data_nef_c25744_2n5z 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 PDB 2N5Z stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 15 CYS SG 1 76 CYS SG stop_ 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 GLY start . false 2 A 2 ALA middle . . 3 A 3 MET middle . . 4 A 4 GLY middle . false 5 A 5 PRO middle . false 6 A 6 SER middle . . 7 A 7 PRO middle . false 8 A 8 ASN middle . . 9 A 9 TRP middle . . 10 A 10 ASP middle . . 11 A 11 ALA middle . . 12 A 12 VAL middle . . 13 A 13 ALA middle . . 14 A 14 GLN middle . . 15 A 15 CYS middle -HG . 16 A 16 GLU middle . . 17 A 17 SER middle . . 18 A 18 GLY middle . false 19 A 19 GLY middle . false 20 A 20 ASN middle . . 21 A 21 TRP middle . . 22 A 22 ALA middle . . 23 A 23 ALA middle . . 24 A 24 ASN middle . . 25 A 25 THR middle . . 26 A 26 GLY middle . false 27 A 27 ASN middle . . 28 A 28 GLY middle . false 29 A 29 LYS middle . . 30 A 30 TYR middle . . 31 A 31 GLY middle . false 32 A 32 GLY middle . false 33 A 33 LEU middle . . 34 A 34 GLN middle . . 35 A 35 PHE middle . . 36 A 36 LYS middle . . 37 A 37 PRO middle . false 38 A 38 ALA middle . . 39 A 39 THR middle . . 40 A 40 TRP middle . . 41 A 41 ALA middle . . 42 A 42 ALA middle . . 43 A 43 PHE middle . . 44 A 44 GLY middle . false 45 A 45 GLY middle . false 46 A 46 VAL middle . . 47 A 47 GLY middle . false 48 A 48 ASN middle . . 49 A 49 PRO middle . false 50 A 50 ALA middle . . 51 A 51 ALA middle . . 52 A 52 ALA middle . . 53 A 53 SER middle . . 54 A 54 ARG middle . . 55 A 55 GLU middle . . 56 A 56 GLN middle . . 57 A 57 GLN middle . . 58 A 58 ILE middle . . 59 A 59 ALA middle . . 60 A 60 VAL middle . . 61 A 61 ALA middle . . 62 A 62 ASN middle . . 63 A 63 ARG middle . . 64 A 64 VAL middle . . 65 A 65 LEU middle . . 66 A 66 ALA middle . . 67 A 67 GLU middle . . 68 A 68 GLN middle . . 69 A 69 GLY middle . false 70 A 70 LEU middle . . 71 A 71 ASP middle . . 72 A 72 ALA middle . . 73 A 73 TRP middle . . 74 A 74 PRO middle . false 75 A 75 THR middle . . 76 A 76 CYS middle -HG . 77 A 77 GLY middle . false 78 A 78 ALA middle . . 79 A 79 ALA middle . . 80 A 80 SER middle . . 81 A 81 GLY middle . false 82 A 82 LEU 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 4 GLY H H 1 8.067 0.020 A 4 GLY HAy H 1 4.053 0.020 A 4 GLY HAx H 1 3.955 0.020 A 4 GLY CA C 13 44.519 0.3 A 4 GLY N N 15 110.205 0.3 A 5 PRO HA H 1 4.342 0.020 A 5 PRO HBy H 1 2.138 0.020 A 5 PRO HBx H 1 1.713 0.020 A 5 PRO HD2 H 1 3.494 0.020 A 5 PRO HD3 H 1 3.494 0.020 A 5 PRO HG2 H 1 1.886 0.020 A 5 PRO HG3 H 1 1.886 0.020 A 5 PRO CA C 13 63.030 0.3 A 5 PRO CB C 13 32.458 0.3 A 5 PRO CD C 13 49.778 0.3 A 5 PRO CG C 13 27.213 0.3 A 6 SER H H 1 8.304 0.020 A 6 SER HA H 1 4.612 0.020 A 6 SER HBy H 1 3.769 0.020 A 6 SER HBx H 1 3.662 0.020 A 6 SER CA C 13 56.015 0.3 A 6 SER CB C 13 63.363 0.3 A 6 SER N N 15 116.630 0.3 A 7 PRO HA H 1 3.807 0.020 A 7 PRO HBx H 1 1.064 0.020 A 7 PRO HBy H 1 1.064 0.020 A 7 PRO HDy H 1 3.546 0.020 A 7 PRO HDx H 1 3.483 0.020 A 7 PRO HG2 H 1 1.495 0.020 A 7 PRO HG3 H 1 1.495 0.020 A 7 PRO CA C 13 62.430 0.3 A 7 PRO CB C 13 30.960 0.3 A 7 PRO CD C 13 50.683 0.3 A 7 PRO CG C 13 27.438 0.3 A 8 ASN H H 1 8.667 0.020 A 8 ASN HA H 1 4.600 0.020 A 8 ASN HBy H 1 3.084 0.020 A 8 ASN HBx H 1 2.539 0.020 A 8 ASN CA C 13 50.800 0.3 A 8 ASN CB C 13 36.222 0.3 A 8 ASN N N 15 120.122 0.3 A 9 TRP H H 1 7.691 0.020 A 9 TRP HA H 1 4.317 0.020 A 9 TRP HBy H 1 3.224 0.020 A 9 TRP HBx H 1 2.987 0.020 A 9 TRP HD1 H 1 7.247 0.020 A 9 TRP HE1 H 1 9.925 0.020 A 9 TRP HE3 H 1 7.451 0.020 A 9 TRP HH2 H 1 6.788 0.020 A 9 TRP HZ2 H 1 7.144 0.020 A 9 TRP HZ3 H 1 6.632 0.020 A 9 TRP CA C 13 59.215 0.3 A 9 TRP CB C 13 30.780 0.3 A 9 TRP CD1 C 13 131.209 0.3 A 9 TRP CE3 C 13 123.440 0.3 A 9 TRP CH2 C 13 122.580 0.3 A 9 TRP CZ2 C 13 117.444 0.3 A 9 TRP CZ3 C 13 126.792 0.3 A 9 TRP N N 15 123.684 0.3 A 10 ASP H H 1 8.320 0.020 A 10 ASP HA H 1 4.593 0.020 A 10 ASP HBy H 1 2.695 0.020 A 10 ASP HBx H 1 2.559 0.020 A 10 ASP CA C 13 58.622 0.3 A 10 ASP CB C 13 40.844 0.3 A 10 ASP N N 15 118.132 0.3 A 11 ALA H H 1 7.395 0.020 A 11 ALA HA H 1 4.041 0.020 A 11 ALA HB% H 1 1.206 0.020 A 11 ALA CA C 13 54.593 0.3 A 11 ALA CB C 13 18.681 0.3 A 11 ALA N N 15 124.299 0.3 A 12 VAL H H 1 7.464 0.020 A 12 VAL HA H 1 3.328 0.020 A 12 VAL HB H 1 1.936 0.020 A 12 VAL HGx% H 1 0.596 0.020 A 12 VAL HGy% H 1 0.269 0.020 A 12 VAL CA C 13 66.682 0.3 A 12 VAL CB C 13 31.481 0.3 A 12 VAL CG1 C 13 21.288 0.3 A 12 VAL CG2 C 13 20.450 0.3 A 12 VAL N N 15 120.997 0.3 A 13 ALA H H 1 8.523 0.020 A 13 ALA HA H 1 3.854 0.020 A 13 ALA HB% H 1 0.489 0.020 A 13 ALA CA C 13 54.711 0.3 A 13 ALA CB C 13 18.918 0.3 A 13 ALA N N 15 121.205 0.3 A 14 GLN H H 1 8.046 0.020 A 14 GLN HA H 1 3.507 0.020 A 14 GLN HBy H 1 2.050 0.020 A 14 GLN HBx H 1 1.974 0.020 A 14 GLN HGy H 1 2.340 0.020 A 14 GLN HGx H 1 2.197 0.020 A 14 GLN CA C 13 58.978 0.3 A 14 GLN CB C 13 27.689 0.3 A 14 GLN CG C 13 33.018 0.3 A 14 GLN N N 15 120.926 0.3 A 15 CYS H H 1 7.108 0.020 A 15 CYS HA H 1 4.130 0.020 A 15 CYS HBy H 1 3.230 0.020 A 15 CYS HBx H 1 2.948 0.020 A 15 CYS CA C 13 59.334 0.3 A 15 CYS CB C 13 35.748 0.3 A 15 CYS N N 15 118.916 0.3 A 16 GLU H H 1 8.776 0.020 A 16 GLU HA H 1 4.020 0.020 A 16 GLU HBy H 1 1.809 0.020 A 16 GLU HBx H 1 1.654 0.020 A 16 GLU HGy H 1 2.138 0.020 A 16 GLU HGx H 1 1.823 0.020 A 16 GLU CA C 13 58.978 0.3 A 16 GLU CB C 13 30.051 0.3 A 16 GLU CG C 13 36.055 0.3 A 16 GLU N N 15 120.227 0.3 A 17 SER H H 1 8.467 0.020 A 17 SER HA H 1 4.551 0.020 A 17 SER HB2 H 1 3.956 0.020 A 17 SER HB3 H 1 3.956 0.020 A 17 SER CA C 13 57.771 0.3 A 17 SER CB C 13 66.563 0.3 A 17 SER N N 15 109.577 0.3 A 18 GLY H H 1 7.598 0.020 A 18 GLY HA2 H 1 3.935 0.020 A 18 GLY HA3 H 1 3.935 0.020 A 18 GLY CA C 13 46.652 0.3 A 18 GLY N N 15 113.669 0.3 A 19 GLY H H 1 7.476 0.020 A 19 GLY HAy H 1 3.867 0.020 A 19 GLY HAx H 1 2.715 0.020 A 19 GLY CA C 13 45.467 0.3 A 19 GLY N N 15 106.884 0.3 A 20 ASN H H 1 6.580 0.020 A 20 ASN HA H 1 4.764 0.020 A 20 ASN HBy H 1 2.766 0.020 A 20 ASN HBx H 1 2.540 0.020 A 20 ASN CA C 13 50.445 0.3 A 20 ASN CB C 13 38.510 0.3 A 20 ASN N N 15 116.428 0.3 A 21 TRP H H 1 8.262 0.020 A 21 TRP HA H 1 3.794 0.020 A 21 TRP HBy H 1 3.380 0.020 A 21 TRP HBx H 1 3.014 0.020 A 21 TRP HD1 H 1 7.397 0.020 A 21 TRP HE3 H 1 7.636 0.020 A 21 TRP HH2 H 1 6.617 0.020 A 21 TRP HZ2 H 1 7.531 0.020 A 21 TRP HZ3 H 1 7.135 0.020 A 21 TRP CA C 13 60.400 0.3 A 21 TRP CB C 13 27.689 0.3 A 21 TRP CD1 C 13 131.163 0.3 A 21 TRP CE3 C 13 122.370 0.3 A 21 TRP CH2 C 13 128.215 0.3 A 21 TRP CZ2 C 13 118.031 0.3 A 21 TRP CZ3 C 13 124.083 0.3 A 21 TRP N N 15 124.313 0.3 A 22 ALA H H 1 7.668 0.020 A 22 ALA HA H 1 5.226 0.020 A 22 ALA HB% H 1 1.338 0.020 A 22 ALA CA C 13 50.208 0.3 A 22 ALA CB C 13 19.037 0.3 A 22 ALA N N 15 120.192 0.3 A 23 ALA H H 1 6.929 0.020 A 23 ALA HA H 1 3.707 0.020 A 23 ALA HB% H 1 1.224 0.020 A 23 ALA CA C 13 54.711 0.3 A 23 ALA CB C 13 18.701 0.3 A 23 ALA N N 15 121.314 0.3 A 24 ASN H H 1 8.678 0.020 A 24 ASN HA H 1 4.630 0.020 A 24 ASN HBy H 1 2.869 0.020 A 24 ASN HBx H 1 2.674 0.020 A 24 ASN CA C 13 52.459 0.3 A 24 ASN CB C 13 37.170 0.3 A 24 ASN N N 15 119.494 0.3 A 25 THR H H 1 9.174 0.020 A 25 THR HA H 1 4.240 0.020 A 25 THR HB H 1 4.407 0.020 A 25 THR HG2% H 1 1.057 0.020 A 25 THR CA C 13 61.941 0.3 A 25 THR CB C 13 69.171 0.3 A 25 THR CG2 C 13 21.195 0.3 A 25 THR N N 15 113.697 0.3 A 26 GLY H H 1 8.381 0.020 A 26 GLY HAy H 1 4.180 0.020 A 26 GLY HAx H 1 3.809 0.020 A 26 GLY CA C 13 45.822 0.3 A 26 GLY N N 15 110.554 0.3 A 27 ASN H H 1 7.718 0.020 A 27 ASN HA H 1 4.541 0.020 A 27 ASN HBy H 1 3.089 0.020 A 27 ASN HBx H 1 2.498 0.020 A 27 ASN CA C 13 51.985 0.3 A 27 ASN CB C 13 37.436 0.3 A 27 ASN N N 15 118.272 0.3 A 28 GLY H H 1 8.287 0.020 A 28 GLY HAy H 1 3.956 0.020 A 28 GLY HAx H 1 3.470 0.020 A 28 GLY CA C 13 45.348 0.3 A 28 GLY N N 15 108.669 0.3 A 29 LYS H H 1 7.256 0.020 A 29 LYS HA H 1 4.666 0.020 A 29 LYS HBy H 1 1.152 0.020 A 29 LYS HBx H 1 0.756 0.020 A 29 LYS HE2 H 1 2.789 0.020 A 29 LYS HE3 H 1 2.789 0.020 A 29 LYS HG2 H 1 0.952 0.020 A 29 LYS HG3 H 1 0.952 0.020 A 29 LYS CA C 13 54.119 0.3 A 29 LYS CB C 13 35.184 0.3 A 29 LYS CD C 13 28.531 0.3 A 29 LYS CE C 13 41.887 0.3 A 29 LYS CG C 13 24.957 0.3 A 29 LYS N N 15 116.881 0.3 A 30 TYR H H 1 8.421 0.020 A 30 TYR HA H 1 4.956 0.020 A 30 TYR HBy H 1 2.863 0.020 A 30 TYR HBx H 1 2.135 0.020 A 30 TYR HD1 H 1 6.881 0.020 A 30 TYR HD2 H 1 6.881 0.020 A 30 TYR HE1 H 1 6.620 0.020 A 30 TYR HE2 H 1 6.620 0.020 A 30 TYR CA C 13 58.148 0.3 A 30 TYR CB C 13 44.163 0.3 A 30 TYR CD1 C 13 135.866 0.3 A 30 TYR CD2 C 13 135.866 0.3 A 30 TYR CE1 C 13 121.110 0.3 A 30 TYR CE2 C 13 121.110 0.3 A 30 TYR N N 15 115.548 0.3 A 31 GLY H H 1 9.969 0.020 A 31 GLY HA2 H 1 4.031 0.020 A 31 GLY HA3 H 1 4.031 0.020 A 31 GLY CA C 13 44.767 0.3 A 31 GLY N N 15 110.774 0.3 A 32 GLY H H 1 9.008 0.020 A 32 GLY HAy H 1 3.611 0.020 A 32 GLY HAx H 1 2.290 0.020 A 32 GLY CA C 13 46.193 0.3 A 32 GLY N N 15 109.262 0.3 A 33 LEU H H 1 7.843 0.020 A 33 LEU HA H 1 3.984 0.020 A 33 LEU HBy H 1 1.471 0.020 A 33 LEU HBx H 1 1.229 0.020 A 33 LEU HDx% H 1 0.500 0.020 A 33 LEU HDy% H 1 0.442 0.020 A 33 LEU HG H 1 0.504 0.020 A 33 LEU CA C 13 52.815 0.3 A 33 LEU CB C 13 41.556 0.3 A 33 LEU CD1 C 13 23.168 0.3 A 33 LEU CD2 C 13 21.906 0.3 A 33 LEU CG C 13 26.969 0.3 A 33 LEU N N 15 115.269 0.3 A 34 GLN H H 1 7.321 0.020 A 34 GLN HA H 1 3.153 0.020 A 34 GLN HBy H 1 2.082 0.020 A 34 GLN HBx H 1 1.703 0.020 A 34 GLN HG2 H 1 2.179 0.020 A 34 GLN HG3 H 1 2.179 0.020 A 34 GLN CA C 13 55.304 0.3 A 34 GLN CB C 13 27.333 0.3 A 34 GLN CG C 13 35.393 0.3 A 34 GLN N N 15 112.176 0.3 A 35 PHE H H 1 7.708 0.020 A 35 PHE HA H 1 4.352 0.020 A 35 PHE HBy H 1 3.085 0.020 A 35 PHE HBx H 1 2.468 0.020 A 35 PHE HD1 H 1 7.571 0.020 A 35 PHE HD2 H 1 7.571 0.020 A 35 PHE HE1 H 1 7.420 0.020 A 35 PHE HE2 H 1 7.420 0.020 A 35 PHE CA C 13 59.334 0.3 A 35 PHE CB C 13 41.793 0.3 A 35 PHE CD1 C 13 135.409 0.3 A 35 PHE CD2 C 13 135.409 0.3 A 35 PHE CE1 C 13 134.551 0.3 A 35 PHE CE2 C 13 134.551 0.3 A 35 PHE N N 15 116.246 0.3 A 36 LYS H H 1 9.110 0.020 A 36 LYS HA H 1 5.006 0.020 A 36 LYS HBy H 1 2.153 0.020 A 36 LYS HBx H 1 1.872 0.020 A 36 LYS HD2 H 1 1.710 0.020 A 36 LYS HD3 H 1 1.710 0.020 A 36 LYS HE2 H 1 2.950 0.020 A 36 LYS HE3 H 1 2.950 0.020 A 36 LYS HGy H 1 1.713 0.020 A 36 LYS HGx H 1 1.517 0.020 A 36 LYS CA C 13 54.711 0.3 A 36 LYS CB C 13 32.193 0.3 A 36 LYS CD C 13 29.686 0.3 A 36 LYS CE C 13 41.915 0.3 A 36 LYS CG C 13 26.172 0.3 A 36 LYS N N 15 122.039 0.3 A 37 PRO HA H 1 4.033 0.020 A 37 PRO HBy H 1 2.293 0.020 A 37 PRO HBx H 1 2.025 0.020 A 37 PRO HDy H 1 4.237 0.020 A 37 PRO HDx H 1 4.040 0.020 A 37 PRO HGy H 1 2.321 0.020 A 37 PRO HGx H 1 1.816 0.020 A 37 PRO CA C 13 66.626 0.3 A 37 PRO CB C 13 32.234 0.3 A 37 PRO CD C 13 50.966 0.3 A 37 PRO CG C 13 28.937 0.3 A 39 THR H H 1 7.046 0.020 A 39 THR HA H 1 4.077 0.020 A 39 THR HB H 1 4.379 0.020 A 39 THR HG2% H 1 1.334 0.020 A 39 THR CA C 13 65.971 0.3 A 39 THR CB C 13 69.550 0.3 A 39 THR CG2 C 13 22.552 0.3 A 39 THR N N 15 115.976 0.3 A 40 TRP H H 1 7.810 0.020 A 40 TRP HA H 1 3.727 0.020 A 40 TRP HBy H 1 3.324 0.020 A 40 TRP HBx H 1 2.688 0.020 A 40 TRP HD1 H 1 7.023 0.020 A 40 TRP HE3 H 1 5.873 0.020 A 40 TRP HH2 H 1 6.739 0.020 A 40 TRP HZ2 H 1 7.227 0.020 A 40 TRP HZ3 H 1 6.561 0.020 A 40 TRP CA C 13 60.163 0.3 A 40 TRP CB C 13 30.317 0.3 A 40 TRP CD1 C 13 131.249 0.3 A 40 TRP CE3 C 13 123.637 0.3 A 40 TRP CH2 C 13 124.107 0.3 A 40 TRP CZ2 C 13 117.398 0.3 A 40 TRP CZ3 C 13 126.802 0.3 A 40 TRP N N 15 120.053 0.3 A 41 ALA H H 1 8.117 0.020 A 41 ALA HA H 1 4.058 0.020 A 41 ALA HB% H 1 1.397 0.020 A 41 ALA CA C 13 54.119 0.3 A 41 ALA CB C 13 18.800 0.3 A 41 ALA N N 15 117.049 0.3 A 42 ALA H H 1 7.678 0.020 A 42 ALA HA H 1 3.882 0.020 A 42 ALA HB% H 1 1.294 0.020 A 42 ALA CA C 13 53.408 0.3 A 42 ALA CB C 13 18.020 0.3 A 42 ALA N N 15 120.416 0.3 A 43 PHE H H 1 7.044 0.020 A 43 PHE HA H 1 4.439 0.020 A 43 PHE HBy H 1 3.326 0.020 A 43 PHE HBx H 1 2.280 0.020 A 43 PHE HD1 H 1 7.411 0.020 A 43 PHE HD2 H 1 7.411 0.020 A 43 PHE HE1 H 1 7.163 0.020 A 43 PHE HE2 H 1 7.163 0.020 A 43 PHE CA C 13 57.911 0.3 A 43 PHE CB C 13 38.711 0.3 A 43 PHE CD1 C 13 135.645 0.3 A 43 PHE CD2 C 13 135.645 0.3 A 43 PHE CE1 C 13 131.608 0.3 A 43 PHE CE2 C 13 131.608 0.3 A 43 PHE N N 15 113.805 0.3 A 44 GLY H H 1 7.099 0.020 A 44 GLY HAy H 1 3.793 0.020 A 44 GLY HAx H 1 3.442 0.020 A 44 GLY CA C 13 45.963 0.3 A 44 GLY N N 15 104.034 0.3 A 45 GLY H H 1 8.015 0.020 A 45 GLY HAy H 1 2.584 0.020 A 45 GLY HAx H 1 2.558 0.020 A 45 GLY CA C 13 44.622 0.3 A 45 GLY N N 15 110.240 0.3 A 46 VAL H H 1 7.854 0.020 A 46 VAL HA H 1 4.236 0.020 A 46 VAL HB H 1 1.833 0.020 A 46 VAL HGx% H 1 0.785 0.020 A 46 VAL HGy% H 1 0.741 0.020 A 46 VAL CA C 13 60.910 0.3 A 46 VAL CB C 13 34.444 0.3 A 46 VAL CG1 C 13 20.462 0.3 A 46 VAL CG2 C 13 20.862 0.3 A 46 VAL N N 15 122.532 0.3 A 47 GLY HAy H 1 3.893 0.020 A 47 GLY HAx H 1 3.744 0.020 A 47 GLY CA C 13 45.230 0.3 A 47 GLY N N 15 114.605 0.3 A 48 ASN H H 1 8.500 0.020 A 48 ASN HA H 1 4.083 0.020 A 48 ASN HBy H 1 2.508 0.020 A 48 ASN HBx H 1 2.082 0.020 A 48 ASN CA C 13 57.494 0.3 A 48 ASN CB C 13 31.011 0.3 A 48 ASN N N 15 121.458 0.3 A 49 PRO HA H 1 2.839 0.020 A 49 PRO HBy H 1 1.041 0.020 A 49 PRO HBx H 1 0.535 0.020 A 49 PRO HDy H 1 3.180 0.020 A 49 PRO HDx H 1 2.641 0.020 A 49 PRO HGy H 1 1.040 0.020 A 49 PRO HGx H 1 -0.048 0.020 A 49 PRO CA C 13 64.978 0.3 A 49 PRO CB C 13 30.885 0.3 A 49 PRO CD C 13 49.388 0.3 A 49 PRO CG C 13 24.890 0.3 A 50 ALA H H 1 7.787 0.020 A 50 ALA HA H 1 4.135 0.020 A 50 ALA HB% H 1 1.325 0.020 A 50 ALA CA C 13 53.171 0.3 A 50 ALA CB C 13 18.404 0.3 A 50 ALA N N 15 110.593 0.3 A 51 ALA H H 1 7.436 0.020 A 51 ALA HA H 1 4.349 0.020 A 51 ALA HB% H 1 1.364 0.020 A 51 ALA CA C 13 51.037 0.3 A 51 ALA CB C 13 19.507 0.3 A 51 ALA N N 15 118.962 0.3 A 52 ALA H H 1 7.080 0.020 A 52 ALA HA H 1 4.520 0.020 A 52 ALA HB% H 1 1.713 0.020 A 52 ALA CA C 13 50.682 0.3 A 52 ALA CB C 13 20.654 0.3 A 52 ALA N N 15 122.852 0.3 A 53 SER H H 1 8.916 0.020 A 53 SER HA H 1 4.255 0.020 A 53 SER HBy H 1 4.260 0.020 A 53 SER HBx H 1 4.002 0.020 A 53 SER CA C 13 57.437 0.3 A 53 SER CB C 13 64.914 0.3 A 53 SER N N 15 119.459 0.3 A 54 ARG H H 1 8.791 0.020 A 54 ARG HA H 1 3.183 0.020 A 54 ARG HB2 H 1 0.906 0.020 A 54 ARG HB3 H 1 0.906 0.020 A 54 ARG HD2 H 1 2.115 0.020 A 54 ARG HD3 H 1 2.115 0.020 A 54 ARG HG2 H 1 0.334 0.020 A 54 ARG HG3 H 1 0.334 0.020 A 54 ARG CA C 13 59.334 0.3 A 54 ARG CB C 13 29.111 0.3 A 54 ARG CD C 13 42.945 0.3 A 54 ARG CG C 13 25.685 0.3 A 54 ARG N N 15 122.357 0.3 A 55 GLU H H 1 8.214 0.020 A 55 GLU HA H 1 3.562 0.020 A 55 GLU HB2 H 1 1.896 0.020 A 55 GLU HB3 H 1 1.896 0.020 A 55 GLU HGy H 1 2.300 0.020 A 55 GLU HGx H 1 1.993 0.020 A 55 GLU CA C 13 61.348 0.3 A 55 GLU CB C 13 28.756 0.3 A 55 GLU CG C 13 37.700 0.3 A 55 GLU N N 15 114.989 0.3 A 56 GLN H H 1 7.975 0.020 A 56 GLN HA H 1 4.041 0.020 A 56 GLN HBy H 1 2.435 0.020 A 56 GLN HBx H 1 2.051 0.020 A 56 GLN HG2 H 1 2.430 0.020 A 56 GLN HG3 H 1 2.430 0.020 A 56 GLN CA C 13 58.504 0.3 A 56 GLN CB C 13 29.704 0.3 A 56 GLN CG C 13 34.121 0.3 A 56 GLN N N 15 121.065 0.3 A 57 GLN H H 1 8.492 0.020 A 57 GLN HA H 1 4.486 0.020 A 57 GLN HB2 H 1 2.505 0.020 A 57 GLN HB3 H 1 2.505 0.020 A 57 GLN HGy H 1 2.749 0.020 A 57 GLN HGx H 1 2.287 0.020 A 57 GLN CA C 13 60.400 0.3 A 57 GLN CB C 13 30.178 0.3 A 57 GLN CG C 13 36.797 0.3 A 57 GLN N N 15 120.192 0.3 A 58 ILE H H 1 8.347 0.020 A 58 ILE HA H 1 2.874 0.020 A 58 ILE HB H 1 1.491 0.020 A 58 ILE HD1% H 1 0.609 0.020 A 58 ILE HG12 H 1 1.564 0.020 A 58 ILE HG13 H 1 1.564 0.020 A 58 ILE HG2% H 1 0.676 0.020 A 58 ILE CA C 13 65.952 0.3 A 58 ILE CB C 13 37.747 0.3 A 58 ILE CD1 C 13 13.656 0.3 A 58 ILE CG1 C 13 30.399 0.3 A 58 ILE CG2 C 13 16.650 0.3 A 58 ILE N N 15 120.157 0.3 A 59 ALA H H 1 7.657 0.020 A 59 ALA HA H 1 4.038 0.020 A 59 ALA HB% H 1 1.334 0.020 A 59 ALA CA C 13 55.304 0.3 A 59 ALA CB C 13 17.970 0.3 A 59 ALA N N 15 121.345 0.3 A 60 VAL H H 1 7.144 0.020 A 60 VAL HA H 1 3.400 0.020 A 60 VAL HB H 1 1.744 0.020 A 60 VAL HGx% H 1 0.373 0.020 A 60 VAL HGy% H 1 -0.170 0.020 A 60 VAL CA C 13 66.208 0.3 A 60 VAL CB C 13 31.481 0.3 A 60 VAL CG1 C 13 21.326 0.3 A 60 VAL CG2 C 13 20.851 0.3 A 60 VAL N N 15 117.152 0.3 A 61 ALA H H 1 8.225 0.020 A 61 ALA HB% H 1 0.284 0.020 A 61 ALA CA C 13 56.371 0.3 A 61 ALA CB C 13 16.482 0.3 A 61 ALA N N 15 123.936 0.3 A 62 ASN H H 1 8.500 0.020 A 62 ASN HA H 1 4.806 0.020 A 62 ASN HBy H 1 2.798 0.020 A 62 ASN HBx H 1 2.729 0.020 A 62 ASN CA C 13 56.845 0.3 A 62 ASN CB C 13 38.356 0.3 A 62 ASN N N 15 114.116 0.3 A 63 ARG H H 1 7.474 0.020 A 63 ARG HA H 1 4.201 0.020 A 63 ARG HBy H 1 2.291 0.020 A 63 ARG HBx H 1 2.099 0.020 A 63 ARG HD2 H 1 3.272 0.020 A 63 ARG HD3 H 1 3.272 0.020 A 63 ARG HG2 H 1 1.993 0.020 A 63 ARG HG3 H 1 1.993 0.020 A 63 ARG CA C 13 59.926 0.3 A 63 ARG CB C 13 30.889 0.3 A 63 ARG CD C 13 44.151 0.3 A 63 ARG CG C 13 28.537 0.3 A 63 ARG N N 15 122.173 0.3 A 64 VAL H H 1 8.107 0.020 A 64 VAL HA H 1 2.276 0.020 A 64 VAL HB H 1 1.426 0.020 A 64 VAL HGx% H 1 0.472 0.020 A 64 VAL HGy% H 1 0.485 0.020 A 64 VAL CA C 13 65.852 0.3 A 64 VAL CB C 13 31.718 0.3 A 64 VAL CG1 C 13 22.080 0.3 A 64 VAL CG2 C 13 21.020 0.3 A 64 VAL N N 15 121.659 0.3 A 65 LEU H H 1 8.948 0.020 A 65 LEU HA H 1 4.353 0.020 A 65 LEU HB2 H 1 2.211 0.020 A 65 LEU HB3 H 1 2.211 0.020 A 65 LEU HDx% H 1 0.869 0.020 A 65 LEU HDy% H 1 0.502 0.020 A 65 LEU HG H 1 1.603 0.020 A 65 LEU CA C 13 57.556 0.3 A 65 LEU CB C 13 43.333 0.3 A 65 LEU CD1 C 13 23.795 0.3 A 65 LEU CD2 C 13 19.502 0.3 A 65 LEU CG C 13 27.039 0.3 A 65 LEU N N 15 120.681 0.3 A 66 ALA H H 1 7.390 0.020 A 66 ALA HA H 1 4.075 0.020 A 66 ALA HB% H 1 1.552 0.020 A 66 ALA CA C 13 54.830 0.3 A 66 ALA CB C 13 19.155 0.3 A 66 ALA N N 15 118.509 0.3 A 67 GLU H H 1 7.369 0.020 A 67 GLU HA H 1 4.490 0.020 A 67 GLU HBy H 1 2.220 0.020 A 67 GLU HBx H 1 2.127 0.020 A 67 GLU HGy H 1 2.465 0.020 A 67 GLU HGx H 1 2.385 0.020 A 67 GLU CA C 13 57.700 0.3 A 67 GLU CB C 13 32.531 0.3 A 67 GLU CG C 13 36.850 0.3 A 67 GLU N N 15 114.309 0.3 A 68 GLN H H 1 8.914 0.020 A 68 GLN HA H 1 4.519 0.020 A 68 GLN HBy H 1 2.091 0.020 A 68 GLN HBx H 1 1.833 0.020 A 68 GLN HGy H 1 2.332 0.020 A 68 GLN HGx H 1 2.246 0.020 A 68 GLN CA C 13 55.778 0.3 A 68 GLN CB C 13 30.889 0.3 A 68 GLN CG C 13 34.258 0.3 A 68 GLN N N 15 116.281 0.3 A 69 GLY H H 1 8.134 0.020 A 69 GLY HAy H 1 4.172 0.020 A 69 GLY HAx H 1 3.927 0.020 A 69 GLY CA C 13 45.941 0.3 A 69 GLY N N 15 109.577 0.3 A 70 LEU H H 1 8.519 0.020 A 70 LEU HA H 1 4.448 0.020 A 70 LEU HBy H 1 1.840 0.020 A 70 LEU HBx H 1 1.613 0.020 A 70 LEU HDx% H 1 0.526 0.020 A 70 LEU HDy% H 1 0.375 0.020 A 70 LEU HG H 1 1.587 0.020 A 70 LEU CA C 13 54.522 0.3 A 70 LEU CB C 13 41.954 0.3 A 70 LEU CD1 C 13 23.633 0.3 A 70 LEU CD2 C 13 22.769 0.3 A 70 LEU CG C 13 25.533 0.3 A 70 LEU N N 15 121.331 0.3 A 71 ASP H H 1 7.718 0.020 A 71 ASP HA H 1 4.093 0.020 A 71 ASP HB2 H 1 2.524 0.020 A 71 ASP HB3 H 1 2.524 0.020 A 71 ASP CA C 13 57.082 0.3 A 71 ASP CB C 13 40.844 0.3 A 71 ASP N N 15 120.681 0.3 A 72 ALA H H 1 8.009 0.020 A 72 ALA HA H 1 3.654 0.020 A 72 ALA HB% H 1 0.105 0.020 A 72 ALA CA C 13 53.289 0.3 A 72 ALA CB C 13 15.885 0.3 A 72 ALA N N 15 119.110 0.3 A 73 TRP H H 1 7.791 0.020 A 73 TRP HA H 1 4.845 0.020 A 73 TRP HBy H 1 2.980 0.020 A 73 TRP HBx H 1 2.925 0.020 A 73 TRP HD1 H 1 7.363 0.020 A 73 TRP HE3 H 1 7.200 0.020 A 73 TRP HH2 H 1 6.909 0.020 A 73 TRP HZ2 H 1 6.560 0.020 A 73 TRP HZ3 H 1 6.805 0.020 A 73 TRP CA C 13 56.963 0.3 A 73 TRP CB C 13 28.163 0.3 A 73 TRP CD1 C 13 130.906 0.3 A 73 TRP CE3 C 13 134.129 0.3 A 73 TRP CH2 C 13 126.115 0.3 A 73 TRP CZ2 C 13 116.321 0.3 A 73 TRP CZ3 C 13 125.025 0.3 A 73 TRP N N 15 117.503 0.3 A 74 PRO HA H 1 4.309 0.020 A 74 PRO HB2 H 1 1.935 0.020 A 74 PRO HB3 H 1 1.935 0.020 A 74 PRO HDy H 1 3.652 0.020 A 74 PRO HDx H 1 3.334 0.020 A 74 PRO HG2 H 1 1.968 0.020 A 74 PRO HG3 H 1 1.968 0.020 A 74 PRO CA C 13 65.586 0.3 A 74 PRO CB C 13 32.234 0.3 A 74 PRO CD C 13 50.225 0.3 A 74 PRO CG C 13 27.513 0.3 A 75 THR H H 1 8.197 0.020 A 75 THR HA H 1 4.409 0.020 A 75 THR HB H 1 4.141 0.020 A 75 THR HG2% H 1 1.081 0.020 A 75 THR CA C 13 63.482 0.3 A 75 THR CB C 13 68.815 0.3 A 75 THR CG2 C 13 22.343 0.3 A 75 THR N N 15 111.008 0.3 A 76 CYS H H 1 8.144 0.020 A 76 CYS HA H 1 4.853 0.020 A 76 CYS HBy H 1 3.440 0.020 A 76 CYS HBx H 1 3.191 0.020 A 76 CYS CA C 13 54.853 0.3 A 76 CYS CB C 13 39.280 0.3 A 76 CYS N N 15 119.131 0.3 A 77 GLY H H 1 8.774 0.020 A 77 GLY HAy H 1 4.153 0.020 A 77 GLY HAx H 1 3.593 0.020 A 77 GLY CA C 13 48.430 0.3 A 77 GLY N N 15 110.834 0.3 A 78 ALA H H 1 8.142 0.020 A 78 ALA HA H 1 4.138 0.020 A 78 ALA HB% H 1 1.282 0.020 A 78 ALA CA C 13 53.882 0.3 A 78 ALA CB C 13 18.563 0.3 A 78 ALA N N 15 123.300 0.3 A 80 SER H H 1 7.742 0.020 A 80 SER HA H 1 3.762 0.020 A 80 SER HBy H 1 3.423 0.020 A 80 SER HBx H 1 3.194 0.020 A 80 SER CA C 13 59.723 0.3 A 80 SER CB C 13 63.648 0.3 A 80 SER N N 15 111.423 0.3 A 81 GLY H H 1 7.562 0.020 A 81 GLY HAy H 1 3.945 0.020 A 81 GLY HAx H 1 3.715 0.020 A 81 GLY CA C 13 45.430 0.3 A 81 GLY N N 15 111.317 0.3 A 82 LEU H H 1 7.340 0.020 A 82 LEU HA H 1 3.960 0.020 A 82 LEU HB2 H 1 1.400 0.020 A 82 LEU HB3 H 1 1.400 0.020 A 82 LEU HDx% H 1 0.613 0.020 A 82 LEU HDy% H 1 0.537 0.020 A 82 LEU HG H 1 1.214 0.020 A 82 LEU CA C 13 56.252 0.3 A 82 LEU CB C 13 42.978 0.3 A 82 LEU CD1 C 13 25.627 0.3 A 82 LEU CD2 C 13 22.999 0.3 A 82 LEU CG C 13 27.762 0.3 A 82 LEU N N 15 126.471 0.3 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 6 SER H A 6 SER HA 1.0 . 3.05 2 2 A 8 ASN H A 8 ASN HA 1.0 . 3.98 3 3 A 8 ASN H A 8 ASN HBy 1.0 . 3.31 4 4 A 8 ASN H A 8 ASN HBx 1.0 . 3.55 5 5 A 10 ASP H A 10 ASP HA 1.0 . 3.52 6 6 A 11 ALA H A 11 ALA HA 1.0 . 3.33 7 7 A 12 VAL H A 12 VAL HA 1.0 . 3.30 8 8 A 13 ALA H A 13 ALA HA 1.0 . 2.62 9 9 A 15 CYS H A 15 CYS HA 1.0 . 3.79 10 10 A 17 SER H A 17 SER HA 1.0 . 2.91 11 11 A 18 GLY H A 18 GLY HA2 1.0 . 4.53 12 11 A 18 GLY H A 18 GLY HA3 1.0 . 4.53 13 12 A 19 GLY H A 19 GLY HAx 1.0 . 2.77 14 13 A 23 ALA H A 23 ALA HA 1.0 . 2.96 15 14 A 24 ASN H A 24 ASN HA 1.0 . 3.30 16 15 A 26 GLY H A 26 GLY HAx 1.0 . 2.80 17 16 A 26 GLY H A 26 GLY HAy 1.0 . 2.68 18 17 A 27 ASN H A 27 ASN HA 1.0 . 3.21 19 18 A 28 GLY H A 28 GLY HAy 1.0 . 3.08 20 19 A 28 GLY H A 28 GLY HAx 1.0 . 2.83 21 20 A 30 TYR H A 30 TYR HA 1.0 . 3.30 22 21 A 31 GLY H A 31 GLY HA2 1.0 . 4.56 23 21 A 31 GLY H A 31 GLY HA3 1.0 . 4.56 24 22 A 33 LEU H A 33 LEU HA 1.0 . 3.14 25 23 A 35 PHE H A 35 PHE HA 1.0 . 3.58 26 24 A 36 LYS H A 36 LYS HA 1.0 . 3.14 27 25 A 40 TRP H A 40 TRP HA 1.0 . 3.21 28 26 A 41 ALA H A 41 ALA HA 1.0 . 2.90 29 27 A 42 ALA H A 42 ALA HA 1.0 . 2.86 30 28 A 43 PHE H A 43 PHE HA 1.0 . 3.33 31 29 A 46 VAL H A 46 VAL HA 1.0 . 3.24 32 30 A 50 ALA H A 50 ALA HA 1.0 . 3.14 33 31 A 51 ALA H A 51 ALA HA 1.0 . 3.11 34 32 A 52 ALA H A 52 ALA HA 1.0 . 3.45 35 33 A 53 SER H A 53 SER HA 1.0 . 2.74 36 34 A 55 GLU H A 55 GLU HA 1.0 . 3.05 37 35 A 56 GLN H A 56 GLN HA 1.0 . 2.99 38 36 A 57 GLN H A 57 GLN HA 1.0 . 3.52 39 37 A 58 ILE H A 58 ILE HA 1.0 . 2.99 40 38 A 59 ALA H A 59 ALA HA 1.0 . 2.80 41 39 A 60 VAL H A 60 VAL HA 1.0 . 3.45 42 40 A 62 ASN H A 62 ASN HA 1.0 . 3.21 43 41 A 63 ARG H A 63 ARG HA 1.0 . 3.39 44 42 A 65 LEU H A 65 LEU HA 1.0 . 3.24 45 43 A 66 ALA H A 66 ALA HA 1.0 . 2.96 46 44 A 67 GLU H A 67 GLU HA 1.0 . 3.14 47 45 A 68 GLN H A 68 GLN HA 1.0 . 3.17 48 46 A 69 GLY H A 69 GLY HAx 1.0 . 2.99 49 47 A 69 GLY H A 69 GLY HAy 1.0 . 2.77 50 48 A 71 ASP H A 71 ASP HA 1.0 . 2.93 51 49 A 72 ALA H A 72 ALA HA 1.0 . 3.27 52 50 A 73 TRP H A 73 TRP HA 1.0 . 3.48 53 51 A 75 THR H A 75 THR HA 1.0 . 3.33 54 52 A 77 GLY H A 77 GLY HAy 1.0 . 2.52 55 53 A 77 GLY H A 77 GLY HAx 1.0 . 2.80 56 54 A 78 ALA H A 78 ALA HA 1.0 . 3.39 57 55 A 81 GLY H A 81 GLY HAy 1.0 . 2.93 58 56 A 81 GLY H A 81 GLY HAx 1.0 . 2.65 59 57 A 82 LEU H A 82 LEU HA 1.0 . 2.93 60 58 A 9 TRP H A 9 TRP HA 1.0 . 3.21 61 59 A 10 ASP H A 9 TRP H 1.0 . 3.17 62 60 A 10 ASP H A 11 ALA H 1.0 . 2.77 63 61 A 12 VAL H A 13 ALA H 1.0 . 2.68 64 62 A 12 VAL H A 14 GLN H 1.0 . 4.57 65 63 A 15 CYS H A 14 GLN H 1.0 . 3.17 66 64 A 13 ALA H A 14 GLN H 1.0 . 2.77 67 65 A 14 GLN H A 14 GLN HA 1.0 . 2.96 68 66 A 15 CYS H A 16 GLU H 1.0 . 3.30 69 67 A 14 GLN H A 16 GLU H 1.0 . 4.20 70 68 A 17 SER H A 16 GLU H 1.0 . 3.48 71 69 A 17 SER H A 18 GLY H 1.0 . 2.62 72 70 A 19 GLY H A 20 ASN H 1.0 . 3.48 73 71 A 20 ASN H A 20 ASN HA 1.0 . 2.96 74 72 A 21 TRP H A 22 ALA H 1.0 . 3.02 75 73 A 21 TRP H A 21 TRP HA 1.0 . 3.55 76 74 A 25 THR H A 25 THR HA 1.0 . 3.21 77 75 A 26 GLY H A 25 THR H 1.0 . 2.86 78 76 A 26 GLY H A 27 ASN H 1.0 . 2.74 79 77 A 27 ASN H A 28 GLY H 1.0 . 3.17 80 78 A 33 LEU H A 34 GLN H 1.0 . 2.40 81 79 A 32 GLY H A 32 GLY HAy 1.0 . 3.52 82 80 A 32 GLY H A 32 GLY HAx 1.0 . 2.93 83 81 A 33 LEU H A 32 GLY H 1.0 . 3.24 84 82 A 40 TRP H A 39 THR H 1.0 . 2.77 85 83 A 40 TRP H A 41 ALA H 1.0 . 2.96 86 84 A 41 ALA H A 42 ALA H 1.0 . 3.08 87 85 A 41 ALA H A 39 THR H 1.0 . 3.95 88 86 A 44 GLY H A 45 GLY H 1.0 . 2.96 89 87 A 50 ALA H A 51 ALA H 1.0 . 2.90 90 88 A 51 ALA H A 52 ALA H 1.0 . 2.77 91 89 A 55 GLU H A 54 ARG H 1.0 . 3.11 92 90 A 56 GLN H A 57 GLN H 1.0 . 2.90 93 91 A 58 ILE H A 59 ALA H 1.0 . 3.05 94 92 A 59 ALA H A 60 VAL H 1.0 . 2.96 95 93 A 60 VAL H A 61 ALA H 1.0 . 2.65 96 94 A 62 ASN H A 63 ARG H 1.0 . 2.90 97 95 A 63 ARG H A 64 VAL H 1.0 . 2.77 98 96 A 65 LEU H A 64 VAL H 1.0 . 3.11 99 97 A 65 LEU H A 66 ALA H 1.0 . 3.08 100 98 A 62 ASN H A 61 ALA H 1.0 . 2.80 101 99 A 67 GLU H A 68 GLN H 1.0 . 2.62 102 100 A 68 GLN H A 69 GLY H 1.0 . 2.52 103 101 A 71 ASP H A 70 LEU H 1.0 . 3.08 104 102 A 71 ASP H A 71 ASP HB2 1.0 . 4.59 105 102 A 71 ASP H A 71 ASP HB3 1.0 . 4.59 106 103 A 10 ASP H A 10 ASP HBx 1.0 . 4.71 107 103 A 10 ASP H A 10 ASP HBy 1.0 . 4.71 108 104 A 11 ALA H A 10 ASP HBx 1.0 . 5.52 109 104 A 11 ALA H A 10 ASP HBy 1.0 . 5.52 110 105 A 12 VAL H A 12 VAL HB 1.0 . 3.41 111 106 A 14 GLN H A 14 GLN HBy 1.0 . 4.44 112 106 A 14 GLN H A 14 GLN HBx 1.0 . 4.44 113 107 A 13 ALA HA A 14 GLN H 1.0 . 3.98 114 108 A 11 ALA HA A 14 GLN H 1.0 . 3.30 115 109 A 15 CYS H A 15 CYS HBy 1.0 . 2.86 116 110 A 15 CYS H A 15 CYS HBx 1.0 . 3.21 117 111 A 15 CYS H A 14 GLN HBy 1.0 . 5.61 118 111 A 15 CYS H A 14 GLN HBx 1.0 . 5.61 119 112 A 16 GLU H A 16 GLU HA 1.0 . 3.39 120 113 A 16 GLU H A 15 CYS HBx 1.0 . 3.33 121 114 A 16 GLU H A 15 CYS HBy 1.0 . 3.17 122 115 A 30 TYR HA A 31 GLY H 1.0 . 2.52 123 116 A 30 TYR H A 30 TYR HBx 1.0 . 3.70 124 117 A 30 TYR H A 30 TYR HBy 1.0 . 3.62 125 118 A 34 GLN H A 34 GLN HA 1.0 . 2.65 126 119 A 34 GLN H A 34 GLN HBy 1.0 . 3.76 127 120 A 40 TRP H A 39 THR HA 1.0 . 3.58 128 121 A 40 TRP H A 39 THR HB 1.0 . 2.96 129 122 A 81 GLY H A 82 LEU H 1.0 . 2.93 130 123 A 43 PHE H A 43 PHE HBy 1.0 . 3.67 131 124 A 43 PHE H A 43 PHE HBx 1.0 . 2.96 132 125 A 55 GLU H A 55 GLU HB2 1.0 . 2.59 133 126 A 60 VAL H A 60 VAL HB 1.0 . 2.83 134 127 A 59 ALA HA A 60 VAL H 1.0 . 3.67 135 128 A 55 GLU HA A 56 GLN H 1.0 . 3.45 136 129 A 35 PHE H A 34 GLN H 1.0 . 2.90 137 130 A 19 GLY H A 19 GLY HAy 1.0 . 2.86 138 131 A 19 GLY HAx A 20 ASN H 1.0 . 3.39 139 132 A 21 TRP H A 21 TRP HBy 1.0 . 5.06 140 132 A 21 TRP H A 21 TRP HBx 1.0 . 5.06 141 133 A 20 ASN H A 20 ASN HBy 1.0 . 3.33 142 134 A 20 ASN H A 20 ASN HBx 1.0 . 3.79 143 135 A 27 ASN H A 27 ASN HBx 1.0 . 3.42 144 136 A 27 ASN H A 27 ASN HBy 1.0 . 4.04 145 137 A 33 LEU H A 33 LEU HBx 1.0 . 3.67 146 138 A 33 LEU H A 33 LEU HBy 1.0 . 3.52 147 139 A 35 PHE H A 35 PHE HBy 1.0 . 2.62 148 140 A 35 PHE H A 35 PHE HBx 1.0 . 2.71 149 141 A 45 GLY H A 45 GLY HAy 1.0 . 3.27 150 142 A 45 GLY H A 45 GLY HAx 1.0 . 2.59 151 143 A 45 GLY H A 44 GLY HAx 1.0 . 3.95 152 144 A 46 VAL H A 46 VAL HB 1.0 . 2.93 153 145 A 46 VAL H A 45 GLY HAx 1.0 . 3.36 154 146 A 46 VAL H A 45 GLY HAy 1.0 . 2.65 155 147 A 13 ALA HA A 16 GLU H 1.0 . 3.61 156 148 A 20 ASN HA A 21 TRP H 1.0 . 2.65 157 149 A 17 SER HA A 18 GLY H 1.0 . 3.55 158 150 A 19 GLY H A 14 GLN HA 1.0 . 3.15 159 151 A 24 ASN H A 24 ASN HBy 1.0 . 3.35 160 152 A 24 ASN H A 24 ASN HBx 1.0 . 3.21 161 153 A 23 ALA HA A 24 ASN H 1.0 . 2.40 162 154 A 26 GLY HAy A 27 ASN H 1.0 . 3.52 163 155 A 26 GLY HAx A 27 ASN H 1.0 . 3.64 164 156 A 29 LYS H A 29 LYS HA 1.0 . 3.70 165 157 A 29 LYS H A 29 LYS HBx 1.0 . 3.64 166 158 A 29 LYS H A 29 LYS HBy 1.0 . 4.20 167 159 A 28 GLY H A 29 LYS H 1.0 . 2.96 168 160 A 33 LEU HA A 34 GLN H 1.0 . 3.27 169 161 A 32 GLY H A 31 GLY HA2 1.0 . 4.90 170 161 A 31 GLY HA3 A 32 GLY H 1.0 . 4.90 171 162 A 35 PHE HA A 36 LYS H 1.0 . 2.40 172 163 A 82 LEU H A 82 LEU HB2 1.0 . 4.68 173 163 A 82 LEU H A 82 LEU HB3 1.0 . 4.68 174 164 A 77 GLY H A 78 ALA H 1.0 . 2.93 175 165 A 75 THR H A 75 THR HB 1.0 . 3.45 176 166 A 73 TRP H A 73 TRP HBy 1.0 . 5.02 177 166 A 73 TRP H A 73 TRP HBx 1.0 . 5.02 178 167 A 30 TYR H A 29 LYS HA 1.0 . 2.99 179 168 A 27 ASN H A 29 LYS H 1.0 . 2.96 180 169 A 9 TRP H A 9 TRP HBy 1.0 . 2.96 181 170 A 22 ALA H A 22 ALA HA 1.0 . 3.33 182 171 A 23 ALA H A 22 ALA HA 1.0 . 3.98 183 172 A 63 ARG H A 63 ARG HBx 1.0 . 2.83 184 173 A 63 ARG H A 63 ARG HBy 1.0 . 2.83 185 174 A 64 VAL H A 64 VAL HB 1.0 . 4.26 186 175 A 64 VAL H A 64 VAL HA 1.0 . 2.96 187 176 A 67 GLU H A 67 GLU HBy 1.0 . 3.45 188 177 A 67 GLU H A 67 GLU HBx 1.0 . 2.68 189 178 A 68 GLN H A 68 GLN HBx 1.0 . 2.99 190 179 A 72 ALA HA A 73 TRP H 1.0 . 3.61 191 180 A 52 ALA HA A 53 SER H 1.0 . 2.46 192 181 A 57 GLN HA A 60 VAL H 1.0 . 4.23 193 182 A 66 ALA HA A 67 GLU H 1.0 . 3.70 194 183 A 12 VAL H A 9 TRP HA 1.0 . 3.48 195 184 A 24 ASN HA A 25 THR H 1.0 . 2.86 196 185 A 30 TYR H A 29 LYS H 1.0 . 4.44 197 186 A 30 TYR H A 35 PHE H 1.0 . 3.24 198 187 A 40 TRP H A 40 TRP HBy 1.0 . 2.83 199 188 A 40 TRP H A 40 TRP HBx 1.0 . 2.86 200 189 A 41 ALA H A 40 TRP HBy 1.0 . 3.97 201 190 A 41 ALA H A 40 TRP HBx 1.0 . 3.70 202 191 A 43 PHE HA A 44 GLY H 1.0 . 5.50 203 192 A 44 GLY H A 44 GLY HAy 1.0 . 5.50 204 193 A 44 GLY H A 44 GLY HAx 1.0 . 5.50 205 194 A 46 VAL HA A 47 GLY H 1.0 . 3.02 206 195 A 53 SER H A 53 SER HBx 1.0 . 4.78 207 195 A 53 SER H A 53 SER HBy 1.0 . 4.78 208 196 A 53 SER HA A 54 ARG H 1.0 . 2.49 209 197 A 54 ARG H A 53 SER HBx 1.0 . 5.33 210 197 A 54 ARG H A 53 SER HBy 1.0 . 5.33 211 198 A 53 SER HA A 55 GLU H 1.0 . 4.77 212 199 A 55 GLU HA A 58 ILE H 1.0 . 3.58 213 200 A 58 ILE H A 58 ILE HB 1.0 . 3.49 214 201 A 61 ALA H A 61 ALA HA 1.0 . 3.14 215 202 A 61 ALA H A 60 VAL HB 1.0 . 2.90 216 203 A 63 ARG H A 62 ASN HBy 1.0 . 6.26 217 203 A 63 ARG H A 62 ASN HBx 1.0 . 6.26 218 204 A 62 ASN HA A 65 LEU H 1.0 . 3.92 219 205 A 54 ARG H A 54 ARG HA 1.0 . 3.27 220 206 A 54 ARG H A 54 ARG HB2 1.0 . 3.30 221 207 A 54 ARG H A 54 ARG HB3 1.0 . 3.50 222 208 A 39 THR H A 39 THR HA 1.0 . 3.45 223 209 A 39 THR H A 39 THR HB 1.0 . 3.02 224 210 A 34 GLN H A 34 GLN HBx 1.0 . 3.72 225 211 A 71 ASP H A 72 ALA H 1.0 . 2.68 226 212 A 72 ALA H A 71 ASP HB2 1.0 . 5.71 227 212 A 72 ALA H A 71 ASP HB3 1.0 . 5.71 228 213 A 80 SER H A 80 SER HA 1.0 . 3.24 229 214 A 80 SER H A 80 SER HBy 1.0 . 2.99 230 215 A 80 SER H A 80 SER HBx 1.0 . 3.36 231 216 A 50 ALA H A 49 PRO HA 1.0 . 3.45 232 217 A 70 LEU H A 70 LEU HA 1.0 . 3.61 233 218 A 70 LEU H A 70 LEU HBy 1.0 . 5.37 234 218 A 70 LEU H A 70 LEU HBx 1.0 . 5.37 235 219 A 16 GLU H A 16 GLU HBy 1.0 . 3.64 236 220 A 16 GLU H A 16 GLU HBx 1.0 . 3.33 237 221 A 65 LEU H A 65 LEU HB2 1.0 . 3.54 238 222 A 65 LEU H A 65 LEU HB3 1.0 . 3.24 239 223 A 8 ASN H A 7 PRO HA 1.0 . 2.40 240 224 A 48 ASN H A 48 ASN HBy 1.0 . 3.11 241 225 A 48 ASN H A 48 ASN HBx 1.0 . 3.58 242 226 A 8 ASN HA A 9 TRP H 1.0 . 2.96 243 227 A 9 TRP H A 9 TRP HBx 1.0 . 3.36 244 228 A 17 SER H A 16 GLU HBx 1.0 . 3.52 245 229 A 17 SER H A 16 GLU HBy 1.0 . 4.17 246 230 A 17 SER HA A 19 GLY H 1.0 . 4.26 247 231 A 23 ALA H A 22 ALA H 1.0 . 2.68 248 232 A 23 ALA H A 24 ASN H 1.0 . 3.73 249 233 A 24 ASN H A 25 THR H 1.0 . 3.64 250 234 A 30 TYR H A 29 LYS HBx 1.0 . 3.24 251 235 A 30 TYR H A 29 LYS HBy 1.0 . 3.38 252 236 A 33 LEU H A 32 GLY HAx 1.0 . 3.76 253 237 A 36 LYS H A 36 LYS HBy 1.0 . 3.30 254 238 A 36 LYS H A 36 LYS HBx 1.0 . 2.96 255 239 A 42 ALA H A 43 PHE H 1.0 . 3.76 256 240 A 51 ALA HA A 52 ALA H 1.0 . 4.04 257 241 A 55 GLU H A 54 ARG HB2 1.0 . 3.11 258 242 A 55 GLU H A 54 ARG HB3 1.0 . 3.48 259 243 A 55 GLU H A 53 SER HBx 1.0 . 6.67 260 243 A 55 GLU H A 53 SER HBy 1.0 . 6.67 261 244 A 55 GLU H A 56 GLN H 1.0 . 2.93 262 245 A 55 GLU H A 55 GLU HB3 1.0 . 3.02 263 246 A 56 GLN H A 56 GLN HBx 1.0 . 2.80 264 247 A 56 GLN H A 56 GLN HBy 1.0 . 2.71 265 248 A 57 GLN H A 57 GLN HB2 1.0 . 4.81 266 248 A 57 GLN H A 57 GLN HB3 1.0 . 4.81 267 249 A 57 GLN H A 56 GLN HBx 1.0 . 3.11 268 250 A 58 ILE H A 57 GLN HB2 1.0 . 5.15 269 250 A 58 ILE H A 57 GLN HB3 1.0 . 5.15 270 251 A 58 ILE HA A 61 ALA H 1.0 . 3.76 271 252 A 60 VAL H A 62 ASN H 1.0 . 3.86 272 253 A 59 ALA HA A 62 ASN H 1.0 . 3.45 273 254 A 62 ASN H A 62 ASN HBy 1.0 . 4.59 274 254 A 62 ASN H A 62 ASN HBx 1.0 . 4.59 275 255 A 62 ASN HA A 63 ARG H 1.0 . 3.67 276 256 A 64 VAL H A 61 ALA HA 1.0 . 3.92 277 257 A 68 GLN H A 68 GLN HBy 1.0 . 2.90 278 258 A 67 GLU H A 69 GLY H 1.0 . 3.48 279 259 A 69 GLY HAx A 70 LEU H 1.0 . 2.90 280 260 A 69 GLY HAy A 70 LEU H 1.0 . 3.02 281 261 A 71 ASP HA A 72 ALA H 1.0 . 3.61 282 262 A 72 ALA H A 73 TRP H 1.0 . 3.42 283 263 A 77 GLY H A 76 CYS HA 1.0 . 3.55 284 264 A 10 ASP H A 9 TRP HBy 1.0 . 4.11 285 265 A 25 THR H A 25 THR HB 1.0 . 3.55 286 266 A 27 ASN HA A 28 GLY H 1.0 . 3.20 287 267 A 30 TYR H A 34 GLN HA 1.0 . 3.99 288 268 A 31 GLY H A 30 TYR HBx 1.0 . 3.98 289 269 A 31 GLY H A 30 TYR HBy 1.0 . 4.26 290 270 A 33 LEU H A 32 GLY HAy 1.0 . 4.11 291 271 A 34 GLN H A 33 LEU HBx 1.0 . 3.52 292 272 A 39 THR H A 36 LYS HBy 1.0 . 4.79 293 273 A 39 THR H A 36 LYS HBx 1.0 . 4.42 294 274 A 40 TRP HA A 41 ALA H 1.0 . 3.74 295 275 A 45 GLY H A 44 GLY HAy 1.0 . 4.85 296 276 A 77 GLY H A 73 TRP HBy 1.0 . 4.93 297 276 A 77 GLY H A 73 TRP HBx 1.0 . 4.93 298 277 A 80 SER H A 79 ALA HA 1.0 . 3.58 299 278 A 63 ARG H A 61 ALA HA 1.0 . 5.00 300 279 A 65 LEU HA A 69 GLY H 1.0 . 3.64 301 280 A 69 GLY H A 68 GLN HBy 1.0 . 4.07 302 281 A 65 LEU HA A 68 GLN H 1.0 . 3.76 303 282 A 69 GLY H A 70 LEU H 1.0 . 4.38 304 283 A 71 ASP H A 73 TRP H 1.0 . 5.50 305 284 A 18 GLY H A 14 GLN HA 1.0 . 4.51 306 285 A 40 TRP H A 38 ALA H 1.0 . 4.46 307 286 A 53 SER H A 56 GLN HBy 1.0 . 2.77 308 287 A 53 SER H A 56 GLN HBx 1.0 . 3.89 309 288 A 6 SER H A 6 SER HBy 1.0 . 4.94 310 289 A 6 SER H A 6 SER HBx 1.0 . 4.94 311 290 A 8 ASN HBx A 9 TRP H 1.0 . 4.45 312 291 A 18 GLY H A 16 GLU HBy 1.0 . 5.50 313 292 A 20 ASN HA A 22 ALA H 1.0 . 4.54 314 293 A 35 PHE H A 34 GLN HBy 1.0 . 5.00 315 294 A 35 PHE H A 34 GLN HBx 1.0 . 5.50 316 295 A 42 ALA HA A 43 PHE H 1.0 . 4.14 317 296 A 41 ALA HA A 45 GLY H 1.0 . 3.89 318 297 A 60 VAL HA A 61 ALA H 1.0 . 4.23 319 298 A 81 GLY HAx A 82 LEU H 1.0 . 3.67 320 299 A 68 GLN HA A 69 GLY H 1.0 . 4.79 321 300 A 69 GLY H A 70 LEU HBy 1.0 . 6.42 322 300 A 69 GLY H A 70 LEU HBx 1.0 . 6.42 323 301 A 12 VAL H A 15 CYS H 1.0 . 4.95 324 302 A 21 TRP HA A 32 GLY H 1.0 . 3.73 325 303 A 23 ALA H A 31 GLY HA2 1.0 . 5.77 326 303 A 23 ALA H A 31 GLY HA3 1.0 . 5.77 327 304 A 50 ALA H A 52 ALA H 1.0 . 3.76 328 305 A 47 GLY H A 47 GLY HAy 1.0 . 3.67 329 306 A 47 GLY H A 47 GLY HAx 1.0 . 3.30 330 307 A 71 ASP HA A 73 TRP H 1.0 . 4.45 331 308 A 18 GLY H A 16 GLU H 1.0 . 3.27 332 309 A 50 ALA H A 49 PRO HBx 1.0 . 3.39 333 310 A 50 ALA H A 49 PRO HBy 1.0 . 4.45 334 311 A 57 GLN H A 54 ARG HA 1.0 . 3.86 335 312 A 28 GLY HAx A 29 LYS H 1.0 . 3.79 336 313 A 28 GLY HAy A 29 LYS H 1.0 . 3.89 337 314 A 60 VAL H A 63 ARG H 1.0 . 4.97 338 315 A 62 ASN H A 64 VAL H 1.0 . 4.17 339 316 A 63 ARG H A 61 ALA H 1.0 . 4.20 340 317 A 12 VAL HA A 13 ALA H 1.0 . 3.64 341 318 A 11 ALA H A 9 TRP H 1.0 . 4.35 342 319 A 10 ASP H A 9 TRP HA 1.0 . 3.49 343 320 A 67 GLU HA A 68 GLN H 1.0 . 3.61 344 321 A 17 SER H A 14 GLN HA 1.0 . 3.58 345 322 A 22 ALA H A 21 TRP HA 1.0 . 3.48 346 323 A 11 ALA H A 12 VAL H 1.0 . 2.93 347 324 A 57 GLN H A 58 ILE H 1.0 . 2.96 348 325 A 56 GLN HA A 59 ALA H 1.0 . 3.58 349 326 A 63 ARG HA A 64 VAL H 1.0 . 3.57 350 327 A 62 ASN H A 61 ALA HA 1.0 . 3.39 351 328 A 60 VAL HA A 63 ARG H 1.0 . 3.52 352 329 A 56 GLN HA A 57 GLN H 1.0 . 3.45 353 330 A 56 GLN H A 55 GLU HB3 1.0 . 3.79 354 331 A 55 GLU H A 54 ARG HA 1.0 . 4.20 355 332 A 64 VAL H A 63 ARG HBy 1.0 . 4.07 356 333 A 67 GLU H A 64 VAL HA 1.0 . 3.44 357 334 A 63 ARG HA A 66 ALA H 1.0 . 3.48 358 335 A 66 ALA H A 65 LEU HB2 1.0 . 3.70 359 336 A 65 LEU HA A 66 ALA H 1.0 . 3.70 360 337 A 66 ALA H A 67 GLU H 1.0 . 3.08 361 338 A 41 ALA HA A 42 ALA H 1.0 . 3.45 362 339 A 40 TRP HA A 43 PHE H 1.0 . 3.27 363 340 A 11 ALA HA A 12 VAL H 1.0 . 3.70 364 341 A 10 ASP HA A 13 ALA H 1.0 . 3.30 365 342 A 13 ALA H A 12 VAL HB 1.0 . 3.52 366 343 A 12 VAL HA A 15 CYS H 1.0 . 3.36 367 344 A 24 ASN HA A 26 GLY H 1.0 . 3.61 368 345 A 46 VAL H A 47 GLY H 1.0 . 4.63 369 346 A 71 ASP H A 70 LEU HBy 1.0 . 6.73 370 346 A 71 ASP H A 70 LEU HBx 1.0 . 6.73 371 347 A 66 ALA HA A 68 GLN H 1.0 . 5.04 372 348 A 66 ALA H A 65 LEU HB3 1.0 . 4.01 373 349 A 30 TYR H A 31 GLY H 1.0 . 4.48 374 350 A 17 SER H A 16 GLU HA 1.0 . 3.39 375 351 A 17 SER H A 17 SER HB2 1.0 . 5.40 376 351 A 17 SER H A 17 SER HB3 1.0 . 5.40 377 352 A 59 ALA H A 58 ILE HB 1.0 . 4.25 378 353 A 75 THR H A 74 PRO HB3 1.0 . 5.24 379 353 A 75 THR H A 74 PRO HB2 1.0 . 5.24 380 354 A 52 ALA H A 49 PRO HA 1.0 . 3.61 381 355 A 50 ALA H A 51 ALA HA 1.0 . 4.91 382 356 A 64 VAL H A 63 ARG HBx 1.0 . 3.30 383 357 A 26 GLY H A 25 THR HA 1.0 . 3.42 384 358 A 65 LEU H A 64 VAL HA 1.0 . 3.50 385 359 A 53 SER H A 56 GLN H 1.0 . 4.07 386 360 A 19 GLY H A 18 GLY HA2 1.0 . 5.64 387 360 A 18 GLY HA3 A 19 GLY H 1.0 . 5.64 388 361 A 44 GLY H A 43 PHE HBx 1.0 . 3.39 389 362 A 48 ASN H A 47 GLY HAy 1.0 . 3.45 390 363 A 81 GLY H A 80 SER H 1.0 . 3.05 391 364 A 18 GLY H A 19 GLY H 1.0 . 3.05 392 365 A 42 ALA H A 39 THR HA 1.0 . 4.07 393 366 A 29 LYS H A 29 LYS HG2 1.0 . 6.26 394 366 A 29 LYS H A 29 LYS HG3 1.0 . 6.26 395 367 A 68 GLN H A 68 GLN HGy 1.0 . 5.30 396 367 A 68 GLN H A 68 GLN HGx 1.0 . 5.30 397 368 A 63 ARG H A 63 ARG HD2 1.0 . 6.79 398 368 A 63 ARG H A 63 ARG HD3 1.0 . 6.79 399 369 A 70 LEU H A 70 LEU HG 1.0 . 2.74 400 370 A 16 GLU H A 16 GLU HGx 1.0 . 5.61 401 370 A 16 GLU H A 16 GLU HGy 1.0 . 5.61 402 371 A 54 ARG H A 54 ARG HD3 1.0 . 7.26 403 371 A 54 ARG H A 54 ARG HD2 1.0 . 7.26 404 372 A 33 LEU H A 33 LEU HG 1.0 . 4.14 405 373 A 36 LYS H A 36 LYS HGx 1.0 . 3.42 406 374 A 36 LYS H A 36 LYS HGy 1.0 . 4.01 407 375 A 36 LYS H A 29 LYS HG2 1.0 . 6.92 408 375 A 36 LYS H A 29 LYS HG3 1.0 . 6.92 409 376 A 36 LYS H A 36 LYS HE2 1.0 . 6.33 410 376 A 36 LYS H A 36 LYS HE3 1.0 . 6.33 411 377 A 55 GLU H A 55 GLU HGy 1.0 . 4.20 412 378 A 56 GLN H A 56 GLN HG2 1.0 . 5.61 413 378 A 56 GLN H A 56 GLN HG3 1.0 . 5.61 414 379 A 57 GLN H A 57 GLN HGy 1.0 . 3.79 415 380 A 57 GLN H A 57 GLN HGx 1.0 . 4.85 416 381 A 58 ILE H A 58 ILE HG12 1.0 . 5.43 417 381 A 58 ILE H A 58 ILE HG13 1.0 . 5.43 418 382 A 41 ALA H A 38 ALA HA 1.0 . 3.58 419 383 A 69 GLY H A 68 GLN HGy 1.0 . 7.26 420 383 A 69 GLY H A 68 GLN HGx 1.0 . 7.26 421 384 A 50 ALA H A 49 PRO HDx 1.0 . 5.50 422 385 A 36 LYS H A 29 LYS HBy 1.0 . 5.41 423 386 A 9 TRP HD1 A 9 TRP HE1 1.0 . 2.74 424 387 A 9 TRP HE1 A 62 ASN HBy 1.0 . 6.26 425 387 A 62 ASN HBx A 9 TRP HE1 1.0 . 6.26 426 388 A 9 TRP HE1 A 58 ILE HG12 1.0 . 6.11 427 388 A 58 ILE HG13 A 9 TRP HE1 1.0 . 6.11 428 389 A 62 ASN HA A 9 TRP HE1 1.0 . 4.07 429 390 A 39 THR H A 38 ALA HA 1.0 . 3.52 430 391 A 21 TRP HD1 A 21 TRP HE1 1.0 . 2.62 431 392 A 21 TRP HE1 A 54 ARG HD3 1.0 . 6.20 432 392 A 54 ARG HD2 A 21 TRP HE1 1.0 . 6.20 433 393 A 40 TRP HD1 A 40 TRP HE1 1.0 . 2.83 434 394 A 46 VAL H A 40 TRP HE1 1.0 . 3.83 435 395 A 46 VAL HA A 40 TRP HE1 1.0 . 5.16 436 396 A 45 GLY HAy A 40 TRP HE1 1.0 . 4.51 437 397 A 39 THR H A 38 ALA H 1.0 . 2.91 438 398 A 33 LEU HG A 73 TRP HE1 1.0 . 4.07 439 399 A 33 LEU HBy A 73 TRP HE1 1.0 . 2.90 440 400 A 33 LEU HBx A 73 TRP HE1 1.0 . 3.89 441 401 A 33 LEU HA A 73 TRP HE1 1.0 . 5.50 442 402 A 73 TRP HE1 A 73 TRP HD1 1.0 . 2.93 443 403 A 71 ASP H A 70 LEU HG 1.0 . 5.04 444 404 A 21 TRP H A 21 TRP HD1 1.0 . 3.39 445 405 A 20 ASN HBy A 20 ASN HD2x 1.0 . 3.79 446 406 A 20 ASN HBx A 20 ASN HD2x 1.0 . 3.73 447 407 A 20 ASN HD2x A 20 ASN HD2y 1.0 . 2.40 448 408 A 23 ALA HA A 20 ASN HD2y 1.0 . 5.50 449 409 A 27 ASN HBy A 27 ASN HD2x 1.0 . 3.79 450 410 A 27 ASN HBx A 27 ASN HD2x 1.0 . 4.42 451 411 A 27 ASN HD2x A 27 ASN HD2y 1.0 . 2.40 452 412 A 29 LYS HBx A 27 ASN HD2y 1.0 . 4.66 453 413 A 24 ASN HBy A 24 ASN HD2y 1.0 . 4.42 454 414 A 24 ASN HBx A 24 ASN HD2y 1.0 . 4.29 455 415 A 24 ASN HA A 24 ASN HD2y 1.0 . 5.50 456 416 A 24 ASN HD2y A 24 ASN HD2x 1.0 . 2.40 457 417 A 24 ASN HA A 24 ASN HD2x 1.0 . 5.50 458 418 A 24 ASN HBy A 24 ASN HD2x 1.0 . 5.50 459 419 A 24 ASN HBx A 24 ASN HD2x 1.0 . 5.50 460 420 A 57 GLN HE2x A 57 GLN HE2y 1.0 . 2.40 461 421 A 60 VAL HA A 57 GLN HE2x 1.0 . 3.61 462 422 A 57 GLN HGy A 57 GLN HE2x 1.0 . 3.55 463 423 A 57 GLN HGx A 57 GLN HE2x 1.0 . 4.54 464 424 A 57 GLN HGy A 57 GLN HE2y 1.0 . 3.67 465 425 A 57 GLN HGx A 57 GLN HE2y 1.0 . 5.50 466 426 A 57 GLN HE2y A 57 GLN HB2 1.0 . 7.26 467 426 A 57 GLN HB3 A 57 GLN HE2y 1.0 . 7.26 468 427 A 54 ARG H A 54 ARG HG3 1.0 . 5.13 469 428 A 72 ALA H A 72 ALA HB% 1.0 . 4.64 470 429 A 11 ALA H A 11 ALA HB% 1.0 . 4.58 471 430 A 12 VAL H A 12 VAL HGx% 1.0 . 4.74 472 431 A 12 VAL H A 12 VAL HGy% 1.0 . 6.19 473 432 A 12 VAL H A 11 ALA HB% 1.0 . 5.05 474 433 A 39 THR H A 39 THR HG2% 1.0 . 5.82 475 434 A 41 ALA H A 41 ALA HB% 1.0 . 4.55 476 435 A 52 ALA H A 52 ALA HB% 1.0 . 4.95 477 436 A 51 ALA H A 51 ALA HB% 1.0 . 4.58 478 437 A 50 ALA H A 50 ALA HB% 1.0 . 4.71 479 438 A 59 ALA H A 59 ALA HB% 1.0 . 4.58 480 439 A 60 VAL H A 60 VAL HGx% 1.0 . 7.19 481 440 A 60 VAL H A 60 VAL HGy% 1.0 . 5.23 482 441 A 60 VAL H A 59 ALA HB% 1.0 . 5.54 483 442 A 46 VAL H A 46 VAL HGy% 1.0 . 7.56 484 443 A 46 VAL H A 46 VAL HGx% 1.0 . 5.48 485 444 A 42 ALA H A 42 ALA HB% 1.0 . 4.46 486 445 A 78 ALA H A 78 ALA HB% 1.0 . 5.26 487 446 A 22 ALA H A 22 ALA HB% 1.0 . 4.46 488 447 A 23 ALA H A 23 ALA HB% 1.0 . 4.64 489 448 A 25 THR H A 25 THR HG2% 1.0 . 5.05 490 449 A 64 VAL H A 64 VAL HGy% 1.0 . 7.23 491 449 A 64 VAL H A 64 VAL HGx% 1.0 . 7.23 492 450 A 66 ALA H A 66 ALA HB% 1.0 . 4.52 493 451 A 40 TRP H A 39 THR HG2% 1.0 . 6.44 494 452 A 43 PHE H A 42 ALA HB% 1.0 . 6.04 495 453 A 52 ALA H A 51 ALA HB% 1.0 . 6.26 496 454 A 58 ILE H A 58 ILE HG2% 1.0 . 5.76 497 455 A 59 ALA H A 58 ILE HG2% 1.0 . 6.07 498 456 A 61 ALA H A 61 ALA HB% 1.0 . 4.49 499 457 A 67 GLU H A 66 ALA HB% 1.0 . 5.60 500 458 A 63 ARG H A 66 ALA HB% 1.0 . 6.41 501 459 A 73 TRP H A 72 ALA HB% 1.0 . 6.22 502 460 A 13 ALA H A 13 ALA HB% 1.0 . 4.46 503 461 A 62 ASN H A 61 ALA HB% 1.0 . 5.33 504 462 A 14 GLN H A 13 ALA HB% 1.0 . 5.26 505 463 A 24 ASN H A 23 ALA HB% 1.0 . 5.26 506 464 A 45 GLY H A 60 VAL HGy% 1.0 . 7.56 507 465 A 53 SER H A 52 ALA HB% 1.0 . 5.42 508 466 A 58 ILE H A 58 ILE HD1% 1.0 . 5.42 509 467 A 61 ALA H A 60 VAL HGy% 1.0 . 6.41 510 468 A 65 LEU H A 65 LEU HDy% 1.0 . 5.45 511 469 A 80 SER H A 79 ALA HB1 1.0 . 6.07 512 470 A 46 VAL H A 60 VAL HGy% 1.0 . 7.56 513 471 A 57 GLN H A 52 ALA HB% 1.0 . 6.04 514 472 A 16 GLU H A 12 VAL HGy% 1.0 . 7.56 515 473 A 80 SER H A 12 VAL HGx% 1.0 . 6.07 516 474 A 80 SER H A 12 VAL HGy% 1.0 . 6.13 517 475 A 81 GLY H A 79 ALA HB1 1.0 . 7.31 518 476 A 19 GLY H A 13 ALA HB% 1.0 . 7.31 519 477 A 42 ALA H A 41 ALA HB% 1.0 . 6.16 520 478 A 24 ASN H A 25 THR HG2% 1.0 . 4.72 521 479 A 43 PHE H A 60 VAL HGy% 1.0 . 6.63 522 480 A 9 TRP HE1 A 58 ILE HG2% 1.0 . 6.01 523 481 A 9 TRP HE1 A 61 ALA HB% 1.0 . 6.07 524 482 A 21 TRP HE1 A 13 ALA HB% 1.0 . 5.88 525 483 A 66 ALA H A 65 LEU HDy% 1.0 . 7.56 526 484 A 63 ARG H A 64 VAL HGy% 1.0 . 9.74 527 484 A 63 ARG H A 64 VAL HGx% 1.0 . 9.74 528 485 A 31 GLY H A 23 ALA HB% 1.0 . 5.02 529 486 A 20 ASN HD2x A 23 ALA HB% 1.0 . 6.84 530 487 A 57 GLN HE2y A 52 ALA HB% 1.0 . 6.60 531 488 A 57 GLN HE2x A 52 ALA HB% 1.0 . 7.56 532 489 A 36 LYS H A 39 THR HG2% 1.0 . 7.06 533 490 A 48 ASN HBy A 48 ASN HA 1.0 . 2.83 534 491 A 43 PHE HA A 43 PHE HBy 1.0 . 2.93 535 492 A 42 ALA HA A 43 PHE HA 1.0 . 4.60 536 493 A 43 PHE HA A 43 PHE HBx 1.0 . 3.48 537 494 A 46 VAL HA A 46 VAL HB 1.0 . 3.11 538 495 A 6 SER HA A 6 SER HBy 1.0 . 4.91 539 496 A 20 ASN HA A 20 ASN HBy 1.0 . 5.34 540 497 A 14 GLN HA A 14 GLN HBy 1.0 . 3.64 541 498 A 14 GLN HA A 18 GLY HA2 1.0 . 5.46 542 498 A 18 GLY HA3 A 14 GLN HA 1.0 . 5.46 543 499 A 14 GLN HA A 14 GLN HBx 1.0 . 3.02 544 500 A 73 TRP HA A 73 TRP HBy 1.0 . 4.42 545 501 A 73 TRP HA A 73 TRP HBx 1.0 . 3.39 546 502 A 50 ALA HA A 22 ALA HA 1.0 . 3.27 547 503 A 34 GLN HA A 34 GLN HBy 1.0 . 3.42 548 504 A 34 GLN HA A 34 GLN HBx 1.0 . 2.74 549 505 A 75 THR HA A 75 THR HB 1.0 . 2.65 550 506 A 77 GLY HAx A 73 TRP HBy 1.0 . 3.08 551 507 A 30 TYR HA A 30 TYR HBy 1.0 . 3.17 552 508 A 30 TYR HA A 30 TYR HBx 1.0 . 3.42 553 509 A 67 GLU HA A 67 GLU HBx 1.0 . 2.96 554 510 A 67 GLU HA A 67 GLU HBy 1.0 . 3.27 555 511 A 35 PHE HA A 35 PHE HBx 1.0 . 3.48 556 512 A 35 PHE HA A 35 PHE HBy 1.0 . 2.90 557 513 A 35 PHE HA A 36 LYS HBx 1.0 . 4.06 558 514 A 27 ASN HA A 27 ASN HBx 1.0 . 3.52 559 515 A 27 ASN HA A 27 ASN HBy 1.0 . 3.45 560 516 A 21 TRP HA A 21 TRP HBx 1.0 . 3.83 561 517 A 15 CYS HA A 15 CYS HBy 1.0 . 3.27 562 518 A 53 SER HA A 53 SER HBx 1.0 . 2.80 563 519 A 58 ILE HA A 58 ILE HB 1.0 . 2.93 564 520 A 36 LYS HA A 36 LYS HBy 1.0 . 2.93 565 521 A 36 LYS HA A 36 LYS HBx 1.0 . 4.35 566 522 A 9 TRP HA A 9 TRP HBx 1.0 . 3.14 567 523 A 9 TRP HA A 9 TRP HBy 1.0 . 2.86 568 524 A 32 GLY HAy A 32 GLY HAx 1.0 . 2.40 569 525 A 32 GLY HAy A 33 LEU HBx 1.0 . 5.50 570 526 A 26 GLY HAx A 26 GLY HAy 1.0 . 2.40 571 527 A 68 GLN HA A 68 GLN HBx 1.0 . 3.61 572 528 A 68 GLN HA A 68 GLN HBy 1.0 . 3.55 573 529 A 60 VAL HA A 63 ARG HBx 1.0 . 4.17 574 530 A 65 LEU HA A 65 LEU HB2 1.0 . 3.21 575 531 A 65 LEU HA A 65 LEU HB3 1.0 . 2.74 576 532 A 53 SER HA A 54 ARG HA 1.0 . 5.10 577 533 A 54 ARG HA A 54 ARG HB2 1.0 . 3.21 578 534 A 54 ARG HA A 57 GLN HB2 1.0 . 5.09 579 534 A 54 ARG HA A 57 GLN HB3 1.0 . 5.09 580 535 A 57 GLN HA A 60 VAL HB 1.0 . 4.11 581 536 A 57 GLN HA A 57 GLN HB2 1.0 . 5.43 582 536 A 57 GLN HA A 57 GLN HB3 1.0 . 5.43 583 537 A 39 THR HA A 39 THR HB 1.0 . 2.90 584 538 A 44 GLY HAx A 44 GLY HAy 1.0 . 2.40 585 539 A 11 ALA HA A 14 GLN HBy 1.0 . 2.68 586 540 A 8 ASN HA A 8 ASN HBx 1.0 . 4.14 587 541 A 8 ASN HA A 8 ASN HBy 1.0 . 4.29 588 542 A 81 GLY HAy A 81 GLY HAx 1.0 . 2.40 589 543 A 71 ASP HA A 71 ASP HB2 1.0 . 4.75 590 543 A 71 ASP HA A 71 ASP HB3 1.0 . 4.75 591 544 A 77 GLY HAy A 77 GLY HAx 1.0 . 2.40 592 545 A 77 GLY HAy A 73 TRP HBy 1.0 . 3.14 593 546 A 63 ARG HA A 63 ARG HBy 1.0 . 2.96 594 547 A 63 ARG HA A 63 ARG HBx 1.0 . 2.86 595 548 A 56 GLN HA A 56 GLN HBx 1.0 . 2.77 596 549 A 56 GLN HA A 56 GLN HBy 1.0 . 3.58 597 550 A 40 TRP HA A 40 TRP HBy 1.0 . 2.80 598 551 A 40 TRP HA A 40 TRP HBx 1.0 . 2.93 599 552 A 45 GLY HAy A 44 GLY HAx 1.0 . 4.17 600 553 A 45 GLY HAy A 45 GLY HAx 1.0 . 2.46 601 554 A 32 GLY HAx A 33 LEU HBy 1.0 . 5.22 602 555 A 20 ASN HA A 20 ASN HBx 1.0 . 3.83 603 556 A 16 GLU HA A 16 GLU HBx 1.0 . 3.08 604 557 A 15 CYS HA A 15 CYS HBx 1.0 . 2.93 605 558 A 69 GLY HAx A 69 GLY HAy 1.0 . 2.40 606 559 A 59 ALA HA A 60 VAL HA 1.0 . 4.94 607 560 A 59 ALA HA A 62 ASN HBy 1.0 . 3.11 608 561 A 64 VAL HB A 61 ALA HA 1.0 . 3.48 609 562 A 48 ASN HBx A 48 ASN HA 1.0 . 4.23 610 563 A 55 GLU HA A 55 GLU HB3 1.0 . 4.93 611 563 A 55 GLU HA A 55 GLU HB2 1.0 . 4.93 612 564 A 55 GLU HA A 58 ILE HB 1.0 . 4.58 613 565 A 33 LEU HA A 33 LEU HBx 1.0 . 2.86 614 566 A 33 LEU HA A 33 LEU HBy 1.0 . 3.11 615 567 A 19 GLY HAx A 19 GLY HAy 1.0 . 2.40 616 568 A 60 VAL HA A 60 VAL HB 1.0 . 3.36 617 569 A 47 GLY HAy A 47 GLY HAx 1.0 . 2.40 618 570 A 4 GLY HAx A 4 GLY HAy 1.0 . 2.40 619 571 A 80 SER HA A 80 SER HBy 1.0 . 2.87 620 572 A 80 SER HA A 80 SER HBx 1.0 . 2.81 621 573 A 82 LEU HA A 82 LEU HB2 1.0 . 5.02 622 573 A 82 LEU HA A 82 LEU HB3 1.0 . 5.02 623 574 A 28 GLY HAy A 28 GLY HAx 1.0 . 2.40 624 575 A 25 THR HA A 25 THR HB 1.0 . 2.92 625 576 A 21 TRP HA A 21 TRP HBy 1.0 . 3.14 626 577 A 17 SER HA A 17 SER HB2 1.0 . 5.43 627 577 A 17 SER HA A 17 SER HB3 1.0 . 5.43 628 578 A 12 VAL HA A 14 GLN HBx 1.0 . 4.33 629 579 A 8 ASN HA A 9 TRP HA 1.0 . 4.53 630 580 A 21 TRP HA A 22 ALA HA 1.0 . 4.51 631 581 A 28 GLY HAx A 27 ASN HBy 1.0 . 4.42 632 582 A 62 ASN HA A 65 LEU HB2 1.0 . 4.01 633 583 A 65 LEU HA A 68 GLN HBx 1.0 . 3.79 634 584 A 9 TRP HA A 12 VAL HB 1.0 . 4.85 635 585 A 17 SER HA A 32 GLY HAx 1.0 . 3.58 636 586 A 14 GLN HA A 17 SER HB2 1.0 . 5.61 637 586 A 14 GLN HA A 17 SER HB3 1.0 . 5.61 638 587 A 21 TRP HA A 32 GLY HAy 1.0 . 2.83 639 588 A 59 ALA HA A 62 ASN HBx 1.0 . 3.89 640 589 A 71 ASP HA A 70 LEU HBy 1.0 . 4.91 641 590 A 32 GLY HAx A 31 GLY HA2 1.0 . 6.95 642 590 A 31 GLY HA3 A 32 GLY HAx 1.0 . 6.95 643 591 A 33 LEU HA A 32 GLY HAx 1.0 . 4.60 644 592 A 5 PRO HBy A 5 PRO HA 1.0 . 3.05 645 593 A 5 PRO HA A 5 PRO HBx 1.0 . 3.33 646 594 A 7 PRO HA A 7 PRO HBx 1.0 . 2.68 647 595 A 7 PRO HA A 7 PRO HBy 1.0 . 2.99 648 596 A 40 TRP HBy A 37 PRO HA 1.0 . 3.73 649 597 A 40 TRP HBx A 37 PRO HA 1.0 . 3.89 650 598 A 37 PRO HA A 37 PRO HBy 1.0 . 3.14 651 599 A 37 PRO HA A 37 PRO HBx 1.0 . 3.83 652 600 A 49 PRO HA A 49 PRO HBx 1.0 . 2.62 653 601 A 74 PRO HB2 A 74 PRO HA 1.0 . 2.77 654 602 A 49 PRO HA A 49 PRO HBy 1.0 . 2.86 655 603 A 60 VAL HA A 63 ARG HBy 1.0 . 4.42 656 604 A 61 ALA HA A 62 ASN HBx 1.0 . 4.48 657 605 A 54 ARG HA A 54 ARG HB3 1.0 . 3.52 658 606 A 74 PRO HA A 74 PRO HB3 1.0 . 2.68 659 607 A 76 CYS HA A 76 CYS HBy 1.0 . 3.86 660 608 A 76 CYS HA A 76 CYS HBx 1.0 . 3.79 661 609 A 13 ALA HA A 16 GLU HBy 1.0 . 2.93 662 610 A 64 VAL HA A 67 GLU HBy 1.0 . 3.39 663 611 A 57 GLN HGy A 57 GLN HB2 1.0 . 4.47 664 611 A 57 GLN HB3 A 57 GLN HGy 1.0 . 4.47 665 612 A 36 LYS HBy A 36 LYS HGy 1.0 . 2.87 666 613 A 36 LYS HGx A 36 LYS HGy 1.0 . 2.40 667 614 A 36 LYS HBx A 36 LYS HGy 1.0 . 2.92 668 615 A 6 SER HBy A 6 SER HBx 1.0 . 2.40 669 616 A 20 ASN HBy A 20 ASN HBx 1.0 . 2.40 670 617 A 14 GLN HA A 14 GLN HGy 1.0 . 5.50 671 618 A 14 GLN HA A 14 GLN HGx 1.0 . 5.13 672 619 A 67 GLU HBx A 67 GLU HGx 1.0 . 2.40 673 620 A 63 ARG HBx A 63 ARG HBy 1.0 . 2.40 674 621 A 63 ARG HBy A 63 ARG HD2 1.0 . 5.21 675 621 A 63 ARG HBy A 63 ARG HD3 1.0 . 5.21 676 622 A 63 ARG HBy A 63 ARG HG2 1.0 . 4.78 677 622 A 63 ARG HBy A 63 ARG HG3 1.0 . 4.78 678 623 A 55 GLU HGx A 55 GLU HB3 1.0 . 4.68 679 623 A 55 GLU HB2 A 55 GLU HGx 1.0 . 4.68 680 624 A 36 LYS HGx A 36 LYS HE2 1.0 . 6.02 681 624 A 36 LYS HGx A 36 LYS HE3 1.0 . 6.02 682 625 A 34 GLN HA A 29 LYS HBy 1.0 . 4.07 683 626 A 34 GLN HA A 29 LYS HBx 1.0 . 3.17 684 627 A 15 CYS HBy A 16 GLU HGy 1.0 . 3.08 685 628 A 16 GLU HBx A 16 GLU HGy 1.0 . 2.40 686 629 A 68 GLN HBy A 68 GLN HGy 1.0 . 2.40 687 630 A 67 GLU HA A 67 GLU HGy 1.0 . 3.83 688 631 A 54 ARG HG2 A 54 ARG HB3 1.0 . 2.62 689 632 A 54 ARG HG2 A 57 GLN HB2 1.0 . 5.61 690 632 A 57 GLN HB3 A 54 ARG HG2 1.0 . 5.61 691 633 A 36 LYS HBy A 36 LYS HE2 1.0 . 7.26 692 633 A 36 LYS HBy A 36 LYS HE3 1.0 . 7.26 693 634 A 36 LYS HBy A 36 LYS HGx 1.0 . 2.89 694 635 A 8 ASN HBx A 6 SER HBy 1.0 . 4.14 695 636 A 82 LEU HG A 82 LEU HB2 1.0 . 4.16 696 636 A 82 LEU HB3 A 82 LEU HG 1.0 . 4.16 697 637 A 68 GLN HBx A 68 GLN HGy 1.0 . 3.05 698 638 A 68 GLN HBx A 68 GLN HBy 1.0 . 2.40 699 639 A 70 LEU HG A 70 LEU HBy 1.0 . 2.40 700 640 A 36 LYS HA A 36 LYS HGx 1.0 . 3.08 701 641 A 36 LYS HBx A 36 LYS HGx 1.0 . 2.87 702 642 A 40 TRP HBy A 40 TRP HBx 1.0 . 2.40 703 643 A 80 SER HBy A 80 SER HBx 1.0 . 2.40 704 644 A 80 SER HBx A 82 LEU HG 1.0 . 2.77 705 645 A 24 ASN HBy A 24 ASN HBx 1.0 . 2.40 706 646 A 14 GLN HGy A 14 GLN HBy 1.0 . 3.67 707 647 A 14 GLN HGx A 14 GLN HBy 1.0 . 3.27 708 648 A 68 GLN HA A 68 GLN HGy 1.0 . 4.48 709 649 A 68 GLN HA A 68 GLN HGx 1.0 . 3.67 710 650 A 65 LEU HA A 65 LEU HG 1.0 . 3.73 711 651 A 54 ARG HA A 54 ARG HG2 1.0 . 2.40 712 652 A 57 GLN HA A 57 GLN HGy 1.0 . 3.79 713 653 A 57 GLN HA A 57 GLN HGx 1.0 . 2.68 714 654 A 34 GLN HBy A 34 GLN HG2 1.0 . 5.71 715 654 A 34 GLN HBy A 34 GLN HG3 1.0 . 5.71 716 655 A 39 THR HB A 36 LYS HBx 1.0 . 3.52 717 656 A 34 GLN HA A 34 GLN HG2 1.0 . 6.02 718 656 A 34 GLN HA A 34 GLN HG3 1.0 . 6.02 719 657 A 34 GLN HBx A 34 GLN HG2 1.0 . 4.16 720 657 A 34 GLN HBx A 34 GLN HG3 1.0 . 4.16 721 658 A 16 GLU HGy A 16 GLU HGx 1.0 . 2.40 722 659 A 15 CYS HBy A 16 GLU HGx 1.0 . 4.01 723 660 A 68 GLN HGx A 68 GLN HGy 1.0 . 2.40 724 661 A 68 GLN HBx A 68 GLN HGx 1.0 . 2.43 725 662 A 29 LYS HBx A 29 LYS HBy 1.0 . 3.52 726 663 A 63 ARG HA A 63 ARG HG2 1.0 . 5.15 727 663 A 63 ARG HA A 63 ARG HG3 1.0 . 5.15 728 664 A 54 ARG HG2 A 54 ARG HD3 1.0 . 2.59 729 665 A 54 ARG HA A 54 ARG HD3 1.0 . 4.42 730 666 A 54 ARG HB3 A 54 ARG HD3 1.0 . 3.14 731 667 A 56 GLN HA A 56 GLN HG2 1.0 . 4.90 732 667 A 56 GLN HA A 56 GLN HG3 1.0 . 4.90 733 668 A 57 GLN HGy A 57 GLN HGx 1.0 . 2.40 734 669 A 57 GLN HGx A 57 GLN HB2 1.0 . 4.40 735 669 A 57 GLN HB3 A 57 GLN HGx 1.0 . 4.40 736 670 A 35 PHE HBy A 35 PHE HBx 1.0 . 2.40 737 671 A 36 LYS HBy A 36 LYS HBx 1.0 . 2.40 738 672 A 10 ASP HBy A 10 ASP HBx 1.0 . 2.40 739 673 A 33 LEU HBx A 33 LEU HBy 1.0 . 2.40 740 674 A 27 ASN HBx A 27 ASN HBy 1.0 . 2.40 741 675 A 16 GLU HA A 16 GLU HGy 1.0 . 3.52 742 676 A 15 CYS HBy A 15 CYS HBx 1.0 . 2.40 743 677 A 67 GLU HBy A 67 GLU HBx 1.0 . 2.65 744 678 A 67 GLU HBy A 67 GLU HGx 1.0 . 2.40 745 679 A 67 GLU HBy A 67 GLU HGy 1.0 . 3.14 746 680 A 70 LEU HBx A 70 LEU HBy 1.0 . 2.40 747 681 A 36 LYS HGx A 29 LYS HG2 1.0 . 5.43 748 681 A 29 LYS HG3 A 36 LYS HGx 1.0 . 5.43 749 682 A 29 LYS HBy A 29 LYS HG2 1.0 . 5.30 750 682 A 29 LYS HBy A 29 LYS HG3 1.0 . 5.30 751 683 A 29 LYS HBx A 29 LYS HG2 1.0 . 4.56 752 683 A 29 LYS HBx A 29 LYS HG3 1.0 . 4.56 753 684 A 48 ASN HBy A 48 ASN HBx 1.0 . 2.40 754 685 A 53 SER HBy A 53 SER HBx 1.0 . 2.40 755 686 A 55 GLU HA A 55 GLU HGx 1.0 . 3.67 756 687 A 56 GLN HBx A 56 GLN HBy 1.0 . 2.40 757 688 A 58 ILE HB A 58 ILE HG12 1.0 . 6.08 758 688 A 58 ILE HB A 58 ILE HG13 1.0 . 6.08 759 689 A 36 LYS HD2 A 36 LYS HE2 1.0 . 8.41 760 689 A 36 LYS HE3 A 36 LYS HD2 1.0 . 8.41 761 689 A 36 LYS HE3 A 36 LYS HD3 1.0 . 8.41 762 689 A 36 LYS HD3 A 36 LYS HE2 1.0 . 8.41 763 690 A 36 LYS HBy A 36 LYS HD2 1.0 . 5.30 764 690 A 36 LYS HBy A 36 LYS HD3 1.0 . 5.30 765 691 A 43 PHE HBy A 43 PHE HBx 1.0 . 2.40 766 692 A 9 TRP HBy A 9 TRP HBx 1.0 . 2.40 767 693 A 33 LEU HA A 34 GLN HG2 1.0 . 7.13 768 693 A 33 LEU HA A 34 GLN HG3 1.0 . 7.13 769 694 A 73 TRP HBx A 73 TRP HBy 1.0 . 2.40 770 695 A 29 LYS HE3 A 29 LYS HG2 1.0 . 9.00 771 695 A 29 LYS HG3 A 29 LYS HE2 1.0 . 9.00 772 695 A 29 LYS HG3 A 29 LYS HE3 1.0 . 9.00 773 695 A 29 LYS HE2 A 29 LYS HG2 1.0 . 9.00 774 696 A 43 PHE HBx A 60 VAL HB 1.0 . 4.73 775 697 A 62 ASN HBx A 62 ASN HBy 1.0 . 2.40 776 698 A 63 ARG HBx A 63 ARG HD2 1.0 . 5.33 777 698 A 63 ARG HBx A 63 ARG HD3 1.0 . 5.33 778 699 A 63 ARG HD3 A 62 ASN HBy 1.0 . 7.26 779 699 A 62 ASN HBy A 63 ARG HD2 1.0 . 7.26 780 700 A 65 LEU HG A 65 LEU HB2 1.0 . 3.02 781 701 A 55 GLU HGy A 55 GLU HB3 1.0 . 4.16 782 701 A 55 GLU HGy A 55 GLU HB2 1.0 . 4.16 783 702 A 55 GLU HGy A 55 GLU HGx 1.0 . 2.40 784 703 A 55 GLU HA A 55 GLU HGy 1.0 . 5.50 785 704 A 57 GLN HB3 A 54 ARG HD3 1.0 . 5.37 786 704 A 54 ARG HD3 A 57 GLN HB2 1.0 . 5.37 787 705 A 34 GLN HBy A 34 GLN HBx 1.0 . 2.40 788 706 A 29 LYS HBy A 34 GLN HBx 1.0 . 4.51 789 707 A 8 ASN HBy A 8 ASN HBx 1.0 . 2.40 790 708 A 21 TRP HBx A 21 TRP HBy 1.0 . 2.40 791 709 A 14 GLN HBx A 14 GLN HGy 1.0 . 4.26 792 710 A 14 GLN HBx A 14 GLN HBy 1.0 . 2.40 793 711 A 14 GLN HBx A 14 GLN HGx 1.0 . 2.49 794 712 A 67 GLU HBx A 67 GLU HGy 1.0 . 2.71 795 713 A 67 GLU HGx A 67 GLU HGy 1.0 . 2.40 796 714 A 30 TYR HBx A 30 TYR HBy 1.0 . 2.40 797 715 A 29 LYS HBx A 29 LYS HE2 1.0 . 7.26 798 715 A 29 LYS HBx A 29 LYS HE3 1.0 . 7.26 799 716 A 58 ILE HA A 58 ILE HG12 1.0 . 4.84 800 716 A 58 ILE HA A 58 ILE HG13 1.0 . 4.84 801 717 A 65 LEU HG A 63 ARG HG2 1.0 . 4.72 802 717 A 63 ARG HG3 A 65 LEU HG 1.0 . 4.72 803 718 A 63 ARG HD2 A 63 ARG HG2 1.0 . 7.33 804 718 A 63 ARG HG3 A 63 ARG HD2 1.0 . 7.33 805 718 A 63 ARG HD3 A 63 ARG HG3 1.0 . 7.33 806 718 A 63 ARG HD3 A 63 ARG HG2 1.0 . 7.33 807 719 A 35 PHE HA A 29 LYS HG2 1.0 . 5.33 808 719 A 35 PHE HA A 29 LYS HG3 1.0 . 5.33 809 720 A 30 TYR HBx A 35 PHE HBy 1.0 . 5.50 810 721 A 35 PHE HBy A 29 LYS HG2 1.0 . 7.26 811 721 A 35 PHE HBy A 29 LYS HG3 1.0 . 7.26 812 722 A 35 PHE HBx A 29 LYS HG2 1.0 . 6.08 813 722 A 35 PHE HBx A 29 LYS HG3 1.0 . 6.08 814 723 A 36 LYS HA A 37 PRO HDx 1.0 . 3.02 815 724 A 29 LYS HG3 A 36 LYS HE2 1.0 . 9.00 816 724 A 29 LYS HG2 A 36 LYS HE2 1.0 . 9.00 817 724 A 36 LYS HE3 A 29 LYS HG2 1.0 . 9.00 818 724 A 29 LYS HG3 A 36 LYS HE3 1.0 . 9.00 819 725 A 52 ALA HA A 57 GLN HGx 1.0 . 4.60 820 726 A 60 VAL HB A 63 ARG HBx 1.0 . 5.50 821 727 A 77 GLY HAy A 70 LEU HBy 1.0 . 5.50 822 728 A 5 PRO HA A 5 PRO HD2 1.0 . 6.26 823 728 A 5 PRO HA A 5 PRO HD3 1.0 . 6.26 824 729 A 5 PRO HA A 5 PRO HG2 1.0 . 7.26 825 729 A 5 PRO HA A 5 PRO HG3 1.0 . 7.26 826 730 A 5 PRO HBy A 5 PRO HBx 1.0 . 2.40 827 731 A 5 PRO HBy A 5 PRO HD2 1.0 . 5.86 828 731 A 5 PRO HBy A 5 PRO HD3 1.0 . 5.86 829 732 A 5 PRO HD2 A 5 PRO HG2 1.0 . 6.43 830 732 A 5 PRO HD3 A 5 PRO HG2 1.0 . 6.43 831 732 A 5 PRO HG3 A 5 PRO HD2 1.0 . 6.43 832 732 A 5 PRO HD3 A 5 PRO HG3 1.0 . 6.43 833 733 A 4 GLY HAy A 5 PRO HD2 1.0 . 4.22 834 733 A 4 GLY HAy A 5 PRO HD3 1.0 . 4.22 835 734 A 5 PRO HBx A 5 PRO HD2 1.0 . 6.79 836 734 A 5 PRO HBx A 5 PRO HD3 1.0 . 6.79 837 735 A 7 PRO HA A 7 PRO HG2 1.0 . 5.92 838 735 A 7 PRO HA A 7 PRO HG3 1.0 . 5.92 839 736 A 7 PRO HDy A 7 PRO HG2 1.0 . 4.50 840 736 A 7 PRO HG3 A 7 PRO HDy 1.0 . 4.50 841 737 A 7 PRO HBx A 7 PRO HDy 1.0 . 3.08 842 738 A 7 PRO HBy A 7 PRO HDy 1.0 . 3.24 843 739 A 7 PRO HDx A 7 PRO HG2 1.0 . 4.50 844 739 A 7 PRO HG3 A 7 PRO HDx 1.0 . 4.50 845 740 A 7 PRO HBx A 7 PRO HDx 1.0 . 2.71 846 741 A 7 PRO HBy A 7 PRO HG2 1.0 . 4.93 847 741 A 7 PRO HBy A 7 PRO HG3 1.0 . 4.93 848 742 A 8 ASN HBy A 7 PRO HBy 1.0 . 4.29 849 743 A 7 PRO HBy A 7 PRO HDx 1.0 . 4.04 850 744 A 7 PRO HBx A 7 PRO HBy 1.0 . 2.40 851 745 A 7 PRO HBx A 7 PRO HG2 1.0 . 4.50 852 745 A 7 PRO HBx A 7 PRO HG3 1.0 . 4.50 853 746 A 37 PRO HA A 37 PRO HGx 1.0 . 4.88 854 747 A 37 PRO HDx A 37 PRO HDy 1.0 . 2.40 855 748 A 36 LYS HA A 37 PRO HDy 1.0 . 2.83 856 749 A 37 PRO HDy A 37 PRO HGy 1.0 . 2.83 857 750 A 37 PRO HGx A 37 PRO HDy 1.0 . 2.71 858 751 A 36 LYS HGx A 37 PRO HDy 1.0 . 4.76 859 752 A 37 PRO HBx A 37 PRO HDy 1.0 . 3.98 860 753 A 37 PRO HDx A 37 PRO HGy 1.0 . 2.43 861 754 A 37 PRO HDx A 37 PRO HGx 1.0 . 2.71 862 755 A 49 PRO HA A 49 PRO HGx 1.0 . 4.01 863 756 A 49 PRO HBx A 49 PRO HBy 1.0 . 2.40 864 757 A 49 PRO HDx A 49 PRO HDy 1.0 . 2.40 865 758 A 49 PRO HBy A 49 PRO HDy 1.0 . 2.52 866 759 A 49 PRO HGx A 49 PRO HDy 1.0 . 2.96 867 760 A 49 PRO HBy A 49 PRO HDx 1.0 . 2.40 868 761 A 49 PRO HBx A 49 PRO HDx 1.0 . 4.04 869 762 A 74 PRO HB2 A 74 PRO HDy 1.0 . 2.40 870 763 A 74 PRO HDy A 74 PRO HDx 1.0 . 2.40 871 764 A 74 PRO HB2 A 74 PRO HDx 1.0 . 2.40 872 765 A 73 TRP HA A 74 PRO HDy 1.0 . 3.55 873 766 A 37 PRO HBx A 37 PRO HGy 1.0 . 2.40 874 767 A 37 PRO HGx A 37 PRO HGy 1.0 . 2.40 875 768 A 49 PRO HBx A 49 PRO HGx 1.0 . 3.05 876 769 A 37 PRO HBx A 37 PRO HGx 1.0 . 2.80 877 770 A 37 PRO HBx A 37 PRO HDx 1.0 . 3.08 878 771 A 57 GLN HB3 A 54 ARG HB3 1.0 . 5.64 879 771 A 54 ARG HB3 A 57 GLN HB2 1.0 . 5.64 880 772 A 54 ARG HB2 A 54 ARG HB3 1.0 . 2.40 881 773 A 54 ARG HB2 A 54 ARG HD3 1.0 . 3.98 882 774 A 57 GLN HB3 A 54 ARG HB2 1.0 . 5.52 883 774 A 54 ARG HB2 A 57 GLN HB2 1.0 . 5.52 884 775 A 54 ARG HG3 A 54 ARG HB3 1.0 . 3.05 885 776 A 54 ARG HG3 A 57 GLN HB2 1.0 . 6.42 886 776 A 57 GLN HB3 A 54 ARG HG3 1.0 . 6.42 887 777 A 54 ARG HA A 54 ARG HG3 1.0 . 3.24 888 778 A 54 ARG HG3 A 54 ARG HB2 1.0 . 2.93 889 779 A 54 ARG HG3 A 54 ARG HG2 1.0 . 2.40 890 780 A 54 ARG HG3 A 54 ARG HD3 1.0 . 3.33 891 781 A 65 LEU HB3 A 65 LEU HB2 1.0 . 2.40 892 782 A 65 LEU HG A 65 LEU HB3 1.0 . 2.92 893 783 A 54 ARG HD2 A 54 ARG HD3 1.0 . 2.40 894 784 A 54 ARG HD2 A 54 ARG HB3 1.0 . 3.05 895 785 A 54 ARG HD2 A 54 ARG HG2 1.0 . 2.77 896 786 A 54 ARG HD2 A 54 ARG HG3 1.0 . 3.55 897 787 A 54 ARG HA A 54 ARG HD2 1.0 . 5.50 898 788 A 74 PRO HDy A 74 PRO HB3 1.0 . 3.89 899 789 A 74 PRO HDx A 74 PRO HB3 1.0 . 3.70 900 790 A 76 CYS HBy A 76 CYS HBx 1.0 . 2.40 901 791 A 16 GLU HGy A 76 CYS HBx 1.0 . 3.24 902 792 A 16 GLU HGy A 76 CYS HBy 1.0 . 3.24 903 793 A 73 TRP HA A 74 PRO HDx 1.0 . 3.61 904 794 A 4 GLY HAx A 5 PRO HD2 1.0 . 5.09 905 794 A 4 GLY HAx A 5 PRO HD3 1.0 . 5.09 906 795 A 37 PRO HBy A 37 PRO HBx 1.0 . 2.40 907 796 A 37 PRO HBy A 37 PRO HGx 1.0 . 2.40 908 797 A 37 PRO HBy A 37 PRO HDx 1.0 . 2.40 909 798 A 37 PRO HBy A 37 PRO HDy 1.0 . 2.86 910 799 A 32 GLY HAy A 17 SER HB2 1.0 . 7.26 911 799 A 32 GLY HAy A 17 SER HB3 1.0 . 7.26 912 800 A 34 GLN HBx A 17 SER HB2 1.0 . 7.26 913 800 A 34 GLN HBx A 17 SER HB3 1.0 . 7.26 914 801 A 15 CYS HBx A 76 CYS HBy 1.0 . 3.14 915 802 A 74 PRO HB2 A 74 PRO HB3 1.0 . 2.40 916 803 A 30 TYR HBx A 49 PRO HBx 1.0 . 3.95 917 804 A 30 TYR HBy A 49 PRO HBy 1.0 . 3.05 918 805 A 30 TYR HBx A 49 PRO HBy 1.0 . 2.65 919 806 A 56 GLN HBx A 56 GLN HG2 1.0 . 4.16 920 806 A 56 GLN HBx A 56 GLN HG3 1.0 . 4.16 921 807 A 69 GLY HAy A 65 LEU HG 1.0 . 5.50 922 808 A 33 LEU HA A 16 GLU HGx 1.0 . 3.08 923 809 A 56 GLN HBx A 52 ALA HB% 1.0 . 4.46 924 810 A 56 GLN HBy A 52 ALA HB% 1.0 . 4.46 925 811 A 57 GLN HGy A 52 ALA HB% 1.0 . 5.39 926 812 A 33 LEU HBx A 12 VAL HGx% 1.0 . 4.98 927 813 A 12 VAL HA A 12 VAL HGx% 1.0 . 4.46 928 814 A 12 VAL HGx% A 75 THR HG2% 1.0 . 8.25 929 815 A 12 VAL HGx% A 12 VAL HGy% 1.0 . 6.76 930 816 A 80 SER HA A 12 VAL HGx% 1.0 . 5.14 931 817 A 14 GLN HBx A 12 VAL HGx% 1.0 . 4.46 932 818 A 33 LEU HBx A 33 LEU HDy% 1.0 . 4.64 933 819 A 80 SER HBy A 82 LEU HDx% 1.0 . 4.46 934 820 A 58 ILE HB A 61 ALA HB% 1.0 . 5.08 935 821 A 63 ARG HBy A 64 VAL HGy% 1.0 . 5.02 936 822 A 39 THR HA A 39 THR HG2% 1.0 . 4.83 937 823 A 46 VAL HA A 41 ALA HB% 1.0 . 7.56 938 824 A 46 VAL HB A 46 VAL HGy% 1.0 . 4.89 939 825 A 9 TRP HBx A 12 VAL HGx% 1.0 . 4.46 940 826 A 25 THR HA A 25 THR HG2% 1.0 . 4.46 941 827 A 19 GLY HAy A 13 ALA HB% 1.0 . 5.45 942 828 A 16 GLU HGy A 12 VAL HGy% 1.0 . 5.14 943 829 A 75 THR HA A 75 THR HG2% 1.0 . 4.58 944 830 A 30 TYR HA A 50 ALA HB% 1.0 . 6.10 945 831 A 59 ALA HB% A 60 VAL HGx% 1.0 . 9.34 946 832 A 40 TRP HBx A 60 VAL HGx% 1.0 . 5.67 947 833 A 60 VAL HA A 60 VAL HGx% 1.0 . 4.46 948 834 A 60 VAL HGx% A 60 VAL HGy% 1.0 . 6.95 949 835 A 43 PHE HBx A 60 VAL HGx% 1.0 . 4.55 950 836 A 48 ASN HBy A 51 ALA HB% 1.0 . 4.61 951 837 A 39 THR HG2% A 64 VAL HGy% 1.0 . 7.04 952 838 A 35 PHE HBy A 39 THR HG2% 1.0 . 6.78 953 839 A 72 ALA HB% A 39 THR HG2% 1.0 . 9.62 954 840 A 12 VAL HA A 12 VAL HGy% 1.0 . 4.80 955 841 A 8 ASN HBx A 78 ALA HB% 1.0 . 6.13 956 842 A 68 GLN HBx A 65 LEU HDy% 1.0 . 5.20 957 843 A 70 LEU HDx% A 70 LEU HBy 1.0 . 7.56 958 844 A 72 ALA HA A 72 ALA HB% 1.0 . 4.46 959 845 A 58 ILE HA A 58 ILE HD1% 1.0 . 4.71 960 846 A 58 ILE HG2% A 58 ILE HD1% 1.0 . 6.52 961 847 A 58 ILE HB A 58 ILE HD1% 1.0 . 4.46 962 848 A 58 ILE HA A 61 ALA HB% 1.0 . 4.46 963 849 A 43 PHE HBy A 64 VAL HGx% 1.0 . 4.83 964 850 A 9 TRP HA A 12 VAL HGx% 1.0 . 4.71 965 851 A 33 LEU HBx A 33 LEU HDx% 1.0 . 4.46 966 852 A 33 LEU HBy A 33 LEU HDx% 1.0 . 4.58 967 853 A 33 LEU HA A 33 LEU HDx% 1.0 . 4.46 968 854 A 80 SER HBx A 82 LEU HDx% 1.0 . 4.71 969 855 A 60 VAL HA A 60 VAL HGy% 1.0 . 4.95 970 856 A 65 LEU HA A 65 LEU HDy% 1.0 . 5.51 971 857 A 65 LEU HA A 65 LEU HDx% 1.0 . 4.46 972 858 A 66 ALA HA A 66 ALA HB% 1.0 . 4.46 973 859 A 50 ALA HA A 50 ALA HB% 1.0 . 4.46 974 860 A 30 TYR HBx A 50 ALA HB% 1.0 . 6.26 975 861 A 39 THR HB A 39 THR HG2% 1.0 . 4.46 976 862 A 11 ALA HA A 11 ALA HB% 1.0 . 4.46 977 863 A 75 THR HB A 75 THR HG2% 1.0 . 5.36 978 864 A 30 TYR HBy A 50 ALA HB% 1.0 . 6.22 979 865 A 58 ILE HA A 58 ILE HG2% 1.0 . 4.55 980 866 A 58 ILE HB A 58 ILE HG2% 1.0 . 4.46 981 867 A 45 GLY HAx A 60 VAL HGy% 1.0 . 6.01 982 868 A 63 ARG HA A 66 ALA HB% 1.0 . 4.46 983 869 A 52 ALA HA A 52 ALA HB% 1.0 . 5.02 984 870 A 56 GLN HA A 59 ALA HB% 1.0 . 4.55 985 871 A 57 GLN HGx A 52 ALA HB% 1.0 . 5.51 986 872 A 40 TRP HA A 60 VAL HGx% 1.0 . 4.77 987 873 A 40 TRP HA A 39 THR HG2% 1.0 . 5.51 988 874 A 12 VAL HB A 12 VAL HGy% 1.0 . 6.07 989 875 A 12 VAL HB A 13 ALA HB% 1.0 . 4.46 990 876 A 33 LEU HBy A 33 LEU HDy% 1.0 . 5.64 991 877 A 59 ALA HA A 59 ALA HB% 1.0 . 4.46 992 878 A 59 ALA HA A 58 ILE HG2% 1.0 . 5.33 993 879 A 61 ALA HA A 61 ALA HB% 1.0 . 4.46 994 880 A 64 VAL HB A 64 VAL HGx% 1.0 . 4.49 995 881 A 43 PHE HBx A 64 VAL HGx% 1.0 . 4.46 996 882 A 69 GLY HAy A 65 LEU HDx% 1.0 . 5.11 997 883 A 65 LEU HDy% A 65 LEU HDx% 1.0 . 7.97 998 884 A 65 LEU HG A 65 LEU HDx% 1.0 . 4.46 999 885 A 69 GLY HAx A 65 LEU HDx% 1.0 . 7.12 1000 886 A 41 ALA HA A 41 ALA HB% 1.0 . 4.46 1001 887 A 46 VAL HB A 46 VAL HGx% 1.0 . 6.26 1002 888 A 9 TRP HBy A 12 VAL HGx% 1.0 . 4.46 1003 889 A 33 LEU HA A 33 LEU HDy% 1.0 . 4.71 1004 890 A 22 ALA HA A 22 ALA HB% 1.0 . 4.46 1005 891 A 60 VAL HB A 60 VAL HGx% 1.0 . 4.46 1006 892 A 60 VAL HB A 60 VAL HGy% 1.0 . 4.46 1007 893 A 65 LEU HDy% A 65 LEU HB2 1.0 . 7.56 1008 894 A 65 LEU HDx% A 65 LEU HB2 1.0 . 4.55 1009 895 A 51 ALA HA A 51 ALA HB% 1.0 . 4.46 1010 896 A 42 ALA HA A 42 ALA HB% 1.0 . 4.46 1011 897 A 43 PHE HBx A 42 ALA HB% 1.0 . 5.73 1012 898 A 14 GLN HBx A 13 ALA HB% 1.0 . 6.13 1013 899 A 12 VAL HA A 11 ALA HB% 1.0 . 5.14 1014 900 A 81 GLY HAy A 11 ALA HB% 1.0 . 4.46 1015 901 A 8 ASN HBy A 78 ALA HB% 1.0 . 5.26 1016 902 A 82 LEU HA A 82 LEU HDy% 1.0 . 4.52 1017 903 A 25 THR HB A 25 THR HG2% 1.0 . 4.77 1018 904 A 78 ALA HA A 78 ALA HB% 1.0 . 4.46 1019 905 A 58 ILE HD1% A 58 ILE HG12 1.0 . 6.45 1020 905 A 58 ILE HG13 A 58 ILE HD1% 1.0 . 6.45 1021 906 A 58 ILE HG2% A 58 ILE HG12 1.0 . 7.35 1022 906 A 58 ILE HG13 A 58 ILE HG2% 1.0 . 7.35 1023 907 A 12 VAL HGy% A 16 GLU HGx 1.0 . 5.11 1024 908 A 43 PHE HBx A 39 THR HG2% 1.0 . 5.11 1025 909 A 39 THR HG2% A 37 PRO HGx 1.0 . 6.10 1026 910 A 52 ALA HA A 51 ALA HB% 1.0 . 6.32 1027 911 A 49 PRO HA A 52 ALA HB% 1.0 . 4.46 1028 912 A 59 ALA HB% A 63 ARG HG2 1.0 . 8.03 1029 912 A 59 ALA HB% A 63 ARG HG3 1.0 . 8.03 1030 913 A 62 ASN HBx A 59 ALA HB% 1.0 . 6.29 1031 914 A 61 ALA HA A 64 VAL HGy% 1.0 . 4.58 1032 915 A 62 ASN HBx A 66 ALA HB% 1.0 . 6.66 1033 916 A 66 ALA HB% A 63 ARG HD2 1.0 . 8.06 1034 916 A 63 ARG HD3 A 66 ALA HB% 1.0 . 8.06 1035 917 A 64 VAL HGx% A 65 LEU HDx% 1.0 . 8.34 1036 918 A 72 ALA HA A 39 THR HG2% 1.0 . 7.37 1037 919 A 74 PRO HB2 A 75 THR HG2% 1.0 . 5.26 1038 920 A 77 GLY HAy A 70 LEU HDx% 1.0 . 5.95 1039 921 A 77 GLY HAy A 78 ALA HB% 1.0 . 6.63 1040 922 A 7 PRO HA A 82 LEU HDy% 1.0 . 5.70 1041 923 A 7 PRO HDx A 82 LEU HDy% 1.0 . 6.35 1042 924 A 7 PRO HBy A 82 LEU HDy% 1.0 . 6.47 1043 925 A 82 LEU HDy% A 7 PRO HG2 1.0 . 7.32 1044 925 A 7 PRO HG3 A 82 LEU HDy% 1.0 . 7.32 1045 926 A 54 ARG HG3 A 58 ILE HD1% 1.0 . 6.07 1046 927 A 65 LEU HDx% A 65 LEU HB3 1.0 . 4.77 1047 928 A 65 LEU HDy% A 65 LEU HB3 1.0 . 5.98 1048 929 A 80 SER HA A 82 LEU HDx% 1.0 . 4.74 1049 930 A 73 TRP HBx A 12 VAL HGy% 1.0 . 7.43 1050 931 A 12 VAL HGy% A 76 CYS HBy 1.0 . 5.76 1051 932 A 12 VAL HGy% A 76 CYS HBx 1.0 . 5.57 1052 933 A 23 ALA HB% A 17 SER HB2 1.0 . 7.60 1053 933 A 17 SER HB3 A 23 ALA HB% 1.0 . 7.60 1054 934 A 23 ALA HA A 23 ALA HB% 1.0 . 4.46 1055 935 A 64 VAL HA A 64 VAL HGx% 1.0 . 4.46 1056 936 A 42 ALA HB% A 64 VAL HGx% 1.0 . 8.50 1057 937 A 38 ALA HA A 38 ALA HB1 1.0 . 4.46 1058 938 A 38 ALA HA A 41 ALA HB% 1.0 . 4.92 1059 939 A 13 ALA HA A 13 ALA HB% 1.0 . 4.46 1060 940 A 20 ASN HBy A 23 ALA HB% 1.0 . 5.11 1061 941 A 20 ASN HBx A 23 ALA HB% 1.0 . 6.26 1062 942 A 43 PHE HBy A 43 PHE HD1 1.0 . 3.59 1063 943 A 43 PHE HBx A 43 PHE HD1 1.0 . 3.29 1064 944 A 9 TRP HBy A 9 TRP HD1 1.0 . 3.42 1065 945 A 9 TRP HBx A 9 TRP HD1 1.0 . 3.68 1066 946 A 73 TRP HD1 A 73 TRP HBy 1.0 . 5.61 1067 946 A 73 TRP HBx A 73 TRP HD1 1.0 . 5.61 1068 947 A 40 TRP HBy A 40 TRP HD1 1.0 . 3.74 1069 948 A 40 TRP HBx A 40 TRP HD1 1.0 . 3.79 1070 949 A 21 TRP HD1 A 21 TRP HBy 1.0 . 4.38 1071 950 A 21 TRP HBx A 21 TRP HD1 1.0 . 2.93 1072 951 A 21 TRP HA A 21 TRP HE3 1.0 . 4.06 1073 952 A 21 TRP HE3 A 21 TRP HBy 1.0 . 3.42 1074 953 A 9 TRP HBx A 9 TRP HE3 1.0 . 3.73 1075 954 A 30 TYR HBy A 30 TYR HD% 1.0 . 7.14 1076 955 A 30 TYR HBx A 30 TYR HD% 1.0 . 7.05 1077 956 A 49 PRO HDx A 30 TYR HD% 1.0 . 7.92 1078 957 A 37 PRO HGx A 30 TYR HD% 1.0 . 8.01 1079 958 A 37 PRO HDy A 30 TYR HD% 1.0 . 8.38 1080 959 A 37 PRO HDx A 30 TYR HD% 1.0 . 9.19 1081 960 A 30 TYR HBy A 30 TYR HE% 1.0 . 8.68 1082 961 A 30 TYR HBx A 30 TYR HE% 1.0 . 9.76 1083 962 A 37 PRO HBy A 30 TYR HE% 1.0 . 8.00 1084 963 A 37 PRO HGx A 30 TYR HE% 1.0 . 7.65 1085 964 A 37 PRO HDx A 30 TYR HE% 1.0 . 8.15 1086 965 A 37 PRO HDy A 30 TYR HE% 1.0 . 8.80 1087 966 A 30 TYR HD% A 49 PRO HGy 1.0 . 9.78 1088 967 A 30 TYR HD% A 30 TYR HE% 1.0 . 10.94 1089 968 A 35 PHE HD% A 40 TRP HE3 1.0 . 9.40 1090 969 A 35 PHE HBy A 35 PHE HD% 1.0 . 8.16 1091 970 A 35 PHE HBx A 35 PHE HD% 1.0 . 8.07 1092 971 A 58 ILE HB A 9 TRP HD1 1.0 . 4.05 1093 972 A 40 TRP HBx A 40 TRP HE3 1.0 . 4.16 1094 973 A 9 TRP HD1 A 9 TRP HE3 1.0 . 3.39 1095 974 A 16 GLU HGy A 73 TRP HD1 1.0 . 3.21 1096 975 A 16 GLU HBy A 73 TRP HD1 1.0 . 2.49 1097 976 A 73 TRP HD1 A 73 TRP HZ2 1.0 . 3.39 1098 977 A 73 TRP HZ2 A 73 TRP HH2 1.0 . 2.40 1099 978 A 54 ARG HA A 21 TRP HE3 1.0 . 3.58 1100 979 A 41 ALA HA A 40 TRP HD1 1.0 . 4.42 1101 980 A 45 GLY HAx A 40 TRP HD1 1.0 . 4.17 1102 981 A 45 GLY HAx A 40 TRP HE3 1.0 . 4.63 1103 982 A 40 TRP HA A 40 TRP HE3 1.0 . 3.98 1104 983 A 61 ALA HA A 73 TRP HZ2 1.0 . 4.10 1105 984 A 61 ALA HA A 73 TRP HH2 1.0 . 4.20 1106 985 A 64 VAL HA A 73 TRP HH2 1.0 . 4.88 1107 986 A 40 TRP HH2 A 57 GLN HB2 1.0 . 5.52 1108 986 A 57 GLN HB3 A 40 TRP HH2 1.0 . 5.52 1109 987 A 33 LEU HBx A 73 TRP HZ2 1.0 . 3.42 1110 988 A 40 TRP HD1 A 49 PRO HGx 1.0 . 4.48 1111 989 A 64 VAL HB A 40 TRP HH2 1.0 . 4.18 1112 990 A 40 TRP HH2 A 40 TRP HZ3 1.0 . 2.77 1113 991 A 40 TRP HZ3 A 40 TRP HZ2 1.0 . 2.40 1114 992 A 40 TRP HH2 A 40 TRP HZ2 1.0 . 3.45 1115 993 A 57 GLN HGx A 40 TRP HZ3 1.0 . 4.55 1116 994 A 60 VAL HB A 40 TRP HZ3 1.0 . 4.01 1117 995 A 49 PRO HA A 40 TRP HZ2 1.0 . 4.18 1118 996 A 57 GLN HGx A 40 TRP HZ2 1.0 . 4.82 1119 997 A 60 VAL HB A 40 TRP HZ2 1.0 . 3.25 1120 998 A 40 TRP HD1 A 40 TRP HZ2 1.0 . 3.33 1121 999 A 21 TRP HH2 A 21 TRP HZ2 1.0 . 2.43 1122 1000 A 21 TRP HZ2 A 54 ARG HD3 1.0 . 6.79 1123 1000 A 54 ARG HD2 A 21 TRP HZ2 1.0 . 6.79 1124 1001 A 21 TRP HH2 A 21 TRP HZ3 1.0 . 2.40 1125 1002 A 21 TRP HH2 A 54 ARG HB3 1.0 . 5.58 1126 1002 A 21 TRP HH2 A 54 ARG HB2 1.0 . 5.58 1127 1003 A 73 TRP HZ3 A 70 LEU HBy 1.0 . 5.68 1128 1003 A 70 LEU HBx A 73 TRP HZ3 1.0 . 5.68 1129 1004 A 33 LEU HBy A 73 TRP HZ2 1.0 . 4.60 1130 1005 A 73 TRP HE3 A 65 LEU HB2 1.0 . 5.06 1131 1005 A 65 LEU HB3 A 73 TRP HE3 1.0 . 5.06 1132 1006 A 58 ILE HB A 9 TRP HZ3 1.0 . 4.07 1133 1007 A 33 LEU HG A 9 TRP HZ3 1.0 . 2.40 1134 1008 A 10 ASP HBy A 21 TRP HZ2 1.0 . 5.25 1135 1009 A 43 PHE HBx A 43 PHE HE1 1.0 . 3.67 1136 1010 A 21 TRP HE3 A 57 GLN HB2 1.0 . 7.26 1137 1010 A 57 GLN HB3 A 21 TRP HE3 1.0 . 7.26 1138 1011 A 57 GLN HGx A 21 TRP HE3 1.0 . 4.17 1139 1012 A 9 TRP HD1 A 58 ILE HD1% 1.0 . 4.46 1140 1013 A 60 VAL HGx% A 40 TRP HE3 1.0 . 5.45 1141 1014 A 73 TRP HD1 A 12 VAL HGy% 1.0 . 5.51 1142 1015 A 39 THR HG2% A 35 PHE HD% 1.0 . 11.33 1143 1016 A 61 ALA HB% A 73 TRP HZ2 1.0 . 5.02 1144 1017 A 73 TRP HZ2 A 64 VAL HGy% 1.0 . 5.20 1145 1018 A 73 TRP HH2 A 64 VAL HGy% 1.0 . 5.17 1146 1019 A 61 ALA HB% A 73 TRP HH2 1.0 . 5.57 1147 1020 A 64 VAL HGx% A 43 PHE HD1 1.0 . 5.33 1148 1021 A 40 TRP HH2 A 64 VAL HGy% 1.0 . 4.80 1149 1022 A 58 ILE HD1% A 21 TRP HZ2 1.0 . 5.17 1150 1023 A 13 ALA HB% A 21 TRP HZ2 1.0 . 4.55 1151 1024 A 13 ALA HB% A 21 TRP HZ3 1.0 . 6.75 1152 1025 A 13 ALA HB% A 21 TRP HH2 1.0 . 5.82 1153 1026 A 39 THR HG2% A 35 PHE HE1 1.0 . 6.01 1154 1027 A 64 VAL HGx% A 35 PHE HE1 1.0 . 4.92 1155 1028 A 61 ALA HB% A 35 PHE HE1 1.0 . 5.82 1156 1029 A 70 LEU HDx% A 73 TRP HZ3 1.0 . 7.25 1157 1030 A 50 ALA HB% A 30 TYR HD% 1.0 . 10.07 stop_ save_