data_nef_c18121_2lt4 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 15977 BMRB 18151 PDB 2LT4 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 ALA start . . 2 A 2 GLY middle . false 3 A 3 HIS middle . . 4 A 4 MET middle . . 5 A 5 GLN middle . . 6 A 6 THR middle . . 7 A 7 SER middle . . 8 A 8 PHE middle . . 9 A 9 LYS middle . . 10 A 10 THR middle . . 11 A 11 GLY middle . false 12 A 12 ASP middle . . 13 A 13 LYS middle . . 14 A 14 ALA middle . . 15 A 15 VAL middle . . 16 A 16 TYR middle . . 17 A 17 PRO middle . false 18 A 18 GLY middle . false 19 A 19 GLN middle . . 20 A 20 GLY middle . false 21 A 21 VAL middle . . 22 A 22 GLY middle . false 23 A 23 GLU middle . . 24 A 24 VAL middle . . 25 A 25 MET middle . . 26 A 26 GLY middle . false 27 A 27 ILE middle . . 28 A 28 GLU middle . . 29 A 29 HIS middle . . 30 A 30 THR middle . . 31 A 31 GLU middle . . 32 A 32 VAL middle . . 33 A 33 ALA middle . . 34 A 34 GLY middle . false 35 A 35 GLN middle . . 36 A 36 ARG middle . . 37 A 37 GLN middle . . 38 A 38 SER middle . . 39 A 39 PHE middle . . 40 A 40 TYR middle . . 41 A 41 VAL middle . . 42 A 42 LEU middle . . 43 A 43 ARG middle . . 44 A 44 ILE middle . . 45 A 45 LEU middle . . 46 A 46 GLU middle . . 47 A 47 ASN middle . . 48 A 48 GLY middle . false 49 A 49 MET middle . . 50 A 50 ARG middle . . 51 A 51 ILE middle . . 52 A 52 MET middle . . 53 A 53 ILE middle . . 54 A 54 PRO middle . false 55 A 55 ILE middle . . 56 A 56 ASN middle . . 57 A 57 LYS middle . . 58 A 58 VAL middle . . 59 A 59 GLY middle . false 60 A 60 SER middle . . 61 A 61 VAL middle . . 62 A 62 GLY middle . false 63 A 63 LEU middle . . 64 A 64 ARG middle . . 65 A 65 GLU middle . . 66 A 66 ILE middle . . 67 A 67 ILE middle . . 68 A 68 SER middle . . 69 A 69 GLU middle . . 70 A 70 GLU middle . . 71 A 71 ASP end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 ALA HA H 1 4.067 0.01 A 1 ALA HB% H 1 1.507 0.01 A 1 ALA CA C 13 51.840 0.1 A 1 ALA CB C 13 19.600 0.1 A 3 HIS HA H 1 4.648 0.01 A 3 HIS HBx H 1 3.086 0.01 A 3 HIS HBy H 1 3.123 0.01 A 3 HIS HD2 H 1 7.002 0.01 A 3 HIS HE1 H 1 7.786 0.01 A 3 HIS C C 13 175.379 0.1 A 3 HIS CA C 13 56.307 0.1 A 3 HIS CB C 13 30.978 0.1 A 4 MET H H 1 8.393 0.01 A 4 MET HA H 1 4.464 0.01 A 4 MET HBx H 1 1.986 0.01 A 4 MET HBy H 1 2.059 0.01 A 4 MET HE% H 1 2.083 0.01 A 4 MET HGx H 1 2.447 0.01 A 4 MET HGy H 1 2.519 0.01 A 4 MET C C 13 175.816 0.1 A 4 MET CA C 13 55.377 0.1 A 4 MET CB C 13 32.961 0.1 A 4 MET CE C 13 16.942 0.1 A 4 MET CG C 13 31.856 0.1 A 4 MET N N 15 121.987 0.1 A 5 GLN H H 1 8.518 0.01 A 5 GLN HA H 1 4.390 0.01 A 5 GLN HBx H 1 1.997 0.01 A 5 GLN HBy H 1 2.083 0.01 A 5 GLN HE2x H 1 6.875 0.01 A 5 GLN HE2y H 1 7.498 0.01 A 5 GLN HGx H 1 2.310 0.01 A 5 GLN HGy H 1 2.310 0.01 A 5 GLN C C 13 175.809 0.1 A 5 GLN CA C 13 55.852 0.1 A 5 GLN CB C 13 29.508 0.1 A 5 GLN CD C 13 180.399 0.1 A 5 GLN CG C 13 33.611 0.1 A 5 GLN N N 15 122.534 0.1 A 5 GLN NE2 N 15 112.270 0.1 A 6 THR H H 1 8.213 0.01 A 6 THR HA H 1 4.307 0.01 A 6 THR HB H 1 4.174 0.01 A 6 THR HG2% H 1 1.033 0.01 A 6 THR C C 13 173.984 0.1 A 6 THR CA C 13 61.740 0.1 A 6 THR CB C 13 69.765 0.1 A 6 THR CG2 C 13 21.615 0.1 A 6 THR N N 15 115.975 0.1 A 7 SER H H 1 8.079 0.01 A 7 SER HA H 1 4.469 0.01 A 7 SER HBx H 1 3.764 0.01 A 7 SER HBy H 1 3.764 0.01 A 7 SER C C 13 172.919 0.1 A 7 SER CA C 13 57.955 0.1 A 7 SER CB C 13 64.096 0.1 A 7 SER N N 15 118.179 0.1 A 8 PHE H H 1 7.617 0.01 A 8 PHE HA H 1 4.759 0.01 A 8 PHE HBx H 1 2.173 0.01 A 8 PHE HBy H 1 2.846 0.01 A 8 PHE HDx H 1 6.888 0.01 A 8 PHE HDy H 1 6.888 0.01 A 8 PHE HEx H 1 7.028 0.01 A 8 PHE HEy H 1 7.028 0.01 A 8 PHE C C 13 174.477 0.1 A 8 PHE CA C 13 57.398 0.1 A 8 PHE CB C 13 41.922 0.1 A 8 PHE N N 15 119.651 0.1 A 9 LYS H H 1 9.090 0.01 A 9 LYS HA H 1 4.714 0.01 A 9 LYS HBx H 1 1.823 0.01 A 9 LYS HBy H 1 1.865 0.01 A 9 LYS HDx H 1 1.716 0.01 A 9 LYS HDy H 1 1.716 0.01 A 9 LYS HEx H 1 3.071 0.01 A 9 LYS HEy H 1 3.071 0.01 A 9 LYS HGx H 1 1.370 0.01 A 9 LYS HGy H 1 1.573 0.01 A 9 LYS C C 13 175.717 0.1 A 9 LYS CA C 13 54.071 0.1 A 9 LYS CB C 13 35.234 0.1 A 9 LYS CD C 13 28.913 0.1 A 9 LYS CE C 13 41.960 0.1 A 9 LYS CG C 13 23.608 0.1 A 9 LYS N N 15 121.327 0.1 A 10 THR H H 1 8.353 0.01 A 10 THR HA H 1 3.658 0.01 A 10 THR HB H 1 3.996 0.01 A 10 THR HG2% H 1 1.222 0.01 A 10 THR CA C 13 65.409 0.1 A 10 THR CB C 13 68.545 0.1 A 10 THR CG2 C 13 22.103 0.1 A 10 THR N N 15 116.728 0.1 A 11 GLY H H 1 9.398 0.01 A 11 GLY HAx H 1 3.878 0.01 A 11 GLY HAy H 1 4.507 0.01 A 11 GLY C C 13 174.855 0.1 A 11 GLY CA C 13 44.771 0.1 A 11 GLY N N 15 117.215 0.1 A 12 ASP H H 1 8.252 0.01 A 12 ASP HA H 1 4.687 0.01 A 12 ASP HBx H 1 2.851 0.01 A 12 ASP HBy H 1 2.962 0.01 A 12 ASP C C 13 175.345 0.1 A 12 ASP CA C 13 55.283 0.1 A 12 ASP CB C 13 41.723 0.1 A 12 ASP N N 15 122.005 0.1 A 13 LYS H H 1 8.509 0.01 A 13 LYS HA H 1 5.435 0.01 A 13 LYS HBx H 1 1.651 0.01 A 13 LYS HBy H 1 1.802 0.01 A 13 LYS HDx H 1 1.630 0.01 A 13 LYS HDy H 1 1.630 0.01 A 13 LYS HEx H 1 2.952 0.01 A 13 LYS HEy H 1 2.991 0.01 A 13 LYS HGx H 1 1.394 0.01 A 13 LYS HGy H 1 1.630 0.01 A 13 LYS C C 13 175.681 0.1 A 13 LYS CA C 13 54.568 0.1 A 13 LYS CB C 13 34.903 0.1 A 13 LYS CD C 13 28.919 0.1 A 13 LYS CE C 13 42.041 0.1 A 13 LYS CG C 13 25.854 0.1 A 13 LYS N N 15 118.600 0.1 A 14 ALA H H 1 8.748 0.01 A 14 ALA HA H 1 4.784 0.01 A 14 ALA HB% H 1 0.820 0.01 A 14 ALA C C 13 175.135 0.1 A 14 ALA CA C 13 50.927 0.1 A 14 ALA CB C 13 23.331 0.1 A 14 ALA N N 15 122.074 0.1 A 15 VAL H H 1 8.972 0.01 A 15 VAL HA H 1 4.239 0.01 A 15 VAL HB H 1 1.862 0.01 A 15 VAL HGx% H 1 0.766 0.01 A 15 VAL HGy% H 1 0.902 0.01 A 15 VAL C C 13 174.714 0.1 A 15 VAL CA C 13 61.670 0.1 A 15 VAL CB C 13 33.602 0.1 A 15 VAL CGx C 13 20.807 0.1 A 15 VAL CGy C 13 21.920 0.1 A 15 VAL N N 15 119.565 0.1 A 16 TYR H H 1 8.564 0.01 A 16 TYR HA H 1 4.918 0.01 A 16 TYR HBx H 1 2.398 0.01 A 16 TYR HBy H 1 3.060 0.01 A 16 TYR HDx H 1 6.775 0.01 A 16 TYR HDy H 1 6.775 0.01 A 16 TYR HEx H 1 6.773 0.01 A 16 TYR HEy H 1 6.773 0.01 A 16 TYR CA C 13 53.934 0.1 A 16 TYR CB C 13 39.930 0.1 A 16 TYR CDx C 13 132.404 0.1 A 16 TYR CEx C 13 118.446 0.1 A 16 TYR N N 15 130.232 0.1 A 17 PRO HA H 1 4.180 0.01 A 17 PRO HBx H 1 1.863 0.01 A 17 PRO HBy H 1 2.223 0.01 A 17 PRO HDx H 1 2.824 0.01 A 17 PRO HDy H 1 3.791 0.01 A 17 PRO HGx H 1 1.845 0.01 A 17 PRO HGy H 1 2.033 0.01 A 17 PRO CA C 13 64.600 0.1 A 17 PRO CB C 13 31.756 0.1 A 17 PRO CD C 13 51.378 0.1 A 17 PRO CG C 13 27.772 0.1 A 18 GLY H H 1 7.963 0.01 A 18 GLY HAx H 1 3.685 0.01 A 18 GLY HAy H 1 4.339 0.01 A 18 GLY C C 13 174.377 0.1 A 18 GLY CA C 13 45.399 0.1 A 18 GLY N N 15 109.092 0.1 A 19 GLN H H 1 8.241 0.01 A 19 GLN HA H 1 4.417 0.01 A 19 GLN HBx H 1 1.948 0.01 A 19 GLN HBy H 1 2.036 0.01 A 19 GLN HE2x H 1 6.584 0.01 A 19 GLN HE2y H 1 7.333 0.01 A 19 GLN HGx H 1 2.260 0.01 A 19 GLN HGy H 1 2.260 0.01 A 19 GLN C C 13 175.578 0.1 A 19 GLN CA C 13 55.438 0.1 A 19 GLN N N 15 116.878 0.1 A 19 GLN NE2 N 15 110.378 0.1 A 20 GLY H H 1 8.227 0.01 A 20 GLY HAx H 1 3.808 0.01 A 20 GLY HAy H 1 4.564 0.01 A 20 GLY C C 13 172.782 0.1 A 20 GLY CA C 13 44.286 0.1 A 20 GLY N N 15 106.722 0.1 A 21 VAL H H 1 8.308 0.01 A 21 VAL HA H 1 4.243 0.01 A 21 VAL HB H 1 2.009 0.01 A 21 VAL HGx% H 1 0.966 0.01 A 21 VAL HGy% H 1 1.046 0.01 A 21 VAL C C 13 176.407 0.1 A 21 VAL CA C 13 63.538 0.1 A 21 VAL CB C 13 32.467 0.1 A 21 VAL CGx C 13 21.702 0.1 A 21 VAL CGy C 13 22.300 0.1 A 21 VAL N N 15 119.734 0.1 A 22 GLY H H 1 9.456 0.01 A 22 GLY HAx H 1 3.278 0.01 A 22 GLY HAy H 1 5.310 0.01 A 22 GLY C C 13 170.290 0.1 A 22 GLY CA C 13 44.679 0.1 A 22 GLY N N 15 115.030 0.1 A 23 GLU H H 1 8.773 0.01 A 23 GLU HA H 1 5.139 0.01 A 23 GLU HBx H 1 1.835 0.01 A 23 GLU HBy H 1 1.935 0.01 A 23 GLU HGx H 1 2.068 0.01 A 23 GLU HGy H 1 2.116 0.01 A 23 GLU CA C 13 53.414 0.1 A 23 GLU CB C 13 33.686 0.1 A 23 GLU CG C 13 36.471 0.1 A 23 GLU N N 15 119.135 0.1 A 24 VAL H H 1 9.240 0.01 A 24 VAL HA H 1 4.100 0.01 A 24 VAL HB H 1 2.319 0.01 A 24 VAL HGx% H 1 0.457 0.01 A 24 VAL HGy% H 1 0.799 0.01 A 24 VAL C C 13 176.553 0.1 A 24 VAL CA C 13 63.381 0.1 A 24 VAL CB C 13 30.750 0.1 A 24 VAL CGx C 13 20.907 0.1 A 24 VAL CGy C 13 21.306 0.1 A 24 VAL N N 15 126.888 0.1 A 25 MET H H 1 9.609 0.01 A 25 MET HA H 1 4.771 0.01 A 25 MET HBx H 1 1.803 0.01 A 25 MET HBy H 1 2.266 0.01 A 25 MET HE% H 1 2.032 0.01 A 25 MET HGx H 1 2.525 0.01 A 25 MET HGy H 1 2.525 0.01 A 25 MET C C 13 176.588 0.1 A 25 MET CA C 13 54.684 0.1 A 25 MET CE C 13 15.757 0.1 A 25 MET CG C 13 31.840 0.1 A 25 MET N N 15 128.536 0.1 A 26 GLY H H 1 7.407 0.01 A 26 GLY HAx H 1 3.989 0.01 A 26 GLY HAy H 1 4.378 0.01 A 26 GLY C C 13 170.481 0.1 A 26 GLY CA C 13 44.370 0.1 A 26 GLY N N 15 105.637 0.1 A 27 ILE H H 1 8.171 0.01 A 27 ILE HA H 1 4.994 0.01 A 27 ILE HB H 1 1.510 0.01 A 27 ILE HD1% H 1 0.863 0.01 A 27 ILE HG1x H 1 0.778 0.01 A 27 ILE HG1y H 1 1.491 0.01 A 27 ILE HG2% H 1 0.441 0.01 A 27 ILE C C 13 175.707 0.1 A 27 ILE CA C 13 59.838 0.1 A 27 ILE CB C 13 40.656 0.1 A 27 ILE CD1 C 13 13.747 0.1 A 27 ILE CG1 C 13 28.667 0.1 A 27 ILE CG2 C 13 17.497 0.1 A 27 ILE N N 15 120.028 0.1 A 28 GLU H H 1 8.915 0.01 A 28 GLU HA H 1 4.533 0.01 A 28 GLU HBx H 1 1.828 0.01 A 28 GLU HBy H 1 1.828 0.01 A 28 GLU HGx H 1 2.048 0.01 A 28 GLU HGy H 1 2.048 0.01 A 28 GLU C C 13 174.365 0.1 A 28 GLU CA C 13 54.143 0.1 A 28 GLU CB C 13 33.545 0.1 A 28 GLU CG C 13 36.118 0.1 A 28 GLU N N 15 127.001 0.1 A 29 HIS H H 1 8.637 0.01 A 29 HIS HA H 1 5.625 0.01 A 29 HIS HBx H 1 2.926 0.01 A 29 HIS HBy H 1 2.926 0.01 A 29 HIS HD2 H 1 6.973 0.01 A 29 HIS HE1 H 1 7.559 0.01 A 29 HIS C C 13 175.808 0.1 A 29 HIS CA C 13 54.686 0.1 A 29 HIS CB C 13 32.923 0.1 A 29 HIS N N 15 121.642 0.1 A 30 THR H H 1 9.105 0.01 A 30 THR HA H 1 4.785 0.01 A 30 THR HB H 1 4.222 0.01 A 30 THR HG2% H 1 1.149 0.01 A 30 THR C C 13 173.084 0.1 A 30 THR CA C 13 60.321 0.1 A 30 THR CB C 13 71.149 0.1 A 30 THR CG2 C 13 20.994 0.1 A 30 THR N N 15 116.444 0.1 A 31 GLU H H 1 8.596 0.01 A 31 GLU HA H 1 4.981 0.01 A 31 GLU HBx H 1 1.876 0.01 A 31 GLU HBy H 1 1.918 0.01 A 31 GLU HGx H 1 1.965 0.01 A 31 GLU HGy H 1 2.044 0.01 A 31 GLU C C 13 175.552 0.1 A 31 GLU CA C 13 55.753 0.1 A 31 GLU CB C 13 31.733 0.1 A 31 GLU CG C 13 36.538 0.1 A 31 GLU N N 15 123.459 0.1 A 32 VAL H H 1 8.629 0.01 A 32 VAL HA H 1 4.208 0.01 A 32 VAL HB H 1 2.017 0.01 A 32 VAL HGx% H 1 0.966 0.01 A 32 VAL HGy% H 1 0.974 0.01 A 32 VAL C C 13 174.206 0.1 A 32 VAL CA C 13 61.837 0.1 A 32 VAL CB C 13 34.410 0.1 A 32 VAL CGx C 13 20.582 0.1 A 32 VAL CGy C 13 21.800 0.1 A 32 VAL N N 15 125.550 0.1 A 33 ALA H H 1 9.263 0.01 A 33 ALA HA H 1 4.077 0.01 A 33 ALA HB% H 1 1.441 0.01 A 33 ALA C C 13 177.477 0.1 A 33 ALA CA C 13 52.866 0.1 A 33 ALA CB C 13 17.147 0.1 A 33 ALA N N 15 131.046 0.1 A 34 GLY H H 1 8.634 0.01 A 34 GLY HAx H 1 3.677 0.01 A 34 GLY HAy H 1 4.151 0.01 A 34 GLY C C 13 173.933 0.1 A 34 GLY CA C 13 45.396 0.1 A 34 GLY N N 15 104.050 0.1 A 35 GLN H H 1 7.922 0.01 A 35 GLN HA H 1 4.657 0.01 A 35 GLN HBx H 1 2.022 0.01 A 35 GLN HBy H 1 2.149 0.01 A 35 GLN HE2x H 1 6.876 0.01 A 35 GLN HE2y H 1 7.568 0.01 A 35 GLN HGx H 1 2.314 0.01 A 35 GLN HGy H 1 2.358 0.01 A 35 GLN C C 13 174.833 0.1 A 35 GLN CA C 13 53.940 0.1 A 35 GLN CB C 13 30.846 0.1 A 35 GLN CD C 13 180.577 0.1 A 35 GLN CG C 13 33.526 0.1 A 35 GLN N N 15 119.599 0.1 A 35 GLN NE2 N 15 112.349 0.1 A 36 ARG H H 1 8.774 0.01 A 36 ARG HA H 1 4.789 0.01 A 36 ARG HBx H 1 1.782 0.01 A 36 ARG HBy H 1 1.782 0.01 A 36 ARG HDx H 1 3.023 0.01 A 36 ARG HDy H 1 3.023 0.01 A 36 ARG HGx H 1 1.532 0.01 A 36 ARG HGy H 1 1.615 0.01 A 36 ARG C C 13 176.000 0.1 A 36 ARG CA C 13 56.455 0.1 A 36 ARG CB C 13 30.873 0.1 A 36 ARG CD C 13 43.224 0.1 A 36 ARG CG C 13 27.590 0.1 A 36 ARG N N 15 126.062 0.1 A 37 GLN H H 1 8.882 0.01 A 37 GLN HA H 1 4.640 0.01 A 37 GLN HBx H 1 1.951 0.01 A 37 GLN HBy H 1 1.951 0.01 A 37 GLN HE2x H 1 6.843 0.01 A 37 GLN HE2y H 1 7.323 0.01 A 37 GLN HGx H 1 2.078 0.01 A 37 GLN HGy H 1 2.197 0.01 A 37 GLN C C 13 174.558 0.1 A 37 GLN CA C 13 54.856 0.1 A 37 GLN CB C 13 32.000 0.1 A 37 GLN CD C 13 180.060 0.1 A 37 GLN CG C 13 33.774 0.1 A 37 GLN N N 15 126.046 0.1 A 37 GLN NE2 N 15 111.562 0.1 A 38 SER H H 1 8.282 0.01 A 38 SER HA H 1 5.511 0.01 A 38 SER HBx H 1 3.355 0.01 A 38 SER HBy H 1 3.600 0.01 A 38 SER C C 13 173.586 0.1 A 38 SER CA C 13 58.045 0.1 A 38 SER CB C 13 64.438 0.1 A 38 SER N N 15 118.183 0.1 A 39 PHE H H 1 9.150 0.01 A 39 PHE HA H 1 5.057 0.01 A 39 PHE HBx H 1 2.487 0.01 A 39 PHE HBy H 1 2.716 0.01 A 39 PHE HDx H 1 6.818 0.01 A 39 PHE HDy H 1 6.818 0.01 A 39 PHE HEx H 1 7.242 0.01 A 39 PHE HEy H 1 7.242 0.01 A 39 PHE HZ H 1 7.197 0.01 A 39 PHE C C 13 175.953 0.1 A 39 PHE CA C 13 56.509 0.1 A 39 PHE CB C 13 43.021 0.1 A 39 PHE N N 15 121.625 0.1 A 40 TYR H H 1 9.266 0.01 A 40 TYR HA H 1 4.952 0.01 A 40 TYR HBx H 1 2.740 0.01 A 40 TYR HBy H 1 2.795 0.01 A 40 TYR HDx H 1 6.912 0.01 A 40 TYR HDy H 1 6.912 0.01 A 40 TYR HEx H 1 7.019 0.01 A 40 TYR HEy H 1 7.019 0.01 A 40 TYR CA C 13 58.598 0.1 A 40 TYR CB C 13 40.424 0.1 A 40 TYR CDx C 13 132.534 0.1 A 40 TYR CEx C 13 119.618 0.1 A 40 TYR N N 15 119.810 0.1 A 41 VAL H H 1 8.480 0.01 A 41 VAL HA H 1 4.500 0.01 A 41 VAL HB H 1 1.859 0.01 A 41 VAL HGx% H 1 0.711 0.01 A 41 VAL HGy% H 1 0.804 0.01 A 41 VAL CA C 13 61.881 0.1 A 41 VAL CB C 13 32.072 0.1 A 41 VAL CGx C 13 21.009 0.1 A 41 VAL CGy C 13 21.061 0.1 A 41 VAL N N 15 117.463 0.1 A 42 LEU H H 1 9.270 0.01 A 42 LEU HA H 1 4.969 0.01 A 42 LEU HBx H 1 1.008 0.01 A 42 LEU HBy H 1 1.745 0.01 A 42 LEU HDx% H 1 0.547 0.01 A 42 LEU HDy% H 1 0.674 0.01 A 42 LEU HG H 1 1.173 0.01 A 42 LEU CA C 13 52.829 0.1 A 42 LEU CB C 13 46.057 0.1 A 42 LEU CDx C 13 24.737 0.1 A 42 LEU CDy C 13 27.068 0.1 A 42 LEU CG C 13 27.953 0.1 A 43 ARG H H 1 9.035 0.01 A 43 ARG HA H 1 5.097 0.01 A 43 ARG HBx H 1 1.467 0.01 A 43 ARG HBy H 1 2.071 0.01 A 43 ARG HDx H 1 3.117 0.01 A 43 ARG HDy H 1 3.320 0.01 A 43 ARG HGx H 1 1.255 0.01 A 43 ARG HGy H 1 1.325 0.01 A 43 ARG CA C 13 53.795 0.1 A 43 ARG CB C 13 32.948 0.1 A 43 ARG CD C 13 43.463 0.1 A 43 ARG CG C 13 27.466 0.1 A 43 ARG N N 15 126.811 0.1 A 44 ILE H H 1 9.343 0.01 A 44 ILE HA H 1 4.219 0.01 A 44 ILE HB H 1 2.597 0.01 A 44 ILE HD1% H 1 0.462 0.01 A 44 ILE HG1x H 1 1.280 0.01 A 44 ILE HG1y H 1 1.535 0.01 A 44 ILE HG2% H 1 1.009 0.01 A 44 ILE C C 13 177.891 0.1 A 44 ILE CA C 13 59.243 0.1 A 44 ILE CB C 13 34.763 0.1 A 44 ILE CD1 C 13 8.761 0.1 A 44 ILE CG1 C 13 26.161 0.1 A 44 ILE CG2 C 13 18.610 0.1 A 44 ILE N N 15 129.931 0.1 A 45 LEU H H 1 8.523 0.01 A 45 LEU HA H 1 3.994 0.01 A 45 LEU HBx H 1 1.570 0.01 A 45 LEU HBy H 1 1.773 0.01 A 45 LEU HDx% H 1 0.919 0.01 A 45 LEU HDy% H 1 0.913 0.01 A 45 LEU HG H 1 1.737 0.01 A 45 LEU CA C 13 58.558 0.1 A 45 LEU CB C 13 40.948 0.1 A 45 LEU CDx C 13 22.987 0.1 A 45 LEU CDy C 13 25.432 0.1 A 45 LEU CG C 13 28.003 0.1 A 45 LEU N N 15 128.466 0.1 A 46 GLU H H 1 8.816 0.01 A 46 GLU HA H 1 4.051 0.01 A 46 GLU HBx H 1 1.901 0.01 A 46 GLU HBy H 1 2.125 0.01 A 46 GLU HGx H 1 2.275 0.01 A 46 GLU HGy H 1 2.275 0.01 A 46 GLU C C 13 176.639 0.1 A 46 GLU CA C 13 59.271 0.1 A 46 GLU CB C 13 30.280 0.1 A 46 GLU CG C 13 35.390 0.1 A 46 GLU N N 15 116.734 0.1 A 47 ASN H H 1 6.675 0.01 A 47 ASN HA H 1 4.923 0.01 A 47 ASN HBx H 1 2.753 0.01 A 47 ASN HBy H 1 3.136 0.01 A 47 ASN HD2x H 1 6.791 0.01 A 47 ASN HD2y H 1 7.456 0.01 A 47 ASN C C 13 176.748 0.1 A 47 ASN CA C 13 51.974 0.1 A 47 ASN CB C 13 39.906 0.1 A 47 ASN N N 15 109.195 0.1 A 47 ASN ND2 N 15 110.326 0.1 A 48 GLY H H 1 8.280 0.01 A 48 GLY HAx H 1 3.699 0.01 A 48 GLY HAy H 1 4.111 0.01 A 48 GLY C C 13 174.202 0.1 A 48 GLY CA C 13 46.205 0.1 A 48 GLY N N 15 110.095 0.1 A 49 MET H H 1 8.130 0.01 A 49 MET HA H 1 4.137 0.01 A 49 MET HBx H 1 1.964 0.01 A 49 MET HBy H 1 1.964 0.01 A 49 MET HE% H 1 1.984 0.01 A 49 MET HGx H 1 2.311 0.01 A 49 MET HGy H 1 2.364 0.01 A 49 MET C C 13 174.714 0.1 A 49 MET CA C 13 56.792 0.1 A 49 MET CB C 13 31.635 0.1 A 49 MET CE C 13 16.864 0.1 A 49 MET CG C 13 31.773 0.1 A 49 MET N N 15 121.539 0.1 A 50 ARG H H 1 8.389 0.01 A 50 ARG HA H 1 5.163 0.01 A 50 ARG HBx H 1 1.467 0.01 A 50 ARG HBy H 1 1.678 0.01 A 50 ARG HDx H 1 3.075 0.01 A 50 ARG HDy H 1 3.075 0.01 A 50 ARG HGx H 1 1.234 0.01 A 50 ARG HGy H 1 1.234 0.01 A 50 ARG CA C 13 54.547 0.1 A 50 ARG CB C 13 32.005 0.1 A 50 ARG CD C 13 43.479 0.1 A 50 ARG CG C 13 28.131 0.1 A 50 ARG N N 15 123.746 0.1 A 51 ILE H H 1 9.152 0.01 A 51 ILE HA H 1 4.307 0.01 A 51 ILE HB H 1 1.481 0.01 A 51 ILE HD1% H 1 0.278 0.01 A 51 ILE HG1y H 1 1.206 0.01 A 51 ILE HG1x H 1 0.800 0.01 A 51 ILE HG2% H 1 0.611 0.01 A 51 ILE CB C 13 40.958 0.1 A 51 ILE CD1 C 13 13.201 0.1 A 51 ILE CG1 C 13 27.227 0.1 A 51 ILE CG2 C 13 17.447 0.1 A 51 ILE N N 15 125.075 0.1 A 52 MET H H 1 8.073 0.01 A 52 MET HA H 1 5.245 0.01 A 52 MET HBx H 1 1.449 0.01 A 52 MET HBy H 1 1.758 0.01 A 52 MET HE% H 1 1.428 0.01 A 52 MET HGx H 1 2.129 0.01 A 52 MET HGy H 1 2.259 0.01 A 52 MET C C 13 175.973 0.1 A 52 MET CA C 13 53.867 0.1 A 52 MET CB C 13 33.219 0.1 A 52 MET CE C 13 16.421 0.1 A 52 MET CG C 13 32.148 0.1 A 52 MET N N 15 118.960 0.1 A 53 ILE H H 1 9.402 0.01 A 53 ILE HA H 1 4.878 0.01 A 53 ILE HB H 1 2.013 0.01 A 53 ILE HD1% H 1 0.802 0.01 A 53 ILE HG1x H 1 1.194 0.01 A 53 ILE HG1y H 1 1.592 0.01 A 53 ILE HG2% H 1 1.070 0.01 A 53 ILE CA C 13 57.975 0.1 A 53 ILE CB C 13 41.758 0.1 A 53 ILE CD1 C 13 15.626 0.1 A 53 ILE CG1 C 13 27.783 0.1 A 53 ILE CG2 C 13 17.636 0.1 A 53 ILE N N 15 125.522 0.1 A 54 PRO HA H 1 4.275 0.01 A 54 PRO HBx H 1 1.848 0.01 A 54 PRO HBy H 1 2.276 0.01 A 54 PRO HDx H 1 3.806 0.01 A 54 PRO HDy H 1 4.220 0.01 A 54 PRO HGx H 1 2.120 0.01 A 54 PRO HGy H 1 2.255 0.01 A 54 PRO C C 13 178.209 0.1 A 54 PRO CA C 13 63.361 0.1 A 54 PRO CB C 13 32.344 0.1 A 54 PRO CD C 13 51.492 0.1 A 54 PRO CG C 13 28.090 0.1 A 55 ILE H H 1 7.829 0.01 A 55 ILE HA H 1 3.893 0.01 A 55 ILE HB H 1 1.535 0.01 A 55 ILE HD1% H 1 0.491 0.01 A 55 ILE HG1x H 1 0.644 0.01 A 55 ILE HG1y H 1 1.226 0.01 A 55 ILE HG2% H 1 0.579 0.01 A 55 ILE CA C 13 64.564 0.1 A 55 ILE CB C 13 37.909 0.1 A 55 ILE CD1 C 13 13.626 0.1 A 55 ILE CG1 C 13 27.486 0.1 A 55 ILE CG2 C 13 16.930 0.1 A 55 ILE N N 15 121.681 0.1 A 56 ASN HA H 1 4.797 0.01 A 56 ASN HBx H 1 2.891 0.01 A 56 ASN HBy H 1 2.981 0.01 A 56 ASN HD2x H 1 6.909 0.01 A 56 ASN HD2y H 1 7.639 0.01 A 56 ASN CA C 13 53.387 0.1 A 56 ASN CB C 13 37.719 0.1 A 56 ASN CG C 13 177.173 0.1 A 56 ASN ND2 N 15 112.148 0.1 A 57 LYS HA H 1 3.938 0.01 A 57 LYS HBx H 1 1.872 0.01 A 57 LYS HBy H 1 1.872 0.01 A 57 LYS HDx H 1 1.705 0.01 A 57 LYS HDy H 1 1.705 0.01 A 57 LYS HEx H 1 3.011 0.01 A 57 LYS HEy H 1 3.011 0.01 A 57 LYS HGx H 1 1.417 0.01 A 57 LYS HGy H 1 1.417 0.01 A 57 LYS C C 13 176.819 0.1 A 57 LYS CA C 13 55.780 0.1 A 57 LYS CB C 13 35.718 0.1 A 57 LYS CD C 13 29.095 0.1 A 57 LYS CE C 13 41.935 0.1 A 57 LYS CG C 13 23.835 0.1 A 58 VAL H H 1 7.625 0.01 A 58 VAL HA H 1 3.882 0.01 A 58 VAL HB H 1 2.210 0.01 A 58 VAL HGx% H 1 1.100 0.01 A 58 VAL HGy% H 1 1.102 0.01 A 58 VAL CA C 13 64.775 0.1 A 58 VAL CB C 13 32.239 0.1 A 58 VAL CGy C 13 21.629 0.1 A 58 VAL CGx C 13 21.349 0.1 A 58 VAL N N 15 120.252 0.1 A 59 GLY H H 1 8.726 0.01 A 59 GLY HAx H 1 4.024 0.01 A 59 GLY HAy H 1 4.024 0.01 A 59 GLY C C 13 175.285 0.1 A 59 GLY CA C 13 45.877 0.1 A 59 GLY N N 15 109.724 0.1 A 60 SER H H 1 8.021 0.01 A 60 SER HA H 1 4.524 0.01 A 60 SER HBx H 1 3.962 0.01 A 60 SER HBy H 1 3.962 0.01 A 60 SER CA C 13 59.355 0.1 A 60 SER CB C 13 63.806 0.1 A 60 SER N N 15 115.858 0.1 A 61 VAL H H 1 7.911 0.01 A 61 VAL HA H 1 4.170 0.01 A 61 VAL HB H 1 2.209 0.01 A 61 VAL HGx% H 1 0.911 0.01 A 61 VAL HGy% H 1 1.008 0.01 A 61 VAL CA C 13 62.825 0.1 A 61 VAL CB C 13 32.241 0.1 A 61 VAL CGy C 13 21.174 0.1 A 61 VAL CGx C 13 20.802 0.1 A 61 VAL N N 15 118.248 0.1 A 62 GLY H H 1 8.700 0.01 A 62 GLY HAx H 1 3.706 0.01 A 62 GLY HAy H 1 4.128 0.01 A 62 GLY CA C 13 45.600 0.1 A 62 GLY N N 15 113.071 0.1 A 63 LEU H H 1 7.755 0.01 A 63 LEU HA H 1 4.496 0.01 A 63 LEU HBx H 1 1.310 0.01 A 63 LEU HBy H 1 1.441 0.01 A 63 LEU HDx% H 1 0.491 0.01 A 63 LEU HDy% H 1 0.542 0.01 A 63 LEU HG H 1 1.398 0.01 A 63 LEU CA C 13 55.397 0.1 A 63 LEU CB C 13 43.030 0.1 A 63 LEU CDx C 13 24.619 0.1 A 63 LEU CDy C 13 25.209 0.1 A 63 LEU CG C 13 26.767 0.1 A 63 LEU N N 15 119.789 0.1 A 64 ARG H H 1 8.334 0.01 A 64 ARG HA H 1 4.849 0.01 A 64 ARG HBx H 1 1.743 0.01 A 64 ARG HBy H 1 1.914 0.01 A 64 ARG HDx H 1 3.209 0.01 A 64 ARG HDy H 1 3.209 0.01 A 64 ARG HGx H 1 1.681 0.01 A 64 ARG HGy H 1 1.681 0.01 A 64 ARG C C 13 175.253 0.1 A 64 ARG CA C 13 54.665 0.1 A 64 ARG CB C 13 33.017 0.1 A 64 ARG CD C 13 43.378 0.1 A 64 ARG CG C 13 26.881 0.1 A 65 GLU H H 1 8.968 0.01 A 65 GLU HA H 1 4.518 0.01 A 65 GLU HBx H 1 2.054 0.01 A 65 GLU HBy H 1 2.110 0.01 A 65 GLU HGx H 1 2.326 0.01 A 65 GLU HGy H 1 2.326 0.01 A 65 GLU C C 13 176.881 0.1 A 65 GLU CA C 13 56.744 0.1 A 65 GLU CB C 13 30.643 0.1 A 65 GLU CG C 13 36.168 0.1 A 65 GLU N N 15 122.611 0.1 A 66 ILE H H 1 8.343 0.01 A 66 ILE HA H 1 4.195 0.01 A 66 ILE HB H 1 1.794 0.01 A 66 ILE HD1% H 1 0.832 0.01 A 66 ILE HG1x H 1 1.146 0.01 A 66 ILE HG1y H 1 1.466 0.01 A 66 ILE HG2% H 1 0.861 0.01 A 66 ILE C C 13 175.806 0.1 A 66 ILE CA C 13 61.020 0.1 A 66 ILE CB C 13 38.821 0.1 A 66 ILE CD1 C 13 13.449 0.1 A 66 ILE CG1 C 13 27.549 0.1 A 66 ILE CG2 C 13 17.489 0.1 A 66 ILE N N 15 121.763 0.1 A 67 ILE H H 1 8.366 0.01 A 67 ILE HA H 1 4.297 0.01 A 67 ILE HB H 1 1.885 0.01 A 67 ILE HD1% H 1 0.857 0.01 A 67 ILE HG1x H 1 1.193 0.01 A 67 ILE HG1y H 1 1.476 0.01 A 67 ILE HG2% H 1 0.918 0.01 A 67 ILE C C 13 176.067 0.1 A 67 ILE CA C 13 60.793 0.1 A 67 ILE CB C 13 38.768 0.1 A 67 ILE CD1 C 13 12.707 0.1 A 67 ILE CG1 C 13 27.141 0.1 A 67 ILE CG2 C 13 17.544 0.1 A 67 ILE N N 15 125.903 0.1 A 68 SER H H 1 8.482 0.01 A 68 SER HA H 1 4.519 0.01 A 68 SER HBx H 1 3.860 0.01 A 68 SER HBy H 1 3.860 0.01 A 68 SER C C 13 174.472 0.1 A 68 SER CA C 13 58.060 0.1 A 68 SER CB C 13 63.973 0.1 A 68 SER N N 15 120.578 0.1 A 69 GLU H H 1 8.613 0.01 A 69 GLU HA H 1 4.348 0.01 A 69 GLU HBx H 1 1.937 0.01 A 69 GLU HBy H 1 2.120 0.01 A 69 GLU HGx H 1 2.276 0.01 A 69 GLU HGy H 1 2.276 0.01 A 69 GLU C C 13 176.227 0.1 A 69 GLU CA C 13 56.708 0.1 A 69 GLU CB C 13 30.589 0.1 A 69 GLU CG C 13 36.259 0.1 A 69 GLU N N 15 123.469 0.1 A 70 GLU H H 1 8.328 0.01 A 70 GLU HA H 1 4.347 0.01 A 70 GLU HBx H 1 1.893 0.01 A 70 GLU HBy H 1 2.105 0.01 A 70 GLU HGx H 1 2.259 0.01 A 70 GLU HGy H 1 2.259 0.01 A 70 GLU C C 13 175.368 0.1 A 70 GLU CA C 13 56.387 0.1 A 70 GLU CB C 13 30.671 0.1 A 70 GLU CG C 13 36.259 0.1 A 70 GLU N N 15 121.351 0.1 A 71 ASP H H 1 7.964 0.01 A 71 ASP HA H 1 4.378 0.01 A 71 ASP HBx H 1 2.564 0.01 A 71 ASP HBy H 1 2.668 0.01 A 71 ASP CA C 13 56.082 0.1 A 71 ASP CB C 13 42.232 0.1 A 71 ASP N N 15 126.978 0.1 stop_ save_ save_assigned_chem_shift_list_2 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_2 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 2 GLY HAx H 1 3.982 0.01 A 2 GLY HAy H 1 3.982 0.01 A 2 GLY CA C 13 45.135 0.1 A 3 HIS H H 1 8.473 0.01 A 3 HIS HA H 1 4.659 0.01 A 3 HIS HBx H 1 3.090 0.01 A 3 HIS HBy H 1 3.130 0.01 A 3 HIS C C 13 175.304 0.1 A 3 HIS CA C 13 56.261 0.1 A 3 HIS CB C 13 30.601 0.1 A 3 HIS N N 15 119.620 0.1 A 4 MET H H 1 8.489 0.01 A 4 MET HA H 1 4.464 0.01 A 4 MET HBx H 1 1.980 0.01 A 4 MET HBy H 1 2.054 0.01 A 4 MET C C 13 175.865 0.1 A 4 MET CA C 13 55.463 0.1 A 4 MET CB C 13 32.801 0.1 A 4 MET N N 15 122.289 0.1 A 5 GLN H H 1 8.604 0.01 A 5 GLN HA H 1 4.374 0.01 A 5 GLN HBx H 1 1.975 0.01 A 5 GLN HBy H 1 2.054 0.01 A 5 GLN HE2x H 1 6.931 0.01 A 5 GLN HE2y H 1 7.549 0.01 A 5 GLN C C 13 175.837 0.1 A 5 GLN CA C 13 55.870 0.1 A 5 GLN CB C 13 29.552 0.1 A 5 GLN CG C 13 33.671 0.1 A 5 GLN N N 15 122.842 0.1 A 5 GLN NE2 N 15 112.507 0.1 A 6 THR H H 1 8.313 0.01 A 6 THR HA H 1 4.285 0.01 A 6 THR HB H 1 4.176 0.01 A 6 THR C C 13 173.972 0.1 A 6 THR CA C 13 61.912 0.1 A 6 THR CB C 13 69.894 0.1 A 6 THR N N 15 116.334 0.1 A 7 SER H H 1 8.132 0.01 A 7 SER HA H 1 4.476 0.01 A 7 SER HBx H 1 3.783 0.01 A 7 SER HBy H 1 3.783 0.01 A 7 SER C C 13 172.823 0.1 A 7 SER CA C 13 57.891 0.1 A 7 SER CB C 13 64.345 0.1 A 7 SER N N 15 118.332 0.1 A 8 PHE H H 1 7.663 0.01 A 8 PHE C C 13 174.345 0.1 A 8 PHE CA C 13 57.553 0.1 A 8 PHE CB C 13 41.984 0.1 A 8 PHE N N 15 119.702 0.1 A 9 LYS H H 1 9.098 0.01 A 9 LYS HA H 1 4.714 0.01 A 9 LYS HBx H 1 1.840 0.01 A 9 LYS HBy H 1 1.840 0.01 A 9 LYS C C 13 175.671 0.1 A 9 LYS CA C 13 54.072 0.1 A 9 LYS CB C 13 35.377 0.1 A 9 LYS N N 15 121.152 0.1 A 10 THR H H 1 8.439 0.01 A 10 THR HA H 1 3.654 0.01 A 10 THR C C 13 175.699 0.1 A 10 THR CA C 13 65.571 0.1 A 10 THR CB C 13 68.656 0.1 A 10 THR N N 15 117.002 0.1 A 11 GLY H H 1 9.458 0.01 A 11 GLY HAx H 1 3.885 0.01 A 11 GLY HAy H 1 4.516 0.01 A 11 GLY C C 13 174.886 0.1 A 11 GLY CA C 13 44.823 0.1 A 11 GLY N N 15 117.451 0.1 A 12 ASP H H 1 8.287 0.01 A 12 ASP C C 13 175.266 0.1 A 12 ASP CA C 13 55.428 0.1 A 12 ASP CB C 13 41.679 0.1 A 12 ASP N N 15 122.138 0.1 A 13 LYS H H 1 8.574 0.01 A 13 LYS HA H 1 5.418 0.01 A 13 LYS C C 13 175.713 0.1 A 13 LYS CA C 13 54.572 0.1 A 13 LYS CB C 13 34.938 0.1 A 13 LYS N N 15 118.579 0.1 A 14 ALA H H 1 8.772 0.01 A 14 ALA HA H 1 4.723 0.01 A 14 ALA HB% H 1 0.800 0.01 A 14 ALA C C 13 175.011 0.1 A 14 ALA CA C 13 50.933 0.1 A 14 ALA CB C 13 23.212 0.1 A 14 ALA N N 15 122.007 0.1 A 15 VAL H H 1 9.009 0.01 A 15 VAL C C 13 174.760 0.1 A 15 VAL CA C 13 61.679 0.1 A 15 VAL N N 15 119.530 0.1 A 16 TYR H H 1 8.574 0.01 A 16 TYR CA C 13 53.998 0.1 A 16 TYR N N 15 130.370 0.1 A 18 GLY H H 1 8.023 0.01 A 18 GLY HAx H 1 3.691 0.01 A 18 GLY C C 13 174.371 0.1 A 18 GLY CA C 13 45.486 0.1 A 18 GLY N N 15 109.494 0.1 A 19 GLN H H 1 8.285 0.01 A 19 GLN HE2x H 1 6.653 0.01 A 19 GLN HE2y H 1 7.407 0.01 A 19 GLN C C 13 175.670 0.1 A 19 GLN CA C 13 55.370 0.1 A 19 GLN CB C 13 30.833 0.1 A 19 GLN N N 15 116.740 0.1 A 19 GLN NE2 N 15 110.735 0.1 A 20 GLY H H 1 8.247 0.01 A 20 GLY C C 13 172.792 0.1 A 20 GLY CA C 13 44.313 0.1 A 20 GLY N N 15 106.913 0.1 A 21 VAL H H 1 8.342 0.01 A 21 VAL HA H 1 4.225 0.01 A 21 VAL C C 13 176.486 0.1 A 21 VAL CA C 13 63.618 0.1 A 21 VAL N N 15 119.593 0.1 A 22 GLY H H 1 9.492 0.01 A 22 GLY C C 13 170.211 0.1 A 22 GLY CA C 13 44.800 0.1 A 22 GLY N N 15 115.093 0.1 A 23 GLU H H 1 8.780 0.01 A 23 GLU HA H 1 5.123 0.01 A 23 GLU C C 13 176.127 0.1 A 23 GLU CA C 13 53.449 0.1 A 23 GLU CB C 13 33.740 0.1 A 23 GLU N N 15 119.014 0.1 A 24 VAL H H 1 9.282 0.01 A 24 VAL C C 13 176.626 0.1 A 24 VAL CA C 13 63.541 0.1 A 24 VAL N N 15 126.960 0.1 A 25 MET H H 1 9.663 0.01 A 25 MET C C 13 176.651 0.1 A 25 MET CA C 13 54.509 0.1 A 25 MET CB C 13 31.244 0.1 A 25 MET N N 15 128.652 0.1 A 26 GLY H H 1 7.428 0.01 A 26 GLY HAx H 1 4.026 0.01 A 26 GLY HAy H 1 4.361 0.01 A 26 GLY C C 13 170.412 0.1 A 26 GLY CA C 13 44.503 0.1 A 26 GLY N N 15 105.798 0.1 A 27 ILE H H 1 8.228 0.01 A 27 ILE HA H 1 4.959 0.01 A 27 ILE C C 13 175.714 0.1 A 27 ILE CA C 13 59.862 0.1 A 27 ILE CB C 13 40.332 0.1 A 27 ILE N N 15 120.026 0.1 A 28 GLU H H 1 8.928 0.01 A 28 GLU C C 13 174.324 0.1 A 28 GLU CA C 13 54.158 0.1 A 28 GLU N N 15 126.984 0.1 A 29 HIS H H 1 8.707 0.01 A 29 HIS C C 13 175.792 0.1 A 29 HIS CA C 13 54.780 0.1 A 29 HIS N N 15 121.396 0.1 A 30 THR H H 1 9.157 0.01 A 30 THR C C 13 174.666 0.1 A 30 THR CA C 13 60.318 0.1 A 30 THR CB C 13 71.583 0.1 A 30 THR N N 15 116.323 0.1 A 31 GLU H H 1 8.681 0.01 A 31 GLU HA H 1 4.941 0.01 A 31 GLU HBx H 1 1.872 0.01 A 31 GLU HBy H 1 1.872 0.01 A 31 GLU C C 13 175.505 0.1 A 31 GLU CA C 13 55.832 0.1 A 31 GLU CB C 13 31.553 0.1 A 31 GLU N N 15 123.476 0.1 A 32 VAL H H 1 8.671 0.01 A 32 VAL C C 13 174.162 0.1 A 32 VAL CA C 13 61.972 0.1 A 32 VAL CB C 13 34.436 0.1 A 32 VAL N N 15 125.703 0.1 A 33 ALA H H 1 9.298 0.01 A 33 ALA C C 13 177.496 0.1 A 33 ALA CA C 13 52.976 0.1 A 33 ALA CB C 13 17.227 0.1 A 33 ALA N N 15 131.327 0.1 A 34 GLY H H 1 8.697 0.01 A 34 GLY HAx H 1 3.678 0.01 A 34 GLY HAy H 1 4.145 0.01 A 34 GLY C C 13 173.891 0.1 A 34 GLY CA C 13 45.462 0.1 A 34 GLY N N 15 104.042 0.1 A 35 GLN H H 1 7.933 0.01 A 35 GLN HE2x H 1 6.938 0.01 A 35 GLN HE2y H 1 7.637 0.01 A 35 GLN C C 13 174.808 0.1 A 35 GLN CA C 13 53.968 0.1 A 35 GLN CB C 13 30.834 0.1 A 35 GLN CG C 13 33.582 0.1 A 35 GLN N N 15 119.624 0.1 A 35 GLN NE2 N 15 112.725 0.1 A 36 ARG H H 1 8.850 0.01 A 36 ARG HE H 1 7.199 0.01 A 36 ARG C C 13 176.051 0.1 A 36 ARG CA C 13 56.596 0.1 A 36 ARG CB C 13 30.892 0.1 A 36 ARG CD C 13 43.323 0.1 A 36 ARG CG C 13 27.521 0.1 A 36 ARG CZ C 13 159.361 0.1 A 36 ARG N N 15 126.285 0.1 A 36 ARG NE N 15 84.206 0.1 A 37 GLN H H 1 8.916 0.01 A 37 GLN HE2x H 1 6.892 0.01 A 37 GLN HE2y H 1 7.390 0.01 A 37 GLN C C 13 174.560 0.1 A 37 GLN CA C 13 54.853 0.1 A 37 GLN N N 15 126.190 0.1 A 37 GLN NE2 N 15 111.988 0.1 A 38 SER H H 1 8.365 0.01 A 38 SER C C 13 173.615 0.1 A 38 SER CA C 13 58.181 0.1 A 38 SER CB C 13 64.783 0.1 A 38 SER N N 15 118.314 0.1 A 39 PHE H H 1 9.164 0.01 A 39 PHE C C 13 175.889 0.1 A 39 PHE CA C 13 56.546 0.1 A 39 PHE N N 15 121.604 0.1 A 40 TYR H H 1 9.290 0.01 A 40 TYR CA C 13 58.589 0.1 A 40 TYR N N 15 119.784 0.1 A 41 VAL H H 1 8.558 0.01 A 41 VAL N N 15 118.085 0.1 A 42 LEU C C 13 174.421 0.1 A 43 ARG H H 1 9.067 0.01 A 43 ARG HA H 1 5.074 0.01 A 43 ARG HE H 1 7.156 0.01 A 43 ARG C C 13 175.843 0.1 A 43 ARG CA C 13 53.885 0.1 A 43 ARG CD C 13 43.470 0.1 A 43 ARG CZ C 13 159.420 0.1 A 43 ARG N N 15 127.315 0.1 A 43 ARG NE N 15 83.222 0.1 A 44 ILE H H 1 9.394 0.01 A 44 ILE C C 13 177.914 0.1 A 44 ILE CA C 13 59.253 0.1 A 44 ILE N N 15 130.159 0.1 A 45 LEU H H 1 8.555 0.01 A 45 LEU C C 13 180.548 0.1 A 45 LEU CA C 13 58.618 0.1 A 45 LEU CB C 13 41.048 0.1 A 45 LEU N N 15 128.400 0.1 A 46 GLU H H 1 8.825 0.01 A 46 GLU C C 13 176.595 0.1 A 46 GLU CA C 13 59.327 0.1 A 46 GLU CB C 13 30.213 0.1 A 46 GLU N N 15 116.766 0.1 A 47 ASN H H 1 6.655 0.01 A 47 ASN HD2x H 1 6.845 0.01 A 47 ASN HD2y H 1 7.503 0.01 A 47 ASN C C 13 176.832 0.1 A 47 ASN CA C 13 52.007 0.1 A 47 ASN CB C 13 40.066 0.1 A 47 ASN N N 15 109.037 0.1 A 47 ASN ND2 N 15 110.530 0.1 A 48 GLY H H 1 8.308 0.01 A 48 GLY C C 13 174.104 0.1 A 48 GLY CA C 13 46.315 0.1 A 48 GLY N N 15 110.391 0.1 A 49 MET H H 1 8.167 0.01 A 49 MET C C 13 174.688 0.1 A 49 MET CA C 13 56.902 0.1 A 49 MET N N 15 121.848 0.1 A 50 ARG H H 1 8.464 0.01 A 50 ARG N N 15 124.143 0.1 A 51 ILE H H 1 9.188 0.01 A 51 ILE C C 13 174.175 0.1 A 51 ILE N N 15 125.286 0.1 A 52 MET H H 1 8.124 0.01 A 52 MET C C 13 176.027 0.1 A 52 MET CA C 13 59.950 0.1 A 52 MET N N 15 119.189 0.1 A 53 ILE H H 1 9.464 0.01 A 53 ILE CA C 13 58.036 0.1 A 53 ILE N N 15 125.960 0.1 A 54 PRO C C 13 178.157 0.1 A 54 PRO CA C 13 63.405 0.1 A 55 ILE H H 1 7.831 0.01 A 55 ILE CA C 13 64.501 0.1 A 55 ILE N N 15 121.825 0.1 A 56 ASN HD2x H 1 6.955 0.01 A 56 ASN HD2y H 1 7.696 0.01 A 56 ASN ND2 N 15 112.526 0.1 A 58 VAL C C 13 176.845 0.1 A 59 GLY H H 1 8.797 0.01 A 59 GLY C C 13 175.296 0.1 A 59 GLY CA C 13 45.962 0.1 A 59 GLY N N 15 110.068 0.1 A 60 SER H H 1 8.058 0.01 A 60 SER CA C 13 59.272 0.1 A 60 SER N N 15 116.013 0.1 A 61 VAL C C 13 176.845 0.1 A 62 GLY H H 1 8.764 0.01 A 62 GLY C C 13 174.250 0.1 A 62 GLY CA C 13 45.422 0.1 A 62 GLY N N 15 113.376 0.1 A 63 LEU H H 1 7.851 0.01 A 63 LEU CA C 13 55.313 0.1 A 63 LEU N N 15 119.685 0.1 A 64 ARG HE H 1 7.322 0.01 A 64 ARG C C 13 175.215 0.1 A 64 ARG CA C 13 54.750 0.1 A 64 ARG CB C 13 33.015 0.1 A 64 ARG CD C 13 43.462 0.1 A 64 ARG CG C 13 26.775 0.1 A 64 ARG CZ C 13 159.490 0.1 A 64 ARG NE N 15 84.624 0.1 A 65 GLU H H 1 8.999 0.01 A 65 GLU HA H 1 4.521 0.01 A 65 GLU HBy H 1 2.069 0.01 A 65 GLU C C 13 176.086 0.1 A 65 GLU CA C 13 56.657 0.1 A 65 GLU CB C 13 30.516 0.1 A 65 GLU N N 15 122.597 0.1 A 66 ILE H H 1 8.453 0.01 A 66 ILE HA H 1 4.155 0.01 A 66 ILE HB H 1 1.786 0.01 A 66 ILE C C 13 175.897 0.1 A 66 ILE CA C 13 61.118 0.1 A 66 ILE CB C 13 38.745 0.1 A 66 ILE N N 15 122.060 0.1 A 67 ILE H H 1 8.468 0.01 A 67 ILE HA H 1 4.289 0.01 A 67 ILE HB H 1 1.876 0.01 A 67 ILE C C 13 176.118 0.1 A 67 ILE CA C 13 60.729 0.1 A 67 ILE CB C 13 38.712 0.1 A 67 ILE N N 15 126.358 0.1 A 68 SER H H 1 8.574 0.01 A 68 SER HA H 1 4.502 0.01 A 68 SER HBx H 1 3.857 0.01 A 68 SER HBy H 1 3.857 0.01 A 68 SER C C 13 174.525 0.1 A 68 SER CA C 13 58.232 0.1 A 68 SER CB C 13 64.031 0.1 A 68 SER N N 15 120.963 0.1 A 69 GLU H H 1 8.694 0.01 A 69 GLU HA H 1 4.338 0.01 A 69 GLU HBx H 1 1.938 0.01 A 69 GLU HBy H 1 2.124 0.01 A 69 GLU C C 13 176.262 0.1 A 69 GLU CA C 13 56.808 0.1 A 69 GLU CB C 13 30.319 0.1 A 69 GLU N N 15 123.560 0.1 A 70 GLU H H 1 8.383 0.01 A 70 GLU HA H 1 4.331 0.01 A 70 GLU HBx H 1 1.896 0.01 A 70 GLU HBy H 1 2.113 0.01 A 70 GLU CA C 13 56.441 0.1 A 70 GLU CB C 13 30.738 0.1 A 70 GLU N N 15 121.410 0.1 A 71 ASP H H 1 8.024 0.01 A 71 ASP HA H 1 4.384 0.01 A 71 ASP HBx H 1 2.578 0.01 A 71 ASP CA C 13 56.168 0.1 A 71 ASP CB C 13 42.197 0.1 A 71 ASP N N 15 127.018 0.1 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 40 TYR H A 52 MET HA 1.0 . 5.50 2 2 A 39 PHE HA A 55 ILE H 1.0 . 2.60 3 3 A 30 THR H A 37 GLN H 1.0 . 4.26 4 4 A 15 VAL H A 64 ARG H 1.0 . 5.50 5 5 A 41 VAL HA A 53 ILE H 1.0 . 4.94 6 6 A 16 TYR HA A 63 LEU HA 1.0 . 2.60 7 7 A 29 HIS HA A 38 SER HA 1.0 . 2.60 8 8 A 13 LYS HA A 23 GLU HA 1.0 . 2.60 9 9 A 24 VAL HA A 42 LEU HA 1.0 . 2.60 10 10 A 52 MET HA A 41 VAL HA 1.0 . 3.55 11 11 A 14 ALA HA A 65 GLU HA 1.0 . 2.60 12 12 A 38 SER HA A 38 SER HBy 1.0 . 3.00 13 13 A 38 SER HA A 38 SER HBx 1.0 . 3.00 14 14 A 38 SER HA A 39 PHE HD% 1.0 . 3.09 15 15 A 13 LYS HA A 13 LYS HGy 1.0 . 2.85 16 16 A 44 ILE HA A 22 GLY HAy 1.0 . 2.80 17 17 A 39 PHE HA A 54 PRO HA 1.0 . 2.85 18 18 A 27 ILE HA A 27 ILE HG2% 1.0 . 2.80 19 19 A 16 TYR HD% A 17 PRO HDx 1.0 . 2.80 20 20 A 16 TYR HD% A 17 PRO HGx 1.0 . 3.02 21 21 A 52 MET HA A 52 MET HBy 1.0 . 2.80 22 22 A 54 PRO HA A 39 PHE HE% 1.0 . 3.39 23 23 A 55 ILE HD1% A 38 SER HBx 1.0 . 2.85 24 24 A 51 ILE HB A 51 ILE HD1% 1.0 . 2.80 25 25 A 24 VAL HA A 24 VAL HGy% 1.0 . 2.80 26 26 A 55 ILE HA A 55 ILE HG2% 1.0 . 2.80 27 27 A 39 PHE HA A 55 ILE HG2% 1.0 . 2.80 28 28 A 40 TYR HD% A 42 LEU HDy% 1.0 . 5.50 29 29 A 24 VAL HGy% A 8 PHE HD% 1.0 . 5.50 30 30 A 40 TYR HD% A 40 TYR HA 1.0 . 3.14 31 31 A 39 PHE HD% A 54 PRO HA 1.0 . 2.85 32 32 A 27 ILE HG2% A 29 HIS HE1 1.0 . 2.80 33 33 A 39 PHE HE% A 37 GLN HBx 1.0 . 2.80 34 33 A 39 PHE HE% A 37 GLN HBy 1.0 . 2.80 35 34 A 39 PHE HE% A 30 THR HG2% 1.0 . 2.80 36 35 A 55 ILE HG2% A 40 TYR HE% 1.0 . 2.80 37 36 A 40 TYR HE% A 27 ILE HD1% 1.0 . 2.80 38 37 A 29 HIS HD2 A 29 HIS HBx 1.0 . 2.85 39 37 A 29 HIS HBy A 29 HIS HD2 1.0 . 2.85 40 38 A 55 ILE HG2% A 40 TYR HD% 1.0 . 2.80 41 39 A 39 PHE HD% A 30 THR HG2% 1.0 . 2.80 42 40 A 16 TYR HE% A 19 GLN HGx 1.0 . 2.80 43 40 A 16 TYR HE% A 19 GLN HGy 1.0 . 2.80 44 41 A 27 ILE HA A 27 ILE HD1% 1.0 . 3.00 45 42 A 27 ILE HA A 27 ILE HG1y 1.0 . 2.80 46 43 A 42 LEU HA A 42 LEU HDy% 1.0 . 3.83 47 44 A 42 LEU HA A 42 LEU HDx% 1.0 . 2.80 48 45 A 47 ASN HA A 47 ASN HBy 1.0 . 2.75 49 46 A 16 TYR HA A 17 PRO HDy 1.0 . 2.80 50 47 A 9 LYS HA A 9 LYS HBy 1.0 . 2.85 51 48 A 9 LYS HA A 9 LYS HBx 1.0 . 2.97 52 49 A 35 GLN HA A 35 GLN HGy 1.0 . 2.85 53 50 A 65 GLU HA A 15 VAL HB 1.0 . 5.50 54 51 A 63 LEU HA A 63 LEU HBx 1.0 . 3.00 55 52 A 51 ILE HA A 49 MET HBx 1.0 . 5.50 56 52 A 49 MET HBy A 51 ILE HA 1.0 . 5.50 57 53 A 44 ILE HA A 44 ILE HD1% 1.0 . 2.80 58 54 A 66 ILE HA A 66 ILE HD1% 1.0 . 5.50 59 55 A 15 VAL HGx% A 17 PRO HA 1.0 . 5.50 60 56 A 24 VAL HA A 42 LEU HDx% 1.0 . 2.80 61 57 A 24 VAL HA A 23 GLU HBy 1.0 . 5.50 62 58 A 67 ILE HG2% A 68 SER HBx 1.0 . 5.50 63 58 A 67 ILE HG2% A 68 SER HBy 1.0 . 5.50 64 59 A 53 ILE HB A 54 PRO HDx 1.0 . 5.50 65 60 A 9 LYS HEy A 9 LYS HGy 1.0 . 3.09 66 60 A 9 LYS HEx A 9 LYS HGy 1.0 . 3.09 67 61 A 36 ARG HDy A 36 ARG HGx 1.0 . 2.80 68 61 A 36 ARG HDx A 36 ARG HGx 1.0 . 2.80 69 62 A 39 PHE HBx A 28 GLU HGx 1.0 . 5.50 70 62 A 28 GLU HGy A 39 PHE HBx 1.0 . 5.50 71 63 A 21 VAL HB A 46 GLU HGx 1.0 . 5.50 72 63 A 21 VAL HB A 46 GLU HGy 1.0 . 5.50 73 64 A 44 ILE HG2% A 46 GLU HBy 1.0 . 5.50 74 65 A 44 ILE HG2% A 49 MET HBx 1.0 . 5.50 75 65 A 49 MET HBy A 44 ILE HG2% 1.0 . 5.50 76 66 A 30 THR HG2% A 37 GLN HBx 1.0 . 5.50 77 66 A 37 GLN HBy A 30 THR HG2% 1.0 . 5.50 78 67 A 15 VAL HB A 66 ILE HG1y 1.0 . 5.50 79 68 A 15 VAL HB A 66 ILE HG2% 1.0 . 5.50 80 69 A 36 ARG HBx A 36 ARG HDx 1.0 . 2.80 81 69 A 36 ARG HBy A 36 ARG HDx 1.0 . 2.80 82 69 A 36 ARG HDy A 36 ARG HBx 1.0 . 2.80 83 69 A 36 ARG HDy A 36 ARG HBy 1.0 . 2.80 84 70 A 36 ARG HGy A 36 ARG HDx 1.0 . 2.80 85 70 A 36 ARG HDy A 36 ARG HGy 1.0 . 2.80 86 71 A 44 ILE HB A 44 ILE HG1x 1.0 . 2.80 87 72 A 42 LEU HDy% A 44 ILE HG1x 1.0 . 5.50 88 73 A 27 ILE HG1y A 9 LYS HDx 1.0 . 5.50 89 73 A 27 ILE HG1y A 9 LYS HDy 1.0 . 5.50 90 74 A 51 ILE HB A 42 LEU HBx 1.0 . 5.50 91 75 A 51 ILE HB A 44 ILE HG2% 1.0 . 5.50 92 76 A 51 ILE HB A 42 LEU HDy% 1.0 . 5.50 93 77 A 15 VAL HB A 66 ILE HG1x 1.0 . 5.50 94 78 A 66 ILE HG1x A 15 VAL HGy% 1.0 . 5.50 95 79 A 9 LYS HGx A 9 LYS HEx 1.0 . 3.09 96 79 A 9 LYS HEy A 9 LYS HGx 1.0 . 3.09 97 80 A 43 ARG HGy A 43 ARG HDy 1.0 . 3.00 98 81 A 43 ARG HGy A 43 ARG HDx 1.0 . 3.00 99 82 A 44 ILE HG1y A 51 ILE HG1y 1.0 . 5.50 100 83 A 44 ILE HB A 44 ILE HG1y 1.0 . 2.80 101 84 A 43 ARG HDy A 43 ARG HGx 1.0 . 3.00 102 85 A 43 ARG HDx A 43 ARG HGx 1.0 . 3.00 103 86 A 44 ILE HG2% A 19 GLN HGx 1.0 . 5.50 104 86 A 19 GLN HGy A 44 ILE HG2% 1.0 . 5.50 105 87 A 15 VAL HB A 66 ILE HD1% 1.0 . 5.50 106 88 A 42 LEU HBx A 24 VAL HGx% 1.0 . 5.50 107 89 A 42 LEU HBx A 53 ILE HD1% 1.0 . 5.50 108 90 A 51 ILE HG2% A 53 ILE HG1y 1.0 . 5.50 109 91 A 42 LEU HG A 51 ILE HG2% 1.0 . 5.50 110 92 A 51 ILE HG2% A 53 ILE HG1x 1.0 . 5.50 111 93 A 42 LEU HBx A 51 ILE HG2% 1.0 . 5.50 112 94 A 53 ILE HD1% A 51 ILE HG2% 1.0 . 5.50 113 95 A 55 ILE HG2% A 38 SER HBx 1.0 . 2.80 114 96 A 24 VAL HGy% A 42 LEU HDy% 1.0 . 5.50 115 97 A 42 LEU HDy% A 44 ILE HD1% 1.0 . 5.50 116 98 A 51 ILE HD1% A 44 ILE HD1% 1.0 . 5.50 117 99 A 51 ILE HD1% A 42 LEU HDy% 1.0 . 5.50 118 100 A 39 PHE HA A 39 PHE HBy 1.0 . 2.80 119 101 A 23 GLU HA A 23 GLU HBx 1.0 . 2.80 120 102 A 13 LYS HA A 13 LYS HGx 1.0 . 2.85 121 103 A 43 ARG HA A 43 ARG HGx 1.0 . 3.74 122 104 A 6 THR HA A 6 THR HB 1.0 . 2.80 123 105 A 12 ASP HA A 12 ASP HBy 1.0 . 3.00 124 106 A 12 ASP HA A 12 ASP HBx 1.0 . 3.00 125 107 A 49 MET HA A 49 MET HGx 1.0 . 3.08 126 108 A 35 GLN HA A 35 GLN HGx 1.0 . 2.85 127 109 A 65 GLU HA A 65 GLU HGx 1.0 . 2.80 128 109 A 65 GLU HA A 65 GLU HGy 1.0 . 2.80 129 110 A 10 THR HA A 24 VAL HB 1.0 . 2.80 130 111 A 5 GLN HA A 5 GLN HGx 1.0 . 2.80 131 111 A 5 GLN HA A 5 GLN HGy 1.0 . 2.80 132 112 A 46 GLU HA A 46 GLU HGx 1.0 . 2.80 133 112 A 46 GLU HGy A 46 GLU HA 1.0 . 2.80 134 113 A 19 GLN HA A 19 GLN HGx 1.0 . 2.96 135 113 A 19 GLN HGy A 19 GLN HA 1.0 . 2.96 136 114 A 70 GLU HA A 70 GLU HGx 1.0 . 2.80 137 114 A 70 GLU HA A 70 GLU HGy 1.0 . 2.80 138 115 A 61 VAL HA A 61 VAL HB 1.0 . 2.85 139 116 A 35 GLN HA A 35 GLN HBy 1.0 . 3.00 140 117 A 35 GLN HA A 35 GLN HBx 1.0 . 3.00 141 118 A 19 GLN HA A 19 GLN HBy 1.0 . 2.80 142 119 A 67 ILE HA A 67 ILE HB 1.0 . 2.80 143 120 A 55 ILE HA A 55 ILE HB 1.0 . 2.80 144 121 A 10 THR HA A 10 THR HG2% 1.0 . 2.80 145 122 A 65 GLU HA A 15 VAL HGy% 1.0 . 2.80 146 123 A 41 VAL HA A 41 VAL HGy% 1.0 . 2.80 147 124 A 24 VAL HGx% A 10 THR HA 1.0 . 2.80 148 125 A 41 VAL HA A 41 VAL HGx% 1.0 . 2.80 149 126 A 55 ILE HG2% A 38 SER HBy 1.0 . 2.80 150 127 A 63 LEU HA A 63 LEU HDx% 1.0 . 2.80 151 128 A 55 ILE HD1% A 38 SER HBy 1.0 . 2.85 152 129 A 24 VAL HGx% A 10 THR HB 1.0 . 5.50 153 130 A 40 TYR HA A 40 TYR HBy 1.0 . 2.85 154 131 A 39 PHE HD% A 54 PRO HDy 1.0 . 3.10 155 132 A 37 GLN HA A 37 GLN HGx 1.0 . 3.14 156 133 A 37 GLN HA A 37 GLN HGy 1.0 . 3.14 157 134 A 63 LEU HA A 63 LEU HBy 1.0 . 2.80 158 135 A 45 LEU HA A 45 LEU HG 1.0 . 2.85 159 136 A 42 LEU HA A 42 LEU HBx 1.0 . 2.80 160 137 A 23 GLU HA A 13 LYS HGx 1.0 . 3.59 161 138 A 40 TYR HD% A 27 ILE HD1% 1.0 . 5.50 162 139 A 67 ILE HA A 67 ILE HD1% 1.0 . 2.80 163 140 A 43 ARG HBx A 43 ARG HDy 1.0 . 3.97 164 141 A 64 ARG HDy A 64 ARG HBx 1.0 . 2.80 165 141 A 64 ARG HBx A 64 ARG HDx 1.0 . 2.80 166 142 A 64 ARG HDy A 64 ARG HBy 1.0 . 2.80 167 142 A 64 ARG HBy A 64 ARG HDx 1.0 . 2.80 168 143 A 31 GLU HA A 31 GLU HBx 1.0 . 3.02 169 144 A 49 MET HA A 49 MET HGy 1.0 . 3.08 170 145 A 28 GLU HA A 28 GLU HGx 1.0 . 2.80 171 145 A 28 GLU HGy A 28 GLU HA 1.0 . 2.80 172 146 A 38 SER HA A 39 PHE H 1.0 . 3.49 173 147 A 47 ASN H A 48 GLY H 1.0 . 3.73 174 148 A 39 PHE HA A 39 PHE HD% 1.0 . 3.92 175 149 A 39 PHE HD% A 39 PHE H 1.0 . 3.73 176 150 A 47 ASN HA A 47 ASN HBx 1.0 . 2.75 177 151 A 48 GLY H A 49 MET H 1.0 . 3.91 178 152 A 29 HIS HD2 A 29 HIS H 1.0 . 4.54 179 153 A 29 HIS H A 29 HIS HBx 1.0 . 3.82 180 153 A 29 HIS HBy A 29 HIS H 1.0 . 3.82 181 154 A 40 TYR H A 39 PHE HA 1.0 . 3.55 182 155 A 16 TYR HE% A 19 GLN H 1.0 . 4.19 183 156 A 16 TYR HD% A 20 GLY H 1.0 . 4.32 184 157 A 13 LYS HA A 14 ALA H 1.0 . 3.25 185 158 A 21 VAL HA A 22 GLY H 1.0 . 3.54 186 159 A 52 MET HA A 53 ILE H 1.0 . 3.53 187 160 A 43 ARG HA A 44 ILE H 1.0 . 3.15 188 161 A 69 GLU HA A 70 GLU H 1.0 . 2.80 189 162 A 70 GLU HBy A 71 ASP H 1.0 . 2.77 190 163 A 16 TYR HA A 17 PRO HDx 1.0 . 2.90 191 164 A 16 TYR HD% A 17 PRO HDy 1.0 . 3.90 192 165 A 34 GLY H A 35 GLN H 1.0 . 3.92 193 166 A 55 ILE H A 54 PRO HA 1.0 . 3.55 194 167 A 52 MET HA A 42 LEU H 1.0 . 5.50 195 168 A 40 TYR H A 40 TYR HBx 1.0 . 3.16 196 169 A 27 ILE HA A 28 GLU H 1.0 . 3.34 197 170 A 51 ILE HB A 51 ILE H 1.0 . 3.43 198 171 A 27 ILE HG2% A 27 ILE H 1.0 . 4.11 199 172 A 30 THR H A 30 THR HG2% 1.0 . 2.88 200 173 A 30 THR HG2% A 31 GLU H 1.0 . 3.53 201 174 A 46 GLU H A 46 GLU HGx 1.0 . 4.77 202 174 A 46 GLU HGy A 46 GLU H 1.0 . 4.77 203 175 A 46 GLU H A 46 GLU HBx 1.0 . 3.54 204 176 A 44 ILE HG2% A 46 GLU H 1.0 . 4.05 205 177 A 46 GLU H A 45 LEU HDx% 1.0 . 5.50 206 178 A 46 GLU H A 45 LEU HDy% 1.0 . 5.50 207 179 A 47 ASN H A 46 GLU H 1.0 . 4.27 208 180 A 44 ILE HG1x A 44 ILE H 1.0 . 4.88 209 181 A 55 ILE HA A 40 TYR HD% 1.0 . 4.10 210 182 A 55 ILE HA A 40 TYR HE% 1.0 . 4.48 211 183 A 40 TYR H A 40 TYR HD% 1.0 . 4.58 212 184 A 40 TYR H A 39 PHE HD% 1.0 . 4.67 213 185 A 39 PHE HE% A 54 PRO HDy 1.0 . 3.69 214 186 A 27 ILE HG2% A 28 GLU H 1.0 . 3.51 215 187 A 51 ILE HD1% A 51 ILE HG2% 1.0 . 3.39 216 188 A 39 PHE HZ A 37 GLN HGy 1.0 . 5.50 217 189 A 39 PHE HZ A 37 GLN HGx 1.0 . 5.50 218 190 A 39 PHE HZ A 37 GLN HBx 1.0 . 3.75 219 190 A 37 GLN HBy A 39 PHE HZ 1.0 . 3.75 220 191 A 15 VAL H A 15 VAL HB 1.0 . 3.31 221 192 A 29 HIS HD2 A 28 GLU HA 1.0 . 4.53 222 193 A 31 GLU H A 30 THR HB 1.0 . 5.50 223 194 A 35 GLN H A 33 ALA HA 1.0 . 5.50 224 195 A 10 THR HB A 10 THR H 1.0 . 2.89 225 196 A 25 MET H A 25 MET HGx 1.0 . 4.35 226 196 A 25 MET H A 25 MET HGy 1.0 . 4.35 227 197 A 69 GLU H A 69 GLU HGx 1.0 . 3.86 228 197 A 69 GLU H A 69 GLU HGy 1.0 . 3.86 229 198 A 70 GLU H A 69 GLU HGx 1.0 . 5.50 230 198 A 70 GLU H A 69 GLU HGy 1.0 . 5.50 231 199 A 71 ASP H A 70 GLU HGx 1.0 . 4.16 232 199 A 70 GLU HGy A 71 ASP H 1.0 . 4.16 233 200 A 28 GLU H A 28 GLU HGx 1.0 . 4.93 234 200 A 28 GLU HGy A 28 GLU H 1.0 . 4.93 235 201 A 41 VAL H A 28 GLU HGx 1.0 . 5.50 236 201 A 28 GLU HGy A 41 VAL H 1.0 . 5.50 237 202 A 31 GLU H A 31 GLU HGy 1.0 . 5.50 238 203 A 37 GLN H A 37 GLN HBx 1.0 . 3.50 239 203 A 37 GLN H A 37 GLN HBy 1.0 . 3.50 240 204 A 19 GLN HBy A 20 GLY H 1.0 . 5.50 241 205 A 67 ILE HB A 68 SER H 1.0 . 5.50 242 206 A 39 PHE HD% A 28 GLU HBx 1.0 . 4.17 243 206 A 39 PHE HD% A 28 GLU HBy 1.0 . 4.17 244 207 A 66 ILE HB A 67 ILE H 1.0 . 5.50 245 208 A 50 ARG H A 50 ARG HBy 1.0 . 3.90 246 209 A 40 TYR HD% A 27 ILE HG1y 1.0 . 3.56 247 210 A 50 ARG H A 50 ARG HBx 1.0 . 3.90 248 211 A 66 ILE HG1x A 67 ILE H 1.0 . 3.45 249 212 A 66 ILE HG1x A 66 ILE H 1.0 . 2.80 250 213 A 39 PHE HD% A 52 MET HBy 1.0 . 3.48 251 214 A 30 THR HG2% A 39 PHE HZ 1.0 . 4.31 252 215 A 44 ILE HG2% A 47 ASN H 1.0 . 3.24 253 216 A 67 ILE HG2% A 68 SER H 1.0 . 3.11 254 217 A 15 VAL H A 15 VAL HGy% 1.0 . 3.89 255 218 A 66 ILE HG2% A 67 ILE H 1.0 . 4.82 256 219 A 66 ILE HG2% A 66 ILE H 1.0 . 3.10 257 220 A 27 ILE HD1% A 27 ILE H 1.0 . 2.80 258 221 A 15 VAL H A 14 ALA HB% 1.0 . 4.13 259 222 A 51 ILE HG1y A 51 ILE H 1.0 . 4.93 260 223 A 24 VAL HGx% A 26 GLY H 1.0 . 3.98 261 224 A 15 VAL HGx% A 16 TYR H 1.0 . 4.54 262 225 A 42 LEU H A 41 VAL HGx% 1.0 . 4.37 263 226 A 40 TYR H A 55 ILE HG2% 1.0 . 4.32 264 227 A 55 ILE H A 55 ILE HG2% 1.0 . 3.36 265 228 A 16 TYR HD% A 63 LEU HDx% 1.0 . 5.42 266 229 A 24 VAL HGy% A 24 VAL H 1.0 . 4.68 267 230 A 24 VAL HGy% A 40 TYR HD% 1.0 . 4.25 268 231 A 68 SER H A 68 SER HBx 1.0 . 3.05 269 231 A 68 SER HBy A 68 SER H 1.0 . 3.05 270 232 A 66 ILE HA A 67 ILE H 1.0 . 3.15 271 233 A 10 THR HG2% A 11 GLY H 1.0 . 3.89 272 234 A 40 TYR H A 39 PHE HBy 1.0 . 3.77 273 235 A 42 LEU H A 41 VAL HGy% 1.0 . 4.37 274 236 A 30 THR H A 29 HIS HBx 1.0 . 3.69 275 236 A 30 THR H A 29 HIS HBy 1.0 . 3.69 276 237 A 46 GLU H A 46 GLU HBy 1.0 . 3.54 277 238 A 36 ARG H A 36 ARG HBx 1.0 . 3.68 278 238 A 36 ARG HBy A 36 ARG H 1.0 . 3.68 279 239 A 29 HIS H A 28 GLU HGx 1.0 . 5.50 280 239 A 28 GLU HGy A 29 HIS H 1.0 . 5.50 281 240 A 34 GLY H A 33 ALA HB% 1.0 . 3.72 282 241 A 31 GLU H A 31 GLU HGx 1.0 . 5.50 283 242 A 23 GLU HBy A 45 LEU H 1.0 . 5.50 284 243 A 23 GLU HBx A 45 LEU H 1.0 . 5.50 285 244 A 27 ILE HD1% A 41 VAL H 1.0 . 5.50 286 245 A 66 ILE HG2% A 68 SER H 1.0 . 5.50 287 246 A 67 ILE HD1% A 68 SER H 1.0 . 5.50 288 247 A 66 ILE HD1% A 68 SER H 1.0 . 5.50 289 248 A 10 THR HG2% A 10 THR H 1.0 . 4.25 290 249 A 70 GLU H A 70 GLU HGx 1.0 . 3.85 291 249 A 70 GLU HGy A 70 GLU H 1.0 . 3.85 292 250 A 9 LYS HBx A 10 THR H 1.0 . 5.50 293 251 A 66 ILE HG1y A 66 ILE H 1.0 . 3.88 294 252 A 64 ARG H A 14 ALA HB% 1.0 . 5.50 295 253 A 15 VAL HGx% A 66 ILE H 1.0 . 5.50 296 254 A 64 ARG H A 64 ARG HGx 1.0 . 5.50 297 254 A 64 ARG H A 64 ARG HGy 1.0 . 5.50 298 255 A 15 VAL HGy% A 21 VAL H 1.0 . 5.50 299 256 A 19 GLN H A 19 GLN HGx 1.0 . 4.64 300 256 A 19 GLN HGy A 19 GLN H 1.0 . 4.64 301 257 A 15 VAL HGy% A 20 GLY H 1.0 . 5.50 302 258 A 24 VAL HGx% A 12 ASP H 1.0 . 5.50 303 259 A 20 GLY H A 19 GLN HBx 1.0 . 5.50 304 260 A 27 ILE H A 27 ILE HB 1.0 . 3.36 305 261 A 49 MET H A 49 MET HE% 1.0 . 5.50 306 262 A 71 ASP H A 70 GLU HBx 1.0 . 2.91 307 263 A 71 ASP H A 71 ASP HBy 1.0 . 3.75 308 264 A 71 ASP H A 71 ASP HBx 1.0 . 3.75 309 265 A 35 GLN H A 35 GLN HGy 1.0 . 4.86 310 266 A 35 GLN H A 35 GLN HGx 1.0 . 4.86 311 267 A 55 ILE H A 55 ILE HB 1.0 . 3.66 312 268 A 40 TYR HD% A 53 ILE HG2% 1.0 . 3.59 313 269 A 39 PHE HD% A 37 GLN HBx 1.0 . 5.12 314 269 A 39 PHE HD% A 37 GLN HBy 1.0 . 5.12 315 270 A 10 THR HG2% A 11 GLY HAy 1.0 . 4.28 316 271 A 24 VAL HA A 24 VAL HGx% 1.0 . 2.80 317 272 A 51 ILE HA A 42 LEU HBy 1.0 . 5.50 318 273 A 44 ILE HD1% A 44 ILE HG2% 1.0 . 3.47 319 274 A 30 THR HG2% A 28 GLU HGx 1.0 . 5.18 320 274 A 30 THR HG2% A 28 GLU HGy 1.0 . 5.18 321 275 A 67 ILE HG2% A 67 ILE HG1y 1.0 . 2.80 322 276 A 45 LEU HDx% A 45 LEU HBx 1.0 . 4.21 323 277 A 66 ILE HG1y A 66 ILE HB 1.0 . 2.99 324 278 A 45 LEU HBy A 45 LEU HDy% 1.0 . 4.21 325 279 A 27 ILE HD1% A 9 LYS HDx 1.0 . 3.58 326 279 A 27 ILE HD1% A 9 LYS HDy 1.0 . 3.58 327 280 A 67 ILE HG2% A 67 ILE HG1x 1.0 . 2.80 328 281 A 65 GLU HA A 15 VAL HGx% 1.0 . 5.50 329 282 A 27 ILE HD1% A 26 GLY HAy 1.0 . 5.50 330 283 A 24 VAL HGx% A 11 GLY HAy 1.0 . 5.50 331 284 A 66 ILE HG2% A 68 SER HBx 1.0 . 5.50 332 284 A 68 SER HBy A 66 ILE HG2% 1.0 . 5.50 333 285 A 42 LEU HA A 24 VAL HGx% 1.0 . 5.50 334 286 A 66 ILE HG1y A 67 ILE H 1.0 . 2.80 335 287 A 16 TYR HA A 16 TYR HD% 1.0 . 3.77 336 288 A 24 VAL HGx% A 24 VAL H 1.0 . 3.79 337 289 A 25 MET H A 26 GLY H 1.0 . 4.45 338 290 A 40 TYR HA A 41 VAL H 1.0 . 3.40 339 291 A 27 ILE HG1y A 27 ILE H 1.0 . 4.34 340 292 A 27 ILE HG1y A 28 GLU H 1.0 . 3.92 341 293 A 39 PHE HD% A 39 PHE HZ 1.0 . 3.81 342 294 A 40 TYR HBy A 41 VAL H 1.0 . 3.57 343 295 A 21 VAL HA A 21 VAL HGy% 1.0 . 3.39 344 296 A 54 PRO HDx A 53 ILE HA 1.0 . 3.71 345 297 A 27 ILE HA A 27 ILE HG1x 1.0 . 3.67 346 298 A 42 LEU HA A 42 LEU HG 1.0 . 3.48 347 299 A 43 ARG HBy A 43 ARG HDy 1.0 . 3.97 348 300 A 43 ARG HBy A 43 ARG HDx 1.0 . 3.97 349 301 A 43 ARG HDx A 43 ARG HBx 1.0 . 3.97 350 302 A 42 LEU HDx% A 40 TYR HBy 1.0 . 5.20 351 303 A 67 ILE HA A 67 ILE HG1x 1.0 . 3.76 352 304 A 66 ILE HA A 66 ILE HG2% 1.0 . 2.80 353 305 A 27 ILE HG2% A 40 TYR HD% 1.0 . 4.56 354 306 A 44 ILE HD1% A 44 ILE HB 1.0 . 3.39 355 307 A 53 ILE HB A 40 TYR HBx 1.0 . 4.92 356 308 A 63 LEU HBx A 14 ALA HB% 1.0 . 5.50 357 309 A 67 ILE HG2% A 67 ILE HA 1.0 . 3.68 358 310 A 30 THR HG2% A 30 THR HA 1.0 . 3.83 359 311 A 24 VAL HGx% A 10 THR HG2% 1.0 . 4.16 360 312 A 6 THR HA A 6 THR HG2% 1.0 . 3.78 361 313 A 55 ILE HD1% A 55 ILE HB 1.0 . 3.13 362 314 A 67 ILE HA A 67 ILE HG1y 1.0 . 3.00 363 315 A 42 LEU HDy% A 42 LEU HBy 1.0 . 3.57 364 316 A 27 ILE HB A 27 ILE HG1x 1.0 . 2.80 365 317 A 63 LEU HBx A 63 LEU HDx% 1.0 . 3.96 366 318 A 52 MET HBy A 28 GLU HGx 1.0 . 5.50 367 318 A 52 MET HBy A 28 GLU HGy 1.0 . 5.50 368 319 A 9 LYS HBy A 9 LYS HEx 1.0 . 5.50 369 319 A 9 LYS HBy A 9 LYS HEy 1.0 . 5.50 370 320 A 44 ILE HG2% A 46 GLU HBx 1.0 . 5.50 371 321 A 44 ILE HG2% A 46 GLU HGx 1.0 . 5.50 372 321 A 46 GLU HGy A 44 ILE HG2% 1.0 . 5.50 373 322 A 44 ILE HG2% A 46 GLU HA 1.0 . 4.66 374 323 A 54 PRO HDx A 53 ILE HG2% 1.0 . 4.37 375 324 A 66 ILE HA A 66 ILE HG1x 1.0 . 3.76 376 325 A 25 MET HA A 25 MET HGx 1.0 . 3.30 377 325 A 25 MET HGy A 25 MET HA 1.0 . 3.30 378 326 A 15 VAL HGx% A 15 VAL HA 1.0 . 3.28 379 327 A 36 ARG HA A 36 ARG HGx 1.0 . 3.34 380 328 A 36 ARG HA A 36 ARG HGy 1.0 . 3.34 381 329 A 52 MET HBy A 39 PHE HBx 1.0 . 4.44 382 330 A 52 MET HBy A 39 PHE HBy 1.0 . 3.31 383 331 A 66 ILE HA A 66 ILE HG1y 1.0 . 3.86 384 332 A 44 ILE HG2% A 49 MET HE% 1.0 . 3.91 385 333 A 51 ILE HG1y A 49 MET HE% 1.0 . 5.32 386 334 A 51 ILE HD1% A 49 MET HE% 1.0 . 4.27 387 335 A 42 LEU HDy% A 42 LEU HBx 1.0 . 3.52 388 336 A 42 LEU HG A 42 LEU HBy 1.0 . 2.80 389 337 A 40 TYR HD% A 24 VAL HGx% 1.0 . 2.80 390 338 A 24 VAL HGy% A 12 ASP HBx 1.0 . 4.41 391 339 A 69 GLU HA A 69 GLU HGx 1.0 . 3.52 392 339 A 69 GLU HA A 69 GLU HGy 1.0 . 3.52 393 340 A 16 TYR HA A 63 LEU HDx% 1.0 . 4.37 394 341 A 15 VAL HGy% A 15 VAL HA 1.0 . 2.80 395 342 A 21 VAL HA A 21 VAL HGx% 1.0 . 3.39 396 343 A 15 VAL HGy% A 21 VAL HA 1.0 . 5.50 397 344 A 24 VAL HGy% A 12 ASP HBy 1.0 . 4.41 398 345 A 24 VAL HGx% A 40 TYR HBy 1.0 . 4.21 399 346 A 63 LEU HA A 63 LEU HG 1.0 . 3.87 400 347 A 63 LEU HA A 63 LEU HDy% 1.0 . 3.68 401 348 A 14 ALA HB% A 63 LEU HDy% 1.0 . 5.50 402 349 A 42 LEU HDx% A 42 LEU HBx 1.0 . 3.07 403 350 A 23 GLU HA A 13 LYS HGy 1.0 . 3.59 404 351 A 53 ILE HB A 40 TYR HBy 1.0 . 3.76 405 352 A 55 ILE HA A 53 ILE HG2% 1.0 . 3.67 406 353 A 40 TYR HBy A 53 ILE HG2% 1.0 . 4.36 407 354 A 66 ILE HG2% A 66 ILE HG1x 1.0 . 3.09 408 355 A 43 ARG HA A 43 ARG HGy 1.0 . 3.74 409 356 A 64 ARG HA A 64 ARG HGx 1.0 . 3.43 410 356 A 64 ARG HGy A 64 ARG HA 1.0 . 3.43 411 357 A 55 ILE HD1% A 58 VAL HGx% 1.0 . 5.50 412 358 A 55 ILE HD1% A 58 VAL HGy% 1.0 . 5.50 413 359 A 31 GLU HA A 31 GLU HGy 1.0 . 3.96 414 360 A 31 GLU HA A 31 GLU HBy 1.0 . 3.02 415 361 A 31 GLU HA A 31 GLU HGx 1.0 . 3.96 416 362 A 25 MET HA A 25 MET HE% 1.0 . 4.32 417 363 A 5 GLN HBy A 5 GLN HE2y 1.0 . 4.48 418 363 A 5 GLN HBx A 5 GLN HE2y 1.0 . 4.48 419 363 A 5 GLN HE2x A 5 GLN HBx 1.0 . 4.48 420 363 A 5 GLN HBy A 5 GLN HE2x 1.0 . 4.48 421 364 A 8 PHE H A 8 PHE HBx 1.0 . 3.69 422 364 A 8 PHE H A 8 PHE HBy 1.0 . 3.69 423 365 A 8 PHE HD% A 12 ASP HBy 1.0 . 2.80 424 365 A 8 PHE HD% A 12 ASP HBx 1.0 . 2.80 425 366 A 9 LYS HEy A 9 LYS HGy 1.0 . 2.80 426 366 A 9 LYS HEx A 9 LYS HGy 1.0 . 2.80 427 366 A 9 LYS HGx A 9 LYS HEx 1.0 . 2.80 428 366 A 9 LYS HEy A 9 LYS HGx 1.0 . 2.80 429 367 A 27 ILE HD1% A 9 LYS HGy 1.0 . 5.34 430 367 A 27 ILE HD1% A 9 LYS HGx 1.0 . 5.34 431 368 A 12 ASP H A 12 ASP HBy 1.0 . 3.45 432 368 A 12 ASP H A 12 ASP HBx 1.0 . 3.45 433 369 A 24 VAL HGy% A 12 ASP HBy 1.0 . 3.77 434 369 A 24 VAL HGy% A 12 ASP HBx 1.0 . 3.77 435 370 A 13 LYS H A 23 GLU HGx 1.0 . 5.34 436 370 A 13 LYS H A 23 GLU HGy 1.0 . 5.34 437 371 A 13 LYS HA A 13 LYS HGy 1.0 . 2.28 438 371 A 13 LYS HA A 13 LYS HGx 1.0 . 2.28 439 372 A 13 LYS HBx A 13 LYS HEx 1.0 . 2.94 440 372 A 13 LYS HBy A 13 LYS HEx 1.0 . 2.94 441 372 A 13 LYS HEy A 13 LYS HBx 1.0 . 2.94 442 372 A 13 LYS HBy A 13 LYS HEy 1.0 . 2.94 443 373 A 13 LYS HEy A 13 LYS HGy 1.0 . 2.80 444 373 A 13 LYS HEx A 13 LYS HGy 1.0 . 2.80 445 373 A 13 LYS HGx A 13 LYS HEx 1.0 . 2.80 446 373 A 13 LYS HGx A 13 LYS HEy 1.0 . 2.80 447 374 A 23 GLU HA A 13 LYS HGy 1.0 . 3.02 448 374 A 23 GLU HA A 13 LYS HGx 1.0 . 3.02 449 375 A 23 GLU HBx A 13 LYS HGy 1.0 . 5.34 450 375 A 23 GLU HBx A 13 LYS HGx 1.0 . 5.34 451 376 A 13 LYS HGx A 23 GLU HGx 1.0 . 5.18 452 376 A 13 LYS HGy A 23 GLU HGx 1.0 . 5.18 453 376 A 23 GLU HGy A 13 LYS HGy 1.0 . 5.18 454 376 A 23 GLU HGy A 13 LYS HGx 1.0 . 5.18 455 377 A 15 VAL HGx% A 20 GLY HAx 1.0 . 3.79 456 377 A 15 VAL HGx% A 20 GLY HAy 1.0 . 3.79 457 378 A 15 VAL HGy% A 20 GLY HAx 1.0 . 3.44 458 378 A 15 VAL HGy% A 20 GLY HAy 1.0 . 3.44 459 379 A 16 TYR H A 16 TYR HBx 1.0 . 3.55 460 379 A 16 TYR H A 16 TYR HBy 1.0 . 3.55 461 380 A 19 GLN H A 16 TYR HBx 1.0 . 5.12 462 380 A 19 GLN H A 16 TYR HBy 1.0 . 5.12 463 381 A 18 GLY H A 17 PRO HBx 1.0 . 3.93 464 381 A 17 PRO HBy A 18 GLY H 1.0 . 3.93 465 382 A 19 GLN HBy A 20 GLY HAx 1.0 . 5.34 466 382 A 19 GLN HBy A 20 GLY HAy 1.0 . 5.34 467 383 A 19 GLN HE2y A 19 GLN HGx 1.0 . 3.24 468 383 A 19 GLN HE2x A 19 GLN HGx 1.0 . 3.24 469 383 A 19 GLN HGy A 19 GLN HE2y 1.0 . 3.24 470 383 A 19 GLN HGy A 19 GLN HE2x 1.0 . 3.24 471 384 A 19 GLN HE2y A 46 GLU HGx 1.0 . 5.34 472 384 A 19 GLN HE2x A 46 GLU HGx 1.0 . 5.34 473 384 A 46 GLU HGy A 19 GLN HE2y 1.0 . 5.34 474 384 A 46 GLU HGy A 19 GLN HE2x 1.0 . 5.34 475 385 A 20 GLY HAy A 21 VAL HGy% 1.0 . 5.28 476 385 A 20 GLY HAx A 21 VAL HGy% 1.0 . 5.28 477 385 A 21 VAL HGx% A 20 GLY HAx 1.0 . 5.28 478 385 A 20 GLY HAy A 21 VAL HGx% 1.0 . 5.28 479 386 A 21 VAL H A 21 VAL HGy% 1.0 . 3.49 480 386 A 21 VAL H A 21 VAL HGx% 1.0 . 3.49 481 387 A 21 VAL HA A 45 LEU HDy% 1.0 . 5.44 482 387 A 21 VAL HA A 45 LEU HDx% 1.0 . 5.44 483 388 A 21 VAL HB A 46 GLU HBx 1.0 . 5.34 484 388 A 21 VAL HB A 46 GLU HBy 1.0 . 5.34 485 389 A 22 GLY H A 21 VAL HGy% 1.0 . 4.13 486 389 A 22 GLY H A 21 VAL HGx% 1.0 . 4.13 487 390 A 22 GLY HAy A 21 VAL HGy% 1.0 . 5.31 488 390 A 22 GLY HAy A 21 VAL HGx% 1.0 . 5.31 489 391 A 21 VAL HGx% A 45 LEU HBy 1.0 . 3.08 490 391 A 21 VAL HGy% A 45 LEU HBy 1.0 . 3.08 491 391 A 45 LEU HBx A 21 VAL HGy% 1.0 . 3.08 492 391 A 21 VAL HGx% A 45 LEU HBx 1.0 . 3.08 493 392 A 21 VAL HGx% A 45 LEU HDy% 1.0 . 5.37 494 392 A 21 VAL HGy% A 45 LEU HDy% 1.0 . 5.37 495 392 A 45 LEU HDx% A 21 VAL HGy% 1.0 . 5.37 496 392 A 21 VAL HGx% A 45 LEU HDx% 1.0 . 5.37 497 393 A 21 VAL HGy% A 46 GLU HBx 1.0 . 5.28 498 393 A 46 GLU HBy A 21 VAL HGy% 1.0 . 5.28 499 393 A 21 VAL HGx% A 46 GLU HBy 1.0 . 5.28 500 393 A 21 VAL HGx% A 46 GLU HBx 1.0 . 5.28 501 394 A 23 GLU H A 23 GLU HGx 1.0 . 5.34 502 394 A 23 GLU HGy A 23 GLU H 1.0 . 5.34 503 395 A 23 GLU HA A 23 GLU HGx 1.0 . 2.80 504 395 A 23 GLU HA A 23 GLU HGy 1.0 . 2.80 505 396 A 23 GLU HBy A 45 LEU HDy% 1.0 . 5.44 506 396 A 23 GLU HBy A 45 LEU HDx% 1.0 . 5.44 507 397 A 24 VAL H A 23 GLU HGx 1.0 . 5.00 508 397 A 24 VAL H A 23 GLU HGy 1.0 . 5.00 509 398 A 24 VAL HGx% A 26 GLY HAy 1.0 . 5.34 510 398 A 24 VAL HGx% A 26 GLY HAx 1.0 . 5.34 511 399 A 25 MET HGx A 41 VAL HGy% 1.0 . 3.71 512 399 A 25 MET HGy A 41 VAL HGy% 1.0 . 3.71 513 399 A 41 VAL HGx% A 25 MET HGx 1.0 . 3.71 514 399 A 25 MET HGy A 41 VAL HGx% 1.0 . 3.71 515 400 A 25 MET HE% A 41 VAL HGy% 1.0 . 5.44 516 400 A 25 MET HE% A 41 VAL HGx% 1.0 . 5.44 517 401 A 26 GLY H A 41 VAL HGy% 1.0 . 4.72 518 401 A 26 GLY H A 41 VAL HGx% 1.0 . 4.72 519 402 A 27 ILE H A 41 VAL HGy% 1.0 . 3.87 520 402 A 27 ILE H A 41 VAL HGx% 1.0 . 3.87 521 403 A 27 ILE HG2% A 38 SER HBx 1.0 . 4.16 522 403 A 27 ILE HG2% A 38 SER HBy 1.0 . 4.16 523 404 A 28 GLU HGy A 41 VAL HGy% 1.0 . 3.94 524 404 A 28 GLU HGx A 41 VAL HGy% 1.0 . 3.94 525 404 A 41 VAL HGx% A 28 GLU HGx 1.0 . 3.94 526 404 A 28 GLU HGy A 41 VAL HGx% 1.0 . 3.94 527 405 A 30 THR HG2% A 37 GLN HGy 1.0 . 5.34 528 405 A 30 THR HG2% A 37 GLN HGx 1.0 . 5.34 529 406 A 31 GLU HBx A 32 VAL HGx% 1.0 . 5.28 530 406 A 31 GLU HBy A 32 VAL HGx% 1.0 . 5.28 531 406 A 32 VAL HGy% A 31 GLU HBx 1.0 . 5.28 532 406 A 31 GLU HBy A 32 VAL HGy% 1.0 . 5.28 533 407 A 31 GLU HBy A 36 ARG HGx 1.0 . 5.18 534 407 A 31 GLU HBx A 36 ARG HGx 1.0 . 5.18 535 407 A 36 ARG HGy A 31 GLU HBx 1.0 . 5.18 536 407 A 31 GLU HBy A 36 ARG HGy 1.0 . 5.18 537 408 A 31 GLU HGy A 35 GLN HGy 1.0 . 5.18 538 408 A 31 GLU HGx A 35 GLN HGy 1.0 . 5.18 539 408 A 35 GLN HGx A 31 GLU HGx 1.0 . 5.18 540 408 A 31 GLU HGy A 35 GLN HGx 1.0 . 5.18 541 409 A 32 VAL H A 32 VAL HGx% 1.0 . 3.01 542 409 A 32 VAL HGy% A 32 VAL H 1.0 . 3.01 543 410 A 32 VAL H A 35 GLN HBy 1.0 . 4.71 544 410 A 32 VAL H A 35 GLN HBx 1.0 . 4.71 545 411 A 32 VAL HA A 32 VAL HGx% 1.0 . 3.04 546 411 A 32 VAL HGy% A 32 VAL HA 1.0 . 3.04 547 412 A 32 VAL HGx% A 36 ARG HBx 1.0 . 5.50 548 412 A 32 VAL HGy% A 36 ARG HBx 1.0 . 5.50 549 412 A 36 ARG HBy A 32 VAL HGx% 1.0 . 5.50 550 412 A 36 ARG HBy A 32 VAL HGy% 1.0 . 5.50 551 413 A 39 PHE HE% A 32 VAL HGx% 1.0 . 2.84 552 413 A 39 PHE HE% A 32 VAL HGy% 1.0 . 2.84 553 414 A 39 PHE HZ A 32 VAL HGx% 1.0 . 2.80 554 414 A 39 PHE HZ A 32 VAL HGy% 1.0 . 2.80 555 415 A 33 ALA HB% A 35 GLN HBy 1.0 . 5.34 556 415 A 33 ALA HB% A 35 GLN HBx 1.0 . 5.34 557 416 A 35 GLN H A 35 GLN HBy 1.0 . 3.41 558 416 A 35 GLN H A 35 GLN HBx 1.0 . 3.41 559 417 A 35 GLN H A 35 GLN HGy 1.0 . 4.26 560 417 A 35 GLN H A 35 GLN HGx 1.0 . 4.26 561 418 A 35 GLN HA A 35 GLN HGy 1.0 . 2.80 562 418 A 35 GLN HA A 35 GLN HGx 1.0 . 2.80 563 419 A 35 GLN HE2x A 35 GLN HBy 1.0 . 3.70 564 419 A 35 GLN HBx A 35 GLN HE2x 1.0 . 3.70 565 420 A 35 GLN HE2y A 35 GLN HBy 1.0 . 4.03 566 420 A 35 GLN HBx A 35 GLN HE2y 1.0 . 4.03 567 421 A 36 ARG H A 35 GLN HBy 1.0 . 4.33 568 421 A 36 ARG H A 35 GLN HBx 1.0 . 4.33 569 422 A 35 GLN HE2x A 35 GLN HGy 1.0 . 2.81 570 422 A 35 GLN HGx A 35 GLN HE2x 1.0 . 2.81 571 423 A 35 GLN HE2y A 35 GLN HGy 1.0 . 3.45 572 423 A 35 GLN HGx A 35 GLN HE2y 1.0 . 3.45 573 424 A 36 ARG HA A 36 ARG HGx 1.0 . 2.80 574 424 A 36 ARG HA A 36 ARG HGy 1.0 . 2.80 575 425 A 37 GLN HA A 37 GLN HGy 1.0 . 2.80 576 425 A 37 GLN HA A 37 GLN HGx 1.0 . 2.80 577 426 A 37 GLN HBy A 37 GLN HE2y 1.0 . 3.80 578 426 A 37 GLN HBx A 37 GLN HE2y 1.0 . 3.80 579 426 A 37 GLN HE2x A 37 GLN HBx 1.0 . 3.80 580 426 A 37 GLN HBy A 37 GLN HE2x 1.0 . 3.80 581 427 A 37 GLN HE2x A 37 GLN HGy 1.0 . 2.93 582 427 A 37 GLN HE2y A 37 GLN HGy 1.0 . 2.93 583 427 A 37 GLN HGx A 37 GLN HE2y 1.0 . 2.93 584 427 A 37 GLN HGx A 37 GLN HE2x 1.0 . 2.93 585 428 A 37 GLN HE2y A 54 PRO HGx 1.0 . 4.76 586 428 A 54 PRO HGy A 37 GLN HE2y 1.0 . 4.76 587 428 A 37 GLN HE2x A 54 PRO HGy 1.0 . 4.76 588 428 A 37 GLN HE2x A 54 PRO HGx 1.0 . 4.76 589 429 A 55 ILE HG2% A 38 SER HBx 1.0 . 2.80 590 429 A 55 ILE HG2% A 38 SER HBy 1.0 . 2.80 591 430 A 55 ILE HD1% A 38 SER HBx 1.0 . 2.80 592 430 A 55 ILE HD1% A 38 SER HBy 1.0 . 2.80 593 431 A 39 PHE HD% A 54 PRO HGx 1.0 . 5.35 594 431 A 39 PHE HD% A 54 PRO HGy 1.0 . 5.35 595 432 A 39 PHE HE% A 54 PRO HGx 1.0 . 5.35 596 432 A 39 PHE HE% A 54 PRO HGy 1.0 . 5.35 597 433 A 40 TYR H A 41 VAL HGy% 1.0 . 5.44 598 433 A 40 TYR H A 41 VAL HGx% 1.0 . 5.44 599 434 A 40 TYR HA A 41 VAL HGy% 1.0 . 3.77 600 434 A 40 TYR HA A 41 VAL HGx% 1.0 . 3.77 601 435 A 40 TYR HD% A 58 VAL HGy% 1.0 . 2.99 602 435 A 40 TYR HD% A 58 VAL HGx% 1.0 . 2.99 603 436 A 40 TYR HD% A 61 VAL HGx% 1.0 . 5.44 604 436 A 40 TYR HD% A 61 VAL HGy% 1.0 . 5.44 605 437 A 40 TYR HE% A 58 VAL HGy% 1.0 . 2.80 606 437 A 40 TYR HE% A 58 VAL HGx% 1.0 . 2.80 607 438 A 41 VAL H A 41 VAL HGy% 1.0 . 3.44 608 438 A 41 VAL H A 41 VAL HGx% 1.0 . 3.44 609 439 A 42 LEU H A 41 VAL HGy% 1.0 . 3.39 610 439 A 42 LEU H A 41 VAL HGx% 1.0 . 3.39 611 440 A 41 VAL HGx% A 50 ARG HBx 1.0 . 3.87 612 440 A 41 VAL HGy% A 50 ARG HBx 1.0 . 3.87 613 440 A 50 ARG HBy A 41 VAL HGy% 1.0 . 3.87 614 440 A 41 VAL HGx% A 50 ARG HBy 1.0 . 3.87 615 441 A 41 VAL HGy% A 50 ARG HGx 1.0 . 5.44 616 441 A 50 ARG HGy A 41 VAL HGy% 1.0 . 5.44 617 441 A 41 VAL HGx% A 50 ARG HGy 1.0 . 5.44 618 441 A 41 VAL HGx% A 50 ARG HGx 1.0 . 5.44 619 442 A 51 ILE H A 41 VAL HGy% 1.0 . 4.94 620 442 A 51 ILE H A 41 VAL HGx% 1.0 . 4.94 621 443 A 52 MET HBy A 41 VAL HGy% 1.0 . 5.44 622 443 A 52 MET HBy A 41 VAL HGx% 1.0 . 5.44 623 444 A 41 VAL HGy% A 52 MET HGx 1.0 . 4.84 624 444 A 41 VAL HGx% A 52 MET HGx 1.0 . 4.84 625 444 A 52 MET HGy A 41 VAL HGy% 1.0 . 4.84 626 444 A 41 VAL HGx% A 52 MET HGy 1.0 . 4.84 627 445 A 52 MET HE% A 41 VAL HGy% 1.0 . 5.44 628 445 A 41 VAL HGx% A 52 MET HE% 1.0 . 5.44 629 446 A 42 LEU HDx% A 43 ARG HBx 1.0 . 5.34 630 446 A 42 LEU HDx% A 43 ARG HBy 1.0 . 5.34 631 447 A 42 LEU HDx% A 43 ARG HGx 1.0 . 5.34 632 447 A 42 LEU HDx% A 43 ARG HGy 1.0 . 5.34 633 448 A 42 LEU HDy% A 53 ILE HG1x 1.0 . 5.34 634 448 A 42 LEU HDy% A 53 ILE HG1y 1.0 . 5.34 635 449 A 43 ARG HA A 43 ARG HGx 1.0 . 2.88 636 449 A 43 ARG HA A 43 ARG HGy 1.0 . 2.88 637 450 A 43 ARG HBx A 43 ARG HDy 1.0 . 2.80 638 450 A 43 ARG HBy A 43 ARG HDy 1.0 . 2.80 639 450 A 43 ARG HDx A 43 ARG HBx 1.0 . 2.80 640 450 A 43 ARG HBy A 43 ARG HDx 1.0 . 2.80 641 451 A 45 LEU H A 45 LEU HDy% 1.0 . 3.93 642 451 A 45 LEU H A 45 LEU HDx% 1.0 . 3.93 643 452 A 45 LEU HA A 45 LEU HDy% 1.0 . 2.80 644 452 A 45 LEU HA A 45 LEU HDx% 1.0 . 2.80 645 453 A 45 LEU HBx A 45 LEU HDy% 1.0 . 2.80 646 453 A 45 LEU HBy A 45 LEU HDy% 1.0 . 2.80 647 453 A 45 LEU HDx% A 45 LEU HBy 1.0 . 2.80 648 453 A 45 LEU HDx% A 45 LEU HBx 1.0 . 2.80 649 454 A 45 LEU HBx A 45 LEU HDy% 1.0 . 4.21 650 455 A 45 LEU HDx% A 45 LEU HBy 1.0 . 4.21 651 456 A 46 GLU H A 45 LEU HBy 1.0 . 4.07 652 456 A 46 GLU H A 45 LEU HBx 1.0 . 4.07 653 457 A 45 LEU HDx% A 48 GLY HAx 1.0 . 5.28 654 457 A 45 LEU HDy% A 48 GLY HAx 1.0 . 5.28 655 457 A 48 GLY HAy A 45 LEU HDy% 1.0 . 5.28 656 457 A 45 LEU HDx% A 48 GLY HAy 1.0 . 5.28 657 458 A 46 GLU H A 46 GLU HBx 1.0 . 3.01 658 458 A 46 GLU H A 46 GLU HBy 1.0 . 3.01 659 459 A 47 ASN HBx A 47 ASN HD2y 1.0 . 2.80 660 459 A 47 ASN HBy A 47 ASN HD2y 1.0 . 2.80 661 459 A 47 ASN HD2x A 47 ASN HBy 1.0 . 2.80 662 459 A 47 ASN HBx A 47 ASN HD2x 1.0 . 2.80 663 460 A 47 ASN HD2x A 49 MET HGx 1.0 . 5.18 664 460 A 47 ASN HD2y A 49 MET HGx 1.0 . 5.18 665 460 A 49 MET HGy A 47 ASN HD2y 1.0 . 5.18 666 460 A 47 ASN HD2x A 49 MET HGy 1.0 . 5.18 667 461 A 49 MET HE% A 47 ASN HD2y 1.0 . 4.10 668 461 A 49 MET HE% A 47 ASN HD2x 1.0 . 4.10 669 462 A 49 MET HA A 49 MET HGx 1.0 . 2.80 670 462 A 49 MET HA A 49 MET HGy 1.0 . 2.80 671 463 A 50 ARG HBy A 52 MET HGx 1.0 . 5.18 672 463 A 50 ARG HBx A 52 MET HGx 1.0 . 5.18 673 463 A 52 MET HGy A 50 ARG HBx 1.0 . 5.18 674 463 A 50 ARG HBy A 52 MET HGy 1.0 . 5.18 675 464 A 52 MET HE% A 50 ARG HBx 1.0 . 5.34 676 464 A 50 ARG HBy A 52 MET HE% 1.0 . 5.34 677 465 A 52 MET H A 52 MET HGx 1.0 . 5.34 678 465 A 52 MET HGy A 52 MET H 1.0 . 5.34 679 466 A 54 PRO HBx A 57 LYS HGx 1.0 . 5.34 680 466 A 54 PRO HBy A 57 LYS HGx 1.0 . 5.34 681 466 A 57 LYS HGy A 54 PRO HBx 1.0 . 5.34 682 466 A 54 PRO HBy A 57 LYS HGy 1.0 . 5.34 683 467 A 54 PRO HBx A 57 LYS HDx 1.0 . 5.34 684 467 A 54 PRO HBy A 57 LYS HDx 1.0 . 5.34 685 467 A 57 LYS HDy A 54 PRO HBx 1.0 . 5.34 686 467 A 54 PRO HBy A 57 LYS HDy 1.0 . 5.34 687 468 A 54 PRO HGy A 57 LYS HGx 1.0 . 5.35 688 468 A 54 PRO HGx A 57 LYS HGx 1.0 . 5.35 689 468 A 57 LYS HGy A 54 PRO HGx 1.0 . 5.35 690 468 A 54 PRO HGy A 57 LYS HGy 1.0 . 5.35 691 469 A 55 ILE H A 55 ILE HG1x 1.0 . 3.31 692 469 A 55 ILE H A 55 ILE HG1y 1.0 . 3.31 693 470 A 55 ILE HA A 58 VAL HGy% 1.0 . 2.80 694 470 A 55 ILE HA A 58 VAL HGx% 1.0 . 2.80 695 471 A 55 ILE HG2% A 58 VAL HGy% 1.0 . 5.44 696 471 A 55 ILE HG2% A 58 VAL HGx% 1.0 . 5.44 697 472 A 55 ILE HG1x A 58 VAL HGy% 1.0 . 4.76 698 472 A 55 ILE HG1y A 58 VAL HGy% 1.0 . 4.76 699 472 A 58 VAL HGx% A 55 ILE HG1x 1.0 . 4.76 700 472 A 58 VAL HGx% A 55 ILE HG1y 1.0 . 4.76 701 473 A 58 VAL H A 58 VAL HGy% 1.0 . 4.07 702 473 A 58 VAL HGx% A 58 VAL H 1.0 . 4.07 703 474 A 58 VAL HA A 58 VAL HGy% 1.0 . 2.80 704 474 A 58 VAL HGx% A 58 VAL HA 1.0 . 2.80 705 475 A 58 VAL HA A 61 VAL HGx% 1.0 . 5.50 706 475 A 61 VAL HGy% A 58 VAL HA 1.0 . 5.50 707 476 A 58 VAL HGx% A 61 VAL HGx% 1.0 . 5.38 708 476 A 58 VAL HGy% A 61 VAL HGx% 1.0 . 5.38 709 476 A 61 VAL HGy% A 58 VAL HGy% 1.0 . 5.38 710 476 A 58 VAL HGx% A 61 VAL HGy% 1.0 . 5.38 711 477 A 63 LEU HDx% A 58 VAL HGy% 1.0 . 5.44 712 477 A 63 LEU HDx% A 58 VAL HGx% 1.0 . 5.44 713 478 A 63 LEU HDy% A 58 VAL HGy% 1.0 . 5.44 714 478 A 63 LEU HDy% A 58 VAL HGx% 1.0 . 5.44 715 479 A 61 VAL H A 61 VAL HGx% 1.0 . 3.87 716 479 A 61 VAL HGy% A 61 VAL H 1.0 . 3.87 717 480 A 61 VAL HA A 61 VAL HGx% 1.0 . 2.85 718 480 A 61 VAL HA A 61 VAL HGy% 1.0 . 2.85 719 481 A 63 LEU HDy% A 61 VAL HGx% 1.0 . 4.78 720 481 A 63 LEU HDy% A 61 VAL HGy% 1.0 . 4.78 721 482 A 64 ARG HBx A 64 ARG HDx 1.0 . 2.80 722 482 A 64 ARG HBy A 64 ARG HDx 1.0 . 2.80 723 482 A 64 ARG HDy A 64 ARG HBx 1.0 . 2.80 724 482 A 64 ARG HDy A 64 ARG HBy 1.0 . 2.80 725 483 A 65 GLU H A 65 GLU HBx 1.0 . 3.63 726 483 A 65 GLU H A 65 GLU HBy 1.0 . 3.63 727 484 A 67 ILE HA A 69 GLU HBx 1.0 . 5.34 728 484 A 67 ILE HA A 69 GLU HBy 1.0 . 5.34 729 485 A 67 ILE HD1% A 69 GLU HBx 1.0 . 5.34 730 485 A 67 ILE HD1% A 69 GLU HBy 1.0 . 5.34 731 486 A 69 GLU H A 69 GLU HBx 1.0 . 3.47 732 486 A 69 GLU H A 69 GLU HBy 1.0 . 3.47 733 487 A 71 ASP H A 71 ASP HBy 1.0 . 2.94 734 487 A 71 ASP H A 71 ASP HBx 1.0 . 2.94 stop_ save_ save_DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 3 HIS C A 4 MET N A 4 MET CA A 4 MET C 1.0 -190.0 -20.0 PHI 2 2 A 4 MET C A 5 GLN N A 5 GLN CA A 5 GLN C 1.0 -190.0 -20.0 PHI 3 3 A 5 GLN C A 6 THR N A 6 THR CA A 6 THR C 1.0 -190.0 -20.0 PHI 4 4 A 6 THR C A 7 SER N A 7 SER CA A 7 SER C 1.0 -190.0 -20.0 PHI 5 5 A 7 SER C A 8 PHE N A 8 PHE CA A 8 PHE C 1.0 -143.7 -71.8 PHI 6 6 A 8 PHE N A 8 PHE CA A 8 PHE C A 9 LYS N 1.0 112.3 173.4 PSI 7 7 A 8 PHE C A 9 LYS N A 9 LYS CA A 9 LYS C 1.0 -154.7 -70.3 PHI 8 8 A 9 LYS N A 9 LYS CA A 9 LYS C A 10 THR N 1.0 131.3 180.0 PSI 9 9 A 9 LYS C A 10 THR N A 10 THR CA A 10 THR C 1.0 -86.6 -30.8 PHI 10 10 A 10 THR N A 10 THR CA A 10 THR C A 11 GLY N 1.0 120.2 145.1 PSI 11 11 A 10 THR C A 11 GLY N A 11 GLY CA A 11 GLY C 1.0 84.6 105.7 PHI 12 12 A 11 GLY N A 11 GLY CA A 11 GLY C A 12 ASP N 1.0 -28.9 1.1 PSI 13 13 A 11 GLY C A 12 ASP N A 12 ASP CA A 12 ASP C 1.0 -94.2 -50.6 PHI 14 14 A 12 ASP N A 12 ASP CA A 12 ASP C A 13 LYS N 1.0 134.3 157.4 PSI 15 15 A 12 ASP C A 13 LYS N A 13 LYS CA A 13 LYS C 1.0 -170.9 -78.0 PHI 16 16 A 13 LYS N A 13 LYS CA A 13 LYS C A 14 ALA N 1.0 127.8 177.8 PSI 17 17 A 13 LYS C A 14 ALA N A 14 ALA CA A 14 ALA C 1.0 -185.0 -111.6 PHI 18 18 A 14 ALA N A 14 ALA CA A 14 ALA C A 15 VAL N 1.0 122.8 175.1 PSI 19 19 A 14 ALA C A 15 VAL N A 15 VAL CA A 15 VAL C 1.0 -156.8 -76.9 PHI 20 20 A 15 VAL N A 15 VAL CA A 15 VAL C A 16 TYR N 1.0 100.3 148.6 PSI 21 21 A 15 VAL C A 16 TYR N A 16 TYR CA A 16 TYR C 1.0 -146.4 -52.4 PHI 22 22 A 18 GLY C A 19 GLN N A 19 GLN CA A 19 GLN C 1.0 -190.0 -20.0 PHI 23 23 A 19 GLN C A 20 GLY N A 20 GLY CA A 20 GLY C 1.0 80.0 110.0 PHI 24 24 A 20 GLY N A 20 GLY CA A 20 GLY C A 21 VAL N 1.0 -18.0 14.0 PSI 25 25 A 20 GLY C A 21 VAL N A 21 VAL CA A 21 VAL C 1.0 -106.1 -39.8 PHI 26 26 A 21 VAL N A 21 VAL CA A 21 VAL C A 22 GLY N 1.0 124.2 145.3 PSI 27 27 A 22 GLY C A 23 GLU N A 23 GLU CA A 23 GLU C 1.0 -151.7 -102.6 PHI 28 28 A 23 GLU N A 23 GLU CA A 23 GLU C A 24 VAL N 1.0 103.3 162.8 PSI 29 29 A 23 GLU C A 24 VAL N A 24 VAL CA A 24 VAL C 1.0 -110.9 -55.3 PHI 30 30 A 24 VAL N A 24 VAL CA A 24 VAL C A 25 MET N 1.0 107.2 153.4 PSI 31 31 A 24 VAL C A 25 MET N A 25 MET CA A 25 MET C 1.0 -129.6 -76.7 PHI 32 32 A 25 MET N A 25 MET CA A 25 MET C A 26 GLY N 1.0 -49.9 -10.0 PSI 33 33 A 25 MET C A 26 GLY N A 26 GLY CA A 26 GLY C 1.0 -190.0 -20.0 PHI 34 34 A 26 GLY C A 27 ILE N A 27 ILE CA A 27 ILE C 1.0 -144.8 -98.4 PHI 35 35 A 27 ILE N A 27 ILE CA A 27 ILE C A 28 GLU N 1.0 110.5 149.5 PSI 36 36 A 27 ILE C A 28 GLU N A 28 GLU CA A 28 GLU C 1.0 -147.9 -91.9 PHI 37 37 A 28 GLU N A 28 GLU CA A 28 GLU C A 29 HIS N 1.0 123.1 178.4 PSI 38 38 A 28 GLU C A 29 HIS N A 29 HIS CA A 29 HIS C 1.0 -137.9 -77.6 PHI 39 39 A 29 HIS N A 29 HIS CA A 29 HIS C A 30 THR N 1.0 113.8 161.7 PSI 40 40 A 29 HIS C A 30 THR N A 30 THR CA A 30 THR C 1.0 -141.9 -103.5 PHI 41 41 A 30 THR N A 30 THR CA A 30 THR C A 31 GLU N 1.0 98.4 185.2 PSI 42 42 A 30 THR C A 31 GLU N A 31 GLU CA A 31 GLU C 1.0 -145.7 -60.8 PHI 43 43 A 31 GLU N A 31 GLU CA A 31 GLU C A 32 VAL N 1.0 108.2 149.7 PSI 44 44 A 31 GLU C A 32 VAL N A 32 VAL CA A 32 VAL C 1.0 -156.5 -89.5 PHI 45 45 A 32 VAL N A 32 VAL CA A 32 VAL C A 33 ALA N 1.0 107.7 153.9 PSI 46 46 A 32 VAL C A 33 ALA N A 33 ALA CA A 33 ALA C 1.0 38.0 62.0 PHI 47 47 A 33 ALA N A 33 ALA CA A 33 ALA C A 34 GLY N 1.0 27.0 55.0 PSI 48 48 A 33 ALA C A 34 GLY N A 34 GLY CA A 34 GLY C 1.0 60.9 99.0 PHI 49 49 A 34 GLY N A 34 GLY CA A 34 GLY C A 35 GLN N 1.0 -30.9 32.9 PSI 50 50 A 34 GLY C A 35 GLN N A 35 GLN CA A 35 GLN C 1.0 -132.8 -79.2 PHI 51 51 A 35 GLN N A 35 GLN CA A 35 GLN C A 36 ARG N 1.0 114.9 167.8 PSI 52 52 A 35 GLN C A 36 ARG N A 36 ARG CA A 36 ARG C 1.0 -122.6 -61.8 PHI 53 53 A 36 ARG N A 36 ARG CA A 36 ARG C A 37 GLN N 1.0 112.8 143.2 PSI 54 54 A 36 ARG C A 37 GLN N A 37 GLN CA A 37 GLN C 1.0 -174.7 -59.3 PHI 55 55 A 37 GLN N A 37 GLN CA A 37 GLN C A 38 SER N 1.0 113.2 172.0 PSI 56 56 A 37 GLN C A 38 SER N A 38 SER CA A 38 SER C 1.0 -142.6 -78.6 PHI 57 57 A 38 SER N A 38 SER CA A 38 SER C A 39 PHE N 1.0 107.8 162.5 PSI 58 58 A 38 SER C A 39 PHE N A 39 PHE CA A 39 PHE C 1.0 -167.8 -86.6 PHI 59 59 A 39 PHE N A 39 PHE CA A 39 PHE C A 40 TYR N 1.0 115.4 182.3 PSI 60 60 A 39 PHE C A 40 TYR N A 40 TYR CA A 40 TYR C 1.0 -150.9 -48.5 PHI 61 61 A 40 TYR N A 40 TYR CA A 40 TYR C A 41 VAL N 1.0 124.9 187.0 PSI 62 62 A 40 TYR C A 41 VAL N A 41 VAL CA A 41 VAL C 1.0 -179.3 -66.5 PHI 63 63 A 41 VAL N A 41 VAL CA A 41 VAL C A 42 LEU N 1.0 99.7 159.7 PSI 64 64 A 41 VAL C A 42 LEU N A 42 LEU CA A 42 LEU C 1.0 -173.3 -70.3 PHI 65 65 A 42 LEU N A 42 LEU CA A 42 LEU C A 43 ARG N 1.0 113.9 163.7 PSI 66 66 A 42 LEU C A 43 ARG N A 43 ARG CA A 43 ARG C 1.0 -134.0 -82.7 PHI 67 67 A 43 ARG N A 43 ARG CA A 43 ARG C A 44 ILE N 1.0 102.3 141.9 PSI 68 68 A 43 ARG C A 44 ILE N A 44 ILE CA A 44 ILE C 1.0 -129.7 -68.7 PHI 69 69 A 44 ILE N A 44 ILE CA A 44 ILE C A 45 LEU N 1.0 56.8 199.2 PSI 70 70 A 44 ILE C A 45 LEU N A 45 LEU CA A 45 LEU C 1.0 -73.2 -47.0 PHI 71 71 A 45 LEU N A 45 LEU CA A 45 LEU C A 46 GLU N 1.0 -51.3 -5.4 PSI 72 72 A 45 LEU C A 46 GLU N A 46 GLU CA A 46 GLU C 1.0 -92.4 -42.3 PHI 73 73 A 46 GLU N A 46 GLU CA A 46 GLU C A 47 ASN N 1.0 -66.7 -3.2 PSI 74 74 A 46 GLU C A 47 ASN N A 47 ASN CA A 47 ASN C 1.0 -134.4 -65.3 PHI 75 75 A 47 ASN N A 47 ASN CA A 47 ASN C A 48 GLY N 1.0 -24.7 27.9 PSI 76 76 A 47 ASN C A 48 GLY N A 48 GLY CA A 48 GLY C 1.0 70.5 96.8 PHI 77 77 A 48 GLY N A 48 GLY CA A 48 GLY C A 49 MET N 1.0 -10.7 18.8 PSI 78 78 A 48 GLY C A 49 MET N A 49 MET CA A 49 MET C 1.0 -126.5 -35.6 PHI 79 79 A 49 MET N A 49 MET CA A 49 MET C A 50 ARG N 1.0 95.5 171.5 PSI 80 80 A 49 MET C A 50 ARG N A 50 ARG CA A 50 ARG C 1.0 -139.5 -73.5 PHI 81 81 A 50 ARG N A 50 ARG CA A 50 ARG C A 51 ILE N 1.0 98.5 172.3 PSI 82 82 A 50 ARG C A 51 ILE N A 51 ILE CA A 51 ILE C 1.0 -160.7 -83.3 PHI 83 83 A 51 ILE N A 51 ILE CA A 51 ILE C A 52 MET N 1.0 106.7 172.0 PSI 84 84 A 51 ILE C A 52 MET N A 52 MET CA A 52 MET C 1.0 -135.4 -71.4 PHI 85 85 A 52 MET N A 52 MET CA A 52 MET C A 53 ILE N 1.0 92.7 169.3 PSI 86 86 A 52 MET C A 53 ILE N A 53 ILE CA A 53 ILE C 1.0 -166.5 -80.7 PHI 87 87 A 53 ILE N A 53 ILE CA A 53 ILE C A 54 PRO N 1.0 85.8 187.9 PSI 88 88 A 54 PRO N A 54 PRO CA A 54 PRO C A 55 ILE N 1.0 122.0 158.2 PSI 89 89 A 54 PRO C A 55 ILE N A 55 ILE CA A 55 ILE C 1.0 -72.8 -51.2 PHI 90 90 A 55 ILE N A 55 ILE CA A 55 ILE C A 56 ASN N 1.0 -51.7 3.8 PSI 91 91 A 55 ILE C A 56 ASN N A 56 ASN CA A 56 ASN C 1.0 -101.2 -46.6 PHI 92 92 A 56 ASN N A 56 ASN CA A 56 ASN C A 57 LYS N 1.0 -42.1 13.1 PSI 93 93 A 56 ASN C A 57 LYS N A 57 LYS CA A 57 LYS C 1.0 -159.4 -36.4 PHI 94 94 A 57 LYS C A 58 VAL N A 58 VAL CA A 58 VAL C 1.0 -89.9 -37.5 PHI 95 95 A 58 VAL N A 58 VAL CA A 58 VAL C A 59 GLY N 1.0 -60.6 -15.3 PSI 96 96 A 58 VAL C A 59 GLY N A 59 GLY CA A 59 GLY C 1.0 68.3 105.1 PHI 97 97 A 59 GLY N A 59 GLY CA A 59 GLY C A 60 SER N 1.0 -20.8 24.8 PSI 98 98 A 59 GLY C A 60 SER N A 60 SER CA A 60 SER C 1.0 -190.0 -20.0 PHI 99 99 A 60 SER C A 61 VAL N A 61 VAL CA A 61 VAL C 1.0 -190.0 -20.0 PHI 100 100 A 61 VAL C A 62 GLY N A 62 GLY CA A 62 GLY C 1.0 51.7 107.8 PHI 101 101 A 62 GLY N A 62 GLY CA A 62 GLY C A 63 LEU N 1.0 -14.0 38.8 PSI 102 102 A 62 GLY C A 63 LEU N A 63 LEU CA A 63 LEU C 1.0 -104.8 -65.8 PHI 103 103 A 63 LEU N A 63 LEU CA A 63 LEU C A 64 ARG N 1.0 108.3 180.9 PSI 104 104 A 63 LEU C A 64 ARG N A 64 ARG CA A 64 ARG C 1.0 -150.6 -77.7 PHI 105 105 A 64 ARG N A 64 ARG CA A 64 ARG C A 65 GLU N 1.0 117.6 173.3 PSI 106 106 A 64 ARG C A 65 GLU N A 65 GLU CA A 65 GLU C 1.0 -111.8 -53.5 PHI 107 107 A 65 GLU C A 66 ILE N A 66 ILE CA A 66 ILE C 1.0 -190.0 -20.0 PHI 108 108 A 66 ILE C A 67 ILE N A 67 ILE CA A 67 ILE C 1.0 -190.0 -20.0 PHI 109 109 A 67 ILE C A 68 SER N A 68 SER CA A 68 SER C 1.0 -190.0 -20.0 PHI 110 110 A 68 SER C A 69 GLU N A 69 GLU CA A 69 GLU C 1.0 -190.0 -20.0 PHI 111 111 A 69 GLU C A 70 GLU N A 70 GLU CA A 70 GLU C 1.0 -190.0 -20.0 PHI stop_ save_