USER MOD reduce.3.24.130724 H: found=0, std=0, add=727, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 726 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 66 SER OG : rot 180:sc= -0.0779 USER MOD Set 1.2: A 67 THR OG1 : rot 35:sc= 1.1 USER MOD Set 2.1: A 19 SER OG : rot -56:sc= 1.88 USER MOD Set 2.2: A 37 LYS NZ :NH3+ 178:sc= 2.4 (180deg=1.1) USER MOD Set 3.1: A 27 THR OG1 : rot -122:sc= 1.24 USER MOD Set 3.2: A 31 THR OG1 : rot -147:sc= 2.03 USER MOD Single : A 13 MET CE :methyl -171:sc= 0 (180deg=-0.0762) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ -156:sc= 1.1 (180deg=0.373) USER MOD Single : A 22 LYS NZ :NH3+ 144:sc= 2.32 (180deg=0.0263) USER MOD Single : A 24 MET CE :methyl 151:sc= -0.0264 (180deg=-0.624) USER MOD Single : A 28 GLN : amide:sc= 0.334 K(o=0.33,f=-6.3!) USER MOD Single : A 29 HIS : no HE2:sc= 1.25 K(o=1.3,f=-4.5!) USER MOD Single : A 32 THR OG1 : rot 132:sc= 0.841 USER MOD Single : A 35 LYS NZ :NH3+ -118:sc= 2.34 (180deg=0.38) USER MOD Single : A 38 TYR OH : rot 130:sc= 0.0309 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= 1.19 K(o=1.2,f=-0.48) USER MOD Single : A 56 LYS NZ :NH3+ -154:sc= 2.56 (180deg=1.22) USER MOD Single : A 58 LYS NZ :NH3+ -165:sc= 2.4 (180deg=0.893) USER MOD Single : A 65 SER OG : rot -42:sc= 0.85 USER MOD Single : A 72 ASN : amide:sc= 1.27 K(o=1.3,f=-0.027) USER MOD Single : A 73 THR OG1 : rot -125:sc= 0.583 USER MOD Single : A 74 ASN : amide:sc= 0.0688 K(o=0.069,f=-1.3) USER MOD Single : A 75 SER OG : rot -80:sc= 0.0595 USER MOD Single : A 77 THR OG1 : rot 164:sc= 1.19 USER MOD Single : A 78 ASN : amide:sc= 0.103 K(o=0.1,f=-1.6!) USER MOD Single : A 88 SER OG : rot 3:sc= 1.13 USER MOD Single : A 89 TYR OH : rot -8:sc= 1.11 USER MOD Single : A 96 ASN : amide:sc= 0.299 K(o=0.3,f=-1.1) USER MOD Single : A 97 SER OG : rot -122:sc= 1.4 USER MOD Single : A 100 THR OG1 : rot 65:sc= 0.96 USER MOD Single : A 102 HIS : no HD1:sc= 0.404 K(o=0.4,f=-2.3!) USER MOD Single : A 106 LYS NZ :NH3+ 163:sc= 1.34 (180deg=1.03) USER MOD ----------------------------------------------------------------- ATOM 211 N MET A 13 -67.984 35.915 95.241 1.00 0.00 N ATOM 212 CA MET A 13 -67.056 36.589 96.159 1.00 0.00 C ATOM 213 C MET A 13 -65.663 35.947 96.245 1.00 0.00 C ATOM 214 O MET A 13 -64.861 36.113 95.331 1.00 0.00 O ATOM 215 CB MET A 13 -67.754 36.794 97.522 1.00 0.00 C ATOM 216 CG MET A 13 -68.635 38.041 97.526 1.00 0.00 C ATOM 217 SD MET A 13 -67.747 39.622 97.484 1.00 0.00 S ATOM 218 CE MET A 13 -67.047 39.660 99.157 1.00 0.00 C ATOM 0 HA MET A 13 -66.823 37.570 95.746 1.00 0.00 H new ATOM 0 HB2 MET A 13 -68.361 35.919 97.755 1.00 0.00 H new ATOM 0 HB3 MET A 13 -67.002 36.878 98.307 1.00 0.00 H new ATOM 0 HG2 MET A 13 -69.303 37.996 96.666 1.00 0.00 H new ATOM 0 HG3 MET A 13 -69.262 38.019 98.418 1.00 0.00 H new ATOM 0 HE1 MET A 13 -66.607 40.639 99.345 1.00 0.00 H new ATOM 0 HE2 MET A 13 -67.835 39.471 99.886 1.00 0.00 H new ATOM 0 HE3 MET A 13 -66.278 38.893 99.247 1.00 0.00 H new ATOM 228 N CYS A 14 -65.314 35.352 97.389 1.00 0.00 N ATOM 229 CA CYS A 14 -63.963 35.485 97.924 1.00 0.00 C ATOM 230 C CYS A 14 -62.905 34.681 97.168 1.00 0.00 C ATOM 231 O CYS A 14 -62.730 33.484 97.388 1.00 0.00 O ATOM 232 CB CYS A 14 -63.974 35.172 99.419 1.00 0.00 C ATOM 233 SG CYS A 14 -64.647 36.545 100.386 1.00 0.00 S ATOM 0 H CYS A 14 -65.942 34.781 97.954 1.00 0.00 H new ATOM 0 HA CYS A 14 -63.659 36.521 97.776 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -64.567 34.275 99.599 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -62.959 34.955 99.753 1.00 0.00 H new ATOM 238 N SER A 15 -62.132 35.397 96.346 1.00 0.00 N ATOM 239 CA SER A 15 -60.888 34.935 95.738 1.00 0.00 C ATOM 240 C SER A 15 -59.761 34.681 96.750 1.00 0.00 C ATOM 241 O SER A 15 -58.764 34.055 96.388 1.00 0.00 O ATOM 242 CB SER A 15 -60.422 35.960 94.699 1.00 0.00 C ATOM 243 OG SER A 15 -60.257 37.224 95.316 1.00 0.00 O ATOM 0 H SER A 15 -62.368 36.352 96.077 1.00 0.00 H new ATOM 0 HA SER A 15 -61.106 33.974 95.272 1.00 0.00 H new ATOM 0 HB2 SER A 15 -59.482 35.637 94.252 1.00 0.00 H new ATOM 0 HB3 SER A 15 -61.151 36.031 93.892 1.00 0.00 H new ATOM 0 HG SER A 15 -59.957 37.877 94.649 1.00 0.00 H new ATOM 249 N GLY A 16 -59.905 35.119 98.008 1.00 0.00 N ATOM 250 CA GLY A 16 -58.936 34.922 99.088 1.00 0.00 C ATOM 251 C GLY A 16 -59.076 33.584 99.830 1.00 0.00 C ATOM 252 O GLY A 16 -60.045 32.849 99.661 1.00 0.00 O ATOM 0 H GLY A 16 -60.730 35.638 98.309 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -57.930 34.990 98.674 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -59.041 35.735 99.807 1.00 0.00 H new ATOM 256 N LYS A 17 -58.074 33.284 100.666 1.00 0.00 N ATOM 257 CA LYS A 17 -57.886 32.015 101.387 1.00 0.00 C ATOM 258 C LYS A 17 -58.926 31.769 102.499 1.00 0.00 C ATOM 259 O LYS A 17 -59.475 32.704 103.082 1.00 0.00 O ATOM 260 CB LYS A 17 -56.445 32.008 101.956 1.00 0.00 C ATOM 261 CG LYS A 17 -55.551 30.869 101.420 1.00 0.00 C ATOM 262 CD LYS A 17 -55.599 29.586 102.264 1.00 0.00 C ATOM 263 CE LYS A 17 -54.917 29.827 103.620 1.00 0.00 C ATOM 264 NZ LYS A 17 -55.409 28.932 104.690 1.00 0.00 N ATOM 0 H LYS A 17 -57.333 33.954 100.870 1.00 0.00 H new ATOM 0 HA LYS A 17 -58.036 31.195 100.685 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -55.972 32.963 101.726 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -56.497 31.932 103.042 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -55.855 30.632 100.400 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -54.521 31.222 101.372 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -56.634 29.279 102.417 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -55.100 28.774 101.735 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -53.842 29.690 103.507 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -55.077 30.863 103.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -55.244 29.375 105.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -56.428 28.765 104.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -54.901 28.025 104.645 1.00 0.00 H new ATOM 278 N PHE A 18 -59.102 30.489 102.841 1.00 0.00 N ATOM 279 CA PHE A 18 -59.938 29.942 103.918 1.00 0.00 C ATOM 280 C PHE A 18 -59.121 28.933 104.752 1.00 0.00 C ATOM 281 O PHE A 18 -58.070 28.478 104.296 1.00 0.00 O ATOM 282 CB PHE A 18 -61.165 29.253 103.282 1.00 0.00 C ATOM 283 CG PHE A 18 -62.184 30.199 102.672 1.00 0.00 C ATOM 284 CD1 PHE A 18 -61.980 30.735 101.385 1.00 0.00 C ATOM 285 CD2 PHE A 18 -63.334 30.559 103.401 1.00 0.00 C ATOM 286 CE1 PHE A 18 -62.882 31.675 100.857 1.00 0.00 C ATOM 287 CE2 PHE A 18 -64.231 31.505 102.879 1.00 0.00 C ATOM 288 CZ PHE A 18 -63.995 32.075 101.615 1.00 0.00 C ATOM 0 H PHE A 18 -58.625 29.746 102.330 1.00 0.00 H new ATOM 0 HA PHE A 18 -60.271 30.740 104.581 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -60.818 28.568 102.509 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -61.660 28.650 104.043 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -61.127 30.422 100.802 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -63.526 30.107 104.363 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -62.720 32.088 99.872 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -65.102 31.795 103.448 1.00 0.00 H new ATOM 0 HZ PHE A 18 -64.671 32.822 101.226 1.00 0.00 H new ATOM 298 N SER A 19 -59.614 28.520 105.926 1.00 0.00 N ATOM 299 CA SER A 19 -59.112 27.359 106.678 1.00 0.00 C ATOM 300 C SER A 19 -60.050 26.165 106.504 1.00 0.00 C ATOM 301 O SER A 19 -61.271 26.323 106.594 1.00 0.00 O ATOM 302 CB SER A 19 -59.025 27.604 108.192 1.00 0.00 C ATOM 303 OG SER A 19 -58.567 28.888 108.560 1.00 0.00 O ATOM 0 H SER A 19 -60.389 28.992 106.391 1.00 0.00 H new ATOM 0 HA SER A 19 -58.115 27.173 106.278 1.00 0.00 H new ATOM 0 HB2 SER A 19 -60.011 27.447 108.628 1.00 0.00 H new ATOM 0 HB3 SER A 19 -58.361 26.858 108.629 1.00 0.00 H new ATOM 0 HG SER A 19 -57.697 29.057 108.142 1.00 0.00 H new ATOM 309 N ILE A 20 -59.475 24.967 106.350 1.00 0.00 N ATOM 310 CA ILE A 20 -60.158 23.719 106.693 1.00 0.00 C ATOM 311 C ILE A 20 -60.181 23.622 108.223 1.00 0.00 C ATOM 312 O ILE A 20 -59.158 23.406 108.867 1.00 0.00 O ATOM 313 CB ILE A 20 -59.537 22.495 105.975 1.00 0.00 C ATOM 314 CG1 ILE A 20 -60.266 21.184 106.346 1.00 0.00 C ATOM 315 CG2 ILE A 20 -58.023 22.310 106.194 1.00 0.00 C ATOM 316 CD1 ILE A 20 -61.740 21.180 105.922 1.00 0.00 C ATOM 0 H ILE A 20 -58.531 24.838 105.987 1.00 0.00 H new ATOM 0 HA ILE A 20 -61.186 23.720 106.331 1.00 0.00 H new ATOM 0 HB ILE A 20 -59.674 22.718 104.917 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -59.755 20.344 105.875 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -60.203 21.031 107.423 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -57.682 21.428 105.652 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -57.492 23.189 105.827 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -57.822 22.182 107.258 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -62.199 20.234 106.209 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -62.262 22.001 106.414 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -61.808 21.303 104.841 1.00 0.00 H new ATOM 328 N ASP A 21 -61.345 23.895 108.811 1.00 0.00 N ATOM 329 CA ASP A 21 -61.515 24.154 110.241 1.00 0.00 C ATOM 330 C ASP A 21 -62.193 22.967 110.961 1.00 0.00 C ATOM 331 O ASP A 21 -62.124 22.848 112.186 1.00 0.00 O ATOM 332 CB ASP A 21 -62.264 25.490 110.357 1.00 0.00 C ATOM 333 CG ASP A 21 -62.034 26.207 111.685 1.00 0.00 C ATOM 334 OD1 ASP A 21 -62.833 25.966 112.617 1.00 0.00 O ATOM 335 OD2 ASP A 21 -61.087 27.028 111.732 1.00 0.00 O ATOM 0 H ASP A 21 -62.221 23.944 108.291 1.00 0.00 H new ATOM 0 HA ASP A 21 -60.558 24.243 110.756 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -61.952 26.144 109.542 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -63.332 25.310 110.231 1.00 0.00 H new ATOM 340 N LYS A 22 -62.782 22.038 110.192 1.00 0.00 N ATOM 341 CA LYS A 22 -62.875 20.600 110.481 1.00 0.00 C ATOM 342 C LYS A 22 -62.984 19.815 109.164 1.00 0.00 C ATOM 343 O LYS A 22 -63.725 20.221 108.266 1.00 0.00 O ATOM 344 CB LYS A 22 -64.071 20.277 111.396 1.00 0.00 C ATOM 345 CG LYS A 22 -63.917 18.891 112.042 1.00 0.00 C ATOM 346 CD LYS A 22 -65.200 18.350 112.691 1.00 0.00 C ATOM 347 CE LYS A 22 -66.308 17.947 111.704 1.00 0.00 C ATOM 348 NZ LYS A 22 -65.869 16.907 110.746 1.00 0.00 N ATOM 0 H LYS A 22 -63.228 22.282 109.308 1.00 0.00 H new ATOM 0 HA LYS A 22 -61.970 20.302 111.011 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -64.153 21.037 112.173 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -64.994 20.311 110.818 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -63.582 18.184 111.283 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -63.134 18.941 112.799 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -64.943 17.483 113.300 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -65.595 19.108 113.367 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -67.170 17.581 112.262 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -66.636 18.828 111.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -66.660 16.261 110.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -65.561 17.358 109.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -65.077 16.371 111.155 1.00 0.00 H new ATOM 362 N GLU A 23 -62.269 18.687 109.108 1.00 0.00 N ATOM 363 CA GLU A 23 -62.275 17.651 108.063 1.00 0.00 C ATOM 364 C GLU A 23 -63.675 17.129 107.691 1.00 0.00 C ATOM 365 O GLU A 23 -64.654 17.360 108.406 1.00 0.00 O ATOM 366 CB GLU A 23 -61.329 16.503 108.487 1.00 0.00 C ATOM 367 CG GLU A 23 -61.377 16.018 109.954 1.00 0.00 C ATOM 368 CD GLU A 23 -62.616 15.187 110.314 1.00 0.00 C ATOM 369 OE1 GLU A 23 -62.635 13.990 109.957 1.00 0.00 O ATOM 370 OE2 GLU A 23 -63.538 15.732 110.964 1.00 0.00 O ATOM 0 H GLU A 23 -61.615 18.453 109.855 1.00 0.00 H new ATOM 0 HA GLU A 23 -61.913 18.116 107.146 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -61.538 15.646 107.847 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -60.307 16.818 108.274 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -60.486 15.423 110.155 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -61.335 16.887 110.611 1.00 0.00 H new ATOM 377 N MET A 24 -63.781 16.419 106.563 1.00 0.00 N ATOM 378 CA MET A 24 -65.057 15.873 106.084 1.00 0.00 C ATOM 379 C MET A 24 -65.595 14.707 106.932 1.00 0.00 C ATOM 380 O MET A 24 -64.877 13.754 107.243 1.00 0.00 O ATOM 381 CB MET A 24 -64.907 15.438 104.623 1.00 0.00 C ATOM 382 CG MET A 24 -65.325 16.565 103.691 1.00 0.00 C ATOM 383 SD MET A 24 -64.950 16.272 101.952 1.00 0.00 S ATOM 384 CE MET A 24 -63.209 16.773 101.954 1.00 0.00 C ATOM 0 H MET A 24 -62.988 16.207 105.957 1.00 0.00 H new ATOM 0 HA MET A 24 -65.793 16.672 106.175 1.00 0.00 H new ATOM 0 HB2 MET A 24 -63.873 15.157 104.424 1.00 0.00 H new ATOM 0 HB3 MET A 24 -65.518 14.556 104.435 1.00 0.00 H new ATOM 0 HG2 MET A 24 -66.398 16.728 103.796 1.00 0.00 H new ATOM 0 HG3 MET A 24 -64.830 17.484 104.007 1.00 0.00 H new ATOM 0 HE1 MET A 24 -62.670 16.220 101.185 1.00 0.00 H new ATOM 0 HE2 MET A 24 -63.138 17.841 101.750 1.00 0.00 H new ATOM 0 HE3 MET A 24 -62.770 16.560 102.929 1.00 0.00 H new ATOM 394 N ALA A 25 -66.898 14.750 107.238 1.00 0.00 N ATOM 395 CA ALA A 25 -67.636 13.695 107.938 1.00 0.00 C ATOM 396 C ALA A 25 -68.944 13.345 107.205 1.00 0.00 C ATOM 397 O ALA A 25 -69.800 14.212 107.028 1.00 0.00 O ATOM 398 CB ALA A 25 -67.893 14.155 109.378 1.00 0.00 C ATOM 0 H ALA A 25 -67.486 15.548 106.996 1.00 0.00 H new ATOM 0 HA ALA A 25 -67.043 12.780 107.955 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -68.442 13.381 109.915 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -66.941 14.337 109.877 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -68.479 15.074 109.367 1.00 0.00 H new ATOM 404 N GLU A 26 -69.094 12.088 106.761 1.00 0.00 N ATOM 405 CA GLU A 26 -70.283 11.634 106.024 1.00 0.00 C ATOM 406 C GLU A 26 -71.527 11.444 106.905 1.00 0.00 C ATOM 407 O GLU A 26 -71.434 11.269 108.120 1.00 0.00 O ATOM 408 CB GLU A 26 -69.985 10.349 105.226 1.00 0.00 C ATOM 409 CG GLU A 26 -70.427 10.503 103.760 1.00 0.00 C ATOM 410 CD GLU A 26 -69.906 9.390 102.859 1.00 0.00 C ATOM 411 OE1 GLU A 26 -68.670 9.270 102.689 1.00 0.00 O ATOM 412 OE2 GLU A 26 -70.726 8.596 102.354 1.00 0.00 O ATOM 0 H GLU A 26 -68.395 11.358 106.903 1.00 0.00 H new ATOM 0 HA GLU A 26 -70.522 12.441 105.331 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -68.918 10.128 105.268 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -70.503 9.505 105.680 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -71.516 10.519 103.715 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -70.078 11.463 103.380 1.00 0.00 H new ATOM 419 N THR A 27 -72.697 11.425 106.263 1.00 0.00 N ATOM 420 CA THR A 27 -74.017 11.327 106.894 1.00 0.00 C ATOM 421 C THR A 27 -74.751 10.036 106.496 1.00 0.00 C ATOM 422 O THR A 27 -74.392 9.352 105.531 1.00 0.00 O ATOM 423 CB THR A 27 -74.873 12.550 106.510 1.00 0.00 C ATOM 424 OG1 THR A 27 -75.202 12.457 105.147 1.00 0.00 O ATOM 425 CG2 THR A 27 -74.200 13.901 106.765 1.00 0.00 C ATOM 0 H THR A 27 -72.754 11.480 105.246 1.00 0.00 H new ATOM 0 HA THR A 27 -73.865 11.303 107.973 1.00 0.00 H new ATOM 0 HB THR A 27 -75.754 12.523 107.152 1.00 0.00 H new ATOM 0 HG1 THR A 27 -74.881 13.255 104.678 1.00 0.00 H new ATOM 0 HG21 THR A 27 -74.873 14.705 106.466 1.00 0.00 H new ATOM 0 HG22 THR A 27 -73.968 13.997 107.826 1.00 0.00 H new ATOM 0 HG23 THR A 27 -73.279 13.964 106.185 1.00 0.00 H new ATOM 433 N GLN A 28 -75.846 9.732 107.203 1.00 0.00 N ATOM 434 CA GLN A 28 -76.839 8.727 106.797 1.00 0.00 C ATOM 435 C GLN A 28 -77.652 9.168 105.564 1.00 0.00 C ATOM 436 O GLN A 28 -78.077 8.322 104.782 1.00 0.00 O ATOM 437 CB GLN A 28 -77.758 8.330 107.975 1.00 0.00 C ATOM 438 CG GLN A 28 -78.077 9.397 109.044 1.00 0.00 C ATOM 439 CD GLN A 28 -78.637 10.699 108.479 1.00 0.00 C ATOM 440 OE1 GLN A 28 -77.897 11.544 107.998 1.00 0.00 O ATOM 441 NE2 GLN A 28 -79.938 10.907 108.510 1.00 0.00 N ATOM 0 H GLN A 28 -76.072 10.185 108.089 1.00 0.00 H new ATOM 0 HA GLN A 28 -76.282 7.838 106.500 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -78.704 7.984 107.557 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -77.302 7.478 108.480 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -78.795 8.983 109.752 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -77.168 9.618 109.604 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -80.558 10.203 108.911 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -80.325 11.772 108.133 1.00 0.00 H new ATOM 450 N HIS A 29 -77.794 10.480 105.337 1.00 0.00 N ATOM 451 CA HIS A 29 -78.269 11.087 104.089 1.00 0.00 C ATOM 452 C HIS A 29 -77.294 10.854 102.908 1.00 0.00 C ATOM 453 O HIS A 29 -77.650 11.093 101.757 1.00 0.00 O ATOM 454 CB HIS A 29 -78.528 12.580 104.380 1.00 0.00 C ATOM 455 CG HIS A 29 -79.093 13.423 103.260 1.00 0.00 C ATOM 456 ND1 HIS A 29 -78.850 14.769 103.084 1.00 0.00 N ATOM 457 CD2 HIS A 29 -79.984 13.036 102.295 1.00 0.00 C ATOM 458 CE1 HIS A 29 -79.575 15.177 102.030 1.00 0.00 C ATOM 459 NE2 HIS A 29 -80.282 14.159 101.517 1.00 0.00 N ATOM 0 H HIS A 29 -77.571 11.176 106.049 1.00 0.00 H new ATOM 0 HA HIS A 29 -79.194 10.612 103.763 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -79.212 12.644 105.226 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -77.587 13.029 104.696 1.00 0.00 H new ATOM 0 HD1 HIS A 29 -78.232 15.349 103.651 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -80.385 12.042 102.159 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -79.587 16.187 101.647 1.00 0.00 H new ATOM 467 N GLY A 30 -76.075 10.349 103.163 1.00 0.00 N ATOM 468 CA GLY A 30 -75.072 10.030 102.147 1.00 0.00 C ATOM 469 C GLY A 30 -74.304 11.247 101.628 1.00 0.00 C ATOM 470 O GLY A 30 -73.528 11.113 100.683 1.00 0.00 O ATOM 0 H GLY A 30 -75.757 10.148 104.111 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -74.362 9.316 102.564 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -75.564 9.538 101.308 1.00 0.00 H new ATOM 474 N THR A 31 -74.541 12.423 102.206 1.00 0.00 N ATOM 475 CA THR A 31 -73.782 13.670 102.057 1.00 0.00 C ATOM 476 C THR A 31 -72.552 13.664 102.972 1.00 0.00 C ATOM 477 O THR A 31 -72.428 12.805 103.840 1.00 0.00 O ATOM 478 CB THR A 31 -74.689 14.850 102.449 1.00 0.00 C ATOM 479 OG1 THR A 31 -75.250 14.611 103.728 1.00 0.00 O ATOM 480 CG2 THR A 31 -75.821 15.032 101.437 1.00 0.00 C ATOM 0 H THR A 31 -75.330 12.541 102.841 1.00 0.00 H new ATOM 0 HA THR A 31 -73.452 13.764 101.023 1.00 0.00 H new ATOM 0 HB THR A 31 -74.082 15.756 102.464 1.00 0.00 H new ATOM 0 HG1 THR A 31 -76.149 14.999 103.768 1.00 0.00 H new ATOM 0 HG21 THR A 31 -76.447 15.872 101.738 1.00 0.00 H new ATOM 0 HG22 THR A 31 -75.400 15.228 100.451 1.00 0.00 H new ATOM 0 HG23 THR A 31 -76.425 14.125 101.399 1.00 0.00 H new ATOM 488 N THR A 32 -71.655 14.642 102.832 1.00 0.00 N ATOM 489 CA THR A 32 -70.551 14.890 103.766 1.00 0.00 C ATOM 490 C THR A 32 -70.571 16.329 104.266 1.00 0.00 C ATOM 491 O THR A 32 -71.014 17.234 103.561 1.00 0.00 O ATOM 492 CB THR A 32 -69.201 14.482 103.150 1.00 0.00 C ATOM 493 OG1 THR A 32 -68.221 14.426 104.158 1.00 0.00 O ATOM 494 CG2 THR A 32 -68.693 15.410 102.047 1.00 0.00 C ATOM 0 H THR A 32 -71.675 15.298 102.051 1.00 0.00 H new ATOM 0 HA THR A 32 -70.689 14.258 104.643 1.00 0.00 H new ATOM 0 HB THR A 32 -69.378 13.510 102.689 1.00 0.00 H new ATOM 0 HG1 THR A 32 -67.718 13.589 104.079 1.00 0.00 H new ATOM 0 HG21 THR A 32 -67.737 15.043 101.674 1.00 0.00 H new ATOM 0 HG22 THR A 32 -69.415 15.435 101.231 1.00 0.00 H new ATOM 0 HG23 THR A 32 -68.564 16.415 102.448 1.00 0.00 H new ATOM 502 N VAL A 33 -70.113 16.534 105.502 1.00 0.00 N ATOM 503 CA VAL A 33 -70.134 17.818 106.201 1.00 0.00 C ATOM 504 C VAL A 33 -68.699 18.285 106.421 1.00 0.00 C ATOM 505 O VAL A 33 -67.913 17.596 107.075 1.00 0.00 O ATOM 506 CB VAL A 33 -70.924 17.747 107.524 1.00 0.00 C ATOM 507 CG1 VAL A 33 -71.128 19.159 108.097 1.00 0.00 C ATOM 508 CG2 VAL A 33 -72.311 17.113 107.339 1.00 0.00 C ATOM 0 H VAL A 33 -69.704 15.786 106.062 1.00 0.00 H new ATOM 0 HA VAL A 33 -70.657 18.547 105.583 1.00 0.00 H new ATOM 0 HB VAL A 33 -70.337 17.128 108.203 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -71.687 19.096 109.031 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -70.158 19.619 108.285 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -71.684 19.765 107.382 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -72.829 17.085 108.298 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -72.890 17.705 106.631 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -72.199 16.098 106.957 1.00 0.00 H new ATOM 518 N VAL A 34 -68.372 19.452 105.860 1.00 0.00 N ATOM 519 CA VAL A 34 -67.075 20.137 105.997 1.00 0.00 C ATOM 520 C VAL A 34 -67.265 21.359 106.898 1.00 0.00 C ATOM 521 O VAL A 34 -68.315 21.990 106.808 1.00 0.00 O ATOM 522 CB VAL A 34 -66.536 20.610 104.621 1.00 0.00 C ATOM 523 CG1 VAL A 34 -65.003 20.591 104.641 1.00 0.00 C ATOM 524 CG2 VAL A 34 -67.037 19.799 103.413 1.00 0.00 C ATOM 0 H VAL A 34 -69.027 19.970 105.274 1.00 0.00 H new ATOM 0 HA VAL A 34 -66.356 19.438 106.425 1.00 0.00 H new ATOM 0 HB VAL A 34 -66.926 21.618 104.484 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -64.622 20.923 103.675 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -64.641 21.259 105.423 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -64.654 19.578 104.839 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -66.606 20.205 102.498 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -66.737 18.757 103.524 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -68.124 19.859 103.360 1.00 0.00 H new ATOM 534 N LYS A 35 -66.274 21.754 107.714 1.00 0.00 N ATOM 535 CA LYS A 35 -66.322 23.039 108.439 1.00 0.00 C ATOM 536 C LYS A 35 -65.206 23.952 107.941 1.00 0.00 C ATOM 537 O LYS A 35 -64.027 23.628 108.089 1.00 0.00 O ATOM 538 CB LYS A 35 -66.291 22.832 109.964 1.00 0.00 C ATOM 539 CG LYS A 35 -66.854 24.026 110.771 1.00 0.00 C ATOM 540 CD LYS A 35 -65.923 24.565 111.872 1.00 0.00 C ATOM 541 CE LYS A 35 -65.420 23.501 112.853 1.00 0.00 C ATOM 542 NZ LYS A 35 -64.204 23.947 113.576 1.00 0.00 N ATOM 0 H LYS A 35 -65.432 21.206 107.889 1.00 0.00 H new ATOM 0 HA LYS A 35 -67.272 23.531 108.229 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -66.863 21.938 110.211 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -65.262 22.649 110.275 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -67.082 24.837 110.079 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -67.796 23.724 111.229 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -65.064 25.044 111.402 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -66.451 25.337 112.432 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -66.206 23.270 113.572 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -65.203 22.581 112.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -63.413 23.311 113.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -63.963 24.916 113.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -64.382 23.927 114.600 1.00 0.00 H new ATOM 556 N VAL A 36 -65.583 25.076 107.331 1.00 0.00 N ATOM 557 CA VAL A 36 -64.638 26.109 106.885 1.00 0.00 C ATOM 558 C VAL A 36 -64.490 27.181 107.966 1.00 0.00 C ATOM 559 O VAL A 36 -65.359 27.328 108.827 1.00 0.00 O ATOM 560 CB VAL A 36 -65.044 26.744 105.528 1.00 0.00 C ATOM 561 CG1 VAL A 36 -65.626 25.708 104.560 1.00 0.00 C ATOM 562 CG2 VAL A 36 -66.045 27.901 105.649 1.00 0.00 C ATOM 0 H VAL A 36 -66.558 25.300 107.130 1.00 0.00 H new ATOM 0 HA VAL A 36 -63.675 25.624 106.723 1.00 0.00 H new ATOM 0 HB VAL A 36 -64.109 27.146 105.138 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -65.896 26.196 103.624 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -64.883 24.935 104.365 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -66.513 25.255 105.002 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -66.276 28.288 104.656 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -66.960 27.543 106.120 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -65.611 28.695 106.256 1.00 0.00 H new ATOM 572 N LYS A 37 -63.438 27.990 107.837 1.00 0.00 N ATOM 573 CA LYS A 37 -63.301 29.335 108.412 1.00 0.00 C ATOM 574 C LYS A 37 -62.731 30.244 107.320 1.00 0.00 C ATOM 575 O LYS A 37 -61.998 29.743 106.468 1.00 0.00 O ATOM 576 CB LYS A 37 -62.383 29.231 109.637 1.00 0.00 C ATOM 577 CG LYS A 37 -62.280 30.503 110.492 1.00 0.00 C ATOM 578 CD LYS A 37 -60.861 31.097 110.533 1.00 0.00 C ATOM 579 CE LYS A 37 -59.926 30.458 111.572 1.00 0.00 C ATOM 580 NZ LYS A 37 -59.495 29.089 111.205 1.00 0.00 N ATOM 0 H LYS A 37 -62.615 27.714 107.302 1.00 0.00 H new ATOM 0 HA LYS A 37 -64.250 29.756 108.743 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -62.739 28.417 110.268 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -61.383 28.959 109.299 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -62.968 31.252 110.101 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -62.601 30.276 111.509 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -60.410 30.993 109.546 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -60.935 32.165 110.739 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -59.045 31.088 111.695 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -60.433 30.426 112.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -58.841 28.726 111.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -60.327 28.467 111.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -59.015 29.112 110.283 1.00 0.00 H new ATOM 594 N TYR A 38 -63.038 31.543 107.292 1.00 0.00 N ATOM 595 CA TYR A 38 -62.407 32.438 106.309 1.00 0.00 C ATOM 596 C TYR A 38 -61.060 32.968 106.829 1.00 0.00 C ATOM 597 O TYR A 38 -60.806 32.971 108.028 1.00 0.00 O ATOM 598 CB TYR A 38 -63.398 33.533 105.877 1.00 0.00 C ATOM 599 CG TYR A 38 -62.858 34.523 104.854 1.00 0.00 C ATOM 600 CD1 TYR A 38 -62.247 34.060 103.670 1.00 0.00 C ATOM 601 CD2 TYR A 38 -62.960 35.911 105.076 1.00 0.00 C ATOM 602 CE1 TYR A 38 -61.749 34.959 102.715 1.00 0.00 C ATOM 603 CE2 TYR A 38 -62.444 36.820 104.135 1.00 0.00 C ATOM 604 CZ TYR A 38 -61.849 36.346 102.948 1.00 0.00 C ATOM 605 OH TYR A 38 -61.367 37.227 102.035 1.00 0.00 O ATOM 0 H TYR A 38 -63.703 31.994 107.921 1.00 0.00 H new ATOM 0 HA TYR A 38 -62.162 31.880 105.405 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -64.286 33.055 105.464 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -63.715 34.085 106.762 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -62.161 32.998 103.496 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -63.437 36.278 105.973 1.00 0.00 H new ATOM 0 HE1 TYR A 38 -61.292 34.591 101.808 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -62.504 37.882 104.322 1.00 0.00 H new ATOM 0 HH TYR A 38 -62.052 37.899 101.836 1.00 0.00 H new ATOM 615 N GLU A 39 -60.170 33.403 105.933 1.00 0.00 N ATOM 616 CA GLU A 39 -58.879 34.001 106.292 1.00 0.00 C ATOM 617 C GLU A 39 -58.666 35.302 105.517 1.00 0.00 C ATOM 618 O GLU A 39 -58.601 36.363 106.140 1.00 0.00 O ATOM 619 CB GLU A 39 -57.725 33.005 106.062 1.00 0.00 C ATOM 620 CG GLU A 39 -57.645 31.922 107.148 1.00 0.00 C ATOM 621 CD GLU A 39 -56.615 30.838 106.812 1.00 0.00 C ATOM 622 OE1 GLU A 39 -55.553 31.141 106.230 1.00 0.00 O ATOM 623 OE2 GLU A 39 -56.898 29.643 107.063 1.00 0.00 O ATOM 0 H GLU A 39 -60.326 33.350 104.926 1.00 0.00 H new ATOM 0 HA GLU A 39 -58.888 34.240 107.355 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -57.851 32.529 105.090 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -56.782 33.551 106.030 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -57.386 32.384 108.101 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -58.625 31.463 107.273 1.00 0.00 H new ATOM 630 N GLY A 40 -58.589 35.191 104.182 1.00 0.00 N ATOM 631 CA GLY A 40 -58.152 36.168 103.182 1.00 0.00 C ATOM 632 C GLY A 40 -58.052 37.633 103.616 1.00 0.00 C ATOM 633 O GLY A 40 -56.948 38.153 103.749 1.00 0.00 O ATOM 0 H GLY A 40 -58.862 34.318 103.731 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -57.173 35.859 102.816 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -58.839 36.114 102.338 1.00 0.00 H new ATOM 637 N ALA A 41 -59.199 38.310 103.744 1.00 0.00 N ATOM 638 CA ALA A 41 -59.292 39.772 103.776 1.00 0.00 C ATOM 639 C ALA A 41 -60.133 40.333 104.939 1.00 0.00 C ATOM 640 O ALA A 41 -60.556 41.488 104.882 1.00 0.00 O ATOM 641 CB ALA A 41 -59.822 40.232 102.410 1.00 0.00 C ATOM 0 H ALA A 41 -60.104 37.848 103.830 1.00 0.00 H new ATOM 0 HA ALA A 41 -58.297 40.174 103.964 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -59.904 41.319 102.399 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -59.135 39.912 101.627 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -60.804 39.792 102.234 1.00 0.00 H new ATOM 647 N GLY A 42 -60.447 39.541 105.974 1.00 0.00 N ATOM 648 CA GLY A 42 -61.248 39.986 107.126 1.00 0.00 C ATOM 649 C GLY A 42 -62.757 40.022 106.854 1.00 0.00 C ATOM 650 O GLY A 42 -63.550 39.596 107.691 1.00 0.00 O ATOM 0 H GLY A 42 -60.151 38.567 106.037 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -61.056 39.322 107.969 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -60.918 40.981 107.423 1.00 0.00 H new ATOM 654 N ALA A 43 -63.133 40.548 105.687 1.00 0.00 N ATOM 655 CA ALA A 43 -64.482 40.854 105.218 1.00 0.00 C ATOM 656 C ALA A 43 -65.421 39.627 105.058 1.00 0.00 C ATOM 657 O ALA A 43 -64.973 38.482 105.145 1.00 0.00 O ATOM 658 CB ALA A 43 -64.289 41.602 103.891 1.00 0.00 C ATOM 0 H ALA A 43 -62.436 40.792 104.984 1.00 0.00 H new ATOM 0 HA ALA A 43 -64.999 41.450 105.970 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -65.262 41.866 103.477 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -63.711 42.509 104.066 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -63.757 40.963 103.187 1.00 0.00 H new ATOM 664 N PRO A 44 -66.735 39.841 104.822 1.00 0.00 N ATOM 665 CA PRO A 44 -67.681 38.774 104.488 1.00 0.00 C ATOM 666 C PRO A 44 -67.414 38.119 103.121 1.00 0.00 C ATOM 667 O PRO A 44 -66.787 38.709 102.241 1.00 0.00 O ATOM 668 CB PRO A 44 -69.073 39.425 104.473 1.00 0.00 C ATOM 669 CG PRO A 44 -68.883 40.795 105.120 1.00 0.00 C ATOM 670 CD PRO A 44 -67.424 41.122 104.847 1.00 0.00 C ATOM 0 HA PRO A 44 -67.586 37.976 105.224 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -69.452 39.520 103.455 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -69.794 38.825 105.027 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -69.549 41.540 104.684 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -69.094 40.766 106.189 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -67.311 41.647 103.898 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -67.016 41.772 105.621 1.00 0.00 H new ATOM 678 N CYS A 45 -68.002 36.937 102.912 1.00 0.00 N ATOM 679 CA CYS A 45 -67.998 36.178 101.661 1.00 0.00 C ATOM 680 C CYS A 45 -69.328 35.436 101.479 1.00 0.00 C ATOM 681 O CYS A 45 -69.867 34.931 102.461 1.00 0.00 O ATOM 682 CB CYS A 45 -66.897 35.105 101.732 1.00 0.00 C ATOM 683 SG CYS A 45 -65.223 35.667 102.115 1.00 0.00 S ATOM 0 H CYS A 45 -68.520 36.461 103.650 1.00 0.00 H new ATOM 0 HA CYS A 45 -67.836 36.874 100.838 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -67.188 34.371 102.484 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -66.869 34.586 100.774 1.00 0.00 H new ATOM 688 N LYS A 46 -69.753 35.191 100.230 1.00 0.00 N ATOM 689 CA LYS A 46 -70.270 33.860 99.872 1.00 0.00 C ATOM 690 C LYS A 46 -69.065 33.030 99.419 1.00 0.00 C ATOM 691 O LYS A 46 -68.259 33.522 98.624 1.00 0.00 O ATOM 692 CB LYS A 46 -71.465 33.915 98.897 1.00 0.00 C ATOM 693 CG LYS A 46 -71.231 33.425 97.457 1.00 0.00 C ATOM 694 CD LYS A 46 -72.571 33.387 96.710 1.00 0.00 C ATOM 695 CE LYS A 46 -72.431 32.795 95.303 1.00 0.00 C ATOM 696 NZ LYS A 46 -73.556 33.231 94.444 1.00 0.00 N ATOM 0 H LYS A 46 -69.751 35.873 99.471 1.00 0.00 H new ATOM 0 HA LYS A 46 -70.725 33.362 100.728 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -72.276 33.325 99.325 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -71.812 34.947 98.849 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -70.534 34.088 96.944 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -70.779 32.433 97.467 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -73.287 32.797 97.281 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -72.975 34.397 96.639 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -71.485 33.110 94.862 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -72.410 31.707 95.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -73.447 32.822 93.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -74.454 32.909 94.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -73.558 34.269 94.375 1.00 0.00 H new ATOM 710 N VAL A 47 -68.863 31.852 100.016 1.00 0.00 N ATOM 711 CA VAL A 47 -67.598 31.115 99.867 1.00 0.00 C ATOM 712 C VAL A 47 -67.650 30.249 98.599 1.00 0.00 C ATOM 713 O VAL A 47 -68.639 29.544 98.395 1.00 0.00 O ATOM 714 CB VAL A 47 -67.116 30.374 101.143 1.00 0.00 C ATOM 715 CG1 VAL A 47 -67.851 30.763 102.433 1.00 0.00 C ATOM 716 CG2 VAL A 47 -67.016 28.852 101.072 1.00 0.00 C ATOM 0 H VAL A 47 -69.554 31.387 100.605 1.00 0.00 H new ATOM 0 HA VAL A 47 -66.805 31.850 99.734 1.00 0.00 H new ATOM 0 HB VAL A 47 -66.094 30.750 101.183 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -67.445 30.193 103.269 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -67.717 31.828 102.621 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -68.913 30.544 102.327 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -66.668 28.465 102.030 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -67.997 28.433 100.846 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -66.312 28.570 100.289 1.00 0.00 H new ATOM 726 N PRO A 48 -66.636 30.306 97.714 1.00 0.00 N ATOM 727 CA PRO A 48 -66.624 29.497 96.503 1.00 0.00 C ATOM 728 C PRO A 48 -66.356 28.034 96.879 1.00 0.00 C ATOM 729 O PRO A 48 -65.259 27.719 97.339 1.00 0.00 O ATOM 730 CB PRO A 48 -65.526 30.081 95.602 1.00 0.00 C ATOM 731 CG PRO A 48 -64.853 31.182 96.426 1.00 0.00 C ATOM 732 CD PRO A 48 -65.358 30.990 97.850 1.00 0.00 C ATOM 0 HA PRO A 48 -67.577 29.516 95.974 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -64.808 29.314 95.314 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -65.949 30.484 94.682 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -63.767 31.099 96.380 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -65.113 32.170 96.047 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -64.657 30.400 98.440 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -65.476 31.947 98.358 1.00 0.00 H new ATOM 740 N ILE A 49 -67.353 27.154 96.708 1.00 0.00 N ATOM 741 CA ILE A 49 -67.201 25.706 96.897 1.00 0.00 C ATOM 742 C ILE A 49 -67.566 24.960 95.624 1.00 0.00 C ATOM 743 O ILE A 49 -68.647 25.148 95.068 1.00 0.00 O ATOM 744 CB ILE A 49 -67.987 25.159 98.112 1.00 0.00 C ATOM 745 CG1 ILE A 49 -67.440 25.854 99.371 1.00 0.00 C ATOM 746 CG2 ILE A 49 -67.877 23.621 98.213 1.00 0.00 C ATOM 747 CD1 ILE A 49 -67.834 25.232 100.712 1.00 0.00 C ATOM 0 H ILE A 49 -68.295 27.431 96.432 1.00 0.00 H new ATOM 0 HA ILE A 49 -66.149 25.531 97.120 1.00 0.00 H new ATOM 0 HB ILE A 49 -69.050 25.375 98.000 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -66.352 25.870 99.308 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -67.775 26.891 99.363 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -68.441 23.272 99.078 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -68.282 23.167 97.308 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -66.830 23.338 98.324 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -67.390 25.807 101.524 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -68.919 25.241 100.812 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -67.474 24.204 100.756 1.00 0.00 H new ATOM 759 N GLU A 50 -66.681 24.044 95.234 1.00 0.00 N ATOM 760 CA GLU A 50 -66.961 23.008 94.249 1.00 0.00 C ATOM 761 C GLU A 50 -66.491 21.647 94.769 1.00 0.00 C ATOM 762 O GLU A 50 -65.700 21.550 95.709 1.00 0.00 O ATOM 763 CB GLU A 50 -66.244 23.292 92.920 1.00 0.00 C ATOM 764 CG GLU A 50 -66.393 24.718 92.368 1.00 0.00 C ATOM 765 CD GLU A 50 -65.641 24.854 91.043 1.00 0.00 C ATOM 766 OE1 GLU A 50 -64.523 24.309 90.916 1.00 0.00 O ATOM 767 OE2 GLU A 50 -66.178 25.448 90.084 1.00 0.00 O ATOM 0 H GLU A 50 -65.731 24.003 95.603 1.00 0.00 H new ATOM 0 HA GLU A 50 -68.038 23.000 94.081 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -65.182 23.083 93.050 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -66.617 22.593 92.172 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -67.448 24.950 92.221 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -66.006 25.437 93.090 1.00 0.00 H new ATOM 774 N ILE A 51 -66.895 20.593 94.058 1.00 0.00 N ATOM 775 CA ILE A 51 -66.150 19.340 94.003 1.00 0.00 C ATOM 776 C ILE A 51 -65.849 19.088 92.538 1.00 0.00 C ATOM 777 O ILE A 51 -66.785 19.038 91.736 1.00 0.00 O ATOM 778 CB ILE A 51 -66.919 18.156 94.613 1.00 0.00 C ATOM 779 CG1 ILE A 51 -67.462 18.526 96.005 1.00 0.00 C ATOM 780 CG2 ILE A 51 -65.980 16.939 94.643 1.00 0.00 C ATOM 781 CD1 ILE A 51 -67.958 17.329 96.821 1.00 0.00 C ATOM 0 H ILE A 51 -67.751 20.587 93.503 1.00 0.00 H new ATOM 0 HA ILE A 51 -65.241 19.426 94.598 1.00 0.00 H new ATOM 0 HB ILE A 51 -67.790 17.905 94.007 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -66.678 19.034 96.566 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -68.281 19.236 95.887 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -66.504 16.085 95.072 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -65.664 16.698 93.628 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -65.105 17.170 95.250 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -68.324 17.674 97.788 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -68.766 16.832 96.284 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -67.138 16.627 96.973 1.00 0.00 H new ATOM 793 N ARG A 52 -64.569 18.931 92.200 1.00 0.00 N ATOM 794 CA ARG A 52 -64.134 18.530 90.865 1.00 0.00 C ATOM 795 C ARG A 52 -63.740 17.047 90.859 1.00 0.00 C ATOM 796 O ARG A 52 -63.443 16.450 91.902 1.00 0.00 O ATOM 797 CB ARG A 52 -63.010 19.458 90.360 1.00 0.00 C ATOM 798 CG ARG A 52 -63.425 20.942 90.238 1.00 0.00 C ATOM 799 CD ARG A 52 -63.510 21.444 88.786 1.00 0.00 C ATOM 800 NE ARG A 52 -64.012 22.830 88.748 1.00 0.00 N ATOM 801 CZ ARG A 52 -64.234 23.633 87.717 1.00 0.00 C ATOM 802 NH1 ARG A 52 -63.966 23.313 86.474 1.00 0.00 N ATOM 803 NH2 ARG A 52 -64.766 24.812 87.914 1.00 0.00 N ATOM 0 H ARG A 52 -63.799 19.080 92.852 1.00 0.00 H new ATOM 0 HA ARG A 52 -64.961 18.639 90.164 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -62.160 19.384 91.038 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -62.672 19.105 89.386 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -64.394 21.080 90.718 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -62.709 21.556 90.784 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -62.526 21.394 88.319 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -64.170 20.796 88.209 1.00 0.00 H new ATOM 0 HE ARG A 52 -64.222 23.235 89.660 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -63.563 22.401 86.258 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -64.160 23.976 85.723 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -65.009 25.111 88.859 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -64.938 25.432 87.123 1.00 0.00 H new ATOM 817 N ASP A 53 -63.786 16.465 89.662 1.00 0.00 N ATOM 818 CA ASP A 53 -63.405 15.089 89.350 1.00 0.00 C ATOM 819 C ASP A 53 -61.944 14.764 89.708 1.00 0.00 C ATOM 820 O ASP A 53 -61.172 15.632 90.113 1.00 0.00 O ATOM 821 CB ASP A 53 -63.729 14.789 87.869 1.00 0.00 C ATOM 822 CG ASP A 53 -63.025 15.647 86.803 1.00 0.00 C ATOM 823 OD1 ASP A 53 -62.353 16.653 87.133 1.00 0.00 O ATOM 824 OD2 ASP A 53 -63.199 15.304 85.613 1.00 0.00 O ATOM 0 H ASP A 53 -64.109 16.970 88.837 1.00 0.00 H new ATOM 0 HA ASP A 53 -63.996 14.427 89.982 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -63.485 13.744 87.676 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -64.805 14.896 87.731 1.00 0.00 H new ATOM 829 N VAL A 54 -61.540 13.495 89.562 1.00 0.00 N ATOM 830 CA VAL A 54 -60.185 13.048 89.930 1.00 0.00 C ATOM 831 C VAL A 54 -59.079 13.812 89.190 1.00 0.00 C ATOM 832 O VAL A 54 -58.054 14.144 89.794 1.00 0.00 O ATOM 833 CB VAL A 54 -60.016 11.519 89.807 1.00 0.00 C ATOM 834 CG1 VAL A 54 -60.957 10.791 90.779 1.00 0.00 C ATOM 835 CG2 VAL A 54 -60.258 10.985 88.389 1.00 0.00 C ATOM 0 H VAL A 54 -62.134 12.754 89.190 1.00 0.00 H new ATOM 0 HA VAL A 54 -60.069 13.294 90.985 1.00 0.00 H new ATOM 0 HB VAL A 54 -58.974 11.319 90.058 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -60.823 9.714 90.677 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -60.726 11.090 91.801 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -61.990 11.051 90.549 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -60.122 9.904 88.379 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -61.275 11.225 88.078 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -59.550 11.446 87.701 1.00 0.00 H new ATOM 845 N ASN A 55 -59.338 14.166 87.925 1.00 0.00 N ATOM 846 CA ASN A 55 -58.517 15.022 87.066 1.00 0.00 C ATOM 847 C ASN A 55 -58.560 16.516 87.459 1.00 0.00 C ATOM 848 O ASN A 55 -57.684 17.272 87.042 1.00 0.00 O ATOM 849 CB ASN A 55 -59.032 14.890 85.625 1.00 0.00 C ATOM 850 CG ASN A 55 -58.791 13.570 84.917 1.00 0.00 C ATOM 851 OD1 ASN A 55 -58.419 12.559 85.494 1.00 0.00 O ATOM 852 ND2 ASN A 55 -59.026 13.568 83.621 1.00 0.00 N ATOM 0 H ASN A 55 -60.178 13.841 87.447 1.00 0.00 H new ATOM 0 HA ASN A 55 -57.484 14.691 87.175 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -60.106 15.077 85.632 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -58.574 15.680 85.030 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -58.898 12.712 83.081 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -59.336 14.422 83.158 1.00 0.00 H new ATOM 859 N LYS A 56 -59.549 16.935 88.264 1.00 0.00 N ATOM 860 CA LYS A 56 -59.754 18.282 88.826 1.00 0.00 C ATOM 861 C LYS A 56 -60.121 19.336 87.772 1.00 0.00 C ATOM 862 O LYS A 56 -59.890 20.528 87.957 1.00 0.00 O ATOM 863 CB LYS A 56 -58.592 18.670 89.767 1.00 0.00 C ATOM 864 CG LYS A 56 -58.395 17.576 90.831 1.00 0.00 C ATOM 865 CD LYS A 56 -57.241 17.815 91.815 1.00 0.00 C ATOM 866 CE LYS A 56 -56.217 16.663 91.817 1.00 0.00 C ATOM 867 NZ LYS A 56 -56.836 15.326 92.025 1.00 0.00 N ATOM 0 H LYS A 56 -60.283 16.293 88.563 1.00 0.00 H new ATOM 0 HA LYS A 56 -60.645 18.249 89.453 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -57.675 18.801 89.193 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -58.805 19.624 90.249 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -59.320 17.475 91.399 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -58.227 16.626 90.324 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -56.735 18.746 91.557 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -57.645 17.939 92.820 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -55.679 16.663 90.869 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -55.481 16.841 92.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -56.137 14.682 92.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -57.652 15.417 92.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -57.152 14.944 91.111 1.00 0.00 H new ATOM 881 N GLU A 57 -60.746 18.889 86.682 1.00 0.00 N ATOM 882 CA GLU A 57 -61.183 19.691 85.532 1.00 0.00 C ATOM 883 C GLU A 57 -62.694 19.955 85.562 1.00 0.00 C ATOM 884 O GLU A 57 -63.104 21.072 85.250 1.00 0.00 O ATOM 885 CB GLU A 57 -60.766 19.033 84.192 1.00 0.00 C ATOM 886 CG GLU A 57 -60.959 17.511 84.206 1.00 0.00 C ATOM 887 CD GLU A 57 -60.827 16.800 82.859 1.00 0.00 C ATOM 888 OE1 GLU A 57 -61.767 16.957 82.043 1.00 0.00 O ATOM 889 OE2 GLU A 57 -59.906 15.962 82.713 1.00 0.00 O ATOM 0 H GLU A 57 -60.975 17.902 86.569 1.00 0.00 H new ATOM 0 HA GLU A 57 -60.678 20.654 85.607 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -61.352 19.464 83.380 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -59.720 19.263 83.987 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -60.231 17.080 84.893 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -61.947 17.295 84.612 1.00 0.00 H new ATOM 896 N LYS A 58 -63.531 18.986 85.967 1.00 0.00 N ATOM 897 CA LYS A 58 -64.995 19.053 85.800 1.00 0.00 C ATOM 898 C LYS A 58 -65.721 18.886 87.131 1.00 0.00 C ATOM 899 O LYS A 58 -65.342 18.045 87.941 1.00 0.00 O ATOM 900 CB LYS A 58 -65.463 17.993 84.788 1.00 0.00 C ATOM 901 CG LYS A 58 -64.837 18.206 83.400 1.00 0.00 C ATOM 902 CD LYS A 58 -65.326 17.209 82.339 1.00 0.00 C ATOM 903 CE LYS A 58 -65.113 15.723 82.674 1.00 0.00 C ATOM 904 NZ LYS A 58 -63.705 15.407 83.003 1.00 0.00 N ATOM 0 H LYS A 58 -63.212 18.130 86.421 1.00 0.00 H new ATOM 0 HA LYS A 58 -65.244 20.042 85.416 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -65.201 17.001 85.155 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -66.549 18.026 84.705 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -65.059 19.219 83.063 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -63.753 18.129 83.485 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -66.390 17.376 82.172 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -64.818 17.427 81.400 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -65.749 15.450 83.516 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -65.429 15.115 81.826 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -63.564 14.377 82.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -63.076 15.865 82.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -63.484 15.757 83.957 1.00 0.00 H new ATOM 918 N VAL A 59 -66.756 19.703 87.356 1.00 0.00 N ATOM 919 CA VAL A 59 -67.569 19.703 88.582 1.00 0.00 C ATOM 920 C VAL A 59 -68.408 18.420 88.676 1.00 0.00 C ATOM 921 O VAL A 59 -69.049 18.025 87.705 1.00 0.00 O ATOM 922 CB VAL A 59 -68.469 20.958 88.649 1.00 0.00 C ATOM 923 CG1 VAL A 59 -69.350 20.973 89.908 1.00 0.00 C ATOM 924 CG2 VAL A 59 -67.619 22.240 88.662 1.00 0.00 C ATOM 0 H VAL A 59 -67.060 20.400 86.676 1.00 0.00 H new ATOM 0 HA VAL A 59 -66.893 19.731 89.437 1.00 0.00 H new ATOM 0 HB VAL A 59 -69.103 20.923 87.763 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -69.965 21.873 89.911 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -69.994 20.094 89.912 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -68.717 20.963 90.795 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -68.274 23.110 88.709 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -66.962 22.232 89.532 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -67.018 22.287 87.754 1.00 0.00 H new ATOM 934 N VAL A 60 -68.420 17.792 89.858 1.00 0.00 N ATOM 935 CA VAL A 60 -69.099 16.512 90.135 1.00 0.00 C ATOM 936 C VAL A 60 -69.974 16.512 91.397 1.00 0.00 C ATOM 937 O VAL A 60 -70.733 15.559 91.593 1.00 0.00 O ATOM 938 CB VAL A 60 -68.088 15.349 90.211 1.00 0.00 C ATOM 939 CG1 VAL A 60 -67.414 15.095 88.859 1.00 0.00 C ATOM 940 CG2 VAL A 60 -67.009 15.569 91.281 1.00 0.00 C ATOM 0 H VAL A 60 -67.943 18.170 90.677 1.00 0.00 H new ATOM 0 HA VAL A 60 -69.774 16.371 89.290 1.00 0.00 H new ATOM 0 HB VAL A 60 -68.672 14.473 90.493 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -66.709 14.269 88.953 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -68.171 14.843 88.117 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -66.881 15.992 88.544 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -66.326 14.719 91.289 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -66.453 16.479 91.056 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -67.481 15.665 92.259 1.00 0.00 H new ATOM 950 N GLY A 61 -69.921 17.556 92.235 1.00 0.00 N ATOM 951 CA GLY A 61 -70.643 17.625 93.513 1.00 0.00 C ATOM 952 C GLY A 61 -71.789 18.644 93.554 1.00 0.00 C ATOM 953 O GLY A 61 -71.897 19.505 92.684 1.00 0.00 O ATOM 0 H GLY A 61 -69.366 18.390 92.041 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -71.046 16.638 93.740 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -69.932 17.868 94.303 1.00 0.00 H new ATOM 957 N ARG A 62 -72.620 18.559 94.604 1.00 0.00 N ATOM 958 CA ARG A 62 -73.756 19.456 94.892 1.00 0.00 C ATOM 959 C ARG A 62 -73.701 19.938 96.346 1.00 0.00 C ATOM 960 O ARG A 62 -73.883 19.137 97.259 1.00 0.00 O ATOM 961 CB ARG A 62 -75.089 18.723 94.637 1.00 0.00 C ATOM 962 CG ARG A 62 -75.380 18.438 93.152 1.00 0.00 C ATOM 963 CD ARG A 62 -75.915 17.015 92.912 1.00 0.00 C ATOM 964 NE ARG A 62 -74.924 15.975 93.252 1.00 0.00 N ATOM 965 CZ ARG A 62 -73.779 15.700 92.652 1.00 0.00 C ATOM 966 NH1 ARG A 62 -73.372 16.294 91.560 1.00 0.00 N ATOM 967 NH2 ARG A 62 -72.983 14.814 93.180 1.00 0.00 N ATOM 0 H ARG A 62 -72.516 17.830 95.310 1.00 0.00 H new ATOM 0 HA ARG A 62 -73.690 20.320 94.231 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -75.081 17.779 95.182 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -75.903 19.321 95.047 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -76.107 19.162 92.783 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -74.467 18.581 92.574 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -76.815 16.863 93.507 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -76.203 16.910 91.866 1.00 0.00 H new ATOM 0 HE ARG A 62 -75.153 15.391 94.056 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -73.950 17.013 91.125 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -72.477 16.038 91.143 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -73.247 14.343 94.045 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -72.096 14.592 92.728 1.00 0.00 H new ATOM 981 N ILE A 63 -73.423 21.225 96.582 1.00 0.00 N ATOM 982 CA ILE A 63 -73.497 21.845 97.918 1.00 0.00 C ATOM 983 C ILE A 63 -74.962 21.893 98.381 1.00 0.00 C ATOM 984 O ILE A 63 -75.789 22.533 97.735 1.00 0.00 O ATOM 985 CB ILE A 63 -72.823 23.247 98.003 1.00 0.00 C ATOM 986 CG1 ILE A 63 -72.096 23.763 96.737 1.00 0.00 C ATOM 987 CG2 ILE A 63 -71.815 23.215 99.162 1.00 0.00 C ATOM 988 CD1 ILE A 63 -73.061 24.312 95.677 1.00 0.00 C ATOM 0 H ILE A 63 -73.138 21.874 95.849 1.00 0.00 H new ATOM 0 HA ILE A 63 -72.918 21.217 98.595 1.00 0.00 H new ATOM 0 HB ILE A 63 -73.648 23.946 98.143 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -71.393 24.546 97.021 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -71.511 22.952 96.304 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -71.326 24.186 99.246 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -72.337 22.990 100.092 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -71.066 22.447 98.971 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -72.494 24.659 94.813 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -73.748 23.524 95.368 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -73.628 25.143 96.096 1.00 0.00 H new ATOM 1000 N ILE A 64 -75.293 21.171 99.461 1.00 0.00 N ATOM 1001 CA ILE A 64 -76.677 20.931 99.904 1.00 0.00 C ATOM 1002 C ILE A 64 -77.127 21.964 100.942 1.00 0.00 C ATOM 1003 O ILE A 64 -78.259 22.438 100.891 1.00 0.00 O ATOM 1004 CB ILE A 64 -76.808 19.491 100.464 1.00 0.00 C ATOM 1005 CG1 ILE A 64 -76.384 18.406 99.448 1.00 0.00 C ATOM 1006 CG2 ILE A 64 -78.224 19.188 100.981 1.00 0.00 C ATOM 1007 CD1 ILE A 64 -77.081 18.460 98.080 1.00 0.00 C ATOM 0 H ILE A 64 -74.597 20.730 100.062 1.00 0.00 H new ATOM 0 HA ILE A 64 -77.334 21.038 99.041 1.00 0.00 H new ATOM 0 HB ILE A 64 -76.115 19.454 101.305 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -75.308 18.484 99.290 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -76.571 17.428 99.891 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -78.262 18.167 101.362 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -78.476 19.884 101.782 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -78.940 19.298 100.166 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -76.707 17.654 97.449 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -78.157 18.346 98.215 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -76.875 19.419 97.604 1.00 0.00 H new ATOM 1019 N SER A 65 -76.238 22.335 101.868 1.00 0.00 N ATOM 1020 CA SER A 65 -76.502 23.105 103.095 1.00 0.00 C ATOM 1021 C SER A 65 -77.018 24.551 102.940 1.00 0.00 C ATOM 1022 O SER A 65 -77.032 25.272 103.941 1.00 0.00 O ATOM 1023 CB SER A 65 -75.194 23.143 103.880 1.00 0.00 C ATOM 1024 OG SER A 65 -75.414 23.560 105.206 1.00 0.00 O ATOM 0 H SER A 65 -75.251 22.092 101.778 1.00 0.00 H new ATOM 0 HA SER A 65 -77.326 22.589 103.587 1.00 0.00 H new ATOM 0 HB2 SER A 65 -74.735 22.154 103.877 1.00 0.00 H new ATOM 0 HB3 SER A 65 -74.493 23.821 103.393 1.00 0.00 H new ATOM 0 HG SER A 65 -76.054 24.302 105.214 1.00 0.00 H new ATOM 1030 N SER A 66 -77.369 24.976 101.719 1.00 0.00 N ATOM 1031 CA SER A 66 -77.576 26.342 101.203 1.00 0.00 C ATOM 1032 C SER A 66 -76.313 26.829 100.470 1.00 0.00 C ATOM 1033 O SER A 66 -75.311 26.120 100.390 1.00 0.00 O ATOM 1034 CB SER A 66 -78.010 27.342 102.291 1.00 0.00 C ATOM 1035 OG SER A 66 -78.490 28.539 101.709 1.00 0.00 O ATOM 0 H SER A 66 -77.535 24.292 100.980 1.00 0.00 H new ATOM 0 HA SER A 66 -78.404 26.294 100.496 1.00 0.00 H new ATOM 0 HB2 SER A 66 -78.787 26.897 102.912 1.00 0.00 H new ATOM 0 HB3 SER A 66 -77.167 27.563 102.946 1.00 0.00 H new ATOM 0 HG SER A 66 -78.762 29.160 102.416 1.00 0.00 H new ATOM 1041 N THR A 67 -76.350 28.053 99.933 1.00 0.00 N ATOM 1042 CA THR A 67 -75.188 28.762 99.383 1.00 0.00 C ATOM 1043 C THR A 67 -74.183 29.062 100.507 1.00 0.00 C ATOM 1044 O THR A 67 -74.531 29.853 101.392 1.00 0.00 O ATOM 1045 CB THR A 67 -75.595 30.093 98.728 1.00 0.00 C ATOM 1046 OG1 THR A 67 -76.243 30.910 99.677 1.00 0.00 O ATOM 1047 CG2 THR A 67 -76.516 29.913 97.522 1.00 0.00 C ATOM 0 H THR A 67 -77.213 28.593 99.867 1.00 0.00 H new ATOM 0 HA THR A 67 -74.740 28.119 98.626 1.00 0.00 H new ATOM 0 HB THR A 67 -74.676 30.558 98.371 1.00 0.00 H new ATOM 0 HG1 THR A 67 -75.844 30.765 100.560 1.00 0.00 H new ATOM 0 HG21 THR A 67 -76.766 30.889 97.106 1.00 0.00 H new ATOM 0 HG22 THR A 67 -76.010 29.314 96.764 1.00 0.00 H new ATOM 0 HG23 THR A 67 -77.430 29.407 97.834 1.00 0.00 H new ATOM 1055 N PRO A 68 -72.967 28.483 100.502 1.00 0.00 N ATOM 1056 CA PRO A 68 -71.941 28.760 101.507 1.00 0.00 C ATOM 1057 C PRO A 68 -71.664 30.251 101.722 1.00 0.00 C ATOM 1058 O PRO A 68 -71.480 30.995 100.755 1.00 0.00 O ATOM 1059 CB PRO A 68 -70.682 28.085 100.971 1.00 0.00 C ATOM 1060 CG PRO A 68 -71.224 26.902 100.184 1.00 0.00 C ATOM 1061 CD PRO A 68 -72.466 27.506 99.540 1.00 0.00 C ATOM 0 HA PRO A 68 -72.270 28.391 102.478 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -70.104 28.758 100.338 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -70.024 27.763 101.778 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -70.511 26.542 99.442 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -71.466 26.057 100.829 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -72.224 27.980 98.589 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -73.213 26.740 99.333 1.00 0.00 H new ATOM 1069 N LEU A 69 -71.542 30.679 102.983 1.00 0.00 N ATOM 1070 CA LEU A 69 -71.114 32.035 103.324 1.00 0.00 C ATOM 1071 C LEU A 69 -70.221 32.101 104.571 1.00 0.00 C ATOM 1072 O LEU A 69 -70.120 31.139 105.334 1.00 0.00 O ATOM 1073 CB LEU A 69 -72.333 32.985 103.382 1.00 0.00 C ATOM 1074 CG LEU A 69 -73.179 32.973 104.671 1.00 0.00 C ATOM 1075 CD1 LEU A 69 -74.025 34.248 104.713 1.00 0.00 C ATOM 1076 CD2 LEU A 69 -74.117 31.767 104.752 1.00 0.00 C ATOM 0 H LEU A 69 -71.738 30.093 103.795 1.00 0.00 H new ATOM 0 HA LEU A 69 -70.465 32.386 102.522 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -71.976 34.002 103.223 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -72.989 32.743 102.546 1.00 0.00 H new ATOM 0 HG LEU A 69 -72.491 32.914 105.514 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -74.629 34.254 105.620 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -73.370 35.119 104.708 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -74.679 34.280 103.841 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -74.687 31.811 105.680 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -74.802 31.781 103.904 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -73.531 30.848 104.730 1.00 0.00 H new ATOM 1088 N ALA A 70 -69.594 33.264 104.756 1.00 0.00 N ATOM 1089 CA ALA A 70 -68.820 33.670 105.924 1.00 0.00 C ATOM 1090 C ALA A 70 -69.122 35.148 106.212 1.00 0.00 C ATOM 1091 O ALA A 70 -69.103 35.972 105.299 1.00 0.00 O ATOM 1092 CB ALA A 70 -67.327 33.445 105.646 1.00 0.00 C ATOM 0 H ALA A 70 -69.617 33.994 104.044 1.00 0.00 H new ATOM 0 HA ALA A 70 -69.090 33.078 106.799 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -66.745 33.747 106.517 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -67.150 32.389 105.440 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -67.024 34.038 104.783 1.00 0.00 H new ATOM 1098 N GLU A 71 -69.424 35.499 107.465 1.00 0.00 N ATOM 1099 CA GLU A 71 -69.830 36.861 107.834 1.00 0.00 C ATOM 1100 C GLU A 71 -68.643 37.802 108.107 1.00 0.00 C ATOM 1101 O GLU A 71 -68.835 39.023 108.078 1.00 0.00 O ATOM 1102 CB GLU A 71 -70.761 36.789 109.059 1.00 0.00 C ATOM 1103 CG GLU A 71 -72.150 36.238 108.711 1.00 0.00 C ATOM 1104 CD GLU A 71 -72.919 37.210 107.819 1.00 0.00 C ATOM 1105 OE1 GLU A 71 -73.227 38.334 108.280 1.00 0.00 O ATOM 1106 OE2 GLU A 71 -73.199 36.880 106.647 1.00 0.00 O ATOM 0 H GLU A 71 -69.395 34.850 108.251 1.00 0.00 H new ATOM 0 HA GLU A 71 -70.355 37.290 106.980 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -70.304 36.158 109.822 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -70.866 37.785 109.490 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -72.048 35.278 108.205 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -72.713 36.057 109.627 1.00 0.00 H new ATOM 1113 N ASN A 72 -67.455 37.233 108.356 1.00 0.00 N ATOM 1114 CA ASN A 72 -66.118 37.808 108.563 1.00 0.00 C ATOM 1115 C ASN A 72 -65.082 36.657 108.584 1.00 0.00 C ATOM 1116 O ASN A 72 -65.476 35.494 108.663 1.00 0.00 O ATOM 1117 CB ASN A 72 -66.091 38.579 109.908 1.00 0.00 C ATOM 1118 CG ASN A 72 -65.972 40.087 109.738 1.00 0.00 C ATOM 1119 OD1 ASN A 72 -65.121 40.732 110.326 1.00 0.00 O ATOM 1120 ND2 ASN A 72 -66.845 40.696 108.966 1.00 0.00 N ATOM 0 H ASN A 72 -67.404 36.217 108.426 1.00 0.00 H new ATOM 0 HA ASN A 72 -65.875 38.501 107.758 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -67.000 38.354 110.465 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -65.253 38.221 110.507 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -66.811 41.710 108.858 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -67.556 40.155 108.475 1.00 0.00 H new ATOM 1127 N THR A 73 -63.773 36.956 108.607 1.00 0.00 N ATOM 1128 CA THR A 73 -62.675 35.974 108.777 1.00 0.00 C ATOM 1129 C THR A 73 -62.954 34.984 109.912 1.00 0.00 C ATOM 1130 O THR A 73 -63.008 33.781 109.682 1.00 0.00 O ATOM 1131 CB THR A 73 -61.314 36.691 108.889 1.00 0.00 C ATOM 1132 OG1 THR A 73 -60.885 36.940 107.566 1.00 0.00 O ATOM 1133 CG2 THR A 73 -60.192 35.955 109.624 1.00 0.00 C ATOM 0 H THR A 73 -63.434 37.913 108.506 1.00 0.00 H new ATOM 0 HA THR A 73 -62.623 35.357 107.880 1.00 0.00 H new ATOM 0 HB THR A 73 -61.492 37.577 109.498 1.00 0.00 H new ATOM 0 HG1 THR A 73 -59.994 36.555 107.433 1.00 0.00 H new ATOM 0 HG21 THR A 73 -59.294 36.572 109.628 1.00 0.00 H new ATOM 0 HG22 THR A 73 -60.500 35.755 110.650 1.00 0.00 H new ATOM 0 HG23 THR A 73 -59.982 35.013 109.118 1.00 0.00 H new ATOM 1141 N ASN A 74 -63.229 35.475 111.123 1.00 0.00 N ATOM 1142 CA ASN A 74 -63.512 34.647 112.299 1.00 0.00 C ATOM 1143 C ASN A 74 -64.830 33.840 112.224 1.00 0.00 C ATOM 1144 O ASN A 74 -65.129 33.099 113.160 1.00 0.00 O ATOM 1145 CB ASN A 74 -63.470 35.550 113.546 1.00 0.00 C ATOM 1146 CG ASN A 74 -62.166 36.331 113.638 1.00 0.00 C ATOM 1147 OD1 ASN A 74 -61.980 37.327 112.957 1.00 0.00 O ATOM 1148 ND2 ASN A 74 -61.221 35.890 114.445 1.00 0.00 N ATOM 0 H ASN A 74 -63.262 36.476 111.318 1.00 0.00 H new ATOM 0 HA ASN A 74 -62.741 33.878 112.349 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -64.309 36.246 113.519 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -63.591 34.939 114.441 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -60.329 36.382 114.503 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -61.382 35.057 115.012 1.00 0.00 H new ATOM 1155 N SER A 75 -65.620 33.952 111.146 1.00 0.00 N ATOM 1156 CA SER A 75 -66.794 33.100 110.922 1.00 0.00 C ATOM 1157 C SER A 75 -66.379 31.696 110.500 1.00 0.00 C ATOM 1158 O SER A 75 -65.736 31.518 109.463 1.00 0.00 O ATOM 1159 CB SER A 75 -67.703 33.664 109.832 1.00 0.00 C ATOM 1160 OG SER A 75 -68.095 34.966 110.191 1.00 0.00 O ATOM 0 H SER A 75 -65.462 34.636 110.406 1.00 0.00 H new ATOM 0 HA SER A 75 -67.333 33.068 111.869 1.00 0.00 H new ATOM 0 HB2 SER A 75 -67.180 33.679 108.876 1.00 0.00 H new ATOM 0 HB3 SER A 75 -68.579 33.028 109.706 1.00 0.00 H new ATOM 0 HG SER A 75 -68.828 34.920 110.840 1.00 0.00 H new ATOM 1166 N VAL A 76 -66.802 30.703 111.282 1.00 0.00 N ATOM 1167 CA VAL A 76 -66.829 29.304 110.860 1.00 0.00 C ATOM 1168 C VAL A 76 -68.173 28.958 110.214 1.00 0.00 C ATOM 1169 O VAL A 76 -69.213 29.456 110.646 1.00 0.00 O ATOM 1170 CB VAL A 76 -66.549 28.346 112.031 1.00 0.00 C ATOM 1171 CG1 VAL A 76 -65.065 28.376 112.400 1.00 0.00 C ATOM 1172 CG2 VAL A 76 -67.383 28.617 113.293 1.00 0.00 C ATOM 0 H VAL A 76 -67.138 30.849 112.234 1.00 0.00 H new ATOM 0 HA VAL A 76 -66.035 29.177 110.124 1.00 0.00 H new ATOM 0 HB VAL A 76 -66.844 27.361 111.668 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -64.883 27.693 113.230 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -64.470 28.069 111.540 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -64.783 29.387 112.694 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -67.119 27.894 114.065 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -67.179 29.625 113.654 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -68.443 28.524 113.056 1.00 0.00 H new ATOM 1182 N THR A 77 -68.152 28.059 109.224 1.00 0.00 N ATOM 1183 CA THR A 77 -69.359 27.591 108.521 1.00 0.00 C ATOM 1184 C THR A 77 -69.257 26.085 108.275 1.00 0.00 C ATOM 1185 O THR A 77 -68.411 25.642 107.495 1.00 0.00 O ATOM 1186 CB THR A 77 -69.604 28.357 107.198 1.00 0.00 C ATOM 1187 OG1 THR A 77 -69.438 29.748 107.374 1.00 0.00 O ATOM 1188 CG2 THR A 77 -71.026 28.136 106.678 1.00 0.00 C ATOM 0 H THR A 77 -67.292 27.630 108.883 1.00 0.00 H new ATOM 0 HA THR A 77 -70.220 27.795 109.158 1.00 0.00 H new ATOM 0 HB THR A 77 -68.875 27.971 106.485 1.00 0.00 H new ATOM 0 HG1 THR A 77 -69.338 30.179 106.499 1.00 0.00 H new ATOM 0 HG21 THR A 77 -71.163 28.688 105.748 1.00 0.00 H new ATOM 0 HG22 THR A 77 -71.186 27.073 106.496 1.00 0.00 H new ATOM 0 HG23 THR A 77 -71.743 28.489 107.419 1.00 0.00 H new ATOM 1196 N ASN A 78 -70.090 25.289 108.960 1.00 0.00 N ATOM 1197 CA ASN A 78 -70.307 23.875 108.640 1.00 0.00 C ATOM 1198 C ASN A 78 -71.256 23.733 107.438 1.00 0.00 C ATOM 1199 O ASN A 78 -72.272 24.421 107.359 1.00 0.00 O ATOM 1200 CB ASN A 78 -70.831 23.126 109.875 1.00 0.00 C ATOM 1201 CG ASN A 78 -72.174 23.653 110.354 1.00 0.00 C ATOM 1202 OD1 ASN A 78 -72.259 24.732 110.919 1.00 0.00 O ATOM 1203 ND2 ASN A 78 -73.247 22.916 110.145 1.00 0.00 N ATOM 0 H ASN A 78 -70.636 25.613 109.758 1.00 0.00 H new ATOM 0 HA ASN A 78 -69.356 23.423 108.358 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -70.924 22.066 109.640 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -70.103 23.210 110.682 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -74.161 23.246 110.456 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -73.163 22.016 109.672 1.00 0.00 H new ATOM 1210 N ILE A 79 -70.904 22.860 106.490 1.00 0.00 N ATOM 1211 CA ILE A 79 -71.505 22.781 105.157 1.00 0.00 C ATOM 1212 C ILE A 79 -71.688 21.312 104.762 1.00 0.00 C ATOM 1213 O ILE A 79 -70.719 20.623 104.443 1.00 0.00 O ATOM 1214 CB ILE A 79 -70.636 23.541 104.124 1.00 0.00 C ATOM 1215 CG1 ILE A 79 -70.465 25.027 104.524 1.00 0.00 C ATOM 1216 CG2 ILE A 79 -71.261 23.438 102.718 1.00 0.00 C ATOM 1217 CD1 ILE A 79 -69.439 25.775 103.681 1.00 0.00 C ATOM 0 H ILE A 79 -70.170 22.167 106.634 1.00 0.00 H new ATOM 0 HA ILE A 79 -72.485 23.258 105.173 1.00 0.00 H new ATOM 0 HB ILE A 79 -69.650 23.077 104.109 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -71.428 25.530 104.439 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -70.169 25.080 105.572 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -70.639 23.977 102.003 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -71.326 22.390 102.425 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -72.260 23.874 102.731 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -69.374 26.809 104.020 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -68.465 25.297 103.785 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -69.743 25.754 102.635 1.00 0.00 H new ATOM 1229 N GLU A 80 -72.941 20.851 104.778 1.00 0.00 N ATOM 1230 CA GLU A 80 -73.398 19.639 104.092 1.00 0.00 C ATOM 1231 C GLU A 80 -73.300 19.773 102.555 1.00 0.00 C ATOM 1232 O GLU A 80 -73.811 20.722 101.949 1.00 0.00 O ATOM 1233 CB GLU A 80 -74.839 19.310 104.518 1.00 0.00 C ATOM 1234 CG GLU A 80 -75.234 17.920 104.003 1.00 0.00 C ATOM 1235 CD GLU A 80 -76.670 17.495 104.324 1.00 0.00 C ATOM 1236 OE1 GLU A 80 -77.521 18.364 104.602 1.00 0.00 O ATOM 1237 OE2 GLU A 80 -76.909 16.264 104.225 1.00 0.00 O ATOM 0 H GLU A 80 -73.689 21.325 105.284 1.00 0.00 H new ATOM 0 HA GLU A 80 -72.741 18.820 104.384 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -74.922 19.341 105.604 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -75.524 20.061 104.124 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -75.097 17.897 102.922 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -74.550 17.184 104.426 1.00 0.00 H new ATOM 1244 N LEU A 81 -72.648 18.794 101.929 1.00 0.00 N ATOM 1245 CA LEU A 81 -72.233 18.770 100.529 1.00 0.00 C ATOM 1246 C LEU A 81 -72.268 17.322 99.989 1.00 0.00 C ATOM 1247 O LEU A 81 -71.991 16.376 100.721 1.00 0.00 O ATOM 1248 CB LEU A 81 -70.832 19.424 100.528 1.00 0.00 C ATOM 1249 CG LEU A 81 -69.923 19.160 99.325 1.00 0.00 C ATOM 1250 CD1 LEU A 81 -70.489 19.681 98.003 1.00 0.00 C ATOM 1251 CD2 LEU A 81 -68.562 19.819 99.579 1.00 0.00 C ATOM 0 H LEU A 81 -72.379 17.941 102.419 1.00 0.00 H new ATOM 0 HA LEU A 81 -72.894 19.318 99.858 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -70.965 20.502 100.617 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -70.307 19.093 101.424 1.00 0.00 H new ATOM 0 HG LEU A 81 -69.835 18.078 99.225 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -69.791 19.458 97.196 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -71.445 19.197 97.801 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -70.635 20.759 98.069 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -67.905 19.638 98.728 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -68.697 20.893 99.711 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -68.115 19.396 100.479 1.00 0.00 H new ATOM 1263 N GLU A 82 -72.603 17.129 98.708 1.00 0.00 N ATOM 1264 CA GLU A 82 -72.850 15.817 98.093 1.00 0.00 C ATOM 1265 C GLU A 82 -71.861 15.537 96.936 1.00 0.00 C ATOM 1266 O GLU A 82 -72.068 16.037 95.830 1.00 0.00 O ATOM 1267 CB GLU A 82 -74.338 15.736 97.687 1.00 0.00 C ATOM 1268 CG GLU A 82 -74.927 14.313 97.644 1.00 0.00 C ATOM 1269 CD GLU A 82 -75.002 13.645 96.265 1.00 0.00 C ATOM 1270 OE1 GLU A 82 -74.507 14.213 95.266 1.00 0.00 O ATOM 1271 OE2 GLU A 82 -75.523 12.504 96.220 1.00 0.00 O ATOM 0 H GLU A 82 -72.713 17.902 98.051 1.00 0.00 H new ATOM 0 HA GLU A 82 -72.661 15.018 98.810 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -74.923 16.333 98.387 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -74.456 16.191 96.704 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -74.331 13.677 98.299 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -75.933 14.347 98.062 1.00 0.00 H new ATOM 1278 N PRO A 83 -70.752 14.801 97.181 1.00 0.00 N ATOM 1279 CA PRO A 83 -69.855 14.275 96.139 1.00 0.00 C ATOM 1280 C PRO A 83 -70.481 13.126 95.326 1.00 0.00 C ATOM 1281 O PRO A 83 -71.506 12.580 95.728 1.00 0.00 O ATOM 1282 CB PRO A 83 -68.597 13.786 96.875 1.00 0.00 C ATOM 1283 CG PRO A 83 -68.966 13.701 98.355 1.00 0.00 C ATOM 1284 CD PRO A 83 -70.254 14.496 98.514 1.00 0.00 C ATOM 0 HA PRO A 83 -69.637 15.056 95.411 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -68.280 12.814 96.498 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -67.766 14.474 96.721 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -69.107 12.665 98.663 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -68.173 14.114 98.979 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -70.991 13.922 99.076 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -70.071 15.413 99.073 1.00 0.00 H new ATOM 1292 N PRO A 84 -69.865 12.681 94.214 1.00 0.00 N ATOM 1293 CA PRO A 84 -70.242 11.428 93.554 1.00 0.00 C ATOM 1294 C PRO A 84 -69.812 10.207 94.391 1.00 0.00 C ATOM 1295 O PRO A 84 -69.003 10.317 95.313 1.00 0.00 O ATOM 1296 CB PRO A 84 -69.515 11.466 92.208 1.00 0.00 C ATOM 1297 CG PRO A 84 -68.225 12.203 92.557 1.00 0.00 C ATOM 1298 CD PRO A 84 -68.698 13.258 93.559 1.00 0.00 C ATOM 0 HA PRO A 84 -71.321 11.334 93.433 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -69.320 10.465 91.822 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -70.092 11.993 91.449 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -67.483 11.535 92.993 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -67.768 12.657 91.678 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -67.917 13.489 94.283 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -68.952 14.191 93.055 1.00 0.00 H new ATOM 1306 N PHE A 85 -70.328 9.020 94.054 1.00 0.00 N ATOM 1307 CA PHE A 85 -69.918 7.750 94.665 1.00 0.00 C ATOM 1308 C PHE A 85 -68.538 7.299 94.148 1.00 0.00 C ATOM 1309 O PHE A 85 -68.434 6.425 93.292 1.00 0.00 O ATOM 1310 CB PHE A 85 -71.005 6.686 94.449 1.00 0.00 C ATOM 1311 CG PHE A 85 -72.334 7.022 95.102 1.00 0.00 C ATOM 1312 CD1 PHE A 85 -72.500 6.851 96.492 1.00 0.00 C ATOM 1313 CD2 PHE A 85 -73.404 7.508 94.327 1.00 0.00 C ATOM 1314 CE1 PHE A 85 -73.731 7.160 97.100 1.00 0.00 C ATOM 1315 CE2 PHE A 85 -74.634 7.819 94.936 1.00 0.00 C ATOM 1316 CZ PHE A 85 -74.798 7.644 96.321 1.00 0.00 C ATOM 0 H PHE A 85 -71.050 8.912 93.342 1.00 0.00 H new ATOM 0 HA PHE A 85 -69.808 7.894 95.740 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -71.161 6.552 93.379 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -70.650 5.733 94.841 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -71.681 6.482 97.091 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -73.281 7.643 93.263 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -73.857 7.026 98.164 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -75.453 8.192 94.339 1.00 0.00 H new ATOM 0 HZ PHE A 85 -75.743 7.881 96.787 1.00 0.00 H new ATOM 1326 N GLY A 86 -67.475 7.922 94.667 1.00 0.00 N ATOM 1327 CA GLY A 86 -66.086 7.659 94.287 1.00 0.00 C ATOM 1328 C GLY A 86 -65.110 8.625 94.963 1.00 0.00 C ATOM 1329 O GLY A 86 -65.496 9.357 95.878 1.00 0.00 O ATOM 0 H GLY A 86 -67.561 8.643 95.383 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -65.825 6.635 94.555 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -65.985 7.741 93.205 1.00 0.00 H new ATOM 1333 N ASP A 87 -63.848 8.609 94.507 1.00 0.00 N ATOM 1334 CA ASP A 87 -62.835 9.614 94.854 1.00 0.00 C ATOM 1335 C ASP A 87 -63.157 10.957 94.180 1.00 0.00 C ATOM 1336 O ASP A 87 -63.643 10.990 93.044 1.00 0.00 O ATOM 1337 CB ASP A 87 -61.434 9.136 94.426 1.00 0.00 C ATOM 1338 CG ASP A 87 -60.328 10.069 94.943 1.00 0.00 C ATOM 1339 OD1 ASP A 87 -60.366 10.394 96.146 1.00 0.00 O ATOM 1340 OD2 ASP A 87 -59.451 10.472 94.140 1.00 0.00 O ATOM 0 H ASP A 87 -63.499 7.886 93.878 1.00 0.00 H new ATOM 0 HA ASP A 87 -62.846 9.751 95.935 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -61.264 8.127 94.803 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -61.385 9.083 93.338 1.00 0.00 H new ATOM 1345 N SER A 88 -62.906 12.083 94.854 1.00 0.00 N ATOM 1346 CA SER A 88 -63.077 13.433 94.297 1.00 0.00 C ATOM 1347 C SER A 88 -62.373 14.511 95.131 1.00 0.00 C ATOM 1348 O SER A 88 -61.925 14.256 96.253 1.00 0.00 O ATOM 1349 CB SER A 88 -64.570 13.764 94.181 1.00 0.00 C ATOM 1350 OG SER A 88 -65.161 13.003 93.152 1.00 0.00 O ATOM 0 H SER A 88 -62.573 12.085 95.818 1.00 0.00 H new ATOM 0 HA SER A 88 -62.613 13.433 93.311 1.00 0.00 H new ATOM 0 HB2 SER A 88 -65.070 13.558 95.128 1.00 0.00 H new ATOM 0 HB3 SER A 88 -64.699 14.827 93.977 1.00 0.00 H new ATOM 0 HG SER A 88 -64.492 12.401 92.765 1.00 0.00 H new ATOM 1356 N TYR A 89 -62.292 15.730 94.574 1.00 0.00 N ATOM 1357 CA TYR A 89 -61.473 16.824 95.103 1.00 0.00 C ATOM 1358 C TYR A 89 -62.319 18.078 95.318 1.00 0.00 C ATOM 1359 O TYR A 89 -62.782 18.726 94.379 1.00 0.00 O ATOM 1360 CB TYR A 89 -60.246 17.048 94.212 1.00 0.00 C ATOM 1361 CG TYR A 89 -59.366 15.812 94.191 1.00 0.00 C ATOM 1362 CD1 TYR A 89 -59.662 14.773 93.288 1.00 0.00 C ATOM 1363 CD2 TYR A 89 -58.394 15.616 95.193 1.00 0.00 C ATOM 1364 CE1 TYR A 89 -59.073 13.509 93.460 1.00 0.00 C ATOM 1365 CE2 TYR A 89 -57.772 14.359 95.337 1.00 0.00 C ATOM 1366 CZ TYR A 89 -58.154 13.287 94.503 1.00 0.00 C ATOM 1367 OH TYR A 89 -57.664 12.036 94.701 1.00 0.00 O ATOM 0 H TYR A 89 -62.804 15.984 93.729 1.00 0.00 H new ATOM 0 HA TYR A 89 -61.090 16.554 96.087 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -60.566 17.290 93.198 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -59.675 17.901 94.579 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -60.340 14.947 92.465 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -58.126 16.429 95.851 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -59.327 12.703 92.788 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -57.005 14.217 96.084 1.00 0.00 H new ATOM 0 HH TYR A 89 -58.143 11.402 94.127 1.00 0.00 H new ATOM 1377 N ILE A 90 -62.562 18.359 96.596 1.00 0.00 N ATOM 1378 CA ILE A 90 -63.365 19.444 97.135 1.00 0.00 C ATOM 1379 C ILE A 90 -62.490 20.697 97.125 1.00 0.00 C ATOM 1380 O ILE A 90 -61.399 20.678 97.698 1.00 0.00 O ATOM 1381 CB ILE A 90 -63.825 19.088 98.569 1.00 0.00 C ATOM 1382 CG1 ILE A 90 -64.753 17.854 98.651 1.00 0.00 C ATOM 1383 CG2 ILE A 90 -64.603 20.269 99.177 1.00 0.00 C ATOM 1384 CD1 ILE A 90 -64.169 16.481 98.302 1.00 0.00 C ATOM 0 H ILE A 90 -62.167 17.783 97.340 1.00 0.00 H new ATOM 0 HA ILE A 90 -64.262 19.614 96.540 1.00 0.00 H new ATOM 0 HB ILE A 90 -62.907 18.862 99.112 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -65.145 17.800 99.667 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -65.602 18.032 97.991 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -64.924 20.012 100.186 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -63.960 21.148 99.214 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -65.477 20.484 98.562 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -64.942 15.720 98.407 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -63.806 16.490 97.274 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -63.343 16.255 98.976 1.00 0.00 H new ATOM 1396 N VAL A 91 -62.960 21.769 96.483 1.00 0.00 N ATOM 1397 CA VAL A 91 -62.227 23.039 96.374 1.00 0.00 C ATOM 1398 C VAL A 91 -63.016 24.123 97.111 1.00 0.00 C ATOM 1399 O VAL A 91 -64.198 24.316 96.828 1.00 0.00 O ATOM 1400 CB VAL A 91 -61.803 23.401 94.923 1.00 0.00 C ATOM 1401 CG1 VAL A 91 -61.714 22.189 93.981 1.00 0.00 C ATOM 1402 CG2 VAL A 91 -62.638 24.493 94.241 1.00 0.00 C ATOM 0 H VAL A 91 -63.868 21.783 96.019 1.00 0.00 H new ATOM 0 HA VAL A 91 -61.260 22.938 96.867 1.00 0.00 H new ATOM 0 HB VAL A 91 -60.805 23.808 95.086 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -61.413 22.522 92.988 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -60.978 21.482 94.366 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -62.688 21.703 93.921 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -62.257 24.667 93.235 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -63.679 24.174 94.185 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -62.572 25.415 94.818 1.00 0.00 H new ATOM 1412 N ILE A 92 -62.382 24.784 98.089 1.00 0.00 N ATOM 1413 CA ILE A 92 -62.979 25.833 98.934 1.00 0.00 C ATOM 1414 C ILE A 92 -62.104 27.094 98.847 1.00 0.00 C ATOM 1415 O ILE A 92 -61.036 27.168 99.459 1.00 0.00 O ATOM 1416 CB ILE A 92 -63.221 25.338 100.381 1.00 0.00 C ATOM 1417 CG1 ILE A 92 -64.016 24.010 100.391 1.00 0.00 C ATOM 1418 CG2 ILE A 92 -63.899 26.437 101.223 1.00 0.00 C ATOM 1419 CD1 ILE A 92 -64.370 23.465 101.778 1.00 0.00 C ATOM 0 H ILE A 92 -61.407 24.599 98.323 1.00 0.00 H new ATOM 0 HA ILE A 92 -63.972 26.090 98.565 1.00 0.00 H new ATOM 0 HB ILE A 92 -62.257 25.127 100.843 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -64.939 24.155 99.830 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -63.436 23.255 99.860 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -64.061 26.071 102.237 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -63.259 27.319 101.254 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -64.857 26.700 100.775 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -64.926 22.533 101.672 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -63.455 23.280 102.341 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -64.982 24.194 102.310 1.00 0.00 H new ATOM 1431 N GLY A 93 -62.539 28.050 98.020 1.00 0.00 N ATOM 1432 CA GLY A 93 -61.754 29.154 97.452 1.00 0.00 C ATOM 1433 C GLY A 93 -61.731 29.056 95.916 1.00 0.00 C ATOM 1434 O GLY A 93 -62.475 28.262 95.342 1.00 0.00 O ATOM 0 H GLY A 93 -63.510 28.076 97.709 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -62.183 30.109 97.756 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -60.736 29.124 97.841 1.00 0.00 H new ATOM 1438 N VAL A 94 -60.886 29.844 95.234 1.00 0.00 N ATOM 1439 CA VAL A 94 -60.754 29.806 93.756 1.00 0.00 C ATOM 1440 C VAL A 94 -59.334 29.409 93.323 1.00 0.00 C ATOM 1441 O VAL A 94 -58.487 29.130 94.165 1.00 0.00 O ATOM 1442 CB VAL A 94 -61.233 31.117 93.089 1.00 0.00 C ATOM 1443 CG1 VAL A 94 -62.635 31.535 93.549 1.00 0.00 C ATOM 1444 CG2 VAL A 94 -60.254 32.272 93.308 1.00 0.00 C ATOM 0 H VAL A 94 -60.274 30.526 95.683 1.00 0.00 H new ATOM 0 HA VAL A 94 -61.423 29.024 93.396 1.00 0.00 H new ATOM 0 HB VAL A 94 -61.276 30.897 92.022 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -62.921 32.461 93.050 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -63.349 30.751 93.297 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -62.633 31.690 94.628 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -60.635 33.169 92.821 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -60.144 32.458 94.376 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -59.284 32.013 92.883 1.00 0.00 H new ATOM 1454 N GLY A 95 -59.045 29.376 92.015 1.00 0.00 N ATOM 1455 CA GLY A 95 -57.773 28.882 91.461 1.00 0.00 C ATOM 1456 C GLY A 95 -56.481 29.502 92.027 1.00 0.00 C ATOM 1457 O GLY A 95 -55.424 28.894 91.893 1.00 0.00 O ATOM 0 H GLY A 95 -59.697 29.696 91.299 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -57.730 27.804 91.618 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -57.785 29.047 90.384 1.00 0.00 H new ATOM 1461 N ASN A 96 -56.549 30.669 92.683 1.00 0.00 N ATOM 1462 CA ASN A 96 -55.421 31.317 93.362 1.00 0.00 C ATOM 1463 C ASN A 96 -55.394 31.104 94.898 1.00 0.00 C ATOM 1464 O ASN A 96 -54.572 31.734 95.567 1.00 0.00 O ATOM 1465 CB ASN A 96 -55.419 32.813 92.982 1.00 0.00 C ATOM 1466 CG ASN A 96 -56.538 33.602 93.646 1.00 0.00 C ATOM 1467 OD1 ASN A 96 -57.548 33.917 93.040 1.00 0.00 O ATOM 1468 ND2 ASN A 96 -56.398 33.901 94.920 1.00 0.00 N ATOM 0 H ASN A 96 -57.415 31.202 92.757 1.00 0.00 H new ATOM 0 HA ASN A 96 -54.504 30.840 93.018 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -54.460 33.251 93.260 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -55.510 32.906 91.900 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -57.139 34.401 95.411 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -55.549 33.632 95.417 1.00 0.00 H new ATOM 1475 N SER A 97 -56.322 30.328 95.479 1.00 0.00 N ATOM 1476 CA SER A 97 -56.535 30.262 96.940 1.00 0.00 C ATOM 1477 C SER A 97 -57.227 29.006 97.493 1.00 0.00 C ATOM 1478 O SER A 97 -57.253 28.831 98.712 1.00 0.00 O ATOM 1479 CB SER A 97 -57.371 31.469 97.371 1.00 0.00 C ATOM 1480 OG SER A 97 -58.592 31.540 96.655 1.00 0.00 O ATOM 0 H SER A 97 -56.951 29.724 94.949 1.00 0.00 H new ATOM 0 HA SER A 97 -55.526 30.243 97.351 1.00 0.00 H new ATOM 0 HB2 SER A 97 -57.578 31.406 98.439 1.00 0.00 H new ATOM 0 HB3 SER A 97 -56.800 32.384 97.210 1.00 0.00 H new ATOM 0 HG SER A 97 -58.646 32.398 96.184 1.00 0.00 H new ATOM 1486 N ALA A 98 -57.805 28.151 96.642 1.00 0.00 N ATOM 1487 CA ALA A 98 -58.675 27.050 97.036 1.00 0.00 C ATOM 1488 C ALA A 98 -57.992 25.996 97.915 1.00 0.00 C ATOM 1489 O ALA A 98 -57.120 25.252 97.449 1.00 0.00 O ATOM 1490 CB ALA A 98 -59.284 26.397 95.791 1.00 0.00 C ATOM 0 H ALA A 98 -57.673 28.212 95.632 1.00 0.00 H new ATOM 0 HA ALA A 98 -59.459 27.486 97.655 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -59.933 25.575 96.092 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -59.866 27.136 95.240 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -58.487 26.015 95.154 1.00 0.00 H new ATOM 1496 N LEU A 99 -58.497 25.848 99.149 1.00 0.00 N ATOM 1497 CA LEU A 99 -58.350 24.621 99.928 1.00 0.00 C ATOM 1498 C LEU A 99 -58.833 23.462 99.056 1.00 0.00 C ATOM 1499 O LEU A 99 -60.034 23.330 98.825 1.00 0.00 O ATOM 1500 CB LEU A 99 -59.222 24.661 101.189 1.00 0.00 C ATOM 1501 CG LEU A 99 -58.911 25.722 102.246 1.00 0.00 C ATOM 1502 CD1 LEU A 99 -60.133 25.807 103.161 1.00 0.00 C ATOM 1503 CD2 LEU A 99 -57.675 25.329 103.061 1.00 0.00 C ATOM 0 H LEU A 99 -59.019 26.580 99.631 1.00 0.00 H new ATOM 0 HA LEU A 99 -57.308 24.507 100.226 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -60.257 24.797 100.875 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -59.160 23.684 101.669 1.00 0.00 H new ATOM 0 HG LEU A 99 -58.701 26.682 101.774 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -59.957 26.555 103.935 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -61.007 26.090 102.575 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -60.307 24.837 103.627 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -57.472 26.097 103.807 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -57.856 24.377 103.560 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -56.817 25.232 102.396 1.00 0.00 H new ATOM 1515 N THR A 100 -57.899 22.679 98.525 1.00 0.00 N ATOM 1516 CA THR A 100 -58.177 21.611 97.568 1.00 0.00 C ATOM 1517 C THR A 100 -57.918 20.286 98.273 1.00 0.00 C ATOM 1518 O THR A 100 -56.771 19.850 98.366 1.00 0.00 O ATOM 1519 CB THR A 100 -57.350 21.798 96.289 1.00 0.00 C ATOM 1520 OG1 THR A 100 -57.614 23.076 95.742 1.00 0.00 O ATOM 1521 CG2 THR A 100 -57.718 20.750 95.234 1.00 0.00 C ATOM 0 H THR A 100 -56.909 22.770 98.752 1.00 0.00 H new ATOM 0 HA THR A 100 -59.216 21.631 97.239 1.00 0.00 H new ATOM 0 HB THR A 100 -56.298 21.692 96.552 1.00 0.00 H new ATOM 0 HG1 THR A 100 -57.296 23.768 96.359 1.00 0.00 H new ATOM 0 HG21 THR A 100 -57.116 20.908 94.339 1.00 0.00 H new ATOM 0 HG22 THR A 100 -57.526 19.753 95.629 1.00 0.00 H new ATOM 0 HG23 THR A 100 -58.774 20.843 94.982 1.00 0.00 H new ATOM 1529 N LEU A 101 -58.977 19.691 98.833 1.00 0.00 N ATOM 1530 CA LEU A 101 -58.897 18.528 99.715 1.00 0.00 C ATOM 1531 C LEU A 101 -59.746 17.352 99.213 1.00 0.00 C ATOM 1532 O LEU A 101 -60.628 17.493 98.370 1.00 0.00 O ATOM 1533 CB LEU A 101 -59.172 18.917 101.186 1.00 0.00 C ATOM 1534 CG LEU A 101 -60.582 19.449 101.529 1.00 0.00 C ATOM 1535 CD1 LEU A 101 -60.865 19.211 103.014 1.00 0.00 C ATOM 1536 CD2 LEU A 101 -60.731 20.957 101.302 1.00 0.00 C ATOM 0 H LEU A 101 -59.933 20.014 98.681 1.00 0.00 H new ATOM 0 HA LEU A 101 -57.871 18.161 99.688 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -58.982 18.042 101.807 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -58.446 19.677 101.475 1.00 0.00 H new ATOM 0 HG LEU A 101 -61.272 18.919 100.872 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -61.859 19.585 103.260 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -60.816 18.143 103.227 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -60.122 19.735 103.615 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -61.744 21.266 101.562 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -60.017 21.492 101.928 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -60.539 21.188 100.254 1.00 0.00 H new ATOM 1548 N HIS A 102 -59.415 16.165 99.711 1.00 0.00 N ATOM 1549 CA HIS A 102 -59.786 14.874 99.139 1.00 0.00 C ATOM 1550 C HIS A 102 -60.949 14.182 99.850 1.00 0.00 C ATOM 1551 O HIS A 102 -61.080 14.254 101.072 1.00 0.00 O ATOM 1552 CB HIS A 102 -58.542 13.977 99.189 1.00 0.00 C ATOM 1553 CG HIS A 102 -57.872 13.795 100.544 1.00 0.00 C ATOM 1554 ND1 HIS A 102 -58.144 14.423 101.754 1.00 0.00 N ATOM 1555 CD2 HIS A 102 -56.779 12.993 100.747 1.00 0.00 C ATOM 1556 CE1 HIS A 102 -57.215 14.020 102.635 1.00 0.00 C ATOM 1557 NE2 HIS A 102 -56.375 13.140 102.075 1.00 0.00 N ATOM 0 H HIS A 102 -58.857 16.072 100.560 1.00 0.00 H new ATOM 0 HA HIS A 102 -60.134 15.049 98.121 1.00 0.00 H new ATOM 0 HB2 HIS A 102 -58.820 12.992 98.814 1.00 0.00 H new ATOM 0 HB3 HIS A 102 -57.803 14.384 98.498 1.00 0.00 H new ATOM 0 HD2 HIS A 102 -56.312 12.358 100.008 1.00 0.00 H new ATOM 0 HE1 HIS A 102 -57.153 14.360 103.658 1.00 0.00 H new ATOM 0 HE2 HIS A 102 -55.593 12.669 102.530 1.00 0.00 H new ATOM 1565 N TRP A 103 -61.745 13.417 99.096 1.00 0.00 N ATOM 1566 CA TRP A 103 -62.772 12.550 99.669 1.00 0.00 C ATOM 1567 C TRP A 103 -63.025 11.310 98.821 1.00 0.00 C ATOM 1568 O TRP A 103 -63.025 11.399 97.598 1.00 0.00 O ATOM 1569 CB TRP A 103 -64.076 13.337 99.775 1.00 0.00 C ATOM 1570 CG TRP A 103 -65.131 12.704 100.619 1.00 0.00 C ATOM 1571 CD1 TRP A 103 -66.335 12.254 100.198 1.00 0.00 C ATOM 1572 CD2 TRP A 103 -65.074 12.437 102.046 1.00 0.00 C ATOM 1573 NE1 TRP A 103 -67.053 11.788 101.284 1.00 0.00 N ATOM 1574 CE2 TRP A 103 -66.331 11.909 102.449 1.00 0.00 C ATOM 1575 CE3 TRP A 103 -64.089 12.588 103.043 1.00 0.00 C ATOM 1576 CZ2 TRP A 103 -66.626 11.616 103.782 1.00 0.00 C ATOM 1577 CZ3 TRP A 103 -64.359 12.237 104.377 1.00 0.00 C ATOM 1578 CH2 TRP A 103 -65.632 11.779 104.756 1.00 0.00 C ATOM 0 H TRP A 103 -61.694 13.383 98.078 1.00 0.00 H new ATOM 0 HA TRP A 103 -62.419 12.222 100.647 1.00 0.00 H new ATOM 0 HB2 TRP A 103 -63.854 14.325 100.179 1.00 0.00 H new ATOM 0 HB3 TRP A 103 -64.476 13.485 98.772 1.00 0.00 H new ATOM 0 HD1 TRP A 103 -66.681 12.258 99.175 1.00 0.00 H new ATOM 0 HE1 TRP A 103 -67.996 11.404 101.229 1.00 0.00 H new ATOM 0 HE3 TRP A 103 -63.117 12.977 102.779 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 -67.610 11.267 104.059 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 -63.579 12.320 105.119 1.00 0.00 H new ATOM 0 HH2 TRP A 103 -65.843 11.554 105.791 1.00 0.00 H new ATOM 1589 N PHE A 104 -63.368 10.200 99.483 1.00 0.00 N ATOM 1590 CA PHE A 104 -63.950 9.017 98.859 1.00 0.00 C ATOM 1591 C PHE A 104 -65.292 8.710 99.533 1.00 0.00 C ATOM 1592 O PHE A 104 -65.338 8.284 100.690 1.00 0.00 O ATOM 1593 CB PHE A 104 -62.969 7.840 98.890 1.00 0.00 C ATOM 1594 CG PHE A 104 -63.511 6.604 98.195 1.00 0.00 C ATOM 1595 CD1 PHE A 104 -64.382 5.746 98.885 1.00 0.00 C ATOM 1596 CD2 PHE A 104 -63.203 6.336 96.850 1.00 0.00 C ATOM 1597 CE1 PHE A 104 -64.974 4.649 98.238 1.00 0.00 C ATOM 1598 CE2 PHE A 104 -63.788 5.236 96.195 1.00 0.00 C ATOM 1599 CZ PHE A 104 -64.681 4.397 96.887 1.00 0.00 C ATOM 0 H PHE A 104 -63.244 10.101 100.491 1.00 0.00 H new ATOM 0 HA PHE A 104 -64.145 9.204 97.803 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -62.035 8.139 98.414 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -62.735 7.595 99.926 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -64.600 5.932 99.926 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -62.515 6.976 96.317 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -65.651 4.002 98.776 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -63.551 5.036 95.160 1.00 0.00 H new ATOM 0 HZ PHE A 104 -65.140 3.561 96.381 1.00 0.00 H new ATOM 1609 N ARG A 105 -66.394 8.977 98.821 1.00 0.00 N ATOM 1610 CA ARG A 105 -67.755 8.820 99.353 1.00 0.00 C ATOM 1611 C ARG A 105 -68.059 7.357 99.701 1.00 0.00 C ATOM 1612 O ARG A 105 -67.665 6.446 98.978 1.00 0.00 O ATOM 1613 CB ARG A 105 -68.740 9.392 98.331 1.00 0.00 C ATOM 1614 CG ARG A 105 -70.179 9.488 98.853 1.00 0.00 C ATOM 1615 CD ARG A 105 -71.059 10.152 97.795 1.00 0.00 C ATOM 1616 NE ARG A 105 -72.431 10.350 98.278 1.00 0.00 N ATOM 1617 CZ ARG A 105 -73.495 10.652 97.551 1.00 0.00 C ATOM 1618 NH1 ARG A 105 -73.458 10.861 96.264 1.00 0.00 N ATOM 1619 NH2 ARG A 105 -74.642 10.865 98.132 1.00 0.00 N ATOM 0 H ARG A 105 -66.368 9.309 97.857 1.00 0.00 H new ATOM 0 HA ARG A 105 -67.853 9.371 100.288 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -68.404 10.385 98.031 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -68.727 8.768 97.438 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -70.560 8.494 99.087 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -70.205 10.065 99.777 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -70.629 11.114 97.515 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -71.075 9.536 96.896 1.00 0.00 H new ATOM 0 HE ARG A 105 -72.580 10.243 99.281 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -72.573 10.795 95.762 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -74.314 11.091 95.760 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -74.720 10.799 99.147 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -75.462 11.098 97.572 1.00 0.00 H new ATOM 1633 N LYS A 106 -68.753 7.136 100.823 1.00 0.00 N ATOM 1634 CA LYS A 106 -69.089 5.847 101.457 1.00 0.00 C ATOM 1635 C LYS A 106 -67.898 4.971 101.892 1.00 0.00 C ATOM 1636 O LYS A 106 -68.121 3.988 102.592 1.00 0.00 O ATOM 1637 CB LYS A 106 -70.142 5.081 100.622 1.00 0.00 C ATOM 1638 CG LYS A 106 -71.562 5.685 100.680 1.00 0.00 C ATOM 1639 CD LYS A 106 -72.459 5.108 101.795 1.00 0.00 C ATOM 1640 CE LYS A 106 -71.979 5.340 103.236 1.00 0.00 C ATOM 1641 NZ LYS A 106 -72.106 6.755 103.659 1.00 0.00 N ATOM 0 H LYS A 106 -69.128 7.918 101.360 1.00 0.00 H new ATOM 0 HA LYS A 106 -69.535 6.112 102.416 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -69.814 5.053 99.583 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -70.184 4.049 100.971 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -71.479 6.763 100.820 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -72.051 5.525 99.719 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -73.455 5.539 101.692 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -72.558 4.034 101.635 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -72.555 4.709 103.913 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -70.937 5.031 103.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -72.050 6.814 104.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -71.336 7.314 103.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -73.021 7.132 103.340 1.00 0.00 H new