USER MOD reduce.3.24.130724 H: found=0, std=0, add=960, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 964 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 41 GLN : amide:sc= -2.19 K(o=-2.2,f=-2.8!) USER MOD Set 1.2: A 150 LYS NZ :NH3+ 154:sc=-0.00231 (180deg=0) USER MOD Set 2.1: A 138 THR OG1 : rot 180:sc= -1.62! USER MOD Set 2.2: A 141 GLN : amide:sc= -0.768 X(o=-2.4,f=-2) USER MOD Set 3.1: A 22 MET CE :methyl -165:sc= -1.8 (180deg=-1.9) USER MOD Set 3.2: A 26 LYS NZ :NH3+ -179:sc= -0.81 (180deg=-0.829) USER MOD Set 4.1: A 20 CYS SG : rot 150:sc= 0 USER MOD Set 4.2: A 42 MET CE :methyl 167:sc= -1.75 (180deg=-2.72) USER MOD Single : A 6 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 16 ASN : amide:sc= -5.42! C(o=-5.4!,f=-6.1!) USER MOD Single : A 23 ASN :FLIP amide:sc= -6.83! C(o=-10!,f=-6.8!) USER MOD Single : A 24 ASN : amide:sc= -0.504 K(o=-0.5,f=-5.5!) USER MOD Single : A 27 LYS NZ :NH3+ 163:sc= -0.296 (180deg=-0.734) USER MOD Single : A 32 SER OG : rot -59:sc= 0.0695 USER MOD Single : A 44 GLN : amide:sc= -0.207 K(o=-0.21,f=-1.4!) USER MOD Single : A 55 ASN :FLIP amide:sc= -0.0112 F(o=-1.1,f=-0.011) USER MOD Single : A 65 THR OG1 : rot 33:sc= -1.37! USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot 145:sc= -1.97 USER MOD Single : A 105 GLN : amide:sc= -0.331 K(o=-0.33,f=-2.4!) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 63:sc= 0.504 USER MOD Single : A 115 GLN : amide:sc= -1.31 X(o=-1.3,f=-1.6) USER MOD Single : A 117 GLN :FLIP amide:sc= -0.3 F(o=-1.6,f=-0.3) USER MOD Single : A 120 ASN : amide:sc= -2.79 K(o=-2.8,f=-3.7!) USER MOD Single : A 135 SER OG : rot -101:sc= -0.263 USER MOD Single : A 146 THR OG1 : rot 37:sc= -1.88! USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 TYR OH : rot 30:sc= -2.41 USER MOD Single : A 155 LYS NZ :NH3+ -164:sc= -1.05 (180deg=-1.63) USER MOD Single : A 159 SER OG : rot 69:sc= 0.33 USER MOD Single : A 164 HIS : no HD1:sc= -5! C(o=-5!,f=-4.6!) USER MOD ----------------------------------------------------------------- ATOM 61 N MET A 6 3.737 8.517 -2.940 1.00 0.00 N ATOM 62 CA MET A 6 4.321 8.966 -4.199 1.00 0.00 C ATOM 63 C MET A 6 3.233 9.168 -5.247 1.00 0.00 C ATOM 64 O MET A 6 2.300 8.371 -5.349 1.00 0.00 O ATOM 65 CB MET A 6 5.345 7.945 -4.700 1.00 0.00 C ATOM 66 CG MET A 6 6.295 7.456 -3.619 1.00 0.00 C ATOM 67 SD MET A 6 6.644 5.691 -3.748 1.00 0.00 S ATOM 68 CE MET A 6 5.682 5.050 -2.378 1.00 0.00 C ATOM 0 HA MET A 6 4.824 9.918 -4.027 1.00 0.00 H new ATOM 0 HB2 MET A 6 4.817 7.090 -5.122 1.00 0.00 H new ATOM 0 HB3 MET A 6 5.925 8.391 -5.508 1.00 0.00 H new ATOM 0 HG2 MET A 6 7.230 8.013 -3.683 1.00 0.00 H new ATOM 0 HG3 MET A 6 5.865 7.667 -2.640 1.00 0.00 H new ATOM 0 HE1 MET A 6 5.797 3.967 -2.328 1.00 0.00 H new ATOM 0 HE2 MET A 6 6.033 5.496 -1.447 1.00 0.00 H new ATOM 0 HE3 MET A 6 4.631 5.297 -2.525 1.00 0.00 H new ATOM 78 N ASP A 7 3.352 10.243 -6.022 1.00 0.00 N ATOM 79 CA ASP A 7 2.371 10.553 -7.060 1.00 0.00 C ATOM 80 C ASP A 7 2.386 9.518 -8.184 1.00 0.00 C ATOM 81 O ASP A 7 1.552 9.566 -9.089 1.00 0.00 O ATOM 82 CB ASP A 7 2.619 11.951 -7.624 1.00 0.00 C ATOM 83 CG ASP A 7 4.016 12.113 -8.190 1.00 0.00 C ATOM 84 OD1 ASP A 7 4.210 11.816 -9.389 1.00 0.00 O ATOM 85 OD2 ASP A 7 4.917 12.541 -7.436 1.00 0.00 O ATOM 0 H ASP A 7 4.117 10.914 -5.951 1.00 0.00 H new ATOM 0 HA ASP A 7 1.384 10.523 -6.598 1.00 0.00 H new ATOM 0 HB2 ASP A 7 1.888 12.158 -8.406 1.00 0.00 H new ATOM 0 HB3 ASP A 7 2.462 12.689 -6.837 1.00 0.00 H new ATOM 196 N ARG A 15 -1.541 -0.895 -8.402 1.00 0.00 N ATOM 197 CA ARG A 15 -2.332 0.272 -8.025 1.00 0.00 C ATOM 198 C ARG A 15 -3.720 -0.118 -7.535 1.00 0.00 C ATOM 199 O ARG A 15 -4.435 -0.882 -8.184 1.00 0.00 O ATOM 200 CB ARG A 15 -2.469 1.259 -9.185 1.00 0.00 C ATOM 201 CG ARG A 15 -2.598 0.610 -10.549 1.00 0.00 C ATOM 202 CD ARG A 15 -1.496 1.067 -11.488 1.00 0.00 C ATOM 203 NE ARG A 15 -2.026 1.535 -12.769 1.00 0.00 N ATOM 204 CZ ARG A 15 -1.270 2.015 -13.755 1.00 0.00 C ATOM 205 NH1 ARG A 15 0.049 2.076 -13.620 1.00 0.00 N ATOM 206 NH2 ARG A 15 -1.833 2.430 -14.881 1.00 0.00 N ATOM 0 HA ARG A 15 -1.793 0.754 -7.209 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -3.343 1.886 -9.011 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -1.600 1.917 -9.190 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -2.561 -0.474 -10.442 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -3.569 0.855 -10.979 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -0.927 1.868 -11.017 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -0.803 0.244 -11.661 1.00 0.00 H new ATOM 0 HE ARG A 15 -3.034 1.491 -12.916 1.00 0.00 H new ATOM 0 HH11 ARG A 15 0.489 1.754 -12.758 1.00 0.00 H new ATOM 0 HH12 ARG A 15 0.623 2.445 -14.379 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -2.846 2.382 -14.993 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -1.254 2.797 -15.636 1.00 0.00 H new ATOM 220 N ASN A 16 -4.100 0.448 -6.400 1.00 0.00 N ATOM 221 CA ASN A 16 -5.405 0.214 -5.808 1.00 0.00 C ATOM 222 C ASN A 16 -6.024 1.554 -5.445 1.00 0.00 C ATOM 223 O ASN A 16 -5.380 2.594 -5.588 1.00 0.00 O ATOM 224 CB ASN A 16 -5.287 -0.671 -4.568 1.00 0.00 C ATOM 225 CG ASN A 16 -5.364 -2.146 -4.908 1.00 0.00 C ATOM 226 OD1 ASN A 16 -6.234 -2.864 -4.413 1.00 0.00 O ATOM 227 ND2 ASN A 16 -4.453 -2.605 -5.755 1.00 0.00 N ATOM 0 H ASN A 16 -3.510 1.084 -5.863 1.00 0.00 H new ATOM 0 HA ASN A 16 -6.041 -0.304 -6.526 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -4.342 -0.465 -4.065 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -6.083 -0.419 -3.867 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -4.454 -3.590 -6.021 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -3.751 -1.973 -6.140 1.00 0.00 H new ATOM 234 N VAL A 17 -7.265 1.548 -4.984 1.00 0.00 N ATOM 235 CA VAL A 17 -7.922 2.793 -4.616 1.00 0.00 C ATOM 236 C VAL A 17 -8.823 2.623 -3.408 1.00 0.00 C ATOM 237 O VAL A 17 -9.292 1.525 -3.120 1.00 0.00 O ATOM 238 CB VAL A 17 -8.755 3.373 -5.772 1.00 0.00 C ATOM 239 CG1 VAL A 17 -7.915 3.534 -7.015 1.00 0.00 C ATOM 240 CG2 VAL A 17 -9.957 2.501 -6.067 1.00 0.00 C ATOM 0 H VAL A 17 -7.831 0.709 -4.857 1.00 0.00 H new ATOM 0 HA VAL A 17 -7.118 3.487 -4.372 1.00 0.00 H new ATOM 0 HB VAL A 17 -9.109 4.356 -5.462 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -8.527 3.946 -7.817 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -7.085 4.210 -6.808 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -7.525 2.563 -7.319 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -10.528 2.934 -6.888 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -9.622 1.502 -6.345 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -10.587 2.438 -5.180 1.00 0.00 H new ATOM 250 N GLY A 18 -9.088 3.733 -2.738 1.00 0.00 N ATOM 251 CA GLY A 18 -9.962 3.725 -1.585 1.00 0.00 C ATOM 252 C GLY A 18 -11.050 4.766 -1.716 1.00 0.00 C ATOM 253 O GLY A 18 -10.985 5.625 -2.595 1.00 0.00 O ATOM 0 H GLY A 18 -8.708 4.649 -2.976 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -10.411 2.738 -1.473 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -9.380 3.915 -0.683 1.00 0.00 H new ATOM 257 N ILE A 19 -12.062 4.691 -0.862 1.00 0.00 N ATOM 258 CA ILE A 19 -13.161 5.639 -0.931 1.00 0.00 C ATOM 259 C ILE A 19 -13.426 6.321 0.405 1.00 0.00 C ATOM 260 O ILE A 19 -13.699 5.668 1.412 1.00 0.00 O ATOM 261 CB ILE A 19 -14.451 4.957 -1.419 1.00 0.00 C ATOM 262 CG1 ILE A 19 -14.213 4.326 -2.793 1.00 0.00 C ATOM 263 CG2 ILE A 19 -15.594 5.963 -1.475 1.00 0.00 C ATOM 264 CD1 ILE A 19 -13.741 2.887 -2.737 1.00 0.00 C ATOM 0 H ILE A 19 -12.143 3.993 -0.123 1.00 0.00 H new ATOM 0 HA ILE A 19 -12.859 6.403 -1.647 1.00 0.00 H new ATOM 0 HB ILE A 19 -14.728 4.171 -0.717 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -15.138 4.372 -3.368 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -13.474 4.919 -3.331 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -16.500 5.466 -1.822 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -15.765 6.375 -0.481 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -15.336 6.769 -2.163 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -13.595 2.512 -3.750 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -12.799 2.834 -2.191 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -14.489 2.278 -2.229 1.00 0.00 H new ATOM 276 N CYS A 20 -13.371 7.647 0.389 1.00 0.00 N ATOM 277 CA CYS A 20 -13.632 8.440 1.575 1.00 0.00 C ATOM 278 C CYS A 20 -14.982 9.122 1.424 1.00 0.00 C ATOM 279 O CYS A 20 -15.095 10.168 0.788 1.00 0.00 O ATOM 280 CB CYS A 20 -12.527 9.471 1.780 1.00 0.00 C ATOM 281 SG CYS A 20 -12.190 9.855 3.514 1.00 0.00 S ATOM 0 H CYS A 20 -13.146 8.196 -0.441 1.00 0.00 H new ATOM 0 HA CYS A 20 -13.650 7.793 2.452 1.00 0.00 H new ATOM 0 HB2 CYS A 20 -11.612 9.104 1.315 1.00 0.00 H new ATOM 0 HB3 CYS A 20 -12.801 10.390 1.262 1.00 0.00 H new ATOM 0 HG CYS A 20 -10.939 10.181 3.651 1.00 0.00 H new ATOM 287 N LEU A 21 -16.004 8.503 1.987 1.00 0.00 N ATOM 288 CA LEU A 21 -17.356 9.028 1.891 1.00 0.00 C ATOM 289 C LEU A 21 -17.762 9.780 3.145 1.00 0.00 C ATOM 290 O LEU A 21 -17.735 9.235 4.245 1.00 0.00 O ATOM 291 CB LEU A 21 -18.333 7.892 1.629 1.00 0.00 C ATOM 292 CG LEU A 21 -19.805 8.286 1.657 1.00 0.00 C ATOM 293 CD1 LEU A 21 -20.172 9.085 0.417 1.00 0.00 C ATOM 294 CD2 LEU A 21 -20.662 7.044 1.777 1.00 0.00 C ATOM 0 H LEU A 21 -15.924 7.635 2.516 1.00 0.00 H new ATOM 0 HA LEU A 21 -17.379 9.734 1.061 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -18.108 7.457 0.655 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -18.167 7.112 2.372 1.00 0.00 H new ATOM 0 HG LEU A 21 -19.987 8.921 2.524 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -21.227 9.356 0.458 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -19.566 9.990 0.375 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -19.986 8.483 -0.472 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -21.714 7.328 1.797 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -20.479 6.391 0.923 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -20.411 6.517 2.697 1.00 0.00 H new ATOM 306 N MET A 22 -18.139 11.035 2.964 1.00 0.00 N ATOM 307 CA MET A 22 -18.550 11.870 4.082 1.00 0.00 C ATOM 308 C MET A 22 -19.986 12.351 3.918 1.00 0.00 C ATOM 309 O MET A 22 -20.480 12.506 2.800 1.00 0.00 O ATOM 310 CB MET A 22 -17.608 13.069 4.238 1.00 0.00 C ATOM 311 CG MET A 22 -16.970 13.537 2.939 1.00 0.00 C ATOM 312 SD MET A 22 -18.067 14.590 1.975 1.00 0.00 S ATOM 313 CE MET A 22 -17.339 16.196 2.278 1.00 0.00 C ATOM 0 H MET A 22 -18.169 11.498 2.056 1.00 0.00 H new ATOM 0 HA MET A 22 -18.497 11.260 4.984 1.00 0.00 H new ATOM 0 HB2 MET A 22 -18.164 13.898 4.676 1.00 0.00 H new ATOM 0 HB3 MET A 22 -16.819 12.807 4.943 1.00 0.00 H new ATOM 0 HG2 MET A 22 -16.053 14.082 3.164 1.00 0.00 H new ATOM 0 HG3 MET A 22 -16.688 12.669 2.343 1.00 0.00 H new ATOM 0 HE1 MET A 22 -18.040 16.975 1.979 1.00 0.00 H new ATOM 0 HE2 MET A 22 -17.113 16.299 3.339 1.00 0.00 H new ATOM 0 HE3 MET A 22 -16.420 16.294 1.700 1.00 0.00 H new ATOM 323 N ASN A 23 -20.647 12.589 5.046 1.00 0.00 N ATOM 324 CA ASN A 23 -22.024 13.056 5.036 1.00 0.00 C ATOM 325 C ASN A 23 -22.069 14.571 5.171 1.00 0.00 C ATOM 326 O ASN A 23 -21.045 15.219 5.395 1.00 0.00 O ATOM 327 CB ASN A 23 -22.833 12.453 6.193 1.00 0.00 C ATOM 328 CG ASN A 23 -22.347 11.097 6.636 1.00 0.00 C ATOM 329 OD1 ASN A 23 -21.269 11.083 7.414 1.00 0.00 O flip ATOM 330 ND2 ASN A 23 -22.947 10.083 6.295 1.00 0.00 N flip ATOM 0 H ASN A 23 -20.249 12.466 5.977 1.00 0.00 H new ATOM 0 HA ASN A 23 -22.460 12.742 4.088 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -22.799 13.136 7.042 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -23.877 12.373 5.890 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -23.769 10.154 5.696 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -22.623 9.169 6.610 1.00 0.00 H new ATOM 337 N ASN A 24 -23.270 15.122 5.080 1.00 0.00 N ATOM 338 CA ASN A 24 -23.479 16.555 5.238 1.00 0.00 C ATOM 339 C ASN A 24 -22.984 17.045 6.608 1.00 0.00 C ATOM 340 O ASN A 24 -23.029 18.241 6.896 1.00 0.00 O ATOM 341 CB ASN A 24 -24.961 16.890 5.069 1.00 0.00 C ATOM 342 CG ASN A 24 -25.844 16.113 6.026 1.00 0.00 C ATOM 343 OD1 ASN A 24 -25.498 15.011 6.453 1.00 0.00 O ATOM 344 ND2 ASN A 24 -26.993 16.683 6.366 1.00 0.00 N ATOM 0 H ASN A 24 -24.123 14.593 4.896 1.00 0.00 H new ATOM 0 HA ASN A 24 -22.902 17.066 4.467 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -25.109 17.958 5.228 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -25.264 16.676 4.044 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -27.629 16.206 7.005 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -27.240 17.598 5.988 1.00 0.00 H new ATOM 351 N ASP A 25 -22.524 16.118 7.457 1.00 0.00 N ATOM 352 CA ASP A 25 -22.045 16.471 8.789 1.00 0.00 C ATOM 353 C ASP A 25 -20.527 16.563 8.826 1.00 0.00 C ATOM 354 O ASP A 25 -19.942 16.842 9.871 1.00 0.00 O ATOM 355 CB ASP A 25 -22.500 15.425 9.801 1.00 0.00 C ATOM 356 CG ASP A 25 -23.842 15.754 10.425 1.00 0.00 C ATOM 357 OD1 ASP A 25 -24.877 15.539 9.759 1.00 0.00 O ATOM 358 OD2 ASP A 25 -23.861 16.226 11.581 1.00 0.00 O ATOM 0 H ASP A 25 -22.475 15.122 7.242 1.00 0.00 H new ATOM 0 HA ASP A 25 -22.462 17.446 9.042 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -22.561 14.454 9.310 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -21.751 15.337 10.588 1.00 0.00 H new ATOM 363 N LYS A 26 -19.900 16.292 7.692 1.00 0.00 N ATOM 364 CA LYS A 26 -18.449 16.309 7.589 1.00 0.00 C ATOM 365 C LYS A 26 -17.866 15.066 8.250 1.00 0.00 C ATOM 366 O LYS A 26 -16.686 15.030 8.600 1.00 0.00 O ATOM 367 CB LYS A 26 -17.852 17.579 8.216 1.00 0.00 C ATOM 368 CG LYS A 26 -17.745 18.746 7.248 1.00 0.00 C ATOM 369 CD LYS A 26 -16.887 18.402 6.041 1.00 0.00 C ATOM 370 CE LYS A 26 -17.605 18.717 4.737 1.00 0.00 C ATOM 371 NZ LYS A 26 -18.910 18.006 4.629 1.00 0.00 N ATOM 0 H LYS A 26 -20.378 16.056 6.823 1.00 0.00 H new ATOM 0 HA LYS A 26 -18.187 16.310 6.531 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -18.467 17.878 9.065 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -16.860 17.350 8.606 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -18.742 19.034 6.915 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -17.319 19.607 7.763 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -15.952 18.961 6.087 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -16.627 17.344 6.068 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -17.771 19.792 4.666 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -16.969 18.437 3.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -19.356 18.236 3.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -18.752 16.980 4.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -19.534 18.305 5.406 1.00 0.00 H new ATOM 385 N LYS A 27 -18.699 14.030 8.392 1.00 0.00 N ATOM 386 CA LYS A 27 -18.258 12.777 8.978 1.00 0.00 C ATOM 387 C LYS A 27 -17.820 11.858 7.853 1.00 0.00 C ATOM 388 O LYS A 27 -17.850 12.260 6.696 1.00 0.00 O ATOM 389 CB LYS A 27 -19.390 12.131 9.780 1.00 0.00 C ATOM 390 CG LYS A 27 -19.401 12.524 11.247 1.00 0.00 C ATOM 391 CD LYS A 27 -20.813 12.777 11.751 1.00 0.00 C ATOM 392 CE LYS A 27 -20.802 13.481 13.097 1.00 0.00 C ATOM 393 NZ LYS A 27 -21.527 14.781 13.053 1.00 0.00 N ATOM 0 H LYS A 27 -19.678 14.042 8.107 1.00 0.00 H new ATOM 0 HA LYS A 27 -17.428 12.958 9.661 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -20.344 12.407 9.332 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -19.304 11.047 9.704 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -18.940 11.734 11.839 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -18.798 13.421 11.388 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -21.357 13.383 11.026 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -21.345 11.830 11.838 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -21.260 12.836 13.847 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -19.771 13.651 13.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -21.748 15.088 14.022 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -20.930 15.496 12.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -22.411 14.668 12.516 1.00 0.00 H new ATOM 407 N ILE A 28 -17.404 10.644 8.170 1.00 0.00 N ATOM 408 CA ILE A 28 -16.959 9.725 7.134 1.00 0.00 C ATOM 409 C ILE A 28 -17.518 8.329 7.338 1.00 0.00 C ATOM 410 O ILE A 28 -17.683 7.858 8.465 1.00 0.00 O ATOM 411 CB ILE A 28 -15.421 9.643 7.062 1.00 0.00 C ATOM 412 CG1 ILE A 28 -14.817 11.043 6.940 1.00 0.00 C ATOM 413 CG2 ILE A 28 -14.984 8.770 5.891 1.00 0.00 C ATOM 414 CD1 ILE A 28 -14.867 11.836 8.224 1.00 0.00 C ATOM 0 H ILE A 28 -17.365 10.275 9.120 1.00 0.00 H new ATOM 0 HA ILE A 28 -17.339 10.126 6.194 1.00 0.00 H new ATOM 0 HB ILE A 28 -15.058 9.188 7.983 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -13.780 10.955 6.617 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -15.348 11.592 6.162 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -13.895 8.725 5.857 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -15.385 7.764 6.017 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -15.358 9.196 4.960 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -14.422 12.818 8.063 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -15.904 11.955 8.538 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -14.312 11.308 8.999 1.00 0.00 H new ATOM 426 N PHE A 29 -17.802 7.680 6.222 1.00 0.00 N ATOM 427 CA PHE A 29 -18.343 6.334 6.209 1.00 0.00 C ATOM 428 C PHE A 29 -17.330 5.333 6.754 1.00 0.00 C ATOM 429 O PHE A 29 -16.334 5.026 6.100 1.00 0.00 O ATOM 430 CB PHE A 29 -18.730 5.963 4.778 1.00 0.00 C ATOM 431 CG PHE A 29 -19.227 4.561 4.633 1.00 0.00 C ATOM 432 CD1 PHE A 29 -20.275 4.109 5.408 1.00 0.00 C ATOM 433 CD2 PHE A 29 -18.647 3.695 3.721 1.00 0.00 C ATOM 434 CE1 PHE A 29 -20.738 2.820 5.279 1.00 0.00 C ATOM 435 CE2 PHE A 29 -19.110 2.401 3.588 1.00 0.00 C ATOM 436 CZ PHE A 29 -20.157 1.965 4.371 1.00 0.00 C ATOM 0 H PHE A 29 -17.662 8.076 5.293 1.00 0.00 H new ATOM 0 HA PHE A 29 -19.224 6.302 6.850 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -19.501 6.650 4.430 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -17.865 6.101 4.130 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -20.737 4.774 6.123 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -17.825 4.035 3.108 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -21.559 2.479 5.892 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -18.653 1.733 2.873 1.00 0.00 H new ATOM 0 HZ PHE A 29 -20.521 0.953 4.272 1.00 0.00 H new ATOM 446 N ALA A 30 -17.592 4.823 7.951 1.00 0.00 N ATOM 447 CA ALA A 30 -16.703 3.854 8.572 1.00 0.00 C ATOM 448 C ALA A 30 -17.267 2.445 8.467 1.00 0.00 C ATOM 449 O ALA A 30 -18.467 2.236 8.620 1.00 0.00 O ATOM 450 CB ALA A 30 -16.458 4.214 10.031 1.00 0.00 C ATOM 0 H ALA A 30 -18.411 5.065 8.509 1.00 0.00 H new ATOM 0 HA ALA A 30 -15.753 3.881 8.038 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -15.791 3.478 10.480 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -16.001 5.202 10.090 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -17.406 4.220 10.569 1.00 0.00 H new ATOM 456 N ALA A 31 -16.392 1.482 8.205 1.00 0.00 N ATOM 457 CA ALA A 31 -16.802 0.088 8.081 1.00 0.00 C ATOM 458 C ALA A 31 -15.792 -0.835 8.758 1.00 0.00 C ATOM 459 O ALA A 31 -14.583 -0.679 8.584 1.00 0.00 O ATOM 460 CB ALA A 31 -16.972 -0.285 6.616 1.00 0.00 C ATOM 0 H ALA A 31 -15.393 1.641 8.074 1.00 0.00 H new ATOM 0 HA ALA A 31 -17.762 -0.035 8.583 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -17.278 -1.328 6.539 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -17.734 0.351 6.165 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -16.026 -0.145 6.093 1.00 0.00 H new ATOM 466 N SER A 32 -16.292 -1.790 9.540 1.00 0.00 N ATOM 467 CA SER A 32 -15.421 -2.721 10.251 1.00 0.00 C ATOM 468 C SER A 32 -15.324 -4.065 9.535 1.00 0.00 C ATOM 469 O SER A 32 -16.266 -4.502 8.873 1.00 0.00 O ATOM 470 CB SER A 32 -15.915 -2.930 11.683 1.00 0.00 C ATOM 471 OG SER A 32 -17.085 -3.730 11.709 1.00 0.00 O ATOM 0 H SER A 32 -17.289 -1.938 9.696 1.00 0.00 H new ATOM 0 HA SER A 32 -14.425 -2.279 10.274 1.00 0.00 H new ATOM 0 HB2 SER A 32 -15.133 -3.405 12.275 1.00 0.00 H new ATOM 0 HB3 SER A 32 -16.121 -1.964 12.144 1.00 0.00 H new ATOM 0 HG SER A 32 -17.788 -3.298 11.181 1.00 0.00 H new ATOM 477 N ARG A 33 -14.170 -4.713 9.677 1.00 0.00 N ATOM 478 CA ARG A 33 -13.920 -6.009 9.057 1.00 0.00 C ATOM 479 C ARG A 33 -14.702 -7.121 9.751 1.00 0.00 C ATOM 480 O ARG A 33 -14.666 -7.235 10.973 1.00 0.00 O ATOM 481 CB ARG A 33 -12.425 -6.325 9.117 1.00 0.00 C ATOM 482 CG ARG A 33 -11.537 -5.246 8.515 1.00 0.00 C ATOM 483 CD ARG A 33 -10.154 -5.246 9.152 1.00 0.00 C ATOM 484 NE ARG A 33 -9.601 -6.595 9.248 1.00 0.00 N ATOM 485 CZ ARG A 33 -8.838 -7.158 8.311 1.00 0.00 C ATOM 486 NH1 ARG A 33 -8.539 -6.499 7.198 1.00 0.00 N ATOM 487 NH2 ARG A 33 -8.376 -8.387 8.487 1.00 0.00 N ATOM 0 H ARG A 33 -13.386 -4.355 10.223 1.00 0.00 H new ATOM 0 HA ARG A 33 -14.252 -5.957 8.020 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -12.138 -6.478 10.158 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -12.242 -7.264 8.595 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -11.445 -5.406 7.441 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -12.003 -4.270 8.653 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -9.483 -4.619 8.564 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -10.212 -4.805 10.147 1.00 0.00 H new ATOM 0 HE ARG A 33 -9.812 -7.140 10.084 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -8.894 -5.554 7.054 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -7.954 -6.938 6.487 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -8.604 -8.901 9.338 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -7.792 -8.820 7.771 1.00 0.00 H new ATOM 501 N LEU A 34 -15.411 -7.926 8.959 1.00 0.00 N ATOM 502 CA LEU A 34 -16.214 -9.046 9.469 1.00 0.00 C ATOM 503 C LEU A 34 -15.386 -10.020 10.310 1.00 0.00 C ATOM 504 O LEU A 34 -15.335 -11.217 10.024 1.00 0.00 O ATOM 505 CB LEU A 34 -16.844 -9.801 8.305 1.00 0.00 C ATOM 506 CG LEU A 34 -18.161 -9.213 7.826 1.00 0.00 C ATOM 507 CD1 LEU A 34 -18.105 -8.900 6.345 1.00 0.00 C ATOM 508 CD2 LEU A 34 -19.320 -10.142 8.150 1.00 0.00 C ATOM 0 H LEU A 34 -15.447 -7.823 7.945 1.00 0.00 H new ATOM 0 HA LEU A 34 -16.986 -8.623 10.112 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -16.141 -9.816 7.472 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -17.008 -10.837 8.603 1.00 0.00 H new ATOM 0 HG LEU A 34 -18.328 -8.276 8.358 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -19.059 -8.480 6.025 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -17.310 -8.179 6.155 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -17.906 -9.815 5.787 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -20.251 -9.699 7.797 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -19.166 -11.102 7.657 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -19.375 -10.292 9.228 1.00 0.00 H new ATOM 520 N ASP A 35 -14.745 -9.505 11.341 1.00 0.00 N ATOM 521 CA ASP A 35 -13.920 -10.316 12.226 1.00 0.00 C ATOM 522 C ASP A 35 -13.374 -9.456 13.356 1.00 0.00 C ATOM 523 O ASP A 35 -13.191 -9.923 14.481 1.00 0.00 O ATOM 524 CB ASP A 35 -12.767 -10.963 11.451 1.00 0.00 C ATOM 525 CG ASP A 35 -12.090 -9.999 10.495 1.00 0.00 C ATOM 526 OD1 ASP A 35 -12.794 -9.407 9.650 1.00 0.00 O ATOM 527 OD2 ASP A 35 -10.857 -9.839 10.590 1.00 0.00 O ATOM 0 H ASP A 35 -14.779 -8.517 11.591 1.00 0.00 H new ATOM 0 HA ASP A 35 -14.538 -11.110 12.646 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -12.030 -11.346 12.157 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -13.146 -11.818 10.891 1.00 0.00 H new ATOM 532 N ILE A 36 -13.118 -8.192 13.039 1.00 0.00 N ATOM 533 CA ILE A 36 -12.595 -7.245 14.007 1.00 0.00 C ATOM 534 C ILE A 36 -13.595 -6.113 14.242 1.00 0.00 C ATOM 535 O ILE A 36 -13.766 -5.242 13.390 1.00 0.00 O ATOM 536 CB ILE A 36 -11.262 -6.649 13.524 1.00 0.00 C ATOM 537 CG1 ILE A 36 -10.338 -7.753 13.006 1.00 0.00 C ATOM 538 CG2 ILE A 36 -10.593 -5.870 14.644 1.00 0.00 C ATOM 539 CD1 ILE A 36 -9.043 -7.231 12.424 1.00 0.00 C ATOM 0 H ILE A 36 -13.267 -7.800 12.109 1.00 0.00 H new ATOM 0 HA ILE A 36 -12.428 -7.782 14.941 1.00 0.00 H new ATOM 0 HB ILE A 36 -11.466 -5.962 12.703 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -10.110 -8.438 13.822 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -10.864 -8.328 12.244 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -9.651 -5.455 14.286 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -11.248 -5.060 14.965 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -10.400 -6.536 15.485 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -8.437 -8.068 12.076 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -9.261 -6.569 11.586 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -8.496 -6.680 13.189 1.00 0.00 H new ATOM 551 N PRO A 37 -14.282 -6.117 15.398 1.00 0.00 N ATOM 552 CA PRO A 37 -15.278 -5.091 15.725 1.00 0.00 C ATOM 553 C PRO A 37 -14.651 -3.749 16.081 1.00 0.00 C ATOM 554 O PRO A 37 -15.311 -2.712 16.032 1.00 0.00 O ATOM 555 CB PRO A 37 -15.999 -5.676 16.937 1.00 0.00 C ATOM 556 CG PRO A 37 -14.994 -6.566 17.583 1.00 0.00 C ATOM 557 CD PRO A 37 -14.154 -7.125 16.468 1.00 0.00 C ATOM 0 HA PRO A 37 -15.929 -4.878 14.877 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -16.329 -4.891 17.618 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -16.887 -6.233 16.638 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -14.380 -6.011 18.292 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -15.482 -7.365 18.141 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -13.116 -7.255 16.774 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -14.515 -8.101 16.144 1.00 0.00 H new ATOM 565 N ASP A 38 -13.374 -3.773 16.442 1.00 0.00 N ATOM 566 CA ASP A 38 -12.665 -2.552 16.809 1.00 0.00 C ATOM 567 C ASP A 38 -11.957 -1.931 15.606 1.00 0.00 C ATOM 568 O ASP A 38 -11.459 -0.807 15.687 1.00 0.00 O ATOM 569 CB ASP A 38 -11.653 -2.840 17.917 1.00 0.00 C ATOM 570 CG ASP A 38 -12.306 -2.949 19.280 1.00 0.00 C ATOM 571 OD1 ASP A 38 -12.739 -4.064 19.643 1.00 0.00 O ATOM 572 OD2 ASP A 38 -12.385 -1.921 19.985 1.00 0.00 O ATOM 0 H ASP A 38 -12.809 -4.621 16.489 1.00 0.00 H new ATOM 0 HA ASP A 38 -13.404 -1.837 17.171 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -11.128 -3.768 17.693 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -10.905 -2.047 17.938 1.00 0.00 H new ATOM 577 N ALA A 39 -11.910 -2.658 14.492 1.00 0.00 N ATOM 578 CA ALA A 39 -11.258 -2.150 13.291 1.00 0.00 C ATOM 579 C ALA A 39 -12.259 -1.475 12.362 1.00 0.00 C ATOM 580 O ALA A 39 -13.045 -2.140 11.696 1.00 0.00 O ATOM 581 CB ALA A 39 -10.534 -3.267 12.554 1.00 0.00 C ATOM 0 H ALA A 39 -12.311 -3.591 14.397 1.00 0.00 H new ATOM 0 HA ALA A 39 -10.527 -1.406 13.606 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -10.055 -2.864 11.662 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -9.777 -3.702 13.206 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -11.250 -4.036 12.265 1.00 0.00 H new ATOM 587 N TRP A 40 -12.204 -0.152 12.315 1.00 0.00 N ATOM 588 CA TRP A 40 -13.083 0.632 11.454 1.00 0.00 C ATOM 589 C TRP A 40 -12.298 1.160 10.262 1.00 0.00 C ATOM 590 O TRP A 40 -11.127 1.488 10.393 1.00 0.00 O ATOM 591 CB TRP A 40 -13.698 1.786 12.237 1.00 0.00 C ATOM 592 CG TRP A 40 -14.846 1.353 13.095 1.00 0.00 C ATOM 593 CD1 TRP A 40 -14.795 0.911 14.385 1.00 0.00 C ATOM 594 CD2 TRP A 40 -16.215 1.306 12.712 1.00 0.00 C ATOM 595 NE1 TRP A 40 -16.064 0.604 14.827 1.00 0.00 N ATOM 596 CE2 TRP A 40 -16.952 0.842 13.816 1.00 0.00 C ATOM 597 CE3 TRP A 40 -16.889 1.618 11.540 1.00 0.00 C ATOM 598 CZ2 TRP A 40 -18.338 0.691 13.774 1.00 0.00 C ATOM 599 CZ3 TRP A 40 -18.254 1.467 11.498 1.00 0.00 C ATOM 600 CH2 TRP A 40 -18.971 1.010 12.608 1.00 0.00 C ATOM 0 H TRP A 40 -11.554 0.407 12.868 1.00 0.00 H new ATOM 0 HA TRP A 40 -13.889 -0.007 11.093 1.00 0.00 H new ATOM 0 HB2 TRP A 40 -12.933 2.243 12.864 1.00 0.00 H new ATOM 0 HB3 TRP A 40 -14.039 2.552 11.540 1.00 0.00 H new ATOM 0 HD1 TRP A 40 -13.894 0.816 14.973 1.00 0.00 H new ATOM 0 HE1 TRP A 40 -16.301 0.256 15.756 1.00 0.00 H new ATOM 0 HE3 TRP A 40 -16.349 1.974 10.675 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 -18.889 0.335 14.632 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 -18.784 1.706 10.588 1.00 0.00 H new ATOM 0 HH2 TRP A 40 -20.044 0.908 12.541 1.00 0.00 H new ATOM 611 N GLN A 41 -12.930 1.238 9.101 1.00 0.00 N ATOM 612 CA GLN A 41 -12.245 1.728 7.912 1.00 0.00 C ATOM 613 C GLN A 41 -13.237 2.335 6.915 1.00 0.00 C ATOM 614 O GLN A 41 -14.004 3.226 7.272 1.00 0.00 O ATOM 615 CB GLN A 41 -11.431 0.593 7.271 1.00 0.00 C ATOM 616 CG GLN A 41 -10.065 0.381 7.900 1.00 0.00 C ATOM 617 CD GLN A 41 -9.857 -1.042 8.367 1.00 0.00 C ATOM 618 OE1 GLN A 41 -9.951 -1.338 9.558 1.00 0.00 O ATOM 619 NE2 GLN A 41 -9.579 -1.936 7.425 1.00 0.00 N ATOM 0 H GLN A 41 -13.904 0.972 8.956 1.00 0.00 H new ATOM 0 HA GLN A 41 -11.558 2.521 8.206 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -12.000 -0.334 7.342 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -11.302 0.807 6.210 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.292 0.639 7.177 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -9.949 1.058 8.746 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -9.511 -1.645 6.450 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -9.434 -2.914 7.677 1.00 0.00 H new ATOM 628 N MET A 42 -13.221 1.862 5.668 1.00 0.00 N ATOM 629 CA MET A 42 -14.115 2.366 4.640 1.00 0.00 C ATOM 630 C MET A 42 -13.821 1.676 3.313 1.00 0.00 C ATOM 631 O MET A 42 -12.748 1.103 3.126 1.00 0.00 O ATOM 632 CB MET A 42 -13.971 3.886 4.493 1.00 0.00 C ATOM 633 CG MET A 42 -12.575 4.330 4.098 1.00 0.00 C ATOM 634 SD MET A 42 -11.614 4.925 5.501 1.00 0.00 S ATOM 635 CE MET A 42 -10.513 6.078 4.686 1.00 0.00 C ATOM 0 H MET A 42 -12.592 1.125 5.350 1.00 0.00 H new ATOM 0 HA MET A 42 -15.142 2.148 4.934 1.00 0.00 H new ATOM 0 HB2 MET A 42 -14.680 4.239 3.744 1.00 0.00 H new ATOM 0 HB3 MET A 42 -14.241 4.361 5.436 1.00 0.00 H new ATOM 0 HG2 MET A 42 -12.051 3.496 3.631 1.00 0.00 H new ATOM 0 HG3 MET A 42 -12.647 5.120 3.350 1.00 0.00 H new ATOM 0 HE1 MET A 42 -10.016 6.696 5.433 1.00 0.00 H new ATOM 0 HE2 MET A 42 -9.766 5.526 4.116 1.00 0.00 H new ATOM 0 HE3 MET A 42 -11.087 6.714 4.012 1.00 0.00 H new ATOM 645 N PRO A 43 -14.775 1.717 2.375 1.00 0.00 N ATOM 646 CA PRO A 43 -14.640 1.096 1.056 1.00 0.00 C ATOM 647 C PRO A 43 -13.249 1.281 0.447 1.00 0.00 C ATOM 648 O PRO A 43 -12.630 2.334 0.593 1.00 0.00 O ATOM 649 CB PRO A 43 -15.707 1.820 0.213 1.00 0.00 C ATOM 650 CG PRO A 43 -16.326 2.844 1.118 1.00 0.00 C ATOM 651 CD PRO A 43 -16.074 2.368 2.515 1.00 0.00 C ATOM 0 HA PRO A 43 -14.773 0.015 1.103 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -15.259 2.292 -0.661 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -16.457 1.119 -0.153 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -15.884 3.827 0.955 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -17.395 2.940 0.925 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -16.045 3.191 3.229 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -16.844 1.676 2.857 1.00 0.00 H new ATOM 659 N GLN A 44 -12.766 0.243 -0.238 1.00 0.00 N ATOM 660 CA GLN A 44 -11.450 0.282 -0.870 1.00 0.00 C ATOM 661 C GLN A 44 -11.224 -0.957 -1.734 1.00 0.00 C ATOM 662 O GLN A 44 -11.701 -2.044 -1.408 1.00 0.00 O ATOM 663 CB GLN A 44 -10.352 0.370 0.191 1.00 0.00 C ATOM 664 CG GLN A 44 -9.116 1.116 -0.270 1.00 0.00 C ATOM 665 CD GLN A 44 -7.835 0.440 0.170 1.00 0.00 C ATOM 666 OE1 GLN A 44 -7.234 0.813 1.176 1.00 0.00 O ATOM 667 NE2 GLN A 44 -7.413 -0.563 -0.590 1.00 0.00 N ATOM 0 H GLN A 44 -13.269 -0.635 -0.368 1.00 0.00 H new ATOM 0 HA GLN A 44 -11.410 1.167 -1.506 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -10.754 0.863 1.076 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -10.066 -0.639 0.490 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -9.127 1.195 -1.357 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -9.141 2.132 0.123 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -7.946 -0.837 -1.416 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -6.556 -1.060 -0.348 1.00 0.00 H new ATOM 676 N GLY A 45 -10.493 -0.789 -2.835 1.00 0.00 N ATOM 677 CA GLY A 45 -10.222 -1.907 -3.720 1.00 0.00 C ATOM 678 C GLY A 45 -9.034 -1.652 -4.621 1.00 0.00 C ATOM 679 O GLY A 45 -8.228 -0.762 -4.354 1.00 0.00 O ATOM 0 H GLY A 45 -10.086 0.099 -3.128 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -10.039 -2.802 -3.125 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -11.103 -2.105 -4.331 1.00 0.00 H new ATOM 683 N GLY A 46 -8.918 -2.433 -5.690 1.00 0.00 N ATOM 684 CA GLY A 46 -7.811 -2.264 -6.610 1.00 0.00 C ATOM 685 C GLY A 46 -8.261 -1.936 -8.020 1.00 0.00 C ATOM 686 O GLY A 46 -9.241 -2.490 -8.515 1.00 0.00 O ATOM 0 H GLY A 46 -9.570 -3.178 -5.934 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -7.162 -1.468 -6.247 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -7.216 -3.177 -6.627 1.00 0.00 H new ATOM 690 N ILE A 47 -7.535 -1.027 -8.663 1.00 0.00 N ATOM 691 CA ILE A 47 -7.850 -0.609 -10.022 1.00 0.00 C ATOM 692 C ILE A 47 -7.576 -1.728 -11.018 1.00 0.00 C ATOM 693 O ILE A 47 -6.599 -2.465 -10.886 1.00 0.00 O ATOM 694 CB ILE A 47 -7.035 0.632 -10.428 1.00 0.00 C ATOM 695 CG1 ILE A 47 -7.112 1.696 -9.337 1.00 0.00 C ATOM 696 CG2 ILE A 47 -7.537 1.192 -11.749 1.00 0.00 C ATOM 697 CD1 ILE A 47 -6.228 2.894 -9.599 1.00 0.00 C ATOM 0 H ILE A 47 -6.720 -0.564 -8.261 1.00 0.00 H new ATOM 0 HA ILE A 47 -8.911 -0.362 -10.040 1.00 0.00 H new ATOM 0 HB ILE A 47 -5.994 0.335 -10.554 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -8.145 2.031 -9.240 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -6.831 1.249 -8.384 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -6.949 2.069 -12.020 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -7.438 0.435 -12.526 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -8.585 1.475 -11.650 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -6.333 3.609 -8.783 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -5.189 2.572 -9.667 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -6.523 3.366 -10.536 1.00 0.00 H new ATOM 709 N ASP A 48 -8.440 -1.845 -12.018 1.00 0.00 N ATOM 710 CA ASP A 48 -8.284 -2.871 -13.040 1.00 0.00 C ATOM 711 C ASP A 48 -7.073 -2.584 -13.919 1.00 0.00 C ATOM 712 O ASP A 48 -6.310 -1.654 -13.660 1.00 0.00 O ATOM 713 CB ASP A 48 -9.546 -2.963 -13.899 1.00 0.00 C ATOM 714 CG ASP A 48 -10.809 -3.040 -13.064 1.00 0.00 C ATOM 715 OD1 ASP A 48 -10.737 -3.539 -11.921 1.00 0.00 O ATOM 716 OD2 ASP A 48 -11.872 -2.603 -13.555 1.00 0.00 O ATOM 0 H ASP A 48 -9.254 -1.243 -12.143 1.00 0.00 H new ATOM 0 HA ASP A 48 -8.126 -3.826 -12.539 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -9.600 -2.094 -14.555 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -9.483 -3.843 -14.540 1.00 0.00 H new ATOM 721 N GLU A 49 -6.905 -3.391 -14.962 1.00 0.00 N ATOM 722 CA GLU A 49 -5.790 -3.227 -15.892 1.00 0.00 C ATOM 723 C GLU A 49 -5.678 -1.777 -16.365 1.00 0.00 C ATOM 724 O GLU A 49 -4.841 -1.019 -15.875 1.00 0.00 O ATOM 725 CB GLU A 49 -5.944 -4.172 -17.090 1.00 0.00 C ATOM 726 CG GLU A 49 -4.626 -4.518 -17.766 1.00 0.00 C ATOM 727 CD GLU A 49 -4.785 -4.784 -19.251 1.00 0.00 C ATOM 728 OE1 GLU A 49 -5.833 -5.337 -19.648 1.00 0.00 O ATOM 729 OE2 GLU A 49 -3.861 -4.438 -20.018 1.00 0.00 O ATOM 0 H GLU A 49 -7.528 -4.167 -15.186 1.00 0.00 H new ATOM 0 HA GLU A 49 -4.871 -3.482 -15.364 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -6.424 -5.092 -16.757 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -6.608 -3.712 -17.822 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -3.921 -3.699 -17.621 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -4.196 -5.398 -17.287 1.00 0.00 H new ATOM 736 N GLY A 50 -6.525 -1.398 -17.318 1.00 0.00 N ATOM 737 CA GLY A 50 -6.502 -0.043 -17.834 1.00 0.00 C ATOM 738 C GLY A 50 -7.724 0.750 -17.420 1.00 0.00 C ATOM 739 O GLY A 50 -8.385 1.369 -18.255 1.00 0.00 O ATOM 0 H GLY A 50 -7.226 -2.006 -17.741 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -5.605 0.464 -17.478 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -6.442 -0.072 -18.922 1.00 0.00 H new ATOM 743 N GLU A 51 -8.022 0.731 -16.127 1.00 0.00 N ATOM 744 CA GLU A 51 -9.167 1.454 -15.596 1.00 0.00 C ATOM 745 C GLU A 51 -8.709 2.618 -14.727 1.00 0.00 C ATOM 746 O GLU A 51 -7.654 2.557 -14.096 1.00 0.00 O ATOM 747 CB GLU A 51 -10.057 0.510 -14.779 1.00 0.00 C ATOM 748 CG GLU A 51 -11.379 1.130 -14.346 1.00 0.00 C ATOM 749 CD GLU A 51 -12.497 0.875 -15.337 1.00 0.00 C ATOM 750 OE1 GLU A 51 -12.548 1.577 -16.368 1.00 0.00 O ATOM 751 OE2 GLU A 51 -13.323 -0.027 -15.081 1.00 0.00 O ATOM 0 H GLU A 51 -7.484 0.221 -15.426 1.00 0.00 H new ATOM 0 HA GLU A 51 -9.742 1.849 -16.433 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -10.262 -0.383 -15.370 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -9.511 0.187 -13.893 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -11.663 0.728 -13.373 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -11.248 2.205 -14.221 1.00 0.00 H new ATOM 758 N ASP A 52 -9.508 3.674 -14.696 1.00 0.00 N ATOM 759 CA ASP A 52 -9.186 4.847 -13.895 1.00 0.00 C ATOM 760 C ASP A 52 -9.329 4.525 -12.409 1.00 0.00 C ATOM 761 O ASP A 52 -9.969 3.541 -12.042 1.00 0.00 O ATOM 762 CB ASP A 52 -10.101 6.014 -14.269 1.00 0.00 C ATOM 763 CG ASP A 52 -9.947 6.438 -15.717 1.00 0.00 C ATOM 764 OD1 ASP A 52 -10.307 5.642 -16.612 1.00 0.00 O ATOM 765 OD2 ASP A 52 -9.470 7.567 -15.960 1.00 0.00 O ATOM 0 H ASP A 52 -10.383 3.744 -15.215 1.00 0.00 H new ATOM 0 HA ASP A 52 -8.154 5.133 -14.097 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -11.138 5.731 -14.086 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -9.883 6.863 -13.621 1.00 0.00 H new ATOM 770 N PRO A 53 -8.736 5.352 -11.531 1.00 0.00 N ATOM 771 CA PRO A 53 -8.799 5.154 -10.084 1.00 0.00 C ATOM 772 C PRO A 53 -10.082 5.710 -9.488 1.00 0.00 C ATOM 773 O PRO A 53 -10.800 5.021 -8.765 1.00 0.00 O ATOM 774 CB PRO A 53 -7.585 5.933 -9.558 1.00 0.00 C ATOM 775 CG PRO A 53 -6.965 6.617 -10.742 1.00 0.00 C ATOM 776 CD PRO A 53 -7.955 6.541 -11.869 1.00 0.00 C ATOM 0 HA PRO A 53 -8.788 4.097 -9.817 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -7.889 6.661 -8.806 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -6.871 5.261 -9.081 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -6.729 7.655 -10.507 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -6.029 6.133 -11.019 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -8.578 7.434 -11.921 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -7.461 6.440 -12.836 1.00 0.00 H new ATOM 784 N ARG A 54 -10.365 6.964 -9.807 1.00 0.00 N ATOM 785 CA ARG A 54 -11.566 7.635 -9.320 1.00 0.00 C ATOM 786 C ARG A 54 -12.799 6.774 -9.566 1.00 0.00 C ATOM 787 O ARG A 54 -13.621 6.578 -8.672 1.00 0.00 O ATOM 788 CB ARG A 54 -11.741 8.977 -10.036 1.00 0.00 C ATOM 789 CG ARG A 54 -12.322 10.075 -9.162 1.00 0.00 C ATOM 790 CD ARG A 54 -13.753 9.780 -8.775 1.00 0.00 C ATOM 791 NE ARG A 54 -14.702 10.431 -9.670 1.00 0.00 N ATOM 792 CZ ARG A 54 -14.809 11.750 -9.821 1.00 0.00 C ATOM 793 NH1 ARG A 54 -14.021 12.579 -9.144 1.00 0.00 N ATOM 794 NH2 ARG A 54 -15.706 12.243 -10.660 1.00 0.00 N ATOM 0 H ARG A 54 -9.776 7.543 -10.405 1.00 0.00 H new ATOM 0 HA ARG A 54 -11.454 7.800 -8.248 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -10.773 9.303 -10.415 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -12.390 8.834 -10.900 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -11.716 10.183 -8.262 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -12.277 11.026 -9.693 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -13.919 8.703 -8.791 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -13.929 10.115 -7.753 1.00 0.00 H new ATOM 0 HE ARG A 54 -15.325 9.837 -10.217 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -13.324 12.207 -8.499 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -14.114 13.587 -9.269 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -16.311 11.614 -11.187 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -15.792 13.252 -10.779 1.00 0.00 H new ATOM 808 N ASN A 55 -12.914 6.254 -10.778 1.00 0.00 N ATOM 809 CA ASN A 55 -14.048 5.409 -11.124 1.00 0.00 C ATOM 810 C ASN A 55 -13.957 4.088 -10.384 1.00 0.00 C ATOM 811 O ASN A 55 -14.964 3.553 -9.924 1.00 0.00 O ATOM 812 CB ASN A 55 -14.120 5.169 -12.629 1.00 0.00 C ATOM 813 CG ASN A 55 -14.527 6.416 -13.393 1.00 0.00 C ATOM 814 OD1 ASN A 55 -13.655 6.880 -14.281 1.00 0.00 O flip ATOM 815 ND2 ASN A 55 -15.614 6.955 -13.188 1.00 0.00 N flip ATOM 0 H ASN A 55 -12.243 6.400 -11.533 1.00 0.00 H new ATOM 0 HA ASN A 55 -14.960 5.925 -10.823 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -13.149 4.827 -12.987 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -14.834 4.371 -12.834 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -16.254 6.565 -12.496 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -15.875 7.792 -13.710 1.00 0.00 H new ATOM 822 N ALA A 56 -12.740 3.571 -10.255 1.00 0.00 N ATOM 823 CA ALA A 56 -12.529 2.320 -9.549 1.00 0.00 C ATOM 824 C ALA A 56 -12.964 2.477 -8.103 1.00 0.00 C ATOM 825 O ALA A 56 -13.663 1.626 -7.557 1.00 0.00 O ATOM 826 CB ALA A 56 -11.071 1.889 -9.628 1.00 0.00 C ATOM 0 H ALA A 56 -11.892 3.998 -10.628 1.00 0.00 H new ATOM 0 HA ALA A 56 -13.129 1.542 -10.022 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -10.940 0.949 -9.091 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -10.788 1.753 -10.672 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -10.440 2.655 -9.177 1.00 0.00 H new ATOM 832 N ALA A 57 -12.564 3.590 -7.495 1.00 0.00 N ATOM 833 CA ALA A 57 -12.933 3.880 -6.119 1.00 0.00 C ATOM 834 C ALA A 57 -14.447 3.906 -5.970 1.00 0.00 C ATOM 835 O ALA A 57 -15.022 3.187 -5.155 1.00 0.00 O ATOM 836 CB ALA A 57 -12.333 5.205 -5.680 1.00 0.00 C ATOM 0 H ALA A 57 -11.984 4.304 -7.936 1.00 0.00 H new ATOM 0 HA ALA A 57 -12.537 3.091 -5.479 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -12.618 5.409 -4.648 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -11.247 5.155 -5.754 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -12.704 6.003 -6.323 1.00 0.00 H new ATOM 842 N ILE A 58 -15.086 4.740 -6.778 1.00 0.00 N ATOM 843 CA ILE A 58 -16.533 4.863 -6.753 1.00 0.00 C ATOM 844 C ILE A 58 -17.205 3.519 -7.015 1.00 0.00 C ATOM 845 O ILE A 58 -18.135 3.136 -6.307 1.00 0.00 O ATOM 846 CB ILE A 58 -17.024 5.898 -7.783 1.00 0.00 C ATOM 847 CG1 ILE A 58 -16.329 7.238 -7.548 1.00 0.00 C ATOM 848 CG2 ILE A 58 -18.535 6.063 -7.698 1.00 0.00 C ATOM 849 CD1 ILE A 58 -16.434 8.182 -8.724 1.00 0.00 C ATOM 0 H ILE A 58 -14.623 5.341 -7.459 1.00 0.00 H new ATOM 0 HA ILE A 58 -16.809 5.205 -5.755 1.00 0.00 H new ATOM 0 HB ILE A 58 -16.775 5.541 -8.782 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -16.763 7.715 -6.669 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -15.277 7.060 -7.327 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -18.863 6.798 -8.433 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -19.017 5.107 -7.901 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -18.808 6.402 -6.699 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -15.919 9.114 -8.490 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -15.975 7.724 -9.600 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -17.484 8.390 -8.931 1.00 0.00 H new ATOM 861 N ARG A 59 -16.736 2.802 -8.034 1.00 0.00 N ATOM 862 CA ARG A 59 -17.314 1.504 -8.365 1.00 0.00 C ATOM 863 C ARG A 59 -17.125 0.508 -7.227 1.00 0.00 C ATOM 864 O ARG A 59 -18.099 0.079 -6.609 1.00 0.00 O ATOM 865 CB ARG A 59 -16.707 0.952 -9.655 1.00 0.00 C ATOM 866 CG ARG A 59 -17.684 0.926 -10.818 1.00 0.00 C ATOM 867 CD ARG A 59 -18.506 -0.354 -10.822 1.00 0.00 C ATOM 868 NE ARG A 59 -19.299 -0.496 -12.044 1.00 0.00 N ATOM 869 CZ ARG A 59 -20.597 -0.198 -12.136 1.00 0.00 C ATOM 870 NH1 ARG A 59 -21.264 0.266 -11.087 1.00 0.00 N ATOM 871 NH2 ARG A 59 -21.229 -0.368 -13.290 1.00 0.00 N ATOM 0 H ARG A 59 -15.967 3.094 -8.637 1.00 0.00 H new ATOM 0 HA ARG A 59 -18.384 1.650 -8.516 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -15.843 1.557 -9.929 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -16.343 -0.059 -9.473 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -18.349 1.787 -10.756 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -17.137 1.012 -11.757 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -17.841 -1.212 -10.720 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -19.169 -0.361 -9.957 1.00 0.00 H new ATOM 0 HE ARG A 59 -18.829 -0.845 -12.879 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -20.785 0.399 -10.196 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -22.256 0.490 -11.171 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -20.723 -0.725 -14.101 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -22.221 -0.142 -13.366 1.00 0.00 H new ATOM 885 N GLU A 60 -15.872 0.141 -6.952 1.00 0.00 N ATOM 886 CA GLU A 60 -15.578 -0.809 -5.878 1.00 0.00 C ATOM 887 C GLU A 60 -16.415 -0.486 -4.646 1.00 0.00 C ATOM 888 O GLU A 60 -16.945 -1.380 -3.984 1.00 0.00 O ATOM 889 CB GLU A 60 -14.086 -0.795 -5.533 1.00 0.00 C ATOM 890 CG GLU A 60 -13.634 0.473 -4.832 1.00 0.00 C ATOM 891 CD GLU A 60 -12.126 0.561 -4.700 1.00 0.00 C ATOM 892 OE1 GLU A 60 -11.420 -0.124 -5.468 1.00 0.00 O ATOM 893 OE2 GLU A 60 -11.652 1.315 -3.823 1.00 0.00 O ATOM 0 H GLU A 60 -15.052 0.483 -7.453 1.00 0.00 H new ATOM 0 HA GLU A 60 -15.836 -1.810 -6.223 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -13.861 -1.651 -4.897 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -13.509 -0.918 -6.449 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -13.998 1.339 -5.385 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -14.085 0.516 -3.841 1.00 0.00 H new ATOM 900 N LEU A 61 -16.546 0.808 -4.364 1.00 0.00 N ATOM 901 CA LEU A 61 -17.338 1.272 -3.234 1.00 0.00 C ATOM 902 C LEU A 61 -18.738 0.663 -3.280 1.00 0.00 C ATOM 903 O LEU A 61 -19.238 0.151 -2.278 1.00 0.00 O ATOM 904 CB LEU A 61 -17.425 2.805 -3.239 1.00 0.00 C ATOM 905 CG LEU A 61 -18.638 3.394 -2.517 1.00 0.00 C ATOM 906 CD1 LEU A 61 -18.685 2.903 -1.078 1.00 0.00 C ATOM 907 CD2 LEU A 61 -18.610 4.915 -2.571 1.00 0.00 C ATOM 0 H LEU A 61 -16.111 1.554 -4.906 1.00 0.00 H new ATOM 0 HA LEU A 61 -16.850 0.952 -2.313 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -16.521 3.205 -2.781 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -17.437 3.148 -4.273 1.00 0.00 H new ATOM 0 HG LEU A 61 -19.542 3.057 -3.025 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -19.553 3.330 -0.576 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -18.758 1.815 -1.067 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -17.778 3.211 -0.559 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -19.482 5.314 -2.052 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -17.703 5.280 -2.090 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -18.626 5.243 -3.611 1.00 0.00 H new ATOM 919 N ARG A 62 -19.361 0.719 -4.455 1.00 0.00 N ATOM 920 CA ARG A 62 -20.698 0.167 -4.643 1.00 0.00 C ATOM 921 C ARG A 62 -20.700 -1.342 -4.428 1.00 0.00 C ATOM 922 O ARG A 62 -21.347 -1.853 -3.517 1.00 0.00 O ATOM 923 CB ARG A 62 -21.216 0.495 -6.048 1.00 0.00 C ATOM 924 CG ARG A 62 -22.730 0.436 -6.179 1.00 0.00 C ATOM 925 CD ARG A 62 -23.270 -0.968 -5.955 1.00 0.00 C ATOM 926 NE ARG A 62 -22.660 -1.943 -6.854 1.00 0.00 N ATOM 927 CZ ARG A 62 -22.891 -3.253 -6.789 1.00 0.00 C ATOM 928 NH1 ARG A 62 -23.702 -3.748 -5.861 1.00 0.00 N ATOM 929 NH2 ARG A 62 -22.305 -4.072 -7.651 1.00 0.00 N ATOM 0 H ARG A 62 -18.959 1.142 -5.292 1.00 0.00 H new ATOM 0 HA ARG A 62 -21.358 0.621 -3.904 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -20.876 1.493 -6.325 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -20.773 -0.202 -6.759 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -23.182 1.117 -5.458 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -23.021 0.782 -7.171 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -23.088 -1.265 -4.922 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -24.350 -0.968 -6.101 1.00 0.00 H new ATOM 0 HE ARG A 62 -22.021 -1.602 -7.572 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -24.153 -3.124 -5.192 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -23.874 -4.752 -5.817 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -21.678 -3.699 -8.363 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -22.481 -5.075 -7.602 1.00 0.00 H new ATOM 943 N GLU A 63 -19.980 -2.051 -5.284 1.00 0.00 N ATOM 944 CA GLU A 63 -19.903 -3.505 -5.205 1.00 0.00 C ATOM 945 C GLU A 63 -19.538 -3.988 -3.801 1.00 0.00 C ATOM 946 O GLU A 63 -19.780 -5.146 -3.455 1.00 0.00 O ATOM 947 CB GLU A 63 -18.888 -4.033 -6.220 1.00 0.00 C ATOM 948 CG GLU A 63 -19.055 -3.433 -7.608 1.00 0.00 C ATOM 949 CD GLU A 63 -19.224 -4.488 -8.684 1.00 0.00 C ATOM 950 OE1 GLU A 63 -20.083 -5.378 -8.514 1.00 0.00 O ATOM 951 OE2 GLU A 63 -18.496 -4.423 -9.698 1.00 0.00 O ATOM 0 H GLU A 63 -19.438 -1.642 -6.045 1.00 0.00 H new ATOM 0 HA GLU A 63 -20.893 -3.897 -5.439 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -17.881 -3.822 -5.860 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -18.982 -5.117 -6.287 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -19.922 -2.773 -7.612 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -18.186 -2.818 -7.841 1.00 0.00 H new ATOM 958 N GLU A 64 -18.935 -3.113 -3.004 1.00 0.00 N ATOM 959 CA GLU A 64 -18.517 -3.478 -1.654 1.00 0.00 C ATOM 960 C GLU A 64 -19.525 -3.049 -0.585 1.00 0.00 C ATOM 961 O GLU A 64 -19.734 -3.774 0.388 1.00 0.00 O ATOM 962 CB GLU A 64 -17.152 -2.864 -1.343 1.00 0.00 C ATOM 963 CG GLU A 64 -16.017 -3.477 -2.145 1.00 0.00 C ATOM 964 CD GLU A 64 -14.680 -2.818 -1.869 1.00 0.00 C ATOM 965 OE1 GLU A 64 -14.384 -2.546 -0.687 1.00 0.00 O ATOM 966 OE2 GLU A 64 -13.928 -2.573 -2.836 1.00 0.00 O ATOM 0 H GLU A 64 -18.725 -2.150 -3.267 1.00 0.00 H new ATOM 0 HA GLU A 64 -18.456 -4.566 -1.627 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -17.190 -1.793 -1.542 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -16.942 -2.984 -0.280 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -15.948 -4.540 -1.914 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -16.244 -3.396 -3.208 1.00 0.00 H new ATOM 973 N THR A 65 -20.133 -1.872 -0.739 1.00 0.00 N ATOM 974 CA THR A 65 -21.089 -1.397 0.265 1.00 0.00 C ATOM 975 C THR A 65 -22.420 -0.961 -0.343 1.00 0.00 C ATOM 976 O THR A 65 -23.405 -0.805 0.375 1.00 0.00 O ATOM 977 CB THR A 65 -20.482 -0.250 1.070 1.00 0.00 C ATOM 978 OG1 THR A 65 -19.539 0.463 0.290 1.00 0.00 O ATOM 979 CG2 THR A 65 -19.783 -0.719 2.328 1.00 0.00 C ATOM 0 H THR A 65 -19.987 -1.243 -1.528 1.00 0.00 H new ATOM 0 HA THR A 65 -21.300 -2.240 0.923 1.00 0.00 H new ATOM 0 HB THR A 65 -21.319 0.389 1.353 1.00 0.00 H new ATOM 0 HG1 THR A 65 -19.821 0.459 -0.649 1.00 0.00 H new ATOM 0 HG21 THR A 65 -19.372 0.140 2.858 1.00 0.00 H new ATOM 0 HG22 THR A 65 -20.497 -1.234 2.971 1.00 0.00 H new ATOM 0 HG23 THR A 65 -18.976 -1.402 2.063 1.00 0.00 H new ATOM 987 N GLY A 66 -22.455 -0.764 -1.654 1.00 0.00 N ATOM 988 CA GLY A 66 -23.688 -0.351 -2.297 1.00 0.00 C ATOM 989 C GLY A 66 -23.822 1.153 -2.399 1.00 0.00 C ATOM 990 O GLY A 66 -24.664 1.659 -3.141 1.00 0.00 O ATOM 0 H GLY A 66 -21.659 -0.881 -2.280 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -23.734 -0.784 -3.296 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -24.535 -0.749 -1.738 1.00 0.00 H new ATOM 994 N VAL A 67 -22.991 1.873 -1.660 1.00 0.00 N ATOM 995 CA VAL A 67 -23.023 3.326 -1.684 1.00 0.00 C ATOM 996 C VAL A 67 -22.842 3.860 -3.097 1.00 0.00 C ATOM 997 O VAL A 67 -21.755 3.787 -3.670 1.00 0.00 O ATOM 998 CB VAL A 67 -21.936 3.921 -0.772 1.00 0.00 C ATOM 999 CG1 VAL A 67 -21.801 5.423 -0.990 1.00 0.00 C ATOM 1000 CG2 VAL A 67 -22.238 3.607 0.685 1.00 0.00 C ATOM 0 H VAL A 67 -22.288 1.475 -1.038 1.00 0.00 H new ATOM 0 HA VAL A 67 -24.003 3.629 -1.315 1.00 0.00 H new ATOM 0 HB VAL A 67 -20.982 3.462 -1.032 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -21.026 5.818 -0.333 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -21.530 5.617 -2.028 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -22.750 5.910 -0.765 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -21.460 4.034 1.318 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -23.203 4.035 0.957 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -22.267 2.527 0.826 1.00 0.00 H new ATOM 1010 N THR A 68 -23.908 4.425 -3.634 1.00 0.00 N ATOM 1011 CA THR A 68 -23.877 5.015 -4.962 1.00 0.00 C ATOM 1012 C THR A 68 -24.284 6.481 -4.876 1.00 0.00 C ATOM 1013 O THR A 68 -23.703 7.341 -5.538 1.00 0.00 O ATOM 1014 CB THR A 68 -24.795 4.250 -5.916 1.00 0.00 C ATOM 1015 OG1 THR A 68 -25.915 3.727 -5.226 1.00 0.00 O ATOM 1016 CG2 THR A 68 -24.102 3.094 -6.613 1.00 0.00 C ATOM 0 H THR A 68 -24.813 4.488 -3.168 1.00 0.00 H new ATOM 0 HA THR A 68 -22.863 4.951 -5.357 1.00 0.00 H new ATOM 0 HB THR A 68 -25.102 4.977 -6.668 1.00 0.00 H new ATOM 0 HG1 THR A 68 -26.490 3.243 -5.855 1.00 0.00 H new ATOM 0 HG21 THR A 68 -24.808 2.593 -7.275 1.00 0.00 H new ATOM 0 HG22 THR A 68 -23.262 3.472 -7.196 1.00 0.00 H new ATOM 0 HG23 THR A 68 -23.738 2.386 -5.869 1.00 0.00 H new ATOM 1024 N SER A 69 -25.281 6.753 -4.036 1.00 0.00 N ATOM 1025 CA SER A 69 -25.774 8.112 -3.826 1.00 0.00 C ATOM 1026 C SER A 69 -24.693 9.013 -3.245 1.00 0.00 C ATOM 1027 O SER A 69 -24.720 9.341 -2.057 1.00 0.00 O ATOM 1028 CB SER A 69 -26.971 8.102 -2.885 1.00 0.00 C ATOM 1029 OG SER A 69 -27.921 7.125 -3.271 1.00 0.00 O ATOM 0 H SER A 69 -25.766 6.044 -3.486 1.00 0.00 H new ATOM 0 HA SER A 69 -26.071 8.504 -4.799 1.00 0.00 H new ATOM 0 HB2 SER A 69 -26.635 7.903 -1.867 1.00 0.00 H new ATOM 0 HB3 SER A 69 -27.440 9.086 -2.879 1.00 0.00 H new ATOM 0 HG SER A 69 -28.677 7.140 -2.648 1.00 0.00 H new ATOM 1035 N ALA A 70 -23.739 9.402 -4.071 1.00 0.00 N ATOM 1036 CA ALA A 70 -22.650 10.256 -3.619 1.00 0.00 C ATOM 1037 C ALA A 70 -21.920 10.912 -4.790 1.00 0.00 C ATOM 1038 O ALA A 70 -21.916 10.390 -5.906 1.00 0.00 O ATOM 1039 CB ALA A 70 -21.674 9.455 -2.764 1.00 0.00 C ATOM 0 H ALA A 70 -23.694 9.142 -5.056 1.00 0.00 H new ATOM 0 HA ALA A 70 -23.082 11.054 -3.015 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -20.864 10.104 -2.432 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -22.196 9.053 -1.896 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -21.263 8.635 -3.352 1.00 0.00 H new ATOM 1045 N GLU A 71 -21.295 12.056 -4.519 1.00 0.00 N ATOM 1046 CA GLU A 71 -20.548 12.786 -5.538 1.00 0.00 C ATOM 1047 C GLU A 71 -19.135 13.076 -5.048 1.00 0.00 C ATOM 1048 O GLU A 71 -18.911 13.294 -3.859 1.00 0.00 O ATOM 1049 CB GLU A 71 -21.242 14.101 -5.904 1.00 0.00 C ATOM 1050 CG GLU A 71 -22.740 14.111 -5.645 1.00 0.00 C ATOM 1051 CD GLU A 71 -23.502 14.878 -6.707 1.00 0.00 C ATOM 1052 OE1 GLU A 71 -23.045 15.976 -7.089 1.00 0.00 O ATOM 1053 OE2 GLU A 71 -24.555 14.379 -7.159 1.00 0.00 O ATOM 0 H GLU A 71 -21.292 12.497 -3.599 1.00 0.00 H new ATOM 0 HA GLU A 71 -20.505 12.160 -6.429 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -20.782 14.911 -5.338 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -21.066 14.310 -6.959 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -23.107 13.085 -5.607 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -22.935 14.555 -4.669 1.00 0.00 H new ATOM 1060 N VAL A 72 -18.187 13.081 -5.970 1.00 0.00 N ATOM 1061 CA VAL A 72 -16.793 13.348 -5.630 1.00 0.00 C ATOM 1062 C VAL A 72 -16.533 14.824 -5.391 1.00 0.00 C ATOM 1063 O VAL A 72 -16.894 15.675 -6.204 1.00 0.00 O ATOM 1064 CB VAL A 72 -15.835 12.833 -6.718 1.00 0.00 C ATOM 1065 CG1 VAL A 72 -14.398 12.826 -6.213 1.00 0.00 C ATOM 1066 CG2 VAL A 72 -16.255 11.444 -7.174 1.00 0.00 C ATOM 0 H VAL A 72 -18.354 12.904 -6.961 1.00 0.00 H new ATOM 0 HA VAL A 72 -16.602 12.809 -4.702 1.00 0.00 H new ATOM 0 HB VAL A 72 -15.887 13.507 -7.573 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -13.738 12.458 -6.999 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -14.104 13.839 -5.937 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -14.322 12.176 -5.341 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -15.569 11.091 -7.944 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -16.231 10.760 -6.326 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -17.266 11.484 -7.580 1.00 0.00 H new ATOM 1076 N ILE A 73 -15.893 15.113 -4.269 1.00 0.00 N ATOM 1077 CA ILE A 73 -15.561 16.481 -3.907 1.00 0.00 C ATOM 1078 C ILE A 73 -14.054 16.697 -3.920 1.00 0.00 C ATOM 1079 O ILE A 73 -13.580 17.831 -3.961 1.00 0.00 O ATOM 1080 CB ILE A 73 -16.072 16.842 -2.503 1.00 0.00 C ATOM 1081 CG1 ILE A 73 -17.402 16.155 -2.204 1.00 0.00 C ATOM 1082 CG2 ILE A 73 -16.199 18.343 -2.359 1.00 0.00 C ATOM 1083 CD1 ILE A 73 -17.313 15.231 -1.016 1.00 0.00 C ATOM 0 H ILE A 73 -15.592 14.414 -3.590 1.00 0.00 H new ATOM 0 HA ILE A 73 -16.045 17.118 -4.647 1.00 0.00 H new ATOM 0 HB ILE A 73 -15.344 16.483 -1.775 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -18.165 16.911 -2.018 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -17.721 15.589 -3.079 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -16.562 18.583 -1.360 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -15.225 18.807 -2.513 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -16.902 18.722 -3.101 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -18.284 14.766 -0.843 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -16.570 14.458 -1.211 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -17.021 15.800 -0.133 1.00 0.00 H new ATOM 1095 N ALA A 74 -13.306 15.602 -3.874 1.00 0.00 N ATOM 1096 CA ALA A 74 -11.849 15.684 -3.869 1.00 0.00 C ATOM 1097 C ALA A 74 -11.200 14.323 -4.082 1.00 0.00 C ATOM 1098 O ALA A 74 -11.881 13.306 -4.209 1.00 0.00 O ATOM 1099 CB ALA A 74 -11.362 16.291 -2.561 1.00 0.00 C ATOM 0 H ALA A 74 -13.679 14.653 -3.840 1.00 0.00 H new ATOM 0 HA ALA A 74 -11.556 16.324 -4.701 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -10.273 16.347 -2.569 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -11.776 17.293 -2.448 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -11.687 15.668 -1.728 1.00 0.00 H new ATOM 1105 N GLU A 75 -9.871 14.323 -4.118 1.00 0.00 N ATOM 1106 CA GLU A 75 -9.103 13.099 -4.316 1.00 0.00 C ATOM 1107 C GLU A 75 -7.679 13.257 -3.783 1.00 0.00 C ATOM 1108 O GLU A 75 -7.145 14.364 -3.735 1.00 0.00 O ATOM 1109 CB GLU A 75 -9.069 12.739 -5.799 1.00 0.00 C ATOM 1110 CG GLU A 75 -8.444 13.815 -6.669 1.00 0.00 C ATOM 1111 CD GLU A 75 -9.477 14.571 -7.483 1.00 0.00 C ATOM 1112 OE1 GLU A 75 -10.124 15.480 -6.922 1.00 0.00 O ATOM 1113 OE2 GLU A 75 -9.641 14.249 -8.679 1.00 0.00 O ATOM 0 H GLU A 75 -9.301 15.162 -4.012 1.00 0.00 H new ATOM 0 HA GLU A 75 -9.589 12.296 -3.762 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -8.512 11.811 -5.927 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -10.086 12.550 -6.142 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -7.897 14.516 -6.039 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -7.718 13.359 -7.342 1.00 0.00 H new ATOM 1120 N VAL A 76 -7.070 12.142 -3.382 1.00 0.00 N ATOM 1121 CA VAL A 76 -5.710 12.163 -2.852 1.00 0.00 C ATOM 1122 C VAL A 76 -4.684 12.403 -3.964 1.00 0.00 C ATOM 1123 O VAL A 76 -4.780 11.824 -5.044 1.00 0.00 O ATOM 1124 CB VAL A 76 -5.386 10.856 -2.092 1.00 0.00 C ATOM 1125 CG1 VAL A 76 -3.889 10.692 -1.844 1.00 0.00 C ATOM 1126 CG2 VAL A 76 -6.146 10.825 -0.776 1.00 0.00 C ATOM 0 H VAL A 76 -7.496 11.216 -3.414 1.00 0.00 H new ATOM 0 HA VAL A 76 -5.648 12.992 -2.147 1.00 0.00 H new ATOM 0 HB VAL A 76 -5.702 10.021 -2.717 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -3.709 9.760 -1.308 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -3.363 10.669 -2.798 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -3.525 11.529 -1.249 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -5.915 9.902 -0.244 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -5.852 11.679 -0.166 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -7.217 10.871 -0.973 1.00 0.00 H new ATOM 1136 N PRO A 77 -3.689 13.270 -3.707 1.00 0.00 N ATOM 1137 CA PRO A 77 -2.641 13.595 -4.683 1.00 0.00 C ATOM 1138 C PRO A 77 -1.843 12.369 -5.115 1.00 0.00 C ATOM 1139 O PRO A 77 -2.027 11.850 -6.217 1.00 0.00 O ATOM 1140 CB PRO A 77 -1.736 14.584 -3.933 1.00 0.00 C ATOM 1141 CG PRO A 77 -2.048 14.373 -2.492 1.00 0.00 C ATOM 1142 CD PRO A 77 -3.501 14.009 -2.447 1.00 0.00 C ATOM 0 HA PRO A 77 -3.063 13.999 -5.603 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -0.683 14.392 -4.141 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -1.939 15.612 -4.235 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -1.431 13.580 -2.069 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -1.851 15.274 -1.912 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -3.738 13.395 -1.578 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -4.138 14.892 -2.396 1.00 0.00 H new ATOM 1150 N TYR A 78 -0.946 11.921 -4.245 1.00 0.00 N ATOM 1151 CA TYR A 78 -0.102 10.770 -4.533 1.00 0.00 C ATOM 1152 C TYR A 78 -0.839 9.456 -4.293 1.00 0.00 C ATOM 1153 O TYR A 78 -1.944 9.438 -3.758 1.00 0.00 O ATOM 1154 CB TYR A 78 1.181 10.811 -3.692 1.00 0.00 C ATOM 1155 CG TYR A 78 0.991 11.311 -2.272 1.00 0.00 C ATOM 1156 CD1 TYR A 78 -0.184 11.061 -1.570 1.00 0.00 C ATOM 1157 CD2 TYR A 78 1.996 12.025 -1.629 1.00 0.00 C ATOM 1158 CE1 TYR A 78 -0.350 11.509 -0.273 1.00 0.00 C ATOM 1159 CE2 TYR A 78 1.836 12.477 -0.332 1.00 0.00 C ATOM 1160 CZ TYR A 78 0.661 12.217 0.341 1.00 0.00 C ATOM 1161 OH TYR A 78 0.497 12.664 1.631 1.00 0.00 O ATOM 0 H TYR A 78 -0.785 12.341 -3.329 1.00 0.00 H new ATOM 0 HA TYR A 78 0.163 10.822 -5.589 1.00 0.00 H new ATOM 0 HB2 TYR A 78 1.608 9.809 -3.656 1.00 0.00 H new ATOM 0 HB3 TYR A 78 1.908 11.450 -4.194 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -0.980 10.508 -2.047 1.00 0.00 H new ATOM 0 HD2 TYR A 78 2.918 12.230 -2.152 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -1.268 11.305 0.257 1.00 0.00 H new ATOM 0 HE2 TYR A 78 2.627 13.031 0.151 1.00 0.00 H new ATOM 0 HH TYR A 78 1.355 12.624 2.103 1.00 0.00 H new ATOM 1171 N TRP A 79 -0.208 8.357 -4.692 1.00 0.00 N ATOM 1172 CA TRP A 79 -0.790 7.030 -4.522 1.00 0.00 C ATOM 1173 C TRP A 79 -0.298 6.390 -3.229 1.00 0.00 C ATOM 1174 O TRP A 79 0.790 5.821 -3.193 1.00 0.00 O ATOM 1175 CB TRP A 79 -0.434 6.141 -5.714 1.00 0.00 C ATOM 1176 CG TRP A 79 -1.052 6.601 -7.001 1.00 0.00 C ATOM 1177 CD1 TRP A 79 -0.841 7.798 -7.629 1.00 0.00 C ATOM 1178 CD2 TRP A 79 -1.984 5.880 -7.818 1.00 0.00 C ATOM 1179 NE1 TRP A 79 -1.585 7.864 -8.781 1.00 0.00 N ATOM 1180 CE2 TRP A 79 -2.292 6.700 -8.921 1.00 0.00 C ATOM 1181 CE3 TRP A 79 -2.589 4.621 -7.729 1.00 0.00 C ATOM 1182 CZ2 TRP A 79 -3.176 6.305 -9.921 1.00 0.00 C ATOM 1183 CZ3 TRP A 79 -3.466 4.233 -8.723 1.00 0.00 C ATOM 1184 CH2 TRP A 79 -3.751 5.072 -9.806 1.00 0.00 C ATOM 0 H TRP A 79 0.710 8.359 -5.137 1.00 0.00 H new ATOM 0 HA TRP A 79 -1.874 7.134 -4.468 1.00 0.00 H new ATOM 0 HB2 TRP A 79 0.650 6.115 -5.828 1.00 0.00 H new ATOM 0 HB3 TRP A 79 -0.758 5.121 -5.507 1.00 0.00 H new ATOM 0 HD1 TRP A 79 -0.185 8.577 -7.271 1.00 0.00 H new ATOM 0 HE1 TRP A 79 -1.607 8.652 -9.428 1.00 0.00 H new ATOM 0 HE3 TRP A 79 -2.374 3.965 -6.898 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 -3.399 6.951 -10.758 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 -3.940 3.265 -8.663 1.00 0.00 H new ATOM 0 HH2 TRP A 79 -4.440 4.737 -10.567 1.00 0.00 H new ATOM 1195 N LEU A 80 -1.099 6.485 -2.172 1.00 0.00 N ATOM 1196 CA LEU A 80 -0.728 5.914 -0.878 1.00 0.00 C ATOM 1197 C LEU A 80 -0.492 4.413 -0.994 1.00 0.00 C ATOM 1198 O LEU A 80 -1.430 3.641 -1.186 1.00 0.00 O ATOM 1199 CB LEU A 80 -1.824 6.183 0.153 1.00 0.00 C ATOM 1200 CG LEU A 80 -2.262 7.642 0.260 1.00 0.00 C ATOM 1201 CD1 LEU A 80 -3.370 7.788 1.290 1.00 0.00 C ATOM 1202 CD2 LEU A 80 -1.076 8.525 0.616 1.00 0.00 C ATOM 0 H LEU A 80 -2.007 6.950 -2.184 1.00 0.00 H new ATOM 0 HA LEU A 80 0.198 6.389 -0.553 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -2.694 5.575 -0.096 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -1.473 5.852 1.130 1.00 0.00 H new ATOM 0 HG LEU A 80 -2.650 7.962 -0.707 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -3.671 8.834 1.355 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -4.226 7.182 0.993 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -3.009 7.454 2.263 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -1.403 9.562 0.689 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -0.660 8.208 1.572 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -0.313 8.439 -0.158 1.00 0.00 H new ATOM 1601 N ALA A 104 0.250 0.289 -4.454 1.00 0.00 N ATOM 1602 CA ALA A 104 0.006 1.728 -4.432 1.00 0.00 C ATOM 1603 C ALA A 104 -1.490 1.993 -4.451 1.00 0.00 C ATOM 1604 O ALA A 104 -2.189 1.555 -5.355 1.00 0.00 O ATOM 1605 CB ALA A 104 0.692 2.407 -5.612 1.00 0.00 C ATOM 0 HA ALA A 104 0.425 2.146 -3.517 1.00 0.00 H new ATOM 0 HB1 ALA A 104 0.498 3.479 -5.578 1.00 0.00 H new ATOM 0 HB2 ALA A 104 1.766 2.231 -5.559 1.00 0.00 H new ATOM 0 HB3 ALA A 104 0.303 1.997 -6.544 1.00 0.00 H new ATOM 1611 N GLN A 105 -1.987 2.683 -3.432 1.00 0.00 N ATOM 1612 CA GLN A 105 -3.415 2.959 -3.337 1.00 0.00 C ATOM 1613 C GLN A 105 -3.727 4.449 -3.241 1.00 0.00 C ATOM 1614 O GLN A 105 -3.260 5.140 -2.339 1.00 0.00 O ATOM 1615 CB GLN A 105 -4.004 2.248 -2.122 1.00 0.00 C ATOM 1616 CG GLN A 105 -3.738 0.754 -2.101 1.00 0.00 C ATOM 1617 CD GLN A 105 -3.133 0.278 -0.797 1.00 0.00 C ATOM 1618 OE1 GLN A 105 -3.103 1.008 0.195 1.00 0.00 O ATOM 1619 NE2 GLN A 105 -2.651 -0.958 -0.795 1.00 0.00 N ATOM 0 H GLN A 105 -1.428 3.059 -2.666 1.00 0.00 H new ATOM 0 HA GLN A 105 -3.866 2.586 -4.257 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -3.593 2.694 -1.216 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -5.081 2.417 -2.100 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -4.673 0.222 -2.277 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -3.067 0.499 -2.921 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -2.698 -1.525 -1.641 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -2.233 -1.341 0.053 1.00 0.00 H new ATOM 1628 N LYS A 106 -4.551 4.918 -4.171 1.00 0.00 N ATOM 1629 CA LYS A 106 -4.976 6.311 -4.198 1.00 0.00 C ATOM 1630 C LYS A 106 -6.410 6.414 -3.689 1.00 0.00 C ATOM 1631 O LYS A 106 -7.272 5.633 -4.088 1.00 0.00 O ATOM 1632 CB LYS A 106 -4.865 6.884 -5.613 1.00 0.00 C ATOM 1633 CG LYS A 106 -4.588 8.380 -5.645 1.00 0.00 C ATOM 1634 CD LYS A 106 -5.698 9.137 -6.360 1.00 0.00 C ATOM 1635 CE LYS A 106 -5.680 8.864 -7.856 1.00 0.00 C ATOM 1636 NZ LYS A 106 -6.033 10.073 -8.651 1.00 0.00 N ATOM 0 H LYS A 106 -4.940 4.348 -4.922 1.00 0.00 H new ATOM 0 HA LYS A 106 -4.323 6.894 -3.549 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -4.068 6.364 -6.145 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -5.791 6.683 -6.151 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -4.488 8.755 -4.626 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -3.638 8.565 -6.147 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -6.664 8.846 -5.947 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -5.584 10.206 -6.182 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -4.690 8.515 -8.148 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -6.381 8.062 -8.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -6.008 9.841 -9.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -6.988 10.392 -8.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -5.349 10.831 -8.452 1.00 0.00 H new ATOM 1650 N TRP A 107 -6.660 7.355 -2.787 1.00 0.00 N ATOM 1651 CA TRP A 107 -7.992 7.514 -2.212 1.00 0.00 C ATOM 1652 C TRP A 107 -8.758 8.674 -2.832 1.00 0.00 C ATOM 1653 O TRP A 107 -8.190 9.513 -3.532 1.00 0.00 O ATOM 1654 CB TRP A 107 -7.888 7.699 -0.698 1.00 0.00 C ATOM 1655 CG TRP A 107 -7.619 6.416 0.018 1.00 0.00 C ATOM 1656 CD1 TRP A 107 -6.420 5.776 0.138 1.00 0.00 C ATOM 1657 CD2 TRP A 107 -8.578 5.602 0.699 1.00 0.00 C ATOM 1658 NE1 TRP A 107 -6.575 4.611 0.847 1.00 0.00 N ATOM 1659 CE2 TRP A 107 -7.892 4.483 1.204 1.00 0.00 C ATOM 1660 CE3 TRP A 107 -9.951 5.712 0.928 1.00 0.00 C ATOM 1661 CZ2 TRP A 107 -8.534 3.482 1.923 1.00 0.00 C ATOM 1662 CZ3 TRP A 107 -10.587 4.717 1.645 1.00 0.00 C ATOM 1663 CH2 TRP A 107 -9.879 3.613 2.134 1.00 0.00 C ATOM 0 H TRP A 107 -5.965 8.015 -2.439 1.00 0.00 H new ATOM 0 HA TRP A 107 -8.552 6.606 -2.434 1.00 0.00 H new ATOM 0 HB2 TRP A 107 -7.091 8.409 -0.476 1.00 0.00 H new ATOM 0 HB3 TRP A 107 -8.815 8.133 -0.324 1.00 0.00 H new ATOM 0 HD1 TRP A 107 -5.485 6.134 -0.266 1.00 0.00 H new ATOM 0 HE1 TRP A 107 -5.832 3.949 1.071 1.00 0.00 H new ATOM 0 HE3 TRP A 107 -10.505 6.559 0.552 1.00 0.00 H new ATOM 0 HZ2 TRP A 107 -7.990 2.630 2.302 1.00 0.00 H new ATOM 0 HZ3 TRP A 107 -11.648 4.792 1.831 1.00 0.00 H new ATOM 0 HH2 TRP A 107 -10.405 2.850 2.689 1.00 0.00 H new ATOM 1674 N PHE A 108 -10.062 8.707 -2.564 1.00 0.00 N ATOM 1675 CA PHE A 108 -10.931 9.751 -3.087 1.00 0.00 C ATOM 1676 C PHE A 108 -11.967 10.169 -2.049 1.00 0.00 C ATOM 1677 O PHE A 108 -12.365 9.375 -1.198 1.00 0.00 O ATOM 1678 CB PHE A 108 -11.647 9.268 -4.348 1.00 0.00 C ATOM 1679 CG PHE A 108 -10.723 8.979 -5.494 1.00 0.00 C ATOM 1680 CD1 PHE A 108 -10.366 9.991 -6.362 1.00 0.00 C ATOM 1681 CD2 PHE A 108 -10.211 7.706 -5.703 1.00 0.00 C ATOM 1682 CE1 PHE A 108 -9.514 9.749 -7.420 1.00 0.00 C ATOM 1683 CE2 PHE A 108 -9.359 7.456 -6.763 1.00 0.00 C ATOM 1684 CZ PHE A 108 -9.011 8.482 -7.623 1.00 0.00 C ATOM 0 H PHE A 108 -10.539 8.017 -1.984 1.00 0.00 H new ATOM 0 HA PHE A 108 -10.307 10.611 -3.330 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -12.211 8.366 -4.112 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -12.369 10.024 -4.657 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -10.759 10.986 -6.211 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -10.480 6.904 -5.032 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -9.241 10.552 -8.089 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -8.966 6.462 -6.919 1.00 0.00 H new ATOM 0 HZ PHE A 108 -8.346 8.291 -8.452 1.00 0.00 H new ATOM 1694 N LEU A 109 -12.404 11.419 -2.134 1.00 0.00 N ATOM 1695 CA LEU A 109 -13.404 11.951 -1.215 1.00 0.00 C ATOM 1696 C LEU A 109 -14.749 12.130 -1.915 1.00 0.00 C ATOM 1697 O LEU A 109 -14.828 12.777 -2.959 1.00 0.00 O ATOM 1698 CB LEU A 109 -12.939 13.287 -0.635 1.00 0.00 C ATOM 1699 CG LEU A 109 -13.873 13.894 0.412 1.00 0.00 C ATOM 1700 CD1 LEU A 109 -14.165 12.884 1.513 1.00 0.00 C ATOM 1701 CD2 LEU A 109 -13.272 15.166 0.993 1.00 0.00 C ATOM 0 H LEU A 109 -12.080 12.087 -2.834 1.00 0.00 H new ATOM 0 HA LEU A 109 -13.528 11.234 -0.403 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -11.955 13.149 -0.187 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -12.820 13.999 -1.451 1.00 0.00 H new ATOM 0 HG LEU A 109 -14.814 14.154 -0.073 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -14.831 13.332 2.250 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -14.641 12.003 1.082 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -13.232 12.593 1.996 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -13.952 15.583 1.736 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -12.317 14.935 1.464 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -13.117 15.892 0.195 1.00 0.00 H new ATOM 1713 N PHE A 110 -15.804 11.559 -1.339 1.00 0.00 N ATOM 1714 CA PHE A 110 -17.138 11.667 -1.928 1.00 0.00 C ATOM 1715 C PHE A 110 -18.190 12.051 -0.890 1.00 0.00 C ATOM 1716 O PHE A 110 -18.128 11.637 0.266 1.00 0.00 O ATOM 1717 CB PHE A 110 -17.567 10.341 -2.571 1.00 0.00 C ATOM 1718 CG PHE A 110 -16.503 9.637 -3.370 1.00 0.00 C ATOM 1719 CD1 PHE A 110 -15.672 10.338 -4.226 1.00 0.00 C ATOM 1720 CD2 PHE A 110 -16.352 8.263 -3.274 1.00 0.00 C ATOM 1721 CE1 PHE A 110 -14.710 9.683 -4.970 1.00 0.00 C ATOM 1722 CE2 PHE A 110 -15.392 7.602 -4.013 1.00 0.00 C ATOM 1723 CZ PHE A 110 -14.569 8.312 -4.864 1.00 0.00 C ATOM 0 H PHE A 110 -15.764 11.021 -0.473 1.00 0.00 H new ATOM 0 HA PHE A 110 -17.074 12.449 -2.684 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -17.911 9.670 -1.784 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -18.420 10.532 -3.222 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -15.777 11.409 -4.313 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -16.994 7.702 -2.612 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -14.068 10.242 -5.635 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -15.285 6.531 -3.926 1.00 0.00 H new ATOM 0 HZ PHE A 110 -13.818 7.798 -5.445 1.00 0.00 H new ATOM 1733 N LYS A 111 -19.171 12.831 -1.336 1.00 0.00 N ATOM 1734 CA LYS A 111 -20.267 13.260 -0.466 1.00 0.00 C ATOM 1735 C LYS A 111 -21.455 12.318 -0.637 1.00 0.00 C ATOM 1736 O LYS A 111 -21.902 12.085 -1.754 1.00 0.00 O ATOM 1737 CB LYS A 111 -20.703 14.691 -0.796 1.00 0.00 C ATOM 1738 CG LYS A 111 -21.589 15.321 0.268 1.00 0.00 C ATOM 1739 CD LYS A 111 -21.422 16.831 0.301 1.00 0.00 C ATOM 1740 CE LYS A 111 -22.028 17.430 1.560 1.00 0.00 C ATOM 1741 NZ LYS A 111 -21.886 18.913 1.593 1.00 0.00 N ATOM 0 H LYS A 111 -19.231 13.179 -2.293 1.00 0.00 H new ATOM 0 HA LYS A 111 -19.915 13.234 0.565 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -19.816 15.310 -0.930 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -21.237 14.689 -1.746 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -22.632 15.072 0.070 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -21.342 14.904 1.244 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -20.363 17.082 0.251 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -21.896 17.270 -0.577 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -23.084 17.165 1.616 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -21.544 16.999 2.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -22.312 19.283 2.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -20.878 19.166 1.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -22.370 19.326 0.770 1.00 0.00 H new ATOM 1755 N PHE A 112 -21.967 11.786 0.469 1.00 0.00 N ATOM 1756 CA PHE A 112 -23.110 10.877 0.417 1.00 0.00 C ATOM 1757 C PHE A 112 -24.408 11.649 0.231 1.00 0.00 C ATOM 1758 O PHE A 112 -24.948 12.216 1.181 1.00 0.00 O ATOM 1759 CB PHE A 112 -23.181 10.032 1.689 1.00 0.00 C ATOM 1760 CG PHE A 112 -24.104 8.850 1.586 1.00 0.00 C ATOM 1761 CD1 PHE A 112 -23.663 7.656 1.042 1.00 0.00 C ATOM 1762 CD2 PHE A 112 -25.410 8.927 2.043 1.00 0.00 C ATOM 1763 CE1 PHE A 112 -24.502 6.560 0.956 1.00 0.00 C ATOM 1764 CE2 PHE A 112 -26.253 7.836 1.961 1.00 0.00 C ATOM 1765 CZ PHE A 112 -25.797 6.650 1.416 1.00 0.00 C ATOM 0 H PHE A 112 -21.612 11.967 1.408 1.00 0.00 H new ATOM 0 HA PHE A 112 -22.975 10.215 -0.439 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -22.180 9.678 1.934 1.00 0.00 H new ATOM 0 HB3 PHE A 112 -23.507 10.664 2.515 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -22.649 7.579 0.679 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -25.773 9.851 2.468 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -24.142 5.635 0.529 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -27.268 7.909 2.322 1.00 0.00 H new ATOM 0 HZ PHE A 112 -26.455 5.796 1.351 1.00 0.00 H new ATOM 1775 N THR A 113 -24.906 11.661 -0.998 1.00 0.00 N ATOM 1776 CA THR A 113 -26.145 12.357 -1.315 1.00 0.00 C ATOM 1777 C THR A 113 -27.309 11.375 -1.398 1.00 0.00 C ATOM 1778 O THR A 113 -28.033 11.336 -2.393 1.00 0.00 O ATOM 1779 CB THR A 113 -26.003 13.115 -2.636 1.00 0.00 C ATOM 1780 OG1 THR A 113 -25.881 12.213 -3.722 1.00 0.00 O ATOM 1781 CG2 THR A 113 -24.802 14.034 -2.675 1.00 0.00 C ATOM 0 H THR A 113 -24.469 11.195 -1.794 1.00 0.00 H new ATOM 0 HA THR A 113 -26.351 13.071 -0.517 1.00 0.00 H new ATOM 0 HB THR A 113 -26.907 13.718 -2.718 1.00 0.00 H new ATOM 0 HG1 THR A 113 -26.700 11.680 -3.798 1.00 0.00 H new ATOM 0 HG21 THR A 113 -24.762 14.540 -3.640 1.00 0.00 H new ATOM 0 HG22 THR A 113 -24.885 14.775 -1.880 1.00 0.00 H new ATOM 0 HG23 THR A 113 -23.892 13.450 -2.533 1.00 0.00 H new ATOM 1789 N GLY A 114 -27.482 10.578 -0.348 1.00 0.00 N ATOM 1790 CA GLY A 114 -28.557 9.605 -0.323 1.00 0.00 C ATOM 1791 C GLY A 114 -28.924 9.187 1.084 1.00 0.00 C ATOM 1792 O GLY A 114 -28.842 9.985 2.019 1.00 0.00 O ATOM 0 H GLY A 114 -26.896 10.589 0.487 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -29.435 10.024 -0.815 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -28.261 8.726 -0.895 1.00 0.00 H new ATOM 1796 N GLN A 115 -29.324 7.929 1.242 1.00 0.00 N ATOM 1797 CA GLN A 115 -29.697 7.405 2.553 1.00 0.00 C ATOM 1798 C GLN A 115 -28.843 6.200 2.930 1.00 0.00 C ATOM 1799 O GLN A 115 -28.355 5.475 2.066 1.00 0.00 O ATOM 1800 CB GLN A 115 -31.174 7.023 2.582 1.00 0.00 C ATOM 1801 CG GLN A 115 -31.633 6.262 1.351 1.00 0.00 C ATOM 1802 CD GLN A 115 -33.133 6.327 1.152 1.00 0.00 C ATOM 1803 OE1 GLN A 115 -33.763 7.349 1.418 1.00 0.00 O ATOM 1804 NE2 GLN A 115 -33.715 5.229 0.683 1.00 0.00 N ATOM 0 H GLN A 115 -29.398 7.254 0.481 1.00 0.00 H new ATOM 0 HA GLN A 115 -29.521 8.194 3.284 1.00 0.00 H new ATOM 0 HB2 GLN A 115 -31.365 6.415 3.466 1.00 0.00 H new ATOM 0 HB3 GLN A 115 -31.772 7.929 2.682 1.00 0.00 H new ATOM 0 HG2 GLN A 115 -31.135 6.669 0.471 1.00 0.00 H new ATOM 0 HG3 GLN A 115 -31.326 5.220 1.437 1.00 0.00 H new ATOM 0 HE21 GLN A 115 -33.154 4.403 0.476 1.00 0.00 H new ATOM 0 HE22 GLN A 115 -34.723 5.212 0.530 1.00 0.00 H new ATOM 1813 N ASP A 116 -28.667 6.002 4.230 1.00 0.00 N ATOM 1814 CA ASP A 116 -27.863 4.898 4.748 1.00 0.00 C ATOM 1815 C ASP A 116 -28.412 3.547 4.318 1.00 0.00 C ATOM 1816 O ASP A 116 -27.657 2.607 4.073 1.00 0.00 O ATOM 1817 CB ASP A 116 -27.834 4.963 6.267 1.00 0.00 C ATOM 1818 CG ASP A 116 -27.250 6.264 6.774 1.00 0.00 C ATOM 1819 OD1 ASP A 116 -26.592 6.968 5.979 1.00 0.00 O ATOM 1820 OD2 ASP A 116 -27.447 6.579 7.966 1.00 0.00 O ATOM 0 H ASP A 116 -29.074 6.596 4.952 1.00 0.00 H new ATOM 0 HA ASP A 116 -26.857 4.999 4.341 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -28.847 4.847 6.653 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -27.248 4.129 6.653 1.00 0.00 H new ATOM 1825 N GLN A 117 -29.728 3.459 4.234 1.00 0.00 N ATOM 1826 CA GLN A 117 -30.396 2.222 3.840 1.00 0.00 C ATOM 1827 C GLN A 117 -29.944 1.737 2.458 1.00 0.00 C ATOM 1828 O GLN A 117 -30.376 0.681 1.997 1.00 0.00 O ATOM 1829 CB GLN A 117 -31.916 2.409 3.857 1.00 0.00 C ATOM 1830 CG GLN A 117 -32.394 3.662 3.141 1.00 0.00 C ATOM 1831 CD GLN A 117 -33.785 4.084 3.580 1.00 0.00 C ATOM 1832 OE1 GLN A 117 -33.947 5.366 3.894 1.00 0.00 O flip ATOM 1833 NE2 GLN A 117 -34.702 3.267 3.638 1.00 0.00 N flip ATOM 0 H GLN A 117 -30.362 4.232 4.434 1.00 0.00 H new ATOM 0 HA GLN A 117 -30.115 1.459 4.566 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -32.384 1.539 3.396 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -32.256 2.443 4.892 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -31.694 4.475 3.331 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -32.393 3.485 2.065 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -34.534 2.293 3.388 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -35.631 3.564 3.936 1.00 0.00 H new ATOM 1842 N GLU A 118 -29.068 2.498 1.801 1.00 0.00 N ATOM 1843 CA GLU A 118 -28.564 2.126 0.484 1.00 0.00 C ATOM 1844 C GLU A 118 -27.296 1.287 0.605 1.00 0.00 C ATOM 1845 O GLU A 118 -26.868 0.645 -0.354 1.00 0.00 O ATOM 1846 CB GLU A 118 -28.266 3.381 -0.339 1.00 0.00 C ATOM 1847 CG GLU A 118 -27.956 3.093 -1.798 1.00 0.00 C ATOM 1848 CD GLU A 118 -29.074 3.520 -2.730 1.00 0.00 C ATOM 1849 OE1 GLU A 118 -30.251 3.258 -2.404 1.00 0.00 O ATOM 1850 OE2 GLU A 118 -28.772 4.118 -3.784 1.00 0.00 O ATOM 0 H GLU A 118 -28.694 3.376 2.162 1.00 0.00 H new ATOM 0 HA GLU A 118 -29.330 1.534 -0.017 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -29.122 4.053 -0.284 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -27.421 3.905 0.107 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -27.038 3.609 -2.079 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -27.773 2.026 -1.922 1.00 0.00 H new ATOM 1857 N ILE A 119 -26.692 1.309 1.787 1.00 0.00 N ATOM 1858 CA ILE A 119 -25.468 0.565 2.038 1.00 0.00 C ATOM 1859 C ILE A 119 -25.738 -0.906 2.336 1.00 0.00 C ATOM 1860 O ILE A 119 -26.096 -1.268 3.456 1.00 0.00 O ATOM 1861 CB ILE A 119 -24.677 1.173 3.204 1.00 0.00 C ATOM 1862 CG1 ILE A 119 -24.564 2.685 3.023 1.00 0.00 C ATOM 1863 CG2 ILE A 119 -23.298 0.532 3.293 1.00 0.00 C ATOM 1864 CD1 ILE A 119 -23.709 3.353 4.068 1.00 0.00 C ATOM 0 H ILE A 119 -27.034 1.838 2.590 1.00 0.00 H new ATOM 0 HA ILE A 119 -24.880 0.631 1.123 1.00 0.00 H new ATOM 0 HB ILE A 119 -25.205 0.976 4.137 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -24.149 2.895 2.037 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -25.562 3.122 3.048 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -22.746 0.971 4.124 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -23.405 -0.541 3.455 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -22.755 0.706 2.364 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -23.673 4.426 3.878 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -24.135 3.174 5.055 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -22.700 2.944 4.028 1.00 0.00 H new ATOM 1876 N ASN A 120 -25.542 -1.752 1.331 1.00 0.00 N ATOM 1877 CA ASN A 120 -25.739 -3.186 1.490 1.00 0.00 C ATOM 1878 C ASN A 120 -24.392 -3.898 1.600 1.00 0.00 C ATOM 1879 O ASN A 120 -23.786 -4.250 0.589 1.00 0.00 O ATOM 1880 CB ASN A 120 -26.539 -3.753 0.312 1.00 0.00 C ATOM 1881 CG ASN A 120 -25.863 -3.511 -1.024 1.00 0.00 C ATOM 1882 OD1 ASN A 120 -25.956 -2.422 -1.592 1.00 0.00 O ATOM 1883 ND2 ASN A 120 -25.183 -4.530 -1.539 1.00 0.00 N ATOM 0 H ASN A 120 -25.247 -1.468 0.397 1.00 0.00 H new ATOM 0 HA ASN A 120 -26.303 -3.355 2.407 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -26.679 -4.824 0.455 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -27.531 -3.301 0.300 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -24.713 -4.427 -2.438 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -25.131 -5.415 -1.035 1.00 0.00 H new ATOM 1890 N LEU A 121 -23.925 -4.110 2.828 1.00 0.00 N ATOM 1891 CA LEU A 121 -22.647 -4.784 3.039 1.00 0.00 C ATOM 1892 C LEU A 121 -22.734 -6.228 2.570 1.00 0.00 C ATOM 1893 O LEU A 121 -21.873 -6.710 1.832 1.00 0.00 O ATOM 1894 CB LEU A 121 -22.246 -4.759 4.518 1.00 0.00 C ATOM 1895 CG LEU A 121 -22.307 -3.395 5.206 1.00 0.00 C ATOM 1896 CD1 LEU A 121 -21.985 -3.544 6.688 1.00 0.00 C ATOM 1897 CD2 LEU A 121 -21.350 -2.414 4.543 1.00 0.00 C ATOM 0 H LEU A 121 -24.406 -3.829 3.683 1.00 0.00 H new ATOM 0 HA LEU A 121 -21.891 -4.252 2.462 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -22.894 -5.447 5.061 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -21.229 -5.142 4.605 1.00 0.00 H new ATOM 0 HG LEU A 121 -23.317 -2.998 5.106 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -22.031 -2.568 7.170 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -22.710 -4.212 7.152 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -20.984 -3.959 6.803 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -21.409 -1.450 5.048 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -20.332 -2.797 4.611 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -21.623 -2.292 3.495 1.00 0.00 H new ATOM 2016 N GLU A 130 -17.848 -8.240 2.945 1.00 0.00 N ATOM 2017 CA GLU A 130 -16.645 -7.441 3.164 1.00 0.00 C ATOM 2018 C GLU A 130 -16.604 -6.874 4.581 1.00 0.00 C ATOM 2019 O GLU A 130 -15.789 -7.291 5.403 1.00 0.00 O ATOM 2020 CB GLU A 130 -16.572 -6.301 2.145 1.00 0.00 C ATOM 2021 CG GLU A 130 -15.467 -6.476 1.116 1.00 0.00 C ATOM 2022 CD GLU A 130 -15.625 -7.742 0.298 1.00 0.00 C ATOM 2023 OE1 GLU A 130 -16.611 -7.841 -0.461 1.00 0.00 O ATOM 2024 OE2 GLU A 130 -14.759 -8.637 0.416 1.00 0.00 O ATOM 0 HA GLU A 130 -15.783 -8.096 3.035 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -17.529 -6.224 1.629 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -16.419 -5.361 2.674 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -15.459 -5.615 0.448 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -14.503 -6.494 1.624 1.00 0.00 H new ATOM 2031 N PHE A 131 -17.489 -5.923 4.861 1.00 0.00 N ATOM 2032 CA PHE A 131 -17.551 -5.300 6.180 1.00 0.00 C ATOM 2033 C PHE A 131 -18.709 -5.865 6.983 1.00 0.00 C ATOM 2034 O PHE A 131 -19.795 -6.104 6.453 1.00 0.00 O ATOM 2035 CB PHE A 131 -17.684 -3.785 6.057 1.00 0.00 C ATOM 2036 CG PHE A 131 -16.968 -3.214 4.865 1.00 0.00 C ATOM 2037 CD1 PHE A 131 -15.594 -3.049 4.880 1.00 0.00 C ATOM 2038 CD2 PHE A 131 -17.671 -2.850 3.727 1.00 0.00 C ATOM 2039 CE1 PHE A 131 -14.931 -2.530 3.785 1.00 0.00 C ATOM 2040 CE2 PHE A 131 -17.015 -2.331 2.628 1.00 0.00 C ATOM 2041 CZ PHE A 131 -15.642 -2.170 2.657 1.00 0.00 C ATOM 0 H PHE A 131 -18.173 -5.567 4.194 1.00 0.00 H new ATOM 0 HA PHE A 131 -16.622 -5.523 6.704 1.00 0.00 H new ATOM 0 HB2 PHE A 131 -18.741 -3.525 5.995 1.00 0.00 H new ATOM 0 HB3 PHE A 131 -17.294 -3.320 6.962 1.00 0.00 H new ATOM 0 HD1 PHE A 131 -15.033 -3.330 5.759 1.00 0.00 H new ATOM 0 HD2 PHE A 131 -18.744 -2.974 3.700 1.00 0.00 H new ATOM 0 HE1 PHE A 131 -13.858 -2.406 3.811 1.00 0.00 H new ATOM 0 HE2 PHE A 131 -17.574 -2.051 1.747 1.00 0.00 H new ATOM 0 HZ PHE A 131 -15.127 -1.764 1.799 1.00 0.00 H new ATOM 2051 N GLY A 132 -18.463 -6.085 8.263 1.00 0.00 N ATOM 2052 CA GLY A 132 -19.483 -6.638 9.127 1.00 0.00 C ATOM 2053 C GLY A 132 -20.437 -5.580 9.625 1.00 0.00 C ATOM 2054 O GLY A 132 -21.637 -5.821 9.761 1.00 0.00 O ATOM 0 H GLY A 132 -17.573 -5.890 8.721 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -20.040 -7.403 8.586 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -19.010 -7.129 9.978 1.00 0.00 H new ATOM 2058 N GLU A 133 -19.898 -4.401 9.896 1.00 0.00 N ATOM 2059 CA GLU A 133 -20.701 -3.287 10.381 1.00 0.00 C ATOM 2060 C GLU A 133 -20.084 -1.966 9.965 1.00 0.00 C ATOM 2061 O GLU A 133 -18.867 -1.853 9.830 1.00 0.00 O ATOM 2062 CB GLU A 133 -20.839 -3.345 11.908 1.00 0.00 C ATOM 2063 CG GLU A 133 -22.277 -3.226 12.388 1.00 0.00 C ATOM 2064 CD GLU A 133 -23.166 -4.322 11.834 1.00 0.00 C ATOM 2065 OE1 GLU A 133 -22.884 -5.507 12.107 1.00 0.00 O ATOM 2066 OE2 GLU A 133 -24.141 -3.995 11.126 1.00 0.00 O ATOM 0 H GLU A 133 -18.906 -4.190 9.788 1.00 0.00 H new ATOM 0 HA GLU A 133 -21.694 -3.365 9.938 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -20.420 -4.285 12.268 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -20.248 -2.542 12.350 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -22.297 -3.262 13.477 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -22.676 -2.255 12.094 1.00 0.00 H new ATOM 2073 N TRP A 134 -20.925 -0.964 9.760 1.00 0.00 N ATOM 2074 CA TRP A 134 -20.441 0.344 9.361 1.00 0.00 C ATOM 2075 C TRP A 134 -21.148 1.454 10.133 1.00 0.00 C ATOM 2076 O TRP A 134 -22.160 1.222 10.796 1.00 0.00 O ATOM 2077 CB TRP A 134 -20.596 0.536 7.851 1.00 0.00 C ATOM 2078 CG TRP A 134 -22.014 0.644 7.390 1.00 0.00 C ATOM 2079 CD1 TRP A 134 -22.763 -0.317 6.774 1.00 0.00 C ATOM 2080 CD2 TRP A 134 -22.846 1.794 7.504 1.00 0.00 C ATOM 2081 NE1 TRP A 134 -24.015 0.178 6.493 1.00 0.00 N ATOM 2082 CE2 TRP A 134 -24.087 1.471 6.934 1.00 0.00 C ATOM 2083 CE3 TRP A 134 -22.658 3.068 8.030 1.00 0.00 C ATOM 2084 CZ2 TRP A 134 -25.137 2.380 6.880 1.00 0.00 C ATOM 2085 CZ3 TRP A 134 -23.694 3.967 7.980 1.00 0.00 C ATOM 2086 CH2 TRP A 134 -24.922 3.624 7.411 1.00 0.00 C ATOM 0 H TRP A 134 -21.938 -1.032 9.863 1.00 0.00 H new ATOM 0 HA TRP A 134 -19.380 0.401 9.604 1.00 0.00 H new ATOM 0 HB2 TRP A 134 -20.059 1.437 7.554 1.00 0.00 H new ATOM 0 HB3 TRP A 134 -20.122 -0.301 7.339 1.00 0.00 H new ATOM 0 HD1 TRP A 134 -22.423 -1.316 6.542 1.00 0.00 H new ATOM 0 HE1 TRP A 134 -24.766 -0.335 6.032 1.00 0.00 H new ATOM 0 HE3 TRP A 134 -21.712 3.345 8.471 1.00 0.00 H new ATOM 0 HZ2 TRP A 134 -26.086 2.116 6.437 1.00 0.00 H new ATOM 0 HZ3 TRP A 134 -23.557 4.957 8.388 1.00 0.00 H new ATOM 0 HH2 TRP A 134 -25.718 4.354 7.389 1.00 0.00 H new ATOM 2097 N SER A 135 -20.594 2.658 10.054 1.00 0.00 N ATOM 2098 CA SER A 135 -21.152 3.813 10.753 1.00 0.00 C ATOM 2099 C SER A 135 -20.618 5.118 10.182 1.00 0.00 C ATOM 2100 O SER A 135 -19.776 5.122 9.286 1.00 0.00 O ATOM 2101 CB SER A 135 -20.813 3.759 12.247 1.00 0.00 C ATOM 2102 OG SER A 135 -21.447 4.814 12.951 1.00 0.00 O ATOM 0 H SER A 135 -19.755 2.862 9.511 1.00 0.00 H new ATOM 0 HA SER A 135 -22.233 3.777 10.616 1.00 0.00 H new ATOM 0 HB2 SER A 135 -21.128 2.801 12.660 1.00 0.00 H new ATOM 0 HB3 SER A 135 -19.733 3.825 12.381 1.00 0.00 H new ATOM 0 HG SER A 135 -20.799 5.530 13.121 1.00 0.00 H new ATOM 2108 N TRP A 136 -21.098 6.224 10.739 1.00 0.00 N ATOM 2109 CA TRP A 136 -20.652 7.549 10.321 1.00 0.00 C ATOM 2110 C TRP A 136 -19.907 8.221 11.458 1.00 0.00 C ATOM 2111 O TRP A 136 -20.516 8.778 12.373 1.00 0.00 O ATOM 2112 CB TRP A 136 -21.818 8.439 9.885 1.00 0.00 C ATOM 2113 CG TRP A 136 -22.705 7.820 8.854 1.00 0.00 C ATOM 2114 CD1 TRP A 136 -23.904 7.215 9.074 1.00 0.00 C ATOM 2115 CD2 TRP A 136 -22.476 7.757 7.440 1.00 0.00 C ATOM 2116 NE1 TRP A 136 -24.434 6.775 7.890 1.00 0.00 N ATOM 2117 CE2 TRP A 136 -23.579 7.095 6.871 1.00 0.00 C ATOM 2118 CE3 TRP A 136 -21.447 8.194 6.598 1.00 0.00 C ATOM 2119 CZ2 TRP A 136 -23.683 6.862 5.503 1.00 0.00 C ATOM 2120 CZ3 TRP A 136 -21.555 7.965 5.240 1.00 0.00 C ATOM 2121 CH2 TRP A 136 -22.665 7.304 4.706 1.00 0.00 C ATOM 0 H TRP A 136 -21.797 6.230 11.482 1.00 0.00 H new ATOM 0 HA TRP A 136 -19.994 7.416 9.463 1.00 0.00 H new ATOM 0 HB2 TRP A 136 -22.417 8.690 10.761 1.00 0.00 H new ATOM 0 HB3 TRP A 136 -21.420 9.375 9.492 1.00 0.00 H new ATOM 0 HD1 TRP A 136 -24.370 7.099 10.041 1.00 0.00 H new ATOM 0 HE1 TRP A 136 -25.324 6.287 7.785 1.00 0.00 H new ATOM 0 HE3 TRP A 136 -20.584 8.701 7.003 1.00 0.00 H new ATOM 0 HZ2 TRP A 136 -24.538 6.350 5.086 1.00 0.00 H new ATOM 0 HZ3 TRP A 136 -20.769 8.302 4.580 1.00 0.00 H new ATOM 0 HH2 TRP A 136 -22.719 7.139 3.640 1.00 0.00 H new ATOM 2132 N VAL A 137 -18.592 8.176 11.388 1.00 0.00 N ATOM 2133 CA VAL A 137 -17.756 8.789 12.401 1.00 0.00 C ATOM 2134 C VAL A 137 -16.988 9.950 11.786 1.00 0.00 C ATOM 2135 O VAL A 137 -16.966 10.100 10.568 1.00 0.00 O ATOM 2136 CB VAL A 137 -16.782 7.762 13.015 1.00 0.00 C ATOM 2137 CG1 VAL A 137 -17.555 6.586 13.601 1.00 0.00 C ATOM 2138 CG2 VAL A 137 -15.776 7.280 11.980 1.00 0.00 C ATOM 0 H VAL A 137 -18.077 7.719 10.636 1.00 0.00 H new ATOM 0 HA VAL A 137 -18.393 9.160 13.204 1.00 0.00 H new ATOM 0 HB VAL A 137 -16.230 8.251 13.818 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -16.856 5.869 14.031 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -18.230 6.945 14.378 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -18.133 6.102 12.814 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -15.101 6.557 12.438 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -16.304 6.809 11.151 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -15.201 8.128 11.609 1.00 0.00 H new ATOM 2148 N THR A 138 -16.346 10.762 12.611 1.00 0.00 N ATOM 2149 CA THR A 138 -15.579 11.884 12.094 1.00 0.00 C ATOM 2150 C THR A 138 -14.286 11.385 11.479 1.00 0.00 C ATOM 2151 O THR A 138 -13.939 10.214 11.614 1.00 0.00 O ATOM 2152 CB THR A 138 -15.281 12.898 13.197 1.00 0.00 C ATOM 2153 OG1 THR A 138 -14.297 12.401 14.086 1.00 0.00 O ATOM 2154 CG2 THR A 138 -16.500 13.266 14.002 1.00 0.00 C ATOM 0 H THR A 138 -16.340 10.668 13.627 1.00 0.00 H new ATOM 0 HA THR A 138 -16.173 12.382 11.328 1.00 0.00 H new ATOM 0 HB THR A 138 -14.922 13.792 12.687 1.00 0.00 H new ATOM 0 HG1 THR A 138 -14.120 13.066 14.783 1.00 0.00 H new ATOM 0 HG21 THR A 138 -16.224 13.989 14.770 1.00 0.00 H new ATOM 0 HG22 THR A 138 -17.252 13.703 13.345 1.00 0.00 H new ATOM 0 HG23 THR A 138 -16.907 12.372 14.475 1.00 0.00 H new ATOM 2162 N PRO A 139 -13.540 12.268 10.810 1.00 0.00 N ATOM 2163 CA PRO A 139 -12.274 11.887 10.201 1.00 0.00 C ATOM 2164 C PRO A 139 -11.292 11.432 11.268 1.00 0.00 C ATOM 2165 O PRO A 139 -10.762 10.327 11.209 1.00 0.00 O ATOM 2166 CB PRO A 139 -11.784 13.165 9.501 1.00 0.00 C ATOM 2167 CG PRO A 139 -12.939 14.116 9.509 1.00 0.00 C ATOM 2168 CD PRO A 139 -13.859 13.690 10.620 1.00 0.00 C ATOM 0 HA PRO A 139 -12.374 11.055 9.504 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -10.927 13.590 10.023 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -11.463 12.951 8.481 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -12.594 15.138 9.666 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -13.459 14.098 8.551 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -13.682 14.265 11.529 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -14.905 13.833 10.351 1.00 0.00 H new ATOM 2176 N GLU A 140 -11.082 12.290 12.255 1.00 0.00 N ATOM 2177 CA GLU A 140 -10.187 11.984 13.363 1.00 0.00 C ATOM 2178 C GLU A 140 -10.704 10.797 14.172 1.00 0.00 C ATOM 2179 O GLU A 140 -9.924 10.051 14.763 1.00 0.00 O ATOM 2180 CB GLU A 140 -10.022 13.209 14.260 1.00 0.00 C ATOM 2181 CG GLU A 140 -8.636 13.824 14.181 1.00 0.00 C ATOM 2182 CD GLU A 140 -8.613 15.276 14.617 1.00 0.00 C ATOM 2183 OE1 GLU A 140 -9.442 16.061 14.114 1.00 0.00 O ATOM 2184 OE2 GLU A 140 -7.764 15.626 15.465 1.00 0.00 O ATOM 0 H GLU A 140 -11.521 13.209 12.312 1.00 0.00 H new ATOM 0 HA GLU A 140 -9.214 11.714 12.952 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -10.762 13.959 13.980 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -10.229 12.926 15.292 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -7.953 13.250 14.807 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -8.268 13.751 13.157 1.00 0.00 H new ATOM 2191 N GLN A 141 -12.023 10.622 14.190 1.00 0.00 N ATOM 2192 CA GLN A 141 -12.636 9.518 14.922 1.00 0.00 C ATOM 2193 C GLN A 141 -12.364 8.200 14.215 1.00 0.00 C ATOM 2194 O GLN A 141 -11.961 7.221 14.843 1.00 0.00 O ATOM 2195 CB GLN A 141 -14.145 9.732 15.086 1.00 0.00 C ATOM 2196 CG GLN A 141 -14.520 10.470 16.364 1.00 0.00 C ATOM 2197 CD GLN A 141 -16.014 10.708 16.484 1.00 0.00 C ATOM 2198 OE1 GLN A 141 -16.818 9.804 16.257 1.00 0.00 O ATOM 2199 NE2 GLN A 141 -16.394 11.930 16.845 1.00 0.00 N ATOM 0 H GLN A 141 -12.686 11.229 13.707 1.00 0.00 H new ATOM 0 HA GLN A 141 -12.190 9.484 15.916 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -14.519 10.292 14.229 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -14.644 8.763 15.076 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -14.177 9.896 17.225 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -14.000 11.428 16.392 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -15.694 12.650 17.024 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -17.386 12.147 16.943 1.00 0.00 H new ATOM 2208 N LEU A 142 -12.578 8.178 12.902 1.00 0.00 N ATOM 2209 CA LEU A 142 -12.341 6.970 12.126 1.00 0.00 C ATOM 2210 C LEU A 142 -10.898 6.534 12.293 1.00 0.00 C ATOM 2211 O LEU A 142 -10.607 5.346 12.405 1.00 0.00 O ATOM 2212 CB LEU A 142 -12.646 7.204 10.641 1.00 0.00 C ATOM 2213 CG LEU A 142 -12.374 6.004 9.729 1.00 0.00 C ATOM 2214 CD1 LEU A 142 -13.298 4.856 10.080 1.00 0.00 C ATOM 2215 CD2 LEU A 142 -12.541 6.398 8.266 1.00 0.00 C ATOM 0 H LEU A 142 -12.912 8.975 12.360 1.00 0.00 H new ATOM 0 HA LEU A 142 -13.005 6.187 12.492 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -13.694 7.488 10.541 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -12.052 8.049 10.292 1.00 0.00 H new ATOM 0 HG LEU A 142 -11.345 5.678 9.881 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -13.093 4.010 9.424 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -13.133 4.560 11.116 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -14.334 5.171 9.953 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -12.344 5.534 7.632 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -13.560 6.747 8.097 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -11.839 7.195 8.021 1.00 0.00 H new ATOM 2227 N ILE A 143 -9.995 7.506 12.328 1.00 0.00 N ATOM 2228 CA ILE A 143 -8.583 7.206 12.505 1.00 0.00 C ATOM 2229 C ILE A 143 -8.348 6.509 13.841 1.00 0.00 C ATOM 2230 O ILE A 143 -7.539 5.592 13.945 1.00 0.00 O ATOM 2231 CB ILE A 143 -7.714 8.472 12.434 1.00 0.00 C ATOM 2232 CG1 ILE A 143 -7.959 9.212 11.117 1.00 0.00 C ATOM 2233 CG2 ILE A 143 -6.243 8.111 12.589 1.00 0.00 C ATOM 2234 CD1 ILE A 143 -7.451 8.474 9.899 1.00 0.00 C ATOM 0 H ILE A 143 -10.213 8.498 12.237 1.00 0.00 H new ATOM 0 HA ILE A 143 -8.293 6.545 11.688 1.00 0.00 H new ATOM 0 HB ILE A 143 -7.991 9.136 13.253 1.00 0.00 H new ATOM 0 HG12 ILE A 143 -9.029 9.388 11.004 1.00 0.00 H new ATOM 0 HG13 ILE A 143 -7.478 10.189 11.165 1.00 0.00 H new ATOM 0 HG21 ILE A 143 -5.639 9.017 12.537 1.00 0.00 H new ATOM 0 HG22 ILE A 143 -6.087 7.626 13.552 1.00 0.00 H new ATOM 0 HG23 ILE A 143 -5.949 7.432 11.789 1.00 0.00 H new ATOM 0 HD11 ILE A 143 -7.661 9.060 9.004 1.00 0.00 H new ATOM 0 HD12 ILE A 143 -6.376 8.321 9.989 1.00 0.00 H new ATOM 0 HD13 ILE A 143 -7.950 7.508 9.825 1.00 0.00 H new ATOM 2246 N ASP A 144 -9.061 6.943 14.868 1.00 0.00 N ATOM 2247 CA ASP A 144 -8.920 6.343 16.183 1.00 0.00 C ATOM 2248 C ASP A 144 -9.474 4.925 16.186 1.00 0.00 C ATOM 2249 O ASP A 144 -8.821 3.986 16.640 1.00 0.00 O ATOM 2250 CB ASP A 144 -9.636 7.192 17.235 1.00 0.00 C ATOM 2251 CG ASP A 144 -8.676 7.793 18.242 1.00 0.00 C ATOM 2252 OD1 ASP A 144 -7.964 7.023 18.918 1.00 0.00 O ATOM 2253 OD2 ASP A 144 -8.637 9.038 18.353 1.00 0.00 O ATOM 0 H ASP A 144 -9.739 7.704 14.817 1.00 0.00 H new ATOM 0 HA ASP A 144 -7.859 6.301 16.429 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -10.187 7.992 16.740 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -10.369 6.577 17.757 1.00 0.00 H new ATOM 2258 N LEU A 145 -10.692 4.794 15.689 1.00 0.00 N ATOM 2259 CA LEU A 145 -11.373 3.506 15.636 1.00 0.00 C ATOM 2260 C LEU A 145 -10.823 2.592 14.541 1.00 0.00 C ATOM 2261 O LEU A 145 -11.038 1.382 14.582 1.00 0.00 O ATOM 2262 CB LEU A 145 -12.871 3.721 15.423 1.00 0.00 C ATOM 2263 CG LEU A 145 -13.640 4.147 16.676 1.00 0.00 C ATOM 2264 CD1 LEU A 145 -14.143 5.578 16.544 1.00 0.00 C ATOM 2265 CD2 LEU A 145 -14.796 3.194 16.943 1.00 0.00 C ATOM 0 H LEU A 145 -11.236 5.570 15.312 1.00 0.00 H new ATOM 0 HA LEU A 145 -11.195 3.010 16.590 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -13.010 4.480 14.653 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -13.306 2.797 15.042 1.00 0.00 H new ATOM 0 HG LEU A 145 -12.957 4.106 17.524 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -14.686 5.857 17.447 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -13.296 6.250 16.407 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -14.807 5.652 15.683 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -15.331 3.513 17.838 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -15.477 3.200 16.092 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -14.409 2.186 17.091 1.00 0.00 H new ATOM 2277 N THR A 146 -10.126 3.157 13.559 1.00 0.00 N ATOM 2278 CA THR A 146 -9.584 2.341 12.476 1.00 0.00 C ATOM 2279 C THR A 146 -8.368 1.545 12.932 1.00 0.00 C ATOM 2280 O THR A 146 -7.892 1.705 14.056 1.00 0.00 O ATOM 2281 CB THR A 146 -9.236 3.183 11.241 1.00 0.00 C ATOM 2282 OG1 THR A 146 -8.910 2.346 10.149 1.00 0.00 O ATOM 2283 CG2 THR A 146 -8.070 4.114 11.444 1.00 0.00 C ATOM 0 H THR A 146 -9.926 4.155 13.490 1.00 0.00 H new ATOM 0 HA THR A 146 -10.368 1.639 12.193 1.00 0.00 H new ATOM 0 HB THR A 146 -10.127 3.781 11.050 1.00 0.00 H new ATOM 0 HG1 THR A 146 -9.487 1.554 10.160 1.00 0.00 H new ATOM 0 HG21 THR A 146 -7.887 4.673 10.527 1.00 0.00 H new ATOM 0 HG22 THR A 146 -8.295 4.808 12.254 1.00 0.00 H new ATOM 0 HG23 THR A 146 -7.182 3.535 11.699 1.00 0.00 H new ATOM 2291 N VAL A 147 -7.879 0.678 12.050 1.00 0.00 N ATOM 2292 CA VAL A 147 -6.725 -0.162 12.352 1.00 0.00 C ATOM 2293 C VAL A 147 -5.420 0.620 12.237 1.00 0.00 C ATOM 2294 O VAL A 147 -5.336 1.608 11.507 1.00 0.00 O ATOM 2295 CB VAL A 147 -6.657 -1.375 11.406 1.00 0.00 C ATOM 2296 CG1 VAL A 147 -7.825 -2.319 11.649 1.00 0.00 C ATOM 2297 CG2 VAL A 147 -6.617 -0.913 9.955 1.00 0.00 C ATOM 0 H VAL A 147 -8.266 0.539 11.117 1.00 0.00 H new ATOM 0 HA VAL A 147 -6.849 -0.506 13.379 1.00 0.00 H new ATOM 0 HB VAL A 147 -5.739 -1.925 11.614 1.00 0.00 H new ATOM 0 HG11 VAL A 147 -7.755 -3.168 10.969 1.00 0.00 H new ATOM 0 HG12 VAL A 147 -7.796 -2.676 12.679 1.00 0.00 H new ATOM 0 HG13 VAL A 147 -8.762 -1.791 11.474 1.00 0.00 H new ATOM 0 HG21 VAL A 147 -6.569 -1.781 9.298 1.00 0.00 H new ATOM 0 HG22 VAL A 147 -7.516 -0.338 9.731 1.00 0.00 H new ATOM 0 HG23 VAL A 147 -5.738 -0.289 9.796 1.00 0.00 H new ATOM 2307 N GLU A 148 -4.400 0.162 12.958 1.00 0.00 N ATOM 2308 CA GLU A 148 -3.092 0.807 12.936 1.00 0.00 C ATOM 2309 C GLU A 148 -2.497 0.792 11.533 1.00 0.00 C ATOM 2310 O GLU A 148 -2.131 1.833 10.996 1.00 0.00 O ATOM 2311 CB GLU A 148 -2.145 0.115 13.917 1.00 0.00 C ATOM 2312 CG GLU A 148 -2.375 0.518 15.367 1.00 0.00 C ATOM 2313 CD GLU A 148 -1.912 -0.540 16.351 1.00 0.00 C ATOM 2314 OE1 GLU A 148 -0.701 -0.839 16.374 1.00 0.00 O ATOM 2315 OE2 GLU A 148 -2.762 -1.067 17.100 1.00 0.00 O ATOM 0 H GLU A 148 -4.455 -0.655 13.566 1.00 0.00 H new ATOM 0 HA GLU A 148 -3.222 1.846 13.239 1.00 0.00 H new ATOM 0 HB2 GLU A 148 -2.264 -0.965 13.825 1.00 0.00 H new ATOM 0 HB3 GLU A 148 -1.116 0.347 13.642 1.00 0.00 H new ATOM 0 HG2 GLU A 148 -1.848 1.451 15.568 1.00 0.00 H new ATOM 0 HG3 GLU A 148 -3.436 0.712 15.522 1.00 0.00 H new ATOM 2322 N PHE A 149 -2.395 -0.395 10.942 1.00 0.00 N ATOM 2323 CA PHE A 149 -1.836 -0.538 9.600 1.00 0.00 C ATOM 2324 C PHE A 149 -2.552 0.331 8.551 1.00 0.00 C ATOM 2325 O PHE A 149 -2.162 0.333 7.383 1.00 0.00 O ATOM 2326 CB PHE A 149 -1.817 -2.011 9.171 1.00 0.00 C ATOM 2327 CG PHE A 149 -3.165 -2.676 9.100 1.00 0.00 C ATOM 2328 CD1 PHE A 149 -3.797 -3.140 10.246 1.00 0.00 C ATOM 2329 CD2 PHE A 149 -3.785 -2.865 7.876 1.00 0.00 C ATOM 2330 CE1 PHE A 149 -5.023 -3.778 10.166 1.00 0.00 C ATOM 2331 CE2 PHE A 149 -5.010 -3.496 7.793 1.00 0.00 C ATOM 2332 CZ PHE A 149 -5.629 -3.956 8.939 1.00 0.00 C ATOM 0 H PHE A 149 -2.692 -1.272 11.370 1.00 0.00 H new ATOM 0 HA PHE A 149 -0.810 -0.173 9.652 1.00 0.00 H new ATOM 0 HB2 PHE A 149 -1.343 -2.081 8.192 1.00 0.00 H new ATOM 0 HB3 PHE A 149 -1.191 -2.568 9.869 1.00 0.00 H new ATOM 0 HD1 PHE A 149 -3.328 -3.002 11.209 1.00 0.00 H new ATOM 0 HD2 PHE A 149 -3.304 -2.514 6.975 1.00 0.00 H new ATOM 0 HE1 PHE A 149 -5.505 -4.136 11.064 1.00 0.00 H new ATOM 0 HE2 PHE A 149 -5.484 -3.630 6.832 1.00 0.00 H new ATOM 0 HZ PHE A 149 -6.585 -4.454 8.875 1.00 0.00 H new ATOM 2342 N LYS A 150 -3.588 1.071 8.957 1.00 0.00 N ATOM 2343 CA LYS A 150 -4.320 1.934 8.027 1.00 0.00 C ATOM 2344 C LYS A 150 -4.593 3.317 8.625 1.00 0.00 C ATOM 2345 O LYS A 150 -5.088 4.207 7.934 1.00 0.00 O ATOM 2346 CB LYS A 150 -5.652 1.294 7.634 1.00 0.00 C ATOM 2347 CG LYS A 150 -5.510 -0.001 6.851 1.00 0.00 C ATOM 2348 CD LYS A 150 -6.863 -0.503 6.366 1.00 0.00 C ATOM 2349 CE LYS A 150 -6.711 -1.590 5.314 1.00 0.00 C ATOM 2350 NZ LYS A 150 -7.844 -1.594 4.346 1.00 0.00 N ATOM 0 H LYS A 150 -3.936 1.090 9.916 1.00 0.00 H new ATOM 0 HA LYS A 150 -3.690 2.054 7.146 1.00 0.00 H new ATOM 0 HB2 LYS A 150 -6.230 1.099 8.537 1.00 0.00 H new ATOM 0 HB3 LYS A 150 -6.223 2.006 7.038 1.00 0.00 H new ATOM 0 HG2 LYS A 150 -4.851 0.158 5.997 1.00 0.00 H new ATOM 0 HG3 LYS A 150 -5.042 -0.759 7.479 1.00 0.00 H new ATOM 0 HD2 LYS A 150 -7.432 -0.890 7.211 1.00 0.00 H new ATOM 0 HD3 LYS A 150 -7.433 0.328 5.952 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -5.775 -1.444 4.775 1.00 0.00 H new ATOM 0 HE3 LYS A 150 -6.649 -2.562 5.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -7.527 -2.000 3.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -8.624 -2.166 4.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -8.172 -0.619 4.192 1.00 0.00 H new ATOM 2364 N LYS A 151 -4.275 3.503 9.905 1.00 0.00 N ATOM 2365 CA LYS A 151 -4.505 4.788 10.563 1.00 0.00 C ATOM 2366 C LYS A 151 -3.717 5.911 9.883 1.00 0.00 C ATOM 2367 O LYS A 151 -4.308 6.847 9.350 1.00 0.00 O ATOM 2368 CB LYS A 151 -4.151 4.705 12.055 1.00 0.00 C ATOM 2369 CG LYS A 151 -5.320 4.248 12.913 1.00 0.00 C ATOM 2370 CD LYS A 151 -4.885 3.523 14.180 1.00 0.00 C ATOM 2371 CE LYS A 151 -3.878 4.329 14.976 1.00 0.00 C ATOM 2372 NZ LYS A 151 -4.539 5.428 15.732 1.00 0.00 N ATOM 0 H LYS A 151 -3.861 2.787 10.503 1.00 0.00 H new ATOM 0 HA LYS A 151 -5.566 5.023 10.472 1.00 0.00 H new ATOM 0 HB2 LYS A 151 -3.317 4.016 12.188 1.00 0.00 H new ATOM 0 HB3 LYS A 151 -3.814 5.683 12.399 1.00 0.00 H new ATOM 0 HG2 LYS A 151 -5.923 5.114 13.186 1.00 0.00 H new ATOM 0 HG3 LYS A 151 -5.958 3.588 12.325 1.00 0.00 H new ATOM 0 HD2 LYS A 151 -5.758 3.320 14.800 1.00 0.00 H new ATOM 0 HD3 LYS A 151 -4.450 2.559 13.915 1.00 0.00 H new ATOM 0 HE2 LYS A 151 -3.351 3.673 15.670 1.00 0.00 H new ATOM 0 HE3 LYS A 151 -3.130 4.747 14.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 -3.823 5.961 16.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 -5.021 6.066 15.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 -5.235 5.026 16.392 1.00 0.00 H new ATOM 2386 N PRO A 152 -2.373 5.829 9.878 1.00 0.00 N ATOM 2387 CA PRO A 152 -1.529 6.846 9.240 1.00 0.00 C ATOM 2388 C PRO A 152 -1.833 6.965 7.756 1.00 0.00 C ATOM 2389 O PRO A 152 -1.661 8.028 7.159 1.00 0.00 O ATOM 2390 CB PRO A 152 -0.100 6.334 9.455 1.00 0.00 C ATOM 2391 CG PRO A 152 -0.248 4.887 9.786 1.00 0.00 C ATOM 2392 CD PRO A 152 -1.578 4.748 10.471 1.00 0.00 C ATOM 0 HA PRO A 152 -1.693 7.838 9.660 1.00 0.00 H new ATOM 0 HB2 PRO A 152 0.507 6.473 8.560 1.00 0.00 H new ATOM 0 HB3 PRO A 152 0.394 6.874 10.263 1.00 0.00 H new ATOM 0 HG2 PRO A 152 -0.209 4.275 8.885 1.00 0.00 H new ATOM 0 HG3 PRO A 152 0.561 4.551 10.435 1.00 0.00 H new ATOM 0 HD2 PRO A 152 -2.026 3.771 10.288 1.00 0.00 H new ATOM 0 HD3 PRO A 152 -1.488 4.860 11.552 1.00 0.00 H new ATOM 2400 N VAL A 153 -2.312 5.875 7.172 1.00 0.00 N ATOM 2401 CA VAL A 153 -2.668 5.872 5.767 1.00 0.00 C ATOM 2402 C VAL A 153 -3.893 6.749 5.571 1.00 0.00 C ATOM 2403 O VAL A 153 -3.896 7.654 4.738 1.00 0.00 O ATOM 2404 CB VAL A 153 -2.956 4.449 5.259 1.00 0.00 C ATOM 2405 CG1 VAL A 153 -3.169 4.452 3.753 1.00 0.00 C ATOM 2406 CG2 VAL A 153 -1.822 3.509 5.643 1.00 0.00 C ATOM 0 H VAL A 153 -2.461 4.987 7.650 1.00 0.00 H new ATOM 0 HA VAL A 153 -1.827 6.261 5.193 1.00 0.00 H new ATOM 0 HB VAL A 153 -3.872 4.091 5.730 1.00 0.00 H new ATOM 0 HG11 VAL A 153 -3.371 3.437 3.412 1.00 0.00 H new ATOM 0 HG12 VAL A 153 -4.015 5.093 3.507 1.00 0.00 H new ATOM 0 HG13 VAL A 153 -2.273 4.828 3.260 1.00 0.00 H new ATOM 0 HG21 VAL A 153 -2.041 2.506 5.276 1.00 0.00 H new ATOM 0 HG22 VAL A 153 -0.891 3.862 5.200 1.00 0.00 H new ATOM 0 HG23 VAL A 153 -1.721 3.485 6.728 1.00 0.00 H new ATOM 2416 N TYR A 154 -4.921 6.497 6.379 1.00 0.00 N ATOM 2417 CA TYR A 154 -6.145 7.285 6.330 1.00 0.00 C ATOM 2418 C TYR A 154 -5.853 8.712 6.767 1.00 0.00 C ATOM 2419 O TYR A 154 -6.376 9.674 6.207 1.00 0.00 O ATOM 2420 CB TYR A 154 -7.196 6.677 7.264 1.00 0.00 C ATOM 2421 CG TYR A 154 -7.813 5.392 6.760 1.00 0.00 C ATOM 2422 CD1 TYR A 154 -7.501 4.886 5.505 1.00 0.00 C ATOM 2423 CD2 TYR A 154 -8.709 4.683 7.548 1.00 0.00 C ATOM 2424 CE1 TYR A 154 -8.066 3.714 5.051 1.00 0.00 C ATOM 2425 CE2 TYR A 154 -9.280 3.510 7.097 1.00 0.00 C ATOM 2426 CZ TYR A 154 -8.954 3.030 5.848 1.00 0.00 C ATOM 2427 OH TYR A 154 -9.522 1.864 5.391 1.00 0.00 O ATOM 0 H TYR A 154 -4.928 5.752 7.075 1.00 0.00 H new ATOM 0 HA TYR A 154 -6.525 7.284 5.308 1.00 0.00 H new ATOM 0 HB2 TYR A 154 -6.736 6.489 8.234 1.00 0.00 H new ATOM 0 HB3 TYR A 154 -7.989 7.408 7.423 1.00 0.00 H new ATOM 0 HD1 TYR A 154 -6.805 5.419 4.875 1.00 0.00 H new ATOM 0 HD2 TYR A 154 -8.963 5.055 8.529 1.00 0.00 H new ATOM 0 HE1 TYR A 154 -7.812 3.334 4.072 1.00 0.00 H new ATOM 0 HE2 TYR A 154 -9.979 2.972 7.720 1.00 0.00 H new ATOM 0 HH TYR A 154 -8.902 1.416 4.778 1.00 0.00 H new ATOM 2437 N LYS A 155 -5.006 8.826 7.783 1.00 0.00 N ATOM 2438 CA LYS A 155 -4.619 10.117 8.330 1.00 0.00 C ATOM 2439 C LYS A 155 -4.036 11.021 7.255 1.00 0.00 C ATOM 2440 O LYS A 155 -4.326 12.216 7.212 1.00 0.00 O ATOM 2441 CB LYS A 155 -3.621 9.915 9.472 1.00 0.00 C ATOM 2442 CG LYS A 155 -4.158 10.328 10.833 1.00 0.00 C ATOM 2443 CD LYS A 155 -4.792 11.711 10.800 1.00 0.00 C ATOM 2444 CE LYS A 155 -4.917 12.300 12.197 1.00 0.00 C ATOM 2445 NZ LYS A 155 -5.501 11.334 13.165 1.00 0.00 N ATOM 0 H LYS A 155 -4.571 8.029 8.248 1.00 0.00 H new ATOM 0 HA LYS A 155 -5.510 10.609 8.720 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -3.332 8.865 9.509 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -2.718 10.487 9.259 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -4.896 9.599 11.168 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -3.347 10.318 11.561 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -4.191 12.373 10.177 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -5.778 11.649 10.340 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -3.933 12.612 12.547 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -5.540 13.194 12.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -5.817 11.843 14.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -6.312 10.852 12.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -4.782 10.631 13.430 1.00 0.00 H new ATOM 2459 N GLU A 156 -3.225 10.446 6.376 1.00 0.00 N ATOM 2460 CA GLU A 156 -2.632 11.212 5.297 1.00 0.00 C ATOM 2461 C GLU A 156 -3.710 11.575 4.298 1.00 0.00 C ATOM 2462 O GLU A 156 -3.665 12.629 3.663 1.00 0.00 O ATOM 2463 CB GLU A 156 -1.520 10.415 4.613 1.00 0.00 C ATOM 2464 CG GLU A 156 -0.679 11.248 3.662 1.00 0.00 C ATOM 2465 CD GLU A 156 0.675 11.604 4.242 1.00 0.00 C ATOM 2466 OE1 GLU A 156 0.711 12.289 5.286 1.00 0.00 O ATOM 2467 OE2 GLU A 156 1.699 11.199 3.653 1.00 0.00 O ATOM 0 H GLU A 156 -2.967 9.459 6.392 1.00 0.00 H new ATOM 0 HA GLU A 156 -2.190 12.121 5.705 1.00 0.00 H new ATOM 0 HB2 GLU A 156 -0.872 9.982 5.375 1.00 0.00 H new ATOM 0 HB3 GLU A 156 -1.964 9.585 4.063 1.00 0.00 H new ATOM 0 HG2 GLU A 156 -0.538 10.699 2.731 1.00 0.00 H new ATOM 0 HG3 GLU A 156 -1.216 12.163 3.414 1.00 0.00 H new ATOM 2474 N VAL A 157 -4.697 10.693 4.183 1.00 0.00 N ATOM 2475 CA VAL A 157 -5.808 10.919 3.287 1.00 0.00 C ATOM 2476 C VAL A 157 -6.624 12.110 3.775 1.00 0.00 C ATOM 2477 O VAL A 157 -7.055 12.949 2.983 1.00 0.00 O ATOM 2478 CB VAL A 157 -6.718 9.675 3.173 1.00 0.00 C ATOM 2479 CG1 VAL A 157 -7.893 9.949 2.249 1.00 0.00 C ATOM 2480 CG2 VAL A 157 -5.925 8.472 2.682 1.00 0.00 C ATOM 0 H VAL A 157 -4.744 9.817 4.703 1.00 0.00 H new ATOM 0 HA VAL A 157 -5.402 11.124 2.297 1.00 0.00 H new ATOM 0 HB VAL A 157 -7.108 9.449 4.166 1.00 0.00 H new ATOM 0 HG11 VAL A 157 -8.520 9.060 2.184 1.00 0.00 H new ATOM 0 HG12 VAL A 157 -8.480 10.779 2.643 1.00 0.00 H new ATOM 0 HG13 VAL A 157 -7.523 10.206 1.256 1.00 0.00 H new ATOM 0 HG21 VAL A 157 -6.584 7.607 2.609 1.00 0.00 H new ATOM 0 HG22 VAL A 157 -5.503 8.690 1.701 1.00 0.00 H new ATOM 0 HG23 VAL A 157 -5.120 8.256 3.384 1.00 0.00 H new ATOM 2490 N LEU A 158 -6.824 12.184 5.091 1.00 0.00 N ATOM 2491 CA LEU A 158 -7.578 13.282 5.686 1.00 0.00 C ATOM 2492 C LEU A 158 -6.863 14.602 5.458 1.00 0.00 C ATOM 2493 O LEU A 158 -7.490 15.608 5.130 1.00 0.00 O ATOM 2494 CB LEU A 158 -7.776 13.044 7.181 1.00 0.00 C ATOM 2495 CG LEU A 158 -8.685 11.868 7.534 1.00 0.00 C ATOM 2496 CD1 LEU A 158 -8.883 11.781 9.040 1.00 0.00 C ATOM 2497 CD2 LEU A 158 -10.022 11.997 6.821 1.00 0.00 C ATOM 0 H LEU A 158 -6.475 11.499 5.761 1.00 0.00 H new ATOM 0 HA LEU A 158 -8.556 13.327 5.206 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -6.801 12.880 7.640 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -8.189 13.949 7.626 1.00 0.00 H new ATOM 0 HG LEU A 158 -8.207 10.947 7.199 1.00 0.00 H new ATOM 0 HD11 LEU A 158 -9.533 10.938 9.273 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -7.918 11.641 9.526 1.00 0.00 H new ATOM 0 HD13 LEU A 158 -9.340 12.702 9.401 1.00 0.00 H new ATOM 0 HD21 LEU A 158 -10.657 11.151 7.083 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -10.508 12.924 7.125 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -9.860 12.008 5.743 1.00 0.00 H new ATOM 2509 N SER A 159 -5.541 14.593 5.618 1.00 0.00 N ATOM 2510 CA SER A 159 -4.753 15.800 5.408 1.00 0.00 C ATOM 2511 C SER A 159 -5.042 16.348 4.025 1.00 0.00 C ATOM 2512 O SER A 159 -5.205 17.552 3.835 1.00 0.00 O ATOM 2513 CB SER A 159 -3.259 15.513 5.571 1.00 0.00 C ATOM 2514 OG SER A 159 -3.001 14.830 6.785 1.00 0.00 O ATOM 0 H SER A 159 -5.000 13.772 5.889 1.00 0.00 H new ATOM 0 HA SER A 159 -5.030 16.541 6.158 1.00 0.00 H new ATOM 0 HB2 SER A 159 -2.907 14.914 4.731 1.00 0.00 H new ATOM 0 HB3 SER A 159 -2.701 16.449 5.551 1.00 0.00 H new ATOM 0 HG SER A 159 -3.366 13.922 6.734 1.00 0.00 H new ATOM 2520 N VAL A 160 -5.142 15.442 3.063 1.00 0.00 N ATOM 2521 CA VAL A 160 -5.457 15.818 1.699 1.00 0.00 C ATOM 2522 C VAL A 160 -6.876 16.364 1.636 1.00 0.00 C ATOM 2523 O VAL A 160 -7.145 17.365 0.974 1.00 0.00 O ATOM 2524 CB VAL A 160 -5.364 14.619 0.746 1.00 0.00 C ATOM 2525 CG1 VAL A 160 -5.738 15.041 -0.664 1.00 0.00 C ATOM 2526 CG2 VAL A 160 -3.977 13.994 0.787 1.00 0.00 C ATOM 0 H VAL A 160 -5.009 14.441 3.206 1.00 0.00 H new ATOM 0 HA VAL A 160 -4.733 16.572 1.391 1.00 0.00 H new ATOM 0 HB VAL A 160 -6.073 13.859 1.075 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -5.668 14.182 -1.331 1.00 0.00 H new ATOM 0 HG12 VAL A 160 -6.759 15.424 -0.671 1.00 0.00 H new ATOM 0 HG13 VAL A 160 -5.056 15.820 -1.003 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -3.939 13.147 0.102 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -3.235 14.735 0.489 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -3.762 13.652 1.799 1.00 0.00 H new ATOM 2536 N PHE A 161 -7.775 15.664 2.319 1.00 0.00 N ATOM 2537 CA PHE A 161 -9.185 16.022 2.358 1.00 0.00 C ATOM 2538 C PHE A 161 -9.476 17.130 3.368 1.00 0.00 C ATOM 2539 O PHE A 161 -10.632 17.481 3.588 1.00 0.00 O ATOM 2540 CB PHE A 161 -10.004 14.774 2.701 1.00 0.00 C ATOM 2541 CG PHE A 161 -9.942 13.708 1.642 1.00 0.00 C ATOM 2542 CD1 PHE A 161 -9.611 14.029 0.334 1.00 0.00 C ATOM 2543 CD2 PHE A 161 -10.203 12.383 1.953 1.00 0.00 C ATOM 2544 CE1 PHE A 161 -9.542 13.054 -0.640 1.00 0.00 C ATOM 2545 CE2 PHE A 161 -10.134 11.403 0.982 1.00 0.00 C ATOM 2546 CZ PHE A 161 -9.803 11.739 -0.316 1.00 0.00 C ATOM 0 H PHE A 161 -7.545 14.831 2.861 1.00 0.00 H new ATOM 0 HA PHE A 161 -9.464 16.405 1.376 1.00 0.00 H new ATOM 0 HB2 PHE A 161 -9.645 14.361 3.643 1.00 0.00 H new ATOM 0 HB3 PHE A 161 -11.044 15.062 2.855 1.00 0.00 H new ATOM 0 HD1 PHE A 161 -9.404 15.057 0.074 1.00 0.00 H new ATOM 0 HD2 PHE A 161 -10.463 12.114 2.966 1.00 0.00 H new ATOM 0 HE1 PHE A 161 -9.284 13.320 -1.654 1.00 0.00 H new ATOM 0 HE2 PHE A 161 -10.339 10.374 1.238 1.00 0.00 H new ATOM 0 HZ PHE A 161 -9.749 10.974 -1.076 1.00 0.00 H new ATOM 2556 N ALA A 162 -8.437 17.684 3.984 1.00 0.00 N ATOM 2557 CA ALA A 162 -8.634 18.741 4.966 1.00 0.00 C ATOM 2558 C ALA A 162 -9.346 19.939 4.345 1.00 0.00 C ATOM 2559 O ALA A 162 -10.349 20.416 4.874 1.00 0.00 O ATOM 2560 CB ALA A 162 -7.302 19.161 5.561 1.00 0.00 C ATOM 0 H ALA A 162 -7.464 17.423 3.823 1.00 0.00 H new ATOM 0 HA ALA A 162 -9.266 18.352 5.764 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -7.464 19.952 6.294 1.00 0.00 H new ATOM 0 HB2 ALA A 162 -6.835 18.305 6.048 1.00 0.00 H new ATOM 0 HB3 ALA A 162 -6.649 19.528 4.769 1.00 0.00 H new ATOM 2566 N PRO A 163 -8.849 20.429 3.196 1.00 0.00 N ATOM 2567 CA PRO A 163 -9.460 21.559 2.492 1.00 0.00 C ATOM 2568 C PRO A 163 -10.908 21.274 2.098 1.00 0.00 C ATOM 2569 O PRO A 163 -11.638 22.179 1.693 1.00 0.00 O ATOM 2570 CB PRO A 163 -8.593 21.724 1.237 1.00 0.00 C ATOM 2571 CG PRO A 163 -7.315 21.023 1.547 1.00 0.00 C ATOM 2572 CD PRO A 163 -7.672 19.909 2.488 1.00 0.00 C ATOM 0 HA PRO A 163 -9.496 22.451 3.117 1.00 0.00 H new ATOM 0 HB2 PRO A 163 -9.079 21.289 0.364 1.00 0.00 H new ATOM 0 HB3 PRO A 163 -8.420 22.777 1.014 1.00 0.00 H new ATOM 0 HG2 PRO A 163 -6.853 20.634 0.639 1.00 0.00 H new ATOM 0 HG3 PRO A 163 -6.597 21.704 2.003 1.00 0.00 H new ATOM 0 HD2 PRO A 163 -7.899 18.987 1.952 1.00 0.00 H new ATOM 0 HD3 PRO A 163 -6.856 19.685 3.175 1.00 0.00 H new ATOM 2580 N HIS A 164 -11.318 20.011 2.214 1.00 0.00 N ATOM 2581 CA HIS A 164 -12.678 19.614 1.864 1.00 0.00 C ATOM 2582 C HIS A 164 -13.465 19.172 3.096 1.00 0.00 C ATOM 2583 O HIS A 164 -14.692 19.109 3.066 1.00 0.00 O ATOM 2584 CB HIS A 164 -12.653 18.486 0.831 1.00 0.00 C ATOM 2585 CG HIS A 164 -11.778 18.781 -0.347 1.00 0.00 C ATOM 2586 ND1 HIS A 164 -12.174 19.579 -1.401 1.00 0.00 N ATOM 2587 CD2 HIS A 164 -10.510 18.397 -0.624 1.00 0.00 C ATOM 2588 CE1 HIS A 164 -11.186 19.672 -2.274 1.00 0.00 C ATOM 2589 NE2 HIS A 164 -10.166 18.966 -1.825 1.00 0.00 N ATOM 0 H HIS A 164 -10.728 19.248 2.547 1.00 0.00 H new ATOM 0 HA HIS A 164 -13.177 20.484 1.436 1.00 0.00 H new ATOM 0 HB2 HIS A 164 -12.307 17.571 1.311 1.00 0.00 H new ATOM 0 HB3 HIS A 164 -13.669 18.299 0.483 1.00 0.00 H new ATOM 0 HD2 HIS A 164 -9.885 17.761 -0.014 1.00 0.00 H new ATOM 0 HE1 HIS A 164 -11.210 20.231 -3.198 1.00 0.00 H new ATOM 0 HE2 HIS A 164 -9.267 18.860 -2.295 1.00 0.00 H new ATOM 2598 N LEU A 165 -12.754 18.866 4.177 1.00 0.00 N ATOM 2599 CA LEU A 165 -13.402 18.431 5.410 1.00 0.00 C ATOM 2600 C LEU A 165 -13.583 19.604 6.370 1.00 0.00 C ATOM 2601 O LEU A 165 -13.927 19.356 7.546 1.00 0.00 O ATOM 2602 CB LEU A 165 -12.585 17.329 6.084 1.00 0.00 C ATOM 2603 CG LEU A 165 -12.436 16.039 5.275 1.00 0.00 C ATOM 2604 CD1 LEU A 165 -11.532 15.059 6.004 1.00 0.00 C ATOM 2605 CD2 LEU A 165 -13.797 15.416 5.000 1.00 0.00 C ATOM 2606 OXT LEU A 165 -13.380 20.758 5.941 1.00 0.00 O ATOM 0 H LEU A 165 -11.736 18.911 4.225 1.00 0.00 H new ATOM 0 HA LEU A 165 -14.385 18.036 5.153 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -11.591 17.718 6.303 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -13.050 17.088 7.040 1.00 0.00 H new ATOM 0 HG LEU A 165 -11.977 16.283 4.317 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -11.436 14.146 5.416 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -10.548 15.506 6.143 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -11.963 14.820 6.976 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -13.668 14.500 4.424 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -14.289 15.184 5.945 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -14.411 16.117 4.434 1.00 0.00 H new