USER MOD reduce.3.24.130724 H: found=0, std=0, add=709, rem=0, adj=31 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 54 TYR OH : rot 180:sc= 0.608 USER MOD Set 1.2: A 76 LYS NZ :NH3+ 176:sc= 0.685 (180deg=0) USER MOD Set 2.1: A 38 SER OG : rot 180:sc= 0.0615 USER MOD Set 2.2: A 41 THR OG1 : rot 90:sc= 0.0542 USER MOD Set 3.1: A 27 THR OG1 : rot 180:sc= 0.126 USER MOD Set 3.2: A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl -167:sc= 0 (180deg=-0.134) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 ASN : amide:sc= -0.107 K(o=-0.11,f=-1.9) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 ASN : amide:sc= -0.153 K(o=-0.15,f=-1.9) USER MOD Single : A 8 TYR OH : rot 151:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 MET CE :methyl 177:sc= 0 (180deg=-0.0269) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 ASN : amide:sc= 1.11 K(o=1.1,f=-0.12) USER MOD Single : A 18 GLN :FLIP amide:sc= -0.0124 F(o=-1.5!,f=-0.012) USER MOD Single : A 19 CYS SG : rot 175:sc= 0.925 USER MOD Single : A 20 THR OG1 : rot 53:sc= 0.459 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.076) USER MOD Single : A 25 SER OG : rot 180:sc= -0.936 USER MOD Single : A 28 TYR OH : rot 65:sc= 1.83 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 CYS SG : rot 18:sc= 0.111 USER MOD Single : A 33 ASN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 35 SER OG : rot 73:sc= 1.23 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 MET CE :methyl 173:sc= 0 (180deg=-0.0419) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot -80:sc= 1.21 USER MOD Single : A 47 LYS NZ :NH3+ 170:sc=-0.00174 (180deg=-0.0913) USER MOD Single : A 48 LYS NZ :NH3+ 138:sc= 1.19 (180deg=0.434) USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 X(o=0,f=-0.47) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 160:sc= 0.293 (180deg=0.124) USER MOD Single : A 66 THR OG1 : rot 180:sc= -0.588 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot -156:sc= 1.24 USER MOD Single : A 72 ASN : amide:sc= 0 X(o=0,f=-0.038) 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 179:sc= 0 (180deg=-0.000245) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 17.074 32.432 32.210 1.00 0.00 N1+ ATOM 2 CA MET A 1 17.184 31.303 33.156 1.00 0.00 C ATOM 3 C MET A 1 17.799 30.071 32.504 1.00 0.00 C ATOM 4 O MET A 1 18.857 29.643 32.948 1.00 0.00 O ATOM 5 CB MET A 1 15.839 30.987 33.838 1.00 0.00 C ATOM 6 CG MET A 1 15.927 29.926 34.943 1.00 0.00 C ATOM 7 SD MET A 1 15.751 28.200 34.408 1.00 0.00 S ATOM 8 CE MET A 1 13.996 28.151 33.940 1.00 0.00 C ATOM 0 H1 MET A 1 16.651 33.250 32.693 1.00 0.00 H new ATOM 0 H2 MET A 1 18.020 32.687 31.862 1.00 0.00 H new ATOM 0 H3 MET A 1 16.473 32.155 31.408 1.00 0.00 H new ATOM 0 HA MET A 1 17.869 31.617 33.944 1.00 0.00 H new ATOM 0 HB2 MET A 1 15.436 31.906 34.264 1.00 0.00 H new ATOM 0 HB3 MET A 1 15.131 30.649 33.081 1.00 0.00 H new ATOM 0 HG2 MET A 1 16.888 30.033 35.446 1.00 0.00 H new ATOM 0 HG3 MET A 1 15.155 30.136 35.683 1.00 0.00 H new ATOM 0 HE1 MET A 1 13.682 27.115 33.813 1.00 0.00 H new ATOM 0 HE2 MET A 1 13.398 28.618 34.722 1.00 0.00 H new ATOM 0 HE3 MET A 1 13.854 28.691 33.004 1.00 0.00 H new ATOM 20 N ALA A 2 17.156 29.484 31.490 1.00 0.00 N ATOM 21 CA ALA A 2 17.584 28.217 30.899 1.00 0.00 C ATOM 22 C ALA A 2 18.852 28.358 30.032 1.00 0.00 C ATOM 23 O ALA A 2 19.022 29.343 29.307 1.00 0.00 O ATOM 24 CB ALA A 2 16.413 27.629 30.101 1.00 0.00 C ATOM 0 H ALA A 2 16.321 29.878 31.056 1.00 0.00 H new ATOM 0 HA ALA A 2 17.861 27.535 31.703 1.00 0.00 H new ATOM 0 HB1 ALA A 2 16.717 26.683 29.653 1.00 0.00 H new ATOM 0 HB2 ALA A 2 15.567 27.460 30.767 1.00 0.00 H new ATOM 0 HB3 ALA A 2 16.122 28.326 29.315 1.00 0.00 H new ATOM 30 N VAL A 3 19.711 27.345 30.118 1.00 0.00 N ATOM 31 CA VAL A 3 20.964 27.290 29.374 1.00 0.00 C ATOM 32 C VAL A 3 21.068 25.922 28.707 1.00 0.00 C ATOM 33 O VAL A 3 20.430 24.966 29.148 1.00 0.00 O ATOM 34 CB VAL A 3 22.181 27.502 30.291 1.00 0.00 C ATOM 35 CG1 VAL A 3 22.134 28.885 30.923 1.00 0.00 C ATOM 36 CG2 VAL A 3 22.235 26.420 31.359 1.00 0.00 C ATOM 0 H VAL A 3 19.554 26.531 30.713 1.00 0.00 H new ATOM 0 HA VAL A 3 20.964 28.089 28.633 1.00 0.00 H new ATOM 0 HB VAL A 3 23.088 27.433 29.690 1.00 0.00 H new ATOM 0 HG11 VAL A 3 23.002 29.020 31.569 1.00 0.00 H new ATOM 0 HG12 VAL A 3 22.143 29.643 30.140 1.00 0.00 H new ATOM 0 HG13 VAL A 3 21.223 28.984 31.514 1.00 0.00 H new ATOM 0 HG21 VAL A 3 23.102 26.584 32.000 1.00 0.00 H new ATOM 0 HG22 VAL A 3 21.327 26.457 31.961 1.00 0.00 H new ATOM 0 HG23 VAL A 3 22.315 25.443 30.883 1.00 0.00 H new ATOM 46 N ASN A 4 21.866 25.822 27.648 1.00 0.00 N ATOM 47 CA ASN A 4 21.995 24.558 26.930 1.00 0.00 C ATOM 48 C ASN A 4 23.076 23.633 27.528 1.00 0.00 C ATOM 49 O ASN A 4 24.248 24.008 27.586 1.00 0.00 O ATOM 50 CB ASN A 4 22.331 24.831 25.463 1.00 0.00 C ATOM 51 CG ASN A 4 21.264 25.647 24.763 1.00 0.00 C ATOM 52 OD1 ASN A 4 20.251 26.011 25.361 1.00 0.00 O ATOM 53 ND2 ASN A 4 21.486 25.941 23.486 1.00 0.00 N ATOM 0 H ASN A 4 22.425 26.588 27.272 1.00 0.00 H new ATOM 0 HA ASN A 4 21.037 24.045 27.022 1.00 0.00 H new ATOM 0 HB2 ASN A 4 23.283 25.358 25.404 1.00 0.00 H new ATOM 0 HB3 ASN A 4 22.459 23.883 24.941 1.00 0.00 H new ATOM 0 HD21 ASN A 4 20.803 26.489 22.963 1.00 0.00 H new ATOM 0 HD22 ASN A 4 22.339 25.619 23.029 1.00 0.00 H new ATOM 60 N LYS A 5 22.685 22.435 27.967 1.00 0.00 N ATOM 61 CA LYS A 5 23.608 21.449 28.524 1.00 0.00 C ATOM 62 C LYS A 5 24.602 20.946 27.480 1.00 0.00 C ATOM 63 O LYS A 5 25.764 20.675 27.785 1.00 0.00 O ATOM 64 CB LYS A 5 22.833 20.271 29.119 1.00 0.00 C ATOM 65 CG LYS A 5 21.938 20.652 30.288 1.00 0.00 C ATOM 66 CD LYS A 5 21.350 19.426 30.966 1.00 0.00 C ATOM 67 CE LYS A 5 20.548 18.581 29.990 1.00 0.00 C ATOM 68 NZ LYS A 5 19.960 17.380 30.645 1.00 0.00 N1+ ATOM 0 H LYS A 5 21.714 22.122 27.945 1.00 0.00 H new ATOM 0 HA LYS A 5 24.176 21.943 29.312 1.00 0.00 H new ATOM 0 HB2 LYS A 5 22.222 19.819 28.338 1.00 0.00 H new ATOM 0 HB3 LYS A 5 23.542 19.511 29.449 1.00 0.00 H new ATOM 0 HG2 LYS A 5 22.512 21.229 31.013 1.00 0.00 H new ATOM 0 HG3 LYS A 5 21.132 21.295 29.935 1.00 0.00 H new ATOM 0 HD2 LYS A 5 22.153 18.826 31.394 1.00 0.00 H new ATOM 0 HD3 LYS A 5 20.709 19.737 31.791 1.00 0.00 H new ATOM 0 HE2 LYS A 5 19.750 19.185 29.558 1.00 0.00 H new ATOM 0 HE3 LYS A 5 21.192 18.267 29.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 19.421 16.831 29.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 20.722 16.790 31.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 19.326 17.679 31.413 1.00 0.00 H new ATOM 82 N ASN A 6 24.126 20.825 26.245 1.00 0.00 N ATOM 83 CA ASN A 6 24.917 20.298 25.136 1.00 0.00 C ATOM 84 C ASN A 6 26.185 21.097 24.840 1.00 0.00 C ATOM 85 O ASN A 6 27.215 20.513 24.503 1.00 0.00 O ATOM 86 CB ASN A 6 24.056 20.223 23.873 1.00 0.00 C ATOM 87 CG ASN A 6 22.840 19.334 24.049 1.00 0.00 C ATOM 88 OD1 ASN A 6 22.617 18.773 25.122 1.00 0.00 O ATOM 89 ND2 ASN A 6 22.046 19.202 22.993 1.00 0.00 N ATOM 0 H ASN A 6 23.177 21.091 25.983 1.00 0.00 H new ATOM 0 HA ASN A 6 25.243 19.305 25.445 1.00 0.00 H new ATOM 0 HB2 ASN A 6 23.731 21.227 23.599 1.00 0.00 H new ATOM 0 HB3 ASN A 6 24.660 19.847 23.047 1.00 0.00 H new ATOM 0 HD21 ASN A 6 21.212 18.617 23.052 1.00 0.00 H new ATOM 0 HD22 ASN A 6 22.270 19.686 22.123 1.00 0.00 H new ATOM 96 N GLU A 7 26.126 22.418 24.959 1.00 0.00 N ATOM 97 CA GLU A 7 27.323 23.229 24.672 1.00 0.00 C ATOM 98 C GLU A 7 27.757 24.063 25.895 1.00 0.00 C ATOM 99 O GLU A 7 28.937 24.097 26.247 1.00 0.00 O ATOM 100 CB GLU A 7 27.053 24.142 23.461 1.00 0.00 C ATOM 101 CG GLU A 7 27.041 23.377 22.127 1.00 0.00 C ATOM 102 CD GLU A 7 26.637 24.250 20.922 1.00 0.00 C ATOM 103 OE1 GLU A 7 26.969 23.880 19.773 1.00 0.00 O ATOM 104 OE2 GLU A 7 25.974 25.300 21.113 1.00 0.00 O ATOM 0 H GLU A 7 25.299 22.944 25.241 1.00 0.00 H new ATOM 0 HA GLU A 7 28.144 22.551 24.438 1.00 0.00 H new ATOM 0 HB2 GLU A 7 26.094 24.642 23.596 1.00 0.00 H new ATOM 0 HB3 GLU A 7 27.816 24.920 23.421 1.00 0.00 H new ATOM 0 HG2 GLU A 7 28.032 22.960 21.947 1.00 0.00 H new ATOM 0 HG3 GLU A 7 26.351 22.537 22.205 1.00 0.00 H new ATOM 111 N TYR A 8 26.809 24.713 26.586 1.00 0.00 N ATOM 112 CA TYR A 8 27.049 25.595 27.737 1.00 0.00 C ATOM 113 C TYR A 8 27.706 24.900 28.926 1.00 0.00 C ATOM 114 O TYR A 8 28.316 25.599 29.728 1.00 0.00 O ATOM 115 CB TYR A 8 25.764 26.335 28.154 1.00 0.00 C ATOM 116 CG TYR A 8 26.040 27.714 28.738 1.00 0.00 C ATOM 117 CD1 TYR A 8 26.271 28.786 27.854 1.00 0.00 C ATOM 118 CD2 TYR A 8 26.110 27.932 30.133 1.00 0.00 C ATOM 119 CE1 TYR A 8 26.589 30.062 28.353 1.00 0.00 C ATOM 120 CE2 TYR A 8 26.428 29.211 30.634 1.00 0.00 C ATOM 121 CZ TYR A 8 26.677 30.279 29.742 1.00 0.00 C ATOM 122 OH TYR A 8 27.027 31.510 30.195 1.00 0.00 O ATOM 0 H TYR A 8 25.820 24.636 26.350 1.00 0.00 H new ATOM 0 HA TYR A 8 27.776 26.332 27.395 1.00 0.00 H new ATOM 0 HB2 TYR A 8 25.111 26.437 27.287 1.00 0.00 H new ATOM 0 HB3 TYR A 8 25.227 25.735 28.889 1.00 0.00 H new ATOM 0 HD1 TYR A 8 26.204 28.627 26.788 1.00 0.00 H new ATOM 0 HD2 TYR A 8 25.920 27.117 30.816 1.00 0.00 H new ATOM 0 HE1 TYR A 8 26.766 30.878 27.669 1.00 0.00 H new ATOM 0 HE2 TYR A 8 26.481 29.375 31.700 1.00 0.00 H new ATOM 0 HH TYR A 8 26.625 31.661 31.076 1.00 0.00 H new ATOM 132 N LYS A 9 27.719 23.558 29.006 1.00 0.00 N ATOM 133 CA LYS A 9 28.570 22.816 29.954 1.00 0.00 C ATOM 134 C LYS A 9 30.006 23.358 29.987 1.00 0.00 C ATOM 135 O LYS A 9 30.576 23.490 31.061 1.00 0.00 O ATOM 136 CB LYS A 9 28.549 21.323 29.584 1.00 0.00 C ATOM 137 CG LYS A 9 29.630 20.449 30.230 1.00 0.00 C ATOM 138 CD LYS A 9 29.338 18.949 30.035 1.00 0.00 C ATOM 139 CE LYS A 9 29.149 18.509 28.572 1.00 0.00 C ATOM 140 NZ LYS A 9 30.435 18.369 27.849 1.00 0.00 N1+ ATOM 0 H LYS A 9 27.142 22.958 28.417 1.00 0.00 H new ATOM 0 HA LYS A 9 28.169 22.949 30.959 1.00 0.00 H new ATOM 0 HB2 LYS A 9 27.574 20.917 29.854 1.00 0.00 H new ATOM 0 HB3 LYS A 9 28.641 21.237 28.501 1.00 0.00 H new ATOM 0 HG2 LYS A 9 30.601 20.691 29.797 1.00 0.00 H new ATOM 0 HG3 LYS A 9 29.691 20.673 31.295 1.00 0.00 H new ATOM 0 HD2 LYS A 9 30.157 18.375 30.469 1.00 0.00 H new ATOM 0 HD3 LYS A 9 28.438 18.693 30.595 1.00 0.00 H new ATOM 0 HE2 LYS A 9 28.618 17.558 28.548 1.00 0.00 H new ATOM 0 HE3 LYS A 9 28.523 19.237 28.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 30.252 18.071 26.869 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 30.933 19.282 27.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 31.024 17.655 28.323 1.00 0.00 H new ATOM 154 N ILE A 10 30.563 23.752 28.840 1.00 0.00 N ATOM 155 CA ILE A 10 31.897 24.365 28.761 1.00 0.00 C ATOM 156 C ILE A 10 31.968 25.678 29.565 1.00 0.00 C ATOM 157 O ILE A 10 32.866 25.858 30.385 1.00 0.00 O ATOM 158 CB ILE A 10 32.276 24.621 27.288 1.00 0.00 C ATOM 159 CG1 ILE A 10 32.231 23.364 26.391 1.00 0.00 C ATOM 160 CG2 ILE A 10 33.632 25.340 27.238 1.00 0.00 C ATOM 161 CD1 ILE A 10 33.460 22.464 26.481 1.00 0.00 C ATOM 0 H ILE A 10 30.103 23.656 27.935 1.00 0.00 H new ATOM 0 HA ILE A 10 32.611 23.668 29.201 1.00 0.00 H new ATOM 0 HB ILE A 10 31.510 25.265 26.857 1.00 0.00 H new ATOM 0 HG12 ILE A 10 31.350 22.779 26.655 1.00 0.00 H new ATOM 0 HG13 ILE A 10 32.105 23.679 25.355 1.00 0.00 H new ATOM 0 HG21 ILE A 10 33.908 25.525 26.200 1.00 0.00 H new ATOM 0 HG22 ILE A 10 33.560 26.289 27.769 1.00 0.00 H new ATOM 0 HG23 ILE A 10 34.392 24.717 27.710 1.00 0.00 H new ATOM 0 HD11 ILE A 10 33.335 21.609 25.816 1.00 0.00 H new ATOM 0 HD12 ILE A 10 34.346 23.027 26.186 1.00 0.00 H new ATOM 0 HD13 ILE A 10 33.579 22.112 27.506 1.00 0.00 H new ATOM 173 N LEU A 11 31.002 26.584 29.373 1.00 0.00 N ATOM 174 CA LEU A 11 30.894 27.834 30.131 1.00 0.00 C ATOM 175 C LEU A 11 30.587 27.610 31.626 1.00 0.00 C ATOM 176 O LEU A 11 30.820 28.500 32.443 1.00 0.00 O ATOM 177 CB LEU A 11 29.912 28.783 29.423 1.00 0.00 C ATOM 178 CG LEU A 11 30.603 29.852 28.542 1.00 0.00 C ATOM 179 CD1 LEU A 11 31.501 30.773 29.369 1.00 0.00 C ATOM 180 CD2 LEU A 11 31.409 29.298 27.370 1.00 0.00 C ATOM 0 H LEU A 11 30.265 26.467 28.678 1.00 0.00 H new ATOM 0 HA LEU A 11 31.869 28.321 30.141 1.00 0.00 H new ATOM 0 HB2 LEU A 11 29.237 28.195 28.802 1.00 0.00 H new ATOM 0 HB3 LEU A 11 29.300 29.284 30.173 1.00 0.00 H new ATOM 0 HG LEU A 11 29.771 30.413 28.116 1.00 0.00 H new ATOM 0 HD11 LEU A 11 31.968 31.509 28.715 1.00 0.00 H new ATOM 0 HD12 LEU A 11 30.902 31.285 30.122 1.00 0.00 H new ATOM 0 HD13 LEU A 11 32.274 30.182 29.860 1.00 0.00 H new ATOM 0 HD21 LEU A 11 31.854 30.122 26.813 1.00 0.00 H new ATOM 0 HD22 LEU A 11 32.198 28.646 27.746 1.00 0.00 H new ATOM 0 HD23 LEU A 11 30.751 28.729 26.713 1.00 0.00 H new ATOM 192 N ILE A 12 30.159 26.402 31.997 1.00 0.00 N ATOM 193 CA ILE A 12 30.002 25.969 33.394 1.00 0.00 C ATOM 194 C ILE A 12 31.331 25.463 33.988 1.00 0.00 C ATOM 195 O ILE A 12 31.630 25.755 35.145 1.00 0.00 O ATOM 196 CB ILE A 12 28.847 24.950 33.523 1.00 0.00 C ATOM 197 CG1 ILE A 12 27.503 25.523 33.013 1.00 0.00 C ATOM 198 CG2 ILE A 12 28.705 24.448 34.967 1.00 0.00 C ATOM 199 CD1 ILE A 12 26.952 26.738 33.777 1.00 0.00 C ATOM 0 H ILE A 12 29.905 25.679 31.323 1.00 0.00 H new ATOM 0 HA ILE A 12 29.725 26.835 33.995 1.00 0.00 H new ATOM 0 HB ILE A 12 29.105 24.103 32.887 1.00 0.00 H new ATOM 0 HG12 ILE A 12 27.624 25.802 31.966 1.00 0.00 H new ATOM 0 HG13 ILE A 12 26.757 24.729 33.047 1.00 0.00 H new ATOM 0 HG21 ILE A 12 27.884 23.733 35.025 1.00 0.00 H new ATOM 0 HG22 ILE A 12 29.631 23.963 35.276 1.00 0.00 H new ATOM 0 HG23 ILE A 12 28.499 25.291 35.627 1.00 0.00 H new ATOM 0 HD11 ILE A 12 26.008 27.051 33.330 1.00 0.00 H new ATOM 0 HD12 ILE A 12 26.788 26.468 34.820 1.00 0.00 H new ATOM 0 HD13 ILE A 12 27.669 27.557 33.723 1.00 0.00 H new ATOM 211 N MET A 13 32.185 24.794 33.201 1.00 0.00 N ATOM 212 CA MET A 13 33.501 24.311 33.652 1.00 0.00 C ATOM 213 C MET A 13 34.389 25.441 34.199 1.00 0.00 C ATOM 214 O MET A 13 34.984 25.299 35.270 1.00 0.00 O ATOM 215 CB MET A 13 34.233 23.581 32.509 1.00 0.00 C ATOM 216 CG MET A 13 33.545 22.278 32.093 1.00 0.00 C ATOM 217 SD MET A 13 34.169 21.535 30.566 1.00 0.00 S ATOM 218 CE MET A 13 33.556 19.847 30.803 1.00 0.00 C ATOM 0 H MET A 13 31.982 24.570 32.227 1.00 0.00 H new ATOM 0 HA MET A 13 33.313 23.615 34.470 1.00 0.00 H new ATOM 0 HB2 MET A 13 34.298 24.243 31.645 1.00 0.00 H new ATOM 0 HB3 MET A 13 35.254 23.363 32.820 1.00 0.00 H new ATOM 0 HG2 MET A 13 33.652 21.554 32.901 1.00 0.00 H new ATOM 0 HG3 MET A 13 32.478 22.470 31.976 1.00 0.00 H new ATOM 0 HE1 MET A 13 33.800 19.245 29.928 1.00 0.00 H new ATOM 0 HE2 MET A 13 34.024 19.411 31.685 1.00 0.00 H new ATOM 0 HE3 MET A 13 32.475 19.868 30.939 1.00 0.00 H new ATOM 228 N LEU A 14 34.461 26.589 33.510 1.00 0.00 N ATOM 229 CA LEU A 14 35.228 27.741 33.988 1.00 0.00 C ATOM 230 C LEU A 14 34.538 28.418 35.186 1.00 0.00 C ATOM 231 O LEU A 14 35.227 28.838 36.111 1.00 0.00 O ATOM 232 CB LEU A 14 35.543 28.758 32.867 1.00 0.00 C ATOM 233 CG LEU A 14 35.607 28.249 31.403 1.00 0.00 C ATOM 234 CD1 LEU A 14 34.331 28.638 30.700 1.00 0.00 C ATOM 235 CD2 LEU A 14 36.811 28.824 30.663 1.00 0.00 C ATOM 0 H LEU A 14 33.994 26.741 32.616 1.00 0.00 H new ATOM 0 HA LEU A 14 36.188 27.353 34.329 1.00 0.00 H new ATOM 0 HB2 LEU A 14 34.790 29.545 32.912 1.00 0.00 H new ATOM 0 HB3 LEU A 14 36.502 29.221 33.099 1.00 0.00 H new ATOM 0 HG LEU A 14 35.718 27.165 31.411 1.00 0.00 H new ATOM 0 HD11 LEU A 14 34.362 28.286 29.669 1.00 0.00 H new ATOM 0 HD12 LEU A 14 33.481 28.186 31.212 1.00 0.00 H new ATOM 0 HD13 LEU A 14 34.226 29.723 30.710 1.00 0.00 H new ATOM 0 HD21 LEU A 14 36.824 28.446 29.641 1.00 0.00 H new ATOM 0 HD22 LEU A 14 36.743 29.912 30.647 1.00 0.00 H new ATOM 0 HD23 LEU A 14 37.727 28.525 31.172 1.00 0.00 H new ATOM 247 N LYS A 15 33.196 28.472 35.201 1.00 0.00 N ATOM 248 CA LYS A 15 32.370 29.025 36.294 1.00 0.00 C ATOM 249 C LYS A 15 32.605 28.300 37.618 1.00 0.00 C ATOM 250 O LYS A 15 32.840 28.961 38.624 1.00 0.00 O ATOM 251 CB LYS A 15 30.899 29.005 35.835 1.00 0.00 C ATOM 252 CG LYS A 15 29.836 29.560 36.804 1.00 0.00 C ATOM 253 CD LYS A 15 29.214 28.516 37.734 1.00 0.00 C ATOM 254 CE LYS A 15 27.859 29.010 38.268 1.00 0.00 C ATOM 255 NZ LYS A 15 27.167 27.964 39.057 1.00 0.00 N1+ ATOM 0 H LYS A 15 32.634 28.120 34.426 1.00 0.00 H new ATOM 0 HA LYS A 15 32.659 30.056 36.499 1.00 0.00 H new ATOM 0 HB2 LYS A 15 30.831 29.569 34.905 1.00 0.00 H new ATOM 0 HB3 LYS A 15 30.635 27.973 35.603 1.00 0.00 H new ATOM 0 HG2 LYS A 15 30.290 30.343 37.411 1.00 0.00 H new ATOM 0 HG3 LYS A 15 29.042 30.028 36.222 1.00 0.00 H new ATOM 0 HD2 LYS A 15 29.080 27.577 37.198 1.00 0.00 H new ATOM 0 HD3 LYS A 15 29.888 28.314 38.567 1.00 0.00 H new ATOM 0 HE2 LYS A 15 28.012 29.893 38.889 1.00 0.00 H new ATOM 0 HE3 LYS A 15 27.228 29.314 37.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 26.257 28.333 39.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 26.998 27.131 38.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 27.759 27.692 39.868 1.00 0.00 H new ATOM 269 N GLU A 16 32.645 26.968 37.616 1.00 0.00 N ATOM 270 CA GLU A 16 32.987 26.177 38.810 1.00 0.00 C ATOM 271 C GLU A 16 34.410 26.445 39.322 1.00 0.00 C ATOM 272 O GLU A 16 34.634 26.476 40.531 1.00 0.00 O ATOM 273 CB GLU A 16 32.809 24.677 38.512 1.00 0.00 C ATOM 274 CG GLU A 16 31.336 24.254 38.431 1.00 0.00 C ATOM 275 CD GLU A 16 30.597 24.579 39.733 1.00 0.00 C ATOM 276 OE1 GLU A 16 29.711 25.464 39.717 1.00 0.00 O ATOM 277 OE2 GLU A 16 30.951 24.012 40.790 1.00 0.00 O ATOM 0 H GLU A 16 32.443 26.403 36.791 1.00 0.00 H new ATOM 0 HA GLU A 16 32.305 26.487 39.601 1.00 0.00 H new ATOM 0 HB2 GLU A 16 33.303 24.438 37.570 1.00 0.00 H new ATOM 0 HB3 GLU A 16 33.306 24.096 39.289 1.00 0.00 H new ATOM 0 HG2 GLU A 16 30.853 24.765 37.598 1.00 0.00 H new ATOM 0 HG3 GLU A 16 31.272 23.185 38.230 1.00 0.00 H new ATOM 284 N ASN A 17 35.347 26.628 38.400 1.00 0.00 N ATOM 285 CA ASN A 17 36.732 26.917 38.753 1.00 0.00 C ATOM 286 C ASN A 17 36.981 28.412 39.021 1.00 0.00 C ATOM 287 O ASN A 17 38.120 28.790 39.313 1.00 0.00 O ATOM 288 CB ASN A 17 37.673 26.432 37.647 1.00 0.00 C ATOM 289 CG ASN A 17 37.769 24.920 37.580 1.00 0.00 C ATOM 290 OD1 ASN A 17 38.431 24.293 38.408 1.00 0.00 O ATOM 291 ND2 ASN A 17 37.108 24.325 36.594 1.00 0.00 N ATOM 0 H ASN A 17 35.172 26.581 37.396 1.00 0.00 H new ATOM 0 HA ASN A 17 36.935 26.382 39.680 1.00 0.00 H new ATOM 0 HB2 ASN A 17 37.325 26.813 36.687 1.00 0.00 H new ATOM 0 HB3 ASN A 17 38.667 26.848 37.813 1.00 0.00 H new ATOM 0 HD21 ASN A 17 37.137 23.310 36.501 1.00 0.00 H new ATOM 0 HD22 ASN A 17 36.572 24.883 35.930 1.00 0.00 H new ATOM 298 N GLN A 18 35.937 29.238 38.836 1.00 0.00 N ATOM 299 CA GLN A 18 35.931 30.700 39.031 1.00 0.00 C ATOM 300 C GLN A 18 36.775 31.466 38.010 1.00 0.00 C ATOM 301 O GLN A 18 37.178 32.602 38.259 1.00 0.00 O ATOM 302 CB GLN A 18 36.264 31.121 40.477 1.00 0.00 C ATOM 303 CG GLN A 18 35.274 30.610 41.511 1.00 0.00 C ATOM 304 CD GLN A 18 35.680 30.955 42.931 1.00 0.00 C ATOM 305 OE1 GLN A 18 36.976 31.146 43.149 1.00 0.00 O flip ATOM 306 NE2 GLN A 18 34.836 31.050 43.823 1.00 0.00 N flip ATOM 0 H GLN A 18 35.029 28.888 38.531 1.00 0.00 H new ATOM 0 HA GLN A 18 34.897 30.992 38.846 1.00 0.00 H new ATOM 0 HB2 GLN A 18 37.260 30.757 40.731 1.00 0.00 H new ATOM 0 HB3 GLN A 18 36.300 32.209 40.529 1.00 0.00 H new ATOM 0 HG2 GLN A 18 34.290 31.032 41.306 1.00 0.00 H new ATOM 0 HG3 GLN A 18 35.182 29.528 41.416 1.00 0.00 H new ATOM 0 HE21 GLN A 18 33.850 30.895 43.611 1.00 0.00 H new ATOM 0 HE22 GLN A 18 35.123 31.284 44.774 1.00 0.00 H new ATOM 315 N CYS A 19 37.041 30.844 36.863 1.00 0.00 N ATOM 316 CA CYS A 19 37.791 31.492 35.798 1.00 0.00 C ATOM 317 C CYS A 19 36.793 32.205 34.894 1.00 0.00 C ATOM 318 O CYS A 19 36.547 31.769 33.769 1.00 0.00 O ATOM 319 CB CYS A 19 38.592 30.464 34.999 1.00 0.00 C ATOM 320 SG CYS A 19 39.809 29.551 35.976 1.00 0.00 S ATOM 0 H CYS A 19 36.746 29.891 36.651 1.00 0.00 H new ATOM 0 HA CYS A 19 38.500 32.205 36.219 1.00 0.00 H new ATOM 0 HB2 CYS A 19 37.900 29.754 34.545 1.00 0.00 H new ATOM 0 HB3 CYS A 19 39.106 30.974 34.184 1.00 0.00 H new ATOM 0 HG CYS A 19 40.363 28.638 35.235 1.00 0.00 H new ATOM 326 N THR A 20 36.218 33.299 35.381 1.00 0.00 N ATOM 327 CA THR A 20 35.230 34.040 34.613 1.00 0.00 C ATOM 328 C THR A 20 35.545 35.526 34.608 1.00 0.00 C ATOM 329 O THR A 20 34.873 36.315 35.272 1.00 0.00 O ATOM 330 CB THR A 20 33.812 33.833 35.179 1.00 0.00 C ATOM 331 OG1 THR A 20 33.789 34.196 36.565 1.00 0.00 O ATOM 332 CG2 THR A 20 33.383 32.381 35.030 1.00 0.00 C ATOM 0 H THR A 20 36.420 33.690 36.301 1.00 0.00 H new ATOM 0 HA THR A 20 35.268 33.658 33.593 1.00 0.00 H new ATOM 0 HB THR A 20 33.120 34.463 34.621 1.00 0.00 H new ATOM 0 HG1 THR A 20 34.150 35.101 36.672 1.00 0.00 H new ATOM 0 HG21 THR A 20 32.379 32.255 35.435 1.00 0.00 H new ATOM 0 HG22 THR A 20 33.385 32.107 33.975 1.00 0.00 H new ATOM 0 HG23 THR A 20 34.077 31.739 35.573 1.00 0.00 H new ATOM 340 N THR A 21 36.570 35.906 33.855 1.00 0.00 N ATOM 341 CA THR A 21 36.952 37.329 33.772 1.00 0.00 C ATOM 342 C THR A 21 37.999 37.561 32.690 1.00 0.00 C ATOM 343 O THR A 21 38.795 36.675 32.381 1.00 0.00 O ATOM 344 CB THR A 21 37.491 37.835 35.134 1.00 0.00 C ATOM 345 OG1 THR A 21 37.680 39.232 35.167 1.00 0.00 O ATOM 346 CG2 THR A 21 38.846 37.236 35.509 1.00 0.00 C ATOM 0 H THR A 21 37.146 35.273 33.301 1.00 0.00 H new ATOM 0 HA THR A 21 36.055 37.890 33.512 1.00 0.00 H new ATOM 0 HB THR A 21 36.717 37.522 35.835 1.00 0.00 H new ATOM 0 HG1 THR A 21 38.019 39.496 36.048 1.00 0.00 H new ATOM 0 HG21 THR A 21 39.165 37.632 36.473 1.00 0.00 H new ATOM 0 HG22 THR A 21 38.759 36.151 35.574 1.00 0.00 H new ATOM 0 HG23 THR A 21 39.582 37.496 34.748 1.00 0.00 H new ATOM 354 N GLU A 22 38.029 38.779 32.155 1.00 0.00 N ATOM 355 CA GLU A 22 38.978 39.241 31.145 1.00 0.00 C ATOM 356 C GLU A 22 40.446 39.144 31.594 1.00 0.00 C ATOM 357 O GLU A 22 41.341 39.055 30.755 1.00 0.00 O ATOM 358 CB GLU A 22 38.646 40.688 30.734 1.00 0.00 C ATOM 359 CG GLU A 22 37.260 40.897 30.099 1.00 0.00 C ATOM 360 CD GLU A 22 36.961 42.372 29.779 1.00 0.00 C ATOM 361 OE1 GLU A 22 37.733 43.257 30.213 1.00 0.00 O ATOM 362 OE2 GLU A 22 35.940 42.656 29.112 1.00 0.00 O ATOM 0 H GLU A 22 37.363 39.503 32.425 1.00 0.00 H new ATOM 0 HA GLU A 22 38.872 38.573 30.290 1.00 0.00 H new ATOM 0 HB2 GLU A 22 38.721 41.324 31.616 1.00 0.00 H new ATOM 0 HB3 GLU A 22 39.404 41.030 30.029 1.00 0.00 H new ATOM 0 HG2 GLU A 22 37.195 40.312 29.182 1.00 0.00 H new ATOM 0 HG3 GLU A 22 36.495 40.516 30.776 1.00 0.00 H new ATOM 369 N LEU A 23 40.700 39.143 32.909 1.00 0.00 N ATOM 370 CA LEU A 23 42.043 39.080 33.497 1.00 0.00 C ATOM 371 C LEU A 23 42.648 37.659 33.514 1.00 0.00 C ATOM 372 O LEU A 23 43.859 37.524 33.711 1.00 0.00 O ATOM 373 CB LEU A 23 42.002 39.685 34.918 1.00 0.00 C ATOM 374 CG LEU A 23 42.008 41.229 34.967 1.00 0.00 C ATOM 375 CD1 LEU A 23 40.723 41.881 34.449 1.00 0.00 C ATOM 376 CD2 LEU A 23 42.205 41.697 36.411 1.00 0.00 C ATOM 0 H LEU A 23 39.960 39.187 33.609 1.00 0.00 H new ATOM 0 HA LEU A 23 42.705 39.665 32.859 1.00 0.00 H new ATOM 0 HB2 LEU A 23 41.108 39.323 35.426 1.00 0.00 H new ATOM 0 HB3 LEU A 23 42.859 39.315 35.480 1.00 0.00 H new ATOM 0 HG LEU A 23 42.824 41.535 34.312 1.00 0.00 H new ATOM 0 HD11 LEU A 23 40.811 42.965 34.519 1.00 0.00 H new ATOM 0 HD12 LEU A 23 40.564 41.596 33.409 1.00 0.00 H new ATOM 0 HD13 LEU A 23 39.877 41.547 35.050 1.00 0.00 H new ATOM 0 HD21 LEU A 23 42.209 42.787 36.443 1.00 0.00 H new ATOM 0 HD22 LEU A 23 41.392 41.319 37.030 1.00 0.00 H new ATOM 0 HD23 LEU A 23 43.155 41.320 36.789 1.00 0.00 H new ATOM 388 N LYS A 24 41.847 36.597 33.321 1.00 0.00 N ATOM 389 CA LYS A 24 42.316 35.198 33.301 1.00 0.00 C ATOM 390 C LYS A 24 42.003 34.548 31.958 1.00 0.00 C ATOM 391 O LYS A 24 40.846 34.443 31.566 1.00 0.00 O ATOM 392 CB LYS A 24 41.710 34.367 34.449 1.00 0.00 C ATOM 393 CG LYS A 24 42.137 34.813 35.857 1.00 0.00 C ATOM 394 CD LYS A 24 41.518 33.968 36.978 1.00 0.00 C ATOM 395 CE LYS A 24 41.922 34.466 38.368 1.00 0.00 C ATOM 396 NZ LYS A 24 43.382 34.363 38.596 1.00 0.00 N1+ ATOM 0 H LYS A 24 40.842 36.686 33.172 1.00 0.00 H new ATOM 0 HA LYS A 24 43.396 35.219 33.445 1.00 0.00 H new ATOM 0 HB2 LYS A 24 40.623 34.416 34.381 1.00 0.00 H new ATOM 0 HB3 LYS A 24 41.991 33.323 34.312 1.00 0.00 H new ATOM 0 HG2 LYS A 24 43.223 34.763 35.932 1.00 0.00 H new ATOM 0 HG3 LYS A 24 41.855 35.856 36.001 1.00 0.00 H new ATOM 0 HD2 LYS A 24 40.432 33.988 36.888 1.00 0.00 H new ATOM 0 HD3 LYS A 24 41.828 32.930 36.862 1.00 0.00 H new ATOM 0 HE2 LYS A 24 41.610 35.504 38.485 1.00 0.00 H new ATOM 0 HE3 LYS A 24 41.396 33.887 39.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 43.596 34.598 39.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 43.697 33.393 38.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 43.879 35.026 37.968 1.00 0.00 H new ATOM 410 N SER A 25 43.038 34.069 31.272 1.00 0.00 N ATOM 411 CA SER A 25 42.917 33.456 29.944 1.00 0.00 C ATOM 412 C SER A 25 43.485 32.035 29.952 1.00 0.00 C ATOM 413 O SER A 25 44.650 31.831 30.312 1.00 0.00 O ATOM 414 CB SER A 25 43.600 34.308 28.862 1.00 0.00 C ATOM 415 OG SER A 25 42.984 35.573 28.671 1.00 0.00 O ATOM 0 H SER A 25 43.996 34.094 31.623 1.00 0.00 H new ATOM 0 HA SER A 25 41.856 33.405 29.700 1.00 0.00 H new ATOM 0 HB2 SER A 25 44.645 34.458 29.133 1.00 0.00 H new ATOM 0 HB3 SER A 25 43.591 33.761 27.919 1.00 0.00 H new ATOM 0 HG SER A 25 43.463 36.068 27.974 1.00 0.00 H new ATOM 421 N PHE A 26 42.670 31.058 29.556 1.00 0.00 N ATOM 422 CA PHE A 26 43.042 29.651 29.456 1.00 0.00 C ATOM 423 C PHE A 26 43.646 29.284 28.090 1.00 0.00 C ATOM 424 O PHE A 26 43.141 29.651 27.025 1.00 0.00 O ATOM 425 CB PHE A 26 41.821 28.759 29.742 1.00 0.00 C ATOM 426 CG PHE A 26 41.670 28.248 31.165 1.00 0.00 C ATOM 427 CD1 PHE A 26 42.733 27.579 31.806 1.00 0.00 C ATOM 428 CD2 PHE A 26 40.423 28.339 31.812 1.00 0.00 C ATOM 429 CE1 PHE A 26 42.553 27.029 33.088 1.00 0.00 C ATOM 430 CE2 PHE A 26 40.228 27.740 33.070 1.00 0.00 C ATOM 431 CZ PHE A 26 41.296 27.091 33.713 1.00 0.00 C ATOM 0 H PHE A 26 41.701 31.232 29.288 1.00 0.00 H new ATOM 0 HA PHE A 26 43.816 29.478 30.204 1.00 0.00 H new ATOM 0 HB2 PHE A 26 40.922 29.319 29.484 1.00 0.00 H new ATOM 0 HB3 PHE A 26 41.864 27.899 29.074 1.00 0.00 H new ATOM 0 HD1 PHE A 26 43.689 27.489 31.311 1.00 0.00 H new ATOM 0 HD2 PHE A 26 39.611 28.872 31.340 1.00 0.00 H new ATOM 0 HE1 PHE A 26 43.383 26.558 33.593 1.00 0.00 H new ATOM 0 HE2 PHE A 26 39.257 27.779 33.542 1.00 0.00 H new ATOM 0 HZ PHE A 26 41.151 26.641 34.684 1.00 0.00 H new ATOM 441 N THR A 27 44.693 28.461 28.150 1.00 0.00 N ATOM 442 CA THR A 27 45.218 27.654 27.043 1.00 0.00 C ATOM 443 C THR A 27 44.307 26.457 26.756 1.00 0.00 C ATOM 444 O THR A 27 43.638 25.930 27.652 1.00 0.00 O ATOM 445 CB THR A 27 46.611 27.116 27.410 1.00 0.00 C ATOM 446 OG1 THR A 27 46.508 26.392 28.619 1.00 0.00 O ATOM 447 CG2 THR A 27 47.631 28.241 27.588 1.00 0.00 C ATOM 0 H THR A 27 45.224 28.331 29.011 1.00 0.00 H new ATOM 0 HA THR A 27 45.269 28.291 26.160 1.00 0.00 H new ATOM 0 HB THR A 27 46.957 26.479 26.596 1.00 0.00 H new ATOM 0 HG1 THR A 27 47.389 26.041 28.866 1.00 0.00 H new ATOM 0 HG21 THR A 27 48.601 27.815 27.847 1.00 0.00 H new ATOM 0 HG22 THR A 27 47.718 28.804 26.659 1.00 0.00 H new ATOM 0 HG23 THR A 27 47.303 28.907 28.386 1.00 0.00 H new ATOM 455 N TYR A 28 44.326 25.955 25.519 1.00 0.00 N ATOM 456 CA TYR A 28 43.684 24.674 25.206 1.00 0.00 C ATOM 457 C TYR A 28 44.419 23.489 25.860 1.00 0.00 C ATOM 458 O TYR A 28 43.780 22.490 26.178 1.00 0.00 O ATOM 459 CB TYR A 28 43.574 24.484 23.685 1.00 0.00 C ATOM 460 CG TYR A 28 42.698 25.463 22.909 1.00 0.00 C ATOM 461 CD1 TYR A 28 41.547 26.058 23.477 1.00 0.00 C ATOM 462 CD2 TYR A 28 43.007 25.716 21.558 1.00 0.00 C ATOM 463 CE1 TYR A 28 40.714 26.884 22.699 1.00 0.00 C ATOM 464 CE2 TYR A 28 42.185 26.555 20.781 1.00 0.00 C ATOM 465 CZ TYR A 28 41.030 27.130 21.347 1.00 0.00 C ATOM 466 OH TYR A 28 40.224 27.912 20.585 1.00 0.00 O ATOM 0 H TYR A 28 44.774 26.410 24.724 1.00 0.00 H new ATOM 0 HA TYR A 28 42.678 24.697 25.625 1.00 0.00 H new ATOM 0 HB2 TYR A 28 44.580 24.531 23.268 1.00 0.00 H new ATOM 0 HB3 TYR A 28 43.198 23.478 23.499 1.00 0.00 H new ATOM 0 HD1 TYR A 28 41.306 25.877 24.514 1.00 0.00 H new ATOM 0 HD2 TYR A 28 43.881 25.263 21.115 1.00 0.00 H new ATOM 0 HE1 TYR A 28 39.833 27.329 23.137 1.00 0.00 H new ATOM 0 HE2 TYR A 28 42.440 26.758 19.751 1.00 0.00 H new ATOM 0 HH TYR A 28 40.234 28.828 20.932 1.00 0.00 H new ATOM 476 N THR A 29 45.730 23.600 26.118 1.00 0.00 N ATOM 477 CA THR A 29 46.533 22.541 26.762 1.00 0.00 C ATOM 478 C THR A 29 46.061 22.245 28.188 1.00 0.00 C ATOM 479 O THR A 29 45.733 21.096 28.487 1.00 0.00 O ATOM 480 CB THR A 29 48.039 22.866 26.752 1.00 0.00 C ATOM 481 OG1 THR A 29 48.308 24.081 27.413 1.00 0.00 O ATOM 482 CG2 THR A 29 48.600 22.993 25.338 1.00 0.00 C ATOM 0 H THR A 29 46.271 24.433 25.885 1.00 0.00 H new ATOM 0 HA THR A 29 46.380 21.643 26.164 1.00 0.00 H new ATOM 0 HB THR A 29 48.516 22.031 27.265 1.00 0.00 H new ATOM 0 HG1 THR A 29 49.271 24.259 27.391 1.00 0.00 H new ATOM 0 HG21 THR A 29 49.664 23.222 25.388 1.00 0.00 H new ATOM 0 HG22 THR A 29 48.456 22.054 24.804 1.00 0.00 H new ATOM 0 HG23 THR A 29 48.081 23.793 24.811 1.00 0.00 H new ATOM 490 N LYS A 30 45.936 23.259 29.060 1.00 0.00 N ATOM 491 CA LYS A 30 45.412 23.072 30.426 1.00 0.00 C ATOM 492 C LYS A 30 43.927 22.692 30.418 1.00 0.00 C ATOM 493 O LYS A 30 43.536 21.792 31.164 1.00 0.00 O ATOM 494 CB LYS A 30 45.702 24.327 31.272 1.00 0.00 C ATOM 495 CG LYS A 30 45.092 24.310 32.687 1.00 0.00 C ATOM 496 CD LYS A 30 45.582 23.194 33.629 1.00 0.00 C ATOM 497 CE LYS A 30 44.802 23.236 34.957 1.00 0.00 C ATOM 498 NZ LYS A 30 45.505 22.521 36.046 1.00 0.00 N1+ ATOM 0 H LYS A 30 46.192 24.222 28.843 1.00 0.00 H new ATOM 0 HA LYS A 30 45.928 22.231 30.890 1.00 0.00 H new ATOM 0 HB2 LYS A 30 46.782 24.447 31.359 1.00 0.00 H new ATOM 0 HB3 LYS A 30 45.326 25.201 30.740 1.00 0.00 H new ATOM 0 HG2 LYS A 30 45.297 25.271 33.159 1.00 0.00 H new ATOM 0 HG3 LYS A 30 44.009 24.226 32.592 1.00 0.00 H new ATOM 0 HD2 LYS A 30 45.451 22.223 33.153 1.00 0.00 H new ATOM 0 HD3 LYS A 30 46.648 23.313 33.821 1.00 0.00 H new ATOM 0 HE2 LYS A 30 44.644 24.274 35.250 1.00 0.00 H new ATOM 0 HE3 LYS A 30 43.817 22.793 34.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 44.942 22.577 36.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 45.633 21.524 35.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 46.435 22.959 36.206 1.00 0.00 H new ATOM 512 N LEU A 31 43.106 23.318 29.564 1.00 0.00 N ATOM 513 CA LEU A 31 41.679 22.977 29.445 1.00 0.00 C ATOM 514 C LEU A 31 41.445 21.510 29.072 1.00 0.00 C ATOM 515 O LEU A 31 40.467 20.937 29.550 1.00 0.00 O ATOM 516 CB LEU A 31 40.989 23.874 28.401 1.00 0.00 C ATOM 517 CG LEU A 31 40.601 25.270 28.910 1.00 0.00 C ATOM 518 CD1 LEU A 31 40.150 26.130 27.727 1.00 0.00 C ATOM 519 CD2 LEU A 31 39.449 25.215 29.918 1.00 0.00 C ATOM 0 H LEU A 31 43.407 24.068 28.941 1.00 0.00 H new ATOM 0 HA LEU A 31 41.247 23.145 30.431 1.00 0.00 H new ATOM 0 HB2 LEU A 31 41.652 23.986 27.543 1.00 0.00 H new ATOM 0 HB3 LEU A 31 40.091 23.369 28.045 1.00 0.00 H new ATOM 0 HG LEU A 31 41.477 25.692 29.402 1.00 0.00 H new ATOM 0 HD11 LEU A 31 39.873 27.122 28.083 1.00 0.00 H new ATOM 0 HD12 LEU A 31 40.965 26.217 27.008 1.00 0.00 H new ATOM 0 HD13 LEU A 31 39.290 25.664 27.246 1.00 0.00 H new ATOM 0 HD21 LEU A 31 39.208 26.225 30.251 1.00 0.00 H new ATOM 0 HD22 LEU A 31 38.573 24.770 29.446 1.00 0.00 H new ATOM 0 HD23 LEU A 31 39.745 24.611 30.776 1.00 0.00 H new ATOM 531 N CYS A 32 42.323 20.895 28.271 1.00 0.00 N ATOM 532 CA CYS A 32 42.198 19.498 27.849 1.00 0.00 C ATOM 533 C CYS A 32 42.130 18.529 29.050 1.00 0.00 C ATOM 534 O CYS A 32 41.357 17.570 29.016 1.00 0.00 O ATOM 535 CB CYS A 32 43.375 19.186 26.906 1.00 0.00 C ATOM 536 SG CYS A 32 43.013 17.754 25.851 1.00 0.00 S ATOM 0 H CYS A 32 43.149 21.360 27.894 1.00 0.00 H new ATOM 0 HA CYS A 32 41.257 19.353 27.319 1.00 0.00 H new ATOM 0 HB2 CYS A 32 43.585 20.055 26.283 1.00 0.00 H new ATOM 0 HB3 CYS A 32 44.272 18.990 27.493 1.00 0.00 H new ATOM 0 HG CYS A 32 41.731 17.542 25.833 1.00 0.00 H new ATOM 542 N ASN A 33 42.875 18.798 30.134 1.00 0.00 N ATOM 543 CA ASN A 33 42.772 18.030 31.384 1.00 0.00 C ATOM 544 C ASN A 33 41.484 18.371 32.153 1.00 0.00 C ATOM 545 O ASN A 33 40.654 17.495 32.380 1.00 0.00 O ATOM 546 CB ASN A 33 44.030 18.252 32.247 1.00 0.00 C ATOM 547 CG ASN A 33 44.103 17.309 33.447 1.00 0.00 C ATOM 548 OD1 ASN A 33 43.539 16.226 33.484 1.00 0.00 O ATOM 549 ND2 ASN A 33 44.791 17.698 34.495 1.00 0.00 N ATOM 0 H ASN A 33 43.563 19.551 30.168 1.00 0.00 H new ATOM 0 HA ASN A 33 42.714 16.971 31.134 1.00 0.00 H new ATOM 0 HB2 ASN A 33 44.917 18.114 31.629 1.00 0.00 H new ATOM 0 HB3 ASN A 33 44.045 19.283 32.600 1.00 0.00 H new ATOM 0 HD21 ASN A 33 44.847 17.100 35.319 1.00 0.00 H new ATOM 0 HD22 ASN A 33 45.270 18.599 34.485 1.00 0.00 H new ATOM 556 N ILE A 34 41.277 19.653 32.503 1.00 0.00 N ATOM 557 CA ILE A 34 40.165 20.123 33.336 1.00 0.00 C ATOM 558 C ILE A 34 38.806 19.659 32.788 1.00 0.00 C ATOM 559 O ILE A 34 37.930 19.248 33.549 1.00 0.00 O ATOM 560 CB ILE A 34 40.204 21.670 33.397 1.00 0.00 C ATOM 561 CG1 ILE A 34 41.530 22.258 33.933 1.00 0.00 C ATOM 562 CG2 ILE A 34 39.091 22.203 34.297 1.00 0.00 C ATOM 563 CD1 ILE A 34 41.544 23.796 33.878 1.00 0.00 C ATOM 0 H ILE A 34 41.896 20.407 32.205 1.00 0.00 H new ATOM 0 HA ILE A 34 40.279 19.699 34.334 1.00 0.00 H new ATOM 0 HB ILE A 34 40.084 21.982 32.360 1.00 0.00 H new ATOM 0 HG12 ILE A 34 41.682 21.931 34.962 1.00 0.00 H new ATOM 0 HG13 ILE A 34 42.362 21.867 33.348 1.00 0.00 H new ATOM 0 HG21 ILE A 34 39.136 23.292 34.326 1.00 0.00 H new ATOM 0 HG22 ILE A 34 38.124 21.890 33.903 1.00 0.00 H new ATOM 0 HG23 ILE A 34 39.217 21.808 35.305 1.00 0.00 H new ATOM 0 HD11 ILE A 34 42.494 24.165 34.264 1.00 0.00 H new ATOM 0 HD12 ILE A 34 41.419 24.124 32.846 1.00 0.00 H new ATOM 0 HD13 ILE A 34 40.728 24.189 34.485 1.00 0.00 H new ATOM 575 N SER A 35 38.642 19.744 31.466 1.00 0.00 N ATOM 576 CA SER A 35 37.369 19.553 30.764 1.00 0.00 C ATOM 577 C SER A 35 37.040 18.085 30.451 1.00 0.00 C ATOM 578 O SER A 35 35.925 17.807 30.012 1.00 0.00 O ATOM 579 CB SER A 35 37.373 20.351 29.451 1.00 0.00 C ATOM 580 OG SER A 35 37.867 21.666 29.617 1.00 0.00 O ATOM 0 H SER A 35 39.415 19.954 30.834 1.00 0.00 H new ATOM 0 HA SER A 35 36.597 19.912 31.445 1.00 0.00 H new ATOM 0 HB2 SER A 35 37.982 19.828 28.714 1.00 0.00 H new ATOM 0 HB3 SER A 35 36.359 20.395 29.053 1.00 0.00 H new ATOM 0 HG SER A 35 38.837 21.636 29.753 1.00 0.00 H new ATOM 586 N LYS A 36 37.986 17.145 30.627 1.00 0.00 N ATOM 587 CA LYS A 36 37.819 15.708 30.307 1.00 0.00 C ATOM 588 C LYS A 36 37.428 15.409 28.841 1.00 0.00 C ATOM 589 O LYS A 36 36.666 14.476 28.571 1.00 0.00 O ATOM 590 CB LYS A 36 36.849 15.064 31.321 1.00 0.00 C ATOM 591 CG LYS A 36 37.461 14.921 32.726 1.00 0.00 C ATOM 592 CD LYS A 36 36.429 14.356 33.709 1.00 0.00 C ATOM 593 CE LYS A 36 37.018 14.170 35.111 1.00 0.00 C ATOM 594 NZ LYS A 36 36.029 13.575 36.045 1.00 0.00 N1+ ATOM 0 H LYS A 36 38.909 17.363 31.003 1.00 0.00 H new ATOM 0 HA LYS A 36 38.802 15.248 30.403 1.00 0.00 H new ATOM 0 HB2 LYS A 36 35.944 15.668 31.384 1.00 0.00 H new ATOM 0 HB3 LYS A 36 36.552 14.080 30.958 1.00 0.00 H new ATOM 0 HG2 LYS A 36 38.330 14.264 32.685 1.00 0.00 H new ATOM 0 HG3 LYS A 36 37.812 15.892 33.076 1.00 0.00 H new ATOM 0 HD2 LYS A 36 35.572 15.027 33.761 1.00 0.00 H new ATOM 0 HD3 LYS A 36 36.062 13.399 33.339 1.00 0.00 H new ATOM 0 HE2 LYS A 36 37.898 13.529 35.055 1.00 0.00 H new ATOM 0 HE3 LYS A 36 37.350 15.134 35.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 36.462 13.463 36.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 35.201 14.200 36.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 35.731 12.645 35.689 1.00 0.00 H new ATOM 608 N LEU A 37 37.899 16.197 27.873 1.00 0.00 N ATOM 609 CA LEU A 37 37.474 16.117 26.476 1.00 0.00 C ATOM 610 C LEU A 37 38.564 16.526 25.483 1.00 0.00 C ATOM 611 O LEU A 37 39.544 17.167 25.859 1.00 0.00 O ATOM 612 CB LEU A 37 36.159 16.896 26.323 1.00 0.00 C ATOM 613 CG LEU A 37 36.170 18.406 26.626 1.00 0.00 C ATOM 614 CD1 LEU A 37 36.710 19.299 25.517 1.00 0.00 C ATOM 615 CD2 LEU A 37 34.754 18.894 26.932 1.00 0.00 C ATOM 0 H LEU A 37 38.598 16.920 28.041 1.00 0.00 H new ATOM 0 HA LEU A 37 37.289 15.075 26.216 1.00 0.00 H new ATOM 0 HB2 LEU A 37 35.811 16.764 25.299 1.00 0.00 H new ATOM 0 HB3 LEU A 37 35.418 16.431 26.974 1.00 0.00 H new ATOM 0 HG LEU A 37 36.848 18.494 27.475 1.00 0.00 H new ATOM 0 HD11 LEU A 37 36.672 20.340 25.837 1.00 0.00 H new ATOM 0 HD12 LEU A 37 37.742 19.024 25.299 1.00 0.00 H new ATOM 0 HD13 LEU A 37 36.103 19.172 24.620 1.00 0.00 H new ATOM 0 HD21 LEU A 37 34.775 19.963 27.145 1.00 0.00 H new ATOM 0 HD22 LEU A 37 34.111 18.708 26.072 1.00 0.00 H new ATOM 0 HD23 LEU A 37 34.364 18.360 27.798 1.00 0.00 H new ATOM 627 N SER A 38 38.388 16.139 24.213 1.00 0.00 N ATOM 628 CA SER A 38 39.340 16.445 23.139 1.00 0.00 C ATOM 629 C SER A 38 39.512 17.958 22.982 1.00 0.00 C ATOM 630 O SER A 38 38.538 18.717 23.030 1.00 0.00 O ATOM 631 CB SER A 38 38.918 15.778 21.815 1.00 0.00 C ATOM 632 OG SER A 38 37.674 16.244 21.300 1.00 0.00 O ATOM 0 H SER A 38 37.578 15.603 23.901 1.00 0.00 H new ATOM 0 HA SER A 38 40.310 16.030 23.414 1.00 0.00 H new ATOM 0 HB2 SER A 38 39.695 15.950 21.070 1.00 0.00 H new ATOM 0 HB3 SER A 38 38.855 14.700 21.967 1.00 0.00 H new ATOM 0 HG SER A 38 37.473 15.779 20.461 1.00 0.00 H new ATOM 638 N MET A 39 40.747 18.427 22.764 1.00 0.00 N ATOM 639 CA MET A 39 40.970 19.863 22.559 1.00 0.00 C ATOM 640 C MET A 39 40.343 20.369 21.249 1.00 0.00 C ATOM 641 O MET A 39 40.014 21.549 21.167 1.00 0.00 O ATOM 642 CB MET A 39 42.441 20.258 22.718 1.00 0.00 C ATOM 643 CG MET A 39 43.407 19.669 21.687 1.00 0.00 C ATOM 644 SD MET A 39 44.977 20.575 21.566 1.00 0.00 S ATOM 645 CE MET A 39 45.571 20.487 23.281 1.00 0.00 C ATOM 0 H MET A 39 41.587 17.850 22.725 1.00 0.00 H new ATOM 0 HA MET A 39 40.442 20.379 23.361 1.00 0.00 H new ATOM 0 HB2 MET A 39 42.512 21.345 22.674 1.00 0.00 H new ATOM 0 HB3 MET A 39 42.773 19.957 23.712 1.00 0.00 H new ATOM 0 HG2 MET A 39 43.615 18.631 21.947 1.00 0.00 H new ATOM 0 HG3 MET A 39 42.924 19.663 20.710 1.00 0.00 H new ATOM 0 HE1 MET A 39 46.582 20.891 23.337 1.00 0.00 H new ATOM 0 HE2 MET A 39 44.911 21.069 23.925 1.00 0.00 H new ATOM 0 HE3 MET A 39 45.577 19.448 23.611 1.00 0.00 H new ATOM 655 N SER A 40 40.051 19.487 20.283 1.00 0.00 N ATOM 656 CA SER A 40 39.107 19.776 19.194 1.00 0.00 C ATOM 657 C SER A 40 37.745 20.229 19.736 1.00 0.00 C ATOM 658 O SER A 40 37.300 21.329 19.410 1.00 0.00 O ATOM 659 CB SER A 40 38.940 18.557 18.279 1.00 0.00 C ATOM 660 OG SER A 40 37.934 18.815 17.323 1.00 0.00 O ATOM 0 H SER A 40 40.462 18.555 20.234 1.00 0.00 H new ATOM 0 HA SER A 40 39.524 20.595 18.609 1.00 0.00 H new ATOM 0 HB2 SER A 40 39.882 18.334 17.779 1.00 0.00 H new ATOM 0 HB3 SER A 40 38.677 17.680 18.870 1.00 0.00 H new ATOM 0 HG SER A 40 37.830 18.035 16.739 1.00 0.00 H new ATOM 666 N THR A 41 37.117 19.458 20.636 1.00 0.00 N ATOM 667 CA THR A 41 35.813 19.803 21.239 1.00 0.00 C ATOM 668 C THR A 41 35.860 21.142 21.985 1.00 0.00 C ATOM 669 O THR A 41 34.947 21.963 21.838 1.00 0.00 O ATOM 670 CB THR A 41 35.300 18.679 22.163 1.00 0.00 C ATOM 671 OG1 THR A 41 34.804 17.618 21.378 1.00 0.00 O ATOM 672 CG2 THR A 41 34.149 19.123 23.066 1.00 0.00 C ATOM 0 H THR A 41 37.498 18.573 20.970 1.00 0.00 H new ATOM 0 HA THR A 41 35.107 19.911 20.416 1.00 0.00 H new ATOM 0 HB THR A 41 36.147 18.387 22.783 1.00 0.00 H new ATOM 0 HG1 THR A 41 35.529 16.989 21.183 1.00 0.00 H new ATOM 0 HG21 THR A 41 33.834 18.287 23.691 1.00 0.00 H new ATOM 0 HG22 THR A 41 34.480 19.946 23.700 1.00 0.00 H new ATOM 0 HG23 THR A 41 33.311 19.453 22.452 1.00 0.00 H new ATOM 680 N VAL A 42 36.930 21.415 22.745 1.00 0.00 N ATOM 681 CA VAL A 42 37.057 22.697 23.462 1.00 0.00 C ATOM 682 C VAL A 42 37.292 23.878 22.513 1.00 0.00 C ATOM 683 O VAL A 42 36.643 24.905 22.674 1.00 0.00 O ATOM 684 CB VAL A 42 38.062 22.622 24.632 1.00 0.00 C ATOM 685 CG1 VAL A 42 39.544 22.681 24.245 1.00 0.00 C ATOM 686 CG2 VAL A 42 37.816 23.779 25.607 1.00 0.00 C ATOM 0 H VAL A 42 37.713 20.775 22.880 1.00 0.00 H new ATOM 0 HA VAL A 42 36.092 22.896 23.929 1.00 0.00 H new ATOM 0 HB VAL A 42 37.881 21.640 25.068 1.00 0.00 H new ATOM 0 HG11 VAL A 42 40.157 22.620 25.144 1.00 0.00 H new ATOM 0 HG12 VAL A 42 39.782 21.846 23.587 1.00 0.00 H new ATOM 0 HG13 VAL A 42 39.748 23.619 23.729 1.00 0.00 H new ATOM 0 HG21 VAL A 42 38.529 23.719 26.430 1.00 0.00 H new ATOM 0 HG22 VAL A 42 37.943 24.728 25.085 1.00 0.00 H new ATOM 0 HG23 VAL A 42 36.802 23.714 26.000 1.00 0.00 H new ATOM 696 N ARG A 43 38.119 23.734 21.465 1.00 0.00 N ATOM 697 CA ARG A 43 38.372 24.744 20.431 1.00 0.00 C ATOM 698 C ARG A 43 37.122 25.043 19.600 1.00 0.00 C ATOM 699 O ARG A 43 36.800 26.207 19.372 1.00 0.00 O ATOM 700 CB ARG A 43 39.559 24.221 19.602 1.00 0.00 C ATOM 701 CG ARG A 43 39.824 24.971 18.298 1.00 0.00 C ATOM 702 CD ARG A 43 41.178 24.548 17.698 1.00 0.00 C ATOM 703 NE ARG A 43 41.240 24.761 16.240 1.00 0.00 N ATOM 704 CZ ARG A 43 42.327 24.745 15.487 1.00 0.00 C ATOM 705 NH1 ARG A 43 43.491 24.528 16.022 1.00 0.00 N ATOM 706 NH2 ARG A 43 42.240 24.932 14.210 1.00 0.00 N ATOM 0 H ARG A 43 38.649 22.876 21.311 1.00 0.00 H new ATOM 0 HA ARG A 43 38.625 25.710 20.868 1.00 0.00 H new ATOM 0 HB2 ARG A 43 40.458 24.265 20.217 1.00 0.00 H new ATOM 0 HB3 ARG A 43 39.384 23.171 19.369 1.00 0.00 H new ATOM 0 HG2 ARG A 43 39.024 24.768 17.586 1.00 0.00 H new ATOM 0 HG3 ARG A 43 39.821 26.045 18.482 1.00 0.00 H new ATOM 0 HD2 ARG A 43 41.977 25.112 18.179 1.00 0.00 H new ATOM 0 HD3 ARG A 43 41.355 23.495 17.916 1.00 0.00 H new ATOM 0 HE ARG A 43 40.355 24.939 15.764 1.00 0.00 H new ATOM 0 HH11 ARG A 43 43.569 24.369 17.027 1.00 0.00 H new ATOM 0 HH12 ARG A 43 44.327 24.517 15.437 1.00 0.00 H new ATOM 0 HH21 ARG A 43 41.330 25.093 13.779 1.00 0.00 H new ATOM 0 HH22 ARG A 43 43.082 24.919 13.634 1.00 0.00 H new ATOM 720 N ARG A 44 36.373 24.015 19.195 1.00 0.00 N ATOM 721 CA ARG A 44 35.131 24.097 18.428 1.00 0.00 C ATOM 722 C ARG A 44 34.008 24.786 19.203 1.00 0.00 C ATOM 723 O ARG A 44 33.323 25.644 18.653 1.00 0.00 O ATOM 724 CB ARG A 44 34.818 22.642 18.059 1.00 0.00 C ATOM 725 CG ARG A 44 33.413 22.339 17.580 1.00 0.00 C ATOM 726 CD ARG A 44 32.935 23.203 16.406 1.00 0.00 C ATOM 727 NE ARG A 44 31.832 22.547 15.692 1.00 0.00 N ATOM 728 CZ ARG A 44 30.652 22.193 16.161 1.00 0.00 C ATOM 729 NH1 ARG A 44 30.346 22.418 17.402 1.00 0.00 N ATOM 730 NH2 ARG A 44 29.796 21.605 15.393 1.00 0.00 N ATOM 0 H ARG A 44 36.632 23.051 19.406 1.00 0.00 H new ATOM 0 HA ARG A 44 35.231 24.720 17.539 1.00 0.00 H new ATOM 0 HB2 ARG A 44 35.515 22.333 17.280 1.00 0.00 H new ATOM 0 HB3 ARG A 44 35.019 22.021 18.932 1.00 0.00 H new ATOM 0 HG2 ARG A 44 33.362 21.291 17.286 1.00 0.00 H new ATOM 0 HG3 ARG A 44 32.723 22.470 18.414 1.00 0.00 H new ATOM 0 HD2 ARG A 44 32.609 24.176 16.774 1.00 0.00 H new ATOM 0 HD3 ARG A 44 33.763 23.383 15.720 1.00 0.00 H new ATOM 0 HE ARG A 44 32.000 22.339 14.708 1.00 0.00 H new ATOM 0 HH11 ARG A 44 31.020 22.871 18.019 1.00 0.00 H new ATOM 0 HH12 ARG A 44 29.432 22.142 17.760 1.00 0.00 H new ATOM 0 HH21 ARG A 44 30.032 21.413 14.419 1.00 0.00 H new ATOM 0 HH22 ARG A 44 28.884 21.333 15.760 1.00 0.00 H new ATOM 744 N SER A 45 33.821 24.442 20.476 1.00 0.00 N ATOM 745 CA SER A 45 32.832 25.114 21.329 1.00 0.00 C ATOM 746 C SER A 45 33.253 26.554 21.654 1.00 0.00 C ATOM 747 O SER A 45 32.461 27.467 21.431 1.00 0.00 O ATOM 748 CB SER A 45 32.541 24.279 22.577 1.00 0.00 C ATOM 749 OG SER A 45 33.731 23.976 23.276 1.00 0.00 O ATOM 0 H SER A 45 34.341 23.700 20.944 1.00 0.00 H new ATOM 0 HA SER A 45 31.896 25.195 20.777 1.00 0.00 H new ATOM 0 HB2 SER A 45 31.860 24.823 23.231 1.00 0.00 H new ATOM 0 HB3 SER A 45 32.038 23.355 22.291 1.00 0.00 H new ATOM 0 HG SER A 45 34.187 23.228 22.837 1.00 0.00 H new ATOM 755 N ILE A 46 34.512 26.802 22.043 1.00 0.00 N ATOM 756 CA ILE A 46 35.073 28.163 22.199 1.00 0.00 C ATOM 757 C ILE A 46 34.883 29.022 20.936 1.00 0.00 C ATOM 758 O ILE A 46 34.510 30.185 21.066 1.00 0.00 O ATOM 759 CB ILE A 46 36.557 28.079 22.643 1.00 0.00 C ATOM 760 CG1 ILE A 46 36.681 27.778 24.158 1.00 0.00 C ATOM 761 CG2 ILE A 46 37.419 29.296 22.282 1.00 0.00 C ATOM 762 CD1 ILE A 46 36.398 28.931 25.123 1.00 0.00 C ATOM 0 H ILE A 46 35.179 26.062 22.261 1.00 0.00 H new ATOM 0 HA ILE A 46 34.515 28.673 22.984 1.00 0.00 H new ATOM 0 HB ILE A 46 36.958 27.248 22.062 1.00 0.00 H new ATOM 0 HG12 ILE A 46 36.000 26.961 24.398 1.00 0.00 H new ATOM 0 HG13 ILE A 46 37.691 27.417 24.350 1.00 0.00 H new ATOM 0 HG21 ILE A 46 38.438 29.138 22.636 1.00 0.00 H new ATOM 0 HG22 ILE A 46 37.427 29.428 21.200 1.00 0.00 H new ATOM 0 HG23 ILE A 46 37.005 30.188 22.753 1.00 0.00 H new ATOM 0 HD11 ILE A 46 36.520 28.585 26.149 1.00 0.00 H new ATOM 0 HD12 ILE A 46 37.095 29.747 24.930 1.00 0.00 H new ATOM 0 HD13 ILE A 46 35.377 29.284 24.978 1.00 0.00 H new ATOM 774 N LYS A 47 35.051 28.467 19.724 1.00 0.00 N ATOM 775 CA LYS A 47 34.840 29.181 18.449 1.00 0.00 C ATOM 776 C LYS A 47 33.393 29.667 18.324 1.00 0.00 C ATOM 777 O LYS A 47 33.178 30.853 18.094 1.00 0.00 O ATOM 778 CB LYS A 47 35.272 28.277 17.278 1.00 0.00 C ATOM 779 CG LYS A 47 34.957 28.815 15.870 1.00 0.00 C ATOM 780 CD LYS A 47 35.747 30.064 15.435 1.00 0.00 C ATOM 781 CE LYS A 47 37.231 29.786 15.143 1.00 0.00 C ATOM 782 NZ LYS A 47 37.406 28.913 13.955 1.00 0.00 N1+ ATOM 0 H LYS A 47 35.341 27.497 19.598 1.00 0.00 H new ATOM 0 HA LYS A 47 35.461 30.077 18.423 1.00 0.00 H new ATOM 0 HB2 LYS A 47 36.346 28.108 17.351 1.00 0.00 H new ATOM 0 HB3 LYS A 47 34.788 27.307 17.393 1.00 0.00 H new ATOM 0 HG2 LYS A 47 35.145 28.020 15.148 1.00 0.00 H new ATOM 0 HG3 LYS A 47 33.893 29.046 15.820 1.00 0.00 H new ATOM 0 HD2 LYS A 47 35.283 30.484 14.543 1.00 0.00 H new ATOM 0 HD3 LYS A 47 35.675 30.819 16.218 1.00 0.00 H new ATOM 0 HE2 LYS A 47 37.752 30.729 14.980 1.00 0.00 H new ATOM 0 HE3 LYS A 47 37.690 29.314 16.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 38.411 28.886 13.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 37.081 27.951 14.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 36.848 29.290 13.162 1.00 0.00 H new ATOM 796 N LYS A 48 32.411 28.791 18.570 1.00 0.00 N ATOM 797 CA LYS A 48 30.989 29.159 18.691 1.00 0.00 C ATOM 798 C LYS A 48 30.766 30.258 19.741 1.00 0.00 C ATOM 799 O LYS A 48 30.045 31.221 19.492 1.00 0.00 O ATOM 800 CB LYS A 48 30.173 27.895 19.033 1.00 0.00 C ATOM 801 CG LYS A 48 29.269 27.455 17.871 1.00 0.00 C ATOM 802 CD LYS A 48 28.798 26.003 18.068 1.00 0.00 C ATOM 803 CE LYS A 48 27.967 25.444 16.903 1.00 0.00 C ATOM 804 NZ LYS A 48 27.453 24.073 17.144 1.00 0.00 N1+ ATOM 0 H LYS A 48 32.581 27.793 18.693 1.00 0.00 H new ATOM 0 HA LYS A 48 30.652 29.568 17.738 1.00 0.00 H new ATOM 0 HB2 LYS A 48 30.854 27.083 19.289 1.00 0.00 H new ATOM 0 HB3 LYS A 48 29.561 28.087 19.914 1.00 0.00 H new ATOM 0 HG2 LYS A 48 28.405 28.117 17.805 1.00 0.00 H new ATOM 0 HG3 LYS A 48 29.811 27.542 16.929 1.00 0.00 H new ATOM 0 HD2 LYS A 48 29.671 25.367 18.214 1.00 0.00 H new ATOM 0 HD3 LYS A 48 28.206 25.946 18.981 1.00 0.00 H new ATOM 0 HE2 LYS A 48 27.125 26.111 16.715 1.00 0.00 H new ATOM 0 HE3 LYS A 48 28.578 25.440 16.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 26.469 24.008 16.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 28.038 23.387 16.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 27.491 23.862 18.162 1.00 0.00 H new ATOM 818 N PHE A 49 31.405 30.157 20.908 1.00 0.00 N ATOM 819 CA PHE A 49 31.247 31.138 21.985 1.00 0.00 C ATOM 820 C PHE A 49 31.896 32.512 21.731 1.00 0.00 C ATOM 821 O PHE A 49 31.502 33.468 22.404 1.00 0.00 O ATOM 822 CB PHE A 49 31.688 30.528 23.322 1.00 0.00 C ATOM 823 CG PHE A 49 30.839 29.362 23.796 1.00 0.00 C ATOM 824 CD1 PHE A 49 29.446 29.517 23.905 1.00 0.00 C ATOM 825 CD2 PHE A 49 31.427 28.136 24.158 1.00 0.00 C ATOM 826 CE1 PHE A 49 28.640 28.461 24.362 1.00 0.00 C ATOM 827 CE2 PHE A 49 30.622 27.068 24.591 1.00 0.00 C ATOM 828 CZ PHE A 49 29.231 27.236 24.703 1.00 0.00 C ATOM 0 H PHE A 49 32.045 29.395 21.133 1.00 0.00 H new ATOM 0 HA PHE A 49 30.182 31.367 22.022 1.00 0.00 H new ATOM 0 HB2 PHE A 49 32.722 30.194 23.231 1.00 0.00 H new ATOM 0 HB3 PHE A 49 31.671 31.307 24.085 1.00 0.00 H new ATOM 0 HD1 PHE A 49 28.991 30.458 23.634 1.00 0.00 H new ATOM 0 HD2 PHE A 49 32.499 28.015 24.103 1.00 0.00 H new ATOM 0 HE1 PHE A 49 27.572 28.592 24.450 1.00 0.00 H new ATOM 0 HE2 PHE A 49 31.073 26.118 24.838 1.00 0.00 H new ATOM 0 HZ PHE A 49 28.616 26.420 25.052 1.00 0.00 H new ATOM 838 N LEU A 50 32.806 32.652 20.754 1.00 0.00 N ATOM 839 CA LEU A 50 33.240 33.968 20.253 1.00 0.00 C ATOM 840 C LEU A 50 32.070 34.730 19.616 1.00 0.00 C ATOM 841 O LEU A 50 31.921 35.932 19.847 1.00 0.00 O ATOM 842 CB LEU A 50 34.370 33.838 19.216 1.00 0.00 C ATOM 843 CG LEU A 50 35.690 33.244 19.734 1.00 0.00 C ATOM 844 CD1 LEU A 50 36.693 33.164 18.591 1.00 0.00 C ATOM 845 CD2 LEU A 50 36.339 34.093 20.824 1.00 0.00 C ATOM 0 H LEU A 50 33.259 31.864 20.292 1.00 0.00 H new ATOM 0 HA LEU A 50 33.612 34.522 21.115 1.00 0.00 H new ATOM 0 HB2 LEU A 50 34.013 33.218 18.394 1.00 0.00 H new ATOM 0 HB3 LEU A 50 34.575 34.826 18.805 1.00 0.00 H new ATOM 0 HG LEU A 50 35.442 32.265 20.145 1.00 0.00 H new ATOM 0 HD11 LEU A 50 37.629 32.743 18.957 1.00 0.00 H new ATOM 0 HD12 LEU A 50 36.294 32.528 17.801 1.00 0.00 H new ATOM 0 HD13 LEU A 50 36.875 34.163 18.196 1.00 0.00 H new ATOM 0 HD21 LEU A 50 37.267 33.621 21.148 1.00 0.00 H new ATOM 0 HD22 LEU A 50 36.555 35.086 20.431 1.00 0.00 H new ATOM 0 HD23 LEU A 50 35.659 34.178 21.672 1.00 0.00 H new ATOM 857 N GLU A 51 31.237 34.025 18.842 1.00 0.00 N ATOM 858 CA GLU A 51 30.047 34.577 18.179 1.00 0.00 C ATOM 859 C GLU A 51 28.935 34.895 19.188 1.00 0.00 C ATOM 860 O GLU A 51 28.285 35.935 19.070 1.00 0.00 O ATOM 861 CB GLU A 51 29.510 33.605 17.109 1.00 0.00 C ATOM 862 CG GLU A 51 30.563 33.218 16.059 1.00 0.00 C ATOM 863 CD GLU A 51 30.029 32.284 14.960 1.00 0.00 C ATOM 864 OE1 GLU A 51 28.961 31.642 15.120 1.00 0.00 O ATOM 865 OE2 GLU A 51 30.714 32.144 13.920 1.00 0.00 O ATOM 0 H GLU A 51 31.374 33.032 18.654 1.00 0.00 H new ATOM 0 HA GLU A 51 30.353 35.506 17.697 1.00 0.00 H new ATOM 0 HB2 GLU A 51 29.145 32.702 17.598 1.00 0.00 H new ATOM 0 HB3 GLU A 51 28.657 34.062 16.607 1.00 0.00 H new ATOM 0 HG2 GLU A 51 30.951 34.125 15.595 1.00 0.00 H new ATOM 0 HG3 GLU A 51 31.401 32.733 16.560 1.00 0.00 H new ATOM 872 N LEU A 52 28.767 34.041 20.213 1.00 0.00 N ATOM 873 CA LEU A 52 27.848 34.268 21.343 1.00 0.00 C ATOM 874 C LEU A 52 28.328 35.340 22.340 1.00 0.00 C ATOM 875 O LEU A 52 27.656 35.584 23.338 1.00 0.00 O ATOM 876 CB LEU A 52 27.510 32.955 22.084 1.00 0.00 C ATOM 877 CG LEU A 52 26.950 31.810 21.212 1.00 0.00 C ATOM 878 CD1 LEU A 52 26.238 30.784 22.092 1.00 0.00 C ATOM 879 CD2 LEU A 52 25.920 32.256 20.168 1.00 0.00 C ATOM 0 H LEU A 52 29.274 33.159 20.281 1.00 0.00 H new ATOM 0 HA LEU A 52 26.939 34.659 20.886 1.00 0.00 H new ATOM 0 HB2 LEU A 52 28.413 32.599 22.581 1.00 0.00 H new ATOM 0 HB3 LEU A 52 26.784 33.179 22.865 1.00 0.00 H new ATOM 0 HG LEU A 52 27.821 31.405 20.696 1.00 0.00 H new ATOM 0 HD11 LEU A 52 25.846 29.980 21.469 1.00 0.00 H new ATOM 0 HD12 LEU A 52 26.943 30.373 22.814 1.00 0.00 H new ATOM 0 HD13 LEU A 52 25.416 31.266 22.621 1.00 0.00 H new ATOM 0 HD21 LEU A 52 25.579 31.390 19.600 1.00 0.00 H new ATOM 0 HD22 LEU A 52 25.070 32.718 20.670 1.00 0.00 H new ATOM 0 HD23 LEU A 52 26.377 32.977 19.491 1.00 0.00 H new ATOM 891 N GLN A 53 29.479 35.975 22.095 1.00 0.00 N ATOM 892 CA GLN A 53 30.079 37.030 22.926 1.00 0.00 C ATOM 893 C GLN A 53 30.481 36.608 24.355 1.00 0.00 C ATOM 894 O GLN A 53 30.948 37.455 25.118 1.00 0.00 O ATOM 895 CB GLN A 53 29.178 38.285 22.974 1.00 0.00 C ATOM 896 CG GLN A 53 28.524 38.711 21.651 1.00 0.00 C ATOM 897 CD GLN A 53 27.631 39.924 21.887 1.00 0.00 C ATOM 898 OE1 GLN A 53 26.510 39.818 22.364 1.00 0.00 O ATOM 899 NE2 GLN A 53 28.093 41.125 21.624 1.00 0.00 N ATOM 0 H GLN A 53 30.046 35.759 21.275 1.00 0.00 H new ATOM 0 HA GLN A 53 31.018 37.260 22.422 1.00 0.00 H new ATOM 0 HB2 GLN A 53 28.388 38.110 23.704 1.00 0.00 H new ATOM 0 HB3 GLN A 53 29.774 39.119 23.344 1.00 0.00 H new ATOM 0 HG2 GLN A 53 29.292 38.950 20.915 1.00 0.00 H new ATOM 0 HG3 GLN A 53 27.936 37.889 21.243 1.00 0.00 H new ATOM 0 HE21 GLN A 53 29.025 41.237 21.226 1.00 0.00 H new ATOM 0 HE22 GLN A 53 27.519 41.946 21.818 1.00 0.00 H new ATOM 908 N TYR A 54 30.300 35.340 24.751 1.00 0.00 N ATOM 909 CA TYR A 54 30.558 34.847 26.114 1.00 0.00 C ATOM 910 C TYR A 54 32.052 34.635 26.417 1.00 0.00 C ATOM 911 O TYR A 54 32.479 34.792 27.563 1.00 0.00 O ATOM 912 CB TYR A 54 29.801 33.529 26.336 1.00 0.00 C ATOM 913 CG TYR A 54 28.292 33.580 26.151 1.00 0.00 C ATOM 914 CD1 TYR A 54 27.545 34.692 26.589 1.00 0.00 C ATOM 915 CD2 TYR A 54 27.626 32.480 25.579 1.00 0.00 C ATOM 916 CE1 TYR A 54 26.146 34.708 26.461 1.00 0.00 C ATOM 917 CE2 TYR A 54 26.230 32.508 25.407 1.00 0.00 C ATOM 918 CZ TYR A 54 25.492 33.634 25.826 1.00 0.00 C ATOM 919 OH TYR A 54 24.151 33.679 25.622 1.00 0.00 O ATOM 0 H TYR A 54 29.963 34.612 24.120 1.00 0.00 H new ATOM 0 HA TYR A 54 30.204 35.619 26.797 1.00 0.00 H new ATOM 0 HB2 TYR A 54 30.205 32.783 25.652 1.00 0.00 H new ATOM 0 HB3 TYR A 54 30.010 33.180 27.347 1.00 0.00 H new ATOM 0 HD1 TYR A 54 28.052 35.539 27.027 1.00 0.00 H new ATOM 0 HD2 TYR A 54 28.189 31.611 25.271 1.00 0.00 H new ATOM 0 HE1 TYR A 54 25.575 35.539 26.847 1.00 0.00 H new ATOM 0 HE2 TYR A 54 25.724 31.668 24.955 1.00 0.00 H new ATOM 0 HH TYR A 54 23.861 32.859 25.171 1.00 0.00 H new ATOM 929 N VAL A 55 32.848 34.299 25.398 1.00 0.00 N ATOM 930 CA VAL A 55 34.316 34.181 25.477 1.00 0.00 C ATOM 931 C VAL A 55 34.956 35.096 24.429 1.00 0.00 C ATOM 932 O VAL A 55 34.317 35.418 23.428 1.00 0.00 O ATOM 933 CB VAL A 55 34.818 32.716 25.367 1.00 0.00 C ATOM 934 CG1 VAL A 55 34.340 31.851 26.538 1.00 0.00 C ATOM 935 CG2 VAL A 55 34.431 32.050 24.044 1.00 0.00 C ATOM 0 H VAL A 55 32.484 34.095 24.467 1.00 0.00 H new ATOM 0 HA VAL A 55 34.628 34.507 26.469 1.00 0.00 H new ATOM 0 HB VAL A 55 35.905 32.784 25.403 1.00 0.00 H new ATOM 0 HG11 VAL A 55 34.716 30.835 26.417 1.00 0.00 H new ATOM 0 HG12 VAL A 55 34.713 32.267 27.474 1.00 0.00 H new ATOM 0 HG13 VAL A 55 33.250 31.835 26.557 1.00 0.00 H new ATOM 0 HG21 VAL A 55 34.810 31.028 24.027 1.00 0.00 H new ATOM 0 HG22 VAL A 55 33.345 32.036 23.947 1.00 0.00 H new ATOM 0 HG23 VAL A 55 34.862 32.611 23.215 1.00 0.00 H new ATOM 945 N LYS A 56 36.208 35.507 24.641 1.00 0.00 N ATOM 946 CA LYS A 56 37.034 36.268 23.687 1.00 0.00 C ATOM 947 C LYS A 56 38.522 35.940 23.873 1.00 0.00 C ATOM 948 O LYS A 56 38.875 35.083 24.682 1.00 0.00 O ATOM 949 CB LYS A 56 36.703 37.776 23.779 1.00 0.00 C ATOM 950 CG LYS A 56 35.640 38.236 22.764 1.00 0.00 C ATOM 951 CD LYS A 56 35.534 39.768 22.663 1.00 0.00 C ATOM 952 CE LYS A 56 34.489 40.190 21.631 1.00 0.00 C ATOM 953 NZ LYS A 56 34.369 41.665 21.550 1.00 0.00 N1+ ATOM 0 H LYS A 56 36.698 35.314 25.514 1.00 0.00 H new ATOM 0 HA LYS A 56 36.794 35.966 22.667 1.00 0.00 H new ATOM 0 HB2 LYS A 56 36.353 38.002 24.786 1.00 0.00 H new ATOM 0 HB3 LYS A 56 37.616 38.350 23.622 1.00 0.00 H new ATOM 0 HG2 LYS A 56 35.881 37.828 21.782 1.00 0.00 H new ATOM 0 HG3 LYS A 56 34.671 37.828 23.050 1.00 0.00 H new ATOM 0 HD2 LYS A 56 35.272 40.181 23.637 1.00 0.00 H new ATOM 0 HD3 LYS A 56 36.504 40.184 22.391 1.00 0.00 H new ATOM 0 HE2 LYS A 56 34.761 39.792 20.653 1.00 0.00 H new ATOM 0 HE3 LYS A 56 33.523 39.759 21.893 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 33.651 41.916 20.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 34.086 42.042 22.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 35.285 42.073 21.276 1.00 0.00 H new ATOM 967 N GLU A 57 39.395 36.539 23.066 1.00 0.00 N ATOM 968 CA GLU A 57 40.777 36.076 22.877 1.00 0.00 C ATOM 969 C GLU A 57 41.741 37.194 22.456 1.00 0.00 C ATOM 970 O GLU A 57 41.324 38.224 21.924 1.00 0.00 O ATOM 971 CB GLU A 57 40.787 34.917 21.868 1.00 0.00 C ATOM 972 CG GLU A 57 40.371 35.287 20.431 1.00 0.00 C ATOM 973 CD GLU A 57 40.581 34.144 19.440 1.00 0.00 C ATOM 974 OE1 GLU A 57 41.343 33.206 19.759 1.00 0.00 O ATOM 975 OE2 GLU A 57 39.904 34.161 18.385 1.00 0.00 O ATOM 0 H GLU A 57 39.165 37.368 22.518 1.00 0.00 H new ATOM 0 HA GLU A 57 41.145 35.728 23.842 1.00 0.00 H new ATOM 0 HB2 GLU A 57 41.790 34.491 21.839 1.00 0.00 H new ATOM 0 HB3 GLU A 57 40.120 34.136 22.231 1.00 0.00 H new ATOM 0 HG2 GLU A 57 39.321 35.578 20.425 1.00 0.00 H new ATOM 0 HG3 GLU A 57 40.944 36.155 20.104 1.00 0.00 H new ATOM 982 N GLY A 58 43.033 36.985 22.727 1.00 0.00 N ATOM 983 CA GLY A 58 44.107 37.965 22.519 1.00 0.00 C ATOM 984 C GLY A 58 44.672 38.010 21.093 1.00 0.00 C ATOM 985 O GLY A 58 44.047 38.537 20.173 1.00 0.00 O ATOM 0 H GLY A 58 43.372 36.102 23.109 1.00 0.00 H new ATOM 0 HA2 GLY A 58 43.731 38.955 22.777 1.00 0.00 H new ATOM 0 HA3 GLY A 58 44.920 37.743 23.210 1.00 0.00 H new ATOM 989 N CYS A 59 45.903 37.522 20.913 1.00 0.00 N ATOM 990 CA CYS A 59 46.580 37.514 19.612 1.00 0.00 C ATOM 991 C CYS A 59 45.911 36.592 18.575 1.00 0.00 C ATOM 992 O CYS A 59 45.531 35.462 18.882 1.00 0.00 O ATOM 993 CB CYS A 59 48.049 37.105 19.781 1.00 0.00 C ATOM 994 SG CYS A 59 48.964 38.402 20.660 1.00 0.00 S ATOM 0 H CYS A 59 46.460 37.120 21.667 1.00 0.00 H new ATOM 0 HA CYS A 59 46.507 38.532 19.228 1.00 0.00 H new ATOM 0 HB2 CYS A 59 48.112 36.168 20.334 1.00 0.00 H new ATOM 0 HB3 CYS A 59 48.500 36.930 18.804 1.00 0.00 H new ATOM 0 HG CYS A 59 50.205 38.040 20.797 1.00 0.00 H new ATOM 1000 N LYS A 60 45.890 37.055 17.319 1.00 0.00 N ATOM 1001 CA LYS A 60 45.541 36.270 16.121 1.00 0.00 C ATOM 1002 C LYS A 60 46.459 35.052 15.915 1.00 0.00 C ATOM 1003 O LYS A 60 47.589 35.020 16.403 1.00 0.00 O ATOM 1004 CB LYS A 60 45.493 37.201 14.892 1.00 0.00 C ATOM 1005 CG LYS A 60 46.859 37.811 14.520 1.00 0.00 C ATOM 1006 CD LYS A 60 46.714 38.953 13.499 1.00 0.00 C ATOM 1007 CE LYS A 60 48.065 39.632 13.224 1.00 0.00 C ATOM 1008 NZ LYS A 60 48.937 38.807 12.359 1.00 0.00 N1+ ATOM 0 H LYS A 60 46.124 38.023 17.097 1.00 0.00 H new ATOM 0 HA LYS A 60 44.549 35.844 16.267 1.00 0.00 H new ATOM 0 HB2 LYS A 60 45.111 36.641 14.038 1.00 0.00 H new ATOM 0 HB3 LYS A 60 44.786 38.008 15.086 1.00 0.00 H new ATOM 0 HG2 LYS A 60 47.347 38.187 15.419 1.00 0.00 H new ATOM 0 HG3 LYS A 60 47.504 37.035 14.108 1.00 0.00 H new ATOM 0 HD2 LYS A 60 46.305 38.561 12.568 1.00 0.00 H new ATOM 0 HD3 LYS A 60 46.004 39.690 13.873 1.00 0.00 H new ATOM 0 HE2 LYS A 60 47.895 40.598 12.750 1.00 0.00 H new ATOM 0 HE3 LYS A 60 48.572 39.826 14.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 49.837 39.303 12.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 49.122 37.894 12.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 48.466 38.643 11.447 1.00 0.00 H new ATOM 1022 N GLN A 61 45.952 34.049 15.197 1.00 0.00 N ATOM 1023 CA GLN A 61 46.547 32.715 15.049 1.00 0.00 C ATOM 1024 C GLN A 61 47.978 32.698 14.465 1.00 0.00 C ATOM 1025 O GLN A 61 48.334 33.493 13.597 1.00 0.00 O ATOM 1026 CB GLN A 61 45.575 31.833 14.238 1.00 0.00 C ATOM 1027 CG GLN A 61 46.074 30.390 14.077 1.00 0.00 C ATOM 1028 CD GLN A 61 45.028 29.365 13.645 1.00 0.00 C ATOM 1029 OE1 GLN A 61 43.825 29.599 13.597 1.00 0.00 O ATOM 1030 NE2 GLN A 61 45.465 28.162 13.357 1.00 0.00 N ATOM 0 H GLN A 61 45.078 34.146 14.680 1.00 0.00 H new ATOM 0 HA GLN A 61 46.684 32.308 16.051 1.00 0.00 H new ATOM 0 HB2 GLN A 61 44.603 31.824 14.731 1.00 0.00 H new ATOM 0 HB3 GLN A 61 45.428 32.274 13.252 1.00 0.00 H new ATOM 0 HG2 GLN A 61 46.882 30.385 13.346 1.00 0.00 H new ATOM 0 HG3 GLN A 61 46.501 30.066 15.026 1.00 0.00 H new ATOM 0 HE21 GLN A 61 46.464 27.960 13.395 1.00 0.00 H new ATOM 0 HE22 GLN A 61 44.806 27.429 13.095 1.00 0.00 H new ATOM 1039 N GLY A 62 48.779 31.737 14.939 1.00 0.00 N ATOM 1040 CA GLY A 62 50.153 31.451 14.512 1.00 0.00 C ATOM 1041 C GLY A 62 51.073 31.340 15.726 1.00 0.00 C ATOM 1042 O GLY A 62 51.621 30.275 16.011 1.00 0.00 O ATOM 0 H GLY A 62 48.467 31.101 15.673 1.00 0.00 H new ATOM 0 HA2 GLY A 62 50.178 30.522 13.942 1.00 0.00 H new ATOM 0 HA3 GLY A 62 50.507 32.241 13.850 1.00 0.00 H new ATOM 1046 N ILE A 63 51.168 32.432 16.486 1.00 0.00 N ATOM 1047 CA ILE A 63 51.766 32.467 17.831 1.00 0.00 C ATOM 1048 C ILE A 63 50.779 31.960 18.897 1.00 0.00 C ATOM 1049 O ILE A 63 49.577 31.854 18.649 1.00 0.00 O ATOM 1050 CB ILE A 63 52.298 33.883 18.148 1.00 0.00 C ATOM 1051 CG1 ILE A 63 51.177 34.952 18.170 1.00 0.00 C ATOM 1052 CG2 ILE A 63 53.427 34.230 17.162 1.00 0.00 C ATOM 1053 CD1 ILE A 63 51.669 36.357 18.546 1.00 0.00 C ATOM 0 H ILE A 63 50.824 33.342 16.180 1.00 0.00 H new ATOM 0 HA ILE A 63 52.617 31.786 17.850 1.00 0.00 H new ATOM 0 HB ILE A 63 52.704 33.884 19.159 1.00 0.00 H new ATOM 0 HG12 ILE A 63 50.707 34.993 17.187 1.00 0.00 H new ATOM 0 HG13 ILE A 63 50.408 34.644 18.879 1.00 0.00 H new ATOM 0 HG21 ILE A 63 53.807 35.228 17.380 1.00 0.00 H new ATOM 0 HG22 ILE A 63 54.234 33.504 17.263 1.00 0.00 H new ATOM 0 HG23 ILE A 63 53.041 34.204 16.143 1.00 0.00 H new ATOM 0 HD11 ILE A 63 50.828 37.051 18.540 1.00 0.00 H new ATOM 0 HD12 ILE A 63 52.113 36.333 19.541 1.00 0.00 H new ATOM 0 HD13 ILE A 63 52.416 36.686 17.824 1.00 0.00 H new ATOM 1065 N SER A 64 51.280 31.648 20.098 1.00 0.00 N ATOM 1066 CA SER A 64 50.463 31.099 21.191 1.00 0.00 C ATOM 1067 C SER A 64 49.394 32.090 21.682 1.00 0.00 C ATOM 1068 O SER A 64 49.711 33.128 22.275 1.00 0.00 O ATOM 1069 CB SER A 64 51.353 30.650 22.352 1.00 0.00 C ATOM 1070 OG SER A 64 50.568 29.958 23.303 1.00 0.00 O ATOM 0 H SER A 64 52.263 31.768 20.341 1.00 0.00 H new ATOM 0 HA SER A 64 49.935 30.234 20.791 1.00 0.00 H new ATOM 0 HB2 SER A 64 52.152 30.005 21.985 1.00 0.00 H new ATOM 0 HB3 SER A 64 51.829 31.514 22.816 1.00 0.00 H new ATOM 0 HG SER A 64 51.136 29.668 24.047 1.00 0.00 H new ATOM 1076 N LYS A 65 48.122 31.765 21.426 1.00 0.00 N ATOM 1077 CA LYS A 65 46.935 32.509 21.878 1.00 0.00 C ATOM 1078 C LYS A 65 46.260 31.857 23.088 1.00 0.00 C ATOM 1079 O LYS A 65 46.582 30.735 23.475 1.00 0.00 O ATOM 1080 CB LYS A 65 45.951 32.700 20.711 1.00 0.00 C ATOM 1081 CG LYS A 65 45.327 31.381 20.236 1.00 0.00 C ATOM 1082 CD LYS A 65 44.105 31.628 19.342 1.00 0.00 C ATOM 1083 CE LYS A 65 44.413 32.462 18.096 1.00 0.00 C ATOM 1084 NZ LYS A 65 43.178 32.692 17.317 1.00 0.00 N1+ ATOM 0 H LYS A 65 47.878 30.942 20.875 1.00 0.00 H new ATOM 0 HA LYS A 65 47.268 33.491 22.213 1.00 0.00 H new ATOM 0 HB2 LYS A 65 45.158 33.382 21.019 1.00 0.00 H new ATOM 0 HB3 LYS A 65 46.471 33.172 19.877 1.00 0.00 H new ATOM 0 HG2 LYS A 65 46.070 30.803 19.687 1.00 0.00 H new ATOM 0 HG3 LYS A 65 45.033 30.784 21.100 1.00 0.00 H new ATOM 0 HD2 LYS A 65 43.692 30.668 19.033 1.00 0.00 H new ATOM 0 HD3 LYS A 65 43.335 32.133 19.925 1.00 0.00 H new ATOM 0 HE2 LYS A 65 44.851 33.417 18.388 1.00 0.00 H new ATOM 0 HE3 LYS A 65 45.150 31.949 17.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 43.312 33.509 16.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 42.964 31.848 16.748 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 42.388 32.881 17.966 1.00 0.00 H new ATOM 1098 N THR A 66 45.296 32.568 23.667 1.00 0.00 N ATOM 1099 CA THR A 66 44.623 32.188 24.914 1.00 0.00 C ATOM 1100 C THR A 66 43.269 32.891 25.053 1.00 0.00 C ATOM 1101 O THR A 66 43.071 33.973 24.489 1.00 0.00 O ATOM 1102 CB THR A 66 45.577 32.463 26.080 1.00 0.00 C ATOM 1103 OG1 THR A 66 45.021 32.052 27.295 1.00 0.00 O ATOM 1104 CG2 THR A 66 45.983 33.931 26.242 1.00 0.00 C ATOM 0 H THR A 66 44.951 33.445 23.276 1.00 0.00 H new ATOM 0 HA THR A 66 44.388 31.124 24.911 1.00 0.00 H new ATOM 0 HB THR A 66 46.469 31.890 25.828 1.00 0.00 H new ATOM 0 HG1 THR A 66 45.651 32.238 28.022 1.00 0.00 H new ATOM 0 HG21 THR A 66 46.659 34.030 27.092 1.00 0.00 H new ATOM 0 HG22 THR A 66 46.486 34.271 25.337 1.00 0.00 H new ATOM 0 HG23 THR A 66 45.094 34.538 26.413 1.00 0.00 H new ATOM 1112 N PHE A 67 42.329 32.253 25.756 1.00 0.00 N ATOM 1113 CA PHE A 67 40.892 32.574 25.725 1.00 0.00 C ATOM 1114 C PHE A 67 40.343 32.901 27.119 1.00 0.00 C ATOM 1115 O PHE A 67 40.577 32.160 28.071 1.00 0.00 O ATOM 1116 CB PHE A 67 40.109 31.409 25.088 1.00 0.00 C ATOM 1117 CG PHE A 67 40.582 31.025 23.696 1.00 0.00 C ATOM 1118 CD1 PHE A 67 41.847 30.435 23.507 1.00 0.00 C ATOM 1119 CD2 PHE A 67 39.767 31.292 22.580 1.00 0.00 C ATOM 1120 CE1 PHE A 67 42.313 30.165 22.209 1.00 0.00 C ATOM 1121 CE2 PHE A 67 40.222 30.994 21.283 1.00 0.00 C ATOM 1122 CZ PHE A 67 41.498 30.440 21.097 1.00 0.00 C ATOM 0 H PHE A 67 42.549 31.477 26.381 1.00 0.00 H new ATOM 0 HA PHE A 67 40.763 33.469 25.117 1.00 0.00 H new ATOM 0 HB2 PHE A 67 40.185 30.537 25.738 1.00 0.00 H new ATOM 0 HB3 PHE A 67 39.054 31.679 25.039 1.00 0.00 H new ATOM 0 HD1 PHE A 67 42.460 30.190 24.362 1.00 0.00 H new ATOM 0 HD2 PHE A 67 38.789 31.727 22.720 1.00 0.00 H new ATOM 0 HE1 PHE A 67 43.298 29.746 22.066 1.00 0.00 H new ATOM 0 HE2 PHE A 67 39.589 31.191 20.430 1.00 0.00 H new ATOM 0 HZ PHE A 67 41.854 30.225 20.100 1.00 0.00 H new ATOM 1132 N TYR A 68 39.594 33.996 27.244 1.00 0.00 N ATOM 1133 CA TYR A 68 39.013 34.501 28.496 1.00 0.00 C ATOM 1134 C TYR A 68 37.499 34.706 28.370 1.00 0.00 C ATOM 1135 O TYR A 68 36.946 34.713 27.270 1.00 0.00 O ATOM 1136 CB TYR A 68 39.709 35.806 28.902 1.00 0.00 C ATOM 1137 CG TYR A 68 39.547 36.941 27.911 1.00 0.00 C ATOM 1138 CD1 TYR A 68 38.392 37.752 27.932 1.00 0.00 C ATOM 1139 CD2 TYR A 68 40.566 37.176 26.967 1.00 0.00 C ATOM 1140 CE1 TYR A 68 38.267 38.818 27.018 1.00 0.00 C ATOM 1141 CE2 TYR A 68 40.440 38.229 26.047 1.00 0.00 C ATOM 1142 CZ TYR A 68 39.299 39.053 26.074 1.00 0.00 C ATOM 1143 OH TYR A 68 39.221 40.071 25.181 1.00 0.00 O ATOM 0 H TYR A 68 39.363 34.584 26.443 1.00 0.00 H new ATOM 0 HA TYR A 68 39.174 33.755 29.275 1.00 0.00 H new ATOM 0 HB2 TYR A 68 39.318 36.126 29.868 1.00 0.00 H new ATOM 0 HB3 TYR A 68 40.772 35.608 29.038 1.00 0.00 H new ATOM 0 HD1 TYR A 68 37.606 37.556 28.646 1.00 0.00 H new ATOM 0 HD2 TYR A 68 41.443 36.547 26.951 1.00 0.00 H new ATOM 0 HE1 TYR A 68 37.392 39.451 27.037 1.00 0.00 H new ATOM 0 HE2 TYR A 68 41.218 38.407 25.319 1.00 0.00 H new ATOM 0 HH TYR A 68 40.023 40.074 24.617 1.00 0.00 H new ATOM 1153 N ILE A 69 36.817 34.872 29.504 1.00 0.00 N ATOM 1154 CA ILE A 69 35.358 35.052 29.578 1.00 0.00 C ATOM 1155 C ILE A 69 35.022 36.530 29.762 1.00 0.00 C ATOM 1156 O ILE A 69 35.656 37.229 30.551 1.00 0.00 O ATOM 1157 CB ILE A 69 34.771 34.139 30.677 1.00 0.00 C ATOM 1158 CG1 ILE A 69 34.944 32.645 30.340 1.00 0.00 C ATOM 1159 CG2 ILE A 69 33.272 34.364 30.953 1.00 0.00 C ATOM 1160 CD1 ILE A 69 36.114 31.940 31.041 1.00 0.00 C ATOM 0 H ILE A 69 37.269 34.886 30.418 1.00 0.00 H new ATOM 0 HA ILE A 69 34.890 34.747 28.642 1.00 0.00 H new ATOM 0 HB ILE A 69 35.340 34.414 31.565 1.00 0.00 H new ATOM 0 HG12 ILE A 69 34.022 32.123 30.597 1.00 0.00 H new ATOM 0 HG13 ILE A 69 35.076 32.547 29.263 1.00 0.00 H new ATOM 0 HG21 ILE A 69 32.940 33.683 31.737 1.00 0.00 H new ATOM 0 HG22 ILE A 69 33.112 35.393 31.274 1.00 0.00 H new ATOM 0 HG23 ILE A 69 32.702 34.175 30.043 1.00 0.00 H new ATOM 0 HD11 ILE A 69 36.145 30.895 30.734 1.00 0.00 H new ATOM 0 HD12 ILE A 69 37.050 32.427 30.766 1.00 0.00 H new ATOM 0 HD13 ILE A 69 35.979 31.997 32.121 1.00 0.00 H new ATOM 1172 N THR A 70 34.022 36.999 29.023 1.00 0.00 N ATOM 1173 CA THR A 70 33.518 38.371 29.066 1.00 0.00 C ATOM 1174 C THR A 70 32.474 38.540 30.187 1.00 0.00 C ATOM 1175 O THR A 70 31.880 37.554 30.642 1.00 0.00 O ATOM 1176 CB THR A 70 32.858 38.692 27.714 1.00 0.00 C ATOM 1177 OG1 THR A 70 31.661 37.966 27.587 1.00 0.00 O ATOM 1178 CG2 THR A 70 33.745 38.387 26.504 1.00 0.00 C ATOM 0 H THR A 70 33.521 36.415 28.353 1.00 0.00 H new ATOM 0 HA THR A 70 34.349 39.048 29.263 1.00 0.00 H new ATOM 0 HB THR A 70 32.676 39.767 27.716 1.00 0.00 H new ATOM 0 HG1 THR A 70 31.442 37.860 26.638 1.00 0.00 H new ATOM 0 HG21 THR A 70 33.211 38.639 25.588 1.00 0.00 H new ATOM 0 HG22 THR A 70 34.659 38.977 26.565 1.00 0.00 H new ATOM 0 HG23 THR A 70 33.998 37.327 26.496 1.00 0.00 H new ATOM 1186 N PRO A 71 32.134 39.778 30.600 1.00 0.00 N ATOM 1187 CA PRO A 71 30.980 40.021 31.474 1.00 0.00 C ATOM 1188 C PRO A 71 29.644 39.556 30.864 1.00 0.00 C ATOM 1189 O PRO A 71 28.751 39.149 31.606 1.00 0.00 O ATOM 1190 CB PRO A 71 30.981 41.531 31.734 1.00 0.00 C ATOM 1191 CG PRO A 71 31.672 42.092 30.493 1.00 0.00 C ATOM 1192 CD PRO A 71 32.748 41.045 30.231 1.00 0.00 C ATOM 0 HA PRO A 71 31.070 39.442 32.393 1.00 0.00 H new ATOM 0 HB2 PRO A 71 29.970 41.922 31.845 1.00 0.00 H new ATOM 0 HB3 PRO A 71 31.522 41.783 32.646 1.00 0.00 H new ATOM 0 HG2 PRO A 71 30.985 42.191 29.653 1.00 0.00 H new ATOM 0 HG3 PRO A 71 32.098 43.079 30.674 1.00 0.00 H new ATOM 0 HD2 PRO A 71 33.054 41.046 29.185 1.00 0.00 H new ATOM 0 HD3 PRO A 71 33.641 41.239 30.825 1.00 0.00 H new ATOM 1200 N ASN A 72 29.513 39.536 29.529 1.00 0.00 N ATOM 1201 CA ASN A 72 28.277 39.122 28.856 1.00 0.00 C ATOM 1202 C ASN A 72 27.887 37.668 29.188 1.00 0.00 C ATOM 1203 O ASN A 72 26.703 37.366 29.335 1.00 0.00 O ATOM 1204 CB ASN A 72 28.409 39.280 27.328 1.00 0.00 C ATOM 1205 CG ASN A 72 28.714 40.688 26.852 1.00 0.00 C ATOM 1206 OD1 ASN A 72 28.202 41.675 27.355 1.00 0.00 O ATOM 1207 ND2 ASN A 72 29.551 40.815 25.851 1.00 0.00 N ATOM 0 H ASN A 72 30.260 39.806 28.889 1.00 0.00 H new ATOM 0 HA ASN A 72 27.487 39.775 29.227 1.00 0.00 H new ATOM 0 HB2 ASN A 72 29.198 38.615 26.976 1.00 0.00 H new ATOM 0 HB3 ASN A 72 27.481 38.948 26.862 1.00 0.00 H new ATOM 0 HD21 ASN A 72 29.777 41.742 25.489 1.00 0.00 H new ATOM 0 HD22 ASN A 72 29.976 39.987 25.434 1.00 0.00 H new ATOM 1214 N GLY A 73 28.868 36.764 29.317 1.00 0.00 N ATOM 1215 CA GLY A 73 28.622 35.378 29.738 1.00 0.00 C ATOM 1216 C GLY A 73 28.374 35.246 31.239 1.00 0.00 C ATOM 1217 O GLY A 73 27.534 34.442 31.643 1.00 0.00 O ATOM 0 H GLY A 73 29.850 36.972 29.133 1.00 0.00 H new ATOM 0 HA2 GLY A 73 27.760 34.987 29.197 1.00 0.00 H new ATOM 0 HA3 GLY A 73 29.478 34.763 29.461 1.00 0.00 H new ATOM 1221 N ILE A 74 29.037 36.069 32.064 1.00 0.00 N ATOM 1222 CA ILE A 74 28.869 36.070 33.525 1.00 0.00 C ATOM 1223 C ILE A 74 27.419 36.309 33.918 1.00 0.00 C ATOM 1224 O ILE A 74 26.941 35.617 34.811 1.00 0.00 O ATOM 1225 CB ILE A 74 29.788 37.092 34.223 1.00 0.00 C ATOM 1226 CG1 ILE A 74 31.244 36.619 34.044 1.00 0.00 C ATOM 1227 CG2 ILE A 74 29.449 37.279 35.719 1.00 0.00 C ATOM 1228 CD1 ILE A 74 32.267 37.640 34.530 1.00 0.00 C ATOM 0 H ILE A 74 29.711 36.759 31.733 1.00 0.00 H new ATOM 0 HA ILE A 74 29.163 35.078 33.867 1.00 0.00 H new ATOM 0 HB ILE A 74 29.639 38.069 33.763 1.00 0.00 H new ATOM 0 HG12 ILE A 74 31.386 35.684 34.587 1.00 0.00 H new ATOM 0 HG13 ILE A 74 31.424 36.406 32.990 1.00 0.00 H new ATOM 0 HG21 ILE A 74 30.129 38.010 36.157 1.00 0.00 H new ATOM 0 HG22 ILE A 74 28.423 37.633 35.818 1.00 0.00 H new ATOM 0 HG23 ILE A 74 29.556 36.327 36.238 1.00 0.00 H new ATOM 0 HD11 ILE A 74 33.273 37.248 34.377 1.00 0.00 H new ATOM 0 HD12 ILE A 74 32.150 38.568 33.970 1.00 0.00 H new ATOM 0 HD13 ILE A 74 32.111 37.835 35.591 1.00 0.00 H new ATOM 1240 N GLU A 75 26.697 37.227 33.266 1.00 0.00 N ATOM 1241 CA GLU A 75 25.296 37.511 33.611 1.00 0.00 C ATOM 1242 C GLU A 75 24.420 36.253 33.629 1.00 0.00 C ATOM 1243 O GLU A 75 23.657 36.049 34.572 1.00 0.00 O ATOM 1244 CB GLU A 75 24.679 38.517 32.637 1.00 0.00 C ATOM 1245 CG GLU A 75 25.306 39.912 32.740 1.00 0.00 C ATOM 1246 CD GLU A 75 24.373 41.013 32.212 1.00 0.00 C ATOM 1247 OE1 GLU A 75 23.383 40.711 31.506 1.00 0.00 O ATOM 1248 OE2 GLU A 75 24.632 42.202 32.513 1.00 0.00 O ATOM 0 H GLU A 75 27.059 37.788 32.495 1.00 0.00 H new ATOM 0 HA GLU A 75 25.322 37.928 34.618 1.00 0.00 H new ATOM 0 HB2 GLU A 75 24.795 38.147 31.618 1.00 0.00 H new ATOM 0 HB3 GLU A 75 23.609 38.591 32.829 1.00 0.00 H new ATOM 0 HG2 GLU A 75 25.556 40.119 33.781 1.00 0.00 H new ATOM 0 HG3 GLU A 75 26.240 39.930 32.178 1.00 0.00 H new ATOM 1255 N LYS A 76 24.594 35.354 32.654 1.00 0.00 N ATOM 1256 CA LYS A 76 23.852 34.085 32.593 1.00 0.00 C ATOM 1257 C LYS A 76 24.224 33.114 33.724 1.00 0.00 C ATOM 1258 O LYS A 76 23.485 32.175 33.997 1.00 0.00 O ATOM 1259 CB LYS A 76 24.021 33.452 31.202 1.00 0.00 C ATOM 1260 CG LYS A 76 23.597 34.415 30.071 1.00 0.00 C ATOM 1261 CD LYS A 76 23.080 33.679 28.830 1.00 0.00 C ATOM 1262 CE LYS A 76 21.985 34.487 28.108 1.00 0.00 C ATOM 1263 NZ LYS A 76 22.518 35.531 27.206 1.00 0.00 N1+ ATOM 0 H LYS A 76 25.252 35.483 31.885 1.00 0.00 H new ATOM 0 HA LYS A 76 22.797 34.308 32.750 1.00 0.00 H new ATOM 0 HB2 LYS A 76 25.062 33.162 31.060 1.00 0.00 H new ATOM 0 HB3 LYS A 76 23.426 32.541 31.144 1.00 0.00 H new ATOM 0 HG2 LYS A 76 22.820 35.084 30.441 1.00 0.00 H new ATOM 0 HG3 LYS A 76 24.447 35.037 29.791 1.00 0.00 H new ATOM 0 HD2 LYS A 76 23.907 33.493 28.145 1.00 0.00 H new ATOM 0 HD3 LYS A 76 22.683 32.707 29.122 1.00 0.00 H new ATOM 0 HE2 LYS A 76 21.362 33.804 27.531 1.00 0.00 H new ATOM 0 HE3 LYS A 76 21.341 34.956 28.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 21.732 35.990 26.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 23.033 36.242 27.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 23.164 35.097 26.516 1.00 0.00 H new ATOM 1277 N LEU A 77 25.341 33.349 34.418 1.00 0.00 N ATOM 1278 CA LEU A 77 25.766 32.619 35.617 1.00 0.00 C ATOM 1279 C LEU A 77 25.107 33.166 36.903 1.00 0.00 C ATOM 1280 O LEU A 77 24.924 32.407 37.853 1.00 0.00 O ATOM 1281 CB LEU A 77 27.306 32.620 35.753 1.00 0.00 C ATOM 1282 CG LEU A 77 28.117 32.503 34.446 1.00 0.00 C ATOM 1283 CD1 LEU A 77 29.616 32.581 34.741 1.00 0.00 C ATOM 1284 CD2 LEU A 77 27.838 31.250 33.616 1.00 0.00 C ATOM 0 H LEU A 77 26.000 34.081 34.150 1.00 0.00 H new ATOM 0 HA LEU A 77 25.428 31.590 35.493 1.00 0.00 H new ATOM 0 HB2 LEU A 77 27.603 33.540 36.256 1.00 0.00 H new ATOM 0 HB3 LEU A 77 27.591 31.794 36.405 1.00 0.00 H new ATOM 0 HG LEU A 77 27.786 33.347 33.841 1.00 0.00 H new ATOM 0 HD11 LEU A 77 30.175 32.497 33.809 1.00 0.00 H new ATOM 0 HD12 LEU A 77 29.844 33.535 35.216 1.00 0.00 H new ATOM 0 HD13 LEU A 77 29.898 31.767 35.408 1.00 0.00 H new ATOM 0 HD21 LEU A 77 28.457 31.262 32.719 1.00 0.00 H new ATOM 0 HD22 LEU A 77 28.071 30.364 34.206 1.00 0.00 H new ATOM 0 HD23 LEU A 77 26.786 31.229 33.331 1.00 0.00 H new ATOM 1296 N LYS A 78 24.716 34.453 36.953 1.00 0.00 N ATOM 1297 CA LYS A 78 23.990 35.065 38.089 1.00 0.00 C ATOM 1298 C LYS A 78 22.580 34.471 38.249 1.00 0.00 C ATOM 1299 O LYS A 78 22.108 34.355 39.377 1.00 0.00 O ATOM 1300 CB LYS A 78 23.896 36.601 37.937 1.00 0.00 C ATOM 1301 CG LYS A 78 25.207 37.386 37.728 1.00 0.00 C ATOM 1302 CD LYS A 78 26.236 37.372 38.849 1.00 0.00 C ATOM 1303 CE LYS A 78 27.477 38.232 38.594 1.00 0.00 C ATOM 1304 NZ LYS A 78 28.449 38.154 39.715 1.00 0.00 N1+ ATOM 0 H LYS A 78 24.897 35.110 36.194 1.00 0.00 H new ATOM 0 HA LYS A 78 24.564 34.836 38.987 1.00 0.00 H new ATOM 0 HB2 LYS A 78 23.240 36.814 37.093 1.00 0.00 H new ATOM 0 HB3 LYS A 78 23.408 36.996 38.828 1.00 0.00 H new ATOM 0 HG2 LYS A 78 25.688 37.000 36.829 1.00 0.00 H new ATOM 0 HG3 LYS A 78 24.945 38.425 37.528 1.00 0.00 H new ATOM 0 HD2 LYS A 78 25.757 37.714 39.767 1.00 0.00 H new ATOM 0 HD3 LYS A 78 26.553 36.343 39.019 1.00 0.00 H new ATOM 0 HE2 LYS A 78 27.960 37.907 37.672 1.00 0.00 H new ATOM 0 HE3 LYS A 78 27.175 39.269 38.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 29.274 38.751 39.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 27.997 38.488 40.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 28.757 37.169 39.839 1.00 0.00 H new ATOM 1318 N SER A 79 21.952 34.012 37.161 1.00 0.00 N ATOM 1319 CA SER A 79 20.709 33.215 37.177 1.00 0.00 C ATOM 1320 C SER A 79 20.833 31.873 37.915 1.00 0.00 C ATOM 1321 O SER A 79 19.831 31.312 38.359 1.00 0.00 O ATOM 1322 CB SER A 79 20.297 32.892 35.736 1.00 0.00 C ATOM 1323 OG SER A 79 19.977 34.068 35.026 1.00 0.00 O ATOM 0 H SER A 79 22.299 34.186 36.218 1.00 0.00 H new ATOM 0 HA SER A 79 19.976 33.825 37.704 1.00 0.00 H new ATOM 0 HB2 SER A 79 21.108 32.367 35.231 1.00 0.00 H new ATOM 0 HB3 SER A 79 19.438 32.221 35.741 1.00 0.00 H new ATOM 0 HG SER A 79 19.719 33.837 34.109 1.00 0.00 H new ATOM 1329 N ILE A 80 22.054 31.338 38.014 1.00 0.00 N ATOM 1330 CA ILE A 80 22.357 30.025 38.606 1.00 0.00 C ATOM 1331 C ILE A 80 22.612 30.144 40.124 1.00 0.00 C ATOM 1332 O ILE A 80 22.431 29.179 40.865 1.00 0.00 O ATOM 1333 CB ILE A 80 23.559 29.370 37.863 1.00 0.00 C ATOM 1334 CG1 ILE A 80 23.495 29.598 36.326 1.00 0.00 C ATOM 1335 CG2 ILE A 80 23.634 27.866 38.197 1.00 0.00 C ATOM 1336 CD1 ILE A 80 24.590 28.907 35.496 1.00 0.00 C ATOM 0 H ILE A 80 22.887 31.819 37.675 1.00 0.00 H new ATOM 0 HA ILE A 80 21.491 29.375 38.483 1.00 0.00 H new ATOM 0 HB ILE A 80 24.469 29.856 38.214 1.00 0.00 H new ATOM 0 HG12 ILE A 80 22.524 29.255 35.968 1.00 0.00 H new ATOM 0 HG13 ILE A 80 23.544 30.670 36.135 1.00 0.00 H new ATOM 0 HG21 ILE A 80 24.478 27.418 37.672 1.00 0.00 H new ATOM 0 HG22 ILE A 80 23.766 27.738 39.271 1.00 0.00 H new ATOM 0 HG23 ILE A 80 22.711 27.377 37.884 1.00 0.00 H new ATOM 0 HD11 ILE A 80 24.445 29.136 34.440 1.00 0.00 H new ATOM 0 HD12 ILE A 80 25.569 29.266 35.814 1.00 0.00 H new ATOM 0 HD13 ILE A 80 24.533 27.829 35.644 1.00 0.00 H new ATOM 1348 N MET A 81 23.034 31.329 40.586 1.00 0.00 N ATOM 1349 CA MET A 81 23.415 31.631 41.974 1.00 0.00 C ATOM 1350 C MET A 81 22.214 31.983 42.850 1.00 0.00 C ATOM 1351 O MET A 81 21.869 31.183 43.748 1.00 0.00 O ATOM 1352 CB MET A 81 24.484 32.737 41.955 1.00 0.00 C ATOM 1353 CG MET A 81 25.144 32.935 43.323 1.00 0.00 C ATOM 1354 SD MET A 81 26.481 34.164 43.318 1.00 0.00 S ATOM 1355 CE MET A 81 25.498 35.687 43.297 1.00 0.00 C ATOM 1356 OXT MET A 81 21.601 33.059 42.673 1.00 0.00 O ATOM 0 H MET A 81 23.123 32.141 39.975 1.00 0.00 H new ATOM 0 HA MET A 81 23.836 30.737 42.434 1.00 0.00 H new ATOM 0 HB2 MET A 81 25.248 32.487 41.219 1.00 0.00 H new ATOM 0 HB3 MET A 81 24.028 33.674 41.636 1.00 0.00 H new ATOM 0 HG2 MET A 81 24.384 33.241 44.042 1.00 0.00 H new ATOM 0 HG3 MET A 81 25.542 31.980 43.666 1.00 0.00 H new ATOM 0 HE1 MET A 81 26.164 36.550 43.310 1.00 0.00 H new ATOM 0 HE2 MET A 81 24.887 35.713 42.395 1.00 0.00 H new ATOM 0 HE3 MET A 81 24.851 35.715 44.174 1.00 0.00 H new TER 1366 MET A 81