USER MOD reduce.3.24.130724 H: found=0, std=0, add=876, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 876 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 57 SER OG : rot 180:sc= 0.00987 USER MOD Set 1.2: A 62 GLN : amide:sc= 0.911 K(o=0.92,f=0.12) USER MOD Set 2.1: A 22 THR OG1 : rot 180:sc= 0.062 USER MOD Set 2.2: A 25 ASN : amide:sc= 0.729 K(o=0.79,f=0.018) USER MOD Set 3.1: A 7 THR OG1 : rot 127:sc= 1.69 USER MOD Set 3.2: A 9 THR OG1 : rot 170:sc= 0.733 USER MOD Set 4.1: A 6 LYS NZ :NH3+ -168:sc= 1.21 (180deg=1.13) USER MOD Set 4.2: B 686 GLN : amide:sc= 1.18 K(o=2.4,f=0.5) USER MOD Single : A 1 MET CE :methyl -165:sc= -0.0579 (180deg=-0.0778) USER MOD Single : A 1 MET N :NH3+ 175:sc= 0.973 (180deg=0.956) USER MOD Single : A 2 GLN : amide:sc= -0.0735 X(o=-0.073,f=0.0015) USER MOD Single : A 11 LYS NZ :NH3+ -175:sc= 1.21 (180deg=1.15) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 156:sc= 1.73 (180deg=1.51) USER MOD Single : A 29 LYS NZ :NH3+ -163:sc= 0.577 (180deg=0.429) USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 LYS NZ :NH3+ 137:sc= 0.0342 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -0.0146 X(o=-0.015,f=-0.23) USER MOD Single : A 41 GLN : amide:sc= 1.1 K(o=1.1,f=-4.9!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 1.09 K(o=1.1,f=-6.9!) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 30:sc= 0.252 USER MOD Single : A 60 ASN : amide:sc= 0.244 X(o=0.24,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 56:sc= 0.673 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HE2:sc= -0.05 X(o=-0.05,f=-0.29) USER MOD Single : B 678 THR OG1 : rot 180:sc= 0 USER MOD Single : B 681 SER OG : rot 180:sc= 0 USER MOD Single : B 689 TYR OH : rot 180:sc= 0 USER MOD Single : B 696 GLN : amide:sc= 0.605 K(o=0.6,f=-0.027) USER MOD Single : B 697 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 704 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 706 THR OG1 : rot -86:sc= -0.279 USER MOD Single : B 708 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.730 1.491 0.162 1.00 0.00 N ATOM 2 CA MET A 1 2.468 1.420 -1.141 1.00 0.00 C ATOM 3 C MET A 1 2.202 2.662 -2.000 1.00 0.00 C ATOM 4 O MET A 1 1.298 3.419 -1.687 1.00 0.00 O ATOM 5 CB MET A 1 2.159 0.132 -1.956 1.00 0.00 C ATOM 6 CG MET A 1 0.746 -0.049 -2.539 1.00 0.00 C ATOM 7 SD MET A 1 0.557 -1.631 -3.394 1.00 0.00 S ATOM 8 CE MET A 1 -0.595 -1.202 -4.724 1.00 0.00 C ATOM 0 H1 MET A 1 1.861 0.601 0.684 1.00 0.00 H new ATOM 0 H2 MET A 1 2.099 2.282 0.727 1.00 0.00 H new ATOM 0 H3 MET A 1 0.717 1.639 -0.020 1.00 0.00 H new ATOM 0 HA MET A 1 3.525 1.384 -0.878 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.867 0.086 -2.783 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.364 -0.724 -1.313 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.012 0.018 -1.736 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.534 0.765 -3.233 1.00 0.00 H new ATOM 0 HE1 MET A 1 -1.004 -2.114 -5.159 1.00 0.00 H new ATOM 0 HE2 MET A 1 -1.407 -0.596 -4.321 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.068 -0.638 -5.494 1.00 0.00 H new ATOM 20 N GLN A 2 2.885 2.838 -3.138 1.00 0.00 N ATOM 21 CA GLN A 2 2.555 3.879 -4.116 1.00 0.00 C ATOM 22 C GLN A 2 2.481 3.300 -5.505 1.00 0.00 C ATOM 23 O GLN A 2 3.155 2.306 -5.777 1.00 0.00 O ATOM 24 CB GLN A 2 3.552 5.059 -4.034 1.00 0.00 C ATOM 25 CG GLN A 2 4.843 4.996 -4.872 1.00 0.00 C ATOM 26 CD GLN A 2 5.867 4.079 -4.227 1.00 0.00 C ATOM 27 OE1 GLN A 2 6.733 4.486 -3.462 1.00 0.00 O ATOM 28 NE2 GLN A 2 5.723 2.800 -4.504 1.00 0.00 N ATOM 0 H GLN A 2 3.683 2.261 -3.406 1.00 0.00 H new ATOM 0 HA GLN A 2 1.570 4.277 -3.874 1.00 0.00 H new ATOM 0 HB2 GLN A 2 3.017 5.965 -4.319 1.00 0.00 H new ATOM 0 HB3 GLN A 2 3.841 5.175 -2.990 1.00 0.00 H new ATOM 0 HG2 GLN A 2 4.612 4.640 -5.876 1.00 0.00 H new ATOM 0 HG3 GLN A 2 5.261 5.997 -4.977 1.00 0.00 H new ATOM 0 HE21 GLN A 2 4.991 2.496 -5.146 1.00 0.00 H new ATOM 0 HE22 GLN A 2 6.344 2.113 -4.077 1.00 0.00 H new ATOM 37 N ILE A 3 1.761 3.979 -6.386 1.00 0.00 N ATOM 38 CA ILE A 3 1.677 3.623 -7.803 1.00 0.00 C ATOM 39 C ILE A 3 1.734 4.901 -8.627 1.00 0.00 C ATOM 40 O ILE A 3 1.388 5.973 -8.141 1.00 0.00 O ATOM 41 CB ILE A 3 0.425 2.765 -8.081 1.00 0.00 C ATOM 42 CG1 ILE A 3 -0.848 3.307 -7.408 1.00 0.00 C ATOM 43 CG2 ILE A 3 0.667 1.334 -7.565 1.00 0.00 C ATOM 44 CD1 ILE A 3 -2.067 3.231 -8.318 1.00 0.00 C ATOM 0 H ILE A 3 1.211 4.802 -6.139 1.00 0.00 H new ATOM 0 HA ILE A 3 2.523 3.001 -8.094 1.00 0.00 H new ATOM 0 HB ILE A 3 0.265 2.788 -9.159 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -1.043 2.741 -6.497 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -0.685 4.343 -7.110 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -0.215 0.723 -7.759 1.00 0.00 H new ATOM 0 HG22 ILE A 3 1.527 0.903 -8.078 1.00 0.00 H new ATOM 0 HG23 ILE A 3 0.860 1.362 -6.493 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -2.937 3.626 -7.794 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -1.887 3.820 -9.217 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -2.250 2.193 -8.595 1.00 0.00 H new ATOM 56 N PHE A 4 2.211 4.772 -9.853 1.00 0.00 N ATOM 57 CA PHE A 4 2.567 5.855 -10.752 1.00 0.00 C ATOM 58 C PHE A 4 1.509 5.947 -11.831 1.00 0.00 C ATOM 59 O PHE A 4 1.511 5.187 -12.787 1.00 0.00 O ATOM 60 CB PHE A 4 3.957 5.573 -11.353 1.00 0.00 C ATOM 61 CG PHE A 4 4.996 4.976 -10.425 1.00 0.00 C ATOM 62 CD1 PHE A 4 5.305 5.630 -9.226 1.00 0.00 C ATOM 63 CD2 PHE A 4 5.663 3.785 -10.751 1.00 0.00 C ATOM 64 CE1 PHE A 4 6.238 5.088 -8.330 1.00 0.00 C ATOM 65 CE2 PHE A 4 6.634 3.269 -9.878 1.00 0.00 C ATOM 66 CZ PHE A 4 6.925 3.913 -8.666 1.00 0.00 C ATOM 0 H PHE A 4 2.369 3.855 -10.271 1.00 0.00 H new ATOM 0 HA PHE A 4 2.613 6.806 -10.222 1.00 0.00 H new ATOM 0 HB2 PHE A 4 3.830 4.898 -12.200 1.00 0.00 H new ATOM 0 HB3 PHE A 4 4.352 6.509 -11.748 1.00 0.00 H new ATOM 0 HD1 PHE A 4 4.818 6.564 -8.988 1.00 0.00 H new ATOM 0 HD2 PHE A 4 5.430 3.267 -11.670 1.00 0.00 H new ATOM 0 HE1 PHE A 4 6.427 5.574 -7.384 1.00 0.00 H new ATOM 0 HE2 PHE A 4 7.163 2.366 -10.143 1.00 0.00 H new ATOM 0 HZ PHE A 4 7.671 3.508 -7.998 1.00 0.00 H new ATOM 76 N VAL A 5 0.555 6.847 -11.697 1.00 0.00 N ATOM 77 CA VAL A 5 -0.481 6.998 -12.716 1.00 0.00 C ATOM 78 C VAL A 5 0.079 7.968 -13.747 1.00 0.00 C ATOM 79 O VAL A 5 0.159 9.163 -13.497 1.00 0.00 O ATOM 80 CB VAL A 5 -1.829 7.383 -12.084 1.00 0.00 C ATOM 81 CG1 VAL A 5 -2.952 7.394 -13.138 1.00 0.00 C ATOM 82 CG2 VAL A 5 -2.153 6.381 -10.967 1.00 0.00 C ATOM 0 H VAL A 5 0.470 7.482 -10.903 1.00 0.00 H new ATOM 0 HA VAL A 5 -0.719 6.066 -13.229 1.00 0.00 H new ATOM 0 HB VAL A 5 -1.758 8.389 -11.671 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -3.894 7.669 -12.663 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -2.713 8.118 -13.917 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -3.045 6.402 -13.581 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -3.107 6.642 -10.510 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -2.214 5.377 -11.386 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -1.368 6.412 -10.211 1.00 0.00 H new ATOM 92 N LYS A 6 0.543 7.459 -14.886 1.00 0.00 N ATOM 93 CA LYS A 6 0.978 8.308 -15.981 1.00 0.00 C ATOM 94 C LYS A 6 -0.282 8.891 -16.586 1.00 0.00 C ATOM 95 O LYS A 6 -1.174 8.138 -16.977 1.00 0.00 O ATOM 96 CB LYS A 6 1.813 7.480 -16.976 1.00 0.00 C ATOM 97 CG LYS A 6 2.543 8.427 -17.944 1.00 0.00 C ATOM 98 CD LYS A 6 3.428 7.720 -18.985 1.00 0.00 C ATOM 99 CE LYS A 6 4.332 8.725 -19.734 1.00 0.00 C ATOM 100 NZ LYS A 6 5.362 8.044 -20.560 1.00 0.00 N ATOM 0 H LYS A 6 0.626 6.459 -15.070 1.00 0.00 H new ATOM 0 HA LYS A 6 1.628 9.121 -15.659 1.00 0.00 H new ATOM 0 HB2 LYS A 6 2.535 6.865 -16.438 1.00 0.00 H new ATOM 0 HB3 LYS A 6 1.167 6.801 -17.532 1.00 0.00 H new ATOM 0 HG2 LYS A 6 1.803 9.032 -18.467 1.00 0.00 H new ATOM 0 HG3 LYS A 6 3.162 9.111 -17.364 1.00 0.00 H new ATOM 0 HD2 LYS A 6 4.046 6.971 -18.490 1.00 0.00 H new ATOM 0 HD3 LYS A 6 2.798 7.191 -19.701 1.00 0.00 H new ATOM 0 HE2 LYS A 6 3.717 9.359 -20.373 1.00 0.00 H new ATOM 0 HE3 LYS A 6 4.821 9.379 -19.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 6.066 8.739 -20.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 5.833 7.310 -19.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 4.909 7.605 -21.387 1.00 0.00 H new ATOM 114 N THR A 7 -0.397 10.212 -16.663 1.00 0.00 N ATOM 115 CA THR A 7 -1.481 10.773 -17.434 1.00 0.00 C ATOM 116 C THR A 7 -1.226 10.492 -18.887 1.00 0.00 C ATOM 117 O THR A 7 -0.099 10.242 -19.292 1.00 0.00 O ATOM 118 CB THR A 7 -1.688 12.259 -17.178 1.00 0.00 C ATOM 119 OG1 THR A 7 -0.470 12.919 -17.398 1.00 0.00 O ATOM 120 CG2 THR A 7 -2.167 12.459 -15.755 1.00 0.00 C ATOM 0 H THR A 7 0.225 10.886 -16.217 1.00 0.00 H new ATOM 0 HA THR A 7 -2.411 10.298 -17.120 1.00 0.00 H new ATOM 0 HB THR A 7 -2.442 12.668 -17.851 1.00 0.00 H new ATOM 0 HG1 THR A 7 -0.605 13.651 -18.036 1.00 0.00 H new ATOM 0 HG21 THR A 7 -2.317 13.522 -15.567 1.00 0.00 H new ATOM 0 HG22 THR A 7 -3.108 11.929 -15.610 1.00 0.00 H new ATOM 0 HG23 THR A 7 -1.421 12.070 -15.062 1.00 0.00 H new ATOM 128 N LEU A 8 -2.265 10.598 -19.689 1.00 0.00 N ATOM 129 CA LEU A 8 -2.116 10.587 -21.130 1.00 0.00 C ATOM 130 C LEU A 8 -1.260 11.797 -21.581 1.00 0.00 C ATOM 131 O LEU A 8 -0.809 11.748 -22.716 1.00 0.00 O ATOM 132 CB LEU A 8 -3.519 10.596 -21.750 1.00 0.00 C ATOM 133 CG LEU A 8 -4.177 9.332 -22.318 1.00 0.00 C ATOM 134 CD1 LEU A 8 -5.635 9.595 -22.717 1.00 0.00 C ATOM 135 CD2 LEU A 8 -3.542 8.841 -23.607 1.00 0.00 C ATOM 0 H LEU A 8 -3.228 10.693 -19.365 1.00 0.00 H new ATOM 0 HA LEU A 8 -1.592 9.692 -21.467 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -4.195 10.983 -20.987 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -3.498 11.327 -22.558 1.00 0.00 H new ATOM 0 HG LEU A 8 -4.065 8.602 -21.516 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -6.074 8.680 -23.116 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -6.199 9.916 -21.842 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.669 10.375 -23.477 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -4.059 7.945 -23.949 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -3.618 9.617 -24.369 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -2.492 8.609 -23.430 1.00 0.00 H new ATOM 147 N THR A 9 -1.001 12.863 -20.793 1.00 0.00 N ATOM 148 CA THR A 9 0.003 13.866 -21.189 1.00 0.00 C ATOM 149 C THR A 9 1.383 13.262 -21.024 1.00 0.00 C ATOM 150 O THR A 9 2.301 13.525 -21.797 1.00 0.00 O ATOM 151 CB THR A 9 -0.006 15.142 -20.330 1.00 0.00 C ATOM 152 OG1 THR A 9 -0.866 15.010 -19.217 1.00 0.00 O ATOM 153 CG2 THR A 9 -0.393 16.345 -21.170 1.00 0.00 C ATOM 0 H THR A 9 -1.462 13.046 -19.902 1.00 0.00 H new ATOM 0 HA THR A 9 -0.242 14.140 -22.215 1.00 0.00 H new ATOM 0 HB THR A 9 1.004 15.295 -19.949 1.00 0.00 H new ATOM 0 HG1 THR A 9 -0.730 15.765 -18.607 1.00 0.00 H new ATOM 0 HG21 THR A 9 -0.394 17.239 -20.546 1.00 0.00 H new ATOM 0 HG22 THR A 9 0.325 16.469 -21.981 1.00 0.00 H new ATOM 0 HG23 THR A 9 -1.388 16.192 -21.587 1.00 0.00 H new ATOM 161 N GLY A 10 1.502 12.469 -19.971 1.00 0.00 N ATOM 162 CA GLY A 10 2.720 11.847 -19.549 1.00 0.00 C ATOM 163 C GLY A 10 3.241 12.469 -18.270 1.00 0.00 C ATOM 164 O GLY A 10 4.434 12.373 -17.990 1.00 0.00 O ATOM 0 H GLY A 10 0.711 12.240 -19.370 1.00 0.00 H new ATOM 0 HA2 GLY A 10 2.552 10.781 -19.395 1.00 0.00 H new ATOM 0 HA3 GLY A 10 3.470 11.942 -20.334 1.00 0.00 H new ATOM 168 N LYS A 11 2.357 13.115 -17.497 1.00 0.00 N ATOM 169 CA LYS A 11 2.708 13.573 -16.168 1.00 0.00 C ATOM 170 C LYS A 11 2.413 12.404 -15.276 1.00 0.00 C ATOM 171 O LYS A 11 1.258 12.012 -15.147 1.00 0.00 O ATOM 172 CB LYS A 11 1.890 14.808 -15.794 1.00 0.00 C ATOM 173 CG LYS A 11 2.203 15.268 -14.356 1.00 0.00 C ATOM 174 CD LYS A 11 1.298 14.738 -13.230 1.00 0.00 C ATOM 175 CE LYS A 11 -0.212 14.847 -13.494 1.00 0.00 C ATOM 176 NZ LYS A 11 -0.717 16.243 -13.565 1.00 0.00 N ATOM 0 H LYS A 11 1.400 13.326 -17.778 1.00 0.00 H new ATOM 0 HA LYS A 11 3.750 13.880 -16.085 1.00 0.00 H new ATOM 0 HB2 LYS A 11 2.106 15.616 -16.493 1.00 0.00 H new ATOM 0 HB3 LYS A 11 0.827 14.585 -15.884 1.00 0.00 H new ATOM 0 HG2 LYS A 11 3.229 14.981 -14.126 1.00 0.00 H new ATOM 0 HG3 LYS A 11 2.164 16.357 -14.335 1.00 0.00 H new ATOM 0 HD2 LYS A 11 1.544 13.691 -13.051 1.00 0.00 H new ATOM 0 HD3 LYS A 11 1.530 15.281 -12.314 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -0.444 14.340 -14.431 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -0.747 14.318 -12.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -1.753 16.233 -13.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -0.454 16.752 -12.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -0.298 16.722 -14.388 1.00 0.00 H new ATOM 190 N THR A 12 3.429 11.828 -14.676 1.00 0.00 N ATOM 191 CA THR A 12 3.224 10.701 -13.801 1.00 0.00 C ATOM 192 C THR A 12 2.904 11.252 -12.420 1.00 0.00 C ATOM 193 O THR A 12 3.743 11.885 -11.779 1.00 0.00 O ATOM 194 CB THR A 12 4.451 9.794 -13.879 1.00 0.00 C ATOM 195 OG1 THR A 12 4.917 9.712 -15.219 1.00 0.00 O ATOM 196 CG2 THR A 12 4.046 8.394 -13.451 1.00 0.00 C ATOM 0 H THR A 12 4.401 12.121 -14.778 1.00 0.00 H new ATOM 0 HA THR A 12 2.382 10.070 -14.087 1.00 0.00 H new ATOM 0 HB THR A 12 5.232 10.200 -13.236 1.00 0.00 H new ATOM 0 HG1 THR A 12 5.704 9.130 -15.256 1.00 0.00 H new ATOM 0 HG21 THR A 12 4.912 7.733 -13.501 1.00 0.00 H new ATOM 0 HG22 THR A 12 3.669 8.421 -12.429 1.00 0.00 H new ATOM 0 HG23 THR A 12 3.266 8.022 -14.116 1.00 0.00 H new ATOM 204 N ILE A 13 1.655 11.048 -11.999 1.00 0.00 N ATOM 205 CA ILE A 13 1.196 11.397 -10.665 1.00 0.00 C ATOM 206 C ILE A 13 1.370 10.127 -9.858 1.00 0.00 C ATOM 207 O ILE A 13 0.709 9.125 -10.119 1.00 0.00 O ATOM 208 CB ILE A 13 -0.243 11.975 -10.665 1.00 0.00 C ATOM 209 CG1 ILE A 13 -1.058 11.751 -9.358 1.00 0.00 C ATOM 210 CG2 ILE A 13 -1.115 11.652 -11.885 1.00 0.00 C ATOM 211 CD1 ILE A 13 -2.337 10.907 -9.455 1.00 0.00 C ATOM 0 H ILE A 13 0.931 10.632 -12.584 1.00 0.00 H new ATOM 0 HA ILE A 13 1.769 12.211 -10.221 1.00 0.00 H new ATOM 0 HB ILE A 13 -0.003 13.036 -10.730 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -0.400 11.281 -8.628 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -1.330 12.728 -8.959 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -2.095 12.113 -11.764 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -0.640 12.042 -12.785 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -1.230 10.572 -11.974 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -2.801 10.835 -8.471 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -3.032 11.378 -10.150 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -2.087 9.908 -9.813 1.00 0.00 H new ATOM 223 N THR A 14 2.277 10.167 -8.903 1.00 0.00 N ATOM 224 CA THR A 14 2.488 9.062 -7.993 1.00 0.00 C ATOM 225 C THR A 14 1.515 9.266 -6.835 1.00 0.00 C ATOM 226 O THR A 14 1.289 10.397 -6.398 1.00 0.00 O ATOM 227 CB THR A 14 3.963 9.037 -7.577 1.00 0.00 C ATOM 228 OG1 THR A 14 4.759 9.012 -8.751 1.00 0.00 O ATOM 229 CG2 THR A 14 4.284 7.798 -6.726 1.00 0.00 C ATOM 0 H THR A 14 2.888 10.967 -8.737 1.00 0.00 H new ATOM 0 HA THR A 14 2.290 8.087 -8.437 1.00 0.00 H new ATOM 0 HB THR A 14 4.174 9.923 -6.979 1.00 0.00 H new ATOM 0 HG1 THR A 14 5.707 8.997 -8.503 1.00 0.00 H new ATOM 0 HG21 THR A 14 5.338 7.811 -6.448 1.00 0.00 H new ATOM 0 HG22 THR A 14 3.671 7.807 -5.825 1.00 0.00 H new ATOM 0 HG23 THR A 14 4.072 6.897 -7.301 1.00 0.00 H new ATOM 237 N LEU A 15 0.910 8.176 -6.360 1.00 0.00 N ATOM 238 CA LEU A 15 -0.106 8.226 -5.329 1.00 0.00 C ATOM 239 C LEU A 15 0.074 7.054 -4.408 1.00 0.00 C ATOM 240 O LEU A 15 0.422 5.979 -4.885 1.00 0.00 O ATOM 241 CB LEU A 15 -1.501 8.298 -5.979 1.00 0.00 C ATOM 242 CG LEU A 15 -1.989 7.085 -6.786 1.00 0.00 C ATOM 243 CD1 LEU A 15 -2.746 6.098 -5.904 1.00 0.00 C ATOM 244 CD2 LEU A 15 -3.006 7.548 -7.822 1.00 0.00 C ATOM 0 H LEU A 15 1.118 7.233 -6.687 1.00 0.00 H new ATOM 0 HA LEU A 15 -0.008 9.125 -4.720 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -2.227 8.486 -5.188 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -1.516 9.165 -6.639 1.00 0.00 H new ATOM 0 HG LEU A 15 -1.107 6.620 -7.227 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -3.077 5.252 -6.506 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -2.090 5.743 -5.109 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -3.613 6.593 -5.465 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -3.355 6.691 -8.397 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -3.852 8.016 -7.318 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -2.539 8.269 -8.493 1.00 0.00 H new ATOM 256 N GLU A 16 -0.176 7.242 -3.118 1.00 0.00 N ATOM 257 CA GLU A 16 0.029 6.210 -2.116 1.00 0.00 C ATOM 258 C GLU A 16 -1.319 5.623 -1.711 1.00 0.00 C ATOM 259 O GLU A 16 -2.278 6.326 -1.377 1.00 0.00 O ATOM 260 CB GLU A 16 0.858 6.726 -0.932 1.00 0.00 C ATOM 261 CG GLU A 16 2.364 6.604 -1.223 1.00 0.00 C ATOM 262 CD GLU A 16 3.214 7.222 -0.097 1.00 0.00 C ATOM 263 OE1 GLU A 16 3.526 8.435 -0.163 1.00 0.00 O ATOM 264 OE2 GLU A 16 3.587 6.492 0.853 1.00 0.00 O ATOM 0 H GLU A 16 -0.529 8.121 -2.738 1.00 0.00 H new ATOM 0 HA GLU A 16 0.622 5.400 -2.541 1.00 0.00 H new ATOM 0 HB2 GLU A 16 0.605 7.767 -0.732 1.00 0.00 H new ATOM 0 HB3 GLU A 16 0.610 6.160 -0.034 1.00 0.00 H new ATOM 0 HG2 GLU A 16 2.627 5.553 -1.343 1.00 0.00 H new ATOM 0 HG3 GLU A 16 2.594 7.100 -2.166 1.00 0.00 H new ATOM 271 N VAL A 17 -1.380 4.304 -1.829 1.00 0.00 N ATOM 272 CA VAL A 17 -2.552 3.447 -1.709 1.00 0.00 C ATOM 273 C VAL A 17 -2.127 2.101 -1.121 1.00 0.00 C ATOM 274 O VAL A 17 -0.977 1.897 -0.732 1.00 0.00 O ATOM 275 CB VAL A 17 -3.192 3.267 -3.104 1.00 0.00 C ATOM 276 CG1 VAL A 17 -4.052 4.474 -3.465 1.00 0.00 C ATOM 277 CG2 VAL A 17 -2.159 2.963 -4.198 1.00 0.00 C ATOM 0 H VAL A 17 -0.540 3.760 -2.028 1.00 0.00 H new ATOM 0 HA VAL A 17 -3.290 3.898 -1.046 1.00 0.00 H new ATOM 0 HB VAL A 17 -3.838 2.391 -3.046 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -4.492 4.325 -4.451 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -4.846 4.589 -2.727 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -3.433 5.371 -3.476 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -2.667 2.847 -5.156 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -1.445 3.784 -4.263 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -1.630 2.042 -3.953 1.00 0.00 H new ATOM 287 N GLU A 18 -3.052 1.157 -1.142 1.00 0.00 N ATOM 288 CA GLU A 18 -2.875 -0.233 -0.748 1.00 0.00 C ATOM 289 C GLU A 18 -3.155 -1.108 -1.971 1.00 0.00 C ATOM 290 O GLU A 18 -3.841 -0.655 -2.888 1.00 0.00 O ATOM 291 CB GLU A 18 -3.878 -0.587 0.366 1.00 0.00 C ATOM 292 CG GLU A 18 -3.843 0.343 1.584 1.00 0.00 C ATOM 293 CD GLU A 18 -2.447 0.500 2.225 1.00 0.00 C ATOM 294 OE1 GLU A 18 -1.674 -0.487 2.286 1.00 0.00 O ATOM 295 OE2 GLU A 18 -2.128 1.613 2.704 1.00 0.00 O ATOM 0 H GLU A 18 -4.004 1.350 -1.453 1.00 0.00 H new ATOM 0 HA GLU A 18 -1.862 -0.395 -0.380 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -4.884 -0.575 -0.053 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -3.684 -1.606 0.700 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -4.205 1.327 1.286 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -4.534 -0.037 2.336 1.00 0.00 H new ATOM 302 N PRO A 19 -2.722 -2.377 -2.020 1.00 0.00 N ATOM 303 CA PRO A 19 -3.161 -3.300 -3.065 1.00 0.00 C ATOM 304 C PRO A 19 -4.690 -3.462 -3.109 1.00 0.00 C ATOM 305 O PRO A 19 -5.259 -3.774 -4.152 1.00 0.00 O ATOM 306 CB PRO A 19 -2.469 -4.626 -2.754 1.00 0.00 C ATOM 307 CG PRO A 19 -1.331 -4.287 -1.797 1.00 0.00 C ATOM 308 CD PRO A 19 -1.838 -3.042 -1.074 1.00 0.00 C ATOM 0 HA PRO A 19 -2.894 -2.921 -4.052 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -3.164 -5.333 -2.300 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -2.089 -5.092 -3.664 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -1.134 -5.103 -1.102 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -0.401 -4.091 -2.331 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -2.369 -3.308 -0.160 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -1.012 -2.392 -0.785 1.00 0.00 H new ATOM 316 N SER A 20 -5.376 -3.192 -2.000 1.00 0.00 N ATOM 317 CA SER A 20 -6.810 -3.371 -1.836 1.00 0.00 C ATOM 318 C SER A 20 -7.528 -2.040 -2.012 1.00 0.00 C ATOM 319 O SER A 20 -8.720 -1.943 -1.722 1.00 0.00 O ATOM 320 CB SER A 20 -7.092 -4.008 -0.466 1.00 0.00 C ATOM 321 OG SER A 20 -6.276 -5.160 -0.270 1.00 0.00 O ATOM 0 H SER A 20 -4.926 -2.828 -1.160 1.00 0.00 H new ATOM 0 HA SER A 20 -7.193 -4.045 -2.603 1.00 0.00 H new ATOM 0 HB2 SER A 20 -6.901 -3.282 0.325 1.00 0.00 H new ATOM 0 HB3 SER A 20 -8.144 -4.285 -0.398 1.00 0.00 H new ATOM 0 HG SER A 20 -6.468 -5.551 0.608 1.00 0.00 H new ATOM 327 N ASP A 21 -6.825 -1.000 -2.481 1.00 0.00 N ATOM 328 CA ASP A 21 -7.480 0.217 -2.878 1.00 0.00 C ATOM 329 C ASP A 21 -8.304 -0.114 -4.102 1.00 0.00 C ATOM 330 O ASP A 21 -7.794 -0.716 -5.057 1.00 0.00 O ATOM 331 CB ASP A 21 -6.501 1.347 -3.211 1.00 0.00 C ATOM 332 CG ASP A 21 -6.479 2.396 -2.108 1.00 0.00 C ATOM 333 OD1 ASP A 21 -7.287 3.347 -2.205 1.00 0.00 O ATOM 334 OD2 ASP A 21 -5.676 2.264 -1.161 1.00 0.00 O ATOM 0 H ASP A 21 -5.811 -0.993 -2.588 1.00 0.00 H new ATOM 0 HA ASP A 21 -8.087 0.579 -2.048 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -5.500 0.937 -3.347 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -6.786 1.813 -4.154 1.00 0.00 H new ATOM 339 N THR A 22 -9.578 0.249 -4.068 1.00 0.00 N ATOM 340 CA THR A 22 -10.444 0.097 -5.207 1.00 0.00 C ATOM 341 C THR A 22 -10.110 1.153 -6.243 1.00 0.00 C ATOM 342 O THR A 22 -9.652 2.249 -5.926 1.00 0.00 O ATOM 343 CB THR A 22 -11.920 0.163 -4.801 1.00 0.00 C ATOM 344 OG1 THR A 22 -12.093 1.069 -3.731 1.00 0.00 O ATOM 345 CG2 THR A 22 -12.477 -1.204 -4.404 1.00 0.00 C ATOM 0 H THR A 22 -10.030 0.655 -3.249 1.00 0.00 H new ATOM 0 HA THR A 22 -10.279 -0.889 -5.643 1.00 0.00 H new ATOM 0 HB THR A 22 -12.473 0.507 -5.675 1.00 0.00 H new ATOM 0 HG1 THR A 22 -13.040 1.104 -3.482 1.00 0.00 H new ATOM 0 HG21 THR A 22 -13.526 -1.102 -4.125 1.00 0.00 H new ATOM 0 HG22 THR A 22 -12.390 -1.891 -5.246 1.00 0.00 H new ATOM 0 HG23 THR A 22 -11.913 -1.595 -3.557 1.00 0.00 H new ATOM 353 N ILE A 23 -10.401 0.838 -7.498 1.00 0.00 N ATOM 354 CA ILE A 23 -10.356 1.795 -8.589 1.00 0.00 C ATOM 355 C ILE A 23 -11.261 2.988 -8.282 1.00 0.00 C ATOM 356 O ILE A 23 -10.870 4.103 -8.607 1.00 0.00 O ATOM 357 CB ILE A 23 -10.721 1.085 -9.898 1.00 0.00 C ATOM 358 CG1 ILE A 23 -9.843 -0.148 -10.196 1.00 0.00 C ATOM 359 CG2 ILE A 23 -10.691 2.034 -11.108 1.00 0.00 C ATOM 360 CD1 ILE A 23 -8.390 -0.135 -9.720 1.00 0.00 C ATOM 0 H ILE A 23 -10.678 -0.100 -7.788 1.00 0.00 H new ATOM 0 HA ILE A 23 -9.349 2.195 -8.704 1.00 0.00 H new ATOM 0 HB ILE A 23 -11.742 0.738 -9.742 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -10.330 -1.017 -9.754 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -9.838 -0.300 -11.275 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -10.957 1.482 -12.010 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -11.405 2.843 -10.954 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -9.690 2.450 -11.219 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -7.906 -1.069 -10.004 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -7.864 0.701 -10.180 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -8.363 -0.028 -8.636 1.00 0.00 H new ATOM 372 N GLU A 24 -12.401 2.800 -7.609 1.00 0.00 N ATOM 373 CA GLU A 24 -13.236 3.907 -7.145 1.00 0.00 C ATOM 374 C GLU A 24 -12.406 4.884 -6.306 1.00 0.00 C ATOM 375 O GLU A 24 -12.416 6.087 -6.574 1.00 0.00 O ATOM 376 CB GLU A 24 -14.432 3.350 -6.353 1.00 0.00 C ATOM 377 CG GLU A 24 -15.396 4.454 -5.902 1.00 0.00 C ATOM 378 CD GLU A 24 -16.604 3.866 -5.146 1.00 0.00 C ATOM 379 OE1 GLU A 24 -17.625 3.525 -5.793 1.00 0.00 O ATOM 380 OE2 GLU A 24 -16.544 3.744 -3.899 1.00 0.00 O ATOM 0 H GLU A 24 -12.768 1.878 -7.372 1.00 0.00 H new ATOM 0 HA GLU A 24 -13.622 4.460 -8.001 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -14.970 2.631 -6.970 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -14.067 2.810 -5.479 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -14.870 5.159 -5.259 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -15.744 5.013 -6.770 1.00 0.00 H new ATOM 387 N ASN A 25 -11.625 4.371 -5.341 1.00 0.00 N ATOM 388 CA ASN A 25 -10.764 5.214 -4.520 1.00 0.00 C ATOM 389 C ASN A 25 -9.703 5.849 -5.379 1.00 0.00 C ATOM 390 O ASN A 25 -9.479 7.045 -5.295 1.00 0.00 O ATOM 391 CB ASN A 25 -9.966 4.446 -3.463 1.00 0.00 C ATOM 392 CG ASN A 25 -10.721 3.590 -2.487 1.00 0.00 C ATOM 393 OD1 ASN A 25 -11.911 3.738 -2.219 1.00 0.00 O ATOM 394 ND2 ASN A 25 -9.946 2.663 -1.964 1.00 0.00 N ATOM 0 H ASN A 25 -11.578 3.377 -5.117 1.00 0.00 H new ATOM 0 HA ASN A 25 -11.445 5.920 -4.045 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -9.253 3.807 -3.984 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -9.387 5.171 -2.891 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -10.326 2.004 -1.285 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -8.965 2.604 -2.238 1.00 0.00 H new ATOM 401 N VAL A 26 -9.008 5.051 -6.182 1.00 0.00 N ATOM 402 CA VAL A 26 -7.841 5.479 -6.936 1.00 0.00 C ATOM 403 C VAL A 26 -8.257 6.603 -7.863 1.00 0.00 C ATOM 404 O VAL A 26 -7.646 7.661 -7.833 1.00 0.00 O ATOM 405 CB VAL A 26 -7.297 4.249 -7.665 1.00 0.00 C ATOM 406 CG1 VAL A 26 -6.286 4.614 -8.750 1.00 0.00 C ATOM 407 CG2 VAL A 26 -6.662 3.261 -6.682 1.00 0.00 C ATOM 0 H VAL A 26 -9.247 4.070 -6.328 1.00 0.00 H new ATOM 0 HA VAL A 26 -7.043 5.873 -6.306 1.00 0.00 H new ATOM 0 HB VAL A 26 -8.152 3.777 -8.149 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.931 3.706 -9.237 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -6.762 5.259 -9.489 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -5.443 5.138 -8.300 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -6.284 2.397 -7.228 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -5.839 3.747 -6.158 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -7.410 2.935 -5.960 1.00 0.00 H new ATOM 417 N LYS A 27 -9.338 6.442 -8.623 1.00 0.00 N ATOM 418 CA LYS A 27 -9.885 7.532 -9.408 1.00 0.00 C ATOM 419 C LYS A 27 -10.219 8.751 -8.565 1.00 0.00 C ATOM 420 O LYS A 27 -9.976 9.862 -9.022 1.00 0.00 O ATOM 421 CB LYS A 27 -11.165 7.076 -10.106 1.00 0.00 C ATOM 422 CG LYS A 27 -11.014 6.048 -11.226 1.00 0.00 C ATOM 423 CD LYS A 27 -12.433 5.669 -11.671 1.00 0.00 C ATOM 424 CE LYS A 27 -12.459 5.023 -13.057 1.00 0.00 C ATOM 425 NZ LYS A 27 -13.835 5.076 -13.640 1.00 0.00 N ATOM 0 H LYS A 27 -9.849 5.563 -8.708 1.00 0.00 H new ATOM 0 HA LYS A 27 -9.117 7.811 -10.129 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -11.833 6.660 -9.352 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -11.659 7.956 -10.518 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -10.445 6.463 -12.058 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -10.471 5.170 -10.875 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -12.867 4.981 -10.945 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -13.059 6.561 -11.678 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -11.759 5.537 -13.716 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -12.128 3.987 -12.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -13.775 5.025 -14.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -14.393 4.274 -13.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -14.295 5.967 -13.364 1.00 0.00 H new ATOM 439 N ALA A 28 -10.750 8.598 -7.354 1.00 0.00 N ATOM 440 CA ALA A 28 -10.979 9.749 -6.482 1.00 0.00 C ATOM 441 C ALA A 28 -9.646 10.382 -6.072 1.00 0.00 C ATOM 442 O ALA A 28 -9.535 11.602 -6.035 1.00 0.00 O ATOM 443 CB ALA A 28 -11.809 9.360 -5.256 1.00 0.00 C ATOM 0 H ALA A 28 -11.027 7.700 -6.957 1.00 0.00 H new ATOM 0 HA ALA A 28 -11.551 10.490 -7.039 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -11.962 10.237 -4.627 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -12.775 8.972 -5.579 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -11.282 8.594 -4.688 1.00 0.00 H new ATOM 449 N LYS A 29 -8.598 9.580 -5.854 1.00 0.00 N ATOM 450 CA LYS A 29 -7.245 10.081 -5.616 1.00 0.00 C ATOM 451 C LYS A 29 -6.751 10.832 -6.866 1.00 0.00 C ATOM 452 O LYS A 29 -6.127 11.883 -6.765 1.00 0.00 O ATOM 453 CB LYS A 29 -6.312 8.924 -5.179 1.00 0.00 C ATOM 454 CG LYS A 29 -6.781 8.068 -3.956 1.00 0.00 C ATOM 455 CD LYS A 29 -5.609 7.763 -3.003 1.00 0.00 C ATOM 456 CE LYS A 29 -6.119 7.186 -1.672 1.00 0.00 C ATOM 457 NZ LYS A 29 -5.056 7.178 -0.619 1.00 0.00 N ATOM 0 H LYS A 29 -8.667 8.562 -5.838 1.00 0.00 H new ATOM 0 HA LYS A 29 -7.242 10.796 -4.793 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -6.176 8.256 -6.030 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -5.334 9.345 -4.945 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -7.563 8.601 -3.415 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -7.218 7.134 -4.309 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -4.927 7.054 -3.474 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -5.041 8.674 -2.815 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -6.969 7.773 -1.324 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -6.478 6.169 -1.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -5.334 6.536 0.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -4.159 6.853 -1.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -4.934 8.139 -0.241 1.00 0.00 H new ATOM 471 N ILE A 30 -7.107 10.373 -8.068 1.00 0.00 N ATOM 472 CA ILE A 30 -6.763 11.070 -9.312 1.00 0.00 C ATOM 473 C ILE A 30 -7.516 12.380 -9.354 1.00 0.00 C ATOM 474 O ILE A 30 -6.921 13.373 -9.696 1.00 0.00 O ATOM 475 CB ILE A 30 -7.071 10.249 -10.586 1.00 0.00 C ATOM 476 CG1 ILE A 30 -6.457 8.844 -10.652 1.00 0.00 C ATOM 477 CG2 ILE A 30 -6.622 11.005 -11.852 1.00 0.00 C ATOM 478 CD1 ILE A 30 -5.173 8.703 -9.849 1.00 0.00 C ATOM 0 H ILE A 30 -7.638 9.514 -8.208 1.00 0.00 H new ATOM 0 HA ILE A 30 -5.685 11.231 -9.308 1.00 0.00 H new ATOM 0 HB ILE A 30 -8.152 10.120 -10.537 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -7.186 8.120 -10.286 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -6.254 8.594 -11.693 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -6.850 10.406 -12.734 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -7.150 11.957 -11.914 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -5.548 11.188 -11.805 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -4.796 7.685 -9.942 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -4.428 9.402 -10.229 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -5.374 8.921 -8.800 1.00 0.00 H new ATOM 490 N GLN A 31 -8.790 12.425 -9.000 1.00 0.00 N ATOM 491 CA GLN A 31 -9.560 13.655 -8.945 1.00 0.00 C ATOM 492 C GLN A 31 -8.913 14.623 -7.961 1.00 0.00 C ATOM 493 O GLN A 31 -8.874 15.817 -8.237 1.00 0.00 O ATOM 494 CB GLN A 31 -11.014 13.381 -8.549 1.00 0.00 C ATOM 495 CG GLN A 31 -11.908 14.626 -8.749 1.00 0.00 C ATOM 496 CD GLN A 31 -12.634 14.977 -7.460 1.00 0.00 C ATOM 497 OE1 GLN A 31 -12.168 15.764 -6.642 1.00 0.00 O ATOM 498 NE2 GLN A 31 -13.777 14.352 -7.253 1.00 0.00 N ATOM 0 H GLN A 31 -9.325 11.596 -8.739 1.00 0.00 H new ATOM 0 HA GLN A 31 -9.566 14.103 -9.938 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -11.403 12.555 -9.144 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -11.054 13.069 -7.505 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -11.298 15.470 -9.071 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -12.633 14.436 -9.541 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -14.138 13.704 -7.953 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -14.300 14.517 -6.393 1.00 0.00 H new ATOM 507 N ASP A 32 -8.343 14.115 -6.866 1.00 0.00 N ATOM 508 CA ASP A 32 -7.668 14.977 -5.915 1.00 0.00 C ATOM 509 C ASP A 32 -6.422 15.596 -6.573 1.00 0.00 C ATOM 510 O ASP A 32 -6.077 16.741 -6.270 1.00 0.00 O ATOM 511 CB ASP A 32 -7.302 14.208 -4.641 1.00 0.00 C ATOM 512 CG ASP A 32 -6.375 15.028 -3.725 1.00 0.00 C ATOM 513 OD1 ASP A 32 -6.867 15.956 -3.042 1.00 0.00 O ATOM 514 OD2 ASP A 32 -5.160 14.712 -3.662 1.00 0.00 O ATOM 0 H ASP A 32 -8.339 13.124 -6.625 1.00 0.00 H new ATOM 0 HA ASP A 32 -8.343 15.781 -5.623 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -8.211 13.948 -4.099 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -6.813 13.272 -4.909 1.00 0.00 H new ATOM 519 N LYS A 33 -5.768 14.883 -7.512 1.00 0.00 N ATOM 520 CA LYS A 33 -4.515 15.341 -8.113 1.00 0.00 C ATOM 521 C LYS A 33 -4.692 16.107 -9.428 1.00 0.00 C ATOM 522 O LYS A 33 -3.942 17.039 -9.718 1.00 0.00 O ATOM 523 CB LYS A 33 -3.665 14.096 -8.357 1.00 0.00 C ATOM 524 CG LYS A 33 -3.256 13.426 -7.034 1.00 0.00 C ATOM 525 CD LYS A 33 -1.999 14.076 -6.433 1.00 0.00 C ATOM 526 CE LYS A 33 -1.437 13.216 -5.298 1.00 0.00 C ATOM 527 NZ LYS A 33 -2.191 13.387 -4.021 1.00 0.00 N ATOM 0 H LYS A 33 -6.095 13.984 -7.867 1.00 0.00 H new ATOM 0 HA LYS A 33 -4.047 16.049 -7.429 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -4.223 13.387 -8.968 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -2.772 14.368 -8.920 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.078 13.496 -6.321 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -3.071 12.365 -7.205 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -1.243 14.204 -7.208 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -2.241 15.070 -6.057 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -1.464 12.167 -5.594 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -0.391 13.474 -5.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -2.340 12.458 -3.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -1.647 13.995 -3.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -3.112 13.828 -4.218 1.00 0.00 H new ATOM 541 N GLU A 34 -5.708 15.730 -10.195 1.00 0.00 N ATOM 542 CA GLU A 34 -5.941 16.130 -11.576 1.00 0.00 C ATOM 543 C GLU A 34 -7.187 16.997 -11.743 1.00 0.00 C ATOM 544 O GLU A 34 -7.209 17.896 -12.586 1.00 0.00 O ATOM 545 CB GLU A 34 -6.087 14.840 -12.409 1.00 0.00 C ATOM 546 CG GLU A 34 -4.833 13.959 -12.401 1.00 0.00 C ATOM 547 CD GLU A 34 -3.536 14.760 -12.576 1.00 0.00 C ATOM 548 OE1 GLU A 34 -3.352 15.422 -13.621 1.00 0.00 O ATOM 549 OE2 GLU A 34 -2.689 14.724 -11.660 1.00 0.00 O ATOM 0 H GLU A 34 -6.432 15.101 -9.849 1.00 0.00 H new ATOM 0 HA GLU A 34 -5.101 16.738 -11.911 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -6.929 14.263 -12.025 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -6.326 15.107 -13.438 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -4.789 13.408 -11.462 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -4.909 13.222 -13.200 1.00 0.00 H new ATOM 556 N GLY A 35 -8.219 16.737 -10.939 1.00 0.00 N ATOM 557 CA GLY A 35 -9.459 17.504 -10.954 1.00 0.00 C ATOM 558 C GLY A 35 -10.478 16.896 -11.914 1.00 0.00 C ATOM 559 O GLY A 35 -11.345 17.616 -12.404 1.00 0.00 O ATOM 0 H GLY A 35 -8.215 15.981 -10.254 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -9.879 17.539 -9.949 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -9.249 18.533 -11.247 1.00 0.00 H new ATOM 563 N ILE A 36 -10.371 15.589 -12.199 1.00 0.00 N ATOM 564 CA ILE A 36 -11.265 14.902 -13.121 1.00 0.00 C ATOM 565 C ILE A 36 -12.133 14.024 -12.241 1.00 0.00 C ATOM 566 O ILE A 36 -11.560 13.222 -11.507 1.00 0.00 O ATOM 567 CB ILE A 36 -10.483 14.023 -14.108 1.00 0.00 C ATOM 568 CG1 ILE A 36 -9.447 14.816 -14.918 1.00 0.00 C ATOM 569 CG2 ILE A 36 -11.477 13.358 -15.075 1.00 0.00 C ATOM 570 CD1 ILE A 36 -8.410 13.845 -15.454 1.00 0.00 C ATOM 0 H ILE A 36 -9.658 14.985 -11.791 1.00 0.00 H new ATOM 0 HA ILE A 36 -11.840 15.611 -13.717 1.00 0.00 H new ATOM 0 HB ILE A 36 -9.938 13.279 -13.526 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -9.932 15.344 -15.739 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -8.972 15.570 -14.290 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -10.933 12.731 -15.781 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -12.179 12.744 -14.510 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -12.025 14.127 -15.620 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -7.665 14.391 -16.033 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -7.922 13.337 -14.622 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -8.897 13.108 -16.093 1.00 0.00 H new ATOM 582 N PRO A 37 -13.463 14.101 -12.310 1.00 0.00 N ATOM 583 CA PRO A 37 -14.332 13.222 -11.547 1.00 0.00 C ATOM 584 C PRO A 37 -14.091 11.753 -11.911 1.00 0.00 C ATOM 585 O PRO A 37 -13.752 11.457 -13.055 1.00 0.00 O ATOM 586 CB PRO A 37 -15.761 13.694 -11.817 1.00 0.00 C ATOM 587 CG PRO A 37 -15.640 14.938 -12.700 1.00 0.00 C ATOM 588 CD PRO A 37 -14.212 14.917 -13.238 1.00 0.00 C ATOM 0 HA PRO A 37 -14.128 13.273 -10.477 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -16.340 12.917 -12.316 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -16.277 13.927 -10.885 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -16.366 14.915 -13.513 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -15.831 15.846 -12.128 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -14.178 14.499 -14.244 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -13.800 15.924 -13.297 1.00 0.00 H new ATOM 596 N PRO A 38 -14.295 10.807 -10.979 1.00 0.00 N ATOM 597 CA PRO A 38 -14.019 9.396 -11.235 1.00 0.00 C ATOM 598 C PRO A 38 -14.876 8.835 -12.349 1.00 0.00 C ATOM 599 O PRO A 38 -14.393 8.030 -13.142 1.00 0.00 O ATOM 600 CB PRO A 38 -14.322 8.677 -9.924 1.00 0.00 C ATOM 601 CG PRO A 38 -15.217 9.623 -9.131 1.00 0.00 C ATOM 602 CD PRO A 38 -14.765 10.998 -9.608 1.00 0.00 C ATOM 0 HA PRO A 38 -12.987 9.262 -11.558 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -14.822 7.726 -10.106 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -13.405 8.456 -9.378 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -16.273 9.450 -9.339 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -15.080 9.503 -8.056 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -15.586 11.714 -9.572 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -13.971 11.391 -8.973 1.00 0.00 H new ATOM 610 N ASP A 39 -16.119 9.300 -12.464 1.00 0.00 N ATOM 611 CA ASP A 39 -17.018 8.764 -13.486 1.00 0.00 C ATOM 612 C ASP A 39 -16.545 9.136 -14.894 1.00 0.00 C ATOM 613 O ASP A 39 -16.804 8.418 -15.858 1.00 0.00 O ATOM 614 CB ASP A 39 -18.448 9.253 -13.236 1.00 0.00 C ATOM 615 CG ASP A 39 -19.430 8.683 -14.275 1.00 0.00 C ATOM 616 OD1 ASP A 39 -19.737 7.467 -14.204 1.00 0.00 O ATOM 617 OD2 ASP A 39 -19.893 9.448 -15.154 1.00 0.00 O ATOM 0 H ASP A 39 -16.521 10.031 -11.877 1.00 0.00 H new ATOM 0 HA ASP A 39 -17.006 7.676 -13.418 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -18.764 8.959 -12.235 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -18.472 10.342 -13.270 1.00 0.00 H new ATOM 622 N GLN A 40 -15.768 10.215 -15.008 1.00 0.00 N ATOM 623 CA GLN A 40 -15.214 10.670 -16.286 1.00 0.00 C ATOM 624 C GLN A 40 -13.839 10.047 -16.537 1.00 0.00 C ATOM 625 O GLN A 40 -13.313 10.169 -17.638 1.00 0.00 O ATOM 626 CB GLN A 40 -15.191 12.210 -16.294 1.00 0.00 C ATOM 627 CG GLN A 40 -14.724 12.863 -17.613 1.00 0.00 C ATOM 628 CD GLN A 40 -15.573 12.559 -18.846 1.00 0.00 C ATOM 629 OE1 GLN A 40 -15.425 11.520 -19.485 1.00 0.00 O ATOM 630 NE2 GLN A 40 -16.450 13.466 -19.234 1.00 0.00 N ATOM 0 H GLN A 40 -15.504 10.800 -14.215 1.00 0.00 H new ATOM 0 HA GLN A 40 -15.843 10.338 -17.112 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -16.193 12.572 -16.065 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -14.538 12.550 -15.490 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -14.698 13.943 -17.471 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -13.701 12.543 -17.812 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -16.566 14.326 -18.697 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -17.012 13.307 -20.071 1.00 0.00 H new ATOM 639 N GLN A 41 -13.239 9.343 -15.576 1.00 0.00 N ATOM 640 CA GLN A 41 -11.982 8.642 -15.806 1.00 0.00 C ATOM 641 C GLN A 41 -12.268 7.273 -16.383 1.00 0.00 C ATOM 642 O GLN A 41 -13.236 6.611 -16.019 1.00 0.00 O ATOM 643 CB GLN A 41 -11.226 8.488 -14.479 1.00 0.00 C ATOM 644 CG GLN A 41 -10.567 9.798 -14.036 1.00 0.00 C ATOM 645 CD GLN A 41 -10.120 9.706 -12.596 1.00 0.00 C ATOM 646 OE1 GLN A 41 -9.406 8.781 -12.249 1.00 0.00 O ATOM 647 NE2 GLN A 41 -10.555 10.588 -11.716 1.00 0.00 N ATOM 0 H GLN A 41 -13.607 9.245 -14.630 1.00 0.00 H new ATOM 0 HA GLN A 41 -11.372 9.214 -16.505 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -11.916 8.150 -13.706 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -10.463 7.716 -14.584 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.711 10.016 -14.675 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -11.270 10.623 -14.153 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -11.152 11.358 -12.018 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -10.294 10.500 -10.734 1.00 0.00 H new ATOM 656 N ARG A 42 -11.337 6.810 -17.201 1.00 0.00 N ATOM 657 CA ARG A 42 -11.275 5.464 -17.742 1.00 0.00 C ATOM 658 C ARG A 42 -9.867 5.032 -17.382 1.00 0.00 C ATOM 659 O ARG A 42 -8.920 5.561 -17.941 1.00 0.00 O ATOM 660 CB ARG A 42 -11.555 5.599 -19.242 1.00 0.00 C ATOM 661 CG ARG A 42 -11.769 4.292 -20.003 1.00 0.00 C ATOM 662 CD ARG A 42 -12.188 4.613 -21.449 1.00 0.00 C ATOM 663 NE ARG A 42 -12.717 3.434 -22.161 1.00 0.00 N ATOM 664 CZ ARG A 42 -13.428 3.424 -23.302 1.00 0.00 C ATOM 665 NH1 ARG A 42 -13.683 4.546 -23.968 1.00 0.00 N ATOM 666 NH2 ARG A 42 -13.886 2.268 -23.766 1.00 0.00 N ATOM 0 H ARG A 42 -10.565 7.394 -17.522 1.00 0.00 H new ATOM 0 HA ARG A 42 -11.985 4.726 -17.369 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -12.441 6.221 -19.372 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -10.722 6.131 -19.701 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -10.853 3.701 -19.999 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -12.537 3.693 -19.513 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -12.946 5.397 -21.438 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -11.330 5.007 -21.993 1.00 0.00 H new ATOM 0 HE ARG A 42 -12.522 2.525 -21.741 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -13.337 5.438 -23.615 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -14.225 4.514 -24.832 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -13.697 1.404 -23.258 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -14.427 2.244 -24.630 1.00 0.00 H new ATOM 680 N LEU A 43 -9.704 4.240 -16.331 1.00 0.00 N ATOM 681 CA LEU A 43 -8.365 3.919 -15.832 1.00 0.00 C ATOM 682 C LEU A 43 -7.914 2.728 -16.632 1.00 0.00 C ATOM 683 O LEU A 43 -8.679 1.785 -16.802 1.00 0.00 O ATOM 684 CB LEU A 43 -8.406 3.622 -14.318 1.00 0.00 C ATOM 685 CG LEU A 43 -7.282 4.305 -13.528 1.00 0.00 C ATOM 686 CD1 LEU A 43 -7.336 5.843 -13.612 1.00 0.00 C ATOM 687 CD2 LEU A 43 -7.453 3.914 -12.060 1.00 0.00 C ATOM 0 H LEU A 43 -10.469 3.811 -15.810 1.00 0.00 H new ATOM 0 HA LEU A 43 -7.669 4.750 -15.950 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -9.367 3.945 -13.919 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -8.343 2.545 -14.166 1.00 0.00 H new ATOM 0 HG LEU A 43 -6.330 3.984 -13.951 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -6.516 6.268 -13.033 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.245 6.154 -14.653 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -8.285 6.196 -13.209 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -6.669 4.382 -11.465 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -8.427 4.250 -11.705 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -7.385 2.831 -11.962 1.00 0.00 H new ATOM 699 N ILE A 44 -6.690 2.753 -17.129 1.00 0.00 N ATOM 700 CA ILE A 44 -6.121 1.669 -17.916 1.00 0.00 C ATOM 701 C ILE A 44 -4.877 1.223 -17.182 1.00 0.00 C ATOM 702 O ILE A 44 -4.230 2.001 -16.486 1.00 0.00 O ATOM 703 CB ILE A 44 -5.884 2.137 -19.374 1.00 0.00 C ATOM 704 CG1 ILE A 44 -7.256 2.558 -19.959 1.00 0.00 C ATOM 705 CG2 ILE A 44 -5.182 1.063 -20.230 1.00 0.00 C ATOM 706 CD1 ILE A 44 -7.339 2.717 -21.479 1.00 0.00 C ATOM 0 H ILE A 44 -6.052 3.538 -16.996 1.00 0.00 H new ATOM 0 HA ILE A 44 -6.788 0.812 -18.013 1.00 0.00 H new ATOM 0 HB ILE A 44 -5.202 2.987 -19.384 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -7.997 1.819 -19.654 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -7.544 3.505 -19.502 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -5.039 1.441 -21.242 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -4.213 0.825 -19.792 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -5.797 0.164 -20.262 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -8.350 3.014 -21.759 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -6.633 3.482 -21.804 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -7.093 1.769 -21.958 1.00 0.00 H new ATOM 718 N PHE A 45 -4.546 -0.042 -17.360 1.00 0.00 N ATOM 719 CA PHE A 45 -3.335 -0.628 -16.845 1.00 0.00 C ATOM 720 C PHE A 45 -2.926 -1.664 -17.865 1.00 0.00 C ATOM 721 O PHE A 45 -3.715 -2.555 -18.132 1.00 0.00 O ATOM 722 CB PHE A 45 -3.676 -1.294 -15.510 1.00 0.00 C ATOM 723 CG PHE A 45 -2.561 -2.160 -14.985 1.00 0.00 C ATOM 724 CD1 PHE A 45 -1.308 -1.576 -14.758 1.00 0.00 C ATOM 725 CD2 PHE A 45 -2.748 -3.539 -14.787 1.00 0.00 C ATOM 726 CE1 PHE A 45 -0.244 -2.361 -14.292 1.00 0.00 C ATOM 727 CE2 PHE A 45 -1.692 -4.322 -14.293 1.00 0.00 C ATOM 728 CZ PHE A 45 -0.445 -3.730 -14.032 1.00 0.00 C ATOM 0 H PHE A 45 -5.128 -0.700 -17.878 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.534 0.094 -16.683 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -3.908 -0.524 -14.774 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -4.574 -1.900 -15.631 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -1.162 -0.522 -14.942 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -3.700 -3.995 -15.014 1.00 0.00 H new ATOM 0 HE1 PHE A 45 0.727 -1.917 -14.133 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -1.838 -5.377 -14.114 1.00 0.00 H new ATOM 0 HZ PHE A 45 0.361 -4.326 -13.631 1.00 0.00 H new ATOM 738 N ALA A 46 -1.755 -1.545 -18.484 1.00 0.00 N ATOM 739 CA ALA A 46 -1.245 -2.543 -19.433 1.00 0.00 C ATOM 740 C ALA A 46 -2.175 -2.813 -20.633 1.00 0.00 C ATOM 741 O ALA A 46 -2.146 -3.888 -21.231 1.00 0.00 O ATOM 742 CB ALA A 46 -0.940 -3.829 -18.650 1.00 0.00 C ATOM 0 H ALA A 46 -1.127 -0.753 -18.345 1.00 0.00 H new ATOM 0 HA ALA A 46 -0.339 -2.142 -19.888 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -0.559 -4.589 -19.332 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -0.192 -3.620 -17.885 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -1.852 -4.192 -18.176 1.00 0.00 H new ATOM 748 N GLY A 47 -3.040 -1.845 -20.961 1.00 0.00 N ATOM 749 CA GLY A 47 -4.069 -1.959 -22.002 1.00 0.00 C ATOM 750 C GLY A 47 -5.405 -2.488 -21.481 1.00 0.00 C ATOM 751 O GLY A 47 -6.404 -2.453 -22.200 1.00 0.00 O ATOM 0 H GLY A 47 -3.043 -0.937 -20.497 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -4.226 -0.980 -22.455 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -3.707 -2.620 -22.789 1.00 0.00 H new ATOM 755 N LYS A 48 -5.453 -2.946 -20.230 1.00 0.00 N ATOM 756 CA LYS A 48 -6.642 -3.449 -19.570 1.00 0.00 C ATOM 757 C LYS A 48 -7.301 -2.261 -18.898 1.00 0.00 C ATOM 758 O LYS A 48 -6.703 -1.626 -18.040 1.00 0.00 O ATOM 759 CB LYS A 48 -6.202 -4.551 -18.588 1.00 0.00 C ATOM 760 CG LYS A 48 -7.379 -5.233 -17.886 1.00 0.00 C ATOM 761 CD LYS A 48 -6.987 -6.513 -17.126 1.00 0.00 C ATOM 762 CE LYS A 48 -6.609 -7.661 -18.081 1.00 0.00 C ATOM 763 NZ LYS A 48 -6.319 -8.928 -17.358 1.00 0.00 N ATOM 0 H LYS A 48 -4.628 -2.975 -19.631 1.00 0.00 H new ATOM 0 HA LYS A 48 -7.368 -3.898 -20.247 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -5.624 -5.301 -19.128 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -5.540 -4.118 -17.838 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -7.831 -4.530 -17.187 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -8.140 -5.479 -18.627 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -6.146 -6.299 -16.466 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -7.817 -6.827 -16.493 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -7.424 -7.827 -18.786 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -5.736 -7.371 -18.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -6.070 -9.670 -18.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -5.524 -8.780 -16.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -7.160 -9.221 -16.821 1.00 0.00 H new ATOM 777 N GLN A 49 -8.499 -1.898 -19.324 1.00 0.00 N ATOM 778 CA GLN A 49 -9.327 -0.921 -18.625 1.00 0.00 C ATOM 779 C GLN A 49 -9.742 -1.565 -17.301 1.00 0.00 C ATOM 780 O GLN A 49 -10.059 -2.756 -17.266 1.00 0.00 O ATOM 781 CB GLN A 49 -10.572 -0.610 -19.472 1.00 0.00 C ATOM 782 CG GLN A 49 -10.222 0.163 -20.752 1.00 0.00 C ATOM 783 CD GLN A 49 -11.293 -0.008 -21.830 1.00 0.00 C ATOM 784 OE1 GLN A 49 -12.304 0.686 -21.828 1.00 0.00 O ATOM 785 NE2 GLN A 49 -11.109 -0.916 -22.775 1.00 0.00 N ATOM 0 H GLN A 49 -8.930 -2.273 -20.169 1.00 0.00 H new ATOM 0 HA GLN A 49 -8.788 0.011 -18.453 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -11.072 -1.542 -19.737 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -11.277 -0.028 -18.879 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -10.108 1.221 -20.518 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -9.262 -0.184 -21.135 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -10.267 -1.491 -22.773 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -11.810 -1.041 -23.506 1.00 0.00 H new ATOM 794 N LEU A 50 -9.753 -0.778 -16.226 1.00 0.00 N ATOM 795 CA LEU A 50 -10.154 -1.244 -14.896 1.00 0.00 C ATOM 796 C LEU A 50 -11.554 -0.702 -14.595 1.00 0.00 C ATOM 797 O LEU A 50 -11.929 0.325 -15.171 1.00 0.00 O ATOM 798 CB LEU A 50 -9.149 -0.798 -13.815 1.00 0.00 C ATOM 799 CG LEU A 50 -7.652 -0.893 -14.168 1.00 0.00 C ATOM 800 CD1 LEU A 50 -6.816 -0.525 -12.940 1.00 0.00 C ATOM 801 CD2 LEU A 50 -7.254 -2.282 -14.667 1.00 0.00 C ATOM 0 H LEU A 50 -9.483 0.205 -16.252 1.00 0.00 H new ATOM 0 HA LEU A 50 -10.167 -2.334 -14.885 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -9.370 0.237 -13.554 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -9.325 -1.397 -12.922 1.00 0.00 H new ATOM 0 HG LEU A 50 -7.462 -0.193 -14.982 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -5.757 -0.592 -13.188 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -7.053 0.493 -12.630 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -7.042 -1.214 -12.126 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -6.190 -2.293 -14.901 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -7.463 -3.020 -13.893 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -7.825 -2.524 -15.563 1.00 0.00 H new ATOM 813 N GLU A 51 -12.298 -1.312 -13.665 1.00 0.00 N ATOM 814 CA GLU A 51 -13.629 -0.830 -13.280 1.00 0.00 C ATOM 815 C GLU A 51 -13.641 -0.449 -11.800 1.00 0.00 C ATOM 816 O GLU A 51 -12.864 -0.982 -11.013 1.00 0.00 O ATOM 817 CB GLU A 51 -14.734 -1.817 -13.698 1.00 0.00 C ATOM 818 CG GLU A 51 -14.795 -3.103 -12.874 1.00 0.00 C ATOM 819 CD GLU A 51 -15.924 -4.031 -13.359 1.00 0.00 C ATOM 820 OE1 GLU A 51 -15.696 -4.853 -14.281 1.00 0.00 O ATOM 821 OE2 GLU A 51 -17.054 -3.948 -12.817 1.00 0.00 O ATOM 0 H GLU A 51 -11.997 -2.147 -13.162 1.00 0.00 H new ATOM 0 HA GLU A 51 -13.859 0.082 -13.830 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -15.697 -1.312 -13.628 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -14.588 -2.081 -14.745 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -13.840 -3.625 -12.940 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -14.951 -2.856 -11.824 1.00 0.00 H new ATOM 828 N ASP A 52 -14.530 0.474 -11.427 1.00 0.00 N ATOM 829 CA ASP A 52 -14.572 1.150 -10.128 1.00 0.00 C ATOM 830 C ASP A 52 -14.625 0.164 -8.971 1.00 0.00 C ATOM 831 O ASP A 52 -13.967 0.367 -7.948 1.00 0.00 O ATOM 832 CB ASP A 52 -15.782 2.101 -10.065 1.00 0.00 C ATOM 833 CG ASP A 52 -15.475 3.462 -10.692 1.00 0.00 C ATOM 834 OD1 ASP A 52 -15.286 3.518 -11.930 1.00 0.00 O ATOM 835 OD2 ASP A 52 -15.380 4.467 -9.953 1.00 0.00 O ATOM 0 H ASP A 52 -15.275 0.785 -12.051 1.00 0.00 H new ATOM 0 HA ASP A 52 -13.650 1.723 -10.029 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -16.627 1.646 -10.581 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -16.080 2.240 -9.026 1.00 0.00 H new ATOM 840 N GLY A 53 -15.372 -0.925 -9.155 1.00 0.00 N ATOM 841 CA GLY A 53 -15.659 -1.902 -8.117 1.00 0.00 C ATOM 842 C GLY A 53 -14.560 -2.943 -7.927 1.00 0.00 C ATOM 843 O GLY A 53 -14.810 -3.974 -7.297 1.00 0.00 O ATOM 0 H GLY A 53 -15.802 -1.153 -10.052 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -15.818 -1.379 -7.174 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -16.591 -2.412 -8.360 1.00 0.00 H new ATOM 847 N ARG A 54 -13.366 -2.734 -8.496 1.00 0.00 N ATOM 848 CA ARG A 54 -12.234 -3.660 -8.437 1.00 0.00 C ATOM 849 C ARG A 54 -11.059 -2.984 -7.776 1.00 0.00 C ATOM 850 O ARG A 54 -11.147 -1.802 -7.484 1.00 0.00 O ATOM 851 CB ARG A 54 -11.909 -4.085 -9.869 1.00 0.00 C ATOM 852 CG ARG A 54 -12.997 -4.968 -10.511 1.00 0.00 C ATOM 853 CD ARG A 54 -13.129 -6.351 -9.875 1.00 0.00 C ATOM 854 NE ARG A 54 -13.933 -6.360 -8.637 1.00 0.00 N ATOM 855 CZ ARG A 54 -13.873 -7.253 -7.640 1.00 0.00 C ATOM 856 NH1 ARG A 54 -13.013 -8.268 -7.658 1.00 0.00 N ATOM 857 NH2 ARG A 54 -14.687 -7.112 -6.597 1.00 0.00 N ATOM 0 H ARG A 54 -13.157 -1.888 -9.026 1.00 0.00 H new ATOM 0 HA ARG A 54 -12.474 -4.543 -7.845 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -11.768 -3.194 -10.481 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -10.963 -4.627 -9.873 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -13.956 -4.454 -10.441 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -12.775 -5.087 -11.572 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -13.581 -7.031 -10.597 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -12.134 -6.736 -9.654 1.00 0.00 H new ATOM 0 HE ARG A 54 -14.608 -5.603 -8.529 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -12.375 -8.382 -8.446 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -12.991 -8.932 -6.884 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -15.344 -6.333 -6.565 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -14.654 -7.783 -5.830 1.00 0.00 H new ATOM 871 N THR A 55 -9.964 -3.689 -7.532 1.00 0.00 N ATOM 872 CA THR A 55 -8.849 -3.200 -6.742 1.00 0.00 C ATOM 873 C THR A 55 -7.563 -3.430 -7.497 1.00 0.00 C ATOM 874 O THR A 55 -7.518 -4.184 -8.464 1.00 0.00 O ATOM 875 CB THR A 55 -8.800 -3.941 -5.399 1.00 0.00 C ATOM 876 OG1 THR A 55 -8.884 -5.335 -5.643 1.00 0.00 O ATOM 877 CG2 THR A 55 -9.918 -3.528 -4.449 1.00 0.00 C ATOM 0 H THR A 55 -9.825 -4.636 -7.886 1.00 0.00 H new ATOM 0 HA THR A 55 -8.976 -2.134 -6.556 1.00 0.00 H new ATOM 0 HB THR A 55 -7.859 -3.679 -4.915 1.00 0.00 H new ATOM 0 HG1 THR A 55 -8.852 -5.819 -4.791 1.00 0.00 H new ATOM 0 HG21 THR A 55 -9.829 -4.087 -3.517 1.00 0.00 H new ATOM 0 HG22 THR A 55 -9.843 -2.461 -4.241 1.00 0.00 H new ATOM 0 HG23 THR A 55 -10.883 -3.741 -4.909 1.00 0.00 H new ATOM 885 N LEU A 56 -6.490 -2.803 -7.036 1.00 0.00 N ATOM 886 CA LEU A 56 -5.186 -2.955 -7.674 1.00 0.00 C ATOM 887 C LEU A 56 -4.773 -4.430 -7.684 1.00 0.00 C ATOM 888 O LEU A 56 -4.420 -4.968 -8.732 1.00 0.00 O ATOM 889 CB LEU A 56 -4.174 -2.020 -6.977 1.00 0.00 C ATOM 890 CG LEU A 56 -4.624 -0.547 -6.964 1.00 0.00 C ATOM 891 CD1 LEU A 56 -3.522 0.347 -6.403 1.00 0.00 C ATOM 892 CD2 LEU A 56 -5.011 -0.047 -8.367 1.00 0.00 C ATOM 0 H LEU A 56 -6.494 -2.185 -6.224 1.00 0.00 H new ATOM 0 HA LEU A 56 -5.224 -2.654 -8.721 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -4.023 -2.357 -5.951 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -3.211 -2.095 -7.482 1.00 0.00 H new ATOM 0 HG LEU A 56 -5.506 -0.494 -6.325 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -3.859 1.383 -6.402 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -3.289 0.041 -5.383 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -2.630 0.256 -7.022 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -5.322 0.996 -8.309 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -4.153 -0.133 -9.034 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -5.833 -0.649 -8.754 1.00 0.00 H new ATOM 904 N SER A 57 -4.951 -5.117 -6.564 1.00 0.00 N ATOM 905 CA SER A 57 -4.708 -6.550 -6.446 1.00 0.00 C ATOM 906 C SER A 57 -5.609 -7.379 -7.357 1.00 0.00 C ATOM 907 O SER A 57 -5.139 -8.411 -7.842 1.00 0.00 O ATOM 908 CB SER A 57 -4.877 -7.030 -5.007 1.00 0.00 C ATOM 909 OG SER A 57 -3.640 -6.934 -4.320 1.00 0.00 O ATOM 0 H SER A 57 -5.274 -4.688 -5.697 1.00 0.00 H new ATOM 0 HA SER A 57 -3.675 -6.699 -6.761 1.00 0.00 H new ATOM 0 HB2 SER A 57 -5.632 -6.430 -4.500 1.00 0.00 H new ATOM 0 HB3 SER A 57 -5.230 -8.061 -4.997 1.00 0.00 H new ATOM 0 HG SER A 57 -3.754 -7.242 -3.397 1.00 0.00 H new ATOM 915 N ASP A 58 -6.842 -6.953 -7.670 1.00 0.00 N ATOM 916 CA ASP A 58 -7.689 -7.712 -8.598 1.00 0.00 C ATOM 917 C ASP A 58 -7.012 -7.827 -9.966 1.00 0.00 C ATOM 918 O ASP A 58 -7.118 -8.849 -10.650 1.00 0.00 O ATOM 919 CB ASP A 58 -9.044 -7.043 -8.763 1.00 0.00 C ATOM 920 CG ASP A 58 -9.958 -7.931 -9.623 1.00 0.00 C ATOM 921 OD1 ASP A 58 -10.677 -8.776 -9.041 1.00 0.00 O ATOM 922 OD2 ASP A 58 -10.021 -7.756 -10.861 1.00 0.00 O ATOM 0 H ASP A 58 -7.268 -6.103 -7.301 1.00 0.00 H new ATOM 0 HA ASP A 58 -7.834 -8.708 -8.180 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -9.498 -6.874 -7.787 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -8.924 -6.066 -9.232 1.00 0.00 H new ATOM 927 N TYR A 59 -6.221 -6.805 -10.294 1.00 0.00 N ATOM 928 CA TYR A 59 -5.461 -6.691 -11.532 1.00 0.00 C ATOM 929 C TYR A 59 -3.980 -7.042 -11.321 1.00 0.00 C ATOM 930 O TYR A 59 -3.174 -6.932 -12.244 1.00 0.00 O ATOM 931 CB TYR A 59 -5.675 -5.277 -12.067 1.00 0.00 C ATOM 932 CG TYR A 59 -7.132 -4.962 -12.356 1.00 0.00 C ATOM 933 CD1 TYR A 59 -7.792 -5.638 -13.400 1.00 0.00 C ATOM 934 CD2 TYR A 59 -7.832 -4.025 -11.569 1.00 0.00 C ATOM 935 CE1 TYR A 59 -9.145 -5.360 -13.682 1.00 0.00 C ATOM 936 CE2 TYR A 59 -9.185 -3.766 -11.830 1.00 0.00 C ATOM 937 CZ TYR A 59 -9.840 -4.411 -12.900 1.00 0.00 C ATOM 938 OH TYR A 59 -11.122 -4.068 -13.204 1.00 0.00 O ATOM 0 H TYR A 59 -6.089 -6.003 -9.677 1.00 0.00 H new ATOM 0 HA TYR A 59 -5.812 -7.411 -12.272 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -5.291 -4.559 -11.342 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -5.094 -5.149 -12.980 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -7.260 -6.372 -13.987 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -7.327 -3.508 -10.767 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -9.647 -5.870 -14.491 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -9.728 -3.069 -11.209 1.00 0.00 H new ATOM 0 HH TYR A 59 -11.573 -4.829 -13.625 1.00 0.00 H new ATOM 948 N ASN A 60 -3.624 -7.492 -10.112 1.00 0.00 N ATOM 949 CA ASN A 60 -2.275 -7.834 -9.651 1.00 0.00 C ATOM 950 C ASN A 60 -1.287 -6.670 -9.796 1.00 0.00 C ATOM 951 O ASN A 60 -0.074 -6.859 -9.884 1.00 0.00 O ATOM 952 CB ASN A 60 -1.803 -9.187 -10.223 1.00 0.00 C ATOM 953 CG ASN A 60 -2.014 -10.344 -9.247 1.00 0.00 C ATOM 954 OD1 ASN A 60 -1.101 -11.125 -8.992 1.00 0.00 O ATOM 955 ND2 ASN A 60 -3.201 -10.487 -8.670 1.00 0.00 N ATOM 0 H ASN A 60 -4.320 -7.636 -9.380 1.00 0.00 H new ATOM 0 HA ASN A 60 -2.316 -7.993 -8.574 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -2.342 -9.394 -11.148 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -0.745 -9.120 -10.478 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -3.359 -11.249 -8.011 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -3.955 -9.835 -8.886 1.00 0.00 H new ATOM 962 N ILE A 61 -1.817 -5.447 -9.805 1.00 0.00 N ATOM 963 CA ILE A 61 -1.054 -4.216 -9.695 1.00 0.00 C ATOM 964 C ILE A 61 -0.599 -4.214 -8.242 1.00 0.00 C ATOM 965 O ILE A 61 -1.414 -4.450 -7.347 1.00 0.00 O ATOM 966 CB ILE A 61 -1.984 -3.019 -9.963 1.00 0.00 C ATOM 967 CG1 ILE A 61 -2.548 -3.007 -11.390 1.00 0.00 C ATOM 968 CG2 ILE A 61 -1.279 -1.679 -9.666 1.00 0.00 C ATOM 969 CD1 ILE A 61 -3.865 -2.240 -11.454 1.00 0.00 C ATOM 0 H ILE A 61 -2.821 -5.287 -9.892 1.00 0.00 H new ATOM 0 HA ILE A 61 -0.224 -4.147 -10.399 1.00 0.00 H new ATOM 0 HB ILE A 61 -2.825 -3.139 -9.280 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -1.825 -2.551 -12.066 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -2.703 -4.030 -11.732 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -1.964 -0.855 -9.866 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -0.975 -1.652 -8.620 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -0.399 -1.582 -10.302 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -4.241 -2.248 -12.477 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -4.594 -2.713 -10.796 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -3.702 -1.210 -11.135 1.00 0.00 H new ATOM 981 N GLN A 62 0.678 -3.958 -7.989 1.00 0.00 N ATOM 982 CA GLN A 62 1.248 -3.917 -6.646 1.00 0.00 C ATOM 983 C GLN A 62 1.967 -2.575 -6.500 1.00 0.00 C ATOM 984 O GLN A 62 1.700 -1.638 -7.250 1.00 0.00 O ATOM 985 CB GLN A 62 2.147 -5.151 -6.426 1.00 0.00 C ATOM 986 CG GLN A 62 1.397 -6.479 -6.628 1.00 0.00 C ATOM 987 CD GLN A 62 0.440 -6.862 -5.490 1.00 0.00 C ATOM 988 OE1 GLN A 62 0.847 -7.425 -4.474 1.00 0.00 O ATOM 989 NE2 GLN A 62 -0.853 -6.604 -5.641 1.00 0.00 N ATOM 0 H GLN A 62 1.360 -3.769 -8.724 1.00 0.00 H new ATOM 0 HA GLN A 62 0.490 -3.974 -5.865 1.00 0.00 H new ATOM 0 HB2 GLN A 62 2.991 -5.107 -7.114 1.00 0.00 H new ATOM 0 HB3 GLN A 62 2.557 -5.121 -5.417 1.00 0.00 H new ATOM 0 HG2 GLN A 62 0.829 -6.421 -7.556 1.00 0.00 H new ATOM 0 HG3 GLN A 62 2.129 -7.277 -6.752 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -1.185 -6.137 -6.485 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -1.515 -6.873 -4.913 1.00 0.00 H new ATOM 998 N LYS A 63 2.838 -2.431 -5.504 1.00 0.00 N ATOM 999 CA LYS A 63 3.653 -1.245 -5.312 1.00 0.00 C ATOM 1000 C LYS A 63 4.532 -0.983 -6.527 1.00 0.00 C ATOM 1001 O LYS A 63 4.824 -1.869 -7.326 1.00 0.00 O ATOM 1002 CB LYS A 63 4.492 -1.398 -4.027 1.00 0.00 C ATOM 1003 CG LYS A 63 5.699 -2.333 -4.141 1.00 0.00 C ATOM 1004 CD LYS A 63 6.354 -2.530 -2.763 1.00 0.00 C ATOM 1005 CE LYS A 63 7.731 -3.186 -2.941 1.00 0.00 C ATOM 1006 NZ LYS A 63 8.389 -3.497 -1.643 1.00 0.00 N ATOM 0 H LYS A 63 2.996 -3.150 -4.798 1.00 0.00 H new ATOM 0 HA LYS A 63 3.001 -0.379 -5.199 1.00 0.00 H new ATOM 0 HB2 LYS A 63 4.844 -0.412 -3.723 1.00 0.00 H new ATOM 0 HB3 LYS A 63 3.844 -1.764 -3.231 1.00 0.00 H new ATOM 0 HG2 LYS A 63 5.385 -3.296 -4.543 1.00 0.00 H new ATOM 0 HG3 LYS A 63 6.425 -1.917 -4.840 1.00 0.00 H new ATOM 0 HD2 LYS A 63 6.459 -1.570 -2.258 1.00 0.00 H new ATOM 0 HD3 LYS A 63 5.720 -3.154 -2.133 1.00 0.00 H new ATOM 0 HE2 LYS A 63 7.620 -4.105 -3.517 1.00 0.00 H new ATOM 0 HE3 LYS A 63 8.373 -2.522 -3.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 9.314 -3.938 -1.820 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 8.522 -2.619 -1.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 7.792 -4.152 -1.099 1.00 0.00 H new ATOM 1020 N GLU A 64 4.969 0.271 -6.580 1.00 0.00 N ATOM 1021 CA GLU A 64 5.851 0.858 -7.579 1.00 0.00 C ATOM 1022 C GLU A 64 5.453 0.388 -8.981 1.00 0.00 C ATOM 1023 O GLU A 64 6.273 -0.051 -9.788 1.00 0.00 O ATOM 1024 CB GLU A 64 7.339 0.747 -7.160 1.00 0.00 C ATOM 1025 CG GLU A 64 8.031 -0.610 -7.303 1.00 0.00 C ATOM 1026 CD GLU A 64 9.377 -0.636 -6.553 1.00 0.00 C ATOM 1027 OE1 GLU A 64 9.397 -0.993 -5.350 1.00 0.00 O ATOM 1028 OE2 GLU A 64 10.424 -0.307 -7.159 1.00 0.00 O ATOM 0 H GLU A 64 4.695 0.953 -5.873 1.00 0.00 H new ATOM 0 HA GLU A 64 5.720 1.939 -7.635 1.00 0.00 H new ATOM 0 HB2 GLU A 64 7.905 1.472 -7.745 1.00 0.00 H new ATOM 0 HB3 GLU A 64 7.414 1.051 -6.116 1.00 0.00 H new ATOM 0 HG2 GLU A 64 7.381 -1.394 -6.915 1.00 0.00 H new ATOM 0 HG3 GLU A 64 8.196 -0.826 -8.358 1.00 0.00 H new ATOM 1035 N SER A 65 4.142 0.474 -9.243 1.00 0.00 N ATOM 1036 CA SER A 65 3.565 -0.004 -10.503 1.00 0.00 C ATOM 1037 C SER A 65 2.897 1.161 -11.212 1.00 0.00 C ATOM 1038 O SER A 65 2.422 2.086 -10.556 1.00 0.00 O ATOM 1039 CB SER A 65 2.590 -1.167 -10.262 1.00 0.00 C ATOM 1040 OG SER A 65 3.264 -2.308 -9.752 1.00 0.00 O ATOM 0 H SER A 65 3.461 0.872 -8.596 1.00 0.00 H new ATOM 0 HA SER A 65 4.357 -0.395 -11.142 1.00 0.00 H new ATOM 0 HB2 SER A 65 1.816 -0.856 -9.561 1.00 0.00 H new ATOM 0 HB3 SER A 65 2.090 -1.425 -11.196 1.00 0.00 H new ATOM 0 HG SER A 65 3.746 -2.065 -8.934 1.00 0.00 H new ATOM 1046 N THR A 66 2.867 1.125 -12.541 1.00 0.00 N ATOM 1047 CA THR A 66 2.408 2.241 -13.364 1.00 0.00 C ATOM 1048 C THR A 66 0.993 1.960 -13.862 1.00 0.00 C ATOM 1049 O THR A 66 0.653 0.828 -14.187 1.00 0.00 O ATOM 1050 CB THR A 66 3.386 2.513 -14.535 1.00 0.00 C ATOM 1051 OG1 THR A 66 4.723 2.554 -14.052 1.00 0.00 O ATOM 1052 CG2 THR A 66 3.127 3.843 -15.264 1.00 0.00 C ATOM 0 H THR A 66 3.163 0.313 -13.083 1.00 0.00 H new ATOM 0 HA THR A 66 2.387 3.146 -12.757 1.00 0.00 H new ATOM 0 HB THR A 66 3.226 1.698 -15.241 1.00 0.00 H new ATOM 0 HG1 THR A 66 5.335 2.725 -14.798 1.00 0.00 H new ATOM 0 HG21 THR A 66 3.851 3.963 -16.070 1.00 0.00 H new ATOM 0 HG22 THR A 66 2.119 3.840 -15.679 1.00 0.00 H new ATOM 0 HG23 THR A 66 3.228 4.669 -14.560 1.00 0.00 H new ATOM 1060 N LEU A 67 0.187 3.013 -13.943 1.00 0.00 N ATOM 1061 CA LEU A 67 -1.201 3.051 -14.385 1.00 0.00 C ATOM 1062 C LEU A 67 -1.378 4.127 -15.453 1.00 0.00 C ATOM 1063 O LEU A 67 -0.482 4.947 -15.634 1.00 0.00 O ATOM 1064 CB LEU A 67 -2.047 3.407 -13.149 1.00 0.00 C ATOM 1065 CG LEU A 67 -3.242 2.499 -12.926 1.00 0.00 C ATOM 1066 CD1 LEU A 67 -2.760 1.117 -12.495 1.00 0.00 C ATOM 1067 CD2 LEU A 67 -4.109 3.085 -11.818 1.00 0.00 C ATOM 0 H LEU A 67 0.517 3.941 -13.678 1.00 0.00 H new ATOM 0 HA LEU A 67 -1.503 2.095 -14.812 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -1.410 3.373 -12.265 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -2.399 4.434 -13.248 1.00 0.00 H new ATOM 0 HG LEU A 67 -3.815 2.416 -13.850 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -3.619 0.466 -12.335 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -2.124 0.694 -13.273 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -2.192 1.202 -11.569 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -4.971 2.439 -11.650 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -3.526 3.158 -10.900 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -4.451 4.078 -12.110 1.00 0.00 H new ATOM 1079 N HIS A 68 -2.559 4.217 -16.072 1.00 0.00 N ATOM 1080 CA HIS A 68 -2.827 5.207 -17.126 1.00 0.00 C ATOM 1081 C HIS A 68 -4.158 5.911 -16.901 1.00 0.00 C ATOM 1082 O HIS A 68 -5.165 5.251 -16.652 1.00 0.00 O ATOM 1083 CB HIS A 68 -2.842 4.532 -18.513 1.00 0.00 C ATOM 1084 CG HIS A 68 -1.510 4.438 -19.211 1.00 0.00 C ATOM 1085 ND1 HIS A 68 -1.033 3.298 -19.863 1.00 0.00 N ATOM 1086 CD2 HIS A 68 -0.653 5.476 -19.437 1.00 0.00 C ATOM 1087 CE1 HIS A 68 0.119 3.671 -20.444 1.00 0.00 C ATOM 1088 NE2 HIS A 68 0.381 4.964 -20.191 1.00 0.00 N ATOM 0 H HIS A 68 -3.352 3.612 -15.861 1.00 0.00 H new ATOM 0 HA HIS A 68 -2.027 5.946 -17.086 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -3.244 3.525 -18.402 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -3.530 5.081 -19.156 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -1.468 2.376 -19.892 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -0.763 6.494 -19.094 1.00 0.00 H new ATOM 0 HE1 HIS A 68 0.748 3.021 -21.034 1.00 0.00 H new ATOM 1096 N LEU A 69 -4.179 7.245 -17.027 1.00 0.00 N ATOM 1097 CA LEU A 69 -5.421 8.027 -17.073 1.00 0.00 C ATOM 1098 C LEU A 69 -5.825 8.078 -18.529 1.00 0.00 C ATOM 1099 O LEU A 69 -5.066 8.583 -19.348 1.00 0.00 O ATOM 1100 CB LEU A 69 -5.224 9.486 -16.555 1.00 0.00 C ATOM 1101 CG LEU A 69 -6.029 10.656 -17.224 1.00 0.00 C ATOM 1102 CD1 LEU A 69 -7.526 10.507 -16.955 1.00 0.00 C ATOM 1103 CD2 LEU A 69 -5.597 12.013 -16.690 1.00 0.00 C ATOM 0 H LEU A 69 -3.334 7.812 -17.100 1.00 0.00 H new ATOM 0 HA LEU A 69 -6.172 7.562 -16.434 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -5.463 9.491 -15.492 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -4.164 9.725 -16.645 1.00 0.00 H new ATOM 0 HG LEU A 69 -5.824 10.601 -18.293 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -8.064 11.329 -17.428 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -7.877 9.560 -17.365 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.706 10.526 -15.880 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -6.177 12.797 -17.177 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -5.767 12.051 -15.614 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -4.537 12.164 -16.896 1.00 0.00 H new ATOM 1115 N VAL A 70 -7.037 7.645 -18.823 1.00 0.00 N ATOM 1116 CA VAL A 70 -7.706 7.806 -20.102 1.00 0.00 C ATOM 1117 C VAL A 70 -9.071 8.391 -19.745 1.00 0.00 C ATOM 1118 O VAL A 70 -9.505 8.320 -18.600 1.00 0.00 O ATOM 1119 CB VAL A 70 -7.678 6.443 -20.815 1.00 0.00 C ATOM 1120 CG1 VAL A 70 -8.540 6.406 -22.063 1.00 0.00 C ATOM 1121 CG2 VAL A 70 -6.229 6.085 -21.188 1.00 0.00 C ATOM 0 H VAL A 70 -7.611 7.147 -18.143 1.00 0.00 H new ATOM 0 HA VAL A 70 -7.247 8.484 -20.821 1.00 0.00 H new ATOM 0 HB VAL A 70 -8.090 5.714 -20.117 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -8.477 5.418 -22.519 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -9.576 6.617 -21.796 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -8.187 7.156 -22.771 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -6.211 5.119 -21.693 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -5.825 6.849 -21.852 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -5.623 6.033 -20.284 1.00 0.00 H new ATOM 1131 N LEU A 71 -9.753 9.022 -20.687 1.00 0.00 N ATOM 1132 CA LEU A 71 -11.049 9.627 -20.431 1.00 0.00 C ATOM 1133 C LEU A 71 -12.138 8.589 -20.704 1.00 0.00 C ATOM 1134 O LEU A 71 -11.990 7.750 -21.583 1.00 0.00 O ATOM 1135 CB LEU A 71 -11.178 10.843 -21.358 1.00 0.00 C ATOM 1136 CG LEU A 71 -12.362 11.745 -20.964 1.00 0.00 C ATOM 1137 CD1 LEU A 71 -11.880 12.897 -20.086 1.00 0.00 C ATOM 1138 CD2 LEU A 71 -13.097 12.257 -22.194 1.00 0.00 C ATOM 0 H LEU A 71 -9.425 9.129 -21.647 1.00 0.00 H new ATOM 0 HA LEU A 71 -11.152 9.954 -19.396 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.255 11.422 -21.327 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -11.307 10.503 -22.386 1.00 0.00 H new ATOM 0 HG LEU A 71 -13.071 11.150 -20.388 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -12.727 13.527 -19.815 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -11.420 12.498 -19.182 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -11.148 13.490 -20.634 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -13.928 12.891 -21.884 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -12.411 12.835 -22.813 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -13.479 11.412 -22.767 1.00 0.00 H new ATOM 1150 N ARG A 72 -13.250 8.658 -19.980 1.00 0.00 N ATOM 1151 CA ARG A 72 -14.461 7.858 -20.218 1.00 0.00 C ATOM 1152 C ARG A 72 -15.216 8.325 -21.458 1.00 0.00 C ATOM 1153 O ARG A 72 -16.002 7.561 -21.998 1.00 0.00 O ATOM 1154 CB ARG A 72 -15.343 7.949 -18.950 1.00 0.00 C ATOM 1155 CG ARG A 72 -16.450 6.886 -18.825 1.00 0.00 C ATOM 1156 CD ARG A 72 -16.055 5.732 -17.890 1.00 0.00 C ATOM 1157 NE ARG A 72 -17.186 4.805 -17.676 1.00 0.00 N ATOM 1158 CZ ARG A 72 -18.219 4.978 -16.833 1.00 0.00 C ATOM 1159 NH1 ARG A 72 -18.316 6.092 -16.119 1.00 0.00 N ATOM 1160 NH2 ARG A 72 -19.146 4.036 -16.712 1.00 0.00 N ATOM 0 H ARG A 72 -13.343 9.290 -19.185 1.00 0.00 H new ATOM 0 HA ARG A 72 -14.185 6.821 -20.410 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -14.697 7.878 -18.075 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -15.808 8.935 -18.924 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -17.360 7.356 -18.452 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -16.679 6.487 -19.813 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -15.212 5.188 -18.316 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -15.725 6.134 -16.932 1.00 0.00 H new ATOM 0 HE ARG A 72 -17.183 3.945 -18.225 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -17.606 6.819 -16.209 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -19.100 6.222 -15.480 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -19.076 3.178 -17.259 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -19.929 4.170 -16.072 1.00 0.00 H new ATOM 1174 N LEU A 73 -15.024 9.576 -21.892 1.00 0.00 N ATOM 1175 CA LEU A 73 -15.843 10.231 -22.927 1.00 0.00 C ATOM 1176 C LEU A 73 -17.299 10.190 -22.419 1.00 0.00 C ATOM 1177 O LEU A 73 -18.230 9.884 -23.155 1.00 0.00 O ATOM 1178 CB LEU A 73 -15.643 9.647 -24.354 1.00 0.00 C ATOM 1179 CG LEU A 73 -14.245 9.618 -25.019 1.00 0.00 C ATOM 1180 CD1 LEU A 73 -13.603 10.950 -25.376 1.00 0.00 C ATOM 1181 CD2 LEU A 73 -13.221 8.714 -24.323 1.00 0.00 C ATOM 0 H LEU A 73 -14.282 10.175 -21.529 1.00 0.00 H new ATOM 0 HA LEU A 73 -15.526 11.265 -23.066 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -16.006 8.620 -24.331 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -16.301 10.203 -25.021 1.00 0.00 H new ATOM 0 HG LEU A 73 -14.520 9.170 -25.974 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -12.629 10.774 -25.833 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -14.242 11.485 -26.078 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -13.477 11.547 -24.473 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -12.273 8.758 -24.859 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -13.074 9.053 -23.298 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -13.587 7.687 -24.317 1.00 0.00 H new ATOM 1325 N ILE B 677 -10.202 16.703 -32.638 1.00 0.00 N ATOM 1326 CA ILE B 677 -9.513 16.054 -31.525 1.00 0.00 C ATOM 1327 C ILE B 677 -8.371 16.981 -31.099 1.00 0.00 C ATOM 1328 O ILE B 677 -7.615 17.465 -31.950 1.00 0.00 O ATOM 1329 CB ILE B 677 -8.975 14.664 -31.914 1.00 0.00 C ATOM 1330 CG1 ILE B 677 -10.172 13.754 -32.266 1.00 0.00 C ATOM 1331 CG2 ILE B 677 -8.116 14.061 -30.775 1.00 0.00 C ATOM 1332 CD1 ILE B 677 -9.757 12.402 -32.840 1.00 0.00 C ATOM 0 HA ILE B 677 -10.209 15.890 -30.703 1.00 0.00 H new ATOM 0 HB ILE B 677 -8.323 14.751 -32.783 1.00 0.00 H new ATOM 0 HG12 ILE B 677 -10.771 13.592 -31.370 1.00 0.00 H new ATOM 0 HG13 ILE B 677 -10.809 14.267 -32.987 1.00 0.00 H new ATOM 0 HG21 ILE B 677 -7.749 13.080 -31.076 1.00 0.00 H new ATOM 0 HG22 ILE B 677 -7.270 14.718 -30.570 1.00 0.00 H new ATOM 0 HG23 ILE B 677 -8.723 13.961 -29.875 1.00 0.00 H new ATOM 0 HD11 ILE B 677 -10.647 11.814 -33.065 1.00 0.00 H new ATOM 0 HD12 ILE B 677 -9.183 12.555 -33.754 1.00 0.00 H new ATOM 0 HD13 ILE B 677 -9.145 11.870 -32.112 1.00 0.00 H new ATOM 1344 N THR B 678 -8.238 17.188 -29.794 1.00 0.00 N ATOM 1345 CA THR B 678 -7.206 17.999 -29.211 1.00 0.00 C ATOM 1346 C THR B 678 -6.520 17.247 -28.065 1.00 0.00 C ATOM 1347 O THR B 678 -7.048 16.311 -27.459 1.00 0.00 O ATOM 1348 CB THR B 678 -7.818 19.369 -28.879 1.00 0.00 C ATOM 1349 OG1 THR B 678 -6.803 20.280 -28.494 1.00 0.00 O ATOM 1350 CG2 THR B 678 -8.928 19.345 -27.829 1.00 0.00 C ATOM 0 H THR B 678 -8.868 16.780 -29.104 1.00 0.00 H new ATOM 0 HA THR B 678 -6.383 18.200 -29.897 1.00 0.00 H new ATOM 0 HB THR B 678 -8.299 19.697 -29.800 1.00 0.00 H new ATOM 0 HG1 THR B 678 -7.205 21.149 -28.287 1.00 0.00 H new ATOM 0 HG21 THR B 678 -9.295 20.358 -27.664 1.00 0.00 H new ATOM 0 HG22 THR B 678 -9.746 18.715 -28.179 1.00 0.00 H new ATOM 0 HG23 THR B 678 -8.536 18.945 -26.894 1.00 0.00 H new ATOM 1358 N PHE B 679 -5.288 17.678 -27.814 1.00 0.00 N ATOM 1359 CA PHE B 679 -4.322 17.098 -26.896 1.00 0.00 C ATOM 1360 C PHE B 679 -3.923 18.197 -25.890 1.00 0.00 C ATOM 1361 O PHE B 679 -2.950 18.926 -26.122 1.00 0.00 O ATOM 1362 CB PHE B 679 -3.137 16.502 -27.673 1.00 0.00 C ATOM 1363 CG PHE B 679 -3.431 15.170 -28.355 1.00 0.00 C ATOM 1364 CD1 PHE B 679 -3.346 13.961 -27.630 1.00 0.00 C ATOM 1365 CD2 PHE B 679 -3.763 15.130 -29.721 1.00 0.00 C ATOM 1366 CE1 PHE B 679 -3.590 12.729 -28.258 1.00 0.00 C ATOM 1367 CE2 PHE B 679 -3.986 13.897 -30.359 1.00 0.00 C ATOM 1368 CZ PHE B 679 -3.889 12.696 -29.632 1.00 0.00 C ATOM 0 H PHE B 679 -4.914 18.503 -28.283 1.00 0.00 H new ATOM 0 HA PHE B 679 -4.743 16.263 -26.337 1.00 0.00 H new ATOM 0 HB2 PHE B 679 -2.817 17.219 -28.429 1.00 0.00 H new ATOM 0 HB3 PHE B 679 -2.301 16.367 -26.987 1.00 0.00 H new ATOM 0 HD1 PHE B 679 -3.090 13.984 -26.581 1.00 0.00 H new ATOM 0 HD2 PHE B 679 -3.847 16.049 -30.282 1.00 0.00 H new ATOM 0 HE1 PHE B 679 -3.548 11.812 -27.689 1.00 0.00 H new ATOM 0 HE2 PHE B 679 -4.232 13.872 -31.410 1.00 0.00 H new ATOM 0 HZ PHE B 679 -4.044 11.750 -30.129 1.00 0.00 H new ATOM 1378 N PRO B 680 -4.724 18.397 -24.825 1.00 0.00 N ATOM 1379 CA PRO B 680 -4.530 19.431 -23.804 1.00 0.00 C ATOM 1380 C PRO B 680 -3.348 19.117 -22.877 1.00 0.00 C ATOM 1381 O PRO B 680 -2.726 18.061 -22.968 1.00 0.00 O ATOM 1382 CB PRO B 680 -5.840 19.411 -22.999 1.00 0.00 C ATOM 1383 CG PRO B 680 -6.185 17.925 -23.035 1.00 0.00 C ATOM 1384 CD PRO B 680 -5.894 17.599 -24.493 1.00 0.00 C ATOM 0 HA PRO B 680 -4.306 20.397 -24.255 1.00 0.00 H new ATOM 0 HB2 PRO B 680 -5.704 19.778 -21.982 1.00 0.00 H new ATOM 0 HB3 PRO B 680 -6.615 20.025 -23.458 1.00 0.00 H new ATOM 0 HG2 PRO B 680 -5.570 17.341 -22.350 1.00 0.00 H new ATOM 0 HG3 PRO B 680 -7.225 17.736 -22.769 1.00 0.00 H new ATOM 0 HD2 PRO B 680 -5.699 16.535 -24.629 1.00 0.00 H new ATOM 0 HD3 PRO B 680 -6.740 17.852 -25.132 1.00 0.00 H new ATOM 1392 N SER B 681 -3.135 19.962 -21.865 1.00 0.00 N ATOM 1393 CA SER B 681 -2.199 19.773 -20.755 1.00 0.00 C ATOM 1394 C SER B 681 -2.539 18.576 -19.835 1.00 0.00 C ATOM 1395 O SER B 681 -2.074 18.519 -18.697 1.00 0.00 O ATOM 1396 CB SER B 681 -2.129 21.089 -19.953 1.00 0.00 C ATOM 1397 OG SER B 681 -1.989 22.212 -20.822 1.00 0.00 O ATOM 0 H SER B 681 -3.640 20.846 -21.795 1.00 0.00 H new ATOM 0 HA SER B 681 -1.227 19.524 -21.181 1.00 0.00 H new ATOM 0 HB2 SER B 681 -3.031 21.201 -19.352 1.00 0.00 H new ATOM 0 HB3 SER B 681 -1.287 21.053 -19.261 1.00 0.00 H new ATOM 0 HG SER B 681 -1.949 23.034 -20.290 1.00 0.00 H new ATOM 1403 N ASP B 682 -3.332 17.607 -20.315 1.00 0.00 N ATOM 1404 CA ASP B 682 -3.658 16.362 -19.619 1.00 0.00 C ATOM 1405 C ASP B 682 -3.575 15.129 -20.522 1.00 0.00 C ATOM 1406 O ASP B 682 -3.466 14.015 -20.008 1.00 0.00 O ATOM 1407 CB ASP B 682 -5.065 16.418 -19.026 1.00 0.00 C ATOM 1408 CG ASP B 682 -5.201 17.417 -17.871 1.00 0.00 C ATOM 1409 OD1 ASP B 682 -4.892 17.047 -16.712 1.00 0.00 O ATOM 1410 OD2 ASP B 682 -5.661 18.558 -18.120 1.00 0.00 O ATOM 0 H ASP B 682 -3.777 17.675 -21.230 1.00 0.00 H new ATOM 0 HA ASP B 682 -2.910 16.267 -18.832 1.00 0.00 H new ATOM 0 HB2 ASP B 682 -5.772 16.684 -19.812 1.00 0.00 H new ATOM 0 HB3 ASP B 682 -5.342 15.425 -18.672 1.00 0.00 H new ATOM 1415 N ILE B 683 -3.620 15.281 -21.853 1.00 0.00 N ATOM 1416 CA ILE B 683 -3.558 14.182 -22.803 1.00 0.00 C ATOM 1417 C ILE B 683 -2.654 14.644 -23.954 1.00 0.00 C ATOM 1418 O ILE B 683 -2.923 15.686 -24.539 1.00 0.00 O ATOM 1419 CB ILE B 683 -4.981 13.796 -23.275 1.00 0.00 C ATOM 1420 CG1 ILE B 683 -5.871 13.080 -22.235 1.00 0.00 C ATOM 1421 CG2 ILE B 683 -4.890 12.870 -24.500 1.00 0.00 C ATOM 1422 CD1 ILE B 683 -6.378 13.856 -21.028 1.00 0.00 C ATOM 0 H ILE B 683 -3.702 16.194 -22.300 1.00 0.00 H new ATOM 0 HA ILE B 683 -3.142 13.280 -22.355 1.00 0.00 H new ATOM 0 HB ILE B 683 -5.453 14.755 -23.489 1.00 0.00 H new ATOM 0 HG12 ILE B 683 -6.741 12.689 -22.762 1.00 0.00 H new ATOM 0 HG13 ILE B 683 -5.313 12.222 -21.862 1.00 0.00 H new ATOM 0 HG21 ILE B 683 -5.894 12.601 -24.828 1.00 0.00 H new ATOM 0 HG22 ILE B 683 -4.370 13.385 -25.308 1.00 0.00 H new ATOM 0 HG23 ILE B 683 -4.342 11.967 -24.233 1.00 0.00 H new ATOM 0 HD11 ILE B 683 -6.986 13.201 -20.404 1.00 0.00 H new ATOM 0 HD12 ILE B 683 -5.530 14.224 -20.450 1.00 0.00 H new ATOM 0 HD13 ILE B 683 -6.981 14.699 -21.365 1.00 0.00 H new ATOM 1434 N ASP B 684 -1.615 13.885 -24.309 1.00 0.00 N ATOM 1435 CA ASP B 684 -0.595 14.213 -25.312 1.00 0.00 C ATOM 1436 C ASP B 684 -0.397 13.000 -26.227 1.00 0.00 C ATOM 1437 O ASP B 684 -0.550 11.868 -25.748 1.00 0.00 O ATOM 1438 CB ASP B 684 0.722 14.537 -24.608 1.00 0.00 C ATOM 1439 CG ASP B 684 1.875 14.784 -25.584 1.00 0.00 C ATOM 1440 OD1 ASP B 684 2.554 13.801 -25.954 1.00 0.00 O ATOM 1441 OD2 ASP B 684 2.111 15.958 -25.945 1.00 0.00 O ATOM 0 H ASP B 684 -1.452 12.973 -23.881 1.00 0.00 H new ATOM 0 HA ASP B 684 -0.913 15.075 -25.899 1.00 0.00 H new ATOM 0 HB2 ASP B 684 0.586 15.420 -23.983 1.00 0.00 H new ATOM 0 HB3 ASP B 684 0.985 13.714 -23.944 1.00 0.00 H new ATOM 1446 N PRO B 685 -0.084 13.178 -27.528 1.00 0.00 N ATOM 1447 CA PRO B 685 0.068 12.059 -28.439 1.00 0.00 C ATOM 1448 C PRO B 685 1.053 10.983 -27.968 1.00 0.00 C ATOM 1449 O PRO B 685 0.840 9.820 -28.291 1.00 0.00 O ATOM 1450 CB PRO B 685 0.512 12.657 -29.778 1.00 0.00 C ATOM 1451 CG PRO B 685 -0.052 14.072 -29.733 1.00 0.00 C ATOM 1452 CD PRO B 685 0.077 14.430 -28.256 1.00 0.00 C ATOM 0 HA PRO B 685 -0.883 11.531 -28.509 1.00 0.00 H new ATOM 0 HB2 PRO B 685 1.597 12.659 -29.878 1.00 0.00 H new ATOM 0 HB3 PRO B 685 0.116 12.092 -30.622 1.00 0.00 H new ATOM 0 HG2 PRO B 685 0.513 14.755 -30.367 1.00 0.00 H new ATOM 0 HG3 PRO B 685 -1.088 14.107 -30.070 1.00 0.00 H new ATOM 0 HD2 PRO B 685 1.046 14.882 -28.047 1.00 0.00 H new ATOM 0 HD3 PRO B 685 -0.683 15.154 -27.961 1.00 0.00 H new ATOM 1460 N GLN B 686 2.118 11.310 -27.219 1.00 0.00 N ATOM 1461 CA GLN B 686 3.144 10.316 -26.923 1.00 0.00 C ATOM 1462 C GLN B 686 2.576 9.167 -26.081 1.00 0.00 C ATOM 1463 O GLN B 686 2.709 8.018 -26.507 1.00 0.00 O ATOM 1464 CB GLN B 686 4.462 10.950 -26.419 1.00 0.00 C ATOM 1465 CG GLN B 686 5.013 10.494 -25.055 1.00 0.00 C ATOM 1466 CD GLN B 686 4.406 11.155 -23.812 1.00 0.00 C ATOM 1467 OE1 GLN B 686 4.676 10.720 -22.695 1.00 0.00 O ATOM 1468 NE2 GLN B 686 3.580 12.185 -23.935 1.00 0.00 N ATOM 0 H GLN B 686 2.284 12.234 -26.819 1.00 0.00 H new ATOM 0 HA GLN B 686 3.451 9.842 -27.855 1.00 0.00 H new ATOM 0 HB2 GLN B 686 5.230 10.761 -27.169 1.00 0.00 H new ATOM 0 HB3 GLN B 686 4.317 12.029 -26.376 1.00 0.00 H new ATOM 0 HG2 GLN B 686 4.869 9.417 -24.972 1.00 0.00 H new ATOM 0 HG3 GLN B 686 6.088 10.673 -25.045 1.00 0.00 H new ATOM 0 HE21 GLN B 686 3.353 12.549 -24.860 1.00 0.00 H new ATOM 0 HE22 GLN B 686 3.171 12.613 -23.104 1.00 0.00 H new ATOM 1477 N VAL B 687 1.884 9.411 -24.956 1.00 0.00 N ATOM 1478 CA VAL B 687 1.283 8.323 -24.201 1.00 0.00 C ATOM 1479 C VAL B 687 0.256 7.616 -25.074 1.00 0.00 C ATOM 1480 O VAL B 687 0.125 6.401 -24.985 1.00 0.00 O ATOM 1481 CB VAL B 687 0.646 8.870 -22.921 1.00 0.00 C ATOM 1482 CG1 VAL B 687 0.352 7.725 -21.945 1.00 0.00 C ATOM 1483 CG2 VAL B 687 1.568 9.872 -22.224 1.00 0.00 C ATOM 0 H VAL B 687 1.734 10.340 -24.562 1.00 0.00 H new ATOM 0 HA VAL B 687 2.047 7.601 -23.912 1.00 0.00 H new ATOM 0 HB VAL B 687 -0.278 9.372 -23.207 1.00 0.00 H new ATOM 0 HG11 VAL B 687 -0.101 8.127 -21.039 1.00 0.00 H new ATOM 0 HG12 VAL B 687 -0.334 7.017 -22.410 1.00 0.00 H new ATOM 0 HG13 VAL B 687 1.282 7.216 -21.691 1.00 0.00 H new ATOM 0 HG21 VAL B 687 1.086 10.241 -21.319 1.00 0.00 H new ATOM 0 HG22 VAL B 687 2.506 9.382 -21.962 1.00 0.00 H new ATOM 0 HG23 VAL B 687 1.770 10.708 -22.894 1.00 0.00 H new ATOM 1493 N PHE B 688 -0.435 8.341 -25.955 1.00 0.00 N ATOM 1494 CA PHE B 688 -1.397 7.744 -26.858 1.00 0.00 C ATOM 1495 C PHE B 688 -0.746 6.843 -27.920 1.00 0.00 C ATOM 1496 O PHE B 688 -1.404 5.947 -28.445 1.00 0.00 O ATOM 1497 CB PHE B 688 -2.225 8.854 -27.504 1.00 0.00 C ATOM 1498 CG PHE B 688 -3.545 8.357 -28.030 1.00 0.00 C ATOM 1499 CD1 PHE B 688 -4.526 7.947 -27.117 1.00 0.00 C ATOM 1500 CD2 PHE B 688 -3.803 8.327 -29.409 1.00 0.00 C ATOM 1501 CE1 PHE B 688 -5.802 7.575 -27.561 1.00 0.00 C ATOM 1502 CE2 PHE B 688 -5.073 7.924 -29.864 1.00 0.00 C ATOM 1503 CZ PHE B 688 -6.067 7.556 -28.940 1.00 0.00 C ATOM 0 H PHE B 688 -0.339 9.351 -26.056 1.00 0.00 H new ATOM 0 HA PHE B 688 -2.045 7.088 -26.276 1.00 0.00 H new ATOM 0 HB2 PHE B 688 -2.403 9.643 -26.773 1.00 0.00 H new ATOM 0 HB3 PHE B 688 -1.656 9.299 -28.321 1.00 0.00 H new ATOM 0 HD1 PHE B 688 -4.297 7.917 -26.062 1.00 0.00 H new ATOM 0 HD2 PHE B 688 -3.035 8.610 -30.114 1.00 0.00 H new ATOM 0 HE1 PHE B 688 -6.571 7.307 -26.852 1.00 0.00 H new ATOM 0 HE2 PHE B 688 -5.284 7.898 -30.923 1.00 0.00 H new ATOM 0 HZ PHE B 688 -7.042 7.256 -29.294 1.00 0.00 H new ATOM 1513 N TYR B 689 0.537 7.021 -28.222 1.00 0.00 N ATOM 1514 CA TYR B 689 1.302 6.145 -29.105 1.00 0.00 C ATOM 1515 C TYR B 689 1.967 5.011 -28.328 1.00 0.00 C ATOM 1516 O TYR B 689 2.401 4.027 -28.929 1.00 0.00 O ATOM 1517 CB TYR B 689 2.348 6.966 -29.871 1.00 0.00 C ATOM 1518 CG TYR B 689 1.810 8.068 -30.774 1.00 0.00 C ATOM 1519 CD1 TYR B 689 0.498 8.018 -31.287 1.00 0.00 C ATOM 1520 CD2 TYR B 689 2.652 9.142 -31.120 1.00 0.00 C ATOM 1521 CE1 TYR B 689 0.035 9.019 -32.155 1.00 0.00 C ATOM 1522 CE2 TYR B 689 2.196 10.152 -31.985 1.00 0.00 C ATOM 1523 CZ TYR B 689 0.883 10.094 -32.511 1.00 0.00 C ATOM 1524 OH TYR B 689 0.420 11.063 -33.352 1.00 0.00 O ATOM 0 H TYR B 689 1.087 7.796 -27.851 1.00 0.00 H new ATOM 0 HA TYR B 689 0.614 5.690 -29.818 1.00 0.00 H new ATOM 0 HB2 TYR B 689 3.026 7.417 -29.147 1.00 0.00 H new ATOM 0 HB3 TYR B 689 2.940 6.283 -30.480 1.00 0.00 H new ATOM 0 HD1 TYR B 689 -0.155 7.204 -31.010 1.00 0.00 H new ATOM 0 HD2 TYR B 689 3.654 9.190 -30.719 1.00 0.00 H new ATOM 0 HE1 TYR B 689 -0.968 8.969 -32.551 1.00 0.00 H new ATOM 0 HE2 TYR B 689 2.847 10.972 -32.248 1.00 0.00 H new ATOM 0 HH TYR B 689 1.121 11.732 -33.498 1.00 0.00 H new ATOM 1534 N GLU B 690 2.039 5.136 -27.003 1.00 0.00 N ATOM 1535 CA GLU B 690 2.821 4.247 -26.151 1.00 0.00 C ATOM 1536 C GLU B 690 1.936 3.256 -25.383 1.00 0.00 C ATOM 1537 O GLU B 690 2.365 2.125 -25.130 1.00 0.00 O ATOM 1538 CB GLU B 690 3.679 5.135 -25.225 1.00 0.00 C ATOM 1539 CG GLU B 690 3.913 4.599 -23.814 1.00 0.00 C ATOM 1540 CD GLU B 690 4.654 5.626 -22.947 1.00 0.00 C ATOM 1541 OE1 GLU B 690 3.976 6.490 -22.344 1.00 0.00 O ATOM 1542 OE2 GLU B 690 5.902 5.575 -22.840 1.00 0.00 O ATOM 0 H GLU B 690 1.549 5.867 -26.487 1.00 0.00 H new ATOM 0 HA GLU B 690 3.473 3.616 -26.755 1.00 0.00 H new ATOM 0 HB2 GLU B 690 4.648 5.290 -25.699 1.00 0.00 H new ATOM 0 HB3 GLU B 690 3.202 6.112 -25.147 1.00 0.00 H new ATOM 0 HG2 GLU B 690 2.957 4.352 -23.353 1.00 0.00 H new ATOM 0 HG3 GLU B 690 4.491 3.676 -23.864 1.00 0.00 H new ATOM 1549 N LEU B 691 0.715 3.656 -25.015 1.00 0.00 N ATOM 1550 CA LEU B 691 -0.274 2.750 -24.439 1.00 0.00 C ATOM 1551 C LEU B 691 -0.657 1.691 -25.475 1.00 0.00 C ATOM 1552 O LEU B 691 -0.289 1.789 -26.651 1.00 0.00 O ATOM 1553 CB LEU B 691 -1.456 3.535 -23.820 1.00 0.00 C ATOM 1554 CG LEU B 691 -2.717 3.855 -24.651 1.00 0.00 C ATOM 1555 CD1 LEU B 691 -3.514 4.936 -23.902 1.00 0.00 C ATOM 1556 CD2 LEU B 691 -2.441 4.329 -26.069 1.00 0.00 C ATOM 0 H LEU B 691 0.388 4.617 -25.109 1.00 0.00 H new ATOM 0 HA LEU B 691 0.148 2.203 -23.596 1.00 0.00 H new ATOM 0 HB2 LEU B 691 -1.784 2.979 -22.942 1.00 0.00 H new ATOM 0 HB3 LEU B 691 -1.058 4.485 -23.465 1.00 0.00 H new ATOM 0 HG LEU B 691 -3.271 2.923 -24.758 1.00 0.00 H new ATOM 0 HD11 LEU B 691 -4.413 5.183 -24.467 1.00 0.00 H new ATOM 0 HD12 LEU B 691 -3.796 4.564 -22.917 1.00 0.00 H new ATOM 0 HD13 LEU B 691 -2.899 5.829 -23.790 1.00 0.00 H new ATOM 0 HD21 LEU B 691 -3.385 4.529 -26.576 1.00 0.00 H new ATOM 0 HD22 LEU B 691 -1.845 5.241 -26.038 1.00 0.00 H new ATOM 0 HD23 LEU B 691 -1.895 3.557 -26.611 1.00 0.00 H new ATOM 1568 N ALA B 692 -1.396 0.674 -25.020 1.00 0.00 N ATOM 1569 CA ALA B 692 -1.804 -0.447 -25.858 1.00 0.00 C ATOM 1570 C ALA B 692 -2.439 0.062 -27.148 1.00 0.00 C ATOM 1571 O ALA B 692 -3.342 0.904 -27.108 1.00 0.00 O ATOM 1572 CB ALA B 692 -2.781 -1.324 -25.070 1.00 0.00 C ATOM 0 H ALA B 692 -1.726 0.609 -24.057 1.00 0.00 H new ATOM 0 HA ALA B 692 -0.933 -1.043 -26.132 1.00 0.00 H new ATOM 0 HB1 ALA B 692 -3.093 -2.166 -25.687 1.00 0.00 H new ATOM 0 HB2 ALA B 692 -2.292 -1.696 -24.170 1.00 0.00 H new ATOM 0 HB3 ALA B 692 -3.655 -0.735 -24.791 1.00 0.00 H new ATOM 1578 N GLU B 693 -1.999 -0.461 -28.291 1.00 0.00 N ATOM 1579 CA GLU B 693 -2.480 -0.010 -29.593 1.00 0.00 C ATOM 1580 C GLU B 693 -3.978 -0.195 -29.687 1.00 0.00 C ATOM 1581 O GLU B 693 -4.671 0.696 -30.154 1.00 0.00 O ATOM 1582 CB GLU B 693 -1.817 -0.807 -30.713 1.00 0.00 C ATOM 1583 CG GLU B 693 -0.442 -0.199 -31.030 1.00 0.00 C ATOM 1584 CD GLU B 693 0.334 -1.054 -32.045 1.00 0.00 C ATOM 1585 OE1 GLU B 693 0.153 -0.863 -33.274 1.00 0.00 O ATOM 1586 OE2 GLU B 693 1.151 -1.911 -31.625 1.00 0.00 O ATOM 0 H GLU B 693 -1.303 -1.205 -28.340 1.00 0.00 H new ATOM 0 HA GLU B 693 -2.229 1.045 -29.699 1.00 0.00 H new ATOM 0 HB2 GLU B 693 -1.706 -1.850 -30.415 1.00 0.00 H new ATOM 0 HB3 GLU B 693 -2.446 -0.795 -31.603 1.00 0.00 H new ATOM 0 HG2 GLU B 693 -0.571 0.808 -31.425 1.00 0.00 H new ATOM 0 HG3 GLU B 693 0.137 -0.109 -30.111 1.00 0.00 H new ATOM 1593 N ALA B 694 -4.498 -1.316 -29.190 1.00 0.00 N ATOM 1594 CA ALA B 694 -5.918 -1.575 -29.304 1.00 0.00 C ATOM 1595 C ALA B 694 -6.727 -0.510 -28.545 1.00 0.00 C ATOM 1596 O ALA B 694 -7.774 -0.076 -29.016 1.00 0.00 O ATOM 1597 CB ALA B 694 -6.202 -2.983 -28.786 1.00 0.00 C ATOM 0 H ALA B 694 -3.963 -2.043 -28.714 1.00 0.00 H new ATOM 0 HA ALA B 694 -6.226 -1.517 -30.348 1.00 0.00 H new ATOM 0 HB1 ALA B 694 -7.269 -3.192 -28.866 1.00 0.00 H new ATOM 0 HB2 ALA B 694 -5.645 -3.708 -29.379 1.00 0.00 H new ATOM 0 HB3 ALA B 694 -5.895 -3.056 -27.743 1.00 0.00 H new ATOM 1603 N VAL B 695 -6.206 -0.037 -27.407 1.00 0.00 N ATOM 1604 CA VAL B 695 -6.790 1.067 -26.642 1.00 0.00 C ATOM 1605 C VAL B 695 -6.704 2.358 -27.452 1.00 0.00 C ATOM 1606 O VAL B 695 -7.695 3.072 -27.515 1.00 0.00 O ATOM 1607 CB VAL B 695 -6.100 1.166 -25.262 1.00 0.00 C ATOM 1608 CG1 VAL B 695 -6.170 2.548 -24.601 1.00 0.00 C ATOM 1609 CG2 VAL B 695 -6.713 0.140 -24.307 1.00 0.00 C ATOM 0 H VAL B 695 -5.357 -0.416 -26.988 1.00 0.00 H new ATOM 0 HA VAL B 695 -7.848 0.884 -26.454 1.00 0.00 H new ATOM 0 HB VAL B 695 -5.045 0.969 -25.454 1.00 0.00 H new ATOM 0 HG11 VAL B 695 -5.659 2.517 -23.639 1.00 0.00 H new ATOM 0 HG12 VAL B 695 -5.688 3.284 -25.245 1.00 0.00 H new ATOM 0 HG13 VAL B 695 -7.213 2.826 -24.449 1.00 0.00 H new ATOM 0 HG21 VAL B 695 -6.225 0.211 -23.335 1.00 0.00 H new ATOM 0 HG22 VAL B 695 -7.779 0.339 -24.194 1.00 0.00 H new ATOM 0 HG23 VAL B 695 -6.572 -0.863 -24.711 1.00 0.00 H new ATOM 1619 N GLN B 696 -5.567 2.657 -28.085 1.00 0.00 N ATOM 1620 CA GLN B 696 -5.423 3.819 -28.959 1.00 0.00 C ATOM 1621 C GLN B 696 -6.481 3.772 -30.058 1.00 0.00 C ATOM 1622 O GLN B 696 -7.161 4.767 -30.266 1.00 0.00 O ATOM 1623 CB GLN B 696 -3.989 3.842 -29.500 1.00 0.00 C ATOM 1624 CG GLN B 696 -3.693 4.742 -30.704 1.00 0.00 C ATOM 1625 CD GLN B 696 -2.395 4.297 -31.384 1.00 0.00 C ATOM 1626 OE1 GLN B 696 -2.382 3.940 -32.559 1.00 0.00 O ATOM 1627 NE2 GLN B 696 -1.294 4.258 -30.647 1.00 0.00 N ATOM 0 H GLN B 696 -4.719 2.097 -28.004 1.00 0.00 H new ATOM 0 HA GLN B 696 -5.588 4.749 -28.415 1.00 0.00 H new ATOM 0 HB2 GLN B 696 -3.329 4.144 -28.686 1.00 0.00 H new ATOM 0 HB3 GLN B 696 -3.717 2.822 -29.770 1.00 0.00 H new ATOM 0 HG2 GLN B 696 -4.519 4.697 -31.414 1.00 0.00 H new ATOM 0 HG3 GLN B 696 -3.607 5.779 -30.381 1.00 0.00 H new ATOM 0 HE21 GLN B 696 -1.322 4.558 -29.673 1.00 0.00 H new ATOM 0 HE22 GLN B 696 -0.419 3.928 -31.054 1.00 0.00 H new ATOM 1636 N LYS B 697 -6.663 2.643 -30.748 1.00 0.00 N ATOM 1637 CA LYS B 697 -7.658 2.535 -31.821 1.00 0.00 C ATOM 1638 C LYS B 697 -9.064 2.766 -31.273 1.00 0.00 C ATOM 1639 O LYS B 697 -9.811 3.561 -31.837 1.00 0.00 O ATOM 1640 CB LYS B 697 -7.568 1.157 -32.507 1.00 0.00 C ATOM 1641 CG LYS B 697 -6.216 0.857 -33.172 1.00 0.00 C ATOM 1642 CD LYS B 697 -5.746 1.884 -34.217 1.00 0.00 C ATOM 1643 CE LYS B 697 -6.713 2.112 -35.397 1.00 0.00 C ATOM 1644 NZ LYS B 697 -6.828 0.930 -36.300 1.00 0.00 N ATOM 0 H LYS B 697 -6.133 1.787 -30.583 1.00 0.00 H new ATOM 0 HA LYS B 697 -7.446 3.304 -32.563 1.00 0.00 H new ATOM 0 HB2 LYS B 697 -7.773 0.384 -31.766 1.00 0.00 H new ATOM 0 HB3 LYS B 697 -8.351 1.090 -33.262 1.00 0.00 H new ATOM 0 HG2 LYS B 697 -5.457 0.784 -32.393 1.00 0.00 H new ATOM 0 HG3 LYS B 697 -6.276 -0.120 -33.651 1.00 0.00 H new ATOM 0 HD2 LYS B 697 -5.579 2.837 -33.716 1.00 0.00 H new ATOM 0 HD3 LYS B 697 -4.784 1.560 -34.614 1.00 0.00 H new ATOM 0 HE2 LYS B 697 -7.700 2.360 -35.007 1.00 0.00 H new ATOM 0 HE3 LYS B 697 -6.374 2.971 -35.975 1.00 0.00 H new ATOM 0 HZ1 LYS B 697 -7.491 1.146 -37.072 1.00 0.00 H new ATOM 0 HZ2 LYS B 697 -5.894 0.706 -36.699 1.00 0.00 H new ATOM 0 HZ3 LYS B 697 -7.179 0.113 -35.760 1.00 0.00 H new ATOM 1658 N GLU B 698 -9.414 2.098 -30.177 1.00 0.00 N ATOM 1659 CA GLU B 698 -10.751 2.219 -29.590 1.00 0.00 C ATOM 1660 C GLU B 698 -11.016 3.649 -29.101 1.00 0.00 C ATOM 1661 O GLU B 698 -12.106 4.179 -29.313 1.00 0.00 O ATOM 1662 CB GLU B 698 -10.922 1.218 -28.437 1.00 0.00 C ATOM 1663 CG GLU B 698 -11.113 -0.231 -28.911 1.00 0.00 C ATOM 1664 CD GLU B 698 -12.469 -0.448 -29.606 1.00 0.00 C ATOM 1665 OE1 GLU B 698 -13.479 -0.708 -28.907 1.00 0.00 O ATOM 1666 OE2 GLU B 698 -12.532 -0.372 -30.856 1.00 0.00 O ATOM 0 H GLU B 698 -8.791 1.466 -29.675 1.00 0.00 H new ATOM 0 HA GLU B 698 -11.481 1.989 -30.366 1.00 0.00 H new ATOM 0 HB2 GLU B 698 -10.047 1.268 -27.789 1.00 0.00 H new ATOM 0 HB3 GLU B 698 -11.782 1.512 -27.835 1.00 0.00 H new ATOM 0 HG2 GLU B 698 -10.309 -0.494 -29.599 1.00 0.00 H new ATOM 0 HG3 GLU B 698 -11.034 -0.903 -28.057 1.00 0.00 H new ATOM 1673 N LEU B 699 -10.024 4.294 -28.481 1.00 0.00 N ATOM 1674 CA LEU B 699 -10.137 5.673 -28.018 1.00 0.00 C ATOM 1675 C LEU B 699 -10.237 6.601 -29.197 1.00 0.00 C ATOM 1676 O LEU B 699 -11.083 7.471 -29.189 1.00 0.00 O ATOM 1677 CB LEU B 699 -8.901 6.095 -27.217 1.00 0.00 C ATOM 1678 CG LEU B 699 -8.991 5.675 -25.754 1.00 0.00 C ATOM 1679 CD1 LEU B 699 -7.581 5.626 -25.150 1.00 0.00 C ATOM 1680 CD2 LEU B 699 -9.878 6.666 -24.972 1.00 0.00 C ATOM 0 H LEU B 699 -9.117 3.869 -28.287 1.00 0.00 H new ATOM 0 HA LEU B 699 -11.026 5.730 -27.389 1.00 0.00 H new ATOM 0 HB2 LEU B 699 -8.011 5.653 -27.666 1.00 0.00 H new ATOM 0 HB3 LEU B 699 -8.784 7.177 -27.276 1.00 0.00 H new ATOM 0 HG LEU B 699 -9.441 4.685 -25.688 1.00 0.00 H new ATOM 0 HD11 LEU B 699 -7.643 5.326 -24.104 1.00 0.00 H new ATOM 0 HD12 LEU B 699 -6.975 4.905 -25.699 1.00 0.00 H new ATOM 0 HD13 LEU B 699 -7.122 6.612 -25.218 1.00 0.00 H new ATOM 0 HD21 LEU B 699 -9.936 6.357 -23.928 1.00 0.00 H new ATOM 0 HD22 LEU B 699 -9.447 7.665 -25.031 1.00 0.00 H new ATOM 0 HD23 LEU B 699 -10.879 6.677 -25.403 1.00 0.00 H new ATOM 1692 N LEU B 700 -9.386 6.436 -30.199 1.00 0.00 N ATOM 1693 CA LEU B 700 -9.366 7.279 -31.373 1.00 0.00 C ATOM 1694 C LEU B 700 -10.719 7.243 -32.062 1.00 0.00 C ATOM 1695 O LEU B 700 -11.230 8.289 -32.451 1.00 0.00 O ATOM 1696 CB LEU B 700 -8.241 6.787 -32.288 1.00 0.00 C ATOM 1697 CG LEU B 700 -8.100 7.563 -33.602 1.00 0.00 C ATOM 1698 CD1 LEU B 700 -7.863 9.056 -33.350 1.00 0.00 C ATOM 1699 CD2 LEU B 700 -6.924 6.972 -34.381 1.00 0.00 C ATOM 0 H LEU B 700 -8.681 5.699 -30.214 1.00 0.00 H new ATOM 0 HA LEU B 700 -9.176 8.318 -31.105 1.00 0.00 H new ATOM 0 HB2 LEU B 700 -7.298 6.844 -31.745 1.00 0.00 H new ATOM 0 HB3 LEU B 700 -8.412 5.736 -32.519 1.00 0.00 H new ATOM 0 HG LEU B 700 -9.025 7.472 -34.172 1.00 0.00 H new ATOM 0 HD11 LEU B 700 -7.768 9.575 -34.304 1.00 0.00 H new ATOM 0 HD12 LEU B 700 -8.705 9.469 -32.794 1.00 0.00 H new ATOM 0 HD13 LEU B 700 -6.948 9.187 -32.773 1.00 0.00 H new ATOM 0 HD21 LEU B 700 -6.804 7.509 -35.322 1.00 0.00 H new ATOM 0 HD22 LEU B 700 -6.013 7.066 -33.791 1.00 0.00 H new ATOM 0 HD23 LEU B 700 -7.116 5.919 -34.587 1.00 0.00 H new ATOM 1711 N ALA B 701 -11.327 6.059 -32.156 1.00 0.00 N ATOM 1712 CA ALA B 701 -12.686 5.920 -32.643 1.00 0.00 C ATOM 1713 C ALA B 701 -13.644 6.724 -31.761 1.00 0.00 C ATOM 1714 O ALA B 701 -14.434 7.484 -32.308 1.00 0.00 O ATOM 1715 CB ALA B 701 -13.075 4.443 -32.719 1.00 0.00 C ATOM 0 H ALA B 701 -10.886 5.177 -31.896 1.00 0.00 H new ATOM 0 HA ALA B 701 -12.752 6.324 -33.653 1.00 0.00 H new ATOM 0 HB1 ALA B 701 -14.097 4.354 -33.086 1.00 0.00 H new ATOM 0 HB2 ALA B 701 -12.399 3.923 -33.398 1.00 0.00 H new ATOM 0 HB3 ALA B 701 -13.006 3.997 -31.727 1.00 0.00 H new ATOM 1721 N GLU B 702 -13.540 6.634 -30.426 1.00 0.00 N ATOM 1722 CA GLU B 702 -14.324 7.421 -29.468 1.00 0.00 C ATOM 1723 C GLU B 702 -14.188 8.918 -29.790 1.00 0.00 C ATOM 1724 O GLU B 702 -15.159 9.609 -30.081 1.00 0.00 O ATOM 1725 CB GLU B 702 -13.851 7.128 -28.022 1.00 0.00 C ATOM 1726 CG GLU B 702 -14.961 6.978 -26.980 1.00 0.00 C ATOM 1727 CD GLU B 702 -15.672 5.622 -27.041 1.00 0.00 C ATOM 1728 OE1 GLU B 702 -16.676 5.508 -27.785 1.00 0.00 O ATOM 1729 OE2 GLU B 702 -15.269 4.709 -26.278 1.00 0.00 O ATOM 0 H GLU B 702 -12.889 5.993 -29.973 1.00 0.00 H new ATOM 0 HA GLU B 702 -15.374 7.140 -29.548 1.00 0.00 H new ATOM 0 HB2 GLU B 702 -13.260 6.212 -28.031 1.00 0.00 H new ATOM 0 HB3 GLU B 702 -13.187 7.933 -27.706 1.00 0.00 H new ATOM 0 HG2 GLU B 702 -14.536 7.113 -25.985 1.00 0.00 H new ATOM 0 HG3 GLU B 702 -15.694 7.771 -27.124 1.00 0.00 H new ATOM 1736 N TRP B 703 -12.958 9.414 -29.804 1.00 0.00 N ATOM 1737 CA TRP B 703 -12.576 10.800 -29.985 1.00 0.00 C ATOM 1738 C TRP B 703 -13.026 11.319 -31.367 1.00 0.00 C ATOM 1739 O TRP B 703 -13.338 12.500 -31.520 1.00 0.00 O ATOM 1740 CB TRP B 703 -11.048 10.869 -29.788 1.00 0.00 C ATOM 1741 CG TRP B 703 -10.425 10.327 -28.514 1.00 0.00 C ATOM 1742 CD1 TRP B 703 -11.035 9.871 -27.392 1.00 0.00 C ATOM 1743 CD2 TRP B 703 -9.012 10.300 -28.172 1.00 0.00 C ATOM 1744 NE1 TRP B 703 -10.117 9.575 -26.405 1.00 0.00 N ATOM 1745 CE2 TRP B 703 -8.860 9.914 -26.813 1.00 0.00 C ATOM 1746 CE3 TRP B 703 -7.849 10.666 -28.856 1.00 0.00 C ATOM 1747 CZ2 TRP B 703 -7.661 10.011 -26.115 1.00 0.00 C ATOM 1748 CZ3 TRP B 703 -6.618 10.760 -28.175 1.00 0.00 C ATOM 1749 CH2 TRP B 703 -6.531 10.482 -26.796 1.00 0.00 C ATOM 0 H TRP B 703 -12.145 8.811 -29.680 1.00 0.00 H new ATOM 0 HA TRP B 703 -13.067 11.449 -29.260 1.00 0.00 H new ATOM 0 HB2 TRP B 703 -10.589 10.342 -30.624 1.00 0.00 H new ATOM 0 HB3 TRP B 703 -10.756 11.916 -29.872 1.00 0.00 H new ATOM 0 HD1 TRP B 703 -12.103 9.754 -27.285 1.00 0.00 H new ATOM 0 HE1 TRP B 703 -10.345 9.162 -25.501 1.00 0.00 H new ATOM 0 HE3 TRP B 703 -7.894 10.878 -29.914 1.00 0.00 H new ATOM 0 HZ2 TRP B 703 -7.603 9.730 -25.074 1.00 0.00 H new ATOM 0 HZ3 TRP B 703 -5.730 11.049 -28.717 1.00 0.00 H new ATOM 0 HH2 TRP B 703 -5.600 10.631 -26.268 1.00 0.00 H new ATOM 1760 N LYS B 704 -13.129 10.435 -32.365 1.00 0.00 N ATOM 1761 CA LYS B 704 -13.662 10.752 -33.690 1.00 0.00 C ATOM 1762 C LYS B 704 -15.183 10.720 -33.751 1.00 0.00 C ATOM 1763 O LYS B 704 -15.757 11.468 -34.542 1.00 0.00 O ATOM 1764 CB LYS B 704 -13.124 9.760 -34.740 1.00 0.00 C ATOM 1765 CG LYS B 704 -11.690 10.076 -35.170 1.00 0.00 C ATOM 1766 CD LYS B 704 -11.225 9.080 -36.241 1.00 0.00 C ATOM 1767 CE LYS B 704 -9.939 9.555 -36.943 1.00 0.00 C ATOM 1768 NZ LYS B 704 -10.210 10.570 -37.999 1.00 0.00 N ATOM 0 H LYS B 704 -12.838 9.462 -32.271 1.00 0.00 H new ATOM 0 HA LYS B 704 -13.332 11.769 -33.903 1.00 0.00 H new ATOM 0 HB2 LYS B 704 -13.163 8.750 -34.333 1.00 0.00 H new ATOM 0 HB3 LYS B 704 -13.773 9.776 -35.615 1.00 0.00 H new ATOM 0 HG2 LYS B 704 -11.635 11.092 -35.560 1.00 0.00 H new ATOM 0 HG3 LYS B 704 -11.026 10.030 -34.307 1.00 0.00 H new ATOM 0 HD2 LYS B 704 -11.050 8.107 -35.781 1.00 0.00 H new ATOM 0 HD3 LYS B 704 -12.015 8.946 -36.980 1.00 0.00 H new ATOM 0 HE2 LYS B 704 -9.259 9.977 -36.203 1.00 0.00 H new ATOM 0 HE3 LYS B 704 -9.433 8.698 -37.388 1.00 0.00 H new ATOM 0 HZ1 LYS B 704 -9.314 10.858 -38.442 1.00 0.00 H new ATOM 0 HZ2 LYS B 704 -10.837 10.161 -38.721 1.00 0.00 H new ATOM 0 HZ3 LYS B 704 -10.668 11.401 -37.573 1.00 0.00 H new ATOM 1782 N ARG B 705 -15.857 9.877 -32.960 1.00 0.00 N ATOM 1783 CA ARG B 705 -17.323 9.760 -33.057 1.00 0.00 C ATOM 1784 C ARG B 705 -17.997 10.884 -32.287 1.00 0.00 C ATOM 1785 O ARG B 705 -19.085 11.326 -32.651 1.00 0.00 O ATOM 1786 CB ARG B 705 -17.864 8.352 -32.738 1.00 0.00 C ATOM 1787 CG ARG B 705 -17.567 7.725 -31.369 1.00 0.00 C ATOM 1788 CD ARG B 705 -18.195 8.423 -30.170 1.00 0.00 C ATOM 1789 NE ARG B 705 -18.279 7.546 -28.989 1.00 0.00 N ATOM 1790 CZ ARG B 705 -19.081 7.707 -27.931 1.00 0.00 C ATOM 1791 NH1 ARG B 705 -19.954 8.710 -27.848 1.00 0.00 N ATOM 1792 NH2 ARG B 705 -18.990 6.836 -26.939 1.00 0.00 N ATOM 0 H ARG B 705 -15.425 9.276 -32.258 1.00 0.00 H new ATOM 0 HA ARG B 705 -17.593 9.887 -34.105 1.00 0.00 H new ATOM 0 HB2 ARG B 705 -18.947 8.383 -32.856 1.00 0.00 H new ATOM 0 HB3 ARG B 705 -17.480 7.673 -33.499 1.00 0.00 H new ATOM 0 HG2 ARG B 705 -17.908 6.690 -31.383 1.00 0.00 H new ATOM 0 HG3 ARG B 705 -16.486 7.702 -31.228 1.00 0.00 H new ATOM 0 HD2 ARG B 705 -17.610 9.308 -29.921 1.00 0.00 H new ATOM 0 HD3 ARG B 705 -19.195 8.766 -30.436 1.00 0.00 H new ATOM 0 HE ARG B 705 -17.663 6.733 -28.977 1.00 0.00 H new ATOM 0 HH11 ARG B 705 -20.027 9.387 -28.607 1.00 0.00 H new ATOM 0 HH12 ARG B 705 -20.550 8.801 -27.025 1.00 0.00 H new ATOM 0 HH21 ARG B 705 -18.321 6.068 -26.995 1.00 0.00 H new ATOM 0 HH22 ARG B 705 -19.589 6.933 -26.119 1.00 0.00 H new ATOM 1806 N THR B 706 -17.329 11.366 -31.241 1.00 0.00 N ATOM 1807 CA THR B 706 -17.700 12.574 -30.529 1.00 0.00 C ATOM 1808 C THR B 706 -17.442 13.769 -31.456 1.00 0.00 C ATOM 1809 O THR B 706 -18.260 14.687 -31.559 1.00 0.00 O ATOM 1810 CB THR B 706 -16.848 12.642 -29.257 1.00 0.00 C ATOM 1811 OG1 THR B 706 -15.502 12.443 -29.621 1.00 0.00 O ATOM 1812 CG2 THR B 706 -17.169 11.529 -28.269 1.00 0.00 C ATOM 0 H THR B 706 -16.498 10.913 -30.861 1.00 0.00 H new ATOM 0 HA THR B 706 -18.752 12.584 -30.244 1.00 0.00 H new ATOM 0 HB THR B 706 -17.047 13.608 -28.794 1.00 0.00 H new ATOM 0 HG1 THR B 706 -15.308 11.483 -29.645 1.00 0.00 H new ATOM 0 HG21 THR B 706 -16.534 11.630 -27.389 1.00 0.00 H new ATOM 0 HG22 THR B 706 -18.215 11.597 -27.971 1.00 0.00 H new ATOM 0 HG23 THR B 706 -16.988 10.562 -28.739 1.00 0.00 H new ATOM 1820 N GLY B 707 -16.311 13.721 -32.166 1.00 0.00 N ATOM 1821 CA GLY B 707 -15.936 14.613 -33.251 1.00 0.00 C ATOM 1822 C GLY B 707 -14.941 15.657 -32.762 1.00 0.00 C ATOM 1823 O GLY B 707 -13.887 15.855 -33.366 1.00 0.00 O ATOM 0 H GLY B 707 -15.597 13.016 -31.983 1.00 0.00 H new ATOM 0 HA2 GLY B 707 -15.498 14.039 -34.067 1.00 0.00 H new ATOM 0 HA3 GLY B 707 -16.824 15.106 -33.648 1.00 0.00 H new ATOM 1827 N SER B 708 -15.234 16.249 -31.607 1.00 0.00 N ATOM 1828 CA SER B 708 -14.355 17.173 -30.907 1.00 0.00 C ATOM 1829 C SER B 708 -14.022 16.598 -29.522 1.00 0.00 C ATOM 1830 O SER B 708 -13.836 17.356 -28.570 1.00 0.00 O ATOM 1831 CB SER B 708 -15.010 18.561 -30.856 1.00 0.00 C ATOM 1832 OG SER B 708 -15.372 18.990 -32.164 1.00 0.00 O ATOM 0 H SER B 708 -16.117 16.092 -31.120 1.00 0.00 H new ATOM 0 HA SER B 708 -13.409 17.296 -31.434 1.00 0.00 H new ATOM 0 HB2 SER B 708 -15.894 18.529 -30.220 1.00 0.00 H new ATOM 0 HB3 SER B 708 -14.322 19.278 -30.409 1.00 0.00 H new ATOM 0 HG SER B 708 -15.790 19.875 -32.114 1.00 0.00 H new ATOM 1838 N ASP B 709 -13.993 15.255 -29.409 1.00 0.00 N ATOM 1839 CA ASP B 709 -13.563 14.479 -28.233 1.00 0.00 C ATOM 1840 C ASP B 709 -14.324 14.767 -26.921 1.00 0.00 C ATOM 1841 O ASP B 709 -13.934 14.289 -25.853 1.00 0.00 O ATOM 1842 CB ASP B 709 -12.037 14.519 -28.093 1.00 0.00 C ATOM 1843 CG ASP B 709 -11.428 15.826 -27.517 1.00 0.00 C ATOM 1844 OD1 ASP B 709 -11.831 16.328 -26.434 1.00 0.00 O ATOM 1845 OD2 ASP B 709 -10.481 16.329 -28.171 1.00 0.00 O ATOM 0 H ASP B 709 -14.285 14.652 -30.178 1.00 0.00 H new ATOM 0 HA ASP B 709 -13.857 13.448 -28.432 1.00 0.00 H new ATOM 0 HB2 ASP B 709 -11.731 13.690 -27.455 1.00 0.00 H new ATOM 0 HB3 ASP B 709 -11.600 14.343 -29.076 1.00 0.00 H new ATOM 1850 N PHE B 710 -15.474 15.447 -27.011 1.00 0.00 N ATOM 1851 CA PHE B 710 -16.260 16.025 -25.935 1.00 0.00 C ATOM 1852 C PHE B 710 -15.431 16.937 -25.010 1.00 0.00 C ATOM 1853 O PHE B 710 -15.538 18.161 -25.116 1.00 0.00 O ATOM 1854 CB PHE B 710 -16.972 14.945 -25.114 1.00 0.00 C ATOM 1855 CG PHE B 710 -18.030 14.061 -25.741 1.00 0.00 C ATOM 1856 CD1 PHE B 710 -18.964 14.534 -26.683 1.00 0.00 C ATOM 1857 CD2 PHE B 710 -18.145 12.750 -25.251 1.00 0.00 C ATOM 1858 CE1 PHE B 710 -19.996 13.686 -27.131 1.00 0.00 C ATOM 1859 CE2 PHE B 710 -19.166 11.904 -25.699 1.00 0.00 C ATOM 1860 CZ PHE B 710 -20.105 12.377 -26.630 1.00 0.00 C ATOM 0 H PHE B 710 -15.907 15.616 -27.919 1.00 0.00 H new ATOM 0 HA PHE B 710 -17.011 16.650 -26.418 1.00 0.00 H new ATOM 0 HB2 PHE B 710 -16.201 14.286 -24.715 1.00 0.00 H new ATOM 0 HB3 PHE B 710 -17.436 15.444 -24.263 1.00 0.00 H new ATOM 0 HD1 PHE B 710 -18.889 15.543 -27.061 1.00 0.00 H new ATOM 0 HD2 PHE B 710 -17.437 12.390 -24.519 1.00 0.00 H new ATOM 0 HE1 PHE B 710 -20.706 14.043 -27.862 1.00 0.00 H new ATOM 0 HE2 PHE B 710 -19.231 10.891 -25.330 1.00 0.00 H new ATOM 0 HZ PHE B 710 -20.909 11.736 -26.960 1.00 0.00 H new