data_nef_c34211_6f55 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 _nef_nmr_meta_data.program_name . _nef_nmr_meta_data.program_version . _nef_nmr_meta_data.creation_date . _nef_nmr_meta_data.uuid . _nef_nmr_meta_data.coordinate_file_name . loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 6F55 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 LYS middle . . 3 A 3 VAL middle . . 4 A 4 PRO middle . false 5 A 5 GLY middle . false 6 A 6 VAL middle . . 7 A 7 ARG middle . . 8 A 8 VAL middle . . 9 A 9 ARG middle . . 10 A 10 ALA middle . . 11 A 11 LEU middle . . 12 A 12 TYR middle . . 13 A 13 ASP middle . . 14 A 14 TYR middle . . 15 A 15 THR middle . . 16 A 16 GLY middle . false 17 A 17 GLN middle . . 18 A 18 GLU middle . . 19 A 19 ALA middle . . 20 A 20 ASP middle . . 21 A 21 GLU middle . . 22 A 22 LEU middle . . 23 A 23 SER middle . . 24 A 24 PHE middle . . 25 A 25 LYS middle . . 26 A 26 ALA middle . . 27 A 27 GLY middle . false 28 A 28 GLU middle . . 29 A 29 GLU middle . . 30 A 30 LEU middle . . 31 A 31 MET middle . . 32 A 32 LYS middle . . 33 A 33 ILE middle . . 34 A 34 SER middle . . 35 A 35 GLU middle . . 36 A 36 GLU middle . . 37 A 37 ASP middle . . 38 A 38 GLU middle . . 39 A 39 GLN middle . . 40 A 40 GLY middle . false 41 A 41 TRP middle . . 42 A 42 CYS middle . . 43 A 43 LYS middle . . 44 A 44 GLY middle . false 45 A 45 ARG middle . . 46 A 46 LEU middle . . 47 A 47 LEU middle . . 48 A 48 THR middle . . 49 A 49 GLY middle . false 50 A 50 HIS middle . . 51 A 51 VAL middle . . 52 A 52 GLY middle . false 53 A 53 LEU middle . . 54 A 54 TYR middle . . 55 A 55 PRO middle . false 56 A 56 ALA middle . . 57 A 57 ASN middle . . 58 A 58 TYR middle . . 59 A 59 VAL middle . . 60 A 60 GLU middle . . 61 A 61 LYS middle . . 62 A 62 VAL middle . . 63 A 63 GLY middle . false 64 A 64 LEU middle . . 65 A 65 ALA middle . . 66 A 66 ALA middle . . 67 A 67 ALA end . . 68 B 101 THR start . . 69 B 102 LYS middle . . 70 B 103 GLY middle . false 71 B 104 PRO middle . false 72 B 105 ALA middle . . 73 B 106 PRO middle . false 74 B 107 ASN middle . . 75 B 108 PRO middle . true 76 B 109 PRO middle . false 77 B 110 PRO middle . false 78 B 111 ILE middle . . 79 B 112 LEU middle . . 80 B 113 LYS middle . . 81 B 114 VAL middle . . 82 B 115 TRP end . . stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_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 MET HE% H 1 2.111 0.000 A 1 MET CE C 13 16.878 0.000 A 2 LYS HA H 1 4.411 0.000 A 2 LYS HB2 H 1 1.776 0.000 A 2 LYS HB3 H 1 1.776 0.000 A 2 LYS HD2 H 1 1.680 0.000 A 2 LYS HD3 H 1 1.680 0.000 A 2 LYS HE2 H 1 2.992 0.000 A 2 LYS HE3 H 1 2.992 0.000 A 2 LYS HGx H 1 1.376 0.000 A 2 LYS HGy H 1 1.422 0.000 A 2 LYS CA C 13 56.461 0.000 A 2 LYS CB C 13 33.007 0.000 A 2 LYS CD C 13 29.039 0.000 A 2 LYS CE C 13 42.053 0.000 A 2 LYS CG C 13 24.705 0.000 A 3 VAL H H 1 8.283 0.000 A 3 VAL HA H 1 4.445 0.000 A 3 VAL HB H 1 2.107 0.000 A 3 VAL HGx% H 1 0.965 0.000 A 3 VAL HGy% H 1 0.974 0.000 A 3 VAL CA C 13 59.780 0.000 A 3 VAL CB C 13 32.697 0.000 A 3 VAL CG1 C 13 20.394 0.000 A 3 VAL CG2 C 13 20.945 0.000 A 3 VAL N N 15 123.238 0.000 A 4 PRO HA H 1 4.426 0.000 A 4 PRO HBx H 1 1.959 0.000 A 4 PRO HBy H 1 2.320 0.000 A 4 PRO HDx H 1 3.756 0.000 A 4 PRO HDy H 1 3.872 0.000 A 4 PRO HGy H 1 2.069 0.000 A 4 PRO HGx H 1 2.011 0.000 A 4 PRO CA C 13 63.679 0.000 A 4 PRO CB C 13 32.294 0.000 A 4 PRO CD C 13 51.002 0.000 A 4 PRO CG C 13 27.400 0.000 A 5 GLY H H 1 8.042 0.000 A 5 GLY HAx H 1 3.960 0.000 A 5 GLY HAy H 1 4.153 0.000 A 5 GLY CA C 13 45.052 0.000 A 5 GLY N N 15 106.257 0.000 A 6 VAL H H 1 8.287 0.000 A 6 VAL HA H 1 4.393 0.000 A 6 VAL HB H 1 1.988 0.000 A 6 VAL HG1% H 1 1.000 0.000 A 6 VAL HG2% H 1 1.000 0.000 A 6 VAL CA C 13 60.766 0.000 A 6 VAL CB C 13 35.226 0.000 A 6 VAL CG1 C 13 21.205 0.000 A 6 VAL CG2 C 13 21.205 0.000 A 6 VAL N N 15 119.987 0.000 A 7 ARG H H 1 8.793 0.000 A 7 ARG HA H 1 4.756 0.000 A 7 ARG HBx H 1 1.698 0.000 A 7 ARG HBy H 1 1.840 0.000 A 7 ARG HD2 H 1 3.194 0.000 A 7 ARG HD3 H 1 3.194 0.000 A 7 ARG HGx H 1 1.549 0.000 A 7 ARG HGy H 1 1.645 0.000 A 7 ARG CA C 13 57.758 0.000 A 7 ARG CB C 13 31.033 0.000 A 7 ARG CD C 13 43.632 0.000 A 7 ARG CG C 13 27.849 0.000 A 7 ARG N N 15 128.936 0.000 A 8 VAL H H 1 9.166 0.000 A 8 VAL HA H 1 5.060 0.000 A 8 VAL HB H 1 1.802 0.000 A 8 VAL HGx% H 1 0.846 0.000 A 8 VAL HGy% H 1 0.498 0.000 A 8 VAL CA C 13 59.205 0.000 A 8 VAL CB C 13 36.215 0.000 A 8 VAL CG1 C 13 21.929 0.000 A 8 VAL CG2 C 13 18.430 0.000 A 8 VAL N N 15 120.660 0.000 A 9 ARG H H 1 9.053 0.000 A 9 ARG HA H 1 4.982 0.000 A 9 ARG HBx H 1 1.394 0.000 A 9 ARG HBy H 1 1.584 0.000 A 9 ARG HD2 H 1 3.150 0.000 A 9 ARG HD3 H 1 3.150 0.000 A 9 ARG HE H 1 7.337 0.000 A 9 ARG HG2 H 1 1.304 0.000 A 9 ARG HG3 H 1 1.304 0.000 A 9 ARG CA C 13 53.419 0.000 A 9 ARG CB C 13 33.958 0.000 A 9 ARG CD C 13 43.494 0.000 A 9 ARG CG C 13 26.940 0.000 A 9 ARG N N 15 119.143 0.000 A 9 ARG NE N 15 114.020 0.000 A 10 ALA H H 1 8.923 0.000 A 10 ALA HA H 1 4.235 0.000 A 10 ALA HB% H 1 1.250 0.000 A 10 ALA CA C 13 52.712 0.000 A 10 ALA CB C 13 19.974 0.000 A 10 ALA N N 15 127.433 0.000 A 11 LEU H H 1 9.511 0.000 A 11 LEU HA H 1 3.988 0.000 A 11 LEU HBy H 1 0.959 0.000 A 11 LEU HBx H 1 0.482 0.000 A 11 LEU HDx% H 1 0.665 0.000 A 11 LEU HDy% H 1 0.616 0.000 A 11 LEU HG H 1 1.269 0.000 A 11 LEU CA C 13 55.381 0.000 A 11 LEU CB C 13 43.745 0.000 A 11 LEU CD1 C 13 25.608 0.000 A 11 LEU CD2 C 13 22.261 0.000 A 11 LEU CG C 13 27.175 0.000 A 11 LEU N N 15 125.905 0.000 A 12 TYR H H 1 7.168 0.000 A 12 TYR HA H 1 4.834 0.000 A 12 TYR HBy H 1 3.312 0.000 A 12 TYR HBx H 1 2.554 0.000 A 12 TYR HD1 H 1 6.739 0.000 A 12 TYR HD2 H 1 6.739 0.000 A 12 TYR HE1 H 1 6.639 0.000 A 12 TYR HE2 H 1 6.639 0.000 A 12 TYR CA C 13 53.978 0.000 A 12 TYR CB C 13 42.608 0.000 A 12 TYR CD1 C 13 134.099 0.000 A 12 TYR CD2 C 13 134.099 0.000 A 12 TYR CE1 C 13 117.972 0.000 A 12 TYR CE2 C 13 117.972 0.000 A 12 TYR N N 15 113.501 0.000 A 13 ASP H H 1 8.569 0.000 A 13 ASP HA H 1 4.769 0.000 A 13 ASP HBx H 1 2.677 0.000 A 13 ASP HBy H 1 2.881 0.000 A 13 ASP CA C 13 54.660 0.000 A 13 ASP CB C 13 41.621 0.000 A 13 ASP N N 15 118.902 0.000 A 14 TYR H H 1 8.655 0.000 A 14 TYR HA H 1 4.610 0.000 A 14 TYR HBy H 1 2.674 0.000 A 14 TYR HBx H 1 1.441 0.000 A 14 TYR HD1 H 1 6.856 0.000 A 14 TYR HD2 H 1 6.856 0.000 A 14 TYR HE1 H 1 6.832 0.000 A 14 TYR HE2 H 1 6.832 0.000 A 14 TYR CA C 13 59.542 0.000 A 14 TYR CB C 13 42.385 0.000 A 14 TYR CD1 C 13 133.068 0.000 A 14 TYR CD2 C 13 133.068 0.000 A 14 TYR CE1 C 13 118.641 0.000 A 14 TYR CE2 C 13 118.641 0.000 A 14 TYR N N 15 119.716 0.000 A 15 THR H H 1 7.309 0.000 A 15 THR HA H 1 4.147 0.000 A 15 THR HB H 1 3.619 0.000 A 15 THR HG2% H 1 1.039 0.000 A 15 THR CA C 13 60.694 0.000 A 15 THR CB C 13 69.626 0.000 A 15 THR CG2 C 13 21.378 0.000 A 15 THR N N 15 124.952 0.000 A 16 GLY H H 1 8.611 0.000 A 16 GLY HA2 H 1 4.068 0.000 A 16 GLY HA3 H 1 3.364 0.000 A 16 GLY CA C 13 46.980 0.000 A 16 GLY N N 15 115.924 0.000 A 17 GLN H H 1 8.955 0.000 A 17 GLN HA H 1 4.195 0.000 A 17 GLN HB2 H 1 2.302 0.000 A 17 GLN HB3 H 1 2.195 0.000 A 17 GLN HE21 H 1 6.926 0.000 A 17 GLN HE22 H 1 7.527 0.000 A 17 GLN HG2 H 1 2.576 0.000 A 17 GLN HG3 H 1 2.399 0.000 A 17 GLN CA C 13 55.921 0.000 A 17 GLN CB C 13 30.895 0.000 A 17 GLN CG C 13 34.463 0.000 A 17 GLN N N 15 123.702 0.000 A 17 GLN NE2 N 15 113.550 0.000 A 18 GLU H H 1 7.059 0.000 A 18 GLU HA H 1 4.532 0.000 A 18 GLU HB2 H 1 2.106 0.000 A 18 GLU HB3 H 1 1.683 0.000 A 18 GLU HG2 H 1 2.222 0.000 A 18 GLU HG3 H 1 2.222 0.000 A 18 GLU CA C 13 54.344 0.000 A 18 GLU CB C 13 33.681 0.000 A 18 GLU CG C 13 36.647 0.000 A 18 GLU N N 15 115.033 0.000 A 19 ALA H H 1 8.892 0.000 A 19 ALA HA H 1 4.120 0.000 A 19 ALA HB% H 1 1.462 0.000 A 19 ALA CA C 13 54.802 0.000 A 19 ALA CB C 13 18.696 0.000 A 19 ALA N N 15 123.081 0.000 A 20 ASP H H 1 7.933 0.000 A 20 ASP HA H 1 4.620 0.000 A 20 ASP HB2 H 1 2.997 0.000 A 20 ASP HB3 H 1 2.506 0.000 A 20 ASP CA C 13 52.888 0.000 A 20 ASP CB C 13 39.571 0.000 A 20 ASP N N 15 114.200 0.000 A 21 GLU H H 1 7.604 0.000 A 21 GLU HA H 1 5.039 0.000 A 21 GLU HB2 H 1 2.694 0.000 A 21 GLU HB3 H 1 1.777 0.000 A 21 GLU HG2 H 1 2.118 0.000 A 21 GLU HG3 H 1 2.118 0.000 A 21 GLU CA C 13 55.067 0.000 A 21 GLU CB C 13 33.646 0.000 A 21 GLU CG C 13 36.268 0.000 A 21 GLU N N 15 118.938 0.000 A 22 LEU H H 1 9.030 0.000 A 22 LEU HA H 1 4.498 0.000 A 22 LEU HB2 H 1 1.804 0.000 A 22 LEU HB3 H 1 1.577 0.000 A 22 LEU HD1% H 1 0.859 0.000 A 22 LEU HD2% H 1 0.806 0.000 A 22 LEU HG H 1 1.474 0.000 A 22 LEU CA C 13 54.193 0.000 A 22 LEU CB C 13 45.246 0.000 A 22 LEU CD1 C 13 25.139 0.000 A 22 LEU CD2 C 13 22.169 0.000 A 22 LEU CG C 13 26.665 0.000 A 22 LEU N N 15 122.132 0.000 A 23 SER H H 1 7.152 0.000 A 23 SER HA H 1 4.949 0.000 A 23 SER HB2 H 1 3.616 0.000 A 23 SER HB3 H 1 4.012 0.000 A 23 SER CA C 13 57.221 0.000 A 23 SER CB C 13 66.244 0.000 A 23 SER N N 15 108.580 0.000 A 24 PHE H H 1 8.823 0.000 A 24 PHE HA H 1 5.001 0.000 A 24 PHE HB2 H 1 3.075 0.000 A 24 PHE HB3 H 1 3.330 0.000 A 24 PHE HD1 H 1 6.835 0.000 A 24 PHE HD2 H 1 6.835 0.000 A 24 PHE HE1 H 1 7.262 0.000 A 24 PHE HE2 H 1 7.262 0.000 A 24 PHE HZ H 1 6.808 0.000 A 24 PHE CA C 13 55.564 0.000 A 24 PHE CB C 13 39.898 0.000 A 24 PHE CD1 C 13 132.572 0.000 A 24 PHE CD2 C 13 132.572 0.000 A 24 PHE CE1 C 13 131.102 0.000 A 24 PHE CE2 C 13 131.102 0.000 A 24 PHE CZ C 13 127.741 0.000 A 24 PHE N N 15 116.453 0.000 A 25 LYS H H 1 8.883 0.000 A 25 LYS HA H 1 5.034 0.000 A 25 LYS HB2 H 1 1.723 0.000 A 25 LYS HB3 H 1 1.915 0.000 A 25 LYS HD2 H 1 1.662 0.000 A 25 LYS HD3 H 1 1.702 0.000 A 25 LYS HE2 H 1 2.995 0.000 A 25 LYS HE3 H 1 2.995 0.000 A 25 LYS HG2 H 1 1.509 0.000 A 25 LYS HG3 H 1 1.509 0.000 A 25 LYS CA C 13 53.330 0.000 A 25 LYS CB C 13 34.950 0.000 A 25 LYS CD C 13 28.487 0.000 A 25 LYS CE C 13 42.113 0.000 A 25 LYS CG C 13 24.667 0.000 A 25 LYS N N 15 120.782 0.000 A 26 ALA H H 1 9.312 0.000 A 26 ALA HA H 1 3.415 0.000 A 26 ALA HB% H 1 1.197 0.000 A 26 ALA CA C 13 54.003 0.000 A 26 ALA CB C 13 18.061 0.000 A 26 ALA N N 15 122.726 0.000 A 27 GLY H H 1 8.843 0.000 A 27 GLY HA2 H 1 4.354 0.000 A 27 GLY HA3 H 1 3.387 0.000 A 27 GLY CA C 13 45.012 0.000 A 27 GLY N N 15 111.878 0.000 A 28 GLU H H 1 8.277 0.000 A 28 GLU HA H 1 4.202 0.000 A 28 GLU HB2 H 1 2.057 0.000 A 28 GLU HB3 H 1 2.360 0.000 A 28 GLU HG2 H 1 2.443 0.000 A 28 GLU HG3 H 1 2.281 0.000 A 28 GLU CA C 13 57.442 0.000 A 28 GLU CB C 13 31.304 0.000 A 28 GLU CG C 13 37.091 0.000 A 28 GLU N N 15 122.855 0.000 A 29 GLU H H 1 8.412 0.000 A 29 GLU HA H 1 5.206 0.000 A 29 GLU HB2 H 1 1.942 0.000 A 29 GLU HB3 H 1 1.942 0.000 A 29 GLU HG2 H 1 2.027 0.000 A 29 GLU HG3 H 1 2.397 0.000 A 29 GLU CA C 13 54.935 0.000 A 29 GLU CB C 13 31.958 0.000 A 29 GLU CG C 13 37.547 0.000 A 29 GLU N N 15 122.063 0.000 A 30 LEU H H 1 8.828 0.000 A 30 LEU HA H 1 4.511 0.000 A 30 LEU HB2 H 1 1.719 0.000 A 30 LEU HB3 H 1 1.485 0.000 A 30 LEU HD1% H 1 -0.071 0.000 A 30 LEU HD2% H 1 -0.043 0.000 A 30 LEU HG H 1 0.910 0.000 A 30 LEU CA C 13 55.255 0.000 A 30 LEU CB C 13 43.395 0.000 A 30 LEU CD1 C 13 25.698 0.000 A 30 LEU CD2 C 13 26.787 0.000 A 30 LEU CG C 13 25.509 0.000 A 30 LEU N N 15 117.865 0.000 A 31 MET H H 1 8.517 0.000 A 31 MET HA H 1 5.280 0.000 A 31 MET HB2 H 1 1.748 0.000 A 31 MET HB3 H 1 2.065 0.000 A 31 MET HE% H 1 1.911 0.000 A 31 MET HG2 H 1 2.428 0.000 A 31 MET HG3 H 1 2.539 0.000 A 31 MET CA C 13 52.692 0.000 A 31 MET CB C 13 33.246 0.000 A 31 MET CE C 13 16.672 0.000 A 31 MET CG C 13 32.180 0.000 A 31 MET N N 15 115.659 0.000 A 32 LYS H H 1 9.588 0.000 A 32 LYS HA H 1 4.744 0.000 A 32 LYS HB2 H 1 1.977 0.000 A 32 LYS HB3 H 1 1.913 0.000 A 32 LYS HD2 H 1 1.466 0.000 A 32 LYS HD3 H 1 1.466 0.000 A 32 LYS HE2 H 1 3.047 0.000 A 32 LYS HE3 H 1 3.080 0.000 A 32 LYS HG2 H 1 1.938 0.000 A 32 LYS HG3 H 1 1.240 0.000 A 32 LYS CA C 13 57.016 0.000 A 32 LYS CB C 13 34.333 0.000 A 32 LYS CD C 13 30.613 0.000 A 32 LYS CE C 13 42.432 0.000 A 32 LYS CG C 13 25.332 0.000 A 32 LYS N N 15 127.441 0.000 A 33 ILE H H 1 9.183 0.000 A 33 ILE HA H 1 4.765 0.000 A 33 ILE HB H 1 2.170 0.000 A 33 ILE HD1% H 1 0.851 0.000 A 33 ILE HG12 H 1 1.145 0.000 A 33 ILE HG13 H 1 1.145 0.000 A 33 ILE HG2% H 1 0.828 0.000 A 33 ILE CA C 13 61.327 0.000 A 33 ILE CB C 13 39.028 0.000 A 33 ILE CD1 C 13 14.224 0.000 A 33 ILE CG1 C 13 26.739 0.000 A 33 ILE CG2 C 13 17.622 0.000 A 33 ILE N N 15 122.158 0.000 A 34 SER H H 1 7.854 0.000 A 34 SER HA H 1 4.825 0.000 A 34 SER HB2 H 1 4.285 0.000 A 34 SER HB3 H 1 3.807 0.000 A 34 SER CA C 13 57.993 0.000 A 34 SER CB C 13 66.817 0.000 A 34 SER N N 15 116.600 0.000 A 35 GLU H H 1 8.379 0.000 A 35 GLU HA H 1 4.449 0.000 A 35 GLU HB2 H 1 2.221 0.000 A 35 GLU HB3 H 1 1.869 0.000 A 35 GLU HG2 H 1 2.447 0.000 A 35 GLU HG3 H 1 2.324 0.000 A 35 GLU CA C 13 55.071 0.000 A 35 GLU CB C 13 30.304 0.000 A 35 GLU CG C 13 35.966 0.000 A 35 GLU N N 15 116.379 0.000 A 36 GLU H H 1 8.725 0.000 A 36 GLU HA H 1 4.378 0.000 A 36 GLU HB2 H 1 1.859 0.000 A 36 GLU HB3 H 1 1.740 0.000 A 36 GLU HG2 H 1 2.516 0.000 A 36 GLU HG3 H 1 1.939 0.000 A 36 GLU CA C 13 56.765 0.000 A 36 GLU CB C 13 30.620 0.000 A 36 GLU CG C 13 35.446 0.000 A 36 GLU N N 15 123.664 0.000 A 37 ASP H H 1 8.840 0.000 A 37 ASP HA H 1 4.737 0.000 A 37 ASP HB2 H 1 2.829 0.000 A 37 ASP HB3 H 1 3.346 0.000 A 37 ASP CA C 13 52.338 0.000 A 37 ASP CB C 13 41.662 0.000 A 37 ASP N N 15 125.664 0.000 A 38 GLU H H 1 8.874 0.000 A 38 GLU HA H 1 4.079 0.000 A 38 GLU HB2 H 1 2.118 0.000 A 38 GLU HB3 H 1 2.070 0.000 A 38 GLU HG2 H 1 2.416 0.000 A 38 GLU HG3 H 1 2.416 0.000 A 38 GLU CA C 13 59.024 0.000 A 38 GLU CB C 13 29.303 0.000 A 38 GLU CG C 13 36.947 0.000 A 38 GLU N N 15 116.949 0.000 A 39 GLN H H 1 8.202 0.000 A 39 GLN HA H 1 4.635 0.000 A 39 GLN HB2 H 1 2.332 0.000 A 39 GLN HB3 H 1 2.602 0.000 A 39 GLN HE21 H 1 6.819 0.000 A 39 GLN HE22 H 1 7.553 0.000 A 39 GLN HG2 H 1 2.491 0.000 A 39 GLN HG3 H 1 2.346 0.000 A 39 GLN CA C 13 56.176 0.000 A 39 GLN CB C 13 30.540 0.000 A 39 GLN CG C 13 34.886 0.000 A 39 GLN N N 15 117.154 0.000 A 39 GLN NE2 N 15 111.669 0.000 A 40 GLY H H 1 8.002 0.000 A 40 GLY HA2 H 1 4.109 0.000 A 40 GLY HA3 H 1 3.959 0.000 A 40 GLY CA C 13 45.547 0.000 A 40 GLY N N 15 107.635 0.000 A 41 TRP H H 1 8.748 0.000 A 41 TRP HA H 1 4.747 0.000 A 41 TRP HB2 H 1 3.446 0.000 A 41 TRP HB3 H 1 2.872 0.000 A 41 TRP HD1 H 1 7.260 0.000 A 41 TRP HE1 H 1 10.482 0.000 A 41 TRP HE3 H 1 7.172 0.000 A 41 TRP HH2 H 1 6.536 0.000 A 41 TRP HZ2 H 1 7.223 0.000 A 41 TRP HZ3 H 1 6.918 0.000 A 41 TRP CA C 13 56.273 0.000 A 41 TRP CB C 13 30.823 0.000 A 41 TRP CD1 C 13 128.911 0.000 A 41 TRP CE3 C 13 125.044 0.000 A 41 TRP CH2 C 13 119.605 0.000 A 41 TRP CZ2 C 13 114.518 0.000 A 41 TRP CZ3 C 13 119.587 0.000 A 41 TRP N N 15 123.666 0.000 A 41 TRP NE1 N 15 129.725 0.000 A 42 CYS H H 1 8.590 0.000 A 42 CYS HA H 1 4.359 0.000 A 42 CYS HB2 H 1 1.543 0.000 A 42 CYS HB3 H 1 2.737 0.000 A 42 CYS CA C 13 57.476 0.000 A 42 CYS CB C 13 31.274 0.000 A 42 CYS N N 15 118.452 0.000 A 43 LYS H H 1 8.138 0.000 A 43 LYS HA H 1 4.849 0.000 A 43 LYS HB2 H 1 1.639 0.000 A 43 LYS HB3 H 1 1.639 0.000 A 43 LYS HD2 H 1 1.645 0.000 A 43 LYS HD3 H 1 1.588 0.000 A 43 LYS HE2 H 1 2.852 0.000 A 43 LYS HE3 H 1 2.913 0.000 A 43 LYS HG2 H 1 1.387 0.000 A 43 LYS HG3 H 1 1.387 0.000 A 43 LYS CA C 13 56.027 0.000 A 43 LYS CB C 13 33.857 0.000 A 43 LYS CD C 13 29.471 0.000 A 43 LYS CE C 13 41.901 0.000 A 43 LYS CG C 13 25.638 0.000 A 43 LYS N N 15 121.113 0.000 A 44 GLY H H 1 9.716 0.000 A 44 GLY HA2 H 1 5.630 0.000 A 44 GLY HA3 H 1 3.623 0.000 A 44 GLY CA C 13 44.436 0.000 A 44 GLY N N 15 112.717 0.000 A 45 ARG H H 1 9.239 0.000 A 45 ARG HA H 1 5.408 0.000 A 45 ARG HB2 H 1 1.719 0.000 A 45 ARG HB3 H 1 1.529 0.000 A 45 ARG HD2 H 1 3.191 0.000 A 45 ARG HD3 H 1 3.191 0.000 A 45 ARG HG2 H 1 1.818 0.000 A 45 ARG HG3 H 1 1.406 0.000 A 45 ARG CA C 13 54.108 0.000 A 45 ARG CB C 13 34.643 0.000 A 45 ARG CD C 13 43.798 0.000 A 45 ARG CG C 13 27.156 0.000 A 45 ARG N N 15 119.702 0.000 A 46 LEU H H 1 9.079 0.000 A 46 LEU HA H 1 4.666 0.000 A 46 LEU HB2 H 1 2.035 0.000 A 46 LEU HB3 H 1 2.035 0.000 A 46 LEU HD1% H 1 1.158 0.000 A 46 LEU HD2% H 1 1.304 0.000 A 46 LEU HG H 1 1.163 0.000 A 46 LEU CA C 13 54.688 0.000 A 46 LEU CB C 13 43.490 0.000 A 46 LEU CD1 C 13 22.624 0.000 A 46 LEU CD2 C 13 26.609 0.000 A 46 LEU CG C 13 26.644 0.000 A 46 LEU N N 15 124.862 0.000 A 47 LEU H H 1 9.817 0.000 A 47 LEU HA H 1 4.161 0.000 A 47 LEU HB2 H 1 1.676 0.000 A 47 LEU HB3 H 1 1.947 0.000 A 47 LEU HD1% H 1 0.842 0.000 A 47 LEU HD2% H 1 0.978 0.000 A 47 LEU HG H 1 1.898 0.000 A 47 LEU CA C 13 57.946 0.000 A 47 LEU CB C 13 40.141 0.000 A 47 LEU CD1 C 13 22.282 0.000 A 47 LEU CD2 C 13 25.445 0.000 A 47 LEU CG C 13 27.108 0.000 A 47 LEU N N 15 122.738 0.000 A 48 THR H H 1 7.199 0.000 A 48 THR HA H 1 4.272 0.000 A 48 THR HB H 1 4.627 0.000 A 48 THR HG2% H 1 1.358 0.000 A 48 THR CA C 13 61.901 0.000 A 48 THR CB C 13 69.647 0.000 A 48 THR CG2 C 13 22.344 0.000 A 48 THR N N 15 104.172 0.000 A 49 GLY H H 1 8.121 0.000 A 49 GLY HA2 H 1 4.526 0.000 A 49 GLY HA3 H 1 3.479 0.000 A 49 GLY CA C 13 45.175 0.000 A 49 GLY N N 15 109.592 0.000 A 50 HIS H H 1 7.293 0.000 A 50 HIS HA H 1 4.480 0.000 A 50 HIS HB2 H 1 2.939 0.000 A 50 HIS HB3 H 1 3.093 0.000 A 50 HIS HD2 H 1 7.088 0.000 A 50 HIS CA C 13 57.633 0.000 A 50 HIS CB C 13 31.319 0.000 A 50 HIS CD2 C 13 118.923 0.000 A 50 HIS N N 15 120.021 0.000 A 51 VAL H H 1 8.119 0.000 A 51 VAL HA H 1 5.404 0.000 A 51 VAL HB H 1 1.943 0.000 A 51 VAL HG1% H 1 1.003 0.000 A 51 VAL HG2% H 1 1.053 0.000 A 51 VAL CA C 13 60.135 0.000 A 51 VAL CB C 13 34.682 0.000 A 51 VAL CG1 C 13 21.437 0.000 A 51 VAL CG2 C 13 21.391 0.000 A 51 VAL N N 15 123.922 0.000 A 52 GLY H H 1 8.609 0.000 A 52 GLY HA2 H 1 4.284 0.000 A 52 GLY HA3 H 1 3.799 0.000 A 52 GLY CA C 13 45.292 0.000 A 52 GLY N N 15 111.938 0.000 A 53 LEU H H 1 9.163 0.000 A 53 LEU HA H 1 5.479 0.000 A 53 LEU HB2 H 1 1.428 0.000 A 53 LEU HB3 H 1 1.355 0.000 A 53 LEU HD1% H 1 0.630 0.000 A 53 LEU HD2% H 1 0.430 0.000 A 53 LEU HG H 1 1.622 0.000 A 53 LEU CA C 13 54.395 0.000 A 53 LEU CB C 13 44.807 0.000 A 53 LEU CD1 C 13 23.180 0.000 A 53 LEU CD2 C 13 25.433 0.000 A 53 LEU CG C 13 27.494 0.000 A 53 LEU N N 15 120.432 0.000 A 54 TYR H H 1 9.563 0.000 A 54 TYR HA H 1 5.305 0.000 A 54 TYR HB2 H 1 2.828 0.000 A 54 TYR HB3 H 1 3.026 0.000 A 54 TYR HD1 H 1 6.807 0.000 A 54 TYR HD2 H 1 6.807 0.000 A 54 TYR HE1 H 1 6.492 0.000 A 54 TYR HE2 H 1 6.492 0.000 A 54 TYR CA C 13 55.457 0.000 A 54 TYR CB C 13 40.350 0.000 A 54 TYR CD1 C 13 133.966 0.000 A 54 TYR CD2 C 13 133.966 0.000 A 54 TYR CE1 C 13 117.939 0.000 A 54 TYR CE2 C 13 117.939 0.000 A 54 TYR N N 15 117.117 0.000 A 55 PRO HA H 1 3.621 0.000 A 55 PRO HB2 H 1 1.716 0.000 A 55 PRO HB3 H 1 1.340 0.000 A 55 PRO HD2 H 1 2.701 0.000 A 55 PRO HD3 H 1 2.971 0.000 A 55 PRO HG2 H 1 0.344 0.000 A 55 PRO HG3 H 1 0.398 0.000 A 55 PRO CA C 13 61.858 0.000 A 55 PRO CB C 13 31.313 0.000 A 55 PRO CD C 13 50.728 0.000 A 55 PRO CG C 13 27.279 0.000 A 56 ALA H H 1 8.108 0.000 A 56 ALA HA H 1 3.944 0.000 A 56 ALA HB% H 1 1.260 0.000 A 56 ALA CA C 13 55.607 0.000 A 56 ALA CB C 13 20.187 0.000 A 56 ALA N N 15 128.124 0.000 A 57 ASN H H 1 8.344 0.000 A 57 ASN HA H 1 5.002 0.000 A 57 ASN HB2 H 1 3.017 0.000 A 57 ASN HB3 H 1 3.062 0.000 A 57 ASN HD21 H 1 7.003 0.000 A 57 ASN HD22 H 1 7.521 0.000 A 57 ASN CA C 13 53.566 0.000 A 57 ASN CB C 13 37.273 0.000 A 57 ASN N N 15 110.207 0.000 A 57 ASN ND2 N 15 112.216 0.000 A 58 TYR H H 1 8.514 0.000 A 58 TYR HA H 1 4.791 0.000 A 58 TYR HB2 H 1 3.673 0.000 A 58 TYR HB3 H 1 3.673 0.000 A 58 TYR HD1 H 1 7.224 0.000 A 58 TYR HD2 H 1 7.224 0.000 A 58 TYR HE1 H 1 6.833 0.000 A 58 TYR HE2 H 1 6.833 0.000 A 58 TYR CA C 13 59.494 0.000 A 58 TYR CB C 13 38.411 0.000 A 58 TYR CD1 C 13 132.035 0.000 A 58 TYR CD2 C 13 132.035 0.000 A 58 TYR CE1 C 13 118.619 0.000 A 58 TYR CE2 C 13 118.619 0.000 A 58 TYR N N 15 119.205 0.000 A 59 VAL H H 1 7.319 0.000 A 59 VAL HA H 1 5.283 0.000 A 59 VAL HB H 1 1.733 0.000 A 59 VAL HG1% H 1 0.289 0.000 A 59 VAL HG2% H 1 0.903 0.000 A 59 VAL CA C 13 58.094 0.000 A 59 VAL CB C 13 35.533 0.000 A 59 VAL CG1 C 13 20.555 0.000 A 59 VAL CG2 C 13 19.662 0.000 A 59 VAL N N 15 108.178 0.000 A 60 GLU H H 1 8.727 0.000 A 60 GLU HA H 1 4.836 0.000 A 60 GLU HB2 H 1 2.049 0.000 A 60 GLU HB3 H 1 1.877 0.000 A 60 GLU HG2 H 1 2.162 0.000 A 60 GLU HG3 H 1 2.235 0.000 A 60 GLU CA C 13 53.551 0.000 A 60 GLU CB C 13 33.532 0.000 A 60 GLU CG C 13 35.100 0.000 A 60 GLU N N 15 117.898 0.000 A 61 LYS H H 1 8.819 0.000 A 61 LYS HA H 1 4.332 0.000 A 61 LYS HB2 H 1 1.764 0.000 A 61 LYS HB3 H 1 1.764 0.000 A 61 LYS HD2 H 1 1.717 0.000 A 61 LYS HD3 H 1 1.717 0.000 A 61 LYS HE2 H 1 2.975 0.000 A 61 LYS HE3 H 1 2.975 0.000 A 61 LYS HG2 H 1 1.525 0.000 A 61 LYS HG3 H 1 1.374 0.000 A 61 LYS CA C 13 57.881 0.000 A 61 LYS CB C 13 32.785 0.000 A 61 LYS CD C 13 29.476 0.000 A 61 LYS CE C 13 42.002 0.000 A 61 LYS CG C 13 25.301 0.000 A 61 LYS N N 15 123.172 0.000 A 62 VAL H H 1 7.871 0.000 A 62 VAL HA H 1 3.972 0.000 A 62 VAL HB H 1 1.823 0.000 A 62 VAL HG1% H 1 0.793 0.000 A 62 VAL HG2% H 1 0.882 0.000 A 62 VAL CA C 13 63.169 0.000 A 62 VAL CB C 13 32.636 0.000 A 62 VAL CG1 C 13 21.604 0.000 A 62 VAL CG2 C 13 21.268 0.000 A 62 VAL N N 15 122.554 0.000 A 63 GLY H H 1 8.586 0.000 A 63 GLY HA2 H 1 3.947 0.000 A 63 GLY HA3 H 1 3.988 0.000 A 63 GLY CA C 13 45.275 0.000 A 63 GLY N N 15 113.377 0.000 A 64 LEU H H 1 8.119 0.000 A 64 LEU HA H 1 4.303 0.000 A 64 LEU HB2 H 1 1.623 0.000 A 64 LEU HB3 H 1 1.623 0.000 A 64 LEU HD1% H 1 0.870 0.000 A 64 LEU HD2% H 1 0.923 0.000 A 64 LEU HG H 1 1.633 0.000 A 64 LEU CA C 13 55.315 0.000 A 64 LEU CB C 13 42.531 0.000 A 64 LEU CD1 C 13 23.544 0.000 A 64 LEU CD2 C 13 24.954 0.000 A 64 LEU CG C 13 27.068 0.000 A 64 LEU N N 15 122.287 0.000 A 65 ALA H H 1 8.307 0.000 A 65 ALA HA H 1 4.255 0.000 A 65 ALA HB% H 1 1.367 0.000 A 65 ALA CA C 13 52.600 0.000 A 65 ALA CB C 13 19.123 0.000 A 65 ALA N N 15 124.886 0.000 A 66 ALA H H 1 8.172 0.000 A 66 ALA HA H 1 4.201 0.000 A 66 ALA HB% H 1 1.324 0.000 A 66 ALA CA C 13 52.539 0.000 A 66 ALA CB C 13 19.202 0.000 A 66 ALA N N 15 123.122 0.000 A 67 ALA H H 1 8.145 0.000 A 67 ALA HA H 1 4.201 0.000 A 67 ALA HB% H 1 1.286 0.000 A 67 ALA CA C 13 52.542 0.000 A 67 ALA CB C 13 19.195 0.000 A 67 ALA N N 15 117.807 0.000 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 B 110 PRO HBx B 111 ILE HD11 1.0 . 5.50 2 2 B 105 ALA HB1 B 106 PRO HGx 1.0 . 5.50 3 2 B 106 PRO HGy B 105 ALA HB1 1.0 . 5.50 4 3 B 105 ALA HB1 B 106 PRO HGx 1.0 . 5.50 5 3 B 106 PRO HGy B 105 ALA HB1 1.0 . 5.50 6 4 B 107 ASN HBy B 108 PRO HDx 1.0 . 4.00 7 4 B 107 ASN HBx B 108 PRO HDx 1.0 . 4.00 8 4 B 108 PRO HDy B 107 ASN HBx 1.0 . 4.00 9 4 B 108 PRO HDy B 107 ASN HBy 1.0 . 4.00 10 5 B 106 PRO HBy A 14 TYR HD% 1.0 . 4.50 11 6 A 14 TYR HD% B 106 PRO HGx 1.0 . 3.50 12 6 B 106 PRO HGy A 14 TYR HD% 1.0 . 3.50 13 7 B 106 PRO HBx A 14 TYR HD% 1.0 . 3.50 14 8 B 106 PRO HBy A 58 TYR HD% 1.0 . 6.00 15 9 B 106 PRO HBy A 41 TRP HZ2 1.0 . 0.00 16 10 A 58 TYR HD% B 106 PRO HGx 1.0 . 4.50 17 10 B 106 PRO HGy A 58 TYR HD% 1.0 . 4.50 18 11 A 41 TRP HZ2 B 106 PRO HGx 1.0 . 0.00 19 11 B 106 PRO HGy A 41 TRP HZ2 1.0 . 0.00 20 12 A 57 ASN HD21 B 106 PRO HGx 1.0 . 6.00 21 12 B 106 PRO HGy A 57 ASN HD21 1.0 . 6.00 22 13 B 106 PRO HBx A 57 ASN HD21 1.0 . 6.00 23 14 B 110 PRO HBx A 58 TYR HD% 1.0 . 6.00 24 15 A 57 ASN HD21 B 106 PRO HDy 1.0 . 6.00 25 16 B 108 PRO HDy A 57 ASN HD22 1.0 . 6.00 26 17 A 57 ASN HD22 B 106 PRO HDy 1.0 . 0.00 27 18 A 57 ASN HD22 B 108 PRO HDx 1.0 . 6.00 28 19 A 57 ASN HD22 B 106 PRO HDx 1.0 . 0.00 29 20 A 39 GLN HE22 B 108 PRO HDx 1.0 . 6.00 30 21 A 39 GLN HE22 B 109 PRO HDx 1.0 . 0.00 31 22 A 39 GLN HE21 B 108 PRO HDx 1.0 . 0.00 32 23 B 109 PRO HDx A 39 GLN HE21 1.0 . 0.00 33 24 A 12 TYR HD% B 112 LEU HD21 1.0 . 3.50 34 25 A 12 TYR HD% B 111 ILE HG1x 1.0 . 3.50 35 26 A 12 TYR HD% B 104 PRO HGx 1.0 . 4.50 36 26 A 12 TYR HD% B 104 PRO HGy 1.0 . 4.50 37 27 A 12 TYR HD% B 108 PRO HGx 1.0 . 0.00 38 27 A 12 TYR HD% B 108 PRO HGy 1.0 . 0.00 39 28 A 12 TYR HD% B 109 PRO HGx 1.0 . 0.00 40 28 A 12 TYR HD% B 109 PRO HGy 1.0 . 0.00 41 29 A 12 TYR HD% B 110 PRO HGx 1.0 . 0.00 42 29 B 110 PRO HGy A 12 TYR HD% 1.0 . 0.00 43 30 B 108 PRO HDy A 41 TRP HZ2 1.0 . 6.00 44 31 A 41 TRP HZ2 B 106 PRO HDy 1.0 . 0.00 45 32 A 41 TRP HZ2 B 110 PRO HDy 1.0 . 0.00 46 33 A 58 TYR HD% B 106 PRO HGx 1.0 . 4.50 47 33 B 106 PRO HGy A 58 TYR HD% 1.0 . 4.50 48 34 A 58 TYR HD% B 104 PRO HGx 1.0 . 0.00 49 34 A 58 TYR HD% B 104 PRO HGy 1.0 . 0.00 50 35 A 58 TYR HD% B 108 PRO HGx 1.0 . 0.00 51 35 A 58 TYR HD% B 108 PRO HGy 1.0 . 0.00 52 36 A 58 TYR HD% B 109 PRO HGx 1.0 . 0.00 53 36 A 58 TYR HD% B 109 PRO HGy 1.0 . 0.00 54 37 A 58 TYR HE% B 106 PRO HGx 1.0 . 4.50 55 37 B 106 PRO HGy A 58 TYR HE% 1.0 . 4.50 56 38 A 58 TYR HE% B 104 PRO HGx 1.0 . 0.00 57 38 B 104 PRO HGy A 58 TYR HE% 1.0 . 0.00 58 39 A 58 TYR HE% B 108 PRO HGx 1.0 . 0.00 59 39 B 108 PRO HGy A 58 TYR HE% 1.0 . 0.00 60 40 A 58 TYR HE% B 109 PRO HGx 1.0 . 0.00 61 40 B 109 PRO HGy A 58 TYR HE% 1.0 . 0.00 62 41 B 101 THR HG21 A 39 GLN HG3 1.0 . 3.50 63 42 B 101 THR HG21 A 39 GLN HG2 1.0 . 3.50 64 43 B 101 THR HG21 A 53 LEU HD1% 1.0 . 4.50 65 44 B 103 GLY HAy A 39 GLN HG3 1.0 . 6.00 66 45 B 103 GLY HAy A 39 GLN HG2 1.0 . 0.00 67 46 B 104 PRO HA A 39 GLN HG3 1.0 . 3.50 68 47 B 104 PRO HA A 39 GLN HB3 1.0 . 4.50 69 48 B 104 PRO HA A 39 GLN HG2 1.0 . 3.50 70 49 B 106 PRO HBy A 41 TRP HZ2 1.0 . 4.50 71 50 B 106 PRO HBy A 58 TYR HD% 1.0 . 0.00 72 51 A 41 TRP HZ2 B 104 PRO HBy 1.0 . 0.00 73 52 A 58 TYR HD% B 104 PRO HBy 1.0 . 0.00 74 53 A 41 TRP HZ2 B 109 PRO HBy 1.0 . 0.00 75 54 A 58 TYR HD% B 109 PRO HBy 1.0 . 0.00 76 55 B 106 PRO HBy A 58 TYR HE% 1.0 . 4.50 77 56 B 106 PRO HBy A 14 TYR HD% 1.0 . 0.00 78 57 A 58 TYR HE% B 104 PRO HBy 1.0 . 0.00 79 58 A 14 TYR HD% B 104 PRO HBy 1.0 . 0.00 80 59 A 58 TYR HE% B 109 PRO HBy 1.0 . 0.00 81 60 A 14 TYR HD% B 109 PRO HBy 1.0 . 0.00 82 61 B 107 ASN HA A 57 ASN HB2 1.0 . 6.00 83 62 B 107 ASN HA A 57 ASN HB3 1.0 . 6.00 84 63 A 41 TRP HZ2 B 107 ASN HA 1.0 . 6.00 85 64 A 58 TYR HD% B 107 ASN HA 1.0 . 0.00 86 65 A 58 TYR HE% B 107 ASN HA 1.0 . 6.00 87 66 B 107 ASN HA A 14 TYR HE% 1.0 . 0.00 88 67 A 57 ASN HB2 B 108 PRO HDx 1.0 . 4.50 89 68 A 57 ASN HB2 B 106 PRO HDx 1.0 . 0.00 90 69 A 57 ASN HB2 B 110 PRO HDx 1.0 . 0.00 91 70 A 57 ASN HB3 B 108 PRO HDx 1.0 . 4.50 92 71 A 57 ASN HB2 B 106 PRO HDx 1.0 . 0.00 93 72 A 57 ASN HB2 B 110 PRO HDx 1.0 . 0.00 94 73 B 108 PRO HDy A 57 ASN HB2 1.0 . 4.50 95 74 B 106 PRO HDy A 57 ASN HB2 1.0 . 0.00 96 75 B 110 PRO HDy A 57 ASN HB2 1.0 . 0.00 97 76 B 108 PRO HDy A 57 ASN HB3 1.0 . 4.50 98 77 B 106 PRO HDy A 57 ASN HB2 1.0 . 0.00 99 78 B 110 PRO HDy A 57 ASN HB2 1.0 . 0.00 100 79 B 111 ILE HD11 A 12 TYR HE% 1.0 . 3.50 101 80 B 111 ILE HD11 A 12 TYR HD% 1.0 . 4.50 102 81 A 12 TYR HE% B 112 LEU HA 1.0 . 6.00 103 82 A 12 TYR HE% B 112 LEU HG 1.0 . 4.50 104 83 A 12 TYR HE% B 112 LEU HBy 1.0 . 0.00 105 84 A 12 TYR HE% B 108 PRO HDx 1.0 . 6.00 106 84 B 108 PRO HDy A 12 TYR HE% 1.0 . 6.00 107 85 A 12 TYR HE% B 106 PRO HDx 1.0 . 0.00 108 85 A 12 TYR HE% B 106 PRO HDy 1.0 . 0.00 109 86 A 12 TYR HE% B 110 PRO HDx 1.0 . 0.00 110 86 A 12 TYR HE% B 110 PRO HDy 1.0 . 0.00 111 87 A 39 GLN HG2 B 108 PRO HDx 1.0 . 6.00 112 87 A 39 GLN HG3 B 108 PRO HDx 1.0 . 6.00 113 88 A 39 GLN HG2 B 106 PRO HDx 1.0 . 0.00 114 88 A 39 GLN HG3 B 106 PRO HDx 1.0 . 0.00 115 89 B 104 PRO HDx A 39 GLN HG3 1.0 . 0.00 116 89 A 39 GLN HG2 B 104 PRO HDx 1.0 . 0.00 117 90 A 39 GLN HG2 B 110 PRO HDx 1.0 . 0.00 118 90 A 39 GLN HG3 B 110 PRO HDx 1.0 . 0.00 119 91 A 39 GLN HB3 B 108 PRO HDx 1.0 . 6.00 120 92 A 39 GLN HB3 B 106 PRO HDx 1.0 . 0.00 121 93 B 104 PRO HDx A 39 GLN HB3 1.0 . 0.00 122 94 A 39 GLN HB3 B 110 PRO HDx 1.0 . 0.00 123 95 A 43 LYS HB3 A 34 SER HB2 1.0 . 5.50 124 95 A 34 SER HB2 A 43 LYS HB2 1.0 . 5.50 125 96 A 41 TRP HA A 55 PRO HA 1.0 . 5.50 126 97 A 15 THR HA A 23 SER HA 1.0 . 5.50 127 98 A 14 TYR HD% A 14 TYR HA 1.0 . 5.50 128 99 A 38 GLU HA A 40 GLY H 1.0 . 5.50 129 100 A 10 ALA HB% A 59 VAL HA 1.0 . 5.50 130 101 A 8 VAL HA A 61 LYS HA 1.0 . 5.50 131 102 A 24 PHE HA A 24 PHE HD% 1.0 . 5.50 132 103 A 24 PHE HD% A 54 TYR HA 1.0 . 5.50 133 104 A 21 GLU HA A 43 LYS HG2 1.0 . 5.50 134 104 A 21 GLU HA A 43 LYS HG3 1.0 . 5.50 135 105 A 35 GLU HA A 32 LYS HE2 1.0 . 5.50 136 106 A 41 TRP HB3 A 53 LEU HA 1.0 . 5.50 137 107 A 53 LEU HA A 52 GLY H 1.0 . 5.50 138 108 A 53 LEU HA A 43 LYS HA 1.0 . 5.50 139 109 A 53 LEU HA A 43 LYS HG2 1.0 . 5.50 140 109 A 43 LYS HG3 A 53 LEU HA 1.0 . 5.50 141 110 A 13 ASP HA A 25 LYS HA 1.0 . 5.50 142 111 A 9 ARG HA A 29 GLU HA 1.0 . 5.50 143 112 A 59 VAL HA A 10 ALA HA 1.0 . 5.50 144 113 A 7 ARG HA A 31 MET HA 1.0 . 5.50 145 114 A 54 TYR HD% A 55 PRO HD3 1.0 . 5.50 146 115 A 56 ALA HB% A 40 GLY HA2 1.0 . 5.50 147 116 A 56 ALA HB% A 40 GLY HA3 1.0 . 5.50 148 117 A 24 PHE HD% A 22 LEU HB2 1.0 . 5.50 149 118 A 5 GLY HAx A 33 ILE HA 1.0 . 5.50 150 119 A 41 TRP HZ3 A 53 LEU HB2 1.0 . 5.50 151 120 A 33 ILE HG2% A 44 GLY HA2 1.0 . 5.50 152 121 A 33 ILE HG2% A 44 GLY HA3 1.0 . 5.50 153 122 A 33 ILE HA A 44 GLY HA3 1.0 . 5.50 154 123 A 44 GLY HA2 A 32 LYS HA 1.0 . 5.50 155 124 A 45 ARG HD3 A 49 GLY HA2 1.0 . 5.50 156 124 A 49 GLY HA2 A 45 ARG HD2 1.0 . 5.50 157 125 A 7 ARG HA A 7 ARG HD2 1.0 . 5.50 158 125 A 7 ARG HA A 7 ARG HD3 1.0 . 5.50 159 126 A 45 ARG HA A 45 ARG HD2 1.0 . 5.50 160 126 A 45 ARG HD3 A 45 ARG HA 1.0 . 5.50 161 127 A 7 ARG HD3 A 61 LYS HB2 1.0 . 5.50 162 127 A 7 ARG HD2 A 61 LYS HB2 1.0 . 5.50 163 127 A 61 LYS HB3 A 7 ARG HD2 1.0 . 5.50 164 127 A 7 ARG HD3 A 61 LYS HB3 1.0 . 5.50 165 128 A 9 ARG HA A 9 ARG HD2 1.0 . 5.50 166 128 A 9 ARG HA A 9 ARG HD3 1.0 . 5.50 167 129 A 9 ARG HD3 A 27 GLY HA3 1.0 . 5.50 168 129 A 9 ARG HD2 A 27 GLY HA3 1.0 . 5.50 169 130 A 47 LEU H A 46 LEU HB2 1.0 . 5.50 170 130 A 46 LEU HB3 A 47 LEU H 1.0 . 5.50 171 131 A 51 VAL HA A 46 LEU HB2 1.0 . 5.50 172 131 A 46 LEU HB3 A 51 VAL HA 1.0 . 5.50 173 132 A 6 VAL HG1% A 61 LYS HE2 1.0 . 5.50 174 132 A 6 VAL HG2% A 61 LYS HE2 1.0 . 5.50 175 132 A 61 LYS HE3 A 6 VAL HG1% 1.0 . 5.50 176 132 A 6 VAL HG2% A 61 LYS HE3 1.0 . 5.50 177 133 A 24 PHE HD% A 54 TYR HB2 1.0 . 5.50 178 134 A 33 ILE HB A 45 ARG H 1.0 . 5.50 179 135 A 29 GLU H A 29 GLU HG2 1.0 . 5.50 180 136 A 25 LYS H A 28 GLU HG2 1.0 . 5.50 181 137 A 21 GLU H A 21 GLU HG2 1.0 . 5.50 182 137 A 21 GLU H A 21 GLU HG3 1.0 . 5.50 183 138 A 56 ALA HB% A 36 GLU HG3 1.0 . 5.50 184 139 A 8 VAL HGy% A 59 VAL HB 1.0 . 5.50 185 140 A 60 GLU H A 60 GLU HG2 1.0 . 5.50 186 141 A 6 VAL HB A 32 LYS H 1.0 . 5.50 187 142 A 39 GLN H A 39 GLN HG3 1.0 . 5.50 188 143 A 33 ILE HG2% A 45 ARG HB3 1.0 . 5.50 189 144 A 17 GLN H A 17 GLN HG3 1.0 . 5.50 190 145 A 43 LYS HB3 A 34 SER HB3 1.0 . 5.50 191 145 A 34 SER HB3 A 43 LYS HB2 1.0 . 5.50 192 146 A 33 ILE HG2% A 43 LYS HB2 1.0 . 5.50 193 146 A 43 LYS HB3 A 33 ILE HG2% 1.0 . 5.50 194 147 A 60 GLU HB2 A 11 LEU HDy% 1.0 . 5.50 195 148 A 6 VAL HG1% A 61 LYS HB2 1.0 . 5.50 196 148 A 6 VAL HG2% A 61 LYS HB2 1.0 . 5.50 197 148 A 61 LYS HB3 A 6 VAL HG1% 1.0 . 5.50 198 148 A 61 LYS HB3 A 6 VAL HG2% 1.0 . 5.50 199 149 A 8 VAL HGx% A 61 LYS HB2 1.0 . 5.50 200 149 A 61 LYS HB3 A 8 VAL HGx% 1.0 . 5.50 201 150 A 61 LYS HA A 62 VAL HB 1.0 . 5.50 202 151 A 8 VAL HGx% A 62 VAL HB 1.0 . 5.50 203 152 A 31 MET H A 31 MET HG3 1.0 . 5.50 204 153 A 33 ILE HG2% A 31 MET HG3 1.0 . 5.50 205 154 A 33 ILE HG2% A 31 MET HG2 1.0 . 5.50 206 155 A 46 LEU HB2 A 50 HIS HB2 1.0 . 5.50 207 155 A 46 LEU HB3 A 50 HIS HB2 1.0 . 5.50 208 156 A 10 ALA HB% A 28 GLU HB3 1.0 . 5.50 209 157 A 42 CYS HB2 A 43 LYS H 1.0 . 5.50 210 158 A 46 LEU HB3 A 50 HIS HB3 1.0 . 5.50 211 158 A 50 HIS HB3 A 46 LEU HB2 1.0 . 5.50 212 159 A 41 TRP HB3 A 41 TRP HZ3 1.0 . 5.50 213 160 A 8 VAL HGx% A 7 ARG HBy 1.0 . 5.50 214 161 A 8 VAL HGx% A 7 ARG HBx 1.0 . 5.50 215 162 A 41 TRP HB3 A 43 LYS HG2 1.0 . 5.50 216 162 A 43 LYS HG3 A 41 TRP HB3 1.0 . 5.50 217 163 A 41 TRP HB3 A 53 LEU HD2% 1.0 . 5.50 218 164 A 6 VAL HA A 61 LYS HD2 1.0 . 5.50 219 164 A 6 VAL HA A 61 LYS HD3 1.0 . 5.50 220 165 A 25 LYS HA A 25 LYS HD3 1.0 . 5.50 221 166 A 7 ARG H A 7 ARG HGy 1.0 . 5.50 222 167 A 53 LEU HG A 43 LYS HG2 1.0 . 5.50 223 167 A 43 LYS HG3 A 53 LEU HG 1.0 . 5.50 224 168 A 47 LEU H A 47 LEU HG 1.0 . 5.50 225 169 A 59 VAL HA A 11 LEU HG 1.0 . 5.50 226 170 A 30 LEU HA A 30 LEU HD2% 1.0 . 5.50 227 171 A 48 THR H A 46 LEU HD2% 1.0 . 5.50 228 172 A 30 LEU HA A 46 LEU HD2% 1.0 . 5.50 229 173 A 30 LEU HA A 30 LEU HD1% 1.0 . 5.50 230 174 A 8 VAL HGy% A 30 LEU HD1% 1.0 . 5.50 231 175 A 51 VAL HA A 22 LEU HD2% 1.0 . 5.50 232 176 A 8 VAL HGx% A 62 VAL H 1.0 . 5.50 233 177 A 61 LYS HA A 8 VAL HGx% 1.0 . 5.50 234 178 A 52 GLY H A 51 VAL HG2% 1.0 . 5.50 235 179 A 15 THR HG2% A 17 GLN HA 1.0 . 5.50 236 180 A 62 VAL H A 62 VAL HG2% 1.0 . 5.50 237 181 A 10 ALA HB% A 9 ARG HA 1.0 . 5.50 238 182 A 56 ALA HB% A 57 ASN HA 1.0 . 5.50 239 183 A 10 ALA HB% A 13 ASP HA 1.0 . 5.50 240 184 A 10 ALA HB% A 24 PHE HE% 1.0 . 5.50 241 185 A 10 ALA HB% A 24 PHE HD% 1.0 . 5.50 242 186 A 10 ALA HB% A 26 ALA HA 1.0 . 5.50 243 187 A 7 ARG HA A 8 VAL HGy% 1.0 . 5.50 244 188 A 8 VAL HGy% A 59 VAL HG2% 1.0 . 5.50 245 189 A 8 VAL HGy% A 59 VAL HG1% 1.0 . 5.50 246 190 A 8 VAL HGy% A 30 LEU HD2% 1.0 . 5.50 247 191 A 26 ALA HB% A 27 GLY H 1.0 . 5.50 248 192 A 26 ALA HB% A 12 TYR HA 1.0 . 5.50 249 193 A 33 ILE HG2% A 5 GLY HAy 1.0 . 5.50 250 194 A 5 GLY HAx A 33 ILE HG2% 1.0 . 5.50 251 195 A 6 VAL H A 31 MET HE% 1.0 . 5.50 252 196 A 31 MET HA A 31 MET HE% 1.0 . 5.50 253 197 A 7 ARG HA A 31 MET HE% 1.0 . 5.50 254 198 A 5 GLY HAx A 31 MET HE% 1.0 . 5.50 255 199 A 31 MET HE% A 7 ARG HD2 1.0 . 5.50 256 199 A 7 ARG HD3 A 31 MET HE% 1.0 . 5.50 257 200 A 32 LYS H A 31 MET HE% 1.0 . 5.50 258 201 A 31 MET HE% A 8 VAL H 1.0 . 5.50 259 202 A 7 ARG H A 31 MET HE% 1.0 . 5.50 260 203 A 6 VAL HA A 31 MET HE% 1.0 . 5.50 261 204 A 33 ILE H A 33 ILE HD1% 1.0 . 5.50 262 205 A 33 ILE HD1% A 43 LYS HE2 1.0 . 5.50 263 206 A 4 PRO HGy A 6 VAL HG1% 1.0 . 5.50 264 206 A 6 VAL HG2% A 4 PRO HGy 1.0 . 5.50 265 207 A 4 PRO HGx A 6 VAL HG1% 1.0 . 5.50 266 207 A 6 VAL HG2% A 4 PRO HGx 1.0 . 5.50 267 208 A 5 GLY HAx A 32 LYS HG2 1.0 . 5.50 268 209 A 5 GLY HAx A 4 PRO HGy 1.0 . 5.50 269 210 A 33 ILE HA A 5 GLY HAy 1.0 . 5.50 270 211 A 5 GLY HAx A 6 VAL HG1% 1.0 . 5.50 271 211 A 5 GLY HAx A 6 VAL HG2% 1.0 . 5.50 272 212 A 8 VAL HA A 7 ARG HA 1.0 . 5.50 273 213 A 60 GLU H A 8 VAL HB 1.0 . 5.50 274 214 A 8 VAL HGy% A 32 LYS HB2 1.0 . 5.50 275 215 A 9 ARG HA A 29 GLU HB2 1.0 . 5.50 276 215 A 9 ARG HA A 29 GLU HB3 1.0 . 5.50 277 216 A 9 ARG HD2 A 29 GLU HB2 1.0 . 5.50 278 216 A 9 ARG HD3 A 29 GLU HB2 1.0 . 5.50 279 216 A 29 GLU HB3 A 9 ARG HD2 1.0 . 5.50 280 216 A 9 ARG HD3 A 29 GLU HB3 1.0 . 5.50 281 217 A 24 PHE HD% A 10 ALA HA 1.0 . 5.50 282 218 A 10 ALA HA A 24 PHE HZ 1.0 . 5.50 283 219 A 10 ALA HB% A 24 PHE HB2 1.0 . 5.50 284 220 A 55 PRO HA A 56 ALA HB% 1.0 . 5.50 285 221 A 56 ALA HB% A 36 GLU HG2 1.0 . 5.50 286 222 A 11 LEU HDx% A 60 GLU HB3 1.0 . 5.50 287 223 A 11 LEU HDx% A 60 GLU HB2 1.0 . 5.50 288 224 A 11 LEU HA A 11 LEU HDx% 1.0 . 5.50 289 225 A 11 LEU HA A 11 LEU HDy% 1.0 . 5.50 290 226 A 14 TYR HD% A 16 GLY HA2 1.0 . 5.50 291 227 A 18 GLU HA A 19 ALA HB% 1.0 . 5.50 292 228 A 24 PHE HD% A 22 LEU HB3 1.0 . 5.50 293 229 A 46 LEU HG A 22 LEU HD1% 1.0 . 5.50 294 230 A 46 LEU HB3 A 22 LEU HD1% 1.0 . 5.50 295 230 A 22 LEU HD1% A 46 LEU HB2 1.0 . 5.50 296 231 A 45 ARG HA A 22 LEU HD1% 1.0 . 5.50 297 232 A 51 VAL HA A 22 LEU HD1% 1.0 . 5.50 298 233 A 24 PHE HD% A 22 LEU HD1% 1.0 . 5.50 299 234 A 52 GLY H A 22 LEU HD1% 1.0 . 5.50 300 235 A 46 LEU HG A 22 LEU HD2% 1.0 . 5.50 301 236 A 24 PHE HD% A 22 LEU HD2% 1.0 . 5.50 302 237 A 24 PHE HA A 30 LEU HB3 1.0 . 5.50 303 238 A 25 LYS HA A 26 ALA HB% 1.0 . 5.50 304 239 A 25 LYS HA A 25 LYS HD2 1.0 . 5.50 305 240 A 26 ALA HA A 12 TYR H 1.0 . 5.50 306 241 A 26 ALA HA A 12 TYR HA 1.0 . 5.50 307 242 A 26 ALA HA A 11 LEU HA 1.0 . 5.50 308 243 A 27 GLY HA2 A 9 ARG HD2 1.0 . 5.50 309 243 A 9 ARG HD3 A 27 GLY HA2 1.0 . 5.50 310 244 A 25 LYS H A 28 GLU HA 1.0 . 5.50 311 245 A 10 ALA HB% A 28 GLU HB2 1.0 . 5.50 312 246 A 25 LYS H A 28 GLU HG3 1.0 . 5.50 313 247 A 29 GLU HA A 9 ARG HG2 1.0 . 5.50 314 247 A 29 GLU HA A 9 ARG HG3 1.0 . 5.50 315 248 A 29 GLU HA A 30 LEU HG 1.0 . 5.50 316 249 A 29 GLU HA A 8 VAL HGy% 1.0 . 5.50 317 250 A 30 LEU H A 29 GLU HG2 1.0 . 5.50 318 251 A 30 LEU HB3 A 46 LEU HA 1.0 . 5.50 319 252 A 32 LYS HB2 A 30 LEU HB2 1.0 . 5.50 320 253 A 31 MET HA A 8 VAL HGy% 1.0 . 5.50 321 254 A 31 MET HA A 8 VAL HGx% 1.0 . 5.50 322 255 A 31 MET HA A 6 VAL HG1% 1.0 . 5.50 323 255 A 31 MET HA A 6 VAL HG2% 1.0 . 5.50 324 256 A 31 MET HA A 6 VAL HB 1.0 . 5.50 325 257 A 31 MET HE% A 5 GLY H 1.0 . 5.50 326 258 A 5 GLY HAy A 31 MET HE% 1.0 . 5.50 327 259 A 8 VAL HGx% A 31 MET HE% 1.0 . 5.50 328 260 A 8 VAL HGy% A 31 MET HE% 1.0 . 5.50 329 261 A 32 LYS HA A 32 LYS HD2 1.0 . 5.50 330 261 A 32 LYS HA A 32 LYS HD3 1.0 . 5.50 331 262 A 32 LYS HB3 A 32 LYS HE2 1.0 . 5.50 332 263 A 32 LYS HB3 A 32 LYS HE3 1.0 . 5.50 333 264 A 35 GLU HA A 32 LYS HE3 1.0 . 5.50 334 265 A 33 ILE HA A 32 LYS HE3 1.0 . 5.50 335 266 A 33 ILE HA A 32 LYS HE2 1.0 . 5.50 336 267 A 33 ILE HB A 32 LYS HG2 1.0 . 5.50 337 268 A 44 GLY HA2 A 33 ILE HB 1.0 . 5.50 338 269 A 33 ILE HD1% A 43 LYS HG2 1.0 . 5.50 339 269 A 43 LYS HG3 A 33 ILE HD1% 1.0 . 5.50 340 270 A 33 ILE HD1% A 51 VAL HB 1.0 . 5.50 341 271 A 45 ARG HA A 33 ILE HD1% 1.0 . 5.50 342 272 A 51 VAL HA A 33 ILE HD1% 1.0 . 5.50 343 273 A 44 GLY HA2 A 33 ILE HD1% 1.0 . 5.50 344 274 A 33 ILE HG2% A 45 ARG HB2 1.0 . 5.50 345 275 A 33 ILE HG2% A 45 ARG HD2 1.0 . 5.50 346 275 A 33 ILE HG2% A 45 ARG HD3 1.0 . 5.50 347 276 A 37 ASP H A 36 GLU HG3 1.0 . 5.50 348 277 A 32 LYS HG3 A 42 CYS HB3 1.0 . 5.50 349 278 A 56 ALA HB% A 42 CYS HB3 1.0 . 5.50 350 279 A 32 LYS HB3 A 42 CYS HB3 1.0 . 5.50 351 280 A 32 LYS HG2 A 42 CYS HB3 1.0 . 5.50 352 281 A 33 ILE HD1% A 43 LYS HE3 1.0 . 5.50 353 282 A 54 TYR HD% A 44 GLY HA2 1.0 . 5.50 354 283 A 52 GLY H A 45 ARG HA 1.0 . 5.50 355 284 A 45 ARG HA A 46 LEU HB2 1.0 . 5.50 356 284 A 45 ARG HA A 46 LEU HB3 1.0 . 5.50 357 285 A 45 ARG HA A 22 LEU HG 1.0 . 5.50 358 286 A 45 ARG HA A 22 LEU HD2% 1.0 . 5.50 359 287 A 46 LEU HB3 A 22 LEU HD2% 1.0 . 5.50 360 287 A 22 LEU HD2% A 46 LEU HB2 1.0 . 5.50 361 288 A 47 LEU H A 48 THR HA 1.0 . 5.50 362 289 A 45 ARG HD2 A 49 GLY HA3 1.0 . 5.50 363 289 A 45 ARG HD3 A 49 GLY HA3 1.0 . 5.50 364 290 A 51 VAL HA A 52 GLY HA2 1.0 . 5.50 365 291 A 51 VAL HA A 52 GLY HA3 1.0 . 5.50 366 292 A 51 VAL H A 51 VAL HG1% 1.0 . 5.50 367 293 A 21 GLU HA A 53 LEU HB2 1.0 . 5.50 368 294 A 43 LYS HG2 A 53 LEU HD2% 1.0 . 5.50 369 294 A 43 LYS HG3 A 53 LEU HD2% 1.0 . 5.50 370 295 A 41 TRP HB2 A 53 LEU HD2% 1.0 . 5.50 371 296 A 53 LEU HA A 53 LEU HD2% 1.0 . 5.50 372 297 A 53 LEU H A 53 LEU HD2% 1.0 . 5.50 373 298 A 43 LYS HG3 A 53 LEU HD1% 1.0 . 5.50 374 298 A 53 LEU HD1% A 43 LYS HG2 1.0 . 5.50 375 299 A 41 TRP HB3 A 53 LEU HD1% 1.0 . 5.50 376 300 A 41 TRP HB2 A 53 LEU HD1% 1.0 . 5.50 377 301 A 53 LEU HA A 53 LEU HD1% 1.0 . 5.50 378 302 A 54 TYR HA A 22 LEU HG 1.0 . 5.50 379 303 A 58 TYR HD% A 55 PRO HA 1.0 . 5.50 380 304 A 55 PRO HA A 41 TRP HZ3 1.0 . 5.50 381 305 A 55 PRO HA A 41 TRP HH2 1.0 . 5.50 382 306 A 55 PRO HA A 54 TYR HE% 1.0 . 5.50 383 307 A 58 TYR HD% A 55 PRO HB3 1.0 . 5.50 384 308 A 41 TRP HH2 A 55 PRO HD2 1.0 . 5.50 385 309 A 55 PRO HD3 A 53 LEU HB3 1.0 . 5.50 386 310 A 41 TRP HZ2 A 55 PRO HD3 1.0 . 5.50 387 311 A 58 TYR HD% A 55 PRO HD3 1.0 . 5.50 388 312 A 55 PRO HG2 A 58 TYR HB2 1.0 . 5.50 389 312 A 55 PRO HG2 A 58 TYR HB3 1.0 . 5.50 390 313 A 55 PRO HG3 A 58 TYR HB2 1.0 . 5.50 391 313 A 58 TYR HB3 A 55 PRO HG3 1.0 . 5.50 392 314 A 58 TYR HD% A 55 PRO HG3 1.0 . 5.50 393 315 A 54 TYR HD% A 56 ALA HA 1.0 . 5.50 394 316 A 42 CYS HB2 A 56 ALA HA 1.0 . 5.50 395 317 A 55 PRO HA A 56 ALA HA 1.0 . 5.50 396 318 A 55 PRO HD2 A 58 TYR HB2 1.0 . 5.50 397 318 A 55 PRO HD2 A 58 TYR HB3 1.0 . 5.50 398 319 A 55 PRO HB2 A 58 TYR HB2 1.0 . 5.50 399 319 A 58 TYR HB3 A 55 PRO HB2 1.0 . 5.50 400 320 A 10 ALA HB% A 59 VAL HB 1.0 . 5.50 401 321 A 11 LEU HDy% A 60 GLU HB3 1.0 . 5.50 402 322 A 61 LYS H A 60 GLU HB3 1.0 . 5.50 403 323 A 61 LYS HA A 8 VAL HGy% 1.0 . 5.50 404 324 A 62 VAL HA A 9 ARG HBy 1.0 . 5.50 405 325 A 62 VAL HA A 9 ARG HBx 1.0 . 5.50 406 326 A 61 LYS HA A 62 VAL HA 1.0 . 5.50 407 327 A 62 VAL HB A 61 LYS H 1.0 . 5.50 408 328 A 65 ALA HA A 64 LEU HB2 1.0 . 5.50 409 328 A 64 LEU HB3 A 65 ALA HA 1.0 . 5.50 410 329 A 65 ALA HB% A 66 ALA H 1.0 . 5.50 411 330 A 66 ALA HB% A 67 ALA H 1.0 . 5.50 412 331 A 67 ALA HB% A 64 LEU HB2 1.0 . 5.50 413 331 A 64 LEU HB3 A 67 ALA HB% 1.0 . 5.50 414 332 A 30 LEU HA A 46 LEU HD1% 1.0 . 5.50 415 333 A 47 LEU HG A 30 LEU HA 1.0 . 5.50 416 334 A 46 LEU HG A 48 THR HG2% 1.0 . 5.50 417 335 A 12 TYR HD% A 58 TYR HB2 1.0 . 4.02 418 335 A 12 TYR HD% A 58 TYR HB3 1.0 . 4.02 419 336 A 54 TYR HD% A 54 TYR H 1.0 . 3.81 420 337 A 54 TYR HD% A 24 PHE HE% 1.0 . 3.47 421 338 A 54 TYR HD% A 55 PRO HD2 1.0 . 3.55 422 339 A 12 TYR HD% A 11 LEU H 1.0 . 4.30 423 340 A 12 TYR HD% A 12 TYR H 1.0 . 3.32 424 341 A 54 TYR HD% A 44 GLY H 1.0 . 3.82 425 342 A 54 TYR HD% A 56 ALA HB% 1.0 . 4.54 426 343 A 24 PHE HD% A 14 TYR H 1.0 . 4.01 427 344 A 24 PHE HD% A 54 TYR HB3 1.0 . 3.38 428 345 A 24 PHE HD% A 24 PHE H 1.0 . 3.42 429 346 A 58 TYR HD% A 57 ASN H 1.0 . 4.97 430 347 A 58 TYR HD% A 58 TYR H 1.0 . 3.44 431 348 A 58 TYR HD% A 14 TYR HBy 1.0 . 3.96 432 349 A 58 TYR HD% A 55 PRO HB2 1.0 . 3.57 433 350 A 58 TYR HD% A 14 TYR HBx 1.0 . 3.96 434 351 A 24 PHE HE% A 54 TYR HB3 1.0 . 3.76 435 352 A 24 PHE HE% A 55 PRO HD2 1.0 . 3.51 436 353 A 24 PHE HE% A 24 PHE H 1.0 . 4.63 437 354 A 24 PHE HE% A 14 TYR H 1.0 . 4.50 438 355 A 24 PHE HE% A 58 TYR HB2 1.0 . 3.86 439 355 A 24 PHE HE% A 58 TYR HB3 1.0 . 3.86 440 356 A 54 TYR HB2 A 24 PHE HE% 1.0 . 3.60 441 357 A 24 PHE HE% A 30 LEU HD1% 1.0 . 4.68 442 358 A 24 PHE HE% A 30 LEU HD2% 1.0 . 4.68 443 359 A 41 TRP HD1 A 41 TRP HB2 1.0 . 3.70 444 360 A 41 TRP HD1 A 41 TRP HB3 1.0 . 3.66 445 361 A 41 TRP HD1 A 39 GLN HB3 1.0 . 3.62 446 362 A 41 TRP HD1 A 39 GLN HB2 1.0 . 3.62 447 363 A 41 TRP HD1 A 41 TRP H 1.0 . 3.96 448 364 A 24 PHE HZ A 58 TYR H 1.0 . 4.46 449 365 A 24 PHE HZ A 58 TYR HB2 1.0 . 3.85 450 365 A 24 PHE HZ A 58 TYR HB3 1.0 . 3.85 451 366 A 54 TYR HB2 A 24 PHE HZ 1.0 . 4.51 452 367 A 24 PHE HZ A 55 PRO HD2 1.0 . 3.69 453 368 A 41 TRP HZ3 A 54 TYR H 1.0 . 4.28 454 369 A 55 PRO HD3 A 41 TRP HZ3 1.0 . 4.45 455 370 A 41 TRP HZ3 A 53 LEU HD2% 1.0 . 5.21 456 371 A 41 TRP HZ3 A 55 PRO HG3 1.0 . 5.50 457 372 A 41 TRP HZ3 A 42 CYS H 1.0 . 4.35 458 373 A 41 TRP HZ3 A 54 TYR HB2 1.0 . 4.70 459 374 A 41 TRP HZ3 A 55 PRO HD2 1.0 . 5.17 460 375 A 41 TRP HZ3 A 53 LEU HB3 1.0 . 3.75 461 376 A 55 PRO HD3 A 41 TRP HH2 1.0 . 4.08 462 377 A 41 TRP HH2 A 21 GLU HB2 1.0 . 4.41 463 378 A 41 TRP HH2 A 54 TYR H 1.0 . 5.50 464 379 A 41 TRP HH2 A 53 LEU HB3 1.0 . 4.14 465 380 A 41 TRP HH2 A 55 PRO HG3 1.0 . 5.14 466 381 A 14 TYR HE% A 12 TYR HBx 1.0 . 4.56 467 382 A 14 TYR HE% A 12 TYR HBy 1.0 . 4.56 468 383 A 58 TYR HE% A 55 PRO HB2 1.0 . 4.12 469 384 A 12 TYR HE% A 58 TYR HB2 1.0 . 4.58 470 384 A 12 TYR HE% A 58 TYR HB3 1.0 . 4.58 471 385 A 33 ILE H A 54 TYR HE% 1.0 . 4.12 472 386 A 43 LYS H A 54 TYR HE% 1.0 . 4.72 473 387 A 24 PHE HE% A 54 TYR HE% 1.0 . 4.90 474 388 A 54 TYR HE% A 56 ALA HA 1.0 . 4.35 475 389 A 42 CYS HB3 A 54 TYR HE% 1.0 . 4.00 476 390 A 8 VAL HGy% A 54 TYR HE% 1.0 . 4.02 477 391 A 32 LYS H A 54 TYR HE% 1.0 . 5.07 478 392 A 54 TYR HE% A 54 TYR H 1.0 . 5.43 479 393 A 54 TYR HE% A 44 GLY H 1.0 . 4.40 480 394 A 32 LYS HG3 A 54 TYR HE% 1.0 . 3.79 481 395 A 12 TYR HD% A 13 ASP H 1.0 . 4.33 482 396 A 12 TYR HD% A 12 TYR HA 1.0 . 4.93 483 397 A 12 TYR HD% A 58 TYR HA 1.0 . 5.09 484 398 A 12 TYR HE% A 11 LEU H 1.0 . 4.93 485 399 A 14 TYR HD% A 14 TYR H 1.0 . 3.88 486 400 A 58 TYR HE% A 55 PRO HG2 1.0 . 4.67 487 401 A 58 TYR HE% A 58 TYR HA 1.0 . 4.76 488 402 A 58 TYR HE% A 58 TYR H 1.0 . 5.05 489 403 A 59 VAL HA A 24 PHE HE% 1.0 . 5.50 490 404 A 24 PHE HZ A 55 PRO HB2 1.0 . 4.86 491 405 A 10 ALA HB% A 24 PHE HZ 1.0 . 4.03 492 406 A 24 PHE HZ A 11 LEU H 1.0 . 5.50 493 407 A 41 TRP HD1 A 39 GLN H 1.0 . 4.92 494 408 A 41 TRP HD1 A 39 GLN HA 1.0 . 5.50 495 409 A 41 TRP HD1 A 53 LEU HD1% 1.0 . 5.50 496 410 A 41 TRP HD1 A 53 LEU HD2% 1.0 . 5.50 497 411 A 41 TRP HA A 41 TRP HE3 1.0 . 4.52 498 412 A 55 PRO HD3 A 41 TRP HE3 1.0 . 4.50 499 413 A 55 PRO HD2 A 41 TRP HE3 1.0 . 5.41 500 414 A 55 PRO HB3 A 41 TRP HE3 1.0 . 5.01 501 415 A 41 TRP HH2 A 21 GLU HG2 1.0 . 4.61 502 415 A 21 GLU HG3 A 41 TRP HH2 1.0 . 4.61 503 416 A 41 TRP HH2 A 21 GLU HB3 1.0 . 4.41 504 417 A 41 TRP HZ2 A 53 LEU HB3 1.0 . 4.86 505 418 A 41 TRP HZ3 A 53 LEU HD1% 1.0 . 5.21 506 419 A 54 TYR HD% A 42 CYS H 1.0 . 5.10 507 420 A 52 GLY H A 54 TYR HD% 1.0 . 5.50 508 421 A 54 TYR HD% A 44 GLY HA3 1.0 . 3.77 509 422 A 54 TYR HD% A 42 CYS HB2 1.0 . 4.55 510 423 A 44 GLY HA2 A 54 TYR HE% 1.0 . 5.50 511 424 A 44 GLY HA3 A 54 TYR HE% 1.0 . 4.67 512 425 A 32 LYS HG2 A 54 TYR HE% 1.0 . 4.86 513 426 A 30 LEU HB2 A 54 TYR HE% 1.0 . 4.83 514 427 A 59 VAL HB A 54 TYR HE% 1.0 . 5.09 515 428 A 42 CYS HB2 A 54 TYR HE% 1.0 . 3.98 516 429 A 50 HIS HD2 A 46 LEU HB2 1.0 . 4.71 517 429 A 46 LEU HB3 A 50 HIS HD2 1.0 . 4.71 518 430 A 41 TRP HE1 A 39 GLN HB2 1.0 . 5.50 519 431 A 41 TRP HE1 A 39 GLN HB3 1.0 . 5.50 520 432 A 7 ARG H A 8 VAL H 1.0 . 5.50 521 433 A 7 ARG H A 7 ARG HD2 1.0 . 5.50 522 433 A 7 ARG HD3 A 7 ARG H 1.0 . 5.50 523 434 A 6 VAL HB A 7 ARG H 1.0 . 5.50 524 435 A 7 ARG H A 7 ARG HGx 1.0 . 5.50 525 436 A 7 ARG H A 6 VAL HG1% 1.0 . 5.50 526 436 A 6 VAL HG2% A 7 ARG H 1.0 . 5.50 527 437 A 41 TRP HA A 56 ALA H 1.0 . 5.50 528 438 A 29 GLU H A 10 ALA H 1.0 . 5.50 529 439 A 26 ALA HA A 10 ALA H 1.0 . 5.50 530 440 A 32 LYS H A 33 ILE H 1.0 . 5.50 531 441 A 5 GLY HAx A 32 LYS H 1.0 . 5.50 532 442 A 32 LYS H A 8 VAL HGx% 1.0 . 5.50 533 443 A 33 ILE HG2% A 32 LYS H 1.0 . 5.50 534 444 A 8 VAL HGy% A 32 LYS H 1.0 . 5.50 535 445 A 32 LYS H A 6 VAL HG1% 1.0 . 5.50 536 445 A 6 VAL HG2% A 32 LYS H 1.0 . 5.50 537 446 A 10 ALA H A 28 GLU H 1.0 . 5.50 538 447 A 29 GLU HA A 10 ALA H 1.0 . 5.50 539 448 A 10 ALA H A 28 GLU HB3 1.0 . 5.50 540 449 A 10 ALA H A 29 GLU HG3 1.0 . 5.50 541 450 A 10 ALA H A 59 VAL HG1% 1.0 . 5.50 542 451 A 59 VAL HA A 11 LEU H 1.0 . 5.50 543 452 A 10 ALA HB% A 11 LEU H 1.0 . 5.50 544 453 A 11 LEU HG A 11 LEU H 1.0 . 5.50 545 454 A 37 ASP H A 36 GLU HG2 1.0 . 5.50 546 455 A 15 THR H A 14 TYR HBx 1.0 . 5.50 547 456 A 14 TYR H A 15 THR H 1.0 . 5.50 548 457 A 14 TYR HD% A 15 THR H 1.0 . 5.50 549 458 A 15 THR H A 14 TYR HBy 1.0 . 5.50 550 459 A 15 THR HG2% A 15 THR H 1.0 . 5.50 551 460 A 51 VAL H A 50 HIS H 1.0 . 5.50 552 461 A 51 VAL H A 50 HIS HB3 1.0 . 5.50 553 462 A 51 VAL H A 50 HIS HB2 1.0 . 5.50 554 463 A 17 GLN H A 17 GLN HG2 1.0 . 5.50 555 464 A 41 TRP H A 42 CYS H 1.0 . 5.50 556 465 A 39 GLN H A 41 TRP H 1.0 . 5.50 557 466 A 56 ALA HB% A 36 GLU H 1.0 . 5.50 558 467 A 56 ALA HB% A 41 TRP H 1.0 . 5.50 559 468 A 36 GLU H A 35 GLU HB2 1.0 . 5.50 560 469 A 36 GLU H A 35 GLU HB3 1.0 . 5.50 561 470 A 3 VAL H A 3 VAL HGx% 1.0 . 5.50 562 471 A 3 VAL H A 3 VAL HGy% 1.0 . 5.50 563 472 A 8 VAL HGx% A 61 LYS H 1.0 . 5.50 564 473 A 61 LYS H A 60 GLU HB2 1.0 . 5.50 565 474 A 8 VAL HB A 61 LYS H 1.0 . 5.50 566 475 A 61 LYS H A 61 LYS HG2 1.0 . 5.50 567 476 A 19 ALA H A 18 GLU HG2 1.0 . 5.50 568 476 A 18 GLU HG3 A 19 ALA H 1.0 . 5.50 569 477 A 9 ARG HA A 28 GLU H 1.0 . 5.50 570 478 A 26 ALA HA A 28 GLU H 1.0 . 5.50 571 479 A 10 ALA HB% A 28 GLU H 1.0 . 5.50 572 480 A 47 LEU H A 30 LEU HA 1.0 . 5.50 573 481 A 47 LEU H A 46 LEU HD1% 1.0 . 5.50 574 482 A 47 LEU H A 47 LEU HD2% 1.0 . 5.50 575 483 A 47 LEU H A 47 LEU HD1% 1.0 . 5.50 576 484 A 47 LEU H A 46 LEU HD2% 1.0 . 5.50 577 485 A 24 PHE HD% A 26 ALA H 1.0 . 5.50 578 486 A 13 ASP HA A 26 ALA H 1.0 . 5.50 579 487 A 26 ALA H A 13 ASP HBy 1.0 . 5.50 580 488 A 26 ALA H A 25 LYS HB3 1.0 . 5.50 581 489 A 26 ALA H A 25 LYS HB2 1.0 . 5.50 582 490 A 26 ALA H A 25 LYS HG2 1.0 . 5.50 583 490 A 26 ALA H A 25 LYS HG3 1.0 . 5.50 584 491 A 8 VAL HA A 62 VAL H 1.0 . 5.50 585 492 A 62 VAL H A 62 VAL HG1% 1.0 . 5.50 586 493 A 62 VAL H A 61 LYS H 1.0 . 5.50 587 494 A 33 ILE H A 32 LYS HG2 1.0 . 5.50 588 495 A 44 GLY HA2 A 33 ILE H 1.0 . 5.50 589 496 A 44 GLY HA3 A 33 ILE H 1.0 . 5.50 590 497 A 53 LEU H A 22 LEU H 1.0 . 5.50 591 498 A 22 LEU H A 52 GLY HA2 1.0 . 5.50 592 499 A 22 LEU H A 52 GLY HA3 1.0 . 5.50 593 500 A 29 GLU H A 29 GLU HG3 1.0 . 5.50 594 501 A 9 ARG HA A 29 GLU H 1.0 . 5.50 595 502 A 43 LYS H A 42 CYS HB3 1.0 . 5.50 596 503 A 43 LYS H A 53 LEU HG 1.0 . 5.50 597 504 A 43 LYS H A 43 LYS HG2 1.0 . 5.50 598 504 A 43 LYS HG3 A 43 LYS H 1.0 . 5.50 599 505 A 25 LYS H A 28 GLU H 1.0 . 5.50 600 506 A 24 PHE HD% A 25 LYS H 1.0 . 5.50 601 507 A 25 LYS H A 24 PHE HB3 1.0 . 5.50 602 508 A 25 LYS H A 24 PHE HB2 1.0 . 5.50 603 509 A 25 LYS H A 25 LYS HG2 1.0 . 5.50 604 509 A 25 LYS H A 25 LYS HG3 1.0 . 5.50 605 510 A 31 MET HA A 8 VAL H 1.0 . 5.50 606 511 A 8 VAL HGx% A 8 VAL H 1.0 . 5.50 607 512 A 8 VAL HGy% A 8 VAL H 1.0 . 5.50 608 513 A 21 GLU HA A 53 LEU H 1.0 . 5.50 609 514 A 53 LEU HG A 53 LEU H 1.0 . 5.50 610 515 A 53 LEU H A 53 LEU HD1% 1.0 . 5.50 611 516 A 53 LEU H A 43 LYS HG2 1.0 . 5.50 612 516 A 43 LYS HG3 A 53 LEU H 1.0 . 5.50 613 517 A 32 LYS H A 6 VAL H 1.0 . 5.50 614 518 A 7 ARG H A 6 VAL H 1.0 . 5.50 615 519 A 31 MET HA A 6 VAL H 1.0 . 5.50 616 520 A 6 VAL H A 6 VAL HG1% 1.0 . 5.50 617 520 A 6 VAL HG2% A 6 VAL H 1.0 . 5.50 618 521 A 8 VAL HGx% A 6 VAL H 1.0 . 5.50 619 522 A 33 ILE HG2% A 6 VAL H 1.0 . 5.50 620 523 A 50 HIS H A 46 LEU H 1.0 . 5.50 621 524 A 50 HIS H A 46 LEU HB2 1.0 . 5.50 622 524 A 46 LEU HB3 A 50 HIS H 1.0 . 5.50 623 525 A 50 HIS H A 46 LEU HD2% 1.0 . 5.50 624 526 A 45 ARG HA A 50 HIS H 1.0 . 5.50 625 527 A 51 VAL HA A 50 HIS H 1.0 . 5.50 626 528 A 45 ARG H A 31 MET HB3 1.0 . 5.50 627 529 A 45 ARG H A 31 MET HB2 1.0 . 5.50 628 530 A 33 ILE HG2% A 45 ARG H 1.0 . 5.50 629 531 A 45 ARG H A 46 LEU H 1.0 . 5.50 630 532 A 32 LYS HA A 45 ARG H 1.0 . 5.50 631 533 A 14 TYR H A 26 ALA H 1.0 . 5.50 632 534 A 25 LYS HA A 14 TYR H 1.0 . 5.50 633 535 A 14 TYR H A 13 ASP HBy 1.0 . 5.50 634 536 A 14 TYR H A 13 ASP HBx 1.0 . 5.50 635 537 A 10 ALA HB% A 14 TYR H 1.0 . 5.50 636 538 A 59 VAL HA A 9 ARG H 1.0 . 5.50 637 539 A 61 LYS HA A 9 ARG H 1.0 . 5.50 638 540 A 54 TYR HD% A 58 TYR H 1.0 . 5.50 639 541 A 55 PRO HB2 A 58 TYR H 1.0 . 5.50 640 542 A 56 ALA HB% A 58 TYR H 1.0 . 5.50 641 543 A 58 TYR H A 59 VAL HG2% 1.0 . 5.50 642 544 A 58 TYR H A 59 VAL HG1% 1.0 . 5.50 643 545 A 9 ARG H A 9 ARG HD2 1.0 . 5.50 644 545 A 9 ARG HD3 A 9 ARG H 1.0 . 5.50 645 546 A 8 VAL HB A 9 ARG H 1.0 . 5.50 646 547 A 8 VAL HGy% A 9 ARG H 1.0 . 5.50 647 548 A 62 VAL H A 9 ARG H 1.0 . 5.50 648 549 A 8 VAL HGx% A 9 ARG H 1.0 . 5.50 649 550 A 13 ASP H A 26 ALA H 1.0 . 5.50 650 551 A 13 ASP H A 12 TYR HBy 1.0 . 5.50 651 552 A 13 ASP H A 12 TYR HBx 1.0 . 5.50 652 553 A 26 ALA HB% A 13 ASP H 1.0 . 5.50 653 554 A 21 GLU H A 19 ALA HA 1.0 . 5.50 654 555 A 21 GLU H A 16 GLY HA3 1.0 . 5.50 655 556 A 21 GLU H A 19 ALA HB% 1.0 . 5.50 656 557 A 55 PRO HA A 42 CYS H 1.0 . 5.50 657 558 A 56 ALA HB% A 42 CYS H 1.0 . 5.50 658 559 A 53 LEU HA A 42 CYS H 1.0 . 5.50 659 560 A 41 TRP HB2 A 42 CYS H 1.0 . 5.50 660 561 A 8 VAL H A 30 LEU H 1.0 . 5.50 661 562 A 30 LEU HG A 30 LEU H 1.0 . 5.50 662 563 A 60 GLU H A 11 LEU H 1.0 . 5.50 663 564 A 60 GLU H A 9 ARG H 1.0 . 5.50 664 565 A 10 ALA HA A 60 GLU H 1.0 . 5.50 665 566 A 59 VAL HB A 60 GLU H 1.0 . 5.50 666 567 A 10 ALA HB% A 60 GLU H 1.0 . 5.50 667 568 A 60 GLU H A 11 LEU HG 1.0 . 5.50 668 569 A 60 GLU H A 59 VAL HG2% 1.0 . 5.50 669 570 A 60 GLU H A 59 VAL HG1% 1.0 . 5.50 670 571 A 9 ARG HA A 30 LEU H 1.0 . 5.50 671 572 A 30 LEU H A 29 GLU HG3 1.0 . 5.50 672 573 A 30 LEU H A 29 GLU HB2 1.0 . 5.50 673 573 A 29 GLU HB3 A 30 LEU H 1.0 . 5.50 674 574 A 8 VAL HGy% A 30 LEU H 1.0 . 5.50 675 575 A 7 ARG HA A 30 LEU H 1.0 . 5.50 676 576 A 54 TYR H A 42 CYS H 1.0 . 5.50 677 577 A 43 LYS HA A 54 TYR H 1.0 . 5.50 678 578 A 41 TRP HB3 A 54 TYR H 1.0 . 5.50 679 579 A 54 TYR H A 53 LEU HD1% 1.0 . 5.50 680 580 A 54 TYR H A 53 LEU HD2% 1.0 . 5.50 681 581 A 54 TYR H A 44 GLY H 1.0 . 5.50 682 582 A 55 PRO HD2 A 54 TYR H 1.0 . 5.50 683 583 A 53 LEU HG A 54 TYR H 1.0 . 5.50 684 584 A 54 TYR H A 43 LYS HG2 1.0 . 5.50 685 584 A 43 LYS HG3 A 54 TYR H 1.0 . 5.50 686 585 A 53 LEU HB2 A 54 TYR H 1.0 . 5.50 687 586 A 39 GLN H A 38 GLU H 1.0 . 5.50 688 587 A 40 GLY H A 38 GLU H 1.0 . 5.50 689 588 A 38 GLU H A 37 ASP HB3 1.0 . 5.50 690 589 A 38 GLU H A 37 ASP HB2 1.0 . 5.50 691 590 A 38 GLU H A 38 GLU HG2 1.0 . 5.50 692 590 A 38 GLU H A 38 GLU HG3 1.0 . 5.50 693 591 A 33 ILE H A 34 SER H 1.0 . 5.50 694 592 A 44 GLY HA2 A 34 SER H 1.0 . 5.50 695 593 A 42 CYS HB3 A 34 SER H 1.0 . 5.50 696 594 A 33 ILE HB A 34 SER H 1.0 . 5.50 697 595 A 32 LYS HG2 A 34 SER H 1.0 . 5.50 698 596 A 34 SER H A 43 LYS HB2 1.0 . 5.50 699 596 A 43 LYS HB3 A 34 SER H 1.0 . 5.50 700 597 A 32 LYS HG3 A 34 SER H 1.0 . 5.50 701 598 A 33 ILE HG2% A 34 SER H 1.0 . 5.50 702 599 A 14 TYR H A 24 PHE H 1.0 . 5.50 703 600 A 15 THR HA A 24 PHE H 1.0 . 5.50 704 601 A 43 LYS H A 34 SER H 1.0 . 5.50 705 602 A 34 SER H A 32 LYS HE2 1.0 . 5.50 706 603 A 34 SER H A 32 LYS HE3 1.0 . 5.50 707 604 A 24 PHE H A 23 SER HB3 1.0 . 5.50 708 605 A 24 PHE H A 23 SER HB2 1.0 . 5.50 709 606 A 24 PHE H A 14 TYR HBx 1.0 . 5.50 710 607 A 35 GLU H A 34 SER HB2 1.0 . 5.50 711 608 A 35 GLU H A 34 SER HB3 1.0 . 5.50 712 609 A 35 GLU H A 35 GLU HG2 1.0 . 5.50 713 610 A 14 TYR HD% A 16 GLY H 1.0 . 5.50 714 611 A 16 GLY H A 15 THR HB 1.0 . 5.50 715 612 A 15 THR HG2% A 16 GLY H 1.0 . 5.50 716 613 A 31 MET H A 30 LEU HB2 1.0 . 5.50 717 614 A 31 MET H A 30 LEU HB3 1.0 . 5.50 718 615 A 45 ARG H A 31 MET H 1.0 . 5.50 719 616 A 31 MET H A 31 MET HG2 1.0 . 5.50 720 617 A 31 MET H A 46 LEU HG 1.0 . 5.50 721 618 A 17 GLN H A 18 GLU H 1.0 . 5.50 722 619 A 21 GLU H A 18 GLU H 1.0 . 5.50 723 620 A 16 GLY HA2 A 18 GLU H 1.0 . 5.50 724 621 A 16 GLY HA3 A 18 GLU H 1.0 . 5.50 725 622 A 18 GLU H A 21 GLU HB2 1.0 . 5.50 726 623 A 18 GLU H A 18 GLU HG2 1.0 . 5.50 727 623 A 18 GLU HG3 A 18 GLU H 1.0 . 5.50 728 624 A 20 ASP H A 18 GLU HB3 1.0 . 5.50 729 625 A 21 GLU H A 20 ASP H 1.0 . 5.50 730 626 A 20 ASP H A 18 GLU HB2 1.0 . 5.50 731 627 A 19 ALA HB% A 20 ASP H 1.0 . 5.50 732 628 A 59 VAL HA A 12 TYR H 1.0 . 5.50 733 629 A 62 VAL HB A 63 GLY H 1.0 . 5.50 734 630 A 12 TYR H A 11 LEU H 1.0 . 5.50 735 631 A 10 ALA HA A 12 TYR H 1.0 . 5.50 736 632 A 10 ALA HB% A 12 TYR H 1.0 . 5.50 737 633 A 12 TYR H A 11 LEU HBy 1.0 . 5.50 738 634 A 12 TYR H A 11 LEU HBx 1.0 . 5.50 739 635 A 53 LEU HA A 44 GLY H 1.0 . 5.50 740 636 A 44 GLY H A 43 LYS HB2 1.0 . 5.50 741 636 A 43 LYS HB3 A 44 GLY H 1.0 . 5.50 742 637 A 44 GLY H A 43 LYS HG2 1.0 . 5.50 743 637 A 43 LYS HG3 A 44 GLY H 1.0 . 5.50 744 638 A 27 GLY H A 28 GLU H 1.0 . 5.50 745 639 A 27 GLY H A 9 ARG HD2 1.0 . 5.50 746 639 A 9 ARG HD3 A 27 GLY H 1.0 . 5.50 747 640 A 10 ALA HB% A 27 GLY H 1.0 . 5.50 748 641 A 27 GLY H A 26 ALA H 1.0 . 5.50 749 642 A 52 GLY H A 44 GLY H 1.0 . 5.50 750 643 A 52 GLY H A 46 LEU H 1.0 . 5.50 751 644 A 52 GLY H A 51 VAL H 1.0 . 5.50 752 645 A 52 GLY H A 43 LYS HA 1.0 . 5.50 753 646 A 52 GLY H A 51 VAL HB 1.0 . 5.50 754 647 A 52 GLY H A 51 VAL HG1% 1.0 . 5.50 755 648 A 52 GLY H A 22 LEU HD2% 1.0 . 5.50 756 649 A 57 ASN H A 58 TYR H 1.0 . 5.50 757 650 A 56 ALA HB% A 57 ASN H 1.0 . 5.50 758 651 A 46 LEU H A 49 GLY H 1.0 . 5.50 759 652 A 50 HIS H A 49 GLY H 1.0 . 5.50 760 653 A 49 GLY H A 46 LEU HB2 1.0 . 5.50 761 653 A 46 LEU HB3 A 49 GLY H 1.0 . 5.50 762 654 A 48 THR HG2% A 49 GLY H 1.0 . 5.50 763 655 A 24 PHE H A 23 SER H 1.0 . 5.50 764 656 A 23 SER H A 22 LEU HB2 1.0 . 5.50 765 657 A 23 SER H A 22 LEU HB3 1.0 . 5.50 766 658 A 23 SER H A 46 LEU HD2% 1.0 . 5.50 767 659 A 58 TYR H A 59 VAL H 1.0 . 5.50 768 660 A 57 ASN HA A 59 VAL H 1.0 . 5.50 769 661 A 59 VAL H A 58 TYR HB2 1.0 . 5.50 770 661 A 58 TYR HB3 A 59 VAL H 1.0 . 5.50 771 662 A 56 ALA HB% A 59 VAL H 1.0 . 5.50 772 663 A 59 VAL H A 59 VAL HG2% 1.0 . 5.50 773 664 A 59 VAL H A 59 VAL HG1% 1.0 . 5.50 774 665 A 40 GLY H A 41 TRP H 1.0 . 5.50 775 666 A 40 GLY H A 39 GLN H 1.0 . 5.50 776 667 A 41 TRP HD1 A 40 GLY H 1.0 . 5.50 777 668 A 33 ILE HG2% A 5 GLY H 1.0 . 5.50 778 669 A 6 VAL H A 5 GLY H 1.0 . 5.50 779 670 A 5 GLY H A 6 VAL HG1% 1.0 . 5.50 780 670 A 6 VAL HG2% A 5 GLY H 1.0 . 5.50 781 671 A 47 LEU H A 48 THR H 1.0 . 5.50 782 672 A 48 THR H A 49 GLY H 1.0 . 5.50 783 673 A 48 THR H A 46 LEU HA 1.0 . 5.50 784 674 A 48 THR H A 46 LEU HB2 1.0 . 5.50 785 674 A 46 LEU HB3 A 48 THR H 1.0 . 5.50 786 675 A 48 THR H A 48 THR HG2% 1.0 . 5.50 787 676 A 48 THR H A 46 LEU HD1% 1.0 . 5.50 788 677 A 5 GLY H A 31 MET HB2 1.0 . 5.50 789 678 A 5 GLY H A 31 MET HB3 1.0 . 5.50 790 679 A 6 VAL H A 32 LYS HD2 1.0 . 5.50 791 679 A 6 VAL H A 32 LYS HD3 1.0 . 5.50 792 680 A 6 VAL H A 32 LYS HG3 1.0 . 5.50 793 681 A 32 LYS H A 8 VAL H 1.0 . 5.50 794 682 A 8 VAL H A 7 ARG HD2 1.0 . 5.50 795 682 A 7 ARG HD3 A 8 VAL H 1.0 . 5.50 796 683 A 10 ALA H A 28 GLU HB2 1.0 . 5.50 797 684 A 10 ALA H A 29 GLU HG2 1.0 . 5.50 798 685 A 59 VAL HB A 10 ALA H 1.0 . 5.50 799 686 A 10 ALA H A 59 VAL HG2% 1.0 . 5.50 800 687 A 59 VAL HB A 11 LEU H 1.0 . 5.50 801 688 A 12 TYR HA A 11 LEU H 1.0 . 5.50 802 689 A 11 LEU H A 10 ALA H 1.0 . 5.50 803 690 A 12 TYR H A 58 TYR HB2 1.0 . 5.50 804 690 A 12 TYR H A 58 TYR HB3 1.0 . 5.50 805 691 A 27 GLY H A 12 TYR H 1.0 . 5.50 806 692 A 12 TYR H A 13 ASP H 1.0 . 5.50 807 693 A 17 GLN H A 16 GLY H 1.0 . 5.50 808 694 A 19 ALA HB% A 18 GLU H 1.0 . 5.50 809 695 A 18 GLU H A 21 GLU HG2 1.0 . 5.50 810 695 A 21 GLU HG3 A 18 GLU H 1.0 . 5.50 811 696 A 18 GLU H A 21 GLU HB3 1.0 . 5.50 812 697 A 21 GLU HA A 18 GLU H 1.0 . 5.50 813 698 A 18 GLU H A 20 ASP H 1.0 . 5.50 814 699 A 20 ASP H A 18 GLU HG2 1.0 . 5.50 815 699 A 18 GLU HG3 A 20 ASP H 1.0 . 5.50 816 700 A 19 ALA H A 20 ASP H 1.0 . 5.50 817 701 A 21 GLU H A 53 LEU H 1.0 . 5.50 818 702 A 21 GLU H A 20 ASP HB2 1.0 . 5.50 819 703 A 21 GLU H A 20 ASP HB3 1.0 . 5.50 820 704 A 21 GLU H A 18 GLU HB2 1.0 . 5.50 821 705 A 21 GLU H A 18 GLU HB3 1.0 . 5.50 822 706 A 52 GLY H A 22 LEU H 1.0 . 5.50 823 707 A 21 GLU H A 22 LEU H 1.0 . 5.50 824 708 A 22 LEU HG A 22 LEU H 1.0 . 5.50 825 709 A 46 LEU HG A 23 SER H 1.0 . 5.50 826 710 A 23 SER H A 46 LEU HD1% 1.0 . 5.50 827 711 A 23 SER H A 46 LEU HB2 1.0 . 5.50 828 711 A 46 LEU HB3 A 23 SER H 1.0 . 5.50 829 712 A 24 PHE HB3 A 23 SER H 1.0 . 5.50 830 713 A 24 PHE HD% A 23 SER H 1.0 . 5.50 831 714 A 22 LEU H A 23 SER H 1.0 . 5.50 832 715 A 24 PHE H A 14 TYR HBy 1.0 . 5.50 833 716 A 55 PRO HD2 A 24 PHE H 1.0 . 5.50 834 717 A 24 PHE H A 15 THR H 1.0 . 5.50 835 718 A 10 ALA HB% A 25 LYS H 1.0 . 5.50 836 719 A 25 LYS H A 28 GLU HB3 1.0 . 5.50 837 720 A 25 LYS H A 28 GLU HB2 1.0 . 5.50 838 721 A 25 LYS H A 26 ALA H 1.0 . 5.50 839 722 A 26 ALA H A 13 ASP HBx 1.0 . 5.50 840 723 A 10 ALA HA A 27 GLY H 1.0 . 5.50 841 724 A 27 GLY H A 11 LEU HA 1.0 . 5.50 842 725 A 24 PHE HB2 A 28 GLU H 1.0 . 5.50 843 726 A 29 GLU H A 9 ARG HG2 1.0 . 5.50 844 726 A 29 GLU H A 9 ARG HG3 1.0 . 5.50 845 727 A 29 GLU H A 30 LEU H 1.0 . 5.50 846 728 A 31 MET H A 30 LEU H 1.0 . 5.50 847 729 A 30 LEU H A 9 ARG HG2 1.0 . 5.50 848 729 A 9 ARG HG3 A 30 LEU H 1.0 . 5.50 849 730 A 31 MET H A 31 MET HE% 1.0 . 5.50 850 731 A 32 LYS H A 31 MET H 1.0 . 5.50 851 732 A 32 LYS H A 32 LYS HG3 1.0 . 5.50 852 733 A 32 LYS H A 32 LYS HD2 1.0 . 5.50 853 733 A 32 LYS H A 32 LYS HD3 1.0 . 5.50 854 734 A 33 ILE H A 33 ILE HG12 1.0 . 5.50 855 734 A 33 ILE H A 33 ILE HG13 1.0 . 5.50 856 735 A 33 ILE HG2% A 33 ILE H 1.0 . 5.50 857 736 A 34 SER H A 35 GLU H 1.0 . 5.50 858 737 A 34 SER H A 32 LYS HD2 1.0 . 5.50 859 737 A 32 LYS HD3 A 34 SER H 1.0 . 5.50 860 738 A 34 SER H A 6 VAL HG1% 1.0 . 5.50 861 738 A 6 VAL HG2% A 34 SER H 1.0 . 5.50 862 739 A 35 GLU H A 35 GLU HG3 1.0 . 5.50 863 740 A 36 GLU H A 35 GLU H 1.0 . 5.50 864 741 A 40 GLY H A 37 ASP H 1.0 . 5.50 865 742 A 37 ASP H A 40 GLY HA2 1.0 . 5.50 866 743 A 37 ASP H A 40 GLY HA3 1.0 . 5.50 867 744 A 41 TRP HB3 A 39 GLN H 1.0 . 5.50 868 745 A 39 GLN HG2 A 39 GLN H 1.0 . 5.50 869 746 A 40 GLY H A 56 ALA HB% 1.0 . 5.50 870 747 A 40 GLY H A 36 GLU HG3 1.0 . 5.50 871 748 A 40 GLY H A 36 GLU HG2 1.0 . 5.50 872 749 A 40 GLY H A 41 TRP HB2 1.0 . 5.50 873 750 A 40 GLY H A 36 GLU HA 1.0 . 5.50 874 751 A 41 TRP HE1 A 53 LEU HB3 1.0 . 5.50 875 752 A 41 TRP HB3 A 42 CYS H 1.0 . 5.50 876 753 A 56 ALA HA A 42 CYS H 1.0 . 5.50 877 754 A 43 LYS H A 42 CYS H 1.0 . 5.50 878 755 A 54 TYR HD% A 45 ARG H 1.0 . 5.50 879 756 A 45 ARG H A 54 TYR HE% 1.0 . 5.50 880 757 A 45 ARG H A 30 LEU HA 1.0 . 5.50 881 758 A 46 LEU H A 50 HIS HB3 1.0 . 5.50 882 759 A 46 LEU H A 50 HIS HB2 1.0 . 5.50 883 760 A 46 LEU H A 46 LEU HD2% 1.0 . 5.50 884 761 A 46 LEU HG A 46 LEU H 1.0 . 5.50 885 762 A 46 LEU H A 46 LEU HD1% 1.0 . 5.50 886 763 A 48 THR H A 47 LEU HD2% 1.0 . 5.50 887 764 A 48 THR H A 47 LEU HD1% 1.0 . 5.50 888 765 A 48 THR H A 46 LEU H 1.0 . 5.50 889 766 A 47 LEU H A 49 GLY H 1.0 . 5.50 890 767 A 49 GLY H A 45 ARG HD2 1.0 . 5.50 891 767 A 45 ARG HD3 A 49 GLY H 1.0 . 5.50 892 768 A 49 GLY H A 47 LEU HD2% 1.0 . 5.50 893 769 A 49 GLY H A 47 LEU HD1% 1.0 . 5.50 894 770 A 46 LEU HG A 50 HIS H 1.0 . 5.50 895 771 A 50 HIS H A 46 LEU HD1% 1.0 . 5.50 896 772 A 51 VAL H A 50 HIS HD2 1.0 . 5.50 897 773 A 51 VAL H A 51 VAL HG2% 1.0 . 5.50 898 774 A 52 GLY H A 53 LEU H 1.0 . 5.50 899 775 A 42 CYS H A 56 ALA H 1.0 . 5.50 900 776 A 57 ASN H A 56 ALA H 1.0 . 5.50 901 777 A 57 ASN H A 58 TYR HB2 1.0 . 5.50 902 777 A 58 TYR HB3 A 57 ASN H 1.0 . 5.50 903 778 A 57 ASN HD21 A 57 ASN H 1.0 . 5.50 904 779 A 54 TYR HD% A 57 ASN H 1.0 . 5.50 905 780 A 56 ALA HA A 58 TYR H 1.0 . 5.50 906 781 A 55 PRO HD2 A 58 TYR H 1.0 . 5.50 907 782 A 59 VAL H A 57 ASN HB2 1.0 . 5.50 908 783 A 59 VAL H A 57 ASN HB3 1.0 . 5.50 909 784 A 24 PHE HZ A 59 VAL H 1.0 . 5.50 910 785 A 54 TYR HD% A 59 VAL H 1.0 . 5.50 911 786 A 60 GLU H A 59 VAL H 1.0 . 5.50 912 787 A 60 GLU H A 60 GLU HG3 1.0 . 5.50 913 788 A 8 VAL HGy% A 60 GLU H 1.0 . 5.50 914 789 A 61 LYS H A 61 LYS HG3 1.0 . 5.50 915 790 A 57 ASN HD22 A 57 ASN H 1.0 . 5.50 916 791 A 57 ASN HD22 A 57 ASN HA 1.0 . 5.50 917 792 A 57 ASN HD21 A 57 ASN HA 1.0 . 5.50 918 793 A 17 GLN HA A 17 GLN HE22 1.0 . 5.50 919 794 A 17 GLN HA A 17 GLN HE21 1.0 . 5.50 920 795 A 64 LEU H A 64 LEU HB2 1.0 . 2.40 921 795 A 64 LEU HB3 A 64 LEU H 1.0 . 2.40 922 796 A 65 ALA HB% A 65 ALA H 1.0 . 2.40 923 797 A 65 ALA H A 64 LEU HB2 1.0 . 2.55 924 797 A 64 LEU HB3 A 65 ALA H 1.0 . 2.55 925 798 A 65 ALA H A 64 LEU HA 1.0 . 2.55 926 799 A 65 ALA HA A 66 ALA H 1.0 . 2.70 927 800 A 66 ALA H A 66 ALA HB% 1.0 . 2.85 928 801 A 3 VAL HGy% A 4 PRO HDx 1.0 . 4.85 929 801 A 3 VAL HGx% A 4 PRO HDx 1.0 . 4.85 930 801 A 4 PRO HDy A 3 VAL HGy% 1.0 . 4.85 931 801 A 3 VAL HGx% A 4 PRO HDy 1.0 . 4.85 932 802 A 5 GLY H A 3 VAL HGy% 1.0 . 5.44 933 802 A 5 GLY H A 3 VAL HGx% 1.0 . 5.44 934 803 A 3 VAL HGy% A 32 LYS HD2 1.0 . 5.44 935 803 A 3 VAL HGx% A 32 LYS HD2 1.0 . 5.44 936 803 A 32 LYS HD3 A 3 VAL HGy% 1.0 . 5.44 937 803 A 32 LYS HD3 A 3 VAL HGx% 1.0 . 5.44 938 804 A 3 VAL HGy% A 32 LYS HE3 1.0 . 4.85 939 804 A 32 LYS HE2 A 3 VAL HGy% 1.0 . 4.85 940 804 A 3 VAL HGx% A 32 LYS HE2 1.0 . 4.85 941 804 A 3 VAL HGx% A 32 LYS HE3 1.0 . 4.85 942 805 A 5 GLY HAx A 4 PRO HBx 1.0 . 5.34 943 805 A 5 GLY HAx A 4 PRO HBy 1.0 . 5.34 944 806 A 5 GLY HAy A 4 PRO HBx 1.0 . 5.34 945 806 A 5 GLY HAy A 4 PRO HBy 1.0 . 5.34 946 807 A 5 GLY H A 4 PRO HDx 1.0 . 4.96 947 807 A 5 GLY H A 4 PRO HDy 1.0 . 4.96 948 808 A 4 PRO HDy A 6 VAL HG1% 1.0 . 5.35 949 808 A 4 PRO HDx A 6 VAL HG1% 1.0 . 5.35 950 808 A 6 VAL HG2% A 4 PRO HDx 1.0 . 5.35 951 808 A 6 VAL HG2% A 4 PRO HDy 1.0 . 5.35 952 809 A 5 GLY HAx A 31 MET HB3 1.0 . 5.34 953 809 A 5 GLY HAx A 31 MET HB2 1.0 . 5.34 954 810 A 6 VAL H A 31 MET HB3 1.0 . 5.34 955 810 A 6 VAL H A 31 MET HB2 1.0 . 5.34 956 811 A 6 VAL HA A 7 ARG HBy 1.0 . 5.34 957 811 A 6 VAL HA A 7 ARG HBx 1.0 . 5.34 958 812 A 6 VAL HB A 32 LYS HE3 1.0 . 5.34 959 812 A 6 VAL HB A 32 LYS HE2 1.0 . 5.34 960 813 A 6 VAL HG2% A 7 ARG HGx 1.0 . 5.34 961 813 A 6 VAL HG1% A 7 ARG HGx 1.0 . 5.34 962 813 A 7 ARG HGy A 6 VAL HG1% 1.0 . 5.34 963 813 A 6 VAL HG2% A 7 ARG HGy 1.0 . 5.34 964 814 A 6 VAL HG2% A 32 LYS HE3 1.0 . 5.34 965 814 A 6 VAL HG1% A 32 LYS HE3 1.0 . 5.34 966 814 A 32 LYS HE2 A 6 VAL HG1% 1.0 . 5.34 967 814 A 6 VAL HG2% A 32 LYS HE2 1.0 . 5.34 968 815 A 6 VAL HG1% A 61 LYS HG3 1.0 . 5.34 969 815 A 6 VAL HG2% A 61 LYS HG3 1.0 . 5.34 970 815 A 61 LYS HG2 A 6 VAL HG1% 1.0 . 5.34 971 815 A 6 VAL HG2% A 61 LYS HG2 1.0 . 5.34 972 816 A 8 VAL HGx% A 7 ARG HGx 1.0 . 5.34 973 816 A 8 VAL HGx% A 7 ARG HGy 1.0 . 5.34 974 817 A 61 LYS HA A 7 ARG HGx 1.0 . 5.34 975 817 A 61 LYS HA A 7 ARG HGy 1.0 . 5.34 976 818 A 62 VAL H A 7 ARG HGx 1.0 . 5.34 977 818 A 62 VAL H A 7 ARG HGy 1.0 . 5.34 978 819 A 62 VAL HB A 7 ARG HGx 1.0 . 5.34 979 819 A 62 VAL HB A 7 ARG HGy 1.0 . 5.34 980 820 A 7 ARG HGy A 62 VAL HG2% 1.0 . 5.28 981 820 A 7 ARG HGx A 62 VAL HG2% 1.0 . 5.28 982 820 A 62 VAL HG1% A 7 ARG HGx 1.0 . 5.28 983 820 A 7 ARG HGy A 62 VAL HG1% 1.0 . 5.28 984 821 A 7 ARG HD2 A 62 VAL HG2% 1.0 . 5.44 985 821 A 7 ARG HD3 A 62 VAL HG2% 1.0 . 5.44 986 821 A 62 VAL HG1% A 7 ARG HD2 1.0 . 5.44 987 821 A 7 ARG HD3 A 62 VAL HG1% 1.0 . 5.44 988 822 A 8 VAL H A 30 LEU HD2% 1.0 . 5.44 989 822 A 8 VAL H A 30 LEU HD1% 1.0 . 5.44 990 823 A 8 VAL H A 31 MET HB3 1.0 . 5.34 991 823 A 8 VAL H A 31 MET HB2 1.0 . 5.34 992 824 A 8 VAL HA A 59 VAL HG2% 1.0 . 5.44 993 824 A 8 VAL HA A 59 VAL HG1% 1.0 . 5.44 994 825 A 8 VAL HA A 62 VAL HG2% 1.0 . 5.44 995 825 A 8 VAL HA A 62 VAL HG1% 1.0 . 5.44 996 826 A 8 VAL HB A 59 VAL HG2% 1.0 . 5.44 997 826 A 8 VAL HB A 59 VAL HG1% 1.0 . 5.44 998 827 A 8 VAL HB A 61 LYS HG3 1.0 . 5.34 999 827 A 8 VAL HB A 61 LYS HG2 1.0 . 5.34 1000 828 A 9 ARG H A 59 VAL HG2% 1.0 . 5.44 1001 828 A 9 ARG H A 59 VAL HG1% 1.0 . 5.44 1002 829 A 9 ARG H A 61 LYS HG3 1.0 . 5.34 1003 829 A 9 ARG H A 61 LYS HG2 1.0 . 5.34 1004 830 A 9 ARG H A 62 VAL HG2% 1.0 . 5.44 1005 830 A 9 ARG H A 62 VAL HG1% 1.0 . 5.44 1006 831 A 9 ARG HA A 29 GLU HG2 1.0 . 5.34 1007 831 A 9 ARG HA A 29 GLU HG3 1.0 . 5.34 1008 832 A 9 ARG HA A 30 LEU HD2% 1.0 . 5.44 1009 832 A 9 ARG HA A 30 LEU HD1% 1.0 . 5.44 1010 833 A 9 ARG HBy A 29 GLU HB2 1.0 . 5.34 1011 833 A 9 ARG HBx A 29 GLU HB2 1.0 . 5.34 1012 833 A 29 GLU HB3 A 9 ARG HBy 1.0 . 5.34 1013 833 A 29 GLU HB3 A 9 ARG HBx 1.0 . 5.34 1014 834 A 9 ARG HBy A 29 GLU HG2 1.0 . 5.18 1015 834 A 9 ARG HBx A 29 GLU HG2 1.0 . 5.18 1016 834 A 29 GLU HG3 A 9 ARG HBy 1.0 . 5.18 1017 834 A 29 GLU HG3 A 9 ARG HBx 1.0 . 5.18 1018 835 A 9 ARG HBy A 62 VAL HG2% 1.0 . 4.53 1019 835 A 9 ARG HBx A 62 VAL HG2% 1.0 . 4.53 1020 835 A 62 VAL HG1% A 9 ARG HBy 1.0 . 4.53 1021 835 A 62 VAL HG1% A 9 ARG HBx 1.0 . 4.53 1022 836 A 9 ARG HG3 A 29 GLU HG2 1.0 . 5.34 1023 836 A 9 ARG HG2 A 29 GLU HG2 1.0 . 5.34 1024 836 A 29 GLU HG3 A 9 ARG HG2 1.0 . 5.34 1025 836 A 9 ARG HG3 A 29 GLU HG3 1.0 . 5.34 1026 837 A 9 ARG HD2 A 62 VAL HG2% 1.0 . 5.44 1027 837 A 9 ARG HD3 A 62 VAL HG2% 1.0 . 5.44 1028 837 A 62 VAL HG1% A 9 ARG HD2 1.0 . 5.44 1029 837 A 9 ARG HD3 A 62 VAL HG1% 1.0 . 5.44 1030 838 A 10 ALA H A 30 LEU HD2% 1.0 . 5.44 1031 838 A 10 ALA H A 30 LEU HD1% 1.0 . 5.44 1032 839 A 10 ALA H A 62 VAL HG2% 1.0 . 5.44 1033 839 A 10 ALA H A 62 VAL HG1% 1.0 . 5.44 1034 840 A 10 ALA HA A 11 LEU HBx 1.0 . 5.34 1035 840 A 10 ALA HA A 11 LEU HBy 1.0 . 5.34 1036 841 A 10 ALA HA A 59 VAL HG2% 1.0 . 5.44 1037 841 A 10 ALA HA A 59 VAL HG1% 1.0 . 5.44 1038 842 A 10 ALA HB% A 25 LYS HB3 1.0 . 5.34 1039 842 A 10 ALA HB% A 25 LYS HB2 1.0 . 5.34 1040 843 A 10 ALA HB% A 27 GLY HA3 1.0 . 5.34 1041 843 A 10 ALA HB% A 27 GLY HA2 1.0 . 5.34 1042 844 A 10 ALA HB% A 28 GLU HG2 1.0 . 5.34 1043 844 A 10 ALA HB% A 28 GLU HG3 1.0 . 5.34 1044 845 A 10 ALA HB% A 30 LEU HD2% 1.0 . 5.44 1045 845 A 10 ALA HB% A 30 LEU HD1% 1.0 . 5.44 1046 846 A 10 ALA HB% A 59 VAL HG2% 1.0 . 5.44 1047 846 A 10 ALA HB% A 59 VAL HG1% 1.0 . 5.44 1048 847 A 11 LEU H A 11 LEU HDy% 1.0 . 5.44 1049 847 A 11 LEU H A 11 LEU HDx% 1.0 . 5.44 1050 848 A 11 LEU H A 59 VAL HG2% 1.0 . 5.44 1051 848 A 11 LEU H A 59 VAL HG1% 1.0 . 5.44 1052 849 A 11 LEU H A 60 GLU HB3 1.0 . 5.34 1053 849 A 11 LEU H A 60 GLU HB2 1.0 . 5.34 1054 850 A 12 TYR HD% A 11 LEU HBx 1.0 . 3.98 1055 850 A 12 TYR HD% A 11 LEU HBy 1.0 . 3.98 1056 851 A 12 TYR HE% A 11 LEU HBx 1.0 . 3.61 1057 851 A 12 TYR HE% A 11 LEU HBy 1.0 . 3.61 1058 852 A 59 VAL HA A 11 LEU HBx 1.0 . 5.34 1059 852 A 59 VAL HA A 11 LEU HBy 1.0 . 5.34 1060 853 A 12 TYR H A 11 LEU HDy% 1.0 . 5.44 1061 853 A 12 TYR H A 11 LEU HDx% 1.0 . 5.44 1062 854 A 12 TYR HD% A 11 LEU HDy% 1.0 . 4.50 1063 854 A 12 TYR HD% A 11 LEU HDx% 1.0 . 4.50 1064 855 A 12 TYR HE% A 11 LEU HDy% 1.0 . 3.76 1065 855 A 12 TYR HE% A 11 LEU HDx% 1.0 . 3.76 1066 856 A 59 VAL H A 11 LEU HDy% 1.0 . 5.44 1067 856 A 59 VAL H A 11 LEU HDx% 1.0 . 5.44 1068 857 A 59 VAL HA A 11 LEU HDy% 1.0 . 5.44 1069 857 A 59 VAL HA A 11 LEU HDx% 1.0 . 5.44 1070 858 A 11 LEU HDy% A 59 VAL HG2% 1.0 . 5.37 1071 858 A 11 LEU HDx% A 59 VAL HG2% 1.0 . 5.37 1072 858 A 59 VAL HG1% A 11 LEU HDy% 1.0 . 5.37 1073 858 A 59 VAL HG1% A 11 LEU HDx% 1.0 . 5.37 1074 859 A 60 GLU H A 11 LEU HDy% 1.0 . 5.44 1075 859 A 60 GLU H A 11 LEU HDx% 1.0 . 5.44 1076 860 A 60 GLU HA A 11 LEU HDy% 1.0 . 5.44 1077 860 A 11 LEU HDx% A 60 GLU HA 1.0 . 5.44 1078 861 A 11 LEU HDy% A 60 GLU HG2 1.0 . 4.85 1079 861 A 11 LEU HDx% A 60 GLU HG2 1.0 . 4.85 1080 861 A 60 GLU HG3 A 11 LEU HDy% 1.0 . 4.85 1081 861 A 11 LEU HDx% A 60 GLU HG3 1.0 . 4.85 1082 862 A 12 TYR H A 59 VAL HG2% 1.0 . 5.44 1083 862 A 12 TYR H A 59 VAL HG1% 1.0 . 5.44 1084 863 A 14 TYR HE% A 12 TYR HBx 1.0 . 3.70 1085 863 A 14 TYR HE% A 12 TYR HBy 1.0 . 3.70 1086 864 A 58 TYR HD% A 12 TYR HBx 1.0 . 4.50 1087 864 A 58 TYR HD% A 12 TYR HBy 1.0 . 4.50 1088 865 A 25 LYS HA A 13 ASP HBy 1.0 . 5.34 1089 865 A 25 LYS HA A 13 ASP HBx 1.0 . 5.34 1090 866 A 13 ASP HBy A 25 LYS HG2 1.0 . 5.34 1091 866 A 13 ASP HBx A 25 LYS HG2 1.0 . 5.34 1092 866 A 25 LYS HG3 A 13 ASP HBy 1.0 . 5.34 1093 866 A 25 LYS HG3 A 13 ASP HBx 1.0 . 5.34 1094 867 A 26 ALA HB% A 13 ASP HBy 1.0 . 5.34 1095 867 A 26 ALA HB% A 13 ASP HBx 1.0 . 5.34 1096 868 A 14 TYR H A 25 LYS HD3 1.0 . 5.34 1097 868 A 14 TYR H A 25 LYS HD2 1.0 . 5.34 1098 869 A 16 GLY H A 14 TYR HBx 1.0 . 5.34 1099 869 A 16 GLY H A 14 TYR HBy 1.0 . 5.34 1100 870 A 24 PHE HE% A 14 TYR HBx 1.0 . 3.79 1101 870 A 24 PHE HE% A 14 TYR HBy 1.0 . 3.79 1102 871 A 24 PHE HZ A 14 TYR HBx 1.0 . 4.25 1103 871 A 24 PHE HZ A 14 TYR HBy 1.0 . 4.25 1104 872 A 14 TYR HBy A 58 TYR HB2 1.0 . 5.34 1105 872 A 14 TYR HBx A 58 TYR HB2 1.0 . 5.34 1106 872 A 58 TYR HB3 A 14 TYR HBx 1.0 . 5.34 1107 872 A 58 TYR HB3 A 14 TYR HBy 1.0 . 5.34 1108 873 A 58 TYR HD% A 14 TYR HBx 1.0 . 3.32 1109 873 A 58 TYR HD% A 14 TYR HBy 1.0 . 3.32 1110 874 A 58 TYR HE% A 14 TYR HBx 1.0 . 3.93 1111 874 A 58 TYR HE% A 14 TYR HBy 1.0 . 3.93 1112 875 A 15 THR HA A 23 SER HB2 1.0 . 5.34 1113 875 A 15 THR HA A 23 SER HB3 1.0 . 5.34 1114 876 A 16 GLY H A 23 SER HB2 1.0 . 5.34 1115 876 A 16 GLY H A 23 SER HB3 1.0 . 5.34 1116 877 A 16 GLY HA2 A 21 GLU HB3 1.0 . 5.34 1117 877 A 16 GLY HA2 A 21 GLU HB2 1.0 . 5.34 1118 878 A 16 GLY HA3 A 21 GLU HB3 1.0 . 5.34 1119 878 A 16 GLY HA3 A 21 GLU HB2 1.0 . 5.34 1120 879 A 17 GLN H A 21 GLU HB3 1.0 . 5.34 1121 879 A 17 GLN H A 21 GLU HB2 1.0 . 5.34 1122 880 A 17 GLN HA A 18 GLU HB3 1.0 . 5.34 1123 880 A 17 GLN HA A 18 GLU HB2 1.0 . 5.34 1124 881 A 18 GLU HA A 17 GLN HB2 1.0 . 5.34 1125 881 A 18 GLU HA A 17 GLN HB3 1.0 . 5.34 1126 882 A 18 GLU H A 17 GLN HG3 1.0 . 5.34 1127 882 A 18 GLU H A 17 GLN HG2 1.0 . 5.34 1128 883 A 19 ALA HB% A 18 GLU HB3 1.0 . 5.34 1129 883 A 19 ALA HB% A 18 GLU HB2 1.0 . 5.34 1130 884 A 21 GLU H A 53 LEU HD2% 1.0 . 5.44 1131 884 A 21 GLU H A 53 LEU HD1% 1.0 . 5.44 1132 885 A 21 GLU HA A 52 GLY HA3 1.0 . 5.34 1133 885 A 21 GLU HA A 52 GLY HA2 1.0 . 5.34 1134 886 A 22 LEU HA A 21 GLU HB3 1.0 . 5.34 1135 886 A 21 GLU HB2 A 22 LEU HA 1.0 . 5.34 1136 887 A 41 TRP HZ3 A 21 GLU HB3 1.0 . 4.88 1137 887 A 41 TRP HZ3 A 21 GLU HB2 1.0 . 4.88 1138 888 A 41 TRP HZ2 A 21 GLU HB3 1.0 . 5.34 1139 888 A 41 TRP HZ2 A 21 GLU HB2 1.0 . 5.34 1140 889 A 41 TRP HH2 A 21 GLU HB3 1.0 . 3.81 1141 889 A 41 TRP HH2 A 21 GLU HB2 1.0 . 3.81 1142 890 A 21 GLU HG3 A 53 LEU HD2% 1.0 . 5.44 1143 890 A 21 GLU HG2 A 53 LEU HD2% 1.0 . 5.44 1144 890 A 53 LEU HD1% A 21 GLU HG2 1.0 . 5.44 1145 890 A 21 GLU HG3 A 53 LEU HD1% 1.0 . 5.44 1146 891 A 22 LEU H A 22 LEU HD2% 1.0 . 5.44 1147 891 A 22 LEU H A 22 LEU HD1% 1.0 . 5.44 1148 892 A 22 LEU HA A 46 LEU HD2% 1.0 . 5.44 1149 892 A 22 LEU HA A 46 LEU HD1% 1.0 . 5.44 1150 893 A 53 LEU H A 22 LEU HB3 1.0 . 5.34 1151 893 A 53 LEU H A 22 LEU HB2 1.0 . 5.34 1152 894 A 54 TYR HD% A 22 LEU HB3 1.0 . 4.16 1153 894 A 54 TYR HD% A 22 LEU HB2 1.0 . 4.16 1154 895 A 22 LEU HG A 52 GLY HA3 1.0 . 5.34 1155 895 A 22 LEU HG A 52 GLY HA2 1.0 . 5.34 1156 896 A 23 SER H A 22 LEU HD2% 1.0 . 5.44 1157 896 A 23 SER H A 22 LEU HD1% 1.0 . 5.44 1158 897 A 30 LEU HB3 A 22 LEU HD2% 1.0 . 5.44 1159 897 A 30 LEU HB3 A 22 LEU HD1% 1.0 . 5.44 1160 898 A 22 LEU HD1% A 30 LEU HD2% 1.0 . 4.85 1161 898 A 30 LEU HD1% A 22 LEU HD2% 1.0 . 4.85 1162 898 A 30 LEU HD1% A 22 LEU HD1% 1.0 . 4.85 1163 898 A 22 LEU HD2% A 30 LEU HD2% 1.0 . 4.85 1164 899 A 31 MET H A 22 LEU HD2% 1.0 . 5.44 1165 899 A 31 MET H A 22 LEU HD1% 1.0 . 5.44 1166 900 A 44 GLY H A 22 LEU HD2% 1.0 . 5.44 1167 900 A 44 GLY H A 22 LEU HD1% 1.0 . 5.44 1168 901 A 44 GLY HA3 A 22 LEU HD2% 1.0 . 5.44 1169 901 A 44 GLY HA3 A 22 LEU HD1% 1.0 . 5.44 1170 902 A 46 LEU H A 22 LEU HD2% 1.0 . 5.44 1171 902 A 46 LEU H A 22 LEU HD1% 1.0 . 5.44 1172 903 A 22 LEU HD2% A 46 LEU HD2% 1.0 . 4.56 1173 903 A 22 LEU HD1% A 46 LEU HD2% 1.0 . 4.56 1174 903 A 46 LEU HD1% A 22 LEU HD2% 1.0 . 4.56 1175 903 A 22 LEU HD1% A 46 LEU HD1% 1.0 . 4.56 1176 904 A 50 HIS H A 22 LEU HD2% 1.0 . 5.44 1177 904 A 50 HIS H A 22 LEU HD1% 1.0 . 5.44 1178 905 A 22 LEU HD1% A 50 HIS HB2 1.0 . 5.28 1179 905 A 22 LEU HD2% A 50 HIS HB2 1.0 . 5.28 1180 905 A 50 HIS HB3 A 22 LEU HD2% 1.0 . 5.28 1181 905 A 22 LEU HD1% A 50 HIS HB3 1.0 . 5.28 1182 906 A 50 HIS HD2 A 22 LEU HD2% 1.0 . 5.44 1183 906 A 50 HIS HD2 A 22 LEU HD1% 1.0 . 5.44 1184 907 A 51 VAL H A 22 LEU HD2% 1.0 . 5.44 1185 907 A 51 VAL H A 22 LEU HD1% 1.0 . 5.44 1186 908 A 22 LEU HD1% A 52 GLY HA3 1.0 . 4.85 1187 908 A 22 LEU HD2% A 52 GLY HA3 1.0 . 4.85 1188 908 A 52 GLY HA2 A 22 LEU HD2% 1.0 . 4.85 1189 908 A 52 GLY HA2 A 22 LEU HD1% 1.0 . 4.85 1190 909 A 54 TYR H A 22 LEU HD2% 1.0 . 5.44 1191 909 A 54 TYR H A 22 LEU HD1% 1.0 . 5.44 1192 910 A 54 TYR HB2 A 22 LEU HD2% 1.0 . 5.44 1193 910 A 54 TYR HB2 A 22 LEU HD1% 1.0 . 5.44 1194 911 A 54 TYR HB3 A 22 LEU HD2% 1.0 . 5.44 1195 911 A 54 TYR HB3 A 22 LEU HD1% 1.0 . 5.44 1196 912 A 54 TYR HD% A 22 LEU HD2% 1.0 . 3.42 1197 912 A 54 TYR HD% A 22 LEU HD1% 1.0 . 3.42 1198 913 A 24 PHE H A 46 LEU HD2% 1.0 . 5.44 1199 913 A 24 PHE H A 46 LEU HD1% 1.0 . 5.44 1200 914 A 24 PHE HA A 28 GLU HB3 1.0 . 5.34 1201 914 A 24 PHE HA A 28 GLU HB2 1.0 . 5.34 1202 915 A 24 PHE HA A 30 LEU HD2% 1.0 . 5.44 1203 915 A 24 PHE HA A 30 LEU HD1% 1.0 . 5.44 1204 916 A 24 PHE HA A 46 LEU HD2% 1.0 . 5.44 1205 916 A 24 PHE HA A 46 LEU HD1% 1.0 . 5.44 1206 917 A 24 PHE HB2 A 28 GLU HB3 1.0 . 5.34 1207 917 A 24 PHE HB2 A 28 GLU HB2 1.0 . 5.34 1208 918 A 24 PHE HB2 A 30 LEU HD2% 1.0 . 5.44 1209 918 A 24 PHE HB2 A 30 LEU HD1% 1.0 . 5.44 1210 919 A 24 PHE HB2 A 46 LEU HD2% 1.0 . 5.44 1211 919 A 24 PHE HB2 A 46 LEU HD1% 1.0 . 5.44 1212 920 A 24 PHE HB3 A 28 GLU HB3 1.0 . 5.34 1213 920 A 24 PHE HB3 A 28 GLU HB2 1.0 . 5.34 1214 921 A 24 PHE HB3 A 46 LEU HD2% 1.0 . 5.44 1215 921 A 24 PHE HB3 A 46 LEU HD1% 1.0 . 5.44 1216 922 A 24 PHE HD% A 25 LYS HD3 1.0 . 5.34 1217 922 A 24 PHE HD% A 25 LYS HD2 1.0 . 5.34 1218 923 A 24 PHE HD% A 28 GLU HB3 1.0 . 3.87 1219 923 A 24 PHE HD% A 28 GLU HB2 1.0 . 3.87 1220 924 A 24 PHE HD% A 30 LEU HD2% 1.0 . 3.14 1221 924 A 24 PHE HD% A 30 LEU HD1% 1.0 . 3.14 1222 925 A 24 PHE HD% A 46 LEU HD2% 1.0 . 5.44 1223 925 A 24 PHE HD% A 46 LEU HD1% 1.0 . 5.44 1224 926 A 24 PHE HD% A 59 VAL HG2% 1.0 . 3.90 1225 926 A 24 PHE HD% A 59 VAL HG1% 1.0 . 3.90 1226 927 A 24 PHE HE% A 30 LEU HD2% 1.0 . 4.00 1227 927 A 24 PHE HE% A 30 LEU HD1% 1.0 . 4.00 1228 928 A 24 PHE HE% A 59 VAL HG2% 1.0 . 3.60 1229 928 A 24 PHE HE% A 59 VAL HG1% 1.0 . 3.60 1230 929 A 24 PHE HZ A 30 LEU HD2% 1.0 . 5.05 1231 929 A 24 PHE HZ A 30 LEU HD1% 1.0 . 5.05 1232 930 A 24 PHE HZ A 59 VAL HG2% 1.0 . 3.51 1233 930 A 24 PHE HZ A 59 VAL HG1% 1.0 . 3.51 1234 931 A 25 LYS H A 25 LYS HD3 1.0 . 5.34 1235 931 A 25 LYS H A 25 LYS HD2 1.0 . 5.34 1236 932 A 25 LYS H A 30 LEU HD2% 1.0 . 5.44 1237 932 A 25 LYS H A 30 LEU HD1% 1.0 . 5.44 1238 933 A 25 LYS H A 46 LEU HD2% 1.0 . 5.44 1239 933 A 25 LYS H A 46 LEU HD1% 1.0 . 5.44 1240 934 A 28 GLU H A 25 LYS HB3 1.0 . 5.34 1241 934 A 28 GLU H A 25 LYS HB2 1.0 . 5.34 1242 935 A 25 LYS HB2 A 28 GLU HB3 1.0 . 5.18 1243 935 A 25 LYS HB3 A 28 GLU HB3 1.0 . 5.18 1244 935 A 28 GLU HB2 A 25 LYS HB3 1.0 . 5.18 1245 935 A 25 LYS HB2 A 28 GLU HB2 1.0 . 5.18 1246 936 A 25 LYS HD3 A 28 GLU HB3 1.0 . 5.18 1247 936 A 25 LYS HD2 A 28 GLU HB3 1.0 . 5.18 1248 936 A 28 GLU HB2 A 25 LYS HD3 1.0 . 5.18 1249 936 A 25 LYS HD2 A 28 GLU HB2 1.0 . 5.18 1250 937 A 26 ALA HA A 27 GLY HA3 1.0 . 5.34 1251 937 A 26 ALA HA A 27 GLY HA2 1.0 . 5.34 1252 938 A 26 ALA HB% A 27 GLY HA3 1.0 . 5.34 1253 938 A 26 ALA HB% A 27 GLY HA2 1.0 . 5.34 1254 939 A 28 GLU H A 30 LEU HD2% 1.0 . 5.44 1255 939 A 28 GLU H A 30 LEU HD1% 1.0 . 5.44 1256 940 A 28 GLU HA A 47 LEU HD2% 1.0 . 5.44 1257 940 A 28 GLU HA A 47 LEU HD1% 1.0 . 5.44 1258 941 A 28 GLU HB3 A 30 LEU HD2% 1.0 . 5.28 1259 941 A 28 GLU HB2 A 30 LEU HD2% 1.0 . 5.28 1260 941 A 30 LEU HD1% A 28 GLU HB3 1.0 . 5.28 1261 941 A 30 LEU HD1% A 28 GLU HB2 1.0 . 5.28 1262 942 A 28 GLU HB3 A 47 LEU HD2% 1.0 . 5.28 1263 942 A 28 GLU HB2 A 47 LEU HD2% 1.0 . 5.28 1264 942 A 47 LEU HD1% A 28 GLU HB3 1.0 . 5.28 1265 942 A 28 GLU HB2 A 47 LEU HD1% 1.0 . 5.28 1266 943 A 29 GLU H A 30 LEU HD2% 1.0 . 5.44 1267 943 A 29 GLU H A 30 LEU HD1% 1.0 . 5.44 1268 944 A 29 GLU H A 47 LEU HD2% 1.0 . 5.44 1269 944 A 29 GLU H A 47 LEU HD1% 1.0 . 5.44 1270 945 A 29 GLU HA A 30 LEU HD2% 1.0 . 5.44 1271 945 A 29 GLU HA A 30 LEU HD1% 1.0 . 5.44 1272 946 A 29 GLU HG3 A 47 LEU HD2% 1.0 . 5.28 1273 946 A 29 GLU HG2 A 47 LEU HD2% 1.0 . 5.28 1274 946 A 47 LEU HD1% A 29 GLU HG2 1.0 . 5.28 1275 946 A 29 GLU HG3 A 47 LEU HD1% 1.0 . 5.28 1276 947 A 30 LEU H A 30 LEU HD2% 1.0 . 5.44 1277 947 A 30 LEU H A 30 LEU HD1% 1.0 . 5.44 1278 948 A 30 LEU H A 46 LEU HD2% 1.0 . 5.44 1279 948 A 30 LEU H A 46 LEU HD1% 1.0 . 5.44 1280 949 A 30 LEU HA A 47 LEU HD2% 1.0 . 5.44 1281 949 A 30 LEU HA A 47 LEU HD1% 1.0 . 5.44 1282 950 A 30 LEU HB2 A 46 LEU HD2% 1.0 . 5.44 1283 950 A 30 LEU HB2 A 46 LEU HD1% 1.0 . 5.44 1284 951 A 30 LEU HB3 A 46 LEU HD2% 1.0 . 5.44 1285 951 A 30 LEU HB3 A 46 LEU HD1% 1.0 . 5.44 1286 952 A 31 MET H A 30 LEU HD2% 1.0 . 5.44 1287 952 A 31 MET H A 30 LEU HD1% 1.0 . 5.44 1288 953 A 32 LYS HB2 A 30 LEU HD2% 1.0 . 5.44 1289 953 A 32 LYS HB2 A 30 LEU HD1% 1.0 . 5.44 1290 954 A 44 GLY H A 30 LEU HD2% 1.0 . 5.44 1291 954 A 44 GLY H A 30 LEU HD1% 1.0 . 5.44 1292 955 A 44 GLY HA2 A 30 LEU HD2% 1.0 . 5.44 1293 955 A 44 GLY HA2 A 30 LEU HD1% 1.0 . 5.44 1294 956 A 44 GLY HA3 A 30 LEU HD2% 1.0 . 5.44 1295 956 A 44 GLY HA3 A 30 LEU HD1% 1.0 . 5.44 1296 957 A 45 ARG H A 30 LEU HD2% 1.0 . 5.44 1297 957 A 45 ARG H A 30 LEU HD1% 1.0 . 5.44 1298 958 A 30 LEU HD2% A 46 LEU HD2% 1.0 . 4.85 1299 958 A 46 LEU HD1% A 30 LEU HD2% 1.0 . 4.85 1300 958 A 30 LEU HD1% A 46 LEU HD1% 1.0 . 4.85 1301 958 A 30 LEU HD1% A 46 LEU HD2% 1.0 . 4.85 1302 959 A 47 LEU H A 30 LEU HD2% 1.0 . 5.44 1303 959 A 47 LEU H A 30 LEU HD1% 1.0 . 5.44 1304 960 A 54 TYR HD% A 30 LEU HD2% 1.0 . 3.52 1305 960 A 54 TYR HD% A 30 LEU HD1% 1.0 . 3.52 1306 961 A 54 TYR HE% A 30 LEU HD2% 1.0 . 3.77 1307 961 A 54 TYR HE% A 30 LEU HD1% 1.0 . 3.77 1308 962 A 30 LEU HD2% A 59 VAL HG2% 1.0 . 4.85 1309 962 A 30 LEU HD1% A 59 VAL HG2% 1.0 . 4.85 1310 962 A 59 VAL HG1% A 30 LEU HD2% 1.0 . 4.85 1311 962 A 30 LEU HD1% A 59 VAL HG1% 1.0 . 4.85 1312 963 A 31 MET H A 46 LEU HD2% 1.0 . 5.44 1313 963 A 31 MET H A 46 LEU HD1% 1.0 . 5.44 1314 964 A 31 MET H A 47 LEU HD2% 1.0 . 5.44 1315 964 A 31 MET H A 47 LEU HD1% 1.0 . 5.44 1316 965 A 33 ILE HG2% A 31 MET HB3 1.0 . 5.34 1317 965 A 33 ILE HG2% A 31 MET HB2 1.0 . 5.34 1318 966 A 45 ARG HA A 31 MET HB3 1.0 . 5.34 1319 966 A 45 ARG HA A 31 MET HB2 1.0 . 5.34 1320 967 A 31 MET HB2 A 45 ARG HB3 1.0 . 5.18 1321 967 A 31 MET HB3 A 45 ARG HB3 1.0 . 5.18 1322 967 A 45 ARG HB2 A 31 MET HB3 1.0 . 5.18 1323 967 A 31 MET HB2 A 45 ARG HB2 1.0 . 5.18 1324 968 A 31 MET HG3 A 47 LEU HD2% 1.0 . 4.85 1325 968 A 31 MET HG2 A 47 LEU HD2% 1.0 . 4.85 1326 968 A 47 LEU HD1% A 31 MET HG3 1.0 . 4.85 1327 968 A 47 LEU HD1% A 31 MET HG2 1.0 . 4.85 1328 969 A 31 MET HE% A 47 LEU HD2% 1.0 . 5.44 1329 969 A 31 MET HE% A 47 LEU HD1% 1.0 . 5.44 1330 970 A 32 LYS HD2 A 35 GLU HB3 1.0 . 5.34 1331 970 A 35 GLU HB2 A 32 LYS HD2 1.0 . 5.34 1332 970 A 32 LYS HD3 A 35 GLU HB2 1.0 . 5.34 1333 970 A 32 LYS HD3 A 35 GLU HB3 1.0 . 5.34 1334 971 A 36 GLU H A 32 LYS HE3 1.0 . 5.34 1335 971 A 36 GLU H A 32 LYS HE2 1.0 . 5.34 1336 972 A 33 ILE H A 43 LYS HD2 1.0 . 5.34 1337 972 A 33 ILE H A 43 LYS HD3 1.0 . 5.34 1338 973 A 33 ILE HG2% A 51 VAL HG2% 1.0 . 5.44 1339 973 A 33 ILE HG2% A 51 VAL HG1% 1.0 . 5.44 1340 974 A 33 ILE HD1% A 43 LYS HD2 1.0 . 5.34 1341 974 A 33 ILE HD1% A 43 LYS HD3 1.0 . 5.34 1342 975 A 33 ILE HD1% A 45 ARG HB3 1.0 . 5.34 1343 975 A 33 ILE HD1% A 45 ARG HB2 1.0 . 5.34 1344 976 A 33 ILE HD1% A 45 ARG HG2 1.0 . 5.34 1345 976 A 33 ILE HD1% A 45 ARG HG3 1.0 . 5.34 1346 977 A 33 ILE HD1% A 51 VAL HG2% 1.0 . 5.44 1347 977 A 33 ILE HD1% A 51 VAL HG1% 1.0 . 5.44 1348 978 A 43 LYS H A 34 SER HB2 1.0 . 5.34 1349 978 A 43 LYS H A 34 SER HB3 1.0 . 5.34 1350 979 A 34 SER HB3 A 43 LYS HD2 1.0 . 5.18 1351 979 A 34 SER HB2 A 43 LYS HD2 1.0 . 5.18 1352 979 A 43 LYS HD3 A 34 SER HB2 1.0 . 5.18 1353 979 A 43 LYS HD3 A 34 SER HB3 1.0 . 5.18 1354 980 A 36 GLU H A 36 GLU HG2 1.0 . 5.34 1355 980 A 36 GLU H A 36 GLU HG3 1.0 . 5.34 1356 981 A 56 ALA HB% A 36 GLU HB2 1.0 . 5.34 1357 981 A 56 ALA HB% A 36 GLU HB3 1.0 . 5.34 1358 982 A 36 GLU HG3 A 40 GLY HA3 1.0 . 4.76 1359 982 A 36 GLU HG2 A 40 GLY HA3 1.0 . 4.76 1360 982 A 40 GLY HA2 A 36 GLU HG2 1.0 . 4.76 1361 982 A 36 GLU HG3 A 40 GLY HA2 1.0 . 4.76 1362 983 A 41 TRP H A 36 GLU HG2 1.0 . 5.34 1363 983 A 41 TRP H A 36 GLU HG3 1.0 . 5.34 1364 984 A 38 GLU HA A 37 ASP HB3 1.0 . 5.34 1365 984 A 38 GLU HA A 37 ASP HB2 1.0 . 5.34 1366 985 A 39 GLN H A 37 ASP HB3 1.0 . 5.34 1367 985 A 39 GLN H A 37 ASP HB2 1.0 . 5.34 1368 986 A 39 GLN HE21 A 38 GLU HB2 1.0 . 4.76 1369 986 A 39 GLN HE21 A 38 GLU HB3 1.0 . 4.76 1370 986 A 39 GLN HE22 A 38 GLU HB3 1.0 . 4.76 1371 986 A 39 GLN HE22 A 38 GLU HB2 1.0 . 4.76 1372 987 A 40 GLY H A 38 GLU HB2 1.0 . 5.34 1373 987 A 40 GLY H A 38 GLU HB3 1.0 . 5.34 1374 988 A 39 GLN HE22 A 38 GLU HG2 1.0 . 5.34 1375 988 A 39 GLN HE21 A 38 GLU HG3 1.0 . 5.34 1376 988 A 39 GLN HE22 A 38 GLU HG3 1.0 . 5.34 1377 988 A 39 GLN HE21 A 38 GLU HG2 1.0 . 5.34 1378 989 A 39 GLN H A 40 GLY HA3 1.0 . 5.34 1379 989 A 39 GLN H A 40 GLY HA2 1.0 . 5.34 1380 990 A 41 TRP HD1 A 39 GLN HB2 1.0 . 2.86 1381 990 A 41 TRP HD1 A 39 GLN HB3 1.0 . 2.86 1382 991 A 41 TRP HD1 A 39 GLN HG3 1.0 . 4.01 1383 991 A 41 TRP HD1 A 39 GLN HG2 1.0 . 4.01 1384 992 A 55 PRO HA A 40 GLY HA3 1.0 . 5.34 1385 992 A 55 PRO HA A 40 GLY HA2 1.0 . 5.34 1386 993 A 41 TRP HD1 A 53 LEU HD2% 1.0 . 4.79 1387 993 A 41 TRP HD1 A 53 LEU HD1% 1.0 . 4.79 1388 994 A 41 TRP HZ3 A 53 LEU HD2% 1.0 . 4.52 1389 994 A 41 TRP HZ3 A 53 LEU HD1% 1.0 . 4.52 1390 995 A 41 TRP HH2 A 53 LEU HD2% 1.0 . 5.44 1391 995 A 41 TRP HH2 A 53 LEU HD1% 1.0 . 5.44 1392 996 A 42 CYS HA A 53 LEU HD2% 1.0 . 5.44 1393 996 A 53 LEU HD1% A 42 CYS HA 1.0 . 5.44 1394 997 A 43 LYS H A 43 LYS HD2 1.0 . 5.34 1395 997 A 43 LYS H A 43 LYS HD3 1.0 . 5.34 1396 998 A 43 LYS H A 53 LEU HD2% 1.0 . 5.44 1397 998 A 43 LYS H A 53 LEU HD1% 1.0 . 5.44 1398 999 A 43 LYS HA A 53 LEU HD2% 1.0 . 5.44 1399 999 A 43 LYS HA A 53 LEU HD1% 1.0 . 5.44 1400 1000 A 43 LYS HB3 A 43 LYS HE3 1.0 . 5.34 1401 1000 A 43 LYS HE2 A 43 LYS HB2 1.0 . 5.34 1402 1000 A 43 LYS HB3 A 43 LYS HE2 1.0 . 5.34 1403 1000 A 43 LYS HB2 A 43 LYS HE3 1.0 . 5.34 1404 1001 A 43 LYS HD3 A 51 VAL HG2% 1.0 . 4.85 1405 1001 A 43 LYS HD2 A 51 VAL HG2% 1.0 . 4.85 1406 1001 A 51 VAL HG1% A 43 LYS HD2 1.0 . 4.85 1407 1001 A 43 LYS HD3 A 51 VAL HG1% 1.0 . 4.85 1408 1002 A 52 GLY H A 43 LYS HD2 1.0 . 5.34 1409 1002 A 52 GLY H A 43 LYS HD3 1.0 . 5.34 1410 1003 A 43 LYS HD3 A 52 GLY HA3 1.0 . 5.18 1411 1003 A 43 LYS HD2 A 52 GLY HA3 1.0 . 5.18 1412 1003 A 52 GLY HA2 A 43 LYS HD2 1.0 . 5.18 1413 1003 A 52 GLY HA2 A 43 LYS HD3 1.0 . 5.18 1414 1004 A 43 LYS HE2 A 51 VAL HG2% 1.0 . 4.53 1415 1004 A 43 LYS HE3 A 51 VAL HG2% 1.0 . 4.53 1416 1004 A 51 VAL HG1% A 43 LYS HE3 1.0 . 4.53 1417 1004 A 51 VAL HG1% A 43 LYS HE2 1.0 . 4.53 1418 1005 A 53 LEU HA A 43 LYS HE3 1.0 . 5.34 1419 1005 A 53 LEU HA A 43 LYS HE2 1.0 . 5.34 1420 1006 A 53 LEU HB2 A 43 LYS HE3 1.0 . 5.34 1421 1006 A 53 LEU HB2 A 43 LYS HE2 1.0 . 5.34 1422 1007 A 53 LEU HB3 A 43 LYS HE3 1.0 . 5.34 1423 1007 A 53 LEU HB3 A 43 LYS HE2 1.0 . 5.34 1424 1008 A 53 LEU HG A 43 LYS HE3 1.0 . 5.34 1425 1008 A 53 LEU HG A 43 LYS HE2 1.0 . 5.34 1426 1009 A 43 LYS HE3 A 53 LEU HD2% 1.0 . 4.53 1427 1009 A 43 LYS HE2 A 53 LEU HD2% 1.0 . 4.53 1428 1009 A 53 LEU HD1% A 43 LYS HE3 1.0 . 4.53 1429 1009 A 53 LEU HD1% A 43 LYS HE2 1.0 . 4.53 1430 1010 A 44 GLY H A 51 VAL HG2% 1.0 . 5.44 1431 1010 A 44 GLY H A 51 VAL HG1% 1.0 . 5.44 1432 1011 A 44 GLY H A 53 LEU HD2% 1.0 . 5.44 1433 1011 A 44 GLY H A 53 LEU HD1% 1.0 . 5.44 1434 1012 A 45 ARG HA A 46 LEU HD2% 1.0 . 5.44 1435 1012 A 45 ARG HA A 46 LEU HD1% 1.0 . 5.44 1436 1013 A 45 ARG HA A 51 VAL HG2% 1.0 . 5.44 1437 1013 A 45 ARG HA A 51 VAL HG1% 1.0 . 5.44 1438 1014 A 45 ARG HB3 A 46 LEU HD2% 1.0 . 5.28 1439 1014 A 45 ARG HB2 A 46 LEU HD2% 1.0 . 5.28 1440 1014 A 46 LEU HD1% A 45 ARG HB3 1.0 . 5.28 1441 1014 A 46 LEU HD1% A 45 ARG HB2 1.0 . 5.28 1442 1015 A 45 ARG HB3 A 51 VAL HG2% 1.0 . 4.85 1443 1015 A 45 ARG HB2 A 51 VAL HG2% 1.0 . 4.85 1444 1015 A 51 VAL HG1% A 45 ARG HB3 1.0 . 4.85 1445 1015 A 45 ARG HB2 A 51 VAL HG1% 1.0 . 4.85 1446 1016 A 46 LEU H A 45 ARG HG2 1.0 . 5.34 1447 1016 A 46 LEU H A 45 ARG HG3 1.0 . 5.34 1448 1017 A 49 GLY H A 45 ARG HG2 1.0 . 5.34 1449 1017 A 49 GLY H A 45 ARG HG3 1.0 . 5.34 1450 1018 A 45 ARG HG3 A 51 VAL HG2% 1.0 . 4.85 1451 1018 A 45 ARG HG2 A 51 VAL HG2% 1.0 . 4.85 1452 1018 A 51 VAL HG1% A 45 ARG HG2 1.0 . 4.85 1453 1018 A 51 VAL HG1% A 45 ARG HG3 1.0 . 4.85 1454 1019 A 45 ARG HD2 A 51 VAL HG2% 1.0 . 5.44 1455 1019 A 45 ARG HD3 A 51 VAL HG2% 1.0 . 5.44 1456 1019 A 51 VAL HG1% A 45 ARG HD2 1.0 . 5.44 1457 1019 A 45 ARG HD3 A 51 VAL HG1% 1.0 . 5.44 1458 1020 A 46 LEU H A 49 GLY HA3 1.0 . 5.34 1459 1020 A 46 LEU H A 49 GLY HA2 1.0 . 5.34 1460 1021 A 46 LEU H A 51 VAL HG2% 1.0 . 5.44 1461 1021 A 46 LEU H A 51 VAL HG1% 1.0 . 5.44 1462 1022 A 47 LEU HA A 46 LEU HD2% 1.0 . 5.44 1463 1022 A 46 LEU HD1% A 47 LEU HA 1.0 . 5.44 1464 1023 A 46 LEU HD1% A 47 LEU HB2 1.0 . 5.28 1465 1023 A 46 LEU HD2% A 47 LEU HB2 1.0 . 5.28 1466 1023 A 47 LEU HB3 A 46 LEU HD2% 1.0 . 5.28 1467 1023 A 46 LEU HD1% A 47 LEU HB3 1.0 . 5.28 1468 1024 A 48 THR HB A 46 LEU HD2% 1.0 . 5.44 1469 1024 A 46 LEU HD1% A 48 THR HB 1.0 . 5.44 1470 1025 A 46 LEU HD2% A 50 HIS HB2 1.0 . 4.85 1471 1025 A 46 LEU HD1% A 50 HIS HB2 1.0 . 4.85 1472 1025 A 50 HIS HB3 A 46 LEU HD2% 1.0 . 4.85 1473 1025 A 46 LEU HD1% A 50 HIS HB3 1.0 . 4.85 1474 1026 A 50 HIS HD2 A 46 LEU HD2% 1.0 . 4.25 1475 1026 A 50 HIS HD2 A 46 LEU HD1% 1.0 . 4.25 1476 1027 A 48 THR HA A 47 LEU HB2 1.0 . 5.34 1477 1027 A 48 THR HA A 47 LEU HB3 1.0 . 5.34 1478 1028 A 48 THR HG2% A 47 LEU HB2 1.0 . 5.34 1479 1028 A 48 THR HG2% A 47 LEU HB3 1.0 . 5.34 1480 1029 A 48 THR H A 49 GLY HA3 1.0 . 5.34 1481 1029 A 48 THR H A 49 GLY HA2 1.0 . 5.34 1482 1030 A 48 THR HA A 49 GLY HA3 1.0 . 5.34 1483 1030 A 48 THR HA A 49 GLY HA2 1.0 . 5.34 1484 1031 A 49 GLY H A 50 HIS HB2 1.0 . 5.34 1485 1031 A 49 GLY H A 50 HIS HB3 1.0 . 5.34 1486 1032 A 50 HIS H A 51 VAL HG2% 1.0 . 5.44 1487 1032 A 50 HIS H A 51 VAL HG1% 1.0 . 5.44 1488 1033 A 50 HIS HA A 51 VAL HG2% 1.0 . 5.44 1489 1033 A 51 VAL HG1% A 50 HIS HA 1.0 . 5.44 1490 1034 A 50 HIS HD2 A 50 HIS HB2 1.0 . 3.30 1491 1034 A 50 HIS HD2 A 50 HIS HB3 1.0 . 3.30 1492 1035 A 51 VAL HG1% A 52 GLY HA3 1.0 . 4.85 1493 1035 A 51 VAL HG2% A 52 GLY HA3 1.0 . 4.85 1494 1035 A 52 GLY HA2 A 51 VAL HG2% 1.0 . 4.85 1495 1035 A 52 GLY HA2 A 51 VAL HG1% 1.0 . 4.85 1496 1036 A 54 TYR HD% A 59 VAL HG2% 1.0 . 3.42 1497 1036 A 54 TYR HD% A 59 VAL HG1% 1.0 . 3.42 1498 1037 A 54 TYR HE% A 59 VAL HG2% 1.0 . 3.43 1499 1037 A 54 TYR HE% A 59 VAL HG1% 1.0 . 3.43 1500 1038 A 56 ALA HA A 59 VAL HG2% 1.0 . 5.44 1501 1038 A 56 ALA HA A 59 VAL HG1% 1.0 . 5.44 1502 1039 A 56 ALA HB% A 57 ASN HB3 1.0 . 5.34 1503 1039 A 56 ALA HB% A 57 ASN HB2 1.0 . 5.34 1504 1040 A 56 ALA HB% A 59 VAL HG2% 1.0 . 5.44 1505 1040 A 56 ALA HB% A 59 VAL HG1% 1.0 . 5.44 1506 1041 A 58 TYR HD% A 57 ASN HB3 1.0 . 4.10 1507 1041 A 58 TYR HD% A 57 ASN HB2 1.0 . 4.10 1508 1042 A 58 TYR HA A 59 VAL HG2% 1.0 . 5.44 1509 1042 A 58 TYR HA A 59 VAL HG1% 1.0 . 5.44 1510 1043 A 58 TYR HB2 A 59 VAL HG2% 1.0 . 5.44 1511 1043 A 58 TYR HB3 A 59 VAL HG2% 1.0 . 5.44 1512 1043 A 59 VAL HG1% A 58 TYR HB2 1.0 . 5.44 1513 1043 A 58 TYR HB3 A 59 VAL HG1% 1.0 . 5.44 1514 1044 A 62 VAL H A 61 LYS HG3 1.0 . 5.34 1515 1044 A 62 VAL H A 61 LYS HG2 1.0 . 5.34 1516 1045 A 62 VAL HA A 61 LYS HG3 1.0 . 5.34 1517 1045 A 62 VAL HA A 61 LYS HG2 1.0 . 5.34 1518 1046 A 61 LYS HE2 A 62 VAL HG2% 1.0 . 5.44 1519 1046 A 62 VAL HG1% A 61 LYS HE2 1.0 . 5.44 1520 1046 A 61 LYS HE3 A 62 VAL HG1% 1.0 . 5.44 1521 1046 A 61 LYS HE3 A 62 VAL HG2% 1.0 . 5.44 1522 1047 A 62 VAL HA A 62 VAL HG2% 1.0 . 2.39 1523 1047 A 62 VAL HA A 62 VAL HG1% 1.0 . 2.39 1524 1048 A 63 GLY H A 62 VAL HG2% 1.0 . 5.44 1525 1048 A 63 GLY H A 62 VAL HG1% 1.0 . 5.44 1526 1049 A 64 LEU H A 63 GLY HA2 1.0 . 2.50 1527 1049 A 64 LEU H A 63 GLY HA3 1.0 . 2.50 1528 1050 A 65 ALA HB% A 64 LEU HD1% 1.0 . 5.44 1529 1050 A 65 ALA HB% A 64 LEU HD2% 1.0 . 5.44 1530 1051 A 67 ALA HB% A 64 LEU HD1% 1.0 . 5.44 1531 1051 A 67 ALA HB% A 64 LEU HD2% 1.0 . 5.44 1532 1052 B 106 PRO HBy A 14 TYR HD% 1.0 . 4.50 1533 1053 A 14 TYR HD% B 106 PRO HGx 1.0 . 3.50 1534 1053 B 106 PRO HGy A 14 TYR HD% 1.0 . 3.50 1535 1054 B 106 PRO HBx A 14 TYR HD% 1.0 . 3.50 1536 1055 A 57 ASN HD21 B 106 PRO HGx 1.0 . 6.00 1537 1055 B 106 PRO HGy A 57 ASN HD21 1.0 . 6.00 1538 1056 B 106 PRO HBx A 57 ASN HD21 1.0 . 6.00 1539 1057 B 110 PRO HBx A 58 TYR HD% 1.0 . 6.00 1540 1058 A 41 TRP HD1 B 105 ALA H 1.0 . 4.50 1541 1059 A 41 TRP HE1 B 105 ALA H 1.0 . 4.50 1542 1060 A 57 ASN HD21 B 106 PRO HDy 1.0 . 6.00 1543 1061 A 12 TYR HD% B 112 LEU HD21 1.0 . 3.50 1544 1062 A 12 TYR HD% B 111 ILE HG1x 1.0 . 3.50 1545 1063 A 41 TRP HD1 B 105 ALA H 1.0 . 4.50 1546 1064 A 41 TRP HZ2 B 105 ALA H 1.0 . 4.50 1547 1065 B 101 THR HG21 A 39 GLN HG3 1.0 . 3.50 1548 1066 B 101 THR HG21 A 39 GLN HG2 1.0 . 3.50 1549 1067 B 101 THR HG21 A 53 LEU HD1% 1.0 . 4.50 1550 1068 B 104 PRO HA A 39 GLN HG3 1.0 . 3.50 1551 1069 B 104 PRO HA A 39 GLN HB3 1.0 . 4.50 1552 1070 B 104 PRO HA A 39 GLN HG2 1.0 . 3.50 1553 1071 A 39 GLN HB3 B 105 ALA H 1.0 . 3.50 1554 1072 B 105 ALA H A 39 GLN HG3 1.0 . 3.50 1555 1073 A 41 TRP HZ2 B 105 ALA H 1.0 . 4.50 1556 1074 A 41 TRP HD1 B 105 ALA H 1.0 . 6.00 1557 1075 B 107 ASN HA A 57 ASN HB2 1.0 . 6.00 1558 1076 B 107 ASN HA A 57 ASN HB3 1.0 . 6.00 1559 1077 B 111 ILE HD11 A 12 TYR HE% 1.0 . 3.50 1560 1078 B 111 ILE HD11 A 12 TYR HD% 1.0 . 4.50 1561 1079 A 12 TYR HE% B 112 LEU HA 1.0 . 6.00 1562 1080 B 110 PRO HBy B 111 ILE H 1.0 . 4.00 1563 1081 B 110 PRO HBx B 111 ILE H 1.0 . 4.00 1564 1082 B 111 ILE H B 110 PRO HGx 1.0 . 5.50 1565 1082 B 110 PRO HGy B 111 ILE H 1.0 . 5.50 1566 1083 B 110 PRO HBx B 111 ILE HD11 1.0 . 5.50 1567 1084 B 102 LYS HA B 103 GLY H 1.0 . 4.00 1568 1085 B 115 TRP H B 113 LYS HEx 1.0 . 5.50 1569 1085 B 113 LYS HEy B 115 TRP H 1.0 . 5.50 1570 1086 B 106 PRO HBy B 107 ASN H 1.0 . 4.00 1571 1087 B 106 PRO HBx B 107 ASN H 1.0 . 4.00 1572 1088 B 107 ASN H B 106 PRO HGx 1.0 . 5.50 1573 1088 B 106 PRO HGy B 107 ASN H 1.0 . 5.50 1574 1089 B 105 ALA HB1 B 106 PRO HGx 1.0 . 5.50 1575 1089 B 106 PRO HGy B 105 ALA HB1 1.0 . 5.50 1576 1090 B 105 ALA HB1 B 106 PRO HGx 1.0 . 5.50 1577 1090 B 106 PRO HGy B 105 ALA HB1 1.0 . 5.50 1578 1091 B 107 ASN HBy B 108 PRO HDx 1.0 . 4.00 1579 1091 B 107 ASN HBx B 108 PRO HDx 1.0 . 4.00 1580 1091 B 108 PRO HDy B 107 ASN HBx 1.0 . 4.00 1581 1091 B 108 PRO HDy B 107 ASN HBy 1.0 . 4.00 stop_ save_ save_spectral_peak_list_1 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_1 _nef_nmr_spectrum.experiment_classification . _nef_nmr_spectrum.experiment_type . _nef_nmr_spectrum.num_dimensions 3 _nef_nmr_spectrum.chemical_shift_list . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectrometer_frequency _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.value_first_point _nef_spectrum_dimension.folding _nef_spectrum_dimension.absolute_peak_positions _nef_spectrum_dimension.is_acquisition 1 ppm . . 21 . . . . 2 ppm . . 66.3 . . . . 3 ppm . . 12 . . . . stop_ save_ save_spectral_peak_list_2 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_2 _nef_nmr_spectrum.experiment_classification . _nef_nmr_spectrum.experiment_type . _nef_nmr_spectrum.num_dimensions 3 _nef_nmr_spectrum.chemical_shift_list . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectrometer_frequency _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.value_first_point _nef_spectrum_dimension.folding _nef_spectrum_dimension.absolute_peak_positions _nef_spectrum_dimension.is_acquisition 1 ppm . . 11 . . . . 2 ppm . . 26 . . . . 3 ppm . . 12 . . . . stop_ save_ save_spectral_peak_list_3 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_3 _nef_nmr_spectrum.experiment_classification . _nef_nmr_spectrum.experiment_type . _nef_nmr_spectrum.num_dimensions 3 _nef_nmr_spectrum.chemical_shift_list . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectrometer_frequency _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.value_first_point _nef_spectrum_dimension.folding _nef_spectrum_dimension.absolute_peak_positions _nef_spectrum_dimension.is_acquisition 1 ppm . . 18 . . . . 2 ppm . . 30 . . . . 3 ppm . . 12.6 . . . . stop_ save_