USER MOD reduce.3.24.130724 H: found=0, std=0, add=840, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 846 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: B 312 ASN : amide:sc= -0.253 K(o=-0.17,f=-2.4) USER MOD Set 1.2: B 316 ASN : amide:sc= 0.0823 X(o=-0.17,f=-0.36) USER MOD Set 2.1: B 306 HIS : no HD1:sc= -0.751 K(o=-1.5,f=-2.6!) USER MOD Set 2.2: B 378 GLN :FLIP amide:sc= -0.771 F(o=-2.7,f=-1.5) USER MOD Set 3.1: B 305 ASN : amide:sc= -0.0719 X(o=-0.14,f=-0.44) USER MOD Set 3.2: B 309 ASN : amide:sc= -0.0702 K(o=-0.14,f=-1.9) USER MOD Set 4.1: A 8 ASN :FLIP amide:sc= -0.376 F(o=-5,f=-1.9) USER MOD Set 4.2: A 10 GLN : amide:sc= 0 X(o=-1.9,f=-2) USER MOD Set 4.3: B 336 GLN : amide:sc= -1.54 K(o=-1.9,f=-5!) USER MOD Set 5.1: A 7 MET CE :methyl -178:sc= -2.22 (180deg=-2.19!) USER MOD Set 5.2: A 11 MET CE :methyl -157:sc= -4.19! (180deg=-5.47!) USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : B 295 SER OG : rot 44:sc= 0.584 USER MOD Single : B 297 GLN : amide:sc= -0.742 K(o=-0.74,f=-2.6!) USER MOD Single : B 298 ASN : amide:sc= -0.0182 K(o=-0.018,f=-0.84) USER MOD Single : B 299 ASN : amide:sc= -0.23 K(o=-0.23,f=-3.1) USER MOD Single : B 300 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 310 TYR OH : rot 28:sc= -1.38! USER MOD Single : B 313 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 315 LYS NZ :NH3+ -143:sc= -4.36! (180deg=-7.24!) USER MOD Single : B 319 GLN : amide:sc= -1.07 K(o=-1.1,f=-3.6!) USER MOD Single : B 321 GLN :FLIP amide:sc= -0.015 F(o=-1.5,f=-0.015) USER MOD Single : B 325 TYR OH : rot -150:sc= -3.41 USER MOD Single : B 326 LYS NZ :NH3+ -167:sc= -0.0206 (180deg=-0.188) USER MOD Single : B 333 HIS :FLIP no HD1:sc= -3.39! C(o=-4.4!,f=-3.4!) USER MOD Single : B 334 THR OG1 : rot 180:sc= 0 USER MOD Single : B 335 TYR OH : rot -24:sc= -0.0793 USER MOD Single : B 337 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 339 GLN : amide:sc= -2.08 X(o=-2.1,f=-1.9) USER MOD Single : B 341 ASN :FLIP amide:sc= -0.221 F(o=-0.9,f=-0.22) USER MOD Single : B 343 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0297) USER MOD Single : B 348 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 349 TYR OH : rot 30:sc= -1.45 USER MOD Single : B 350 THR OG1 : rot 180:sc= 0 USER MOD Single : B 354 THR OG1 : rot 180:sc= 0 USER MOD Single : B 356 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 359 TYR OH : rot 180:sc= 0 USER MOD Single : B 361 GLN :FLIP amide:sc= -0.855 F(o=-3!,f=-0.85) USER MOD Single : B 367 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 368 ASN : amide:sc= -0.285 X(o=-0.28,f=-0.63) USER MOD Single : B 369 GLN : amide:sc= -2.57 K(o=-2.6,f=-7.8!) USER MOD Single : B 374 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 6 2.895 13.049 -6.544 1.00 0.00 N ATOM 2 CA ARG A 6 3.492 12.214 -5.463 1.00 0.00 C ATOM 3 C ARG A 6 2.894 10.807 -5.458 1.00 0.00 C ATOM 4 O ARG A 6 1.718 10.623 -5.781 1.00 0.00 O ATOM 5 CB ARG A 6 3.249 12.896 -4.111 1.00 0.00 C ATOM 6 CG ARG A 6 3.919 14.256 -3.981 1.00 0.00 C ATOM 7 CD ARG A 6 3.713 14.852 -2.597 1.00 0.00 C ATOM 8 NE ARG A 6 4.312 16.183 -2.476 1.00 0.00 N ATOM 9 CZ ARG A 6 4.297 16.910 -1.356 1.00 0.00 C ATOM 10 NH1 ARG A 6 3.730 16.437 -0.249 1.00 0.00 N ATOM 11 NH2 ARG A 6 4.857 18.116 -1.342 1.00 0.00 N ATOM 0 HA ARG A 6 4.563 12.119 -5.643 1.00 0.00 H new ATOM 0 HB2 ARG A 6 2.176 13.014 -3.962 1.00 0.00 H new ATOM 0 HB3 ARG A 6 3.612 12.245 -3.316 1.00 0.00 H new ATOM 0 HG2 ARG A 6 4.986 14.157 -4.180 1.00 0.00 H new ATOM 0 HG3 ARG A 6 3.516 14.934 -4.733 1.00 0.00 H new ATOM 0 HD2 ARG A 6 2.646 14.915 -2.385 1.00 0.00 H new ATOM 0 HD3 ARG A 6 4.148 14.190 -1.849 1.00 0.00 H new ATOM 0 HE ARG A 6 4.769 16.579 -3.298 1.00 0.00 H new ATOM 0 HH11 ARG A 6 3.302 15.511 -0.251 1.00 0.00 H new ATOM 0 HH12 ARG A 6 3.724 17.000 0.601 1.00 0.00 H new ATOM 0 HH21 ARG A 6 5.297 18.484 -2.186 1.00 0.00 H new ATOM 0 HH22 ARG A 6 4.847 18.673 -0.488 1.00 0.00 H new ATOM 27 N MET A 7 3.711 9.819 -5.091 1.00 0.00 N ATOM 28 CA MET A 7 3.264 8.427 -5.048 1.00 0.00 C ATOM 29 C MET A 7 3.409 7.833 -3.646 1.00 0.00 C ATOM 30 O MET A 7 4.043 8.424 -2.769 1.00 0.00 O ATOM 31 CB MET A 7 4.051 7.583 -6.054 1.00 0.00 C ATOM 32 CG MET A 7 3.862 8.013 -7.502 1.00 0.00 C ATOM 33 SD MET A 7 2.132 7.997 -8.018 1.00 0.00 S ATOM 34 CE MET A 7 1.693 6.288 -7.712 1.00 0.00 C ATOM 0 H MET A 7 4.685 9.957 -4.820 1.00 0.00 H new ATOM 0 HA MET A 7 2.207 8.413 -5.314 1.00 0.00 H new ATOM 0 HB2 MET A 7 5.111 7.634 -5.806 1.00 0.00 H new ATOM 0 HB3 MET A 7 3.750 6.540 -5.953 1.00 0.00 H new ATOM 0 HG2 MET A 7 4.266 9.017 -7.634 1.00 0.00 H new ATOM 0 HG3 MET A 7 4.436 7.351 -8.150 1.00 0.00 H new ATOM 0 HE1 MET A 7 0.661 6.117 -8.017 1.00 0.00 H new ATOM 0 HE2 MET A 7 2.353 5.635 -8.283 1.00 0.00 H new ATOM 0 HE3 MET A 7 1.798 6.070 -6.649 1.00 0.00 H new ATOM 44 N ASN A 8 2.806 6.658 -3.449 1.00 0.00 N ATOM 45 CA ASN A 8 2.847 5.958 -2.162 1.00 0.00 C ATOM 46 C ASN A 8 2.149 4.584 -2.263 1.00 0.00 C ATOM 47 O ASN A 8 2.482 3.792 -3.145 1.00 0.00 O ATOM 48 CB ASN A 8 2.232 6.838 -1.049 1.00 0.00 C ATOM 49 CG ASN A 8 0.821 7.360 -1.338 1.00 0.00 C ATOM 50 OD1 ASN A 8 0.190 6.921 -2.430 1.00 0.00 O flip ATOM 51 ND2 ASN A 8 0.289 8.155 -0.563 1.00 0.00 N flip ATOM 0 H ASN A 8 2.279 6.167 -4.171 1.00 0.00 H new ATOM 0 HA ASN A 8 3.888 5.772 -1.897 1.00 0.00 H new ATOM 0 HB2 ASN A 8 2.207 6.262 -0.124 1.00 0.00 H new ATOM 0 HB3 ASN A 8 2.889 7.690 -0.876 1.00 0.00 H new ATOM 0 HD21 ASN A 8 0.792 8.475 0.264 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -0.655 8.494 -0.748 1.00 0.00 H new ATOM 58 N ILE A 9 1.189 4.302 -1.370 1.00 0.00 N ATOM 59 CA ILE A 9 0.466 3.025 -1.390 1.00 0.00 C ATOM 60 C ILE A 9 -0.330 2.828 -2.659 1.00 0.00 C ATOM 61 O ILE A 9 -0.372 1.723 -3.203 1.00 0.00 O ATOM 62 CB ILE A 9 -0.541 2.888 -0.239 1.00 0.00 C ATOM 63 CG1 ILE A 9 -1.318 4.189 -0.012 1.00 0.00 C ATOM 64 CG2 ILE A 9 0.146 2.430 1.015 1.00 0.00 C ATOM 65 CD1 ILE A 9 -2.511 4.025 0.898 1.00 0.00 C ATOM 0 H ILE A 9 0.897 4.939 -0.629 1.00 0.00 H new ATOM 0 HA ILE A 9 1.257 2.280 -1.302 1.00 0.00 H new ATOM 0 HB ILE A 9 -1.269 2.127 -0.520 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -0.646 4.935 0.413 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -1.655 4.575 -0.974 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -0.585 2.339 1.818 1.00 0.00 H new ATOM 0 HG22 ILE A 9 0.615 1.462 0.840 1.00 0.00 H new ATOM 0 HG23 ILE A 9 0.908 3.156 1.298 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -3.014 4.985 1.015 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -3.203 3.303 0.464 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -2.179 3.669 1.873 1.00 0.00 H new ATOM 77 N GLN A 10 -1.006 3.885 -3.093 1.00 0.00 N ATOM 78 CA GLN A 10 -1.850 3.803 -4.266 1.00 0.00 C ATOM 79 C GLN A 10 -1.123 3.123 -5.424 1.00 0.00 C ATOM 80 O GLN A 10 -1.721 2.346 -6.170 1.00 0.00 O ATOM 81 CB GLN A 10 -2.345 5.191 -4.681 1.00 0.00 C ATOM 82 CG GLN A 10 -3.280 5.174 -5.879 1.00 0.00 C ATOM 83 CD GLN A 10 -3.765 6.562 -6.261 1.00 0.00 C ATOM 84 OE1 GLN A 10 -4.413 7.245 -5.466 1.00 0.00 O ATOM 85 NE2 GLN A 10 -3.455 6.986 -7.481 1.00 0.00 N ATOM 0 H GLN A 10 -0.983 4.803 -2.649 1.00 0.00 H new ATOM 0 HA GLN A 10 -2.716 3.193 -4.008 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -2.859 5.651 -3.837 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -1.485 5.820 -4.912 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -2.767 4.726 -6.730 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -4.139 4.542 -5.656 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -2.916 6.388 -8.107 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -3.755 7.910 -7.791 1.00 0.00 H new ATOM 94 N MET A 11 0.176 3.406 -5.552 1.00 0.00 N ATOM 95 CA MET A 11 0.999 2.811 -6.598 1.00 0.00 C ATOM 96 C MET A 11 0.854 1.288 -6.588 1.00 0.00 C ATOM 97 O MET A 11 0.611 0.674 -7.627 1.00 0.00 O ATOM 98 CB MET A 11 2.464 3.203 -6.393 1.00 0.00 C ATOM 99 CG MET A 11 3.398 2.684 -7.469 1.00 0.00 C ATOM 100 SD MET A 11 5.128 3.041 -7.111 1.00 0.00 S ATOM 101 CE MET A 11 5.122 4.830 -7.098 1.00 0.00 C ATOM 0 H MET A 11 0.679 4.047 -4.939 1.00 0.00 H new ATOM 0 HA MET A 11 0.663 3.184 -7.565 1.00 0.00 H new ATOM 0 HB2 MET A 11 2.537 4.290 -6.357 1.00 0.00 H new ATOM 0 HB3 MET A 11 2.798 2.829 -5.425 1.00 0.00 H new ATOM 0 HG2 MET A 11 3.266 1.607 -7.572 1.00 0.00 H new ATOM 0 HG3 MET A 11 3.129 3.131 -8.426 1.00 0.00 H new ATOM 0 HE1 MET A 11 6.128 5.199 -7.298 1.00 0.00 H new ATOM 0 HE2 MET A 11 4.441 5.197 -7.866 1.00 0.00 H new ATOM 0 HE3 MET A 11 4.793 5.186 -6.122 1.00 0.00 H new ATOM 111 N LEU A 12 0.986 0.690 -5.400 1.00 0.00 N ATOM 112 CA LEU A 12 0.853 -0.758 -5.249 1.00 0.00 C ATOM 113 C LEU A 12 -0.570 -1.205 -5.551 1.00 0.00 C ATOM 114 O LEU A 12 -0.786 -2.090 -6.374 1.00 0.00 O ATOM 115 CB LEU A 12 1.177 -1.202 -3.827 1.00 0.00 C ATOM 116 CG LEU A 12 2.536 -0.793 -3.267 1.00 0.00 C ATOM 117 CD1 LEU A 12 2.372 -0.180 -1.883 1.00 0.00 C ATOM 118 CD2 LEU A 12 3.459 -1.999 -3.201 1.00 0.00 C ATOM 0 H LEU A 12 1.184 1.187 -4.532 1.00 0.00 H new ATOM 0 HA LEU A 12 1.555 -1.209 -5.950 1.00 0.00 H new ATOM 0 HB2 LEU A 12 0.405 -0.809 -3.165 1.00 0.00 H new ATOM 0 HB3 LEU A 12 1.107 -2.289 -3.787 1.00 0.00 H new ATOM 0 HG LEU A 12 2.978 -0.048 -3.929 1.00 0.00 H new ATOM 0 HD11 LEU A 12 3.349 0.108 -1.494 1.00 0.00 H new ATOM 0 HD12 LEU A 12 1.734 0.701 -1.949 1.00 0.00 H new ATOM 0 HD13 LEU A 12 1.916 -0.909 -1.214 1.00 0.00 H new ATOM 0 HD21 LEU A 12 4.426 -1.696 -2.800 1.00 0.00 H new ATOM 0 HD22 LEU A 12 3.020 -2.758 -2.554 1.00 0.00 H new ATOM 0 HD23 LEU A 12 3.594 -2.409 -4.202 1.00 0.00 H new ATOM 130 N LEU A 13 -1.533 -0.597 -4.848 1.00 0.00 N ATOM 131 CA LEU A 13 -2.952 -0.933 -5.006 1.00 0.00 C ATOM 132 C LEU A 13 -3.333 -1.120 -6.474 1.00 0.00 C ATOM 133 O LEU A 13 -3.809 -2.187 -6.861 1.00 0.00 O ATOM 134 CB LEU A 13 -3.829 0.160 -4.382 1.00 0.00 C ATOM 135 CG LEU A 13 -3.606 0.411 -2.888 1.00 0.00 C ATOM 136 CD1 LEU A 13 -4.392 1.631 -2.429 1.00 0.00 C ATOM 137 CD2 LEU A 13 -4.002 -0.816 -2.080 1.00 0.00 C ATOM 0 H LEU A 13 -1.353 0.135 -4.160 1.00 0.00 H new ATOM 0 HA LEU A 13 -3.121 -1.879 -4.491 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -3.655 1.092 -4.919 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -4.875 -0.106 -4.536 1.00 0.00 H new ATOM 0 HG LEU A 13 -2.546 0.605 -2.724 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -4.222 1.794 -1.365 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -4.063 2.507 -2.988 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -5.455 1.466 -2.605 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -3.838 -0.622 -1.020 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -5.056 -1.039 -2.249 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -3.397 -1.667 -2.391 1.00 0.00 H new ATOM 149 N GLU A 14 -3.109 -0.080 -7.286 1.00 0.00 N ATOM 150 CA GLU A 14 -3.419 -0.137 -8.718 1.00 0.00 C ATOM 151 C GLU A 14 -2.819 -1.393 -9.345 1.00 0.00 C ATOM 152 O GLU A 14 -3.441 -2.037 -10.191 1.00 0.00 O ATOM 153 CB GLU A 14 -2.886 1.111 -9.433 1.00 0.00 C ATOM 154 CG GLU A 14 -3.490 2.422 -8.944 1.00 0.00 C ATOM 155 CD GLU A 14 -4.991 2.509 -9.162 1.00 0.00 C ATOM 156 OE1 GLU A 14 -5.736 1.733 -8.525 1.00 0.00 O ATOM 157 OE2 GLU A 14 -5.423 3.354 -9.973 1.00 0.00 O ATOM 0 H GLU A 14 -2.715 0.809 -6.976 1.00 0.00 H new ATOM 0 HA GLU A 14 -4.503 -0.171 -8.832 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -1.804 1.154 -9.306 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -3.078 1.013 -10.501 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -3.277 2.539 -7.881 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -3.006 3.252 -9.459 1.00 0.00 H new ATOM 164 N ALA A 15 -1.611 -1.740 -8.903 1.00 0.00 N ATOM 165 CA ALA A 15 -0.914 -2.924 -9.389 1.00 0.00 C ATOM 166 C ALA A 15 -1.598 -4.195 -8.925 1.00 0.00 C ATOM 167 O ALA A 15 -1.895 -5.069 -9.735 1.00 0.00 O ATOM 168 CB ALA A 15 0.517 -2.928 -8.899 1.00 0.00 C ATOM 0 H ALA A 15 -1.093 -1.210 -8.202 1.00 0.00 H new ATOM 0 HA ALA A 15 -0.933 -2.892 -10.478 1.00 0.00 H new ATOM 0 HB1 ALA A 15 1.026 -3.818 -9.269 1.00 0.00 H new ATOM 0 HB2 ALA A 15 1.029 -2.038 -9.265 1.00 0.00 H new ATOM 0 HB3 ALA A 15 0.528 -2.931 -7.809 1.00 0.00 H new ATOM 174 N ALA A 16 -1.828 -4.299 -7.610 1.00 0.00 N ATOM 175 CA ALA A 16 -2.462 -5.479 -7.033 1.00 0.00 C ATOM 176 C ALA A 16 -3.659 -5.935 -7.867 1.00 0.00 C ATOM 177 O ALA A 16 -3.886 -7.131 -8.026 1.00 0.00 O ATOM 178 CB ALA A 16 -2.902 -5.224 -5.605 1.00 0.00 C ATOM 0 H ALA A 16 -1.583 -3.578 -6.931 1.00 0.00 H new ATOM 0 HA ALA A 16 -1.715 -6.273 -7.034 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -3.371 -6.122 -5.203 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -2.035 -4.964 -4.998 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -3.617 -4.402 -5.586 1.00 0.00 H new ATOM 184 N ASP A 17 -4.413 -4.968 -8.403 1.00 0.00 N ATOM 185 CA ASP A 17 -5.581 -5.264 -9.235 1.00 0.00 C ATOM 186 C ASP A 17 -5.179 -6.103 -10.447 1.00 0.00 C ATOM 187 O ASP A 17 -5.812 -7.114 -10.751 1.00 0.00 O ATOM 188 CB ASP A 17 -6.249 -3.964 -9.698 1.00 0.00 C ATOM 189 CG ASP A 17 -6.756 -3.120 -8.541 1.00 0.00 C ATOM 190 OD1 ASP A 17 -7.622 -3.607 -7.783 1.00 0.00 O ATOM 191 OD2 ASP A 17 -6.284 -1.972 -8.392 1.00 0.00 O ATOM 0 H ASP A 17 -4.233 -3.972 -8.274 1.00 0.00 H new ATOM 0 HA ASP A 17 -6.292 -5.833 -8.636 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -5.536 -3.382 -10.282 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -7.082 -4.204 -10.359 1.00 0.00 H new ATOM 196 N TYR A 18 -4.108 -5.678 -11.123 1.00 0.00 N ATOM 197 CA TYR A 18 -3.599 -6.390 -12.293 1.00 0.00 C ATOM 198 C TYR A 18 -2.840 -7.640 -11.868 1.00 0.00 C ATOM 199 O TYR A 18 -3.076 -8.727 -12.400 1.00 0.00 O ATOM 200 CB TYR A 18 -2.706 -5.459 -13.129 1.00 0.00 C ATOM 201 CG TYR A 18 -1.992 -6.134 -14.286 1.00 0.00 C ATOM 202 CD1 TYR A 18 -0.963 -7.043 -14.060 1.00 0.00 C ATOM 203 CD2 TYR A 18 -2.344 -5.858 -15.602 1.00 0.00 C ATOM 204 CE1 TYR A 18 -0.309 -7.655 -15.112 1.00 0.00 C ATOM 205 CE2 TYR A 18 -1.694 -6.468 -16.658 1.00 0.00 C ATOM 206 CZ TYR A 18 -0.678 -7.365 -16.407 1.00 0.00 C ATOM 207 OH TYR A 18 -0.028 -7.972 -17.457 1.00 0.00 O ATOM 0 H TYR A 18 -3.577 -4.842 -10.877 1.00 0.00 H new ATOM 0 HA TYR A 18 -4.441 -6.703 -12.910 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -3.318 -4.647 -13.522 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -1.961 -5.008 -12.474 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -0.671 -7.274 -13.046 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -3.139 -5.155 -15.803 1.00 0.00 H new ATOM 0 HE1 TYR A 18 0.488 -8.358 -14.920 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -1.981 -6.243 -17.675 1.00 0.00 H new ATOM 0 HH TYR A 18 -0.410 -7.659 -18.303 1.00 0.00 H new ATOM 217 N LEU A 19 -1.950 -7.484 -10.891 1.00 0.00 N ATOM 218 CA LEU A 19 -1.175 -8.603 -10.369 1.00 0.00 C ATOM 219 C LEU A 19 -2.113 -9.725 -9.945 1.00 0.00 C ATOM 220 O LEU A 19 -1.812 -10.905 -10.128 1.00 0.00 O ATOM 221 CB LEU A 19 -0.349 -8.162 -9.157 1.00 0.00 C ATOM 222 CG LEU A 19 0.528 -6.931 -9.370 1.00 0.00 C ATOM 223 CD1 LEU A 19 1.067 -6.436 -8.039 1.00 0.00 C ATOM 224 CD2 LEU A 19 1.672 -7.239 -10.326 1.00 0.00 C ATOM 0 H LEU A 19 -1.748 -6.589 -10.444 1.00 0.00 H new ATOM 0 HA LEU A 19 -0.505 -8.954 -11.153 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -1.029 -7.963 -8.329 1.00 0.00 H new ATOM 0 HB3 LEU A 19 0.289 -8.992 -8.853 1.00 0.00 H new ATOM 0 HG LEU A 19 -0.083 -6.146 -9.816 1.00 0.00 H new ATOM 0 HD11 LEU A 19 1.691 -5.558 -8.203 1.00 0.00 H new ATOM 0 HD12 LEU A 19 0.236 -6.173 -7.385 1.00 0.00 H new ATOM 0 HD13 LEU A 19 1.662 -7.221 -7.572 1.00 0.00 H new ATOM 0 HD21 LEU A 19 2.283 -6.347 -10.462 1.00 0.00 H new ATOM 0 HD22 LEU A 19 2.286 -8.039 -9.913 1.00 0.00 H new ATOM 0 HD23 LEU A 19 1.268 -7.552 -11.289 1.00 0.00 H new ATOM 236 N GLU A 20 -3.258 -9.329 -9.372 1.00 0.00 N ATOM 237 CA GLU A 20 -4.271 -10.272 -8.897 1.00 0.00 C ATOM 238 C GLU A 20 -4.403 -11.470 -9.838 1.00 0.00 C ATOM 239 O GLU A 20 -4.200 -12.614 -9.429 1.00 0.00 O ATOM 240 CB GLU A 20 -5.620 -9.563 -8.761 1.00 0.00 C ATOM 241 CG GLU A 20 -6.406 -9.998 -7.542 1.00 0.00 C ATOM 242 CD GLU A 20 -7.742 -9.287 -7.418 1.00 0.00 C ATOM 243 OE1 GLU A 20 -8.590 -9.457 -8.321 1.00 0.00 O ATOM 244 OE2 GLU A 20 -7.938 -8.561 -6.423 1.00 0.00 O ATOM 0 H GLU A 20 -3.504 -8.350 -9.227 1.00 0.00 H new ATOM 0 HA GLU A 20 -3.955 -10.644 -7.922 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -5.454 -8.487 -8.712 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -6.214 -9.753 -9.655 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -6.575 -11.074 -7.589 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -5.814 -9.808 -6.647 1.00 0.00 H new ATOM 251 N ARG A 21 -4.735 -11.195 -11.099 1.00 0.00 N ATOM 252 CA ARG A 21 -4.883 -12.246 -12.103 1.00 0.00 C ATOM 253 C ARG A 21 -3.523 -12.817 -12.501 1.00 0.00 C ATOM 254 O ARG A 21 -2.658 -12.034 -12.955 1.00 0.00 O ATOM 255 CB ARG A 21 -5.613 -11.704 -13.334 1.00 0.00 C ATOM 256 CG ARG A 21 -7.028 -11.228 -13.041 1.00 0.00 C ATOM 257 CD ARG A 21 -7.676 -10.605 -14.266 1.00 0.00 C ATOM 258 NE ARG A 21 -6.977 -9.397 -14.708 1.00 0.00 N ATOM 259 CZ ARG A 21 -7.332 -8.675 -15.773 1.00 0.00 C ATOM 260 NH1 ARG A 21 -8.373 -9.037 -16.519 1.00 0.00 N ATOM 261 NH2 ARG A 21 -6.639 -7.587 -16.097 1.00 0.00 N ATOM 262 OXT ARG A 21 -3.331 -14.042 -12.350 1.00 0.00 O ATOM 0 H ARG A 21 -4.906 -10.252 -11.449 1.00 0.00 H new ATOM 0 HA ARG A 21 -5.475 -13.051 -11.668 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -5.039 -10.877 -13.752 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -5.651 -12.482 -14.096 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -7.631 -12.069 -12.698 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -7.006 -10.500 -12.230 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -7.689 -11.333 -15.078 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -8.714 -10.360 -14.041 1.00 0.00 H new ATOM 0 HE ARG A 21 -6.168 -9.088 -14.169 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -8.907 -9.872 -16.279 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -8.637 -8.479 -17.331 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -5.838 -7.306 -15.532 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -6.909 -7.034 -16.911 1.00 0.00 H new TER 276 ARG A 21 ATOM 277 N SER B 295 -6.913 -1.048 -19.747 1.00 0.00 N ATOM 278 CA SER B 295 -5.799 -0.585 -18.872 1.00 0.00 C ATOM 279 C SER B 295 -4.640 -0.016 -19.693 1.00 0.00 C ATOM 280 O SER B 295 -3.754 -0.752 -20.134 1.00 0.00 O ATOM 281 CB SER B 295 -5.325 -1.765 -18.011 1.00 0.00 C ATOM 282 OG SER B 295 -4.922 -2.862 -18.816 1.00 0.00 O ATOM 0 HA SER B 295 -6.161 0.219 -18.232 1.00 0.00 H new ATOM 0 HB2 SER B 295 -4.493 -1.448 -17.382 1.00 0.00 H new ATOM 0 HB3 SER B 295 -6.128 -2.077 -17.344 1.00 0.00 H new ATOM 0 HG SER B 295 -4.376 -2.537 -19.562 1.00 0.00 H new ATOM 290 N LEU B 296 -4.656 1.303 -19.895 1.00 0.00 N ATOM 291 CA LEU B 296 -3.612 1.980 -20.660 1.00 0.00 C ATOM 292 C LEU B 296 -2.677 2.752 -19.733 1.00 0.00 C ATOM 293 O LEU B 296 -3.117 3.623 -18.978 1.00 0.00 O ATOM 294 CB LEU B 296 -4.221 2.933 -21.698 1.00 0.00 C ATOM 295 CG LEU B 296 -4.949 2.263 -22.874 1.00 0.00 C ATOM 296 CD1 LEU B 296 -6.269 1.647 -22.429 1.00 0.00 C ATOM 297 CD2 LEU B 296 -5.182 3.269 -23.995 1.00 0.00 C ATOM 0 H LEU B 296 -5.383 1.923 -19.538 1.00 0.00 H new ATOM 0 HA LEU B 296 -3.037 1.216 -21.184 1.00 0.00 H new ATOM 0 HB2 LEU B 296 -4.923 3.594 -21.189 1.00 0.00 H new ATOM 0 HB3 LEU B 296 -3.425 3.561 -22.098 1.00 0.00 H new ATOM 0 HG LEU B 296 -4.315 1.459 -23.248 1.00 0.00 H new ATOM 0 HD11 LEU B 296 -6.760 1.181 -23.284 1.00 0.00 H new ATOM 0 HD12 LEU B 296 -6.080 0.894 -21.664 1.00 0.00 H new ATOM 0 HD13 LEU B 296 -6.914 2.425 -22.020 1.00 0.00 H new ATOM 0 HD21 LEU B 296 -5.698 2.780 -24.821 1.00 0.00 H new ATOM 0 HD22 LEU B 296 -5.791 4.093 -23.623 1.00 0.00 H new ATOM 0 HD23 LEU B 296 -4.224 3.654 -24.343 1.00 0.00 H new ATOM 309 N GLN B 297 -1.384 2.431 -19.798 1.00 0.00 N ATOM 310 CA GLN B 297 -0.381 3.097 -18.968 1.00 0.00 C ATOM 311 C GLN B 297 -0.121 4.517 -19.466 1.00 0.00 C ATOM 312 O GLN B 297 -0.080 4.762 -20.674 1.00 0.00 O ATOM 313 CB GLN B 297 0.925 2.296 -18.955 1.00 0.00 C ATOM 314 CG GLN B 297 0.779 0.876 -18.420 1.00 0.00 C ATOM 315 CD GLN B 297 0.315 0.834 -16.973 1.00 0.00 C ATOM 316 OE1 GLN B 297 -0.785 1.280 -16.646 1.00 0.00 O ATOM 317 NE2 GLN B 297 1.155 0.293 -16.095 1.00 0.00 N ATOM 0 H GLN B 297 -1.007 1.713 -20.417 1.00 0.00 H new ATOM 0 HA GLN B 297 -0.768 3.153 -17.951 1.00 0.00 H new ATOM 0 HB2 GLN B 297 1.322 2.252 -19.969 1.00 0.00 H new ATOM 0 HB3 GLN B 297 1.659 2.828 -18.349 1.00 0.00 H new ATOM 0 HG2 GLN B 297 0.068 0.331 -19.040 1.00 0.00 H new ATOM 0 HG3 GLN B 297 1.736 0.361 -18.505 1.00 0.00 H new ATOM 0 HE21 GLN B 297 2.058 -0.065 -16.407 1.00 0.00 H new ATOM 0 HE22 GLN B 297 0.896 0.236 -15.110 1.00 0.00 H new ATOM 326 N ASN B 298 0.046 5.451 -18.530 1.00 0.00 N ATOM 327 CA ASN B 298 0.292 6.851 -18.875 1.00 0.00 C ATOM 328 C ASN B 298 1.787 7.126 -19.055 1.00 0.00 C ATOM 329 O ASN B 298 2.271 7.212 -20.186 1.00 0.00 O ATOM 330 CB ASN B 298 -0.297 7.780 -17.805 1.00 0.00 C ATOM 331 CG ASN B 298 -1.809 7.674 -17.710 1.00 0.00 C ATOM 332 OD1 ASN B 298 -2.352 6.612 -17.404 1.00 0.00 O ATOM 333 ND2 ASN B 298 -2.501 8.779 -17.974 1.00 0.00 N ATOM 0 H ASN B 298 0.015 5.264 -17.528 1.00 0.00 H new ATOM 0 HA ASN B 298 -0.203 7.052 -19.825 1.00 0.00 H new ATOM 0 HB2 ASN B 298 0.142 7.538 -16.837 1.00 0.00 H new ATOM 0 HB3 ASN B 298 -0.022 8.810 -18.032 1.00 0.00 H new ATOM 0 HD21 ASN B 298 -3.520 8.766 -17.927 1.00 0.00 H new ATOM 0 HD22 ASN B 298 -2.013 9.639 -18.224 1.00 0.00 H new ATOM 340 N ASN B 299 2.512 7.270 -17.943 1.00 0.00 N ATOM 341 CA ASN B 299 3.949 7.544 -17.992 1.00 0.00 C ATOM 342 C ASN B 299 4.627 7.242 -16.653 1.00 0.00 C ATOM 343 O ASN B 299 3.961 6.905 -15.671 1.00 0.00 O ATOM 344 CB ASN B 299 4.197 9.006 -18.391 1.00 0.00 C ATOM 345 CG ASN B 299 3.530 9.995 -17.448 1.00 0.00 C ATOM 346 OD1 ASN B 299 3.851 10.052 -16.261 1.00 0.00 O ATOM 347 ND2 ASN B 299 2.594 10.778 -17.973 1.00 0.00 N ATOM 0 H ASN B 299 2.128 7.202 -17.000 1.00 0.00 H new ATOM 0 HA ASN B 299 4.386 6.886 -18.743 1.00 0.00 H new ATOM 0 HB2 ASN B 299 5.270 9.196 -18.410 1.00 0.00 H new ATOM 0 HB3 ASN B 299 3.827 9.170 -19.403 1.00 0.00 H new ATOM 0 HD21 ASN B 299 2.111 11.459 -17.387 1.00 0.00 H new ATOM 0 HD22 ASN B 299 2.358 10.698 -18.962 1.00 0.00 H new ATOM 354 N GLN B 300 5.959 7.369 -16.629 1.00 0.00 N ATOM 355 CA GLN B 300 6.747 7.113 -15.422 1.00 0.00 C ATOM 356 C GLN B 300 6.500 5.699 -14.886 1.00 0.00 C ATOM 357 O GLN B 300 5.990 5.522 -13.777 1.00 0.00 O ATOM 358 CB GLN B 300 6.436 8.158 -14.344 1.00 0.00 C ATOM 359 CG GLN B 300 6.811 9.577 -14.743 1.00 0.00 C ATOM 360 CD GLN B 300 6.488 10.595 -13.665 1.00 0.00 C ATOM 361 OE1 GLN B 300 6.994 10.511 -12.546 1.00 0.00 O ATOM 362 NE2 GLN B 300 5.641 11.565 -13.996 1.00 0.00 N ATOM 0 H GLN B 300 6.514 7.649 -17.437 1.00 0.00 H new ATOM 0 HA GLN B 300 7.801 7.191 -15.689 1.00 0.00 H new ATOM 0 HB2 GLN B 300 5.371 8.124 -14.114 1.00 0.00 H new ATOM 0 HB3 GLN B 300 6.968 7.894 -13.430 1.00 0.00 H new ATOM 0 HG2 GLN B 300 7.877 9.617 -14.967 1.00 0.00 H new ATOM 0 HG3 GLN B 300 6.283 9.844 -15.658 1.00 0.00 H new ATOM 0 HE21 GLN B 300 5.244 11.597 -14.935 1.00 0.00 H new ATOM 0 HE22 GLN B 300 5.388 12.277 -13.311 1.00 0.00 H new ATOM 371 N PRO B 301 6.861 4.668 -15.678 1.00 0.00 N ATOM 372 CA PRO B 301 6.679 3.267 -15.289 1.00 0.00 C ATOM 373 C PRO B 301 7.732 2.780 -14.288 1.00 0.00 C ATOM 374 O PRO B 301 7.511 1.791 -13.592 1.00 0.00 O ATOM 375 CB PRO B 301 6.818 2.521 -16.615 1.00 0.00 C ATOM 376 CG PRO B 301 7.739 3.366 -17.427 1.00 0.00 C ATOM 377 CD PRO B 301 7.474 4.791 -17.018 1.00 0.00 C ATOM 0 HA PRO B 301 5.727 3.109 -14.782 1.00 0.00 H new ATOM 0 HB2 PRO B 301 7.225 1.521 -16.466 1.00 0.00 H new ATOM 0 HB3 PRO B 301 5.852 2.402 -17.106 1.00 0.00 H new ATOM 0 HG2 PRO B 301 8.779 3.095 -17.243 1.00 0.00 H new ATOM 0 HG3 PRO B 301 7.557 3.227 -18.493 1.00 0.00 H new ATOM 0 HD2 PRO B 301 8.394 5.375 -16.984 1.00 0.00 H new ATOM 0 HD3 PRO B 301 6.805 5.290 -17.719 1.00 0.00 H new ATOM 385 N VAL B 302 8.872 3.475 -14.219 1.00 0.00 N ATOM 386 CA VAL B 302 9.947 3.102 -13.299 1.00 0.00 C ATOM 387 C VAL B 302 9.474 3.178 -11.848 1.00 0.00 C ATOM 388 O VAL B 302 9.632 2.223 -11.085 1.00 0.00 O ATOM 389 CB VAL B 302 11.190 4.003 -13.476 1.00 0.00 C ATOM 390 CG1 VAL B 302 12.308 3.573 -12.535 1.00 0.00 C ATOM 391 CG2 VAL B 302 11.666 3.984 -14.922 1.00 0.00 C ATOM 0 H VAL B 302 9.072 4.297 -14.789 1.00 0.00 H new ATOM 0 HA VAL B 302 10.224 2.075 -13.538 1.00 0.00 H new ATOM 0 HB VAL B 302 10.908 5.025 -13.223 1.00 0.00 H new ATOM 0 HG11 VAL B 302 13.173 4.221 -12.677 1.00 0.00 H new ATOM 0 HG12 VAL B 302 11.964 3.648 -11.503 1.00 0.00 H new ATOM 0 HG13 VAL B 302 12.588 2.542 -12.750 1.00 0.00 H new ATOM 0 HG21 VAL B 302 12.542 4.625 -15.025 1.00 0.00 H new ATOM 0 HG22 VAL B 302 11.927 2.964 -15.206 1.00 0.00 H new ATOM 0 HG23 VAL B 302 10.871 4.349 -15.572 1.00 0.00 H new ATOM 401 N GLU B 303 8.887 4.319 -11.477 1.00 0.00 N ATOM 402 CA GLU B 303 8.382 4.519 -10.119 1.00 0.00 C ATOM 403 C GLU B 303 7.251 3.543 -9.811 1.00 0.00 C ATOM 404 O GLU B 303 7.271 2.870 -8.782 1.00 0.00 O ATOM 405 CB GLU B 303 7.886 5.957 -9.935 1.00 0.00 C ATOM 406 CG GLU B 303 8.983 7.003 -10.079 1.00 0.00 C ATOM 407 CD GLU B 303 8.482 8.430 -9.902 1.00 0.00 C ATOM 408 OE1 GLU B 303 7.267 8.624 -9.668 1.00 0.00 O ATOM 409 OE2 GLU B 303 9.309 9.361 -9.999 1.00 0.00 O ATOM 0 H GLU B 303 8.751 5.116 -12.098 1.00 0.00 H new ATOM 0 HA GLU B 303 9.204 4.334 -9.427 1.00 0.00 H new ATOM 0 HB2 GLU B 303 7.104 6.159 -10.667 1.00 0.00 H new ATOM 0 HB3 GLU B 303 7.432 6.052 -8.949 1.00 0.00 H new ATOM 0 HG2 GLU B 303 9.763 6.805 -9.343 1.00 0.00 H new ATOM 0 HG3 GLU B 303 9.441 6.906 -11.063 1.00 0.00 H new ATOM 416 N PHE B 304 6.273 3.470 -10.716 1.00 0.00 N ATOM 417 CA PHE B 304 5.124 2.577 -10.555 1.00 0.00 C ATOM 418 C PHE B 304 5.571 1.119 -10.432 1.00 0.00 C ATOM 419 O PHE B 304 5.120 0.400 -9.543 1.00 0.00 O ATOM 420 CB PHE B 304 4.172 2.737 -11.748 1.00 0.00 C ATOM 421 CG PHE B 304 2.919 1.905 -11.664 1.00 0.00 C ATOM 422 CD1 PHE B 304 1.963 2.156 -10.690 1.00 0.00 C ATOM 423 CD2 PHE B 304 2.697 0.875 -12.564 1.00 0.00 C ATOM 424 CE1 PHE B 304 0.811 1.396 -10.618 1.00 0.00 C ATOM 425 CE2 PHE B 304 1.548 0.109 -12.495 1.00 0.00 C ATOM 426 CZ PHE B 304 0.603 0.371 -11.521 1.00 0.00 C ATOM 0 H PHE B 304 6.254 4.022 -11.573 1.00 0.00 H new ATOM 0 HA PHE B 304 4.604 2.849 -9.636 1.00 0.00 H new ATOM 0 HB2 PHE B 304 3.891 3.787 -11.834 1.00 0.00 H new ATOM 0 HB3 PHE B 304 4.707 2.475 -12.661 1.00 0.00 H new ATOM 0 HD1 PHE B 304 2.121 2.954 -9.980 1.00 0.00 H new ATOM 0 HD2 PHE B 304 3.431 0.668 -13.329 1.00 0.00 H new ATOM 0 HE1 PHE B 304 0.074 1.603 -9.856 1.00 0.00 H new ATOM 0 HE2 PHE B 304 1.389 -0.693 -13.201 1.00 0.00 H new ATOM 0 HZ PHE B 304 -0.296 -0.224 -11.466 1.00 0.00 H new ATOM 436 N ASN B 305 6.461 0.695 -11.329 1.00 0.00 N ATOM 437 CA ASN B 305 6.974 -0.676 -11.330 1.00 0.00 C ATOM 438 C ASN B 305 7.623 -1.046 -9.990 1.00 0.00 C ATOM 439 O ASN B 305 7.602 -2.211 -9.593 1.00 0.00 O ATOM 440 CB ASN B 305 7.984 -0.864 -12.466 1.00 0.00 C ATOM 441 CG ASN B 305 8.452 -2.302 -12.599 1.00 0.00 C ATOM 442 OD1 ASN B 305 7.661 -3.197 -12.898 1.00 0.00 O ATOM 443 ND2 ASN B 305 9.741 -2.533 -12.373 1.00 0.00 N ATOM 0 H ASN B 305 6.844 1.284 -12.068 1.00 0.00 H new ATOM 0 HA ASN B 305 6.124 -1.341 -11.484 1.00 0.00 H new ATOM 0 HB2 ASN B 305 7.532 -0.544 -13.405 1.00 0.00 H new ATOM 0 HB3 ASN B 305 8.846 -0.220 -12.291 1.00 0.00 H new ATOM 0 HD21 ASN B 305 10.109 -3.481 -12.445 1.00 0.00 H new ATOM 0 HD22 ASN B 305 10.362 -1.762 -12.128 1.00 0.00 H new ATOM 450 N HIS B 306 8.202 -0.056 -9.303 1.00 0.00 N ATOM 451 CA HIS B 306 8.855 -0.292 -8.012 1.00 0.00 C ATOM 452 C HIS B 306 7.893 -0.951 -7.023 1.00 0.00 C ATOM 453 O HIS B 306 8.117 -2.087 -6.599 1.00 0.00 O ATOM 454 CB HIS B 306 9.401 1.026 -7.447 1.00 0.00 C ATOM 455 CG HIS B 306 10.058 0.894 -6.106 1.00 0.00 C ATOM 456 ND1 HIS B 306 9.362 0.606 -4.950 1.00 0.00 N ATOM 457 CD2 HIS B 306 11.355 1.015 -5.740 1.00 0.00 C ATOM 458 CE1 HIS B 306 10.202 0.557 -3.934 1.00 0.00 C ATOM 459 NE2 HIS B 306 11.418 0.799 -4.387 1.00 0.00 N ATOM 0 H HIS B 306 8.232 0.914 -9.618 1.00 0.00 H new ATOM 0 HA HIS B 306 9.689 -0.976 -8.168 1.00 0.00 H new ATOM 0 HB2 HIS B 306 10.121 1.440 -8.153 1.00 0.00 H new ATOM 0 HB3 HIS B 306 8.583 1.742 -7.369 1.00 0.00 H new ATOM 0 HD2 HIS B 306 12.186 1.240 -6.392 1.00 0.00 H new ATOM 0 HE1 HIS B 306 9.939 0.353 -2.906 1.00 0.00 H new ATOM 0 HE2 HIS B 306 12.267 0.822 -3.822 1.00 0.00 H new ATOM 468 N ALA B 307 6.813 -0.248 -6.673 1.00 0.00 N ATOM 469 CA ALA B 307 5.811 -0.790 -5.755 1.00 0.00 C ATOM 470 C ALA B 307 5.163 -2.024 -6.363 1.00 0.00 C ATOM 471 O ALA B 307 4.898 -3.008 -5.678 1.00 0.00 O ATOM 472 CB ALA B 307 4.748 0.252 -5.447 1.00 0.00 C ATOM 0 H ALA B 307 6.611 0.693 -7.010 1.00 0.00 H new ATOM 0 HA ALA B 307 6.308 -1.066 -4.825 1.00 0.00 H new ATOM 0 HB1 ALA B 307 4.012 -0.170 -4.763 1.00 0.00 H new ATOM 0 HB2 ALA B 307 5.215 1.123 -4.986 1.00 0.00 H new ATOM 0 HB3 ALA B 307 4.254 0.552 -6.371 1.00 0.00 H new ATOM 478 N ILE B 308 4.927 -1.949 -7.665 1.00 0.00 N ATOM 479 CA ILE B 308 4.325 -3.030 -8.432 1.00 0.00 C ATOM 480 C ILE B 308 5.023 -4.359 -8.188 1.00 0.00 C ATOM 481 O ILE B 308 4.414 -5.304 -7.684 1.00 0.00 O ATOM 482 CB ILE B 308 4.369 -2.671 -9.930 1.00 0.00 C ATOM 483 CG1 ILE B 308 3.141 -1.836 -10.302 1.00 0.00 C ATOM 484 CG2 ILE B 308 4.482 -3.916 -10.791 1.00 0.00 C ATOM 485 CD1 ILE B 308 2.564 -1.055 -9.134 1.00 0.00 C ATOM 0 H ILE B 308 5.151 -1.126 -8.225 1.00 0.00 H new ATOM 0 HA ILE B 308 3.292 -3.147 -8.105 1.00 0.00 H new ATOM 0 HB ILE B 308 5.260 -2.073 -10.121 1.00 0.00 H new ATOM 0 HG12 ILE B 308 3.411 -1.140 -11.096 1.00 0.00 H new ATOM 0 HG13 ILE B 308 2.371 -2.495 -10.704 1.00 0.00 H new ATOM 0 HG21 ILE B 308 4.511 -3.630 -11.842 1.00 0.00 H new ATOM 0 HG22 ILE B 308 5.396 -4.453 -10.536 1.00 0.00 H new ATOM 0 HG23 ILE B 308 3.621 -4.560 -10.614 1.00 0.00 H new ATOM 0 HD11 ILE B 308 1.697 -0.486 -9.470 1.00 0.00 H new ATOM 0 HD12 ILE B 308 2.262 -1.747 -8.347 1.00 0.00 H new ATOM 0 HD13 ILE B 308 3.318 -0.371 -8.746 1.00 0.00 H new ATOM 497 N ASN B 309 6.303 -4.420 -8.538 1.00 0.00 N ATOM 498 CA ASN B 309 7.082 -5.629 -8.342 1.00 0.00 C ATOM 499 C ASN B 309 7.120 -6.005 -6.860 1.00 0.00 C ATOM 500 O ASN B 309 7.178 -7.186 -6.516 1.00 0.00 O ATOM 501 CB ASN B 309 8.477 -5.437 -8.924 1.00 0.00 C ATOM 502 CG ASN B 309 8.558 -5.865 -10.378 1.00 0.00 C ATOM 503 OD1 ASN B 309 7.850 -5.332 -11.231 1.00 0.00 O ATOM 504 ND2 ASN B 309 9.420 -6.834 -10.668 1.00 0.00 N ATOM 0 H ASN B 309 6.819 -3.647 -8.958 1.00 0.00 H new ATOM 0 HA ASN B 309 6.612 -6.460 -8.868 1.00 0.00 H new ATOM 0 HB2 ASN B 309 8.762 -4.388 -8.840 1.00 0.00 H new ATOM 0 HB3 ASN B 309 9.195 -6.011 -8.338 1.00 0.00 H new ATOM 0 HD21 ASN B 309 9.513 -7.163 -11.629 1.00 0.00 H new ATOM 0 HD22 ASN B 309 9.988 -7.249 -9.930 1.00 0.00 H new ATOM 511 N TYR B 310 7.027 -4.998 -5.985 1.00 0.00 N ATOM 512 CA TYR B 310 6.984 -5.239 -4.547 1.00 0.00 C ATOM 513 C TYR B 310 5.692 -5.984 -4.193 1.00 0.00 C ATOM 514 O TYR B 310 5.716 -6.946 -3.425 1.00 0.00 O ATOM 515 CB TYR B 310 7.081 -3.922 -3.767 1.00 0.00 C ATOM 516 CG TYR B 310 6.637 -4.029 -2.323 1.00 0.00 C ATOM 517 CD1 TYR B 310 6.913 -5.158 -1.557 1.00 0.00 C ATOM 518 CD2 TYR B 310 5.927 -2.999 -1.731 1.00 0.00 C ATOM 519 CE1 TYR B 310 6.489 -5.248 -0.246 1.00 0.00 C ATOM 520 CE2 TYR B 310 5.494 -3.084 -0.426 1.00 0.00 C ATOM 521 CZ TYR B 310 5.777 -4.208 0.312 1.00 0.00 C ATOM 522 OH TYR B 310 5.331 -4.300 1.607 1.00 0.00 O ATOM 0 H TYR B 310 6.981 -4.014 -6.250 1.00 0.00 H new ATOM 0 HA TYR B 310 7.840 -5.853 -4.266 1.00 0.00 H new ATOM 0 HB2 TYR B 310 8.112 -3.570 -3.794 1.00 0.00 H new ATOM 0 HB3 TYR B 310 6.474 -3.169 -4.269 1.00 0.00 H new ATOM 0 HD1 TYR B 310 7.467 -5.975 -1.994 1.00 0.00 H new ATOM 0 HD2 TYR B 310 5.708 -2.110 -2.304 1.00 0.00 H new ATOM 0 HE1 TYR B 310 6.714 -6.128 0.339 1.00 0.00 H new ATOM 0 HE2 TYR B 310 4.935 -2.272 0.015 1.00 0.00 H new ATOM 0 HH TYR B 310 5.926 -4.888 2.117 1.00 0.00 H new ATOM 532 N VAL B 311 4.563 -5.551 -4.781 1.00 0.00 N ATOM 533 CA VAL B 311 3.276 -6.210 -4.537 1.00 0.00 C ATOM 534 C VAL B 311 3.382 -7.683 -4.920 1.00 0.00 C ATOM 535 O VAL B 311 2.795 -8.543 -4.269 1.00 0.00 O ATOM 536 CB VAL B 311 2.105 -5.590 -5.339 1.00 0.00 C ATOM 537 CG1 VAL B 311 0.783 -6.189 -4.902 1.00 0.00 C ATOM 538 CG2 VAL B 311 2.026 -4.090 -5.190 1.00 0.00 C ATOM 0 H VAL B 311 4.519 -4.757 -5.420 1.00 0.00 H new ATOM 0 HA VAL B 311 3.059 -6.079 -3.477 1.00 0.00 H new ATOM 0 HB VAL B 311 2.300 -5.820 -6.387 1.00 0.00 H new ATOM 0 HG11 VAL B 311 -0.027 -5.741 -5.477 1.00 0.00 H new ATOM 0 HG12 VAL B 311 0.797 -7.265 -5.073 1.00 0.00 H new ATOM 0 HG13 VAL B 311 0.627 -5.992 -3.841 1.00 0.00 H new ATOM 0 HG21 VAL B 311 1.187 -3.710 -5.773 1.00 0.00 H new ATOM 0 HG22 VAL B 311 1.882 -3.836 -4.140 1.00 0.00 H new ATOM 0 HG23 VAL B 311 2.951 -3.639 -5.549 1.00 0.00 H new ATOM 548 N ASN B 312 4.157 -7.962 -5.979 1.00 0.00 N ATOM 549 CA ASN B 312 4.369 -9.328 -6.448 1.00 0.00 C ATOM 550 C ASN B 312 4.869 -10.206 -5.300 1.00 0.00 C ATOM 551 O ASN B 312 4.386 -11.321 -5.113 1.00 0.00 O ATOM 552 CB ASN B 312 5.355 -9.334 -7.625 1.00 0.00 C ATOM 553 CG ASN B 312 5.667 -10.727 -8.137 1.00 0.00 C ATOM 554 OD1 ASN B 312 6.327 -11.516 -7.460 1.00 0.00 O ATOM 555 ND2 ASN B 312 5.191 -11.041 -9.338 1.00 0.00 N ATOM 0 H ASN B 312 4.646 -7.253 -6.525 1.00 0.00 H new ATOM 0 HA ASN B 312 3.422 -9.739 -6.799 1.00 0.00 H new ATOM 0 HB2 ASN B 312 4.942 -8.739 -8.439 1.00 0.00 H new ATOM 0 HB3 ASN B 312 6.282 -8.851 -7.316 1.00 0.00 H new ATOM 0 HD21 ASN B 312 5.368 -11.965 -9.731 1.00 0.00 H new ATOM 0 HD22 ASN B 312 4.649 -10.358 -9.866 1.00 0.00 H new ATOM 562 N LYS B 313 5.807 -9.674 -4.505 1.00 0.00 N ATOM 563 CA LYS B 313 6.333 -10.393 -3.341 1.00 0.00 C ATOM 564 C LYS B 313 5.192 -10.793 -2.423 1.00 0.00 C ATOM 565 O LYS B 313 5.064 -11.947 -2.029 1.00 0.00 O ATOM 566 CB LYS B 313 7.300 -9.505 -2.541 1.00 0.00 C ATOM 567 CG LYS B 313 8.724 -9.503 -3.060 1.00 0.00 C ATOM 568 CD LYS B 313 9.573 -8.444 -2.372 1.00 0.00 C ATOM 569 CE LYS B 313 9.753 -8.744 -0.891 1.00 0.00 C ATOM 570 NZ LYS B 313 10.564 -7.701 -0.203 1.00 0.00 N ATOM 0 H LYS B 313 6.215 -8.750 -4.648 1.00 0.00 H new ATOM 0 HA LYS B 313 6.861 -11.275 -3.704 1.00 0.00 H new ATOM 0 HB2 LYS B 313 6.923 -8.482 -2.546 1.00 0.00 H new ATOM 0 HB3 LYS B 313 7.305 -9.838 -1.503 1.00 0.00 H new ATOM 0 HG2 LYS B 313 9.170 -10.485 -2.903 1.00 0.00 H new ATOM 0 HG3 LYS B 313 8.719 -9.323 -4.135 1.00 0.00 H new ATOM 0 HD2 LYS B 313 10.549 -8.390 -2.854 1.00 0.00 H new ATOM 0 HD3 LYS B 313 9.104 -7.467 -2.491 1.00 0.00 H new ATOM 0 HE2 LYS B 313 8.775 -8.815 -0.414 1.00 0.00 H new ATOM 0 HE3 LYS B 313 10.236 -9.714 -0.774 1.00 0.00 H new ATOM 0 HZ1 LYS B 313 10.662 -7.945 0.803 1.00 0.00 H new ATOM 0 HZ2 LYS B 313 11.506 -7.650 -0.640 1.00 0.00 H new ATOM 0 HZ3 LYS B 313 10.091 -6.779 -0.291 1.00 0.00 H new ATOM 584 N ILE B 314 4.377 -9.804 -2.091 1.00 0.00 N ATOM 585 CA ILE B 314 3.233 -9.983 -1.216 1.00 0.00 C ATOM 586 C ILE B 314 2.212 -10.938 -1.829 1.00 0.00 C ATOM 587 O ILE B 314 1.877 -11.962 -1.238 1.00 0.00 O ATOM 588 CB ILE B 314 2.605 -8.602 -0.934 1.00 0.00 C ATOM 589 CG1 ILE B 314 3.613 -7.764 -0.153 1.00 0.00 C ATOM 590 CG2 ILE B 314 1.287 -8.708 -0.182 1.00 0.00 C ATOM 591 CD1 ILE B 314 3.186 -6.344 0.086 1.00 0.00 C ATOM 0 H ILE B 314 4.493 -8.847 -2.425 1.00 0.00 H new ATOM 0 HA ILE B 314 3.561 -10.431 -0.278 1.00 0.00 H new ATOM 0 HB ILE B 314 2.373 -8.122 -1.885 1.00 0.00 H new ATOM 0 HG12 ILE B 314 3.797 -8.242 0.809 1.00 0.00 H new ATOM 0 HG13 ILE B 314 4.560 -7.760 -0.693 1.00 0.00 H new ATOM 0 HG21 ILE B 314 0.886 -7.709 -0.008 1.00 0.00 H new ATOM 0 HG22 ILE B 314 0.577 -9.287 -0.773 1.00 0.00 H new ATOM 0 HG23 ILE B 314 1.453 -9.204 0.774 1.00 0.00 H new ATOM 0 HD11 ILE B 314 3.960 -5.821 0.647 1.00 0.00 H new ATOM 0 HD12 ILE B 314 3.031 -5.845 -0.870 1.00 0.00 H new ATOM 0 HD13 ILE B 314 2.256 -6.334 0.655 1.00 0.00 H new ATOM 603 N LYS B 315 1.745 -10.615 -3.024 1.00 0.00 N ATOM 604 CA LYS B 315 0.781 -11.450 -3.726 1.00 0.00 C ATOM 605 C LYS B 315 1.236 -12.914 -3.760 1.00 0.00 C ATOM 606 O LYS B 315 0.473 -13.817 -3.412 1.00 0.00 O ATOM 607 CB LYS B 315 0.588 -10.915 -5.142 1.00 0.00 C ATOM 608 CG LYS B 315 -0.496 -11.624 -5.930 1.00 0.00 C ATOM 609 CD LYS B 315 -0.697 -10.981 -7.291 1.00 0.00 C ATOM 610 CE LYS B 315 0.409 -11.355 -8.269 1.00 0.00 C ATOM 611 NZ LYS B 315 1.721 -10.742 -7.918 1.00 0.00 N ATOM 0 H LYS B 315 2.020 -9.774 -3.532 1.00 0.00 H new ATOM 0 HA LYS B 315 -0.169 -11.415 -3.192 1.00 0.00 H new ATOM 0 HB2 LYS B 315 0.347 -9.853 -5.088 1.00 0.00 H new ATOM 0 HB3 LYS B 315 1.530 -11.001 -5.683 1.00 0.00 H new ATOM 0 HG2 LYS B 315 -0.230 -12.673 -6.057 1.00 0.00 H new ATOM 0 HG3 LYS B 315 -1.431 -11.598 -5.371 1.00 0.00 H new ATOM 0 HD2 LYS B 315 -1.660 -11.289 -7.698 1.00 0.00 H new ATOM 0 HD3 LYS B 315 -0.730 -9.897 -7.178 1.00 0.00 H new ATOM 0 HE2 LYS B 315 0.515 -12.440 -8.294 1.00 0.00 H new ATOM 0 HE3 LYS B 315 0.123 -11.040 -9.272 1.00 0.00 H new ATOM 0 HZ1 LYS B 315 2.222 -10.472 -8.788 1.00 0.00 H new ATOM 0 HZ2 LYS B 315 1.564 -9.897 -7.332 1.00 0.00 H new ATOM 0 HZ3 LYS B 315 2.294 -11.429 -7.388 1.00 0.00 H new ATOM 625 N ASN B 316 2.486 -13.135 -4.175 1.00 0.00 N ATOM 626 CA ASN B 316 3.058 -14.482 -4.251 1.00 0.00 C ATOM 627 C ASN B 316 3.286 -15.093 -2.866 1.00 0.00 C ATOM 628 O ASN B 316 2.869 -16.221 -2.602 1.00 0.00 O ATOM 629 CB ASN B 316 4.368 -14.455 -5.042 1.00 0.00 C ATOM 630 CG ASN B 316 4.130 -14.540 -6.538 1.00 0.00 C ATOM 631 OD1 ASN B 316 3.653 -15.557 -7.043 1.00 0.00 O ATOM 632 ND2 ASN B 316 4.446 -13.470 -7.254 1.00 0.00 N ATOM 0 H ASN B 316 3.124 -12.394 -4.465 1.00 0.00 H new ATOM 0 HA ASN B 316 2.336 -15.114 -4.768 1.00 0.00 H new ATOM 0 HB2 ASN B 316 4.911 -13.538 -4.813 1.00 0.00 H new ATOM 0 HB3 ASN B 316 4.999 -15.286 -4.727 1.00 0.00 H new ATOM 0 HD21 ASN B 316 4.296 -13.469 -8.263 1.00 0.00 H new ATOM 0 HD22 ASN B 316 4.839 -12.648 -6.796 1.00 0.00 H new ATOM 639 N ARG B 317 3.962 -14.352 -1.988 1.00 0.00 N ATOM 640 CA ARG B 317 4.252 -14.833 -0.637 1.00 0.00 C ATOM 641 C ARG B 317 2.974 -15.219 0.112 1.00 0.00 C ATOM 642 O ARG B 317 2.966 -16.192 0.871 1.00 0.00 O ATOM 643 CB ARG B 317 5.025 -13.773 0.157 1.00 0.00 C ATOM 644 CG ARG B 317 5.527 -14.261 1.508 1.00 0.00 C ATOM 645 CD ARG B 317 6.459 -15.457 1.358 1.00 0.00 C ATOM 646 NE ARG B 317 6.956 -15.940 2.648 1.00 0.00 N ATOM 647 CZ ARG B 317 7.811 -15.269 3.426 1.00 0.00 C ATOM 648 NH1 ARG B 317 8.311 -14.099 3.034 1.00 0.00 N ATOM 649 NH2 ARG B 317 8.177 -15.780 4.598 1.00 0.00 N ATOM 0 H ARG B 317 4.319 -13.417 -2.188 1.00 0.00 H new ATOM 0 HA ARG B 317 4.868 -15.727 -0.734 1.00 0.00 H new ATOM 0 HB2 ARG B 317 5.876 -13.437 -0.436 1.00 0.00 H new ATOM 0 HB3 ARG B 317 4.381 -12.907 0.311 1.00 0.00 H new ATOM 0 HG2 ARG B 317 6.051 -13.452 2.017 1.00 0.00 H new ATOM 0 HG3 ARG B 317 4.679 -14.536 2.135 1.00 0.00 H new ATOM 0 HD2 ARG B 317 5.932 -16.264 0.849 1.00 0.00 H new ATOM 0 HD3 ARG B 317 7.303 -15.180 0.727 1.00 0.00 H new ATOM 0 HE ARG B 317 6.628 -16.849 2.975 1.00 0.00 H new ATOM 0 HH11 ARG B 317 8.042 -13.706 2.132 1.00 0.00 H new ATOM 0 HH12 ARG B 317 8.963 -13.596 3.636 1.00 0.00 H new ATOM 0 HH21 ARG B 317 7.805 -16.681 4.900 1.00 0.00 H new ATOM 0 HH22 ARG B 317 8.829 -15.271 5.195 1.00 0.00 H new ATOM 663 N PHE B 318 1.901 -14.452 -0.093 1.00 0.00 N ATOM 664 CA PHE B 318 0.628 -14.718 0.576 1.00 0.00 C ATOM 665 C PHE B 318 -0.356 -15.461 -0.333 1.00 0.00 C ATOM 666 O PHE B 318 -1.571 -15.351 -0.148 1.00 0.00 O ATOM 667 CB PHE B 318 -0.001 -13.409 1.065 1.00 0.00 C ATOM 668 CG PHE B 318 0.947 -12.550 1.853 1.00 0.00 C ATOM 669 CD1 PHE B 318 1.415 -12.947 3.095 1.00 0.00 C ATOM 670 CD2 PHE B 318 1.386 -11.353 1.331 1.00 0.00 C ATOM 671 CE1 PHE B 318 2.309 -12.152 3.792 1.00 0.00 C ATOM 672 CE2 PHE B 318 2.272 -10.560 2.021 1.00 0.00 C ATOM 673 CZ PHE B 318 2.737 -10.954 3.246 1.00 0.00 C ATOM 0 H PHE B 318 1.889 -13.644 -0.715 1.00 0.00 H new ATOM 0 HA PHE B 318 0.841 -15.361 1.430 1.00 0.00 H new ATOM 0 HB2 PHE B 318 -0.362 -12.845 0.205 1.00 0.00 H new ATOM 0 HB3 PHE B 318 -0.869 -13.640 1.682 1.00 0.00 H new ATOM 0 HD1 PHE B 318 1.081 -13.881 3.522 1.00 0.00 H new ATOM 0 HD2 PHE B 318 1.028 -11.032 0.364 1.00 0.00 H new ATOM 0 HE1 PHE B 318 2.672 -12.466 4.760 1.00 0.00 H new ATOM 0 HE2 PHE B 318 2.602 -9.624 1.595 1.00 0.00 H new ATOM 0 HZ PHE B 318 3.436 -10.332 3.785 1.00 0.00 H new ATOM 683 N GLN B 319 0.158 -16.235 -1.299 1.00 0.00 N ATOM 684 CA GLN B 319 -0.706 -17.009 -2.197 1.00 0.00 C ATOM 685 C GLN B 319 -1.727 -17.818 -1.394 1.00 0.00 C ATOM 686 O GLN B 319 -2.889 -17.933 -1.786 1.00 0.00 O ATOM 687 CB GLN B 319 0.117 -17.940 -3.092 1.00 0.00 C ATOM 688 CG GLN B 319 0.744 -17.246 -4.295 1.00 0.00 C ATOM 689 CD GLN B 319 -0.283 -16.788 -5.317 1.00 0.00 C ATOM 690 OE1 GLN B 319 -1.140 -15.955 -5.023 1.00 0.00 O ATOM 691 NE2 GLN B 319 -0.202 -17.333 -6.526 1.00 0.00 N ATOM 0 H GLN B 319 1.157 -16.341 -1.477 1.00 0.00 H new ATOM 0 HA GLN B 319 -1.237 -16.304 -2.836 1.00 0.00 H new ATOM 0 HB2 GLN B 319 0.907 -18.396 -2.496 1.00 0.00 H new ATOM 0 HB3 GLN B 319 -0.523 -18.749 -3.445 1.00 0.00 H new ATOM 0 HG2 GLN B 319 1.317 -16.384 -3.953 1.00 0.00 H new ATOM 0 HG3 GLN B 319 1.447 -17.927 -4.775 1.00 0.00 H new ATOM 0 HE21 GLN B 319 0.524 -18.020 -6.728 1.00 0.00 H new ATOM 0 HE22 GLN B 319 -0.866 -17.064 -7.252 1.00 0.00 H new ATOM 700 N GLY B 320 -1.282 -18.357 -0.254 1.00 0.00 N ATOM 701 CA GLY B 320 -2.161 -19.127 0.607 1.00 0.00 C ATOM 702 C GLY B 320 -2.981 -18.241 1.529 1.00 0.00 C ATOM 703 O GLY B 320 -4.017 -18.668 2.042 1.00 0.00 O ATOM 0 H GLY B 320 -0.324 -18.271 0.085 1.00 0.00 H new ATOM 0 HA2 GLY B 320 -2.831 -19.729 -0.006 1.00 0.00 H new ATOM 0 HA3 GLY B 320 -1.567 -19.819 1.204 1.00 0.00 H new ATOM 707 N GLN B 321 -2.516 -17.003 1.737 1.00 0.00 N ATOM 708 CA GLN B 321 -3.207 -16.044 2.595 1.00 0.00 C ATOM 709 C GLN B 321 -3.955 -15.003 1.761 1.00 0.00 C ATOM 710 O GLN B 321 -3.467 -13.883 1.586 1.00 0.00 O ATOM 711 CB GLN B 321 -2.225 -15.297 3.505 1.00 0.00 C ATOM 712 CG GLN B 321 -1.082 -16.120 4.059 1.00 0.00 C ATOM 713 CD GLN B 321 -1.513 -17.280 4.953 1.00 0.00 C ATOM 714 OE1 GLN B 321 -2.782 -17.309 5.369 1.00 0.00 O flip ATOM 715 NE2 GLN B 321 -0.698 -18.139 5.290 1.00 0.00 N flip ATOM 0 H GLN B 321 -1.658 -16.644 1.318 1.00 0.00 H new ATOM 0 HA GLN B 321 -3.908 -16.618 3.200 1.00 0.00 H new ATOM 0 HB2 GLN B 321 -1.807 -14.459 2.946 1.00 0.00 H new ATOM 0 HB3 GLN B 321 -2.783 -14.876 4.341 1.00 0.00 H new ATOM 0 HG2 GLN B 321 -0.499 -16.516 3.227 1.00 0.00 H new ATOM 0 HG3 GLN B 321 -0.422 -15.465 4.628 1.00 0.00 H new ATOM 0 HE21 GLN B 321 0.264 -18.089 4.955 1.00 0.00 H new ATOM 0 HE22 GLN B 321 -0.985 -18.901 5.904 1.00 0.00 H new ATOM 724 N PRO B 322 -5.155 -15.326 1.255 1.00 0.00 N ATOM 725 CA PRO B 322 -5.941 -14.366 0.476 1.00 0.00 C ATOM 726 C PRO B 322 -6.352 -13.168 1.337 1.00 0.00 C ATOM 727 O PRO B 322 -6.625 -12.083 0.821 1.00 0.00 O ATOM 728 CB PRO B 322 -7.168 -15.169 0.036 1.00 0.00 C ATOM 729 CG PRO B 322 -7.263 -16.293 1.012 1.00 0.00 C ATOM 730 CD PRO B 322 -5.852 -16.611 1.419 1.00 0.00 C ATOM 0 HA PRO B 322 -5.385 -13.952 -0.365 1.00 0.00 H new ATOM 0 HB2 PRO B 322 -8.068 -14.555 0.052 1.00 0.00 H new ATOM 0 HB3 PRO B 322 -7.053 -15.539 -0.983 1.00 0.00 H new ATOM 0 HG2 PRO B 322 -7.863 -16.009 1.876 1.00 0.00 H new ATOM 0 HG3 PRO B 322 -7.744 -17.161 0.561 1.00 0.00 H new ATOM 0 HD2 PRO B 322 -5.801 -16.968 2.448 1.00 0.00 H new ATOM 0 HD3 PRO B 322 -5.417 -17.388 0.790 1.00 0.00 H new ATOM 738 N ASP B 323 -6.373 -13.379 2.661 1.00 0.00 N ATOM 739 CA ASP B 323 -6.728 -12.337 3.616 1.00 0.00 C ATOM 740 C ASP B 323 -5.651 -11.255 3.684 1.00 0.00 C ATOM 741 O ASP B 323 -5.959 -10.092 3.923 1.00 0.00 O ATOM 742 CB ASP B 323 -6.955 -12.938 5.008 1.00 0.00 C ATOM 743 CG ASP B 323 -8.105 -13.930 5.040 1.00 0.00 C ATOM 744 OD1 ASP B 323 -8.009 -14.978 4.365 1.00 0.00 O ATOM 745 OD2 ASP B 323 -9.102 -13.659 5.741 1.00 0.00 O ATOM 0 H ASP B 323 -6.144 -14.275 3.091 1.00 0.00 H new ATOM 0 HA ASP B 323 -7.654 -11.875 3.272 1.00 0.00 H new ATOM 0 HB2 ASP B 323 -6.043 -13.435 5.337 1.00 0.00 H new ATOM 0 HB3 ASP B 323 -7.154 -12.135 5.718 1.00 0.00 H new ATOM 750 N ILE B 324 -4.389 -11.646 3.483 1.00 0.00 N ATOM 751 CA ILE B 324 -3.272 -10.700 3.534 1.00 0.00 C ATOM 752 C ILE B 324 -3.332 -9.717 2.392 1.00 0.00 C ATOM 753 O ILE B 324 -3.205 -8.509 2.581 1.00 0.00 O ATOM 754 CB ILE B 324 -1.903 -11.400 3.447 1.00 0.00 C ATOM 755 CG1 ILE B 324 -1.798 -12.480 4.513 1.00 0.00 C ATOM 756 CG2 ILE B 324 -0.792 -10.360 3.567 1.00 0.00 C ATOM 757 CD1 ILE B 324 -2.201 -12.010 5.875 1.00 0.00 C ATOM 0 H ILE B 324 -4.116 -12.609 3.284 1.00 0.00 H new ATOM 0 HA ILE B 324 -3.370 -10.193 4.494 1.00 0.00 H new ATOM 0 HB ILE B 324 -1.796 -11.892 2.480 1.00 0.00 H new ATOM 0 HG12 ILE B 324 -2.425 -13.324 4.228 1.00 0.00 H new ATOM 0 HG13 ILE B 324 -0.771 -12.844 4.551 1.00 0.00 H new ATOM 0 HG21 ILE B 324 0.177 -10.854 3.506 1.00 0.00 H new ATOM 0 HG22 ILE B 324 -0.882 -9.636 2.757 1.00 0.00 H new ATOM 0 HG23 ILE B 324 -0.877 -9.846 4.524 1.00 0.00 H new ATOM 0 HD11 ILE B 324 -2.102 -12.830 6.587 1.00 0.00 H new ATOM 0 HD12 ILE B 324 -1.558 -11.185 6.180 1.00 0.00 H new ATOM 0 HD13 ILE B 324 -3.237 -11.673 5.852 1.00 0.00 H new ATOM 769 N TYR B 325 -3.503 -10.260 1.204 1.00 0.00 N ATOM 770 CA TYR B 325 -3.554 -9.448 -0.002 1.00 0.00 C ATOM 771 C TYR B 325 -4.756 -8.507 0.061 1.00 0.00 C ATOM 772 O TYR B 325 -4.618 -7.303 -0.148 1.00 0.00 O ATOM 773 CB TYR B 325 -3.635 -10.340 -1.247 1.00 0.00 C ATOM 774 CG TYR B 325 -2.982 -9.740 -2.477 1.00 0.00 C ATOM 775 CD1 TYR B 325 -1.939 -8.822 -2.367 1.00 0.00 C ATOM 776 CD2 TYR B 325 -3.398 -10.109 -3.753 1.00 0.00 C ATOM 777 CE1 TYR B 325 -1.341 -8.286 -3.497 1.00 0.00 C ATOM 778 CE2 TYR B 325 -2.803 -9.577 -4.880 1.00 0.00 C ATOM 779 CZ TYR B 325 -1.779 -8.667 -4.747 1.00 0.00 C ATOM 780 OH TYR B 325 -1.187 -8.138 -5.871 1.00 0.00 O ATOM 0 H TYR B 325 -3.610 -11.262 1.044 1.00 0.00 H new ATOM 0 HA TYR B 325 -2.642 -8.854 -0.068 1.00 0.00 H new ATOM 0 HB2 TYR B 325 -3.162 -11.297 -1.027 1.00 0.00 H new ATOM 0 HB3 TYR B 325 -4.683 -10.545 -1.467 1.00 0.00 H new ATOM 0 HD1 TYR B 325 -1.592 -8.524 -1.389 1.00 0.00 H new ATOM 0 HD2 TYR B 325 -4.200 -10.824 -3.864 1.00 0.00 H new ATOM 0 HE1 TYR B 325 -0.536 -7.573 -3.398 1.00 0.00 H new ATOM 0 HE2 TYR B 325 -3.140 -9.874 -5.862 1.00 0.00 H new ATOM 0 HH TYR B 325 -1.843 -8.099 -6.598 1.00 0.00 H new ATOM 790 N LYS B 326 -5.926 -9.062 0.387 1.00 0.00 N ATOM 791 CA LYS B 326 -7.142 -8.275 0.520 1.00 0.00 C ATOM 792 C LYS B 326 -7.001 -7.247 1.651 1.00 0.00 C ATOM 793 O LYS B 326 -7.283 -6.064 1.461 1.00 0.00 O ATOM 794 CB LYS B 326 -8.335 -9.214 0.759 1.00 0.00 C ATOM 795 CG LYS B 326 -9.330 -8.710 1.787 1.00 0.00 C ATOM 796 CD LYS B 326 -10.516 -9.654 1.936 1.00 0.00 C ATOM 797 CE LYS B 326 -11.344 -9.731 0.661 1.00 0.00 C ATOM 798 NZ LYS B 326 -11.968 -8.422 0.316 1.00 0.00 N ATOM 0 H LYS B 326 -6.051 -10.059 0.563 1.00 0.00 H new ATOM 0 HA LYS B 326 -7.316 -7.720 -0.402 1.00 0.00 H new ATOM 0 HB2 LYS B 326 -8.855 -9.370 -0.186 1.00 0.00 H new ATOM 0 HB3 LYS B 326 -7.959 -10.185 1.080 1.00 0.00 H new ATOM 0 HG2 LYS B 326 -8.832 -8.597 2.750 1.00 0.00 H new ATOM 0 HG3 LYS B 326 -9.686 -7.722 1.494 1.00 0.00 H new ATOM 0 HD2 LYS B 326 -10.157 -10.650 2.196 1.00 0.00 H new ATOM 0 HD3 LYS B 326 -11.147 -9.317 2.759 1.00 0.00 H new ATOM 0 HE2 LYS B 326 -10.710 -10.058 -0.163 1.00 0.00 H new ATOM 0 HE3 LYS B 326 -12.124 -10.483 0.781 1.00 0.00 H new ATOM 0 HZ1 LYS B 326 -12.690 -8.564 -0.419 1.00 0.00 H new ATOM 0 HZ2 LYS B 326 -12.413 -8.015 1.164 1.00 0.00 H new ATOM 0 HZ3 LYS B 326 -11.237 -7.772 -0.037 1.00 0.00 H new ATOM 812 N ALA B 327 -6.563 -7.716 2.825 1.00 0.00 N ATOM 813 CA ALA B 327 -6.378 -6.854 3.996 1.00 0.00 C ATOM 814 C ALA B 327 -5.402 -5.718 3.712 1.00 0.00 C ATOM 815 O ALA B 327 -5.741 -4.549 3.880 1.00 0.00 O ATOM 816 CB ALA B 327 -5.891 -7.668 5.187 1.00 0.00 C ATOM 0 H ALA B 327 -6.329 -8.695 2.989 1.00 0.00 H new ATOM 0 HA ALA B 327 -7.347 -6.415 4.232 1.00 0.00 H new ATOM 0 HB1 ALA B 327 -5.759 -7.011 6.047 1.00 0.00 H new ATOM 0 HB2 ALA B 327 -6.625 -8.437 5.427 1.00 0.00 H new ATOM 0 HB3 ALA B 327 -4.939 -8.139 4.941 1.00 0.00 H new ATOM 822 N PHE B 328 -4.190 -6.076 3.283 1.00 0.00 N ATOM 823 CA PHE B 328 -3.146 -5.094 2.978 1.00 0.00 C ATOM 824 C PHE B 328 -3.682 -3.992 2.070 1.00 0.00 C ATOM 825 O PHE B 328 -3.484 -2.811 2.345 1.00 0.00 O ATOM 826 CB PHE B 328 -1.957 -5.793 2.309 1.00 0.00 C ATOM 827 CG PHE B 328 -0.819 -4.876 1.958 1.00 0.00 C ATOM 828 CD1 PHE B 328 -0.105 -4.230 2.949 1.00 0.00 C ATOM 829 CD2 PHE B 328 -0.465 -4.663 0.634 1.00 0.00 C ATOM 830 CE1 PHE B 328 0.943 -3.389 2.632 1.00 0.00 C ATOM 831 CE2 PHE B 328 0.583 -3.822 0.311 1.00 0.00 C ATOM 832 CZ PHE B 328 1.288 -3.185 1.313 1.00 0.00 C ATOM 0 H PHE B 328 -3.906 -7.045 3.138 1.00 0.00 H new ATOM 0 HA PHE B 328 -2.819 -4.636 3.912 1.00 0.00 H new ATOM 0 HB2 PHE B 328 -1.588 -6.573 2.974 1.00 0.00 H new ATOM 0 HB3 PHE B 328 -2.304 -6.286 1.401 1.00 0.00 H new ATOM 0 HD1 PHE B 328 -0.370 -4.385 3.984 1.00 0.00 H new ATOM 0 HD2 PHE B 328 -1.014 -5.159 -0.153 1.00 0.00 H new ATOM 0 HE1 PHE B 328 1.492 -2.891 3.417 1.00 0.00 H new ATOM 0 HE2 PHE B 328 0.850 -3.663 -0.723 1.00 0.00 H new ATOM 0 HZ PHE B 328 2.108 -2.528 1.064 1.00 0.00 H new ATOM 842 N LEU B 329 -4.370 -4.385 0.999 1.00 0.00 N ATOM 843 CA LEU B 329 -4.943 -3.419 0.062 1.00 0.00 C ATOM 844 C LEU B 329 -5.949 -2.508 0.768 1.00 0.00 C ATOM 845 O LEU B 329 -5.844 -1.284 0.687 1.00 0.00 O ATOM 846 CB LEU B 329 -5.608 -4.135 -1.119 1.00 0.00 C ATOM 847 CG LEU B 329 -4.654 -4.926 -2.018 1.00 0.00 C ATOM 848 CD1 LEU B 329 -5.422 -5.631 -3.129 1.00 0.00 C ATOM 849 CD2 LEU B 329 -3.584 -4.013 -2.604 1.00 0.00 C ATOM 0 H LEU B 329 -4.544 -5.361 0.759 1.00 0.00 H new ATOM 0 HA LEU B 329 -4.131 -2.802 -0.323 1.00 0.00 H new ATOM 0 HB2 LEU B 329 -6.366 -4.816 -0.731 1.00 0.00 H new ATOM 0 HB3 LEU B 329 -6.126 -3.394 -1.728 1.00 0.00 H new ATOM 0 HG LEU B 329 -4.161 -5.683 -1.408 1.00 0.00 H new ATOM 0 HD11 LEU B 329 -4.726 -6.187 -3.756 1.00 0.00 H new ATOM 0 HD12 LEU B 329 -6.145 -6.319 -2.691 1.00 0.00 H new ATOM 0 HD13 LEU B 329 -5.945 -4.892 -3.735 1.00 0.00 H new ATOM 0 HD21 LEU B 329 -2.917 -4.595 -3.239 1.00 0.00 H new ATOM 0 HD22 LEU B 329 -4.058 -3.230 -3.196 1.00 0.00 H new ATOM 0 HD23 LEU B 329 -3.011 -3.559 -1.796 1.00 0.00 H new ATOM 861 N GLU B 330 -6.909 -3.112 1.479 1.00 0.00 N ATOM 862 CA GLU B 330 -7.923 -2.352 2.221 1.00 0.00 C ATOM 863 C GLU B 330 -7.267 -1.400 3.224 1.00 0.00 C ATOM 864 O GLU B 330 -7.757 -0.294 3.451 1.00 0.00 O ATOM 865 CB GLU B 330 -8.874 -3.305 2.952 1.00 0.00 C ATOM 866 CG GLU B 330 -9.702 -4.177 2.019 1.00 0.00 C ATOM 867 CD GLU B 330 -10.509 -5.226 2.761 1.00 0.00 C ATOM 868 OE1 GLU B 330 -9.896 -6.074 3.443 1.00 0.00 O ATOM 869 OE2 GLU B 330 -11.753 -5.198 2.660 1.00 0.00 O ATOM 0 H GLU B 330 -7.005 -4.125 1.556 1.00 0.00 H new ATOM 0 HA GLU B 330 -8.493 -1.760 1.504 1.00 0.00 H new ATOM 0 HB2 GLU B 330 -8.293 -3.947 3.615 1.00 0.00 H new ATOM 0 HB3 GLU B 330 -9.546 -2.722 3.582 1.00 0.00 H new ATOM 0 HG2 GLU B 330 -10.378 -3.545 1.442 1.00 0.00 H new ATOM 0 HG3 GLU B 330 -9.041 -4.670 1.307 1.00 0.00 H new ATOM 876 N ILE B 331 -6.145 -1.835 3.804 1.00 0.00 N ATOM 877 CA ILE B 331 -5.399 -1.020 4.760 1.00 0.00 C ATOM 878 C ILE B 331 -4.979 0.292 4.103 1.00 0.00 C ATOM 879 O ILE B 331 -5.234 1.377 4.629 1.00 0.00 O ATOM 880 CB ILE B 331 -4.150 -1.773 5.266 1.00 0.00 C ATOM 881 CG1 ILE B 331 -4.568 -2.948 6.146 1.00 0.00 C ATOM 882 CG2 ILE B 331 -3.214 -0.847 6.026 1.00 0.00 C ATOM 883 CD1 ILE B 331 -3.419 -3.844 6.534 1.00 0.00 C ATOM 0 H ILE B 331 -5.734 -2.751 3.626 1.00 0.00 H new ATOM 0 HA ILE B 331 -6.045 -0.811 5.613 1.00 0.00 H new ATOM 0 HB ILE B 331 -3.609 -2.152 4.399 1.00 0.00 H new ATOM 0 HG12 ILE B 331 -5.042 -2.565 7.050 1.00 0.00 H new ATOM 0 HG13 ILE B 331 -5.318 -3.538 5.619 1.00 0.00 H new ATOM 0 HG21 ILE B 331 -2.345 -1.409 6.368 1.00 0.00 H new ATOM 0 HG22 ILE B 331 -2.889 -0.040 5.370 1.00 0.00 H new ATOM 0 HG23 ILE B 331 -3.736 -0.427 6.886 1.00 0.00 H new ATOM 0 HD11 ILE B 331 -3.787 -4.658 7.159 1.00 0.00 H new ATOM 0 HD12 ILE B 331 -2.959 -4.256 5.636 1.00 0.00 H new ATOM 0 HD13 ILE B 331 -2.679 -3.267 7.089 1.00 0.00 H new ATOM 895 N LEU B 332 -4.356 0.172 2.932 1.00 0.00 N ATOM 896 CA LEU B 332 -3.913 1.332 2.159 1.00 0.00 C ATOM 897 C LEU B 332 -5.117 2.166 1.743 1.00 0.00 C ATOM 898 O LEU B 332 -5.074 3.396 1.740 1.00 0.00 O ATOM 899 CB LEU B 332 -3.159 0.887 0.901 1.00 0.00 C ATOM 900 CG LEU B 332 -2.310 -0.375 1.050 1.00 0.00 C ATOM 901 CD1 LEU B 332 -1.459 -0.595 -0.189 1.00 0.00 C ATOM 902 CD2 LEU B 332 -1.456 -0.297 2.304 1.00 0.00 C ATOM 0 H LEU B 332 -4.145 -0.725 2.494 1.00 0.00 H new ATOM 0 HA LEU B 332 -3.247 1.925 2.785 1.00 0.00 H new ATOM 0 HB2 LEU B 332 -3.884 0.723 0.104 1.00 0.00 H new ATOM 0 HB3 LEU B 332 -2.511 1.703 0.580 1.00 0.00 H new ATOM 0 HG LEU B 332 -2.974 -1.233 1.153 1.00 0.00 H new ATOM 0 HD11 LEU B 332 -0.861 -1.498 -0.064 1.00 0.00 H new ATOM 0 HD12 LEU B 332 -2.106 -0.705 -1.060 1.00 0.00 H new ATOM 0 HD13 LEU B 332 -0.799 0.260 -0.333 1.00 0.00 H new ATOM 0 HD21 LEU B 332 -0.858 -1.204 2.394 1.00 0.00 H new ATOM 0 HD22 LEU B 332 -0.796 0.568 2.241 1.00 0.00 H new ATOM 0 HD23 LEU B 332 -2.100 -0.199 3.178 1.00 0.00 H new ATOM 914 N HIS B 333 -6.187 1.469 1.375 1.00 0.00 N ATOM 915 CA HIS B 333 -7.423 2.114 0.927 1.00 0.00 C ATOM 916 C HIS B 333 -7.921 3.150 1.938 1.00 0.00 C ATOM 917 O HIS B 333 -8.168 4.299 1.574 1.00 0.00 O ATOM 918 CB HIS B 333 -8.519 1.066 0.677 1.00 0.00 C ATOM 919 CG HIS B 333 -8.246 0.158 -0.484 1.00 0.00 C ATOM 920 ND1 HIS B 333 -7.258 0.170 -1.409 1.00 0.00 N flip ATOM 921 CD2 HIS B 333 -9.051 -0.915 -0.803 1.00 0.00 C flip ATOM 922 CE1 HIS B 333 -7.482 -0.884 -2.260 1.00 0.00 C flip ATOM 923 NE2 HIS B 333 -8.570 -1.523 -1.872 1.00 0.00 N flip ATOM 0 H HIS B 333 -6.226 0.450 1.377 1.00 0.00 H new ATOM 0 HA HIS B 333 -7.197 2.631 -0.006 1.00 0.00 H new ATOM 0 HB2 HIS B 333 -8.640 0.462 1.576 1.00 0.00 H new ATOM 0 HB3 HIS B 333 -9.466 1.579 0.508 1.00 0.00 H new ATOM 0 HD2 HIS B 333 -9.937 -1.212 -0.262 1.00 0.00 H new ATOM 0 HE1 HIS B 333 -6.868 -1.147 -3.109 1.00 0.00 H new ATOM 0 HE2 HIS B 333 -8.971 -2.346 -2.321 1.00 0.00 H new ATOM 932 N THR B 334 -8.051 2.749 3.208 1.00 0.00 N ATOM 933 CA THR B 334 -8.503 3.669 4.255 1.00 0.00 C ATOM 934 C THR B 334 -7.535 4.842 4.376 1.00 0.00 C ATOM 935 O THR B 334 -7.949 5.990 4.539 1.00 0.00 O ATOM 936 CB THR B 334 -8.617 2.941 5.602 1.00 0.00 C ATOM 937 OG1 THR B 334 -9.668 1.993 5.569 1.00 0.00 O ATOM 938 CG2 THR B 334 -8.868 3.874 6.777 1.00 0.00 C ATOM 0 H THR B 334 -7.852 1.803 3.532 1.00 0.00 H new ATOM 0 HA THR B 334 -9.488 4.047 3.981 1.00 0.00 H new ATOM 0 HB THR B 334 -7.652 2.457 5.751 1.00 0.00 H new ATOM 0 HG1 THR B 334 -9.725 1.537 6.435 1.00 0.00 H new ATOM 0 HG21 THR B 334 -8.937 3.292 7.696 1.00 0.00 H new ATOM 0 HG22 THR B 334 -8.046 4.585 6.859 1.00 0.00 H new ATOM 0 HG23 THR B 334 -9.801 4.415 6.619 1.00 0.00 H new ATOM 946 N TYR B 335 -6.244 4.534 4.277 1.00 0.00 N ATOM 947 CA TYR B 335 -5.192 5.540 4.356 1.00 0.00 C ATOM 948 C TYR B 335 -5.371 6.609 3.270 1.00 0.00 C ATOM 949 O TYR B 335 -5.549 7.785 3.585 1.00 0.00 O ATOM 950 CB TYR B 335 -3.833 4.851 4.227 1.00 0.00 C ATOM 951 CG TYR B 335 -2.642 5.775 4.319 1.00 0.00 C ATOM 952 CD1 TYR B 335 -2.204 6.264 5.541 1.00 0.00 C ATOM 953 CD2 TYR B 335 -1.952 6.146 3.178 1.00 0.00 C ATOM 954 CE1 TYR B 335 -1.103 7.101 5.618 1.00 0.00 C ATOM 955 CE2 TYR B 335 -0.859 6.975 3.240 1.00 0.00 C ATOM 956 CZ TYR B 335 -0.434 7.453 4.462 1.00 0.00 C ATOM 957 OH TYR B 335 0.661 8.283 4.526 1.00 0.00 O ATOM 0 H TYR B 335 -5.900 3.583 4.140 1.00 0.00 H new ATOM 0 HA TYR B 335 -5.249 6.046 5.320 1.00 0.00 H new ATOM 0 HB2 TYR B 335 -3.749 4.095 5.008 1.00 0.00 H new ATOM 0 HB3 TYR B 335 -3.796 4.328 3.271 1.00 0.00 H new ATOM 0 HD1 TYR B 335 -2.728 5.989 6.444 1.00 0.00 H new ATOM 0 HD2 TYR B 335 -2.280 5.775 2.218 1.00 0.00 H new ATOM 0 HE1 TYR B 335 -0.770 7.476 6.575 1.00 0.00 H new ATOM 0 HE2 TYR B 335 -0.335 7.251 2.337 1.00 0.00 H new ATOM 0 HH TYR B 335 0.613 8.826 5.340 1.00 0.00 H new ATOM 967 N GLN B 336 -5.327 6.192 1.993 1.00 0.00 N ATOM 968 CA GLN B 336 -5.489 7.122 0.861 1.00 0.00 C ATOM 969 C GLN B 336 -6.745 7.984 0.988 1.00 0.00 C ATOM 970 O GLN B 336 -6.685 9.199 0.792 1.00 0.00 O ATOM 971 CB GLN B 336 -5.541 6.373 -0.475 1.00 0.00 C ATOM 972 CG GLN B 336 -4.181 5.992 -1.038 1.00 0.00 C ATOM 973 CD GLN B 336 -3.211 7.160 -1.077 1.00 0.00 C ATOM 974 OE1 GLN B 336 -2.668 7.565 -0.049 1.00 0.00 O ATOM 975 NE2 GLN B 336 -3.002 7.722 -2.263 1.00 0.00 N ATOM 0 H GLN B 336 -5.181 5.220 1.719 1.00 0.00 H new ATOM 0 HA GLN B 336 -4.615 7.773 0.885 1.00 0.00 H new ATOM 0 HB2 GLN B 336 -6.134 5.467 -0.346 1.00 0.00 H new ATOM 0 HB3 GLN B 336 -6.061 6.993 -1.205 1.00 0.00 H new ATOM 0 HG2 GLN B 336 -3.754 5.191 -0.434 1.00 0.00 H new ATOM 0 HG3 GLN B 336 -4.308 5.597 -2.046 1.00 0.00 H new ATOM 0 HE21 GLN B 336 -3.472 7.356 -3.091 1.00 0.00 H new ATOM 0 HE22 GLN B 336 -2.372 8.520 -2.345 1.00 0.00 H new ATOM 984 N LYS B 337 -7.878 7.353 1.302 1.00 0.00 N ATOM 985 CA LYS B 337 -9.140 8.078 1.436 1.00 0.00 C ATOM 986 C LYS B 337 -9.021 9.168 2.494 1.00 0.00 C ATOM 987 O LYS B 337 -9.351 10.325 2.237 1.00 0.00 O ATOM 988 CB LYS B 337 -10.278 7.118 1.796 1.00 0.00 C ATOM 989 CG LYS B 337 -10.613 6.131 0.688 1.00 0.00 C ATOM 990 CD LYS B 337 -11.737 5.192 1.093 1.00 0.00 C ATOM 991 CE LYS B 337 -11.329 4.290 2.249 1.00 0.00 C ATOM 992 NZ LYS B 337 -12.419 3.352 2.640 1.00 0.00 N ATOM 0 H LYS B 337 -7.947 6.349 1.467 1.00 0.00 H new ATOM 0 HA LYS B 337 -9.367 8.544 0.477 1.00 0.00 H new ATOM 0 HB2 LYS B 337 -10.005 6.564 2.694 1.00 0.00 H new ATOM 0 HB3 LYS B 337 -11.169 7.698 2.037 1.00 0.00 H new ATOM 0 HG2 LYS B 337 -10.901 6.677 -0.211 1.00 0.00 H new ATOM 0 HG3 LYS B 337 -9.726 5.550 0.438 1.00 0.00 H new ATOM 0 HD2 LYS B 337 -12.613 5.775 1.378 1.00 0.00 H new ATOM 0 HD3 LYS B 337 -12.026 4.580 0.238 1.00 0.00 H new ATOM 0 HE2 LYS B 337 -10.444 3.719 1.968 1.00 0.00 H new ATOM 0 HE3 LYS B 337 -11.054 4.903 3.107 1.00 0.00 H new ATOM 0 HZ1 LYS B 337 -12.098 2.757 3.430 1.00 0.00 H new ATOM 0 HZ2 LYS B 337 -13.256 3.895 2.933 1.00 0.00 H new ATOM 0 HZ3 LYS B 337 -12.665 2.748 1.830 1.00 0.00 H new ATOM 1006 N GLU B 338 -8.539 8.791 3.676 1.00 0.00 N ATOM 1007 CA GLU B 338 -8.353 9.702 4.774 1.00 0.00 C ATOM 1008 C GLU B 338 -7.570 10.952 4.362 1.00 0.00 C ATOM 1009 O GLU B 338 -7.954 12.064 4.712 1.00 0.00 O ATOM 1010 CB GLU B 338 -7.618 8.938 5.864 1.00 0.00 C ATOM 1011 CG GLU B 338 -7.523 9.671 7.159 1.00 0.00 C ATOM 1012 CD GLU B 338 -6.497 10.791 7.137 1.00 0.00 C ATOM 1013 OE1 GLU B 338 -5.304 10.502 6.898 1.00 0.00 O ATOM 1014 OE2 GLU B 338 -6.885 11.955 7.357 1.00 0.00 O ATOM 0 H GLU B 338 -8.267 7.831 3.888 1.00 0.00 H new ATOM 0 HA GLU B 338 -9.321 10.059 5.127 1.00 0.00 H new ATOM 0 HB2 GLU B 338 -8.125 7.988 6.032 1.00 0.00 H new ATOM 0 HB3 GLU B 338 -6.612 8.705 5.515 1.00 0.00 H new ATOM 0 HG2 GLU B 338 -8.500 10.086 7.407 1.00 0.00 H new ATOM 0 HG3 GLU B 338 -7.266 8.967 7.950 1.00 0.00 H new ATOM 1021 N GLN B 339 -6.477 10.761 3.615 1.00 0.00 N ATOM 1022 CA GLN B 339 -5.650 11.885 3.161 1.00 0.00 C ATOM 1023 C GLN B 339 -6.513 12.930 2.463 1.00 0.00 C ATOM 1024 O GLN B 339 -6.516 14.105 2.839 1.00 0.00 O ATOM 1025 CB GLN B 339 -4.556 11.409 2.195 1.00 0.00 C ATOM 1026 CG GLN B 339 -3.786 10.191 2.682 1.00 0.00 C ATOM 1027 CD GLN B 339 -3.091 10.390 4.026 1.00 0.00 C ATOM 1028 OE1 GLN B 339 -2.718 9.417 4.681 1.00 0.00 O ATOM 1029 NE2 GLN B 339 -2.884 11.640 4.439 1.00 0.00 N ATOM 0 H GLN B 339 -6.146 9.845 3.313 1.00 0.00 H new ATOM 0 HA GLN B 339 -5.179 12.326 4.039 1.00 0.00 H new ATOM 0 HB2 GLN B 339 -5.012 11.177 1.233 1.00 0.00 H new ATOM 0 HB3 GLN B 339 -3.854 12.226 2.026 1.00 0.00 H new ATOM 0 HG2 GLN B 339 -4.473 9.348 2.761 1.00 0.00 H new ATOM 0 HG3 GLN B 339 -3.039 9.924 1.935 1.00 0.00 H new ATOM 0 HE21 GLN B 339 -3.206 12.424 3.872 1.00 0.00 H new ATOM 0 HE22 GLN B 339 -2.404 11.812 5.322 1.00 0.00 H new ATOM 1038 N ARG B 340 -7.245 12.484 1.446 1.00 0.00 N ATOM 1039 CA ARG B 340 -8.127 13.363 0.679 1.00 0.00 C ATOM 1040 C ARG B 340 -9.304 13.853 1.526 1.00 0.00 C ATOM 1041 O ARG B 340 -9.670 15.027 1.466 1.00 0.00 O ATOM 1042 CB ARG B 340 -8.638 12.640 -0.571 1.00 0.00 C ATOM 1043 CG ARG B 340 -7.541 12.338 -1.583 1.00 0.00 C ATOM 1044 CD ARG B 340 -8.090 11.639 -2.817 1.00 0.00 C ATOM 1045 NE ARG B 340 -7.053 11.411 -3.826 1.00 0.00 N ATOM 1046 CZ ARG B 340 -7.271 10.818 -5.002 1.00 0.00 C ATOM 1047 NH1 ARG B 340 -8.485 10.376 -5.323 1.00 0.00 N ATOM 1048 NH2 ARG B 340 -6.268 10.664 -5.861 1.00 0.00 N ATOM 0 H ARG B 340 -7.245 11.514 1.131 1.00 0.00 H new ATOM 0 HA ARG B 340 -7.548 14.235 0.376 1.00 0.00 H new ATOM 0 HB2 ARG B 340 -9.115 11.706 -0.273 1.00 0.00 H new ATOM 0 HB3 ARG B 340 -9.404 13.251 -1.048 1.00 0.00 H new ATOM 0 HG2 ARG B 340 -7.053 13.267 -1.878 1.00 0.00 H new ATOM 0 HG3 ARG B 340 -6.780 11.711 -1.118 1.00 0.00 H new ATOM 0 HD2 ARG B 340 -8.530 10.685 -2.527 1.00 0.00 H new ATOM 0 HD3 ARG B 340 -8.890 12.241 -3.249 1.00 0.00 H new ATOM 0 HE ARG B 340 -6.105 11.725 -3.617 1.00 0.00 H new ATOM 0 HH11 ARG B 340 -9.259 10.489 -4.668 1.00 0.00 H new ATOM 0 HH12 ARG B 340 -8.642 9.924 -6.224 1.00 0.00 H new ATOM 0 HH21 ARG B 340 -5.335 10.999 -5.621 1.00 0.00 H new ATOM 0 HH22 ARG B 340 -6.432 10.211 -6.760 1.00 0.00 H new ATOM 1062 N ASN B 341 -9.890 12.950 2.316 1.00 0.00 N ATOM 1063 CA ASN B 341 -11.024 13.287 3.180 1.00 0.00 C ATOM 1064 C ASN B 341 -10.668 14.390 4.179 1.00 0.00 C ATOM 1065 O ASN B 341 -11.360 15.405 4.263 1.00 0.00 O ATOM 1066 CB ASN B 341 -11.515 12.042 3.926 1.00 0.00 C ATOM 1067 CG ASN B 341 -12.367 11.136 3.054 1.00 0.00 C ATOM 1068 OD1 ASN B 341 -12.042 9.847 3.037 1.00 0.00 O flip ATOM 1069 ND2 ASN B 341 -13.319 11.586 2.417 1.00 0.00 N flip ATOM 0 H ASN B 341 -9.596 11.975 2.375 1.00 0.00 H new ATOM 0 HA ASN B 341 -11.823 13.662 2.540 1.00 0.00 H new ATOM 0 HB2 ASN B 341 -10.656 11.482 4.295 1.00 0.00 H new ATOM 0 HB3 ASN B 341 -12.093 12.350 4.797 1.00 0.00 H new ATOM 0 HD21 ASN B 341 -13.535 12.582 2.458 1.00 0.00 H new ATOM 0 HD22 ASN B 341 -13.893 10.963 1.849 1.00 0.00 H new ATOM 1076 N ALA B 342 -9.589 14.181 4.938 1.00 0.00 N ATOM 1077 CA ALA B 342 -9.137 15.150 5.938 1.00 0.00 C ATOM 1078 C ALA B 342 -8.915 16.535 5.332 1.00 0.00 C ATOM 1079 O ALA B 342 -9.248 17.545 5.950 1.00 0.00 O ATOM 1080 CB ALA B 342 -7.863 14.665 6.613 1.00 0.00 C ATOM 0 H ALA B 342 -9.010 13.344 4.878 1.00 0.00 H new ATOM 0 HA ALA B 342 -9.927 15.237 6.684 1.00 0.00 H new ATOM 0 HB1 ALA B 342 -7.542 15.398 7.353 1.00 0.00 H new ATOM 0 HB2 ALA B 342 -8.053 13.711 7.105 1.00 0.00 H new ATOM 0 HB3 ALA B 342 -7.081 14.538 5.865 1.00 0.00 H new ATOM 1086 N LYS B 343 -8.348 16.576 4.127 1.00 0.00 N ATOM 1087 CA LYS B 343 -8.083 17.842 3.447 1.00 0.00 C ATOM 1088 C LYS B 343 -9.387 18.537 3.044 1.00 0.00 C ATOM 1089 O LYS B 343 -9.525 19.752 3.199 1.00 0.00 O ATOM 1090 CB LYS B 343 -7.211 17.602 2.209 1.00 0.00 C ATOM 1091 CG LYS B 343 -6.863 18.872 1.451 1.00 0.00 C ATOM 1092 CD LYS B 343 -5.944 18.583 0.273 1.00 0.00 C ATOM 1093 CE LYS B 343 -5.517 19.861 -0.439 1.00 0.00 C ATOM 1094 NZ LYS B 343 -6.668 20.578 -1.060 1.00 0.00 N ATOM 0 H LYS B 343 -8.064 15.748 3.603 1.00 0.00 H new ATOM 0 HA LYS B 343 -7.552 18.494 4.140 1.00 0.00 H new ATOM 0 HB2 LYS B 343 -6.289 17.108 2.515 1.00 0.00 H new ATOM 0 HB3 LYS B 343 -7.730 16.919 1.537 1.00 0.00 H new ATOM 0 HG2 LYS B 343 -7.777 19.346 1.093 1.00 0.00 H new ATOM 0 HG3 LYS B 343 -6.380 19.579 2.126 1.00 0.00 H new ATOM 0 HD2 LYS B 343 -5.060 18.050 0.624 1.00 0.00 H new ATOM 0 HD3 LYS B 343 -6.453 17.927 -0.433 1.00 0.00 H new ATOM 0 HE2 LYS B 343 -5.022 20.522 0.272 1.00 0.00 H new ATOM 0 HE3 LYS B 343 -4.786 19.617 -1.210 1.00 0.00 H new ATOM 0 HZ1 LYS B 343 -6.315 21.373 -1.630 1.00 0.00 H new ATOM 0 HZ2 LYS B 343 -7.197 19.922 -1.670 1.00 0.00 H new ATOM 0 HZ3 LYS B 343 -7.296 20.939 -0.314 1.00 0.00 H new ATOM 1108 N GLU B 344 -10.332 17.756 2.522 1.00 0.00 N ATOM 1109 CA GLU B 344 -11.628 18.280 2.083 1.00 0.00 C ATOM 1110 C GLU B 344 -12.420 18.900 3.239 1.00 0.00 C ATOM 1111 O GLU B 344 -12.715 20.096 3.222 1.00 0.00 O ATOM 1112 CB GLU B 344 -12.449 17.167 1.425 1.00 0.00 C ATOM 1113 CG GLU B 344 -11.851 16.658 0.119 1.00 0.00 C ATOM 1114 CD GLU B 344 -12.521 15.395 -0.404 1.00 0.00 C ATOM 1115 OE1 GLU B 344 -13.451 14.882 0.261 1.00 0.00 O ATOM 1116 OE2 GLU B 344 -12.111 14.913 -1.479 1.00 0.00 O ATOM 0 H GLU B 344 -10.224 16.750 2.392 1.00 0.00 H new ATOM 0 HA GLU B 344 -11.432 19.070 1.358 1.00 0.00 H new ATOM 0 HB2 GLU B 344 -12.540 16.334 2.122 1.00 0.00 H new ATOM 0 HB3 GLU B 344 -13.457 17.535 1.234 1.00 0.00 H new ATOM 0 HG2 GLU B 344 -11.929 17.440 -0.636 1.00 0.00 H new ATOM 0 HG3 GLU B 344 -10.789 16.462 0.267 1.00 0.00 H new ATOM 1123 N ALA B 345 -12.774 18.080 4.235 1.00 0.00 N ATOM 1124 CA ALA B 345 -13.546 18.556 5.386 1.00 0.00 C ATOM 1125 C ALA B 345 -12.701 19.423 6.320 1.00 0.00 C ATOM 1126 O ALA B 345 -13.159 20.470 6.783 1.00 0.00 O ATOM 1127 CB ALA B 345 -14.135 17.377 6.148 1.00 0.00 C ATOM 0 H ALA B 345 -12.539 17.088 4.267 1.00 0.00 H new ATOM 0 HA ALA B 345 -14.356 19.178 5.005 1.00 0.00 H new ATOM 0 HB1 ALA B 345 -14.706 17.744 7.001 1.00 0.00 H new ATOM 0 HB2 ALA B 345 -14.791 16.809 5.489 1.00 0.00 H new ATOM 0 HB3 ALA B 345 -13.330 16.733 6.501 1.00 0.00 H new ATOM 1133 N GLY B 346 -11.470 18.987 6.590 1.00 0.00 N ATOM 1134 CA GLY B 346 -10.584 19.735 7.463 1.00 0.00 C ATOM 1135 C GLY B 346 -10.593 19.218 8.889 1.00 0.00 C ATOM 1136 O GLY B 346 -9.789 18.356 9.247 1.00 0.00 O ATOM 0 H GLY B 346 -11.072 18.125 6.217 1.00 0.00 H new ATOM 0 HA2 GLY B 346 -9.568 19.687 7.070 1.00 0.00 H new ATOM 0 HA3 GLY B 346 -10.878 20.785 7.460 1.00 0.00 H new ATOM 1140 N GLY B 347 -11.501 19.753 9.705 1.00 0.00 N ATOM 1141 CA GLY B 347 -11.600 19.342 11.098 1.00 0.00 C ATOM 1142 C GLY B 347 -12.870 18.563 11.414 1.00 0.00 C ATOM 1143 O GLY B 347 -12.942 17.893 12.446 1.00 0.00 O ATOM 0 H GLY B 347 -12.173 20.467 9.424 1.00 0.00 H new ATOM 0 HA2 GLY B 347 -10.735 18.728 11.350 1.00 0.00 H new ATOM 0 HA3 GLY B 347 -11.559 20.227 11.733 1.00 0.00 H new ATOM 1147 N ASN B 348 -13.874 18.649 10.537 1.00 0.00 N ATOM 1148 CA ASN B 348 -15.142 17.945 10.744 1.00 0.00 C ATOM 1149 C ASN B 348 -15.017 16.455 10.411 1.00 0.00 C ATOM 1150 O ASN B 348 -15.738 15.628 10.974 1.00 0.00 O ATOM 1151 CB ASN B 348 -16.249 18.578 9.895 1.00 0.00 C ATOM 1152 CG ASN B 348 -16.491 20.036 10.249 1.00 0.00 C ATOM 1153 OD1 ASN B 348 -16.853 20.358 11.381 1.00 0.00 O ATOM 1154 ND2 ASN B 348 -16.291 20.925 9.282 1.00 0.00 N ATOM 0 H ASN B 348 -13.833 19.198 9.678 1.00 0.00 H new ATOM 0 HA ASN B 348 -15.401 18.036 11.799 1.00 0.00 H new ATOM 0 HB2 ASN B 348 -15.982 18.503 8.841 1.00 0.00 H new ATOM 0 HB3 ASN B 348 -17.173 18.016 10.031 1.00 0.00 H new ATOM 0 HD21 ASN B 348 -16.437 21.918 9.464 1.00 0.00 H new ATOM 0 HD22 ASN B 348 -15.991 20.615 8.358 1.00 0.00 H new ATOM 1161 N TYR B 349 -14.104 16.120 9.496 1.00 0.00 N ATOM 1162 CA TYR B 349 -13.889 14.732 9.090 1.00 0.00 C ATOM 1163 C TYR B 349 -13.092 13.950 10.133 1.00 0.00 C ATOM 1164 O TYR B 349 -13.531 12.896 10.586 1.00 0.00 O ATOM 1165 CB TYR B 349 -13.141 14.674 7.750 1.00 0.00 C ATOM 1166 CG TYR B 349 -12.497 13.328 7.475 1.00 0.00 C ATOM 1167 CD1 TYR B 349 -13.262 12.224 7.126 1.00 0.00 C ATOM 1168 CD2 TYR B 349 -11.122 13.162 7.598 1.00 0.00 C ATOM 1169 CE1 TYR B 349 -12.676 10.992 6.901 1.00 0.00 C ATOM 1170 CE2 TYR B 349 -10.526 11.935 7.373 1.00 0.00 C ATOM 1171 CZ TYR B 349 -11.308 10.853 7.026 1.00 0.00 C ATOM 1172 OH TYR B 349 -10.724 9.627 6.805 1.00 0.00 O ATOM 0 H TYR B 349 -13.502 16.793 9.023 1.00 0.00 H new ATOM 0 HA TYR B 349 -14.874 14.275 8.990 1.00 0.00 H new ATOM 0 HB2 TYR B 349 -13.837 14.907 6.944 1.00 0.00 H new ATOM 0 HB3 TYR B 349 -12.371 15.445 7.739 1.00 0.00 H new ATOM 0 HD1 TYR B 349 -14.332 12.329 7.029 1.00 0.00 H new ATOM 0 HD2 TYR B 349 -10.509 14.007 7.874 1.00 0.00 H new ATOM 0 HE1 TYR B 349 -13.285 10.143 6.629 1.00 0.00 H new ATOM 0 HE2 TYR B 349 -9.456 11.824 7.468 1.00 0.00 H new ATOM 0 HH TYR B 349 -11.253 9.126 6.150 1.00 0.00 H new ATOM 1182 N THR B 350 -11.902 14.465 10.457 1.00 0.00 N ATOM 1183 CA THR B 350 -10.970 13.832 11.395 1.00 0.00 C ATOM 1184 C THR B 350 -10.453 12.520 10.787 1.00 0.00 C ATOM 1185 O THR B 350 -11.231 11.679 10.333 1.00 0.00 O ATOM 1186 CB THR B 350 -11.589 13.594 12.781 1.00 0.00 C ATOM 1187 OG1 THR B 350 -10.601 13.745 13.788 1.00 0.00 O ATOM 1188 CG2 THR B 350 -12.140 12.208 12.960 1.00 0.00 C ATOM 0 H THR B 350 -11.555 15.343 10.071 1.00 0.00 H new ATOM 0 HA THR B 350 -10.137 14.517 11.554 1.00 0.00 H new ATOM 0 HB THR B 350 -12.396 14.322 12.862 1.00 0.00 H new ATOM 0 HG1 THR B 350 -11.005 13.593 14.668 1.00 0.00 H new ATOM 0 HG21 THR B 350 -12.561 12.110 13.961 1.00 0.00 H new ATOM 0 HG22 THR B 350 -12.919 12.028 12.219 1.00 0.00 H new ATOM 0 HG23 THR B 350 -11.340 11.479 12.830 1.00 0.00 H new ATOM 1196 N PRO B 351 -9.122 12.350 10.740 1.00 0.00 N ATOM 1197 CA PRO B 351 -8.481 11.163 10.152 1.00 0.00 C ATOM 1198 C PRO B 351 -8.884 9.849 10.811 1.00 0.00 C ATOM 1199 O PRO B 351 -8.658 9.642 12.007 1.00 0.00 O ATOM 1200 CB PRO B 351 -6.986 11.423 10.368 1.00 0.00 C ATOM 1201 CG PRO B 351 -6.880 12.897 10.515 1.00 0.00 C ATOM 1202 CD PRO B 351 -8.130 13.317 11.229 1.00 0.00 C ATOM 0 HA PRO B 351 -8.776 11.041 9.110 1.00 0.00 H new ATOM 0 HB2 PRO B 351 -6.618 10.909 11.256 1.00 0.00 H new ATOM 0 HB3 PRO B 351 -6.395 11.065 9.525 1.00 0.00 H new ATOM 0 HG2 PRO B 351 -5.992 13.172 11.083 1.00 0.00 H new ATOM 0 HG3 PRO B 351 -6.800 13.384 9.543 1.00 0.00 H new ATOM 0 HD2 PRO B 351 -8.014 13.266 12.312 1.00 0.00 H new ATOM 0 HD3 PRO B 351 -8.410 14.342 10.986 1.00 0.00 H new ATOM 1210 N ALA B 352 -9.451 8.949 10.007 1.00 0.00 N ATOM 1211 CA ALA B 352 -9.852 7.629 10.483 1.00 0.00 C ATOM 1212 C ALA B 352 -8.654 6.671 10.470 1.00 0.00 C ATOM 1213 O ALA B 352 -8.692 5.609 11.090 1.00 0.00 O ATOM 1214 CB ALA B 352 -10.988 7.078 9.629 1.00 0.00 C ATOM 0 H ALA B 352 -9.643 9.113 9.019 1.00 0.00 H new ATOM 0 HA ALA B 352 -10.208 7.722 11.509 1.00 0.00 H new ATOM 0 HB1 ALA B 352 -11.275 6.093 9.997 1.00 0.00 H new ATOM 0 HB2 ALA B 352 -11.844 7.750 9.685 1.00 0.00 H new ATOM 0 HB3 ALA B 352 -10.658 6.996 8.593 1.00 0.00 H new ATOM 1220 N LEU B 353 -7.587 7.076 9.768 1.00 0.00 N ATOM 1221 CA LEU B 353 -6.358 6.293 9.664 1.00 0.00 C ATOM 1222 C LEU B 353 -5.174 7.187 9.332 1.00 0.00 C ATOM 1223 O LEU B 353 -5.330 8.331 8.902 1.00 0.00 O ATOM 1224 CB LEU B 353 -6.438 5.239 8.555 1.00 0.00 C ATOM 1225 CG LEU B 353 -6.493 3.781 9.003 1.00 0.00 C ATOM 1226 CD1 LEU B 353 -7.872 3.402 9.524 1.00 0.00 C ATOM 1227 CD2 LEU B 353 -6.053 2.867 7.863 1.00 0.00 C ATOM 0 H LEU B 353 -7.556 7.958 9.257 1.00 0.00 H new ATOM 0 HA LEU B 353 -6.231 5.808 10.632 1.00 0.00 H new ATOM 0 HB2 LEU B 353 -7.323 5.444 7.953 1.00 0.00 H new ATOM 0 HB3 LEU B 353 -5.573 5.363 7.903 1.00 0.00 H new ATOM 0 HG LEU B 353 -5.800 3.653 9.835 1.00 0.00 H new ATOM 0 HD11 LEU B 353 -7.870 2.357 9.833 1.00 0.00 H new ATOM 0 HD12 LEU B 353 -8.124 4.032 10.377 1.00 0.00 H new ATOM 0 HD13 LEU B 353 -8.611 3.546 8.736 1.00 0.00 H new ATOM 0 HD21 LEU B 353 -6.095 1.829 8.192 1.00 0.00 H new ATOM 0 HD22 LEU B 353 -6.717 3.005 7.009 1.00 0.00 H new ATOM 0 HD23 LEU B 353 -5.032 3.114 7.572 1.00 0.00 H new ATOM 1239 N THR B 354 -3.992 6.622 9.500 1.00 0.00 N ATOM 1240 CA THR B 354 -2.740 7.294 9.198 1.00 0.00 C ATOM 1241 C THR B 354 -1.689 6.237 8.891 1.00 0.00 C ATOM 1242 O THR B 354 -1.996 5.042 8.890 1.00 0.00 O ATOM 1243 CB THR B 354 -2.288 8.174 10.370 1.00 0.00 C ATOM 1244 OG1 THR B 354 -2.180 7.415 11.562 1.00 0.00 O ATOM 1245 CG2 THR B 354 -3.217 9.339 10.649 1.00 0.00 C ATOM 0 H THR B 354 -3.873 5.673 9.854 1.00 0.00 H new ATOM 0 HA THR B 354 -2.878 7.947 8.336 1.00 0.00 H new ATOM 0 HB THR B 354 -1.319 8.571 10.066 1.00 0.00 H new ATOM 0 HG1 THR B 354 -1.889 7.997 12.295 1.00 0.00 H new ATOM 0 HG21 THR B 354 -2.834 9.917 11.490 1.00 0.00 H new ATOM 0 HG22 THR B 354 -3.275 9.977 9.767 1.00 0.00 H new ATOM 0 HG23 THR B 354 -4.211 8.962 10.890 1.00 0.00 H new ATOM 1253 N GLU B 355 -0.452 6.658 8.662 1.00 0.00 N ATOM 1254 CA GLU B 355 0.620 5.702 8.397 1.00 0.00 C ATOM 1255 C GLU B 355 0.682 4.691 9.547 1.00 0.00 C ATOM 1256 O GLU B 355 1.076 3.540 9.359 1.00 0.00 O ATOM 1257 CB GLU B 355 1.980 6.402 8.262 1.00 0.00 C ATOM 1258 CG GLU B 355 2.027 7.529 7.242 1.00 0.00 C ATOM 1259 CD GLU B 355 1.473 8.843 7.769 1.00 0.00 C ATOM 1260 OE1 GLU B 355 2.040 9.375 8.746 1.00 0.00 O ATOM 1261 OE2 GLU B 355 0.476 9.339 7.205 1.00 0.00 O ATOM 0 H GLU B 355 -0.167 7.637 8.654 1.00 0.00 H new ATOM 0 HA GLU B 355 0.405 5.199 7.454 1.00 0.00 H new ATOM 0 HB2 GLU B 355 2.264 6.802 9.236 1.00 0.00 H new ATOM 0 HB3 GLU B 355 2.729 5.658 7.993 1.00 0.00 H new ATOM 0 HG2 GLU B 355 3.059 7.679 6.925 1.00 0.00 H new ATOM 0 HG3 GLU B 355 1.462 7.233 6.358 1.00 0.00 H new ATOM 1268 N GLN B 356 0.280 5.152 10.739 1.00 0.00 N ATOM 1269 CA GLN B 356 0.272 4.334 11.947 1.00 0.00 C ATOM 1270 C GLN B 356 -0.681 3.146 11.830 1.00 0.00 C ATOM 1271 O GLN B 356 -0.309 2.030 12.186 1.00 0.00 O ATOM 1272 CB GLN B 356 -0.107 5.189 13.159 1.00 0.00 C ATOM 1273 CG GLN B 356 0.854 6.340 13.416 1.00 0.00 C ATOM 1274 CD GLN B 356 0.425 7.214 14.579 1.00 0.00 C ATOM 1275 OE1 GLN B 356 0.320 6.749 15.714 1.00 0.00 O ATOM 1276 NE2 GLN B 356 0.171 8.490 14.302 1.00 0.00 N ATOM 0 H GLN B 356 -0.049 6.106 10.887 1.00 0.00 H new ATOM 0 HA GLN B 356 1.279 3.937 12.078 1.00 0.00 H new ATOM 0 HB2 GLN B 356 -1.110 5.590 13.011 1.00 0.00 H new ATOM 0 HB3 GLN B 356 -0.145 4.554 14.044 1.00 0.00 H new ATOM 0 HG2 GLN B 356 1.848 5.940 13.615 1.00 0.00 H new ATOM 0 HG3 GLN B 356 0.931 6.951 12.517 1.00 0.00 H new ATOM 0 HE21 GLN B 356 0.271 8.834 13.347 1.00 0.00 H new ATOM 0 HE22 GLN B 356 -0.123 9.124 15.045 1.00 0.00 H new ATOM 1285 N GLU B 357 -1.906 3.369 11.328 1.00 0.00 N ATOM 1286 CA GLU B 357 -2.862 2.273 11.180 1.00 0.00 C ATOM 1287 C GLU B 357 -2.424 1.343 10.062 1.00 0.00 C ATOM 1288 O GLU B 357 -2.602 0.127 10.138 1.00 0.00 O ATOM 1289 CB GLU B 357 -4.256 2.789 10.831 1.00 0.00 C ATOM 1290 CG GLU B 357 -4.815 3.872 11.744 1.00 0.00 C ATOM 1291 CD GLU B 357 -4.965 3.424 13.186 1.00 0.00 C ATOM 1292 OE1 GLU B 357 -3.933 3.150 13.838 1.00 0.00 O ATOM 1293 OE2 GLU B 357 -6.115 3.345 13.665 1.00 0.00 O ATOM 0 H GLU B 357 -2.248 4.281 11.025 1.00 0.00 H new ATOM 0 HA GLU B 357 -2.894 1.748 12.134 1.00 0.00 H new ATOM 0 HB2 GLU B 357 -4.234 3.176 9.812 1.00 0.00 H new ATOM 0 HB3 GLU B 357 -4.946 1.945 10.836 1.00 0.00 H new ATOM 0 HG2 GLU B 357 -4.159 4.742 11.708 1.00 0.00 H new ATOM 0 HG3 GLU B 357 -5.787 4.189 11.367 1.00 0.00 H new ATOM 1300 N VAL B 358 -1.872 1.943 9.011 1.00 0.00 N ATOM 1301 CA VAL B 358 -1.426 1.202 7.843 1.00 0.00 C ATOM 1302 C VAL B 358 -0.274 0.265 8.183 1.00 0.00 C ATOM 1303 O VAL B 358 -0.408 -0.953 8.067 1.00 0.00 O ATOM 1304 CB VAL B 358 -0.997 2.186 6.737 1.00 0.00 C ATOM 1305 CG1 VAL B 358 -0.575 1.461 5.473 1.00 0.00 C ATOM 1306 CG2 VAL B 358 -2.124 3.159 6.447 1.00 0.00 C ATOM 0 H VAL B 358 -1.723 2.950 8.948 1.00 0.00 H new ATOM 0 HA VAL B 358 -2.258 0.593 7.490 1.00 0.00 H new ATOM 0 HB VAL B 358 -0.130 2.740 7.095 1.00 0.00 H new ATOM 0 HG11 VAL B 358 -0.280 2.189 4.717 1.00 0.00 H new ATOM 0 HG12 VAL B 358 0.267 0.805 5.694 1.00 0.00 H new ATOM 0 HG13 VAL B 358 -1.409 0.867 5.099 1.00 0.00 H new ATOM 0 HG21 VAL B 358 -1.814 3.852 5.664 1.00 0.00 H new ATOM 0 HG22 VAL B 358 -3.004 2.608 6.116 1.00 0.00 H new ATOM 0 HG23 VAL B 358 -2.364 3.718 7.352 1.00 0.00 H new ATOM 1316 N TYR B 359 0.842 0.832 8.630 1.00 0.00 N ATOM 1317 CA TYR B 359 2.005 0.039 9.013 1.00 0.00 C ATOM 1318 C TYR B 359 1.655 -0.945 10.133 1.00 0.00 C ATOM 1319 O TYR B 359 2.207 -2.042 10.198 1.00 0.00 O ATOM 1320 CB TYR B 359 3.160 0.958 9.433 1.00 0.00 C ATOM 1321 CG TYR B 359 4.439 0.225 9.775 1.00 0.00 C ATOM 1322 CD1 TYR B 359 4.574 -0.462 10.976 1.00 0.00 C ATOM 1323 CD2 TYR B 359 5.510 0.211 8.890 1.00 0.00 C ATOM 1324 CE1 TYR B 359 5.738 -1.138 11.285 1.00 0.00 C ATOM 1325 CE2 TYR B 359 6.677 -0.463 9.191 1.00 0.00 C ATOM 1326 CZ TYR B 359 6.787 -1.136 10.389 1.00 0.00 C ATOM 1327 OH TYR B 359 7.949 -1.808 10.693 1.00 0.00 O ATOM 0 H TYR B 359 0.966 1.839 8.736 1.00 0.00 H new ATOM 0 HA TYR B 359 2.323 -0.543 8.148 1.00 0.00 H new ATOM 0 HB2 TYR B 359 3.362 1.662 8.626 1.00 0.00 H new ATOM 0 HB3 TYR B 359 2.848 1.545 10.297 1.00 0.00 H new ATOM 0 HD1 TYR B 359 3.755 -0.467 11.679 1.00 0.00 H new ATOM 0 HD2 TYR B 359 5.428 0.737 7.950 1.00 0.00 H new ATOM 0 HE1 TYR B 359 5.827 -1.665 12.223 1.00 0.00 H new ATOM 0 HE2 TYR B 359 7.500 -0.463 8.491 1.00 0.00 H new ATOM 0 HH TYR B 359 8.587 -1.708 9.956 1.00 0.00 H new ATOM 1337 N ALA B 360 0.734 -0.538 11.015 1.00 0.00 N ATOM 1338 CA ALA B 360 0.312 -1.376 12.140 1.00 0.00 C ATOM 1339 C ALA B 360 -0.340 -2.681 11.678 1.00 0.00 C ATOM 1340 O ALA B 360 0.130 -3.768 12.017 1.00 0.00 O ATOM 1341 CB ALA B 360 -0.641 -0.611 13.048 1.00 0.00 C ATOM 0 H ALA B 360 0.267 0.368 10.970 1.00 0.00 H new ATOM 0 HA ALA B 360 1.212 -1.637 12.697 1.00 0.00 H new ATOM 0 HB1 ALA B 360 -0.944 -1.249 13.878 1.00 0.00 H new ATOM 0 HB2 ALA B 360 -0.140 0.276 13.436 1.00 0.00 H new ATOM 0 HB3 ALA B 360 -1.522 -0.311 12.481 1.00 0.00 H new ATOM 1347 N GLN B 361 -1.431 -2.565 10.919 1.00 0.00 N ATOM 1348 CA GLN B 361 -2.156 -3.740 10.430 1.00 0.00 C ATOM 1349 C GLN B 361 -1.312 -4.559 9.450 1.00 0.00 C ATOM 1350 O GLN B 361 -1.392 -5.788 9.437 1.00 0.00 O ATOM 1351 CB GLN B 361 -3.479 -3.322 9.777 1.00 0.00 C ATOM 1352 CG GLN B 361 -4.402 -2.558 10.722 1.00 0.00 C ATOM 1353 CD GLN B 361 -5.758 -2.203 10.119 1.00 0.00 C ATOM 1354 OE1 GLN B 361 -6.127 -2.838 9.007 1.00 0.00 O flip ATOM 1355 NE2 GLN B 361 -6.485 -1.378 10.671 1.00 0.00 N flip ATOM 0 H GLN B 361 -1.831 -1.672 10.630 1.00 0.00 H new ATOM 0 HA GLN B 361 -2.372 -4.374 11.290 1.00 0.00 H new ATOM 0 HB2 GLN B 361 -3.267 -2.701 8.907 1.00 0.00 H new ATOM 0 HB3 GLN B 361 -3.995 -4.211 9.416 1.00 0.00 H new ATOM 0 HG2 GLN B 361 -4.561 -3.156 11.619 1.00 0.00 H new ATOM 0 HG3 GLN B 361 -3.904 -1.640 11.035 1.00 0.00 H new ATOM 0 HE21 GLN B 361 -6.171 -0.910 11.521 1.00 0.00 H new ATOM 0 HE22 GLN B 361 -7.401 -1.162 10.278 1.00 0.00 H new ATOM 1364 N VAL B 362 -0.493 -3.880 8.643 1.00 0.00 N ATOM 1365 CA VAL B 362 0.374 -4.561 7.677 1.00 0.00 C ATOM 1366 C VAL B 362 1.470 -5.346 8.396 1.00 0.00 C ATOM 1367 O VAL B 362 1.826 -6.449 7.978 1.00 0.00 O ATOM 1368 CB VAL B 362 1.029 -3.568 6.696 1.00 0.00 C ATOM 1369 CG1 VAL B 362 1.933 -4.296 5.709 1.00 0.00 C ATOM 1370 CG2 VAL B 362 -0.030 -2.758 5.960 1.00 0.00 C ATOM 0 H VAL B 362 -0.412 -2.863 8.639 1.00 0.00 H new ATOM 0 HA VAL B 362 -0.259 -5.244 7.110 1.00 0.00 H new ATOM 0 HB VAL B 362 1.644 -2.879 7.274 1.00 0.00 H new ATOM 0 HG11 VAL B 362 2.383 -3.574 5.028 1.00 0.00 H new ATOM 0 HG12 VAL B 362 2.718 -4.820 6.253 1.00 0.00 H new ATOM 0 HG13 VAL B 362 1.345 -5.015 5.139 1.00 0.00 H new ATOM 0 HG21 VAL B 362 0.455 -2.064 5.273 1.00 0.00 H new ATOM 0 HG22 VAL B 362 -0.678 -3.431 5.398 1.00 0.00 H new ATOM 0 HG23 VAL B 362 -0.626 -2.198 6.681 1.00 0.00 H new ATOM 1380 N ALA B 363 1.995 -4.772 9.484 1.00 0.00 N ATOM 1381 CA ALA B 363 3.043 -5.419 10.273 1.00 0.00 C ATOM 1382 C ALA B 363 2.611 -6.814 10.726 1.00 0.00 C ATOM 1383 O ALA B 363 3.428 -7.735 10.782 1.00 0.00 O ATOM 1384 CB ALA B 363 3.409 -4.561 11.478 1.00 0.00 C ATOM 0 H ALA B 363 1.709 -3.859 9.837 1.00 0.00 H new ATOM 0 HA ALA B 363 3.923 -5.527 9.638 1.00 0.00 H new ATOM 0 HB1 ALA B 363 4.190 -5.057 12.054 1.00 0.00 H new ATOM 0 HB2 ALA B 363 3.770 -3.591 11.137 1.00 0.00 H new ATOM 0 HB3 ALA B 363 2.529 -4.421 12.106 1.00 0.00 H new ATOM 1390 N ARG B 364 1.316 -6.967 11.027 1.00 0.00 N ATOM 1391 CA ARG B 364 0.777 -8.259 11.451 1.00 0.00 C ATOM 1392 C ARG B 364 0.756 -9.247 10.288 1.00 0.00 C ATOM 1393 O ARG B 364 0.988 -10.439 10.475 1.00 0.00 O ATOM 1394 CB ARG B 364 -0.629 -8.103 12.042 1.00 0.00 C ATOM 1395 CG ARG B 364 -0.634 -7.882 13.546 1.00 0.00 C ATOM 1396 CD ARG B 364 -2.049 -7.751 14.090 1.00 0.00 C ATOM 1397 NE ARG B 364 -2.101 -7.906 15.546 1.00 0.00 N ATOM 1398 CZ ARG B 364 -1.534 -7.067 16.420 1.00 0.00 C ATOM 1399 NH1 ARG B 364 -0.910 -5.966 16.004 1.00 0.00 N ATOM 1400 NH2 ARG B 364 -1.608 -7.324 17.723 1.00 0.00 N ATOM 0 H ARG B 364 0.628 -6.215 10.984 1.00 0.00 H new ATOM 0 HA ARG B 364 1.433 -8.653 12.228 1.00 0.00 H new ATOM 0 HB2 ARG B 364 -1.127 -7.263 11.558 1.00 0.00 H new ATOM 0 HB3 ARG B 364 -1.212 -8.995 11.812 1.00 0.00 H new ATOM 0 HG2 ARG B 364 -0.130 -8.714 14.038 1.00 0.00 H new ATOM 0 HG3 ARG B 364 -0.068 -6.981 13.784 1.00 0.00 H new ATOM 0 HD2 ARG B 364 -2.453 -6.776 13.816 1.00 0.00 H new ATOM 0 HD3 ARG B 364 -2.686 -8.502 13.624 1.00 0.00 H new ATOM 0 HE ARG B 364 -2.605 -8.710 15.919 1.00 0.00 H new ATOM 0 HH11 ARG B 364 -0.860 -5.754 15.008 1.00 0.00 H new ATOM 0 HH12 ARG B 364 -0.482 -5.335 16.682 1.00 0.00 H new ATOM 0 HH21 ARG B 364 -2.095 -8.158 18.052 1.00 0.00 H new ATOM 0 HH22 ARG B 364 -1.177 -6.687 18.394 1.00 0.00 H new ATOM 1414 N LEU B 365 0.488 -8.745 9.084 1.00 0.00 N ATOM 1415 CA LEU B 365 0.465 -9.593 7.899 1.00 0.00 C ATOM 1416 C LEU B 365 1.863 -10.149 7.610 1.00 0.00 C ATOM 1417 O LEU B 365 2.031 -11.343 7.356 1.00 0.00 O ATOM 1418 CB LEU B 365 -0.028 -8.813 6.666 1.00 0.00 C ATOM 1419 CG LEU B 365 -1.389 -8.120 6.802 1.00 0.00 C ATOM 1420 CD1 LEU B 365 -1.780 -7.443 5.493 1.00 0.00 C ATOM 1421 CD2 LEU B 365 -2.464 -9.106 7.240 1.00 0.00 C ATOM 0 H LEU B 365 0.285 -7.761 8.906 1.00 0.00 H new ATOM 0 HA LEU B 365 -0.223 -10.414 8.098 1.00 0.00 H new ATOM 0 HB2 LEU B 365 0.718 -8.058 6.418 1.00 0.00 H new ATOM 0 HB3 LEU B 365 -0.077 -9.501 5.822 1.00 0.00 H new ATOM 0 HG LEU B 365 -1.302 -7.354 7.573 1.00 0.00 H new ATOM 0 HD11 LEU B 365 -2.749 -6.957 5.610 1.00 0.00 H new ATOM 0 HD12 LEU B 365 -1.029 -6.698 5.230 1.00 0.00 H new ATOM 0 HD13 LEU B 365 -1.842 -8.190 4.701 1.00 0.00 H new ATOM 0 HD21 LEU B 365 -3.419 -8.588 7.329 1.00 0.00 H new ATOM 0 HD22 LEU B 365 -2.550 -9.902 6.501 1.00 0.00 H new ATOM 0 HD23 LEU B 365 -2.193 -9.535 8.205 1.00 0.00 H new ATOM 1433 N PHE B 366 2.854 -9.248 7.599 1.00 0.00 N ATOM 1434 CA PHE B 366 4.238 -9.593 7.287 1.00 0.00 C ATOM 1435 C PHE B 366 5.063 -9.952 8.537 1.00 0.00 C ATOM 1436 O PHE B 366 6.218 -9.533 8.657 1.00 0.00 O ATOM 1437 CB PHE B 366 4.859 -8.394 6.564 1.00 0.00 C ATOM 1438 CG PHE B 366 4.056 -7.883 5.387 1.00 0.00 C ATOM 1439 CD1 PHE B 366 2.888 -8.518 4.984 1.00 0.00 C ATOM 1440 CD2 PHE B 366 4.463 -6.755 4.693 1.00 0.00 C ATOM 1441 CE1 PHE B 366 2.151 -8.044 3.922 1.00 0.00 C ATOM 1442 CE2 PHE B 366 3.724 -6.275 3.626 1.00 0.00 C ATOM 1443 CZ PHE B 366 2.564 -6.924 3.243 1.00 0.00 C ATOM 0 H PHE B 366 2.714 -8.259 7.807 1.00 0.00 H new ATOM 0 HA PHE B 366 4.246 -10.484 6.660 1.00 0.00 H new ATOM 0 HB2 PHE B 366 4.988 -7.582 7.279 1.00 0.00 H new ATOM 0 HB3 PHE B 366 5.854 -8.672 6.215 1.00 0.00 H new ATOM 0 HD1 PHE B 366 2.553 -9.398 5.513 1.00 0.00 H new ATOM 0 HD2 PHE B 366 5.368 -6.244 4.988 1.00 0.00 H new ATOM 0 HE1 PHE B 366 1.247 -8.554 3.623 1.00 0.00 H new ATOM 0 HE2 PHE B 366 4.052 -5.395 3.093 1.00 0.00 H new ATOM 0 HZ PHE B 366 1.984 -6.551 2.412 1.00 0.00 H new ATOM 1453 N LYS B 367 4.475 -10.716 9.466 1.00 0.00 N ATOM 1454 CA LYS B 367 5.172 -11.112 10.702 1.00 0.00 C ATOM 1455 C LYS B 367 6.567 -11.694 10.443 1.00 0.00 C ATOM 1456 O LYS B 367 7.576 -11.062 10.760 1.00 0.00 O ATOM 1457 CB LYS B 367 4.341 -12.119 11.505 1.00 0.00 C ATOM 1458 CG LYS B 367 3.187 -11.495 12.273 1.00 0.00 C ATOM 1459 CD LYS B 367 3.670 -10.476 13.299 1.00 0.00 C ATOM 1460 CE LYS B 367 4.585 -11.111 14.338 1.00 0.00 C ATOM 1461 NZ LYS B 367 5.050 -10.122 15.352 1.00 0.00 N ATOM 0 H LYS B 367 3.522 -11.072 9.389 1.00 0.00 H new ATOM 0 HA LYS B 367 5.298 -10.196 11.279 1.00 0.00 H new ATOM 0 HB2 LYS B 367 3.946 -12.873 10.824 1.00 0.00 H new ATOM 0 HB3 LYS B 367 4.995 -12.636 12.208 1.00 0.00 H new ATOM 0 HG2 LYS B 367 2.506 -11.011 11.574 1.00 0.00 H new ATOM 0 HG3 LYS B 367 2.622 -12.278 12.778 1.00 0.00 H new ATOM 0 HD2 LYS B 367 4.201 -9.671 12.790 1.00 0.00 H new ATOM 0 HD3 LYS B 367 2.811 -10.026 13.797 1.00 0.00 H new ATOM 0 HE2 LYS B 367 4.057 -11.922 14.839 1.00 0.00 H new ATOM 0 HE3 LYS B 367 5.448 -11.552 13.840 1.00 0.00 H new ATOM 0 HZ1 LYS B 367 5.670 -10.595 16.040 1.00 0.00 H new ATOM 0 HZ2 LYS B 367 5.576 -9.360 14.878 1.00 0.00 H new ATOM 0 HZ3 LYS B 367 4.228 -9.719 15.846 1.00 0.00 H new ATOM 1475 N ASN B 368 6.615 -12.912 9.894 1.00 0.00 N ATOM 1476 CA ASN B 368 7.888 -13.596 9.628 1.00 0.00 C ATOM 1477 C ASN B 368 8.507 -13.200 8.280 1.00 0.00 C ATOM 1478 O ASN B 368 9.158 -14.021 7.628 1.00 0.00 O ATOM 1479 CB ASN B 368 7.691 -15.118 9.689 1.00 0.00 C ATOM 1480 CG ASN B 368 6.625 -15.619 8.726 1.00 0.00 C ATOM 1481 OD1 ASN B 368 6.750 -15.470 7.509 1.00 0.00 O ATOM 1482 ND2 ASN B 368 5.567 -16.214 9.267 1.00 0.00 N ATOM 0 H ASN B 368 5.788 -13.446 9.625 1.00 0.00 H new ATOM 0 HA ASN B 368 8.586 -13.280 10.404 1.00 0.00 H new ATOM 0 HB2 ASN B 368 8.637 -15.610 9.463 1.00 0.00 H new ATOM 0 HB3 ASN B 368 7.418 -15.403 10.705 1.00 0.00 H new ATOM 0 HD21 ASN B 368 4.820 -16.567 8.670 1.00 0.00 H new ATOM 0 HD22 ASN B 368 5.502 -16.317 10.280 1.00 0.00 H new ATOM 1489 N GLN B 369 8.322 -11.947 7.869 1.00 0.00 N ATOM 1490 CA GLN B 369 8.881 -11.469 6.609 1.00 0.00 C ATOM 1491 C GLN B 369 9.200 -9.976 6.670 1.00 0.00 C ATOM 1492 O GLN B 369 8.621 -9.170 5.939 1.00 0.00 O ATOM 1493 CB GLN B 369 7.932 -11.789 5.449 1.00 0.00 C ATOM 1494 CG GLN B 369 6.476 -11.466 5.734 1.00 0.00 C ATOM 1495 CD GLN B 369 5.536 -12.218 4.816 1.00 0.00 C ATOM 1496 OE1 GLN B 369 5.500 -11.974 3.610 1.00 0.00 O ATOM 1497 NE2 GLN B 369 4.781 -13.156 5.382 1.00 0.00 N ATOM 0 H GLN B 369 7.791 -11.248 8.389 1.00 0.00 H new ATOM 0 HA GLN B 369 9.822 -11.991 6.435 1.00 0.00 H new ATOM 0 HB2 GLN B 369 8.251 -11.232 4.568 1.00 0.00 H new ATOM 0 HB3 GLN B 369 8.017 -12.848 5.205 1.00 0.00 H new ATOM 0 HG2 GLN B 369 6.246 -11.714 6.770 1.00 0.00 H new ATOM 0 HG3 GLN B 369 6.314 -10.394 5.620 1.00 0.00 H new ATOM 0 HE21 GLN B 369 4.844 -13.324 6.386 1.00 0.00 H new ATOM 0 HE22 GLN B 369 4.139 -13.707 4.812 1.00 0.00 H new ATOM 1506 N GLU B 370 10.143 -9.624 7.552 1.00 0.00 N ATOM 1507 CA GLU B 370 10.578 -8.235 7.723 1.00 0.00 C ATOM 1508 C GLU B 370 10.958 -7.586 6.389 1.00 0.00 C ATOM 1509 O GLU B 370 10.928 -6.362 6.264 1.00 0.00 O ATOM 1510 CB GLU B 370 11.757 -8.158 8.699 1.00 0.00 C ATOM 1511 CG GLU B 370 11.431 -8.667 10.101 1.00 0.00 C ATOM 1512 CD GLU B 370 10.371 -7.842 10.822 1.00 0.00 C ATOM 1513 OE1 GLU B 370 9.941 -6.797 10.285 1.00 0.00 O ATOM 1514 OE2 GLU B 370 9.975 -8.242 11.938 1.00 0.00 O ATOM 0 H GLU B 370 10.621 -10.288 8.161 1.00 0.00 H new ATOM 0 HA GLU B 370 9.734 -7.680 8.134 1.00 0.00 H new ATOM 0 HB2 GLU B 370 12.588 -8.737 8.297 1.00 0.00 H new ATOM 0 HB3 GLU B 370 12.093 -7.123 8.767 1.00 0.00 H new ATOM 0 HG2 GLU B 370 11.090 -9.700 10.033 1.00 0.00 H new ATOM 0 HG3 GLU B 370 12.343 -8.671 10.698 1.00 0.00 H new ATOM 1521 N ASP B 371 11.306 -8.410 5.392 1.00 0.00 N ATOM 1522 CA ASP B 371 11.678 -7.905 4.071 1.00 0.00 C ATOM 1523 C ASP B 371 10.483 -7.219 3.426 1.00 0.00 C ATOM 1524 O ASP B 371 10.571 -6.064 3.006 1.00 0.00 O ATOM 1525 CB ASP B 371 12.163 -9.050 3.176 1.00 0.00 C ATOM 1526 CG ASP B 371 13.427 -9.731 3.686 1.00 0.00 C ATOM 1527 OD1 ASP B 371 13.971 -9.300 4.728 1.00 0.00 O ATOM 1528 OD2 ASP B 371 13.876 -10.699 3.037 1.00 0.00 O ATOM 0 H ASP B 371 11.337 -9.426 5.478 1.00 0.00 H new ATOM 0 HA ASP B 371 12.489 -7.186 4.188 1.00 0.00 H new ATOM 0 HB2 ASP B 371 11.370 -9.793 3.089 1.00 0.00 H new ATOM 0 HB3 ASP B 371 12.348 -8.663 2.174 1.00 0.00 H new ATOM 1533 N LEU B 372 9.353 -7.930 3.383 1.00 0.00 N ATOM 1534 CA LEU B 372 8.119 -7.380 2.830 1.00 0.00 C ATOM 1535 C LEU B 372 7.788 -6.053 3.516 1.00 0.00 C ATOM 1536 O LEU B 372 7.384 -5.093 2.865 1.00 0.00 O ATOM 1537 CB LEU B 372 6.959 -8.375 3.003 1.00 0.00 C ATOM 1538 CG LEU B 372 6.804 -9.434 1.898 1.00 0.00 C ATOM 1539 CD1 LEU B 372 6.253 -8.804 0.627 1.00 0.00 C ATOM 1540 CD2 LEU B 372 8.129 -10.135 1.613 1.00 0.00 C ATOM 0 H LEU B 372 9.270 -8.887 3.725 1.00 0.00 H new ATOM 0 HA LEU B 372 8.261 -7.203 1.764 1.00 0.00 H new ATOM 0 HB2 LEU B 372 7.088 -8.889 3.955 1.00 0.00 H new ATOM 0 HB3 LEU B 372 6.029 -7.810 3.069 1.00 0.00 H new ATOM 0 HG LEU B 372 6.096 -10.184 2.252 1.00 0.00 H new ATOM 0 HD11 LEU B 372 6.150 -9.569 -0.143 1.00 0.00 H new ATOM 0 HD12 LEU B 372 5.278 -8.363 0.833 1.00 0.00 H new ATOM 0 HD13 LEU B 372 6.936 -8.029 0.280 1.00 0.00 H new ATOM 0 HD21 LEU B 372 7.986 -10.877 0.828 1.00 0.00 H new ATOM 0 HD22 LEU B 372 8.867 -9.401 1.289 1.00 0.00 H new ATOM 0 HD23 LEU B 372 8.482 -10.628 2.519 1.00 0.00 H new ATOM 1552 N LEU B 373 7.985 -6.007 4.838 1.00 0.00 N ATOM 1553 CA LEU B 373 7.727 -4.792 5.618 1.00 0.00 C ATOM 1554 C LEU B 373 8.710 -3.678 5.260 1.00 0.00 C ATOM 1555 O LEU B 373 8.321 -2.515 5.154 1.00 0.00 O ATOM 1556 CB LEU B 373 7.799 -5.083 7.122 1.00 0.00 C ATOM 1557 CG LEU B 373 6.559 -5.750 7.722 1.00 0.00 C ATOM 1558 CD1 LEU B 373 6.766 -6.023 9.206 1.00 0.00 C ATOM 1559 CD2 LEU B 373 5.326 -4.880 7.507 1.00 0.00 C ATOM 0 H LEU B 373 8.322 -6.796 5.390 1.00 0.00 H new ATOM 0 HA LEU B 373 6.721 -4.456 5.369 1.00 0.00 H new ATOM 0 HB2 LEU B 373 8.661 -5.722 7.310 1.00 0.00 H new ATOM 0 HB3 LEU B 373 7.977 -4.145 7.648 1.00 0.00 H new ATOM 0 HG LEU B 373 6.401 -6.702 7.214 1.00 0.00 H new ATOM 0 HD11 LEU B 373 5.875 -6.497 9.616 1.00 0.00 H new ATOM 0 HD12 LEU B 373 7.622 -6.684 9.338 1.00 0.00 H new ATOM 0 HD13 LEU B 373 6.949 -5.083 9.727 1.00 0.00 H new ATOM 0 HD21 LEU B 373 4.454 -5.371 7.940 1.00 0.00 H new ATOM 0 HD22 LEU B 373 5.475 -3.913 7.988 1.00 0.00 H new ATOM 0 HD23 LEU B 373 5.166 -4.733 6.439 1.00 0.00 H new ATOM 1571 N SER B 374 9.982 -4.040 5.075 1.00 0.00 N ATOM 1572 CA SER B 374 11.016 -3.066 4.727 1.00 0.00 C ATOM 1573 C SER B 374 10.636 -2.306 3.458 1.00 0.00 C ATOM 1574 O SER B 374 10.697 -1.076 3.420 1.00 0.00 O ATOM 1575 CB SER B 374 12.366 -3.764 4.536 1.00 0.00 C ATOM 1576 OG SER B 374 13.388 -2.830 4.228 1.00 0.00 O ATOM 0 H SER B 374 10.319 -4.999 5.160 1.00 0.00 H new ATOM 0 HA SER B 374 11.101 -2.353 5.547 1.00 0.00 H new ATOM 0 HB2 SER B 374 12.629 -4.308 5.443 1.00 0.00 H new ATOM 0 HB3 SER B 374 12.288 -4.499 3.735 1.00 0.00 H new ATOM 0 HG SER B 374 14.239 -3.302 4.113 1.00 0.00 H new ATOM 1582 N GLU B 375 10.230 -3.048 2.426 1.00 0.00 N ATOM 1583 CA GLU B 375 9.824 -2.452 1.156 1.00 0.00 C ATOM 1584 C GLU B 375 8.569 -1.591 1.338 1.00 0.00 C ATOM 1585 O GLU B 375 8.427 -0.543 0.705 1.00 0.00 O ATOM 1586 CB GLU B 375 9.562 -3.555 0.123 1.00 0.00 C ATOM 1587 CG GLU B 375 9.480 -3.058 -1.316 1.00 0.00 C ATOM 1588 CD GLU B 375 10.823 -2.627 -1.889 1.00 0.00 C ATOM 1589 OE1 GLU B 375 11.846 -2.712 -1.174 1.00 0.00 O ATOM 1590 OE2 GLU B 375 10.852 -2.210 -3.066 1.00 0.00 O ATOM 0 H GLU B 375 10.174 -4.066 2.447 1.00 0.00 H new ATOM 0 HA GLU B 375 10.630 -1.811 0.799 1.00 0.00 H new ATOM 0 HB2 GLU B 375 10.355 -4.299 0.194 1.00 0.00 H new ATOM 0 HB3 GLU B 375 8.629 -4.059 0.375 1.00 0.00 H new ATOM 0 HG2 GLU B 375 9.064 -3.848 -1.941 1.00 0.00 H new ATOM 0 HG3 GLU B 375 8.788 -2.217 -1.362 1.00 0.00 H new ATOM 1597 N PHE B 376 7.659 -2.055 2.204 1.00 0.00 N ATOM 1598 CA PHE B 376 6.403 -1.354 2.484 1.00 0.00 C ATOM 1599 C PHE B 376 6.621 0.103 2.903 1.00 0.00 C ATOM 1600 O PHE B 376 6.152 1.025 2.234 1.00 0.00 O ATOM 1601 CB PHE B 376 5.630 -2.069 3.596 1.00 0.00 C ATOM 1602 CG PHE B 376 4.280 -1.468 3.864 1.00 0.00 C ATOM 1603 CD1 PHE B 376 3.567 -0.852 2.846 1.00 0.00 C ATOM 1604 CD2 PHE B 376 3.724 -1.523 5.130 1.00 0.00 C ATOM 1605 CE1 PHE B 376 2.327 -0.301 3.087 1.00 0.00 C ATOM 1606 CE2 PHE B 376 2.482 -0.972 5.375 1.00 0.00 C ATOM 1607 CZ PHE B 376 1.785 -0.361 4.353 1.00 0.00 C ATOM 0 H PHE B 376 7.773 -2.923 2.727 1.00 0.00 H new ATOM 0 HA PHE B 376 5.834 -1.361 1.554 1.00 0.00 H new ATOM 0 HB2 PHE B 376 5.506 -3.118 3.326 1.00 0.00 H new ATOM 0 HB3 PHE B 376 6.219 -2.044 4.513 1.00 0.00 H new ATOM 0 HD1 PHE B 376 3.989 -0.804 1.853 1.00 0.00 H new ATOM 0 HD2 PHE B 376 4.266 -2.001 5.933 1.00 0.00 H new ATOM 0 HE1 PHE B 376 1.782 0.176 2.286 1.00 0.00 H new ATOM 0 HE2 PHE B 376 2.056 -1.019 6.366 1.00 0.00 H new ATOM 0 HZ PHE B 376 0.814 0.071 4.545 1.00 0.00 H new ATOM 1617 N GLY B 377 7.302 0.292 4.039 1.00 0.00 N ATOM 1618 CA GLY B 377 7.548 1.628 4.574 1.00 0.00 C ATOM 1619 C GLY B 377 8.280 2.578 3.631 1.00 0.00 C ATOM 1620 O GLY B 377 8.419 3.759 3.944 1.00 0.00 O ATOM 0 H GLY B 377 7.690 -0.465 4.602 1.00 0.00 H new ATOM 0 HA2 GLY B 377 6.592 2.076 4.845 1.00 0.00 H new ATOM 0 HA3 GLY B 377 8.128 1.534 5.492 1.00 0.00 H new ATOM 1624 N GLN B 378 8.753 2.085 2.486 1.00 0.00 N ATOM 1625 CA GLN B 378 9.463 2.936 1.531 1.00 0.00 C ATOM 1626 C GLN B 378 8.519 3.927 0.830 1.00 0.00 C ATOM 1627 O GLN B 378 8.982 4.883 0.204 1.00 0.00 O ATOM 1628 CB GLN B 378 10.197 2.079 0.495 1.00 0.00 C ATOM 1629 CG GLN B 378 11.240 1.152 1.112 1.00 0.00 C ATOM 1630 CD GLN B 378 11.996 0.300 0.100 1.00 0.00 C ATOM 1631 OE1 GLN B 378 11.717 0.476 -1.193 1.00 0.00 O flip ATOM 1632 NE2 GLN B 378 12.835 -0.515 0.480 1.00 0.00 N flip ATOM 0 H GLN B 378 8.659 1.111 2.199 1.00 0.00 H new ATOM 0 HA GLN B 378 10.191 3.519 2.094 1.00 0.00 H new ATOM 0 HB2 GLN B 378 9.469 1.482 -0.054 1.00 0.00 H new ATOM 0 HB3 GLN B 378 10.684 2.733 -0.228 1.00 0.00 H new ATOM 0 HG2 GLN B 378 11.957 1.752 1.672 1.00 0.00 H new ATOM 0 HG3 GLN B 378 10.747 0.494 1.828 1.00 0.00 H new ATOM 0 HE21 GLN B 378 13.025 -0.625 1.476 1.00 0.00 H new ATOM 0 HE22 GLN B 378 13.341 -1.081 -0.201 1.00 0.00 H new ATOM 1641 N PHE B 379 7.201 3.707 0.940 1.00 0.00 N ATOM 1642 CA PHE B 379 6.216 4.591 0.317 1.00 0.00 C ATOM 1643 C PHE B 379 5.665 5.573 1.342 1.00 0.00 C ATOM 1644 O PHE B 379 5.665 6.785 1.123 1.00 0.00 O ATOM 1645 CB PHE B 379 5.076 3.768 -0.285 1.00 0.00 C ATOM 1646 CG PHE B 379 5.558 2.627 -1.129 1.00 0.00 C ATOM 1647 CD1 PHE B 379 6.255 2.860 -2.303 1.00 0.00 C ATOM 1648 CD2 PHE B 379 5.334 1.322 -0.734 1.00 0.00 C ATOM 1649 CE1 PHE B 379 6.717 1.807 -3.068 1.00 0.00 C ATOM 1650 CE2 PHE B 379 5.790 0.267 -1.494 1.00 0.00 C ATOM 1651 CZ PHE B 379 6.483 0.508 -2.663 1.00 0.00 C ATOM 0 H PHE B 379 6.797 2.925 1.455 1.00 0.00 H new ATOM 0 HA PHE B 379 6.705 5.152 -0.479 1.00 0.00 H new ATOM 0 HB2 PHE B 379 4.452 3.379 0.520 1.00 0.00 H new ATOM 0 HB3 PHE B 379 4.446 4.419 -0.890 1.00 0.00 H new ATOM 0 HD1 PHE B 379 6.439 3.875 -2.623 1.00 0.00 H new ATOM 0 HD2 PHE B 379 4.795 1.127 0.181 1.00 0.00 H new ATOM 0 HE1 PHE B 379 7.260 1.999 -3.981 1.00 0.00 H new ATOM 0 HE2 PHE B 379 5.605 -0.748 -1.175 1.00 0.00 H new ATOM 0 HZ PHE B 379 6.841 -0.318 -3.260 1.00 0.00 H new ATOM 1661 N LEU B 380 5.206 5.029 2.469 1.00 0.00 N ATOM 1662 CA LEU B 380 4.659 5.839 3.548 1.00 0.00 C ATOM 1663 C LEU B 380 5.759 6.191 4.556 1.00 0.00 C ATOM 1664 O LEU B 380 6.718 5.439 4.716 1.00 0.00 O ATOM 1665 CB LEU B 380 3.443 5.143 4.211 1.00 0.00 C ATOM 1666 CG LEU B 380 3.648 3.760 4.864 1.00 0.00 C ATOM 1667 CD1 LEU B 380 3.849 2.673 3.815 1.00 0.00 C ATOM 1668 CD2 LEU B 380 4.788 3.776 5.872 1.00 0.00 C ATOM 0 H LEU B 380 5.204 4.026 2.655 1.00 0.00 H new ATOM 0 HA LEU B 380 4.286 6.775 3.133 1.00 0.00 H new ATOM 0 HB2 LEU B 380 3.053 5.815 4.975 1.00 0.00 H new ATOM 0 HB3 LEU B 380 2.667 5.039 3.452 1.00 0.00 H new ATOM 0 HG LEU B 380 2.736 3.524 5.412 1.00 0.00 H new ATOM 0 HD11 LEU B 380 3.990 1.712 4.309 1.00 0.00 H new ATOM 0 HD12 LEU B 380 2.972 2.623 3.170 1.00 0.00 H new ATOM 0 HD13 LEU B 380 4.729 2.905 3.215 1.00 0.00 H new ATOM 0 HD21 LEU B 380 4.901 2.784 6.310 1.00 0.00 H new ATOM 0 HD22 LEU B 380 5.713 4.058 5.370 1.00 0.00 H new ATOM 0 HD23 LEU B 380 4.568 4.497 6.659 1.00 0.00 H new ATOM 1680 N PRO B 381 5.659 7.365 5.215 1.00 0.00 N ATOM 1681 CA PRO B 381 6.670 7.840 6.178 1.00 0.00 C ATOM 1682 C PRO B 381 6.941 6.873 7.340 1.00 0.00 C ATOM 1683 O PRO B 381 6.744 5.663 7.228 1.00 0.00 O ATOM 1684 CB PRO B 381 6.071 9.153 6.696 1.00 0.00 C ATOM 1685 CG PRO B 381 5.165 9.604 5.610 1.00 0.00 C ATOM 1686 CD PRO B 381 4.580 8.349 5.037 1.00 0.00 C ATOM 0 HA PRO B 381 7.644 7.943 5.700 1.00 0.00 H new ATOM 0 HB2 PRO B 381 5.527 9.000 7.628 1.00 0.00 H new ATOM 0 HB3 PRO B 381 6.847 9.891 6.897 1.00 0.00 H new ATOM 0 HG2 PRO B 381 4.385 10.261 5.995 1.00 0.00 H new ATOM 0 HG3 PRO B 381 5.710 10.166 4.851 1.00 0.00 H new ATOM 0 HD2 PRO B 381 3.672 8.051 5.562 1.00 0.00 H new ATOM 0 HD3 PRO B 381 4.315 8.471 3.987 1.00 0.00 H new ATOM 1694 N ASP B 382 7.416 7.429 8.452 1.00 0.00 N ATOM 1695 CA ASP B 382 7.745 6.644 9.639 1.00 0.00 C ATOM 1696 C ASP B 382 6.530 6.461 10.541 1.00 0.00 C ATOM 1697 O ASP B 382 6.278 7.264 11.442 1.00 0.00 O ATOM 1698 CB ASP B 382 8.891 7.301 10.421 1.00 0.00 C ATOM 1699 CG ASP B 382 10.199 7.311 9.648 1.00 0.00 C ATOM 1700 OD1 ASP B 382 10.259 7.959 8.580 1.00 0.00 O ATOM 1701 OD2 ASP B 382 11.166 6.669 10.110 1.00 0.00 O ATOM 0 H ASP B 382 7.583 8.430 8.556 1.00 0.00 H new ATOM 0 HA ASP B 382 8.067 5.658 9.303 1.00 0.00 H new ATOM 0 HB2 ASP B 382 8.614 8.325 10.671 1.00 0.00 H new ATOM 0 HB3 ASP B 382 9.034 6.770 11.362 1.00 0.00 H new ATOM 1706 N ALA B 383 5.785 5.392 10.285 1.00 0.00 N ATOM 1707 CA ALA B 383 4.591 5.075 11.062 1.00 0.00 C ATOM 1708 C ALA B 383 4.957 4.475 12.420 1.00 0.00 C ATOM 1709 O ALA B 383 4.567 5.064 13.449 1.00 0.00 O ATOM 1710 CB ALA B 383 3.700 4.121 10.285 1.00 0.00 C ATOM 1711 OXT ALA B 383 5.629 3.421 12.441 1.00 0.00 O ATOM 0 H ALA B 383 5.988 4.725 9.540 1.00 0.00 H new ATOM 0 HA ALA B 383 4.047 6.002 11.242 1.00 0.00 H new ATOM 0 HB1 ALA B 383 2.812 3.891 10.874 1.00 0.00 H new ATOM 0 HB2 ALA B 383 3.402 4.586 9.345 1.00 0.00 H new ATOM 0 HB3 ALA B 383 4.246 3.201 10.078 1.00 0.00 H new TER 1717 ALA B 383