USER MOD reduce.3.24.130724 H: found=0, std=0, add=1119, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1121 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 75 HIS : no HE2:sc= 0.933 K(o=0.023,f=-4.1!) USER MOD Set 1.2: A 135 THR OG1 : rot 142:sc= -0.147 USER MOD Set 1.3: A 136 GLN :FLIP amide:sc= -0.762 F(o=-0.97,f=0.023) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot -90:sc= 0.346 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0.0259 USER MOD Single : A 25 ASN : amide:sc= 0.215 K(o=0.22,f=-6.2!) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 MET CE :methyl 127:sc= -0.0056 (180deg=-0.67) USER MOD Single : A 33 ASN : amide:sc= -0.656 K(o=-0.66,f=-2.7!) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 GLN :FLIP amide:sc= -1.03 F(o=-2.5!,f=-1) USER MOD Single : A 39 ASN : amide:sc= 0 X(o=0,f=0.33) USER MOD Single : A 40 ASN : amide:sc= -0.0528 K(o=-0.053,f=-1) USER MOD Single : A 44 THR OG1 : rot -72:sc= 0.3 USER MOD Single : A 45 THR OG1 : rot -32:sc= -0.822 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= -0.374 K(o=-0.37,f=-2.5!) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 76 ASN : amide:sc= -0.169 K(o=-0.17,f=-1.1) USER MOD Single : A 78 ASN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : A 84 ASN : amide:sc= -0.094 X(o=-0.094,f=-0.077) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 95 GLN :FLIP amide:sc= -0.22 F(o=-2.1!,f=-0.22) USER MOD Single : A 98 ASN :FLIP amide:sc= -1.32 F(o=-4.8!,f=-1.3) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 GLN : amide:sc= 0.0193 X(o=0.019,f=0) USER MOD Single : A 102 ASN : amide:sc=-0.00748 X(o=-0.0075,f=0) USER MOD Single : A 103 GLN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 107 ASN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 110 SER OG : rot 180:sc= 0.0832 USER MOD Single : A 111 SER OG : rot 180:sc= 0.0662 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 ASN : amide:sc= 1.14 K(o=1.1,f=-6.2!) USER MOD Single : A 125 THR OG1 : rot 180:sc= 0.0195 USER MOD Single : A 127 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 MET CE :methyl -178:sc= -0.535 (180deg=-0.566) USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 HIS : no HE2:sc= 0.504 K(o=0.5,f=-3.7!) USER MOD Single : A 145 ASN : amide:sc= 0.00238 K(o=0.0024,f=-0.59) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 149 THR OG1 : rot 38:sc= 0.0241 USER MOD Single : A 151 THR OG1 : rot 28:sc= 0.0756 USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD Single : A 155 GLN : amide:sc= -0.672 K(o=-0.67,f=-4.9!) USER MOD Single : A 168 SER OG : rot 120:sc= -1.05 USER MOD Single : A 169 THR OG1 : rot 180:sc= 0 USER MOD Single : A 171 THR OG1 : rot 180:sc= 0 USER MOD Single : A 175 TYR OH : rot 180:sc= 0 USER MOD Single : A 179 ASN :FLIP amide:sc= -0.0476 F(o=-0.74,f=-0.048) USER MOD ----------------------------------------------------------------- ATOM 235 N GLY A 16 -11.123 19.946 0.506 1.00 0.00 N ATOM 236 CA GLY A 16 -10.227 18.781 0.544 1.00 0.00 C ATOM 237 C GLY A 16 -10.600 17.747 1.618 1.00 0.00 C ATOM 238 O GLY A 16 -11.545 17.947 2.382 1.00 0.00 O ATOM 0 HA2 GLY A 16 -10.235 18.296 -0.432 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -9.208 19.124 0.721 1.00 0.00 H new ATOM 242 N CYS A 17 -9.845 16.642 1.691 1.00 0.00 N ATOM 243 CA CYS A 17 -9.955 15.657 2.772 1.00 0.00 C ATOM 244 C CYS A 17 -8.706 15.708 3.661 1.00 0.00 C ATOM 245 O CYS A 17 -7.677 16.281 3.287 1.00 0.00 O ATOM 246 CB CYS A 17 -10.110 14.216 2.262 1.00 0.00 C ATOM 247 SG CYS A 17 -11.399 13.813 1.050 1.00 0.00 S ATOM 0 H CYS A 17 -9.136 16.406 0.996 1.00 0.00 H new ATOM 0 HA CYS A 17 -10.853 15.922 3.330 1.00 0.00 H new ATOM 0 HB2 CYS A 17 -9.154 13.922 1.828 1.00 0.00 H new ATOM 0 HB3 CYS A 17 -10.274 13.581 3.132 1.00 0.00 H new ATOM 252 N SER A 18 -8.789 15.042 4.806 1.00 0.00 N ATOM 253 CA SER A 18 -7.646 14.627 5.583 1.00 0.00 C ATOM 254 C SER A 18 -7.629 13.098 5.608 1.00 0.00 C ATOM 255 O SER A 18 -8.670 12.465 5.466 1.00 0.00 O ATOM 256 CB SER A 18 -7.765 15.196 6.997 1.00 0.00 C ATOM 257 OG SER A 18 -7.952 16.595 7.001 1.00 0.00 O ATOM 0 H SER A 18 -9.680 14.773 5.224 1.00 0.00 H new ATOM 0 HA SER A 18 -6.717 14.995 5.147 1.00 0.00 H new ATOM 0 HB2 SER A 18 -8.601 14.719 7.508 1.00 0.00 H new ATOM 0 HB3 SER A 18 -6.865 14.951 7.561 1.00 0.00 H new ATOM 0 HG SER A 18 -8.024 16.913 7.925 1.00 0.00 H new ATOM 263 N VAL A 19 -6.459 12.492 5.783 1.00 0.00 N ATOM 264 CA VAL A 19 -6.323 11.091 6.141 1.00 0.00 C ATOM 265 C VAL A 19 -6.838 10.901 7.569 1.00 0.00 C ATOM 266 O VAL A 19 -6.627 11.758 8.434 1.00 0.00 O ATOM 267 CB VAL A 19 -4.858 10.664 5.914 1.00 0.00 C ATOM 268 CG1 VAL A 19 -3.843 11.409 6.799 1.00 0.00 C ATOM 269 CG2 VAL A 19 -4.665 9.153 6.051 1.00 0.00 C ATOM 0 H VAL A 19 -5.565 12.972 5.677 1.00 0.00 H new ATOM 0 HA VAL A 19 -6.927 10.436 5.513 1.00 0.00 H new ATOM 0 HB VAL A 19 -4.650 10.952 4.884 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -2.837 11.052 6.579 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -3.900 12.479 6.597 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -4.072 11.225 7.849 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -3.618 8.903 5.882 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -4.956 8.838 7.053 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -5.284 8.639 5.315 1.00 0.00 H new ATOM 279 N ALA A 20 -7.566 9.810 7.801 1.00 0.00 N ATOM 280 CA ALA A 20 -8.058 9.468 9.118 1.00 0.00 C ATOM 281 C ALA A 20 -6.929 8.938 9.981 1.00 0.00 C ATOM 282 O ALA A 20 -6.032 8.258 9.486 1.00 0.00 O ATOM 283 CB ALA A 20 -9.156 8.425 9.013 1.00 0.00 C ATOM 0 H ALA A 20 -7.827 9.143 7.075 1.00 0.00 H new ATOM 0 HA ALA A 20 -8.464 10.368 9.580 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -9.518 8.176 10.011 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -9.978 8.821 8.417 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -8.761 7.528 8.536 1.00 0.00 H new ATOM 289 N ALA A 21 -7.077 9.134 11.291 1.00 0.00 N ATOM 290 CA ALA A 21 -6.230 8.545 12.315 1.00 0.00 C ATOM 291 C ALA A 21 -6.037 7.047 12.078 1.00 0.00 C ATOM 292 O ALA A 21 -4.921 6.545 12.190 1.00 0.00 O ATOM 293 CB ALA A 21 -6.896 8.776 13.669 1.00 0.00 C ATOM 0 H ALA A 21 -7.813 9.726 11.675 1.00 0.00 H new ATOM 0 HA ALA A 21 -5.245 9.012 12.285 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -6.279 8.343 14.456 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -7.006 9.846 13.842 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -7.878 8.304 13.676 1.00 0.00 H new ATOM 299 N GLU A 22 -7.105 6.347 11.692 1.00 0.00 N ATOM 300 CA GLU A 22 -7.115 4.916 11.415 1.00 0.00 C ATOM 301 C GLU A 22 -6.265 4.506 10.196 1.00 0.00 C ATOM 302 O GLU A 22 -6.250 3.326 9.836 1.00 0.00 O ATOM 303 CB GLU A 22 -8.575 4.448 11.314 1.00 0.00 C ATOM 304 CG GLU A 22 -9.258 4.734 9.965 1.00 0.00 C ATOM 305 CD GLU A 22 -10.760 4.986 10.125 1.00 0.00 C ATOM 306 OE1 GLU A 22 -11.131 6.155 10.369 1.00 0.00 O ATOM 307 OE2 GLU A 22 -11.581 4.037 10.043 1.00 0.00 O ATOM 0 H GLU A 22 -8.019 6.780 11.560 1.00 0.00 H new ATOM 0 HA GLU A 22 -6.627 4.404 12.245 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -8.611 3.375 11.502 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -9.151 4.929 12.105 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -8.792 5.603 9.500 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -9.101 3.890 9.293 1.00 0.00 H new ATOM 314 N SER A 23 -5.578 5.456 9.550 1.00 0.00 N ATOM 315 CA SER A 23 -4.623 5.238 8.478 1.00 0.00 C ATOM 316 C SER A 23 -3.334 6.067 8.640 1.00 0.00 C ATOM 317 O SER A 23 -2.318 5.651 8.090 1.00 0.00 O ATOM 318 CB SER A 23 -5.307 5.488 7.127 1.00 0.00 C ATOM 319 OG SER A 23 -4.964 4.466 6.204 1.00 0.00 O ATOM 0 H SER A 23 -5.685 6.444 9.779 1.00 0.00 H new ATOM 0 HA SER A 23 -4.297 4.199 8.523 1.00 0.00 H new ATOM 0 HB2 SER A 23 -6.388 5.519 7.260 1.00 0.00 H new ATOM 0 HB3 SER A 23 -5.006 6.459 6.733 1.00 0.00 H new ATOM 0 HG SER A 23 -4.157 4.726 5.713 1.00 0.00 H new ATOM 325 N THR A 24 -3.302 7.189 9.369 1.00 0.00 N ATOM 326 CA THR A 24 -2.094 7.919 9.703 1.00 0.00 C ATOM 327 C THR A 24 -1.185 6.992 10.510 1.00 0.00 C ATOM 328 O THR A 24 -1.511 6.661 11.647 1.00 0.00 O ATOM 329 CB THR A 24 -2.448 9.198 10.498 1.00 0.00 C ATOM 330 OG1 THR A 24 -3.620 9.802 9.997 1.00 0.00 O ATOM 331 CG2 THR A 24 -1.356 10.267 10.395 1.00 0.00 C ATOM 0 H THR A 24 -4.145 7.619 9.749 1.00 0.00 H new ATOM 0 HA THR A 24 -1.574 8.234 8.799 1.00 0.00 H new ATOM 0 HB THR A 24 -2.570 8.868 11.530 1.00 0.00 H new ATOM 0 HG1 THR A 24 -3.822 10.607 10.518 1.00 0.00 H new ATOM 0 HG21 THR A 24 -1.651 11.145 10.970 1.00 0.00 H new ATOM 0 HG22 THR A 24 -0.421 9.871 10.791 1.00 0.00 H new ATOM 0 HG23 THR A 24 -1.218 10.546 9.351 1.00 0.00 H new ATOM 339 N ASN A 25 -0.047 6.603 9.927 1.00 0.00 N ATOM 340 CA ASN A 25 1.058 5.913 10.596 1.00 0.00 C ATOM 341 C ASN A 25 0.760 4.436 10.839 1.00 0.00 C ATOM 342 O ASN A 25 1.362 3.813 11.715 1.00 0.00 O ATOM 343 CB ASN A 25 1.517 6.625 11.880 1.00 0.00 C ATOM 344 CG ASN A 25 1.652 8.126 11.708 1.00 0.00 C ATOM 345 OD1 ASN A 25 2.219 8.587 10.724 1.00 0.00 O ATOM 346 ND2 ASN A 25 1.057 8.913 12.588 1.00 0.00 N ATOM 0 H ASN A 25 0.136 6.767 8.937 1.00 0.00 H new ATOM 0 HA ASN A 25 1.898 5.957 9.903 1.00 0.00 H new ATOM 0 HB2 ASN A 25 0.804 6.419 12.678 1.00 0.00 H new ATOM 0 HB3 ASN A 25 2.476 6.213 12.195 1.00 0.00 H new ATOM 0 HD21 ASN A 25 1.064 9.924 12.455 1.00 0.00 H new ATOM 0 HD22 ASN A 25 0.591 8.509 13.400 1.00 0.00 H new ATOM 353 N PHE A 26 -0.128 3.843 10.039 1.00 0.00 N ATOM 354 CA PHE A 26 -0.672 2.529 10.347 1.00 0.00 C ATOM 355 C PHE A 26 0.355 1.454 9.982 1.00 0.00 C ATOM 356 O PHE A 26 1.235 1.655 9.141 1.00 0.00 O ATOM 357 CB PHE A 26 -1.977 2.298 9.564 1.00 0.00 C ATOM 358 CG PHE A 26 -1.785 1.836 8.129 1.00 0.00 C ATOM 359 CD1 PHE A 26 -1.149 2.667 7.188 1.00 0.00 C ATOM 360 CD2 PHE A 26 -2.150 0.525 7.765 1.00 0.00 C ATOM 361 CE1 PHE A 26 -0.826 2.172 5.917 1.00 0.00 C ATOM 362 CE2 PHE A 26 -1.820 0.032 6.492 1.00 0.00 C ATOM 363 CZ PHE A 26 -1.121 0.842 5.586 1.00 0.00 C ATOM 0 H PHE A 26 -0.482 4.255 9.176 1.00 0.00 H new ATOM 0 HA PHE A 26 -0.891 2.473 11.413 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -2.575 1.556 10.093 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -2.550 3.225 9.559 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -0.909 3.688 7.446 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -2.684 -0.101 8.465 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -0.350 2.816 5.192 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -2.105 -0.971 6.211 1.00 0.00 H new ATOM 0 HZ PHE A 26 -0.810 0.441 4.633 1.00 0.00 H new ATOM 373 N THR A 27 0.262 0.299 10.631 1.00 0.00 N ATOM 374 CA THR A 27 1.135 -0.838 10.377 1.00 0.00 C ATOM 375 C THR A 27 0.492 -1.735 9.321 1.00 0.00 C ATOM 376 O THR A 27 -0.722 -1.976 9.374 1.00 0.00 O ATOM 377 CB THR A 27 1.315 -1.595 11.700 1.00 0.00 C ATOM 378 OG1 THR A 27 1.584 -0.720 12.784 1.00 0.00 O ATOM 379 CG2 THR A 27 2.419 -2.640 11.638 1.00 0.00 C ATOM 0 H THR A 27 -0.432 0.125 11.358 1.00 0.00 H new ATOM 0 HA THR A 27 2.108 -0.516 10.005 1.00 0.00 H new ATOM 0 HB THR A 27 0.363 -2.100 11.865 1.00 0.00 H new ATOM 0 HG1 THR A 27 1.690 -1.242 13.607 1.00 0.00 H new ATOM 0 HG21 THR A 27 2.499 -3.142 12.602 1.00 0.00 H new ATOM 0 HG22 THR A 27 2.184 -3.372 10.866 1.00 0.00 H new ATOM 0 HG23 THR A 27 3.366 -2.155 11.402 1.00 0.00 H new ATOM 387 N VAL A 28 1.299 -2.290 8.418 1.00 0.00 N ATOM 388 CA VAL A 28 0.896 -3.384 7.549 1.00 0.00 C ATOM 389 C VAL A 28 1.350 -4.669 8.216 1.00 0.00 C ATOM 390 O VAL A 28 2.517 -4.826 8.585 1.00 0.00 O ATOM 391 CB VAL A 28 1.447 -3.241 6.124 1.00 0.00 C ATOM 392 CG1 VAL A 28 0.819 -4.266 5.174 1.00 0.00 C ATOM 393 CG2 VAL A 28 1.174 -1.846 5.576 1.00 0.00 C ATOM 0 H VAL A 28 2.261 -1.986 8.271 1.00 0.00 H new ATOM 0 HA VAL A 28 -0.187 -3.382 7.423 1.00 0.00 H new ATOM 0 HB VAL A 28 2.521 -3.415 6.182 1.00 0.00 H new ATOM 0 HG11 VAL A 28 1.232 -4.136 4.174 1.00 0.00 H new ATOM 0 HG12 VAL A 28 1.038 -5.273 5.529 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -0.261 -4.119 5.143 1.00 0.00 H new ATOM 0 HG21 VAL A 28 1.573 -1.768 4.565 1.00 0.00 H new ATOM 0 HG22 VAL A 28 0.099 -1.667 5.556 1.00 0.00 H new ATOM 0 HG23 VAL A 28 1.654 -1.104 6.214 1.00 0.00 H new ATOM 403 N ASP A 29 0.405 -5.591 8.348 1.00 0.00 N ATOM 404 CA ASP A 29 0.660 -6.999 8.595 1.00 0.00 C ATOM 405 C ASP A 29 1.052 -7.568 7.251 1.00 0.00 C ATOM 406 O ASP A 29 0.225 -7.693 6.352 1.00 0.00 O ATOM 407 CB ASP A 29 -0.609 -7.652 9.163 1.00 0.00 C ATOM 408 CG ASP A 29 -0.862 -9.058 8.605 1.00 0.00 C ATOM 409 OD1 ASP A 29 -0.002 -9.939 8.809 1.00 0.00 O ATOM 410 OD2 ASP A 29 -1.927 -9.274 7.978 1.00 0.00 O ATOM 0 H ASP A 29 -0.589 -5.370 8.284 1.00 0.00 H new ATOM 0 HA ASP A 29 1.448 -7.177 9.327 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -0.527 -7.707 10.249 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -1.468 -7.019 8.940 1.00 0.00 H new ATOM 415 N LEU A 30 2.344 -7.848 7.127 1.00 0.00 N ATOM 416 CA LEU A 30 2.816 -8.927 6.303 1.00 0.00 C ATOM 417 C LEU A 30 3.165 -10.028 7.292 1.00 0.00 C ATOM 418 O LEU A 30 3.973 -9.835 8.202 1.00 0.00 O ATOM 419 CB LEU A 30 4.033 -8.498 5.468 1.00 0.00 C ATOM 420 CG LEU A 30 3.726 -8.468 3.972 1.00 0.00 C ATOM 421 CD1 LEU A 30 2.876 -7.241 3.604 1.00 0.00 C ATOM 422 CD2 LEU A 30 5.060 -8.464 3.213 1.00 0.00 C ATOM 0 H LEU A 30 3.084 -7.328 7.599 1.00 0.00 H new ATOM 0 HA LEU A 30 2.074 -9.254 5.575 1.00 0.00 H new ATOM 0 HB2 LEU A 30 4.362 -7.510 5.789 1.00 0.00 H new ATOM 0 HB3 LEU A 30 4.859 -9.185 5.654 1.00 0.00 H new ATOM 0 HG LEU A 30 3.144 -9.347 3.696 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.673 -7.247 2.533 1.00 0.00 H new ATOM 0 HD12 LEU A 30 1.934 -7.273 4.152 1.00 0.00 H new ATOM 0 HD13 LEU A 30 3.417 -6.332 3.866 1.00 0.00 H new ATOM 0 HD21 LEU A 30 4.868 -8.443 2.140 1.00 0.00 H new ATOM 0 HD22 LEU A 30 5.637 -7.584 3.496 1.00 0.00 H new ATOM 0 HD23 LEU A 30 5.624 -9.363 3.463 1.00 0.00 H new ATOM 434 N MET A 31 2.516 -11.169 7.116 1.00 0.00 N ATOM 435 CA MET A 31 2.914 -12.483 7.616 1.00 0.00 C ATOM 436 C MET A 31 4.411 -12.791 7.355 1.00 0.00 C ATOM 437 O MET A 31 5.176 -11.986 6.813 1.00 0.00 O ATOM 438 CB MET A 31 1.981 -13.549 6.992 1.00 0.00 C ATOM 439 CG MET A 31 2.462 -13.949 5.587 1.00 0.00 C ATOM 440 SD MET A 31 1.269 -14.604 4.414 1.00 0.00 S ATOM 441 CE MET A 31 0.438 -13.046 4.071 1.00 0.00 C ATOM 0 H MET A 31 1.644 -11.208 6.589 1.00 0.00 H new ATOM 0 HA MET A 31 2.807 -12.497 8.701 1.00 0.00 H new ATOM 0 HB2 MET A 31 1.949 -14.430 7.634 1.00 0.00 H new ATOM 0 HB3 MET A 31 0.965 -13.159 6.935 1.00 0.00 H new ATOM 0 HG2 MET A 31 2.922 -13.071 5.134 1.00 0.00 H new ATOM 0 HG3 MET A 31 3.249 -14.694 5.708 1.00 0.00 H new ATOM 0 HE1 MET A 31 0.414 -12.876 2.995 1.00 0.00 H new ATOM 0 HE2 MET A 31 -0.581 -13.085 4.455 1.00 0.00 H new ATOM 0 HE3 MET A 31 0.977 -12.232 4.556 1.00 0.00 H new ATOM 451 N GLU A 32 4.824 -14.025 7.639 1.00 0.00 N ATOM 452 CA GLU A 32 6.222 -14.453 7.454 1.00 0.00 C ATOM 453 C GLU A 32 6.467 -14.934 6.016 1.00 0.00 C ATOM 454 O GLU A 32 5.558 -15.431 5.345 1.00 0.00 O ATOM 455 CB GLU A 32 6.621 -15.534 8.486 1.00 0.00 C ATOM 456 CG GLU A 32 7.319 -14.928 9.719 1.00 0.00 C ATOM 457 CD GLU A 32 6.558 -15.153 11.025 1.00 0.00 C ATOM 458 OE1 GLU A 32 5.503 -14.516 11.247 1.00 0.00 O ATOM 459 OE2 GLU A 32 7.024 -15.975 11.846 1.00 0.00 O ATOM 0 H GLU A 32 4.211 -14.755 8.001 1.00 0.00 H new ATOM 0 HA GLU A 32 6.860 -13.586 7.626 1.00 0.00 H new ATOM 0 HB2 GLU A 32 5.731 -16.077 8.804 1.00 0.00 H new ATOM 0 HB3 GLU A 32 7.285 -16.258 8.014 1.00 0.00 H new ATOM 0 HG2 GLU A 32 8.316 -15.359 9.810 1.00 0.00 H new ATOM 0 HG3 GLU A 32 7.448 -13.857 9.563 1.00 0.00 H new ATOM 466 N ASN A 33 7.691 -14.802 5.506 1.00 0.00 N ATOM 467 CA ASN A 33 8.037 -14.991 4.095 1.00 0.00 C ATOM 468 C ASN A 33 9.305 -15.777 3.878 1.00 0.00 C ATOM 469 O ASN A 33 10.307 -15.199 3.510 1.00 0.00 O ATOM 470 CB ASN A 33 7.908 -13.730 3.212 1.00 0.00 C ATOM 471 CG ASN A 33 8.038 -12.355 3.866 1.00 0.00 C ATOM 472 OD1 ASN A 33 8.339 -12.159 5.041 1.00 0.00 O ATOM 473 ND2 ASN A 33 7.764 -11.344 3.066 1.00 0.00 N ATOM 0 H ASN A 33 8.496 -14.553 6.081 1.00 0.00 H new ATOM 0 HA ASN A 33 7.243 -15.636 3.718 1.00 0.00 H new ATOM 0 HB2 ASN A 33 8.665 -13.796 2.430 1.00 0.00 H new ATOM 0 HB3 ASN A 33 6.936 -13.770 2.719 1.00 0.00 H new ATOM 0 HD21 ASN A 33 7.801 -10.388 3.421 1.00 0.00 H new ATOM 0 HD22 ASN A 33 7.515 -11.517 2.092 1.00 0.00 H new ATOM 480 N ALA A 34 9.265 -17.097 4.057 1.00 0.00 N ATOM 481 CA ALA A 34 10.446 -17.938 3.945 1.00 0.00 C ATOM 482 C ALA A 34 11.295 -17.596 2.717 1.00 0.00 C ATOM 483 O ALA A 34 10.796 -17.554 1.594 1.00 0.00 O ATOM 484 CB ALA A 34 10.049 -19.413 3.957 1.00 0.00 C ATOM 0 H ALA A 34 8.412 -17.608 4.283 1.00 0.00 H new ATOM 0 HA ALA A 34 11.073 -17.739 4.814 1.00 0.00 H new ATOM 0 HB1 ALA A 34 10.943 -20.031 3.872 1.00 0.00 H new ATOM 0 HB2 ALA A 34 9.535 -19.644 4.890 1.00 0.00 H new ATOM 0 HB3 ALA A 34 9.385 -19.618 3.117 1.00 0.00 H new ATOM 490 N ALA A 35 12.568 -17.288 2.956 1.00 0.00 N ATOM 491 CA ALA A 35 13.482 -16.690 1.998 1.00 0.00 C ATOM 492 C ALA A 35 13.571 -17.512 0.710 1.00 0.00 C ATOM 493 O ALA A 35 13.743 -16.953 -0.370 1.00 0.00 O ATOM 494 CB ALA A 35 14.858 -16.559 2.661 1.00 0.00 C ATOM 0 H ALA A 35 13.005 -17.457 3.862 1.00 0.00 H new ATOM 0 HA ALA A 35 13.110 -15.706 1.713 1.00 0.00 H new ATOM 0 HB1 ALA A 35 15.560 -16.111 1.957 1.00 0.00 H new ATOM 0 HB2 ALA A 35 14.777 -15.926 3.545 1.00 0.00 H new ATOM 0 HB3 ALA A 35 15.217 -17.546 2.953 1.00 0.00 H new ATOM 500 N LYS A 36 13.422 -18.834 0.812 1.00 0.00 N ATOM 501 CA LYS A 36 13.655 -19.760 -0.286 1.00 0.00 C ATOM 502 C LYS A 36 12.750 -19.540 -1.497 1.00 0.00 C ATOM 503 O LYS A 36 13.168 -19.903 -2.595 1.00 0.00 O ATOM 504 CB LYS A 36 13.566 -21.209 0.214 1.00 0.00 C ATOM 505 CG LYS A 36 12.175 -21.634 0.722 1.00 0.00 C ATOM 506 CD LYS A 36 12.079 -23.145 0.960 1.00 0.00 C ATOM 507 CE LYS A 36 12.193 -23.927 -0.358 1.00 0.00 C ATOM 508 NZ LYS A 36 11.963 -25.372 -0.175 1.00 0.00 N ATOM 0 H LYS A 36 13.131 -19.293 1.675 1.00 0.00 H new ATOM 0 HA LYS A 36 14.664 -19.557 -0.644 1.00 0.00 H new ATOM 0 HB2 LYS A 36 13.861 -21.876 -0.596 1.00 0.00 H new ATOM 0 HB3 LYS A 36 14.288 -21.346 1.019 1.00 0.00 H new ATOM 0 HG2 LYS A 36 11.953 -21.107 1.650 1.00 0.00 H new ATOM 0 HG3 LYS A 36 11.419 -21.334 -0.003 1.00 0.00 H new ATOM 0 HD2 LYS A 36 12.870 -23.459 1.641 1.00 0.00 H new ATOM 0 HD3 LYS A 36 11.131 -23.379 1.443 1.00 0.00 H new ATOM 0 HE2 LYS A 36 11.471 -23.535 -1.074 1.00 0.00 H new ATOM 0 HE3 LYS A 36 13.183 -23.771 -0.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 12.050 -25.856 -1.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 12.668 -25.755 0.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 11.008 -25.526 0.208 1.00 0.00 H new ATOM 522 N GLN A 37 11.540 -18.992 -1.333 1.00 0.00 N ATOM 523 CA GLN A 37 10.600 -18.883 -2.451 1.00 0.00 C ATOM 524 C GLN A 37 11.012 -17.804 -3.453 1.00 0.00 C ATOM 525 O GLN A 37 10.500 -17.782 -4.570 1.00 0.00 O ATOM 526 CB GLN A 37 9.160 -18.606 -1.978 1.00 0.00 C ATOM 527 CG GLN A 37 9.071 -17.460 -0.957 1.00 0.00 C ATOM 528 CD GLN A 37 7.811 -16.606 -1.001 1.00 0.00 C ATOM 529 OE1 GLN A 37 7.483 -16.001 0.129 1.00 0.00 O flip ATOM 530 NE2 GLN A 37 7.113 -16.477 -2.007 1.00 0.00 N flip ATOM 0 H GLN A 37 11.193 -18.622 -0.448 1.00 0.00 H new ATOM 0 HA GLN A 37 10.628 -19.853 -2.947 1.00 0.00 H new ATOM 0 HB2 GLN A 37 8.540 -18.364 -2.842 1.00 0.00 H new ATOM 0 HB3 GLN A 37 8.749 -19.513 -1.534 1.00 0.00 H new ATOM 0 HG2 GLN A 37 9.159 -17.886 0.042 1.00 0.00 H new ATOM 0 HG3 GLN A 37 9.931 -16.806 -1.102 1.00 0.00 H new ATOM 0 HE21 GLN A 37 7.375 -16.948 -2.873 1.00 0.00 H new ATOM 0 HE22 GLN A 37 6.273 -15.899 -1.974 1.00 0.00 H new ATOM 539 N PHE A 38 11.892 -16.881 -3.069 1.00 0.00 N ATOM 540 CA PHE A 38 12.252 -15.758 -3.912 1.00 0.00 C ATOM 541 C PHE A 38 13.413 -16.188 -4.799 1.00 0.00 C ATOM 542 O PHE A 38 14.560 -15.820 -4.558 1.00 0.00 O ATOM 543 CB PHE A 38 12.571 -14.559 -3.027 1.00 0.00 C ATOM 544 CG PHE A 38 11.408 -14.095 -2.165 1.00 0.00 C ATOM 545 CD1 PHE A 38 10.378 -13.299 -2.706 1.00 0.00 C ATOM 546 CD2 PHE A 38 11.406 -14.390 -0.790 1.00 0.00 C ATOM 547 CE1 PHE A 38 9.389 -12.760 -1.864 1.00 0.00 C ATOM 548 CE2 PHE A 38 10.407 -13.876 0.050 1.00 0.00 C ATOM 549 CZ PHE A 38 9.408 -13.045 -0.485 1.00 0.00 C ATOM 0 H PHE A 38 12.370 -16.896 -2.168 1.00 0.00 H new ATOM 0 HA PHE A 38 11.436 -15.453 -4.567 1.00 0.00 H new ATOM 0 HB2 PHE A 38 13.410 -14.812 -2.379 1.00 0.00 H new ATOM 0 HB3 PHE A 38 12.894 -13.731 -3.658 1.00 0.00 H new ATOM 0 HD1 PHE A 38 10.348 -13.103 -3.768 1.00 0.00 H new ATOM 0 HD2 PHE A 38 12.181 -15.018 -0.377 1.00 0.00 H new ATOM 0 HE1 PHE A 38 8.615 -12.128 -2.275 1.00 0.00 H new ATOM 0 HE2 PHE A 38 10.406 -14.118 1.103 1.00 0.00 H new ATOM 0 HZ PHE A 38 8.653 -12.624 0.163 1.00 0.00 H new ATOM 559 N ASN A 39 13.115 -17.022 -5.794 1.00 0.00 N ATOM 560 CA ASN A 39 14.110 -17.743 -6.577 1.00 0.00 C ATOM 561 C ASN A 39 14.135 -17.321 -8.049 1.00 0.00 C ATOM 562 O ASN A 39 14.646 -18.062 -8.888 1.00 0.00 O ATOM 563 CB ASN A 39 13.969 -19.261 -6.379 1.00 0.00 C ATOM 564 CG ASN A 39 12.706 -19.810 -7.021 1.00 0.00 C ATOM 565 OD1 ASN A 39 11.604 -19.517 -6.576 1.00 0.00 O ATOM 566 ND2 ASN A 39 12.819 -20.604 -8.065 1.00 0.00 N ATOM 0 H ASN A 39 12.156 -17.217 -6.082 1.00 0.00 H new ATOM 0 HA ASN A 39 15.092 -17.462 -6.195 1.00 0.00 H new ATOM 0 HB2 ASN A 39 14.838 -19.763 -6.804 1.00 0.00 H new ATOM 0 HB3 ASN A 39 13.960 -19.487 -5.313 1.00 0.00 H new ATOM 0 HD21 ASN A 39 11.983 -20.982 -8.511 1.00 0.00 H new ATOM 0 HD22 ASN A 39 13.742 -20.842 -8.428 1.00 0.00 H new ATOM 573 N ASN A 40 13.630 -16.123 -8.354 1.00 0.00 N ATOM 574 CA ASN A 40 13.647 -15.391 -9.631 1.00 0.00 C ATOM 575 C ASN A 40 13.096 -13.991 -9.348 1.00 0.00 C ATOM 576 O ASN A 40 12.866 -13.657 -8.189 1.00 0.00 O ATOM 577 CB ASN A 40 12.808 -16.110 -10.699 1.00 0.00 C ATOM 578 CG ASN A 40 11.449 -16.531 -10.159 1.00 0.00 C ATOM 579 OD1 ASN A 40 10.603 -15.683 -9.899 1.00 0.00 O ATOM 580 ND2 ASN A 40 11.225 -17.822 -9.978 1.00 0.00 N ATOM 0 H ASN A 40 13.147 -15.581 -7.638 1.00 0.00 H new ATOM 0 HA ASN A 40 14.661 -15.335 -10.026 1.00 0.00 H new ATOM 0 HB2 ASN A 40 12.671 -15.452 -11.557 1.00 0.00 H new ATOM 0 HB3 ASN A 40 13.347 -16.989 -11.054 1.00 0.00 H new ATOM 0 HD21 ASN A 40 10.327 -18.137 -9.612 1.00 0.00 H new ATOM 0 HD22 ASN A 40 11.951 -18.502 -10.205 1.00 0.00 H new ATOM 587 N ILE A 41 12.947 -13.147 -10.372 1.00 0.00 N ATOM 588 CA ILE A 41 12.766 -11.701 -10.226 1.00 0.00 C ATOM 589 C ILE A 41 11.304 -11.294 -10.493 1.00 0.00 C ATOM 590 O ILE A 41 10.887 -10.201 -10.102 1.00 0.00 O ATOM 591 CB ILE A 41 13.838 -10.997 -11.101 1.00 0.00 C ATOM 592 CG1 ILE A 41 15.261 -11.212 -10.518 1.00 0.00 C ATOM 593 CG2 ILE A 41 13.624 -9.481 -11.253 1.00 0.00 C ATOM 594 CD1 ILE A 41 16.008 -12.412 -11.115 1.00 0.00 C ATOM 0 H ILE A 41 12.949 -13.456 -11.344 1.00 0.00 H new ATOM 0 HA ILE A 41 12.931 -11.370 -9.201 1.00 0.00 H new ATOM 0 HB ILE A 41 13.736 -11.457 -12.084 1.00 0.00 H new ATOM 0 HG12 ILE A 41 15.851 -10.311 -10.686 1.00 0.00 H new ATOM 0 HG13 ILE A 41 15.183 -11.346 -9.439 1.00 0.00 H new ATOM 0 HG21 ILE A 41 14.413 -9.063 -11.878 1.00 0.00 H new ATOM 0 HG22 ILE A 41 12.656 -9.295 -11.719 1.00 0.00 H new ATOM 0 HG23 ILE A 41 13.651 -9.009 -10.271 1.00 0.00 H new ATOM 0 HD11 ILE A 41 16.993 -12.493 -10.655 1.00 0.00 H new ATOM 0 HD12 ILE A 41 15.442 -13.324 -10.924 1.00 0.00 H new ATOM 0 HD13 ILE A 41 16.120 -12.273 -12.190 1.00 0.00 H new ATOM 606 N GLY A 42 10.479 -12.185 -11.053 1.00 0.00 N ATOM 607 CA GLY A 42 9.026 -12.038 -11.040 1.00 0.00 C ATOM 608 C GLY A 42 8.410 -12.531 -9.727 1.00 0.00 C ATOM 609 O GLY A 42 7.187 -12.459 -9.565 1.00 0.00 O ATOM 0 H GLY A 42 10.803 -13.028 -11.527 1.00 0.00 H new ATOM 0 HA2 GLY A 42 8.766 -10.990 -11.191 1.00 0.00 H new ATOM 0 HA3 GLY A 42 8.598 -12.596 -11.873 1.00 0.00 H new ATOM 613 N ALA A 43 9.231 -13.056 -8.803 1.00 0.00 N ATOM 614 CA ALA A 43 8.787 -13.705 -7.581 1.00 0.00 C ATOM 615 C ALA A 43 8.087 -12.681 -6.698 1.00 0.00 C ATOM 616 O ALA A 43 8.713 -11.854 -6.029 1.00 0.00 O ATOM 617 CB ALA A 43 9.962 -14.342 -6.837 1.00 0.00 C ATOM 0 H ALA A 43 10.246 -13.035 -8.898 1.00 0.00 H new ATOM 0 HA ALA A 43 8.090 -14.503 -7.837 1.00 0.00 H new ATOM 0 HB1 ALA A 43 9.600 -14.820 -5.927 1.00 0.00 H new ATOM 0 HB2 ALA A 43 10.435 -15.088 -7.475 1.00 0.00 H new ATOM 0 HB3 ALA A 43 10.689 -13.572 -6.578 1.00 0.00 H new ATOM 623 N THR A 44 6.768 -12.744 -6.698 1.00 0.00 N ATOM 624 CA THR A 44 5.890 -11.878 -5.943 1.00 0.00 C ATOM 625 C THR A 44 5.278 -12.727 -4.834 1.00 0.00 C ATOM 626 O THR A 44 5.028 -13.922 -5.023 1.00 0.00 O ATOM 627 CB THR A 44 4.875 -11.229 -6.909 1.00 0.00 C ATOM 628 OG1 THR A 44 4.589 -12.067 -8.017 1.00 0.00 O ATOM 629 CG2 THR A 44 5.465 -9.960 -7.520 1.00 0.00 C ATOM 0 H THR A 44 6.259 -13.434 -7.251 1.00 0.00 H new ATOM 0 HA THR A 44 6.403 -11.043 -5.466 1.00 0.00 H new ATOM 0 HB THR A 44 3.979 -11.037 -6.318 1.00 0.00 H new ATOM 0 HG1 THR A 44 5.365 -12.096 -8.614 1.00 0.00 H new ATOM 0 HG21 THR A 44 4.740 -9.512 -8.199 1.00 0.00 H new ATOM 0 HG22 THR A 44 5.705 -9.252 -6.727 1.00 0.00 H new ATOM 0 HG23 THR A 44 6.372 -10.209 -8.071 1.00 0.00 H new ATOM 637 N THR A 45 5.092 -12.147 -3.648 1.00 0.00 N ATOM 638 CA THR A 45 4.384 -12.852 -2.582 1.00 0.00 C ATOM 639 C THR A 45 2.857 -12.657 -2.696 1.00 0.00 C ATOM 640 O THR A 45 2.424 -11.698 -3.331 1.00 0.00 O ATOM 641 CB THR A 45 4.954 -12.474 -1.201 1.00 0.00 C ATOM 642 OG1 THR A 45 5.624 -11.245 -1.074 1.00 0.00 O ATOM 643 CG2 THR A 45 6.038 -13.449 -0.805 1.00 0.00 C ATOM 0 H THR A 45 5.414 -11.210 -3.405 1.00 0.00 H new ATOM 0 HA THR A 45 4.553 -13.923 -2.698 1.00 0.00 H new ATOM 0 HB THR A 45 4.044 -12.456 -0.601 1.00 0.00 H new ATOM 0 HG1 THR A 45 6.069 -11.026 -1.919 1.00 0.00 H new ATOM 0 HG21 THR A 45 6.435 -13.174 0.172 1.00 0.00 H new ATOM 0 HG22 THR A 45 5.623 -14.456 -0.758 1.00 0.00 H new ATOM 0 HG23 THR A 45 6.839 -13.422 -1.543 1.00 0.00 H new ATOM 651 N PRO A 46 2.047 -13.519 -2.046 1.00 0.00 N ATOM 652 CA PRO A 46 0.580 -13.439 -2.043 1.00 0.00 C ATOM 653 C PRO A 46 0.094 -12.125 -1.435 1.00 0.00 C ATOM 654 O PRO A 46 0.138 -11.991 -0.216 1.00 0.00 O ATOM 655 CB PRO A 46 0.080 -14.645 -1.225 1.00 0.00 C ATOM 656 CG PRO A 46 1.310 -15.229 -0.546 1.00 0.00 C ATOM 657 CD PRO A 46 2.500 -14.710 -1.336 1.00 0.00 C ATOM 0 HA PRO A 46 0.190 -13.464 -3.060 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -0.663 -14.337 -0.489 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -0.397 -15.383 -1.870 1.00 0.00 H new ATOM 0 HG2 PRO A 46 1.366 -14.918 0.497 1.00 0.00 H new ATOM 0 HG3 PRO A 46 1.281 -16.319 -0.552 1.00 0.00 H new ATOM 0 HD2 PRO A 46 3.331 -14.472 -0.672 1.00 0.00 H new ATOM 0 HD3 PRO A 46 2.858 -15.465 -2.036 1.00 0.00 H new ATOM 665 N VAL A 47 -0.313 -11.153 -2.253 1.00 0.00 N ATOM 666 CA VAL A 47 -0.591 -9.778 -1.848 1.00 0.00 C ATOM 667 C VAL A 47 -1.565 -9.689 -0.656 1.00 0.00 C ATOM 668 O VAL A 47 -2.399 -10.579 -0.472 1.00 0.00 O ATOM 669 CB VAL A 47 -1.039 -8.989 -3.103 1.00 0.00 C ATOM 670 CG1 VAL A 47 -2.553 -8.794 -3.224 1.00 0.00 C ATOM 671 CG2 VAL A 47 -0.243 -7.688 -3.225 1.00 0.00 C ATOM 0 H VAL A 47 -0.463 -11.309 -3.250 1.00 0.00 H new ATOM 0 HA VAL A 47 0.315 -9.314 -1.458 1.00 0.00 H new ATOM 0 HB VAL A 47 -0.801 -9.610 -3.967 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -2.776 -8.232 -4.131 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -3.043 -9.767 -3.270 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -2.919 -8.244 -2.357 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -0.569 -7.144 -4.112 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -0.412 -7.074 -2.340 1.00 0.00 H new ATOM 0 HG23 VAL A 47 0.819 -7.918 -3.310 1.00 0.00 H new ATOM 681 N VAL A 48 -1.488 -8.605 0.127 1.00 0.00 N ATOM 682 CA VAL A 48 -2.262 -8.428 1.359 1.00 0.00 C ATOM 683 C VAL A 48 -2.958 -7.053 1.305 1.00 0.00 C ATOM 684 O VAL A 48 -2.323 -6.103 0.833 1.00 0.00 O ATOM 685 CB VAL A 48 -1.299 -8.642 2.557 1.00 0.00 C ATOM 686 CG1 VAL A 48 -0.769 -7.360 3.203 1.00 0.00 C ATOM 687 CG2 VAL A 48 -1.889 -9.546 3.638 1.00 0.00 C ATOM 0 H VAL A 48 -0.877 -7.816 -0.082 1.00 0.00 H new ATOM 0 HA VAL A 48 -3.064 -9.156 1.478 1.00 0.00 H new ATOM 0 HB VAL A 48 -0.446 -9.138 2.095 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -0.106 -7.616 4.029 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -0.219 -6.780 2.462 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -1.605 -6.769 3.578 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -1.171 -9.659 4.450 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -2.806 -9.101 4.024 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -2.112 -10.524 3.212 1.00 0.00 H new ATOM 697 N PRO A 49 -4.228 -6.907 1.735 1.00 0.00 N ATOM 698 CA PRO A 49 -5.048 -5.720 1.462 1.00 0.00 C ATOM 699 C PRO A 49 -4.716 -4.510 2.351 1.00 0.00 C ATOM 700 O PRO A 49 -4.112 -4.644 3.422 1.00 0.00 O ATOM 701 CB PRO A 49 -6.493 -6.180 1.684 1.00 0.00 C ATOM 702 CG PRO A 49 -6.350 -7.262 2.750 1.00 0.00 C ATOM 703 CD PRO A 49 -5.043 -7.941 2.358 1.00 0.00 C ATOM 0 HA PRO A 49 -4.860 -5.362 0.450 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -7.129 -5.362 2.022 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -6.937 -6.572 0.769 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -6.302 -6.839 3.754 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -7.189 -7.958 2.737 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -4.543 -8.359 3.231 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -5.223 -8.766 1.668 1.00 0.00 H new ATOM 711 N PHE A 50 -5.131 -3.319 1.910 1.00 0.00 N ATOM 712 CA PHE A 50 -4.849 -1.996 2.467 1.00 0.00 C ATOM 713 C PHE A 50 -5.805 -0.969 1.835 1.00 0.00 C ATOM 714 O PHE A 50 -6.494 -1.261 0.856 1.00 0.00 O ATOM 715 CB PHE A 50 -3.363 -1.698 2.204 1.00 0.00 C ATOM 716 CG PHE A 50 -2.873 -0.271 2.048 1.00 0.00 C ATOM 717 CD1 PHE A 50 -3.003 0.667 3.086 1.00 0.00 C ATOM 718 CD2 PHE A 50 -2.127 0.068 0.906 1.00 0.00 C ATOM 719 CE1 PHE A 50 -2.429 1.944 2.958 1.00 0.00 C ATOM 720 CE2 PHE A 50 -1.516 1.325 0.800 1.00 0.00 C ATOM 721 CZ PHE A 50 -1.667 2.270 1.825 1.00 0.00 C ATOM 0 H PHE A 50 -5.724 -3.252 1.083 1.00 0.00 H new ATOM 0 HA PHE A 50 -5.019 -1.948 3.543 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -2.797 -2.143 3.022 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -3.085 -2.233 1.296 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -3.545 0.407 3.983 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -2.024 -0.647 0.103 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -2.575 2.679 3.736 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -0.928 1.566 -0.073 1.00 0.00 H new ATOM 0 HZ PHE A 50 -1.201 3.241 1.743 1.00 0.00 H new ATOM 731 N ARG A 51 -5.880 0.238 2.400 1.00 0.00 N ATOM 732 CA ARG A 51 -6.529 1.431 1.858 1.00 0.00 C ATOM 733 C ARG A 51 -5.969 2.645 2.597 1.00 0.00 C ATOM 734 O ARG A 51 -5.401 2.464 3.675 1.00 0.00 O ATOM 735 CB ARG A 51 -8.060 1.311 1.976 1.00 0.00 C ATOM 736 CG ARG A 51 -8.671 0.886 3.329 1.00 0.00 C ATOM 737 CD ARG A 51 -8.770 2.011 4.367 1.00 0.00 C ATOM 738 NE ARG A 51 -7.611 2.067 5.275 1.00 0.00 N ATOM 739 CZ ARG A 51 -7.587 1.859 6.596 1.00 0.00 C ATOM 740 NH1 ARG A 51 -8.612 1.309 7.234 1.00 0.00 N ATOM 741 NH2 ARG A 51 -6.512 2.249 7.268 1.00 0.00 N ATOM 0 H ARG A 51 -5.459 0.419 3.311 1.00 0.00 H new ATOM 0 HA ARG A 51 -6.319 1.544 0.794 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -8.488 2.277 1.710 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -8.394 0.596 1.224 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -9.669 0.484 3.152 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -8.071 0.077 3.746 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -8.865 2.966 3.850 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -9.678 1.875 4.955 1.00 0.00 H new ATOM 0 HE ARG A 51 -6.715 2.292 4.842 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -9.446 1.033 6.716 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -8.566 1.162 8.242 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -5.736 2.693 6.776 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -6.461 2.105 8.277 1.00 0.00 H new ATOM 755 N ILE A 52 -6.181 3.872 2.116 1.00 0.00 N ATOM 756 CA ILE A 52 -5.809 5.073 2.876 1.00 0.00 C ATOM 757 C ILE A 52 -7.102 5.776 3.221 1.00 0.00 C ATOM 758 O ILE A 52 -7.616 6.520 2.400 1.00 0.00 O ATOM 759 CB ILE A 52 -4.831 5.986 2.114 1.00 0.00 C ATOM 760 CG1 ILE A 52 -3.490 5.281 1.886 1.00 0.00 C ATOM 761 CG2 ILE A 52 -4.533 7.240 2.957 1.00 0.00 C ATOM 762 CD1 ILE A 52 -2.945 5.454 0.476 1.00 0.00 C ATOM 0 H ILE A 52 -6.606 4.062 1.209 1.00 0.00 H new ATOM 0 HA ILE A 52 -5.264 4.796 3.778 1.00 0.00 H new ATOM 0 HB ILE A 52 -5.294 6.241 1.161 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -2.761 5.666 2.599 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -3.608 4.217 2.093 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -3.841 7.886 2.417 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -5.461 7.780 3.146 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -4.087 6.943 3.906 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -1.994 4.929 0.387 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -3.655 5.043 -0.242 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -2.795 6.514 0.272 1.00 0.00 H new ATOM 774 N LEU A 53 -7.690 5.471 4.369 1.00 0.00 N ATOM 775 CA LEU A 53 -8.995 6.003 4.749 1.00 0.00 C ATOM 776 C LEU A 53 -8.897 7.537 4.815 1.00 0.00 C ATOM 777 O LEU A 53 -8.107 8.038 5.621 1.00 0.00 O ATOM 778 CB LEU A 53 -9.366 5.355 6.096 1.00 0.00 C ATOM 779 CG LEU A 53 -10.858 5.350 6.450 1.00 0.00 C ATOM 780 CD1 LEU A 53 -11.398 6.770 6.636 1.00 0.00 C ATOM 781 CD2 LEU A 53 -11.649 4.523 5.424 1.00 0.00 C ATOM 0 H LEU A 53 -7.278 4.849 5.064 1.00 0.00 H new ATOM 0 HA LEU A 53 -9.780 5.771 4.029 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -9.010 4.325 6.091 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -8.827 5.875 6.888 1.00 0.00 H new ATOM 0 HG LEU A 53 -10.989 4.862 7.416 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -12.458 6.726 6.886 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -10.855 7.263 7.442 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -11.266 7.333 5.712 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -12.706 4.529 5.689 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -11.521 4.956 4.432 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -11.281 3.497 5.423 1.00 0.00 H new ATOM 793 N LEU A 54 -9.633 8.280 3.973 1.00 0.00 N ATOM 794 CA LEU A 54 -9.608 9.748 3.970 1.00 0.00 C ATOM 795 C LEU A 54 -10.888 10.247 4.633 1.00 0.00 C ATOM 796 O LEU A 54 -11.929 10.352 3.983 1.00 0.00 O ATOM 797 CB LEU A 54 -9.415 10.387 2.573 1.00 0.00 C ATOM 798 CG LEU A 54 -8.064 10.219 1.840 1.00 0.00 C ATOM 799 CD1 LEU A 54 -6.851 10.128 2.769 1.00 0.00 C ATOM 800 CD2 LEU A 54 -8.089 9.045 0.859 1.00 0.00 C ATOM 0 H LEU A 54 -10.261 7.879 3.277 1.00 0.00 H new ATOM 0 HA LEU A 54 -8.727 10.061 4.531 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -10.192 9.988 1.921 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -9.601 11.456 2.674 1.00 0.00 H new ATOM 0 HG LEU A 54 -7.939 11.142 1.274 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -5.945 10.011 2.174 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -6.780 11.038 3.364 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -6.963 9.269 3.431 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -7.121 8.962 0.366 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -8.300 8.123 1.400 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -8.864 9.212 0.111 1.00 0.00 H new ATOM 812 N SER A 55 -10.815 10.546 5.931 1.00 0.00 N ATOM 813 CA SER A 55 -11.876 11.210 6.667 1.00 0.00 C ATOM 814 C SER A 55 -11.265 11.922 7.895 1.00 0.00 C ATOM 815 O SER A 55 -10.238 11.475 8.416 1.00 0.00 O ATOM 816 CB SER A 55 -12.987 10.193 6.992 1.00 0.00 C ATOM 817 OG SER A 55 -13.479 10.220 8.316 1.00 0.00 O ATOM 0 H SER A 55 -10.000 10.327 6.504 1.00 0.00 H new ATOM 0 HA SER A 55 -12.357 11.989 6.075 1.00 0.00 H new ATOM 0 HB2 SER A 55 -13.821 10.365 6.311 1.00 0.00 H new ATOM 0 HB3 SER A 55 -12.608 9.192 6.786 1.00 0.00 H new ATOM 0 HG SER A 55 -14.178 9.541 8.419 1.00 0.00 H new ATOM 823 N PRO A 56 -11.882 12.980 8.447 1.00 0.00 N ATOM 824 CA PRO A 56 -13.021 13.681 7.878 1.00 0.00 C ATOM 825 C PRO A 56 -12.646 14.299 6.522 1.00 0.00 C ATOM 826 O PRO A 56 -11.467 14.438 6.176 1.00 0.00 O ATOM 827 CB PRO A 56 -13.416 14.724 8.931 1.00 0.00 C ATOM 828 CG PRO A 56 -12.129 14.978 9.709 1.00 0.00 C ATOM 829 CD PRO A 56 -11.414 13.637 9.659 1.00 0.00 C ATOM 0 HA PRO A 56 -13.864 13.024 7.664 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -13.787 15.638 8.467 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -14.208 14.353 9.582 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -11.533 15.768 9.252 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -12.334 15.286 10.734 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -10.333 13.772 9.638 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -11.643 13.039 10.541 1.00 0.00 H new ATOM 837 N CYS A 57 -13.660 14.615 5.724 1.00 0.00 N ATOM 838 CA CYS A 57 -13.493 15.194 4.405 1.00 0.00 C ATOM 839 C CYS A 57 -14.605 16.201 4.151 1.00 0.00 C ATOM 840 O CYS A 57 -15.734 16.020 4.625 1.00 0.00 O ATOM 841 CB CYS A 57 -13.464 14.098 3.325 1.00 0.00 C ATOM 842 SG CYS A 57 -13.079 14.766 1.684 1.00 0.00 S ATOM 0 H CYS A 57 -14.636 14.472 5.984 1.00 0.00 H new ATOM 0 HA CYS A 57 -12.536 15.714 4.358 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -12.722 13.346 3.593 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -14.431 13.595 3.293 1.00 0.00 H new ATOM 847 N GLY A 58 -14.267 17.241 3.394 1.00 0.00 N ATOM 848 CA GLY A 58 -15.134 18.293 2.966 1.00 0.00 C ATOM 849 C GLY A 58 -16.233 17.846 2.023 1.00 0.00 C ATOM 850 O GLY A 58 -16.359 16.671 1.665 1.00 0.00 O ATOM 0 H GLY A 58 -13.315 17.363 3.050 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -15.588 18.754 3.843 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -14.539 19.062 2.474 1.00 0.00 H new ATOM 854 N ASN A 59 -17.031 18.829 1.606 1.00 0.00 N ATOM 855 CA ASN A 59 -18.095 18.640 0.634 1.00 0.00 C ATOM 856 C ASN A 59 -17.718 19.120 -0.769 1.00 0.00 C ATOM 857 O ASN A 59 -18.435 18.776 -1.706 1.00 0.00 O ATOM 858 CB ASN A 59 -19.404 19.280 1.118 1.00 0.00 C ATOM 859 CG ASN A 59 -19.337 20.799 1.228 1.00 0.00 C ATOM 860 OD1 ASN A 59 -18.997 21.483 0.275 1.00 0.00 O ATOM 861 ND2 ASN A 59 -19.641 21.339 2.393 1.00 0.00 N ATOM 0 H ASN A 59 -16.951 19.789 1.941 1.00 0.00 H new ATOM 0 HA ASN A 59 -18.252 17.565 0.550 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -20.206 19.009 0.432 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -19.663 18.865 2.092 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -19.595 22.351 2.514 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -19.922 20.745 3.173 1.00 0.00 H new ATOM 868 N ALA A 60 -16.607 19.843 -0.958 1.00 0.00 N ATOM 869 CA ALA A 60 -16.317 20.492 -2.234 1.00 0.00 C ATOM 870 C ALA A 60 -14.999 20.004 -2.830 1.00 0.00 C ATOM 871 O ALA A 60 -14.321 20.749 -3.541 1.00 0.00 O ATOM 872 CB ALA A 60 -16.297 22.007 -2.009 1.00 0.00 C ATOM 0 H ALA A 60 -15.897 19.991 -0.241 1.00 0.00 H new ATOM 0 HA ALA A 60 -17.093 20.234 -2.955 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -16.082 22.512 -2.951 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -17.268 22.332 -1.637 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -15.527 22.256 -1.279 1.00 0.00 H new ATOM 878 N VAL A 61 -14.695 18.720 -2.691 1.00 0.00 N ATOM 879 CA VAL A 61 -13.501 18.104 -3.262 1.00 0.00 C ATOM 880 C VAL A 61 -13.909 17.422 -4.585 1.00 0.00 C ATOM 881 O VAL A 61 -15.079 17.492 -4.979 1.00 0.00 O ATOM 882 CB VAL A 61 -12.753 17.260 -2.185 1.00 0.00 C ATOM 883 CG1 VAL A 61 -13.311 17.385 -0.755 1.00 0.00 C ATOM 884 CG2 VAL A 61 -12.683 15.763 -2.447 1.00 0.00 C ATOM 0 H VAL A 61 -15.279 18.066 -2.170 1.00 0.00 H new ATOM 0 HA VAL A 61 -12.731 18.821 -3.549 1.00 0.00 H new ATOM 0 HB VAL A 61 -11.763 17.710 -2.267 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -12.725 16.762 -0.080 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -13.253 18.424 -0.431 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -14.351 17.058 -0.740 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -12.142 15.277 -1.636 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -13.693 15.356 -2.505 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -12.165 15.582 -3.389 1.00 0.00 H new ATOM 894 N SER A 62 -12.972 16.828 -5.323 1.00 0.00 N ATOM 895 CA SER A 62 -13.280 16.080 -6.538 1.00 0.00 C ATOM 896 C SER A 62 -12.326 14.903 -6.728 1.00 0.00 C ATOM 897 O SER A 62 -12.737 13.747 -6.642 1.00 0.00 O ATOM 898 CB SER A 62 -13.292 17.025 -7.742 1.00 0.00 C ATOM 899 OG SER A 62 -12.220 17.961 -7.720 1.00 0.00 O ATOM 0 H SER A 62 -11.978 16.853 -5.094 1.00 0.00 H new ATOM 0 HA SER A 62 -14.276 15.648 -6.443 1.00 0.00 H new ATOM 0 HB2 SER A 62 -13.237 16.438 -8.659 1.00 0.00 H new ATOM 0 HB3 SER A 62 -14.239 17.565 -7.765 1.00 0.00 H new ATOM 0 HG SER A 62 -12.273 18.538 -8.510 1.00 0.00 H new ATOM 905 N ALA A 63 -11.047 15.183 -6.983 1.00 0.00 N ATOM 906 CA ALA A 63 -10.020 14.175 -7.188 1.00 0.00 C ATOM 907 C ALA A 63 -8.719 14.604 -6.505 1.00 0.00 C ATOM 908 O ALA A 63 -8.576 15.734 -6.027 1.00 0.00 O ATOM 909 CB ALA A 63 -9.832 13.918 -8.680 1.00 0.00 C ATOM 0 H ALA A 63 -10.695 16.138 -7.053 1.00 0.00 H new ATOM 0 HA ALA A 63 -10.331 13.235 -6.732 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -9.061 13.161 -8.825 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -10.770 13.567 -9.110 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -9.531 14.842 -9.173 1.00 0.00 H new ATOM 915 N VAL A 64 -7.774 13.676 -6.427 1.00 0.00 N ATOM 916 CA VAL A 64 -6.536 13.775 -5.662 1.00 0.00 C ATOM 917 C VAL A 64 -5.376 13.205 -6.496 1.00 0.00 C ATOM 918 O VAL A 64 -5.595 12.587 -7.545 1.00 0.00 O ATOM 919 CB VAL A 64 -6.798 13.054 -4.318 1.00 0.00 C ATOM 920 CG1 VAL A 64 -5.564 12.668 -3.509 1.00 0.00 C ATOM 921 CG2 VAL A 64 -7.653 13.954 -3.415 1.00 0.00 C ATOM 0 H VAL A 64 -7.854 12.787 -6.921 1.00 0.00 H new ATOM 0 HA VAL A 64 -6.237 14.799 -5.438 1.00 0.00 H new ATOM 0 HB VAL A 64 -7.288 12.125 -4.609 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -5.873 12.170 -2.590 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -4.941 11.993 -4.096 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -4.995 13.565 -3.263 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -7.839 13.448 -2.468 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -7.125 14.889 -3.229 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -8.603 14.165 -3.906 1.00 0.00 H new ATOM 931 N LYS A 65 -4.134 13.460 -6.063 1.00 0.00 N ATOM 932 CA LYS A 65 -2.905 13.062 -6.761 1.00 0.00 C ATOM 933 C LYS A 65 -1.888 12.549 -5.727 1.00 0.00 C ATOM 934 O LYS A 65 -1.253 13.331 -5.010 1.00 0.00 O ATOM 935 CB LYS A 65 -2.362 14.258 -7.570 1.00 0.00 C ATOM 936 CG LYS A 65 -3.258 14.651 -8.772 1.00 0.00 C ATOM 937 CD LYS A 65 -2.777 15.931 -9.479 1.00 0.00 C ATOM 938 CE LYS A 65 -3.810 16.535 -10.449 1.00 0.00 C ATOM 939 NZ LYS A 65 -3.968 15.811 -11.732 1.00 0.00 N ATOM 0 H LYS A 65 -3.952 13.962 -5.194 1.00 0.00 H new ATOM 0 HA LYS A 65 -3.104 12.255 -7.466 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -2.259 15.118 -6.908 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -1.364 14.016 -7.935 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -3.277 13.830 -9.489 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -4.281 14.795 -8.425 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -2.522 16.676 -8.726 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -1.863 15.708 -10.030 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -4.778 16.570 -9.948 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -3.524 17.565 -10.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -4.682 16.291 -12.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -3.059 15.798 -12.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -4.274 14.835 -11.544 1.00 0.00 H new ATOM 953 N VAL A 66 -1.780 11.227 -5.586 1.00 0.00 N ATOM 954 CA VAL A 66 -1.004 10.577 -4.530 1.00 0.00 C ATOM 955 C VAL A 66 0.495 10.558 -4.861 1.00 0.00 C ATOM 956 O VAL A 66 0.892 10.312 -5.998 1.00 0.00 O ATOM 957 CB VAL A 66 -1.578 9.162 -4.277 1.00 0.00 C ATOM 958 CG1 VAL A 66 -1.681 8.291 -5.537 1.00 0.00 C ATOM 959 CG2 VAL A 66 -0.798 8.397 -3.193 1.00 0.00 C ATOM 0 H VAL A 66 -2.238 10.567 -6.214 1.00 0.00 H new ATOM 0 HA VAL A 66 -1.093 11.151 -3.608 1.00 0.00 H new ATOM 0 HB VAL A 66 -2.593 9.350 -3.927 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -2.092 7.317 -5.273 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -2.334 8.776 -6.262 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -0.690 8.161 -5.971 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -1.241 7.411 -3.054 1.00 0.00 H new ATOM 0 HG22 VAL A 66 0.242 8.288 -3.502 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -0.842 8.950 -2.255 1.00 0.00 H new ATOM 969 N GLY A 67 1.333 10.740 -3.841 1.00 0.00 N ATOM 970 CA GLY A 67 2.772 10.565 -3.847 1.00 0.00 C ATOM 971 C GLY A 67 3.137 9.531 -2.785 1.00 0.00 C ATOM 972 O GLY A 67 3.238 9.865 -1.603 1.00 0.00 O ATOM 0 H GLY A 67 0.992 11.035 -2.926 1.00 0.00 H new ATOM 0 HA2 GLY A 67 3.110 10.235 -4.829 1.00 0.00 H new ATOM 0 HA3 GLY A 67 3.270 11.512 -3.641 1.00 0.00 H new ATOM 976 N PHE A 68 3.307 8.271 -3.186 1.00 0.00 N ATOM 977 CA PHE A 68 3.995 7.267 -2.382 1.00 0.00 C ATOM 978 C PHE A 68 5.489 7.519 -2.576 1.00 0.00 C ATOM 979 O PHE A 68 5.977 7.350 -3.695 1.00 0.00 O ATOM 980 CB PHE A 68 3.608 5.841 -2.838 1.00 0.00 C ATOM 981 CG PHE A 68 2.910 5.006 -1.779 1.00 0.00 C ATOM 982 CD1 PHE A 68 3.669 4.385 -0.766 1.00 0.00 C ATOM 983 CD2 PHE A 68 1.518 4.793 -1.833 1.00 0.00 C ATOM 984 CE1 PHE A 68 3.045 3.551 0.181 1.00 0.00 C ATOM 985 CE2 PHE A 68 0.894 3.956 -0.889 1.00 0.00 C ATOM 986 CZ PHE A 68 1.658 3.331 0.115 1.00 0.00 C ATOM 0 H PHE A 68 2.969 7.919 -4.082 1.00 0.00 H new ATOM 0 HA PHE A 68 3.718 7.341 -1.330 1.00 0.00 H new ATOM 0 HB2 PHE A 68 2.958 5.916 -3.709 1.00 0.00 H new ATOM 0 HB3 PHE A 68 4.510 5.319 -3.158 1.00 0.00 H new ATOM 0 HD1 PHE A 68 4.735 4.550 -0.716 1.00 0.00 H new ATOM 0 HD2 PHE A 68 0.929 5.273 -2.600 1.00 0.00 H new ATOM 0 HE1 PHE A 68 3.631 3.081 0.957 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -0.173 3.793 -0.935 1.00 0.00 H new ATOM 0 HZ PHE A 68 1.179 2.683 0.834 1.00 0.00 H new ATOM 996 N THR A 69 6.211 7.919 -1.526 1.00 0.00 N ATOM 997 CA THR A 69 7.658 8.121 -1.614 1.00 0.00 C ATOM 998 C THR A 69 8.383 7.603 -0.372 1.00 0.00 C ATOM 999 O THR A 69 7.801 7.563 0.716 1.00 0.00 O ATOM 1000 CB THR A 69 8.006 9.578 -1.973 1.00 0.00 C ATOM 1001 OG1 THR A 69 6.980 10.505 -1.651 1.00 0.00 O ATOM 1002 CG2 THR A 69 8.276 9.682 -3.476 1.00 0.00 C ATOM 0 H THR A 69 5.816 8.109 -0.605 1.00 0.00 H new ATOM 0 HA THR A 69 8.030 7.515 -2.440 1.00 0.00 H new ATOM 0 HB THR A 69 8.884 9.834 -1.379 1.00 0.00 H new ATOM 0 HG1 THR A 69 7.265 11.408 -1.902 1.00 0.00 H new ATOM 0 HG21 THR A 69 8.522 10.713 -3.731 1.00 0.00 H new ATOM 0 HG22 THR A 69 9.111 9.033 -3.741 1.00 0.00 H new ATOM 0 HG23 THR A 69 7.388 9.374 -4.027 1.00 0.00 H new ATOM 1010 N GLY A 70 9.633 7.159 -0.539 1.00 0.00 N ATOM 1011 CA GLY A 70 10.331 6.312 0.419 1.00 0.00 C ATOM 1012 C GLY A 70 11.830 6.305 0.132 1.00 0.00 C ATOM 1013 O GLY A 70 12.498 7.283 0.469 1.00 0.00 O ATOM 0 H GLY A 70 10.194 7.385 -1.361 1.00 0.00 H new ATOM 0 HA2 GLY A 70 10.150 6.672 1.432 1.00 0.00 H new ATOM 0 HA3 GLY A 70 9.940 5.296 0.368 1.00 0.00 H new ATOM 1017 N VAL A 71 12.344 5.249 -0.510 1.00 0.00 N ATOM 1018 CA VAL A 71 13.723 5.117 -0.981 1.00 0.00 C ATOM 1019 C VAL A 71 13.691 4.201 -2.209 1.00 0.00 C ATOM 1020 O VAL A 71 13.166 3.093 -2.106 1.00 0.00 O ATOM 1021 CB VAL A 71 14.614 4.487 0.117 1.00 0.00 C ATOM 1022 CG1 VAL A 71 16.042 4.225 -0.390 1.00 0.00 C ATOM 1023 CG2 VAL A 71 14.728 5.354 1.378 1.00 0.00 C ATOM 0 H VAL A 71 11.781 4.426 -0.724 1.00 0.00 H new ATOM 0 HA VAL A 71 14.138 6.095 -1.227 1.00 0.00 H new ATOM 0 HB VAL A 71 14.115 3.552 0.371 1.00 0.00 H new ATOM 0 HG11 VAL A 71 16.636 3.783 0.409 1.00 0.00 H new ATOM 0 HG12 VAL A 71 16.007 3.541 -1.238 1.00 0.00 H new ATOM 0 HG13 VAL A 71 16.496 5.166 -0.702 1.00 0.00 H new ATOM 0 HG21 VAL A 71 15.366 4.854 2.107 1.00 0.00 H new ATOM 0 HG22 VAL A 71 15.162 6.320 1.118 1.00 0.00 H new ATOM 0 HG23 VAL A 71 13.737 5.505 1.806 1.00 0.00 H new ATOM 1033 N ALA A 72 14.259 4.615 -3.342 1.00 0.00 N ATOM 1034 CA ALA A 72 14.264 3.799 -4.553 1.00 0.00 C ATOM 1035 C ALA A 72 15.349 2.729 -4.423 1.00 0.00 C ATOM 1036 O ALA A 72 16.473 3.018 -3.995 1.00 0.00 O ATOM 1037 CB ALA A 72 14.539 4.700 -5.761 1.00 0.00 C ATOM 0 H ALA A 72 14.724 5.517 -3.445 1.00 0.00 H new ATOM 0 HA ALA A 72 13.299 3.311 -4.690 1.00 0.00 H new ATOM 0 HB1 ALA A 72 14.544 4.098 -6.670 1.00 0.00 H new ATOM 0 HB2 ALA A 72 13.760 5.459 -5.833 1.00 0.00 H new ATOM 0 HB3 ALA A 72 15.508 5.184 -5.641 1.00 0.00 H new ATOM 1043 N ASP A 73 15.017 1.481 -4.759 1.00 0.00 N ATOM 1044 CA ASP A 73 15.972 0.376 -4.677 1.00 0.00 C ATOM 1045 C ASP A 73 17.063 0.519 -5.753 1.00 0.00 C ATOM 1046 O ASP A 73 16.914 1.252 -6.733 1.00 0.00 O ATOM 1047 CB ASP A 73 15.241 -0.974 -4.773 1.00 0.00 C ATOM 1048 CG ASP A 73 16.134 -2.129 -4.317 1.00 0.00 C ATOM 1049 OD1 ASP A 73 16.858 -2.719 -5.150 1.00 0.00 O ATOM 1050 OD2 ASP A 73 16.151 -2.464 -3.111 1.00 0.00 O ATOM 0 H ASP A 73 14.091 1.211 -5.091 1.00 0.00 H new ATOM 0 HA ASP A 73 16.469 0.411 -3.708 1.00 0.00 H new ATOM 0 HB2 ASP A 73 14.340 -0.945 -4.160 1.00 0.00 H new ATOM 0 HB3 ASP A 73 14.922 -1.144 -5.801 1.00 0.00 H new ATOM 1055 N SER A 74 18.182 -0.180 -5.582 1.00 0.00 N ATOM 1056 CA SER A 74 19.275 -0.238 -6.542 1.00 0.00 C ATOM 1057 C SER A 74 18.928 -1.148 -7.721 1.00 0.00 C ATOM 1058 O SER A 74 19.197 -0.800 -8.866 1.00 0.00 O ATOM 1059 CB SER A 74 20.530 -0.710 -5.794 1.00 0.00 C ATOM 1060 OG SER A 74 21.641 -1.039 -6.615 1.00 0.00 O ATOM 0 H SER A 74 18.356 -0.738 -4.746 1.00 0.00 H new ATOM 0 HA SER A 74 19.458 0.747 -6.971 1.00 0.00 H new ATOM 0 HB2 SER A 74 20.833 0.072 -5.098 1.00 0.00 H new ATOM 0 HB3 SER A 74 20.269 -1.584 -5.197 1.00 0.00 H new ATOM 0 HG SER A 74 22.390 -1.326 -6.052 1.00 0.00 H new ATOM 1066 N HIS A 75 18.367 -2.328 -7.454 1.00 0.00 N ATOM 1067 CA HIS A 75 18.124 -3.337 -8.480 1.00 0.00 C ATOM 1068 C HIS A 75 17.030 -2.896 -9.433 1.00 0.00 C ATOM 1069 O HIS A 75 17.080 -3.194 -10.623 1.00 0.00 O ATOM 1070 CB HIS A 75 17.713 -4.662 -7.833 1.00 0.00 C ATOM 1071 CG HIS A 75 18.635 -5.157 -6.745 1.00 0.00 C ATOM 1072 ND1 HIS A 75 18.498 -4.888 -5.396 1.00 0.00 N ATOM 1073 CD2 HIS A 75 19.737 -5.947 -6.915 1.00 0.00 C ATOM 1074 CE1 HIS A 75 19.509 -5.504 -4.755 1.00 0.00 C ATOM 1075 NE2 HIS A 75 20.274 -6.155 -5.657 1.00 0.00 N ATOM 0 H HIS A 75 18.069 -2.609 -6.520 1.00 0.00 H new ATOM 0 HA HIS A 75 19.050 -3.468 -9.039 1.00 0.00 H new ATOM 0 HB2 HIS A 75 16.712 -4.550 -7.416 1.00 0.00 H new ATOM 0 HB3 HIS A 75 17.651 -5.424 -8.610 1.00 0.00 H new ATOM 0 HD1 HIS A 75 17.765 -4.325 -4.965 1.00 0.00 H new ATOM 0 HD2 HIS A 75 20.115 -6.334 -7.850 1.00 0.00 H new ATOM 0 HE1 HIS A 75 19.681 -5.481 -3.689 1.00 0.00 H new ATOM 1084 N ASN A 76 15.989 -2.278 -8.888 1.00 0.00 N ATOM 1085 CA ASN A 76 14.732 -2.040 -9.563 1.00 0.00 C ATOM 1086 C ASN A 76 14.205 -0.780 -8.914 1.00 0.00 C ATOM 1087 O ASN A 76 13.444 -0.866 -7.959 1.00 0.00 O ATOM 1088 CB ASN A 76 13.786 -3.235 -9.366 1.00 0.00 C ATOM 1089 CG ASN A 76 14.254 -4.460 -10.139 1.00 0.00 C ATOM 1090 OD1 ASN A 76 14.861 -5.362 -9.572 1.00 0.00 O ATOM 1091 ND2 ASN A 76 14.051 -4.462 -11.445 1.00 0.00 N ATOM 0 H ASN A 76 16.003 -1.920 -7.933 1.00 0.00 H new ATOM 0 HA ASN A 76 14.832 -1.925 -10.642 1.00 0.00 H new ATOM 0 HB2 ASN A 76 13.722 -3.477 -8.305 1.00 0.00 H new ATOM 0 HB3 ASN A 76 12.782 -2.961 -9.691 1.00 0.00 H new ATOM 0 HD21 ASN A 76 14.404 -5.231 -12.015 1.00 0.00 H new ATOM 0 HD22 ASN A 76 13.541 -3.695 -11.883 1.00 0.00 H new ATOM 1098 N ALA A 77 14.646 0.386 -9.384 1.00 0.00 N ATOM 1099 CA ALA A 77 14.347 1.677 -8.768 1.00 0.00 C ATOM 1100 C ALA A 77 12.843 1.973 -8.640 1.00 0.00 C ATOM 1101 O ALA A 77 12.448 2.844 -7.867 1.00 0.00 O ATOM 1102 CB ALA A 77 15.042 2.775 -9.578 1.00 0.00 C ATOM 0 H ALA A 77 15.230 0.461 -10.217 1.00 0.00 H new ATOM 0 HA ALA A 77 14.723 1.646 -7.746 1.00 0.00 H new ATOM 0 HB1 ALA A 77 14.829 3.746 -9.132 1.00 0.00 H new ATOM 0 HB2 ALA A 77 16.118 2.603 -9.576 1.00 0.00 H new ATOM 0 HB3 ALA A 77 14.674 2.759 -10.604 1.00 0.00 H new ATOM 1108 N ASN A 78 11.997 1.262 -9.393 1.00 0.00 N ATOM 1109 CA ASN A 78 10.548 1.327 -9.247 1.00 0.00 C ATOM 1110 C ASN A 78 10.105 0.786 -7.883 1.00 0.00 C ATOM 1111 O ASN A 78 9.128 1.295 -7.341 1.00 0.00 O ATOM 1112 CB ASN A 78 9.835 0.553 -10.380 1.00 0.00 C ATOM 1113 CG ASN A 78 9.807 1.303 -11.711 1.00 0.00 C ATOM 1114 OD1 ASN A 78 10.573 2.234 -11.931 1.00 0.00 O ATOM 1115 ND2 ASN A 78 8.930 0.943 -12.633 1.00 0.00 N ATOM 0 H ASN A 78 12.306 0.622 -10.125 1.00 0.00 H new ATOM 0 HA ASN A 78 10.263 2.377 -9.314 1.00 0.00 H new ATOM 0 HB2 ASN A 78 10.334 -0.406 -10.523 1.00 0.00 H new ATOM 0 HB3 ASN A 78 8.812 0.337 -10.073 1.00 0.00 H new ATOM 0 HD21 ASN A 78 8.893 1.440 -13.523 1.00 0.00 H new ATOM 0 HD22 ASN A 78 8.291 0.169 -12.454 1.00 0.00 H new ATOM 1122 N LEU A 79 10.760 -0.254 -7.356 1.00 0.00 N ATOM 1123 CA LEU A 79 10.456 -0.898 -6.079 1.00 0.00 C ATOM 1124 C LEU A 79 11.059 -0.088 -4.920 1.00 0.00 C ATOM 1125 O LEU A 79 12.022 0.662 -5.098 1.00 0.00 O ATOM 1126 CB LEU A 79 11.015 -2.341 -6.078 1.00 0.00 C ATOM 1127 CG LEU A 79 10.184 -3.412 -6.828 1.00 0.00 C ATOM 1128 CD1 LEU A 79 11.036 -4.676 -6.918 1.00 0.00 C ATOM 1129 CD2 LEU A 79 8.831 -3.639 -6.137 1.00 0.00 C ATOM 0 H LEU A 79 11.552 -0.687 -7.831 1.00 0.00 H new ATOM 0 HA LEU A 79 9.375 -0.937 -5.945 1.00 0.00 H new ATOM 0 HB2 LEU A 79 12.014 -2.319 -6.514 1.00 0.00 H new ATOM 0 HB3 LEU A 79 11.127 -2.661 -5.042 1.00 0.00 H new ATOM 0 HG LEU A 79 9.938 -3.084 -7.838 1.00 0.00 H new ATOM 0 HD11 LEU A 79 10.480 -5.453 -7.442 1.00 0.00 H new ATOM 0 HD12 LEU A 79 11.955 -4.458 -7.462 1.00 0.00 H new ATOM 0 HD13 LEU A 79 11.283 -5.021 -5.914 1.00 0.00 H new ATOM 0 HD21 LEU A 79 8.266 -4.395 -6.682 1.00 0.00 H new ATOM 0 HD22 LEU A 79 8.997 -3.978 -5.114 1.00 0.00 H new ATOM 0 HD23 LEU A 79 8.268 -2.706 -6.123 1.00 0.00 H new ATOM 1141 N LEU A 80 10.492 -0.262 -3.718 1.00 0.00 N ATOM 1142 CA LEU A 80 10.912 0.421 -2.492 1.00 0.00 C ATOM 1143 C LEU A 80 12.018 -0.408 -1.830 1.00 0.00 C ATOM 1144 O LEU A 80 11.917 -1.635 -1.761 1.00 0.00 O ATOM 1145 CB LEU A 80 9.671 0.656 -1.594 1.00 0.00 C ATOM 1146 CG LEU A 80 9.922 1.138 -0.146 1.00 0.00 C ATOM 1147 CD1 LEU A 80 10.664 2.470 -0.048 1.00 0.00 C ATOM 1148 CD2 LEU A 80 8.596 1.315 0.594 1.00 0.00 C ATOM 0 H LEU A 80 9.709 -0.899 -3.571 1.00 0.00 H new ATOM 0 HA LEU A 80 11.333 1.406 -2.693 1.00 0.00 H new ATOM 0 HB2 LEU A 80 9.032 1.389 -2.087 1.00 0.00 H new ATOM 0 HB3 LEU A 80 9.108 -0.276 -1.546 1.00 0.00 H new ATOM 0 HG LEU A 80 10.546 0.363 0.299 1.00 0.00 H new ATOM 0 HD11 LEU A 80 10.799 2.735 1.001 1.00 0.00 H new ATOM 0 HD12 LEU A 80 11.639 2.380 -0.528 1.00 0.00 H new ATOM 0 HD13 LEU A 80 10.085 3.247 -0.547 1.00 0.00 H new ATOM 0 HD21 LEU A 80 8.790 1.654 1.612 1.00 0.00 H new ATOM 0 HD22 LEU A 80 7.985 2.054 0.075 1.00 0.00 H new ATOM 0 HD23 LEU A 80 8.066 0.363 0.624 1.00 0.00 H new ATOM 1160 N ALA A 81 13.083 0.253 -1.373 1.00 0.00 N ATOM 1161 CA ALA A 81 14.158 -0.349 -0.591 1.00 0.00 C ATOM 1162 C ALA A 81 13.688 -0.695 0.836 1.00 0.00 C ATOM 1163 O ALA A 81 12.514 -0.590 1.174 1.00 0.00 O ATOM 1164 CB ALA A 81 15.363 0.600 -0.578 1.00 0.00 C ATOM 0 H ALA A 81 13.223 1.249 -1.543 1.00 0.00 H new ATOM 0 HA ALA A 81 14.456 -1.289 -1.055 1.00 0.00 H new ATOM 0 HB1 ALA A 81 16.170 0.156 0.005 1.00 0.00 H new ATOM 0 HB2 ALA A 81 15.704 0.769 -1.599 1.00 0.00 H new ATOM 0 HB3 ALA A 81 15.073 1.550 -0.130 1.00 0.00 H new ATOM 1170 N LEU A 82 14.614 -1.121 1.696 1.00 0.00 N ATOM 1171 CA LEU A 82 14.355 -1.613 3.052 1.00 0.00 C ATOM 1172 C LEU A 82 15.135 -0.735 4.034 1.00 0.00 C ATOM 1173 O LEU A 82 15.763 0.251 3.633 1.00 0.00 O ATOM 1174 CB LEU A 82 14.714 -3.120 3.208 1.00 0.00 C ATOM 1175 CG LEU A 82 14.430 -4.030 2.000 1.00 0.00 C ATOM 1176 CD1 LEU A 82 15.650 -4.018 1.068 1.00 0.00 C ATOM 1177 CD2 LEU A 82 14.150 -5.473 2.451 1.00 0.00 C ATOM 0 H LEU A 82 15.606 -1.134 1.458 1.00 0.00 H new ATOM 0 HA LEU A 82 13.288 -1.545 3.266 1.00 0.00 H new ATOM 0 HB2 LEU A 82 15.775 -3.193 3.446 1.00 0.00 H new ATOM 0 HB3 LEU A 82 14.167 -3.513 4.065 1.00 0.00 H new ATOM 0 HG LEU A 82 13.549 -3.655 1.479 1.00 0.00 H new ATOM 0 HD11 LEU A 82 15.458 -4.660 0.209 1.00 0.00 H new ATOM 0 HD12 LEU A 82 15.836 -3.000 0.726 1.00 0.00 H new ATOM 0 HD13 LEU A 82 16.523 -4.385 1.607 1.00 0.00 H new ATOM 0 HD21 LEU A 82 13.952 -6.095 1.578 1.00 0.00 H new ATOM 0 HD22 LEU A 82 15.017 -5.862 2.985 1.00 0.00 H new ATOM 0 HD23 LEU A 82 13.282 -5.486 3.110 1.00 0.00 H new ATOM 1189 N GLU A 83 15.210 -1.149 5.302 1.00 0.00 N ATOM 1190 CA GLU A 83 16.217 -0.677 6.248 1.00 0.00 C ATOM 1191 C GLU A 83 17.641 -1.014 5.764 1.00 0.00 C ATOM 1192 O GLU A 83 18.608 -0.570 6.374 1.00 0.00 O ATOM 1193 CB GLU A 83 15.928 -1.245 7.649 1.00 0.00 C ATOM 1194 CG GLU A 83 16.130 -2.765 7.744 1.00 0.00 C ATOM 1195 CD GLU A 83 15.783 -3.359 9.119 1.00 0.00 C ATOM 1196 OE1 GLU A 83 15.645 -2.648 10.144 1.00 0.00 O ATOM 1197 OE2 GLU A 83 15.607 -4.592 9.203 1.00 0.00 O ATOM 0 H GLU A 83 14.564 -1.829 5.702 1.00 0.00 H new ATOM 0 HA GLU A 83 16.162 0.410 6.310 1.00 0.00 H new ATOM 0 HB2 GLU A 83 16.577 -0.754 8.373 1.00 0.00 H new ATOM 0 HB3 GLU A 83 14.902 -1.004 7.926 1.00 0.00 H new ATOM 0 HG2 GLU A 83 15.517 -3.250 6.985 1.00 0.00 H new ATOM 0 HG3 GLU A 83 17.169 -2.998 7.511 1.00 0.00 H new ATOM 1204 N ASN A 84 17.754 -1.776 4.665 1.00 0.00 N ATOM 1205 CA ASN A 84 18.911 -1.909 3.781 1.00 0.00 C ATOM 1206 C ASN A 84 20.120 -2.547 4.478 1.00 0.00 C ATOM 1207 O ASN A 84 21.255 -2.393 4.015 1.00 0.00 O ATOM 1208 CB ASN A 84 19.186 -0.543 3.119 1.00 0.00 C ATOM 1209 CG ASN A 84 20.097 -0.605 1.901 1.00 0.00 C ATOM 1210 OD1 ASN A 84 21.112 0.083 1.838 1.00 0.00 O ATOM 1211 ND2 ASN A 84 19.757 -1.364 0.871 1.00 0.00 N ATOM 0 H ASN A 84 16.977 -2.358 4.352 1.00 0.00 H new ATOM 0 HA ASN A 84 18.690 -2.619 2.984 1.00 0.00 H new ATOM 0 HB2 ASN A 84 18.236 -0.098 2.824 1.00 0.00 H new ATOM 0 HB3 ASN A 84 19.633 0.122 3.858 1.00 0.00 H new ATOM 0 HD21 ASN A 84 20.337 -1.375 0.032 1.00 0.00 H new ATOM 0 HD22 ASN A 84 18.915 -1.938 0.916 1.00 0.00 H new ATOM 1218 N THR A 85 19.877 -3.263 5.582 1.00 0.00 N ATOM 1219 CA THR A 85 20.877 -3.737 6.522 1.00 0.00 C ATOM 1220 C THR A 85 21.011 -5.260 6.480 1.00 0.00 C ATOM 1221 O THR A 85 20.171 -5.969 5.932 1.00 0.00 O ATOM 1222 CB THR A 85 20.542 -3.185 7.920 1.00 0.00 C ATOM 1223 OG1 THR A 85 21.763 -2.993 8.602 1.00 0.00 O ATOM 1224 CG2 THR A 85 19.679 -4.088 8.808 1.00 0.00 C ATOM 0 H THR A 85 18.931 -3.536 5.849 1.00 0.00 H new ATOM 0 HA THR A 85 21.862 -3.363 6.242 1.00 0.00 H new ATOM 0 HB THR A 85 19.962 -2.278 7.747 1.00 0.00 H new ATOM 0 HG1 THR A 85 21.585 -2.639 9.498 1.00 0.00 H new ATOM 0 HG21 THR A 85 19.507 -3.598 9.767 1.00 0.00 H new ATOM 0 HG22 THR A 85 18.723 -4.273 8.318 1.00 0.00 H new ATOM 0 HG23 THR A 85 20.193 -5.035 8.972 1.00 0.00 H new ATOM 1232 N VAL A 86 22.076 -5.778 7.077 1.00 0.00 N ATOM 1233 CA VAL A 86 22.437 -7.192 7.057 1.00 0.00 C ATOM 1234 C VAL A 86 21.366 -8.083 7.689 1.00 0.00 C ATOM 1235 O VAL A 86 21.100 -9.179 7.189 1.00 0.00 O ATOM 1236 CB VAL A 86 23.806 -7.361 7.740 1.00 0.00 C ATOM 1237 CG1 VAL A 86 24.872 -6.592 6.950 1.00 0.00 C ATOM 1238 CG2 VAL A 86 23.794 -6.878 9.199 1.00 0.00 C ATOM 0 H VAL A 86 22.735 -5.208 7.607 1.00 0.00 H new ATOM 0 HA VAL A 86 22.506 -7.521 6.020 1.00 0.00 H new ATOM 0 HB VAL A 86 24.039 -8.426 7.751 1.00 0.00 H new ATOM 0 HG11 VAL A 86 25.841 -6.712 7.434 1.00 0.00 H new ATOM 0 HG12 VAL A 86 24.923 -6.982 5.933 1.00 0.00 H new ATOM 0 HG13 VAL A 86 24.610 -5.534 6.920 1.00 0.00 H new ATOM 0 HG21 VAL A 86 24.782 -7.018 9.637 1.00 0.00 H new ATOM 0 HG22 VAL A 86 23.530 -5.821 9.230 1.00 0.00 H new ATOM 0 HG23 VAL A 86 23.061 -7.452 9.766 1.00 0.00 H new ATOM 1248 N SER A 87 20.756 -7.615 8.781 1.00 0.00 N ATOM 1249 CA SER A 87 19.712 -8.315 9.513 1.00 0.00 C ATOM 1250 C SER A 87 18.346 -8.207 8.805 1.00 0.00 C ATOM 1251 O SER A 87 17.394 -8.895 9.189 1.00 0.00 O ATOM 1252 CB SER A 87 19.651 -7.732 10.933 1.00 0.00 C ATOM 1253 OG SER A 87 20.944 -7.472 11.456 1.00 0.00 O ATOM 0 H SER A 87 20.987 -6.709 9.188 1.00 0.00 H new ATOM 0 HA SER A 87 19.949 -9.378 9.556 1.00 0.00 H new ATOM 0 HB2 SER A 87 19.072 -6.809 10.921 1.00 0.00 H new ATOM 0 HB3 SER A 87 19.128 -8.428 11.589 1.00 0.00 H new ATOM 0 HG SER A 87 20.863 -7.101 12.359 1.00 0.00 H new ATOM 1259 N ALA A 88 18.220 -7.339 7.795 1.00 0.00 N ATOM 1260 CA ALA A 88 17.125 -7.368 6.842 1.00 0.00 C ATOM 1261 C ALA A 88 17.435 -8.424 5.781 1.00 0.00 C ATOM 1262 O ALA A 88 18.536 -8.979 5.733 1.00 0.00 O ATOM 1263 CB ALA A 88 16.945 -5.991 6.196 1.00 0.00 C ATOM 0 H ALA A 88 18.890 -6.589 7.622 1.00 0.00 H new ATOM 0 HA ALA A 88 16.195 -7.621 7.351 1.00 0.00 H new ATOM 0 HB1 ALA A 88 16.121 -6.028 5.484 1.00 0.00 H new ATOM 0 HB2 ALA A 88 16.725 -5.253 6.968 1.00 0.00 H new ATOM 0 HB3 ALA A 88 17.861 -5.710 5.676 1.00 0.00 H new ATOM 1269 N ALA A 89 16.457 -8.691 4.920 1.00 0.00 N ATOM 1270 CA ALA A 89 16.696 -9.537 3.768 1.00 0.00 C ATOM 1271 C ALA A 89 17.511 -8.775 2.717 1.00 0.00 C ATOM 1272 O ALA A 89 17.447 -7.542 2.630 1.00 0.00 O ATOM 1273 CB ALA A 89 15.361 -9.977 3.180 1.00 0.00 C ATOM 0 H ALA A 89 15.504 -8.336 5.001 1.00 0.00 H new ATOM 0 HA ALA A 89 17.262 -10.417 4.075 1.00 0.00 H new ATOM 0 HB1 ALA A 89 15.537 -10.614 2.313 1.00 0.00 H new ATOM 0 HB2 ALA A 89 14.799 -10.533 3.930 1.00 0.00 H new ATOM 0 HB3 ALA A 89 14.791 -9.099 2.876 1.00 0.00 H new ATOM 1279 N SER A 90 18.174 -9.529 1.846 1.00 0.00 N ATOM 1280 CA SER A 90 18.797 -9.054 0.619 1.00 0.00 C ATOM 1281 C SER A 90 18.012 -9.599 -0.572 1.00 0.00 C ATOM 1282 O SER A 90 17.297 -10.598 -0.439 1.00 0.00 O ATOM 1283 CB SER A 90 20.250 -9.519 0.573 1.00 0.00 C ATOM 1284 OG SER A 90 21.072 -8.539 1.174 1.00 0.00 O ATOM 0 H SER A 90 18.296 -10.532 1.984 1.00 0.00 H new ATOM 0 HA SER A 90 18.786 -7.965 0.583 1.00 0.00 H new ATOM 0 HB2 SER A 90 20.357 -10.470 1.095 1.00 0.00 H new ATOM 0 HB3 SER A 90 20.558 -9.686 -0.459 1.00 0.00 H new ATOM 0 HG SER A 90 22.006 -8.835 1.148 1.00 0.00 H new ATOM 1290 N GLY A 91 18.178 -8.970 -1.739 1.00 0.00 N ATOM 1291 CA GLY A 91 17.524 -9.329 -2.991 1.00 0.00 C ATOM 1292 C GLY A 91 16.005 -9.306 -2.924 1.00 0.00 C ATOM 1293 O GLY A 91 15.374 -9.931 -3.772 1.00 0.00 O ATOM 0 H GLY A 91 18.797 -8.165 -1.836 1.00 0.00 H new ATOM 0 HA2 GLY A 91 17.853 -8.643 -3.771 1.00 0.00 H new ATOM 0 HA3 GLY A 91 17.849 -10.327 -3.286 1.00 0.00 H new ATOM 1297 N LEU A 92 15.414 -8.624 -1.944 1.00 0.00 N ATOM 1298 CA LEU A 92 13.971 -8.460 -1.805 1.00 0.00 C ATOM 1299 C LEU A 92 13.679 -6.967 -1.808 1.00 0.00 C ATOM 1300 O LEU A 92 14.308 -6.219 -1.061 1.00 0.00 O ATOM 1301 CB LEU A 92 13.445 -9.170 -0.536 1.00 0.00 C ATOM 1302 CG LEU A 92 13.766 -10.683 -0.532 1.00 0.00 C ATOM 1303 CD1 LEU A 92 13.332 -11.436 0.729 1.00 0.00 C ATOM 1304 CD2 LEU A 92 13.127 -11.420 -1.701 1.00 0.00 C ATOM 0 H LEU A 92 15.942 -8.158 -1.206 1.00 0.00 H new ATOM 0 HA LEU A 92 13.446 -8.931 -2.636 1.00 0.00 H new ATOM 0 HB2 LEU A 92 13.886 -8.705 0.346 1.00 0.00 H new ATOM 0 HB3 LEU A 92 12.366 -9.030 -0.465 1.00 0.00 H new ATOM 0 HG LEU A 92 14.854 -10.686 -0.595 1.00 0.00 H new ATOM 0 HD11 LEU A 92 13.601 -12.488 0.635 1.00 0.00 H new ATOM 0 HD12 LEU A 92 13.833 -11.010 1.598 1.00 0.00 H new ATOM 0 HD13 LEU A 92 12.253 -11.347 0.853 1.00 0.00 H new ATOM 0 HD21 LEU A 92 13.385 -12.478 -1.649 1.00 0.00 H new ATOM 0 HD22 LEU A 92 12.044 -11.308 -1.654 1.00 0.00 H new ATOM 0 HD23 LEU A 92 13.494 -11.003 -2.639 1.00 0.00 H new ATOM 1316 N GLY A 93 12.754 -6.518 -2.646 1.00 0.00 N ATOM 1317 CA GLY A 93 12.212 -5.172 -2.631 1.00 0.00 C ATOM 1318 C GLY A 93 10.856 -5.193 -1.936 1.00 0.00 C ATOM 1319 O GLY A 93 10.163 -6.216 -1.887 1.00 0.00 O ATOM 0 H GLY A 93 12.349 -7.102 -3.378 1.00 0.00 H new ATOM 0 HA2 GLY A 93 12.892 -4.498 -2.110 1.00 0.00 H new ATOM 0 HA3 GLY A 93 12.108 -4.796 -3.649 1.00 0.00 H new ATOM 1323 N ILE A 94 10.471 -4.043 -1.404 1.00 0.00 N ATOM 1324 CA ILE A 94 9.155 -3.790 -0.857 1.00 0.00 C ATOM 1325 C ILE A 94 8.260 -3.393 -2.035 1.00 0.00 C ATOM 1326 O ILE A 94 8.662 -2.585 -2.881 1.00 0.00 O ATOM 1327 CB ILE A 94 9.249 -2.674 0.198 1.00 0.00 C ATOM 1328 CG1 ILE A 94 10.261 -2.914 1.332 1.00 0.00 C ATOM 1329 CG2 ILE A 94 7.853 -2.368 0.749 1.00 0.00 C ATOM 1330 CD1 ILE A 94 9.806 -3.898 2.401 1.00 0.00 C ATOM 0 H ILE A 94 11.091 -3.235 -1.341 1.00 0.00 H new ATOM 0 HA ILE A 94 8.738 -4.665 -0.359 1.00 0.00 H new ATOM 0 HB ILE A 94 9.650 -1.806 -0.325 1.00 0.00 H new ATOM 0 HG12 ILE A 94 11.192 -3.278 0.897 1.00 0.00 H new ATOM 0 HG13 ILE A 94 10.483 -1.959 1.809 1.00 0.00 H new ATOM 0 HG21 ILE A 94 7.922 -1.577 1.496 1.00 0.00 H new ATOM 0 HG22 ILE A 94 7.204 -2.043 -0.064 1.00 0.00 H new ATOM 0 HG23 ILE A 94 7.438 -3.265 1.208 1.00 0.00 H new ATOM 0 HD11 ILE A 94 10.585 -4.001 3.156 1.00 0.00 H new ATOM 0 HD12 ILE A 94 8.893 -3.530 2.870 1.00 0.00 H new ATOM 0 HD13 ILE A 94 9.613 -4.869 1.944 1.00 0.00 H new ATOM 1342 N GLN A 95 7.047 -3.950 -2.078 1.00 0.00 N ATOM 1343 CA GLN A 95 6.118 -3.804 -3.187 1.00 0.00 C ATOM 1344 C GLN A 95 4.791 -3.247 -2.695 1.00 0.00 C ATOM 1345 O GLN A 95 4.060 -3.911 -1.963 1.00 0.00 O ATOM 1346 CB GLN A 95 5.987 -5.166 -3.904 1.00 0.00 C ATOM 1347 CG GLN A 95 4.774 -5.272 -4.835 1.00 0.00 C ATOM 1348 CD GLN A 95 4.629 -6.680 -5.396 1.00 0.00 C ATOM 1349 OE1 GLN A 95 4.871 -6.863 -6.682 1.00 0.00 O flip ATOM 1350 NE2 GLN A 95 4.291 -7.613 -4.675 1.00 0.00 N flip ATOM 0 H GLN A 95 6.681 -4.528 -1.321 1.00 0.00 H new ATOM 0 HA GLN A 95 6.491 -3.083 -3.915 1.00 0.00 H new ATOM 0 HB2 GLN A 95 6.892 -5.348 -4.483 1.00 0.00 H new ATOM 0 HB3 GLN A 95 5.925 -5.954 -3.154 1.00 0.00 H new ATOM 0 HG2 GLN A 95 3.870 -5.000 -4.290 1.00 0.00 H new ATOM 0 HG3 GLN A 95 4.878 -4.561 -5.654 1.00 0.00 H new ATOM 0 HE21 GLN A 95 4.109 -7.452 -3.684 1.00 0.00 H new ATOM 0 HE22 GLN A 95 4.192 -8.550 -5.066 1.00 0.00 H new ATOM 1359 N LEU A 96 4.469 -2.037 -3.143 1.00 0.00 N ATOM 1360 CA LEU A 96 3.196 -1.357 -2.968 1.00 0.00 C ATOM 1361 C LEU A 96 2.633 -1.133 -4.369 1.00 0.00 C ATOM 1362 O LEU A 96 3.395 -0.866 -5.298 1.00 0.00 O ATOM 1363 CB LEU A 96 3.392 -0.043 -2.175 1.00 0.00 C ATOM 1364 CG LEU A 96 4.112 -0.165 -0.799 1.00 0.00 C ATOM 1365 CD1 LEU A 96 3.904 -1.478 -0.051 1.00 0.00 C ATOM 1366 CD2 LEU A 96 5.588 0.206 -0.909 1.00 0.00 C ATOM 0 H LEU A 96 5.134 -1.472 -3.671 1.00 0.00 H new ATOM 0 HA LEU A 96 2.490 -1.946 -2.382 1.00 0.00 H new ATOM 0 HB2 LEU A 96 3.959 0.650 -2.797 1.00 0.00 H new ATOM 0 HB3 LEU A 96 2.412 0.405 -2.009 1.00 0.00 H new ATOM 0 HG LEU A 96 3.611 0.568 -0.167 1.00 0.00 H new ATOM 0 HD11 LEU A 96 4.451 -1.450 0.892 1.00 0.00 H new ATOM 0 HD12 LEU A 96 2.842 -1.618 0.150 1.00 0.00 H new ATOM 0 HD13 LEU A 96 4.271 -2.305 -0.659 1.00 0.00 H new ATOM 0 HD21 LEU A 96 6.061 0.110 0.068 1.00 0.00 H new ATOM 0 HD22 LEU A 96 6.079 -0.462 -1.617 1.00 0.00 H new ATOM 0 HD23 LEU A 96 5.680 1.235 -1.257 1.00 0.00 H new ATOM 1378 N LEU A 97 1.320 -1.298 -4.558 1.00 0.00 N ATOM 1379 CA LEU A 97 0.682 -1.309 -5.885 1.00 0.00 C ATOM 1380 C LEU A 97 -0.574 -0.431 -5.850 1.00 0.00 C ATOM 1381 O LEU A 97 -0.985 -0.022 -4.763 1.00 0.00 O ATOM 1382 CB LEU A 97 0.317 -2.751 -6.311 1.00 0.00 C ATOM 1383 CG LEU A 97 1.365 -3.854 -6.029 1.00 0.00 C ATOM 1384 CD1 LEU A 97 0.921 -4.718 -4.839 1.00 0.00 C ATOM 1385 CD2 LEU A 97 1.592 -4.758 -7.241 1.00 0.00 C ATOM 0 H LEU A 97 0.662 -1.429 -3.790 1.00 0.00 H new ATOM 0 HA LEU A 97 1.384 -0.912 -6.618 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -0.610 -3.028 -5.809 1.00 0.00 H new ATOM 0 HB3 LEU A 97 0.110 -2.746 -7.381 1.00 0.00 H new ATOM 0 HG LEU A 97 2.303 -3.348 -5.799 1.00 0.00 H new ATOM 0 HD11 LEU A 97 1.667 -5.490 -4.651 1.00 0.00 H new ATOM 0 HD12 LEU A 97 0.817 -4.091 -3.953 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -0.036 -5.187 -5.067 1.00 0.00 H new ATOM 0 HD21 LEU A 97 2.335 -5.516 -6.995 1.00 0.00 H new ATOM 0 HD22 LEU A 97 0.655 -5.243 -7.513 1.00 0.00 H new ATOM 0 HD23 LEU A 97 1.948 -4.160 -8.080 1.00 0.00 H new ATOM 1397 N ASN A 98 -1.244 -0.173 -6.976 1.00 0.00 N ATOM 1398 CA ASN A 98 -2.609 0.397 -7.013 1.00 0.00 C ATOM 1399 C ASN A 98 -3.650 -0.730 -7.064 1.00 0.00 C ATOM 1400 O ASN A 98 -3.249 -1.891 -7.081 1.00 0.00 O ATOM 1401 CB ASN A 98 -2.785 1.375 -8.181 1.00 0.00 C ATOM 1402 CG ASN A 98 -2.415 0.834 -9.539 1.00 0.00 C ATOM 1403 OD1 ASN A 98 -2.858 -0.360 -9.893 1.00 0.00 O flip ATOM 1404 ND2 ASN A 98 -1.746 1.508 -10.306 1.00 0.00 N flip ATOM 0 H ASN A 98 -0.857 -0.353 -7.902 1.00 0.00 H new ATOM 0 HA ASN A 98 -2.763 0.969 -6.098 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -3.826 1.698 -8.209 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -2.181 2.261 -7.985 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -1.412 2.428 -10.018 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -1.521 1.152 -11.235 1.00 0.00 H new ATOM 1411 N GLU A 99 -4.953 -0.441 -7.126 1.00 0.00 N ATOM 1412 CA GLU A 99 -6.044 -1.427 -7.066 1.00 0.00 C ATOM 1413 C GLU A 99 -5.877 -2.538 -8.108 1.00 0.00 C ATOM 1414 O GLU A 99 -5.989 -3.717 -7.782 1.00 0.00 O ATOM 1415 CB GLU A 99 -7.379 -0.693 -7.256 1.00 0.00 C ATOM 1416 CG GLU A 99 -8.601 -1.623 -7.292 1.00 0.00 C ATOM 1417 CD GLU A 99 -9.282 -1.606 -8.651 1.00 0.00 C ATOM 1418 OE1 GLU A 99 -8.602 -1.777 -9.685 1.00 0.00 O ATOM 1419 OE2 GLU A 99 -10.512 -1.378 -8.710 1.00 0.00 O ATOM 0 H GLU A 99 -5.292 0.516 -7.223 1.00 0.00 H new ATOM 0 HA GLU A 99 -6.022 -1.915 -6.092 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -7.506 0.026 -6.446 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -7.340 -0.124 -8.185 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -8.291 -2.640 -7.053 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -9.313 -1.318 -6.525 1.00 0.00 H new ATOM 1426 N GLN A 100 -5.535 -2.165 -9.345 1.00 0.00 N ATOM 1427 CA GLN A 100 -5.277 -3.071 -10.473 1.00 0.00 C ATOM 1428 C GLN A 100 -4.018 -3.912 -10.288 1.00 0.00 C ATOM 1429 O GLN A 100 -3.649 -4.681 -11.170 1.00 0.00 O ATOM 1430 CB GLN A 100 -5.152 -2.245 -11.751 1.00 0.00 C ATOM 1431 CG GLN A 100 -6.495 -1.637 -12.124 1.00 0.00 C ATOM 1432 CD GLN A 100 -6.382 -0.832 -13.403 1.00 0.00 C ATOM 1433 OE1 GLN A 100 -6.167 -1.351 -14.495 1.00 0.00 O ATOM 1434 NE2 GLN A 100 -6.410 0.479 -13.252 1.00 0.00 N ATOM 0 H GLN A 100 -5.425 -1.184 -9.600 1.00 0.00 H new ATOM 0 HA GLN A 100 -6.115 -3.765 -10.532 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -4.415 -1.455 -11.610 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -4.792 -2.875 -12.565 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -7.235 -2.427 -12.250 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -6.847 -0.997 -11.315 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -6.591 0.883 -12.333 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -6.251 1.088 -14.054 1.00 0.00 H new ATOM 1443 N GLN A 101 -3.361 -3.753 -9.146 1.00 0.00 N ATOM 1444 CA GLN A 101 -2.181 -4.479 -8.705 1.00 0.00 C ATOM 1445 C GLN A 101 -1.018 -4.180 -9.651 1.00 0.00 C ATOM 1446 O GLN A 101 -0.178 -5.034 -9.930 1.00 0.00 O ATOM 1447 CB GLN A 101 -2.510 -5.973 -8.540 1.00 0.00 C ATOM 1448 CG GLN A 101 -3.828 -6.175 -7.768 1.00 0.00 C ATOM 1449 CD GLN A 101 -4.142 -7.620 -7.413 1.00 0.00 C ATOM 1450 OE1 GLN A 101 -4.072 -8.513 -8.254 1.00 0.00 O ATOM 1451 NE2 GLN A 101 -4.557 -7.886 -6.183 1.00 0.00 N ATOM 0 H GLN A 101 -3.662 -3.064 -8.456 1.00 0.00 H new ATOM 0 HA GLN A 101 -1.861 -4.145 -7.718 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -2.586 -6.441 -9.521 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -1.697 -6.470 -8.011 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -3.788 -5.590 -6.849 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -4.648 -5.776 -8.365 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -4.612 -7.139 -5.491 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -4.821 -8.838 -5.929 1.00 0.00 H new ATOM 1460 N ASN A 102 -1.012 -2.962 -10.194 1.00 0.00 N ATOM 1461 CA ASN A 102 -0.041 -2.515 -11.169 1.00 0.00 C ATOM 1462 C ASN A 102 1.217 -2.040 -10.442 1.00 0.00 C ATOM 1463 O ASN A 102 1.106 -1.481 -9.345 1.00 0.00 O ATOM 1464 CB ASN A 102 -0.677 -1.410 -12.013 1.00 0.00 C ATOM 1465 CG ASN A 102 0.126 -1.178 -13.270 1.00 0.00 C ATOM 1466 OD1 ASN A 102 0.816 -0.174 -13.420 1.00 0.00 O ATOM 1467 ND2 ASN A 102 -0.007 -2.086 -14.211 1.00 0.00 N ATOM 0 H ASN A 102 -1.702 -2.249 -9.957 1.00 0.00 H new ATOM 0 HA ASN A 102 0.254 -3.325 -11.837 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -1.699 -1.685 -12.273 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -0.732 -0.488 -11.434 1.00 0.00 H new ATOM 0 HD21 ASN A 102 0.472 -1.969 -15.104 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -0.590 -2.907 -14.048 1.00 0.00 H new ATOM 1474 N GLN A 103 2.396 -2.281 -11.021 1.00 0.00 N ATOM 1475 CA GLN A 103 3.692 -1.953 -10.439 1.00 0.00 C ATOM 1476 C GLN A 103 3.871 -0.431 -10.368 1.00 0.00 C ATOM 1477 O GLN A 103 4.423 0.174 -11.288 1.00 0.00 O ATOM 1478 CB GLN A 103 4.814 -2.689 -11.211 1.00 0.00 C ATOM 1479 CG GLN A 103 6.229 -2.457 -10.633 1.00 0.00 C ATOM 1480 CD GLN A 103 7.301 -3.433 -11.149 1.00 0.00 C ATOM 1481 OE1 GLN A 103 7.042 -4.580 -11.511 1.00 0.00 O ATOM 1482 NE2 GLN A 103 8.561 -3.026 -11.113 1.00 0.00 N ATOM 0 H GLN A 103 2.473 -2.724 -11.937 1.00 0.00 H new ATOM 0 HA GLN A 103 3.749 -2.306 -9.409 1.00 0.00 H new ATOM 0 HB2 GLN A 103 4.602 -3.758 -11.208 1.00 0.00 H new ATOM 0 HB3 GLN A 103 4.799 -2.364 -12.251 1.00 0.00 H new ATOM 0 HG2 GLN A 103 6.540 -1.439 -10.868 1.00 0.00 H new ATOM 0 HG3 GLN A 103 6.180 -2.533 -9.547 1.00 0.00 H new ATOM 0 HE21 GLN A 103 8.782 -2.076 -10.814 1.00 0.00 H new ATOM 0 HE22 GLN A 103 9.310 -3.662 -11.385 1.00 0.00 H new ATOM 1491 N ILE A 104 3.418 0.176 -9.267 1.00 0.00 N ATOM 1492 CA ILE A 104 3.663 1.573 -8.915 1.00 0.00 C ATOM 1493 C ILE A 104 5.182 1.799 -8.937 1.00 0.00 C ATOM 1494 O ILE A 104 5.887 1.116 -8.182 1.00 0.00 O ATOM 1495 CB ILE A 104 3.036 1.885 -7.529 1.00 0.00 C ATOM 1496 CG1 ILE A 104 1.518 2.115 -7.699 1.00 0.00 C ATOM 1497 CG2 ILE A 104 3.674 3.070 -6.768 1.00 0.00 C ATOM 1498 CD1 ILE A 104 0.792 2.410 -6.381 1.00 0.00 C ATOM 0 H ILE A 104 2.851 -0.311 -8.573 1.00 0.00 H new ATOM 0 HA ILE A 104 3.196 2.253 -9.628 1.00 0.00 H new ATOM 0 HB ILE A 104 3.239 1.014 -6.906 1.00 0.00 H new ATOM 0 HG12 ILE A 104 1.359 2.946 -8.386 1.00 0.00 H new ATOM 0 HG13 ILE A 104 1.074 1.232 -8.159 1.00 0.00 H new ATOM 0 HG21 ILE A 104 3.165 3.206 -5.814 1.00 0.00 H new ATOM 0 HG22 ILE A 104 4.729 2.863 -6.591 1.00 0.00 H new ATOM 0 HG23 ILE A 104 3.578 3.978 -7.363 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -0.270 2.561 -6.576 1.00 0.00 H new ATOM 0 HD12 ILE A 104 0.920 1.569 -5.699 1.00 0.00 H new ATOM 0 HD13 ILE A 104 1.209 3.310 -5.929 1.00 0.00 H new ATOM 1510 N PRO A 105 5.698 2.740 -9.747 1.00 0.00 N ATOM 1511 CA PRO A 105 7.050 3.245 -9.602 1.00 0.00 C ATOM 1512 C PRO A 105 7.135 4.177 -8.390 1.00 0.00 C ATOM 1513 O PRO A 105 6.182 4.885 -8.061 1.00 0.00 O ATOM 1514 CB PRO A 105 7.325 4.005 -10.899 1.00 0.00 C ATOM 1515 CG PRO A 105 5.954 4.518 -11.331 1.00 0.00 C ATOM 1516 CD PRO A 105 4.982 3.481 -10.776 1.00 0.00 C ATOM 0 HA PRO A 105 7.779 2.452 -9.437 1.00 0.00 H new ATOM 0 HB2 PRO A 105 8.025 4.825 -10.739 1.00 0.00 H new ATOM 0 HB3 PRO A 105 7.764 3.355 -11.656 1.00 0.00 H new ATOM 0 HG2 PRO A 105 5.753 5.510 -10.927 1.00 0.00 H new ATOM 0 HG3 PRO A 105 5.880 4.595 -12.416 1.00 0.00 H new ATOM 0 HD2 PRO A 105 4.098 3.964 -10.360 1.00 0.00 H new ATOM 0 HD3 PRO A 105 4.638 2.812 -11.565 1.00 0.00 H new ATOM 1524 N LEU A 106 8.308 4.230 -7.765 1.00 0.00 N ATOM 1525 CA LEU A 106 8.617 5.216 -6.743 1.00 0.00 C ATOM 1526 C LEU A 106 8.797 6.599 -7.366 1.00 0.00 C ATOM 1527 O LEU A 106 8.981 6.725 -8.581 1.00 0.00 O ATOM 1528 CB LEU A 106 9.876 4.777 -5.977 1.00 0.00 C ATOM 1529 CG LEU A 106 9.539 4.479 -4.512 1.00 0.00 C ATOM 1530 CD1 LEU A 106 10.752 3.861 -3.847 1.00 0.00 C ATOM 1531 CD2 LEU A 106 9.164 5.732 -3.724 1.00 0.00 C ATOM 0 H LEU A 106 9.074 3.584 -7.957 1.00 0.00 H new ATOM 0 HA LEU A 106 7.787 5.283 -6.040 1.00 0.00 H new ATOM 0 HB2 LEU A 106 10.303 3.890 -6.445 1.00 0.00 H new ATOM 0 HB3 LEU A 106 10.632 5.560 -6.030 1.00 0.00 H new ATOM 0 HG LEU A 106 8.681 3.807 -4.511 1.00 0.00 H new ATOM 0 HD11 LEU A 106 10.524 3.644 -2.803 1.00 0.00 H new ATOM 0 HD12 LEU A 106 11.017 2.936 -4.360 1.00 0.00 H new ATOM 0 HD13 LEU A 106 11.589 4.557 -3.899 1.00 0.00 H new ATOM 0 HD21 LEU A 106 8.936 5.459 -2.694 1.00 0.00 H new ATOM 0 HD22 LEU A 106 9.998 6.433 -3.737 1.00 0.00 H new ATOM 0 HD23 LEU A 106 8.290 6.199 -4.178 1.00 0.00 H new ATOM 1543 N ASN A 107 8.808 7.629 -6.510 1.00 0.00 N ATOM 1544 CA ASN A 107 9.037 9.046 -6.834 1.00 0.00 C ATOM 1545 C ASN A 107 8.140 9.563 -7.963 1.00 0.00 C ATOM 1546 O ASN A 107 8.508 10.475 -8.712 1.00 0.00 O ATOM 1547 CB ASN A 107 10.527 9.378 -7.045 1.00 0.00 C ATOM 1548 CG ASN A 107 11.501 8.433 -6.367 1.00 0.00 C ATOM 1549 OD1 ASN A 107 12.105 7.590 -7.022 1.00 0.00 O ATOM 1550 ND2 ASN A 107 11.664 8.530 -5.063 1.00 0.00 N ATOM 0 H ASN A 107 8.648 7.489 -5.512 1.00 0.00 H new ATOM 0 HA ASN A 107 8.731 9.602 -5.948 1.00 0.00 H new ATOM 0 HB2 ASN A 107 10.734 9.381 -8.115 1.00 0.00 H new ATOM 0 HB3 ASN A 107 10.713 10.389 -6.681 1.00 0.00 H new ATOM 0 HD21 ASN A 107 12.302 7.897 -4.580 1.00 0.00 H new ATOM 0 HD22 ASN A 107 11.152 9.238 -4.536 1.00 0.00 H new ATOM 1557 N ALA A 108 6.969 8.949 -8.105 1.00 0.00 N ATOM 1558 CA ALA A 108 6.095 9.091 -9.238 1.00 0.00 C ATOM 1559 C ALA A 108 5.516 10.506 -9.268 1.00 0.00 C ATOM 1560 O ALA A 108 5.155 11.041 -8.209 1.00 0.00 O ATOM 1561 CB ALA A 108 5.001 8.032 -9.121 1.00 0.00 C ATOM 0 H ALA A 108 6.599 8.315 -7.397 1.00 0.00 H new ATOM 0 HA ALA A 108 6.635 8.944 -10.174 1.00 0.00 H new ATOM 0 HB1 ALA A 108 4.321 8.116 -9.969 1.00 0.00 H new ATOM 0 HB2 ALA A 108 5.454 7.040 -9.115 1.00 0.00 H new ATOM 0 HB3 ALA A 108 4.446 8.183 -8.195 1.00 0.00 H new ATOM 1567 N PRO A 109 5.396 11.115 -10.456 1.00 0.00 N ATOM 1568 CA PRO A 109 4.593 12.303 -10.641 1.00 0.00 C ATOM 1569 C PRO A 109 3.118 11.898 -10.652 1.00 0.00 C ATOM 1570 O PRO A 109 2.760 10.725 -10.792 1.00 0.00 O ATOM 1571 CB PRO A 109 5.006 12.836 -12.011 1.00 0.00 C ATOM 1572 CG PRO A 109 5.224 11.543 -12.791 1.00 0.00 C ATOM 1573 CD PRO A 109 5.836 10.611 -11.748 1.00 0.00 C ATOM 0 HA PRO A 109 4.733 13.047 -9.857 1.00 0.00 H new ATOM 0 HB2 PRO A 109 4.232 13.459 -12.459 1.00 0.00 H new ATOM 0 HB3 PRO A 109 5.911 13.441 -11.959 1.00 0.00 H new ATOM 0 HG2 PRO A 109 4.288 11.147 -13.186 1.00 0.00 H new ATOM 0 HG3 PRO A 109 5.891 11.692 -13.640 1.00 0.00 H new ATOM 0 HD2 PRO A 109 5.505 9.584 -11.900 1.00 0.00 H new ATOM 0 HD3 PRO A 109 6.924 10.609 -11.817 1.00 0.00 H new ATOM 1581 N SER A 110 2.244 12.892 -10.634 1.00 0.00 N ATOM 1582 CA SER A 110 0.815 12.700 -10.796 1.00 0.00 C ATOM 1583 C SER A 110 0.449 12.061 -12.135 1.00 0.00 C ATOM 1584 O SER A 110 -0.581 11.407 -12.225 1.00 0.00 O ATOM 1585 CB SER A 110 0.103 14.040 -10.618 1.00 0.00 C ATOM 1586 OG SER A 110 0.877 15.135 -11.078 1.00 0.00 O ATOM 0 H SER A 110 2.513 13.867 -10.505 1.00 0.00 H new ATOM 0 HA SER A 110 0.484 12.000 -10.029 1.00 0.00 H new ATOM 0 HB2 SER A 110 -0.844 14.018 -11.157 1.00 0.00 H new ATOM 0 HB3 SER A 110 -0.133 14.184 -9.564 1.00 0.00 H new ATOM 0 HG SER A 110 0.378 15.968 -10.944 1.00 0.00 H new ATOM 1592 N SER A 111 1.267 12.204 -13.171 1.00 0.00 N ATOM 1593 CA SER A 111 1.031 11.642 -14.488 1.00 0.00 C ATOM 1594 C SER A 111 1.301 10.130 -14.557 1.00 0.00 C ATOM 1595 O SER A 111 1.184 9.545 -15.638 1.00 0.00 O ATOM 1596 CB SER A 111 1.867 12.443 -15.487 1.00 0.00 C ATOM 1597 OG SER A 111 3.183 12.689 -15.012 1.00 0.00 O ATOM 0 H SER A 111 2.138 12.731 -13.112 1.00 0.00 H new ATOM 0 HA SER A 111 -0.026 11.728 -14.738 1.00 0.00 H new ATOM 0 HB2 SER A 111 1.919 11.901 -16.431 1.00 0.00 H new ATOM 0 HB3 SER A 111 1.373 13.393 -15.692 1.00 0.00 H new ATOM 0 HG SER A 111 3.682 13.202 -15.682 1.00 0.00 H new ATOM 1603 N ALA A 112 1.662 9.471 -13.445 1.00 0.00 N ATOM 1604 CA ALA A 112 2.029 8.056 -13.435 1.00 0.00 C ATOM 1605 C ALA A 112 1.081 7.194 -12.592 1.00 0.00 C ATOM 1606 O ALA A 112 1.315 5.994 -12.464 1.00 0.00 O ATOM 1607 CB ALA A 112 3.475 7.942 -12.948 1.00 0.00 C ATOM 0 H ALA A 112 1.706 9.911 -12.526 1.00 0.00 H new ATOM 0 HA ALA A 112 1.940 7.666 -14.449 1.00 0.00 H new ATOM 0 HB1 ALA A 112 3.772 6.893 -12.932 1.00 0.00 H new ATOM 0 HB2 ALA A 112 4.130 8.494 -13.621 1.00 0.00 H new ATOM 0 HB3 ALA A 112 3.554 8.357 -11.943 1.00 0.00 H new ATOM 1613 N LEU A 113 0.047 7.769 -11.982 1.00 0.00 N ATOM 1614 CA LEU A 113 -1.007 7.097 -11.242 1.00 0.00 C ATOM 1615 C LEU A 113 -2.291 7.914 -11.418 1.00 0.00 C ATOM 1616 O LEU A 113 -2.258 9.027 -11.946 1.00 0.00 O ATOM 1617 CB LEU A 113 -0.630 6.915 -9.753 1.00 0.00 C ATOM 1618 CG LEU A 113 0.198 7.994 -9.023 1.00 0.00 C ATOM 1619 CD1 LEU A 113 1.707 7.891 -9.260 1.00 0.00 C ATOM 1620 CD2 LEU A 113 -0.275 9.433 -9.219 1.00 0.00 C ATOM 0 H LEU A 113 -0.081 8.781 -11.995 1.00 0.00 H new ATOM 0 HA LEU A 113 -1.158 6.090 -11.630 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -1.559 6.790 -9.197 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -0.081 5.977 -9.671 1.00 0.00 H new ATOM 0 HG LEU A 113 0.005 7.751 -7.978 1.00 0.00 H new ATOM 0 HD11 LEU A 113 2.216 8.684 -8.713 1.00 0.00 H new ATOM 0 HD12 LEU A 113 2.065 6.922 -8.911 1.00 0.00 H new ATOM 0 HD13 LEU A 113 1.916 7.993 -10.325 1.00 0.00 H new ATOM 0 HD21 LEU A 113 0.376 10.109 -8.664 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -0.241 9.686 -10.279 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -1.297 9.533 -8.854 1.00 0.00 H new ATOM 1632 N SER A 114 -3.432 7.377 -10.984 1.00 0.00 N ATOM 1633 CA SER A 114 -4.709 8.051 -11.164 1.00 0.00 C ATOM 1634 C SER A 114 -5.684 7.666 -10.055 1.00 0.00 C ATOM 1635 O SER A 114 -6.203 6.543 -10.022 1.00 0.00 O ATOM 1636 CB SER A 114 -5.256 7.772 -12.569 1.00 0.00 C ATOM 1637 OG SER A 114 -5.172 6.408 -12.958 1.00 0.00 O ATOM 0 H SER A 114 -3.493 6.478 -10.506 1.00 0.00 H new ATOM 0 HA SER A 114 -4.567 9.129 -11.085 1.00 0.00 H new ATOM 0 HB2 SER A 114 -6.298 8.089 -12.612 1.00 0.00 H new ATOM 0 HB3 SER A 114 -4.708 8.380 -13.289 1.00 0.00 H new ATOM 0 HG SER A 114 -5.539 6.302 -13.861 1.00 0.00 H new ATOM 1643 N TRP A 115 -5.927 8.609 -9.146 1.00 0.00 N ATOM 1644 CA TRP A 115 -6.905 8.487 -8.077 1.00 0.00 C ATOM 1645 C TRP A 115 -8.328 8.526 -8.654 1.00 0.00 C ATOM 1646 O TRP A 115 -8.527 8.621 -9.865 1.00 0.00 O ATOM 1647 CB TRP A 115 -6.673 9.599 -7.040 1.00 0.00 C ATOM 1648 CG TRP A 115 -7.157 9.280 -5.659 1.00 0.00 C ATOM 1649 CD1 TRP A 115 -8.351 9.626 -5.130 1.00 0.00 C ATOM 1650 CD2 TRP A 115 -6.460 8.545 -4.613 1.00 0.00 C ATOM 1651 NE1 TRP A 115 -8.461 9.122 -3.850 1.00 0.00 N ATOM 1652 CE2 TRP A 115 -7.304 8.477 -3.466 1.00 0.00 C ATOM 1653 CE3 TRP A 115 -5.196 7.931 -4.521 1.00 0.00 C ATOM 1654 CZ2 TRP A 115 -6.902 7.837 -2.285 1.00 0.00 C ATOM 1655 CZ3 TRP A 115 -4.768 7.323 -3.328 1.00 0.00 C ATOM 1656 CH2 TRP A 115 -5.617 7.277 -2.209 1.00 0.00 C ATOM 0 H TRP A 115 -5.433 9.501 -9.136 1.00 0.00 H new ATOM 0 HA TRP A 115 -6.786 7.528 -7.574 1.00 0.00 H new ATOM 0 HB2 TRP A 115 -5.606 9.817 -6.995 1.00 0.00 H new ATOM 0 HB3 TRP A 115 -7.170 10.506 -7.384 1.00 0.00 H new ATOM 0 HD1 TRP A 115 -9.107 10.210 -5.634 1.00 0.00 H new ATOM 0 HE1 TRP A 115 -9.291 9.215 -3.264 1.00 0.00 H new ATOM 0 HE3 TRP A 115 -4.544 7.927 -5.382 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 -7.574 7.775 -1.442 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 -3.781 6.889 -3.271 1.00 0.00 H new ATOM 0 HH2 TRP A 115 -5.282 6.812 -1.294 1.00 0.00 H new ATOM 1667 N THR A 116 -9.326 8.493 -7.781 1.00 0.00 N ATOM 1668 CA THR A 116 -10.736 8.303 -8.092 1.00 0.00 C ATOM 1669 C THR A 116 -11.567 9.527 -7.668 1.00 0.00 C ATOM 1670 O THR A 116 -11.030 10.501 -7.136 1.00 0.00 O ATOM 1671 CB THR A 116 -11.129 6.972 -7.423 1.00 0.00 C ATOM 1672 OG1 THR A 116 -12.410 6.499 -7.794 1.00 0.00 O ATOM 1673 CG2 THR A 116 -11.045 7.026 -5.894 1.00 0.00 C ATOM 0 H THR A 116 -9.164 8.604 -6.780 1.00 0.00 H new ATOM 0 HA THR A 116 -10.936 8.231 -9.161 1.00 0.00 H new ATOM 0 HB THR A 116 -10.387 6.268 -7.799 1.00 0.00 H new ATOM 0 HG1 THR A 116 -12.592 5.653 -7.335 1.00 0.00 H new ATOM 0 HG21 THR A 116 -11.333 6.060 -5.479 1.00 0.00 H new ATOM 0 HG22 THR A 116 -10.023 7.259 -5.594 1.00 0.00 H new ATOM 0 HG23 THR A 116 -11.718 7.797 -5.520 1.00 0.00 H new ATOM 1681 N THR A 117 -12.877 9.478 -7.914 1.00 0.00 N ATOM 1682 CA THR A 117 -13.885 10.397 -7.399 1.00 0.00 C ATOM 1683 C THR A 117 -13.925 10.321 -5.868 1.00 0.00 C ATOM 1684 O THR A 117 -14.456 9.351 -5.312 1.00 0.00 O ATOM 1685 CB THR A 117 -15.254 10.095 -8.035 1.00 0.00 C ATOM 1686 OG1 THR A 117 -15.164 10.197 -9.449 1.00 0.00 O ATOM 1687 CG2 THR A 117 -16.348 11.053 -7.548 1.00 0.00 C ATOM 0 H THR A 117 -13.282 8.756 -8.510 1.00 0.00 H new ATOM 0 HA THR A 117 -13.623 11.420 -7.670 1.00 0.00 H new ATOM 0 HB THR A 117 -15.525 9.083 -7.735 1.00 0.00 H new ATOM 0 HG1 THR A 117 -16.038 10.002 -9.847 1.00 0.00 H new ATOM 0 HG21 THR A 117 -17.294 10.798 -8.026 1.00 0.00 H new ATOM 0 HG22 THR A 117 -16.453 10.966 -6.467 1.00 0.00 H new ATOM 0 HG23 THR A 117 -16.076 12.077 -7.805 1.00 0.00 H new ATOM 1695 N LEU A 118 -13.317 11.303 -5.199 1.00 0.00 N ATOM 1696 CA LEU A 118 -13.566 11.603 -3.795 1.00 0.00 C ATOM 1697 C LEU A 118 -15.032 12.027 -3.666 1.00 0.00 C ATOM 1698 O LEU A 118 -15.425 13.080 -4.174 1.00 0.00 O ATOM 1699 CB LEU A 118 -12.678 12.753 -3.283 1.00 0.00 C ATOM 1700 CG LEU A 118 -11.226 12.469 -2.865 1.00 0.00 C ATOM 1701 CD1 LEU A 118 -11.117 11.441 -1.741 1.00 0.00 C ATOM 1702 CD2 LEU A 118 -10.358 12.057 -4.037 1.00 0.00 C ATOM 0 H LEU A 118 -12.627 11.920 -5.628 1.00 0.00 H new ATOM 0 HA LEU A 118 -13.339 10.717 -3.202 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -12.649 13.514 -4.063 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -13.183 13.196 -2.425 1.00 0.00 H new ATOM 0 HG LEU A 118 -10.851 13.417 -2.479 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -10.068 11.284 -1.492 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -11.648 11.805 -0.862 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -11.557 10.498 -2.066 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -9.343 11.868 -3.689 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -10.762 11.150 -4.488 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -10.345 12.856 -4.778 1.00 0.00 H new ATOM 1714 N THR A 119 -15.855 11.216 -3.017 1.00 0.00 N ATOM 1715 CA THR A 119 -17.220 11.572 -2.649 1.00 0.00 C ATOM 1716 C THR A 119 -17.179 12.532 -1.447 1.00 0.00 C ATOM 1717 O THR A 119 -16.282 12.415 -0.603 1.00 0.00 O ATOM 1718 CB THR A 119 -17.962 10.249 -2.396 1.00 0.00 C ATOM 1719 OG1 THR A 119 -18.165 9.616 -3.651 1.00 0.00 O ATOM 1720 CG2 THR A 119 -19.330 10.299 -1.718 1.00 0.00 C ATOM 0 H THR A 119 -15.589 10.275 -2.726 1.00 0.00 H new ATOM 0 HA THR A 119 -17.759 12.112 -3.427 1.00 0.00 H new ATOM 0 HB THR A 119 -17.314 9.728 -1.692 1.00 0.00 H new ATOM 0 HG1 THR A 119 -18.636 8.767 -3.517 1.00 0.00 H new ATOM 0 HG21 THR A 119 -19.721 9.287 -1.612 1.00 0.00 H new ATOM 0 HG22 THR A 119 -19.231 10.755 -0.733 1.00 0.00 H new ATOM 0 HG23 THR A 119 -20.015 10.891 -2.325 1.00 0.00 H new ATOM 1728 N PRO A 120 -18.123 13.486 -1.347 1.00 0.00 N ATOM 1729 CA PRO A 120 -18.139 14.450 -0.259 1.00 0.00 C ATOM 1730 C PRO A 120 -18.473 13.747 1.053 1.00 0.00 C ATOM 1731 O PRO A 120 -19.216 12.766 1.053 1.00 0.00 O ATOM 1732 CB PRO A 120 -19.222 15.463 -0.641 1.00 0.00 C ATOM 1733 CG PRO A 120 -20.195 14.667 -1.502 1.00 0.00 C ATOM 1734 CD PRO A 120 -19.286 13.665 -2.210 1.00 0.00 C ATOM 0 HA PRO A 120 -17.175 14.937 -0.114 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -19.714 15.871 0.242 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -18.802 16.306 -1.190 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -20.953 14.168 -0.898 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -20.722 15.305 -2.211 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -19.801 12.718 -2.369 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -18.989 14.035 -3.191 1.00 0.00 H new ATOM 1742 N GLY A 121 -17.975 14.276 2.174 1.00 0.00 N ATOM 1743 CA GLY A 121 -18.407 13.882 3.511 1.00 0.00 C ATOM 1744 C GLY A 121 -18.403 12.367 3.751 1.00 0.00 C ATOM 1745 O GLY A 121 -19.279 11.857 4.457 1.00 0.00 O ATOM 0 H GLY A 121 -17.253 14.997 2.175 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -17.757 14.357 4.246 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -19.414 14.263 3.683 1.00 0.00 H new ATOM 1749 N LYS A 122 -17.449 11.628 3.178 1.00 0.00 N ATOM 1750 CA LYS A 122 -17.367 10.171 3.281 1.00 0.00 C ATOM 1751 C LYS A 122 -15.923 9.746 3.546 1.00 0.00 C ATOM 1752 O LYS A 122 -15.018 10.555 3.340 1.00 0.00 O ATOM 1753 CB LYS A 122 -17.968 9.537 2.004 1.00 0.00 C ATOM 1754 CG LYS A 122 -19.323 8.885 2.322 1.00 0.00 C ATOM 1755 CD LYS A 122 -19.872 8.048 1.162 1.00 0.00 C ATOM 1756 CE LYS A 122 -20.795 6.946 1.721 1.00 0.00 C ATOM 1757 NZ LYS A 122 -21.064 5.851 0.758 1.00 0.00 N ATOM 0 H LYS A 122 -16.699 12.035 2.619 1.00 0.00 H new ATOM 0 HA LYS A 122 -17.953 9.810 4.127 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -18.095 10.300 1.236 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -17.282 8.791 1.602 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -19.217 8.251 3.202 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -20.044 9.663 2.575 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -20.423 8.683 0.469 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -19.051 7.601 0.601 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -20.342 6.526 2.619 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -21.742 7.395 2.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -21.690 5.147 1.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -21.524 6.240 -0.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -20.168 5.397 0.489 1.00 0.00 H new ATOM 1771 N PRO A 123 -15.688 8.494 3.983 1.00 0.00 N ATOM 1772 CA PRO A 123 -14.368 8.009 4.376 1.00 0.00 C ATOM 1773 C PRO A 123 -13.471 7.635 3.189 1.00 0.00 C ATOM 1774 O PRO A 123 -12.306 7.287 3.381 1.00 0.00 O ATOM 1775 CB PRO A 123 -14.659 6.816 5.282 1.00 0.00 C ATOM 1776 CG PRO A 123 -15.924 6.220 4.690 1.00 0.00 C ATOM 1777 CD PRO A 123 -16.684 7.453 4.215 1.00 0.00 C ATOM 0 HA PRO A 123 -13.795 8.787 4.880 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -13.838 6.099 5.278 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -14.807 7.125 6.317 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -15.704 5.538 3.868 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -16.491 5.655 5.430 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -17.239 7.238 3.302 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -17.411 7.772 4.962 1.00 0.00 H new ATOM 1785 N ASN A 124 -13.999 7.723 1.965 1.00 0.00 N ATOM 1786 CA ASN A 124 -13.271 7.650 0.701 1.00 0.00 C ATOM 1787 C ASN A 124 -12.277 6.491 0.679 1.00 0.00 C ATOM 1788 O ASN A 124 -11.078 6.627 0.423 1.00 0.00 O ATOM 1789 CB ASN A 124 -12.676 9.019 0.372 1.00 0.00 C ATOM 1790 CG ASN A 124 -13.771 9.914 -0.176 1.00 0.00 C ATOM 1791 OD1 ASN A 124 -14.282 9.667 -1.262 1.00 0.00 O ATOM 1792 ND2 ASN A 124 -14.200 10.915 0.570 1.00 0.00 N ATOM 0 H ASN A 124 -15.001 7.854 1.825 1.00 0.00 H new ATOM 0 HA ASN A 124 -13.961 7.412 -0.109 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -12.238 9.464 1.266 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -11.874 8.915 -0.358 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -14.970 11.499 0.245 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -13.761 11.104 1.471 1.00 0.00 H new ATOM 1799 N THR A 125 -12.801 5.326 1.031 1.00 0.00 N ATOM 1800 CA THR A 125 -12.124 4.052 1.005 1.00 0.00 C ATOM 1801 C THR A 125 -11.768 3.692 -0.455 1.00 0.00 C ATOM 1802 O THR A 125 -12.573 3.856 -1.374 1.00 0.00 O ATOM 1803 CB THR A 125 -13.042 3.031 1.699 1.00 0.00 C ATOM 1804 OG1 THR A 125 -13.627 3.587 2.876 1.00 0.00 O ATOM 1805 CG2 THR A 125 -12.292 1.768 2.111 1.00 0.00 C ATOM 0 H THR A 125 -13.763 5.248 1.359 1.00 0.00 H new ATOM 0 HA THR A 125 -11.177 4.068 1.544 1.00 0.00 H new ATOM 0 HB THR A 125 -13.811 2.776 0.970 1.00 0.00 H new ATOM 0 HG1 THR A 125 -14.208 2.920 3.299 1.00 0.00 H new ATOM 0 HG21 THR A 125 -12.982 1.077 2.597 1.00 0.00 H new ATOM 0 HG22 THR A 125 -11.866 1.293 1.227 1.00 0.00 H new ATOM 0 HG23 THR A 125 -11.492 2.029 2.804 1.00 0.00 H new ATOM 1813 N LEU A 126 -10.531 3.248 -0.658 1.00 0.00 N ATOM 1814 CA LEU A 126 -9.925 2.729 -1.879 1.00 0.00 C ATOM 1815 C LEU A 126 -9.715 1.229 -1.665 1.00 0.00 C ATOM 1816 O LEU A 126 -10.027 0.704 -0.597 1.00 0.00 O ATOM 1817 CB LEU A 126 -8.568 3.439 -2.107 1.00 0.00 C ATOM 1818 CG LEU A 126 -8.587 4.735 -2.937 1.00 0.00 C ATOM 1819 CD1 LEU A 126 -8.677 4.432 -4.430 1.00 0.00 C ATOM 1820 CD2 LEU A 126 -9.688 5.728 -2.560 1.00 0.00 C ATOM 0 H LEU A 126 -9.859 3.243 0.109 1.00 0.00 H new ATOM 0 HA LEU A 126 -10.554 2.904 -2.752 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -8.138 3.668 -1.132 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -7.895 2.734 -2.595 1.00 0.00 H new ATOM 0 HG LEU A 126 -7.640 5.219 -2.699 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -8.689 5.367 -4.991 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -7.815 3.838 -4.733 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -9.592 3.875 -4.634 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -9.619 6.608 -3.200 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -10.663 5.258 -2.693 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -9.568 6.026 -1.519 1.00 0.00 H new ATOM 1832 N ASN A 127 -9.131 0.542 -2.645 1.00 0.00 N ATOM 1833 CA ASN A 127 -8.658 -0.826 -2.501 1.00 0.00 C ATOM 1834 C ASN A 127 -7.207 -0.838 -2.925 1.00 0.00 C ATOM 1835 O ASN A 127 -6.906 -0.549 -4.079 1.00 0.00 O ATOM 1836 CB ASN A 127 -9.485 -1.778 -3.361 1.00 0.00 C ATOM 1837 CG ASN A 127 -10.852 -2.055 -2.767 1.00 0.00 C ATOM 1838 OD1 ASN A 127 -10.998 -2.955 -1.946 1.00 0.00 O ATOM 1839 ND2 ASN A 127 -11.873 -1.317 -3.164 1.00 0.00 N ATOM 0 H ASN A 127 -8.972 0.930 -3.575 1.00 0.00 H new ATOM 0 HA ASN A 127 -8.760 -1.164 -1.470 1.00 0.00 H new ATOM 0 HB2 ASN A 127 -9.604 -1.352 -4.357 1.00 0.00 H new ATOM 0 HB3 ASN A 127 -8.946 -2.718 -3.479 1.00 0.00 H new ATOM 0 HD21 ASN A 127 -12.805 -1.490 -2.787 1.00 0.00 H new ATOM 0 HD22 ASN A 127 -11.730 -0.574 -3.848 1.00 0.00 H new ATOM 1846 N PHE A 128 -6.293 -1.124 -2.004 1.00 0.00 N ATOM 1847 CA PHE A 128 -4.872 -1.245 -2.294 1.00 0.00 C ATOM 1848 C PHE A 128 -4.325 -2.508 -1.633 1.00 0.00 C ATOM 1849 O PHE A 128 -5.002 -3.166 -0.843 1.00 0.00 O ATOM 1850 CB PHE A 128 -4.112 -0.001 -1.802 1.00 0.00 C ATOM 1851 CG PHE A 128 -4.492 1.328 -2.435 1.00 0.00 C ATOM 1852 CD1 PHE A 128 -4.545 1.463 -3.833 1.00 0.00 C ATOM 1853 CD2 PHE A 128 -4.754 2.444 -1.620 1.00 0.00 C ATOM 1854 CE1 PHE A 128 -4.865 2.703 -4.410 1.00 0.00 C ATOM 1855 CE2 PHE A 128 -5.109 3.673 -2.201 1.00 0.00 C ATOM 1856 CZ PHE A 128 -5.156 3.809 -3.598 1.00 0.00 C ATOM 0 H PHE A 128 -6.523 -1.280 -1.023 1.00 0.00 H new ATOM 0 HA PHE A 128 -4.731 -1.318 -3.372 1.00 0.00 H new ATOM 0 HB2 PHE A 128 -4.257 0.082 -0.725 1.00 0.00 H new ATOM 0 HB3 PHE A 128 -3.047 -0.165 -1.969 1.00 0.00 H new ATOM 0 HD1 PHE A 128 -4.339 0.612 -4.465 1.00 0.00 H new ATOM 0 HD2 PHE A 128 -4.682 2.356 -0.546 1.00 0.00 H new ATOM 0 HE1 PHE A 128 -4.887 2.805 -5.485 1.00 0.00 H new ATOM 0 HE2 PHE A 128 -5.347 4.517 -1.570 1.00 0.00 H new ATOM 0 HZ PHE A 128 -5.414 4.758 -4.044 1.00 0.00 H new ATOM 1866 N TYR A 129 -3.073 -2.822 -1.938 1.00 0.00 N ATOM 1867 CA TYR A 129 -2.359 -4.016 -1.534 1.00 0.00 C ATOM 1868 C TYR A 129 -0.892 -3.654 -1.300 1.00 0.00 C ATOM 1869 O TYR A 129 -0.373 -2.715 -1.918 1.00 0.00 O ATOM 1870 CB TYR A 129 -2.480 -5.100 -2.623 1.00 0.00 C ATOM 1871 CG TYR A 129 -3.897 -5.379 -3.080 1.00 0.00 C ATOM 1872 CD1 TYR A 129 -4.732 -6.156 -2.259 1.00 0.00 C ATOM 1873 CD2 TYR A 129 -4.415 -4.776 -4.245 1.00 0.00 C ATOM 1874 CE1 TYR A 129 -6.115 -6.198 -2.498 1.00 0.00 C ATOM 1875 CE2 TYR A 129 -5.795 -4.840 -4.503 1.00 0.00 C ATOM 1876 CZ TYR A 129 -6.656 -5.506 -3.603 1.00 0.00 C ATOM 1877 OH TYR A 129 -8.000 -5.443 -3.792 1.00 0.00 O ATOM 0 H TYR A 129 -2.496 -2.207 -2.511 1.00 0.00 H new ATOM 0 HA TYR A 129 -2.788 -4.412 -0.613 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -1.887 -4.797 -3.486 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -2.045 -6.026 -2.246 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -4.309 -6.722 -1.442 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -3.756 -4.269 -4.934 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -6.762 -6.758 -1.839 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -6.198 -4.378 -5.392 1.00 0.00 H new ATOM 0 HH TYR A 129 -8.193 -4.926 -4.602 1.00 0.00 H new ATOM 1887 N ALA A 130 -0.204 -4.417 -0.454 1.00 0.00 N ATOM 1888 CA ALA A 130 1.239 -4.376 -0.251 1.00 0.00 C ATOM 1889 C ALA A 130 1.741 -5.811 -0.151 1.00 0.00 C ATOM 1890 O ALA A 130 0.989 -6.703 0.263 1.00 0.00 O ATOM 1891 CB ALA A 130 1.589 -3.616 1.039 1.00 0.00 C ATOM 0 H ALA A 130 -0.661 -5.113 0.136 1.00 0.00 H new ATOM 0 HA ALA A 130 1.711 -3.857 -1.086 1.00 0.00 H new ATOM 0 HB1 ALA A 130 2.671 -3.599 1.169 1.00 0.00 H new ATOM 0 HB2 ALA A 130 1.215 -2.594 0.972 1.00 0.00 H new ATOM 0 HB3 ALA A 130 1.129 -4.115 1.892 1.00 0.00 H new ATOM 1897 N ARG A 131 3.015 -6.039 -0.485 1.00 0.00 N ATOM 1898 CA ARG A 131 3.695 -7.302 -0.244 1.00 0.00 C ATOM 1899 C ARG A 131 5.214 -7.160 -0.389 1.00 0.00 C ATOM 1900 O ARG A 131 5.734 -6.040 -0.411 1.00 0.00 O ATOM 1901 CB ARG A 131 3.093 -8.397 -1.147 1.00 0.00 C ATOM 1902 CG ARG A 131 2.986 -9.729 -0.402 1.00 0.00 C ATOM 1903 CD ARG A 131 2.111 -9.807 0.850 1.00 0.00 C ATOM 1904 NE ARG A 131 2.084 -11.172 1.377 1.00 0.00 N ATOM 1905 CZ ARG A 131 3.087 -11.901 1.861 1.00 0.00 C ATOM 1906 NH1 ARG A 131 4.242 -11.341 2.182 1.00 0.00 N ATOM 1907 NH2 ARG A 131 2.927 -13.206 2.007 1.00 0.00 N ATOM 0 H ARG A 131 3.605 -5.339 -0.935 1.00 0.00 H new ATOM 0 HA ARG A 131 3.532 -7.608 0.789 1.00 0.00 H new ATOM 0 HB2 ARG A 131 2.105 -8.088 -1.489 1.00 0.00 H new ATOM 0 HB3 ARG A 131 3.713 -8.522 -2.035 1.00 0.00 H new ATOM 0 HG2 ARG A 131 2.618 -10.473 -1.108 1.00 0.00 H new ATOM 0 HG3 ARG A 131 3.995 -10.030 -0.119 1.00 0.00 H new ATOM 0 HD2 ARG A 131 2.493 -9.126 1.610 1.00 0.00 H new ATOM 0 HD3 ARG A 131 1.098 -9.483 0.612 1.00 0.00 H new ATOM 0 HE ARG A 131 1.171 -11.627 1.373 1.00 0.00 H new ATOM 0 HH11 ARG A 131 4.373 -10.337 2.060 1.00 0.00 H new ATOM 0 HH12 ARG A 131 5.001 -11.913 2.552 1.00 0.00 H new ATOM 0 HH21 ARG A 131 2.042 -13.643 1.750 1.00 0.00 H new ATOM 0 HH22 ARG A 131 3.689 -13.775 2.377 1.00 0.00 H new ATOM 1921 N LEU A 132 5.930 -8.289 -0.401 1.00 0.00 N ATOM 1922 CA LEU A 132 7.342 -8.377 -0.741 1.00 0.00 C ATOM 1923 C LEU A 132 7.446 -8.926 -2.156 1.00 0.00 C ATOM 1924 O LEU A 132 6.489 -9.454 -2.737 1.00 0.00 O ATOM 1925 CB LEU A 132 8.111 -9.299 0.233 1.00 0.00 C ATOM 1926 CG LEU A 132 9.560 -8.837 0.503 1.00 0.00 C ATOM 1927 CD1 LEU A 132 9.648 -7.483 1.210 1.00 0.00 C ATOM 1928 CD2 LEU A 132 10.259 -9.848 1.413 1.00 0.00 C ATOM 0 H LEU A 132 5.523 -9.194 -0.165 1.00 0.00 H new ATOM 0 HA LEU A 132 7.789 -7.386 -0.668 1.00 0.00 H new ATOM 0 HB2 LEU A 132 7.571 -9.347 1.179 1.00 0.00 H new ATOM 0 HB3 LEU A 132 8.130 -10.310 -0.174 1.00 0.00 H new ATOM 0 HG LEU A 132 10.030 -8.753 -0.477 1.00 0.00 H new ATOM 0 HD11 LEU A 132 10.695 -7.222 1.367 1.00 0.00 H new ATOM 0 HD12 LEU A 132 9.172 -6.720 0.595 1.00 0.00 H new ATOM 0 HD13 LEU A 132 9.140 -7.542 2.173 1.00 0.00 H new ATOM 0 HD21 LEU A 132 11.281 -9.521 1.603 1.00 0.00 H new ATOM 0 HD22 LEU A 132 9.720 -9.921 2.358 1.00 0.00 H new ATOM 0 HD23 LEU A 132 10.275 -10.824 0.928 1.00 0.00 H new ATOM 1940 N MET A 133 8.643 -8.841 -2.693 1.00 0.00 N ATOM 1941 CA MET A 133 8.885 -8.958 -4.105 1.00 0.00 C ATOM 1942 C MET A 133 10.375 -9.229 -4.213 1.00 0.00 C ATOM 1943 O MET A 133 11.151 -8.618 -3.482 1.00 0.00 O ATOM 1944 CB MET A 133 8.445 -7.602 -4.667 1.00 0.00 C ATOM 1945 CG MET A 133 9.111 -7.120 -5.938 1.00 0.00 C ATOM 1946 SD MET A 133 8.084 -7.194 -7.412 1.00 0.00 S ATOM 1947 CE MET A 133 8.660 -8.832 -7.824 1.00 0.00 C ATOM 0 H MET A 133 9.489 -8.685 -2.145 1.00 0.00 H new ATOM 0 HA MET A 133 8.360 -9.744 -4.648 1.00 0.00 H new ATOM 0 HB2 MET A 133 7.371 -7.645 -4.846 1.00 0.00 H new ATOM 0 HB3 MET A 133 8.609 -6.850 -3.896 1.00 0.00 H new ATOM 0 HG2 MET A 133 9.436 -6.090 -5.792 1.00 0.00 H new ATOM 0 HG3 MET A 133 10.008 -7.716 -6.108 1.00 0.00 H new ATOM 0 HE1 MET A 133 8.203 -9.154 -8.760 1.00 0.00 H new ATOM 0 HE2 MET A 133 9.744 -8.819 -7.935 1.00 0.00 H new ATOM 0 HE3 MET A 133 8.385 -9.525 -7.029 1.00 0.00 H new ATOM 1957 N ALA A 134 10.799 -10.144 -5.074 1.00 0.00 N ATOM 1958 CA ALA A 134 12.216 -10.321 -5.309 1.00 0.00 C ATOM 1959 C ALA A 134 12.752 -9.204 -6.186 1.00 0.00 C ATOM 1960 O ALA A 134 12.072 -8.700 -7.077 1.00 0.00 O ATOM 1961 CB ALA A 134 12.486 -11.668 -5.952 1.00 0.00 C ATOM 0 H ALA A 134 10.191 -10.763 -5.610 1.00 0.00 H new ATOM 0 HA ALA A 134 12.729 -10.287 -4.348 1.00 0.00 H new ATOM 0 HB1 ALA A 134 13.557 -11.782 -6.121 1.00 0.00 H new ATOM 0 HB2 ALA A 134 12.136 -12.462 -5.293 1.00 0.00 H new ATOM 0 HB3 ALA A 134 11.960 -11.728 -6.905 1.00 0.00 H new ATOM 1967 N THR A 135 14.016 -8.894 -5.972 1.00 0.00 N ATOM 1968 CA THR A 135 14.867 -8.192 -6.901 1.00 0.00 C ATOM 1969 C THR A 135 16.003 -9.115 -7.342 1.00 0.00 C ATOM 1970 O THR A 135 16.449 -8.971 -8.476 1.00 0.00 O ATOM 1971 CB THR A 135 15.372 -6.895 -6.258 1.00 0.00 C ATOM 1972 OG1 THR A 135 15.906 -7.137 -4.970 1.00 0.00 O ATOM 1973 CG2 THR A 135 14.251 -5.860 -6.157 1.00 0.00 C ATOM 0 H THR A 135 14.495 -9.138 -5.105 1.00 0.00 H new ATOM 0 HA THR A 135 14.311 -7.910 -7.795 1.00 0.00 H new ATOM 0 HB THR A 135 16.161 -6.503 -6.899 1.00 0.00 H new ATOM 0 HG1 THR A 135 16.694 -6.571 -4.831 1.00 0.00 H new ATOM 0 HG21 THR A 135 14.636 -4.950 -5.697 1.00 0.00 H new ATOM 0 HG22 THR A 135 13.876 -5.632 -7.155 1.00 0.00 H new ATOM 0 HG23 THR A 135 13.441 -6.259 -5.547 1.00 0.00 H new ATOM 1981 N GLN A 136 16.444 -10.073 -6.510 1.00 0.00 N ATOM 1982 CA GLN A 136 17.387 -11.134 -6.851 1.00 0.00 C ATOM 1983 C GLN A 136 17.039 -12.417 -6.099 1.00 0.00 C ATOM 1984 O GLN A 136 16.070 -12.469 -5.345 1.00 0.00 O ATOM 1985 CB GLN A 136 18.852 -10.725 -6.549 1.00 0.00 C ATOM 1986 CG GLN A 136 19.376 -9.519 -7.350 1.00 0.00 C ATOM 1987 CD GLN A 136 19.255 -9.625 -8.880 1.00 0.00 C ATOM 1988 OE1 GLN A 136 19.057 -10.809 -9.446 1.00 0.00 O flip ATOM 1989 NE2 GLN A 136 19.331 -8.606 -9.564 1.00 0.00 N flip ATOM 0 H GLN A 136 16.135 -10.125 -5.539 1.00 0.00 H new ATOM 0 HA GLN A 136 17.304 -11.309 -7.924 1.00 0.00 H new ATOM 0 HB2 GLN A 136 18.937 -10.499 -5.486 1.00 0.00 H new ATOM 0 HB3 GLN A 136 19.499 -11.580 -6.746 1.00 0.00 H new ATOM 0 HG2 GLN A 136 18.838 -8.629 -7.023 1.00 0.00 H new ATOM 0 HG3 GLN A 136 20.426 -9.368 -7.097 1.00 0.00 H new ATOM 0 HE21 GLN A 136 19.483 -7.702 -9.117 1.00 0.00 H new ATOM 0 HE22 GLN A 136 19.242 -8.665 -10.578 1.00 0.00 H new ATOM 1998 N VAL A 137 17.873 -13.444 -6.275 1.00 0.00 N ATOM 1999 CA VAL A 137 17.708 -14.774 -5.710 1.00 0.00 C ATOM 2000 C VAL A 137 18.841 -15.049 -4.693 1.00 0.00 C ATOM 2001 O VAL A 137 19.484 -16.100 -4.768 1.00 0.00 O ATOM 2002 CB VAL A 137 17.685 -15.734 -6.931 1.00 0.00 C ATOM 2003 CG1 VAL A 137 17.535 -17.226 -6.595 1.00 0.00 C ATOM 2004 CG2 VAL A 137 16.621 -15.283 -7.941 1.00 0.00 C ATOM 0 H VAL A 137 18.717 -13.362 -6.841 1.00 0.00 H new ATOM 0 HA VAL A 137 16.789 -14.905 -5.138 1.00 0.00 H new ATOM 0 HB VAL A 137 18.678 -15.658 -7.374 1.00 0.00 H new ATOM 0 HG11 VAL A 137 17.530 -17.808 -7.517 1.00 0.00 H new ATOM 0 HG12 VAL A 137 18.369 -17.544 -5.970 1.00 0.00 H new ATOM 0 HG13 VAL A 137 16.599 -17.386 -6.060 1.00 0.00 H new ATOM 0 HG21 VAL A 137 16.615 -15.964 -8.792 1.00 0.00 H new ATOM 0 HG22 VAL A 137 15.641 -15.290 -7.464 1.00 0.00 H new ATOM 0 HG23 VAL A 137 16.850 -14.274 -8.285 1.00 0.00 H new ATOM 2014 N PRO A 138 19.096 -14.192 -3.676 1.00 0.00 N ATOM 2015 CA PRO A 138 20.125 -14.494 -2.699 1.00 0.00 C ATOM 2016 C PRO A 138 19.607 -15.470 -1.635 1.00 0.00 C ATOM 2017 O PRO A 138 20.409 -16.212 -1.062 1.00 0.00 O ATOM 2018 CB PRO A 138 20.558 -13.166 -2.095 1.00 0.00 C ATOM 2019 CG PRO A 138 19.252 -12.402 -2.094 1.00 0.00 C ATOM 2020 CD PRO A 138 18.535 -12.891 -3.356 1.00 0.00 C ATOM 0 HA PRO A 138 20.976 -14.990 -3.165 1.00 0.00 H new ATOM 0 HB2 PRO A 138 20.966 -13.284 -1.091 1.00 0.00 H new ATOM 0 HB3 PRO A 138 21.323 -12.672 -2.694 1.00 0.00 H new ATOM 0 HG2 PRO A 138 18.668 -12.611 -1.197 1.00 0.00 H new ATOM 0 HG3 PRO A 138 19.420 -11.325 -2.122 1.00 0.00 H new ATOM 0 HD2 PRO A 138 17.461 -12.964 -3.187 1.00 0.00 H new ATOM 0 HD3 PRO A 138 18.682 -12.193 -4.180 1.00 0.00 H new ATOM 2028 N VAL A 139 18.281 -15.481 -1.418 1.00 0.00 N ATOM 2029 CA VAL A 139 17.522 -16.258 -0.435 1.00 0.00 C ATOM 2030 C VAL A 139 18.132 -16.136 0.968 1.00 0.00 C ATOM 2031 O VAL A 139 18.464 -17.106 1.652 1.00 0.00 O ATOM 2032 CB VAL A 139 17.185 -17.674 -0.948 1.00 0.00 C ATOM 2033 CG1 VAL A 139 16.388 -17.581 -2.263 1.00 0.00 C ATOM 2034 CG2 VAL A 139 18.411 -18.553 -1.199 1.00 0.00 C ATOM 0 H VAL A 139 17.663 -14.893 -1.977 1.00 0.00 H new ATOM 0 HA VAL A 139 16.532 -15.821 -0.308 1.00 0.00 H new ATOM 0 HB VAL A 139 16.603 -18.141 -0.154 1.00 0.00 H new ATOM 0 HG11 VAL A 139 16.154 -18.585 -2.618 1.00 0.00 H new ATOM 0 HG12 VAL A 139 15.462 -17.033 -2.089 1.00 0.00 H new ATOM 0 HG13 VAL A 139 16.983 -17.060 -3.013 1.00 0.00 H new ATOM 0 HG21 VAL A 139 18.090 -19.531 -1.557 1.00 0.00 H new ATOM 0 HG22 VAL A 139 19.048 -18.083 -1.948 1.00 0.00 H new ATOM 0 HG23 VAL A 139 18.970 -18.672 -0.271 1.00 0.00 H new ATOM 2044 N THR A 140 18.246 -14.884 1.393 1.00 0.00 N ATOM 2045 CA THR A 140 18.786 -14.430 2.650 1.00 0.00 C ATOM 2046 C THR A 140 17.617 -14.211 3.613 1.00 0.00 C ATOM 2047 O THR A 140 16.724 -13.408 3.331 1.00 0.00 O ATOM 2048 CB THR A 140 19.572 -13.149 2.347 1.00 0.00 C ATOM 2049 OG1 THR A 140 20.810 -13.429 1.713 1.00 0.00 O ATOM 2050 CG2 THR A 140 19.811 -12.274 3.577 1.00 0.00 C ATOM 0 H THR A 140 17.935 -14.104 0.814 1.00 0.00 H new ATOM 0 HA THR A 140 19.459 -15.144 3.124 1.00 0.00 H new ATOM 0 HB THR A 140 18.938 -12.583 1.664 1.00 0.00 H new ATOM 0 HG1 THR A 140 21.283 -12.590 1.533 1.00 0.00 H new ATOM 0 HG21 THR A 140 20.373 -11.386 3.288 1.00 0.00 H new ATOM 0 HG22 THR A 140 18.853 -11.975 4.003 1.00 0.00 H new ATOM 0 HG23 THR A 140 20.378 -12.836 4.319 1.00 0.00 H new ATOM 2058 N ALA A 141 17.642 -14.929 4.736 1.00 0.00 N ATOM 2059 CA ALA A 141 16.774 -14.687 5.885 1.00 0.00 C ATOM 2060 C ALA A 141 16.936 -13.255 6.432 1.00 0.00 C ATOM 2061 O ALA A 141 17.988 -12.630 6.273 1.00 0.00 O ATOM 2062 CB ALA A 141 17.114 -15.690 6.985 1.00 0.00 C ATOM 0 H ALA A 141 18.281 -15.712 4.874 1.00 0.00 H new ATOM 0 HA ALA A 141 15.740 -14.806 5.562 1.00 0.00 H new ATOM 0 HB1 ALA A 141 16.470 -15.516 7.847 1.00 0.00 H new ATOM 0 HB2 ALA A 141 16.959 -16.703 6.614 1.00 0.00 H new ATOM 0 HB3 ALA A 141 18.156 -15.567 7.280 1.00 0.00 H new ATOM 2068 N GLY A 142 15.930 -12.753 7.151 1.00 0.00 N ATOM 2069 CA GLY A 142 15.937 -11.425 7.754 1.00 0.00 C ATOM 2070 C GLY A 142 14.539 -10.981 8.158 1.00 0.00 C ATOM 2071 O GLY A 142 13.555 -11.623 7.829 1.00 0.00 O ATOM 0 H GLY A 142 15.071 -13.272 7.332 1.00 0.00 H new ATOM 0 HA2 GLY A 142 16.585 -11.427 8.630 1.00 0.00 H new ATOM 0 HA3 GLY A 142 16.357 -10.708 7.049 1.00 0.00 H new ATOM 2075 N HIS A 143 14.412 -9.852 8.841 1.00 0.00 N ATOM 2076 CA HIS A 143 13.138 -9.164 9.059 1.00 0.00 C ATOM 2077 C HIS A 143 12.803 -8.305 7.842 1.00 0.00 C ATOM 2078 O HIS A 143 13.699 -7.827 7.146 1.00 0.00 O ATOM 2079 CB HIS A 143 13.115 -8.343 10.366 1.00 0.00 C ATOM 2080 CG HIS A 143 14.455 -7.931 10.922 1.00 0.00 C ATOM 2081 ND1 HIS A 143 15.236 -6.870 10.499 1.00 0.00 N ATOM 2082 CD2 HIS A 143 15.069 -8.504 12.000 1.00 0.00 C ATOM 2083 CE1 HIS A 143 16.289 -6.783 11.326 1.00 0.00 C ATOM 2084 NE2 HIS A 143 16.222 -7.779 12.230 1.00 0.00 N ATOM 0 H HIS A 143 15.205 -9.375 9.270 1.00 0.00 H new ATOM 0 HA HIS A 143 12.365 -9.923 9.180 1.00 0.00 H new ATOM 0 HB2 HIS A 143 12.525 -7.443 10.194 1.00 0.00 H new ATOM 0 HB3 HIS A 143 12.594 -8.925 11.126 1.00 0.00 H new ATOM 0 HD1 HIS A 143 15.045 -6.263 9.702 1.00 0.00 H new ATOM 0 HD2 HIS A 143 14.721 -9.358 12.563 1.00 0.00 H new ATOM 0 HE1 HIS A 143 17.066 -6.034 11.275 1.00 0.00 H new ATOM 2093 N ILE A 144 11.513 -8.058 7.630 1.00 0.00 N ATOM 2094 CA ILE A 144 10.990 -7.034 6.738 1.00 0.00 C ATOM 2095 C ILE A 144 10.851 -5.811 7.622 1.00 0.00 C ATOM 2096 O ILE A 144 10.207 -5.887 8.670 1.00 0.00 O ATOM 2097 CB ILE A 144 9.621 -7.458 6.152 1.00 0.00 C ATOM 2098 CG1 ILE A 144 9.698 -8.561 5.081 1.00 0.00 C ATOM 2099 CG2 ILE A 144 8.892 -6.280 5.480 1.00 0.00 C ATOM 2100 CD1 ILE A 144 10.527 -9.793 5.421 1.00 0.00 C ATOM 0 H ILE A 144 10.776 -8.589 8.095 1.00 0.00 H new ATOM 0 HA ILE A 144 11.637 -6.855 5.879 1.00 0.00 H new ATOM 0 HB ILE A 144 9.087 -7.832 7.026 1.00 0.00 H new ATOM 0 HG12 ILE A 144 8.683 -8.887 4.855 1.00 0.00 H new ATOM 0 HG13 ILE A 144 10.102 -8.121 4.169 1.00 0.00 H new ATOM 0 HG21 ILE A 144 7.936 -6.622 5.083 1.00 0.00 H new ATOM 0 HG22 ILE A 144 8.719 -5.493 6.214 1.00 0.00 H new ATOM 0 HG23 ILE A 144 9.504 -5.890 4.667 1.00 0.00 H new ATOM 0 HD11 ILE A 144 10.500 -10.492 4.585 1.00 0.00 H new ATOM 0 HD12 ILE A 144 11.558 -9.496 5.612 1.00 0.00 H new ATOM 0 HD13 ILE A 144 10.117 -10.274 6.309 1.00 0.00 H new ATOM 2112 N ASN A 145 11.489 -4.727 7.199 1.00 0.00 N ATOM 2113 CA ASN A 145 11.448 -3.421 7.822 1.00 0.00 C ATOM 2114 C ASN A 145 11.829 -2.441 6.722 1.00 0.00 C ATOM 2115 O ASN A 145 12.808 -2.680 6.015 1.00 0.00 O ATOM 2116 CB ASN A 145 12.505 -3.328 8.918 1.00 0.00 C ATOM 2117 CG ASN A 145 12.104 -3.896 10.268 1.00 0.00 C ATOM 2118 OD1 ASN A 145 10.948 -3.878 10.682 1.00 0.00 O ATOM 2119 ND2 ASN A 145 13.075 -4.395 11.009 1.00 0.00 N ATOM 0 H ASN A 145 12.079 -4.742 6.367 1.00 0.00 H new ATOM 0 HA ASN A 145 10.470 -3.222 8.260 1.00 0.00 H new ATOM 0 HB2 ASN A 145 13.401 -3.846 8.578 1.00 0.00 H new ATOM 0 HB3 ASN A 145 12.774 -2.280 9.050 1.00 0.00 H new ATOM 0 HD21 ASN A 145 12.869 -4.770 11.935 1.00 0.00 H new ATOM 0 HD22 ASN A 145 14.032 -4.405 10.656 1.00 0.00 H new ATOM 2126 N ALA A 146 11.066 -1.370 6.561 1.00 0.00 N ATOM 2127 CA ALA A 146 11.224 -0.302 5.590 1.00 0.00 C ATOM 2128 C ALA A 146 10.489 0.921 6.142 1.00 0.00 C ATOM 2129 O ALA A 146 10.185 0.994 7.334 1.00 0.00 O ATOM 2130 CB ALA A 146 10.669 -0.764 4.235 1.00 0.00 C ATOM 0 H ALA A 146 10.253 -1.215 7.157 1.00 0.00 H new ATOM 0 HA ALA A 146 12.270 -0.041 5.428 1.00 0.00 H new ATOM 0 HB1 ALA A 146 10.785 0.035 3.503 1.00 0.00 H new ATOM 0 HB2 ALA A 146 11.215 -1.646 3.900 1.00 0.00 H new ATOM 0 HB3 ALA A 146 9.612 -1.009 4.339 1.00 0.00 H new ATOM 2136 N THR A 147 10.220 1.899 5.293 1.00 0.00 N ATOM 2137 CA THR A 147 9.576 3.139 5.648 1.00 0.00 C ATOM 2138 C THR A 147 9.181 3.828 4.339 1.00 0.00 C ATOM 2139 O THR A 147 9.908 3.748 3.347 1.00 0.00 O ATOM 2140 CB THR A 147 10.534 3.968 6.540 1.00 0.00 C ATOM 2141 OG1 THR A 147 9.977 5.214 6.903 1.00 0.00 O ATOM 2142 CG2 THR A 147 11.927 4.195 5.937 1.00 0.00 C ATOM 0 H THR A 147 10.456 1.842 4.302 1.00 0.00 H new ATOM 0 HA THR A 147 8.670 2.999 6.238 1.00 0.00 H new ATOM 0 HB THR A 147 10.665 3.350 7.428 1.00 0.00 H new ATOM 0 HG1 THR A 147 10.612 5.704 7.466 1.00 0.00 H new ATOM 0 HG21 THR A 147 12.531 4.784 6.628 1.00 0.00 H new ATOM 0 HG22 THR A 147 12.409 3.233 5.763 1.00 0.00 H new ATOM 0 HG23 THR A 147 11.832 4.730 4.992 1.00 0.00 H new ATOM 2150 N ALA A 148 8.029 4.490 4.341 1.00 0.00 N ATOM 2151 CA ALA A 148 7.605 5.402 3.295 1.00 0.00 C ATOM 2152 C ALA A 148 6.522 6.321 3.857 1.00 0.00 C ATOM 2153 O ALA A 148 6.053 6.142 4.984 1.00 0.00 O ATOM 2154 CB ALA A 148 7.046 4.641 2.084 1.00 0.00 C ATOM 0 H ALA A 148 7.347 4.401 5.095 1.00 0.00 H new ATOM 0 HA ALA A 148 8.468 5.979 2.963 1.00 0.00 H new ATOM 0 HB1 ALA A 148 6.737 5.352 1.318 1.00 0.00 H new ATOM 0 HB2 ALA A 148 7.816 3.984 1.680 1.00 0.00 H new ATOM 0 HB3 ALA A 148 6.187 4.045 2.393 1.00 0.00 H new ATOM 2160 N THR A 149 6.085 7.266 3.033 1.00 0.00 N ATOM 2161 CA THR A 149 5.021 8.197 3.324 1.00 0.00 C ATOM 2162 C THR A 149 4.110 8.242 2.098 1.00 0.00 C ATOM 2163 O THR A 149 4.546 8.600 1.000 1.00 0.00 O ATOM 2164 CB THR A 149 5.620 9.565 3.716 1.00 0.00 C ATOM 2165 OG1 THR A 149 6.615 9.994 2.806 1.00 0.00 O ATOM 2166 CG2 THR A 149 6.267 9.480 5.099 1.00 0.00 C ATOM 0 H THR A 149 6.486 7.404 2.105 1.00 0.00 H new ATOM 0 HA THR A 149 4.418 7.889 4.178 1.00 0.00 H new ATOM 0 HB THR A 149 4.796 10.278 3.708 1.00 0.00 H new ATOM 0 HG1 THR A 149 6.355 9.743 1.895 1.00 0.00 H new ATOM 0 HG21 THR A 149 6.686 10.450 5.365 1.00 0.00 H new ATOM 0 HG22 THR A 149 5.516 9.195 5.835 1.00 0.00 H new ATOM 0 HG23 THR A 149 7.061 8.734 5.084 1.00 0.00 H new ATOM 2174 N PHE A 150 2.849 7.854 2.260 1.00 0.00 N ATOM 2175 CA PHE A 150 1.803 8.090 1.280 1.00 0.00 C ATOM 2176 C PHE A 150 1.252 9.484 1.567 1.00 0.00 C ATOM 2177 O PHE A 150 0.652 9.721 2.619 1.00 0.00 O ATOM 2178 CB PHE A 150 0.735 6.988 1.346 1.00 0.00 C ATOM 2179 CG PHE A 150 0.312 6.597 2.748 1.00 0.00 C ATOM 2180 CD1 PHE A 150 1.088 5.674 3.473 1.00 0.00 C ATOM 2181 CD2 PHE A 150 -0.810 7.197 3.350 1.00 0.00 C ATOM 2182 CE1 PHE A 150 0.761 5.383 4.803 1.00 0.00 C ATOM 2183 CE2 PHE A 150 -1.164 6.863 4.668 1.00 0.00 C ATOM 2184 CZ PHE A 150 -0.369 5.962 5.393 1.00 0.00 C ATOM 0 H PHE A 150 2.523 7.359 3.090 1.00 0.00 H new ATOM 0 HA PHE A 150 2.182 8.052 0.259 1.00 0.00 H new ATOM 0 HB2 PHE A 150 -0.145 7.321 0.795 1.00 0.00 H new ATOM 0 HB3 PHE A 150 1.114 6.103 0.836 1.00 0.00 H new ATOM 0 HD1 PHE A 150 1.933 5.191 3.005 1.00 0.00 H new ATOM 0 HD2 PHE A 150 -1.399 7.915 2.798 1.00 0.00 H new ATOM 0 HE1 PHE A 150 1.382 4.710 5.375 1.00 0.00 H new ATOM 0 HE2 PHE A 150 -2.043 7.297 5.121 1.00 0.00 H new ATOM 0 HZ PHE A 150 -0.630 5.714 6.411 1.00 0.00 H new ATOM 2194 N THR A 151 1.515 10.442 0.687 1.00 0.00 N ATOM 2195 CA THR A 151 1.091 11.818 0.854 1.00 0.00 C ATOM 2196 C THR A 151 0.192 12.131 -0.333 1.00 0.00 C ATOM 2197 O THR A 151 0.596 12.070 -1.492 1.00 0.00 O ATOM 2198 CB THR A 151 2.317 12.728 1.038 1.00 0.00 C ATOM 2199 OG1 THR A 151 3.212 12.632 -0.047 1.00 0.00 O ATOM 2200 CG2 THR A 151 3.065 12.409 2.340 1.00 0.00 C ATOM 0 H THR A 151 2.037 10.278 -0.174 1.00 0.00 H new ATOM 0 HA THR A 151 0.509 11.995 1.759 1.00 0.00 H new ATOM 0 HB THR A 151 1.935 13.748 1.086 1.00 0.00 H new ATOM 0 HG1 THR A 151 2.718 12.393 -0.859 1.00 0.00 H new ATOM 0 HG21 THR A 151 3.925 13.071 2.437 1.00 0.00 H new ATOM 0 HG22 THR A 151 2.397 12.555 3.189 1.00 0.00 H new ATOM 0 HG23 THR A 151 3.405 11.373 2.320 1.00 0.00 H new ATOM 2208 N LEU A 152 -1.074 12.409 -0.050 1.00 0.00 N ATOM 2209 CA LEU A 152 -2.029 12.876 -1.032 1.00 0.00 C ATOM 2210 C LEU A 152 -1.751 14.362 -1.208 1.00 0.00 C ATOM 2211 O LEU A 152 -1.794 15.108 -0.228 1.00 0.00 O ATOM 2212 CB LEU A 152 -3.462 12.646 -0.518 1.00 0.00 C ATOM 2213 CG LEU A 152 -3.960 11.189 -0.407 1.00 0.00 C ATOM 2214 CD1 LEU A 152 -3.529 10.335 -1.596 1.00 0.00 C ATOM 2215 CD2 LEU A 152 -3.504 10.485 0.876 1.00 0.00 C ATOM 0 H LEU A 152 -1.467 12.313 0.886 1.00 0.00 H new ATOM 0 HA LEU A 152 -1.936 12.344 -1.979 1.00 0.00 H new ATOM 0 HB2 LEU A 152 -3.542 13.104 0.468 1.00 0.00 H new ATOM 0 HB3 LEU A 152 -4.144 13.184 -1.176 1.00 0.00 H new ATOM 0 HG LEU A 152 -5.046 11.279 -0.390 1.00 0.00 H new ATOM 0 HD11 LEU A 152 -3.904 9.319 -1.470 1.00 0.00 H new ATOM 0 HD12 LEU A 152 -3.934 10.760 -2.515 1.00 0.00 H new ATOM 0 HD13 LEU A 152 -2.441 10.315 -1.654 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -3.890 9.466 0.888 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -2.415 10.462 0.911 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -3.883 11.027 1.743 1.00 0.00 H new ATOM 2227 N GLU A 153 -1.415 14.804 -2.416 1.00 0.00 N ATOM 2228 CA GLU A 153 -1.615 16.199 -2.775 1.00 0.00 C ATOM 2229 C GLU A 153 -3.006 16.250 -3.399 1.00 0.00 C ATOM 2230 O GLU A 153 -3.404 15.341 -4.129 1.00 0.00 O ATOM 2231 CB GLU A 153 -0.498 16.692 -3.705 1.00 0.00 C ATOM 2232 CG GLU A 153 -0.571 18.198 -3.994 1.00 0.00 C ATOM 2233 CD GLU A 153 -0.210 19.104 -2.807 1.00 0.00 C ATOM 2234 OE1 GLU A 153 -0.781 18.954 -1.699 1.00 0.00 O ATOM 2235 OE2 GLU A 153 0.658 19.991 -2.974 1.00 0.00 O ATOM 0 H GLU A 153 -1.009 14.225 -3.151 1.00 0.00 H new ATOM 0 HA GLU A 153 -1.563 16.872 -1.919 1.00 0.00 H new ATOM 0 HB2 GLU A 153 0.468 16.461 -3.256 1.00 0.00 H new ATOM 0 HB3 GLU A 153 -0.550 16.145 -4.646 1.00 0.00 H new ATOM 0 HG2 GLU A 153 0.098 18.427 -4.823 1.00 0.00 H new ATOM 0 HG3 GLU A 153 -1.581 18.441 -4.324 1.00 0.00 H new ATOM 2242 N TYR A 154 -3.792 17.258 -3.048 1.00 0.00 N ATOM 2243 CA TYR A 154 -5.206 17.310 -3.390 1.00 0.00 C ATOM 2244 C TYR A 154 -5.368 18.191 -4.630 1.00 0.00 C ATOM 2245 O TYR A 154 -4.372 18.639 -5.212 1.00 0.00 O ATOM 2246 CB TYR A 154 -6.005 17.736 -2.146 1.00 0.00 C ATOM 2247 CG TYR A 154 -5.965 16.704 -1.020 1.00 0.00 C ATOM 2248 CD1 TYR A 154 -4.808 16.534 -0.235 1.00 0.00 C ATOM 2249 CD2 TYR A 154 -7.057 15.844 -0.810 1.00 0.00 C ATOM 2250 CE1 TYR A 154 -4.753 15.555 0.772 1.00 0.00 C ATOM 2251 CE2 TYR A 154 -7.000 14.829 0.162 1.00 0.00 C ATOM 2252 CZ TYR A 154 -5.852 14.691 0.974 1.00 0.00 C ATOM 2253 OH TYR A 154 -5.780 13.694 1.899 1.00 0.00 O ATOM 0 H TYR A 154 -3.466 18.065 -2.516 1.00 0.00 H new ATOM 0 HA TYR A 154 -5.617 16.339 -3.667 1.00 0.00 H new ATOM 0 HB2 TYR A 154 -5.611 18.683 -1.776 1.00 0.00 H new ATOM 0 HB3 TYR A 154 -7.042 17.912 -2.431 1.00 0.00 H new ATOM 0 HD1 TYR A 154 -3.950 17.166 -0.410 1.00 0.00 H new ATOM 0 HD2 TYR A 154 -7.952 15.964 -1.403 1.00 0.00 H new ATOM 0 HE1 TYR A 154 -3.872 15.464 1.390 1.00 0.00 H new ATOM 0 HE2 TYR A 154 -7.834 14.155 0.288 1.00 0.00 H new ATOM 0 HH TYR A 154 -6.624 13.195 1.909 1.00 0.00 H new ATOM 2263 N GLN A 155 -6.592 18.399 -5.117 1.00 0.00 N ATOM 2264 CA GLN A 155 -6.804 19.380 -6.178 1.00 0.00 C ATOM 2265 C GLN A 155 -6.730 20.790 -5.580 1.00 0.00 C ATOM 2266 O GLN A 155 -7.709 21.255 -4.997 1.00 0.00 O ATOM 2267 CB GLN A 155 -8.098 19.085 -6.958 1.00 0.00 C ATOM 2268 CG GLN A 155 -8.104 19.734 -8.352 1.00 0.00 C ATOM 2269 CD GLN A 155 -7.116 19.114 -9.350 1.00 0.00 C ATOM 2270 OE1 GLN A 155 -6.260 18.290 -9.014 1.00 0.00 O ATOM 2271 NE2 GLN A 155 -7.198 19.499 -10.611 1.00 0.00 N ATOM 0 H GLN A 155 -7.432 17.914 -4.802 1.00 0.00 H new ATOM 0 HA GLN A 155 -6.012 19.311 -6.924 1.00 0.00 H new ATOM 0 HB2 GLN A 155 -8.218 18.007 -7.062 1.00 0.00 H new ATOM 0 HB3 GLN A 155 -8.953 19.448 -6.388 1.00 0.00 H new ATOM 0 HG2 GLN A 155 -9.110 19.665 -8.766 1.00 0.00 H new ATOM 0 HG3 GLN A 155 -7.875 20.794 -8.246 1.00 0.00 H new ATOM 0 HE21 GLN A 155 -7.904 20.180 -10.892 1.00 0.00 H new ATOM 0 HE22 GLN A 155 -6.555 19.116 -11.304 1.00 0.00 H new ATOM 2463 N ASP A 167 2.416 13.343 7.581 1.00 0.00 N ATOM 2464 CA ASP A 167 3.541 12.439 7.725 1.00 0.00 C ATOM 2465 C ASP A 167 3.116 10.975 7.920 1.00 0.00 C ATOM 2466 O ASP A 167 3.949 10.194 8.376 1.00 0.00 O ATOM 2467 CB ASP A 167 4.569 12.908 8.786 1.00 0.00 C ATOM 2468 CG ASP A 167 5.254 14.260 8.569 1.00 0.00 C ATOM 2469 OD1 ASP A 167 4.679 15.201 7.976 1.00 0.00 O ATOM 2470 OD2 ASP A 167 6.377 14.457 9.081 1.00 0.00 O ATOM 0 HA ASP A 167 4.063 12.475 6.769 1.00 0.00 H new ATOM 0 HB2 ASP A 167 4.063 12.940 9.751 1.00 0.00 H new ATOM 0 HB3 ASP A 167 5.346 12.147 8.859 1.00 0.00 H new ATOM 2475 N SER A 168 1.878 10.598 7.537 1.00 0.00 N ATOM 2476 CA SER A 168 1.306 9.241 7.564 1.00 0.00 C ATOM 2477 C SER A 168 2.346 8.177 7.156 1.00 0.00 C ATOM 2478 O SER A 168 2.577 7.952 5.961 1.00 0.00 O ATOM 2479 CB SER A 168 0.090 9.166 6.632 1.00 0.00 C ATOM 2480 OG SER A 168 -0.774 10.270 6.810 1.00 0.00 O ATOM 0 H SER A 168 1.210 11.280 7.178 1.00 0.00 H new ATOM 0 HA SER A 168 0.996 9.031 8.588 1.00 0.00 H new ATOM 0 HB2 SER A 168 0.427 9.131 5.596 1.00 0.00 H new ATOM 0 HB3 SER A 168 -0.457 8.242 6.821 1.00 0.00 H new ATOM 0 HG SER A 168 -0.851 10.764 5.967 1.00 0.00 H new ATOM 2486 N THR A 169 3.011 7.579 8.140 1.00 0.00 N ATOM 2487 CA THR A 169 4.103 6.638 7.929 1.00 0.00 C ATOM 2488 C THR A 169 3.544 5.294 7.442 1.00 0.00 C ATOM 2489 O THR A 169 2.375 4.979 7.689 1.00 0.00 O ATOM 2490 CB THR A 169 4.921 6.566 9.246 1.00 0.00 C ATOM 2491 OG1 THR A 169 6.276 6.886 9.004 1.00 0.00 O ATOM 2492 CG2 THR A 169 4.891 5.249 10.025 1.00 0.00 C ATOM 0 H THR A 169 2.801 7.739 9.125 1.00 0.00 H new ATOM 0 HA THR A 169 4.786 6.959 7.142 1.00 0.00 H new ATOM 0 HB THR A 169 4.411 7.293 9.878 1.00 0.00 H new ATOM 0 HG1 THR A 169 6.779 6.838 9.844 1.00 0.00 H new ATOM 0 HG21 THR A 169 5.505 5.342 10.921 1.00 0.00 H new ATOM 0 HG22 THR A 169 3.865 5.019 10.311 1.00 0.00 H new ATOM 0 HG23 THR A 169 5.282 4.447 9.399 1.00 0.00 H new ATOM 2500 N ILE A 170 4.390 4.482 6.800 1.00 0.00 N ATOM 2501 CA ILE A 170 4.106 3.106 6.411 1.00 0.00 C ATOM 2502 C ILE A 170 5.195 2.240 7.052 1.00 0.00 C ATOM 2503 O ILE A 170 6.382 2.424 6.763 1.00 0.00 O ATOM 2504 CB ILE A 170 3.971 3.001 4.854 1.00 0.00 C ATOM 2505 CG1 ILE A 170 2.629 2.366 4.422 1.00 0.00 C ATOM 2506 CG2 ILE A 170 5.138 2.314 4.112 1.00 0.00 C ATOM 2507 CD1 ILE A 170 2.625 0.840 4.311 1.00 0.00 C ATOM 0 H ILE A 170 5.327 4.781 6.529 1.00 0.00 H new ATOM 0 HA ILE A 170 3.145 2.741 6.773 1.00 0.00 H new ATOM 0 HB ILE A 170 4.005 4.045 4.544 1.00 0.00 H new ATOM 0 HG12 ILE A 170 1.861 2.662 5.136 1.00 0.00 H new ATOM 0 HG13 ILE A 170 2.344 2.783 3.456 1.00 0.00 H new ATOM 0 HG21 ILE A 170 4.931 2.301 3.042 1.00 0.00 H new ATOM 0 HG22 ILE A 170 6.061 2.864 4.297 1.00 0.00 H new ATOM 0 HG23 ILE A 170 5.247 1.291 4.473 1.00 0.00 H new ATOM 0 HD11 ILE A 170 1.636 0.500 4.002 1.00 0.00 H new ATOM 0 HD12 ILE A 170 3.363 0.527 3.573 1.00 0.00 H new ATOM 0 HD13 ILE A 170 2.872 0.404 5.279 1.00 0.00 H new ATOM 2519 N THR A 171 4.804 1.316 7.930 1.00 0.00 N ATOM 2520 CA THR A 171 5.688 0.299 8.486 1.00 0.00 C ATOM 2521 C THR A 171 5.065 -1.038 8.117 1.00 0.00 C ATOM 2522 O THR A 171 4.082 -1.474 8.725 1.00 0.00 O ATOM 2523 CB THR A 171 5.849 0.432 10.010 1.00 0.00 C ATOM 2524 OG1 THR A 171 6.149 1.769 10.353 1.00 0.00 O ATOM 2525 CG2 THR A 171 6.940 -0.499 10.556 1.00 0.00 C ATOM 0 H THR A 171 3.847 1.255 8.279 1.00 0.00 H new ATOM 0 HA THR A 171 6.695 0.404 8.081 1.00 0.00 H new ATOM 0 HB THR A 171 4.902 0.139 10.464 1.00 0.00 H new ATOM 0 HG1 THR A 171 6.248 1.843 11.325 1.00 0.00 H new ATOM 0 HG21 THR A 171 7.020 -0.372 11.636 1.00 0.00 H new ATOM 0 HG22 THR A 171 6.682 -1.534 10.330 1.00 0.00 H new ATOM 0 HG23 THR A 171 7.894 -0.253 10.090 1.00 0.00 H new ATOM 2533 N ILE A 172 5.594 -1.671 7.077 1.00 0.00 N ATOM 2534 CA ILE A 172 5.298 -3.059 6.789 1.00 0.00 C ATOM 2535 C ILE A 172 6.163 -3.916 7.723 1.00 0.00 C ATOM 2536 O ILE A 172 7.388 -3.814 7.695 1.00 0.00 O ATOM 2537 CB ILE A 172 5.528 -3.336 5.286 1.00 0.00 C ATOM 2538 CG1 ILE A 172 4.791 -2.338 4.347 1.00 0.00 C ATOM 2539 CG2 ILE A 172 5.108 -4.790 5.004 1.00 0.00 C ATOM 2540 CD1 ILE A 172 5.185 -2.608 2.908 1.00 0.00 C ATOM 0 H ILE A 172 6.236 -1.235 6.416 1.00 0.00 H new ATOM 0 HA ILE A 172 4.254 -3.310 6.977 1.00 0.00 H new ATOM 0 HB ILE A 172 6.586 -3.190 5.067 1.00 0.00 H new ATOM 0 HG12 ILE A 172 3.712 -2.441 4.465 1.00 0.00 H new ATOM 0 HG13 ILE A 172 5.045 -1.313 4.618 1.00 0.00 H new ATOM 0 HG21 ILE A 172 5.260 -5.014 3.948 1.00 0.00 H new ATOM 0 HG22 ILE A 172 5.711 -5.467 5.609 1.00 0.00 H new ATOM 0 HG23 ILE A 172 4.055 -4.920 5.255 1.00 0.00 H new ATOM 0 HD11 ILE A 172 4.668 -1.908 2.252 1.00 0.00 H new ATOM 0 HD12 ILE A 172 6.262 -2.482 2.796 1.00 0.00 H new ATOM 0 HD13 ILE A 172 4.909 -3.628 2.640 1.00 0.00 H new ATOM 2552 N ARG A 173 5.542 -4.714 8.593 1.00 0.00 N ATOM 2553 CA ARG A 173 6.246 -5.669 9.456 1.00 0.00 C ATOM 2554 C ARG A 173 6.326 -7.003 8.711 1.00 0.00 C ATOM 2555 O ARG A 173 5.561 -7.206 7.776 1.00 0.00 O ATOM 2556 CB ARG A 173 5.475 -5.833 10.781 1.00 0.00 C ATOM 2557 CG ARG A 173 5.177 -4.513 11.518 1.00 0.00 C ATOM 2558 CD ARG A 173 6.354 -3.869 12.271 1.00 0.00 C ATOM 2559 NE ARG A 173 6.791 -4.663 13.431 1.00 0.00 N ATOM 2560 CZ ARG A 173 6.170 -4.803 14.611 1.00 0.00 C ATOM 2561 NH1 ARG A 173 5.071 -4.116 14.920 1.00 0.00 N ATOM 2562 NH2 ARG A 173 6.655 -5.669 15.487 1.00 0.00 N ATOM 0 H ARG A 173 4.530 -4.717 8.721 1.00 0.00 H new ATOM 0 HA ARG A 173 7.250 -5.315 9.689 1.00 0.00 H new ATOM 0 HB2 ARG A 173 4.532 -6.341 10.577 1.00 0.00 H new ATOM 0 HB3 ARG A 173 6.050 -6.481 11.443 1.00 0.00 H new ATOM 0 HG2 ARG A 173 4.802 -3.793 10.791 1.00 0.00 H new ATOM 0 HG3 ARG A 173 4.373 -4.694 12.231 1.00 0.00 H new ATOM 0 HD2 ARG A 173 7.192 -3.743 11.586 1.00 0.00 H new ATOM 0 HD3 ARG A 173 6.064 -2.873 12.606 1.00 0.00 H new ATOM 0 HE ARG A 173 7.671 -5.167 13.324 1.00 0.00 H new ATOM 0 HH11 ARG A 173 4.675 -3.458 14.249 1.00 0.00 H new ATOM 0 HH12 ARG A 173 4.625 -4.248 15.828 1.00 0.00 H new ATOM 0 HH21 ARG A 173 7.486 -6.214 15.258 1.00 0.00 H new ATOM 0 HH22 ARG A 173 6.198 -5.791 16.391 1.00 0.00 H new ATOM 2576 N GLY A 174 7.195 -7.923 9.115 1.00 0.00 N ATOM 2577 CA GLY A 174 7.264 -9.284 8.592 1.00 0.00 C ATOM 2578 C GLY A 174 8.634 -9.894 8.870 1.00 0.00 C ATOM 2579 O GLY A 174 9.526 -9.205 9.381 1.00 0.00 O ATOM 0 H GLY A 174 7.892 -7.738 9.837 1.00 0.00 H new ATOM 0 HA2 GLY A 174 6.487 -9.896 9.050 1.00 0.00 H new ATOM 0 HA3 GLY A 174 7.073 -9.278 7.519 1.00 0.00 H new ATOM 2583 N TYR A 175 8.842 -11.162 8.507 1.00 0.00 N ATOM 2584 CA TYR A 175 10.118 -11.847 8.708 1.00 0.00 C ATOM 2585 C TYR A 175 10.281 -12.954 7.665 1.00 0.00 C ATOM 2586 O TYR A 175 9.421 -13.838 7.563 1.00 0.00 O ATOM 2587 CB TYR A 175 10.192 -12.388 10.148 1.00 0.00 C ATOM 2588 CG TYR A 175 11.514 -13.039 10.488 1.00 0.00 C ATOM 2589 CD1 TYR A 175 12.582 -12.260 10.963 1.00 0.00 C ATOM 2590 CD2 TYR A 175 11.680 -14.426 10.332 1.00 0.00 C ATOM 2591 CE1 TYR A 175 13.837 -12.836 11.215 1.00 0.00 C ATOM 2592 CE2 TYR A 175 12.918 -15.022 10.618 1.00 0.00 C ATOM 2593 CZ TYR A 175 14.013 -14.220 11.013 1.00 0.00 C ATOM 2594 OH TYR A 175 15.215 -14.808 11.252 1.00 0.00 O ATOM 0 H TYR A 175 8.129 -11.742 8.065 1.00 0.00 H new ATOM 0 HA TYR A 175 10.945 -11.149 8.575 1.00 0.00 H new ATOM 0 HB2 TYR A 175 10.012 -11.569 10.844 1.00 0.00 H new ATOM 0 HB3 TYR A 175 9.392 -13.113 10.295 1.00 0.00 H new ATOM 0 HD1 TYR A 175 12.436 -11.204 11.137 1.00 0.00 H new ATOM 0 HD2 TYR A 175 10.854 -15.033 9.992 1.00 0.00 H new ATOM 0 HE1 TYR A 175 14.659 -12.226 11.560 1.00 0.00 H new ATOM 0 HE2 TYR A 175 13.034 -16.093 10.536 1.00 0.00 H new ATOM 0 HH TYR A 175 15.154 -15.767 11.060 1.00 0.00 H new ATOM 2604 N VAL A 176 11.366 -12.915 6.882 1.00 0.00 N ATOM 2605 CA VAL A 176 11.688 -14.024 5.989 1.00 0.00 C ATOM 2606 C VAL A 176 12.436 -15.102 6.789 1.00 0.00 C ATOM 2607 O VAL A 176 13.511 -14.878 7.349 1.00 0.00 O ATOM 2608 CB VAL A 176 12.395 -13.607 4.673 1.00 0.00 C ATOM 2609 CG1 VAL A 176 11.599 -12.721 3.694 1.00 0.00 C ATOM 2610 CG2 VAL A 176 13.657 -12.861 4.869 1.00 0.00 C ATOM 0 H VAL A 176 12.025 -12.137 6.851 1.00 0.00 H new ATOM 0 HA VAL A 176 10.753 -14.447 5.622 1.00 0.00 H new ATOM 0 HB VAL A 176 12.541 -14.600 4.249 1.00 0.00 H new ATOM 0 HG11 VAL A 176 12.211 -12.505 2.818 1.00 0.00 H new ATOM 0 HG12 VAL A 176 10.694 -13.243 3.384 1.00 0.00 H new ATOM 0 HG13 VAL A 176 11.328 -11.787 4.186 1.00 0.00 H new ATOM 0 HG21 VAL A 176 14.085 -12.609 3.899 1.00 0.00 H new ATOM 0 HG22 VAL A 176 13.456 -11.946 5.426 1.00 0.00 H new ATOM 0 HG23 VAL A 176 14.361 -13.478 5.427 1.00 0.00 H new ATOM 2620 N ARG A 177 11.827 -16.288 6.861 1.00 0.00 N ATOM 2621 CA ARG A 177 12.362 -17.459 7.552 1.00 0.00 C ATOM 2622 C ARG A 177 13.405 -18.102 6.643 1.00 0.00 C ATOM 2623 O ARG A 177 13.188 -18.170 5.441 1.00 0.00 O ATOM 2624 CB ARG A 177 11.228 -18.469 7.818 1.00 0.00 C ATOM 2625 CG ARG A 177 9.995 -17.908 8.544 1.00 0.00 C ATOM 2626 CD ARG A 177 9.986 -18.215 10.048 1.00 0.00 C ATOM 2627 NE ARG A 177 8.643 -18.034 10.629 1.00 0.00 N ATOM 2628 CZ ARG A 177 7.587 -18.827 10.414 1.00 0.00 C ATOM 2629 NH1 ARG A 177 7.694 -19.892 9.628 1.00 0.00 N ATOM 2630 NH2 ARG A 177 6.419 -18.514 10.960 1.00 0.00 N ATOM 0 H ARG A 177 10.921 -16.463 6.426 1.00 0.00 H new ATOM 0 HA ARG A 177 12.806 -17.167 8.504 1.00 0.00 H new ATOM 0 HB2 ARG A 177 10.907 -18.887 6.864 1.00 0.00 H new ATOM 0 HB3 ARG A 177 11.631 -19.293 8.407 1.00 0.00 H new ATOM 0 HG2 ARG A 177 9.957 -16.828 8.400 1.00 0.00 H new ATOM 0 HG3 ARG A 177 9.095 -18.322 8.090 1.00 0.00 H new ATOM 0 HD2 ARG A 177 10.320 -19.239 10.213 1.00 0.00 H new ATOM 0 HD3 ARG A 177 10.695 -17.563 10.558 1.00 0.00 H new ATOM 0 HE ARG A 177 8.507 -17.235 11.248 1.00 0.00 H new ATOM 0 HH11 ARG A 177 8.586 -20.110 9.183 1.00 0.00 H new ATOM 0 HH12 ARG A 177 6.884 -20.492 9.469 1.00 0.00 H new ATOM 0 HH21 ARG A 177 6.333 -17.677 11.536 1.00 0.00 H new ATOM 0 HH22 ARG A 177 5.607 -19.111 10.803 1.00 0.00 H new ATOM 2644 N ASP A 178 14.518 -18.587 7.164 1.00 0.00 N ATOM 2645 CA ASP A 178 15.581 -19.172 6.344 1.00 0.00 C ATOM 2646 C ASP A 178 15.169 -20.468 5.630 1.00 0.00 C ATOM 2647 O ASP A 178 15.791 -20.816 4.628 1.00 0.00 O ATOM 2648 CB ASP A 178 16.891 -19.298 7.144 1.00 0.00 C ATOM 2649 CG ASP A 178 17.278 -20.715 7.553 1.00 0.00 C ATOM 2650 OD1 ASP A 178 17.920 -21.405 6.734 1.00 0.00 O ATOM 2651 OD2 ASP A 178 17.038 -21.056 8.735 1.00 0.00 O ATOM 0 H ASP A 178 14.717 -18.590 8.164 1.00 0.00 H new ATOM 0 HA ASP A 178 15.771 -18.474 5.529 1.00 0.00 H new ATOM 0 HB2 ASP A 178 17.701 -18.876 6.549 1.00 0.00 H new ATOM 0 HB3 ASP A 178 16.806 -18.689 8.044 1.00 0.00 H new ATOM 2656 N ASN A 179 14.089 -21.139 6.045 1.00 0.00 N ATOM 2657 CA ASN A 179 13.517 -22.294 5.356 1.00 0.00 C ATOM 2658 C ASN A 179 12.011 -22.154 5.349 1.00 0.00 C ATOM 2659 O ASN A 179 11.416 -22.523 4.316 1.00 0.00 O ATOM 2660 CB ASN A 179 13.921 -23.612 6.043 1.00 0.00 C ATOM 2661 CG ASN A 179 13.493 -24.879 5.297 1.00 0.00 C ATOM 2662 OD1 ASN A 179 12.953 -24.783 4.093 1.00 0.00 O flip ATOM 2663 ND2 ASN A 179 13.650 -25.983 5.806 1.00 0.00 N flip ATOM 0 H ASN A 179 13.578 -20.885 6.891 1.00 0.00 H new ATOM 0 HA ASN A 179 13.899 -22.324 4.336 1.00 0.00 H new ATOM 0 HB2 ASN A 179 15.004 -23.626 6.164 1.00 0.00 H new ATOM 0 HB3 ASN A 179 13.489 -23.632 7.043 1.00 0.00 H new ATOM 0 HD21 ASN A 179 14.066 -26.062 6.734 1.00 0.00 H new ATOM 0 HD22 ASN A 179 13.365 -26.822 5.302 1.00 0.00 H new