data_nef_c18541_2luu 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 1MKN PDB 1MKC BMRB 18540 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 18 CYS SG 1 42 CYS SG 1 26 CYS SG 1 51 CYS SG 1 33 CYS SG 1 55 CYS SG 1 65 CYS SG 1 97 CYS SG 1 75 CYS SG 1 107 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 SER middle . . 3 A 3 MET middle . . 4 A 4 LYS middle . . 5 A 5 LYS middle . . 6 A 6 LYS middle . . 7 A 7 GLU middle . . 8 A 8 LYS middle . . 9 A 9 GLY middle . false 10 A 10 LYS middle . . 11 A 11 GLU middle . . 12 A 12 PRO middle . false 13 A 13 LYS middle . . 14 A 14 ALA middle . . 15 A 15 ASP middle . . 16 A 16 ALA middle . . 17 A 17 GLU middle . . 18 A 18 CYS middle -HG . 19 A 19 SER middle . . 20 A 20 GLU middle . . 21 A 21 TRP middle . . 22 A 22 GLN middle . . 23 A 23 TYR middle . . 24 A 24 GLY middle . false 25 A 25 LYS middle . . 26 A 26 CYS middle -HG . 27 A 27 VAL middle . . 28 A 28 PRO middle . false 29 A 29 ASN middle . . 30 A 30 SER middle . . 31 A 31 GLY middle . false 32 A 32 ASP middle . . 33 A 33 CYS middle -HG . 34 A 34 GLY middle . false 35 A 35 ASN middle . . 36 A 36 GLY middle . false 37 A 37 ILE middle . . 38 A 38 ARG middle . . 39 A 39 GLU middle . . 40 A 40 ALA middle . . 41 A 41 THR middle . . 42 A 42 CYS middle -HG . 43 A 43 ASN middle . . 44 A 44 GLU middle . . 45 A 45 GLN middle . . 46 A 46 THR middle . . 47 A 47 LYS middle . . 48 A 48 LYS middle . . 49 A 49 THR middle . . 50 A 50 LYS middle . . 51 A 51 CYS middle -HG . 52 A 52 LYS middle . . 53 A 53 VAL middle . . 54 A 54 PRO middle . false 55 A 55 CYS middle -HG . 56 A 56 ASN middle . . 57 A 57 TRP middle . . 58 A 58 LYS middle . . 59 A 59 LYS middle . . 60 A 60 ASP middle . . 61 A 61 PHE middle . . 62 A 62 GLY middle . false 63 A 63 ALA middle . . 64 A 64 ASP middle . . 65 A 65 CYS middle -HG . 66 A 66 LYS middle . . 67 A 67 TYR middle . . 68 A 68 LYS middle . . 69 A 69 PHE middle . . 70 A 70 GLY middle . false 71 A 71 ARG middle . . 72 A 72 TRP middle . . 73 A 73 ALA middle . . 74 A 74 GLU middle . . 75 A 75 CYS middle -HG . 76 A 76 ASP middle . . 77 A 77 THR middle . . 78 A 78 THR middle . . 79 A 79 THR middle . . 80 A 80 GLY middle . false 81 A 81 THR middle . . 82 A 82 ARG middle . . 83 A 83 SER middle . . 84 A 84 ARG middle . . 85 A 85 SER middle . . 86 A 86 GLY middle . false 87 A 87 THR middle . . 88 A 88 LEU middle . . 89 A 89 LYS middle . . 90 A 90 LYS middle . . 91 A 91 ALA middle . . 92 A 92 LEU middle . . 93 A 93 PHE middle . . 94 A 94 ASN middle . . 95 A 95 ALA middle . . 96 A 96 GLU middle . . 97 A 97 CYS middle -HG . 98 A 98 GLN middle . . 99 A 99 THR middle . . 100 A 100 THR middle . . 101 A 101 ILE middle . . 102 A 102 LYS middle . . 103 A 103 VAL middle . . 104 A 104 SER middle . . 105 A 105 LYS middle . . 106 A 106 PRO middle . false 107 A 107 CYS middle -HG . 108 A 108 THR middle . . 109 A 109 PRO middle . false 110 A 110 LYS middle . . 111 A 111 THR middle . . 112 A 112 PRO middle . false 113 A 113 LYS middle . . 114 A 114 PRO middle . false 115 A 115 LYS middle . . 116 A 116 GLY middle . false 117 A 117 GLY middle . false 118 A 118 GLU middle . . 119 A 119 LYS middle . . 120 A 120 LYS middle . . 121 A 121 LYS middle . . 122 A 122 GLY middle . false 123 A 123 LYS middle . . 124 A 124 GLY middle . false 125 A 125 LYS middle . . 126 A 126 GLU middle . . 127 A 127 ASN 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 5 LYS HA H 1 4.297 0.03 A 5 LYS HB3 H 1 1.774 0.03 A 5 LYS CA C 13 56.021 0.30 A 5 LYS CB C 13 33.298 0.30 A 6 LYS H H 1 8.476 0.03 A 6 LYS HA H 1 4.264 0.03 A 6 LYS CA C 13 55.722 0.3 A 6 LYS N N 15 123.506 0.3 A 7 GLU H H 1 8.354 0.03 A 7 GLU HA H 1 4.266 0.03 A 7 GLU CA C 13 56.501 0.3 A 7 GLU N N 15 123.769 0.3 A 8 LYS H H 1 8.406 0.03 A 8 LYS HA H 1 4.229 0.03 A 8 LYS CA C 13 56.637 0.3 A 8 LYS N N 15 123.785 0.3 A 9 GLY H H 1 8.523 0.03 A 9 GLY HA3 H 1 3.923 0.03 A 9 GLY CA C 13 45.378 0.3 A 9 GLY N N 15 110.707 0.3 A 10 LYS HA H 1 4.295 0.03 A 10 LYS CA C 13 56.031 0.3 A 11 GLU H H 1 8.482 0.03 A 11 GLU HA H 1 4.521 0.03 A 11 GLU HB3 H 1 1.875 0.03 A 11 GLU HG3 H 1 2.241 0.03 A 11 GLU CA C 13 54.441 0.3 A 11 GLU CB C 13 29.497 0.3 A 11 GLU CG C 13 36.066 0.3 A 11 GLU N N 15 123.866 0.3 A 12 PRO HA H 1 4.377 0.03 A 12 PRO HB2 H 1 2.227 0.03 A 12 PRO HB3 H 1 1.832 0.03 A 12 PRO HD3 H 1 3.730 0.03 A 12 PRO HG3 H 1 1.386 0.03 A 12 PRO CA C 13 63.303 0.3 A 12 PRO CB C 13 32.522 0.3 A 12 PRO CD C 13 50.778 0.3 A 12 PRO CG C 13 24.880 0.3 A 13 LYS H H 1 8.371 0.03 A 13 LYS HA H 1 4.263 0.03 A 13 LYS HB3 H 1 1.738 0.03 A 13 LYS HG3 H 1 1.407 0.03 A 13 LYS CA C 13 56.379 0.3 A 13 LYS CB C 13 33.277 0.3 A 13 LYS CG C 13 25.004 0.3 A 13 LYS N N 15 121.851 0.3 A 14 ALA H H 1 8.376 0.03 A 14 ALA HA H 1 4.262 0.03 A 14 ALA HB% H 1 1.342 0.03 A 14 ALA CA C 13 52.458 0.03 A 14 ALA CB C 13 19.427 0.03 A 14 ALA N N 15 125.976 0.3 A 15 ASP H H 1 8.287 0.03 A 15 ASP HA H 1 4.521 0.03 A 15 ASP HB3 H 1 2.594 0.03 A 15 ASP CA C 13 54.348 0.3 A 15 ASP CB C 13 41.241 0.3 A 15 ASP N N 15 119.712 0.3 A 16 ALA H H 1 8.093 0.03 A 16 ALA HA H 1 4.291 0.03 A 16 ALA HB% H 1 1.342 0.03 A 16 ALA CA C 13 52.489 0.3 A 16 ALA CB C 13 19.644 0.3 A 16 ALA N N 15 123.569 0.3 A 17 GLU H H 1 8.276 0.03 A 17 GLU HA H 1 4.240 0.03 A 17 GLU HB3 H 1 1.911 0.03 A 17 GLU HG3 H 1 2.177 0.03 A 17 GLU CA C 13 56.269 0.3 A 17 GLU CB C 13 30.426 0.3 A 17 GLU CG C 13 36.252 0.3 A 17 GLU N N 15 120.108 0.3 A 18 CYS H H 1 8.347 0.03 A 18 CYS HA H 1 4.378 0.03 A 18 CYS HB2 H 1 2.565 0.03 A 18 CYS HB3 H 1 2.845 0.03 A 18 CYS CA C 13 57.840 0.3 A 18 CYS CB C 13 42.356 0.3 A 18 CYS N N 15 122.416 0.3 A 19 SER HA H 1 4.470 0.03 A 19 SER HB3 H 1 3.788 0.03 A 19 SER CA C 13 59.708 0.3 A 19 SER CB C 13 64.170 0.3 A 20 GLU H H 1 7.466 0.03 A 20 GLU HA H 1 4.578 0.03 A 20 GLU HB3 H 1 1.860 0.03 A 20 GLU HG3 H 1 2.119 0.03 A 20 GLU CA C 13 55.556 0.3 A 20 GLU CB C 13 30.396 0.3 A 20 GLU CG C 13 35.973 0.3 A 20 GLU N N 15 122.747 0.3 A 21 TRP H H 1 8.260 0.03 A 21 TRP HA H 1 4.190 0.03 A 21 TRP HB2 H 1 2.723 0.03 A 21 TRP HB3 H 1 2.435 0.03 A 21 TRP HD1 H 1 7.196 0.03 A 21 TRP HE1 H 1 10.038 0.03 A 21 TRP HE3 H 1 6.925 0.03 A 21 TRP HH2 H 1 6.973 0.03 A 21 TRP HZ2 H 1 7.483 0.03 A 21 TRP HZ3 H 1 6.707 0.03 A 21 TRP CA C 13 57.756 0.3 A 21 TRP CB C 13 29.714 0.3 A 21 TRP CD1 C 13 127.296 0.3 A 21 TRP CE3 C 13 120.621 0.3 A 21 TRP CH2 C 13 124.316 0.3 A 21 TRP CZ2 C 13 115.143 0.3 A 21 TRP CZ3 C 13 121.977 0.3 A 21 TRP N N 15 125.223 0.3 A 21 TRP NE1 N 15 130.505 0.3 A 22 GLN H H 1 8.838 0.03 A 22 GLN HA H 1 4.528 0.03 A 22 GLN HB2 H 1 1.982 0.03 A 22 GLN HB3 H 1 2.069 0.03 A 22 GLN HE21 H 1 7.376 0.03 A 22 GLN HE22 H 1 6.879 0.03 A 22 GLN HG3 H 1 2.234 0.03 A 22 GLN CA C 13 54.379 0.3 A 22 GLN CB C 13 29.745 0.3 A 22 GLN CG C 13 33.649 0.3 A 22 GLN N N 15 121.000 0.3 A 22 GLN NE2 N 15 112.616 0.3 A 23 TYR H H 1 8.867 0.03 A 23 TYR HA H 1 4.952 0.03 A 23 TYR HB3 H 1 2.881 0.03 A 23 TYR HD1 H 1 7.009 0.03 A 23 TYR HE1 H 1 6.614 0.03 A 23 TYR CA C 13 58.624 0.3 A 23 TYR CB C 13 41.117 0.3 A 23 TYR CD1 C 13 133.300 0.3 A 23 TYR CE1 C 13 118.142 0.3 A 23 TYR N N 15 123.216 0.3 A 24 GLY H H 1 8.784 0.03 A 24 GLY HA2 H 1 4.434 0.03 A 24 GLY HA3 H 1 3.938 0.03 A 24 GLY CA C 13 43.874 0.3 A 24 GLY N N 15 110.374 0.3 A 25 LYS H H 1 8.341 0.03 A 25 LYS HA H 1 4.168 0.03 A 25 LYS HB3 H 1 1.695 0.03 A 25 LYS HD3 H 1 1.637 0.03 A 25 LYS HE3 H 1 2.939 0.03 A 25 LYS HG3 H 1 1.371 0.03 A 25 LYS CA C 13 56.145 0.3 A 25 LYS CB C 13 33.463 0.3 A 25 LYS CD C 13 29.156 0.3 A 25 LYS CE C 13 42.275 0.3 A 25 LYS CG C 13 24.818 0.3 A 25 LYS N N 15 118.661 0.3 A 26 CYS H H 1 8.707 0.03 A 26 CYS HA H 1 4.370 0.03 A 26 CYS HB3 H 1 2.730 0.03 A 26 CYS CA C 13 55.866 0.3 A 26 CYS CB C 13 41.272 0.3 A 26 CYS N N 15 120.448 0.3 A 27 VAL H H 1 8.563 0.03 A 27 VAL HA H 1 4.320 0.03 A 27 VAL HB H 1 2.069 0.03 A 27 VAL HG1% H 1 0.918 0.03 A 27 VAL HG2% H 1 0.876 0.03 A 27 VAL CA C 13 59.894 0.3 A 27 VAL CB C 13 33.091 0.3 A 27 VAL CG1 C 13 21.007 0.3 A 27 VAL CG2 C 13 20.653 0.3 A 27 VAL N N 15 133.553 0.3 A 28 PRO HA H 1 4.140 0.03 A 28 PRO HB2 H 1 1.573 0.03 A 28 PRO HD2 H 1 3.665 0.03 A 28 PRO HD3 H 1 3.967 0.03 A 28 PRO HG2 H 1 1.328 0.03 A 28 PRO HG3 H 1 1.760 0.03 A 28 PRO CA C 13 62.900 0.3 A 28 PRO CB C 13 32.069 0.3 A 28 PRO CD C 13 51.521 0.3 A 28 PRO CG C 13 27.514 0.3 A 29 ASN H H 1 9.227 0.03 A 29 ASN HA H 1 4.435 0.03 A 29 ASN HB2 H 1 2.833 0.03 A 29 ASN HB3 H 1 2.650 0.03 A 29 ASN CA C 13 55.494 0.3 A 29 ASN CB C 13 38.359 0.3 A 29 ASN N N 15 122.812 0.3 A 30 SER H H 1 8.447 0.03 A 30 SER HA H 1 4.528 0.03 A 30 SER HB3 H 1 3.730 0.03 A 30 SER CA C 13 57.508 0.3 A 30 SER CB C 13 64.759 0.3 A 30 SER N N 15 112.217 0.3 A 31 GLY H H 1 8.507 0.03 A 31 GLY HA2 H 1 4.068 0.03 A 31 GLY HA3 H 1 3.772 0.03 A 31 GLY CA C 13 46.136 0.3 A 31 GLY N N 15 110.684 0.3 A 32 ASP H H 1 8.367 0.03 A 32 ASP HA H 1 4.672 0.03 A 32 ASP HB2 H 1 2.680 0.03 A 32 ASP CA C 13 53.356 0.3 A 32 ASP CB C 13 41.860 0.3 A 32 ASP N N 15 118.261 0.3 A 33 CYS H H 1 7.927 0.03 A 33 CYS HA H 1 4.514 0.03 A 33 CYS HB2 H 1 2.860 0.03 A 33 CYS HB3 H 1 3.866 0.03 A 33 CYS CA C 13 56.238 0.3 A 33 CYS CB C 13 48.120 0.3 A 33 CYS N N 15 113.108 0.3 A 34 GLY H H 1 9.410 0.03 A 34 GLY HA2 H 1 4.636 0.03 A 34 GLY HA3 H 1 3.744 0.03 A 34 GLY CA C 13 43.813 0.3 A 34 GLY N N 15 109.586 0.3 A 35 ASN H H 1 8.905 0.03 A 35 ASN HA H 1 4.744 0.03 A 35 ASN HB2 H 1 2.793 0.03 A 35 ASN HD21 H 1 7.699 0.03 A 35 ASN HD22 H 1 6.824 0.03 A 35 ASN CA C 13 54.596 0.3 A 35 ASN CB C 13 38.545 0.3 A 35 ASN N N 15 120.577 0.3 A 35 ASN ND2 N 15 111.253 0.3 A 36 GLY H H 1 8.796 0.03 A 36 GLY HA2 H 1 4.470 0.03 A 36 GLY HA3 H 1 3.759 0.03 A 36 GLY CA C 13 46.013 0.3 A 36 GLY N N 15 110.959 0.3 A 37 ILE H H 1 7.842 0.03 A 37 ILE HA H 1 4.931 0.03 A 37 ILE HB H 1 1.716 0.03 A 37 ILE HD1% H 1 0.695 0.03 A 37 ILE HG12 H 1 1.206 0.03 A 37 ILE HG13 H 1 1.414 0.03 A 37 ILE HG2% H 1 0.782 0.03 A 37 ILE CA C 13 58.593 0.3 A 37 ILE CB C 13 41.798 0.3 A 37 ILE CD1 C 13 11.742 0.3 A 37 ILE CG1 C 13 27.049 0.3 A 37 ILE CG2 C 13 18.466 0.3 A 37 ILE N N 15 120.668 0.3 A 38 ARG H H 1 9.149 0.03 A 38 ARG HA H 1 5.031 0.03 A 38 ARG HB2 H 1 1.601 0.03 A 38 ARG HD2 H 1 2.953 0.03 A 38 ARG HG2 H 1 1.306 0.03 A 38 ARG CA C 13 53.604 0.3 A 38 ARG CB C 13 34.052 0.3 A 38 ARG CD C 13 44.432 0.3 A 38 ARG CG C 13 26.089 0.3 A 38 ARG N N 15 125.249 0.3 A 39 GLU H H 1 9.216 0.03 A 39 GLU HA H 1 4.873 0.03 A 39 GLU HB2 H 1 1.918 0.03 A 39 GLU HG2 H 1 2.227 0.03 A 39 GLU HG3 H 1 2.033 0.03 A 39 GLU CA C 13 56.114 0.3 A 39 GLU CB C 13 31.883 0.3 A 39 GLU CG C 13 37.491 0.3 A 39 GLU N N 15 125.287 0.3 A 40 ALA H H 1 9.032 0.03 A 40 ALA HA H 1 5.312 0.03 A 40 ALA HB% H 1 0.969 0.03 A 40 ALA CA C 13 50.010 0.3 A 40 ALA CB C 13 23.734 0.3 A 40 ALA N N 15 127.892 0.3 A 41 THR H H 1 8.987 0.03 A 41 THR HA H 1 5.456 0.03 A 41 THR HB H 1 3.967 0.03 A 41 THR HG2% H 1 1.076 0.03 A 41 THR CA C 13 60.452 0.3 A 41 THR CB C 13 72.010 0.3 A 41 THR CG2 C 13 21.781 0.3 A 41 THR N N 15 114.317 0.3 A 42 CYS H H 1 8.199 0.03 A 42 CYS HA H 1 4.147 0.03 A 42 CYS HB2 H 1 1.515 0.03 A 42 CYS HB3 H 1 0.889 0.03 A 42 CYS CA C 13 56.300 0.3 A 42 CYS CB C 13 39.970 0.3 A 42 CYS N N 15 124.017 0.3 A 43 ASN H H 1 9.240 0.03 A 43 ASN HA H 1 4.147 0.03 A 43 ASN HB2 H 1 2.924 0.03 A 43 ASN HD21 H 1 7.486 0.03 A 43 ASN HD22 H 1 6.777 0.03 A 43 ASN CA C 13 55.169 0.3 A 43 ASN CB C 13 36.624 0.3 A 43 ASN N N 15 126.635 0.3 A 43 ASN ND2 N 15 112.616 0.3 A 44 GLU H H 1 8.886 0.03 A 44 GLU HA H 1 4.154 0.03 A 44 GLU HB2 H 1 2.097 0.03 A 44 GLU HG2 H 1 2.213 0.03 A 44 GLU CA C 13 57.601 0.3 A 44 GLU CB C 13 28.660 0.3 A 44 GLU CG C 13 36.593 0.3 A 44 GLU N N 15 119.286 0.3 A 45 GLN H H 1 8.168 0.03 A 45 GLN HA H 1 4.573 0.03 A 45 GLN HB2 H 1 2.097 0.03 A 45 GLN HE21 H 1 7.599 0.03 A 45 GLN HE22 H 1 7.016 0.03 A 45 GLN HG2 H 1 2.456 0.03 A 45 GLN CA C 13 55.331 0.3 A 45 GLN CB C 13 31.015 0.3 A 45 GLN CG C 13 34.238 0.3 A 45 GLN N N 15 120.676 0.3 A 45 GLN NE2 N 15 111.996 0.3 A 46 THR H H 1 8.551 0.03 A 46 THR HA H 1 5.492 0.03 A 46 THR HB H 1 3.987 0.03 A 46 THR HG2% H 1 1.132 0.03 A 46 THR CA C 13 61.196 0.3 A 46 THR CB C 13 72.010 0.3 A 46 THR CG2 C 13 21.810 0.3 A 46 THR N N 15 117.017 0.3 A 47 LYS H H 1 9.256 0.03 A 47 LYS HA H 1 4.715 0.03 A 47 LYS HB2 H 1 1.573 0.03 A 47 LYS HD2 H 1 1.055 0.03 A 47 LYS HD3 H 1 1.558 0.03 A 47 LYS HE2 H 1 2.241 0.03 A 47 LYS HE3 H 1 1.724 0.03 A 47 LYS HG2 H 1 1.041 0.03 A 47 LYS CA C 13 55.060 0.3 A 47 LYS CB C 13 35.911 0.3 A 47 LYS CD C 13 29.404 0.3 A 47 LYS CE C 13 41.660 0.3 A 47 LYS CG C 13 24.635 0.3 A 47 LYS N N 15 124.392 0.3 A 48 LYS H H 1 8.526 0.03 A 48 LYS HA H 1 5.031 0.03 A 48 LYS HB2 H 1 1.659 0.03 A 48 LYS HD2 H 1 1.565 0.03 A 48 LYS HE2 H 1 2.917 0.03 A 48 LYS HG2 H 1 1.284 0.03 A 48 LYS CA C 13 55.370 0.3 A 48 LYS CB C 13 34.300 0.3 A 48 LYS CD C 13 29.187 0.3 A 48 LYS CE C 13 42.331 0.3 A 48 LYS CG C 13 25.483 0.3 A 48 LYS N N 15 121.236 0.3 A 49 THR H H 1 8.803 0.03 A 49 THR HA H 1 4.708 0.03 A 49 THR HB H 1 4.075 0.03 A 49 THR HG2% H 1 0.997 0.03 A 49 THR CA C 13 59.925 0.3 A 49 THR CB C 13 72.010 0.3 A 49 THR CG2 C 13 21.812 0.3 A 49 THR N N 15 115.588 0.3 A 50 LYS H H 1 8.461 0.03 A 50 LYS HA H 1 4.621 0.03 A 50 LYS HB2 H 1 1.724 0.03 A 50 LYS HD2 H 1 1.652 0.03 A 50 LYS HE2 H 1 2.888 0.03 A 50 LYS HG2 H 1 1.436 0.03 A 50 LYS CA C 13 57.384 0.3 A 50 LYS CB C 13 33.215 0.3 A 50 LYS CD C 13 28.970 0.3 A 50 LYS CE C 13 42.303 0.3 A 50 LYS CG C 13 25.624 0.3 A 50 LYS N N 15 122.458 0.3 A 51 CYS H H 1 8.153 0.03 A 51 CYS HA H 1 4.873 0.03 A 51 CYS HB3 H 1 3.097 0.03 A 51 CYS CA C 13 55.060 0.3 A 51 CYS CB C 13 47.407 0.3 A 51 CYS N N 15 118.659 0.3 A 52 LYS H H 1 8.590 0.03 A 52 LYS HA H 1 4.744 0.03 A 52 LYS HB2 H 1 1.558 0.03 A 52 LYS HD2 H 1 1.551 0.03 A 52 LYS HD3 H 1 1.501 0.03 A 52 LYS HG2 H 1 1.141 0.03 A 52 LYS CA C 13 55.804 0.3 A 52 LYS CB C 13 36.314 0.3 A 52 LYS CD C 13 29.280 0.3 A 52 LYS CG C 13 25.159 0.3 A 52 LYS N N 15 120.840 0.3 A 53 VAL H H 1 8.627 0.03 A 53 VAL HA H 1 4.463 0.03 A 53 VAL HB H 1 1.788 0.03 A 53 VAL HG1% H 1 0.717 0.03 A 53 VAL HG2% H 1 1.048 0.03 A 53 VAL CA C 13 59.213 0.3 A 53 VAL CB C 13 34.889 0.3 A 53 VAL CG1 C 13 22.123 0.3 A 53 VAL CG2 C 13 20.232 0.3 A 53 VAL N N 15 126.695 0.3 A 54 PRO HA H 1 4.327 0.03 A 54 PRO HB2 H 1 1.846 0.03 A 54 PRO HB3 H 1 2.213 0.03 A 54 PRO HD3 H 1 3.813 0.03 A 54 PRO HG2 H 1 1.871 0.03 A 54 PRO HG3 H 1 1.342 0.03 A 54 PRO CA C 13 63.427 0.3 A 54 PRO CB C 13 32.306 0.3 A 54 PRO CD C 13 51.141 0.3 A 54 PRO CG C 13 27.544 0.3 A 55 CYS H H 1 8.066 0.03 A 55 CYS HA H 1 4.586 0.03 A 55 CYS HB2 H 1 1.795 0.03 A 55 CYS CA C 13 54.306 0.3 A 55 CYS CB C 13 31.635 0.3 A 55 CYS N N 15 120.797 0.3 A 56 ASN HA H 1 4.607 0.03 A 56 ASN HB2 H 1 2.730 0.03 A 56 ASN HD21 H 1 7.578 0.03 A 56 ASN HD22 H 1 6.817 0.03 A 56 ASN CA C 13 53.356 0.3 A 56 ASN CB C 13 38.576 0.3 A 56 ASN N N 15 112.710 0.3 A 57 TRP H H 1 7.927 0.03 A 57 TRP HA H 1 4.607 0.03 A 57 TRP HB2 H 1 3.255 0.03 A 57 TRP HD1 H 1 7.282 0.03 A 57 TRP HE1 H 1 10.223 0.03 A 57 TRP HE3 H 1 7.570 0.03 A 57 TRP HH2 H 1 7.160 0.03 A 57 TRP HZ2 H 1 7.491 0.03 A 57 TRP HZ3 H 1 7.074 0.03 A 57 TRP CA C 13 57.260 0.3 A 57 TRP CB C 13 29.311 0.3 A 57 TRP CD1 C 13 127.380 0.3 A 57 TRP CE3 C 13 121.002 0.3 A 57 TRP CH2 C 13 124.706 0.3 A 57 TRP CZ2 C 13 114.625 0.3 A 57 TRP CZ3 C 13 122.200 0.3 A 57 TRP N N 15 120.732 0.3 A 57 TRP NE1 N 15 129.976 0.3 A 58 LYS H H 1 7.821 0.03 A 58 LYS HA H 1 4.089 0.03 A 58 LYS HB2 H 1 1.450 0.03 A 58 LYS HB3 H 1 1.587 0.03 A 58 LYS HD2 H 1 1.537 0.03 A 58 LYS HE2 H 1 2.853 0.03 A 58 LYS HG2 H 1 0.969 0.03 A 58 LYS CA C 13 56.331 0.3 A 58 LYS CB C 13 32.937 0.3 A 58 LYS CD C 13 29.218 0.3 A 58 LYS CE C 13 42.247 0.3 A 58 LYS CG C 13 24.663 0.3 A 58 LYS N N 15 122.398 0.3 A 59 LYS H H 1 7.975 0.03 A 59 LYS HA H 1 4.082 0.03 A 59 LYS HB2 H 1 1.630 0.03 A 59 LYS HD2 H 1 1.558 0.03 A 59 LYS HG2 H 1 1.227 0.03 A 59 LYS CA C 13 56.517 0.3 A 59 LYS CB C 13 32.968 0.3 A 59 LYS CD C 13 28.939 0.3 A 59 LYS CG C 13 24.663 0.3 A 59 LYS N N 15 121.847 0.3 A 60 ASP H H 1 8.176 0.03 A 60 ASP HA H 1 4.542 0.03 A 60 ASP HB2 H 1 2.565 0.03 A 60 ASP CA C 13 54.317 0.3 A 60 ASP CB C 13 41.427 0.3 A 60 ASP N N 15 120.319 0.3 A 61 PHE H H 1 8.011 0.03 A 61 PHE HA H 1 4.621 0.03 A 61 PHE HB2 H 1 3.104 0.03 A 61 PHE HD1 H 1 7.304 0.03 A 61 PHE HE1 H 1 7.376 0.03 A 61 PHE HZ H 1 7.295 0.03 A 61 PHE CA C 13 57.973 0.3 A 61 PHE CB C 13 39.722 0.3 A 61 PHE CD2 C 13 132.142 0.3 A 61 PHE CE2 C 13 131.696 0.3 A 61 PHE CZ C 13 129.889 0.3 A 61 PHE N N 15 119.988 0.3 A 62 GLY H H 1 8.397 0.03 A 62 GLY HA2 H 1 3.931 0.03 A 62 GLY CA C 13 45.982 0.3 A 62 GLY N N 15 109.961 0.3 A 63 ALA H H 1 8.202 0.03 A 63 ALA HA H 1 4.240 0.03 A 63 ALA HB% H 1 1.364 0.03 A 63 ALA CA C 13 53.325 0.3 A 63 ALA CB C 13 19.458 0.3 A 63 ALA N N 15 123.587 0.3 A 64 ASP H H 1 8.214 0.03 A 64 ASP HA H 1 4.614 0.03 A 64 ASP HB2 H 1 2.867 0.03 A 64 ASP HB3 H 1 2.573 0.03 A 64 ASP CA C 13 54.968 0.3 A 64 ASP CB C 13 41.736 0.3 A 64 ASP N N 15 116.871 0.3 A 65 CYS H H 1 7.668 0.03 A 65 CYS HA H 1 4.658 0.03 A 65 CYS HB2 H 1 3.011 0.03 A 65 CYS HB3 H 1 2.702 0.03 A 65 CYS CA C 13 53.526 0.3 A 65 CYS CB C 13 41.489 0.3 A 65 CYS N N 15 118.304 0.3 A 66 LYS H H 1 8.142 0.03 A 66 LYS HA H 1 4.673 0.03 A 66 LYS HB2 H 1 1.652 0.03 A 66 LYS HD2 H 1 1.565 0.03 A 66 LYS HE2 H 1 2.939 0.03 A 66 LYS HG2 H 1 1.271 0.03 A 66 LYS CA C 13 53.905 0.3 A 66 LYS CB C 13 33.525 0.3 A 66 LYS CD C 13 28.753 0.3 A 66 LYS CE C 13 42.294 0.3 A 66 LYS CG C 13 24.446 0.3 A 66 LYS N N 15 122.833 0.3 A 67 TYR H H 1 8.715 0.03 A 67 TYR HA H 1 4.406 0.03 A 67 TYR HB2 H 1 1.939 0.03 A 67 TYR HB3 H 1 1.429 0.03 A 67 TYR HD1 H 1 6.383 0.03 A 67 TYR HE1 H 1 6.450 0.03 A 67 TYR CA C 13 58.364 0.3 A 67 TYR CB C 13 42.170 0.3 A 67 TYR CD1 C 13 132.520 0.3 A 67 TYR CE1 C 13 117.987 0.3 A 67 TYR N N 15 121.505 0.3 A 68 LYS H H 1 8.588 0.03 A 68 LYS HA H 1 4.521 0.03 A 68 LYS HB2 H 1 1.465 0.03 A 68 LYS HB3 H 1 1.745 0.03 A 68 LYS HD2 H 1 1.573 0.03 A 68 LYS HG2 H 1 1.206 0.03 A 68 LYS HG3 H 1 1.285 0.03 A 68 LYS CA C 13 54.751 0.3 A 68 LYS CB C 13 33.928 0.3 A 68 LYS CD C 13 28.784 0.3 A 68 LYS CG C 13 25.004 0.3 A 68 LYS N N 15 121.296 0.3 A 69 PHE H H 1 9.196 0.03 A 69 PHE HA H 1 5.154 0.03 A 69 PHE HB2 H 1 2.723 0.03 A 69 PHE HD1 H 1 6.907 0.03 A 69 PHE HE1 H 1 7.010 0.03 A 69 PHE HZ H 1 7.027 0.03 A 69 PHE CA C 13 58.593 0.3 A 69 PHE CB C 13 41.643 0.3 A 69 PHE CD1 C 13 131.474 0.3 A 69 PHE CE1 C 13 131.234 0.3 A 69 PHE CZ C 13 129.834 0.3 A 69 PHE N N 15 126.618 0.3 A 70 GLY H H 1 8.356 0.03 A 70 GLY HA2 H 1 4.384 0.03 A 70 GLY HA3 H 1 3.852 0.03 A 70 GLY CA C 13 43.662 0.3 A 70 GLY N N 15 108.695 0.3 A 71 ARG H H 1 8.393 0.03 A 71 ARG HA H 1 4.197 0.03 A 71 ARG HB2 H 1 1.714 0.03 A 71 ARG HB3 H 1 1.781 0.03 A 71 ARG HD2 H 1 3.176 0.03 A 71 ARG HG2 H 1 1.680 0.03 A 71 ARG CA C 13 55.990 0.3 A 71 ARG CB C 13 31.046 0.3 A 71 ARG CD C 13 43.596 0.3 A 71 ARG CG C 13 27.452 0.3 A 71 ARG N N 15 118.371 0.3 A 72 TRP H H 1 8.447 0.03 A 72 TRP HA H 1 4.370 0.03 A 72 TRP HB2 H 1 3.116 0.03 A 72 TRP HD1 H 1 7.419 0.03 A 72 TRP HE1 H 1 10.345 0.03 A 72 TRP HE3 H 1 7.110 0.03 A 72 TRP HH2 H 1 6.721 0.03 A 72 TRP HZ2 H 1 7.225 0.03 A 72 TRP HZ3 H 1 6.960 0.03 A 72 TRP CA C 13 58.500 0.3 A 72 TRP CB C 13 29.650 0.3 A 72 TRP CD1 C 13 128.828 0.3 A 72 TRP CE3 C 13 119.357 0.3 A 72 TRP CH2 C 13 123.756 0.3 A 72 TRP CZ2 C 13 114.802 0.3 A 72 TRP CZ3 C 13 122.811 0.3 A 72 TRP N N 15 122.001 0.3 A 72 TRP NE1 N 15 130.647 0.3 A 73 ALA H H 1 8.858 0.03 A 73 ALA HA H 1 4.528 0.03 A 73 ALA HB% H 1 1.724 0.03 A 73 ALA CA C 13 51.311 0.3 A 73 ALA CB C 13 20.201 0.3 A 73 ALA N N 15 126.678 0.3 A 74 GLU H H 1 8.376 0.03 A 74 GLU HA H 1 4.133 0.03 A 74 GLU HB2 H 1 1.961 0.03 A 74 GLU HG2 H 1 2.364 0.03 A 74 GLU CA C 13 56.548 0.3 A 74 GLU CB C 13 30.179 0.3 A 74 GLU CG C 13 36.438 0.3 A 74 GLU N N 15 117.404 0.3 A 75 CYS H H 1 8.853 0.03 A 75 CYS HA H 1 4.118 0.03 A 75 CYS HB2 H 1 2.838 0.03 A 75 CYS HB3 H 1 3.758 0.03 A 75 CYS CA C 13 57.361 0.3 A 75 CYS CB C 13 41.364 0.3 A 75 CYS N N 15 120.341 0.3 A 76 ASP H H 1 8.726 0.03 A 76 ASP HA H 1 4.801 0.03 A 76 ASP HB2 H 1 3.255 0.03 A 76 ASP HB3 H 1 2.658 0.03 A 76 ASP CA C 13 53.201 0.3 A 76 ASP CB C 13 41.984 0.3 A 76 ASP N N 15 131.518 0.3 A 77 THR H H 1 8.724 0.03 A 77 THR HA H 1 3.924 0.03 A 77 THR HB H 1 4.305 0.03 A 77 THR HG2% H 1 1.220 0.03 A 77 THR CA C 13 64.883 0.3 A 77 THR CB C 13 68.756 0.3 A 77 THR CG2 C 13 22.432 0.3 A 77 THR N N 15 119.686 0.3 A 78 THR H H 1 8.547 0.03 A 78 THR HA H 1 4.161 0.03 A 78 THR HB H 1 4.319 0.03 A 78 THR HG2% H 1 1.199 0.03 A 78 THR CA C 13 65.658 0.3 A 78 THR CB C 13 68.725 0.3 A 78 THR CG2 C 13 22.153 0.3 A 78 THR N N 15 116.273 0.3 A 79 THR H H 1 7.432 0.03 A 79 THR HA H 1 4.406 0.03 A 79 THR HB H 1 4.276 0.03 A 79 THR HG2% H 1 1.134 0.03 A 79 THR CA C 13 62.125 0.3 A 79 THR CB C 13 70.832 0.3 A 79 THR CG2 C 13 21.750 0.3 A 79 THR N N 15 130.898 0.3 A 80 GLY H H 1 8.711 0.03 A 80 GLY HA2 H 1 4.003 0.03 A 80 GLY HA3 H 1 3.687 0.03 A 80 GLY CA C 13 47.345 0.3 A 80 GLY N N 15 112.475 0.3 A 81 THR H H 1 7.379 0.03 A 81 THR HA H 1 5.118 0.03 A 81 THR HB H 1 3.938 0.03 A 81 THR HG2% H 1 0.954 0.03 A 81 THR CA C 13 59.677 0.3 A 81 THR CB C 13 73.590 0.3 A 81 THR CG2 C 13 21.750 0.3 A 81 THR N N 15 108.061 0.3 A 82 ARG H H 1 9.104 0.03 A 82 ARG HA H 1 4.974 0.03 A 82 ARG HB2 H 1 1.557 0.03 A 82 ARG HB3 H 1 1.788 0.03 A 82 ARG HD2 H 1 2.745 0.03 A 82 ARG HG2 H 1 1.508 0.03 A 82 ARG HG3 H 1 1.277 0.03 A 82 ARG CA C 13 54.379 0.3 A 82 ARG CB C 13 34.269 0.3 A 82 ARG CD C 13 44.168 0.3 A 82 ARG CG C 13 27.050 0.3 A 82 ARG N N 15 119.002 0.3 A 83 SER H H 1 7.789 0.03 A 83 SER HA H 1 6.189 0.03 A 83 SER HB2 H 1 3.821 0.03 A 83 SER HB3 H 1 3.730 0.03 A 83 SER CA C 13 57.756 0.3 A 83 SER CB C 13 67.579 0.3 A 83 SER N N 15 114.615 0.3 A 84 ARG H H 1 8.771 0.03 A 84 ARG HA H 1 4.657 0.03 A 84 ARG HB2 H 1 0.997 0.03 A 84 ARG HB3 H 1 0.778 0.03 A 84 ARG HD2 H 1 3.644 0.03 A 84 ARG HG2 H 1 1.644 0.03 A 84 ARG CA C 13 54.441 0.3 A 84 ARG CB C 13 33.308 0.3 A 84 ARG CD C 13 43.751 0.3 A 84 ARG CG C 13 29.131 0.3 A 84 ARG N N 15 119.058 0.3 A 85 SER H H 1 8.887 0.03 A 85 SER HA H 1 5.427 0.03 A 85 SER HB2 H 1 3.715 0.03 A 85 SER CA C 13 57.199 0.3 A 85 SER CB C 13 65.534 0.3 A 85 SER N N 15 116.177 0.3 A 86 GLY H H 1 8.962 0.03 A 86 GLY HA2 H 1 4.823 0.03 A 86 GLY HA3 H 1 2.443 0.03 A 86 GLY CA C 13 44.742 0.3 A 86 GLY N N 15 110.779 0.3 A 87 THR H H 1 8.323 0.03 A 87 THR HA H 1 5.031 0.03 A 87 THR HB H 1 3.924 0.03 A 87 THR HG2% H 1 1.155 0.03 A 87 THR CA C 13 60.545 0.3 A 87 THR CB C 13 71.390 0.3 A 87 THR CG2 C 13 21.595 0.3 A 87 THR N N 15 115.919 0.3 A 88 LEU H H 1 8.710 0.03 A 88 LEU HA H 1 3.428 0.03 A 88 LEU HB2 H 1 1.594 0.03 A 88 LEU HD1% H 1 0.278 0.03 A 88 LEU HD2% H 1 0.559 0.03 A 88 LEU HG H 1 1.141 0.03 A 88 LEU CA C 13 56.641 0.3 A 88 LEU CB C 13 43.348 0.3 A 88 LEU CD1 C 13 22.618 0.3 A 88 LEU CD2 C 13 26.708 0.3 A 88 LEU CG C 13 26.708 0.3 A 88 LEU N N 15 129.597 0.3 A 89 LYS H H 1 8.921 0.03 A 89 LYS HA H 1 4.248 0.03 A 89 LYS HB2 H 1 1.493 0.03 A 89 LYS HD2 H 1 1.573 0.03 A 89 LYS HE2 H 1 2.946 0.03 A 89 LYS HG2 H 1 1.199 0.03 A 89 LYS CA C 13 56.207 0.3 A 89 LYS CB C 13 33.618 0.3 A 89 LYS CD C 13 28.970 0.3 A 89 LYS CE C 13 42.356 0.3 A 89 LYS CG C 13 25.066 0.3 A 89 LYS N N 15 127.345 0.3 A 90 LYS H H 1 7.632 0.03 A 90 LYS HA H 1 4.140 0.03 A 90 LYS HB2 H 1 1.573 0.03 A 90 LYS HD2 H 1 1.565 0.03 A 90 LYS HE2 H 1 2.853 0.03 A 90 LYS HG2 H 1 1.199 0.03 A 90 LYS CA C 13 56.548 0.3 A 90 LYS CB C 13 34.610 0.3 A 90 LYS CD C 13 29.125 0.3 A 90 LYS CE C 13 42.294 0.3 A 90 LYS CG C 13 24.787 0.3 A 90 LYS N N 15 119.544 0.3 A 91 ALA H H 1 8.349 0.03 A 91 ALA HA H 1 4.729 0.03 A 91 ALA HB% H 1 1.227 0.03 A 91 ALA CA C 13 51.063 0.3 A 91 ALA CB C 13 21.410 0.3 A 91 ALA N N 15 127.513 0.3 A 92 LEU H H 1 8.461 0.03 A 92 LEU HA H 1 4.183 0.03 A 92 LEU HB2 H 1 1.526 0.03 A 92 LEU HB3 H 1 1.156 0.03 A 92 LEU HD1% H 1 0.774 0.03 A 92 LEU HD2% H 1 0.674 0.03 A 92 LEU HG H 1 1.407 0.03 A 92 LEU CA C 13 54.918 0.3 A 92 LEU CB C 13 42.697 0.3 A 92 LEU CD1 C 13 25.438 0.3 A 92 LEU CD2 C 13 23.393 0.3 A 92 LEU CG C 13 27.700 0.3 A 92 LEU N N 15 122.705 0.3 A 93 PHE H H 1 8.265 0.03 A 93 PHE HA H 1 4.312 0.03 A 93 PHE HB2 H 1 3.090 0.03 A 93 PHE HD1 H 1 7.167 0.03 A 93 PHE HE1 H 1 7.256 0.03 A 93 PHE HZ H 1 7.220 0.03 A 93 PHE CA C 13 58.345 0.3 A 93 PHE CB C 13 37.987 0.3 A 93 PHE CD1 C 13 132.392 0.3 A 93 PHE CE1 C 13 131.404 0.3 A 93 PHE CZ C 13 129.643 0.3 A 93 PHE N N 15 117.486 0.3 A 94 ASN H H 1 8.298 0.03 A 94 ASN HA H 1 4.442 0.03 A 94 ASN HB2 H 1 2.802 0.03 A 94 ASN HD21 H 1 7.488 0.03 A 94 ASN HD22 H 1 6.838 0.03 A 94 ASN CA C 13 53.418 0.3 A 94 ASN CB C 13 38.297 0.3 A 94 ASN N N 15 116.556 0.3 A 94 ASN ND2 N 15 112.399 0.3 A 95 ALA H H 1 7.807 0.03 A 95 ALA HA H 1 4.104 0.03 A 95 ALA HB% H 1 1.350 0.03 A 95 ALA CA C 13 53.263 0.3 A 95 ALA CB C 13 20.325 0.3 A 95 ALA N N 15 122.303 0.3 A 96 GLU H H 1 8.273 0.03 A 96 GLU HA H 1 4.291 0.03 A 96 GLU HB2 H 1 1.925 0.03 A 96 GLU HG2 H 1 2.148 0.03 A 96 GLU CA C 13 55.928 0.3 A 96 GLU CB C 13 29.435 0.3 A 96 GLU CG C 13 36.345 0.3 A 96 GLU N N 15 120.053 0.3 A 97 CYS H H 1 7.959 0.03 A 97 CYS HA H 1 4.816 0.03 A 97 CYS HB2 H 1 2.572 0.03 A 97 CYS HB3 H 1 2.888 0.03 A 97 CYS CA C 13 53.759 0.3 A 97 CYS CB C 13 44.030 0.3 A 97 CYS N N 15 121.322 0.3 A 98 GLN H H 1 8.795 0.03 A 98 GLN HA H 1 4.363 0.03 A 98 GLN HB2 H 1 1.860 0.03 A 98 GLN HB3 H 1 2.191 0.03 A 98 GLN HE21 H 1 7.757 0.03 A 98 GLN HE22 H 1 6.948 0.03 A 98 GLN HG2 H 1 2.457 0.03 A 98 GLN CA C 13 55.928 0.3 A 98 GLN CB C 13 29.249 0.3 A 98 GLN CG C 13 34.331 0.3 A 98 GLN N N 15 123.105 0.3 A 98 GLN NE2 N 15 113.112 0.3 A 99 THR H H 1 8.988 0.03 A 99 THR HA H 1 3.989 0.03 A 99 THR HB H 1 4.291 0.03 A 99 THR HG2% H 1 1.292 0.03 A 99 THR CA C 13 66.556 0.3 A 99 THR CB C 13 68.942 0.3 A 99 THR CG2 C 13 22.773 0.3 A 99 THR N N 15 119.299 0.3 A 100 THR H H 1 7.637 0.03 A 100 THR HA H 1 5.305 0.03 A 100 THR HB H 1 3.996 0.03 A 100 THR HG2% H 1 1.148 0.03 A 100 THR CA C 13 60.235 0.3 A 100 THR CB C 13 72.010 0.3 A 100 THR CG2 C 13 21.812 0.3 A 100 THR N N 15 112.875 0.3 A 101 ILE H H 1 8.230 0.03 A 101 ILE HA H 1 4.528 0.03 A 101 ILE HB H 1 1.242 0.03 A 101 ILE HD1% H 1 0.0480 0.03 A 101 ILE HG12 H 1 0.724 0.03 A 101 ILE HG13 H 1 0.0049 0.03 A 101 ILE HG2% H 1 0.192 0.03 A 101 ILE CA C 13 59.368 0.3 A 101 ILE CB C 13 42.914 0.3 A 101 ILE CD1 C 13 14.004 0.3 A 101 ILE CG1 C 13 26.057 0.3 A 101 ILE CG2 C 13 17.691 0.3 A 101 ILE N N 15 117.887 0.3 A 102 LYS H H 1 8.252 0.03 A 102 LYS HA H 1 5.103 0.03 A 102 LYS HB2 H 1 1.630 0.03 A 102 LYS HD2 H 1 1.565 0.03 A 102 LYS HE2 H 1 2.948 0.03 A 102 LYS HG2 H 1 1.263 0.03 A 102 LYS CA C 13 55.463 0.3 A 102 LYS CB C 13 35.106 0.3 A 102 LYS CD C 13 29.342 0.3 A 102 LYS CE C 13 42.350 0.3 A 102 LYS CG C 13 25.004 0.3 A 102 LYS N N 15 123.694 0.3 A 103 VAL H H 1 8.688 0.03 A 103 VAL HA H 1 4.672 0.03 A 103 VAL HB H 1 1.961 0.03 A 103 VAL HG1% H 1 0.875 0.03 A 103 VAL HG2% H 1 0.580 0.03 A 103 VAL CA C 13 60.142 0.3 A 103 VAL CB C 13 35.044 0.3 A 103 VAL CG1 C 13 21.968 0.3 A 103 VAL CG2 C 13 20.697 0.3 A 103 VAL N N 15 121.227 0.3 A 104 SER H H 1 8.511 0.03 A 104 SER HA H 1 6.031 0.03 A 104 SER HB2 H 1 3.651 0.03 A 104 SER HB3 H 1 3.736 0.03 A 104 SER CA C 13 56.982 0.3 A 104 SER CB C 13 67.176 0.3 A 104 SER N N 15 116.121 0.3 A 105 LYS H H 1 8.962 0.03 A 105 LYS HA H 1 4.938 0.03 A 105 LYS HB2 H 1 1.443 0.03 A 105 LYS HB3 H 1 1.480 0.03 A 105 LYS HD2 H 1 1.084 0.03 A 105 LYS HD3 H 1 0.783 0.03 A 105 LYS HE2 H 1 2.816 0.03 A 105 LYS HG2 H 1 0.595 0.03 A 105 LYS HG3 H 1 0.782 0.03 A 105 LYS CA C 13 53.790 0.3 A 105 LYS CB C 13 34.331 0.3 A 105 LYS CD C 13 29.493 0.3 A 105 LYS CE C 13 42.030 0.3 A 105 LYS CG C 13 23.362 0.3 A 105 LYS N N 15 121.189 0.3 A 106 PRO HA H 1 4.751 0.03 A 106 PRO HB2 H 1 2.371 0.03 A 106 PRO HB3 H 1 1.745 0.03 A 106 PRO HD2 H 1 3.744 0.03 A 106 PRO HD3 H 1 3.450 0.03 A 106 PRO HG2 H 1 1.939 0.03 A 106 PRO CA C 13 62.776 0.3 A 106 PRO CB C 13 32.379 0.3 A 106 PRO CD C 13 50.778 0.3 A 106 PRO CG C 13 27.376 0.3 A 107 CYS H H 1 8.162 0.03 A 107 CYS HA H 1 4.506 0.03 A 107 CYS HB2 H 1 3.075 0.03 A 107 CYS HB3 H 1 2.978 0.03 A 107 CYS CA C 13 55.948 0.3 A 107 CYS CB C 13 45.021 0.3 A 107 CYS N N 15 117.900 0.3 A 108 THR H H 1 8.154 0.03 A 108 THR HA H 1 4.521 0.03 A 108 THR HB H 1 4.082 0.03 A 108 THR HG2% H 1 1.184 0.03 A 108 THR CA C 13 59.863 0.3 A 108 THR CB C 13 69.965 0.3 A 108 THR CG2 C 13 21.695 0.3 A 108 THR N N 15 118.432 0.3 A 109 PRO HA H 1 4.276 0.03 A 109 PRO HB2 H 1 2.169 0.03 A 109 PRO HB3 H 1 1.853 0.03 A 109 PRO HD2 H 1 3.655 0.03 A 109 PRO HD3 H 1 3.811 0.03 A 109 PRO HG3 H 1 1.867 0.03 A 109 PRO CA C 13 63.217 0.3 A 109 PRO CB C 13 32.476 0.3 A 109 PRO CD C 13 51.305 0.3 A 109 PRO CG C 13 27.432 0.3 A 110 LYS H H 1 8.526 0.03 A 110 LYS N N 15 122.383 0.3 A 112 PRO HA H 1 4.377 0.03 A 112 PRO HB2 H 1 2.234 0.03 A 112 PRO CA C 13 63.055 0.3 A 112 PRO CB C 13 32.286 0.3 A 113 LYS H H 1 8.410 0.03 A 113 LYS HA H 1 4.521 0.03 A 113 LYS HB2 H 1 1.716 0.03 A 113 LYS HG2 H 1 1.436 0.03 A 113 LYS CA C 13 54.286 0.3 A 113 LYS CB C 13 32.719 0.3 A 113 LYS CG C 13 24.787 0.3 A 113 LYS N N 15 123.462 0.3 A 116 GLY HA2 H 1 3.924 0.03 A 116 GLY CA C 13 45.486 0.03 A 117 GLY H H 1 8.297 0.03 A 117 GLY HA2 H 1 3.931 0.03 A 117 GLY CA C 13 45.300 0.03 A 117 GLY N N 15 108.931 0.3 A 118 GLU H H 1 8.402 0.03 A 118 GLU HA H 1 4.216 0.03 A 118 GLU HB2 H 1 1.918 0.03 A 118 GLU CA C 13 56.484 0.3 A 118 GLU CB C 13 30.179 0.3 A 118 GLU N N 15 120.745 0.3 A 119 LYS H H 1 8.410 0.03 A 119 LYS HA H 1 4.266 0.03 A 119 LYS CA C 13 56.501 0.3 A 119 LYS N N 15 123.286 0.3 A 120 LYS H H 1 8.358 0.03 A 120 LYS N N 15 123.390 0.3 A 122 GLY H H 1 8.479 0.03 A 122 GLY N N 15 110.664 0.3 A 124 GLY H H 1 8.439 0.03 A 124 GLY N N 15 110.803 0.3 A 126 GLU HA H 1 4.291 0.03 A 126 GLU CA C 13 56.765 0.3 A 127 ASN H H 1 7.985 0.03 A 127 ASN CA C 13 54.830 0.3 A 127 ASN N N 15 124.472 0.3 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type . save_ save_DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_4 _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 36 GLY HA3 A 28 PRO HA 1.0 . 1.8 2 2 A 58 LYS HG2 A 58 LYS HE2 1.0 . 1.8 3 3 A 47 LYS HG2 A 47 LYS HE2 1.0 . 1.8 4 4 A 58 LYS HG2 A 58 LYS HA 1.0 . 1.8 5 5 A 58 LYS HG2 A 58 LYS HB3 1.0 . 1.8 6 6 A 47 LYS HG2 A 47 LYS HD3 1.0 . 1.8 7 7 A 47 LYS HG2 A 47 LYS HD2 1.0 . 1.8 8 8 A 40 ALA HB% A 23 TYR HD1 1.0 . 1.8 9 9 A 40 ALA HB% A 41 THR HA 1.0 . 1.8 10 10 A 40 ALA HB% A 23 TYR HA 1.0 . 1.8 11 11 A 40 ALA HB% A 21 TRP HA 1.0 . 1.8 12 12 A 40 ALA HB% A 47 LYS HB2 1.0 . 1.8 13 13 A 40 ALA HB% A 39 GLU HA 1.0 . 1.8 14 14 A 40 ALA HB% A 21 TRP HZ3 1.0 . 1.8 15 15 A 40 ALA HB% A 21 TRP HE3 1.0 . 1.8 16 16 A 40 ALA HB% A 21 TRP HB2 1.0 . 1.8 17 17 A 40 ALA HB% A 21 TRP HB3 1.0 . 1.8 18 18 A 40 ALA HB% A 40 ALA HA 1.0 . 1.8 19 19 A 105 LYS HG3 A 105 LYS HB3 1.0 . 1.8 20 20 A 105 LYS HG3 A 105 LYS HD2 1.0 . 1.8 21 21 A 105 LYS HG3 A 105 LYS HD3 1.0 . 1.8 22 22 A 92 LEU HD2% A 92 LEU HB2 1.0 . 1.8 23 23 A 92 LEU HD2% A 92 LEU HB3 1.0 . 1.8 24 24 A 92 LEU HD2% A 90 LYS HE2 1.0 . 1.8 25 25 A 92 LEU HD2% A 92 LEU HA 1.0 . 1.8 26 26 A 92 LEU HD2% A 92 LEU HG 1.0 . 1.8 27 27 A 92 LEU HD2% A 90 LYS HG2 1.0 . 1.8 28 28 A 92 LEU HD2% A 90 LYS HD2 1.0 . 1.8 29 29 A 105 LYS HD2 A 105 LYS HG2 1.0 . 1.8 30 30 A 83 SER HB3 A 104 SER HA 1.0 . 1.8 31 31 A 83 SER HB3 A 82 ARG HA 1.0 . 1.8 32 32 A 104 SER HB3 A 81 THR HB 1.0 . 1.8 33 33 A 104 SER HB2 A 81 THR HG2% 1.0 . 1.8 34 34 A 104 SER HA A 104 SER HB2 1.0 . 1.8 35 35 A 81 THR HB A 104 SER HB2 1.0 . 1.8 36 36 A 40 ALA HB% A 23 TYR HE1 1.0 . 1.8 37 37 A 92 LEU HD2% A 90 LYS HB2 1.0 . 1.8 38 38 A 104 SER HB3 A 81 THR HG2% 1.0 . 1.8 39 39 A 107 CYS HB2 A 107 CYS HA 1.0 . 1.8 40 40 A 86 GLY HA3 A 86 GLY HA2 1.0 . 1.8 41 41 A 99 THR HG2% A 98 GLN HA 1.0 . 1.8 42 42 A 99 THR HG2% A 88 LEU HD2% 1.0 . 1.8 43 43 A 99 THR HG2% A 99 THR HB 1.0 . 1.8 44 44 A 88 LEU HD2% A 99 THR HA 1.0 . 1.8 45 45 A 99 THR HG2% A 99 THR HB 1.0 . 1.8 46 46 A 88 LEU HD1% A 88 LEU HB2 1.0 . 1.8 47 47 A 88 LEU HD1% A 65 CYS HB2 1.0 . 1.8 48 48 A 88 LEU HD1% A 88 LEU HA 1.0 . 1.8 49 49 A 88 LEU HD1% A 67 TYR HE1 1.0 . 1.8 50 50 A 88 LEU HD1% A 88 LEU HG 1.0 . 1.8 51 51 A 99 THR HA A 88 LEU HD1% 1.0 . 1.8 52 52 A 88 LEU HD1% A 65 CYS HB3 1.0 . 1.8 53 53 A 88 LEU HD1% A 89 LYS HA 1.0 . 1.8 54 54 A 88 LEU HD1% A 91 ALA HA 1.0 . 1.8 55 55 A 82 ARG HD2 A 82 ARG HB3 1.0 . 1.8 56 56 A 77 THR HG2% A 77 THR HB 1.0 . 1.8 57 57 A 77 THR HG2% A 77 THR HA 1.0 . 1.8 58 58 A 77 THR HG2% A 109 PRO HB3 1.0 . 1.8 59 59 A 77 THR HG2% A 76 ASP HA 1.0 . 1.8 60 60 A 77 THR HG2% A 109 PRO HG3 1.0 . 1.8 61 61 A 77 THR HG2% A 77 THR HB 1.0 . 1.8 62 62 A 28 PRO HA A 53 VAL HG1% 1.0 . 1.8 63 63 A 53 VAL HG1% A 28 PRO HD2 1.0 . 1.8 64 64 A 88 LEU HD1% A 97 CYS HB3 1.0 . 1.8 65 65 A 88 LEU HD1% A 67 TYR HA 1.0 . 1.8 66 66 A 88 LEU HD1% A 65 CYS HA 1.0 . 1.8 67 67 A 82 ARG HD2 A 82 ARG HG2 1.0 . 1.8 68 68 A 82 ARG HD2 A 82 ARG HG3 1.0 . 1.8 69 69 A 88 LEU HD1% A 97 CYS HB2 1.0 . 1.8 70 70 A 97 CYS HB2 A 97 CYS HA 1.0 . 1.8 71 71 A 77 THR HG2% A 109 PRO HB2 1.0 . 1.8 72 72 A 78 THR HG2% A 78 THR HA 1.0 . 1.8 73 73 A 100 THR HG2% A 100 THR HA 1.0 . 1.8 74 74 A 79 THR HG2% A 79 THR HB 1.0 . 1.8 75 75 A 41 THR HG2% A 44 GLU HA 1.0 . 1.8 76 76 A 49 THR HG2% A 47 LYS HE3 1.0 . 1.8 77 77 A 49 THR HG2% A 48 LYS HA 1.0 . 1.8 78 78 A 103 VAL HG1% A 69 PHE HE1 1.0 . 1.8 79 79 A 103 VAL HG1% A 69 PHE HZ 1.0 . 1.8 80 80 A 103 VAL HG1% A 101 ILE HG2% 1.0 . 1.8 81 81 A 103 VAL HG1% A 103 VAL HA 1.0 . 1.8 82 82 A 103 VAL HG1% A 101 ILE HD1% 1.0 . 1.8 83 83 A 103 VAL HG1% A 72 TRP HZ2 1.0 . 1.8 84 84 A 53 VAL HG1% A 33 CYS HA 1.0 . 1.8 85 85 A 53 VAL HG1% A 53 VAL HG2% 1.0 . 1.8 86 86 A 53 VAL HG1% A 26 CYS HBx 1.0 . 1.8 87 87 A 53 VAL HG1% A 53 VAL HA 1.0 . 1.8 88 88 A 53 VAL HG1% A 53 VAL HB 1.0 . 1.8 89 89 A 53 VAL HG1% A 52 LYS HA 1.0 . 1.8 90 90 A 53 VAL HG1% A 28 PRO HB2 1.0 . 1.8 91 91 A 53 VAL HG1% A 28 PRO HD3 1.0 . 1.8 92 92 A 53 VAL HG1% A 52 LYS HD2 1.0 . 1.8 93 93 A 53 VAL HG1% A 28 PRO HG3 1.0 . 1.8 94 94 A 53 VAL HG1% A 28 PRO HG2 1.0 . 1.8 95 95 A 70 GLY HA2 A 70 GLY HA3 1.0 . 1.8 96 96 A 24 GLY HA3 A 24 GLY HA2 1.0 . 1.8 97 97 A 71 ARG HD2 A 71 ARG HB3 1.0 . 1.8 98 98 A 71 ARG HD2 A 71 ARG HG2 1.0 . 1.8 99 99 A 108 THR HG2% A 109 PRO HD2 1.0 . 1.8 100 100 A 108 THR HG2% A 108 THR HB 1.0 . 1.8 101 101 A 87 THR HG2% A 87 THR HA 1.0 . 1.8 102 102 A 87 THR HG2% A 87 THR HB 1.0 . 1.8 103 103 A 79 THR HG2% A 79 THR HA 1.0 . 1.8 104 104 A 78 THR HG2% A 78 THR HB 1.0 . 1.8 105 105 A 46 THR HG2% A 39 GLU HG2 1.0 . 1.8 106 106 A 46 THR HG2% A 39 GLU HG3 1.0 . 1.8 107 107 A 39 GLU HA A 46 THR HG2% 1.0 . 1.8 108 108 A 41 THR HG2% A 45 GLN HA 1.0 . 1.8 109 109 A 46 THR HG2% A 39 GLU HB2 1.0 . 1.8 110 110 A 46 THR HG2% A 46 THR HB 1.0 . 1.8 111 111 A 41 THR HA A 41 THR HG2% 1.0 . 1.8 112 112 A 47 LYS HE2 A 49 THR HG2% 1.0 . 1.8 113 113 A 49 THR HG2% A 49 THR HA 1.0 . 1.8 114 114 A 47 LYS HB2 A 49 THR HG2% 1.0 . 1.8 115 115 A 49 THR HG2% A 38 ARG HB2 1.0 . 1.8 116 116 A 23 TYR HE1 A 49 THR HG2% 1.0 . 1.8 117 117 A 49 THR HG2% A 49 THR HB 1.0 . 1.8 118 118 A 104 SER HB2 A 81 THR HG2% 1.0 . 1.8 119 119 A 81 THR HG2% A 106 PRO HA 1.0 . 1.8 120 120 A 81 THR HG2% A 79 THR HA 1.0 . 1.8 121 121 A 81 THR HG2% A 81 THR HA 1.0 . 1.8 122 122 A 81 THR HB A 81 THR HG2% 1.0 . 1.8 123 123 A 81 THR HG2% A 106 PRO HG2 1.0 . 1.8 124 124 A 81 THR HG2% A 79 THR HB 1.0 . 1.8 125 125 A 103 VAL HG1% A 72 TRP HH2 1.0 . 1.8 126 126 A 103 VAL HG1% A 103 VAL HB 1.0 . 1.8 127 127 A 103 VAL HG1% A 102 LYS HA 1.0 . 1.8 128 128 A 103 VAL HG1% A 101 ILE HG13 1.0 . 1.8 129 129 A 85 SER HB2 A 85 SER HA 1.0 . 1.8 130 130 A 85 SER HB2 A 102 LYS HD2 1.0 . 1.8 131 131 A 85 SER HB2 A 85 SER HA 1.0 . 1.8 132 132 A 71 ARG HD2 A 71 ARG HA 1.0 . 1.8 133 133 A 99 THR HA A 88 LEU HB2 1.0 . 1.8 134 134 A 91 ALA HB% A 90 LYS HA 1.0 . 1.8 135 135 A 91 ALA HA A 91 ALA HB% 1.0 . 1.8 136 136 A 88 LEU HD2% A 91 ALA HB% 1.0 . 1.8 137 137 A 27 VAL HG1% A 38 ARG HA 1.0 . 1.8 138 138 A 88 LEU HB2 A 88 LEU HG 1.0 . 1.8 139 139 A 27 VAL HG1% A 27 VAL HA 1.0 . 1.8 140 140 A 27 VAL HG1% A 26 CYS HA 1.0 . 1.8 141 141 A 27 VAL HG1% A 25 LYS HBx 1.0 . 1.8 142 142 A 28 PRO HD2 A 27 VAL HG1% 1.0 . 1.8 143 143 A 27 VAL HG1% A 25 LYS HDx 1.0 . 1.8 144 144 A 77 THR HG2% A 77 THR HA 1.0 . 1.8 145 145 A 77 THR HB A 77 THR HA 1.0 . 1.8 146 146 A 30 SER HBx A 30 SER HA 1.0 . 1.8 147 147 A 92 LEU HD2% A 92 LEU HB2 1.0 . 1.8 148 148 A 92 LEU HB2 A 92 LEU HB3 1.0 . 1.8 149 149 A 92 LEU HB2 A 64 ASP HA 1.0 . 1.8 150 150 A 92 LEU HB2 A 92 LEU HA 1.0 . 1.8 151 151 A 92 LEU HB2 A 92 LEU HG 1.0 . 1.8 152 152 A 92 LEU HB2 A 92 LEU HD1% 1.0 . 1.8 153 153 A 101 ILE HB A 101 ILE HA 1.0 . 1.8 154 154 A 101 ILE HG13 A 101 ILE HB 1.0 . 1.8 155 155 A 101 ILE HG2% A 101 ILE HB 1.0 . 1.8 156 156 A 101 ILE HD1% A 101 ILE HB 1.0 . 1.8 157 157 A 92 LEU HB3 A 92 LEU HA 1.0 . 1.8 158 158 A 92 LEU HB3 A 92 LEU HG 1.0 . 1.8 159 159 A 92 LEU HB3 A 92 LEU HD1% 1.0 . 1.8 160 160 A 28 PRO HD3 A 27 VAL HG2% 1.0 . 1.8 161 161 A 28 PRO HD2 A 27 VAL HG2% 1.0 . 1.8 162 162 A 103 VAL HG1% A 103 VAL HG2% 1.0 . 1.8 163 163 A 69 PHE HE1 A 103 VAL HG2% 1.0 . 1.8 164 164 A 101 ILE HD1% A 103 VAL HG2% 1.0 . 1.8 165 165 A 72 TRP HH2 A 103 VAL HG2% 1.0 . 1.8 166 166 A 95 ALA HB% A 95 ALA HA 1.0 . 1.8 167 167 A 53 VAL HG2% A 53 VAL HA 1.0 . 1.8 168 168 A 28 PRO HD2 A 53 VAL HG2% 1.0 . 1.8 169 169 A 53 VAL HG2% A 33 CYS HB3 1.0 . 1.8 170 170 A 27 VAL HG1% A 25 LYS HE3 1.0 . 1.8 171 171 A 27 VAL HA A 27 VAL HG2% 1.0 . 1.8 172 172 A 27 VAL HG2% A 27 VAL HB 1.0 . 1.8 173 173 A 28 PRO HG3 A 27 VAL HG2% 1.0 . 1.8 174 174 A 28 PRO HG2 A 27 VAL HG2% 1.0 . 1.8 175 175 A 103 VAL HA A 103 VAL HG2% 1.0 . 1.8 176 176 A 103 VAL HB A 103 VAL HG2% 1.0 . 1.8 177 177 A 103 VAL HG2% A 72 TRP HZ3 1.0 . 1.8 178 178 A 102 LYS HA A 103 VAL HG2% 1.0 . 1.8 179 179 A 103 VAL HG2% A 84 ARG HD2 1.0 . 1.8 180 180 A 72 TRP HZ2 A 103 VAL HG2% 1.0 . 1.8 181 181 A 19 SER HBx A 19 SER HA 1.0 . 1.8 182 182 A 90 LYS HE2 A 90 LYS HD2 1.0 . 1.8 183 183 A 90 LYS HE2 A 90 LYS HG2 1.0 . 1.8 184 184 A 18 CYS HB2 A 18 CYS HA 1.0 . 1.8 185 185 A 18 CYS HB2 A 21 TRP HZ2 1.0 . 1.8 186 186 A 36 GLY HA3 A 37 ILE HB 1.0 . 1.8 187 187 A 37 ILE HB A 37 ILE HG2% 1.0 . 1.8 188 188 A 37 ILE HB A 37 ILE HA 1.0 . 1.8 189 189 A 73 ALA HB% A 74 GLU HG2 1.0 . 1.8 190 190 A 73 ALA HB% A 74 GLU HA 1.0 . 1.8 191 191 A 82 ARG HA A 73 ALA HB% 1.0 . 1.8 192 192 A 73 ALA HB% A 84 ARG HA 1.0 . 1.8 193 193 A 73 ALA HB% A 74 GLU HB2 1.0 . 1.8 194 194 A 73 ALA HB% A 73 ALA HA 1.0 . 1.8 195 195 A 37 ILE HB A 37 ILE HG12 1.0 . 1.8 196 196 A 67 TYR HA A 67 TYR HB3 1.0 . 1.8 197 197 A 53 VAL HG1% A 53 VAL HG2% 1.0 . 1.8 198 198 A 53 VAL HG2% A 53 VAL HB 1.0 . 1.8 199 199 A 33 CYS HA A 53 VAL HG2% 1.0 . 1.8 200 200 A 53 VAL HG2% A 52 LYS HD2 1.0 . 1.8 201 201 A 53 VAL HG2% A 28 PRO HG3 1.0 . 1.8 202 202 A 53 VAL HG2% A 28 PRO HG2 1.0 . 1.8 203 203 A 53 VAL HG2% A 33 CYS HB2 1.0 . 1.8 204 204 A 53 VAL HG2% A 55 CYS HA 1.0 . 1.8 205 205 A 76 ASP HA A 76 ASP HB2 1.0 . 1.8 206 206 A 32 ASP HB2 A 32 ASP HA 1.0 . 1.8 207 207 A 67 TYR HB2 A 67 TYR HD1 1.0 . 1.8 208 208 A 67 TYR HA A 67 TYR HB2 1.0 . 1.8 209 209 A 73 ALA HB% A 72 TRP HA 1.0 . 1.8 210 210 A 37 ILE HB A 37 ILE HD1% 1.0 . 1.8 211 211 A 37 ILE HB A 37 ILE HG13 1.0 . 1.8 212 212 A 65 CYS HB2 A 65 CYS HA 1.0 . 1.8 213 213 A 65 CYS HB2 A 67 TYR HE1 1.0 . 1.8 214 214 A 64 ASP HA A 64 ASP HB2 1.0 . 1.8 215 215 A 88 LEU HD1% A 65 CYS HB3 1.0 . 1.8 216 216 A 65 CYS HB3 A 63 ALA HB% 1.0 . 1.8 217 217 A 67 TYR HE1 A 65 CYS HB3 1.0 . 1.8 218 218 A 47 LYS HE2 A 47 LYS HD2 1.0 . 1.8 219 219 A 14 ALA HB% A 14 ALA HA 1.0 . 1.8 220 220 A 23 TYR HA A 23 TYR HBx 1.0 . 1.8 221 221 A 26 CYS HBx A 26 CYS HA 1.0 . 1.8 222 222 A 26 CYS HBx A 26 CYS HA 1.0 . 1.8 223 223 A 15 ASP HB3 A 15 ASP HA 1.0 . 1.8 224 224 A 60 ASP HB2 A 60 ASP HA 1.0 . 1.8 225 225 A 28 PRO HA A 28 PRO HB2 1.0 . 1.8 226 226 A 23 TYR HD1 A 23 TYR HBx 1.0 . 1.8 227 227 A 37 ILE HB A 37 ILE HG2% 1.0 . 1.8 228 228 A 37 ILE HG2% A 37 ILE HA 1.0 . 1.8 229 229 A 37 ILE HG2% A 50 LYS HA 1.0 . 1.8 230 230 A 37 ILE HG2% A 48 LYS HB2 1.0 . 1.8 231 231 A 37 ILE HG2% A 37 ILE HD1% 1.0 . 1.8 232 232 A 39 GLU HB2 A 37 ILE HG2% 1.0 . 1.8 233 233 A 37 ILE HG2% A 48 LYS HD2 1.0 . 1.8 234 234 A 37 ILE HG2% A 48 LYS HG2 1.0 . 1.8 235 235 A 48 LYS HA A 37 ILE HG2% 1.0 . 1.8 236 236 A 37 ILE HG2% A 48 LYS HE2 1.0 . 1.8 237 237 A 39 GLU HG2 A 37 ILE HG2% 1.0 . 1.8 238 238 A 38 ARG HA A 37 ILE HG2% 1.0 . 1.8 239 239 A 37 ILE HG2% A 37 ILE HG12 1.0 . 1.8 240 240 A 42 CYS HB2 A 42 CYS HB3 1.0 . 1.8 241 241 A 42 CYS HB2 A 42 CYS HA 1.0 . 1.8 242 242 A 42 CYS HB3 A 42 CYS HA 1.0 . 1.8 243 243 A 42 CYS HB2 A 42 CYS HB3 1.0 . 1.8 244 244 A 101 ILE HG2% A 98 GLN HB2 1.0 . 1.8 245 245 A 61 PHE HBy A 61 PHE HB2 1.0 . 1.8 246 246 A 61 PHE HBy A 61 PHE HA 1.0 . 1.8 247 247 A 61 PHE HB2 A 61 PHE HD1 1.0 . 1.8 248 248 A 61 PHE HB2 A 61 PHE HA 1.0 . 1.8 249 249 A 69 PHE HE1 A 101 ILE HG2% 1.0 . 1.8 250 250 A 101 ILE HG2% A 101 ILE HB 1.0 . 1.8 251 251 A 100 THR HA A 101 ILE HG2% 1.0 . 1.8 252 252 A 101 ILE HG2% A 101 ILE HA 1.0 . 1.8 253 253 A 101 ILE HG2% A 98 GLN HG2 1.0 . 1.8 254 254 A 67 TYR HE1 A 101 ILE HG2% 1.0 . 1.8 255 255 A 101 ILE HG2% A 98 GLN HB3 1.0 . 1.8 256 256 A 101 ILE HG2% A 101 ILE HG12 1.0 . 1.8 257 257 A 101 ILE HG2% A 101 ILE HG12 1.0 . 1.8 258 258 A 103 VAL HG1% A 101 ILE HG2% 1.0 . 1.8 259 259 A 101 ILE HG2% A 101 ILE HD1% 1.0 . 1.8 260 260 A 35 ASN HB2 A 35 ASN HA 1.0 . 1.8 261 261 A 56 ASN HB2 A 56 ASN HA 1.0 . 1.8 262 262 A 29 ASN HB3 A 29 ASN HA 1.0 . 1.8 263 263 A 29 ASN HA A 29 ASN HB2 1.0 . 1.8 264 264 A 93 PHE HBy A 93 PHE HA 1.0 . 1.8 265 265 A 93 PHE HA A 93 PHE HB2 1.0 . 1.8 266 266 A 39 GLU HA A 39 GLU HG2 1.0 . 1.8 267 267 A 93 PHE HB2 A 93 PHE HD1 1.0 . 1.8 268 268 A 46 THR HG2% A 39 GLU HG2 1.0 . 1.8 269 269 A 39 GLU HG2 A 39 GLU HB2 1.0 . 1.8 270 270 A 46 THR HG2% A 39 GLU HG3 1.0 . 1.8 271 271 A 39 GLU HG3 A 39 GLU HB2 1.0 . 1.8 272 272 A 39 GLU HA A 39 GLU HG3 1.0 . 1.8 273 273 A 43 ASN HB2 A 43 ASN HA 1.0 . 1.8 274 274 A 44 GLU HA A 44 GLU HG2 1.0 . 1.8 275 275 A 44 GLU HG2 A 44 GLU HB2 1.0 . 1.8 276 276 A 74 GLU HG2 A 74 GLU HA 1.0 . 1.8 277 277 A 74 GLU HG2 A 74 GLU HB2 1.0 . 1.8 278 278 A 74 GLU HG2 A 73 ALA HA 1.0 . 1.8 279 279 A 17 GLU HGx A 17 GLU HA 1.0 . 1.8 280 280 A 17 GLU HGx A 17 GLU HBx 1.0 . 1.8 281 281 A 96 GLU HG2 A 96 GLU HA 1.0 . 1.8 282 282 A 86 GLY HA3 A 101 ILE HD1% 1.0 . 1.8 283 283 A 69 PHE HE1 A 101 ILE HD1% 1.0 . 1.8 284 284 A 20 GLU HGx A 20 GLU HA 1.0 . 1.8 285 285 A 47 LYS HB2 A 47 LYS HA 1.0 . 1.8 286 286 A 47 LYS HB2 A 47 LYS HA 1.0 . 1.8 287 287 A 101 ILE HD1% A 67 TYR HD1 1.0 . 1.8 288 288 A 103 VAL HG1% A 101 ILE HD1% 1.0 . 1.8 289 289 A 101 ILE HD1% A 101 ILE HB 1.0 . 1.8 290 290 A 101 ILE HD1% A 103 VAL HG2% 1.0 . 1.8 291 291 A 69 PHE HZ A 101 ILE HD1% 1.0 . 1.8 292 292 A 101 ILE HG2% A 101 ILE HD1% 1.0 . 1.8 293 293 A 101 ILE HD1% A 101 ILE HA 1.0 . 1.8 294 294 A 67 TYR HE1 A 101 ILE HD1% 1.0 . 1.8 295 295 A 101 ILE HD1% A 101 ILE HG12 1.0 . 1.8 296 296 A 101 ILE HD1% A 101 ILE HG13 1.0 . 1.8 297 297 A 104 SER HB2 A 103 VAL HB 1.0 . 1.8 298 298 A 103 VAL HG1% A 103 VAL HB 1.0 . 1.8 299 299 A 103 VAL HB A 103 VAL HG2% 1.0 . 1.8 300 300 A 103 VAL HA A 103 VAL HB 1.0 . 1.8 301 301 A 53 VAL HG1% A 53 VAL HB 1.0 . 1.8 302 302 A 53 VAL HG2% A 53 VAL HB 1.0 . 1.8 303 303 A 53 VAL HA A 53 VAL HB 1.0 . 1.8 304 304 A 53 VAL HB A 33 CYS HB2 1.0 . 1.8 305 305 A 102 LYS HA A 102 LYS HBy 1.0 . 1.8 306 306 A 33 CYS HA A 53 VAL HB 1.0 . 1.8 307 307 A 53 VAL HB A 33 CYS HB3 1.0 . 1.8 308 308 A 88 LEU HA A 67 TYR HA 1.0 . 1.8 309 309 A 88 LEU HA A 67 TYR HD1 1.0 . 1.8 310 310 A 88 LEU HD1% A 88 LEU HA 1.0 . 1.8 311 311 A 88 LEU HB2 A 88 LEU HA 1.0 . 1.8 312 312 A 98 GLN HA A 98 GLN HG2 1.0 . 1.8 313 313 A 45 GLN HA A 45 GLN HG2 1.0 . 1.8 314 314 A 37 ILE HG2% A 48 LYS HB2 1.0 . 1.8 315 315 A 90 LYS HB2 A 90 LYS HA 1.0 . 1.8 316 316 A 105 LYS HG3 A 105 LYS HB3 1.0 . 1.8 317 317 A 105 LYS HB3 A 105 LYS HG2 1.0 . 1.8 318 318 A 105 LYS HB2 A 106 PRO HD2 1.0 . 1.8 319 319 A 105 LYS HB2 A 106 PRO HD3 1.0 . 1.8 320 320 A 101 ILE HG2% A 98 GLN HG2 1.0 . 1.8 321 321 A 97 CYS HA A 98 GLN HG2 1.0 . 1.8 322 322 A 98 GLN HG2 A 98 GLN HB3 1.0 . 1.8 323 323 A 98 GLN HB2 A 98 GLN HG2 1.0 . 1.8 324 324 A 45 GLN HG2 A 45 GLN HB2 1.0 . 1.8 325 325 A 82 ARG HD2 A 82 ARG HB3 1.0 . 1.8 326 326 A 38 ARG HB2 A 38 ARG HA 1.0 . 1.8 327 327 A 37 ILE HB A 37 ILE HD1% 1.0 . 1.8 328 328 A 37 ILE HG2% A 37 ILE HD1% 1.0 . 1.8 329 329 A 37 ILE HD1% A 50 LYS HE2 1.0 . 1.8 330 330 A 37 ILE HD1% A 50 LYS HD2 1.0 . 1.8 331 331 A 22 GLN HGx A 22 GLN HA 1.0 . 1.8 332 332 A 22 GLN HGx A 22 GLN HB2 1.0 . 1.8 333 333 A 38 ARG HB2 A 38 ARG HDy 1.0 . 1.8 334 334 A 68 LYS HB2 A 68 LYS HA 1.0 . 1.8 335 335 A 37 ILE HA A 37 ILE HD1% 1.0 . 1.8 336 336 A 37 ILE HG12 A 37 ILE HD1% 1.0 . 1.8 337 337 A 37 ILE HD1% A 50 LYS HA 1.0 . 1.8 338 338 A 37 ILE HD1% A 50 LYS HG2 1.0 . 1.8 339 339 A 72 TRP HA A 84 ARG HB2 1.0 . 1.8 340 340 A 84 ARG HA A 84 ARG HB2 1.0 . 1.8 341 341 A 27 VAL HB A 25 LYS HGx 1.0 . 1.8 342 342 A 115 LYS HBx A 115 LYS HA 1.0 . 1.8 343 343 A 59 LYS HB2 A 59 LYS HA 1.0 . 1.8 344 344 A 72 TRP HA A 84 ARG HB3 1.0 . 1.8 345 345 A 84 ARG HA A 84 ARG HB3 1.0 . 1.8 346 346 A 27 VAL HA A 27 VAL HB 1.0 . 1.8 347 347 A 58 LYS HG2 A 58 LYS HB3 1.0 . 1.8 348 348 A 58 LYS HA A 58 LYS HB2 1.0 . 1.8 349 349 A 106 PRO HA A 106 PRO HB2 1.0 . 1.8 350 350 A 106 PRO HD2 A 106 PRO HB2 1.0 . 1.8 351 351 A 106 PRO HG2 A 106 PRO HB2 1.0 . 1.8 352 352 A 106 PRO HD3 A 106 PRO HB2 1.0 . 1.8 353 353 A 54 PRO HB3 A 54 PRO HA 1.0 . 1.8 354 354 A 54 PRO HB3 A 54 PRO HB2 1.0 . 1.8 355 355 A 54 PRO HB3 A 54 PRO HG2 1.0 . 1.8 356 356 A 54 PRO HB3 A 54 PRO HD3 1.0 . 1.8 357 357 A 54 PRO HA A 54 PRO HB2 1.0 . 1.8 358 358 A 106 PRO HA A 106 PRO HB3 1.0 . 1.8 359 359 A 106 PRO HD3 A 106 PRO HB3 1.0 . 1.8 360 360 A 39 GLU HA A 39 GLU HB2 1.0 . 1.8 361 361 A 46 THR HG2% A 39 GLU HB2 1.0 . 1.8 362 362 A 36 GLY HA3 A 28 PRO HB2 1.0 . 1.8 363 363 A 39 GLU HG3 A 39 GLU HB2 1.0 . 1.8 364 364 A 39 GLU HB2 A 38 ARG HA 1.0 . 1.8 365 365 A 28 PRO HB2 A 28 PRO HG3 1.0 . 1.8 366 366 A 28 PRO HA A 28 PRO HB2 1.0 . 1.8 367 367 A 28 PRO HB2 A 28 PRO HG2 1.0 . 1.8 368 368 A 95 ALA HB% A 95 ALA HA 1.0 . 1.8 369 369 A 45 GLN HG2 A 45 GLN HBy 1.0 . 1.8 370 370 A 45 GLN HG2 A 45 GLN HB2 1.0 . 1.8 371 371 A 45 GLN HA A 45 GLN HB2 1.0 . 1.8 372 372 A 71 ARG HD2 A 71 ARG HB3 1.0 . 1.8 373 373 A 71 ARG HB3 A 71 ARG HG2 1.0 . 1.8 374 374 A 71 ARG HD2 A 71 ARG HB2 1.0 . 1.8 375 375 A 73 ALA HB% A 71 ARG HB2 1.0 . 1.8 376 376 A 45 GLN HB2 A 21 TRP HH2 1.0 . 1.8 377 377 A 71 ARG HA A 71 ARG HB2 1.0 . 1.8 378 378 A 17 GLU HGx A 17 GLU HB3 1.0 . 1.8 379 379 A 17 GLU HA A 17 GLU HB3 1.0 . 1.8 380 380 A 17 GLU HBx A 17 GLU HB3 1.0 . 1.8 381 381 A 20 GLU HA A 20 GLU HBx 1.0 . 1.8 382 382 A 17 GLU HGx A 17 GLU HBx 1.0 . 1.8 383 383 A 17 GLU HA A 17 GLU HBx 1.0 . 1.8 384 384 A 20 GLU HA A 20 GLU HBx 1.0 . 1.8 385 385 A 21 TRP HB2 A 21 TRP HB3 1.0 . 1.8 386 386 A 74 GLU HA A 74 GLU HBy 1.0 . 1.8 387 387 A 81 THR HB A 81 THR HG2% 1.0 . 1.8 388 388 A 81 THR HB A 81 THR HA 1.0 . 1.8 389 389 A 21 TRP HB2 A 21 TRP HD1 1.0 . 1.8 390 390 A 40 ALA HB% A 21 TRP HB2 1.0 . 1.8 391 391 A 21 TRP HA A 21 TRP HB2 1.0 . 1.8 392 392 A 40 ALA HB% A 21 TRP HB3 1.0 . 1.8 393 393 A 21 TRP HA A 21 TRP HB3 1.0 . 1.8 394 394 A 21 TRP HB2 A 21 TRP HB3 1.0 . 1.8 395 395 A 28 PRO HD3 A 27 VAL HA 1.0 . 1.8 396 396 A 57 TRP HB2 A 57 TRP HA 1.0 . 1.8 397 397 A 21 TRP HB2 A 21 TRP HB3 1.0 . 1.8 398 398 A 21 TRP HE3 A 21 TRP HB3 1.0 . 1.8 399 399 A 22 GLN HA A 22 GLN HB2 1.0 . 1.8 400 400 A 22 GLN HA A 22 GLN HB3 1.0 . 1.8 401 401 A 102 LYS HD2 A 83 SER HB2 1.0 . 1.8 402 402 A 47 LYS HE2 A 47 LYS HD2 1.0 . 1.8 403 403 A 108 THR HG2% A 109 PRO HD3 1.0 . 1.8 404 404 A 109 PRO HD3 A 108 THR HA 1.0 . 1.8 405 405 A 109 PRO HB3 A 109 PRO HD3 1.0 . 1.8 406 406 A 28 PRO HD2 A 27 VAL HG1% 1.0 . 1.8 407 407 A 54 PRO HA A 54 PRO HD3 1.0 . 1.8 408 408 A 54 PRO HD3 A 54 PRO HG3 1.0 . 1.8 409 409 A 108 THR HG2% A 109 PRO HD2 1.0 . 1.8 410 410 A 109 PRO HD2 A 108 THR HA 1.0 . 1.8 411 411 A 109 PRO HD2 A 108 THR HB 1.0 . 1.8 412 412 A 57 TRP HB2 A 57 TRP HE3 1.0 . 1.8 413 413 A 98 GLN HG2 A 98 GLN HB3 1.0 . 1.8 414 414 A 98 GLN HA A 98 GLN HB3 1.0 . 1.8 415 415 A 101 ILE HG2% A 98 GLN HB3 1.0 . 1.8 416 416 A 101 ILE HG2% A 98 GLN HB2 1.0 . 1.8 417 417 A 25 LYS HDx A 25 LYS HGx 1.0 . 1.8 418 418 A 48 LYS HD2 A 48 LYS HE2 1.0 . 1.8 419 419 A 47 LYS HD2 A 47 LYS HB2 1.0 . 1.8 420 420 A 47 LYS HD2 A 47 LYS HE3 1.0 . 1.8 421 421 A 47 LYS HG2 A 47 LYS HD2 1.0 . 1.8 422 422 A 54 PRO HA A 54 PRO HD3 1.0 . 1.8 423 423 A 54 PRO HB3 A 54 PRO HD3 1.0 . 1.8 424 424 A 54 PRO HG2 A 54 PRO HD3 1.0 . 1.8 425 425 A 106 PRO HD3 A 106 PRO HB3 1.0 . 1.8 426 426 A 106 PRO HD3 A 106 PRO HB2 1.0 . 1.8 427 427 A 106 PRO HG2 A 106 PRO HD3 1.0 . 1.8 428 428 A 66 LYS HD2 A 66 LYS HA 1.0 . 1.8 429 429 A 106 PRO HD3 A 105 LYS HA 1.0 . 1.8 430 430 A 105 LYS HB2 A 106 PRO HD3 1.0 . 1.8 431 431 A 44 GLU HA A 44 GLU HG2 1.0 . 1.8 432 432 A 44 GLU HB2 A 44 GLU HGy 1.0 . 1.8 433 433 A 44 GLU HA A 44 GLU HBy 1.0 . 1.8 434 434 A 49 THR HA A 49 THR HB 1.0 . 1.8 435 435 A 49 THR HG2% A 49 THR HB 1.0 . 1.8 436 436 A 41 THR HG2% A 41 THR HB 1.0 . 1.8 437 437 A 41 THR HA A 41 THR HB 1.0 . 1.8 438 438 A 53 VAL HA A 54 PRO HG2 1.0 . 1.8 439 439 A 53 VAL HG1% A 28 PRO HG3 1.0 . 1.8 440 440 A 28 PRO HG2 A 27 VAL HA 1.0 . 1.8 441 441 A 28 PRO HD2 A 28 PRO HG2 1.0 . 1.8 442 442 A 28 PRO HB2 A 28 PRO HG3 1.0 . 1.8 443 443 A 28 PRO HG3 A 32 ASP HA 1.0 . 1.8 444 444 A 28 PRO HD3 A 28 PRO HG3 1.0 . 1.8 445 445 A 28 PRO HD2 A 28 PRO HG3 1.0 . 1.8 446 446 A 28 PRO HG3 A 28 PRO HG2 1.0 . 1.8 447 447 A 92 LEU HD2% A 92 LEU HG 1.0 . 1.8 448 448 A 92 LEU HB2 A 92 LEU HG 1.0 . 1.8 449 449 A 92 LEU HB3 A 92 LEU HG 1.0 . 1.8 450 450 A 92 LEU HA A 92 LEU HG 1.0 . 1.8 451 451 A 54 PRO HG2 A 54 PRO HG3 1.0 . 1.8 452 452 A 28 PRO HG3 A 28 PRO HG2 1.0 . 1.8 453 453 A 33 CYS HA A 28 PRO HG2 1.0 . 1.8 454 454 A 28 PRO HB2 A 28 PRO HG2 1.0 . 1.8 455 455 A 28 PRO HG2 A 32 ASP HA 1.0 . 1.8 456 456 A 28 PRO HA A 28 PRO HG2 1.0 . 1.8 457 457 A 28 PRO HD3 A 28 PRO HG2 1.0 . 1.8 458 458 A 87 THR HA A 87 THR HB 1.0 . 1.8 459 459 A 71 ARG HD2 A 71 ARG HG2 1.0 . 1.8 460 460 A 71 ARG HG2 A 71 ARG HA 1.0 . 1.8 461 461 A 71 ARG HG2 A 71 ARG HB2 1.0 . 1.8 462 462 A 82 ARG HD2 A 82 ARG HG2 1.0 . 1.8 463 463 A 37 ILE HB A 37 ILE HG13 1.0 . 1.8 464 464 A 37 ILE HG2% A 37 ILE HG13 1.0 . 1.8 465 465 A 37 ILE HD1% A 37 ILE HG13 1.0 . 1.8 466 466 A 37 ILE HB A 37 ILE HG12 1.0 . 1.8 467 467 A 37 ILE HG12 A 37 ILE HD1% 1.0 . 1.8 468 468 A 37 ILE HG2% A 37 ILE HG12 1.0 . 1.8 469 469 A 88 LEU HD2% A 97 CYS HB2 1.0 . 1.8 470 470 A 88 LEU HD2% A 91 ALA HA 1.0 . 1.8 471 471 A 33 CYS HB2 A 55 CYS HA 1.0 . 1.8 472 472 A 88 LEU HD2% A 88 LEU HG 1.0 . 1.8 473 473 A 88 LEU HD2% A 88 LEU HA 1.0 . 1.8 474 474 A 99 THR HG2% A 88 LEU HD2% 1.0 . 1.8 475 475 A 88 LEU HD2% A 99 THR HA 1.0 . 1.8 476 476 A 88 LEU HD2% A 88 LEU HD1% 1.0 . 1.8 477 477 A 88 LEU HD2% A 88 LEU HB2 1.0 . 1.8 478 478 A 88 LEU HD2% A 67 TYR HE1 1.0 . 1.8 479 479 A 88 LEU HD2% A 101 ILE HG12 1.0 . 1.8 480 480 A 53 VAL HG2% A 33 CYS HB3 1.0 . 1.8 481 481 A 33 CYS HB3 A 33 CYS HB2 1.0 . 1.8 482 482 A 26 CYS HA A 38 ARG HG2 1.0 . 1.8 483 483 A 38 ARG HA A 38 ARG HG2 1.0 . 1.8 484 484 A 101 ILE HD1% A 101 ILE HG12 1.0 . 1.8 485 485 A 88 LEU HD2% A 91 ALA HB% 1.0 . 1.8 486 486 A 108 THR HG2% A 108 THR HB 1.0 . 1.8 487 487 A 79 THR HG2% A 80 GLY HA2 1.0 . 1.8 488 488 A 108 THR HA A 80 GLY HA2 1.0 . 1.8 489 489 A 33 CYS HA A 33 CYS HB3 1.0 . 1.8 490 490 A 33 CYS HB3 A 33 CYS HB2 1.0 . 1.8 491 491 A 38 ARG HG2 A 38 ARG HD2 1.0 . 1.8 492 492 A 101 ILE HG2% A 101 ILE HG12 1.0 . 1.8 493 493 A 101 ILE HG2% A 101 ILE HG12 1.0 . 1.8 494 494 A 101 ILE HD1% A 101 ILE HG12 1.0 . 1.8 495 495 A 108 THR HB A 108 THR HA 1.0 . 1.8 496 496 A 51 CYS HBx A 51 CYS HA 1.0 . 1.8 497 497 A 92 LEU HD2% A 92 LEU HD1% 1.0 . 1.8 498 498 A 92 LEU HB2 A 92 LEU HD1% 1.0 . 1.8 499 499 A 90 LYS HB2 A 92 LEU HD1% 1.0 . 1.8 500 500 A 92 LEU HA A 92 LEU HD1% 1.0 . 1.8 501 501 A 90 LYS HD2 A 92 LEU HD1% 1.0 . 1.8 502 502 A 92 LEU HG A 92 LEU HD1% 1.0 . 1.8 503 503 A 92 LEU HD1% A 64 ASP HB3 1.0 . 1.8 504 504 A 102 LYS HA A 102 LYS HGy 1.0 . 1.8 505 505 A 68 LYS HB2 A 68 LYS HG2 1.0 . 1.8 506 506 A 90 LYS HE2 A 92 LEU HD1% 1.0 . 1.8 507 507 A 25 LYS HBx A 25 LYS HGx 1.0 . 1.8 508 508 A 25 LYS HDx A 25 LYS HGx 1.0 . 1.8 509 509 A 90 LYS HG2 A 90 LYS HA 1.0 . 1.8 510 510 A 90 LYS HG2 A 90 LYS HD2 1.0 . 1.8 511 511 A 90 LYS HE2 A 90 LYS HG2 1.0 . 1.8 512 512 A 90 LYS HG2 A 90 LYS HB2 1.0 . 1.8 513 513 A 58 LYS HG2 A 58 LYS HE2 1.0 . 1.8 514 514 A 58 LYS HG2 A 58 LYS HA 1.0 . 1.8 515 515 A 58 LYS HG2 A 58 LYS HD2 1.0 . 1.8 516 516 A 58 LYS HG2 A 58 LYS HB3 1.0 . 1.8 517 517 A 36 GLY HA3 A 28 PRO HA 1.0 . 1.8 518 518 A 36 GLY HA3 A 36 GLY HA2 1.0 . 1.8 519 519 A 47 LYS HG2 A 47 LYS HE2 1.0 . 1.8 520 520 A 68 LYS HA A 68 LYS HG2 1.0 . 1.8 521 521 A 27 VAL HG1% A 27 VAL HB 1.0 . 1.8 522 522 A 14 ALA HB% A 13 LYS HA 1.0 . 1.8 523 523 A 18 CYS HB2 A 17 GLU HA 1.0 . 1.8 524 524 A 28 PRO HB2 A 27 VAL HG2% 1.0 . 1.8 525 525 A 83 SER HB3 A 83 SER HA 1.0 . 1.8 526 526 A 88 LEU HD1% A 97 CYS HB2 1.0 . 1.8 527 527 A 88 LEU HD1% A 91 ALA HB% 1.0 . 1.8 528 528 A 94 ASN HB2 A 94 ASN HA 1.0 . 1.8 529 529 A 33 CYS HA A 33 CYS HB2 1.0 . 1.8 530 530 A 53 VAL HG1% A 28 PRO HB2 1.0 . 1.8 531 531 A 20 GLU HGx A 20 GLU HBx 1.0 . 1.8 532 532 A 27 VAL HG1% A 27 VAL HB 1.0 . 1.8 533 533 A 41 THR HG2% A 41 THR HB 1.0 . 1.8 534 534 A 21 TRP HA A 42 CYS HB3 1.0 . 1.8 535 535 A 42 CYS HB2 A 42 CYS HB3 1.0 . 1.8 536 536 A 44 GLU HG2 A 44 GLU HB2 1.0 . 1.8 537 537 A 37 ILE HG2% A 48 LYS HD2 1.0 . 1.8 538 538 A 103 VAL HG2% A 72 TRP HE3 1.0 . 1.8 539 539 A 88 LEU HD1% A 67 TYR HD1 1.0 . 1.8 540 540 A 81 THR HG2% A 106 PRO HB2 1.0 . 1.8 541 541 A 88 LEU HA A 67 TYR HA 1.0 . 1.8 542 542 A 86 GLY HA3 A 69 PHE HA 1.0 . 1.8 543 543 A 64 ASP HA A 92 LEU HD1% 1.0 . 1.8 544 544 A 69 PHE HZ A 103 VAL HG2% 1.0 . 1.8 545 545 A 63 ALA HB% A 63 ALA HA 1.0 . 1.8 546 546 A 65 CYS HB3 A 65 CYS HA 1.0 . 1.8 547 547 A 76 ASP HA A 76 ASP HB3 1.0 . 1.8 548 548 A 88 LEU HD2% A 97 CYS HB2 1.0 . 1.8 549 549 A 101 ILE HG2% A 67 TYR HD1 1.0 . 1.8 550 550 A 101 ILE HG2% A 103 VAL HG2% 1.0 . 1.8 551 551 A 101 ILE HG2% A 103 VAL HG2% 1.0 . 1.8 552 552 A 21 TRP HB2 A 23 TYR HE1 1.0 . 1.8 553 553 A 105 LYS HB2 A 105 LYS HA 1.0 . 1.8 554 554 A 53 VAL HG1% A 33 CYS HB3 1.0 . 1.8 555 555 A 57 TRP HB2 A 57 TRP HD1 1.0 . 1.8 556 556 A 81 THR HG2% A 80 GLY HA3 1.0 . 1.8 557 557 A 81 THR HG2% A 80 GLY HA2 1.0 . 1.8 558 558 A 69 PHE HZ A 101 ILE HG2% 1.0 . 1.8 559 559 A 103 VAL HG2% A 83 SER HB2 1.0 . 1.8 560 560 A 88 LEU HD2% A 97 CYS HB3 1.0 . 1.8 561 561 A 21 TRP HA A 22 GLN HGx 1.0 . 1.8 562 562 A 88 LEU HD2% A 99 THR HB 1.0 . 1.8 563 563 A 88 LEU HD2% A 89 LYS HA 1.0 . 1.8 564 564 A 37 ILE HG2% A 48 LYS HD2 1.0 . 1.8 565 565 A 27 VAL HG1% A 25 LYS HBx 1.0 . 1.8 566 566 A 37 ILE HD1% A 50 LYS HB2 1.0 . 1.8 567 567 A 28 PRO HB2 A 27 VAL HG2% 1.0 . 1.8 568 568 A 53 VAL HG1% A 33 CYS HB3 1.0 . 1.8 569 569 A 53 VAL HG1% A 33 CYS HB2 1.0 . 1.8 570 570 A 39 GLU HG2 A 37 ILE HG2% 1.0 . 1.8 571 571 A 39 GLU HG2 A 46 THR HB 1.0 . 1.8 572 572 A 40 ALA HB% A 21 TRP HH2 1.0 . 1.8 573 573 A 21 TRP HE3 A 21 TRP HB2 1.0 . 1.8 574 574 A 21 TRP HB3 A 21 TRP HD1 1.0 . 1.8 575 575 A 21 TRP HB3 A 23 TYR HE1 1.0 . 1.8 576 576 A 49 THR HA A 49 THR HB 1.0 . 1.8 577 577 A 49 THR HG2% A 38 ARG HG2 1.0 . 1.8 578 578 A 27 VAL HG1% A 25 LYS HGx 1.0 . 1.8 579 579 A 38 ARG HB2 A 26 CYS HA 1.0 . 1.8 580 580 A 28 PRO HB2 A 36 GLY HA2 1.0 . 1.8 581 581 A 33 CYS HA A 28 PRO HB2 1.0 . 1.8 582 582 A 28 PRO HB2 A 32 ASP HA 1.0 . 1.8 583 583 A 41 THR HA A 42 CYS HB3 1.0 . 1.8 584 584 A 71 ARG HA A 72 TRP HB2 1.0 . 1.8 585 585 A 86 GLY HA3 A 69 PHE HD1 1.0 . 1.8 586 586 A 103 VAL HG2% A 84 ARG HB2 1.0 . 1.8 587 587 A 53 VAL HG2% A 28 PRO HD3 1.0 . 1.8 588 588 A 28 PRO HA A 53 VAL HG1% 1.0 . 1.8 589 589 A 53 VAL HG2% A 28 PRO HB2 1.0 . 1.8 590 590 A 33 CYS HA A 28 PRO HG3 1.0 . 1.8 591 591 A 72 TRP HB2 A 72 TRP HD1 1.0 . 1.8 592 592 A 72 TRP HE3 A 72 TRP HB2 1.0 . 1.8 593 593 A 97 CYS HB2 A 96 GLU HA 1.0 . 1.8 594 594 A 88 LEU HD1% A 88 LEU HG 1.0 . 1.8 595 595 A 82 ARG HA A 82 ARG HG2 1.0 . 1.8 596 596 A 82 ARG HG2 A 75 CYS HA 1.0 . 1.8 597 597 A 53 VAL HA A 54 PRO HD3 1.0 . 1.8 598 598 A 67 TYR HA A 68 LYS HB2 1.0 . 1.8 599 599 A 103 VAL HG2% A 84 ARG HB3 1.0 . 1.8 600 600 A 81 THR HG2% A 106 PRO HB3 1.0 . 1.8 601 601 A 82 ARG HD2 A 82 ARG HB2 1.0 . 1.8 602 602 A 105 LYS HB3 A 105 LYS HE2 1.0 . 1.8 603 603 A 105 LYS HD3 A 105 LYS HG2 1.0 . 1.8 604 604 A 105 LYS HD2 A 105 LYS HG2 1.0 . 1.8 605 605 A 105 LYS HG2 A 105 LYS HB2 1.0 . 1.8 606 606 A 107 CYS HB2 A 107 CYS HA 1.0 . 1.8 607 607 A 36 GLY HA3 A 28 PRO HA 1.0 . 5.5 608 608 A 58 LYS HG2 A 58 LYS HE2 1.0 . 5.5 609 609 A 47 LYS HG2 A 47 LYS HE2 1.0 . 5.5 610 610 A 58 LYS HG2 A 58 LYS HA 1.0 . 5.5 611 611 A 58 LYS HG2 A 58 LYS HB3 1.0 . 5.5 612 612 A 47 LYS HG2 A 47 LYS HD3 1.0 . 3.4 613 613 A 47 LYS HG2 A 47 LYS HD2 1.0 . 3.4 614 614 A 40 ALA HB% A 23 TYR HD1 1.0 . 5.5 615 615 A 40 ALA HB% A 41 THR HA 1.0 . 5.5 616 616 A 40 ALA HB% A 23 TYR HA 1.0 . 5.5 617 617 A 40 ALA HB% A 21 TRP HA 1.0 . 5.5 618 618 A 40 ALA HB% A 47 LYS HB2 1.0 . 5.5 619 619 A 40 ALA HB% A 39 GLU HA 1.0 . 5.5 620 620 A 40 ALA HB% A 21 TRP HZ3 1.0 . 5.5 621 621 A 40 ALA HB% A 21 TRP HE3 1.0 . 5.5 622 622 A 40 ALA HB% A 21 TRP HB2 1.0 . 5.5 623 623 A 40 ALA HB% A 21 TRP HB3 1.0 . 5.5 624 624 A 40 ALA HB% A 40 ALA HA 1.0 . 5.5 625 625 A 105 LYS HG3 A 105 LYS HB3 1.0 . 5.5 626 626 A 105 LYS HG3 A 105 LYS HD2 1.0 . 5.5 627 627 A 105 LYS HG3 A 105 LYS HD3 1.0 . 5.5 628 628 A 92 LEU HD2% A 92 LEU HB2 1.0 . 5.5 629 629 A 92 LEU HD2% A 92 LEU HB3 1.0 . 5.5 630 630 A 92 LEU HD2% A 90 LYS HE2 1.0 . 5.5 631 631 A 92 LEU HD2% A 92 LEU HA 1.0 . 3.4 632 632 A 92 LEU HD2% A 92 LEU HG 1.0 . 3.4 633 633 A 92 LEU HD2% A 90 LYS HG2 1.0 . 5.5 634 634 A 92 LEU HD2% A 90 LYS HD2 1.0 . 5.5 635 635 A 105 LYS HD2 A 105 LYS HG2 1.0 . 5.5 636 636 A 83 SER HB3 A 104 SER HA 1.0 . 5.5 637 637 A 83 SER HB3 A 82 ARG HA 1.0 . 5.5 638 638 A 104 SER HB3 A 81 THR HB 1.0 . 5.5 639 639 A 104 SER HB2 A 81 THR HG2% 1.0 . 5.5 640 640 A 104 SER HA A 104 SER HB2 1.0 . 5.5 641 641 A 81 THR HB A 104 SER HB2 1.0 . 5.5 642 642 A 40 ALA HB% A 23 TYR HE1 1.0 . 5.5 643 643 A 92 LEU HD2% A 90 LYS HB2 1.0 . 5.5 644 644 A 104 SER HB3 A 81 THR HG2% 1.0 . 5.5 645 645 A 107 CYS HB2 A 107 CYS HA 1.0 . 5.5 646 646 A 86 GLY HA3 A 86 GLY HA2 1.0 . 5.5 647 647 A 99 THR HG2% A 98 GLN HA 1.0 . 5.5 648 648 A 99 THR HG2% A 88 LEU HD2% 1.0 . 5.5 649 649 A 99 THR HG2% A 99 THR HB 1.0 . 3.4 650 650 A 88 LEU HD2% A 99 THR HA 1.0 . 5.5 651 651 A 99 THR HG2% A 99 THR HB 1.0 . 5.5 652 652 A 88 LEU HD1% A 88 LEU HB2 1.0 . 5.5 653 653 A 88 LEU HD1% A 65 CYS HB2 1.0 . 5.5 654 654 A 88 LEU HD1% A 88 LEU HA 1.0 . 5.5 655 655 A 88 LEU HD1% A 67 TYR HE1 1.0 . 5.5 656 656 A 88 LEU HD1% A 88 LEU HG 1.0 . 5.5 657 657 A 99 THR HA A 88 LEU HD1% 1.0 . 5.5 658 658 A 88 LEU HD1% A 65 CYS HB3 1.0 . 5.5 659 659 A 88 LEU HD1% A 89 LYS HA 1.0 . 5.5 660 660 A 88 LEU HD1% A 91 ALA HA 1.0 . 5.5 661 661 A 82 ARG HD2 A 82 ARG HB3 1.0 . 5.5 662 662 A 77 THR HG2% A 77 THR HB 1.0 . 3.4 663 663 A 77 THR HG2% A 77 THR HA 1.0 . 3.4 664 664 A 77 THR HG2% A 109 PRO HB3 1.0 . 5.5 665 665 A 77 THR HG2% A 76 ASP HA 1.0 . 5.5 666 666 A 77 THR HG2% A 109 PRO HG3 1.0 . 5.5 667 667 A 77 THR HG2% A 77 THR HB 1.0 . 2.8 668 668 A 28 PRO HA A 53 VAL HG1% 1.0 . 5.5 669 669 A 53 VAL HG1% A 28 PRO HD2 1.0 . 5.5 670 670 A 88 LEU HD1% A 97 CYS HB3 1.0 . 5.5 671 671 A 88 LEU HD1% A 67 TYR HA 1.0 . 5.5 672 672 A 88 LEU HD1% A 65 CYS HA 1.0 . 5.5 673 673 A 82 ARG HD2 A 82 ARG HG2 1.0 . 5.5 674 674 A 82 ARG HD2 A 82 ARG HG3 1.0 . 5.5 675 675 A 88 LEU HD1% A 97 CYS HB2 1.0 . 5.5 676 676 A 97 CYS HB2 A 97 CYS HA 1.0 . 5.5 677 677 A 77 THR HG2% A 109 PRO HB2 1.0 . 5.5 678 678 A 78 THR HG2% A 78 THR HA 1.0 . 5.5 679 679 A 100 THR HG2% A 100 THR HA 1.0 . 5.5 680 680 A 79 THR HG2% A 79 THR HB 1.0 . 3.4 681 681 A 41 THR HG2% A 44 GLU HA 1.0 . 5.5 682 682 A 49 THR HG2% A 47 LYS HE3 1.0 . 5.5 683 683 A 49 THR HG2% A 48 LYS HA 1.0 . 5.5 684 684 A 103 VAL HG1% A 69 PHE HE1 1.0 . 5.5 685 685 A 103 VAL HG1% A 69 PHE HZ 1.0 . 5.5 686 686 A 103 VAL HG1% A 101 ILE HG2% 1.0 . 5.5 687 687 A 103 VAL HG1% A 103 VAL HA 1.0 . 5.5 688 688 A 103 VAL HG1% A 101 ILE HD1% 1.0 . 5.5 689 689 A 103 VAL HG1% A 72 TRP HZ2 1.0 . 5.5 690 690 A 53 VAL HG1% A 33 CYS HA 1.0 . 5.5 691 691 A 53 VAL HG1% A 53 VAL HG2% 1.0 . 5.5 692 692 A 53 VAL HG1% A 26 CYS HBx 1.0 . 5.5 693 693 A 53 VAL HG1% A 53 VAL HA 1.0 . 5.5 694 694 A 53 VAL HG1% A 53 VAL HB 1.0 . 5.5 695 695 A 53 VAL HG1% A 52 LYS HA 1.0 . 5.5 696 696 A 53 VAL HG1% A 28 PRO HB2 1.0 . 5.5 697 697 A 53 VAL HG1% A 28 PRO HD3 1.0 . 5.5 698 698 A 53 VAL HG1% A 52 LYS HD2 1.0 . 5.5 699 699 A 53 VAL HG1% A 28 PRO HG3 1.0 . 5.5 700 700 A 53 VAL HG1% A 28 PRO HG2 1.0 . 5.5 701 701 A 70 GLY HA2 A 70 GLY HA3 1.0 . 3.4 702 702 A 24 GLY HA3 A 24 GLY HA2 1.0 . 5.5 703 703 A 71 ARG HD2 A 71 ARG HB3 1.0 . 3.4 704 704 A 71 ARG HD2 A 71 ARG HG2 1.0 . 2.8 705 705 A 108 THR HG2% A 109 PRO HD2 1.0 . 5.5 706 706 A 108 THR HG2% A 108 THR HB 1.0 . 3.4 707 707 A 87 THR HG2% A 87 THR HA 1.0 . 5.5 708 708 A 87 THR HG2% A 87 THR HB 1.0 . 3.4 709 709 A 79 THR HG2% A 79 THR HA 1.0 . 3.4 710 710 A 78 THR HG2% A 78 THR HB 1.0 . 5.5 711 711 A 46 THR HG2% A 39 GLU HG2 1.0 . 5.5 712 712 A 46 THR HG2% A 39 GLU HG3 1.0 . 5.5 713 713 A 39 GLU HA A 46 THR HG2% 1.0 . 5.5 714 714 A 41 THR HG2% A 45 GLN HA 1.0 . 5.5 715 715 A 46 THR HG2% A 39 GLU HB2 1.0 . 5.5 716 716 A 46 THR HG2% A 46 THR HB 1.0 . 2.8 717 717 A 41 THR HA A 41 THR HG2% 1.0 . 5.5 718 718 A 47 LYS HE2 A 49 THR HG2% 1.0 . 5.5 719 719 A 49 THR HG2% A 49 THR HA 1.0 . 5.5 720 720 A 47 LYS HB2 A 49 THR HG2% 1.0 . 5.5 721 721 A 49 THR HG2% A 38 ARG HB2 1.0 . 5.5 722 722 A 23 TYR HE1 A 49 THR HG2% 1.0 . 5.5 723 723 A 49 THR HG2% A 49 THR HB 1.0 . 3.4 724 724 A 104 SER HB2 A 81 THR HG2% 1.0 . 5.5 725 725 A 81 THR HG2% A 106 PRO HA 1.0 . 5.5 726 726 A 81 THR HG2% A 79 THR HA 1.0 . 5.5 727 727 A 81 THR HG2% A 81 THR HA 1.0 . 5.5 728 728 A 81 THR HB A 81 THR HG2% 1.0 . 5.5 729 729 A 81 THR HG2% A 106 PRO HG2 1.0 . 5.5 730 730 A 81 THR HG2% A 79 THR HB 1.0 . 5.5 731 731 A 103 VAL HG1% A 72 TRP HH2 1.0 . 5.5 732 732 A 103 VAL HG1% A 103 VAL HB 1.0 . 3.4 733 733 A 103 VAL HG1% A 102 LYS HA 1.0 . 5.5 734 734 A 103 VAL HG1% A 101 ILE HG13 1.0 . 5.5 735 735 A 85 SER HB2 A 85 SER HA 1.0 . 5.5 736 736 A 85 SER HB2 A 102 LYS HD2 1.0 . 5.5 737 737 A 85 SER HB2 A 85 SER HA 1.0 . 5.5 738 738 A 71 ARG HD2 A 71 ARG HA 1.0 . 5.5 739 739 A 99 THR HA A 88 LEU HB2 1.0 . 5.5 740 740 A 91 ALA HB% A 90 LYS HA 1.0 . 5.5 741 741 A 91 ALA HA A 91 ALA HB% 1.0 . 3.4 742 742 A 88 LEU HD2% A 91 ALA HB% 1.0 . 5.5 743 743 A 27 VAL HG1% A 38 ARG HA 1.0 . 5.5 744 744 A 88 LEU HB2 A 88 LEU HG 1.0 . 5.5 745 745 A 27 VAL HG1% A 27 VAL HA 1.0 . 5.5 746 746 A 27 VAL HG1% A 26 CYS HA 1.0 . 5.5 747 747 A 27 VAL HG1% A 25 LYS HBx 1.0 . 5.5 748 748 A 28 PRO HD2 A 27 VAL HG1% 1.0 . 5.5 749 749 A 27 VAL HG1% A 25 LYS HDx 1.0 . 5.5 750 750 A 77 THR HG2% A 77 THR HA 1.0 . 5.5 751 751 A 77 THR HB A 77 THR HA 1.0 . 3.4 752 752 A 30 SER HBx A 30 SER HA 1.0 . 2.8 753 753 A 92 LEU HD2% A 92 LEU HB2 1.0 . 5.5 754 754 A 92 LEU HB2 A 92 LEU HB3 1.0 . 3.4 755 755 A 92 LEU HB2 A 64 ASP HA 1.0 . 5.5 756 756 A 92 LEU HB2 A 92 LEU HA 1.0 . 5.5 757 757 A 92 LEU HB2 A 92 LEU HG 1.0 . 3.4 758 758 A 92 LEU HB2 A 92 LEU HD1% 1.0 . 5.5 759 759 A 101 ILE HB A 101 ILE HA 1.0 . 5.5 760 760 A 101 ILE HG13 A 101 ILE HB 1.0 . 5.5 761 761 A 101 ILE HG2% A 101 ILE HB 1.0 . 5.5 762 762 A 101 ILE HD1% A 101 ILE HB 1.0 . 5.5 763 763 A 92 LEU HB3 A 92 LEU HA 1.0 . 5.5 764 764 A 92 LEU HB3 A 92 LEU HG 1.0 . 5.5 765 765 A 92 LEU HB3 A 92 LEU HD1% 1.0 . 5.5 766 766 A 28 PRO HD3 A 27 VAL HG2% 1.0 . 5.5 767 767 A 28 PRO HD2 A 27 VAL HG2% 1.0 . 5.5 768 768 A 103 VAL HG1% A 103 VAL HG2% 1.0 . 5.5 769 769 A 69 PHE HE1 A 103 VAL HG2% 1.0 . 5.5 770 770 A 101 ILE HD1% A 103 VAL HG2% 1.0 . 5.5 771 771 A 72 TRP HH2 A 103 VAL HG2% 1.0 . 5.5 772 772 A 95 ALA HB% A 95 ALA HA 1.0 . 3.4 773 773 A 53 VAL HG2% A 53 VAL HA 1.0 . 5.5 774 774 A 28 PRO HD2 A 53 VAL HG2% 1.0 . 5.5 775 775 A 53 VAL HG2% A 33 CYS HB3 1.0 . 5.5 776 776 A 27 VAL HG1% A 25 LYS HE3 1.0 . 2.8 777 777 A 27 VAL HA A 27 VAL HG2% 1.0 . 5.5 778 778 A 27 VAL HG2% A 27 VAL HB 1.0 . 3.4 779 779 A 28 PRO HG3 A 27 VAL HG2% 1.0 . 5.5 780 780 A 28 PRO HG2 A 27 VAL HG2% 1.0 . 5.5 781 781 A 103 VAL HA A 103 VAL HG2% 1.0 . 5.5 782 782 A 103 VAL HB A 103 VAL HG2% 1.0 . 5.5 783 783 A 103 VAL HG2% A 72 TRP HZ3 1.0 . 5.5 784 784 A 102 LYS HA A 103 VAL HG2% 1.0 . 5.5 785 785 A 103 VAL HG2% A 84 ARG HD2 1.0 . 5.5 786 786 A 72 TRP HZ2 A 103 VAL HG2% 1.0 . 5.5 787 787 A 19 SER HBx A 19 SER HA 1.0 . 3.4 788 788 A 90 LYS HE2 A 90 LYS HD2 1.0 . 2.8 789 789 A 90 LYS HE2 A 90 LYS HG2 1.0 . 2.8 790 790 A 18 CYS HB2 A 18 CYS HA 1.0 . 3.4 791 791 A 18 CYS HB2 A 21 TRP HZ2 1.0 . 5.5 792 792 A 36 GLY HA3 A 37 ILE HB 1.0 . 5.5 793 793 A 37 ILE HB A 37 ILE HG2% 1.0 . 3.4 794 794 A 37 ILE HB A 37 ILE HA 1.0 . 5.5 795 795 A 73 ALA HB% A 74 GLU HG2 1.0 . 5.5 796 796 A 73 ALA HB% A 74 GLU HA 1.0 . 5.5 797 797 A 82 ARG HA A 73 ALA HB% 1.0 . 5.5 798 798 A 73 ALA HB% A 84 ARG HA 1.0 . 5.5 799 799 A 73 ALA HB% A 74 GLU HB2 1.0 . 5.5 800 800 A 73 ALA HB% A 73 ALA HA 1.0 . 3.4 801 801 A 37 ILE HB A 37 ILE HG12 1.0 . 5.5 802 802 A 67 TYR HA A 67 TYR HB3 1.0 . 5.5 803 803 A 53 VAL HG1% A 53 VAL HG2% 1.0 . 5.5 804 804 A 53 VAL HG2% A 53 VAL HB 1.0 . 5.5 805 805 A 33 CYS HA A 53 VAL HG2% 1.0 . 5.5 806 806 A 53 VAL HG2% A 52 LYS HD2 1.0 . 5.5 807 807 A 53 VAL HG2% A 28 PRO HG3 1.0 . 5.5 808 808 A 53 VAL HG2% A 28 PRO HG2 1.0 . 5.5 809 809 A 53 VAL HG2% A 33 CYS HB2 1.0 . 5.5 810 810 A 53 VAL HG2% A 55 CYS HA 1.0 . 5.5 811 811 A 76 ASP HA A 76 ASP HB2 1.0 . 5.5 812 812 A 32 ASP HB2 A 32 ASP HA 1.0 . 3.4 813 813 A 67 TYR HB2 A 67 TYR HD1 1.0 . 5.5 814 814 A 67 TYR HA A 67 TYR HB2 1.0 . 5.5 815 815 A 73 ALA HB% A 72 TRP HA 1.0 . 5.5 816 816 A 37 ILE HB A 37 ILE HD1% 1.0 . 5.5 817 817 A 37 ILE HB A 37 ILE HG13 1.0 . 3.4 818 818 A 65 CYS HB2 A 65 CYS HA 1.0 . 5.5 819 819 A 65 CYS HB2 A 67 TYR HE1 1.0 . 5.5 820 820 A 64 ASP HA A 64 ASP HB2 1.0 . 5.5 821 821 A 88 LEU HD1% A 65 CYS HB3 1.0 . 5.5 822 822 A 65 CYS HB3 A 63 ALA HB% 1.0 . 5.5 823 823 A 67 TYR HE1 A 65 CYS HB3 1.0 . 5.5 824 824 A 47 LYS HE2 A 47 LYS HD2 1.0 . 3.4 825 825 A 14 ALA HB% A 14 ALA HA 1.0 . 2.8 826 826 A 23 TYR HA A 23 TYR HBx 1.0 . 5.5 827 827 A 26 CYS HBx A 26 CYS HA 1.0 . 5.5 828 828 A 26 CYS HBx A 26 CYS HA 1.0 . 5.5 829 829 A 15 ASP HB3 A 15 ASP HA 1.0 . 3.4 830 830 A 60 ASP HB2 A 60 ASP HA 1.0 . 3.4 831 831 A 28 PRO HA A 28 PRO HB2 1.0 . 5.5 832 832 A 23 TYR HD1 A 23 TYR HBx 1.0 . 5.5 833 833 A 37 ILE HB A 37 ILE HG2% 1.0 . 3.4 834 834 A 37 ILE HG2% A 37 ILE HA 1.0 . 5.5 835 835 A 37 ILE HG2% A 50 LYS HA 1.0 . 5.5 836 836 A 37 ILE HG2% A 48 LYS HB2 1.0 . 5.5 837 837 A 37 ILE HG2% A 37 ILE HD1% 1.0 . 5.5 838 838 A 39 GLU HB2 A 37 ILE HG2% 1.0 . 5.5 839 839 A 37 ILE HG2% A 48 LYS HD2 1.0 . 5.5 840 840 A 37 ILE HG2% A 48 LYS HG2 1.0 . 5.5 841 841 A 48 LYS HA A 37 ILE HG2% 1.0 . 5.5 842 842 A 37 ILE HG2% A 48 LYS HE2 1.0 . 5.5 843 843 A 39 GLU HG2 A 37 ILE HG2% 1.0 . 5.5 844 844 A 38 ARG HA A 37 ILE HG2% 1.0 . 5.5 845 845 A 37 ILE HG2% A 37 ILE HG12 1.0 . 5.5 846 846 A 42 CYS HB2 A 42 CYS HB3 1.0 . 5.5 847 847 A 42 CYS HB2 A 42 CYS HA 1.0 . 5.5 848 848 A 42 CYS HB3 A 42 CYS HA 1.0 . 5.5 849 849 A 42 CYS HB2 A 42 CYS HB3 1.0 . 5.5 850 850 A 101 ILE HG2% A 98 GLN HB2 1.0 . 5.5 851 851 A 61 PHE HBy A 61 PHE HB2 1.0 . 2.8 852 852 A 61 PHE HBy A 61 PHE HA 1.0 . 5.5 853 853 A 61 PHE HB2 A 61 PHE HD1 1.0 . 5.5 854 854 A 61 PHE HB2 A 61 PHE HA 1.0 . 5.5 855 855 A 69 PHE HE1 A 101 ILE HG2% 1.0 . 5.5 856 856 A 101 ILE HG2% A 101 ILE HB 1.0 . 5.5 857 857 A 100 THR HA A 101 ILE HG2% 1.0 . 5.5 858 858 A 101 ILE HG2% A 101 ILE HA 1.0 . 5.5 859 859 A 101 ILE HG2% A 98 GLN HG2 1.0 . 5.5 860 860 A 67 TYR HE1 A 101 ILE HG2% 1.0 . 5.5 861 861 A 101 ILE HG2% A 98 GLN HB3 1.0 . 5.5 862 862 A 101 ILE HG2% A 101 ILE HG12 1.0 . 5.5 863 863 A 101 ILE HG2% A 101 ILE HG12 1.0 . 5.5 864 864 A 103 VAL HG1% A 101 ILE HG2% 1.0 . 5.5 865 865 A 101 ILE HG2% A 101 ILE HD1% 1.0 . 5.5 866 866 A 35 ASN HB2 A 35 ASN HA 1.0 . 5.5 867 867 A 56 ASN HB2 A 56 ASN HA 1.0 . 3.4 868 868 A 29 ASN HB3 A 29 ASN HA 1.0 . 5.5 869 869 A 29 ASN HA A 29 ASN HB2 1.0 . 5.5 870 870 A 93 PHE HBy A 93 PHE HA 1.0 . 5.5 871 871 A 93 PHE HA A 93 PHE HB2 1.0 . 5.5 872 872 A 39 GLU HA A 39 GLU HG2 1.0 . 5.5 873 873 A 93 PHE HB2 A 93 PHE HD1 1.0 . 5.5 874 874 A 46 THR HG2% A 39 GLU HG2 1.0 . 5.5 875 875 A 39 GLU HG2 A 39 GLU HB2 1.0 . 2.8 876 876 A 46 THR HG2% A 39 GLU HG3 1.0 . 5.5 877 877 A 39 GLU HG3 A 39 GLU HB2 1.0 . 2.8 878 878 A 39 GLU HA A 39 GLU HG3 1.0 . 5.5 879 879 A 43 ASN HB2 A 43 ASN HA 1.0 . 3.4 880 880 A 44 GLU HA A 44 GLU HG2 1.0 . 3.4 881 881 A 44 GLU HG2 A 44 GLU HB2 1.0 . 2.8 882 882 A 74 GLU HG2 A 74 GLU HA 1.0 . 5.5 883 883 A 74 GLU HG2 A 74 GLU HB2 1.0 . 2.8 884 884 A 74 GLU HG2 A 73 ALA HA 1.0 . 5.5 885 885 A 17 GLU HGx A 17 GLU HA 1.0 . 3.4 886 886 A 17 GLU HGx A 17 GLU HBx 1.0 . 2.8 887 887 A 96 GLU HG2 A 96 GLU HA 1.0 . 5.5 888 888 A 86 GLY HA3 A 101 ILE HD1% 1.0 . 5.5 889 889 A 69 PHE HE1 A 101 ILE HD1% 1.0 . 5.5 890 890 A 20 GLU HGx A 20 GLU HA 1.0 . 5.5 891 891 A 47 LYS HB2 A 47 LYS HA 1.0 . 3.4 892 892 A 47 LYS HB2 A 47 LYS HA 1.0 . 3.4 893 893 A 101 ILE HD1% A 67 TYR HD1 1.0 . 5.5 894 894 A 103 VAL HG1% A 101 ILE HD1% 1.0 . 5.5 895 895 A 101 ILE HD1% A 101 ILE HB 1.0 . 5.5 896 896 A 101 ILE HD1% A 103 VAL HG2% 1.0 . 5.5 897 897 A 69 PHE HZ A 101 ILE HD1% 1.0 . 5.5 898 898 A 101 ILE HG2% A 101 ILE HD1% 1.0 . 5.5 899 899 A 101 ILE HD1% A 101 ILE HA 1.0 . 5.5 900 900 A 67 TYR HE1 A 101 ILE HD1% 1.0 . 5.5 901 901 A 101 ILE HD1% A 101 ILE HG12 1.0 . 5.5 902 902 A 101 ILE HD1% A 101 ILE HG13 1.0 . 3.4 903 903 A 104 SER HB2 A 103 VAL HB 1.0 . 5.5 904 904 A 103 VAL HG1% A 103 VAL HB 1.0 . 5.5 905 905 A 103 VAL HB A 103 VAL HG2% 1.0 . 5.5 906 906 A 103 VAL HA A 103 VAL HB 1.0 . 3.4 907 907 A 53 VAL HG1% A 53 VAL HB 1.0 . 5.5 908 908 A 53 VAL HG2% A 53 VAL HB 1.0 . 5.5 909 909 A 53 VAL HA A 53 VAL HB 1.0 . 5.5 910 910 A 53 VAL HB A 33 CYS HB2 1.0 . 5.5 911 911 A 102 LYS HA A 102 LYS HBy 1.0 . 5.5 912 912 A 33 CYS HA A 53 VAL HB 1.0 . 5.5 913 913 A 53 VAL HB A 33 CYS HB3 1.0 . 5.5 914 914 A 88 LEU HA A 67 TYR HA 1.0 . 5.5 915 915 A 88 LEU HA A 67 TYR HD1 1.0 . 5.5 916 916 A 88 LEU HD1% A 88 LEU HA 1.0 . 5.5 917 917 A 88 LEU HB2 A 88 LEU HA 1.0 . 5.5 918 918 A 98 GLN HA A 98 GLN HG2 1.0 . 3.4 919 919 A 45 GLN HA A 45 GLN HG2 1.0 . 5.5 920 920 A 37 ILE HG2% A 48 LYS HB2 1.0 . 5.5 921 921 A 90 LYS HB2 A 90 LYS HA 1.0 . 3.4 922 922 A 105 LYS HG3 A 105 LYS HB3 1.0 . 5.5 923 923 A 105 LYS HB3 A 105 LYS HG2 1.0 . 5.5 924 924 A 105 LYS HB2 A 106 PRO HD2 1.0 . 5.5 925 925 A 105 LYS HB2 A 106 PRO HD3 1.0 . 5.5 926 926 A 101 ILE HG2% A 98 GLN HG2 1.0 . 5.5 927 927 A 97 CYS HA A 98 GLN HG2 1.0 . 5.5 928 928 A 98 GLN HG2 A 98 GLN HB3 1.0 . 2.8 929 929 A 98 GLN HB2 A 98 GLN HG2 1.0 . 3.4 930 930 A 45 GLN HG2 A 45 GLN HB2 1.0 . 2.8 931 931 A 82 ARG HD2 A 82 ARG HB3 1.0 . 5.5 932 932 A 38 ARG HB2 A 38 ARG HA 1.0 . 5.5 933 933 A 37 ILE HB A 37 ILE HD1% 1.0 . 5.5 934 934 A 37 ILE HG2% A 37 ILE HD1% 1.0 . 5.5 935 935 A 37 ILE HD1% A 50 LYS HE2 1.0 . 5.5 936 936 A 37 ILE HD1% A 50 LYS HD2 1.0 . 5.5 937 937 A 22 GLN HGx A 22 GLN HA 1.0 . 3.4 938 938 A 22 GLN HGx A 22 GLN HB2 1.0 . 2.8 939 939 A 38 ARG HB2 A 38 ARG HDy 1.0 . 5.5 940 940 A 68 LYS HB2 A 68 LYS HA 1.0 . 5.5 941 941 A 37 ILE HA A 37 ILE HD1% 1.0 . 5.5 942 942 A 37 ILE HG12 A 37 ILE HD1% 1.0 . 3.4 943 943 A 37 ILE HD1% A 50 LYS HA 1.0 . 5.5 944 944 A 37 ILE HD1% A 50 LYS HG2 1.0 . 5.5 945 945 A 72 TRP HA A 84 ARG HB2 1.0 . 5.5 946 946 A 84 ARG HA A 84 ARG HB2 1.0 . 5.5 947 947 A 27 VAL HB A 25 LYS HGx 1.0 . 3.4 948 948 A 115 LYS HBx A 115 LYS HA 1.0 . 2.8 949 949 A 59 LYS HB2 A 59 LYS HA 1.0 . 2.8 950 950 A 72 TRP HA A 84 ARG HB3 1.0 . 5.5 951 951 A 84 ARG HA A 84 ARG HB3 1.0 . 5.5 952 952 A 27 VAL HA A 27 VAL HB 1.0 . 5.5 953 953 A 58 LYS HG2 A 58 LYS HB3 1.0 . 3.4 954 954 A 58 LYS HA A 58 LYS HB2 1.0 . 5.5 955 955 A 106 PRO HA A 106 PRO HB2 1.0 . 5.5 956 956 A 106 PRO HD2 A 106 PRO HB2 1.0 . 5.5 957 957 A 106 PRO HG2 A 106 PRO HB2 1.0 . 3.4 958 958 A 106 PRO HD3 A 106 PRO HB2 1.0 . 5.5 959 959 A 54 PRO HB3 A 54 PRO HA 1.0 . 2.8 960 960 A 54 PRO HB3 A 54 PRO HB2 1.0 . 2.8 961 961 A 54 PRO HB3 A 54 PRO HG2 1.0 . 2.8 962 962 A 54 PRO HB3 A 54 PRO HD3 1.0 . 5.5 963 963 A 54 PRO HA A 54 PRO HB2 1.0 . 3.4 964 964 A 106 PRO HA A 106 PRO HB3 1.0 . 5.5 965 965 A 106 PRO HD3 A 106 PRO HB3 1.0 . 5.5 966 966 A 39 GLU HA A 39 GLU HB2 1.0 . 5.5 967 967 A 46 THR HG2% A 39 GLU HB2 1.0 . 5.5 968 968 A 36 GLY HA3 A 28 PRO HB2 1.0 . 5.5 969 969 A 39 GLU HG3 A 39 GLU HB2 1.0 . 3.4 970 970 A 39 GLU HB2 A 38 ARG HA 1.0 . 5.5 971 971 A 28 PRO HB2 A 28 PRO HG3 1.0 . 3.4 972 972 A 28 PRO HA A 28 PRO HB2 1.0 . 3.4 973 973 A 28 PRO HB2 A 28 PRO HG2 1.0 . 3.4 974 974 A 95 ALA HB% A 95 ALA HA 1.0 . 5.5 975 975 A 45 GLN HG2 A 45 GLN HBy 1.0 . 2.8 976 976 A 45 GLN HG2 A 45 GLN HB2 1.0 . 2.8 977 977 A 45 GLN HA A 45 GLN HB2 1.0 . 5.5 978 978 A 71 ARG HD2 A 71 ARG HB3 1.0 . 5.5 979 979 A 71 ARG HB3 A 71 ARG HG2 1.0 . 2.8 980 980 A 71 ARG HD2 A 71 ARG HB2 1.0 . 5.5 981 981 A 73 ALA HB% A 71 ARG HB2 1.0 . 5.5 982 982 A 45 GLN HB2 A 21 TRP HH2 1.0 . 5.5 983 983 A 71 ARG HA A 71 ARG HB2 1.0 . 5.5 984 984 A 17 GLU HGx A 17 GLU HB3 1.0 . 2.8 985 985 A 17 GLU HA A 17 GLU HB3 1.0 . 3.4 986 986 A 17 GLU HBx A 17 GLU HB3 1.0 . 2.8 987 987 A 20 GLU HA A 20 GLU HBx 1.0 . 5.5 988 988 A 17 GLU HGx A 17 GLU HBx 1.0 . 2.8 989 989 A 17 GLU HA A 17 GLU HBx 1.0 . 3.4 990 990 A 20 GLU HA A 20 GLU HBx 1.0 . 3.4 991 991 A 21 TRP HB2 A 21 TRP HB3 1.0 . 3.4 992 992 A 74 GLU HA A 74 GLU HBy 1.0 . 5.5 993 993 A 81 THR HB A 81 THR HG2% 1.0 . 5.5 994 994 A 81 THR HB A 81 THR HA 1.0 . 5.5 995 995 A 21 TRP HB2 A 21 TRP HD1 1.0 . 5.5 996 996 A 40 ALA HB% A 21 TRP HB2 1.0 . 5.5 997 997 A 21 TRP HA A 21 TRP HB2 1.0 . 5.5 998 998 A 40 ALA HB% A 21 TRP HB3 1.0 . 5.5 999 999 A 21 TRP HA A 21 TRP HB3 1.0 . 5.5 1000 1000 A 21 TRP HB2 A 21 TRP HB3 1.0 . 3.4 1001 1001 A 28 PRO HD3 A 27 VAL HA 1.0 . 5.5 1002 1002 A 57 TRP HB2 A 57 TRP HA 1.0 . 3.4 1003 1003 A 21 TRP HB2 A 21 TRP HB3 1.0 . 3.4 1004 1004 A 21 TRP HE3 A 21 TRP HB3 1.0 . 5.5 1005 1005 A 22 GLN HA A 22 GLN HB2 1.0 . 3.4 1006 1006 A 22 GLN HA A 22 GLN HB3 1.0 . 5.5 1007 1007 A 102 LYS HD2 A 83 SER HB2 1.0 . 5.5 1008 1008 A 47 LYS HE2 A 47 LYS HD2 1.0 . 3.4 1009 1009 A 108 THR HG2% A 109 PRO HD3 1.0 . 5.5 1010 1010 A 109 PRO HD3 A 108 THR HA 1.0 . 2.8 1011 1011 A 109 PRO HB3 A 109 PRO HD3 1.0 . 5.5 1012 1012 A 28 PRO HD2 A 27 VAL HG1% 1.0 . 5.5 1013 1013 A 54 PRO HA A 54 PRO HD3 1.0 . 5.5 1014 1014 A 54 PRO HD3 A 54 PRO HG3 1.0 . 5.5 1015 1015 A 108 THR HG2% A 109 PRO HD2 1.0 . 5.5 1016 1016 A 109 PRO HD2 A 108 THR HA 1.0 . 2.8 1017 1017 A 109 PRO HD2 A 108 THR HB 1.0 . 5.5 1018 1018 A 57 TRP HB2 A 57 TRP HE3 1.0 . 5.5 1019 1019 A 98 GLN HG2 A 98 GLN HB3 1.0 . 3.4 1020 1020 A 98 GLN HA A 98 GLN HB3 1.0 . 5.5 1021 1021 A 101 ILE HG2% A 98 GLN HB3 1.0 . 5.5 1022 1022 A 101 ILE HG2% A 98 GLN HB2 1.0 . 5.5 1023 1023 A 25 LYS HDx A 25 LYS HGx 1.0 . 2.8 1024 1024 A 48 LYS HD2 A 48 LYS HE2 1.0 . 2.8 1025 1025 A 47 LYS HD2 A 47 LYS HB2 1.0 . 3.4 1026 1026 A 47 LYS HD2 A 47 LYS HE3 1.0 . 5.5 1027 1027 A 47 LYS HG2 A 47 LYS HD2 1.0 . 2.8 1028 1028 A 54 PRO HA A 54 PRO HD3 1.0 . 5.5 1029 1029 A 54 PRO HB3 A 54 PRO HD3 1.0 . 5.5 1030 1030 A 54 PRO HG2 A 54 PRO HD3 1.0 . 2.8 1031 1031 A 106 PRO HD3 A 106 PRO HB3 1.0 . 5.5 1032 1032 A 106 PRO HD3 A 106 PRO HB2 1.0 . 5.5 1033 1033 A 106 PRO HG2 A 106 PRO HD3 1.0 . 5.5 1034 1034 A 66 LYS HD2 A 66 LYS HA 1.0 . 5.5 1035 1035 A 106 PRO HD3 A 105 LYS HA 1.0 . 5.5 1036 1036 A 105 LYS HB2 A 106 PRO HD3 1.0 . 5.5 1037 1037 A 44 GLU HA A 44 GLU HG2 1.0 . 3.4 1038 1038 A 44 GLU HB2 A 44 GLU HGy 1.0 . 2.8 1039 1039 A 44 GLU HA A 44 GLU HBy 1.0 . 3.4 1040 1040 A 49 THR HA A 49 THR HB 1.0 . 5.5 1041 1041 A 49 THR HG2% A 49 THR HB 1.0 . 5.5 1042 1042 A 41 THR HG2% A 41 THR HB 1.0 . 3.4 1043 1043 A 41 THR HA A 41 THR HB 1.0 . 5.5 1044 1044 A 53 VAL HA A 54 PRO HG2 1.0 . 5.5 1045 1045 A 53 VAL HG1% A 28 PRO HG3 1.0 . 5.5 1046 1046 A 28 PRO HG2 A 27 VAL HA 1.0 . 5.5 1047 1047 A 28 PRO HD2 A 28 PRO HG2 1.0 . 5.5 1048 1048 A 28 PRO HB2 A 28 PRO HG3 1.0 . 3.4 1049 1049 A 28 PRO HG3 A 32 ASP HA 1.0 . 5.5 1050 1050 A 28 PRO HD3 A 28 PRO HG3 1.0 . 5.5 1051 1051 A 28 PRO HD2 A 28 PRO HG3 1.0 . 3.4 1052 1052 A 28 PRO HG3 A 28 PRO HG2 1.0 . 2.8 1053 1053 A 92 LEU HD2% A 92 LEU HG 1.0 . 5.5 1054 1054 A 92 LEU HB2 A 92 LEU HG 1.0 . 5.5 1055 1055 A 92 LEU HB3 A 92 LEU HG 1.0 . 3.4 1056 1056 A 92 LEU HA A 92 LEU HG 1.0 . 5.5 1057 1057 A 54 PRO HG2 A 54 PRO HG3 1.0 . 2.8 1058 1058 A 28 PRO HG3 A 28 PRO HG2 1.0 . 3.4 1059 1059 A 33 CYS HA A 28 PRO HG2 1.0 . 5.5 1060 1060 A 28 PRO HB2 A 28 PRO HG2 1.0 . 3.4 1061 1061 A 28 PRO HG2 A 32 ASP HA 1.0 . 5.5 1062 1062 A 28 PRO HA A 28 PRO HG2 1.0 . 5.5 1063 1063 A 28 PRO HD3 A 28 PRO HG2 1.0 . 5.5 1064 1064 A 87 THR HA A 87 THR HB 1.0 . 5.5 1065 1065 A 71 ARG HD2 A 71 ARG HG2 1.0 . 2.8 1066 1066 A 71 ARG HG2 A 71 ARG HA 1.0 . 5.5 1067 1067 A 71 ARG HG2 A 71 ARG HB2 1.0 . 2.8 1068 1068 A 82 ARG HD2 A 82 ARG HG2 1.0 . 5.5 1069 1069 A 37 ILE HB A 37 ILE HG13 1.0 . 3.4 1070 1070 A 37 ILE HG2% A 37 ILE HG13 1.0 . 5.5 1071 1071 A 37 ILE HD1% A 37 ILE HG13 1.0 . 5.5 1072 1072 A 37 ILE HB A 37 ILE HG12 1.0 . 3.4 1073 1073 A 37 ILE HG12 A 37 ILE HD1% 1.0 . 5.5 1074 1074 A 37 ILE HG2% A 37 ILE HG12 1.0 . 5.5 1075 1075 A 88 LEU HD2% A 97 CYS HB2 1.0 . 5.5 1076 1076 A 88 LEU HD2% A 91 ALA HA 1.0 . 5.5 1077 1077 A 33 CYS HB2 A 55 CYS HA 1.0 . 5.5 1078 1078 A 88 LEU HD2% A 88 LEU HG 1.0 . 5.5 1079 1079 A 88 LEU HD2% A 88 LEU HA 1.0 . 5.5 1080 1080 A 99 THR HG2% A 88 LEU HD2% 1.0 . 5.5 1081 1081 A 88 LEU HD2% A 99 THR HA 1.0 . 5.5 1082 1082 A 88 LEU HD2% A 88 LEU HD1% 1.0 . 5.5 1083 1083 A 88 LEU HD2% A 88 LEU HB2 1.0 . 5.5 1084 1084 A 88 LEU HD2% A 67 TYR HE1 1.0 . 5.5 1085 1085 A 88 LEU HD2% A 101 ILE HG12 1.0 . 5.5 1086 1086 A 53 VAL HG2% A 33 CYS HB3 1.0 . 5.5 1087 1087 A 33 CYS HB3 A 33 CYS HB2 1.0 . 5.5 1088 1088 A 26 CYS HA A 38 ARG HG2 1.0 . 5.5 1089 1089 A 38 ARG HA A 38 ARG HG2 1.0 . 5.5 1090 1090 A 101 ILE HD1% A 101 ILE HG12 1.0 . 5.5 1091 1091 A 88 LEU HD2% A 91 ALA HB% 1.0 . 5.5 1092 1092 A 108 THR HG2% A 108 THR HB 1.0 . 5.5 1093 1093 A 79 THR HG2% A 80 GLY HA2 1.0 . 5.5 1094 1094 A 108 THR HA A 80 GLY HA2 1.0 . 5.5 1095 1095 A 33 CYS HA A 33 CYS HB3 1.0 . 5.5 1096 1096 A 33 CYS HB3 A 33 CYS HB2 1.0 . 5.5 1097 1097 A 38 ARG HG2 A 38 ARG HD2 1.0 . 5.5 1098 1098 A 101 ILE HG2% A 101 ILE HG12 1.0 . 5.5 1099 1099 A 101 ILE HG2% A 101 ILE HG12 1.0 . 5.5 1100 1100 A 101 ILE HD1% A 101 ILE HG12 1.0 . 5.5 1101 1101 A 108 THR HB A 108 THR HA 1.0 . 5.5 1102 1102 A 51 CYS HBx A 51 CYS HA 1.0 . 5.5 1103 1103 A 92 LEU HD2% A 92 LEU HD1% 1.0 . 5.5 1104 1104 A 92 LEU HB2 A 92 LEU HD1% 1.0 . 5.5 1105 1105 A 90 LYS HB2 A 92 LEU HD1% 1.0 . 5.5 1106 1106 A 92 LEU HA A 92 LEU HD1% 1.0 . 5.5 1107 1107 A 90 LYS HD2 A 92 LEU HD1% 1.0 . 5.5 1108 1108 A 92 LEU HG A 92 LEU HD1% 1.0 . 5.5 1109 1109 A 92 LEU HD1% A 64 ASP HB3 1.0 . 5.5 1110 1110 A 102 LYS HA A 102 LYS HGy 1.0 . 5.5 1111 1111 A 68 LYS HB2 A 68 LYS HG2 1.0 . 2.8 1112 1112 A 90 LYS HE2 A 92 LEU HD1% 1.0 . 5.5 1113 1113 A 25 LYS HBx A 25 LYS HGx 1.0 . 2.8 1114 1114 A 25 LYS HDx A 25 LYS HGx 1.0 . 2.8 1115 1115 A 90 LYS HG2 A 90 LYS HA 1.0 . 3.4 1116 1116 A 90 LYS HG2 A 90 LYS HD2 1.0 . 2.8 1117 1117 A 90 LYS HE2 A 90 LYS HG2 1.0 . 2.8 1118 1118 A 90 LYS HG2 A 90 LYS HB2 1.0 . 2.8 1119 1119 A 58 LYS HG2 A 58 LYS HE2 1.0 . 3.4 1120 1120 A 58 LYS HG2 A 58 LYS HA 1.0 . 5.5 1121 1121 A 58 LYS HG2 A 58 LYS HD2 1.0 . 2.8 1122 1122 A 58 LYS HG2 A 58 LYS HB3 1.0 . 3.4 1123 1123 A 36 GLY HA3 A 28 PRO HA 1.0 . 5.5 1124 1124 A 36 GLY HA3 A 36 GLY HA2 1.0 . 5.5 1125 1125 A 47 LYS HG2 A 47 LYS HE2 1.0 . 5.5 1126 1126 A 68 LYS HA A 68 LYS HG2 1.0 . 5.5 1127 1127 A 27 VAL HG1% A 27 VAL HB 1.0 . 3.4 1128 1128 A 14 ALA HB% A 13 LYS HA 1.0 . 5.5 1129 1129 A 18 CYS HB2 A 17 GLU HA 1.0 . 5.5 1130 1130 A 28 PRO HB2 A 27 VAL HG2% 1.0 . 5.5 1131 1131 A 83 SER HB3 A 83 SER HA 1.0 . 5.5 1132 1132 A 88 LEU HD1% A 97 CYS HB2 1.0 . 5.5 1133 1133 A 88 LEU HD1% A 91 ALA HB% 1.0 . 5.5 1134 1134 A 94 ASN HB2 A 94 ASN HA 1.0 . 3.4 1135 1135 A 33 CYS HA A 33 CYS HB2 1.0 . 5.5 1136 1136 A 53 VAL HG1% A 28 PRO HB2 1.0 . 5.5 1137 1137 A 20 GLU HGx A 20 GLU HBx 1.0 . 2.8 1138 1138 A 27 VAL HG1% A 27 VAL HB 1.0 . 3.4 1139 1139 A 41 THR HG2% A 41 THR HB 1.0 . 2.8 1140 1140 A 21 TRP HA A 42 CYS HB3 1.0 . 5.5 1141 1141 A 42 CYS HB2 A 42 CYS HB3 1.0 . 5.5 1142 1142 A 44 GLU HG2 A 44 GLU HB2 1.0 . 2.8 1143 1143 A 37 ILE HG2% A 48 LYS HD2 1.0 . 5.5 1144 1144 A 103 VAL HG2% A 72 TRP HE3 1.0 . 5.5 1145 1145 A 88 LEU HD1% A 67 TYR HD1 1.0 . 5.5 1146 1146 A 81 THR HG2% A 106 PRO HB2 1.0 . 5.5 1147 1147 A 88 LEU HA A 67 TYR HA 1.0 . 5.5 1148 1148 A 86 GLY HA3 A 69 PHE HA 1.0 . 5.5 1149 1149 A 64 ASP HA A 92 LEU HD1% 1.0 . 5.5 1150 1150 A 69 PHE HZ A 103 VAL HG2% 1.0 . 5.5 1151 1151 A 63 ALA HB% A 63 ALA HA 1.0 . 2.8 1152 1152 A 65 CYS HB3 A 65 CYS HA 1.0 . 5.5 1153 1153 A 76 ASP HA A 76 ASP HB3 1.0 . 5.5 1154 1154 A 88 LEU HD2% A 97 CYS HB2 1.0 . 5.5 1155 1155 A 101 ILE HG2% A 67 TYR HD1 1.0 . 5.5 1156 1156 A 101 ILE HG2% A 103 VAL HG2% 1.0 . 5.5 1157 1157 A 101 ILE HG2% A 103 VAL HG2% 1.0 . 5.5 1158 1158 A 21 TRP HB2 A 23 TYR HE1 1.0 . 5.5 1159 1159 A 105 LYS HB2 A 105 LYS HA 1.0 . 5.5 1160 1160 A 53 VAL HG1% A 33 CYS HB3 1.0 . 5.5 1161 1161 A 57 TRP HB2 A 57 TRP HD1 1.0 . 5.5 1162 1162 A 81 THR HG2% A 80 GLY HA3 1.0 . 5.5 1163 1163 A 81 THR HG2% A 80 GLY HA2 1.0 . 5.5 1164 1164 A 69 PHE HZ A 101 ILE HG2% 1.0 . 5.5 1165 1165 A 103 VAL HG2% A 83 SER HB2 1.0 . 5.5 1166 1166 A 88 LEU HD2% A 97 CYS HB3 1.0 . 5.5 1167 1167 A 21 TRP HA A 22 GLN HGx 1.0 . 5.5 1168 1168 A 88 LEU HD2% A 99 THR HB 1.0 . 5.5 1169 1169 A 88 LEU HD2% A 89 LYS HA 1.0 . 5.5 1170 1170 A 37 ILE HG2% A 48 LYS HD2 1.0 . 5.5 1171 1171 A 27 VAL HG1% A 25 LYS HBx 1.0 . 5.5 1172 1172 A 37 ILE HD1% A 50 LYS HB2 1.0 . 5.5 1173 1173 A 28 PRO HB2 A 27 VAL HG2% 1.0 . 5.5 1174 1174 A 53 VAL HG1% A 33 CYS HB3 1.0 . 5.5 1175 1175 A 53 VAL HG1% A 33 CYS HB2 1.0 . 5.5 1176 1176 A 39 GLU HG2 A 37 ILE HG2% 1.0 . 5.5 1177 1177 A 39 GLU HG2 A 46 THR HB 1.0 . 5.5 1178 1178 A 40 ALA HB% A 21 TRP HH2 1.0 . 5.5 1179 1179 A 21 TRP HE3 A 21 TRP HB2 1.0 . 5.5 1180 1180 A 21 TRP HB3 A 21 TRP HD1 1.0 . 5.5 1181 1181 A 21 TRP HB3 A 23 TYR HE1 1.0 . 5.5 1182 1182 A 49 THR HA A 49 THR HB 1.0 . 5.5 1183 1183 A 49 THR HG2% A 38 ARG HG2 1.0 . 5.5 1184 1184 A 27 VAL HG1% A 25 LYS HGx 1.0 . 5.5 1185 1185 A 38 ARG HB2 A 26 CYS HA 1.0 . 5.5 1186 1186 A 28 PRO HB2 A 36 GLY HA2 1.0 . 5.5 1187 1187 A 33 CYS HA A 28 PRO HB2 1.0 . 5.5 1188 1188 A 28 PRO HB2 A 32 ASP HA 1.0 . 5.5 1189 1189 A 41 THR HA A 42 CYS HB3 1.0 . 5.5 1190 1190 A 71 ARG HA A 72 TRP HB2 1.0 . 5.5 1191 1191 A 86 GLY HA3 A 69 PHE HD1 1.0 . 5.5 1192 1192 A 103 VAL HG2% A 84 ARG HB2 1.0 . 5.5 1193 1193 A 53 VAL HG2% A 28 PRO HD3 1.0 . 5.5 1194 1194 A 28 PRO HA A 53 VAL HG1% 1.0 . 5.5 1195 1195 A 53 VAL HG2% A 28 PRO HB2 1.0 . 5.5 1196 1196 A 33 CYS HA A 28 PRO HG3 1.0 . 5.5 1197 1197 A 72 TRP HB2 A 72 TRP HD1 1.0 . 5.5 1198 1198 A 72 TRP HE3 A 72 TRP HB2 1.0 . 5.5 1199 1199 A 97 CYS HB2 A 96 GLU HA 1.0 . 5.5 1200 1200 A 88 LEU HD1% A 88 LEU HG 1.0 . 5.5 1201 1201 A 82 ARG HA A 82 ARG HG2 1.0 . 5.5 1202 1202 A 82 ARG HG2 A 75 CYS HA 1.0 . 5.5 1203 1203 A 53 VAL HA A 54 PRO HD3 1.0 . 3.4 1204 1204 A 67 TYR HA A 68 LYS HB2 1.0 . 5.5 1205 1205 A 103 VAL HG2% A 84 ARG HB3 1.0 . 5.5 1206 1206 A 81 THR HG2% A 106 PRO HB3 1.0 . 5.5 1207 1207 A 82 ARG HD2 A 82 ARG HB2 1.0 . 5.5 1208 1208 A 105 LYS HB3 A 105 LYS HE2 1.0 . 5.5 1209 1209 A 105 LYS HD3 A 105 LYS HG2 1.0 . 5.5 1210 1210 A 105 LYS HD2 A 105 LYS HG2 1.0 . 5.5 1211 1211 A 105 LYS HG2 A 105 LYS HB2 1.0 . 5.5 1212 1212 A 107 CYS HB2 A 107 CYS HA 1.0 . 5.5 1213 1213 A 53 VAL H A 34 GLY H 1.0 . 1.8 1214 1214 A 40 ALA H A 47 LYS H 1.0 . 1.8 1215 1215 A 37 ILE H A 29 ASN H 1.0 . 1.8 1216 1216 A 29 ASN H A 30 SER H 1.0 . 1.8 1217 1217 A 49 THR H A 38 ARG H 1.0 . 1.8 1218 1218 A 40 ALA H A 47 LYS H 1.0 . 1.8 1219 1219 A 100 THR H A 99 THR H 1.0 . 1.8 1220 1220 A 42 CYS H A 41 THR H 1.0 . 1.8 1221 1221 A 41 THR H A 22 GLN H 1.0 . 1.8 1222 1222 A 101 ILE H A 86 GLY H 1.0 . 1.8 1223 1223 A 90 LYS H A 89 LYS H 1.0 . 1.8 1224 1224 A 45 GLN H A 44 GLU H 1.0 . 1.8 1225 1225 A 49 THR H A 38 ARG H 1.0 . 1.8 1226 1226 A 51 CYS H A 36 GLY H 1.0 . 1.8 1227 1227 A 41 THR H A 24 GLY H 1.0 . 1.8 1228 1228 A 24 GLY H A 25 LYS H 1.0 . 1.8 1229 1229 A 53 VAL H A 36 GLY H 1.0 . 1.8 1230 1230 A 81 THR H A 80 GLY H 1.0 . 1.8 1231 1231 A 53 VAL H A 34 GLY H 1.0 . 1.8 1232 1232 A 87 THR H A 68 LYS H 1.0 . 1.8 1233 1233 A 37 ILE H A 27 VAL H 1.0 . 1.8 1234 1234 A 53 VAL H A 36 GLY H 1.0 . 1.8 1235 1235 A 77 THR H A 78 THR H 1.0 . 1.8 1236 1236 A 80 GLY H A 78 THR H 1.0 . 1.8 1237 1237 A 29 ASN H A 30 SER H 1.0 . 1.8 1238 1238 A 33 CYS H A 32 ASP H 1.0 . 1.8 1239 1239 A 63 ALA H A 62 GLY H 1.0 . 1.8 1240 1240 A 62 GLY H A 61 PHE H 1.0 . 1.8 1241 1241 A 87 THR H A 68 LYS H 1.0 . 1.8 1242 1242 A 101 ILE H A 86 GLY H 1.0 . 1.8 1243 1243 A 63 ALA H A 64 ASP H 1.0 . 1.8 1244 1244 A 63 ALA H A 62 GLY H 1.0 . 1.8 1245 1245 A 63 ALA H A 64 ASP H 1.0 . 1.8 1246 1246 A 64 ASP H A 65 CYS H 1.0 . 1.8 1247 1247 A 45 GLN H A 44 GLU H 1.0 . 1.8 1248 1248 A 51 CYS H A 36 GLY H 1.0 . 1.8 1249 1249 A 38 ARG H A 51 CYS H 1.0 . 1.8 1250 1250 A 62 GLY H A 61 PHE H 1.0 . 1.8 1251 1251 A 33 CYS H A 32 ASP H 1.0 . 1.8 1252 1252 A 37 ILE H A 27 VAL H 1.0 . 1.8 1253 1253 A 94 ASN H A 95 ALA H 1.0 . 1.8 1254 1254 A 90 LYS H A 89 LYS H 1.0 . 1.8 1255 1255 A 64 ASP H A 65 CYS H 1.0 . 1.8 1256 1256 A 90 LYS H A 91 ALA H 1.0 . 1.8 1257 1257 A 100 THR H A 99 THR H 1.0 . 1.8 1258 1258 A 78 THR H A 79 THR H 1.0 . 1.8 1259 1259 A 80 GLY H A 79 THR H 1.0 . 1.8 1260 1260 A 78 THR H A 79 THR H 1.0 . 1.8 1261 1261 A 80 GLY H A 79 THR H 1.0 . 1.8 1262 1262 A 105 LYS H A 82 ARG H 1.0 . 1.8 1263 1263 A 84 ARG H A 103 VAL H 1.0 . 1.8 1264 1264 A 53 VAL H A 34 GLY H 1.0 . 5.5 1265 1265 A 40 ALA H A 47 LYS H 1.0 . 5.5 1266 1266 A 37 ILE H A 29 ASN H 1.0 . 5.5 1267 1267 A 29 ASN H A 30 SER H 1.0 . 5.5 1268 1268 A 49 THR H A 38 ARG H 1.0 . 5.5 1269 1269 A 40 ALA H A 47 LYS H 1.0 . 5.5 1270 1270 A 100 THR H A 99 THR H 1.0 . 5.5 1271 1271 A 42 CYS H A 41 THR H 1.0 . 5.5 1272 1272 A 41 THR H A 22 GLN H 1.0 . 5.5 1273 1273 A 101 ILE H A 86 GLY H 1.0 . 5.5 1274 1274 A 90 LYS H A 89 LYS H 1.0 . 5.5 1275 1275 A 45 GLN H A 44 GLU H 1.0 . 5.5 1276 1276 A 49 THR H A 38 ARG H 1.0 . 5.5 1277 1277 A 51 CYS H A 36 GLY H 1.0 . 5.5 1278 1278 A 41 THR H A 24 GLY H 1.0 . 5.5 1279 1279 A 24 GLY H A 25 LYS H 1.0 . 5.5 1280 1280 A 53 VAL H A 36 GLY H 1.0 . 5.5 1281 1281 A 81 THR H A 80 GLY H 1.0 . 5.5 1282 1282 A 53 VAL H A 34 GLY H 1.0 . 5.5 1283 1283 A 87 THR H A 68 LYS H 1.0 . 5.5 1284 1284 A 37 ILE H A 27 VAL H 1.0 . 5.5 1285 1285 A 53 VAL H A 36 GLY H 1.0 . 5.5 1286 1286 A 77 THR H A 78 THR H 1.0 . 5.5 1287 1287 A 80 GLY H A 78 THR H 1.0 . 5.5 1288 1288 A 29 ASN H A 30 SER H 1.0 . 5.5 1289 1289 A 33 CYS H A 32 ASP H 1.0 . 3.4 1290 1290 A 63 ALA H A 62 GLY H 1.0 . 5.5 1291 1291 A 62 GLY H A 61 PHE H 1.0 . 5.5 1292 1292 A 87 THR H A 68 LYS H 1.0 . 5.5 1293 1293 A 101 ILE H A 86 GLY H 1.0 . 5.5 1294 1294 A 63 ALA H A 64 ASP H 1.0 . 5.5 1295 1295 A 63 ALA H A 62 GLY H 1.0 . 5.5 1296 1296 A 63 ALA H A 64 ASP H 1.0 . 5.5 1297 1297 A 64 ASP H A 65 CYS H 1.0 . 5.5 1298 1298 A 45 GLN H A 44 GLU H 1.0 . 5.5 1299 1299 A 51 CYS H A 36 GLY H 1.0 . 5.5 1300 1300 A 38 ARG H A 51 CYS H 1.0 . 5.5 1301 1301 A 62 GLY H A 61 PHE H 1.0 . 5.5 1302 1302 A 33 CYS H A 32 ASP H 1.0 . 5.5 1303 1303 A 37 ILE H A 27 VAL H 1.0 . 5.5 1304 1304 A 94 ASN H A 95 ALA H 1.0 . 5.5 1305 1305 A 90 LYS H A 89 LYS H 1.0 . 5.5 1306 1306 A 64 ASP H A 65 CYS H 1.0 . 5.5 1307 1307 A 90 LYS H A 91 ALA H 1.0 . 5.5 1308 1308 A 100 THR H A 99 THR H 1.0 . 5.5 1309 1309 A 78 THR H A 79 THR H 1.0 . 5.5 1310 1310 A 80 GLY H A 79 THR H 1.0 . 3.4 1311 1311 A 78 THR H A 79 THR H 1.0 . 5.5 1312 1312 A 80 GLY H A 79 THR H 1.0 . 5.5 1313 1313 A 105 LYS H A 82 ARG H 1.0 . 5.5 1314 1314 A 84 ARG H A 103 VAL H 1.0 . 3.4 1315 1315 A 57 TRP HH2 A 57 TRP HZ2 1.0 . 1.8 1316 1316 A 57 TRP HH2 A 57 TRP HZ3 1.0 . 1.8 1317 1317 A 72 TRP HZ3 A 83 SER HA 1.0 . 1.8 1318 1318 A 23 TYR HD1 A 21 TRP HE3 1.0 . 1.8 1319 1319 A 23 TYR HD1 A 23 TYR HE1 1.0 . 1.8 1320 1320 A 21 TRP HE3 A 21 TRP HH2 1.0 . 1.8 1321 1321 A 23 TYR HD1 A 23 TYR HE1 1.0 . 1.8 1322 1322 A 21 TRP HE3 A 23 TYR HE1 1.0 . 1.8 1323 1323 A 67 TYR HE1 A 67 TYR HD1 1.0 . 1.8 1324 1324 A 67 TYR HE1 A 67 TYR HD1 1.0 . 1.8 1325 1325 A 67 TYR HE1 A 67 TYR HD1 1.0 . 1.8 1326 1326 A 104 SER HA A 72 TRP HZ3 1.0 . 1.8 1327 1327 A 41 THR HA A 21 TRP HZ3 1.0 . 1.8 1328 1328 A 23 TYR HD1 A 40 ALA HA 1.0 . 1.8 1329 1329 A 69 PHE HA A 69 PHE HD1 1.0 . 1.8 1330 1330 A 23 TYR HD1 A 23 TYR HA 1.0 . 1.8 1331 1331 A 61 PHE HA A 61 PHE HD1 1.0 . 1.8 1332 1332 A 57 TRP HA A 57 TRP HD1 1.0 . 1.8 1333 1333 A 57 TRP HA A 57 TRP HE3 1.0 . 1.8 1334 1334 A 19 SER HA A 21 TRP HD1 1.0 . 1.8 1335 1335 A 20 GLU HA A 21 TRP HD1 1.0 . 1.8 1336 1336 A 72 TRP HA A 72 TRP HE3 1.0 . 1.8 1337 1337 A 93 PHE HA A 93 PHE HD1 1.0 . 1.8 1338 1338 A 83 SER HB2 A 83 SER HA 1.0 . 1.8 1339 1339 A 104 SER HA A 104 SER HB2 1.0 . 1.8 1340 1340 A 57 TRP HB2 A 57 TRP HD1 1.0 . 1.8 1341 1341 A 57 TRP HB2 A 57 TRP HE3 1.0 . 1.8 1342 1342 A 61 PHE HB2 A 61 PHE HD1 1.0 . 1.8 1343 1343 A 61 PHE HB2 A 61 PHE HD1 1.0 . 1.8 1344 1344 A 93 PHE HBy A 93 PHE HD1 1.0 . 1.8 1345 1345 A 72 TRP HB2 A 72 TRP HD1 1.0 . 1.8 1346 1346 A 72 TRP HE3 A 72 TRP HB2 1.0 . 1.8 1347 1347 A 65 CYS HB2 A 67 TYR HE1 1.0 . 1.8 1348 1348 A 23 TYR HD1 A 38 ARG HD2 1.0 . 1.8 1349 1349 A 23 TYR HE1 A 38 ARG HD2 1.0 . 1.8 1350 1350 A 21 TRP HZ2 A 43 ASN HB2 1.0 . 1.8 1351 1351 A 21 TRP HZ2 A 18 CYS HB3 1.0 . 1.8 1352 1352 A 23 TYR HD1 A 23 TYR HBx 1.0 . 1.8 1353 1353 A 23 TYR HE1 A 23 TYR HBx 1.0 . 1.8 1354 1354 A 35 ASN HB2 A 57 TRP HZ2 1.0 . 1.8 1355 1355 A 69 PHE HD1 A 69 PHE HB2 1.0 . 1.8 1356 1356 A 67 TYR HE1 A 65 CYS HB3 1.0 . 1.8 1357 1357 A 18 CYS HB2 A 21 TRP HD1 1.0 . 1.8 1358 1358 A 18 CYS HB2 A 21 TRP HZ2 1.0 . 1.8 1359 1359 A 21 TRP HZ2 A 45 GLN HG2 1.0 . 1.8 1360 1360 A 21 TRP HE3 A 21 TRP HB3 1.0 . 1.8 1361 1361 A 21 TRP HB3 A 21 TRP HD1 1.0 . 1.8 1362 1362 A 45 GLN HB2 A 21 TRP HH2 1.0 . 1.8 1363 1363 A 67 TYR HB2 A 67 TYR HD1 1.0 . 1.8 1364 1364 A 88 LEU HB2 A 67 TYR HE1 1.0 . 1.8 1365 1365 A 67 TYR HB3 A 67 TYR HD1 1.0 . 1.8 1366 1366 A 23 TYR HD1 A 38 ARG HG2 1.0 . 1.8 1367 1367 A 40 ALA HB% A 23 TYR HD1 1.0 . 1.8 1368 1368 A 40 ALA HB% A 21 TRP HE3 1.0 . 1.8 1369 1369 A 40 ALA HB% A 23 TYR HE1 1.0 . 1.8 1370 1370 A 23 TYR HD1 A 49 THR HG2% 1.0 . 1.8 1371 1371 A 23 TYR HE1 A 49 THR HG2% 1.0 . 1.8 1372 1372 A 40 ALA HB% A 21 TRP HH2 1.0 . 1.8 1373 1373 A 103 VAL HG2% A 69 PHE HD1 1.0 . 1.8 1374 1374 A 69 PHE HE1 A 103 VAL HG2% 1.0 . 1.8 1375 1375 A 72 TRP HH2 A 103 VAL HG2% 1.0 . 1.8 1376 1376 A 88 LEU HD1% A 67 TYR HD1 1.0 . 1.8 1377 1377 A 88 LEU HD1% A 67 TYR HE1 1.0 . 1.8 1378 1378 A 67 TYR HE1 A 101 ILE HG2% 1.0 . 1.8 1379 1379 A 69 PHE HZ A 101 ILE HD1% 1.0 . 1.8 1380 1380 A 67 TYR HE1 A 101 ILE HD1% 1.0 . 1.8 1381 1381 A 69 PHE HE1 A 101 ILE HD1% 1.0 . 1.8 1382 1382 A 21 TRP HB2 A 21 TRP HD1 1.0 . 1.8 1383 1383 A 21 TRP HZ2 A 21 TRP HH2 1.0 . 1.8 1384 1384 A 21 TRP HZ3 A 21 TRP HH2 1.0 . 1.8 1385 1385 A 21 TRP HZ3 A 21 TRP HH2 1.0 . 1.8 1386 1386 A 23 TYR HD1 A 22 GLN HA 1.0 . 1.8 1387 1387 A 60 ASP HB2 A 61 PHE HD1 1.0 . 1.8 1388 1388 A 104 SER HA A 83 SER HA 1.0 . 1.8 1389 1389 A 104 SER HA A 83 SER HA 1.0 . 1.8 1390 1390 A 71 ARG HA A 72 TRP HD1 1.0 . 1.8 1391 1391 A 103 VAL HG1% A 69 PHE HE1 1.0 . 1.8 1392 1392 A 83 SER HA A 72 TRP HE3 1.0 . 1.8 1393 1393 A 72 TRP HZ2 A 72 TRP HH2 1.0 . 1.8 1394 1394 A 69 PHE HE1 A 101 ILE HG2% 1.0 . 1.8 1395 1395 A 69 PHE HZ A 103 VAL HG2% 1.0 . 1.8 1396 1396 A 103 VAL HG1% A 69 PHE HZ 1.0 . 1.8 1397 1397 A 101 ILE HD1% A 69 PHE HD1 1.0 . 1.8 1398 1398 A 83 SER HA A 72 TRP HE3 1.0 . 1.8 1399 1399 A 82 ARG HB3 A 72 TRP HE3 1.0 . 1.8 1400 1400 A 82 ARG HG2 A 72 TRP HE3 1.0 . 1.8 1401 1401 A 72 TRP HE3 A 82 ARG HB2 1.0 . 1.8 1402 1402 A 103 VAL HG2% A 72 TRP HE3 1.0 . 1.8 1403 1403 A 103 VAL HG1% A 72 TRP HH2 1.0 . 1.8 1404 1404 A 21 TRP HZ2 A 21 TRP HD1 1.0 . 1.8 1405 1405 A 23 TYR HE1 A 21 TRP HD1 1.0 . 1.8 1406 1406 A 23 TYR HD1 A 38 ARG HB2 1.0 . 1.8 1407 1407 A 40 ALA HB% A 21 TRP HZ3 1.0 . 1.8 1408 1408 A 21 TRP HB2 A 23 TYR HE1 1.0 . 1.8 1409 1409 A 21 TRP HB3 A 23 TYR HE1 1.0 . 1.8 1410 1410 A 103 VAL HG1% A 69 PHE HD1 1.0 . 1.8 1411 1411 A 72 TRP HH2 A 72 TRP HZ3 1.0 . 1.8 1412 1412 A 72 TRP HZ2 A 72 TRP HH2 1.0 . 1.8 1413 1413 A 72 TRP HZ2 A 103 VAL HG2% 1.0 . 1.8 1414 1414 A 84 ARG HB2 A 72 TRP HE3 1.0 . 1.8 1415 1415 A 21 TRP HE3 A 21 TRP HB2 1.0 . 1.8 1416 1416 A 57 TRP HH2 A 57 TRP HZ2 1.0 . 2.8 1417 1417 A 57 TRP HH2 A 57 TRP HZ3 1.0 . 3.4 1418 1418 A 72 TRP HZ3 A 83 SER HA 1.0 . 5.5 1419 1419 A 23 TYR HD1 A 21 TRP HE3 1.0 . 3.4 1420 1420 A 23 TYR HD1 A 23 TYR HE1 1.0 . 2.8 1421 1421 A 21 TRP HE3 A 21 TRP HH2 1.0 . 5.5 1422 1422 A 23 TYR HD1 A 23 TYR HE1 1.0 . 2.8 1423 1423 A 21 TRP HE3 A 23 TYR HE1 1.0 . 5.5 1424 1424 A 67 TYR HE1 A 67 TYR HD1 1.0 . 3.4 1425 1425 A 67 TYR HE1 A 67 TYR HD1 1.0 . 3.4 1426 1426 A 67 TYR HE1 A 67 TYR HD1 1.0 . 3.4 1427 1427 A 104 SER HA A 72 TRP HZ3 1.0 . 5.5 1428 1428 A 41 THR HA A 21 TRP HZ3 1.0 . 5.5 1429 1429 A 23 TYR HD1 A 40 ALA HA 1.0 . 5.5 1430 1430 A 69 PHE HA A 69 PHE HD1 1.0 . 5.5 1431 1431 A 23 TYR HD1 A 23 TYR HA 1.0 . 5.5 1432 1432 A 61 PHE HA A 61 PHE HD1 1.0 . 5.5 1433 1433 A 57 TRP HA A 57 TRP HD1 1.0 . 5.5 1434 1434 A 57 TRP HA A 57 TRP HE3 1.0 . 5.5 1435 1435 A 19 SER HA A 21 TRP HD1 1.0 . 5.5 1436 1436 A 20 GLU HA A 21 TRP HD1 1.0 . 5.5 1437 1437 A 72 TRP HA A 72 TRP HE3 1.0 . 5.5 1438 1438 A 93 PHE HA A 93 PHE HD1 1.0 . 5.5 1439 1439 A 83 SER HB2 A 83 SER HA 1.0 . 5.5 1440 1440 A 104 SER HA A 104 SER HB2 1.0 . 5.5 1441 1441 A 57 TRP HB2 A 57 TRP HD1 1.0 . 5.5 1442 1442 A 57 TRP HB2 A 57 TRP HE3 1.0 . 5.5 1443 1443 A 61 PHE HB2 A 61 PHE HD1 1.0 . 5.5 1444 1444 A 61 PHE HB2 A 61 PHE HD1 1.0 . 5.5 1445 1445 A 93 PHE HBy A 93 PHE HD1 1.0 . 5.5 1446 1446 A 72 TRP HB2 A 72 TRP HD1 1.0 . 5.5 1447 1447 A 72 TRP HE3 A 72 TRP HB2 1.0 . 5.5 1448 1448 A 65 CYS HB2 A 67 TYR HE1 1.0 . 5.5 1449 1449 A 23 TYR HD1 A 38 ARG HD2 1.0 . 5.5 1450 1450 A 23 TYR HE1 A 38 ARG HD2 1.0 . 5.5 1451 1451 A 21 TRP HZ2 A 43 ASN HB2 1.0 . 3.4 1452 1452 A 21 TRP HZ2 A 18 CYS HB3 1.0 . 5.5 1453 1453 A 23 TYR HD1 A 23 TYR HBx 1.0 . 5.5 1454 1454 A 23 TYR HE1 A 23 TYR HBx 1.0 . 5.5 1455 1455 A 35 ASN HB2 A 57 TRP HZ2 1.0 . 5.5 1456 1456 A 69 PHE HD1 A 69 PHE HB2 1.0 . 5.5 1457 1457 A 67 TYR HE1 A 65 CYS HB3 1.0 . 5.5 1458 1458 A 18 CYS HB2 A 21 TRP HD1 1.0 . 5.5 1459 1459 A 18 CYS HB2 A 21 TRP HZ2 1.0 . 5.5 1460 1460 A 21 TRP HZ2 A 45 GLN HG2 1.0 . 5.5 1461 1461 A 21 TRP HE3 A 21 TRP HB3 1.0 . 5.5 1462 1462 A 21 TRP HB3 A 21 TRP HD1 1.0 . 5.5 1463 1463 A 45 GLN HB2 A 21 TRP HH2 1.0 . 5.5 1464 1464 A 67 TYR HB2 A 67 TYR HD1 1.0 . 5.5 1465 1465 A 88 LEU HB2 A 67 TYR HE1 1.0 . 5.5 1466 1466 A 67 TYR HB3 A 67 TYR HD1 1.0 . 5.5 1467 1467 A 23 TYR HD1 A 38 ARG HG2 1.0 . 5.5 1468 1468 A 40 ALA HB% A 23 TYR HD1 1.0 . 5.5 1469 1469 A 40 ALA HB% A 21 TRP HE3 1.0 . 5.5 1470 1470 A 40 ALA HB% A 23 TYR HE1 1.0 . 5.5 1471 1471 A 23 TYR HD1 A 49 THR HG2% 1.0 . 5.5 1472 1472 A 23 TYR HE1 A 49 THR HG2% 1.0 . 5.5 1473 1473 A 40 ALA HB% A 21 TRP HH2 1.0 . 5.5 1474 1474 A 103 VAL HG2% A 69 PHE HD1 1.0 . 5.5 1475 1475 A 69 PHE HE1 A 103 VAL HG2% 1.0 . 5.5 1476 1476 A 72 TRP HH2 A 103 VAL HG2% 1.0 . 5.5 1477 1477 A 88 LEU HD1% A 67 TYR HD1 1.0 . 5.5 1478 1478 A 88 LEU HD1% A 67 TYR HE1 1.0 . 5.5 1479 1479 A 67 TYR HE1 A 101 ILE HG2% 1.0 . 5.5 1480 1480 A 69 PHE HZ A 101 ILE HD1% 1.0 . 5.5 1481 1481 A 67 TYR HE1 A 101 ILE HD1% 1.0 . 5.5 1482 1482 A 69 PHE HE1 A 101 ILE HD1% 1.0 . 5.5 1483 1483 A 21 TRP HB2 A 21 TRP HD1 1.0 . 5.5 1484 1484 A 21 TRP HZ2 A 21 TRP HH2 1.0 . 3.4 1485 1485 A 21 TRP HZ3 A 21 TRP HH2 1.0 . 5.5 1486 1486 A 21 TRP HZ3 A 21 TRP HH2 1.0 . 5.5 1487 1487 A 23 TYR HD1 A 22 GLN HA 1.0 . 5.5 1488 1488 A 60 ASP HB2 A 61 PHE HD1 1.0 . 5.5 1489 1489 A 104 SER HA A 83 SER HA 1.0 . 5.5 1490 1490 A 104 SER HA A 83 SER HA 1.0 . 5.5 1491 1491 A 71 ARG HA A 72 TRP HD1 1.0 . 5.5 1492 1492 A 103 VAL HG1% A 69 PHE HE1 1.0 . 5.5 1493 1493 A 83 SER HA A 72 TRP HE3 1.0 . 5.5 1494 1494 A 72 TRP HZ2 A 72 TRP HH2 1.0 . 5.5 1495 1495 A 69 PHE HE1 A 101 ILE HG2% 1.0 . 5.5 1496 1496 A 69 PHE HZ A 103 VAL HG2% 1.0 . 5.5 1497 1497 A 103 VAL HG1% A 69 PHE HZ 1.0 . 5.5 1498 1498 A 101 ILE HD1% A 69 PHE HD1 1.0 . 5.5 1499 1499 A 83 SER HA A 72 TRP HE3 1.0 . 5.5 1500 1500 A 82 ARG HB3 A 72 TRP HE3 1.0 . 5.5 1501 1501 A 82 ARG HG2 A 72 TRP HE3 1.0 . 5.5 1502 1502 A 72 TRP HE3 A 82 ARG HB2 1.0 . 5.5 1503 1503 A 103 VAL HG2% A 72 TRP HE3 1.0 . 5.5 1504 1504 A 103 VAL HG1% A 72 TRP HH2 1.0 . 5.5 1505 1505 A 21 TRP HZ2 A 21 TRP HD1 1.0 . 5.5 1506 1506 A 23 TYR HE1 A 21 TRP HD1 1.0 . 5.5 1507 1507 A 23 TYR HD1 A 38 ARG HB2 1.0 . 5.5 1508 1508 A 40 ALA HB% A 21 TRP HZ3 1.0 . 5.5 1509 1509 A 21 TRP HB2 A 23 TYR HE1 1.0 . 5.5 1510 1510 A 21 TRP HB3 A 23 TYR HE1 1.0 . 5.5 1511 1511 A 103 VAL HG1% A 69 PHE HD1 1.0 . 5.5 1512 1512 A 72 TRP HH2 A 72 TRP HZ3 1.0 . 5.5 1513 1513 A 72 TRP HZ2 A 72 TRP HH2 1.0 . 5.5 1514 1514 A 72 TRP HZ2 A 103 VAL HG2% 1.0 . 5.5 1515 1515 A 84 ARG HB2 A 72 TRP HE3 1.0 . 5.5 1516 1516 A 21 TRP HE3 A 21 TRP HB2 1.0 . 5.5 1517 1517 A 72 TRP HZ2 A 72 TRP HE1 1.0 . 5.5 1518 1518 A 72 TRP HD1 A 72 TRP HE1 1.0 . 3.4 1519 1519 A 57 TRP HZ2 A 57 TRP HE1 1.0 . 3.4 1520 1520 A 57 TRP HD1 A 57 TRP HE1 1.0 . 3.4 1521 1521 A 21 TRP HZ2 A 21 TRP HE1 1.0 . 3.4 1522 1522 A 18 CYS HB2 A 21 TRP HE1 1.0 . 5.5 1523 1523 A 21 TRP HD1 A 21 TRP HE1 1.0 . 2.8 1524 1524 A 19 SER HA A 21 TRP HE1 1.0 . 5.5 1525 1525 A 53 VAL HG1% A 34 GLY H 1.0 . 5.5 1526 1526 A 33 CYS HB3 A 34 GLY H 1.0 . 5.5 1527 1527 A 33 CYS HB2 A 34 GLY H 1.0 . 5.5 1528 1528 A 34 GLY H A 34 GLY HA3 1.0 . 5.5 1529 1529 A 53 VAL HG2% A 34 GLY H 1.0 . 5.5 1530 1530 A 53 VAL HB A 34 GLY H 1.0 . 5.5 1531 1531 A 33 CYS HA A 34 GLY H 1.0 . 5.5 1532 1532 A 34 GLY H A 34 GLY HA2 1.0 . 5.5 1533 1533 A 43 ASN HA A 43 ASN H 1.0 . 3.4 1534 1534 A 43 ASN HB2 A 43 ASN H 1.0 . 5.5 1535 1535 A 46 THR HG2% A 47 LYS H 1.0 . 5.5 1536 1536 A 47 LYS H A 46 THR HA 1.0 . 2.8 1537 1537 A 47 LYS HB2 A 47 LYS H 1.0 . 5.5 1538 1538 A 47 LYS HA A 47 LYS H 1.0 . 5.5 1539 1539 A 46 THR HB A 47 LYS H 1.0 . 5.5 1540 1540 A 39 GLU HB2 A 39 GLU H 1.0 . 3.4 1541 1541 A 28 PRO HG2 A 29 ASN H 1.0 . 5.5 1542 1542 A 36 GLY HA2 A 29 ASN H 1.0 . 5.5 1543 1543 A 36 GLY HA3 A 29 ASN H 1.0 . 5.5 1544 1544 A 28 PRO HA A 29 ASN H 1.0 . 3.4 1545 1545 A 29 ASN HB3 A 29 ASN H 1.0 . 5.5 1546 1546 A 29 ASN HA A 29 ASN H 1.0 . 5.5 1547 1547 A 28 PRO HB2 A 29 ASN H 1.0 . 5.5 1548 1548 A 69 PHE H A 68 LYS HD2 1.0 . 5.5 1549 1549 A 68 LYS HB2 A 69 PHE H 1.0 . 5.5 1550 1550 A 39 GLU HG2 A 39 GLU H 1.0 . 5.5 1551 1551 A 39 GLU HA A 39 GLU H 1.0 . 5.5 1552 1552 A 38 ARG HB2 A 39 GLU H 1.0 . 5.5 1553 1553 A 38 ARG HA A 39 GLU H 1.0 . 3.4 1554 1554 A 38 ARG HG2 A 39 GLU H 1.0 . 5.5 1555 1555 A 69 PHE H A 68 LYS HG3 1.0 . 5.5 1556 1556 A 69 PHE H A 68 LYS HB3 1.0 . 5.5 1557 1557 A 69 PHE HB2 A 69 PHE H 1.0 . 5.5 1558 1558 A 68 LYS HA A 69 PHE H 1.0 . 5.5 1559 1559 A 38 ARG HG2 A 38 ARG H 1.0 . 5.5 1560 1560 A 38 ARG HD2 A 38 ARG H 1.0 . 5.5 1561 1561 A 37 ILE HB A 38 ARG H 1.0 . 5.5 1562 1562 A 37 ILE HG2% A 38 ARG H 1.0 . 5.5 1563 1563 A 37 ILE HA A 38 ARG H 1.0 . 3.4 1564 1564 A 38 ARG HB2 A 38 ARG H 1.0 . 5.5 1565 1565 A 37 ILE HD1% A 38 ARG H 1.0 . 5.5 1566 1566 A 48 LYS HA A 38 ARG H 1.0 . 5.5 1567 1567 A 38 ARG HA A 38 ARG H 1.0 . 5.5 1568 1568 A 50 LYS HA A 38 ARG H 1.0 . 5.5 1569 1569 A 82 ARG HG2 A 82 ARG H 1.0 . 5.5 1570 1570 A 82 ARG HG3 A 82 ARG H 1.0 . 5.5 1571 1571 A 81 THR HG2% A 82 ARG H 1.0 . 5.5 1572 1572 A 81 THR HA A 82 ARG H 1.0 . 5.5 1573 1573 A 82 ARG HB2 A 82 ARG H 1.0 . 5.5 1574 1574 A 82 ARG HA A 82 ARG H 1.0 . 5.5 1575 1575 A 81 THR HB A 82 ARG H 1.0 . 5.5 1576 1576 A 39 GLU HA A 40 ALA H 1.0 . 2.8 1577 1577 A 40 ALA HA A 40 ALA H 1.0 . 5.5 1578 1578 A 40 ALA HB% A 40 ALA H 1.0 . 5.5 1579 1579 A 41 THR HG2% A 40 ALA H 1.0 . 5.5 1580 1580 A 39 GLU HB2 A 40 ALA H 1.0 . 5.5 1581 1581 A 40 ALA H A 46 THR HA 1.0 . 5.5 1582 1582 A 99 THR HA A 99 THR H 1.0 . 5.5 1583 1583 A 98 GLN HA A 99 THR H 1.0 . 5.5 1584 1584 A 99 THR HB A 99 THR H 1.0 . 5.5 1585 1585 A 41 THR HB A 41 THR H 1.0 . 5.5 1586 1586 A 40 ALA HB% A 41 THR H 1.0 . 5.5 1587 1587 A 41 THR HA A 41 THR H 1.0 . 5.5 1588 1588 A 23 TYR HA A 41 THR H 1.0 . 5.5 1589 1589 A 21 TRP HE3 A 41 THR H 1.0 . 5.5 1590 1590 A 22 GLN HA A 41 THR H 1.0 . 5.5 1591 1591 A 22 GLN HB2 A 41 THR H 1.0 . 5.5 1592 1592 A 40 ALA HA A 41 THR H 1.0 . 3.4 1593 1593 A 81 THR HA A 105 LYS H 1.0 . 5.5 1594 1594 A 99 THR HG2% A 99 THR H 1.0 . 5.5 1595 1595 A 98 GLN HB3 A 99 THR H 1.0 . 5.5 1596 1596 A 41 THR HG2% A 41 THR H 1.0 . 5.5 1597 1597 A 86 GLY HA2 A 86 GLY H 1.0 . 5.5 1598 1598 A 87 THR HG2% A 86 GLY H 1.0 . 5.5 1599 1599 A 85 SER HA A 86 GLY H 1.0 . 3.4 1600 1600 A 104 SER HB2 A 105 LYS H 1.0 . 5.5 1601 1601 A 72 TRP HE3 A 105 LYS H 1.0 . 5.5 1602 1602 A 105 LYS HG2 A 105 LYS H 1.0 . 5.5 1603 1603 A 81 THR HG2% A 105 LYS H 1.0 . 5.5 1604 1604 A 72 TRP HZ3 A 105 LYS H 1.0 . 5.5 1605 1605 A 104 SER HA A 105 LYS H 1.0 . 3.4 1606 1606 A 105 LYS HB2 A 105 LYS H 1.0 . 5.5 1607 1607 A 105 LYS HA A 105 LYS H 1.0 . 5.5 1608 1608 A 81 THR HB A 105 LYS H 1.0 . 5.5 1609 1609 A 86 GLY HA3 A 86 GLY H 1.0 . 5.5 1610 1610 A 85 SER HB2 A 86 GLY H 1.0 . 5.5 1611 1611 A 101 ILE HG2% A 86 GLY H 1.0 . 5.5 1612 1612 A 101 ILE HD1% A 86 GLY H 1.0 . 5.5 1613 1613 A 102 LYS HA A 86 GLY H 1.0 . 5.5 1614 1614 A 89 LYS H A 89 LYS HB2 1.0 . 5.5 1615 1615 A 89 LYS H A 89 LYS HG2 1.0 . 5.5 1616 1616 A 88 LEU HD1% A 89 LYS H 1.0 . 5.5 1617 1617 A 88 LEU HA A 89 LYS H 1.0 . 5.5 1618 1618 A 89 LYS HA A 89 LYS H 1.0 . 5.5 1619 1619 A 34 GLY HA2 A 35 ASN H 1.0 . 5.5 1620 1620 A 35 ASN HB2 A 35 ASN H 1.0 . 5.5 1621 1621 A 35 ASN HA A 35 ASN H 1.0 . 5.5 1622 1622 A 34 GLY HA3 A 35 ASN H 1.0 . 5.5 1623 1623 A 41 THR HG2% A 44 GLU H 1.0 . 5.5 1624 1624 A 44 GLU HB2 A 44 GLU H 1.0 . 5.5 1625 1625 A 85 SER HB2 A 85 SER H 1.0 . 5.5 1626 1626 A 85 SER HA A 85 SER H 1.0 . 5.5 1627 1627 A 23 TYR HD1 A 23 TYR H 1.0 . 5.5 1628 1628 A 23 TYR HA A 23 TYR H 1.0 . 5.5 1629 1629 A 44 GLU HG2 A 44 GLU H 1.0 . 5.5 1630 1630 A 43 ASN HA A 44 GLU H 1.0 . 5.5 1631 1631 A 43 ASN HB2 A 44 GLU H 1.0 . 3.4 1632 1632 A 44 GLU HA A 44 GLU H 1.0 . 5.5 1633 1633 A 84 ARG HB2 A 85 SER H 1.0 . 5.5 1634 1634 A 84 ARG HB3 A 85 SER H 1.0 . 5.5 1635 1635 A 84 ARG HA A 85 SER H 1.0 . 3.4 1636 1636 A 72 TRP HA A 73 ALA H 1.0 . 3.4 1637 1637 A 72 TRP HE3 A 73 ALA H 1.0 . 5.5 1638 1638 A 73 ALA HB% A 73 ALA H 1.0 . 5.5 1639 1639 A 84 ARG HA A 73 ALA H 1.0 . 5.5 1640 1640 A 72 TRP HB2 A 73 ALA H 1.0 . 5.5 1641 1641 A 73 ALA HA A 73 ALA H 1.0 . 5.5 1642 1642 A 23 TYR HBx A 23 TYR H 1.0 . 5.5 1643 1643 A 22 GLN HGx A 23 TYR H 1.0 . 5.5 1644 1644 A 22 GLN HA A 23 TYR H 1.0 . 3.4 1645 1645 A 22 GLN HB2 A 23 TYR H 1.0 . 5.5 1646 1646 A 75 CYS H A 75 CYS HB2 1.0 . 5.5 1647 1647 A 74 GLU HA A 75 CYS H 1.0 . 3.4 1648 1648 A 75 CYS H A 75 CYS HB3 1.0 . 5.5 1649 1649 A 74 GLU HG2 A 75 CYS H 1.0 . 5.5 1650 1650 A 21 TRP HA A 22 GLN H 1.0 . 3.4 1651 1651 A 22 GLN HGx A 22 GLN H 1.0 . 5.5 1652 1652 A 22 GLN HA A 22 GLN H 1.0 . 5.5 1653 1653 A 21 TRP HB2 A 22 GLN H 1.0 . 5.5 1654 1654 A 22 GLN HB2 A 22 GLN H 1.0 . 5.5 1655 1655 A 21 TRP HB3 A 22 GLN H 1.0 . 5.5 1656 1656 A 49 THR HA A 49 THR H 1.0 . 5.5 1657 1657 A 97 CYS HB2 A 98 GLN H 1.0 . 5.5 1658 1658 A 98 GLN HG2 A 98 GLN H 1.0 . 5.5 1659 1659 A 98 GLN HA A 98 GLN H 1.0 . 5.5 1660 1660 A 97 CYS HA A 98 GLN H 1.0 . 3.4 1661 1661 A 98 GLN HB2 A 98 GLN H 1.0 . 5.5 1662 1662 A 98 GLN HB3 A 98 GLN H 1.0 . 5.5 1663 1663 A 49 THR HB A 49 THR H 1.0 . 5.5 1664 1664 A 38 ARG HG2 A 49 THR H 1.0 . 5.5 1665 1665 A 49 THR HG2% A 49 THR H 1.0 . 5.5 1666 1666 A 37 ILE HG2% A 49 THR H 1.0 . 5.5 1667 1667 A 37 ILE HA A 49 THR H 1.0 . 5.5 1668 1668 A 47 LYS HB2 A 49 THR H 1.0 . 5.5 1669 1669 A 38 ARG HB2 A 49 THR H 1.0 . 5.5 1670 1670 A 48 LYS HA A 49 THR H 1.0 . 3.4 1671 1671 A 36 GLY HA2 A 36 GLY H 1.0 . 5.5 1672 1672 A 36 GLY HA3 A 36 GLY H 1.0 . 5.5 1673 1673 A 36 GLY H A 35 ASN HBy 1.0 . 5.5 1674 1674 A 35 ASN HB2 A 36 GLY H 1.0 . 5.5 1675 1675 A 36 GLY H A 52 LYS HB2 1.0 . 5.5 1676 1676 A 50 LYS HA A 36 GLY H 1.0 . 5.5 1677 1677 A 35 ASN HA A 36 GLY H 1.0 . 2.8 1678 1678 A 83 SER HA A 84 ARG H 1.0 . 3.4 1679 1679 A 83 SER HB2 A 84 ARG H 1.0 . 5.5 1680 1680 A 103 VAL HG1% A 84 ARG H 1.0 . 5.5 1681 1681 A 37 ILE HD1% A 49 THR H 1.0 . 5.5 1682 1682 A 36 GLY H A 52 LYS HG2 1.0 . 5.5 1683 1683 A 23 TYR HD1 A 24 GLY H 1.0 . 5.5 1684 1684 A 40 ALA HB% A 24 GLY H 1.0 . 5.5 1685 1685 A 24 GLY HA2 A 24 GLY H 1.0 . 5.5 1686 1686 A 24 GLY HA3 A 24 GLY H 1.0 . 5.5 1687 1687 A 23 TYR HBx A 24 GLY H 1.0 . 5.5 1688 1688 A 23 TYR HA A 24 GLY H 1.0 . 3.4 1689 1689 A 40 ALA HA A 24 GLY H 1.0 . 5.5 1690 1690 A 103 VAL HG2% A 84 ARG H 1.0 . 5.5 1691 1691 A 72 TRP HZ3 A 84 ARG H 1.0 . 5.5 1692 1692 A 84 ARG HA A 84 ARG H 1.0 . 5.5 1693 1693 A 72 TRP HE3 A 84 ARG H 1.0 . 5.5 1694 1694 A 99 THR HG2% A 88 LEU H 1.0 . 5.5 1695 1695 A 100 THR HG2% A 88 LEU H 1.0 . 5.5 1696 1696 A 88 LEU HB2 A 88 LEU H 1.0 . 5.5 1697 1697 A 87 THR HA A 88 LEU H 1.0 . 3.4 1698 1698 A 88 LEU HA A 88 LEU H 1.0 . 5.5 1699 1699 A 77 THR HG2% A 77 THR H 1.0 . 5.5 1700 1700 A 76 ASP HA A 77 THR H 1.0 . 3.4 1701 1701 A 77 THR HB A 77 THR H 1.0 . 5.5 1702 1702 A 77 THR HA A 77 THR H 1.0 . 5.5 1703 1703 A 76 ASP HB2 A 77 THR H 1.0 . 5.5 1704 1704 A 79 THR HG2% A 80 GLY H 1.0 . 5.5 1705 1705 A 77 THR HA A 80 GLY H 1.0 . 5.5 1706 1706 A 76 ASP HB2 A 76 ASP H 1.0 . 5.5 1707 1707 A 76 ASP HB3 A 76 ASP H 1.0 . 5.5 1708 1708 A 75 CYS HA A 76 ASP H 1.0 . 3.4 1709 1709 A 82 ARG HA A 76 ASP H 1.0 . 5.5 1710 1710 A 76 ASP HA A 76 ASP H 1.0 . 5.5 1711 1711 A 87 THR HB A 88 LEU H 1.0 . 5.5 1712 1712 A 88 LEU HG A 88 LEU H 1.0 . 5.5 1713 1713 A 88 LEU HD2% A 88 LEU H 1.0 . 5.5 1714 1714 A 88 LEU HD1% A 88 LEU H 1.0 . 5.5 1715 1715 A 67 TYR HE1 A 88 LEU H 1.0 . 5.5 1716 1716 A 99 THR HA A 88 LEU H 1.0 . 5.5 1717 1717 A 66 LYS HA A 67 TYR H 1.0 . 3.4 1718 1718 A 103 VAL H A 102 LYS HG2 1.0 . 5.5 1719 1719 A 67 TYR HB2 A 67 TYR H 1.0 . 5.5 1720 1720 A 67 TYR HB3 A 67 TYR H 1.0 . 5.5 1721 1721 A 66 LYS HD2 A 67 TYR H 1.0 . 5.5 1722 1722 A 26 CYS HBx A 26 CYS H 1.0 . 5.5 1723 1723 A 26 CYS H A 25 LYS HA 1.0 . 3.4 1724 1724 A 25 LYS HBx A 26 CYS H 1.0 . 5.5 1725 1725 A 80 GLY HA3 A 80 GLY H 1.0 . 5.5 1726 1726 A 80 GLY HA2 A 80 GLY H 1.0 . 5.5 1727 1727 A 79 THR HA A 80 GLY H 1.0 . 5.5 1728 1728 A 83 SER HB3 A 103 VAL H 1.0 . 5.5 1729 1729 A 67 TYR HD1 A 67 TYR H 1.0 . 5.5 1730 1730 A 103 VAL HG1% A 103 VAL H 1.0 . 5.5 1731 1731 A 103 VAL HG2% A 103 VAL H 1.0 . 5.5 1732 1732 A 103 VAL HA A 103 VAL H 1.0 . 5.5 1733 1733 A 67 TYR HA A 67 TYR H 1.0 . 5.5 1734 1734 A 103 VAL H A 102 LYS HB2 1.0 . 5.5 1735 1735 A 103 VAL HB A 103 VAL H 1.0 . 5.5 1736 1736 A 102 LYS HA A 103 VAL H 1.0 . 3.4 1737 1737 A 53 VAL H A 52 LYS HG2 1.0 . 5.5 1738 1738 A 53 VAL H A 34 GLY HA3 1.0 . 5.5 1739 1739 A 53 VAL HG1% A 53 VAL H 1.0 . 5.5 1740 1740 A 53 VAL HG2% A 53 VAL H 1.0 . 5.5 1741 1741 A 53 VAL H A 52 LYS HB2 1.0 . 5.5 1742 1742 A 53 VAL HB A 53 VAL H 1.0 . 5.5 1743 1743 A 52 LYS HA A 53 VAL H 1.0 . 2.8 1744 1744 A 53 VAL HA A 53 VAL H 1.0 . 5.5 1745 1745 A 33 CYS HA A 53 VAL H 1.0 . 5.5 1746 1746 A 52 LYS HD2 A 53 VAL H 1.0 . 5.5 1747 1747 A 67 TYR HD1 A 68 LYS H 1.0 . 5.5 1748 1748 A 68 LYS HG2 A 68 LYS H 1.0 . 5.5 1749 1749 A 67 TYR HB2 A 68 LYS H 1.0 . 5.5 1750 1750 A 67 TYR HB3 A 68 LYS H 1.0 . 5.5 1751 1751 A 67 TYR HA A 68 LYS H 1.0 . 5.5 1752 1752 A 68 LYS H A 68 LYS HB3 1.0 . 5.5 1753 1753 A 68 LYS HB2 A 68 LYS H 1.0 . 5.5 1754 1754 A 68 LYS HA A 68 LYS H 1.0 . 5.5 1755 1755 A 88 LEU HA A 68 LYS H 1.0 . 5.5 1756 1756 A 51 CYS HBx A 52 LYS H 1.0 . 5.5 1757 1757 A 27 VAL HG1% A 27 VAL H 1.0 . 5.5 1758 1758 A 26 CYS HBx A 27 VAL H 1.0 . 5.5 1759 1759 A 27 VAL HA A 27 VAL H 1.0 . 5.5 1760 1760 A 26 CYS HA A 27 VAL H 1.0 . 3.4 1761 1761 A 38 ARG HB2 A 27 VAL H 1.0 . 5.5 1762 1762 A 27 VAL HB A 27 VAL H 1.0 . 3.4 1763 1763 A 38 ARG HA A 27 VAL H 1.0 . 5.5 1764 1764 A 13 LYS H A 12 PRO HGx 1.0 . 5.5 1765 1765 A 46 THR HB A 46 THR H 1.0 . 3.4 1766 1766 A 46 THR HA A 46 THR H 1.0 . 5.5 1767 1767 A 45 GLN HG2 A 46 THR H 1.0 . 5.5 1768 1768 A 45 GLN HA A 46 THR H 1.0 . 2.8 1769 1769 A 45 GLN HB2 A 46 THR H 1.0 . 5.5 1770 1770 A 78 THR HB A 78 THR H 1.0 . 3.4 1771 1771 A 78 THR HG2% A 78 THR H 1.0 . 5.5 1772 1772 A 78 THR HA A 78 THR H 1.0 . 5.5 1773 1773 A 77 THR HA A 78 THR H 1.0 . 5.5 1774 1774 A 76 ASP HA A 78 THR H 1.0 . 5.5 1775 1775 A 48 LYS HG2 A 48 LYS H 1.0 . 5.5 1776 1776 A 46 THR HG2% A 48 LYS H 1.0 . 5.5 1777 1777 A 47 LYS HB2 A 48 LYS H 1.0 . 5.5 1778 1778 A 48 LYS HB2 A 48 LYS H 1.0 . 5.5 1779 1779 A 48 LYS HA A 48 LYS H 1.0 . 5.5 1780 1780 A 47 LYS HA A 48 LYS H 1.0 . 2.8 1781 1781 A 48 LYS HD2 A 48 LYS H 1.0 . 5.5 1782 1782 A 47 LYS HD2 A 48 LYS H 1.0 . 5.5 1783 1783 A 104 SER HA A 104 SER H 1.0 . 5.5 1784 1784 A 79 THR HA A 78 THR H 1.0 . 5.5 1785 1785 A 103 VAL HA A 104 SER H 1.0 . 3.4 1786 1786 A 104 SER HB2 A 104 SER H 1.0 . 5.5 1787 1787 A 103 VAL HG1% A 104 SER H 1.0 . 5.5 1788 1788 A 103 VAL HG2% A 104 SER H 1.0 . 5.5 1789 1789 A 103 VAL HB A 104 SER H 1.0 . 5.5 1790 1790 A 11 GLU N A 11 GLU HA 1.0 . 5.5 1791 1791 A 11 GLU N A 11 GLU HBx 1.0 . 5.5 1792 1792 A 11 GLU N A 11 GLU HGx 1.0 . 5.5 1793 1793 A 31 GLY H A 31 GLY HA2 1.0 . 3.4 1794 1794 A 30 SER HA A 31 GLY H 1.0 . 2.8 1795 1795 A 31 GLY H A 31 GLY HA3 1.0 . 3.4 1796 1796 A 30 SER HBx A 31 GLY H 1.0 . 5.5 1797 1797 A 92 LEU HG A 92 LEU H 1.0 . 5.5 1798 1798 A 91 ALA HA A 92 LEU H 1.0 . 5.5 1799 1799 A 92 LEU HB3 A 92 LEU H 1.0 . 5.5 1800 1800 A 92 LEU HD2% A 92 LEU H 1.0 . 5.5 1801 1801 A 91 ALA HB% A 92 LEU H 1.0 . 5.5 1802 1802 A 92 LEU HB2 A 92 LEU H 1.0 . 5.5 1803 1803 A 50 LYS HE2 A 50 LYS H 1.0 . 5.5 1804 1804 A 49 THR HA A 50 LYS H 1.0 . 3.4 1805 1805 A 50 LYS HA A 50 LYS H 1.0 . 5.5 1806 1806 A 49 THR HB A 50 LYS H 1.0 . 5.5 1807 1807 A 49 THR HB A 50 LYS H 1.0 . 3.4 1808 1808 A 50 LYS HG2 A 50 LYS H 1.0 . 5.5 1809 1809 A 49 THR HG2% A 50 LYS H 1.0 . 5.5 1810 1810 A 50 LYS HB2 A 50 LYS H 1.0 . 3.4 1811 1811 A 50 LYS HD2 A 50 LYS H 1.0 . 5.5 1812 1812 A 71 ARG HG2 A 72 TRP H 1.0 . 5.5 1813 1813 A 72 TRP HD1 A 72 TRP H 1.0 . 5.5 1814 1814 A 72 TRP HA A 72 TRP H 1.0 . 5.5 1815 1815 A 71 ARG HA A 72 TRP H 1.0 . 2.8 1816 1816 A 71 ARG HB3 A 72 TRP H 1.0 . 5.5 1817 1817 A 72 TRP HB2 A 72 TRP H 1.0 . 5.5 1818 1818 A 30 SER HBx A 30 SER H 1.0 . 3.4 1819 1819 A 28 PRO HA A 30 SER H 1.0 . 5.5 1820 1820 A 29 ASN HB2 A 30 SER H 1.0 . 5.5 1821 1821 A 30 SER HA A 30 SER H 1.0 . 5.5 1822 1822 A 29 ASN HA A 30 SER H 1.0 . 5.5 1823 1823 A 28 PRO HB2 A 30 SER H 1.0 . 5.5 1824 1824 A 72 TRP HE3 A 72 TRP H 1.0 . 5.5 1825 1825 A 113 LYS N A 113 LYS HG2 1.0 . 5.5 1826 1826 A 8 LYS N A 8 LYS HA 1.0 . 3.4 1827 1827 A 113 LYS N A 113 LYS HB2 1.0 . 3.4 1828 1828 A 113 LYS N A 113 LYS HA 1.0 . 5.5 1829 1829 A 113 LYS N A 112 PRO HB2 1.0 . 5.5 1830 1830 A 113 LYS N A 112 PRO HA 1.0 . 2.8 1831 1831 A 118 GLU H A 118 GLU HB2 1.0 . 5.5 1832 1832 A 93 PHE HB2 A 62 GLY H 1.0 . 5.5 1833 1833 A 61 PHE HB2 A 62 GLY H 1.0 . 5.5 1834 1834 A 118 GLU H A 117 GLY HA2 1.0 . 5.5 1835 1835 A 71 ARG HA A 71 ARG H 1.0 . 5.5 1836 1836 A 71 ARG HG2 A 71 ARG H 1.0 . 5.5 1837 1837 A 70 GLY HA3 A 71 ARG H 1.0 . 5.5 1838 1838 A 71 ARG HD2 A 71 ARG H 1.0 . 5.5 1839 1839 A 71 ARG HB2 A 71 ARG H 1.0 . 5.5 1840 1840 A 62 GLY H A 62 GLY HA2 1.0 . 3.4 1841 1841 A 61 PHE HA A 62 GLY H 1.0 . 5.5 1842 1842 A 14 ALA H A 13 LYS HGx 1.0 . 5.5 1843 1843 A 14 ALA HB% A 14 ALA H 1.0 . 5.5 1844 1844 A 13 LYS HA A 14 ALA H 1.0 . 3.4 1845 1845 A 14 ALA H A 13 LYS HBx 1.0 . 5.5 1846 1846 A 14 ALA HA A 14 ALA H 1.0 . 5.5 1847 1847 A 13 LYS H A 12 PRO HGx 1.0 . 5.5 1848 1848 A 13 LYS H A 12 PRO HA 1.0 . 2.8 1849 1849 A 13 LYS H A 13 LYS HBx 1.0 . 3.4 1850 1850 A 32 ASP H A 31 GLY HA2 1.0 . 3.4 1851 1851 A 32 ASP H A 31 GLY HA3 1.0 . 5.5 1852 1852 A 32 ASP HB2 A 32 ASP H 1.0 . 5.5 1853 1853 A 73 ALA HB% A 74 GLU H 1.0 . 5.5 1854 1854 A 74 GLU HG2 A 74 GLU H 1.0 . 3.4 1855 1855 A 74 GLU HA A 74 GLU H 1.0 . 5.5 1856 1856 A 74 GLU HB2 A 74 GLU H 1.0 . 3.4 1857 1857 A 73 ALA HA A 74 GLU H 1.0 . 3.4 1858 1858 A 86 GLY HA2 A 70 GLY H 1.0 . 5.5 1859 1859 A 70 GLY HA2 A 70 GLY H 1.0 . 5.5 1860 1860 A 70 GLY HA3 A 70 GLY H 1.0 . 5.5 1861 1861 A 69 PHE HB2 A 70 GLY H 1.0 . 5.5 1862 1862 A 69 PHE HA A 70 GLY H 1.0 . 3.4 1863 1863 A 86 GLY HA3 A 70 GLY H 1.0 . 5.5 1864 1864 A 90 LYS HG2 A 91 ALA H 1.0 . 5.5 1865 1865 A 91 ALA HB% A 91 ALA H 1.0 . 5.5 1866 1866 A 90 LYS HA A 91 ALA H 1.0 . 2.8 1867 1867 A 90 LYS HB2 A 91 ALA H 1.0 . 5.5 1868 1868 A 90 LYS HD2 A 91 ALA H 1.0 . 5.5 1869 1869 A 91 ALA HA A 91 ALA H 1.0 . 5.5 1870 1870 A 18 CYS HB2 A 18 CYS H 1.0 . 3.4 1871 1871 A 17 GLU HBx A 18 CYS H 1.0 . 5.5 1872 1872 A 17 GLU HGx A 18 CYS H 1.0 . 5.5 1873 1873 A 17 GLU HA A 18 CYS H 1.0 . 2.8 1874 1874 A 25 LYS HGx A 25 LYS H 1.0 . 5.5 1875 1875 A 24 GLY HA2 A 25 LYS H 1.0 . 3.4 1876 1876 A 24 GLY HA3 A 25 LYS H 1.0 . 3.4 1877 1877 A 25 LYS H A 25 LYS HA 1.0 . 5.5 1878 1878 A 25 LYS HBx A 25 LYS H 1.0 . 3.4 1879 1879 A 32 ASP HA A 32 ASP H 1.0 . 5.5 1880 1880 A 87 THR HA A 87 THR H 1.0 . 5.5 1881 1881 A 67 TYR HD1 A 87 THR H 1.0 . 5.5 1882 1882 A 86 GLY HA2 A 87 THR H 1.0 . 5.5 1883 1883 A 86 GLY HA3 A 87 THR H 1.0 . 5.5 1884 1884 A 87 THR HG2% A 87 THR H 1.0 . 5.5 1885 1885 A 67 TYR HB3 A 87 THR H 1.0 . 5.5 1886 1886 A 87 THR HB A 87 THR H 1.0 . 5.5 1887 1887 A 69 PHE HA A 87 THR H 1.0 . 5.5 1888 1888 A 117 GLY H A 116 GLY HA2 1.0 . 5.5 1889 1889 A 90 LYS HE2 A 91 ALA H 1.0 . 5.5 1890 1890 A 15 ASP H A 16 ALA HB% 1.0 . 5.5 1891 1891 A 15 ASP H A 15 ASP HBx 1.0 . 3.4 1892 1892 A 17 GLU HGx A 17 GLU H 1.0 . 3.4 1893 1893 A 15 ASP HA A 15 ASP H 1.0 . 5.5 1894 1894 A 94 ASN HB2 A 94 ASN H 1.0 . 5.5 1895 1895 A 94 ASN HA A 94 ASN H 1.0 . 3.4 1896 1896 A 20 GLU HGx A 21 TRP H 1.0 . 5.5 1897 1897 A 20 GLU HBx A 21 TRP H 1.0 . 5.5 1898 1898 A 17 GLU HA A 17 GLU H 1.0 . 5.5 1899 1899 A 17 GLU H A 16 ALA HA 1.0 . 2.8 1900 1900 A 17 GLU HBx A 17 GLU H 1.0 . 3.4 1901 1901 A 92 LEU HD2% A 93 PHE H 1.0 . 5.5 1902 1902 A 92 LEU HA A 93 PHE H 1.0 . 3.4 1903 1903 A 92 LEU HD1% A 93 PHE H 1.0 . 5.5 1904 1904 A 93 PHE HB2 A 93 PHE H 1.0 . 5.5 1905 1905 A 93 PHE HA A 93 PHE H 1.0 . 3.4 1906 1906 A 21 TRP HD1 A 21 TRP H 1.0 . 5.5 1907 1907 A 21 TRP HA A 21 TRP H 1.0 . 5.5 1908 1908 A 20 GLU HA A 21 TRP H 1.0 . 3.4 1909 1909 A 21 TRP HB2 A 21 TRP H 1.0 . 5.5 1910 1910 A 21 TRP HB3 A 21 TRP H 1.0 . 5.5 1911 1911 A 101 ILE HG12 A 102 LYS H 1.0 . 5.5 1912 1912 A 101 ILE HG13 A 102 LYS H 1.0 . 5.5 1913 1913 A 102 LYS HG2 A 102 LYS H 1.0 . 5.5 1914 1914 A 103 VAL HG1% A 102 LYS H 1.0 . 5.5 1915 1915 A 101 ILE HB A 102 LYS H 1.0 . 5.5 1916 1916 A 101 ILE HG2% A 102 LYS H 1.0 . 5.5 1917 1917 A 101 ILE HA A 102 LYS H 1.0 . 3.4 1918 1918 A 101 ILE HD1% A 102 LYS H 1.0 . 5.5 1919 1919 A 102 LYS HB2 A 102 LYS H 1.0 . 3.4 1920 1920 A 102 LYS HA A 102 LYS H 1.0 . 5.5 1921 1921 A 102 LYS HD2 A 102 LYS H 1.0 . 5.5 1922 1922 A 92 LEU HB3 A 93 PHE H 1.0 . 5.5 1923 1923 A 92 LEU HG A 93 PHE H 1.0 . 5.5 1924 1924 A 93 PHE HD1 A 93 PHE H 1.0 . 5.5 1925 1925 A 92 LEU HB2 A 93 PHE H 1.0 . 5.5 1926 1926 A 101 ILE H A 100 THR HB 1.0 . 5.5 1927 1927 A 100 THR HG2% A 101 ILE H 1.0 . 5.5 1928 1928 A 101 ILE HG2% A 101 ILE H 1.0 . 5.5 1929 1929 A 100 THR HA A 101 ILE H 1.0 . 3.4 1930 1930 A 101 ILE HD1% A 101 ILE H 1.0 . 5.5 1931 1931 A 101 ILE H A 100 THR HB 1.0 . 5.5 1932 1932 A 101 ILE HG12 A 101 ILE H 1.0 . 5.5 1933 1933 A 85 SER HA A 101 ILE H 1.0 . 5.5 1934 1934 A 67 TYR HE1 A 101 ILE H 1.0 . 5.5 1935 1935 A 21 TRP HZ3 A 42 CYS H 1.0 . 5.5 1936 1936 A 63 ALA HA A 63 ALA H 1.0 . 5.5 1937 1937 A 101 ILE HG13 A 101 ILE H 1.0 . 5.5 1938 1938 A 87 THR HA A 101 ILE H 1.0 . 5.5 1939 1939 A 101 ILE HA A 101 ILE H 1.0 . 5.5 1940 1940 A 64 ASP H A 62 GLY HA2 1.0 . 5.5 1941 1941 A 63 ALA HB% A 64 ASP H 1.0 . 5.5 1942 1942 A 64 ASP HA A 64 ASP H 1.0 . 5.5 1943 1943 A 64 ASP HB3 A 64 ASP H 1.0 . 5.5 1944 1944 A 64 ASP HB2 A 64 ASP H 1.0 . 5.5 1945 1945 A 63 ALA HA A 64 ASP H 1.0 . 3.4 1946 1946 A 41 THR HB A 42 CYS H 1.0 . 5.5 1947 1947 A 41 THR HG2% A 42 CYS H 1.0 . 5.5 1948 1948 A 42 CYS HB2 A 42 CYS H 1.0 . 5.5 1949 1949 A 41 THR HA A 42 CYS H 1.0 . 2.8 1950 1950 A 21 TRP HH2 A 42 CYS H 1.0 . 5.5 1951 1951 A 42 CYS HA A 42 CYS H 1.0 . 5.5 1952 1952 A 21 TRP HE3 A 42 CYS H 1.0 . 5.5 1953 1953 A 45 GLN HB2 A 42 CYS H 1.0 . 5.5 1954 1954 A 41 THR HB A 42 CYS H 1.0 . 5.5 1955 1955 A 63 ALA H A 62 GLY HA2 1.0 . 3.4 1956 1956 A 63 ALA HB% A 63 ALA H 1.0 . 5.5 1957 1957 A 42 CYS HB3 A 42 CYS H 1.0 . 5.5 1958 1958 A 60 ASP H A 59 LYS HG2 1.0 . 5.5 1959 1959 A 59 LYS HB2 A 60 ASP H 1.0 . 5.5 1960 1960 A 60 ASP HA A 60 ASP H 1.0 . 5.5 1961 1961 A 60 ASP H A 59 LYS HD2 1.0 . 5.5 1962 1962 A 60 ASP HB2 A 60 ASP H 1.0 . 5.5 1963 1963 A 59 LYS HA A 60 ASP H 1.0 . 3.4 1964 1964 A 108 THR HB A 108 THR H 1.0 . 5.5 1965 1965 A 108 THR HA A 108 THR H 1.0 . 5.5 1966 1966 A 65 CYS HB3 A 66 LYS H 1.0 . 5.5 1967 1967 A 41 THR HG2% A 45 GLN H 1.0 . 5.5 1968 1968 A 43 ASN HB2 A 45 GLN H 1.0 . 5.5 1969 1969 A 44 GLU HG2 A 45 GLN H 1.0 . 5.5 1970 1970 A 45 GLN HG2 A 45 GLN H 1.0 . 3.4 1971 1971 A 45 GLN HB2 A 45 GLN H 1.0 . 5.5 1972 1972 A 44 GLU HB2 A 45 GLN H 1.0 . 5.5 1973 1973 A 41 THR HB A 45 GLN H 1.0 . 5.5 1974 1974 A 41 THR HA A 45 GLN H 1.0 . 5.5 1975 1975 A 50 LYS HG2 A 51 CYS H 1.0 . 5.5 1976 1976 A 37 ILE HA A 51 CYS H 1.0 . 5.5 1977 1977 A 50 LYS HA A 51 CYS H 1.0 . 2.8 1978 1978 A 37 ILE HD1% A 51 CYS H 1.0 . 5.5 1979 1979 A 51 CYS HA A 51 CYS H 1.0 . 5.5 1980 1980 A 50 LYS HB2 A 51 CYS H 1.0 . 5.5 1981 1981 A 66 LYS H A 66 LYS HG2 1.0 . 5.5 1982 1982 A 88 LEU HD1% A 66 LYS H 1.0 . 5.5 1983 1983 A 66 LYS H A 66 LYS HB2 1.0 . 5.5 1984 1984 A 65 CYS HA A 66 LYS H 1.0 . 3.4 1985 1985 A 91 ALA HA A 66 LYS H 1.0 . 5.5 1986 1986 A 66 LYS HD2 A 66 LYS H 1.0 . 5.5 1987 1987 A 107 CYS HB2 A 107 CYS H 1.0 . 5.5 1988 1988 A 81 THR HG2% A 107 CYS H 1.0 . 5.5 1989 1989 A 106 PRO HA A 107 CYS H 1.0 . 3.4 1990 1990 A 81 THR HA A 107 CYS H 1.0 . 5.5 1991 1991 A 106 PRO HB2 A 107 CYS H 1.0 . 5.5 1992 1992 A 16 ALA HB% A 16 ALA H 1.0 . 5.5 1993 1993 A 15 ASP HBx A 16 ALA H 1.0 . 5.5 1994 1994 A 15 ASP HA A 16 ALA H 1.0 . 3.4 1995 1995 A 16 ALA HA A 16 ALA H 1.0 . 5.5 1996 1996 A 54 PRO HA A 55 CYS H 1.0 . 5.5 1997 1997 A 61 PHE HD1 A 61 PHE H 1.0 . 5.5 1998 1998 A 61 PHE HB2 A 61 PHE H 1.0 . 5.5 1999 1999 A 60 ASP HA A 61 PHE H 1.0 . 3.4 2000 2000 A 60 ASP HB2 A 61 PHE H 1.0 . 5.5 2001 2001 A 61 PHE HA A 61 PHE H 1.0 . 5.5 2002 2002 A 59 LYS HA A 59 LYS H 1.0 . 3.4 2003 2003 A 59 LYS HB2 A 59 LYS H 1.0 . 3.4 2004 2004 A 59 LYS HD2 A 59 LYS H 1.0 . 5.5 2005 2005 A 59 LYS HG2 A 59 LYS H 1.0 . 5.5 2006 2006 A 88 LEU HG A 97 CYS H 1.0 . 5.5 2007 2007 A 97 CYS HB2 A 97 CYS H 1.0 . 5.5 2008 2008 A 91 ALA HB% A 97 CYS H 1.0 . 5.5 2009 2009 A 96 GLU HG2 A 97 CYS H 1.0 . 5.5 2010 2010 A 96 GLU HA A 97 CYS H 1.0 . 2.8 2011 2011 A 97 CYS HA A 97 CYS H 1.0 . 5.5 2012 2012 A 97 CYS H A 96 GLU HB2 1.0 . 5.5 2013 2013 A 97 CYS HB3 A 97 CYS H 1.0 . 5.5 2014 2014 A 33 CYS HB2 A 33 CYS H 1.0 . 5.5 2015 2015 A 57 TRP HD1 A 57 TRP H 1.0 . 5.5 2016 2016 A 56 ASN HB2 A 57 TRP H 1.0 . 5.5 2017 2017 A 57 TRP HA A 57 TRP H 1.0 . 5.5 2018 2018 A 56 ASN HA A 57 TRP H 1.0 . 5.5 2019 2019 A 57 TRP HB2 A 57 TRP H 1.0 . 5.5 2020 2020 A 28 PRO HG3 A 33 CYS H 1.0 . 5.5 2021 2021 A 33 CYS HB3 A 33 CYS H 1.0 . 5.5 2022 2022 A 33 CYS H A 31 GLY HA2 1.0 . 5.5 2023 2023 A 33 CYS H A 31 GLY HA3 1.0 . 5.5 2024 2024 A 53 VAL HG2% A 33 CYS H 1.0 . 5.5 2025 2025 A 32 ASP HB2 A 33 CYS H 1.0 . 5.5 2026 2026 A 33 CYS HA A 33 CYS H 1.0 . 5.5 2027 2027 A 28 PRO HB2 A 33 CYS H 1.0 . 5.5 2028 2028 A 32 ASP HA A 33 CYS H 1.0 . 5.5 2029 2029 A 28 PRO HG2 A 33 CYS H 1.0 . 5.5 2030 2030 A 58 LYS HD2 A 58 LYS H 1.0 . 5.5 2031 2031 A 26 CYS HA A 37 ILE H 1.0 . 5.5 2032 2032 A 37 ILE HG12 A 37 ILE H 1.0 . 5.5 2033 2033 A 36 GLY HA2 A 37 ILE H 1.0 . 5.5 2034 2034 A 36 GLY HA3 A 37 ILE H 1.0 . 3.4 2035 2035 A 27 VAL HG2% A 37 ILE H 1.0 . 5.5 2036 2036 A 37 ILE HB A 37 ILE H 1.0 . 3.4 2037 2037 A 28 PRO HA A 37 ILE H 1.0 . 5.5 2038 2038 A 37 ILE HA A 37 ILE H 1.0 . 5.5 2039 2039 A 37 ILE HD1% A 37 ILE H 1.0 . 5.5 2040 2040 A 57 TRP HA A 58 LYS H 1.0 . 5.5 2041 2041 A 58 LYS HB2 A 58 LYS H 1.0 . 5.5 2042 2042 A 57 TRP HB2 A 58 LYS H 1.0 . 5.5 2043 2043 A 58 LYS HG2 A 58 LYS H 1.0 . 5.5 2044 2044 A 58 LYS HA A 58 LYS H 1.0 . 5.5 2045 2045 A 37 ILE HG2% A 37 ILE H 1.0 . 5.5 2046 2046 A 27 VAL HB A 37 ILE H 1.0 . 5.5 2047 2047 A 95 ALA HA A 95 ALA H 1.0 . 5.5 2048 2048 A 95 ALA HB% A 95 ALA H 1.0 . 5.5 2049 2049 A 94 ASN HB2 A 95 ALA H 1.0 . 5.5 2050 2050 A 94 ASN HA A 95 ALA H 1.0 . 5.5 2051 2051 A 83 SER HB2 A 83 SER H 1.0 . 5.5 2052 2052 A 73 ALA HB% A 83 SER H 1.0 . 5.5 2053 2053 A 83 SER HA A 83 SER H 1.0 . 5.5 2054 2054 A 82 ARG HA A 83 SER H 1.0 . 3.4 2055 2055 A 82 ARG HB3 A 83 SER H 1.0 . 5.5 2056 2056 A 98 GLN HG2 A 98 GLN HE22 1.0 . 5.5 2057 2057 A 65 CYS HB2 A 65 CYS H 1.0 . 5.5 2058 2058 A 65 CYS HB3 A 65 CYS H 1.0 . 5.5 2059 2059 A 63 ALA HB% A 65 CYS H 1.0 . 5.5 2060 2060 A 64 ASP HA A 65 CYS H 1.0 . 5.5 2061 2061 A 101 ILE HG2% A 100 THR H 1.0 . 5.5 2062 2062 A 87 THR HA A 100 THR H 1.0 . 5.5 2063 2063 A 35 ASN HB2 A 35 ASN HD21 1.0 . 5.5 2064 2064 A 90 LYS HG2 A 90 LYS H 1.0 . 5.5 2065 2065 A 88 LEU HD1% A 90 LYS H 1.0 . 5.5 2066 2066 A 90 LYS HB2 A 90 LYS H 1.0 . 5.5 2067 2067 A 89 LYS HA A 90 LYS H 1.0 . 5.5 2068 2068 A 90 LYS HD2 A 90 LYS H 1.0 . 5.5 2069 2069 A 99 THR HG2% A 100 THR H 1.0 . 5.5 2070 2070 A 98 GLN HA A 98 GLN HE21 1.0 . 5.5 2071 2071 A 98 GLN HB2 A 98 GLN HE21 1.0 . 5.5 2072 2072 A 100 THR H A 100 THR HB 1.0 . 3.4 2073 2073 A 99 THR HB A 100 THR H 1.0 . 5.5 2074 2074 A 99 THR HA A 100 THR H 1.0 . 5.5 2075 2075 A 100 THR HG2% A 100 THR H 1.0 . 5.5 2076 2076 A 100 THR HA A 100 THR H 1.0 . 5.5 2077 2077 A 98 GLN HG2 A 98 GLN HE21 1.0 . 5.5 2078 2078 A 98 GLN HB3 A 98 GLN HE21 1.0 . 5.5 2079 2079 A 100 THR H A 100 THR HB 1.0 . 5.5 2080 2080 A 21 TRP HZ2 A 45 GLN HE21 1.0 . 5.5 2081 2081 A 56 ASN HB2 A 56 ASN HD21 1.0 . 5.5 2082 2082 A 45 GLN HG2 A 45 GLN HE21 1.0 . 5.5 2083 2083 A 45 GLN HB2 A 45 GLN HE21 1.0 . 5.5 2084 2084 A 94 ASN HB2 A 94 ASN HD21 1.0 . 3.4 2085 2085 A 94 ASN HA A 94 ASN HD21 1.0 . 5.5 2086 2086 A 18 CYS HB2 A 20 GLU H 1.0 . 5.5 2087 2087 A 19 SER HA A 20 GLU H 1.0 . 5.5 2088 2088 A 20 GLU HA A 20 GLU H 1.0 . 5.5 2089 2089 A 20 GLU HBx A 20 GLU H 1.0 . 5.5 2090 2090 A 79 THR HB A 79 THR H 1.0 . 5.5 2091 2091 A 80 GLY HA3 A 79 THR H 1.0 . 5.5 2092 2092 A 78 THR HB A 79 THR H 1.0 . 5.5 2093 2093 A 20 GLU HGx A 20 GLU H 1.0 . 5.5 2094 2094 A 18 CYS HA A 20 GLU H 1.0 . 5.5 2095 2095 A 19 SER HBx A 20 GLU H 1.0 . 5.5 2096 2096 A 18 CYS HB3 A 43 ASN HD21 1.0 . 5.5 2097 2097 A 78 THR HA A 79 THR H 1.0 . 5.5 2098 2098 A 79 THR HG2% A 79 THR H 1.0 . 5.5 2099 2099 A 79 THR HA A 79 THR H 1.0 . 5.5 2100 2100 A 18 CYS HB2 A 43 ASN HD21 1.0 . 5.5 2101 2101 A 80 GLY HA2 A 81 THR H 1.0 . 5.5 2102 2102 A 80 GLY HA3 A 81 THR H 1.0 . 5.5 2103 2103 A 76 ASP HB3 A 81 THR H 1.0 . 5.5 2104 2104 A 81 THR HG2% A 81 THR H 1.0 . 5.5 2105 2105 A 76 ASP HB2 A 81 THR H 1.0 . 5.5 2106 2106 A 81 THR HA A 81 THR H 1.0 . 5.5 2107 2107 A 81 THR HB A 81 THR H 1.0 . 5.5 2108 2108 A 22 GLN HGx A 22 GLN HE21 1.0 . 3.4 2109 2109 A 22 GLN HB3 A 22 GLN HE21 1.0 . 5.5 2110 2110 A 21 TRP HZ2 A 45 GLN HE22 1.0 . 5.5 2111 2111 A 18 CYS HB2 A 45 GLN HE22 1.0 . 5.5 2112 2112 A 45 GLN HG2 A 45 GLN HE22 1.0 . 5.5 2113 2113 A 98 GLN HG2 A 98 GLN HE22 1.0 . 5.5 2114 2114 A 43 ASN HB2 A 43 ASN HD22 1.0 . 5.5 2115 2115 A 94 ASN HB2 A 94 ASN HD22 1.0 . 5.5 2116 2116 A 22 GLN HGx A 22 GLN HE22 1.0 . 5.5 2117 2117 A 92 LEU HA A 92 LEU H 1.0 . 5.5 2118 2118 A 75 CYS HA A 75 CYS H 1.0 . 5.5 2119 2119 A 65 CYS HA A 65 CYS H 1.0 . 5.5 2120 2120 A 42 CYS HA A 43 ASN H 1.0 . 5.5 2121 2121 A 46 THR HG2% A 46 THR H 1.0 . 5.5 2122 2122 A 118 GLU H A 118 GLU HA 1.0 . 5.5 2123 2123 A 66 LYS HA A 66 LYS H 1.0 . 5.5 2124 2124 A 45 GLN HA A 45 GLN H 1.0 . 5.5 2125 2125 A 13 LYS H A 12 PRO HB3 1.0 . 5.5 2126 2126 A 90 LYS H A 89 LYS HB2 1.0 . 5.5 2127 2127 A 18 CYS HA A 18 CYS H 1.0 . 5.5 2128 2128 A 29 ASN HB2 A 29 ASN H 1.0 . 5.5 2129 2129 A 52 LYS HA A 36 GLY H 1.0 . 5.5 2130 2130 A 39 GLU HA A 47 LYS H 1.0 . 5.5 2131 2131 A 44 GLU HA A 45 GLN H 1.0 . 5.5 2132 2132 A 39 GLU HG2 A 47 LYS H 1.0 . 5.5 2133 2133 A 39 GLU HA A 49 THR H 1.0 . 5.5 2134 2134 A 104 SER HA A 84 ARG H 1.0 . 5.5 2135 2135 A 35 ASN HA A 53 VAL H 1.0 . 5.5 2136 2136 A 95 ALA HA A 96 GLU H 1.0 . 5.5 2137 2137 A 96 GLU HB2 A 96 GLU H 1.0 . 5.5 2138 2138 A 67 TYR HA A 89 LYS H 1.0 . 5.5 2139 2139 A 83 SER HA A 105 LYS H 1.0 . 5.5 2140 2140 A 80 GLY HA2 A 79 THR H 1.0 . 5.5 2141 2141 A 90 LYS HA A 90 LYS H 1.0 . 5.5 2142 2142 A 93 PHE HA A 94 ASN H 1.0 . 5.5 2143 2143 A 95 ALA HB% A 96 GLU H 1.0 . 5.5 2144 2144 A 51 CYS HA A 52 LYS H 1.0 . 5.5 2145 2145 A 85 SER HA A 103 VAL H 1.0 . 5.5 2146 2146 A 67 TYR H A 66 LYS HB2 1.0 . 5.5 2147 2147 A 40 ALA HB% A 47 LYS H 1.0 . 5.5 2148 2148 A 104 SER HB3 A 104 SER H 1.0 . 5.5 2149 2149 A 39 GLU HG3 A 39 GLU H 1.0 . 5.5 2150 2150 A 27 VAL HG2% A 27 VAL H 1.0 . 5.5 2151 2151 A 104 SER HB3 A 82 ARG H 1.0 . 5.5 2152 2152 A 22 GLN HGx A 41 THR H 1.0 . 5.5 2153 2153 A 25 LYS HDx A 25 LYS H 1.0 . 5.5 2154 2154 A 26 CYS HA A 26 CYS H 1.0 . 5.5 2155 2155 A 39 GLU HG3 A 40 ALA H 1.0 . 5.5 2156 2156 A 42 CYS HA A 22 GLN H 1.0 . 5.5 2157 2157 A 92 LEU HD1% A 92 LEU H 1.0 . 5.5 2158 2158 A 47 LYS HG2 A 47 LYS H 1.0 . 5.5 2159 2159 A 75 CYS HB2 A 76 ASP H 1.0 . 5.5 2160 2160 A 90 LYS H A 66 LYS HB2 1.0 . 5.5 2161 2161 A 81 THR HG2% A 80 GLY H 1.0 . 5.5 2162 2162 A 106 PRO HB3 A 107 CYS H 1.0 . 5.5 2163 2163 A 107 CYS HA A 107 CYS H 1.0 . 5.5 2164 2164 A 108 THR HG2% A 108 THR H 1.0 . 5.5 2165 2165 A 74 GLU HB2 A 75 CYS H 1.0 . 5.5 2166 2166 A 82 ARG HB2 A 105 LYS H 1.0 . 5.5 2167 2167 A 7 GLU H A 7 GLU HA 1.0 . 3.4 2168 2168 A 7 GLU H A 6 LYS HA 1.0 . 5.5 2169 2169 A 8 LYS HA A 9 GLY H 1.0 . 5.5 2170 2170 A 9 GLY H A 9 GLY HAx 1.0 . 5.5 2171 2171 A 72 TRP HZ2 A 72 TRP HE1 1.0 . 1.8 2172 2172 A 72 TRP HD1 A 72 TRP HE1 1.0 . 1.8 2173 2173 A 57 TRP HZ2 A 57 TRP HE1 1.0 . 1.8 2174 2174 A 57 TRP HD1 A 57 TRP HE1 1.0 . 1.8 2175 2175 A 21 TRP HZ2 A 21 TRP HE1 1.0 . 1.8 2176 2176 A 18 CYS HB2 A 21 TRP HE1 1.0 . 1.8 2177 2177 A 21 TRP HD1 A 21 TRP HE1 1.0 . 1.8 2178 2178 A 19 SER HA A 21 TRP HE1 1.0 . 1.8 2179 2179 A 53 VAL HG1% A 34 GLY H 1.0 . 1.8 2180 2180 A 33 CYS HB3 A 34 GLY H 1.0 . 1.8 2181 2181 A 33 CYS HB2 A 34 GLY H 1.0 . 1.8 2182 2182 A 34 GLY H A 34 GLY HA3 1.0 . 1.8 2183 2183 A 53 VAL HG2% A 34 GLY H 1.0 . 1.8 2184 2184 A 53 VAL HB A 34 GLY H 1.0 . 1.8 2185 2185 A 33 CYS HA A 34 GLY H 1.0 . 1.8 2186 2186 A 34 GLY H A 34 GLY HA2 1.0 . 1.8 2187 2187 A 43 ASN HA A 43 ASN H 1.0 . 1.8 2188 2188 A 43 ASN HB2 A 43 ASN H 1.0 . 1.8 2189 2189 A 46 THR HG2% A 47 LYS H 1.0 . 1.8 2190 2190 A 47 LYS H A 46 THR HA 1.0 . 1.8 2191 2191 A 47 LYS HB2 A 47 LYS H 1.0 . 1.8 2192 2192 A 47 LYS HA A 47 LYS H 1.0 . 1.8 2193 2193 A 46 THR HB A 47 LYS H 1.0 . 1.8 2194 2194 A 39 GLU HB2 A 39 GLU H 1.0 . 1.8 2195 2195 A 28 PRO HG2 A 29 ASN H 1.0 . 1.8 2196 2196 A 36 GLY HA2 A 29 ASN H 1.0 . 1.8 2197 2197 A 36 GLY HA3 A 29 ASN H 1.0 . 1.8 2198 2198 A 28 PRO HA A 29 ASN H 1.0 . 1.8 2199 2199 A 29 ASN HB3 A 29 ASN H 1.0 . 1.8 2200 2200 A 29 ASN HA A 29 ASN H 1.0 . 1.8 2201 2201 A 28 PRO HB2 A 29 ASN H 1.0 . 1.8 2202 2202 A 69 PHE H A 68 LYS HD2 1.0 . 1.8 2203 2203 A 68 LYS HB2 A 69 PHE H 1.0 . 1.8 2204 2204 A 39 GLU HG2 A 39 GLU H 1.0 . 1.8 2205 2205 A 39 GLU HA A 39 GLU H 1.0 . 1.8 2206 2206 A 38 ARG HB2 A 39 GLU H 1.0 . 1.8 2207 2207 A 38 ARG HA A 39 GLU H 1.0 . 1.8 2208 2208 A 38 ARG HG2 A 39 GLU H 1.0 . 1.8 2209 2209 A 69 PHE H A 68 LYS HG3 1.0 . 1.8 2210 2210 A 69 PHE H A 68 LYS HB3 1.0 . 1.8 2211 2211 A 69 PHE HB2 A 69 PHE H 1.0 . 1.8 2212 2212 A 68 LYS HA A 69 PHE H 1.0 . 1.8 2213 2213 A 38 ARG HG2 A 38 ARG H 1.0 . 1.8 2214 2214 A 38 ARG HD2 A 38 ARG H 1.0 . 1.8 2215 2215 A 37 ILE HB A 38 ARG H 1.0 . 1.8 2216 2216 A 37 ILE HG2% A 38 ARG H 1.0 . 1.8 2217 2217 A 37 ILE HA A 38 ARG H 1.0 . 1.8 2218 2218 A 38 ARG HB2 A 38 ARG H 1.0 . 1.8 2219 2219 A 37 ILE HD1% A 38 ARG H 1.0 . 1.8 2220 2220 A 48 LYS HA A 38 ARG H 1.0 . 1.8 2221 2221 A 38 ARG HA A 38 ARG H 1.0 . 1.8 2222 2222 A 50 LYS HA A 38 ARG H 1.0 . 1.8 2223 2223 A 82 ARG HG2 A 82 ARG H 1.0 . 1.8 2224 2224 A 82 ARG HG3 A 82 ARG H 1.0 . 1.8 2225 2225 A 81 THR HG2% A 82 ARG H 1.0 . 1.8 2226 2226 A 81 THR HA A 82 ARG H 1.0 . 1.8 2227 2227 A 82 ARG HB2 A 82 ARG H 1.0 . 1.8 2228 2228 A 82 ARG HA A 82 ARG H 1.0 . 1.8 2229 2229 A 81 THR HB A 82 ARG H 1.0 . 1.8 2230 2230 A 39 GLU HA A 40 ALA H 1.0 . 1.8 2231 2231 A 40 ALA HA A 40 ALA H 1.0 . 1.8 2232 2232 A 40 ALA HB% A 40 ALA H 1.0 . 1.8 2233 2233 A 41 THR HG2% A 40 ALA H 1.0 . 1.8 2234 2234 A 39 GLU HB2 A 40 ALA H 1.0 . 1.8 2235 2235 A 40 ALA H A 46 THR HA 1.0 . 1.8 2236 2236 A 99 THR HA A 99 THR H 1.0 . 1.8 2237 2237 A 98 GLN HA A 99 THR H 1.0 . 1.8 2238 2238 A 99 THR HB A 99 THR H 1.0 . 1.8 2239 2239 A 41 THR HB A 41 THR H 1.0 . 1.8 2240 2240 A 40 ALA HB% A 41 THR H 1.0 . 1.8 2241 2241 A 41 THR HA A 41 THR H 1.0 . 1.8 2242 2242 A 23 TYR HA A 41 THR H 1.0 . 1.8 2243 2243 A 21 TRP HE3 A 41 THR H 1.0 . 1.8 2244 2244 A 22 GLN HA A 41 THR H 1.0 . 1.8 2245 2245 A 22 GLN HB2 A 41 THR H 1.0 . 1.8 2246 2246 A 40 ALA HA A 41 THR H 1.0 . 1.8 2247 2247 A 81 THR HA A 105 LYS H 1.0 . 1.8 2248 2248 A 99 THR HG2% A 99 THR H 1.0 . 1.8 2249 2249 A 98 GLN HB3 A 99 THR H 1.0 . 1.8 2250 2250 A 41 THR HG2% A 41 THR H 1.0 . 1.8 2251 2251 A 86 GLY HA2 A 86 GLY H 1.0 . 1.8 2252 2252 A 87 THR HG2% A 86 GLY H 1.0 . 1.8 2253 2253 A 85 SER HA A 86 GLY H 1.0 . 1.8 2254 2254 A 104 SER HB2 A 105 LYS H 1.0 . 1.8 2255 2255 A 72 TRP HE3 A 105 LYS H 1.0 . 1.8 2256 2256 A 105 LYS HG2 A 105 LYS H 1.0 . 1.8 2257 2257 A 81 THR HG2% A 105 LYS H 1.0 . 1.8 2258 2258 A 72 TRP HZ3 A 105 LYS H 1.0 . 1.8 2259 2259 A 104 SER HA A 105 LYS H 1.0 . 1.8 2260 2260 A 105 LYS HB2 A 105 LYS H 1.0 . 1.8 2261 2261 A 105 LYS HA A 105 LYS H 1.0 . 1.8 2262 2262 A 81 THR HB A 105 LYS H 1.0 . 1.8 2263 2263 A 86 GLY HA3 A 86 GLY H 1.0 . 1.8 2264 2264 A 85 SER HB2 A 86 GLY H 1.0 . 1.8 2265 2265 A 101 ILE HG2% A 86 GLY H 1.0 . 1.8 2266 2266 A 101 ILE HD1% A 86 GLY H 1.0 . 1.8 2267 2267 A 102 LYS HA A 86 GLY H 1.0 . 1.8 2268 2268 A 89 LYS H A 89 LYS HB2 1.0 . 1.8 2269 2269 A 89 LYS H A 89 LYS HG2 1.0 . 1.8 2270 2270 A 88 LEU HD1% A 89 LYS H 1.0 . 1.8 2271 2271 A 88 LEU HA A 89 LYS H 1.0 . 1.8 2272 2272 A 89 LYS HA A 89 LYS H 1.0 . 1.8 2273 2273 A 34 GLY HA2 A 35 ASN H 1.0 . 1.8 2274 2274 A 35 ASN HB2 A 35 ASN H 1.0 . 1.8 2275 2275 A 35 ASN HA A 35 ASN H 1.0 . 1.8 2276 2276 A 34 GLY HA3 A 35 ASN H 1.0 . 1.8 2277 2277 A 41 THR HG2% A 44 GLU H 1.0 . 1.8 2278 2278 A 44 GLU HB2 A 44 GLU H 1.0 . 1.8 2279 2279 A 85 SER HB2 A 85 SER H 1.0 . 1.8 2280 2280 A 85 SER HA A 85 SER H 1.0 . 1.8 2281 2281 A 23 TYR HD1 A 23 TYR H 1.0 . 1.8 2282 2282 A 23 TYR HA A 23 TYR H 1.0 . 1.8 2283 2283 A 44 GLU HG2 A 44 GLU H 1.0 . 1.8 2284 2284 A 43 ASN HA A 44 GLU H 1.0 . 1.8 2285 2285 A 43 ASN HB2 A 44 GLU H 1.0 . 1.8 2286 2286 A 44 GLU HA A 44 GLU H 1.0 . 1.8 2287 2287 A 84 ARG HB2 A 85 SER H 1.0 . 1.8 2288 2288 A 84 ARG HB3 A 85 SER H 1.0 . 1.8 2289 2289 A 84 ARG HA A 85 SER H 1.0 . 1.8 2290 2290 A 72 TRP HA A 73 ALA H 1.0 . 1.8 2291 2291 A 72 TRP HE3 A 73 ALA H 1.0 . 1.8 2292 2292 A 73 ALA HB% A 73 ALA H 1.0 . 1.8 2293 2293 A 84 ARG HA A 73 ALA H 1.0 . 1.8 2294 2294 A 72 TRP HB2 A 73 ALA H 1.0 . 1.8 2295 2295 A 73 ALA HA A 73 ALA H 1.0 . 1.8 2296 2296 A 23 TYR HBx A 23 TYR H 1.0 . 1.8 2297 2297 A 22 GLN HGx A 23 TYR H 1.0 . 1.8 2298 2298 A 22 GLN HA A 23 TYR H 1.0 . 1.8 2299 2299 A 22 GLN HB2 A 23 TYR H 1.0 . 1.8 2300 2300 A 75 CYS H A 75 CYS HB2 1.0 . 1.8 2301 2301 A 74 GLU HA A 75 CYS H 1.0 . 1.8 2302 2302 A 75 CYS H A 75 CYS HB3 1.0 . 1.8 2303 2303 A 74 GLU HG2 A 75 CYS H 1.0 . 1.8 2304 2304 A 21 TRP HA A 22 GLN H 1.0 . 1.8 2305 2305 A 22 GLN HGx A 22 GLN H 1.0 . 1.8 2306 2306 A 22 GLN HA A 22 GLN H 1.0 . 1.8 2307 2307 A 21 TRP HB2 A 22 GLN H 1.0 . 1.8 2308 2308 A 22 GLN HB2 A 22 GLN H 1.0 . 1.8 2309 2309 A 21 TRP HB3 A 22 GLN H 1.0 . 1.8 2310 2310 A 49 THR HA A 49 THR H 1.0 . 1.8 2311 2311 A 97 CYS HB2 A 98 GLN H 1.0 . 1.8 2312 2312 A 98 GLN HG2 A 98 GLN H 1.0 . 1.8 2313 2313 A 98 GLN HA A 98 GLN H 1.0 . 1.8 2314 2314 A 97 CYS HA A 98 GLN H 1.0 . 1.8 2315 2315 A 98 GLN HB2 A 98 GLN H 1.0 . 1.8 2316 2316 A 98 GLN HB3 A 98 GLN H 1.0 . 1.8 2317 2317 A 49 THR HB A 49 THR H 1.0 . 1.8 2318 2318 A 38 ARG HG2 A 49 THR H 1.0 . 1.8 2319 2319 A 49 THR HG2% A 49 THR H 1.0 . 1.8 2320 2320 A 37 ILE HG2% A 49 THR H 1.0 . 1.8 2321 2321 A 37 ILE HA A 49 THR H 1.0 . 1.8 2322 2322 A 47 LYS HB2 A 49 THR H 1.0 . 1.8 2323 2323 A 38 ARG HB2 A 49 THR H 1.0 . 1.8 2324 2324 A 48 LYS HA A 49 THR H 1.0 . 1.8 2325 2325 A 36 GLY HA2 A 36 GLY H 1.0 . 1.8 2326 2326 A 36 GLY HA3 A 36 GLY H 1.0 . 1.8 2327 2327 A 36 GLY H A 35 ASN HBy 1.0 . 1.8 2328 2328 A 35 ASN HB2 A 36 GLY H 1.0 . 1.8 2329 2329 A 36 GLY H A 52 LYS HB2 1.0 . 1.8 2330 2330 A 50 LYS HA A 36 GLY H 1.0 . 1.8 2331 2331 A 35 ASN HA A 36 GLY H 1.0 . 1.8 2332 2332 A 83 SER HA A 84 ARG H 1.0 . 1.8 2333 2333 A 83 SER HB2 A 84 ARG H 1.0 . 1.8 2334 2334 A 103 VAL HG1% A 84 ARG H 1.0 . 1.8 2335 2335 A 37 ILE HD1% A 49 THR H 1.0 . 1.8 2336 2336 A 36 GLY H A 52 LYS HG2 1.0 . 1.8 2337 2337 A 23 TYR HD1 A 24 GLY H 1.0 . 1.8 2338 2338 A 40 ALA HB% A 24 GLY H 1.0 . 1.8 2339 2339 A 24 GLY HA2 A 24 GLY H 1.0 . 1.8 2340 2340 A 24 GLY HA3 A 24 GLY H 1.0 . 1.8 2341 2341 A 23 TYR HBx A 24 GLY H 1.0 . 1.8 2342 2342 A 23 TYR HA A 24 GLY H 1.0 . 1.8 2343 2343 A 40 ALA HA A 24 GLY H 1.0 . 1.8 2344 2344 A 103 VAL HG2% A 84 ARG H 1.0 . 1.8 2345 2345 A 72 TRP HZ3 A 84 ARG H 1.0 . 1.8 2346 2346 A 84 ARG HA A 84 ARG H 1.0 . 1.8 2347 2347 A 72 TRP HE3 A 84 ARG H 1.0 . 1.8 2348 2348 A 99 THR HG2% A 88 LEU H 1.0 . 1.8 2349 2349 A 100 THR HG2% A 88 LEU H 1.0 . 1.8 2350 2350 A 88 LEU HB2 A 88 LEU H 1.0 . 1.8 2351 2351 A 87 THR HA A 88 LEU H 1.0 . 1.8 2352 2352 A 88 LEU HA A 88 LEU H 1.0 . 1.8 2353 2353 A 77 THR HG2% A 77 THR H 1.0 . 1.8 2354 2354 A 76 ASP HA A 77 THR H 1.0 . 1.8 2355 2355 A 77 THR HB A 77 THR H 1.0 . 1.8 2356 2356 A 77 THR HA A 77 THR H 1.0 . 1.8 2357 2357 A 76 ASP HB2 A 77 THR H 1.0 . 1.8 2358 2358 A 79 THR HG2% A 80 GLY H 1.0 . 1.8 2359 2359 A 77 THR HA A 80 GLY H 1.0 . 1.8 2360 2360 A 76 ASP HB2 A 76 ASP H 1.0 . 1.8 2361 2361 A 76 ASP HB3 A 76 ASP H 1.0 . 1.8 2362 2362 A 75 CYS HA A 76 ASP H 1.0 . 1.8 2363 2363 A 82 ARG HA A 76 ASP H 1.0 . 1.8 2364 2364 A 76 ASP HA A 76 ASP H 1.0 . 1.8 2365 2365 A 87 THR HB A 88 LEU H 1.0 . 1.8 2366 2366 A 88 LEU HG A 88 LEU H 1.0 . 1.8 2367 2367 A 88 LEU HD2% A 88 LEU H 1.0 . 1.8 2368 2368 A 88 LEU HD1% A 88 LEU H 1.0 . 1.8 2369 2369 A 67 TYR HE1 A 88 LEU H 1.0 . 1.8 2370 2370 A 99 THR HA A 88 LEU H 1.0 . 1.8 2371 2371 A 66 LYS HA A 67 TYR H 1.0 . 1.8 2372 2372 A 103 VAL H A 102 LYS HG2 1.0 . 1.8 2373 2373 A 67 TYR HB2 A 67 TYR H 1.0 . 1.8 2374 2374 A 67 TYR HB3 A 67 TYR H 1.0 . 1.8 2375 2375 A 66 LYS HD2 A 67 TYR H 1.0 . 1.8 2376 2376 A 26 CYS HBx A 26 CYS H 1.0 . 1.8 2377 2377 A 26 CYS H A 25 LYS HA 1.0 . 1.8 2378 2378 A 25 LYS HBx A 26 CYS H 1.0 . 1.8 2379 2379 A 80 GLY HA3 A 80 GLY H 1.0 . 1.8 2380 2380 A 80 GLY HA2 A 80 GLY H 1.0 . 1.8 2381 2381 A 79 THR HA A 80 GLY H 1.0 . 1.8 2382 2382 A 83 SER HB3 A 103 VAL H 1.0 . 1.8 2383 2383 A 67 TYR HD1 A 67 TYR H 1.0 . 1.8 2384 2384 A 103 VAL HG1% A 103 VAL H 1.0 . 1.8 2385 2385 A 103 VAL HG2% A 103 VAL H 1.0 . 1.8 2386 2386 A 103 VAL HA A 103 VAL H 1.0 . 1.8 2387 2387 A 67 TYR HA A 67 TYR H 1.0 . 1.8 2388 2388 A 103 VAL H A 102 LYS HB2 1.0 . 1.8 2389 2389 A 103 VAL HB A 103 VAL H 1.0 . 1.8 2390 2390 A 102 LYS HA A 103 VAL H 1.0 . 1.8 2391 2391 A 53 VAL H A 52 LYS HG2 1.0 . 1.8 2392 2392 A 53 VAL H A 34 GLY HA3 1.0 . 1.8 2393 2393 A 53 VAL HG1% A 53 VAL H 1.0 . 1.8 2394 2394 A 53 VAL HG2% A 53 VAL H 1.0 . 1.8 2395 2395 A 53 VAL H A 52 LYS HB2 1.0 . 1.8 2396 2396 A 53 VAL HB A 53 VAL H 1.0 . 1.8 2397 2397 A 52 LYS HA A 53 VAL H 1.0 . 1.8 2398 2398 A 53 VAL HA A 53 VAL H 1.0 . 1.8 2399 2399 A 33 CYS HA A 53 VAL H 1.0 . 1.8 2400 2400 A 52 LYS HD2 A 53 VAL H 1.0 . 1.8 2401 2401 A 67 TYR HD1 A 68 LYS H 1.0 . 1.8 2402 2402 A 68 LYS HG2 A 68 LYS H 1.0 . 1.8 2403 2403 A 67 TYR HB2 A 68 LYS H 1.0 . 1.8 2404 2404 A 67 TYR HB3 A 68 LYS H 1.0 . 1.8 2405 2405 A 67 TYR HA A 68 LYS H 1.0 . 1.8 2406 2406 A 68 LYS H A 68 LYS HB3 1.0 . 1.8 2407 2407 A 68 LYS HB2 A 68 LYS H 1.0 . 1.8 2408 2408 A 68 LYS HA A 68 LYS H 1.0 . 1.8 2409 2409 A 88 LEU HA A 68 LYS H 1.0 . 1.8 2410 2410 A 51 CYS HBx A 52 LYS H 1.0 . 1.8 2411 2411 A 27 VAL HG1% A 27 VAL H 1.0 . 1.8 2412 2412 A 26 CYS HBx A 27 VAL H 1.0 . 1.8 2413 2413 A 27 VAL HA A 27 VAL H 1.0 . 1.8 2414 2414 A 26 CYS HA A 27 VAL H 1.0 . 1.8 2415 2415 A 38 ARG HB2 A 27 VAL H 1.0 . 1.8 2416 2416 A 27 VAL HB A 27 VAL H 1.0 . 1.8 2417 2417 A 38 ARG HA A 27 VAL H 1.0 . 1.8 2418 2418 A 13 LYS H A 12 PRO HGx 1.0 . 1.8 2419 2419 A 46 THR HB A 46 THR H 1.0 . 1.8 2420 2420 A 46 THR HA A 46 THR H 1.0 . 1.8 2421 2421 A 45 GLN HG2 A 46 THR H 1.0 . 1.8 2422 2422 A 45 GLN HA A 46 THR H 1.0 . 1.8 2423 2423 A 45 GLN HB2 A 46 THR H 1.0 . 1.8 2424 2424 A 78 THR HB A 78 THR H 1.0 . 1.8 2425 2425 A 78 THR HG2% A 78 THR H 1.0 . 1.8 2426 2426 A 78 THR HA A 78 THR H 1.0 . 1.8 2427 2427 A 77 THR HA A 78 THR H 1.0 . 1.8 2428 2428 A 76 ASP HA A 78 THR H 1.0 . 1.8 2429 2429 A 48 LYS HG2 A 48 LYS H 1.0 . 1.8 2430 2430 A 46 THR HG2% A 48 LYS H 1.0 . 1.8 2431 2431 A 47 LYS HB2 A 48 LYS H 1.0 . 1.8 2432 2432 A 48 LYS HB2 A 48 LYS H 1.0 . 1.8 2433 2433 A 48 LYS HA A 48 LYS H 1.0 . 1.8 2434 2434 A 47 LYS HA A 48 LYS H 1.0 . 1.8 2435 2435 A 48 LYS HD2 A 48 LYS H 1.0 . 1.8 2436 2436 A 47 LYS HD2 A 48 LYS H 1.0 . 1.8 2437 2437 A 104 SER HA A 104 SER H 1.0 . 1.8 2438 2438 A 79 THR HA A 78 THR H 1.0 . 1.8 2439 2439 A 103 VAL HA A 104 SER H 1.0 . 1.8 2440 2440 A 104 SER HB2 A 104 SER H 1.0 . 1.8 2441 2441 A 103 VAL HG1% A 104 SER H 1.0 . 1.8 2442 2442 A 103 VAL HG2% A 104 SER H 1.0 . 1.8 2443 2443 A 103 VAL HB A 104 SER H 1.0 . 1.8 2444 2444 A 11 GLU N A 11 GLU HA 1.0 . 1.8 2445 2445 A 11 GLU N A 11 GLU HBx 1.0 . 1.8 2446 2446 A 11 GLU N A 11 GLU HGx 1.0 . 1.8 2447 2447 A 31 GLY H A 31 GLY HA2 1.0 . 1.8 2448 2448 A 30 SER HA A 31 GLY H 1.0 . 1.8 2449 2449 A 31 GLY H A 31 GLY HA3 1.0 . 1.8 2450 2450 A 30 SER HBx A 31 GLY H 1.0 . 1.8 2451 2451 A 92 LEU HG A 92 LEU H 1.0 . 1.8 2452 2452 A 91 ALA HA A 92 LEU H 1.0 . 1.8 2453 2453 A 92 LEU HB3 A 92 LEU H 1.0 . 1.8 2454 2454 A 92 LEU HD2% A 92 LEU H 1.0 . 1.8 2455 2455 A 91 ALA HB% A 92 LEU H 1.0 . 1.8 2456 2456 A 92 LEU HB2 A 92 LEU H 1.0 . 1.8 2457 2457 A 50 LYS HE2 A 50 LYS H 1.0 . 1.8 2458 2458 A 49 THR HA A 50 LYS H 1.0 . 1.8 2459 2459 A 50 LYS HA A 50 LYS H 1.0 . 1.8 2460 2460 A 49 THR HB A 50 LYS H 1.0 . 1.8 2461 2461 A 49 THR HB A 50 LYS H 1.0 . 1.8 2462 2462 A 50 LYS HG2 A 50 LYS H 1.0 . 1.8 2463 2463 A 49 THR HG2% A 50 LYS H 1.0 . 1.8 2464 2464 A 50 LYS HB2 A 50 LYS H 1.0 . 1.8 2465 2465 A 50 LYS HD2 A 50 LYS H 1.0 . 1.8 2466 2466 A 71 ARG HG2 A 72 TRP H 1.0 . 1.8 2467 2467 A 72 TRP HD1 A 72 TRP H 1.0 . 1.8 2468 2468 A 72 TRP HA A 72 TRP H 1.0 . 1.8 2469 2469 A 71 ARG HA A 72 TRP H 1.0 . 1.8 2470 2470 A 71 ARG HB3 A 72 TRP H 1.0 . 1.8 2471 2471 A 72 TRP HB2 A 72 TRP H 1.0 . 1.8 2472 2472 A 30 SER HBx A 30 SER H 1.0 . 1.8 2473 2473 A 28 PRO HA A 30 SER H 1.0 . 1.8 2474 2474 A 29 ASN HB2 A 30 SER H 1.0 . 1.8 2475 2475 A 30 SER HA A 30 SER H 1.0 . 1.8 2476 2476 A 29 ASN HA A 30 SER H 1.0 . 1.8 2477 2477 A 28 PRO HB2 A 30 SER H 1.0 . 1.8 2478 2478 A 72 TRP HE3 A 72 TRP H 1.0 . 1.8 2479 2479 A 113 LYS N A 113 LYS HG2 1.0 . 1.8 2480 2480 A 8 LYS N A 8 LYS HA 1.0 . 1.8 2481 2481 A 113 LYS N A 113 LYS HB2 1.0 . 1.8 2482 2482 A 113 LYS N A 113 LYS HA 1.0 . 1.8 2483 2483 A 113 LYS N A 112 PRO HB2 1.0 . 1.8 2484 2484 A 113 LYS N A 112 PRO HA 1.0 . 1.8 2485 2485 A 118 GLU H A 118 GLU HB2 1.0 . 1.8 2486 2486 A 93 PHE HB2 A 62 GLY H 1.0 . 1.8 2487 2487 A 61 PHE HB2 A 62 GLY H 1.0 . 1.8 2488 2488 A 118 GLU H A 117 GLY HA2 1.0 . 1.8 2489 2489 A 71 ARG HA A 71 ARG H 1.0 . 1.8 2490 2490 A 71 ARG HG2 A 71 ARG H 1.0 . 1.8 2491 2491 A 70 GLY HA3 A 71 ARG H 1.0 . 1.8 2492 2492 A 71 ARG HD2 A 71 ARG H 1.0 . 1.8 2493 2493 A 71 ARG HB2 A 71 ARG H 1.0 . 1.8 2494 2494 A 62 GLY H A 62 GLY HA2 1.0 . 1.8 2495 2495 A 61 PHE HA A 62 GLY H 1.0 . 1.8 2496 2496 A 14 ALA H A 13 LYS HGx 1.0 . 1.8 2497 2497 A 14 ALA HB% A 14 ALA H 1.0 . 1.8 2498 2498 A 13 LYS HA A 14 ALA H 1.0 . 1.8 2499 2499 A 14 ALA H A 13 LYS HBx 1.0 . 1.8 2500 2500 A 14 ALA HA A 14 ALA H 1.0 . 1.8 2501 2501 A 13 LYS H A 12 PRO HGx 1.0 . 1.8 2502 2502 A 13 LYS H A 12 PRO HA 1.0 . 1.8 2503 2503 A 13 LYS H A 13 LYS HBx 1.0 . 1.8 2504 2504 A 32 ASP H A 31 GLY HA2 1.0 . 1.8 2505 2505 A 32 ASP H A 31 GLY HA3 1.0 . 1.8 2506 2506 A 32 ASP HB2 A 32 ASP H 1.0 . 1.8 2507 2507 A 73 ALA HB% A 74 GLU H 1.0 . 1.8 2508 2508 A 74 GLU HG2 A 74 GLU H 1.0 . 1.8 2509 2509 A 74 GLU HA A 74 GLU H 1.0 . 1.8 2510 2510 A 74 GLU HB2 A 74 GLU H 1.0 . 1.8 2511 2511 A 73 ALA HA A 74 GLU H 1.0 . 1.8 2512 2512 A 86 GLY HA2 A 70 GLY H 1.0 . 1.8 2513 2513 A 70 GLY HA2 A 70 GLY H 1.0 . 1.8 2514 2514 A 70 GLY HA3 A 70 GLY H 1.0 . 1.8 2515 2515 A 69 PHE HB2 A 70 GLY H 1.0 . 1.8 2516 2516 A 69 PHE HA A 70 GLY H 1.0 . 1.8 2517 2517 A 86 GLY HA3 A 70 GLY H 1.0 . 1.8 2518 2518 A 90 LYS HG2 A 91 ALA H 1.0 . 1.8 2519 2519 A 91 ALA HB% A 91 ALA H 1.0 . 1.8 2520 2520 A 90 LYS HA A 91 ALA H 1.0 . 1.8 2521 2521 A 90 LYS HB2 A 91 ALA H 1.0 . 1.8 2522 2522 A 90 LYS HD2 A 91 ALA H 1.0 . 1.8 2523 2523 A 91 ALA HA A 91 ALA H 1.0 . 1.8 2524 2524 A 18 CYS HB2 A 18 CYS H 1.0 . 1.8 2525 2525 A 17 GLU HBx A 18 CYS H 1.0 . 1.8 2526 2526 A 17 GLU HGx A 18 CYS H 1.0 . 1.8 2527 2527 A 17 GLU HA A 18 CYS H 1.0 . 1.8 2528 2528 A 25 LYS HGx A 25 LYS H 1.0 . 1.8 2529 2529 A 24 GLY HA2 A 25 LYS H 1.0 . 1.8 2530 2530 A 24 GLY HA3 A 25 LYS H 1.0 . 1.8 2531 2531 A 25 LYS H A 25 LYS HA 1.0 . 1.8 2532 2532 A 25 LYS HBx A 25 LYS H 1.0 . 1.8 2533 2533 A 32 ASP HA A 32 ASP H 1.0 . 1.8 2534 2534 A 87 THR HA A 87 THR H 1.0 . 1.8 2535 2535 A 67 TYR HD1 A 87 THR H 1.0 . 1.8 2536 2536 A 86 GLY HA2 A 87 THR H 1.0 . 1.8 2537 2537 A 86 GLY HA3 A 87 THR H 1.0 . 1.8 2538 2538 A 87 THR HG2% A 87 THR H 1.0 . 1.8 2539 2539 A 67 TYR HB3 A 87 THR H 1.0 . 1.8 2540 2540 A 87 THR HB A 87 THR H 1.0 . 1.8 2541 2541 A 69 PHE HA A 87 THR H 1.0 . 1.8 2542 2542 A 117 GLY H A 116 GLY HA2 1.0 . 1.8 2543 2543 A 90 LYS HE2 A 91 ALA H 1.0 . 1.8 2544 2544 A 15 ASP H A 16 ALA HB% 1.0 . 1.8 2545 2545 A 15 ASP H A 15 ASP HBx 1.0 . 1.8 2546 2546 A 17 GLU HGx A 17 GLU H 1.0 . 1.8 2547 2547 A 15 ASP HA A 15 ASP H 1.0 . 1.8 2548 2548 A 94 ASN HB2 A 94 ASN H 1.0 . 1.8 2549 2549 A 94 ASN HA A 94 ASN H 1.0 . 1.8 2550 2550 A 20 GLU HGx A 21 TRP H 1.0 . 1.8 2551 2551 A 20 GLU HBx A 21 TRP H 1.0 . 1.8 2552 2552 A 17 GLU HA A 17 GLU H 1.0 . 1.8 2553 2553 A 17 GLU H A 16 ALA HA 1.0 . 1.8 2554 2554 A 17 GLU HBx A 17 GLU H 1.0 . 1.8 2555 2555 A 92 LEU HD2% A 93 PHE H 1.0 . 1.8 2556 2556 A 92 LEU HA A 93 PHE H 1.0 . 1.8 2557 2557 A 92 LEU HD1% A 93 PHE H 1.0 . 1.8 2558 2558 A 93 PHE HB2 A 93 PHE H 1.0 . 1.8 2559 2559 A 93 PHE HA A 93 PHE H 1.0 . 1.8 2560 2560 A 21 TRP HD1 A 21 TRP H 1.0 . 1.8 2561 2561 A 21 TRP HA A 21 TRP H 1.0 . 1.8 2562 2562 A 20 GLU HA A 21 TRP H 1.0 . 1.8 2563 2563 A 21 TRP HB2 A 21 TRP H 1.0 . 1.8 2564 2564 A 21 TRP HB3 A 21 TRP H 1.0 . 1.8 2565 2565 A 101 ILE HG12 A 102 LYS H 1.0 . 1.8 2566 2566 A 101 ILE HG13 A 102 LYS H 1.0 . 1.8 2567 2567 A 102 LYS HG2 A 102 LYS H 1.0 . 1.8 2568 2568 A 103 VAL HG1% A 102 LYS H 1.0 . 1.8 2569 2569 A 101 ILE HB A 102 LYS H 1.0 . 1.8 2570 2570 A 101 ILE HG2% A 102 LYS H 1.0 . 1.8 2571 2571 A 101 ILE HA A 102 LYS H 1.0 . 1.8 2572 2572 A 101 ILE HD1% A 102 LYS H 1.0 . 1.8 2573 2573 A 102 LYS HB2 A 102 LYS H 1.0 . 1.8 2574 2574 A 102 LYS HA A 102 LYS H 1.0 . 1.8 2575 2575 A 102 LYS HD2 A 102 LYS H 1.0 . 1.8 2576 2576 A 92 LEU HB3 A 93 PHE H 1.0 . 1.8 2577 2577 A 92 LEU HG A 93 PHE H 1.0 . 1.8 2578 2578 A 93 PHE HD1 A 93 PHE H 1.0 . 1.8 2579 2579 A 92 LEU HB2 A 93 PHE H 1.0 . 1.8 2580 2580 A 101 ILE H A 100 THR HB 1.0 . 1.8 2581 2581 A 100 THR HG2% A 101 ILE H 1.0 . 1.8 2582 2582 A 101 ILE HG2% A 101 ILE H 1.0 . 1.8 2583 2583 A 100 THR HA A 101 ILE H 1.0 . 1.8 2584 2584 A 101 ILE HD1% A 101 ILE H 1.0 . 1.8 2585 2585 A 101 ILE H A 100 THR HB 1.0 . 1.8 2586 2586 A 101 ILE HG12 A 101 ILE H 1.0 . 1.8 2587 2587 A 85 SER HA A 101 ILE H 1.0 . 1.8 2588 2588 A 67 TYR HE1 A 101 ILE H 1.0 . 1.8 2589 2589 A 21 TRP HZ3 A 42 CYS H 1.0 . 1.8 2590 2590 A 63 ALA HA A 63 ALA H 1.0 . 1.8 2591 2591 A 101 ILE HG13 A 101 ILE H 1.0 . 1.8 2592 2592 A 87 THR HA A 101 ILE H 1.0 . 1.8 2593 2593 A 101 ILE HA A 101 ILE H 1.0 . 1.8 2594 2594 A 64 ASP H A 62 GLY HA2 1.0 . 1.8 2595 2595 A 63 ALA HB% A 64 ASP H 1.0 . 1.8 2596 2596 A 64 ASP HA A 64 ASP H 1.0 . 1.8 2597 2597 A 64 ASP HB3 A 64 ASP H 1.0 . 1.8 2598 2598 A 64 ASP HB2 A 64 ASP H 1.0 . 1.8 2599 2599 A 63 ALA HA A 64 ASP H 1.0 . 1.8 2600 2600 A 41 THR HB A 42 CYS H 1.0 . 1.8 2601 2601 A 41 THR HG2% A 42 CYS H 1.0 . 1.8 2602 2602 A 42 CYS HB2 A 42 CYS H 1.0 . 1.8 2603 2603 A 41 THR HA A 42 CYS H 1.0 . 1.8 2604 2604 A 21 TRP HH2 A 42 CYS H 1.0 . 1.8 2605 2605 A 42 CYS HA A 42 CYS H 1.0 . 1.8 2606 2606 A 21 TRP HE3 A 42 CYS H 1.0 . 1.8 2607 2607 A 45 GLN HB2 A 42 CYS H 1.0 . 1.8 2608 2608 A 41 THR HB A 42 CYS H 1.0 . 1.8 2609 2609 A 63 ALA H A 62 GLY HA2 1.0 . 1.8 2610 2610 A 63 ALA HB% A 63 ALA H 1.0 . 1.8 2611 2611 A 42 CYS HB3 A 42 CYS H 1.0 . 1.8 2612 2612 A 60 ASP H A 59 LYS HG2 1.0 . 1.8 2613 2613 A 59 LYS HB2 A 60 ASP H 1.0 . 1.8 2614 2614 A 60 ASP HA A 60 ASP H 1.0 . 1.8 2615 2615 A 60 ASP H A 59 LYS HD2 1.0 . 1.8 2616 2616 A 60 ASP HB2 A 60 ASP H 1.0 . 1.8 2617 2617 A 59 LYS HA A 60 ASP H 1.0 . 1.8 2618 2618 A 108 THR HB A 108 THR H 1.0 . 1.8 2619 2619 A 108 THR HA A 108 THR H 1.0 . 1.8 2620 2620 A 65 CYS HB3 A 66 LYS H 1.0 . 1.8 2621 2621 A 41 THR HG2% A 45 GLN H 1.0 . 1.8 2622 2622 A 43 ASN HB2 A 45 GLN H 1.0 . 1.8 2623 2623 A 44 GLU HG2 A 45 GLN H 1.0 . 1.8 2624 2624 A 45 GLN HG2 A 45 GLN H 1.0 . 1.8 2625 2625 A 45 GLN HB2 A 45 GLN H 1.0 . 1.8 2626 2626 A 44 GLU HB2 A 45 GLN H 1.0 . 1.8 2627 2627 A 41 THR HB A 45 GLN H 1.0 . 1.8 2628 2628 A 41 THR HA A 45 GLN H 1.0 . 1.8 2629 2629 A 50 LYS HG2 A 51 CYS H 1.0 . 1.8 2630 2630 A 37 ILE HA A 51 CYS H 1.0 . 1.8 2631 2631 A 50 LYS HA A 51 CYS H 1.0 . 1.8 2632 2632 A 37 ILE HD1% A 51 CYS H 1.0 . 1.8 2633 2633 A 51 CYS HA A 51 CYS H 1.0 . 1.8 2634 2634 A 50 LYS HB2 A 51 CYS H 1.0 . 1.8 2635 2635 A 66 LYS H A 66 LYS HG2 1.0 . 1.8 2636 2636 A 88 LEU HD1% A 66 LYS H 1.0 . 1.8 2637 2637 A 66 LYS H A 66 LYS HB2 1.0 . 1.8 2638 2638 A 65 CYS HA A 66 LYS H 1.0 . 1.8 2639 2639 A 91 ALA HA A 66 LYS H 1.0 . 1.8 2640 2640 A 66 LYS HD2 A 66 LYS H 1.0 . 1.8 2641 2641 A 107 CYS HB2 A 107 CYS H 1.0 . 1.8 2642 2642 A 81 THR HG2% A 107 CYS H 1.0 . 1.8 2643 2643 A 106 PRO HA A 107 CYS H 1.0 . 1.8 2644 2644 A 81 THR HA A 107 CYS H 1.0 . 1.8 2645 2645 A 106 PRO HB2 A 107 CYS H 1.0 . 1.8 2646 2646 A 16 ALA HB% A 16 ALA H 1.0 . 1.8 2647 2647 A 15 ASP HBx A 16 ALA H 1.0 . 1.8 2648 2648 A 15 ASP HA A 16 ALA H 1.0 . 1.8 2649 2649 A 16 ALA HA A 16 ALA H 1.0 . 1.8 2650 2650 A 54 PRO HA A 55 CYS H 1.0 . 1.8 2651 2651 A 61 PHE HD1 A 61 PHE H 1.0 . 1.8 2652 2652 A 61 PHE HB2 A 61 PHE H 1.0 . 1.8 2653 2653 A 60 ASP HA A 61 PHE H 1.0 . 1.8 2654 2654 A 60 ASP HB2 A 61 PHE H 1.0 . 1.8 2655 2655 A 61 PHE HA A 61 PHE H 1.0 . 1.8 2656 2656 A 59 LYS HA A 59 LYS H 1.0 . 1.8 2657 2657 A 59 LYS HB2 A 59 LYS H 1.0 . 1.8 2658 2658 A 59 LYS HD2 A 59 LYS H 1.0 . 1.8 2659 2659 A 59 LYS HG2 A 59 LYS H 1.0 . 1.8 2660 2660 A 88 LEU HG A 97 CYS H 1.0 . 1.8 2661 2661 A 97 CYS HB2 A 97 CYS H 1.0 . 1.8 2662 2662 A 91 ALA HB% A 97 CYS H 1.0 . 1.8 2663 2663 A 96 GLU HG2 A 97 CYS H 1.0 . 1.8 2664 2664 A 96 GLU HA A 97 CYS H 1.0 . 1.8 2665 2665 A 97 CYS HA A 97 CYS H 1.0 . 1.8 2666 2666 A 97 CYS H A 96 GLU HB2 1.0 . 1.8 2667 2667 A 97 CYS HB3 A 97 CYS H 1.0 . 1.8 2668 2668 A 33 CYS HB2 A 33 CYS H 1.0 . 1.8 2669 2669 A 57 TRP HD1 A 57 TRP H 1.0 . 1.8 2670 2670 A 56 ASN HB2 A 57 TRP H 1.0 . 1.8 2671 2671 A 57 TRP HA A 57 TRP H 1.0 . 1.8 2672 2672 A 56 ASN HA A 57 TRP H 1.0 . 1.8 2673 2673 A 57 TRP HB2 A 57 TRP H 1.0 . 1.8 2674 2674 A 28 PRO HG3 A 33 CYS H 1.0 . 1.8 2675 2675 A 33 CYS HB3 A 33 CYS H 1.0 . 1.8 2676 2676 A 33 CYS H A 31 GLY HA2 1.0 . 1.8 2677 2677 A 33 CYS H A 31 GLY HA3 1.0 . 1.8 2678 2678 A 53 VAL HG2% A 33 CYS H 1.0 . 1.8 2679 2679 A 32 ASP HB2 A 33 CYS H 1.0 . 1.8 2680 2680 A 33 CYS HA A 33 CYS H 1.0 . 1.8 2681 2681 A 28 PRO HB2 A 33 CYS H 1.0 . 1.8 2682 2682 A 32 ASP HA A 33 CYS H 1.0 . 1.8 2683 2683 A 28 PRO HG2 A 33 CYS H 1.0 . 1.8 2684 2684 A 58 LYS HD2 A 58 LYS H 1.0 . 1.8 2685 2685 A 26 CYS HA A 37 ILE H 1.0 . 1.8 2686 2686 A 37 ILE HG12 A 37 ILE H 1.0 . 1.8 2687 2687 A 36 GLY HA2 A 37 ILE H 1.0 . 1.8 2688 2688 A 36 GLY HA3 A 37 ILE H 1.0 . 1.8 2689 2689 A 27 VAL HG2% A 37 ILE H 1.0 . 1.8 2690 2690 A 37 ILE HB A 37 ILE H 1.0 . 1.8 2691 2691 A 28 PRO HA A 37 ILE H 1.0 . 1.8 2692 2692 A 37 ILE HA A 37 ILE H 1.0 . 1.8 2693 2693 A 37 ILE HD1% A 37 ILE H 1.0 . 1.8 2694 2694 A 57 TRP HA A 58 LYS H 1.0 . 1.8 2695 2695 A 58 LYS HB2 A 58 LYS H 1.0 . 1.8 2696 2696 A 57 TRP HB2 A 58 LYS H 1.0 . 1.8 2697 2697 A 58 LYS HG2 A 58 LYS H 1.0 . 1.8 2698 2698 A 58 LYS HA A 58 LYS H 1.0 . 1.8 2699 2699 A 37 ILE HG2% A 37 ILE H 1.0 . 1.8 2700 2700 A 27 VAL HB A 37 ILE H 1.0 . 1.8 2701 2701 A 95 ALA HA A 95 ALA H 1.0 . 1.8 2702 2702 A 95 ALA HB% A 95 ALA H 1.0 . 1.8 2703 2703 A 94 ASN HB2 A 95 ALA H 1.0 . 1.8 2704 2704 A 94 ASN HA A 95 ALA H 1.0 . 1.8 2705 2705 A 83 SER HB2 A 83 SER H 1.0 . 1.8 2706 2706 A 73 ALA HB% A 83 SER H 1.0 . 1.8 2707 2707 A 83 SER HA A 83 SER H 1.0 . 1.8 2708 2708 A 82 ARG HA A 83 SER H 1.0 . 1.8 2709 2709 A 82 ARG HB3 A 83 SER H 1.0 . 1.8 2710 2710 A 98 GLN HG2 A 98 GLN HE22 1.0 . 1.8 2711 2711 A 65 CYS HB2 A 65 CYS H 1.0 . 1.8 2712 2712 A 65 CYS HB3 A 65 CYS H 1.0 . 1.8 2713 2713 A 63 ALA HB% A 65 CYS H 1.0 . 1.8 2714 2714 A 64 ASP HA A 65 CYS H 1.0 . 1.8 2715 2715 A 101 ILE HG2% A 100 THR H 1.0 . 1.8 2716 2716 A 87 THR HA A 100 THR H 1.0 . 1.8 2717 2717 A 35 ASN HB2 A 35 ASN HD21 1.0 . 1.8 2718 2718 A 90 LYS HG2 A 90 LYS H 1.0 . 1.8 2719 2719 A 88 LEU HD1% A 90 LYS H 1.0 . 1.8 2720 2720 A 90 LYS HB2 A 90 LYS H 1.0 . 1.8 2721 2721 A 89 LYS HA A 90 LYS H 1.0 . 1.8 2722 2722 A 90 LYS HD2 A 90 LYS H 1.0 . 1.8 2723 2723 A 99 THR HG2% A 100 THR H 1.0 . 1.8 2724 2724 A 98 GLN HA A 98 GLN HE21 1.0 . 1.8 2725 2725 A 98 GLN HB2 A 98 GLN HE21 1.0 . 1.8 2726 2726 A 100 THR H A 100 THR HB 1.0 . 1.8 2727 2727 A 99 THR HB A 100 THR H 1.0 . 1.8 2728 2728 A 99 THR HA A 100 THR H 1.0 . 1.8 2729 2729 A 100 THR HG2% A 100 THR H 1.0 . 1.8 2730 2730 A 100 THR HA A 100 THR H 1.0 . 1.8 2731 2731 A 98 GLN HG2 A 98 GLN HE21 1.0 . 1.8 2732 2732 A 98 GLN HB3 A 98 GLN HE21 1.0 . 1.8 2733 2733 A 100 THR H A 100 THR HB 1.0 . 1.8 2734 2734 A 21 TRP HZ2 A 45 GLN HE21 1.0 . 1.8 2735 2735 A 56 ASN HB2 A 56 ASN HD21 1.0 . 1.8 2736 2736 A 45 GLN HG2 A 45 GLN HE21 1.0 . 1.8 2737 2737 A 45 GLN HB2 A 45 GLN HE21 1.0 . 1.8 2738 2738 A 94 ASN HB2 A 94 ASN HD21 1.0 . 1.8 2739 2739 A 94 ASN HA A 94 ASN HD21 1.0 . 1.8 2740 2740 A 18 CYS HB2 A 20 GLU H 1.0 . 1.8 2741 2741 A 19 SER HA A 20 GLU H 1.0 . 1.8 2742 2742 A 20 GLU HA A 20 GLU H 1.0 . 1.8 2743 2743 A 20 GLU HBx A 20 GLU H 1.0 . 1.8 2744 2744 A 79 THR HB A 79 THR H 1.0 . 1.8 2745 2745 A 80 GLY HA3 A 79 THR H 1.0 . 1.8 2746 2746 A 78 THR HB A 79 THR H 1.0 . 1.8 2747 2747 A 20 GLU HGx A 20 GLU H 1.0 . 1.8 2748 2748 A 18 CYS HA A 20 GLU H 1.0 . 1.8 2749 2749 A 19 SER HBx A 20 GLU H 1.0 . 1.8 2750 2750 A 18 CYS HB3 A 43 ASN HD21 1.0 . 1.8 2751 2751 A 78 THR HA A 79 THR H 1.0 . 1.8 2752 2752 A 79 THR HG2% A 79 THR H 1.0 . 1.8 2753 2753 A 79 THR HA A 79 THR H 1.0 . 1.8 2754 2754 A 18 CYS HB2 A 43 ASN HD21 1.0 . 1.8 2755 2755 A 80 GLY HA2 A 81 THR H 1.0 . 1.8 2756 2756 A 80 GLY HA3 A 81 THR H 1.0 . 1.8 2757 2757 A 76 ASP HB3 A 81 THR H 1.0 . 1.8 2758 2758 A 81 THR HG2% A 81 THR H 1.0 . 1.8 2759 2759 A 76 ASP HB2 A 81 THR H 1.0 . 1.8 2760 2760 A 81 THR HA A 81 THR H 1.0 . 1.8 2761 2761 A 81 THR HB A 81 THR H 1.0 . 1.8 2762 2762 A 22 GLN HGx A 22 GLN HE21 1.0 . 1.8 2763 2763 A 22 GLN HB3 A 22 GLN HE21 1.0 . 1.8 2764 2764 A 21 TRP HZ2 A 45 GLN HE22 1.0 . 1.8 2765 2765 A 18 CYS HB2 A 45 GLN HE22 1.0 . 1.8 2766 2766 A 45 GLN HG2 A 45 GLN HE22 1.0 . 1.8 2767 2767 A 98 GLN HG2 A 98 GLN HE22 1.0 . 1.8 2768 2768 A 43 ASN HB2 A 43 ASN HD22 1.0 . 1.8 2769 2769 A 94 ASN HB2 A 94 ASN HD22 1.0 . 1.8 2770 2770 A 22 GLN HGx A 22 GLN HE22 1.0 . 1.8 2771 2771 A 92 LEU HA A 92 LEU H 1.0 . 1.8 2772 2772 A 75 CYS HA A 75 CYS H 1.0 . 1.8 2773 2773 A 65 CYS HA A 65 CYS H 1.0 . 1.8 2774 2774 A 42 CYS HA A 43 ASN H 1.0 . 1.8 2775 2775 A 46 THR HG2% A 46 THR H 1.0 . 1.8 2776 2776 A 118 GLU H A 118 GLU HA 1.0 . 1.8 2777 2777 A 66 LYS HA A 66 LYS H 1.0 . 1.8 2778 2778 A 45 GLN HA A 45 GLN H 1.0 . 1.8 2779 2779 A 13 LYS H A 12 PRO HB3 1.0 . 1.8 2780 2780 A 90 LYS H A 89 LYS HB2 1.0 . 1.8 2781 2781 A 18 CYS HA A 18 CYS H 1.0 . 1.8 2782 2782 A 29 ASN HB2 A 29 ASN H 1.0 . 1.8 2783 2783 A 52 LYS HA A 36 GLY H 1.0 . 1.8 2784 2784 A 39 GLU HA A 47 LYS H 1.0 . 1.8 2785 2785 A 44 GLU HA A 45 GLN H 1.0 . 1.8 2786 2786 A 39 GLU HG2 A 47 LYS H 1.0 . 1.8 2787 2787 A 39 GLU HA A 49 THR H 1.0 . 1.8 2788 2788 A 104 SER HA A 84 ARG H 1.0 . 1.8 2789 2789 A 35 ASN HA A 53 VAL H 1.0 . 1.8 2790 2790 A 95 ALA HA A 96 GLU H 1.0 . 1.8 2791 2791 A 96 GLU HB2 A 96 GLU H 1.0 . 1.8 2792 2792 A 67 TYR HA A 89 LYS H 1.0 . 1.8 2793 2793 A 83 SER HA A 105 LYS H 1.0 . 1.8 2794 2794 A 80 GLY HA2 A 79 THR H 1.0 . 1.8 2795 2795 A 90 LYS HA A 90 LYS H 1.0 . 1.8 2796 2796 A 93 PHE HA A 94 ASN H 1.0 . 1.8 2797 2797 A 95 ALA HB% A 96 GLU H 1.0 . 1.8 2798 2798 A 51 CYS HA A 52 LYS H 1.0 . 1.8 2799 2799 A 85 SER HA A 103 VAL H 1.0 . 1.8 2800 2800 A 67 TYR H A 66 LYS HB2 1.0 . 1.8 2801 2801 A 40 ALA HB% A 47 LYS H 1.0 . 1.8 2802 2802 A 104 SER HB3 A 104 SER H 1.0 . 1.8 2803 2803 A 39 GLU HG3 A 39 GLU H 1.0 . 1.8 2804 2804 A 27 VAL HG2% A 27 VAL H 1.0 . 1.8 2805 2805 A 104 SER HB3 A 82 ARG H 1.0 . 1.8 2806 2806 A 22 GLN HGx A 41 THR H 1.0 . 1.8 2807 2807 A 25 LYS HDx A 25 LYS H 1.0 . 1.8 2808 2808 A 26 CYS HA A 26 CYS H 1.0 . 1.8 2809 2809 A 39 GLU HG3 A 40 ALA H 1.0 . 1.8 2810 2810 A 42 CYS HA A 22 GLN H 1.0 . 1.8 2811 2811 A 92 LEU HD1% A 92 LEU H 1.0 . 1.8 2812 2812 A 47 LYS HG2 A 47 LYS H 1.0 . 1.8 2813 2813 A 75 CYS HB2 A 76 ASP H 1.0 . 1.8 2814 2814 A 90 LYS H A 66 LYS HB2 1.0 . 1.8 2815 2815 A 81 THR HG2% A 80 GLY H 1.0 . 1.8 2816 2816 A 106 PRO HB3 A 107 CYS H 1.0 . 1.8 2817 2817 A 107 CYS HA A 107 CYS H 1.0 . 1.8 2818 2818 A 108 THR HG2% A 108 THR H 1.0 . 1.8 2819 2819 A 74 GLU HB2 A 75 CYS H 1.0 . 1.8 2820 2820 A 82 ARG HB2 A 105 LYS H 1.0 . 1.8 2821 2821 A 7 GLU H A 7 GLU HA 1.0 . 1.8 2822 2822 A 7 GLU H A 6 LYS HA 1.0 . 1.8 2823 2823 A 8 LYS HA A 9 GLY H 1.0 . 1.8 2824 2824 A 9 GLY H A 9 GLY HAx 1.0 . 1.8 stop_ save_ save_DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_2 _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 10 LYS C A 11 GLU N A 11 GLU CA A 11 GLU C 1.0 -82.78 -69.84 PHI 2 2 A 11 GLU N A 11 GLU CA A 11 GLU C A 12 PRO N 1.0 119.84 151.56 PSI 3 3 A 13 LYS C A 14 ALA N A 14 ALA CA A 14 ALA C 1.0 -81.32 -58.18 PHI 4 4 A 14 ALA N A 14 ALA CA A 14 ALA C A 15 ASP N 1.0 -53.01 -3.25 PSI 5 5 A 16 ALA C A 17 GLU N A 17 GLU CA A 17 GLU C 1.0 -146.45 -76.41 PHI 6 6 A 17 GLU N A 17 GLU CA A 17 GLU C A 18 CYS N 1.0 132.76 172.96 PSI 7 7 A 22 GLN C A 23 TYR N A 23 TYR CA A 23 TYR C 1.0 -130.20 -82.84 PHI 8 8 A 23 TYR N A 23 TYR CA A 23 TYR C A 24 GLY N 1.0 130.14 163.80 PSI 9 9 A 24 GLY C A 25 LYS N A 25 LYS CA A 25 LYS C 1.0 -119.40 -60.22 PHI 10 10 A 25 LYS N A 25 LYS CA A 25 LYS C A 26 CYS N 1.0 123.24 155.38 PSI 11 11 A 25 LYS C A 26 CYS N A 26 CYS CA A 26 CYS C 1.0 -156.47 -106.27 PHI 12 12 A 26 CYS N A 26 CYS CA A 26 CYS C A 27 VAL N 1.0 113.04 151.48 PSI 13 13 A 26 CYS C A 27 VAL N A 27 VAL CA A 27 VAL C 1.0 -111.36 -91.68 PHI 14 14 A 27 VAL N A 27 VAL CA A 27 VAL C A 28 PRO N 1.0 110.59 128.61 PSI 15 15 A 32 ASP C A 33 CYS N A 33 CYS CA A 33 CYS C 1.0 -154.77 -130.23 PHI 16 16 A 33 CYS N A 33 CYS CA A 33 CYS C A 34 GLY N 1.0 150.72 160.62 PSI 17 17 A 33 CYS C A 34 GLY N A 34 GLY CA A 34 GLY C 1.0 -17.16 324.88 PHI 18 18 A 34 GLY N A 34 GLY CA A 34 GLY C A 35 ASN N 1.0 -2.60 271.80 PSI 19 19 A 36 GLY C A 37 ILE N A 37 ILE CA A 37 ILE C 1.0 -138.04 -105.80 PHI 20 20 A 37 ILE N A 37 ILE CA A 37 ILE C A 38 ARG N 1.0 129.18 159.14 PSI 21 21 A 37 ILE C A 38 ARG N A 38 ARG CA A 38 ARG C 1.0 -130.39 -108.03 PHI 22 22 A 38 ARG N A 38 ARG CA A 38 ARG C A 39 GLU N 1.0 124.50 144.64 PSI 23 23 A 38 ARG C A 39 GLU N A 39 GLU CA A 39 GLU C 1.0 -127.07 -84.69 PHI 24 24 A 39 GLU N A 39 GLU CA A 39 GLU C A 40 ALA N 1.0 114.99 143.89 PSI 25 25 A 39 GLU C A 40 ALA N A 40 ALA CA A 40 ALA C 1.0 -134.62 -105.56 PHI 26 26 A 40 ALA N A 40 ALA CA A 40 ALA C A 41 THR N 1.0 124.12 149.88 PSI 27 27 A 40 ALA C A 41 THR N A 41 THR CA A 41 THR C 1.0 -130.46 -95.20 PHI 28 28 A 41 THR N A 41 THR CA A 41 THR C A 42 CYS N 1.0 117.71 157.71 PSI 29 29 A 41 THR C A 42 CYS N A 42 CYS CA A 42 CYS C 1.0 -160.11 -90.55 PHI 30 30 A 42 CYS N A 42 CYS CA A 42 CYS C A 43 ASN N 1.0 113.08 151.12 PSI 31 31 A 45 GLN C A 46 THR N A 46 THR CA A 46 THR C 1.0 -145.70 -117.52 PHI 32 32 A 46 THR N A 46 THR CA A 46 THR C A 47 LYS N 1.0 125.75 163.03 PSI 33 33 A 46 THR C A 47 LYS N A 47 LYS CA A 47 LYS C 1.0 -148.69 -112.49 PHI 34 34 A 47 LYS N A 47 LYS CA A 47 LYS C A 48 LYS N 1.0 131.03 163.95 PSI 35 35 A 47 LYS C A 48 LYS N A 48 LYS CA A 48 LYS C 1.0 -126.92 -80.46 PHI 36 36 A 48 LYS N A 48 LYS CA A 48 LYS C A 49 THR N 1.0 128.49 151.03 PSI 37 37 A 48 LYS C A 49 THR N A 49 THR CA A 49 THR C 1.0 -137.48 -111.32 PHI 38 38 A 49 THR N A 49 THR CA A 49 THR C A 50 LYS N 1.0 130.74 168.18 PSI 39 39 A 50 LYS C A 51 CYS N A 51 CYS CA A 51 CYS C 1.0 -147.86 -132.66 PHI 40 40 A 51 CYS N A 51 CYS CA A 51 CYS C A 52 LYS N 1.0 149.07 171.09 PSI 41 41 A 51 CYS C A 52 LYS N A 52 LYS CA A 52 LYS C 1.0 -144.73 -94.03 PHI 42 42 A 52 LYS N A 52 LYS CA A 52 LYS C A 53 VAL N 1.0 126.99 145.33 PSI 43 43 A 52 LYS C A 53 VAL N A 53 VAL CA A 53 VAL C 1.0 -129.58 -90.44 PHI 44 44 A 53 VAL N A 53 VAL CA A 53 VAL C A 54 PRO N 1.0 91.27 151.63 PSI 45 45 A 54 PRO C A 55 CYS N A 55 CYS CA A 55 CYS C 1.0 -143.02 -103.34 PHI 46 46 A 55 CYS N A 55 CYS CA A 55 CYS C A 56 ASN N 1.0 123.17 169.75 PSI 47 47 A 62 GLY C A 63 ALA N A 63 ALA CA A 63 ALA C 1.0 -93.16 -60.98 PHI 48 48 A 63 ALA N A 63 ALA CA A 63 ALA C A 64 ASP N 1.0 -47.66 9.94 PSI 49 49 A 64 ASP C A 65 CYS N A 65 CYS CA A 65 CYS C 1.0 -153.76 -115.70 PHI 50 50 A 65 CYS N A 65 CYS CA A 65 CYS C A 66 LYS N 1.0 143.44 157.34 PSI 51 51 A 65 CYS C A 66 LYS N A 66 LYS CA A 66 LYS C 1.0 -121.59 -81.05 PHI 52 52 A 66 LYS N A 66 LYS CA A 66 LYS C A 67 TYR N 1.0 118.84 138.58 PSI 53 53 A 66 LYS C A 67 TYR N A 67 TYR CA A 67 TYR C 1.0 -144.29 -85.25 PHI 54 54 A 67 TYR N A 67 TYR CA A 67 TYR C A 68 LYS N 1.0 131.55 167.69 PSI 55 55 A 67 TYR C A 68 LYS N A 68 LYS CA A 68 LYS C 1.0 -133.49 -88.83 PHI 56 56 A 68 LYS N A 68 LYS CA A 68 LYS C A 69 PHE N 1.0 109.99 138.03 PSI 57 57 A 68 LYS C A 69 PHE N A 69 PHE CA A 69 PHE C 1.0 -123.93 -86.59 PHI 58 58 A 69 PHE N A 69 PHE CA A 69 PHE C A 70 GLY N 1.0 132.67 156.85 PSI 59 59 A 73 ALA C A 74 GLU N A 74 GLU CA A 74 GLU C 1.0 -146.19 -64.67 PHI 60 60 A 74 GLU N A 74 GLU CA A 74 GLU C A 75 CYS N 1.0 133.32 174.00 PSI 61 61 A 75 CYS C A 76 ASP N A 76 ASP CA A 76 ASP C 1.0 -100.67 -71.47 PHI 62 62 A 76 ASP N A 76 ASP CA A 76 ASP C A 77 THR N 1.0 100.58 135.88 PSI 63 63 A 76 ASP C A 77 THR N A 77 THR CA A 77 THR C 1.0 -70.39 -57.55 PHI 64 64 A 77 THR N A 77 THR CA A 77 THR C A 78 THR N 1.0 -34.45 -10.79 PSI 65 65 A 80 GLY C A 81 THR N A 81 THR CA A 81 THR C 1.0 -154.93 -119.91 PHI 66 66 A 81 THR N A 81 THR CA A 81 THR C A 82 ARG N 1.0 155.70 178.86 PSI 67 67 A 81 THR C A 82 ARG N A 82 ARG CA A 82 ARG C 1.0 -148.08 -107.52 PHI 68 68 A 82 ARG N A 82 ARG CA A 82 ARG C A 83 SER N 1.0 125.29 167.69 PSI 69 69 A 82 ARG C A 83 SER N A 83 SER CA A 83 SER C 1.0 -158.51 -109.53 PHI 70 70 A 83 SER N A 83 SER CA A 83 SER C A 84 ARG N 1.0 131.03 157.23 PSI 71 71 A 83 SER C A 84 ARG N A 84 ARG CA A 84 ARG C 1.0 -166.60 -123.42 PHI 72 72 A 84 ARG N A 84 ARG CA A 84 ARG C A 85 SER N 1.0 144.70 164.90 PSI 73 73 A 84 ARG C A 85 SER N A 85 SER CA A 85 SER C 1.0 -134.41 -86.21 PHI 74 74 A 85 SER N A 85 SER CA A 85 SER C A 86 GLY N 1.0 127.24 150.46 PSI 75 75 A 86 GLY C A 87 THR N A 87 THR CA A 87 THR C 1.0 -142.77 -100.29 PHI 76 76 A 87 THR N A 87 THR CA A 87 THR C A 88 LEU N 1.0 125.83 150.75 PSI 77 77 A 87 THR C A 88 LEU N A 88 LEU CA A 88 LEU C 1.0 -98.90 -57.18 PHI 78 78 A 88 LEU N A 88 LEU CA A 88 LEU C A 89 LYS N 1.0 126.55 141.71 PSI 79 79 A 89 LYS C A 90 LYS N A 90 LYS CA A 90 LYS C 1.0 -158.46 -81.50 PHI 80 80 A 90 LYS N A 90 LYS CA A 90 LYS C A 91 ALA N 1.0 125.99 159.47 PSI 81 81 A 96 GLU C A 97 CYS N A 97 CYS CA A 97 CYS C 1.0 -153.45 -102.77 PHI 82 82 A 97 CYS N A 97 CYS CA A 97 CYS C A 98 GLN N 1.0 143.84 164.26 PSI 83 83 A 97 CYS C A 98 GLN N A 98 GLN CA A 98 GLN C 1.0 -102.92 -58.52 PHI 84 84 A 98 GLN N A 98 GLN CA A 98 GLN C A 99 THR N 1.0 120.71 150.55 PSI 85 85 A 100 THR C A 101 ILE N A 101 ILE CA A 101 ILE C 1.0 -155.74 -116.44 PHI 86 86 A 101 ILE N A 101 ILE CA A 101 ILE C A 102 LYS N 1.0 140.19 161.61 PSI 87 87 A 101 ILE C A 102 LYS N A 102 LYS CA A 102 LYS C 1.0 -138.43 -94.27 PHI 88 88 A 102 LYS C A 103 VAL N A 103 VAL CA A 103 VAL C 1.0 -137.31 -111.35 PHI 89 89 A 103 VAL N A 103 VAL CA A 103 VAL C A 104 SER N 1.0 132.41 161.01 PSI 90 90 A 103 VAL C A 104 SER N A 104 SER CA A 104 SER C 1.0 -147.48 -104.32 PHI 91 91 A 104 SER N A 104 SER CA A 104 SER C A 105 LYS N 1.0 125.26 163.28 PSI 92 92 A 104 SER C A 105 LYS N A 105 LYS CA A 105 LYS C 1.0 -149.19 -113.73 PHI 93 93 A 105 LYS N A 105 LYS CA A 105 LYS C A 106 PRO N 1.0 116.16 157.92 PSI 94 94 A 106 PRO C A 107 CYS N A 107 CYS CA A 107 CYS C 1.0 -144.89 -120.53 PHI 95 95 A 107 CYS N A 107 CYS CA A 107 CYS C A 108 THR N 1.0 146.78 159.66 PSI 96 96 A 107 CYS C A 108 THR N A 108 THR CA A 108 THR C 1.0 -107.05 -77.93 PHI 97 97 A 108 THR N A 108 THR CA A 108 THR C A 109 PRO N 1.0 116.57 145.59 PSI 98 98 A 115 LYS C A 116 GLY N A 116 GLY CA A 116 GLY C 1.0 -182.75 200.97 PHI 99 99 A 116 GLY N A 116 GLY CA A 116 GLY C A 117 GLY N 1.0 -216.91 98.33 PSI stop_ save_