USER MOD reduce.3.24.130724 H: found=0, std=0, add=709, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 709 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 25 SER OG : rot -140:sc= 0.035 USER MOD Set 1.2: A 66 THR OG1 : rot -170:sc= -0.352 USER MOD Set 2.1: A 27 THR OG1 : rot 128:sc= 1.43 USER MOD Set 2.2: A 29 THR OG1 : rot 180:sc= 1.07 USER MOD Single : A 1 MET CE :methyl -171:sc= 0 (180deg=-0.122) USER MOD Single : A 1 MET N :NH3+ -123:sc= 0 (180deg=-0.0282) USER MOD Single : A 4 ASN : amide:sc= -0.0998 K(o=-0.1,f=-1.9) USER MOD Single : A 5 LYS NZ :NH3+ -166:sc= -0.0154 (180deg=-0.232) USER MOD Single : A 6 ASN : amide:sc=-0.00781 K(o=-0.0078,f=-1.4) USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 MET CE :methyl -150:sc= 0 (180deg=-0.0166) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 ASN : amide:sc= 1.04 K(o=1,f=0) USER MOD Single : A 18 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 19 CYS SG : rot 44:sc= 0.338 USER MOD Single : A 20 THR OG1 : rot 180:sc=-0.00608 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 118:sc= 1.73 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 CYS SG : rot 35:sc= 0.474 USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 SER OG : rot 96:sc= 1.26 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0.0752 USER MOD Single : A 39 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot -50:sc= 1.26 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 GLN : amide:sc= -1.51! K(o=-1.5!,f=-0.014) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ -124:sc= 0.911 (180deg=-0.344) USER MOD Single : A 59 CYS SG : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot -141:sc= 1.24 USER MOD Single : A 72 ASN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 14.653 29.879 32.249 1.00 0.00 N1+ ATOM 2 CA MET A 1 15.900 30.520 31.777 1.00 0.00 C ATOM 3 C MET A 1 17.107 29.692 32.226 1.00 0.00 C ATOM 4 O MET A 1 18.011 30.197 32.882 1.00 0.00 O ATOM 5 CB MET A 1 16.003 31.996 32.211 1.00 0.00 C ATOM 6 CG MET A 1 14.941 32.892 31.562 1.00 0.00 C ATOM 7 SD MET A 1 14.972 32.962 29.746 1.00 0.00 S ATOM 8 CE MET A 1 16.557 33.811 29.504 1.00 0.00 C ATOM 0 H1 MET A 1 14.035 29.682 31.436 1.00 0.00 H new ATOM 0 H2 MET A 1 14.883 28.988 32.733 1.00 0.00 H new ATOM 0 H3 MET A 1 14.164 30.516 32.910 1.00 0.00 H new ATOM 0 HA MET A 1 15.885 30.541 30.687 1.00 0.00 H new ATOM 0 HB2 MET A 1 15.907 32.057 33.295 1.00 0.00 H new ATOM 0 HB3 MET A 1 16.993 32.375 31.957 1.00 0.00 H new ATOM 0 HG2 MET A 1 13.957 32.545 31.877 1.00 0.00 H new ATOM 0 HG3 MET A 1 15.061 33.904 31.948 1.00 0.00 H new ATOM 0 HE1 MET A 1 16.668 34.083 28.454 1.00 0.00 H new ATOM 0 HE2 MET A 1 16.585 34.712 30.117 1.00 0.00 H new ATOM 0 HE3 MET A 1 17.373 33.149 29.795 1.00 0.00 H new ATOM 20 N ALA A 2 17.143 28.419 31.838 1.00 0.00 N ATOM 21 CA ALA A 2 18.259 27.554 32.219 1.00 0.00 C ATOM 22 C ALA A 2 19.059 27.052 30.997 1.00 0.00 C ATOM 23 O ALA A 2 18.476 26.486 30.073 1.00 0.00 O ATOM 24 CB ALA A 2 17.743 26.370 33.022 1.00 0.00 C ATOM 0 H ALA A 2 16.426 27.969 31.270 1.00 0.00 H new ATOM 0 HA ALA A 2 18.939 28.150 32.828 1.00 0.00 H new ATOM 0 HB1 ALA A 2 18.579 25.729 33.303 1.00 0.00 H new ATOM 0 HB2 ALA A 2 17.244 26.730 33.921 1.00 0.00 H new ATOM 0 HB3 ALA A 2 17.036 25.801 32.418 1.00 0.00 H new ATOM 30 N VAL A 3 20.372 27.250 31.034 1.00 0.00 N ATOM 31 CA VAL A 3 21.241 26.883 29.927 1.00 0.00 C ATOM 32 C VAL A 3 21.217 25.381 29.680 1.00 0.00 C ATOM 33 O VAL A 3 21.044 24.595 30.612 1.00 0.00 O ATOM 34 CB VAL A 3 22.695 27.312 30.193 1.00 0.00 C ATOM 35 CG1 VAL A 3 22.789 28.825 30.319 1.00 0.00 C ATOM 36 CG2 VAL A 3 23.229 26.629 31.442 1.00 0.00 C ATOM 0 H VAL A 3 20.859 27.667 31.827 1.00 0.00 H new ATOM 0 HA VAL A 3 20.863 27.403 29.047 1.00 0.00 H new ATOM 0 HB VAL A 3 23.310 27.004 29.347 1.00 0.00 H new ATOM 0 HG11 VAL A 3 23.824 29.111 30.507 1.00 0.00 H new ATOM 0 HG12 VAL A 3 22.447 29.289 29.394 1.00 0.00 H new ATOM 0 HG13 VAL A 3 22.164 29.161 31.146 1.00 0.00 H new ATOM 0 HG21 VAL A 3 24.258 26.943 31.616 1.00 0.00 H new ATOM 0 HG22 VAL A 3 22.615 26.906 32.299 1.00 0.00 H new ATOM 0 HG23 VAL A 3 23.197 25.548 31.307 1.00 0.00 H new ATOM 46 N ASN A 4 21.389 24.982 28.422 1.00 0.00 N ATOM 47 CA ASN A 4 21.367 23.575 28.062 1.00 0.00 C ATOM 48 C ASN A 4 22.516 22.844 28.756 1.00 0.00 C ATOM 49 O ASN A 4 23.614 23.385 28.894 1.00 0.00 O ATOM 50 CB ASN A 4 21.486 23.412 26.546 1.00 0.00 C ATOM 51 CG ASN A 4 20.342 24.068 25.799 1.00 0.00 C ATOM 52 OD1 ASN A 4 19.461 24.681 26.402 1.00 0.00 O ATOM 53 ND2 ASN A 4 20.349 23.941 24.477 1.00 0.00 N ATOM 0 H ASN A 4 21.545 25.616 27.638 1.00 0.00 H new ATOM 0 HA ASN A 4 20.420 23.145 28.387 1.00 0.00 H new ATOM 0 HB2 ASN A 4 22.429 23.843 26.211 1.00 0.00 H new ATOM 0 HB3 ASN A 4 21.515 22.351 26.299 1.00 0.00 H new ATOM 0 HD21 ASN A 4 19.604 24.360 23.920 1.00 0.00 H new ATOM 0 HD22 ASN A 4 21.099 23.424 24.018 1.00 0.00 H new ATOM 60 N LYS A 5 22.272 21.603 29.171 1.00 0.00 N ATOM 61 CA LYS A 5 23.275 20.813 29.873 1.00 0.00 C ATOM 62 C LYS A 5 24.417 20.348 28.962 1.00 0.00 C ATOM 63 O LYS A 5 24.274 20.357 27.732 1.00 0.00 O ATOM 64 CB LYS A 5 22.618 19.600 30.538 1.00 0.00 C ATOM 65 CG LYS A 5 21.825 18.723 29.583 1.00 0.00 C ATOM 66 CD LYS A 5 21.210 17.534 30.304 1.00 0.00 C ATOM 67 CE LYS A 5 20.392 16.671 29.357 1.00 0.00 C ATOM 68 NZ LYS A 5 19.249 17.421 28.768 1.00 0.00 N1+ ATOM 0 H LYS A 5 21.383 21.123 29.031 1.00 0.00 H new ATOM 0 HA LYS A 5 23.714 21.464 30.629 1.00 0.00 H new ATOM 0 HB2 LYS A 5 23.391 18.996 31.012 1.00 0.00 H new ATOM 0 HB3 LYS A 5 21.955 19.948 31.330 1.00 0.00 H new ATOM 0 HG2 LYS A 5 21.038 19.313 29.113 1.00 0.00 H new ATOM 0 HG3 LYS A 5 22.477 18.369 28.785 1.00 0.00 H new ATOM 0 HD2 LYS A 5 21.999 16.933 30.756 1.00 0.00 H new ATOM 0 HD3 LYS A 5 20.575 17.888 31.116 1.00 0.00 H new ATOM 0 HE2 LYS A 5 21.034 16.301 28.557 1.00 0.00 H new ATOM 0 HE3 LYS A 5 20.016 15.800 29.893 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 18.587 16.753 28.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 18.758 17.949 29.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 19.603 18.086 28.051 1.00 0.00 H new ATOM 82 N ASN A 6 25.549 20.019 29.600 1.00 0.00 N ATOM 83 CA ASN A 6 26.788 19.510 28.979 1.00 0.00 C ATOM 84 C ASN A 6 27.641 20.515 28.193 1.00 0.00 C ATOM 85 O ASN A 6 28.851 20.572 28.413 1.00 0.00 O ATOM 86 CB ASN A 6 26.587 18.200 28.184 1.00 0.00 C ATOM 87 CG ASN A 6 26.109 17.056 29.057 1.00 0.00 C ATOM 88 OD1 ASN A 6 25.968 17.203 30.271 1.00 0.00 O ATOM 89 ND2 ASN A 6 25.859 15.906 28.442 1.00 0.00 N ATOM 0 H ASN A 6 25.633 20.103 30.613 1.00 0.00 H new ATOM 0 HA ASN A 6 27.390 19.289 29.861 1.00 0.00 H new ATOM 0 HB2 ASN A 6 25.864 18.371 27.387 1.00 0.00 H new ATOM 0 HB3 ASN A 6 27.527 17.921 27.708 1.00 0.00 H new ATOM 0 HD21 ASN A 6 25.537 15.100 28.978 1.00 0.00 H new ATOM 0 HD22 ASN A 6 25.989 15.828 27.433 1.00 0.00 H new ATOM 96 N GLU A 7 27.061 21.303 27.290 1.00 0.00 N ATOM 97 CA GLU A 7 27.909 22.202 26.510 1.00 0.00 C ATOM 98 C GLU A 7 28.320 23.461 27.305 1.00 0.00 C ATOM 99 O GLU A 7 29.508 23.748 27.444 1.00 0.00 O ATOM 100 CB GLU A 7 27.143 22.517 25.214 1.00 0.00 C ATOM 101 CG GLU A 7 27.906 23.501 24.334 1.00 0.00 C ATOM 102 CD GLU A 7 27.598 23.328 22.837 1.00 0.00 C ATOM 103 OE1 GLU A 7 28.559 23.253 22.034 1.00 0.00 O ATOM 104 OE2 GLU A 7 26.410 23.246 22.455 1.00 0.00 O ATOM 0 H GLU A 7 26.062 21.340 27.086 1.00 0.00 H new ATOM 0 HA GLU A 7 28.860 21.728 26.269 1.00 0.00 H new ATOM 0 HB2 GLU A 7 26.968 21.594 24.661 1.00 0.00 H new ATOM 0 HB3 GLU A 7 26.165 22.931 25.460 1.00 0.00 H new ATOM 0 HG2 GLU A 7 27.658 24.519 24.636 1.00 0.00 H new ATOM 0 HG3 GLU A 7 28.976 23.372 24.497 1.00 0.00 H new ATOM 111 N TYR A 8 27.373 24.159 27.949 1.00 0.00 N ATOM 112 CA TYR A 8 27.658 25.263 28.884 1.00 0.00 C ATOM 113 C TYR A 8 28.558 24.823 30.039 1.00 0.00 C ATOM 114 O TYR A 8 29.272 25.650 30.597 1.00 0.00 O ATOM 115 CB TYR A 8 26.346 25.886 29.397 1.00 0.00 C ATOM 116 CG TYR A 8 26.485 27.323 29.877 1.00 0.00 C ATOM 117 CD1 TYR A 8 26.924 27.615 31.184 1.00 0.00 C ATOM 118 CD2 TYR A 8 26.159 28.379 29.005 1.00 0.00 C ATOM 119 CE1 TYR A 8 27.075 28.950 31.608 1.00 0.00 C ATOM 120 CE2 TYR A 8 26.287 29.715 29.432 1.00 0.00 C ATOM 121 CZ TYR A 8 26.759 30.005 30.726 1.00 0.00 C ATOM 122 OH TYR A 8 26.908 31.297 31.114 1.00 0.00 O ATOM 0 H TYR A 8 26.377 23.973 27.836 1.00 0.00 H new ATOM 0 HA TYR A 8 28.209 26.026 28.335 1.00 0.00 H new ATOM 0 HB2 TYR A 8 25.604 25.851 28.599 1.00 0.00 H new ATOM 0 HB3 TYR A 8 25.963 25.277 30.216 1.00 0.00 H new ATOM 0 HD1 TYR A 8 27.147 26.808 31.867 1.00 0.00 H new ATOM 0 HD2 TYR A 8 25.810 28.164 28.006 1.00 0.00 H new ATOM 0 HE1 TYR A 8 27.431 29.165 32.605 1.00 0.00 H new ATOM 0 HE2 TYR A 8 26.022 30.521 28.763 1.00 0.00 H new ATOM 0 HH TYR A 8 26.645 31.891 30.381 1.00 0.00 H new ATOM 132 N LYS A 9 28.637 23.516 30.349 1.00 0.00 N ATOM 133 CA LYS A 9 29.540 22.936 31.346 1.00 0.00 C ATOM 134 C LYS A 9 31.009 23.352 31.140 1.00 0.00 C ATOM 135 O LYS A 9 31.732 23.513 32.115 1.00 0.00 O ATOM 136 CB LYS A 9 29.391 21.414 31.311 1.00 0.00 C ATOM 137 CG LYS A 9 29.411 20.748 32.693 1.00 0.00 C ATOM 138 CD LYS A 9 29.216 19.214 32.730 1.00 0.00 C ATOM 139 CE LYS A 9 29.282 18.675 34.169 1.00 0.00 C ATOM 140 NZ LYS A 9 29.099 17.205 34.241 1.00 0.00 N1+ ATOM 0 H LYS A 9 28.052 22.815 29.894 1.00 0.00 H new ATOM 0 HA LYS A 9 29.259 23.321 32.326 1.00 0.00 H new ATOM 0 HB2 LYS A 9 28.454 21.163 30.813 1.00 0.00 H new ATOM 0 HB3 LYS A 9 30.196 20.995 30.707 1.00 0.00 H new ATOM 0 HG2 LYS A 9 30.364 20.981 33.169 1.00 0.00 H new ATOM 0 HG3 LYS A 9 28.631 21.205 33.302 1.00 0.00 H new ATOM 0 HD2 LYS A 9 28.254 18.957 32.287 1.00 0.00 H new ATOM 0 HD3 LYS A 9 29.984 18.733 32.124 1.00 0.00 H new ATOM 0 HE2 LYS A 9 30.245 18.939 34.607 1.00 0.00 H new ATOM 0 HE3 LYS A 9 28.514 19.162 34.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 29.153 16.897 35.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 28.170 16.951 33.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 29.846 16.735 33.691 1.00 0.00 H new ATOM 154 N ILE A 10 31.418 23.636 29.894 1.00 0.00 N ATOM 155 CA ILE A 10 32.734 24.221 29.575 1.00 0.00 C ATOM 156 C ILE A 10 32.939 25.577 30.273 1.00 0.00 C ATOM 157 O ILE A 10 33.930 25.793 30.969 1.00 0.00 O ATOM 158 CB ILE A 10 32.867 24.379 28.048 1.00 0.00 C ATOM 159 CG1 ILE A 10 32.959 23.000 27.366 1.00 0.00 C ATOM 160 CG2 ILE A 10 34.094 25.243 27.696 1.00 0.00 C ATOM 161 CD1 ILE A 10 32.533 23.042 25.900 1.00 0.00 C ATOM 0 H ILE A 10 30.841 23.465 29.070 1.00 0.00 H new ATOM 0 HA ILE A 10 33.507 23.547 29.944 1.00 0.00 H new ATOM 0 HB ILE A 10 31.976 24.885 27.677 1.00 0.00 H new ATOM 0 HG12 ILE A 10 33.983 22.633 27.433 1.00 0.00 H new ATOM 0 HG13 ILE A 10 32.330 22.290 27.903 1.00 0.00 H new ATOM 0 HG21 ILE A 10 34.170 25.343 26.613 1.00 0.00 H new ATOM 0 HG22 ILE A 10 33.984 26.230 28.144 1.00 0.00 H new ATOM 0 HG23 ILE A 10 34.996 24.768 28.081 1.00 0.00 H new ATOM 0 HD11 ILE A 10 32.617 22.045 25.468 1.00 0.00 H new ATOM 0 HD12 ILE A 10 31.500 23.382 25.831 1.00 0.00 H new ATOM 0 HD13 ILE A 10 33.178 23.730 25.353 1.00 0.00 H new ATOM 173 N LEU A 11 31.976 26.492 30.109 1.00 0.00 N ATOM 174 CA LEU A 11 31.962 27.801 30.771 1.00 0.00 C ATOM 175 C LEU A 11 31.851 27.647 32.303 1.00 0.00 C ATOM 176 O LEU A 11 32.335 28.502 33.045 1.00 0.00 O ATOM 177 CB LEU A 11 30.826 28.658 30.163 1.00 0.00 C ATOM 178 CG LEU A 11 31.046 29.080 28.691 1.00 0.00 C ATOM 179 CD1 LEU A 11 29.750 29.585 28.070 1.00 0.00 C ATOM 180 CD2 LEU A 11 32.102 30.181 28.569 1.00 0.00 C ATOM 0 H LEU A 11 31.171 26.340 29.502 1.00 0.00 H new ATOM 0 HA LEU A 11 32.905 28.320 30.596 1.00 0.00 H new ATOM 0 HB2 LEU A 11 29.893 28.099 30.230 1.00 0.00 H new ATOM 0 HB3 LEU A 11 30.704 29.556 30.769 1.00 0.00 H new ATOM 0 HG LEU A 11 31.392 28.192 28.161 1.00 0.00 H new ATOM 0 HD11 LEU A 11 29.931 29.875 27.035 1.00 0.00 H new ATOM 0 HD12 LEU A 11 29.000 28.794 28.099 1.00 0.00 H new ATOM 0 HD13 LEU A 11 29.390 30.447 28.631 1.00 0.00 H new ATOM 0 HD21 LEU A 11 32.228 30.450 27.520 1.00 0.00 H new ATOM 0 HD22 LEU A 11 31.781 31.057 29.132 1.00 0.00 H new ATOM 0 HD23 LEU A 11 33.051 29.821 28.968 1.00 0.00 H new ATOM 192 N ILE A 12 31.300 26.524 32.780 1.00 0.00 N ATOM 193 CA ILE A 12 31.235 26.175 34.213 1.00 0.00 C ATOM 194 C ILE A 12 32.604 25.754 34.772 1.00 0.00 C ATOM 195 O ILE A 12 32.961 26.181 35.870 1.00 0.00 O ATOM 196 CB ILE A 12 30.142 25.122 34.509 1.00 0.00 C ATOM 197 CG1 ILE A 12 28.751 25.548 33.988 1.00 0.00 C ATOM 198 CG2 ILE A 12 30.073 24.792 36.013 1.00 0.00 C ATOM 199 CD1 ILE A 12 28.236 26.876 34.548 1.00 0.00 C ATOM 0 H ILE A 12 30.879 25.818 32.176 1.00 0.00 H new ATOM 0 HA ILE A 12 30.947 27.085 34.739 1.00 0.00 H new ATOM 0 HB ILE A 12 30.431 24.222 33.967 1.00 0.00 H new ATOM 0 HG12 ILE A 12 28.792 25.619 32.901 1.00 0.00 H new ATOM 0 HG13 ILE A 12 28.032 24.765 34.229 1.00 0.00 H new ATOM 0 HG21 ILE A 12 29.295 24.049 36.187 1.00 0.00 H new ATOM 0 HG22 ILE A 12 31.033 24.396 36.343 1.00 0.00 H new ATOM 0 HG23 ILE A 12 29.842 25.698 36.574 1.00 0.00 H new ATOM 0 HD11 ILE A 12 27.254 27.093 34.126 1.00 0.00 H new ATOM 0 HD12 ILE A 12 28.158 26.807 35.633 1.00 0.00 H new ATOM 0 HD13 ILE A 12 28.929 27.675 34.284 1.00 0.00 H new ATOM 211 N MET A 13 33.417 25.003 34.018 1.00 0.00 N ATOM 212 CA MET A 13 34.781 24.647 34.435 1.00 0.00 C ATOM 213 C MET A 13 35.650 25.886 34.683 1.00 0.00 C ATOM 214 O MET A 13 36.431 25.919 35.637 1.00 0.00 O ATOM 215 CB MET A 13 35.458 23.736 33.396 1.00 0.00 C ATOM 216 CG MET A 13 34.785 22.370 33.232 1.00 0.00 C ATOM 217 SD MET A 13 34.653 21.397 34.756 1.00 0.00 S ATOM 218 CE MET A 13 33.925 19.885 34.075 1.00 0.00 C ATOM 0 H MET A 13 33.151 24.627 33.108 1.00 0.00 H new ATOM 0 HA MET A 13 34.688 24.106 35.377 1.00 0.00 H new ATOM 0 HB2 MET A 13 35.465 24.244 32.432 1.00 0.00 H new ATOM 0 HB3 MET A 13 36.498 23.585 33.684 1.00 0.00 H new ATOM 0 HG2 MET A 13 33.785 22.520 32.826 1.00 0.00 H new ATOM 0 HG3 MET A 13 35.344 21.792 32.496 1.00 0.00 H new ATOM 0 HE1 MET A 13 33.301 19.409 34.831 1.00 0.00 H new ATOM 0 HE2 MET A 13 33.316 20.134 33.206 1.00 0.00 H new ATOM 0 HE3 MET A 13 34.720 19.201 33.777 1.00 0.00 H new ATOM 228 N LEU A 14 35.492 26.939 33.875 1.00 0.00 N ATOM 229 CA LEU A 14 36.139 28.221 34.116 1.00 0.00 C ATOM 230 C LEU A 14 35.504 28.957 35.300 1.00 0.00 C ATOM 231 O LEU A 14 36.238 29.496 36.123 1.00 0.00 O ATOM 232 CB LEU A 14 36.061 29.078 32.851 1.00 0.00 C ATOM 233 CG LEU A 14 36.721 28.438 31.615 1.00 0.00 C ATOM 234 CD1 LEU A 14 36.091 28.971 30.333 1.00 0.00 C ATOM 235 CD2 LEU A 14 38.220 28.721 31.578 1.00 0.00 C ATOM 0 H LEU A 14 34.911 26.921 33.037 1.00 0.00 H new ATOM 0 HA LEU A 14 37.183 28.037 34.368 1.00 0.00 H new ATOM 0 HB2 LEU A 14 35.014 29.280 32.626 1.00 0.00 H new ATOM 0 HB3 LEU A 14 36.536 30.039 33.047 1.00 0.00 H new ATOM 0 HG LEU A 14 36.562 27.362 31.686 1.00 0.00 H new ATOM 0 HD11 LEU A 14 36.571 28.507 29.471 1.00 0.00 H new ATOM 0 HD12 LEU A 14 35.027 28.736 30.326 1.00 0.00 H new ATOM 0 HD13 LEU A 14 36.224 30.052 30.284 1.00 0.00 H new ATOM 0 HD21 LEU A 14 38.656 28.256 30.694 1.00 0.00 H new ATOM 0 HD22 LEU A 14 38.386 29.798 31.541 1.00 0.00 H new ATOM 0 HD23 LEU A 14 38.690 28.312 32.472 1.00 0.00 H new ATOM 247 N LYS A 15 34.149 28.971 35.414 1.00 0.00 N ATOM 248 CA LYS A 15 33.409 29.629 36.505 1.00 0.00 C ATOM 249 C LYS A 15 33.879 29.147 37.880 1.00 0.00 C ATOM 250 O LYS A 15 34.228 29.973 38.716 1.00 0.00 O ATOM 251 CB LYS A 15 31.895 29.411 36.289 1.00 0.00 C ATOM 252 CG LYS A 15 30.936 29.792 37.437 1.00 0.00 C ATOM 253 CD LYS A 15 31.216 31.153 38.078 1.00 0.00 C ATOM 254 CE LYS A 15 30.166 31.514 39.146 1.00 0.00 C ATOM 255 NZ LYS A 15 30.537 32.724 39.924 1.00 0.00 N1+ ATOM 0 H LYS A 15 33.538 28.516 34.736 1.00 0.00 H new ATOM 0 HA LYS A 15 33.612 30.700 36.484 1.00 0.00 H new ATOM 0 HB2 LYS A 15 31.599 29.977 35.405 1.00 0.00 H new ATOM 0 HB3 LYS A 15 31.739 28.357 36.060 1.00 0.00 H new ATOM 0 HG2 LYS A 15 29.915 29.788 37.056 1.00 0.00 H new ATOM 0 HG3 LYS A 15 30.991 29.024 38.208 1.00 0.00 H new ATOM 0 HD2 LYS A 15 32.207 31.143 38.532 1.00 0.00 H new ATOM 0 HD3 LYS A 15 31.227 31.922 37.306 1.00 0.00 H new ATOM 0 HE2 LYS A 15 29.203 31.678 38.663 1.00 0.00 H new ATOM 0 HE3 LYS A 15 30.041 30.672 39.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 29.798 32.924 40.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 31.443 32.561 40.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 30.630 33.536 39.280 1.00 0.00 H new ATOM 269 N GLU A 16 33.975 27.814 38.102 1.00 0.00 N ATOM 270 CA GLU A 16 34.430 27.249 39.383 1.00 0.00 C ATOM 271 C GLU A 16 35.947 27.377 39.618 1.00 0.00 C ATOM 272 O GLU A 16 36.366 27.421 40.773 1.00 0.00 O ATOM 273 CB GLU A 16 33.982 25.782 39.524 1.00 0.00 C ATOM 274 CG GLU A 16 32.464 25.554 39.654 1.00 0.00 C ATOM 275 CD GLU A 16 32.015 24.082 39.723 1.00 0.00 C ATOM 276 OE1 GLU A 16 32.867 23.196 39.478 1.00 0.00 O ATOM 277 OE2 GLU A 16 30.826 23.786 39.987 1.00 0.00 O ATOM 0 H GLU A 16 33.740 27.111 37.401 1.00 0.00 H new ATOM 0 HA GLU A 16 33.954 27.850 40.158 1.00 0.00 H new ATOM 0 HB2 GLU A 16 34.341 25.227 38.657 1.00 0.00 H new ATOM 0 HB3 GLU A 16 34.471 25.355 40.400 1.00 0.00 H new ATOM 0 HG2 GLU A 16 32.114 26.064 40.551 1.00 0.00 H new ATOM 0 HG3 GLU A 16 31.970 26.026 38.805 1.00 0.00 H new ATOM 284 N ASN A 17 36.785 27.501 38.577 1.00 0.00 N ATOM 285 CA ASN A 17 38.192 27.913 38.746 1.00 0.00 C ATOM 286 C ASN A 17 38.400 29.440 38.787 1.00 0.00 C ATOM 287 O ASN A 17 39.536 29.894 38.909 1.00 0.00 O ATOM 288 CB ASN A 17 39.124 27.251 37.715 1.00 0.00 C ATOM 289 CG ASN A 17 39.293 25.761 37.938 1.00 0.00 C ATOM 290 OD1 ASN A 17 40.093 25.323 38.758 1.00 0.00 O ATOM 291 ND2 ASN A 17 38.574 24.941 37.214 1.00 0.00 N ATOM 0 H ASN A 17 36.516 27.323 37.610 1.00 0.00 H new ATOM 0 HA ASN A 17 38.470 27.546 39.734 1.00 0.00 H new ATOM 0 HB2 ASN A 17 38.727 27.420 36.714 1.00 0.00 H new ATOM 0 HB3 ASN A 17 40.101 27.732 37.756 1.00 0.00 H new ATOM 0 HD21 ASN A 17 38.678 23.933 37.331 1.00 0.00 H new ATOM 0 HD22 ASN A 17 37.910 25.310 36.533 1.00 0.00 H new ATOM 298 N GLN A 18 37.334 30.249 38.734 1.00 0.00 N ATOM 299 CA GLN A 18 37.392 31.723 38.719 1.00 0.00 C ATOM 300 C GLN A 18 38.049 32.310 37.442 1.00 0.00 C ATOM 301 O GLN A 18 38.410 33.489 37.387 1.00 0.00 O ATOM 302 CB GLN A 18 38.007 32.268 40.034 1.00 0.00 C ATOM 303 CG GLN A 18 37.285 31.788 41.310 1.00 0.00 C ATOM 304 CD GLN A 18 37.955 32.280 42.583 1.00 0.00 C ATOM 305 OE1 GLN A 18 39.144 32.575 42.617 1.00 0.00 O ATOM 306 NE2 GLN A 18 37.228 32.433 43.668 1.00 0.00 N ATOM 0 H GLN A 18 36.380 29.890 38.699 1.00 0.00 H new ATOM 0 HA GLN A 18 36.363 32.078 38.673 1.00 0.00 H new ATOM 0 HB2 GLN A 18 39.053 31.967 40.086 1.00 0.00 H new ATOM 0 HB3 GLN A 18 37.990 33.358 40.007 1.00 0.00 H new ATOM 0 HG2 GLN A 18 36.252 32.135 41.290 1.00 0.00 H new ATOM 0 HG3 GLN A 18 37.255 30.698 41.318 1.00 0.00 H new ATOM 0 HE21 GLN A 18 36.237 32.192 43.656 1.00 0.00 H new ATOM 0 HE22 GLN A 18 37.655 32.793 44.522 1.00 0.00 H new ATOM 315 N CYS A 19 38.196 31.496 36.395 1.00 0.00 N ATOM 316 CA CYS A 19 38.933 31.761 35.156 1.00 0.00 C ATOM 317 C CYS A 19 38.124 32.510 34.090 1.00 0.00 C ATOM 318 O CYS A 19 38.043 32.060 32.953 1.00 0.00 O ATOM 319 CB CYS A 19 39.520 30.442 34.639 1.00 0.00 C ATOM 320 SG CYS A 19 40.723 29.806 35.838 1.00 0.00 S ATOM 0 H CYS A 19 37.773 30.568 36.389 1.00 0.00 H new ATOM 0 HA CYS A 19 39.743 32.452 35.390 1.00 0.00 H new ATOM 0 HB2 CYS A 19 38.724 29.713 34.484 1.00 0.00 H new ATOM 0 HB3 CYS A 19 40.001 30.599 33.673 1.00 0.00 H new ATOM 0 HG CYS A 19 40.240 29.920 37.039 1.00 0.00 H new ATOM 326 N THR A 20 37.395 33.544 34.505 1.00 0.00 N ATOM 327 CA THR A 20 36.556 34.285 33.567 1.00 0.00 C ATOM 328 C THR A 20 36.618 35.818 33.641 1.00 0.00 C ATOM 329 O THR A 20 35.977 36.426 34.498 1.00 0.00 O ATOM 330 CB THR A 20 35.076 33.902 33.756 1.00 0.00 C ATOM 331 OG1 THR A 20 34.262 34.653 32.847 1.00 0.00 O ATOM 332 CG2 THR A 20 34.628 34.182 35.184 1.00 0.00 C ATOM 0 H THR A 20 37.368 33.883 35.467 1.00 0.00 H new ATOM 0 HA THR A 20 36.968 33.997 32.600 1.00 0.00 H new ATOM 0 HB THR A 20 34.966 32.836 33.555 1.00 0.00 H new ATOM 0 HG1 THR A 20 33.322 34.406 32.969 1.00 0.00 H new ATOM 0 HG21 THR A 20 33.580 33.905 35.297 1.00 0.00 H new ATOM 0 HG22 THR A 20 35.235 33.599 35.877 1.00 0.00 H new ATOM 0 HG23 THR A 20 34.748 35.243 35.402 1.00 0.00 H new ATOM 340 N THR A 21 37.377 36.434 32.737 1.00 0.00 N ATOM 341 CA THR A 21 37.574 37.883 32.722 1.00 0.00 C ATOM 342 C THR A 21 38.142 38.215 31.337 1.00 0.00 C ATOM 343 O THR A 21 38.685 37.340 30.660 1.00 0.00 O ATOM 344 CB THR A 21 38.388 38.512 33.878 1.00 0.00 C ATOM 345 OG1 THR A 21 38.274 39.940 33.828 1.00 0.00 O ATOM 346 CG2 THR A 21 39.850 38.128 33.818 1.00 0.00 C ATOM 0 H THR A 21 37.873 35.943 31.994 1.00 0.00 H new ATOM 0 HA THR A 21 36.607 38.350 32.907 1.00 0.00 H new ATOM 0 HB THR A 21 37.977 38.130 34.813 1.00 0.00 H new ATOM 0 HG1 THR A 21 38.789 40.335 34.562 1.00 0.00 H new ATOM 0 HG21 THR A 21 40.382 38.592 34.648 1.00 0.00 H new ATOM 0 HG22 THR A 21 39.945 37.044 33.887 1.00 0.00 H new ATOM 0 HG23 THR A 21 40.278 38.471 32.876 1.00 0.00 H new ATOM 354 N GLU A 22 38.031 39.466 30.909 1.00 0.00 N ATOM 355 CA GLU A 22 38.510 39.832 29.581 1.00 0.00 C ATOM 356 C GLU A 22 40.008 39.584 29.428 1.00 0.00 C ATOM 357 O GLU A 22 40.455 39.091 28.393 1.00 0.00 O ATOM 358 CB GLU A 22 38.199 41.301 29.284 1.00 0.00 C ATOM 359 CG GLU A 22 36.716 41.608 29.151 1.00 0.00 C ATOM 360 CD GLU A 22 36.441 43.082 28.929 1.00 0.00 C ATOM 361 OE1 GLU A 22 37.383 43.891 29.067 1.00 0.00 O ATOM 362 OE2 GLU A 22 35.283 43.432 28.618 1.00 0.00 O ATOM 0 H GLU A 22 37.623 40.230 31.448 1.00 0.00 H new ATOM 0 HA GLU A 22 37.987 39.198 28.865 1.00 0.00 H new ATOM 0 HB2 GLU A 22 38.617 41.918 30.080 1.00 0.00 H new ATOM 0 HB3 GLU A 22 38.703 41.588 28.361 1.00 0.00 H new ATOM 0 HG2 GLU A 22 36.304 41.037 28.319 1.00 0.00 H new ATOM 0 HG3 GLU A 22 36.199 41.278 30.052 1.00 0.00 H new ATOM 369 N LEU A 23 40.781 39.923 30.453 1.00 0.00 N ATOM 370 CA LEU A 23 42.225 39.722 30.402 1.00 0.00 C ATOM 371 C LEU A 23 42.614 38.245 30.306 1.00 0.00 C ATOM 372 O LEU A 23 43.513 37.883 29.547 1.00 0.00 O ATOM 373 CB LEU A 23 42.891 40.349 31.630 1.00 0.00 C ATOM 374 CG LEU A 23 42.919 41.878 31.666 1.00 0.00 C ATOM 375 CD1 LEU A 23 41.510 42.445 31.588 1.00 0.00 C ATOM 376 CD2 LEU A 23 43.628 42.373 32.918 1.00 0.00 C ATOM 0 H LEU A 23 40.437 40.334 31.321 1.00 0.00 H new ATOM 0 HA LEU A 23 42.578 40.212 29.494 1.00 0.00 H new ATOM 0 HB2 LEU A 23 42.374 39.993 32.521 1.00 0.00 H new ATOM 0 HB3 LEU A 23 43.917 39.984 31.689 1.00 0.00 H new ATOM 0 HG LEU A 23 43.475 42.228 30.797 1.00 0.00 H new ATOM 0 HD11 LEU A 23 41.554 43.534 31.615 1.00 0.00 H new ATOM 0 HD12 LEU A 23 41.040 42.124 30.659 1.00 0.00 H new ATOM 0 HD13 LEU A 23 40.925 42.084 32.434 1.00 0.00 H new ATOM 0 HD21 LEU A 23 43.637 43.463 32.924 1.00 0.00 H new ATOM 0 HD22 LEU A 23 43.103 42.009 33.801 1.00 0.00 H new ATOM 0 HD23 LEU A 23 44.653 42.002 32.927 1.00 0.00 H new ATOM 388 N LYS A 24 41.937 37.398 31.077 1.00 0.00 N ATOM 389 CA LYS A 24 42.237 35.965 31.091 1.00 0.00 C ATOM 390 C LYS A 24 41.714 35.147 29.913 1.00 0.00 C ATOM 391 O LYS A 24 40.604 35.345 29.420 1.00 0.00 O ATOM 392 CB LYS A 24 41.738 35.314 32.382 1.00 0.00 C ATOM 393 CG LYS A 24 42.438 35.809 33.639 1.00 0.00 C ATOM 394 CD LYS A 24 43.828 36.349 33.344 1.00 0.00 C ATOM 395 CE LYS A 24 44.539 36.772 34.620 1.00 0.00 C ATOM 396 NZ LYS A 24 45.894 37.326 34.350 1.00 0.00 N1+ ATOM 0 H LYS A 24 41.178 37.676 31.700 1.00 0.00 H new ATOM 0 HA LYS A 24 43.324 35.944 31.013 1.00 0.00 H new ATOM 0 HB2 LYS A 24 40.668 35.498 32.479 1.00 0.00 H new ATOM 0 HB3 LYS A 24 41.870 34.235 32.307 1.00 0.00 H new ATOM 0 HG2 LYS A 24 41.837 36.590 34.104 1.00 0.00 H new ATOM 0 HG3 LYS A 24 42.512 34.993 34.358 1.00 0.00 H new ATOM 0 HD2 LYS A 24 44.416 35.586 32.833 1.00 0.00 H new ATOM 0 HD3 LYS A 24 43.754 37.200 32.667 1.00 0.00 H new ATOM 0 HE2 LYS A 24 43.939 37.520 35.138 1.00 0.00 H new ATOM 0 HE3 LYS A 24 44.625 35.915 35.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 46.342 37.601 35.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 46.477 36.604 33.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 45.812 38.160 33.734 1.00 0.00 H new ATOM 410 N SER A 25 42.563 34.223 29.486 1.00 0.00 N ATOM 411 CA SER A 25 42.276 33.299 28.380 1.00 0.00 C ATOM 412 C SER A 25 42.654 31.867 28.761 1.00 0.00 C ATOM 413 O SER A 25 43.464 31.662 29.664 1.00 0.00 O ATOM 414 CB SER A 25 42.991 33.711 27.087 1.00 0.00 C ATOM 415 OG SER A 25 44.393 33.753 27.273 1.00 0.00 O ATOM 0 H SER A 25 43.486 34.086 29.899 1.00 0.00 H new ATOM 0 HA SER A 25 41.203 33.345 28.192 1.00 0.00 H new ATOM 0 HB2 SER A 25 42.747 33.006 26.292 1.00 0.00 H new ATOM 0 HB3 SER A 25 42.634 34.689 26.766 1.00 0.00 H new ATOM 0 HG SER A 25 44.763 34.528 26.800 1.00 0.00 H new ATOM 421 N PHE A 26 42.081 30.884 28.067 1.00 0.00 N ATOM 422 CA PHE A 26 42.371 29.457 28.240 1.00 0.00 C ATOM 423 C PHE A 26 42.678 28.813 26.874 1.00 0.00 C ATOM 424 O PHE A 26 41.994 29.072 25.881 1.00 0.00 O ATOM 425 CB PHE A 26 41.193 28.773 28.967 1.00 0.00 C ATOM 426 CG PHE A 26 41.435 28.315 30.402 1.00 0.00 C ATOM 427 CD1 PHE A 26 41.808 29.229 31.410 1.00 0.00 C ATOM 428 CD2 PHE A 26 41.192 26.973 30.760 1.00 0.00 C ATOM 429 CE1 PHE A 26 41.936 28.808 32.749 1.00 0.00 C ATOM 430 CE2 PHE A 26 41.306 26.569 32.103 1.00 0.00 C ATOM 431 CZ PHE A 26 41.664 27.474 33.096 1.00 0.00 C ATOM 0 H PHE A 26 41.381 31.062 27.347 1.00 0.00 H new ATOM 0 HA PHE A 26 43.257 29.326 28.861 1.00 0.00 H new ATOM 0 HB2 PHE A 26 40.350 29.464 28.970 1.00 0.00 H new ATOM 0 HB3 PHE A 26 40.892 27.905 28.381 1.00 0.00 H new ATOM 0 HD1 PHE A 26 41.997 30.261 31.153 1.00 0.00 H new ATOM 0 HD2 PHE A 26 40.918 26.254 30.002 1.00 0.00 H new ATOM 0 HE1 PHE A 26 42.243 29.511 33.509 1.00 0.00 H new ATOM 0 HE2 PHE A 26 41.112 25.540 32.367 1.00 0.00 H new ATOM 0 HZ PHE A 26 41.732 27.154 34.125 1.00 0.00 H new ATOM 441 N THR A 27 43.711 27.968 26.822 1.00 0.00 N ATOM 442 CA THR A 27 44.138 27.223 25.623 1.00 0.00 C ATOM 443 C THR A 27 43.296 25.965 25.401 1.00 0.00 C ATOM 444 O THR A 27 42.742 25.407 26.350 1.00 0.00 O ATOM 445 CB THR A 27 45.612 26.805 25.741 1.00 0.00 C ATOM 446 OG1 THR A 27 45.782 25.974 26.866 1.00 0.00 O ATOM 447 CG2 THR A 27 46.565 27.991 25.878 1.00 0.00 C ATOM 0 H THR A 27 44.295 27.774 27.636 1.00 0.00 H new ATOM 0 HA THR A 27 44.002 27.894 24.775 1.00 0.00 H new ATOM 0 HB THR A 27 45.857 26.282 24.816 1.00 0.00 H new ATOM 0 HG1 THR A 27 46.236 25.148 26.597 1.00 0.00 H new ATOM 0 HG21 THR A 27 47.589 27.627 25.957 1.00 0.00 H new ATOM 0 HG22 THR A 27 46.475 28.634 25.002 1.00 0.00 H new ATOM 0 HG23 THR A 27 46.312 28.560 26.773 1.00 0.00 H new ATOM 455 N TYR A 28 43.245 25.437 24.172 1.00 0.00 N ATOM 456 CA TYR A 28 42.559 24.167 23.902 1.00 0.00 C ATOM 457 C TYR A 28 43.243 22.971 24.578 1.00 0.00 C ATOM 458 O TYR A 28 42.554 22.034 24.979 1.00 0.00 O ATOM 459 CB TYR A 28 42.388 23.942 22.395 1.00 0.00 C ATOM 460 CG TYR A 28 41.557 25.005 21.701 1.00 0.00 C ATOM 461 CD1 TYR A 28 40.252 25.281 22.156 1.00 0.00 C ATOM 462 CD2 TYR A 28 42.072 25.700 20.588 1.00 0.00 C ATOM 463 CE1 TYR A 28 39.458 26.236 21.500 1.00 0.00 C ATOM 464 CE2 TYR A 28 41.279 26.663 19.931 1.00 0.00 C ATOM 465 CZ TYR A 28 39.969 26.930 20.387 1.00 0.00 C ATOM 466 OH TYR A 28 39.192 27.845 19.758 1.00 0.00 O ATOM 0 H TYR A 28 43.669 25.868 23.351 1.00 0.00 H new ATOM 0 HA TYR A 28 41.566 24.243 24.346 1.00 0.00 H new ATOM 0 HB2 TYR A 28 43.373 23.905 21.930 1.00 0.00 H new ATOM 0 HB3 TYR A 28 41.923 22.970 22.234 1.00 0.00 H new ATOM 0 HD1 TYR A 28 39.860 24.755 23.014 1.00 0.00 H new ATOM 0 HD2 TYR A 28 43.073 25.495 20.239 1.00 0.00 H new ATOM 0 HE1 TYR A 28 38.456 26.438 21.849 1.00 0.00 H new ATOM 0 HE2 TYR A 28 41.673 27.197 19.079 1.00 0.00 H new ATOM 0 HH TYR A 28 39.609 28.729 19.824 1.00 0.00 H new ATOM 476 N THR A 29 44.561 23.030 24.792 1.00 0.00 N ATOM 477 CA THR A 29 45.312 22.056 25.609 1.00 0.00 C ATOM 478 C THR A 29 44.766 21.981 27.042 1.00 0.00 C ATOM 479 O THR A 29 44.411 20.900 27.512 1.00 0.00 O ATOM 480 CB THR A 29 46.820 22.388 25.618 1.00 0.00 C ATOM 481 OG1 THR A 29 47.047 23.726 26.020 1.00 0.00 O ATOM 482 CG2 THR A 29 47.443 22.231 24.230 1.00 0.00 C ATOM 0 H THR A 29 45.150 23.764 24.399 1.00 0.00 H new ATOM 0 HA THR A 29 45.179 21.076 25.151 1.00 0.00 H new ATOM 0 HB THR A 29 47.276 21.689 26.319 1.00 0.00 H new ATOM 0 HG1 THR A 29 48.010 23.909 26.019 1.00 0.00 H new ATOM 0 HG21 THR A 29 48.505 22.474 24.278 1.00 0.00 H new ATOM 0 HG22 THR A 29 47.321 21.202 23.891 1.00 0.00 H new ATOM 0 HG23 THR A 29 46.948 22.905 23.531 1.00 0.00 H new ATOM 490 N LYS A 30 44.605 23.126 27.721 1.00 0.00 N ATOM 491 CA LYS A 30 44.047 23.203 29.082 1.00 0.00 C ATOM 492 C LYS A 30 42.549 22.872 29.112 1.00 0.00 C ATOM 493 O LYS A 30 42.112 22.109 29.974 1.00 0.00 O ATOM 494 CB LYS A 30 44.351 24.605 29.642 1.00 0.00 C ATOM 495 CG LYS A 30 43.946 24.821 31.108 1.00 0.00 C ATOM 496 CD LYS A 30 44.701 23.947 32.117 1.00 0.00 C ATOM 497 CE LYS A 30 44.510 24.515 33.532 1.00 0.00 C ATOM 498 NZ LYS A 30 45.296 23.774 34.548 1.00 0.00 N1+ ATOM 0 H LYS A 30 44.861 24.036 27.338 1.00 0.00 H new ATOM 0 HA LYS A 30 44.516 22.450 29.716 1.00 0.00 H new ATOM 0 HB2 LYS A 30 45.420 24.795 29.544 1.00 0.00 H new ATOM 0 HB3 LYS A 30 43.839 25.344 29.027 1.00 0.00 H new ATOM 0 HG2 LYS A 30 44.106 25.868 31.364 1.00 0.00 H new ATOM 0 HG3 LYS A 30 42.878 24.628 31.208 1.00 0.00 H new ATOM 0 HD2 LYS A 30 44.333 22.922 32.073 1.00 0.00 H new ATOM 0 HD3 LYS A 30 45.761 23.917 31.866 1.00 0.00 H new ATOM 0 HE2 LYS A 30 44.805 25.564 33.542 1.00 0.00 H new ATOM 0 HE3 LYS A 30 43.453 24.478 33.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 45.135 24.194 35.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 44.998 22.778 34.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 46.308 23.830 34.313 1.00 0.00 H new ATOM 512 N LEU A 31 41.773 23.403 28.162 1.00 0.00 N ATOM 513 CA LEU A 31 40.327 23.172 28.049 1.00 0.00 C ATOM 514 C LEU A 31 39.977 21.695 27.819 1.00 0.00 C ATOM 515 O LEU A 31 39.002 21.222 28.398 1.00 0.00 O ATOM 516 CB LEU A 31 39.746 24.027 26.910 1.00 0.00 C ATOM 517 CG LEU A 31 39.643 25.532 27.206 1.00 0.00 C ATOM 518 CD1 LEU A 31 39.409 26.311 25.911 1.00 0.00 C ATOM 519 CD2 LEU A 31 38.486 25.847 28.156 1.00 0.00 C ATOM 0 H LEU A 31 42.138 24.018 27.435 1.00 0.00 H new ATOM 0 HA LEU A 31 39.884 23.463 29.001 1.00 0.00 H new ATOM 0 HB2 LEU A 31 40.364 23.889 26.023 1.00 0.00 H new ATOM 0 HB3 LEU A 31 38.752 23.652 26.667 1.00 0.00 H new ATOM 0 HG LEU A 31 40.583 25.826 27.673 1.00 0.00 H new ATOM 0 HD11 LEU A 31 39.338 27.375 26.135 1.00 0.00 H new ATOM 0 HD12 LEU A 31 40.240 26.138 25.227 1.00 0.00 H new ATOM 0 HD13 LEU A 31 38.482 25.975 25.447 1.00 0.00 H new ATOM 0 HD21 LEU A 31 38.448 26.921 28.340 1.00 0.00 H new ATOM 0 HD22 LEU A 31 37.548 25.522 27.707 1.00 0.00 H new ATOM 0 HD23 LEU A 31 38.637 25.323 29.100 1.00 0.00 H new ATOM 531 N CYS A 32 40.766 20.959 27.028 1.00 0.00 N ATOM 532 CA CYS A 32 40.593 19.520 26.816 1.00 0.00 C ATOM 533 C CYS A 32 40.621 18.755 28.152 1.00 0.00 C ATOM 534 O CYS A 32 39.676 18.038 28.482 1.00 0.00 O ATOM 535 CB CYS A 32 41.698 19.054 25.852 1.00 0.00 C ATOM 536 SG CYS A 32 41.567 17.278 25.500 1.00 0.00 S ATOM 0 H CYS A 32 41.552 21.352 26.511 1.00 0.00 H new ATOM 0 HA CYS A 32 39.618 19.312 26.376 1.00 0.00 H new ATOM 0 HB2 CYS A 32 41.631 19.617 24.921 1.00 0.00 H new ATOM 0 HB3 CYS A 32 42.675 19.269 26.285 1.00 0.00 H new ATOM 0 HG CYS A 32 40.314 16.935 25.460 1.00 0.00 H new ATOM 542 N ASN A 33 41.670 18.973 28.958 1.00 0.00 N ATOM 543 CA ASN A 33 41.847 18.300 30.245 1.00 0.00 C ATOM 544 C ASN A 33 40.717 18.609 31.245 1.00 0.00 C ATOM 545 O ASN A 33 40.142 17.681 31.808 1.00 0.00 O ATOM 546 CB ASN A 33 43.226 18.671 30.818 1.00 0.00 C ATOM 547 CG ASN A 33 43.450 18.008 32.166 1.00 0.00 C ATOM 548 OD1 ASN A 33 43.570 16.801 32.274 1.00 0.00 O ATOM 549 ND2 ASN A 33 43.477 18.767 33.239 1.00 0.00 N ATOM 0 H ASN A 33 42.421 19.625 28.731 1.00 0.00 H new ATOM 0 HA ASN A 33 41.797 17.224 30.076 1.00 0.00 H new ATOM 0 HB2 ASN A 33 44.007 18.364 30.123 1.00 0.00 H new ATOM 0 HB3 ASN A 33 43.301 19.753 30.924 1.00 0.00 H new ATOM 0 HD21 ASN A 33 43.598 18.345 34.160 1.00 0.00 H new ATOM 0 HD22 ASN A 33 43.377 19.778 33.151 1.00 0.00 H new ATOM 556 N ILE A 34 40.374 19.888 31.460 1.00 0.00 N ATOM 557 CA ILE A 34 39.333 20.249 32.446 1.00 0.00 C ATOM 558 C ILE A 34 37.922 19.822 32.000 1.00 0.00 C ATOM 559 O ILE A 34 37.073 19.578 32.847 1.00 0.00 O ATOM 560 CB ILE A 34 39.375 21.749 32.833 1.00 0.00 C ATOM 561 CG1 ILE A 34 38.895 22.635 31.660 1.00 0.00 C ATOM 562 CG2 ILE A 34 40.749 22.147 33.416 1.00 0.00 C ATOM 563 CD1 ILE A 34 38.689 24.111 31.991 1.00 0.00 C ATOM 0 H ILE A 34 40.792 20.682 30.975 1.00 0.00 H new ATOM 0 HA ILE A 34 39.568 19.681 33.346 1.00 0.00 H new ATOM 0 HB ILE A 34 38.667 21.925 33.643 1.00 0.00 H new ATOM 0 HG12 ILE A 34 39.621 22.560 30.851 1.00 0.00 H new ATOM 0 HG13 ILE A 34 37.955 22.231 31.283 1.00 0.00 H new ATOM 0 HG21 ILE A 34 40.741 23.206 33.676 1.00 0.00 H new ATOM 0 HG22 ILE A 34 40.950 21.556 34.309 1.00 0.00 H new ATOM 0 HG23 ILE A 34 41.526 21.961 32.675 1.00 0.00 H new ATOM 0 HD11 ILE A 34 38.353 24.640 31.099 1.00 0.00 H new ATOM 0 HD12 ILE A 34 37.938 24.207 32.775 1.00 0.00 H new ATOM 0 HD13 ILE A 34 39.629 24.541 32.335 1.00 0.00 H new ATOM 575 N SER A 35 37.655 19.735 30.689 1.00 0.00 N ATOM 576 CA SER A 35 36.314 19.415 30.165 1.00 0.00 C ATOM 577 C SER A 35 36.037 17.910 30.044 1.00 0.00 C ATOM 578 O SER A 35 34.870 17.522 29.945 1.00 0.00 O ATOM 579 CB SER A 35 36.082 20.077 28.804 1.00 0.00 C ATOM 580 OG SER A 35 36.376 21.458 28.837 1.00 0.00 O ATOM 0 H SER A 35 38.356 19.883 29.963 1.00 0.00 H new ATOM 0 HA SER A 35 35.618 19.814 30.903 1.00 0.00 H new ATOM 0 HB2 SER A 35 36.704 19.591 28.052 1.00 0.00 H new ATOM 0 HB3 SER A 35 35.045 19.933 28.502 1.00 0.00 H new ATOM 0 HG SER A 35 37.292 21.605 28.520 1.00 0.00 H new ATOM 586 N LYS A 36 37.077 17.057 30.066 1.00 0.00 N ATOM 587 CA LYS A 36 36.974 15.585 29.938 1.00 0.00 C ATOM 588 C LYS A 36 36.466 15.080 28.571 1.00 0.00 C ATOM 589 O LYS A 36 35.831 14.028 28.470 1.00 0.00 O ATOM 590 CB LYS A 36 36.185 15.029 31.143 1.00 0.00 C ATOM 591 CG LYS A 36 37.068 14.284 32.147 1.00 0.00 C ATOM 592 CD LYS A 36 36.184 13.872 33.325 1.00 0.00 C ATOM 593 CE LYS A 36 36.970 13.067 34.354 1.00 0.00 C ATOM 594 NZ LYS A 36 36.058 12.592 35.415 1.00 0.00 N1+ ATOM 0 H LYS A 36 38.039 17.377 30.176 1.00 0.00 H new ATOM 0 HA LYS A 36 37.987 15.182 29.963 1.00 0.00 H new ATOM 0 HB2 LYS A 36 35.682 15.852 31.651 1.00 0.00 H new ATOM 0 HB3 LYS A 36 35.408 14.355 30.781 1.00 0.00 H new ATOM 0 HG2 LYS A 36 37.520 13.407 31.683 1.00 0.00 H new ATOM 0 HG3 LYS A 36 37.884 14.922 32.486 1.00 0.00 H new ATOM 0 HD2 LYS A 36 35.767 14.761 33.798 1.00 0.00 H new ATOM 0 HD3 LYS A 36 35.344 13.280 32.962 1.00 0.00 H new ATOM 0 HE2 LYS A 36 37.456 12.219 33.872 1.00 0.00 H new ATOM 0 HE3 LYS A 36 37.758 13.683 34.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 36.596 12.043 36.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 35.614 13.408 35.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 35.321 11.990 34.995 1.00 0.00 H new ATOM 608 N LEU A 37 36.731 15.838 27.505 1.00 0.00 N ATOM 609 CA LEU A 37 36.284 15.579 26.139 1.00 0.00 C ATOM 610 C LEU A 37 37.341 16.011 25.107 1.00 0.00 C ATOM 611 O LEU A 37 38.303 16.696 25.453 1.00 0.00 O ATOM 612 CB LEU A 37 34.909 16.243 25.937 1.00 0.00 C ATOM 613 CG LEU A 37 34.737 17.716 26.355 1.00 0.00 C ATOM 614 CD1 LEU A 37 35.363 18.722 25.396 1.00 0.00 C ATOM 615 CD2 LEU A 37 33.250 18.047 26.468 1.00 0.00 C ATOM 0 H LEU A 37 37.289 16.689 27.576 1.00 0.00 H new ATOM 0 HA LEU A 37 36.163 14.508 25.978 1.00 0.00 H new ATOM 0 HB2 LEU A 37 34.656 16.166 24.880 1.00 0.00 H new ATOM 0 HB3 LEU A 37 34.173 15.655 26.485 1.00 0.00 H new ATOM 0 HG LEU A 37 35.257 17.808 27.308 1.00 0.00 H new ATOM 0 HD11 LEU A 37 35.194 19.733 25.768 1.00 0.00 H new ATOM 0 HD12 LEU A 37 36.435 18.537 25.323 1.00 0.00 H new ATOM 0 HD13 LEU A 37 34.908 18.617 24.411 1.00 0.00 H new ATOM 0 HD21 LEU A 37 33.131 19.089 26.764 1.00 0.00 H new ATOM 0 HD22 LEU A 37 32.767 17.886 25.504 1.00 0.00 H new ATOM 0 HD23 LEU A 37 32.790 17.402 27.217 1.00 0.00 H new ATOM 627 N SER A 38 37.175 15.602 23.844 1.00 0.00 N ATOM 628 CA SER A 38 38.131 15.908 22.770 1.00 0.00 C ATOM 629 C SER A 38 38.369 17.414 22.614 1.00 0.00 C ATOM 630 O SER A 38 37.441 18.227 22.691 1.00 0.00 O ATOM 631 CB SER A 38 37.684 15.305 21.430 1.00 0.00 C ATOM 632 OG SER A 38 38.565 15.712 20.390 1.00 0.00 O ATOM 0 H SER A 38 36.375 15.050 23.536 1.00 0.00 H new ATOM 0 HA SER A 38 39.075 15.449 23.063 1.00 0.00 H new ATOM 0 HB2 SER A 38 37.669 14.217 21.499 1.00 0.00 H new ATOM 0 HB3 SER A 38 36.667 15.624 21.201 1.00 0.00 H new ATOM 0 HG SER A 38 38.272 15.320 19.541 1.00 0.00 H new ATOM 638 N MET A 39 39.615 17.780 22.295 1.00 0.00 N ATOM 639 CA MET A 39 39.977 19.153 21.937 1.00 0.00 C ATOM 640 C MET A 39 39.142 19.670 20.749 1.00 0.00 C ATOM 641 O MET A 39 38.779 20.841 20.731 1.00 0.00 O ATOM 642 CB MET A 39 41.496 19.260 21.711 1.00 0.00 C ATOM 643 CG MET A 39 42.043 18.522 20.479 1.00 0.00 C ATOM 644 SD MET A 39 43.848 18.352 20.439 1.00 0.00 S ATOM 645 CE MET A 39 44.036 16.801 21.360 1.00 0.00 C ATOM 0 H MET A 39 40.401 17.130 22.278 1.00 0.00 H new ATOM 0 HA MET A 39 39.732 19.812 22.770 1.00 0.00 H new ATOM 0 HB2 MET A 39 41.758 20.315 21.625 1.00 0.00 H new ATOM 0 HB3 MET A 39 42.004 18.876 22.596 1.00 0.00 H new ATOM 0 HG2 MET A 39 41.597 17.528 20.440 1.00 0.00 H new ATOM 0 HG3 MET A 39 41.721 19.052 19.582 1.00 0.00 H new ATOM 0 HE1 MET A 39 45.093 16.546 21.431 1.00 0.00 H new ATOM 0 HE2 MET A 39 43.624 16.921 22.362 1.00 0.00 H new ATOM 0 HE3 MET A 39 43.504 16.003 20.842 1.00 0.00 H new ATOM 655 N SER A 40 38.739 18.801 19.814 1.00 0.00 N ATOM 656 CA SER A 40 37.816 19.144 18.720 1.00 0.00 C ATOM 657 C SER A 40 36.420 19.530 19.226 1.00 0.00 C ATOM 658 O SER A 40 35.847 20.536 18.799 1.00 0.00 O ATOM 659 CB SER A 40 37.729 17.947 17.776 1.00 0.00 C ATOM 660 OG SER A 40 36.785 18.157 16.752 1.00 0.00 O ATOM 0 H SER A 40 39.047 17.829 19.794 1.00 0.00 H new ATOM 0 HA SER A 40 38.205 20.019 18.200 1.00 0.00 H new ATOM 0 HB2 SER A 40 38.708 17.760 17.335 1.00 0.00 H new ATOM 0 HB3 SER A 40 37.459 17.056 18.343 1.00 0.00 H new ATOM 0 HG SER A 40 36.757 17.372 16.166 1.00 0.00 H new ATOM 666 N THR A 41 35.891 18.794 20.209 1.00 0.00 N ATOM 667 CA THR A 41 34.583 19.082 20.809 1.00 0.00 C ATOM 668 C THR A 41 34.585 20.451 21.489 1.00 0.00 C ATOM 669 O THR A 41 33.728 21.280 21.183 1.00 0.00 O ATOM 670 CB THR A 41 34.135 17.963 21.768 1.00 0.00 C ATOM 671 OG1 THR A 41 34.216 16.737 21.080 1.00 0.00 O ATOM 672 CG2 THR A 41 32.689 18.149 22.222 1.00 0.00 C ATOM 0 H THR A 41 36.358 17.981 20.612 1.00 0.00 H new ATOM 0 HA THR A 41 33.848 19.115 20.005 1.00 0.00 H new ATOM 0 HB THR A 41 34.781 17.987 22.646 1.00 0.00 H new ATOM 0 HG1 THR A 41 33.936 16.009 21.674 1.00 0.00 H new ATOM 0 HG21 THR A 41 32.412 17.339 22.897 1.00 0.00 H new ATOM 0 HG22 THR A 41 32.590 19.103 22.740 1.00 0.00 H new ATOM 0 HG23 THR A 41 32.031 18.138 21.353 1.00 0.00 H new ATOM 680 N VAL A 42 35.589 20.748 22.326 1.00 0.00 N ATOM 681 CA VAL A 42 35.676 22.059 23.000 1.00 0.00 C ATOM 682 C VAL A 42 35.973 23.214 22.040 1.00 0.00 C ATOM 683 O VAL A 42 35.492 24.322 22.263 1.00 0.00 O ATOM 684 CB VAL A 42 36.646 22.020 24.194 1.00 0.00 C ATOM 685 CG1 VAL A 42 38.098 21.719 23.836 1.00 0.00 C ATOM 686 CG2 VAL A 42 36.611 23.333 24.977 1.00 0.00 C ATOM 0 H VAL A 42 36.349 20.106 22.554 1.00 0.00 H new ATOM 0 HA VAL A 42 34.683 22.265 23.399 1.00 0.00 H new ATOM 0 HB VAL A 42 36.284 21.188 24.798 1.00 0.00 H new ATOM 0 HG11 VAL A 42 38.703 21.713 24.743 1.00 0.00 H new ATOM 0 HG12 VAL A 42 38.159 20.744 23.353 1.00 0.00 H new ATOM 0 HG13 VAL A 42 38.471 22.485 23.156 1.00 0.00 H new ATOM 0 HG21 VAL A 42 37.306 23.276 25.814 1.00 0.00 H new ATOM 0 HG22 VAL A 42 36.899 24.155 24.322 1.00 0.00 H new ATOM 0 HG23 VAL A 42 35.603 23.505 25.354 1.00 0.00 H new ATOM 696 N ARG A 43 36.698 22.966 20.939 1.00 0.00 N ATOM 697 CA ARG A 43 36.897 23.938 19.841 1.00 0.00 C ATOM 698 C ARG A 43 35.585 24.300 19.153 1.00 0.00 C ATOM 699 O ARG A 43 35.307 25.486 18.983 1.00 0.00 O ATOM 700 CB ARG A 43 37.897 23.392 18.811 1.00 0.00 C ATOM 701 CG ARG A 43 39.333 23.489 19.337 1.00 0.00 C ATOM 702 CD ARG A 43 40.283 22.540 18.610 1.00 0.00 C ATOM 703 NE ARG A 43 40.663 23.052 17.285 1.00 0.00 N ATOM 704 CZ ARG A 43 41.885 23.157 16.809 1.00 0.00 C ATOM 705 NH1 ARG A 43 42.903 22.788 17.529 1.00 0.00 N ATOM 706 NH2 ARG A 43 42.085 23.641 15.629 1.00 0.00 N ATOM 0 H ARG A 43 37.170 22.076 20.779 1.00 0.00 H new ATOM 0 HA ARG A 43 37.300 24.847 20.287 1.00 0.00 H new ATOM 0 HB2 ARG A 43 37.659 22.353 18.582 1.00 0.00 H new ATOM 0 HB3 ARG A 43 37.808 23.952 17.880 1.00 0.00 H new ATOM 0 HG2 ARG A 43 39.690 24.513 19.225 1.00 0.00 H new ATOM 0 HG3 ARG A 43 39.343 23.263 20.403 1.00 0.00 H new ATOM 0 HD2 ARG A 43 41.179 22.392 19.212 1.00 0.00 H new ATOM 0 HD3 ARG A 43 39.808 21.565 18.500 1.00 0.00 H new ATOM 0 HE ARG A 43 39.904 23.356 16.675 1.00 0.00 H new ATOM 0 HH11 ARG A 43 42.756 22.415 18.467 1.00 0.00 H new ATOM 0 HH12 ARG A 43 43.849 22.871 17.156 1.00 0.00 H new ATOM 0 HH21 ARG A 43 41.294 23.944 15.061 1.00 0.00 H new ATOM 0 HH22 ARG A 43 43.034 23.720 15.264 1.00 0.00 H new ATOM 720 N ARG A 44 34.755 23.312 18.807 1.00 0.00 N ATOM 721 CA ARG A 44 33.417 23.529 18.222 1.00 0.00 C ATOM 722 C ARG A 44 32.527 24.347 19.164 1.00 0.00 C ATOM 723 O ARG A 44 31.966 25.358 18.741 1.00 0.00 O ATOM 724 CB ARG A 44 32.792 22.173 17.848 1.00 0.00 C ATOM 725 CG ARG A 44 33.445 21.570 16.589 1.00 0.00 C ATOM 726 CD ARG A 44 33.169 20.071 16.405 1.00 0.00 C ATOM 727 NE ARG A 44 31.732 19.751 16.266 1.00 0.00 N ATOM 728 CZ ARG A 44 30.929 19.277 17.203 1.00 0.00 C ATOM 729 NH1 ARG A 44 31.382 19.044 18.398 1.00 0.00 N ATOM 730 NH2 ARG A 44 29.683 19.035 16.936 1.00 0.00 N ATOM 0 H ARG A 44 34.990 22.326 18.924 1.00 0.00 H new ATOM 0 HA ARG A 44 33.513 24.117 17.309 1.00 0.00 H new ATOM 0 HB2 ARG A 44 32.902 21.480 18.682 1.00 0.00 H new ATOM 0 HB3 ARG A 44 31.723 22.300 17.678 1.00 0.00 H new ATOM 0 HG2 ARG A 44 33.084 22.107 15.712 1.00 0.00 H new ATOM 0 HG3 ARG A 44 34.522 21.728 16.639 1.00 0.00 H new ATOM 0 HD2 ARG A 44 33.700 19.717 15.521 1.00 0.00 H new ATOM 0 HD3 ARG A 44 33.574 19.527 17.259 1.00 0.00 H new ATOM 0 HE ARG A 44 31.316 19.913 15.349 1.00 0.00 H new ATOM 0 HH11 ARG A 44 32.361 19.227 18.617 1.00 0.00 H new ATOM 0 HH12 ARG A 44 30.758 18.678 19.118 1.00 0.00 H new ATOM 0 HH21 ARG A 44 29.319 19.210 16.000 1.00 0.00 H new ATOM 0 HH22 ARG A 44 29.067 18.669 17.662 1.00 0.00 H new ATOM 744 N SER A 45 32.484 23.999 20.452 1.00 0.00 N ATOM 745 CA SER A 45 31.736 24.767 21.457 1.00 0.00 C ATOM 746 C SER A 45 32.292 26.184 21.677 1.00 0.00 C ATOM 747 O SER A 45 31.512 27.129 21.693 1.00 0.00 O ATOM 748 CB SER A 45 31.687 24.006 22.780 1.00 0.00 C ATOM 749 OG SER A 45 31.065 22.751 22.586 1.00 0.00 O ATOM 0 H SER A 45 32.963 23.181 20.829 1.00 0.00 H new ATOM 0 HA SER A 45 30.726 24.887 21.065 1.00 0.00 H new ATOM 0 HB2 SER A 45 32.696 23.866 23.168 1.00 0.00 H new ATOM 0 HB3 SER A 45 31.137 24.584 23.523 1.00 0.00 H new ATOM 0 HG SER A 45 30.220 22.876 22.106 1.00 0.00 H new ATOM 755 N ILE A 46 33.615 26.389 21.759 1.00 0.00 N ATOM 756 CA ILE A 46 34.222 27.739 21.797 1.00 0.00 C ATOM 757 C ILE A 46 33.890 28.550 20.538 1.00 0.00 C ATOM 758 O ILE A 46 33.612 29.742 20.654 1.00 0.00 O ATOM 759 CB ILE A 46 35.756 27.658 22.030 1.00 0.00 C ATOM 760 CG1 ILE A 46 36.079 27.195 23.472 1.00 0.00 C ATOM 761 CG2 ILE A 46 36.524 28.956 21.710 1.00 0.00 C ATOM 762 CD1 ILE A 46 36.108 28.260 24.561 1.00 0.00 C ATOM 0 H ILE A 46 34.296 25.631 21.801 1.00 0.00 H new ATOM 0 HA ILE A 46 33.783 28.268 22.643 1.00 0.00 H new ATOM 0 HB ILE A 46 36.106 26.915 21.314 1.00 0.00 H new ATOM 0 HG12 ILE A 46 35.344 26.442 23.757 1.00 0.00 H new ATOM 0 HG13 ILE A 46 37.051 26.702 23.458 1.00 0.00 H new ATOM 0 HG21 ILE A 46 37.587 28.807 21.902 1.00 0.00 H new ATOM 0 HG22 ILE A 46 36.378 29.216 20.662 1.00 0.00 H new ATOM 0 HG23 ILE A 46 36.152 29.764 22.340 1.00 0.00 H new ATOM 0 HD11 ILE A 46 36.346 27.796 25.518 1.00 0.00 H new ATOM 0 HD12 ILE A 46 36.866 29.005 24.321 1.00 0.00 H new ATOM 0 HD13 ILE A 46 35.132 28.742 24.625 1.00 0.00 H new ATOM 774 N LYS A 47 33.845 27.925 19.351 1.00 0.00 N ATOM 775 CA LYS A 47 33.506 28.593 18.083 1.00 0.00 C ATOM 776 C LYS A 47 32.038 29.040 18.064 1.00 0.00 C ATOM 777 O LYS A 47 31.751 30.163 17.656 1.00 0.00 O ATOM 778 CB LYS A 47 33.896 27.686 16.897 1.00 0.00 C ATOM 779 CG LYS A 47 33.967 28.474 15.575 1.00 0.00 C ATOM 780 CD LYS A 47 34.536 27.680 14.383 1.00 0.00 C ATOM 781 CE LYS A 47 35.982 27.208 14.602 1.00 0.00 C ATOM 782 NZ LYS A 47 36.660 26.905 13.318 1.00 0.00 N1+ ATOM 0 H LYS A 47 34.045 26.931 19.243 1.00 0.00 H new ATOM 0 HA LYS A 47 34.086 29.511 17.985 1.00 0.00 H new ATOM 0 HB2 LYS A 47 34.862 27.222 17.096 1.00 0.00 H new ATOM 0 HB3 LYS A 47 33.169 26.880 16.801 1.00 0.00 H new ATOM 0 HG2 LYS A 47 32.965 28.819 15.319 1.00 0.00 H new ATOM 0 HG3 LYS A 47 34.581 29.362 15.729 1.00 0.00 H new ATOM 0 HD2 LYS A 47 33.902 26.813 14.197 1.00 0.00 H new ATOM 0 HD3 LYS A 47 34.496 28.302 13.489 1.00 0.00 H new ATOM 0 HE2 LYS A 47 36.539 27.978 15.135 1.00 0.00 H new ATOM 0 HE3 LYS A 47 35.983 26.319 15.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 37.633 26.590 13.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 36.142 26.153 12.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 36.681 27.760 12.726 1.00 0.00 H new ATOM 796 N LYS A 48 31.131 28.232 18.628 1.00 0.00 N ATOM 797 CA LYS A 48 29.755 28.638 18.972 1.00 0.00 C ATOM 798 C LYS A 48 29.713 29.755 20.026 1.00 0.00 C ATOM 799 O LYS A 48 28.958 30.712 19.867 1.00 0.00 O ATOM 800 CB LYS A 48 28.972 27.405 19.454 1.00 0.00 C ATOM 801 CG LYS A 48 28.420 26.567 18.292 1.00 0.00 C ATOM 802 CD LYS A 48 27.580 25.399 18.826 1.00 0.00 C ATOM 803 CE LYS A 48 26.915 24.637 17.675 1.00 0.00 C ATOM 804 NZ LYS A 48 26.034 23.565 18.189 1.00 0.00 N1+ ATOM 0 H LYS A 48 31.333 27.260 18.864 1.00 0.00 H new ATOM 0 HA LYS A 48 29.291 29.048 18.075 1.00 0.00 H new ATOM 0 HB2 LYS A 48 29.623 26.783 20.069 1.00 0.00 H new ATOM 0 HB3 LYS A 48 28.147 27.728 20.089 1.00 0.00 H new ATOM 0 HG2 LYS A 48 27.811 27.194 17.641 1.00 0.00 H new ATOM 0 HG3 LYS A 48 29.243 26.185 17.688 1.00 0.00 H new ATOM 0 HD2 LYS A 48 28.213 24.722 19.399 1.00 0.00 H new ATOM 0 HD3 LYS A 48 26.817 25.775 19.508 1.00 0.00 H new ATOM 0 HE2 LYS A 48 26.335 25.328 17.064 1.00 0.00 H new ATOM 0 HE3 LYS A 48 27.680 24.206 17.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 25.595 23.063 17.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 26.595 22.895 18.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 25.291 23.982 18.786 1.00 0.00 H new ATOM 818 N PHE A 49 30.627 29.707 20.999 1.00 0.00 N ATOM 819 CA PHE A 49 30.694 30.695 22.093 1.00 0.00 C ATOM 820 C PHE A 49 30.912 32.106 21.546 1.00 0.00 C ATOM 821 O PHE A 49 30.358 33.080 22.054 1.00 0.00 O ATOM 822 CB PHE A 49 31.815 30.336 23.070 1.00 0.00 C ATOM 823 CG PHE A 49 31.509 29.145 23.933 1.00 0.00 C ATOM 824 CD1 PHE A 49 30.294 28.489 23.825 1.00 0.00 C ATOM 825 CD2 PHE A 49 32.435 28.683 24.853 1.00 0.00 C ATOM 826 CE1 PHE A 49 30.008 27.393 24.618 1.00 0.00 C ATOM 827 CE2 PHE A 49 32.156 27.588 25.649 1.00 0.00 C ATOM 828 CZ PHE A 49 30.941 26.942 25.531 1.00 0.00 C ATOM 0 H PHE A 49 31.344 28.984 21.056 1.00 0.00 H new ATOM 0 HA PHE A 49 29.741 30.674 22.622 1.00 0.00 H new ATOM 0 HB2 PHE A 49 32.727 30.140 22.506 1.00 0.00 H new ATOM 0 HB3 PHE A 49 32.015 31.195 23.710 1.00 0.00 H new ATOM 0 HD1 PHE A 49 29.561 28.838 23.113 1.00 0.00 H new ATOM 0 HD2 PHE A 49 33.387 29.184 24.950 1.00 0.00 H new ATOM 0 HE1 PHE A 49 29.057 26.890 24.524 1.00 0.00 H new ATOM 0 HE2 PHE A 49 32.887 27.238 26.362 1.00 0.00 H new ATOM 0 HZ PHE A 49 30.721 26.086 26.151 1.00 0.00 H new ATOM 838 N LEU A 50 31.727 32.191 20.506 1.00 0.00 N ATOM 839 CA LEU A 50 31.974 33.461 19.803 1.00 0.00 C ATOM 840 C LEU A 50 30.668 34.163 19.400 1.00 0.00 C ATOM 841 O LEU A 50 30.568 35.389 19.498 1.00 0.00 O ATOM 842 CB LEU A 50 32.823 33.246 18.541 1.00 0.00 C ATOM 843 CG LEU A 50 34.160 32.510 18.740 1.00 0.00 C ATOM 844 CD1 LEU A 50 34.916 32.453 17.420 1.00 0.00 C ATOM 845 CD2 LEU A 50 35.085 33.180 19.754 1.00 0.00 C ATOM 0 H LEU A 50 32.236 31.396 20.121 1.00 0.00 H new ATOM 0 HA LEU A 50 32.514 34.094 20.507 1.00 0.00 H new ATOM 0 HB2 LEU A 50 32.228 32.687 17.819 1.00 0.00 H new ATOM 0 HB3 LEU A 50 33.030 34.220 18.097 1.00 0.00 H new ATOM 0 HG LEU A 50 33.897 31.521 19.114 1.00 0.00 H new ATOM 0 HD11 LEU A 50 35.862 31.931 17.565 1.00 0.00 H new ATOM 0 HD12 LEU A 50 34.318 31.921 16.681 1.00 0.00 H new ATOM 0 HD13 LEU A 50 35.111 33.466 17.068 1.00 0.00 H new ATOM 0 HD21 LEU A 50 36.007 32.605 19.841 1.00 0.00 H new ATOM 0 HD22 LEU A 50 35.318 34.191 19.421 1.00 0.00 H new ATOM 0 HD23 LEU A 50 34.591 33.223 20.725 1.00 0.00 H new ATOM 857 N GLU A 51 29.742 33.389 18.838 1.00 0.00 N ATOM 858 CA GLU A 51 28.425 33.878 18.428 1.00 0.00 C ATOM 859 C GLU A 51 27.579 34.293 19.632 1.00 0.00 C ATOM 860 O GLU A 51 26.848 35.283 19.593 1.00 0.00 O ATOM 861 CB GLU A 51 27.690 32.806 17.622 1.00 0.00 C ATOM 862 CG GLU A 51 28.403 32.400 16.341 1.00 0.00 C ATOM 863 CD GLU A 51 28.599 33.564 15.390 1.00 0.00 C ATOM 864 OE1 GLU A 51 29.209 33.361 14.319 1.00 0.00 O ATOM 865 OE2 GLU A 51 28.144 34.681 15.713 1.00 0.00 O ATOM 0 H GLU A 51 29.885 32.396 18.652 1.00 0.00 H new ATOM 0 HA GLU A 51 28.580 34.759 17.805 1.00 0.00 H new ATOM 0 HB2 GLU A 51 27.557 31.923 18.247 1.00 0.00 H new ATOM 0 HB3 GLU A 51 26.695 33.173 17.371 1.00 0.00 H new ATOM 0 HG2 GLU A 51 29.374 31.971 16.590 1.00 0.00 H new ATOM 0 HG3 GLU A 51 27.829 31.620 15.841 1.00 0.00 H new ATOM 872 N LEU A 52 27.660 33.532 20.719 1.00 0.00 N ATOM 873 CA LEU A 52 26.882 33.814 21.938 1.00 0.00 C ATOM 874 C LEU A 52 27.243 35.158 22.579 1.00 0.00 C ATOM 875 O LEU A 52 26.395 35.873 23.113 1.00 0.00 O ATOM 876 CB LEU A 52 27.085 32.693 22.959 1.00 0.00 C ATOM 877 CG LEU A 52 26.769 31.280 22.466 1.00 0.00 C ATOM 878 CD1 LEU A 52 27.139 30.251 23.523 1.00 0.00 C ATOM 879 CD2 LEU A 52 25.300 31.161 22.087 1.00 0.00 C ATOM 0 H LEU A 52 28.258 32.709 20.788 1.00 0.00 H new ATOM 0 HA LEU A 52 25.836 33.869 21.636 1.00 0.00 H new ATOM 0 HB2 LEU A 52 28.121 32.717 23.296 1.00 0.00 H new ATOM 0 HB3 LEU A 52 26.462 32.902 23.829 1.00 0.00 H new ATOM 0 HG LEU A 52 27.366 31.084 21.576 1.00 0.00 H new ATOM 0 HD11 LEU A 52 26.907 29.252 23.155 1.00 0.00 H new ATOM 0 HD12 LEU A 52 28.205 30.320 23.740 1.00 0.00 H new ATOM 0 HD13 LEU A 52 26.570 30.443 24.433 1.00 0.00 H new ATOM 0 HD21 LEU A 52 25.095 30.149 21.739 1.00 0.00 H new ATOM 0 HD22 LEU A 52 24.681 31.378 22.958 1.00 0.00 H new ATOM 0 HD23 LEU A 52 25.070 31.871 21.293 1.00 0.00 H new ATOM 891 N GLN A 53 28.528 35.464 22.505 1.00 0.00 N ATOM 892 CA GLN A 53 29.194 36.670 23.062 1.00 0.00 C ATOM 893 C GLN A 53 29.851 36.363 24.404 1.00 0.00 C ATOM 894 O GLN A 53 30.510 37.221 24.991 1.00 0.00 O ATOM 895 CB GLN A 53 28.349 37.965 23.102 1.00 0.00 C ATOM 896 CG GLN A 53 27.880 38.442 21.737 1.00 0.00 C ATOM 897 CD GLN A 53 27.016 39.687 21.819 1.00 0.00 C ATOM 898 OE1 GLN A 53 26.902 40.440 20.852 1.00 0.00 O ATOM 899 NE2 GLN A 53 26.403 39.910 22.977 1.00 0.00 N ATOM 0 H GLN A 53 29.190 34.851 22.029 1.00 0.00 H new ATOM 0 HA GLN A 53 29.968 36.911 22.333 1.00 0.00 H new ATOM 0 HB2 GLN A 53 27.478 37.798 23.736 1.00 0.00 H new ATOM 0 HB3 GLN A 53 28.937 38.755 23.569 1.00 0.00 H new ATOM 0 HG2 GLN A 53 28.748 38.647 21.110 1.00 0.00 H new ATOM 0 HG3 GLN A 53 27.317 37.645 21.251 1.00 0.00 H new ATOM 0 HE21 GLN A 53 26.526 39.259 23.753 1.00 0.00 H new ATOM 0 HE22 GLN A 53 25.810 40.732 23.090 1.00 0.00 H new ATOM 908 N TYR A 54 29.672 35.136 24.883 1.00 0.00 N ATOM 909 CA TYR A 54 30.384 34.720 26.092 1.00 0.00 C ATOM 910 C TYR A 54 31.905 34.691 25.923 1.00 0.00 C ATOM 911 O TYR A 54 32.613 34.986 26.880 1.00 0.00 O ATOM 912 CB TYR A 54 29.882 33.333 26.524 1.00 0.00 C ATOM 913 CG TYR A 54 28.379 33.205 26.714 1.00 0.00 C ATOM 914 CD1 TYR A 54 27.616 34.288 27.198 1.00 0.00 C ATOM 915 CD2 TYR A 54 27.742 31.988 26.401 1.00 0.00 C ATOM 916 CE1 TYR A 54 26.225 34.172 27.359 1.00 0.00 C ATOM 917 CE2 TYR A 54 26.349 31.869 26.546 1.00 0.00 C ATOM 918 CZ TYR A 54 25.588 32.962 27.006 1.00 0.00 C ATOM 919 OH TYR A 54 24.241 32.830 27.092 1.00 0.00 O ATOM 0 H TYR A 54 29.061 34.431 24.471 1.00 0.00 H new ATOM 0 HA TYR A 54 30.173 35.465 26.859 1.00 0.00 H new ATOM 0 HB2 TYR A 54 30.199 32.604 25.778 1.00 0.00 H new ATOM 0 HB3 TYR A 54 30.372 33.065 27.460 1.00 0.00 H new ATOM 0 HD1 TYR A 54 28.107 35.217 27.448 1.00 0.00 H new ATOM 0 HD2 TYR A 54 28.323 31.148 26.050 1.00 0.00 H new ATOM 0 HE1 TYR A 54 25.649 34.999 27.748 1.00 0.00 H new ATOM 0 HE2 TYR A 54 25.860 30.937 26.304 1.00 0.00 H new ATOM 0 HH TYR A 54 23.982 31.929 26.807 1.00 0.00 H new ATOM 929 N VAL A 55 32.415 34.336 24.737 1.00 0.00 N ATOM 930 CA VAL A 55 33.856 34.163 24.467 1.00 0.00 C ATOM 931 C VAL A 55 34.259 34.964 23.231 1.00 0.00 C ATOM 932 O VAL A 55 33.444 35.240 22.352 1.00 0.00 O ATOM 933 CB VAL A 55 34.245 32.671 24.307 1.00 0.00 C ATOM 934 CG1 VAL A 55 35.704 32.369 23.948 1.00 0.00 C ATOM 935 CG2 VAL A 55 33.934 31.873 25.583 1.00 0.00 C ATOM 0 H VAL A 55 31.831 34.157 23.920 1.00 0.00 H new ATOM 0 HA VAL A 55 34.402 34.543 25.331 1.00 0.00 H new ATOM 0 HB VAL A 55 33.637 32.371 23.454 1.00 0.00 H new ATOM 0 HG11 VAL A 55 35.843 31.291 23.866 1.00 0.00 H new ATOM 0 HG12 VAL A 55 35.949 32.840 22.996 1.00 0.00 H new ATOM 0 HG13 VAL A 55 36.359 32.761 24.726 1.00 0.00 H new ATOM 0 HG21 VAL A 55 34.218 30.831 25.439 1.00 0.00 H new ATOM 0 HG22 VAL A 55 34.496 32.290 26.419 1.00 0.00 H new ATOM 0 HG23 VAL A 55 32.867 31.932 25.798 1.00 0.00 H new ATOM 945 N LYS A 56 35.545 35.289 23.142 1.00 0.00 N ATOM 946 CA LYS A 56 36.203 35.897 21.969 1.00 0.00 C ATOM 947 C LYS A 56 37.695 35.547 21.902 1.00 0.00 C ATOM 948 O LYS A 56 38.284 35.099 22.883 1.00 0.00 O ATOM 949 CB LYS A 56 35.931 37.421 21.926 1.00 0.00 C ATOM 950 CG LYS A 56 35.407 37.931 20.566 1.00 0.00 C ATOM 951 CD LYS A 56 34.039 37.342 20.163 1.00 0.00 C ATOM 952 CE LYS A 56 33.446 38.034 18.929 1.00 0.00 C ATOM 953 NZ LYS A 56 32.129 37.457 18.559 1.00 0.00 N1+ ATOM 0 H LYS A 56 36.193 35.133 23.914 1.00 0.00 H new ATOM 0 HA LYS A 56 35.765 35.468 21.068 1.00 0.00 H new ATOM 0 HB2 LYS A 56 35.205 37.671 22.700 1.00 0.00 H new ATOM 0 HB3 LYS A 56 36.852 37.950 22.170 1.00 0.00 H new ATOM 0 HG2 LYS A 56 35.327 39.017 20.603 1.00 0.00 H new ATOM 0 HG3 LYS A 56 36.137 37.691 19.793 1.00 0.00 H new ATOM 0 HD2 LYS A 56 34.150 36.277 19.961 1.00 0.00 H new ATOM 0 HD3 LYS A 56 33.345 37.437 20.998 1.00 0.00 H new ATOM 0 HE2 LYS A 56 33.334 39.100 19.128 1.00 0.00 H new ATOM 0 HE3 LYS A 56 34.135 37.937 18.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 32.157 37.133 17.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 31.915 36.652 19.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 31.391 38.182 18.665 1.00 0.00 H new ATOM 967 N GLU A 57 38.289 35.740 20.728 1.00 0.00 N ATOM 968 CA GLU A 57 39.698 35.430 20.518 1.00 0.00 C ATOM 969 C GLU A 57 40.491 36.667 20.071 1.00 0.00 C ATOM 970 O GLU A 57 40.041 37.402 19.192 1.00 0.00 O ATOM 971 CB GLU A 57 39.841 34.324 19.471 1.00 0.00 C ATOM 972 CG GLU A 57 39.859 34.830 18.038 1.00 0.00 C ATOM 973 CD GLU A 57 40.110 33.724 17.032 1.00 0.00 C ATOM 974 OE1 GLU A 57 40.603 32.650 17.437 1.00 0.00 O ATOM 975 OE2 GLU A 57 39.816 33.929 15.835 1.00 0.00 O ATOM 0 H GLU A 57 37.814 36.111 19.905 1.00 0.00 H new ATOM 0 HA GLU A 57 40.107 35.092 21.470 1.00 0.00 H new ATOM 0 HB2 GLU A 57 40.762 33.773 19.663 1.00 0.00 H new ATOM 0 HB3 GLU A 57 39.018 33.619 19.587 1.00 0.00 H new ATOM 0 HG2 GLU A 57 38.906 35.310 17.814 1.00 0.00 H new ATOM 0 HG3 GLU A 57 40.632 35.592 17.935 1.00 0.00 H new ATOM 982 N GLY A 58 41.662 36.901 20.665 1.00 0.00 N ATOM 983 CA GLY A 58 42.484 38.042 20.305 1.00 0.00 C ATOM 984 C GLY A 58 43.842 37.589 19.782 1.00 0.00 C ATOM 985 O GLY A 58 44.465 36.715 20.385 1.00 0.00 O ATOM 0 H GLY A 58 42.057 36.311 21.397 1.00 0.00 H new ATOM 0 HA2 GLY A 58 41.976 38.636 19.545 1.00 0.00 H new ATOM 0 HA3 GLY A 58 42.620 38.686 21.174 1.00 0.00 H new ATOM 989 N CYS A 59 44.313 38.164 18.675 1.00 0.00 N ATOM 990 CA CYS A 59 45.601 37.772 18.112 1.00 0.00 C ATOM 991 C CYS A 59 46.742 38.528 18.789 1.00 0.00 C ATOM 992 O CYS A 59 47.235 39.530 18.271 1.00 0.00 O ATOM 993 CB CYS A 59 45.625 38.041 16.606 1.00 0.00 C ATOM 994 SG CYS A 59 44.380 37.125 15.668 1.00 0.00 S ATOM 0 H CYS A 59 43.826 38.895 18.156 1.00 0.00 H new ATOM 0 HA CYS A 59 45.737 36.705 18.288 1.00 0.00 H new ATOM 0 HB2 CYS A 59 45.479 39.108 16.437 1.00 0.00 H new ATOM 0 HB3 CYS A 59 46.613 37.789 16.219 1.00 0.00 H new ATOM 0 HG CYS A 59 44.481 37.423 14.407 1.00 0.00 H new ATOM 1000 N LYS A 60 47.166 38.026 19.945 1.00 0.00 N ATOM 1001 CA LYS A 60 48.277 38.618 20.680 1.00 0.00 C ATOM 1002 C LYS A 60 49.575 38.365 19.908 1.00 0.00 C ATOM 1003 O LYS A 60 49.727 37.319 19.278 1.00 0.00 O ATOM 1004 CB LYS A 60 48.372 38.021 22.084 1.00 0.00 C ATOM 1005 CG LYS A 60 47.131 38.238 22.933 1.00 0.00 C ATOM 1006 CD LYS A 60 46.834 39.717 23.118 1.00 0.00 C ATOM 1007 CE LYS A 60 45.597 39.934 23.975 1.00 0.00 C ATOM 1008 NZ LYS A 60 45.304 41.380 24.176 1.00 0.00 N1+ ATOM 0 H LYS A 60 46.755 37.208 20.394 1.00 0.00 H new ATOM 0 HA LYS A 60 48.112 39.691 20.780 1.00 0.00 H new ATOM 0 HB2 LYS A 60 48.560 36.951 22.001 1.00 0.00 H new ATOM 0 HB3 LYS A 60 49.230 38.456 22.596 1.00 0.00 H new ATOM 0 HG2 LYS A 60 46.277 37.751 22.462 1.00 0.00 H new ATOM 0 HG3 LYS A 60 47.269 37.769 23.907 1.00 0.00 H new ATOM 0 HD2 LYS A 60 47.690 40.206 23.583 1.00 0.00 H new ATOM 0 HD3 LYS A 60 46.690 40.185 22.144 1.00 0.00 H new ATOM 0 HE2 LYS A 60 44.740 39.453 23.503 1.00 0.00 H new ATOM 0 HE3 LYS A 60 45.738 39.455 24.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 44.453 41.483 24.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 46.110 41.835 24.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 45.143 41.833 23.254 1.00 0.00 H new ATOM 1022 N GLN A 61 50.508 39.313 19.955 1.00 0.00 N ATOM 1023 CA GLN A 61 51.775 39.177 19.241 1.00 0.00 C ATOM 1024 C GLN A 61 52.665 38.070 19.835 1.00 0.00 C ATOM 1025 O GLN A 61 52.694 37.887 21.052 1.00 0.00 O ATOM 1026 CB GLN A 61 52.525 40.512 19.263 1.00 0.00 C ATOM 1027 CG GLN A 61 53.829 40.515 18.483 1.00 0.00 C ATOM 1028 CD GLN A 61 54.508 41.871 18.484 1.00 0.00 C ATOM 1029 OE1 GLN A 61 53.914 42.875 18.877 1.00 0.00 O ATOM 1030 NE2 GLN A 61 55.760 41.906 18.043 1.00 0.00 N ATOM 0 H GLN A 61 50.411 40.183 20.479 1.00 0.00 H new ATOM 0 HA GLN A 61 51.544 38.893 18.214 1.00 0.00 H new ATOM 0 HB2 GLN A 61 51.873 41.287 18.860 1.00 0.00 H new ATOM 0 HB3 GLN A 61 52.735 40.779 20.299 1.00 0.00 H new ATOM 0 HG2 GLN A 61 54.505 39.774 18.910 1.00 0.00 H new ATOM 0 HG3 GLN A 61 53.633 40.212 17.454 1.00 0.00 H new ATOM 0 HE21 GLN A 61 56.213 41.049 17.727 1.00 0.00 H new ATOM 0 HE22 GLN A 61 56.268 42.790 18.021 1.00 0.00 H new ATOM 1039 N GLY A 62 53.387 37.337 18.984 1.00 0.00 N ATOM 1040 CA GLY A 62 54.292 36.273 19.405 1.00 0.00 C ATOM 1041 C GLY A 62 53.717 34.947 19.890 1.00 0.00 C ATOM 1042 O GLY A 62 53.999 33.907 19.295 1.00 0.00 O ATOM 0 H GLY A 62 53.357 37.470 17.973 1.00 0.00 H new ATOM 0 HA2 GLY A 62 54.953 36.055 18.566 1.00 0.00 H new ATOM 0 HA3 GLY A 62 54.915 36.672 20.206 1.00 0.00 H new ATOM 1046 N ILE A 63 52.919 34.964 20.954 1.00 0.00 N ATOM 1047 CA ILE A 63 52.318 33.749 21.493 1.00 0.00 C ATOM 1048 C ILE A 63 51.191 33.231 20.606 1.00 0.00 C ATOM 1049 O ILE A 63 50.654 33.965 19.776 1.00 0.00 O ATOM 1050 CB ILE A 63 51.757 33.984 22.908 1.00 0.00 C ATOM 1051 CG1 ILE A 63 50.630 35.018 22.866 1.00 0.00 C ATOM 1052 CG2 ILE A 63 52.862 34.439 23.848 1.00 0.00 C ATOM 1053 CD1 ILE A 63 50.016 35.303 24.219 1.00 0.00 C ATOM 0 H ILE A 63 52.673 35.813 21.463 1.00 0.00 H new ATOM 0 HA ILE A 63 53.114 33.005 21.530 1.00 0.00 H new ATOM 0 HB ILE A 63 51.352 33.044 23.283 1.00 0.00 H new ATOM 0 HG12 ILE A 63 51.017 35.948 22.449 1.00 0.00 H new ATOM 0 HG13 ILE A 63 49.851 34.666 22.190 1.00 0.00 H new ATOM 0 HG21 ILE A 63 52.449 34.601 24.844 1.00 0.00 H new ATOM 0 HG22 ILE A 63 53.637 33.674 23.896 1.00 0.00 H new ATOM 0 HG23 ILE A 63 53.294 35.369 23.479 1.00 0.00 H new ATOM 0 HD11 ILE A 63 49.225 36.045 24.111 1.00 0.00 H new ATOM 0 HD12 ILE A 63 49.598 34.384 24.630 1.00 0.00 H new ATOM 0 HD13 ILE A 63 50.782 35.686 24.893 1.00 0.00 H new ATOM 1065 N SER A 64 50.834 31.964 20.788 1.00 0.00 N ATOM 1066 CA SER A 64 49.743 31.376 19.988 1.00 0.00 C ATOM 1067 C SER A 64 48.373 31.992 20.342 1.00 0.00 C ATOM 1068 O SER A 64 48.199 32.567 21.421 1.00 0.00 O ATOM 1069 CB SER A 64 49.736 29.854 20.192 1.00 0.00 C ATOM 1070 OG SER A 64 48.738 29.218 19.420 1.00 0.00 O ATOM 0 H SER A 64 51.265 31.331 21.462 1.00 0.00 H new ATOM 0 HA SER A 64 49.921 31.601 18.936 1.00 0.00 H new ATOM 0 HB2 SER A 64 50.712 29.449 19.926 1.00 0.00 H new ATOM 0 HB3 SER A 64 49.575 29.631 21.247 1.00 0.00 H new ATOM 0 HG SER A 64 48.769 28.251 19.578 1.00 0.00 H new ATOM 1076 N LYS A 65 47.383 31.876 19.443 1.00 0.00 N ATOM 1077 CA LYS A 65 46.009 32.370 19.658 1.00 0.00 C ATOM 1078 C LYS A 65 45.336 31.711 20.871 1.00 0.00 C ATOM 1079 O LYS A 65 45.509 30.526 21.142 1.00 0.00 O ATOM 1080 CB LYS A 65 45.164 32.200 18.383 1.00 0.00 C ATOM 1081 CG LYS A 65 44.966 30.730 17.982 1.00 0.00 C ATOM 1082 CD LYS A 65 44.103 30.532 16.721 1.00 0.00 C ATOM 1083 CE LYS A 65 44.669 31.060 15.387 1.00 0.00 C ATOM 1084 NZ LYS A 65 43.778 30.831 14.219 1.00 0.00 N1+ ATOM 0 H LYS A 65 47.513 31.431 18.534 1.00 0.00 H new ATOM 0 HA LYS A 65 46.078 33.434 19.882 1.00 0.00 H new ATOM 0 HB2 LYS A 65 44.189 32.663 18.536 1.00 0.00 H new ATOM 0 HB3 LYS A 65 45.644 32.733 17.562 1.00 0.00 H new ATOM 0 HG2 LYS A 65 45.943 30.275 17.816 1.00 0.00 H new ATOM 0 HG3 LYS A 65 44.504 30.197 18.813 1.00 0.00 H new ATOM 0 HD2 LYS A 65 43.911 29.465 16.607 1.00 0.00 H new ATOM 0 HD3 LYS A 65 43.140 31.012 16.893 1.00 0.00 H new ATOM 0 HE2 LYS A 65 44.858 32.129 15.482 1.00 0.00 H new ATOM 0 HE3 LYS A 65 45.630 30.582 15.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 44.225 31.212 13.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 43.616 29.811 14.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 42.868 31.310 14.377 1.00 0.00 H new ATOM 1098 N THR A 66 44.508 32.483 21.567 1.00 0.00 N ATOM 1099 CA THR A 66 43.860 32.077 22.823 1.00 0.00 C ATOM 1100 C THR A 66 42.515 32.776 23.001 1.00 0.00 C ATOM 1101 O THR A 66 42.234 33.746 22.296 1.00 0.00 O ATOM 1102 CB THR A 66 44.840 32.291 23.975 1.00 0.00 C ATOM 1103 OG1 THR A 66 44.343 31.699 25.145 1.00 0.00 O ATOM 1104 CG2 THR A 66 45.156 33.762 24.248 1.00 0.00 C ATOM 0 H THR A 66 44.259 33.428 21.274 1.00 0.00 H new ATOM 0 HA THR A 66 43.616 31.015 22.803 1.00 0.00 H new ATOM 0 HB THR A 66 45.773 31.818 23.669 1.00 0.00 H new ATOM 0 HG1 THR A 66 44.893 31.973 25.909 1.00 0.00 H new ATOM 0 HG21 THR A 66 45.858 33.835 25.079 1.00 0.00 H new ATOM 0 HG22 THR A 66 45.599 34.210 23.358 1.00 0.00 H new ATOM 0 HG23 THR A 66 44.237 34.291 24.502 1.00 0.00 H new ATOM 1112 N PHE A 67 41.652 32.263 23.879 1.00 0.00 N ATOM 1113 CA PHE A 67 40.230 32.631 23.930 1.00 0.00 C ATOM 1114 C PHE A 67 39.831 33.032 25.357 1.00 0.00 C ATOM 1115 O PHE A 67 40.105 32.293 26.302 1.00 0.00 O ATOM 1116 CB PHE A 67 39.360 31.510 23.312 1.00 0.00 C ATOM 1117 CG PHE A 67 39.836 31.058 21.935 1.00 0.00 C ATOM 1118 CD1 PHE A 67 41.032 30.317 21.824 1.00 0.00 C ATOM 1119 CD2 PHE A 67 39.138 31.421 20.763 1.00 0.00 C ATOM 1120 CE1 PHE A 67 41.568 30.012 20.562 1.00 0.00 C ATOM 1121 CE2 PHE A 67 39.635 31.037 19.502 1.00 0.00 C ATOM 1122 CZ PHE A 67 40.857 30.352 19.399 1.00 0.00 C ATOM 0 H PHE A 67 41.919 31.574 24.582 1.00 0.00 H new ATOM 0 HA PHE A 67 40.050 33.514 23.317 1.00 0.00 H new ATOM 0 HB2 PHE A 67 39.355 30.653 23.985 1.00 0.00 H new ATOM 0 HB3 PHE A 67 38.331 31.861 23.235 1.00 0.00 H new ATOM 0 HD1 PHE A 67 41.539 29.982 22.717 1.00 0.00 H new ATOM 0 HD2 PHE A 67 38.224 31.992 20.833 1.00 0.00 H new ATOM 0 HE1 PHE A 67 42.525 29.517 20.486 1.00 0.00 H new ATOM 0 HE2 PHE A 67 39.073 31.271 18.610 1.00 0.00 H new ATOM 0 HZ PHE A 67 41.249 30.087 18.428 1.00 0.00 H new ATOM 1132 N TYR A 68 39.246 34.225 25.511 1.00 0.00 N ATOM 1133 CA TYR A 68 38.888 34.853 26.793 1.00 0.00 C ATOM 1134 C TYR A 68 37.370 35.020 26.936 1.00 0.00 C ATOM 1135 O TYR A 68 36.639 34.889 25.956 1.00 0.00 O ATOM 1136 CB TYR A 68 39.605 36.205 26.944 1.00 0.00 C ATOM 1137 CG TYR A 68 39.073 37.312 26.052 1.00 0.00 C ATOM 1138 CD1 TYR A 68 37.901 38.007 26.415 1.00 0.00 C ATOM 1139 CD2 TYR A 68 39.758 37.653 24.867 1.00 0.00 C ATOM 1140 CE1 TYR A 68 37.422 39.045 25.596 1.00 0.00 C ATOM 1141 CE2 TYR A 68 39.281 38.696 24.049 1.00 0.00 C ATOM 1142 CZ TYR A 68 38.111 39.398 24.418 1.00 0.00 C ATOM 1143 OH TYR A 68 37.648 40.418 23.652 1.00 0.00 O ATOM 0 H TYR A 68 38.997 34.807 24.711 1.00 0.00 H new ATOM 0 HA TYR A 68 39.218 34.191 27.594 1.00 0.00 H new ATOM 0 HB2 TYR A 68 39.529 36.527 27.983 1.00 0.00 H new ATOM 0 HB3 TYR A 68 40.665 36.064 26.731 1.00 0.00 H new ATOM 0 HD1 TYR A 68 37.373 37.743 27.319 1.00 0.00 H new ATOM 0 HD2 TYR A 68 40.650 37.113 24.586 1.00 0.00 H new ATOM 0 HE1 TYR A 68 36.522 39.574 25.871 1.00 0.00 H new ATOM 0 HE2 TYR A 68 39.807 38.958 23.143 1.00 0.00 H new ATOM 0 HH TYR A 68 38.235 40.537 22.876 1.00 0.00 H new ATOM 1153 N ILE A 69 36.898 35.309 28.154 1.00 0.00 N ATOM 1154 CA ILE A 69 35.473 35.260 28.521 1.00 0.00 C ATOM 1155 C ILE A 69 34.986 36.631 29.015 1.00 0.00 C ATOM 1156 O ILE A 69 35.638 37.258 29.846 1.00 0.00 O ATOM 1157 CB ILE A 69 35.215 34.117 29.531 1.00 0.00 C ATOM 1158 CG1 ILE A 69 35.780 32.764 29.026 1.00 0.00 C ATOM 1159 CG2 ILE A 69 33.713 33.946 29.814 1.00 0.00 C ATOM 1160 CD1 ILE A 69 37.178 32.443 29.573 1.00 0.00 C ATOM 0 H ILE A 69 37.503 35.588 28.927 1.00 0.00 H new ATOM 0 HA ILE A 69 34.881 35.032 27.635 1.00 0.00 H new ATOM 0 HB ILE A 69 35.730 34.400 30.449 1.00 0.00 H new ATOM 0 HG12 ILE A 69 35.095 31.965 29.309 1.00 0.00 H new ATOM 0 HG13 ILE A 69 35.819 32.779 27.937 1.00 0.00 H new ATOM 0 HG21 ILE A 69 33.567 33.135 30.527 1.00 0.00 H new ATOM 0 HG22 ILE A 69 33.313 34.871 30.230 1.00 0.00 H new ATOM 0 HG23 ILE A 69 33.192 33.711 28.886 1.00 0.00 H new ATOM 0 HD11 ILE A 69 37.511 31.483 29.179 1.00 0.00 H new ATOM 0 HD12 ILE A 69 37.876 33.223 29.268 1.00 0.00 H new ATOM 0 HD13 ILE A 69 37.141 32.395 30.661 1.00 0.00 H new ATOM 1172 N THR A 70 33.868 37.114 28.476 1.00 0.00 N ATOM 1173 CA THR A 70 33.364 38.489 28.620 1.00 0.00 C ATOM 1174 C THR A 70 32.441 38.663 29.847 1.00 0.00 C ATOM 1175 O THR A 70 31.892 37.675 30.360 1.00 0.00 O ATOM 1176 CB THR A 70 32.569 38.842 27.342 1.00 0.00 C ATOM 1177 OG1 THR A 70 31.337 38.152 27.313 1.00 0.00 O ATOM 1178 CG2 THR A 70 33.306 38.541 26.034 1.00 0.00 C ATOM 0 H THR A 70 33.257 36.535 27.900 1.00 0.00 H new ATOM 0 HA THR A 70 34.219 39.149 28.765 1.00 0.00 H new ATOM 0 HB THR A 70 32.423 39.921 27.399 1.00 0.00 H new ATOM 0 HG1 THR A 70 31.146 37.861 26.397 1.00 0.00 H new ATOM 0 HG21 THR A 70 32.676 38.819 25.189 1.00 0.00 H new ATOM 0 HG22 THR A 70 34.233 39.113 25.999 1.00 0.00 H new ATOM 0 HG23 THR A 70 33.534 37.476 25.982 1.00 0.00 H new ATOM 1186 N PRO A 71 32.141 39.903 30.305 1.00 0.00 N ATOM 1187 CA PRO A 71 31.158 40.134 31.366 1.00 0.00 C ATOM 1188 C PRO A 71 29.754 39.642 30.989 1.00 0.00 C ATOM 1189 O PRO A 71 29.014 39.199 31.862 1.00 0.00 O ATOM 1190 CB PRO A 71 31.162 41.644 31.627 1.00 0.00 C ATOM 1191 CG PRO A 71 31.589 42.213 30.278 1.00 0.00 C ATOM 1192 CD PRO A 71 32.635 41.193 29.841 1.00 0.00 C ATOM 0 HA PRO A 71 31.427 39.568 32.258 1.00 0.00 H new ATOM 0 HB2 PRO A 71 30.179 42.006 31.927 1.00 0.00 H new ATOM 0 HB3 PRO A 71 31.858 41.916 32.421 1.00 0.00 H new ATOM 0 HG2 PRO A 71 30.757 42.275 29.576 1.00 0.00 H new ATOM 0 HG3 PRO A 71 32.006 43.216 30.368 1.00 0.00 H new ATOM 0 HD2 PRO A 71 32.760 41.199 28.758 1.00 0.00 H new ATOM 0 HD3 PRO A 71 33.609 41.419 30.275 1.00 0.00 H new ATOM 1200 N ASN A 72 29.389 39.647 29.701 1.00 0.00 N ATOM 1201 CA ASN A 72 28.075 39.192 29.242 1.00 0.00 C ATOM 1202 C ASN A 72 27.857 37.676 29.429 1.00 0.00 C ATOM 1203 O ASN A 72 26.711 37.233 29.478 1.00 0.00 O ATOM 1204 CB ASN A 72 27.853 39.624 27.784 1.00 0.00 C ATOM 1205 CG ASN A 72 27.685 41.131 27.654 1.00 0.00 C ATOM 1206 OD1 ASN A 72 28.609 41.907 27.869 1.00 0.00 O ATOM 1207 ND2 ASN A 72 26.505 41.592 27.316 1.00 0.00 N ATOM 0 H ASN A 72 29.999 39.967 28.949 1.00 0.00 H new ATOM 0 HA ASN A 72 27.325 39.671 29.872 1.00 0.00 H new ATOM 0 HB2 ASN A 72 28.699 39.300 27.177 1.00 0.00 H new ATOM 0 HB3 ASN A 72 26.968 39.125 27.389 1.00 0.00 H new ATOM 0 HD21 ASN A 72 26.355 42.597 27.232 1.00 0.00 H new ATOM 0 HD22 ASN A 72 25.737 40.945 27.137 1.00 0.00 H new ATOM 1214 N GLY A 73 28.927 36.885 29.578 1.00 0.00 N ATOM 1215 CA GLY A 73 28.836 35.523 30.117 1.00 0.00 C ATOM 1216 C GLY A 73 28.753 35.510 31.644 1.00 0.00 C ATOM 1217 O GLY A 73 27.908 34.820 32.211 1.00 0.00 O ATOM 0 H GLY A 73 29.875 37.169 29.330 1.00 0.00 H new ATOM 0 HA2 GLY A 73 27.957 35.028 29.703 1.00 0.00 H new ATOM 0 HA3 GLY A 73 29.706 34.949 29.797 1.00 0.00 H new ATOM 1221 N ILE A 74 29.586 36.313 32.317 1.00 0.00 N ATOM 1222 CA ILE A 74 29.694 36.370 33.783 1.00 0.00 C ATOM 1223 C ILE A 74 28.368 36.750 34.449 1.00 0.00 C ATOM 1224 O ILE A 74 28.031 36.165 35.476 1.00 0.00 O ATOM 1225 CB ILE A 74 30.826 37.334 34.196 1.00 0.00 C ATOM 1226 CG1 ILE A 74 32.168 36.714 33.767 1.00 0.00 C ATOM 1227 CG2 ILE A 74 30.836 37.633 35.706 1.00 0.00 C ATOM 1228 CD1 ILE A 74 33.349 37.674 33.877 1.00 0.00 C ATOM 0 H ILE A 74 30.221 36.958 31.847 1.00 0.00 H new ATOM 0 HA ILE A 74 29.941 35.369 34.136 1.00 0.00 H new ATOM 0 HB ILE A 74 30.660 38.289 33.698 1.00 0.00 H new ATOM 0 HG12 ILE A 74 32.366 35.836 34.382 1.00 0.00 H new ATOM 0 HG13 ILE A 74 32.086 36.369 32.736 1.00 0.00 H new ATOM 0 HG21 ILE A 74 31.654 38.316 35.936 1.00 0.00 H new ATOM 0 HG22 ILE A 74 29.889 38.091 35.993 1.00 0.00 H new ATOM 0 HG23 ILE A 74 30.972 36.704 36.260 1.00 0.00 H new ATOM 0 HD11 ILE A 74 34.260 37.168 33.558 1.00 0.00 H new ATOM 0 HD12 ILE A 74 33.174 38.541 33.240 1.00 0.00 H new ATOM 0 HD13 ILE A 74 33.458 38.000 34.911 1.00 0.00 H new ATOM 1240 N GLU A 75 27.578 37.615 33.822 1.00 0.00 N ATOM 1241 CA GLU A 75 26.301 38.003 34.404 1.00 0.00 C ATOM 1242 C GLU A 75 25.440 36.751 34.542 1.00 0.00 C ATOM 1243 O GLU A 75 24.748 36.569 35.544 1.00 0.00 O ATOM 1244 CB GLU A 75 25.600 39.038 33.525 1.00 0.00 C ATOM 1245 CG GLU A 75 26.392 40.322 33.337 1.00 0.00 C ATOM 1246 CD GLU A 75 25.682 41.320 32.444 1.00 0.00 C ATOM 1247 OE1 GLU A 75 26.230 42.421 32.227 1.00 0.00 O ATOM 1248 OE2 GLU A 75 24.576 41.003 31.958 1.00 0.00 O ATOM 0 H GLU A 75 27.795 38.053 32.927 1.00 0.00 H new ATOM 0 HA GLU A 75 26.462 38.456 35.382 1.00 0.00 H new ATOM 0 HB2 GLU A 75 25.403 38.597 32.548 1.00 0.00 H new ATOM 0 HB3 GLU A 75 24.633 39.280 33.966 1.00 0.00 H new ATOM 0 HG2 GLU A 75 26.575 40.777 34.310 1.00 0.00 H new ATOM 0 HG3 GLU A 75 27.365 40.084 32.908 1.00 0.00 H new ATOM 1255 N LYS A 76 25.489 35.892 33.528 1.00 0.00 N ATOM 1256 CA LYS A 76 24.755 34.627 33.536 1.00 0.00 C ATOM 1257 C LYS A 76 25.274 33.715 34.650 1.00 0.00 C ATOM 1258 O LYS A 76 24.504 33.021 35.315 1.00 0.00 O ATOM 1259 CB LYS A 76 24.875 33.928 32.181 1.00 0.00 C ATOM 1260 CG LYS A 76 24.372 34.762 31.013 1.00 0.00 C ATOM 1261 CD LYS A 76 22.866 34.956 31.069 1.00 0.00 C ATOM 1262 CE LYS A 76 22.332 35.534 29.768 1.00 0.00 C ATOM 1263 NZ LYS A 76 22.724 36.959 29.583 1.00 0.00 N1+ ATOM 0 H LYS A 76 26.035 36.050 32.681 1.00 0.00 H new ATOM 0 HA LYS A 76 23.703 34.842 33.723 1.00 0.00 H new ATOM 0 HB2 LYS A 76 25.920 33.669 32.007 1.00 0.00 H new ATOM 0 HB3 LYS A 76 24.316 32.993 32.215 1.00 0.00 H new ATOM 0 HG2 LYS A 76 24.865 35.734 31.021 1.00 0.00 H new ATOM 0 HG3 LYS A 76 24.642 34.276 30.076 1.00 0.00 H new ATOM 0 HD2 LYS A 76 22.382 34.000 31.270 1.00 0.00 H new ATOM 0 HD3 LYS A 76 22.614 35.621 31.895 1.00 0.00 H new ATOM 0 HE2 LYS A 76 22.705 34.945 28.930 1.00 0.00 H new ATOM 0 HE3 LYS A 76 21.245 35.453 29.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 22.338 37.311 28.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 22.347 37.528 30.368 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 23.761 37.035 29.568 1.00 0.00 H new ATOM 1277 N LEU A 77 26.591 33.732 34.840 1.00 0.00 N ATOM 1278 CA LEU A 77 27.270 32.932 35.858 1.00 0.00 C ATOM 1279 C LEU A 77 26.893 33.318 37.288 1.00 0.00 C ATOM 1280 O LEU A 77 26.899 32.482 38.187 1.00 0.00 O ATOM 1281 CB LEU A 77 28.786 33.095 35.733 1.00 0.00 C ATOM 1282 CG LEU A 77 29.379 32.711 34.377 1.00 0.00 C ATOM 1283 CD1 LEU A 77 30.872 33.001 34.348 1.00 0.00 C ATOM 1284 CD2 LEU A 77 29.109 31.247 34.066 1.00 0.00 C ATOM 0 H LEU A 77 27.225 34.308 34.286 1.00 0.00 H new ATOM 0 HA LEU A 77 26.953 31.905 35.679 1.00 0.00 H new ATOM 0 HB2 LEU A 77 29.041 34.134 35.940 1.00 0.00 H new ATOM 0 HB3 LEU A 77 29.264 32.490 36.504 1.00 0.00 H new ATOM 0 HG LEU A 77 28.897 33.315 33.608 1.00 0.00 H new ATOM 0 HD11 LEU A 77 31.278 32.722 33.376 1.00 0.00 H new ATOM 0 HD12 LEU A 77 31.040 34.064 34.519 1.00 0.00 H new ATOM 0 HD13 LEU A 77 31.370 32.425 35.128 1.00 0.00 H new ATOM 0 HD21 LEU A 77 29.540 30.996 33.097 1.00 0.00 H new ATOM 0 HD22 LEU A 77 29.560 30.622 34.837 1.00 0.00 H new ATOM 0 HD23 LEU A 77 28.033 31.073 34.041 1.00 0.00 H new ATOM 1296 N LYS A 78 26.573 34.591 37.493 1.00 0.00 N ATOM 1297 CA LYS A 78 26.158 35.093 38.800 1.00 0.00 C ATOM 1298 C LYS A 78 24.845 34.469 39.279 1.00 0.00 C ATOM 1299 O LYS A 78 24.682 34.203 40.470 1.00 0.00 O ATOM 1300 CB LYS A 78 26.011 36.615 38.755 1.00 0.00 C ATOM 1301 CG LYS A 78 27.273 37.348 38.332 1.00 0.00 C ATOM 1302 CD LYS A 78 28.390 37.159 39.346 1.00 0.00 C ATOM 1303 CE LYS A 78 29.657 37.883 38.918 1.00 0.00 C ATOM 1304 NZ LYS A 78 30.739 37.756 39.932 1.00 0.00 N1+ ATOM 0 H LYS A 78 26.593 35.302 36.762 1.00 0.00 H new ATOM 0 HA LYS A 78 26.935 34.810 39.510 1.00 0.00 H new ATOM 0 HB2 LYS A 78 25.207 36.871 38.066 1.00 0.00 H new ATOM 0 HB3 LYS A 78 25.711 36.970 39.741 1.00 0.00 H new ATOM 0 HG2 LYS A 78 27.598 36.983 37.358 1.00 0.00 H new ATOM 0 HG3 LYS A 78 27.058 38.411 38.219 1.00 0.00 H new ATOM 0 HD2 LYS A 78 28.067 37.531 40.318 1.00 0.00 H new ATOM 0 HD3 LYS A 78 28.599 36.096 39.465 1.00 0.00 H new ATOM 0 HE2 LYS A 78 30.002 37.479 37.966 1.00 0.00 H new ATOM 0 HE3 LYS A 78 29.435 38.938 38.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 31.585 38.263 39.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 30.420 38.165 40.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 30.969 36.751 40.070 1.00 0.00 H new ATOM 1318 N SER A 79 23.914 34.237 38.359 1.00 0.00 N ATOM 1319 CA SER A 79 22.617 33.668 38.715 1.00 0.00 C ATOM 1320 C SER A 79 22.743 32.283 39.355 1.00 0.00 C ATOM 1321 O SER A 79 22.032 31.980 40.312 1.00 0.00 O ATOM 1322 CB SER A 79 21.722 33.583 37.478 1.00 0.00 C ATOM 1323 OG SER A 79 20.466 33.010 37.796 1.00 0.00 O ATOM 0 H SER A 79 24.032 34.433 37.365 1.00 0.00 H new ATOM 0 HA SER A 79 22.169 34.332 39.454 1.00 0.00 H new ATOM 0 HB2 SER A 79 21.576 34.580 37.062 1.00 0.00 H new ATOM 0 HB3 SER A 79 22.214 32.986 36.710 1.00 0.00 H new ATOM 0 HG SER A 79 19.912 32.968 36.989 1.00 0.00 H new ATOM 1329 N ILE A 80 23.637 31.443 38.838 1.00 0.00 N ATOM 1330 CA ILE A 80 23.827 30.108 39.409 1.00 0.00 C ATOM 1331 C ILE A 80 24.437 30.254 40.801 1.00 0.00 C ATOM 1332 O ILE A 80 25.241 31.157 41.040 1.00 0.00 O ATOM 1333 CB ILE A 80 24.723 29.203 38.538 1.00 0.00 C ATOM 1334 CG1 ILE A 80 26.049 29.898 38.218 1.00 0.00 C ATOM 1335 CG2 ILE A 80 23.995 28.787 37.268 1.00 0.00 C ATOM 1336 CD1 ILE A 80 27.177 28.938 37.910 1.00 0.00 C ATOM 0 H ILE A 80 24.233 31.656 38.038 1.00 0.00 H new ATOM 0 HA ILE A 80 22.851 29.625 39.458 1.00 0.00 H new ATOM 0 HB ILE A 80 24.950 28.299 39.103 1.00 0.00 H new ATOM 0 HG12 ILE A 80 25.905 30.562 37.366 1.00 0.00 H new ATOM 0 HG13 ILE A 80 26.336 30.523 39.064 1.00 0.00 H new ATOM 0 HG21 ILE A 80 24.645 28.149 36.668 1.00 0.00 H new ATOM 0 HG22 ILE A 80 23.090 28.239 37.530 1.00 0.00 H new ATOM 0 HG23 ILE A 80 23.728 29.675 36.694 1.00 0.00 H new ATOM 0 HD11 ILE A 80 28.085 29.501 37.693 1.00 0.00 H new ATOM 0 HD12 ILE A 80 27.349 28.290 38.770 1.00 0.00 H new ATOM 0 HD13 ILE A 80 26.911 28.330 37.045 1.00 0.00 H new ATOM 1348 N MET A 81 24.075 29.361 41.717 1.00 0.00 N ATOM 1349 CA MET A 81 24.573 29.451 43.085 1.00 0.00 C ATOM 1350 C MET A 81 24.486 28.097 43.779 1.00 0.00 C ATOM 1351 O MET A 81 24.893 27.949 44.931 1.00 0.00 O ATOM 1352 CB MET A 81 23.774 30.489 43.876 1.00 0.00 C ATOM 1353 CG MET A 81 22.294 30.167 44.004 1.00 0.00 C ATOM 1354 SD MET A 81 21.391 31.410 44.947 1.00 0.00 S ATOM 1355 CE MET A 81 19.737 30.725 44.912 1.00 0.00 C ATOM 1356 OXT MET A 81 24.008 27.119 43.205 1.00 0.00 O ATOM 0 H MET A 81 23.447 28.577 41.541 1.00 0.00 H new ATOM 0 HA MET A 81 25.618 29.759 43.046 1.00 0.00 H new ATOM 0 HB2 MET A 81 24.203 30.579 44.874 1.00 0.00 H new ATOM 0 HB3 MET A 81 23.883 31.460 43.394 1.00 0.00 H new ATOM 0 HG2 MET A 81 21.857 30.083 43.009 1.00 0.00 H new ATOM 0 HG3 MET A 81 22.178 29.196 44.486 1.00 0.00 H new ATOM 0 HE1 MET A 81 19.059 31.383 45.456 1.00 0.00 H new ATOM 0 HE2 MET A 81 19.403 30.634 43.879 1.00 0.00 H new ATOM 0 HE3 MET A 81 19.741 29.741 45.380 1.00 0.00 H new TER 1366 MET A 81