USER MOD reduce.3.24.130724 H: found=0, std=0, add=778, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 659 hydrogens (20 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 NoAdj-H: A 59 GLY H : A 59 GLY N : A 160 RCY C1V :(H bumps) USER MOD NoAdj-H: A 70 TRP H : A 70 TRP N : A 176 RCY C1Z :(H bumps) USER MOD NoAdj-H: A 71 GLU H : A 71 GLU N : A 176 RCY C1Y :(H bumps) USER MOD NoAdj-H: A 73 CYS H : A 73 CYS N : A 173 RCY C1S :(H bumps) USER MOD NoAdj-H: A 110 RCYH1SA : A 110 RCY C1S : A 10 CYS SG :(H bumps) USER MOD NoAdj-H: A 121 RCYH1SA : A 121 RCY C1S : A 21 CYS SG :(H bumps) USER MOD NoAdj-H: A 121 RCY H1U : A 121 RCY C1U : A 70 TRP CH2 :(H bumps) USER MOD NoAdj-H: A 130 RCYH1SA : A 130 RCY C1S : A 30 CYS SG :(H bumps) USER MOD NoAdj-H: A 138 RCYH1YB : A 138 RCY C1Y : A 57 MET SD :(H bumps) USER MOD NoAdj-H: A 138 RCYH1VA : A 138 RCY C1V : A 35 THR CG2 :(H bumps) USER MOD NoAdj-H: A 138 RCYH1SA : A 138 RCY C1S : A 38 CYS SG :(H bumps) USER MOD NoAdj-H: A 138 RCYH1LA : A 138 RCY C1L : A 37 GLN O :(H bumps) USER MOD NoAdj-H: A 138 RCY H1Y : A 138 RCY C1Y : A 57 MET SD :(H bumps) USER MOD NoAdj-H: A 138 RCY H1V : A 138 RCY C1V : A 35 THR CB :(H bumps) USER MOD NoAdj-H: A 138 RCY H1L : A 138 RCY C1L : A 37 GLN O :(H bumps) USER MOD NoAdj-H: A 138 RCY H1C : A 138 RCY C1C : A 35 THR N :(H bumps) USER MOD NoAdj-H: A 150 RCYH1VA : A 150 RCY C1V : A 187 RCY C1Q :(H bumps) USER MOD NoAdj-H: A 150 RCYH1SA : A 150 RCY C1S : A 50 CYS SG :(H bumps) USER MOD NoAdj-H: A 150 RCYH1CB : A 150 RCY C1C : A 87 CYS SG :(H bumps) USER MOD NoAdj-H: A 160 RCYH1YB : A 160 RCY C1Y : A 63 ASP CB :(H bumps) USER MOD NoAdj-H: A 160 RCYH1YA : A 160 RCY C1Y : A 63 ASP CB :(H bumps) USER MOD NoAdj-H: A 160 RCYH1VB : A 160 RCY C1V : A 58 GLU CA :(H bumps) USER MOD NoAdj-H: A 160 RCYH1VA : A 160 RCY C1V : A 58 GLU CA :(H bumps) USER MOD NoAdj-H: A 160 RCYH1SA : A 160 RCY C1S : A 60 CYS SG :(H bumps) USER MOD NoAdj-H: A 160 RCY H1Y : A 160 RCY C1Y : A 168 RCY O1J :(H bumps) USER MOD NoAdj-H: A 160 RCY H1V : A 160 RCY C1V : A 59 GLY N :(H bumps) USER MOD NoAdj-H: A 168 RCYH1SA : A 168 RCY C1S : A 68 CYS SG :(H bumps) USER MOD NoAdj-H: A 173 RCYH1ZB : A 173 RCY C1Z : A 176 RCY C1Z :(H bumps) USER MOD NoAdj-H: A 173 RCYH1ZA : A 173 RCY C1Z : A 68 CYS C :(H bumps) USER MOD NoAdj-H: A 173 RCYH1YB : A 173 RCY C1Y : A 176 RCY C1Y :(H bumps) USER MOD NoAdj-H: A 173 RCYH1YA : A 173 RCY C1Y : A 176 RCY C1Y :(H bumps) USER MOD NoAdj-H: A 173 RCYH1VB : A 173 RCY C1V : A 176 RCY O1G :(H bumps) USER MOD NoAdj-H: A 173 RCYH1VA : A 173 RCY C1V : A 176 RCY O1G :(H bumps) USER MOD NoAdj-H: A 173 RCYH1SA : A 173 RCY C1S : A 73 CYS SG :(H bumps) USER MOD NoAdj-H: A 173 RCYH1LA : A 173 RCY C1L : A 72 ALA C :(H bumps) USER MOD NoAdj-H: A 173 RCY H1Z : A 173 RCY C1Z : A 68 CYS C :(H bumps) USER MOD NoAdj-H: A 173 RCY H1Y : A 173 RCY C1Y : A 176 RCY C1Y :(H bumps) USER MOD NoAdj-H: A 173 RCY H1U : A 173 RCY C1U : A 69 PRO C :(H bumps) USER MOD NoAdj-H: A 173 RCY H1L : A 173 RCY C1L : A 72 ALA C :(H bumps) USER MOD NoAdj-H: A 176 RCYH1ZA : A 176 RCY C1Z : A 69 PRO C :(H bumps) USER MOD NoAdj-H: A 176 RCYH1YB : A 176 RCY C1Y : A 173 RCY C1M :(H bumps) USER MOD NoAdj-H: A 176 RCYH1YA : A 176 RCY C1Y : A 173 RCY C1Y :(H bumps) USER MOD NoAdj-H: A 176 RCYH1VB : A 176 RCY C1V : A 70 TRP CD1 :(H bumps) USER MOD NoAdj-H: A 176 RCYH1VA : A 176 RCY C1V : A 70 TRP CB :(H bumps) USER MOD NoAdj-H: A 176 RCYH1SA : A 176 RCY C1S : A 76 CYS SG :(H bumps) USER MOD NoAdj-H: A 176 RCYH1MA : A 176 RCY C1M : A 69 PRO O :(H bumps) USER MOD NoAdj-H: A 176 RCYH1LA : A 176 RCY C1L : A 74 ASN OD1 :(H bumps) USER MOD NoAdj-H: A 176 RCY H1Z : A 176 RCY C1Z : A 173 RCY C1Z :(H bumps) USER MOD NoAdj-H: A 176 RCY H1Y : A 176 RCY C1Y : A 173 RCY C1Z :(H bumps) USER MOD NoAdj-H: A 176 RCY H1V : A 176 RCY C1V : A 70 TRP CB :(H bumps) USER MOD NoAdj-H: A 176 RCY H1M : A 176 RCY C1M : A 173 RCY C1X :(H bumps) USER MOD NoAdj-H: A 176 RCY H1L : A 176 RCY C1L : A 74 ASN O :(H bumps) USER MOD NoAdj-H: A 187 RCYH1SA : A 187 RCY C1S : A 87 CYS SG :(H bumps) USER MOD Set 1.1: A 37 GLN : amide:sc= -2.38! K(o=-3.5!,f=-5.4) USER MOD Set 1.2: A 40 SER OG : rot -139:sc= -1.08! USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -161:sc= -0.139 (180deg=-0.89) USER MOD Single : A 2 ASN : amide:sc= -2.51! C(o=-2.5!,f=-2.4!) USER MOD Single : A 7 LYS NZ :NH3+ 179:sc= -2.36 (180deg=-2.45) USER MOD Single : A 12 SER OG : rot 180:sc= 0.0712 USER MOD Single : A 14 THR OG1 : rot -56:sc= 1.16 USER MOD Single : A 17 MET CE :methyl -156:sc= -0.92 (180deg=-2.36!) USER MOD Single : A 22 THR OG1 : rot -122:sc= -2.91! USER MOD Single : A 25 LYS NZ :NH3+ -152:sc= 0 (180deg=-0.015) USER MOD Single : A 29 LYS NZ :NH3+ 158:sc= -2.36 (180deg=-4.84!) USER MOD Single : A 31 LYS NZ :NH3+ 156:sc= -0.0734 (180deg=-0.637) USER MOD Single : A 32 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 LYS NZ :NH3+ -156:sc= -3.79 (180deg=-4.66!) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 GLN :FLIP amide:sc= -5.05! C(o=-6.7!,f=-5!) USER MOD Single : A 57 MET CE :methyl -132:sc= -13.2! (180deg=-18.4!) USER MOD Single : A 62 THR OG1 : rot 180:sc= -0.597 USER MOD Single : A 65 THR OG1 : rot 4:sc= 0.572 USER MOD Single : A 74 ASN : amide:sc= -29.8! C(o=-30!,f=-44!) USER MOD Single : A 75 HIS :FLIP no HD1:sc= -2.51! C(o=-3.7!,f=-2.5!) USER MOD Single : A 79 HIS :FLIP no HD1:sc= -2.55! C(o=-3.4!,f=-2.6!) USER MOD Single : A 83 GLN : amide:sc= -0.17 K(o=-0.17,f=-2.5!) USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 64.591 6.776 13.965 1.00 1.00 N ATOM 2 CA MET A 1 63.413 7.173 14.786 1.00 1.00 C ATOM 3 C MET A 1 63.428 8.688 15.000 1.00 1.00 C ATOM 4 O MET A 1 64.423 9.258 15.402 1.00 1.00 O ATOM 5 CB MET A 1 63.474 6.465 16.142 1.00 1.00 C ATOM 6 CG MET A 1 63.679 4.964 15.926 1.00 1.00 C ATOM 7 SD MET A 1 62.260 4.284 15.032 1.00 1.00 S ATOM 8 CE MET A 1 63.129 2.905 14.245 1.00 1.00 C ATOM 0 H1 MET A 1 64.425 5.837 13.551 1.00 1.00 H new ATOM 0 H2 MET A 1 64.733 7.470 13.204 1.00 1.00 H new ATOM 0 H3 MET A 1 65.439 6.744 14.567 1.00 1.00 H new ATOM 0 HA MET A 1 62.497 6.888 14.269 1.00 1.00 H new ATOM 0 HB2 MET A 1 64.289 6.872 16.740 1.00 1.00 H new ATOM 0 HB3 MET A 1 62.553 6.641 16.698 1.00 1.00 H new ATOM 0 HG2 MET A 1 64.595 4.789 15.363 1.00 1.00 H new ATOM 0 HG3 MET A 1 63.793 4.460 16.886 1.00 1.00 H new ATOM 0 HE1 MET A 1 62.430 2.337 13.631 1.00 1.00 H new ATOM 0 HE2 MET A 1 63.932 3.292 13.617 1.00 1.00 H new ATOM 0 HE3 MET A 1 63.550 2.255 15.012 1.00 1.00 H new ATOM 17 N ASN A 2 62.332 9.346 14.736 1.00 1.00 N ATOM 18 CA ASN A 2 62.286 10.823 14.925 1.00 1.00 C ATOM 19 C ASN A 2 60.828 11.284 15.003 1.00 1.00 C ATOM 20 O ASN A 2 60.353 11.700 16.041 1.00 1.00 O ATOM 21 CB ASN A 2 62.977 11.511 13.744 1.00 1.00 C ATOM 22 CG ASN A 2 64.494 11.431 13.922 1.00 1.00 C ATOM 23 OD1 ASN A 2 65.049 12.061 14.800 1.00 1.00 O ATOM 24 ND2 ASN A 2 65.194 10.677 13.119 1.00 1.00 N ATOM 0 H ASN A 2 61.467 8.924 14.398 1.00 1.00 H new ATOM 0 HA ASN A 2 62.799 11.086 15.850 1.00 1.00 H new ATOM 0 HB2 ASN A 2 62.684 11.033 12.809 1.00 1.00 H new ATOM 0 HB3 ASN A 2 62.662 12.553 13.681 1.00 1.00 H new ATOM 0 HD21 ASN A 2 66.206 10.617 13.229 1.00 1.00 H new ATOM 0 HD22 ASN A 2 64.729 10.148 12.382 1.00 1.00 H new ATOM 31 N LEU A 3 60.114 11.215 13.912 1.00 1.00 N ATOM 32 CA LEU A 3 58.688 11.651 13.924 1.00 1.00 C ATOM 33 C LEU A 3 57.911 10.884 12.852 1.00 1.00 C ATOM 34 O LEU A 3 56.696 10.861 12.849 1.00 1.00 O ATOM 35 CB LEU A 3 58.614 13.153 13.633 1.00 1.00 C ATOM 36 CG LEU A 3 57.227 13.682 14.005 1.00 1.00 C ATOM 37 CD1 LEU A 3 57.078 13.698 15.527 1.00 1.00 C ATOM 38 CD2 LEU A 3 57.063 15.103 13.462 1.00 1.00 C ATOM 0 H LEU A 3 60.456 10.876 13.013 1.00 1.00 H new ATOM 0 HA LEU A 3 58.252 11.447 14.902 1.00 1.00 H new ATOM 0 HB2 LEU A 3 59.380 13.681 14.201 1.00 1.00 H new ATOM 0 HB3 LEU A 3 58.814 13.339 12.578 1.00 1.00 H new ATOM 0 HG LEU A 3 56.463 13.036 13.573 1.00 1.00 H new ATOM 0 HD11 LEU A 3 56.090 14.075 15.792 1.00 1.00 H new ATOM 0 HD12 LEU A 3 57.196 12.686 15.915 1.00 1.00 H new ATOM 0 HD13 LEU A 3 57.841 14.344 15.961 1.00 1.00 H new ATOM 0 HD21 LEU A 3 56.076 15.482 13.726 1.00 1.00 H new ATOM 0 HD22 LEU A 3 57.827 15.749 13.895 1.00 1.00 H new ATOM 0 HD23 LEU A 3 57.170 15.093 12.377 1.00 1.00 H new ATOM 50 N GLU A 4 58.601 10.255 11.941 1.00 1.00 N ATOM 51 CA GLU A 4 57.898 9.492 10.871 1.00 1.00 C ATOM 52 C GLU A 4 56.836 8.588 11.510 1.00 1.00 C ATOM 53 O GLU A 4 57.009 8.113 12.614 1.00 1.00 O ATOM 54 CB GLU A 4 58.911 8.632 10.112 1.00 1.00 C ATOM 55 CG GLU A 4 59.912 9.538 9.392 1.00 1.00 C ATOM 56 CD GLU A 4 59.246 10.159 8.162 1.00 1.00 C ATOM 57 OE1 GLU A 4 58.077 9.884 7.944 1.00 1.00 O ATOM 58 OE2 GLU A 4 59.916 10.898 7.460 1.00 1.00 O ATOM 0 H GLU A 4 59.620 10.236 11.891 1.00 1.00 H new ATOM 0 HA GLU A 4 57.420 10.185 10.179 1.00 1.00 H new ATOM 0 HB2 GLU A 4 59.434 7.972 10.804 1.00 1.00 H new ATOM 0 HB3 GLU A 4 58.397 7.996 9.392 1.00 1.00 H new ATOM 0 HG2 GLU A 4 60.259 10.322 10.065 1.00 1.00 H new ATOM 0 HG3 GLU A 4 60.789 8.964 9.093 1.00 1.00 H new ATOM 65 N PRO A 5 55.746 8.353 10.823 1.00 1.00 N ATOM 66 CA PRO A 5 54.639 7.490 11.339 1.00 1.00 C ATOM 67 C PRO A 5 55.027 6.001 11.364 1.00 1.00 C ATOM 68 O PRO A 5 55.212 5.393 10.329 1.00 1.00 O ATOM 69 CB PRO A 5 53.501 7.727 10.339 1.00 1.00 C ATOM 70 CG PRO A 5 54.176 8.136 9.072 1.00 1.00 C ATOM 71 CD PRO A 5 55.450 8.878 9.480 1.00 1.00 C ATOM 0 HA PRO A 5 54.377 7.737 12.368 1.00 1.00 H new ATOM 0 HB2 PRO A 5 52.908 6.824 10.196 1.00 1.00 H new ATOM 0 HB3 PRO A 5 52.821 8.503 10.692 1.00 1.00 H new ATOM 0 HG2 PRO A 5 54.413 7.266 8.460 1.00 1.00 H new ATOM 0 HG3 PRO A 5 53.527 8.778 8.476 1.00 1.00 H new ATOM 0 HD2 PRO A 5 56.267 8.683 8.785 1.00 1.00 H new ATOM 0 HD3 PRO A 5 55.297 9.957 9.497 1.00 1.00 H new ATOM 79 N PRO A 6 55.147 5.415 12.532 1.00 1.00 N ATOM 80 CA PRO A 6 55.515 3.979 12.671 1.00 1.00 C ATOM 81 C PRO A 6 54.300 3.056 12.524 1.00 1.00 C ATOM 82 O PRO A 6 53.168 3.492 12.595 1.00 1.00 O ATOM 83 CB PRO A 6 56.080 3.903 14.088 1.00 1.00 C ATOM 84 CG PRO A 6 55.338 4.954 14.850 1.00 1.00 C ATOM 85 CD PRO A 6 54.952 6.048 13.846 1.00 1.00 C ATOM 0 HA PRO A 6 56.214 3.653 11.901 1.00 1.00 H new ATOM 0 HB2 PRO A 6 55.926 2.916 14.523 1.00 1.00 H new ATOM 0 HB3 PRO A 6 57.154 4.091 14.097 1.00 1.00 H new ATOM 0 HG2 PRO A 6 54.450 4.533 15.322 1.00 1.00 H new ATOM 0 HG3 PRO A 6 55.959 5.363 15.647 1.00 1.00 H new ATOM 0 HD2 PRO A 6 53.920 6.369 13.984 1.00 1.00 H new ATOM 0 HD3 PRO A 6 55.579 6.932 13.959 1.00 1.00 H new ATOM 93 N LYS A 7 54.527 1.785 12.322 1.00 1.00 N ATOM 94 CA LYS A 7 53.388 0.830 12.173 1.00 1.00 C ATOM 95 C LYS A 7 53.614 -0.378 13.086 1.00 1.00 C ATOM 96 O LYS A 7 53.600 -0.264 14.295 1.00 1.00 O ATOM 97 CB LYS A 7 53.300 0.362 10.717 1.00 1.00 C ATOM 98 CG LYS A 7 52.684 1.470 9.860 1.00 1.00 C ATOM 99 CD LYS A 7 52.896 1.149 8.380 1.00 1.00 C ATOM 100 CE LYS A 7 54.155 1.858 7.878 1.00 1.00 C ATOM 101 NZ LYS A 7 55.223 1.764 8.913 1.00 1.00 N ATOM 0 H LYS A 7 55.454 1.365 12.254 1.00 1.00 H new ATOM 0 HA LYS A 7 52.458 1.326 12.450 1.00 1.00 H new ATOM 0 HB2 LYS A 7 54.293 0.109 10.345 1.00 1.00 H new ATOM 0 HB3 LYS A 7 52.695 -0.542 10.651 1.00 1.00 H new ATOM 0 HG2 LYS A 7 51.619 1.560 10.074 1.00 1.00 H new ATOM 0 HG3 LYS A 7 53.141 2.429 10.104 1.00 1.00 H new ATOM 0 HD2 LYS A 7 52.993 0.072 8.241 1.00 1.00 H new ATOM 0 HD3 LYS A 7 52.030 1.469 7.800 1.00 1.00 H new ATOM 0 HE2 LYS A 7 54.495 1.404 6.947 1.00 1.00 H new ATOM 0 HE3 LYS A 7 53.935 2.903 7.661 1.00 1.00 H new ATOM 0 HZ1 LYS A 7 56.085 2.231 8.566 1.00 1.00 H new ATOM 0 HZ2 LYS A 7 54.903 2.231 9.785 1.00 1.00 H new ATOM 0 HZ3 LYS A 7 55.427 0.764 9.111 1.00 1.00 H new ATOM 115 N ALA A 8 53.820 -1.535 12.518 1.00 1.00 N ATOM 116 CA ALA A 8 54.045 -2.748 13.356 1.00 1.00 C ATOM 117 C ALA A 8 54.866 -3.769 12.565 1.00 1.00 C ATOM 118 O ALA A 8 54.993 -4.913 12.953 1.00 1.00 O ATOM 119 CB ALA A 8 52.695 -3.362 13.735 1.00 1.00 C ATOM 0 H ALA A 8 53.842 -1.693 11.511 1.00 1.00 H new ATOM 0 HA ALA A 8 54.585 -2.470 14.261 1.00 1.00 H new ATOM 0 HB1 ALA A 8 52.858 -4.249 14.348 1.00 1.00 H new ATOM 0 HB2 ALA A 8 52.110 -2.635 14.298 1.00 1.00 H new ATOM 0 HB3 ALA A 8 52.155 -3.640 12.830 1.00 1.00 H new ATOM 125 N GLU A 9 55.425 -3.362 11.458 1.00 1.00 N ATOM 126 CA GLU A 9 56.241 -4.305 10.638 1.00 1.00 C ATOM 127 C GLU A 9 57.386 -3.537 9.975 1.00 1.00 C ATOM 128 O GLU A 9 57.730 -2.444 10.382 1.00 1.00 O ATOM 129 CB GLU A 9 55.360 -4.939 9.560 1.00 1.00 C ATOM 130 CG GLU A 9 54.067 -5.456 10.195 1.00 1.00 C ATOM 131 CD GLU A 9 53.274 -6.256 9.160 1.00 1.00 C ATOM 132 OE1 GLU A 9 53.875 -6.699 8.195 1.00 1.00 O ATOM 133 OE2 GLU A 9 52.079 -6.412 9.350 1.00 1.00 O ATOM 0 H GLU A 9 55.352 -2.416 11.085 1.00 1.00 H new ATOM 0 HA GLU A 9 56.648 -5.088 11.278 1.00 1.00 H new ATOM 0 HB2 GLU A 9 55.130 -4.206 8.786 1.00 1.00 H new ATOM 0 HB3 GLU A 9 55.892 -5.758 9.076 1.00 1.00 H new ATOM 0 HG2 GLU A 9 54.298 -6.083 11.056 1.00 1.00 H new ATOM 0 HG3 GLU A 9 53.469 -4.621 10.560 1.00 1.00 H new ATOM 140 N CYS A 10 57.981 -4.096 8.956 1.00 1.00 N ATOM 141 CA CYS A 10 59.102 -3.394 8.270 1.00 1.00 C ATOM 142 C CYS A 10 59.115 -3.773 6.788 1.00 1.00 C ATOM 143 O CYS A 10 60.158 -3.895 6.179 1.00 1.00 O ATOM 144 CB CYS A 10 60.431 -3.803 8.911 1.00 1.00 C ATOM 145 SG CYS A 10 61.788 -2.922 8.099 1.00 1.00 S ATOM 0 H CYS A 10 57.739 -5.008 8.569 1.00 1.00 H new ATOM 0 HA CYS A 10 58.966 -2.317 8.368 1.00 1.00 H new ATOM 0 HB2 CYS A 10 60.419 -3.573 9.976 1.00 1.00 H new ATOM 0 HB3 CYS A 10 60.575 -4.879 8.819 1.00 1.00 H new ATOM 150 N ARG A 11 57.965 -3.962 6.199 1.00 1.00 N ATOM 151 CA ARG A 11 57.927 -4.334 4.757 1.00 1.00 C ATOM 152 C ARG A 11 56.528 -4.075 4.192 1.00 1.00 C ATOM 153 O ARG A 11 55.604 -4.829 4.425 1.00 1.00 O ATOM 154 CB ARG A 11 58.274 -5.819 4.608 1.00 1.00 C ATOM 155 CG ARG A 11 58.785 -6.085 3.191 1.00 1.00 C ATOM 156 CD ARG A 11 59.106 -7.573 3.034 1.00 1.00 C ATOM 157 NE ARG A 11 60.190 -7.744 2.026 1.00 1.00 N ATOM 158 CZ ARG A 11 59.917 -7.650 0.753 1.00 1.00 C ATOM 159 NH1 ARG A 11 58.696 -7.407 0.363 1.00 1.00 N ATOM 160 NH2 ARG A 11 60.867 -7.800 -0.130 1.00 1.00 N ATOM 0 H ARG A 11 57.055 -3.875 6.652 1.00 1.00 H new ATOM 0 HA ARG A 11 58.651 -3.732 4.208 1.00 1.00 H new ATOM 0 HB2 ARG A 11 59.033 -6.101 5.338 1.00 1.00 H new ATOM 0 HB3 ARG A 11 57.395 -6.431 4.809 1.00 1.00 H new ATOM 0 HG2 ARG A 11 58.034 -5.785 2.460 1.00 1.00 H new ATOM 0 HG3 ARG A 11 59.676 -5.488 2.996 1.00 1.00 H new ATOM 0 HD2 ARG A 11 59.416 -7.992 3.991 1.00 1.00 H new ATOM 0 HD3 ARG A 11 58.215 -8.117 2.721 1.00 1.00 H new ATOM 0 HE ARG A 11 61.145 -7.934 2.331 1.00 1.00 H new ATOM 0 HH11 ARG A 11 57.954 -7.290 1.053 1.00 1.00 H new ATOM 0 HH12 ARG A 11 58.483 -7.334 -0.632 1.00 1.00 H new ATOM 0 HH21 ARG A 11 61.821 -7.990 0.175 1.00 1.00 H new ATOM 0 HH22 ARG A 11 60.655 -7.727 -1.125 1.00 1.00 H new ATOM 174 N SER A 12 56.366 -3.016 3.446 1.00 1.00 N ATOM 175 CA SER A 12 55.029 -2.714 2.863 1.00 1.00 C ATOM 176 C SER A 12 54.740 -3.699 1.728 1.00 1.00 C ATOM 177 O SER A 12 53.610 -3.874 1.316 1.00 1.00 O ATOM 178 CB SER A 12 55.022 -1.287 2.314 1.00 1.00 C ATOM 179 OG SER A 12 55.003 -0.367 3.397 1.00 1.00 O ATOM 0 H SER A 12 57.101 -2.348 3.216 1.00 1.00 H new ATOM 0 HA SER A 12 54.264 -2.808 3.634 1.00 1.00 H new ATOM 0 HB2 SER A 12 55.903 -1.119 1.695 1.00 1.00 H new ATOM 0 HB3 SER A 12 54.151 -1.134 1.677 1.00 1.00 H new ATOM 0 HG SER A 12 55.000 0.549 3.048 1.00 1.00 H new ATOM 185 N ALA A 13 55.756 -4.346 1.225 1.00 1.00 N ATOM 186 CA ALA A 13 55.550 -5.326 0.119 1.00 1.00 C ATOM 187 C ALA A 13 55.141 -4.586 -1.158 1.00 1.00 C ATOM 188 O ALA A 13 54.188 -4.951 -1.818 1.00 1.00 O ATOM 189 CB ALA A 13 54.454 -6.321 0.516 1.00 1.00 C ATOM 0 H ALA A 13 56.722 -4.238 1.533 1.00 1.00 H new ATOM 0 HA ALA A 13 56.479 -5.866 -0.064 1.00 1.00 H new ATOM 0 HB1 ALA A 13 54.303 -7.037 -0.292 1.00 1.00 H new ATOM 0 HB2 ALA A 13 54.754 -6.851 1.420 1.00 1.00 H new ATOM 0 HB3 ALA A 13 53.524 -5.783 0.702 1.00 1.00 H new ATOM 195 N THR A 14 55.856 -3.553 -1.515 1.00 1.00 N ATOM 196 CA THR A 14 55.508 -2.795 -2.752 1.00 1.00 C ATOM 197 C THR A 14 56.578 -1.732 -3.022 1.00 1.00 C ATOM 198 O THR A 14 56.274 -0.584 -3.278 1.00 1.00 O ATOM 199 CB THR A 14 54.147 -2.115 -2.573 1.00 1.00 C ATOM 200 OG1 THR A 14 53.877 -1.296 -3.701 1.00 1.00 O ATOM 201 CG2 THR A 14 54.166 -1.255 -1.308 1.00 1.00 C ATOM 0 H THR A 14 56.666 -3.201 -1.004 1.00 1.00 H new ATOM 0 HA THR A 14 55.461 -3.484 -3.595 1.00 1.00 H new ATOM 0 HB THR A 14 53.371 -2.874 -2.481 1.00 1.00 H new ATOM 0 HG1 THR A 14 54.606 -0.652 -3.819 1.00 1.00 H new ATOM 0 HG21 THR A 14 53.197 -0.772 -1.182 1.00 1.00 H new ATOM 0 HG22 THR A 14 54.373 -1.885 -0.443 1.00 1.00 H new ATOM 0 HG23 THR A 14 54.942 -0.495 -1.397 1.00 1.00 H new ATOM 209 N ARG A 15 57.829 -2.106 -2.969 1.00 1.00 N ATOM 210 CA ARG A 15 58.916 -1.117 -3.225 1.00 1.00 C ATOM 211 C ARG A 15 60.274 -1.827 -3.186 1.00 1.00 C ATOM 212 O ARG A 15 60.354 -3.034 -3.293 1.00 1.00 O ATOM 213 CB ARG A 15 58.871 -0.023 -2.151 1.00 1.00 C ATOM 214 CG ARG A 15 58.512 -0.646 -0.800 1.00 1.00 C ATOM 215 CD ARG A 15 58.986 0.273 0.328 1.00 1.00 C ATOM 216 NE ARG A 15 58.280 -0.087 1.590 1.00 1.00 N ATOM 217 CZ ARG A 15 58.409 0.667 2.647 1.00 1.00 C ATOM 218 NH1 ARG A 15 59.156 1.736 2.599 1.00 1.00 N ATOM 219 NH2 ARG A 15 57.791 0.353 3.752 1.00 1.00 N ATOM 0 H ARG A 15 58.145 -3.053 -2.760 1.00 1.00 H new ATOM 0 HA ARG A 15 58.776 -0.665 -4.207 1.00 1.00 H new ATOM 0 HB2 ARG A 15 59.837 0.478 -2.087 1.00 1.00 H new ATOM 0 HB3 ARG A 15 58.136 0.735 -2.420 1.00 1.00 H new ATOM 0 HG2 ARG A 15 57.435 -0.797 -0.732 1.00 1.00 H new ATOM 0 HG3 ARG A 15 58.978 -1.627 -0.704 1.00 1.00 H new ATOM 0 HD2 ARG A 15 60.064 0.177 0.461 1.00 1.00 H new ATOM 0 HD3 ARG A 15 58.788 1.314 0.072 1.00 1.00 H new ATOM 0 HE ARG A 15 57.696 -0.923 1.627 1.00 1.00 H new ATOM 0 HH11 ARG A 15 59.639 1.982 1.735 1.00 1.00 H new ATOM 0 HH12 ARG A 15 59.257 2.325 3.425 1.00 1.00 H new ATOM 0 HH21 ARG A 15 57.207 -0.482 3.790 1.00 1.00 H new ATOM 0 HH22 ARG A 15 57.892 0.943 4.578 1.00 1.00 H new ATOM 233 N VAL A 16 61.342 -1.087 -3.037 1.00 1.00 N ATOM 234 CA VAL A 16 62.693 -1.718 -2.992 1.00 1.00 C ATOM 235 C VAL A 16 62.900 -2.576 -4.245 1.00 1.00 C ATOM 236 O VAL A 16 63.501 -2.144 -5.208 1.00 1.00 O ATOM 237 CB VAL A 16 62.805 -2.588 -1.738 1.00 1.00 C ATOM 238 CG1 VAL A 16 64.253 -3.052 -1.565 1.00 1.00 C ATOM 239 CG2 VAL A 16 62.383 -1.773 -0.514 1.00 1.00 C ATOM 0 H VAL A 16 61.336 -0.071 -2.944 1.00 1.00 H new ATOM 0 HA VAL A 16 63.459 -0.943 -2.961 1.00 1.00 H new ATOM 0 HB VAL A 16 62.155 -3.457 -1.840 1.00 1.00 H new ATOM 0 HG11 VAL A 16 64.332 -3.672 -0.672 1.00 1.00 H new ATOM 0 HG12 VAL A 16 64.556 -3.632 -2.437 1.00 1.00 H new ATOM 0 HG13 VAL A 16 64.904 -2.183 -1.463 1.00 1.00 H new ATOM 0 HG21 VAL A 16 62.462 -2.392 0.380 1.00 1.00 H new ATOM 0 HG22 VAL A 16 63.034 -0.904 -0.413 1.00 1.00 H new ATOM 0 HG23 VAL A 16 61.352 -1.441 -0.636 1.00 1.00 H new ATOM 249 N MET A 17 62.401 -3.784 -4.244 1.00 1.00 N ATOM 250 CA MET A 17 62.562 -4.666 -5.438 1.00 1.00 C ATOM 251 C MET A 17 61.247 -4.689 -6.218 1.00 1.00 C ATOM 252 O MET A 17 61.231 -4.756 -7.431 1.00 1.00 O ATOM 253 CB MET A 17 62.915 -6.082 -4.979 1.00 1.00 C ATOM 254 CG MET A 17 63.994 -6.013 -3.896 1.00 1.00 C ATOM 255 SD MET A 17 64.841 -7.608 -3.786 1.00 1.00 S ATOM 256 CE MET A 17 66.453 -6.973 -3.263 1.00 1.00 C ATOM 0 H MET A 17 61.888 -4.199 -3.466 1.00 1.00 H new ATOM 0 HA MET A 17 63.360 -4.287 -6.076 1.00 1.00 H new ATOM 0 HB2 MET A 17 62.027 -6.582 -4.592 1.00 1.00 H new ATOM 0 HB3 MET A 17 63.270 -6.672 -5.824 1.00 1.00 H new ATOM 0 HG2 MET A 17 64.709 -5.225 -4.130 1.00 1.00 H new ATOM 0 HG3 MET A 17 63.545 -5.761 -2.935 1.00 1.00 H new ATOM 0 HE1 MET A 17 67.231 -7.687 -3.535 1.00 1.00 H new ATOM 0 HE2 MET A 17 66.646 -6.020 -3.756 1.00 1.00 H new ATOM 0 HE3 MET A 17 66.454 -6.829 -2.183 1.00 1.00 H new ATOM 266 N GLY A 18 60.144 -4.623 -5.526 1.00 1.00 N ATOM 267 CA GLY A 18 58.823 -4.628 -6.213 1.00 1.00 C ATOM 268 C GLY A 18 58.727 -5.821 -7.166 1.00 1.00 C ATOM 269 O GLY A 18 58.472 -5.663 -8.344 1.00 1.00 O ATOM 0 H GLY A 18 60.101 -4.566 -4.509 1.00 1.00 H new ATOM 0 HA2 GLY A 18 58.022 -4.677 -5.476 1.00 1.00 H new ATOM 0 HA3 GLY A 18 58.690 -3.699 -6.767 1.00 1.00 H new ATOM 273 N GLY A 19 58.913 -7.016 -6.668 1.00 1.00 N ATOM 274 CA GLY A 19 58.814 -8.219 -7.548 1.00 1.00 C ATOM 275 C GLY A 19 60.215 -8.775 -7.848 1.00 1.00 C ATOM 276 O GLY A 19 61.016 -8.955 -6.953 1.00 1.00 O ATOM 0 H GLY A 19 59.129 -7.211 -5.690 1.00 1.00 H new ATOM 0 HA2 GLY A 19 58.207 -8.984 -7.063 1.00 1.00 H new ATOM 0 HA3 GLY A 19 58.312 -7.957 -8.479 1.00 1.00 H new ATOM 280 N PRO A 20 60.506 -9.061 -9.097 1.00 1.00 N ATOM 281 CA PRO A 20 61.826 -9.623 -9.510 1.00 1.00 C ATOM 282 C PRO A 20 63.011 -8.941 -8.818 1.00 1.00 C ATOM 283 O PRO A 20 62.867 -7.923 -8.169 1.00 1.00 O ATOM 284 CB PRO A 20 61.862 -9.371 -11.017 1.00 1.00 C ATOM 285 CG PRO A 20 60.431 -9.401 -11.440 1.00 1.00 C ATOM 286 CD PRO A 20 59.611 -8.882 -10.253 1.00 1.00 C ATOM 0 HA PRO A 20 61.919 -10.674 -9.235 1.00 1.00 H new ATOM 0 HB2 PRO A 20 62.323 -8.410 -11.247 1.00 1.00 H new ATOM 0 HB3 PRO A 20 62.444 -10.135 -11.533 1.00 1.00 H new ATOM 0 HG2 PRO A 20 60.274 -8.778 -12.321 1.00 1.00 H new ATOM 0 HG3 PRO A 20 60.127 -10.413 -11.707 1.00 1.00 H new ATOM 0 HD2 PRO A 20 59.335 -7.836 -10.386 1.00 1.00 H new ATOM 0 HD3 PRO A 20 58.685 -9.444 -10.132 1.00 1.00 H new ATOM 294 N CYS A 21 64.181 -9.506 -8.955 1.00 1.00 N ATOM 295 CA CYS A 21 65.390 -8.915 -8.312 1.00 1.00 C ATOM 296 C CYS A 21 66.562 -8.968 -9.295 1.00 1.00 C ATOM 297 O CYS A 21 67.229 -9.975 -9.424 1.00 1.00 O ATOM 298 CB CYS A 21 65.740 -9.720 -7.060 1.00 1.00 C ATOM 299 SG CYS A 21 66.923 -8.791 -6.054 1.00 1.00 S ATOM 0 H CYS A 21 64.352 -10.358 -9.489 1.00 1.00 H new ATOM 0 HA CYS A 21 65.191 -7.879 -8.037 1.00 1.00 H new ATOM 0 HB2 CYS A 21 64.838 -9.925 -6.483 1.00 1.00 H new ATOM 0 HB3 CYS A 21 66.164 -10.684 -7.342 1.00 1.00 H new ATOM 304 N THR A 22 66.815 -7.892 -9.994 1.00 1.00 N ATOM 305 CA THR A 22 67.942 -7.878 -10.975 1.00 1.00 C ATOM 306 C THR A 22 68.838 -6.664 -10.702 1.00 1.00 C ATOM 307 O THR A 22 68.380 -5.652 -10.208 1.00 1.00 O ATOM 308 CB THR A 22 67.371 -7.783 -12.395 1.00 1.00 C ATOM 309 OG1 THR A 22 67.216 -6.417 -12.750 1.00 1.00 O ATOM 310 CG2 THR A 22 66.013 -8.484 -12.449 1.00 1.00 C ATOM 0 H THR A 22 66.289 -7.021 -9.928 1.00 1.00 H new ATOM 0 HA THR A 22 68.529 -8.791 -10.876 1.00 1.00 H new ATOM 0 HB THR A 22 68.053 -8.265 -13.095 1.00 1.00 H new ATOM 0 HG1 THR A 22 66.280 -6.244 -12.984 1.00 1.00 H new ATOM 0 HG21 THR A 22 65.608 -8.416 -13.459 1.00 1.00 H new ATOM 0 HG22 THR A 22 66.134 -9.532 -12.177 1.00 1.00 H new ATOM 0 HG23 THR A 22 65.328 -8.004 -11.750 1.00 1.00 H new ATOM 318 N PRO A 23 70.105 -6.758 -11.022 1.00 1.00 N ATOM 319 CA PRO A 23 71.071 -5.647 -10.809 1.00 1.00 C ATOM 320 C PRO A 23 70.438 -4.277 -11.069 1.00 1.00 C ATOM 321 O PRO A 23 69.999 -3.985 -12.164 1.00 1.00 O ATOM 322 CB PRO A 23 72.167 -5.946 -11.830 1.00 1.00 C ATOM 323 CG PRO A 23 72.173 -7.435 -11.965 1.00 1.00 C ATOM 324 CD PRO A 23 70.760 -7.929 -11.627 1.00 1.00 C ATOM 0 HA PRO A 23 71.432 -5.597 -9.782 1.00 1.00 H new ATOM 0 HB2 PRO A 23 71.959 -5.464 -12.785 1.00 1.00 H new ATOM 0 HB3 PRO A 23 73.135 -5.576 -11.490 1.00 1.00 H new ATOM 0 HG2 PRO A 23 72.451 -7.728 -12.977 1.00 1.00 H new ATOM 0 HG3 PRO A 23 72.907 -7.879 -11.292 1.00 1.00 H new ATOM 0 HD2 PRO A 23 70.231 -8.265 -12.519 1.00 1.00 H new ATOM 0 HD3 PRO A 23 70.787 -8.772 -10.936 1.00 1.00 H new ATOM 332 N ARG A 24 70.378 -3.438 -10.071 1.00 1.00 N ATOM 333 CA ARG A 24 69.762 -2.095 -10.265 1.00 1.00 C ATOM 334 C ARG A 24 68.418 -2.260 -10.976 1.00 1.00 C ATOM 335 O ARG A 24 68.074 -1.506 -11.863 1.00 1.00 O ATOM 336 CB ARG A 24 70.688 -1.220 -11.115 1.00 1.00 C ATOM 337 CG ARG A 24 70.111 0.193 -11.219 1.00 1.00 C ATOM 338 CD ARG A 24 69.962 0.578 -12.692 1.00 1.00 C ATOM 339 NE ARG A 24 69.207 1.858 -12.797 1.00 1.00 N ATOM 340 CZ ARG A 24 69.212 2.528 -13.917 1.00 1.00 C ATOM 341 NH1 ARG A 24 69.878 2.077 -14.944 1.00 1.00 N ATOM 342 NH2 ARG A 24 68.551 3.650 -14.009 1.00 1.00 N ATOM 0 H ARG A 24 70.728 -3.624 -9.131 1.00 1.00 H new ATOM 0 HA ARG A 24 69.610 -1.618 -9.296 1.00 1.00 H new ATOM 0 HB2 ARG A 24 71.682 -1.185 -10.669 1.00 1.00 H new ATOM 0 HB3 ARG A 24 70.800 -1.652 -12.110 1.00 1.00 H new ATOM 0 HG2 ARG A 24 69.143 0.239 -10.721 1.00 1.00 H new ATOM 0 HG3 ARG A 24 70.765 0.902 -10.711 1.00 1.00 H new ATOM 0 HD2 ARG A 24 70.944 0.684 -13.152 1.00 1.00 H new ATOM 0 HD3 ARG A 24 69.439 -0.210 -13.234 1.00 1.00 H new ATOM 0 HE ARG A 24 68.686 2.211 -11.994 1.00 1.00 H new ATOM 0 HH11 ARG A 24 70.395 1.201 -14.872 1.00 1.00 H new ATOM 0 HH12 ARG A 24 69.882 2.601 -15.819 1.00 1.00 H new ATOM 0 HH21 ARG A 24 68.031 4.003 -13.206 1.00 1.00 H new ATOM 0 HH22 ARG A 24 68.555 4.174 -14.884 1.00 1.00 H new ATOM 356 N LYS A 25 67.658 -3.246 -10.589 1.00 1.00 N ATOM 357 CA LYS A 25 66.337 -3.475 -11.228 1.00 1.00 C ATOM 358 C LYS A 25 66.534 -3.879 -12.695 1.00 1.00 C ATOM 359 O LYS A 25 65.602 -4.282 -13.362 1.00 1.00 O ATOM 360 CB LYS A 25 65.490 -2.193 -11.142 1.00 1.00 C ATOM 361 CG LYS A 25 64.159 -2.504 -10.455 1.00 1.00 C ATOM 362 CD LYS A 25 63.445 -3.628 -11.208 1.00 1.00 C ATOM 363 CE LYS A 25 61.947 -3.577 -10.902 1.00 1.00 C ATOM 364 NZ LYS A 25 61.302 -2.535 -11.751 1.00 1.00 N ATOM 0 H LYS A 25 67.900 -3.907 -9.851 1.00 1.00 H new ATOM 0 HA LYS A 25 65.818 -4.279 -10.706 1.00 1.00 H new ATOM 0 HB2 LYS A 25 66.028 -1.426 -10.585 1.00 1.00 H new ATOM 0 HB3 LYS A 25 65.311 -1.795 -12.141 1.00 1.00 H new ATOM 0 HG2 LYS A 25 64.332 -2.798 -9.420 1.00 1.00 H new ATOM 0 HG3 LYS A 25 63.533 -1.612 -10.432 1.00 1.00 H new ATOM 0 HD2 LYS A 25 63.612 -3.525 -12.280 1.00 1.00 H new ATOM 0 HD3 LYS A 25 63.854 -4.594 -10.914 1.00 1.00 H new ATOM 0 HE2 LYS A 25 61.493 -4.549 -11.093 1.00 1.00 H new ATOM 0 HE3 LYS A 25 61.788 -3.352 -9.847 1.00 1.00 H new ATOM 0 HZ1 LYS A 25 60.463 -2.161 -11.264 1.00 1.00 H new ATOM 0 HZ2 LYS A 25 61.976 -1.762 -11.923 1.00 1.00 H new ATOM 0 HZ3 LYS A 25 61.017 -2.955 -12.659 1.00 1.00 H new ATOM 378 N GLY A 26 67.734 -3.783 -13.204 1.00 1.00 N ATOM 379 CA GLY A 26 67.961 -4.174 -14.626 1.00 1.00 C ATOM 380 C GLY A 26 69.350 -3.710 -15.095 1.00 1.00 C ATOM 381 O GLY A 26 70.356 -4.248 -14.677 1.00 1.00 O ATOM 0 H GLY A 26 68.559 -3.454 -12.702 1.00 1.00 H new ATOM 0 HA2 GLY A 26 67.878 -5.256 -14.730 1.00 1.00 H new ATOM 0 HA3 GLY A 26 67.191 -3.733 -15.258 1.00 1.00 H new ATOM 385 N PRO A 27 69.410 -2.730 -15.969 1.00 1.00 N ATOM 386 CA PRO A 27 70.701 -2.210 -16.507 1.00 1.00 C ATOM 387 C PRO A 27 71.799 -2.122 -15.435 1.00 1.00 C ATOM 388 O PRO A 27 71.521 -1.889 -14.277 1.00 1.00 O ATOM 389 CB PRO A 27 70.333 -0.816 -17.014 1.00 1.00 C ATOM 390 CG PRO A 27 68.897 -0.921 -17.415 1.00 1.00 C ATOM 391 CD PRO A 27 68.261 -2.007 -16.539 1.00 1.00 C ATOM 0 HA PRO A 27 71.114 -2.865 -17.274 1.00 1.00 H new ATOM 0 HB2 PRO A 27 70.473 -0.063 -16.238 1.00 1.00 H new ATOM 0 HB3 PRO A 27 70.959 -0.524 -17.857 1.00 1.00 H new ATOM 0 HG2 PRO A 27 68.388 0.033 -17.276 1.00 1.00 H new ATOM 0 HG3 PRO A 27 68.810 -1.178 -18.471 1.00 1.00 H new ATOM 0 HD2 PRO A 27 67.636 -1.574 -15.758 1.00 1.00 H new ATOM 0 HD3 PRO A 27 67.625 -2.670 -17.125 1.00 1.00 H new ATOM 399 N PRO A 28 73.041 -2.299 -15.822 1.00 1.00 N ATOM 400 CA PRO A 28 74.194 -2.228 -14.880 1.00 1.00 C ATOM 401 C PRO A 28 74.059 -1.072 -13.883 1.00 1.00 C ATOM 402 O PRO A 28 73.253 -0.180 -14.059 1.00 1.00 O ATOM 403 CB PRO A 28 75.393 -2.003 -15.801 1.00 1.00 C ATOM 404 CG PRO A 28 75.011 -2.636 -17.100 1.00 1.00 C ATOM 405 CD PRO A 28 73.482 -2.583 -17.197 1.00 1.00 C ATOM 0 HA PRO A 28 74.275 -3.125 -14.266 1.00 1.00 H new ATOM 0 HB2 PRO A 28 75.600 -0.940 -15.926 1.00 1.00 H new ATOM 0 HB3 PRO A 28 76.295 -2.457 -15.391 1.00 1.00 H new ATOM 0 HG2 PRO A 28 75.468 -2.106 -17.936 1.00 1.00 H new ATOM 0 HG3 PRO A 28 75.364 -3.666 -17.145 1.00 1.00 H new ATOM 0 HD2 PRO A 28 73.154 -1.807 -17.888 1.00 1.00 H new ATOM 0 HD3 PRO A 28 73.073 -3.526 -17.559 1.00 1.00 H new ATOM 413 N LYS A 29 74.843 -1.081 -12.839 1.00 1.00 N ATOM 414 CA LYS A 29 74.758 0.018 -11.836 1.00 1.00 C ATOM 415 C LYS A 29 75.700 1.156 -12.244 1.00 1.00 C ATOM 416 O LYS A 29 75.279 2.151 -12.798 1.00 1.00 O ATOM 417 CB LYS A 29 75.154 -0.516 -10.454 1.00 1.00 C ATOM 418 CG LYS A 29 74.612 -1.936 -10.276 1.00 1.00 C ATOM 419 CD LYS A 29 75.719 -2.947 -10.582 1.00 1.00 C ATOM 420 CE LYS A 29 75.450 -4.245 -9.818 1.00 1.00 C ATOM 421 NZ LYS A 29 73.983 -4.402 -9.607 1.00 1.00 N ATOM 0 H LYS A 29 75.537 -1.801 -12.638 1.00 1.00 H new ATOM 0 HA LYS A 29 73.736 0.395 -11.794 1.00 1.00 H new ATOM 0 HB2 LYS A 29 76.239 -0.515 -10.350 1.00 1.00 H new ATOM 0 HB3 LYS A 29 74.758 0.135 -9.675 1.00 1.00 H new ATOM 0 HG2 LYS A 29 74.251 -2.074 -9.257 1.00 1.00 H new ATOM 0 HG3 LYS A 29 73.763 -2.098 -10.940 1.00 1.00 H new ATOM 0 HD2 LYS A 29 75.760 -3.145 -11.653 1.00 1.00 H new ATOM 0 HD3 LYS A 29 76.688 -2.539 -10.296 1.00 1.00 H new ATOM 0 HE2 LYS A 29 75.841 -5.096 -10.376 1.00 1.00 H new ATOM 0 HE3 LYS A 29 75.967 -4.229 -8.858 1.00 1.00 H new ATOM 0 HZ1 LYS A 29 73.762 -5.404 -9.440 1.00 1.00 H new ATOM 0 HZ2 LYS A 29 73.689 -3.840 -8.783 1.00 1.00 H new ATOM 0 HZ3 LYS A 29 73.473 -4.071 -10.451 1.00 1.00 H new ATOM 435 N CYS A 30 76.972 1.018 -11.977 1.00 1.00 N ATOM 436 CA CYS A 30 77.932 2.094 -12.354 1.00 1.00 C ATOM 437 C CYS A 30 79.363 1.614 -12.103 1.00 1.00 C ATOM 438 O CYS A 30 80.284 1.987 -12.802 1.00 1.00 O ATOM 439 CB CYS A 30 77.659 3.341 -11.510 1.00 1.00 C ATOM 440 SG CYS A 30 78.478 4.769 -12.263 1.00 1.00 S ATOM 0 H CYS A 30 77.386 0.208 -11.515 1.00 1.00 H new ATOM 0 HA CYS A 30 77.809 2.335 -13.410 1.00 1.00 H new ATOM 0 HB2 CYS A 30 76.586 3.518 -11.440 1.00 1.00 H new ATOM 0 HB3 CYS A 30 78.024 3.193 -10.494 1.00 1.00 H new ATOM 445 N LYS A 31 79.554 0.787 -11.112 1.00 1.00 N ATOM 446 CA LYS A 31 80.924 0.276 -10.810 1.00 1.00 C ATOM 447 C LYS A 31 81.935 1.424 -10.881 1.00 1.00 C ATOM 448 O LYS A 31 82.447 1.750 -11.934 1.00 1.00 O ATOM 449 CB LYS A 31 81.298 -0.800 -11.832 1.00 1.00 C ATOM 450 CG LYS A 31 80.283 -1.943 -11.771 1.00 1.00 C ATOM 451 CD LYS A 31 80.003 -2.454 -13.186 1.00 1.00 C ATOM 452 CE LYS A 31 81.251 -3.151 -13.733 1.00 1.00 C ATOM 453 NZ LYS A 31 81.524 -4.379 -12.935 1.00 1.00 N ATOM 0 H LYS A 31 78.819 0.441 -10.496 1.00 1.00 H new ATOM 0 HA LYS A 31 80.938 -0.150 -9.807 1.00 1.00 H new ATOM 0 HB2 LYS A 31 81.319 -0.372 -12.834 1.00 1.00 H new ATOM 0 HB3 LYS A 31 82.299 -1.178 -11.626 1.00 1.00 H new ATOM 0 HG2 LYS A 31 80.668 -2.752 -11.150 1.00 1.00 H new ATOM 0 HG3 LYS A 31 79.358 -1.598 -11.308 1.00 1.00 H new ATOM 0 HD2 LYS A 31 79.162 -3.147 -13.174 1.00 1.00 H new ATOM 0 HD3 LYS A 31 79.723 -1.624 -13.835 1.00 1.00 H new ATOM 0 HE2 LYS A 31 81.105 -3.411 -14.782 1.00 1.00 H new ATOM 0 HE3 LYS A 31 82.106 -2.477 -13.687 1.00 1.00 H new ATOM 0 HZ1 LYS A 31 82.076 -5.049 -13.507 1.00 1.00 H new ATOM 0 HZ2 LYS A 31 82.062 -4.126 -12.082 1.00 1.00 H new ATOM 0 HZ3 LYS A 31 80.624 -4.820 -12.658 1.00 1.00 H new ATOM 467 N GLN A 32 82.228 2.040 -9.767 1.00 1.00 N ATOM 468 CA GLN A 32 83.207 3.166 -9.771 1.00 1.00 C ATOM 469 C GLN A 32 83.937 3.214 -8.427 1.00 1.00 C ATOM 470 O GLN A 32 83.796 4.152 -7.667 1.00 1.00 O ATOM 471 CB GLN A 32 82.462 4.485 -9.993 1.00 1.00 C ATOM 472 CG GLN A 32 83.465 5.585 -10.345 1.00 1.00 C ATOM 473 CD GLN A 32 82.748 6.936 -10.386 1.00 1.00 C ATOM 474 OE1 GLN A 32 82.526 7.487 -11.446 1.00 1.00 O ATOM 475 NE2 GLN A 32 82.375 7.497 -9.268 1.00 1.00 N ATOM 0 H GLN A 32 81.832 1.812 -8.855 1.00 1.00 H new ATOM 0 HA GLN A 32 83.931 3.016 -10.572 1.00 1.00 H new ATOM 0 HB2 GLN A 32 81.733 4.373 -10.796 1.00 1.00 H new ATOM 0 HB3 GLN A 32 81.908 4.757 -9.095 1.00 1.00 H new ATOM 0 HG2 GLN A 32 84.267 5.610 -9.608 1.00 1.00 H new ATOM 0 HG3 GLN A 32 83.926 5.376 -11.311 1.00 1.00 H new ATOM 0 HE21 GLN A 32 82.561 7.034 -8.378 1.00 1.00 H new ATOM 0 HE22 GLN A 32 81.897 8.398 -9.284 1.00 1.00 H new ATOM 484 N ARG A 33 84.717 2.210 -8.127 1.00 1.00 N ATOM 485 CA ARG A 33 85.455 2.197 -6.832 1.00 1.00 C ATOM 486 C ARG A 33 86.099 3.563 -6.592 1.00 1.00 C ATOM 487 O ARG A 33 87.054 3.935 -7.244 1.00 1.00 O ATOM 488 CB ARG A 33 86.545 1.120 -6.878 1.00 1.00 C ATOM 489 CG ARG A 33 87.160 0.947 -5.488 1.00 1.00 C ATOM 490 CD ARG A 33 88.466 1.739 -5.404 1.00 1.00 C ATOM 491 NE ARG A 33 89.399 1.271 -6.467 1.00 1.00 N ATOM 492 CZ ARG A 33 90.682 1.483 -6.349 1.00 1.00 C ATOM 493 NH1 ARG A 33 91.146 2.104 -5.300 1.00 1.00 N ATOM 494 NH2 ARG A 33 91.499 1.073 -7.280 1.00 1.00 N ATOM 0 H ARG A 33 84.875 1.398 -8.724 1.00 1.00 H new ATOM 0 HA ARG A 33 84.759 1.979 -6.022 1.00 1.00 H new ATOM 0 HB2 ARG A 33 86.122 0.175 -7.219 1.00 1.00 H new ATOM 0 HB3 ARG A 33 87.317 1.401 -7.595 1.00 1.00 H new ATOM 0 HG2 ARG A 33 86.463 1.293 -4.725 1.00 1.00 H new ATOM 0 HG3 ARG A 33 87.349 -0.108 -5.292 1.00 1.00 H new ATOM 0 HD2 ARG A 33 88.266 2.804 -5.523 1.00 1.00 H new ATOM 0 HD3 ARG A 33 88.921 1.608 -4.422 1.00 1.00 H new ATOM 0 HE ARG A 33 89.036 0.785 -7.287 1.00 1.00 H new ATOM 0 HH11 ARG A 33 90.507 2.424 -4.572 1.00 1.00 H new ATOM 0 HH12 ARG A 33 92.148 2.270 -5.207 1.00 1.00 H new ATOM 0 HH21 ARG A 33 91.135 0.587 -8.100 1.00 1.00 H new ATOM 0 HH22 ARG A 33 92.501 1.239 -7.188 1.00 1.00 H new ATOM 508 N GLN A 34 85.583 4.311 -5.657 1.00 1.00 N ATOM 509 CA GLN A 34 86.158 5.654 -5.363 1.00 1.00 C ATOM 510 C GLN A 34 85.339 6.301 -4.241 1.00 1.00 C ATOM 511 O GLN A 34 84.576 7.221 -4.462 1.00 1.00 O ATOM 512 CB GLN A 34 86.108 6.522 -6.633 1.00 1.00 C ATOM 513 CG GLN A 34 87.532 6.892 -7.054 1.00 1.00 C ATOM 514 CD GLN A 34 87.496 7.603 -8.408 1.00 1.00 C ATOM 515 OE1 GLN A 34 87.174 7.003 -9.414 1.00 1.00 O ATOM 516 NE2 GLN A 34 87.816 8.867 -8.476 1.00 1.00 N ATOM 0 H GLN A 34 84.783 4.049 -5.081 1.00 1.00 H new ATOM 0 HA GLN A 34 87.197 5.561 -5.047 1.00 1.00 H new ATOM 0 HB2 GLN A 34 85.609 5.981 -7.437 1.00 1.00 H new ATOM 0 HB3 GLN A 34 85.526 7.425 -6.447 1.00 1.00 H new ATOM 0 HG2 GLN A 34 87.988 7.538 -6.304 1.00 1.00 H new ATOM 0 HG3 GLN A 34 88.148 5.995 -7.119 1.00 1.00 H new ATOM 0 HE21 GLN A 34 88.086 9.371 -7.631 1.00 1.00 H new ATOM 0 HE22 GLN A 34 87.796 9.351 -9.374 1.00 1.00 H new ATOM 525 N THR A 35 85.483 5.817 -3.037 1.00 1.00 N ATOM 526 CA THR A 35 84.705 6.392 -1.902 1.00 1.00 C ATOM 527 C THR A 35 85.562 6.394 -0.635 1.00 1.00 C ATOM 528 O THR A 35 85.356 5.608 0.267 1.00 1.00 O ATOM 529 CB THR A 35 83.451 5.543 -1.670 1.00 1.00 C ATOM 530 OG1 THR A 35 83.072 5.626 -0.304 1.00 1.00 O ATOM 531 CG2 THR A 35 83.744 4.086 -2.033 1.00 1.00 C ATOM 0 H THR A 35 86.106 5.048 -2.790 1.00 1.00 H new ATOM 0 HA THR A 35 84.418 7.416 -2.141 1.00 1.00 H new ATOM 0 HB THR A 35 82.639 5.914 -2.296 1.00 1.00 H new ATOM 0 HG21 THR A 35 82.851 3.483 -1.867 1.00 1.00 H new ATOM 0 HG22 THR A 35 84.035 4.024 -3.082 1.00 1.00 H new ATOM 0 HG23 THR A 35 84.555 3.712 -1.409 1.00 1.00 H new ATOM 539 N ARG A 36 86.518 7.279 -0.556 1.00 1.00 N ATOM 540 CA ARG A 36 87.382 7.336 0.658 1.00 1.00 C ATOM 541 C ARG A 36 86.723 8.253 1.694 1.00 1.00 C ATOM 542 O ARG A 36 87.302 9.223 2.140 1.00 1.00 O ATOM 543 CB ARG A 36 88.771 7.878 0.281 1.00 1.00 C ATOM 544 CG ARG A 36 89.048 7.594 -1.197 1.00 1.00 C ATOM 545 CD ARG A 36 88.444 8.708 -2.053 1.00 1.00 C ATOM 546 NE ARG A 36 89.531 9.597 -2.551 1.00 1.00 N ATOM 547 CZ ARG A 36 89.859 10.667 -1.880 1.00 1.00 C ATOM 548 NH1 ARG A 36 89.234 10.958 -0.771 1.00 1.00 N ATOM 549 NH2 ARG A 36 90.811 11.445 -2.316 1.00 1.00 N ATOM 0 H ARG A 36 86.738 7.964 -1.279 1.00 1.00 H new ATOM 0 HA ARG A 36 87.498 6.337 1.078 1.00 1.00 H new ATOM 0 HB2 ARG A 36 88.818 8.950 0.471 1.00 1.00 H new ATOM 0 HB3 ARG A 36 89.536 7.411 0.901 1.00 1.00 H new ATOM 0 HG2 ARG A 36 90.122 7.529 -1.371 1.00 1.00 H new ATOM 0 HG3 ARG A 36 88.621 6.632 -1.480 1.00 1.00 H new ATOM 0 HD2 ARG A 36 87.897 8.280 -2.893 1.00 1.00 H new ATOM 0 HD3 ARG A 36 87.728 9.284 -1.467 1.00 1.00 H new ATOM 0 HE ARG A 36 90.019 9.369 -3.417 1.00 1.00 H new ATOM 0 HH11 ARG A 36 88.490 10.349 -0.430 1.00 1.00 H new ATOM 0 HH12 ARG A 36 89.490 11.794 -0.246 1.00 1.00 H new ATOM 0 HH21 ARG A 36 91.299 11.217 -3.182 1.00 1.00 H new ATOM 0 HH22 ARG A 36 91.067 12.281 -1.791 1.00 1.00 H new ATOM 563 N GLN A 37 85.510 7.952 2.073 1.00 1.00 N ATOM 564 CA GLN A 37 84.800 8.802 3.072 1.00 1.00 C ATOM 565 C GLN A 37 84.520 10.177 2.462 1.00 1.00 C ATOM 566 O GLN A 37 85.152 10.586 1.509 1.00 1.00 O ATOM 567 CB GLN A 37 85.663 8.963 4.331 1.00 1.00 C ATOM 568 CG GLN A 37 84.772 9.338 5.517 1.00 1.00 C ATOM 569 CD GLN A 37 85.609 10.053 6.579 1.00 1.00 C ATOM 570 OE1 GLN A 37 85.483 9.777 7.756 1.00 1.00 O ATOM 571 NE2 GLN A 37 86.466 10.966 6.212 1.00 1.00 N ATOM 0 H GLN A 37 84.978 7.151 1.732 1.00 1.00 H new ATOM 0 HA GLN A 37 83.859 8.325 3.345 1.00 1.00 H new ATOM 0 HB2 GLN A 37 86.195 8.035 4.541 1.00 1.00 H new ATOM 0 HB3 GLN A 37 86.417 9.733 4.171 1.00 1.00 H new ATOM 0 HG2 GLN A 37 83.959 9.983 5.185 1.00 1.00 H new ATOM 0 HG3 GLN A 37 84.316 8.443 5.940 1.00 1.00 H new ATOM 0 HE21 GLN A 37 86.572 11.198 5.224 1.00 1.00 H new ATOM 0 HE22 GLN A 37 87.030 11.447 6.913 1.00 1.00 H new ATOM 580 N CYS A 38 83.571 10.891 3.004 1.00 1.00 N ATOM 581 CA CYS A 38 83.240 12.238 2.459 1.00 1.00 C ATOM 582 C CYS A 38 82.794 13.150 3.605 1.00 1.00 C ATOM 583 O CYS A 38 83.440 14.128 3.923 1.00 1.00 O ATOM 584 CB CYS A 38 82.105 12.105 1.438 1.00 1.00 C ATOM 585 SG CYS A 38 82.709 12.568 -0.204 1.00 1.00 S ATOM 0 H CYS A 38 83.009 10.598 3.803 1.00 1.00 H new ATOM 0 HA CYS A 38 84.117 12.666 1.974 1.00 1.00 H new ATOM 0 HB2 CYS A 38 81.733 11.081 1.424 1.00 1.00 H new ATOM 0 HB3 CYS A 38 81.269 12.744 1.723 1.00 1.00 H new ATOM 590 N LYS A 39 81.687 12.830 4.223 1.00 1.00 N ATOM 591 CA LYS A 39 81.177 13.665 5.350 1.00 1.00 C ATOM 592 C LYS A 39 81.214 12.847 6.643 1.00 1.00 C ATOM 593 O LYS A 39 81.396 13.378 7.720 1.00 1.00 O ATOM 594 CB LYS A 39 79.733 14.080 5.051 1.00 1.00 C ATOM 595 CG LYS A 39 79.679 14.839 3.724 1.00 1.00 C ATOM 596 CD LYS A 39 78.426 14.425 2.949 1.00 1.00 C ATOM 597 CE LYS A 39 77.181 14.918 3.689 1.00 1.00 C ATOM 598 NZ LYS A 39 76.892 14.008 4.834 1.00 1.00 N ATOM 0 H LYS A 39 81.111 12.020 3.993 1.00 1.00 H new ATOM 0 HA LYS A 39 81.799 14.553 5.464 1.00 1.00 H new ATOM 0 HB2 LYS A 39 79.094 13.199 5.003 1.00 1.00 H new ATOM 0 HB3 LYS A 39 79.351 14.708 5.856 1.00 1.00 H new ATOM 0 HG2 LYS A 39 79.667 15.913 3.908 1.00 1.00 H new ATOM 0 HG3 LYS A 39 80.571 14.626 3.135 1.00 1.00 H new ATOM 0 HD2 LYS A 39 78.453 14.843 1.943 1.00 1.00 H new ATOM 0 HD3 LYS A 39 78.393 13.341 2.843 1.00 1.00 H new ATOM 0 HE2 LYS A 39 77.337 15.935 4.049 1.00 1.00 H new ATOM 0 HE3 LYS A 39 76.329 14.948 3.010 1.00 1.00 H new ATOM 0 HZ1 LYS A 39 75.884 14.070 5.081 1.00 1.00 H new ATOM 0 HZ2 LYS A 39 77.123 13.030 4.567 1.00 1.00 H new ATOM 0 HZ3 LYS A 39 77.467 14.288 5.654 1.00 1.00 H new ATOM 612 N SER A 40 81.042 11.557 6.541 1.00 1.00 N ATOM 613 CA SER A 40 81.066 10.698 7.760 1.00 1.00 C ATOM 614 C SER A 40 79.826 10.982 8.612 1.00 1.00 C ATOM 615 O SER A 40 79.920 11.241 9.795 1.00 1.00 O ATOM 616 CB SER A 40 82.330 10.996 8.572 1.00 1.00 C ATOM 617 OG SER A 40 83.378 11.364 7.687 1.00 1.00 O ATOM 0 H SER A 40 80.886 11.060 5.664 1.00 1.00 H new ATOM 0 HA SER A 40 81.067 9.649 7.464 1.00 1.00 H new ATOM 0 HB2 SER A 40 82.139 11.800 9.283 1.00 1.00 H new ATOM 0 HB3 SER A 40 82.619 10.120 9.152 1.00 1.00 H new ATOM 0 HG SER A 40 84.216 10.951 7.983 1.00 1.00 H new ATOM 623 N LYS A 41 78.663 10.933 8.015 1.00 1.00 N ATOM 624 CA LYS A 41 77.408 11.199 8.780 1.00 1.00 C ATOM 625 C LYS A 41 76.479 9.986 8.667 1.00 1.00 C ATOM 626 O LYS A 41 75.581 9.961 7.849 1.00 1.00 O ATOM 627 CB LYS A 41 76.706 12.426 8.189 1.00 1.00 C ATOM 628 CG LYS A 41 77.649 13.630 8.234 1.00 1.00 C ATOM 629 CD LYS A 41 77.550 14.305 9.603 1.00 1.00 C ATOM 630 CE LYS A 41 76.183 14.978 9.744 1.00 1.00 C ATOM 631 NZ LYS A 41 76.336 16.263 10.484 1.00 1.00 N ATOM 0 H LYS A 41 78.528 10.719 7.027 1.00 1.00 H new ATOM 0 HA LYS A 41 77.650 11.381 9.827 1.00 1.00 H new ATOM 0 HB2 LYS A 41 76.406 12.225 7.161 1.00 1.00 H new ATOM 0 HB3 LYS A 41 75.797 12.642 8.750 1.00 1.00 H new ATOM 0 HG2 LYS A 41 78.674 13.310 8.048 1.00 1.00 H new ATOM 0 HG3 LYS A 41 77.389 14.339 7.448 1.00 1.00 H new ATOM 0 HD2 LYS A 41 77.687 13.568 10.394 1.00 1.00 H new ATOM 0 HD3 LYS A 41 78.344 15.044 9.714 1.00 1.00 H new ATOM 0 HE2 LYS A 41 75.753 15.162 8.759 1.00 1.00 H new ATOM 0 HE3 LYS A 41 75.495 14.320 10.275 1.00 1.00 H new ATOM 0 HZ1 LYS A 41 75.407 16.721 10.580 1.00 1.00 H new ATOM 0 HZ2 LYS A 41 76.729 16.075 11.428 1.00 1.00 H new ATOM 0 HZ3 LYS A 41 76.979 16.891 9.960 1.00 1.00 H new ATOM 645 N PRO A 42 76.691 8.987 9.485 1.00 1.00 N ATOM 646 CA PRO A 42 75.856 7.755 9.475 1.00 1.00 C ATOM 647 C PRO A 42 74.532 7.947 10.238 1.00 1.00 C ATOM 648 O PRO A 42 74.450 8.745 11.150 1.00 1.00 O ATOM 649 CB PRO A 42 76.744 6.717 10.168 1.00 1.00 C ATOM 650 CG PRO A 42 77.664 7.494 11.054 1.00 1.00 C ATOM 651 CD PRO A 42 77.751 8.921 10.503 1.00 1.00 C ATOM 0 HA PRO A 42 75.559 7.465 8.467 1.00 1.00 H new ATOM 0 HB2 PRO A 42 76.145 6.014 10.747 1.00 1.00 H new ATOM 0 HB3 PRO A 42 77.305 6.133 9.438 1.00 1.00 H new ATOM 0 HG2 PRO A 42 77.291 7.502 12.078 1.00 1.00 H new ATOM 0 HG3 PRO A 42 78.651 7.033 11.078 1.00 1.00 H new ATOM 0 HD2 PRO A 42 77.594 9.660 11.288 1.00 1.00 H new ATOM 0 HD3 PRO A 42 78.731 9.120 10.069 1.00 1.00 H new ATOM 659 N PRO A 43 73.501 7.224 9.863 1.00 1.00 N ATOM 660 CA PRO A 43 72.162 7.323 10.517 1.00 1.00 C ATOM 661 C PRO A 43 72.044 6.459 11.780 1.00 1.00 C ATOM 662 O PRO A 43 72.782 5.512 11.971 1.00 1.00 O ATOM 663 CB PRO A 43 71.223 6.800 9.433 1.00 1.00 C ATOM 664 CG PRO A 43 72.029 5.776 8.703 1.00 1.00 C ATOM 665 CD PRO A 43 73.491 6.232 8.774 1.00 1.00 C ATOM 0 HA PRO A 43 71.949 8.337 10.856 1.00 1.00 H new ATOM 0 HB2 PRO A 43 70.323 6.363 9.865 1.00 1.00 H new ATOM 0 HB3 PRO A 43 70.901 7.600 8.767 1.00 1.00 H new ATOM 0 HG2 PRO A 43 71.908 4.793 9.157 1.00 1.00 H new ATOM 0 HG3 PRO A 43 71.700 5.691 7.667 1.00 1.00 H new ATOM 0 HD2 PRO A 43 74.160 5.398 8.987 1.00 1.00 H new ATOM 0 HD3 PRO A 43 73.819 6.670 7.831 1.00 1.00 H new ATOM 673 N LYS A 44 71.106 6.778 12.636 1.00 1.00 N ATOM 674 CA LYS A 44 70.910 5.982 13.885 1.00 1.00 C ATOM 675 C LYS A 44 72.221 5.891 14.671 1.00 1.00 C ATOM 676 O LYS A 44 72.267 5.337 15.752 1.00 1.00 O ATOM 677 CB LYS A 44 70.433 4.572 13.520 1.00 1.00 C ATOM 678 CG LYS A 44 70.311 3.728 14.790 1.00 1.00 C ATOM 679 CD LYS A 44 69.381 2.542 14.528 1.00 1.00 C ATOM 680 CE LYS A 44 69.507 1.531 15.669 1.00 1.00 C ATOM 681 NZ LYS A 44 68.430 0.509 15.549 1.00 1.00 N ATOM 0 H LYS A 44 70.463 7.562 12.522 1.00 1.00 H new ATOM 0 HA LYS A 44 70.162 6.476 14.505 1.00 1.00 H new ATOM 0 HB2 LYS A 44 69.470 4.623 13.011 1.00 1.00 H new ATOM 0 HB3 LYS A 44 71.135 4.107 12.828 1.00 1.00 H new ATOM 0 HG2 LYS A 44 71.294 3.372 15.098 1.00 1.00 H new ATOM 0 HG3 LYS A 44 69.922 4.335 15.607 1.00 1.00 H new ATOM 0 HD2 LYS A 44 68.350 2.886 14.446 1.00 1.00 H new ATOM 0 HD3 LYS A 44 69.636 2.069 13.580 1.00 1.00 H new ATOM 0 HE2 LYS A 44 70.485 1.050 15.636 1.00 1.00 H new ATOM 0 HE3 LYS A 44 69.434 2.040 16.630 1.00 1.00 H new ATOM 0 HZ1 LYS A 44 68.516 -0.178 16.325 1.00 1.00 H new ATOM 0 HZ2 LYS A 44 67.502 0.975 15.600 1.00 1.00 H new ATOM 0 HZ3 LYS A 44 68.520 0.016 14.638 1.00 1.00 H new ATOM 695 N LYS A 45 73.287 6.428 14.144 1.00 1.00 N ATOM 696 CA LYS A 45 74.591 6.368 14.865 1.00 1.00 C ATOM 697 C LYS A 45 74.841 7.701 15.574 1.00 1.00 C ATOM 698 O LYS A 45 74.462 7.891 16.713 1.00 1.00 O ATOM 699 CB LYS A 45 75.709 6.102 13.851 1.00 1.00 C ATOM 700 CG LYS A 45 75.860 4.595 13.636 1.00 1.00 C ATOM 701 CD LYS A 45 76.828 4.025 14.675 1.00 1.00 C ATOM 702 CE LYS A 45 78.248 4.506 14.369 1.00 1.00 C ATOM 703 NZ LYS A 45 79.216 3.409 14.655 1.00 1.00 N ATOM 0 H LYS A 45 73.312 6.907 13.244 1.00 1.00 H new ATOM 0 HA LYS A 45 74.571 5.568 15.605 1.00 1.00 H new ATOM 0 HB2 LYS A 45 75.480 6.593 12.905 1.00 1.00 H new ATOM 0 HB3 LYS A 45 76.648 6.524 14.210 1.00 1.00 H new ATOM 0 HG2 LYS A 45 74.890 4.106 13.721 1.00 1.00 H new ATOM 0 HG3 LYS A 45 76.231 4.396 12.630 1.00 1.00 H new ATOM 0 HD2 LYS A 45 76.533 4.343 15.675 1.00 1.00 H new ATOM 0 HD3 LYS A 45 76.791 2.936 14.663 1.00 1.00 H new ATOM 0 HE2 LYS A 45 78.324 4.809 13.325 1.00 1.00 H new ATOM 0 HE3 LYS A 45 78.485 5.382 14.973 1.00 1.00 H new ATOM 0 HZ1 LYS A 45 80.181 3.735 14.447 1.00 1.00 H new ATOM 0 HZ2 LYS A 45 79.150 3.140 15.657 1.00 1.00 H new ATOM 0 HZ3 LYS A 45 78.993 2.586 14.060 1.00 1.00 H new ATOM 717 N GLY A 46 75.477 8.627 14.910 1.00 1.00 N ATOM 718 CA GLY A 46 75.751 9.946 15.547 1.00 1.00 C ATOM 719 C GLY A 46 76.756 10.726 14.698 1.00 1.00 C ATOM 720 O GLY A 46 76.406 11.335 13.707 1.00 1.00 O ATOM 0 H GLY A 46 75.819 8.527 13.954 1.00 1.00 H new ATOM 0 HA2 GLY A 46 74.825 10.513 15.646 1.00 1.00 H new ATOM 0 HA3 GLY A 46 76.145 9.801 16.553 1.00 1.00 H new ATOM 724 N VAL A 47 78.006 10.711 15.077 1.00 1.00 N ATOM 725 CA VAL A 47 79.034 11.452 14.291 1.00 1.00 C ATOM 726 C VAL A 47 80.386 10.748 14.429 1.00 1.00 C ATOM 727 O VAL A 47 81.428 11.373 14.387 1.00 1.00 O ATOM 728 CB VAL A 47 79.148 12.883 14.820 1.00 1.00 C ATOM 729 CG1 VAL A 47 77.926 13.690 14.379 1.00 1.00 C ATOM 730 CG2 VAL A 47 79.215 12.856 16.348 1.00 1.00 C ATOM 0 H VAL A 47 78.359 10.218 15.897 1.00 1.00 H new ATOM 0 HA VAL A 47 78.741 11.475 13.241 1.00 1.00 H new ATOM 0 HB VAL A 47 80.051 13.346 14.423 1.00 1.00 H new ATOM 0 HG11 VAL A 47 78.008 14.709 14.756 1.00 1.00 H new ATOM 0 HG12 VAL A 47 77.876 13.709 13.290 1.00 1.00 H new ATOM 0 HG13 VAL A 47 77.022 13.228 14.776 1.00 1.00 H new ATOM 0 HG21 VAL A 47 79.296 13.875 16.727 1.00 1.00 H new ATOM 0 HG22 VAL A 47 78.311 12.393 16.744 1.00 1.00 H new ATOM 0 HG23 VAL A 47 80.085 12.281 16.664 1.00 1.00 H new ATOM 740 N GLN A 48 80.379 9.453 14.593 1.00 1.00 N ATOM 741 CA GLN A 48 81.665 8.713 14.732 1.00 1.00 C ATOM 742 C GLN A 48 82.548 8.998 13.514 1.00 1.00 C ATOM 743 O GLN A 48 82.291 9.905 12.748 1.00 1.00 O ATOM 744 CB GLN A 48 81.382 7.210 14.820 1.00 1.00 C ATOM 745 CG GLN A 48 80.960 6.852 16.246 1.00 1.00 C ATOM 746 CD GLN A 48 79.755 7.703 16.651 1.00 1.00 C ATOM 747 OE1 GLN A 48 79.933 8.956 16.967 1.00 1.00 O flip ATOM 748 NE2 GLN A 48 78.639 7.222 16.681 1.00 1.00 N flip ATOM 0 H GLN A 48 79.539 8.876 14.637 1.00 1.00 H new ATOM 0 HA GLN A 48 82.178 9.038 15.637 1.00 1.00 H new ATOM 0 HB2 GLN A 48 80.595 6.936 14.117 1.00 1.00 H new ATOM 0 HB3 GLN A 48 82.271 6.645 14.540 1.00 1.00 H new ATOM 0 HG2 GLN A 48 80.708 5.793 16.307 1.00 1.00 H new ATOM 0 HG3 GLN A 48 81.787 7.023 16.935 1.00 1.00 H new ATOM 0 HE21 GLN A 48 78.499 6.242 16.434 1.00 1.00 H new ATOM 0 HE22 GLN A 48 77.842 7.798 16.953 1.00 1.00 H new ATOM 757 N GLY A 49 83.587 8.228 13.331 1.00 1.00 N ATOM 758 CA GLY A 49 84.490 8.451 12.164 1.00 1.00 C ATOM 759 C GLY A 49 84.910 7.102 11.577 1.00 1.00 C ATOM 760 O GLY A 49 86.062 6.721 11.636 1.00 1.00 O ATOM 0 H GLY A 49 83.850 7.453 13.940 1.00 1.00 H new ATOM 0 HA2 GLY A 49 83.981 9.047 11.406 1.00 1.00 H new ATOM 0 HA3 GLY A 49 85.370 9.014 12.474 1.00 1.00 H new ATOM 764 N CYS A 50 83.985 6.379 11.008 1.00 1.00 N ATOM 765 CA CYS A 50 84.332 5.058 10.413 1.00 1.00 C ATOM 766 C CYS A 50 85.176 5.273 9.155 1.00 1.00 C ATOM 767 O CYS A 50 85.357 4.373 8.359 1.00 1.00 O ATOM 768 CB CYS A 50 83.049 4.313 10.037 1.00 1.00 C ATOM 769 SG CYS A 50 82.229 3.721 11.538 1.00 1.00 S ATOM 0 H CYS A 50 83.004 6.646 10.929 1.00 1.00 H new ATOM 0 HA CYS A 50 84.896 4.472 11.138 1.00 1.00 H new ATOM 0 HB2 CYS A 50 82.382 4.973 9.482 1.00 1.00 H new ATOM 0 HB3 CYS A 50 83.283 3.473 9.383 1.00 1.00 H new ATOM 774 N GLY A 51 85.683 6.464 8.960 1.00 1.00 N ATOM 775 CA GLY A 51 86.502 6.740 7.741 1.00 1.00 C ATOM 776 C GLY A 51 87.952 7.040 8.127 1.00 1.00 C ATOM 777 O GLY A 51 88.618 6.238 8.751 1.00 1.00 O ATOM 0 H GLY A 51 85.565 7.256 9.592 1.00 1.00 H new ATOM 0 HA2 GLY A 51 86.468 5.881 7.071 1.00 1.00 H new ATOM 0 HA3 GLY A 51 86.082 7.586 7.197 1.00 1.00 H new ATOM 781 N ASP A 52 88.448 8.186 7.744 1.00 1.00 N ATOM 782 CA ASP A 52 89.860 8.540 8.066 1.00 1.00 C ATOM 783 C ASP A 52 90.789 7.654 7.229 1.00 1.00 C ATOM 784 O ASP A 52 91.989 7.836 7.209 1.00 1.00 O ATOM 785 CB ASP A 52 90.115 8.335 9.572 1.00 1.00 C ATOM 786 CG ASP A 52 90.960 7.078 9.786 1.00 1.00 C ATOM 787 OD1 ASP A 52 92.146 7.130 9.503 1.00 1.00 O ATOM 788 OD2 ASP A 52 90.407 6.084 10.228 1.00 1.00 O ATOM 0 H ASP A 52 87.934 8.894 7.220 1.00 1.00 H new ATOM 0 HA ASP A 52 90.053 9.586 7.829 1.00 1.00 H new ATOM 0 HB2 ASP A 52 90.627 9.204 9.985 1.00 1.00 H new ATOM 0 HB3 ASP A 52 89.167 8.242 10.102 1.00 1.00 H new ATOM 793 N ASP A 53 90.226 6.700 6.533 1.00 1.00 N ATOM 794 CA ASP A 53 91.041 5.785 5.680 1.00 1.00 C ATOM 795 C ASP A 53 90.190 4.563 5.325 1.00 1.00 C ATOM 796 O ASP A 53 90.700 3.515 4.983 1.00 1.00 O ATOM 797 CB ASP A 53 92.291 5.328 6.440 1.00 1.00 C ATOM 798 CG ASP A 53 91.942 5.112 7.914 1.00 1.00 C ATOM 799 OD1 ASP A 53 90.765 5.008 8.214 1.00 1.00 O ATOM 800 OD2 ASP A 53 92.859 5.054 8.717 1.00 1.00 O ATOM 0 H ASP A 53 89.223 6.514 6.520 1.00 1.00 H new ATOM 0 HA ASP A 53 91.351 6.309 4.776 1.00 1.00 H new ATOM 0 HB2 ASP A 53 92.675 4.404 6.007 1.00 1.00 H new ATOM 0 HB3 ASP A 53 93.079 6.075 6.348 1.00 1.00 H new ATOM 805 N ILE A 54 88.894 4.691 5.421 1.00 1.00 N ATOM 806 CA ILE A 54 87.997 3.540 5.109 1.00 1.00 C ATOM 807 C ILE A 54 86.678 4.073 4.534 1.00 1.00 C ATOM 808 O ILE A 54 86.156 5.065 5.001 1.00 1.00 O ATOM 809 CB ILE A 54 87.718 2.773 6.412 1.00 1.00 C ATOM 810 CG1 ILE A 54 89.011 2.117 6.902 1.00 1.00 C ATOM 811 CG2 ILE A 54 86.666 1.693 6.154 1.00 1.00 C ATOM 812 CD1 ILE A 54 88.701 1.203 8.090 1.00 1.00 C ATOM 0 H ILE A 54 88.416 5.547 5.703 1.00 1.00 H new ATOM 0 HA ILE A 54 88.467 2.878 4.381 1.00 1.00 H new ATOM 0 HB ILE A 54 87.350 3.465 7.169 1.00 1.00 H new ATOM 0 HG12 ILE A 54 89.468 1.542 6.096 1.00 1.00 H new ATOM 0 HG13 ILE A 54 89.731 2.881 7.196 1.00 1.00 H new ATOM 0 HG21 ILE A 54 86.468 1.149 7.078 1.00 1.00 H new ATOM 0 HG22 ILE A 54 85.745 2.159 5.803 1.00 1.00 H new ATOM 0 HG23 ILE A 54 87.034 1.000 5.397 1.00 1.00 H new ATOM 0 HD11 ILE A 54 89.622 0.736 8.439 1.00 1.00 H new ATOM 0 HD12 ILE A 54 88.264 1.791 8.897 1.00 1.00 H new ATOM 0 HD13 ILE A 54 87.997 0.431 7.781 1.00 1.00 H new ATOM 824 N PRO A 55 86.124 3.419 3.541 1.00 1.00 N ATOM 825 CA PRO A 55 84.831 3.852 2.935 1.00 1.00 C ATOM 826 C PRO A 55 83.677 3.712 3.935 1.00 1.00 C ATOM 827 O PRO A 55 82.559 3.406 3.575 1.00 1.00 O ATOM 828 CB PRO A 55 84.639 2.906 1.741 1.00 1.00 C ATOM 829 CG PRO A 55 85.490 1.714 2.038 1.00 1.00 C ATOM 830 CD PRO A 55 86.657 2.209 2.896 1.00 1.00 C ATOM 0 HA PRO A 55 84.843 4.901 2.640 1.00 1.00 H new ATOM 0 HB2 PRO A 55 83.592 2.623 1.628 1.00 1.00 H new ATOM 0 HB3 PRO A 55 84.942 3.383 0.809 1.00 1.00 H new ATOM 0 HG2 PRO A 55 84.917 0.952 2.566 1.00 1.00 H new ATOM 0 HG3 PRO A 55 85.853 1.259 1.117 1.00 1.00 H new ATOM 0 HD2 PRO A 55 86.959 1.463 3.631 1.00 1.00 H new ATOM 0 HD3 PRO A 55 87.535 2.432 2.289 1.00 1.00 H new ATOM 838 N GLY A 56 83.950 3.930 5.193 1.00 1.00 N ATOM 839 CA GLY A 56 82.884 3.807 6.226 1.00 1.00 C ATOM 840 C GLY A 56 81.688 4.678 5.845 1.00 1.00 C ATOM 841 O GLY A 56 80.621 4.560 6.413 1.00 1.00 O ATOM 0 H GLY A 56 84.870 4.189 5.550 1.00 1.00 H new ATOM 0 HA2 GLY A 56 82.573 2.766 6.318 1.00 1.00 H new ATOM 0 HA3 GLY A 56 83.271 4.111 7.199 1.00 1.00 H new ATOM 845 N MET A 57 81.853 5.556 4.892 1.00 1.00 N ATOM 846 CA MET A 57 80.711 6.430 4.490 1.00 1.00 C ATOM 847 C MET A 57 79.454 5.567 4.340 1.00 1.00 C ATOM 848 O MET A 57 79.468 4.541 3.691 1.00 1.00 O ATOM 849 CB MET A 57 81.019 7.151 3.164 1.00 1.00 C ATOM 850 CG MET A 57 82.008 6.322 2.342 1.00 1.00 C ATOM 851 SD MET A 57 81.202 4.800 1.785 1.00 1.00 S ATOM 852 CE MET A 57 80.013 5.572 0.660 1.00 1.00 C ATOM 0 H MET A 57 82.721 5.706 4.378 1.00 1.00 H new ATOM 0 HA MET A 57 80.550 7.187 5.257 1.00 1.00 H new ATOM 0 HB2 MET A 57 80.099 7.302 2.599 1.00 1.00 H new ATOM 0 HB3 MET A 57 81.436 8.138 3.364 1.00 1.00 H new ATOM 0 HG2 MET A 57 82.356 6.897 1.484 1.00 1.00 H new ATOM 0 HG3 MET A 57 82.886 6.083 2.942 1.00 1.00 H new ATOM 0 HE1 MET A 57 79.019 5.165 0.846 1.00 1.00 H new ATOM 0 HE2 MET A 57 80.001 6.649 0.826 1.00 1.00 H new ATOM 0 HE3 MET A 57 80.302 5.367 -0.371 1.00 1.00 H new ATOM 862 N GLU A 58 78.370 5.967 4.953 1.00 1.00 N ATOM 863 CA GLU A 58 77.116 5.160 4.860 1.00 1.00 C ATOM 864 C GLU A 58 76.089 5.890 3.986 1.00 1.00 C ATOM 865 O GLU A 58 75.916 5.573 2.826 1.00 1.00 O ATOM 866 CB GLU A 58 76.549 4.942 6.271 1.00 1.00 C ATOM 867 CG GLU A 58 75.876 3.570 6.344 1.00 1.00 C ATOM 868 CD GLU A 58 75.198 3.406 7.706 1.00 1.00 C ATOM 869 OE1 GLU A 58 75.899 3.443 8.703 1.00 1.00 O ATOM 870 OE2 GLU A 58 73.988 3.246 7.727 1.00 1.00 O ATOM 0 H GLU A 58 78.299 6.816 5.513 1.00 1.00 H new ATOM 0 HA GLU A 58 77.336 4.194 4.406 1.00 1.00 H new ATOM 0 HB2 GLU A 58 77.348 5.007 7.010 1.00 1.00 H new ATOM 0 HB3 GLU A 58 75.830 5.725 6.510 1.00 1.00 H new ATOM 0 HG2 GLU A 58 75.141 3.471 5.546 1.00 1.00 H new ATOM 0 HG3 GLU A 58 76.615 2.782 6.196 1.00 1.00 H new ATOM 877 N GLY A 59 75.404 6.860 4.529 1.00 1.00 N ATOM 878 CA GLY A 59 74.393 7.596 3.719 1.00 1.00 C ATOM 879 C GLY A 59 73.519 8.456 4.633 1.00 1.00 C ATOM 880 O GLY A 59 73.871 8.739 5.760 1.00 1.00 O ATOM 0 HA2 GLY A 59 74.893 8.225 2.982 1.00 1.00 H new ATOM 0 HA3 GLY A 59 73.773 6.890 3.167 1.00 1.00 H new ATOM 884 N CYS A 60 72.380 8.876 4.147 1.00 1.00 N ATOM 885 CA CYS A 60 71.473 9.722 4.973 1.00 1.00 C ATOM 886 C CYS A 60 70.029 9.252 4.782 1.00 1.00 C ATOM 887 O CYS A 60 69.125 10.045 4.608 1.00 1.00 O ATOM 888 CB CYS A 60 71.596 11.182 4.531 1.00 1.00 C ATOM 889 SG CYS A 60 73.344 11.643 4.450 1.00 1.00 S ATOM 0 H CYS A 60 72.039 8.667 3.209 1.00 1.00 H new ATOM 0 HA CYS A 60 71.749 9.636 6.024 1.00 1.00 H new ATOM 0 HB2 CYS A 60 71.127 11.319 3.556 1.00 1.00 H new ATOM 0 HB3 CYS A 60 71.070 11.831 5.231 1.00 1.00 H new ATOM 894 N GLY A 61 69.809 7.964 4.809 1.00 1.00 N ATOM 895 CA GLY A 61 68.426 7.431 4.626 1.00 1.00 C ATOM 896 C GLY A 61 68.264 6.917 3.195 1.00 1.00 C ATOM 897 O GLY A 61 67.352 6.172 2.892 1.00 1.00 O ATOM 0 H GLY A 61 70.529 7.256 4.950 1.00 1.00 H new ATOM 0 HA2 GLY A 61 68.238 6.626 5.337 1.00 1.00 H new ATOM 0 HA3 GLY A 61 67.694 8.213 4.828 1.00 1.00 H new ATOM 901 N THR A 62 69.142 7.307 2.310 1.00 1.00 N ATOM 902 CA THR A 62 69.040 6.841 0.896 1.00 1.00 C ATOM 903 C THR A 62 69.870 5.571 0.716 1.00 1.00 C ATOM 904 O THR A 62 69.446 4.629 0.078 1.00 1.00 O ATOM 905 CB THR A 62 69.572 7.927 -0.040 1.00 1.00 C ATOM 906 OG1 THR A 62 70.094 7.323 -1.214 1.00 1.00 O ATOM 907 CG2 THR A 62 70.677 8.716 0.665 1.00 1.00 C ATOM 0 H THR A 62 69.927 7.929 2.505 1.00 1.00 H new ATOM 0 HA THR A 62 67.997 6.633 0.659 1.00 1.00 H new ATOM 0 HB THR A 62 68.761 8.604 -0.309 1.00 1.00 H new ATOM 0 HG1 THR A 62 70.434 8.018 -1.816 1.00 1.00 H new ATOM 0 HG21 THR A 62 71.055 9.489 -0.004 1.00 1.00 H new ATOM 0 HG22 THR A 62 70.275 9.180 1.566 1.00 1.00 H new ATOM 0 HG23 THR A 62 71.489 8.042 0.936 1.00 1.00 H new ATOM 915 N ASP A 63 71.052 5.538 1.270 1.00 1.00 N ATOM 916 CA ASP A 63 71.904 4.326 1.126 1.00 1.00 C ATOM 917 C ASP A 63 71.255 3.167 1.882 1.00 1.00 C ATOM 918 O ASP A 63 71.805 2.644 2.830 1.00 1.00 O ATOM 919 CB ASP A 63 73.293 4.600 1.704 1.00 1.00 C ATOM 920 CG ASP A 63 74.240 3.462 1.319 1.00 1.00 C ATOM 921 OD1 ASP A 63 74.840 3.549 0.260 1.00 1.00 O ATOM 922 OD2 ASP A 63 74.350 2.523 2.090 1.00 1.00 O ATOM 0 H ASP A 63 71.462 6.297 1.814 1.00 1.00 H new ATOM 0 HA ASP A 63 72.001 4.070 0.071 1.00 1.00 H new ATOM 0 HB2 ASP A 63 73.675 5.549 1.326 1.00 1.00 H new ATOM 0 HB3 ASP A 63 73.236 4.689 2.789 1.00 1.00 H new ATOM 927 N ILE A 64 70.082 2.770 1.474 1.00 1.00 N ATOM 928 CA ILE A 64 69.387 1.654 2.173 1.00 1.00 C ATOM 929 C ILE A 64 68.148 1.260 1.371 1.00 1.00 C ATOM 930 O ILE A 64 67.473 0.295 1.672 1.00 1.00 O ATOM 931 CB ILE A 64 68.984 2.128 3.574 1.00 1.00 C ATOM 932 CG1 ILE A 64 68.932 0.928 4.522 1.00 1.00 C ATOM 933 CG2 ILE A 64 67.605 2.788 3.514 1.00 1.00 C ATOM 934 CD1 ILE A 64 68.712 1.417 5.954 1.00 1.00 C ATOM 0 H ILE A 64 69.574 3.171 0.686 1.00 1.00 H new ATOM 0 HA ILE A 64 70.043 0.788 2.260 1.00 1.00 H new ATOM 0 HB ILE A 64 69.716 2.849 3.937 1.00 1.00 H new ATOM 0 HG12 ILE A 64 68.127 0.254 4.229 1.00 1.00 H new ATOM 0 HG13 ILE A 64 69.861 0.361 4.459 1.00 1.00 H new ATOM 0 HG21 ILE A 64 67.319 3.125 4.510 1.00 1.00 H new ATOM 0 HG22 ILE A 64 67.640 3.643 2.838 1.00 1.00 H new ATOM 0 HG23 ILE A 64 66.872 2.068 3.150 1.00 1.00 H new ATOM 0 HD11 ILE A 64 68.675 0.562 6.629 1.00 1.00 H new ATOM 0 HD12 ILE A 64 69.532 2.073 6.244 1.00 1.00 H new ATOM 0 HD13 ILE A 64 67.771 1.965 6.011 1.00 1.00 H new ATOM 946 N THR A 65 67.851 2.008 0.350 1.00 1.00 N ATOM 947 CA THR A 65 66.665 1.704 -0.493 1.00 1.00 C ATOM 948 C THR A 65 66.892 2.319 -1.868 1.00 1.00 C ATOM 949 O THR A 65 66.361 1.869 -2.864 1.00 1.00 O ATOM 950 CB THR A 65 65.413 2.313 0.144 1.00 1.00 C ATOM 951 OG1 THR A 65 65.134 1.645 1.366 1.00 1.00 O ATOM 952 CG2 THR A 65 64.226 2.157 -0.808 1.00 1.00 C ATOM 0 H THR A 65 68.385 2.827 0.060 1.00 1.00 H new ATOM 0 HA THR A 65 66.527 0.626 -0.579 1.00 1.00 H new ATOM 0 HB THR A 65 65.582 3.372 0.338 1.00 1.00 H new ATOM 0 HG1 THR A 65 65.839 0.989 1.549 1.00 1.00 H new ATOM 0 HG21 THR A 65 63.335 2.591 -0.353 1.00 1.00 H new ATOM 0 HG22 THR A 65 64.441 2.670 -1.745 1.00 1.00 H new ATOM 0 HG23 THR A 65 64.054 1.099 -1.005 1.00 1.00 H new ATOM 960 N VAL A 66 67.694 3.348 -1.923 1.00 1.00 N ATOM 961 CA VAL A 66 67.987 4.010 -3.221 1.00 1.00 C ATOM 962 C VAL A 66 69.365 3.562 -3.710 1.00 1.00 C ATOM 963 O VAL A 66 69.536 3.207 -4.859 1.00 1.00 O ATOM 964 CB VAL A 66 67.983 5.528 -3.032 1.00 1.00 C ATOM 965 CG1 VAL A 66 67.920 6.213 -4.398 1.00 1.00 C ATOM 966 CG2 VAL A 66 66.763 5.934 -2.202 1.00 1.00 C ATOM 0 H VAL A 66 68.161 3.760 -1.115 1.00 1.00 H new ATOM 0 HA VAL A 66 67.228 3.735 -3.954 1.00 1.00 H new ATOM 0 HB VAL A 66 68.893 5.832 -2.515 1.00 1.00 H new ATOM 0 HG11 VAL A 66 67.917 7.295 -4.263 1.00 1.00 H new ATOM 0 HG12 VAL A 66 68.788 5.924 -4.991 1.00 1.00 H new ATOM 0 HG13 VAL A 66 67.010 5.910 -4.916 1.00 1.00 H new ATOM 0 HG21 VAL A 66 66.759 7.016 -2.066 1.00 1.00 H new ATOM 0 HG22 VAL A 66 65.853 5.630 -2.719 1.00 1.00 H new ATOM 0 HG23 VAL A 66 66.807 5.446 -1.228 1.00 1.00 H new ATOM 976 N ILE A 67 70.354 3.572 -2.847 1.00 1.00 N ATOM 977 CA ILE A 67 71.718 3.140 -3.279 1.00 1.00 C ATOM 978 C ILE A 67 72.339 2.225 -2.224 1.00 1.00 C ATOM 979 O ILE A 67 73.016 2.675 -1.322 1.00 1.00 O ATOM 980 CB ILE A 67 72.615 4.365 -3.463 1.00 1.00 C ATOM 981 CG1 ILE A 67 72.030 5.264 -4.554 1.00 1.00 C ATOM 982 CG2 ILE A 67 74.018 3.914 -3.873 1.00 1.00 C ATOM 983 CD1 ILE A 67 72.802 6.585 -4.596 1.00 1.00 C ATOM 0 H ILE A 67 70.275 3.858 -1.871 1.00 1.00 H new ATOM 0 HA ILE A 67 71.630 2.601 -4.222 1.00 1.00 H new ATOM 0 HB ILE A 67 72.671 4.918 -2.526 1.00 1.00 H new ATOM 0 HG12 ILE A 67 72.089 4.765 -5.521 1.00 1.00 H new ATOM 0 HG13 ILE A 67 70.975 5.453 -4.357 1.00 1.00 H new ATOM 0 HG21 ILE A 67 74.657 4.787 -4.004 1.00 1.00 H new ATOM 0 HG22 ILE A 67 74.435 3.272 -3.097 1.00 1.00 H new ATOM 0 HG23 ILE A 67 73.963 3.361 -4.811 1.00 1.00 H new ATOM 0 HD11 ILE A 67 72.385 7.225 -5.373 1.00 1.00 H new ATOM 0 HD12 ILE A 67 72.720 7.085 -3.631 1.00 1.00 H new ATOM 0 HD13 ILE A 67 73.851 6.386 -4.814 1.00 1.00 H new ATOM 995 N CYS A 68 72.140 0.942 -2.338 1.00 1.00 N ATOM 996 CA CYS A 68 72.746 0.008 -1.348 1.00 1.00 C ATOM 997 C CYS A 68 74.095 -0.482 -1.887 1.00 1.00 C ATOM 998 O CYS A 68 74.293 -0.571 -3.083 1.00 1.00 O ATOM 999 CB CYS A 68 71.808 -1.184 -1.133 1.00 1.00 C ATOM 1000 SG CYS A 68 70.681 -0.825 0.237 1.00 1.00 S ATOM 0 H CYS A 68 71.586 0.500 -3.071 1.00 1.00 H new ATOM 0 HA CYS A 68 72.897 0.519 -0.397 1.00 1.00 H new ATOM 0 HB2 CYS A 68 71.241 -1.383 -2.042 1.00 1.00 H new ATOM 0 HB3 CYS A 68 72.387 -2.082 -0.916 1.00 1.00 H new ATOM 1005 N PRO A 69 75.024 -0.792 -1.019 1.00 1.00 N ATOM 1006 CA PRO A 69 76.375 -1.270 -1.433 1.00 1.00 C ATOM 1007 C PRO A 69 76.290 -2.512 -2.324 1.00 1.00 C ATOM 1008 O PRO A 69 77.278 -2.976 -2.857 1.00 1.00 O ATOM 1009 CB PRO A 69 77.092 -1.595 -0.111 1.00 1.00 C ATOM 1010 CG PRO A 69 76.037 -1.600 0.948 1.00 1.00 C ATOM 1011 CD PRO A 69 74.890 -0.723 0.442 1.00 1.00 C ATOM 0 HA PRO A 69 76.903 -0.522 -2.024 1.00 1.00 H new ATOM 0 HB2 PRO A 69 77.591 -2.562 -0.167 1.00 1.00 H new ATOM 0 HB3 PRO A 69 77.859 -0.852 0.108 1.00 1.00 H new ATOM 0 HG2 PRO A 69 75.690 -2.615 1.141 1.00 1.00 H new ATOM 0 HG3 PRO A 69 76.432 -1.214 1.888 1.00 1.00 H new ATOM 0 HD2 PRO A 69 73.922 -1.097 0.774 1.00 1.00 H new ATOM 0 HD3 PRO A 69 74.977 0.301 0.805 1.00 1.00 H new ATOM 1019 N TRP A 70 75.114 -3.050 -2.488 1.00 1.00 N ATOM 1020 CA TRP A 70 74.957 -4.258 -3.343 1.00 1.00 C ATOM 1021 C TRP A 70 74.922 -3.836 -4.818 1.00 1.00 C ATOM 1022 O TRP A 70 75.256 -4.603 -5.699 1.00 1.00 O ATOM 1023 CB TRP A 70 73.653 -4.978 -2.954 1.00 1.00 C ATOM 1024 CG TRP A 70 72.927 -5.407 -4.189 1.00 1.00 C ATOM 1025 CD1 TRP A 70 73.424 -6.240 -5.131 1.00 1.00 C ATOM 1026 CD2 TRP A 70 71.587 -5.042 -4.630 1.00 1.00 C ATOM 1027 NE1 TRP A 70 72.476 -6.410 -6.123 1.00 1.00 N ATOM 1028 CE2 TRP A 70 71.327 -5.693 -5.861 1.00 1.00 C ATOM 1029 CE3 TRP A 70 70.583 -4.220 -4.090 1.00 1.00 C ATOM 1030 CZ2 TRP A 70 70.111 -5.531 -6.531 1.00 1.00 C ATOM 1031 CZ3 TRP A 70 69.362 -4.055 -4.759 1.00 1.00 C ATOM 1032 CH2 TRP A 70 69.125 -4.708 -5.976 1.00 1.00 C ATOM 0 HA TRP A 70 75.796 -4.938 -3.196 1.00 1.00 H new ATOM 0 HB2 TRP A 70 73.876 -5.845 -2.332 1.00 1.00 H new ATOM 0 HB3 TRP A 70 73.023 -4.315 -2.362 1.00 1.00 H new ATOM 0 HD1 TRP A 70 74.402 -6.698 -5.112 1.00 1.00 H new ATOM 0 HE1 TRP A 70 72.610 -6.994 -6.948 1.00 1.00 H new ATOM 0 HE3 TRP A 70 70.753 -3.712 -3.153 1.00 1.00 H new ATOM 0 HZ2 TRP A 70 69.934 -6.037 -7.469 1.00 1.00 H new ATOM 0 HZ3 TRP A 70 68.599 -3.420 -4.333 1.00 1.00 H new ATOM 0 HH2 TRP A 70 68.182 -4.576 -6.485 1.00 1.00 H new ATOM 1043 N GLU A 71 74.520 -2.625 -5.096 1.00 1.00 N ATOM 1044 CA GLU A 71 74.464 -2.169 -6.514 1.00 1.00 C ATOM 1045 C GLU A 71 75.860 -1.738 -6.974 1.00 1.00 C ATOM 1046 O GLU A 71 76.244 -1.949 -8.106 1.00 1.00 O ATOM 1047 CB GLU A 71 73.499 -0.987 -6.630 1.00 1.00 C ATOM 1048 CG GLU A 71 72.060 -1.485 -6.480 1.00 1.00 C ATOM 1049 CD GLU A 71 71.093 -0.311 -6.644 1.00 1.00 C ATOM 1050 OE1 GLU A 71 71.476 0.663 -7.272 1.00 1.00 O ATOM 1051 OE2 GLU A 71 69.987 -0.405 -6.139 1.00 1.00 O ATOM 0 HA GLU A 71 74.115 -2.988 -7.144 1.00 1.00 H new ATOM 0 HB2 GLU A 71 73.721 -0.246 -5.862 1.00 1.00 H new ATOM 0 HB3 GLU A 71 73.626 -0.494 -7.594 1.00 1.00 H new ATOM 0 HG2 GLU A 71 71.849 -2.250 -7.227 1.00 1.00 H new ATOM 0 HG3 GLU A 71 71.924 -1.948 -5.502 1.00 1.00 H new ATOM 1058 N ALA A 72 76.624 -1.145 -6.103 1.00 1.00 N ATOM 1059 CA ALA A 72 77.997 -0.711 -6.491 1.00 1.00 C ATOM 1060 C ALA A 72 78.846 -1.954 -6.746 1.00 1.00 C ATOM 1061 O ALA A 72 78.355 -2.955 -7.226 1.00 1.00 O ATOM 1062 CB ALA A 72 78.613 0.110 -5.356 1.00 1.00 C ATOM 0 H ALA A 72 76.360 -0.941 -5.139 1.00 1.00 H new ATOM 0 HA ALA A 72 77.956 -0.098 -7.391 1.00 1.00 H new ATOM 0 HB1 ALA A 72 79.617 0.427 -5.640 1.00 1.00 H new ATOM 0 HB2 ALA A 72 77.995 0.988 -5.165 1.00 1.00 H new ATOM 0 HB3 ALA A 72 78.666 -0.499 -4.454 1.00 1.00 H new ATOM 1068 N CYS A 73 80.108 -1.914 -6.418 1.00 1.00 N ATOM 1069 CA CYS A 73 80.959 -3.117 -6.633 1.00 1.00 C ATOM 1070 C CYS A 73 80.358 -4.288 -5.852 1.00 1.00 C ATOM 1071 O CYS A 73 80.792 -4.613 -4.764 1.00 1.00 O ATOM 1072 CB CYS A 73 82.385 -2.836 -6.142 1.00 1.00 C ATOM 1073 SG CYS A 73 82.371 -1.396 -5.045 1.00 1.00 S ATOM 0 HA CYS A 73 80.997 -3.363 -7.694 1.00 1.00 H new ATOM 0 HB2 CYS A 73 82.777 -3.705 -5.614 1.00 1.00 H new ATOM 0 HB3 CYS A 73 83.044 -2.654 -6.991 1.00 1.00 H new ATOM 1078 N ASN A 74 79.340 -4.900 -6.398 1.00 1.00 N ATOM 1079 CA ASN A 74 78.662 -6.035 -5.708 1.00 1.00 C ATOM 1080 C ASN A 74 79.669 -6.868 -4.913 1.00 1.00 C ATOM 1081 O ASN A 74 79.356 -7.394 -3.863 1.00 1.00 O ATOM 1082 CB ASN A 74 77.978 -6.922 -6.755 1.00 1.00 C ATOM 1083 CG ASN A 74 76.763 -7.609 -6.128 1.00 1.00 C ATOM 1084 OD1 ASN A 74 76.667 -7.715 -4.921 1.00 1.00 O ATOM 1085 ND2 ASN A 74 75.826 -8.083 -6.901 1.00 1.00 N ATOM 0 H ASN A 74 78.945 -4.657 -7.306 1.00 1.00 H new ATOM 0 HA ASN A 74 77.923 -5.634 -5.014 1.00 1.00 H new ATOM 0 HB2 ASN A 74 77.668 -6.321 -7.610 1.00 1.00 H new ATOM 0 HB3 ASN A 74 78.679 -7.669 -7.128 1.00 1.00 H new ATOM 0 HD21 ASN A 74 75.012 -8.543 -6.493 1.00 1.00 H new ATOM 0 HD22 ASN A 74 75.907 -7.994 -7.914 1.00 1.00 H new ATOM 1092 N HIS A 75 80.868 -7.010 -5.405 1.00 1.00 N ATOM 1093 CA HIS A 75 81.872 -7.827 -4.669 1.00 1.00 C ATOM 1094 C HIS A 75 81.253 -9.190 -4.345 1.00 1.00 C ATOM 1095 O HIS A 75 81.813 -9.984 -3.616 1.00 1.00 O ATOM 1096 CB HIS A 75 82.261 -7.108 -3.372 1.00 1.00 C ATOM 1097 CG HIS A 75 83.090 -8.027 -2.518 1.00 1.00 C ATOM 1098 ND1 HIS A 75 84.282 -8.669 -2.750 1.00 1.00 N flip ATOM 1099 CD2 HIS A 75 82.711 -8.385 -1.233 1.00 1.00 C flip ATOM 1100 CE1 HIS A 75 84.634 -9.412 -1.627 1.00 1.00 C flip ATOM 1101 NE2 HIS A 75 83.656 -9.207 -0.743 1.00 1.00 N flip ATOM 0 H HIS A 75 81.195 -6.599 -6.279 1.00 1.00 H new ATOM 0 HA HIS A 75 82.765 -7.965 -5.279 1.00 1.00 H new ATOM 0 HB2 HIS A 75 82.822 -6.202 -3.600 1.00 1.00 H new ATOM 0 HB3 HIS A 75 81.366 -6.801 -2.831 1.00 1.00 H new ATOM 0 HD2 HIS A 75 81.818 -8.062 -0.719 1.00 1.00 H new ATOM 0 HE1 HIS A 75 85.514 -10.025 -1.498 1.00 1.00 H new ATOM 0 HE2 HIS A 75 83.628 -9.622 0.188 1.00 1.00 H new ATOM 1110 N CYS A 76 80.097 -9.463 -4.896 1.00 1.00 N ATOM 1111 CA CYS A 76 79.423 -10.767 -4.641 1.00 1.00 C ATOM 1112 C CYS A 76 79.072 -11.419 -5.978 1.00 1.00 C ATOM 1113 O CYS A 76 79.652 -12.414 -6.367 1.00 1.00 O ATOM 1114 CB CYS A 76 78.140 -10.533 -3.840 1.00 1.00 C ATOM 1115 SG CYS A 76 78.558 -9.861 -2.212 1.00 1.00 S ATOM 0 H CYS A 76 79.590 -8.832 -5.516 1.00 1.00 H new ATOM 0 HA CYS A 76 80.089 -11.418 -4.075 1.00 1.00 H new ATOM 0 HB2 CYS A 76 77.487 -9.842 -4.373 1.00 1.00 H new ATOM 0 HB3 CYS A 76 77.592 -11.469 -3.729 1.00 1.00 H new ATOM 1120 N GLU A 77 78.128 -10.862 -6.689 1.00 1.00 N ATOM 1121 CA GLU A 77 77.750 -11.452 -8.005 1.00 1.00 C ATOM 1122 C GLU A 77 78.853 -11.160 -9.021 1.00 1.00 C ATOM 1123 O GLU A 77 78.900 -11.740 -10.088 1.00 1.00 O ATOM 1124 CB GLU A 77 76.428 -10.843 -8.484 1.00 1.00 C ATOM 1125 CG GLU A 77 76.136 -11.306 -9.913 1.00 1.00 C ATOM 1126 CD GLU A 77 76.265 -12.828 -9.993 1.00 1.00 C ATOM 1127 OE1 GLU A 77 75.558 -13.502 -9.262 1.00 1.00 O ATOM 1128 OE2 GLU A 77 77.068 -13.294 -10.785 1.00 1.00 O ATOM 0 H GLU A 77 77.605 -10.029 -6.417 1.00 1.00 H new ATOM 0 HA GLU A 77 77.627 -12.530 -7.901 1.00 1.00 H new ATOM 0 HB2 GLU A 77 75.617 -11.143 -7.821 1.00 1.00 H new ATOM 0 HB3 GLU A 77 76.483 -9.755 -8.448 1.00 1.00 H new ATOM 0 HG2 GLU A 77 75.132 -11.000 -10.208 1.00 1.00 H new ATOM 0 HG3 GLU A 77 76.830 -10.835 -10.608 1.00 1.00 H new ATOM 1135 N LEU A 78 79.745 -10.262 -8.695 1.00 1.00 N ATOM 1136 CA LEU A 78 80.851 -9.924 -9.636 1.00 1.00 C ATOM 1137 C LEU A 78 82.172 -9.861 -8.851 1.00 1.00 C ATOM 1138 O LEU A 78 82.555 -10.814 -8.203 1.00 1.00 O ATOM 1139 CB LEU A 78 80.540 -8.571 -10.304 1.00 1.00 C ATOM 1140 CG LEU A 78 81.081 -8.566 -11.735 1.00 1.00 C ATOM 1141 CD1 LEU A 78 82.582 -8.861 -11.716 1.00 1.00 C ATOM 1142 CD2 LEU A 78 80.362 -9.639 -12.554 1.00 1.00 C ATOM 0 H LEU A 78 79.754 -9.747 -7.815 1.00 1.00 H new ATOM 0 HA LEU A 78 80.944 -10.683 -10.412 1.00 1.00 H new ATOM 0 HB2 LEU A 78 79.464 -8.397 -10.311 1.00 1.00 H new ATOM 0 HB3 LEU A 78 80.990 -7.760 -9.732 1.00 1.00 H new ATOM 0 HG LEU A 78 80.909 -7.588 -12.184 1.00 1.00 H new ATOM 0 HD11 LEU A 78 82.966 -8.857 -12.736 1.00 1.00 H new ATOM 0 HD12 LEU A 78 83.096 -8.097 -11.132 1.00 1.00 H new ATOM 0 HD13 LEU A 78 82.755 -9.839 -11.267 1.00 1.00 H new ATOM 0 HD21 LEU A 78 80.746 -9.637 -13.574 1.00 1.00 H new ATOM 0 HD22 LEU A 78 80.534 -10.617 -12.104 1.00 1.00 H new ATOM 0 HD23 LEU A 78 79.292 -9.430 -12.569 1.00 1.00 H new ATOM 1154 N HIS A 79 82.868 -8.755 -8.895 1.00 1.00 N ATOM 1155 CA HIS A 79 84.155 -8.648 -8.146 1.00 1.00 C ATOM 1156 C HIS A 79 84.734 -7.242 -8.332 1.00 1.00 C ATOM 1157 O HIS A 79 84.301 -6.489 -9.182 1.00 1.00 O ATOM 1158 CB HIS A 79 85.151 -9.686 -8.679 1.00 1.00 C ATOM 1159 CG HIS A 79 86.515 -9.412 -8.108 1.00 1.00 C ATOM 1160 ND1 HIS A 79 87.027 -9.561 -6.841 1.00 1.00 N flip ATOM 1161 CD2 HIS A 79 87.554 -8.915 -8.881 1.00 1.00 C flip ATOM 1162 CE1 HIS A 79 88.360 -9.163 -6.832 1.00 1.00 C flip ATOM 1163 NE2 HIS A 79 88.628 -8.783 -8.083 1.00 1.00 N flip ATOM 0 H HIS A 79 82.601 -7.921 -9.418 1.00 1.00 H new ATOM 0 HA HIS A 79 83.975 -8.833 -7.087 1.00 1.00 H new ATOM 0 HB2 HIS A 79 84.826 -10.690 -8.407 1.00 1.00 H new ATOM 0 HB3 HIS A 79 85.186 -9.646 -9.768 1.00 1.00 H new ATOM 0 HD2 HIS A 79 87.508 -8.677 -9.933 1.00 1.00 H new ATOM 0 HE1 HIS A 79 89.036 -9.162 -5.990 1.00 1.00 H new ATOM 0 HE2 HIS A 79 89.535 -8.436 -8.395 1.00 1.00 H new ATOM 1172 N GLU A 80 85.714 -6.885 -7.547 1.00 1.00 N ATOM 1173 CA GLU A 80 86.326 -5.532 -7.680 1.00 1.00 C ATOM 1174 C GLU A 80 87.547 -5.436 -6.759 1.00 1.00 C ATOM 1175 O GLU A 80 88.255 -6.402 -6.552 1.00 1.00 O ATOM 1176 CB GLU A 80 85.302 -4.458 -7.289 1.00 1.00 C ATOM 1177 CG GLU A 80 85.638 -3.145 -7.999 1.00 1.00 C ATOM 1178 CD GLU A 80 84.996 -3.136 -9.388 1.00 1.00 C ATOM 1179 OE1 GLU A 80 85.387 -3.952 -10.206 1.00 1.00 O ATOM 1180 OE2 GLU A 80 84.122 -2.314 -9.609 1.00 1.00 O ATOM 0 H GLU A 80 86.118 -7.473 -6.818 1.00 1.00 H new ATOM 0 HA GLU A 80 86.633 -5.373 -8.714 1.00 1.00 H new ATOM 0 HB2 GLU A 80 84.298 -4.783 -7.560 1.00 1.00 H new ATOM 0 HB3 GLU A 80 85.309 -4.311 -6.209 1.00 1.00 H new ATOM 0 HG2 GLU A 80 85.275 -2.300 -7.414 1.00 1.00 H new ATOM 0 HG3 GLU A 80 86.719 -3.032 -8.086 1.00 1.00 H new ATOM 1187 N LEU A 81 87.799 -4.281 -6.206 1.00 1.00 N ATOM 1188 CA LEU A 81 88.976 -4.127 -5.300 1.00 1.00 C ATOM 1189 C LEU A 81 88.562 -4.492 -3.869 1.00 1.00 C ATOM 1190 O LEU A 81 89.319 -4.330 -2.934 1.00 1.00 O ATOM 1191 CB LEU A 81 89.468 -2.672 -5.342 1.00 1.00 C ATOM 1192 CG LEU A 81 90.501 -2.507 -6.458 1.00 1.00 C ATOM 1193 CD1 LEU A 81 91.852 -3.051 -5.989 1.00 1.00 C ATOM 1194 CD2 LEU A 81 90.042 -3.282 -7.695 1.00 1.00 C ATOM 0 H LEU A 81 87.242 -3.437 -6.341 1.00 1.00 H new ATOM 0 HA LEU A 81 89.780 -4.787 -5.626 1.00 1.00 H new ATOM 0 HB2 LEU A 81 88.627 -1.999 -5.510 1.00 1.00 H new ATOM 0 HB3 LEU A 81 89.908 -2.399 -4.383 1.00 1.00 H new ATOM 0 HG LEU A 81 90.602 -1.450 -6.706 1.00 1.00 H new ATOM 0 HD11 LEU A 81 92.588 -2.933 -6.785 1.00 1.00 H new ATOM 0 HD12 LEU A 81 92.180 -2.500 -5.107 1.00 1.00 H new ATOM 0 HD13 LEU A 81 91.752 -4.108 -5.741 1.00 1.00 H new ATOM 0 HD21 LEU A 81 90.777 -3.165 -8.491 1.00 1.00 H new ATOM 0 HD22 LEU A 81 89.942 -4.338 -7.446 1.00 1.00 H new ATOM 0 HD23 LEU A 81 89.080 -2.895 -8.030 1.00 1.00 H new ATOM 1206 N ALA A 82 87.365 -4.986 -3.696 1.00 1.00 N ATOM 1207 CA ALA A 82 86.898 -5.370 -2.331 1.00 1.00 C ATOM 1208 C ALA A 82 87.686 -6.584 -1.842 1.00 1.00 C ATOM 1209 O ALA A 82 87.141 -7.476 -1.225 1.00 1.00 O ATOM 1210 CB ALA A 82 85.407 -5.716 -2.385 1.00 1.00 C ATOM 0 H ALA A 82 86.688 -5.141 -4.443 1.00 1.00 H new ATOM 0 HA ALA A 82 87.056 -4.538 -1.645 1.00 1.00 H new ATOM 0 HB1 ALA A 82 85.062 -5.997 -1.390 1.00 1.00 H new ATOM 0 HB2 ALA A 82 84.845 -4.849 -2.732 1.00 1.00 H new ATOM 0 HB3 ALA A 82 85.251 -6.548 -3.071 1.00 1.00 H new ATOM 1216 N GLN A 83 88.966 -6.622 -2.100 1.00 1.00 N ATOM 1217 CA GLN A 83 89.780 -7.775 -1.626 1.00 1.00 C ATOM 1218 C GLN A 83 89.819 -7.734 -0.099 1.00 1.00 C ATOM 1219 O GLN A 83 90.862 -7.584 0.505 1.00 1.00 O ATOM 1220 CB GLN A 83 91.204 -7.656 -2.175 1.00 1.00 C ATOM 1221 CG GLN A 83 91.709 -6.225 -1.980 1.00 1.00 C ATOM 1222 CD GLN A 83 93.237 -6.208 -2.053 1.00 1.00 C ATOM 1223 OE1 GLN A 83 93.865 -7.246 -2.119 1.00 1.00 O ATOM 1224 NE2 GLN A 83 93.866 -5.065 -2.046 1.00 1.00 N ATOM 0 H GLN A 83 89.480 -5.908 -2.616 1.00 1.00 H new ATOM 0 HA GLN A 83 89.344 -8.713 -1.970 1.00 1.00 H new ATOM 0 HB2 GLN A 83 91.862 -8.358 -1.663 1.00 1.00 H new ATOM 0 HB3 GLN A 83 91.220 -7.918 -3.233 1.00 1.00 H new ATOM 0 HG2 GLN A 83 91.291 -5.573 -2.747 1.00 1.00 H new ATOM 0 HG3 GLN A 83 91.376 -5.839 -1.017 1.00 1.00 H new ATOM 0 HE21 GLN A 83 93.339 -4.193 -1.991 1.00 1.00 H new ATOM 0 HE22 GLN A 83 94.885 -5.043 -2.096 1.00 1.00 H new ATOM 1233 N TYR A 84 88.682 -7.845 0.528 1.00 1.00 N ATOM 1234 CA TYR A 84 88.637 -7.790 2.013 1.00 1.00 C ATOM 1235 C TYR A 84 88.905 -6.353 2.466 1.00 1.00 C ATOM 1236 O TYR A 84 89.925 -6.055 3.055 1.00 1.00 O ATOM 1237 CB TYR A 84 89.693 -8.734 2.606 1.00 1.00 C ATOM 1238 CG TYR A 84 89.888 -9.915 1.685 1.00 1.00 C ATOM 1239 CD1 TYR A 84 88.785 -10.492 1.045 1.00 1.00 C ATOM 1240 CD2 TYR A 84 91.171 -10.432 1.472 1.00 1.00 C ATOM 1241 CE1 TYR A 84 88.966 -11.587 0.191 1.00 1.00 C ATOM 1242 CE2 TYR A 84 91.352 -11.526 0.618 1.00 1.00 C ATOM 1243 CZ TYR A 84 90.249 -12.104 -0.023 1.00 1.00 C ATOM 1244 OH TYR A 84 90.427 -13.183 -0.864 1.00 1.00 O ATOM 0 H TYR A 84 87.778 -7.972 0.073 1.00 1.00 H new ATOM 0 HA TYR A 84 87.654 -8.106 2.362 1.00 1.00 H new ATOM 0 HB2 TYR A 84 90.636 -8.204 2.739 1.00 1.00 H new ATOM 0 HB3 TYR A 84 89.378 -9.076 3.592 1.00 1.00 H new ATOM 0 HD1 TYR A 84 87.795 -10.093 1.210 1.00 1.00 H new ATOM 0 HD2 TYR A 84 92.022 -9.987 1.967 1.00 1.00 H new ATOM 0 HE1 TYR A 84 88.115 -12.033 -0.303 1.00 1.00 H new ATOM 0 HE2 TYR A 84 92.342 -11.924 0.453 1.00 1.00 H new ATOM 0 HH TYR A 84 91.378 -13.415 -0.902 1.00 1.00 H new ATOM 1254 N GLY A 85 87.992 -5.457 2.203 1.00 1.00 N ATOM 1255 CA GLY A 85 88.194 -4.045 2.636 1.00 1.00 C ATOM 1256 C GLY A 85 88.149 -4.012 4.161 1.00 1.00 C ATOM 1257 O GLY A 85 88.580 -3.072 4.796 1.00 1.00 O ATOM 0 H GLY A 85 87.119 -5.641 1.709 1.00 1.00 H new ATOM 0 HA2 GLY A 85 89.151 -3.668 2.274 1.00 1.00 H new ATOM 0 HA3 GLY A 85 87.419 -3.403 2.217 1.00 1.00 H new ATOM 1261 N ILE A 86 87.630 -5.056 4.741 1.00 1.00 N ATOM 1262 CA ILE A 86 87.542 -5.144 6.230 1.00 1.00 C ATOM 1263 C ILE A 86 86.621 -4.042 6.763 1.00 1.00 C ATOM 1264 O ILE A 86 86.402 -3.032 6.125 1.00 1.00 O ATOM 1265 CB ILE A 86 88.941 -4.993 6.853 1.00 1.00 C ATOM 1266 CG1 ILE A 86 89.948 -5.818 6.048 1.00 1.00 C ATOM 1267 CG2 ILE A 86 88.914 -5.494 8.298 1.00 1.00 C ATOM 1268 CD1 ILE A 86 91.015 -4.891 5.462 1.00 1.00 C ATOM 0 H ILE A 86 87.257 -5.864 4.243 1.00 1.00 H new ATOM 0 HA ILE A 86 87.134 -6.118 6.501 1.00 1.00 H new ATOM 0 HB ILE A 86 89.234 -3.943 6.838 1.00 1.00 H new ATOM 0 HG12 ILE A 86 90.414 -6.568 6.688 1.00 1.00 H new ATOM 0 HG13 ILE A 86 89.438 -6.354 5.248 1.00 1.00 H new ATOM 0 HG21 ILE A 86 89.905 -5.387 8.739 1.00 1.00 H new ATOM 0 HG22 ILE A 86 88.196 -4.909 8.873 1.00 1.00 H new ATOM 0 HG23 ILE A 86 88.622 -6.544 8.314 1.00 1.00 H new ATOM 0 HD11 ILE A 86 91.732 -5.478 4.889 1.00 1.00 H new ATOM 0 HD12 ILE A 86 90.541 -4.158 4.809 1.00 1.00 H new ATOM 0 HD13 ILE A 86 91.533 -4.375 6.271 1.00 1.00 H new ATOM 1280 N CYS A 87 86.081 -4.240 7.935 1.00 1.00 N ATOM 1281 CA CYS A 87 85.172 -3.221 8.533 1.00 1.00 C ATOM 1282 C CYS A 87 86.008 -2.103 9.160 1.00 1.00 C ATOM 1283 CB CYS A 87 84.307 -3.888 9.610 1.00 1.00 C ATOM 1284 SG CYS A 87 82.559 -3.716 9.174 1.00 1.00 S ATOM 0 H CYS A 87 86.232 -5.070 8.508 1.00 1.00 H new ATOM 0 HA CYS A 87 84.529 -2.800 7.761 1.00 1.00 H new ATOM 0 HB2 CYS A 87 84.568 -4.942 9.700 1.00 1.00 H new ATOM 0 HB3 CYS A 87 84.497 -3.429 10.580 1.00 1.00 H new TER 1289 CYS A 87 HETATM 1290 C1C RCY A 110 59.402 1.658 4.802 1.00 1.00 C HETATM 1291 O1G RCY A 110 59.379 1.612 8.305 1.00 1.00 O HETATM 1292 O1H RCY A 110 62.961 -0.774 6.362 1.00 1.00 O HETATM 1293 O1J RCY A 110 58.260 3.551 6.847 1.00 1.00 O HETATM 1294 C1L RCY A 110 60.275 -0.639 8.649 1.00 1.00 C HETATM 1295 C1M RCY A 110 62.079 3.199 6.840 1.00 1.00 C HETATM 1296 C1P RCY A 110 60.188 0.742 7.987 1.00 1.00 C HETATM 1297 C1Q RCY A 110 61.866 -0.483 6.840 1.00 1.00 C HETATM 1298 N1R RCY A 110 61.232 0.902 6.883 1.00 1.00 N HETATM 1299 C1S RCY A 110 60.893 -1.443 7.500 1.00 1.00 C HETATM 1300 C1U RCY A 110 61.564 2.131 6.033 1.00 1.00 C HETATM 1301 C1V RCY A 110 60.715 3.767 4.297 1.00 1.00 C HETATM 1302 N1V RCY A 110 59.685 3.425 6.554 1.00 1.00 N HETATM 1303 C1W RCY A 110 60.858 3.957 7.376 1.00 1.00 C HETATM 1304 C1X RCY A 110 60.333 2.736 5.361 1.00 1.00 C HETATM 1305 C1Y RCY A 110 61.022 5.464 7.162 1.00 1.00 C HETATM 1306 C1Z RCY A 110 60.615 3.645 8.853 1.00 1.00 C HETATM 0 H1ZB RCY A 110 60.440 2.576 8.975 1.00 1.00 H new HETATM 0 H1ZA RCY A 110 61.488 3.939 9.435 1.00 1.00 H new HETATM 0 H1YB RCY A 110 61.911 5.811 7.688 1.00 1.00 H new HETATM 0 H1YA RCY A 110 61.126 5.671 6.097 1.00 1.00 H new HETATM 0 H1VB RCY A 110 61.226 3.268 3.474 1.00 1.00 H new HETATM 0 H1VA RCY A 110 59.815 4.254 3.923 1.00 1.00 H new HETATM 0 H1MA RCY A 110 62.686 2.811 7.658 1.00 1.00 H new HETATM 0 H1LA RCY A 110 60.902 -0.636 9.540 1.00 1.00 H new HETATM 0 H1CB RCY A 110 59.937 1.063 4.062 1.00 1.00 H new HETATM 0 H1CA RCY A 110 59.066 1.012 5.613 1.00 1.00 H new HETATM 0 H1Z RCY A 110 59.743 4.197 9.203 1.00 1.00 H new HETATM 0 H1Y RCY A 110 60.146 5.984 7.549 1.00 1.00 H new HETATM 0 H1V RCY A 110 61.376 4.514 4.735 1.00 1.00 H new HETATM 0 H1U RCY A 110 62.282 1.765 5.299 1.00 1.00 H new HETATM 0 H1S RCY A 110 60.131 -1.780 6.797 1.00 1.00 H new HETATM 0 H1M RCY A 110 62.719 3.857 6.252 1.00 1.00 H new HETATM 0 H1L RCY A 110 59.299 -1.021 8.948 1.00 1.00 H new HETATM 0 H1C RCY A 110 58.539 2.130 4.333 1.00 1.00 H new HETATM 1309 C1C RCY A 121 67.254 -3.187 -8.808 1.00 1.00 C HETATM 1310 O1G RCY A 121 64.971 -4.091 -6.760 1.00 1.00 O HETATM 1311 O1H RCY A 121 68.894 -6.540 -5.803 1.00 1.00 O HETATM 1312 O1J RCY A 121 65.041 -1.656 -7.456 1.00 1.00 O HETATM 1313 C1L RCY A 121 65.407 -6.464 -6.355 1.00 1.00 C HETATM 1314 C1M RCY A 121 67.943 -2.749 -5.199 1.00 1.00 C HETATM 1315 C1P RCY A 121 65.783 -4.989 -6.539 1.00 1.00 C HETATM 1316 C1Q RCY A 121 67.805 -6.198 -6.261 1.00 1.00 C HETATM 1317 N1R RCY A 121 67.290 -4.772 -6.413 1.00 1.00 N HETATM 1318 C1S RCY A 121 66.722 -7.125 -6.783 1.00 1.00 C HETATM 1319 C1U RCY A 121 68.086 -3.466 -6.434 1.00 1.00 C HETATM 1320 C1V RCY A 121 68.564 -1.324 -7.696 1.00 1.00 C HETATM 1321 N1V RCY A 121 66.313 -1.988 -6.821 1.00 1.00 N HETATM 1322 C1W RCY A 121 66.663 -1.916 -5.335 1.00 1.00 C HETATM 1323 C1X RCY A 121 67.587 -2.483 -7.491 1.00 1.00 C HETATM 1324 C1Y RCY A 121 66.917 -0.465 -4.915 1.00 1.00 C HETATM 1325 C1Z RCY A 121 65.518 -2.520 -4.522 1.00 1.00 C HETATM 0 H1ZB RCY A 121 65.313 -3.530 -4.877 1.00 1.00 H new HETATM 0 H1ZA RCY A 121 65.798 -2.555 -3.469 1.00 1.00 H new HETATM 0 H1YB RCY A 121 67.246 -0.439 -3.876 1.00 1.00 H new HETATM 0 H1YA RCY A 121 67.689 -0.032 -5.551 1.00 1.00 H new HETATM 0 H1VB RCY A 121 69.492 -1.702 -8.125 1.00 1.00 H new HETATM 0 H1VA RCY A 121 68.123 -0.592 -8.372 1.00 1.00 H new HETATM 0 H1MA RCY A 121 67.873 -3.436 -4.356 1.00 1.00 H new HETATM 0 H1LA RCY A 121 65.137 -6.701 -5.326 1.00 1.00 H new HETATM 0 H1CB RCY A 121 68.147 -3.680 -9.193 1.00 1.00 H new HETATM 0 H1CA RCY A 121 66.475 -3.930 -8.637 1.00 1.00 H new HETATM 0 H1Z RCY A 121 64.625 -1.906 -4.640 1.00 1.00 H new HETATM 0 H1Y RCY A 121 65.997 0.110 -5.019 1.00 1.00 H new HETATM 0 H1V RCY A 121 68.774 -0.851 -6.737 1.00 1.00 H new HETATM 0 H1S RCY A 121 66.779 -7.230 -7.866 1.00 1.00 H new HETATM 0 H1M RCY A 121 68.807 -2.109 -5.018 1.00 1.00 H new HETATM 0 H1L RCY A 121 64.567 -6.762 -6.982 1.00 1.00 H new HETATM 0 H1C RCY A 121 66.903 -2.454 -9.534 1.00 1.00 H new HETATM 1328 C1C RCY A 130 79.115 8.438 -7.317 1.00 1.00 C HETATM 1329 O1G RCY A 130 76.196 7.876 -8.866 1.00 1.00 O HETATM 1330 O1H RCY A 130 79.150 4.229 -9.388 1.00 1.00 O HETATM 1331 O1J RCY A 130 76.303 9.344 -6.736 1.00 1.00 O HETATM 1332 C1L RCY A 130 76.915 6.567 -10.804 1.00 1.00 C HETATM 1333 C1M RCY A 130 76.982 5.598 -6.280 1.00 1.00 C HETATM 1334 C1P RCY A 130 76.900 6.979 -9.326 1.00 1.00 C HETATM 1335 C1Q RCY A 130 78.543 5.284 -9.566 1.00 1.00 C HETATM 1336 N1R RCY A 130 77.868 6.136 -8.498 1.00 1.00 N HETATM 1337 C1S RCY A 130 78.327 5.978 -10.898 1.00 1.00 C HETATM 1338 C1U RCY A 130 78.107 6.139 -6.987 1.00 1.00 C HETATM 1339 C1V RCY A 130 78.785 7.521 -4.977 1.00 1.00 C HETATM 1340 N1V RCY A 130 76.810 8.008 -6.438 1.00 1.00 N HETATM 1341 C1W RCY A 130 76.003 6.761 -6.080 1.00 1.00 C HETATM 1342 C1X RCY A 130 78.260 7.547 -6.414 1.00 1.00 C HETATM 1343 C1Y RCY A 130 75.533 6.826 -4.625 1.00 1.00 C HETATM 1344 C1Z RCY A 130 74.808 6.650 -7.028 1.00 1.00 C HETATM 0 H1ZB RCY A 130 75.159 6.666 -8.060 1.00 1.00 H new HETATM 0 H1ZA RCY A 130 74.279 5.716 -6.839 1.00 1.00 H new HETATM 0 H1YB RCY A 130 75.032 5.894 -4.362 1.00 1.00 H new HETATM 0 H1YA RCY A 130 76.393 6.972 -3.971 1.00 1.00 H new HETATM 0 H1VB RCY A 130 79.805 7.136 -4.969 1.00 1.00 H new HETATM 0 H1VA RCY A 130 78.775 8.531 -4.568 1.00 1.00 H new HETATM 0 H1MA RCY A 130 76.517 4.791 -6.847 1.00 1.00 H new HETATM 0 H1LA RCY A 130 76.142 5.837 -11.042 1.00 1.00 H new HETATM 0 H1CB RCY A 130 80.108 8.002 -7.423 1.00 1.00 H new HETATM 0 H1CA RCY A 130 78.647 8.517 -8.298 1.00 1.00 H new HETATM 0 H1Z RCY A 130 74.132 7.489 -6.862 1.00 1.00 H new HETATM 0 H1Y RCY A 130 74.839 7.658 -4.504 1.00 1.00 H new HETATM 0 H1V RCY A 130 78.150 6.877 -4.369 1.00 1.00 H new HETATM 0 H1U RCY A 130 79.016 5.552 -6.857 1.00 1.00 H new HETATM 0 H1S RCY A 130 79.071 6.757 -11.064 1.00 1.00 H new HETATM 0 H1M RCY A 130 77.289 5.179 -5.322 1.00 1.00 H new HETATM 0 H1L RCY A 130 76.771 7.414 -11.475 1.00 1.00 H new HETATM 0 H1C RCY A 130 79.199 9.430 -6.874 1.00 1.00 H new HETATM 1347 C1C RCY A 138 84.665 6.765 -2.195 1.00 1.00 C HETATM 1348 O1G RCY A 138 84.998 7.981 0.145 1.00 1.00 O HETATM 1349 O1H RCY A 138 81.096 10.255 -1.234 1.00 1.00 O HETATM 1350 O1J RCY A 138 84.879 5.430 0.496 1.00 1.00 O HETATM 1351 C1L RCY A 138 84.264 10.308 0.326 1.00 1.00 C HETATM 1352 C1M RCY A 138 81.384 6.667 -0.487 1.00 1.00 C HETATM 1353 C1P RCY A 138 84.154 8.840 -0.105 1.00 1.00 C HETATM 1354 C1Q RCY A 138 82.270 9.974 -0.994 1.00 1.00 C HETATM 1355 N1R RCY A 138 82.865 8.576 -0.882 1.00 1.00 N HETATM 1356 C1S RCY A 138 83.396 10.963 -0.754 1.00 1.00 C HETATM 1357 C1U RCY A 138 82.307 7.255 -1.415 1.00 1.00 C HETATM 1358 C1V RCY A 138 82.868 4.987 -2.392 1.00 1.00 C HETATM 1359 N1V RCY A 138 83.615 5.791 -0.140 1.00 1.00 N HETATM 1360 C1W RCY A 138 82.231 5.857 0.502 1.00 1.00 C HETATM 1361 C1X RCY A 138 83.384 6.186 -1.592 1.00 1.00 C HETATM 1362 C1Y RCY A 138 81.655 4.449 0.677 1.00 1.00 C HETATM 1363 C1Z RCY A 138 82.339 6.566 1.852 1.00 1.00 C HETATM 0 H1ZB RCY A 138 82.806 7.541 1.714 1.00 1.00 H new HETATM 0 H1ZA RCY A 138 81.343 6.697 2.275 1.00 1.00 H new HETATM 0 H1YA RCY A 138 81.649 3.936 -0.285 1.00 1.00 H new HETATM 0 H1VB RCY A 138 82.654 5.297 -3.415 1.00 1.00 H new HETATM 0 H1MA RCY A 138 80.809 7.435 0.030 1.00 1.00 H new HETATM 0 H1CB RCY A 138 84.445 7.194 -3.173 1.00 1.00 H new HETATM 0 H1CA RCY A 138 85.058 7.541 -1.538 1.00 1.00 H new HETATM 0 H1Z RCY A 138 82.946 5.966 2.531 1.00 1.00 H new HETATM 0 H1U RCY A 138 81.846 7.521 -2.366 1.00 1.00 H new HETATM 0 H1S RCY A 138 83.966 11.143 -1.665 1.00 1.00 H new HETATM 0 H1M RCY A 138 80.668 6.027 -1.002 1.00 1.00 H new HETATM 1366 C1C RCY A 150 81.315 -2.347 9.280 1.00 1.00 C HETATM 1367 O1G RCY A 150 79.980 -0.514 9.694 1.00 1.00 O HETATM 1368 O1H RCY A 150 83.803 2.247 9.450 1.00 1.00 O HETATM 1369 O1J RCY A 150 79.448 -1.500 7.075 1.00 1.00 O HETATM 1370 C1L RCY A 150 80.574 1.619 10.735 1.00 1.00 C HETATM 1371 C1M RCY A 150 82.975 0.000 6.950 1.00 1.00 C HETATM 1372 C1P RCY A 150 80.810 0.377 9.867 1.00 1.00 C HETATM 1373 C1Q RCY A 150 82.828 1.624 9.869 1.00 1.00 C HETATM 1374 N1R RCY A 150 82.205 0.383 9.243 1.00 1.00 N HETATM 1375 C1S RCY A 150 82.022 1.954 11.112 1.00 1.00 C HETATM 1376 C1U RCY A 150 82.825 -0.598 8.246 1.00 1.00 C HETATM 1377 C1V RCY A 150 82.696 -2.914 7.232 1.00 1.00 C HETATM 1378 N1V RCY A 150 80.876 -1.199 7.098 1.00 1.00 N HETATM 1379 C1W RCY A 150 81.633 -0.192 6.234 1.00 1.00 C HETATM 1380 C1X RCY A 150 81.943 -1.819 7.989 1.00 1.00 C HETATM 1381 C1Y RCY A 150 81.850 -0.753 4.825 1.00 1.00 C HETATM 1382 C1Z RCY A 150 80.841 1.114 6.178 1.00 1.00 C HETATM 0 H1ZB RCY A 150 80.646 1.465 7.191 1.00 1.00 H new HETATM 0 H1ZA RCY A 150 81.417 1.866 5.638 1.00 1.00 H new HETATM 0 H1YB RCY A 150 82.462 -0.060 4.248 1.00 1.00 H new HETATM 0 H1YA RCY A 150 82.356 -1.716 4.891 1.00 1.00 H new HETATM 0 H1VB RCY A 150 83.493 -3.310 7.862 1.00 1.00 H new HETATM 0 H1MA RCY A 150 83.223 1.058 7.036 1.00 1.00 H new HETATM 0 H1LA RCY A 150 80.088 2.426 10.186 1.00 1.00 H new HETATM 0 H1CA RCY A 150 80.699 -1.568 9.730 1.00 1.00 H new HETATM 0 H1Z RCY A 150 79.895 0.944 5.664 1.00 1.00 H new HETATM 0 H1Y RCY A 150 80.886 -0.882 4.333 1.00 1.00 H new HETATM 0 H1V RCY A 150 83.127 -2.497 6.322 1.00 1.00 H new HETATM 0 H1U RCY A 150 83.775 -0.878 8.700 1.00 1.00 H new HETATM 0 H1S RCY A 150 82.355 1.367 11.968 1.00 1.00 H new HETATM 0 H1M RCY A 150 83.784 -0.473 6.394 1.00 1.00 H new HETATM 0 H1L RCY A 150 79.954 1.408 11.606 1.00 1.00 H new HETATM 0 H1C RCY A 150 80.695 -3.215 9.055 1.00 1.00 H new HETATM 1385 C1C RCY A 160 74.793 5.352 7.267 1.00 1.00 C HETATM 1386 O1G RCY A 160 76.092 7.657 6.172 1.00 1.00 O HETATM 1387 O1H RCY A 160 71.850 9.046 4.630 1.00 1.00 O HETATM 1388 O1J RCY A 160 73.871 2.701 6.176 1.00 1.00 O HETATM 1389 C1L RCY A 160 75.163 9.837 5.561 1.00 1.00 C HETATM 1390 C1M RCY A 160 72.828 5.793 4.162 1.00 1.00 C HETATM 1391 C1P RCY A 160 75.145 8.314 5.744 1.00 1.00 C HETATM 1392 C1Q RCY A 160 73.066 8.931 4.781 1.00 1.00 C HETATM 1393 N1R RCY A 160 73.803 7.714 5.326 1.00 1.00 N HETATM 1394 C1S RCY A 160 74.112 9.982 4.456 1.00 1.00 C HETATM 1395 C1U RCY A 160 73.315 6.267 5.425 1.00 1.00 C HETATM 1396 C1V RCY A 160 75.661 5.478 4.888 1.00 1.00 C HETATM 1397 N1V RCY A 160 73.748 3.967 5.460 1.00 1.00 N HETATM 1398 C1W RCY A 160 72.901 4.262 4.223 1.00 1.00 C HETATM 1399 C1X RCY A 160 74.433 5.288 5.781 1.00 1.00 C HETATM 1400 C1Y RCY A 160 73.576 3.704 2.967 1.00 1.00 C HETATM 1401 C1Z RCY A 160 71.514 3.647 4.408 1.00 1.00 C HETATM 0 H1ZB RCY A 160 71.076 4.010 5.338 1.00 1.00 H new HETATM 0 H1ZA RCY A 160 70.876 3.930 3.571 1.00 1.00 H new HETATM 0 H1MA RCY A 160 71.805 6.127 3.989 1.00 1.00 H new HETATM 0 H1LA RCY A 160 74.888 10.370 6.471 1.00 1.00 H new HETATM 0 H1CB RCY A 160 75.128 6.359 7.517 1.00 1.00 H new HETATM 0 H1CA RCY A 160 73.917 5.102 7.865 1.00 1.00 H new HETATM 0 H1Z RCY A 160 71.600 2.561 4.447 1.00 1.00 H new HETATM 0 H1U RCY A 160 72.545 6.295 6.196 1.00 1.00 H new HETATM 0 H1S RCY A 160 74.548 9.816 3.471 1.00 1.00 H new HETATM 0 H1M RCY A 160 73.433 6.179 3.342 1.00 1.00 H new HETATM 0 H1L RCY A 160 76.142 10.209 5.257 1.00 1.00 H new HETATM 0 H1C RCY A 160 75.592 4.641 7.479 1.00 1.00 H new HETATM 1404 C1C RCY A 168 75.539 0.181 4.089 1.00 1.00 C HETATM 1405 O1G RCY A 168 74.740 -2.510 2.898 1.00 1.00 O HETATM 1406 O1H RCY A 168 71.025 0.405 2.953 1.00 1.00 O HETATM 1407 O1J RCY A 168 74.106 2.820 3.870 1.00 1.00 O HETATM 1408 C1L RCY A 168 73.057 -1.910 1.226 1.00 1.00 C HETATM 1409 C1M RCY A 168 72.201 0.026 5.678 1.00 1.00 C HETATM 1410 C1P RCY A 168 73.722 -1.883 2.608 1.00 1.00 C HETATM 1411 C1Q RCY A 168 71.755 -0.565 2.751 1.00 1.00 C HETATM 1412 N1R RCY A 168 72.963 -0.982 3.581 1.00 1.00 N HETATM 1413 C1S RCY A 168 71.616 -1.569 1.622 1.00 1.00 C HETATM 1414 C1U RCY A 168 73.315 -0.593 5.018 1.00 1.00 C HETATM 1415 C1V RCY A 168 74.957 0.619 6.517 1.00 1.00 C HETATM 1416 N1V RCY A 168 73.639 1.701 4.683 1.00 1.00 N HETATM 1417 C1W RCY A 168 72.259 1.514 5.310 1.00 1.00 C HETATM 1418 C1X RCY A 168 74.420 0.460 5.093 1.00 1.00 C HETATM 1419 C1Y RCY A 168 72.118 2.384 6.562 1.00 1.00 C HETATM 1420 C1Z RCY A 168 71.188 1.873 4.280 1.00 1.00 C HETATM 0 H1ZB RCY A 168 71.342 1.286 3.375 1.00 1.00 H new HETATM 0 H1ZA RCY A 168 70.202 1.655 4.690 1.00 1.00 H new HETATM 0 H1YB RCY A 168 71.162 2.176 7.044 1.00 1.00 H new HETATM 0 H1YA RCY A 168 72.930 2.160 7.254 1.00 1.00 H new HETATM 0 H1VB RCY A 168 75.465 -0.297 6.819 1.00 1.00 H new HETATM 0 H1VA RCY A 168 75.660 1.451 6.550 1.00 1.00 H new HETATM 0 H1MA RCY A 168 71.260 -0.419 5.354 1.00 1.00 H new HETATM 0 H1LA RCY A 168 73.486 -1.178 0.542 1.00 1.00 H new HETATM 0 H1CB RCY A 168 75.980 -0.793 4.298 1.00 1.00 H new HETATM 0 H1CA RCY A 168 75.131 0.185 3.078 1.00 1.00 H new HETATM 0 H1Z RCY A 168 71.255 2.934 4.040 1.00 1.00 H new HETATM 0 H1Y RCY A 168 72.162 3.436 6.281 1.00 1.00 H new HETATM 0 H1V RCY A 168 74.129 0.816 7.198 1.00 1.00 H new HETATM 0 H1U RCY A 168 73.621 -1.530 5.484 1.00 1.00 H new HETATM 0 H1S RCY A 168 71.074 -2.457 1.946 1.00 1.00 H new HETATM 0 H1M RCY A 168 72.263 -0.111 6.758 1.00 1.00 H new HETATM 0 H1L RCY A 168 73.138 -2.884 0.743 1.00 1.00 H new HETATM 0 H1C RCY A 168 76.305 0.952 4.174 1.00 1.00 H new HETATM 1423 C1C RCY A 173 77.775 -3.981 -2.230 1.00 1.00 C HETATM 1424 O1G RCY A 173 77.501 -1.464 -6.682 1.00 1.00 O HETATM 1425 O1H RCY A 173 80.326 -2.028 -2.940 1.00 1.00 O HETATM 1426 O1J RCY A 173 74.820 -4.059 -1.651 1.00 1.00 O HETATM 1427 C1L RCY A 173 79.932 -1.474 -6.405 1.00 1.00 C HETATM 1428 C1M RCY A 173 75.961 -1.415 -4.184 1.00 1.00 C HETATM 1429 C1P RCY A 173 78.474 -1.539 -5.933 1.00 1.00 C HETATM 1430 C1Q RCY A 173 79.843 -1.625 -3.997 1.00 1.00 C HETATM 1431 N1R RCY A 173 78.381 -1.707 -4.418 1.00 1.00 N HETATM 1432 C1S RCY A 173 80.598 -0.951 -5.128 1.00 1.00 C HETATM 1433 C1U RCY A 173 77.144 -1.908 -3.539 1.00 1.00 C HETATM 1434 C1V RCY A 173 76.827 -4.198 -4.571 1.00 1.00 C HETATM 1435 N1V RCY A 173 75.424 -3.266 -2.718 1.00 1.00 N HETATM 1436 C1W RCY A 173 74.781 -2.138 -3.521 1.00 1.00 C HETATM 1437 C1X RCY A 173 76.835 -3.381 -3.278 1.00 1.00 C HETATM 1438 C1Y RCY A 173 73.834 -2.707 -4.582 1.00 1.00 C HETATM 1439 C1Z RCY A 173 74.027 -1.211 -2.567 1.00 1.00 C HETATM 0 H1MA RCY A 173 75.873 -0.335 -4.064 1.00 1.00 H new HETATM 0 H1CB RCY A 173 78.805 -3.904 -2.578 1.00 1.00 H new HETATM 0 H1CA RCY A 173 77.668 -3.437 -1.291 1.00 1.00 H new HETATM 0 H1V RCY A 173 76.147 -3.738 -5.288 1.00 1.00 H new HETATM 0 H1S RCY A 173 80.527 0.135 -5.060 1.00 1.00 H new HETATM 0 H1M RCY A 173 75.989 -1.616 -5.255 1.00 1.00 H new HETATM 0 H1C RCY A 173 77.523 -5.030 -2.073 1.00 1.00 H new HETATM 1442 C1C RCY A 176 73.575 -6.462 -1.539 1.00 1.00 C HETATM 1443 O1G RCY A 176 77.259 -5.601 -4.775 1.00 1.00 O HETATM 1444 O1H RCY A 176 76.577 -8.088 -0.818 1.00 1.00 O HETATM 1445 O1J RCY A 176 72.388 -3.695 -1.514 1.00 1.00 O HETATM 1446 C1L RCY A 176 78.045 -7.791 -4.016 1.00 1.00 C HETATM 1447 C1M RCY A 176 76.064 -3.930 -2.582 1.00 1.00 C HETATM 1448 C1P RCY A 176 77.304 -6.454 -3.889 1.00 1.00 C HETATM 1449 C1Q RCY A 176 77.097 -7.571 -1.806 1.00 1.00 C HETATM 1450 N1R RCY A 176 76.630 -6.312 -2.525 1.00 1.00 N HETATM 1451 C1S RCY A 176 78.328 -8.075 -2.537 1.00 1.00 C HETATM 1452 C1U RCY A 176 75.719 -5.198 -2.006 1.00 1.00 C HETATM 1453 C1V RCY A 176 74.104 -5.687 -3.894 1.00 1.00 C HETATM 1454 N1V RCY A 176 73.698 -4.018 -2.072 1.00 1.00 N HETATM 1455 C1W RCY A 176 74.815 -3.049 -2.455 1.00 1.00 C HETATM 1456 C1X RCY A 176 74.256 -5.396 -2.400 1.00 1.00 C HETATM 1457 C1Y RCY A 176 74.498 -2.368 -3.790 1.00 1.00 C HETATM 1458 C1Z RCY A 176 74.979 -2.010 -1.346 1.00 1.00 C HETATM 0 H1ZB RCY A 176 75.144 -2.516 -0.395 1.00 1.00 H new HETATM 0 H1CB RCY A 176 74.093 -7.413 -1.660 1.00 1.00 H new HETATM 0 H1CA RCY A 176 73.609 -6.161 -0.492 1.00 1.00 H new HETATM 0 H1U RCY A 176 75.851 -5.226 -0.924 1.00 1.00 H new HETATM 0 H1S RCY A 176 79.227 -7.560 -2.200 1.00 1.00 H new HETATM 0 H1C RCY A 176 72.536 -6.573 -1.851 1.00 1.00 H new HETATM 1461 C1C RCY A 187 82.672 -2.103 3.072 1.00 1.00 C HETATM 1462 O1G RCY A 187 82.826 -4.926 4.187 1.00 1.00 O HETATM 1463 O1H RCY A 187 80.487 -2.417 7.433 1.00 1.00 O HETATM 1464 O1J RCY A 187 82.321 -4.779 1.737 1.00 1.00 O HETATM 1465 C1L RCY A 187 82.991 -4.772 6.623 1.00 1.00 C HETATM 1466 C1M RCY A 187 79.389 -3.592 3.905 1.00 1.00 C HETATM 1467 C1P RCY A 187 82.445 -4.409 5.236 1.00 1.00 C HETATM 1468 C1Q RCY A 187 81.381 -2.981 6.804 1.00 1.00 C HETATM 1469 N1R RCY A 187 81.370 -3.327 5.320 1.00 1.00 N HETATM 1470 C1S RCY A 187 82.706 -3.462 7.367 1.00 1.00 C HETATM 1471 C1U RCY A 187 80.500 -2.737 4.208 1.00 1.00 C HETATM 1472 C1V RCY A 187 80.465 -1.760 1.872 1.00 1.00 C HETATM 1473 N1V RCY A 187 81.255 -4.068 2.438 1.00 1.00 N HETATM 1474 C1W RCY A 187 79.905 -4.621 2.891 1.00 1.00 C HETATM 1475 C1X RCY A 187 81.242 -2.611 2.879 1.00 1.00 C HETATM 1476 C1Y RCY A 187 78.946 -4.734 1.703 1.00 1.00 C HETATM 1477 C1Z RCY A 187 80.118 -5.987 3.545 1.00 1.00 C HETATM 0 H1ZB RCY A 187 80.849 -5.896 4.348 1.00 1.00 H new HETATM 0 H1ZA RCY A 187 79.173 -6.346 3.953 1.00 1.00 H new HETATM 0 H1YB RCY A 187 77.964 -5.049 2.057 1.00 1.00 H new HETATM 0 H1YA RCY A 187 78.861 -3.765 1.211 1.00 1.00 H new HETATM 0 H1VB RCY A 187 80.416 -0.730 2.227 1.00 1.00 H new HETATM 0 H1VA RCY A 187 80.970 -1.787 0.906 1.00 1.00 H new HETATM 0 H1MA RCY A 187 79.019 -4.084 4.805 1.00 1.00 H new HETATM 0 H1LA RCY A 187 82.475 -5.624 7.065 1.00 1.00 H new HETATM 0 H1CB RCY A 187 82.649 -1.121 3.545 1.00 1.00 H new HETATM 0 H1CA RCY A 187 83.223 -2.798 3.706 1.00 1.00 H new HETATM 0 H1Z RCY A 187 80.484 -6.694 2.800 1.00 1.00 H new HETATM 0 H1Y RCY A 187 79.329 -5.469 0.995 1.00 1.00 H new HETATM 0 H1V RCY A 187 79.455 -2.155 1.765 1.00 1.00 H new HETATM 0 H1U RCY A 187 80.197 -1.763 4.592 1.00 1.00 H new HETATM 0 H1S RCY A 187 83.497 -2.731 7.199 1.00 1.00 H new HETATM 0 H1M RCY A 187 78.559 -3.020 3.491 1.00 1.00 H new HETATM 0 H1L RCY A 187 84.053 -5.018 6.603 1.00 1.00 H new HETATM 0 H1C RCY A 187 83.165 -2.028 2.103 1.00 1.00 H new