data_nef_c27581_6hkc 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 _nef_nmr_meta_data.program_name . _nef_nmr_meta_data.program_version . _nef_nmr_meta_data.creation_date . _nef_nmr_meta_data.uuid . _nef_nmr_meta_data.coordinate_file_name . 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 7 CYS SG 1 58 CYS SG 1 44 CYS SG 1 73 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 PRO middle . false 3 A 3 THR middle . . 4 A 4 SER middle . . 5 A 5 GLU middle . . 6 A 6 GLY middle . false 7 A 7 CYS middle -HG . 8 A 8 GLN middle . . 9 A 9 ILE middle . . 10 A 10 ILE middle . . 11 A 11 HIS middle . . 12 A 12 PRO middle . false 13 A 13 PRO middle . false 14 A 14 TRP middle . . 15 A 15 GLU middle . . 16 A 16 GLY middle . false 17 A 17 GLY middle . false 18 A 18 ILE middle . . 19 A 19 ARG middle . . 20 A 20 TYR middle . . 21 A 21 ARG middle . . 22 A 22 GLY middle . false 23 A 23 LEU middle . . 24 A 24 THR middle . . 25 A 25 ARG middle . . 26 A 26 ASP middle . . 27 A 27 GLN middle . . 28 A 28 VAL middle . . 29 A 29 LYS middle . . 30 A 30 ALA middle . . 31 A 31 ILE middle . . 32 A 32 ASN middle . . 33 A 33 PHE middle . . 34 A 34 LEU middle . . 35 A 35 PRO middle . false 36 A 36 VAL middle . . 37 A 37 ASP middle . . 38 A 38 TYR middle . . 39 A 39 GLU middle . . 40 A 40 ILE middle . . 41 A 41 GLU middle . . 42 A 42 TYR middle . . 43 A 43 VAL middle . . 44 A 44 CYS middle -HG . 45 A 45 ARG middle . . 46 A 46 GLY middle . false 47 A 47 GLU middle . . 48 A 48 ARG middle . . 49 A 49 GLU middle . . 50 A 50 VAL middle . . 51 A 51 VAL middle . . 52 A 52 GLY middle . false 53 A 53 PRO middle . false 54 A 54 LYS middle . . 55 A 55 VAL middle . . 56 A 56 ARG middle . . 57 A 57 LYS middle . . 58 A 58 CYS middle -HG . 59 A 59 LEU middle . . 60 A 60 ALA middle . . 61 A 61 ASN middle . . 62 A 62 GLY middle . false 63 A 63 SER middle . . 64 A 64 TRP middle . . 65 A 65 THR middle . . 66 A 66 ASP middle . . 67 A 67 MET middle . . 68 A 68 ASP middle . . 69 A 69 THR middle . . 70 A 70 PRO middle . false 71 A 71 SER middle . . 72 A 72 ARG middle . . 73 A 73 CYS middle -HG . 74 A 74 VAL middle . . 75 A 75 ARG end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 GLY HA2 H 1 3.91047 0.04 A 1 GLY HA3 H 1 3.91047 0.04 A 1 GLY CA C 13 43.30735 0.4 A 2 PRO HA H 1 4.45398 0.04 A 2 PRO HBx H 1 1.89418 0.04 A 2 PRO HBy H 1 2.23336 0.04 A 2 PRO HDx H 1 3.47532 0.04 A 2 PRO HDy H 1 3.51855 0.04 A 2 PRO HG2 H 1 1.93417 0.04 A 2 PRO HG3 H 1 1.93417 0.04 A 2 PRO C C 13 177.02649 0.4 A 2 PRO CA C 13 63.16974 0.4 A 2 PRO CB C 13 32.2644 0.4 A 2 PRO CD C 13 49.60704 0.4 A 2 PRO CG C 13 26.97635 0.4 A 3 THR H H 1 8.24344 0.04 A 3 THR HA H 1 4.2682 0.04 A 3 THR HB H 1 4.11491 0.04 A 3 THR HG2% H 1 1.11006 0.04 A 3 THR C C 13 174.22451 0.4 A 3 THR CA C 13 61.75331 0.4 A 3 THR CB C 13 69.77046 0.4 A 3 THR CG2 C 13 21.56773 0.4 A 3 THR N N 15 114.29711 0.2 A 4 SER H H 1 8.09244 0.04 A 4 SER HA H 1 4.25407 0.04 A 4 SER HBx H 1 3.50818 0.04 A 4 SER HBy H 1 3.56734 0.04 A 4 SER C C 13 173.90722 0.4 A 4 SER CA C 13 57.96412 0.4 A 4 SER CB C 13 63.85548 0.4 A 4 SER N N 15 117.59769 0.2 A 5 GLU H H 1 8.11644 0.04 A 5 GLU HA H 1 3.98073 0.04 A 5 GLU HBy H 1 1.53465 0.04 A 5 GLU HBx H 1 1.38094 0.04 A 5 GLU HG2 H 1 1.87667 0.04 A 5 GLU HG3 H 1 1.87667 0.04 A 5 GLU C C 13 175.3232 0.4 A 5 GLU CA C 13 56.37059 0.4 A 5 GLU CB C 13 30.18628 0.4 A 5 GLU CG C 13 35.78177 0.4 A 5 GLU N N 15 122.54259 0.2 A 6 GLY H H 1 7.6368 0.04 A 6 GLY HAx H 1 3.46944 0.04 A 6 GLY HAy H 1 4.56265 0.04 A 6 GLY C C 13 172.90304 0.4 A 6 GLY CA C 13 44.48558 0.4 A 6 GLY N N 15 107.17088 0.2 A 7 CYS H H 1 8.87248 0.04 A 7 CYS HA H 1 4.78397 0.04 A 7 CYS HBx H 1 1.6406 0.04 A 7 CYS HBy H 1 2.08417 0.04 A 7 CYS C C 13 174.64218 0.4 A 7 CYS CA C 13 56.70848 0.4 A 7 CYS CB C 13 42.35938 0.4 A 7 CYS N N 15 116.70167 0.2 A 8 GLN H H 1 9.03515 0.04 A 8 GLN HA H 1 4.19912 0.04 A 8 GLN HBx H 1 1.99351 0.04 A 8 GLN HBy H 1 2.09198 0.04 A 8 GLN HE2y H 1 7.4855 0.04 A 8 GLN HE2x H 1 6.84592 0.04 A 8 GLN HGx H 1 2.35878 0.04 A 8 GLN HGy H 1 2.38714 0.04 A 8 GLN C C 13 175.97592 0.4 A 8 GLN CA C 13 56.34641 0.4 A 8 GLN CB C 13 29.57095 0.4 A 8 GLN CG C 13 34.43017 0.4 A 8 GLN N N 15 123.20478 0.2 A 8 GLN NE2 N 15 112.2548 0.2 A 9 ILE H H 1 7.77247 0.04 A 9 ILE HA H 1 3.8846 0.04 A 9 ILE HB H 1 1.48096 0.04 A 9 ILE HD1% H 1 0.56437 0.04 A 9 ILE HG1x H 1 1.04689 0.04 A 9 ILE HG1y H 1 1.33448 0.04 A 9 ILE HG2% H 1 0.71879 0.04 A 9 ILE C C 13 174.75129 0.4 A 9 ILE CA C 13 62.90831 0.4 A 9 ILE CB C 13 39.13094 0.4 A 9 ILE CD1 C 13 14.13396 0.4 A 9 ILE CG1 C 13 28.39694 0.4 A 9 ILE CG2 C 13 17.5631 0.4 A 9 ILE N N 15 120.84766 0.2 A 10 ILE H H 1 7.24916 0.04 A 10 ILE HA H 1 4.12526 0.04 A 10 ILE HB H 1 1.20255 0.04 A 10 ILE HD1% H 1 -0.17606 0.04 A 10 ILE HG1x H 1 0.4857 0.04 A 10 ILE HG1y H 1 0.90721 0.04 A 10 ILE HG2% H 1 0.6305 0.04 A 10 ILE C C 13 175.48269 0.4 A 10 ILE CA C 13 59.74509 0.4 A 10 ILE CB C 13 39.8799 0.4 A 10 ILE CD1 C 13 11.91001 0.4 A 10 ILE CG1 C 13 26.60657 0.4 A 10 ILE CG2 C 13 17.43646 0.4 A 10 ILE N N 15 123.41785 0.2 A 11 HIS H H 1 8.59824 0.04 A 11 HIS HA H 1 4.0123 0.04 A 11 HIS HBy H 1 2.92781 0.04 A 11 HIS HBx H 1 2.90811 0.04 A 11 HIS HD2 H 1 7.13429 0.04 A 11 HIS C C 13 172.45671 0.4 A 11 HIS CA C 13 53.67218 0.4 A 11 HIS CB C 13 27.99209 0.4 A 11 HIS CD2 C 13 119.48312 0.4 A 11 HIS N N 15 124.03055 0.2 A 12 PRO HA H 1 4.50038 0.04 A 12 PRO HBx H 1 2.08031 0.04 A 12 PRO HBy H 1 2.31876 0.04 A 12 PRO HDy H 1 3.55135 0.04 A 12 PRO HDx H 1 3.48487 0.04 A 12 PRO HGx H 1 1.7603 0.04 A 12 PRO HGy H 1 1.88459 0.04 A 12 PRO CA C 13 62.49757 0.4 A 12 PRO CB C 13 34.66603 0.4 A 12 PRO CD C 13 50.27055 0.4 A 12 PRO CG C 13 24.6932 0.4 A 13 PRO HA H 1 4.5757 0.04 A 13 PRO HBx H 1 1.94233 0.04 A 13 PRO HBy H 1 2.32204 0.04 A 13 PRO HDx H 1 3.21249 0.04 A 13 PRO HDy H 1 3.61853 0.04 A 13 PRO HGy H 1 1.87893 0.04 A 13 PRO HGx H 1 1.7596 0.04 A 13 PRO C C 13 175.76623 0.4 A 13 PRO CA C 13 61.92288 0.4 A 13 PRO CB C 13 32.10195 0.4 A 13 PRO CD C 13 50.20909 0.4 A 13 PRO CG C 13 26.94585 0.4 A 14 TRP H H 1 8.37436 0.04 A 14 TRP HA H 1 4.26453 0.04 A 14 TRP HBx H 1 3.07125 0.04 A 14 TRP HBy H 1 3.24352 0.04 A 14 TRP HD1 H 1 7.15595 0.04 A 14 TRP HE1 H 1 10.088 0.04 A 14 TRP HE3 H 1 7.59613 0.04 A 14 TRP HH2 H 1 7.1715 0.04 A 14 TRP HZ2 H 1 7.42724 0.04 A 14 TRP HZ3 H 1 7.10036 0.04 A 14 TRP CA C 13 59.49312 0.4 A 14 TRP CB C 13 28.98513 0.4 A 14 TRP CD1 C 13 127.10708 0.4 A 14 TRP CE3 C 13 120.74324 0.4 A 14 TRP CH2 C 13 124.75186 0.4 A 14 TRP CZ2 C 13 114.83121 0.4 A 14 TRP CZ3 C 13 122.03248 0.4 A 14 TRP N N 15 121.81456 0.2 A 14 TRP NE1 N 15 129.4812 0.2 A 15 GLU H H 1 8.42666 0.04 A 15 GLU HA H 1 3.73728 0.04 A 15 GLU HBx H 1 1.7163 0.04 A 15 GLU HBy H 1 2.02322 0.04 A 15 GLU HGx H 1 1.3297 0.04 A 15 GLU HGy H 1 1.613 0.04 A 15 GLU C C 13 174.672 0.4 A 15 GLU CA C 13 57.14844 0.4 A 15 GLU CB C 13 26.7034 0.4 A 15 GLU CG C 13 34.98854 0.4 A 15 GLU N N 15 117.90766 0.2 A 16 GLY H H 1 7.85933 0.04 A 16 GLY HAx H 1 4.25001 0.04 A 16 GLY HAy H 1 4.88819 0.04 A 16 GLY C C 13 171.94744 0.4 A 16 GLY CA C 13 46.18793 0.4 A 16 GLY N N 15 104.82638 0.2 A 17 GLY H H 1 8.98291 0.04 A 17 GLY HAx H 1 2.63142 0.04 A 17 GLY HAy H 1 4.80388 0.04 A 17 GLY C C 13 170.82528 0.4 A 17 GLY CA C 13 45.02823 0.4 A 17 GLY N N 15 109.04737 0.2 A 18 ILE H H 1 7.95233 0.04 A 18 ILE HA H 1 4.26933 0.04 A 18 ILE HB H 1 1.20575 0.04 A 18 ILE HD1% H 1 0.16407 0.04 A 18 ILE HG1x H 1 0.02625 0.04 A 18 ILE HG1y H 1 0.93863 0.04 A 18 ILE HG2% H 1 -0.18963 0.04 A 18 ILE C C 13 173.79974 0.4 A 18 ILE CA C 13 59.59302 0.4 A 18 ILE CB C 13 41.74241 0.4 A 18 ILE CD1 C 13 13.91632 0.4 A 18 ILE CG1 C 13 28.16714 0.4 A 18 ILE CG2 C 13 18.57063 0.4 A 18 ILE N N 15 117.98894 0.2 A 19 ARG H H 1 9.25823 0.04 A 19 ARG HA H 1 4.41049 0.04 A 19 ARG HBy H 1 1.60947 0.04 A 19 ARG HBx H 1 1.19869 0.04 A 19 ARG HDx H 1 2.82385 0.04 A 19 ARG HDy H 1 3.15873 0.04 A 19 ARG HGx H 1 1.03585 0.04 A 19 ARG HGy H 1 1.28681 0.04 A 19 ARG C C 13 175.3523 0.4 A 19 ARG CA C 13 55.49035 0.4 A 19 ARG CB C 13 31.61361 0.4 A 19 ARG CD C 13 42.96392 0.4 A 19 ARG CG C 13 27.31422 0.4 A 19 ARG N N 15 127.54848 0.2 A 20 TYR H H 1 8.80605 0.04 A 20 TYR HA H 1 4.79303 0.04 A 20 TYR HBx H 1 2.73936 0.04 A 20 TYR HBy H 1 2.97298 0.04 A 20 TYR HDx H 1 7.09094 0.04 A 20 TYR HDy H 1 7.09094 0.04 A 20 TYR HEx H 1 6.54106 0.04 A 20 TYR HEy H 1 6.54106 0.04 A 20 TYR C C 13 175.02386 0.4 A 20 TYR CA C 13 57.85785 0.4 A 20 TYR CB C 13 38.74049 0.4 A 20 TYR CDx C 13 133.23031 0.4 A 20 TYR CDy C 13 133.23031 0.4 A 20 TYR CEx C 13 117.91887 0.4 A 20 TYR CEy C 13 117.91887 0.4 A 20 TYR N N 15 113.03679 0.2 A 21 ARG H H 1 8.31524 0.04 A 21 ARG HA H 1 4.13272 0.04 A 21 ARG HB2 H 1 1.64773 0.04 A 21 ARG HB3 H 1 1.64773 0.04 A 21 ARG HD2 H 1 3.08895 0.04 A 21 ARG HD3 H 1 3.08895 0.04 A 21 ARG HGx H 1 1.50947 0.04 A 21 ARG HGy H 1 1.53748 0.04 A 21 ARG C C 13 179.70956 0.4 A 21 ARG CA C 13 58.13381 0.4 A 21 ARG CB C 13 30.22966 0.4 A 21 ARG CD C 13 43.30842 0.4 A 21 ARG CG C 13 27.93451 0.4 A 21 ARG N N 15 119.65474 0.2 A 22 GLY H H 1 9.51458 0.04 A 22 GLY HAx H 1 3.71182 0.04 A 22 GLY HAy H 1 4.1994 0.04 A 22 GLY C C 13 173.08559 0.4 A 22 GLY CA C 13 45.4362 0.4 A 22 GLY N N 15 113.56334 0.2 A 23 LEU H H 1 7.86372 0.04 A 23 LEU HA H 1 4.92463 0.04 A 23 LEU HBx H 1 1.24647 0.04 A 23 LEU HBy H 1 1.65472 0.04 A 23 LEU HDx% H 1 0.62685 0.04 A 23 LEU HDy% H 1 0.69831 0.04 A 23 LEU HG H 1 1.5008 0.04 A 23 LEU C C 13 176.76945 0.4 A 23 LEU CA C 13 53.46812 0.4 A 23 LEU CB C 13 45.50538 0.4 A 23 LEU CDx C 13 23.75481 0.4 A 23 LEU CDy C 13 26.0109 0.4 A 23 LEU CG C 13 27.18555 0.4 A 23 LEU N N 15 120.82676 0.2 A 24 THR H H 1 8.29725 0.04 A 24 THR HA H 1 4.56409 0.04 A 24 THR HB H 1 4.57833 0.04 A 24 THR HG2% H 1 1.16595 0.04 A 24 THR C C 13 175.83099 0.4 A 24 THR CA C 13 60.01229 0.4 A 24 THR CB C 13 71.20738 0.4 A 24 THR CG2 C 13 21.68858 0.4 A 24 THR N N 15 111.12183 0.2 A 25 ARG H H 1 8.6996 0.04 A 25 ARG HA H 1 3.68333 0.04 A 25 ARG HB2 H 1 1.6604 0.04 A 25 ARG HB3 H 1 1.6604 0.04 A 25 ARG HDx H 1 3.05854 0.04 A 25 ARG HDy H 1 3.11874 0.04 A 25 ARG HG2 H 1 1.33561 0.04 A 25 ARG HG3 H 1 1.33561 0.04 A 25 ARG C C 13 177.81976 0.4 A 25 ARG CA C 13 59.56241 0.4 A 25 ARG CB C 13 29.6542 0.4 A 25 ARG CD C 13 43.24822 0.4 A 25 ARG CG C 13 27.09244 0.4 A 25 ARG N N 15 120.86741 0.2 A 26 ASP H H 1 8.04173 0.04 A 26 ASP HA H 1 4.14751 0.04 A 26 ASP HBx H 1 2.34769 0.04 A 26 ASP HBy H 1 2.47079 0.04 A 26 ASP C C 13 178.7239 0.4 A 26 ASP CA C 13 56.86083 0.4 A 26 ASP CB C 13 40.24784 0.4 A 26 ASP N N 15 115.74396 0.2 A 27 GLN H H 1 7.52583 0.04 A 27 GLN HA H 1 3.90392 0.04 A 27 GLN HBx H 1 1.8067 0.04 A 27 GLN HBy H 1 2.23075 0.04 A 27 GLN HE2y H 1 7.39312 0.04 A 27 GLN HE2x H 1 6.71665 0.04 A 27 GLN HGx H 1 2.21084 0.04 A 27 GLN HGy H 1 2.32135 0.04 A 27 GLN C C 13 178.97998 0.4 A 27 GLN CA C 13 58.54177 0.4 A 27 GLN CB C 13 29.4984 0.4 A 27 GLN CG C 13 34.65656 0.4 A 27 GLN N N 15 119.34415 0.2 A 27 GLN NE2 N 15 110.65087 0.2 A 28 VAL H H 1 7.9337 0.04 A 28 VAL HA H 1 3.17483 0.04 A 28 VAL HB H 1 1.56702 0.04 A 28 VAL HGx% H 1 0.13889 0.04 A 28 VAL HGy% H 1 0.38715 0.04 A 28 VAL C C 13 176.46653 0.4 A 28 VAL CA C 13 65.75937 0.4 A 28 VAL CB C 13 31.23631 0.4 A 28 VAL CGy C 13 23.26389 0.4 A 28 VAL CGx C 13 21.06608 0.4 A 28 VAL N N 15 119.17716 0.2 A 29 LYS H H 1 7.08247 0.04 A 29 LYS HA H 1 3.58156 0.04 A 29 LYS HBx H 1 1.50487 0.04 A 29 LYS HBy H 1 1.60307 0.04 A 29 LYS HD2 H 1 1.37609 0.04 A 29 LYS HD3 H 1 1.37609 0.04 A 29 LYS HEx H 1 2.62984 0.04 A 29 LYS HEy H 1 2.66891 0.04 A 29 LYS HGy H 1 1.10225 0.04 A 29 LYS HGx H 1 0.93226 0.04 A 29 LYS C C 13 176.82998 0.4 A 29 LYS CA C 13 58.16448 0.4 A 29 LYS CB C 13 32.25213 0.4 A 29 LYS CD C 13 29.28523 0.4 A 29 LYS CE C 13 41.7477 0.4 A 29 LYS CG C 13 24.99983 0.4 A 29 LYS N N 15 115.40078 0.2 A 30 ALA H H 1 7.01752 0.04 A 30 ALA HA H 1 4.29018 0.04 A 30 ALA HB% H 1 1.29675 0.04 A 30 ALA C C 13 177.55071 0.4 A 30 ALA CA C 13 52.00341 0.4 A 30 ALA CB C 13 20.07177 0.4 A 30 ALA N N 15 118.80889 0.2 A 31 ILE H H 1 7.24362 0.04 A 31 ILE HA H 1 4.06738 0.04 A 31 ILE HB H 1 1.7488 0.04 A 31 ILE HD1% H 1 0.59875 0.04 A 31 ILE HG1x H 1 1.18486 0.04 A 31 ILE HG1y H 1 1.33897 0.04 A 31 ILE HG2% H 1 0.69755 0.04 A 31 ILE CA C 13 62.12365 0.4 A 31 ILE CB C 13 39.65982 0.4 A 31 ILE CD1 C 13 14.13396 0.4 A 31 ILE CG1 C 13 27.36637 0.4 A 31 ILE CG2 C 13 17.51759 0.4 A 31 ILE N N 15 118.01637 0.2 A 32 ASN H H 1 8.37383 0.04 A 32 ASN HBx H 1 2.52567 0.04 A 32 ASN HBy H 1 2.57833 0.04 A 32 ASN HD2y H 1 7.23741 0.04 A 32 ASN HD2x H 1 6.79199 0.04 A 32 ASN CB C 13 40.45533 0.4 A 32 ASN N N 15 118.50332 0.2 A 32 ASN ND2 N 15 112.79272 0.2 A 33 PHE HA H 1 4.87855 0.04 A 33 PHE HBy H 1 2.72683 0.04 A 33 PHE HBx H 1 2.54739 0.04 A 33 PHE HDx H 1 6.82357 0.04 A 33 PHE HDy H 1 6.82357 0.04 A 33 PHE HEx H 1 7.18312 0.04 A 33 PHE HEy H 1 7.18312 0.04 A 33 PHE C C 13 173.70902 0.4 A 33 PHE CA C 13 56.44137 0.4 A 33 PHE CB C 13 42.38188 0.4 A 33 PHE CDx C 13 131.92516 0.4 A 33 PHE CDy C 13 131.92516 0.4 A 33 PHE CEx C 13 131.05536 0.4 A 33 PHE CEy C 13 131.05536 0.4 A 34 LEU H H 1 9.16144 0.04 A 34 LEU HA H 1 4.58394 0.04 A 34 LEU HBx H 1 1.32288 0.04 A 34 LEU HBy H 1 1.62894 0.04 A 34 LEU HDx% H 1 0.60679 0.04 A 34 LEU HDy% H 1 0.69017 0.04 A 34 LEU HG H 1 1.75247 0.04 A 34 LEU C C 13 173.29783 0.4 A 34 LEU CA C 13 49.90213 0.4 A 34 LEU CB C 13 40.98198 0.4 A 34 LEU CDx C 13 23.86083 0.4 A 34 LEU CDy C 13 23.97906 0.4 A 34 LEU CG C 13 28.78634 0.4 A 34 LEU N N 15 125.17689 0.2 A 35 PRO HA H 1 4.44934 0.04 A 35 PRO HBx H 1 1.91174 0.04 A 35 PRO HBy H 1 2.20722 0.04 A 35 PRO HDx H 1 3.12818 0.04 A 35 PRO HDy H 1 3.51764 0.04 A 35 PRO HG2 H 1 1.99542 0.04 A 35 PRO HG3 H 1 1.99542 0.04 A 35 PRO C C 13 176.03215 0.4 A 35 PRO CA C 13 62.02711 0.4 A 35 PRO CB C 13 32.55375 0.4 A 35 PRO CD C 13 49.69963 0.4 A 35 PRO CG C 13 27.34942 0.4 A 36 VAL H H 1 7.8867 0.04 A 36 VAL HA H 1 3.16284 0.04 A 36 VAL HB H 1 1.68838 0.04 A 36 VAL HGx% H 1 0.76334 0.04 A 36 VAL HGy% H 1 0.81906 0.04 A 36 VAL C C 13 176.91559 0.4 A 36 VAL CA C 13 65.07682 0.4 A 36 VAL CB C 13 31.36939 0.4 A 36 VAL CGy C 13 23.04456 0.4 A 36 VAL CGx C 13 20.70832 0.4 A 36 VAL N N 15 118.96087 0.2 A 37 ASP H H 1 8.7943 0.04 A 37 ASP HA H 1 4.03947 0.04 A 37 ASP HBx H 1 2.74239 0.04 A 37 ASP HBy H 1 3.35412 0.04 A 37 ASP C C 13 174.96445 0.4 A 37 ASP CA C 13 57.65842 0.4 A 37 ASP CB C 13 39.2582 0.4 A 37 ASP N N 15 119.15979 0.2 A 38 TYR H H 1 8.19334 0.04 A 38 TYR HA H 1 3.99703 0.04 A 38 TYR HBx H 1 2.80362 0.04 A 38 TYR HBy H 1 3.16817 0.04 A 38 TYR HDx H 1 7.08223 0.04 A 38 TYR HDy H 1 7.08223 0.04 A 38 TYR HEx H 1 6.88564 0.04 A 38 TYR HEy H 1 6.88564 0.04 A 38 TYR C C 13 174.24631 0.4 A 38 TYR CA C 13 61.05148 0.4 A 38 TYR CB C 13 40.27639 0.4 A 38 TYR CDx C 13 133.19298 0.4 A 38 TYR CDy C 13 133.19298 0.4 A 38 TYR CEx C 13 119.15085 0.4 A 38 TYR CEy C 13 119.15085 0.4 A 38 TYR N N 15 123.7178 0.2 A 39 GLU H H 1 7.26636 0.04 A 39 GLU HA H 1 5.63699 0.04 A 39 GLU HBx H 1 1.63303 0.04 A 39 GLU HBy H 1 1.75649 0.04 A 39 GLU HGx H 1 1.89233 0.04 A 39 GLU HGy H 1 2.20015 0.04 A 39 GLU C C 13 175.46514 0.4 A 39 GLU CA C 13 54.36049 0.4 A 39 GLU CB C 13 33.27262 0.4 A 39 GLU CG C 13 36.82695 0.4 A 39 GLU N N 15 124.83671 0.2 A 40 ILE H H 1 8.56435 0.04 A 40 ILE HA H 1 4.23449 0.04 A 40 ILE HB H 1 1.04632 0.04 A 40 ILE HD1% H 1 -0.31561 0.04 A 40 ILE HG1x H 1 0.46721 0.04 A 40 ILE HG1y H 1 0.81306 0.04 A 40 ILE HG2% H 1 0.5407 0.04 A 40 ILE C C 13 173.62508 0.4 A 40 ILE CA C 13 59.40417 0.4 A 40 ILE CB C 13 40.38699 0.4 A 40 ILE CD1 C 13 13.76758 0.4 A 40 ILE CG1 C 13 24.69829 0.4 A 40 ILE CG2 C 13 20.28234 0.4 A 40 ILE N N 15 115.3952 0.2 A 41 GLU H H 1 6.67181 0.04 A 41 GLU HA H 1 5.2289 0.04 A 41 GLU HBx H 1 1.75868 0.04 A 41 GLU HBy H 1 1.797 0.04 A 41 GLU HGx H 1 2.06778 0.04 A 41 GLU HGy H 1 2.13986 0.04 A 41 GLU C C 13 174.50948 0.4 A 41 GLU CA C 13 53.58354 0.4 A 41 GLU CB C 13 34.03365 0.4 A 41 GLU CG C 13 35.57841 0.4 A 41 GLU N N 15 117.94601 0.2 A 42 TYR H H 1 8.68121 0.04 A 42 TYR HA H 1 4.62428 0.04 A 42 TYR HBx H 1 2.63993 0.04 A 42 TYR HBy H 1 2.68293 0.04 A 42 TYR HDx H 1 6.75802 0.04 A 42 TYR HDy H 1 6.75802 0.04 A 42 TYR HEx H 1 6.27295 0.04 A 42 TYR HEy H 1 6.27295 0.04 A 42 TYR C C 13 174.79021 0.4 A 42 TYR CA C 13 58.74686 0.4 A 42 TYR CB C 13 41.02481 0.4 A 42 TYR CDx C 13 132.65676 0.4 A 42 TYR CDy C 13 132.65676 0.4 A 42 TYR CEx C 13 117.06549 0.4 A 42 TYR CEy C 13 117.06549 0.4 A 42 TYR N N 15 124.13422 0.2 A 43 VAL H H 1 8.23804 0.04 A 43 VAL HA H 1 4.35953 0.04 A 43 VAL HB H 1 1.80325 0.04 A 43 VAL HGx% H 1 0.21851 0.04 A 43 VAL HGy% H 1 0.67071 0.04 A 43 VAL C C 13 174.39459 0.4 A 43 VAL CA C 13 59.67114 0.4 A 43 VAL CB C 13 35.45759 0.4 A 43 VAL CGx C 13 19.94779 0.4 A 43 VAL CGy C 13 21.8421 0.4 A 43 VAL N N 15 115.96081 0.2 A 44 CYS H H 1 8.74243 0.04 A 44 CYS HA H 1 5.50026 0.04 A 44 CYS HBx H 1 2.59381 0.04 A 44 CYS HBy H 1 2.97725 0.04 A 44 CYS C C 13 174.53795 0.4 A 44 CYS CA C 13 53.24521 0.4 A 44 CYS CB C 13 42.86205 0.4 A 44 CYS N N 15 118.0203 0.2 A 45 ARG H H 1 8.62869 0.04 A 45 ARG HA H 1 4.17936 0.04 A 45 ARG HBx H 1 1.52351 0.04 A 45 ARG HBy H 1 1.57736 0.04 A 45 ARG HDx H 1 2.37771 0.04 A 45 ARG HDy H 1 2.53925 0.04 A 45 ARG HGx H 1 1.14816 0.04 A 45 ARG HGy H 1 1.24457 0.04 A 45 ARG C C 13 177.77169 0.4 A 45 ARG CA C 13 56.03414 0.4 A 45 ARG CB C 13 31.26947 0.4 A 45 ARG CD C 13 42.92252 0.4 A 45 ARG CG C 13 27.32611 0.4 A 45 ARG N N 15 120.67973 0.2 A 46 GLY H H 1 8.63406 0.04 A 46 GLY HA2 H 1 3.70697 0.04 A 46 GLY HA3 H 1 3.70697 0.04 A 46 GLY C C 13 174.57999 0.4 A 46 GLY CA C 13 46.66237 0.4 A 46 GLY N N 15 110.04421 0.2 A 47 GLU H H 1 8.69278 0.04 A 47 GLU HA H 1 4.16762 0.04 A 47 GLU HBy H 1 2.15662 0.04 A 47 GLU HBx H 1 1.93148 0.04 A 47 GLU HG2 H 1 2.16476 0.04 A 47 GLU HG3 H 1 2.16476 0.04 A 47 GLU C C 13 176.09439 0.4 A 47 GLU CA C 13 56.34145 0.4 A 47 GLU CB C 13 28.03853 0.4 A 47 GLU CG C 13 36.31744 0.4 A 47 GLU N N 15 119.61446 0.2 A 48 ARG H H 1 7.15396 0.04 A 48 ARG HA H 1 4.26444 0.04 A 48 ARG HBx H 1 1.5912 0.04 A 48 ARG HBy H 1 1.6518 0.04 A 48 ARG HDx H 1 2.94984 0.04 A 48 ARG HDy H 1 3.10718 0.04 A 48 ARG HGx H 1 1.39432 0.04 A 48 ARG HGy H 1 1.6593 0.04 A 48 ARG C C 13 174.68609 0.4 A 48 ARG CA C 13 56.11732 0.4 A 48 ARG CB C 13 32.00784 0.4 A 48 ARG CD C 13 43.48663 0.4 A 48 ARG CG C 13 28.83897 0.4 A 48 ARG N N 15 118.50507 0.2 A 49 GLU H H 1 8.49638 0.04 A 49 GLU HA H 1 4.43807 0.04 A 49 GLU HBx H 1 1.78788 0.04 A 49 GLU HBy H 1 1.90686 0.04 A 49 GLU HG2 H 1 2.21683 0.04 A 49 GLU HG3 H 1 2.21683 0.04 A 49 GLU C C 13 175.28949 0.4 A 49 GLU CA C 13 54.52932 0.4 A 49 GLU CB C 13 32.17789 0.4 A 49 GLU CG C 13 35.47442 0.4 A 49 GLU N N 15 119.93526 0.2 A 50 VAL H H 1 8.39006 0.04 A 50 VAL HA H 1 4.11526 0.04 A 50 VAL HB H 1 1.77758 0.04 A 50 VAL HGx% H 1 0.47545 0.04 A 50 VAL HGy% H 1 0.82855 0.04 A 50 VAL C C 13 176.55597 0.4 A 50 VAL CA C 13 62.97966 0.4 A 50 VAL CB C 13 32.65852 0.4 A 50 VAL CGx C 13 21.64964 0.4 A 50 VAL CGy C 13 22.97321 0.4 A 50 VAL N N 15 122.82996 0.2 A 51 VAL H H 1 9.00419 0.04 A 51 VAL HA H 1 4.13926 0.04 A 51 VAL HB H 1 1.73098 0.04 A 51 VAL HGx% H 1 0.80853 0.04 A 51 VAL HGy% H 1 0.80853 0.04 A 51 VAL C C 13 175.47223 0.4 A 51 VAL CA C 13 62.06912 0.4 A 51 VAL CB C 13 33.2115 0.4 A 51 VAL CGx C 13 21.43865 0.4 A 51 VAL CGy C 13 21.43865 0.4 A 51 VAL N N 15 130.06561 0.2 A 52 GLY H H 1 8.04929 0.04 A 52 GLY HAx H 1 3.41548 0.04 A 52 GLY HAy H 1 4.7574 0.04 A 52 GLY C C 13 170.80504 0.4 A 52 GLY CA C 13 43.30367 0.4 A 52 GLY N N 15 114.31554 0.2 A 53 PRO HA H 1 4.08223 0.04 A 53 PRO HBx H 1 1.43873 0.04 A 53 PRO HBy H 1 2.18023 0.04 A 53 PRO HD2 H 1 3.1779 0.04 A 53 PRO HD3 H 1 3.1779 0.04 A 53 PRO HG2 H 1 1.89528 0.04 A 53 PRO HG3 H 1 1.89528 0.04 A 53 PRO C C 13 176.40468 0.4 A 53 PRO CA C 13 63.62271 0.4 A 53 PRO CB C 13 31.73879 0.4 A 53 PRO CD C 13 49.05828 0.4 A 53 PRO CG C 13 27.79406 0.4 A 54 LYS H H 1 8.4309 0.04 A 54 LYS HA H 1 4.16937 0.04 A 54 LYS HBy H 1 1.9556 0.04 A 54 LYS HBx H 1 1.80429 0.04 A 54 LYS HDx H 1 1.69783 0.04 A 54 LYS HDy H 1 1.75515 0.04 A 54 LYS HE2 H 1 3.02589 0.04 A 54 LYS HE3 H 1 3.02589 0.04 A 54 LYS HGx H 1 1.461 0.04 A 54 LYS HGy H 1 1.5909 0.04 A 54 LYS C C 13 175.88399 0.4 A 54 LYS CA C 13 57.89043 0.4 A 54 LYS CB C 13 33.95935 0.4 A 54 LYS CD C 13 29.36416 0.4 A 54 LYS CE C 13 42.4395 0.4 A 54 LYS CG C 13 26.06274 0.4 A 54 LYS N N 15 122.8249 0.2 A 55 VAL H H 1 7.43387 0.04 A 55 VAL HA H 1 5.21788 0.04 A 55 VAL HB H 1 1.90402 0.04 A 55 VAL HGx% H 1 0.80084 0.04 A 55 VAL HGy% H 1 0.837 0.04 A 55 VAL C C 13 176.17859 0.4 A 55 VAL CA C 13 58.81278 0.4 A 55 VAL CB C 13 36.18864 0.4 A 55 VAL CGx C 13 20.0638 0.4 A 55 VAL CGy C 13 21.12959 0.4 A 55 VAL N N 15 113.60882 0.2 A 56 ARG H H 1 7.97724 0.04 A 56 ARG HA H 1 4.5013 0.04 A 56 ARG HBy H 1 2.08756 0.04 A 56 ARG HBx H 1 1.28096 0.04 A 56 ARG HDx H 1 2.52596 0.04 A 56 ARG HDy H 1 3.28805 0.04 A 56 ARG HGx H 1 1.21817 0.04 A 56 ARG HGy H 1 1.96468 0.04 A 56 ARG C C 13 173.22743 0.4 A 56 ARG CA C 13 54.84375 0.4 A 56 ARG CB C 13 36.04737 0.4 A 56 ARG CD C 13 43.29038 0.4 A 56 ARG CG C 13 28.78941 0.4 A 56 ARG N N 15 118.40569 0.2 A 57 LYS H H 1 8.86959 0.04 A 57 LYS HA H 1 5.61588 0.04 A 57 LYS HBx H 1 1.59596 0.04 A 57 LYS HBy H 1 1.68866 0.04 A 57 LYS HDx H 1 1.58989 0.04 A 57 LYS HDy H 1 1.64453 0.04 A 57 LYS HE2 H 1 2.901 0.04 A 57 LYS HE3 H 1 2.901 0.04 A 57 LYS HG2 H 1 1.24284 0.04 A 57 LYS HG3 H 1 1.24284 0.04 A 57 LYS C C 13 175.25434 0.4 A 57 LYS CA C 13 54.40051 0.4 A 57 LYS CB C 13 36.99104 0.4 A 57 LYS CD C 13 29.73679 0.4 A 57 LYS CE C 13 41.72681 0.4 A 57 LYS CG C 13 25.0687 0.4 A 57 LYS N N 15 121.9442 0.2 A 58 CYS H H 1 8.57707 0.04 A 58 CYS HA H 1 3.96855 0.04 A 58 CYS HBx H 1 1.63441 0.04 A 58 CYS HBy H 1 2.46539 0.04 A 58 CYS C C 13 174.96269 0.4 A 58 CYS CA C 13 54.85901 0.4 A 58 CYS CB C 13 35.61291 0.4 A 58 CYS N N 15 123.61283 0.2 A 59 LEU H H 1 8.74853 0.04 A 59 LEU HA H 1 4.40692 0.04 A 59 LEU HBx H 1 1.33003 0.04 A 59 LEU HBy H 1 2.34339 0.04 A 59 LEU HDx% H 1 0.6928 0.04 A 59 LEU HDy% H 1 0.74022 0.04 A 59 LEU HG H 1 1.70851 0.04 A 59 LEU C C 13 177.84706 0.4 A 59 LEU CA C 13 54.34394 0.4 A 59 LEU CB C 13 43.08955 0.4 A 59 LEU CDy C 13 24.93543 0.4 A 59 LEU CDx C 13 21.92563 0.4 A 59 LEU CG C 13 26.39851 0.4 A 59 LEU N N 15 112.97345 0.2 A 60 ALA H H 1 8.38668 0.04 A 60 ALA HA H 1 3.90285 0.04 A 60 ALA HB% H 1 1.32999 0.04 A 60 ALA C C 13 177.68134 0.4 A 60 ALA CA C 13 54.32947 0.4 A 60 ALA CB C 13 18.05391 0.4 A 60 ALA N N 15 119.98881 0.2 A 61 ASN H H 1 7.39382 0.04 A 61 ASN HA H 1 4.47188 0.04 A 61 ASN HBx H 1 2.66755 0.04 A 61 ASN HBy H 1 3.16131 0.04 A 61 ASN HD2x H 1 6.55748 0.04 A 61 ASN HD2y H 1 7.31906 0.04 A 61 ASN C C 13 176.77903 0.4 A 61 ASN CA C 13 52.46811 0.4 A 61 ASN CB C 13 37.03703 0.4 A 61 ASN N N 15 112.60333 0.2 A 61 ASN ND2 N 15 108.17596 0.2 A 62 GLY H H 1 8.27074 0.04 A 62 GLY HAx H 1 3.60041 0.04 A 62 GLY HAy H 1 4.0777 0.04 A 62 GLY C C 13 173.70845 0.4 A 62 GLY CA C 13 46.04845 0.4 A 62 GLY N N 15 109.65829 0.2 A 63 SER H H 1 7.662 0.04 A 63 SER HA H 1 4.71828 0.04 A 63 SER HB2 H 1 3.82912 0.04 A 63 SER HB3 H 1 3.82912 0.04 A 63 SER C C 13 172.1492 0.4 A 63 SER CA C 13 56.80043 0.4 A 63 SER CB C 13 65.38299 0.4 A 63 SER N N 15 116.33496 0.2 A 64 TRP H H 1 8.04758 0.04 A 64 TRP HA H 1 5.20384 0.04 A 64 TRP HB2 H 1 3.13049 0.04 A 64 TRP HB3 H 1 3.13049 0.04 A 64 TRP HD1 H 1 7.331 0.04 A 64 TRP HE1 H 1 10.7068 0.04 A 64 TRP HE3 H 1 7.07112 0.04 A 64 TRP HH2 H 1 6.96799 0.04 A 64 TRP HZ2 H 1 7.21766 0.04 A 64 TRP C C 13 177.94856 0.4 A 64 TRP CA C 13 56.17606 0.4 A 64 TRP CB C 13 31.52073 0.4 A 64 TRP CD1 C 13 127.51596 0.4 A 64 TRP CE3 C 13 119.87371 0.4 A 64 TRP CH2 C 13 123.01435 0.4 A 64 TRP CZ2 C 13 113.63842 0.4 A 64 TRP N N 15 121.69386 0.2 A 64 TRP NE1 N 15 130.94 0.2 A 65 THR H H 1 8.58107 0.04 A 65 THR HA H 1 4.10843 0.04 A 65 THR HB H 1 4.36535 0.04 A 65 THR HG2% H 1 1.53429 0.04 A 65 THR C C 13 174.50198 0.4 A 65 THR CA C 13 62.90951 0.4 A 65 THR CB C 13 70.30376 0.4 A 65 THR CG2 C 13 24.17836 0.4 A 65 THR N N 15 111.3984 0.2 A 66 ASP H H 1 8.80858 0.04 A 66 ASP HA H 1 4.44123 0.04 A 66 ASP HBy H 1 2.96515 0.04 A 66 ASP HBx H 1 2.67817 0.04 A 66 ASP C C 13 178.29207 0.4 A 66 ASP CA C 13 55.67506 0.4 A 66 ASP CB C 13 39.84359 0.4 A 66 ASP N N 15 115.06862 0.2 A 67 MET H H 1 8.03859 0.04 A 67 MET HA H 1 4.13593 0.04 A 67 MET HB2 H 1 2.18539 0.04 A 67 MET HB3 H 1 2.18539 0.04 A 67 MET HE% H 1 2.1109 0.04 A 67 MET HGx H 1 2.69938 0.04 A 67 MET HGy H 1 2.78173 0.04 A 67 MET C C 13 176.52378 0.4 A 67 MET CA C 13 57.61813 0.4 A 67 MET CB C 13 31.64563 0.4 A 67 MET CE C 13 17.04969 0.4 A 67 MET CG C 13 32.94004 0.4 A 67 MET N N 15 117.83343 0.2 A 68 ASP H H 1 8.49729 0.04 A 68 ASP HA H 1 4.47688 0.04 A 68 ASP HBy H 1 2.68961 0.04 A 68 ASP HBx H 1 2.66963 0.04 A 68 ASP C C 13 175.94433 0.4 A 68 ASP CA C 13 54.85695 0.4 A 68 ASP CB C 13 40.3155 0.4 A 68 ASP N N 15 116.31299 0.2 A 69 THR H H 1 8.09714 0.04 A 69 THR HA H 1 4.69717 0.04 A 69 THR HB H 1 3.98445 0.04 A 69 THR HG2% H 1 1.20445 0.04 A 69 THR C C 13 171.63273 0.4 A 69 THR CA C 13 59.26811 0.4 A 69 THR CB C 13 70.36247 0.4 A 69 THR CG2 C 13 21.52857 0.4 A 69 THR N N 15 118.04648 0.2 A 70 PRO HA H 1 4.28708 0.04 A 70 PRO HBx H 1 1.60303 0.04 A 70 PRO HBy H 1 2.17258 0.04 A 70 PRO HD2 H 1 3.73178 0.04 A 70 PRO HD3 H 1 3.73178 0.04 A 70 PRO HGx H 1 1.83037 0.04 A 70 PRO HGy H 1 1.89048 0.04 A 70 PRO C C 13 175.60516 0.4 A 70 PRO CA C 13 62.49812 0.4 A 70 PRO CB C 13 32.8652 0.4 A 70 PRO CD C 13 51.22659 0.4 A 70 PRO CG C 13 26.72138 0.4 A 71 SER H H 1 7.862 0.04 A 71 SER HA H 1 5.01406 0.04 A 71 SER HBx H 1 2.4081 0.04 A 71 SER HBy H 1 2.58428 0.04 A 71 SER C C 13 173.35288 0.4 A 71 SER CA C 13 57.85724 0.4 A 71 SER CB C 13 62.76329 0.4 A 71 SER N N 15 116.87409 0.2 A 72 ARG H H 1 8.71553 0.04 A 72 ARG HA H 1 4.5468 0.04 A 72 ARG HBx H 1 1.52099 0.04 A 72 ARG HBy H 1 1.74696 0.04 A 72 ARG HD2 H 1 3.01667 0.04 A 72 ARG HD3 H 1 3.01667 0.04 A 72 ARG HGx H 1 1.26739 0.04 A 72 ARG HGy H 1 1.46352 0.04 A 72 ARG C C 13 173.8294 0.4 A 72 ARG CA C 13 54.35195 0.4 A 72 ARG CB C 13 34.17617 0.4 A 72 ARG CD C 13 43.64152 0.4 A 72 ARG CG C 13 27.03567 0.4 A 72 ARG N N 15 121.15302 0.2 A 73 CYS H H 1 9.04441 0.04 A 73 CYS HA H 1 5.13339 0.04 A 73 CYS HBx H 1 2.64618 0.04 A 73 CYS HBy H 1 2.80899 0.04 A 73 CYS C C 13 174.87366 0.4 A 73 CYS CA C 13 55.28123 0.4 A 73 CYS CB C 13 42.21554 0.4 A 73 CYS N N 15 118.9745 0.2 A 74 VAL H H 1 8.71942 0.04 A 74 VAL HA H 1 4.36458 0.04 A 74 VAL HB H 1 2.05307 0.04 A 74 VAL HGx% H 1 0.82355 0.04 A 74 VAL HGy% H 1 0.88386 0.04 A 74 VAL C C 13 174.64747 0.4 A 74 VAL CA C 13 61.27756 0.4 A 74 VAL CB C 13 35.01746 0.4 A 74 VAL CGx C 13 20.58198 0.4 A 74 VAL CGy C 13 21.38183 0.4 A 74 VAL N N 15 122.30077 0.2 A 75 ARG H H 1 8.13932 0.04 A 75 ARG HA H 1 4.13605 0.04 A 75 ARG HBx H 1 1.64962 0.04 A 75 ARG HBy H 1 1.72038 0.04 A 75 ARG HD2 H 1 3.08511 0.04 A 75 ARG HD3 H 1 3.08511 0.04 A 75 ARG HG2 H 1 1.54864 0.04 A 75 ARG HG3 H 1 1.54864 0.04 A 75 ARG C C 13 180.67727 0.4 A 75 ARG CA C 13 58.06391 0.4 A 75 ARG CB C 13 31.47584 0.4 A 75 ARG CD C 13 43.44255 0.4 A 75 ARG CG C 13 27.42035 0.4 A 75 ARG N N 15 109.10489 0.2 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-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 24 THR HB A 25 ARG H 1.0 0.0 3.68 2 2 A 65 THR HB A 66 ASP H 1.0 0.0 3.82 3 3 A 68 ASP HA A 69 THR HB 1.0 0.0 5.43 4 4 A 69 THR HB A 70 PRO HD2 1.0 0.0 4.93 5 5 A 69 THR HB A 53 PRO HD2 1.0 0.0 4.97 6 6 A 69 THR HB A 53 PRO HG2 1.0 0.0 4.01 7 7 A 65 THR HB A 59 LEU HDx% 1.0 0.0 5.46 8 8 A 65 THR HB A 59 LEU HDy% 1.0 0.0 5.46 9 9 A 28 VAL HA A 31 ILE H 1.0 0.0 5.50 10 10 A 28 VAL HA A 9 ILE HG1x 1.0 0.0 5.11 11 11 A 28 VAL HA A 31 ILE HG1x 1.0 0.0 5.50 12 12 A 28 VAL HA A 31 ILE HG1y 1.0 0.0 3.75 13 13 A 28 VAL HA A 23 LEU HDy% 1.0 0.0 4.01 14 14 A 28 VAL HA A 31 ILE HD1% 1.0 0.0 3.53 15 15 A 36 VAL HA A 38 TYR H 1.0 0.0 4.25 16 16 A 36 VAL HA A 58 CYS HBy 1.0 0.0 3.99 17 17 A 6 GLY H A 4 SER HBy 1.0 0.0 5.50 18 18 A 6 GLY H A 4 SER HBx 1.0 0.0 5.50 19 19 A 53 PRO HA A 55 VAL H 1.0 0.0 4.57 20 20 A 53 PRO HA A 69 THR HG2% 1.0 0.0 5.18 21 21 A 9 ILE HA A 20 TYR HE% 1.0 0.0 4.83 22 22 A 54 LYS HA A 71 SER HBy 1.0 0.0 5.50 23 23 A 9 ILE HA A 10 ILE HA 1.0 0.0 4.40 24 24 A 54 LYS HA A 71 SER HBx 1.0 0.0 5.50 25 25 A 9 ILE HG1x A 9 ILE HA 1.0 0.0 3.79 26 26 A 9 ILE HA A 10 ILE HB 1.0 0.0 5.00 27 27 A 9 ILE HA A 9 ILE HG1y 1.0 0.0 4.09 28 28 A 9 ILE HA A 10 ILE HG1y 1.0 0.0 4.66 29 29 A 9 ILE HA A 9 ILE HG2% 1.0 0.0 3.39 30 30 A 9 ILE HA A 9 ILE HD1% 1.0 0.0 3.98 31 31 A 50 VAL HA A 50 VAL HGy% 1.0 0.0 3.25 32 32 A 9 ILE HA A 10 ILE HD1% 1.0 0.0 5.24 33 33 A 70 PRO HA A 71 SER HA 1.0 0.0 5.05 34 34 A 53 PRO HD2 A 71 SER HBy 1.0 0.0 5.29 35 35 A 53 PRO HD2 A 71 SER HBx 1.0 0.0 5.29 36 36 A 65 THR HA A 65 THR HG2% 1.0 0.0 3.11 37 37 A 69 THR HG2% A 70 PRO HA 1.0 0.0 4.98 38 38 A 50 VAL HGx% A 71 SER HBy 1.0 0.0 5.30 39 39 A 50 VAL HGx% A 71 SER HBx 1.0 0.0 5.30 40 40 A 65 THR HA A 59 LEU HDy% 1.0 0.0 4.28 41 41 A 50 VAL HGy% A 71 SER HBy 1.0 0.0 4.37 42 42 A 50 VAL HGy% A 71 SER HBx 1.0 0.0 4.37 43 43 A 7 CYS H A 35 PRO HA 1.0 0.0 4.94 44 44 A 35 PRO HA A 6 GLY HAx 1.0 0.0 4.26 45 45 A 51 VAL HA A 52 GLY HAx 1.0 0.0 4.40 46 46 A 35 PRO HA A 36 VAL HB 1.0 0.0 4.86 47 47 A 31 ILE HG1y A 31 ILE HA 1.0 0.0 4.25 48 48 A 35 PRO HA A 36 VAL HGx% 1.0 0.0 3.96 49 49 A 74 VAL HA A 75 ARG H 1.0 0.0 2.85 50 50 A 34 LEU HBy A 38 TYR HA 1.0 0.0 5.47 51 51 A 3 THR HA A 3 THR HG2% 1.0 0.0 3.84 52 52 A 74 VAL HA A 74 VAL HGx% 1.0 0.0 3.25 53 53 A 38 TYR HA A 37 ASP H 1.0 0.0 5.11 54 54 A 38 TYR HA A 58 CYS H 1.0 0.0 5.26 55 55 A 38 TYR HA A 39 GLU HGy 1.0 0.0 4.88 56 56 A 38 TYR HA A 35 PRO HG2 1.0 0.0 4.61 57 57 A 18 ILE HA A 42 TYR HA 1.0 0.0 3.88 58 58 A 42 TYR HBy A 43 VAL HA 1.0 0.0 4.36 59 59 A 24 THR HA A 24 THR HG2% 1.0 0.0 3.29 60 60 A 10 ILE HA A 10 ILE HG1y 1.0 0.0 3.99 61 61 A 43 VAL HA A 43 VAL HGx% 1.0 0.0 3.35 62 62 A 10 ILE HA A 10 ILE HG1x 1.0 0.0 3.78 63 63 A 10 ILE HA A 10 ILE HD1% 1.0 0.0 4.36 64 64 A 20 TYR HD% A 40 ILE HA 1.0 0.0 5.01 65 65 A 40 ILE HA A 39 GLU HA 1.0 0.0 4.88 66 66 A 24 THR HA A 25 ARG HA 1.0 0.0 4.83 67 67 A 18 ILE HA A 18 ILE HG1x 1.0 0.0 4.10 68 68 A 40 ILE HA A 40 ILE HG1y 1.0 0.0 4.21 69 69 A 40 ILE HA A 40 ILE HG2% 1.0 0.0 3.25 70 70 A 25 ARG HA A 28 VAL HGx% 1.0 0.0 5.50 71 71 A 18 ILE HA A 18 ILE HG1y 1.0 0.0 4.02 72 72 A 42 TYR H A 55 VAL HA 1.0 0.0 4.21 73 73 A 27 GLN HA A 30 ALA H 1.0 0.0 5.29 74 74 A 55 VAL HA A 42 TYR HD% 1.0 0.0 4.52 75 75 A 27 GLN HA A 27 GLN HGx 1.0 0.0 3.62 76 76 A 55 VAL HA A 41 GLU HBx 1.0 0.0 4.29 77 77 A 23 LEU HDy% A 27 GLN HA 1.0 0.0 4.50 78 78 A 6 GLY H A 4 SER HA 1.0 0.0 5.50 79 79 A 54 LYS HA A 41 GLU HA 1.0 0.0 5.00 80 80 A 54 LYS HA A 55 VAL HA 1.0 0.0 5.33 81 81 A 29 LYS HA A 29 LYS HGx 1.0 0.0 3.95 82 82 A 29 LYS HA A 29 LYS HGy 1.0 0.0 3.95 83 83 A 20 TYR HD% A 20 TYR HA 1.0 0.0 3.91 84 84 A 54 LYS HA A 42 TYR HD% 1.0 0.0 3.83 85 85 A 71 SER HA A 52 GLY HAy 1.0 0.0 3.87 86 86 A 71 SER HA A 52 GLY HAx 1.0 0.0 4.38 87 87 A 53 PRO HD2 A 71 SER HA 1.0 0.0 4.14 88 88 A 36 VAL HA A 37 ASP HA 1.0 0.0 4.33 89 89 A 67 MET HA A 67 MET HGy 1.0 0.0 3.61 90 90 A 54 LYS HA A 42 TYR HBx 1.0 0.0 3.56 91 91 A 71 SER HA A 72 ARG HGx 1.0 0.0 4.65 92 92 A 69 THR HG2% A 71 SER HA 1.0 0.0 4.93 93 93 A 5 GLU HA A 6 GLY HAy 1.0 0.0 5.12 94 94 A 8 GLN HA A 33 PHE HA 1.0 0.0 3.41 95 95 A 9 ILE HG1y A 8 GLN HA 1.0 0.0 4.69 96 96 A 33 PHE HA A 31 ILE HG2% 1.0 0.0 4.53 97 97 A 59 LEU H A 64 TRP HA 1.0 0.0 3.96 98 98 A 64 TRP HA A 64 TRP HD1 1.0 0.0 5.00 99 99 A 44 CYS HA A 45 ARG HA 1.0 0.0 5.23 100 100 A 64 TRP HA A 63 SER HA 1.0 0.0 5.49 101 101 A 65 THR HA A 64 TRP HA 1.0 0.0 4.65 102 102 A 64 TRP HA A 58 CYS HA 1.0 0.0 3.61 103 103 A 45 ARG HA A 46 GLY HA3 1.0 0.0 4.91 104 104 A 46 GLY HA3 A 47 GLU HA 1.0 0.0 5.24 105 105 A 48 ARG HA A 48 ARG HDy 1.0 0.0 4.36 106 106 A 48 ARG HA A 48 ARG HDx 1.0 0.0 4.36 107 107 A 8 GLN HA A 33 PHE HBx 1.0 0.0 4.60 108 108 A 64 TRP HA A 7 CYS HBx 1.0 0.0 5.41 109 109 A 64 TRP HA A 56 ARG HBx 1.0 0.0 5.50 110 110 A 64 TRP HA A 59 LEU HG 1.0 0.0 4.37 111 111 A 65 THR HG2% A 64 TRP HA 1.0 0.0 4.33 112 112 A 48 ARG HA A 48 ARG HGx 1.0 0.0 4.09 113 113 A 45 ARG HA A 45 ARG HGy 1.0 0.0 3.94 114 114 A 49 GLU H A 73 CYS HA 1.0 0.0 5.44 115 115 A 20 TYR HD% A 19 ARG HA 1.0 0.0 4.73 116 116 A 50 VAL HA A 73 CYS HA 1.0 0.0 3.63 117 117 A 73 CYS HA A 44 CYS HBx 1.0 0.0 4.95 118 118 A 73 CYS HA A 74 VAL HB 1.0 0.0 5.01 119 119 A 73 CYS HA A 50 VAL HB 1.0 0.0 4.38 120 120 A 73 CYS HA A 48 ARG HBx 1.0 0.0 5.47 121 121 A 19 ARG HA A 19 ARG HGx 1.0 0.0 4.24 122 122 A 50 VAL HGx% A 73 CYS HA 1.0 0.0 3.78 123 123 A 43 VAL HGx% A 19 ARG HA 1.0 0.0 4.28 124 124 A 59 LEU H A 58 CYS HA 1.0 0.0 3.20 125 125 A 58 CYS HA A 57 LYS HA 1.0 0.0 4.99 126 126 A 55 VAL HA A 56 ARG HA 1.0 0.0 4.84 127 127 A 36 VAL HA A 58 CYS HA 1.0 0.0 4.52 128 128 A 56 ARG HA A 56 ARG HGx 1.0 0.0 3.89 129 129 A 56 ARG HA A 56 ARG HGy 1.0 0.0 4.00 130 130 A 56 ARG HA A 55 VAL HGx% 1.0 0.0 5.50 131 131 A 56 ARG HA A 55 VAL HGy% 1.0 0.0 5.50 132 132 A 6 GLY H A 60 ALA HA 1.0 0.0 5.36 133 133 A 57 LYS HA A 56 ARG HA 1.0 0.0 5.00 134 134 A 60 ALA HA A 59 LEU HA 1.0 0.0 4.71 135 135 A 38 TYR HA A 39 GLU HA 1.0 0.0 4.87 136 136 A 36 VAL HA A 60 ALA HA 1.0 0.0 4.95 137 137 A 39 GLU HGy A 39 GLU HA 1.0 0.0 4.01 138 138 A 39 GLU HA A 39 GLU HGx 1.0 0.0 3.75 139 139 A 59 LEU HG A 59 LEU HA 1.0 0.0 3.83 140 140 A 36 VAL HB A 60 ALA HA 1.0 0.0 4.34 141 141 A 50 VAL HGx% A 49 GLU HA 1.0 0.0 3.79 142 142 A 57 LYS HA A 40 ILE HD1% 1.0 0.0 5.50 143 143 A 41 GLU HA A 56 ARG H 1.0 0.0 4.49 144 144 A 11 HIS HA A 11 HIS HD2 1.0 0.0 4.98 145 145 A 42 TYR HD% A 41 GLU HA 1.0 0.0 4.26 146 146 A 40 ILE HA A 41 GLU HA 1.0 0.0 4.87 147 147 A 41 GLU HA A 42 TYR HBx 1.0 0.0 4.53 148 148 A 41 GLU HA A 41 GLU HGy 1.0 0.0 3.95 149 149 A 10 ILE HB A 11 HIS HA 1.0 0.0 5.29 150 150 A 40 ILE HG1y A 41 GLU HA 1.0 0.0 4.44 151 151 A 41 GLU HA A 18 ILE HG2% 1.0 0.0 5.50 152 152 A 44 CYS HA A 16 GLY HAx 1.0 0.0 3.66 153 153 A 44 CYS HA A 16 GLY HAy 1.0 0.0 3.82 154 154 A 23 LEU HA A 27 GLN HBy 1.0 0.0 5.11 155 155 A 23 LEU HA A 27 GLN HGy 1.0 0.0 5.50 156 156 A 44 CYS HA A 43 VAL HB 1.0 0.0 4.96 157 157 A 44 CYS HA A 45 ARG HBx 1.0 0.0 4.41 158 158 A 23 LEU HA A 23 LEU HG 1.0 0.0 3.83 159 159 A 44 CYS HA A 45 ARG HGx 1.0 0.0 5.36 160 160 A 61 ASN HA A 61 ASN HD2y 1.0 0.0 5.07 161 161 A 61 ASN HA A 60 ALA HB% 1.0 0.0 4.46 162 162 A 70 PRO HD2 A 69 THR HA 1.0 0.0 2.86 163 163 A 35 PRO HDy A 38 TYR HD% 1.0 0.0 4.54 164 164 A 35 PRO HDy A 38 TYR HE% 1.0 0.0 5.48 165 165 A 42 TYR HD% A 13 PRO HDy 1.0 0.0 4.15 166 166 A 13 PRO HDy A 42 TYR HE% 1.0 0.0 4.06 167 167 A 42 TYR HE% A 13 PRO HDx 1.0 0.0 5.19 168 168 A 35 PRO HDy A 34 LEU HA 1.0 0.0 3.29 169 169 A 35 PRO HDy A 38 TYR HBx 1.0 0.0 5.26 170 170 A 34 LEU HA A 34 LEU HG 1.0 0.0 4.16 171 171 A 34 LEU HG A 35 PRO HDx 1.0 0.0 4.55 172 172 A 35 PRO HDy A 34 LEU HBx 1.0 0.0 4.94 173 173 A 18 ILE HG1x A 13 PRO HDy 1.0 0.0 4.62 174 174 A 34 LEU HA A 34 LEU HDx% 1.0 0.0 3.70 175 175 A 18 ILE HG1y A 13 PRO HDy 1.0 0.0 4.85 176 176 A 18 ILE HG1y A 13 PRO HDx 1.0 0.0 4.95 177 177 A 34 LEU HA A 35 PRO HDx 1.0 0.0 3.55 178 178 A 38 TYR HBx A 35 PRO HDx 1.0 0.0 4.59 179 179 A 35 PRO HDx A 34 LEU HBx 1.0 0.0 4.20 180 180 A 34 LEU HBy A 35 PRO HDy 1.0 0.0 4.11 181 181 A 34 LEU HBy A 35 PRO HDx 1.0 0.0 3.88 182 182 A 31 ILE HG2% A 35 PRO HDy 1.0 0.0 4.86 183 183 A 35 PRO HDy A 34 LEU HDy% 1.0 0.0 5.32 184 184 A 35 PRO HDx A 34 LEU HDy% 1.0 0.0 4.46 185 185 A 35 PRO HDy A 34 LEU HDx% 1.0 0.0 5.32 186 186 A 35 PRO HDx A 34 LEU HDx% 1.0 0.0 4.46 187 187 A 53 PRO HD2 A 52 GLY H 1.0 0.0 4.89 188 188 A 53 PRO HD2 A 52 GLY HAy 1.0 0.0 3.40 189 189 A 53 PRO HD2 A 52 GLY HAx 1.0 0.0 3.33 190 190 A 53 PRO HD2 A 69 THR HG2% 1.0 0.0 3.50 191 191 A 46 GLY HA3 A 48 ARG H 1.0 0.0 5.44 192 192 A 46 GLY HA3 A 47 GLU HBy 1.0 0.0 5.50 193 193 A 46 GLY HA3 A 45 ARG HBy 1.0 0.0 4.35 194 194 A 16 GLY HAy A 45 ARG H 1.0 0.0 4.57 195 195 A 7 CYS HA A 62 GLY HAy 1.0 0.0 4.93 196 196 A 7 CYS HA A 62 GLY HAx 1.0 0.0 4.51 197 197 A 23 LEU HBx A 24 THR H 1.0 0.0 4.30 198 198 A 23 LEU HBx A 20 TYR HBx 1.0 0.0 4.75 199 199 A 20 TYR HBy A 23 LEU HBy 1.0 0.0 5.16 200 200 A 23 LEU HBx A 20 TYR HBy 1.0 0.0 5.07 201 201 A 27 GLN HBy A 23 LEU HBy 1.0 0.0 4.97 202 202 A 27 GLN HBy A 23 LEU HBx 1.0 0.0 5.24 203 203 A 6 GLY HAx A 36 VAL HGx% 1.0 0.0 4.08 204 204 A 42 TYR HE% A 56 ARG HDx 1.0 0.0 5.12 205 205 A 42 TYR HE% A 56 ARG HDy 1.0 0.0 5.12 206 206 A 64 TRP HB2 A 56 ARG HDx 1.0 0.0 4.15 207 207 A 53 PRO HG2 A 52 GLY HAx 1.0 0.0 4.88 208 208 A 69 THR HG2% A 52 GLY HAy 1.0 0.0 5.50 209 209 A 59 LEU H A 59 LEU HBy 1.0 0.0 4.06 210 210 A 44 CYS HBx A 45 ARG H 1.0 0.0 4.02 211 211 A 46 GLY H A 45 ARG HDy 1.0 0.0 4.50 212 212 A 59 LEU HBx A 60 ALA H 1.0 0.0 3.87 213 213 A 59 LEU HBy A 61 ASN H 1.0 0.0 5.36 214 214 A 59 LEU HBx A 61 ASN H 1.0 0.0 4.25 215 215 A 8 GLN HA A 33 PHE HBy 1.0 0.0 5.06 216 216 A 19 ARG HBy A 19 ARG HDy 1.0 0.0 3.84 217 217 A 19 ARG HBy A 19 ARG HDx 1.0 0.0 3.84 218 218 A 45 ARG HBy A 45 ARG HDy 1.0 0.0 3.92 219 219 A 45 ARG HBy A 45 ARG HDx 1.0 0.0 3.92 220 220 A 59 LEU HBy A 59 LEU HDx% 1.0 0.0 3.36 221 221 A 59 LEU HBx A 59 LEU HDx% 1.0 0.0 3.28 222 222 A 43 VAL HGx% A 19 ARG HDy 1.0 0.0 4.47 223 223 A 43 VAL HGx% A 19 ARG HDx 1.0 0.0 4.47 224 224 A 7 CYS HBx A 8 GLN H 1.0 0.0 4.38 225 225 A 7 CYS H A 7 CYS HBy 1.0 0.0 4.03 226 226 A 64 TRP HD1 A 7 CYS HBx 1.0 0.0 4.84 227 227 A 7 CYS HBy A 64 TRP HZ2 1.0 0.0 4.34 228 228 A 6 GLY HAy A 33 PHE HBx 1.0 0.0 4.17 229 229 A 6 GLY HAy A 33 PHE HBy 1.0 0.0 4.36 230 230 A 7 CYS HBx A 62 GLY HAx 1.0 0.0 5.49 231 231 A 6 GLY HAx A 33 PHE HBx 1.0 0.0 4.71 232 232 A 6 GLY HAx A 33 PHE HBy 1.0 0.0 5.50 233 233 A 31 ILE HG2% A 33 PHE HBy 1.0 0.0 5.02 234 234 A 20 TYR HE% A 18 ILE HB 1.0 0.0 4.35 235 235 A 42 TYR HBx A 43 VAL H 1.0 0.0 4.38 236 236 A 38 TYR HD% A 34 LEU HBx 1.0 0.0 5.35 237 237 A 34 LEU HBx A 64 TRP HH2 1.0 0.0 4.79 238 238 A 34 LEU HBy A 64 TRP HH2 1.0 0.0 4.84 239 239 A 54 LYS HA A 42 TYR HBy 1.0 0.0 4.57 240 240 A 34 LEU HBx A 38 TYR HBy 1.0 0.0 5.28 241 241 A 50 VAL HGx% A 42 TYR HBx 1.0 0.0 4.86 242 242 A 50 VAL HGx% A 42 TYR HBy 1.0 0.0 4.30 243 243 A 34 LEU HBy A 34 LEU HDy% 1.0 0.0 3.85 244 244 A 50 VAL HGy% A 42 TYR HBx 1.0 0.0 4.17 245 245 A 41 GLU HA A 40 ILE HB 1.0 0.0 5.50 246 246 A 68 ASP H A 68 ASP HBy 1.0 0.0 3.76 247 247 A 26 ASP HBx A 27 GLN H 1.0 0.0 4.48 248 248 A 58 CYS HBy A 38 TYR HBx 1.0 0.0 4.44 249 249 A 39 GLU HGy A 38 TYR HBy 1.0 0.0 5.49 250 250 A 38 TYR HBx A 35 PRO HBy 1.0 0.0 5.50 251 251 A 35 PRO HG2 A 38 TYR HBy 1.0 0.0 4.61 252 252 A 38 TYR HBx A 34 LEU HBx 1.0 0.0 4.92 253 253 A 34 LEU HBy A 38 TYR HBy 1.0 0.0 4.64 254 254 A 34 LEU HBy A 38 TYR HBx 1.0 0.0 4.50 255 255 A 10 ILE HB A 18 ILE HD1% 1.0 0.0 4.02 256 256 A 10 ILE HB A 40 ILE HD1% 1.0 0.0 4.61 257 257 A 31 ILE HB A 32 ASN H 1.0 0.0 4.21 258 258 A 28 VAL HA A 31 ILE HB 1.0 0.0 5.05 259 259 A 9 ILE HG1x A 31 ILE HB 1.0 0.0 4.17 260 260 A 69 THR HG2% A 66 ASP HBx 1.0 0.0 5.05 261 261 A 9 ILE HD1% A 31 ILE HB 1.0 0.0 3.63 262 262 A 20 TYR HBx A 20 TYR H 1.0 0.0 4.12 263 263 A 31 ILE H A 9 ILE HB 1.0 0.0 4.26 264 264 A 8 GLN HA A 9 ILE HB 1.0 0.0 5.16 265 265 A 20 TYR HBx A 23 LEU HBy 1.0 0.0 4.31 266 266 A 23 LEU HG A 20 TYR HBx 1.0 0.0 4.87 267 267 A 20 TYR HBy A 28 VAL HGy% 1.0 0.0 5.50 268 268 A 39 GLU HGy A 40 ILE H 1.0 0.0 5.47 269 269 A 58 CYS H A 57 LYS HBy 1.0 0.0 4.81 270 270 A 57 LYS HBy A 65 THR H 1.0 0.0 5.12 271 271 A 58 CYS H A 57 LYS HBx 1.0 0.0 4.65 272 272 A 56 ARG HA A 57 LYS HBy 1.0 0.0 5.26 273 273 A 56 ARG HA A 57 LYS HBx 1.0 0.0 5.20 274 274 A 39 GLU HGy A 37 ASP HA 1.0 0.0 5.50 275 275 A 39 GLU HGy A 57 LYS HBx 1.0 0.0 5.16 276 276 A 39 GLU HGx A 57 LYS HBy 1.0 0.0 5.11 277 277 A 39 GLU HGx A 57 LYS HBx 1.0 0.0 3.94 278 278 A 59 LEU HBx A 61 ASN HBx 1.0 0.0 5.19 279 279 A 59 LEU HBx A 61 ASN HBy 1.0 0.0 5.50 280 280 A 56 ARG HBx A 64 TRP HB2 1.0 0.0 4.17 281 281 A 40 ILE HD1% A 56 ARG HBy 1.0 0.0 4.44 282 282 A 59 LEU H A 58 CYS HBx 1.0 0.0 5.10 283 283 A 43 VAL HB A 48 ARG H 1.0 0.0 5.50 284 284 A 58 CYS HBy A 38 TYR HD% 1.0 0.0 5.50 285 285 A 58 CYS HBy A 64 TRP HE3 1.0 0.0 5.50 286 286 A 58 CYS HBx A 64 TRP HE3 1.0 0.0 4.46 287 287 A 58 CYS HBy A 57 LYS HA 1.0 0.0 4.78 288 288 A 57 LYS HA A 58 CYS HBx 1.0 0.0 4.94 289 289 A 41 GLU HA A 41 GLU HGx 1.0 0.0 3.95 290 290 A 38 TYR HBy A 58 CYS HBx 1.0 0.0 4.24 291 291 A 38 TYR HBx A 58 CYS HBx 1.0 0.0 4.62 292 292 A 58 CYS HBy A 36 VAL HGy% 1.0 0.0 4.73 293 293 A 58 CYS HBx A 36 VAL HGy% 1.0 0.0 5.50 294 294 A 75 ARG H A 74 VAL HB 1.0 0.0 4.33 295 295 A 27 GLN HGx A 24 THR H 1.0 0.0 4.66 296 296 A 27 GLN HGx A 28 VAL H 1.0 0.0 4.76 297 297 A 27 GLN HGy A 28 VAL H 1.0 0.0 5.17 298 298 A 27 GLN HGy A 27 GLN HE2x 1.0 0.0 3.98 299 299 A 27 GLN HA A 27 GLN HGy 1.0 0.0 3.95 300 300 A 41 GLU HBx A 19 ARG H 1.0 0.0 5.41 301 301 A 72 ARG H A 72 ARG HBx 1.0 0.0 3.96 302 302 A 55 VAL H A 54 LYS HBy 1.0 0.0 4.22 303 303 A 55 VAL H A 54 LYS HBx 1.0 0.0 4.70 304 304 A 40 ILE H A 39 GLU HBx 1.0 0.0 4.77 305 305 A 52 GLY H A 51 VAL HB 1.0 0.0 4.71 306 306 A 67 MET HGy A 64 TRP H 1.0 0.0 3.95 307 307 A 35 PRO HBy A 36 VAL H 1.0 0.0 3.91 308 308 A 39 GLU H A 39 GLU HBy 1.0 0.0 3.84 309 309 A 71 SER HA A 70 PRO HBx 1.0 0.0 5.44 310 310 A 64 TRP HB2 A 67 MET HGx 1.0 0.0 4.30 311 311 A 67 MET HGy A 64 TRP HB2 1.0 0.0 4.27 312 312 A 38 TYR HD% A 35 PRO HBx 1.0 0.0 4.98 313 313 A 34 LEU HA A 35 PRO HBy 1.0 0.0 4.97 314 314 A 55 VAL H A 53 PRO HBy 1.0 0.0 5.50 315 315 A 48 ARG H A 48 ARG HBy 1.0 0.0 4.00 316 316 A 52 GLY HAy A 53 PRO HBy 1.0 0.0 5.50 317 317 A 14 TRP HBx A 13 PRO HBy 1.0 0.0 5.50 318 318 A 69 THR HG2% A 53 PRO HBx 1.0 0.0 4.40 319 319 A 36 VAL HB A 37 ASP H 1.0 0.0 4.80 320 320 A 68 ASP H A 67 MET HB2 1.0 0.0 4.07 321 321 A 75 ARG H A 75 ARG HBy 1.0 0.0 4.04 322 322 A 75 ARG H A 75 ARG HBx 1.0 0.0 4.04 323 323 A 67 MET HB2 A 67 MET H 1.0 0.0 3.25 324 324 A 28 VAL H A 28 VAL HB 1.0 0.0 3.99 325 325 A 64 TRP HB2 A 64 TRP HE3 1.0 0.0 4.04 326 326 A 63 SER HA A 64 TRP HB2 1.0 0.0 4.91 327 327 A 64 TRP HB2 A 56 ARG HDy 1.0 0.0 4.15 328 328 A 19 ARG HBx A 41 GLU HBy 1.0 0.0 4.21 329 329 A 65 THR HG2% A 64 TRP HB2 1.0 0.0 5.50 330 330 A 64 TRP HB2 A 56 ARG HBy 1.0 0.0 5.01 331 331 A 43 VAL HGx% A 19 ARG HBy 1.0 0.0 4.06 332 332 A 43 VAL HGx% A 19 ARG HBx 1.0 0.0 3.94 333 333 A 8 GLN HBy A 64 TRP HE1 1.0 0.0 5.50 334 334 A 64 TRP HE1 A 8 GLN HBx 1.0 0.0 5.50 335 335 A 8 GLN H A 8 GLN HBx 1.0 0.0 3.61 336 336 A 27 GLN HBy A 24 THR H 1.0 0.0 4.04 337 337 A 27 GLN HBy A 27 GLN H 1.0 0.0 3.91 338 338 A 8 GLN HBy A 33 PHE HD% 1.0 0.0 5.33 339 339 A 57 LYS HA A 57 LYS HDy 1.0 0.0 4.87 340 340 A 57 LYS HA A 57 LYS HDx 1.0 0.0 4.87 341 341 A 7 CYS HA A 8 GLN HBy 1.0 0.0 5.37 342 342 A 54 LYS HBy A 54 LYS HDx 1.0 0.0 3.61 343 343 A 49 GLU H A 48 ARG HGy 1.0 0.0 4.85 344 344 A 14 TRP HBx A 13 PRO HA 1.0 0.0 4.79 345 345 A 54 LYS HA A 54 LYS HDy 1.0 0.0 4.71 346 346 A 34 LEU HG A 38 TYR HBy 1.0 0.0 5.27 347 347 A 14 TRP HBx A 13 PRO HBx 1.0 0.0 5.50 348 348 A 54 LYS HBy A 54 LYS HDy 1.0 0.0 3.71 349 349 A 50 VAL HGx% A 54 LYS HDy 1.0 0.0 4.98 350 350 A 23 LEU HDy% A 27 GLN HBx 1.0 0.0 3.73 351 351 A 50 VAL HGy% A 54 LYS HDx 1.0 0.0 4.78 352 352 A 56 ARG HGy A 56 ARG H 1.0 0.0 5.13 353 353 A 20 TYR HD% A 34 LEU HG 1.0 0.0 5.21 354 354 A 20 TYR HE% A 34 LEU HG 1.0 0.0 4.61 355 355 A 56 ARG HGx A 42 TYR HE% 1.0 0.0 4.65 356 356 A 56 ARG HGy A 42 TYR HE% 1.0 0.0 4.13 357 357 A 48 ARG HA A 48 ARG HGy 1.0 0.0 4.09 358 358 A 47 GLU H A 47 GLU HBx 1.0 0.0 4.17 359 359 A 31 ILE H A 9 ILE HG1y 1.0 0.0 4.82 360 360 A 46 GLY HA3 A 47 GLU HBx 1.0 0.0 5.50 361 361 A 18 ILE HG1x A 13 PRO HDx 1.0 0.0 5.44 362 362 A 18 ILE HG1x A 13 PRO HGx 1.0 0.0 4.61 363 363 A 19 ARG H A 19 ARG HGx 1.0 0.0 5.06 364 364 A 20 TYR H A 19 ARG HGx 1.0 0.0 4.72 365 365 A 53 PRO HG2 A 54 LYS H 1.0 0.0 4.85 366 366 A 21 ARG H A 21 ARG HGx 1.0 0.0 4.17 367 367 A 31 ILE H A 31 ILE HG1x 1.0 0.0 4.52 368 368 A 35 PRO HG2 A 34 LEU HA 1.0 0.0 4.70 369 369 A 31 ILE HG1x A 31 ILE HA 1.0 0.0 4.00 370 370 A 35 PRO HG2 A 38 TYR HBx 1.0 0.0 4.11 371 371 A 31 ILE HG1x A 31 ILE HG2% 1.0 0.0 3.23 372 372 A 31 ILE HG1y A 9 ILE HD1% 1.0 0.0 3.91 373 373 A 72 ARG HGx A 51 VAL H 1.0 0.0 4.87 374 374 A 20 TYR H A 19 ARG HGy 1.0 0.0 4.72 375 375 A 45 ARG HGy A 45 ARG H 1.0 0.0 4.95 376 376 A 42 TYR HD% A 13 PRO HGx 1.0 0.0 4.25 377 377 A 42 TYR HD% A 13 PRO HGy 1.0 0.0 4.59 378 378 A 42 TYR HE% A 13 PRO HGx 1.0 0.0 4.64 379 379 A 42 TYR HE% A 13 PRO HGy 1.0 0.0 5.10 380 380 A 69 THR HA A 70 PRO HGx 1.0 0.0 4.21 381 381 A 69 THR HA A 70 PRO HGy 1.0 0.0 4.73 382 382 A 72 ARG HGx A 72 ARG HA 1.0 0.0 4.05 383 383 A 72 ARG HA A 72 ARG HGy 1.0 0.0 4.21 384 384 A 19 ARG HA A 19 ARG HGy 1.0 0.0 4.24 385 385 A 16 GLY HAy A 13 PRO HGy 1.0 0.0 4.38 386 386 A 45 ARG HA A 45 ARG HGx 1.0 0.0 4.11 387 387 A 69 THR HG2% A 70 PRO HGy 1.0 0.0 5.50 388 388 A 59 LEU H A 59 LEU HG 1.0 0.0 3.90 389 389 A 9 ILE HA A 10 ILE HG1x 1.0 0.0 5.32 390 390 A 54 LYS HDx A 54 LYS HGy 1.0 0.0 2.99 391 391 A 10 ILE HG1x A 18 ILE HD1% 1.0 0.0 5.50 392 392 A 10 ILE HG1y A 40 ILE HD1% 1.0 0.0 4.68 393 393 A 10 ILE HG1x A 40 ILE HD1% 1.0 0.0 4.79 394 394 A 24 THR H A 23 LEU HDx% 1.0 0.0 5.47 395 395 A 23 LEU HDx% A 23 LEU H 1.0 0.0 4.28 396 396 A 55 VAL H A 54 LYS HGx 1.0 0.0 5.50 397 397 A 20 TYR HD% A 23 LEU HDx% 1.0 0.0 3.73 398 398 A 38 TYR HE% A 23 LEU HDx% 1.0 0.0 4.22 399 399 A 54 LYS HA A 54 LYS HGx 1.0 0.0 4.06 400 400 A 28 VAL HA A 23 LEU HDx% 1.0 0.0 3.99 401 401 A 20 TYR HBx A 23 LEU HDx% 1.0 0.0 3.57 402 402 A 20 TYR HBy A 23 LEU HDx% 1.0 0.0 3.84 403 403 A 27 GLN HBy A 23 LEU HDx% 1.0 0.0 4.58 404 404 A 23 LEU HBy A 23 LEU HDx% 1.0 0.0 3.27 405 405 A 23 LEU HBx A 23 LEU HDx% 1.0 0.0 3.34 406 406 A 23 LEU HDx% A 28 VAL HGx% 1.0 0.0 4.30 407 407 A 40 ILE HG1y A 19 ARG H 1.0 0.0 5.50 408 408 A 60 ALA H A 59 LEU HDy% 1.0 0.0 4.58 409 409 A 40 ILE HG1y A 56 ARG H 1.0 0.0 4.04 410 410 A 64 TRP HE3 A 40 ILE HG1x 1.0 0.0 4.39 411 411 A 42 TYR HE% A 40 ILE HG1x 1.0 0.0 5.38 412 412 A 40 ILE HG1y A 42 TYR HE% 1.0 0.0 4.96 413 413 A 39 GLU HA A 40 ILE HG1y 1.0 0.0 5.50 414 414 A 39 GLU HA A 40 ILE HG1x 1.0 0.0 4.68 415 415 A 40 ILE HG1y A 55 VAL HA 1.0 0.0 5.26 416 416 A 41 GLU HA A 40 ILE HG1x 1.0 0.0 5.50 417 417 A 55 VAL HA A 40 ILE HG1x 1.0 0.0 5.50 418 418 A 59 LEU HA A 59 LEU HDy% 1.0 0.0 4.22 419 419 A 59 LEU HBy A 59 LEU HDy% 1.0 0.0 3.36 420 420 A 65 THR HG2% A 59 LEU HDy% 1.0 0.0 3.02 421 421 A 59 LEU HBx A 59 LEU HDy% 1.0 0.0 3.28 422 422 A 40 ILE HG1y A 56 ARG HBy 1.0 0.0 4.10 423 423 A 56 ARG HBy A 40 ILE HG1x 1.0 0.0 4.28 424 424 A 10 ILE HD1% A 40 ILE HG1y 1.0 0.0 4.74 425 425 A 10 ILE HD1% A 40 ILE HG1x 1.0 0.0 4.54 426 426 A 65 THR HG2% A 57 LYS H 1.0 0.0 3.57 427 427 A 20 TYR HE% A 34 LEU HDx% 1.0 0.0 3.97 428 428 A 65 THR HG2% A 57 LYS HA 1.0 0.0 4.96 429 429 A 34 LEU HBy A 34 LEU HDx% 1.0 0.0 3.85 430 430 A 65 THR HG2% A 59 LEU HDx% 1.0 0.0 3.02 431 431 A 23 LEU HDy% A 38 TYR HE% 1.0 0.0 4.82 432 432 A 20 TYR HE% A 34 LEU HDy% 1.0 0.0 3.97 433 433 A 23 LEU HDy% A 23 LEU HA 1.0 0.0 2.93 434 434 A 34 LEU HA A 34 LEU HDy% 1.0 0.0 3.70 435 435 A 23 LEU HDy% A 20 TYR HBx 1.0 0.0 4.60 436 436 A 23 LEU HDy% A 20 TYR HBy 1.0 0.0 4.79 437 437 A 23 LEU HDy% A 27 GLN HBy 1.0 0.0 3.53 438 438 A 23 LEU HDy% A 23 LEU HBy 1.0 0.0 3.33 439 439 A 34 LEU HBx A 34 LEU HDy% 1.0 0.0 3.60 440 440 A 34 LEU HBx A 34 LEU HDx% 1.0 0.0 3.60 441 441 A 23 LEU HDy% A 23 LEU HBx 1.0 0.0 3.29 442 442 A 23 LEU HDy% A 28 VAL HGy% 1.0 0.0 4.85 443 443 A 23 LEU HDy% A 28 VAL HGx% 1.0 0.0 4.85 444 444 A 50 VAL HGx% A 73 CYS H 1.0 0.0 3.95 445 445 A 36 VAL HGx% A 37 ASP H 1.0 0.0 4.29 446 446 A 20 TYR HD% A 28 VAL HGy% 1.0 0.0 3.93 447 447 A 50 VAL HGx% A 42 TYR HD% 1.0 0.0 5.42 448 448 A 20 TYR HE% A 28 VAL HGy% 1.0 0.0 4.61 449 449 A 36 VAL HGx% A 60 ALA HA 1.0 0.0 3.58 450 450 A 25 ARG HA A 28 VAL HGy% 1.0 0.0 5.50 451 451 A 29 LYS HA A 28 VAL HGy% 1.0 0.0 5.32 452 452 A 36 VAL HA A 36 VAL HGx% 1.0 0.0 3.21 453 453 A 28 VAL HA A 28 VAL HGy% 1.0 0.0 3.49 454 454 A 20 TYR HBx A 28 VAL HGy% 1.0 0.0 5.03 455 455 A 36 VAL HGx% A 35 PRO HBx 1.0 0.0 4.09 456 456 A 50 VAL HGx% A 48 ARG HBx 1.0 0.0 4.06 457 457 A 50 VAL HGx% A 54 LYS HGx 1.0 0.0 4.97 458 458 A 36 VAL HGx% A 60 ALA HB% 1.0 0.0 3.31 459 459 A 23 LEU HDx% A 28 VAL HGy% 1.0 0.0 4.30 460 460 A 60 ALA H A 59 LEU HDx% 1.0 0.0 4.58 461 461 A 59 LEU HA A 59 LEU HDx% 1.0 0.0 4.22 462 462 A 65 THR HA A 59 LEU HDx% 1.0 0.0 4.28 463 463 A 50 VAL HGy% A 51 VAL H 1.0 0.0 3.62 464 464 A 50 VAL HGy% A 72 ARG H 1.0 0.0 3.88 465 465 A 75 ARG H A 74 VAL HGy% 1.0 0.0 4.01 466 466 A 69 THR HG2% A 69 THR H 1.0 0.0 4.11 467 467 A 50 VAL HGy% A 42 TYR HD% 1.0 0.0 5.03 468 468 A 43 VAL HGx% A 44 CYS HA 1.0 0.0 5.50 469 469 A 50 VAL HGy% A 73 CYS HA 1.0 0.0 4.27 470 470 A 50 VAL HGy% A 71 SER HA 1.0 0.0 4.63 471 471 A 24 THR HG2% A 23 LEU HA 1.0 0.0 4.12 472 472 A 69 THR HG2% A 69 THR HA 1.0 0.0 3.15 473 473 A 3 THR HG2% A 2 PRO HA 1.0 0.0 4.50 474 474 A 70 PRO HD2 A 69 THR HG2% 1.0 0.0 3.42 475 475 A 69 THR HG2% A 66 ASP HBy 1.0 0.0 5.05 476 476 A 42 TYR HBy A 43 VAL HGx% 1.0 0.0 4.91 477 477 A 50 VAL HGy% A 42 TYR HBy 1.0 0.0 3.83 478 478 A 24 THR HG2% A 27 GLN HGx 1.0 0.0 4.49 479 479 A 24 THR HG2% A 27 GLN HGy 1.0 0.0 4.22 480 480 A 50 VAL HGy% A 54 LYS HBy 1.0 0.0 4.06 481 481 A 53 PRO HG2 A 69 THR HG2% 1.0 0.0 3.71 482 482 A 50 VAL HGy% A 54 LYS HGy 1.0 0.0 4.04 483 483 A 50 VAL HGy% A 54 LYS HGx 1.0 0.0 3.79 484 484 A 36 VAL HGy% A 36 VAL H 1.0 0.0 3.80 485 485 A 55 VAL H A 55 VAL HGy% 1.0 0.0 4.13 486 486 A 20 TYR HD% A 28 VAL HGx% 1.0 0.0 3.93 487 487 A 29 LYS H A 28 VAL HGx% 1.0 0.0 4.47 488 488 A 20 TYR HE% A 28 VAL HGx% 1.0 0.0 4.61 489 489 A 55 VAL HA A 55 VAL HGy% 1.0 0.0 3.29 490 490 A 37 ASP HA A 36 VAL HGy% 1.0 0.0 3.85 491 491 A 60 ALA HA A 36 VAL HGy% 1.0 0.0 3.28 492 492 A 29 LYS HA A 28 VAL HGx% 1.0 0.0 5.32 493 493 A 28 VAL HA A 28 VAL HGx% 1.0 0.0 3.49 494 494 A 20 TYR HBx A 28 VAL HGx% 1.0 0.0 5.03 495 495 A 20 TYR HBy A 28 VAL HGx% 1.0 0.0 5.50 496 496 A 40 ILE HG2% A 20 TYR H 1.0 0.0 5.19 497 497 A 74 VAL H A 74 VAL HGx% 1.0 0.0 4.15 498 498 A 75 ARG H A 74 VAL HGx% 1.0 0.0 4.01 499 499 A 40 ILE HG2% A 56 ARG H 1.0 0.0 4.98 500 500 A 20 TYR HD% A 40 ILE HG2% 1.0 0.0 3.29 501 501 A 20 TYR HE% A 40 ILE HG2% 1.0 0.0 3.64 502 502 A 40 ILE HG2% A 42 TYR HE% 1.0 0.0 5.50 503 503 A 39 GLU HA A 40 ILE HG2% 1.0 0.0 4.43 504 504 A 40 ILE HG2% A 41 GLU HA 1.0 0.0 5.50 505 505 A 40 ILE HG2% A 20 TYR HA 1.0 0.0 4.32 506 506 A 40 ILE HG2% A 38 TYR HBy 1.0 0.0 4.75 507 507 A 40 ILE HG2% A 56 ARG HBx 1.0 0.0 5.50 508 508 A 40 ILE HG2% A 34 LEU HG 1.0 0.0 4.14 509 509 A 56 ARG H A 55 VAL HGx% 1.0 0.0 4.40 510 510 A 30 ALA H A 30 ALA HB% 1.0 0.0 2.94 511 511 A 44 CYS HA A 43 VAL HGy% 1.0 0.0 5.33 512 512 A 55 VAL HA A 55 VAL HGx% 1.0 0.0 3.29 513 513 A 43 VAL HGy% A 17 GLY HAy 1.0 0.0 4.44 514 514 A 42 TYR HA A 43 VAL HGy% 1.0 0.0 4.46 515 515 A 43 VAL HA A 43 VAL HGy% 1.0 0.0 3.83 516 516 A 43 VAL HGy% A 17 GLY HAx 1.0 0.0 4.44 517 517 A 19 ARG HBy A 43 VAL HGy% 1.0 0.0 4.51 518 518 A 18 ILE HB A 43 VAL HGy% 1.0 0.0 4.49 519 519 A 9 ILE HG2% A 30 ALA HB% 1.0 0.0 4.93 520 520 A 18 ILE HG2% A 20 TYR H 1.0 0.0 4.69 521 521 A 20 TYR HD% A 18 ILE HG2% 1.0 0.0 4.10 522 522 A 20 TYR HE% A 18 ILE HG2% 1.0 0.0 3.77 523 523 A 42 TYR HA A 18 ILE HG2% 1.0 0.0 4.57 524 524 A 18 ILE HA A 18 ILE HG2% 1.0 0.0 3.33 525 525 A 18 ILE HG2% A 19 ARG HBy 1.0 0.0 4.53 526 526 A 18 ILE HG2% A 40 ILE HB 1.0 0.0 3.21 527 527 A 18 ILE HG1x A 18 ILE HG2% 1.0 0.0 3.78 528 528 A 40 ILE HG1y A 18 ILE HG2% 1.0 0.0 4.38 529 529 A 40 ILE HG2% A 18 ILE HG2% 1.0 0.0 3.36 530 530 A 18 ILE HG1y A 18 ILE HG2% 1.0 0.0 3.60 531 531 A 40 ILE HD1% A 18 ILE HG2% 1.0 0.0 3.71 532 532 A 6 GLY H A 60 ALA HB% 1.0 0.0 5.50 533 533 A 60 ALA HB% A 61 ASN H 1.0 0.0 3.71 534 534 A 59 LEU HA A 60 ALA HB% 1.0 0.0 4.36 535 535 A 36 VAL HA A 60 ALA HB% 1.0 0.0 5.21 536 536 A 60 ALA HB% A 61 ASN HBy 1.0 0.0 4.90 537 537 A 60 ALA HB% A 59 LEU HBy 1.0 0.0 4.66 538 538 A 36 VAL HB A 60 ALA HB% 1.0 0.0 4.17 539 539 A 60 ALA HB% A 36 VAL HGy% 1.0 0.0 3.16 540 540 A 64 TRP HE1 A 10 ILE HG2% 1.0 0.0 5.19 541 541 A 9 ILE HG2% A 9 ILE H 1.0 0.0 3.79 542 542 A 9 ILE HG2% A 10 ILE H 1.0 0.0 3.60 543 543 A 20 TYR HE% A 9 ILE HG2% 1.0 0.0 4.49 544 544 A 42 TYR HE% A 10 ILE HG2% 1.0 0.0 4.61 545 545 A 31 ILE HG2% A 34 LEU HA 1.0 0.0 4.06 546 546 A 8 GLN HA A 31 ILE HG2% 1.0 0.0 4.38 547 547 A 10 ILE HA A 10 ILE HG2% 1.0 0.0 3.31 548 548 A 31 ILE HA A 31 ILE HG2% 1.0 0.0 3.40 549 549 A 28 VAL HA A 9 ILE HG2% 1.0 0.0 4.72 550 550 A 9 ILE HG1x A 9 ILE HG2% 1.0 0.0 3.55 551 551 A 31 ILE HG1y A 31 ILE HG2% 1.0 0.0 3.38 552 552 A 9 ILE HG1y A 9 ILE HG2% 1.0 0.0 3.26 553 553 A 10 ILE HG1y A 10 ILE HG2% 1.0 0.0 3.50 554 554 A 10 ILE HG1x A 10 ILE HG2% 1.0 0.0 3.34 555 555 A 10 ILE HD1% A 10 ILE HG2% 1.0 0.0 3.18 556 556 A 40 ILE HD1% A 10 ILE HG2% 1.0 0.0 4.62 557 557 A 64 TRP HE1 A 67 MET HE% 1.0 0.0 5.35 558 558 A 63 SER HA A 67 MET HE% 1.0 0.0 4.98 559 559 A 10 ILE HA A 67 MET HE% 1.0 0.0 4.48 560 560 A 67 MET HA A 67 MET HE% 1.0 0.0 4.66 561 561 A 64 TRP HB2 A 67 MET HE% 1.0 0.0 4.18 562 562 A 67 MET HGx A 67 MET HE% 1.0 0.0 3.28 563 563 A 67 MET HGy A 67 MET HE% 1.0 0.0 3.72 564 564 A 10 ILE HG2% A 67 MET HE% 1.0 0.0 3.77 565 565 A 10 ILE HG1x A 67 MET HE% 1.0 0.0 4.50 566 566 A 10 ILE HD1% A 67 MET HE% 1.0 0.0 3.56 567 567 A 31 ILE HD1% A 32 ASN H 1.0 0.0 4.97 568 568 A 9 ILE HD1% A 8 GLN HE2y 1.0 0.0 5.50 569 569 A 20 TYR HE% A 9 ILE HD1% 1.0 0.0 4.50 570 570 A 9 ILE HD1% A 29 LYS HA 1.0 0.0 4.50 571 571 A 40 ILE HD1% A 57 LYS H 1.0 0.0 5.50 572 572 A 18 ILE HD1% A 18 ILE H 1.0 0.0 4.86 573 573 A 31 ILE H A 31 ILE HD1% 1.0 0.0 4.36 574 574 A 18 ILE HD1% A 10 ILE H 1.0 0.0 4.85 575 575 A 20 TYR HD% A 18 ILE HD1% 1.0 0.0 5.50 576 576 A 31 ILE HD1% A 20 TYR HD% 1.0 0.0 5.25 577 577 A 31 ILE HD1% A 29 LYS H 1.0 0.0 5.50 578 578 A 40 ILE HD1% A 64 TRP HE3 1.0 0.0 4.36 579 579 A 9 ILE HD1% A 30 ALA H 1.0 0.0 3.94 580 580 A 42 TYR HD% A 18 ILE HD1% 1.0 0.0 4.30 581 581 A 31 ILE HD1% A 20 TYR HE% 1.0 0.0 5.50 582 582 A 20 TYR HE% A 18 ILE HD1% 1.0 0.0 4.40 583 583 A 20 TYR HE% A 40 ILE HD1% 1.0 0.0 4.61 584 584 A 42 TYR HE% A 18 ILE HD1% 1.0 0.0 3.82 585 585 A 40 ILE HD1% A 42 TYR HE% 1.0 0.0 3.93 586 586 A 39 GLU HA A 40 ILE HD1% 1.0 0.0 5.20 587 587 A 41 GLU HA A 40 ILE HD1% 1.0 0.0 5.50 588 588 A 55 VAL HA A 40 ILE HD1% 1.0 0.0 5.50 589 589 A 42 TYR HA A 18 ILE HD1% 1.0 0.0 4.73 590 590 A 31 ILE HD1% A 34 LEU HA 1.0 0.0 4.88 591 591 A 18 ILE HA A 18 ILE HD1% 1.0 0.0 3.91 592 592 A 40 ILE HA A 40 ILE HD1% 1.0 0.0 4.28 593 593 A 31 ILE HD1% A 31 ILE HA 1.0 0.0 4.26 594 594 A 13 PRO HDy A 18 ILE HD1% 1.0 0.0 3.93 595 595 A 13 PRO HDx A 18 ILE HD1% 1.0 0.0 4.24 596 596 A 28 VAL HA A 9 ILE HD1% 1.0 0.0 4.37 597 597 A 40 ILE HD1% A 38 TYR HBy 1.0 0.0 5.45 598 598 A 40 ILE HD1% A 64 TRP HB2 1.0 0.0 5.50 599 599 A 31 ILE HD1% A 27 GLN HBy 1.0 0.0 4.81 600 600 A 56 ARG HBx A 40 ILE HD1% 1.0 0.0 4.25 601 601 A 56 ARG HGx A 40 ILE HD1% 1.0 0.0 4.56 602 602 A 18 ILE HD1% A 13 PRO HGx 1.0 0.0 4.05 603 603 A 31 ILE HD1% A 31 ILE HB 1.0 0.0 3.37 604 604 A 40 ILE HD1% A 34 LEU HG 1.0 0.0 5.50 605 605 A 40 ILE HD1% A 58 CYS HBx 1.0 0.0 5.25 606 606 A 9 ILE HD1% A 9 ILE HB 1.0 0.0 3.53 607 607 A 56 ARG HGy A 40 ILE HD1% 1.0 0.0 3.55 608 608 A 18 ILE HB A 18 ILE HD1% 1.0 0.0 3.28 609 609 A 40 ILE HD1% A 40 ILE HB 1.0 0.0 3.48 610 610 A 9 ILE HG2% A 9 ILE HD1% 1.0 0.0 2.89 611 611 A 18 ILE HD1% A 10 ILE HG2% 1.0 0.0 3.90 612 612 A 40 ILE HG2% A 40 ILE HD1% 1.0 0.0 3.05 613 613 A 40 ILE HG2% A 18 ILE HD1% 1.0 0.0 4.17 614 614 A 40 ILE HD1% A 18 ILE HD1% 1.0 0.0 3.52 615 615 A 18 ILE HG2% A 18 ILE HD1% 1.0 0.0 3.04 616 616 A 10 ILE HD1% A 40 ILE HD1% 1.0 0.0 2.94 617 617 A 10 ILE HD1% A 64 TRP HE3 1.0 0.0 4.94 618 618 A 20 TYR HE% A 10 ILE HD1% 1.0 0.0 5.50 619 619 A 10 ILE HD1% A 42 TYR HE% 1.0 0.0 4.95 620 620 A 10 ILE HD1% A 64 TRP HA 1.0 0.0 5.41 621 621 A 10 ILE HD1% A 63 SER HA 1.0 0.0 5.50 622 622 A 10 ILE HD1% A 67 MET HA 1.0 0.0 5.03 623 623 A 10 ILE HD1% A 56 ARG HDy 1.0 0.0 4.43 624 624 A 10 ILE HD1% A 64 TRP HB2 1.0 0.0 4.37 625 625 A 10 ILE HD1% A 56 ARG HDx 1.0 0.0 4.43 626 626 A 10 ILE HD1% A 56 ARG HBx 1.0 0.0 4.40 627 627 A 10 ILE HB A 10 ILE HD1% 1.0 0.0 3.68 628 628 A 10 ILE HD1% A 18 ILE HD1% 1.0 0.0 4.26 629 629 A 31 ILE H A 9 ILE HG1x 1.0 0.0 5.05 630 630 A 10 ILE HG1y A 18 ILE HD1% 1.0 0.0 5.19 631 631 A 42 TYR HD% A 13 PRO HDx 1.0 0.0 4.96 632 632 A 18 ILE HG1x A 19 ARG HBy 1.0 0.0 5.19 633 633 A 59 LEU HA A 36 VAL HGy% 1.0 0.0 3.20 634 634 A 31 ILE HD1% A 31 ILE HG2% 1.0 0.0 3.47 635 635 A 23 LEU HA A 23 LEU HDx% 1.0 0.0 4.06 636 636 A 9 ILE HD1% A 31 ILE HA 1.0 0.0 4.47 637 637 A 36 VAL HA A 35 PRO HA 1.0 0.0 5.00 638 638 A 36 VAL HA A 36 VAL HGy% 1.0 0.0 3.12 639 639 A 40 ILE HG2% A 40 ILE HG1x 1.0 0.0 2.72 640 640 A 40 ILE HA A 40 ILE HG1x 1.0 0.0 3.84 641 641 A 40 ILE HG1y A 40 ILE HG2% 1.0 0.0 3.43 642 642 A 45 ARG HBx A 45 ARG HDy 1.0 0.0 4.10 643 643 A 45 ARG HBx A 45 ARG HDx 1.0 0.0 4.10 644 644 A 50 VAL HA A 50 VAL HGx% 1.0 0.0 3.06 645 645 A 67 MET HA A 67 MET HGx 1.0 0.0 4.00 646 646 A 72 ARG HBx A 73 CYS H 1.0 0.0 3.77 647 647 A 74 VAL HA A 74 VAL HGy% 1.0 0.0 3.25 648 648 A 64 TRP H A 64 TRP HE1 1.0 0.0 5.02 649 649 A 10 ILE HA A 64 TRP HE1 1.0 0.0 4.82 650 650 A 64 TRP HB2 A 64 TRP HE1 1.0 0.0 5.09 651 651 A 64 TRP HE1 A 9 ILE H 1.0 0.0 5.19 652 652 A 9 ILE HA A 64 TRP HE1 1.0 0.0 4.27 653 653 A 7 CYS HBx A 64 TRP HE1 1.0 0.0 3.36 654 654 A 7 CYS HBy A 64 TRP HE1 1.0 0.0 3.69 655 655 A 10 ILE HB A 64 TRP HE1 1.0 0.0 5.50 656 656 A 10 ILE HG1y A 64 TRP HE1 1.0 0.0 3.64 657 657 A 10 ILE HG1x A 64 TRP HE1 1.0 0.0 3.86 658 658 A 10 ILE HD1% A 64 TRP HE1 1.0 0.0 3.84 659 659 A 51 VAL H A 50 VAL H 1.0 0.0 4.42 660 660 A 73 CYS HA A 51 VAL H 1.0 0.0 3.88 661 661 A 52 GLY HAy A 51 VAL H 1.0 0.0 5.22 662 662 A 51 VAL H A 72 ARG HA 1.0 0.0 5.50 663 663 A 51 VAL HB A 51 VAL H 1.0 0.0 3.00 664 664 A 51 VAL H A 72 ARG HGy 1.0 0.0 4.80 665 665 A 14 TRP HBy A 14 TRP HE1 1.0 0.0 4.87 666 666 A 14 TRP HE1 A 15 GLU HGy 1.0 0.0 5.32 667 667 A 14 TRP HE1 A 15 GLU HGx 1.0 0.0 5.32 668 668 A 20 TYR H A 19 ARG H 1.0 0.0 4.60 669 669 A 20 TYR HE% A 19 ARG H 1.0 0.0 5.14 670 670 A 41 GLU HA A 19 ARG H 1.0 0.0 5.02 671 671 A 20 TYR HA A 19 ARG H 1.0 0.0 5.16 672 672 A 42 TYR HA A 19 ARG H 1.0 0.0 4.01 673 673 A 18 ILE HA A 19 ARG H 1.0 0.0 2.85 674 674 A 19 ARG H A 19 ARG HDy 1.0 0.0 4.89 675 675 A 19 ARG H A 19 ARG HDx 1.0 0.0 4.89 676 676 A 19 ARG H A 41 GLU HBy 1.0 0.0 4.14 677 677 A 19 ARG HBy A 19 ARG H 1.0 0.0 3.38 678 678 A 19 ARG H A 19 ARG HBx 1.0 0.0 3.35 679 679 A 18 ILE HG1x A 19 ARG H 1.0 0.0 4.39 680 680 A 43 VAL HGx% A 19 ARG H 1.0 0.0 4.06 681 681 A 40 ILE HG2% A 19 ARG H 1.0 0.0 5.25 682 682 A 19 ARG H A 43 VAL HGy% 1.0 0.0 4.00 683 683 A 18 ILE HG1y A 19 ARG H 1.0 0.0 4.26 684 684 A 18 ILE HG2% A 19 ARG H 1.0 0.0 3.29 685 685 A 9 ILE H A 34 LEU H 1.0 0.0 4.89 686 686 A 64 TRP HZ2 A 34 LEU H 1.0 0.0 4.53 687 687 A 64 TRP HH2 A 34 LEU H 1.0 0.0 5.50 688 688 A 33 PHE HD% A 34 LEU H 1.0 0.0 4.46 689 689 A 33 PHE HA A 34 LEU H 1.0 0.0 2.88 690 690 A 8 GLN HA A 34 LEU H 1.0 0.0 4.22 691 691 A 9 ILE HA A 34 LEU H 1.0 0.0 5.32 692 692 A 35 PRO HDy A 34 LEU H 1.0 0.0 5.24 693 693 A 35 PRO HDx A 34 LEU H 1.0 0.0 4.98 694 694 A 33 PHE HBx A 34 LEU H 1.0 0.0 3.76 695 695 A 33 PHE HBy A 34 LEU H 1.0 0.0 4.54 696 696 A 7 CYS HBx A 34 LEU H 1.0 0.0 4.58 697 697 A 34 LEU HG A 34 LEU H 1.0 0.0 4.05 698 698 A 34 LEU HBx A 34 LEU H 1.0 0.0 3.23 699 699 A 34 LEU HBy A 34 LEU H 1.0 0.0 3.61 700 700 A 34 LEU H A 34 LEU HDy% 1.0 0.0 4.14 701 701 A 40 ILE H A 39 GLU H 1.0 0.0 4.23 702 702 A 38 TYR HD% A 39 GLU H 1.0 0.0 3.57 703 703 A 38 TYR HE% A 39 GLU H 1.0 0.0 4.24 704 704 A 38 TYR HA A 39 GLU H 1.0 0.0 2.60 705 705 A 38 TYR HBy A 39 GLU H 1.0 0.0 3.95 706 706 A 38 TYR HBx A 39 GLU H 1.0 0.0 4.27 707 707 A 39 GLU HGy A 39 GLU H 1.0 0.0 3.88 708 708 A 39 GLU HGx A 39 GLU H 1.0 0.0 4.45 709 709 A 39 GLU HBx A 39 GLU H 1.0 0.0 3.27 710 710 A 40 ILE HG2% A 39 GLU H 1.0 0.0 4.63 711 711 A 43 VAL HGx% A 42 TYR H 1.0 0.0 4.69 712 712 A 42 TYR H A 43 VAL H 1.0 0.0 4.79 713 713 A 42 TYR H A 42 TYR HD% 1.0 0.0 3.21 714 714 A 42 TYR H A 42 TYR HE% 1.0 0.0 4.59 715 715 A 42 TYR H A 41 GLU HA 1.0 0.0 2.78 716 716 A 54 LYS HA A 42 TYR H 1.0 0.0 3.90 717 717 A 10 ILE HA A 11 HIS H 1.0 0.0 2.76 718 718 A 42 TYR H A 42 TYR HBx 1.0 0.0 3.10 719 719 A 42 TYR H A 54 LYS HBx 1.0 0.0 3.86 720 720 A 42 TYR H A 54 LYS HDy 1.0 0.0 4.19 721 721 A 42 TYR H A 54 LYS HGy 1.0 0.0 4.66 722 722 A 42 TYR H A 54 LYS HGx 1.0 0.0 5.14 723 723 A 42 TYR H A 40 ILE HB 1.0 0.0 5.27 724 724 A 10 ILE HG1y A 11 HIS H 1.0 0.0 5.16 725 725 A 10 ILE HG2% A 11 HIS H 1.0 0.0 3.31 726 726 A 10 ILE HG1x A 11 HIS H 1.0 0.0 4.67 727 727 A 50 VAL HGy% A 42 TYR H 1.0 0.0 5.34 728 728 A 10 ILE HD1% A 11 HIS H 1.0 0.0 5.14 729 729 A 38 TYR H A 37 ASP H 1.0 0.0 3.21 730 730 A 38 TYR H A 39 GLU H 1.0 0.0 4.71 731 731 A 10 ILE H A 11 HIS H 1.0 0.0 4.68 732 732 A 38 TYR H A 38 TYR HD% 1.0 0.0 3.58 733 733 A 38 TYR H A 35 PRO HDy 1.0 0.0 5.50 734 734 A 38 TYR H A 38 TYR HBy 1.0 0.0 3.31 735 735 A 38 TYR H A 38 TYR HBx 1.0 0.0 2.98 736 736 A 38 TYR H A 58 CYS HBy 1.0 0.0 3.21 737 737 A 38 TYR H A 35 PRO HBy 1.0 0.0 5.50 738 738 A 38 TYR H A 39 GLU HGy 1.0 0.0 5.50 739 739 A 67 MET HE% A 11 HIS H 1.0 0.0 5.25 740 740 A 38 TYR H A 35 PRO HG2 1.0 0.0 3.67 741 741 A 38 TYR H A 58 CYS HBx 1.0 0.0 4.01 742 742 A 38 TYR H A 34 LEU HBy 1.0 0.0 4.55 743 743 A 38 TYR H A 58 CYS H 1.0 0.0 4.16 744 744 A 11 HIS HD2 A 11 HIS H 1.0 0.0 3.43 745 745 A 58 CYS H A 64 TRP HH2 1.0 0.0 4.80 746 746 A 58 CYS H A 57 LYS HA 1.0 0.0 2.70 747 747 A 38 TYR H A 57 LYS HA 1.0 0.0 5.50 748 748 A 38 TYR H A 35 PRO HA 1.0 0.0 5.20 749 749 A 58 CYS H A 59 LEU HA 1.0 0.0 5.49 750 750 A 58 CYS H A 38 TYR HBy 1.0 0.0 3.86 751 751 A 58 CYS H A 38 TYR HBx 1.0 0.0 4.75 752 752 A 58 CYS HBy A 58 CYS H 1.0 0.0 3.08 753 753 A 58 CYS H A 39 GLU HGy 1.0 0.0 4.88 754 754 A 58 CYS H A 39 GLU HGx 1.0 0.0 4.81 755 755 A 58 CYS H A 58 CYS HBx 1.0 0.0 2.97 756 756 A 58 CYS H A 40 ILE HG2% 1.0 0.0 5.50 757 757 A 9 ILE HA A 10 ILE H 1.0 0.0 3.16 758 758 A 9 ILE HB A 10 ILE H 1.0 0.0 4.49 759 759 A 9 ILE HG1x A 10 ILE H 1.0 0.0 4.46 760 760 A 10 ILE HB A 10 ILE H 1.0 0.0 3.83 761 761 A 9 ILE HG1y A 10 ILE H 1.0 0.0 5.03 762 762 A 10 ILE HG1y A 10 ILE H 1.0 0.0 4.03 763 763 A 10 ILE HG2% A 10 ILE H 1.0 0.0 4.08 764 764 A 10 ILE HG1x A 10 ILE H 1.0 0.0 3.98 765 765 A 10 ILE HD1% A 10 ILE H 1.0 0.0 4.50 766 766 A 8 GLN H A 64 TRP HE1 1.0 0.0 4.23 767 767 A 8 GLN H A 9 ILE H 1.0 0.0 4.67 768 768 A 64 TRP HD1 A 8 GLN H 1.0 0.0 5.50 769 769 A 8 GLN H A 33 PHE HE% 1.0 0.0 4.14 770 770 A 8 GLN H A 33 PHE HD% 1.0 0.0 4.03 771 771 A 7 CYS HA A 8 GLN H 1.0 0.0 2.77 772 772 A 8 GLN H A 8 GLN HBy 1.0 0.0 2.84 773 773 A 8 GLN H A 7 CYS HBy 1.0 0.0 3.77 774 774 A 74 VAL H A 50 VAL H 1.0 0.0 4.43 775 775 A 42 TYR H A 54 LYS H 1.0 0.0 5.43 776 776 A 42 TYR HD% A 54 LYS H 1.0 0.0 5.50 777 777 A 73 CYS HA A 50 VAL H 1.0 0.0 4.86 778 778 A 71 SER HA A 54 LYS H 1.0 0.0 5.50 779 779 A 52 GLY HAy A 54 LYS H 1.0 0.0 4.85 780 780 A 49 GLU HA A 50 VAL H 1.0 0.0 2.45 781 781 A 53 PRO HA A 54 LYS H 1.0 0.0 2.87 782 782 A 53 PRO HD2 A 54 LYS H 1.0 0.0 4.53 783 783 A 42 TYR HBx A 54 LYS H 1.0 0.0 4.71 784 784 A 54 LYS HBy A 54 LYS H 1.0 0.0 3.59 785 785 A 54 LYS HBx A 54 LYS H 1.0 0.0 2.88 786 786 A 54 LYS H A 54 LYS HGy 1.0 0.0 3.37 787 787 A 54 LYS H A 54 LYS HGx 1.0 0.0 3.36 788 788 A 54 LYS HGx A 50 VAL H 1.0 0.0 5.38 789 789 A 50 VAL HGx% A 50 VAL H 1.0 0.0 2.67 790 790 A 50 VAL HGy% A 54 LYS H 1.0 0.0 3.98 791 791 A 50 VAL HGy% A 50 VAL H 1.0 0.0 3.33 792 792 A 51 VAL H A 74 VAL H 1.0 0.0 3.48 793 793 A 73 CYS HA A 74 VAL H 1.0 0.0 2.74 794 794 A 50 VAL HA A 74 VAL H 1.0 0.0 3.89 795 795 A 74 VAL H A 73 CYS HBy 1.0 0.0 4.50 796 796 A 74 VAL H A 73 CYS HBx 1.0 0.0 4.50 797 797 A 74 VAL HB A 74 VAL H 1.0 0.0 3.67 798 798 A 50 VAL HB A 74 VAL H 1.0 0.0 3.90 799 799 A 72 ARG HGy A 74 VAL H 1.0 0.0 5.50 800 800 A 50 VAL HGx% A 74 VAL H 1.0 0.0 3.83 801 801 A 50 VAL HGy% A 74 VAL H 1.0 0.0 4.91 802 802 A 75 ARG H A 74 VAL H 1.0 0.0 4.25 803 803 A 14 TRP H A 14 TRP HE3 1.0 0.0 4.99 804 804 A 14 TRP H A 14 TRP HD1 1.0 0.0 5.38 805 805 A 64 TRP HA A 57 LYS H 1.0 0.0 4.88 806 806 A 13 PRO HA A 14 TRP H 1.0 0.0 3.04 807 807 A 56 ARG HA A 57 LYS H 1.0 0.0 2.90 808 808 A 65 THR HB A 57 LYS H 1.0 0.0 3.92 809 809 A 65 THR HA A 57 LYS H 1.0 0.0 4.47 810 810 A 14 TRP HBx A 14 TRP H 1.0 0.0 3.25 811 811 A 14 TRP HBy A 14 TRP H 1.0 0.0 3.27 812 812 A 14 TRP H A 13 PRO HBy 1.0 0.0 3.92 813 813 A 56 ARG HBx A 57 LYS H 1.0 0.0 3.49 814 814 A 56 ARG HGx A 57 LYS H 1.0 0.0 4.91 815 815 A 14 TRP H A 13 PRO HBx 1.0 0.0 3.92 816 816 A 13 PRO HGy A 14 TRP H 1.0 0.0 3.85 817 817 A 57 LYS HBy A 57 LYS H 1.0 0.0 3.20 818 818 A 56 ARG HBy A 57 LYS H 1.0 0.0 4.14 819 819 A 65 THR H A 64 TRP H 1.0 0.0 4.61 820 820 A 64 TRP HE3 A 64 TRP H 1.0 0.0 5.50 821 821 A 63 SER HA A 64 TRP H 1.0 0.0 2.67 822 822 A 64 TRP HB2 A 64 TRP H 1.0 0.0 2.90 823 823 A 64 TRP H A 67 MET HGx 1.0 0.0 3.93 824 824 A 64 TRP H A 67 MET HB2 1.0 0.0 4.10 825 825 A 64 TRP H A 67 MET HE% 1.0 0.0 4.02 826 826 A 10 ILE HG1x A 64 TRP H 1.0 0.0 5.36 827 827 A 10 ILE HD1% A 64 TRP H 1.0 0.0 4.78 828 828 A 71 SER HA A 72 ARG H 1.0 0.0 2.67 829 829 A 52 GLY HAx A 72 ARG H 1.0 0.0 4.31 830 830 A 25 ARG H A 25 ARG HDx 1.0 0.0 5.04 831 831 A 72 ARG H A 71 SER HBy 1.0 0.0 4.07 832 832 A 72 ARG H A 71 SER HBx 1.0 0.0 4.07 833 833 A 72 ARG HGx A 72 ARG H 1.0 0.0 3.23 834 834 A 9 ILE H A 8 GLN HE2x 1.0 0.0 4.59 835 835 A 25 ARG H A 24 THR HA 1.0 0.0 2.67 836 836 A 25 ARG H A 25 ARG HDy 1.0 0.0 5.04 837 837 A 20 TYR HBy A 23 LEU H 1.0 0.0 4.89 838 838 A 25 ARG H A 24 THR HG2% 1.0 0.0 3.38 839 839 A 45 ARG H A 17 GLY H 1.0 0.0 4.62 840 840 A 20 TYR H A 23 LEU H 1.0 0.0 5.25 841 841 A 25 ARG H A 24 THR H 1.0 0.0 4.47 842 842 A 24 THR H A 23 LEU H 1.0 0.0 4.60 843 843 A 25 ARG H A 27 GLN H 1.0 0.0 4.75 844 844 A 31 ILE H A 9 ILE H 1.0 0.0 4.19 845 845 A 48 ARG H A 45 ARG H 1.0 0.0 5.50 846 846 A 44 CYS HA A 45 ARG H 1.0 0.0 2.86 847 847 A 16 GLY HAx A 45 ARG H 1.0 0.0 3.42 848 848 A 33 PHE HA A 9 ILE H 1.0 0.0 4.55 849 849 A 24 THR HA A 23 LEU H 1.0 0.0 4.85 850 850 A 8 GLN HA A 9 ILE H 1.0 0.0 2.68 851 851 A 20 TYR HBx A 23 LEU H 1.0 0.0 4.49 852 852 A 45 ARG H A 44 CYS HBy 1.0 0.0 3.46 853 853 A 8 GLN HBy A 9 ILE H 1.0 0.0 3.65 854 854 A 8 GLN HBx A 9 ILE H 1.0 0.0 3.66 855 855 A 23 LEU HBy A 23 LEU H 1.0 0.0 4.03 856 856 A 45 ARG HBx A 45 ARG H 1.0 0.0 2.94 857 857 A 23 LEU HG A 23 LEU H 1.0 0.0 3.77 858 858 A 9 ILE HB A 9 ILE H 1.0 0.0 2.99 859 859 A 9 ILE HG1x A 9 ILE H 1.0 0.0 4.10 860 860 A 45 ARG HGx A 45 ARG H 1.0 0.0 3.89 861 861 A 23 LEU HBx A 23 LEU H 1.0 0.0 3.61 862 862 A 9 ILE HG1y A 9 ILE H 1.0 0.0 3.37 863 863 A 23 LEU HDy% A 23 LEU H 1.0 0.0 4.60 864 864 A 9 ILE HD1% A 9 ILE H 1.0 0.0 3.73 865 865 A 59 LEU H A 60 ALA H 1.0 0.0 4.76 866 866 A 49 GLU H A 74 VAL H 1.0 0.0 4.24 867 867 A 59 LEU HA A 60 ALA H 1.0 0.0 2.59 868 868 A 48 ARG HA A 49 GLU H 1.0 0.0 2.64 869 869 A 36 VAL HA A 60 ALA H 1.0 0.0 5.23 870 870 A 49 GLU H A 44 CYS HBx 1.0 0.0 4.90 871 871 A 49 GLU H A 44 CYS HBy 1.0 0.0 5.40 872 872 A 59 LEU HBy A 60 ALA H 1.0 0.0 3.34 873 873 A 36 VAL HB A 60 ALA H 1.0 0.0 3.97 874 874 A 49 GLU H A 48 ARG HBx 1.0 0.0 3.61 875 875 A 49 GLU H A 48 ARG HBy 1.0 0.0 3.72 876 876 A 49 GLU H A 48 ARG HGx 1.0 0.0 4.85 877 877 A 60 ALA HB% A 60 ALA H 1.0 0.0 2.40 878 878 A 50 VAL HGx% A 49 GLU H 1.0 0.0 4.25 879 879 A 60 ALA H A 36 VAL HGy% 1.0 0.0 2.95 880 880 A 40 ILE HA A 21 ARG H 1.0 0.0 4.24 881 881 A 21 ARG H A 22 GLY H 1.0 0.0 4.43 882 882 A 20 TYR H A 21 ARG H 1.0 0.0 4.48 883 883 A 39 GLU H A 21 ARG H 1.0 0.0 4.86 884 884 A 20 TYR HD% A 21 ARG H 1.0 0.0 4.55 885 885 A 38 TYR HD% A 21 ARG H 1.0 0.0 4.81 886 886 A 38 TYR HE% A 21 ARG H 1.0 0.0 4.18 887 887 A 20 TYR HA A 21 ARG H 1.0 0.0 2.89 888 888 A 46 GLY HA3 A 47 GLU H 1.0 0.0 2.80 889 889 A 38 TYR HBy A 21 ARG H 1.0 0.0 5.50 890 890 A 20 TYR HBy A 21 ARG H 1.0 0.0 4.19 891 891 A 47 GLU H A 44 CYS HBy 1.0 0.0 5.04 892 892 A 47 GLU H A 47 GLU HBy 1.0 0.0 4.17 893 893 A 21 ARG H A 21 ARG HGy 1.0 0.0 4.17 894 894 A 21 ARG H A 23 LEU HDx% 1.0 0.0 4.33 895 895 A 40 ILE HG2% A 21 ARG H 1.0 0.0 4.35 896 896 A 27 GLN H A 26 ASP H 1.0 0.0 2.99 897 897 A 27 GLN H A 29 LYS H 1.0 0.0 4.71 898 898 A 27 GLN H A 27 GLN HE2y 1.0 0.0 5.24 899 899 A 25 ARG HA A 27 GLN H 1.0 0.0 4.33 900 900 A 27 GLN H A 26 ASP HBy 1.0 0.0 3.84 901 901 A 27 GLN HGx A 27 GLN H 1.0 0.0 3.40 902 902 A 27 GLN H A 27 GLN HBx 1.0 0.0 3.23 903 903 A 24 THR HG2% A 27 GLN H 1.0 0.0 4.30 904 904 A 27 GLN H A 28 VAL HGy% 1.0 0.0 4.99 905 905 A 27 GLN H A 28 VAL HGx% 1.0 0.0 4.99 906 906 A 37 ASP H A 58 CYS H 1.0 0.0 3.92 907 907 A 37 ASP H A 36 VAL H 1.0 0.0 4.19 908 908 A 28 VAL H A 29 LYS H 1.0 0.0 3.24 909 909 A 37 ASP H A 57 LYS HA 1.0 0.0 5.49 910 910 A 35 PRO HA A 37 ASP H 1.0 0.0 5.39 911 911 A 37 ASP H A 59 LEU HA 1.0 0.0 5.50 912 912 A 37 ASP H A 37 ASP HA 1.0 0.0 2.87 913 913 A 37 ASP H A 37 ASP HBy 1.0 0.0 3.97 914 914 A 36 VAL HA A 37 ASP H 1.0 0.0 2.60 915 915 A 37 ASP H A 37 ASP HBx 1.0 0.0 3.97 916 916 A 58 CYS HBy A 37 ASP H 1.0 0.0 3.48 917 917 A 27 GLN HBy A 28 VAL H 1.0 0.0 3.31 918 918 A 28 VAL H A 27 GLN HBx 1.0 0.0 3.62 919 919 A 37 ASP H A 58 CYS HBx 1.0 0.0 3.82 920 920 A 72 ARG HGy A 73 CYS H 1.0 0.0 4.82 921 921 A 37 ASP H A 36 VAL HGy% 1.0 0.0 3.63 922 922 A 23 LEU HDy% A 28 VAL H 1.0 0.0 3.89 923 923 A 28 VAL H A 23 LEU HDx% 1.0 0.0 4.52 924 924 A 31 ILE HD1% A 28 VAL H 1.0 0.0 4.70 925 925 A 28 VAL H A 28 VAL HGy% 1.0 0.0 4.00 926 926 A 28 VAL H A 28 VAL HGx% 1.0 0.0 4.00 927 927 A 72 ARG H A 73 CYS H 1.0 0.0 4.72 928 928 A 73 CYS H A 74 VAL H 1.0 0.0 5.12 929 929 A 38 TYR H A 36 VAL H 1.0 0.0 5.16 930 930 A 30 ALA H A 28 VAL H 1.0 0.0 4.39 931 931 A 6 GLY HAy A 36 VAL H 1.0 0.0 4.54 932 932 A 72 ARG HA A 73 CYS H 1.0 0.0 3.09 933 933 A 35 PRO HA A 36 VAL H 1.0 0.0 2.58 934 934 A 31 ILE HA A 30 ALA H 1.0 0.0 4.90 935 935 A 60 ALA HA A 36 VAL H 1.0 0.0 5.29 936 936 A 30 ALA H A 29 LYS HA 1.0 0.0 3.55 937 937 A 6 GLY HAx A 36 VAL H 1.0 0.0 3.78 938 938 A 28 VAL HA A 30 ALA H 1.0 0.0 4.01 939 939 A 73 CYS H A 73 CYS HBy 1.0 0.0 4.00 940 940 A 73 CYS H A 73 CYS HBx 1.0 0.0 4.00 941 941 A 74 VAL HB A 73 CYS H 1.0 0.0 5.50 942 942 A 36 VAL H A 35 PRO HBx 1.0 0.0 3.43 943 943 A 50 VAL HB A 73 CYS H 1.0 0.0 4.05 944 944 A 36 VAL HB A 36 VAL H 1.0 0.0 2.83 945 945 A 30 ALA H A 29 LYS HBy 1.0 0.0 4.13 946 946 A 73 CYS H A 72 ARG HBy 1.0 0.0 4.21 947 947 A 30 ALA H A 29 LYS HBx 1.0 0.0 4.13 948 948 A 60 ALA HB% A 36 VAL H 1.0 0.0 5.48 949 949 A 31 ILE HG1y A 30 ALA H 1.0 0.0 4.22 950 950 A 30 ALA H A 29 LYS HGx 1.0 0.0 4.57 951 951 A 30 ALA H A 29 LYS HGy 1.0 0.0 4.57 952 952 A 36 VAL HGx% A 36 VAL H 1.0 0.0 2.63 953 953 A 44 CYS HA A 48 ARG H 1.0 0.0 5.50 954 954 A 49 GLU HA A 48 ARG H 1.0 0.0 4.93 955 955 A 50 VAL HGx% A 48 ARG H 1.0 0.0 5.50 956 956 A 56 ARG H A 57 LYS H 1.0 0.0 4.37 957 957 A 48 ARG H A 47 GLU H 1.0 0.0 3.50 958 958 A 56 ARG H A 40 ILE H 1.0 0.0 3.30 959 959 A 49 GLU H A 48 ARG H 1.0 0.0 4.49 960 960 A 56 ARG H A 64 TRP HE3 1.0 0.0 4.99 961 961 A 42 TYR HD% A 56 ARG H 1.0 0.0 5.30 962 962 A 56 ARG H A 42 TYR HE% 1.0 0.0 5.08 963 963 A 39 GLU HA A 56 ARG H 1.0 0.0 4.11 964 964 A 55 VAL HA A 56 ARG H 1.0 0.0 2.60 965 965 A 47 GLU HA A 48 ARG H 1.0 0.0 3.15 966 966 A 31 ILE HA A 32 ASN H 1.0 0.0 3.20 967 967 A 56 ARG H A 56 ARG HDy 1.0 0.0 5.50 968 968 A 48 ARG H A 48 ARG HDy 1.0 0.0 4.58 969 969 A 44 CYS HBx A 48 ARG H 1.0 0.0 4.36 970 970 A 48 ARG H A 48 ARG HDx 1.0 0.0 4.58 971 971 A 48 ARG H A 44 CYS HBy 1.0 0.0 3.78 972 972 A 32 ASN H A 32 ASN HBy 1.0 0.0 3.84 973 973 A 56 ARG H A 56 ARG HDx 1.0 0.0 5.50 974 974 A 48 ARG H A 47 GLU HBx 1.0 0.0 4.54 975 975 A 56 ARG HBx A 56 ARG H 1.0 0.0 3.94 976 976 A 56 ARG H A 55 VAL HB 1.0 0.0 3.13 977 977 A 48 ARG H A 47 GLU HBy 1.0 0.0 4.54 978 978 A 56 ARG H A 39 GLU HBy 1.0 0.0 4.93 979 979 A 31 ILE HG1x A 32 ASN H 1.0 0.0 4.16 980 980 A 31 ILE HG1y A 32 ASN H 1.0 0.0 5.05 981 981 A 56 ARG H A 40 ILE HB 1.0 0.0 5.25 982 982 A 56 ARG H A 55 VAL HGy% 1.0 0.0 4.40 983 983 A 31 ILE HG2% A 32 ASN H 1.0 0.0 3.80 984 984 A 9 ILE HD1% A 32 ASN H 1.0 0.0 5.50 985 985 A 56 ARG H A 40 ILE HG1x 1.0 0.0 3.54 986 986 A 40 ILE HD1% A 56 ARG H 1.0 0.0 3.95 987 987 A 31 ILE H A 9 ILE HD1% 1.0 0.0 4.16 988 988 A 19 ARG H A 18 ILE H 1.0 0.0 4.54 989 989 A 19 ARG H A 41 GLU H 1.0 0.0 3.58 990 990 A 18 ILE H A 17 GLY H 1.0 0.0 4.44 991 991 A 42 TYR H A 41 GLU H 1.0 0.0 4.37 992 992 A 31 ILE H A 32 ASN H 1.0 0.0 4.42 993 993 A 43 VAL H A 44 CYS H 1.0 0.0 4.48 994 994 A 14 TRP HE3 A 15 GLU H 1.0 0.0 5.25 995 995 A 48 ARG H A 44 CYS H 1.0 0.0 4.57 996 996 A 14 TRP HD1 A 15 GLU H 1.0 0.0 5.29 997 997 A 31 ILE H A 30 ALA H 1.0 0.0 4.02 998 998 A 20 TYR HE% A 18 ILE H 1.0 0.0 5.04 999 999 A 16 GLY HAx A 44 CYS H 1.0 0.0 5.50 1000 1000 A 18 ILE H A 17 GLY HAy 1.0 0.0 3.26 1001 1001 A 68 ASP HA A 69 THR H 1.0 0.0 3.46 1002 1002 A 43 VAL HA A 44 CYS H 1.0 0.0 2.63 1003 1003 A 15 GLU H A 14 TRP HA 1.0 0.0 3.37 1004 1004 A 40 ILE HA A 41 GLU H 1.0 0.0 2.76 1005 1005 A 69 THR HB A 69 THR H 1.0 0.0 3.44 1006 1006 A 70 PRO HD2 A 69 THR H 1.0 0.0 4.19 1007 1007 A 14 TRP HBx A 15 GLU H 1.0 0.0 4.51 1008 1008 A 64 TRP HB2 A 67 MET H 1.0 0.0 4.86 1009 1009 A 14 TRP HBy A 15 GLU H 1.0 0.0 4.43 1010 1010 A 44 CYS HBx A 44 CYS H 1.0 0.0 3.58 1011 1011 A 18 ILE H A 17 GLY HAx 1.0 0.0 3.26 1012 1012 A 44 CYS HBy A 44 CYS H 1.0 0.0 3.18 1013 1013 A 69 THR H A 70 PRO HBy 1.0 0.0 5.06 1014 1014 A 41 GLU H A 41 GLU HGy 1.0 0.0 5.06 1015 1015 A 43 VAL HB A 44 CYS H 1.0 0.0 2.95 1016 1016 A 41 GLU HBy A 41 GLU H 1.0 0.0 3.15 1017 1017 A 31 ILE H A 31 ILE HB 1.0 0.0 3.40 1018 1018 A 15 GLU H A 15 GLU HGy 1.0 0.0 4.37 1019 1019 A 19 ARG HBy A 41 GLU H 1.0 0.0 3.75 1020 1020 A 15 GLU H A 15 GLU HGx 1.0 0.0 4.37 1021 1021 A 31 ILE H A 30 ALA HB% 1.0 0.0 3.44 1022 1022 A 18 ILE HB A 18 ILE H 1.0 0.0 3.27 1023 1023 A 19 ARG HBx A 41 GLU H 1.0 0.0 3.96 1024 1024 A 31 ILE H A 31 ILE HG1y 1.0 0.0 3.61 1025 1025 A 40 ILE HB A 41 GLU H 1.0 0.0 3.06 1026 1026 A 18 ILE HG1x A 18 ILE H 1.0 0.0 4.78 1027 1027 A 50 VAL HGx% A 44 CYS H 1.0 0.0 3.74 1028 1028 A 40 ILE HG1y A 41 GLU H 1.0 0.0 3.93 1029 1029 A 31 ILE H A 31 ILE HG2% 1.0 0.0 4.00 1030 1030 A 43 VAL HGx% A 44 CYS H 1.0 0.0 3.86 1031 1031 A 43 VAL HGx% A 41 GLU H 1.0 0.0 4.96 1032 1032 A 43 VAL HGx% A 18 ILE H 1.0 0.0 5.16 1033 1033 A 40 ILE HG2% A 41 GLU H 1.0 0.0 3.68 1034 1034 A 43 VAL HGy% A 44 CYS H 1.0 0.0 3.68 1035 1035 A 43 VAL HGy% A 18 ILE H 1.0 0.0 3.85 1036 1036 A 18 ILE HD1% A 41 GLU H 1.0 0.0 5.07 1037 1037 A 18 ILE HG1y A 18 ILE H 1.0 0.0 4.51 1038 1038 A 18 ILE HG2% A 18 ILE H 1.0 0.0 3.87 1039 1039 A 18 ILE HG2% A 41 GLU H 1.0 0.0 3.78 1040 1040 A 40 ILE HD1% A 41 GLU H 1.0 0.0 4.64 1041 1041 A 3 THR H A 4 SER H 1.0 0.0 3.95 1042 1042 A 4 SER H A 3 THR HB 1.0 0.0 3.91 1043 1043 A 3 THR HG2% A 4 SER H 1.0 0.0 4.27 1044 1044 A 10 ILE HD1% A 67 MET H 1.0 0.0 5.36 1045 1045 A 72 ARG H A 71 SER H 1.0 0.0 4.61 1046 1046 A 42 TYR HE% A 71 SER H 1.0 0.0 4.95 1047 1047 A 52 GLY HAy A 71 SER H 1.0 0.0 5.42 1048 1048 A 70 PRO HA A 71 SER H 1.0 0.0 2.80 1049 1049 A 53 PRO HD2 A 71 SER H 1.0 0.0 5.40 1050 1050 A 71 SER H A 71 SER HBy 1.0 0.0 3.64 1051 1051 A 71 SER H A 71 SER HBx 1.0 0.0 3.64 1052 1052 A 53 PRO HG2 A 71 SER H 1.0 0.0 5.50 1053 1053 A 7 CYS H A 34 LEU H 1.0 0.0 3.33 1054 1054 A 7 CYS H A 8 GLN H 1.0 0.0 4.40 1055 1055 A 7 CYS H A 36 VAL H 1.0 0.0 5.34 1056 1056 A 6 GLY H A 7 CYS H 1.0 0.0 4.42 1057 1057 A 7 CYS H A 64 TRP HZ2 1.0 0.0 5.06 1058 1058 A 7 CYS H A 33 PHE HD% 1.0 0.0 4.41 1059 1059 A 7 CYS H A 6 GLY HAy 1.0 0.0 2.86 1060 1060 A 7 CYS H A 8 GLN HA 1.0 0.0 5.11 1061 1061 A 7 CYS H A 58 CYS HA 1.0 0.0 5.48 1062 1062 A 70 PRO HD2 A 71 SER H 1.0 0.0 5.50 1063 1063 A 7 CYS H A 6 GLY HAx 1.0 0.0 2.99 1064 1064 A 36 VAL HA A 7 CYS H 1.0 0.0 5.13 1065 1065 A 7 CYS H A 33 PHE HBx 1.0 0.0 3.88 1066 1066 A 7 CYS H A 33 PHE HBy 1.0 0.0 4.84 1067 1067 A 70 PRO HBy A 71 SER H 1.0 0.0 4.16 1068 1068 A 7 CYS H A 7 CYS HBx 1.0 0.0 3.64 1069 1069 A 7 CYS H A 34 LEU HBx 1.0 0.0 3.20 1070 1070 A 70 PRO HBx A 71 SER H 1.0 0.0 3.92 1071 1071 A 7 CYS H A 34 LEU HBy 1.0 0.0 4.30 1072 1072 A 7 CYS H A 34 LEU HDy% 1.0 0.0 5.37 1073 1073 A 7 CYS H A 34 LEU HDx% 1.0 0.0 5.37 1074 1074 A 66 ASP H A 68 ASP H 1.0 0.0 5.32 1075 1075 A 59 LEU H A 63 SER H 1.0 0.0 4.81 1076 1076 A 68 ASP H A 67 MET H 1.0 0.0 2.76 1077 1077 A 64 TRP H A 63 SER H 1.0 0.0 4.40 1078 1078 A 61 ASN H A 63 SER H 1.0 0.0 4.53 1079 1079 A 61 ASN HD2y A 63 SER H 1.0 0.0 4.62 1080 1080 A 69 THR HA A 68 ASP H 1.0 0.0 5.06 1081 1081 A 61 ASN HA A 63 SER H 1.0 0.0 5.11 1082 1082 A 67 MET HA A 68 ASP H 1.0 0.0 3.55 1083 1083 A 69 THR HB A 68 ASP H 1.0 0.0 4.92 1084 1084 A 62 GLY HAx A 63 SER H 1.0 0.0 3.55 1085 1085 A 61 ASN HBx A 63 SER H 1.0 0.0 4.48 1086 1086 A 61 ASN HBy A 63 SER H 1.0 0.0 5.50 1087 1087 A 67 MET HGy A 63 SER H 1.0 0.0 5.50 1088 1088 A 59 LEU HG A 63 SER H 1.0 0.0 5.50 1089 1089 A 69 THR HG2% A 68 ASP H 1.0 0.0 5.17 1090 1090 A 43 VAL H A 19 ARG H 1.0 0.0 4.35 1091 1091 A 42 TYR HD% A 43 VAL H 1.0 0.0 4.49 1092 1092 A 44 CYS HA A 43 VAL H 1.0 0.0 5.07 1093 1093 A 42 TYR HA A 43 VAL H 1.0 0.0 2.77 1094 1094 A 18 ILE HA A 43 VAL H 1.0 0.0 3.49 1095 1095 A 42 TYR HBy A 43 VAL H 1.0 0.0 3.26 1096 1096 A 43 VAL H A 54 LYS HBy 1.0 0.0 5.39 1097 1097 A 43 VAL HB A 43 VAL H 1.0 0.0 4.07 1098 1098 A 19 ARG HBy A 43 VAL H 1.0 0.0 5.39 1099 1099 A 18 ILE HB A 43 VAL H 1.0 0.0 4.81 1100 1100 A 18 ILE HG1x A 43 VAL H 1.0 0.0 4.93 1101 1101 A 50 VAL HGx% A 43 VAL H 1.0 0.0 4.95 1102 1102 A 43 VAL HGx% A 43 VAL H 1.0 0.0 3.57 1103 1103 A 50 VAL HGy% A 43 VAL H 1.0 0.0 5.34 1104 1104 A 43 VAL H A 43 VAL HGy% 1.0 0.0 3.18 1105 1105 A 18 ILE HG1y A 43 VAL H 1.0 0.0 4.91 1106 1106 A 18 ILE HG2% A 43 VAL H 1.0 0.0 5.15 1107 1107 A 27 GLN HA A 26 ASP H 1.0 0.0 5.22 1108 1108 A 26 ASP H A 26 ASP HBy 1.0 0.0 3.96 1109 1109 A 26 ASP HBx A 26 ASP H 1.0 0.0 3.22 1110 1110 A 24 THR HG2% A 26 ASP H 1.0 0.0 4.99 1111 1111 A 38 TYR HD% A 40 ILE H 1.0 0.0 4.25 1112 1112 A 64 TRP HH2 A 40 ILE H 1.0 0.0 5.21 1113 1113 A 40 ILE H A 41 GLU H 1.0 0.0 4.51 1114 1114 A 39 GLU HA A 40 ILE H 1.0 0.0 2.68 1115 1115 A 55 VAL HA A 40 ILE H 1.0 0.0 4.63 1116 1116 A 56 ARG HA A 40 ILE H 1.0 0.0 5.34 1117 1117 A 29 LYS H A 26 ASP HA 1.0 0.0 5.50 1118 1118 A 56 ARG HBx A 40 ILE H 1.0 0.0 4.98 1119 1119 A 39 GLU HGx A 40 ILE H 1.0 0.0 4.47 1120 1120 A 40 ILE H A 39 GLU HBy 1.0 0.0 3.91 1121 1121 A 29 LYS H A 29 LYS HBy 1.0 0.0 3.72 1122 1122 A 29 LYS H A 29 LYS HBx 1.0 0.0 3.72 1123 1123 A 40 ILE H A 56 ARG HBy 1.0 0.0 4.02 1124 1124 A 29 LYS H A 29 LYS HGx 1.0 0.0 4.29 1125 1125 A 40 ILE HB A 40 ILE H 1.0 0.0 4.10 1126 1126 A 29 LYS H A 29 LYS HGy 1.0 0.0 4.29 1127 1127 A 40 ILE HG1y A 40 ILE H 1.0 0.0 3.57 1128 1128 A 23 LEU HDy% A 29 LYS H 1.0 0.0 5.50 1129 1129 A 29 LYS H A 28 VAL HGy% 1.0 0.0 4.47 1130 1130 A 10 ILE HD1% A 40 ILE H 1.0 0.0 5.50 1131 1131 A 40 ILE HD1% A 40 ILE H 1.0 0.0 3.99 1132 1132 A 66 ASP H A 65 THR H 1.0 0.0 4.48 1133 1133 A 66 ASP H A 67 MET H 1.0 0.0 3.55 1134 1134 A 66 ASP H A 66 ASP HA 1.0 0.0 2.61 1135 1135 A 66 ASP H A 65 THR HA 1.0 0.0 2.58 1136 1136 A 66 ASP H A 66 ASP HBx 1.0 0.0 4.00 1137 1137 A 66 ASP H A 66 ASP HBy 1.0 0.0 4.00 1138 1138 A 66 ASP H A 67 MET HB2 1.0 0.0 4.35 1139 1139 A 66 ASP H A 65 THR HG2% 1.0 0.0 3.94 1140 1140 A 52 GLY H A 51 VAL H 1.0 0.0 4.10 1141 1141 A 52 GLY H A 72 ARG H 1.0 0.0 4.64 1142 1142 A 2 PRO HA A 3 THR H 1.0 0.0 2.95 1143 1143 A 51 VAL HA A 52 GLY H 1.0 0.0 2.47 1144 1144 A 3 THR H A 3 THR HB 1.0 0.0 3.92 1145 1145 A 3 THR H A 2 PRO HDx 1.0 0.0 5.50 1146 1146 A 3 THR H A 2 PRO HDy 1.0 0.0 5.50 1147 1147 A 52 GLY HAx A 52 GLY H 1.0 0.0 2.88 1148 1148 A 3 THR HG2% A 3 THR H 1.0 0.0 3.73 1149 1149 A 50 VAL HGy% A 52 GLY H 1.0 0.0 4.02 1150 1150 A 55 VAL H A 42 TYR H 1.0 0.0 4.88 1151 1151 A 55 VAL H A 56 ARG H 1.0 0.0 4.40 1152 1152 A 55 VAL H A 54 LYS HA 1.0 0.0 3.43 1153 1153 A 55 VAL H A 42 TYR HBx 1.0 0.0 4.85 1154 1154 A 55 VAL H A 53 PRO HBx 1.0 0.0 4.22 1155 1155 A 55 VAL H A 54 LYS HGy 1.0 0.0 4.59 1156 1156 A 23 LEU HBx A 22 GLY H 1.0 0.0 4.65 1157 1157 A 55 VAL H A 56 ARG HGy 1.0 0.0 4.94 1158 1158 A 55 VAL H A 55 VAL HGx% 1.0 0.0 4.13 1159 1159 A 23 LEU H A 22 GLY H 1.0 0.0 3.83 1160 1160 A 23 LEU HA A 22 GLY H 1.0 0.0 5.19 1161 1161 A 55 VAL H A 56 ARG HA 1.0 0.0 4.79 1162 1162 A 23 LEU HG A 22 GLY H 1.0 0.0 3.99 1163 1163 A 23 LEU HDx% A 22 GLY H 1.0 0.0 5.02 1164 1164 A 59 LEU H A 61 ASN H 1.0 0.0 4.54 1165 1165 A 60 ALA H A 61 ASN H 1.0 0.0 3.96 1166 1166 A 6 GLY H A 61 ASN H 1.0 0.0 4.45 1167 1167 A 60 ALA HA A 61 ASN H 1.0 0.0 3.39 1168 1168 A 62 GLY HAx A 61 ASN H 1.0 0.0 4.86 1169 1169 A 61 ASN H A 61 ASN HBx 1.0 0.0 4.09 1170 1170 A 61 ASN H A 61 ASN HBy 1.0 0.0 3.81 1171 1171 A 36 VAL HB A 61 ASN H 1.0 0.0 4.22 1172 1172 A 8 GLN HBy A 8 GLN HE2y 1.0 0.0 4.59 1173 1173 A 8 GLN HBy A 8 GLN HE2x 1.0 0.0 4.88 1174 1174 A 8 GLN HBx A 8 GLN HE2y 1.0 0.0 4.62 1175 1175 A 8 GLN HBx A 8 GLN HE2x 1.0 0.0 4.92 1176 1176 A 9 ILE HG2% A 8 GLN HE2y 1.0 0.0 4.86 1177 1177 A 9 ILE HG2% A 8 GLN HE2x 1.0 0.0 5.50 1178 1178 A 65 THR H A 57 LYS H 1.0 0.0 3.22 1179 1179 A 65 THR H A 67 MET H 1.0 0.0 5.15 1180 1180 A 64 TRP HD1 A 65 THR H 1.0 0.0 5.48 1181 1181 A 65 THR H A 64 TRP HE3 1.0 0.0 3.66 1182 1182 A 57 LYS HA A 65 THR H 1.0 0.0 5.18 1183 1183 A 64 TRP HA A 65 THR H 1.0 0.0 2.83 1184 1184 A 56 ARG HA A 65 THR H 1.0 0.0 4.02 1185 1185 A 65 THR HB A 65 THR H 1.0 0.0 3.79 1186 1186 A 58 CYS HA A 65 THR H 1.0 0.0 4.58 1187 1187 A 65 THR H A 56 ARG HDy 1.0 0.0 4.99 1188 1188 A 64 TRP HB2 A 65 THR H 1.0 0.0 3.56 1189 1189 A 65 THR H A 67 MET HGx 1.0 0.0 5.34 1190 1190 A 67 MET HGy A 65 THR H 1.0 0.0 5.50 1191 1191 A 65 THR H A 56 ARG HDx 1.0 0.0 4.99 1192 1192 A 56 ARG HBx A 65 THR H 1.0 0.0 3.67 1193 1193 A 56 ARG HGx A 65 THR H 1.0 0.0 5.50 1194 1194 A 59 LEU HG A 65 THR H 1.0 0.0 3.94 1195 1195 A 65 THR HG2% A 65 THR H 1.0 0.0 2.79 1196 1196 A 65 THR H A 56 ARG HBy 1.0 0.0 4.93 1197 1197 A 65 THR H A 59 LEU HDx% 1.0 0.0 4.62 1198 1198 A 65 THR H A 59 LEU HDy% 1.0 0.0 4.62 1199 1199 A 10 ILE HD1% A 65 THR H 1.0 0.0 5.14 1200 1200 A 24 THR H A 27 GLN H 1.0 0.0 4.60 1201 1201 A 23 LEU HA A 24 THR H 1.0 0.0 3.00 1202 1202 A 27 GLN HA A 24 THR H 1.0 0.0 5.31 1203 1203 A 27 GLN HGy A 24 THR H 1.0 0.0 3.34 1204 1204 A 24 THR H A 27 GLN HBx 1.0 0.0 3.77 1205 1205 A 24 THR H A 23 LEU HBy 1.0 0.0 4.04 1206 1206 A 23 LEU HG A 24 THR H 1.0 0.0 4.78 1207 1207 A 24 THR HG2% A 24 THR H 1.0 0.0 3.14 1208 1208 A 23 LEU HDy% A 24 THR H 1.0 0.0 3.73 1209 1209 A 23 LEU HG A 27 GLN HE2x 1.0 0.0 5.36 1210 1210 A 24 THR H A 27 GLN HE2x 1.0 0.0 5.06 1211 1211 A 24 THR H A 27 GLN HE2y 1.0 0.0 4.90 1212 1212 A 23 LEU HA A 27 GLN HE2y 1.0 0.0 4.93 1213 1213 A 24 THR HA A 27 GLN HE2y 1.0 0.0 5.50 1214 1214 A 24 THR HB A 27 GLN HE2y 1.0 0.0 5.50 1215 1215 A 27 GLN HA A 27 GLN HE2x 1.0 0.0 5.50 1216 1216 A 27 GLN HA A 27 GLN HE2y 1.0 0.0 4.83 1217 1217 A 27 GLN HBy A 27 GLN HE2x 1.0 0.0 3.93 1218 1218 A 27 GLN HBy A 27 GLN HE2y 1.0 0.0 3.53 1219 1219 A 27 GLN HE2x A 27 GLN HBx 1.0 0.0 4.39 1220 1220 A 27 GLN HBx A 27 GLN HE2y 1.0 0.0 4.35 1221 1221 A 23 LEU HG A 27 GLN HE2y 1.0 0.0 5.25 1222 1222 A 23 LEU HBx A 27 GLN HE2y 1.0 0.0 4.81 1223 1223 A 24 THR HG2% A 27 GLN HE2x 1.0 0.0 4.29 1224 1224 A 24 THR HG2% A 27 GLN HE2y 1.0 0.0 4.16 1225 1225 A 23 LEU HDy% A 27 GLN HE2x 1.0 0.0 3.96 1226 1226 A 23 LEU HDy% A 27 GLN HE2y 1.0 0.0 3.88 1227 1227 A 23 LEU HDx% A 27 GLN HE2y 1.0 0.0 4.87 1228 1228 A 45 ARG HA A 46 GLY H 1.0 0.0 2.71 1229 1229 A 46 GLY H A 45 ARG HDx 1.0 0.0 4.50 1230 1230 A 45 ARG HBy A 46 GLY H 1.0 0.0 3.24 1231 1231 A 45 ARG HGx A 46 GLY H 1.0 0.0 4.09 1232 1232 A 45 ARG HGy A 46 GLY H 1.0 0.0 4.60 1233 1233 A 61 ASN HA A 62 GLY H 1.0 0.0 3.57 1234 1234 A 61 ASN HBx A 62 GLY H 1.0 0.0 4.47 1235 1235 A 61 ASN HBy A 62 GLY H 1.0 0.0 4.46 1236 1236 A 43 VAL H A 17 GLY H 1.0 0.0 3.78 1237 1237 A 17 GLY H A 16 GLY H 1.0 0.0 4.63 1238 1238 A 44 CYS HA A 17 GLY H 1.0 0.0 4.13 1239 1239 A 16 GLY HAx A 17 GLY H 1.0 0.0 3.49 1240 1240 A 42 TYR HA A 17 GLY H 1.0 0.0 5.50 1241 1241 A 16 GLY HAy A 17 GLY H 1.0 0.0 3.36 1242 1242 A 13 PRO HDy A 17 GLY H 1.0 0.0 5.50 1243 1243 A 13 PRO HDx A 17 GLY H 1.0 0.0 4.50 1244 1244 A 13 PRO HGx A 17 GLY H 1.0 0.0 4.38 1245 1245 A 13 PRO HGy A 17 GLY H 1.0 0.0 4.12 1246 1246 A 45 ARG HBx A 17 GLY H 1.0 0.0 5.50 1247 1247 A 45 ARG HGx A 17 GLY H 1.0 0.0 5.25 1248 1248 A 50 VAL HGx% A 17 GLY H 1.0 0.0 5.50 1249 1249 A 43 VAL HGx% A 17 GLY H 1.0 0.0 5.50 1250 1250 A 43 VAL HGy% A 17 GLY H 1.0 0.0 3.84 1251 1251 A 61 ASN HD2y A 59 LEU HBy 1.0 0.0 4.72 1252 1252 A 63 SER H A 61 ASN HD2x 1.0 0.0 4.87 1253 1253 A 63 SER HA A 61 ASN HD2y 1.0 0.0 5.24 1254 1254 A 61 ASN HA A 61 ASN HD2x 1.0 0.0 4.36 1255 1255 A 61 ASN HBx A 61 ASN HD2x 1.0 0.0 3.49 1256 1256 A 61 ASN HD2y A 61 ASN HBx 1.0 0.0 3.66 1257 1257 A 59 LEU HBy A 61 ASN HD2x 1.0 0.0 5.45 1258 1258 A 59 LEU HBx A 61 ASN HD2x 1.0 0.0 4.87 1259 1259 A 61 ASN HD2y A 59 LEU HBx 1.0 0.0 4.80 1260 1260 A 6 GLY H A 33 PHE HD% 1.0 0.0 4.77 1261 1261 A 6 GLY H A 5 GLU HA 1.0 0.0 2.77 1262 1262 A 6 GLY H A 33 PHE HBx 1.0 0.0 4.56 1263 1263 A 6 GLY H A 33 PHE HBy 1.0 0.0 4.99 1264 1264 A 6 GLY H A 36 VAL HB 1.0 0.0 5.27 1265 1265 A 6 GLY H A 5 GLU HBx 1.0 0.0 4.59 1266 1266 A 6 GLY H A 5 GLU HBy 1.0 0.0 4.59 1267 1267 A 44 CYS HA A 16 GLY H 1.0 0.0 5.19 1268 1268 A 45 ARG H A 16 GLY H 1.0 0.0 5.02 1269 1269 A 15 GLU H A 16 GLY H 1.0 0.0 4.50 1270 1270 A 14 TRP HBy A 16 GLY H 1.0 0.0 5.50 1271 1271 A 13 PRO HGy A 16 GLY H 1.0 0.0 5.15 1272 1272 A 10 ILE HB A 11 HIS H 1.0 0.0 3.99 1273 1273 A 42 TYR H A 56 ARG H 1.0 0.0 5.50 1274 1274 A 68 ASP H A 69 THR H 1.0 0.0 3.45 1275 1275 A 3 THR HA A 4 SER H 1.0 0.0 2.64 1276 1276 A 6 GLY HAy A 5 GLU H 1.0 0.0 4.86 1277 1277 A 4 SER HA A 5 GLU H 1.0 0.0 2.70 1278 1278 A 40 ILE HB A 19 ARG H 1.0 0.0 4.14 1279 1279 A 19 ARG H A 19 ARG HGy 1.0 0.0 5.06 1280 1280 A 34 LEU H A 34 LEU HDx% 1.0 0.0 4.14 1281 1281 A 24 THR HB A 24 THR H 1.0 0.0 4.17 1282 1282 A 27 GLN HGy A 27 GLN H 1.0 0.0 3.31 1283 1283 A 32 ASN H A 32 ASN HBx 1.0 0.0 3.84 1284 1284 A 40 ILE H A 40 ILE HG1x 1.0 0.0 3.11 1285 1285 A 40 ILE HG2% A 40 ILE H 1.0 0.0 3.23 1286 1286 A 41 GLU H A 41 GLU HGx 1.0 0.0 5.06 1287 1287 A 41 GLU HBx A 41 GLU H 1.0 0.0 3.43 1288 1288 A 42 TYR HBy A 42 TYR H 1.0 0.0 3.67 1289 1289 A 45 ARG HBy A 45 ARG H 1.0 0.0 3.37 1290 1290 A 48 ARG HBx A 48 ARG H 1.0 0.0 3.15 1291 1291 A 50 VAL HA A 51 VAL H 1.0 0.0 2.56 1292 1292 A 55 VAL H A 55 VAL HB 1.0 0.0 3.74 1293 1293 A 56 ARG HGx A 56 ARG H 1.0 0.0 3.64 1294 1294 A 56 ARG H A 56 ARG HBy 1.0 0.0 3.48 1295 1295 A 57 LYS HBx A 57 LYS H 1.0 0.0 3.33 1296 1296 A 64 TRP HD1 A 64 TRP H 1.0 0.0 3.28 1297 1297 A 67 MET HGx A 67 MET H 1.0 0.0 3.83 1298 1298 A 68 ASP H A 68 ASP HBx 1.0 0.0 3.76 1299 1299 A 50 VAL HB A 72 ARG H 1.0 0.0 4.02 1300 1300 A 72 ARG H A 72 ARG HBy 1.0 0.0 3.43 1301 1301 A 72 ARG H A 72 ARG HGy 1.0 0.0 3.62 1302 1302 A 74 VAL H A 74 VAL HGy% 1.0 0.0 4.15 1303 1303 A 20 TYR HA A 38 TYR HD% 1.0 0.0 4.28 1304 1304 A 40 ILE HA A 38 TYR HD% 1.0 0.0 4.54 1305 1305 A 38 TYR HA A 38 TYR HD% 1.0 0.0 3.55 1306 1306 A 38 TYR HD% A 35 PRO HDx 1.0 0.0 3.51 1307 1307 A 35 PRO HG2 A 38 TYR HD% 1.0 0.0 3.62 1308 1308 A 38 TYR HD% A 34 LEU HG 1.0 0.0 4.69 1309 1309 A 34 LEU HBy A 38 TYR HD% 1.0 0.0 4.07 1310 1310 A 40 ILE HG2% A 38 TYR HD% 1.0 0.0 2.95 1311 1311 A 33 PHE HA A 33 PHE HD% 1.0 0.0 3.89 1312 1312 A 6 GLY HAy A 33 PHE HD% 1.0 0.0 4.12 1313 1313 A 8 GLN HA A 33 PHE HD% 1.0 0.0 3.99 1314 1314 A 6 GLY HAx A 33 PHE HD% 1.0 0.0 4.87 1315 1315 A 31 ILE HG2% A 33 PHE HD% 1.0 0.0 5.50 1316 1316 A 64 TRP HD1 A 63 SER HA 1.0 0.0 4.24 1317 1317 A 10 ILE HG1y A 64 TRP HD1 1.0 0.0 4.57 1318 1318 A 64 TRP HD1 A 64 TRP HB2 1.0 0.0 3.39 1319 1319 A 64 TRP HD1 A 67 MET HE% 1.0 0.0 3.73 1320 1320 A 64 TRP HD1 A 7 CYS HBy 1.0 0.0 4.66 1321 1321 A 64 TRP HD1 A 10 ILE HG2% 1.0 0.0 4.71 1322 1322 A 10 ILE HG1x A 64 TRP HD1 1.0 0.0 4.42 1323 1323 A 10 ILE HD1% A 64 TRP HD1 1.0 0.0 3.71 1324 1324 A 14 TRP HD1 A 14 TRP HA 1.0 0.0 4.54 1325 1325 A 14 TRP HBy A 14 TRP HD1 1.0 0.0 3.73 1326 1326 A 34 LEU HG A 64 TRP HH2 1.0 0.0 4.39 1327 1327 A 64 TRP HH2 A 58 CYS HBx 1.0 0.0 5.04 1328 1328 A 40 ILE HG2% A 64 TRP HH2 1.0 0.0 3.95 1329 1329 A 14 TRP HE3 A 14 TRP HA 1.0 0.0 4.08 1330 1330 A 64 TRP HE3 A 57 LYS H 1.0 0.0 4.24 1331 1331 A 58 CYS HA A 64 TRP HE3 1.0 0.0 4.19 1332 1332 A 56 ARG HBx A 64 TRP HE3 1.0 0.0 3.63 1333 1333 A 56 ARG HBy A 64 TRP HE3 1.0 0.0 3.70 1334 1334 A 58 CYS H A 64 TRP HE3 1.0 0.0 3.90 1335 1335 A 57 LYS HA A 64 TRP HE3 1.0 0.0 4.02 1336 1336 A 64 TRP HA A 64 TRP HE3 1.0 0.0 3.78 1337 1337 A 10 ILE HA A 11 HIS HD2 1.0 0.0 4.89 1338 1338 A 20 TYR HD% A 38 TYR HE% 1.0 0.0 2.51 1339 1339 A 20 TYR HA A 38 TYR HE% 1.0 0.0 3.70 1340 1340 A 40 ILE HA A 38 TYR HE% 1.0 0.0 4.47 1341 1341 A 38 TYR HA A 38 TYR HE% 1.0 0.0 4.56 1342 1342 A 38 TYR HE% A 35 PRO HDx 1.0 0.0 4.70 1343 1343 A 38 TYR HE% A 20 TYR HBx 1.0 0.0 4.03 1344 1344 A 35 PRO HG2 A 38 TYR HE% 1.0 0.0 4.39 1345 1345 A 38 TYR HE% A 34 LEU HG 1.0 0.0 5.02 1346 1346 A 40 ILE HG2% A 38 TYR HE% 1.0 0.0 3.02 1347 1347 A 9 ILE HA A 64 TRP HZ2 1.0 0.0 3.97 1348 1348 A 7 CYS HBx A 64 TRP HZ2 1.0 0.0 4.45 1349 1349 A 34 LEU HG A 64 TRP HZ2 1.0 0.0 4.56 1350 1350 A 34 LEU HBx A 64 TRP HZ2 1.0 0.0 3.51 1351 1351 A 34 LEU HBy A 64 TRP HZ2 1.0 0.0 4.08 1352 1352 A 10 ILE HG1y A 64 TRP HZ2 1.0 0.0 4.44 1353 1353 A 64 TRP HZ2 A 34 LEU HDy% 1.0 0.0 3.48 1354 1354 A 64 TRP HZ2 A 34 LEU HDx% 1.0 0.0 3.48 1355 1355 A 10 ILE HD1% A 64 TRP HZ2 1.0 0.0 4.64 1356 1356 A 64 TRP HZ2 A 38 TYR HBy 1.0 0.0 5.36 1357 1357 A 3 THR H A 2 PRO HBx 1.0 0.0 3.96 1358 1357 A 3 THR H A 2 PRO HBy 1.0 0.0 3.96 1359 1358 A 3 THR H A 4 SER HBx 1.0 0.0 5.34 1360 1358 A 3 THR H A 4 SER HBy 1.0 0.0 5.34 1361 1359 A 4 SER H A 4 SER HBx 1.0 0.0 3.06 1362 1359 A 4 SER H A 4 SER HBy 1.0 0.0 3.06 1363 1360 A 4 SER H A 5 GLU HG2 1.0 0.0 4.18 1364 1360 A 4 SER H A 5 GLU HG3 1.0 0.0 4.18 1365 1361 A 4 SER HA A 5 GLU HG2 1.0 0.0 4.64 1366 1361 A 4 SER HA A 5 GLU HG3 1.0 0.0 4.64 1367 1362 A 5 GLU H A 4 SER HBx 1.0 0.0 3.95 1368 1362 A 5 GLU H A 4 SER HBy 1.0 0.0 3.95 1369 1363 A 5 GLU H A 5 GLU HBx 1.0 0.0 2.95 1370 1363 A 5 GLU H A 5 GLU HBy 1.0 0.0 2.95 1371 1364 A 5 GLU H A 5 GLU HG2 1.0 0.0 3.27 1372 1364 A 5 GLU H A 5 GLU HG3 1.0 0.0 3.27 1373 1365 A 5 GLU HA A 5 GLU HG2 1.0 0.0 3.50 1374 1365 A 5 GLU HA A 5 GLU HG3 1.0 0.0 3.50 1375 1366 A 6 GLY H A 5 GLU HBx 1.0 0.0 3.85 1376 1366 A 6 GLY H A 5 GLU HBy 1.0 0.0 3.85 1377 1367 A 6 GLY H A 5 GLU HG2 1.0 0.0 4.88 1378 1367 A 6 GLY H A 5 GLU HG3 1.0 0.0 4.88 1379 1368 A 7 CYS H A 34 LEU HDy% 1.0 0.0 4.25 1380 1368 A 7 CYS H A 34 LEU HDx% 1.0 0.0 4.25 1381 1369 A 8 GLN H A 8 GLN HGx 1.0 0.0 3.26 1382 1369 A 8 GLN H A 8 GLN HGy 1.0 0.0 3.26 1383 1370 A 8 GLN H A 34 LEU HDy% 1.0 0.0 4.72 1384 1370 A 8 GLN H A 34 LEU HDx% 1.0 0.0 4.72 1385 1371 A 8 GLN HA A 34 LEU HDy% 1.0 0.0 4.13 1386 1371 A 8 GLN HA A 34 LEU HDx% 1.0 0.0 4.13 1387 1372 A 8 GLN HBx A 34 LEU HDy% 1.0 0.0 4.62 1388 1372 A 8 GLN HBx A 34 LEU HDx% 1.0 0.0 4.62 1389 1373 A 8 GLN HE2y A 8 GLN HGx 1.0 0.0 3.02 1390 1373 A 8 GLN HE2y A 8 GLN HGy 1.0 0.0 3.02 1391 1374 A 8 GLN HE2x A 8 GLN HGx 1.0 0.0 3.53 1392 1374 A 8 GLN HE2x A 8 GLN HGy 1.0 0.0 3.53 1393 1375 A 9 ILE H A 8 GLN HGx 1.0 0.0 3.60 1394 1375 A 9 ILE H A 8 GLN HGy 1.0 0.0 3.60 1395 1376 A 9 ILE HA A 8 GLN HGx 1.0 0.0 5.34 1396 1376 A 9 ILE HA A 8 GLN HGy 1.0 0.0 5.34 1397 1377 A 33 PHE HD% A 8 GLN HGx 1.0 0.0 4.53 1398 1377 A 33 PHE HD% A 8 GLN HGy 1.0 0.0 4.53 1399 1378 A 33 PHE HE% A 8 GLN HGx 1.0 0.0 4.36 1400 1378 A 33 PHE HE% A 8 GLN HGy 1.0 0.0 4.36 1401 1379 A 64 TRP HE1 A 8 GLN HGx 1.0 0.0 4.63 1402 1379 A 64 TRP HE1 A 8 GLN HGy 1.0 0.0 4.63 1403 1380 A 9 ILE H A 34 LEU HDy% 1.0 0.0 3.50 1404 1380 A 9 ILE H A 34 LEU HDx% 1.0 0.0 3.50 1405 1381 A 9 ILE HA A 34 LEU HDy% 1.0 0.0 3.53 1406 1381 A 9 ILE HA A 34 LEU HDx% 1.0 0.0 3.53 1407 1382 A 9 ILE HG2% A 28 VAL HGy% 1.0 0.0 3.55 1408 1382 A 9 ILE HG2% A 28 VAL HGx% 1.0 0.0 3.55 1409 1383 A 9 ILE HG1x A 28 VAL HGy% 1.0 0.0 4.96 1410 1383 A 9 ILE HG1x A 28 VAL HGx% 1.0 0.0 4.96 1411 1384 A 9 ILE HG1x A 34 LEU HDy% 1.0 0.0 3.15 1412 1384 A 9 ILE HG1x A 34 LEU HDx% 1.0 0.0 3.15 1413 1385 A 9 ILE HG1y A 34 LEU HDy% 1.0 0.0 3.56 1414 1385 A 9 ILE HG1y A 34 LEU HDx% 1.0 0.0 3.56 1415 1386 A 9 ILE HD1% A 28 VAL HGy% 1.0 0.0 3.43 1416 1386 A 9 ILE HD1% A 28 VAL HGx% 1.0 0.0 3.43 1417 1387 A 10 ILE HA A 11 HIS HBy 1.0 0.0 4.54 1418 1387 A 10 ILE HA A 11 HIS HBx 1.0 0.0 4.54 1419 1388 A 10 ILE HB A 11 HIS HBy 1.0 0.0 5.34 1420 1388 A 10 ILE HB A 11 HIS HBx 1.0 0.0 5.34 1421 1389 A 10 ILE HG2% A 11 HIS HBy 1.0 0.0 4.63 1422 1389 A 10 ILE HG2% A 11 HIS HBx 1.0 0.0 4.63 1423 1390 A 10 ILE HD1% A 56 ARG HDx 1.0 0.0 3.78 1424 1390 A 10 ILE HD1% A 56 ARG HDy 1.0 0.0 3.78 1425 1391 A 11 HIS H A 11 HIS HBy 1.0 0.0 2.96 1426 1391 A 11 HIS H A 11 HIS HBx 1.0 0.0 2.96 1427 1392 A 14 TRP H A 13 PRO HBy 1.0 0.0 3.40 1428 1392 A 14 TRP H A 13 PRO HBx 1.0 0.0 3.40 1429 1393 A 14 TRP HA A 13 PRO HBy 1.0 0.0 5.08 1430 1393 A 14 TRP HA A 13 PRO HBx 1.0 0.0 5.08 1431 1394 A 14 TRP HBx A 13 PRO HBy 1.0 0.0 4.83 1432 1394 A 14 TRP HBx A 13 PRO HBx 1.0 0.0 4.83 1433 1395 A 14 TRP HD1 A 15 GLU HGy 1.0 0.0 4.62 1434 1395 A 14 TRP HD1 A 15 GLU HGx 1.0 0.0 4.62 1435 1396 A 14 TRP HE1 A 15 GLU HBx 1.0 0.0 4.49 1436 1396 A 14 TRP HE1 A 15 GLU HBy 1.0 0.0 4.49 1437 1397 A 14 TRP HE1 A 15 GLU HGy 1.0 0.0 4.47 1438 1397 A 14 TRP HE1 A 15 GLU HGx 1.0 0.0 4.47 1439 1398 A 16 GLY H A 15 GLU HGy 1.0 0.0 4.97 1440 1398 A 16 GLY H A 15 GLU HGx 1.0 0.0 4.97 1441 1399 A 43 VAL H A 17 GLY HAy 1.0 0.0 4.97 1442 1399 A 43 VAL H A 17 GLY HAx 1.0 0.0 4.97 1443 1400 A 43 VAL HGy% A 17 GLY HAy 1.0 0.0 3.77 1444 1400 A 43 VAL HGy% A 17 GLY HAx 1.0 0.0 3.77 1445 1401 A 18 ILE H A 19 ARG HDx 1.0 0.0 4.47 1446 1401 A 18 ILE H A 19 ARG HDy 1.0 0.0 4.47 1447 1402 A 18 ILE HG2% A 19 ARG HDx 1.0 0.0 4.60 1448 1402 A 18 ILE HG2% A 19 ARG HDy 1.0 0.0 4.60 1449 1403 A 19 ARG H A 19 ARG HGx 1.0 0.0 4.27 1450 1403 A 19 ARG H A 19 ARG HGy 1.0 0.0 4.27 1451 1404 A 19 ARG H A 19 ARG HDx 1.0 0.0 4.30 1452 1404 A 19 ARG H A 19 ARG HDy 1.0 0.0 4.30 1453 1405 A 19 ARG H A 41 GLU HGy 1.0 0.0 5.34 1454 1405 A 19 ARG H A 41 GLU HGx 1.0 0.0 5.34 1455 1406 A 19 ARG HBy A 19 ARG HDx 1.0 0.0 3.35 1456 1406 A 19 ARG HBy A 19 ARG HDy 1.0 0.0 3.35 1457 1407 A 20 TYR H A 19 ARG HGx 1.0 0.0 4.15 1458 1407 A 20 TYR H A 19 ARG HGy 1.0 0.0 4.15 1459 1408 A 20 TYR HA A 21 ARG HB2 1.0 0.0 4.45 1460 1408 A 20 TYR HA A 21 ARG HB3 1.0 0.0 4.45 1461 1409 A 20 TYR HBx A 28 VAL HGy% 1.0 0.0 3.73 1462 1409 A 20 TYR HBx A 28 VAL HGx% 1.0 0.0 3.73 1463 1410 A 20 TYR HBy A 21 ARG HB2 1.0 0.0 4.36 1464 1410 A 20 TYR HBy A 21 ARG HB3 1.0 0.0 4.36 1465 1411 A 20 TYR HBy A 28 VAL HGy% 1.0 0.0 4.14 1466 1411 A 20 TYR HBy A 28 VAL HGx% 1.0 0.0 4.14 1467 1412 A 20 TYR HD% A 28 VAL HGy% 1.0 0.0 3.33 1468 1412 A 20 TYR HD% A 28 VAL HGx% 1.0 0.0 3.33 1469 1413 A 20 TYR HD% A 34 LEU HDy% 1.0 0.0 3.71 1470 1413 A 20 TYR HD% A 34 LEU HDx% 1.0 0.0 3.71 1471 1414 A 20 TYR HE% A 28 VAL HGy% 1.0 0.0 4.02 1472 1414 A 20 TYR HE% A 28 VAL HGx% 1.0 0.0 4.02 1473 1415 A 20 TYR HE% A 34 LEU HDy% 1.0 0.0 3.38 1474 1415 A 20 TYR HE% A 34 LEU HDx% 1.0 0.0 3.38 1475 1416 A 21 ARG H A 21 ARG HB2 1.0 0.0 2.72 1476 1416 A 21 ARG H A 21 ARG HB3 1.0 0.0 2.72 1477 1417 A 21 ARG H A 21 ARG HGx 1.0 0.0 3.42 1478 1417 A 21 ARG H A 21 ARG HGy 1.0 0.0 3.42 1479 1418 A 21 ARG HA A 21 ARG HGx 1.0 0.0 3.54 1480 1418 A 21 ARG HGy A 21 ARG HA 1.0 0.0 3.54 1481 1419 A 21 ARG HA A 21 ARG HD2 1.0 0.0 3.57 1482 1419 A 21 ARG HA A 21 ARG HD3 1.0 0.0 3.57 1483 1420 A 21 ARG HA A 22 GLY HAx 1.0 0.0 4.75 1484 1420 A 21 ARG HA A 22 GLY HAy 1.0 0.0 4.75 1485 1421 A 21 ARG HB3 A 21 ARG HD2 1.0 0.0 3.15 1486 1421 A 21 ARG HB2 A 21 ARG HD2 1.0 0.0 3.15 1487 1421 A 21 ARG HD3 A 21 ARG HB2 1.0 0.0 3.15 1488 1421 A 21 ARG HB3 A 21 ARG HD3 1.0 0.0 3.15 1489 1422 A 22 GLY H A 21 ARG HB2 1.0 0.0 3.82 1490 1422 A 22 GLY H A 21 ARG HB3 1.0 0.0 3.82 1491 1423 A 38 TYR HA A 21 ARG HB2 1.0 0.0 4.24 1492 1423 A 38 TYR HA A 21 ARG HB3 1.0 0.0 4.24 1493 1424 A 38 TYR HD% A 21 ARG HB2 1.0 0.0 3.81 1494 1424 A 38 TYR HD% A 21 ARG HB3 1.0 0.0 3.81 1495 1425 A 38 TYR HE% A 21 ARG HB2 1.0 0.0 4.17 1496 1425 A 38 TYR HE% A 21 ARG HB3 1.0 0.0 4.17 1497 1426 A 39 GLU H A 21 ARG HB2 1.0 0.0 3.22 1498 1426 A 39 GLU H A 21 ARG HB3 1.0 0.0 3.22 1499 1427 A 40 ILE HG2% A 21 ARG HB2 1.0 0.0 4.73 1500 1427 A 40 ILE HG2% A 21 ARG HB3 1.0 0.0 4.73 1501 1428 A 22 GLY H A 21 ARG HGx 1.0 0.0 4.08 1502 1428 A 22 GLY H A 21 ARG HGy 1.0 0.0 4.08 1503 1429 A 39 GLU H A 21 ARG HGx 1.0 0.0 4.66 1504 1429 A 39 GLU H A 21 ARG HGy 1.0 0.0 4.66 1505 1430 A 22 GLY H A 21 ARG HD2 1.0 0.0 4.60 1506 1430 A 22 GLY H A 21 ARG HD3 1.0 0.0 4.60 1507 1431 A 23 LEU H A 28 VAL HGy% 1.0 0.0 5.12 1508 1431 A 23 LEU H A 28 VAL HGx% 1.0 0.0 5.12 1509 1432 A 23 LEU HA A 28 VAL HGy% 1.0 0.0 4.75 1510 1432 A 23 LEU HA A 28 VAL HGx% 1.0 0.0 4.75 1511 1433 A 23 LEU HBx A 28 VAL HGy% 1.0 0.0 3.57 1512 1433 A 23 LEU HBx A 28 VAL HGx% 1.0 0.0 3.57 1513 1434 A 23 LEU HBy A 28 VAL HGy% 1.0 0.0 4.04 1514 1434 A 23 LEU HBy A 28 VAL HGx% 1.0 0.0 4.04 1515 1435 A 23 LEU HG A 28 VAL HGy% 1.0 0.0 4.83 1516 1435 A 23 LEU HG A 28 VAL HGx% 1.0 0.0 4.83 1517 1436 A 23 LEU HDx% A 28 VAL HGy% 1.0 0.0 2.99 1518 1436 A 23 LEU HDx% A 28 VAL HGx% 1.0 0.0 2.99 1519 1437 A 23 LEU HDy% A 28 VAL HGy% 1.0 0.0 3.77 1520 1437 A 23 LEU HDy% A 28 VAL HGx% 1.0 0.0 3.77 1521 1438 A 24 THR H A 28 VAL HGy% 1.0 0.0 4.71 1522 1438 A 24 THR H A 28 VAL HGx% 1.0 0.0 4.71 1523 1439 A 24 THR HA A 28 VAL HGy% 1.0 0.0 4.90 1524 1439 A 24 THR HA A 28 VAL HGx% 1.0 0.0 4.90 1525 1440 A 25 ARG H A 25 ARG HB2 1.0 0.0 2.74 1526 1440 A 25 ARG H A 25 ARG HB3 1.0 0.0 2.74 1527 1441 A 25 ARG H A 25 ARG HG2 1.0 0.0 3.37 1528 1441 A 25 ARG H A 25 ARG HG3 1.0 0.0 3.37 1529 1442 A 25 ARG H A 25 ARG HDx 1.0 0.0 4.25 1530 1442 A 25 ARG H A 25 ARG HDy 1.0 0.0 4.25 1531 1443 A 25 ARG HA A 25 ARG HG2 1.0 0.0 3.71 1532 1443 A 25 ARG HA A 25 ARG HG3 1.0 0.0 3.71 1533 1444 A 25 ARG HA A 25 ARG HDx 1.0 0.0 4.58 1534 1444 A 25 ARG HA A 25 ARG HDy 1.0 0.0 4.58 1535 1445 A 25 ARG HA A 28 VAL HGy% 1.0 0.0 4.55 1536 1445 A 25 ARG HA A 28 VAL HGx% 1.0 0.0 4.55 1537 1446 A 26 ASP H A 25 ARG HB2 1.0 0.0 3.95 1538 1446 A 26 ASP H A 25 ARG HB3 1.0 0.0 3.95 1539 1447 A 26 ASP H A 25 ARG HG2 1.0 0.0 4.37 1540 1447 A 26 ASP H A 25 ARG HG3 1.0 0.0 4.37 1541 1448 A 26 ASP H A 25 ARG HDx 1.0 0.0 5.01 1542 1448 A 26 ASP H A 25 ARG HDy 1.0 0.0 5.01 1543 1449 A 26 ASP H A 28 VAL HGy% 1.0 0.0 5.44 1544 1449 A 26 ASP H A 28 VAL HGx% 1.0 0.0 5.44 1545 1450 A 27 GLN H A 28 VAL HGy% 1.0 0.0 3.77 1546 1450 A 27 GLN H A 28 VAL HGx% 1.0 0.0 3.77 1547 1451 A 27 GLN HBy A 28 VAL HGy% 1.0 0.0 4.57 1548 1451 A 27 GLN HBy A 28 VAL HGx% 1.0 0.0 4.57 1549 1452 A 28 VAL H A 28 VAL HGy% 1.0 0.0 2.85 1550 1452 A 28 VAL H A 28 VAL HGx% 1.0 0.0 2.85 1551 1453 A 28 VAL HA A 28 VAL HGy% 1.0 0.0 3.01 1552 1453 A 28 VAL HA A 28 VAL HGx% 1.0 0.0 3.01 1553 1454 A 29 LYS H A 28 VAL HGy% 1.0 0.0 3.87 1554 1454 A 29 LYS H A 28 VAL HGx% 1.0 0.0 3.87 1555 1455 A 29 LYS HA A 28 VAL HGy% 1.0 0.0 4.27 1556 1455 A 29 LYS HA A 28 VAL HGx% 1.0 0.0 4.27 1557 1456 A 30 ALA H A 28 VAL HGy% 1.0 0.0 4.53 1558 1456 A 30 ALA H A 28 VAL HGx% 1.0 0.0 4.53 1559 1457 A 29 LYS H A 29 LYS HBy 1.0 0.0 3.06 1560 1457 A 29 LYS H A 29 LYS HBx 1.0 0.0 3.06 1561 1458 A 29 LYS H A 29 LYS HGx 1.0 0.0 3.50 1562 1458 A 29 LYS H A 29 LYS HGy 1.0 0.0 3.50 1563 1459 A 29 LYS HA A 29 LYS HD2 1.0 0.0 4.47 1564 1459 A 29 LYS HA A 29 LYS HD3 1.0 0.0 4.47 1565 1460 A 30 ALA H A 29 LYS HGx 1.0 0.0 3.87 1566 1460 A 30 ALA H A 29 LYS HGy 1.0 0.0 3.87 1567 1461 A 31 ILE HA A 32 ASN HD2x 1.0 0.0 5.34 1568 1461 A 31 ILE HA A 32 ASN HD2y 1.0 0.0 5.34 1569 1462 A 32 ASN H A 32 ASN HBy 1.0 0.0 3.33 1570 1462 A 32 ASN H A 32 ASN HBx 1.0 0.0 3.33 1571 1463 A 32 ASN H A 32 ASN HD2x 1.0 0.0 4.01 1572 1463 A 32 ASN H A 32 ASN HD2y 1.0 0.0 4.01 1573 1464 A 32 ASN HBy A 32 ASN HD2x 1.0 0.0 2.94 1574 1464 A 32 ASN HBx A 32 ASN HD2x 1.0 0.0 2.94 1575 1464 A 32 ASN HD2y A 32 ASN HBy 1.0 0.0 2.94 1576 1464 A 32 ASN HD2y A 32 ASN HBx 1.0 0.0 2.94 1577 1465 A 33 PHE HA A 34 LEU HDy% 1.0 0.0 4.67 1578 1465 A 33 PHE HA A 34 LEU HDx% 1.0 0.0 4.67 1579 1466 A 33 PHE HBx A 34 LEU HDy% 1.0 0.0 5.07 1580 1466 A 33 PHE HBx A 34 LEU HDx% 1.0 0.0 5.07 1581 1467 A 33 PHE HD% A 34 LEU HDy% 1.0 0.0 5.44 1582 1467 A 33 PHE HD% A 34 LEU HDx% 1.0 0.0 5.44 1583 1468 A 34 LEU H A 34 LEU HDy% 1.0 0.0 3.15 1584 1468 A 34 LEU H A 34 LEU HDx% 1.0 0.0 3.15 1585 1469 A 34 LEU HA A 34 LEU HDy% 1.0 0.0 3.17 1586 1469 A 34 LEU HA A 34 LEU HDx% 1.0 0.0 3.17 1587 1470 A 35 PRO HG2 A 34 LEU HDy% 1.0 0.0 4.45 1588 1470 A 35 PRO HG2 A 34 LEU HDx% 1.0 0.0 4.45 1589 1471 A 35 PRO HDx A 34 LEU HDy% 1.0 0.0 3.59 1590 1471 A 35 PRO HDx A 34 LEU HDx% 1.0 0.0 3.59 1591 1472 A 35 PRO HDy A 34 LEU HDy% 1.0 0.0 4.24 1592 1472 A 35 PRO HDy A 34 LEU HDx% 1.0 0.0 4.24 1593 1473 A 38 TYR H A 34 LEU HDy% 1.0 0.0 5.44 1594 1473 A 38 TYR H A 34 LEU HDx% 1.0 0.0 5.44 1595 1474 A 38 TYR HBx A 34 LEU HDy% 1.0 0.0 4.62 1596 1474 A 38 TYR HBx A 34 LEU HDx% 1.0 0.0 4.62 1597 1475 A 38 TYR HBy A 34 LEU HDy% 1.0 0.0 4.33 1598 1475 A 38 TYR HBy A 34 LEU HDx% 1.0 0.0 4.33 1599 1476 A 38 TYR HD% A 34 LEU HDy% 1.0 0.0 3.88 1600 1476 A 38 TYR HD% A 34 LEU HDx% 1.0 0.0 3.88 1601 1477 A 64 TRP HH2 A 34 LEU HDy% 1.0 0.0 4.09 1602 1477 A 64 TRP HH2 A 34 LEU HDx% 1.0 0.0 4.09 1603 1478 A 37 ASP HA A 57 LYS HG2 1.0 0.0 3.48 1604 1478 A 37 ASP HA A 57 LYS HG3 1.0 0.0 3.48 1605 1479 A 37 ASP HA A 57 LYS HDx 1.0 0.0 4.11 1606 1479 A 37 ASP HA A 57 LYS HDy 1.0 0.0 4.11 1607 1480 A 38 TYR H A 37 ASP HBy 1.0 0.0 3.92 1608 1480 A 38 TYR H A 37 ASP HBx 1.0 0.0 3.92 1609 1481 A 39 GLU HA A 55 VAL HGy% 1.0 0.0 4.34 1610 1481 A 39 GLU HA A 55 VAL HGx% 1.0 0.0 4.34 1611 1482 A 39 GLU HBy A 55 VAL HGy% 1.0 0.0 4.09 1612 1482 A 39 GLU HBy A 55 VAL HGx% 1.0 0.0 4.09 1613 1483 A 39 GLU HGx A 57 LYS HG2 1.0 0.0 4.48 1614 1483 A 39 GLU HGx A 57 LYS HG3 1.0 0.0 4.48 1615 1484 A 39 GLU HGx A 57 LYS HE2 1.0 0.0 4.65 1616 1484 A 39 GLU HGx A 57 LYS HE3 1.0 0.0 4.65 1617 1485 A 39 GLU HGy A 57 LYS HG2 1.0 0.0 4.53 1618 1485 A 39 GLU HGy A 57 LYS HG3 1.0 0.0 4.53 1619 1486 A 39 GLU HGy A 57 LYS HE2 1.0 0.0 5.34 1620 1486 A 39 GLU HGy A 57 LYS HE3 1.0 0.0 5.34 1621 1487 A 40 ILE HD1% A 56 ARG HDx 1.0 0.0 3.75 1622 1487 A 40 ILE HD1% A 56 ARG HDy 1.0 0.0 3.75 1623 1488 A 41 GLU H A 41 GLU HGy 1.0 0.0 4.35 1624 1488 A 41 GLU H A 41 GLU HGx 1.0 0.0 4.35 1625 1489 A 41 GLU HA A 55 VAL HGy% 1.0 0.0 4.72 1626 1489 A 41 GLU HA A 55 VAL HGx% 1.0 0.0 4.72 1627 1490 A 42 TYR H A 41 GLU HGy 1.0 0.0 3.68 1628 1490 A 42 TYR H A 41 GLU HGx 1.0 0.0 3.68 1629 1491 A 43 VAL HGx% A 41 GLU HGy 1.0 0.0 4.02 1630 1491 A 43 VAL HGx% A 41 GLU HGx 1.0 0.0 4.02 1631 1492 A 55 VAL HA A 41 GLU HGy 1.0 0.0 5.07 1632 1492 A 55 VAL HA A 41 GLU HGx 1.0 0.0 5.07 1633 1493 A 42 TYR HD% A 55 VAL HGy% 1.0 0.0 5.44 1634 1493 A 42 TYR HD% A 55 VAL HGx% 1.0 0.0 5.44 1635 1494 A 42 TYR HD% A 71 SER HBx 1.0 0.0 4.55 1636 1494 A 42 TYR HD% A 71 SER HBy 1.0 0.0 4.55 1637 1495 A 42 TYR HE% A 56 ARG HDx 1.0 0.0 4.47 1638 1495 A 42 TYR HE% A 56 ARG HDy 1.0 0.0 4.47 1639 1496 A 42 TYR HE% A 71 SER HBx 1.0 0.0 5.34 1640 1496 A 42 TYR HE% A 71 SER HBy 1.0 0.0 5.34 1641 1497 A 44 CYS H A 48 ARG HGx 1.0 0.0 5.26 1642 1497 A 44 CYS H A 48 ARG HGy 1.0 0.0 5.26 1643 1498 A 45 ARG H A 45 ARG HDx 1.0 0.0 4.96 1644 1498 A 45 ARG H A 45 ARG HDy 1.0 0.0 4.96 1645 1499 A 45 ARG HA A 45 ARG HDx 1.0 0.0 3.35 1646 1499 A 45 ARG HA A 45 ARG HDy 1.0 0.0 3.35 1647 1500 A 45 ARG HBx A 45 ARG HDx 1.0 0.0 3.52 1648 1500 A 45 ARG HBx A 45 ARG HDy 1.0 0.0 3.52 1649 1501 A 45 ARG HBy A 45 ARG HDx 1.0 0.0 3.42 1650 1501 A 45 ARG HBy A 45 ARG HDy 1.0 0.0 3.42 1651 1502 A 46 GLY H A 47 GLU HG2 1.0 0.0 5.34 1652 1502 A 46 GLY H A 47 GLU HG3 1.0 0.0 5.34 1653 1503 A 46 GLY HA3 A 47 GLU HBx 1.0 0.0 4.71 1654 1503 A 46 GLY HA3 A 47 GLU HBy 1.0 0.0 4.71 1655 1504 A 46 GLY HA3 A 47 GLU HG2 1.0 0.0 4.16 1656 1504 A 46 GLY HA3 A 47 GLU HG3 1.0 0.0 4.16 1657 1505 A 47 GLU H A 47 GLU HBx 1.0 0.0 3.61 1658 1505 A 47 GLU H A 47 GLU HBy 1.0 0.0 3.61 1659 1506 A 47 GLU H A 47 GLU HG2 1.0 0.0 3.02 1660 1506 A 47 GLU H A 47 GLU HG3 1.0 0.0 3.02 1661 1507 A 47 GLU H A 48 ARG HGx 1.0 0.0 3.95 1662 1507 A 47 GLU H A 48 ARG HGy 1.0 0.0 3.95 1663 1508 A 47 GLU HA A 47 GLU HBx 1.0 0.0 2.63 1664 1508 A 47 GLU HA A 47 GLU HBy 1.0 0.0 2.63 1665 1509 A 47 GLU HA A 47 GLU HG2 1.0 0.0 3.48 1666 1509 A 47 GLU HA A 47 GLU HG3 1.0 0.0 3.48 1667 1510 A 47 GLU HBx A 47 GLU HG2 1.0 0.0 2.27 1668 1510 A 47 GLU HBy A 47 GLU HG2 1.0 0.0 2.27 1669 1510 A 47 GLU HG3 A 47 GLU HBx 1.0 0.0 2.27 1670 1510 A 47 GLU HG3 A 47 GLU HBy 1.0 0.0 2.27 1671 1511 A 48 ARG H A 47 GLU HBx 1.0 0.0 3.81 1672 1511 A 48 ARG H A 47 GLU HBy 1.0 0.0 3.81 1673 1512 A 48 ARG HA A 47 GLU HBx 1.0 0.0 4.79 1674 1512 A 48 ARG HA A 47 GLU HBy 1.0 0.0 4.79 1675 1513 A 47 GLU HBx A 48 ARG HDx 1.0 0.0 5.18 1676 1513 A 48 ARG HDy A 47 GLU HBx 1.0 0.0 5.18 1677 1513 A 47 GLU HBy A 48 ARG HDy 1.0 0.0 5.18 1678 1513 A 47 GLU HBy A 48 ARG HDx 1.0 0.0 5.18 1679 1514 A 48 ARG H A 47 GLU HG2 1.0 0.0 5.27 1680 1514 A 48 ARG H A 47 GLU HG3 1.0 0.0 5.27 1681 1515 A 47 GLU HG3 A 48 ARG HDx 1.0 0.0 5.18 1682 1515 A 47 GLU HG2 A 48 ARG HDx 1.0 0.0 5.18 1683 1515 A 48 ARG HDy A 47 GLU HG2 1.0 0.0 5.18 1684 1515 A 47 GLU HG3 A 48 ARG HDy 1.0 0.0 5.18 1685 1516 A 48 ARG H A 48 ARG HGx 1.0 0.0 2.68 1686 1516 A 48 ARG H A 48 ARG HGy 1.0 0.0 2.68 1687 1517 A 48 ARG H A 48 ARG HDx 1.0 0.0 3.75 1688 1517 A 48 ARG H A 48 ARG HDy 1.0 0.0 3.75 1689 1518 A 48 ARG HA A 49 GLU HG2 1.0 0.0 5.06 1690 1518 A 48 ARG HA A 49 GLU HG3 1.0 0.0 5.06 1691 1519 A 48 ARG HBy A 48 ARG HDx 1.0 0.0 3.00 1692 1519 A 48 ARG HBy A 48 ARG HDy 1.0 0.0 3.00 1693 1520 A 49 GLU H A 48 ARG HGx 1.0 0.0 4.26 1694 1520 A 49 GLU H A 48 ARG HGy 1.0 0.0 4.26 1695 1521 A 49 GLU H A 48 ARG HDx 1.0 0.0 4.37 1696 1521 A 49 GLU H A 48 ARG HDy 1.0 0.0 4.37 1697 1522 A 49 GLU H A 49 GLU HBx 1.0 0.0 2.92 1698 1522 A 49 GLU H A 49 GLU HBy 1.0 0.0 2.92 1699 1523 A 49 GLU H A 49 GLU HG2 1.0 0.0 3.89 1700 1523 A 49 GLU H A 49 GLU HG3 1.0 0.0 3.89 1701 1524 A 49 GLU H A 73 CYS HBy 1.0 0.0 5.34 1702 1524 A 49 GLU H A 73 CYS HBx 1.0 0.0 5.34 1703 1525 A 49 GLU HA A 49 GLU HG2 1.0 0.0 3.38 1704 1525 A 49 GLU HA A 49 GLU HG3 1.0 0.0 3.38 1705 1526 A 50 VAL H A 49 GLU HBx 1.0 0.0 2.97 1706 1526 A 50 VAL H A 49 GLU HBy 1.0 0.0 2.97 1707 1527 A 51 VAL H A 49 GLU HBx 1.0 0.0 5.34 1708 1527 A 51 VAL H A 49 GLU HBy 1.0 0.0 5.34 1709 1528 A 74 VAL H A 49 GLU HBx 1.0 0.0 5.15 1710 1528 A 74 VAL H A 49 GLU HBy 1.0 0.0 5.15 1711 1529 A 50 VAL H A 49 GLU HG2 1.0 0.0 4.28 1712 1529 A 50 VAL H A 49 GLU HG3 1.0 0.0 4.28 1713 1530 A 50 VAL H A 54 LYS HE2 1.0 0.0 4.15 1714 1530 A 50 VAL H A 54 LYS HE3 1.0 0.0 4.15 1715 1531 A 50 VAL HA A 71 SER HBx 1.0 0.0 5.34 1716 1531 A 50 VAL HA A 71 SER HBy 1.0 0.0 5.34 1717 1532 A 50 VAL HB A 54 LYS HE2 1.0 0.0 4.99 1718 1532 A 50 VAL HB A 54 LYS HE3 1.0 0.0 4.99 1719 1533 A 50 VAL HGx% A 54 LYS HE2 1.0 0.0 3.78 1720 1533 A 50 VAL HGx% A 54 LYS HE3 1.0 0.0 3.78 1721 1534 A 50 VAL HGx% A 71 SER HBx 1.0 0.0 4.48 1722 1534 A 50 VAL HGx% A 71 SER HBy 1.0 0.0 4.48 1723 1535 A 50 VAL HGx% A 73 CYS HBy 1.0 0.0 3.23 1724 1535 A 50 VAL HGx% A 73 CYS HBx 1.0 0.0 3.23 1725 1536 A 50 VAL HGy% A 54 LYS HE2 1.0 0.0 4.28 1726 1536 A 50 VAL HGy% A 54 LYS HE3 1.0 0.0 4.28 1727 1537 A 50 VAL HGy% A 71 SER HBx 1.0 0.0 3.73 1728 1537 A 50 VAL HGy% A 71 SER HBy 1.0 0.0 3.73 1729 1538 A 51 VAL H A 51 VAL HGx% 1.0 0.0 2.88 1730 1538 A 51 VAL H A 51 VAL HGy% 1.0 0.0 2.88 1731 1539 A 51 VAL H A 71 SER HBx 1.0 0.0 5.34 1732 1539 A 51 VAL H A 71 SER HBy 1.0 0.0 5.34 1733 1540 A 51 VAL H A 72 ARG HD2 1.0 0.0 5.13 1734 1540 A 51 VAL H A 72 ARG HD3 1.0 0.0 5.13 1735 1541 A 51 VAL H A 74 VAL HGy% 1.0 0.0 5.44 1736 1541 A 51 VAL H A 74 VAL HGx% 1.0 0.0 5.44 1737 1542 A 51 VAL HA A 51 VAL HGx% 1.0 0.0 3.10 1738 1542 A 51 VAL HA A 51 VAL HGy% 1.0 0.0 3.10 1739 1543 A 52 GLY HAx A 51 VAL HGx% 1.0 0.0 4.69 1740 1543 A 52 GLY HAx A 51 VAL HGy% 1.0 0.0 4.69 1741 1544 A 72 ARG H A 51 VAL HGx% 1.0 0.0 3.93 1742 1544 A 72 ARG H A 51 VAL HGy% 1.0 0.0 3.93 1743 1545 A 72 ARG HBx A 51 VAL HGx% 1.0 0.0 3.54 1744 1545 A 72 ARG HBx A 51 VAL HGy% 1.0 0.0 3.54 1745 1546 A 72 ARG HBy A 51 VAL HGx% 1.0 0.0 4.72 1746 1546 A 72 ARG HBy A 51 VAL HGy% 1.0 0.0 4.72 1747 1547 A 72 ARG HGx A 51 VAL HGx% 1.0 0.0 3.69 1748 1547 A 72 ARG HGx A 51 VAL HGy% 1.0 0.0 3.69 1749 1548 A 72 ARG HGy A 51 VAL HGx% 1.0 0.0 3.91 1750 1548 A 72 ARG HGy A 51 VAL HGy% 1.0 0.0 3.91 1751 1549 A 51 VAL HGy% A 72 ARG HD2 1.0 0.0 3.73 1752 1549 A 51 VAL HGx% A 72 ARG HD2 1.0 0.0 3.73 1753 1549 A 72 ARG HD3 A 51 VAL HGx% 1.0 0.0 3.73 1754 1549 A 51 VAL HGy% A 72 ARG HD3 1.0 0.0 3.73 1755 1550 A 53 PRO HBx A 55 VAL HGy% 1.0 0.0 3.58 1756 1550 A 53 PRO HBx A 55 VAL HGx% 1.0 0.0 3.58 1757 1551 A 53 PRO HG2 A 71 SER HBx 1.0 0.0 4.61 1758 1551 A 53 PRO HG2 A 71 SER HBy 1.0 0.0 4.61 1759 1552 A 53 PRO HD2 A 71 SER HBx 1.0 0.0 4.60 1760 1552 A 53 PRO HD2 A 71 SER HBy 1.0 0.0 4.60 1761 1553 A 54 LYS H A 54 LYS HE2 1.0 0.0 5.28 1762 1553 A 54 LYS H A 54 LYS HE3 1.0 0.0 5.28 1763 1554 A 54 LYS H A 55 VAL HGy% 1.0 0.0 4.14 1764 1554 A 54 LYS H A 55 VAL HGx% 1.0 0.0 4.14 1765 1555 A 54 LYS HA A 55 VAL HGy% 1.0 0.0 4.29 1766 1555 A 54 LYS HA A 55 VAL HGx% 1.0 0.0 4.29 1767 1556 A 54 LYS HBy A 54 LYS HE2 1.0 0.0 4.18 1768 1556 A 54 LYS HBy A 54 LYS HE3 1.0 0.0 4.18 1769 1557 A 54 LYS HGx A 54 LYS HE2 1.0 0.0 3.43 1770 1557 A 54 LYS HGx A 54 LYS HE3 1.0 0.0 3.43 1771 1558 A 54 LYS HGy A 54 LYS HE2 1.0 0.0 3.64 1772 1558 A 54 LYS HGy A 54 LYS HE3 1.0 0.0 3.64 1773 1559 A 54 LYS HGy A 55 VAL HGy% 1.0 0.0 4.35 1774 1559 A 54 LYS HGy A 55 VAL HGx% 1.0 0.0 4.35 1775 1560 A 55 VAL H A 55 VAL HGy% 1.0 0.0 2.89 1776 1560 A 55 VAL H A 55 VAL HGx% 1.0 0.0 2.89 1777 1561 A 55 VAL H A 71 SER HBx 1.0 0.0 5.34 1778 1561 A 55 VAL H A 71 SER HBy 1.0 0.0 5.34 1779 1562 A 56 ARG H A 55 VAL HGy% 1.0 0.0 2.94 1780 1562 A 56 ARG H A 55 VAL HGx% 1.0 0.0 2.94 1781 1563 A 57 LYS H A 55 VAL HGy% 1.0 0.0 4.26 1782 1563 A 57 LYS H A 55 VAL HGx% 1.0 0.0 4.26 1783 1564 A 57 LYS HA A 55 VAL HGy% 1.0 0.0 5.41 1784 1564 A 57 LYS HA A 55 VAL HGx% 1.0 0.0 5.41 1785 1565 A 56 ARG H A 56 ARG HDx 1.0 0.0 4.74 1786 1565 A 56 ARG H A 56 ARG HDy 1.0 0.0 4.74 1787 1566 A 57 LYS H A 56 ARG HDx 1.0 0.0 5.34 1788 1566 A 57 LYS H A 56 ARG HDy 1.0 0.0 5.34 1789 1567 A 64 TRP H A 56 ARG HDx 1.0 0.0 5.34 1790 1567 A 64 TRP H A 56 ARG HDy 1.0 0.0 5.34 1791 1568 A 64 TRP HB2 A 56 ARG HDx 1.0 0.0 3.61 1792 1568 A 64 TRP HB2 A 56 ARG HDy 1.0 0.0 3.61 1793 1569 A 64 TRP HE3 A 56 ARG HDx 1.0 0.0 4.34 1794 1569 A 64 TRP HE3 A 56 ARG HDy 1.0 0.0 4.34 1795 1570 A 65 THR H A 56 ARG HDx 1.0 0.0 4.15 1796 1570 A 65 THR H A 56 ARG HDy 1.0 0.0 4.15 1797 1571 A 57 LYS H A 57 LYS HE2 1.0 0.0 5.09 1798 1571 A 57 LYS H A 57 LYS HE3 1.0 0.0 5.09 1799 1572 A 57 LYS H A 59 LEU HDy% 1.0 0.0 4.36 1800 1572 A 57 LYS H A 59 LEU HDx% 1.0 0.0 4.36 1801 1573 A 57 LYS HA A 57 LYS HG2 1.0 0.0 3.37 1802 1573 A 57 LYS HA A 57 LYS HG3 1.0 0.0 3.37 1803 1574 A 57 LYS HA A 57 LYS HE2 1.0 0.0 4.91 1804 1574 A 57 LYS HA A 57 LYS HE3 1.0 0.0 4.91 1805 1575 A 57 LYS HBx A 57 LYS HE2 1.0 0.0 3.35 1806 1575 A 57 LYS HBx A 57 LYS HE3 1.0 0.0 3.35 1807 1576 A 57 LYS HBx A 59 LEU HDy% 1.0 0.0 4.81 1808 1576 A 57 LYS HBx A 59 LEU HDx% 1.0 0.0 4.81 1809 1577 A 57 LYS HBy A 57 LYS HE2 1.0 0.0 4.41 1810 1577 A 57 LYS HBy A 57 LYS HE3 1.0 0.0 4.41 1811 1578 A 57 LYS HBy A 59 LEU HDy% 1.0 0.0 3.33 1812 1578 A 57 LYS HBy A 59 LEU HDx% 1.0 0.0 3.33 1813 1579 A 57 LYS HE2 A 57 LYS HG2 1.0 0.0 3.24 1814 1579 A 57 LYS HE3 A 57 LYS HG2 1.0 0.0 3.24 1815 1579 A 57 LYS HG3 A 57 LYS HE2 1.0 0.0 3.24 1816 1579 A 57 LYS HG3 A 57 LYS HE3 1.0 0.0 3.24 1817 1580 A 58 CYS H A 57 LYS HG2 1.0 0.0 3.33 1818 1580 A 58 CYS H A 57 LYS HG3 1.0 0.0 3.33 1819 1581 A 57 LYS HG3 A 59 LEU HDy% 1.0 0.0 4.37 1820 1581 A 57 LYS HG2 A 59 LEU HDy% 1.0 0.0 4.37 1821 1581 A 59 LEU HDx% A 57 LYS HG2 1.0 0.0 4.37 1822 1581 A 57 LYS HG3 A 59 LEU HDx% 1.0 0.0 4.37 1823 1582 A 57 LYS HDx A 59 LEU HDy% 1.0 0.0 4.11 1824 1582 A 57 LYS HDy A 59 LEU HDy% 1.0 0.0 4.11 1825 1582 A 59 LEU HDx% A 57 LYS HDx 1.0 0.0 4.11 1826 1582 A 57 LYS HDy A 59 LEU HDx% 1.0 0.0 4.11 1827 1583 A 57 LYS HE3 A 59 LEU HDy% 1.0 0.0 4.42 1828 1583 A 57 LYS HE2 A 59 LEU HDy% 1.0 0.0 4.42 1829 1583 A 59 LEU HDx% A 57 LYS HE2 1.0 0.0 4.42 1830 1583 A 57 LYS HE3 A 59 LEU HDx% 1.0 0.0 4.42 1831 1584 A 65 THR HG2% A 57 LYS HE2 1.0 0.0 4.23 1832 1584 A 65 THR HG2% A 57 LYS HE3 1.0 0.0 4.23 1833 1585 A 58 CYS HA A 59 LEU HDy% 1.0 0.0 4.46 1834 1585 A 58 CYS HA A 59 LEU HDx% 1.0 0.0 4.46 1835 1586 A 59 LEU H A 59 LEU HDy% 1.0 0.0 3.75 1836 1586 A 59 LEU H A 59 LEU HDx% 1.0 0.0 3.75 1837 1587 A 59 LEU HA A 59 LEU HDy% 1.0 0.0 2.83 1838 1587 A 59 LEU HA A 59 LEU HDx% 1.0 0.0 2.83 1839 1588 A 59 LEU HBx A 59 LEU HDy% 1.0 0.0 2.84 1840 1588 A 59 LEU HBx A 59 LEU HDx% 1.0 0.0 2.84 1841 1589 A 59 LEU HBx A 63 SER HB2 1.0 0.0 5.34 1842 1589 A 59 LEU HBx A 63 SER HB3 1.0 0.0 5.34 1843 1590 A 59 LEU HBy A 59 LEU HDy% 1.0 0.0 2.92 1844 1590 A 59 LEU HBy A 59 LEU HDx% 1.0 0.0 2.92 1845 1591 A 60 ALA H A 59 LEU HDy% 1.0 0.0 3.95 1846 1591 A 60 ALA H A 59 LEU HDx% 1.0 0.0 3.95 1847 1592 A 61 ASN HD2x A 59 LEU HDy% 1.0 0.0 4.02 1848 1592 A 61 ASN HD2x A 59 LEU HDx% 1.0 0.0 4.02 1849 1593 A 61 ASN HD2y A 59 LEU HDy% 1.0 0.0 3.86 1850 1593 A 61 ASN HD2y A 59 LEU HDx% 1.0 0.0 3.86 1851 1594 A 59 LEU HDx% A 63 SER HB2 1.0 0.0 3.87 1852 1594 A 63 SER HB3 A 59 LEU HDy% 1.0 0.0 3.87 1853 1594 A 59 LEU HDx% A 63 SER HB3 1.0 0.0 3.87 1854 1594 A 59 LEU HDy% A 63 SER HB2 1.0 0.0 3.87 1855 1595 A 64 TRP H A 59 LEU HDy% 1.0 0.0 5.04 1856 1595 A 64 TRP H A 59 LEU HDx% 1.0 0.0 5.04 1857 1596 A 64 TRP HA A 59 LEU HDy% 1.0 0.0 4.74 1858 1596 A 64 TRP HA A 59 LEU HDx% 1.0 0.0 4.74 1859 1597 A 65 THR H A 59 LEU HDy% 1.0 0.0 3.96 1860 1597 A 65 THR H A 59 LEU HDx% 1.0 0.0 3.96 1861 1598 A 65 THR HA A 59 LEU HDy% 1.0 0.0 3.22 1862 1598 A 65 THR HA A 59 LEU HDx% 1.0 0.0 3.22 1863 1599 A 65 THR HB A 59 LEU HDy% 1.0 0.0 4.62 1864 1599 A 65 THR HB A 59 LEU HDx% 1.0 0.0 4.62 1865 1600 A 65 THR HG2% A 59 LEU HDy% 1.0 0.0 2.57 1866 1600 A 65 THR HG2% A 59 LEU HDx% 1.0 0.0 2.57 1867 1601 A 66 ASP H A 59 LEU HDy% 1.0 0.0 3.99 1868 1601 A 66 ASP H A 59 LEU HDx% 1.0 0.0 3.99 1869 1602 A 61 ASN HBx A 63 SER HB2 1.0 0.0 5.34 1870 1602 A 61 ASN HBx A 63 SER HB3 1.0 0.0 5.34 1871 1603 A 61 ASN HD2x A 63 SER HB2 1.0 0.0 4.13 1872 1603 A 61 ASN HD2x A 63 SER HB3 1.0 0.0 4.13 1873 1604 A 61 ASN HD2y A 63 SER HB2 1.0 0.0 4.02 1874 1604 A 61 ASN HD2y A 63 SER HB3 1.0 0.0 4.02 1875 1605 A 63 SER H A 63 SER HB2 1.0 0.0 3.69 1876 1605 A 63 SER H A 63 SER HB3 1.0 0.0 3.69 1877 1606 A 64 TRP H A 63 SER HB2 1.0 0.0 3.34 1878 1606 A 64 TRP H A 63 SER HB3 1.0 0.0 3.34 1879 1607 A 64 TRP HA A 63 SER HB2 1.0 0.0 5.32 1880 1607 A 64 TRP HA A 63 SER HB3 1.0 0.0 5.32 1881 1608 A 64 TRP HB2 A 63 SER HB2 1.0 0.0 5.34 1882 1608 A 64 TRP HB2 A 63 SER HB3 1.0 0.0 5.34 1883 1609 A 67 MET HB2 A 63 SER HB2 1.0 0.0 4.70 1884 1609 A 67 MET HB2 A 63 SER HB3 1.0 0.0 4.70 1885 1610 A 67 MET HGx A 63 SER HB2 1.0 0.0 5.01 1886 1610 A 67 MET HGx A 63 SER HB3 1.0 0.0 5.01 1887 1611 A 67 MET HGy A 63 SER HB2 1.0 0.0 5.10 1888 1611 A 67 MET HGy A 63 SER HB3 1.0 0.0 5.10 1889 1612 A 67 MET HE% A 63 SER HB2 1.0 0.0 4.76 1890 1612 A 67 MET HE% A 63 SER HB3 1.0 0.0 4.76 1891 1613 A 65 THR H A 66 ASP HBx 1.0 0.0 5.34 1892 1613 A 65 THR H A 66 ASP HBy 1.0 0.0 5.34 1893 1614 A 66 ASP H A 66 ASP HBx 1.0 0.0 3.39 1894 1614 A 66 ASP H A 66 ASP HBy 1.0 0.0 3.39 1895 1615 A 67 MET H A 66 ASP HBx 1.0 0.0 3.23 1896 1615 A 67 MET H A 66 ASP HBy 1.0 0.0 3.23 1897 1616 A 68 ASP H A 66 ASP HBx 1.0 0.0 4.58 1898 1616 A 68 ASP H A 66 ASP HBy 1.0 0.0 4.58 1899 1617 A 69 THR H A 66 ASP HBx 1.0 0.0 4.56 1900 1617 A 69 THR H A 66 ASP HBy 1.0 0.0 4.56 1901 1618 A 69 THR HB A 66 ASP HBx 1.0 0.0 4.27 1902 1618 A 69 THR HB A 66 ASP HBy 1.0 0.0 4.27 1903 1619 A 69 THR HG2% A 66 ASP HBx 1.0 0.0 4.24 1904 1619 A 69 THR HG2% A 66 ASP HBy 1.0 0.0 4.24 1905 1620 A 68 ASP H A 68 ASP HBx 1.0 0.0 3.00 1906 1620 A 68 ASP H A 68 ASP HBy 1.0 0.0 3.00 1907 1621 A 68 ASP HA A 68 ASP HBx 1.0 0.0 2.63 1908 1621 A 68 ASP HA A 68 ASP HBy 1.0 0.0 2.63 1909 1622 A 69 THR H A 68 ASP HBx 1.0 0.0 4.19 1910 1622 A 69 THR H A 68 ASP HBy 1.0 0.0 4.19 1911 1623 A 71 SER H A 71 SER HBx 1.0 0.0 3.11 1912 1623 A 71 SER H A 71 SER HBy 1.0 0.0 3.11 1913 1624 A 72 ARG H A 71 SER HBx 1.0 0.0 3.35 1914 1624 A 72 ARG H A 71 SER HBy 1.0 0.0 3.35 1915 1625 A 72 ARG H A 72 ARG HD2 1.0 0.0 5.30 1916 1625 A 72 ARG H A 72 ARG HD3 1.0 0.0 5.30 1917 1626 A 72 ARG HBx A 72 ARG HD2 1.0 0.0 3.55 1918 1626 A 72 ARG HBx A 72 ARG HD3 1.0 0.0 3.55 1919 1627 A 72 ARG HBx A 74 VAL HGy% 1.0 0.0 3.23 1920 1627 A 72 ARG HBx A 74 VAL HGx% 1.0 0.0 3.23 1921 1628 A 72 ARG HBy A 72 ARG HD2 1.0 0.0 3.65 1922 1628 A 72 ARG HBy A 72 ARG HD3 1.0 0.0 3.65 1923 1629 A 72 ARG HBy A 74 VAL HGy% 1.0 0.0 5.15 1924 1629 A 72 ARG HBy A 74 VAL HGx% 1.0 0.0 5.15 1925 1630 A 72 ARG HD3 A 74 VAL HGy% 1.0 0.0 3.48 1926 1630 A 72 ARG HD2 A 74 VAL HGy% 1.0 0.0 3.48 1927 1630 A 74 VAL HGx% A 72 ARG HD2 1.0 0.0 3.48 1928 1630 A 72 ARG HD3 A 74 VAL HGx% 1.0 0.0 3.48 1929 1631 A 73 CYS H A 73 CYS HBy 1.0 0.0 3.34 1930 1631 A 73 CYS H A 73 CYS HBx 1.0 0.0 3.34 1931 1632 A 73 CYS H A 74 VAL HGy% 1.0 0.0 4.93 1932 1632 A 73 CYS H A 74 VAL HGx% 1.0 0.0 4.93 1933 1633 A 74 VAL H A 73 CYS HBy 1.0 0.0 3.68 1934 1633 A 74 VAL H A 73 CYS HBx 1.0 0.0 3.68 1935 1634 A 74 VAL H A 74 VAL HGy% 1.0 0.0 3.19 1936 1634 A 74 VAL H A 74 VAL HGx% 1.0 0.0 3.19 1937 1635 A 75 ARG H A 74 VAL HGy% 1.0 0.0 3.32 1938 1635 A 75 ARG H A 74 VAL HGx% 1.0 0.0 3.32 1939 1636 A 75 ARG HA A 74 VAL HGy% 1.0 0.0 4.05 1940 1636 A 74 VAL HGx% A 75 ARG HA 1.0 0.0 4.05 1941 1637 A 74 VAL HGx% A 75 ARG HBy 1.0 0.0 4.13 1942 1637 A 74 VAL HGy% A 75 ARG HBy 1.0 0.0 4.13 1943 1637 A 75 ARG HBx A 74 VAL HGy% 1.0 0.0 4.13 1944 1637 A 74 VAL HGx% A 75 ARG HBx 1.0 0.0 4.13 1945 1638 A 74 VAL HGx% A 75 ARG HD2 1.0 0.0 5.24 1946 1638 A 74 VAL HGy% A 75 ARG HD2 1.0 0.0 5.24 1947 1638 A 75 ARG HD3 A 74 VAL HGy% 1.0 0.0 5.24 1948 1638 A 74 VAL HGx% A 75 ARG HD3 1.0 0.0 5.24 1949 1639 A 75 ARG H A 75 ARG HBy 1.0 0.0 3.48 1950 1639 A 75 ARG H A 75 ARG HBx 1.0 0.0 3.48 1951 1640 A 75 ARG H A 75 ARG HG2 1.0 0.0 4.13 1952 1640 A 75 ARG H A 75 ARG HG3 1.0 0.0 4.13 1953 1641 A 75 ARG HBx A 75 ARG HD2 1.0 0.0 3.12 1954 1641 A 75 ARG HBy A 75 ARG HD2 1.0 0.0 3.12 1955 1641 A 75 ARG HD3 A 75 ARG HBy 1.0 0.0 3.12 1956 1641 A 75 ARG HBx A 75 ARG HD3 1.0 0.0 3.12 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 2 PRO C A 3 THR N A 3 THR CA A 3 THR C 1.0 -160.0 -80.0 PHI 2 2 A 3 THR N A 3 THR CA A 3 THR C A 4 SER N 1.0 100.0 170.0 PSI 3 3 A 3 THR C A 4 SER N A 4 SER CA A 4 SER C 1.0 -150.0 -80.0 PHI 4 4 A 4 SER N A 4 SER CA A 4 SER C A 5 GLU N 1.0 100.0 160.0 PSI 5 5 A 4 SER C A 5 GLU N A 5 GLU CA A 5 GLU C 1.0 -170.0 -70.0 PHI 6 6 A 5 GLU N A 5 GLU CA A 5 GLU C A 6 GLY N 1.0 100.0 170.0 PSI 7 7 A 5 GLU C A 6 GLY N A 6 GLY CA A 6 GLY C 1.0 -160.0 -90.0 PHI 8 8 A 6 GLY N A 6 GLY CA A 6 GLY C A 7 CYS N 1.0 110.0 180.0 PSI 9 9 A 6 GLY C A 7 CYS N A 7 CYS CA A 7 CYS C 1.0 -160.0 -80.0 PHI 10 10 A 7 CYS N A 7 CYS CA A 7 CYS C A 8 GLN N 1.0 100.0 170.0 PSI 11 11 A 7 CYS C A 8 GLN N A 8 GLN CA A 8 GLN C 1.0 -180.0 -60.0 PHI 12 12 A 8 GLN N A 8 GLN CA A 8 GLN C A 9 ILE N 1.0 100.0 180.0 PSI 13 13 A 8 GLN C A 9 ILE N A 9 ILE CA A 9 ILE C 1.0 -160.0 -90.0 PHI 14 14 A 9 ILE N A 9 ILE CA A 9 ILE C A 10 ILE N 1.0 100.0 170.0 PSI 15 15 A 9 ILE C A 10 ILE N A 10 ILE CA A 10 ILE C 1.0 -140.0 -70.0 PHI 16 16 A 10 ILE N A 10 ILE CA A 10 ILE C A 11 HIS N 1.0 100.0 170.0 PSI 17 17 A 10 ILE C A 11 HIS N A 11 HIS CA A 11 HIS C 1.0 -170.0 -50.0 PHI 18 18 A 11 HIS N A 11 HIS CA A 11 HIS C A 12 PRO N 1.0 100.0 180.0 PSI 19 19 A 13 PRO C A 14 TRP N A 14 TRP CA A 14 TRP C 1.0 -100.0 -40.0 PHI 20 20 A 14 TRP N A 14 TRP CA A 14 TRP C A 15 GLU N 1.0 100.0 180.0 PSI 21 21 A 14 TRP C A 15 GLU N A 15 GLU CA A 15 GLU C 1.0 -180.0 -40.0 PHI 22 22 A 15 GLU N A 15 GLU CA A 15 GLU C A 16 GLY N 1.0 100.0 190.0 PSI 23 23 A 16 GLY C A 17 GLY N A 17 GLY CA A 17 GLY C 1.0 -180.0 -70.0 PHI 24 24 A 17 GLY N A 17 GLY CA A 17 GLY C A 18 ILE N 1.0 100.0 190.0 PSI 25 25 A 17 GLY C A 18 ILE N A 18 ILE CA A 18 ILE C 1.0 -160.0 -80.0 PHI 26 26 A 18 ILE N A 18 ILE CA A 18 ILE C A 19 ARG N 1.0 100.0 180.0 PSI 27 27 A 18 ILE C A 19 ARG N A 19 ARG CA A 19 ARG C 1.0 -160.0 -40.0 PHI 28 28 A 19 ARG N A 19 ARG CA A 19 ARG C A 20 TYR N 1.0 90.0 180.0 PSI 29 29 A 19 ARG C A 20 TYR N A 20 TYR CA A 20 TYR C 1.0 -180.0 -60.0 PHI 30 30 A 20 TYR N A 20 TYR CA A 20 TYR C A 21 ARG N 1.0 100.0 190.0 PSI 31 31 A 21 ARG C A 22 GLY N A 22 GLY CA A 22 GLY C 1.0 -180.0 -70.0 PHI 32 32 A 22 GLY N A 22 GLY CA A 22 GLY C A 23 LEU N 1.0 100.0 190.0 PSI 33 33 A 22 GLY C A 23 LEU N A 23 LEU CA A 23 LEU C 1.0 -150.0 -90.0 PHI 34 34 A 23 LEU N A 23 LEU CA A 23 LEU C A 24 THR N 1.0 100.0 170.0 PSI 35 35 A 23 LEU C A 24 THR N A 24 THR CA A 24 THR C 1.0 -180.0 -70.0 PHI 36 36 A 24 THR N A 24 THR CA A 24 THR C A 25 ARG N 1.0 100.0 180.0 PSI 37 37 A 24 THR C A 25 ARG N A 25 ARG CA A 25 ARG C 1.0 -130.0 -50.0 PHI 38 38 A 25 ARG N A 25 ARG CA A 25 ARG C A 26 ASP N 1.0 120.0 190.0 PSI 39 39 A 27 GLN C A 28 VAL N A 28 VAL CA A 28 VAL C 1.0 40.0 80.0 PHI 40 40 A 28 VAL N A 28 VAL CA A 28 VAL C A 29 LYS N 1.0 10.0 60.0 PSI 41 41 A 29 LYS C A 30 ALA N A 30 ALA CA A 30 ALA C 1.0 -180.0 -90.0 PHI 42 42 A 30 ALA N A 30 ALA CA A 30 ALA C A 31 ILE N 1.0 130.0 190.0 PSI 43 43 A 30 ALA C A 31 ILE N A 31 ILE CA A 31 ILE C 1.0 -170.0 -40.0 PHI 44 44 A 31 ILE N A 31 ILE CA A 31 ILE C A 32 ASN N 1.0 90.0 180.0 PSI 45 45 A 32 ASN C A 33 PHE N A 33 PHE CA A 33 PHE C 1.0 -170.0 -90.0 PHI 46 46 A 33 PHE N A 33 PHE CA A 33 PHE C A 34 LEU N 1.0 110.0 180.0 PSI 47 47 A 33 PHE C A 34 LEU N A 34 LEU CA A 34 LEU C 1.0 -160.0 -50.0 PHI 48 48 A 34 LEU N A 34 LEU CA A 34 LEU C A 35 PRO N 1.0 90.0 180.0 PSI 49 49 A 37 ASP C A 38 TYR N A 38 TYR CA A 38 TYR C 1.0 -160.0 -50.0 PHI 50 50 A 38 TYR N A 38 TYR CA A 38 TYR C A 39 GLU N 1.0 90.0 160.0 PSI 51 51 A 38 TYR C A 39 GLU N A 39 GLU CA A 39 GLU C 1.0 -160.0 -80.0 PHI 52 52 A 39 GLU N A 39 GLU CA A 39 GLU C A 40 ILE N 1.0 100.0 170.0 PSI 53 53 A 39 GLU C A 40 ILE N A 40 ILE CA A 40 ILE C 1.0 -160.0 -90.0 PHI 54 54 A 40 ILE N A 40 ILE CA A 40 ILE C A 41 GLU N 1.0 120.0 180.0 PSI 55 55 A 40 ILE C A 41 GLU N A 41 GLU CA A 41 GLU C 1.0 -160.0 -80.0 PHI 56 56 A 41 GLU N A 41 GLU CA A 41 GLU C A 42 TYR N 1.0 100.0 170.0 PSI 57 57 A 41 GLU C A 42 TYR N A 42 TYR CA A 42 TYR C 1.0 -180.0 -40.0 PHI 58 58 A 42 TYR N A 42 TYR CA A 42 TYR C A 43 VAL N 1.0 100.0 190.0 PSI 59 59 A 42 TYR C A 43 VAL N A 43 VAL CA A 43 VAL C 1.0 -160.0 -50.0 PHI 60 60 A 43 VAL N A 43 VAL CA A 43 VAL C A 44 CYS N 1.0 100.0 170.0 PSI 61 61 A 43 VAL C A 44 CYS N A 44 CYS CA A 44 CYS C 1.0 -170.0 -90.0 PHI 62 62 A 44 CYS N A 44 CYS CA A 44 CYS C A 45 ARG N 1.0 110.0 180.0 PSI 63 63 A 44 CYS C A 45 ARG N A 45 ARG CA A 45 ARG C 1.0 -150.0 -60.0 PHI 64 64 A 45 ARG N A 45 ARG CA A 45 ARG C A 46 GLY N 1.0 90.0 160.0 PSI 65 65 A 46 GLY C A 47 GLU N A 47 GLU CA A 47 GLU C 1.0 -180.0 -50.0 PHI 66 66 A 47 GLU N A 47 GLU CA A 47 GLU C A 48 ARG N 1.0 90.0 190.0 PSI 67 67 A 47 GLU C A 48 ARG N A 48 ARG CA A 48 ARG C 1.0 -170.0 -90.0 PHI 68 68 A 48 ARG N A 48 ARG CA A 48 ARG C A 49 GLU N 1.0 100.0 180.0 PSI 69 69 A 48 ARG C A 49 GLU N A 49 GLU CA A 49 GLU C 1.0 -160.0 -80.0 PHI 70 70 A 49 GLU N A 49 GLU CA A 49 GLU C A 50 VAL N 1.0 100.0 170.0 PSI 71 71 A 49 GLU C A 50 VAL N A 50 VAL CA A 50 VAL C 1.0 -140.0 -70.0 PHI 72 72 A 50 VAL N A 50 VAL CA A 50 VAL C A 51 VAL N 1.0 90.0 150.0 PSI 73 73 A 50 VAL C A 51 VAL N A 51 VAL CA A 51 VAL C 1.0 -150.0 -80.0 PHI 74 74 A 51 VAL N A 51 VAL CA A 51 VAL C A 52 GLY N 1.0 100.0 150.0 PSI 75 75 A 51 VAL C A 52 GLY N A 52 GLY CA A 52 GLY C 1.0 -150.0 -50.0 PHI 76 76 A 52 GLY N A 52 GLY CA A 52 GLY C A 53 PRO N 1.0 100.0 170.0 PSI 77 77 A 53 PRO C A 54 LYS N A 54 LYS CA A 54 LYS C 1.0 -160.0 -50.0 PHI 78 78 A 54 LYS N A 54 LYS CA A 54 LYS C A 55 VAL N 1.0 90.0 170.0 PSI 79 79 A 54 LYS C A 55 VAL N A 55 VAL CA A 55 VAL C 1.0 -160.0 -100.0 PHI 80 80 A 55 VAL N A 55 VAL CA A 55 VAL C A 56 ARG N 1.0 130.0 180.0 PSI 81 81 A 55 VAL C A 56 ARG N A 56 ARG CA A 56 ARG C 1.0 -160.0 -80.0 PHI 82 82 A 56 ARG N A 56 ARG CA A 56 ARG C A 57 LYS N 1.0 100.0 170.0 PSI 83 83 A 56 ARG C A 57 LYS N A 57 LYS CA A 57 LYS C 1.0 -170.0 -60.0 PHI 84 84 A 57 LYS N A 57 LYS CA A 57 LYS C A 58 CYS N 1.0 90.0 180.0 PSI 85 85 A 58 CYS C A 59 LEU N A 59 LEU CA A 59 LEU C 1.0 -170.0 -90.0 PHI 86 86 A 59 LEU N A 59 LEU CA A 59 LEU C A 60 ALA N 1.0 110.0 180.0 PSI 87 87 A 59 LEU C A 60 ALA N A 60 ALA CA A 60 ALA C 1.0 -180.0 -50.0 PHI 88 88 A 60 ALA N A 60 ALA CA A 60 ALA C A 61 ASN N 1.0 100.0 190.0 PSI 89 89 A 60 ALA C A 61 ASN N A 61 ASN CA A 61 ASN C 1.0 -160.0 -80.0 PHI 90 90 A 61 ASN N A 61 ASN CA A 61 ASN C A 62 GLY N 1.0 110.0 180.0 PSI 91 91 A 61 ASN C A 62 GLY N A 62 GLY CA A 62 GLY C 1.0 -180.0 -60.0 PHI 92 92 A 62 GLY N A 62 GLY CA A 62 GLY C A 63 SER N 1.0 90.0 190.0 PSI 93 93 A 62 GLY C A 63 SER N A 63 SER CA A 63 SER C 1.0 -180.0 -90.0 PHI 94 94 A 63 SER N A 63 SER CA A 63 SER C A 64 TRP N 1.0 110.0 180.0 PSI 95 95 A 63 SER C A 64 TRP N A 64 TRP CA A 64 TRP C 1.0 -180.0 -50.0 PHI 96 96 A 64 TRP N A 64 TRP CA A 64 TRP C A 65 THR N 1.0 90.0 180.0 PSI 97 97 A 64 TRP C A 65 THR N A 65 THR CA A 65 THR C 1.0 -180.0 -50.0 PHI 98 98 A 65 THR N A 65 THR CA A 65 THR C A 66 ASP N 1.0 80.0 190.0 PSI 99 99 A 65 THR C A 66 ASP N A 66 ASP CA A 66 ASP C 1.0 -160.0 -70.0 PHI 100 100 A 68 ASP N A 68 ASP CA A 68 ASP C A 69 THR N 1.0 90.0 170.0 PSI 101 101 A 68 ASP N A 68 ASP CA A 68 ASP C A 69 THR N 1.0 90.0 170.0 PSI 102 102 A 66 ASP C A 67 MET N A 67 MET CA A 67 MET C 1.0 -160.0 -70.0 PHI 103 103 A 67 MET N A 67 MET CA A 67 MET C A 68 ASP N 1.0 90.0 170.0 PSI 104 104 A 67 MET C A 68 ASP N A 68 ASP CA A 68 ASP C 1.0 -160.0 -70.0 PHI 105 105 A 68 ASP C A 69 THR N A 69 THR CA A 69 THR C 1.0 -160.0 -70.0 PHI 106 106 A 69 THR N A 69 THR CA A 69 THR C A 70 PRO N 1.0 90.0 170.0 PSI 107 107 A 70 PRO C A 71 SER N A 71 SER CA A 71 SER C 1.0 -160.0 -70.0 PHI 108 108 A 71 SER N A 71 SER CA A 71 SER C A 72 ARG N 1.0 100.0 180.0 PSI 109 109 A 71 SER C A 72 ARG N A 72 ARG CA A 72 ARG C 1.0 -170.0 -80.0 PHI 110 110 A 72 ARG N A 72 ARG CA A 72 ARG C A 73 CYS N 1.0 100.0 180.0 PSI 111 111 A 72 ARG C A 73 CYS N A 73 CYS CA A 73 CYS C 1.0 -120.0 -40.0 PHI 112 112 A 73 CYS N A 73 CYS CA A 73 CYS C A 74 VAL N 1.0 100.0 170.0 PSI stop_ save_