USER MOD reduce.3.24.130724 H: found=0, std=0, add=709, rem=0, adj=27 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 Single : A 1 MET CE :methyl -157:sc= -0.21 (180deg=-0.885) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 ASN : amide:sc= -0.0298 K(o=-0.03,f=-2.1) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 ASN : amide:sc= -0.364 K(o=-0.36,f=-3.6!) USER MOD Single : A 8 TYR OH : rot 150:sc= -0.831 USER MOD Single : A 9 LYS NZ :NH3+ 169:sc= 1.21 (180deg=1.1) USER MOD Single : A 13 MET CE :methyl 143:sc= -0.0277 (180deg=-0.703) USER MOD Single : A 15 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0648) USER MOD Single : A 17 ASN : amide:sc= -0.0847 K(o=-0.085,f=-2.6) USER MOD Single : A 18 GLN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : A 19 CYS SG : rot 35:sc= 0.37 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ -171:sc= -0.0107 (180deg=-0.105) USER MOD Single : A 25 SER OG : rot 180:sc= -0.955 USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 TYR OH : rot 125:sc= 0.184 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 CYS SG : rot 17:sc= 0.409 USER MOD Single : A 33 ASN : amide:sc= -0.974 K(o=-0.97,f=-1.8!) USER MOD Single : A 35 SER OG : rot 95:sc= 1.22 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 40 SER OG : rot 180:sc= 0.0123 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot -160:sc= -0.0447 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= 0 X(o=0,f=0) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 CYS SG : rot 35:sc= 0.025 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=-0.84) USER MOD Single : A 64 SER OG : rot 180:sc= 0.00228 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 THR OG1 : rot 42:sc= 0.387 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot -147:sc= 1.19 USER MOD Single : A 72 ASN : amide:sc= 0 K(o=0,f=-0.64) 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 -177:sc= 0 (180deg=-0.0165) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 18.095 32.903 31.988 1.00 0.00 N1+ ATOM 2 CA MET A 1 17.183 32.114 31.166 1.00 0.00 C ATOM 3 C MET A 1 17.730 30.709 30.898 1.00 0.00 C ATOM 4 O MET A 1 17.120 29.719 31.304 1.00 0.00 O ATOM 5 CB MET A 1 16.890 32.836 29.848 1.00 0.00 C ATOM 6 CG MET A 1 15.957 32.076 28.919 1.00 0.00 C ATOM 7 SD MET A 1 15.529 33.016 27.441 1.00 0.00 S ATOM 8 CE MET A 1 14.680 34.416 28.166 1.00 0.00 C ATOM 0 H1 MET A 1 17.690 33.847 32.147 1.00 0.00 H new ATOM 0 H2 MET A 1 18.237 32.428 32.902 1.00 0.00 H new ATOM 0 H3 MET A 1 19.009 32.996 31.501 1.00 0.00 H new ATOM 0 HA MET A 1 16.252 32.003 31.722 1.00 0.00 H new ATOM 0 HB2 MET A 1 16.452 33.809 30.069 1.00 0.00 H new ATOM 0 HB3 MET A 1 17.831 33.020 29.330 1.00 0.00 H new ATOM 0 HG2 MET A 1 16.429 31.139 28.624 1.00 0.00 H new ATOM 0 HG3 MET A 1 15.045 31.819 29.458 1.00 0.00 H new ATOM 0 HE1 MET A 1 14.017 34.863 27.425 1.00 0.00 H new ATOM 0 HE2 MET A 1 14.095 34.083 29.023 1.00 0.00 H new ATOM 0 HE3 MET A 1 15.411 35.156 28.491 1.00 0.00 H new ATOM 20 N ALA A 2 18.905 30.615 30.282 1.00 0.00 N ATOM 21 CA ALA A 2 19.493 29.308 29.997 1.00 0.00 C ATOM 22 C ALA A 2 20.596 28.980 31.021 1.00 0.00 C ATOM 23 O ALA A 2 21.573 29.720 31.130 1.00 0.00 O ATOM 24 CB ALA A 2 20.065 29.292 28.589 1.00 0.00 C ATOM 0 H ALA A 2 19.461 31.413 29.975 1.00 0.00 H new ATOM 0 HA ALA A 2 18.713 28.550 30.072 1.00 0.00 H new ATOM 0 HB1 ALA A 2 20.501 28.314 28.385 1.00 0.00 H new ATOM 0 HB2 ALA A 2 19.270 29.492 27.871 1.00 0.00 H new ATOM 0 HB3 ALA A 2 20.835 30.059 28.500 1.00 0.00 H new ATOM 30 N VAL A 3 20.447 27.882 31.767 1.00 0.00 N ATOM 31 CA VAL A 3 21.433 27.487 32.771 1.00 0.00 C ATOM 32 C VAL A 3 21.787 26.003 32.672 1.00 0.00 C ATOM 33 O VAL A 3 21.232 25.187 33.407 1.00 0.00 O ATOM 34 CB VAL A 3 20.918 27.769 34.195 1.00 0.00 C ATOM 35 CG1 VAL A 3 19.570 27.099 34.414 1.00 0.00 C ATOM 36 CG2 VAL A 3 21.930 27.298 35.228 1.00 0.00 C ATOM 0 H VAL A 3 19.650 27.250 31.693 1.00 0.00 H new ATOM 0 HA VAL A 3 22.325 28.081 32.573 1.00 0.00 H new ATOM 0 HB VAL A 3 20.787 28.845 34.312 1.00 0.00 H new ATOM 0 HG11 VAL A 3 19.220 27.308 35.425 1.00 0.00 H new ATOM 0 HG12 VAL A 3 18.850 27.486 33.693 1.00 0.00 H new ATOM 0 HG13 VAL A 3 19.673 26.022 34.281 1.00 0.00 H new ATOM 0 HG21 VAL A 3 21.551 27.504 36.229 1.00 0.00 H new ATOM 0 HG22 VAL A 3 22.093 26.226 35.116 1.00 0.00 H new ATOM 0 HG23 VAL A 3 22.872 27.825 35.081 1.00 0.00 H new ATOM 46 N ASN A 4 22.703 25.645 31.776 1.00 0.00 N ATOM 47 CA ASN A 4 23.074 24.240 31.616 1.00 0.00 C ATOM 48 C ASN A 4 24.427 23.826 32.201 1.00 0.00 C ATOM 49 O ASN A 4 25.480 24.293 31.767 1.00 0.00 O ATOM 50 CB ASN A 4 23.116 23.876 30.130 1.00 0.00 C ATOM 51 CG ASN A 4 21.774 24.052 29.448 1.00 0.00 C ATOM 52 OD1 ASN A 4 20.773 24.365 30.092 1.00 0.00 O ATOM 53 ND2 ASN A 4 21.747 23.848 28.137 1.00 0.00 N ATOM 0 H ASN A 4 23.194 26.293 31.160 1.00 0.00 H new ATOM 0 HA ASN A 4 22.304 23.710 32.177 1.00 0.00 H new ATOM 0 HB2 ASN A 4 23.858 24.497 29.629 1.00 0.00 H new ATOM 0 HB3 ASN A 4 23.441 22.841 30.022 1.00 0.00 H new ATOM 0 HD21 ASN A 4 20.872 23.949 27.623 1.00 0.00 H new ATOM 0 HD22 ASN A 4 22.601 23.590 27.643 1.00 0.00 H new ATOM 60 N LYS A 5 24.372 22.942 33.194 1.00 0.00 N ATOM 61 CA LYS A 5 25.559 22.456 33.894 1.00 0.00 C ATOM 62 C LYS A 5 26.378 21.542 32.987 1.00 0.00 C ATOM 63 O LYS A 5 27.534 21.225 33.266 1.00 0.00 O ATOM 64 CB LYS A 5 25.158 21.711 35.168 1.00 0.00 C ATOM 65 CG LYS A 5 24.305 20.477 34.923 1.00 0.00 C ATOM 66 CD LYS A 5 23.977 19.764 36.225 1.00 0.00 C ATOM 67 CE LYS A 5 23.180 18.493 35.981 1.00 0.00 C ATOM 68 NZ LYS A 5 22.802 17.816 37.252 1.00 0.00 N1+ ATOM 0 H LYS A 5 23.499 22.541 33.537 1.00 0.00 H new ATOM 0 HA LYS A 5 26.172 23.315 34.168 1.00 0.00 H new ATOM 0 HB2 LYS A 5 26.061 21.415 35.702 1.00 0.00 H new ATOM 0 HB3 LYS A 5 24.612 22.394 35.819 1.00 0.00 H new ATOM 0 HG2 LYS A 5 23.381 20.765 34.421 1.00 0.00 H new ATOM 0 HG3 LYS A 5 24.832 19.795 34.255 1.00 0.00 H new ATOM 0 HD2 LYS A 5 24.901 19.520 36.750 1.00 0.00 H new ATOM 0 HD3 LYS A 5 23.409 20.432 36.873 1.00 0.00 H new ATOM 0 HE2 LYS A 5 22.279 18.733 35.417 1.00 0.00 H new ATOM 0 HE3 LYS A 5 23.767 17.810 35.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 22.260 16.954 37.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 23.662 17.563 37.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 22.220 18.458 37.827 1.00 0.00 H new ATOM 82 N ASN A 6 25.746 21.131 31.896 1.00 0.00 N ATOM 83 CA ASN A 6 26.340 20.210 30.935 1.00 0.00 C ATOM 84 C ASN A 6 27.281 20.977 29.975 1.00 0.00 C ATOM 85 O ASN A 6 28.475 20.690 29.943 1.00 0.00 O ATOM 86 CB ASN A 6 25.216 19.453 30.199 1.00 0.00 C ATOM 87 CG ASN A 6 24.320 18.565 31.059 1.00 0.00 C ATOM 88 OD1 ASN A 6 24.294 18.594 32.283 1.00 0.00 O ATOM 89 ND2 ASN A 6 23.524 17.744 30.422 1.00 0.00 N ATOM 0 H ASN A 6 24.802 21.428 31.651 1.00 0.00 H new ATOM 0 HA ASN A 6 26.955 19.469 31.445 1.00 0.00 H new ATOM 0 HB2 ASN A 6 24.587 20.184 29.692 1.00 0.00 H new ATOM 0 HB3 ASN A 6 25.671 18.833 29.426 1.00 0.00 H new ATOM 0 HD21 ASN A 6 22.892 17.138 30.945 1.00 0.00 H new ATOM 0 HD22 ASN A 6 23.536 17.710 29.403 1.00 0.00 H new ATOM 96 N GLU A 7 26.777 21.991 29.254 1.00 0.00 N ATOM 97 CA GLU A 7 27.563 22.805 28.303 1.00 0.00 C ATOM 98 C GLU A 7 27.962 24.182 28.856 1.00 0.00 C ATOM 99 O GLU A 7 29.118 24.582 28.716 1.00 0.00 O ATOM 100 CB GLU A 7 26.821 22.997 26.967 1.00 0.00 C ATOM 101 CG GLU A 7 26.408 21.691 26.265 1.00 0.00 C ATOM 102 CD GLU A 7 25.225 20.977 26.943 1.00 0.00 C ATOM 103 OE1 GLU A 7 25.169 19.728 26.910 1.00 0.00 O ATOM 104 OE2 GLU A 7 24.374 21.680 27.540 1.00 0.00 O ATOM 0 H GLU A 7 25.799 22.275 29.313 1.00 0.00 H new ATOM 0 HA GLU A 7 28.477 22.235 28.138 1.00 0.00 H new ATOM 0 HB2 GLU A 7 25.927 23.595 27.146 1.00 0.00 H new ATOM 0 HB3 GLU A 7 27.458 23.570 26.293 1.00 0.00 H new ATOM 0 HG2 GLU A 7 26.144 21.912 25.231 1.00 0.00 H new ATOM 0 HG3 GLU A 7 27.263 21.016 26.239 1.00 0.00 H new ATOM 111 N TYR A 8 27.062 24.899 29.550 1.00 0.00 N ATOM 112 CA TYR A 8 27.390 26.156 30.241 1.00 0.00 C ATOM 113 C TYR A 8 28.487 25.961 31.296 1.00 0.00 C ATOM 114 O TYR A 8 29.211 26.912 31.589 1.00 0.00 O ATOM 115 CB TYR A 8 26.119 26.830 30.796 1.00 0.00 C ATOM 116 CG TYR A 8 26.248 28.338 30.863 1.00 0.00 C ATOM 117 CD1 TYR A 8 26.850 28.938 31.980 1.00 0.00 C ATOM 118 CD2 TYR A 8 25.813 29.133 29.786 1.00 0.00 C ATOM 119 CE1 TYR A 8 27.060 30.328 32.007 1.00 0.00 C ATOM 120 CE2 TYR A 8 26.010 30.531 29.812 1.00 0.00 C ATOM 121 CZ TYR A 8 26.656 31.125 30.920 1.00 0.00 C ATOM 122 OH TYR A 8 26.924 32.455 30.958 1.00 0.00 O ATOM 0 H TYR A 8 26.085 24.622 29.647 1.00 0.00 H new ATOM 0 HA TYR A 8 27.811 26.845 29.509 1.00 0.00 H new ATOM 0 HB2 TYR A 8 25.268 26.568 30.167 1.00 0.00 H new ATOM 0 HB3 TYR A 8 25.910 26.441 31.793 1.00 0.00 H new ATOM 0 HD1 TYR A 8 27.152 28.331 32.820 1.00 0.00 H new ATOM 0 HD2 TYR A 8 25.328 28.673 28.938 1.00 0.00 H new ATOM 0 HE1 TYR A 8 27.532 30.785 32.864 1.00 0.00 H new ATOM 0 HE2 TYR A 8 25.669 31.143 28.990 1.00 0.00 H new ATOM 0 HH TYR A 8 27.049 32.790 30.045 1.00 0.00 H new ATOM 132 N LYS A 9 28.726 24.710 31.734 1.00 0.00 N ATOM 133 CA LYS A 9 29.922 24.282 32.482 1.00 0.00 C ATOM 134 C LYS A 9 31.190 24.998 32.004 1.00 0.00 C ATOM 135 O LYS A 9 31.948 25.458 32.845 1.00 0.00 O ATOM 136 CB LYS A 9 30.092 22.746 32.396 1.00 0.00 C ATOM 137 CG LYS A 9 31.541 22.221 32.453 1.00 0.00 C ATOM 138 CD LYS A 9 31.665 20.703 32.272 1.00 0.00 C ATOM 139 CE LYS A 9 31.319 19.905 33.536 1.00 0.00 C ATOM 140 NZ LYS A 9 31.724 18.485 33.384 1.00 0.00 N1+ ATOM 0 H LYS A 9 28.071 23.946 31.571 1.00 0.00 H new ATOM 0 HA LYS A 9 29.772 24.562 33.525 1.00 0.00 H new ATOM 0 HB2 LYS A 9 29.530 22.292 33.212 1.00 0.00 H new ATOM 0 HB3 LYS A 9 29.638 22.402 31.467 1.00 0.00 H new ATOM 0 HG2 LYS A 9 32.127 22.717 31.679 1.00 0.00 H new ATOM 0 HG3 LYS A 9 31.979 22.499 33.412 1.00 0.00 H new ATOM 0 HD2 LYS A 9 31.008 20.387 31.461 1.00 0.00 H new ATOM 0 HD3 LYS A 9 32.684 20.463 31.968 1.00 0.00 H new ATOM 0 HE2 LYS A 9 31.823 20.342 34.398 1.00 0.00 H new ATOM 0 HE3 LYS A 9 30.248 19.965 33.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 31.656 18.004 34.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 31.095 18.016 32.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 32.704 18.439 33.040 1.00 0.00 H new ATOM 154 N ILE A 10 31.413 25.134 30.693 1.00 0.00 N ATOM 155 CA ILE A 10 32.627 25.764 30.145 1.00 0.00 C ATOM 156 C ILE A 10 32.857 27.167 30.715 1.00 0.00 C ATOM 157 O ILE A 10 33.932 27.455 31.234 1.00 0.00 O ATOM 158 CB ILE A 10 32.545 25.829 28.606 1.00 0.00 C ATOM 159 CG1 ILE A 10 32.463 24.458 27.917 1.00 0.00 C ATOM 160 CG2 ILE A 10 33.693 26.677 28.032 1.00 0.00 C ATOM 161 CD1 ILE A 10 33.556 23.473 28.316 1.00 0.00 C ATOM 0 H ILE A 10 30.760 24.812 29.979 1.00 0.00 H new ATOM 0 HA ILE A 10 33.474 25.146 30.441 1.00 0.00 H new ATOM 0 HB ILE A 10 31.596 26.316 28.382 1.00 0.00 H new ATOM 0 HG12 ILE A 10 31.494 24.013 28.140 1.00 0.00 H new ATOM 0 HG13 ILE A 10 32.504 24.607 26.838 1.00 0.00 H new ATOM 0 HG21 ILE A 10 33.614 26.708 26.945 1.00 0.00 H new ATOM 0 HG22 ILE A 10 33.631 27.690 28.430 1.00 0.00 H new ATOM 0 HG23 ILE A 10 34.648 26.234 28.314 1.00 0.00 H new ATOM 0 HD11 ILE A 10 33.415 22.535 27.779 1.00 0.00 H new ATOM 0 HD12 ILE A 10 34.531 23.891 28.066 1.00 0.00 H new ATOM 0 HD13 ILE A 10 33.505 23.288 29.389 1.00 0.00 H new ATOM 173 N LEU A 11 31.840 28.032 30.646 1.00 0.00 N ATOM 174 CA LEU A 11 31.920 29.409 31.139 1.00 0.00 C ATOM 175 C LEU A 11 32.015 29.453 32.680 1.00 0.00 C ATOM 176 O LEU A 11 32.555 30.399 33.254 1.00 0.00 O ATOM 177 CB LEU A 11 30.730 30.216 30.577 1.00 0.00 C ATOM 178 CG LEU A 11 30.658 30.285 29.029 1.00 0.00 C ATOM 179 CD1 LEU A 11 29.397 31.013 28.606 1.00 0.00 C ATOM 180 CD2 LEU A 11 31.862 31.000 28.412 1.00 0.00 C ATOM 0 H LEU A 11 30.933 27.794 30.244 1.00 0.00 H new ATOM 0 HA LEU A 11 32.838 29.876 30.782 1.00 0.00 H new ATOM 0 HB2 LEU A 11 29.804 29.777 30.950 1.00 0.00 H new ATOM 0 HB3 LEU A 11 30.782 31.232 30.969 1.00 0.00 H new ATOM 0 HG LEU A 11 30.656 29.256 28.669 1.00 0.00 H new ATOM 0 HD11 LEU A 11 29.351 31.059 27.518 1.00 0.00 H new ATOM 0 HD12 LEU A 11 28.525 30.480 28.984 1.00 0.00 H new ATOM 0 HD13 LEU A 11 29.407 32.025 29.012 1.00 0.00 H new ATOM 0 HD21 LEU A 11 31.758 31.018 27.327 1.00 0.00 H new ATOM 0 HD22 LEU A 11 31.911 32.022 28.789 1.00 0.00 H new ATOM 0 HD23 LEU A 11 32.776 30.470 28.680 1.00 0.00 H new ATOM 192 N ILE A 12 31.573 28.380 33.343 1.00 0.00 N ATOM 193 CA ILE A 12 31.721 28.180 34.793 1.00 0.00 C ATOM 194 C ILE A 12 33.168 27.794 35.161 1.00 0.00 C ATOM 195 O ILE A 12 33.722 28.338 36.115 1.00 0.00 O ATOM 196 CB ILE A 12 30.683 27.171 35.338 1.00 0.00 C ATOM 197 CG1 ILE A 12 29.231 27.545 34.960 1.00 0.00 C ATOM 198 CG2 ILE A 12 30.800 27.008 36.864 1.00 0.00 C ATOM 199 CD1 ILE A 12 28.690 28.839 35.585 1.00 0.00 C ATOM 0 H ILE A 12 31.092 27.609 32.880 1.00 0.00 H new ATOM 0 HA ILE A 12 31.514 29.132 35.283 1.00 0.00 H new ATOM 0 HB ILE A 12 30.915 26.219 34.861 1.00 0.00 H new ATOM 0 HG12 ILE A 12 29.169 27.634 33.875 1.00 0.00 H new ATOM 0 HG13 ILE A 12 28.577 26.723 35.250 1.00 0.00 H new ATOM 0 HG21 ILE A 12 30.055 26.292 37.212 1.00 0.00 H new ATOM 0 HG22 ILE A 12 31.797 26.646 37.116 1.00 0.00 H new ATOM 0 HG23 ILE A 12 30.631 27.970 37.347 1.00 0.00 H new ATOM 0 HD11 ILE A 12 27.665 29.003 35.252 1.00 0.00 H new ATOM 0 HD12 ILE A 12 28.709 28.754 36.672 1.00 0.00 H new ATOM 0 HD13 ILE A 12 29.311 29.680 35.276 1.00 0.00 H new ATOM 211 N MET A 13 33.826 26.925 34.384 1.00 0.00 N ATOM 212 CA MET A 13 35.211 26.493 34.632 1.00 0.00 C ATOM 213 C MET A 13 36.221 27.650 34.586 1.00 0.00 C ATOM 214 O MET A 13 37.234 27.608 35.280 1.00 0.00 O ATOM 215 CB MET A 13 35.643 25.424 33.618 1.00 0.00 C ATOM 216 CG MET A 13 34.874 24.096 33.618 1.00 0.00 C ATOM 217 SD MET A 13 34.772 23.165 35.173 1.00 0.00 S ATOM 218 CE MET A 13 33.328 23.916 35.977 1.00 0.00 C ATOM 0 H MET A 13 33.410 26.497 33.557 1.00 0.00 H new ATOM 0 HA MET A 13 35.214 26.081 35.641 1.00 0.00 H new ATOM 0 HB2 MET A 13 35.567 25.857 32.620 1.00 0.00 H new ATOM 0 HB3 MET A 13 36.696 25.203 33.790 1.00 0.00 H new ATOM 0 HG2 MET A 13 33.857 24.300 33.285 1.00 0.00 H new ATOM 0 HG3 MET A 13 35.330 23.447 32.870 1.00 0.00 H new ATOM 0 HE1 MET A 13 32.765 23.147 36.506 1.00 0.00 H new ATOM 0 HE2 MET A 13 33.660 24.675 36.686 1.00 0.00 H new ATOM 0 HE3 MET A 13 32.691 24.378 35.223 1.00 0.00 H new ATOM 228 N LEU A 14 35.955 28.702 33.803 1.00 0.00 N ATOM 229 CA LEU A 14 36.776 29.910 33.812 1.00 0.00 C ATOM 230 C LEU A 14 36.453 30.797 35.009 1.00 0.00 C ATOM 231 O LEU A 14 37.383 31.273 35.653 1.00 0.00 O ATOM 232 CB LEU A 14 36.713 30.729 32.508 1.00 0.00 C ATOM 233 CG LEU A 14 35.649 30.372 31.453 1.00 0.00 C ATOM 234 CD1 LEU A 14 35.010 31.645 30.914 1.00 0.00 C ATOM 235 CD2 LEU A 14 36.241 29.562 30.303 1.00 0.00 C ATOM 0 H LEU A 14 35.171 28.737 33.152 1.00 0.00 H new ATOM 0 HA LEU A 14 37.801 29.550 33.896 1.00 0.00 H new ATOM 0 HB2 LEU A 14 36.567 31.774 32.782 1.00 0.00 H new ATOM 0 HB3 LEU A 14 37.689 30.659 32.028 1.00 0.00 H new ATOM 0 HG LEU A 14 34.892 29.756 31.938 1.00 0.00 H new ATOM 0 HD11 LEU A 14 34.258 31.387 30.168 1.00 0.00 H new ATOM 0 HD12 LEU A 14 34.538 32.190 31.732 1.00 0.00 H new ATOM 0 HD13 LEU A 14 35.776 32.271 30.456 1.00 0.00 H new ATOM 0 HD21 LEU A 14 35.458 29.330 29.580 1.00 0.00 H new ATOM 0 HD22 LEU A 14 37.025 30.142 29.816 1.00 0.00 H new ATOM 0 HD23 LEU A 14 36.663 28.635 30.691 1.00 0.00 H new ATOM 247 N LYS A 15 35.170 31.024 35.332 1.00 0.00 N ATOM 248 CA LYS A 15 34.793 31.913 36.448 1.00 0.00 C ATOM 249 C LYS A 15 35.304 31.402 37.792 1.00 0.00 C ATOM 250 O LYS A 15 35.721 32.194 38.628 1.00 0.00 O ATOM 251 CB LYS A 15 33.287 32.240 36.412 1.00 0.00 C ATOM 252 CG LYS A 15 32.516 32.536 37.714 1.00 0.00 C ATOM 253 CD LYS A 15 32.638 33.949 38.315 1.00 0.00 C ATOM 254 CE LYS A 15 31.492 34.149 39.322 1.00 0.00 C ATOM 255 NZ LYS A 15 31.518 33.169 40.433 1.00 0.00 N1+ ATOM 0 H LYS A 15 34.379 30.608 34.841 1.00 0.00 H new ATOM 0 HA LYS A 15 35.302 32.868 36.315 1.00 0.00 H new ATOM 0 HB2 LYS A 15 33.162 33.105 35.761 1.00 0.00 H new ATOM 0 HB3 LYS A 15 32.788 31.401 35.927 1.00 0.00 H new ATOM 0 HG2 LYS A 15 31.460 32.340 37.530 1.00 0.00 H new ATOM 0 HG3 LYS A 15 32.846 31.821 38.468 1.00 0.00 H new ATOM 0 HD2 LYS A 15 33.602 34.069 38.809 1.00 0.00 H new ATOM 0 HD3 LYS A 15 32.587 34.702 37.528 1.00 0.00 H new ATOM 0 HE2 LYS A 15 31.549 35.157 39.733 1.00 0.00 H new ATOM 0 HE3 LYS A 15 30.539 34.071 38.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 30.821 33.444 41.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 31.284 32.224 40.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 32.467 33.150 40.857 1.00 0.00 H new ATOM 269 N GLU A 16 35.359 30.083 37.956 1.00 0.00 N ATOM 270 CA GLU A 16 35.966 29.408 39.111 1.00 0.00 C ATOM 271 C GLU A 16 37.477 29.648 39.283 1.00 0.00 C ATOM 272 O GLU A 16 37.964 29.570 40.411 1.00 0.00 O ATOM 273 CB GLU A 16 35.677 27.898 39.011 1.00 0.00 C ATOM 274 CG GLU A 16 34.232 27.554 39.410 1.00 0.00 C ATOM 275 CD GLU A 16 33.918 27.962 40.853 1.00 0.00 C ATOM 276 OE1 GLU A 16 34.815 27.932 41.726 1.00 0.00 O ATOM 277 OE2 GLU A 16 32.767 28.357 41.148 1.00 0.00 O ATOM 0 H GLU A 16 34.973 29.432 37.273 1.00 0.00 H new ATOM 0 HA GLU A 16 35.509 29.846 39.999 1.00 0.00 H new ATOM 0 HB2 GLU A 16 35.860 27.562 37.990 1.00 0.00 H new ATOM 0 HB3 GLU A 16 36.369 27.354 39.654 1.00 0.00 H new ATOM 0 HG2 GLU A 16 33.541 28.056 38.733 1.00 0.00 H new ATOM 0 HG3 GLU A 16 34.070 26.482 39.294 1.00 0.00 H new ATOM 284 N ASN A 17 38.176 29.853 38.168 1.00 0.00 N ATOM 285 CA ASN A 17 39.598 30.178 38.179 1.00 0.00 C ATOM 286 C ASN A 17 39.855 31.686 37.977 1.00 0.00 C ATOM 287 O ASN A 17 41.004 32.127 38.047 1.00 0.00 O ATOM 288 CB ASN A 17 40.331 29.381 37.098 1.00 0.00 C ATOM 289 CG ASN A 17 40.190 27.883 37.282 1.00 0.00 C ATOM 290 OD1 ASN A 17 39.559 27.419 38.232 1.00 0.00 O ATOM 291 ND2 ASN A 17 40.778 27.117 36.371 1.00 0.00 N ATOM 0 H ASN A 17 37.771 29.798 37.233 1.00 0.00 H new ATOM 0 HA ASN A 17 39.981 29.906 39.163 1.00 0.00 H new ATOM 0 HB2 ASN A 17 39.943 29.661 36.119 1.00 0.00 H new ATOM 0 HB3 ASN A 17 41.388 29.647 37.110 1.00 0.00 H new ATOM 0 HD21 ASN A 17 40.717 26.101 36.442 1.00 0.00 H new ATOM 0 HD22 ASN A 17 41.291 27.544 35.600 1.00 0.00 H new ATOM 298 N GLN A 18 38.795 32.454 37.698 1.00 0.00 N ATOM 299 CA GLN A 18 38.864 33.908 37.495 1.00 0.00 C ATOM 300 C GLN A 18 39.865 34.340 36.419 1.00 0.00 C ATOM 301 O GLN A 18 40.557 35.346 36.581 1.00 0.00 O ATOM 302 CB GLN A 18 39.149 34.635 38.816 1.00 0.00 C ATOM 303 CG GLN A 18 38.100 34.391 39.889 1.00 0.00 C ATOM 304 CD GLN A 18 38.394 35.137 41.176 1.00 0.00 C ATOM 305 OE1 GLN A 18 39.359 35.897 41.260 1.00 0.00 O ATOM 306 NE2 GLN A 18 37.561 34.922 42.188 1.00 0.00 N ATOM 0 H GLN A 18 37.851 32.078 37.605 1.00 0.00 H new ATOM 0 HA GLN A 18 37.880 34.198 37.127 1.00 0.00 H new ATOM 0 HB2 GLN A 18 40.121 34.317 39.193 1.00 0.00 H new ATOM 0 HB3 GLN A 18 39.216 35.706 38.624 1.00 0.00 H new ATOM 0 HG2 GLN A 18 37.124 34.696 39.512 1.00 0.00 H new ATOM 0 HG3 GLN A 18 38.042 33.323 40.098 1.00 0.00 H new ATOM 0 HE21 GLN A 18 36.774 34.283 42.074 1.00 0.00 H new ATOM 0 HE22 GLN A 18 37.708 35.395 43.079 1.00 0.00 H new ATOM 315 N CYS A 19 39.943 33.586 35.326 1.00 0.00 N ATOM 316 CA CYS A 19 40.870 33.910 34.241 1.00 0.00 C ATOM 317 C CYS A 19 40.231 34.599 33.028 1.00 0.00 C ATOM 318 O CYS A 19 40.923 34.900 32.055 1.00 0.00 O ATOM 319 CB CYS A 19 41.587 32.639 33.777 1.00 0.00 C ATOM 320 SG CYS A 19 42.542 31.813 35.071 1.00 0.00 S ATOM 0 H CYS A 19 39.380 32.751 35.167 1.00 0.00 H new ATOM 0 HA CYS A 19 41.568 34.633 34.664 1.00 0.00 H new ATOM 0 HB2 CYS A 19 40.848 31.941 33.385 1.00 0.00 H new ATOM 0 HB3 CYS A 19 42.255 32.892 32.953 1.00 0.00 H new ATOM 0 HG CYS A 19 41.934 31.947 36.212 1.00 0.00 H new ATOM 326 N THR A 20 38.926 34.849 33.076 1.00 0.00 N ATOM 327 CA THR A 20 38.231 35.473 31.946 1.00 0.00 C ATOM 328 C THR A 20 38.433 36.968 31.684 1.00 0.00 C ATOM 329 O THR A 20 38.155 37.804 32.544 1.00 0.00 O ATOM 330 CB THR A 20 36.704 35.336 32.100 1.00 0.00 C ATOM 331 OG1 THR A 20 36.051 35.947 30.980 1.00 0.00 O ATOM 332 CG2 THR A 20 36.234 36.001 33.386 1.00 0.00 C ATOM 0 H THR A 20 38.330 34.633 33.875 1.00 0.00 H new ATOM 0 HA THR A 20 38.686 34.927 31.119 1.00 0.00 H new ATOM 0 HB THR A 20 36.452 34.276 32.141 1.00 0.00 H new ATOM 0 HG1 THR A 20 35.080 35.858 31.079 1.00 0.00 H new ATOM 0 HG21 THR A 20 35.153 35.894 33.477 1.00 0.00 H new ATOM 0 HG22 THR A 20 36.719 35.527 34.239 1.00 0.00 H new ATOM 0 HG23 THR A 20 36.493 37.060 33.364 1.00 0.00 H new ATOM 340 N THR A 21 39.042 37.278 30.546 1.00 0.00 N ATOM 341 CA THR A 21 39.310 38.657 30.166 1.00 0.00 C ATOM 342 C THR A 21 39.492 38.745 28.660 1.00 0.00 C ATOM 343 O THR A 21 39.743 37.736 28.000 1.00 0.00 O ATOM 344 CB THR A 21 40.575 39.197 30.857 1.00 0.00 C ATOM 345 OG1 THR A 21 41.632 38.235 30.749 1.00 0.00 O ATOM 346 CG2 THR A 21 40.301 39.485 32.326 1.00 0.00 C ATOM 0 H THR A 21 39.361 36.587 29.867 1.00 0.00 H new ATOM 0 HA THR A 21 38.460 39.262 30.481 1.00 0.00 H new ATOM 0 HB THR A 21 40.869 40.124 30.366 1.00 0.00 H new ATOM 0 HG1 THR A 21 42.436 38.582 31.188 1.00 0.00 H new ATOM 0 HG21 THR A 21 41.207 39.866 32.797 1.00 0.00 H new ATOM 0 HG22 THR A 21 39.509 40.229 32.409 1.00 0.00 H new ATOM 0 HG23 THR A 21 39.991 38.567 32.825 1.00 0.00 H new ATOM 354 N GLU A 22 39.366 39.948 28.114 1.00 0.00 N ATOM 355 CA GLU A 22 39.539 40.135 26.680 1.00 0.00 C ATOM 356 C GLU A 22 40.990 39.845 26.297 1.00 0.00 C ATOM 357 O GLU A 22 41.270 39.210 25.280 1.00 0.00 O ATOM 358 CB GLU A 22 39.170 41.563 26.280 1.00 0.00 C ATOM 359 CG GLU A 22 37.785 41.996 26.729 1.00 0.00 C ATOM 360 CD GLU A 22 37.510 43.459 26.441 1.00 0.00 C ATOM 361 OE1 GLU A 22 36.414 43.941 26.794 1.00 0.00 O ATOM 362 OE2 GLU A 22 38.393 44.128 25.862 1.00 0.00 O ATOM 0 H GLU A 22 39.148 40.798 28.634 1.00 0.00 H new ATOM 0 HA GLU A 22 38.880 39.446 26.152 1.00 0.00 H new ATOM 0 HB2 GLU A 22 39.907 42.248 26.700 1.00 0.00 H new ATOM 0 HB3 GLU A 22 39.233 41.653 25.196 1.00 0.00 H new ATOM 0 HG2 GLU A 22 37.036 41.384 26.227 1.00 0.00 H new ATOM 0 HG3 GLU A 22 37.680 41.814 27.799 1.00 0.00 H new ATOM 369 N LEU A 23 41.902 40.330 27.135 1.00 0.00 N ATOM 370 CA LEU A 23 43.344 40.184 26.932 1.00 0.00 C ATOM 371 C LEU A 23 43.892 38.756 26.979 1.00 0.00 C ATOM 372 O LEU A 23 44.766 38.400 26.188 1.00 0.00 O ATOM 373 CB LEU A 23 44.091 41.043 27.957 1.00 0.00 C ATOM 374 CG LEU A 23 45.598 41.206 27.738 1.00 0.00 C ATOM 375 CD1 LEU A 23 46.130 42.383 28.541 1.00 0.00 C ATOM 376 CD2 LEU A 23 46.348 39.930 28.089 1.00 0.00 C ATOM 0 H LEU A 23 41.660 40.841 27.984 1.00 0.00 H new ATOM 0 HA LEU A 23 43.514 40.517 25.908 1.00 0.00 H new ATOM 0 HB2 LEU A 23 43.638 42.034 27.967 1.00 0.00 H new ATOM 0 HB3 LEU A 23 43.934 40.610 28.945 1.00 0.00 H new ATOM 0 HG LEU A 23 45.764 41.407 26.680 1.00 0.00 H new ATOM 0 HD11 LEU A 23 47.202 42.483 28.373 1.00 0.00 H new ATOM 0 HD12 LEU A 23 45.626 43.296 28.225 1.00 0.00 H new ATOM 0 HD13 LEU A 23 45.943 42.214 29.602 1.00 0.00 H new ATOM 0 HD21 LEU A 23 47.415 40.078 27.923 1.00 0.00 H new ATOM 0 HD22 LEU A 23 46.175 39.682 29.136 1.00 0.00 H new ATOM 0 HD23 LEU A 23 45.992 39.114 27.460 1.00 0.00 H new ATOM 388 N LYS A 24 43.386 37.940 27.900 1.00 0.00 N ATOM 389 CA LYS A 24 43.889 36.577 28.062 1.00 0.00 C ATOM 390 C LYS A 24 42.966 35.519 27.441 1.00 0.00 C ATOM 391 O LYS A 24 41.765 35.520 27.701 1.00 0.00 O ATOM 392 CB LYS A 24 44.066 36.269 29.551 1.00 0.00 C ATOM 393 CG LYS A 24 44.808 37.345 30.327 1.00 0.00 C ATOM 394 CD LYS A 24 44.772 37.070 31.822 1.00 0.00 C ATOM 395 CE LYS A 24 45.457 38.174 32.610 1.00 0.00 C ATOM 396 NZ LYS A 24 46.903 38.292 32.277 1.00 0.00 N1+ ATOM 0 H LYS A 24 42.635 38.195 28.541 1.00 0.00 H new ATOM 0 HA LYS A 24 44.843 36.529 27.536 1.00 0.00 H new ATOM 0 HB2 LYS A 24 43.083 36.126 30.000 1.00 0.00 H new ATOM 0 HB3 LYS A 24 44.604 35.327 29.654 1.00 0.00 H new ATOM 0 HG2 LYS A 24 45.843 37.393 29.988 1.00 0.00 H new ATOM 0 HG3 LYS A 24 44.361 38.318 30.123 1.00 0.00 H new ATOM 0 HD2 LYS A 24 43.737 36.976 32.151 1.00 0.00 H new ATOM 0 HD3 LYS A 24 45.260 36.118 32.029 1.00 0.00 H new ATOM 0 HE2 LYS A 24 44.961 39.123 32.407 1.00 0.00 H new ATOM 0 HE3 LYS A 24 45.347 37.978 33.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 47.360 38.948 32.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 47.353 37.357 32.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 47.008 38.653 31.307 1.00 0.00 H new ATOM 410 N SER A 25 43.515 34.607 26.637 1.00 0.00 N ATOM 411 CA SER A 25 42.704 33.570 26.011 1.00 0.00 C ATOM 412 C SER A 25 43.061 32.194 26.566 1.00 0.00 C ATOM 413 O SER A 25 44.227 31.802 26.592 1.00 0.00 O ATOM 414 CB SER A 25 42.899 33.585 24.494 1.00 0.00 C ATOM 415 OG SER A 25 42.845 34.907 23.987 1.00 0.00 O ATOM 0 H SER A 25 44.508 34.568 26.408 1.00 0.00 H new ATOM 0 HA SER A 25 41.658 33.776 26.237 1.00 0.00 H new ATOM 0 HB2 SER A 25 43.859 33.135 24.243 1.00 0.00 H new ATOM 0 HB3 SER A 25 42.128 32.978 24.019 1.00 0.00 H new ATOM 0 HG SER A 25 42.974 34.890 23.016 1.00 0.00 H new ATOM 421 N PHE A 26 42.039 31.468 27.006 1.00 0.00 N ATOM 422 CA PHE A 26 42.208 30.116 27.575 1.00 0.00 C ATOM 423 C PHE A 26 42.514 29.037 26.530 1.00 0.00 C ATOM 424 O PHE A 26 41.875 28.983 25.479 1.00 0.00 O ATOM 425 CB PHE A 26 40.958 29.720 28.363 1.00 0.00 C ATOM 426 CG PHE A 26 41.249 29.219 29.748 1.00 0.00 C ATOM 427 CD1 PHE A 26 42.547 29.190 30.229 1.00 0.00 C ATOM 428 CD2 PHE A 26 40.225 28.774 30.569 1.00 0.00 C ATOM 429 CE1 PHE A 26 42.820 28.728 31.503 1.00 0.00 C ATOM 430 CE2 PHE A 26 40.491 28.312 31.844 1.00 0.00 C ATOM 431 CZ PHE A 26 41.790 28.289 32.312 1.00 0.00 C ATOM 0 H PHE A 26 41.071 31.789 26.983 1.00 0.00 H new ATOM 0 HA PHE A 26 43.077 30.172 28.230 1.00 0.00 H new ATOM 0 HB2 PHE A 26 40.294 30.582 28.430 1.00 0.00 H new ATOM 0 HB3 PHE A 26 40.422 28.947 27.812 1.00 0.00 H new ATOM 0 HD1 PHE A 26 43.356 29.533 29.601 1.00 0.00 H new ATOM 0 HD2 PHE A 26 39.207 28.788 30.208 1.00 0.00 H new ATOM 0 HE1 PHE A 26 43.837 28.710 31.865 1.00 0.00 H new ATOM 0 HE2 PHE A 26 39.684 27.969 32.474 1.00 0.00 H new ATOM 0 HZ PHE A 26 42.000 27.929 33.308 1.00 0.00 H new ATOM 441 N THR A 27 43.493 28.181 26.825 1.00 0.00 N ATOM 442 CA THR A 27 43.894 27.132 25.863 1.00 0.00 C ATOM 443 C THR A 27 43.098 25.830 26.021 1.00 0.00 C ATOM 444 O THR A 27 42.745 25.419 27.129 1.00 0.00 O ATOM 445 CB THR A 27 45.402 26.831 25.939 1.00 0.00 C ATOM 446 OG1 THR A 27 45.752 26.348 27.216 1.00 0.00 O ATOM 447 CG2 THR A 27 46.245 28.070 25.650 1.00 0.00 C ATOM 0 H THR A 27 44.018 28.184 27.700 1.00 0.00 H new ATOM 0 HA THR A 27 43.662 27.542 24.880 1.00 0.00 H new ATOM 0 HB THR A 27 45.605 26.075 25.180 1.00 0.00 H new ATOM 0 HG1 THR A 27 46.714 26.161 27.243 1.00 0.00 H new ATOM 0 HG21 THR A 27 47.302 27.814 25.714 1.00 0.00 H new ATOM 0 HG22 THR A 27 46.021 28.437 24.649 1.00 0.00 H new ATOM 0 HG23 THR A 27 46.015 28.845 26.381 1.00 0.00 H new ATOM 455 N TYR A 28 42.853 25.128 24.905 1.00 0.00 N ATOM 456 CA TYR A 28 42.067 23.882 24.892 1.00 0.00 C ATOM 457 C TYR A 28 42.621 22.798 25.824 1.00 0.00 C ATOM 458 O TYR A 28 41.829 22.110 26.462 1.00 0.00 O ATOM 459 CB TYR A 28 41.981 23.299 23.469 1.00 0.00 C ATOM 460 CG TYR A 28 40.930 23.896 22.555 1.00 0.00 C ATOM 461 CD1 TYR A 28 39.597 24.023 23.000 1.00 0.00 C ATOM 462 CD2 TYR A 28 41.256 24.211 21.220 1.00 0.00 C ATOM 463 CE1 TYR A 28 38.599 24.474 22.119 1.00 0.00 C ATOM 464 CE2 TYR A 28 40.254 24.651 20.334 1.00 0.00 C ATOM 465 CZ TYR A 28 38.924 24.789 20.786 1.00 0.00 C ATOM 466 OH TYR A 28 37.955 25.207 19.936 1.00 0.00 O ATOM 0 H TYR A 28 43.194 25.407 23.985 1.00 0.00 H new ATOM 0 HA TYR A 28 41.078 24.165 25.254 1.00 0.00 H new ATOM 0 HB2 TYR A 28 42.954 23.418 22.993 1.00 0.00 H new ATOM 0 HB3 TYR A 28 41.794 22.228 23.550 1.00 0.00 H new ATOM 0 HD1 TYR A 28 39.343 23.773 24.020 1.00 0.00 H new ATOM 0 HD2 TYR A 28 42.275 24.115 20.877 1.00 0.00 H new ATOM 0 HE1 TYR A 28 37.581 24.579 22.465 1.00 0.00 H new ATOM 0 HE2 TYR A 28 40.503 24.883 19.309 1.00 0.00 H new ATOM 0 HH TYR A 28 38.212 26.068 19.545 1.00 0.00 H new ATOM 476 N THR A 29 43.948 22.656 25.950 1.00 0.00 N ATOM 477 CA THR A 29 44.567 21.689 26.877 1.00 0.00 C ATOM 478 C THR A 29 44.108 21.907 28.323 1.00 0.00 C ATOM 479 O THR A 29 43.681 20.962 28.988 1.00 0.00 O ATOM 480 CB THR A 29 46.106 21.699 26.775 1.00 0.00 C ATOM 481 OG1 THR A 29 46.622 20.623 27.522 1.00 0.00 O ATOM 482 CG2 THR A 29 46.788 22.965 27.302 1.00 0.00 C ATOM 0 H THR A 29 44.623 23.204 25.416 1.00 0.00 H new ATOM 0 HA THR A 29 44.224 20.701 26.571 1.00 0.00 H new ATOM 0 HB THR A 29 46.317 21.636 25.707 1.00 0.00 H new ATOM 0 HG1 THR A 29 47.600 20.622 27.461 1.00 0.00 H new ATOM 0 HG21 THR A 29 47.868 22.872 27.185 1.00 0.00 H new ATOM 0 HG22 THR A 29 46.435 23.829 26.739 1.00 0.00 H new ATOM 0 HG23 THR A 29 46.547 23.096 28.357 1.00 0.00 H new ATOM 490 N LYS A 30 44.116 23.159 28.800 1.00 0.00 N ATOM 491 CA LYS A 30 43.710 23.490 30.169 1.00 0.00 C ATOM 492 C LYS A 30 42.198 23.370 30.348 1.00 0.00 C ATOM 493 O LYS A 30 41.749 22.757 31.314 1.00 0.00 O ATOM 494 CB LYS A 30 44.226 24.898 30.514 1.00 0.00 C ATOM 495 CG LYS A 30 44.242 25.198 32.022 1.00 0.00 C ATOM 496 CD LYS A 30 45.136 24.220 32.799 1.00 0.00 C ATOM 497 CE LYS A 30 45.562 24.825 34.139 1.00 0.00 C ATOM 498 NZ LYS A 30 46.644 24.037 34.769 1.00 0.00 N1+ ATOM 0 H LYS A 30 44.403 23.967 28.248 1.00 0.00 H new ATOM 0 HA LYS A 30 44.152 22.775 30.863 1.00 0.00 H new ATOM 0 HB2 LYS A 30 45.235 25.012 30.119 1.00 0.00 H new ATOM 0 HB3 LYS A 30 43.602 25.637 30.012 1.00 0.00 H new ATOM 0 HG2 LYS A 30 44.594 26.217 32.184 1.00 0.00 H new ATOM 0 HG3 LYS A 30 43.225 25.146 32.412 1.00 0.00 H new ATOM 0 HD2 LYS A 30 44.600 23.286 32.970 1.00 0.00 H new ATOM 0 HD3 LYS A 30 46.018 23.977 32.207 1.00 0.00 H new ATOM 0 HE2 LYS A 30 45.899 25.850 33.986 1.00 0.00 H new ATOM 0 HE3 LYS A 30 44.704 24.868 34.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 46.909 24.474 35.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 46.313 23.065 34.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 47.471 24.017 34.139 1.00 0.00 H new ATOM 512 N LEU A 31 41.426 23.894 29.393 1.00 0.00 N ATOM 513 CA LEU A 31 39.961 23.861 29.417 1.00 0.00 C ATOM 514 C LEU A 31 39.398 22.426 29.333 1.00 0.00 C ATOM 515 O LEU A 31 38.379 22.140 29.959 1.00 0.00 O ATOM 516 CB LEU A 31 39.412 24.762 28.284 1.00 0.00 C ATOM 517 CG LEU A 31 38.810 26.091 28.773 1.00 0.00 C ATOM 518 CD1 LEU A 31 38.360 26.929 27.576 1.00 0.00 C ATOM 519 CD2 LEU A 31 37.596 25.881 29.685 1.00 0.00 C ATOM 0 H LEU A 31 41.806 24.360 28.569 1.00 0.00 H new ATOM 0 HA LEU A 31 39.625 24.250 30.378 1.00 0.00 H new ATOM 0 HB2 LEU A 31 40.218 24.977 27.583 1.00 0.00 H new ATOM 0 HB3 LEU A 31 38.649 24.211 27.734 1.00 0.00 H new ATOM 0 HG LEU A 31 39.590 26.599 29.340 1.00 0.00 H new ATOM 0 HD11 LEU A 31 37.935 27.869 27.929 1.00 0.00 H new ATOM 0 HD12 LEU A 31 39.217 27.137 26.935 1.00 0.00 H new ATOM 0 HD13 LEU A 31 37.607 26.380 27.010 1.00 0.00 H new ATOM 0 HD21 LEU A 31 37.208 26.849 30.003 1.00 0.00 H new ATOM 0 HD22 LEU A 31 36.821 25.341 29.141 1.00 0.00 H new ATOM 0 HD23 LEU A 31 37.894 25.304 30.561 1.00 0.00 H new ATOM 531 N CYS A 32 40.064 21.519 28.612 1.00 0.00 N ATOM 532 CA CYS A 32 39.754 20.084 28.543 1.00 0.00 C ATOM 533 C CYS A 32 39.838 19.415 29.929 1.00 0.00 C ATOM 534 O CYS A 32 38.836 18.917 30.448 1.00 0.00 O ATOM 535 CB CYS A 32 40.742 19.472 27.529 1.00 0.00 C ATOM 536 SG CYS A 32 40.675 17.663 27.481 1.00 0.00 S ATOM 0 H CYS A 32 40.867 21.773 28.036 1.00 0.00 H new ATOM 0 HA CYS A 32 38.727 19.919 28.216 1.00 0.00 H new ATOM 0 HB2 CYS A 32 40.525 19.865 26.536 1.00 0.00 H new ATOM 0 HB3 CYS A 32 41.755 19.786 27.782 1.00 0.00 H new ATOM 0 HG CYS A 32 39.573 17.255 28.038 1.00 0.00 H new ATOM 542 N ASN A 33 41.008 19.448 30.558 1.00 0.00 N ATOM 543 CA ASN A 33 41.193 18.762 31.840 1.00 0.00 C ATOM 544 C ASN A 33 40.281 19.255 32.965 1.00 0.00 C ATOM 545 O ASN A 33 39.741 18.452 33.726 1.00 0.00 O ATOM 546 CB ASN A 33 42.653 18.882 32.285 1.00 0.00 C ATOM 547 CG ASN A 33 42.912 18.213 33.621 1.00 0.00 C ATOM 548 OD1 ASN A 33 42.067 17.482 34.137 1.00 0.00 O ATOM 549 ND2 ASN A 33 44.088 18.460 34.187 1.00 0.00 N ATOM 0 H ASN A 33 41.835 19.934 30.210 1.00 0.00 H new ATOM 0 HA ASN A 33 40.916 17.723 31.659 1.00 0.00 H new ATOM 0 HB2 ASN A 33 43.298 18.435 31.528 1.00 0.00 H new ATOM 0 HB3 ASN A 33 42.923 19.936 32.352 1.00 0.00 H new ATOM 0 HD21 ASN A 33 44.320 18.037 35.086 1.00 0.00 H new ATOM 0 HD22 ASN A 33 44.759 19.073 33.723 1.00 0.00 H new ATOM 556 N ILE A 34 40.110 20.554 33.080 1.00 0.00 N ATOM 557 CA ILE A 34 39.256 21.136 34.112 1.00 0.00 C ATOM 558 C ILE A 34 37.793 20.723 33.944 1.00 0.00 C ATOM 559 O ILE A 34 37.077 20.489 34.918 1.00 0.00 O ATOM 560 CB ILE A 34 39.342 22.673 34.102 1.00 0.00 C ATOM 561 CG1 ILE A 34 38.776 23.229 32.794 1.00 0.00 C ATOM 562 CG2 ILE A 34 40.783 23.123 34.285 1.00 0.00 C ATOM 563 CD1 ILE A 34 38.860 24.736 32.685 1.00 0.00 C ATOM 0 H ILE A 34 40.553 21.240 32.468 1.00 0.00 H new ATOM 0 HA ILE A 34 39.622 20.754 35.065 1.00 0.00 H new ATOM 0 HB ILE A 34 38.748 23.059 34.931 1.00 0.00 H new ATOM 0 HG12 ILE A 34 39.314 22.783 31.957 1.00 0.00 H new ATOM 0 HG13 ILE A 34 37.733 22.925 32.701 1.00 0.00 H new ATOM 0 HG21 ILE A 34 40.828 24.212 34.276 1.00 0.00 H new ATOM 0 HG22 ILE A 34 41.162 22.752 35.237 1.00 0.00 H new ATOM 0 HG23 ILE A 34 41.393 22.728 33.473 1.00 0.00 H new ATOM 0 HD11 ILE A 34 38.440 25.056 31.731 1.00 0.00 H new ATOM 0 HD12 ILE A 34 38.298 25.192 33.500 1.00 0.00 H new ATOM 0 HD13 ILE A 34 39.903 25.048 32.745 1.00 0.00 H new ATOM 575 N SER A 35 37.367 20.655 32.680 1.00 0.00 N ATOM 576 CA SER A 35 35.975 20.337 32.331 1.00 0.00 C ATOM 577 C SER A 35 35.583 18.870 32.575 1.00 0.00 C ATOM 578 O SER A 35 34.395 18.550 32.453 1.00 0.00 O ATOM 579 CB SER A 35 35.681 20.711 30.875 1.00 0.00 C ATOM 580 OG SER A 35 35.833 22.096 30.658 1.00 0.00 O ATOM 0 H SER A 35 37.970 20.817 31.873 1.00 0.00 H new ATOM 0 HA SER A 35 35.366 20.938 33.006 1.00 0.00 H new ATOM 0 HB2 SER A 35 36.352 20.162 30.214 1.00 0.00 H new ATOM 0 HB3 SER A 35 34.665 20.411 30.619 1.00 0.00 H new ATOM 0 HG SER A 35 36.736 22.278 30.324 1.00 0.00 H new ATOM 586 N LYS A 36 36.538 17.988 32.925 1.00 0.00 N ATOM 587 CA LYS A 36 36.340 16.547 33.207 1.00 0.00 C ATOM 588 C LYS A 36 35.911 15.695 32.002 1.00 0.00 C ATOM 589 O LYS A 36 35.002 14.866 32.113 1.00 0.00 O ATOM 590 CB LYS A 36 35.397 16.355 34.407 1.00 0.00 C ATOM 591 CG LYS A 36 35.923 16.959 35.720 1.00 0.00 C ATOM 592 CD LYS A 36 34.887 16.818 36.842 1.00 0.00 C ATOM 593 CE LYS A 36 35.318 17.635 38.065 1.00 0.00 C ATOM 594 NZ LYS A 36 34.297 17.579 39.136 1.00 0.00 N1+ ATOM 0 H LYS A 36 37.513 18.269 33.024 1.00 0.00 H new ATOM 0 HA LYS A 36 37.329 16.165 33.460 1.00 0.00 H new ATOM 0 HB2 LYS A 36 34.432 16.805 34.173 1.00 0.00 H new ATOM 0 HB3 LYS A 36 35.224 15.289 34.553 1.00 0.00 H new ATOM 0 HG2 LYS A 36 36.848 16.460 36.009 1.00 0.00 H new ATOM 0 HG3 LYS A 36 36.162 18.012 35.570 1.00 0.00 H new ATOM 0 HD2 LYS A 36 33.913 17.159 36.492 1.00 0.00 H new ATOM 0 HD3 LYS A 36 34.778 15.769 37.116 1.00 0.00 H new ATOM 0 HE2 LYS A 36 36.267 17.254 38.444 1.00 0.00 H new ATOM 0 HE3 LYS A 36 35.485 18.672 37.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 34.617 18.141 39.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 33.399 17.965 38.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 34.157 16.592 39.431 1.00 0.00 H new ATOM 608 N LEU A 37 36.489 15.942 30.826 1.00 0.00 N ATOM 609 CA LEU A 37 36.018 15.371 29.569 1.00 0.00 C ATOM 610 C LEU A 37 37.092 15.336 28.468 1.00 0.00 C ATOM 611 O LEU A 37 38.189 15.866 28.638 1.00 0.00 O ATOM 612 CB LEU A 37 34.753 16.157 29.185 1.00 0.00 C ATOM 613 CG LEU A 37 34.834 17.699 29.151 1.00 0.00 C ATOM 614 CD1 LEU A 37 35.744 18.294 28.084 1.00 0.00 C ATOM 615 CD2 LEU A 37 33.431 18.270 28.948 1.00 0.00 C ATOM 0 H LEU A 37 37.302 16.548 30.721 1.00 0.00 H new ATOM 0 HA LEU A 37 35.780 14.315 29.693 1.00 0.00 H new ATOM 0 HB2 LEU A 37 34.437 15.818 28.198 1.00 0.00 H new ATOM 0 HB3 LEU A 37 33.964 15.880 29.884 1.00 0.00 H new ATOM 0 HG LEU A 37 35.275 17.976 30.109 1.00 0.00 H new ATOM 0 HD11 LEU A 37 35.723 19.382 28.153 1.00 0.00 H new ATOM 0 HD12 LEU A 37 36.764 17.940 28.237 1.00 0.00 H new ATOM 0 HD13 LEU A 37 35.397 17.987 27.097 1.00 0.00 H new ATOM 0 HD21 LEU A 37 33.481 19.359 28.923 1.00 0.00 H new ATOM 0 HD22 LEU A 37 33.022 17.904 28.006 1.00 0.00 H new ATOM 0 HD23 LEU A 37 32.788 17.955 29.770 1.00 0.00 H new ATOM 627 N SER A 38 36.767 14.702 27.338 1.00 0.00 N ATOM 628 CA SER A 38 37.598 14.654 26.130 1.00 0.00 C ATOM 629 C SER A 38 37.758 16.019 25.456 1.00 0.00 C ATOM 630 O SER A 38 36.789 16.776 25.338 1.00 0.00 O ATOM 631 CB SER A 38 36.965 13.717 25.097 1.00 0.00 C ATOM 632 OG SER A 38 36.843 12.411 25.611 1.00 0.00 O ATOM 0 H SER A 38 35.890 14.191 27.235 1.00 0.00 H new ATOM 0 HA SER A 38 38.577 14.304 26.456 1.00 0.00 H new ATOM 0 HB2 SER A 38 35.982 14.093 24.813 1.00 0.00 H new ATOM 0 HB3 SER A 38 37.574 13.701 24.193 1.00 0.00 H new ATOM 0 HG SER A 38 36.435 11.830 24.935 1.00 0.00 H new ATOM 638 N MET A 39 38.933 16.299 24.878 1.00 0.00 N ATOM 639 CA MET A 39 39.175 17.560 24.155 1.00 0.00 C ATOM 640 C MET A 39 38.155 17.813 23.029 1.00 0.00 C ATOM 641 O MET A 39 37.720 18.949 22.832 1.00 0.00 O ATOM 642 CB MET A 39 40.612 17.600 23.605 1.00 0.00 C ATOM 643 CG MET A 39 40.841 18.868 22.767 1.00 0.00 C ATOM 644 SD MET A 39 42.549 19.177 22.248 1.00 0.00 S ATOM 645 CE MET A 39 42.785 17.850 21.031 1.00 0.00 C ATOM 0 H MET A 39 39.735 15.669 24.896 1.00 0.00 H new ATOM 0 HA MET A 39 39.045 18.365 24.878 1.00 0.00 H new ATOM 0 HB2 MET A 39 41.323 17.571 24.431 1.00 0.00 H new ATOM 0 HB3 MET A 39 40.797 16.717 22.994 1.00 0.00 H new ATOM 0 HG2 MET A 39 40.216 18.809 21.876 1.00 0.00 H new ATOM 0 HG3 MET A 39 40.496 19.727 23.342 1.00 0.00 H new ATOM 0 HE1 MET A 39 43.793 17.908 20.621 1.00 0.00 H new ATOM 0 HE2 MET A 39 42.645 16.883 21.515 1.00 0.00 H new ATOM 0 HE3 MET A 39 42.059 17.961 20.226 1.00 0.00 H new ATOM 655 N SER A 40 37.728 16.763 22.324 1.00 0.00 N ATOM 656 CA SER A 40 36.695 16.830 21.284 1.00 0.00 C ATOM 657 C SER A 40 35.409 17.513 21.772 1.00 0.00 C ATOM 658 O SER A 40 34.824 18.307 21.036 1.00 0.00 O ATOM 659 CB SER A 40 36.376 15.415 20.781 1.00 0.00 C ATOM 660 OG SER A 40 37.581 14.716 20.514 1.00 0.00 O ATOM 0 H SER A 40 38.097 15.822 22.462 1.00 0.00 H new ATOM 0 HA SER A 40 37.092 17.438 20.471 1.00 0.00 H new ATOM 0 HB2 SER A 40 35.791 14.877 21.527 1.00 0.00 H new ATOM 0 HB3 SER A 40 35.768 15.469 19.878 1.00 0.00 H new ATOM 0 HG SER A 40 37.372 13.813 20.195 1.00 0.00 H new ATOM 666 N THR A 41 35.000 17.286 23.024 1.00 0.00 N ATOM 667 CA THR A 41 33.779 17.866 23.606 1.00 0.00 C ATOM 668 C THR A 41 33.928 19.362 23.904 1.00 0.00 C ATOM 669 O THR A 41 33.025 20.136 23.589 1.00 0.00 O ATOM 670 CB THR A 41 33.363 17.100 24.873 1.00 0.00 C ATOM 671 OG1 THR A 41 33.315 15.721 24.595 1.00 0.00 O ATOM 672 CG2 THR A 41 31.977 17.499 25.372 1.00 0.00 C ATOM 0 H THR A 41 35.512 16.687 23.672 1.00 0.00 H new ATOM 0 HA THR A 41 32.992 17.765 22.859 1.00 0.00 H new ATOM 0 HB THR A 41 34.102 17.342 25.637 1.00 0.00 H new ATOM 0 HG1 THR A 41 33.052 15.233 25.403 1.00 0.00 H new ATOM 0 HG21 THR A 41 31.734 16.928 26.268 1.00 0.00 H new ATOM 0 HG22 THR A 41 31.967 18.563 25.607 1.00 0.00 H new ATOM 0 HG23 THR A 41 31.238 17.291 24.598 1.00 0.00 H new ATOM 680 N VAL A 42 35.072 19.809 24.446 1.00 0.00 N ATOM 681 CA VAL A 42 35.310 21.248 24.708 1.00 0.00 C ATOM 682 C VAL A 42 35.500 22.060 23.424 1.00 0.00 C ATOM 683 O VAL A 42 35.072 23.207 23.328 1.00 0.00 O ATOM 684 CB VAL A 42 36.453 21.474 25.710 1.00 0.00 C ATOM 685 CG1 VAL A 42 37.849 21.114 25.213 1.00 0.00 C ATOM 686 CG2 VAL A 42 36.491 22.929 26.186 1.00 0.00 C ATOM 0 H VAL A 42 35.847 19.202 24.712 1.00 0.00 H new ATOM 0 HA VAL A 42 34.401 21.626 25.175 1.00 0.00 H new ATOM 0 HB VAL A 42 36.214 20.785 26.520 1.00 0.00 H new ATOM 0 HG11 VAL A 42 38.578 21.313 25.999 1.00 0.00 H new ATOM 0 HG12 VAL A 42 37.880 20.057 24.948 1.00 0.00 H new ATOM 0 HG13 VAL A 42 38.089 21.715 24.336 1.00 0.00 H new ATOM 0 HG21 VAL A 42 37.310 23.059 26.894 1.00 0.00 H new ATOM 0 HG22 VAL A 42 36.643 23.588 25.331 1.00 0.00 H new ATOM 0 HG23 VAL A 42 35.548 23.177 26.673 1.00 0.00 H new ATOM 696 N ARG A 43 36.083 21.435 22.401 1.00 0.00 N ATOM 697 CA ARG A 43 36.200 21.945 21.041 1.00 0.00 C ATOM 698 C ARG A 43 34.831 22.151 20.378 1.00 0.00 C ATOM 699 O ARG A 43 34.608 23.182 19.750 1.00 0.00 O ATOM 700 CB ARG A 43 37.117 20.934 20.346 1.00 0.00 C ATOM 701 CG ARG A 43 37.453 21.251 18.900 1.00 0.00 C ATOM 702 CD ARG A 43 38.513 20.240 18.444 1.00 0.00 C ATOM 703 NE ARG A 43 38.796 20.324 17.004 1.00 0.00 N ATOM 704 CZ ARG A 43 39.971 20.272 16.410 1.00 0.00 C ATOM 705 NH1 ARG A 43 41.059 20.132 17.116 1.00 0.00 N ATOM 706 NH2 ARG A 43 40.056 20.349 15.120 1.00 0.00 N ATOM 0 H ARG A 43 36.507 20.513 22.507 1.00 0.00 H new ATOM 0 HA ARG A 43 36.627 22.946 20.987 1.00 0.00 H new ATOM 0 HB2 ARG A 43 38.047 20.863 20.911 1.00 0.00 H new ATOM 0 HB3 ARG A 43 36.644 19.953 20.385 1.00 0.00 H new ATOM 0 HG2 ARG A 43 36.563 21.182 18.275 1.00 0.00 H new ATOM 0 HG3 ARG A 43 37.829 22.270 18.808 1.00 0.00 H new ATOM 0 HD2 ARG A 43 39.434 20.410 19.001 1.00 0.00 H new ATOM 0 HD3 ARG A 43 38.175 19.232 18.685 1.00 0.00 H new ATOM 0 HE ARG A 43 37.987 20.436 16.392 1.00 0.00 H new ATOM 0 HH11 ARG A 43 41.002 20.062 18.132 1.00 0.00 H new ATOM 0 HH12 ARG A 43 41.966 20.092 16.652 1.00 0.00 H new ATOM 0 HH21 ARG A 43 39.211 20.450 14.558 1.00 0.00 H new ATOM 0 HH22 ARG A 43 40.968 20.308 14.666 1.00 0.00 H new ATOM 720 N ARG A 44 33.879 21.229 20.585 1.00 0.00 N ATOM 721 CA ARG A 44 32.485 21.346 20.107 1.00 0.00 C ATOM 722 C ARG A 44 31.737 22.506 20.768 1.00 0.00 C ATOM 723 O ARG A 44 31.171 23.340 20.061 1.00 0.00 O ATOM 724 CB ARG A 44 31.737 20.019 20.341 1.00 0.00 C ATOM 725 CG ARG A 44 32.225 18.881 19.430 1.00 0.00 C ATOM 726 CD ARG A 44 31.594 18.902 18.042 1.00 0.00 C ATOM 727 NE ARG A 44 30.174 18.532 18.092 1.00 0.00 N ATOM 728 CZ ARG A 44 29.437 18.166 17.069 1.00 0.00 C ATOM 729 NH1 ARG A 44 29.942 18.144 15.869 1.00 0.00 N ATOM 730 NH2 ARG A 44 28.204 17.824 17.244 1.00 0.00 N ATOM 0 H ARG A 44 34.055 20.365 21.098 1.00 0.00 H new ATOM 0 HA ARG A 44 32.522 21.561 19.039 1.00 0.00 H new ATOM 0 HB2 ARG A 44 31.858 19.720 21.382 1.00 0.00 H new ATOM 0 HB3 ARG A 44 30.671 20.176 20.176 1.00 0.00 H new ATOM 0 HG2 ARG A 44 33.308 18.946 19.329 1.00 0.00 H new ATOM 0 HG3 ARG A 44 32.006 17.925 19.906 1.00 0.00 H new ATOM 0 HD2 ARG A 44 31.697 19.897 17.609 1.00 0.00 H new ATOM 0 HD3 ARG A 44 32.128 18.213 17.388 1.00 0.00 H new ATOM 0 HE ARG A 44 29.719 18.562 19.004 1.00 0.00 H new ATOM 0 HH11 ARG A 44 30.915 18.412 15.720 1.00 0.00 H new ATOM 0 HH12 ARG A 44 29.365 17.859 15.078 1.00 0.00 H new ATOM 0 HH21 ARG A 44 27.799 17.838 18.180 1.00 0.00 H new ATOM 0 HH22 ARG A 44 27.635 17.540 16.446 1.00 0.00 H new ATOM 744 N SER A 45 31.747 22.583 22.102 1.00 0.00 N ATOM 745 CA SER A 45 31.056 23.648 22.850 1.00 0.00 C ATOM 746 C SER A 45 31.650 25.031 22.542 1.00 0.00 C ATOM 747 O SER A 45 30.894 25.932 22.191 1.00 0.00 O ATOM 748 CB SER A 45 31.069 23.345 24.353 1.00 0.00 C ATOM 749 OG SER A 45 32.385 23.137 24.812 1.00 0.00 O ATOM 0 H SER A 45 32.233 21.912 22.697 1.00 0.00 H new ATOM 0 HA SER A 45 30.017 23.672 22.523 1.00 0.00 H new ATOM 0 HB2 SER A 45 30.616 24.172 24.899 1.00 0.00 H new ATOM 0 HB3 SER A 45 30.465 22.461 24.555 1.00 0.00 H new ATOM 0 HG SER A 45 32.362 22.647 25.660 1.00 0.00 H new ATOM 755 N ILE A 46 32.982 25.199 22.543 1.00 0.00 N ATOM 756 CA ILE A 46 33.633 26.462 22.137 1.00 0.00 C ATOM 757 C ILE A 46 33.266 26.877 20.704 1.00 0.00 C ATOM 758 O ILE A 46 32.959 28.051 20.500 1.00 0.00 O ATOM 759 CB ILE A 46 35.169 26.394 22.348 1.00 0.00 C ATOM 760 CG1 ILE A 46 35.540 26.591 23.842 1.00 0.00 C ATOM 761 CG2 ILE A 46 35.982 27.374 21.478 1.00 0.00 C ATOM 762 CD1 ILE A 46 35.491 28.022 24.384 1.00 0.00 C ATOM 0 H ILE A 46 33.638 24.470 22.823 1.00 0.00 H new ATOM 0 HA ILE A 46 33.246 27.246 22.788 1.00 0.00 H new ATOM 0 HB ILE A 46 35.447 25.392 22.022 1.00 0.00 H new ATOM 0 HG12 ILE A 46 34.868 25.977 24.442 1.00 0.00 H new ATOM 0 HG13 ILE A 46 36.547 26.204 23.995 1.00 0.00 H new ATOM 0 HG21 ILE A 46 37.044 27.256 21.693 1.00 0.00 H new ATOM 0 HG22 ILE A 46 35.799 27.163 20.424 1.00 0.00 H new ATOM 0 HG23 ILE A 46 35.678 28.397 21.701 1.00 0.00 H new ATOM 0 HD11 ILE A 46 35.771 28.022 25.437 1.00 0.00 H new ATOM 0 HD12 ILE A 46 36.186 28.647 23.824 1.00 0.00 H new ATOM 0 HD13 ILE A 46 34.481 28.417 24.277 1.00 0.00 H new ATOM 774 N LYS A 47 33.216 25.957 19.724 1.00 0.00 N ATOM 775 CA LYS A 47 32.906 26.318 18.324 1.00 0.00 C ATOM 776 C LYS A 47 31.489 26.881 18.212 1.00 0.00 C ATOM 777 O LYS A 47 31.273 27.879 17.533 1.00 0.00 O ATOM 778 CB LYS A 47 33.114 25.119 17.373 1.00 0.00 C ATOM 779 CG LYS A 47 33.170 25.577 15.901 1.00 0.00 C ATOM 780 CD LYS A 47 33.124 24.410 14.900 1.00 0.00 C ATOM 781 CE LYS A 47 33.366 24.933 13.474 1.00 0.00 C ATOM 782 NZ LYS A 47 32.983 23.947 12.434 1.00 0.00 N1+ ATOM 0 H LYS A 47 33.385 24.962 19.872 1.00 0.00 H new ATOM 0 HA LYS A 47 33.602 27.098 18.016 1.00 0.00 H new ATOM 0 HB2 LYS A 47 34.039 24.603 17.631 1.00 0.00 H new ATOM 0 HB3 LYS A 47 32.302 24.403 17.503 1.00 0.00 H new ATOM 0 HG2 LYS A 47 32.334 26.249 15.704 1.00 0.00 H new ATOM 0 HG3 LYS A 47 34.084 26.149 15.740 1.00 0.00 H new ATOM 0 HD2 LYS A 47 33.880 23.668 15.158 1.00 0.00 H new ATOM 0 HD3 LYS A 47 32.156 23.911 14.954 1.00 0.00 H new ATOM 0 HE2 LYS A 47 32.798 25.851 13.326 1.00 0.00 H new ATOM 0 HE3 LYS A 47 34.419 25.188 13.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 33.165 24.348 11.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 33.543 23.079 12.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 31.972 23.722 12.525 1.00 0.00 H new ATOM 796 N LYS A 48 30.534 26.291 18.937 1.00 0.00 N ATOM 797 CA LYS A 48 29.166 26.812 19.067 1.00 0.00 C ATOM 798 C LYS A 48 29.090 28.117 19.869 1.00 0.00 C ATOM 799 O LYS A 48 28.336 29.014 19.505 1.00 0.00 O ATOM 800 CB LYS A 48 28.284 25.710 19.674 1.00 0.00 C ATOM 801 CG LYS A 48 27.864 24.703 18.587 1.00 0.00 C ATOM 802 CD LYS A 48 26.602 23.917 18.964 1.00 0.00 C ATOM 803 CE LYS A 48 26.235 22.980 17.805 1.00 0.00 C ATOM 804 NZ LYS A 48 24.875 22.420 17.952 1.00 0.00 N1+ ATOM 0 H LYS A 48 30.689 25.427 19.457 1.00 0.00 H new ATOM 0 HA LYS A 48 28.799 27.076 18.075 1.00 0.00 H new ATOM 0 HB2 LYS A 48 28.827 25.195 20.466 1.00 0.00 H new ATOM 0 HB3 LYS A 48 27.399 26.153 20.130 1.00 0.00 H new ATOM 0 HG2 LYS A 48 27.690 25.236 17.652 1.00 0.00 H new ATOM 0 HG3 LYS A 48 28.682 24.005 18.409 1.00 0.00 H new ATOM 0 HD2 LYS A 48 26.774 23.342 19.874 1.00 0.00 H new ATOM 0 HD3 LYS A 48 25.779 24.601 19.170 1.00 0.00 H new ATOM 0 HE2 LYS A 48 26.302 23.525 16.863 1.00 0.00 H new ATOM 0 HE3 LYS A 48 26.958 22.166 17.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 24.669 21.793 17.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 24.817 21.878 18.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 24.181 23.194 17.974 1.00 0.00 H new ATOM 818 N PHE A 49 29.888 28.276 20.925 1.00 0.00 N ATOM 819 CA PHE A 49 29.878 29.489 21.755 1.00 0.00 C ATOM 820 C PHE A 49 30.450 30.729 21.034 1.00 0.00 C ATOM 821 O PHE A 49 30.192 31.848 21.484 1.00 0.00 O ATOM 822 CB PHE A 49 30.558 29.217 23.108 1.00 0.00 C ATOM 823 CG PHE A 49 29.816 28.329 24.111 1.00 0.00 C ATOM 824 CD1 PHE A 49 28.675 27.569 23.764 1.00 0.00 C ATOM 825 CD2 PHE A 49 30.279 28.287 25.442 1.00 0.00 C ATOM 826 CE1 PHE A 49 28.015 26.785 24.726 1.00 0.00 C ATOM 827 CE2 PHE A 49 29.612 27.507 26.406 1.00 0.00 C ATOM 828 CZ PHE A 49 28.481 26.756 26.048 1.00 0.00 C ATOM 0 H PHE A 49 30.559 27.572 21.232 1.00 0.00 H new ATOM 0 HA PHE A 49 28.836 29.742 21.949 1.00 0.00 H new ATOM 0 HB2 PHE A 49 31.528 28.761 22.910 1.00 0.00 H new ATOM 0 HB3 PHE A 49 30.748 30.177 23.587 1.00 0.00 H new ATOM 0 HD1 PHE A 49 28.307 27.591 22.749 1.00 0.00 H new ATOM 0 HD2 PHE A 49 31.152 28.857 25.724 1.00 0.00 H new ATOM 0 HE1 PHE A 49 27.148 26.204 24.447 1.00 0.00 H new ATOM 0 HE2 PHE A 49 29.972 27.486 27.424 1.00 0.00 H new ATOM 0 HZ PHE A 49 27.971 26.158 26.789 1.00 0.00 H new ATOM 838 N LEU A 50 31.132 30.559 19.892 1.00 0.00 N ATOM 839 CA LEU A 50 31.434 31.648 18.948 1.00 0.00 C ATOM 840 C LEU A 50 30.166 32.313 18.388 1.00 0.00 C ATOM 841 O LEU A 50 30.164 33.518 18.140 1.00 0.00 O ATOM 842 CB LEU A 50 32.240 31.123 17.753 1.00 0.00 C ATOM 843 CG LEU A 50 33.646 30.593 18.074 1.00 0.00 C ATOM 844 CD1 LEU A 50 34.222 29.953 16.817 1.00 0.00 C ATOM 845 CD2 LEU A 50 34.611 31.703 18.502 1.00 0.00 C ATOM 0 H LEU A 50 31.494 29.653 19.594 1.00 0.00 H new ATOM 0 HA LEU A 50 32.005 32.383 19.516 1.00 0.00 H new ATOM 0 HB2 LEU A 50 31.671 30.324 17.278 1.00 0.00 H new ATOM 0 HB3 LEU A 50 32.333 31.926 17.021 1.00 0.00 H new ATOM 0 HG LEU A 50 33.545 29.885 18.897 1.00 0.00 H new ATOM 0 HD11 LEU A 50 35.221 29.571 17.028 1.00 0.00 H new ATOM 0 HD12 LEU A 50 33.579 29.132 16.500 1.00 0.00 H new ATOM 0 HD13 LEU A 50 34.278 30.697 16.023 1.00 0.00 H new ATOM 0 HD21 LEU A 50 35.589 31.272 18.717 1.00 0.00 H new ATOM 0 HD22 LEU A 50 34.705 32.434 17.698 1.00 0.00 H new ATOM 0 HD23 LEU A 50 34.227 32.194 19.396 1.00 0.00 H new ATOM 857 N GLU A 51 29.091 31.552 18.158 1.00 0.00 N ATOM 858 CA GLU A 51 27.799 32.118 17.739 1.00 0.00 C ATOM 859 C GLU A 51 27.002 32.680 18.921 1.00 0.00 C ATOM 860 O GLU A 51 26.263 33.650 18.755 1.00 0.00 O ATOM 861 CB GLU A 51 26.943 31.085 16.996 1.00 0.00 C ATOM 862 CG GLU A 51 27.474 30.810 15.587 1.00 0.00 C ATOM 863 CD GLU A 51 26.409 30.101 14.751 1.00 0.00 C ATOM 864 OE1 GLU A 51 25.748 30.761 13.906 1.00 0.00 O ATOM 865 OE2 GLU A 51 26.217 28.877 14.919 1.00 0.00 O ATOM 0 H GLU A 51 29.088 30.537 18.255 1.00 0.00 H new ATOM 0 HA GLU A 51 28.036 32.938 17.061 1.00 0.00 H new ATOM 0 HB2 GLU A 51 26.922 30.155 17.564 1.00 0.00 H new ATOM 0 HB3 GLU A 51 25.915 31.443 16.933 1.00 0.00 H new ATOM 0 HG2 GLU A 51 27.758 31.747 15.108 1.00 0.00 H new ATOM 0 HG3 GLU A 51 28.372 30.195 15.643 1.00 0.00 H new ATOM 872 N LEU A 52 27.187 32.125 20.124 1.00 0.00 N ATOM 873 CA LEU A 52 26.639 32.694 21.366 1.00 0.00 C ATOM 874 C LEU A 52 27.333 34.001 21.787 1.00 0.00 C ATOM 875 O LEU A 52 26.888 34.661 22.720 1.00 0.00 O ATOM 876 CB LEU A 52 26.654 31.658 22.503 1.00 0.00 C ATOM 877 CG LEU A 52 25.966 30.322 22.147 1.00 0.00 C ATOM 878 CD1 LEU A 52 25.756 29.505 23.416 1.00 0.00 C ATOM 879 CD2 LEU A 52 24.587 30.475 21.496 1.00 0.00 C ATOM 0 H LEU A 52 27.721 31.268 20.267 1.00 0.00 H new ATOM 0 HA LEU A 52 25.602 32.956 21.156 1.00 0.00 H new ATOM 0 HB2 LEU A 52 27.688 31.458 22.785 1.00 0.00 H new ATOM 0 HB3 LEU A 52 26.163 32.086 23.377 1.00 0.00 H new ATOM 0 HG LEU A 52 26.631 29.841 21.430 1.00 0.00 H new ATOM 0 HD11 LEU A 52 25.270 28.562 23.165 1.00 0.00 H new ATOM 0 HD12 LEU A 52 26.720 29.304 23.883 1.00 0.00 H new ATOM 0 HD13 LEU A 52 25.127 30.064 24.109 1.00 0.00 H new ATOM 0 HD21 LEU A 52 24.176 29.489 21.279 1.00 0.00 H new ATOM 0 HD22 LEU A 52 23.920 31.005 22.176 1.00 0.00 H new ATOM 0 HD23 LEU A 52 24.683 31.040 20.569 1.00 0.00 H new ATOM 891 N GLN A 53 28.421 34.379 21.107 1.00 0.00 N ATOM 892 CA GLN A 53 29.214 35.595 21.347 1.00 0.00 C ATOM 893 C GLN A 53 29.858 35.649 22.749 1.00 0.00 C ATOM 894 O GLN A 53 30.408 36.676 23.154 1.00 0.00 O ATOM 895 CB GLN A 53 28.401 36.860 20.988 1.00 0.00 C ATOM 896 CG GLN A 53 27.569 36.710 19.699 1.00 0.00 C ATOM 897 CD GLN A 53 26.962 38.030 19.238 1.00 0.00 C ATOM 898 OE1 GLN A 53 27.627 38.894 18.678 1.00 0.00 O ATOM 899 NE2 GLN A 53 25.686 38.244 19.458 1.00 0.00 N ATOM 0 H GLN A 53 28.792 33.821 20.338 1.00 0.00 H new ATOM 0 HA GLN A 53 30.068 35.560 20.671 1.00 0.00 H new ATOM 0 HB2 GLN A 53 27.734 37.101 21.816 1.00 0.00 H new ATOM 0 HB3 GLN A 53 29.084 37.701 20.874 1.00 0.00 H new ATOM 0 HG2 GLN A 53 28.201 36.309 18.907 1.00 0.00 H new ATOM 0 HG3 GLN A 53 26.771 35.986 19.868 1.00 0.00 H new ATOM 0 HE21 GLN A 53 25.122 37.532 19.923 1.00 0.00 H new ATOM 0 HE22 GLN A 53 25.258 39.122 19.164 1.00 0.00 H new ATOM 908 N TYR A 54 29.821 34.535 23.489 1.00 0.00 N ATOM 909 CA TYR A 54 30.456 34.378 24.798 1.00 0.00 C ATOM 910 C TYR A 54 31.978 34.230 24.682 1.00 0.00 C ATOM 911 O TYR A 54 32.700 34.651 25.579 1.00 0.00 O ATOM 912 CB TYR A 54 29.890 33.136 25.503 1.00 0.00 C ATOM 913 CG TYR A 54 28.385 33.089 25.700 1.00 0.00 C ATOM 914 CD1 TYR A 54 27.642 34.270 25.898 1.00 0.00 C ATOM 915 CD2 TYR A 54 27.729 31.840 25.718 1.00 0.00 C ATOM 916 CE1 TYR A 54 26.246 34.209 26.035 1.00 0.00 C ATOM 917 CE2 TYR A 54 26.340 31.773 25.928 1.00 0.00 C ATOM 918 CZ TYR A 54 25.588 32.958 26.022 1.00 0.00 C ATOM 919 OH TYR A 54 24.235 32.873 26.086 1.00 0.00 O ATOM 0 H TYR A 54 29.333 33.694 23.182 1.00 0.00 H new ATOM 0 HA TYR A 54 30.242 35.278 25.375 1.00 0.00 H new ATOM 0 HB2 TYR A 54 30.186 32.256 24.932 1.00 0.00 H new ATOM 0 HB3 TYR A 54 30.364 33.055 26.481 1.00 0.00 H new ATOM 0 HD1 TYR A 54 28.147 35.223 25.944 1.00 0.00 H new ATOM 0 HD2 TYR A 54 28.295 30.932 25.570 1.00 0.00 H new ATOM 0 HE1 TYR A 54 25.675 35.118 26.150 1.00 0.00 H new ATOM 0 HE2 TYR A 54 25.852 30.814 26.017 1.00 0.00 H new ATOM 0 HH TYR A 54 23.965 31.931 26.064 1.00 0.00 H new ATOM 929 N VAL A 55 32.468 33.623 23.594 1.00 0.00 N ATOM 930 CA VAL A 55 33.896 33.335 23.367 1.00 0.00 C ATOM 931 C VAL A 55 34.330 33.823 21.982 1.00 0.00 C ATOM 932 O VAL A 55 33.508 33.936 21.070 1.00 0.00 O ATOM 933 CB VAL A 55 34.249 31.842 23.615 1.00 0.00 C ATOM 934 CG1 VAL A 55 33.772 31.360 24.995 1.00 0.00 C ATOM 935 CG2 VAL A 55 33.674 30.917 22.538 1.00 0.00 C ATOM 0 H VAL A 55 31.872 33.310 22.828 1.00 0.00 H new ATOM 0 HA VAL A 55 34.469 33.894 24.107 1.00 0.00 H new ATOM 0 HB VAL A 55 35.337 31.790 23.574 1.00 0.00 H new ATOM 0 HG11 VAL A 55 34.039 30.311 25.127 1.00 0.00 H new ATOM 0 HG12 VAL A 55 34.248 31.956 25.773 1.00 0.00 H new ATOM 0 HG13 VAL A 55 32.690 31.470 25.065 1.00 0.00 H new ATOM 0 HG21 VAL A 55 33.950 29.886 22.759 1.00 0.00 H new ATOM 0 HG22 VAL A 55 32.588 31.007 22.523 1.00 0.00 H new ATOM 0 HG23 VAL A 55 34.075 31.199 21.564 1.00 0.00 H new ATOM 945 N LYS A 56 35.627 34.098 21.812 1.00 0.00 N ATOM 946 CA LYS A 56 36.249 34.535 20.551 1.00 0.00 C ATOM 947 C LYS A 56 37.672 33.996 20.428 1.00 0.00 C ATOM 948 O LYS A 56 38.393 33.925 21.417 1.00 0.00 O ATOM 949 CB LYS A 56 36.264 36.076 20.483 1.00 0.00 C ATOM 950 CG LYS A 56 34.977 36.717 19.946 1.00 0.00 C ATOM 951 CD LYS A 56 35.258 37.780 18.866 1.00 0.00 C ATOM 952 CE LYS A 56 33.970 38.331 18.245 1.00 0.00 C ATOM 953 NZ LYS A 56 33.198 39.197 19.165 1.00 0.00 N1+ ATOM 0 H LYS A 56 36.300 34.021 22.575 1.00 0.00 H new ATOM 0 HA LYS A 56 35.661 34.140 19.723 1.00 0.00 H new ATOM 0 HB2 LYS A 56 36.456 36.466 21.482 1.00 0.00 H new ATOM 0 HB3 LYS A 56 37.097 36.388 19.853 1.00 0.00 H new ATOM 0 HG2 LYS A 56 34.334 35.941 19.530 1.00 0.00 H new ATOM 0 HG3 LYS A 56 34.431 37.176 20.770 1.00 0.00 H new ATOM 0 HD2 LYS A 56 35.827 38.600 19.305 1.00 0.00 H new ATOM 0 HD3 LYS A 56 35.879 37.344 18.083 1.00 0.00 H new ATOM 0 HE2 LYS A 56 34.221 38.898 17.349 1.00 0.00 H new ATOM 0 HE3 LYS A 56 33.342 37.498 17.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 32.340 39.536 18.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 32.930 38.653 20.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 33.781 40.010 19.447 1.00 0.00 H new ATOM 967 N GLU A 57 38.079 33.637 19.216 1.00 0.00 N ATOM 968 CA GLU A 57 39.409 33.083 19.023 1.00 0.00 C ATOM 969 C GLU A 57 40.423 34.180 18.669 1.00 0.00 C ATOM 970 O GLU A 57 40.306 34.816 17.621 1.00 0.00 O ATOM 971 CB GLU A 57 39.379 32.039 17.906 1.00 0.00 C ATOM 972 CG GLU A 57 39.179 32.624 16.517 1.00 0.00 C ATOM 973 CD GLU A 57 38.895 31.561 15.473 1.00 0.00 C ATOM 974 OE1 GLU A 57 39.183 30.375 15.738 1.00 0.00 O ATOM 975 OE2 GLU A 57 38.383 31.912 14.389 1.00 0.00 O ATOM 0 H GLU A 57 37.518 33.718 18.368 1.00 0.00 H new ATOM 0 HA GLU A 57 39.719 32.617 19.958 1.00 0.00 H new ATOM 0 HB2 GLU A 57 40.314 31.478 17.922 1.00 0.00 H new ATOM 0 HB3 GLU A 57 38.578 31.328 18.108 1.00 0.00 H new ATOM 0 HG2 GLU A 57 38.353 33.334 16.541 1.00 0.00 H new ATOM 0 HG3 GLU A 57 40.070 33.182 16.230 1.00 0.00 H new ATOM 982 N GLY A 58 41.415 34.402 19.533 1.00 0.00 N ATOM 983 CA GLY A 58 42.441 35.394 19.284 1.00 0.00 C ATOM 984 C GLY A 58 43.776 34.794 19.673 1.00 0.00 C ATOM 985 O GLY A 58 43.840 33.980 20.595 1.00 0.00 O ATOM 0 H GLY A 58 41.522 33.900 20.415 1.00 0.00 H new ATOM 0 HA2 GLY A 58 42.445 35.683 18.233 1.00 0.00 H new ATOM 0 HA3 GLY A 58 42.246 36.297 19.862 1.00 0.00 H new ATOM 989 N CYS A 59 44.846 35.179 18.987 1.00 0.00 N ATOM 990 CA CYS A 59 46.157 34.634 19.304 1.00 0.00 C ATOM 991 C CYS A 59 47.148 35.732 19.709 1.00 0.00 C ATOM 992 O CYS A 59 47.306 36.715 18.985 1.00 0.00 O ATOM 993 CB CYS A 59 46.710 33.875 18.097 1.00 0.00 C ATOM 994 SG CYS A 59 46.775 34.850 16.576 1.00 0.00 S ATOM 0 H CYS A 59 44.832 35.854 18.222 1.00 0.00 H new ATOM 0 HA CYS A 59 46.036 33.957 20.150 1.00 0.00 H new ATOM 0 HB2 CYS A 59 47.714 33.522 18.333 1.00 0.00 H new ATOM 0 HB3 CYS A 59 46.094 32.992 17.924 1.00 0.00 H new ATOM 0 HG CYS A 59 47.047 36.088 16.865 1.00 0.00 H new ATOM 1000 N LYS A 60 47.818 35.577 20.853 1.00 0.00 N ATOM 1001 CA LYS A 60 48.810 36.550 21.289 1.00 0.00 C ATOM 1002 C LYS A 60 50.018 36.409 20.374 1.00 0.00 C ATOM 1003 O LYS A 60 50.329 35.304 19.925 1.00 0.00 O ATOM 1004 CB LYS A 60 49.208 36.297 22.742 1.00 0.00 C ATOM 1005 CG LYS A 60 48.028 36.194 23.693 1.00 0.00 C ATOM 1006 CD LYS A 60 48.482 36.129 25.142 1.00 0.00 C ATOM 1007 CE LYS A 60 47.308 35.922 26.084 1.00 0.00 C ATOM 1008 NZ LYS A 60 47.740 35.815 27.505 1.00 0.00 N1+ ATOM 0 H LYS A 60 47.689 34.789 21.488 1.00 0.00 H new ATOM 0 HA LYS A 60 48.403 37.560 21.234 1.00 0.00 H new ATOM 0 HB2 LYS A 60 49.787 35.375 22.795 1.00 0.00 H new ATOM 0 HB3 LYS A 60 49.862 37.103 23.075 1.00 0.00 H new ATOM 0 HG2 LYS A 60 47.372 37.054 23.555 1.00 0.00 H new ATOM 0 HG3 LYS A 60 47.444 35.306 23.454 1.00 0.00 H new ATOM 0 HD2 LYS A 60 49.196 35.315 25.265 1.00 0.00 H new ATOM 0 HD3 LYS A 60 49.002 37.051 25.403 1.00 0.00 H new ATOM 0 HE2 LYS A 60 46.610 36.752 25.980 1.00 0.00 H new ATOM 0 HE3 LYS A 60 46.771 35.017 25.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 46.907 35.675 28.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 48.386 35.007 27.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 48.229 36.689 27.786 1.00 0.00 H new ATOM 1022 N GLN A 61 50.720 37.503 20.104 1.00 0.00 N ATOM 1023 CA GLN A 61 51.870 37.384 19.204 1.00 0.00 C ATOM 1024 C GLN A 61 52.939 36.436 19.788 1.00 0.00 C ATOM 1025 O GLN A 61 53.705 36.813 20.675 1.00 0.00 O ATOM 1026 CB GLN A 61 52.436 38.778 18.889 1.00 0.00 C ATOM 1027 CG GLN A 61 53.469 38.709 17.748 1.00 0.00 C ATOM 1028 CD GLN A 61 54.389 39.922 17.673 1.00 0.00 C ATOM 1029 OE1 GLN A 61 54.700 40.580 18.661 1.00 0.00 O ATOM 1030 NE2 GLN A 61 54.951 40.202 16.521 1.00 0.00 N ATOM 0 H GLN A 61 50.532 38.436 20.470 1.00 0.00 H new ATOM 0 HA GLN A 61 51.541 36.938 18.265 1.00 0.00 H new ATOM 0 HB2 GLN A 61 51.624 39.449 18.609 1.00 0.00 H new ATOM 0 HB3 GLN A 61 52.902 39.196 19.782 1.00 0.00 H new ATOM 0 HG2 GLN A 61 54.076 37.812 17.874 1.00 0.00 H new ATOM 0 HG3 GLN A 61 52.942 38.606 16.800 1.00 0.00 H new ATOM 0 HE21 GLN A 61 54.704 39.665 15.689 1.00 0.00 H new ATOM 0 HE22 GLN A 61 55.635 40.956 16.457 1.00 0.00 H new ATOM 1039 N GLY A 62 53.007 35.205 19.276 1.00 0.00 N ATOM 1040 CA GLY A 62 53.951 34.167 19.704 1.00 0.00 C ATOM 1041 C GLY A 62 53.322 32.892 20.275 1.00 0.00 C ATOM 1042 O GLY A 62 54.026 31.887 20.368 1.00 0.00 O ATOM 0 H GLY A 62 52.388 34.892 18.528 1.00 0.00 H new ATOM 0 HA2 GLY A 62 54.573 33.893 18.852 1.00 0.00 H new ATOM 0 HA3 GLY A 62 54.613 34.593 20.458 1.00 0.00 H new ATOM 1046 N ILE A 63 52.021 32.872 20.590 1.00 0.00 N ATOM 1047 CA ILE A 63 51.317 31.657 21.051 1.00 0.00 C ATOM 1048 C ILE A 63 50.407 31.066 19.966 1.00 0.00 C ATOM 1049 O ILE A 63 49.979 31.762 19.042 1.00 0.00 O ATOM 1050 CB ILE A 63 50.582 31.879 22.394 1.00 0.00 C ATOM 1051 CG1 ILE A 63 49.266 32.665 22.234 1.00 0.00 C ATOM 1052 CG2 ILE A 63 51.529 32.522 23.424 1.00 0.00 C ATOM 1053 CD1 ILE A 63 48.445 32.766 23.525 1.00 0.00 C ATOM 0 H ILE A 63 51.422 33.695 20.534 1.00 0.00 H new ATOM 0 HA ILE A 63 52.083 30.906 21.246 1.00 0.00 H new ATOM 0 HB ILE A 63 50.287 30.900 22.772 1.00 0.00 H new ATOM 0 HG12 ILE A 63 49.495 33.670 21.880 1.00 0.00 H new ATOM 0 HG13 ILE A 63 48.659 32.187 21.465 1.00 0.00 H new ATOM 0 HG21 ILE A 63 50.997 32.672 24.364 1.00 0.00 H new ATOM 0 HG22 ILE A 63 52.384 31.867 23.591 1.00 0.00 H new ATOM 0 HG23 ILE A 63 51.878 33.484 23.047 1.00 0.00 H new ATOM 0 HD11 ILE A 63 47.534 33.333 23.333 1.00 0.00 H new ATOM 0 HD12 ILE A 63 48.184 31.765 23.870 1.00 0.00 H new ATOM 0 HD13 ILE A 63 49.033 33.272 24.291 1.00 0.00 H new ATOM 1065 N SER A 64 50.112 29.768 20.079 1.00 0.00 N ATOM 1066 CA SER A 64 49.193 29.051 19.180 1.00 0.00 C ATOM 1067 C SER A 64 47.726 29.488 19.365 1.00 0.00 C ATOM 1068 O SER A 64 47.411 30.270 20.265 1.00 0.00 O ATOM 1069 CB SER A 64 49.369 27.544 19.388 1.00 0.00 C ATOM 1070 OG SER A 64 48.800 26.826 18.313 1.00 0.00 O ATOM 0 H SER A 64 50.509 29.174 20.807 1.00 0.00 H new ATOM 0 HA SER A 64 49.445 29.305 18.150 1.00 0.00 H new ATOM 0 HB2 SER A 64 50.429 27.304 19.473 1.00 0.00 H new ATOM 0 HB3 SER A 64 48.898 27.243 20.324 1.00 0.00 H new ATOM 0 HG SER A 64 48.922 25.865 18.460 1.00 0.00 H new ATOM 1076 N LYS A 65 46.812 29.007 18.509 1.00 0.00 N ATOM 1077 CA LYS A 65 45.390 29.403 18.529 1.00 0.00 C ATOM 1078 C LYS A 65 44.708 29.076 19.863 1.00 0.00 C ATOM 1079 O LYS A 65 44.918 28.022 20.459 1.00 0.00 O ATOM 1080 CB LYS A 65 44.616 28.847 17.323 1.00 0.00 C ATOM 1081 CG LYS A 65 44.521 27.316 17.304 1.00 0.00 C ATOM 1082 CD LYS A 65 43.707 26.786 16.109 1.00 0.00 C ATOM 1083 CE LYS A 65 44.289 27.187 14.742 1.00 0.00 C ATOM 1084 NZ LYS A 65 43.747 26.341 13.650 1.00 0.00 N1+ ATOM 0 H LYS A 65 47.036 28.330 17.780 1.00 0.00 H new ATOM 0 HA LYS A 65 45.371 30.489 18.437 1.00 0.00 H new ATOM 0 HB2 LYS A 65 43.609 29.265 17.325 1.00 0.00 H new ATOM 0 HB3 LYS A 65 45.099 29.184 16.406 1.00 0.00 H new ATOM 0 HG2 LYS A 65 45.525 26.894 17.270 1.00 0.00 H new ATOM 0 HG3 LYS A 65 44.063 26.973 18.231 1.00 0.00 H new ATOM 0 HD2 LYS A 65 43.656 25.699 16.168 1.00 0.00 H new ATOM 0 HD3 LYS A 65 42.685 27.158 16.183 1.00 0.00 H new ATOM 0 HE2 LYS A 65 44.060 28.233 14.541 1.00 0.00 H new ATOM 0 HE3 LYS A 65 45.375 27.098 14.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 44.160 26.638 12.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 43.987 25.345 13.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 42.713 26.446 13.610 1.00 0.00 H new ATOM 1098 N THR A 66 43.886 30.009 20.333 1.00 0.00 N ATOM 1099 CA THR A 66 43.314 30.013 21.684 1.00 0.00 C ATOM 1100 C THR A 66 42.136 30.990 21.757 1.00 0.00 C ATOM 1101 O THR A 66 41.997 31.843 20.875 1.00 0.00 O ATOM 1102 CB THR A 66 44.413 30.341 22.705 1.00 0.00 C ATOM 1103 OG1 THR A 66 43.871 30.338 24.003 1.00 0.00 O ATOM 1104 CG2 THR A 66 45.103 31.682 22.468 1.00 0.00 C ATOM 0 H THR A 66 43.588 30.807 19.772 1.00 0.00 H new ATOM 0 HA THR A 66 42.922 29.025 21.926 1.00 0.00 H new ATOM 0 HB THR A 66 45.171 29.567 22.585 1.00 0.00 H new ATOM 0 HG1 THR A 66 43.252 29.584 24.097 1.00 0.00 H new ATOM 0 HG21 THR A 66 45.865 31.839 23.231 1.00 0.00 H new ATOM 0 HG22 THR A 66 45.570 31.682 21.483 1.00 0.00 H new ATOM 0 HG23 THR A 66 44.367 32.484 22.520 1.00 0.00 H new ATOM 1112 N PHE A 67 41.268 30.856 22.766 1.00 0.00 N ATOM 1113 CA PHE A 67 39.953 31.504 22.801 1.00 0.00 C ATOM 1114 C PHE A 67 39.746 32.278 24.112 1.00 0.00 C ATOM 1115 O PHE A 67 39.840 31.714 25.200 1.00 0.00 O ATOM 1116 CB PHE A 67 38.848 30.461 22.535 1.00 0.00 C ATOM 1117 CG PHE A 67 39.039 29.635 21.266 1.00 0.00 C ATOM 1118 CD1 PHE A 67 40.102 28.711 21.179 1.00 0.00 C ATOM 1119 CD2 PHE A 67 38.180 29.797 20.157 1.00 0.00 C ATOM 1120 CE1 PHE A 67 40.349 28.014 19.984 1.00 0.00 C ATOM 1121 CE2 PHE A 67 38.372 29.031 18.992 1.00 0.00 C ATOM 1122 CZ PHE A 67 39.471 28.160 18.896 1.00 0.00 C ATOM 0 H PHE A 67 41.462 30.288 23.591 1.00 0.00 H new ATOM 0 HA PHE A 67 39.898 32.247 22.006 1.00 0.00 H new ATOM 0 HB2 PHE A 67 38.794 29.784 23.388 1.00 0.00 H new ATOM 0 HB3 PHE A 67 37.889 30.976 22.476 1.00 0.00 H new ATOM 0 HD1 PHE A 67 40.732 28.538 22.039 1.00 0.00 H new ATOM 0 HD2 PHE A 67 37.372 30.512 20.203 1.00 0.00 H new ATOM 0 HE1 PHE A 67 41.211 27.368 19.902 1.00 0.00 H new ATOM 0 HE2 PHE A 67 37.675 29.112 18.171 1.00 0.00 H new ATOM 0 HZ PHE A 67 39.641 27.603 17.986 1.00 0.00 H new ATOM 1132 N TYR A 68 39.495 33.585 24.018 1.00 0.00 N ATOM 1133 CA TYR A 68 39.132 34.432 25.159 1.00 0.00 C ATOM 1134 C TYR A 68 37.607 34.544 25.297 1.00 0.00 C ATOM 1135 O TYR A 68 36.854 34.035 24.460 1.00 0.00 O ATOM 1136 CB TYR A 68 39.837 35.795 25.068 1.00 0.00 C ATOM 1137 CG TYR A 68 39.147 36.807 24.185 1.00 0.00 C ATOM 1138 CD1 TYR A 68 39.501 36.901 22.827 1.00 0.00 C ATOM 1139 CD2 TYR A 68 38.139 37.635 24.722 1.00 0.00 C ATOM 1140 CE1 TYR A 68 38.834 37.821 21.992 1.00 0.00 C ATOM 1141 CE2 TYR A 68 37.458 38.536 23.884 1.00 0.00 C ATOM 1142 CZ TYR A 68 37.797 38.624 22.519 1.00 0.00 C ATOM 1143 OH TYR A 68 37.100 39.470 21.720 1.00 0.00 O ATOM 0 H TYR A 68 39.538 34.094 23.135 1.00 0.00 H new ATOM 0 HA TYR A 68 39.485 33.962 26.077 1.00 0.00 H new ATOM 0 HB2 TYR A 68 39.926 36.210 26.072 1.00 0.00 H new ATOM 0 HB3 TYR A 68 40.850 35.640 24.696 1.00 0.00 H new ATOM 0 HD1 TYR A 68 40.281 36.271 22.425 1.00 0.00 H new ATOM 0 HD2 TYR A 68 37.891 37.577 25.772 1.00 0.00 H new ATOM 0 HE1 TYR A 68 39.115 37.912 20.953 1.00 0.00 H new ATOM 0 HE2 TYR A 68 36.675 39.161 24.287 1.00 0.00 H new ATOM 0 HH TYR A 68 36.425 39.941 22.252 1.00 0.00 H new ATOM 1153 N ILE A 69 37.151 35.179 26.378 1.00 0.00 N ATOM 1154 CA ILE A 69 35.751 35.210 26.803 1.00 0.00 C ATOM 1155 C ILE A 69 35.303 36.659 27.048 1.00 0.00 C ATOM 1156 O ILE A 69 36.052 37.467 27.596 1.00 0.00 O ATOM 1157 CB ILE A 69 35.570 34.268 28.017 1.00 0.00 C ATOM 1158 CG1 ILE A 69 35.924 32.803 27.641 1.00 0.00 C ATOM 1159 CG2 ILE A 69 34.131 34.323 28.566 1.00 0.00 C ATOM 1160 CD1 ILE A 69 37.346 32.379 28.041 1.00 0.00 C ATOM 0 H ILE A 69 37.766 35.702 27.001 1.00 0.00 H new ATOM 0 HA ILE A 69 35.094 34.834 26.019 1.00 0.00 H new ATOM 0 HB ILE A 69 36.252 34.614 28.794 1.00 0.00 H new ATOM 0 HG12 ILE A 69 35.209 32.134 28.119 1.00 0.00 H new ATOM 0 HG13 ILE A 69 35.808 32.677 26.564 1.00 0.00 H new ATOM 0 HG21 ILE A 69 34.041 33.649 29.418 1.00 0.00 H new ATOM 0 HG22 ILE A 69 33.901 35.340 28.882 1.00 0.00 H new ATOM 0 HG23 ILE A 69 33.432 34.019 27.787 1.00 0.00 H new ATOM 0 HD11 ILE A 69 37.514 31.344 27.744 1.00 0.00 H new ATOM 0 HD12 ILE A 69 38.071 33.022 27.542 1.00 0.00 H new ATOM 0 HD13 ILE A 69 37.463 32.470 29.121 1.00 0.00 H new ATOM 1172 N THR A 70 34.097 37.000 26.587 1.00 0.00 N ATOM 1173 CA THR A 70 33.529 38.351 26.587 1.00 0.00 C ATOM 1174 C THR A 70 32.788 38.678 27.900 1.00 0.00 C ATOM 1175 O THR A 70 32.300 37.771 28.583 1.00 0.00 O ATOM 1176 CB THR A 70 32.576 38.487 25.383 1.00 0.00 C ATOM 1177 OG1 THR A 70 31.441 37.663 25.520 1.00 0.00 O ATOM 1178 CG2 THR A 70 33.241 38.140 24.049 1.00 0.00 C ATOM 0 H THR A 70 33.461 36.311 26.185 1.00 0.00 H new ATOM 0 HA THR A 70 34.347 39.067 26.506 1.00 0.00 H new ATOM 0 HB THR A 70 32.287 39.538 25.375 1.00 0.00 H new ATOM 0 HG1 THR A 70 31.155 37.350 24.636 1.00 0.00 H new ATOM 0 HG21 THR A 70 32.518 38.255 23.241 1.00 0.00 H new ATOM 0 HG22 THR A 70 34.085 38.808 23.879 1.00 0.00 H new ATOM 0 HG23 THR A 70 33.594 37.109 24.076 1.00 0.00 H new ATOM 1186 N PRO A 71 32.615 39.973 28.260 1.00 0.00 N ATOM 1187 CA PRO A 71 31.829 40.366 29.438 1.00 0.00 C ATOM 1188 C PRO A 71 30.366 39.906 29.358 1.00 0.00 C ATOM 1189 O PRO A 71 29.759 39.620 30.389 1.00 0.00 O ATOM 1190 CB PRO A 71 31.922 41.895 29.501 1.00 0.00 C ATOM 1191 CG PRO A 71 32.129 42.280 28.037 1.00 0.00 C ATOM 1192 CD PRO A 71 33.062 41.169 27.556 1.00 0.00 C ATOM 0 HA PRO A 71 32.224 39.890 30.336 1.00 0.00 H new ATOM 0 HB2 PRO A 71 31.015 42.339 29.912 1.00 0.00 H new ATOM 0 HB3 PRO A 71 32.751 42.225 30.127 1.00 0.00 H new ATOM 0 HG2 PRO A 71 31.191 42.297 27.481 1.00 0.00 H new ATOM 0 HG3 PRO A 71 32.579 43.267 27.933 1.00 0.00 H new ATOM 0 HD2 PRO A 71 32.997 41.039 26.476 1.00 0.00 H new ATOM 0 HD3 PRO A 71 34.102 41.398 27.788 1.00 0.00 H new ATOM 1200 N ASN A 72 29.818 39.728 28.150 1.00 0.00 N ATOM 1201 CA ASN A 72 28.471 39.193 27.953 1.00 0.00 C ATOM 1202 C ASN A 72 28.294 37.777 28.541 1.00 0.00 C ATOM 1203 O ASN A 72 27.187 37.414 28.926 1.00 0.00 O ATOM 1204 CB ASN A 72 28.127 39.212 26.455 1.00 0.00 C ATOM 1205 CG ASN A 72 27.926 40.604 25.882 1.00 0.00 C ATOM 1206 OD1 ASN A 72 27.891 41.609 26.578 1.00 0.00 O ATOM 1207 ND2 ASN A 72 27.746 40.691 24.587 1.00 0.00 N ATOM 0 H ASN A 72 30.301 39.953 27.280 1.00 0.00 H new ATOM 0 HA ASN A 72 27.779 39.834 28.499 1.00 0.00 H new ATOM 0 HB2 ASN A 72 28.926 38.716 25.904 1.00 0.00 H new ATOM 0 HB3 ASN A 72 27.219 38.630 26.294 1.00 0.00 H new ATOM 0 HD21 ASN A 72 27.576 41.600 24.156 1.00 0.00 H new ATOM 0 HD22 ASN A 72 27.776 39.850 24.010 1.00 0.00 H new ATOM 1214 N GLY A 73 29.370 36.988 28.668 1.00 0.00 N ATOM 1215 CA GLY A 73 29.332 35.724 29.411 1.00 0.00 C ATOM 1216 C GLY A 73 29.089 35.942 30.911 1.00 0.00 C ATOM 1217 O GLY A 73 28.210 35.301 31.487 1.00 0.00 O ATOM 0 H GLY A 73 30.281 37.206 28.263 1.00 0.00 H new ATOM 0 HA2 GLY A 73 28.544 35.089 29.005 1.00 0.00 H new ATOM 0 HA3 GLY A 73 30.273 35.193 29.270 1.00 0.00 H new ATOM 1221 N ILE A 74 29.822 36.880 31.527 1.00 0.00 N ATOM 1222 CA ILE A 74 29.694 37.275 32.935 1.00 0.00 C ATOM 1223 C ILE A 74 28.316 37.860 33.249 1.00 0.00 C ATOM 1224 O ILE A 74 27.788 37.574 34.322 1.00 0.00 O ATOM 1225 CB ILE A 74 30.813 38.271 33.323 1.00 0.00 C ATOM 1226 CG1 ILE A 74 32.216 37.643 33.258 1.00 0.00 C ATOM 1227 CG2 ILE A 74 30.647 38.814 34.754 1.00 0.00 C ATOM 1228 CD1 ILE A 74 33.028 37.961 32.001 1.00 0.00 C ATOM 0 H ILE A 74 30.548 37.404 31.038 1.00 0.00 H new ATOM 0 HA ILE A 74 29.802 36.372 33.535 1.00 0.00 H new ATOM 0 HB ILE A 74 30.720 39.074 32.592 1.00 0.00 H new ATOM 0 HG12 ILE A 74 32.783 37.975 34.128 1.00 0.00 H new ATOM 0 HG13 ILE A 74 32.114 36.561 33.338 1.00 0.00 H new ATOM 0 HG21 ILE A 74 31.458 39.508 34.976 1.00 0.00 H new ATOM 0 HG22 ILE A 74 29.692 39.333 34.838 1.00 0.00 H new ATOM 0 HG23 ILE A 74 30.674 37.986 35.463 1.00 0.00 H new ATOM 0 HD11 ILE A 74 33.998 37.468 32.060 1.00 0.00 H new ATOM 0 HD12 ILE A 74 32.493 37.603 31.122 1.00 0.00 H new ATOM 0 HD13 ILE A 74 33.172 39.039 31.924 1.00 0.00 H new ATOM 1240 N GLU A 75 27.704 38.622 32.340 1.00 0.00 N ATOM 1241 CA GLU A 75 26.354 39.177 32.549 1.00 0.00 C ATOM 1242 C GLU A 75 25.312 38.080 32.822 1.00 0.00 C ATOM 1243 O GLU A 75 24.483 38.217 33.720 1.00 0.00 O ATOM 1244 CB GLU A 75 25.926 40.040 31.353 1.00 0.00 C ATOM 1245 CG GLU A 75 26.731 41.345 31.310 1.00 0.00 C ATOM 1246 CD GLU A 75 26.266 42.322 30.229 1.00 0.00 C ATOM 1247 OE1 GLU A 75 25.263 42.085 29.519 1.00 0.00 O ATOM 1248 OE2 GLU A 75 26.903 43.388 30.087 1.00 0.00 O ATOM 0 H GLU A 75 28.121 38.873 31.444 1.00 0.00 H new ATOM 0 HA GLU A 75 26.403 39.808 33.437 1.00 0.00 H new ATOM 0 HB2 GLU A 75 26.074 39.485 30.427 1.00 0.00 H new ATOM 0 HB3 GLU A 75 24.862 40.265 31.423 1.00 0.00 H new ATOM 0 HG2 GLU A 75 26.664 41.834 32.282 1.00 0.00 H new ATOM 0 HG3 GLU A 75 27.782 41.107 31.144 1.00 0.00 H new ATOM 1255 N LYS A 76 25.421 36.920 32.164 1.00 0.00 N ATOM 1256 CA LYS A 76 24.577 35.757 32.475 1.00 0.00 C ATOM 1257 C LYS A 76 24.892 35.110 33.831 1.00 0.00 C ATOM 1258 O LYS A 76 23.992 34.559 34.463 1.00 0.00 O ATOM 1259 CB LYS A 76 24.681 34.721 31.351 1.00 0.00 C ATOM 1260 CG LYS A 76 24.340 35.304 29.973 1.00 0.00 C ATOM 1261 CD LYS A 76 24.278 34.206 28.915 1.00 0.00 C ATOM 1262 CE LYS A 76 22.983 33.379 28.947 1.00 0.00 C ATOM 1263 NZ LYS A 76 21.870 34.099 28.286 1.00 0.00 N1+ ATOM 0 H LYS A 76 26.088 36.760 31.409 1.00 0.00 H new ATOM 0 HA LYS A 76 23.554 36.127 32.550 1.00 0.00 H new ATOM 0 HB2 LYS A 76 25.693 34.316 31.329 1.00 0.00 H new ATOM 0 HB3 LYS A 76 24.009 33.890 31.565 1.00 0.00 H new ATOM 0 HG2 LYS A 76 23.383 35.823 30.020 1.00 0.00 H new ATOM 0 HG3 LYS A 76 25.090 36.044 29.691 1.00 0.00 H new ATOM 0 HD2 LYS A 76 24.383 34.659 27.929 1.00 0.00 H new ATOM 0 HD3 LYS A 76 25.128 33.537 29.050 1.00 0.00 H new ATOM 0 HE2 LYS A 76 23.147 32.423 28.450 1.00 0.00 H new ATOM 0 HE3 LYS A 76 22.714 33.159 29.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 21.009 33.517 28.323 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 21.700 35.000 28.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 22.119 34.287 27.294 1.00 0.00 H new ATOM 1277 N LEU A 77 26.127 35.211 34.333 1.00 0.00 N ATOM 1278 CA LEU A 77 26.477 34.752 35.686 1.00 0.00 C ATOM 1279 C LEU A 77 25.690 35.535 36.754 1.00 0.00 C ATOM 1280 O LEU A 77 25.327 34.971 37.778 1.00 0.00 O ATOM 1281 CB LEU A 77 27.989 34.848 35.971 1.00 0.00 C ATOM 1282 CG LEU A 77 28.907 34.220 34.912 1.00 0.00 C ATOM 1283 CD1 LEU A 77 30.373 34.480 35.268 1.00 0.00 C ATOM 1284 CD2 LEU A 77 28.720 32.717 34.770 1.00 0.00 C ATOM 0 H LEU A 77 26.911 35.611 33.817 1.00 0.00 H new ATOM 0 HA LEU A 77 26.200 33.699 35.736 1.00 0.00 H new ATOM 0 HB2 LEU A 77 28.254 35.900 36.077 1.00 0.00 H new ATOM 0 HB3 LEU A 77 28.191 34.370 36.930 1.00 0.00 H new ATOM 0 HG LEU A 77 28.636 34.688 33.965 1.00 0.00 H new ATOM 0 HD11 LEU A 77 31.016 34.031 34.511 1.00 0.00 H new ATOM 0 HD12 LEU A 77 30.553 35.554 35.306 1.00 0.00 H new ATOM 0 HD13 LEU A 77 30.595 34.040 36.240 1.00 0.00 H new ATOM 0 HD21 LEU A 77 29.398 32.337 34.006 1.00 0.00 H new ATOM 0 HD22 LEU A 77 28.937 32.232 35.722 1.00 0.00 H new ATOM 0 HD23 LEU A 77 27.691 32.504 34.480 1.00 0.00 H new ATOM 1296 N LYS A 78 25.343 36.799 36.491 1.00 0.00 N ATOM 1297 CA LYS A 78 24.457 37.632 37.333 1.00 0.00 C ATOM 1298 C LYS A 78 22.988 37.152 37.404 1.00 0.00 C ATOM 1299 O LYS A 78 22.190 37.744 38.134 1.00 0.00 O ATOM 1300 CB LYS A 78 24.481 39.097 36.839 1.00 0.00 C ATOM 1301 CG LYS A 78 25.849 39.683 36.454 1.00 0.00 C ATOM 1302 CD LYS A 78 26.849 39.790 37.615 1.00 0.00 C ATOM 1303 CE LYS A 78 28.184 40.443 37.234 1.00 0.00 C ATOM 1304 NZ LYS A 78 29.091 40.482 38.405 1.00 0.00 N1+ ATOM 0 H LYS A 78 25.677 37.292 35.663 1.00 0.00 H new ATOM 0 HA LYS A 78 24.858 37.543 38.343 1.00 0.00 H new ATOM 0 HB2 LYS A 78 23.824 39.173 35.972 1.00 0.00 H new ATOM 0 HB3 LYS A 78 24.052 39.725 37.620 1.00 0.00 H new ATOM 0 HG2 LYS A 78 26.287 39.064 35.671 1.00 0.00 H new ATOM 0 HG3 LYS A 78 25.698 40.675 36.029 1.00 0.00 H new ATOM 0 HD2 LYS A 78 26.393 40.364 38.421 1.00 0.00 H new ATOM 0 HD3 LYS A 78 27.044 38.791 38.006 1.00 0.00 H new ATOM 0 HE2 LYS A 78 28.651 39.885 36.422 1.00 0.00 H new ATOM 0 HE3 LYS A 78 28.010 41.454 36.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 29.991 40.927 38.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 28.649 41.034 39.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 29.270 39.513 38.738 1.00 0.00 H new ATOM 1318 N SER A 79 22.607 36.123 36.638 1.00 0.00 N ATOM 1319 CA SER A 79 21.335 35.405 36.754 1.00 0.00 C ATOM 1320 C SER A 79 21.401 34.274 37.796 1.00 0.00 C ATOM 1321 O SER A 79 20.372 33.839 38.308 1.00 0.00 O ATOM 1322 CB SER A 79 20.943 34.856 35.371 1.00 0.00 C ATOM 1323 OG SER A 79 19.629 34.336 35.352 1.00 0.00 O ATOM 0 H SER A 79 23.199 35.755 35.893 1.00 0.00 H new ATOM 0 HA SER A 79 20.574 36.103 37.103 1.00 0.00 H new ATOM 0 HB2 SER A 79 21.027 35.651 34.630 1.00 0.00 H new ATOM 0 HB3 SER A 79 21.645 34.074 35.081 1.00 0.00 H new ATOM 0 HG SER A 79 19.423 34.000 34.455 1.00 0.00 H new ATOM 1329 N ILE A 80 22.607 33.807 38.148 1.00 0.00 N ATOM 1330 CA ILE A 80 22.827 32.606 38.988 1.00 0.00 C ATOM 1331 C ILE A 80 23.554 32.897 40.313 1.00 0.00 C ATOM 1332 O ILE A 80 23.162 32.342 41.348 1.00 0.00 O ATOM 1333 CB ILE A 80 23.532 31.500 38.154 1.00 0.00 C ATOM 1334 CG1 ILE A 80 24.849 31.944 37.468 1.00 0.00 C ATOM 1335 CG2 ILE A 80 22.551 30.947 37.108 1.00 0.00 C ATOM 1336 CD1 ILE A 80 25.689 30.791 36.890 1.00 0.00 C ATOM 0 H ILE A 80 23.475 34.255 37.856 1.00 0.00 H new ATOM 0 HA ILE A 80 21.846 32.243 39.294 1.00 0.00 H new ATOM 0 HB ILE A 80 23.825 30.727 38.864 1.00 0.00 H new ATOM 0 HG12 ILE A 80 24.608 32.640 36.664 1.00 0.00 H new ATOM 0 HG13 ILE A 80 25.454 32.490 38.191 1.00 0.00 H new ATOM 0 HG21 ILE A 80 23.043 30.171 36.522 1.00 0.00 H new ATOM 0 HG22 ILE A 80 21.682 30.524 37.612 1.00 0.00 H new ATOM 0 HG23 ILE A 80 22.231 31.753 36.447 1.00 0.00 H new ATOM 0 HD11 ILE A 80 26.591 31.193 36.430 1.00 0.00 H new ATOM 0 HD12 ILE A 80 25.965 30.105 37.691 1.00 0.00 H new ATOM 0 HD13 ILE A 80 25.106 30.257 36.140 1.00 0.00 H new ATOM 1348 N MET A 81 24.596 33.745 40.285 1.00 0.00 N ATOM 1349 CA MET A 81 25.357 34.263 41.427 1.00 0.00 C ATOM 1350 C MET A 81 24.917 35.683 41.750 1.00 0.00 C ATOM 1351 O MET A 81 24.931 36.011 42.953 1.00 0.00 O ATOM 1352 CB MET A 81 26.877 34.238 41.155 1.00 0.00 C ATOM 1353 CG MET A 81 27.513 32.845 41.010 1.00 0.00 C ATOM 1354 SD MET A 81 27.387 31.708 42.423 1.00 0.00 S ATOM 1355 CE MET A 81 28.432 32.576 43.629 1.00 0.00 C ATOM 1356 OXT MET A 81 24.609 36.468 40.827 1.00 0.00 O ATOM 0 H MET A 81 24.951 34.110 39.401 1.00 0.00 H new ATOM 0 HA MET A 81 25.155 33.615 42.280 1.00 0.00 H new ATOM 0 HB2 MET A 81 27.072 34.801 40.243 1.00 0.00 H new ATOM 0 HB3 MET A 81 27.380 34.763 41.967 1.00 0.00 H new ATOM 0 HG2 MET A 81 27.061 32.358 40.146 1.00 0.00 H new ATOM 0 HG3 MET A 81 28.570 32.981 40.782 1.00 0.00 H new ATOM 0 HE1 MET A 81 28.506 31.983 44.540 1.00 0.00 H new ATOM 0 HE2 MET A 81 29.427 32.722 43.209 1.00 0.00 H new ATOM 0 HE3 MET A 81 27.991 33.545 43.862 1.00 0.00 H new TER 1366 MET A 81