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 130 ASN : amide:sc= -0.456 K(o=0.31,f=-0.29) USER MOD Set 1.2: A 133 ASN : amide:sc= 0.762 K(o=0.31,f=-0.64) USER MOD Set 2.1: A 88 ASN : amide:sc= 0.0791 X(o=0.21,f=0.39) USER MOD Set 2.2: A 142 TYR OH : rot 180:sc= 0.131 USER MOD Set 3.1: A 65 LYS NZ :NH3+ 157:sc= 0.794 (180deg=0) USER MOD Set 3.2: A 181 TYR OH : rot 0:sc= 0.705 USER MOD Set 4.1: A 41 LYS NZ :NH3+ 169:sc= 1.94 (180deg=0.861) USER MOD Set 4.2: A 184 ASN : amide:sc= 0.643 K(o=2.6,f=-4.9) USER MOD Set 5.1: A 40 HIS : no HE2:sc= 1.75 K(o=0.4,f=-11!) USER MOD Set 5.2: A 179 HIS : no HE2:sc= -1.36 K(o=0.4,f=-6.8!) USER MOD Single : A 32 THR OG1 : rot -30:sc= 0.13 USER MOD Single : A 33 THR OG1 : rot 145:sc= 0.805 USER MOD Single : A 34 THR OG1 : rot 180:sc= -0.151 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0.0193 USER MOD Single : A 36 SER OG : rot -150:sc= 0 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 169:sc= -0.335 (180deg=-0.592) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= 1.1 K(o=1.1,f=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 ASN : amide:sc= -0.0011 K(o=-0.0011,f=-0.81) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= -0.481 X(o=-0.48,f=0) USER MOD Single : A 72 ASN : amide:sc= -0.0918 K(o=-0.092,f=-2) USER MOD Single : A 74 LYS NZ :NH3+ -162:sc= 0.946 (180deg=0.729) USER MOD Single : A 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot -24:sc= 0.87 USER MOD Single : A 85 ASN : amide:sc= -0.766 K(o=-0.77,f=0) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= 0.986 K(o=0.99,f=-0.44) USER MOD Single : A 94 ASN : amide:sc= -0.0704 X(o=-0.07,f=-0.042) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 ASN : amide:sc= -0.324 X(o=-0.32,f=-0.076) USER MOD Single : A 105 GLN : amide:sc= -0.0331 X(o=-0.033,f=-0.17) USER MOD Single : A 106 THR OG1 : rot 180:sc= -0.514 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 170:sc= 0.699 USER MOD Single : A 113 MET CE :methyl 168:sc= -0.126 (180deg=-0.337) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 MET CE :methyl -150:sc= -0.771 (180deg=-2.17!) USER MOD Single : A 119 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0331) USER MOD Single : A 120 LYS NZ :NH3+ -178:sc= 0.992 (180deg=0.989) USER MOD Single : A 122 THR OG1 : rot 175:sc= -0.545 USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 THR OG1 : rot 180:sc=0.000518 USER MOD Single : A 138 LYS NZ :NH3+ -177:sc= 1.26 (180deg=1.14) USER MOD Single : A 139 TYR OH : rot 15:sc= 1.06 USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 HIS : no HD1:sc= -0.0317 X(o=-0.032,f=-0.18) USER MOD Single : A 146 SER OG : rot 180:sc= -0.0368 USER MOD Single : A 162 LYS NZ :NH3+ -130:sc= 0.617 (180deg=0.00541) USER MOD Single : A 173 ASN : amide:sc= 0.619 K(o=0.62,f=-4.5!) USER MOD Single : A 183 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 185 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 167 N THR A 32 -0.404 -20.127 -2.230 1.00 1.12 N ATOM 168 CA THR A 32 0.502 -18.976 -2.326 1.00 0.93 C ATOM 169 C THR A 32 1.987 -19.312 -2.490 1.00 0.96 C ATOM 170 O THR A 32 2.494 -20.286 -1.927 1.00 1.13 O ATOM 171 CB THR A 32 0.272 -18.008 -1.152 1.00 0.87 C ATOM 172 OG1 THR A 32 0.266 -18.662 0.102 1.00 1.09 O ATOM 173 CG2 THR A 32 -1.086 -17.330 -1.313 1.00 0.86 C ATOM 0 HA THR A 32 0.238 -18.489 -3.264 1.00 0.93 H new ATOM 0 HB THR A 32 1.094 -17.293 -1.172 1.00 0.87 H new ATOM 0 HG1 THR A 32 -0.066 -19.578 -0.008 1.00 1.09 H new ATOM 0 HG21 THR A 32 -1.251 -16.644 -0.482 1.00 0.86 H new ATOM 0 HG22 THR A 32 -1.107 -16.776 -2.251 1.00 0.86 H new ATOM 0 HG23 THR A 32 -1.871 -18.086 -1.321 1.00 0.86 H new ATOM 181 N THR A 33 2.709 -18.477 -3.251 1.00 0.89 N ATOM 182 CA THR A 33 4.136 -18.688 -3.584 1.00 0.94 C ATOM 183 C THR A 33 5.123 -18.080 -2.577 1.00 0.95 C ATOM 184 O THR A 33 6.307 -18.431 -2.584 1.00 1.18 O ATOM 185 CB THR A 33 4.473 -18.193 -5.000 1.00 1.04 C ATOM 186 OG1 THR A 33 4.374 -16.791 -5.087 1.00 1.45 O ATOM 187 CG2 THR A 33 3.562 -18.796 -6.074 1.00 1.14 C ATOM 0 H THR A 33 2.321 -17.627 -3.659 1.00 0.89 H new ATOM 0 HA THR A 33 4.264 -19.769 -3.533 1.00 0.94 H new ATOM 0 HB THR A 33 5.497 -18.517 -5.183 1.00 1.04 H new ATOM 0 HG1 THR A 33 5.058 -16.452 -5.702 1.00 1.45 H new ATOM 0 HG21 THR A 33 3.848 -18.410 -7.052 1.00 1.14 H new ATOM 0 HG22 THR A 33 3.663 -19.881 -6.069 1.00 1.14 H new ATOM 0 HG23 THR A 33 2.527 -18.527 -5.866 1.00 1.14 H new ATOM 195 N THR A 34 4.642 -17.193 -1.698 1.00 0.88 N ATOM 196 CA THR A 34 5.364 -16.620 -0.548 1.00 0.96 C ATOM 197 C THR A 34 4.412 -16.337 0.627 1.00 0.83 C ATOM 198 O THR A 34 3.189 -16.337 0.464 1.00 0.87 O ATOM 199 CB THR A 34 6.185 -15.376 -0.949 1.00 1.29 C ATOM 200 OG1 THR A 34 6.870 -14.880 0.180 1.00 2.36 O ATOM 201 CG2 THR A 34 5.343 -14.235 -1.519 1.00 0.82 C ATOM 0 H THR A 34 3.690 -16.835 -1.770 1.00 0.88 H new ATOM 0 HA THR A 34 6.080 -17.367 -0.205 1.00 0.96 H new ATOM 0 HB THR A 34 6.866 -15.709 -1.732 1.00 1.29 H new ATOM 0 HG1 THR A 34 7.393 -14.091 -0.075 1.00 2.36 H new ATOM 0 HG21 THR A 34 5.992 -13.398 -1.777 1.00 0.82 H new ATOM 0 HG22 THR A 34 4.822 -14.579 -2.413 1.00 0.82 H new ATOM 0 HG23 THR A 34 4.614 -13.914 -0.775 1.00 0.82 H new ATOM 209 N THR A 35 4.971 -16.106 1.817 1.00 0.78 N ATOM 210 CA THR A 35 4.294 -15.865 3.108 1.00 0.73 C ATOM 211 C THR A 35 4.286 -14.398 3.569 1.00 0.64 C ATOM 212 O THR A 35 3.731 -14.095 4.628 1.00 0.63 O ATOM 213 CB THR A 35 4.904 -16.758 4.208 1.00 0.86 C ATOM 214 OG1 THR A 35 6.301 -16.946 4.017 1.00 0.95 O ATOM 215 CG2 THR A 35 4.256 -18.136 4.199 1.00 1.02 C ATOM 0 H THR A 35 5.986 -16.079 1.919 1.00 0.78 H new ATOM 0 HA THR A 35 3.250 -16.126 2.937 1.00 0.73 H new ATOM 0 HB THR A 35 4.725 -16.249 5.155 1.00 0.86 H new ATOM 0 HG1 THR A 35 6.655 -17.515 4.732 1.00 0.95 H new ATOM 0 HG21 THR A 35 4.699 -18.752 4.982 1.00 1.02 H new ATOM 0 HG22 THR A 35 3.186 -18.036 4.379 1.00 1.02 H new ATOM 0 HG23 THR A 35 4.419 -18.608 3.230 1.00 1.02 H new ATOM 223 N SER A 36 4.870 -13.470 2.805 1.00 0.61 N ATOM 224 CA SER A 36 4.858 -12.029 3.089 1.00 0.55 C ATOM 225 C SER A 36 4.895 -11.159 1.824 1.00 0.56 C ATOM 226 O SER A 36 5.200 -11.632 0.728 1.00 0.66 O ATOM 227 CB SER A 36 6.005 -11.667 4.040 1.00 0.66 C ATOM 228 OG SER A 36 7.264 -11.950 3.471 1.00 1.73 O ATOM 0 H SER A 36 5.377 -13.704 1.951 1.00 0.61 H new ATOM 0 HA SER A 36 3.906 -11.811 3.573 1.00 0.55 H new ATOM 0 HB2 SER A 36 5.949 -10.608 4.291 1.00 0.66 H new ATOM 0 HB3 SER A 36 5.894 -12.222 4.972 1.00 0.66 H new ATOM 0 HG SER A 36 7.902 -12.172 4.181 1.00 1.73 H new ATOM 234 N VAL A 37 4.586 -9.872 1.986 1.00 0.53 N ATOM 235 CA VAL A 37 4.564 -8.818 0.955 1.00 0.52 C ATOM 236 C VAL A 37 5.322 -7.584 1.459 1.00 0.53 C ATOM 237 O VAL A 37 5.136 -7.187 2.611 1.00 0.46 O ATOM 238 CB VAL A 37 3.118 -8.499 0.529 1.00 0.51 C ATOM 239 CG1 VAL A 37 2.274 -7.979 1.683 1.00 0.51 C ATOM 240 CG2 VAL A 37 3.026 -7.497 -0.628 1.00 0.51 C ATOM 0 H VAL A 37 4.326 -9.507 2.902 1.00 0.53 H new ATOM 0 HA VAL A 37 5.075 -9.172 0.060 1.00 0.52 H new ATOM 0 HB VAL A 37 2.725 -9.457 0.188 1.00 0.51 H new ATOM 0 HG11 VAL A 37 1.264 -7.769 1.330 1.00 0.51 H new ATOM 0 HG12 VAL A 37 2.234 -8.730 2.472 1.00 0.51 H new ATOM 0 HG13 VAL A 37 2.718 -7.064 2.075 1.00 0.51 H new ATOM 0 HG21 VAL A 37 1.979 -7.320 -0.874 1.00 0.51 H new ATOM 0 HG22 VAL A 37 3.493 -6.557 -0.333 1.00 0.51 H new ATOM 0 HG23 VAL A 37 3.541 -7.900 -1.500 1.00 0.51 H new ATOM 250 N THR A 38 6.157 -6.958 0.623 1.00 0.65 N ATOM 251 CA THR A 38 6.840 -5.696 0.972 1.00 0.62 C ATOM 252 C THR A 38 6.194 -4.510 0.249 1.00 0.59 C ATOM 253 O THR A 38 6.212 -4.411 -0.977 1.00 0.60 O ATOM 254 CB THR A 38 8.360 -5.745 0.744 1.00 0.68 C ATOM 255 OG1 THR A 38 8.939 -6.874 1.370 1.00 0.88 O ATOM 256 CG2 THR A 38 9.056 -4.531 1.361 1.00 0.61 C ATOM 0 H THR A 38 6.381 -7.304 -0.310 1.00 0.65 H new ATOM 0 HA THR A 38 6.709 -5.555 2.045 1.00 0.62 H new ATOM 0 HB THR A 38 8.495 -5.775 -0.337 1.00 0.68 H new ATOM 0 HG1 THR A 38 9.905 -6.879 1.206 1.00 0.88 H new ATOM 0 HG21 THR A 38 10.129 -4.597 1.182 1.00 0.61 H new ATOM 0 HG22 THR A 38 8.668 -3.619 0.907 1.00 0.61 H new ATOM 0 HG23 THR A 38 8.868 -4.510 2.434 1.00 0.61 H new ATOM 264 N VAL A 39 5.600 -3.596 1.014 1.00 0.60 N ATOM 265 CA VAL A 39 4.942 -2.377 0.524 1.00 0.60 C ATOM 266 C VAL A 39 5.907 -1.188 0.578 1.00 0.59 C ATOM 267 O VAL A 39 6.621 -0.983 1.562 1.00 0.63 O ATOM 268 CB VAL A 39 3.592 -2.142 1.239 1.00 0.69 C ATOM 269 CG1 VAL A 39 3.646 -2.376 2.747 1.00 0.83 C ATOM 270 CG2 VAL A 39 2.990 -0.758 0.972 1.00 0.75 C ATOM 0 H VAL A 39 5.560 -3.683 2.029 1.00 0.60 H new ATOM 0 HA VAL A 39 4.684 -2.501 -0.528 1.00 0.60 H new ATOM 0 HB VAL A 39 2.941 -2.896 0.797 1.00 0.69 H new ATOM 0 HG11 VAL A 39 2.662 -2.192 3.179 1.00 0.83 H new ATOM 0 HG12 VAL A 39 3.942 -3.406 2.945 1.00 0.83 H new ATOM 0 HG13 VAL A 39 4.372 -1.697 3.195 1.00 0.83 H new ATOM 0 HG21 VAL A 39 2.044 -0.664 1.505 1.00 0.75 H new ATOM 0 HG22 VAL A 39 3.680 0.012 1.318 1.00 0.75 H new ATOM 0 HG23 VAL A 39 2.817 -0.636 -0.097 1.00 0.75 H new ATOM 280 N HIS A 40 5.927 -0.422 -0.508 1.00 0.55 N ATOM 281 CA HIS A 40 6.754 0.775 -0.721 1.00 0.57 C ATOM 282 C HIS A 40 5.848 2.021 -0.895 1.00 0.85 C ATOM 283 O HIS A 40 4.626 1.885 -0.853 1.00 1.84 O ATOM 284 CB HIS A 40 7.667 0.502 -1.934 1.00 0.55 C ATOM 285 CG HIS A 40 8.490 -0.770 -1.821 1.00 0.46 C ATOM 286 ND1 HIS A 40 9.706 -0.896 -1.188 1.00 0.56 N ATOM 287 CD2 HIS A 40 8.171 -2.015 -2.311 1.00 0.45 C ATOM 288 CE1 HIS A 40 10.108 -2.172 -1.290 1.00 0.56 C ATOM 289 NE2 HIS A 40 9.214 -2.897 -1.985 1.00 0.53 N ATOM 0 H HIS A 40 5.335 -0.626 -1.313 1.00 0.55 H new ATOM 0 HA HIS A 40 7.388 0.989 0.140 1.00 0.57 H new ATOM 0 HB2 HIS A 40 7.052 0.445 -2.832 1.00 0.55 H new ATOM 0 HB3 HIS A 40 8.342 1.348 -2.064 1.00 0.55 H new ATOM 0 HD1 HIS A 40 10.215 -0.146 -0.720 1.00 0.56 H new ATOM 0 HD2 HIS A 40 7.273 -2.270 -2.853 1.00 0.45 H new ATOM 0 HE1 HIS A 40 11.024 -2.563 -0.871 1.00 0.56 H new ATOM 297 N LYS A 41 6.393 3.237 -1.085 1.00 0.36 N ATOM 298 CA LYS A 41 5.606 4.443 -1.444 1.00 0.39 C ATOM 299 C LYS A 41 6.345 5.383 -2.405 1.00 0.41 C ATOM 300 O LYS A 41 7.479 5.780 -2.129 1.00 0.47 O ATOM 301 CB LYS A 41 5.160 5.183 -0.164 1.00 0.50 C ATOM 302 CG LYS A 41 3.927 6.093 -0.399 1.00 0.84 C ATOM 303 CD LYS A 41 4.271 7.549 -0.767 1.00 0.87 C ATOM 304 CE LYS A 41 3.323 8.180 -1.804 1.00 0.72 C ATOM 305 NZ LYS A 41 2.091 8.754 -1.222 1.00 1.01 N ATOM 0 H LYS A 41 7.393 3.417 -0.995 1.00 0.36 H new ATOM 0 HA LYS A 41 4.724 4.102 -1.986 1.00 0.39 H new ATOM 0 HB2 LYS A 41 4.925 4.452 0.610 1.00 0.50 H new ATOM 0 HB3 LYS A 41 5.987 5.787 0.208 1.00 0.50 H new ATOM 0 HG2 LYS A 41 3.320 5.663 -1.196 1.00 0.84 H new ATOM 0 HG3 LYS A 41 3.314 6.094 0.503 1.00 0.84 H new ATOM 0 HD2 LYS A 41 4.254 8.154 0.139 1.00 0.87 H new ATOM 0 HD3 LYS A 41 5.289 7.583 -1.154 1.00 0.87 H new ATOM 0 HE2 LYS A 41 3.858 8.963 -2.341 1.00 0.72 H new ATOM 0 HE3 LYS A 41 3.047 7.422 -2.537 1.00 0.72 H new ATOM 0 HZ1 LYS A 41 1.597 9.318 -1.942 1.00 1.01 H new ATOM 0 HZ2 LYS A 41 1.469 7.986 -0.898 1.00 1.01 H new ATOM 0 HZ3 LYS A 41 2.339 9.362 -0.416 1.00 1.01 H new ATOM 319 N LEU A 42 5.687 5.779 -3.504 1.00 0.45 N ATOM 320 CA LEU A 42 6.272 6.610 -4.571 1.00 0.47 C ATOM 321 C LEU A 42 5.620 7.995 -4.708 1.00 0.48 C ATOM 322 O LEU A 42 4.417 8.146 -4.513 1.00 0.49 O ATOM 323 CB LEU A 42 6.186 5.878 -5.923 1.00 0.49 C ATOM 324 CG LEU A 42 6.833 4.491 -6.002 1.00 0.49 C ATOM 325 CD1 LEU A 42 6.909 4.074 -7.470 1.00 0.56 C ATOM 326 CD2 LEU A 42 8.253 4.445 -5.453 1.00 0.50 C ATOM 0 H LEU A 42 4.715 5.527 -3.681 1.00 0.45 H new ATOM 0 HA LEU A 42 7.311 6.774 -4.283 1.00 0.47 H new ATOM 0 HB2 LEU A 42 5.134 5.777 -6.188 1.00 0.49 H new ATOM 0 HB3 LEU A 42 6.646 6.511 -6.682 1.00 0.49 H new ATOM 0 HG LEU A 42 6.216 3.827 -5.397 1.00 0.49 H new ATOM 0 HD11 LEU A 42 7.367 3.088 -7.545 1.00 0.56 H new ATOM 0 HD12 LEU A 42 5.904 4.040 -7.891 1.00 0.56 H new ATOM 0 HD13 LEU A 42 7.510 4.796 -8.023 1.00 0.56 H new ATOM 0 HD21 LEU A 42 8.645 3.432 -5.542 1.00 0.50 H new ATOM 0 HD22 LEU A 42 8.884 5.130 -6.019 1.00 0.50 H new ATOM 0 HD23 LEU A 42 8.247 4.740 -4.404 1.00 0.50 H new ATOM 338 N LEU A 43 6.420 8.982 -5.115 1.00 0.55 N ATOM 339 CA LEU A 43 6.023 10.334 -5.531 1.00 0.55 C ATOM 340 C LEU A 43 6.790 10.740 -6.809 1.00 0.54 C ATOM 341 O LEU A 43 7.641 9.994 -7.301 1.00 0.51 O ATOM 342 CB LEU A 43 6.262 11.335 -4.378 1.00 0.67 C ATOM 343 CG LEU A 43 5.322 11.212 -3.164 1.00 0.87 C ATOM 344 CD1 LEU A 43 5.631 12.327 -2.164 1.00 1.99 C ATOM 345 CD2 LEU A 43 3.845 11.355 -3.527 1.00 0.84 C ATOM 0 H LEU A 43 7.430 8.852 -5.167 1.00 0.55 H new ATOM 0 HA LEU A 43 4.958 10.345 -5.764 1.00 0.55 H new ATOM 0 HB2 LEU A 43 7.288 11.218 -4.030 1.00 0.67 H new ATOM 0 HB3 LEU A 43 6.175 12.345 -4.778 1.00 0.67 H new ATOM 0 HG LEU A 43 5.492 10.217 -2.754 1.00 0.87 H new ATOM 0 HD11 LEU A 43 4.966 12.240 -1.305 1.00 1.99 H new ATOM 0 HD12 LEU A 43 6.666 12.241 -1.832 1.00 1.99 H new ATOM 0 HD13 LEU A 43 5.482 13.295 -2.641 1.00 1.99 H new ATOM 0 HD21 LEU A 43 3.238 11.258 -2.627 1.00 0.84 H new ATOM 0 HD22 LEU A 43 3.674 12.333 -3.977 1.00 0.84 H new ATOM 0 HD23 LEU A 43 3.568 10.576 -4.237 1.00 0.84 H new ATOM 357 N ALA A 44 6.497 11.924 -7.350 1.00 0.66 N ATOM 358 CA ALA A 44 7.144 12.484 -8.538 1.00 0.62 C ATOM 359 C ALA A 44 8.010 13.722 -8.213 1.00 0.67 C ATOM 360 O ALA A 44 7.917 14.288 -7.120 1.00 0.81 O ATOM 361 CB ALA A 44 6.042 12.783 -9.558 1.00 0.62 C ATOM 0 H ALA A 44 5.781 12.538 -6.962 1.00 0.66 H new ATOM 0 HA ALA A 44 7.849 11.764 -8.955 1.00 0.62 H new ATOM 0 HB1 ALA A 44 6.486 13.203 -10.461 1.00 0.62 H new ATOM 0 HB2 ALA A 44 5.517 11.861 -9.807 1.00 0.62 H new ATOM 0 HB3 ALA A 44 5.337 13.498 -9.133 1.00 0.62 H new ATOM 367 N THR A 45 8.862 14.170 -9.141 1.00 0.67 N ATOM 368 CA THR A 45 9.709 15.365 -8.939 1.00 0.73 C ATOM 369 C THR A 45 9.003 16.676 -9.298 1.00 0.80 C ATOM 370 O THR A 45 9.209 17.678 -8.610 1.00 0.92 O ATOM 371 CB THR A 45 11.061 15.248 -9.660 1.00 0.75 C ATOM 372 OG1 THR A 45 10.901 15.011 -11.039 1.00 0.76 O ATOM 373 CG2 THR A 45 11.905 14.111 -9.082 1.00 0.81 C ATOM 0 H THR A 45 8.988 13.723 -10.049 1.00 0.67 H new ATOM 0 HA THR A 45 9.905 15.401 -7.867 1.00 0.73 H new ATOM 0 HB THR A 45 11.565 16.202 -9.509 1.00 0.75 H new ATOM 0 HG1 THR A 45 11.782 14.944 -11.464 1.00 0.76 H new ATOM 0 HG21 THR A 45 12.855 14.056 -9.614 1.00 0.81 H new ATOM 0 HG22 THR A 45 12.092 14.298 -8.025 1.00 0.81 H new ATOM 0 HG23 THR A 45 11.371 13.168 -9.194 1.00 0.81 H new ATOM 381 N ASP A 46 8.109 16.692 -10.290 1.00 0.80 N ATOM 382 CA ASP A 46 7.380 17.887 -10.756 1.00 0.95 C ATOM 383 C ASP A 46 5.861 17.654 -10.941 1.00 1.10 C ATOM 384 O ASP A 46 5.163 18.442 -11.585 1.00 1.63 O ATOM 385 CB ASP A 46 8.065 18.396 -12.035 1.00 0.95 C ATOM 386 CG ASP A 46 7.708 19.842 -12.366 1.00 1.25 C ATOM 387 OD1 ASP A 46 7.930 20.737 -11.519 1.00 2.49 O ATOM 388 OD2 ASP A 46 7.271 20.121 -13.509 1.00 1.60 O ATOM 0 H ASP A 46 7.861 15.851 -10.811 1.00 0.80 H new ATOM 0 HA ASP A 46 7.431 18.653 -9.982 1.00 0.95 H new ATOM 0 HB2 ASP A 46 9.146 18.311 -11.920 1.00 0.95 H new ATOM 0 HB3 ASP A 46 7.782 17.757 -12.871 1.00 0.95 H new ATOM 393 N GLY A 47 5.324 16.563 -10.385 1.00 0.87 N ATOM 394 CA GLY A 47 3.936 16.123 -10.590 1.00 0.88 C ATOM 395 C GLY A 47 3.765 15.191 -11.795 1.00 0.84 C ATOM 396 O GLY A 47 2.759 15.244 -12.496 1.00 1.13 O ATOM 0 H GLY A 47 5.852 15.947 -9.767 1.00 0.87 H new ATOM 0 HA2 GLY A 47 3.588 15.612 -9.692 1.00 0.88 H new ATOM 0 HA3 GLY A 47 3.301 16.999 -10.724 1.00 0.88 H new ATOM 400 N ASP A 48 4.763 14.348 -12.054 1.00 0.71 N ATOM 401 CA ASP A 48 4.860 13.368 -13.148 1.00 0.69 C ATOM 402 C ASP A 48 4.078 12.060 -12.910 1.00 0.66 C ATOM 403 O ASP A 48 4.276 11.085 -13.636 1.00 0.68 O ATOM 404 CB ASP A 48 6.340 13.030 -13.388 1.00 0.68 C ATOM 405 CG ASP A 48 7.246 14.255 -13.342 1.00 0.90 C ATOM 406 OD1 ASP A 48 7.589 14.700 -12.226 1.00 2.04 O ATOM 407 OD2 ASP A 48 7.613 14.775 -14.421 1.00 1.51 O ATOM 0 H ASP A 48 5.593 14.326 -11.461 1.00 0.71 H new ATOM 0 HA ASP A 48 4.402 13.840 -14.018 1.00 0.69 H new ATOM 0 HB2 ASP A 48 6.670 12.313 -12.636 1.00 0.68 H new ATOM 0 HB3 ASP A 48 6.443 12.545 -14.359 1.00 0.68 H new ATOM 412 N MET A 49 3.194 11.998 -11.905 1.00 0.68 N ATOM 413 CA MET A 49 2.525 10.745 -11.510 1.00 0.66 C ATOM 414 C MET A 49 1.685 10.125 -12.644 1.00 0.75 C ATOM 415 O MET A 49 1.427 8.924 -12.639 1.00 0.79 O ATOM 416 CB MET A 49 1.666 10.960 -10.252 1.00 0.70 C ATOM 417 CG MET A 49 2.437 11.350 -8.981 1.00 0.64 C ATOM 418 SD MET A 49 2.910 9.994 -7.858 1.00 0.54 S ATOM 419 CE MET A 49 4.039 8.995 -8.857 1.00 0.47 C ATOM 0 H MET A 49 2.922 12.806 -11.345 1.00 0.68 H new ATOM 0 HA MET A 49 3.316 10.030 -11.284 1.00 0.66 H new ATOM 0 HB2 MET A 49 0.932 11.738 -10.463 1.00 0.70 H new ATOM 0 HB3 MET A 49 1.111 10.044 -10.052 1.00 0.70 H new ATOM 0 HG2 MET A 49 3.344 11.874 -9.281 1.00 0.64 H new ATOM 0 HG3 MET A 49 1.830 12.060 -8.420 1.00 0.64 H new ATOM 0 HE1 MET A 49 4.536 8.262 -8.221 1.00 0.47 H new ATOM 0 HE2 MET A 49 3.477 8.478 -9.635 1.00 0.47 H new ATOM 0 HE3 MET A 49 4.786 9.641 -9.318 1.00 0.47 H new ATOM 429 N ASP A 50 1.309 10.919 -13.648 1.00 0.83 N ATOM 430 CA ASP A 50 0.641 10.492 -14.882 1.00 0.95 C ATOM 431 C ASP A 50 1.507 9.549 -15.742 1.00 0.83 C ATOM 432 O ASP A 50 1.099 8.422 -16.034 1.00 0.88 O ATOM 433 CB ASP A 50 0.259 11.743 -15.689 1.00 1.21 C ATOM 434 CG ASP A 50 -0.586 12.727 -14.878 1.00 1.63 C ATOM 435 OD1 ASP A 50 -0.017 13.548 -14.122 1.00 2.90 O ATOM 436 OD2 ASP A 50 -1.833 12.691 -14.977 1.00 1.74 O ATOM 0 H ASP A 50 1.469 11.926 -13.623 1.00 0.83 H new ATOM 0 HA ASP A 50 -0.246 9.922 -14.604 1.00 0.95 H new ATOM 0 HB2 ASP A 50 1.166 12.243 -16.030 1.00 1.21 H new ATOM 0 HB3 ASP A 50 -0.293 11.443 -16.579 1.00 1.21 H new ATOM 441 N LYS A 51 2.726 9.968 -16.123 1.00 0.73 N ATOM 442 CA LYS A 51 3.618 9.156 -16.965 1.00 0.66 C ATOM 443 C LYS A 51 4.190 7.966 -16.198 1.00 0.60 C ATOM 444 O LYS A 51 4.166 6.853 -16.715 1.00 0.65 O ATOM 445 CB LYS A 51 4.676 10.005 -17.694 1.00 0.62 C ATOM 446 CG LYS A 51 5.519 11.004 -16.877 1.00 0.66 C ATOM 447 CD LYS A 51 5.328 12.470 -17.297 1.00 1.18 C ATOM 448 CE LYS A 51 3.914 12.969 -16.992 1.00 3.49 C ATOM 449 NZ LYS A 51 3.713 14.357 -17.452 1.00 4.38 N ATOM 0 H LYS A 51 3.117 10.872 -15.858 1.00 0.73 H new ATOM 0 HA LYS A 51 3.013 8.726 -17.763 1.00 0.66 H new ATOM 0 HB2 LYS A 51 5.364 9.320 -18.189 1.00 0.62 H new ATOM 0 HB3 LYS A 51 4.166 10.566 -18.477 1.00 0.62 H new ATOM 0 HG2 LYS A 51 5.264 10.902 -15.822 1.00 0.66 H new ATOM 0 HG3 LYS A 51 6.572 10.742 -16.977 1.00 0.66 H new ATOM 0 HD2 LYS A 51 6.054 13.095 -16.777 1.00 1.18 H new ATOM 0 HD3 LYS A 51 5.527 12.571 -18.364 1.00 1.18 H new ATOM 0 HE2 LYS A 51 3.186 12.317 -17.475 1.00 3.49 H new ATOM 0 HE3 LYS A 51 3.731 12.911 -15.919 1.00 3.49 H new ATOM 0 HZ1 LYS A 51 2.744 14.660 -17.228 1.00 4.38 H new ATOM 0 HZ2 LYS A 51 4.391 14.983 -16.973 1.00 4.38 H new ATOM 0 HZ3 LYS A 51 3.862 14.407 -18.480 1.00 4.38 H new ATOM 463 N ILE A 52 4.536 8.158 -14.925 1.00 0.56 N ATOM 464 CA ILE A 52 4.887 7.082 -13.991 1.00 0.56 C ATOM 465 C ILE A 52 3.785 6.010 -13.949 1.00 0.64 C ATOM 466 O ILE A 52 4.082 4.837 -14.159 1.00 0.67 O ATOM 467 CB ILE A 52 5.192 7.671 -12.593 1.00 0.55 C ATOM 468 CG1 ILE A 52 6.451 8.563 -12.689 1.00 0.51 C ATOM 469 CG2 ILE A 52 5.398 6.552 -11.549 1.00 0.58 C ATOM 470 CD1 ILE A 52 6.840 9.317 -11.421 1.00 0.50 C ATOM 0 H ILE A 52 4.582 9.085 -14.503 1.00 0.56 H new ATOM 0 HA ILE A 52 5.791 6.585 -14.342 1.00 0.56 H new ATOM 0 HB ILE A 52 4.342 8.269 -12.265 1.00 0.55 H new ATOM 0 HG12 ILE A 52 7.292 7.937 -12.987 1.00 0.51 H new ATOM 0 HG13 ILE A 52 6.296 9.290 -13.486 1.00 0.51 H new ATOM 0 HG21 ILE A 52 5.611 6.996 -10.577 1.00 0.58 H new ATOM 0 HG22 ILE A 52 4.494 5.947 -11.481 1.00 0.58 H new ATOM 0 HG23 ILE A 52 6.235 5.922 -11.851 1.00 0.58 H new ATOM 0 HD11 ILE A 52 7.736 9.908 -11.610 1.00 0.50 H new ATOM 0 HD12 ILE A 52 6.025 9.978 -11.126 1.00 0.50 H new ATOM 0 HD13 ILE A 52 7.037 8.605 -10.620 1.00 0.50 H new ATOM 482 N ALA A 53 2.510 6.373 -13.767 1.00 0.71 N ATOM 483 CA ALA A 53 1.422 5.391 -13.767 1.00 0.80 C ATOM 484 C ALA A 53 1.296 4.632 -15.103 1.00 0.86 C ATOM 485 O ALA A 53 0.997 3.434 -15.089 1.00 0.92 O ATOM 486 CB ALA A 53 0.115 6.091 -13.385 1.00 0.88 C ATOM 0 H ALA A 53 2.208 7.336 -13.618 1.00 0.71 H new ATOM 0 HA ALA A 53 1.654 4.627 -13.025 1.00 0.80 H new ATOM 0 HB1 ALA A 53 -0.699 5.366 -13.383 1.00 0.88 H new ATOM 0 HB2 ALA A 53 0.214 6.529 -12.392 1.00 0.88 H new ATOM 0 HB3 ALA A 53 -0.101 6.877 -14.108 1.00 0.88 H new ATOM 492 N ASN A 54 1.607 5.273 -16.236 1.00 0.87 N ATOM 493 CA ASN A 54 1.631 4.613 -17.545 1.00 0.96 C ATOM 494 C ASN A 54 2.805 3.624 -17.700 1.00 0.94 C ATOM 495 O ASN A 54 2.641 2.581 -18.336 1.00 1.10 O ATOM 496 CB ASN A 54 1.629 5.652 -18.673 1.00 0.93 C ATOM 497 CG ASN A 54 0.247 6.210 -18.939 1.00 1.12 C ATOM 498 OD1 ASN A 54 -0.408 5.856 -19.909 1.00 1.30 O ATOM 499 ND2 ASN A 54 -0.244 7.101 -18.116 1.00 1.15 N ATOM 0 H ASN A 54 1.849 6.263 -16.270 1.00 0.87 H new ATOM 0 HA ASN A 54 0.721 4.017 -17.615 1.00 0.96 H new ATOM 0 HB2 ASN A 54 2.304 6.468 -18.414 1.00 0.93 H new ATOM 0 HB3 ASN A 54 2.016 5.196 -19.584 1.00 0.93 H new ATOM 0 HD21 ASN A 54 -1.169 7.497 -18.285 1.00 1.15 H new ATOM 0 HD22 ASN A 54 0.298 7.400 -17.305 1.00 1.15 H new ATOM 506 N GLU A 55 3.967 3.909 -17.106 1.00 0.81 N ATOM 507 CA GLU A 55 5.095 2.966 -17.041 1.00 0.87 C ATOM 508 C GLU A 55 4.796 1.749 -16.151 1.00 0.98 C ATOM 509 O GLU A 55 5.339 0.666 -16.382 1.00 1.18 O ATOM 510 CB GLU A 55 6.357 3.670 -16.529 1.00 0.79 C ATOM 511 CG GLU A 55 6.894 4.734 -17.494 1.00 0.79 C ATOM 512 CD GLU A 55 7.255 4.165 -18.874 1.00 0.90 C ATOM 513 OE1 GLU A 55 8.313 3.504 -19.013 1.00 1.81 O ATOM 514 OE2 GLU A 55 6.518 4.394 -19.865 1.00 1.95 O ATOM 0 H GLU A 55 4.156 4.803 -16.654 1.00 0.81 H new ATOM 0 HA GLU A 55 5.256 2.606 -18.057 1.00 0.87 H new ATOM 0 HB2 GLU A 55 6.139 4.138 -15.569 1.00 0.79 H new ATOM 0 HB3 GLU A 55 7.133 2.925 -16.352 1.00 0.79 H new ATOM 0 HG2 GLU A 55 6.146 5.518 -17.615 1.00 0.79 H new ATOM 0 HG3 GLU A 55 7.777 5.200 -17.057 1.00 0.79 H new ATOM 521 N LEU A 56 3.928 1.894 -15.144 1.00 0.91 N ATOM 522 CA LEU A 56 3.545 0.789 -14.260 1.00 0.99 C ATOM 523 C LEU A 56 2.389 -0.064 -14.795 1.00 1.13 C ATOM 524 O LEU A 56 2.422 -1.282 -14.629 1.00 1.25 O ATOM 525 CB LEU A 56 3.268 1.299 -12.842 1.00 0.90 C ATOM 526 CG LEU A 56 4.421 2.080 -12.183 1.00 0.77 C ATOM 527 CD1 LEU A 56 4.075 2.262 -10.719 1.00 0.77 C ATOM 528 CD2 LEU A 56 5.808 1.436 -12.260 1.00 0.80 C ATOM 0 H LEU A 56 3.472 2.779 -14.920 1.00 0.91 H new ATOM 0 HA LEU A 56 4.401 0.115 -14.226 1.00 0.99 H new ATOM 0 HB2 LEU A 56 2.387 1.940 -12.871 1.00 0.90 H new ATOM 0 HB3 LEU A 56 3.021 0.446 -12.209 1.00 0.90 H new ATOM 0 HG LEU A 56 4.503 3.010 -12.745 1.00 0.77 H new ATOM 0 HD11 LEU A 56 4.874 2.813 -10.222 1.00 0.77 H new ATOM 0 HD12 LEU A 56 3.142 2.818 -10.632 1.00 0.77 H new ATOM 0 HD13 LEU A 56 3.960 1.286 -10.248 1.00 0.77 H new ATOM 0 HD21 LEU A 56 6.535 2.078 -11.763 1.00 0.80 H new ATOM 0 HD22 LEU A 56 5.785 0.464 -11.768 1.00 0.80 H new ATOM 0 HD23 LEU A 56 6.092 1.308 -13.304 1.00 0.80 H new ATOM 540 N GLU A 57 1.398 0.529 -15.470 1.00 1.14 N ATOM 541 CA GLU A 57 0.260 -0.234 -16.027 1.00 1.28 C ATOM 542 C GLU A 57 0.676 -1.214 -17.146 1.00 1.31 C ATOM 543 O GLU A 57 0.016 -2.235 -17.365 1.00 1.41 O ATOM 544 CB GLU A 57 -0.893 0.694 -16.472 1.00 1.31 C ATOM 545 CG GLU A 57 -0.674 1.371 -17.830 1.00 1.23 C ATOM 546 CD GLU A 57 -1.947 2.021 -18.379 1.00 1.83 C ATOM 547 OE1 GLU A 57 -2.388 3.085 -17.882 1.00 2.86 O ATOM 548 OE2 GLU A 57 -2.493 1.475 -19.367 1.00 2.35 O ATOM 0 H GLU A 57 1.355 1.533 -15.647 1.00 1.14 H new ATOM 0 HA GLU A 57 -0.115 -0.852 -15.211 1.00 1.28 H new ATOM 0 HB2 GLU A 57 -1.815 0.114 -16.514 1.00 1.31 H new ATOM 0 HB3 GLU A 57 -1.036 1.465 -15.714 1.00 1.31 H new ATOM 0 HG2 GLU A 57 0.103 2.129 -17.732 1.00 1.23 H new ATOM 0 HG3 GLU A 57 -0.311 0.633 -18.545 1.00 1.23 H new ATOM 555 N THR A 58 1.788 -0.938 -17.842 1.00 1.25 N ATOM 556 CA THR A 58 2.354 -1.864 -18.838 1.00 1.33 C ATOM 557 C THR A 58 3.099 -3.048 -18.198 1.00 1.35 C ATOM 558 O THR A 58 3.010 -4.156 -18.723 1.00 1.68 O ATOM 559 CB THR A 58 3.186 -1.113 -19.892 1.00 1.35 C ATOM 560 OG1 THR A 58 3.569 -1.981 -20.942 1.00 1.46 O ATOM 561 CG2 THR A 58 4.435 -0.432 -19.349 1.00 1.34 C ATOM 0 H THR A 58 2.318 -0.074 -17.733 1.00 1.25 H new ATOM 0 HA THR A 58 1.517 -2.317 -19.370 1.00 1.33 H new ATOM 0 HB THR A 58 2.524 -0.326 -20.253 1.00 1.35 H new ATOM 0 HG1 THR A 58 4.096 -1.484 -21.602 1.00 1.46 H new ATOM 0 HG21 THR A 58 4.958 0.071 -20.162 1.00 1.34 H new ATOM 0 HG22 THR A 58 4.151 0.299 -18.592 1.00 1.34 H new ATOM 0 HG23 THR A 58 5.092 -1.179 -18.903 1.00 1.34 H new ATOM 569 N GLY A 59 3.765 -2.855 -17.050 1.00 1.14 N ATOM 570 CA GLY A 59 4.454 -3.915 -16.296 1.00 1.14 C ATOM 571 C GLY A 59 3.523 -4.747 -15.401 1.00 1.18 C ATOM 572 O GLY A 59 2.366 -4.380 -15.179 1.00 1.23 O ATOM 0 H GLY A 59 3.842 -1.938 -16.610 1.00 1.14 H new ATOM 0 HA2 GLY A 59 4.956 -4.580 -16.999 1.00 1.14 H new ATOM 0 HA3 GLY A 59 5.228 -3.462 -15.677 1.00 1.14 H new ATOM 576 N ASN A 60 4.004 -5.877 -14.874 1.00 1.22 N ATOM 577 CA ASN A 60 3.181 -6.836 -14.113 1.00 1.29 C ATOM 578 C ASN A 60 3.227 -6.594 -12.591 1.00 1.19 C ATOM 579 O ASN A 60 3.150 -7.528 -11.793 1.00 1.27 O ATOM 580 CB ASN A 60 3.528 -8.284 -14.517 1.00 1.46 C ATOM 581 CG ASN A 60 3.371 -8.579 -15.998 1.00 1.79 C ATOM 582 OD1 ASN A 60 2.848 -7.789 -16.776 1.00 2.09 O ATOM 583 ND2 ASN A 60 3.798 -9.734 -16.442 1.00 2.17 N ATOM 0 H ASN A 60 4.981 -6.158 -14.961 1.00 1.22 H new ATOM 0 HA ASN A 60 2.138 -6.667 -14.382 1.00 1.29 H new ATOM 0 HB2 ASN A 60 4.557 -8.493 -14.225 1.00 1.46 H new ATOM 0 HB3 ASN A 60 2.892 -8.967 -13.954 1.00 1.46 H new ATOM 0 HD21 ASN A 60 3.694 -9.971 -17.429 1.00 2.17 H new ATOM 0 HD22 ASN A 60 4.234 -10.397 -15.801 1.00 2.17 H new ATOM 590 N TYR A 61 3.371 -5.341 -12.161 1.00 1.07 N ATOM 591 CA TYR A 61 3.691 -5.005 -10.769 1.00 0.93 C ATOM 592 C TYR A 61 2.569 -5.239 -9.742 1.00 0.92 C ATOM 593 O TYR A 61 2.758 -4.978 -8.555 1.00 0.86 O ATOM 594 CB TYR A 61 4.321 -3.607 -10.705 1.00 0.87 C ATOM 595 CG TYR A 61 5.363 -3.348 -11.783 1.00 0.90 C ATOM 596 CD1 TYR A 61 6.368 -4.298 -12.062 1.00 1.80 C ATOM 597 CD2 TYR A 61 5.299 -2.164 -12.539 1.00 2.21 C ATOM 598 CE1 TYR A 61 7.281 -4.073 -13.109 1.00 1.85 C ATOM 599 CE2 TYR A 61 6.243 -1.912 -13.552 1.00 2.27 C ATOM 600 CZ TYR A 61 7.222 -2.881 -13.858 1.00 1.13 C ATOM 601 OH TYR A 61 8.104 -2.679 -14.871 1.00 1.35 O ATOM 0 H TYR A 61 3.269 -4.527 -12.767 1.00 1.07 H new ATOM 0 HA TYR A 61 4.430 -5.735 -10.439 1.00 0.93 H new ATOM 0 HB2 TYR A 61 3.532 -2.860 -10.790 1.00 0.87 H new ATOM 0 HB3 TYR A 61 4.784 -3.473 -9.727 1.00 0.87 H new ATOM 0 HD1 TYR A 61 6.437 -5.199 -11.471 1.00 1.80 H new ATOM 0 HD2 TYR A 61 4.520 -1.443 -12.341 1.00 2.21 H new ATOM 0 HE1 TYR A 61 8.030 -4.817 -13.339 1.00 1.85 H new ATOM 0 HE2 TYR A 61 6.218 -0.978 -14.094 1.00 2.27 H new ATOM 0 HH TYR A 61 7.929 -1.810 -15.288 1.00 1.35 H new ATOM 611 N ALA A 62 1.417 -5.780 -10.156 1.00 1.07 N ATOM 612 CA ALA A 62 0.393 -6.294 -9.243 1.00 1.10 C ATOM 613 C ALA A 62 0.912 -7.484 -8.404 1.00 1.01 C ATOM 614 O ALA A 62 0.388 -7.735 -7.315 1.00 1.04 O ATOM 615 CB ALA A 62 -0.828 -6.718 -10.069 1.00 1.29 C ATOM 0 H ALA A 62 1.169 -5.873 -11.141 1.00 1.07 H new ATOM 0 HA ALA A 62 0.122 -5.505 -8.541 1.00 1.10 H new ATOM 0 HB1 ALA A 62 -1.601 -7.104 -9.404 1.00 1.29 H new ATOM 0 HB2 ALA A 62 -1.215 -5.857 -10.615 1.00 1.29 H new ATOM 0 HB3 ALA A 62 -0.537 -7.495 -10.776 1.00 1.29 H new ATOM 621 N GLY A 63 1.936 -8.200 -8.895 1.00 0.96 N ATOM 622 CA GLY A 63 2.679 -9.232 -8.164 1.00 0.88 C ATOM 623 C GLY A 63 4.119 -8.807 -7.845 1.00 0.80 C ATOM 624 O GLY A 63 4.446 -8.479 -6.702 1.00 0.75 O ATOM 0 H GLY A 63 2.280 -8.069 -9.846 1.00 0.96 H new ATOM 0 HA2 GLY A 63 2.157 -9.461 -7.235 1.00 0.88 H new ATOM 0 HA3 GLY A 63 2.697 -10.148 -8.754 1.00 0.88 H new ATOM 628 N ASN A 64 4.981 -8.862 -8.864 1.00 0.87 N ATOM 629 CA ASN A 64 6.435 -8.697 -8.737 1.00 0.84 C ATOM 630 C ASN A 64 6.912 -7.240 -8.542 1.00 0.73 C ATOM 631 O ASN A 64 6.218 -6.284 -8.886 1.00 0.71 O ATOM 632 CB ASN A 64 7.170 -9.479 -9.841 1.00 1.03 C ATOM 633 CG ASN A 64 7.355 -8.662 -11.088 1.00 1.12 C ATOM 634 OD1 ASN A 64 8.463 -8.375 -11.518 1.00 1.48 O ATOM 635 ND2 ASN A 64 6.278 -8.254 -11.697 1.00 1.38 N ATOM 0 H ASN A 64 4.681 -9.027 -9.825 1.00 0.87 H new ATOM 0 HA ASN A 64 6.721 -9.149 -7.787 1.00 0.84 H new ATOM 0 HB2 ASN A 64 8.144 -9.799 -9.470 1.00 1.03 H new ATOM 0 HB3 ASN A 64 6.608 -10.382 -10.080 1.00 1.03 H new ATOM 0 HD21 ASN A 64 6.353 -7.688 -12.543 1.00 1.38 H new ATOM 0 HD22 ASN A 64 5.359 -8.500 -11.328 1.00 1.38 H new ATOM 642 N LYS A 65 8.119 -7.068 -7.983 1.00 0.70 N ATOM 643 CA LYS A 65 8.747 -5.753 -7.755 1.00 0.61 C ATOM 644 C LYS A 65 9.009 -5.015 -9.077 1.00 0.63 C ATOM 645 O LYS A 65 9.312 -5.636 -10.095 1.00 0.70 O ATOM 646 CB LYS A 65 10.039 -5.962 -6.942 1.00 0.68 C ATOM 647 CG LYS A 65 10.635 -4.689 -6.318 1.00 1.96 C ATOM 648 CD LYS A 65 11.958 -4.990 -5.592 1.00 1.99 C ATOM 649 CE LYS A 65 12.646 -3.731 -5.040 1.00 2.10 C ATOM 650 NZ LYS A 65 11.935 -3.151 -3.877 1.00 4.06 N ATOM 0 H LYS A 65 8.697 -7.849 -7.671 1.00 0.70 H new ATOM 0 HA LYS A 65 8.068 -5.116 -7.188 1.00 0.61 H new ATOM 0 HB2 LYS A 65 9.836 -6.677 -6.145 1.00 0.68 H new ATOM 0 HB3 LYS A 65 10.789 -6.414 -7.592 1.00 0.68 H new ATOM 0 HG2 LYS A 65 10.806 -3.945 -7.096 1.00 1.96 H new ATOM 0 HG3 LYS A 65 9.922 -4.257 -5.616 1.00 1.96 H new ATOM 0 HD2 LYS A 65 11.765 -5.680 -4.771 1.00 1.99 H new ATOM 0 HD3 LYS A 65 12.636 -5.494 -6.280 1.00 1.99 H new ATOM 0 HE2 LYS A 65 13.667 -3.978 -4.749 1.00 2.10 H new ATOM 0 HE3 LYS A 65 12.712 -2.983 -5.830 1.00 2.10 H new ATOM 0 HZ1 LYS A 65 12.598 -2.580 -3.315 1.00 4.06 H new ATOM 0 HZ2 LYS A 65 11.156 -2.549 -4.211 1.00 4.06 H new ATOM 0 HZ3 LYS A 65 11.552 -3.917 -3.287 1.00 4.06 H new ATOM 664 N VAL A 66 8.930 -3.681 -9.050 1.00 0.62 N ATOM 665 CA VAL A 66 9.124 -2.820 -10.237 1.00 0.70 C ATOM 666 C VAL A 66 10.488 -3.061 -10.902 1.00 0.89 C ATOM 667 O VAL A 66 11.494 -3.253 -10.211 1.00 1.15 O ATOM 668 CB VAL A 66 8.909 -1.328 -9.909 1.00 0.63 C ATOM 669 CG1 VAL A 66 9.196 -0.410 -11.105 1.00 0.81 C ATOM 670 CG2 VAL A 66 7.450 -1.074 -9.516 1.00 0.54 C ATOM 0 H VAL A 66 8.728 -3.157 -8.199 1.00 0.62 H new ATOM 0 HA VAL A 66 8.358 -3.103 -10.959 1.00 0.70 H new ATOM 0 HB VAL A 66 9.600 -1.104 -9.097 1.00 0.63 H new ATOM 0 HG11 VAL A 66 9.028 0.627 -10.816 1.00 0.81 H new ATOM 0 HG12 VAL A 66 10.232 -0.536 -11.420 1.00 0.81 H new ATOM 0 HG13 VAL A 66 8.532 -0.669 -11.930 1.00 0.81 H new ATOM 0 HG21 VAL A 66 7.313 -0.017 -9.287 1.00 0.54 H new ATOM 0 HG22 VAL A 66 6.797 -1.354 -10.342 1.00 0.54 H new ATOM 0 HG23 VAL A 66 7.201 -1.670 -8.638 1.00 0.54 H new ATOM 680 N GLY A 67 10.529 -3.063 -12.240 1.00 0.98 N ATOM 681 CA GLY A 67 11.735 -3.329 -13.032 1.00 1.21 C ATOM 682 C GLY A 67 12.831 -2.280 -12.818 1.00 0.91 C ATOM 683 O GLY A 67 13.881 -2.603 -12.258 1.00 1.10 O ATOM 0 H GLY A 67 9.707 -2.876 -12.814 1.00 0.98 H new ATOM 0 HA2 GLY A 67 12.125 -4.313 -12.772 1.00 1.21 H new ATOM 0 HA3 GLY A 67 11.470 -3.360 -14.089 1.00 1.21 H new ATOM 687 N VAL A 68 12.565 -1.041 -13.246 1.00 0.73 N ATOM 688 CA VAL A 68 13.399 0.165 -13.053 1.00 0.78 C ATOM 689 C VAL A 68 12.497 1.409 -12.969 1.00 0.65 C ATOM 690 O VAL A 68 11.714 1.671 -13.890 1.00 0.79 O ATOM 691 CB VAL A 68 14.412 0.359 -14.208 1.00 1.17 C ATOM 692 CG1 VAL A 68 15.335 1.551 -13.931 1.00 2.02 C ATOM 693 CG2 VAL A 68 15.323 -0.853 -14.440 1.00 1.86 C ATOM 0 H VAL A 68 11.713 -0.834 -13.768 1.00 0.73 H new ATOM 0 HA VAL A 68 13.958 0.032 -12.127 1.00 0.78 H new ATOM 0 HB VAL A 68 13.794 0.516 -15.092 1.00 1.17 H new ATOM 0 HG11 VAL A 68 16.037 1.667 -14.756 1.00 2.02 H new ATOM 0 HG12 VAL A 68 14.738 2.458 -13.832 1.00 2.02 H new ATOM 0 HG13 VAL A 68 15.886 1.377 -13.007 1.00 2.02 H new ATOM 0 HG21 VAL A 68 16.005 -0.643 -15.264 1.00 1.86 H new ATOM 0 HG22 VAL A 68 15.897 -1.055 -13.536 1.00 1.86 H new ATOM 0 HG23 VAL A 68 14.715 -1.724 -14.685 1.00 1.86 H new ATOM 703 N LEU A 69 12.604 2.204 -11.902 1.00 0.71 N ATOM 704 CA LEU A 69 11.857 3.461 -11.745 1.00 0.66 C ATOM 705 C LEU A 69 12.420 4.597 -12.626 1.00 0.67 C ATOM 706 O LEU A 69 13.640 4.690 -12.806 1.00 0.81 O ATOM 707 CB LEU A 69 11.828 3.865 -10.260 1.00 0.86 C ATOM 708 CG LEU A 69 11.017 2.915 -9.363 1.00 0.97 C ATOM 709 CD1 LEU A 69 11.220 3.283 -7.895 1.00 1.21 C ATOM 710 CD2 LEU A 69 9.521 3.013 -9.665 1.00 0.92 C ATOM 0 H LEU A 69 13.216 1.994 -11.114 1.00 0.71 H new ATOM 0 HA LEU A 69 10.837 3.290 -12.088 1.00 0.66 H new ATOM 0 HB2 LEU A 69 12.851 3.912 -9.888 1.00 0.86 H new ATOM 0 HB3 LEU A 69 11.412 4.869 -10.176 1.00 0.86 H new ATOM 0 HG LEU A 69 11.366 1.902 -9.561 1.00 0.97 H new ATOM 0 HD11 LEU A 69 10.642 2.605 -7.267 1.00 1.21 H new ATOM 0 HD12 LEU A 69 12.277 3.200 -7.642 1.00 1.21 H new ATOM 0 HD13 LEU A 69 10.886 4.307 -7.727 1.00 1.21 H new ATOM 0 HD21 LEU A 69 8.973 2.330 -9.016 1.00 0.92 H new ATOM 0 HD22 LEU A 69 9.180 4.033 -9.489 1.00 0.92 H new ATOM 0 HD23 LEU A 69 9.342 2.746 -10.706 1.00 0.92 H new ATOM 722 N PRO A 70 11.557 5.493 -13.147 1.00 0.59 N ATOM 723 CA PRO A 70 11.972 6.562 -14.053 1.00 0.61 C ATOM 724 C PRO A 70 12.745 7.665 -13.329 1.00 0.62 C ATOM 725 O PRO A 70 12.627 7.834 -12.113 1.00 0.59 O ATOM 726 CB PRO A 70 10.674 7.112 -14.631 1.00 0.59 C ATOM 727 CG PRO A 70 9.663 6.910 -13.527 1.00 0.51 C ATOM 728 CD PRO A 70 10.133 5.626 -12.844 1.00 0.53 C ATOM 0 HA PRO A 70 12.649 6.185 -14.820 1.00 0.61 H new ATOM 0 HB2 PRO A 70 10.770 8.165 -14.895 1.00 0.59 H new ATOM 0 HB3 PRO A 70 10.385 6.581 -15.538 1.00 0.59 H new ATOM 0 HG2 PRO A 70 9.651 7.752 -12.835 1.00 0.51 H new ATOM 0 HG3 PRO A 70 8.652 6.808 -13.922 1.00 0.51 H new ATOM 0 HD2 PRO A 70 9.968 5.676 -11.768 1.00 0.53 H new ATOM 0 HD3 PRO A 70 9.576 4.764 -13.212 1.00 0.53 H new ATOM 736 N ALA A 71 13.485 8.482 -14.078 1.00 0.68 N ATOM 737 CA ALA A 71 14.321 9.541 -13.505 1.00 0.73 C ATOM 738 C ALA A 71 13.530 10.688 -12.838 1.00 0.65 C ATOM 739 O ALA A 71 14.100 11.445 -12.055 1.00 0.78 O ATOM 740 CB ALA A 71 15.252 10.050 -14.602 1.00 0.87 C ATOM 0 H ALA A 71 13.523 8.430 -15.096 1.00 0.68 H new ATOM 0 HA ALA A 71 14.894 9.112 -12.683 1.00 0.73 H new ATOM 0 HB1 ALA A 71 15.887 10.841 -14.202 1.00 0.87 H new ATOM 0 HB2 ALA A 71 15.875 9.230 -14.960 1.00 0.87 H new ATOM 0 HB3 ALA A 71 14.660 10.443 -15.428 1.00 0.87 H new ATOM 746 N ASN A 72 12.223 10.792 -13.109 1.00 0.60 N ATOM 747 CA ASN A 72 11.288 11.721 -12.464 1.00 0.61 C ATOM 748 C ASN A 72 10.484 11.102 -11.294 1.00 0.56 C ATOM 749 O ASN A 72 9.696 11.799 -10.656 1.00 0.67 O ATOM 750 CB ASN A 72 10.397 12.363 -13.543 1.00 0.65 C ATOM 751 CG ASN A 72 9.546 11.385 -14.338 1.00 0.70 C ATOM 752 OD1 ASN A 72 9.482 10.195 -14.074 1.00 1.73 O ATOM 753 ND2 ASN A 72 8.884 11.842 -15.374 1.00 1.49 N ATOM 0 H ASN A 72 11.770 10.208 -13.812 1.00 0.60 H new ATOM 0 HA ASN A 72 11.872 12.501 -11.976 1.00 0.61 H new ATOM 0 HB2 ASN A 72 9.739 13.089 -13.065 1.00 0.65 H new ATOM 0 HB3 ASN A 72 11.032 12.916 -14.236 1.00 0.65 H new ATOM 0 HD21 ASN A 72 8.327 11.206 -15.944 1.00 1.49 H new ATOM 0 HD22 ASN A 72 8.926 12.834 -15.609 1.00 1.49 H new ATOM 760 N ALA A 73 10.675 9.812 -10.990 1.00 0.50 N ATOM 761 CA ALA A 73 10.154 9.174 -9.775 1.00 0.48 C ATOM 762 C ALA A 73 11.083 9.375 -8.554 1.00 0.50 C ATOM 763 O ALA A 73 12.306 9.461 -8.692 1.00 0.56 O ATOM 764 CB ALA A 73 9.907 7.685 -10.064 1.00 0.47 C ATOM 0 H ALA A 73 11.202 9.175 -11.588 1.00 0.50 H new ATOM 0 HA ALA A 73 9.213 9.653 -9.506 1.00 0.48 H new ATOM 0 HB1 ALA A 73 9.520 7.200 -9.168 1.00 0.47 H new ATOM 0 HB2 ALA A 73 9.182 7.587 -10.872 1.00 0.47 H new ATOM 0 HB3 ALA A 73 10.844 7.211 -10.357 1.00 0.47 H new ATOM 770 N LYS A 74 10.503 9.396 -7.345 1.00 0.50 N ATOM 771 CA LYS A 74 11.214 9.359 -6.048 1.00 0.58 C ATOM 772 C LYS A 74 10.455 8.498 -5.030 1.00 0.53 C ATOM 773 O LYS A 74 9.232 8.379 -5.108 1.00 0.60 O ATOM 774 CB LYS A 74 11.486 10.795 -5.547 1.00 0.78 C ATOM 775 CG LYS A 74 10.256 11.483 -4.926 1.00 0.80 C ATOM 776 CD LYS A 74 10.363 13.017 -4.961 1.00 0.92 C ATOM 777 CE LYS A 74 9.134 13.640 -4.286 1.00 1.36 C ATOM 778 NZ LYS A 74 8.953 15.067 -4.637 1.00 2.41 N ATOM 0 H LYS A 74 9.490 9.441 -7.234 1.00 0.50 H new ATOM 0 HA LYS A 74 12.184 8.881 -6.183 1.00 0.58 H new ATOM 0 HB2 LYS A 74 12.286 10.766 -4.807 1.00 0.78 H new ATOM 0 HB3 LYS A 74 11.845 11.398 -6.381 1.00 0.78 H new ATOM 0 HG2 LYS A 74 9.359 11.172 -5.462 1.00 0.80 H new ATOM 0 HG3 LYS A 74 10.141 11.153 -3.894 1.00 0.80 H new ATOM 0 HD2 LYS A 74 11.271 13.339 -4.452 1.00 0.92 H new ATOM 0 HD3 LYS A 74 10.437 13.362 -5.992 1.00 0.92 H new ATOM 0 HE2 LYS A 74 8.243 13.083 -4.576 1.00 1.36 H new ATOM 0 HE3 LYS A 74 9.231 13.545 -3.204 1.00 1.36 H new ATOM 0 HZ1 LYS A 74 8.320 15.517 -3.946 1.00 2.41 H new ATOM 0 HZ2 LYS A 74 9.875 15.547 -4.625 1.00 2.41 H new ATOM 0 HZ3 LYS A 74 8.536 15.141 -5.587 1.00 2.41 H new ATOM 792 N GLU A 75 11.161 7.891 -4.081 1.00 0.57 N ATOM 793 CA GLU A 75 10.605 6.890 -3.150 1.00 0.62 C ATOM 794 C GLU A 75 10.884 7.288 -1.697 1.00 0.78 C ATOM 795 O GLU A 75 11.986 7.765 -1.404 1.00 1.02 O ATOM 796 CB GLU A 75 11.143 5.473 -3.439 1.00 0.97 C ATOM 797 CG GLU A 75 11.521 5.178 -4.904 1.00 0.77 C ATOM 798 CD GLU A 75 13.024 5.390 -5.123 1.00 1.49 C ATOM 799 OE1 GLU A 75 13.825 4.465 -4.844 1.00 1.55 O ATOM 800 OE2 GLU A 75 13.430 6.503 -5.532 1.00 3.10 O ATOM 0 H GLU A 75 12.152 8.077 -3.927 1.00 0.57 H new ATOM 0 HA GLU A 75 9.526 6.867 -3.305 1.00 0.62 H new ATOM 0 HB2 GLU A 75 12.023 5.306 -2.817 1.00 0.97 H new ATOM 0 HB3 GLU A 75 10.390 4.750 -3.126 1.00 0.97 H new ATOM 0 HG2 GLU A 75 11.252 4.152 -5.156 1.00 0.77 H new ATOM 0 HG3 GLU A 75 10.955 5.829 -5.570 1.00 0.77 H new ATOM 807 N ILE A 76 9.919 7.120 -0.786 1.00 0.71 N ATOM 808 CA ILE A 76 10.012 7.675 0.578 1.00 0.74 C ATOM 809 C ILE A 76 9.682 6.697 1.709 1.00 0.70 C ATOM 810 O ILE A 76 8.889 5.761 1.563 1.00 0.77 O ATOM 811 CB ILE A 76 9.194 8.981 0.730 1.00 0.73 C ATOM 812 CG1 ILE A 76 7.711 8.810 0.326 1.00 0.68 C ATOM 813 CG2 ILE A 76 9.875 10.121 -0.042 1.00 0.82 C ATOM 814 CD1 ILE A 76 6.865 10.064 0.582 1.00 0.84 C ATOM 0 H ILE A 76 9.059 6.602 -0.966 1.00 0.71 H new ATOM 0 HA ILE A 76 11.072 7.900 0.693 1.00 0.74 H new ATOM 0 HB ILE A 76 9.178 9.241 1.788 1.00 0.73 H new ATOM 0 HG12 ILE A 76 7.657 8.553 -0.732 1.00 0.68 H new ATOM 0 HG13 ILE A 76 7.285 7.973 0.879 1.00 0.68 H new ATOM 0 HG21 ILE A 76 9.293 11.035 0.071 1.00 0.82 H new ATOM 0 HG22 ILE A 76 10.879 10.279 0.353 1.00 0.82 H new ATOM 0 HG23 ILE A 76 9.938 9.859 -1.098 1.00 0.82 H new ATOM 0 HD11 ILE A 76 5.835 9.877 0.277 1.00 0.84 H new ATOM 0 HD12 ILE A 76 6.890 10.309 1.644 1.00 0.84 H new ATOM 0 HD13 ILE A 76 7.268 10.898 0.007 1.00 0.84 H new ATOM 826 N ALA A 77 10.282 6.980 2.865 1.00 0.64 N ATOM 827 CA ALA A 77 10.037 6.331 4.144 1.00 0.60 C ATOM 828 C ALA A 77 9.396 7.286 5.172 1.00 0.53 C ATOM 829 O ALA A 77 9.528 8.509 5.068 1.00 0.63 O ATOM 830 CB ALA A 77 11.344 5.715 4.635 1.00 0.65 C ATOM 0 H ALA A 77 10.991 7.710 2.933 1.00 0.64 H new ATOM 0 HA ALA A 77 9.304 5.535 4.013 1.00 0.60 H new ATOM 0 HB1 ALA A 77 11.177 5.224 5.594 1.00 0.65 H new ATOM 0 HB2 ALA A 77 11.696 4.983 3.909 1.00 0.65 H new ATOM 0 HB3 ALA A 77 12.093 6.498 4.754 1.00 0.65 H new ATOM 836 N GLY A 78 8.702 6.721 6.164 1.00 0.47 N ATOM 837 CA GLY A 78 7.997 7.455 7.221 1.00 0.46 C ATOM 838 C GLY A 78 6.539 7.801 6.903 1.00 0.45 C ATOM 839 O GLY A 78 5.935 8.606 7.612 1.00 0.53 O ATOM 0 H GLY A 78 8.612 5.709 6.257 1.00 0.47 H new ATOM 0 HA2 GLY A 78 8.023 6.862 8.135 1.00 0.46 H new ATOM 0 HA3 GLY A 78 8.538 8.379 7.425 1.00 0.46 H new ATOM 843 N VAL A 79 5.976 7.180 5.862 1.00 0.45 N ATOM 844 CA VAL A 79 4.557 7.249 5.475 1.00 0.46 C ATOM 845 C VAL A 79 3.801 6.021 5.981 1.00 0.40 C ATOM 846 O VAL A 79 4.352 4.921 5.977 1.00 0.39 O ATOM 847 CB VAL A 79 4.389 7.464 3.957 1.00 0.56 C ATOM 848 CG1 VAL A 79 5.304 6.602 3.084 1.00 0.82 C ATOM 849 CG2 VAL A 79 2.949 7.284 3.466 1.00 0.61 C ATOM 0 H VAL A 79 6.520 6.587 5.235 1.00 0.45 H new ATOM 0 HA VAL A 79 4.115 8.122 5.954 1.00 0.46 H new ATOM 0 HB VAL A 79 4.685 8.506 3.838 1.00 0.56 H new ATOM 0 HG11 VAL A 79 5.116 6.821 2.033 1.00 0.82 H new ATOM 0 HG12 VAL A 79 6.345 6.822 3.320 1.00 0.82 H new ATOM 0 HG13 VAL A 79 5.104 5.548 3.277 1.00 0.82 H new ATOM 0 HG21 VAL A 79 2.908 7.451 2.390 1.00 0.61 H new ATOM 0 HG22 VAL A 79 2.612 6.272 3.690 1.00 0.61 H new ATOM 0 HG23 VAL A 79 2.301 8.001 3.969 1.00 0.61 H new ATOM 859 N MET A 80 2.554 6.216 6.419 1.00 0.42 N ATOM 860 CA MET A 80 1.690 5.200 7.026 1.00 0.39 C ATOM 861 C MET A 80 0.599 4.674 6.081 1.00 0.38 C ATOM 862 O MET A 80 -0.095 5.443 5.415 1.00 0.42 O ATOM 863 CB MET A 80 1.067 5.814 8.287 1.00 0.44 C ATOM 864 CG MET A 80 0.114 4.876 9.030 1.00 0.45 C ATOM 865 SD MET A 80 0.811 3.278 9.518 1.00 0.55 S ATOM 866 CE MET A 80 0.395 3.347 11.277 1.00 0.48 C ATOM 0 H MET A 80 2.099 7.127 6.357 1.00 0.42 H new ATOM 0 HA MET A 80 2.300 4.330 7.267 1.00 0.39 H new ATOM 0 HB2 MET A 80 1.866 6.115 8.965 1.00 0.44 H new ATOM 0 HB3 MET A 80 0.527 6.719 8.009 1.00 0.44 H new ATOM 0 HG2 MET A 80 -0.243 5.385 9.925 1.00 0.45 H new ATOM 0 HG3 MET A 80 -0.755 4.695 8.398 1.00 0.45 H new ATOM 0 HE1 MET A 80 0.744 2.439 11.769 1.00 0.48 H new ATOM 0 HE2 MET A 80 0.875 4.214 11.731 1.00 0.48 H new ATOM 0 HE3 MET A 80 -0.686 3.429 11.392 1.00 0.48 H new ATOM 876 N PHE A 81 0.391 3.355 6.082 1.00 0.36 N ATOM 877 CA PHE A 81 -0.657 2.665 5.321 1.00 0.40 C ATOM 878 C PHE A 81 -1.266 1.501 6.117 1.00 0.38 C ATOM 879 O PHE A 81 -0.623 0.891 6.976 1.00 0.36 O ATOM 880 CB PHE A 81 -0.133 2.210 3.940 1.00 0.46 C ATOM 881 CG PHE A 81 1.349 1.909 3.926 1.00 0.46 C ATOM 882 CD1 PHE A 81 1.777 0.645 4.360 1.00 1.62 C ATOM 883 CD2 PHE A 81 2.297 2.914 3.626 1.00 1.57 C ATOM 884 CE1 PHE A 81 3.138 0.381 4.513 1.00 1.65 C ATOM 885 CE2 PHE A 81 3.664 2.637 3.785 1.00 1.59 C ATOM 886 CZ PHE A 81 4.086 1.373 4.233 1.00 0.66 C ATOM 0 H PHE A 81 0.966 2.715 6.630 1.00 0.36 H new ATOM 0 HA PHE A 81 -1.462 3.379 5.145 1.00 0.40 H new ATOM 0 HB2 PHE A 81 -0.679 1.320 3.628 1.00 0.46 H new ATOM 0 HB3 PHE A 81 -0.345 2.987 3.206 1.00 0.46 H new ATOM 0 HD1 PHE A 81 1.051 -0.125 4.576 1.00 1.62 H new ATOM 0 HD2 PHE A 81 1.973 3.884 3.278 1.00 1.57 H new ATOM 0 HE1 PHE A 81 3.462 -0.593 4.849 1.00 1.65 H new ATOM 0 HE2 PHE A 81 4.396 3.399 3.562 1.00 1.59 H new ATOM 0 HZ PHE A 81 5.139 1.168 4.361 1.00 0.66 H new ATOM 896 N VAL A 82 -2.528 1.203 5.806 1.00 0.38 N ATOM 897 CA VAL A 82 -3.391 0.201 6.448 1.00 0.34 C ATOM 898 C VAL A 82 -3.930 -0.772 5.377 1.00 0.33 C ATOM 899 O VAL A 82 -4.190 -0.358 4.242 1.00 0.37 O ATOM 900 CB VAL A 82 -4.542 0.871 7.237 1.00 0.37 C ATOM 901 CG1 VAL A 82 -4.067 2.052 8.101 1.00 0.42 C ATOM 902 CG2 VAL A 82 -5.660 1.424 6.350 1.00 0.40 C ATOM 0 H VAL A 82 -3.010 1.686 5.048 1.00 0.38 H new ATOM 0 HA VAL A 82 -2.802 -0.363 7.171 1.00 0.34 H new ATOM 0 HB VAL A 82 -4.919 0.056 7.855 1.00 0.37 H new ATOM 0 HG11 VAL A 82 -4.918 2.481 8.630 1.00 0.42 H new ATOM 0 HG12 VAL A 82 -3.330 1.701 8.823 1.00 0.42 H new ATOM 0 HG13 VAL A 82 -3.616 2.812 7.463 1.00 0.42 H new ATOM 0 HG21 VAL A 82 -6.429 1.878 6.975 1.00 0.40 H new ATOM 0 HG22 VAL A 82 -5.251 2.176 5.675 1.00 0.40 H new ATOM 0 HG23 VAL A 82 -6.097 0.613 5.768 1.00 0.40 H new ATOM 912 N TRP A 83 -4.136 -2.049 5.708 1.00 0.29 N ATOM 913 CA TRP A 83 -4.844 -3.010 4.852 1.00 0.26 C ATOM 914 C TRP A 83 -6.362 -3.014 5.110 1.00 0.27 C ATOM 915 O TRP A 83 -6.842 -2.832 6.231 1.00 0.29 O ATOM 916 CB TRP A 83 -4.255 -4.420 5.008 1.00 0.24 C ATOM 917 CG TRP A 83 -3.056 -4.752 4.162 1.00 0.26 C ATOM 918 CD1 TRP A 83 -1.859 -4.120 4.161 1.00 0.32 C ATOM 919 CD2 TRP A 83 -2.914 -5.856 3.213 1.00 0.28 C ATOM 920 NE1 TRP A 83 -1.015 -4.723 3.243 1.00 0.35 N ATOM 921 CE2 TRP A 83 -1.610 -5.809 2.632 1.00 0.34 C ATOM 922 CE3 TRP A 83 -3.755 -6.913 2.807 1.00 0.29 C ATOM 923 CZ2 TRP A 83 -1.170 -6.751 1.684 1.00 0.40 C ATOM 924 CZ3 TRP A 83 -3.327 -7.868 1.867 1.00 0.33 C ATOM 925 CH2 TRP A 83 -2.036 -7.801 1.314 1.00 0.40 C ATOM 0 H TRP A 83 -3.813 -2.452 6.588 1.00 0.29 H new ATOM 0 HA TRP A 83 -4.698 -2.688 3.821 1.00 0.26 H new ATOM 0 HB2 TRP A 83 -3.982 -4.560 6.054 1.00 0.24 H new ATOM 0 HB3 TRP A 83 -5.040 -5.143 4.784 1.00 0.24 H new ATOM 0 HD1 TRP A 83 -1.601 -3.274 4.781 1.00 0.32 H new ATOM 0 HE1 TRP A 83 -0.067 -4.403 3.042 1.00 0.35 H new ATOM 0 HE3 TRP A 83 -4.747 -6.991 3.226 1.00 0.29 H new ATOM 0 HZ2 TRP A 83 -0.186 -6.671 1.247 1.00 0.40 H new ATOM 0 HZ3 TRP A 83 -3.997 -8.660 1.567 1.00 0.33 H new ATOM 0 HH2 TRP A 83 -1.709 -8.551 0.609 1.00 0.40 H new ATOM 936 N THR A 84 -7.126 -3.276 4.050 1.00 0.27 N ATOM 937 CA THR A 84 -8.590 -3.403 4.050 1.00 0.28 C ATOM 938 C THR A 84 -9.073 -4.592 3.212 1.00 0.30 C ATOM 939 O THR A 84 -8.330 -5.160 2.412 1.00 0.29 O ATOM 940 CB THR A 84 -9.282 -2.136 3.506 1.00 0.30 C ATOM 941 OG1 THR A 84 -8.795 -1.815 2.231 1.00 0.34 O ATOM 942 CG2 THR A 84 -9.126 -0.891 4.369 1.00 0.34 C ATOM 0 H THR A 84 -6.726 -3.413 3.122 1.00 0.27 H new ATOM 0 HA THR A 84 -8.860 -3.556 5.095 1.00 0.28 H new ATOM 0 HB THR A 84 -10.339 -2.401 3.494 1.00 0.30 H new ATOM 0 HG1 THR A 84 -7.901 -2.199 2.116 1.00 0.34 H new ATOM 0 HG21 THR A 84 -9.648 -0.056 3.901 1.00 0.34 H new ATOM 0 HG22 THR A 84 -9.550 -1.077 5.356 1.00 0.34 H new ATOM 0 HG23 THR A 84 -8.068 -0.648 4.469 1.00 0.34 H new ATOM 950 N ASN A 85 -10.336 -4.976 3.391 1.00 0.40 N ATOM 951 CA ASN A 85 -11.067 -5.894 2.519 1.00 0.47 C ATOM 952 C ASN A 85 -11.732 -5.145 1.357 1.00 0.51 C ATOM 953 O ASN A 85 -11.781 -3.915 1.350 1.00 0.53 O ATOM 954 CB ASN A 85 -12.031 -6.752 3.361 1.00 0.56 C ATOM 955 CG ASN A 85 -11.577 -8.195 3.347 1.00 0.72 C ATOM 956 OD1 ASN A 85 -12.267 -9.086 2.879 1.00 1.55 O ATOM 957 ND2 ASN A 85 -10.355 -8.429 3.763 1.00 1.12 N ATOM 0 H ASN A 85 -10.898 -4.645 4.175 1.00 0.40 H new ATOM 0 HA ASN A 85 -10.374 -6.587 2.041 1.00 0.47 H new ATOM 0 HB2 ASN A 85 -12.063 -6.381 4.385 1.00 0.56 H new ATOM 0 HB3 ASN A 85 -13.043 -6.676 2.963 1.00 0.56 H new ATOM 0 HD21 ASN A 85 -9.966 -9.369 3.698 1.00 1.12 H new ATOM 0 HD22 ASN A 85 -9.794 -7.670 4.151 1.00 1.12 H new ATOM 964 N THR A 86 -12.237 -5.871 0.357 1.00 0.58 N ATOM 965 CA THR A 86 -12.674 -5.247 -0.902 1.00 0.69 C ATOM 966 C THR A 86 -13.909 -4.330 -0.781 1.00 0.62 C ATOM 967 O THR A 86 -14.134 -3.472 -1.635 1.00 0.77 O ATOM 968 CB THR A 86 -12.729 -6.277 -2.033 1.00 1.05 C ATOM 969 OG1 THR A 86 -12.561 -5.612 -3.256 1.00 2.82 O ATOM 970 CG2 THR A 86 -14.013 -7.080 -2.058 1.00 1.78 C ATOM 0 H THR A 86 -12.354 -6.884 0.390 1.00 0.58 H new ATOM 0 HA THR A 86 -11.903 -4.529 -1.181 1.00 0.69 H new ATOM 0 HB THR A 86 -11.926 -6.993 -1.859 1.00 1.05 H new ATOM 0 HG1 THR A 86 -12.593 -6.262 -3.989 1.00 2.82 H new ATOM 0 HG21 THR A 86 -13.982 -7.790 -2.885 1.00 1.78 H new ATOM 0 HG22 THR A 86 -14.122 -7.622 -1.118 1.00 1.78 H new ATOM 0 HG23 THR A 86 -14.860 -6.407 -2.189 1.00 1.78 H new ATOM 978 N ASN A 87 -14.643 -4.408 0.336 1.00 0.52 N ATOM 979 CA ASN A 87 -15.693 -3.457 0.744 1.00 0.59 C ATOM 980 C ASN A 87 -15.132 -2.209 1.472 1.00 0.56 C ATOM 981 O ASN A 87 -15.833 -1.534 2.228 1.00 0.62 O ATOM 982 CB ASN A 87 -16.715 -4.209 1.608 1.00 0.70 C ATOM 983 CG ASN A 87 -18.020 -3.453 1.789 1.00 2.19 C ATOM 984 OD1 ASN A 87 -18.563 -2.860 0.862 1.00 2.85 O ATOM 985 ND2 ASN A 87 -18.572 -3.465 2.973 1.00 3.38 N ATOM 0 H ASN A 87 -14.519 -5.164 1.009 1.00 0.52 H new ATOM 0 HA ASN A 87 -16.177 -3.066 -0.151 1.00 0.59 H new ATOM 0 HB2 ASN A 87 -16.924 -5.177 1.152 1.00 0.70 H new ATOM 0 HB3 ASN A 87 -16.278 -4.406 2.587 1.00 0.70 H new ATOM 0 HD21 ASN A 87 -19.456 -2.981 3.128 1.00 3.38 H new ATOM 0 HD22 ASN A 87 -18.119 -3.959 3.742 1.00 3.38 H new ATOM 992 N ASN A 88 -13.835 -1.935 1.306 1.00 0.54 N ATOM 993 CA ASN A 88 -13.085 -0.862 1.965 1.00 0.54 C ATOM 994 C ASN A 88 -13.083 -0.967 3.512 1.00 0.55 C ATOM 995 O ASN A 88 -12.918 0.029 4.214 1.00 0.62 O ATOM 996 CB ASN A 88 -13.516 0.518 1.413 1.00 0.55 C ATOM 997 CG ASN A 88 -14.080 0.512 0.000 1.00 0.56 C ATOM 998 OD1 ASN A 88 -15.287 0.529 -0.218 1.00 0.64 O ATOM 999 ND2 ASN A 88 -13.246 0.460 -1.008 1.00 0.55 N ATOM 0 H ASN A 88 -13.250 -2.484 0.676 1.00 0.54 H new ATOM 0 HA ASN A 88 -12.032 -0.985 1.710 1.00 0.54 H new ATOM 0 HB2 ASN A 88 -14.266 0.940 2.083 1.00 0.55 H new ATOM 0 HB3 ASN A 88 -12.654 1.185 1.439 1.00 0.55 H new ATOM 0 HD21 ASN A 88 -13.602 0.434 -1.964 1.00 0.55 H new ATOM 0 HD22 ASN A 88 -12.240 0.445 -0.838 1.00 0.55 H new ATOM 1006 N GLU A 89 -13.300 -2.172 4.054 1.00 0.50 N ATOM 1007 CA GLU A 89 -13.349 -2.469 5.497 1.00 0.48 C ATOM 1008 C GLU A 89 -11.970 -2.694 6.103 1.00 0.38 C ATOM 1009 O GLU A 89 -11.192 -3.473 5.565 1.00 0.34 O ATOM 1010 CB GLU A 89 -14.147 -3.754 5.752 1.00 0.56 C ATOM 1011 CG GLU A 89 -15.649 -3.486 5.867 1.00 0.69 C ATOM 1012 CD GLU A 89 -16.437 -4.797 5.856 1.00 1.21 C ATOM 1013 OE1 GLU A 89 -16.197 -5.662 6.727 1.00 1.79 O ATOM 1014 OE2 GLU A 89 -17.302 -4.991 4.967 1.00 2.61 O ATOM 0 H GLU A 89 -13.453 -3.001 3.480 1.00 0.50 H new ATOM 0 HA GLU A 89 -13.814 -1.598 5.958 1.00 0.48 H new ATOM 0 HB2 GLU A 89 -13.966 -4.459 4.941 1.00 0.56 H new ATOM 0 HB3 GLU A 89 -13.792 -4.225 6.669 1.00 0.56 H new ATOM 0 HG2 GLU A 89 -15.856 -2.940 6.787 1.00 0.69 H new ATOM 0 HG3 GLU A 89 -15.975 -2.854 5.041 1.00 0.69 H new ATOM 1021 N ILE A 90 -11.696 -2.136 7.281 1.00 0.38 N ATOM 1022 CA ILE A 90 -10.405 -2.317 7.950 1.00 0.34 C ATOM 1023 C ILE A 90 -10.335 -3.701 8.623 1.00 0.31 C ATOM 1024 O ILE A 90 -11.235 -4.078 9.384 1.00 0.36 O ATOM 1025 CB ILE A 90 -10.109 -1.183 8.949 1.00 0.39 C ATOM 1026 CG1 ILE A 90 -10.448 0.209 8.373 1.00 0.43 C ATOM 1027 CG2 ILE A 90 -8.617 -1.284 9.320 1.00 0.40 C ATOM 1028 CD1 ILE A 90 -10.087 1.368 9.304 1.00 0.48 C ATOM 0 H ILE A 90 -12.354 -1.551 7.796 1.00 0.38 H new ATOM 0 HA ILE A 90 -9.626 -2.270 7.189 1.00 0.34 H new ATOM 0 HB ILE A 90 -10.738 -1.296 9.832 1.00 0.39 H new ATOM 0 HG12 ILE A 90 -9.922 0.338 7.427 1.00 0.43 H new ATOM 0 HG13 ILE A 90 -11.515 0.251 8.153 1.00 0.43 H new ATOM 0 HG21 ILE A 90 -8.364 -0.496 10.029 1.00 0.40 H new ATOM 0 HG22 ILE A 90 -8.420 -2.256 9.773 1.00 0.40 H new ATOM 0 HG23 ILE A 90 -8.010 -1.172 8.421 1.00 0.40 H new ATOM 0 HD11 ILE A 90 -10.355 2.312 8.830 1.00 0.48 H new ATOM 0 HD12 ILE A 90 -10.633 1.265 10.242 1.00 0.48 H new ATOM 0 HD13 ILE A 90 -9.016 1.354 9.504 1.00 0.48 H new ATOM 1040 N ILE A 91 -9.262 -4.443 8.343 1.00 0.27 N ATOM 1041 CA ILE A 91 -8.969 -5.797 8.867 1.00 0.28 C ATOM 1042 C ILE A 91 -7.576 -5.937 9.530 1.00 0.29 C ATOM 1043 O ILE A 91 -6.638 -5.209 9.211 1.00 0.31 O ATOM 1044 CB ILE A 91 -9.258 -6.871 7.784 1.00 0.29 C ATOM 1045 CG1 ILE A 91 -8.359 -6.788 6.523 1.00 0.28 C ATOM 1046 CG2 ILE A 91 -10.719 -6.767 7.309 1.00 0.40 C ATOM 1047 CD1 ILE A 91 -7.122 -7.682 6.565 1.00 1.03 C ATOM 0 H ILE A 91 -8.532 -4.108 7.714 1.00 0.27 H new ATOM 0 HA ILE A 91 -9.654 -5.973 9.696 1.00 0.28 H new ATOM 0 HB ILE A 91 -9.045 -7.819 8.278 1.00 0.29 H new ATOM 0 HG12 ILE A 91 -8.955 -7.055 5.650 1.00 0.28 H new ATOM 0 HG13 ILE A 91 -8.040 -5.755 6.388 1.00 0.28 H new ATOM 0 HG21 ILE A 91 -10.910 -7.525 6.550 1.00 0.40 H new ATOM 0 HG22 ILE A 91 -11.389 -6.924 8.155 1.00 0.40 H new ATOM 0 HG23 ILE A 91 -10.895 -5.778 6.886 1.00 0.40 H new ATOM 0 HD11 ILE A 91 -6.553 -7.559 5.643 1.00 1.03 H new ATOM 0 HD12 ILE A 91 -6.500 -7.403 7.415 1.00 1.03 H new ATOM 0 HD13 ILE A 91 -7.429 -8.723 6.666 1.00 1.03 H new ATOM 1059 N ASP A 92 -7.464 -6.842 10.505 1.00 0.40 N ATOM 1060 CA ASP A 92 -6.218 -7.342 11.126 1.00 0.46 C ATOM 1061 C ASP A 92 -5.522 -8.373 10.214 1.00 0.47 C ATOM 1062 O ASP A 92 -6.150 -8.969 9.343 1.00 0.45 O ATOM 1063 CB ASP A 92 -6.559 -7.964 12.502 1.00 0.53 C ATOM 1064 CG ASP A 92 -5.484 -8.913 13.061 1.00 0.61 C ATOM 1065 OD1 ASP A 92 -4.460 -8.460 13.620 1.00 1.47 O ATOM 1066 OD2 ASP A 92 -5.605 -10.138 12.840 1.00 1.58 O ATOM 0 H ASP A 92 -8.290 -7.278 10.914 1.00 0.40 H new ATOM 0 HA ASP A 92 -5.525 -6.512 11.265 1.00 0.46 H new ATOM 0 HB2 ASP A 92 -6.723 -7.159 13.219 1.00 0.53 H new ATOM 0 HB3 ASP A 92 -7.498 -8.511 12.416 1.00 0.53 H new ATOM 1071 N GLU A 93 -4.232 -8.630 10.444 1.00 0.55 N ATOM 1072 CA GLU A 93 -3.400 -9.548 9.654 1.00 0.57 C ATOM 1073 C GLU A 93 -3.912 -10.997 9.541 1.00 0.58 C ATOM 1074 O GLU A 93 -3.536 -11.670 8.589 1.00 0.59 O ATOM 1075 CB GLU A 93 -1.962 -9.525 10.204 1.00 0.67 C ATOM 1076 CG GLU A 93 -1.788 -10.293 11.521 1.00 0.70 C ATOM 1077 CD GLU A 93 -0.525 -9.849 12.267 1.00 1.17 C ATOM 1078 OE1 GLU A 93 0.605 -9.964 11.726 1.00 1.70 O ATOM 1079 OE2 GLU A 93 -0.661 -9.390 13.431 1.00 2.46 O ATOM 0 H GLU A 93 -3.719 -8.192 11.209 1.00 0.55 H new ATOM 0 HA GLU A 93 -3.444 -9.174 8.631 1.00 0.57 H new ATOM 0 HB2 GLU A 93 -1.291 -9.948 9.457 1.00 0.67 H new ATOM 0 HB3 GLU A 93 -1.658 -8.489 10.356 1.00 0.67 H new ATOM 0 HG2 GLU A 93 -2.661 -10.134 12.154 1.00 0.70 H new ATOM 0 HG3 GLU A 93 -1.734 -11.362 11.316 1.00 0.70 H new ATOM 1086 N ASN A 94 -4.770 -11.496 10.445 1.00 0.70 N ATOM 1087 CA ASN A 94 -5.426 -12.805 10.278 1.00 0.70 C ATOM 1088 C ASN A 94 -6.754 -12.735 9.485 1.00 0.67 C ATOM 1089 O ASN A 94 -7.418 -13.752 9.296 1.00 0.72 O ATOM 1090 CB ASN A 94 -5.489 -13.597 11.598 1.00 0.74 C ATOM 1091 CG ASN A 94 -6.838 -13.521 12.269 1.00 1.54 C ATOM 1092 OD1 ASN A 94 -7.627 -14.460 12.311 1.00 2.72 O ATOM 1093 ND2 ASN A 94 -7.187 -12.369 12.763 1.00 2.11 N ATOM 0 H ASN A 94 -5.027 -11.010 11.304 1.00 0.70 H new ATOM 0 HA ASN A 94 -4.783 -13.400 9.629 1.00 0.70 H new ATOM 0 HB2 ASN A 94 -5.246 -14.641 11.400 1.00 0.74 H new ATOM 0 HB3 ASN A 94 -4.729 -13.216 12.280 1.00 0.74 H new ATOM 0 HD21 ASN A 94 -8.110 -12.252 13.181 1.00 2.11 H new ATOM 0 HD22 ASN A 94 -6.538 -11.583 12.732 1.00 2.11 H new ATOM 1100 N GLY A 95 -7.184 -11.546 9.047 1.00 0.61 N ATOM 1101 CA GLY A 95 -8.460 -11.315 8.371 1.00 0.61 C ATOM 1102 C GLY A 95 -9.654 -11.134 9.316 1.00 0.64 C ATOM 1103 O GLY A 95 -10.797 -11.267 8.879 1.00 0.75 O ATOM 0 H GLY A 95 -6.635 -10.694 9.158 1.00 0.61 H new ATOM 0 HA2 GLY A 95 -8.370 -10.427 7.745 1.00 0.61 H new ATOM 0 HA3 GLY A 95 -8.662 -12.155 7.706 1.00 0.61 H new ATOM 1107 N GLN A 96 -9.405 -10.843 10.597 1.00 0.65 N ATOM 1108 CA GLN A 96 -10.430 -10.397 11.544 1.00 0.67 C ATOM 1109 C GLN A 96 -10.779 -8.933 11.248 1.00 0.59 C ATOM 1110 O GLN A 96 -9.916 -8.143 10.873 1.00 0.45 O ATOM 1111 CB GLN A 96 -9.940 -10.590 12.988 1.00 0.73 C ATOM 1112 CG GLN A 96 -10.918 -10.029 14.031 1.00 0.81 C ATOM 1113 CD GLN A 96 -10.561 -10.375 15.472 1.00 1.82 C ATOM 1114 OE1 GLN A 96 -9.565 -11.012 15.795 1.00 2.69 O ATOM 1115 NE2 GLN A 96 -11.374 -9.946 16.403 1.00 2.15 N ATOM 0 H GLN A 96 -8.475 -10.912 11.009 1.00 0.65 H new ATOM 0 HA GLN A 96 -11.333 -10.996 11.430 1.00 0.67 H new ATOM 0 HB2 GLN A 96 -9.787 -11.653 13.175 1.00 0.73 H new ATOM 0 HB3 GLN A 96 -8.972 -10.103 13.106 1.00 0.73 H new ATOM 0 HG2 GLN A 96 -10.958 -8.945 13.929 1.00 0.81 H new ATOM 0 HG3 GLN A 96 -11.918 -10.407 13.815 1.00 0.81 H new ATOM 0 HE21 GLN A 96 -12.206 -9.415 16.148 1.00 2.15 H new ATOM 0 HE22 GLN A 96 -11.175 -10.143 17.384 1.00 2.15 H new ATOM 1124 N THR A 97 -12.037 -8.545 11.429 1.00 0.73 N ATOM 1125 CA THR A 97 -12.562 -7.239 11.016 1.00 0.59 C ATOM 1126 C THR A 97 -12.793 -6.301 12.203 1.00 0.54 C ATOM 1127 O THR A 97 -13.162 -6.738 13.297 1.00 0.71 O ATOM 1128 CB THR A 97 -13.838 -7.414 10.188 1.00 0.74 C ATOM 1129 OG1 THR A 97 -14.884 -7.829 11.025 1.00 1.00 O ATOM 1130 CG2 THR A 97 -13.702 -8.450 9.068 1.00 0.86 C ATOM 0 H THR A 97 -12.737 -9.137 11.875 1.00 0.73 H new ATOM 0 HA THR A 97 -11.804 -6.765 10.392 1.00 0.59 H new ATOM 0 HB THR A 97 -14.037 -6.445 9.729 1.00 0.74 H new ATOM 0 HG1 THR A 97 -15.702 -7.940 10.496 1.00 1.00 H new ATOM 0 HG21 THR A 97 -14.643 -8.522 8.523 1.00 0.86 H new ATOM 0 HG22 THR A 97 -12.909 -8.145 8.385 1.00 0.86 H new ATOM 0 HG23 THR A 97 -13.457 -9.421 9.498 1.00 0.86 H new ATOM 1138 N LEU A 98 -12.572 -4.999 11.999 1.00 0.41 N ATOM 1139 CA LEU A 98 -12.552 -3.986 13.064 1.00 0.48 C ATOM 1140 C LEU A 98 -13.831 -3.122 13.138 1.00 0.59 C ATOM 1141 O LEU A 98 -13.954 -2.313 14.056 1.00 0.78 O ATOM 1142 CB LEU A 98 -11.273 -3.130 12.922 1.00 0.46 C ATOM 1143 CG LEU A 98 -9.933 -3.760 13.368 1.00 0.45 C ATOM 1144 CD1 LEU A 98 -9.875 -4.076 14.862 1.00 0.57 C ATOM 1145 CD2 LEU A 98 -9.536 -5.020 12.601 1.00 0.41 C ATOM 0 H LEU A 98 -12.398 -4.610 11.072 1.00 0.41 H new ATOM 0 HA LEU A 98 -12.535 -4.512 14.018 1.00 0.48 H new ATOM 0 HB2 LEU A 98 -11.176 -2.843 11.875 1.00 0.46 H new ATOM 0 HB3 LEU A 98 -11.418 -2.213 13.492 1.00 0.46 H new ATOM 0 HG LEU A 98 -9.216 -2.973 13.132 1.00 0.45 H new ATOM 0 HD11 LEU A 98 -8.907 -4.515 15.104 1.00 0.57 H new ATOM 0 HD12 LEU A 98 -10.010 -3.158 15.434 1.00 0.57 H new ATOM 0 HD13 LEU A 98 -10.667 -4.781 15.116 1.00 0.57 H new ATOM 0 HD21 LEU A 98 -8.584 -5.392 12.981 1.00 0.41 H new ATOM 0 HD22 LEU A 98 -10.303 -5.783 12.733 1.00 0.41 H new ATOM 0 HD23 LEU A 98 -9.437 -4.785 11.541 1.00 0.41 H new ATOM 1157 N GLY A 99 -14.786 -3.269 12.211 1.00 0.55 N ATOM 1158 CA GLY A 99 -16.057 -2.529 12.229 1.00 0.64 C ATOM 1159 C GLY A 99 -15.940 -1.081 11.738 1.00 0.65 C ATOM 1160 O GLY A 99 -16.663 -0.204 12.223 1.00 0.71 O ATOM 0 H GLY A 99 -14.699 -3.909 11.421 1.00 0.55 H new ATOM 0 HA2 GLY A 99 -16.781 -3.056 11.608 1.00 0.64 H new ATOM 0 HA3 GLY A 99 -16.451 -2.527 13.245 1.00 0.64 H new ATOM 1164 N VAL A 100 -15.000 -0.814 10.823 1.00 0.63 N ATOM 1165 CA VAL A 100 -14.731 0.518 10.245 1.00 0.65 C ATOM 1166 C VAL A 100 -14.466 0.401 8.738 1.00 0.61 C ATOM 1167 O VAL A 100 -13.884 -0.583 8.282 1.00 0.56 O ATOM 1168 CB VAL A 100 -13.552 1.218 10.960 1.00 0.66 C ATOM 1169 CG1 VAL A 100 -13.311 2.643 10.437 1.00 1.20 C ATOM 1170 CG2 VAL A 100 -13.771 1.340 12.475 1.00 1.07 C ATOM 0 H VAL A 100 -14.385 -1.537 10.450 1.00 0.63 H new ATOM 0 HA VAL A 100 -15.616 1.136 10.396 1.00 0.65 H new ATOM 0 HB VAL A 100 -12.693 0.582 10.749 1.00 0.66 H new ATOM 0 HG11 VAL A 100 -12.473 3.090 10.972 1.00 1.20 H new ATOM 0 HG12 VAL A 100 -13.083 2.606 9.372 1.00 1.20 H new ATOM 0 HG13 VAL A 100 -14.206 3.245 10.596 1.00 1.20 H new ATOM 0 HG21 VAL A 100 -12.914 1.839 12.928 1.00 1.07 H new ATOM 0 HG22 VAL A 100 -14.672 1.922 12.667 1.00 1.07 H new ATOM 0 HG23 VAL A 100 -13.883 0.346 12.908 1.00 1.07 H new ATOM 1180 N ASN A 101 -14.883 1.404 7.965 1.00 0.66 N ATOM 1181 CA ASN A 101 -14.785 1.538 6.528 1.00 0.65 C ATOM 1182 C ASN A 101 -14.108 2.871 6.143 1.00 0.63 C ATOM 1183 O ASN A 101 -14.059 3.805 6.949 1.00 0.66 O ATOM 1184 CB ASN A 101 -16.247 1.442 6.057 1.00 0.73 C ATOM 1185 CG ASN A 101 -16.507 1.952 4.667 1.00 1.00 C ATOM 1186 OD1 ASN A 101 -16.941 3.076 4.454 1.00 1.50 O ATOM 1187 ND2 ASN A 101 -16.256 1.158 3.670 1.00 0.93 N ATOM 0 H ASN A 101 -15.341 2.216 8.378 1.00 0.66 H new ATOM 0 HA ASN A 101 -14.163 0.777 6.057 1.00 0.65 H new ATOM 0 HB2 ASN A 101 -16.561 0.399 6.109 1.00 0.73 H new ATOM 0 HB3 ASN A 101 -16.874 1.998 6.754 1.00 0.73 H new ATOM 0 HD21 ASN A 101 -16.421 1.472 2.714 1.00 0.93 H new ATOM 0 HD22 ASN A 101 -15.894 0.220 3.843 1.00 0.93 H new ATOM 1194 N ILE A 102 -13.574 2.941 4.920 1.00 0.62 N ATOM 1195 CA ILE A 102 -12.793 4.076 4.395 1.00 0.61 C ATOM 1196 C ILE A 102 -13.217 4.396 2.949 1.00 0.69 C ATOM 1197 O ILE A 102 -13.314 3.496 2.118 1.00 0.76 O ATOM 1198 CB ILE A 102 -11.266 3.788 4.476 1.00 0.54 C ATOM 1199 CG1 ILE A 102 -10.810 3.353 5.891 1.00 0.51 C ATOM 1200 CG2 ILE A 102 -10.494 5.055 4.064 1.00 0.54 C ATOM 1201 CD1 ILE A 102 -9.374 2.813 5.993 1.00 0.46 C ATOM 0 H ILE A 102 -13.674 2.186 4.242 1.00 0.62 H new ATOM 0 HA ILE A 102 -12.999 4.949 5.015 1.00 0.61 H new ATOM 0 HB ILE A 102 -11.055 2.960 3.800 1.00 0.54 H new ATOM 0 HG12 ILE A 102 -10.906 4.207 6.562 1.00 0.51 H new ATOM 0 HG13 ILE A 102 -11.494 2.585 6.253 1.00 0.51 H new ATOM 0 HG21 ILE A 102 -9.423 4.862 4.118 1.00 0.54 H new ATOM 0 HG22 ILE A 102 -10.762 5.329 3.044 1.00 0.54 H new ATOM 0 HG23 ILE A 102 -10.750 5.872 4.738 1.00 0.54 H new ATOM 0 HD11 ILE A 102 -9.161 2.539 7.026 1.00 0.46 H new ATOM 0 HD12 ILE A 102 -9.269 1.935 5.356 1.00 0.46 H new ATOM 0 HD13 ILE A 102 -8.672 3.582 5.670 1.00 0.46 H new ATOM 1213 N ASP A 103 -13.431 5.671 2.609 1.00 0.72 N ATOM 1214 CA ASP A 103 -13.768 6.058 1.225 1.00 0.78 C ATOM 1215 C ASP A 103 -12.534 6.016 0.301 1.00 0.74 C ATOM 1216 O ASP A 103 -11.486 6.507 0.723 1.00 0.71 O ATOM 1217 CB ASP A 103 -14.323 7.481 1.161 1.00 0.88 C ATOM 1218 CG ASP A 103 -15.190 7.636 -0.076 1.00 1.23 C ATOM 1219 OD1 ASP A 103 -16.370 7.215 -0.061 1.00 1.80 O ATOM 1220 OD2 ASP A 103 -14.672 8.142 -1.093 1.00 2.24 O ATOM 0 H ASP A 103 -13.379 6.451 3.264 1.00 0.72 H new ATOM 0 HA ASP A 103 -14.515 5.338 0.892 1.00 0.78 H new ATOM 0 HB2 ASP A 103 -14.908 7.694 2.056 1.00 0.88 H new ATOM 0 HB3 ASP A 103 -13.504 8.200 1.136 1.00 0.88 H new ATOM 1225 N PRO A 104 -12.600 5.552 -0.966 1.00 0.78 N ATOM 1226 CA PRO A 104 -11.431 5.583 -1.849 1.00 0.77 C ATOM 1227 C PRO A 104 -11.072 6.999 -2.326 1.00 0.79 C ATOM 1228 O PRO A 104 -9.913 7.254 -2.649 1.00 0.78 O ATOM 1229 CB PRO A 104 -11.761 4.629 -2.994 1.00 0.83 C ATOM 1230 CG PRO A 104 -13.280 4.657 -3.081 1.00 0.94 C ATOM 1231 CD PRO A 104 -13.766 5.049 -1.686 1.00 0.87 C ATOM 0 HA PRO A 104 -10.532 5.266 -1.321 1.00 0.77 H new ATOM 0 HB2 PRO A 104 -11.303 4.955 -3.928 1.00 0.83 H new ATOM 0 HB3 PRO A 104 -11.393 3.623 -2.792 1.00 0.83 H new ATOM 0 HG2 PRO A 104 -13.616 5.375 -3.829 1.00 0.94 H new ATOM 0 HG3 PRO A 104 -13.674 3.684 -3.374 1.00 0.94 H new ATOM 0 HD2 PRO A 104 -14.543 5.811 -1.746 1.00 0.87 H new ATOM 0 HD3 PRO A 104 -14.199 4.192 -1.171 1.00 0.87 H new ATOM 1239 N GLN A 105 -12.040 7.918 -2.340 1.00 0.86 N ATOM 1240 CA GLN A 105 -11.891 9.313 -2.759 1.00 0.88 C ATOM 1241 C GLN A 105 -11.457 10.213 -1.596 1.00 0.89 C ATOM 1242 O GLN A 105 -10.459 10.929 -1.691 1.00 0.94 O ATOM 1243 CB GLN A 105 -13.220 9.793 -3.374 1.00 0.92 C ATOM 1244 CG GLN A 105 -13.777 8.808 -4.403 1.00 0.92 C ATOM 1245 CD GLN A 105 -12.797 8.569 -5.541 1.00 0.93 C ATOM 1246 OE1 GLN A 105 -12.125 9.476 -6.019 1.00 1.30 O ATOM 1247 NE2 GLN A 105 -12.623 7.348 -5.981 1.00 1.14 N ATOM 0 H GLN A 105 -12.992 7.700 -2.046 1.00 0.86 H new ATOM 0 HA GLN A 105 -11.101 9.376 -3.508 1.00 0.88 H new ATOM 0 HB2 GLN A 105 -13.953 9.938 -2.580 1.00 0.92 H new ATOM 0 HB3 GLN A 105 -13.068 10.762 -3.848 1.00 0.92 H new ATOM 0 HG2 GLN A 105 -14.005 7.861 -3.914 1.00 0.92 H new ATOM 0 HG3 GLN A 105 -14.714 9.193 -4.805 1.00 0.92 H new ATOM 0 HE21 GLN A 105 -13.175 6.583 -5.593 1.00 1.14 H new ATOM 0 HE22 GLN A 105 -11.936 7.162 -6.712 1.00 1.14 H new ATOM 1256 N THR A 106 -12.190 10.141 -0.481 1.00 0.88 N ATOM 1257 CA THR A 106 -12.007 11.029 0.686 1.00 0.90 C ATOM 1258 C THR A 106 -10.895 10.566 1.624 1.00 0.85 C ATOM 1259 O THR A 106 -10.359 11.381 2.379 1.00 0.87 O ATOM 1260 CB THR A 106 -13.310 11.187 1.496 1.00 0.95 C ATOM 1261 OG1 THR A 106 -13.489 10.122 2.389 1.00 0.91 O ATOM 1262 CG2 THR A 106 -14.539 11.313 0.600 1.00 1.00 C ATOM 0 H THR A 106 -12.938 9.459 -0.355 1.00 0.88 H new ATOM 0 HA THR A 106 -11.718 11.992 0.266 1.00 0.90 H new ATOM 0 HB THR A 106 -13.205 12.114 2.060 1.00 0.95 H new ATOM 0 HG1 THR A 106 -14.322 10.251 2.889 1.00 0.91 H new ATOM 0 HG21 THR A 106 -15.430 11.422 1.218 1.00 1.00 H new ATOM 0 HG22 THR A 106 -14.433 12.188 -0.042 1.00 1.00 H new ATOM 0 HG23 THR A 106 -14.632 10.419 -0.017 1.00 1.00 H new ATOM 1270 N PHE A 107 -10.574 9.264 1.599 1.00 0.81 N ATOM 1271 CA PHE A 107 -9.641 8.583 2.514 1.00 0.83 C ATOM 1272 C PHE A 107 -9.957 8.819 4.014 1.00 0.86 C ATOM 1273 O PHE A 107 -9.077 8.676 4.868 1.00 0.96 O ATOM 1274 CB PHE A 107 -8.173 8.870 2.102 1.00 0.92 C ATOM 1275 CG PHE A 107 -7.460 7.904 1.161 1.00 0.77 C ATOM 1276 CD1 PHE A 107 -8.133 7.018 0.298 1.00 2.03 C ATOM 1277 CD2 PHE A 107 -6.052 7.917 1.142 1.00 2.12 C ATOM 1278 CE1 PHE A 107 -7.411 6.131 -0.509 1.00 2.02 C ATOM 1279 CE2 PHE A 107 -5.328 7.050 0.307 1.00 2.10 C ATOM 1280 CZ PHE A 107 -6.008 6.138 -0.512 1.00 0.71 C ATOM 0 H PHE A 107 -10.975 8.627 0.910 1.00 0.81 H new ATOM 0 HA PHE A 107 -9.788 7.508 2.406 1.00 0.83 H new ATOM 0 HB2 PHE A 107 -8.150 9.856 1.639 1.00 0.92 H new ATOM 0 HB3 PHE A 107 -7.582 8.933 3.016 1.00 0.92 H new ATOM 0 HD1 PHE A 107 -9.212 7.023 0.259 1.00 2.03 H new ATOM 0 HD2 PHE A 107 -5.519 8.606 1.781 1.00 2.12 H new ATOM 0 HE1 PHE A 107 -7.941 5.431 -1.138 1.00 2.02 H new ATOM 0 HE2 PHE A 107 -4.249 7.086 0.296 1.00 2.10 H new ATOM 0 HZ PHE A 107 -5.459 5.450 -1.137 1.00 0.71 H new ATOM 1290 N LYS A 108 -11.213 9.158 4.361 1.00 0.83 N ATOM 1291 CA LYS A 108 -11.661 9.334 5.756 1.00 0.86 C ATOM 1292 C LYS A 108 -12.505 8.161 6.263 1.00 0.80 C ATOM 1293 O LYS A 108 -13.024 7.364 5.476 1.00 0.84 O ATOM 1294 CB LYS A 108 -12.252 10.736 6.003 1.00 1.04 C ATOM 1295 CG LYS A 108 -13.762 10.911 5.757 1.00 1.17 C ATOM 1296 CD LYS A 108 -14.400 11.867 6.775 1.00 2.12 C ATOM 1297 CE LYS A 108 -14.531 11.210 8.156 1.00 2.65 C ATOM 1298 NZ LYS A 108 -14.979 12.176 9.183 1.00 3.71 N ATOM 0 H LYS A 108 -11.951 9.319 3.676 1.00 0.83 H new ATOM 0 HA LYS A 108 -10.777 9.300 6.392 1.00 0.86 H new ATOM 0 HB2 LYS A 108 -12.042 11.015 7.036 1.00 1.04 H new ATOM 0 HB3 LYS A 108 -11.721 11.444 5.367 1.00 1.04 H new ATOM 0 HG2 LYS A 108 -13.924 11.293 4.749 1.00 1.17 H new ATOM 0 HG3 LYS A 108 -14.254 9.940 5.813 1.00 1.17 H new ATOM 0 HD2 LYS A 108 -13.795 12.770 6.856 1.00 2.12 H new ATOM 0 HD3 LYS A 108 -15.385 12.173 6.421 1.00 2.12 H new ATOM 0 HE2 LYS A 108 -15.240 10.384 8.100 1.00 2.65 H new ATOM 0 HE3 LYS A 108 -13.571 10.786 8.450 1.00 2.65 H new ATOM 0 HZ1 LYS A 108 -15.056 11.695 10.102 1.00 3.71 H new ATOM 0 HZ2 LYS A 108 -14.290 12.951 9.254 1.00 3.71 H new ATOM 0 HZ3 LYS A 108 -15.907 12.562 8.916 1.00 3.71 H new ATOM 1312 N LEU A 109 -12.642 8.066 7.583 1.00 0.82 N ATOM 1313 CA LEU A 109 -13.167 6.900 8.303 1.00 0.84 C ATOM 1314 C LEU A 109 -14.671 6.964 8.616 1.00 0.94 C ATOM 1315 O LEU A 109 -15.223 8.027 8.904 1.00 1.09 O ATOM 1316 CB LEU A 109 -12.343 6.743 9.601 1.00 0.82 C ATOM 1317 CG LEU A 109 -10.874 6.352 9.338 1.00 0.74 C ATOM 1318 CD1 LEU A 109 -9.930 6.818 10.441 1.00 0.78 C ATOM 1319 CD2 LEU A 109 -10.735 4.837 9.269 1.00 0.67 C ATOM 0 H LEU A 109 -12.381 8.828 8.209 1.00 0.82 H new ATOM 0 HA LEU A 109 -13.064 6.033 7.650 1.00 0.84 H new ATOM 0 HB2 LEU A 109 -12.370 7.680 10.158 1.00 0.82 H new ATOM 0 HB3 LEU A 109 -12.808 5.985 10.231 1.00 0.82 H new ATOM 0 HG LEU A 109 -10.606 6.835 8.398 1.00 0.74 H new ATOM 0 HD11 LEU A 109 -8.911 6.514 10.200 1.00 0.78 H new ATOM 0 HD12 LEU A 109 -9.975 7.904 10.523 1.00 0.78 H new ATOM 0 HD13 LEU A 109 -10.228 6.370 11.389 1.00 0.78 H new ATOM 0 HD21 LEU A 109 -9.693 4.575 9.083 1.00 0.67 H new ATOM 0 HD22 LEU A 109 -11.056 4.399 10.214 1.00 0.67 H new ATOM 0 HD23 LEU A 109 -11.356 4.451 8.461 1.00 0.67 H new ATOM 1331 N SER A 110 -15.320 5.796 8.670 1.00 0.88 N ATOM 1332 CA SER A 110 -16.696 5.631 9.176 1.00 0.93 C ATOM 1333 C SER A 110 -16.812 5.704 10.711 1.00 1.00 C ATOM 1334 O SER A 110 -17.901 5.531 11.256 1.00 1.16 O ATOM 1335 CB SER A 110 -17.296 4.321 8.658 1.00 0.91 C ATOM 1336 OG SER A 110 -16.703 3.201 9.291 1.00 1.29 O ATOM 0 H SER A 110 -14.900 4.920 8.359 1.00 0.88 H new ATOM 0 HA SER A 110 -17.263 6.479 8.793 1.00 0.93 H new ATOM 0 HB2 SER A 110 -18.371 4.315 8.835 1.00 0.91 H new ATOM 0 HB3 SER A 110 -17.150 4.252 7.580 1.00 0.91 H new ATOM 0 HG SER A 110 -17.209 2.392 9.066 1.00 1.29 H new ATOM 1342 N GLY A 111 -15.704 5.918 11.426 1.00 0.96 N ATOM 1343 CA GLY A 111 -15.628 5.906 12.887 1.00 1.01 C ATOM 1344 C GLY A 111 -14.233 6.278 13.399 1.00 0.98 C ATOM 1345 O GLY A 111 -13.494 7.005 12.729 1.00 1.01 O ATOM 0 H GLY A 111 -14.804 6.111 10.986 1.00 0.96 H new ATOM 0 HA2 GLY A 111 -16.360 6.605 13.293 1.00 1.01 H new ATOM 0 HA3 GLY A 111 -15.895 4.915 13.255 1.00 1.01 H new ATOM 1349 N ALA A 112 -13.870 5.779 14.580 1.00 1.00 N ATOM 1350 CA ALA A 112 -12.583 6.050 15.223 1.00 0.99 C ATOM 1351 C ALA A 112 -11.482 5.039 14.838 1.00 0.88 C ATOM 1352 O ALA A 112 -11.768 3.879 14.518 1.00 0.78 O ATOM 1353 CB ALA A 112 -12.797 6.096 16.739 1.00 1.09 C ATOM 0 H ALA A 112 -14.472 5.164 15.127 1.00 1.00 H new ATOM 0 HA ALA A 112 -12.220 7.013 14.865 1.00 0.99 H new ATOM 0 HB1 ALA A 112 -11.847 6.297 17.235 1.00 1.09 H new ATOM 0 HB2 ALA A 112 -13.508 6.886 16.982 1.00 1.09 H new ATOM 0 HB3 ALA A 112 -13.189 5.138 17.080 1.00 1.09 H new ATOM 1359 N MET A 113 -10.218 5.463 14.935 1.00 0.96 N ATOM 1360 CA MET A 113 -9.021 4.670 14.633 1.00 0.92 C ATOM 1361 C MET A 113 -9.031 3.305 15.357 1.00 0.87 C ATOM 1362 O MET A 113 -9.264 3.269 16.569 1.00 1.00 O ATOM 1363 CB MET A 113 -7.768 5.481 15.039 1.00 1.07 C ATOM 1364 CG MET A 113 -6.647 5.389 14.002 1.00 1.06 C ATOM 1365 SD MET A 113 -7.056 6.243 12.456 1.00 1.96 S ATOM 1366 CE MET A 113 -6.333 5.104 11.255 1.00 1.08 C ATOM 0 H MET A 113 -9.991 6.410 15.239 1.00 0.96 H new ATOM 0 HA MET A 113 -9.007 4.463 13.563 1.00 0.92 H new ATOM 0 HB2 MET A 113 -8.045 6.526 15.177 1.00 1.07 H new ATOM 0 HB3 MET A 113 -7.401 5.119 15.999 1.00 1.07 H new ATOM 0 HG2 MET A 113 -5.735 5.817 14.419 1.00 1.06 H new ATOM 0 HG3 MET A 113 -6.439 4.340 13.789 1.00 1.06 H new ATOM 0 HE1 MET A 113 -6.676 5.365 10.254 1.00 1.08 H new ATOM 0 HE2 MET A 113 -5.246 5.174 11.296 1.00 1.08 H new ATOM 0 HE3 MET A 113 -6.640 4.085 11.490 1.00 1.08 H new ATOM 1376 N PRO A 114 -8.776 2.181 14.659 1.00 0.74 N ATOM 1377 CA PRO A 114 -8.849 0.833 15.232 1.00 0.68 C ATOM 1378 C PRO A 114 -7.659 0.490 16.138 1.00 0.82 C ATOM 1379 O PRO A 114 -6.626 1.165 16.116 1.00 1.00 O ATOM 1380 CB PRO A 114 -8.864 -0.100 14.020 1.00 0.56 C ATOM 1381 CG PRO A 114 -7.983 0.659 13.032 1.00 0.60 C ATOM 1382 CD PRO A 114 -8.429 2.093 13.246 1.00 0.70 C ATOM 0 HA PRO A 114 -9.728 0.741 15.870 1.00 0.68 H new ATOM 0 HB2 PRO A 114 -8.459 -1.084 14.256 1.00 0.56 H new ATOM 0 HB3 PRO A 114 -9.872 -0.254 13.635 1.00 0.56 H new ATOM 0 HG2 PRO A 114 -6.922 0.526 13.246 1.00 0.60 H new ATOM 0 HG3 PRO A 114 -8.145 0.330 12.005 1.00 0.60 H new ATOM 0 HD2 PRO A 114 -7.634 2.794 12.992 1.00 0.70 H new ATOM 0 HD3 PRO A 114 -9.284 2.337 12.615 1.00 0.70 H new ATOM 1390 N ALA A 115 -7.784 -0.613 16.881 1.00 0.83 N ATOM 1391 CA ALA A 115 -6.699 -1.243 17.622 1.00 0.98 C ATOM 1392 C ALA A 115 -5.855 -2.145 16.698 1.00 0.97 C ATOM 1393 O ALA A 115 -4.951 -1.669 16.013 1.00 1.64 O ATOM 1394 CB ALA A 115 -7.306 -1.969 18.834 1.00 1.13 C ATOM 0 H ALA A 115 -8.672 -1.104 16.984 1.00 0.83 H new ATOM 0 HA ALA A 115 -5.996 -0.501 18.001 1.00 0.98 H new ATOM 0 HB1 ALA A 115 -6.512 -2.449 19.406 1.00 1.13 H new ATOM 0 HB2 ALA A 115 -7.824 -1.249 19.467 1.00 1.13 H new ATOM 0 HB3 ALA A 115 -8.013 -2.724 18.489 1.00 1.13 H new ATOM 1400 N THR A 116 -6.202 -3.433 16.603 1.00 0.62 N ATOM 1401 CA THR A 116 -5.394 -4.505 15.985 1.00 0.57 C ATOM 1402 C THR A 116 -5.332 -4.518 14.451 1.00 0.49 C ATOM 1403 O THR A 116 -4.818 -5.463 13.862 1.00 0.52 O ATOM 1404 CB THR A 116 -5.818 -5.885 16.533 1.00 0.62 C ATOM 1405 OG1 THR A 116 -7.159 -6.188 16.208 1.00 0.70 O ATOM 1406 CG2 THR A 116 -5.750 -5.911 18.062 1.00 0.75 C ATOM 0 H THR A 116 -7.090 -3.778 16.968 1.00 0.62 H new ATOM 0 HA THR A 116 -4.371 -4.273 16.281 1.00 0.57 H new ATOM 0 HB THR A 116 -5.133 -6.604 16.083 1.00 0.62 H new ATOM 0 HG1 THR A 116 -7.392 -7.069 16.569 1.00 0.70 H new ATOM 0 HG21 THR A 116 -6.053 -6.894 18.423 1.00 0.75 H new ATOM 0 HG22 THR A 116 -4.729 -5.705 18.384 1.00 0.75 H new ATOM 0 HG23 THR A 116 -6.419 -5.153 18.469 1.00 0.75 H new ATOM 1414 N ALA A 117 -5.804 -3.472 13.769 1.00 0.46 N ATOM 1415 CA ALA A 117 -5.763 -3.377 12.304 1.00 0.40 C ATOM 1416 C ALA A 117 -4.341 -3.567 11.718 1.00 0.36 C ATOM 1417 O ALA A 117 -3.341 -3.172 12.326 1.00 0.40 O ATOM 1418 CB ALA A 117 -6.370 -2.033 11.882 1.00 0.40 C ATOM 0 H ALA A 117 -6.229 -2.661 14.219 1.00 0.46 H new ATOM 0 HA ALA A 117 -6.351 -4.198 11.894 1.00 0.40 H new ATOM 0 HB1 ALA A 117 -6.346 -1.948 10.796 1.00 0.40 H new ATOM 0 HB2 ALA A 117 -7.402 -1.975 12.228 1.00 0.40 H new ATOM 0 HB3 ALA A 117 -5.794 -1.219 12.322 1.00 0.40 H new ATOM 1424 N MET A 118 -4.256 -4.148 10.520 1.00 0.29 N ATOM 1425 CA MET A 118 -3.015 -4.397 9.782 1.00 0.28 C ATOM 1426 C MET A 118 -2.483 -3.085 9.194 1.00 0.27 C ATOM 1427 O MET A 118 -3.001 -2.581 8.201 1.00 0.32 O ATOM 1428 CB MET A 118 -3.297 -5.452 8.701 1.00 0.31 C ATOM 1429 CG MET A 118 -2.131 -5.650 7.731 1.00 0.43 C ATOM 1430 SD MET A 118 -2.256 -7.132 6.694 1.00 1.72 S ATOM 1431 CE MET A 118 -0.663 -7.913 7.061 1.00 0.57 C ATOM 0 H MET A 118 -5.082 -4.471 10.017 1.00 0.29 H new ATOM 0 HA MET A 118 -2.239 -4.782 10.444 1.00 0.28 H new ATOM 0 HB2 MET A 118 -3.526 -6.403 9.182 1.00 0.31 H new ATOM 0 HB3 MET A 118 -4.183 -5.158 8.138 1.00 0.31 H new ATOM 0 HG2 MET A 118 -2.061 -4.775 7.085 1.00 0.43 H new ATOM 0 HG3 MET A 118 -1.204 -5.700 8.303 1.00 0.43 H new ATOM 0 HE1 MET A 118 -0.330 -8.485 6.195 1.00 0.57 H new ATOM 0 HE2 MET A 118 0.074 -7.144 7.293 1.00 0.57 H new ATOM 0 HE3 MET A 118 -0.773 -8.580 7.916 1.00 0.57 H new ATOM 1441 N LYS A 119 -1.461 -2.510 9.828 1.00 0.34 N ATOM 1442 CA LYS A 119 -0.877 -1.195 9.501 1.00 0.35 C ATOM 1443 C LYS A 119 0.569 -1.079 9.997 1.00 0.38 C ATOM 1444 O LYS A 119 0.897 -1.615 11.058 1.00 0.47 O ATOM 1445 CB LYS A 119 -1.741 -0.093 10.130 1.00 0.38 C ATOM 1446 CG LYS A 119 -1.856 -0.181 11.661 1.00 0.42 C ATOM 1447 CD LYS A 119 -3.252 0.244 12.128 1.00 0.51 C ATOM 1448 CE LYS A 119 -3.505 -0.098 13.608 1.00 0.67 C ATOM 1449 NZ LYS A 119 -2.479 0.443 14.522 1.00 0.94 N ATOM 0 H LYS A 119 -0.994 -2.960 10.615 1.00 0.34 H new ATOM 0 HA LYS A 119 -0.859 -1.084 8.417 1.00 0.35 H new ATOM 0 HB2 LYS A 119 -1.323 0.878 9.863 1.00 0.38 H new ATOM 0 HB3 LYS A 119 -2.741 -0.139 9.698 1.00 0.38 H new ATOM 0 HG2 LYS A 119 -1.654 -1.201 11.987 1.00 0.42 H new ATOM 0 HG3 LYS A 119 -1.103 0.457 12.124 1.00 0.42 H new ATOM 0 HD2 LYS A 119 -3.370 1.317 11.981 1.00 0.51 H new ATOM 0 HD3 LYS A 119 -4.004 -0.247 11.511 1.00 0.51 H new ATOM 0 HE2 LYS A 119 -4.481 0.289 13.900 1.00 0.67 H new ATOM 0 HE3 LYS A 119 -3.545 -1.181 13.720 1.00 0.67 H new ATOM 0 HZ1 LYS A 119 -2.754 0.249 15.506 1.00 0.94 H new ATOM 0 HZ2 LYS A 119 -1.564 -0.009 14.323 1.00 0.94 H new ATOM 0 HZ3 LYS A 119 -2.396 1.470 14.381 1.00 0.94 H new ATOM 1463 N LYS A 120 1.418 -0.372 9.248 1.00 0.37 N ATOM 1464 CA LYS A 120 2.807 -0.015 9.602 1.00 0.42 C ATOM 1465 C LYS A 120 3.342 1.039 8.623 1.00 0.35 C ATOM 1466 O LYS A 120 2.855 1.148 7.503 1.00 0.52 O ATOM 1467 CB LYS A 120 3.687 -1.292 9.674 1.00 0.79 C ATOM 1468 CG LYS A 120 5.194 -1.047 9.554 1.00 0.75 C ATOM 1469 CD LYS A 120 6.018 -2.288 9.866 1.00 1.04 C ATOM 1470 CE LYS A 120 5.771 -3.505 8.981 1.00 1.63 C ATOM 1471 NZ LYS A 120 6.598 -4.642 9.443 1.00 2.61 N ATOM 0 H LYS A 120 1.149 -0.012 8.332 1.00 0.37 H new ATOM 0 HA LYS A 120 2.837 0.436 10.594 1.00 0.42 H new ATOM 0 HB2 LYS A 120 3.490 -1.798 10.619 1.00 0.79 H new ATOM 0 HB3 LYS A 120 3.380 -1.972 8.879 1.00 0.79 H new ATOM 0 HG2 LYS A 120 5.423 -0.708 8.544 1.00 0.75 H new ATOM 0 HG3 LYS A 120 5.483 -0.244 10.233 1.00 0.75 H new ATOM 0 HD2 LYS A 120 7.073 -2.024 9.797 1.00 1.04 H new ATOM 0 HD3 LYS A 120 5.828 -2.573 10.901 1.00 1.04 H new ATOM 0 HE2 LYS A 120 4.716 -3.777 9.009 1.00 1.63 H new ATOM 0 HE3 LYS A 120 6.012 -3.267 7.945 1.00 1.63 H new ATOM 0 HZ1 LYS A 120 6.450 -5.457 8.814 1.00 2.61 H new ATOM 0 HZ2 LYS A 120 7.602 -4.370 9.427 1.00 2.61 H new ATOM 0 HZ3 LYS A 120 6.325 -4.899 10.413 1.00 2.61 H new ATOM 1485 N LEU A 121 4.348 1.798 9.056 1.00 0.38 N ATOM 1486 CA LEU A 121 5.064 2.796 8.254 1.00 0.36 C ATOM 1487 C LEU A 121 6.251 2.213 7.459 1.00 0.36 C ATOM 1488 O LEU A 121 6.919 1.293 7.938 1.00 0.39 O ATOM 1489 CB LEU A 121 5.550 3.951 9.145 1.00 0.41 C ATOM 1490 CG LEU A 121 4.404 4.718 9.824 1.00 0.43 C ATOM 1491 CD1 LEU A 121 4.027 4.163 11.197 1.00 0.45 C ATOM 1492 CD2 LEU A 121 4.791 6.179 9.996 1.00 0.49 C ATOM 0 H LEU A 121 4.702 1.734 10.011 1.00 0.38 H new ATOM 0 HA LEU A 121 4.347 3.165 7.520 1.00 0.36 H new ATOM 0 HB2 LEU A 121 6.216 3.554 9.911 1.00 0.41 H new ATOM 0 HB3 LEU A 121 6.135 4.645 8.542 1.00 0.41 H new ATOM 0 HG LEU A 121 3.539 4.605 9.170 1.00 0.43 H new ATOM 0 HD11 LEU A 121 3.212 4.753 11.617 1.00 0.45 H new ATOM 0 HD12 LEU A 121 3.709 3.125 11.095 1.00 0.45 H new ATOM 0 HD13 LEU A 121 4.891 4.214 11.860 1.00 0.45 H new ATOM 0 HD21 LEU A 121 3.975 6.717 10.478 1.00 0.49 H new ATOM 0 HD22 LEU A 121 5.686 6.248 10.614 1.00 0.49 H new ATOM 0 HD23 LEU A 121 4.990 6.620 9.019 1.00 0.49 H new ATOM 1504 N THR A 122 6.591 2.786 6.295 1.00 0.37 N ATOM 1505 CA THR A 122 7.846 2.454 5.578 1.00 0.40 C ATOM 1506 C THR A 122 9.066 2.866 6.423 1.00 0.43 C ATOM 1507 O THR A 122 9.131 3.996 6.911 1.00 0.45 O ATOM 1508 CB THR A 122 7.919 3.088 4.166 1.00 0.43 C ATOM 1509 OG1 THR A 122 7.313 4.359 4.141 1.00 0.43 O ATOM 1510 CG2 THR A 122 7.273 2.263 3.050 1.00 0.55 C ATOM 0 H THR A 122 6.017 3.485 5.823 1.00 0.37 H new ATOM 0 HA THR A 122 7.854 1.374 5.433 1.00 0.40 H new ATOM 0 HB THR A 122 8.990 3.142 3.970 1.00 0.43 H new ATOM 0 HG1 THR A 122 7.446 4.768 3.260 1.00 0.43 H new ATOM 0 HG21 THR A 122 7.376 2.790 2.102 1.00 0.55 H new ATOM 0 HG22 THR A 122 7.767 1.294 2.982 1.00 0.55 H new ATOM 0 HG23 THR A 122 6.216 2.117 3.271 1.00 0.55 H new ATOM 1518 N GLU A 123 10.045 1.972 6.629 1.00 0.50 N ATOM 1519 CA GLU A 123 11.195 2.257 7.519 1.00 0.58 C ATOM 1520 C GLU A 123 12.294 3.100 6.867 1.00 0.68 C ATOM 1521 O GLU A 123 12.656 4.171 7.361 1.00 0.79 O ATOM 1522 CB GLU A 123 11.813 0.998 8.154 1.00 0.65 C ATOM 1523 CG GLU A 123 11.909 -0.232 7.258 1.00 0.74 C ATOM 1524 CD GLU A 123 12.770 -1.329 7.895 1.00 1.12 C ATOM 1525 OE1 GLU A 123 14.000 -1.140 8.061 1.00 1.92 O ATOM 1526 OE2 GLU A 123 12.214 -2.405 8.223 1.00 2.08 O ATOM 0 H GLU A 123 10.069 1.049 6.197 1.00 0.50 H new ATOM 0 HA GLU A 123 10.750 2.853 8.316 1.00 0.58 H new ATOM 0 HB2 GLU A 123 12.815 1.247 8.502 1.00 0.65 H new ATOM 0 HB3 GLU A 123 11.226 0.735 9.034 1.00 0.65 H new ATOM 0 HG2 GLU A 123 10.909 -0.620 7.064 1.00 0.74 H new ATOM 0 HG3 GLU A 123 12.334 0.051 6.295 1.00 0.74 H new ATOM 1533 N ALA A 124 12.821 2.598 5.755 1.00 0.70 N ATOM 1534 CA ALA A 124 13.880 3.207 4.960 1.00 0.86 C ATOM 1535 C ALA A 124 13.761 2.751 3.499 1.00 0.91 C ATOM 1536 O ALA A 124 13.807 3.568 2.585 1.00 1.18 O ATOM 1537 CB ALA A 124 15.227 2.815 5.576 1.00 0.92 C ATOM 0 H ALA A 124 12.504 1.710 5.365 1.00 0.70 H new ATOM 0 HA ALA A 124 13.796 4.294 4.965 1.00 0.86 H new ATOM 0 HB1 ALA A 124 16.036 3.260 4.996 1.00 0.92 H new ATOM 0 HB2 ALA A 124 15.276 3.175 6.604 1.00 0.92 H new ATOM 0 HB3 ALA A 124 15.329 1.730 5.567 1.00 0.92 H new ATOM 1543 N GLU A 125 13.503 1.460 3.274 1.00 0.84 N ATOM 1544 CA GLU A 125 13.330 0.877 1.937 1.00 1.11 C ATOM 1545 C GLU A 125 11.864 0.574 1.593 1.00 1.17 C ATOM 1546 O GLU A 125 11.444 0.698 0.441 1.00 2.09 O ATOM 1547 CB GLU A 125 14.159 -0.415 1.833 1.00 1.24 C ATOM 1548 CG GLU A 125 15.557 -0.404 2.480 1.00 1.59 C ATOM 1549 CD GLU A 125 15.559 -0.769 3.975 1.00 3.42 C ATOM 1550 OE1 GLU A 125 14.505 -0.737 4.661 1.00 4.58 O ATOM 1551 OE2 GLU A 125 16.636 -1.112 4.519 1.00 4.51 O ATOM 0 H GLU A 125 13.407 0.778 4.026 1.00 0.84 H new ATOM 0 HA GLU A 125 13.676 1.620 1.219 1.00 1.11 H new ATOM 0 HB2 GLU A 125 13.584 -1.224 2.284 1.00 1.24 H new ATOM 0 HB3 GLU A 125 14.277 -0.658 0.777 1.00 1.24 H new ATOM 0 HG2 GLU A 125 16.199 -1.104 1.945 1.00 1.59 H new ATOM 0 HG3 GLU A 125 15.994 0.587 2.358 1.00 1.59 H new ATOM 1558 N GLY A 126 11.084 0.206 2.609 1.00 0.61 N ATOM 1559 CA GLY A 126 9.733 -0.343 2.506 1.00 0.53 C ATOM 1560 C GLY A 126 9.227 -0.816 3.881 1.00 0.55 C ATOM 1561 O GLY A 126 9.880 -0.538 4.889 1.00 0.72 O ATOM 0 H GLY A 126 11.394 0.287 3.577 1.00 0.61 H new ATOM 0 HA2 GLY A 126 9.058 0.414 2.106 1.00 0.53 H new ATOM 0 HA3 GLY A 126 9.728 -1.178 1.805 1.00 0.53 H new ATOM 1565 N ALA A 127 8.091 -1.515 3.942 1.00 0.49 N ATOM 1566 CA ALA A 127 7.553 -2.199 5.132 1.00 0.51 C ATOM 1567 C ALA A 127 7.056 -3.613 4.768 1.00 0.48 C ATOM 1568 O ALA A 127 6.374 -3.778 3.757 1.00 0.49 O ATOM 1569 CB ALA A 127 6.432 -1.347 5.739 1.00 0.57 C ATOM 0 H ALA A 127 7.489 -1.628 3.127 1.00 0.49 H new ATOM 0 HA ALA A 127 8.342 -2.317 5.874 1.00 0.51 H new ATOM 0 HB1 ALA A 127 6.030 -1.848 6.620 1.00 0.57 H new ATOM 0 HB2 ALA A 127 6.829 -0.373 6.025 1.00 0.57 H new ATOM 0 HB3 ALA A 127 5.638 -1.213 5.004 1.00 0.57 H new ATOM 1575 N LYS A 128 7.356 -4.631 5.586 1.00 0.47 N ATOM 1576 CA LYS A 128 6.945 -6.028 5.350 1.00 0.43 C ATOM 1577 C LYS A 128 5.676 -6.390 6.126 1.00 0.51 C ATOM 1578 O LYS A 128 5.611 -6.173 7.332 1.00 0.75 O ATOM 1579 CB LYS A 128 8.091 -6.993 5.690 1.00 0.50 C ATOM 1580 CG LYS A 128 7.871 -8.355 5.004 1.00 1.19 C ATOM 1581 CD LYS A 128 8.738 -9.458 5.616 1.00 1.29 C ATOM 1582 CE LYS A 128 8.102 -10.016 6.898 1.00 1.00 C ATOM 1583 NZ LYS A 128 9.027 -10.954 7.570 1.00 1.36 N ATOM 0 H LYS A 128 7.898 -4.509 6.442 1.00 0.47 H new ATOM 0 HA LYS A 128 6.711 -6.126 4.290 1.00 0.43 H new ATOM 0 HB2 LYS A 128 9.041 -6.566 5.368 1.00 0.50 H new ATOM 0 HB3 LYS A 128 8.152 -7.129 6.770 1.00 0.50 H new ATOM 0 HG2 LYS A 128 6.821 -8.635 5.084 1.00 1.19 H new ATOM 0 HG3 LYS A 128 8.097 -8.265 3.941 1.00 1.19 H new ATOM 0 HD2 LYS A 128 8.872 -10.263 4.893 1.00 1.29 H new ATOM 0 HD3 LYS A 128 9.729 -9.063 5.840 1.00 1.29 H new ATOM 0 HE2 LYS A 128 7.851 -9.197 7.573 1.00 1.00 H new ATOM 0 HE3 LYS A 128 7.170 -10.526 6.656 1.00 1.00 H new ATOM 0 HZ1 LYS A 128 8.581 -11.322 8.435 1.00 1.36 H new ATOM 0 HZ2 LYS A 128 9.245 -11.744 6.930 1.00 1.36 H new ATOM 0 HZ3 LYS A 128 9.906 -10.457 7.818 1.00 1.36 H new ATOM 1597 N PHE A 129 4.689 -6.949 5.432 1.00 0.38 N ATOM 1598 CA PHE A 129 3.387 -7.381 5.949 1.00 0.38 C ATOM 1599 C PHE A 129 3.278 -8.906 5.734 1.00 0.38 C ATOM 1600 O PHE A 129 3.676 -9.409 4.682 1.00 0.51 O ATOM 1601 CB PHE A 129 2.283 -6.576 5.229 1.00 0.39 C ATOM 1602 CG PHE A 129 2.073 -5.131 5.692 1.00 0.42 C ATOM 1603 CD1 PHE A 129 3.136 -4.205 5.742 1.00 1.75 C ATOM 1604 CD2 PHE A 129 0.785 -4.687 6.050 1.00 1.56 C ATOM 1605 CE1 PHE A 129 2.926 -2.895 6.204 1.00 1.73 C ATOM 1606 CE2 PHE A 129 0.567 -3.368 6.487 1.00 1.59 C ATOM 1607 CZ PHE A 129 1.639 -2.468 6.557 1.00 0.43 C ATOM 0 H PHE A 129 4.779 -7.125 4.431 1.00 0.38 H new ATOM 0 HA PHE A 129 3.273 -7.190 7.016 1.00 0.38 H new ATOM 0 HB2 PHE A 129 2.512 -6.562 4.163 1.00 0.39 H new ATOM 0 HB3 PHE A 129 1.341 -7.111 5.346 1.00 0.39 H new ATOM 0 HD1 PHE A 129 4.122 -4.506 5.422 1.00 1.75 H new ATOM 0 HD2 PHE A 129 -0.049 -5.371 5.988 1.00 1.56 H new ATOM 0 HE1 PHE A 129 3.760 -2.214 6.287 1.00 1.73 H new ATOM 0 HE2 PHE A 129 -0.426 -3.049 6.768 1.00 1.59 H new ATOM 0 HZ PHE A 129 1.474 -1.451 6.881 1.00 0.43 H new ATOM 1617 N ASN A 130 2.796 -9.675 6.715 1.00 0.42 N ATOM 1618 CA ASN A 130 2.869 -11.143 6.678 1.00 0.44 C ATOM 1619 C ASN A 130 1.560 -11.769 6.155 1.00 0.52 C ATOM 1620 O ASN A 130 0.563 -11.862 6.870 1.00 0.89 O ATOM 1621 CB ASN A 130 3.216 -11.625 8.089 1.00 0.57 C ATOM 1622 CG ASN A 130 3.649 -13.072 8.105 1.00 1.00 C ATOM 1623 OD1 ASN A 130 4.767 -13.397 7.734 1.00 1.90 O ATOM 1624 ND2 ASN A 130 2.803 -13.974 8.527 1.00 1.13 N ATOM 0 H ASN A 130 2.347 -9.303 7.552 1.00 0.42 H new ATOM 0 HA ASN A 130 3.642 -11.463 5.979 1.00 0.44 H new ATOM 0 HB2 ASN A 130 4.013 -11.004 8.498 1.00 0.57 H new ATOM 0 HB3 ASN A 130 2.349 -11.499 8.738 1.00 0.57 H new ATOM 0 HD21 ASN A 130 3.074 -14.957 8.548 1.00 1.13 H new ATOM 0 HD22 ASN A 130 1.872 -13.695 8.835 1.00 1.13 H new ATOM 1631 N THR A 131 1.553 -12.241 4.911 1.00 0.46 N ATOM 1632 CA THR A 131 0.361 -12.765 4.220 1.00 0.52 C ATOM 1633 C THR A 131 0.110 -14.251 4.486 1.00 0.60 C ATOM 1634 O THR A 131 -0.874 -14.802 3.993 1.00 0.73 O ATOM 1635 CB THR A 131 0.427 -12.479 2.712 1.00 0.58 C ATOM 1636 OG1 THR A 131 1.638 -12.957 2.183 1.00 0.63 O ATOM 1637 CG2 THR A 131 0.365 -10.984 2.408 1.00 0.58 C ATOM 0 H THR A 131 2.394 -12.274 4.334 1.00 0.46 H new ATOM 0 HA THR A 131 -0.492 -12.232 4.641 1.00 0.52 H new ATOM 0 HB THR A 131 -0.432 -12.979 2.264 1.00 0.58 H new ATOM 0 HG1 THR A 131 1.671 -12.772 1.221 1.00 0.63 H new ATOM 0 HG21 THR A 131 0.415 -10.830 1.330 1.00 0.58 H new ATOM 0 HG22 THR A 131 -0.569 -10.573 2.791 1.00 0.58 H new ATOM 0 HG23 THR A 131 1.205 -10.480 2.886 1.00 0.58 H new ATOM 1645 N ALA A 132 0.936 -14.906 5.312 1.00 0.57 N ATOM 1646 CA ALA A 132 0.676 -16.258 5.818 1.00 0.61 C ATOM 1647 C ALA A 132 -0.634 -16.331 6.635 1.00 0.75 C ATOM 1648 O ALA A 132 -1.301 -17.369 6.681 1.00 0.88 O ATOM 1649 CB ALA A 132 1.851 -16.676 6.706 1.00 0.66 C ATOM 0 H ALA A 132 1.812 -14.508 5.650 1.00 0.57 H new ATOM 0 HA ALA A 132 0.568 -16.929 4.966 1.00 0.61 H new ATOM 0 HB1 ALA A 132 1.676 -17.680 7.092 1.00 0.66 H new ATOM 0 HB2 ALA A 132 2.770 -16.668 6.121 1.00 0.66 H new ATOM 0 HB3 ALA A 132 1.944 -15.978 7.538 1.00 0.66 H new ATOM 1655 N ASN A 133 -1.009 -15.217 7.274 1.00 0.91 N ATOM 1656 CA ASN A 133 -2.158 -15.102 8.169 1.00 1.17 C ATOM 1657 C ASN A 133 -3.467 -14.775 7.434 1.00 1.08 C ATOM 1658 O ASN A 133 -4.532 -15.074 7.963 1.00 1.21 O ATOM 1659 CB ASN A 133 -1.808 -14.049 9.232 1.00 1.46 C ATOM 1660 CG ASN A 133 -0.628 -14.434 10.085 1.00 1.37 C ATOM 1661 OD1 ASN A 133 0.428 -13.818 10.041 1.00 2.30 O ATOM 1662 ND2 ASN A 133 -0.752 -15.471 10.868 1.00 1.55 N ATOM 0 H ASN A 133 -0.499 -14.339 7.176 1.00 0.91 H new ATOM 0 HA ASN A 133 -2.349 -16.067 8.639 1.00 1.17 H new ATOM 0 HB2 ASN A 133 -1.597 -13.101 8.738 1.00 1.46 H new ATOM 0 HB3 ASN A 133 -2.674 -13.888 9.874 1.00 1.46 H new ATOM 0 HD21 ASN A 133 0.033 -15.770 11.446 1.00 1.55 H new ATOM 0 HD22 ASN A 133 -1.634 -15.982 10.902 1.00 1.55 H new ATOM 1669 N LEU A 134 -3.418 -14.225 6.215 1.00 0.87 N ATOM 1670 CA LEU A 134 -4.622 -13.971 5.434 1.00 0.80 C ATOM 1671 C LEU A 134 -5.173 -15.229 4.741 1.00 0.88 C ATOM 1672 O LEU A 134 -4.391 -16.047 4.240 1.00 0.92 O ATOM 1673 CB LEU A 134 -4.363 -12.888 4.369 1.00 0.64 C ATOM 1674 CG LEU A 134 -4.376 -11.419 4.815 1.00 0.59 C ATOM 1675 CD1 LEU A 134 -5.439 -11.119 5.868 1.00 0.62 C ATOM 1676 CD2 LEU A 134 -3.013 -10.956 5.303 1.00 0.60 C ATOM 0 H LEU A 134 -2.552 -13.949 5.752 1.00 0.87 H new ATOM 0 HA LEU A 134 -5.372 -13.630 6.148 1.00 0.80 H new ATOM 0 HB2 LEU A 134 -3.392 -13.091 3.916 1.00 0.64 H new ATOM 0 HB3 LEU A 134 -5.111 -13.005 3.585 1.00 0.64 H new ATOM 0 HG LEU A 134 -4.635 -10.853 3.920 1.00 0.59 H new ATOM 0 HD11 LEU A 134 -5.395 -10.064 6.140 1.00 0.62 H new ATOM 0 HD12 LEU A 134 -6.425 -11.349 5.465 1.00 0.62 H new ATOM 0 HD13 LEU A 134 -5.257 -11.729 6.753 1.00 0.62 H new ATOM 0 HD21 LEU A 134 -3.071 -9.911 5.608 1.00 0.60 H new ATOM 0 HD22 LEU A 134 -2.705 -11.565 6.153 1.00 0.60 H new ATOM 0 HD23 LEU A 134 -2.284 -11.059 4.499 1.00 0.60 H new ATOM 1688 N PRO A 135 -6.509 -15.358 4.640 1.00 0.96 N ATOM 1689 CA PRO A 135 -7.139 -16.336 3.767 1.00 1.05 C ATOM 1690 C PRO A 135 -7.122 -15.853 2.306 1.00 0.97 C ATOM 1691 O PRO A 135 -6.837 -14.689 1.997 1.00 0.85 O ATOM 1692 CB PRO A 135 -8.563 -16.505 4.296 1.00 1.19 C ATOM 1693 CG PRO A 135 -8.879 -15.123 4.876 1.00 1.11 C ATOM 1694 CD PRO A 135 -7.524 -14.613 5.378 1.00 1.00 C ATOM 0 HA PRO A 135 -6.609 -17.288 3.770 1.00 1.05 H new ATOM 0 HB2 PRO A 135 -9.259 -16.779 3.503 1.00 1.19 H new ATOM 0 HB3 PRO A 135 -8.622 -17.285 5.055 1.00 1.19 H new ATOM 0 HG2 PRO A 135 -9.300 -14.460 4.120 1.00 1.11 H new ATOM 0 HG3 PRO A 135 -9.606 -15.187 5.685 1.00 1.11 H new ATOM 0 HD2 PRO A 135 -7.423 -13.542 5.205 1.00 1.00 H new ATOM 0 HD3 PRO A 135 -7.421 -14.774 6.451 1.00 1.00 H new ATOM 1702 N ALA A 136 -7.471 -16.751 1.392 1.00 1.06 N ATOM 1703 CA ALA A 136 -7.454 -16.557 -0.046 1.00 1.06 C ATOM 1704 C ALA A 136 -8.617 -15.655 -0.488 1.00 1.09 C ATOM 1705 O ALA A 136 -9.720 -16.129 -0.767 1.00 1.33 O ATOM 1706 CB ALA A 136 -7.517 -17.959 -0.657 1.00 1.20 C ATOM 0 H ALA A 136 -7.790 -17.684 1.653 1.00 1.06 H new ATOM 0 HA ALA A 136 -6.554 -16.043 -0.384 1.00 1.06 H new ATOM 0 HB1 ALA A 136 -7.508 -17.883 -1.744 1.00 1.20 H new ATOM 0 HB2 ALA A 136 -6.655 -18.539 -0.326 1.00 1.20 H new ATOM 0 HB3 ALA A 136 -8.433 -18.455 -0.336 1.00 1.20 H new ATOM 1712 N ALA A 137 -8.376 -14.343 -0.515 1.00 0.90 N ATOM 1713 CA ALA A 137 -9.352 -13.348 -0.937 1.00 0.84 C ATOM 1714 C ALA A 137 -8.680 -12.115 -1.591 1.00 0.76 C ATOM 1715 O ALA A 137 -7.447 -12.022 -1.646 1.00 0.77 O ATOM 1716 CB ALA A 137 -10.183 -12.946 0.292 1.00 0.80 C ATOM 0 H ALA A 137 -7.481 -13.940 -0.239 1.00 0.90 H new ATOM 0 HA ALA A 137 -9.998 -13.777 -1.702 1.00 0.84 H new ATOM 0 HB1 ALA A 137 -10.923 -12.200 0.003 1.00 0.80 H new ATOM 0 HB2 ALA A 137 -10.690 -13.824 0.691 1.00 0.80 H new ATOM 0 HB3 ALA A 137 -9.526 -12.528 1.055 1.00 0.80 H new ATOM 1722 N LYS A 138 -9.487 -11.152 -2.060 1.00 0.70 N ATOM 1723 CA LYS A 138 -9.028 -9.809 -2.454 1.00 0.66 C ATOM 1724 C LYS A 138 -9.001 -8.850 -1.262 1.00 0.62 C ATOM 1725 O LYS A 138 -9.868 -8.884 -0.384 1.00 0.60 O ATOM 1726 CB LYS A 138 -9.887 -9.222 -3.584 1.00 0.69 C ATOM 1727 CG LYS A 138 -9.386 -9.651 -4.967 1.00 0.71 C ATOM 1728 CD LYS A 138 -10.144 -8.870 -6.047 1.00 1.06 C ATOM 1729 CE LYS A 138 -9.706 -9.339 -7.432 1.00 2.26 C ATOM 1730 NZ LYS A 138 -10.195 -8.435 -8.503 1.00 2.72 N ATOM 0 H LYS A 138 -10.491 -11.285 -2.178 1.00 0.70 H new ATOM 0 HA LYS A 138 -8.010 -9.925 -2.825 1.00 0.66 H new ATOM 0 HB2 LYS A 138 -10.921 -9.543 -3.457 1.00 0.69 H new ATOM 0 HB3 LYS A 138 -9.880 -8.134 -3.517 1.00 0.69 H new ATOM 0 HG2 LYS A 138 -8.315 -9.465 -5.052 1.00 0.71 H new ATOM 0 HG3 LYS A 138 -9.536 -10.722 -5.104 1.00 0.71 H new ATOM 0 HD2 LYS A 138 -11.218 -9.015 -5.927 1.00 1.06 H new ATOM 0 HD3 LYS A 138 -9.953 -7.802 -5.938 1.00 1.06 H new ATOM 0 HE2 LYS A 138 -8.618 -9.392 -7.470 1.00 2.26 H new ATOM 0 HE3 LYS A 138 -10.080 -10.347 -7.609 1.00 2.26 H new ATOM 0 HZ1 LYS A 138 -9.920 -8.816 -9.431 1.00 2.72 H new ATOM 0 HZ2 LYS A 138 -11.231 -8.364 -8.451 1.00 2.72 H new ATOM 0 HZ3 LYS A 138 -9.777 -7.491 -8.378 1.00 2.72 H new ATOM 1744 N TYR A 139 -8.034 -7.943 -1.294 1.00 0.60 N ATOM 1745 CA TYR A 139 -7.758 -6.917 -0.292 1.00 0.48 C ATOM 1746 C TYR A 139 -7.474 -5.577 -0.987 1.00 0.43 C ATOM 1747 O TYR A 139 -7.298 -5.519 -2.208 1.00 0.55 O ATOM 1748 CB TYR A 139 -6.559 -7.358 0.561 1.00 0.47 C ATOM 1749 CG TYR A 139 -6.760 -8.680 1.271 1.00 0.53 C ATOM 1750 CD1 TYR A 139 -6.416 -9.883 0.621 1.00 0.59 C ATOM 1751 CD2 TYR A 139 -7.316 -8.707 2.563 1.00 0.55 C ATOM 1752 CE1 TYR A 139 -6.672 -11.117 1.243 1.00 0.65 C ATOM 1753 CE2 TYR A 139 -7.574 -9.945 3.182 1.00 0.60 C ATOM 1754 CZ TYR A 139 -7.275 -11.143 2.513 1.00 0.63 C ATOM 1755 OH TYR A 139 -7.581 -12.319 3.103 1.00 0.69 O ATOM 0 H TYR A 139 -7.376 -7.900 -2.072 1.00 0.60 H new ATOM 0 HA TYR A 139 -8.623 -6.786 0.358 1.00 0.48 H new ATOM 0 HB2 TYR A 139 -5.679 -7.431 -0.078 1.00 0.47 H new ATOM 0 HB3 TYR A 139 -6.351 -6.587 1.303 1.00 0.47 H new ATOM 0 HD1 TYR A 139 -5.955 -9.856 -0.356 1.00 0.59 H new ATOM 0 HD2 TYR A 139 -7.543 -7.784 3.076 1.00 0.55 H new ATOM 0 HE1 TYR A 139 -6.407 -12.040 0.748 1.00 0.65 H new ATOM 0 HE2 TYR A 139 -8.003 -9.973 4.173 1.00 0.60 H new ATOM 0 HH TYR A 139 -7.114 -13.047 2.643 1.00 0.69 H new ATOM 1765 N LYS A 140 -7.395 -4.495 -0.212 1.00 0.34 N ATOM 1766 CA LYS A 140 -6.962 -3.171 -0.701 1.00 0.39 C ATOM 1767 C LYS A 140 -6.069 -2.455 0.314 1.00 0.33 C ATOM 1768 O LYS A 140 -6.253 -2.640 1.516 1.00 0.34 O ATOM 1769 CB LYS A 140 -8.162 -2.284 -1.104 1.00 0.49 C ATOM 1770 CG LYS A 140 -9.101 -2.909 -2.137 1.00 0.65 C ATOM 1771 CD LYS A 140 -10.095 -1.883 -2.692 1.00 0.70 C ATOM 1772 CE LYS A 140 -11.129 -2.669 -3.508 1.00 0.78 C ATOM 1773 NZ LYS A 140 -11.900 -1.831 -4.456 1.00 1.67 N ATOM 0 H LYS A 140 -7.630 -4.505 0.781 1.00 0.34 H new ATOM 0 HA LYS A 140 -6.368 -3.348 -1.598 1.00 0.39 H new ATOM 0 HB2 LYS A 140 -8.736 -2.045 -0.209 1.00 0.49 H new ATOM 0 HB3 LYS A 140 -7.783 -1.342 -1.501 1.00 0.49 H new ATOM 0 HG2 LYS A 140 -8.515 -3.328 -2.955 1.00 0.65 H new ATOM 0 HG3 LYS A 140 -9.647 -3.735 -1.680 1.00 0.65 H new ATOM 0 HD2 LYS A 140 -10.577 -1.334 -1.883 1.00 0.70 H new ATOM 0 HD3 LYS A 140 -9.586 -1.149 -3.317 1.00 0.70 H new ATOM 0 HE2 LYS A 140 -10.619 -3.455 -4.064 1.00 0.78 H new ATOM 0 HE3 LYS A 140 -11.822 -3.160 -2.824 1.00 0.78 H new ATOM 0 HZ1 LYS A 140 -12.579 -2.426 -4.973 1.00 1.67 H new ATOM 0 HZ2 LYS A 140 -12.414 -1.096 -3.930 1.00 1.67 H new ATOM 0 HZ3 LYS A 140 -11.249 -1.382 -5.131 1.00 1.67 H new ATOM 1787 N ILE A 141 -5.137 -1.616 -0.142 1.00 0.44 N ATOM 1788 CA ILE A 141 -4.314 -0.762 0.739 1.00 0.41 C ATOM 1789 C ILE A 141 -4.813 0.685 0.684 1.00 0.41 C ATOM 1790 O ILE A 141 -5.153 1.195 -0.386 1.00 0.43 O ATOM 1791 CB ILE A 141 -2.794 -0.867 0.451 1.00 0.39 C ATOM 1792 CG1 ILE A 141 -2.248 -2.299 0.662 1.00 0.41 C ATOM 1793 CG2 ILE A 141 -1.974 0.059 1.368 1.00 0.35 C ATOM 1794 CD1 ILE A 141 -2.300 -3.131 -0.616 1.00 0.42 C ATOM 0 H ILE A 141 -4.926 -1.504 -1.134 1.00 0.44 H new ATOM 0 HA ILE A 141 -4.435 -1.134 1.756 1.00 0.41 H new ATOM 0 HB ILE A 141 -2.686 -0.575 -0.594 1.00 0.39 H new ATOM 0 HG12 ILE A 141 -1.219 -2.245 1.016 1.00 0.41 H new ATOM 0 HG13 ILE A 141 -2.827 -2.796 1.440 1.00 0.41 H new ATOM 0 HG21 ILE A 141 -0.914 -0.044 1.135 1.00 0.35 H new ATOM 0 HG22 ILE A 141 -2.282 1.093 1.210 1.00 0.35 H new ATOM 0 HG23 ILE A 141 -2.145 -0.216 2.409 1.00 0.35 H new ATOM 0 HD11 ILE A 141 -1.906 -4.128 -0.417 1.00 0.42 H new ATOM 0 HD12 ILE A 141 -3.332 -3.210 -0.957 1.00 0.42 H new ATOM 0 HD13 ILE A 141 -1.699 -2.650 -1.388 1.00 0.42 H new ATOM 1806 N TYR A 142 -4.817 1.336 1.847 1.00 0.41 N ATOM 1807 CA TYR A 142 -5.133 2.750 2.037 1.00 0.46 C ATOM 1808 C TYR A 142 -3.977 3.449 2.763 1.00 0.52 C ATOM 1809 O TYR A 142 -3.439 2.920 3.733 1.00 0.54 O ATOM 1810 CB TYR A 142 -6.451 2.867 2.813 1.00 0.44 C ATOM 1811 CG TYR A 142 -7.683 2.671 1.953 1.00 0.43 C ATOM 1812 CD1 TYR A 142 -8.065 1.387 1.502 1.00 1.87 C ATOM 1813 CD2 TYR A 142 -8.449 3.795 1.595 1.00 1.72 C ATOM 1814 CE1 TYR A 142 -9.202 1.223 0.693 1.00 1.87 C ATOM 1815 CE2 TYR A 142 -9.597 3.628 0.806 1.00 1.73 C ATOM 1816 CZ TYR A 142 -9.973 2.350 0.351 1.00 0.45 C ATOM 1817 OH TYR A 142 -11.082 2.212 -0.416 1.00 0.48 O ATOM 0 H TYR A 142 -4.589 0.868 2.724 1.00 0.41 H new ATOM 0 HA TYR A 142 -5.259 3.244 1.074 1.00 0.46 H new ATOM 0 HB2 TYR A 142 -6.457 2.129 3.615 1.00 0.44 H new ATOM 0 HB3 TYR A 142 -6.500 3.849 3.284 1.00 0.44 H new ATOM 0 HD1 TYR A 142 -7.478 0.525 1.782 1.00 1.87 H new ATOM 0 HD2 TYR A 142 -8.155 4.780 1.925 1.00 1.72 H new ATOM 0 HE1 TYR A 142 -9.482 0.242 0.337 1.00 1.87 H new ATOM 0 HE2 TYR A 142 -10.197 4.487 0.546 1.00 1.73 H new ATOM 0 HH TYR A 142 -11.495 3.090 -0.555 1.00 0.48 H new ATOM 1827 N GLU A 143 -3.588 4.639 2.306 1.00 0.60 N ATOM 1828 CA GLU A 143 -2.523 5.448 2.915 1.00 0.57 C ATOM 1829 C GLU A 143 -3.148 6.502 3.836 1.00 0.60 C ATOM 1830 O GLU A 143 -3.985 7.281 3.384 1.00 0.84 O ATOM 1831 CB GLU A 143 -1.676 6.082 1.805 1.00 0.66 C ATOM 1832 CG GLU A 143 -0.439 6.807 2.339 1.00 0.66 C ATOM 1833 CD GLU A 143 0.260 7.563 1.208 1.00 0.80 C ATOM 1834 OE1 GLU A 143 0.743 6.922 0.252 1.00 1.84 O ATOM 1835 OE2 GLU A 143 0.330 8.815 1.255 1.00 1.59 O ATOM 0 H GLU A 143 -4.009 5.079 1.488 1.00 0.60 H new ATOM 0 HA GLU A 143 -1.867 4.825 3.523 1.00 0.57 H new ATOM 0 HB2 GLU A 143 -1.363 5.306 1.106 1.00 0.66 H new ATOM 0 HB3 GLU A 143 -2.290 6.787 1.244 1.00 0.66 H new ATOM 0 HG2 GLU A 143 -0.728 7.503 3.127 1.00 0.66 H new ATOM 0 HG3 GLU A 143 0.248 6.088 2.785 1.00 0.66 H new ATOM 1842 N ILE A 144 -2.762 6.536 5.115 1.00 0.64 N ATOM 1843 CA ILE A 144 -3.396 7.383 6.138 1.00 0.65 C ATOM 1844 C ILE A 144 -2.333 8.296 6.762 1.00 0.71 C ATOM 1845 O ILE A 144 -1.624 7.903 7.689 1.00 0.70 O ATOM 1846 CB ILE A 144 -4.107 6.494 7.190 1.00 0.63 C ATOM 1847 CG1 ILE A 144 -5.113 5.476 6.597 1.00 0.60 C ATOM 1848 CG2 ILE A 144 -4.800 7.374 8.242 1.00 0.69 C ATOM 1849 CD1 ILE A 144 -6.319 6.066 5.857 1.00 0.58 C ATOM 0 H ILE A 144 -1.993 5.972 5.476 1.00 0.64 H new ATOM 0 HA ILE A 144 -4.160 8.019 5.690 1.00 0.65 H new ATOM 0 HB ILE A 144 -3.322 5.895 7.651 1.00 0.63 H new ATOM 0 HG12 ILE A 144 -4.575 4.824 5.909 1.00 0.60 H new ATOM 0 HG13 ILE A 144 -5.483 4.848 7.408 1.00 0.60 H new ATOM 0 HG21 ILE A 144 -5.297 6.740 8.977 1.00 0.69 H new ATOM 0 HG22 ILE A 144 -4.058 7.996 8.742 1.00 0.69 H new ATOM 0 HG23 ILE A 144 -5.538 8.011 7.754 1.00 0.69 H new ATOM 0 HD11 ILE A 144 -6.950 5.258 5.488 1.00 0.58 H new ATOM 0 HD12 ILE A 144 -6.894 6.692 6.539 1.00 0.58 H new ATOM 0 HD13 ILE A 144 -5.972 6.668 5.017 1.00 0.58 H new ATOM 1861 N HIS A 145 -2.233 9.540 6.283 1.00 0.95 N ATOM 1862 CA HIS A 145 -1.114 10.419 6.653 1.00 1.10 C ATOM 1863 C HIS A 145 -1.197 10.996 8.078 1.00 1.14 C ATOM 1864 O HIS A 145 -0.190 11.470 8.614 1.00 1.34 O ATOM 1865 CB HIS A 145 -0.869 11.490 5.573 1.00 1.37 C ATOM 1866 CG HIS A 145 0.555 11.453 5.073 1.00 2.04 C ATOM 1867 ND1 HIS A 145 1.607 12.241 5.494 1.00 3.11 N ATOM 1868 CD2 HIS A 145 1.072 10.521 4.215 1.00 2.89 C ATOM 1869 CE1 HIS A 145 2.731 11.788 4.916 1.00 4.21 C ATOM 1870 NE2 HIS A 145 2.457 10.723 4.141 1.00 4.10 N ATOM 0 H HIS A 145 -2.907 9.961 5.643 1.00 0.95 H new ATOM 0 HA HIS A 145 -0.230 9.783 6.690 1.00 1.10 H new ATOM 0 HB2 HIS A 145 -1.553 11.331 4.739 1.00 1.37 H new ATOM 0 HB3 HIS A 145 -1.087 12.477 5.981 1.00 1.37 H new ATOM 0 HD2 HIS A 145 0.512 9.763 3.688 1.00 2.89 H new ATOM 0 HE1 HIS A 145 3.713 12.216 5.053 1.00 4.21 H new ATOM 0 HE2 HIS A 145 3.126 10.171 3.605 1.00 4.10 H new ATOM 1878 N SER A 146 -2.349 10.865 8.743 1.00 1.17 N ATOM 1879 CA SER A 146 -2.570 11.316 10.123 1.00 1.25 C ATOM 1880 C SER A 146 -1.707 10.593 11.170 1.00 1.19 C ATOM 1881 O SER A 146 -1.491 11.153 12.251 1.00 1.32 O ATOM 1882 CB SER A 146 -4.056 11.197 10.471 1.00 1.44 C ATOM 1883 OG SER A 146 -4.492 9.862 10.353 1.00 1.70 O ATOM 0 H SER A 146 -3.174 10.432 8.328 1.00 1.17 H new ATOM 0 HA SER A 146 -2.254 12.359 10.161 1.00 1.25 H new ATOM 0 HB2 SER A 146 -4.226 11.551 11.488 1.00 1.44 H new ATOM 0 HB3 SER A 146 -4.641 11.835 9.809 1.00 1.44 H new ATOM 0 HG SER A 146 -5.443 9.807 10.581 1.00 1.70 H new ATOM 2086 N LYS A 162 -2.176 14.064 -2.778 1.00 1.16 N ATOM 2087 CA LYS A 162 -3.016 12.932 -2.330 1.00 1.11 C ATOM 2088 C LYS A 162 -2.704 11.582 -2.995 1.00 0.94 C ATOM 2089 O LYS A 162 -2.638 11.491 -4.222 1.00 1.08 O ATOM 2090 CB LYS A 162 -4.509 13.300 -2.448 1.00 1.33 C ATOM 2091 CG LYS A 162 -5.052 13.481 -3.886 1.00 2.14 C ATOM 2092 CD LYS A 162 -6.574 13.327 -4.021 1.00 2.09 C ATOM 2093 CE LYS A 162 -7.063 11.974 -3.490 1.00 1.37 C ATOM 2094 NZ LYS A 162 -8.505 11.770 -3.735 1.00 1.69 N ATOM 0 HA LYS A 162 -2.762 12.770 -1.283 1.00 1.11 H new ATOM 0 HB2 LYS A 162 -5.094 12.524 -1.955 1.00 1.33 H new ATOM 0 HB3 LYS A 162 -4.679 14.225 -1.898 1.00 1.33 H new ATOM 0 HG2 LYS A 162 -4.767 14.470 -4.246 1.00 2.14 H new ATOM 0 HG3 LYS A 162 -4.568 12.753 -4.537 1.00 2.14 H new ATOM 0 HD2 LYS A 162 -7.070 14.131 -3.477 1.00 2.09 H new ATOM 0 HD3 LYS A 162 -6.857 13.429 -5.069 1.00 2.09 H new ATOM 0 HE2 LYS A 162 -6.498 11.173 -3.966 1.00 1.37 H new ATOM 0 HE3 LYS A 162 -6.865 11.912 -2.420 1.00 1.37 H new ATOM 0 HZ1 LYS A 162 -8.969 11.474 -2.852 1.00 1.69 H new ATOM 0 HZ2 LYS A 162 -8.930 12.659 -4.068 1.00 1.69 H new ATOM 0 HZ3 LYS A 162 -8.634 11.033 -4.457 1.00 1.69 H new ATOM 2108 N ALA A 163 -2.584 10.521 -2.192 1.00 0.80 N ATOM 2109 CA ALA A 163 -2.525 9.135 -2.665 1.00 0.66 C ATOM 2110 C ALA A 163 -3.922 8.585 -3.003 1.00 0.60 C ATOM 2111 O ALA A 163 -4.924 9.010 -2.418 1.00 0.69 O ATOM 2112 CB ALA A 163 -1.800 8.255 -1.638 1.00 0.77 C ATOM 0 H ALA A 163 -2.524 10.603 -1.177 1.00 0.80 H new ATOM 0 HA ALA A 163 -1.954 9.117 -3.593 1.00 0.66 H new ATOM 0 HB1 ALA A 163 -1.763 7.228 -2.001 1.00 0.77 H new ATOM 0 HB2 ALA A 163 -0.785 8.626 -1.493 1.00 0.77 H new ATOM 0 HB3 ALA A 163 -2.336 8.285 -0.690 1.00 0.77 H new ATOM 2118 N VAL A 164 -3.975 7.616 -3.922 1.00 0.55 N ATOM 2119 CA VAL A 164 -5.192 6.872 -4.311 1.00 0.51 C ATOM 2120 C VAL A 164 -4.996 5.356 -4.105 1.00 0.59 C ATOM 2121 O VAL A 164 -3.868 4.864 -4.204 1.00 0.66 O ATOM 2122 CB VAL A 164 -5.691 7.234 -5.728 1.00 0.48 C ATOM 2123 CG1 VAL A 164 -6.654 8.425 -5.666 1.00 0.53 C ATOM 2124 CG2 VAL A 164 -4.569 7.592 -6.705 1.00 0.60 C ATOM 0 H VAL A 164 -3.148 7.313 -4.437 1.00 0.55 H new ATOM 0 HA VAL A 164 -5.995 7.186 -3.645 1.00 0.51 H new ATOM 0 HB VAL A 164 -6.186 6.336 -6.097 1.00 0.48 H new ATOM 0 HG11 VAL A 164 -6.997 8.668 -6.672 1.00 0.53 H new ATOM 0 HG12 VAL A 164 -7.511 8.168 -5.043 1.00 0.53 H new ATOM 0 HG13 VAL A 164 -6.140 9.287 -5.240 1.00 0.53 H new ATOM 0 HG21 VAL A 164 -4.997 7.834 -7.678 1.00 0.60 H new ATOM 0 HG22 VAL A 164 -4.018 8.453 -6.327 1.00 0.60 H new ATOM 0 HG23 VAL A 164 -3.892 6.744 -6.808 1.00 0.60 H new ATOM 2134 N PRO A 165 -6.071 4.604 -3.787 1.00 0.63 N ATOM 2135 CA PRO A 165 -5.987 3.232 -3.276 1.00 0.69 C ATOM 2136 C PRO A 165 -5.702 2.155 -4.332 1.00 0.69 C ATOM 2137 O PRO A 165 -5.890 2.360 -5.538 1.00 0.78 O ATOM 2138 CB PRO A 165 -7.305 3.016 -2.529 1.00 0.66 C ATOM 2139 CG PRO A 165 -8.293 3.850 -3.339 1.00 0.64 C ATOM 2140 CD PRO A 165 -7.462 5.035 -3.830 1.00 0.64 C ATOM 0 HA PRO A 165 -5.119 3.122 -2.626 1.00 0.69 H new ATOM 0 HB2 PRO A 165 -7.588 1.964 -2.505 1.00 0.66 H new ATOM 0 HB3 PRO A 165 -7.244 3.354 -1.494 1.00 0.66 H new ATOM 0 HG2 PRO A 165 -8.707 3.281 -4.171 1.00 0.64 H new ATOM 0 HG3 PRO A 165 -9.134 4.178 -2.728 1.00 0.64 H new ATOM 0 HD2 PRO A 165 -7.750 5.319 -4.842 1.00 0.64 H new ATOM 0 HD3 PRO A 165 -7.618 5.908 -3.197 1.00 0.64 H new ATOM 2148 N ILE A 166 -5.272 0.988 -3.841 1.00 0.69 N ATOM 2149 CA ILE A 166 -4.695 -0.131 -4.606 1.00 0.68 C ATOM 2150 C ILE A 166 -5.444 -1.434 -4.308 1.00 0.63 C ATOM 2151 O ILE A 166 -5.632 -1.756 -3.137 1.00 0.60 O ATOM 2152 CB ILE A 166 -3.193 -0.317 -4.241 1.00 0.67 C ATOM 2153 CG1 ILE A 166 -2.406 1.010 -4.116 1.00 0.83 C ATOM 2154 CG2 ILE A 166 -2.510 -1.234 -5.267 1.00 0.69 C ATOM 2155 CD1 ILE A 166 -2.422 1.570 -2.685 1.00 1.25 C ATOM 0 H ILE A 166 -5.318 0.784 -2.843 1.00 0.69 H new ATOM 0 HA ILE A 166 -4.789 0.104 -5.666 1.00 0.68 H new ATOM 0 HB ILE A 166 -3.179 -0.774 -3.252 1.00 0.67 H new ATOM 0 HG12 ILE A 166 -1.374 0.848 -4.428 1.00 0.83 H new ATOM 0 HG13 ILE A 166 -2.832 1.747 -4.796 1.00 0.83 H new ATOM 0 HG21 ILE A 166 -1.460 -1.357 -5.002 1.00 0.69 H new ATOM 0 HG22 ILE A 166 -3.001 -2.207 -5.269 1.00 0.69 H new ATOM 0 HG23 ILE A 166 -2.584 -0.789 -6.259 1.00 0.69 H new ATOM 0 HD11 ILE A 166 -1.856 2.501 -2.652 1.00 1.25 H new ATOM 0 HD12 ILE A 166 -3.451 1.760 -2.380 1.00 1.25 H new ATOM 0 HD13 ILE A 166 -1.970 0.847 -2.006 1.00 1.25 H new ATOM 2167 N GLU A 167 -5.807 -2.214 -5.332 1.00 0.72 N ATOM 2168 CA GLU A 167 -6.419 -3.550 -5.188 1.00 0.71 C ATOM 2169 C GLU A 167 -5.380 -4.675 -5.340 1.00 0.71 C ATOM 2170 O GLU A 167 -4.599 -4.687 -6.296 1.00 0.86 O ATOM 2171 CB GLU A 167 -7.582 -3.686 -6.187 1.00 0.86 C ATOM 2172 CG GLU A 167 -8.398 -4.979 -6.029 1.00 2.08 C ATOM 2173 CD GLU A 167 -9.541 -5.027 -7.051 1.00 2.48 C ATOM 2174 OE1 GLU A 167 -10.535 -4.286 -6.877 1.00 2.93 O ATOM 2175 OE2 GLU A 167 -9.440 -5.774 -8.057 1.00 3.39 O ATOM 0 H GLU A 167 -5.683 -1.934 -6.305 1.00 0.72 H new ATOM 0 HA GLU A 167 -6.818 -3.652 -4.179 1.00 0.71 H new ATOM 0 HB2 GLU A 167 -8.249 -2.832 -6.070 1.00 0.86 H new ATOM 0 HB3 GLU A 167 -7.183 -3.643 -7.200 1.00 0.86 H new ATOM 0 HG2 GLU A 167 -7.748 -5.844 -6.162 1.00 2.08 H new ATOM 0 HG3 GLU A 167 -8.804 -5.038 -5.019 1.00 2.08 H new ATOM 2182 N ILE A 168 -5.365 -5.630 -4.407 1.00 0.61 N ATOM 2183 CA ILE A 168 -4.369 -6.706 -4.321 1.00 0.63 C ATOM 2184 C ILE A 168 -5.047 -8.057 -4.032 1.00 0.67 C ATOM 2185 O ILE A 168 -6.065 -8.133 -3.345 1.00 0.67 O ATOM 2186 CB ILE A 168 -3.279 -6.315 -3.288 1.00 0.54 C ATOM 2187 CG1 ILE A 168 -2.017 -7.188 -3.436 1.00 0.58 C ATOM 2188 CG2 ILE A 168 -3.808 -6.351 -1.844 1.00 0.49 C ATOM 2189 CD1 ILE A 168 -0.839 -6.740 -2.558 1.00 0.56 C ATOM 0 H ILE A 168 -6.066 -5.679 -3.667 1.00 0.61 H new ATOM 0 HA ILE A 168 -3.867 -6.835 -5.280 1.00 0.63 H new ATOM 0 HB ILE A 168 -3.000 -5.284 -3.505 1.00 0.54 H new ATOM 0 HG12 ILE A 168 -2.270 -8.219 -3.188 1.00 0.58 H new ATOM 0 HG13 ILE A 168 -1.702 -7.179 -4.480 1.00 0.58 H new ATOM 0 HG21 ILE A 168 -3.010 -6.070 -1.157 1.00 0.49 H new ATOM 0 HG22 ILE A 168 -4.637 -5.651 -1.743 1.00 0.49 H new ATOM 0 HG23 ILE A 168 -4.153 -7.358 -1.608 1.00 0.49 H new ATOM 0 HD11 ILE A 168 0.009 -7.405 -2.720 1.00 0.56 H new ATOM 0 HD12 ILE A 168 -0.556 -5.721 -2.821 1.00 0.56 H new ATOM 0 HD13 ILE A 168 -1.133 -6.776 -1.509 1.00 0.56 H new ATOM 2201 N GLU A 169 -4.475 -9.141 -4.547 1.00 0.72 N ATOM 2202 CA GLU A 169 -4.912 -10.521 -4.301 1.00 0.70 C ATOM 2203 C GLU A 169 -3.707 -11.355 -3.827 1.00 0.74 C ATOM 2204 O GLU A 169 -2.558 -11.016 -4.134 1.00 0.80 O ATOM 2205 CB GLU A 169 -5.584 -11.054 -5.582 1.00 0.70 C ATOM 2206 CG GLU A 169 -6.388 -12.347 -5.390 1.00 0.84 C ATOM 2207 CD GLU A 169 -7.182 -12.718 -6.654 1.00 0.86 C ATOM 2208 OE1 GLU A 169 -6.653 -12.582 -7.787 1.00 1.62 O ATOM 2209 OE2 GLU A 169 -8.337 -13.198 -6.527 1.00 1.95 O ATOM 0 H GLU A 169 -3.668 -9.087 -5.168 1.00 0.72 H new ATOM 0 HA GLU A 169 -5.654 -10.582 -3.505 1.00 0.70 H new ATOM 0 HB2 GLU A 169 -6.247 -10.284 -5.976 1.00 0.70 H new ATOM 0 HB3 GLU A 169 -4.815 -11.228 -6.335 1.00 0.70 H new ATOM 0 HG2 GLU A 169 -5.711 -13.162 -5.134 1.00 0.84 H new ATOM 0 HG3 GLU A 169 -7.074 -12.227 -4.552 1.00 0.84 H new ATOM 2216 N LEU A 170 -3.925 -12.422 -3.048 1.00 0.74 N ATOM 2217 CA LEU A 170 -2.803 -13.201 -2.499 1.00 0.76 C ATOM 2218 C LEU A 170 -1.995 -13.897 -3.614 1.00 0.74 C ATOM 2219 O LEU A 170 -2.596 -14.347 -4.595 1.00 0.89 O ATOM 2220 CB LEU A 170 -3.271 -14.182 -1.415 1.00 0.85 C ATOM 2221 CG LEU A 170 -3.856 -13.543 -0.140 1.00 0.80 C ATOM 2222 CD1 LEU A 170 -3.749 -14.550 0.998 1.00 0.99 C ATOM 2223 CD2 LEU A 170 -3.155 -12.264 0.336 1.00 1.05 C ATOM 0 H LEU A 170 -4.850 -12.763 -2.786 1.00 0.74 H new ATOM 0 HA LEU A 170 -2.124 -12.500 -2.013 1.00 0.76 H new ATOM 0 HB2 LEU A 170 -4.025 -14.840 -1.848 1.00 0.85 H new ATOM 0 HB3 LEU A 170 -2.426 -14.809 -1.130 1.00 0.85 H new ATOM 0 HG LEU A 170 -4.879 -13.270 -0.400 1.00 0.80 H new ATOM 0 HD11 LEU A 170 -4.159 -14.114 1.909 1.00 0.99 H new ATOM 0 HD12 LEU A 170 -4.309 -15.449 0.742 1.00 0.99 H new ATOM 0 HD13 LEU A 170 -2.702 -14.808 1.158 1.00 0.99 H new ATOM 0 HD21 LEU A 170 -3.643 -11.896 1.238 1.00 1.05 H new ATOM 0 HD22 LEU A 170 -2.109 -12.481 0.552 1.00 1.05 H new ATOM 0 HD23 LEU A 170 -3.214 -11.505 -0.444 1.00 1.05 H new ATOM 2235 N PRO A 171 -0.656 -14.007 -3.479 1.00 0.63 N ATOM 2236 CA PRO A 171 0.262 -14.369 -4.565 1.00 0.57 C ATOM 2237 C PRO A 171 0.124 -15.803 -5.101 1.00 0.59 C ATOM 2238 O PRO A 171 0.794 -16.720 -4.630 1.00 0.79 O ATOM 2239 CB PRO A 171 1.668 -14.080 -4.011 1.00 0.57 C ATOM 2240 CG PRO A 171 1.491 -14.316 -2.512 1.00 0.69 C ATOM 2241 CD PRO A 171 0.108 -13.725 -2.270 1.00 0.70 C ATOM 0 HA PRO A 171 0.028 -13.781 -5.452 1.00 0.57 H new ATOM 0 HB2 PRO A 171 2.417 -14.745 -4.440 1.00 0.57 H new ATOM 0 HB3 PRO A 171 1.987 -13.060 -4.226 1.00 0.57 H new ATOM 0 HG2 PRO A 171 1.535 -15.375 -2.256 1.00 0.69 H new ATOM 0 HG3 PRO A 171 2.260 -13.814 -1.925 1.00 0.69 H new ATOM 0 HD2 PRO A 171 -0.363 -14.174 -1.395 1.00 0.70 H new ATOM 0 HD3 PRO A 171 0.167 -12.652 -2.085 1.00 0.70 H new ATOM 2249 N LEU A 172 -0.699 -15.970 -6.138 1.00 0.62 N ATOM 2250 CA LEU A 172 -0.818 -17.166 -6.978 1.00 0.65 C ATOM 2251 C LEU A 172 -0.546 -16.695 -8.418 1.00 0.79 C ATOM 2252 O LEU A 172 -1.445 -16.392 -9.213 1.00 1.33 O ATOM 2253 CB LEU A 172 -2.181 -17.842 -6.747 1.00 0.89 C ATOM 2254 CG LEU A 172 -2.207 -19.331 -7.142 1.00 1.21 C ATOM 2255 CD1 LEU A 172 -3.612 -19.883 -6.922 1.00 2.04 C ATOM 2256 CD2 LEU A 172 -1.794 -19.603 -8.586 1.00 2.37 C ATOM 0 H LEU A 172 -1.338 -15.232 -6.432 1.00 0.62 H new ATOM 0 HA LEU A 172 -0.099 -17.948 -6.734 1.00 0.65 H new ATOM 0 HB2 LEU A 172 -2.449 -17.749 -5.695 1.00 0.89 H new ATOM 0 HB3 LEU A 172 -2.942 -17.310 -7.318 1.00 0.89 H new ATOM 0 HG LEU A 172 -1.471 -19.826 -6.508 1.00 1.21 H new ATOM 0 HD11 LEU A 172 -3.637 -20.937 -7.200 1.00 2.04 H new ATOM 0 HD12 LEU A 172 -3.884 -19.778 -5.872 1.00 2.04 H new ATOM 0 HD13 LEU A 172 -4.321 -19.329 -7.537 1.00 2.04 H new ATOM 0 HD21 LEU A 172 -1.840 -20.674 -8.782 1.00 2.37 H new ATOM 0 HD22 LEU A 172 -2.471 -19.081 -9.262 1.00 2.37 H new ATOM 0 HD23 LEU A 172 -0.776 -19.248 -8.746 1.00 2.37 H new ATOM 2268 N ASN A 173 0.745 -16.507 -8.676 1.00 0.85 N ATOM 2269 CA ASN A 173 1.324 -15.834 -9.836 1.00 0.97 C ATOM 2270 C ASN A 173 2.777 -16.325 -10.015 1.00 1.04 C ATOM 2271 O ASN A 173 3.287 -17.091 -9.196 1.00 1.75 O ATOM 2272 CB ASN A 173 1.209 -14.326 -9.525 1.00 1.11 C ATOM 2273 CG ASN A 173 1.460 -13.364 -10.670 1.00 1.34 C ATOM 2274 OD1 ASN A 173 1.866 -13.720 -11.770 1.00 2.65 O ATOM 2275 ND2 ASN A 173 1.219 -12.106 -10.407 1.00 1.17 N ATOM 0 H ASN A 173 1.464 -16.844 -8.036 1.00 0.85 H new ATOM 0 HA ASN A 173 0.820 -16.046 -10.779 1.00 0.97 H new ATOM 0 HB2 ASN A 173 0.208 -14.136 -9.137 1.00 1.11 H new ATOM 0 HB3 ASN A 173 1.911 -14.091 -8.725 1.00 1.11 H new ATOM 0 HD21 ASN A 173 1.368 -11.397 -11.125 1.00 1.17 H new ATOM 0 HD22 ASN A 173 0.881 -11.834 -9.484 1.00 1.17 H new ATOM 2282 N ASP A 174 3.485 -15.888 -11.052 1.00 1.29 N ATOM 2283 CA ASP A 174 4.843 -16.349 -11.380 1.00 1.54 C ATOM 2284 C ASP A 174 5.961 -15.613 -10.614 1.00 1.46 C ATOM 2285 O ASP A 174 7.035 -15.347 -11.164 1.00 1.92 O ATOM 2286 CB ASP A 174 5.040 -16.302 -12.898 1.00 1.89 C ATOM 2287 CG ASP A 174 6.160 -17.231 -13.366 1.00 2.29 C ATOM 2288 OD1 ASP A 174 6.309 -18.354 -12.826 1.00 2.82 O ATOM 2289 OD2 ASP A 174 6.899 -16.880 -14.315 1.00 3.23 O ATOM 0 H ASP A 174 3.130 -15.190 -11.705 1.00 1.29 H new ATOM 0 HA ASP A 174 4.930 -17.381 -11.039 1.00 1.54 H new ATOM 0 HB2 ASP A 174 4.109 -16.581 -13.392 1.00 1.89 H new ATOM 0 HB3 ASP A 174 5.268 -15.280 -13.201 1.00 1.89 H new ATOM 2294 N VAL A 175 5.701 -15.228 -9.362 1.00 1.06 N ATOM 2295 CA VAL A 175 6.599 -14.417 -8.530 1.00 0.98 C ATOM 2296 C VAL A 175 7.129 -15.210 -7.333 1.00 1.01 C ATOM 2297 O VAL A 175 6.516 -16.193 -6.898 1.00 1.17 O ATOM 2298 CB VAL A 175 5.998 -13.042 -8.151 1.00 0.89 C ATOM 2299 CG1 VAL A 175 4.973 -12.536 -9.171 1.00 1.22 C ATOM 2300 CG2 VAL A 175 5.368 -12.938 -6.758 1.00 0.55 C ATOM 0 H VAL A 175 4.836 -15.478 -8.884 1.00 1.06 H new ATOM 0 HA VAL A 175 7.468 -14.175 -9.142 1.00 0.98 H new ATOM 0 HB VAL A 175 6.887 -12.412 -8.149 1.00 0.89 H new ATOM 0 HG11 VAL A 175 4.588 -11.568 -8.850 1.00 1.22 H new ATOM 0 HG12 VAL A 175 5.450 -12.431 -10.145 1.00 1.22 H new ATOM 0 HG13 VAL A 175 4.151 -13.248 -9.244 1.00 1.22 H new ATOM 0 HG21 VAL A 175 4.982 -11.930 -6.608 1.00 0.55 H new ATOM 0 HG22 VAL A 175 4.552 -13.655 -6.673 1.00 0.55 H new ATOM 0 HG23 VAL A 175 6.122 -13.155 -6.001 1.00 0.55 H new ATOM 2310 N VAL A 176 8.276 -14.772 -6.815 1.00 0.99 N ATOM 2311 CA VAL A 176 8.979 -15.338 -5.648 1.00 1.05 C ATOM 2312 C VAL A 176 8.894 -14.406 -4.432 1.00 0.84 C ATOM 2313 O VAL A 176 8.780 -14.882 -3.305 1.00 0.88 O ATOM 2314 CB VAL A 176 10.445 -15.643 -6.025 1.00 1.33 C ATOM 2315 CG1 VAL A 176 11.275 -16.105 -4.823 1.00 1.64 C ATOM 2316 CG2 VAL A 176 10.514 -16.741 -7.096 1.00 1.81 C ATOM 0 H VAL A 176 8.770 -13.973 -7.213 1.00 0.99 H new ATOM 0 HA VAL A 176 8.489 -16.269 -5.363 1.00 1.05 H new ATOM 0 HB VAL A 176 10.859 -14.708 -6.403 1.00 1.33 H new ATOM 0 HG11 VAL A 176 12.297 -16.306 -5.143 1.00 1.64 H new ATOM 0 HG12 VAL A 176 11.280 -15.324 -4.062 1.00 1.64 H new ATOM 0 HG13 VAL A 176 10.839 -17.014 -4.408 1.00 1.64 H new ATOM 0 HG21 VAL A 176 11.556 -16.940 -7.347 1.00 1.81 H new ATOM 0 HG22 VAL A 176 10.053 -17.652 -6.714 1.00 1.81 H new ATOM 0 HG23 VAL A 176 9.983 -16.412 -7.989 1.00 1.81 H new ATOM 2326 N ASP A 177 8.890 -13.090 -4.650 1.00 0.73 N ATOM 2327 CA ASP A 177 8.649 -12.063 -3.630 1.00 0.70 C ATOM 2328 C ASP A 177 7.560 -11.093 -4.135 1.00 0.49 C ATOM 2329 O ASP A 177 7.600 -10.661 -5.289 1.00 0.52 O ATOM 2330 CB ASP A 177 9.952 -11.309 -3.307 1.00 0.98 C ATOM 2331 CG ASP A 177 11.082 -12.178 -2.741 1.00 2.16 C ATOM 2332 OD1 ASP A 177 11.049 -12.522 -1.530 1.00 2.55 O ATOM 2333 OD2 ASP A 177 12.057 -12.455 -3.479 1.00 3.74 O ATOM 0 H ASP A 177 9.060 -12.694 -5.574 1.00 0.73 H new ATOM 0 HA ASP A 177 8.304 -12.536 -2.711 1.00 0.70 H new ATOM 0 HB2 ASP A 177 10.308 -10.824 -4.216 1.00 0.98 H new ATOM 0 HB3 ASP A 177 9.728 -10.519 -2.590 1.00 0.98 H new ATOM 2338 N ALA A 178 6.583 -10.745 -3.296 1.00 0.40 N ATOM 2339 CA ALA A 178 5.470 -9.861 -3.649 1.00 0.32 C ATOM 2340 C ALA A 178 5.722 -8.425 -3.177 1.00 0.33 C ATOM 2341 O ALA A 178 6.165 -8.222 -2.041 1.00 0.34 O ATOM 2342 CB ALA A 178 4.178 -10.399 -3.031 1.00 0.41 C ATOM 0 H ALA A 178 6.542 -11.076 -2.332 1.00 0.40 H new ATOM 0 HA ALA A 178 5.379 -9.840 -4.735 1.00 0.32 H new ATOM 0 HB1 ALA A 178 3.348 -9.742 -3.293 1.00 0.41 H new ATOM 0 HB2 ALA A 178 3.982 -11.401 -3.413 1.00 0.41 H new ATOM 0 HB3 ALA A 178 4.282 -10.438 -1.947 1.00 0.41 H new ATOM 2348 N HIS A 179 5.403 -7.428 -4.012 1.00 0.34 N ATOM 2349 CA HIS A 179 5.598 -6.015 -3.659 1.00 0.37 C ATOM 2350 C HIS A 179 4.392 -5.117 -3.978 1.00 0.38 C ATOM 2351 O HIS A 179 3.463 -5.523 -4.682 1.00 0.43 O ATOM 2352 CB HIS A 179 6.923 -5.472 -4.246 1.00 0.40 C ATOM 2353 CG HIS A 179 8.141 -6.217 -3.771 1.00 0.45 C ATOM 2354 ND1 HIS A 179 9.062 -5.757 -2.860 1.00 0.50 N ATOM 2355 CD2 HIS A 179 8.515 -7.486 -4.124 1.00 0.52 C ATOM 2356 CE1 HIS A 179 9.954 -6.737 -2.644 1.00 0.61 C ATOM 2357 NE2 HIS A 179 9.654 -7.818 -3.383 1.00 0.63 N ATOM 0 H HIS A 179 5.007 -7.574 -4.941 1.00 0.34 H new ATOM 0 HA HIS A 179 5.678 -5.980 -2.573 1.00 0.37 H new ATOM 0 HB2 HIS A 179 6.877 -5.523 -5.334 1.00 0.40 H new ATOM 0 HB3 HIS A 179 7.024 -4.420 -3.981 1.00 0.40 H new ATOM 0 HD1 HIS A 179 9.067 -4.834 -2.425 1.00 0.50 H new ATOM 0 HD2 HIS A 179 8.019 -8.118 -4.846 1.00 0.52 H new ATOM 0 HE1 HIS A 179 10.795 -6.666 -1.970 1.00 0.61 H new ATOM 2365 N VAL A 180 4.399 -3.889 -3.440 1.00 0.38 N ATOM 2366 CA VAL A 180 3.356 -2.862 -3.647 1.00 0.40 C ATOM 2367 C VAL A 180 3.966 -1.491 -3.925 1.00 0.38 C ATOM 2368 O VAL A 180 4.870 -1.075 -3.201 1.00 0.37 O ATOM 2369 CB VAL A 180 2.411 -2.701 -2.440 1.00 0.47 C ATOM 2370 CG1 VAL A 180 1.060 -2.153 -2.903 1.00 0.60 C ATOM 2371 CG2 VAL A 180 2.179 -3.969 -1.620 1.00 0.42 C ATOM 0 H VAL A 180 5.151 -3.569 -2.830 1.00 0.38 H new ATOM 0 HA VAL A 180 2.786 -3.219 -4.505 1.00 0.40 H new ATOM 0 HB VAL A 180 2.922 -2.004 -1.776 1.00 0.47 H new ATOM 0 HG11 VAL A 180 0.398 -2.042 -2.044 1.00 0.60 H new ATOM 0 HG12 VAL A 180 1.204 -1.182 -3.377 1.00 0.60 H new ATOM 0 HG13 VAL A 180 0.613 -2.843 -3.618 1.00 0.60 H new ATOM 0 HG21 VAL A 180 1.501 -3.750 -0.795 1.00 0.42 H new ATOM 0 HG22 VAL A 180 1.741 -4.738 -2.256 1.00 0.42 H new ATOM 0 HG23 VAL A 180 3.130 -4.325 -1.223 1.00 0.42 H new ATOM 2381 N TYR A 181 3.426 -0.773 -4.914 1.00 0.41 N ATOM 2382 CA TYR A 181 3.888 0.557 -5.325 1.00 0.41 C ATOM 2383 C TYR A 181 2.704 1.532 -5.520 1.00 0.46 C ATOM 2384 O TYR A 181 2.223 1.708 -6.641 1.00 0.60 O ATOM 2385 CB TYR A 181 4.759 0.395 -6.576 1.00 0.47 C ATOM 2386 CG TYR A 181 6.127 -0.178 -6.251 1.00 0.55 C ATOM 2387 CD1 TYR A 181 7.166 0.703 -5.904 1.00 1.87 C ATOM 2388 CD2 TYR A 181 6.356 -1.569 -6.242 1.00 1.59 C ATOM 2389 CE1 TYR A 181 8.451 0.216 -5.609 1.00 2.08 C ATOM 2390 CE2 TYR A 181 7.637 -2.066 -5.924 1.00 1.54 C ATOM 2391 CZ TYR A 181 8.690 -1.172 -5.627 1.00 0.99 C ATOM 2392 OH TYR A 181 9.936 -1.641 -5.363 1.00 1.28 O ATOM 0 H TYR A 181 2.636 -1.108 -5.465 1.00 0.41 H new ATOM 0 HA TYR A 181 4.495 1.009 -4.541 1.00 0.41 H new ATOM 0 HB2 TYR A 181 4.253 -0.258 -7.287 1.00 0.47 H new ATOM 0 HB3 TYR A 181 4.878 1.364 -7.062 1.00 0.47 H new ATOM 0 HD1 TYR A 181 6.975 1.765 -5.864 1.00 1.87 H new ATOM 0 HD2 TYR A 181 5.553 -2.252 -6.478 1.00 1.59 H new ATOM 0 HE1 TYR A 181 9.250 0.902 -5.370 1.00 2.08 H new ATOM 0 HE2 TYR A 181 7.813 -3.131 -5.907 1.00 1.54 H new ATOM 0 HH TYR A 181 10.538 -0.888 -5.185 1.00 1.28 H new ATOM 2402 N PRO A 182 2.188 2.149 -4.438 1.00 0.42 N ATOM 2403 CA PRO A 182 1.138 3.167 -4.485 1.00 0.48 C ATOM 2404 C PRO A 182 1.633 4.485 -5.093 1.00 0.51 C ATOM 2405 O PRO A 182 2.809 4.843 -4.965 1.00 0.59 O ATOM 2406 CB PRO A 182 0.693 3.376 -3.037 1.00 0.50 C ATOM 2407 CG PRO A 182 1.924 3.009 -2.222 1.00 0.53 C ATOM 2408 CD PRO A 182 2.631 1.954 -3.071 1.00 0.43 C ATOM 0 HA PRO A 182 0.318 2.838 -5.123 1.00 0.48 H new ATOM 0 HB2 PRO A 182 0.387 4.407 -2.857 1.00 0.50 H new ATOM 0 HB3 PRO A 182 -0.157 2.743 -2.784 1.00 0.50 H new ATOM 0 HG2 PRO A 182 2.562 3.876 -2.051 1.00 0.53 H new ATOM 0 HG3 PRO A 182 1.651 2.616 -1.243 1.00 0.53 H new ATOM 0 HD2 PRO A 182 3.713 2.060 -2.997 1.00 0.43 H new ATOM 0 HD3 PRO A 182 2.385 0.950 -2.724 1.00 0.43 H new ATOM 2416 N LYS A 183 0.703 5.218 -5.718 1.00 0.54 N ATOM 2417 CA LYS A 183 0.928 6.495 -6.409 1.00 0.55 C ATOM 2418 C LYS A 183 -0.101 7.556 -5.990 1.00 0.62 C ATOM 2419 O LYS A 183 -1.204 7.242 -5.533 1.00 1.06 O ATOM 2420 CB LYS A 183 0.903 6.319 -7.947 1.00 0.57 C ATOM 2421 CG LYS A 183 1.761 5.170 -8.518 1.00 0.68 C ATOM 2422 CD LYS A 183 0.999 3.840 -8.675 1.00 1.69 C ATOM 2423 CE LYS A 183 0.039 3.833 -9.873 1.00 1.29 C ATOM 2424 NZ LYS A 183 -0.826 2.630 -9.847 1.00 1.67 N ATOM 0 H LYS A 183 -0.273 4.923 -5.758 1.00 0.54 H new ATOM 0 HA LYS A 183 1.919 6.840 -6.113 1.00 0.55 H new ATOM 0 HB2 LYS A 183 -0.130 6.161 -8.256 1.00 0.57 H new ATOM 0 HB3 LYS A 183 1.233 7.252 -8.404 1.00 0.57 H new ATOM 0 HG2 LYS A 183 2.152 5.470 -9.490 1.00 0.68 H new ATOM 0 HG3 LYS A 183 2.619 5.011 -7.865 1.00 0.68 H new ATOM 0 HD2 LYS A 183 1.717 3.028 -8.788 1.00 1.69 H new ATOM 0 HD3 LYS A 183 0.435 3.642 -7.764 1.00 1.69 H new ATOM 0 HE2 LYS A 183 -0.579 4.731 -9.855 1.00 1.29 H new ATOM 0 HE3 LYS A 183 0.609 3.857 -10.802 1.00 1.29 H new ATOM 0 HZ1 LYS A 183 -1.467 2.646 -10.666 1.00 1.67 H new ATOM 0 HZ2 LYS A 183 -0.234 1.776 -9.887 1.00 1.67 H new ATOM 0 HZ3 LYS A 183 -1.385 2.623 -8.970 1.00 1.67 H new ATOM 2438 N ASN A 184 0.257 8.818 -6.202 0.49 0.43 N ATOM 2439 CA ASN A 184 -0.650 9.961 -6.098 0.49 0.50 C ATOM 2440 C ASN A 184 -1.354 10.233 -7.445 0.49 0.64 C ATOM 2441 O ASN A 184 -1.084 9.560 -8.441 0.49 0.83 O ATOM 2442 CB ASN A 184 0.127 11.171 -5.533 0.49 0.68 C ATOM 2443 CG ASN A 184 0.474 11.075 -4.056 0.49 1.57 C ATOM 2444 OD1 ASN A 184 0.614 10.023 -3.445 0.49 2.71 O ATOM 2445 ND2 ASN A 184 0.646 12.214 -3.436 0.49 1.94 N ATOM 0 H ASN A 184 1.208 9.083 -6.457 0.49 0.43 H new ATOM 0 HA ASN A 184 -1.458 9.746 -5.398 0.49 0.50 H new ATOM 0 HB2 ASN A 184 1.050 11.289 -6.101 0.49 0.68 H new ATOM 0 HB3 ASN A 184 -0.465 12.072 -5.695 0.49 0.68 H new ATOM 0 HD21 ASN A 184 0.896 12.224 -2.447 0.49 1.94 H new ATOM 0 HD22 ASN A 184 0.530 13.092 -3.941 0.49 1.94 H new ATOM 2452 N THR A 185 -2.294 11.188 -7.481 0.49 0.77 N ATOM 2453 CA THR A 185 -2.876 11.690 -8.748 0.49 1.05 C ATOM 2454 C THR A 185 -3.264 13.170 -8.685 0.49 1.31 C ATOM 2455 O THR A 185 -2.716 13.963 -9.449 0.49 2.48 O ATOM 2456 CB THR A 185 -4.038 10.809 -9.247 0.49 1.27 C ATOM 2457 OG1 THR A 185 -4.447 11.258 -10.521 0.49 1.66 O ATOM 2458 CG2 THR A 185 -5.260 10.760 -8.327 0.49 1.35 C ATOM 0 H THR A 185 -2.673 11.634 -6.646 0.49 0.77 H new ATOM 0 HA THR A 185 -2.080 11.617 -9.489 0.49 1.05 H new ATOM 0 HB THR A 185 -3.642 9.794 -9.273 0.49 1.27 H new ATOM 0 HG1 THR A 185 -5.185 10.700 -10.843 0.49 1.66 H new ATOM 0 HG21 THR A 185 -6.021 10.115 -8.766 0.49 1.35 H new ATOM 0 HG22 THR A 185 -4.967 10.365 -7.354 0.49 1.35 H new ATOM 0 HG23 THR A 185 -5.664 11.765 -8.204 0.49 1.35 H new