USER MOD reduce.3.24.130724 H: found=0, std=0, add=856, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 858 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 728 HIS :FLIP no HE2:sc= -0.136 F(o=-0.44,f=0.36) USER MOD Set 1.2: A 739 THR OG1 : rot 100:sc= -0.127 USER MOD Set 1.3: A 740 GLN :FLIP amide:sc= 0.619 F(o=-1.4,f=0.36) USER MOD Set 2.1: A 714 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 732 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 640 ASN :FLIP amide:sc= -1.84! C(o=-2.6!,f=-1.8!) USER MOD Set 3.2: A 658 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 651 HIS : no HD1:sc=-0.00598 K(o=-0.006,f=-0.81) USER MOD Set 4.2: A 652 SER OG : rot 180:sc= 0 USER MOD Single : A 629 SER OG : rot 31:sc= 0.0537 USER MOD Single : A 638 ASN :FLIP amide:sc= -0.747 F(o=-2.1!,f=-0.75) USER MOD Single : A 642 LYS NZ :NH3+ -156:sc= 1.16 (180deg=0.978) USER MOD Single : A 644 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 645 THR OG1 : rot 39:sc= 0.0797 USER MOD Single : A 646 LYS NZ :NH3+ 146:sc= 1.23 (180deg=1.02) USER MOD Single : A 649 TYR OH : rot -113:sc= -1.19! USER MOD Single : A 657 TYR OH : rot 13:sc= 0.235 USER MOD Single : A 660 ASN : amide:sc= -3.41! C(o=-3.4!,f=-4.8!) USER MOD Single : A 665 MET CE :methyl 163:sc= -2.56! (180deg=-3.6) USER MOD Single : A 666 LYS NZ :NH3+ 169:sc= -0.0113 (180deg=-0.132) USER MOD Single : A 669 ASN : amide:sc= -0.0393 K(o=-0.039,f=-2.1!) USER MOD Single : A 670 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 672 GLN : amide:sc= -1.78! C(o=-1.8!,f=-1.5!) USER MOD Single : A 679 THR OG1 : rot 180:sc= 0.946 USER MOD Single : A 680 THR OG1 : rot 180:sc= 0 USER MOD Single : A 690 THR OG1 : rot -21:sc= 0.0926 USER MOD Single : A 699 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 703 GLN :FLIP amide:sc= -3.85! C(o=-4.7!,f=-3.8!) USER MOD Single : A 705 SER OG : rot 38:sc= 0.0159 USER MOD Single : A 706 SER OG : rot 138:sc= 1.29 USER MOD Single : A 709 TYR OH : rot 74:sc= -0.582 USER MOD Single : A 710 TYR OH : rot 180:sc= 0 USER MOD Single : A 711 TYR OH : rot 180:sc= 0 USER MOD Single : A 718 ASN : amide:sc= 0.127 K(o=0.13,f=-2) USER MOD Single : A 720 SER OG : rot 180:sc= 0 USER MOD Single : A 722 SER OG : rot 180:sc= 0 USER MOD Single : A 724 THR OG1 : rot 180:sc= 0 USER MOD Single : A 725 MET CE :methyl 172:sc= -1.46 (180deg=-1.62) USER MOD Single : A 730 SER OG : rot 180:sc= 0.00938 USER MOD Single : A 735 HIS :FLIP no HD1:sc= -0.139 F(o=-0.73,f=-0.14) USER MOD Single : A 743 GLN : amide:sc= 0 X(o=0,f=-0.19) USER MOD ----------------------------------------------------------------- ATOM 103 N SER A 629 28.387 -7.861 -0.692 1.00 0.00 N ATOM 104 CA SER A 629 27.304 -8.477 0.055 1.00 0.00 C ATOM 105 C SER A 629 27.010 -7.736 1.351 1.00 0.00 C ATOM 106 O SER A 629 27.901 -7.466 2.162 1.00 0.00 O ATOM 107 CB SER A 629 27.522 -9.963 0.277 1.00 0.00 C ATOM 108 OG SER A 629 27.668 -10.651 -0.970 1.00 0.00 O ATOM 0 HA SER A 629 26.412 -8.390 -0.565 1.00 0.00 H new ATOM 0 HB2 SER A 629 28.412 -10.117 0.888 1.00 0.00 H new ATOM 0 HB3 SER A 629 26.680 -10.379 0.830 1.00 0.00 H new ATOM 0 HG SER A 629 28.085 -10.054 -1.626 1.00 0.00 H new ATOM 114 N CYS A 630 25.771 -7.393 1.512 1.00 0.00 N ATOM 115 CA CYS A 630 25.300 -6.628 2.632 1.00 0.00 C ATOM 116 C CYS A 630 24.318 -7.460 3.461 1.00 0.00 C ATOM 117 O CYS A 630 24.158 -8.679 3.216 1.00 0.00 O ATOM 118 CB CYS A 630 24.602 -5.407 2.067 1.00 0.00 C ATOM 119 SG CYS A 630 23.332 -5.848 0.836 1.00 0.00 S ATOM 0 H CYS A 630 25.035 -7.643 0.851 1.00 0.00 H new ATOM 0 HA CYS A 630 26.125 -6.340 3.284 1.00 0.00 H new ATOM 0 HB2 CYS A 630 24.139 -4.847 2.879 1.00 0.00 H new ATOM 0 HB3 CYS A 630 25.339 -4.750 1.606 1.00 0.00 H new ATOM 124 N GLY A 631 23.684 -6.828 4.428 1.00 0.00 N ATOM 125 CA GLY A 631 22.706 -7.453 5.208 1.00 0.00 C ATOM 126 C GLY A 631 21.377 -6.767 5.023 1.00 0.00 C ATOM 127 O GLY A 631 21.021 -6.416 3.898 1.00 0.00 O ATOM 0 H GLY A 631 23.856 -5.854 4.675 1.00 0.00 H new ATOM 0 HA2 GLY A 631 22.624 -8.503 4.928 1.00 0.00 H new ATOM 0 HA3 GLY A 631 22.995 -7.425 6.259 1.00 0.00 H new ATOM 131 N PRO A 632 20.638 -6.540 6.104 1.00 0.00 N ATOM 132 CA PRO A 632 19.290 -5.955 6.062 1.00 0.00 C ATOM 133 C PRO A 632 19.229 -4.575 5.398 1.00 0.00 C ATOM 134 O PRO A 632 20.171 -3.779 5.485 1.00 0.00 O ATOM 135 CB PRO A 632 18.904 -5.843 7.533 1.00 0.00 C ATOM 136 CG PRO A 632 19.781 -6.810 8.220 1.00 0.00 C ATOM 137 CD PRO A 632 21.063 -6.802 7.475 1.00 0.00 C ATOM 0 HA PRO A 632 18.621 -6.572 5.462 1.00 0.00 H new ATOM 0 HB2 PRO A 632 19.058 -4.831 7.908 1.00 0.00 H new ATOM 0 HB3 PRO A 632 17.852 -6.083 7.687 1.00 0.00 H new ATOM 0 HG2 PRO A 632 19.933 -6.527 9.261 1.00 0.00 H new ATOM 0 HG3 PRO A 632 19.337 -7.806 8.222 1.00 0.00 H new ATOM 0 HD2 PRO A 632 21.740 -6.031 7.843 1.00 0.00 H new ATOM 0 HD3 PRO A 632 21.587 -7.754 7.561 1.00 0.00 H new ATOM 145 N PRO A 633 18.108 -4.283 4.735 1.00 0.00 N ATOM 146 CA PRO A 633 17.889 -3.006 4.060 1.00 0.00 C ATOM 147 C PRO A 633 17.840 -1.828 5.031 1.00 0.00 C ATOM 148 O PRO A 633 17.607 -2.005 6.245 1.00 0.00 O ATOM 149 CB PRO A 633 16.507 -3.174 3.421 1.00 0.00 C ATOM 150 CG PRO A 633 15.856 -4.254 4.200 1.00 0.00 C ATOM 151 CD PRO A 633 16.953 -5.181 4.587 1.00 0.00 C ATOM 0 HA PRO A 633 18.696 -2.787 3.360 1.00 0.00 H new ATOM 0 HB2 PRO A 633 15.933 -2.249 3.472 1.00 0.00 H new ATOM 0 HB3 PRO A 633 16.589 -3.441 2.367 1.00 0.00 H new ATOM 0 HG2 PRO A 633 15.351 -3.854 5.080 1.00 0.00 H new ATOM 0 HG3 PRO A 633 15.101 -4.767 3.605 1.00 0.00 H new ATOM 0 HD2 PRO A 633 16.729 -5.706 5.515 1.00 0.00 H new ATOM 0 HD3 PRO A 633 17.127 -5.941 3.825 1.00 0.00 H new ATOM 159 N PRO A 634 18.111 -0.628 4.521 1.00 0.00 N ATOM 160 CA PRO A 634 17.935 0.623 5.264 1.00 0.00 C ATOM 161 C PRO A 634 16.436 0.903 5.556 1.00 0.00 C ATOM 162 O PRO A 634 15.585 0.004 5.470 1.00 0.00 O ATOM 163 CB PRO A 634 18.507 1.690 4.316 1.00 0.00 C ATOM 164 CG PRO A 634 18.564 1.051 2.973 1.00 0.00 C ATOM 165 CD PRO A 634 18.674 -0.412 3.186 1.00 0.00 C ATOM 0 HA PRO A 634 18.427 0.601 6.236 1.00 0.00 H new ATOM 0 HB2 PRO A 634 17.875 2.578 4.300 1.00 0.00 H new ATOM 0 HB3 PRO A 634 19.498 2.010 4.639 1.00 0.00 H new ATOM 0 HG2 PRO A 634 17.671 1.289 2.396 1.00 0.00 H new ATOM 0 HG3 PRO A 634 19.418 1.422 2.407 1.00 0.00 H new ATOM 0 HD2 PRO A 634 18.122 -0.967 2.427 1.00 0.00 H new ATOM 0 HD3 PRO A 634 19.711 -0.745 3.133 1.00 0.00 H new ATOM 173 N GLU A 635 16.115 2.112 5.917 1.00 0.00 N ATOM 174 CA GLU A 635 14.738 2.432 6.210 1.00 0.00 C ATOM 175 C GLU A 635 14.202 3.425 5.207 1.00 0.00 C ATOM 176 O GLU A 635 14.979 4.138 4.562 1.00 0.00 O ATOM 177 CB GLU A 635 14.610 2.998 7.607 1.00 0.00 C ATOM 178 CG GLU A 635 15.195 4.372 7.779 1.00 0.00 C ATOM 179 CD GLU A 635 15.126 4.825 9.198 1.00 0.00 C ATOM 180 OE1 GLU A 635 16.016 4.472 9.992 1.00 0.00 O ATOM 181 OE2 GLU A 635 14.168 5.527 9.554 1.00 0.00 O ATOM 0 H GLU A 635 16.773 2.885 6.016 1.00 0.00 H new ATOM 0 HA GLU A 635 14.155 1.513 6.146 1.00 0.00 H new ATOM 0 HB2 GLU A 635 13.554 3.030 7.877 1.00 0.00 H new ATOM 0 HB3 GLU A 635 15.098 2.319 8.307 1.00 0.00 H new ATOM 0 HG2 GLU A 635 16.233 4.370 7.447 1.00 0.00 H new ATOM 0 HG3 GLU A 635 14.659 5.078 7.145 1.00 0.00 H new ATOM 188 N LEU A 636 12.897 3.498 5.073 1.00 0.00 N ATOM 189 CA LEU A 636 12.323 4.461 4.178 1.00 0.00 C ATOM 190 C LEU A 636 12.000 5.698 5.021 1.00 0.00 C ATOM 191 O LEU A 636 11.544 5.563 6.162 1.00 0.00 O ATOM 192 CB LEU A 636 11.029 3.895 3.507 1.00 0.00 C ATOM 193 CG LEU A 636 10.567 4.486 2.138 1.00 0.00 C ATOM 194 CD1 LEU A 636 9.221 3.996 1.733 1.00 0.00 C ATOM 195 CD2 LEU A 636 10.634 5.982 2.059 1.00 0.00 C ATOM 0 H LEU A 636 12.226 2.909 5.567 1.00 0.00 H new ATOM 0 HA LEU A 636 13.014 4.705 3.371 1.00 0.00 H new ATOM 0 HB2 LEU A 636 11.170 2.823 3.372 1.00 0.00 H new ATOM 0 HB3 LEU A 636 10.209 4.022 4.214 1.00 0.00 H new ATOM 0 HG LEU A 636 11.298 4.110 1.422 1.00 0.00 H new ATOM 0 HD11 LEU A 636 8.947 4.437 0.775 1.00 0.00 H new ATOM 0 HD12 LEU A 636 9.242 2.910 1.640 1.00 0.00 H new ATOM 0 HD13 LEU A 636 8.488 4.282 2.487 1.00 0.00 H new ATOM 0 HD21 LEU A 636 10.296 6.310 1.076 1.00 0.00 H new ATOM 0 HD22 LEU A 636 9.993 6.416 2.826 1.00 0.00 H new ATOM 0 HD23 LEU A 636 11.662 6.309 2.217 1.00 0.00 H new ATOM 207 N LEU A 637 12.331 6.867 4.469 1.00 0.00 N ATOM 208 CA LEU A 637 12.028 8.204 5.001 1.00 0.00 C ATOM 209 C LEU A 637 10.706 8.208 5.762 1.00 0.00 C ATOM 210 O LEU A 637 10.675 8.409 6.968 1.00 0.00 O ATOM 211 CB LEU A 637 11.945 9.187 3.787 1.00 0.00 C ATOM 212 CG LEU A 637 11.871 10.725 4.031 1.00 0.00 C ATOM 213 CD1 LEU A 637 10.620 11.187 4.772 1.00 0.00 C ATOM 214 CD2 LEU A 637 13.127 11.229 4.699 1.00 0.00 C ATOM 0 H LEU A 637 12.846 6.912 3.590 1.00 0.00 H new ATOM 0 HA LEU A 637 12.808 8.508 5.699 1.00 0.00 H new ATOM 0 HB2 LEU A 637 12.816 9.000 3.159 1.00 0.00 H new ATOM 0 HB3 LEU A 637 11.067 8.909 3.205 1.00 0.00 H new ATOM 0 HG LEU A 637 11.794 11.174 3.041 1.00 0.00 H new ATOM 0 HD11 LEU A 637 10.651 12.269 4.899 1.00 0.00 H new ATOM 0 HD12 LEU A 637 9.735 10.914 4.197 1.00 0.00 H new ATOM 0 HD13 LEU A 637 10.579 10.708 5.750 1.00 0.00 H new ATOM 0 HD21 LEU A 637 13.048 12.305 4.857 1.00 0.00 H new ATOM 0 HD22 LEU A 637 13.254 10.729 5.659 1.00 0.00 H new ATOM 0 HD23 LEU A 637 13.987 11.018 4.063 1.00 0.00 H new ATOM 226 N ASN A 638 9.622 7.978 5.060 1.00 0.00 N ATOM 227 CA ASN A 638 8.338 8.031 5.713 1.00 0.00 C ATOM 228 C ASN A 638 7.730 6.639 5.804 1.00 0.00 C ATOM 229 O ASN A 638 6.999 6.322 6.729 1.00 0.00 O ATOM 230 CB ASN A 638 7.374 8.968 4.976 1.00 0.00 C ATOM 231 CG ASN A 638 6.135 9.289 5.795 1.00 0.00 C ATOM 232 OD1 ASN A 638 5.129 8.450 5.731 1.00 0.00 O flip ATOM 233 ND2 ASN A 638 6.103 10.287 6.495 1.00 0.00 N flip ATOM 0 H ASN A 638 9.601 7.758 4.064 1.00 0.00 H new ATOM 0 HA ASN A 638 8.496 8.422 6.718 1.00 0.00 H new ATOM 0 HB2 ASN A 638 7.892 9.895 4.728 1.00 0.00 H new ATOM 0 HB3 ASN A 638 7.074 8.508 4.034 1.00 0.00 H new ATOM 0 HD21 ASN A 638 6.904 10.918 6.521 1.00 0.00 H new ATOM 0 HD22 ASN A 638 5.275 10.491 7.055 1.00 0.00 H new ATOM 240 N GLY A 639 8.008 5.837 4.799 1.00 0.00 N ATOM 241 CA GLY A 639 7.493 4.489 4.731 1.00 0.00 C ATOM 242 C GLY A 639 8.306 3.489 5.516 1.00 0.00 C ATOM 243 O GLY A 639 8.922 3.830 6.528 1.00 0.00 O ATOM 0 H GLY A 639 8.596 6.101 4.009 1.00 0.00 H new ATOM 0 HA2 GLY A 639 6.468 4.482 5.102 1.00 0.00 H new ATOM 0 HA3 GLY A 639 7.457 4.176 3.688 1.00 0.00 H new ATOM 247 N ASN A 640 8.354 2.276 5.017 1.00 0.00 N ATOM 248 CA ASN A 640 9.064 1.194 5.678 1.00 0.00 C ATOM 249 C ASN A 640 9.303 0.087 4.654 1.00 0.00 C ATOM 250 O ASN A 640 8.976 0.244 3.464 1.00 0.00 O ATOM 251 CB ASN A 640 8.210 0.622 6.803 1.00 0.00 C ATOM 252 CG ASN A 640 8.954 -0.221 7.849 1.00 0.00 C ATOM 253 OD1 ASN A 640 10.181 0.107 8.141 1.00 0.00 O flip ATOM 254 ND2 ASN A 640 8.401 -1.177 8.381 1.00 0.00 N flip ATOM 0 H ASN A 640 7.904 2.006 4.142 1.00 0.00 H new ATOM 0 HA ASN A 640 10.003 1.568 6.086 1.00 0.00 H new ATOM 0 HB2 ASN A 640 7.717 1.449 7.315 1.00 0.00 H new ATOM 0 HB3 ASN A 640 7.426 0.008 6.361 1.00 0.00 H new ATOM 0 HD21 ASN A 640 7.440 -1.412 8.134 1.00 0.00 H new ATOM 0 HD22 ASN A 640 8.902 -1.737 9.070 1.00 0.00 H new ATOM 261 N VAL A 641 9.804 -1.024 5.122 1.00 0.00 N ATOM 262 CA VAL A 641 10.172 -2.158 4.317 1.00 0.00 C ATOM 263 C VAL A 641 9.134 -3.249 4.488 1.00 0.00 C ATOM 264 O VAL A 641 8.634 -3.458 5.589 1.00 0.00 O ATOM 265 CB VAL A 641 11.518 -2.689 4.821 1.00 0.00 C ATOM 266 CG1 VAL A 641 12.094 -3.752 3.922 1.00 0.00 C ATOM 267 CG2 VAL A 641 12.458 -1.554 5.008 1.00 0.00 C ATOM 0 H VAL A 641 9.974 -1.170 6.117 1.00 0.00 H new ATOM 0 HA VAL A 641 10.237 -1.867 3.269 1.00 0.00 H new ATOM 0 HB VAL A 641 11.354 -3.176 5.782 1.00 0.00 H new ATOM 0 HG11 VAL A 641 13.047 -4.093 4.326 1.00 0.00 H new ATOM 0 HG12 VAL A 641 11.403 -4.593 3.864 1.00 0.00 H new ATOM 0 HG13 VAL A 641 12.249 -3.340 2.925 1.00 0.00 H new ATOM 0 HG21 VAL A 641 13.416 -1.930 5.367 1.00 0.00 H new ATOM 0 HG22 VAL A 641 12.603 -1.041 4.057 1.00 0.00 H new ATOM 0 HG23 VAL A 641 12.046 -0.857 5.738 1.00 0.00 H new ATOM 277 N LYS A 642 8.794 -3.921 3.416 1.00 0.00 N ATOM 278 CA LYS A 642 7.823 -5.005 3.487 1.00 0.00 C ATOM 279 C LYS A 642 8.540 -6.341 3.329 1.00 0.00 C ATOM 280 O LYS A 642 7.974 -7.408 3.557 1.00 0.00 O ATOM 281 CB LYS A 642 6.789 -4.830 2.386 1.00 0.00 C ATOM 282 CG LYS A 642 7.335 -5.072 0.997 1.00 0.00 C ATOM 283 CD LYS A 642 6.418 -4.544 -0.057 1.00 0.00 C ATOM 284 CE LYS A 642 6.482 -3.041 -0.124 1.00 0.00 C ATOM 285 NZ LYS A 642 5.619 -2.523 -1.210 1.00 0.00 N ATOM 0 H LYS A 642 9.169 -3.744 2.484 1.00 0.00 H new ATOM 0 HA LYS A 642 7.319 -4.986 4.453 1.00 0.00 H new ATOM 0 HB2 LYS A 642 5.960 -5.515 2.566 1.00 0.00 H new ATOM 0 HB3 LYS A 642 6.384 -3.819 2.437 1.00 0.00 H new ATOM 0 HG2 LYS A 642 8.311 -4.596 0.902 1.00 0.00 H new ATOM 0 HG3 LYS A 642 7.485 -6.141 0.846 1.00 0.00 H new ATOM 0 HD2 LYS A 642 6.689 -4.967 -1.025 1.00 0.00 H new ATOM 0 HD3 LYS A 642 5.396 -4.859 0.154 1.00 0.00 H new ATOM 0 HE2 LYS A 642 6.167 -2.617 0.830 1.00 0.00 H new ATOM 0 HE3 LYS A 642 7.512 -2.724 -0.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 642 5.963 -1.589 -1.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 642 5.646 -3.178 -2.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 642 4.641 -2.438 -0.866 1.00 0.00 H new ATOM 299 N GLU A 643 9.790 -6.251 2.929 1.00 0.00 N ATOM 300 CA GLU A 643 10.636 -7.402 2.703 1.00 0.00 C ATOM 301 C GLU A 643 11.130 -7.913 4.030 1.00 0.00 C ATOM 302 O GLU A 643 11.230 -7.144 4.998 1.00 0.00 O ATOM 303 CB GLU A 643 11.827 -6.989 1.852 1.00 0.00 C ATOM 304 CG GLU A 643 11.449 -6.385 0.520 1.00 0.00 C ATOM 305 CD GLU A 643 10.788 -7.360 -0.406 1.00 0.00 C ATOM 306 OE1 GLU A 643 11.501 -8.154 -1.049 1.00 0.00 O ATOM 307 OE2 GLU A 643 9.562 -7.331 -0.535 1.00 0.00 O ATOM 0 H GLU A 643 10.254 -5.361 2.749 1.00 0.00 H new ATOM 0 HA GLU A 643 10.072 -8.182 2.191 1.00 0.00 H new ATOM 0 HB2 GLU A 643 12.427 -6.269 2.409 1.00 0.00 H new ATOM 0 HB3 GLU A 643 12.457 -7.862 1.678 1.00 0.00 H new ATOM 0 HG2 GLU A 643 10.779 -5.542 0.688 1.00 0.00 H new ATOM 0 HG3 GLU A 643 12.345 -5.989 0.041 1.00 0.00 H new ATOM 314 N LYS A 644 11.445 -9.173 4.089 1.00 0.00 N ATOM 315 CA LYS A 644 11.916 -9.760 5.307 1.00 0.00 C ATOM 316 C LYS A 644 13.415 -9.678 5.376 1.00 0.00 C ATOM 317 O LYS A 644 14.110 -9.763 4.349 1.00 0.00 O ATOM 318 CB LYS A 644 11.450 -11.207 5.456 1.00 0.00 C ATOM 319 CG LYS A 644 9.938 -11.377 5.473 1.00 0.00 C ATOM 320 CD LYS A 644 9.263 -10.590 6.599 1.00 0.00 C ATOM 321 CE LYS A 644 9.716 -11.053 7.977 1.00 0.00 C ATOM 322 NZ LYS A 644 9.079 -10.271 9.052 1.00 0.00 N ATOM 0 H LYS A 644 11.383 -9.818 3.301 1.00 0.00 H new ATOM 0 HA LYS A 644 11.490 -9.194 6.136 1.00 0.00 H new ATOM 0 HB2 LYS A 644 11.861 -11.796 4.636 1.00 0.00 H new ATOM 0 HB3 LYS A 644 11.861 -11.616 6.379 1.00 0.00 H new ATOM 0 HG2 LYS A 644 9.530 -11.053 4.515 1.00 0.00 H new ATOM 0 HG3 LYS A 644 9.697 -12.435 5.581 1.00 0.00 H new ATOM 0 HD2 LYS A 644 9.486 -9.529 6.483 1.00 0.00 H new ATOM 0 HD3 LYS A 644 8.181 -10.699 6.518 1.00 0.00 H new ATOM 0 HE2 LYS A 644 9.475 -12.109 8.103 1.00 0.00 H new ATOM 0 HE3 LYS A 644 10.799 -10.962 8.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 644 9.412 -10.615 9.975 1.00 0.00 H new ATOM 0 HZ2 LYS A 644 9.329 -9.267 8.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 644 8.046 -10.379 8.994 1.00 0.00 H new ATOM 336 N THR A 645 13.902 -9.486 6.560 1.00 0.00 N ATOM 337 CA THR A 645 15.310 -9.371 6.811 1.00 0.00 C ATOM 338 C THR A 645 15.975 -10.741 6.828 1.00 0.00 C ATOM 339 O THR A 645 15.618 -11.620 7.611 1.00 0.00 O ATOM 340 CB THR A 645 15.574 -8.615 8.119 1.00 0.00 C ATOM 341 OG1 THR A 645 14.752 -9.171 9.159 1.00 0.00 O ATOM 342 CG2 THR A 645 15.267 -7.132 7.957 1.00 0.00 C ATOM 0 H THR A 645 13.325 -9.403 7.397 1.00 0.00 H new ATOM 0 HA THR A 645 15.750 -8.796 5.997 1.00 0.00 H new ATOM 0 HB THR A 645 16.627 -8.720 8.381 1.00 0.00 H new ATOM 0 HG1 THR A 645 14.715 -10.145 9.061 1.00 0.00 H new ATOM 0 HG21 THR A 645 15.461 -6.615 8.897 1.00 0.00 H new ATOM 0 HG22 THR A 645 15.900 -6.713 7.175 1.00 0.00 H new ATOM 0 HG23 THR A 645 14.220 -7.005 7.683 1.00 0.00 H new ATOM 350 N LYS A 646 16.914 -10.923 5.939 1.00 0.00 N ATOM 351 CA LYS A 646 17.596 -12.203 5.793 1.00 0.00 C ATOM 352 C LYS A 646 18.972 -12.160 6.420 1.00 0.00 C ATOM 353 O LYS A 646 19.611 -13.196 6.589 1.00 0.00 O ATOM 354 CB LYS A 646 17.760 -12.552 4.312 1.00 0.00 C ATOM 355 CG LYS A 646 16.478 -12.480 3.510 1.00 0.00 C ATOM 356 CD LYS A 646 16.655 -12.998 2.080 1.00 0.00 C ATOM 357 CE LYS A 646 17.647 -12.177 1.265 1.00 0.00 C ATOM 358 NZ LYS A 646 17.816 -12.730 -0.096 1.00 0.00 N ATOM 0 H LYS A 646 17.234 -10.200 5.294 1.00 0.00 H new ATOM 0 HA LYS A 646 16.988 -12.955 6.295 1.00 0.00 H new ATOM 0 HB2 LYS A 646 18.490 -11.874 3.870 1.00 0.00 H new ATOM 0 HB3 LYS A 646 18.170 -13.559 4.231 1.00 0.00 H new ATOM 0 HG2 LYS A 646 15.705 -13.063 4.012 1.00 0.00 H new ATOM 0 HG3 LYS A 646 16.129 -11.448 3.479 1.00 0.00 H new ATOM 0 HD2 LYS A 646 16.992 -14.034 2.114 1.00 0.00 H new ATOM 0 HD3 LYS A 646 15.688 -12.994 1.576 1.00 0.00 H new ATOM 0 HE2 LYS A 646 17.301 -11.145 1.200 1.00 0.00 H new ATOM 0 HE3 LYS A 646 18.611 -12.158 1.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 646 17.978 -11.953 -0.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 646 18.631 -13.375 -0.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 646 16.958 -13.251 -0.368 1.00 0.00 H new ATOM 372 N GLU A 647 19.443 -10.933 6.727 1.00 0.00 N ATOM 373 CA GLU A 647 20.815 -10.643 7.259 1.00 0.00 C ATOM 374 C GLU A 647 21.919 -10.947 6.215 1.00 0.00 C ATOM 375 O GLU A 647 22.981 -10.326 6.224 1.00 0.00 O ATOM 376 CB GLU A 647 21.071 -11.418 8.554 1.00 0.00 C ATOM 377 CG GLU A 647 20.042 -11.182 9.652 1.00 0.00 C ATOM 378 CD GLU A 647 20.055 -9.788 10.215 1.00 0.00 C ATOM 379 OE1 GLU A 647 21.116 -9.349 10.724 1.00 0.00 O ATOM 380 OE2 GLU A 647 19.017 -9.110 10.159 1.00 0.00 O ATOM 0 H GLU A 647 18.878 -10.091 6.614 1.00 0.00 H new ATOM 0 HA GLU A 647 20.857 -9.576 7.476 1.00 0.00 H new ATOM 0 HB2 GLU A 647 21.099 -12.483 8.324 1.00 0.00 H new ATOM 0 HB3 GLU A 647 22.056 -11.148 8.934 1.00 0.00 H new ATOM 0 HG2 GLU A 647 19.049 -11.393 9.256 1.00 0.00 H new ATOM 0 HG3 GLU A 647 20.220 -11.891 10.461 1.00 0.00 H new ATOM 387 N GLU A 648 21.662 -11.886 5.347 1.00 0.00 N ATOM 388 CA GLU A 648 22.559 -12.239 4.303 1.00 0.00 C ATOM 389 C GLU A 648 21.926 -11.849 2.977 1.00 0.00 C ATOM 390 O GLU A 648 20.972 -12.477 2.523 1.00 0.00 O ATOM 391 CB GLU A 648 22.806 -13.741 4.300 1.00 0.00 C ATOM 392 CG GLU A 648 23.894 -14.176 3.339 1.00 0.00 C ATOM 393 CD GLU A 648 23.704 -15.584 2.868 1.00 0.00 C ATOM 394 OE1 GLU A 648 23.850 -16.533 3.668 1.00 0.00 O ATOM 395 OE2 GLU A 648 23.355 -15.765 1.682 1.00 0.00 O ATOM 0 H GLU A 648 20.802 -12.434 5.353 1.00 0.00 H new ATOM 0 HA GLU A 648 23.507 -11.723 4.452 1.00 0.00 H new ATOM 0 HB2 GLU A 648 23.075 -14.058 5.308 1.00 0.00 H new ATOM 0 HB3 GLU A 648 21.879 -14.253 4.041 1.00 0.00 H new ATOM 0 HG2 GLU A 648 23.906 -13.506 2.479 1.00 0.00 H new ATOM 0 HG3 GLU A 648 24.864 -14.086 3.827 1.00 0.00 H new ATOM 402 N TYR A 649 22.374 -10.768 2.429 1.00 0.00 N ATOM 403 CA TYR A 649 21.954 -10.343 1.119 1.00 0.00 C ATOM 404 C TYR A 649 23.183 -10.342 0.246 1.00 0.00 C ATOM 405 O TYR A 649 24.182 -11.001 0.587 1.00 0.00 O ATOM 406 CB TYR A 649 21.317 -8.942 1.170 1.00 0.00 C ATOM 407 CG TYR A 649 20.002 -8.862 1.926 1.00 0.00 C ATOM 408 CD1 TYR A 649 19.942 -9.143 3.274 1.00 0.00 C ATOM 409 CD2 TYR A 649 18.831 -8.467 1.294 1.00 0.00 C ATOM 410 CE1 TYR A 649 18.783 -9.037 3.976 1.00 0.00 C ATOM 411 CE2 TYR A 649 17.645 -8.365 2.000 1.00 0.00 C ATOM 412 CZ TYR A 649 17.640 -8.653 3.350 1.00 0.00 C ATOM 413 OH TYR A 649 16.495 -8.538 4.093 1.00 0.00 O ATOM 0 H TYR A 649 23.047 -10.145 2.875 1.00 0.00 H new ATOM 0 HA TYR A 649 21.195 -11.017 0.721 1.00 0.00 H new ATOM 0 HB2 TYR A 649 22.026 -8.254 1.630 1.00 0.00 H new ATOM 0 HB3 TYR A 649 21.154 -8.596 0.149 1.00 0.00 H new ATOM 0 HD1 TYR A 649 20.840 -9.456 3.786 1.00 0.00 H new ATOM 0 HD2 TYR A 649 18.846 -8.237 0.239 1.00 0.00 H new ATOM 0 HE1 TYR A 649 18.771 -9.258 5.033 1.00 0.00 H new ATOM 0 HE2 TYR A 649 16.736 -8.064 1.501 1.00 0.00 H new ATOM 0 HH TYR A 649 15.856 -9.228 3.818 1.00 0.00 H new ATOM 423 N GLY A 650 23.149 -9.642 -0.832 1.00 0.00 N ATOM 424 CA GLY A 650 24.263 -9.610 -1.698 1.00 0.00 C ATOM 425 C GLY A 650 24.039 -8.670 -2.823 1.00 0.00 C ATOM 426 O GLY A 650 23.104 -7.870 -2.791 1.00 0.00 O ATOM 0 H GLY A 650 22.352 -9.081 -1.133 1.00 0.00 H new ATOM 0 HA2 GLY A 650 25.151 -9.311 -1.142 1.00 0.00 H new ATOM 0 HA3 GLY A 650 24.453 -10.610 -2.088 1.00 0.00 H new ATOM 430 N HIS A 651 24.860 -8.781 -3.814 1.00 0.00 N ATOM 431 CA HIS A 651 24.806 -7.936 -4.966 1.00 0.00 C ATOM 432 C HIS A 651 23.576 -8.260 -5.768 1.00 0.00 C ATOM 433 O HIS A 651 23.210 -9.433 -5.906 1.00 0.00 O ATOM 434 CB HIS A 651 26.056 -8.158 -5.789 1.00 0.00 C ATOM 435 CG HIS A 651 26.336 -7.182 -6.895 1.00 0.00 C ATOM 436 ND1 HIS A 651 26.721 -5.885 -6.661 1.00 0.00 N ATOM 437 CD2 HIS A 651 26.368 -7.344 -8.235 1.00 0.00 C ATOM 438 CE1 HIS A 651 26.977 -5.287 -7.810 1.00 0.00 C ATOM 439 NE2 HIS A 651 26.771 -6.148 -8.778 1.00 0.00 N ATOM 0 H HIS A 651 25.605 -9.477 -3.849 1.00 0.00 H new ATOM 0 HA HIS A 651 24.756 -6.889 -4.668 1.00 0.00 H new ATOM 0 HB2 HIS A 651 26.910 -8.154 -5.112 1.00 0.00 H new ATOM 0 HB3 HIS A 651 25.999 -9.155 -6.226 1.00 0.00 H new ATOM 0 HD2 HIS A 651 26.123 -8.245 -8.778 1.00 0.00 H new ATOM 0 HE1 HIS A 651 27.301 -4.264 -7.932 1.00 0.00 H new ATOM 0 HE2 HIS A 651 26.891 -5.960 -9.773 1.00 0.00 H new ATOM 448 N SER A 652 22.925 -7.219 -6.219 1.00 0.00 N ATOM 449 CA SER A 652 21.752 -7.285 -7.051 1.00 0.00 C ATOM 450 C SER A 652 20.476 -7.670 -6.275 1.00 0.00 C ATOM 451 O SER A 652 19.402 -7.781 -6.866 1.00 0.00 O ATOM 452 CB SER A 652 21.997 -8.163 -8.285 1.00 0.00 C ATOM 453 OG SER A 652 23.174 -7.730 -8.980 1.00 0.00 O ATOM 0 H SER A 652 23.210 -6.263 -6.008 1.00 0.00 H new ATOM 0 HA SER A 652 21.560 -6.274 -7.411 1.00 0.00 H new ATOM 0 HB2 SER A 652 22.108 -9.204 -7.982 1.00 0.00 H new ATOM 0 HB3 SER A 652 21.135 -8.115 -8.951 1.00 0.00 H new ATOM 0 HG SER A 652 23.319 -8.300 -9.764 1.00 0.00 H new ATOM 459 N GLU A 653 20.587 -7.803 -4.950 1.00 0.00 N ATOM 460 CA GLU A 653 19.427 -8.087 -4.102 1.00 0.00 C ATOM 461 C GLU A 653 18.554 -6.865 -4.043 1.00 0.00 C ATOM 462 O GLU A 653 19.069 -5.756 -3.964 1.00 0.00 O ATOM 463 CB GLU A 653 19.845 -8.485 -2.686 1.00 0.00 C ATOM 464 CG GLU A 653 20.460 -9.861 -2.580 1.00 0.00 C ATOM 465 CD GLU A 653 19.474 -10.941 -2.901 1.00 0.00 C ATOM 466 OE1 GLU A 653 18.519 -11.128 -2.121 1.00 0.00 O ATOM 467 OE2 GLU A 653 19.611 -11.600 -3.947 1.00 0.00 O ATOM 0 H GLU A 653 21.468 -7.719 -4.442 1.00 0.00 H new ATOM 0 HA GLU A 653 18.883 -8.926 -4.536 1.00 0.00 H new ATOM 0 HB2 GLU A 653 20.559 -7.751 -2.311 1.00 0.00 H new ATOM 0 HB3 GLU A 653 18.971 -8.440 -2.036 1.00 0.00 H new ATOM 0 HG2 GLU A 653 21.310 -9.932 -3.259 1.00 0.00 H new ATOM 0 HG3 GLU A 653 20.845 -10.010 -1.571 1.00 0.00 H new ATOM 474 N VAL A 654 17.262 -7.056 -4.079 1.00 0.00 N ATOM 475 CA VAL A 654 16.338 -5.944 -4.115 1.00 0.00 C ATOM 476 C VAL A 654 15.377 -5.940 -2.956 1.00 0.00 C ATOM 477 O VAL A 654 14.876 -6.988 -2.535 1.00 0.00 O ATOM 478 CB VAL A 654 15.550 -5.852 -5.445 1.00 0.00 C ATOM 479 CG1 VAL A 654 16.430 -5.302 -6.551 1.00 0.00 C ATOM 480 CG2 VAL A 654 15.018 -7.214 -5.835 1.00 0.00 C ATOM 0 H VAL A 654 16.820 -7.975 -4.084 1.00 0.00 H new ATOM 0 HA VAL A 654 16.973 -5.061 -4.035 1.00 0.00 H new ATOM 0 HB VAL A 654 14.710 -5.173 -5.299 1.00 0.00 H new ATOM 0 HG11 VAL A 654 15.858 -5.245 -7.477 1.00 0.00 H new ATOM 0 HG12 VAL A 654 16.778 -4.306 -6.278 1.00 0.00 H new ATOM 0 HG13 VAL A 654 17.288 -5.959 -6.694 1.00 0.00 H new ATOM 0 HG21 VAL A 654 14.466 -7.135 -6.772 1.00 0.00 H new ATOM 0 HG22 VAL A 654 15.850 -7.907 -5.962 1.00 0.00 H new ATOM 0 HG23 VAL A 654 14.354 -7.583 -5.053 1.00 0.00 H new ATOM 490 N VAL A 655 15.136 -4.769 -2.440 1.00 0.00 N ATOM 491 CA VAL A 655 14.211 -4.571 -1.359 1.00 0.00 C ATOM 492 C VAL A 655 13.136 -3.604 -1.780 1.00 0.00 C ATOM 493 O VAL A 655 13.427 -2.560 -2.359 1.00 0.00 O ATOM 494 CB VAL A 655 14.919 -4.080 -0.066 1.00 0.00 C ATOM 495 CG1 VAL A 655 13.910 -3.555 0.951 1.00 0.00 C ATOM 496 CG2 VAL A 655 15.707 -5.230 0.539 1.00 0.00 C ATOM 0 H VAL A 655 15.583 -3.911 -2.763 1.00 0.00 H new ATOM 0 HA VAL A 655 13.758 -5.534 -1.124 1.00 0.00 H new ATOM 0 HB VAL A 655 15.591 -3.262 -0.327 1.00 0.00 H new ATOM 0 HG11 VAL A 655 14.436 -3.219 1.845 1.00 0.00 H new ATOM 0 HG12 VAL A 655 13.359 -2.720 0.519 1.00 0.00 H new ATOM 0 HG13 VAL A 655 13.214 -4.351 1.217 1.00 0.00 H new ATOM 0 HG21 VAL A 655 16.206 -4.891 1.447 1.00 0.00 H new ATOM 0 HG22 VAL A 655 15.029 -6.048 0.782 1.00 0.00 H new ATOM 0 HG23 VAL A 655 16.452 -5.577 -0.177 1.00 0.00 H new ATOM 506 N GLU A 656 11.912 -3.975 -1.508 1.00 0.00 N ATOM 507 CA GLU A 656 10.778 -3.202 -1.850 1.00 0.00 C ATOM 508 C GLU A 656 10.245 -2.469 -0.616 1.00 0.00 C ATOM 509 O GLU A 656 9.990 -3.074 0.450 1.00 0.00 O ATOM 510 CB GLU A 656 9.707 -4.109 -2.401 1.00 0.00 C ATOM 511 CG GLU A 656 8.591 -3.376 -3.080 1.00 0.00 C ATOM 512 CD GLU A 656 7.510 -4.300 -3.567 1.00 0.00 C ATOM 513 OE1 GLU A 656 7.825 -5.328 -4.197 1.00 0.00 O ATOM 514 OE2 GLU A 656 6.329 -4.044 -3.272 1.00 0.00 O ATOM 0 H GLU A 656 11.686 -4.847 -1.030 1.00 0.00 H new ATOM 0 HA GLU A 656 11.061 -2.465 -2.601 1.00 0.00 H new ATOM 0 HB2 GLU A 656 10.159 -4.802 -3.110 1.00 0.00 H new ATOM 0 HB3 GLU A 656 9.296 -4.707 -1.588 1.00 0.00 H new ATOM 0 HG2 GLU A 656 8.161 -2.652 -2.388 1.00 0.00 H new ATOM 0 HG3 GLU A 656 8.990 -2.812 -3.923 1.00 0.00 H new ATOM 521 N TYR A 657 10.086 -1.205 -0.767 1.00 0.00 N ATOM 522 CA TYR A 657 9.569 -0.340 0.246 1.00 0.00 C ATOM 523 C TYR A 657 8.134 -0.010 -0.025 1.00 0.00 C ATOM 524 O TYR A 657 7.645 -0.205 -1.140 1.00 0.00 O ATOM 525 CB TYR A 657 10.375 0.949 0.296 1.00 0.00 C ATOM 526 CG TYR A 657 11.744 0.767 0.858 1.00 0.00 C ATOM 527 CD1 TYR A 657 11.942 0.799 2.216 1.00 0.00 C ATOM 528 CD2 TYR A 657 12.829 0.522 0.042 1.00 0.00 C ATOM 529 CE1 TYR A 657 13.177 0.596 2.756 1.00 0.00 C ATOM 530 CE2 TYR A 657 14.069 0.311 0.575 1.00 0.00 C ATOM 531 CZ TYR A 657 14.238 0.344 1.931 1.00 0.00 C ATOM 532 OH TYR A 657 15.472 0.130 2.454 1.00 0.00 O ATOM 0 H TYR A 657 10.320 -0.719 -1.632 1.00 0.00 H new ATOM 0 HA TYR A 657 9.644 -0.856 1.203 1.00 0.00 H new ATOM 0 HB2 TYR A 657 10.455 1.359 -0.711 1.00 0.00 H new ATOM 0 HB3 TYR A 657 9.838 1.682 0.897 1.00 0.00 H new ATOM 0 HD1 TYR A 657 11.103 0.989 2.869 1.00 0.00 H new ATOM 0 HD2 TYR A 657 12.697 0.497 -1.030 1.00 0.00 H new ATOM 0 HE1 TYR A 657 13.316 0.634 3.826 1.00 0.00 H new ATOM 0 HE2 TYR A 657 14.912 0.119 -0.072 1.00 0.00 H new ATOM 0 HH TYR A 657 15.397 -0.015 3.420 1.00 0.00 H new ATOM 542 N TYR A 658 7.456 0.441 0.990 1.00 0.00 N ATOM 543 CA TYR A 658 6.110 0.912 0.870 1.00 0.00 C ATOM 544 C TYR A 658 6.017 2.173 1.682 1.00 0.00 C ATOM 545 O TYR A 658 6.674 2.278 2.728 1.00 0.00 O ATOM 546 CB TYR A 658 5.067 -0.126 1.376 1.00 0.00 C ATOM 547 CG TYR A 658 5.108 -0.441 2.868 1.00 0.00 C ATOM 548 CD1 TYR A 658 5.896 -1.465 3.359 1.00 0.00 C ATOM 549 CD2 TYR A 658 4.343 0.289 3.777 1.00 0.00 C ATOM 550 CE1 TYR A 658 5.929 -1.755 4.709 1.00 0.00 C ATOM 551 CE2 TYR A 658 4.372 0.005 5.125 1.00 0.00 C ATOM 552 CZ TYR A 658 5.167 -1.018 5.587 1.00 0.00 C ATOM 553 OH TYR A 658 5.199 -1.308 6.935 1.00 0.00 O ATOM 0 H TYR A 658 7.830 0.492 1.938 1.00 0.00 H new ATOM 0 HA TYR A 658 5.879 1.086 -0.181 1.00 0.00 H new ATOM 0 HB2 TYR A 658 4.070 0.240 1.129 1.00 0.00 H new ATOM 0 HB3 TYR A 658 5.211 -1.055 0.824 1.00 0.00 H new ATOM 0 HD1 TYR A 658 6.496 -2.048 2.676 1.00 0.00 H new ATOM 0 HD2 TYR A 658 3.716 1.092 3.418 1.00 0.00 H new ATOM 0 HE1 TYR A 658 6.551 -2.558 5.075 1.00 0.00 H new ATOM 0 HE2 TYR A 658 3.774 0.582 5.815 1.00 0.00 H new ATOM 0 HH TYR A 658 4.605 -0.694 7.416 1.00 0.00 H new ATOM 563 N CYS A 659 5.292 3.125 1.213 1.00 0.00 N ATOM 564 CA CYS A 659 5.070 4.327 1.962 1.00 0.00 C ATOM 565 C CYS A 659 3.907 4.126 2.910 1.00 0.00 C ATOM 566 O CYS A 659 3.144 3.166 2.769 1.00 0.00 O ATOM 567 CB CYS A 659 4.807 5.521 1.035 1.00 0.00 C ATOM 568 SG CYS A 659 6.260 6.103 0.102 1.00 0.00 S ATOM 0 H CYS A 659 4.833 3.101 0.302 1.00 0.00 H new ATOM 0 HA CYS A 659 5.970 4.548 2.536 1.00 0.00 H new ATOM 0 HB2 CYS A 659 4.025 5.247 0.327 1.00 0.00 H new ATOM 0 HB3 CYS A 659 4.422 6.348 1.632 1.00 0.00 H new ATOM 573 N ASN A 660 3.797 5.005 3.894 1.00 0.00 N ATOM 574 CA ASN A 660 2.667 4.997 4.825 1.00 0.00 C ATOM 575 C ASN A 660 1.410 5.223 3.985 1.00 0.00 C ATOM 576 O ASN A 660 1.486 5.880 2.970 1.00 0.00 O ATOM 577 CB ASN A 660 2.793 6.155 5.810 1.00 0.00 C ATOM 578 CG ASN A 660 2.628 5.787 7.286 1.00 0.00 C ATOM 579 OD1 ASN A 660 1.533 5.872 7.844 1.00 0.00 O ATOM 580 ND2 ASN A 660 3.685 5.380 7.916 1.00 0.00 N ATOM 0 H ASN A 660 4.480 5.741 4.074 1.00 0.00 H new ATOM 0 HA ASN A 660 2.634 4.059 5.380 1.00 0.00 H new ATOM 0 HB2 ASN A 660 3.771 6.618 5.676 1.00 0.00 H new ATOM 0 HB3 ASN A 660 2.047 6.908 5.556 1.00 0.00 H new ATOM 0 HD21 ASN A 660 3.623 5.120 8.900 1.00 0.00 H new ATOM 0 HD22 ASN A 660 4.578 5.320 7.427 1.00 0.00 H new ATOM 587 N PRO A 661 0.255 4.772 4.435 1.00 0.00 N ATOM 588 CA PRO A 661 -1.007 4.784 3.646 1.00 0.00 C ATOM 589 C PRO A 661 -1.556 6.185 3.338 1.00 0.00 C ATOM 590 O PRO A 661 -2.558 6.328 2.659 1.00 0.00 O ATOM 591 CB PRO A 661 -1.967 4.034 4.553 1.00 0.00 C ATOM 592 CG PRO A 661 -1.428 4.261 5.915 1.00 0.00 C ATOM 593 CD PRO A 661 0.048 4.233 5.761 1.00 0.00 C ATOM 0 HA PRO A 661 -0.856 4.347 2.659 1.00 0.00 H new ATOM 0 HB2 PRO A 661 -2.984 4.414 4.458 1.00 0.00 H new ATOM 0 HB3 PRO A 661 -1.999 2.972 4.309 1.00 0.00 H new ATOM 0 HG2 PRO A 661 -1.764 5.217 6.317 1.00 0.00 H new ATOM 0 HG3 PRO A 661 -1.766 3.489 6.606 1.00 0.00 H new ATOM 0 HD2 PRO A 661 0.543 4.836 6.522 1.00 0.00 H new ATOM 0 HD3 PRO A 661 0.442 3.221 5.850 1.00 0.00 H new ATOM 601 N ARG A 662 -0.913 7.198 3.863 1.00 0.00 N ATOM 602 CA ARG A 662 -1.316 8.555 3.598 1.00 0.00 C ATOM 603 C ARG A 662 -0.295 9.269 2.736 1.00 0.00 C ATOM 604 O ARG A 662 -0.485 10.411 2.306 1.00 0.00 O ATOM 605 CB ARG A 662 -1.584 9.297 4.881 1.00 0.00 C ATOM 606 CG ARG A 662 -0.424 9.384 5.818 1.00 0.00 C ATOM 607 CD ARG A 662 -0.878 10.045 7.059 1.00 0.00 C ATOM 608 NE ARG A 662 0.187 10.236 8.036 1.00 0.00 N ATOM 609 CZ ARG A 662 0.093 9.895 9.320 1.00 0.00 C ATOM 610 NH1 ARG A 662 -0.925 9.140 9.740 1.00 0.00 N ATOM 611 NH2 ARG A 662 1.033 10.272 10.169 1.00 0.00 N ATOM 0 H ARG A 662 -0.105 7.107 4.479 1.00 0.00 H new ATOM 0 HA ARG A 662 -2.250 8.529 3.036 1.00 0.00 H new ATOM 0 HB2 ARG A 662 -1.910 10.308 4.636 1.00 0.00 H new ATOM 0 HB3 ARG A 662 -2.412 8.811 5.397 1.00 0.00 H new ATOM 0 HG2 ARG A 662 -0.038 8.389 6.037 1.00 0.00 H new ATOM 0 HG3 ARG A 662 0.390 9.949 5.363 1.00 0.00 H new ATOM 0 HD2 ARG A 662 -1.310 11.014 6.809 1.00 0.00 H new ATOM 0 HD3 ARG A 662 -1.672 9.449 7.510 1.00 0.00 H new ATOM 0 HE ARG A 662 1.059 10.657 7.716 1.00 0.00 H new ATOM 0 HH11 ARG A 662 -1.633 8.823 9.077 1.00 0.00 H new ATOM 0 HH12 ARG A 662 -0.995 8.880 10.724 1.00 0.00 H new ATOM 0 HH21 ARG A 662 1.827 10.822 9.840 1.00 0.00 H new ATOM 0 HH22 ARG A 662 0.965 10.013 11.153 1.00 0.00 H new ATOM 625 N PHE A 663 0.771 8.581 2.483 1.00 0.00 N ATOM 626 CA PHE A 663 1.841 9.062 1.656 1.00 0.00 C ATOM 627 C PHE A 663 1.985 8.190 0.440 1.00 0.00 C ATOM 628 O PHE A 663 1.687 7.004 0.466 1.00 0.00 O ATOM 629 CB PHE A 663 3.181 9.141 2.402 1.00 0.00 C ATOM 630 CG PHE A 663 3.306 10.290 3.359 1.00 0.00 C ATOM 631 CD1 PHE A 663 2.651 10.294 4.569 1.00 0.00 C ATOM 632 CD2 PHE A 663 4.095 11.371 3.030 1.00 0.00 C ATOM 633 CE1 PHE A 663 2.778 11.362 5.435 1.00 0.00 C ATOM 634 CE2 PHE A 663 4.228 12.435 3.883 1.00 0.00 C ATOM 635 CZ PHE A 663 3.570 12.434 5.089 1.00 0.00 C ATOM 0 H PHE A 663 0.930 7.644 2.853 1.00 0.00 H new ATOM 0 HA PHE A 663 1.579 10.077 1.359 1.00 0.00 H new ATOM 0 HB2 PHE A 663 3.329 8.212 2.952 1.00 0.00 H new ATOM 0 HB3 PHE A 663 3.985 9.209 1.669 1.00 0.00 H new ATOM 0 HD1 PHE A 663 2.031 9.453 4.844 1.00 0.00 H new ATOM 0 HD2 PHE A 663 4.617 11.380 2.085 1.00 0.00 H new ATOM 0 HE1 PHE A 663 2.257 11.357 6.381 1.00 0.00 H new ATOM 0 HE2 PHE A 663 4.850 13.274 3.607 1.00 0.00 H new ATOM 0 HZ PHE A 663 3.674 13.271 5.763 1.00 0.00 H new ATOM 645 N LEU A 664 2.423 8.781 -0.604 1.00 0.00 N ATOM 646 CA LEU A 664 2.621 8.110 -1.841 1.00 0.00 C ATOM 647 C LEU A 664 4.074 7.967 -2.103 1.00 0.00 C ATOM 648 O LEU A 664 4.890 8.819 -1.691 1.00 0.00 O ATOM 649 CB LEU A 664 1.936 8.845 -3.007 1.00 0.00 C ATOM 650 CG LEU A 664 0.448 8.636 -3.172 1.00 0.00 C ATOM 651 CD1 LEU A 664 -0.321 9.059 -1.937 1.00 0.00 C ATOM 652 CD2 LEU A 664 -0.034 9.369 -4.404 1.00 0.00 C ATOM 0 H LEU A 664 2.662 9.772 -0.629 1.00 0.00 H new ATOM 0 HA LEU A 664 2.164 7.123 -1.767 1.00 0.00 H new ATOM 0 HB2 LEU A 664 2.116 9.913 -2.887 1.00 0.00 H new ATOM 0 HB3 LEU A 664 2.425 8.541 -3.933 1.00 0.00 H new ATOM 0 HG LEU A 664 0.261 7.570 -3.302 1.00 0.00 H new ATOM 0 HD11 LEU A 664 -1.386 8.893 -2.097 1.00 0.00 H new ATOM 0 HD12 LEU A 664 0.013 8.472 -1.081 1.00 0.00 H new ATOM 0 HD13 LEU A 664 -0.144 10.117 -1.743 1.00 0.00 H new ATOM 0 HD21 LEU A 664 -1.107 9.217 -4.521 1.00 0.00 H new ATOM 0 HD22 LEU A 664 0.172 10.434 -4.298 1.00 0.00 H new ATOM 0 HD23 LEU A 664 0.485 8.985 -5.282 1.00 0.00 H new ATOM 664 N MET A 665 4.404 6.887 -2.734 1.00 0.00 N ATOM 665 CA MET A 665 5.747 6.602 -3.123 1.00 0.00 C ATOM 666 C MET A 665 6.133 7.536 -4.251 1.00 0.00 C ATOM 667 O MET A 665 5.442 7.597 -5.263 1.00 0.00 O ATOM 668 CB MET A 665 5.841 5.159 -3.576 1.00 0.00 C ATOM 669 CG MET A 665 7.236 4.731 -3.952 1.00 0.00 C ATOM 670 SD MET A 665 8.339 4.699 -2.531 1.00 0.00 S ATOM 671 CE MET A 665 7.540 3.444 -1.520 1.00 0.00 C ATOM 0 H MET A 665 3.735 6.164 -2.999 1.00 0.00 H new ATOM 0 HA MET A 665 6.427 6.750 -2.284 1.00 0.00 H new ATOM 0 HB2 MET A 665 5.475 4.513 -2.778 1.00 0.00 H new ATOM 0 HB3 MET A 665 5.183 5.013 -4.432 1.00 0.00 H new ATOM 0 HG2 MET A 665 7.201 3.741 -4.406 1.00 0.00 H new ATOM 0 HG3 MET A 665 7.634 5.412 -4.704 1.00 0.00 H new ATOM 0 HE1 MET A 665 8.238 3.088 -0.762 1.00 0.00 H new ATOM 0 HE2 MET A 665 6.664 3.872 -1.033 1.00 0.00 H new ATOM 0 HE3 MET A 665 7.233 2.610 -2.151 1.00 0.00 H new ATOM 681 N LYS A 666 7.184 8.280 -4.067 1.00 0.00 N ATOM 682 CA LYS A 666 7.609 9.227 -5.066 1.00 0.00 C ATOM 683 C LYS A 666 8.749 8.624 -5.872 1.00 0.00 C ATOM 684 O LYS A 666 8.697 8.587 -7.098 1.00 0.00 O ATOM 685 CB LYS A 666 8.050 10.553 -4.377 1.00 0.00 C ATOM 686 CG LYS A 666 8.081 11.829 -5.250 1.00 0.00 C ATOM 687 CD LYS A 666 9.112 11.803 -6.364 1.00 0.00 C ATOM 688 CE LYS A 666 9.086 13.098 -7.169 1.00 0.00 C ATOM 689 NZ LYS A 666 9.529 14.270 -6.374 1.00 0.00 N ATOM 0 H LYS A 666 7.768 8.252 -3.231 1.00 0.00 H new ATOM 0 HA LYS A 666 6.785 9.454 -5.743 1.00 0.00 H new ATOM 0 HB2 LYS A 666 7.380 10.735 -3.537 1.00 0.00 H new ATOM 0 HB3 LYS A 666 9.047 10.403 -3.963 1.00 0.00 H new ATOM 0 HG2 LYS A 666 7.094 11.978 -5.688 1.00 0.00 H new ATOM 0 HG3 LYS A 666 8.278 12.688 -4.609 1.00 0.00 H new ATOM 0 HD2 LYS A 666 10.105 11.655 -5.940 1.00 0.00 H new ATOM 0 HD3 LYS A 666 8.917 10.957 -7.024 1.00 0.00 H new ATOM 0 HE2 LYS A 666 9.729 12.992 -8.043 1.00 0.00 H new ATOM 0 HE3 LYS A 666 8.075 13.273 -7.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 666 9.672 15.084 -7.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 666 8.803 14.504 -5.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 666 10.422 14.045 -5.892 1.00 0.00 H new ATOM 703 N GLY A 667 9.726 8.099 -5.171 1.00 0.00 N ATOM 704 CA GLY A 667 10.931 7.617 -5.816 1.00 0.00 C ATOM 705 C GLY A 667 10.899 6.140 -6.124 1.00 0.00 C ATOM 706 O GLY A 667 9.824 5.530 -6.139 1.00 0.00 O ATOM 0 H GLY A 667 9.713 7.994 -4.157 1.00 0.00 H new ATOM 0 HA2 GLY A 667 11.084 8.170 -6.743 1.00 0.00 H new ATOM 0 HA3 GLY A 667 11.786 7.828 -5.174 1.00 0.00 H new ATOM 710 N PRO A 668 12.069 5.533 -6.379 1.00 0.00 N ATOM 711 CA PRO A 668 12.167 4.114 -6.654 1.00 0.00 C ATOM 712 C PRO A 668 12.018 3.319 -5.380 1.00 0.00 C ATOM 713 O PRO A 668 12.911 3.275 -4.541 1.00 0.00 O ATOM 714 CB PRO A 668 13.561 3.942 -7.232 1.00 0.00 C ATOM 715 CG PRO A 668 14.349 5.040 -6.624 1.00 0.00 C ATOM 716 CD PRO A 668 13.398 6.189 -6.421 1.00 0.00 C ATOM 0 HA PRO A 668 11.389 3.762 -7.331 1.00 0.00 H new ATOM 0 HB2 PRO A 668 13.978 2.967 -6.981 1.00 0.00 H new ATOM 0 HB3 PRO A 668 13.552 4.014 -8.320 1.00 0.00 H new ATOM 0 HG2 PRO A 668 14.785 4.725 -5.676 1.00 0.00 H new ATOM 0 HG3 PRO A 668 15.175 5.330 -7.274 1.00 0.00 H new ATOM 0 HD2 PRO A 668 13.610 6.727 -5.497 1.00 0.00 H new ATOM 0 HD3 PRO A 668 13.463 6.913 -7.233 1.00 0.00 H new ATOM 724 N ASN A 669 10.890 2.706 -5.241 1.00 0.00 N ATOM 725 CA ASN A 669 10.529 1.958 -4.020 1.00 0.00 C ATOM 726 C ASN A 669 11.358 0.703 -3.848 1.00 0.00 C ATOM 727 O ASN A 669 11.276 0.036 -2.832 1.00 0.00 O ATOM 728 CB ASN A 669 9.064 1.539 -4.018 1.00 0.00 C ATOM 729 CG ASN A 669 8.729 0.491 -5.062 1.00 0.00 C ATOM 730 OD1 ASN A 669 9.251 0.489 -6.180 1.00 0.00 O ATOM 731 ND2 ASN A 669 7.932 -0.439 -4.686 1.00 0.00 N ATOM 0 H ASN A 669 10.167 2.693 -5.961 1.00 0.00 H new ATOM 0 HA ASN A 669 10.724 2.647 -3.199 1.00 0.00 H new ATOM 0 HB2 ASN A 669 8.807 1.152 -3.032 1.00 0.00 H new ATOM 0 HB3 ASN A 669 8.443 2.419 -4.187 1.00 0.00 H new ATOM 0 HD21 ASN A 669 7.713 -1.209 -5.318 1.00 0.00 H new ATOM 0 HD22 ASN A 669 7.516 -0.409 -3.755 1.00 0.00 H new ATOM 738 N LYS A 670 12.103 0.377 -4.835 1.00 0.00 N ATOM 739 CA LYS A 670 12.897 -0.791 -4.829 1.00 0.00 C ATOM 740 C LYS A 670 14.335 -0.416 -4.951 1.00 0.00 C ATOM 741 O LYS A 670 14.709 0.402 -5.801 1.00 0.00 O ATOM 742 CB LYS A 670 12.454 -1.722 -5.941 1.00 0.00 C ATOM 743 CG LYS A 670 11.169 -2.457 -5.654 1.00 0.00 C ATOM 744 CD LYS A 670 10.696 -3.185 -6.891 1.00 0.00 C ATOM 745 CE LYS A 670 9.353 -3.840 -6.678 1.00 0.00 C ATOM 746 NZ LYS A 670 8.895 -4.536 -7.889 1.00 0.00 N ATOM 0 H LYS A 670 12.180 0.928 -5.690 1.00 0.00 H new ATOM 0 HA LYS A 670 12.770 -1.325 -3.887 1.00 0.00 H new ATOM 0 HB2 LYS A 670 12.333 -1.144 -6.857 1.00 0.00 H new ATOM 0 HB3 LYS A 670 13.243 -2.451 -6.126 1.00 0.00 H new ATOM 0 HG2 LYS A 670 11.322 -3.167 -4.841 1.00 0.00 H new ATOM 0 HG3 LYS A 670 10.405 -1.753 -5.323 1.00 0.00 H new ATOM 0 HD2 LYS A 670 10.630 -2.483 -7.723 1.00 0.00 H new ATOM 0 HD3 LYS A 670 11.429 -3.942 -7.170 1.00 0.00 H new ATOM 0 HE2 LYS A 670 9.420 -4.549 -5.853 1.00 0.00 H new ATOM 0 HE3 LYS A 670 8.620 -3.085 -6.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 670 7.970 -4.975 -7.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 670 8.808 -3.854 -8.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 670 9.583 -5.272 -8.147 1.00 0.00 H new ATOM 760 N ILE A 671 15.127 -0.961 -4.086 1.00 0.00 N ATOM 761 CA ILE A 671 16.528 -0.685 -4.068 1.00 0.00 C ATOM 762 C ILE A 671 17.276 -1.963 -4.272 1.00 0.00 C ATOM 763 O ILE A 671 16.714 -3.039 -4.111 1.00 0.00 O ATOM 764 CB ILE A 671 16.997 -0.020 -2.749 1.00 0.00 C ATOM 765 CG1 ILE A 671 16.751 -0.942 -1.559 1.00 0.00 C ATOM 766 CG2 ILE A 671 16.293 1.313 -2.550 1.00 0.00 C ATOM 767 CD1 ILE A 671 17.312 -0.421 -0.263 1.00 0.00 C ATOM 0 H ILE A 671 14.819 -1.615 -3.367 1.00 0.00 H new ATOM 0 HA ILE A 671 16.732 0.023 -4.871 1.00 0.00 H new ATOM 0 HB ILE A 671 18.070 0.162 -2.818 1.00 0.00 H new ATOM 0 HG12 ILE A 671 15.678 -1.094 -1.445 1.00 0.00 H new ATOM 0 HG13 ILE A 671 17.191 -1.917 -1.769 1.00 0.00 H new ATOM 0 HG21 ILE A 671 16.632 1.768 -1.620 1.00 0.00 H new ATOM 0 HG22 ILE A 671 16.525 1.975 -3.384 1.00 0.00 H new ATOM 0 HG23 ILE A 671 15.216 1.152 -2.503 1.00 0.00 H new ATOM 0 HD11 ILE A 671 17.098 -1.130 0.537 1.00 0.00 H new ATOM 0 HD12 ILE A 671 18.391 -0.295 -0.358 1.00 0.00 H new ATOM 0 HD13 ILE A 671 16.854 0.540 -0.028 1.00 0.00 H new ATOM 779 N GLN A 672 18.519 -1.843 -4.568 1.00 0.00 N ATOM 780 CA GLN A 672 19.362 -2.947 -4.878 1.00 0.00 C ATOM 781 C GLN A 672 20.691 -2.793 -4.194 1.00 0.00 C ATOM 782 O GLN A 672 21.221 -1.696 -4.100 1.00 0.00 O ATOM 783 CB GLN A 672 19.509 -3.083 -6.397 1.00 0.00 C ATOM 784 CG GLN A 672 20.594 -4.022 -6.850 1.00 0.00 C ATOM 785 CD GLN A 672 20.570 -4.261 -8.336 1.00 0.00 C ATOM 786 OE1 GLN A 672 21.194 -3.545 -9.109 1.00 0.00 O ATOM 787 NE2 GLN A 672 19.854 -5.275 -8.752 1.00 0.00 N ATOM 0 H GLN A 672 18.997 -0.943 -4.603 1.00 0.00 H new ATOM 0 HA GLN A 672 18.910 -3.867 -4.507 1.00 0.00 H new ATOM 0 HB2 GLN A 672 18.559 -3.423 -6.810 1.00 0.00 H new ATOM 0 HB3 GLN A 672 19.704 -2.097 -6.818 1.00 0.00 H new ATOM 0 HG2 GLN A 672 21.564 -3.614 -6.567 1.00 0.00 H new ATOM 0 HG3 GLN A 672 20.485 -4.974 -6.331 1.00 0.00 H new ATOM 0 HE21 GLN A 672 19.347 -5.851 -8.080 1.00 0.00 H new ATOM 0 HE22 GLN A 672 19.804 -5.489 -9.748 1.00 0.00 H new ATOM 796 N CYS A 673 21.184 -3.871 -3.664 1.00 0.00 N ATOM 797 CA CYS A 673 22.458 -3.864 -2.987 1.00 0.00 C ATOM 798 C CYS A 673 23.560 -4.027 -4.010 1.00 0.00 C ATOM 799 O CYS A 673 23.726 -5.096 -4.603 1.00 0.00 O ATOM 800 CB CYS A 673 22.508 -4.978 -1.946 1.00 0.00 C ATOM 801 SG CYS A 673 23.999 -5.015 -0.890 1.00 0.00 S ATOM 0 H CYS A 673 20.722 -4.780 -3.685 1.00 0.00 H new ATOM 0 HA CYS A 673 22.595 -2.916 -2.466 1.00 0.00 H new ATOM 0 HB2 CYS A 673 21.633 -4.888 -1.303 1.00 0.00 H new ATOM 0 HB3 CYS A 673 22.427 -5.935 -2.462 1.00 0.00 H new ATOM 806 N VAL A 674 24.277 -2.975 -4.252 1.00 0.00 N ATOM 807 CA VAL A 674 25.331 -3.004 -5.239 1.00 0.00 C ATOM 808 C VAL A 674 26.697 -3.229 -4.582 1.00 0.00 C ATOM 809 O VAL A 674 26.786 -3.700 -3.438 1.00 0.00 O ATOM 810 CB VAL A 674 25.341 -1.725 -6.135 1.00 0.00 C ATOM 811 CG1 VAL A 674 24.037 -1.606 -6.909 1.00 0.00 C ATOM 812 CG2 VAL A 674 25.591 -0.464 -5.324 1.00 0.00 C ATOM 0 H VAL A 674 24.158 -2.078 -3.782 1.00 0.00 H new ATOM 0 HA VAL A 674 25.126 -3.849 -5.896 1.00 0.00 H new ATOM 0 HB VAL A 674 26.165 -1.830 -6.840 1.00 0.00 H new ATOM 0 HG11 VAL A 674 24.062 -0.709 -7.528 1.00 0.00 H new ATOM 0 HG12 VAL A 674 23.910 -2.482 -7.545 1.00 0.00 H new ATOM 0 HG13 VAL A 674 23.203 -1.541 -6.210 1.00 0.00 H new ATOM 0 HG21 VAL A 674 25.590 0.401 -5.987 1.00 0.00 H new ATOM 0 HG22 VAL A 674 24.805 -0.350 -4.577 1.00 0.00 H new ATOM 0 HG23 VAL A 674 26.558 -0.538 -4.825 1.00 0.00 H new ATOM 822 N ASP A 675 27.748 -2.952 -5.321 1.00 0.00 N ATOM 823 CA ASP A 675 29.116 -3.102 -4.853 1.00 0.00 C ATOM 824 C ASP A 675 29.469 -1.985 -3.869 1.00 0.00 C ATOM 825 O ASP A 675 29.996 -0.936 -4.228 1.00 0.00 O ATOM 826 CB ASP A 675 30.108 -3.148 -6.048 1.00 0.00 C ATOM 827 CG ASP A 675 30.037 -1.958 -6.995 1.00 0.00 C ATOM 828 OD1 ASP A 675 28.921 -1.631 -7.490 1.00 0.00 O ATOM 829 OD2 ASP A 675 31.076 -1.319 -7.263 1.00 0.00 O ATOM 0 H ASP A 675 27.680 -2.611 -6.280 1.00 0.00 H new ATOM 0 HA ASP A 675 29.201 -4.051 -4.324 1.00 0.00 H new ATOM 0 HB2 ASP A 675 31.122 -3.219 -5.655 1.00 0.00 H new ATOM 0 HB3 ASP A 675 29.922 -4.058 -6.619 1.00 0.00 H new ATOM 834 N GLY A 676 29.027 -2.169 -2.656 1.00 0.00 N ATOM 835 CA GLY A 676 29.364 -1.287 -1.593 1.00 0.00 C ATOM 836 C GLY A 676 28.211 -1.023 -0.674 1.00 0.00 C ATOM 837 O GLY A 676 28.327 -1.198 0.537 1.00 0.00 O ATOM 0 H GLY A 676 28.420 -2.942 -2.384 1.00 0.00 H new ATOM 0 HA2 GLY A 676 30.189 -1.712 -1.021 1.00 0.00 H new ATOM 0 HA3 GLY A 676 29.717 -0.343 -2.008 1.00 0.00 H new ATOM 841 N GLU A 677 27.089 -0.646 -1.233 1.00 0.00 N ATOM 842 CA GLU A 677 25.911 -0.301 -0.440 1.00 0.00 C ATOM 843 C GLU A 677 24.657 -0.493 -1.278 1.00 0.00 C ATOM 844 O GLU A 677 24.725 -1.048 -2.365 1.00 0.00 O ATOM 845 CB GLU A 677 25.993 1.159 0.067 1.00 0.00 C ATOM 846 CG GLU A 677 25.992 2.214 -1.034 1.00 0.00 C ATOM 847 CD GLU A 677 25.952 3.623 -0.495 1.00 0.00 C ATOM 848 OE1 GLU A 677 24.916 4.033 0.057 1.00 0.00 O ATOM 849 OE2 GLU A 677 26.934 4.362 -0.658 1.00 0.00 O ATOM 0 H GLU A 677 26.955 -0.566 -2.241 1.00 0.00 H new ATOM 0 HA GLU A 677 25.872 -0.959 0.428 1.00 0.00 H new ATOM 0 HB2 GLU A 677 25.150 1.347 0.733 1.00 0.00 H new ATOM 0 HB3 GLU A 677 26.900 1.273 0.661 1.00 0.00 H new ATOM 0 HG2 GLU A 677 26.883 2.091 -1.650 1.00 0.00 H new ATOM 0 HG3 GLU A 677 25.131 2.054 -1.683 1.00 0.00 H new ATOM 856 N TRP A 678 23.539 -0.044 -0.771 1.00 0.00 N ATOM 857 CA TRP A 678 22.282 -0.119 -1.474 1.00 0.00 C ATOM 858 C TRP A 678 22.116 1.109 -2.378 1.00 0.00 C ATOM 859 O TRP A 678 22.814 2.111 -2.207 1.00 0.00 O ATOM 860 CB TRP A 678 21.130 -0.203 -0.476 1.00 0.00 C ATOM 861 CG TRP A 678 21.088 -1.482 0.324 1.00 0.00 C ATOM 862 CD1 TRP A 678 21.740 -1.768 1.494 1.00 0.00 C ATOM 863 CD2 TRP A 678 20.330 -2.637 0.001 1.00 0.00 C ATOM 864 NE1 TRP A 678 21.425 -3.045 1.902 1.00 0.00 N ATOM 865 CE2 TRP A 678 20.564 -3.599 0.996 1.00 0.00 C ATOM 866 CE3 TRP A 678 19.482 -2.944 -1.042 1.00 0.00 C ATOM 867 CZ2 TRP A 678 19.963 -4.860 0.963 1.00 0.00 C ATOM 868 CZ3 TRP A 678 18.889 -4.165 -1.087 1.00 0.00 C ATOM 869 CH2 TRP A 678 19.127 -5.124 -0.092 1.00 0.00 C ATOM 0 H TRP A 678 23.473 0.389 0.150 1.00 0.00 H new ATOM 0 HA TRP A 678 22.272 -1.015 -2.094 1.00 0.00 H new ATOM 0 HB2 TRP A 678 21.200 0.639 0.212 1.00 0.00 H new ATOM 0 HB3 TRP A 678 20.189 -0.096 -1.016 1.00 0.00 H new ATOM 0 HD1 TRP A 678 22.401 -1.094 2.018 1.00 0.00 H new ATOM 0 HE1 TRP A 678 21.777 -3.503 2.743 1.00 0.00 H new ATOM 0 HE3 TRP A 678 19.291 -2.218 -1.818 1.00 0.00 H new ATOM 0 HZ2 TRP A 678 20.148 -5.594 1.733 1.00 0.00 H new ATOM 0 HZ3 TRP A 678 18.223 -4.401 -1.903 1.00 0.00 H new ATOM 0 HH2 TRP A 678 18.644 -6.088 -0.157 1.00 0.00 H new ATOM 880 N THR A 679 21.220 1.025 -3.328 1.00 0.00 N ATOM 881 CA THR A 679 20.972 2.102 -4.271 1.00 0.00 C ATOM 882 C THR A 679 20.158 3.244 -3.658 1.00 0.00 C ATOM 883 O THR A 679 19.839 3.226 -2.458 1.00 0.00 O ATOM 884 CB THR A 679 20.261 1.558 -5.523 1.00 0.00 C ATOM 885 OG1 THR A 679 19.118 0.792 -5.116 1.00 0.00 O ATOM 886 CG2 THR A 679 21.188 0.681 -6.350 1.00 0.00 C ATOM 0 H THR A 679 20.634 0.203 -3.476 1.00 0.00 H new ATOM 0 HA THR A 679 21.942 2.513 -4.549 1.00 0.00 H new ATOM 0 HB THR A 679 19.954 2.403 -6.140 1.00 0.00 H new ATOM 0 HG1 THR A 679 18.659 0.443 -5.908 1.00 0.00 H new ATOM 0 HG21 THR A 679 20.655 0.313 -7.227 1.00 0.00 H new ATOM 0 HG22 THR A 679 22.052 1.264 -6.669 1.00 0.00 H new ATOM 0 HG23 THR A 679 21.523 -0.164 -5.748 1.00 0.00 H new ATOM 894 N THR A 680 19.867 4.238 -4.475 1.00 0.00 N ATOM 895 CA THR A 680 19.092 5.388 -4.092 1.00 0.00 C ATOM 896 C THR A 680 17.697 4.982 -3.599 1.00 0.00 C ATOM 897 O THR A 680 16.889 4.419 -4.351 1.00 0.00 O ATOM 898 CB THR A 680 18.976 6.341 -5.300 1.00 0.00 C ATOM 899 OG1 THR A 680 20.308 6.715 -5.724 1.00 0.00 O ATOM 900 CG2 THR A 680 18.171 7.591 -4.955 1.00 0.00 C ATOM 0 H THR A 680 20.174 4.263 -5.447 1.00 0.00 H new ATOM 0 HA THR A 680 19.596 5.893 -3.268 1.00 0.00 H new ATOM 0 HB THR A 680 18.450 5.825 -6.103 1.00 0.00 H new ATOM 0 HG1 THR A 680 20.249 7.320 -6.493 1.00 0.00 H new ATOM 0 HG21 THR A 680 18.111 8.238 -5.830 1.00 0.00 H new ATOM 0 HG22 THR A 680 17.166 7.303 -4.647 1.00 0.00 H new ATOM 0 HG23 THR A 680 18.661 8.126 -4.141 1.00 0.00 H new ATOM 908 N LEU A 681 17.459 5.215 -2.331 1.00 0.00 N ATOM 909 CA LEU A 681 16.175 4.948 -1.727 1.00 0.00 C ATOM 910 C LEU A 681 15.110 5.923 -2.175 1.00 0.00 C ATOM 911 O LEU A 681 15.412 7.057 -2.595 1.00 0.00 O ATOM 912 CB LEU A 681 16.232 4.917 -0.200 1.00 0.00 C ATOM 913 CG LEU A 681 16.725 3.636 0.434 1.00 0.00 C ATOM 914 CD1 LEU A 681 18.236 3.538 0.428 1.00 0.00 C ATOM 915 CD2 LEU A 681 16.150 3.509 1.810 1.00 0.00 C ATOM 0 H LEU A 681 18.152 5.596 -1.687 1.00 0.00 H new ATOM 0 HA LEU A 681 15.902 3.952 -2.077 1.00 0.00 H new ATOM 0 HB2 LEU A 681 16.875 5.731 0.133 1.00 0.00 H new ATOM 0 HB3 LEU A 681 15.232 5.123 0.182 1.00 0.00 H new ATOM 0 HG LEU A 681 16.378 2.794 -0.165 1.00 0.00 H new ATOM 0 HD11 LEU A 681 18.542 2.601 0.894 1.00 0.00 H new ATOM 0 HD12 LEU A 681 18.598 3.568 -0.600 1.00 0.00 H new ATOM 0 HD13 LEU A 681 18.657 4.375 0.986 1.00 0.00 H new ATOM 0 HD21 LEU A 681 16.504 2.586 2.269 1.00 0.00 H new ATOM 0 HD22 LEU A 681 16.464 4.359 2.416 1.00 0.00 H new ATOM 0 HD23 LEU A 681 15.062 3.489 1.749 1.00 0.00 H new ATOM 927 N PRO A 682 13.842 5.496 -2.086 1.00 0.00 N ATOM 928 CA PRO A 682 12.708 6.305 -2.477 1.00 0.00 C ATOM 929 C PRO A 682 12.396 7.430 -1.497 1.00 0.00 C ATOM 930 O PRO A 682 13.061 7.612 -0.467 1.00 0.00 O ATOM 931 CB PRO A 682 11.560 5.310 -2.471 1.00 0.00 C ATOM 932 CG PRO A 682 11.945 4.310 -1.452 1.00 0.00 C ATOM 933 CD PRO A 682 13.412 4.150 -1.618 1.00 0.00 C ATOM 0 HA PRO A 682 12.892 6.800 -3.431 1.00 0.00 H new ATOM 0 HB2 PRO A 682 10.617 5.793 -2.217 1.00 0.00 H new ATOM 0 HB3 PRO A 682 11.428 4.849 -3.450 1.00 0.00 H new ATOM 0 HG2 PRO A 682 11.695 4.651 -0.448 1.00 0.00 H new ATOM 0 HG3 PRO A 682 11.423 3.366 -1.607 1.00 0.00 H new ATOM 0 HD2 PRO A 682 13.897 3.874 -0.682 1.00 0.00 H new ATOM 0 HD3 PRO A 682 13.654 3.373 -2.344 1.00 0.00 H new ATOM 941 N VAL A 683 11.360 8.145 -1.820 1.00 0.00 N ATOM 942 CA VAL A 683 10.880 9.262 -1.067 1.00 0.00 C ATOM 943 C VAL A 683 9.384 9.065 -0.958 1.00 0.00 C ATOM 944 O VAL A 683 8.782 8.463 -1.849 1.00 0.00 O ATOM 945 CB VAL A 683 11.168 10.619 -1.810 1.00 0.00 C ATOM 946 CG1 VAL A 683 10.729 11.822 -0.981 1.00 0.00 C ATOM 947 CG2 VAL A 683 12.637 10.750 -2.190 1.00 0.00 C ATOM 0 H VAL A 683 10.803 7.956 -2.653 1.00 0.00 H new ATOM 0 HA VAL A 683 11.373 9.313 -0.096 1.00 0.00 H new ATOM 0 HB VAL A 683 10.578 10.604 -2.726 1.00 0.00 H new ATOM 0 HG11 VAL A 683 10.945 12.739 -1.529 1.00 0.00 H new ATOM 0 HG12 VAL A 683 9.658 11.759 -0.787 1.00 0.00 H new ATOM 0 HG13 VAL A 683 11.270 11.829 -0.035 1.00 0.00 H new ATOM 0 HG21 VAL A 683 12.797 11.699 -2.701 1.00 0.00 H new ATOM 0 HG22 VAL A 683 13.250 10.714 -1.290 1.00 0.00 H new ATOM 0 HG23 VAL A 683 12.916 9.930 -2.852 1.00 0.00 H new ATOM 957 N CYS A 684 8.804 9.529 0.103 1.00 0.00 N ATOM 958 CA CYS A 684 7.386 9.431 0.312 1.00 0.00 C ATOM 959 C CYS A 684 6.830 10.833 0.437 1.00 0.00 C ATOM 960 O CYS A 684 7.350 11.639 1.210 1.00 0.00 O ATOM 961 CB CYS A 684 7.080 8.618 1.576 1.00 0.00 C ATOM 962 SG CYS A 684 7.492 6.859 1.524 1.00 0.00 S ATOM 0 H CYS A 684 9.304 9.993 0.861 1.00 0.00 H new ATOM 0 HA CYS A 684 6.921 8.917 -0.530 1.00 0.00 H new ATOM 0 HB2 CYS A 684 7.617 9.069 2.410 1.00 0.00 H new ATOM 0 HB3 CYS A 684 6.016 8.713 1.793 1.00 0.00 H new ATOM 967 N ILE A 685 5.813 11.124 -0.319 1.00 0.00 N ATOM 968 CA ILE A 685 5.212 12.440 -0.362 1.00 0.00 C ATOM 969 C ILE A 685 3.750 12.325 -0.034 1.00 0.00 C ATOM 970 O ILE A 685 3.174 11.263 -0.161 1.00 0.00 O ATOM 971 CB ILE A 685 5.331 13.061 -1.764 1.00 0.00 C ATOM 972 CG1 ILE A 685 4.724 12.108 -2.804 1.00 0.00 C ATOM 973 CG2 ILE A 685 6.785 13.380 -2.082 1.00 0.00 C ATOM 974 CD1 ILE A 685 4.587 12.689 -4.176 1.00 0.00 C ATOM 0 H ILE A 685 5.364 10.447 -0.937 1.00 0.00 H new ATOM 0 HA ILE A 685 5.733 13.071 0.358 1.00 0.00 H new ATOM 0 HB ILE A 685 4.776 13.999 -1.793 1.00 0.00 H new ATOM 0 HG12 ILE A 685 5.344 11.213 -2.863 1.00 0.00 H new ATOM 0 HG13 ILE A 685 3.740 11.792 -2.457 1.00 0.00 H new ATOM 0 HG21 ILE A 685 6.852 13.819 -3.078 1.00 0.00 H new ATOM 0 HG22 ILE A 685 7.172 14.086 -1.347 1.00 0.00 H new ATOM 0 HG23 ILE A 685 7.374 12.464 -2.049 1.00 0.00 H new ATOM 0 HD11 ILE A 685 4.150 11.946 -4.844 1.00 0.00 H new ATOM 0 HD12 ILE A 685 3.941 13.566 -4.137 1.00 0.00 H new ATOM 0 HD13 ILE A 685 5.570 12.978 -4.548 1.00 0.00 H new ATOM 986 N VAL A 686 3.160 13.378 0.388 1.00 0.00 N ATOM 987 CA VAL A 686 1.764 13.344 0.706 1.00 0.00 C ATOM 988 C VAL A 686 0.962 13.994 -0.385 1.00 0.00 C ATOM 989 O VAL A 686 1.140 15.170 -0.750 1.00 0.00 O ATOM 990 CB VAL A 686 1.433 13.906 2.119 1.00 0.00 C ATOM 991 CG1 VAL A 686 1.731 15.377 2.219 1.00 0.00 C ATOM 992 CG2 VAL A 686 -0.005 13.606 2.517 1.00 0.00 C ATOM 0 H VAL A 686 3.613 14.282 0.525 1.00 0.00 H new ATOM 0 HA VAL A 686 1.471 12.295 0.758 1.00 0.00 H new ATOM 0 HB VAL A 686 2.085 13.394 2.827 1.00 0.00 H new ATOM 0 HG11 VAL A 686 1.486 15.731 3.221 1.00 0.00 H new ATOM 0 HG12 VAL A 686 2.789 15.548 2.022 1.00 0.00 H new ATOM 0 HG13 VAL A 686 1.134 15.920 1.487 1.00 0.00 H new ATOM 0 HG21 VAL A 686 -0.200 14.013 3.509 1.00 0.00 H new ATOM 0 HG22 VAL A 686 -0.685 14.062 1.797 1.00 0.00 H new ATOM 0 HG23 VAL A 686 -0.161 12.527 2.530 1.00 0.00 H new ATOM 1043 N THR A 690 -7.885 12.742 -0.680 1.00 0.00 N ATOM 1044 CA THR A 690 -8.382 11.531 -0.116 1.00 0.00 C ATOM 1045 C THR A 690 -9.477 10.933 -0.983 1.00 0.00 C ATOM 1046 O THR A 690 -9.871 11.506 -2.002 1.00 0.00 O ATOM 1047 CB THR A 690 -8.906 11.763 1.337 1.00 0.00 C ATOM 1048 OG1 THR A 690 -9.885 12.814 1.356 1.00 0.00 O ATOM 1049 CG2 THR A 690 -7.771 12.127 2.281 1.00 0.00 C ATOM 0 HA THR A 690 -7.554 10.823 -0.074 1.00 0.00 H new ATOM 0 HB THR A 690 -9.360 10.831 1.673 1.00 0.00 H new ATOM 0 HG1 THR A 690 -9.776 13.377 0.561 1.00 0.00 H new ATOM 0 HG21 THR A 690 -8.168 12.282 3.284 1.00 0.00 H new ATOM 0 HG22 THR A 690 -7.041 11.318 2.301 1.00 0.00 H new ATOM 0 HG23 THR A 690 -7.290 13.042 1.936 1.00 0.00 H new ATOM 1057 N CYS A 691 -9.924 9.776 -0.607 1.00 0.00 N ATOM 1058 CA CYS A 691 -11.046 9.140 -1.254 1.00 0.00 C ATOM 1059 C CYS A 691 -12.347 9.539 -0.584 1.00 0.00 C ATOM 1060 O CYS A 691 -13.436 9.120 -0.994 1.00 0.00 O ATOM 1061 CB CYS A 691 -10.863 7.630 -1.279 1.00 0.00 C ATOM 1062 SG CYS A 691 -9.783 7.051 -2.607 1.00 0.00 S ATOM 0 H CYS A 691 -9.524 9.237 0.161 1.00 0.00 H new ATOM 0 HA CYS A 691 -11.094 9.482 -2.288 1.00 0.00 H new ATOM 0 HB2 CYS A 691 -10.453 7.307 -0.322 1.00 0.00 H new ATOM 0 HB3 CYS A 691 -11.839 7.156 -1.384 1.00 0.00 H new ATOM 1067 N GLY A 692 -12.222 10.323 0.467 1.00 0.00 N ATOM 1068 CA GLY A 692 -13.357 10.859 1.146 1.00 0.00 C ATOM 1069 C GLY A 692 -13.808 9.948 2.222 1.00 0.00 C ATOM 1070 O GLY A 692 -13.528 10.181 3.412 1.00 0.00 O ATOM 0 H GLY A 692 -11.325 10.600 0.866 1.00 0.00 H new ATOM 0 HA2 GLY A 692 -13.107 11.832 1.569 1.00 0.00 H new ATOM 0 HA3 GLY A 692 -14.168 11.019 0.436 1.00 0.00 H new ATOM 1074 N ASP A 693 -14.460 8.892 1.819 1.00 0.00 N ATOM 1075 CA ASP A 693 -14.938 7.884 2.722 1.00 0.00 C ATOM 1076 C ASP A 693 -15.171 6.622 1.926 1.00 0.00 C ATOM 1077 O ASP A 693 -14.692 6.503 0.783 1.00 0.00 O ATOM 1078 CB ASP A 693 -16.236 8.332 3.432 1.00 0.00 C ATOM 1079 CG ASP A 693 -16.389 7.716 4.820 1.00 0.00 C ATOM 1080 OD1 ASP A 693 -16.648 6.502 4.947 1.00 0.00 O ATOM 1081 OD2 ASP A 693 -16.200 8.437 5.818 1.00 0.00 O ATOM 0 H ASP A 693 -14.677 8.706 0.840 1.00 0.00 H new ATOM 0 HA ASP A 693 -14.198 7.709 3.503 1.00 0.00 H new ATOM 0 HB2 ASP A 693 -16.242 9.419 3.518 1.00 0.00 H new ATOM 0 HB3 ASP A 693 -17.094 8.056 2.820 1.00 0.00 H new ATOM 1086 N ILE A 694 -15.841 5.701 2.510 1.00 0.00 N ATOM 1087 CA ILE A 694 -16.196 4.475 1.910 1.00 0.00 C ATOM 1088 C ILE A 694 -17.398 4.640 1.008 1.00 0.00 C ATOM 1089 O ILE A 694 -18.366 5.318 1.356 1.00 0.00 O ATOM 1090 CB ILE A 694 -16.390 3.433 3.020 1.00 0.00 C ATOM 1091 CG1 ILE A 694 -15.049 2.814 3.315 1.00 0.00 C ATOM 1092 CG2 ILE A 694 -17.465 2.391 2.721 1.00 0.00 C ATOM 1093 CD1 ILE A 694 -14.809 2.539 4.758 1.00 0.00 C ATOM 0 H ILE A 694 -16.173 5.788 3.470 1.00 0.00 H new ATOM 0 HA ILE A 694 -15.401 4.119 1.255 1.00 0.00 H new ATOM 0 HB ILE A 694 -16.773 3.941 3.905 1.00 0.00 H new ATOM 0 HG12 ILE A 694 -14.962 1.880 2.759 1.00 0.00 H new ATOM 0 HG13 ILE A 694 -14.266 3.478 2.948 1.00 0.00 H new ATOM 0 HG21 ILE A 694 -17.538 1.693 3.555 1.00 0.00 H new ATOM 0 HG22 ILE A 694 -18.424 2.888 2.579 1.00 0.00 H new ATOM 0 HG23 ILE A 694 -17.201 1.846 1.815 1.00 0.00 H new ATOM 0 HD11 ILE A 694 -13.822 2.094 4.884 1.00 0.00 H new ATOM 0 HD12 ILE A 694 -14.861 3.472 5.320 1.00 0.00 H new ATOM 0 HD13 ILE A 694 -15.568 1.850 5.128 1.00 0.00 H new ATOM 1105 N PRO A 695 -17.308 4.076 -0.186 1.00 0.00 N ATOM 1106 CA PRO A 695 -18.366 4.137 -1.169 1.00 0.00 C ATOM 1107 C PRO A 695 -19.520 3.220 -0.806 1.00 0.00 C ATOM 1108 O PRO A 695 -19.526 2.559 0.239 1.00 0.00 O ATOM 1109 CB PRO A 695 -17.693 3.634 -2.444 1.00 0.00 C ATOM 1110 CG PRO A 695 -16.615 2.733 -1.963 1.00 0.00 C ATOM 1111 CD PRO A 695 -16.150 3.310 -0.659 1.00 0.00 C ATOM 0 HA PRO A 695 -18.789 5.138 -1.255 1.00 0.00 H new ATOM 0 HB2 PRO A 695 -18.399 3.103 -3.083 1.00 0.00 H new ATOM 0 HB3 PRO A 695 -17.289 4.458 -3.032 1.00 0.00 H new ATOM 0 HG2 PRO A 695 -16.985 1.716 -1.831 1.00 0.00 H new ATOM 0 HG3 PRO A 695 -15.797 2.683 -2.682 1.00 0.00 H new ATOM 0 HD2 PRO A 695 -15.871 2.529 0.048 1.00 0.00 H new ATOM 0 HD3 PRO A 695 -15.276 3.947 -0.792 1.00 0.00 H new ATOM 1119 N GLU A 696 -20.467 3.161 -1.654 1.00 0.00 N ATOM 1120 CA GLU A 696 -21.589 2.336 -1.437 1.00 0.00 C ATOM 1121 C GLU A 696 -21.546 1.176 -2.385 1.00 0.00 C ATOM 1122 O GLU A 696 -21.513 1.355 -3.603 1.00 0.00 O ATOM 1123 CB GLU A 696 -22.889 3.115 -1.597 1.00 0.00 C ATOM 1124 CG GLU A 696 -24.126 2.274 -1.354 1.00 0.00 C ATOM 1125 CD GLU A 696 -25.389 3.062 -1.445 1.00 0.00 C ATOM 1126 OE1 GLU A 696 -25.770 3.693 -0.442 1.00 0.00 O ATOM 1127 OE2 GLU A 696 -26.046 3.047 -2.513 1.00 0.00 O ATOM 0 H GLU A 696 -20.489 3.688 -2.527 1.00 0.00 H new ATOM 0 HA GLU A 696 -21.556 1.965 -0.412 1.00 0.00 H new ATOM 0 HB2 GLU A 696 -22.888 3.956 -0.904 1.00 0.00 H new ATOM 0 HB3 GLU A 696 -22.933 3.532 -2.603 1.00 0.00 H new ATOM 0 HG2 GLU A 696 -24.156 1.463 -2.081 1.00 0.00 H new ATOM 0 HG3 GLU A 696 -24.060 1.815 -0.367 1.00 0.00 H new ATOM 1134 N LEU A 697 -21.511 0.004 -1.843 1.00 0.00 N ATOM 1135 CA LEU A 697 -21.557 -1.175 -2.637 1.00 0.00 C ATOM 1136 C LEU A 697 -23.027 -1.523 -2.767 1.00 0.00 C ATOM 1137 O LEU A 697 -23.754 -1.398 -1.778 1.00 0.00 O ATOM 1138 CB LEU A 697 -20.762 -2.288 -1.944 1.00 0.00 C ATOM 1139 CG LEU A 697 -20.549 -3.580 -2.730 1.00 0.00 C ATOM 1140 CD1 LEU A 697 -19.878 -3.282 -4.049 1.00 0.00 C ATOM 1141 CD2 LEU A 697 -19.694 -4.543 -1.928 1.00 0.00 C ATOM 0 H LEU A 697 -21.450 -0.162 -0.838 1.00 0.00 H new ATOM 0 HA LEU A 697 -21.111 -1.040 -3.622 1.00 0.00 H new ATOM 0 HB2 LEU A 697 -19.784 -1.889 -1.676 1.00 0.00 H new ATOM 0 HB3 LEU A 697 -21.270 -2.538 -1.013 1.00 0.00 H new ATOM 0 HG LEU A 697 -21.520 -4.037 -2.920 1.00 0.00 H new ATOM 0 HD11 LEU A 697 -19.731 -4.211 -4.601 1.00 0.00 H new ATOM 0 HD12 LEU A 697 -20.506 -2.609 -4.633 1.00 0.00 H new ATOM 0 HD13 LEU A 697 -18.912 -2.811 -3.868 1.00 0.00 H new ATOM 0 HD21 LEU A 697 -19.548 -5.461 -2.497 1.00 0.00 H new ATOM 0 HD22 LEU A 697 -18.726 -4.086 -1.723 1.00 0.00 H new ATOM 0 HD23 LEU A 697 -20.193 -4.775 -0.987 1.00 0.00 H new ATOM 1153 N GLU A 698 -23.459 -1.936 -3.966 1.00 0.00 N ATOM 1154 CA GLU A 698 -24.892 -2.188 -4.300 1.00 0.00 C ATOM 1155 C GLU A 698 -25.669 -2.910 -3.187 1.00 0.00 C ATOM 1156 O GLU A 698 -26.819 -2.596 -2.920 1.00 0.00 O ATOM 1157 CB GLU A 698 -25.011 -2.977 -5.608 1.00 0.00 C ATOM 1158 CG GLU A 698 -24.494 -4.411 -5.541 1.00 0.00 C ATOM 1159 CD GLU A 698 -24.639 -5.123 -6.845 1.00 0.00 C ATOM 1160 OE1 GLU A 698 -25.782 -5.342 -7.290 1.00 0.00 O ATOM 1161 OE2 GLU A 698 -23.622 -5.428 -7.477 1.00 0.00 O ATOM 0 H GLU A 698 -22.828 -2.110 -4.748 1.00 0.00 H new ATOM 0 HA GLU A 698 -25.347 -1.204 -4.413 1.00 0.00 H new ATOM 0 HB2 GLU A 698 -26.058 -2.997 -5.909 1.00 0.00 H new ATOM 0 HB3 GLU A 698 -24.465 -2.445 -6.387 1.00 0.00 H new ATOM 0 HG2 GLU A 698 -23.444 -4.404 -5.247 1.00 0.00 H new ATOM 0 HG3 GLU A 698 -25.037 -4.956 -4.769 1.00 0.00 H new ATOM 1168 N HIS A 699 -25.034 -3.881 -2.573 1.00 0.00 N ATOM 1169 CA HIS A 699 -25.603 -4.626 -1.471 1.00 0.00 C ATOM 1170 C HIS A 699 -24.516 -4.920 -0.460 1.00 0.00 C ATOM 1171 O HIS A 699 -24.573 -5.909 0.276 1.00 0.00 O ATOM 1172 CB HIS A 699 -26.279 -5.929 -1.959 1.00 0.00 C ATOM 1173 CG HIS A 699 -27.685 -5.746 -2.482 1.00 0.00 C ATOM 1174 ND1 HIS A 699 -28.787 -5.786 -1.671 1.00 0.00 N ATOM 1175 CD2 HIS A 699 -28.161 -5.526 -3.732 1.00 0.00 C ATOM 1176 CE1 HIS A 699 -29.870 -5.607 -2.382 1.00 0.00 C ATOM 1177 NE2 HIS A 699 -29.525 -5.445 -3.634 1.00 0.00 N ATOM 0 H HIS A 699 -24.093 -4.181 -2.828 1.00 0.00 H new ATOM 0 HA HIS A 699 -26.380 -4.025 -1.000 1.00 0.00 H new ATOM 0 HB2 HIS A 699 -25.666 -6.369 -2.746 1.00 0.00 H new ATOM 0 HB3 HIS A 699 -26.301 -6.643 -1.136 1.00 0.00 H new ATOM 0 HD2 HIS A 699 -27.576 -5.432 -4.635 1.00 0.00 H new ATOM 0 HE1 HIS A 699 -30.880 -5.595 -2.000 1.00 0.00 H new ATOM 0 HE2 HIS A 699 -30.167 -5.285 -4.410 1.00 0.00 H new ATOM 1186 N GLY A 700 -23.523 -4.051 -0.435 1.00 0.00 N ATOM 1187 CA GLY A 700 -22.415 -4.205 0.475 1.00 0.00 C ATOM 1188 C GLY A 700 -22.077 -2.930 1.242 1.00 0.00 C ATOM 1189 O GLY A 700 -22.710 -1.888 1.054 1.00 0.00 O ATOM 0 H GLY A 700 -23.465 -3.230 -1.038 1.00 0.00 H new ATOM 0 HA2 GLY A 700 -22.647 -4.997 1.187 1.00 0.00 H new ATOM 0 HA3 GLY A 700 -21.537 -4.527 -0.085 1.00 0.00 H new ATOM 1193 N TRP A 701 -21.070 -3.037 2.077 1.00 0.00 N ATOM 1194 CA TRP A 701 -20.582 -2.028 2.977 1.00 0.00 C ATOM 1195 C TRP A 701 -19.172 -2.423 3.342 1.00 0.00 C ATOM 1196 O TRP A 701 -18.543 -3.144 2.587 1.00 0.00 O ATOM 1197 CB TRP A 701 -21.497 -1.916 4.214 1.00 0.00 C ATOM 1198 CG TRP A 701 -22.043 -3.228 4.689 1.00 0.00 C ATOM 1199 CD1 TRP A 701 -23.199 -3.781 4.294 1.00 0.00 C ATOM 1200 CD2 TRP A 701 -21.460 -4.140 5.611 1.00 0.00 C ATOM 1201 NE1 TRP A 701 -23.389 -4.982 4.902 1.00 0.00 N ATOM 1202 CE2 TRP A 701 -22.337 -5.229 5.726 1.00 0.00 C ATOM 1203 CE3 TRP A 701 -20.294 -4.141 6.347 1.00 0.00 C ATOM 1204 CZ2 TRP A 701 -22.075 -6.310 6.551 1.00 0.00 C ATOM 1205 CZ3 TRP A 701 -20.028 -5.200 7.159 1.00 0.00 C ATOM 1206 CH2 TRP A 701 -20.916 -6.278 7.261 1.00 0.00 C ATOM 0 H TRP A 701 -20.532 -3.901 2.147 1.00 0.00 H new ATOM 0 HA TRP A 701 -20.584 -1.041 2.514 1.00 0.00 H new ATOM 0 HB2 TRP A 701 -20.938 -1.452 5.026 1.00 0.00 H new ATOM 0 HB3 TRP A 701 -22.329 -1.252 3.979 1.00 0.00 H new ATOM 0 HD1 TRP A 701 -23.885 -3.334 3.590 1.00 0.00 H new ATOM 0 HE1 TRP A 701 -24.190 -5.597 4.762 1.00 0.00 H new ATOM 0 HE3 TRP A 701 -19.603 -3.314 6.280 1.00 0.00 H new ATOM 0 HZ2 TRP A 701 -22.761 -7.141 6.627 1.00 0.00 H new ATOM 0 HZ3 TRP A 701 -19.115 -5.209 7.736 1.00 0.00 H new ATOM 0 HH2 TRP A 701 -20.675 -7.101 7.917 1.00 0.00 H new ATOM 1217 N ALA A 702 -18.696 -2.047 4.480 1.00 0.00 N ATOM 1218 CA ALA A 702 -17.303 -2.210 4.766 1.00 0.00 C ATOM 1219 C ALA A 702 -17.053 -2.691 6.186 1.00 0.00 C ATOM 1220 O ALA A 702 -17.827 -2.393 7.091 1.00 0.00 O ATOM 1221 CB ALA A 702 -16.648 -0.892 4.520 1.00 0.00 C ATOM 0 H ALA A 702 -19.245 -1.625 5.229 1.00 0.00 H new ATOM 0 HA ALA A 702 -16.884 -2.982 4.120 1.00 0.00 H new ATOM 0 HB1 ALA A 702 -15.581 -0.972 4.727 1.00 0.00 H new ATOM 0 HB2 ALA A 702 -16.795 -0.601 3.480 1.00 0.00 H new ATOM 0 HB3 ALA A 702 -17.089 -0.139 5.173 1.00 0.00 H new ATOM 1227 N GLN A 703 -15.959 -3.416 6.374 1.00 0.00 N ATOM 1228 CA GLN A 703 -15.612 -3.946 7.694 1.00 0.00 C ATOM 1229 C GLN A 703 -14.873 -2.916 8.505 1.00 0.00 C ATOM 1230 O GLN A 703 -15.158 -2.716 9.680 1.00 0.00 O ATOM 1231 CB GLN A 703 -14.786 -5.254 7.642 1.00 0.00 C ATOM 1232 CG GLN A 703 -15.583 -6.519 7.323 1.00 0.00 C ATOM 1233 CD GLN A 703 -15.425 -7.046 5.905 1.00 0.00 C ATOM 1234 OE1 GLN A 703 -15.159 -6.192 4.969 1.00 0.00 O flip ATOM 1235 NE2 GLN A 703 -15.530 -8.240 5.667 1.00 0.00 N flip ATOM 0 H GLN A 703 -15.296 -3.652 5.635 1.00 0.00 H new ATOM 0 HA GLN A 703 -16.561 -4.189 8.172 1.00 0.00 H new ATOM 0 HB2 GLN A 703 -14.003 -5.140 6.893 1.00 0.00 H new ATOM 0 HB3 GLN A 703 -14.290 -5.390 8.603 1.00 0.00 H new ATOM 0 HG2 GLN A 703 -15.284 -7.302 8.020 1.00 0.00 H new ATOM 0 HG3 GLN A 703 -16.639 -6.318 7.503 1.00 0.00 H new ATOM 0 HE21 GLN A 703 -15.740 -8.894 6.421 1.00 0.00 H new ATOM 0 HE22 GLN A 703 -15.407 -8.583 4.714 1.00 0.00 H new ATOM 1244 N LEU A 704 -13.949 -2.246 7.871 1.00 0.00 N ATOM 1245 CA LEU A 704 -13.157 -1.252 8.531 1.00 0.00 C ATOM 1246 C LEU A 704 -13.162 0.036 7.747 1.00 0.00 C ATOM 1247 O LEU A 704 -13.294 0.022 6.514 1.00 0.00 O ATOM 1248 CB LEU A 704 -11.717 -1.777 8.825 1.00 0.00 C ATOM 1249 CG LEU A 704 -10.874 -2.350 7.647 1.00 0.00 C ATOM 1250 CD1 LEU A 704 -10.360 -1.267 6.704 1.00 0.00 C ATOM 1251 CD2 LEU A 704 -9.716 -3.175 8.181 1.00 0.00 C ATOM 0 H LEU A 704 -13.727 -2.376 6.884 1.00 0.00 H new ATOM 0 HA LEU A 704 -13.605 -1.036 9.501 1.00 0.00 H new ATOM 0 HB2 LEU A 704 -11.151 -0.958 9.269 1.00 0.00 H new ATOM 0 HB3 LEU A 704 -11.798 -2.556 9.583 1.00 0.00 H new ATOM 0 HG LEU A 704 -11.539 -2.987 7.064 1.00 0.00 H new ATOM 0 HD11 LEU A 704 -9.780 -1.727 5.904 1.00 0.00 H new ATOM 0 HD12 LEU A 704 -11.204 -0.727 6.276 1.00 0.00 H new ATOM 0 HD13 LEU A 704 -9.728 -0.573 7.258 1.00 0.00 H new ATOM 0 HD21 LEU A 704 -9.135 -3.569 7.347 1.00 0.00 H new ATOM 0 HD22 LEU A 704 -9.078 -2.547 8.803 1.00 0.00 H new ATOM 0 HD23 LEU A 704 -10.103 -4.002 8.777 1.00 0.00 H new ATOM 1263 N SER A 705 -13.079 1.117 8.451 1.00 0.00 N ATOM 1264 CA SER A 705 -13.002 2.420 7.873 1.00 0.00 C ATOM 1265 C SER A 705 -11.788 3.142 8.423 1.00 0.00 C ATOM 1266 O SER A 705 -11.645 3.297 9.638 1.00 0.00 O ATOM 1267 CB SER A 705 -14.296 3.180 8.156 1.00 0.00 C ATOM 1268 OG SER A 705 -14.707 3.023 9.508 1.00 0.00 O ATOM 0 H SER A 705 -13.062 1.119 9.471 1.00 0.00 H new ATOM 0 HA SER A 705 -12.888 2.351 6.791 1.00 0.00 H new ATOM 0 HB2 SER A 705 -14.153 4.238 7.939 1.00 0.00 H new ATOM 0 HB3 SER A 705 -15.082 2.822 7.492 1.00 0.00 H new ATOM 0 HG SER A 705 -13.920 3.027 10.092 1.00 0.00 H new ATOM 1274 N SER A 706 -10.907 3.544 7.559 1.00 0.00 N ATOM 1275 CA SER A 706 -9.682 4.177 7.977 1.00 0.00 C ATOM 1276 C SER A 706 -9.487 5.586 7.391 1.00 0.00 C ATOM 1277 O SER A 706 -8.902 5.762 6.327 1.00 0.00 O ATOM 1278 CB SER A 706 -8.525 3.245 7.657 1.00 0.00 C ATOM 1279 OG SER A 706 -8.739 2.640 6.379 1.00 0.00 O ATOM 0 H SER A 706 -11.010 3.446 6.549 1.00 0.00 H new ATOM 0 HA SER A 706 -9.728 4.344 9.053 1.00 0.00 H new ATOM 0 HB2 SER A 706 -7.587 3.800 7.656 1.00 0.00 H new ATOM 0 HB3 SER A 706 -8.440 2.477 8.425 1.00 0.00 H new ATOM 0 HG SER A 706 -7.898 2.632 5.876 1.00 0.00 H new ATOM 1285 N PRO A 707 -10.047 6.599 8.049 1.00 0.00 N ATOM 1286 CA PRO A 707 -9.879 7.975 7.664 1.00 0.00 C ATOM 1287 C PRO A 707 -8.689 8.633 8.392 1.00 0.00 C ATOM 1288 O PRO A 707 -8.400 8.304 9.533 1.00 0.00 O ATOM 1289 CB PRO A 707 -11.196 8.619 8.076 1.00 0.00 C ATOM 1290 CG PRO A 707 -11.912 7.582 8.915 1.00 0.00 C ATOM 1291 CD PRO A 707 -10.934 6.489 9.188 1.00 0.00 C ATOM 0 HA PRO A 707 -9.658 8.087 6.603 1.00 0.00 H new ATOM 0 HB2 PRO A 707 -11.024 9.533 8.645 1.00 0.00 H new ATOM 0 HB3 PRO A 707 -11.788 8.894 7.203 1.00 0.00 H new ATOM 0 HG2 PRO A 707 -12.270 8.020 9.847 1.00 0.00 H new ATOM 0 HG3 PRO A 707 -12.785 7.196 8.388 1.00 0.00 H new ATOM 0 HD2 PRO A 707 -10.409 6.636 10.132 1.00 0.00 H new ATOM 0 HD3 PRO A 707 -11.415 5.512 9.240 1.00 0.00 H new ATOM 1299 N PRO A 708 -7.988 9.562 7.747 1.00 0.00 N ATOM 1300 CA PRO A 708 -8.292 9.984 6.390 1.00 0.00 C ATOM 1301 C PRO A 708 -7.905 8.917 5.375 1.00 0.00 C ATOM 1302 O PRO A 708 -6.788 8.362 5.414 1.00 0.00 O ATOM 1303 CB PRO A 708 -7.452 11.244 6.218 1.00 0.00 C ATOM 1304 CG PRO A 708 -6.301 11.054 7.131 1.00 0.00 C ATOM 1305 CD PRO A 708 -6.818 10.267 8.299 1.00 0.00 C ATOM 0 HA PRO A 708 -9.356 10.156 6.228 1.00 0.00 H new ATOM 0 HB2 PRO A 708 -7.123 11.363 5.186 1.00 0.00 H new ATOM 0 HB3 PRO A 708 -8.020 12.137 6.477 1.00 0.00 H new ATOM 0 HG2 PRO A 708 -5.491 10.522 6.631 1.00 0.00 H new ATOM 0 HG3 PRO A 708 -5.899 12.014 7.456 1.00 0.00 H new ATOM 0 HD2 PRO A 708 -6.070 9.570 8.676 1.00 0.00 H new ATOM 0 HD3 PRO A 708 -7.095 10.916 9.129 1.00 0.00 H new ATOM 1313 N TYR A 709 -8.836 8.603 4.503 1.00 0.00 N ATOM 1314 CA TYR A 709 -8.619 7.586 3.495 1.00 0.00 C ATOM 1315 C TYR A 709 -7.774 8.185 2.381 1.00 0.00 C ATOM 1316 O TYR A 709 -8.318 8.719 1.401 1.00 0.00 O ATOM 1317 CB TYR A 709 -9.946 7.087 2.882 1.00 0.00 C ATOM 1318 CG TYR A 709 -11.050 6.724 3.850 1.00 0.00 C ATOM 1319 CD1 TYR A 709 -11.877 7.694 4.345 1.00 0.00 C ATOM 1320 CD2 TYR A 709 -11.296 5.412 4.216 1.00 0.00 C ATOM 1321 CE1 TYR A 709 -12.917 7.399 5.174 1.00 0.00 C ATOM 1322 CE2 TYR A 709 -12.339 5.098 5.059 1.00 0.00 C ATOM 1323 CZ TYR A 709 -13.153 6.100 5.532 1.00 0.00 C ATOM 1324 OH TYR A 709 -14.214 5.797 6.359 1.00 0.00 O ATOM 0 H TYR A 709 -9.757 9.040 4.470 1.00 0.00 H new ATOM 0 HA TYR A 709 -8.122 6.740 3.969 1.00 0.00 H new ATOM 0 HB2 TYR A 709 -10.322 7.860 2.212 1.00 0.00 H new ATOM 0 HB3 TYR A 709 -9.729 6.212 2.270 1.00 0.00 H new ATOM 0 HD1 TYR A 709 -11.701 8.724 4.071 1.00 0.00 H new ATOM 0 HD2 TYR A 709 -10.662 4.625 3.836 1.00 0.00 H new ATOM 0 HE1 TYR A 709 -13.553 8.188 5.547 1.00 0.00 H new ATOM 0 HE2 TYR A 709 -12.516 4.072 5.346 1.00 0.00 H new ATOM 0 HH TYR A 709 -15.052 5.873 5.857 1.00 0.00 H new ATOM 1334 N TYR A 710 -6.481 8.190 2.566 1.00 0.00 N ATOM 1335 CA TYR A 710 -5.577 8.717 1.576 1.00 0.00 C ATOM 1336 C TYR A 710 -5.278 7.715 0.523 1.00 0.00 C ATOM 1337 O TYR A 710 -5.603 6.526 0.658 1.00 0.00 O ATOM 1338 CB TYR A 710 -4.267 9.178 2.176 1.00 0.00 C ATOM 1339 CG TYR A 710 -4.265 10.581 2.684 1.00 0.00 C ATOM 1340 CD1 TYR A 710 -4.661 10.890 3.963 1.00 0.00 C ATOM 1341 CD2 TYR A 710 -3.863 11.604 1.861 1.00 0.00 C ATOM 1342 CE1 TYR A 710 -4.653 12.198 4.408 1.00 0.00 C ATOM 1343 CE2 TYR A 710 -3.857 12.898 2.293 1.00 0.00 C ATOM 1344 CZ TYR A 710 -4.252 13.195 3.564 1.00 0.00 C ATOM 1345 OH TYR A 710 -4.255 14.505 3.989 1.00 0.00 O ATOM 0 H TYR A 710 -6.024 7.830 3.404 1.00 0.00 H new ATOM 0 HA TYR A 710 -6.089 9.575 1.140 1.00 0.00 H new ATOM 0 HB2 TYR A 710 -4.006 8.510 2.997 1.00 0.00 H new ATOM 0 HB3 TYR A 710 -3.485 9.079 1.423 1.00 0.00 H new ATOM 0 HD1 TYR A 710 -4.982 10.102 4.628 1.00 0.00 H new ATOM 0 HD2 TYR A 710 -3.546 11.380 0.853 1.00 0.00 H new ATOM 0 HE1 TYR A 710 -4.962 12.431 5.416 1.00 0.00 H new ATOM 0 HE2 TYR A 710 -3.539 13.688 1.628 1.00 0.00 H new ATOM 0 HH TYR A 710 -3.940 15.085 3.264 1.00 0.00 H new ATOM 1355 N TYR A 711 -4.659 8.191 -0.525 1.00 0.00 N ATOM 1356 CA TYR A 711 -4.221 7.363 -1.606 1.00 0.00 C ATOM 1357 C TYR A 711 -3.239 6.335 -1.048 1.00 0.00 C ATOM 1358 O TYR A 711 -2.268 6.690 -0.385 1.00 0.00 O ATOM 1359 CB TYR A 711 -3.535 8.241 -2.666 1.00 0.00 C ATOM 1360 CG TYR A 711 -3.058 7.538 -3.937 1.00 0.00 C ATOM 1361 CD1 TYR A 711 -2.095 6.526 -3.911 1.00 0.00 C ATOM 1362 CD2 TYR A 711 -3.567 7.899 -5.150 1.00 0.00 C ATOM 1363 CE1 TYR A 711 -1.670 5.912 -5.060 1.00 0.00 C ATOM 1364 CE2 TYR A 711 -3.153 7.289 -6.311 1.00 0.00 C ATOM 1365 CZ TYR A 711 -2.205 6.298 -6.263 1.00 0.00 C ATOM 1366 OH TYR A 711 -1.807 5.682 -7.423 1.00 0.00 O ATOM 0 H TYR A 711 -4.444 9.180 -0.649 1.00 0.00 H new ATOM 0 HA TYR A 711 -5.063 6.850 -2.071 1.00 0.00 H new ATOM 0 HB2 TYR A 711 -4.229 9.031 -2.954 1.00 0.00 H new ATOM 0 HB3 TYR A 711 -2.676 8.725 -2.202 1.00 0.00 H new ATOM 0 HD1 TYR A 711 -1.676 6.221 -2.964 1.00 0.00 H new ATOM 0 HD2 TYR A 711 -4.311 8.680 -5.200 1.00 0.00 H new ATOM 0 HE1 TYR A 711 -0.923 5.133 -5.019 1.00 0.00 H new ATOM 0 HE2 TYR A 711 -3.573 7.590 -7.259 1.00 0.00 H new ATOM 0 HH TYR A 711 -2.285 6.075 -8.183 1.00 0.00 H new ATOM 1376 N GLY A 712 -3.497 5.092 -1.322 1.00 0.00 N ATOM 1377 CA GLY A 712 -2.644 4.045 -0.838 1.00 0.00 C ATOM 1378 C GLY A 712 -3.239 3.312 0.340 1.00 0.00 C ATOM 1379 O GLY A 712 -2.846 2.173 0.628 1.00 0.00 O ATOM 0 H GLY A 712 -4.291 4.776 -1.878 1.00 0.00 H new ATOM 0 HA2 GLY A 712 -2.452 3.336 -1.643 1.00 0.00 H new ATOM 0 HA3 GLY A 712 -1.682 4.469 -0.550 1.00 0.00 H new ATOM 1383 N ASP A 713 -4.190 3.933 1.028 1.00 0.00 N ATOM 1384 CA ASP A 713 -4.842 3.268 2.154 1.00 0.00 C ATOM 1385 C ASP A 713 -5.814 2.233 1.594 1.00 0.00 C ATOM 1386 O ASP A 713 -6.088 2.207 0.372 1.00 0.00 O ATOM 1387 CB ASP A 713 -5.567 4.265 3.084 1.00 0.00 C ATOM 1388 CG ASP A 713 -5.803 3.718 4.489 1.00 0.00 C ATOM 1389 OD1 ASP A 713 -6.691 2.884 4.679 1.00 0.00 O ATOM 1390 OD2 ASP A 713 -5.060 4.099 5.426 1.00 0.00 O ATOM 0 H ASP A 713 -4.523 4.877 0.833 1.00 0.00 H new ATOM 0 HA ASP A 713 -4.084 2.783 2.769 1.00 0.00 H new ATOM 0 HB2 ASP A 713 -4.980 5.181 3.152 1.00 0.00 H new ATOM 0 HB3 ASP A 713 -6.526 4.534 2.640 1.00 0.00 H new ATOM 1395 N SER A 714 -6.344 1.408 2.425 1.00 0.00 N ATOM 1396 CA SER A 714 -7.141 0.297 1.961 1.00 0.00 C ATOM 1397 C SER A 714 -8.346 0.101 2.816 1.00 0.00 C ATOM 1398 O SER A 714 -8.319 0.325 4.016 1.00 0.00 O ATOM 1399 CB SER A 714 -6.351 -0.981 2.017 1.00 0.00 C ATOM 1400 OG SER A 714 -5.006 -0.771 1.572 1.00 0.00 O ATOM 0 H SER A 714 -6.247 1.471 3.438 1.00 0.00 H new ATOM 0 HA SER A 714 -7.436 0.530 0.938 1.00 0.00 H new ATOM 0 HB2 SER A 714 -6.345 -1.365 3.037 1.00 0.00 H new ATOM 0 HB3 SER A 714 -6.830 -1.737 1.395 1.00 0.00 H new ATOM 0 HG SER A 714 -4.510 -1.615 1.618 1.00 0.00 H new ATOM 1406 N VAL A 715 -9.367 -0.369 2.211 1.00 0.00 N ATOM 1407 CA VAL A 715 -10.563 -0.671 2.889 1.00 0.00 C ATOM 1408 C VAL A 715 -11.019 -2.040 2.487 1.00 0.00 C ATOM 1409 O VAL A 715 -10.811 -2.448 1.364 1.00 0.00 O ATOM 1410 CB VAL A 715 -11.665 0.386 2.625 1.00 0.00 C ATOM 1411 CG1 VAL A 715 -12.978 -0.121 3.097 1.00 0.00 C ATOM 1412 CG2 VAL A 715 -11.359 1.651 3.376 1.00 0.00 C ATOM 0 H VAL A 715 -9.395 -0.558 1.209 1.00 0.00 H new ATOM 0 HA VAL A 715 -10.370 -0.651 3.962 1.00 0.00 H new ATOM 0 HB VAL A 715 -11.698 0.583 1.553 1.00 0.00 H new ATOM 0 HG11 VAL A 715 -13.747 0.628 2.908 1.00 0.00 H new ATOM 0 HG12 VAL A 715 -13.227 -1.039 2.564 1.00 0.00 H new ATOM 0 HG13 VAL A 715 -12.926 -0.325 4.166 1.00 0.00 H new ATOM 0 HG21 VAL A 715 -12.140 2.387 3.183 1.00 0.00 H new ATOM 0 HG22 VAL A 715 -11.316 1.439 4.444 1.00 0.00 H new ATOM 0 HG23 VAL A 715 -10.398 2.047 3.046 1.00 0.00 H new ATOM 1422 N GLU A 716 -11.562 -2.762 3.408 1.00 0.00 N ATOM 1423 CA GLU A 716 -12.089 -4.045 3.108 1.00 0.00 C ATOM 1424 C GLU A 716 -13.605 -4.005 3.198 1.00 0.00 C ATOM 1425 O GLU A 716 -14.178 -3.646 4.246 1.00 0.00 O ATOM 1426 CB GLU A 716 -11.484 -5.105 4.005 1.00 0.00 C ATOM 1427 CG GLU A 716 -9.959 -5.132 3.919 1.00 0.00 C ATOM 1428 CD GLU A 716 -9.336 -6.306 4.606 1.00 0.00 C ATOM 1429 OE1 GLU A 716 -9.163 -6.275 5.823 1.00 0.00 O ATOM 1430 OE2 GLU A 716 -9.014 -7.307 3.927 1.00 0.00 O ATOM 0 H GLU A 716 -11.652 -2.479 4.384 1.00 0.00 H new ATOM 0 HA GLU A 716 -11.820 -4.318 2.087 1.00 0.00 H new ATOM 0 HB2 GLU A 716 -11.785 -4.921 5.036 1.00 0.00 H new ATOM 0 HB3 GLU A 716 -11.879 -6.082 3.727 1.00 0.00 H new ATOM 0 HG2 GLU A 716 -9.664 -5.138 2.870 1.00 0.00 H new ATOM 0 HG3 GLU A 716 -9.563 -4.215 4.356 1.00 0.00 H new ATOM 1437 N PHE A 717 -14.231 -4.354 2.112 1.00 0.00 N ATOM 1438 CA PHE A 717 -15.667 -4.332 1.947 1.00 0.00 C ATOM 1439 C PHE A 717 -16.270 -5.675 2.226 1.00 0.00 C ATOM 1440 O PHE A 717 -15.575 -6.675 2.274 1.00 0.00 O ATOM 1441 CB PHE A 717 -16.038 -3.880 0.528 1.00 0.00 C ATOM 1442 CG PHE A 717 -16.386 -2.436 0.421 1.00 0.00 C ATOM 1443 CD1 PHE A 717 -15.559 -1.459 0.934 1.00 0.00 C ATOM 1444 CD2 PHE A 717 -17.575 -2.061 -0.169 1.00 0.00 C ATOM 1445 CE1 PHE A 717 -15.925 -0.133 0.850 1.00 0.00 C ATOM 1446 CE2 PHE A 717 -17.940 -0.749 -0.250 1.00 0.00 C ATOM 1447 CZ PHE A 717 -17.118 0.210 0.256 1.00 0.00 C ATOM 0 H PHE A 717 -13.740 -4.676 1.278 1.00 0.00 H new ATOM 0 HA PHE A 717 -16.070 -3.620 2.667 1.00 0.00 H new ATOM 0 HB2 PHE A 717 -15.202 -4.092 -0.139 1.00 0.00 H new ATOM 0 HB3 PHE A 717 -16.883 -4.473 0.179 1.00 0.00 H new ATOM 0 HD1 PHE A 717 -14.625 -1.733 1.401 1.00 0.00 H new ATOM 0 HD2 PHE A 717 -18.229 -2.819 -0.574 1.00 0.00 H new ATOM 0 HE1 PHE A 717 -15.278 0.634 1.249 1.00 0.00 H new ATOM 0 HE2 PHE A 717 -18.876 -0.473 -0.713 1.00 0.00 H new ATOM 0 HZ PHE A 717 -17.404 1.249 0.191 1.00 0.00 H new ATOM 1457 N ASN A 718 -17.531 -5.681 2.477 1.00 0.00 N ATOM 1458 CA ASN A 718 -18.271 -6.891 2.707 1.00 0.00 C ATOM 1459 C ASN A 718 -19.671 -6.668 2.248 1.00 0.00 C ATOM 1460 O ASN A 718 -20.163 -5.557 2.303 1.00 0.00 O ATOM 1461 CB ASN A 718 -18.271 -7.298 4.191 1.00 0.00 C ATOM 1462 CG ASN A 718 -18.956 -8.638 4.425 1.00 0.00 C ATOM 1463 OD1 ASN A 718 -18.959 -9.505 3.549 1.00 0.00 O ATOM 1464 ND2 ASN A 718 -19.497 -8.840 5.590 1.00 0.00 N ATOM 0 H ASN A 718 -18.097 -4.834 2.531 1.00 0.00 H new ATOM 0 HA ASN A 718 -17.798 -7.702 2.154 1.00 0.00 H new ATOM 0 HB2 ASN A 718 -17.243 -7.351 4.551 1.00 0.00 H new ATOM 0 HB3 ASN A 718 -18.775 -6.528 4.776 1.00 0.00 H new ATOM 0 HD21 ASN A 718 -19.939 -9.735 5.799 1.00 0.00 H new ATOM 0 HD22 ASN A 718 -19.479 -8.103 6.295 1.00 0.00 H new ATOM 1471 N CYS A 719 -20.280 -7.679 1.780 1.00 0.00 N ATOM 1472 CA CYS A 719 -21.641 -7.601 1.335 1.00 0.00 C ATOM 1473 C CYS A 719 -22.573 -7.944 2.482 1.00 0.00 C ATOM 1474 O CYS A 719 -22.115 -8.451 3.521 1.00 0.00 O ATOM 1475 CB CYS A 719 -21.848 -8.528 0.133 1.00 0.00 C ATOM 1476 SG CYS A 719 -20.968 -7.974 -1.356 1.00 0.00 S ATOM 0 H CYS A 719 -19.859 -8.603 1.686 1.00 0.00 H new ATOM 0 HA CYS A 719 -21.870 -6.585 1.012 1.00 0.00 H new ATOM 0 HB2 CYS A 719 -21.512 -9.531 0.394 1.00 0.00 H new ATOM 0 HB3 CYS A 719 -22.914 -8.596 -0.086 1.00 0.00 H new ATOM 1481 N SER A 720 -23.861 -7.621 2.321 1.00 0.00 N ATOM 1482 CA SER A 720 -24.889 -7.953 3.295 1.00 0.00 C ATOM 1483 C SER A 720 -24.791 -9.439 3.639 1.00 0.00 C ATOM 1484 O SER A 720 -24.441 -10.247 2.786 1.00 0.00 O ATOM 1485 CB SER A 720 -26.276 -7.602 2.711 1.00 0.00 C ATOM 1486 OG SER A 720 -27.348 -7.916 3.602 1.00 0.00 O ATOM 0 H SER A 720 -24.214 -7.120 1.506 1.00 0.00 H new ATOM 0 HA SER A 720 -24.748 -7.378 4.210 1.00 0.00 H new ATOM 0 HB2 SER A 720 -26.307 -6.539 2.474 1.00 0.00 H new ATOM 0 HB3 SER A 720 -26.418 -8.142 1.775 1.00 0.00 H new ATOM 0 HG SER A 720 -28.201 -7.673 3.185 1.00 0.00 H new ATOM 1492 N GLU A 721 -25.106 -9.780 4.867 1.00 0.00 N ATOM 1493 CA GLU A 721 -24.926 -11.123 5.401 1.00 0.00 C ATOM 1494 C GLU A 721 -25.636 -12.213 4.560 1.00 0.00 C ATOM 1495 O GLU A 721 -25.134 -13.335 4.432 1.00 0.00 O ATOM 1496 CB GLU A 721 -25.348 -11.131 6.872 1.00 0.00 C ATOM 1497 CG GLU A 721 -25.122 -12.429 7.616 1.00 0.00 C ATOM 1498 CD GLU A 721 -25.295 -12.240 9.096 1.00 0.00 C ATOM 1499 OE1 GLU A 721 -26.437 -12.149 9.576 1.00 0.00 O ATOM 1500 OE2 GLU A 721 -24.280 -12.128 9.814 1.00 0.00 O ATOM 0 H GLU A 721 -25.502 -9.124 5.540 1.00 0.00 H new ATOM 0 HA GLU A 721 -23.870 -11.386 5.337 1.00 0.00 H new ATOM 0 HB2 GLU A 721 -24.807 -10.339 7.390 1.00 0.00 H new ATOM 0 HB3 GLU A 721 -26.408 -10.882 6.928 1.00 0.00 H new ATOM 0 HG2 GLU A 721 -25.822 -13.184 7.258 1.00 0.00 H new ATOM 0 HG3 GLU A 721 -24.119 -12.801 7.408 1.00 0.00 H new ATOM 1507 N SER A 722 -26.742 -11.862 3.941 1.00 0.00 N ATOM 1508 CA SER A 722 -27.483 -12.797 3.104 1.00 0.00 C ATOM 1509 C SER A 722 -27.068 -12.690 1.605 1.00 0.00 C ATOM 1510 O SER A 722 -27.725 -13.250 0.716 1.00 0.00 O ATOM 1511 CB SER A 722 -28.973 -12.539 3.280 1.00 0.00 C ATOM 1512 OG SER A 722 -29.324 -12.596 4.660 1.00 0.00 O ATOM 0 H SER A 722 -27.155 -10.931 3.999 1.00 0.00 H new ATOM 0 HA SER A 722 -27.247 -13.814 3.418 1.00 0.00 H new ATOM 0 HB2 SER A 722 -29.231 -11.562 2.872 1.00 0.00 H new ATOM 0 HB3 SER A 722 -29.546 -13.279 2.721 1.00 0.00 H new ATOM 0 HG SER A 722 -30.284 -12.427 4.761 1.00 0.00 H new ATOM 1518 N PHE A 723 -25.989 -11.979 1.340 1.00 0.00 N ATOM 1519 CA PHE A 723 -25.456 -11.819 -0.001 1.00 0.00 C ATOM 1520 C PHE A 723 -23.999 -12.194 0.004 1.00 0.00 C ATOM 1521 O PHE A 723 -23.341 -12.130 1.034 1.00 0.00 O ATOM 1522 CB PHE A 723 -25.614 -10.370 -0.507 1.00 0.00 C ATOM 1523 CG PHE A 723 -27.032 -9.942 -0.755 1.00 0.00 C ATOM 1524 CD1 PHE A 723 -27.852 -9.533 0.280 1.00 0.00 C ATOM 1525 CD2 PHE A 723 -27.541 -9.953 -2.033 1.00 0.00 C ATOM 1526 CE1 PHE A 723 -29.150 -9.146 0.038 1.00 0.00 C ATOM 1527 CE2 PHE A 723 -28.832 -9.570 -2.284 1.00 0.00 C ATOM 1528 CZ PHE A 723 -29.643 -9.164 -1.248 1.00 0.00 C ATOM 0 H PHE A 723 -25.452 -11.491 2.056 1.00 0.00 H new ATOM 0 HA PHE A 723 -26.016 -12.469 -0.673 1.00 0.00 H new ATOM 0 HB2 PHE A 723 -25.167 -9.694 0.222 1.00 0.00 H new ATOM 0 HB3 PHE A 723 -25.048 -10.259 -1.432 1.00 0.00 H new ATOM 0 HD1 PHE A 723 -27.470 -9.517 1.290 1.00 0.00 H new ATOM 0 HD2 PHE A 723 -26.912 -10.269 -2.852 1.00 0.00 H new ATOM 0 HE1 PHE A 723 -29.781 -8.829 0.855 1.00 0.00 H new ATOM 0 HE2 PHE A 723 -29.214 -9.586 -3.294 1.00 0.00 H new ATOM 0 HZ PHE A 723 -30.661 -8.861 -1.443 1.00 0.00 H new ATOM 1538 N THR A 724 -23.507 -12.588 -1.109 1.00 0.00 N ATOM 1539 CA THR A 724 -22.136 -12.960 -1.224 1.00 0.00 C ATOM 1540 C THR A 724 -21.498 -12.052 -2.239 1.00 0.00 C ATOM 1541 O THR A 724 -22.174 -11.598 -3.171 1.00 0.00 O ATOM 1542 CB THR A 724 -21.981 -14.467 -1.623 1.00 0.00 C ATOM 1543 OG1 THR A 724 -20.598 -14.842 -1.727 1.00 0.00 O ATOM 1544 CG2 THR A 724 -22.701 -14.786 -2.930 1.00 0.00 C ATOM 0 H THR A 724 -24.041 -12.665 -1.975 1.00 0.00 H new ATOM 0 HA THR A 724 -21.638 -12.850 -0.261 1.00 0.00 H new ATOM 0 HB THR A 724 -22.444 -15.049 -0.826 1.00 0.00 H new ATOM 0 HG1 THR A 724 -20.533 -15.788 -1.975 1.00 0.00 H new ATOM 0 HG21 THR A 724 -22.568 -15.841 -3.170 1.00 0.00 H new ATOM 0 HG22 THR A 724 -23.764 -14.569 -2.822 1.00 0.00 H new ATOM 0 HG23 THR A 724 -22.286 -14.176 -3.732 1.00 0.00 H new ATOM 1552 N MET A 725 -20.262 -11.709 -2.036 1.00 0.00 N ATOM 1553 CA MET A 725 -19.584 -10.885 -2.968 1.00 0.00 C ATOM 1554 C MET A 725 -18.887 -11.739 -3.999 1.00 0.00 C ATOM 1555 O MET A 725 -18.663 -12.940 -3.799 1.00 0.00 O ATOM 1556 CB MET A 725 -18.557 -9.986 -2.292 1.00 0.00 C ATOM 1557 CG MET A 725 -17.260 -10.679 -1.896 1.00 0.00 C ATOM 1558 SD MET A 725 -15.973 -9.530 -1.369 1.00 0.00 S ATOM 1559 CE MET A 725 -16.861 -8.493 -0.217 1.00 0.00 C ATOM 0 H MET A 725 -19.708 -11.992 -1.228 1.00 0.00 H new ATOM 0 HA MET A 725 -20.332 -10.251 -3.444 1.00 0.00 H new ATOM 0 HB2 MET A 725 -18.320 -9.160 -2.963 1.00 0.00 H new ATOM 0 HB3 MET A 725 -19.007 -9.552 -1.399 1.00 0.00 H new ATOM 0 HG2 MET A 725 -17.463 -11.382 -1.088 1.00 0.00 H new ATOM 0 HG3 MET A 725 -16.894 -11.262 -2.741 1.00 0.00 H new ATOM 0 HE1 MET A 725 -16.160 -7.831 0.292 1.00 0.00 H new ATOM 0 HE2 MET A 725 -17.597 -7.897 -0.757 1.00 0.00 H new ATOM 0 HE3 MET A 725 -17.369 -9.118 0.518 1.00 0.00 H new ATOM 1569 N ILE A 726 -18.573 -11.123 -5.080 1.00 0.00 N ATOM 1570 CA ILE A 726 -17.826 -11.721 -6.150 1.00 0.00 C ATOM 1571 C ILE A 726 -16.610 -10.850 -6.368 1.00 0.00 C ATOM 1572 O ILE A 726 -16.745 -9.644 -6.620 1.00 0.00 O ATOM 1573 CB ILE A 726 -18.648 -11.796 -7.467 1.00 0.00 C ATOM 1574 CG1 ILE A 726 -20.002 -12.482 -7.232 1.00 0.00 C ATOM 1575 CG2 ILE A 726 -17.859 -12.535 -8.545 1.00 0.00 C ATOM 1576 CD1 ILE A 726 -20.889 -12.518 -8.460 1.00 0.00 C ATOM 0 H ILE A 726 -18.834 -10.153 -5.260 1.00 0.00 H new ATOM 0 HA ILE A 726 -17.561 -12.744 -5.883 1.00 0.00 H new ATOM 0 HB ILE A 726 -18.837 -10.778 -7.807 1.00 0.00 H new ATOM 0 HG12 ILE A 726 -19.828 -13.502 -6.891 1.00 0.00 H new ATOM 0 HG13 ILE A 726 -20.528 -11.963 -6.430 1.00 0.00 H new ATOM 0 HG21 ILE A 726 -18.448 -12.579 -9.461 1.00 0.00 H new ATOM 0 HG22 ILE A 726 -16.925 -12.007 -8.739 1.00 0.00 H new ATOM 0 HG23 ILE A 726 -17.639 -13.547 -8.206 1.00 0.00 H new ATOM 0 HD11 ILE A 726 -21.827 -13.017 -8.217 1.00 0.00 H new ATOM 0 HD12 ILE A 726 -21.095 -11.500 -8.790 1.00 0.00 H new ATOM 0 HD13 ILE A 726 -20.384 -13.063 -9.258 1.00 0.00 H new ATOM 1588 N GLY A 727 -15.458 -11.431 -6.270 1.00 0.00 N ATOM 1589 CA GLY A 727 -14.239 -10.696 -6.356 1.00 0.00 C ATOM 1590 C GLY A 727 -13.546 -10.744 -5.031 1.00 0.00 C ATOM 1591 O GLY A 727 -13.627 -11.755 -4.331 1.00 0.00 O ATOM 0 H GLY A 727 -15.336 -12.434 -6.127 1.00 0.00 H new ATOM 0 HA2 GLY A 727 -13.599 -11.118 -7.131 1.00 0.00 H new ATOM 0 HA3 GLY A 727 -14.442 -9.663 -6.638 1.00 0.00 H new ATOM 1595 N HIS A 728 -12.898 -9.680 -4.673 1.00 0.00 N ATOM 1596 CA HIS A 728 -12.241 -9.595 -3.401 1.00 0.00 C ATOM 1597 C HIS A 728 -12.836 -8.480 -2.607 1.00 0.00 C ATOM 1598 O HIS A 728 -13.554 -7.642 -3.157 1.00 0.00 O ATOM 1599 CB HIS A 728 -10.719 -9.443 -3.529 1.00 0.00 C ATOM 1600 CG HIS A 728 -10.209 -8.261 -4.292 1.00 0.00 C ATOM 1601 ND1 HIS A 728 -10.384 -6.954 -4.088 1.00 0.00 N flip ATOM 1602 CD2 HIS A 728 -9.350 -8.366 -5.362 1.00 0.00 C flip ATOM 1603 CE1 HIS A 728 -9.635 -6.282 -5.017 1.00 0.00 C flip ATOM 1604 NE2 HIS A 728 -9.020 -7.161 -5.775 1.00 0.00 N flip ATOM 0 H HIS A 728 -12.808 -8.845 -5.252 1.00 0.00 H new ATOM 0 HA HIS A 728 -12.402 -10.537 -2.876 1.00 0.00 H new ATOM 0 HB2 HIS A 728 -10.298 -9.403 -2.524 1.00 0.00 H new ATOM 0 HB3 HIS A 728 -10.329 -10.344 -4.002 1.00 0.00 H new ATOM 0 HD1 HIS A 728 -10.971 -6.531 -3.369 1.00 0.00 H new ATOM 0 HD2 HIS A 728 -9.001 -9.292 -5.795 1.00 0.00 H new ATOM 0 HE1 HIS A 728 -9.562 -5.209 -5.111 1.00 0.00 H new ATOM 1613 N ARG A 729 -12.491 -8.409 -1.363 1.00 0.00 N ATOM 1614 CA ARG A 729 -13.107 -7.470 -0.491 1.00 0.00 C ATOM 1615 C ARG A 729 -12.325 -6.184 -0.375 1.00 0.00 C ATOM 1616 O ARG A 729 -12.901 -5.126 -0.127 1.00 0.00 O ATOM 1617 CB ARG A 729 -13.305 -8.067 0.895 1.00 0.00 C ATOM 1618 CG ARG A 729 -12.045 -8.293 1.722 1.00 0.00 C ATOM 1619 CD ARG A 729 -12.388 -8.896 3.064 1.00 0.00 C ATOM 1620 NE ARG A 729 -11.277 -8.816 4.021 1.00 0.00 N ATOM 1621 CZ ARG A 729 -11.310 -9.251 5.289 1.00 0.00 C ATOM 1622 NH1 ARG A 729 -12.346 -9.928 5.746 1.00 0.00 N ATOM 1623 NH2 ARG A 729 -10.296 -8.992 6.096 1.00 0.00 N ATOM 0 H ARG A 729 -11.780 -8.996 -0.927 1.00 0.00 H new ATOM 0 HA ARG A 729 -14.075 -7.233 -0.932 1.00 0.00 H new ATOM 0 HB2 ARG A 729 -13.970 -7.411 1.458 1.00 0.00 H new ATOM 0 HB3 ARG A 729 -13.818 -9.023 0.785 1.00 0.00 H new ATOM 0 HG2 ARG A 729 -11.365 -8.953 1.184 1.00 0.00 H new ATOM 0 HG3 ARG A 729 -11.524 -7.347 1.866 1.00 0.00 H new ATOM 0 HD2 ARG A 729 -13.256 -8.383 3.477 1.00 0.00 H new ATOM 0 HD3 ARG A 729 -12.670 -9.940 2.927 1.00 0.00 H new ATOM 0 HE ARG A 729 -10.408 -8.394 3.694 1.00 0.00 H new ATOM 0 HH11 ARG A 729 -13.136 -10.127 5.132 1.00 0.00 H new ATOM 0 HH12 ARG A 729 -12.357 -10.252 6.713 1.00 0.00 H new ATOM 0 HH21 ARG A 729 -9.494 -8.464 5.753 1.00 0.00 H new ATOM 0 HH22 ARG A 729 -10.316 -9.320 7.061 1.00 0.00 H new ATOM 1637 N SER A 730 -11.040 -6.253 -0.543 1.00 0.00 N ATOM 1638 CA SER A 730 -10.237 -5.085 -0.291 1.00 0.00 C ATOM 1639 C SER A 730 -10.105 -4.135 -1.461 1.00 0.00 C ATOM 1640 O SER A 730 -10.139 -4.521 -2.616 1.00 0.00 O ATOM 1641 CB SER A 730 -8.905 -5.456 0.296 1.00 0.00 C ATOM 1642 OG SER A 730 -8.302 -6.524 -0.424 1.00 0.00 O ATOM 0 H SER A 730 -10.529 -7.082 -0.846 1.00 0.00 H new ATOM 0 HA SER A 730 -10.791 -4.512 0.452 1.00 0.00 H new ATOM 0 HB2 SER A 730 -8.245 -4.588 0.284 1.00 0.00 H new ATOM 0 HB3 SER A 730 -9.033 -5.744 1.339 1.00 0.00 H new ATOM 0 HG SER A 730 -7.436 -6.743 -0.021 1.00 0.00 H new ATOM 1648 N ILE A 731 -10.023 -2.883 -1.147 1.00 0.00 N ATOM 1649 CA ILE A 731 -9.833 -1.859 -2.119 1.00 0.00 C ATOM 1650 C ILE A 731 -8.710 -0.971 -1.687 1.00 0.00 C ATOM 1651 O ILE A 731 -8.257 -1.042 -0.546 1.00 0.00 O ATOM 1652 CB ILE A 731 -11.105 -1.020 -2.315 1.00 0.00 C ATOM 1653 CG1 ILE A 731 -11.587 -0.479 -0.960 1.00 0.00 C ATOM 1654 CG2 ILE A 731 -12.162 -1.829 -3.032 1.00 0.00 C ATOM 1655 CD1 ILE A 731 -12.905 0.203 -0.985 1.00 0.00 C ATOM 0 H ILE A 731 -10.088 -2.538 -0.189 1.00 0.00 H new ATOM 0 HA ILE A 731 -9.596 -2.334 -3.071 1.00 0.00 H new ATOM 0 HB ILE A 731 -10.887 -0.159 -2.947 1.00 0.00 H new ATOM 0 HG12 ILE A 731 -11.638 -1.307 -0.253 1.00 0.00 H new ATOM 0 HG13 ILE A 731 -10.842 0.219 -0.580 1.00 0.00 H new ATOM 0 HG21 ILE A 731 -13.058 -1.222 -3.164 1.00 0.00 H new ATOM 0 HG22 ILE A 731 -11.785 -2.137 -4.007 1.00 0.00 H new ATOM 0 HG23 ILE A 731 -12.406 -2.713 -2.442 1.00 0.00 H new ATOM 0 HD11 ILE A 731 -13.155 0.548 0.018 1.00 0.00 H new ATOM 0 HD12 ILE A 731 -12.860 1.056 -1.662 1.00 0.00 H new ATOM 0 HD13 ILE A 731 -13.669 -0.494 -1.330 1.00 0.00 H new ATOM 1667 N THR A 732 -8.271 -0.150 -2.562 1.00 0.00 N ATOM 1668 CA THR A 732 -7.212 0.759 -2.285 1.00 0.00 C ATOM 1669 C THR A 732 -7.565 2.106 -2.881 1.00 0.00 C ATOM 1670 O THR A 732 -8.137 2.166 -3.960 1.00 0.00 O ATOM 1671 CB THR A 732 -5.873 0.223 -2.847 1.00 0.00 C ATOM 1672 OG1 THR A 732 -5.554 -1.037 -2.203 1.00 0.00 O ATOM 1673 CG2 THR A 732 -4.747 1.213 -2.614 1.00 0.00 C ATOM 0 H THR A 732 -8.640 -0.084 -3.511 1.00 0.00 H new ATOM 0 HA THR A 732 -7.085 0.868 -1.208 1.00 0.00 H new ATOM 0 HB THR A 732 -5.982 0.077 -3.922 1.00 0.00 H new ATOM 0 HG1 THR A 732 -4.707 -1.380 -2.558 1.00 0.00 H new ATOM 0 HG21 THR A 732 -3.819 0.810 -3.019 1.00 0.00 H new ATOM 0 HG22 THR A 732 -4.981 2.154 -3.111 1.00 0.00 H new ATOM 0 HG23 THR A 732 -4.631 1.387 -1.544 1.00 0.00 H new ATOM 1681 N CYS A 733 -7.331 3.151 -2.128 1.00 0.00 N ATOM 1682 CA CYS A 733 -7.627 4.498 -2.562 1.00 0.00 C ATOM 1683 C CYS A 733 -6.675 4.917 -3.659 1.00 0.00 C ATOM 1684 O CYS A 733 -5.477 5.100 -3.415 1.00 0.00 O ATOM 1685 CB CYS A 733 -7.547 5.462 -1.383 1.00 0.00 C ATOM 1686 SG CYS A 733 -7.925 7.174 -1.816 1.00 0.00 S ATOM 0 H CYS A 733 -6.928 3.094 -1.193 1.00 0.00 H new ATOM 0 HA CYS A 733 -8.642 4.524 -2.960 1.00 0.00 H new ATOM 0 HB2 CYS A 733 -8.238 5.132 -0.608 1.00 0.00 H new ATOM 0 HB3 CYS A 733 -6.545 5.417 -0.956 1.00 0.00 H new ATOM 1691 N ILE A 734 -7.192 5.021 -4.867 1.00 0.00 N ATOM 1692 CA ILE A 734 -6.407 5.366 -6.024 1.00 0.00 C ATOM 1693 C ILE A 734 -6.986 6.601 -6.724 1.00 0.00 C ATOM 1694 O ILE A 734 -8.057 6.555 -7.314 1.00 0.00 O ATOM 1695 CB ILE A 734 -6.323 4.174 -7.034 1.00 0.00 C ATOM 1696 CG1 ILE A 734 -5.722 2.931 -6.355 1.00 0.00 C ATOM 1697 CG2 ILE A 734 -5.494 4.550 -8.257 1.00 0.00 C ATOM 1698 CD1 ILE A 734 -4.357 3.171 -5.770 1.00 0.00 C ATOM 0 H ILE A 734 -8.180 4.866 -5.070 1.00 0.00 H new ATOM 0 HA ILE A 734 -5.399 5.593 -5.677 1.00 0.00 H new ATOM 0 HB ILE A 734 -7.337 3.943 -7.362 1.00 0.00 H new ATOM 0 HG12 ILE A 734 -6.394 2.597 -5.565 1.00 0.00 H new ATOM 0 HG13 ILE A 734 -5.660 2.122 -7.083 1.00 0.00 H new ATOM 0 HG21 ILE A 734 -5.452 3.703 -8.942 1.00 0.00 H new ATOM 0 HG22 ILE A 734 -5.953 5.401 -8.760 1.00 0.00 H new ATOM 0 HG23 ILE A 734 -4.484 4.814 -7.945 1.00 0.00 H new ATOM 0 HD11 ILE A 734 -3.993 2.254 -5.307 1.00 0.00 H new ATOM 0 HD12 ILE A 734 -3.671 3.476 -6.560 1.00 0.00 H new ATOM 0 HD13 ILE A 734 -4.417 3.958 -5.018 1.00 0.00 H new ATOM 1710 N HIS A 735 -6.287 7.712 -6.590 1.00 0.00 N ATOM 1711 CA HIS A 735 -6.622 8.992 -7.243 1.00 0.00 C ATOM 1712 C HIS A 735 -7.894 9.621 -6.708 1.00 0.00 C ATOM 1713 O HIS A 735 -8.466 10.518 -7.326 1.00 0.00 O ATOM 1714 CB HIS A 735 -6.656 8.875 -8.781 1.00 0.00 C ATOM 1715 CG HIS A 735 -5.304 8.831 -9.428 1.00 0.00 C ATOM 1716 ND1 HIS A 735 -4.388 7.840 -9.525 1.00 0.00 N flip ATOM 1717 CD2 HIS A 735 -4.764 9.905 -10.081 1.00 0.00 C flip ATOM 1718 CE1 HIS A 735 -3.329 8.337 -10.222 1.00 0.00 C flip ATOM 1719 NE2 HIS A 735 -3.580 9.585 -10.548 1.00 0.00 N flip ATOM 0 H HIS A 735 -5.448 7.765 -6.013 1.00 0.00 H new ATOM 0 HA HIS A 735 -5.809 9.670 -6.984 1.00 0.00 H new ATOM 0 HB2 HIS A 735 -7.205 7.973 -9.053 1.00 0.00 H new ATOM 0 HB3 HIS A 735 -7.212 9.721 -9.186 1.00 0.00 H new ATOM 0 HD2 HIS A 735 -5.239 10.868 -10.195 1.00 0.00 H new ATOM 0 HE1 HIS A 735 -2.429 7.793 -10.467 1.00 0.00 H new ATOM 0 HE2 HIS A 735 -2.960 10.200 -11.075 1.00 0.00 H new ATOM 1728 N GLY A 736 -8.299 9.192 -5.538 1.00 0.00 N ATOM 1729 CA GLY A 736 -9.492 9.732 -4.933 1.00 0.00 C ATOM 1730 C GLY A 736 -10.679 8.829 -5.142 1.00 0.00 C ATOM 1731 O GLY A 736 -11.807 9.182 -4.791 1.00 0.00 O ATOM 0 H GLY A 736 -7.824 8.476 -4.989 1.00 0.00 H new ATOM 0 HA2 GLY A 736 -9.326 9.874 -3.865 1.00 0.00 H new ATOM 0 HA3 GLY A 736 -9.703 10.714 -5.357 1.00 0.00 H new ATOM 1735 N VAL A 737 -10.426 7.661 -5.710 1.00 0.00 N ATOM 1736 CA VAL A 737 -11.456 6.676 -5.960 1.00 0.00 C ATOM 1737 C VAL A 737 -10.892 5.344 -5.521 1.00 0.00 C ATOM 1738 O VAL A 737 -9.713 5.114 -5.671 1.00 0.00 O ATOM 1739 CB VAL A 737 -11.819 6.603 -7.487 1.00 0.00 C ATOM 1740 CG1 VAL A 737 -12.959 5.630 -7.752 1.00 0.00 C ATOM 1741 CG2 VAL A 737 -12.166 7.974 -8.036 1.00 0.00 C ATOM 0 H VAL A 737 -9.495 7.372 -6.010 1.00 0.00 H new ATOM 0 HA VAL A 737 -12.365 6.939 -5.419 1.00 0.00 H new ATOM 0 HB VAL A 737 -10.933 6.234 -8.004 1.00 0.00 H new ATOM 0 HG11 VAL A 737 -13.179 5.609 -8.819 1.00 0.00 H new ATOM 0 HG12 VAL A 737 -12.670 4.632 -7.422 1.00 0.00 H new ATOM 0 HG13 VAL A 737 -13.846 5.951 -7.205 1.00 0.00 H new ATOM 0 HG21 VAL A 737 -12.412 7.890 -9.094 1.00 0.00 H new ATOM 0 HG22 VAL A 737 -13.022 8.377 -7.495 1.00 0.00 H new ATOM 0 HG23 VAL A 737 -11.313 8.641 -7.914 1.00 0.00 H new ATOM 1751 N TRP A 738 -11.682 4.499 -4.946 1.00 0.00 N ATOM 1752 CA TRP A 738 -11.187 3.198 -4.558 1.00 0.00 C ATOM 1753 C TRP A 738 -11.053 2.321 -5.806 1.00 0.00 C ATOM 1754 O TRP A 738 -11.625 2.648 -6.855 1.00 0.00 O ATOM 1755 CB TRP A 738 -12.100 2.557 -3.531 1.00 0.00 C ATOM 1756 CG TRP A 738 -12.210 3.352 -2.254 1.00 0.00 C ATOM 1757 CD1 TRP A 738 -13.186 4.225 -1.908 1.00 0.00 C ATOM 1758 CD2 TRP A 738 -11.299 3.335 -1.163 1.00 0.00 C ATOM 1759 NE1 TRP A 738 -12.934 4.757 -0.672 1.00 0.00 N ATOM 1760 CE2 TRP A 738 -11.777 4.227 -0.199 1.00 0.00 C ATOM 1761 CE3 TRP A 738 -10.132 2.652 -0.915 1.00 0.00 C ATOM 1762 CZ2 TRP A 738 -11.111 4.451 0.987 1.00 0.00 C ATOM 1763 CZ3 TRP A 738 -9.467 2.867 0.258 1.00 0.00 C ATOM 1764 CH2 TRP A 738 -9.952 3.761 1.200 1.00 0.00 C ATOM 0 H TRP A 738 -12.664 4.672 -4.731 1.00 0.00 H new ATOM 0 HA TRP A 738 -10.207 3.307 -4.094 1.00 0.00 H new ATOM 0 HB2 TRP A 738 -13.094 2.436 -3.963 1.00 0.00 H new ATOM 0 HB3 TRP A 738 -11.730 1.558 -3.299 1.00 0.00 H new ATOM 0 HD1 TRP A 738 -14.042 4.467 -2.520 1.00 0.00 H new ATOM 0 HE1 TRP A 738 -13.518 5.438 -0.187 1.00 0.00 H new ATOM 0 HE3 TRP A 738 -9.745 1.952 -1.641 1.00 0.00 H new ATOM 0 HZ2 TRP A 738 -11.492 5.146 1.720 1.00 0.00 H new ATOM 0 HZ3 TRP A 738 -8.549 2.333 0.455 1.00 0.00 H new ATOM 0 HH2 TRP A 738 -9.404 3.914 2.118 1.00 0.00 H new ATOM 1775 N THR A 739 -10.301 1.240 -5.684 1.00 0.00 N ATOM 1776 CA THR A 739 -9.992 0.347 -6.801 1.00 0.00 C ATOM 1777 C THR A 739 -11.166 -0.041 -7.666 1.00 0.00 C ATOM 1778 O THR A 739 -11.300 0.452 -8.789 1.00 0.00 O ATOM 1779 CB THR A 739 -9.212 -0.903 -6.354 1.00 0.00 C ATOM 1780 OG1 THR A 739 -9.878 -1.552 -5.255 1.00 0.00 O ATOM 1781 CG2 THR A 739 -7.821 -0.532 -5.932 1.00 0.00 C ATOM 0 H THR A 739 -9.881 0.950 -4.801 1.00 0.00 H new ATOM 0 HA THR A 739 -9.351 0.956 -7.439 1.00 0.00 H new ATOM 0 HB THR A 739 -9.165 -1.587 -7.202 1.00 0.00 H new ATOM 0 HG1 THR A 739 -10.389 -2.319 -5.589 1.00 0.00 H new ATOM 0 HG21 THR A 739 -7.285 -1.428 -5.619 1.00 0.00 H new ATOM 0 HG22 THR A 739 -7.298 -0.069 -6.769 1.00 0.00 H new ATOM 0 HG23 THR A 739 -7.868 0.171 -5.101 1.00 0.00 H new ATOM 1789 N GLN A 740 -12.035 -0.863 -7.148 1.00 0.00 N ATOM 1790 CA GLN A 740 -13.088 -1.403 -7.977 1.00 0.00 C ATOM 1791 C GLN A 740 -14.273 -1.918 -7.229 1.00 0.00 C ATOM 1792 O GLN A 740 -15.389 -1.806 -7.726 1.00 0.00 O ATOM 1793 CB GLN A 740 -12.537 -2.446 -8.981 1.00 0.00 C ATOM 1794 CG GLN A 740 -11.427 -3.394 -8.445 1.00 0.00 C ATOM 1795 CD GLN A 740 -11.817 -4.257 -7.250 1.00 0.00 C ATOM 1796 OE1 GLN A 740 -11.470 -3.819 -6.060 1.00 0.00 O flip ATOM 1797 NE2 GLN A 740 -12.350 -5.344 -7.399 1.00 0.00 N flip ATOM 0 H GLN A 740 -12.041 -1.172 -6.176 1.00 0.00 H new ATOM 0 HA GLN A 740 -13.472 -0.552 -8.540 1.00 0.00 H new ATOM 0 HB2 GLN A 740 -13.369 -3.056 -9.332 1.00 0.00 H new ATOM 0 HB3 GLN A 740 -12.144 -1.914 -9.847 1.00 0.00 H new ATOM 0 HG2 GLN A 740 -11.112 -4.050 -9.256 1.00 0.00 H new ATOM 0 HG3 GLN A 740 -10.562 -2.791 -8.168 1.00 0.00 H new ATOM 0 HE21 GLN A 740 -12.610 -5.661 -8.333 1.00 0.00 H new ATOM 0 HE22 GLN A 740 -12.536 -5.936 -6.589 1.00 0.00 H new ATOM 1806 N LEU A 741 -14.029 -2.459 -6.036 1.00 0.00 N ATOM 1807 CA LEU A 741 -15.064 -3.090 -5.185 1.00 0.00 C ATOM 1808 C LEU A 741 -15.604 -4.369 -5.856 1.00 0.00 C ATOM 1809 O LEU A 741 -15.534 -4.534 -7.081 1.00 0.00 O ATOM 1810 CB LEU A 741 -16.209 -2.107 -4.961 1.00 0.00 C ATOM 1811 CG LEU A 741 -15.788 -0.737 -4.467 1.00 0.00 C ATOM 1812 CD1 LEU A 741 -16.897 0.234 -4.697 1.00 0.00 C ATOM 1813 CD2 LEU A 741 -15.488 -0.782 -3.000 1.00 0.00 C ATOM 0 H LEU A 741 -13.098 -2.477 -5.619 1.00 0.00 H new ATOM 0 HA LEU A 741 -14.618 -3.357 -4.227 1.00 0.00 H new ATOM 0 HB2 LEU A 741 -16.754 -1.988 -5.897 1.00 0.00 H new ATOM 0 HB3 LEU A 741 -16.904 -2.539 -4.241 1.00 0.00 H new ATOM 0 HG LEU A 741 -14.895 -0.429 -5.010 1.00 0.00 H new ATOM 0 HD11 LEU A 741 -16.597 1.220 -4.343 1.00 0.00 H new ATOM 0 HD12 LEU A 741 -17.121 0.284 -5.762 1.00 0.00 H new ATOM 0 HD13 LEU A 741 -17.784 -0.092 -4.154 1.00 0.00 H new ATOM 0 HD21 LEU A 741 -15.187 0.209 -2.660 1.00 0.00 H new ATOM 0 HD22 LEU A 741 -16.378 -1.098 -2.456 1.00 0.00 H new ATOM 0 HD23 LEU A 741 -14.680 -1.490 -2.815 1.00 0.00 H new ATOM 1825 N PRO A 742 -16.097 -5.304 -5.075 1.00 0.00 N ATOM 1826 CA PRO A 742 -16.721 -6.495 -5.617 1.00 0.00 C ATOM 1827 C PRO A 742 -18.168 -6.203 -6.076 1.00 0.00 C ATOM 1828 O PRO A 742 -18.553 -5.047 -6.303 1.00 0.00 O ATOM 1829 CB PRO A 742 -16.729 -7.460 -4.424 1.00 0.00 C ATOM 1830 CG PRO A 742 -16.774 -6.575 -3.226 1.00 0.00 C ATOM 1831 CD PRO A 742 -16.069 -5.304 -3.603 1.00 0.00 C ATOM 0 HA PRO A 742 -16.199 -6.885 -6.491 1.00 0.00 H new ATOM 0 HB2 PRO A 742 -17.592 -8.125 -4.458 1.00 0.00 H new ATOM 0 HB3 PRO A 742 -15.840 -8.091 -4.418 1.00 0.00 H new ATOM 0 HG2 PRO A 742 -17.804 -6.374 -2.932 1.00 0.00 H new ATOM 0 HG3 PRO A 742 -16.286 -7.050 -2.375 1.00 0.00 H new ATOM 0 HD2 PRO A 742 -16.576 -4.430 -3.194 1.00 0.00 H new ATOM 0 HD3 PRO A 742 -15.047 -5.286 -3.223 1.00 0.00 H new ATOM 1839 N GLN A 743 -18.933 -7.240 -6.228 1.00 0.00 N ATOM 1840 CA GLN A 743 -20.333 -7.151 -6.574 1.00 0.00 C ATOM 1841 C GLN A 743 -21.071 -8.175 -5.732 1.00 0.00 C ATOM 1842 O GLN A 743 -20.594 -9.297 -5.587 1.00 0.00 O ATOM 1843 CB GLN A 743 -20.526 -7.398 -8.087 1.00 0.00 C ATOM 1844 CG GLN A 743 -19.850 -8.664 -8.592 1.00 0.00 C ATOM 1845 CD GLN A 743 -19.956 -8.873 -10.088 1.00 0.00 C ATOM 1846 OE1 GLN A 743 -20.935 -8.476 -10.739 1.00 0.00 O ATOM 1847 NE2 GLN A 743 -18.936 -9.463 -10.650 1.00 0.00 N ATOM 0 H GLN A 743 -18.601 -8.198 -6.114 1.00 0.00 H new ATOM 0 HA GLN A 743 -20.730 -6.157 -6.369 1.00 0.00 H new ATOM 0 HB2 GLN A 743 -21.593 -7.455 -8.303 1.00 0.00 H new ATOM 0 HB3 GLN A 743 -20.134 -6.543 -8.638 1.00 0.00 H new ATOM 0 HG2 GLN A 743 -18.796 -8.634 -8.315 1.00 0.00 H new ATOM 0 HG3 GLN A 743 -20.289 -9.523 -8.085 1.00 0.00 H new ATOM 0 HE21 GLN A 743 -18.150 -9.775 -10.080 1.00 0.00 H new ATOM 0 HE22 GLN A 743 -18.925 -9.612 -11.659 1.00 0.00 H new ATOM 1856 N CYS A 744 -22.158 -7.786 -5.107 1.00 0.00 N ATOM 1857 CA CYS A 744 -22.882 -8.709 -4.250 1.00 0.00 C ATOM 1858 C CYS A 744 -24.001 -9.374 -5.020 1.00 0.00 C ATOM 1859 O CYS A 744 -24.613 -8.752 -5.894 1.00 0.00 O ATOM 1860 CB CYS A 744 -23.470 -7.956 -3.073 1.00 0.00 C ATOM 1861 SG CYS A 744 -22.314 -6.785 -2.300 1.00 0.00 S ATOM 0 H CYS A 744 -22.560 -6.851 -5.171 1.00 0.00 H new ATOM 0 HA CYS A 744 -22.189 -9.471 -3.895 1.00 0.00 H new ATOM 0 HB2 CYS A 744 -24.354 -7.413 -3.406 1.00 0.00 H new ATOM 0 HB3 CYS A 744 -23.801 -8.674 -2.323 1.00 0.00 H new ATOM 1866 N VAL A 745 -24.281 -10.610 -4.690 1.00 0.00 N ATOM 1867 CA VAL A 745 -25.328 -11.372 -5.303 1.00 0.00 C ATOM 1868 C VAL A 745 -26.005 -12.158 -4.226 1.00 0.00 C ATOM 1869 O VAL A 745 -25.407 -12.398 -3.159 1.00 0.00 O ATOM 1870 CB VAL A 745 -24.823 -12.340 -6.426 1.00 0.00 C ATOM 1871 CG1 VAL A 745 -24.348 -11.571 -7.648 1.00 0.00 C ATOM 1872 CG2 VAL A 745 -23.709 -13.246 -5.918 1.00 0.00 C ATOM 0 H VAL A 745 -23.772 -11.122 -3.970 1.00 0.00 H new ATOM 0 HA VAL A 745 -26.010 -10.677 -5.793 1.00 0.00 H new ATOM 0 HB VAL A 745 -25.670 -12.961 -6.716 1.00 0.00 H new ATOM 0 HG11 VAL A 745 -24.004 -12.272 -8.408 1.00 0.00 H new ATOM 0 HG12 VAL A 745 -25.171 -10.978 -8.047 1.00 0.00 H new ATOM 0 HG13 VAL A 745 -23.528 -10.911 -7.366 1.00 0.00 H new ATOM 0 HG21 VAL A 745 -23.381 -13.905 -6.722 1.00 0.00 H new ATOM 0 HG22 VAL A 745 -22.869 -12.637 -5.583 1.00 0.00 H new ATOM 0 HG23 VAL A 745 -24.078 -13.845 -5.085 1.00 0.00 H new ATOM 1882 N ALA A 746 -27.231 -12.501 -4.454 1.00 0.00 N ATOM 1883 CA ALA A 746 -28.001 -13.267 -3.515 1.00 0.00 C ATOM 1884 C ALA A 746 -27.469 -14.677 -3.452 1.00 0.00 C ATOM 1885 O ALA A 746 -27.310 -15.326 -4.485 1.00 0.00 O ATOM 1886 CB ALA A 746 -29.467 -13.270 -3.915 1.00 0.00 C ATOM 0 H ALA A 746 -27.736 -12.257 -5.306 1.00 0.00 H new ATOM 0 HA ALA A 746 -27.916 -12.812 -2.528 1.00 0.00 H new ATOM 0 HB1 ALA A 746 -30.039 -13.854 -3.195 1.00 0.00 H new ATOM 0 HB2 ALA A 746 -29.842 -12.247 -3.932 1.00 0.00 H new ATOM 0 HB3 ALA A 746 -29.573 -13.711 -4.906 1.00 0.00 H new ATOM 1892 N ILE A 747 -27.124 -15.106 -2.254 1.00 0.00 N ATOM 1893 CA ILE A 747 -26.657 -16.463 -2.010 1.00 0.00 C ATOM 1894 C ILE A 747 -27.779 -17.446 -2.338 1.00 0.00 C ATOM 1895 O ILE A 747 -28.777 -17.497 -1.582 1.00 0.00 O ATOM 1896 CB ILE A 747 -26.205 -16.666 -0.534 1.00 0.00 C ATOM 1897 CG1 ILE A 747 -25.123 -15.645 -0.166 1.00 0.00 C ATOM 1898 CG2 ILE A 747 -25.688 -18.096 -0.323 1.00 0.00 C ATOM 1899 CD1 ILE A 747 -24.669 -15.701 1.282 1.00 0.00 C ATOM 1900 OXT ILE A 747 -27.681 -18.156 -3.356 1.00 0.00 O ATOM 0 H ILE A 747 -27.159 -14.524 -1.417 1.00 0.00 H new ATOM 0 HA ILE A 747 -25.792 -16.642 -2.649 1.00 0.00 H new ATOM 0 HB ILE A 747 -27.065 -16.512 0.118 1.00 0.00 H new ATOM 0 HG12 ILE A 747 -24.258 -15.803 -0.811 1.00 0.00 H new ATOM 0 HG13 ILE A 747 -25.499 -14.644 -0.377 1.00 0.00 H new ATOM 0 HG21 ILE A 747 -25.376 -18.221 0.714 1.00 0.00 H new ATOM 0 HG22 ILE A 747 -26.482 -18.807 -0.551 1.00 0.00 H new ATOM 0 HG23 ILE A 747 -24.838 -18.277 -0.982 1.00 0.00 H new ATOM 0 HD11 ILE A 747 -23.903 -14.945 1.453 1.00 0.00 H new ATOM 0 HD12 ILE A 747 -25.519 -15.511 1.937 1.00 0.00 H new ATOM 0 HD13 ILE A 747 -24.259 -16.688 1.497 1.00 0.00 H new