USER MOD reduce.3.24.130724 H: found=0, std=0, add=1119, rem=0, adj=41 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 69 THR OG1 : rot 180:sc= 0.0967 USER MOD Set 1.2: A 149 THR OG1 : rot 79:sc= 0.102 USER MOD Set 2.1: A 75 HIS : no HE2:sc= -0.268 K(o=0.87,f=-1.7!) USER MOD Set 2.2: A 135 THR OG1 : rot 179:sc= 1.14 USER MOD Set 3.1: A 98 ASN :FLIP amide:sc= 0.219 F(o=-2.3,f=0.52) USER MOD Set 3.2: A 100 GLN :FLIP amide:sc= 0.302 F(o=-2.3,f=0.52) USER MOD Set 4.1: A 78 ASN : amide:sc= 0.0574 K(o=-1.3,f=-3.3!) USER MOD Set 4.2: A 95 GLN : amide:sc= -0.353 K(o=-1.3,f=-4.8!) USER MOD Set 4.3: A 103 GLN : amide:sc= -1.03 X(o=-1.3,f=-1.2) USER MOD Set 5.1: A 39 ASN : amide:sc= 0.437 K(o=0.14,f=-3.9!) USER MOD Set 5.2: A 40 ASN :FLIP amide:sc= -0.298 F(o=-0.54,f=0.14) USER MOD Set 6.1: A 24 THR OG1 : rot 180:sc= 0 USER MOD Set 6.2: A 25 ASN : amide:sc= -0.48 X(o=-0.48,f=-0.011) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot -114:sc= 0.119 USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 MET CE :methyl -171:sc= -1.03 (180deg=-1.16) USER MOD Single : A 33 ASN : amide:sc= -0.571 K(o=-0.57,f=-3.2) USER MOD Single : A 36 LYS NZ :NH3+ -173:sc= 0.519 (180deg=0.494) USER MOD Single : A 37 GLN : amide:sc= -0.219 K(o=-0.22,f=-0.77) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0.102 USER MOD Single : A 45 THR OG1 : rot -89:sc= 1.09 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= 0.876 K(o=0.88,f=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.00841) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 76 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 ASN : amide:sc= -0.383 X(o=-0.38,f=-0.38) 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 101 GLN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : A 102 ASN : amide:sc= -0.451 X(o=-0.45,f=-0.022) USER MOD Single : A 107 ASN : amide:sc= -0.216 K(o=-0.22,f=-1.2) USER MOD Single : A 110 SER OG : rot -23:sc= 0.355 USER MOD Single : A 111 SER OG : rot 180:sc= 0 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= 0.021 USER MOD Single : A 119 THR OG1 : rot 31:sc= 0.471 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 ASN : amide:sc= 0.174 K(o=0.17,f=-0.98) USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 ASN : amide:sc= -0.216 X(o=-0.22,f=0) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 MET CE :methyl -156:sc= -3.71! (180deg=-8.68!) USER MOD Single : A 136 GLN :FLIP amide:sc= -0.224 F(o=-1.3!,f=-0.22) USER MOD Single : A 140 THR OG1 : rot 41:sc= 0.797 USER MOD Single : A 143 HIS : no HE2:sc= 0.243 K(o=0.24,f=-2.9!) USER MOD Single : A 145 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 151 THR OG1 : rot 180:sc= 0 USER MOD Single : A 154 TYR OH : rot 112:sc= 0.424 USER MOD Single : A 155 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 168 SER OG : rot 180:sc= 0.0788 USER MOD Single : A 169 THR OG1 : rot 180:sc= 0 USER MOD Single : A 171 THR OG1 : rot 180:sc=-0.00388 USER MOD Single : A 175 TYR OH : rot 180:sc= 0 USER MOD Single : A 179 ASN : amide:sc= -0.462! X(o=-0.46!,f=-0.29) USER MOD ----------------------------------------------------------------- ATOM 235 N GLY A 16 -10.472 18.221 -0.421 1.00 0.00 N ATOM 236 CA GLY A 16 -9.486 17.216 -0.054 1.00 0.00 C ATOM 237 C GLY A 16 -9.846 16.604 1.297 1.00 0.00 C ATOM 238 O GLY A 16 -10.709 17.124 2.013 1.00 0.00 O ATOM 0 HA2 GLY A 16 -9.446 16.438 -0.816 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -8.495 17.667 -0.006 1.00 0.00 H new ATOM 242 N CYS A 17 -9.161 15.530 1.673 1.00 0.00 N ATOM 243 CA CYS A 17 -9.450 14.762 2.874 1.00 0.00 C ATOM 244 C CYS A 17 -8.166 14.627 3.682 1.00 0.00 C ATOM 245 O CYS A 17 -7.104 14.420 3.095 1.00 0.00 O ATOM 246 CB CYS A 17 -9.976 13.382 2.473 1.00 0.00 C ATOM 247 SG CYS A 17 -11.338 13.320 1.273 1.00 0.00 S ATOM 0 H CYS A 17 -8.373 15.163 1.139 1.00 0.00 H new ATOM 0 HA CYS A 17 -10.206 15.263 3.478 1.00 0.00 H new ATOM 0 HB2 CYS A 17 -9.143 12.810 2.066 1.00 0.00 H new ATOM 0 HB3 CYS A 17 -10.302 12.870 3.378 1.00 0.00 H new ATOM 252 N SER A 18 -8.262 14.722 5.005 1.00 0.00 N ATOM 253 CA SER A 18 -7.164 14.389 5.895 1.00 0.00 C ATOM 254 C SER A 18 -6.981 12.865 5.916 1.00 0.00 C ATOM 255 O SER A 18 -7.929 12.107 5.709 1.00 0.00 O ATOM 256 CB SER A 18 -7.504 14.940 7.283 1.00 0.00 C ATOM 257 OG SER A 18 -7.211 16.327 7.366 1.00 0.00 O ATOM 0 H SER A 18 -9.106 15.033 5.487 1.00 0.00 H new ATOM 0 HA SER A 18 -6.225 14.830 5.559 1.00 0.00 H new ATOM 0 HB2 SER A 18 -8.560 14.775 7.495 1.00 0.00 H new ATOM 0 HB3 SER A 18 -6.938 14.399 8.041 1.00 0.00 H new ATOM 0 HG SER A 18 -7.438 16.656 8.261 1.00 0.00 H new ATOM 263 N VAL A 19 -5.757 12.416 6.177 1.00 0.00 N ATOM 264 CA VAL A 19 -5.408 11.018 6.401 1.00 0.00 C ATOM 265 C VAL A 19 -5.734 10.661 7.852 1.00 0.00 C ATOM 266 O VAL A 19 -5.569 11.495 8.748 1.00 0.00 O ATOM 267 CB VAL A 19 -3.921 10.826 6.000 1.00 0.00 C ATOM 268 CG1 VAL A 19 -2.949 11.840 6.626 1.00 0.00 C ATOM 269 CG2 VAL A 19 -3.420 9.419 6.320 1.00 0.00 C ATOM 0 H VAL A 19 -4.952 13.039 6.241 1.00 0.00 H new ATOM 0 HA VAL A 19 -5.987 10.329 5.786 1.00 0.00 H new ATOM 0 HB VAL A 19 -3.923 10.996 4.923 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -1.934 11.627 6.289 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -3.229 12.848 6.321 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -2.994 11.764 7.712 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -2.375 9.329 6.023 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -3.510 9.235 7.391 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -4.017 8.688 5.775 1.00 0.00 H new ATOM 279 N ALA A 20 -6.192 9.430 8.090 1.00 0.00 N ATOM 280 CA ALA A 20 -6.564 8.962 9.418 1.00 0.00 C ATOM 281 C ALA A 20 -5.346 8.674 10.304 1.00 0.00 C ATOM 282 O ALA A 20 -4.205 8.582 9.839 1.00 0.00 O ATOM 283 CB ALA A 20 -7.429 7.713 9.272 1.00 0.00 C ATOM 0 H ALA A 20 -6.314 8.729 7.359 1.00 0.00 H new ATOM 0 HA ALA A 20 -7.123 9.755 9.915 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -7.715 7.351 10.260 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -8.325 7.956 8.701 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -6.865 6.939 8.751 1.00 0.00 H new ATOM 289 N ALA A 21 -5.612 8.461 11.594 1.00 0.00 N ATOM 290 CA ALA A 21 -4.628 7.987 12.560 1.00 0.00 C ATOM 291 C ALA A 21 -4.161 6.567 12.223 1.00 0.00 C ATOM 292 O ALA A 21 -3.067 6.174 12.605 1.00 0.00 O ATOM 293 CB ALA A 21 -5.245 8.036 13.960 1.00 0.00 C ATOM 0 H ALA A 21 -6.534 8.617 12.001 1.00 0.00 H new ATOM 0 HA ALA A 21 -3.751 8.633 12.523 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -4.517 7.683 14.691 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -5.529 9.061 14.197 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -6.128 7.398 13.991 1.00 0.00 H new ATOM 299 N GLU A 22 -4.946 5.798 11.465 1.00 0.00 N ATOM 300 CA GLU A 22 -4.576 4.462 10.996 1.00 0.00 C ATOM 301 C GLU A 22 -3.705 4.517 9.725 1.00 0.00 C ATOM 302 O GLU A 22 -3.715 3.582 8.928 1.00 0.00 O ATOM 303 CB GLU A 22 -5.837 3.594 10.860 1.00 0.00 C ATOM 304 CG GLU A 22 -6.759 4.013 9.713 1.00 0.00 C ATOM 305 CD GLU A 22 -6.984 2.857 8.736 1.00 0.00 C ATOM 306 OE1 GLU A 22 -7.728 1.897 9.051 1.00 0.00 O ATOM 307 OE2 GLU A 22 -6.422 2.947 7.623 1.00 0.00 O ATOM 0 H GLU A 22 -5.872 6.092 11.155 1.00 0.00 H new ATOM 0 HA GLU A 22 -3.939 3.981 11.738 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -5.537 2.557 10.712 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -6.396 3.634 11.795 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -7.716 4.345 10.115 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -6.324 4.861 9.184 1.00 0.00 H new ATOM 314 N SER A 23 -2.980 5.620 9.513 1.00 0.00 N ATOM 315 CA SER A 23 -1.993 5.755 8.440 1.00 0.00 C ATOM 316 C SER A 23 -0.733 6.523 8.848 1.00 0.00 C ATOM 317 O SER A 23 0.373 6.113 8.505 1.00 0.00 O ATOM 318 CB SER A 23 -2.632 6.422 7.226 1.00 0.00 C ATOM 319 OG SER A 23 -2.781 5.500 6.171 1.00 0.00 O ATOM 0 H SER A 23 -3.065 6.456 10.091 1.00 0.00 H new ATOM 0 HA SER A 23 -1.670 4.743 8.197 1.00 0.00 H new ATOM 0 HB2 SER A 23 -3.605 6.830 7.499 1.00 0.00 H new ATOM 0 HB3 SER A 23 -2.016 7.260 6.899 1.00 0.00 H new ATOM 0 HG SER A 23 -2.202 5.761 5.424 1.00 0.00 H new ATOM 325 N THR A 24 -0.826 7.652 9.546 1.00 0.00 N ATOM 326 CA THR A 24 0.376 8.203 10.140 1.00 0.00 C ATOM 327 C THR A 24 0.780 7.199 11.220 1.00 0.00 C ATOM 328 O THR A 24 -0.043 6.873 12.072 1.00 0.00 O ATOM 329 CB THR A 24 0.123 9.644 10.622 1.00 0.00 C ATOM 330 OG1 THR A 24 1.333 10.276 10.982 1.00 0.00 O ATOM 331 CG2 THR A 24 -0.889 9.797 11.761 1.00 0.00 C ATOM 0 H THR A 24 -1.684 8.180 9.707 1.00 0.00 H new ATOM 0 HA THR A 24 1.208 8.319 9.445 1.00 0.00 H new ATOM 0 HB THR A 24 -0.330 10.132 9.759 1.00 0.00 H new ATOM 0 HG1 THR A 24 1.148 11.190 11.283 1.00 0.00 H new ATOM 0 HG21 THR A 24 -0.989 10.851 12.020 1.00 0.00 H new ATOM 0 HG22 THR A 24 -1.856 9.408 11.443 1.00 0.00 H new ATOM 0 HG23 THR A 24 -0.543 9.241 12.632 1.00 0.00 H new ATOM 339 N ASN A 25 2.024 6.709 11.184 1.00 0.00 N ATOM 340 CA ASN A 25 2.664 6.095 12.358 1.00 0.00 C ATOM 341 C ASN A 25 2.007 4.751 12.714 1.00 0.00 C ATOM 342 O ASN A 25 2.049 4.300 13.859 1.00 0.00 O ATOM 343 CB ASN A 25 2.633 7.088 13.550 1.00 0.00 C ATOM 344 CG ASN A 25 3.126 8.507 13.285 1.00 0.00 C ATOM 345 OD1 ASN A 25 2.782 9.421 14.024 1.00 0.00 O ATOM 346 ND2 ASN A 25 3.838 8.756 12.194 1.00 0.00 N ATOM 0 H ASN A 25 2.612 6.725 10.351 1.00 0.00 H new ATOM 0 HA ASN A 25 3.705 5.879 12.120 1.00 0.00 H new ATOM 0 HB2 ASN A 25 1.607 7.149 13.913 1.00 0.00 H new ATOM 0 HB3 ASN A 25 3.233 6.667 14.357 1.00 0.00 H new ATOM 0 HD21 ASN A 25 4.103 9.714 11.966 1.00 0.00 H new ATOM 0 HD22 ASN A 25 4.121 7.989 11.584 1.00 0.00 H new ATOM 353 N PHE A 26 1.326 4.146 11.744 1.00 0.00 N ATOM 354 CA PHE A 26 0.541 2.931 11.875 1.00 0.00 C ATOM 355 C PHE A 26 1.374 1.698 11.528 1.00 0.00 C ATOM 356 O PHE A 26 2.581 1.784 11.299 1.00 0.00 O ATOM 357 CB PHE A 26 -0.691 3.041 10.967 1.00 0.00 C ATOM 358 CG PHE A 26 -0.485 2.705 9.499 1.00 0.00 C ATOM 359 CD1 PHE A 26 0.553 3.288 8.748 1.00 0.00 C ATOM 360 CD2 PHE A 26 -1.400 1.854 8.857 1.00 0.00 C ATOM 361 CE1 PHE A 26 0.578 3.148 7.354 1.00 0.00 C ATOM 362 CE2 PHE A 26 -1.333 1.672 7.469 1.00 0.00 C ATOM 363 CZ PHE A 26 -0.369 2.346 6.707 1.00 0.00 C ATOM 0 H PHE A 26 1.309 4.515 10.793 1.00 0.00 H new ATOM 0 HA PHE A 26 0.219 2.816 12.910 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -1.465 2.383 11.362 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -1.074 4.060 11.033 1.00 0.00 H new ATOM 0 HD1 PHE A 26 1.332 3.845 9.247 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -2.155 1.340 9.433 1.00 0.00 H new ATOM 0 HE1 PHE A 26 1.332 3.662 6.776 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -2.030 1.006 6.982 1.00 0.00 H new ATOM 0 HZ PHE A 26 -0.357 2.247 5.632 1.00 0.00 H new ATOM 373 N THR A 27 0.707 0.550 11.428 1.00 0.00 N ATOM 374 CA THR A 27 1.292 -0.647 10.864 1.00 0.00 C ATOM 375 C THR A 27 0.404 -1.155 9.723 1.00 0.00 C ATOM 376 O THR A 27 -0.827 -1.057 9.774 1.00 0.00 O ATOM 377 CB THR A 27 1.418 -1.694 11.989 1.00 0.00 C ATOM 378 OG1 THR A 27 2.009 -1.181 13.176 1.00 0.00 O ATOM 379 CG2 THR A 27 2.252 -2.891 11.563 1.00 0.00 C ATOM 0 H THR A 27 -0.257 0.432 11.739 1.00 0.00 H new ATOM 0 HA THR A 27 2.281 -0.446 10.453 1.00 0.00 H new ATOM 0 HB THR A 27 0.388 -1.988 12.193 1.00 0.00 H new ATOM 0 HG1 THR A 27 2.059 -1.891 13.850 1.00 0.00 H new ATOM 0 HG21 THR A 27 2.314 -3.603 12.386 1.00 0.00 H new ATOM 0 HG22 THR A 27 1.786 -3.371 10.702 1.00 0.00 H new ATOM 0 HG23 THR A 27 3.255 -2.559 11.294 1.00 0.00 H new ATOM 387 N VAL A 28 1.034 -1.766 8.721 1.00 0.00 N ATOM 388 CA VAL A 28 0.386 -2.650 7.767 1.00 0.00 C ATOM 389 C VAL A 28 0.966 -4.027 8.022 1.00 0.00 C ATOM 390 O VAL A 28 2.182 -4.206 7.993 1.00 0.00 O ATOM 391 CB VAL A 28 0.610 -2.201 6.315 1.00 0.00 C ATOM 392 CG1 VAL A 28 -0.409 -2.899 5.401 1.00 0.00 C ATOM 393 CG2 VAL A 28 0.444 -0.702 6.083 1.00 0.00 C ATOM 0 H VAL A 28 2.033 -1.654 8.550 1.00 0.00 H new ATOM 0 HA VAL A 28 -0.696 -2.641 7.901 1.00 0.00 H new ATOM 0 HB VAL A 28 1.643 -2.467 6.092 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -0.251 -2.581 4.370 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -0.281 -3.979 5.471 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -1.419 -2.633 5.712 1.00 0.00 H new ATOM 0 HG21 VAL A 28 0.620 -0.475 5.032 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -0.568 -0.402 6.355 1.00 0.00 H new ATOM 0 HG23 VAL A 28 1.161 -0.157 6.697 1.00 0.00 H new ATOM 403 N ASP A 29 0.106 -4.989 8.311 1.00 0.00 N ATOM 404 CA ASP A 29 0.463 -6.293 8.826 1.00 0.00 C ATOM 405 C ASP A 29 -0.173 -7.278 7.866 1.00 0.00 C ATOM 406 O ASP A 29 -1.393 -7.435 7.834 1.00 0.00 O ATOM 407 CB ASP A 29 0.060 -6.506 10.297 1.00 0.00 C ATOM 408 CG ASP A 29 -0.725 -5.373 10.959 1.00 0.00 C ATOM 409 OD1 ASP A 29 -1.853 -5.075 10.493 1.00 0.00 O ATOM 410 OD2 ASP A 29 -0.243 -4.792 11.952 1.00 0.00 O ATOM 0 H ASP A 29 -0.900 -4.875 8.187 1.00 0.00 H new ATOM 0 HA ASP A 29 1.544 -6.425 8.866 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -0.536 -7.416 10.359 1.00 0.00 H new ATOM 0 HB3 ASP A 29 0.966 -6.678 10.878 1.00 0.00 H new ATOM 415 N LEU A 30 0.668 -7.828 6.991 1.00 0.00 N ATOM 416 CA LEU A 30 0.257 -8.583 5.821 1.00 0.00 C ATOM 417 C LEU A 30 0.043 -10.015 6.262 1.00 0.00 C ATOM 418 O LEU A 30 -1.085 -10.478 6.395 1.00 0.00 O ATOM 419 CB LEU A 30 1.334 -8.456 4.712 1.00 0.00 C ATOM 420 CG LEU A 30 1.167 -7.259 3.755 1.00 0.00 C ATOM 421 CD1 LEU A 30 0.706 -5.968 4.426 1.00 0.00 C ATOM 422 CD2 LEU A 30 2.499 -6.971 3.056 1.00 0.00 C ATOM 0 H LEU A 30 1.681 -7.755 7.084 1.00 0.00 H new ATOM 0 HA LEU A 30 -0.671 -8.201 5.397 1.00 0.00 H new ATOM 0 HB2 LEU A 30 2.312 -8.384 5.187 1.00 0.00 H new ATOM 0 HB3 LEU A 30 1.332 -9.373 4.122 1.00 0.00 H new ATOM 0 HG LEU A 30 0.385 -7.557 3.056 1.00 0.00 H new ATOM 0 HD11 LEU A 30 0.616 -5.181 3.677 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -0.262 -6.130 4.900 1.00 0.00 H new ATOM 0 HD13 LEU A 30 1.434 -5.670 5.180 1.00 0.00 H new ATOM 0 HD21 LEU A 30 2.379 -6.125 2.380 1.00 0.00 H new ATOM 0 HD22 LEU A 30 3.258 -6.735 3.802 1.00 0.00 H new ATOM 0 HD23 LEU A 30 2.809 -7.848 2.488 1.00 0.00 H new ATOM 434 N MET A 31 1.147 -10.715 6.477 1.00 0.00 N ATOM 435 CA MET A 31 1.314 -12.155 6.452 1.00 0.00 C ATOM 436 C MET A 31 2.791 -12.372 6.183 1.00 0.00 C ATOM 437 O MET A 31 3.464 -11.512 5.596 1.00 0.00 O ATOM 438 CB MET A 31 0.563 -12.831 5.293 1.00 0.00 C ATOM 439 CG MET A 31 -0.777 -13.492 5.597 1.00 0.00 C ATOM 440 SD MET A 31 -1.251 -14.616 4.256 1.00 0.00 S ATOM 441 CE MET A 31 -1.275 -13.415 2.898 1.00 0.00 C ATOM 0 H MET A 31 2.026 -10.244 6.692 1.00 0.00 H new ATOM 0 HA MET A 31 0.936 -12.574 7.385 1.00 0.00 H new ATOM 0 HB2 MET A 31 0.397 -12.081 4.520 1.00 0.00 H new ATOM 0 HB3 MET A 31 1.220 -13.589 4.866 1.00 0.00 H new ATOM 0 HG2 MET A 31 -0.713 -14.043 6.535 1.00 0.00 H new ATOM 0 HG3 MET A 31 -1.544 -12.729 5.728 1.00 0.00 H new ATOM 0 HE1 MET A 31 -1.701 -13.880 2.009 1.00 0.00 H new ATOM 0 HE2 MET A 31 -1.880 -12.555 3.184 1.00 0.00 H new ATOM 0 HE3 MET A 31 -0.258 -13.088 2.684 1.00 0.00 H new ATOM 451 N GLU A 32 3.254 -13.568 6.503 1.00 0.00 N ATOM 452 CA GLU A 32 4.671 -13.862 6.517 1.00 0.00 C ATOM 453 C GLU A 32 5.159 -14.087 5.093 1.00 0.00 C ATOM 454 O GLU A 32 4.395 -14.292 4.138 1.00 0.00 O ATOM 455 CB GLU A 32 5.017 -15.038 7.461 1.00 0.00 C ATOM 456 CG GLU A 32 5.519 -14.556 8.832 1.00 0.00 C ATOM 457 CD GLU A 32 4.418 -14.104 9.813 1.00 0.00 C ATOM 458 OE1 GLU A 32 3.388 -13.521 9.398 1.00 0.00 O ATOM 459 OE2 GLU A 32 4.635 -14.203 11.044 1.00 0.00 O ATOM 0 H GLU A 32 2.660 -14.357 6.759 1.00 0.00 H new ATOM 0 HA GLU A 32 5.202 -13.002 6.926 1.00 0.00 H new ATOM 0 HB2 GLU A 32 4.134 -15.663 7.599 1.00 0.00 H new ATOM 0 HB3 GLU A 32 5.780 -15.662 6.996 1.00 0.00 H new ATOM 0 HG2 GLU A 32 6.088 -15.361 9.296 1.00 0.00 H new ATOM 0 HG3 GLU A 32 6.208 -13.726 8.677 1.00 0.00 H new ATOM 466 N ASN A 33 6.473 -14.036 4.968 1.00 0.00 N ATOM 467 CA ASN A 33 7.234 -14.045 3.740 1.00 0.00 C ATOM 468 C ASN A 33 8.165 -15.239 3.799 1.00 0.00 C ATOM 469 O ASN A 33 8.218 -15.921 4.821 1.00 0.00 O ATOM 470 CB ASN A 33 7.899 -12.684 3.568 1.00 0.00 C ATOM 471 CG ASN A 33 6.907 -11.543 3.728 1.00 0.00 C ATOM 472 OD1 ASN A 33 6.904 -10.895 4.764 1.00 0.00 O ATOM 473 ND2 ASN A 33 6.047 -11.283 2.757 1.00 0.00 N ATOM 0 H ASN A 33 7.078 -13.983 5.787 1.00 0.00 H new ATOM 0 HA ASN A 33 6.628 -14.173 2.843 1.00 0.00 H new ATOM 0 HB2 ASN A 33 8.698 -12.575 4.301 1.00 0.00 H new ATOM 0 HB3 ASN A 33 8.361 -12.628 2.582 1.00 0.00 H new ATOM 0 HD21 ASN A 33 5.367 -10.531 2.866 1.00 0.00 H new ATOM 0 HD22 ASN A 33 6.064 -11.835 1.899 1.00 0.00 H new ATOM 480 N ALA A 34 8.897 -15.527 2.729 1.00 0.00 N ATOM 481 CA ALA A 34 9.791 -16.666 2.740 1.00 0.00 C ATOM 482 C ALA A 34 11.017 -16.334 1.941 1.00 0.00 C ATOM 483 O ALA A 34 10.903 -16.030 0.764 1.00 0.00 O ATOM 484 CB ALA A 34 9.099 -17.920 2.194 1.00 0.00 C ATOM 0 H ALA A 34 8.887 -14.994 1.859 1.00 0.00 H new ATOM 0 HA ALA A 34 10.080 -16.884 3.768 1.00 0.00 H new ATOM 0 HB1 ALA A 34 9.795 -18.758 2.215 1.00 0.00 H new ATOM 0 HB2 ALA A 34 8.231 -18.154 2.810 1.00 0.00 H new ATOM 0 HB3 ALA A 34 8.778 -17.741 1.168 1.00 0.00 H new ATOM 490 N ALA A 35 12.188 -16.419 2.558 1.00 0.00 N ATOM 491 CA ALA A 35 13.435 -16.355 1.803 1.00 0.00 C ATOM 492 C ALA A 35 13.394 -17.352 0.632 1.00 0.00 C ATOM 493 O ALA A 35 13.767 -17.005 -0.487 1.00 0.00 O ATOM 494 CB ALA A 35 14.626 -16.636 2.720 1.00 0.00 C ATOM 0 H ALA A 35 12.302 -16.531 3.565 1.00 0.00 H new ATOM 0 HA ALA A 35 13.552 -15.351 1.395 1.00 0.00 H new ATOM 0 HB1 ALA A 35 15.549 -16.585 2.143 1.00 0.00 H new ATOM 0 HB2 ALA A 35 14.655 -15.893 3.517 1.00 0.00 H new ATOM 0 HB3 ALA A 35 14.524 -17.631 3.154 1.00 0.00 H new ATOM 500 N LYS A 36 12.844 -18.553 0.862 1.00 0.00 N ATOM 501 CA LYS A 36 12.928 -19.657 -0.098 1.00 0.00 C ATOM 502 C LYS A 36 12.034 -19.520 -1.326 1.00 0.00 C ATOM 503 O LYS A 36 12.030 -20.432 -2.155 1.00 0.00 O ATOM 504 CB LYS A 36 12.749 -21.024 0.590 1.00 0.00 C ATOM 505 CG LYS A 36 11.420 -21.321 1.312 1.00 0.00 C ATOM 506 CD LYS A 36 10.146 -21.450 0.460 1.00 0.00 C ATOM 507 CE LYS A 36 10.243 -22.612 -0.544 1.00 0.00 C ATOM 508 NZ LYS A 36 9.745 -22.262 -1.892 1.00 0.00 N ATOM 0 H LYS A 36 12.332 -18.783 1.714 1.00 0.00 H new ATOM 0 HA LYS A 36 13.942 -19.598 -0.494 1.00 0.00 H new ATOM 0 HB2 LYS A 36 12.894 -21.796 -0.166 1.00 0.00 H new ATOM 0 HB3 LYS A 36 13.553 -21.135 1.318 1.00 0.00 H new ATOM 0 HG2 LYS A 36 11.544 -22.249 1.870 1.00 0.00 H new ATOM 0 HG3 LYS A 36 11.254 -20.530 2.043 1.00 0.00 H new ATOM 0 HD2 LYS A 36 9.287 -21.605 1.113 1.00 0.00 H new ATOM 0 HD3 LYS A 36 9.973 -20.518 -0.079 1.00 0.00 H new ATOM 0 HE2 LYS A 36 11.282 -22.932 -0.620 1.00 0.00 H new ATOM 0 HE3 LYS A 36 9.675 -23.461 -0.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 9.726 -23.115 -2.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 8.784 -21.871 -1.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 10.374 -21.554 -2.321 1.00 0.00 H new ATOM 522 N GLN A 37 11.226 -18.464 -1.442 1.00 0.00 N ATOM 523 CA GLN A 37 10.389 -18.267 -2.623 1.00 0.00 C ATOM 524 C GLN A 37 10.959 -17.212 -3.571 1.00 0.00 C ATOM 525 O GLN A 37 10.497 -17.091 -4.703 1.00 0.00 O ATOM 526 CB GLN A 37 8.951 -17.940 -2.205 1.00 0.00 C ATOM 527 CG GLN A 37 8.730 -16.538 -1.618 1.00 0.00 C ATOM 528 CD GLN A 37 7.261 -16.162 -1.647 1.00 0.00 C ATOM 529 OE1 GLN A 37 6.631 -16.158 -2.699 1.00 0.00 O ATOM 530 NE2 GLN A 37 6.678 -15.822 -0.518 1.00 0.00 N ATOM 0 H GLN A 37 11.135 -17.735 -0.734 1.00 0.00 H new ATOM 0 HA GLN A 37 10.380 -19.202 -3.184 1.00 0.00 H new ATOM 0 HB2 GLN A 37 8.304 -18.056 -3.075 1.00 0.00 H new ATOM 0 HB3 GLN A 37 8.630 -18.677 -1.469 1.00 0.00 H new ATOM 0 HG2 GLN A 37 9.097 -16.508 -0.592 1.00 0.00 H new ATOM 0 HG3 GLN A 37 9.307 -15.807 -2.185 1.00 0.00 H new ATOM 0 HE21 GLN A 37 7.210 -15.828 0.353 1.00 0.00 H new ATOM 0 HE22 GLN A 37 5.694 -15.552 -0.513 1.00 0.00 H new ATOM 539 N PHE A 38 11.927 -16.422 -3.109 1.00 0.00 N ATOM 540 CA PHE A 38 12.371 -15.215 -3.790 1.00 0.00 C ATOM 541 C PHE A 38 13.712 -15.447 -4.478 1.00 0.00 C ATOM 542 O PHE A 38 14.587 -14.589 -4.526 1.00 0.00 O ATOM 543 CB PHE A 38 12.426 -14.107 -2.753 1.00 0.00 C ATOM 544 CG PHE A 38 11.083 -13.680 -2.175 1.00 0.00 C ATOM 545 CD1 PHE A 38 10.036 -13.215 -2.997 1.00 0.00 C ATOM 546 CD2 PHE A 38 10.932 -13.617 -0.779 1.00 0.00 C ATOM 547 CE1 PHE A 38 8.873 -12.680 -2.426 1.00 0.00 C ATOM 548 CE2 PHE A 38 9.753 -13.122 -0.206 1.00 0.00 C ATOM 549 CZ PHE A 38 8.721 -12.648 -1.030 1.00 0.00 C ATOM 0 H PHE A 38 12.429 -16.608 -2.241 1.00 0.00 H new ATOM 0 HA PHE A 38 11.679 -14.930 -4.583 1.00 0.00 H new ATOM 0 HB2 PHE A 38 13.067 -14.432 -1.934 1.00 0.00 H new ATOM 0 HB3 PHE A 38 12.901 -13.236 -3.203 1.00 0.00 H new ATOM 0 HD1 PHE A 38 10.131 -13.271 -4.071 1.00 0.00 H new ATOM 0 HD2 PHE A 38 11.735 -13.954 -0.140 1.00 0.00 H new ATOM 0 HE1 PHE A 38 8.091 -12.291 -3.062 1.00 0.00 H new ATOM 0 HE2 PHE A 38 9.639 -13.105 0.868 1.00 0.00 H new ATOM 0 HZ PHE A 38 7.813 -12.260 -0.592 1.00 0.00 H new ATOM 559 N ASN A 39 13.854 -16.629 -5.055 1.00 0.00 N ATOM 560 CA ASN A 39 15.036 -17.124 -5.736 1.00 0.00 C ATOM 561 C ASN A 39 15.139 -16.616 -7.184 1.00 0.00 C ATOM 562 O ASN A 39 15.760 -17.250 -8.038 1.00 0.00 O ATOM 563 CB ASN A 39 14.960 -18.658 -5.705 1.00 0.00 C ATOM 564 CG ASN A 39 13.762 -19.175 -6.497 1.00 0.00 C ATOM 565 OD1 ASN A 39 12.611 -18.913 -6.158 1.00 0.00 O ATOM 566 ND2 ASN A 39 13.981 -19.851 -7.601 1.00 0.00 N ATOM 0 H ASN A 39 13.096 -17.312 -5.060 1.00 0.00 H new ATOM 0 HA ASN A 39 15.929 -16.757 -5.230 1.00 0.00 H new ATOM 0 HB2 ASN A 39 15.878 -19.077 -6.117 1.00 0.00 H new ATOM 0 HB3 ASN A 39 14.889 -18.999 -4.672 1.00 0.00 H new ATOM 0 HD21 ASN A 39 13.196 -20.158 -8.175 1.00 0.00 H new ATOM 0 HD22 ASN A 39 14.936 -20.070 -7.884 1.00 0.00 H new ATOM 573 N ASN A 40 14.478 -15.502 -7.500 1.00 0.00 N ATOM 574 CA ASN A 40 14.199 -14.992 -8.844 1.00 0.00 C ATOM 575 C ASN A 40 13.241 -13.826 -8.742 1.00 0.00 C ATOM 576 O ASN A 40 12.458 -13.757 -7.798 1.00 0.00 O ATOM 577 CB ASN A 40 13.531 -16.040 -9.772 1.00 0.00 C ATOM 578 CG ASN A 40 12.609 -17.087 -9.136 1.00 0.00 C ATOM 579 OD1 ASN A 40 11.948 -16.805 -8.025 1.00 0.00 O flip ATOM 580 ND2 ASN A 40 12.452 -18.184 -9.668 1.00 0.00 N flip ATOM 0 H ASN A 40 14.098 -14.891 -6.777 1.00 0.00 H new ATOM 0 HA ASN A 40 15.162 -14.713 -9.271 1.00 0.00 H new ATOM 0 HB2 ASN A 40 12.954 -15.500 -10.523 1.00 0.00 H new ATOM 0 HB3 ASN A 40 14.323 -16.571 -10.300 1.00 0.00 H new ATOM 0 HD21 ASN A 40 12.956 -18.412 -10.525 1.00 0.00 H new ATOM 0 HD22 ASN A 40 11.817 -18.866 -9.253 1.00 0.00 H new ATOM 587 N ILE A 41 13.279 -12.966 -9.756 1.00 0.00 N ATOM 588 CA ILE A 41 12.578 -11.695 -9.837 1.00 0.00 C ATOM 589 C ILE A 41 11.123 -11.908 -10.294 1.00 0.00 C ATOM 590 O ILE A 41 10.264 -11.067 -10.037 1.00 0.00 O ATOM 591 CB ILE A 41 13.399 -10.735 -10.740 1.00 0.00 C ATOM 592 CG1 ILE A 41 14.830 -10.501 -10.179 1.00 0.00 C ATOM 593 CG2 ILE A 41 12.731 -9.354 -10.878 1.00 0.00 C ATOM 594 CD1 ILE A 41 15.895 -11.493 -10.670 1.00 0.00 C ATOM 0 H ILE A 41 13.834 -13.152 -10.591 1.00 0.00 H new ATOM 0 HA ILE A 41 12.499 -11.225 -8.857 1.00 0.00 H new ATOM 0 HB ILE A 41 13.447 -11.224 -11.713 1.00 0.00 H new ATOM 0 HG12 ILE A 41 15.146 -9.492 -10.444 1.00 0.00 H new ATOM 0 HG13 ILE A 41 14.788 -10.546 -9.091 1.00 0.00 H new ATOM 0 HG21 ILE A 41 13.341 -8.717 -11.518 1.00 0.00 H new ATOM 0 HG22 ILE A 41 11.741 -9.471 -11.320 1.00 0.00 H new ATOM 0 HG23 ILE A 41 12.637 -8.895 -9.894 1.00 0.00 H new ATOM 0 HD11 ILE A 41 16.857 -11.245 -10.222 1.00 0.00 H new ATOM 0 HD12 ILE A 41 15.610 -12.505 -10.381 1.00 0.00 H new ATOM 0 HD13 ILE A 41 15.974 -11.434 -11.756 1.00 0.00 H new ATOM 606 N GLY A 42 10.790 -13.080 -10.836 1.00 0.00 N ATOM 607 CA GLY A 42 9.410 -13.446 -11.138 1.00 0.00 C ATOM 608 C GLY A 42 8.611 -13.863 -9.899 1.00 0.00 C ATOM 609 O GLY A 42 7.454 -14.253 -10.034 1.00 0.00 O ATOM 0 H GLY A 42 11.471 -13.800 -11.077 1.00 0.00 H new ATOM 0 HA2 GLY A 42 8.913 -12.601 -11.615 1.00 0.00 H new ATOM 0 HA3 GLY A 42 9.407 -14.265 -11.857 1.00 0.00 H new ATOM 613 N ALA A 43 9.191 -13.840 -8.693 1.00 0.00 N ATOM 614 CA ALA A 43 8.518 -14.239 -7.459 1.00 0.00 C ATOM 615 C ALA A 43 7.559 -13.151 -6.912 1.00 0.00 C ATOM 616 O ALA A 43 7.701 -12.708 -5.767 1.00 0.00 O ATOM 617 CB ALA A 43 9.593 -14.657 -6.442 1.00 0.00 C ATOM 0 H ALA A 43 10.155 -13.539 -8.549 1.00 0.00 H new ATOM 0 HA ALA A 43 7.865 -15.088 -7.664 1.00 0.00 H new ATOM 0 HB1 ALA A 43 9.115 -14.960 -5.511 1.00 0.00 H new ATOM 0 HB2 ALA A 43 10.168 -15.492 -6.843 1.00 0.00 H new ATOM 0 HB3 ALA A 43 10.260 -13.816 -6.251 1.00 0.00 H new ATOM 623 N THR A 44 6.490 -12.820 -7.643 1.00 0.00 N ATOM 624 CA THR A 44 5.432 -11.902 -7.209 1.00 0.00 C ATOM 625 C THR A 44 4.481 -12.636 -6.249 1.00 0.00 C ATOM 626 O THR A 44 3.762 -13.558 -6.655 1.00 0.00 O ATOM 627 CB THR A 44 4.652 -11.368 -8.435 1.00 0.00 C ATOM 628 OG1 THR A 44 4.666 -12.302 -9.499 1.00 0.00 O ATOM 629 CG2 THR A 44 5.234 -10.076 -9.007 1.00 0.00 C ATOM 0 H THR A 44 6.332 -13.194 -8.579 1.00 0.00 H new ATOM 0 HA THR A 44 5.880 -11.054 -6.691 1.00 0.00 H new ATOM 0 HB THR A 44 3.645 -11.189 -8.059 1.00 0.00 H new ATOM 0 HG1 THR A 44 4.165 -11.939 -10.259 1.00 0.00 H new ATOM 0 HG21 THR A 44 4.640 -9.757 -9.863 1.00 0.00 H new ATOM 0 HG22 THR A 44 5.215 -9.299 -8.243 1.00 0.00 H new ATOM 0 HG23 THR A 44 6.263 -10.249 -9.323 1.00 0.00 H new ATOM 637 N THR A 45 4.511 -12.278 -4.961 1.00 0.00 N ATOM 638 CA THR A 45 3.748 -12.904 -3.886 1.00 0.00 C ATOM 639 C THR A 45 2.224 -12.720 -4.037 1.00 0.00 C ATOM 640 O THR A 45 1.764 -11.890 -4.834 1.00 0.00 O ATOM 641 CB THR A 45 4.273 -12.368 -2.532 1.00 0.00 C ATOM 642 OG1 THR A 45 4.691 -11.010 -2.545 1.00 0.00 O ATOM 643 CG2 THR A 45 5.417 -13.239 -2.049 1.00 0.00 C ATOM 0 H THR A 45 5.095 -11.510 -4.629 1.00 0.00 H new ATOM 0 HA THR A 45 3.900 -13.982 -3.934 1.00 0.00 H new ATOM 0 HB THR A 45 3.421 -12.410 -1.853 1.00 0.00 H new ATOM 0 HG1 THR A 45 5.637 -10.961 -2.795 1.00 0.00 H new ATOM 0 HG21 THR A 45 5.785 -12.860 -1.096 1.00 0.00 H new ATOM 0 HG22 THR A 45 5.066 -14.263 -1.921 1.00 0.00 H new ATOM 0 HG23 THR A 45 6.223 -13.221 -2.783 1.00 0.00 H new ATOM 651 N PRO A 46 1.414 -13.465 -3.255 1.00 0.00 N ATOM 652 CA PRO A 46 -0.020 -13.231 -3.183 1.00 0.00 C ATOM 653 C PRO A 46 -0.267 -11.873 -2.531 1.00 0.00 C ATOM 654 O PRO A 46 -0.035 -11.728 -1.325 1.00 0.00 O ATOM 655 CB PRO A 46 -0.609 -14.387 -2.369 1.00 0.00 C ATOM 656 CG PRO A 46 0.558 -14.927 -1.550 1.00 0.00 C ATOM 657 CD PRO A 46 1.794 -14.568 -2.373 1.00 0.00 C ATOM 0 HA PRO A 46 -0.494 -13.203 -4.164 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -1.418 -14.044 -1.724 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -1.024 -15.157 -3.020 1.00 0.00 H new ATOM 0 HG2 PRO A 46 0.593 -14.472 -0.560 1.00 0.00 H new ATOM 0 HG3 PRO A 46 0.477 -16.004 -1.403 1.00 0.00 H new ATOM 0 HD2 PRO A 46 2.619 -14.276 -1.723 1.00 0.00 H new ATOM 0 HD3 PRO A 46 2.134 -15.426 -2.953 1.00 0.00 H new ATOM 665 N VAL A 47 -0.643 -10.863 -3.322 1.00 0.00 N ATOM 666 CA VAL A 47 -0.858 -9.528 -2.790 1.00 0.00 C ATOM 667 C VAL A 47 -2.040 -9.476 -1.836 1.00 0.00 C ATOM 668 O VAL A 47 -3.053 -10.146 -2.042 1.00 0.00 O ATOM 669 CB VAL A 47 -0.911 -8.442 -3.882 1.00 0.00 C ATOM 670 CG1 VAL A 47 0.331 -8.481 -4.780 1.00 0.00 C ATOM 671 CG2 VAL A 47 -2.167 -8.515 -4.752 1.00 0.00 C ATOM 0 H VAL A 47 -0.802 -10.951 -4.326 1.00 0.00 H new ATOM 0 HA VAL A 47 0.024 -9.289 -2.196 1.00 0.00 H new ATOM 0 HB VAL A 47 -0.939 -7.497 -3.340 1.00 0.00 H new ATOM 0 HG11 VAL A 47 0.257 -7.701 -5.537 1.00 0.00 H new ATOM 0 HG12 VAL A 47 1.223 -8.316 -4.175 1.00 0.00 H new ATOM 0 HG13 VAL A 47 0.398 -9.454 -5.267 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -2.139 -7.722 -5.499 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -2.208 -9.483 -5.252 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -3.051 -8.392 -4.126 1.00 0.00 H new ATOM 681 N VAL A 48 -1.888 -8.656 -0.804 1.00 0.00 N ATOM 682 CA VAL A 48 -2.800 -8.524 0.313 1.00 0.00 C ATOM 683 C VAL A 48 -3.420 -7.129 0.214 1.00 0.00 C ATOM 684 O VAL A 48 -2.707 -6.177 -0.111 1.00 0.00 O ATOM 685 CB VAL A 48 -1.976 -8.738 1.597 1.00 0.00 C ATOM 686 CG1 VAL A 48 -2.572 -8.099 2.850 1.00 0.00 C ATOM 687 CG2 VAL A 48 -1.771 -10.237 1.846 1.00 0.00 C ATOM 0 H VAL A 48 -1.082 -8.036 -0.724 1.00 0.00 H new ATOM 0 HA VAL A 48 -3.611 -9.252 0.316 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.026 -8.234 1.418 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -1.926 -8.301 3.704 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -2.655 -7.022 2.705 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -3.561 -8.518 3.037 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -1.187 -10.378 2.756 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -2.740 -10.723 1.957 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -1.239 -10.677 1.002 1.00 0.00 H new ATOM 697 N PRO A 49 -4.725 -6.974 0.471 1.00 0.00 N ATOM 698 CA PRO A 49 -5.385 -5.681 0.414 1.00 0.00 C ATOM 699 C PRO A 49 -4.838 -4.755 1.505 1.00 0.00 C ATOM 700 O PRO A 49 -4.741 -5.144 2.671 1.00 0.00 O ATOM 701 CB PRO A 49 -6.876 -5.986 0.577 1.00 0.00 C ATOM 702 CG PRO A 49 -6.927 -7.338 1.273 1.00 0.00 C ATOM 703 CD PRO A 49 -5.669 -8.031 0.783 1.00 0.00 C ATOM 0 HA PRO A 49 -5.207 -5.152 -0.522 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -7.374 -5.218 1.169 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -7.380 -6.020 -0.389 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -6.931 -7.232 2.358 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -7.824 -7.895 1.004 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -5.269 -8.698 1.546 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -5.877 -8.641 -0.096 1.00 0.00 H new ATOM 711 N PHE A 50 -4.524 -3.514 1.139 1.00 0.00 N ATOM 712 CA PHE A 50 -4.366 -2.393 2.062 1.00 0.00 C ATOM 713 C PHE A 50 -4.945 -1.166 1.359 1.00 0.00 C ATOM 714 O PHE A 50 -5.414 -1.263 0.224 1.00 0.00 O ATOM 715 CB PHE A 50 -2.909 -2.219 2.533 1.00 0.00 C ATOM 716 CG PHE A 50 -2.097 -1.131 1.855 1.00 0.00 C ATOM 717 CD1 PHE A 50 -1.628 -1.329 0.548 1.00 0.00 C ATOM 718 CD2 PHE A 50 -1.787 0.070 2.528 1.00 0.00 C ATOM 719 CE1 PHE A 50 -0.787 -0.381 -0.057 1.00 0.00 C ATOM 720 CE2 PHE A 50 -0.975 1.039 1.910 1.00 0.00 C ATOM 721 CZ PHE A 50 -0.446 0.798 0.629 1.00 0.00 C ATOM 0 H PHE A 50 -4.368 -3.254 0.165 1.00 0.00 H new ATOM 0 HA PHE A 50 -4.908 -2.568 2.991 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -2.920 -2.017 3.604 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -2.391 -3.168 2.392 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -1.916 -2.216 0.003 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -2.174 0.246 3.521 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -0.402 -0.558 -1.050 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -0.758 1.967 2.419 1.00 0.00 H new ATOM 0 HZ PHE A 50 0.220 1.516 0.174 1.00 0.00 H new ATOM 731 N ARG A 51 -4.985 -0.022 2.030 1.00 0.00 N ATOM 732 CA ARG A 51 -5.523 1.217 1.480 1.00 0.00 C ATOM 733 C ARG A 51 -5.126 2.353 2.402 1.00 0.00 C ATOM 734 O ARG A 51 -4.689 2.092 3.524 1.00 0.00 O ATOM 735 CB ARG A 51 -7.045 1.109 1.297 1.00 0.00 C ATOM 736 CG ARG A 51 -7.858 0.490 2.439 1.00 0.00 C ATOM 737 CD ARG A 51 -7.935 1.304 3.742 1.00 0.00 C ATOM 738 NE ARG A 51 -6.993 0.783 4.750 1.00 0.00 N ATOM 739 CZ ARG A 51 -7.232 0.538 6.045 1.00 0.00 C ATOM 740 NH1 ARG A 51 -8.403 0.805 6.602 1.00 0.00 N ATOM 741 NH2 ARG A 51 -6.277 0.012 6.797 1.00 0.00 N ATOM 0 H ARG A 51 -4.640 0.073 2.985 1.00 0.00 H new ATOM 0 HA ARG A 51 -5.112 1.412 0.490 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -7.433 2.111 1.114 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -7.234 0.525 0.396 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -8.874 0.319 2.082 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -7.433 -0.487 2.671 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -7.709 2.350 3.535 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -8.950 1.269 4.137 1.00 0.00 H new ATOM 0 HE ARG A 51 -6.047 0.586 4.422 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -9.154 1.209 6.042 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -8.554 0.607 7.591 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -5.367 -0.204 6.389 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -6.451 -0.177 7.784 1.00 0.00 H new ATOM 755 N ILE A 52 -5.353 3.591 1.976 1.00 0.00 N ATOM 756 CA ILE A 52 -5.098 4.767 2.794 1.00 0.00 C ATOM 757 C ILE A 52 -6.462 5.304 3.204 1.00 0.00 C ATOM 758 O ILE A 52 -7.080 6.037 2.445 1.00 0.00 O ATOM 759 CB ILE A 52 -4.255 5.804 2.022 1.00 0.00 C ATOM 760 CG1 ILE A 52 -2.895 5.271 1.528 1.00 0.00 C ATOM 761 CG2 ILE A 52 -3.974 6.976 2.972 1.00 0.00 C ATOM 762 CD1 ILE A 52 -2.446 5.919 0.216 1.00 0.00 C ATOM 0 H ILE A 52 -5.721 3.806 1.049 1.00 0.00 H new ATOM 0 HA ILE A 52 -4.511 4.525 3.680 1.00 0.00 H new ATOM 0 HB ILE A 52 -4.829 6.085 1.139 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -2.140 5.450 2.293 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -2.961 4.192 1.391 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -3.378 7.728 2.455 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -4.917 7.418 3.294 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -3.427 6.615 3.843 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -1.483 5.505 -0.083 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -3.184 5.718 -0.560 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -2.351 6.996 0.356 1.00 0.00 H new ATOM 774 N LEU A 53 -6.986 4.898 4.353 1.00 0.00 N ATOM 775 CA LEU A 53 -8.213 5.446 4.930 1.00 0.00 C ATOM 776 C LEU A 53 -8.035 6.964 5.068 1.00 0.00 C ATOM 777 O LEU A 53 -7.189 7.396 5.863 1.00 0.00 O ATOM 778 CB LEU A 53 -8.409 4.770 6.294 1.00 0.00 C ATOM 779 CG LEU A 53 -9.705 4.911 7.098 1.00 0.00 C ATOM 780 CD1 LEU A 53 -10.281 6.326 7.071 1.00 0.00 C ATOM 781 CD2 LEU A 53 -10.696 3.834 6.668 1.00 0.00 C ATOM 0 H LEU A 53 -6.564 4.165 4.923 1.00 0.00 H new ATOM 0 HA LEU A 53 -9.091 5.261 4.310 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -8.251 3.703 6.140 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -7.602 5.122 6.937 1.00 0.00 H new ATOM 0 HG LEU A 53 -9.475 4.748 8.151 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -11.198 6.357 7.659 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -9.556 7.022 7.492 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -10.501 6.610 6.042 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -11.617 3.937 7.242 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -10.916 3.945 5.606 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -10.264 2.849 6.848 1.00 0.00 H new ATOM 793 N LEU A 54 -8.809 7.758 4.320 1.00 0.00 N ATOM 794 CA LEU A 54 -8.832 9.210 4.477 1.00 0.00 C ATOM 795 C LEU A 54 -10.041 9.559 5.323 1.00 0.00 C ATOM 796 O LEU A 54 -11.182 9.343 4.917 1.00 0.00 O ATOM 797 CB LEU A 54 -8.821 10.003 3.154 1.00 0.00 C ATOM 798 CG LEU A 54 -7.572 9.891 2.251 1.00 0.00 C ATOM 799 CD1 LEU A 54 -6.274 9.774 3.054 1.00 0.00 C ATOM 800 CD2 LEU A 54 -7.687 8.753 1.235 1.00 0.00 C ATOM 0 H LEU A 54 -9.434 7.410 3.592 1.00 0.00 H new ATOM 0 HA LEU A 54 -7.904 9.509 4.965 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -9.685 9.688 2.569 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -8.965 11.056 3.395 1.00 0.00 H new ATOM 0 HG LEU A 54 -7.528 10.827 1.694 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -5.429 9.698 2.370 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -6.154 10.656 3.683 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -6.314 8.884 3.682 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -6.784 8.717 0.625 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -7.807 7.806 1.761 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -8.551 8.924 0.593 1.00 0.00 H new ATOM 812 N SER A 55 -9.787 10.057 6.526 1.00 0.00 N ATOM 813 CA SER A 55 -10.791 10.532 7.447 1.00 0.00 C ATOM 814 C SER A 55 -10.099 11.610 8.294 1.00 0.00 C ATOM 815 O SER A 55 -8.925 11.439 8.644 1.00 0.00 O ATOM 816 CB SER A 55 -11.276 9.332 8.277 1.00 0.00 C ATOM 817 OG SER A 55 -12.026 9.644 9.436 1.00 0.00 O ATOM 0 H SER A 55 -8.839 10.141 6.893 1.00 0.00 H new ATOM 0 HA SER A 55 -11.670 10.963 6.968 1.00 0.00 H new ATOM 0 HB2 SER A 55 -11.884 8.693 7.636 1.00 0.00 H new ATOM 0 HB3 SER A 55 -10.406 8.747 8.577 1.00 0.00 H new ATOM 0 HG SER A 55 -12.287 8.815 9.890 1.00 0.00 H new ATOM 823 N PRO A 56 -10.808 12.679 8.691 1.00 0.00 N ATOM 824 CA PRO A 56 -12.089 13.095 8.134 1.00 0.00 C ATOM 825 C PRO A 56 -11.903 13.702 6.735 1.00 0.00 C ATOM 826 O PRO A 56 -10.790 14.020 6.314 1.00 0.00 O ATOM 827 CB PRO A 56 -12.627 14.124 9.126 1.00 0.00 C ATOM 828 CG PRO A 56 -11.364 14.767 9.698 1.00 0.00 C ATOM 829 CD PRO A 56 -10.326 13.649 9.660 1.00 0.00 C ATOM 0 HA PRO A 56 -12.779 12.261 8.005 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -13.264 14.860 8.635 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -13.226 13.654 9.906 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -11.049 15.624 9.103 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -11.525 15.127 10.714 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -9.349 14.035 9.371 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -10.210 13.192 10.643 1.00 0.00 H new ATOM 837 N CYS A 57 -13.011 13.926 6.029 1.00 0.00 N ATOM 838 CA CYS A 57 -13.031 14.685 4.787 1.00 0.00 C ATOM 839 C CYS A 57 -14.114 15.760 4.851 1.00 0.00 C ATOM 840 O CYS A 57 -15.010 15.708 5.701 1.00 0.00 O ATOM 841 CB CYS A 57 -13.240 13.744 3.593 1.00 0.00 C ATOM 842 SG CYS A 57 -12.797 14.516 2.016 1.00 0.00 S ATOM 0 H CYS A 57 -13.928 13.580 6.310 1.00 0.00 H new ATOM 0 HA CYS A 57 -12.071 15.182 4.652 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -12.641 12.844 3.734 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -14.283 13.430 3.560 1.00 0.00 H new ATOM 847 N GLY A 58 -14.027 16.721 3.936 1.00 0.00 N ATOM 848 CA GLY A 58 -15.042 17.722 3.689 1.00 0.00 C ATOM 849 C GLY A 58 -16.108 17.204 2.732 1.00 0.00 C ATOM 850 O GLY A 58 -16.266 15.991 2.540 1.00 0.00 O ATOM 0 H GLY A 58 -13.215 16.822 3.327 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -15.506 18.013 4.631 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -14.580 18.617 3.272 1.00 0.00 H new ATOM 854 N ASN A 59 -16.872 18.141 2.167 1.00 0.00 N ATOM 855 CA ASN A 59 -18.082 17.860 1.407 1.00 0.00 C ATOM 856 C ASN A 59 -17.920 18.130 -0.097 1.00 0.00 C ATOM 857 O ASN A 59 -18.872 17.887 -0.841 1.00 0.00 O ATOM 858 CB ASN A 59 -19.258 18.654 2.009 1.00 0.00 C ATOM 859 CG ASN A 59 -20.588 17.906 1.987 1.00 0.00 C ATOM 860 OD1 ASN A 59 -21.219 17.736 3.027 1.00 0.00 O ATOM 861 ND2 ASN A 59 -21.054 17.425 0.851 1.00 0.00 N ATOM 0 H ASN A 59 -16.658 19.136 2.229 1.00 0.00 H new ATOM 0 HA ASN A 59 -18.291 16.793 1.487 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -19.017 18.915 3.039 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -19.370 19.589 1.461 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -21.936 16.913 0.838 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -20.532 17.565 -0.014 1.00 0.00 H new ATOM 868 N ALA A 60 -16.771 18.632 -0.569 1.00 0.00 N ATOM 869 CA ALA A 60 -16.605 19.154 -1.927 1.00 0.00 C ATOM 870 C ALA A 60 -15.310 18.620 -2.546 1.00 0.00 C ATOM 871 O ALA A 60 -14.258 19.260 -2.463 1.00 0.00 O ATOM 872 CB ALA A 60 -16.654 20.685 -1.882 1.00 0.00 C ATOM 0 H ALA A 60 -15.921 18.686 -0.008 1.00 0.00 H new ATOM 0 HA ALA A 60 -17.418 18.813 -2.568 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -16.531 21.083 -2.889 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -17.615 21.007 -1.480 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -15.851 21.056 -1.245 1.00 0.00 H new ATOM 878 N VAL A 61 -15.377 17.418 -3.126 1.00 0.00 N ATOM 879 CA VAL A 61 -14.217 16.670 -3.614 1.00 0.00 C ATOM 880 C VAL A 61 -14.532 15.857 -4.877 1.00 0.00 C ATOM 881 O VAL A 61 -15.697 15.577 -5.157 1.00 0.00 O ATOM 882 CB VAL A 61 -13.711 15.732 -2.501 1.00 0.00 C ATOM 883 CG1 VAL A 61 -12.828 16.473 -1.503 1.00 0.00 C ATOM 884 CG2 VAL A 61 -14.809 14.965 -1.754 1.00 0.00 C ATOM 0 H VAL A 61 -16.260 16.928 -3.272 1.00 0.00 H new ATOM 0 HA VAL A 61 -13.446 17.393 -3.882 1.00 0.00 H new ATOM 0 HB VAL A 61 -13.124 14.982 -3.030 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -12.489 15.780 -0.732 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -11.964 16.890 -2.021 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -13.398 17.279 -1.041 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -14.356 14.332 -0.991 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -15.490 15.673 -1.281 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -15.363 14.344 -2.458 1.00 0.00 H new ATOM 894 N SER A 62 -13.488 15.430 -5.600 1.00 0.00 N ATOM 895 CA SER A 62 -13.568 14.646 -6.829 1.00 0.00 C ATOM 896 C SER A 62 -12.408 13.631 -6.933 1.00 0.00 C ATOM 897 O SER A 62 -12.646 12.496 -7.355 1.00 0.00 O ATOM 898 CB SER A 62 -13.602 15.647 -7.998 1.00 0.00 C ATOM 899 OG SER A 62 -13.695 15.070 -9.282 1.00 0.00 O ATOM 0 H SER A 62 -12.526 15.633 -5.329 1.00 0.00 H new ATOM 0 HA SER A 62 -14.471 14.035 -6.846 1.00 0.00 H new ATOM 0 HB2 SER A 62 -14.450 16.317 -7.856 1.00 0.00 H new ATOM 0 HB3 SER A 62 -12.701 16.259 -7.957 1.00 0.00 H new ATOM 0 HG SER A 62 -13.712 15.779 -9.959 1.00 0.00 H new ATOM 905 N ALA A 63 -11.171 13.982 -6.536 1.00 0.00 N ATOM 906 CA ALA A 63 -9.984 13.120 -6.634 1.00 0.00 C ATOM 907 C ALA A 63 -8.850 13.582 -5.706 1.00 0.00 C ATOM 908 O ALA A 63 -8.653 14.780 -5.508 1.00 0.00 O ATOM 909 CB ALA A 63 -9.443 13.133 -8.070 1.00 0.00 C ATOM 0 H ALA A 63 -10.967 14.895 -6.129 1.00 0.00 H new ATOM 0 HA ALA A 63 -10.300 12.120 -6.338 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -8.564 12.492 -8.133 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -10.210 12.765 -8.751 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -9.170 14.151 -8.347 1.00 0.00 H new ATOM 915 N VAL A 64 -8.067 12.636 -5.186 1.00 0.00 N ATOM 916 CA VAL A 64 -6.702 12.837 -4.680 1.00 0.00 C ATOM 917 C VAL A 64 -5.706 12.612 -5.834 1.00 0.00 C ATOM 918 O VAL A 64 -6.063 12.043 -6.873 1.00 0.00 O ATOM 919 CB VAL A 64 -6.500 11.869 -3.481 1.00 0.00 C ATOM 920 CG1 VAL A 64 -5.136 11.196 -3.304 1.00 0.00 C ATOM 921 CG2 VAL A 64 -6.843 12.565 -2.164 1.00 0.00 C ATOM 0 H VAL A 64 -8.376 11.668 -5.101 1.00 0.00 H new ATOM 0 HA VAL A 64 -6.531 13.851 -4.320 1.00 0.00 H new ATOM 0 HB VAL A 64 -7.181 11.059 -3.742 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -5.159 10.553 -2.424 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -4.909 10.596 -4.185 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -4.368 11.959 -3.177 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -6.695 11.871 -1.337 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -6.195 13.432 -2.031 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -7.883 12.889 -2.184 1.00 0.00 H new ATOM 931 N LYS A 65 -4.440 12.998 -5.645 1.00 0.00 N ATOM 932 CA LYS A 65 -3.301 12.475 -6.397 1.00 0.00 C ATOM 933 C LYS A 65 -2.358 11.854 -5.375 1.00 0.00 C ATOM 934 O LYS A 65 -1.890 12.554 -4.478 1.00 0.00 O ATOM 935 CB LYS A 65 -2.569 13.575 -7.180 1.00 0.00 C ATOM 936 CG LYS A 65 -3.389 14.263 -8.277 1.00 0.00 C ATOM 937 CD LYS A 65 -4.379 15.321 -7.761 1.00 0.00 C ATOM 938 CE LYS A 65 -4.543 16.450 -8.782 1.00 0.00 C ATOM 939 NZ LYS A 65 -5.059 15.974 -10.080 1.00 0.00 N ATOM 0 H LYS A 65 -4.176 13.697 -4.950 1.00 0.00 H new ATOM 0 HA LYS A 65 -3.646 11.749 -7.133 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -2.230 14.334 -6.475 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -1.678 13.141 -7.635 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -2.705 14.736 -8.982 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -3.943 13.504 -8.830 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -5.346 14.857 -7.565 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -4.024 15.728 -6.815 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -5.222 17.202 -8.380 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -3.581 16.938 -8.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -5.215 16.786 -10.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -4.368 15.328 -10.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -5.958 15.472 -9.933 1.00 0.00 H new ATOM 953 N VAL A 66 -2.089 10.555 -5.470 1.00 0.00 N ATOM 954 CA VAL A 66 -1.197 9.891 -4.529 1.00 0.00 C ATOM 955 C VAL A 66 0.255 10.181 -4.915 1.00 0.00 C ATOM 956 O VAL A 66 0.563 10.453 -6.077 1.00 0.00 O ATOM 957 CB VAL A 66 -1.571 8.393 -4.438 1.00 0.00 C ATOM 958 CG1 VAL A 66 -1.506 7.638 -5.775 1.00 0.00 C ATOM 959 CG2 VAL A 66 -0.750 7.619 -3.395 1.00 0.00 C ATOM 0 H VAL A 66 -2.476 9.943 -6.189 1.00 0.00 H new ATOM 0 HA VAL A 66 -1.311 10.281 -3.517 1.00 0.00 H new ATOM 0 HB VAL A 66 -2.613 8.427 -4.120 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -1.783 6.596 -5.618 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -2.196 8.094 -6.484 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -0.492 7.688 -6.172 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -1.065 6.576 -3.385 1.00 0.00 H new ATOM 0 HG22 VAL A 66 0.308 7.676 -3.650 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -0.910 8.056 -2.409 1.00 0.00 H new ATOM 969 N GLY A 67 1.149 10.153 -3.928 1.00 0.00 N ATOM 970 CA GLY A 67 2.589 10.151 -4.116 1.00 0.00 C ATOM 971 C GLY A 67 3.219 9.212 -3.104 1.00 0.00 C ATOM 972 O GLY A 67 3.354 9.589 -1.942 1.00 0.00 O ATOM 0 H GLY A 67 0.876 10.130 -2.945 1.00 0.00 H new ATOM 0 HA2 GLY A 67 2.836 9.833 -5.129 1.00 0.00 H new ATOM 0 HA3 GLY A 67 2.986 11.159 -3.993 1.00 0.00 H new ATOM 976 N PHE A 68 3.563 7.991 -3.513 1.00 0.00 N ATOM 977 CA PHE A 68 4.358 7.079 -2.703 1.00 0.00 C ATOM 978 C PHE A 68 5.826 7.447 -2.891 1.00 0.00 C ATOM 979 O PHE A 68 6.366 7.315 -3.991 1.00 0.00 O ATOM 980 CB PHE A 68 4.074 5.627 -3.109 1.00 0.00 C ATOM 981 CG PHE A 68 2.786 5.086 -2.516 1.00 0.00 C ATOM 982 CD1 PHE A 68 2.705 4.864 -1.128 1.00 0.00 C ATOM 983 CD2 PHE A 68 1.675 4.804 -3.331 1.00 0.00 C ATOM 984 CE1 PHE A 68 1.530 4.347 -0.557 1.00 0.00 C ATOM 985 CE2 PHE A 68 0.505 4.264 -2.766 1.00 0.00 C ATOM 986 CZ PHE A 68 0.433 4.038 -1.380 1.00 0.00 C ATOM 0 H PHE A 68 3.295 7.609 -4.420 1.00 0.00 H new ATOM 0 HA PHE A 68 4.099 7.167 -1.648 1.00 0.00 H new ATOM 0 HB2 PHE A 68 4.022 5.563 -4.196 1.00 0.00 H new ATOM 0 HB3 PHE A 68 4.906 4.998 -2.792 1.00 0.00 H new ATOM 0 HD1 PHE A 68 3.552 5.093 -0.498 1.00 0.00 H new ATOM 0 HD2 PHE A 68 1.720 5.002 -4.392 1.00 0.00 H new ATOM 0 HE1 PHE A 68 1.470 4.188 0.509 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -0.338 4.023 -3.397 1.00 0.00 H new ATOM 0 HZ PHE A 68 -0.467 3.626 -0.947 1.00 0.00 H new ATOM 996 N THR A 69 6.483 7.937 -1.843 1.00 0.00 N ATOM 997 CA THR A 69 7.861 8.412 -1.903 1.00 0.00 C ATOM 998 C THR A 69 8.681 7.749 -0.799 1.00 0.00 C ATOM 999 O THR A 69 8.115 7.191 0.142 1.00 0.00 O ATOM 1000 CB THR A 69 7.852 9.951 -1.881 1.00 0.00 C ATOM 1001 OG1 THR A 69 7.323 10.494 -0.680 1.00 0.00 O ATOM 1002 CG2 THR A 69 7.019 10.456 -3.071 1.00 0.00 C ATOM 0 H THR A 69 6.066 8.016 -0.915 1.00 0.00 H new ATOM 0 HA THR A 69 8.354 8.126 -2.832 1.00 0.00 H new ATOM 0 HB THR A 69 8.889 10.281 -1.947 1.00 0.00 H new ATOM 0 HG1 THR A 69 7.346 11.473 -0.726 1.00 0.00 H new ATOM 0 HG21 THR A 69 7.004 11.546 -3.068 1.00 0.00 H new ATOM 0 HG22 THR A 69 7.462 10.102 -4.002 1.00 0.00 H new ATOM 0 HG23 THR A 69 6.000 10.079 -2.988 1.00 0.00 H new ATOM 1010 N GLY A 70 10.004 7.741 -0.919 1.00 0.00 N ATOM 1011 CA GLY A 70 10.879 6.983 -0.044 1.00 0.00 C ATOM 1012 C GLY A 70 12.074 6.458 -0.830 1.00 0.00 C ATOM 1013 O GLY A 70 12.195 6.716 -2.030 1.00 0.00 O ATOM 0 H GLY A 70 10.501 8.268 -1.637 1.00 0.00 H new ATOM 0 HA2 GLY A 70 11.222 7.614 0.776 1.00 0.00 H new ATOM 0 HA3 GLY A 70 10.332 6.152 0.400 1.00 0.00 H new ATOM 1017 N VAL A 71 12.951 5.728 -0.148 1.00 0.00 N ATOM 1018 CA VAL A 71 14.111 5.091 -0.746 1.00 0.00 C ATOM 1019 C VAL A 71 13.661 4.095 -1.826 1.00 0.00 C ATOM 1020 O VAL A 71 12.973 3.108 -1.543 1.00 0.00 O ATOM 1021 CB VAL A 71 15.009 4.492 0.362 1.00 0.00 C ATOM 1022 CG1 VAL A 71 14.297 3.517 1.317 1.00 0.00 C ATOM 1023 CG2 VAL A 71 16.274 3.859 -0.237 1.00 0.00 C ATOM 0 H VAL A 71 12.870 5.562 0.855 1.00 0.00 H new ATOM 0 HA VAL A 71 14.735 5.819 -1.265 1.00 0.00 H new ATOM 0 HB VAL A 71 15.292 5.339 0.987 1.00 0.00 H new ATOM 0 HG11 VAL A 71 15.007 3.150 2.058 1.00 0.00 H new ATOM 0 HG12 VAL A 71 13.480 4.033 1.821 1.00 0.00 H new ATOM 0 HG13 VAL A 71 13.899 2.676 0.749 1.00 0.00 H new ATOM 0 HG21 VAL A 71 16.888 3.445 0.563 1.00 0.00 H new ATOM 0 HG22 VAL A 71 15.991 3.063 -0.926 1.00 0.00 H new ATOM 0 HG23 VAL A 71 16.842 4.619 -0.774 1.00 0.00 H new ATOM 1033 N ALA A 72 14.079 4.340 -3.069 1.00 0.00 N ATOM 1034 CA ALA A 72 13.905 3.396 -4.162 1.00 0.00 C ATOM 1035 C ALA A 72 14.978 2.309 -4.059 1.00 0.00 C ATOM 1036 O ALA A 72 16.124 2.581 -3.673 1.00 0.00 O ATOM 1037 CB ALA A 72 14.038 4.124 -5.500 1.00 0.00 C ATOM 0 H ALA A 72 14.549 5.203 -3.342 1.00 0.00 H new ATOM 0 HA ALA A 72 12.915 2.943 -4.100 1.00 0.00 H new ATOM 0 HB1 ALA A 72 13.907 3.413 -6.316 1.00 0.00 H new ATOM 0 HB2 ALA A 72 13.276 4.900 -5.569 1.00 0.00 H new ATOM 0 HB3 ALA A 72 15.026 4.579 -5.570 1.00 0.00 H new ATOM 1043 N ASP A 73 14.608 1.076 -4.404 1.00 0.00 N ATOM 1044 CA ASP A 73 15.503 -0.076 -4.384 1.00 0.00 C ATOM 1045 C ASP A 73 16.638 0.087 -5.395 1.00 0.00 C ATOM 1046 O ASP A 73 16.471 0.695 -6.448 1.00 0.00 O ATOM 1047 CB ASP A 73 14.722 -1.368 -4.667 1.00 0.00 C ATOM 1048 CG ASP A 73 15.659 -2.574 -4.588 1.00 0.00 C ATOM 1049 OD1 ASP A 73 16.265 -2.796 -3.523 1.00 0.00 O ATOM 1050 OD2 ASP A 73 15.860 -3.299 -5.593 1.00 0.00 O ATOM 0 H ASP A 73 13.662 0.848 -4.710 1.00 0.00 H new ATOM 0 HA ASP A 73 15.943 -0.140 -3.389 1.00 0.00 H new ATOM 0 HB2 ASP A 73 13.912 -1.478 -3.946 1.00 0.00 H new ATOM 0 HB3 ASP A 73 14.264 -1.317 -5.655 1.00 0.00 H new ATOM 1055 N SER A 74 17.789 -0.514 -5.105 1.00 0.00 N ATOM 1056 CA SER A 74 18.950 -0.490 -5.985 1.00 0.00 C ATOM 1057 C SER A 74 18.645 -1.169 -7.325 1.00 0.00 C ATOM 1058 O SER A 74 19.164 -0.759 -8.360 1.00 0.00 O ATOM 1059 CB SER A 74 20.100 -1.192 -5.248 1.00 0.00 C ATOM 1060 OG SER A 74 21.345 -1.118 -5.907 1.00 0.00 O ATOM 0 H SER A 74 17.942 -1.037 -4.242 1.00 0.00 H new ATOM 0 HA SER A 74 19.227 0.538 -6.220 1.00 0.00 H new ATOM 0 HB2 SER A 74 20.201 -0.753 -4.256 1.00 0.00 H new ATOM 0 HB3 SER A 74 19.839 -2.241 -5.107 1.00 0.00 H new ATOM 0 HG SER A 74 22.024 -1.585 -5.377 1.00 0.00 H new ATOM 1066 N HIS A 75 17.850 -2.240 -7.316 1.00 0.00 N ATOM 1067 CA HIS A 75 17.841 -3.235 -8.380 1.00 0.00 C ATOM 1068 C HIS A 75 16.599 -3.069 -9.243 1.00 0.00 C ATOM 1069 O HIS A 75 16.724 -3.062 -10.463 1.00 0.00 O ATOM 1070 CB HIS A 75 17.971 -4.645 -7.788 1.00 0.00 C ATOM 1071 CG HIS A 75 18.810 -4.743 -6.533 1.00 0.00 C ATOM 1072 ND1 HIS A 75 18.317 -4.615 -5.245 1.00 0.00 N ATOM 1073 CD2 HIS A 75 20.158 -4.972 -6.459 1.00 0.00 C ATOM 1074 CE1 HIS A 75 19.348 -4.790 -4.401 1.00 0.00 C ATOM 1075 NE2 HIS A 75 20.474 -4.998 -5.112 1.00 0.00 N ATOM 0 H HIS A 75 17.191 -2.439 -6.563 1.00 0.00 H new ATOM 0 HA HIS A 75 18.702 -3.085 -9.031 1.00 0.00 H new ATOM 0 HB2 HIS A 75 16.972 -5.023 -7.568 1.00 0.00 H new ATOM 0 HB3 HIS A 75 18.401 -5.301 -8.545 1.00 0.00 H new ATOM 0 HD1 HIS A 75 17.350 -4.423 -4.985 1.00 0.00 H new ATOM 0 HD2 HIS A 75 20.839 -5.106 -7.287 1.00 0.00 H new ATOM 0 HE1 HIS A 75 19.284 -4.768 -3.323 1.00 0.00 H new ATOM 1084 N ASN A 76 15.420 -2.859 -8.651 1.00 0.00 N ATOM 1085 CA ASN A 76 14.216 -2.449 -9.377 1.00 0.00 C ATOM 1086 C ASN A 76 13.702 -1.193 -8.700 1.00 0.00 C ATOM 1087 O ASN A 76 12.894 -1.269 -7.778 1.00 0.00 O ATOM 1088 CB ASN A 76 13.184 -3.583 -9.508 1.00 0.00 C ATOM 1089 CG ASN A 76 13.033 -3.929 -10.978 1.00 0.00 C ATOM 1090 OD1 ASN A 76 12.087 -3.499 -11.630 1.00 0.00 O ATOM 1091 ND2 ASN A 76 13.990 -4.648 -11.535 1.00 0.00 N ATOM 0 H ASN A 76 15.274 -2.970 -7.648 1.00 0.00 H new ATOM 0 HA ASN A 76 14.444 -2.220 -10.418 1.00 0.00 H new ATOM 0 HB2 ASN A 76 13.509 -4.458 -8.944 1.00 0.00 H new ATOM 0 HB3 ASN A 76 12.226 -3.273 -9.091 1.00 0.00 H new ATOM 0 HD21 ASN A 76 13.955 -4.859 -12.532 1.00 0.00 H new ATOM 0 HD22 ASN A 76 14.765 -4.992 -10.968 1.00 0.00 H new ATOM 1098 N ALA A 77 14.225 -0.040 -9.128 1.00 0.00 N ATOM 1099 CA ALA A 77 14.056 1.247 -8.460 1.00 0.00 C ATOM 1100 C ALA A 77 12.610 1.759 -8.454 1.00 0.00 C ATOM 1101 O ALA A 77 12.326 2.806 -7.875 1.00 0.00 O ATOM 1102 CB ALA A 77 14.995 2.265 -9.116 1.00 0.00 C ATOM 0 H ALA A 77 14.793 0.022 -9.973 1.00 0.00 H new ATOM 0 HA ALA A 77 14.311 1.108 -7.409 1.00 0.00 H new ATOM 0 HB1 ALA A 77 14.881 3.233 -8.628 1.00 0.00 H new ATOM 0 HB2 ALA A 77 16.026 1.927 -9.014 1.00 0.00 H new ATOM 0 HB3 ALA A 77 14.747 2.360 -10.173 1.00 0.00 H new ATOM 1108 N ASN A 78 11.681 1.056 -9.095 1.00 0.00 N ATOM 1109 CA ASN A 78 10.255 1.310 -8.967 1.00 0.00 C ATOM 1110 C ASN A 78 9.795 1.025 -7.533 1.00 0.00 C ATOM 1111 O ASN A 78 8.842 1.652 -7.072 1.00 0.00 O ATOM 1112 CB ASN A 78 9.468 0.416 -9.941 1.00 0.00 C ATOM 1113 CG ASN A 78 9.875 0.617 -11.394 1.00 0.00 C ATOM 1114 OD1 ASN A 78 10.997 0.291 -11.777 1.00 0.00 O ATOM 1115 ND2 ASN A 78 8.991 1.136 -12.223 1.00 0.00 N ATOM 0 H ASN A 78 11.903 0.285 -9.725 1.00 0.00 H new ATOM 0 HA ASN A 78 10.067 2.357 -9.205 1.00 0.00 H new ATOM 0 HB2 ASN A 78 9.618 -0.629 -9.669 1.00 0.00 H new ATOM 0 HB3 ASN A 78 8.403 0.623 -9.836 1.00 0.00 H new ATOM 0 HD21 ASN A 78 9.232 1.274 -13.204 1.00 0.00 H new ATOM 0 HD22 ASN A 78 8.066 1.399 -11.883 1.00 0.00 H new ATOM 1122 N LEU A 79 10.435 0.060 -6.855 1.00 0.00 N ATOM 1123 CA LEU A 79 9.985 -0.537 -5.602 1.00 0.00 C ATOM 1124 C LEU A 79 10.723 0.055 -4.396 1.00 0.00 C ATOM 1125 O LEU A 79 11.752 0.716 -4.528 1.00 0.00 O ATOM 1126 CB LEU A 79 10.135 -2.075 -5.682 1.00 0.00 C ATOM 1127 CG LEU A 79 9.090 -2.859 -6.526 1.00 0.00 C ATOM 1128 CD1 LEU A 79 7.781 -2.102 -6.823 1.00 0.00 C ATOM 1129 CD2 LEU A 79 9.724 -3.320 -7.834 1.00 0.00 C ATOM 0 H LEU A 79 11.315 -0.337 -7.184 1.00 0.00 H new ATOM 0 HA LEU A 79 8.931 -0.301 -5.455 1.00 0.00 H new ATOM 0 HB2 LEU A 79 11.124 -2.295 -6.084 1.00 0.00 H new ATOM 0 HB3 LEU A 79 10.109 -2.468 -4.666 1.00 0.00 H new ATOM 0 HG LEU A 79 8.799 -3.706 -5.905 1.00 0.00 H new ATOM 0 HD11 LEU A 79 7.121 -2.735 -7.416 1.00 0.00 H new ATOM 0 HD12 LEU A 79 7.289 -1.844 -5.885 1.00 0.00 H new ATOM 0 HD13 LEU A 79 8.005 -1.191 -7.378 1.00 0.00 H new ATOM 0 HD21 LEU A 79 8.988 -3.869 -8.422 1.00 0.00 H new ATOM 0 HD22 LEU A 79 10.065 -2.452 -8.399 1.00 0.00 H new ATOM 0 HD23 LEU A 79 10.573 -3.969 -7.618 1.00 0.00 H new ATOM 1141 N LEU A 80 10.160 -0.165 -3.205 1.00 0.00 N ATOM 1142 CA LEU A 80 10.521 0.474 -1.936 1.00 0.00 C ATOM 1143 C LEU A 80 11.631 -0.349 -1.272 1.00 0.00 C ATOM 1144 O LEU A 80 11.427 -1.534 -1.007 1.00 0.00 O ATOM 1145 CB LEU A 80 9.245 0.518 -1.066 1.00 0.00 C ATOM 1146 CG LEU A 80 9.220 1.471 0.147 1.00 0.00 C ATOM 1147 CD1 LEU A 80 7.978 1.140 0.980 1.00 0.00 C ATOM 1148 CD2 LEU A 80 10.431 1.368 1.061 1.00 0.00 C ATOM 0 H LEU A 80 9.396 -0.832 -3.094 1.00 0.00 H new ATOM 0 HA LEU A 80 10.895 1.488 -2.076 1.00 0.00 H new ATOM 0 HB2 LEU A 80 8.410 0.783 -1.714 1.00 0.00 H new ATOM 0 HB3 LEU A 80 9.057 -0.491 -0.700 1.00 0.00 H new ATOM 0 HG LEU A 80 9.218 2.484 -0.256 1.00 0.00 H new ATOM 0 HD11 LEU A 80 7.934 1.800 1.846 1.00 0.00 H new ATOM 0 HD12 LEU A 80 7.084 1.280 0.372 1.00 0.00 H new ATOM 0 HD13 LEU A 80 8.030 0.104 1.315 1.00 0.00 H new ATOM 0 HD21 LEU A 80 10.326 2.074 1.885 1.00 0.00 H new ATOM 0 HD22 LEU A 80 10.502 0.355 1.458 1.00 0.00 H new ATOM 0 HD23 LEU A 80 11.334 1.601 0.496 1.00 0.00 H new ATOM 1160 N ALA A 81 12.805 0.232 -1.037 1.00 0.00 N ATOM 1161 CA ALA A 81 13.952 -0.455 -0.443 1.00 0.00 C ATOM 1162 C ALA A 81 13.751 -0.686 1.068 1.00 0.00 C ATOM 1163 O ALA A 81 13.044 0.084 1.709 1.00 0.00 O ATOM 1164 CB ALA A 81 15.199 0.392 -0.699 1.00 0.00 C ATOM 0 H ALA A 81 12.990 1.210 -1.257 1.00 0.00 H new ATOM 0 HA ALA A 81 14.063 -1.438 -0.901 1.00 0.00 H new ATOM 0 HB1 ALA A 81 16.069 -0.101 -0.265 1.00 0.00 H new ATOM 0 HB2 ALA A 81 15.346 0.508 -1.773 1.00 0.00 H new ATOM 0 HB3 ALA A 81 15.072 1.374 -0.242 1.00 0.00 H new ATOM 1170 N LEU A 82 14.385 -1.705 1.670 1.00 0.00 N ATOM 1171 CA LEU A 82 14.250 -1.961 3.114 1.00 0.00 C ATOM 1172 C LEU A 82 15.109 -1.000 3.934 1.00 0.00 C ATOM 1173 O LEU A 82 15.936 -0.281 3.372 1.00 0.00 O ATOM 1174 CB LEU A 82 14.656 -3.396 3.512 1.00 0.00 C ATOM 1175 CG LEU A 82 13.940 -4.574 2.848 1.00 0.00 C ATOM 1176 CD1 LEU A 82 12.434 -4.366 2.704 1.00 0.00 C ATOM 1177 CD2 LEU A 82 14.617 -4.955 1.531 1.00 0.00 C ATOM 0 H LEU A 82 14.994 -2.363 1.182 1.00 0.00 H new ATOM 0 HA LEU A 82 13.191 -1.815 3.329 1.00 0.00 H new ATOM 0 HB2 LEU A 82 15.723 -3.504 3.315 1.00 0.00 H new ATOM 0 HB3 LEU A 82 14.520 -3.491 4.589 1.00 0.00 H new ATOM 0 HG LEU A 82 14.038 -5.424 3.523 1.00 0.00 H new ATOM 0 HD11 LEU A 82 11.990 -5.239 2.226 1.00 0.00 H new ATOM 0 HD12 LEU A 82 11.990 -4.227 3.690 1.00 0.00 H new ATOM 0 HD13 LEU A 82 12.245 -3.483 2.094 1.00 0.00 H new ATOM 0 HD21 LEU A 82 14.088 -5.795 1.080 1.00 0.00 H new ATOM 0 HD22 LEU A 82 14.594 -4.104 0.851 1.00 0.00 H new ATOM 0 HD23 LEU A 82 15.652 -5.238 1.723 1.00 0.00 H new ATOM 1189 N GLU A 83 15.010 -1.132 5.266 1.00 0.00 N ATOM 1190 CA GLU A 83 15.794 -0.449 6.293 1.00 0.00 C ATOM 1191 C GLU A 83 17.323 -0.639 6.169 1.00 0.00 C ATOM 1192 O GLU A 83 18.053 -0.105 7.001 1.00 0.00 O ATOM 1193 CB GLU A 83 15.318 -0.863 7.705 1.00 0.00 C ATOM 1194 CG GLU A 83 15.626 -2.320 8.072 1.00 0.00 C ATOM 1195 CD GLU A 83 15.757 -2.564 9.588 1.00 0.00 C ATOM 1196 OE1 GLU A 83 16.457 -1.807 10.295 1.00 0.00 O ATOM 1197 OE2 GLU A 83 15.206 -3.568 10.103 1.00 0.00 O ATOM 0 H GLU A 83 14.327 -1.768 5.678 1.00 0.00 H new ATOM 0 HA GLU A 83 15.614 0.614 6.132 1.00 0.00 H new ATOM 0 HB2 GLU A 83 15.786 -0.208 8.440 1.00 0.00 H new ATOM 0 HB3 GLU A 83 14.242 -0.702 7.775 1.00 0.00 H new ATOM 0 HG2 GLU A 83 14.836 -2.959 7.677 1.00 0.00 H new ATOM 0 HG3 GLU A 83 16.553 -2.620 7.583 1.00 0.00 H new ATOM 1204 N ASN A 84 17.819 -1.382 5.167 1.00 0.00 N ATOM 1205 CA ASN A 84 19.226 -1.468 4.768 1.00 0.00 C ATOM 1206 C ASN A 84 20.124 -1.888 5.939 1.00 0.00 C ATOM 1207 O ASN A 84 21.113 -1.227 6.262 1.00 0.00 O ATOM 1208 CB ASN A 84 19.628 -0.118 4.145 1.00 0.00 C ATOM 1209 CG ASN A 84 21.081 -0.024 3.689 1.00 0.00 C ATOM 1210 OD1 ASN A 84 21.800 0.900 4.056 1.00 0.00 O ATOM 1211 ND2 ASN A 84 21.567 -0.956 2.891 1.00 0.00 N ATOM 0 H ASN A 84 17.217 -1.966 4.587 1.00 0.00 H new ATOM 0 HA ASN A 84 19.361 -2.251 4.021 1.00 0.00 H new ATOM 0 HB2 ASN A 84 18.981 0.077 3.289 1.00 0.00 H new ATOM 0 HB3 ASN A 84 19.440 0.671 4.873 1.00 0.00 H new ATOM 0 HD21 ASN A 84 22.538 -0.907 2.581 1.00 0.00 H new ATOM 0 HD22 ASN A 84 20.972 -1.726 2.584 1.00 0.00 H new ATOM 1218 N THR A 85 19.779 -2.987 6.608 1.00 0.00 N ATOM 1219 CA THR A 85 20.499 -3.430 7.791 1.00 0.00 C ATOM 1220 C THR A 85 20.429 -4.957 7.921 1.00 0.00 C ATOM 1221 O THR A 85 19.568 -5.617 7.338 1.00 0.00 O ATOM 1222 CB THR A 85 19.970 -2.613 9.000 1.00 0.00 C ATOM 1223 OG1 THR A 85 21.013 -1.785 9.474 1.00 0.00 O ATOM 1224 CG2 THR A 85 19.399 -3.406 10.177 1.00 0.00 C ATOM 0 H THR A 85 18.998 -3.588 6.345 1.00 0.00 H new ATOM 0 HA THR A 85 21.569 -3.231 7.730 1.00 0.00 H new ATOM 0 HB THR A 85 19.118 -2.059 8.607 1.00 0.00 H new ATOM 0 HG1 THR A 85 20.693 -1.261 10.238 1.00 0.00 H new ATOM 0 HG21 THR A 85 19.065 -2.717 10.953 1.00 0.00 H new ATOM 0 HG22 THR A 85 18.555 -4.005 9.837 1.00 0.00 H new ATOM 0 HG23 THR A 85 20.170 -4.062 10.582 1.00 0.00 H new ATOM 1232 N VAL A 86 21.354 -5.522 8.694 1.00 0.00 N ATOM 1233 CA VAL A 86 21.562 -6.950 8.911 1.00 0.00 C ATOM 1234 C VAL A 86 20.327 -7.639 9.515 1.00 0.00 C ATOM 1235 O VAL A 86 20.091 -8.833 9.307 1.00 0.00 O ATOM 1236 CB VAL A 86 22.826 -7.078 9.791 1.00 0.00 C ATOM 1237 CG1 VAL A 86 22.633 -6.482 11.199 1.00 0.00 C ATOM 1238 CG2 VAL A 86 23.333 -8.518 9.897 1.00 0.00 C ATOM 0 H VAL A 86 22.021 -4.957 9.219 1.00 0.00 H new ATOM 0 HA VAL A 86 21.711 -7.471 7.965 1.00 0.00 H new ATOM 0 HB VAL A 86 23.587 -6.491 9.277 1.00 0.00 H new ATOM 0 HG11 VAL A 86 23.552 -6.600 11.773 1.00 0.00 H new ATOM 0 HG12 VAL A 86 22.390 -5.423 11.116 1.00 0.00 H new ATOM 0 HG13 VAL A 86 21.820 -7.002 11.706 1.00 0.00 H new ATOM 0 HG21 VAL A 86 24.222 -8.545 10.527 1.00 0.00 H new ATOM 0 HG22 VAL A 86 22.557 -9.145 10.336 1.00 0.00 H new ATOM 0 HG23 VAL A 86 23.581 -8.890 8.903 1.00 0.00 H new ATOM 1248 N SER A 87 19.514 -6.905 10.274 1.00 0.00 N ATOM 1249 CA SER A 87 18.266 -7.395 10.838 1.00 0.00 C ATOM 1250 C SER A 87 17.188 -7.604 9.771 1.00 0.00 C ATOM 1251 O SER A 87 16.171 -8.241 10.050 1.00 0.00 O ATOM 1252 CB SER A 87 17.796 -6.382 11.885 1.00 0.00 C ATOM 1253 OG SER A 87 18.848 -6.096 12.783 1.00 0.00 O ATOM 0 H SER A 87 19.712 -5.934 10.516 1.00 0.00 H new ATOM 0 HA SER A 87 18.439 -8.371 11.292 1.00 0.00 H new ATOM 0 HB2 SER A 87 17.465 -5.466 11.395 1.00 0.00 H new ATOM 0 HB3 SER A 87 16.939 -6.779 12.429 1.00 0.00 H new ATOM 0 HG SER A 87 18.542 -5.446 13.449 1.00 0.00 H new ATOM 1259 N ALA A 88 17.377 -7.063 8.567 1.00 0.00 N ATOM 1260 CA ALA A 88 16.312 -6.874 7.609 1.00 0.00 C ATOM 1261 C ALA A 88 16.505 -7.725 6.374 1.00 0.00 C ATOM 1262 O ALA A 88 17.611 -8.164 6.063 1.00 0.00 O ATOM 1263 CB ALA A 88 16.236 -5.392 7.259 1.00 0.00 C ATOM 0 H ALA A 88 18.287 -6.744 8.236 1.00 0.00 H new ATOM 0 HA ALA A 88 15.370 -7.196 8.052 1.00 0.00 H new ATOM 0 HB1 ALA A 88 15.437 -5.229 6.536 1.00 0.00 H new ATOM 0 HB2 ALA A 88 16.032 -4.815 8.161 1.00 0.00 H new ATOM 0 HB3 ALA A 88 17.185 -5.070 6.829 1.00 0.00 H new ATOM 1269 N ALA A 89 15.398 -7.930 5.664 1.00 0.00 N ATOM 1270 CA ALA A 89 15.413 -8.569 4.368 1.00 0.00 C ATOM 1271 C ALA A 89 16.269 -7.738 3.404 1.00 0.00 C ATOM 1272 O ALA A 89 16.554 -6.561 3.645 1.00 0.00 O ATOM 1273 CB ALA A 89 13.971 -8.735 3.863 1.00 0.00 C ATOM 0 H ALA A 89 14.468 -7.654 5.979 1.00 0.00 H new ATOM 0 HA ALA A 89 15.856 -9.563 4.436 1.00 0.00 H new ATOM 0 HB1 ALA A 89 13.981 -9.217 2.885 1.00 0.00 H new ATOM 0 HB2 ALA A 89 13.408 -9.350 4.565 1.00 0.00 H new ATOM 0 HB3 ALA A 89 13.500 -7.756 3.780 1.00 0.00 H new ATOM 1279 N SER A 90 16.621 -8.340 2.276 1.00 0.00 N ATOM 1280 CA SER A 90 17.379 -7.710 1.219 1.00 0.00 C ATOM 1281 C SER A 90 16.950 -8.297 -0.109 1.00 0.00 C ATOM 1282 O SER A 90 16.404 -9.400 -0.175 1.00 0.00 O ATOM 1283 CB SER A 90 18.871 -7.940 1.447 1.00 0.00 C ATOM 1284 OG SER A 90 19.538 -6.703 1.455 1.00 0.00 O ATOM 0 H SER A 90 16.377 -9.309 2.071 1.00 0.00 H new ATOM 0 HA SER A 90 17.192 -6.636 1.215 1.00 0.00 H new ATOM 0 HB2 SER A 90 19.030 -8.458 2.393 1.00 0.00 H new ATOM 0 HB3 SER A 90 19.276 -8.579 0.662 1.00 0.00 H new ATOM 0 HG SER A 90 20.496 -6.849 1.603 1.00 0.00 H new ATOM 1290 N GLY A 91 17.201 -7.560 -1.185 1.00 0.00 N ATOM 1291 CA GLY A 91 16.732 -7.891 -2.518 1.00 0.00 C ATOM 1292 C GLY A 91 15.218 -8.111 -2.583 1.00 0.00 C ATOM 1293 O GLY A 91 14.754 -8.772 -3.508 1.00 0.00 O ATOM 0 H GLY A 91 17.747 -6.699 -1.150 1.00 0.00 H new ATOM 0 HA2 GLY A 91 17.007 -7.089 -3.203 1.00 0.00 H new ATOM 0 HA3 GLY A 91 17.239 -8.792 -2.862 1.00 0.00 H new ATOM 1297 N LEU A 92 14.456 -7.601 -1.609 1.00 0.00 N ATOM 1298 CA LEU A 92 13.021 -7.791 -1.433 1.00 0.00 C ATOM 1299 C LEU A 92 12.420 -6.415 -1.199 1.00 0.00 C ATOM 1300 O LEU A 92 12.160 -6.045 -0.058 1.00 0.00 O ATOM 1301 CB LEU A 92 12.729 -8.712 -0.228 1.00 0.00 C ATOM 1302 CG LEU A 92 13.129 -10.177 -0.388 1.00 0.00 C ATOM 1303 CD1 LEU A 92 12.772 -10.996 0.848 1.00 0.00 C ATOM 1304 CD2 LEU A 92 12.449 -10.873 -1.547 1.00 0.00 C ATOM 0 H LEU A 92 14.854 -7.009 -0.880 1.00 0.00 H new ATOM 0 HA LEU A 92 12.589 -8.267 -2.313 1.00 0.00 H new ATOM 0 HB2 LEU A 92 13.244 -8.309 0.644 1.00 0.00 H new ATOM 0 HB3 LEU A 92 11.661 -8.670 -0.015 1.00 0.00 H new ATOM 0 HG LEU A 92 14.205 -10.134 -0.558 1.00 0.00 H new ATOM 0 HD11 LEU A 92 13.072 -12.033 0.696 1.00 0.00 H new ATOM 0 HD12 LEU A 92 13.293 -10.591 1.716 1.00 0.00 H new ATOM 0 HD13 LEU A 92 11.696 -10.950 1.016 1.00 0.00 H new ATOM 0 HD21 LEU A 92 12.783 -11.909 -1.596 1.00 0.00 H new ATOM 0 HD22 LEU A 92 11.369 -10.847 -1.404 1.00 0.00 H new ATOM 0 HD23 LEU A 92 12.704 -10.365 -2.477 1.00 0.00 H new ATOM 1316 N GLY A 93 12.266 -5.615 -2.249 1.00 0.00 N ATOM 1317 CA GLY A 93 11.652 -4.310 -2.081 1.00 0.00 C ATOM 1318 C GLY A 93 10.141 -4.485 -1.945 1.00 0.00 C ATOM 1319 O GLY A 93 9.551 -5.422 -2.505 1.00 0.00 O ATOM 0 H GLY A 93 12.551 -5.842 -3.202 1.00 0.00 H new ATOM 0 HA2 GLY A 93 12.055 -3.815 -1.197 1.00 0.00 H new ATOM 0 HA3 GLY A 93 11.882 -3.673 -2.935 1.00 0.00 H new ATOM 1323 N ILE A 94 9.491 -3.583 -1.220 1.00 0.00 N ATOM 1324 CA ILE A 94 8.051 -3.640 -1.041 1.00 0.00 C ATOM 1325 C ILE A 94 7.401 -3.110 -2.321 1.00 0.00 C ATOM 1326 O ILE A 94 7.893 -2.154 -2.932 1.00 0.00 O ATOM 1327 CB ILE A 94 7.573 -2.877 0.216 1.00 0.00 C ATOM 1328 CG1 ILE A 94 8.573 -2.777 1.390 1.00 0.00 C ATOM 1329 CG2 ILE A 94 6.276 -3.536 0.707 1.00 0.00 C ATOM 1330 CD1 ILE A 94 9.040 -4.112 1.977 1.00 0.00 C ATOM 0 H ILE A 94 9.943 -2.801 -0.746 1.00 0.00 H new ATOM 0 HA ILE A 94 7.748 -4.673 -0.869 1.00 0.00 H new ATOM 0 HB ILE A 94 7.439 -1.844 -0.105 1.00 0.00 H new ATOM 0 HG12 ILE A 94 9.449 -2.223 1.052 1.00 0.00 H new ATOM 0 HG13 ILE A 94 8.114 -2.191 2.186 1.00 0.00 H new ATOM 0 HG21 ILE A 94 5.917 -3.016 1.595 1.00 0.00 H new ATOM 0 HG22 ILE A 94 5.520 -3.480 -0.077 1.00 0.00 H new ATOM 0 HG23 ILE A 94 6.469 -4.581 0.952 1.00 0.00 H new ATOM 0 HD11 ILE A 94 9.738 -3.926 2.793 1.00 0.00 H new ATOM 0 HD12 ILE A 94 8.179 -4.665 2.354 1.00 0.00 H new ATOM 0 HD13 ILE A 94 9.535 -4.697 1.202 1.00 0.00 H new ATOM 1342 N GLN A 95 6.286 -3.725 -2.703 1.00 0.00 N ATOM 1343 CA GLN A 95 5.588 -3.504 -3.956 1.00 0.00 C ATOM 1344 C GLN A 95 4.135 -3.154 -3.614 1.00 0.00 C ATOM 1345 O GLN A 95 3.391 -4.025 -3.152 1.00 0.00 O ATOM 1346 CB GLN A 95 5.816 -4.757 -4.836 1.00 0.00 C ATOM 1347 CG GLN A 95 4.860 -4.867 -6.021 1.00 0.00 C ATOM 1348 CD GLN A 95 5.432 -5.510 -7.286 1.00 0.00 C ATOM 1349 OE1 GLN A 95 6.322 -4.975 -7.934 1.00 0.00 O ATOM 1350 NE2 GLN A 95 4.898 -6.639 -7.720 1.00 0.00 N ATOM 0 H GLN A 95 5.827 -4.422 -2.117 1.00 0.00 H new ATOM 0 HA GLN A 95 5.953 -2.665 -4.548 1.00 0.00 H new ATOM 0 HB2 GLN A 95 6.840 -4.745 -5.209 1.00 0.00 H new ATOM 0 HB3 GLN A 95 5.713 -5.647 -4.216 1.00 0.00 H new ATOM 0 HG2 GLN A 95 3.989 -5.442 -5.707 1.00 0.00 H new ATOM 0 HG3 GLN A 95 4.508 -3.867 -6.273 1.00 0.00 H new ATOM 0 HE21 GLN A 95 4.156 -7.091 -7.185 1.00 0.00 H new ATOM 0 HE22 GLN A 95 5.228 -7.058 -8.589 1.00 0.00 H new ATOM 1359 N LEU A 96 3.755 -1.872 -3.756 1.00 0.00 N ATOM 1360 CA LEU A 96 2.493 -1.295 -3.271 1.00 0.00 C ATOM 1361 C LEU A 96 1.695 -0.700 -4.422 1.00 0.00 C ATOM 1362 O LEU A 96 1.520 0.512 -4.559 1.00 0.00 O ATOM 1363 CB LEU A 96 2.709 -0.195 -2.193 1.00 0.00 C ATOM 1364 CG LEU A 96 3.532 -0.468 -0.924 1.00 0.00 C ATOM 1365 CD1 LEU A 96 3.283 -1.834 -0.330 1.00 0.00 C ATOM 1366 CD2 LEU A 96 5.033 -0.240 -1.102 1.00 0.00 C ATOM 0 H LEU A 96 4.342 -1.185 -4.230 1.00 0.00 H new ATOM 0 HA LEU A 96 1.942 -2.117 -2.813 1.00 0.00 H new ATOM 0 HB2 LEU A 96 3.172 0.654 -2.695 1.00 0.00 H new ATOM 0 HB3 LEU A 96 1.720 0.128 -1.867 1.00 0.00 H new ATOM 0 HG LEU A 96 3.169 0.277 -0.216 1.00 0.00 H new ATOM 0 HD11 LEU A 96 3.896 -1.960 0.563 1.00 0.00 H new ATOM 0 HD12 LEU A 96 2.230 -1.929 -0.064 1.00 0.00 H new ATOM 0 HD13 LEU A 96 3.543 -2.601 -1.060 1.00 0.00 H new ATOM 0 HD21 LEU A 96 5.547 -0.453 -0.165 1.00 0.00 H new ATOM 0 HD22 LEU A 96 5.412 -0.901 -1.882 1.00 0.00 H new ATOM 0 HD23 LEU A 96 5.212 0.797 -1.387 1.00 0.00 H new ATOM 1378 N LEU A 97 1.150 -1.596 -5.224 1.00 0.00 N ATOM 1379 CA LEU A 97 0.495 -1.285 -6.472 1.00 0.00 C ATOM 1380 C LEU A 97 -0.919 -0.760 -6.233 1.00 0.00 C ATOM 1381 O LEU A 97 -1.486 -0.860 -5.139 1.00 0.00 O ATOM 1382 CB LEU A 97 0.482 -2.532 -7.383 1.00 0.00 C ATOM 1383 CG LEU A 97 0.431 -3.947 -6.801 1.00 0.00 C ATOM 1384 CD1 LEU A 97 1.769 -4.474 -6.348 1.00 0.00 C ATOM 1385 CD2 LEU A 97 -0.652 -4.218 -5.777 1.00 0.00 C ATOM 0 H LEU A 97 1.154 -2.594 -5.013 1.00 0.00 H new ATOM 0 HA LEU A 97 1.054 -0.495 -6.974 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -0.377 -2.431 -8.046 1.00 0.00 H new ATOM 0 HB3 LEU A 97 1.374 -2.478 -8.007 1.00 0.00 H new ATOM 0 HG LEU A 97 0.130 -4.526 -7.674 1.00 0.00 H new ATOM 0 HD11 LEU A 97 1.647 -5.481 -5.949 1.00 0.00 H new ATOM 0 HD12 LEU A 97 2.455 -4.500 -7.194 1.00 0.00 H new ATOM 0 HD13 LEU A 97 2.173 -3.823 -5.573 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -0.584 -5.253 -5.441 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -0.523 -3.550 -4.925 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -1.630 -4.046 -6.227 1.00 0.00 H new ATOM 1397 N ASN A 98 -1.509 -0.243 -7.310 1.00 0.00 N ATOM 1398 CA ASN A 98 -2.921 0.120 -7.338 1.00 0.00 C ATOM 1399 C ASN A 98 -3.753 -1.153 -7.510 1.00 0.00 C ATOM 1400 O ASN A 98 -3.208 -2.244 -7.664 1.00 0.00 O ATOM 1401 CB ASN A 98 -3.231 1.100 -8.494 1.00 0.00 C ATOM 1402 CG ASN A 98 -3.210 0.531 -9.902 1.00 0.00 C ATOM 1403 OD1 ASN A 98 -2.493 -0.545 -10.145 1.00 0.00 O flip ATOM 1404 ND2 ASN A 98 -3.864 1.063 -10.790 1.00 0.00 N flip ATOM 0 H ASN A 98 -1.019 -0.065 -8.187 1.00 0.00 H new ATOM 0 HA ASN A 98 -3.171 0.618 -6.401 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -4.216 1.532 -8.317 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -2.511 1.917 -8.448 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -4.415 1.897 -10.588 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -3.857 0.672 -11.732 1.00 0.00 H new ATOM 1411 N GLU A 99 -5.069 -0.985 -7.541 1.00 0.00 N ATOM 1412 CA GLU A 99 -6.097 -2.010 -7.693 1.00 0.00 C ATOM 1413 C GLU A 99 -5.798 -2.960 -8.859 1.00 0.00 C ATOM 1414 O GLU A 99 -5.901 -4.170 -8.704 1.00 0.00 O ATOM 1415 CB GLU A 99 -7.417 -1.244 -7.844 1.00 0.00 C ATOM 1416 CG GLU A 99 -8.641 -2.063 -8.245 1.00 0.00 C ATOM 1417 CD GLU A 99 -9.124 -1.650 -9.631 1.00 0.00 C ATOM 1418 OE1 GLU A 99 -9.914 -0.682 -9.728 1.00 0.00 O ATOM 1419 OE2 GLU A 99 -8.656 -2.195 -10.648 1.00 0.00 O ATOM 0 H GLU A 99 -5.479 -0.055 -7.454 1.00 0.00 H new ATOM 0 HA GLU A 99 -6.141 -2.675 -6.831 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -7.634 -0.749 -6.897 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -7.273 -0.460 -8.588 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -8.394 -3.125 -8.240 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -9.439 -1.918 -7.516 1.00 0.00 H new ATOM 1426 N GLN A 100 -5.312 -2.427 -9.982 1.00 0.00 N ATOM 1427 CA GLN A 100 -4.929 -3.170 -11.186 1.00 0.00 C ATOM 1428 C GLN A 100 -3.682 -4.038 -10.997 1.00 0.00 C ATOM 1429 O GLN A 100 -3.166 -4.591 -11.969 1.00 0.00 O ATOM 1430 CB GLN A 100 -4.669 -2.158 -12.309 1.00 0.00 C ATOM 1431 CG GLN A 100 -5.963 -1.473 -12.707 1.00 0.00 C ATOM 1432 CD GLN A 100 -5.696 -0.389 -13.742 1.00 0.00 C ATOM 1433 OE1 GLN A 100 -5.205 0.762 -13.307 1.00 0.00 O flip ATOM 1434 NE2 GLN A 100 -5.836 -0.601 -14.942 1.00 0.00 N flip ATOM 0 H GLN A 100 -5.168 -1.422 -10.082 1.00 0.00 H new ATOM 0 HA GLN A 100 -5.747 -3.849 -11.427 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -3.943 -1.415 -11.978 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -4.237 -2.664 -13.172 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -6.660 -2.207 -13.112 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -6.435 -1.036 -11.827 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -6.215 -1.492 -15.262 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -5.573 0.114 -15.620 1.00 0.00 H new ATOM 1443 N GLN A 101 -3.150 -4.111 -9.778 1.00 0.00 N ATOM 1444 CA GLN A 101 -1.979 -4.879 -9.393 1.00 0.00 C ATOM 1445 C GLN A 101 -0.763 -4.498 -10.248 1.00 0.00 C ATOM 1446 O GLN A 101 0.108 -5.327 -10.521 1.00 0.00 O ATOM 1447 CB GLN A 101 -2.298 -6.385 -9.380 1.00 0.00 C ATOM 1448 CG GLN A 101 -3.640 -6.675 -8.679 1.00 0.00 C ATOM 1449 CD GLN A 101 -3.904 -8.168 -8.480 1.00 0.00 C ATOM 1450 OE1 GLN A 101 -3.217 -8.850 -7.720 1.00 0.00 O ATOM 1451 NE2 GLN A 101 -4.936 -8.701 -9.105 1.00 0.00 N ATOM 0 H GLN A 101 -3.553 -3.604 -8.990 1.00 0.00 H new ATOM 0 HA GLN A 101 -1.701 -4.626 -8.370 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -2.333 -6.759 -10.403 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -1.498 -6.923 -8.872 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -3.651 -6.178 -7.709 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -4.450 -6.244 -9.267 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -5.502 -8.131 -9.734 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -5.168 -9.683 -8.960 1.00 0.00 H new ATOM 1460 N ASN A 102 -0.721 -3.242 -10.693 1.00 0.00 N ATOM 1461 CA ASN A 102 0.233 -2.691 -11.635 1.00 0.00 C ATOM 1462 C ASN A 102 1.250 -1.851 -10.874 1.00 0.00 C ATOM 1463 O ASN A 102 0.854 -1.117 -9.968 1.00 0.00 O ATOM 1464 CB ASN A 102 -0.474 -1.808 -12.679 1.00 0.00 C ATOM 1465 CG ASN A 102 0.529 -1.416 -13.757 1.00 0.00 C ATOM 1466 OD1 ASN A 102 0.712 -0.249 -14.084 1.00 0.00 O ATOM 1467 ND2 ASN A 102 1.252 -2.382 -14.291 1.00 0.00 N ATOM 0 H ASN A 102 -1.397 -2.545 -10.381 1.00 0.00 H new ATOM 0 HA ASN A 102 0.728 -3.512 -12.154 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -1.312 -2.346 -13.122 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -0.883 -0.917 -12.203 1.00 0.00 H new ATOM 0 HD21 ASN A 102 1.969 -2.160 -14.981 1.00 0.00 H new ATOM 0 HD22 ASN A 102 1.094 -3.351 -14.013 1.00 0.00 H new ATOM 1474 N GLN A 103 2.529 -1.999 -11.217 1.00 0.00 N ATOM 1475 CA GLN A 103 3.677 -1.475 -10.490 1.00 0.00 C ATOM 1476 C GLN A 103 3.601 0.050 -10.315 1.00 0.00 C ATOM 1477 O GLN A 103 3.904 0.786 -11.252 1.00 0.00 O ATOM 1478 CB GLN A 103 4.959 -1.936 -11.213 1.00 0.00 C ATOM 1479 CG GLN A 103 6.255 -1.503 -10.520 1.00 0.00 C ATOM 1480 CD GLN A 103 7.472 -2.242 -11.081 1.00 0.00 C ATOM 1481 OE1 GLN A 103 8.092 -1.841 -12.057 1.00 0.00 O ATOM 1482 NE2 GLN A 103 7.871 -3.342 -10.469 1.00 0.00 N ATOM 0 H GLN A 103 2.803 -2.515 -12.053 1.00 0.00 H new ATOM 0 HA GLN A 103 3.685 -1.872 -9.475 1.00 0.00 H new ATOM 0 HB2 GLN A 103 4.948 -3.023 -11.293 1.00 0.00 H new ATOM 0 HB3 GLN A 103 4.953 -1.541 -12.229 1.00 0.00 H new ATOM 0 HG2 GLN A 103 6.393 -0.429 -10.644 1.00 0.00 H new ATOM 0 HG3 GLN A 103 6.176 -1.693 -9.450 1.00 0.00 H new ATOM 0 HE21 GLN A 103 7.362 -3.686 -9.655 1.00 0.00 H new ATOM 0 HE22 GLN A 103 8.688 -3.848 -10.811 1.00 0.00 H new ATOM 1491 N ILE A 104 3.242 0.520 -9.115 1.00 0.00 N ATOM 1492 CA ILE A 104 3.307 1.934 -8.747 1.00 0.00 C ATOM 1493 C ILE A 104 4.791 2.335 -8.618 1.00 0.00 C ATOM 1494 O ILE A 104 5.505 1.708 -7.827 1.00 0.00 O ATOM 1495 CB ILE A 104 2.461 2.198 -7.470 1.00 0.00 C ATOM 1496 CG1 ILE A 104 1.033 2.587 -7.927 1.00 0.00 C ATOM 1497 CG2 ILE A 104 3.027 3.254 -6.499 1.00 0.00 C ATOM 1498 CD1 ILE A 104 0.054 2.980 -6.815 1.00 0.00 C ATOM 0 H ILE A 104 2.895 -0.079 -8.366 1.00 0.00 H new ATOM 0 HA ILE A 104 2.867 2.567 -9.517 1.00 0.00 H new ATOM 0 HB ILE A 104 2.474 1.278 -6.885 1.00 0.00 H new ATOM 0 HG12 ILE A 104 1.111 3.420 -8.626 1.00 0.00 H new ATOM 0 HG13 ILE A 104 0.608 1.748 -8.478 1.00 0.00 H new ATOM 0 HG21 ILE A 104 2.358 3.358 -5.645 1.00 0.00 H new ATOM 0 HG22 ILE A 104 4.012 2.939 -6.153 1.00 0.00 H new ATOM 0 HG23 ILE A 104 3.112 4.212 -7.012 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -0.912 3.232 -7.253 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -0.067 2.145 -6.125 1.00 0.00 H new ATOM 0 HD13 ILE A 104 0.444 3.843 -6.275 1.00 0.00 H new ATOM 1510 N PRO A 105 5.274 3.343 -9.368 1.00 0.00 N ATOM 1511 CA PRO A 105 6.633 3.862 -9.266 1.00 0.00 C ATOM 1512 C PRO A 105 6.790 4.893 -8.126 1.00 0.00 C ATOM 1513 O PRO A 105 6.085 5.908 -8.073 1.00 0.00 O ATOM 1514 CB PRO A 105 6.898 4.477 -10.645 1.00 0.00 C ATOM 1515 CG PRO A 105 5.526 4.943 -11.134 1.00 0.00 C ATOM 1516 CD PRO A 105 4.556 3.988 -10.460 1.00 0.00 C ATOM 0 HA PRO A 105 7.352 3.083 -9.013 1.00 0.00 H new ATOM 0 HB2 PRO A 105 7.598 5.310 -10.579 1.00 0.00 H new ATOM 0 HB3 PRO A 105 7.334 3.747 -11.327 1.00 0.00 H new ATOM 0 HG2 PRO A 105 5.331 5.977 -10.851 1.00 0.00 H new ATOM 0 HG3 PRO A 105 5.449 4.890 -12.220 1.00 0.00 H new ATOM 0 HD2 PRO A 105 3.686 4.526 -10.084 1.00 0.00 H new ATOM 0 HD3 PRO A 105 4.190 3.247 -11.170 1.00 0.00 H new ATOM 1524 N LEU A 106 7.758 4.665 -7.231 1.00 0.00 N ATOM 1525 CA LEU A 106 8.170 5.614 -6.188 1.00 0.00 C ATOM 1526 C LEU A 106 8.640 6.938 -6.785 1.00 0.00 C ATOM 1527 O LEU A 106 9.349 6.956 -7.798 1.00 0.00 O ATOM 1528 CB LEU A 106 9.314 5.004 -5.347 1.00 0.00 C ATOM 1529 CG LEU A 106 8.875 4.540 -3.950 1.00 0.00 C ATOM 1530 CD1 LEU A 106 7.810 3.439 -4.005 1.00 0.00 C ATOM 1531 CD2 LEU A 106 10.093 4.009 -3.191 1.00 0.00 C ATOM 0 H LEU A 106 8.290 3.795 -7.211 1.00 0.00 H new ATOM 0 HA LEU A 106 7.302 5.810 -5.558 1.00 0.00 H new ATOM 0 HB2 LEU A 106 9.736 4.156 -5.886 1.00 0.00 H new ATOM 0 HB3 LEU A 106 10.109 5.742 -5.242 1.00 0.00 H new ATOM 0 HG LEU A 106 8.439 5.401 -3.443 1.00 0.00 H new ATOM 0 HD11 LEU A 106 7.535 3.148 -2.991 1.00 0.00 H new ATOM 0 HD12 LEU A 106 6.929 3.811 -4.527 1.00 0.00 H new ATOM 0 HD13 LEU A 106 8.208 2.574 -4.536 1.00 0.00 H new ATOM 0 HD21 LEU A 106 9.787 3.678 -2.198 1.00 0.00 H new ATOM 0 HD22 LEU A 106 10.524 3.170 -3.737 1.00 0.00 H new ATOM 0 HD23 LEU A 106 10.836 4.801 -3.097 1.00 0.00 H new ATOM 1543 N ASN A 107 8.346 8.035 -6.076 1.00 0.00 N ATOM 1544 CA ASN A 107 8.767 9.415 -6.363 1.00 0.00 C ATOM 1545 C ASN A 107 8.315 9.956 -7.729 1.00 0.00 C ATOM 1546 O ASN A 107 8.730 11.056 -8.109 1.00 0.00 O ATOM 1547 CB ASN A 107 10.284 9.579 -6.130 1.00 0.00 C ATOM 1548 CG ASN A 107 10.651 9.623 -4.660 1.00 0.00 C ATOM 1549 OD1 ASN A 107 10.215 10.519 -3.949 1.00 0.00 O ATOM 1550 ND2 ASN A 107 11.451 8.694 -4.173 1.00 0.00 N ATOM 0 H ASN A 107 7.772 7.981 -5.234 1.00 0.00 H new ATOM 0 HA ASN A 107 8.237 10.046 -5.649 1.00 0.00 H new ATOM 0 HB2 ASN A 107 10.812 8.753 -6.607 1.00 0.00 H new ATOM 0 HB3 ASN A 107 10.624 10.495 -6.612 1.00 0.00 H new ATOM 0 HD21 ASN A 107 11.716 8.714 -3.188 1.00 0.00 H new ATOM 0 HD22 ASN A 107 11.804 7.955 -4.781 1.00 0.00 H new ATOM 1557 N ALA A 108 7.463 9.227 -8.457 1.00 0.00 N ATOM 1558 CA ALA A 108 7.017 9.569 -9.801 1.00 0.00 C ATOM 1559 C ALA A 108 6.143 10.833 -9.826 1.00 0.00 C ATOM 1560 O ALA A 108 5.533 11.168 -8.804 1.00 0.00 O ATOM 1561 CB ALA A 108 6.222 8.385 -10.351 1.00 0.00 C ATOM 0 H ALA A 108 7.056 8.358 -8.112 1.00 0.00 H new ATOM 0 HA ALA A 108 7.894 9.779 -10.413 1.00 0.00 H new ATOM 0 HB1 ALA A 108 5.876 8.616 -11.358 1.00 0.00 H new ATOM 0 HB2 ALA A 108 6.859 7.501 -10.380 1.00 0.00 H new ATOM 0 HB3 ALA A 108 5.363 8.193 -9.707 1.00 0.00 H new ATOM 1567 N PRO A 109 6.026 11.519 -10.977 1.00 0.00 N ATOM 1568 CA PRO A 109 5.122 12.646 -11.162 1.00 0.00 C ATOM 1569 C PRO A 109 3.662 12.193 -11.230 1.00 0.00 C ATOM 1570 O PRO A 109 3.366 11.031 -11.523 1.00 0.00 O ATOM 1571 CB PRO A 109 5.510 13.310 -12.487 1.00 0.00 C ATOM 1572 CG PRO A 109 6.719 12.527 -12.981 1.00 0.00 C ATOM 1573 CD PRO A 109 6.624 11.193 -12.254 1.00 0.00 C ATOM 0 HA PRO A 109 5.208 13.332 -10.319 1.00 0.00 H new ATOM 0 HB2 PRO A 109 4.691 13.266 -13.205 1.00 0.00 H new ATOM 0 HB3 PRO A 109 5.753 14.363 -12.345 1.00 0.00 H new ATOM 0 HG2 PRO A 109 6.692 12.394 -14.062 1.00 0.00 H new ATOM 0 HG3 PRO A 109 7.650 13.043 -12.746 1.00 0.00 H new ATOM 0 HD2 PRO A 109 6.013 10.481 -12.809 1.00 0.00 H new ATOM 0 HD3 PRO A 109 7.607 10.739 -12.128 1.00 0.00 H new ATOM 1581 N SER A 110 2.767 13.168 -11.082 1.00 0.00 N ATOM 1582 CA SER A 110 1.328 13.032 -10.916 1.00 0.00 C ATOM 1583 C SER A 110 0.571 12.240 -11.994 1.00 0.00 C ATOM 1584 O SER A 110 -0.609 11.968 -11.776 1.00 0.00 O ATOM 1585 CB SER A 110 0.774 14.464 -10.850 1.00 0.00 C ATOM 1586 OG SER A 110 -0.601 14.538 -10.529 1.00 0.00 O ATOM 0 H SER A 110 3.055 14.147 -11.075 1.00 0.00 H new ATOM 0 HA SER A 110 1.169 12.438 -10.016 1.00 0.00 H new ATOM 0 HB2 SER A 110 1.340 15.027 -10.108 1.00 0.00 H new ATOM 0 HB3 SER A 110 0.938 14.950 -11.812 1.00 0.00 H new ATOM 0 HG SER A 110 -1.037 13.691 -10.761 1.00 0.00 H new ATOM 1592 N SER A 111 1.159 11.917 -13.148 1.00 0.00 N ATOM 1593 CA SER A 111 0.421 11.252 -14.213 1.00 0.00 C ATOM 1594 C SER A 111 0.373 9.731 -14.063 1.00 0.00 C ATOM 1595 O SER A 111 -0.609 9.141 -14.519 1.00 0.00 O ATOM 1596 CB SER A 111 1.028 11.606 -15.571 1.00 0.00 C ATOM 1597 OG SER A 111 0.828 12.966 -15.888 1.00 0.00 O ATOM 0 H SER A 111 2.138 12.106 -13.364 1.00 0.00 H new ATOM 0 HA SER A 111 -0.605 11.613 -14.144 1.00 0.00 H new ATOM 0 HB2 SER A 111 2.096 11.387 -15.562 1.00 0.00 H new ATOM 0 HB3 SER A 111 0.581 10.981 -16.344 1.00 0.00 H new ATOM 0 HG SER A 111 1.229 13.161 -16.761 1.00 0.00 H new ATOM 1603 N ALA A 112 1.387 9.098 -13.454 1.00 0.00 N ATOM 1604 CA ALA A 112 1.586 7.651 -13.595 1.00 0.00 C ATOM 1605 C ALA A 112 0.576 6.870 -12.754 1.00 0.00 C ATOM 1606 O ALA A 112 0.289 5.697 -12.998 1.00 0.00 O ATOM 1607 CB ALA A 112 3.027 7.279 -13.199 1.00 0.00 C ATOM 0 H ALA A 112 2.077 9.563 -12.864 1.00 0.00 H new ATOM 0 HA ALA A 112 1.425 7.381 -14.639 1.00 0.00 H new ATOM 0 HB1 ALA A 112 3.168 6.203 -13.306 1.00 0.00 H new ATOM 0 HB2 ALA A 112 3.729 7.803 -13.847 1.00 0.00 H new ATOM 0 HB3 ALA A 112 3.205 7.567 -12.163 1.00 0.00 H new ATOM 1613 N LEU A 113 0.015 7.546 -11.762 1.00 0.00 N ATOM 1614 CA LEU A 113 -0.918 7.064 -10.775 1.00 0.00 C ATOM 1615 C LEU A 113 -2.194 7.884 -10.919 1.00 0.00 C ATOM 1616 O LEU A 113 -2.177 9.013 -11.418 1.00 0.00 O ATOM 1617 CB LEU A 113 -0.308 7.127 -9.357 1.00 0.00 C ATOM 1618 CG LEU A 113 0.632 8.296 -8.966 1.00 0.00 C ATOM 1619 CD1 LEU A 113 2.063 8.140 -9.487 1.00 0.00 C ATOM 1620 CD2 LEU A 113 0.097 9.696 -9.279 1.00 0.00 C ATOM 0 H LEU A 113 0.226 8.534 -11.622 1.00 0.00 H new ATOM 0 HA LEU A 113 -1.154 6.012 -10.935 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -1.136 7.127 -8.648 1.00 0.00 H new ATOM 0 HB3 LEU A 113 0.245 6.201 -9.201 1.00 0.00 H new ATOM 0 HG LEU A 113 0.661 8.216 -7.879 1.00 0.00 H new ATOM 0 HD11 LEU A 113 2.660 8.996 -9.173 1.00 0.00 H new ATOM 0 HD12 LEU A 113 2.499 7.226 -9.084 1.00 0.00 H new ATOM 0 HD13 LEU A 113 2.050 8.086 -10.576 1.00 0.00 H new ATOM 0 HD21 LEU A 113 0.828 10.443 -8.968 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -0.081 9.786 -10.351 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -0.838 9.857 -8.742 1.00 0.00 H new ATOM 1632 N SER A 114 -3.301 7.311 -10.468 1.00 0.00 N ATOM 1633 CA SER A 114 -4.631 7.894 -10.517 1.00 0.00 C ATOM 1634 C SER A 114 -5.336 7.598 -9.193 1.00 0.00 C ATOM 1635 O SER A 114 -4.730 7.053 -8.262 1.00 0.00 O ATOM 1636 CB SER A 114 -5.379 7.342 -11.740 1.00 0.00 C ATOM 1637 OG SER A 114 -6.368 8.254 -12.186 1.00 0.00 O ATOM 0 H SER A 114 -3.294 6.386 -10.039 1.00 0.00 H new ATOM 0 HA SER A 114 -4.594 8.977 -10.635 1.00 0.00 H new ATOM 0 HB2 SER A 114 -4.671 7.145 -12.545 1.00 0.00 H new ATOM 0 HB3 SER A 114 -5.845 6.390 -11.486 1.00 0.00 H new ATOM 0 HG SER A 114 -6.829 7.881 -12.966 1.00 0.00 H new ATOM 1643 N TRP A 115 -6.607 7.975 -9.081 1.00 0.00 N ATOM 1644 CA TRP A 115 -7.382 7.765 -7.871 1.00 0.00 C ATOM 1645 C TRP A 115 -8.816 7.370 -8.210 1.00 0.00 C ATOM 1646 O TRP A 115 -9.207 7.316 -9.382 1.00 0.00 O ATOM 1647 CB TRP A 115 -7.303 9.021 -6.992 1.00 0.00 C ATOM 1648 CG TRP A 115 -7.521 8.778 -5.532 1.00 0.00 C ATOM 1649 CD1 TRP A 115 -8.618 9.123 -4.822 1.00 0.00 C ATOM 1650 CD2 TRP A 115 -6.625 8.108 -4.593 1.00 0.00 C ATOM 1651 NE1 TRP A 115 -8.441 8.752 -3.504 1.00 0.00 N ATOM 1652 CE2 TRP A 115 -7.217 8.156 -3.300 1.00 0.00 C ATOM 1653 CE3 TRP A 115 -5.377 7.459 -4.702 1.00 0.00 C ATOM 1654 CZ2 TRP A 115 -6.588 7.629 -2.166 1.00 0.00 C ATOM 1655 CZ3 TRP A 115 -4.755 6.891 -3.573 1.00 0.00 C ATOM 1656 CH2 TRP A 115 -5.350 6.989 -2.305 1.00 0.00 C ATOM 0 H TRP A 115 -7.125 8.435 -9.830 1.00 0.00 H new ATOM 0 HA TRP A 115 -6.964 6.935 -7.302 1.00 0.00 H new ATOM 0 HB2 TRP A 115 -6.324 9.482 -7.127 1.00 0.00 H new ATOM 0 HB3 TRP A 115 -8.045 9.739 -7.341 1.00 0.00 H new ATOM 0 HD1 TRP A 115 -9.494 9.611 -5.222 1.00 0.00 H new ATOM 0 HE1 TRP A 115 -9.133 8.901 -2.770 1.00 0.00 H new ATOM 0 HE3 TRP A 115 -4.892 7.397 -5.665 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 -7.052 7.715 -1.195 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 -3.812 6.376 -3.684 1.00 0.00 H new ATOM 0 HH2 TRP A 115 -4.855 6.572 -1.440 1.00 0.00 H new ATOM 1667 N THR A 116 -9.582 7.080 -7.164 1.00 0.00 N ATOM 1668 CA THR A 116 -11.003 6.778 -7.234 1.00 0.00 C ATOM 1669 C THR A 116 -11.779 8.100 -7.139 1.00 0.00 C ATOM 1670 O THR A 116 -11.193 9.150 -6.852 1.00 0.00 O ATOM 1671 CB THR A 116 -11.317 5.754 -6.118 1.00 0.00 C ATOM 1672 OG1 THR A 116 -12.563 5.111 -6.254 1.00 0.00 O ATOM 1673 CG2 THR A 116 -11.276 6.351 -4.706 1.00 0.00 C ATOM 0 H THR A 116 -9.216 7.048 -6.212 1.00 0.00 H new ATOM 0 HA THR A 116 -11.307 6.318 -8.174 1.00 0.00 H new ATOM 0 HB THR A 116 -10.516 5.026 -6.244 1.00 0.00 H new ATOM 0 HG1 THR A 116 -12.688 4.480 -5.515 1.00 0.00 H new ATOM 0 HG21 THR A 116 -11.506 5.575 -3.976 1.00 0.00 H new ATOM 0 HG22 THR A 116 -10.281 6.751 -4.509 1.00 0.00 H new ATOM 0 HG23 THR A 116 -12.011 7.152 -4.628 1.00 0.00 H new ATOM 1681 N THR A 117 -13.094 8.057 -7.345 1.00 0.00 N ATOM 1682 CA THR A 117 -13.989 9.173 -7.079 1.00 0.00 C ATOM 1683 C THR A 117 -13.932 9.502 -5.580 1.00 0.00 C ATOM 1684 O THR A 117 -14.514 8.801 -4.748 1.00 0.00 O ATOM 1685 CB THR A 117 -15.409 8.829 -7.566 1.00 0.00 C ATOM 1686 OG1 THR A 117 -15.361 8.104 -8.781 1.00 0.00 O ATOM 1687 CG2 THR A 117 -16.235 10.093 -7.810 1.00 0.00 C ATOM 0 H THR A 117 -13.571 7.231 -7.707 1.00 0.00 H new ATOM 0 HA THR A 117 -13.679 10.063 -7.626 1.00 0.00 H new ATOM 0 HB THR A 117 -15.873 8.229 -6.783 1.00 0.00 H new ATOM 0 HG1 THR A 117 -16.273 7.894 -9.073 1.00 0.00 H new ATOM 0 HG21 THR A 117 -17.232 9.816 -8.153 1.00 0.00 H new ATOM 0 HG22 THR A 117 -16.315 10.660 -6.883 1.00 0.00 H new ATOM 0 HG23 THR A 117 -15.748 10.705 -8.569 1.00 0.00 H new ATOM 1695 N LEU A 118 -13.171 10.539 -5.221 1.00 0.00 N ATOM 1696 CA LEU A 118 -12.967 10.970 -3.844 1.00 0.00 C ATOM 1697 C LEU A 118 -14.328 11.391 -3.291 1.00 0.00 C ATOM 1698 O LEU A 118 -14.897 12.384 -3.738 1.00 0.00 O ATOM 1699 CB LEU A 118 -11.915 12.092 -3.803 1.00 0.00 C ATOM 1700 CG LEU A 118 -11.226 12.251 -2.443 1.00 0.00 C ATOM 1701 CD1 LEU A 118 -10.224 11.118 -2.194 1.00 0.00 C ATOM 1702 CD2 LEU A 118 -10.462 13.576 -2.371 1.00 0.00 C ATOM 0 H LEU A 118 -12.670 11.113 -5.899 1.00 0.00 H new ATOM 0 HA LEU A 118 -12.576 10.170 -3.216 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -11.158 11.894 -4.562 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -12.393 13.035 -4.069 1.00 0.00 H new ATOM 0 HG LEU A 118 -12.011 12.226 -1.687 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -9.751 11.258 -1.222 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -10.746 10.161 -2.210 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -9.462 11.129 -2.973 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -9.981 13.666 -1.397 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -9.704 13.602 -3.154 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -11.156 14.404 -2.511 1.00 0.00 H new ATOM 1714 N THR A 119 -14.905 10.548 -2.439 1.00 0.00 N ATOM 1715 CA THR A 119 -16.289 10.626 -1.989 1.00 0.00 C ATOM 1716 C THR A 119 -16.327 11.531 -0.742 1.00 0.00 C ATOM 1717 O THR A 119 -15.463 11.359 0.123 1.00 0.00 O ATOM 1718 CB THR A 119 -16.751 9.179 -1.722 1.00 0.00 C ATOM 1719 OG1 THR A 119 -16.503 8.346 -2.852 1.00 0.00 O ATOM 1720 CG2 THR A 119 -18.238 9.059 -1.393 1.00 0.00 C ATOM 0 H THR A 119 -14.401 9.762 -2.028 1.00 0.00 H new ATOM 0 HA THR A 119 -16.968 11.065 -2.720 1.00 0.00 H new ATOM 0 HB THR A 119 -16.173 8.861 -0.854 1.00 0.00 H new ATOM 0 HG1 THR A 119 -15.707 8.666 -3.326 1.00 0.00 H new ATOM 0 HG21 THR A 119 -18.489 8.013 -1.218 1.00 0.00 H new ATOM 0 HG22 THR A 119 -18.461 9.640 -0.498 1.00 0.00 H new ATOM 0 HG23 THR A 119 -18.827 9.438 -2.228 1.00 0.00 H new ATOM 1728 N PRO A 120 -17.270 12.482 -0.609 1.00 0.00 N ATOM 1729 CA PRO A 120 -17.276 13.402 0.520 1.00 0.00 C ATOM 1730 C PRO A 120 -17.624 12.646 1.801 1.00 0.00 C ATOM 1731 O PRO A 120 -18.355 11.658 1.738 1.00 0.00 O ATOM 1732 CB PRO A 120 -18.337 14.447 0.179 1.00 0.00 C ATOM 1733 CG PRO A 120 -19.326 13.697 -0.704 1.00 0.00 C ATOM 1734 CD PRO A 120 -18.466 12.657 -1.420 1.00 0.00 C ATOM 0 HA PRO A 120 -16.306 13.870 0.689 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -18.818 14.834 1.077 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -17.903 15.300 -0.343 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -20.112 13.227 -0.113 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -19.816 14.366 -1.412 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -19.004 11.715 -1.526 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -18.208 12.992 -2.425 1.00 0.00 H new ATOM 1742 N GLY A 121 -17.149 13.138 2.950 1.00 0.00 N ATOM 1743 CA GLY A 121 -17.361 12.582 4.289 1.00 0.00 C ATOM 1744 C GLY A 121 -17.519 11.060 4.326 1.00 0.00 C ATOM 1745 O GLY A 121 -18.520 10.541 4.826 1.00 0.00 O ATOM 0 H GLY A 121 -16.575 13.981 2.971 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -16.520 12.863 4.923 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -18.252 13.038 4.721 1.00 0.00 H new ATOM 1749 N LYS A 122 -16.564 10.322 3.767 1.00 0.00 N ATOM 1750 CA LYS A 122 -16.494 8.865 3.850 1.00 0.00 C ATOM 1751 C LYS A 122 -15.016 8.498 3.974 1.00 0.00 C ATOM 1752 O LYS A 122 -14.164 9.366 3.780 1.00 0.00 O ATOM 1753 CB LYS A 122 -17.210 8.222 2.638 1.00 0.00 C ATOM 1754 CG LYS A 122 -18.441 7.394 3.073 1.00 0.00 C ATOM 1755 CD LYS A 122 -19.239 6.884 1.867 1.00 0.00 C ATOM 1756 CE LYS A 122 -20.755 6.925 2.101 1.00 0.00 C ATOM 1757 NZ LYS A 122 -21.494 5.807 1.480 1.00 0.00 N ATOM 0 H LYS A 122 -15.798 10.730 3.231 1.00 0.00 H new ATOM 0 HA LYS A 122 -17.018 8.473 4.721 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -17.523 9.002 1.945 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -16.511 7.580 2.101 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -18.115 6.548 3.677 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -19.086 8.006 3.703 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -18.994 7.487 0.993 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -18.937 5.861 1.643 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -20.946 6.920 3.174 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -21.146 7.865 1.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -22.509 5.906 1.683 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -21.344 5.821 0.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -21.150 4.905 1.868 1.00 0.00 H new ATOM 1771 N PRO A 123 -14.681 7.241 4.294 1.00 0.00 N ATOM 1772 CA PRO A 123 -13.333 6.845 4.674 1.00 0.00 C ATOM 1773 C PRO A 123 -12.397 6.669 3.463 1.00 0.00 C ATOM 1774 O PRO A 123 -11.262 6.223 3.623 1.00 0.00 O ATOM 1775 CB PRO A 123 -13.541 5.544 5.450 1.00 0.00 C ATOM 1776 CG PRO A 123 -14.795 4.913 4.857 1.00 0.00 C ATOM 1777 CD PRO A 123 -15.570 6.094 4.285 1.00 0.00 C ATOM 0 HA PRO A 123 -12.832 7.609 5.269 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -12.681 4.882 5.345 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -13.665 5.738 6.515 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -14.548 4.186 4.083 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -15.374 4.386 5.616 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -15.907 5.877 3.271 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -16.460 6.294 4.881 1.00 0.00 H new ATOM 1785 N ASN A 124 -12.891 6.952 2.248 1.00 0.00 N ATOM 1786 CA ASN A 124 -12.241 6.809 0.939 1.00 0.00 C ATOM 1787 C ASN A 124 -11.339 5.580 0.852 1.00 0.00 C ATOM 1788 O ASN A 124 -10.228 5.650 0.337 1.00 0.00 O ATOM 1789 CB ASN A 124 -11.497 8.092 0.535 1.00 0.00 C ATOM 1790 CG ASN A 124 -12.368 9.322 0.351 1.00 0.00 C ATOM 1791 OD1 ASN A 124 -11.857 10.425 0.329 1.00 0.00 O ATOM 1792 ND2 ASN A 124 -13.669 9.192 0.147 1.00 0.00 N ATOM 0 H ASN A 124 -13.838 7.318 2.149 1.00 0.00 H new ATOM 0 HA ASN A 124 -13.041 6.648 0.216 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -10.746 8.310 1.294 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -10.963 7.904 -0.396 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -14.243 10.017 -0.029 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -14.098 8.267 0.165 1.00 0.00 H new ATOM 1799 N THR A 125 -11.803 4.452 1.377 1.00 0.00 N ATOM 1800 CA THR A 125 -11.136 3.166 1.310 1.00 0.00 C ATOM 1801 C THR A 125 -11.020 2.754 -0.168 1.00 0.00 C ATOM 1802 O THR A 125 -12.031 2.558 -0.849 1.00 0.00 O ATOM 1803 CB THR A 125 -11.983 2.207 2.157 1.00 0.00 C ATOM 1804 OG1 THR A 125 -11.993 2.710 3.484 1.00 0.00 O ATOM 1805 CG2 THR A 125 -11.489 0.762 2.184 1.00 0.00 C ATOM 0 H THR A 125 -12.689 4.411 1.880 1.00 0.00 H new ATOM 0 HA THR A 125 -10.119 3.172 1.703 1.00 0.00 H new ATOM 0 HB THR A 125 -12.972 2.169 1.701 1.00 0.00 H new ATOM 0 HG1 THR A 125 -12.529 2.120 4.054 1.00 0.00 H new ATOM 0 HG21 THR A 125 -12.152 0.162 2.808 1.00 0.00 H new ATOM 0 HG22 THR A 125 -11.483 0.361 1.171 1.00 0.00 H new ATOM 0 HG23 THR A 125 -10.479 0.730 2.593 1.00 0.00 H new ATOM 1813 N LEU A 126 -9.782 2.691 -0.655 1.00 0.00 N ATOM 1814 CA LEU A 126 -9.372 2.233 -1.977 1.00 0.00 C ATOM 1815 C LEU A 126 -9.340 0.706 -1.998 1.00 0.00 C ATOM 1816 O LEU A 126 -9.347 0.063 -0.953 1.00 0.00 O ATOM 1817 CB LEU A 126 -7.961 2.786 -2.267 1.00 0.00 C ATOM 1818 CG LEU A 126 -7.895 4.172 -2.937 1.00 0.00 C ATOM 1819 CD1 LEU A 126 -8.185 4.080 -4.432 1.00 0.00 C ATOM 1820 CD2 LEU A 126 -8.826 5.246 -2.373 1.00 0.00 C ATOM 0 H LEU A 126 -8.982 2.981 -0.093 1.00 0.00 H new ATOM 0 HA LEU A 126 -10.074 2.584 -2.733 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -7.413 2.834 -1.326 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -7.438 2.073 -2.904 1.00 0.00 H new ATOM 0 HG LEU A 126 -6.873 4.485 -2.723 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -8.131 5.074 -4.875 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -7.449 3.431 -4.906 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -9.183 3.669 -4.584 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -8.687 6.175 -2.926 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -9.861 4.917 -2.469 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -8.594 5.412 -1.321 1.00 0.00 H new ATOM 1832 N ASN A 127 -9.229 0.134 -3.197 1.00 0.00 N ATOM 1833 CA ASN A 127 -9.161 -1.313 -3.425 1.00 0.00 C ATOM 1834 C ASN A 127 -7.732 -1.686 -3.836 1.00 0.00 C ATOM 1835 O ASN A 127 -7.531 -2.495 -4.736 1.00 0.00 O ATOM 1836 CB ASN A 127 -10.205 -1.757 -4.475 1.00 0.00 C ATOM 1837 CG ASN A 127 -11.639 -1.518 -4.029 1.00 0.00 C ATOM 1838 OD1 ASN A 127 -12.398 -2.432 -3.725 1.00 0.00 O ATOM 1839 ND2 ASN A 127 -12.063 -0.268 -3.985 1.00 0.00 N ATOM 0 H ASN A 127 -9.183 0.676 -4.060 1.00 0.00 H new ATOM 0 HA ASN A 127 -9.406 -1.843 -2.505 1.00 0.00 H new ATOM 0 HB2 ASN A 127 -10.026 -1.219 -5.406 1.00 0.00 H new ATOM 0 HB3 ASN A 127 -10.069 -2.817 -4.688 1.00 0.00 H new ATOM 0 HD21 ASN A 127 -13.020 -0.064 -3.698 1.00 0.00 H new ATOM 0 HD22 ASN A 127 -11.433 0.493 -4.238 1.00 0.00 H new ATOM 1846 N PHE A 128 -6.725 -1.036 -3.248 1.00 0.00 N ATOM 1847 CA PHE A 128 -5.317 -1.256 -3.578 1.00 0.00 C ATOM 1848 C PHE A 128 -4.770 -2.461 -2.799 1.00 0.00 C ATOM 1849 O PHE A 128 -5.481 -3.081 -1.999 1.00 0.00 O ATOM 1850 CB PHE A 128 -4.525 0.043 -3.327 1.00 0.00 C ATOM 1851 CG PHE A 128 -4.747 1.191 -4.312 1.00 0.00 C ATOM 1852 CD1 PHE A 128 -5.687 1.117 -5.360 1.00 0.00 C ATOM 1853 CD2 PHE A 128 -3.965 2.356 -4.198 1.00 0.00 C ATOM 1854 CE1 PHE A 128 -5.833 2.175 -6.272 1.00 0.00 C ATOM 1855 CE2 PHE A 128 -4.130 3.429 -5.088 1.00 0.00 C ATOM 1856 CZ PHE A 128 -5.066 3.342 -6.130 1.00 0.00 C ATOM 0 H PHE A 128 -6.867 -0.334 -2.521 1.00 0.00 H new ATOM 0 HA PHE A 128 -5.208 -1.501 -4.634 1.00 0.00 H new ATOM 0 HB2 PHE A 128 -4.770 0.402 -2.327 1.00 0.00 H new ATOM 0 HB3 PHE A 128 -3.463 -0.202 -3.326 1.00 0.00 H new ATOM 0 HD1 PHE A 128 -6.303 0.236 -5.463 1.00 0.00 H new ATOM 0 HD2 PHE A 128 -3.226 2.425 -3.413 1.00 0.00 H new ATOM 0 HE1 PHE A 128 -6.538 2.090 -7.086 1.00 0.00 H new ATOM 0 HE2 PHE A 128 -3.536 4.323 -4.971 1.00 0.00 H new ATOM 0 HZ PHE A 128 -5.195 4.166 -6.817 1.00 0.00 H new ATOM 1866 N TYR A 129 -3.510 -2.826 -3.046 1.00 0.00 N ATOM 1867 CA TYR A 129 -2.884 -3.993 -2.442 1.00 0.00 C ATOM 1868 C TYR A 129 -1.417 -3.685 -2.125 1.00 0.00 C ATOM 1869 O TYR A 129 -0.861 -2.687 -2.584 1.00 0.00 O ATOM 1870 CB TYR A 129 -3.021 -5.214 -3.371 1.00 0.00 C ATOM 1871 CG TYR A 129 -4.423 -5.560 -3.841 1.00 0.00 C ATOM 1872 CD1 TYR A 129 -5.216 -6.437 -3.079 1.00 0.00 C ATOM 1873 CD2 TYR A 129 -4.932 -5.024 -5.043 1.00 0.00 C ATOM 1874 CE1 TYR A 129 -6.531 -6.735 -3.468 1.00 0.00 C ATOM 1875 CE2 TYR A 129 -6.244 -5.335 -5.447 1.00 0.00 C ATOM 1876 CZ TYR A 129 -7.056 -6.173 -4.651 1.00 0.00 C ATOM 1877 OH TYR A 129 -8.346 -6.409 -5.007 1.00 0.00 O ATOM 0 H TYR A 129 -2.895 -2.312 -3.677 1.00 0.00 H new ATOM 0 HA TYR A 129 -3.389 -4.235 -1.507 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -2.400 -5.044 -4.250 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -2.611 -6.082 -2.855 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -4.809 -6.886 -2.185 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -4.317 -4.377 -5.651 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -7.139 -7.392 -2.864 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -6.632 -4.931 -6.370 1.00 0.00 H new ATOM 0 HH TYR A 129 -8.543 -5.945 -5.848 1.00 0.00 H new ATOM 1887 N ALA A 130 -0.784 -4.536 -1.322 1.00 0.00 N ATOM 1888 CA ALA A 130 0.621 -4.490 -0.954 1.00 0.00 C ATOM 1889 C ALA A 130 1.143 -5.913 -0.924 1.00 0.00 C ATOM 1890 O ALA A 130 0.429 -6.815 -0.476 1.00 0.00 O ATOM 1891 CB ALA A 130 0.779 -3.888 0.449 1.00 0.00 C ATOM 0 H ALA A 130 -1.270 -5.321 -0.887 1.00 0.00 H new ATOM 0 HA ALA A 130 1.169 -3.880 -1.672 1.00 0.00 H new ATOM 0 HB1 ALA A 130 1.836 -3.858 0.715 1.00 0.00 H new ATOM 0 HB2 ALA A 130 0.374 -2.876 0.459 1.00 0.00 H new ATOM 0 HB3 ALA A 130 0.240 -4.502 1.171 1.00 0.00 H new ATOM 1897 N ARG A 131 2.400 -6.111 -1.325 1.00 0.00 N ATOM 1898 CA ARG A 131 3.184 -7.291 -0.974 1.00 0.00 C ATOM 1899 C ARG A 131 4.647 -7.037 -1.306 1.00 0.00 C ATOM 1900 O ARG A 131 5.124 -5.915 -1.117 1.00 0.00 O ATOM 1901 CB ARG A 131 2.601 -8.568 -1.606 1.00 0.00 C ATOM 1902 CG ARG A 131 2.589 -9.750 -0.619 1.00 0.00 C ATOM 1903 CD ARG A 131 1.631 -9.638 0.588 1.00 0.00 C ATOM 1904 NE ARG A 131 2.163 -10.371 1.742 1.00 0.00 N ATOM 1905 CZ ARG A 131 2.101 -11.694 1.891 1.00 0.00 C ATOM 1906 NH1 ARG A 131 1.487 -12.458 0.994 1.00 0.00 N ATOM 1907 NH2 ARG A 131 2.653 -12.263 2.952 1.00 0.00 N ATOM 0 H ARG A 131 2.906 -5.446 -1.910 1.00 0.00 H new ATOM 0 HA ARG A 131 3.128 -7.471 0.100 1.00 0.00 H new ATOM 0 HB2 ARG A 131 1.585 -8.371 -1.948 1.00 0.00 H new ATOM 0 HB3 ARG A 131 3.187 -8.837 -2.485 1.00 0.00 H new ATOM 0 HG2 ARG A 131 2.334 -10.653 -1.173 1.00 0.00 H new ATOM 0 HG3 ARG A 131 3.601 -9.885 -0.238 1.00 0.00 H new ATOM 0 HD2 ARG A 131 1.490 -8.590 0.850 1.00 0.00 H new ATOM 0 HD3 ARG A 131 0.652 -10.034 0.319 1.00 0.00 H new ATOM 0 HE ARG A 131 2.612 -9.831 2.482 1.00 0.00 H new ATOM 0 HH11 ARG A 131 1.053 -12.034 0.174 1.00 0.00 H new ATOM 0 HH12 ARG A 131 1.450 -13.469 1.125 1.00 0.00 H new ATOM 0 HH21 ARG A 131 3.124 -11.689 3.652 1.00 0.00 H new ATOM 0 HH22 ARG A 131 2.608 -13.275 3.069 1.00 0.00 H new ATOM 1921 N LEU A 132 5.386 -8.074 -1.688 1.00 0.00 N ATOM 1922 CA LEU A 132 6.824 -8.123 -1.563 1.00 0.00 C ATOM 1923 C LEU A 132 7.388 -8.681 -2.856 1.00 0.00 C ATOM 1924 O LEU A 132 7.090 -9.825 -3.216 1.00 0.00 O ATOM 1925 CB LEU A 132 7.173 -9.024 -0.368 1.00 0.00 C ATOM 1926 CG LEU A 132 8.308 -8.547 0.549 1.00 0.00 C ATOM 1927 CD1 LEU A 132 9.110 -9.780 0.956 1.00 0.00 C ATOM 1928 CD2 LEU A 132 9.261 -7.491 -0.007 1.00 0.00 C ATOM 0 H LEU A 132 4.986 -8.917 -2.100 1.00 0.00 H new ATOM 0 HA LEU A 132 7.250 -7.135 -1.390 1.00 0.00 H new ATOM 0 HB2 LEU A 132 6.276 -9.148 0.238 1.00 0.00 H new ATOM 0 HB3 LEU A 132 7.437 -10.010 -0.751 1.00 0.00 H new ATOM 0 HG LEU A 132 7.818 -8.037 1.379 1.00 0.00 H new ATOM 0 HD11 LEU A 132 9.929 -9.482 1.611 1.00 0.00 H new ATOM 0 HD12 LEU A 132 8.460 -10.479 1.483 1.00 0.00 H new ATOM 0 HD13 LEU A 132 9.514 -10.261 0.066 1.00 0.00 H new ATOM 0 HD21 LEU A 132 10.012 -7.247 0.744 1.00 0.00 H new ATOM 0 HD22 LEU A 132 9.753 -7.878 -0.899 1.00 0.00 H new ATOM 0 HD23 LEU A 132 8.699 -6.593 -0.264 1.00 0.00 H new ATOM 1940 N MET A 133 8.171 -7.870 -3.557 1.00 0.00 N ATOM 1941 CA MET A 133 8.701 -8.197 -4.865 1.00 0.00 C ATOM 1942 C MET A 133 10.187 -8.476 -4.691 1.00 0.00 C ATOM 1943 O MET A 133 10.918 -7.605 -4.212 1.00 0.00 O ATOM 1944 CB MET A 133 8.396 -7.019 -5.814 1.00 0.00 C ATOM 1945 CG MET A 133 9.127 -7.001 -7.170 1.00 0.00 C ATOM 1946 SD MET A 133 8.209 -7.675 -8.562 1.00 0.00 S ATOM 1947 CE MET A 133 8.105 -9.297 -7.812 1.00 0.00 C ATOM 0 H MET A 133 8.458 -6.950 -3.222 1.00 0.00 H new ATOM 0 HA MET A 133 8.247 -9.084 -5.308 1.00 0.00 H new ATOM 0 HB2 MET A 133 7.323 -7.010 -6.008 1.00 0.00 H new ATOM 0 HB3 MET A 133 8.633 -6.093 -5.290 1.00 0.00 H new ATOM 0 HG2 MET A 133 9.398 -5.971 -7.402 1.00 0.00 H new ATOM 0 HG3 MET A 133 10.057 -7.560 -7.068 1.00 0.00 H new ATOM 0 HE1 MET A 133 7.966 -10.049 -8.589 1.00 0.00 H new ATOM 0 HE2 MET A 133 9.025 -9.505 -7.266 1.00 0.00 H new ATOM 0 HE3 MET A 133 7.260 -9.326 -7.124 1.00 0.00 H new ATOM 1957 N ALA A 134 10.651 -9.673 -5.058 1.00 0.00 N ATOM 1958 CA ALA A 134 12.087 -9.895 -5.104 1.00 0.00 C ATOM 1959 C ALA A 134 12.662 -9.131 -6.275 1.00 0.00 C ATOM 1960 O ALA A 134 12.210 -9.335 -7.399 1.00 0.00 O ATOM 1961 CB ALA A 134 12.462 -11.374 -5.196 1.00 0.00 C ATOM 0 H ALA A 134 10.074 -10.473 -5.318 1.00 0.00 H new ATOM 0 HA ALA A 134 12.510 -9.534 -4.167 1.00 0.00 H new ATOM 0 HB1 ALA A 134 13.547 -11.473 -5.227 1.00 0.00 H new ATOM 0 HB2 ALA A 134 12.074 -11.903 -4.325 1.00 0.00 H new ATOM 0 HB3 ALA A 134 12.033 -11.803 -6.102 1.00 0.00 H new ATOM 1967 N THR A 135 13.646 -8.285 -6.009 1.00 0.00 N ATOM 1968 CA THR A 135 14.451 -7.650 -7.028 1.00 0.00 C ATOM 1969 C THR A 135 15.767 -8.428 -7.201 1.00 0.00 C ATOM 1970 O THR A 135 16.370 -8.344 -8.272 1.00 0.00 O ATOM 1971 CB THR A 135 14.621 -6.153 -6.688 1.00 0.00 C ATOM 1972 OG1 THR A 135 15.436 -5.928 -5.555 1.00 0.00 O ATOM 1973 CG2 THR A 135 13.294 -5.458 -6.373 1.00 0.00 C ATOM 0 H THR A 135 13.908 -8.019 -5.060 1.00 0.00 H new ATOM 0 HA THR A 135 13.962 -7.679 -8.002 1.00 0.00 H new ATOM 0 HB THR A 135 15.079 -5.745 -7.589 1.00 0.00 H new ATOM 0 HG1 THR A 135 15.516 -4.964 -5.396 1.00 0.00 H new ATOM 0 HG21 THR A 135 13.479 -4.409 -6.142 1.00 0.00 H new ATOM 0 HG22 THR A 135 12.632 -5.529 -7.236 1.00 0.00 H new ATOM 0 HG23 THR A 135 12.825 -5.941 -5.516 1.00 0.00 H new ATOM 1981 N GLN A 136 16.206 -9.220 -6.204 1.00 0.00 N ATOM 1982 CA GLN A 136 17.381 -10.096 -6.255 1.00 0.00 C ATOM 1983 C GLN A 136 17.136 -11.380 -5.469 1.00 0.00 C ATOM 1984 O GLN A 136 16.076 -11.563 -4.877 1.00 0.00 O ATOM 1985 CB GLN A 136 18.646 -9.388 -5.717 1.00 0.00 C ATOM 1986 CG GLN A 136 19.053 -8.126 -6.479 1.00 0.00 C ATOM 1987 CD GLN A 136 19.707 -8.447 -7.824 1.00 0.00 C ATOM 1988 OE1 GLN A 136 19.029 -9.100 -8.751 1.00 0.00 O flip ATOM 1989 NE2 GLN A 136 20.881 -8.147 -8.022 1.00 0.00 N flip ATOM 0 H GLN A 136 15.727 -9.265 -5.304 1.00 0.00 H new ATOM 0 HA GLN A 136 17.549 -10.345 -7.303 1.00 0.00 H new ATOM 0 HB2 GLN A 136 18.481 -9.126 -4.672 1.00 0.00 H new ATOM 0 HB3 GLN A 136 19.477 -10.093 -5.741 1.00 0.00 H new ATOM 0 HG2 GLN A 136 18.173 -7.504 -6.644 1.00 0.00 H new ATOM 0 HG3 GLN A 136 19.745 -7.544 -5.870 1.00 0.00 H new ATOM 0 HE21 GLN A 136 21.406 -7.643 -7.307 1.00 0.00 H new ATOM 0 HE22 GLN A 136 21.331 -8.402 -8.901 1.00 0.00 H new ATOM 1998 N VAL A 137 18.153 -12.244 -5.423 1.00 0.00 N ATOM 1999 CA VAL A 137 18.117 -13.567 -4.816 1.00 0.00 C ATOM 2000 C VAL A 137 19.149 -13.595 -3.662 1.00 0.00 C ATOM 2001 O VAL A 137 19.949 -14.529 -3.573 1.00 0.00 O ATOM 2002 CB VAL A 137 18.415 -14.548 -5.982 1.00 0.00 C ATOM 2003 CG1 VAL A 137 18.419 -16.031 -5.573 1.00 0.00 C ATOM 2004 CG2 VAL A 137 17.423 -14.288 -7.128 1.00 0.00 C ATOM 0 H VAL A 137 19.063 -12.026 -5.828 1.00 0.00 H new ATOM 0 HA VAL A 137 17.166 -13.845 -4.361 1.00 0.00 H new ATOM 0 HB VAL A 137 19.434 -14.349 -6.314 1.00 0.00 H new ATOM 0 HG11 VAL A 137 18.635 -16.648 -6.445 1.00 0.00 H new ATOM 0 HG12 VAL A 137 19.183 -16.197 -4.813 1.00 0.00 H new ATOM 0 HG13 VAL A 137 17.442 -16.300 -5.171 1.00 0.00 H new ATOM 0 HG21 VAL A 137 17.628 -14.974 -7.949 1.00 0.00 H new ATOM 0 HG22 VAL A 137 16.405 -14.444 -6.770 1.00 0.00 H new ATOM 0 HG23 VAL A 137 17.532 -13.261 -7.477 1.00 0.00 H new ATOM 2014 N PRO A 138 19.134 -12.655 -2.686 1.00 0.00 N ATOM 2015 CA PRO A 138 20.062 -12.732 -1.574 1.00 0.00 C ATOM 2016 C PRO A 138 19.529 -13.675 -0.476 1.00 0.00 C ATOM 2017 O PRO A 138 20.251 -13.958 0.477 1.00 0.00 O ATOM 2018 CB PRO A 138 20.256 -11.307 -1.073 1.00 0.00 C ATOM 2019 CG PRO A 138 18.866 -10.745 -1.273 1.00 0.00 C ATOM 2020 CD PRO A 138 18.380 -11.421 -2.555 1.00 0.00 C ATOM 0 HA PRO A 138 21.020 -13.153 -1.880 1.00 0.00 H new ATOM 0 HB2 PRO A 138 20.569 -11.275 -0.029 1.00 0.00 H new ATOM 0 HB3 PRO A 138 21.007 -10.766 -1.648 1.00 0.00 H new ATOM 0 HG2 PRO A 138 18.216 -10.975 -0.429 1.00 0.00 H new ATOM 0 HG3 PRO A 138 18.884 -9.660 -1.375 1.00 0.00 H new ATOM 0 HD2 PRO A 138 17.310 -11.624 -2.504 1.00 0.00 H new ATOM 0 HD3 PRO A 138 18.541 -10.775 -3.418 1.00 0.00 H new ATOM 2028 N VAL A 139 18.258 -14.102 -0.593 1.00 0.00 N ATOM 2029 CA VAL A 139 17.495 -15.045 0.231 1.00 0.00 C ATOM 2030 C VAL A 139 17.889 -14.987 1.712 1.00 0.00 C ATOM 2031 O VAL A 139 18.199 -15.978 2.364 1.00 0.00 O ATOM 2032 CB VAL A 139 17.467 -16.440 -0.428 1.00 0.00 C ATOM 2033 CG1 VAL A 139 16.753 -16.332 -1.788 1.00 0.00 C ATOM 2034 CG2 VAL A 139 18.853 -17.062 -0.640 1.00 0.00 C ATOM 0 H VAL A 139 17.679 -13.751 -1.356 1.00 0.00 H new ATOM 0 HA VAL A 139 16.450 -14.738 0.263 1.00 0.00 H new ATOM 0 HB VAL A 139 16.937 -17.098 0.260 1.00 0.00 H new ATOM 0 HG11 VAL A 139 16.727 -17.312 -2.264 1.00 0.00 H new ATOM 0 HG12 VAL A 139 15.734 -15.975 -1.637 1.00 0.00 H new ATOM 0 HG13 VAL A 139 17.292 -15.633 -2.427 1.00 0.00 H new ATOM 0 HG21 VAL A 139 18.745 -18.041 -1.107 1.00 0.00 H new ATOM 0 HG22 VAL A 139 19.447 -16.415 -1.285 1.00 0.00 H new ATOM 0 HG23 VAL A 139 19.353 -17.173 0.322 1.00 0.00 H new ATOM 2044 N THR A 140 17.856 -13.765 2.230 1.00 0.00 N ATOM 2045 CA THR A 140 18.320 -13.339 3.525 1.00 0.00 C ATOM 2046 C THR A 140 17.120 -13.351 4.464 1.00 0.00 C ATOM 2047 O THR A 140 16.146 -12.630 4.240 1.00 0.00 O ATOM 2048 CB THR A 140 18.913 -11.940 3.308 1.00 0.00 C ATOM 2049 OG1 THR A 140 20.141 -12.066 2.613 1.00 0.00 O ATOM 2050 CG2 THR A 140 19.099 -11.122 4.586 1.00 0.00 C ATOM 0 H THR A 140 17.467 -12.985 1.699 1.00 0.00 H new ATOM 0 HA THR A 140 19.081 -13.979 3.972 1.00 0.00 H new ATOM 0 HB THR A 140 18.186 -11.379 2.721 1.00 0.00 H new ATOM 0 HG1 THR A 140 20.051 -12.743 1.910 1.00 0.00 H new ATOM 0 HG21 THR A 140 19.523 -10.149 4.337 1.00 0.00 H new ATOM 0 HG22 THR A 140 18.134 -10.984 5.073 1.00 0.00 H new ATOM 0 HG23 THR A 140 19.773 -11.649 5.261 1.00 0.00 H new ATOM 2058 N ALA A 141 17.166 -14.187 5.486 1.00 0.00 N ATOM 2059 CA ALA A 141 16.216 -14.183 6.584 1.00 0.00 C ATOM 2060 C ALA A 141 16.399 -12.896 7.414 1.00 0.00 C ATOM 2061 O ALA A 141 17.305 -12.797 8.245 1.00 0.00 O ATOM 2062 CB ALA A 141 16.364 -15.469 7.402 1.00 0.00 C ATOM 0 H ALA A 141 17.884 -14.906 5.577 1.00 0.00 H new ATOM 0 HA ALA A 141 15.192 -14.173 6.212 1.00 0.00 H new ATOM 0 HB1 ALA A 141 15.649 -15.461 8.225 1.00 0.00 H new ATOM 0 HB2 ALA A 141 16.172 -16.331 6.763 1.00 0.00 H new ATOM 0 HB3 ALA A 141 17.376 -15.532 7.802 1.00 0.00 H new ATOM 2068 N GLY A 142 15.557 -11.887 7.180 1.00 0.00 N ATOM 2069 CA GLY A 142 15.534 -10.644 7.941 1.00 0.00 C ATOM 2070 C GLY A 142 14.125 -10.055 7.932 1.00 0.00 C ATOM 2071 O GLY A 142 13.535 -9.884 6.869 1.00 0.00 O ATOM 0 H GLY A 142 14.858 -11.916 6.438 1.00 0.00 H new ATOM 0 HA2 GLY A 142 15.854 -10.829 8.967 1.00 0.00 H new ATOM 0 HA3 GLY A 142 16.238 -9.931 7.512 1.00 0.00 H new ATOM 2075 N HIS A 143 13.562 -9.735 9.099 1.00 0.00 N ATOM 2076 CA HIS A 143 12.254 -9.088 9.234 1.00 0.00 C ATOM 2077 C HIS A 143 12.111 -7.909 8.277 1.00 0.00 C ATOM 2078 O HIS A 143 13.034 -7.108 8.097 1.00 0.00 O ATOM 2079 CB HIS A 143 11.945 -8.633 10.671 1.00 0.00 C ATOM 2080 CG HIS A 143 12.967 -7.752 11.339 1.00 0.00 C ATOM 2081 ND1 HIS A 143 13.680 -6.719 10.761 1.00 0.00 N ATOM 2082 CD2 HIS A 143 13.291 -7.807 12.663 1.00 0.00 C ATOM 2083 CE1 HIS A 143 14.426 -6.159 11.724 1.00 0.00 C ATOM 2084 NE2 HIS A 143 14.208 -6.805 12.885 1.00 0.00 N ATOM 0 H HIS A 143 14.011 -9.922 9.995 1.00 0.00 H new ATOM 0 HA HIS A 143 11.524 -9.854 8.972 1.00 0.00 H new ATOM 0 HB2 HIS A 143 10.993 -8.102 10.662 1.00 0.00 H new ATOM 0 HB3 HIS A 143 11.808 -9.522 11.287 1.00 0.00 H new ATOM 0 HD1 HIS A 143 13.645 -6.435 9.782 1.00 0.00 H new ATOM 0 HD2 HIS A 143 12.904 -8.501 13.394 1.00 0.00 H new ATOM 0 HE1 HIS A 143 15.096 -5.322 11.590 1.00 0.00 H new ATOM 2093 N ILE A 144 10.929 -7.767 7.702 1.00 0.00 N ATOM 2094 CA ILE A 144 10.602 -6.641 6.851 1.00 0.00 C ATOM 2095 C ILE A 144 10.269 -5.497 7.794 1.00 0.00 C ATOM 2096 O ILE A 144 9.387 -5.634 8.642 1.00 0.00 O ATOM 2097 CB ILE A 144 9.457 -7.007 5.897 1.00 0.00 C ATOM 2098 CG1 ILE A 144 9.814 -8.347 5.209 1.00 0.00 C ATOM 2099 CG2 ILE A 144 9.236 -5.868 4.892 1.00 0.00 C ATOM 2100 CD1 ILE A 144 8.913 -8.692 4.040 1.00 0.00 C ATOM 0 H ILE A 144 10.166 -8.435 7.815 1.00 0.00 H new ATOM 0 HA ILE A 144 11.425 -6.349 6.199 1.00 0.00 H new ATOM 0 HB ILE A 144 8.518 -7.137 6.435 1.00 0.00 H new ATOM 0 HG12 ILE A 144 10.846 -8.302 4.860 1.00 0.00 H new ATOM 0 HG13 ILE A 144 9.761 -9.149 5.946 1.00 0.00 H new ATOM 0 HG21 ILE A 144 8.422 -6.132 4.216 1.00 0.00 H new ATOM 0 HG22 ILE A 144 8.981 -4.954 5.428 1.00 0.00 H new ATOM 0 HG23 ILE A 144 10.148 -5.708 4.317 1.00 0.00 H new ATOM 0 HD11 ILE A 144 9.224 -9.644 3.609 1.00 0.00 H new ATOM 0 HD12 ILE A 144 7.882 -8.770 4.386 1.00 0.00 H new ATOM 0 HD13 ILE A 144 8.984 -7.911 3.283 1.00 0.00 H new ATOM 2112 N ASN A 145 11.028 -4.414 7.677 1.00 0.00 N ATOM 2113 CA ASN A 145 10.991 -3.264 8.571 1.00 0.00 C ATOM 2114 C ASN A 145 11.034 -1.980 7.744 1.00 0.00 C ATOM 2115 O ASN A 145 11.573 -0.975 8.191 1.00 0.00 O ATOM 2116 CB ASN A 145 12.187 -3.338 9.536 1.00 0.00 C ATOM 2117 CG ASN A 145 11.814 -2.894 10.938 1.00 0.00 C ATOM 2118 OD1 ASN A 145 11.738 -1.707 11.245 1.00 0.00 O ATOM 2119 ND2 ASN A 145 11.548 -3.843 11.819 1.00 0.00 N ATOM 0 H ASN A 145 11.712 -4.309 6.928 1.00 0.00 H new ATOM 0 HA ASN A 145 10.071 -3.267 9.155 1.00 0.00 H new ATOM 0 HB2 ASN A 145 12.565 -4.360 9.568 1.00 0.00 H new ATOM 0 HB3 ASN A 145 12.996 -2.711 9.160 1.00 0.00 H new ATOM 0 HD21 ASN A 145 11.275 -3.594 12.770 1.00 0.00 H new ATOM 0 HD22 ASN A 145 11.616 -4.824 11.548 1.00 0.00 H new ATOM 2126 N ALA A 146 10.584 -2.039 6.483 1.00 0.00 N ATOM 2127 CA ALA A 146 10.784 -0.918 5.583 1.00 0.00 C ATOM 2128 C ALA A 146 9.944 0.263 6.065 1.00 0.00 C ATOM 2129 O ALA A 146 8.947 0.085 6.782 1.00 0.00 O ATOM 2130 CB ALA A 146 10.379 -1.264 4.156 1.00 0.00 C ATOM 0 H ALA A 146 10.091 -2.836 6.079 1.00 0.00 H new ATOM 0 HA ALA A 146 11.845 -0.666 5.584 1.00 0.00 H new ATOM 0 HB1 ALA A 146 10.543 -0.400 3.512 1.00 0.00 H new ATOM 0 HB2 ALA A 146 10.979 -2.101 3.800 1.00 0.00 H new ATOM 0 HB3 ALA A 146 9.324 -1.538 4.133 1.00 0.00 H new ATOM 2136 N THR A 147 10.257 1.444 5.565 1.00 0.00 N ATOM 2137 CA THR A 147 9.713 2.709 5.998 1.00 0.00 C ATOM 2138 C THR A 147 9.713 3.644 4.787 1.00 0.00 C ATOM 2139 O THR A 147 10.631 3.618 3.967 1.00 0.00 O ATOM 2140 CB THR A 147 10.547 3.181 7.202 1.00 0.00 C ATOM 2141 OG1 THR A 147 10.108 4.429 7.688 1.00 0.00 O ATOM 2142 CG2 THR A 147 12.052 3.237 6.913 1.00 0.00 C ATOM 0 H THR A 147 10.932 1.547 4.808 1.00 0.00 H new ATOM 0 HA THR A 147 8.681 2.662 6.345 1.00 0.00 H new ATOM 0 HB THR A 147 10.390 2.425 7.971 1.00 0.00 H new ATOM 0 HG1 THR A 147 10.660 4.695 8.453 1.00 0.00 H new ATOM 0 HG21 THR A 147 12.581 3.577 7.803 1.00 0.00 H new ATOM 0 HG22 THR A 147 12.407 2.244 6.637 1.00 0.00 H new ATOM 0 HG23 THR A 147 12.239 3.930 6.093 1.00 0.00 H new ATOM 2150 N ALA A 148 8.633 4.403 4.618 1.00 0.00 N ATOM 2151 CA ALA A 148 8.425 5.301 3.491 1.00 0.00 C ATOM 2152 C ALA A 148 7.354 6.320 3.867 1.00 0.00 C ATOM 2153 O ALA A 148 6.852 6.303 4.992 1.00 0.00 O ATOM 2154 CB ALA A 148 8.018 4.503 2.247 1.00 0.00 C ATOM 0 H ALA A 148 7.858 4.409 5.281 1.00 0.00 H new ATOM 0 HA ALA A 148 9.350 5.827 3.256 1.00 0.00 H new ATOM 0 HB1 ALA A 148 7.865 5.185 1.411 1.00 0.00 H new ATOM 0 HB2 ALA A 148 8.806 3.793 1.996 1.00 0.00 H new ATOM 0 HB3 ALA A 148 7.093 3.963 2.448 1.00 0.00 H new ATOM 2160 N THR A 149 6.992 7.197 2.937 1.00 0.00 N ATOM 2161 CA THR A 149 6.056 8.291 3.153 1.00 0.00 C ATOM 2162 C THR A 149 5.084 8.313 1.975 1.00 0.00 C ATOM 2163 O THR A 149 5.485 8.069 0.837 1.00 0.00 O ATOM 2164 CB THR A 149 6.859 9.599 3.305 1.00 0.00 C ATOM 2165 OG1 THR A 149 7.898 9.675 2.335 1.00 0.00 O ATOM 2166 CG2 THR A 149 7.517 9.657 4.683 1.00 0.00 C ATOM 0 H THR A 149 7.354 7.164 1.984 1.00 0.00 H new ATOM 0 HA THR A 149 5.471 8.168 4.064 1.00 0.00 H new ATOM 0 HB THR A 149 6.160 10.425 3.172 1.00 0.00 H new ATOM 0 HG1 THR A 149 7.522 9.956 1.475 1.00 0.00 H new ATOM 0 HG21 THR A 149 8.081 10.585 4.778 1.00 0.00 H new ATOM 0 HG22 THR A 149 6.749 9.619 5.455 1.00 0.00 H new ATOM 0 HG23 THR A 149 8.192 8.809 4.800 1.00 0.00 H new ATOM 2174 N PHE A 150 3.813 8.602 2.230 1.00 0.00 N ATOM 2175 CA PHE A 150 2.764 8.604 1.218 1.00 0.00 C ATOM 2176 C PHE A 150 2.005 9.919 1.368 1.00 0.00 C ATOM 2177 O PHE A 150 1.315 10.141 2.365 1.00 0.00 O ATOM 2178 CB PHE A 150 1.899 7.342 1.343 1.00 0.00 C ATOM 2179 CG PHE A 150 1.302 7.131 2.714 1.00 0.00 C ATOM 2180 CD1 PHE A 150 2.123 6.697 3.773 1.00 0.00 C ATOM 2181 CD2 PHE A 150 -0.048 7.446 2.950 1.00 0.00 C ATOM 2182 CE1 PHE A 150 1.614 6.624 5.075 1.00 0.00 C ATOM 2183 CE2 PHE A 150 -0.560 7.358 4.252 1.00 0.00 C ATOM 2184 CZ PHE A 150 0.276 6.955 5.303 1.00 0.00 C ATOM 0 H PHE A 150 3.477 8.846 3.162 1.00 0.00 H new ATOM 0 HA PHE A 150 3.160 8.559 0.204 1.00 0.00 H new ATOM 0 HB2 PHE A 150 1.092 7.395 0.612 1.00 0.00 H new ATOM 0 HB3 PHE A 150 2.505 6.473 1.086 1.00 0.00 H new ATOM 0 HD1 PHE A 150 3.149 6.420 3.580 1.00 0.00 H new ATOM 0 HD2 PHE A 150 -0.686 7.753 2.134 1.00 0.00 H new ATOM 0 HE1 PHE A 150 2.248 6.316 5.893 1.00 0.00 H new ATOM 0 HE2 PHE A 150 -1.595 7.600 4.445 1.00 0.00 H new ATOM 0 HZ PHE A 150 -0.121 6.900 6.306 1.00 0.00 H new ATOM 2194 N THR A 151 2.212 10.833 0.428 1.00 0.00 N ATOM 2195 CA THR A 151 1.871 12.238 0.558 1.00 0.00 C ATOM 2196 C THR A 151 0.809 12.554 -0.497 1.00 0.00 C ATOM 2197 O THR A 151 1.102 12.662 -1.688 1.00 0.00 O ATOM 2198 CB THR A 151 3.174 13.068 0.473 1.00 0.00 C ATOM 2199 OG1 THR A 151 4.024 12.623 -0.567 1.00 0.00 O ATOM 2200 CG2 THR A 151 3.967 12.941 1.778 1.00 0.00 C ATOM 0 H THR A 151 2.635 10.607 -0.472 1.00 0.00 H new ATOM 0 HA THR A 151 1.429 12.497 1.520 1.00 0.00 H new ATOM 0 HB THR A 151 2.870 14.097 0.284 1.00 0.00 H new ATOM 0 HG1 THR A 151 4.834 13.175 -0.586 1.00 0.00 H new ATOM 0 HG21 THR A 151 4.882 13.529 1.707 1.00 0.00 H new ATOM 0 HG22 THR A 151 3.363 13.308 2.608 1.00 0.00 H new ATOM 0 HG23 THR A 151 4.221 11.895 1.949 1.00 0.00 H new ATOM 2208 N LEU A 152 -0.455 12.617 -0.078 1.00 0.00 N ATOM 2209 CA LEU A 152 -1.591 12.843 -0.958 1.00 0.00 C ATOM 2210 C LEU A 152 -1.671 14.333 -1.265 1.00 0.00 C ATOM 2211 O LEU A 152 -1.758 15.151 -0.345 1.00 0.00 O ATOM 2212 CB LEU A 152 -2.907 12.370 -0.310 1.00 0.00 C ATOM 2213 CG LEU A 152 -3.057 10.864 -0.001 1.00 0.00 C ATOM 2214 CD1 LEU A 152 -2.508 9.967 -1.113 1.00 0.00 C ATOM 2215 CD2 LEU A 152 -2.403 10.445 1.322 1.00 0.00 C ATOM 0 H LEU A 152 -0.718 12.510 0.902 1.00 0.00 H new ATOM 0 HA LEU A 152 -1.452 12.269 -1.874 1.00 0.00 H new ATOM 0 HB2 LEU A 152 -3.037 12.918 0.623 1.00 0.00 H new ATOM 0 HB3 LEU A 152 -3.727 12.660 -0.967 1.00 0.00 H new ATOM 0 HG LEU A 152 -4.135 10.723 0.077 1.00 0.00 H new ATOM 0 HD11 LEU A 152 -2.643 8.921 -0.837 1.00 0.00 H new ATOM 0 HD12 LEU A 152 -3.043 10.169 -2.041 1.00 0.00 H new ATOM 0 HD13 LEU A 152 -1.447 10.171 -1.255 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -2.546 9.376 1.476 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -1.336 10.667 1.287 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -2.861 10.995 2.144 1.00 0.00 H new ATOM 2227 N GLU A 153 -1.618 14.662 -2.551 1.00 0.00 N ATOM 2228 CA GLU A 153 -1.987 15.959 -3.109 1.00 0.00 C ATOM 2229 C GLU A 153 -3.471 15.949 -3.521 1.00 0.00 C ATOM 2230 O GLU A 153 -4.121 14.900 -3.532 1.00 0.00 O ATOM 2231 CB GLU A 153 -1.077 16.252 -4.315 1.00 0.00 C ATOM 2232 CG GLU A 153 0.335 16.712 -3.926 1.00 0.00 C ATOM 2233 CD GLU A 153 0.356 18.120 -3.333 1.00 0.00 C ATOM 2234 OE1 GLU A 153 -0.160 19.059 -3.985 1.00 0.00 O ATOM 2235 OE2 GLU A 153 0.874 18.317 -2.211 1.00 0.00 O ATOM 0 H GLU A 153 -1.303 14.004 -3.264 1.00 0.00 H new ATOM 0 HA GLU A 153 -1.854 16.744 -2.364 1.00 0.00 H new ATOM 0 HB2 GLU A 153 -1.001 15.354 -4.928 1.00 0.00 H new ATOM 0 HB3 GLU A 153 -1.543 17.020 -4.932 1.00 0.00 H new ATOM 0 HG2 GLU A 153 0.754 16.012 -3.203 1.00 0.00 H new ATOM 0 HG3 GLU A 153 0.977 16.684 -4.806 1.00 0.00 H new ATOM 2242 N TYR A 154 -4.015 17.116 -3.880 1.00 0.00 N ATOM 2243 CA TYR A 154 -5.444 17.357 -4.092 1.00 0.00 C ATOM 2244 C TYR A 154 -5.645 18.076 -5.429 1.00 0.00 C ATOM 2245 O TYR A 154 -4.681 18.394 -6.129 1.00 0.00 O ATOM 2246 CB TYR A 154 -6.003 18.156 -2.896 1.00 0.00 C ATOM 2247 CG TYR A 154 -5.634 17.531 -1.562 1.00 0.00 C ATOM 2248 CD1 TYR A 154 -6.259 16.339 -1.146 1.00 0.00 C ATOM 2249 CD2 TYR A 154 -4.540 18.041 -0.833 1.00 0.00 C ATOM 2250 CE1 TYR A 154 -5.750 15.619 -0.050 1.00 0.00 C ATOM 2251 CE2 TYR A 154 -4.019 17.318 0.252 1.00 0.00 C ATOM 2252 CZ TYR A 154 -4.596 16.082 0.622 1.00 0.00 C ATOM 2253 OH TYR A 154 -3.968 15.298 1.540 1.00 0.00 O ATOM 0 H TYR A 154 -3.449 17.950 -4.037 1.00 0.00 H new ATOM 0 HA TYR A 154 -5.994 16.418 -4.145 1.00 0.00 H new ATOM 0 HB2 TYR A 154 -5.622 19.177 -2.934 1.00 0.00 H new ATOM 0 HB3 TYR A 154 -7.088 18.217 -2.978 1.00 0.00 H new ATOM 0 HD1 TYR A 154 -7.131 15.977 -1.670 1.00 0.00 H new ATOM 0 HD2 TYR A 154 -4.102 18.989 -1.110 1.00 0.00 H new ATOM 0 HE1 TYR A 154 -6.240 14.714 0.277 1.00 0.00 H new ATOM 0 HE2 TYR A 154 -3.176 17.707 0.804 1.00 0.00 H new ATOM 0 HH TYR A 154 -3.090 15.031 1.196 1.00 0.00 H new ATOM 2263 N GLN A 155 -6.891 18.327 -5.828 1.00 0.00 N ATOM 2264 CA GLN A 155 -7.224 18.955 -7.106 1.00 0.00 C ATOM 2265 C GLN A 155 -7.200 20.483 -6.974 1.00 0.00 C ATOM 2266 O GLN A 155 -8.167 21.167 -7.309 1.00 0.00 O ATOM 2267 CB GLN A 155 -8.561 18.383 -7.581 1.00 0.00 C ATOM 2268 CG GLN A 155 -8.841 18.656 -9.062 1.00 0.00 C ATOM 2269 CD GLN A 155 -10.114 17.937 -9.476 1.00 0.00 C ATOM 2270 OE1 GLN A 155 -10.056 16.822 -9.984 1.00 0.00 O ATOM 2271 NE2 GLN A 155 -11.272 18.510 -9.213 1.00 0.00 N ATOM 0 H GLN A 155 -7.709 18.097 -5.265 1.00 0.00 H new ATOM 0 HA GLN A 155 -6.481 18.728 -7.871 1.00 0.00 H new ATOM 0 HB2 GLN A 155 -8.571 17.307 -7.408 1.00 0.00 H new ATOM 0 HB3 GLN A 155 -9.365 18.809 -6.981 1.00 0.00 H new ATOM 0 HG2 GLN A 155 -8.944 19.728 -9.232 1.00 0.00 H new ATOM 0 HG3 GLN A 155 -8.003 18.315 -9.671 1.00 0.00 H new ATOM 0 HE21 GLN A 155 -11.298 19.438 -8.790 1.00 0.00 H new ATOM 0 HE22 GLN A 155 -12.142 18.025 -9.432 1.00 0.00 H new ATOM 2463 N ASP A 167 4.312 13.841 6.893 1.00 0.00 N ATOM 2464 CA ASP A 167 5.473 12.976 7.118 1.00 0.00 C ATOM 2465 C ASP A 167 5.025 11.561 7.505 1.00 0.00 C ATOM 2466 O ASP A 167 5.823 10.812 8.074 1.00 0.00 O ATOM 2467 CB ASP A 167 6.391 13.559 8.216 1.00 0.00 C ATOM 2468 CG ASP A 167 6.742 15.038 8.050 1.00 0.00 C ATOM 2469 OD1 ASP A 167 7.332 15.447 7.025 1.00 0.00 O ATOM 2470 OD2 ASP A 167 6.355 15.836 8.943 1.00 0.00 O ATOM 0 HA ASP A 167 6.037 12.924 6.187 1.00 0.00 H new ATOM 0 HB2 ASP A 167 5.907 13.423 9.183 1.00 0.00 H new ATOM 0 HB3 ASP A 167 7.316 12.982 8.239 1.00 0.00 H new ATOM 2475 N SER A 168 3.761 11.202 7.245 1.00 0.00 N ATOM 2476 CA SER A 168 3.102 9.941 7.580 1.00 0.00 C ATOM 2477 C SER A 168 3.991 8.744 7.226 1.00 0.00 C ATOM 2478 O SER A 168 4.110 8.381 6.054 1.00 0.00 O ATOM 2479 CB SER A 168 1.757 9.847 6.836 1.00 0.00 C ATOM 2480 OG SER A 168 1.080 11.091 6.760 1.00 0.00 O ATOM 0 H SER A 168 3.128 11.836 6.758 1.00 0.00 H new ATOM 0 HA SER A 168 2.922 9.918 8.655 1.00 0.00 H new ATOM 0 HB2 SER A 168 1.931 9.472 5.828 1.00 0.00 H new ATOM 0 HB3 SER A 168 1.118 9.122 7.340 1.00 0.00 H new ATOM 0 HG SER A 168 0.235 10.975 6.277 1.00 0.00 H new ATOM 2486 N THR A 169 4.661 8.172 8.223 1.00 0.00 N ATOM 2487 CA THR A 169 5.509 7.011 8.038 1.00 0.00 C ATOM 2488 C THR A 169 4.612 5.802 7.740 1.00 0.00 C ATOM 2489 O THR A 169 3.746 5.460 8.547 1.00 0.00 O ATOM 2490 CB THR A 169 6.385 6.814 9.287 1.00 0.00 C ATOM 2491 OG1 THR A 169 6.938 8.053 9.708 1.00 0.00 O ATOM 2492 CG2 THR A 169 7.550 5.868 9.001 1.00 0.00 C ATOM 0 H THR A 169 4.627 8.507 9.186 1.00 0.00 H new ATOM 0 HA THR A 169 6.188 7.141 7.195 1.00 0.00 H new ATOM 0 HB THR A 169 5.743 6.394 10.062 1.00 0.00 H new ATOM 0 HG1 THR A 169 7.491 7.911 10.504 1.00 0.00 H new ATOM 0 HG21 THR A 169 8.151 5.748 9.902 1.00 0.00 H new ATOM 0 HG22 THR A 169 7.163 4.897 8.691 1.00 0.00 H new ATOM 0 HG23 THR A 169 8.168 6.283 8.205 1.00 0.00 H new ATOM 2500 N ILE A 170 4.804 5.182 6.575 1.00 0.00 N ATOM 2501 CA ILE A 170 4.302 3.858 6.232 1.00 0.00 C ATOM 2502 C ILE A 170 5.265 2.873 6.886 1.00 0.00 C ATOM 2503 O ILE A 170 6.474 3.109 6.923 1.00 0.00 O ATOM 2504 CB ILE A 170 4.212 3.729 4.678 1.00 0.00 C ATOM 2505 CG1 ILE A 170 2.782 3.436 4.175 1.00 0.00 C ATOM 2506 CG2 ILE A 170 5.213 2.756 4.029 1.00 0.00 C ATOM 2507 CD1 ILE A 170 2.335 1.975 4.248 1.00 0.00 C ATOM 0 H ILE A 170 5.336 5.609 5.816 1.00 0.00 H new ATOM 0 HA ILE A 170 3.293 3.660 6.595 1.00 0.00 H new ATOM 0 HB ILE A 170 4.506 4.724 4.345 1.00 0.00 H new ATOM 0 HG12 ILE A 170 2.083 4.039 4.754 1.00 0.00 H new ATOM 0 HG13 ILE A 170 2.707 3.768 3.139 1.00 0.00 H new ATOM 0 HG21 ILE A 170 5.062 2.745 2.950 1.00 0.00 H new ATOM 0 HG22 ILE A 170 6.230 3.080 4.250 1.00 0.00 H new ATOM 0 HG23 ILE A 170 5.057 1.754 4.428 1.00 0.00 H new ATOM 0 HD11 ILE A 170 1.317 1.887 3.870 1.00 0.00 H new ATOM 0 HD12 ILE A 170 3.001 1.360 3.643 1.00 0.00 H new ATOM 0 HD13 ILE A 170 2.368 1.636 5.283 1.00 0.00 H new ATOM 2519 N THR A 171 4.753 1.769 7.413 1.00 0.00 N ATOM 2520 CA THR A 171 5.536 0.799 8.156 1.00 0.00 C ATOM 2521 C THR A 171 4.860 -0.549 7.936 1.00 0.00 C ATOM 2522 O THR A 171 3.937 -0.942 8.653 1.00 0.00 O ATOM 2523 CB THR A 171 5.656 1.316 9.609 1.00 0.00 C ATOM 2524 OG1 THR A 171 6.569 2.399 9.631 1.00 0.00 O ATOM 2525 CG2 THR A 171 6.159 0.299 10.626 1.00 0.00 C ATOM 0 H THR A 171 3.767 1.521 7.333 1.00 0.00 H new ATOM 0 HA THR A 171 6.568 0.664 7.833 1.00 0.00 H new ATOM 0 HB THR A 171 4.640 1.585 9.899 1.00 0.00 H new ATOM 0 HG1 THR A 171 6.653 2.737 10.547 1.00 0.00 H new ATOM 0 HG21 THR A 171 6.206 0.763 11.611 1.00 0.00 H new ATOM 0 HG22 THR A 171 5.478 -0.552 10.657 1.00 0.00 H new ATOM 0 HG23 THR A 171 7.153 -0.043 10.338 1.00 0.00 H new ATOM 2533 N ILE A 172 5.308 -1.266 6.904 1.00 0.00 N ATOM 2534 CA ILE A 172 4.731 -2.532 6.480 1.00 0.00 C ATOM 2535 C ILE A 172 5.590 -3.657 7.053 1.00 0.00 C ATOM 2536 O ILE A 172 6.821 -3.638 6.922 1.00 0.00 O ATOM 2537 CB ILE A 172 4.613 -2.596 4.944 1.00 0.00 C ATOM 2538 CG1 ILE A 172 3.882 -1.351 4.389 1.00 0.00 C ATOM 2539 CG2 ILE A 172 3.893 -3.901 4.550 1.00 0.00 C ATOM 2540 CD1 ILE A 172 4.033 -1.262 2.890 1.00 0.00 C ATOM 0 H ILE A 172 6.099 -0.972 6.331 1.00 0.00 H new ATOM 0 HA ILE A 172 3.715 -2.638 6.859 1.00 0.00 H new ATOM 0 HB ILE A 172 5.610 -2.596 4.503 1.00 0.00 H new ATOM 0 HG12 ILE A 172 2.825 -1.399 4.650 1.00 0.00 H new ATOM 0 HG13 ILE A 172 4.285 -0.451 4.853 1.00 0.00 H new ATOM 0 HG21 ILE A 172 3.805 -3.955 3.465 1.00 0.00 H new ATOM 0 HG22 ILE A 172 4.466 -4.756 4.910 1.00 0.00 H new ATOM 0 HG23 ILE A 172 2.898 -3.917 4.996 1.00 0.00 H new ATOM 0 HD11 ILE A 172 3.510 -0.378 2.523 1.00 0.00 H new ATOM 0 HD12 ILE A 172 5.090 -1.190 2.634 1.00 0.00 H new ATOM 0 HD13 ILE A 172 3.608 -2.153 2.428 1.00 0.00 H new ATOM 2552 N ARG A 173 4.928 -4.589 7.733 1.00 0.00 N ATOM 2553 CA ARG A 173 5.526 -5.726 8.404 1.00 0.00 C ATOM 2554 C ARG A 173 5.829 -6.802 7.382 1.00 0.00 C ATOM 2555 O ARG A 173 5.554 -6.695 6.184 1.00 0.00 O ATOM 2556 CB ARG A 173 4.563 -6.311 9.467 1.00 0.00 C ATOM 2557 CG ARG A 173 4.104 -5.347 10.554 1.00 0.00 C ATOM 2558 CD ARG A 173 5.238 -4.919 11.485 1.00 0.00 C ATOM 2559 NE ARG A 173 5.329 -5.689 12.724 1.00 0.00 N ATOM 2560 CZ ARG A 173 6.411 -5.713 13.504 1.00 0.00 C ATOM 2561 NH1 ARG A 173 7.517 -5.053 13.177 1.00 0.00 N ATOM 2562 NH2 ARG A 173 6.386 -6.399 14.633 1.00 0.00 N ATOM 0 H ARG A 173 3.913 -4.566 7.832 1.00 0.00 H new ATOM 0 HA ARG A 173 6.439 -5.394 8.898 1.00 0.00 H new ATOM 0 HB2 ARG A 173 3.681 -6.698 8.956 1.00 0.00 H new ATOM 0 HB3 ARG A 173 5.053 -7.160 9.945 1.00 0.00 H new ATOM 0 HG2 ARG A 173 3.669 -4.463 10.089 1.00 0.00 H new ATOM 0 HG3 ARG A 173 3.316 -5.818 11.142 1.00 0.00 H new ATOM 0 HD2 ARG A 173 6.183 -5.005 10.949 1.00 0.00 H new ATOM 0 HD3 ARG A 173 5.108 -3.866 11.735 1.00 0.00 H new ATOM 0 HE ARG A 173 4.519 -6.240 13.009 1.00 0.00 H new ATOM 0 HH11 ARG A 173 7.552 -4.512 12.313 1.00 0.00 H new ATOM 0 HH12 ARG A 173 8.331 -5.087 13.790 1.00 0.00 H new ATOM 0 HH21 ARG A 173 5.543 -6.906 14.903 1.00 0.00 H new ATOM 0 HH22 ARG A 173 7.210 -6.422 15.234 1.00 0.00 H new ATOM 2576 N GLY A 174 6.345 -7.891 7.915 1.00 0.00 N ATOM 2577 CA GLY A 174 6.622 -9.117 7.228 1.00 0.00 C ATOM 2578 C GLY A 174 7.784 -9.760 7.950 1.00 0.00 C ATOM 2579 O GLY A 174 8.576 -9.089 8.626 1.00 0.00 O ATOM 0 H GLY A 174 6.595 -7.937 8.903 1.00 0.00 H new ATOM 0 HA2 GLY A 174 5.750 -9.771 7.236 1.00 0.00 H new ATOM 0 HA3 GLY A 174 6.870 -8.929 6.183 1.00 0.00 H new ATOM 2583 N TYR A 175 7.933 -11.059 7.779 1.00 0.00 N ATOM 2584 CA TYR A 175 9.065 -11.793 8.285 1.00 0.00 C ATOM 2585 C TYR A 175 9.315 -12.885 7.275 1.00 0.00 C ATOM 2586 O TYR A 175 8.426 -13.690 6.988 1.00 0.00 O ATOM 2587 CB TYR A 175 8.785 -12.311 9.695 1.00 0.00 C ATOM 2588 CG TYR A 175 9.849 -13.246 10.211 1.00 0.00 C ATOM 2589 CD1 TYR A 175 9.769 -14.615 9.906 1.00 0.00 C ATOM 2590 CD2 TYR A 175 10.930 -12.745 10.957 1.00 0.00 C ATOM 2591 CE1 TYR A 175 10.797 -15.478 10.310 1.00 0.00 C ATOM 2592 CE2 TYR A 175 11.947 -13.613 11.386 1.00 0.00 C ATOM 2593 CZ TYR A 175 11.905 -14.976 11.022 1.00 0.00 C ATOM 2594 OH TYR A 175 12.930 -15.816 11.313 1.00 0.00 O ATOM 0 H TYR A 175 7.259 -11.638 7.277 1.00 0.00 H new ATOM 0 HA TYR A 175 9.958 -11.177 8.394 1.00 0.00 H new ATOM 0 HB2 TYR A 175 8.696 -11.463 10.375 1.00 0.00 H new ATOM 0 HB3 TYR A 175 7.825 -12.827 9.701 1.00 0.00 H new ATOM 0 HD1 TYR A 175 8.919 -15.001 9.363 1.00 0.00 H new ATOM 0 HD2 TYR A 175 10.978 -11.694 11.200 1.00 0.00 H new ATOM 0 HE1 TYR A 175 10.740 -16.531 10.075 1.00 0.00 H new ATOM 0 HE2 TYR A 175 12.759 -13.239 11.992 1.00 0.00 H new ATOM 0 HH TYR A 175 13.623 -15.328 11.806 1.00 0.00 H new ATOM 2604 N VAL A 176 10.495 -12.865 6.668 1.00 0.00 N ATOM 2605 CA VAL A 176 10.881 -13.896 5.722 1.00 0.00 C ATOM 2606 C VAL A 176 11.327 -15.086 6.552 1.00 0.00 C ATOM 2607 O VAL A 176 12.291 -15.028 7.313 1.00 0.00 O ATOM 2608 CB VAL A 176 11.916 -13.396 4.700 1.00 0.00 C ATOM 2609 CG1 VAL A 176 11.272 -12.467 3.674 1.00 0.00 C ATOM 2610 CG2 VAL A 176 12.984 -12.578 5.349 1.00 0.00 C ATOM 0 H VAL A 176 11.200 -12.143 6.817 1.00 0.00 H new ATOM 0 HA VAL A 176 10.047 -14.195 5.087 1.00 0.00 H new ATOM 0 HB VAL A 176 12.326 -14.294 4.239 1.00 0.00 H new ATOM 0 HG11 VAL A 176 12.027 -12.129 2.964 1.00 0.00 H new ATOM 0 HG12 VAL A 176 10.487 -13.003 3.141 1.00 0.00 H new ATOM 0 HG13 VAL A 176 10.841 -11.605 4.183 1.00 0.00 H new ATOM 0 HG21 VAL A 176 13.696 -12.244 4.594 1.00 0.00 H new ATOM 0 HG22 VAL A 176 12.535 -11.711 5.833 1.00 0.00 H new ATOM 0 HG23 VAL A 176 13.502 -13.182 6.094 1.00 0.00 H new ATOM 2620 N ARG A 177 10.583 -16.162 6.388 1.00 0.00 N ATOM 2621 CA ARG A 177 10.858 -17.452 6.972 1.00 0.00 C ATOM 2622 C ARG A 177 11.949 -18.034 6.084 1.00 0.00 C ATOM 2623 O ARG A 177 11.866 -17.856 4.868 1.00 0.00 O ATOM 2624 CB ARG A 177 9.582 -18.297 6.832 1.00 0.00 C ATOM 2625 CG ARG A 177 8.364 -17.654 7.495 1.00 0.00 C ATOM 2626 CD ARG A 177 8.115 -18.262 8.880 1.00 0.00 C ATOM 2627 NE ARG A 177 6.747 -18.026 9.359 1.00 0.00 N ATOM 2628 CZ ARG A 177 5.627 -18.561 8.854 1.00 0.00 C ATOM 2629 NH1 ARG A 177 5.651 -19.324 7.755 1.00 0.00 N ATOM 2630 NH2 ARG A 177 4.483 -18.319 9.477 1.00 0.00 N ATOM 0 H ARG A 177 9.736 -16.157 5.820 1.00 0.00 H new ATOM 0 HA ARG A 177 11.154 -17.415 8.021 1.00 0.00 H new ATOM 0 HB2 ARG A 177 9.372 -18.455 5.774 1.00 0.00 H new ATOM 0 HB3 ARG A 177 9.753 -19.279 7.273 1.00 0.00 H new ATOM 0 HG2 ARG A 177 8.519 -16.579 7.587 1.00 0.00 H new ATOM 0 HG3 ARG A 177 7.485 -17.796 6.867 1.00 0.00 H new ATOM 0 HD2 ARG A 177 8.303 -19.335 8.842 1.00 0.00 H new ATOM 0 HD3 ARG A 177 8.824 -17.839 9.592 1.00 0.00 H new ATOM 0 HE ARG A 177 6.639 -17.394 10.152 1.00 0.00 H new ATOM 0 HH11 ARG A 177 6.536 -19.510 7.282 1.00 0.00 H new ATOM 0 HH12 ARG A 177 4.785 -19.720 7.390 1.00 0.00 H new ATOM 0 HH21 ARG A 177 4.472 -17.740 10.316 1.00 0.00 H new ATOM 0 HH22 ARG A 177 3.613 -18.712 9.117 1.00 0.00 H new ATOM 2644 N ASP A 178 12.986 -18.675 6.614 1.00 0.00 N ATOM 2645 CA ASP A 178 13.978 -19.251 5.699 1.00 0.00 C ATOM 2646 C ASP A 178 13.383 -20.384 4.854 1.00 0.00 C ATOM 2647 O ASP A 178 13.886 -20.664 3.766 1.00 0.00 O ATOM 2648 CB ASP A 178 15.298 -19.611 6.390 1.00 0.00 C ATOM 2649 CG ASP A 178 15.479 -21.092 6.706 1.00 0.00 C ATOM 2650 OD1 ASP A 178 15.843 -21.870 5.790 1.00 0.00 O ATOM 2651 OD2 ASP A 178 15.351 -21.443 7.896 1.00 0.00 O ATOM 0 H ASP A 178 13.162 -18.807 7.610 1.00 0.00 H new ATOM 0 HA ASP A 178 14.252 -18.467 4.993 1.00 0.00 H new ATOM 0 HB2 ASP A 178 16.123 -19.287 5.755 1.00 0.00 H new ATOM 0 HB3 ASP A 178 15.370 -19.046 7.319 1.00 0.00 H new ATOM 2656 N ASN A 179 12.267 -20.962 5.304 1.00 0.00 N ATOM 2657 CA ASN A 179 11.577 -22.118 4.753 1.00 0.00 C ATOM 2658 C ASN A 179 10.132 -21.805 4.412 1.00 0.00 C ATOM 2659 O ASN A 179 9.604 -20.802 4.935 1.00 0.00 O ATOM 2660 CB ASN A 179 11.665 -23.275 5.756 1.00 0.00 C ATOM 2661 CG ASN A 179 10.994 -23.058 7.115 1.00 0.00 C ATOM 2662 OD1 ASN A 179 11.226 -23.823 8.046 1.00 0.00 O ATOM 2663 ND2 ASN A 179 10.169 -22.048 7.323 1.00 0.00 N ATOM 0 H ASN A 179 11.789 -20.601 6.129 1.00 0.00 H new ATOM 0 HA ASN A 179 12.063 -22.403 3.820 1.00 0.00 H new ATOM 0 HB2 ASN A 179 11.224 -24.159 5.296 1.00 0.00 H new ATOM 0 HB3 ASN A 179 12.718 -23.497 5.928 1.00 0.00 H new ATOM 0 HD21 ASN A 179 9.742 -21.919 8.240 1.00 0.00 H new ATOM 0 HD22 ASN A 179 9.959 -21.397 6.566 1.00 0.00 H new