data_nef_c19953_2mov save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 2MOV stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 18 CYS SG 1 79 CYS SG stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY start . false 2 A 2 SER middle . . 3 A 3 ALA middle . . 4 A 4 GLN middle . . 5 A 5 ASN middle . . 6 A 6 ILE middle . . 7 A 7 THR middle . . 8 A 8 ALA middle . . 9 A 9 ARG middle . . 10 A 10 ILE middle . . 11 A 11 GLY middle . false 12 A 12 GLU middle . . 13 A 13 PRO middle . false 14 A 14 LEU middle . . 15 A 15 VAL middle . . 16 A 16 LEU middle . . 17 A 17 LYS middle . . 18 A 18 CYS middle -HG . 19 A 19 LYS middle . . 20 A 20 GLY middle . false 21 A 21 ALA middle . . 22 A 22 PRO middle . false 23 A 23 LYS middle . . 24 A 24 LYS middle . . 25 A 25 PRO middle . false 26 A 26 PRO middle . false 27 A 27 GLN middle . . 28 A 28 ARG middle . . 29 A 29 LEU middle . . 30 A 30 GLU middle . . 31 A 31 TRP middle . . 32 A 32 LYS middle . . 33 A 33 LEU middle . . 34 A 34 ASN middle . . 35 A 35 THR middle . . 36 A 36 GLY middle . false 37 A 37 ARG middle . . 38 A 38 THR middle . . 39 A 39 GLU middle . . 40 A 40 ALA middle . . 41 A 41 TRP middle . . 42 A 42 LYS middle . . 43 A 43 VAL middle . . 44 A 44 LEU middle . . 45 A 45 SER middle . . 46 A 46 PRO middle . false 47 A 47 GLN middle . . 48 A 48 GLY middle . false 49 A 49 GLY middle . false 50 A 50 GLY middle . false 51 A 51 PRO middle . false 52 A 52 TRP middle . . 53 A 53 ASP middle . . 54 A 54 SER middle . . 55 A 55 VAL middle . . 56 A 56 ALA middle . . 57 A 57 ARG middle . . 58 A 58 VAL middle . . 59 A 59 LEU middle . . 60 A 60 PRO middle . false 61 A 61 ASN middle . . 62 A 62 GLY middle . false 63 A 63 SER middle . . 64 A 64 LEU middle . . 65 A 65 PHE middle . . 66 A 66 LEU middle . . 67 A 67 PRO middle . false 68 A 68 ALA middle . . 69 A 69 VAL middle . . 70 A 70 GLY middle . false 71 A 71 ILE middle . . 72 A 72 GLN middle . . 73 A 73 ASP middle . . 74 A 74 GLU middle . . 75 A 75 GLY middle . false 76 A 76 ILE middle . . 77 A 77 PHE middle . . 78 A 78 ARG middle . . 79 A 79 CYS middle -HG . 80 A 80 GLN middle . . 81 A 81 ALA middle . . 82 A 82 MET middle . . 83 A 83 ASN middle . . 84 A 84 ARG middle . . 85 A 85 ASN middle . . 86 A 86 GLY middle . false 87 A 87 LYS middle . . 88 A 88 GLU middle . . 89 A 89 THR middle . . 90 A 90 LYS middle . . 91 A 91 SER middle . . 92 A 92 ASN middle . . 93 A 93 TYR middle . . 94 A 94 ARG middle . . 95 A 95 VAL middle . . 96 A 96 ARG middle . . 97 A 97 VAL middle . . 98 A 98 TYR middle . . 99 A 99 GLN middle . . 100 A 100 ILE middle . . 101 A 101 PRO middle . false 102 A 102 GLY middle . false 103 A 103 LYS middle . . 104 A 104 PRO middle . false 105 A 105 GLU end . . 106 B 1 IOR . . . 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 H1 H 1 8.574 0.020 A 1 GLY HA2 H 1 4.167 0.020 A 1 GLY HA3 H 1 4.167 0.020 A 1 GLY C C 13 182.218 0.3 A 1 GLY CA C 13 45.278 0.3 A 1 GLY N N 15 109.581 0.3 A 2 SER H H 1 7.718 0.020 A 2 SER CA C 13 56.058 0.3 A 2 SER CB C 13 73.640 0.3 A 2 SER N N 15 120.242 0.3 A 3 ALA H H 1 8.270 0.020 A 3 ALA HA H 1 4.255 0.020 A 3 ALA HB% H 1 1.122 0.020 A 3 ALA CA C 13 52.796 0.3 A 3 ALA CB C 13 19.073 0.3 A 3 ALA N N 15 125.382 0.3 A 4 GLN H H 1 8.369 0.020 A 4 GLN HA H 1 4.376 0.020 A 4 GLN HB2 H 1 1.981 0.020 A 4 GLN HB3 H 1 1.981 0.020 A 4 GLN HG2 H 1 2.464 0.020 A 4 GLN HG3 H 1 2.464 0.020 A 4 GLN C C 13 180.249 0.3 A 4 GLN CA C 13 55.247 0.3 A 4 GLN CB C 13 30.734 0.3 A 4 GLN N N 15 121.681 0.3 A 5 ASN H H 1 8.855 0.020 A 5 ASN HA H 1 5.295 0.020 A 5 ASN HB2 H 1 2.670 0.020 A 5 ASN HB3 H 1 2.670 0.020 A 5 ASN HD21 H 1 5.906 0.020 A 5 ASN HD22 H 1 7.815 0.020 A 5 ASN C C 13 180.338 0.3 A 5 ASN CA C 13 53.778 0.3 A 5 ASN CB C 13 39.425 0.3 A 5 ASN N N 15 125.011 0.3 A 6 ILE H H 1 9.029 0.020 A 6 ILE HA H 1 4.442 0.020 A 6 ILE HB H 1 1.817 0.020 A 6 ILE HG2% H 1 0.763 0.020 A 6 ILE C C 13 180.658 0.3 A 6 ILE CA C 13 58.746 0.3 A 6 ILE CB C 13 40.589 0.3 A 6 ILE CD1 C 13 14.279 0.3 A 6 ILE CG1 C 13 28.373 0.3 A 6 ILE N N 15 126.410 0.3 A 7 THR H H 1 8.646 0.020 A 7 THR HA H 1 4.934 0.020 A 7 THR HB H 1 3.884 0.020 A 7 THR HG2% H 1 0.961 0.020 A 7 THR C C 13 182.475 0.3 A 7 THR CA C 13 61.385 0.3 A 7 THR CB C 13 69.377 0.3 A 7 THR N N 15 123.534 0.3 A 8 ALA H H 1 8.962 0.020 A 8 ALA HA H 1 4.524 0.020 A 8 ALA HB% H 1 1.167 0.020 A 8 ALA C C 13 180.516 0.3 A 8 ALA CA C 13 49.905 0.3 A 8 ALA CB C 13 22.770 0.3 A 8 ALA N N 15 130.785 0.3 A 9 ARG H H 1 8.253 0.020 A 9 ARG HA H 1 4.475 0.020 A 9 ARG HBy H 1 1.604 0.020 A 9 ARG HBx H 1 1.407 0.020 A 9 ARG HD2 H 1 3.071 0.020 A 9 ARG HD3 H 1 3.071 0.020 A 9 ARG HG2 H 1 1.295 0.020 A 9 ARG HG3 H 1 1.295 0.020 A 9 ARG CA C 13 55.318 0.3 A 9 ARG CB C 13 31.026 0.3 A 9 ARG CD C 13 43.806 0.3 A 9 ARG N N 15 121.142 0.3 A 10 ILE H H 1 8.033 0.020 A 10 ILE HA H 1 3.416 0.020 A 10 ILE HB H 1 1.475 0.020 A 10 ILE HD1% H 1 0.762 0.020 A 10 ILE HG12 H 1 1.065 0.020 A 10 ILE HG13 H 1 1.065 0.020 A 10 ILE HG2% H 1 0.837 0.020 A 10 ILE C C 13 179.374 0.3 A 10 ILE CA C 13 62.983 0.3 A 10 ILE CB C 13 37.678 0.3 A 10 ILE CD1 C 13 13.885 0.3 A 10 ILE CG1 C 13 27.351 0.3 A 10 ILE CG2 C 13 17.040 0.3 A 10 ILE N N 15 122.711 0.3 A 11 GLY H H 1 9.422 0.020 A 11 GLY HAy H 1 4.130 0.020 A 11 GLY HAx H 1 3.294 0.020 A 11 GLY C C 13 182.099 0.3 A 11 GLY CA C 13 44.963 0.3 A 11 GLY N N 15 114.163 0.3 A 12 GLU H H 1 7.584 0.020 A 12 GLU HA H 1 4.650 0.020 A 12 GLU HB2 H 1 1.887 0.020 A 12 GLU HB3 H 1 1.887 0.020 A 12 GLU HG2 H 1 2.114 0.020 A 12 GLU HG3 H 1 2.114 0.020 A 12 GLU C C 13 182.012 0.3 A 12 GLU CA C 13 54.326 0.3 A 12 GLU CB C 13 29.647 0.3 A 12 GLU N N 15 120.916 0.3 A 13 PRO HA H 1 4.622 0.020 A 13 PRO HB2 H 1 2.225 0.020 A 13 PRO HB3 H 1 2.225 0.020 A 13 PRO CA C 13 61.936 0.3 A 13 PRO CB C 13 33.439 0.3 A 13 PRO CD C 13 51.444 0.3 A 13 PRO CG C 13 27.743 0.3 A 14 LEU H H 1 8.555 0.020 A 14 LEU HA H 1 4.393 0.020 A 14 LEU HBy H 1 1.267 0.020 A 14 LEU HBx H 1 1.039 0.020 A 14 LEU HD1% H 1 0.885 0.020 A 14 LEU HD2% H 1 0.885 0.020 A 14 LEU HG H 1 1.780 0.020 A 14 LEU CA C 13 54.384 0.3 A 14 LEU CB C 13 46.895 0.3 A 14 LEU N N 15 122.239 0.3 A 15 VAL H H 1 8.010 0.020 A 15 VAL HA H 1 4.852 0.020 A 15 VAL HB H 1 1.669 0.020 A 15 VAL HG1% H 1 1.144 0.020 A 15 VAL HG2% H 1 0.627 0.020 A 15 VAL C C 13 180.427 0.3 A 15 VAL CA C 13 60.757 0.3 A 15 VAL CB C 13 33.605 0.3 A 15 VAL CG1 C 13 22.827 0.3 A 15 VAL CG2 C 13 21.754 0.3 A 15 VAL N N 15 124.751 0.3 A 16 LEU H H 1 8.847 0.020 A 16 LEU HA H 1 4.278 0.020 A 16 LEU HB2 H 1 1.548 0.020 A 16 LEU HB3 H 1 1.548 0.020 A 16 LEU HD1% H 1 0.991 0.020 A 16 LEU HD2% H 1 0.733 0.020 A 16 LEU CA C 13 52.209 0.3 A 16 LEU CB C 13 43.912 0.3 A 16 LEU CD1 C 13 23.413 0.3 A 16 LEU CD2 C 13 24.043 0.3 A 16 LEU CG C 13 27.271 0.3 A 16 LEU N N 15 126.833 0.3 A 17 LYS H H 1 8.240 0.020 A 17 LYS HA H 1 4.814 0.020 A 17 LYS HB2 H 1 1.681 0.020 A 17 LYS HB3 H 1 1.681 0.020 A 17 LYS HE2 H 1 3.208 0.020 A 17 LYS HE3 H 1 3.208 0.020 A 17 LYS HG2 H 1 1.386 0.020 A 17 LYS HG3 H 1 1.386 0.020 A 17 LYS C C 13 177.595 0.3 A 17 LYS CA C 13 56.872 0.3 A 17 LYS CB C 13 34.070 0.3 A 17 LYS CD C 13 28.294 0.3 A 17 LYS CG C 13 25.224 0.3 A 17 LYS N N 15 122.534 0.3 A 18 CYS H H 1 8.882 0.020 A 18 CYS HA H 1 4.489 0.020 A 18 CYS HBy H 1 2.277 0.020 A 18 CYS HBx H 1 2.079 0.020 A 18 CYS CA C 13 66.588 0.3 A 18 CYS CB C 13 42.274 0.3 A 18 CYS N N 15 127.085 0.3 A 19 LYS H H 1 8.123 0.020 A 19 LYS HA H 1 4.590 0.020 A 19 LYS HB2 H 1 1.826 0.020 A 19 LYS HB3 H 1 1.826 0.020 A 19 LYS HD2 H 1 1.705 0.020 A 19 LYS HD3 H 1 1.705 0.020 A 19 LYS HE2 H 1 2.949 0.020 A 19 LYS HE3 H 1 2.949 0.020 A 19 LYS HG2 H 1 1.401 0.020 A 19 LYS HG3 H 1 1.401 0.020 A 19 LYS C C 13 174.655 0.3 A 19 LYS CA C 13 58.753 0.3 A 19 LYS CB C 13 30.811 0.3 A 19 LYS CD C 13 29.161 0.3 A 19 LYS CG C 13 24.830 0.3 A 19 LYS N N 15 126.461 0.3 A 20 GLY H H 1 8.430 0.020 A 20 GLY HAy H 1 3.851 0.020 A 20 GLY HAx H 1 3.490 0.020 A 20 GLY C C 13 182.286 0.3 A 20 GLY N N 15 109.992 0.3 A 21 ALA H H 1 7.366 0.020 A 21 ALA HA H 1 4.315 0.020 A 21 ALA HB% H 1 1.210 0.020 A 21 ALA C C 13 179.946 0.3 A 21 ALA CA C 13 49.916 0.3 A 21 ALA CB C 13 18.331 0.3 A 21 ALA N N 15 122.552 0.3 A 22 PRO HA H 1 4.376 0.020 A 22 PRO HB2 H 1 1.945 0.020 A 22 PRO HB3 H 1 1.945 0.020 A 22 PRO C C 13 179.442 0.3 A 22 PRO CA C 13 63.079 0.3 A 22 PRO CB C 13 32.363 0.3 A 23 LYS H H 1 8.279 0.020 A 23 LYS HA H 1 4.081 0.020 A 23 LYS HB2 H 1 1.826 0.020 A 23 LYS HB3 H 1 1.826 0.020 A 23 LYS HD2 H 1 1.661 0.020 A 23 LYS HD3 H 1 1.661 0.020 A 23 LYS HE2 H 1 2.904 0.020 A 23 LYS HE3 H 1 2.904 0.020 A 23 LYS HG2 H 1 1.395 0.020 A 23 LYS HG3 H 1 1.395 0.020 A 23 LYS C C 13 180.160 0.3 A 23 LYS CA C 13 57.732 0.3 A 23 LYS CB C 13 32.906 0.3 A 23 LYS CD C 13 29.161 0.3 A 23 LYS CG C 13 24.830 0.3 A 23 LYS N N 15 119.560 0.3 A 24 LYS H H 1 7.281 0.020 A 24 LYS HA H 1 4.285 0.020 A 24 LYS HB2 H 1 1.780 0.020 A 24 LYS HB3 H 1 1.780 0.020 A 24 LYS HD2 H 1 1.674 0.020 A 24 LYS HD3 H 1 1.674 0.020 A 24 LYS HE2 H 1 2.934 0.020 A 24 LYS HE3 H 1 2.934 0.020 A 24 LYS C C 13 182.564 0.3 A 24 LYS CA C 13 52.926 0.3 A 24 LYS CB C 13 33.682 0.3 A 24 LYS CD C 13 30.027 0.3 A 24 LYS CG C 13 25.066 0.3 A 24 LYS N N 15 116.784 0.3 A 28 ARG H H 1 9.109 0.020 A 28 ARG HA H 1 4.458 0.020 A 28 ARG HB2 H 1 1.719 0.020 A 28 ARG HB3 H 1 1.719 0.020 A 28 ARG HD2 H 1 3.253 0.020 A 28 ARG HD3 H 1 3.253 0.020 A 28 ARG HG2 H 1 1.598 0.020 A 28 ARG HG3 H 1 1.598 0.020 A 28 ARG N N 15 125.840 0.3 A 29 LEU H H 1 7.799 0.020 A 29 LEU HA H 1 4.590 0.020 A 29 LEU HB2 H 1 1.556 0.020 A 29 LEU HB3 H 1 1.556 0.020 A 29 LEU HD1% H 1 0.861 0.020 A 29 LEU HD2% H 1 0.991 0.020 A 29 LEU HG H 1 1.997 0.020 A 29 LEU CA C 13 54.323 0.3 A 29 LEU CB C 13 45.484 0.3 A 29 LEU CD1 C 13 26.301 0.3 A 29 LEU CD2 C 13 25.302 0.3 A 29 LEU CG C 13 22.262 0.3 A 29 LEU N N 15 121.383 0.3 A 30 GLU H H 1 7.994 0.020 A 30 GLU HA H 1 4.164 0.020 A 30 GLU HB2 H 1 2.054 0.020 A 30 GLU HB3 H 1 2.054 0.020 A 30 GLU HG2 H 1 2.297 0.020 A 30 GLU HG3 H 1 2.297 0.020 A 30 GLU CA C 13 54.323 0.3 A 30 GLU CB C 13 29.757 0.3 A 30 GLU N N 15 121.472 0.3 A 32 LYS H H 1 9.738 0.020 A 32 LYS HA H 1 4.543 0.020 A 32 LYS HB2 H 1 1.328 0.020 A 32 LYS HB3 H 1 1.328 0.020 A 32 LYS HD2 H 1 1.765 0.020 A 32 LYS HD3 H 1 1.765 0.020 A 32 LYS HE2 H 1 2.889 0.020 A 32 LYS HE3 H 1 2.889 0.020 A 32 LYS HG2 H 1 1.006 0.020 A 32 LYS C C 13 180.676 0.3 A 32 LYS CA C 13 55.066 0.3 A 32 LYS CB C 13 32.291 0.3 A 32 LYS CD C 13 28.924 0.3 A 32 LYS CG C 13 24.830 0.3 A 32 LYS N N 15 120.067 0.3 A 33 LEU H H 1 9.195 0.020 A 33 LEU HA H 1 5.164 0.020 A 33 LEU HB2 H 1 1.066 0.020 A 33 LEU HB3 H 1 1.066 0.020 A 33 LEU HD1% H 1 0.763 0.020 A 33 LEU HD2% H 1 0.330 0.020 A 33 LEU CA C 13 54.323 0.3 A 33 LEU CB C 13 43.680 0.3 A 33 LEU CD1 C 13 24.436 0.3 A 33 LEU CD2 C 13 23.169 0.3 A 33 LEU CG C 13 27.035 0.3 A 33 LEU N N 15 121.803 0.3 A 34 ASN H H 1 8.194 0.020 A 34 ASN HA H 1 4.240 0.020 A 34 ASN HB2 H 1 2.585 0.020 A 34 ASN HB3 H 1 2.585 0.020 A 34 ASN HD21 H 1 6.890 0.020 A 34 ASN HD22 H 1 7.072 0.020 A 34 ASN C C 13 180.213 0.3 A 34 ASN CA C 13 52.416 0.3 A 34 ASN CB C 13 36.786 0.3 A 34 ASN N N 15 119.192 0.3 A 35 THR H H 1 8.104 0.020 A 35 THR HA H 1 4.983 0.020 A 35 THR HB H 1 2.047 0.020 A 35 THR C C 13 180.071 0.3 A 35 THR CA C 13 59.212 0.3 A 35 THR CB C 13 72.326 0.3 A 35 THR N N 15 116.747 0.3 A 36 GLY H H 1 7.983 0.020 A 36 GLY HA2 H 1 3.933 0.020 A 36 GLY HA3 H 1 3.933 0.020 A 36 GLY C C 13 180.215 0.3 A 36 GLY CA C 13 47.260 0.3 A 36 GLY N N 15 108.825 0.3 A 37 ARG H H 1 8.076 0.020 A 37 ARG HA H 1 4.093 0.020 A 37 ARG HB2 H 1 1.387 0.020 A 37 ARG HB3 H 1 1.387 0.020 A 37 ARG HD2 H 1 2.949 0.020 A 37 ARG HD3 H 1 2.949 0.020 A 37 ARG HG2 H 1 1.737 0.020 A 37 ARG HG3 H 1 1.737 0.020 A 37 ARG C C 13 178.788 0.3 A 37 ARG CA C 13 57.505 0.3 A 37 ARG CB C 13 31.898 0.3 A 37 ARG CD C 13 43.097 0.3 A 37 ARG CG C 13 27.077 0.3 A 37 ARG N N 15 117.907 0.3 A 38 THR H H 1 7.463 0.020 A 38 THR HA H 1 4.426 0.020 A 38 THR HB H 1 4.224 0.020 A 38 THR HG2% H 1 1.507 0.020 A 38 THR C C 13 181.098 0.3 A 38 THR CA C 13 61.725 0.3 A 38 THR CB C 13 70.314 0.3 A 38 THR N N 15 108.611 0.3 A 39 GLU H H 1 8.580 0.020 A 39 GLU HA H 1 4.015 0.020 A 39 GLU HB2 H 1 1.932 0.020 A 39 GLU HB3 H 1 1.932 0.020 A 39 GLU HG2 H 1 2.190 0.020 A 39 GLU HG3 H 1 2.190 0.020 A 39 GLU C C 13 180.410 0.3 A 39 GLU CA C 13 57.859 0.3 A 39 GLU CB C 13 29.182 0.3 A 39 GLU CG C 13 34.436 0.3 A 39 GLU N N 15 120.194 0.3 A 40 ALA H H 1 7.734 0.020 A 40 ALA HA H 1 3.999 0.020 A 40 ALA HB% H 1 1.345 0.020 A 40 ALA C C 13 179.162 0.3 A 40 ALA CA C 13 51.608 0.3 A 40 ALA CB C 13 20.054 0.3 A 40 ALA N N 15 122.043 0.3 A 41 TRP H H 1 7.836 0.020 A 41 TRP HA H 1 4.557 0.020 A 41 TRP HBy H 1 2.984 0.020 A 41 TRP HBx H 1 2.810 0.020 A 41 TRP C C 13 178.895 0.3 A 41 TRP CA C 13 58.281 0.3 A 41 TRP CB C 13 29.823 0.3 A 41 TRP N N 15 119.285 0.3 A 42 LYS H H 1 9.214 0.020 A 42 LYS HA H 1 4.590 0.020 A 42 LYS HB2 H 1 1.472 0.020 A 42 LYS HB3 H 1 1.472 0.020 A 42 LYS HD2 H 1 1.902 0.020 A 42 LYS HD3 H 1 1.902 0.020 A 42 LYS HE2 H 1 2.828 0.020 A 42 LYS HE3 H 1 2.828 0.020 A 42 LYS HG2 H 1 1.364 0.020 A 42 LYS HG3 H 1 1.364 0.020 A 42 LYS C C 13 180.908 0.3 A 42 LYS CA C 13 54.579 0.3 A 42 LYS CB C 13 34.870 0.3 A 42 LYS CD C 13 28.924 0.3 A 42 LYS CG C 13 24.322 0.3 A 42 LYS N N 15 125.849 0.3 A 43 VAL H H 1 8.344 0.020 A 43 VAL HA H 1 4.606 0.020 A 43 VAL HB H 1 2.158 0.020 A 43 VAL HG1% H 1 0.839 0.020 A 43 VAL HG2% H 1 0.839 0.020 A 43 VAL C C 13 179.554 0.3 A 43 VAL CA C 13 62.006 0.3 A 43 VAL CB C 13 32.643 0.3 A 43 VAL CG1 C 13 21.050 0.3 A 43 VAL N N 15 124.313 0.3 A 44 LEU H H 1 8.523 0.020 A 44 LEU HA H 1 4.524 0.020 A 44 LEU HB2 H 1 1.423 0.020 A 44 LEU HB3 H 1 1.423 0.020 A 44 LEU HD1% H 1 1.099 0.020 A 44 LEU HD2% H 1 0.930 0.020 A 44 LEU HG H 1 1.590 0.020 A 44 LEU C C 13 178.913 0.3 A 44 LEU CA C 13 54.379 0.3 A 44 LEU CB C 13 42.451 0.3 A 44 LEU CD1 C 13 25.059 0.3 A 44 LEU CG C 13 26.873 0.3 A 44 LEU N N 15 122.206 0.3 A 45 SER H H 1 8.712 0.020 A 45 SER HA H 1 4.953 0.020 A 45 SER HB2 H 1 3.872 0.020 A 45 SER HB3 H 1 3.872 0.020 A 45 SER C C 13 181.717 0.3 A 45 SER CA C 13 55.886 0.3 A 45 SER CB C 13 64.530 0.3 A 45 SER N N 15 118.360 0.3 A 46 PRO HA H 1 4.311 0.020 A 46 PRO HBy H 1 2.375 0.020 A 46 PRO HBx H 1 2.014 0.020 A 46 PRO C C 13 178.695 0.3 A 46 PRO CA C 13 64.638 0.3 A 46 PRO CB C 13 31.898 0.3 A 46 PRO CG C 13 27.665 0.3 A 47 GLN H H 1 8.176 0.020 A 47 GLN HA H 1 4.270 0.020 A 47 GLN HB2 H 1 2.034 0.020 A 47 GLN HB3 H 1 2.034 0.020 A 47 GLN HE21 H 1 7.466 0.020 A 47 GLN HE22 H 1 6.815 0.020 A 47 GLN HG2 H 1 2.297 0.020 A 47 GLN HG3 H 1 2.297 0.020 A 47 GLN C C 13 179.055 0.3 A 47 GLN CA C 13 56.809 0.3 A 47 GLN CB C 13 29.157 0.3 A 47 GLN CG C 13 34.357 0.3 A 47 GLN N N 15 116.933 0.3 A 48 GLY H H 1 8.009 0.020 A 48 GLY HA2 H 1 4.015 0.020 A 48 GLY HA3 H 1 4.015 0.020 A 48 GLY C C 13 181.200 0.3 A 48 GLY CA C 13 45.669 0.3 A 48 GLY N N 15 108.903 0.3 A 49 GLY H H 1 9.061 0.020 A 49 GLY HA2 H 1 4.005 0.020 A 49 GLY HA3 H 1 4.005 0.020 A 49 GLY C C 13 181.183 0.3 A 49 GLY N N 15 110.474 0.3 A 50 GLY H H 1 9.001 0.020 A 50 GLY HA2 H 1 3.983 0.020 A 50 GLY HA3 H 1 3.983 0.020 A 50 GLY C C 13 180.911 0.3 A 50 GLY CA C 13 45.160 0.3 A 50 GLY N N 15 110.287 0.3 A 51 PRO HA H 1 4.179 0.020 A 51 PRO HBy H 1 2.063 0.020 A 51 PRO HBx H 1 1.369 0.020 A 51 PRO C C 13 177.388 0.3 A 51 PRO CA C 13 64.638 0.3 A 51 PRO CB C 13 31.610 0.3 A 52 TRP H H 1 8.474 0.020 A 52 TRP HA H 1 4.393 0.020 A 52 TRP HBy H 1 3.409 0.020 A 52 TRP HBx H 1 3.150 0.020 A 52 TRP C C 13 178.913 0.3 A 52 TRP CA C 13 58.686 0.3 A 52 TRP CB C 13 28.435 0.3 A 52 TRP N N 15 118.198 0.3 A 53 ASP H H 1 7.734 0.020 A 53 ASP HA H 1 4.328 0.020 A 53 ASP HBy H 1 2.645 0.020 A 53 ASP HBx H 1 2.519 0.020 A 53 ASP C C 13 179.216 0.3 A 53 ASP CB C 13 40.589 0.3 A 53 ASP N N 15 120.269 0.3 A 54 SER H H 1 7.758 0.020 A 54 SER HA H 1 4.179 0.020 A 54 SER HB2 H 1 3.736 0.020 A 54 SER HB3 H 1 3.736 0.020 A 54 SER C C 13 181.590 0.3 A 54 SER CA C 13 59.705 0.3 A 54 SER CB C 13 63.402 0.3 A 54 SER N N 15 110.519 0.3 A 55 VAL H H 1 7.805 0.020 A 55 VAL HA H 1 4.343 0.020 A 55 VAL HB H 1 1.915 0.020 A 55 VAL HG1% H 1 0.854 0.020 A 55 VAL HG2% H 1 0.854 0.020 A 55 VAL C C 13 180.908 0.3 A 55 VAL CA C 13 63.429 0.3 A 55 VAL CB C 13 33.605 0.3 A 55 VAL CG1 C 13 21.365 0.3 A 55 VAL CG2 C 13 20.735 0.3 A 55 VAL N N 15 119.941 0.3 A 56 ALA H H 1 8.195 0.020 A 56 ALA HA H 1 4.718 0.020 A 56 ALA HB% H 1 1.044 0.020 A 56 ALA C C 13 181.406 0.3 A 56 ALA CA C 13 51.875 0.3 A 56 ALA CB C 13 19.794 0.3 A 56 ALA N N 15 120.796 0.3 A 57 ARG H H 1 8.854 0.020 A 57 ARG HA H 1 4.606 0.020 A 57 ARG HB2 H 1 1.751 0.020 A 57 ARG HB3 H 1 1.751 0.020 A 57 ARG HD2 H 1 3.091 0.020 A 57 ARG HD3 H 1 3.091 0.020 A 57 ARG HG2 H 1 1.358 0.020 A 57 ARG HG3 H 1 1.358 0.020 A 57 ARG C C 13 181.780 0.3 A 57 ARG CA C 13 54.071 0.3 A 57 ARG CB C 13 34.070 0.3 A 57 ARG CD C 13 42.982 0.3 A 57 ARG CG C 13 28.350 0.3 A 57 ARG N N 15 118.535 0.3 A 58 VAL H H 1 8.594 0.020 A 58 VAL HA H 1 4.229 0.020 A 58 VAL HB H 1 1.833 0.020 A 58 VAL HG1% H 1 0.964 0.020 A 58 VAL HG2% H 1 0.964 0.020 A 58 VAL C C 13 178.859 0.3 A 58 VAL CA C 13 62.727 0.3 A 58 VAL CB C 13 31.898 0.3 A 58 VAL CG1 C 13 21.752 0.3 A 58 VAL N N 15 123.786 0.3 A 59 LEU H H 1 9.275 0.020 A 59 LEU HA H 1 4.255 0.020 A 59 LEU HB2 H 1 1.731 0.020 A 59 LEU HB3 H 1 1.731 0.020 A 59 LEU HD1% H 1 1.037 0.020 A 59 LEU HD2% H 1 0.961 0.020 A 59 LEU HG H 1 1.506 0.020 A 59 LEU C C 13 178.895 0.3 A 59 LEU CA C 13 54.012 0.3 A 59 LEU CB C 13 38.995 0.3 A 59 LEU CD1 C 13 24.279 0.3 A 59 LEU CD2 C 13 23.334 0.3 A 59 LEU CG C 13 26.038 0.3 A 59 LEU N N 15 129.460 0.3 A 60 PRO HA H 1 4.270 0.020 A 60 PRO HBy H 1 2.299 0.020 A 60 PRO HBx H 1 1.843 0.020 A 60 PRO C C 13 179.442 0.3 A 60 PRO CA C 13 65.933 0.3 A 61 ASN H H 1 7.248 0.020 A 61 ASN HA H 1 4.461 0.020 A 61 ASN HBy H 1 3.146 0.020 A 61 ASN HBx H 1 2.661 0.020 A 61 ASN HD21 H 1 6.496 0.020 A 61 ASN HD22 H 1 7.360 0.020 A 61 ASN C C 13 179.570 0.3 A 61 ASN CA C 13 52.242 0.3 A 61 ASN CB C 13 37.532 0.3 A 61 ASN N N 15 109.938 0.3 A 62 GLY H H 1 8.504 0.020 A 62 GLY HA2 H 1 4.103 0.020 A 62 GLY HA3 H 1 4.103 0.020 A 62 GLY C C 13 182.796 0.3 A 62 GLY CA C 13 45.530 0.3 A 62 GLY N N 15 108.629 0.3 A 63 SER H H 1 7.691 0.020 A 63 SER HA H 1 4.754 0.020 A 63 SER HB2 H 1 3.611 0.020 A 63 SER HB3 H 1 3.611 0.020 A 63 SER C C 13 184.665 0.3 A 63 SER CA C 13 59.488 0.3 A 63 SER CB C 13 63.484 0.3 A 63 SER N N 15 115.130 0.3 A 64 LEU H H 1 8.676 0.020 A 64 LEU HA H 1 4.149 0.020 A 64 LEU HB2 H 1 1.947 0.020 A 64 LEU HB3 H 1 1.947 0.020 A 64 LEU HD1% H 1 0.794 0.020 A 64 LEU HD2% H 1 1.006 0.020 A 64 LEU HG H 1 1.441 0.020 A 64 LEU CA C 13 53.611 0.3 A 64 LEU CB C 13 41.752 0.3 A 64 LEU CD1 C 13 24.357 0.3 A 64 LEU CD2 C 13 23.806 0.3 A 64 LEU CG C 13 25.611 0.3 A 64 LEU N N 15 123.759 0.3 A 65 PHE H H 1 8.960 0.020 A 65 PHE HA H 1 5.262 0.020 A 65 PHE HBy H 1 2.801 0.020 A 65 PHE HBx H 1 2.612 0.020 A 65 PHE C C 13 182.528 0.3 A 65 PHE CA C 13 54.231 0.3 A 65 PHE CB C 13 42.136 0.3 A 65 PHE N N 15 126.342 0.3 A 66 LEU H H 1 8.755 0.020 A 66 LEU HA H 1 4.437 0.020 A 66 LEU HB2 H 1 1.524 0.020 A 66 LEU HB3 H 1 1.524 0.020 A 66 LEU HD1% H 1 1.021 0.020 A 66 LEU HD2% H 1 0.930 0.020 A 66 LEU HG H 1 1.354 0.020 A 66 LEU CA C 13 52.175 0.3 A 66 LEU CB C 13 38.464 0.3 A 66 LEU CD1 C 13 24.672 0.3 A 66 LEU CD2 C 13 23.964 0.3 A 66 LEU CG C 13 26.001 0.3 A 66 LEU N N 15 130.155 0.3 A 67 PRO HA H 1 3.338 0.020 A 67 PRO HBy H 1 1.932 0.020 A 67 PRO HBx H 1 1.424 0.020 A 67 PRO C C 13 179.136 0.3 A 67 PRO CA C 13 63.830 0.3 A 67 PRO CB C 13 31.922 0.3 A 68 ALA H H 1 7.440 0.020 A 68 ALA HA H 1 3.517 0.020 A 68 ALA HB% H 1 0.898 0.020 A 68 ALA C C 13 180.587 0.3 A 68 ALA CA C 13 51.855 0.3 A 68 ALA CB C 13 19.171 0.3 A 68 ALA N N 15 116.300 0.3 A 69 VAL H H 1 7.993 0.020 A 69 VAL HA H 1 3.593 0.020 A 69 VAL HB H 1 1.901 0.020 A 69 VAL HG1% H 1 1.166 0.020 A 69 VAL HG2% H 1 1.249 0.020 A 69 VAL C C 13 179.501 0.3 A 69 VAL CA C 13 64.178 0.3 A 69 VAL CB C 13 32.208 0.3 A 69 VAL CG1 C 13 21.431 0.3 A 69 VAL CG2 C 13 20.893 0.3 A 69 VAL N N 15 125.447 0.3 A 70 GLY H H 1 9.822 0.020 A 70 GLY HA2 H 1 3.997 0.020 A 70 GLY HA3 H 1 3.997 0.020 A 70 GLY C C 13 181.353 0.3 A 70 GLY CA C 13 43.282 0.3 A 70 GLY N N 15 116.929 0.3 A 71 ILE H H 1 8.566 0.020 A 71 ILE HA H 1 3.696 0.020 A 71 ILE HB H 1 1.681 0.020 A 71 ILE HD1% H 1 0.792 0.020 A 71 ILE HG1y H 1 1.401 0.020 A 71 ILE HG1x H 1 0.333 0.020 A 71 ILE C C 13 177.839 0.3 A 71 ILE CA C 13 64.256 0.3 A 71 ILE CB C 13 38.493 0.3 A 71 ILE CD1 C 13 14.128 0.3 A 71 ILE CG1 C 13 27.507 0.3 A 71 ILE CG2 C 13 17.350 0.3 A 71 ILE N N 15 118.740 0.3 A 72 GLN H H 1 8.640 0.020 A 72 GLN HA H 1 4.174 0.020 A 72 GLN HB2 H 1 2.188 0.020 A 72 GLN HB3 H 1 2.188 0.020 A 72 GLN HE21 H 1 7.466 0.020 A 72 GLN HE22 H 1 7.027 0.020 A 72 GLN HG2 H 1 2.327 0.020 A 72 GLN HG3 H 1 2.327 0.020 A 72 GLN C C 13 180.690 0.3 A 72 GLN CA C 13 57.604 0.3 A 72 GLN CB C 13 28.438 0.3 A 72 GLN CG C 13 34.279 0.3 A 72 GLN N N 15 116.978 0.3 A 73 ASP H H 1 7.746 0.020 A 73 ASP HA H 1 4.573 0.020 A 73 ASP HBy H 1 2.728 0.020 A 73 ASP HBx H 1 2.588 0.020 A 73 ASP C C 13 182.643 0.3 A 73 ASP CA C 13 55.949 0.3 A 73 ASP CB C 13 41.675 0.3 A 73 ASP N N 15 116.362 0.3 A 74 GLU H H 1 6.614 0.020 A 74 GLU HA H 1 3.975 0.020 A 74 GLU HBy H 1 2.063 0.020 A 74 GLU HBx H 1 1.872 0.020 A 74 GLU HG2 H 1 2.464 0.020 A 74 GLU HG3 H 1 2.464 0.020 A 74 GLU C C 13 178.212 0.3 A 74 GLU CA C 13 57.651 0.3 A 74 GLU CB C 13 30.734 0.3 A 74 GLU CG C 13 36.641 0.3 A 74 GLU N N 15 113.012 0.3 A 75 GLY H H 1 8.166 0.020 A 75 GLY HAy H 1 4.524 0.020 A 75 GLY HAx H 1 3.720 0.020 A 75 GLY C C 13 184.569 0.3 A 75 GLY CA C 13 45.160 0.3 A 75 GLY N N 15 110.613 0.3 A 76 ILE H H 1 7.829 0.020 A 76 ILE HA H 1 5.244 0.020 A 76 ILE HB H 1 1.553 0.020 A 76 ILE HD1% H 1 0.739 0.020 A 76 ILE HG12 H 1 0.978 0.020 A 76 ILE HG13 H 1 0.978 0.020 A 76 ILE HG2% H 1 0.900 0.020 A 76 ILE C C 13 181.513 0.3 A 76 ILE CA C 13 58.514 0.3 A 76 ILE CB C 13 40.511 0.3 A 76 ILE CD1 C 13 13.064 0.3 A 76 ILE CG1 C 13 25.400 0.3 A 76 ILE CG2 C 13 19.318 0.3 A 76 ILE N N 15 120.633 0.3 A 77 PHE H H 1 9.053 0.020 A 77 PHE HA H 1 4.802 0.020 A 77 PHE HB2 H 1 2.904 0.020 A 77 PHE HB3 H 1 2.904 0.020 A 77 PHE CA C 13 56.750 0.3 A 77 PHE CB C 13 43.304 0.3 A 77 PHE N N 15 124.180 0.3 A 78 ARG H H 1 9.882 0.020 A 78 ARG HA H 1 4.836 0.020 A 78 ARG HB2 H 1 1.768 0.020 A 78 ARG HB3 H 1 1.768 0.020 A 78 ARG HD2 H 1 2.965 0.020 A 78 ARG HD3 H 1 2.965 0.020 A 78 ARG HG2 H 1 1.355 0.020 A 78 ARG HG3 H 1 1.355 0.020 A 78 ARG CA C 13 55.838 0.3 A 78 ARG CB C 13 31.898 0.3 A 78 ARG CD C 13 42.524 0.3 A 78 ARG CG C 13 28.767 0.3 A 78 ARG N N 15 123.423 0.3 A 79 CYS H H 1 8.875 0.020 A 79 CYS HA H 1 4.877 0.020 A 79 CYS HB2 H 1 2.812 0.020 A 79 CYS HB3 H 1 2.812 0.020 A 79 CYS C C 13 179.287 0.3 A 79 CYS CA C 13 62.728 0.3 A 79 CYS CB C 13 42.731 0.3 A 79 CYS N N 15 120.601 0.3 A 80 GLN H H 1 8.665 0.020 A 80 GLN HA H 1 4.294 0.020 A 80 GLN HB2 H 1 1.899 0.020 A 80 GLN HB3 H 1 1.899 0.020 A 80 GLN CA C 13 55.548 0.3 A 80 GLN CB C 13 32.984 0.3 A 80 GLN N N 15 128.089 0.3 A 81 ALA H H 1 8.369 0.020 A 81 ALA HA H 1 4.934 0.020 A 81 ALA HB% H 1 1.056 0.020 A 81 ALA C C 13 178.681 0.3 A 81 ALA CA C 13 51.875 0.3 A 81 ALA CB C 13 19.787 0.3 A 81 ALA N N 15 125.820 0.3 A 82 MET H H 1 8.043 0.020 A 82 MET HA H 1 4.786 0.020 A 82 MET HB2 H 1 1.798 0.020 A 82 MET HB3 H 1 1.798 0.020 A 82 MET HG2 H 1 2.957 0.020 A 82 MET HG3 H 1 2.957 0.020 A 82 MET C C 13 179.112 0.3 A 82 MET CA C 13 54.228 0.3 A 82 MET CB C 13 33.915 0.3 A 82 MET CG C 13 32.104 0.3 A 82 MET N N 15 119.807 0.3 A 83 ASN H H 1 8.399 0.020 A 83 ASN HA H 1 4.741 0.020 A 83 ASN HB2 H 1 2.858 0.020 A 83 ASN HB3 H 1 2.858 0.020 A 83 ASN HD21 H 1 6.951 0.020 A 83 ASN HD22 H 1 7.572 0.020 A 83 ASN C C 13 178.521 0.3 A 83 ASN CA C 13 51.530 0.3 A 83 ASN CB C 13 38.881 0.3 A 83 ASN N N 15 122.813 0.3 A 85 ASN H H 1 7.935 0.020 A 85 ASN HA H 1 4.652 0.020 A 85 ASN HBy H 1 2.857 0.020 A 85 ASN HBx H 1 2.607 0.020 A 85 ASN HD21 H 1 6.754 0.020 A 85 ASN HD22 H 1 7.360 0.020 A 85 ASN C C 13 180.376 0.3 A 85 ASN CA C 13 53.021 0.3 A 85 ASN CB C 13 38.881 0.3 A 85 ASN N N 15 115.594 0.3 A 86 GLY H H 1 7.950 0.020 A 86 GLY HA2 H 1 3.617 0.020 A 86 GLY HA3 H 1 3.617 0.020 A 86 GLY C C 13 182.286 0.3 A 86 GLY CA C 13 45.597 0.3 A 86 GLY N N 15 107.672 0.3 A 87 LYS H H 1 7.664 0.020 A 87 LYS HA H 1 4.294 0.020 A 87 LYS HB2 H 1 1.555 0.020 A 87 LYS HB3 H 1 1.555 0.020 A 87 LYS HD2 H 1 1.629 0.020 A 87 LYS HD3 H 1 1.629 0.020 A 87 LYS HE2 H 1 2.889 0.020 A 87 LYS HE3 H 1 2.889 0.020 A 87 LYS HG2 H 1 1.325 0.020 A 87 LYS HG3 H 1 1.325 0.020 A 87 LYS C C 13 179.536 0.3 A 87 LYS CA C 13 55.863 0.3 A 87 LYS CB C 13 33.527 0.3 A 87 LYS CD C 13 30.070 0.3 A 87 LYS CE C 13 39.919 0.3 A 87 LYS CG C 13 24.453 0.3 A 87 LYS N N 15 119.544 0.3 A 88 GLU H H 1 8.632 0.020 A 88 GLU HA H 1 4.672 0.020 A 88 GLU HB2 H 1 1.686 0.020 A 88 GLU HB3 H 1 1.686 0.020 A 88 GLU HG2 H 1 2.008 0.020 A 88 GLU HG3 H 1 2.008 0.020 A 88 GLU C C 13 179.305 0.3 A 88 GLU CA C 13 56.019 0.3 A 88 GLU CB C 13 31.898 0.3 A 88 GLU N N 15 125.549 0.3 A 89 THR H H 1 9.372 0.020 A 89 THR HA H 1 4.437 0.020 A 89 THR HB H 1 4.159 0.020 A 89 THR HG2% H 1 1.234 0.020 A 89 THR C C 13 179.661 0.3 A 89 THR CA C 13 61.169 0.3 A 89 THR CB C 13 69.228 0.3 A 89 THR N N 15 121.868 0.3 A 90 LYS H H 1 8.681 0.020 A 90 LYS HA H 1 4.754 0.020 A 90 LYS HB2 H 1 1.801 0.020 A 90 LYS HB3 H 1 1.801 0.020 A 90 LYS HDy H 1 1.872 0.020 A 90 LYS HDx H 1 1.598 0.020 A 90 LYS HE2 H 1 2.889 0.020 A 90 LYS HE3 H 1 2.889 0.020 A 90 LYS HG2 H 1 1.325 0.020 A 90 LYS HG3 H 1 1.325 0.020 A 90 LYS CA C 13 55.459 0.3 A 90 LYS CB C 13 32.625 0.3 A 90 LYS CD C 13 28.531 0.3 A 90 LYS CE C 13 42.074 0.3 A 90 LYS CG C 13 24.672 0.3 A 90 LYS N N 15 125.963 0.3 A 91 SER H H 1 8.518 0.020 A 91 SER HA H 1 4.655 0.020 A 91 SER HB2 H 1 3.753 0.020 A 91 SER HB3 H 1 3.753 0.020 A 91 SER C C 13 181.567 0.3 A 91 SER CA C 13 57.117 0.3 A 91 SER CB C 13 64.210 0.3 A 91 SER N N 15 120.382 0.3 A 92 ASN H H 1 8.579 0.020 A 92 ASN HA H 1 5.361 0.020 A 92 ASN HB2 H 1 2.489 0.020 A 92 ASN HB3 H 1 2.489 0.020 A 92 ASN HD21 H 1 6.936 0.020 A 92 ASN HD22 H 1 7.406 0.020 A 92 ASN C C 13 182.065 0.3 A 92 ASN CA C 13 53.180 0.3 A 92 ASN CB C 13 42.611 0.3 A 92 ASN N N 15 122.689 0.3 A 93 TYR H H 1 9.583 0.020 A 93 TYR HA H 1 5.410 0.020 A 93 TYR HB2 H 1 3.080 0.020 A 93 TYR HB3 H 1 3.080 0.020 A 93 TYR C C 13 181.157 0.3 A 93 TYR CA C 13 57.222 0.3 A 93 TYR N N 15 122.028 0.3 A 94 ARG H H 1 8.892 0.020 A 94 ARG HA H 1 5.098 0.020 A 94 ARG HBy H 1 1.965 0.020 A 94 ARG HBx H 1 1.522 0.020 A 94 ARG HD2 H 1 3.101 0.020 A 94 ARG HD3 H 1 3.101 0.020 A 94 ARG HGx H 1 1.401 0.020 A 94 ARG HGy H 1 1.710 0.020 A 94 ARG C C 13 180.712 0.3 A 94 ARG CA C 13 55.114 0.3 A 94 ARG CB C 13 31.354 0.3 A 94 ARG CD C 13 43.338 0.3 A 94 ARG CG C 13 27.415 0.3 A 94 ARG N N 15 124.484 0.3 A 95 VAL H H 1 9.226 0.020 A 95 VAL HA H 1 4.639 0.020 A 95 VAL HB H 1 2.112 0.020 A 95 VAL HG1% H 1 0.458 0.020 A 95 VAL HG2% H 1 0.458 0.020 A 95 VAL C C 13 179.910 0.3 A 95 VAL CA C 13 62.493 0.3 A 95 VAL CB C 13 33.993 0.3 A 95 VAL CG1 C 13 20.980 0.3 A 95 VAL N N 15 128.773 0.3 A 96 ARG H H 1 8.792 0.020 A 96 ARG HA H 1 4.655 0.020 A 96 ARG HB2 H 1 1.686 0.020 A 96 ARG HB3 H 1 1.686 0.020 A 96 ARG HD2 H 1 2.964 0.020 A 96 ARG HD3 H 1 2.964 0.020 A 96 ARG HG2 H 1 1.431 0.020 A 96 ARG HG3 H 1 1.431 0.020 A 96 ARG C C 13 181.086 0.3 A 96 ARG CA C 13 54.279 0.3 A 96 ARG CB C 13 32.906 0.3 A 96 ARG CD C 13 42.117 0.3 A 96 ARG CG C 13 27.139 0.3 A 96 ARG N N 15 128.436 0.3 A 97 VAL H H 1 9.372 0.020 A 97 VAL HA H 1 4.754 0.020 A 97 VAL HB H 1 1.784 0.020 A 97 VAL HG1% H 1 0.839 0.020 A 97 VAL HG2% H 1 1.143 0.020 A 97 VAL C C 13 179.629 0.3 A 97 VAL CA C 13 60.846 0.3 A 97 VAL CB C 13 32.972 0.3 A 97 VAL CG1 C 13 20.871 0.3 A 97 VAL CG2 C 13 20.302 0.3 A 97 VAL N N 15 122.021 0.3 A 98 TYR H H 1 8.515 0.020 A 98 TYR HA H 1 4.458 0.020 A 98 TYR HB2 H 1 3.572 0.020 A 98 TYR HB3 H 1 3.572 0.020 A 98 TYR C C 13 181.555 0.3 A 98 TYR CA C 13 57.342 0.3 A 98 TYR N N 15 120.266 0.3 A 99 GLN H H 1 8.522 0.020 A 99 GLN HA H 1 4.261 0.020 A 99 GLN HBy H 1 2.063 0.020 A 99 GLN HBx H 1 1.768 0.020 A 99 GLN HE21 H 1 7.315 0.020 A 99 GLN HE22 H 1 6.845 0.020 A 99 GLN HG2 H 1 2.312 0.020 A 99 GLN HG3 H 1 2.312 0.020 A 99 GLN C C 13 180.138 0.3 A 99 GLN CA C 13 55.758 0.3 A 99 GLN CB C 13 29.647 0.3 A 99 GLN N N 15 122.414 0.3 A 100 ILE H H 1 8.169 0.020 A 100 ILE HA H 1 4.270 0.020 A 100 ILE HB H 1 1.720 0.020 A 100 ILE HD1% H 1 0.801 0.020 A 100 ILE HG1y H 1 1.386 0.020 A 100 ILE HG1x H 1 0.832 0.020 A 100 ILE C C 13 181.174 0.3 A 100 ILE CA C 13 59.259 0.3 A 100 ILE CB C 13 38.416 0.3 A 100 ILE CD1 C 13 13.040 0.3 A 100 ILE CG1 C 13 27.295 0.3 A 100 ILE CG2 C 13 17.534 0.3 A 100 ILE N N 15 122.711 0.3 A 101 PRO HA H 1 4.240 0.020 A 101 PRO HBy H 1 2.151 0.020 A 101 PRO HBx H 1 1.798 0.020 A 101 PRO C C 13 178.339 0.3 A 101 PRO CA C 13 63.620 0.3 A 101 PRO CB C 13 32.282 0.3 A 102 GLY H H 1 8.370 0.020 A 102 GLY HA2 H 1 3.786 0.020 A 102 GLY HA3 H 1 3.786 0.020 A 102 GLY C C 13 182.083 0.3 A 102 GLY CA C 13 45.033 0.3 A 102 GLY N N 15 109.441 0.3 A 103 LYS H H 1 7.948 0.020 A 103 LYS HA H 1 4.468 0.020 A 103 LYS HB2 H 1 1.598 0.020 A 103 LYS HB3 H 1 1.598 0.020 A 103 LYS C C 13 180.854 0.3 A 103 LYS CA C 13 54.326 0.3 A 103 LYS CB C 13 32.984 0.3 A 103 LYS N N 15 122.292 0.3 A 104 PRO HA H 1 4.294 0.020 A 104 PRO HBy H 1 2.129 0.020 A 104 PRO HBx H 1 1.833 0.020 A 104 PRO C C 13 179.595 0.3 A 104 PRO CA C 13 63.629 0.3 A 104 PRO CB C 13 31.898 0.3 A 105 GLU H H 1 7.937 0.020 A 105 GLU HA H 1 3.967 0.020 A 105 GLU HB2 H 1 1.762 0.020 A 105 GLU HB3 H 1 1.762 0.020 A 105 GLU HG2 H 1 2.190 0.020 A 105 GLU HG3 H 1 2.190 0.020 A 105 GLU C C 13 174.460 0.3 A 105 GLU CA C 13 58.319 0.3 A 105 GLU CB C 13 31.459 0.3 A 105 GLU N N 15 126.247 0.3 B 1 IOR H H 1 7.288 0.020 B 1 IOR H3 H 1 3.950 0.020 B 1 IOR H6% H 1 1.154 0.020 B 1 IOR HA H 1 3.619 0.020 B 1 IOR HB2 H 1 1.657 0.020 B 1 IOR HB3 H 1 1.657 0.020 B 1 IOR HD2 H 1 3.230 0.020 B 1 IOR HG2 H 1 1.506 0.020 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 6 ILE HG2% A 7 THR H 1.0 . 3.37 2 2 A 58 VAL H A 57 ARG HG2 1.0 . 4.56 3 2 A 57 ARG HG3 A 58 VAL H 1.0 . 4.56 4 3 A 89 THR H A 90 LYS H 1.0 . 4.77 5 4 A 74 GLU HA A 97 VAL H 1.0 . 4.37 6 5 A 89 THR H A 88 GLU HG2 1.0 . 3.41 7 5 A 89 THR H A 88 GLU HG3 1.0 . 3.41 8 6 A 38 THR HA A 40 ALA H 1.0 . 4.61 9 7 A 40 ALA H A 39 GLU HB2 1.0 . 4.19 10 7 A 40 ALA H A 39 GLU HB3 1.0 . 4.19 11 8 A 16 LEU HA A 17 LYS H 1.0 . 2.92 12 9 A 100 ILE H A 98 TYR HB2 1.0 . 6.86 13 9 A 98 TYR HB3 A 100 ILE H 1.0 . 6.86 14 10 A 17 LYS H A 16 LEU HB2 1.0 . 3.24 15 10 A 17 LYS H A 16 LEU HB3 1.0 . 3.24 16 11 A 100 ILE H A 100 ILE HG1y 1.0 . 3.33 17 12 A 100 ILE H A 100 ILE HG1x 1.0 . 3.33 18 13 A 100 ILE H A 10 ILE HD1% 1.0 . 6.21 19 14 A 37 ARG H A 37 ARG HG2 1.0 . 4.36 20 14 A 37 ARG H A 37 ARG HG3 1.0 . 4.36 21 15 A 37 ARG H A 38 THR HG2% 1.0 . 4.61 22 16 A 23 LYS H A 22 PRO HB2 1.0 . 4.05 23 16 A 22 PRO HB3 A 23 LYS H 1.0 . 4.05 24 17 A 23 LYS H A 23 LYS HD2 1.0 . 3.73 25 17 A 23 LYS H A 23 LYS HD3 1.0 . 3.73 26 18 A 96 ARG H A 97 VAL HA 1.0 . 4.81 27 19 A 96 ARG H A 96 ARG HB2 1.0 . 3.72 28 19 A 96 ARG H A 96 ARG HB3 1.0 . 3.72 29 20 A 96 ARG H A 95 VAL HG1% 1.0 . 3.59 30 20 A 96 ARG H A 95 VAL HG2% 1.0 . 3.59 31 21 A 10 ILE HA A 11 GLY H 1.0 . 3.27 32 22 A 11 GLY H A 12 GLU HB2 1.0 . 4.70 33 22 A 11 GLY H A 12 GLU HB3 1.0 . 4.70 34 23 A 11 GLY H A 10 ILE HB 1.0 . 4.70 35 24 A 11 GLY H A 10 ILE HG2% 1.0 . 3.39 36 25 A 33 LEU H A 32 LYS HB2 1.0 . 4.26 37 25 A 32 LYS HB3 A 33 LEU H 1.0 . 4.26 38 26 A 81 ALA H A 29 LEU HB2 1.0 . 5.04 39 26 A 29 LEU HB3 A 81 ALA H 1.0 . 5.04 40 27 A 3 ALA H A 3 ALA HB% 1.0 . 4.14 41 28 A 10 ILE HB A 10 ILE H 1.0 . 2.78 42 29 A 10 ILE H A 97 VAL HB 1.0 . 6.24 43 30 A 10 ILE H A 98 TYR H 1.0 . 3.51 44 31 A 102 GLY H A 103 LYS H 1.0 . 3.77 45 32 A 10 ILE HD1% A 99 GLN H 1.0 . 5.40 46 33 A 43 VAL H A 43 VAL HG1% 1.0 . 3.38 47 33 A 43 VAL H A 43 VAL HG2% 1.0 . 3.38 48 34 A 75 GLY H A 95 VAL HB 1.0 . 3.96 49 35 A 75 GLY H A 95 VAL HG1% 1.0 . 3.78 50 35 A 95 VAL HG2% A 75 GLY H 1.0 . 3.78 51 36 A 82 MET H A 82 MET HB2 1.0 . 3.81 52 36 A 82 MET H A 82 MET HB3 1.0 . 3.81 53 37 A 82 MET H A 81 ALA HB% 1.0 . 3.82 54 38 A 38 THR H A 39 GLU H 1.0 . 4.62 55 39 A 38 THR H A 38 THR HB 1.0 . 3.75 56 40 A 38 THR H A 36 GLY HA2 1.0 . 4.02 57 40 A 38 THR H A 36 GLY HA3 1.0 . 4.02 58 41 A 88 GLU H A 88 GLU HG2 1.0 . 4.05 59 41 A 88 GLU HG3 A 88 GLU H 1.0 . 4.05 60 42 A 90 LYS H A 90 LYS HB2 1.0 . 4.16 61 42 A 90 LYS H A 90 LYS HB3 1.0 . 4.16 62 43 A 90 LYS H A 90 LYS HG2 1.0 . 4.44 63 43 A 90 LYS H A 90 LYS HG3 1.0 . 4.44 64 44 A 90 LYS H A 89 THR HG2% 1.0 . 4.21 65 45 A 94 ARG H A 93 TYR HB2 1.0 . 3.84 66 45 A 93 TYR HB3 A 94 ARG H 1.0 . 3.84 67 46 A 7 THR HB A 8 ALA H 1.0 . 4.35 68 47 A 8 ALA H A 7 THR HG2% 1.0 . 3.84 69 48 A 10 ILE HD1% A 71 ILE H 1.0 . 4.37 70 49 A 55 VAL H A 54 SER HB2 1.0 . 3.84 71 49 A 54 SER HB3 A 55 VAL H 1.0 . 3.84 72 50 A 3 ALA HB% A 2 SER H 1.0 . 6.14 73 51 A 14 LEU H A 13 PRO HB2 1.0 . 4.28 74 51 A 13 PRO HB3 A 14 LEU H 1.0 . 4.28 75 52 A 5 ASN H A 4 GLN HB2 1.0 . 4.00 76 52 A 4 GLN HB3 A 5 ASN H 1.0 . 4.00 77 53 A 68 ALA H A 68 ALA HB% 1.0 . 4.01 78 54 A 73 ASP H A 72 GLN HB2 1.0 . 4.07 79 54 A 72 GLN HB3 A 73 ASP H 1.0 . 4.07 80 55 A 73 ASP H A 97 VAL HG2% 1.0 . 5.45 81 56 A 79 CYS H A 78 ARG HB2 1.0 . 3.92 82 56 A 78 ARG HB3 A 79 CYS H 1.0 . 3.92 83 57 A 54 SER H A 54 SER HB2 1.0 . 4.20 84 57 A 54 SER HB3 A 54 SER H 1.0 . 4.20 85 58 A 62 GLY H A 63 SER HB2 1.0 . 4.55 86 58 A 62 GLY H A 63 SER HB3 1.0 . 4.55 87 59 A 59 LEU H A 59 LEU HG 1.0 . 4.33 88 60 A 3 ALA H A 2 SER H 1.0 . 4.20 89 61 A 2 SER H A 19 LYS HE2 1.0 . 5.16 90 61 A 2 SER H A 19 LYS HE3 1.0 . 5.16 91 62 A 53 ASP H A 53 ASP HBy 1.0 . 3.83 92 63 A 53 ASP H A 53 ASP HBx 1.0 . 3.83 93 64 A 10 ILE HB A 98 TYR H 1.0 . 4.84 94 65 A 38 THR HG2% A 39 GLU H 1.0 . 5.04 95 66 A 41 TRP H A 42 LYS HD2 1.0 . 4.76 96 66 A 41 TRP H A 42 LYS HD3 1.0 . 4.76 97 67 A 94 ARG H A 93 TYR H 1.0 . 4.62 98 68 A 93 TYR H A 92 ASN HB2 1.0 . 4.18 99 68 A 93 TYR H A 92 ASN HB3 1.0 . 4.18 100 69 A 47 GLN H A 49 GLY H 1.0 . 5.50 101 70 A 29 LEU H A 29 LEU HB2 1.0 . 3.65 102 70 A 29 LEU HB3 A 29 LEU H 1.0 . 3.65 103 71 A 72 GLN H A 74 GLU H 1.0 . 4.38 104 72 A 72 GLN H A 72 GLN HB2 1.0 . 3.65 105 72 A 72 GLN HB3 A 72 GLN H 1.0 . 3.65 106 73 A 72 GLN H A 71 ILE HB 1.0 . 3.65 107 74 A 10 ILE HD1% A 72 GLN H 1.0 . 5.33 108 75 A 72 GLN H A 71 ILE HD1% 1.0 . 5.50 109 76 A 20 GLY H A 19 LYS HB2 1.0 . 4.11 110 76 A 19 LYS HB3 A 20 GLY H 1.0 . 4.11 111 77 A 95 VAL H A 95 VAL HG1% 1.0 . 4.04 112 77 A 95 VAL HG2% A 95 VAL H 1.0 . 4.04 113 78 A 97 VAL HB A 9 ARG H 1.0 . 5.39 114 79 A 42 LYS H A 42 LYS HG2 1.0 . 4.06 115 79 A 42 LYS H A 42 LYS HG3 1.0 . 4.06 116 80 A 15 VAL H A 15 VAL HG2% 1.0 . 4.01 117 81 A 15 VAL H A 16 LEU H 1.0 . 4.44 118 82 A 57 ARG H A 55 VAL HG1% 1.0 . 5.50 119 82 A 55 VAL HG2% A 57 ARG H 1.0 . 5.50 120 83 A 52 TRP H A 51 PRO HBy 1.0 . 4.28 121 84 A 52 TRP H A 51 PRO HBx 1.0 . 4.28 122 85 A 45 SER H A 44 LEU HB2 1.0 . 3.68 123 85 A 44 LEU HB3 A 45 SER H 1.0 . 3.68 124 86 A 12 GLU H A 12 GLU HG2 1.0 . 3.25 125 86 A 12 GLU H A 12 GLU HG3 1.0 . 3.25 126 87 A 12 GLU H A 12 GLU HB2 1.0 . 3.15 127 87 A 12 GLU HB3 A 12 GLU H 1.0 . 3.15 128 88 A 61 ASN H A 59 LEU HB2 1.0 . 3.92 129 88 A 59 LEU HB3 A 61 ASN H 1.0 . 3.92 130 89 A 68 ALA H A 69 VAL H 1.0 . 4.21 131 90 A 69 VAL H A 69 VAL HG2% 1.0 . 4.23 132 91 A 74 GLU H A 36 GLY H 1.0 . 4.34 133 92 A 34 ASN H A 33 LEU HB2 1.0 . 4.41 134 92 A 33 LEU HB3 A 34 ASN H 1.0 . 4.41 135 93 A 4 GLN H A 4 GLN HB2 1.0 . 3.88 136 93 A 4 GLN HB3 A 4 GLN H 1.0 . 3.88 137 94 A 64 LEU HA A 65 PHE H 1.0 . 3.18 138 95 A 6 ILE H A 5 ASN HB2 1.0 . 4.18 139 95 A 5 ASN HB3 A 6 ILE H 1.0 . 4.18 140 96 A 65 PHE H A 64 LEU HG 1.0 . 3.59 141 97 A 19 LYS H A 91 SER HB3 1.0 . 4.18 142 97 A 19 LYS H A 91 SER HB2 1.0 . 4.18 143 98 A 104 PRO HA A 105 GLU H 1.0 . 3.13 144 99 A 105 GLU H A 105 GLU HB2 1.0 . 3.58 145 99 A 105 GLU H A 105 GLU HB3 1.0 . 3.58 146 100 A 7 THR H A 6 ILE HA 1.0 . 3.22 147 101 A 36 GLY H A 36 GLY HA2 1.0 . 2.81 148 101 A 36 GLY HA3 A 36 GLY H 1.0 . 2.81 149 102 A 48 GLY H A 47 GLN HG2 1.0 . 4.27 150 102 A 47 GLN HG3 A 48 GLY H 1.0 . 4.27 151 103 A 81 ALA HB% A 21 ALA H 1.0 . 3.72 152 104 A 43 VAL H A 43 VAL HB 1.0 . 3.40 153 105 A 59 LEU H A 59 LEU HD1% 1.0 . 4.54 154 106 A 30 GLU H A 30 GLU HB2 1.0 . 4.10 155 106 A 30 GLU H A 30 GLU HB3 1.0 . 4.10 156 107 A 29 LEU HA A 30 GLU HB2 1.0 . 4.25 157 107 A 30 GLU HB3 A 29 LEU HA 1.0 . 4.25 158 108 A 13 PRO HA A 14 LEU HBx 1.0 . 5.50 159 109 A 98 TYR HA A 10 ILE HG12 1.0 . 5.50 160 109 A 10 ILE HG13 A 98 TYR HA 1.0 . 5.50 161 110 A 71 ILE HB A 10 ILE HG12 1.0 . 3.89 162 110 A 71 ILE HB A 10 ILE HG13 1.0 . 3.89 163 111 A 10 ILE H A 10 ILE HG12 1.0 . 4.16 164 111 A 10 ILE H A 10 ILE HG13 1.0 . 4.16 165 112 A 87 LYS HA A 88 GLU HB2 1.0 . 5.42 166 112 A 87 LYS HA A 88 GLU HB3 1.0 . 5.42 167 113 A 104 PRO HA A 105 GLU HB2 1.0 . 5.50 168 113 A 104 PRO HA A 105 GLU HB3 1.0 . 5.50 169 114 A 32 LYS HA A 78 ARG HB2 1.0 . 5.10 170 114 A 78 ARG HB3 A 32 LYS HA 1.0 . 5.10 171 115 A 57 ARG HA A 58 VAL HB 1.0 . 5.50 172 116 A 58 VAL H A 58 VAL HB 1.0 . 3.96 173 117 A 71 ILE HB A 72 GLN HG2 1.0 . 5.33 174 117 A 71 ILE HB A 72 GLN HG3 1.0 . 5.33 175 118 A 72 GLN H A 72 GLN HG2 1.0 . 3.76 176 118 A 72 GLN H A 72 GLN HG3 1.0 . 3.76 177 119 A 72 GLN HB2 A 72 GLN HG2 1.0 . 2.40 178 119 A 72 GLN HB3 A 72 GLN HG2 1.0 . 2.40 179 119 A 72 GLN HG3 A 72 GLN HB2 1.0 . 2.40 180 119 A 72 GLN HB3 A 72 GLN HG3 1.0 . 2.40 181 120 A 71 ILE HA A 72 GLN HG2 1.0 . 5.50 182 120 A 72 GLN HG3 A 71 ILE HA 1.0 . 5.50 183 121 A 74 GLU HA A 96 ARG HA 1.0 . 3.98 184 122 A 74 GLU HA A 74 GLU HG2 1.0 . 3.36 185 122 A 74 GLU HA A 74 GLU HG3 1.0 . 3.36 186 123 A 83 ASN HB3 A 86 GLY HA2 1.0 . 5.12 187 123 A 83 ASN HB2 A 86 GLY HA2 1.0 . 5.12 188 123 A 86 GLY HA3 A 83 ASN HB2 1.0 . 5.12 189 123 A 83 ASN HB3 A 86 GLY HA3 1.0 . 5.12 190 124 A 86 GLY HA2 A 87 LYS HE2 1.0 . 5.50 191 124 A 86 GLY HA3 A 87 LYS HE2 1.0 . 5.50 192 124 A 87 LYS HE3 A 86 GLY HA2 1.0 . 5.50 193 124 A 86 GLY HA3 A 87 LYS HE3 1.0 . 5.50 194 125 A 85 ASN HA A 86 GLY HA2 1.0 . 4.44 195 125 A 86 GLY HA3 A 85 ASN HA 1.0 . 4.44 196 126 A 33 LEU HA A 34 ASN HB2 1.0 . 4.33 197 126 A 33 LEU HA A 34 ASN HB3 1.0 . 4.33 198 127 A 47 GLN H A 47 GLN HG2 1.0 . 4.47 199 127 A 47 GLN H A 47 GLN HG3 1.0 . 4.47 200 128 A 47 GLN HB3 A 47 GLN HG2 1.0 . 2.84 201 128 A 47 GLN HB2 A 47 GLN HG2 1.0 . 2.84 202 128 A 47 GLN HG3 A 47 GLN HB2 1.0 . 2.84 203 128 A 47 GLN HG3 A 47 GLN HB3 1.0 . 2.84 204 129 A 63 SER HB3 A 59 LEU HD1% 1.0 . 5.42 205 129 A 59 LEU HD1% A 63 SER HB2 1.0 . 5.42 206 130 A 63 SER HB3 A 59 LEU HD2% 1.0 . 5.42 207 130 A 59 LEU HD2% A 63 SER HB2 1.0 . 5.42 208 131 A 64 LEU HA A 64 LEU HD2% 1.0 . 5.25 209 132 A 64 LEU HB3 A 64 LEU HD2% 1.0 . 3.92 210 132 A 64 LEU HD2% A 64 LEU HB2 1.0 . 3.92 211 133 A 59 LEU HA A 59 LEU HD2% 1.0 . 5.50 212 134 A 23 LYS HA A 24 LYS HD2 1.0 . 5.50 213 134 A 23 LYS HA A 24 LYS HD3 1.0 . 5.50 214 135 A 95 VAL HB A 96 ARG HB2 1.0 . 5.50 215 135 A 96 ARG HB3 A 95 VAL HB 1.0 . 5.50 216 136 A 13 PRO HA A 14 LEU HBy 1.0 . 5.50 217 137 A 63 SER H A 63 SER HB2 1.0 . 3.24 218 137 A 63 SER HB3 A 63 SER H 1.0 . 3.24 219 138 A 92 ASN HA A 92 ASN HD21 1.0 . 3.94 220 139 A 92 ASN HA A 92 ASN HD22 1.0 . 3.94 221 140 A 94 ARG HA A 94 ARG HGy 1.0 . 4.13 222 141 A 94 ARG HA A 94 ARG HGx 1.0 . 4.13 223 142 A 94 ARG HA A 94 ARG HD2 1.0 . 4.20 224 142 A 94 ARG HA A 94 ARG HD3 1.0 . 4.20 225 143 A 33 LEU HA A 77 PHE HB2 1.0 . 4.84 226 143 A 33 LEU HA A 77 PHE HB3 1.0 . 4.84 227 144 A 76 ILE HA A 77 PHE HB2 1.0 . 5.19 228 144 A 77 PHE HB3 A 76 ILE HA 1.0 . 5.19 229 145 A 52 TRP HA A 57 ARG HG2 1.0 . 3.24 230 145 A 57 ARG HG3 A 52 TRP HA 1.0 . 3.24 231 146 A 52 TRP HA A 57 ARG HD2 1.0 . 4.71 232 146 A 52 TRP HA A 57 ARG HD3 1.0 . 4.71 233 147 A 61 ASN HA A 59 LEU HB2 1.0 . 5.27 234 147 A 59 LEU HB3 A 61 ASN HA 1.0 . 5.27 235 148 A 71 ILE HB A 98 TYR HA 1.0 . 7.50 236 149 A 33 LEU HA A 33 LEU HD1% 1.0 . 4.12 237 150 A 33 LEU HA A 33 LEU HD2% 1.0 . 4.12 238 151 A 59 LEU HG A 59 LEU HB2 1.0 . 2.76 239 151 A 59 LEU HG A 59 LEU HB3 1.0 . 2.76 240 152 A 19 LYS H A 19 LYS HG2 1.0 . 3.94 241 152 A 19 LYS H A 19 LYS HG3 1.0 . 3.94 242 153 A 18 CYS HA A 17 LYS HG2 1.0 . 5.31 243 153 A 17 LYS HG3 A 18 CYS HA 1.0 . 5.31 244 154 A 18 CYS HA A 19 LYS HG2 1.0 . 5.49 245 154 A 19 LYS HG3 A 18 CYS HA 1.0 . 5.49 246 155 A 76 ILE H A 76 ILE HG12 1.0 . 3.88 247 155 A 76 ILE H A 76 ILE HG13 1.0 . 3.88 248 156 A 76 ILE HG2% A 76 ILE HG12 1.0 . 3.38 249 156 A 76 ILE HG13 A 76 ILE HG2% 1.0 . 3.38 250 157 A 18 CYS HA A 19 LYS HD2 1.0 . 4.19 251 157 A 18 CYS HA A 19 LYS HD3 1.0 . 4.19 252 158 A 40 ALA HA A 39 GLU HB2 1.0 . 4.75 253 158 A 39 GLU HB3 A 40 ALA HA 1.0 . 4.75 254 159 A 78 ARG H A 78 ARG HB2 1.0 . 3.70 255 159 A 78 ARG HB3 A 78 ARG H 1.0 . 3.70 256 160 A 4 GLN HA A 5 ASN HB2 1.0 . 4.62 257 160 A 5 ASN HB3 A 4 GLN HA 1.0 . 4.62 258 161 A 6 ILE HA A 5 ASN HB2 1.0 . 5.06 259 161 A 5 ASN HB3 A 6 ILE HA 1.0 . 5.06 260 162 A 5 ASN H A 5 ASN HB2 1.0 . 3.70 261 162 A 5 ASN H A 5 ASN HB3 1.0 . 3.70 262 163 A 100 ILE HA A 100 ILE HG1y 1.0 . 3.75 263 164 A 100 ILE HA A 100 ILE HG1x 1.0 . 3.75 264 165 A 10 ILE HD1% A 98 TYR HB2 1.0 . 3.99 265 165 A 98 TYR HB3 A 10 ILE HD1% 1.0 . 3.99 266 166 A 71 ILE HD1% A 98 TYR HB2 1.0 . 5.46 267 166 A 98 TYR HB3 A 71 ILE HD1% 1.0 . 5.46 268 167 A 61 ASN HA A 24 LYS HB2 1.0 . 4.21 269 167 A 61 ASN HA A 24 LYS HB3 1.0 . 4.21 270 168 A 83 ASN HA A 83 ASN HB2 1.0 . 2.55 271 168 A 83 ASN HB3 A 83 ASN HA 1.0 . 2.55 272 169 A 23 LYS HA A 22 PRO HA 1.0 . 5.07 273 170 A 23 LYS HA A 24 LYS HA 1.0 . 5.50 274 171 A 38 THR HA A 39 GLU HA 1.0 . 5.50 275 172 A 23 LYS HA A 23 LYS HG2 1.0 . 4.05 276 172 A 23 LYS HA A 23 LYS HG3 1.0 . 4.05 277 173 A 37 ARG HA A 37 ARG HG2 1.0 . 3.37 278 173 A 37 ARG HG3 A 37 ARG HA 1.0 . 3.37 279 174 A 10 ILE HA A 9 ARG HA 1.0 . 5.03 280 175 A 10 ILE HA A 10 ILE HG2% 1.0 . 3.73 281 176 A 17 LYS HG3 A 63 SER HB2 1.0 . 4.77 282 176 A 17 LYS HG2 A 63 SER HB2 1.0 . 4.77 283 176 A 63 SER HB3 A 17 LYS HG2 1.0 . 4.77 284 176 A 63 SER HB3 A 17 LYS HG3 1.0 . 4.77 285 177 A 59 LEU HG A 63 SER HB2 1.0 . 5.06 286 177 A 63 SER HB3 A 59 LEU HG 1.0 . 5.06 287 178 A 24 LYS HA A 24 LYS HD2 1.0 . 4.30 288 178 A 24 LYS HD3 A 24 LYS HA 1.0 . 4.30 289 179 A 7 THR H A 7 THR HB 1.0 . 3.80 290 180 A 7 THR HB A 8 ALA HA 1.0 . 4.37 291 181 A 64 LEU HA A 65 PHE HA 1.0 . 4.59 292 182 A 76 ILE H A 76 ILE HD1% 1.0 . 4.13 293 183 A 89 THR HG2% A 89 THR HA 1.0 . 2.74 294 184 A 55 VAL HA A 55 VAL HG1% 1.0 . 3.45 295 184 A 55 VAL HG2% A 55 VAL HA 1.0 . 3.45 296 185 A 55 VAL HA A 54 SER HB2 1.0 . 4.07 297 185 A 54 SER HB3 A 55 VAL HA 1.0 . 4.07 298 186 A 3 ALA HB% A 4 GLN HB2 1.0 . 5.05 299 186 A 3 ALA HB% A 4 GLN HB3 1.0 . 5.05 300 187 A 39 GLU HA A 39 GLU HG2 1.0 . 3.53 301 187 A 39 GLU HA A 39 GLU HG3 1.0 . 3.53 302 188 A 39 GLU H A 39 GLU HG2 1.0 . 4.46 303 188 A 39 GLU H A 39 GLU HG3 1.0 . 4.46 304 189 A 38 THR HA A 39 GLU HG2 1.0 . 4.68 305 189 A 38 THR HA A 39 GLU HG3 1.0 . 4.68 306 190 A 39 GLU HB3 A 39 GLU HG2 1.0 . 2.40 307 190 A 39 GLU HB2 A 39 GLU HG2 1.0 . 2.40 308 190 A 39 GLU HG3 A 39 GLU HB2 1.0 . 2.40 309 190 A 39 GLU HB3 A 39 GLU HG3 1.0 . 2.40 310 191 A 57 ARG HA A 58 VAL HG1% 1.0 . 4.03 311 191 A 57 ARG HA A 58 VAL HG2% 1.0 . 4.03 312 192 A 58 VAL H A 58 VAL HG1% 1.0 . 3.53 313 192 A 58 VAL H A 58 VAL HG2% 1.0 . 3.53 314 193 A 19 LYS H A 19 LYS HD2 1.0 . 4.71 315 193 A 19 LYS H A 19 LYS HD3 1.0 . 4.71 316 194 A 29 LEU H A 29 LEU HG 1.0 . 4.10 317 195 A 29 LEU HG A 28 ARG HA 1.0 . 5.50 318 196 A 10 ILE HA A 11 GLY HAx 1.0 . 4.45 319 197 A 32 LYS HA A 32 LYS HB2 1.0 . 2.62 320 197 A 32 LYS HB3 A 32 LYS HA 1.0 . 2.62 321 198 A 9 ARG HA A 9 ARG HD2 1.0 . 3.61 322 198 A 9 ARG HA A 9 ARG HD3 1.0 . 3.61 323 199 A 71 ILE H A 71 ILE HG1y 1.0 . 4.96 324 200 A 95 VAL HA A 96 ARG HG2 1.0 . 5.41 325 200 A 95 VAL HA A 96 ARG HG3 1.0 . 5.41 326 201 A 98 TYR HA A 71 ILE HG1y 1.0 . 6.50 327 202 A 69 VAL HA A 69 VAL HG1% 1.0 . 3.69 328 203 A 82 MET HA A 82 MET HB2 1.0 . 2.55 329 203 A 82 MET HB3 A 82 MET HA 1.0 . 2.55 330 204 A 82 MET HA A 82 MET HG2 1.0 . 2.71 331 204 A 82 MET HA A 82 MET HG3 1.0 . 2.71 332 205 A 57 ARG HA A 57 ARG HD2 1.0 . 3.96 333 205 A 57 ARG HA A 57 ARG HD3 1.0 . 3.96 334 206 A 35 THR HA A 35 THR HB 1.0 . 2.97 335 207 A 64 LEU HA A 63 SER HB2 1.0 . 5.50 336 207 A 63 SER HB3 A 64 LEU HA 1.0 . 5.50 337 208 A 64 LEU HA A 64 LEU HG 1.0 . 3.81 338 209 A 64 LEU HA A 64 LEU HD1% 1.0 . 5.25 339 210 A 64 LEU HA A 65 PHE HBx 1.0 . 5.50 340 211 A 38 THR HB A 39 GLU HB2 1.0 . 5.50 341 211 A 39 GLU HB3 A 38 THR HB 1.0 . 5.50 342 212 A 47 GLN HA A 47 GLN HG2 1.0 . 3.38 343 212 A 47 GLN HG3 A 47 GLN HA 1.0 . 3.38 344 213 A 47 GLN HA A 47 GLN HE22 1.0 . 3.70 345 214 A 47 GLN H A 47 GLN HA 1.0 . 2.94 346 215 A 47 GLN HA A 47 GLN HE21 1.0 . 3.70 347 216 A 87 LYS HA A 87 LYS HG2 1.0 . 4.03 348 216 A 87 LYS HA A 87 LYS HG3 1.0 . 4.03 349 217 A 87 LYS HA A 87 LYS HE2 1.0 . 3.71 350 217 A 87 LYS HA A 87 LYS HE3 1.0 . 3.71 351 218 A 44 LEU HA A 44 LEU HG 1.0 . 3.83 352 219 A 2 SER H A 19 LYS HG2 1.0 . 5.24 353 219 A 2 SER H A 19 LYS HG3 1.0 . 5.24 354 220 A 87 LYS H A 87 LYS HG2 1.0 . 5.50 355 220 A 87 LYS HG3 A 87 LYS H 1.0 . 5.50 356 221 A 15 VAL HA A 15 VAL HG2% 1.0 . 2.55 357 222 A 87 LYS HB2 A 87 LYS HE2 1.0 . 4.21 358 222 A 87 LYS HE3 A 87 LYS HB2 1.0 . 4.21 359 222 A 87 LYS HE3 A 87 LYS HB3 1.0 . 4.21 360 222 A 87 LYS HB3 A 87 LYS HE2 1.0 . 4.21 361 223 A 38 THR HB A 40 ALA HB% 1.0 . 6.21 362 224 A 56 ALA HA A 57 ARG HD2 1.0 . 3.91 363 224 A 57 ARG HD3 A 56 ALA HA 1.0 . 3.91 364 225 A 56 ALA HB% A 57 ARG HD2 1.0 . 5.16 365 225 A 57 ARG HD3 A 56 ALA HB% 1.0 . 5.16 366 226 A 57 ARG H A 57 ARG HD2 1.0 . 4.22 367 226 A 57 ARG H A 57 ARG HD3 1.0 . 4.22 368 227 A 94 ARG H A 94 ARG HD2 1.0 . 4.47 369 227 A 94 ARG H A 94 ARG HD3 1.0 . 4.47 370 228 A 22 PRO HA A 23 LYS HG2 1.0 . 5.50 371 228 A 22 PRO HA A 23 LYS HG3 1.0 . 5.50 372 229 A 64 LEU HG A 58 VAL HA 1.0 . 5.50 373 230 A 23 LYS H A 23 LYS HG2 1.0 . 4.06 374 230 A 23 LYS H A 23 LYS HG3 1.0 . 4.06 375 231 A 15 VAL HA A 15 VAL HG1% 1.0 . 2.55 376 232 A 97 VAL HA A 97 VAL HB 1.0 . 3.00 377 233 A 42 LYS HB3 A 42 LYS HE2 1.0 . 4.81 378 233 A 42 LYS HB2 A 42 LYS HE2 1.0 . 4.81 379 233 A 42 LYS HE3 A 42 LYS HB2 1.0 . 4.81 380 233 A 42 LYS HB3 A 42 LYS HE3 1.0 . 4.81 381 234 A 16 LEU HA A 16 LEU HD1% 1.0 . 3.98 382 235 A 16 LEU HA A 15 VAL HA 1.0 . 5.00 383 236 A 16 LEU HA A 17 LYS HA 1.0 . 5.36 384 237 A 16 LEU HA A 16 LEU HD2% 1.0 . 3.98 385 238 A 16 LEU HA A 17 LYS HB2 1.0 . 4.04 386 238 A 16 LEU HA A 17 LYS HB3 1.0 . 4.04 387 239 A 96 ARG H A 96 ARG HG2 1.0 . 4.87 388 239 A 96 ARG H A 96 ARG HG3 1.0 . 4.87 389 240 A 79 CYS HA A 79 CYS HB2 1.0 . 2.94 390 240 A 79 CYS HA A 79 CYS HB3 1.0 . 2.94 391 241 A 63 SER HA A 63 SER HB2 1.0 . 2.55 392 241 A 63 SER HB3 A 63 SER HA 1.0 . 2.55 393 242 A 81 ALA H A 80 GLN HA 1.0 . 3.19 394 243 A 81 ALA HA A 82 MET HB2 1.0 . 4.41 395 243 A 82 MET HB3 A 81 ALA HA 1.0 . 4.41 396 244 A 57 ARG HB2 A 58 VAL HG1% 1.0 . 4.82 397 244 A 58 VAL HG2% A 57 ARG HB2 1.0 . 4.82 398 244 A 58 VAL HG2% A 57 ARG HB3 1.0 . 4.82 399 244 A 57 ARG HB3 A 58 VAL HG1% 1.0 . 4.82 400 245 A 81 ALA HB% A 82 MET HB2 1.0 . 5.50 401 245 A 82 MET HB3 A 81 ALA HB% 1.0 . 5.50 402 246 A 42 LYS HB2 A 43 VAL HG1% 1.0 . 5.09 403 246 A 42 LYS HB3 A 43 VAL HG1% 1.0 . 5.09 404 246 A 43 VAL HG2% A 42 LYS HB2 1.0 . 5.09 405 246 A 43 VAL HG2% A 42 LYS HB3 1.0 . 5.09 406 247 A 43 VAL HG1% A 44 LEU HB2 1.0 . 5.37 407 247 A 43 VAL HG2% A 44 LEU HB2 1.0 . 5.37 408 247 A 44 LEU HB3 A 43 VAL HG1% 1.0 . 5.37 409 247 A 43 VAL HG2% A 44 LEU HB3 1.0 . 5.37 410 248 A 59 LEU H A 59 LEU HD2% 1.0 . 4.54 411 249 A 23 LYS HB3 A 23 LYS HE2 1.0 . 5.50 412 249 A 23 LYS HB2 A 23 LYS HE2 1.0 . 5.50 413 249 A 23 LYS HE3 A 23 LYS HB2 1.0 . 5.50 414 249 A 23 LYS HB3 A 23 LYS HE3 1.0 . 5.50 415 250 A 23 LYS H A 23 LYS HB2 1.0 . 3.55 416 250 A 23 LYS H A 23 LYS HB3 1.0 . 3.55 417 251 A 23 LYS HB3 A 23 LYS HD2 1.0 . 2.40 418 251 A 23 LYS HB2 A 23 LYS HD2 1.0 . 2.40 419 251 A 23 LYS HD3 A 23 LYS HB2 1.0 . 2.40 420 251 A 23 LYS HD3 A 23 LYS HB3 1.0 . 2.40 421 252 A 17 LYS HA A 18 CYS HBx 1.0 . 5.50 422 253 A 10 ILE HG2% A 71 ILE HB 1.0 . 5.48 423 254 A 10 ILE HG2% A 10 ILE H 1.0 . 4.89 424 255 A 4 GLN HB3 A 5 ASN HB2 1.0 . 5.23 425 255 A 4 GLN HB2 A 5 ASN HB2 1.0 . 5.23 426 255 A 5 ASN HB3 A 4 GLN HB2 1.0 . 5.23 427 255 A 4 GLN HB3 A 5 ASN HB3 1.0 . 5.23 428 256 A 55 VAL HB A 54 SER HB2 1.0 . 4.87 429 256 A 54 SER HB3 A 55 VAL HB 1.0 . 4.87 430 257 A 55 VAL H A 55 VAL HB 1.0 . 4.11 431 258 A 14 LEU HA A 14 LEU HG 1.0 . 3.23 432 259 A 87 LYS H A 87 LYS HD2 1.0 . 5.04 433 259 A 87 LYS H A 87 LYS HD3 1.0 . 5.04 434 260 A 87 LYS HA A 87 LYS HD2 1.0 . 5.50 435 260 A 87 LYS HA A 87 LYS HD3 1.0 . 5.50 436 261 A 19 LYS HA A 19 LYS HE2 1.0 . 3.14 437 261 A 19 LYS HE3 A 19 LYS HA 1.0 . 3.14 438 262 A 3 ALA HA A 4 GLN HB2 1.0 . 5.50 439 262 A 4 GLN HB3 A 3 ALA HA 1.0 . 5.50 440 263 A 37 ARG H A 37 ARG HD2 1.0 . 4.05 441 263 A 37 ARG H A 37 ARG HD3 1.0 . 4.05 442 264 A 36 GLY HA2 A 37 ARG HD2 1.0 . 4.39 443 264 A 36 GLY HA3 A 37 ARG HD2 1.0 . 4.39 444 264 A 37 ARG HD3 A 36 GLY HA2 1.0 . 4.39 445 264 A 36 GLY HA3 A 37 ARG HD3 1.0 . 4.39 446 265 A 69 VAL HB A 97 VAL HG1% 1.0 . 5.50 447 266 A 54 SER HB2 A 55 VAL HG1% 1.0 . 5.50 448 266 A 55 VAL HG2% A 54 SER HB2 1.0 . 5.50 449 266 A 54 SER HB3 A 55 VAL HG2% 1.0 . 5.50 450 266 A 54 SER HB3 A 55 VAL HG1% 1.0 . 5.50 451 267 A 54 SER HA A 55 VAL HG1% 1.0 . 4.42 452 267 A 55 VAL HG2% A 54 SER HA 1.0 . 4.42 453 268 A 55 VAL H A 55 VAL HG1% 1.0 . 5.50 454 268 A 55 VAL H A 55 VAL HG2% 1.0 . 5.50 455 269 A 73 ASP H A 97 VAL HG1% 1.0 . 5.45 456 270 A 66 LEU HA A 66 LEU HD1% 1.0 . 3.95 457 271 A 66 LEU HA A 66 LEU HD2% 1.0 . 3.95 458 272 A 65 PHE HA A 66 LEU HA 1.0 . 4.66 459 273 A 66 LEU HA A 66 LEU HG 1.0 . 3.66 460 274 A 33 LEU H A 33 LEU HD1% 1.0 . 5.13 461 275 A 24 LYS HB2 A 61 ASN HBx 1.0 . 5.50 462 275 A 24 LYS HB3 A 61 ASN HBx 1.0 . 5.50 463 276 A 61 ASN H A 61 ASN HBx 1.0 . 4.16 464 277 A 9 ARG HA A 8 ALA HB% 1.0 . 4.61 465 278 A 15 VAL H A 15 VAL HG1% 1.0 . 4.01 466 279 A 44 LEU HA A 44 LEU HD2% 1.0 . 4.29 467 280 A 17 LYS HA A 18 CYS HBy 1.0 . 5.50 468 281 A 6 ILE HB A 5 ASN HB2 1.0 . 5.50 469 281 A 5 ASN HB3 A 6 ILE HB 1.0 . 5.50 470 282 A 6 ILE HB A 5 ASN HA 1.0 . 5.50 471 283 A 88 GLU HA A 88 GLU HB2 1.0 . 2.40 472 283 A 88 GLU HB3 A 88 GLU HA 1.0 . 2.40 473 284 A 88 GLU HA A 88 GLU HG2 1.0 . 3.36 474 284 A 88 GLU HG3 A 88 GLU HA 1.0 . 3.36 475 285 A 19 LYS HA A 19 LYS HD2 1.0 . 2.70 476 285 A 19 LYS HD3 A 19 LYS HA 1.0 . 2.70 477 286 A 19 LYS HA A 19 LYS HB2 1.0 . 2.74 478 286 A 19 LYS HB3 A 19 LYS HA 1.0 . 2.74 479 287 A 94 ARG HA A 95 VAL HG1% 1.0 . 3.92 480 287 A 95 VAL HG2% A 94 ARG HA 1.0 . 3.92 481 288 A 16 LEU HB2 A 95 VAL HG1% 1.0 . 5.34 482 288 A 16 LEU HB3 A 95 VAL HG1% 1.0 . 5.34 483 288 A 95 VAL HG2% A 16 LEU HB2 1.0 . 5.34 484 288 A 16 LEU HB3 A 95 VAL HG2% 1.0 . 5.34 485 289 A 95 VAL HG1% A 96 ARG HG2 1.0 . 5.50 486 289 A 96 ARG HG3 A 95 VAL HG1% 1.0 . 5.50 487 289 A 95 VAL HG2% A 96 ARG HG3 1.0 . 5.50 488 289 A 95 VAL HG2% A 96 ARG HG2 1.0 . 5.50 489 290 A 65 PHE HA A 66 LEU HD2% 1.0 . 5.50 490 291 A 78 ARG HA A 78 ARG HD2 1.0 . 4.05 491 291 A 78 ARG HA A 78 ARG HD3 1.0 . 4.05 492 292 A 78 ARG H A 78 ARG HD2 1.0 . 5.11 493 292 A 78 ARG H A 78 ARG HD3 1.0 . 5.11 494 293 A 38 THR HA A 38 THR HG2% 1.0 . 3.42 495 294 A 19 LYS HB3 A 91 SER HB3 1.0 . 4.31 496 294 A 19 LYS HB2 A 91 SER HB3 1.0 . 4.31 497 294 A 91 SER HB2 A 19 LYS HB2 1.0 . 4.31 498 294 A 19 LYS HB3 A 91 SER HB2 1.0 . 4.31 499 295 A 37 ARG HB2 A 37 ARG HD2 1.0 . 3.93 500 295 A 37 ARG HB3 A 37 ARG HD2 1.0 . 3.93 501 295 A 37 ARG HD3 A 37 ARG HB2 1.0 . 3.93 502 295 A 37 ARG HD3 A 37 ARG HB3 1.0 . 3.93 503 296 A 36 GLY HA2 A 37 ARG HB2 1.0 . 4.24 504 296 A 37 ARG HB3 A 36 GLY HA2 1.0 . 4.24 505 296 A 36 GLY HA3 A 37 ARG HB3 1.0 . 4.24 506 296 A 36 GLY HA3 A 37 ARG HB2 1.0 . 4.24 507 297 A 78 ARG HA A 78 ARG HB2 1.0 . 2.79 508 297 A 78 ARG HB3 A 78 ARG HA 1.0 . 2.79 509 298 A 78 ARG HA A 78 ARG HG2 1.0 . 2.40 510 298 A 78 ARG HA A 78 ARG HG3 1.0 . 2.40 511 299 A 90 LYS HA A 90 LYS HE2 1.0 . 3.51 512 299 A 90 LYS HA A 90 LYS HE3 1.0 . 3.51 513 300 A 17 LYS HB2 A 17 LYS HG2 1.0 . 3.00 514 300 A 17 LYS HB3 A 17 LYS HG2 1.0 . 3.00 515 300 A 17 LYS HG3 A 17 LYS HB2 1.0 . 3.00 516 300 A 17 LYS HG3 A 17 LYS HB3 1.0 . 3.00 517 301 A 17 LYS HB2 A 17 LYS HE2 1.0 . 4.14 518 301 A 17 LYS HB3 A 17 LYS HE2 1.0 . 4.14 519 301 A 17 LYS HE3 A 17 LYS HB2 1.0 . 4.14 520 301 A 17 LYS HB3 A 17 LYS HE3 1.0 . 4.14 521 302 A 59 LEU HG A 57 ARG HB2 1.0 . 5.50 522 302 A 59 LEU HG A 57 ARG HB3 1.0 . 5.50 523 303 A 59 LEU HG A 59 LEU HA 1.0 . 3.81 524 304 A 10 ILE HD1% A 98 TYR HA 1.0 . 4.44 525 305 A 10 ILE HD1% A 71 ILE HB 1.0 . 4.25 526 306 A 10 ILE HD1% A 10 ILE H 1.0 . 3.85 527 307 A 91 SER HA A 92 ASN HB2 1.0 . 4.10 528 307 A 92 ASN HB3 A 91 SER HA 1.0 . 4.10 529 308 A 61 ASN HBy A 24 LYS HB2 1.0 . 5.50 530 308 A 24 LYS HB3 A 61 ASN HBy 1.0 . 5.50 531 309 A 61 ASN H A 61 ASN HBy 1.0 . 4.16 532 310 A 52 TRP HA A 57 ARG HB2 1.0 . 5.50 533 310 A 52 TRP HA A 57 ARG HB3 1.0 . 5.50 534 311 A 76 ILE HA A 76 ILE HD1% 1.0 . 3.73 535 312 A 76 ILE HA A 75 GLY HAx 1.0 . 4.65 536 313 A 76 ILE HA A 75 GLY HAy 1.0 . 4.65 537 314 A 76 ILE HA A 76 ILE HG2% 1.0 . 3.55 538 315 A 100 ILE HB A 100 ILE HD1% 1.0 . 3.79 539 316 A 72 GLN HE21 A 72 GLN HB2 1.0 . 4.46 540 316 A 72 GLN HB3 A 72 GLN HE21 1.0 . 4.46 541 317 A 71 ILE HA A 72 GLN HB2 1.0 . 5.50 542 317 A 72 GLN HB3 A 71 ILE HA 1.0 . 5.50 543 318 A 72 GLN HE22 A 72 GLN HB2 1.0 . 4.46 544 318 A 72 GLN HB3 A 72 GLN HE22 1.0 . 4.46 545 319 A 82 MET HB3 A 83 ASN HB2 1.0 . 5.41 546 319 A 82 MET HB2 A 83 ASN HB2 1.0 . 5.41 547 319 A 83 ASN HB3 A 82 MET HB2 1.0 . 5.41 548 319 A 82 MET HB3 A 83 ASN HB3 1.0 . 5.41 549 320 A 17 LYS HA A 17 LYS HG2 1.0 . 2.87 550 320 A 17 LYS HG3 A 17 LYS HA 1.0 . 2.87 551 321 A 17 LYS HA A 17 LYS HB2 1.0 . 2.99 552 321 A 17 LYS HA A 17 LYS HB3 1.0 . 2.99 553 322 A 17 LYS HA A 17 LYS HE2 1.0 . 3.56 554 322 A 17 LYS HA A 17 LYS HE3 1.0 . 3.56 555 323 A 33 LEU HA A 34 ASN HA 1.0 . 4.49 556 324 A 45 SER H A 45 SER HB2 1.0 . 3.61 557 324 A 45 SER H A 45 SER HB3 1.0 . 3.61 558 325 A 64 LEU HB3 A 64 LEU HD1% 1.0 . 3.92 559 325 A 64 LEU HB2 A 64 LEU HD1% 1.0 . 3.92 560 326 A 15 VAL HA A 16 LEU HB2 1.0 . 4.91 561 326 A 16 LEU HB3 A 15 VAL HA 1.0 . 4.91 562 327 A 17 LYS HA A 16 LEU HB2 1.0 . 5.15 563 327 A 16 LEU HB3 A 17 LYS HA 1.0 . 5.15 564 328 A 16 LEU HB3 A 17 LYS HB2 1.0 . 4.60 565 328 A 16 LEU HB2 A 17 LYS HB2 1.0 . 4.60 566 328 A 17 LYS HB3 A 16 LEU HB2 1.0 . 4.60 567 328 A 16 LEU HB3 A 17 LYS HB3 1.0 . 4.60 568 329 A 24 LYS HB2 A 24 LYS HD2 1.0 . 2.45 569 329 A 24 LYS HB3 A 24 LYS HD2 1.0 . 2.45 570 329 A 24 LYS HD3 A 24 LYS HB2 1.0 . 2.45 571 329 A 24 LYS HD3 A 24 LYS HB3 1.0 . 2.45 572 330 A 24 LYS H A 24 LYS HB2 1.0 . 3.66 573 330 A 24 LYS HB3 A 24 LYS H 1.0 . 3.66 574 331 A 23 LYS HA A 24 LYS HB2 1.0 . 4.86 575 331 A 23 LYS HA A 24 LYS HB3 1.0 . 4.86 576 332 A 65 PHE HA A 66 LEU HD1% 1.0 . 5.50 577 333 A 64 LEU HA A 65 PHE HBy 1.0 . 5.50 578 334 A 7 THR HB A 8 ALA HB% 1.0 . 4.91 579 335 A 90 LYS HA A 90 LYS HB2 1.0 . 2.40 580 335 A 90 LYS HB3 A 90 LYS HA 1.0 . 2.40 581 336 A 7 THR HB A 7 THR HA 1.0 . 2.79 582 337 A 64 LEU HG A 65 PHE HA 1.0 . 4.70 583 338 A 65 PHE HA A 66 LEU HG 1.0 . 5.17 584 339 A 66 LEU HG A 66 LEU H 1.0 . 4.93 585 340 A 77 PHE HA A 77 PHE HB2 1.0 . 2.59 586 340 A 77 PHE HB3 A 77 PHE HA 1.0 . 2.59 587 341 A 54 SER HA A 53 ASP HA 1.0 . 5.50 588 342 A 89 THR H A 89 THR HB 1.0 . 3.59 589 343 A 88 GLU HA A 89 THR HB 1.0 . 5.43 590 344 A 90 LYS HA A 89 THR HB 1.0 . 5.50 591 345 A 10 ILE HB A 9 ARG HA 1.0 . 5.50 592 346 A 10 ILE HB A 98 TYR HA 1.0 . 6.50 593 347 A 42 LYS HB3 A 42 LYS HD2 1.0 . 3.91 594 347 A 42 LYS HB2 A 42 LYS HD2 1.0 . 3.91 595 347 A 42 LYS HD3 A 42 LYS HB2 1.0 . 3.91 596 347 A 42 LYS HD3 A 42 LYS HB3 1.0 . 3.91 597 348 A 42 LYS H A 42 LYS HD2 1.0 . 5.50 598 348 A 42 LYS HD3 A 42 LYS H 1.0 . 5.50 599 349 A 41 TRP HA A 42 LYS HD2 1.0 . 5.11 600 349 A 42 LYS HD3 A 41 TRP HA 1.0 . 5.11 601 350 A 42 LYS HA A 42 LYS HD2 1.0 . 5.39 602 350 A 42 LYS HD3 A 42 LYS HA 1.0 . 5.39 603 351 A 59 LEU HA A 57 ARG HB2 1.0 . 5.19 604 351 A 59 LEU HA A 57 ARG HB3 1.0 . 5.19 605 352 A 59 LEU HA A 59 LEU HD1% 1.0 . 5.50 606 353 A 9 ARG H A 9 ARG HD2 1.0 . 3.93 607 353 A 9 ARG H A 9 ARG HD3 1.0 . 3.93 608 354 A 8 ALA HA A 9 ARG HD2 1.0 . 5.50 609 354 A 8 ALA HA A 9 ARG HD3 1.0 . 5.50 610 355 A 81 ALA H A 81 ALA HB% 1.0 . 3.76 611 356 A 81 ALA HB% A 21 ALA HA 1.0 . 5.27 612 357 A 69 VAL HB A 97 VAL HG2% 1.0 . 5.50 613 358 A 68 ALA HB% A 67 PRO HA 1.0 . 4.74 614 359 A 101 PRO HA A 102 GLY HA2 1.0 . 4.56 615 359 A 101 PRO HA A 102 GLY HA3 1.0 . 4.56 616 360 A 71 ILE H A 71 ILE HG1x 1.0 . 4.96 617 361 A 98 TYR HA A 71 ILE HG1x 1.0 . 5.90 618 362 A 10 ILE HD1% A 71 ILE HA 1.0 . 3.74 619 363 A 71 ILE HD1% A 71 ILE HA 1.0 . 4.04 620 364 A 18 CYS HA A 91 SER HB3 1.0 . 3.29 621 364 A 91 SER HB2 A 18 CYS HA 1.0 . 3.29 622 365 A 81 ALA HB% A 82 MET HG2 1.0 . 5.50 623 365 A 81 ALA HB% A 82 MET HG3 1.0 . 5.50 624 366 A 82 MET H A 82 MET HG2 1.0 . 3.97 625 366 A 82 MET H A 82 MET HG3 1.0 . 3.97 626 367 A 33 LEU H A 32 LYS HA 1.0 . 3.14 627 368 A 12 GLU HA A 12 GLU HB2 1.0 . 2.40 628 368 A 12 GLU HB3 A 12 GLU HA 1.0 . 2.40 629 369 A 96 ARG HA A 96 ARG HD2 1.0 . 2.53 630 369 A 96 ARG HA A 96 ARG HD3 1.0 . 2.53 631 370 A 63 SER HB2 A 64 LEU HB2 1.0 . 4.51 632 370 A 64 LEU HB3 A 63 SER HB2 1.0 . 4.51 633 370 A 63 SER HB3 A 64 LEU HB3 1.0 . 4.51 634 370 A 63 SER HB3 A 64 LEU HB2 1.0 . 4.51 635 371 A 15 VAL HA A 64 LEU HB2 1.0 . 5.37 636 371 A 64 LEU HB3 A 15 VAL HA 1.0 . 5.37 637 372 A 63 SER HA A 64 LEU HB2 1.0 . 5.50 638 372 A 64 LEU HB3 A 63 SER HA 1.0 . 5.50 639 373 A 32 LYS H A 32 LYS HD2 1.0 . 5.05 640 373 A 32 LYS H A 32 LYS HD3 1.0 . 5.05 641 374 A 95 VAL HB A 94 ARG HA 1.0 . 4.31 642 375 A 95 VAL HB A 95 VAL H 1.0 . 3.98 643 376 A 44 LEU HA A 44 LEU HD1% 1.0 . 4.29 644 377 A 57 ARG HA A 56 ALA HB% 1.0 . 4.94 645 378 A 81 ALA HB% A 29 LEU HA 1.0 . 4.87 646 379 A 94 ARG HA A 95 VAL HA 1.0 . 4.47 647 380 A 95 VAL HA A 95 VAL HG1% 1.0 . 3.12 648 380 A 95 VAL HG2% A 95 VAL HA 1.0 . 3.12 649 381 A 102 GLY HA2 A 103 LYS HB2 1.0 . 4.39 650 381 A 102 GLY HA3 A 103 LYS HB2 1.0 . 4.39 651 381 A 103 LYS HB3 A 102 GLY HA2 1.0 . 4.39 652 381 A 102 GLY HA3 A 103 LYS HB3 1.0 . 4.39 653 382 A 76 ILE H A 76 ILE HG2% 1.0 . 4.14 654 383 A 35 THR HA A 36 GLY HA2 1.0 . 5.50 655 383 A 36 GLY HA3 A 35 THR HA 1.0 . 5.50 656 384 A 35 THR HB A 36 GLY HA2 1.0 . 4.37 657 384 A 36 GLY HA3 A 35 THR HB 1.0 . 4.37 658 385 A 58 VAL HA A 58 VAL HG1% 1.0 . 3.99 659 385 A 58 VAL HG2% A 58 VAL HA 1.0 . 3.99 660 386 A 75 GLY H A 35 THR HB 1.0 . 5.50 661 387 A 57 ARG HA A 57 ARG HG2 1.0 . 4.08 662 387 A 57 ARG HG3 A 57 ARG HA 1.0 . 4.08 663 388 A 56 ALA HA A 57 ARG HG2 1.0 . 3.75 664 388 A 57 ARG HG3 A 56 ALA HA 1.0 . 3.75 665 389 A 56 ALA HB% A 57 ARG HG2 1.0 . 4.70 666 389 A 57 ARG HG3 A 56 ALA HB% 1.0 . 4.70 667 390 A 57 ARG H A 57 ARG HG2 1.0 . 4.63 668 390 A 57 ARG HG3 A 57 ARG H 1.0 . 4.63 669 391 A 79 CYS H A 78 ARG HG2 1.0 . 5.23 670 391 A 79 CYS H A 78 ARG HG3 1.0 . 5.23 671 392 A 19 LYS HB3 A 19 LYS HD2 1.0 . 2.85 672 392 A 19 LYS HD3 A 19 LYS HB2 1.0 . 2.85 673 392 A 19 LYS HB3 A 19 LYS HD3 1.0 . 2.85 674 392 A 19 LYS HB2 A 19 LYS HD2 1.0 . 2.85 675 393 A 19 LYS H A 19 LYS HB2 1.0 . 4.05 676 393 A 19 LYS HB3 A 19 LYS H 1.0 . 4.05 677 394 A 19 LYS HB2 A 19 LYS HE2 1.0 . 3.62 678 394 A 19 LYS HB3 A 19 LYS HE2 1.0 . 3.62 679 394 A 19 LYS HE3 A 19 LYS HB2 1.0 . 3.62 680 394 A 19 LYS HE3 A 19 LYS HB3 1.0 . 3.62 681 395 A 18 CYS HA A 19 LYS HB2 1.0 . 4.84 682 395 A 19 LYS HB3 A 18 CYS HA 1.0 . 4.84 683 396 A 28 ARG HA A 29 LEU HB2 1.0 . 4.88 684 396 A 29 LEU HB3 A 28 ARG HA 1.0 . 4.88 685 397 A 28 ARG HB2 A 29 LEU HB2 1.0 . 5.50 686 397 A 28 ARG HB3 A 29 LEU HB2 1.0 . 5.50 687 397 A 29 LEU HB3 A 28 ARG HB2 1.0 . 5.50 688 397 A 29 LEU HB3 A 28 ARG HB3 1.0 . 5.50 689 398 A 29 LEU HB3 A 82 MET HB2 1.0 . 5.50 690 398 A 29 LEU HB2 A 82 MET HB2 1.0 . 5.50 691 398 A 82 MET HB3 A 29 LEU HB2 1.0 . 5.50 692 398 A 29 LEU HB3 A 82 MET HB3 1.0 . 5.50 693 399 A 47 GLN HE22 A 47 GLN HB2 1.0 . 4.36 694 399 A 47 GLN HB3 A 47 GLN HE22 1.0 . 4.36 695 400 A 47 GLN H A 47 GLN HB2 1.0 . 4.00 696 400 A 47 GLN H A 47 GLN HB3 1.0 . 4.00 697 401 A 47 GLN HE21 A 47 GLN HB2 1.0 . 4.36 698 401 A 47 GLN HB3 A 47 GLN HE21 1.0 . 4.36 699 402 A 9 ARG HA A 12 GLU HB2 1.0 . 5.50 700 402 A 12 GLU HB3 A 9 ARG HA 1.0 . 5.50 701 403 A 38 THR HA A 39 GLU HB2 1.0 . 5.50 702 403 A 38 THR HA A 39 GLU HB3 1.0 . 5.50 703 404 A 87 LYS HA A 86 GLY HA2 1.0 . 5.50 704 404 A 87 LYS HA A 86 GLY HA3 1.0 . 5.50 705 405 A 99 GLN HA A 98 TYR HB2 1.0 . 5.50 706 405 A 98 TYR HB3 A 99 GLN HA 1.0 . 5.50 707 406 A 99 GLN HA A 99 GLN HE22 1.0 . 3.31 708 407 A 99 GLN HA A 99 GLN HG2 1.0 . 3.89 709 407 A 99 GLN HA A 99 GLN HG3 1.0 . 3.89 710 408 A 99 GLN HA A 99 GLN HE21 1.0 . 3.31 711 409 A 69 VAL HA A 70 GLY HA2 1.0 . 4.04 712 409 A 69 VAL HA A 70 GLY HA3 1.0 . 4.04 713 410 A 69 VAL HB A 70 GLY HA2 1.0 . 4.92 714 410 A 69 VAL HB A 70 GLY HA3 1.0 . 4.92 715 411 A 78 ARG HB3 A 79 CYS HB2 1.0 . 5.50 716 411 A 78 ARG HB2 A 79 CYS HB2 1.0 . 5.50 717 411 A 79 CYS HB3 A 78 ARG HB2 1.0 . 5.50 718 411 A 78 ARG HB3 A 79 CYS HB3 1.0 . 5.50 719 412 A 79 CYS H A 79 CYS HB2 1.0 . 4.20 720 412 A 79 CYS H A 79 CYS HB3 1.0 . 4.20 721 413 A 6 ILE HG2% A 6 ILE HA 1.0 . 3.59 722 414 A 44 LEU HG A 44 LEU HB2 1.0 . 2.67 723 414 A 44 LEU HB3 A 44 LEU HG 1.0 . 2.67 724 415 A 44 LEU HG A 44 LEU H 1.0 . 4.11 725 416 A 61 ASN HA A 62 GLY HA2 1.0 . 4.26 726 416 A 61 ASN HA A 62 GLY HA3 1.0 . 4.26 727 417 A 22 PRO HB3 A 23 LYS HD2 1.0 . 5.50 728 417 A 22 PRO HB2 A 23 LYS HD2 1.0 . 5.50 729 417 A 23 LYS HD3 A 22 PRO HB2 1.0 . 5.50 730 417 A 22 PRO HB3 A 23 LYS HD3 1.0 . 5.50 731 418 A 23 LYS HA A 23 LYS HD2 1.0 . 4.23 732 418 A 23 LYS HD3 A 23 LYS HA 1.0 . 4.23 733 419 A 22 PRO HA A 23 LYS HD2 1.0 . 4.58 734 419 A 23 LYS HD3 A 22 PRO HA 1.0 . 4.58 735 420 A 9 ARG HA A 9 ARG HG2 1.0 . 2.90 736 420 A 9 ARG HA A 9 ARG HG3 1.0 . 2.90 737 421 A 42 LYS HA A 42 LYS HG2 1.0 . 3.26 738 421 A 42 LYS HG3 A 42 LYS HA 1.0 . 3.26 739 422 A 32 LYS HA A 32 LYS HD2 1.0 . 4.40 740 422 A 32 LYS HA A 32 LYS HD3 1.0 . 4.40 741 423 A 97 VAL HB A 9 ARG HA 1.0 . 4.71 742 424 A 18 CYS HA A 17 LYS HB2 1.0 . 4.62 743 424 A 18 CYS HA A 17 LYS HB3 1.0 . 4.62 744 425 A 100 ILE H A 100 ILE HD1% 1.0 . 5.50 745 426 A 100 ILE HA A 100 ILE HD1% 1.0 . 4.34 746 427 A 76 ILE HD1% A 76 ILE HB 1.0 . 3.76 747 428 A 76 ILE HB A 75 GLY HAx 1.0 . 5.50 748 429 A 76 ILE HB A 75 GLY HAy 1.0 . 5.50 749 430 A 76 ILE H A 76 ILE HB 1.0 . 4.11 750 431 A 37 ARG HA A 37 ARG HD2 1.0 . 2.79 751 431 A 37 ARG HA A 37 ARG HD3 1.0 . 2.79 752 432 A 87 LYS H A 87 LYS HE2 1.0 . 5.20 753 432 A 87 LYS HE3 A 87 LYS H 1.0 . 5.20 754 433 A 4 GLN HA A 5 ASN HA 1.0 . 5.13 755 434 A 6 ILE HA A 5 ASN HA 1.0 . 5.50 756 435 A 5 ASN HA A 4 GLN HB2 1.0 . 5.09 757 435 A 4 GLN HB3 A 5 ASN HA 1.0 . 5.09 758 436 A 36 GLY HA2 A 37 ARG HG2 1.0 . 5.50 759 436 A 36 GLY HA3 A 37 ARG HG2 1.0 . 5.50 760 436 A 37 ARG HG3 A 36 GLY HA2 1.0 . 5.50 761 436 A 37 ARG HG3 A 36 GLY HA3 1.0 . 5.50 762 437 A 65 PHE HA A 66 LEU HB2 1.0 . 5.50 763 437 A 65 PHE HA A 66 LEU HB3 1.0 . 5.50 764 438 A 33 LEU H A 33 LEU HD2% 1.0 . 5.13 765 439 A 57 ARG HA A 57 ARG HB2 1.0 . 2.52 766 439 A 57 ARG HA A 57 ARG HB3 1.0 . 2.52 767 440 A 96 ARG HA A 96 ARG HB2 1.0 . 2.79 768 440 A 96 ARG HB3 A 96 ARG HA 1.0 . 2.79 769 441 A 10 ILE HA A 11 GLY HAy 1.0 . 4.45 770 442 A 1 GLY HA3 A 19 LYS HG2 1.0 . 4.30 771 442 A 1 GLY HA2 A 19 LYS HG2 1.0 . 4.30 772 442 A 19 LYS HG3 A 1 GLY HA2 1.0 . 4.30 773 442 A 19 LYS HG3 A 1 GLY HA3 1.0 . 4.30 774 443 A 57 ARG HB2 A 57 ARG HD2 1.0 . 3.71 775 443 A 57 ARG HB3 A 57 ARG HD2 1.0 . 3.71 776 443 A 57 ARG HD3 A 57 ARG HB2 1.0 . 3.71 777 443 A 57 ARG HD3 A 57 ARG HB3 1.0 . 3.71 778 444 A 18 CYS H A 17 LYS HB2 1.0 . 4.25 779 444 A 17 LYS HB3 A 18 CYS H 1.0 . 4.25 780 445 A 97 VAL HB A 98 TYR HA 1.0 . 4.99 781 446 A 91 SER HA A 91 SER HB3 1.0 . 2.55 782 446 A 91 SER HB2 A 91 SER HA 1.0 . 2.55 783 447 A 79 CYS H A 78 ARG HD2 1.0 . 5.50 784 447 A 79 CYS H A 78 ARG HD3 1.0 . 5.50 785 448 A 96 ARG H A 96 ARG HD2 1.0 . 5.50 786 448 A 96 ARG H A 96 ARG HD3 1.0 . 5.50 787 449 A 69 VAL H A 69 VAL HG1% 1.0 . 4.23 788 450 A 78 ARG H A 78 ARG HG2 1.0 . 4.21 789 450 A 78 ARG H A 78 ARG HG3 1.0 . 4.21 790 451 A 43 VAL HA A 43 VAL HG1% 1.0 . 2.85 791 451 A 43 VAL HG2% A 43 VAL HA 1.0 . 2.85 792 452 A 93 TYR HA A 94 ARG HD2 1.0 . 3.94 793 452 A 94 ARG HD3 A 93 TYR HA 1.0 . 3.94 794 453 A 40 ALA H A 40 ALA HB% 1.0 . 3.72 795 454 A 40 ALA HB% A 39 GLU HB2 1.0 . 4.76 796 454 A 39 GLU HB3 A 40 ALA HB% 1.0 . 4.76 797 455 A 40 ALA HB% A 42 LYS HD2 1.0 . 5.00 798 455 A 42 LYS HD3 A 40 ALA HB% 1.0 . 5.00 799 456 A 81 ALA HB% A 29 LEU HB2 1.0 . 3.12 800 456 A 29 LEU HB3 A 81 ALA HB% 1.0 . 3.12 801 457 A 21 ALA HB% A 29 LEU HB2 1.0 . 3.92 802 457 A 29 LEU HB3 A 21 ALA HB% 1.0 . 3.92 803 458 A 29 LEU HG A 21 ALA HB% 1.0 . 5.08 804 459 A 10 ILE HD1% A 99 GLN HG2 1.0 . 3.88 805 459 A 10 ILE HD1% A 99 GLN HG3 1.0 . 3.88 806 460 A 10 ILE HD1% A 10 ILE HA 1.0 . 3.90 807 461 A 69 VAL HA A 69 VAL HG2% 1.0 . 3.69 808 462 A 38 THR HG2% A 40 ALA HB% 1.0 . 5.31 809 463 A 32 LYS HD2 A 43 VAL HG1% 1.0 . 3.06 810 463 A 32 LYS HD3 A 43 VAL HG1% 1.0 . 3.06 811 463 A 43 VAL HG2% A 32 LYS HD2 1.0 . 3.06 812 463 A 43 VAL HG2% A 32 LYS HD3 1.0 . 3.06 813 464 A 32 LYS HB2 A 43 VAL HG1% 1.0 . 3.71 814 464 A 32 LYS HB3 A 43 VAL HG1% 1.0 . 3.71 815 464 A 43 VAL HG2% A 32 LYS HB2 1.0 . 3.71 816 464 A 32 LYS HB3 A 43 VAL HG2% 1.0 . 3.71 817 465 A 56 ALA HB% A 55 VAL HG1% 1.0 . 3.82 818 465 A 55 VAL HG2% A 56 ALA HB% 1.0 . 3.82 819 466 A 5 ASN HA A 5 ASN HD22 1.0 . 3.95 820 466 A 5 ASN HA A 5 ASN HD21 1.0 . 3.95 821 467 A 5 ASN HA A 94 ARG HBy 1.0 . 3.73 822 467 A 5 ASN HA A 94 ARG HBx 1.0 . 3.73 823 468 A 5 ASN HB2 A 94 ARG HBy 1.0 . 5.34 824 468 A 5 ASN HB3 A 94 ARG HBy 1.0 . 5.34 825 468 A 94 ARG HBx A 5 ASN HB2 1.0 . 5.34 826 468 A 5 ASN HB3 A 94 ARG HBx 1.0 . 5.34 827 469 A 5 ASN HB2 A 94 ARG HGy 1.0 . 5.23 828 469 A 5 ASN HB3 A 94 ARG HGy 1.0 . 5.23 829 469 A 94 ARG HGx A 5 ASN HB2 1.0 . 5.23 830 469 A 5 ASN HB3 A 94 ARG HGx 1.0 . 5.23 831 470 A 6 ILE HB A 16 LEU HD1% 1.0 . 3.90 832 470 A 6 ILE HB A 16 LEU HD2% 1.0 . 3.90 833 471 A 8 ALA HA A 69 VAL HG1% 1.0 . 4.95 834 471 A 8 ALA HA A 69 VAL HG2% 1.0 . 4.95 835 472 A 8 ALA HB% A 97 VAL HG1% 1.0 . 3.68 836 472 A 8 ALA HB% A 97 VAL HG2% 1.0 . 3.68 837 473 A 9 ARG H A 9 ARG HBy 1.0 . 3.15 838 473 A 9 ARG H A 9 ARG HBx 1.0 . 3.15 839 474 A 9 ARG HA A 9 ARG HBy 1.0 . 2.52 840 474 A 9 ARG HA A 9 ARG HBx 1.0 . 2.52 841 475 A 9 ARG HA A 69 VAL HG1% 1.0 . 5.17 842 475 A 9 ARG HA A 69 VAL HG2% 1.0 . 5.17 843 476 A 9 ARG HA A 97 VAL HG1% 1.0 . 4.79 844 476 A 9 ARG HA A 97 VAL HG2% 1.0 . 4.79 845 477 A 9 ARG HBx A 9 ARG HG2 1.0 . 2.42 846 477 A 9 ARG HBy A 9 ARG HG2 1.0 . 2.42 847 477 A 9 ARG HG3 A 9 ARG HBy 1.0 . 2.42 848 477 A 9 ARG HG3 A 9 ARG HBx 1.0 . 2.42 849 478 A 9 ARG HBx A 9 ARG HD2 1.0 . 2.75 850 478 A 9 ARG HBy A 9 ARG HD2 1.0 . 2.75 851 478 A 9 ARG HD3 A 9 ARG HBy 1.0 . 2.75 852 478 A 9 ARG HD3 A 9 ARG HBx 1.0 . 2.75 853 479 A 10 ILE HB A 9 ARG HBy 1.0 . 4.98 854 479 A 10 ILE HB A 9 ARG HBx 1.0 . 4.98 855 480 A 12 GLU H A 9 ARG HBy 1.0 . 4.88 856 480 A 12 GLU H A 9 ARG HBx 1.0 . 4.88 857 481 A 10 ILE HB A 11 GLY HAy 1.0 . 5.00 858 481 A 10 ILE HB A 11 GLY HAx 1.0 . 5.00 859 482 A 10 ILE HD1% A 71 ILE HG1x 1.0 . 4.44 860 482 A 10 ILE HD1% A 71 ILE HG1y 1.0 . 4.44 861 483 A 10 ILE HD1% A 97 VAL HG1% 1.0 . 3.55 862 483 A 10 ILE HD1% A 97 VAL HG2% 1.0 . 3.55 863 484 A 11 GLY HAx A 12 GLU HB2 1.0 . 5.34 864 484 A 11 GLY HAy A 12 GLU HB2 1.0 . 5.34 865 484 A 12 GLU HB3 A 11 GLY HAy 1.0 . 5.34 866 484 A 12 GLU HB3 A 11 GLY HAx 1.0 . 5.34 867 485 A 13 PRO HB3 A 14 LEU HBx 1.0 . 5.34 868 485 A 13 PRO HB2 A 14 LEU HBx 1.0 . 5.34 869 485 A 14 LEU HBy A 13 PRO HB2 1.0 . 5.34 870 485 A 13 PRO HB3 A 14 LEU HBy 1.0 . 5.34 871 486 A 14 LEU H A 14 LEU HBx 1.0 . 3.62 872 486 A 14 LEU H A 14 LEU HBy 1.0 . 3.62 873 487 A 14 LEU H A 15 VAL HG1% 1.0 . 4.97 874 487 A 14 LEU H A 15 VAL HG2% 1.0 . 4.97 875 488 A 14 LEU HA A 14 LEU HD1% 1.0 . 3.76 876 488 A 14 LEU HA A 14 LEU HD2% 1.0 . 3.76 877 489 A 14 LEU HA A 15 VAL HG1% 1.0 . 4.95 878 489 A 14 LEU HA A 15 VAL HG2% 1.0 . 4.95 879 490 A 14 LEU HBx A 15 VAL HG1% 1.0 . 5.06 880 490 A 14 LEU HBy A 15 VAL HG1% 1.0 . 5.06 881 490 A 15 VAL HG2% A 14 LEU HBx 1.0 . 5.06 882 490 A 14 LEU HBy A 15 VAL HG2% 1.0 . 5.06 883 491 A 66 LEU H A 14 LEU HBx 1.0 . 4.14 884 491 A 66 LEU H A 14 LEU HBy 1.0 . 4.14 885 492 A 14 LEU HG A 66 LEU HD1% 1.0 . 5.24 886 492 A 14 LEU HG A 66 LEU HD2% 1.0 . 5.24 887 493 A 15 VAL H A 15 VAL HG1% 1.0 . 3.13 888 493 A 15 VAL H A 15 VAL HG2% 1.0 . 3.13 889 494 A 15 VAL HA A 16 LEU HD1% 1.0 . 4.32 890 494 A 15 VAL HA A 16 LEU HD2% 1.0 . 4.32 891 495 A 15 VAL HA A 59 LEU HD1% 1.0 . 5.08 892 495 A 15 VAL HA A 59 LEU HD2% 1.0 . 5.08 893 496 A 15 VAL HB A 59 LEU HD1% 1.0 . 5.44 894 496 A 59 LEU HD2% A 15 VAL HB 1.0 . 5.44 895 497 A 15 VAL HG1% A 16 LEU HD1% 1.0 . 5.11 896 497 A 15 VAL HG2% A 16 LEU HD1% 1.0 . 5.11 897 497 A 16 LEU HD2% A 15 VAL HG1% 1.0 . 5.11 898 497 A 16 LEU HD2% A 15 VAL HG2% 1.0 . 5.11 899 498 A 15 VAL HG2% A 59 LEU HD1% 1.0 . 4.85 900 498 A 15 VAL HG1% A 59 LEU HD1% 1.0 . 4.85 901 498 A 59 LEU HD2% A 15 VAL HG1% 1.0 . 4.85 902 498 A 15 VAL HG2% A 59 LEU HD2% 1.0 . 4.85 903 499 A 64 LEU H A 15 VAL HG1% 1.0 . 4.18 904 499 A 15 VAL HG2% A 64 LEU H 1.0 . 4.18 905 500 A 66 LEU H A 15 VAL HG1% 1.0 . 5.35 906 500 A 66 LEU H A 15 VAL HG2% 1.0 . 5.35 907 501 A 16 LEU H A 16 LEU HD1% 1.0 . 4.60 908 501 A 16 LEU H A 16 LEU HD2% 1.0 . 4.60 909 502 A 16 LEU HA A 16 LEU HD1% 1.0 . 3.17 910 502 A 16 LEU HA A 16 LEU HD2% 1.0 . 3.17 911 503 A 17 LYS HB2 A 18 CYS HBy 1.0 . 5.34 912 503 A 17 LYS HB3 A 18 CYS HBy 1.0 . 5.34 913 503 A 18 CYS HBx A 17 LYS HB2 1.0 . 5.34 914 503 A 17 LYS HB3 A 18 CYS HBx 1.0 . 5.34 915 504 A 17 LYS HG3 A 18 CYS HBy 1.0 . 4.33 916 504 A 17 LYS HG2 A 18 CYS HBy 1.0 . 4.33 917 504 A 18 CYS HBx A 17 LYS HG2 1.0 . 4.33 918 504 A 17 LYS HG3 A 18 CYS HBx 1.0 . 4.33 919 505 A 18 CYS HA A 18 CYS HBy 1.0 . 2.53 920 505 A 18 CYS HA A 18 CYS HBx 1.0 . 2.53 921 506 A 63 SER HA A 18 CYS HBy 1.0 . 5.34 922 506 A 63 SER HA A 18 CYS HBx 1.0 . 5.34 923 507 A 24 LYS HA A 61 ASN HBx 1.0 . 5.57 924 507 A 24 LYS HA A 61 ASN HBy 1.0 . 5.57 925 508 A 24 LYS HB2 A 61 ASN HBx 1.0 . 4.67 926 508 A 24 LYS HB3 A 61 ASN HBx 1.0 . 4.67 927 508 A 61 ASN HBy A 24 LYS HB2 1.0 . 4.67 928 508 A 24 LYS HB3 A 61 ASN HBy 1.0 . 4.67 929 509 A 28 ARG HA A 29 LEU HD1% 1.0 . 4.87 930 509 A 28 ARG HA A 29 LEU HD2% 1.0 . 4.87 931 510 A 28 ARG HB2 A 29 LEU HD1% 1.0 . 5.44 932 510 A 28 ARG HB3 A 29 LEU HD1% 1.0 . 5.44 933 510 A 29 LEU HD2% A 28 ARG HB2 1.0 . 5.44 934 510 A 28 ARG HB3 A 29 LEU HD2% 1.0 . 5.44 935 511 A 29 LEU H A 29 LEU HD1% 1.0 . 4.48 936 511 A 29 LEU H A 29 LEU HD2% 1.0 . 4.48 937 512 A 32 LYS H A 32 LYS HG2 1.0 . 5.34 938 512 A 32 LYS H A 32 LYS HGy 1.0 . 5.34 939 513 A 32 LYS HA A 32 LYS HG2 1.0 . 3.00 940 513 A 32 LYS HA A 32 LYS HGy 1.0 . 3.00 941 514 A 43 VAL H A 32 LYS HG2 1.0 . 4.80 942 514 A 43 VAL H A 32 LYS HGy 1.0 . 4.80 943 515 A 32 LYS HGy A 43 VAL HG1% 1.0 . 3.31 944 515 A 32 LYS HG2 A 43 VAL HG1% 1.0 . 3.31 945 515 A 43 VAL HG2% A 32 LYS HG2 1.0 . 3.31 946 515 A 43 VAL HG2% A 32 LYS HGy 1.0 . 3.31 947 516 A 33 LEU H A 33 LEU HD1% 1.0 . 3.84 948 516 A 33 LEU H A 33 LEU HD2% 1.0 . 3.84 949 517 A 33 LEU HA A 33 LEU HD1% 1.0 . 3.52 950 517 A 33 LEU HA A 33 LEU HD2% 1.0 . 3.52 951 518 A 33 LEU HD2% A 64 LEU HD1% 1.0 . 4.22 952 518 A 33 LEU HD1% A 64 LEU HD1% 1.0 . 4.22 953 518 A 64 LEU HD2% A 33 LEU HD1% 1.0 . 4.22 954 518 A 33 LEU HD2% A 64 LEU HD2% 1.0 . 4.22 955 519 A 77 PHE HA A 33 LEU HD1% 1.0 . 4.90 956 519 A 77 PHE HA A 33 LEU HD2% 1.0 . 4.90 957 520 A 34 ASN HA A 34 ASN HD22 1.0 . 3.58 958 520 A 34 ASN HA A 34 ASN HD21 1.0 . 3.58 959 521 A 40 ALA HA A 41 TRP HBy 1.0 . 5.34 960 521 A 40 ALA HA A 41 TRP HBx 1.0 . 5.34 961 522 A 40 ALA HB% A 41 TRP HBy 1.0 . 5.34 962 522 A 40 ALA HB% A 41 TRP HBx 1.0 . 5.34 963 523 A 41 TRP H A 41 TRP HBy 1.0 . 3.63 964 523 A 41 TRP H A 41 TRP HBx 1.0 . 3.63 965 524 A 41 TRP HBy A 42 LYS HB2 1.0 . 5.34 966 524 A 41 TRP HBx A 42 LYS HB2 1.0 . 5.34 967 524 A 42 LYS HB3 A 41 TRP HBy 1.0 . 5.34 968 524 A 42 LYS HB3 A 41 TRP HBx 1.0 . 5.34 969 525 A 44 LEU H A 44 LEU HD1% 1.0 . 4.39 970 525 A 44 LEU H A 44 LEU HD2% 1.0 . 4.39 971 526 A 44 LEU HA A 44 LEU HD1% 1.0 . 3.69 972 526 A 44 LEU HA A 44 LEU HD2% 1.0 . 3.69 973 527 A 47 GLN HB3 A 47 GLN HE21 1.0 . 3.66 974 527 A 47 GLN HE22 A 47 GLN HB2 1.0 . 3.66 975 527 A 47 GLN HE21 A 47 GLN HB2 1.0 . 3.66 976 527 A 47 GLN HB3 A 47 GLN HE22 1.0 . 3.66 977 528 A 51 PRO HA A 52 TRP HBy 1.0 . 5.03 978 528 A 51 PRO HA A 52 TRP HBx 1.0 . 5.03 979 529 A 52 TRP H A 52 TRP HBy 1.0 . 3.52 980 529 A 52 TRP H A 52 TRP HBx 1.0 . 3.52 981 530 A 53 ASP H A 52 TRP HBy 1.0 . 4.11 982 530 A 53 ASP H A 52 TRP HBx 1.0 . 4.11 983 531 A 52 TRP HBy A 53 ASP HBy 1.0 . 4.53 984 531 A 52 TRP HBx A 53 ASP HBy 1.0 . 4.53 985 531 A 53 ASP HBx A 52 TRP HBy 1.0 . 4.53 986 531 A 52 TRP HBx A 53 ASP HBx 1.0 . 4.53 987 532 A 52 TRP HBx A 57 ARG HG2 1.0 . 3.85 988 532 A 57 ARG HG3 A 52 TRP HBy 1.0 . 3.85 989 532 A 57 ARG HG3 A 52 TRP HBx 1.0 . 3.85 990 532 A 52 TRP HBy A 57 ARG HG2 1.0 . 3.85 991 533 A 53 ASP H A 53 ASP HBy 1.0 . 3.17 992 533 A 53 ASP H A 53 ASP HBx 1.0 . 3.17 993 534 A 54 SER HA A 53 ASP HBy 1.0 . 5.34 994 534 A 54 SER HA A 53 ASP HBx 1.0 . 5.34 995 535 A 53 ASP HBx A 54 SER HB2 1.0 . 5.34 996 535 A 53 ASP HBy A 54 SER HB2 1.0 . 5.34 997 535 A 54 SER HB3 A 53 ASP HBy 1.0 . 5.34 998 535 A 54 SER HB3 A 53 ASP HBx 1.0 . 5.34 999 536 A 56 ALA HA A 64 LEU HD1% 1.0 . 5.44 1000 536 A 56 ALA HA A 64 LEU HD2% 1.0 . 5.44 1001 537 A 57 ARG H A 64 LEU HD1% 1.0 . 4.75 1002 537 A 57 ARG H A 64 LEU HD2% 1.0 . 4.75 1003 538 A 57 ARG HB2 A 59 LEU HD1% 1.0 . 5.43 1004 538 A 57 ARG HB3 A 59 LEU HD1% 1.0 . 5.43 1005 538 A 59 LEU HD2% A 57 ARG HB2 1.0 . 5.43 1006 538 A 57 ARG HB3 A 59 LEU HD2% 1.0 . 5.43 1007 539 A 58 VAL H A 64 LEU HD1% 1.0 . 4.68 1008 539 A 58 VAL H A 64 LEU HD2% 1.0 . 4.68 1009 540 A 58 VAL HA A 64 LEU HD1% 1.0 . 4.69 1010 540 A 58 VAL HA A 64 LEU HD2% 1.0 . 4.69 1011 541 A 59 LEU H A 59 LEU HD1% 1.0 . 3.84 1012 541 A 59 LEU H A 59 LEU HD2% 1.0 . 3.84 1013 542 A 59 LEU HA A 59 LEU HD1% 1.0 . 4.23 1014 542 A 59 LEU HA A 59 LEU HD2% 1.0 . 4.23 1015 543 A 59 LEU HB3 A 65 PHE HBx 1.0 . 5.11 1016 543 A 59 LEU HB2 A 65 PHE HBx 1.0 . 5.11 1017 543 A 65 PHE HBy A 59 LEU HB2 1.0 . 5.11 1018 543 A 59 LEU HB3 A 65 PHE HBy 1.0 . 5.11 1019 544 A 63 SER HA A 59 LEU HD1% 1.0 . 5.44 1020 544 A 63 SER HA A 59 LEU HD2% 1.0 . 5.44 1021 545 A 59 LEU HD2% A 63 SER HB2 1.0 . 4.57 1022 545 A 59 LEU HD1% A 63 SER HB2 1.0 . 4.57 1023 545 A 63 SER HB3 A 59 LEU HD1% 1.0 . 4.57 1024 545 A 63 SER HB3 A 59 LEU HD2% 1.0 . 4.57 1025 546 A 64 LEU H A 59 LEU HD1% 1.0 . 4.06 1026 546 A 59 LEU HD2% A 64 LEU H 1.0 . 4.06 1027 547 A 64 LEU HA A 59 LEU HD1% 1.0 . 4.22 1028 547 A 64 LEU HA A 59 LEU HD2% 1.0 . 4.22 1029 548 A 65 PHE HA A 59 LEU HD1% 1.0 . 5.44 1030 548 A 65 PHE HA A 59 LEU HD2% 1.0 . 5.44 1031 549 A 59 LEU HD2% A 65 PHE HBx 1.0 . 4.45 1032 549 A 59 LEU HD1% A 65 PHE HBx 1.0 . 4.45 1033 549 A 65 PHE HBy A 59 LEU HD1% 1.0 . 4.45 1034 549 A 59 LEU HD2% A 65 PHE HBy 1.0 . 4.45 1035 550 A 61 ASN H A 61 ASN HBx 1.0 . 3.49 1036 550 A 61 ASN H A 61 ASN HBy 1.0 . 3.49 1037 551 A 61 ASN HA A 61 ASN HBx 1.0 . 2.48 1038 551 A 61 ASN HA A 61 ASN HBy 1.0 . 2.48 1039 552 A 61 ASN HBx A 61 ASN HD22 1.0 . 3.14 1040 552 A 61 ASN HBy A 61 ASN HD22 1.0 . 3.14 1041 552 A 61 ASN HD21 A 61 ASN HBx 1.0 . 3.14 1042 552 A 61 ASN HBy A 61 ASN HD21 1.0 . 3.14 1043 553 A 63 SER HB2 A 64 LEU HD1% 1.0 . 5.44 1044 553 A 63 SER HB3 A 64 LEU HD1% 1.0 . 5.44 1045 553 A 64 LEU HD2% A 63 SER HB2 1.0 . 5.44 1046 553 A 63 SER HB3 A 64 LEU HD2% 1.0 . 5.44 1047 554 A 64 LEU H A 64 LEU HD1% 1.0 . 5.10 1048 554 A 64 LEU H A 64 LEU HD2% 1.0 . 5.10 1049 555 A 64 LEU HA A 64 LEU HD1% 1.0 . 3.99 1050 555 A 64 LEU HA A 64 LEU HD2% 1.0 . 3.99 1051 556 A 65 PHE HA A 64 LEU HD1% 1.0 . 5.44 1052 556 A 65 PHE HA A 64 LEU HD2% 1.0 . 5.44 1053 557 A 66 LEU H A 64 LEU HD1% 1.0 . 5.44 1054 557 A 66 LEU H A 64 LEU HD2% 1.0 . 5.44 1055 558 A 65 PHE H A 65 PHE HBx 1.0 . 3.55 1056 558 A 65 PHE H A 65 PHE HBy 1.0 . 3.55 1057 559 A 65 PHE HA A 66 LEU HD1% 1.0 . 4.62 1058 559 A 65 PHE HA A 66 LEU HD2% 1.0 . 4.62 1059 560 A 66 LEU H A 66 LEU HD1% 1.0 . 5.33 1060 560 A 66 LEU H A 66 LEU HD2% 1.0 . 5.33 1061 561 A 66 LEU HA A 66 LEU HD1% 1.0 . 3.36 1062 561 A 66 LEU HA A 66 LEU HD2% 1.0 . 3.36 1063 562 A 66 LEU HB3 A 73 ASP HBy 1.0 . 5.27 1064 562 A 66 LEU HB2 A 73 ASP HBy 1.0 . 5.27 1065 562 A 73 ASP HBx A 66 LEU HB2 1.0 . 5.27 1066 562 A 66 LEU HB3 A 73 ASP HBx 1.0 . 5.27 1067 563 A 66 LEU HG A 69 VAL HG1% 1.0 . 4.34 1068 563 A 66 LEU HG A 69 VAL HG2% 1.0 . 4.34 1069 564 A 69 VAL HA A 66 LEU HD1% 1.0 . 4.12 1070 564 A 69 VAL HA A 66 LEU HD2% 1.0 . 4.12 1071 565 A 66 LEU HD1% A 69 VAL HG1% 1.0 . 3.62 1072 565 A 66 LEU HD2% A 69 VAL HG1% 1.0 . 3.62 1073 565 A 69 VAL HG2% A 66 LEU HD1% 1.0 . 3.62 1074 565 A 69 VAL HG2% A 66 LEU HD2% 1.0 . 3.62 1075 566 A 66 LEU HD2% A 73 ASP HBy 1.0 . 4.01 1076 566 A 66 LEU HD1% A 73 ASP HBy 1.0 . 4.01 1077 566 A 73 ASP HBx A 66 LEU HD1% 1.0 . 4.01 1078 566 A 66 LEU HD2% A 73 ASP HBx 1.0 . 4.01 1079 567 A 68 ALA H A 69 VAL HG1% 1.0 . 5.44 1080 567 A 68 ALA H A 69 VAL HG2% 1.0 . 5.44 1081 568 A 69 VAL HB A 97 VAL HG1% 1.0 . 4.78 1082 568 A 69 VAL HB A 97 VAL HG2% 1.0 . 4.78 1083 569 A 69 VAL HG1% A 97 VAL HG1% 1.0 . 4.14 1084 569 A 69 VAL HG2% A 97 VAL HG1% 1.0 . 4.14 1085 569 A 97 VAL HG2% A 69 VAL HG1% 1.0 . 4.14 1086 569 A 69 VAL HG2% A 97 VAL HG2% 1.0 . 4.14 1087 570 A 71 ILE H A 71 ILE HG1x 1.0 . 4.09 1088 570 A 71 ILE H A 71 ILE HG1y 1.0 . 4.09 1089 571 A 71 ILE HA A 71 ILE HG1x 1.0 . 3.64 1090 571 A 71 ILE HA A 71 ILE HG1y 1.0 . 3.64 1091 572 A 71 ILE HA A 97 VAL HG1% 1.0 . 5.44 1092 572 A 71 ILE HA A 97 VAL HG2% 1.0 . 5.44 1093 573 A 98 TYR HA A 71 ILE HG1x 1.0 . 5.82 1094 573 A 98 TYR HA A 71 ILE HG1y 1.0 . 5.82 1095 574 A 71 ILE HG1x A 98 TYR HB2 1.0 . 4.31 1096 574 A 71 ILE HG1y A 98 TYR HB2 1.0 . 4.31 1097 574 A 98 TYR HB3 A 71 ILE HG1x 1.0 . 4.31 1098 574 A 98 TYR HB3 A 71 ILE HG1y 1.0 . 4.31 1099 575 A 72 GLN HE21 A 72 GLN HA 1.0 . 4.39 1100 575 A 72 GLN HE22 A 72 GLN HA 1.0 . 4.39 1101 576 A 73 ASP H A 97 VAL HG1% 1.0 . 4.49 1102 576 A 73 ASP H A 97 VAL HG2% 1.0 . 4.49 1103 577 A 73 ASP HA A 73 ASP HBy 1.0 . 2.52 1104 577 A 73 ASP HBx A 73 ASP HA 1.0 . 2.52 1105 578 A 74 GLU H A 73 ASP HBy 1.0 . 3.95 1106 578 A 74 GLU H A 73 ASP HBx 1.0 . 3.95 1107 579 A 85 ASN H A 85 ASN HBy 1.0 . 3.69 1108 579 A 85 ASN H A 85 ASN HBx 1.0 . 3.69 1109 580 A 86 GLY H A 85 ASN HBy 1.0 . 4.29 1110 580 A 85 ASN HBx A 86 GLY H 1.0 . 4.29 1111 581 A 92 ASN HA A 92 ASN HD21 1.0 . 3.29 1112 581 A 92 ASN HA A 92 ASN HD22 1.0 . 3.29 1113 582 A 93 TYR H A 92 ASN HD21 1.0 . 3.31 1114 582 A 93 TYR H A 92 ASN HD22 1.0 . 3.31 1115 583 A 93 TYR HA A 94 ARG HBy 1.0 . 4.71 1116 583 A 93 TYR HA A 94 ARG HBx 1.0 . 4.71 1117 584 A 93 TYR HA A 94 ARG HGy 1.0 . 4.08 1118 584 A 93 TYR HA A 94 ARG HGx 1.0 . 4.08 1119 585 A 94 ARG H A 94 ARG HGy 1.0 . 4.11 1120 585 A 94 ARG H A 94 ARG HGx 1.0 . 4.11 1121 586 A 94 ARG HA A 94 ARG HGy 1.0 . 3.40 1122 586 A 94 ARG HA A 94 ARG HGx 1.0 . 3.40 1123 587 A 94 ARG HBx A 94 ARG HGy 1.0 . 2.36 1124 587 A 94 ARG HBy A 94 ARG HGy 1.0 . 2.36 1125 587 A 94 ARG HGx A 94 ARG HBy 1.0 . 2.36 1126 587 A 94 ARG HBx A 94 ARG HGx 1.0 . 2.36 1127 588 A 94 ARG HBy A 94 ARG HD2 1.0 . 2.94 1128 588 A 94 ARG HBx A 94 ARG HD2 1.0 . 2.94 1129 588 A 94 ARG HD3 A 94 ARG HBy 1.0 . 2.94 1130 588 A 94 ARG HD3 A 94 ARG HBx 1.0 . 2.94 1131 589 A 95 VAL H A 94 ARG HBy 1.0 . 4.20 1132 589 A 95 VAL H A 94 ARG HBx 1.0 . 4.20 1133 590 A 94 ARG HBx A 95 VAL HG1% 1.0 . 5.23 1134 590 A 94 ARG HBy A 95 VAL HG1% 1.0 . 5.23 1135 590 A 95 VAL HG2% A 94 ARG HBy 1.0 . 5.23 1136 590 A 95 VAL HG2% A 94 ARG HBx 1.0 . 5.23 1137 591 A 97 VAL H A 97 VAL HG1% 1.0 . 3.86 1138 591 A 97 VAL H A 97 VAL HG2% 1.0 . 3.86 1139 592 A 97 VAL HA A 97 VAL HG1% 1.0 . 2.56 1140 592 A 97 VAL HA A 97 VAL HG2% 1.0 . 2.56 1141 593 A 98 TYR H A 97 VAL HG1% 1.0 . 4.32 1142 593 A 98 TYR H A 97 VAL HG2% 1.0 . 4.32 1143 594 A 98 TYR HB2 A 100 ILE HG1x 1.0 . 5.94 1144 594 A 98 TYR HB3 A 100 ILE HG1x 1.0 . 5.94 1145 594 A 100 ILE HG1y A 98 TYR HB2 1.0 . 5.94 1146 594 A 98 TYR HB3 A 100 ILE HG1y 1.0 . 5.94 1147 595 A 99 GLN H A 100 ILE HG1x 1.0 . 5.11 1148 595 A 99 GLN H A 100 ILE HG1y 1.0 . 5.11 1149 596 A 105 GLU H A 104 PRO HBy 1.0 . 3.72 1150 596 A 105 GLU H A 104 PRO HBx 1.0 . 3.72 1151 597 A 4 GLN H A 93 TYR HA 1.0 . 3.79 1152 598 A 5 ASN H A 4 GLN HA 1.0 . 3.19 1153 599 A 6 ILE H A 5 ASN HA 1.0 . 3.16 1154 600 A 6 ILE HG2% A 7 THR H 1.0 . 3.94 1155 601 A 6 ILE HG2% A 8 ALA HB% 1.0 . 3.98 1156 602 A 8 ALA HB% A 14 LEU HD2% 1.0 . 3.61 1157 603 A 10 ILE H A 9 ARG HA 1.0 . 3.04 1158 604 A 11 GLY H A 10 ILE HG2% 1.0 . 3.99 1159 605 A 11 GLY H A 12 GLU H 1.0 . 3.76 1160 606 A 14 LEU H A 13 PRO HA 1.0 . 3.39 1161 607 A 15 VAL H A 14 LEU HA 1.0 . 3.20 1162 608 A 14 LEU HG A 16 LEU HG 1.0 . 3.40 1163 609 A 15 VAL H A 14 LEU HD1% 1.0 . 3.20 1164 610 A 16 LEU HD2% A 14 LEU HD2% 1.0 . 3.30 1165 611 A 16 LEU H A 15 VAL HA 1.0 . 3.13 1166 612 A 17 LYS HA A 18 CYS H 1.0 . 3.22 1167 613 A 63 SER HA A 18 CYS H 1.0 . 3.72 1168 614 A 19 LYS H A 18 CYS HA 1.0 . 3.20 1169 615 A 20 GLY H A 19 LYS HA 1.0 . 3.17 1170 616 A 20 GLY H A 21 ALA H 1.0 . 3.86 1171 617 A 23 LYS H A 22 PRO HA 1.0 . 3.21 1172 618 A 23 LYS H A 24 LYS H 1.0 . 3.84 1173 619 A 29 LEU H A 28 ARG HA 1.0 . 3.19 1174 620 A 30 GLU H A 29 LEU HA 1.0 . 3.30 1175 621 A 29 LEU HA A 81 ALA HA 1.0 . 3.19 1176 622 A 30 GLU HA A 29 LEU HD1% 1.0 . 3.78 1177 623 A 33 LEU H A 42 LYS H 1.0 . 3.63 1178 624 A 34 ASN H A 33 LEU HA 1.0 . 3.25 1179 625 A 34 ASN HA A 35 THR H 1.0 . 3.14 1180 626 A 36 GLY H A 35 THR HA 1.0 . 3.27 1181 627 A 36 GLY H A 35 THR HB 1.0 . 3.69 1182 628 A 35 THR HB A 73 ASP HA 1.0 . 3.49 1183 629 A 38 THR HA A 39 GLU H 1.0 . 3.55 1184 630 A 41 TRP H A 40 ALA HA 1.0 . 3.17 1185 631 A 41 TRP H A 40 ALA HB% 1.0 . 3.95 1186 632 A 42 LYS H A 41 TRP HA 1.0 . 3.20 1187 633 A 43 VAL H A 42 LYS HA 1.0 . 3.28 1188 634 A 44 LEU H A 43 VAL HA 1.0 . 3.17 1189 635 A 45 SER H A 44 LEU HA 1.0 . 3.23 1190 636 A 47 GLN H A 46 PRO HA 1.0 . 3.32 1191 637 A 47 GLN H A 58 VAL HB 1.0 . 3.98 1192 638 A 48 GLY H A 49 GLY HA3 1.0 . 4.87 1193 639 A 48 GLY H A 49 GLY HA2 1.0 . 4.87 1194 640 A 49 GLY H A 57 ARG HA 1.0 . 4.86 1195 641 A 54 SER H A 51 PRO HBy 1.0 . 5.39 1196 642 A 54 SER H A 51 PRO HBx 1.0 . 5.39 1197 643 A 52 TRP HA A 53 ASP HA 1.0 . 4.71 1198 644 A 54 SER H A 52 TRP HA 1.0 . 3.86 1199 645 A 54 SER H A 53 ASP H 1.0 . 3.88 1200 646 A 55 VAL HA A 54 SER HA 1.0 . 5.13 1201 647 A 55 VAL HG2% A 56 ALA H 1.0 . 3.90 1202 648 A 55 VAL HG2% A 56 ALA H 1.0 . 2.83 1203 649 A 57 ARG H A 56 ALA HA 1.0 . 3.11 1204 650 A 56 ALA HA A 66 LEU HA 1.0 . 3.67 1205 651 A 57 ARG H A 65 PHE H 1.0 . 3.60 1206 652 A 58 VAL H A 57 ARG HA 1.0 . 3.30 1207 653 A 59 LEU H A 58 VAL HA 1.0 . 3.11 1208 654 A 64 LEU HA A 58 VAL HA 1.0 . 3.62 1209 655 A 58 VAL HA A 64 LEU HD1% 1.0 . 3.81 1210 656 A 59 LEU HD2% A 65 PHE HBy 1.0 . 3.99 1211 657 A 59 LEU HD2% A 65 PHE HBx 1.0 . 3.99 1212 658 A 63 SER HA A 64 LEU H 1.0 . 3.29 1213 659 A 64 LEU HG A 66 LEU HD1% 1.0 . 3.91 1214 660 A 65 PHE H A 64 LEU HD1% 1.0 . 3.49 1215 661 A 64 LEU HD2% A 66 LEU HD1% 1.0 . 3.77 1216 662 A 65 PHE HA A 66 LEU H 1.0 . 3.18 1217 663 A 66 LEU HD2% A 69 VAL HG1% 1.0 . 3.03 1218 664 A 69 VAL HA A 70 GLY H 1.0 . 3.21 1219 665 A 69 VAL HB A 70 GLY H 1.0 . 3.67 1220 666 A 69 VAL HB A 97 VAL HG1% 1.0 . 3.84 1221 667 A 71 ILE H A 72 GLN H 1.0 . 3.90 1222 668 A 74 GLU HA A 75 GLY H 1.0 . 3.20 1223 669 A 75 GLY H A 95 VAL H 1.0 . 3.86 1224 670 A 76 ILE HA A 77 PHE H 1.0 . 3.14 1225 671 A 78 ARG H A 77 PHE HA 1.0 . 3.14 1226 672 A 79 CYS H A 78 ARG HA 1.0 . 3.18 1227 673 A 79 CYS H A 91 SER H 1.0 . 3.77 1228 674 A 79 CYS HA A 80 GLN H 1.0 . 3.19 1229 675 A 89 THR H A 81 ALA H 1.0 . 3.81 1230 676 A 82 MET H A 81 ALA HA 1.0 . 3.18 1231 677 A 82 MET HA A 83 ASN H 1.0 . 3.09 1232 678 A 82 MET HA A 88 GLU HA 1.0 . 3.46 1233 679 A 88 GLU HA A 82 MET HE1 1.0 . 3.64 1234 680 A 88 GLU HA A 83 ASN H 1.0 . 3.87 1235 681 A 87 LYS H A 86 GLY H 1.0 . 4.57 1236 682 A 88 GLU H A 87 LYS HA 1.0 . 3.48 1237 683 A 89 THR H A 88 GLU HA 1.0 . 3.17 1238 684 A 90 LYS H A 89 THR HA 1.0 . 3.18 1239 685 A 90 LYS HA A 91 SER H 1.0 . 3.23 1240 686 A 91 SER HA A 92 ASN H 1.0 . 2.52 1241 687 A 92 ASN H A 91 SER HB3 1.0 . 4.25 1242 688 A 93 TYR H A 92 ASN HA 1.0 . 3.22 1243 689 A 94 ARG H A 93 TYR HA 1.0 . 3.18 1244 690 A 95 VAL H A 94 ARG HA 1.0 . 3.08 1245 691 A 96 ARG H A 95 VAL HA 1.0 . 3.13 1246 692 A 95 VAL HG1% A 97 VAL HG1% 1.0 . 3.95 1247 693 A 97 VAL H A 96 ARG HA 1.0 . 3.49 1248 694 A 99 GLN H A 98 TYR HA 1.0 . 4.27 1249 695 A 100 ILE H A 99 GLN HA 1.0 . 3.20 1250 696 A 58 VAL H A 57 ARG HB2 1.0 . 3.76 1251 696 A 58 VAL H A 57 ARG HB3 1.0 . 3.76 1252 697 A 97 VAL H A 96 ARG H 1.0 . 4.37 1253 698 A 89 THR H A 88 GLU HB2 1.0 . 3.61 1254 698 A 89 THR H A 88 GLU HB3 1.0 . 3.61 1255 699 A 40 ALA H A 39 GLU H 1.0 . 3.50 1256 700 A 100 ILE H A 99 GLN H 1.0 . 5.30 1257 701 A 98 TYR H A 9 ARG H 1.0 . 5.15 1258 702 A 9 ARG H A 8 ALA HA 1.0 . 2.97 1259 703 A 56 ALA HB% A 56 ALA H 1.0 . 3.31 1260 704 A 10 ILE H A 12 GLU H 1.0 . 5.33 1261 705 A 10 ILE H A 99 GLN H 1.0 . 5.04 1262 706 A 43 VAL H A 42 LYS HB2 1.0 . 4.06 1263 706 A 43 VAL H A 42 LYS HB3 1.0 . 4.06 1264 707 A 37 ARG H A 38 THR H 1.0 . 3.15 1265 708 A 38 THR H A 37 ARG HB2 1.0 . 3.97 1266 708 A 38 THR H A 37 ARG HB3 1.0 . 3.97 1267 709 A 88 GLU H A 88 GLU HB2 1.0 . 3.57 1268 709 A 88 GLU H A 88 GLU HB3 1.0 . 3.57 1269 710 A 8 ALA H A 7 THR HA 1.0 . 3.23 1270 711 A 75 GLY H A 76 ILE H 1.0 . 4.65 1271 712 A 17 LYS H A 17 LYS HB2 1.0 . 3.45 1272 712 A 17 LYS H A 17 LYS HB3 1.0 . 3.45 1273 713 A 91 SER HB2 A 92 ASN H 1.0 . 4.25 1274 714 A 73 ASP H A 72 GLN H 1.0 . 3.70 1275 715 A 62 GLY H A 61 ASN H 1.0 . 3.80 1276 716 A 97 VAL HA A 98 TYR H 1.0 . 3.42 1277 717 A 98 TYR H A 98 TYR HB2 1.0 . 3.77 1278 717 A 98 TYR HB3 A 98 TYR H 1.0 . 3.77 1279 718 A 97 VAL HB A 98 TYR H 1.0 . 3.42 1280 719 A 41 TRP H A 40 ALA HB% 1.0 . 3.59 1281 720 A 55 VAL HB A 56 ALA H 1.0 . 2.73 1282 721 A 93 TYR H A 92 ASN H 1.0 . 4.28 1283 722 A 102 GLY H A 102 GLY HA2 1.0 . 2.76 1284 722 A 102 GLY H A 102 GLY HA3 1.0 . 2.76 1285 723 A 55 VAL H A 56 ALA H 1.0 . 4.62 1286 724 A 15 VAL H A 15 VAL HB 1.0 . 3.73 1287 725 A 69 VAL H A 68 ALA HA 1.0 . 3.19 1288 726 A 69 VAL H A 69 VAL HB 1.0 . 3.73 1289 727 A 62 GLY H A 63 SER H 1.0 . 3.67 1290 728 A 73 ASP H A 74 GLU H 1.0 . 3.42 1291 729 A 10 ILE H A 9 ARG HBy 1.0 . 3.26 1292 729 A 10 ILE H A 9 ARG HBx 1.0 . 3.26 1293 730 A 98 TYR H A 9 ARG HBy 1.0 . 5.34 1294 730 A 98 TYR H A 9 ARG HBx 1.0 . 5.34 1295 731 A 52 TRP H A 51 PRO HBy 1.0 . 3.72 1296 731 A 52 TRP H A 51 PRO HBx 1.0 . 3.72 1297 732 A 72 GLN H A 73 ASP HBy 1.0 . 4.11 1298 732 A 72 GLN H A 73 ASP HBx 1.0 . 4.11 1299 733 A 73 ASP H A 74 GLU HBy 1.0 . 4.96 1300 733 A 73 ASP H A 74 GLU HBx 1.0 . 4.96 1301 734 A 4 GLN H A 92 ASN O 1.0 . 2.06 1302 735 A 6 ILE H A 94 ARG O 1.0 . 1.96 1303 736 A 8 ALA H A 96 ARG O 1.0 . 2.03 1304 737 A 11 GLY H A 69 VAL O 1.0 . 1.93 1305 738 A 12 GLU H A 9 ARG O 1.0 . 2.38 1306 739 A 14 LEU H A 66 LEU O 1.0 . 2.20 1307 740 A 16 LEU H A 64 LEU O 1.0 . 1.93 1308 741 A 19 LYS H A 91 SER OG 1.0 . 2.15 1309 742 A 21 ALA H A 18 CYS O 1.0 . 2.26 1310 743 A 30 GLU H A 80 GLN O 1.0 . 2.54 1311 744 A 31 TRP H A 44 LEU O 1.0 . 2.32 1312 745 A 32 LYS H A 78 ARG O 1.0 . 2.30 1313 746 A 33 LEU H A 42 LYS O 1.0 . 2.30 1314 747 A 34 ASN H A 76 ILE O 1.0 . 1.89 1315 748 A 36 GLY H A 74 GLU O 1.0 . 2.06 1316 749 A 42 LYS H A 33 LEU O 1.0 . 1.98 1317 750 A 44 LEU H A 31 TRP O 1.0 . 2.00 1318 751 A 57 ARG H A 65 PHE O 1.0 . 1.97 1319 752 A 59 LEU H A 63 SER O 1.0 . 1.84 1320 753 A 62 GLY H A 59 LEU O 1.0 . 2.13 1321 754 A 64 LEU H A 16 LEU O 1.0 . 1.87 1322 755 A 65 PHE H A 57 ARG O 1.0 . 1.87 1323 756 A 66 LEU H A 14 LEU O 1.0 . 1.89 1324 757 A 69 VAL H A 12 GLU O 1.0 . 1.98 1325 758 A 73 ASP H A 70 GLY O 1.0 . 1.89 1326 759 A 74 GLU H A 71 ILE O 1.0 . 2.28 1327 760 A 76 ILE H A 34 ASN O 1.0 . 1.86 1328 761 A 77 PHE H A 93 TYR O 1.0 . 1.97 1329 762 A 78 ARG H A 32 LYS O 1.0 . 1.97 1330 763 A 79 CYS H A 91 SER O 1.0 . 2.00 1331 764 A 80 GLN H A 30 GLU O 1.0 . 2.35 1332 765 A 81 ALA H A 89 THR O 1.0 . 2.03 1333 766 A 83 ASN H A 87 LYS O 1.0 . 1.95 1334 767 A 89 THR H A 81 ALA O 1.0 . 1.95 1335 768 A 91 SER H A 79 CYS O 1.0 . 2.00 1336 769 A 93 TYR H A 77 PHE O 1.0 . 1.68 1337 770 A 94 ARG H A 4 GLN O 1.0 . 1.99 1338 771 A 95 VAL H A 75 GLY O 1.0 . 1.99 1339 772 A 96 ARG H A 6 ILE O 1.0 . 1.98 1340 773 A 18 CYS SG A 79 CYS SG 1.0 . 2.10 1341 774 A 79 CYS SG A 18 CYS CB 1.0 . 3.10 1342 775 A 18 CYS SG A 79 CYS CB 1.0 . 3.10 1343 776 A 93 TYR HA A 4 GLN HB2 1.0 . 3.67 1344 776 A 4 GLN HB3 A 93 TYR HA 1.0 . 3.67 1345 777 A 6 ILE HD11 A 4 GLN HG2 1.0 . 3.85 1346 777 A 4 GLN HG3 A 6 ILE HD11 1.0 . 3.85 1347 778 A 6 ILE HD11 A 4 GLN HE2y 1.0 . 3.19 1348 778 A 6 ILE HD11 A 4 GLN HE2x 1.0 . 3.19 1349 779 A 6 ILE HD11 A 4 GLN HE2x 1.0 . 3.86 1350 779 A 6 ILE HD11 A 4 GLN HE2y 1.0 . 3.86 1351 780 A 16 LEU HD2% A 6 ILE HG1x 1.0 . 3.51 1352 780 A 16 LEU HD2% A 6 ILE HG1y 1.0 . 3.51 1353 781 A 9 ARG HBx A 12 GLU HB2 1.0 . 3.79 1354 781 A 9 ARG HBy A 12 GLU HB2 1.0 . 3.79 1355 781 A 12 GLU HB3 A 9 ARG HBy 1.0 . 3.79 1356 781 A 12 GLU HB3 A 9 ARG HBx 1.0 . 3.79 1357 782 A 9 ARG HBy A 12 GLU HG2 1.0 . 3.05 1358 782 A 9 ARG HBx A 12 GLU HG2 1.0 . 3.05 1359 782 A 12 GLU HG3 A 9 ARG HBy 1.0 . 3.05 1360 782 A 12 GLU HG3 A 9 ARG HBx 1.0 . 3.05 1361 783 A 10 ILE H A 9 ARG HG2 1.0 . 3.63 1362 783 A 10 ILE H A 9 ARG HG3 1.0 . 3.63 1363 784 A 9 ARG HD3 A 12 GLU HG2 1.0 . 3.28 1364 784 A 9 ARG HD2 A 12 GLU HG2 1.0 . 3.28 1365 784 A 12 GLU HG3 A 9 ARG HD2 1.0 . 3.28 1366 784 A 12 GLU HG3 A 9 ARG HD3 1.0 . 3.28 1367 785 A 10 ILE H A 99 GLN HBy 1.0 . 5.45 1368 785 A 10 ILE H A 99 GLN HBx 1.0 . 5.45 1369 786 A 10 ILE HD1% A 99 GLN HBy 1.0 . 3.51 1370 786 A 10 ILE HD1% A 99 GLN HBx 1.0 . 3.51 1371 787 A 68 ALA HB% A 11 GLY HAx 1.0 . 3.65 1372 787 A 68 ALA HB% A 11 GLY HAy 1.0 . 3.65 1373 788 A 12 GLU HA A 13 PRO HDx 1.0 . 3.08 1374 788 A 12 GLU HA A 13 PRO HDy 1.0 . 3.08 1375 789 A 12 GLU HB3 A 13 PRO HDx 1.0 . 3.10 1376 789 A 13 PRO HDy A 12 GLU HB2 1.0 . 3.10 1377 789 A 12 GLU HB3 A 13 PRO HDy 1.0 . 3.10 1378 789 A 12 GLU HB2 A 13 PRO HDx 1.0 . 3.10 1379 790 A 14 LEU H A 66 LEU HB2 1.0 . 3.81 1380 790 A 14 LEU H A 66 LEU HB3 1.0 . 3.81 1381 791 A 14 LEU HBy A 69 VAL HG1% 1.0 . 3.32 1382 791 A 14 LEU HBx A 69 VAL HG1% 1.0 . 3.32 1383 792 A 15 VAL HG1% A 63 SER HB2 1.0 . 3.38 1384 792 A 63 SER HB3 A 15 VAL HG1% 1.0 . 3.38 1385 793 A 15 VAL HG1% A 63 SER HB2 1.0 . 3.29 1386 793 A 63 SER HB3 A 15 VAL HG1% 1.0 . 3.29 1387 794 A 64 LEU H A 16 LEU HB2 1.0 . 3.88 1388 794 A 16 LEU HB3 A 64 LEU H 1.0 . 3.88 1389 795 A 16 LEU HB2 A 64 LEU HB2 1.0 . 3.04 1390 795 A 16 LEU HB3 A 64 LEU HB2 1.0 . 3.04 1391 795 A 64 LEU HB3 A 16 LEU HB2 1.0 . 3.04 1392 795 A 16 LEU HB3 A 64 LEU HB3 1.0 . 3.04 1393 796 A 16 LEU HD1% A 77 PHE HB2 1.0 . 3.36 1394 796 A 77 PHE HB3 A 16 LEU HD1% 1.0 . 3.36 1395 797 A 63 SER HG A 17 LYS HG2 1.0 . 3.81 1396 797 A 17 LYS HG3 A 63 SER HG 1.0 . 3.81 1397 798 A 21 ALA HB% A 18 CYS HBx 1.0 . 3.55 1398 798 A 21 ALA HB% A 18 CYS HBy 1.0 . 3.55 1399 799 A 20 GLY HAy A 83 ASN HD22 1.0 . 3.00 1400 799 A 20 GLY HAx A 83 ASN HD22 1.0 . 3.00 1401 799 A 83 ASN HD21 A 20 GLY HAy 1.0 . 3.00 1402 799 A 20 GLY HAx A 83 ASN HD21 1.0 . 3.00 1403 800 A 30 GLU H A 29 LEU HB2 1.0 . 3.55 1404 800 A 29 LEU HB3 A 30 GLU H 1.0 . 3.55 1405 801 A 81 ALA HA A 29 LEU HB2 1.0 . 3.74 1406 801 A 29 LEU HB3 A 81 ALA HA 1.0 . 3.74 1407 802 A 62 GLY HA3 A 29 LEU HD2% 1.0 . 3.00 1408 802 A 29 LEU HD2% A 62 GLY HA2 1.0 . 3.00 1409 803 A 30 GLU HG2 A 43 VAL HG1% 1.0 . 3.43 1410 803 A 30 GLU HG3 A 43 VAL HG1% 1.0 . 3.43 1411 804 A 32 LYS HB2 A 78 ARG HB2 1.0 . 3.78 1412 804 A 78 ARG HB3 A 32 LYS HB2 1.0 . 3.78 1413 804 A 32 LYS HB3 A 78 ARG HB3 1.0 . 3.78 1414 804 A 32 LYS HB3 A 78 ARG HB2 1.0 . 3.78 1415 805 A 33 LEU HB3 A 42 LYS HE2 1.0 . 3.23 1416 805 A 42 LYS HE3 A 33 LEU HB2 1.0 . 3.23 1417 805 A 33 LEU HB3 A 42 LYS HE3 1.0 . 3.23 1418 805 A 33 LEU HB2 A 42 LYS HE2 1.0 . 3.23 1419 806 A 76 ILE HB A 34 ASN HB2 1.0 . 3.54 1420 806 A 34 ASN HB3 A 76 ILE HB 1.0 . 3.54 1421 807 A 41 TRP HA A 34 ASN HD22 1.0 . 3.81 1422 807 A 41 TRP HA A 34 ASN HD21 1.0 . 3.81 1423 808 A 35 THR HA A 75 GLY HAy 1.0 . 3.23 1424 808 A 35 THR HA A 75 GLY HAx 1.0 . 3.23 1425 809 A 35 THR HB A 75 GLY HAy 1.0 . 3.51 1426 809 A 35 THR HB A 75 GLY HAx 1.0 . 3.51 1427 810 A 35 THR HG1 A 42 LYS HE2 1.0 . 4.79 1428 810 A 42 LYS HE3 A 35 THR HG1 1.0 . 4.79 1429 811 A 36 GLY H A 74 GLU HBy 1.0 . 4.56 1430 811 A 36 GLY H A 74 GLU HBx 1.0 . 4.56 1431 812 A 36 GLY H A 75 GLY HAy 1.0 . 4.10 1432 812 A 36 GLY H A 75 GLY HAx 1.0 . 4.10 1433 813 A 37 ARG H A 36 GLY HA2 1.0 . 2.95 1434 813 A 37 ARG H A 36 GLY HA3 1.0 . 2.95 1435 814 A 45 SER H A 44 LEU HB2 1.0 . 3.68 1436 814 A 44 LEU HB3 A 45 SER H 1.0 . 3.68 1437 815 A 44 LEU HB3 A 58 VAL HG2% 1.0 . 3.54 1438 815 A 58 VAL HG2% A 44 LEU HB2 1.0 . 3.54 1439 816 A 47 GLN H A 48 GLY HA2 1.0 . 4.43 1440 816 A 47 GLN H A 48 GLY HA3 1.0 . 4.43 1441 817 A 48 GLY H A 49 GLY HA2 1.0 . 4.35 1442 817 A 48 GLY H A 49 GLY HA3 1.0 . 4.35 1443 818 A 48 GLY H A 57 ARG HB2 1.0 . 4.93 1444 818 A 48 GLY H A 57 ARG HB3 1.0 . 4.93 1445 819 A 48 GLY HA2 A 49 GLY HA2 1.0 . 4.29 1446 819 A 48 GLY HA3 A 49 GLY HA2 1.0 . 4.29 1447 819 A 49 GLY HA3 A 48 GLY HA2 1.0 . 4.29 1448 819 A 48 GLY HA3 A 49 GLY HA3 1.0 . 4.29 1449 820 A 58 VAL H A 48 GLY HA2 1.0 . 3.45 1450 820 A 58 VAL H A 48 GLY HA3 1.0 . 3.45 1451 821 A 49 GLY HA2 A 50 GLY HA2 1.0 . 3.63 1452 821 A 49 GLY HA3 A 50 GLY HA2 1.0 . 3.63 1453 821 A 50 GLY HA3 A 49 GLY HA2 1.0 . 3.63 1454 821 A 49 GLY HA3 A 50 GLY HA3 1.0 . 3.63 1455 822 A 51 PRO HA A 50 GLY HA2 1.0 . 4.57 1456 822 A 51 PRO HA A 50 GLY HA3 1.0 . 4.57 1457 823 A 52 TRP H A 51 PRO HBy 1.0 . 4.12 1458 823 A 52 TRP H A 51 PRO HBx 1.0 . 4.12 1459 824 A 52 TRP HA A 51 PRO HBy 1.0 . 4.73 1460 824 A 52 TRP HA A 51 PRO HBx 1.0 . 4.73 1461 825 A 54 SER H A 51 PRO HBy 1.0 . 4.54 1462 825 A 54 SER H A 51 PRO HBx 1.0 . 4.54 1463 826 A 53 ASP HA A 52 TRP HBy 1.0 . 4.62 1464 826 A 53 ASP HA A 52 TRP HBx 1.0 . 4.62 1465 827 A 55 VAL HA A 54 SER HB2 1.0 . 4.07 1466 827 A 54 SER HB3 A 55 VAL HA 1.0 . 4.07 1467 828 A 54 SER HB3 A 55 VAL HG1% 1.0 . 3.21 1468 828 A 54 SER HB2 A 55 VAL HG1% 1.0 . 3.21 1469 829 A 54 SER HB2 A 55 VAL HG1% 1.0 . 3.90 1470 829 A 54 SER HB3 A 55 VAL HG1% 1.0 . 3.90 1471 830 A 58 VAL H A 57 ARG HB2 1.0 . 3.76 1472 830 A 58 VAL H A 57 ARG HB3 1.0 . 3.76 1473 831 A 57 ARG HB2 A 65 PHE HBx 1.0 . 5.42 1474 831 A 57 ARG HB3 A 65 PHE HBx 1.0 . 5.42 1475 831 A 65 PHE HBy A 57 ARG HB2 1.0 . 5.42 1476 831 A 57 ARG HB3 A 65 PHE HBy 1.0 . 5.42 1477 832 A 62 GLY HA3 A 58 VAL HG1% 1.0 . 3.84 1478 832 A 58 VAL HG1% A 62 GLY HA2 1.0 . 3.84 1479 833 A 58 VAL HG1% A 62 GLY HA2 1.0 . 3.64 1480 833 A 62 GLY HA3 A 58 VAL HG1% 1.0 . 3.64 1481 834 A 59 LEU HA A 60 PRO HBy 1.0 . 5.23 1482 834 A 59 LEU HA A 60 PRO HBx 1.0 . 5.23 1483 835 A 61 ASN H A 59 LEU HB2 1.0 . 3.92 1484 835 A 59 LEU HB3 A 61 ASN H 1.0 . 3.92 1485 836 A 63 SER H A 59 LEU HB2 1.0 . 3.78 1486 836 A 59 LEU HB3 A 63 SER H 1.0 . 3.78 1487 837 A 59 LEU HB3 A 63 SER HB2 1.0 . 3.60 1488 837 A 59 LEU HB2 A 63 SER HB2 1.0 . 3.60 1489 837 A 63 SER HB3 A 59 LEU HB2 1.0 . 3.60 1490 837 A 63 SER HB3 A 59 LEU HB3 1.0 . 3.60 1491 838 A 59 LEU HG A 65 PHE HBx 1.0 . 3.12 1492 838 A 59 LEU HG A 65 PHE HBy 1.0 . 3.12 1493 839 A 59 LEU HD1% A 65 PHE HBx 1.0 . 3.37 1494 839 A 65 PHE HBy A 59 LEU HD1% 1.0 . 3.37 1495 840 A 59 LEU HD1% A 63 SER HB2 1.0 . 3.17 1496 840 A 63 SER HB3 A 59 LEU HD1% 1.0 . 3.17 1497 841 A 59 LEU HD2% A 65 PHE HBx 1.0 . 3.20 1498 841 A 59 LEU HD2% A 65 PHE HBy 1.0 . 3.20 1499 842 A 61 ASN H A 60 PRO HBy 1.0 . 3.54 1500 842 A 61 ASN H A 60 PRO HBx 1.0 . 3.54 1501 843 A 60 PRO HBx A 61 ASN HBx 1.0 . 4.76 1502 843 A 60 PRO HBy A 61 ASN HBx 1.0 . 4.76 1503 843 A 61 ASN HBy A 60 PRO HBy 1.0 . 4.76 1504 843 A 61 ASN HBy A 60 PRO HBx 1.0 . 4.76 1505 844 A 63 SER HG A 61 ASN HD22 1.0 . 3.60 1506 844 A 61 ASN HD21 A 63 SER HG 1.0 . 3.60 1507 845 A 64 LEU H A 63 SER HB2 1.0 . 3.70 1508 845 A 63 SER HB3 A 64 LEU H 1.0 . 3.70 1509 846 A 66 LEU HB3 A 69 VAL HG1% 1.0 . 3.50 1510 846 A 66 LEU HB2 A 69 VAL HG1% 1.0 . 3.50 1511 847 A 66 LEU HD2% A 73 ASP HBy 1.0 . 3.78 1512 847 A 66 LEU HD2% A 73 ASP HBx 1.0 . 3.78 1513 848 A 68 ALA H A 67 PRO HBy 1.0 . 3.74 1514 848 A 68 ALA H A 67 PRO HBx 1.0 . 3.74 1515 849 A 68 ALA HB% A 67 PRO HBy 1.0 . 3.84 1516 849 A 68 ALA HB% A 67 PRO HBx 1.0 . 3.84 1517 850 A 69 VAL HB A 73 ASP HBy 1.0 . 3.86 1518 850 A 69 VAL HB A 73 ASP HBx 1.0 . 3.86 1519 851 A 70 GLY H A 73 ASP HBy 1.0 . 3.52 1520 851 A 73 ASP HBx A 70 GLY H 1.0 . 3.52 1521 852 A 71 ILE HA A 74 GLU HG2 1.0 . 3.86 1522 852 A 71 ILE HA A 74 GLU HG3 1.0 . 3.86 1523 853 A 74 GLU H A 74 GLU HBy 1.0 . 2.85 1524 853 A 74 GLU H A 74 GLU HBx 1.0 . 2.85 1525 854 A 74 GLU HA A 75 GLY HAy 1.0 . 5.34 1526 854 A 74 GLU HA A 75 GLY HAx 1.0 . 5.34 1527 855 A 75 GLY H A 74 GLU HBy 1.0 . 3.80 1528 855 A 75 GLY H A 74 GLU HBx 1.0 . 3.80 1529 856 A 74 GLU HBy A 75 GLY HAy 1.0 . 4.65 1530 856 A 74 GLU HBx A 75 GLY HAy 1.0 . 4.65 1531 856 A 75 GLY HAx A 74 GLU HBy 1.0 . 4.65 1532 856 A 74 GLU HBx A 75 GLY HAx 1.0 . 4.65 1533 857 A 74 GLU HBy A 95 VAL HG1% 1.0 . 4.81 1534 857 A 74 GLU HBx A 95 VAL HG1% 1.0 . 4.81 1535 857 A 95 VAL HG2% A 74 GLU HBy 1.0 . 4.81 1536 857 A 95 VAL HG2% A 74 GLU HBx 1.0 . 4.81 1537 858 A 96 ARG HA A 74 GLU HBy 1.0 . 4.26 1538 858 A 96 ARG HA A 74 GLU HBx 1.0 . 4.26 1539 859 A 74 GLU HBy A 96 ARG HB2 1.0 . 5.34 1540 859 A 74 GLU HBx A 96 ARG HB2 1.0 . 5.34 1541 859 A 96 ARG HB3 A 74 GLU HBy 1.0 . 5.34 1542 859 A 96 ARG HB3 A 74 GLU HBx 1.0 . 5.34 1543 860 A 74 GLU HBy A 96 ARG HD2 1.0 . 3.98 1544 860 A 74 GLU HBx A 96 ARG HD2 1.0 . 3.98 1545 860 A 96 ARG HD3 A 74 GLU HBy 1.0 . 3.98 1546 860 A 96 ARG HD3 A 74 GLU HBx 1.0 . 3.98 1547 861 A 76 ILE HA A 75 GLY HAy 1.0 . 4.03 1548 861 A 76 ILE HA A 75 GLY HAx 1.0 . 4.03 1549 862 A 76 ILE HG2% A 75 GLY HAy 1.0 . 5.20 1550 862 A 76 ILE HG2% A 75 GLY HAx 1.0 . 5.20 1551 863 A 75 GLY HAx A 76 ILE HG12 1.0 . 3.98 1552 863 A 75 GLY HAy A 76 ILE HG12 1.0 . 3.98 1553 863 A 76 ILE HG13 A 75 GLY HAy 1.0 . 3.98 1554 863 A 76 ILE HG13 A 75 GLY HAx 1.0 . 3.98 1555 864 A 76 ILE HD1% A 75 GLY HAy 1.0 . 4.29 1556 864 A 76 ILE HD1% A 75 GLY HAx 1.0 . 4.29 1557 865 A 76 ILE HG2% A 78 ARG HG3 1.0 . 3.89 1558 865 A 76 ILE HG2% A 78 ARG HG2 1.0 . 3.89 1559 866 A 92 ASN HD21 A 76 ILE HG2% 1.0 . 3.27 1560 866 A 92 ASN HD22 A 76 ILE HG2% 1.0 . 3.27 1561 867 A 77 PHE HB2 A 93 TYR HB2 1.0 . 2.97 1562 867 A 77 PHE HB3 A 93 TYR HB2 1.0 . 2.97 1563 867 A 93 TYR HB3 A 77 PHE HB2 1.0 . 2.97 1564 867 A 93 TYR HB3 A 77 PHE HB3 1.0 . 2.97 1565 868 A 92 ASN HD21 A 78 ARG HG2 1.0 . 3.60 1566 868 A 92 ASN HD21 A 78 ARG HG3 1.0 . 3.60 1567 868 A 92 ASN HD22 A 78 ARG HG2 1.0 . 3.60 1568 868 A 92 ASN HD22 A 78 ARG HG3 1.0 . 3.60 1569 869 A 79 CYS H A 91 SER HB3 1.0 . 3.44 1570 869 A 79 CYS H A 91 SER HB2 1.0 . 3.44 1571 870 A 79 CYS HB3 A 91 SER HB3 1.0 . 3.06 1572 870 A 79 CYS HB2 A 91 SER HB3 1.0 . 3.06 1573 870 A 91 SER HB2 A 79 CYS HB2 1.0 . 3.06 1574 870 A 91 SER HB2 A 79 CYS HB3 1.0 . 3.06 1575 871 A 91 SER HG A 79 CYS HB2 1.0 . 3.91 1576 871 A 79 CYS HB3 A 91 SER HG 1.0 . 3.91 1577 872 A 86 GLY H A 83 ASN HB2 1.0 . 3.87 1578 872 A 83 ASN HB3 A 86 GLY H 1.0 . 3.87 1579 873 A 89 THR HG1 A 83 ASN HD22 1.0 . 3.10 1580 873 A 83 ASN HD21 A 89 THR HG1 1.0 . 3.10 1581 874 A 85 ASN HA A 85 ASN HD22 1.0 . 3.68 1582 874 A 85 ASN HA A 85 ASN HD21 1.0 . 3.68 1583 875 A 85 ASN HBy A 86 GLY HA2 1.0 . 5.44 1584 875 A 85 ASN HBx A 86 GLY HA2 1.0 . 5.44 1585 875 A 86 GLY HA3 A 85 ASN HBy 1.0 . 5.44 1586 875 A 86 GLY HA3 A 85 ASN HBx 1.0 . 5.44 1587 876 A 88 GLU H A 87 LYS HB2 1.0 . 2.86 1588 876 A 88 GLU H A 87 LYS HB3 1.0 . 2.86 1589 877 A 89 THR H A 88 GLU HG2 1.0 . 3.41 1590 877 A 89 THR H A 88 GLU HG3 1.0 . 3.41 1591 878 A 92 ASN H A 91 SER HB3 1.0 . 3.62 1592 878 A 91 SER HB2 A 92 ASN H 1.0 . 3.62 1593 879 A 93 TYR HEy A 91 SER HB3 1.0 . 3.59 1594 879 A 91 SER HB2 A 93 TYR HEy 1.0 . 3.59 1595 880 A 93 TYR H A 92 ASN HD21 1.0 . 3.31 1596 880 A 93 TYR H A 92 ASN HD22 1.0 . 3.31 1597 881 A 94 ARG H A 93 TYR HB2 1.0 . 3.84 1598 881 A 93 TYR HB3 A 94 ARG H 1.0 . 3.84 1599 882 A 95 VAL HG2% A 93 TYR HB3 1.0 . 3.80 1600 882 A 95 VAL HG2% A 93 TYR HB2 1.0 . 3.80 1601 883 A 95 VAL H A 94 ARG HGy 1.0 . 4.77 1602 883 A 95 VAL H A 94 ARG HGx 1.0 . 4.77 1603 884 A 97 VAL H A 96 ARG HB2 1.0 . 3.47 1604 884 A 97 VAL H A 96 ARG HB3 1.0 . 3.47 1605 885 A 98 TYR HA A 99 GLN HBy 1.0 . 5.41 1606 885 A 98 TYR HA A 99 GLN HBx 1.0 . 5.41 1607 886 A 99 GLN H A 98 TYR HB2 1.0 . 4.68 1608 886 A 98 TYR HB3 A 99 GLN H 1.0 . 4.68 1609 887 A 98 TYR HB2 A 99 GLN HBy 1.0 . 5.60 1610 887 A 98 TYR HB3 A 99 GLN HBy 1.0 . 5.60 1611 887 A 99 GLN HBx A 98 TYR HB2 1.0 . 5.60 1612 887 A 98 TYR HB3 A 99 GLN HBx 1.0 . 5.60 1613 888 A 99 GLN H A 99 GLN HBy 1.0 . 3.65 1614 888 A 99 GLN H A 99 GLN HBx 1.0 . 3.65 1615 889 A 99 GLN HA A 99 GLN HE21 1.0 . 2.79 1616 889 A 99 GLN HA A 99 GLN HE22 1.0 . 2.79 1617 890 A 99 GLN HE21 A 99 GLN HBy 1.0 . 3.59 1618 890 A 99 GLN HE22 A 99 GLN HBy 1.0 . 3.59 1619 890 A 99 GLN HE22 A 99 GLN HBx 1.0 . 3.59 1620 890 A 99 GLN HE21 A 99 GLN HBx 1.0 . 3.59 1621 891 A 100 ILE H A 99 GLN HBy 1.0 . 4.36 1622 891 A 100 ILE H A 99 GLN HBx 1.0 . 4.36 1623 892 A 100 ILE HB A 99 GLN HBy 1.0 . 6.34 1624 892 A 100 ILE HB A 99 GLN HBx 1.0 . 6.34 1625 893 A 99 GLN HBx A 100 ILE HG1x 1.0 . 5.61 1626 893 A 99 GLN HBy A 100 ILE HG1x 1.0 . 5.61 1627 893 A 100 ILE HG1y A 99 GLN HBy 1.0 . 5.61 1628 893 A 100 ILE HG1y A 99 GLN HBx 1.0 . 5.61 1629 894 A 100 ILE HD1% A 99 GLN HBy 1.0 . 5.84 1630 894 A 100 ILE HD1% A 99 GLN HBx 1.0 . 5.84 1631 895 A 100 ILE H A 99 GLN HG2 1.0 . 3.56 1632 895 A 100 ILE H A 99 GLN HG3 1.0 . 3.56 1633 896 A 101 PRO HBx A 102 GLY HA2 1.0 . 4.18 1634 896 A 101 PRO HBy A 102 GLY HA2 1.0 . 4.18 1635 896 A 102 GLY HA3 A 101 PRO HBy 1.0 . 4.18 1636 896 A 102 GLY HA3 A 101 PRO HBx 1.0 . 4.18 stop_ save_