data_nef_c34176_6ehz 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 6EHZ stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 9 CYS SG 1 34 CYS SG 1 11 CYS SG 1 50 CYS SG stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 LYS start . . 2 A 2 PRO middle . false 3 A 3 VAL middle . . 4 A 4 SER middle . . 5 A 5 LEU middle . . 6 A 6 SER middle . . 7 A 7 TYR middle . . 8 A 8 ARG middle . . 9 A 9 CYS middle -HG . 10 A 10 PRO middle . false 11 A 11 CYS middle -HG . 12 A 12 ARG middle . . 13 A 13 PHE middle . . 14 A 14 PHE middle . . 15 A 15 GLU middle . . 16 A 16 SER middle . . 17 A 17 HIS middle . . 18 A 18 ILE middle . . 19 A 19 ALA middle . . 20 A 20 ARG middle . . 21 A 21 ALA middle . . 22 A 22 ASN middle . . 23 A 23 VAL middle . . 24 A 24 LYS middle . . 25 A 25 HIS middle . . 26 A 26 LEU middle . . 27 A 27 LYS middle . . 28 A 28 ILE middle . . 29 A 29 LEU middle . . 30 A 30 ASN middle . . 31 A 31 THR middle . . 32 A 32 PRO middle . false 33 A 33 ASN middle . . 34 A 34 CYS middle -HG . 35 A 35 ALA middle . . 36 A 36 LEU middle . . 37 A 37 GLN middle . . 38 A 38 ILE middle . . 39 A 39 VAL middle . . 40 A 40 ALA middle . . 41 A 41 ARG middle . . 42 A 42 LEU middle . . 43 A 43 LYS middle . . 44 A 44 ASN middle . . 45 A 45 ASN middle . . 46 A 46 ASN middle . . 47 A 47 ARG middle . . 48 A 48 GLN middle . . 49 A 49 VAL middle . . 50 A 50 CYS middle -HG . 51 A 51 ILE middle . . 52 A 52 ASP middle . . 53 A 53 PRO middle . false 54 A 54 LYS middle . . 55 A 55 LEU middle . . 56 A 56 LYS middle . . 57 A 57 TRP middle . . 58 A 58 ILE middle . . 59 A 59 GLN middle . . 60 A 60 GLU middle . . 61 A 61 TYR middle . . 62 A 62 LEU middle . . 63 A 63 GLU middle . . 64 A 64 LYS middle . . 65 A 65 ALA middle . . 66 A 66 LEU middle . . 67 A 67 ASN middle . . 68 A 68 LYS middle . . 69 A 69 GLY middle . false 70 A 70 ARG middle . . 71 A 71 ARG middle . . 72 A 72 GLU middle . . 73 A 73 GLU middle . . 74 A 74 LYS middle . . 75 A 75 VAL middle . . 76 A 76 GLY middle . false 77 A 77 LYS middle . . 78 A 78 LYS middle . . 79 A 79 GLU middle . . 80 A 80 LYS middle . . 81 A 81 ILE middle . . 82 A 82 GLY middle . false 83 A 83 LYS middle . . 84 A 84 LYS middle . . 85 A 85 LYS middle . . 86 A 86 ARG middle . . 87 A 87 GLN middle . . 88 A 88 LYS middle . . 89 A 89 LYS middle . . 90 A 90 ARG middle . . 91 A 91 LYS middle . . 92 A 92 ALA middle . . 93 A 93 ALA middle . . 94 A 94 GLN middle . . 95 A 95 LYS middle . . 96 A 96 ARG middle . . 97 A 97 LYS middle . . 98 A 98 ASN 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 2 PRO HA H 1 4.450 0.000 A 2 PRO HBy H 1 2.271 0.000 A 2 PRO HBx H 1 1.871 0.000 A 2 PRO HDx H 1 3.626 0.000 A 2 PRO HDy H 1 3.848 0.000 A 2 PRO HGx H 1 2.012 0.000 A 2 PRO C C 13 176.881 0.000 A 2 PRO CA C 13 63.042 0.000 A 2 PRO CB C 13 32.110 0.000 A 2 PRO CD C 13 50.786 0.000 A 2 PRO CG C 13 27.462 0.000 A 3 VAL H H 1 8.251 0.003 A 3 VAL HA H 1 4.074 0.000 A 3 VAL HB H 1 2.038 0.000 A 3 VAL HGx% H 1 0.934 0.000 A 3 VAL C C 13 176.295 0.000 A 3 VAL CA C 13 62.343 0.000 A 3 VAL CB C 13 32.865 0.000 A 3 VAL CGx C 13 20.441 0.000 A 3 VAL N N 15 120.720 0.023 A 4 SER H H 1 8.309 0.003 A 4 SER HA H 1 4.431 0.000 A 4 SER HBx H 1 3.806 0.000 A 4 SER C C 13 174.490 0.000 A 4 SER CA C 13 57.995 0.000 A 4 SER CB C 13 63.779 0.000 A 4 SER N N 15 119.258 0.012 A 5 LEU H H 1 8.312 0.005 A 5 LEU HA H 1 4.340 0.000 A 5 LEU HBy H 1 1.582 0.000 A 5 LEU HBx H 1 1.490 0.000 A 5 LEU HDx% H 1 0.887 0.000 A 5 LEU HDy% H 1 0.832 0.000 A 5 LEU HG H 1 1.500 0.000 A 5 LEU C C 13 177.201 0.000 A 5 LEU CA C 13 55.254 0.000 A 5 LEU CB C 13 42.356 0.000 A 5 LEU CDy C 13 24.885 0.067 A 5 LEU CDx C 13 23.327 0.022 A 5 LEU CG C 13 27.023 0.000 A 5 LEU N N 15 124.874 0.034 A 6 SER H H 1 8.152 0.004 A 6 SER HA H 1 4.364 0.000 A 6 SER HBx H 1 3.761 0.000 A 6 SER C C 13 174.168 0.000 A 6 SER CA C 13 58.252 0.000 A 6 SER CB C 13 63.779 0.000 A 6 SER N N 15 115.991 0.020 A 7 TYR H H 1 8.001 0.010 A 7 TYR HA H 1 4.526 0.005 A 7 TYR HBy H 1 3.030 0.004 A 7 TYR HBx H 1 2.900 0.007 A 7 TYR HDx H 1 7.086 0.007 A 7 TYR HDy H 1 7.086 0.007 A 7 TYR HEx H 1 6.809 0.000 A 7 TYR HEy H 1 6.809 0.000 A 7 TYR C C 13 175.538 0.000 A 7 TYR CA C 13 57.807 0.000 A 7 TYR CB C 13 38.811 0.005 A 7 TYR CDx C 13 133.391 0.025 A 7 TYR CDy C 13 133.391 0.025 A 7 TYR CEx C 13 118.790 0.000 A 7 TYR CEy C 13 118.790 0.000 A 7 TYR N N 15 122.024 0.054 A 8 ARG H H 1 8.135 0.008 A 8 ARG HA H 1 4.326 0.000 A 8 ARG HBy H 1 1.763 0.000 A 8 ARG HBx H 1 1.676 0.001 A 8 ARG HDy H 1 3.131 0.000 A 8 ARG HDx H 1 2.981 0.000 A 8 ARG HGx H 1 1.408 0.000 A 8 ARG HGy H 1 1.507 0.000 A 8 ARG C C 13 175.879 0.000 A 8 ARG CA C 13 56.006 0.000 A 8 ARG CB C 13 30.846 0.000 A 8 ARG CD C 13 43.324 0.000 A 8 ARG CG C 13 27.053 0.000 A 8 ARG N N 15 122.002 0.072 A 9 CYS H H 1 8.111 0.002 A 9 CYS HA H 1 4.929 0.000 A 9 CYS HBx H 1 2.699 0.000 A 9 CYS HBy H 1 3.205 0.000 A 9 CYS CA C 13 52.982 0.000 A 9 CYS CB C 13 40.019 0.000 A 9 CYS N N 15 120.968 0.031 A 10 PRO HA H 1 4.296 0.000 A 10 PRO HBy H 1 2.287 0.000 A 10 PRO HBx H 1 1.878 0.000 A 10 PRO HDx H 1 3.842 0.000 A 10 PRO HGx H 1 2.033 0.000 A 10 PRO C C 13 177.600 0.000 A 10 PRO CA C 13 64.841 0.000 A 10 PRO CB C 13 32.164 0.000 A 10 PRO CD C 13 51.069 0.000 A 10 PRO CG C 13 27.457 0.000 A 11 CYS H H 1 8.252 0.002 A 11 CYS HA H 1 4.874 0.000 A 11 CYS HBx H 1 2.723 0.000 A 11 CYS HBy H 1 2.916 0.000 A 11 CYS C C 13 174.199 0.000 A 11 CYS CA C 13 53.466 0.000 A 11 CYS CB C 13 40.398 0.000 A 11 CYS N N 15 114.311 0.009 A 12 ARG H H 1 8.301 0.004 A 12 ARG HA H 1 4.035 0.000 A 12 ARG HBx H 1 1.560 0.000 A 12 ARG HDx H 1 2.967 0.000 A 12 ARG HGx H 1 1.202 0.000 A 12 ARG HGy H 1 1.291 0.000 A 12 ARG C C 13 175.011 0.000 A 12 ARG CA C 13 57.022 0.000 A 12 ARG CB C 13 31.148 0.000 A 12 ARG CD C 13 43.163 0.000 A 12 ARG CG C 13 26.825 0.000 A 12 ARG N N 15 122.268 0.028 A 13 PHE H H 1 7.524 0.005 A 13 PHE HA H 1 4.537 0.000 A 13 PHE HBx H 1 2.822 0.000 A 13 PHE HBy H 1 3.089 0.008 A 13 PHE HDx H 1 7.324 0.001 A 13 PHE HDy H 1 7.324 0.001 A 13 PHE HEx H 1 7.181 0.002 A 13 PHE HEy H 1 7.181 0.002 A 13 PHE C C 13 174.067 0.000 A 13 PHE CA C 13 55.879 0.000 A 13 PHE CB C 13 40.921 0.000 A 13 PHE CDy C 13 133.124 0.084 A 13 PHE CEy C 13 131.474 0.107 A 13 PHE N N 15 116.295 0.006 A 14 PHE H H 1 8.265 0.004 A 14 PHE HA H 1 4.769 0.000 A 14 PHE HBx H 1 2.756 0.011 A 14 PHE HDx H 1 7.266 0.018 A 14 PHE HDy H 1 7.266 0.018 A 14 PHE HEx H 1 6.984 0.003 A 14 PHE HEy H 1 6.984 0.003 A 14 PHE C C 13 175.023 0.000 A 14 PHE CA C 13 55.618 0.000 A 14 PHE CB C 13 41.077 0.000 A 14 PHE CDx C 13 131.989 0.000 A 14 PHE CEx C 13 131.223 0.030 A 14 PHE N N 15 119.606 0.036 A 15 GLU H H 1 8.898 0.002 A 15 GLU HA H 1 4.589 0.000 A 15 GLU HBy H 1 2.161 0.000 A 15 GLU HBx H 1 1.952 0.000 A 15 GLU HGy H 1 2.424 0.000 A 15 GLU HGx H 1 2.245 0.000 A 15 GLU C C 13 176.560 0.000 A 15 GLU CA C 13 55.817 0.000 A 15 GLU CB C 13 31.157 0.000 A 15 GLU CG C 13 36.194 0.000 A 15 GLU N N 15 121.874 0.027 A 16 SER H H 1 8.796 0.002 A 16 SER HA H 1 4.783 0.000 A 16 SER HBy H 1 3.875 0.000 A 16 SER HBx H 1 3.623 0.000 A 16 SER C C 13 174.294 0.000 A 16 SER CA C 13 58.916 0.000 A 16 SER CB C 13 64.478 0.000 A 16 SER N N 15 118.432 0.044 A 17 HIS H H 1 8.947 0.016 A 17 HIS HA H 1 4.906 0.000 A 17 HIS HBy H 1 3.332 0.000 A 17 HIS HBx H 1 3.200 0.000 A 17 HIS HD2 H 1 7.256 0.000 A 17 HIS HE1 H 1 8.354 0.000 A 17 HIS CA C 13 55.172 0.000 A 17 HIS CB C 13 28.203 0.000 A 17 HIS CD2 C 13 119.900 0.000 A 17 HIS CE1 C 13 137.286 0.000 A 17 HIS N N 15 120.667 0.000 A 18 ILE H H 1 7.139 0.002 A 18 ILE HA H 1 4.384 0.000 A 18 ILE HB H 1 1.808 0.000 A 18 ILE HD1% H 1 0.805 0.001 A 18 ILE HG1y H 1 1.424 0.000 A 18 ILE HG1x H 1 1.233 0.000 A 18 ILE HG2% H 1 0.866 0.002 A 18 ILE C C 13 173.750 0.000 A 18 ILE CA C 13 59.014 0.000 A 18 ILE CB C 13 39.804 0.000 A 18 ILE CD1 C 13 13.035 0.051 A 18 ILE CG1 C 13 27.844 0.000 A 18 ILE CG2 C 13 17.876 0.043 A 18 ILE N N 15 119.092 0.030 A 19 ALA H H 1 8.449 0.001 A 19 ALA HA H 1 4.403 0.000 A 19 ALA HB% H 1 1.286 0.001 A 19 ALA C C 13 177.248 0.000 A 19 ALA CA C 13 50.524 0.000 A 19 ALA CB C 13 19.884 0.012 A 19 ALA N N 15 130.707 0.014 A 20 ARG H H 1 7.683 0.002 A 20 ARG HA H 1 2.605 0.000 A 20 ARG HBx H 1 0.333 0.000 A 20 ARG HBy H 1 1.001 0.003 A 20 ARG HDx H 1 2.728 0.000 A 20 ARG HDy H 1 2.731 0.000 A 20 ARG HGx H 1 0.853 0.000 A 20 ARG HGy H 1 1.122 0.000 A 20 ARG C C 13 178.301 0.000 A 20 ARG CA C 13 58.729 0.000 A 20 ARG CB C 13 29.012 0.000 A 20 ARG CD C 13 43.262 0.000 A 20 ARG CG C 13 26.493 0.000 A 20 ARG N N 15 123.653 0.027 A 21 ALA H H 1 8.077 0.001 A 21 ALA HA H 1 4.027 0.000 A 21 ALA HB% H 1 1.240 0.000 A 21 ALA C C 13 177.798 0.000 A 21 ALA CA C 13 53.581 0.000 A 21 ALA CB C 13 18.455 0.013 A 21 ALA N N 15 116.979 0.007 A 22 ASN H H 1 7.706 0.004 A 22 ASN HA H 1 4.883 0.000 A 22 ASN HBy H 1 3.091 0.000 A 22 ASN HBx H 1 2.713 0.000 A 22 ASN HD2y H 1 7.658 0.001 A 22 ASN HD2x H 1 7.089 0.001 A 22 ASN C C 13 175.097 0.000 A 22 ASN CA C 13 53.094 0.000 A 22 ASN CB C 13 40.349 0.000 A 22 ASN CG C 13 176.885 0.000 A 22 ASN N N 15 112.246 0.043 A 22 ASN ND2 N 15 111.389 0.020 A 23 VAL H H 1 7.482 0.002 A 23 VAL HA H 1 4.643 0.000 A 23 VAL HB H 1 2.084 0.000 A 23 VAL HGx% H 1 0.834 0.003 A 23 VAL HGy% H 1 0.779 0.002 A 23 VAL C C 13 174.163 0.000 A 23 VAL CA C 13 61.391 0.000 A 23 VAL CB C 13 34.139 0.000 A 23 VAL CGx C 13 20.400 0.033 A 23 VAL CGy C 13 22.318 0.025 A 23 VAL N N 15 116.369 0.020 A 24 LYS H H 1 9.215 0.006 A 24 LYS HA H 1 4.474 0.000 A 24 LYS HBx H 1 1.505 0.000 A 24 LYS HDx H 1 1.541 0.000 A 24 LYS HEx H 1 2.822 0.000 A 24 LYS HGy H 1 1.142 0.000 A 24 LYS HGx H 1 1.020 0.000 A 24 LYS C C 13 174.902 0.000 A 24 LYS CA C 13 55.829 0.000 A 24 LYS CB C 13 35.200 0.000 A 24 LYS CD C 13 29.633 0.000 A 24 LYS CE C 13 42.241 0.000 A 24 LYS CG C 13 24.281 0.000 A 24 LYS N N 15 122.755 0.033 A 25 HIS H H 1 8.204 0.003 A 25 HIS HA H 1 4.567 0.000 A 25 HIS HBx H 1 3.165 0.000 A 25 HIS HD2 H 1 6.981 0.003 A 25 HIS HE1 H 1 8.026 0.002 A 25 HIS CA C 13 55.590 0.000 A 25 HIS CB C 13 30.621 0.000 A 25 HIS CD2 C 13 119.321 0.079 A 25 HIS CE1 C 13 138.151 0.004 A 25 HIS N N 15 115.149 0.011 A 26 LEU H H 1 8.077 0.003 A 26 LEU HA H 1 4.845 0.000 A 26 LEU HBx H 1 1.198 0.000 A 26 LEU HBy H 1 1.305 0.000 A 26 LEU HDx% H 1 0.490 0.006 A 26 LEU HDy% H 1 0.436 0.005 A 26 LEU HG H 1 1.329 0.000 A 26 LEU C C 13 176.202 0.000 A 26 LEU CA C 13 55.350 0.000 A 26 LEU CB C 13 44.520 0.000 A 26 LEU CDy C 13 25.183 0.034 A 26 LEU CG C 13 27.059 0.000 A 26 LEU N N 15 121.370 0.035 A 27 LYS H H 1 9.108 0.005 A 27 LYS HA H 1 4.603 0.000 A 27 LYS HBy H 1 1.765 0.000 A 27 LYS HBx H 1 1.655 0.000 A 27 LYS HDx H 1 1.624 0.000 A 27 LYS HEx H 1 2.892 0.000 A 27 LYS HGx H 1 1.314 0.000 A 27 LYS C C 13 173.692 0.000 A 27 LYS CA C 13 55.417 0.000 A 27 LYS CB C 13 36.001 0.000 A 27 LYS CD C 13 29.765 0.000 A 27 LYS CG C 13 24.597 0.000 A 27 LYS N N 15 123.707 0.008 A 28 ILE H H 1 8.433 0.005 A 28 ILE HA H 1 4.567 0.000 A 28 ILE HB H 1 1.743 0.000 A 28 ILE HD1% H 1 0.813 0.010 A 28 ILE HG1x H 1 0.982 0.000 A 28 ILE HG1y H 1 1.663 0.000 A 28 ILE HG2% H 1 0.809 0.001 A 28 ILE C C 13 176.060 0.000 A 28 ILE CA C 13 60.713 0.000 A 28 ILE CB C 13 38.802 0.000 A 28 ILE CD1 C 13 13.828 0.040 A 28 ILE CG1 C 13 28.163 0.000 A 28 ILE CG2 C 13 18.008 0.046 A 28 ILE N N 15 123.239 0.008 A 29 LEU H H 1 9.059 0.005 A 29 LEU HA H 1 4.585 0.000 A 29 LEU HBy H 1 1.643 0.000 A 29 LEU HBx H 1 1.539 0.000 A 29 LEU HDx% H 1 0.794 0.004 A 29 LEU HG H 1 0.827 0.000 A 29 LEU C C 13 175.739 0.000 A 29 LEU CA C 13 54.133 0.000 A 29 LEU CB C 13 43.351 0.000 A 29 LEU CDx C 13 23.719 0.075 A 29 LEU CG C 13 25.209 0.000 A 29 LEU N N 15 129.051 0.003 A 30 ASN H H 1 8.724 0.006 A 30 ASN HA H 1 5.031 0.005 A 30 ASN HBy H 1 2.811 0.000 A 30 ASN HBx H 1 2.537 0.000 A 30 ASN HD2x H 1 6.686 0.004 A 30 ASN HD2y H 1 7.523 0.001 A 30 ASN C C 13 174.395 0.000 A 30 ASN CA C 13 52.216 0.000 A 30 ASN CB C 13 39.166 0.000 A 30 ASN CG C 13 176.983 0.000 A 30 ASN N N 15 123.549 0.000 A 30 ASN ND2 N 15 111.611 0.035 A 31 THR H H 1 8.183 0.003 A 31 THR HA H 1 4.671 0.011 A 31 THR HB H 1 3.994 0.002 A 31 THR HG2% H 1 1.249 0.003 A 31 THR CA C 13 59.851 0.000 A 31 THR CB C 13 70.236 0.000 A 31 THR CG2 C 13 22.210 0.074 A 31 THR N N 15 118.810 0.004 A 32 PRO HA H 1 4.251 0.002 A 32 PRO HBy H 1 2.275 0.000 A 32 PRO HBx H 1 1.794 0.000 A 32 PRO HDx H 1 3.675 0.006 A 32 PRO HDy H 1 3.853 0.009 A 32 PRO HGy H 1 2.038 0.011 A 32 PRO HGx H 1 1.962 0.009 A 32 PRO C C 13 176.761 0.000 A 32 PRO CA C 13 64.401 0.000 A 32 PRO CB C 13 32.005 0.000 A 32 PRO CD C 13 51.125 0.000 A 32 PRO CG C 13 27.614 0.091 A 33 ASN H H 1 8.519 0.003 A 33 ASN HA H 1 4.371 0.001 A 33 ASN HBy H 1 2.763 0.000 A 33 ASN HBx H 1 2.711 0.000 A 33 ASN HD2y H 1 7.264 0.003 A 33 ASN HD2x H 1 6.893 0.005 A 33 ASN C C 13 174.417 0.000 A 33 ASN CA C 13 54.808 0.000 A 33 ASN CB C 13 38.088 0.000 A 33 ASN N N 15 112.769 0.009 A 33 ASN ND2 N 15 113.493 0.013 A 34 CYS H H 1 7.587 0.008 A 34 CYS HA H 1 4.877 0.006 A 34 CYS HBy H 1 3.127 0.003 A 34 CYS HBx H 1 2.904 0.002 A 34 CYS C C 13 173.813 0.000 A 34 CYS CA C 13 54.694 0.000 A 34 CYS CB C 13 44.510 0.000 A 34 CYS N N 15 116.366 0.005 A 35 ALA H H 1 8.393 0.004 A 35 ALA HA H 1 4.264 0.003 A 35 ALA HB% H 1 1.406 0.000 A 35 ALA C C 13 176.685 0.000 A 35 ALA CA C 13 52.434 0.000 A 35 ALA CB C 13 18.612 0.008 A 35 ALA N N 15 124.876 0.013 A 36 LEU H H 1 8.007 0.004 A 36 LEU HA H 1 4.218 0.000 A 36 LEU HBx H 1 1.468 0.000 A 36 LEU HBy H 1 1.556 0.000 A 36 LEU HDx% H 1 0.868 0.000 A 36 LEU HDy% H 1 0.815 0.000 A 36 LEU C C 13 176.242 0.000 A 36 LEU CA C 13 56.581 0.000 A 36 LEU CB C 13 42.157 0.000 A 36 LEU CDy C 13 24.969 0.027 A 36 LEU N N 15 121.460 0.000 A 37 GLN H H 1 8.452 0.001 A 37 GLN HA H 1 4.605 0.002 A 37 GLN HBy H 1 2.191 0.000 A 37 GLN HBx H 1 1.998 0.004 A 37 GLN HE2x H 1 6.624 0.002 A 37 GLN HE2y H 1 7.285 0.004 A 37 GLN HGx H 1 2.418 0.011 A 37 GLN C C 13 173.431 0.000 A 37 GLN CA C 13 54.134 0.042 A 37 GLN CB C 13 32.080 0.000 A 37 GLN CG C 13 34.207 0.000 A 37 GLN N N 15 123.227 0.005 A 37 GLN NE2 N 15 110.376 0.031 A 38 ILE H H 1 9.327 0.003 A 38 ILE HA H 1 4.797 0.000 A 38 ILE HB H 1 1.867 0.000 A 38 ILE HD1% H 1 0.740 0.003 A 38 ILE HG1y H 1 1.390 0.000 A 38 ILE HG1x H 1 1.040 0.000 A 38 ILE HG2% H 1 0.639 0.009 A 38 ILE C C 13 174.602 0.000 A 38 ILE CA C 13 60.287 0.000 A 38 ILE CB C 13 38.730 0.000 A 38 ILE CD1 C 13 14.561 0.046 A 38 ILE CG1 C 13 27.725 0.000 A 38 ILE CG2 C 13 18.814 0.032 A 38 ILE N N 15 124.747 0.030 A 39 VAL H H 1 8.789 0.002 A 39 VAL HA H 1 5.122 0.000 A 39 VAL HB H 1 1.925 0.000 A 39 VAL HGx% H 1 0.876 0.003 A 39 VAL HGy% H 1 0.878 0.002 A 39 VAL C C 13 174.603 0.000 A 39 VAL CA C 13 59.795 0.000 A 39 VAL CB C 13 34.817 0.000 A 39 VAL CGx C 13 20.484 0.002 A 39 VAL CGy C 13 21.621 0.004 A 39 VAL N N 15 123.395 0.019 A 40 ALA H H 1 9.148 0.005 A 40 ALA HA H 1 5.124 0.000 A 40 ALA HB% H 1 1.273 0.002 A 40 ALA C C 13 175.821 0.000 A 40 ALA CA C 13 50.212 0.000 A 40 ALA CB C 13 23.445 0.049 A 40 ALA N N 15 125.311 0.027 A 41 ARG H H 1 8.442 0.003 A 41 ARG HA H 1 5.175 0.000 A 41 ARG HBx H 1 1.443 0.000 A 41 ARG HBy H 1 1.518 0.000 A 41 ARG HDx H 1 3.038 0.000 A 41 ARG HGy H 1 1.634 0.000 A 41 ARG HGx H 1 1.516 0.000 A 41 ARG C C 13 176.332 0.000 A 41 ARG CA C 13 53.721 0.000 A 41 ARG CB C 13 32.445 0.000 A 41 ARG CD C 13 42.936 0.000 A 41 ARG CG C 13 27.445 0.000 A 41 ARG N N 15 118.028 0.032 A 42 LEU H H 1 8.943 0.005 A 42 LEU HA H 1 4.764 0.015 A 42 LEU HBy H 1 2.193 0.000 A 42 LEU HBx H 1 1.719 0.006 A 42 LEU HDx% H 1 1.001 0.000 A 42 LEU HDy% H 1 0.810 0.000 A 42 LEU HG H 1 1.799 0.000 A 42 LEU C C 13 178.448 0.000 A 42 LEU CA C 13 54.420 0.000 A 42 LEU CB C 13 41.356 0.000 A 42 LEU CDy C 13 25.598 0.000 A 42 LEU CDx C 13 23.008 0.000 A 42 LEU CG C 13 27.432 0.000 A 42 LEU N N 15 124.573 0.043 A 43 LYS H H 1 8.366 0.002 A 43 LYS HA H 1 3.789 0.004 A 43 LYS HBy H 1 1.805 0.000 A 43 LYS HBx H 1 1.623 0.000 A 43 LYS HDx H 1 1.694 0.000 A 43 LYS HEx H 1 2.833 0.000 A 43 LYS HGx H 1 1.165 0.000 A 43 LYS HGy H 1 1.222 0.004 A 43 LYS C C 13 178.100 0.000 A 43 LYS CA C 13 59.380 0.000 A 43 LYS CB C 13 33.285 0.000 A 43 LYS CD C 13 29.707 0.000 A 43 LYS CE C 13 42.198 0.000 A 43 LYS CG C 13 26.475 0.000 A 43 LYS N N 15 120.613 0.015 A 44 ASN H H 1 8.633 0.004 A 44 ASN HA H 1 4.459 0.014 A 44 ASN HBx H 1 2.788 0.000 A 44 ASN HBy H 1 2.893 0.000 A 44 ASN HD2y H 1 7.604 0.002 A 44 ASN HD2x H 1 6.782 0.002 A 44 ASN C C 13 175.885 0.000 A 44 ASN CA C 13 55.461 0.000 A 44 ASN CB C 13 37.519 0.000 A 44 ASN N N 15 114.271 0.009 A 44 ASN ND2 N 15 112.381 0.003 A 45 ASN H H 1 7.403 0.003 A 45 ASN HA H 1 4.703 0.000 A 45 ASN HBy H 1 3.034 0.000 A 45 ASN HBx H 1 2.696 0.000 A 45 ASN HD2y H 1 7.450 0.002 A 45 ASN HD2x H 1 6.488 0.008 A 45 ASN C C 13 175.420 0.000 A 45 ASN CA C 13 52.653 0.000 A 45 ASN CB C 13 39.181 0.000 A 45 ASN CG C 13 176.025 0.000 A 45 ASN N N 15 114.876 0.010 A 45 ASN ND2 N 15 109.224 0.022 A 46 ASN H H 1 8.068 0.009 A 46 ASN HA H 1 4.609 0.002 A 46 ASN HBy H 1 3.107 0.000 A 46 ASN HBx H 1 2.692 0.000 A 46 ASN HD2x H 1 6.887 0.000 A 46 ASN HD2y H 1 7.554 0.000 A 46 ASN C C 13 174.729 0.000 A 46 ASN CA C 13 54.572 0.000 A 46 ASN CB C 13 38.994 0.000 A 46 ASN N N 15 116.177 0.012 A 46 ASN ND2 N 15 112.268 0.000 A 47 ARG H H 1 7.969 0.002 A 47 ARG HA H 1 4.192 0.000 A 47 ARG HBx H 1 1.726 0.000 A 47 ARG HDx H 1 3.118 0.000 A 47 ARG HDy H 1 3.203 0.000 A 47 ARG HGx H 1 1.571 0.000 A 47 ARG C C 13 175.741 0.000 A 47 ARG CA C 13 57.070 0.000 A 47 ARG CB C 13 31.606 0.000 A 47 ARG CD C 13 43.586 0.000 A 47 ARG CG C 13 27.917 0.000 A 47 ARG N N 15 120.126 0.004 A 48 GLN H H 1 8.696 0.001 A 48 GLN HA H 1 5.143 0.000 A 48 GLN HBx H 1 1.879 0.000 A 48 GLN HBy H 1 2.026 0.000 A 48 GLN HE2y H 1 7.518 0.000 A 48 GLN HE2x H 1 6.878 0.001 A 48 GLN HGx H 1 2.185 0.007 A 48 GLN HGy H 1 2.209 0.000 A 48 GLN C C 13 175.638 0.000 A 48 GLN CA C 13 55.712 0.000 A 48 GLN CB C 13 30.713 0.000 A 48 GLN CG C 13 35.251 0.000 A 48 GLN N N 15 123.423 0.006 A 48 GLN NE2 N 15 111.801 0.082 A 49 VAL H H 1 9.000 0.001 A 49 VAL HA H 1 4.705 0.000 A 49 VAL HB H 1 2.108 0.000 A 49 VAL HGx% H 1 0.878 0.002 A 49 VAL HGy% H 1 0.749 0.001 A 49 VAL C C 13 174.291 0.000 A 49 VAL CA C 13 59.287 0.000 A 49 VAL CB C 13 35.708 0.000 A 49 VAL CGy C 13 21.418 0.012 A 49 VAL CGx C 13 18.911 0.024 A 49 VAL N N 15 120.108 0.000 A 50 CYS H H 1 8.772 0.004 A 50 CYS HA H 1 5.675 0.000 A 50 CYS HBy H 1 3.730 0.000 A 50 CYS HBx H 1 2.991 0.006 A 50 CYS C C 13 174.418 0.000 A 50 CYS CA C 13 55.986 0.000 A 50 CYS CB C 13 45.155 0.000 A 50 CYS N N 15 120.567 0.019 A 51 ILE H H 1 8.624 0.003 A 51 ILE HA H 1 4.441 0.000 A 51 ILE HB H 1 1.406 0.000 A 51 ILE HD1% H 1 0.656 0.002 A 51 ILE HG1y H 1 1.324 0.000 A 51 ILE HG1x H 1 1.011 0.000 A 51 ILE HG2% H 1 0.684 0.003 A 51 ILE C C 13 174.167 0.000 A 51 ILE CA C 13 59.912 0.000 A 51 ILE CB C 13 39.367 0.000 A 51 ILE CD1 C 13 13.168 0.030 A 51 ILE CG1 C 13 27.682 0.000 A 51 ILE CG2 C 13 18.163 0.014 A 51 ILE N N 15 122.917 0.009 A 52 ASP H H 1 7.677 0.003 A 52 ASP HA H 1 3.683 0.000 A 52 ASP HBy H 1 2.645 0.000 A 52 ASP HBx H 1 2.254 0.000 A 52 ASP CA C 13 51.660 0.000 A 52 ASP CB C 13 42.555 0.000 A 52 ASP N N 15 126.518 0.048 A 53 PRO HA H 1 4.052 0.000 A 53 PRO HBy H 1 1.947 0.000 A 53 PRO HBx H 1 1.779 0.000 A 53 PRO HDx H 1 3.257 0.004 A 53 PRO HDy H 1 3.493 0.000 A 53 PRO HGx H 1 1.716 0.000 A 53 PRO HGy H 1 1.775 0.000 A 53 PRO C C 13 176.350 0.000 A 53 PRO CA C 13 63.360 0.000 A 53 PRO CB C 13 32.128 0.000 A 53 PRO CD C 13 50.743 0.027 A 53 PRO CG C 13 27.106 0.000 A 54 LYS H H 1 8.136 0.002 A 54 LYS HA H 1 3.993 0.000 A 54 LYS HBx H 1 1.705 0.000 A 54 LYS HBy H 1 1.715 0.000 A 54 LYS HDx H 1 1.626 0.000 A 54 LYS HEx H 1 2.950 0.000 A 54 LYS HGx H 1 1.285 0.000 A 54 LYS C C 13 177.916 0.000 A 54 LYS CA C 13 56.089 0.000 A 54 LYS CB C 13 31.610 0.000 A 54 LYS CD C 13 28.575 0.000 A 54 LYS CE C 13 41.452 0.000 A 54 LYS CG C 13 24.735 0.000 A 54 LYS N N 15 115.305 0.007 A 55 LEU H H 1 7.077 0.002 A 55 LEU HA H 1 4.046 0.000 A 55 LEU HBx H 1 1.001 0.000 A 55 LEU HBy H 1 1.179 0.000 A 55 LEU HDx% H 1 0.985 0.000 A 55 LEU HDy% H 1 1.008 0.009 A 55 LEU HG H 1 1.785 0.000 A 55 LEU C C 13 179.179 0.000 A 55 LEU CA C 13 55.478 0.000 A 55 LEU CB C 13 41.505 0.000 A 55 LEU CDy C 13 25.479 0.038 A 55 LEU CDx C 13 23.026 0.020 A 55 LEU CG C 13 26.926 0.000 A 55 LEU N N 15 120.291 0.006 A 56 LYS H H 1 8.863 0.003 A 56 LYS HA H 1 3.937 0.000 A 56 LYS HBx H 1 1.987 0.000 A 56 LYS HDx H 1 1.755 0.000 A 56 LYS HEx H 1 3.037 0.000 A 56 LYS HGy H 1 1.569 0.000 A 56 LYS HGx H 1 1.534 0.000 A 56 LYS C C 13 179.128 0.000 A 56 LYS CA C 13 59.913 0.000 A 56 LYS CB C 13 31.845 0.000 A 56 LYS CD C 13 28.950 0.000 A 56 LYS CE C 13 42.362 0.000 A 56 LYS CG C 13 24.735 0.000 A 56 LYS N N 15 125.358 0.008 A 57 TRP H H 1 7.798 0.007 A 57 TRP HA H 1 4.659 0.000 A 57 TRP HBy H 1 3.626 0.000 A 57 TRP HBx H 1 3.287 0.000 A 57 TRP HD1 H 1 7.694 0.003 A 57 TRP HE1 H 1 10.246 0.003 A 57 TRP HE3 H 1 6.641 0.000 A 57 TRP HH2 H 1 6.657 0.005 A 57 TRP HZ2 H 1 6.977 0.005 A 57 TRP HZ3 H 1 7.361 0.002 A 57 TRP C C 13 178.600 0.000 A 57 TRP CA C 13 58.091 0.000 A 57 TRP CB C 13 27.581 0.000 A 57 TRP CD1 C 13 128.770 0.000 A 57 TRP CE3 C 13 121.988 0.000 A 57 TRP CH2 C 13 123.852 0.000 A 57 TRP CZ2 C 13 113.898 0.000 A 57 TRP CZ3 C 13 122.759 0.112 A 57 TRP N N 15 113.478 0.017 A 57 TRP NE1 N 15 130.477 0.022 A 58 ILE H H 1 6.385 0.001 A 58 ILE HA H 1 3.748 0.000 A 58 ILE HB H 1 1.474 0.000 A 58 ILE HD1% H 1 0.030 0.004 A 58 ILE HG1y H 1 0.701 0.000 A 58 ILE HG1x H 1 -0.057 0.000 A 58 ILE HG2% H 1 0.593 0.001 A 58 ILE C C 13 177.132 0.000 A 58 ILE CA C 13 60.747 0.000 A 58 ILE CB C 13 35.699 0.000 A 58 ILE CD1 C 13 11.319 0.031 A 58 ILE CG1 C 13 27.069 0.000 A 58 ILE CG2 C 13 17.838 0.024 A 58 ILE N N 15 123.327 0.012 A 59 GLN H H 1 7.801 0.002 A 59 GLN HA H 1 3.821 0.000 A 59 GLN HBx H 1 2.170 0.000 A 59 GLN HE2x H 1 6.791 0.004 A 59 GLN HE2y H 1 7.557 0.003 A 59 GLN HGx H 1 2.382 0.000 A 59 GLN C C 13 178.951 0.000 A 59 GLN CA C 13 59.485 0.000 A 59 GLN CB C 13 27.504 0.000 A 59 GLN CG C 13 33.871 0.000 A 59 GLN N N 15 120.718 0.011 A 59 GLN NE2 N 15 113.485 0.021 A 60 GLU H H 1 8.079 0.001 A 60 GLU HA H 1 4.079 0.000 A 60 GLU HBx H 1 2.077 0.000 A 60 GLU HBy H 1 2.188 0.000 A 60 GLU HGy H 1 2.410 0.000 A 60 GLU HGx H 1 2.231 0.000 A 60 GLU C C 13 178.466 0.000 A 60 GLU CA C 13 59.317 0.000 A 60 GLU CB C 13 29.553 0.000 A 60 GLU CG C 13 36.542 0.000 A 60 GLU N N 15 118.041 0.011 A 61 TYR H H 1 7.734 0.002 A 61 TYR HA H 1 4.237 0.002 A 61 TYR HBx H 1 3.293 0.004 A 61 TYR HDx H 1 6.751 0.002 A 61 TYR HDy H 1 7.057 0.004 A 61 TYR HEx H 1 6.752 0.006 A 61 TYR C C 13 177.980 0.000 A 61 TYR CA C 13 61.312 0.000 A 61 TYR CB C 13 38.524 0.000 A 61 TYR CDx C 13 132.855 0.049 A 61 TYR CDy C 13 132.927 0.147 A 61 TYR CEx C 13 118.283 0.067 A 61 TYR N N 15 120.914 0.014 A 62 LEU H H 1 8.553 0.002 A 62 LEU HA H 1 3.815 0.000 A 62 LEU HBy H 1 1.859 0.000 A 62 LEU HBx H 1 1.472 0.000 A 62 LEU HDx% H 1 0.840 0.000 A 62 LEU HG H 1 0.824 0.000 A 62 LEU C C 13 178.726 0.000 A 62 LEU CA C 13 57.626 0.000 A 62 LEU CB C 13 41.824 0.000 A 62 LEU CDx C 13 22.991 0.010 A 62 LEU CG C 13 25.715 0.000 A 62 LEU N N 15 119.614 0.006 A 63 GLU H H 1 7.904 0.000 A 63 GLU HA H 1 3.946 0.000 A 63 GLU HBy H 1 2.092 0.000 A 63 GLU HBx H 1 2.074 0.000 A 63 GLU HGy H 1 2.373 0.000 A 63 GLU HGx H 1 2.240 0.000 A 63 GLU C C 13 178.566 0.000 A 63 GLU CA C 13 59.185 0.000 A 63 GLU CB C 13 29.565 0.000 A 63 GLU CG C 13 36.225 0.000 A 63 GLU N N 15 118.407 0.003 A 64 LYS H H 1 7.492 0.001 A 64 LYS HA H 1 4.136 0.000 A 64 LYS HBx H 1 1.854 0.000 A 64 LYS HDx H 1 1.663 0.000 A 64 LYS HEx H 1 2.971 0.000 A 64 LYS HGx H 1 1.415 0.000 A 64 LYS HGy H 1 1.548 0.000 A 64 LYS C C 13 178.334 0.000 A 64 LYS CA C 13 57.975 0.000 A 64 LYS CB C 13 32.605 0.000 A 64 LYS CD C 13 29.099 0.000 A 64 LYS CE C 13 42.346 0.000 A 64 LYS CG C 13 25.182 0.000 A 64 LYS N N 15 117.257 0.004 A 65 ALA H H 1 8.009 0.000 A 65 ALA HA H 1 4.086 0.000 A 65 ALA HB% H 1 1.150 0.001 A 65 ALA C C 13 179.158 0.000 A 65 ALA CA C 13 54.070 0.000 A 65 ALA CB C 13 18.743 0.017 A 65 ALA N N 15 121.445 0.000 A 66 LEU H H 1 7.913 0.001 A 66 LEU HA H 1 4.268 0.000 A 66 LEU HBy H 1 1.700 0.000 A 66 LEU HBx H 1 1.547 0.000 A 66 LEU HDx% H 1 0.843 0.000 A 66 LEU HG H 1 0.866 0.000 A 66 LEU C C 13 177.545 0.000 A 66 LEU CA C 13 55.504 0.000 A 66 LEU CB C 13 42.017 0.000 A 66 LEU CDx C 13 22.999 0.000 A 66 LEU CG C 13 25.167 0.000 A 66 LEU N N 15 117.185 0.007 A 67 ASN H H 1 7.833 0.008 A 67 ASN HA H 1 4.620 0.000 A 67 ASN HBx H 1 2.781 0.000 A 67 ASN HBy H 1 2.883 0.004 A 67 ASN HD2x H 1 6.902 0.000 A 67 ASN HD2y H 1 7.654 0.000 A 67 ASN C C 13 175.574 0.000 A 67 ASN CA C 13 53.818 0.000 A 67 ASN CB C 13 38.583 0.000 A 67 ASN N N 15 117.778 0.006 A 67 ASN ND2 N 15 112.916 0.009 A 68 LYS H H 1 8.136 0.002 A 68 LYS HA H 1 4.269 0.009 A 68 LYS HBx H 1 1.876 0.000 A 68 LYS HDx H 1 1.662 0.000 A 68 LYS HEx H 1 2.980 0.000 A 68 LYS HGx H 1 1.429 0.000 A 68 LYS CA C 13 57.019 0.000 A 68 LYS CB C 13 32.623 0.000 A 68 LYS CD C 13 29.074 0.000 A 68 LYS CE C 13 42.213 0.000 A 68 LYS CG C 13 24.616 0.000 A 68 LYS N N 15 120.965 0.051 A 69 GLY H H 1 8.367 0.005 A 69 GLY HAx H 1 3.925 0.000 A 69 GLY CA C 13 45.440 0.000 A 69 GLY N N 15 108.886 0.071 A 70 ARG H H 1 8.035 0.001 A 70 ARG CA C 13 56.200 0.000 A 70 ARG CB C 13 30.914 0.000 A 70 ARG N N 15 120.571 0.009 A 71 ARG H H 1 8.492 0.000 A 71 ARG CA C 13 56.566 0.000 A 71 ARG CB C 13 30.433 0.000 A 71 ARG N N 15 122.454 0.000 A 72 GLU H H 1 8.392 0.000 A 72 GLU CA C 13 56.200 0.000 A 72 GLU CB C 13 33.250 0.000 A 72 GLU N N 15 122.847 0.000 A 74 LYS H H 1 8.412 0.000 A 74 LYS HA H 1 4.327 0.000 A 74 LYS HBx H 1 1.764 0.000 A 74 LYS HDx H 1 1.660 0.000 A 74 LYS HEx H 1 2.971 0.000 A 74 LYS HGx H 1 1.410 0.000 A 74 LYS CA C 13 56.342 0.000 A 74 LYS CB C 13 32.917 0.000 A 74 LYS CD C 13 29.045 0.000 A 74 LYS CG C 13 24.638 0.000 A 74 LYS N N 15 122.912 0.000 A 75 VAL H H 1 8.103 0.000 A 75 VAL HA H 1 4.091 0.000 A 75 VAL HB H 1 2.064 0.000 A 75 VAL HGx% H 1 0.930 0.000 A 75 VAL CA C 13 62.526 0.000 A 75 VAL CB C 13 32.800 0.000 A 75 VAL CGx C 13 20.678 0.000 A 75 VAL N N 15 121.232 0.000 A 76 GLY H H 1 8.464 0.000 A 76 GLY HAx H 1 3.886 0.000 A 76 GLY HAy H 1 3.997 0.000 A 76 GLY CA C 13 45.197 0.000 A 76 GLY N N 15 112.632 0.000 A 77 LYS H H 1 8.176 0.000 A 77 LYS CA C 13 56.380 0.000 A 77 LYS CB C 13 33.220 0.000 A 77 LYS N N 15 121.228 0.000 A 78 LYS H H 1 8.360 0.000 A 78 LYS CA C 13 56.441 0.000 A 78 LYS CB C 13 32.994 0.000 A 78 LYS N N 15 123.381 0.000 A 79 GLU H H 1 8.398 0.000 A 79 GLU CA C 13 56.454 0.000 A 79 GLU N N 15 122.479 0.000 A 80 LYS H H 1 8.390 0.000 A 80 LYS HA H 1 4.292 0.000 A 80 LYS HBx H 1 1.787 0.000 A 80 LYS HDx H 1 1.673 0.000 A 80 LYS HEx H 1 2.984 0.000 A 80 LYS HGx H 1 1.402 0.000 A 80 LYS CA C 13 56.389 0.000 A 80 LYS CB C 13 32.912 0.000 A 80 LYS CD C 13 29.136 0.000 A 80 LYS CE C 13 42.261 0.000 A 80 LYS CG C 13 24.693 0.000 A 80 LYS N N 15 122.653 0.000 A 81 ILE H H 1 8.136 0.000 A 81 ILE HA H 1 4.122 0.000 A 81 ILE HB H 1 1.854 0.000 A 81 ILE HD1% H 1 0.842 0.000 A 81 ILE HG1y H 1 1.472 0.000 A 81 ILE HG1x H 1 1.194 0.000 A 81 ILE HG2% H 1 0.909 0.000 A 81 ILE CA C 13 61.277 0.000 A 81 ILE CB C 13 38.722 0.000 A 81 ILE CD1 C 13 12.837 0.000 A 81 ILE CG1 C 13 27.358 0.000 A 81 ILE CG2 C 13 17.449 0.000 A 81 ILE N N 15 122.341 0.000 A 82 GLY H H 1 8.448 0.000 A 82 GLY CA C 13 45.268 0.000 A 82 GLY N N 15 112.989 0.000 A 83 LYS H H 1 8.176 0.000 A 83 LYS CA C 13 56.380 0.000 A 83 LYS CB C 13 33.220 0.000 A 83 LYS N N 15 121.219 0.000 A 85 LYS H H 1 8.370 0.000 A 85 LYS CA C 13 56.380 0.000 A 85 LYS CB C 13 33.040 0.000 A 85 LYS N N 15 122.850 0.000 A 86 ARG H H 1 8.410 0.000 A 86 ARG CA C 13 56.180 0.000 A 86 ARG CB C 13 30.920 0.000 A 86 ARG N N 15 123.080 0.000 A 87 GLN H H 1 8.482 0.000 A 87 GLN CA C 13 55.720 0.000 A 87 GLN CB C 13 29.880 0.000 A 87 GLN N N 15 122.644 0.000 A 88 LYS H H 1 8.446 0.000 A 88 LYS HA H 1 4.274 0.000 A 88 LYS HEx H 1 2.980 0.000 A 88 LYS CA C 13 56.380 0.000 A 88 LYS CB C 13 33.250 0.000 A 88 LYS CD C 13 29.111 0.000 A 88 LYS CE C 13 42.221 0.000 A 88 LYS CG C 13 24.647 0.000 A 88 LYS N N 15 123.968 0.000 A 89 LYS H H 1 8.328 0.000 A 89 LYS CA C 13 56.397 0.000 A 89 LYS CB C 13 33.062 0.000 A 89 LYS N N 15 122.750 0.000 A 90 ARG H H 1 8.410 0.000 A 90 ARG CA C 13 56.150 0.000 A 90 ARG CB C 13 31.110 0.000 A 90 ARG N N 15 123.660 0.000 A 91 LYS H H 1 8.408 0.000 A 91 LYS HA H 1 4.253 0.000 A 91 LYS HBx H 1 1.774 0.000 A 91 LYS HDx H 1 1.688 0.000 A 91 LYS HEx H 1 2.987 0.000 A 91 LYS HGx H 1 1.426 0.000 A 91 LYS CA C 13 56.330 0.000 A 91 LYS CB C 13 33.210 0.000 A 91 LYS CD C 13 29.187 0.000 A 91 LYS CE C 13 42.165 0.000 A 91 LYS CG C 13 24.615 0.000 A 91 LYS N N 15 123.539 0.000 A 92 ALA H H 1 8.358 0.000 A 92 ALA HA H 1 4.266 0.000 A 92 ALA HB% H 1 1.364 0.000 A 92 ALA CA C 13 52.340 0.000 A 92 ALA CB C 13 19.261 0.000 A 92 ALA N N 15 126.200 0.000 A 93 ALA H H 1 8.302 0.000 A 93 ALA HA H 1 4.273 0.000 A 93 ALA HB% H 1 1.362 0.000 A 93 ALA CA C 13 52.346 0.000 A 93 ALA CB C 13 19.370 0.000 A 93 ALA N N 15 123.871 0.000 A 94 GLN H H 1 8.325 0.000 A 94 GLN CA C 13 55.646 0.000 A 94 GLN CB C 13 29.857 0.000 A 94 GLN N N 15 120.159 0.000 A 95 LYS H H 1 8.392 0.000 A 95 LYS CA C 13 56.330 0.000 A 95 LYS CB C 13 33.210 0.000 A 95 LYS N N 15 123.579 0.000 A 96 ARG H H 1 8.381 0.000 A 96 ARG CA C 13 56.230 0.000 A 96 ARG CB C 13 31.220 0.000 A 96 ARG N N 15 123.151 0.000 A 97 LYS H H 1 8.422 0.000 A 97 LYS HA H 1 4.296 0.000 A 97 LYS HBx H 1 1.837 0.000 A 97 LYS HDx H 1 1.679 0.000 A 97 LYS HEx H 1 2.987 0.000 A 97 LYS HGx H 1 1.426 0.000 A 97 LYS CA C 13 56.441 0.000 A 97 LYS CB C 13 33.261 0.000 A 97 LYS CD C 13 29.084 0.000 A 97 LYS CE C 13 42.240 0.000 A 97 LYS CG C 13 24.445 0.000 A 97 LYS N N 15 123.894 0.000 A 98 ASN H H 1 8.019 0.000 A 98 ASN HD2x H 1 6.770 0.000 A 98 ASN HD2y H 1 7.485 0.000 A 98 ASN CA C 13 54.860 0.000 A 98 ASN CB C 13 40.290 0.000 A 98 ASN N N 15 125.422 0.000 A 98 ASN ND2 N 15 112.497 0.002 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 58 ILE CD1 A 51 ILE HG2% 1.0 1.404 2.228 2 2 A 38 ILE CG2 A 26 LEU HDx% 1.0 1.345 2.079 3 3 A 49 VAL CGy A 18 ILE HD1% 1.0 1.414 2.254 4 4 A 51 ILE HG2% A 55 LEU CDy 1.0 1.332 2.044 5 5 A 51 ILE CD1 A 38 ILE HG2% 1.0 1.363 2.123 6 6 A 38 ILE HD1% A 38 ILE CD1 1.0 0.809 1.017 7 7 A 23 VAL CGy A 40 ALA HB% 1.0 1.321 2.017 8 8 A 28 ILE CD1 A 28 ILE HD1% 1.0 0.801 1.005 9 9 A 51 ILE CD1 A 26 LEU HDy% 1.0 1.363 2.123 10 10 A 61 TYR HA A 61 TYR HDy 1.0 1.888 4.222 11 11 A 61 TYR HDy A 61 TYR H 1.0 1.928 4.548 12 12 A 61 TYR HDy A 62 LEU HBy 1.0 1.948 4.768 13 13 A 61 TYR HDy A 62 LEU HDx% 1.0 1.853 3.973 14 14 A 61 TYR HEx A 61 TYR HBy 1.0 1.975 5.139 15 15 A 26 LEU HDy% A 61 TYR HEx 1.0 1.971 5.065 16 16 A 61 TYR HEx A 26 LEU HBy 1.0 1.947 4.751 17 17 A 25 HIS HD2 A 24 LYS HDy 1.0 1.959 4.907 18 18 A 57 TRP HZ2 A 57 TRP HH2 1.0 1.760 3.470 19 19 A 57 TRP HH2 A 57 TRP HZ3 1.0 1.648 2.998 20 20 A 57 TRP HBy A 57 TRP HD1 1.0 1.844 3.922 21 21 A 57 TRP HD1 A 19 ALA HA 1.0 1.987 5.359 22 22 A 57 TRP HD1 A 57 TRP HA 1.0 1.960 4.902 23 23 A 57 TRP HD1 A 57 TRP H 1.0 1.776 3.546 24 24 A 13 PHE HBy A 13 PHE HDx 1.0 1.915 4.431 25 24 A 13 PHE HDy A 13 PHE HBy 1.0 1.915 4.431 26 25 A 13 PHE HDx A 13 PHE HBx 1.0 1.952 4.816 27 25 A 13 PHE HDy A 13 PHE HBx 1.0 1.952 4.816 28 26 A 13 PHE HDx A 13 PHE HA 1.0 1.972 5.072 29 26 A 13 PHE HDy A 13 PHE HA 1.0 1.972 5.072 30 27 A 13 PHE HBy A 13 PHE HEy 1.0 1.959 4.899 31 27 A 13 PHE HBy A 13 PHE HEx 1.0 1.959 4.899 32 28 A 14 PHE HEy A 14 PHE HDx 1.0 1.451 2.355 33 28 A 14 PHE HEx A 14 PHE HDx 1.0 1.451 2.355 34 28 A 14 PHE HDy A 14 PHE HEx 1.0 1.451 2.355 35 28 A 14 PHE HDy A 14 PHE HEy 1.0 1.451 2.355 36 29 A 14 PHE HEx A 50 CYS HBx 1.0 1.970 5.060 37 29 A 14 PHE HEy A 50 CYS HBx 1.0 1.970 5.060 38 30 A 14 PHE HEx A 52 ASP HA 1.0 1.974 5.118 39 30 A 14 PHE HEy A 52 ASP HA 1.0 1.974 5.118 40 31 A 14 PHE HEx A 14 PHE HA 1.0 1.979 5.189 41 31 A 14 PHE HEy A 14 PHE HA 1.0 1.979 5.189 42 32 A 14 PHE HDx A 14 PHE HBy 1.0 1.842 3.906 43 32 A 14 PHE HDy A 14 PHE HBy 1.0 1.842 3.906 44 33 A 57 TRP HZ3 A 57 TRP HE3 1.0 1.853 3.977 45 34 A 25 HIS HE1 A 41 ARG HGy 1.0 1.986 5.346 46 35 A 25 HIS HD2 A 24 LYS HGy 1.0 1.992 5.506 47 36 A 13 PHE HBx A 13 PHE HEy 1.0 1.955 4.853 48 36 A 13 PHE HBx A 13 PHE HEx 1.0 1.955 4.853 49 37 A 13 PHE HA A 13 PHE HEy 1.0 1.984 5.296 50 37 A 13 PHE HA A 13 PHE HEx 1.0 1.984 5.296 51 38 A 13 PHE HEy A 13 PHE H 1.0 1.958 4.878 52 38 A 13 PHE HEx A 13 PHE H 1.0 1.958 4.878 53 39 A 13 PHE HDx A 13 PHE HEx 1.0 1.334 2.050 54 39 A 13 PHE HDx A 13 PHE HEy 1.0 1.334 2.050 55 39 A 13 PHE HDy A 13 PHE HEy 1.0 1.334 2.050 56 39 A 13 PHE HDy A 13 PHE HEx 1.0 1.334 2.050 57 40 A 13 PHE HA A 14 PHE HEx 1.0 1.989 5.401 58 40 A 13 PHE HA A 14 PHE HEy 1.0 1.989 5.401 59 41 A 61 TYR HDy A 65 ALA HB% 1.0 1.972 5.070 60 42 A 7 TYR HEx A 7 TYR HDx 1.0 1.478 2.434 61 42 A 7 TYR HEy A 7 TYR HDx 1.0 1.478 2.434 62 42 A 7 TYR HDy A 7 TYR HEy 1.0 1.478 2.434 63 42 A 7 TYR HDy A 7 TYR HEx 1.0 1.478 2.434 64 43 A 38 ILE HD1% A 61 TYR HDy 1.0 1.961 4.921 65 44 A 38 ILE HG2% A 61 TYR HEx 1.0 1.977 5.167 66 45 A 61 TYR HA A 61 TYR HDx 1.0 1.988 5.388 67 46 A 61 TYR HBy A 61 TYR HDx 1.0 1.925 4.527 68 47 A 57 TRP HZ3 A 20 ARG HGx 1.0 1.953 4.825 69 48 A 26 LEU HDx% A 57 TRP HZ3 1.0 1.988 5.392 70 49 A 61 TYR HDy A 58 ILE HA 1.0 1.976 5.160 71 50 A 14 PHE HDx A 50 CYS HBx 1.0 1.970 5.052 72 50 A 14 PHE HDy A 50 CYS HBx 1.0 1.970 5.052 73 51 A 52 ASP H A 51 ILE HA 1.0 1.603 2.831 74 52 A 52 ASP H A 55 LEU HDx% 1.0 1.709 3.237 75 53 A 52 ASP H A 16 SER HA 1.0 1.711 3.249 76 54 A 52 ASP H A 52 ASP HBx 1.0 1.667 3.071 77 55 A 51 ILE HG2% A 52 ASP H 1.0 1.650 3.002 78 56 A 52 ASP HA A 52 ASP H 1.0 1.762 3.476 79 57 A 40 ALA H A 49 VAL H 1.0 1.701 3.205 80 58 A 40 ALA H A 49 VAL HGy% 1.0 1.789 3.613 81 59 A 40 ALA H A 41 ARG H 1.0 1.914 4.424 82 60 A 40 ALA H A 39 VAL HA 1.0 1.565 2.703 83 61 A 40 ALA H A 48 GLN HGy 1.0 1.950 4.788 84 62 A 56 LYS H A 56 LYS HDy 1.0 1.888 4.218 85 63 A 56 LYS H A 56 LYS HGx 1.0 1.865 4.055 86 64 A 56 LYS H A 55 LEU HDy% 1.0 1.753 3.437 87 65 A 57 TRP H A 56 LYS H 1.0 1.900 4.312 88 66 A 56 LYS H A 56 LYS HBy 1.0 1.671 3.085 89 67 A 56 LYS H A 55 LEU HBx 1.0 1.934 4.612 90 68 A 35 ALA H A 34 CYS HBy 1.0 1.770 3.518 91 69 A 35 ALA H A 34 CYS HBx 1.0 1.796 3.650 92 70 A 35 ALA H A 35 ALA HA 1.0 1.651 3.009 93 71 A 35 ALA H A 35 ALA HB% 1.0 1.600 2.824 94 72 A 5 LEU H A 5 LEU HA 1.0 1.753 3.437 95 73 A 5 LEU H A 5 LEU HDy% 1.0 1.959 4.895 96 74 A 5 LEU H A 4 SER HA 1.0 1.657 3.031 97 75 A 5 LEU H A 4 SER HBx 1.0 1.914 4.426 98 76 A 5 LEU H A 5 LEU HBy 1.0 1.717 3.271 99 77 A 5 LEU H A 6 SER H 1.0 1.828 3.828 100 78 A 38 ILE H A 38 ILE HA 1.0 1.829 3.833 101 79 A 38 ILE H A 37 GLN HBx 1.0 1.907 4.361 102 80 A 38 ILE H A 38 ILE HB 1.0 1.710 3.242 103 81 A 38 ILE H A 37 GLN HBy 1.0 1.805 3.701 104 82 A 38 ILE H A 39 VAL H 1.0 1.904 4.344 105 83 A 42 LEU H A 41 ARG HA 1.0 1.551 2.657 106 84 A 42 LEU H A 42 LEU HA 1.0 1.783 3.581 107 85 A 42 LEU H A 46 ASN HA 1.0 1.866 4.068 108 86 A 42 LEU H A 42 LEU HG 1.0 1.600 2.820 109 87 A 42 LEU H A 47 ARG H 1.0 1.836 3.872 110 88 A 42 LEU H A 42 LEU HBy 1.0 1.690 3.160 111 89 A 27 LYS H A 27 LYS HA 1.0 1.768 3.504 112 90 A 26 LEU HDx% A 27 LYS H 1.0 1.821 3.785 113 91 A 39 VAL H A 27 LYS H 1.0 1.766 3.496 114 92 A 27 LYS H A 26 LEU H 1.0 1.920 4.474 115 93 A 27 LYS H A 40 ALA HA 1.0 1.797 3.657 116 94 A 27 LYS H A 26 LEU HA 1.0 1.605 2.843 117 95 A 27 LYS H A 27 LYS HBy 1.0 1.752 3.428 118 96 A 27 LYS H A 39 VAL HGx% 1.0 1.771 3.521 119 97 A 30 ASN H A 31 THR H 1.0 1.936 4.630 120 98 A 30 ASN H A 29 LEU HDx% 1.0 1.816 3.758 121 99 A 20 ARG H A 21 ALA H 1.0 1.815 3.753 122 100 A 20 ARG H A 20 ARG HA 1.0 1.750 3.420 123 101 A 20 ARG H A 19 ALA HB% 1.0 1.661 3.047 124 102 A 20 ARG H A 20 ARG HBy 1.0 1.656 3.028 125 103 A 20 ARG H A 20 ARG HBx 1.0 1.665 3.061 126 104 A 20 ARG H A 57 TRP HE1 1.0 1.910 4.398 127 105 A 39 VAL HA A 39 VAL H 1.0 1.799 3.669 128 106 A 38 ILE HA A 39 VAL H 1.0 1.625 2.913 129 107 A 39 VAL H A 28 ILE HA 1.0 1.766 3.496 130 108 A 39 VAL H A 39 VAL HB 1.0 1.714 3.260 131 109 A 39 VAL H A 39 VAL HGx% 1.0 1.672 3.090 132 110 A 38 ILE HG2% A 39 VAL H 1.0 1.723 3.299 133 111 A 39 VAL H A 50 CYS HA 1.0 1.968 5.018 134 112 A 48 GLN H A 48 GLN HA 1.0 1.732 3.338 135 113 A 48 GLN H A 48 GLN HBx 1.0 1.691 3.165 136 114 A 48 GLN H A 48 GLN HBy 1.0 1.654 3.020 137 115 A 57 TRP HA A 58 ILE H 1.0 1.881 4.165 138 116 A 58 ILE HA A 58 ILE H 1.0 1.736 3.356 139 117 A 58 ILE H A 58 ILE HB 1.0 1.600 2.822 140 118 A 55 LEU HBx A 58 ILE H 1.0 1.771 3.521 141 119 A 58 ILE H A 58 ILE HG1x 1.0 1.717 3.277 142 120 A 37 GLN H A 37 GLN HGx 1.0 1.720 3.290 143 121 A 28 ILE H A 27 LYS HGx 1.0 1.711 3.247 144 122 A 28 ILE H A 28 ILE HG1x 1.0 1.781 3.571 145 123 A 24 LYS H A 43 LYS HA 1.0 1.988 5.396 146 124 A 51 ILE H A 50 CYS HBy 1.0 1.882 4.180 147 125 A 51 ILE H A 51 ILE HB 1.0 1.703 3.213 148 126 A 51 ILE H A 51 ILE HG1y 1.0 1.815 3.753 149 127 A 39 VAL HA A 51 ILE H 1.0 1.837 3.877 150 128 A 51 ILE HA A 51 ILE H 1.0 1.874 4.120 151 129 A 38 ILE HB A 51 ILE H 1.0 1.850 3.958 152 130 A 24 LYS H A 23 VAL H 1.0 1.929 4.569 153 131 A 42 LEU HA A 24 LYS H 1.0 1.813 3.745 154 132 A 24 LYS H A 23 VAL HB 1.0 1.803 3.689 155 133 A 40 ALA HB% A 24 LYS H 1.0 1.838 3.886 156 134 A 24 LYS H A 24 LYS HGx 1.0 1.789 3.615 157 135 A 24 LYS HGy A 24 LYS H 1.0 1.860 4.028 158 136 A 24 LYS H A 23 VAL HGy% 1.0 1.703 3.211 159 137 A 13 PHE H A 12 ARG H 1.0 1.934 4.614 160 138 A 12 ARG H A 12 ARG HBy 1.0 1.876 4.132 161 139 A 8 ARG H A 8 ARG HGx 1.0 1.847 3.943 162 140 A 8 ARG H A 7 TYR HBx 1.0 1.889 4.225 163 141 A 8 ARG H A 7 TYR HBy 1.0 1.876 4.134 164 142 A 8 ARG H A 8 ARG HBx 1.0 1.772 3.530 165 143 A 7 TYR HDx A 7 TYR H 1.0 1.925 4.531 166 143 A 7 TYR HDy A 7 TYR H 1.0 1.925 4.531 167 144 A 7 TYR HBx A 7 TYR H 1.0 1.796 3.652 168 145 A 7 TYR HBy A 7 TYR H 1.0 1.762 3.476 169 146 A 52 ASP H A 15 GLU H 1.0 1.838 3.886 170 147 A 14 PHE HA A 15 GLU H 1.0 1.562 2.694 171 148 A 51 ILE HA A 15 GLU H 1.0 1.717 3.271 172 149 A 14 PHE HBy A 15 GLU H 1.0 1.651 3.007 173 150 A 15 GLU H A 15 GLU HGx 1.0 1.758 3.462 174 151 A 15 GLU H A 15 GLU HBy 1.0 1.665 3.061 175 152 A 26 LEU H A 26 LEU HBx 1.0 1.656 3.026 176 153 A 37 GLN H A 36 LEU H 1.0 1.919 4.477 177 154 A 65 ALA H A 64 LYS H 1.0 1.587 2.775 178 155 A 65 ALA H A 64 LYS HBx 1.0 1.626 2.914 179 156 A 36 LEU H A 36 LEU HBx 1.0 1.485 2.455 180 157 A 65 ALA HB% A 65 ALA H 1.0 1.505 2.513 181 158 A 36 LEU H A 36 LEU HDy% 1.0 1.648 2.994 182 159 A 9 CYS H A 8 ARG HA 1.0 1.486 2.456 183 160 A 9 CYS H A 9 CYS HBy 1.0 1.741 3.379 184 161 A 68 LYS H A 67 ASN HA 1.0 1.733 3.345 185 162 A 68 LYS H A 68 LYS HGy 1.0 1.764 3.488 186 163 A 68 LYS H A 67 ASN HBx 1.0 1.847 3.943 187 164 A 9 CYS H A 9 CYS HBx 1.0 1.735 3.355 188 165 A 9 CYS H A 9 CYS HA 1.0 1.802 3.680 189 166 A 61 TYR H A 60 GLU H 1.0 1.723 3.299 190 167 A 61 TYR HA A 61 TYR H 1.0 1.693 3.173 191 168 A 61 TYR H A 58 ILE HA 1.0 1.751 3.423 192 169 A 61 TYR H A 61 TYR HBy 1.0 1.520 2.560 193 170 A 61 TYR H A 60 GLU HBy 1.0 1.710 3.242 194 171 A 61 TYR H A 62 LEU HBy 1.0 1.807 3.707 195 172 A 61 TYR H A 58 ILE HG2% 1.0 1.879 4.151 196 173 A 61 TYR H A 58 ILE HD1% 1.0 1.918 4.458 197 174 A 61 TYR H A 57 TRP HA 1.0 1.996 5.630 198 175 A 17 HIS H A 17 HIS HA 1.0 1.971 5.067 199 176 A 3 VAL H A 3 VAL HA 1.0 1.822 3.790 200 177 A 3 VAL H A 2 PRO HBy 1.0 1.952 4.802 201 178 A 3 VAL H A 3 VAL HB 1.0 1.771 3.523 202 179 A 3 VAL H A 2 PRO HBx 1.0 1.857 4.003 203 180 A 3 VAL H A 3 VAL HGx% 1.0 1.786 3.598 204 181 A 3 VAL H A 2 PRO HA 1.0 1.583 2.765 205 182 A 60 GLU H A 59 GLN H 1.0 1.731 3.337 206 183 A 59 GLN H A 55 LEU H 1.0 1.939 4.661 207 184 A 58 ILE H A 59 GLN H 1.0 1.648 2.994 208 185 A 57 TRP HA A 59 GLN H 1.0 1.959 4.889 209 186 A 59 GLN H A 56 LYS HA 1.0 1.813 3.737 210 187 A 59 GLN H A 59 GLN HA 1.0 1.678 3.114 211 188 A 59 GLN H A 59 GLN HGy 1.0 1.610 2.856 212 189 A 59 GLN H A 59 GLN HBy 1.0 1.549 2.651 213 190 A 58 ILE HB A 59 GLN H 1.0 1.708 3.236 214 191 A 58 ILE HG2% A 59 GLN H 1.0 1.773 3.531 215 192 A 39 VAL HA A 50 CYS H 1.0 1.936 4.630 216 193 A 50 CYS H A 49 VAL HA 1.0 1.556 2.674 217 194 A 50 CYS HBy A 50 CYS H 1.0 1.709 3.241 218 195 A 50 CYS HBx A 50 CYS H 1.0 1.765 3.495 219 196 A 50 CYS H A 49 VAL HGx% 1.0 1.746 3.400 220 197 A 49 VAL HGy% A 50 CYS H 1.0 1.773 3.533 221 198 A 24 LYS H A 43 LYS H 1.0 1.875 4.125 222 199 A 42 LEU H A 43 LYS H 1.0 1.940 4.670 223 200 A 43 LYS H A 22 ASN HBy 1.0 1.936 4.640 224 201 A 43 LYS H A 43 LYS HBy 1.0 1.649 3.001 225 202 A 43 LYS H A 43 LYS HBx 1.0 1.610 2.860 226 203 A 43 LYS H A 42 LEU HDy% 1.0 1.679 3.117 227 204 A 42 LEU HA A 43 LYS H 1.0 1.515 2.545 228 205 A 24 LYS HGy A 43 LYS H 1.0 1.818 3.770 229 206 A 56 LYS H A 55 LEU H 1.0 1.980 5.220 230 207 A 58 ILE H A 55 LEU H 1.0 1.914 4.430 231 208 A 55 LEU H A 55 LEU HA 1.0 1.665 3.059 232 209 A 55 LEU H A 52 ASP HBy 1.0 1.877 4.135 233 210 A 52 ASP HBx A 55 LEU H 1.0 1.938 4.656 234 211 A 55 LEU H A 55 LEU HG 1.0 1.604 2.838 235 212 A 58 ILE HB A 55 LEU H 1.0 1.864 4.048 236 213 A 55 LEU H A 55 LEU HBy 1.0 1.595 2.805 237 214 A 47 ARG H A 48 GLN H 1.0 1.907 4.365 238 215 A 46 ASN HA A 47 ARG H 1.0 1.752 3.428 239 216 A 47 ARG H A 47 ARG HA 1.0 1.666 3.066 240 217 A 47 ARG H A 45 ASN HBx 1.0 1.864 4.052 241 218 A 47 ARG H A 42 LEU HBy 1.0 1.749 3.419 242 219 A 47 ARG H A 47 ARG HBx 1.0 1.501 2.501 243 220 A 47 ARG H A 47 ARG HGx 1.0 1.595 2.805 244 221 A 47 ARG H A 42 LEU HDx% 1.0 1.825 3.805 245 222 A 61 TYR HDy A 62 LEU H 1.0 1.915 4.435 246 223 A 61 TYR HBy A 62 LEU H 1.0 1.667 3.067 247 224 A 62 LEU H A 62 LEU HBx 1.0 1.732 3.336 248 225 A 62 LEU HDx% A 62 LEU H 1.0 1.683 3.131 249 226 A 58 ILE HG2% A 62 LEU H 1.0 1.875 4.127 250 227 A 61 TYR H A 62 LEU H 1.0 1.702 3.210 251 228 A 61 TYR HA A 62 LEU H 1.0 1.854 3.986 252 229 A 62 LEU HBy A 62 LEU H 1.0 1.551 2.659 253 230 A 15 GLU H A 14 PHE H 1.0 1.969 5.041 254 231 A 14 PHE HEx A 14 PHE H 1.0 1.848 3.946 255 231 A 14 PHE HEy A 14 PHE H 1.0 1.848 3.946 256 232 A 14 PHE HA A 14 PHE H 1.0 1.697 3.187 257 233 A 13 PHE HBx A 14 PHE H 1.0 1.728 3.322 258 234 A 3 VAL HA A 4 SER H 1.0 1.689 3.157 259 235 A 4 SER HBx A 4 SER H 1.0 1.824 3.804 260 236 A 3 VAL HB A 4 SER H 1.0 1.935 4.621 261 237 A 3 VAL HGx% A 4 SER H 1.0 1.941 4.689 262 238 A 18 ILE H A 19 ALA H 1.0 1.926 4.534 263 239 A 18 ILE H A 17 HIS HBx 1.0 1.880 4.164 264 240 A 57 TRP HE1 A 18 ILE H 1.0 1.954 4.834 265 241 A 18 ILE H A 17 HIS HBy 1.0 1.878 4.148 266 242 A 18 ILE H A 18 ILE HB 1.0 1.662 3.052 267 243 A 18 ILE H A 18 ILE HG1y 1.0 1.835 3.869 268 244 A 18 ILE H A 18 ILE HG1x 1.0 1.738 3.368 269 245 A 55 LEU HDx% A 18 ILE H 1.0 1.719 3.285 270 246 A 31 THR H A 30 ASN HA 1.0 1.516 2.548 271 247 A 31 THR H A 31 THR HA 1.0 1.690 3.162 272 248 A 31 THR H A 36 LEU HA 1.0 1.854 3.980 273 249 A 31 THR H A 31 THR HB 1.0 1.718 3.280 274 250 A 31 THR H A 29 LEU HBx 1.0 1.877 4.139 275 251 A 31 THR H A 31 THR HG2% 1.0 1.764 3.486 276 252 A 16 SER H A 16 SER HBy 1.0 1.843 3.917 277 253 A 16 SER H A 16 SER HBx 1.0 1.789 3.611 278 254 A 16 SER H A 15 GLU HBx 1.0 1.846 3.932 279 255 A 15 GLU HBy A 16 SER H 1.0 1.893 4.257 280 256 A 17 HIS H A 16 SER H 1.0 1.931 4.577 281 257 A 62 LEU H A 63 GLU H 1.0 1.685 3.143 282 258 A 61 TYR HA A 63 GLU H 1.0 1.884 4.192 283 259 A 63 GLU H A 60 GLU HA 1.0 1.760 3.468 284 260 A 63 GLU H A 63 GLU HGx 1.0 1.766 3.496 285 261 A 63 GLU H A 63 GLU HBy 1.0 1.520 2.560 286 262 A 62 LEU HBy A 63 GLU H 1.0 1.621 2.897 287 263 A 62 LEU HBx A 63 GLU H 1.0 1.726 3.314 288 264 A 41 ARG H A 42 LEU H 1.0 1.923 4.511 289 265 A 26 LEU HDx% A 41 ARG H 1.0 1.893 4.259 290 266 A 58 ILE H A 60 GLU H 1.0 1.896 4.282 291 267 A 57 TRP HA A 60 GLU H 1.0 1.830 3.842 292 268 A 60 GLU H A 59 GLN HA 1.0 1.795 3.643 293 269 A 60 GLU H A 60 GLU HGy 1.0 1.652 3.008 294 270 A 60 GLU H A 58 ILE HG2% 1.0 1.940 4.674 295 271 A 41 ARG H A 24 LYS H 1.0 1.827 3.819 296 272 A 41 ARG H A 40 ALA HA 1.0 1.556 2.676 297 273 A 41 ARG H A 41 ARG HBy 1.0 1.649 2.997 298 274 A 40 ALA HB% A 41 ARG H 1.0 1.613 2.869 299 275 A 41 ARG H A 23 VAL HGy% 1.0 1.760 3.468 300 276 A 68 LYS H A 67 ASN H 1.0 1.855 3.989 301 277 A 67 ASN H A 64 LYS HA 1.0 1.817 3.761 302 278 A 67 ASN H A 67 ASN HBy 1.0 1.663 3.055 303 279 A 67 ASN H A 66 LEU HBy 1.0 1.734 3.350 304 280 A 67 ASN H A 66 LEU HBx 1.0 1.786 3.598 305 281 A 65 ALA HB% A 67 ASN H 1.0 1.911 4.403 306 282 A 64 LYS H A 66 LEU H 1.0 1.810 3.728 307 283 A 66 LEU H A 65 ALA HA 1.0 1.738 3.366 308 284 A 66 LEU H A 63 GLU HA 1.0 1.850 3.958 309 285 A 66 LEU H A 62 LEU HA 1.0 1.863 4.047 310 286 A 67 ASN HBy A 66 LEU H 1.0 1.983 5.277 311 287 A 66 LEU HBy A 66 LEU H 1.0 1.536 2.612 312 288 A 65 ALA HB% A 66 LEU H 1.0 1.656 3.028 313 289 A 66 LEU H A 66 LEU HDx% 1.0 1.680 3.120 314 290 A 64 LYS H A 63 GLU HGx 1.0 1.935 4.625 315 291 A 64 LYS H A 64 LYS HDy 1.0 1.753 3.435 316 292 A 64 LYS H A 63 GLU H 1.0 1.596 2.806 317 293 A 64 LYS H A 64 LYS HA 1.0 1.636 2.952 318 294 A 64 LYS H A 63 GLU HA 1.0 1.775 3.541 319 295 A 64 LYS H A 62 LEU HA 1.0 1.884 4.194 320 296 A 64 LYS H A 63 GLU HBy 1.0 1.643 2.979 321 297 A 64 LYS H A 64 LYS HBx 1.0 1.553 2.665 322 298 A 64 LYS H A 64 LYS HGx 1.0 1.685 3.139 323 299 A 65 ALA HB% A 64 LYS H 1.0 1.851 3.967 324 300 A 21 ALA H A 20 ARG HBx 1.0 1.818 3.768 325 301 A 21 ALA H A 23 VAL H 1.0 1.854 3.984 326 302 A 19 ALA HA A 21 ALA H 1.0 1.883 4.187 327 303 A 21 ALA H A 20 ARG HA 1.0 1.868 4.080 328 304 A 21 ALA H A 20 ARG HBy 1.0 1.719 3.279 329 305 A 42 LEU HBy A 46 ASN H 1.0 1.959 4.885 330 306 A 34 CYS H A 33 ASN H 1.0 1.743 3.387 331 307 A 31 THR H A 34 CYS H 1.0 1.949 4.767 332 308 A 34 CYS H A 34 CYS HA 1.0 1.745 3.401 333 309 A 34 CYS HBy A 34 CYS H 1.0 1.733 3.345 334 310 A 34 CYS HBx A 34 CYS H 1.0 1.675 3.097 335 311 A 31 THR HG2% A 34 CYS H 1.0 1.891 4.243 336 312 A 13 PHE HBy A 13 PHE H 1.0 1.691 3.163 337 313 A 13 PHE HA A 13 PHE H 1.0 1.733 3.343 338 314 A 13 PHE H A 12 ARG HBy 1.0 1.739 3.367 339 315 A 13 PHE H A 12 ARG HA 1.0 1.790 3.620 340 316 A 23 VAL H A 22 ASN HA 1.0 1.771 3.519 341 317 A 23 VAL H A 22 ASN H 1.0 1.639 2.963 342 318 A 23 VAL H A 23 VAL HB 1.0 1.673 3.095 343 319 A 23 VAL H A 23 VAL HGx% 1.0 1.560 2.686 344 320 A 23 VAL H A 43 LYS H 1.0 1.964 4.958 345 321 A 43 LYS HA A 46 ASN H 1.0 1.981 5.237 346 322 A 46 ASN H A 46 ASN HBx 1.0 1.852 3.972 347 323 A 46 ASN H A 45 ASN H 1.0 1.795 3.641 348 324 A 6 SER H A 7 TYR H 1.0 1.781 3.573 349 325 A 6 SER H A 6 SER HBy 1.0 1.784 3.588 350 326 A 6 SER H A 5 LEU HBx 1.0 1.904 4.344 351 327 A 55 LEU H A 54 LYS H 1.0 1.624 2.908 352 328 A 54 LYS H A 54 LYS HA 1.0 1.621 2.895 353 329 A 52 ASP HA A 54 LYS H 1.0 1.845 3.931 354 330 A 54 LYS H A 53 PRO HDy 1.0 1.852 3.972 355 331 A 52 ASP HBy A 54 LYS H 1.0 1.911 4.397 356 332 A 54 LYS H A 53 PRO HBx 1.0 1.906 4.362 357 333 A 54 LYS H A 54 LYS HGx 1.0 1.611 2.859 358 334 A 54 LYS H A 53 PRO HDx 1.0 1.794 3.638 359 335 A 41 ARG H A 25 HIS H 1.0 1.950 4.782 360 336 A 25 HIS H A 25 HIS HA 1.0 1.738 3.368 361 337 A 25 HIS H A 25 HIS HBy 1.0 1.851 3.967 362 338 A 25 HIS H A 24 LYS HBx 1.0 1.735 3.353 363 339 A 45 ASN H A 44 ASN HD2x 1.0 1.958 4.878 364 340 A 45 ASN H A 45 ASN HA 1.0 1.647 2.993 365 341 A 42 LEU HBy A 45 ASN H 1.0 1.934 4.614 366 342 A 45 ASN H A 45 ASN HBy 1.0 1.882 4.170 367 343 A 45 ASN HBx A 45 ASN H 1.0 1.833 3.859 368 344 A 45 ASN H A 42 LEU HBx 1.0 1.903 4.329 369 345 A 11 CYS H A 37 GLN HE2y 1.0 1.950 4.776 370 346 A 11 CYS H A 11 CYS HA 1.0 1.731 3.333 371 347 A 11 CYS H A 10 PRO HDx 1.0 1.783 3.585 372 348 A 11 CYS H A 11 CYS HBx 1.0 1.679 3.113 373 349 A 11 CYS H A 11 CYS HBy 1.0 1.690 3.158 374 350 A 11 CYS H A 10 PRO HBx 1.0 1.828 3.824 375 351 A 11 CYS H A 10 PRO HBy 1.0 1.777 3.553 376 352 A 11 CYS H A 37 GLN HE2x 1.0 1.909 4.389 377 353 A 11 CYS H A 10 PRO HA 1.0 1.771 3.521 378 354 A 44 ASN H A 44 ASN HBx 1.0 1.945 4.735 379 355 A 44 ASN H A 44 ASN HBy 1.0 1.962 4.930 380 356 A 44 ASN H A 44 ASN HA 1.0 1.911 4.397 381 357 A 11 CYS H A 29 LEU HG 1.0 1.909 4.379 382 358 A 9 CYS HBy A 11 CYS H 1.0 1.846 3.932 383 359 A 57 TRP H A 56 LYS HA 1.0 1.849 3.951 384 360 A 57 TRP HA A 57 TRP H 1.0 1.719 3.283 385 361 A 57 TRP H A 58 ILE H 1.0 1.748 3.412 386 362 A 57 TRP H A 57 TRP HBx 1.0 1.743 3.391 387 363 A 57 TRP H A 56 LYS HBy 1.0 1.690 3.164 388 364 A 57 TRP H A 55 LEU HBx 1.0 1.884 4.190 389 365 A 62 LEU HDx% A 59 GLN HE2x 1.0 1.913 4.411 390 366 A 58 ILE HG2% A 59 GLN HE2x 1.0 1.939 4.665 391 367 A 61 TYR H A 59 GLN HE2x 1.0 0.000 22.728 392 368 A 59 GLN HE2x A 59 GLN HE2y 1.0 1.354 2.098 393 369 A 59 GLN HBy A 59 GLN HE2x 1.0 1.878 4.144 394 370 A 59 GLN HA A 59 GLN HE2x 1.0 1.933 4.597 395 371 A 59 GLN HGy A 59 GLN HE2y 1.0 1.818 3.768 396 372 A 58 ILE HG2% A 59 GLN HE2y 1.0 1.980 5.220 397 373 A 4 SER HA A 4 SER H 1.0 1.897 4.283 398 374 A 13 PHE H A 14 PHE H 1.0 1.955 4.841 399 375 A 14 PHE HDx A 14 PHE H 1.0 1.955 4.843 400 375 A 14 PHE HDy A 14 PHE H 1.0 1.955 4.843 401 376 A 18 ILE HD1% A 15 GLU H 1.0 1.915 4.437 402 377 A 50 CYS HBx A 15 GLU H 1.0 1.968 5.014 403 378 A 15 GLU H A 18 ILE H 1.0 1.979 5.207 404 379 A 52 ASP HBx A 16 SER H 1.0 1.941 4.683 405 380 A 18 ILE H A 16 SER H 1.0 2.000 5.924 406 381 A 17 HIS H A 17 HIS HBy 1.0 1.997 6.293 407 382 A 17 HIS H A 17 HIS HBx 1.0 1.983 6.757 408 383 A 18 ILE H A 15 GLU HA 1.0 1.970 5.048 409 384 A 18 ILE H A 16 SER HBy 1.0 1.999 5.843 410 385 A 18 ILE H A 15 GLU HBx 1.0 1.999 5.887 411 386 A 51 ILE HG2% A 18 ILE H 1.0 1.931 4.581 412 387 A 22 ASN HBy A 19 ALA H 1.0 1.968 5.016 413 388 A 19 ALA H A 22 ASN HBx 1.0 1.922 4.494 414 389 A 19 ALA H A 18 ILE HG2% 1.0 1.766 3.496 415 390 A 19 ALA H A 18 ILE HG1y 1.0 1.935 4.619 416 391 A 22 ASN H A 23 VAL HGx% 1.0 1.758 3.460 417 392 A 22 ASN H A 43 LYS HDy 1.0 1.974 5.106 418 393 A 23 VAL HB A 22 ASN H 1.0 1.925 4.519 419 394 A 22 ASN HBy A 22 ASN H 1.0 1.739 3.371 420 395 A 21 ALA H A 22 ASN H 1.0 1.807 3.709 421 396 A 19 ALA H A 22 ASN H 1.0 1.996 5.668 422 397 A 22 ASN HA A 22 ASN HD2x 1.0 1.986 5.360 423 398 A 22 ASN HBy A 22 ASN HD2x 1.0 1.960 4.908 424 399 A 22 ASN HBx A 22 ASN HD2x 1.0 1.961 4.927 425 400 A 19 ALA HB% A 22 ASN HD2x 1.0 1.938 4.658 426 401 A 22 ASN HD2x A 22 ASN HD2y 1.0 1.608 2.848 427 402 A 19 ALA H A 22 ASN HD2x 1.0 1.988 6.630 428 403 A 19 ALA H A 22 ASN HD2y 1.0 1.997 5.671 429 404 A 22 ASN HA A 22 ASN HD2y 1.0 1.949 4.775 430 405 A 22 ASN HBy A 22 ASN HD2y 1.0 1.930 4.576 431 406 A 22 ASN HBx A 22 ASN HD2y 1.0 1.933 4.605 432 407 A 19 ALA HB% A 22 ASN HD2y 1.0 1.936 4.626 433 408 A 42 LEU HDx% A 22 ASN HD2y 1.0 1.993 5.519 434 409 A 22 ASN HD2y A 18 ILE HA 1.0 1.999 5.789 435 410 A 20 ARG HA A 23 VAL H 1.0 1.913 4.423 436 411 A 23 VAL H A 22 ASN HBx 1.0 1.880 4.160 437 412 A 23 VAL H A 23 VAL HA 1.0 1.844 3.926 438 413 A 42 LEU H A 24 LYS H 1.0 1.988 5.394 439 414 A 24 LYS H A 25 HIS HBy 1.0 1.995 6.401 440 415 A 24 LYS H A 24 LYS HEy 1.0 1.995 6.381 441 416 A 26 LEU HBy A 26 LEU H 1.0 1.794 3.642 442 417 A 28 ILE H A 27 LYS HDy 1.0 1.616 2.876 443 418 A 37 GLN HBy A 37 GLN H 1.0 1.828 3.824 444 419 A 37 GLN HBx A 37 GLN H 1.0 1.840 3.894 445 420 A 39 VAL H A 29 LEU H 1.0 1.915 4.441 446 421 A 38 ILE HA A 29 LEU H 1.0 1.912 4.404 447 422 A 28 ILE HA A 29 LEU H 1.0 1.629 2.929 448 423 A 37 GLN HBx A 29 LEU H 1.0 1.954 4.832 449 424 A 37 GLN HBy A 29 LEU H 1.0 1.969 5.037 450 425 A 29 LEU H A 29 LEU HBy 1.0 1.745 3.397 451 426 A 29 LEU HBx A 29 LEU H 1.0 1.721 3.289 452 427 A 29 LEU H A 28 ILE HG2% 1.0 1.680 3.118 453 428 A 48 GLN HBx A 48 GLN HE2x 1.0 1.962 4.936 454 429 A 48 GLN HBy A 48 GLN HE2x 1.0 1.965 4.985 455 430 A 48 GLN HE2x A 39 VAL HGy% 1.0 1.871 4.103 456 431 A 30 ASN HA A 30 ASN HD2y 1.0 1.980 5.232 457 432 A 30 ASN HA A 30 ASN HD2x 1.0 1.999 5.801 458 433 A 31 THR H A 32 PRO HDx 1.0 1.968 5.016 459 434 A 34 CYS HBx A 31 THR H 1.0 1.932 4.600 460 435 A 33 ASN H A 32 PRO HGy 1.0 1.974 5.114 461 436 A 33 ASN H A 32 PRO HBy 1.0 1.951 4.793 462 437 A 33 ASN H A 32 PRO HBx 1.0 1.953 4.821 463 438 A 33 ASN H A 32 PRO HGx 1.0 1.983 5.271 464 439 A 32 PRO HBy A 33 ASN HD2y 1.0 2.000 5.988 465 440 A 32 PRO HBx A 33 ASN HD2y 1.0 2.000 5.978 466 441 A 33 ASN HD2y A 33 ASN HA 1.0 1.999 6.135 467 442 A 33 ASN HA A 33 ASN HD2x 1.0 2.000 5.990 468 443 A 33 ASN HD2y A 33 ASN HD2x 1.0 1.546 2.642 469 444 A 32 PRO HBy A 33 ASN HD2x 1.0 2.000 6.032 470 445 A 32 PRO HBx A 33 ASN HD2x 1.0 1.996 6.382 471 446 A 34 CYS H A 32 PRO HBy 1.0 1.994 5.592 472 447 A 34 CYS H A 32 PRO HGx 1.0 1.993 5.557 473 448 A 34 CYS H A 32 PRO HBx 1.0 1.993 5.547 474 449 A 31 THR HB A 34 CYS H 1.0 1.927 4.549 475 450 A 34 CYS H A 33 ASN HA 1.0 1.819 3.775 476 451 A 35 ALA H A 37 GLN HE2x 1.0 1.995 5.617 477 452 A 35 ALA H A 37 GLN HE2y 1.0 1.981 6.785 478 453 A 37 GLN HE2y A 37 GLN HA 1.0 2.000 5.916 479 454 A 34 CYS HBy A 37 GLN HE2y 1.0 1.981 5.233 480 455 A 37 GLN HBx A 37 GLN HE2y 1.0 1.988 5.398 481 456 A 29 LEU HBx A 37 GLN HE2y 1.0 1.995 5.633 482 457 A 35 ALA HB% A 37 GLN HE2y 1.0 1.994 5.548 483 458 A 9 CYS HBx A 37 GLN HE2y 1.0 1.994 5.552 484 459 A 31 THR HG2% A 37 GLN HE2y 1.0 1.992 6.500 485 460 A 31 THR HB A 37 GLN HE2y 1.0 1.998 6.256 486 461 A 37 GLN HE2x A 37 GLN HA 1.0 1.999 5.835 487 462 A 10 PRO HDx A 37 GLN HE2x 1.0 1.990 5.430 488 463 A 9 CYS HBx A 37 GLN HE2x 1.0 1.993 5.509 489 464 A 37 GLN HBx A 37 GLN HE2x 1.0 1.976 5.146 490 465 A 35 ALA HB% A 37 GLN HE2x 1.0 1.997 5.719 491 466 A 29 LEU HBx A 37 GLN HE2x 1.0 1.999 5.769 492 467 A 31 THR HG2% A 37 GLN HE2x 1.0 1.994 6.466 493 468 A 31 THR HB A 37 GLN HE2x 1.0 1.998 6.248 494 469 A 9 CYS HA A 37 GLN HE2x 1.0 1.997 6.323 495 470 A 37 GLN HE2y A 37 GLN HE2x 1.0 1.673 3.091 496 471 A 38 ILE H A 38 ILE HG1x 1.0 1.926 4.538 497 472 A 38 ILE H A 37 GLN H 1.0 1.987 5.367 498 473 A 38 ILE H A 51 ILE H 1.0 1.988 5.388 499 474 A 38 ILE H A 29 LEU H 1.0 1.968 5.022 500 475 A 26 LEU HDx% A 39 VAL H 1.0 1.965 4.985 501 476 A 40 ALA H A 51 ILE H 1.0 1.965 4.971 502 477 A 41 ARG H A 26 LEU HA 1.0 1.926 4.538 503 478 A 42 LEU H A 48 GLN H 1.0 1.949 4.769 504 479 A 42 LEU H A 47 ARG HA 1.0 2.000 6.104 505 480 A 43 LYS H A 23 VAL HA 1.0 1.775 3.545 506 481 A 44 ASN H A 43 LYS HDy 1.0 1.996 5.624 507 482 A 44 ASN HBy A 44 ASN HD2y 1.0 1.930 4.574 508 483 A 44 ASN HBx A 44 ASN HD2y 1.0 1.928 4.558 509 484 A 42 LEU HDy% A 45 ASN H 1.0 1.997 6.357 510 485 A 42 LEU HDx% A 45 ASN H 1.0 1.995 6.385 511 486 A 45 ASN H A 44 ASN HBx 1.0 1.960 4.908 512 487 A 45 ASN H A 44 ASN HA 1.0 1.911 4.401 513 488 A 45 ASN H A 45 ASN HD2y 1.0 1.992 6.512 514 489 A 47 ARG HGx A 45 ASN HD2y 1.0 1.999 5.827 515 490 A 45 ASN HBx A 45 ASN HD2y 1.0 1.919 4.477 516 491 A 42 LEU HDy% A 45 ASN HD2y 1.0 2.000 6.144 517 492 A 42 LEU HBy A 45 ASN HD2y 1.0 1.989 6.603 518 493 A 45 ASN HD2y A 45 ASN HD2x 1.0 1.574 2.734 519 494 A 42 LEU HDy% A 45 ASN HD2x 1.0 2.000 5.958 520 495 A 47 ARG HBx A 45 ASN HD2x 1.0 1.957 4.873 521 496 A 47 ARG HGx A 45 ASN HD2x 1.0 1.997 5.691 522 497 A 42 LEU HDx% A 45 ASN HD2x 1.0 1.945 4.729 523 498 A 45 ASN HBx A 45 ASN HD2x 1.0 1.851 3.967 524 499 A 42 LEU HBy A 45 ASN HD2x 1.0 1.994 6.422 525 500 A 46 ASN H A 42 LEU HBx 1.0 1.969 5.043 526 501 A 47 ARG H A 45 ASN HD2y 1.0 1.993 5.533 527 502 A 48 GLN H A 48 GLN HE2x 1.0 2.000 6.138 528 503 A 39 VAL HGy% A 48 GLN HE2y 1.0 1.976 5.148 529 504 A 48 GLN HBy A 48 GLN HE2y 1.0 2.000 6.076 530 505 A 48 GLN HBx A 48 GLN HE2y 1.0 2.000 5.962 531 506 A 49 VAL H A 49 VAL HA 1.0 1.834 3.862 532 507 A 49 VAL H A 48 GLN HBx 1.0 1.875 4.119 533 508 A 49 VAL H A 48 GLN HBy 1.0 1.874 4.120 534 509 A 49 VAL H A 49 VAL HGy% 1.0 1.745 3.399 535 510 A 49 VAL H A 41 ARG HDx 1.0 1.993 5.531 536 511 A 15 GLU HBy A 50 CYS H 1.0 1.960 4.914 537 512 A 51 ILE HA A 50 CYS H 1.0 1.981 5.239 538 513 A 38 ILE HA A 51 ILE H 1.0 1.986 5.348 539 514 A 14 PHE HBy A 51 ILE H 1.0 1.996 5.642 540 515 A 51 ILE H A 58 ILE HD1% 1.0 1.998 5.752 541 516 A 52 ASP H A 51 ILE H 1.0 1.995 5.625 542 517 A 14 PHE HDx A 51 ILE H 1.0 1.993 6.491 543 517 A 14 PHE HDy A 51 ILE H 1.0 1.993 6.491 544 518 A 52 ASP H A 53 PRO HDy 1.0 1.970 5.040 545 519 A 52 ASP H A 53 PRO HDx 1.0 1.974 5.104 546 520 A 52 ASP H A 15 GLU HBy 1.0 1.962 4.934 547 521 A 52 ASP H A 51 ILE HB 1.0 1.915 4.437 548 522 A 54 LYS H A 54 LYS HEx 1.0 1.995 5.641 549 523 A 52 ASP HBx A 54 LYS H 1.0 1.995 5.603 550 524 A 58 ILE HG2% A 54 LYS H 1.0 1.972 5.090 551 525 A 55 LEU H A 58 ILE HG1y 1.0 1.889 4.223 552 526 A 58 ILE HG2% A 55 LEU H 1.0 1.876 4.136 553 527 A 55 LEU H A 53 PRO HDx 1.0 2.000 5.930 554 528 A 52 ASP HA A 55 LEU H 1.0 1.986 5.350 555 529 A 56 LYS H A 56 LYS HA 1.0 1.830 3.840 556 530 A 57 TRP H A 55 LEU HA 1.0 1.956 4.862 557 531 A 57 TRP HE1 A 58 ILE H 1.0 1.995 5.601 558 532 A 20 ARG HBx A 57 TRP HE1 1.0 2.000 6.110 559 533 A 57 TRP HD1 A 57 TRP HE1 1.0 1.695 3.181 560 534 A 57 TRP HZ2 A 57 TRP HE1 1.0 1.819 3.771 561 535 A 57 TRP HE1 A 55 LEU HA 1.0 1.998 5.748 562 536 A 57 TRP HE1 A 57 TRP HBx 1.0 1.990 5.442 563 537 A 20 ARG HA A 57 TRP HE1 1.0 1.996 5.668 564 538 A 57 TRP HE1 A 18 ILE HB 1.0 1.967 5.013 565 539 A 55 LEU HDx% A 57 TRP HE1 1.0 1.663 3.051 566 540 A 51 ILE HG2% A 57 TRP HE1 1.0 1.911 4.401 567 541 A 56 LYS H A 58 ILE H 1.0 1.998 6.248 568 542 A 58 ILE H A 56 LYS HA 1.0 1.931 4.587 569 543 A 58 ILE H A 55 LEU HA 1.0 1.941 4.681 570 544 A 58 ILE H A 57 TRP HBx 1.0 1.884 4.190 571 545 A 56 LYS HBy A 58 ILE H 1.0 1.960 4.908 572 546 A 58 ILE H A 58 ILE HD1% 1.0 1.801 3.671 573 547 A 58 ILE HG1x A 59 GLN H 1.0 1.947 4.753 574 548 A 58 ILE HD1% A 59 GLN H 1.0 1.952 4.814 575 549 A 55 LEU HBx A 59 GLN H 1.0 1.966 5.000 576 550 A 62 LEU HBy A 59 GLN H 1.0 1.929 4.569 577 551 A 59 GLN H A 59 GLN HE2x 1.0 1.879 4.151 578 552 A 59 GLN HA A 59 GLN HE2y 1.0 1.992 5.490 579 553 A 60 GLU H A 60 GLU HBy 1.0 1.683 3.131 580 554 A 26 LEU HDy% A 61 TYR H 1.0 1.999 5.803 581 555 A 64 LYS H A 62 LEU H 1.0 1.958 4.870 582 556 A 62 LEU H A 60 GLU HA 1.0 1.983 5.287 583 557 A 66 LEU H A 67 ASN HD2y 1.0 1.853 3.977 584 558 A 8 ARG H A 8 ARG HGy 1.0 1.882 4.180 585 559 A 8 ARG H A 8 ARG HBy 1.0 1.867 4.065 586 560 A 30 ASN HD2y A 30 ASN HD2x 1.0 1.473 2.419 587 561 A 59 GLN HA A 62 LEU H 1.0 1.859 4.015 588 562 A 62 LEU HDx% A 59 GLN HA 1.0 1.684 3.134 589 563 A 58 ILE H A 59 GLN HA 1.0 2.000 5.970 590 564 A 49 VAL HA A 49 VAL HB 1.0 1.564 2.700 591 565 A 18 ILE HG1x A 18 ILE HA 1.0 1.693 3.173 592 566 A 60 GLU H A 60 GLU HA 1.0 1.619 2.891 593 567 A 61 TYR H A 60 GLU HA 1.0 1.788 3.612 594 568 A 60 GLU HA A 60 GLU HGy 1.0 1.671 3.083 595 569 A 63 GLU H A 63 GLU HA 1.0 1.579 2.751 596 570 A 63 GLU HGx A 63 GLU HA 1.0 1.687 3.145 597 571 A 63 GLU HA A 63 GLU HGy 1.0 1.631 2.933 598 572 A 66 LEU HBy A 63 GLU HA 1.0 1.720 3.288 599 573 A 43 LYS HA A 43 LYS HBy 1.0 1.545 2.637 600 574 A 43 LYS HA A 43 LYS H 1.0 1.720 3.288 601 575 A 43 LYS HA A 43 LYS HBx 1.0 1.606 2.844 602 576 A 24 LYS HDy A 43 LYS HA 1.0 1.577 2.741 603 577 A 24 LYS HGy A 43 LYS HA 1.0 1.841 3.899 604 578 A 19 ALA H A 18 ILE HA 1.0 1.504 2.510 605 579 A 18 ILE H A 18 ILE HA 1.0 1.755 3.447 606 580 A 18 ILE HB A 18 ILE HA 1.0 1.668 3.070 607 581 A 18 ILE HG2% A 18 ILE HA 1.0 1.611 2.861 608 582 A 57 TRP HZ2 A 20 ARG HA 1.0 1.865 4.055 609 583 A 57 TRP HH2 A 20 ARG HA 1.0 1.820 3.784 610 584 A 19 ALA HA A 20 ARG HA 1.0 1.929 4.569 611 585 A 20 ARG HA A 20 ARG HBy 1.0 1.658 3.032 612 586 A 20 ARG HA A 23 VAL HGx% 1.0 1.590 2.788 613 587 A 20 ARG HA A 20 ARG HBx 1.0 1.627 2.919 614 588 A 20 ARG HA A 23 VAL HB 1.0 1.861 4.035 615 589 A 57 TRP HBy A 57 TRP HA 1.0 1.518 2.556 616 590 A 6 SER H A 6 SER HA 1.0 1.842 3.908 617 591 A 7 TYR H A 6 SER HA 1.0 1.680 3.118 618 592 A 6 SER HBy A 6 SER HA 1.0 1.539 2.619 619 593 A 64 LYS HA A 67 ASN HBy 1.0 1.861 4.033 620 594 A 8 ARG H A 7 TYR HA 1.0 1.666 3.064 621 595 A 7 TYR H A 7 TYR HA 1.0 1.788 3.606 622 596 A 7 TYR HBx A 7 TYR HA 1.0 1.577 2.743 623 597 A 4 SER HA A 4 SER HBx 1.0 1.657 3.031 624 598 A 64 LYS HA A 64 LYS HGx 1.0 1.692 3.170 625 599 A 7 TYR HDx A 7 TYR HA 1.0 1.701 3.203 626 599 A 7 TYR HDy A 7 TYR HA 1.0 1.701 3.203 627 600 A 62 LEU H A 62 LEU HA 1.0 1.718 3.276 628 601 A 65 ALA H A 62 LEU HA 1.0 1.750 3.424 629 602 A 61 TYR HDy A 62 LEU HA 1.0 1.858 4.008 630 603 A 62 LEU HBy A 62 LEU HA 1.0 1.594 2.802 631 604 A 62 LEU HBx A 62 LEU HA 1.0 1.598 2.814 632 605 A 65 ALA HB% A 62 LEU HA 1.0 1.682 3.128 633 606 A 61 TYR HBy A 62 LEU HA 1.0 1.884 4.188 634 607 A 48 GLN H A 47 ARG HA 1.0 1.481 2.441 635 608 A 12 ARG HA A 12 ARG HDy 1.0 1.780 3.566 636 609 A 12 ARG HBy A 12 ARG HA 1.0 1.506 2.520 637 610 A 40 ALA H A 50 CYS HA 1.0 1.870 4.090 638 611 A 50 CYS HA A 50 CYS H 1.0 1.771 3.523 639 612 A 50 CYS HA A 51 ILE H 1.0 1.599 2.819 640 613 A 39 VAL HA A 50 CYS HA 1.0 1.680 3.120 641 614 A 50 CYS HA A 50 CYS HBy 1.0 1.774 3.540 642 615 A 59 GLN HGy A 54 LYS HA 1.0 1.808 3.716 643 616 A 54 LYS HA A 54 LYS HGx 1.0 1.582 2.760 644 617 A 50 CYS HA A 51 ILE HG1x 1.0 1.894 4.268 645 618 A 16 SER H A 15 GLU HA 1.0 1.570 2.720 646 619 A 15 GLU HBx A 15 GLU HA 1.0 1.667 3.069 647 620 A 15 GLU HBy A 15 GLU HA 1.0 1.701 3.203 648 621 A 13 PHE HA A 14 PHE H 1.0 1.489 2.467 649 622 A 13 PHE HBx A 13 PHE HA 1.0 1.581 2.757 650 623 A 54 LYS HA A 59 GLN HE2x 1.0 1.828 3.826 651 624 A 54 LYS HA A 59 GLN HE2y 1.0 1.903 4.335 652 625 A 49 VAL H A 48 GLN HA 1.0 1.544 2.636 653 626 A 48 GLN HA A 48 GLN HBy 1.0 1.718 3.276 654 627 A 48 GLN HA A 48 GLN HBx 1.0 1.728 3.322 655 628 A 48 GLN HA A 41 ARG HGx 1.0 1.749 3.417 656 629 A 15 GLU HGx A 15 GLU HA 1.0 1.767 3.505 657 630 A 24 LYS HGx A 24 LYS HA 1.0 1.728 3.322 658 631 A 24 LYS H A 24 LYS HA 1.0 1.721 3.291 659 632 A 24 LYS HBx A 24 LYS HA 1.0 1.536 2.612 660 633 A 66 LEU H A 66 LEU HA 1.0 1.611 2.861 661 634 A 56 LYS H A 55 LEU HA 1.0 1.639 2.965 662 635 A 55 LEU HDy% A 55 LEU HA 1.0 1.460 2.382 663 636 A 17 HIS HA A 17 HIS HBy 1.0 1.610 2.858 664 637 A 26 LEU HDx% A 26 LEU HA 1.0 1.689 3.157 665 638 A 27 LYS HA A 28 ILE H 1.0 1.482 2.446 666 639 A 26 LEU H A 25 HIS HA 1.0 1.627 2.917 667 640 A 44 ASN HBy A 44 ASN HA 1.0 1.509 2.527 668 641 A 5 LEU HA A 5 LEU HBx 1.0 1.584 2.766 669 642 A 5 LEU HA A 5 LEU HDy% 1.0 1.568 2.712 670 643 A 55 LEU HBx A 55 LEU HA 1.0 1.666 3.066 671 644 A 35 ALA H A 34 CYS HA 1.0 1.650 3.004 672 645 A 34 CYS HBy A 34 CYS HA 1.0 1.566 2.708 673 646 A 33 ASN H A 33 ASN HA 1.0 1.667 3.069 674 647 A 33 ASN HA A 33 ASN HBx 1.0 1.568 2.714 675 648 A 34 CYS HBx A 34 CYS HA 1.0 1.710 3.242 676 649 A 46 ASN HA A 46 ASN H 1.0 1.639 2.961 677 650 A 46 ASN HA A 46 ASN HBx 1.0 1.637 2.955 678 651 A 42 LEU HA A 42 LEU HG 1.0 1.580 2.754 679 652 A 42 LEU HA A 42 LEU HDy% 1.0 1.519 2.557 680 653 A 37 GLN H A 37 GLN HA 1.0 1.676 3.102 681 654 A 38 ILE H A 37 GLN HA 1.0 1.583 2.763 682 655 A 37 GLN HGx A 37 GLN HA 1.0 1.674 3.096 683 656 A 37 GLN HBy A 37 GLN HA 1.0 1.653 3.013 684 657 A 29 LEU H A 29 LEU HA 1.0 1.747 3.411 685 658 A 30 ASN H A 29 LEU HA 1.0 1.725 3.311 686 659 A 65 ALA H A 65 ALA HA 1.0 1.621 2.895 687 660 A 65 ALA HB% A 65 ALA HA 1.0 1.427 2.289 688 661 A 41 ARG HA A 41 ARG HDx 1.0 1.767 3.501 689 662 A 12 ARG H A 11 CYS HA 1.0 1.706 3.226 690 663 A 67 ASN HA A 67 ASN H 1.0 1.595 2.803 691 664 A 41 ARG H A 41 ARG HA 1.0 1.783 3.579 692 665 A 41 ARG HA A 41 ARG HGx 1.0 1.645 2.983 693 666 A 11 CYS HA A 11 CYS HBy 1.0 1.602 2.826 694 667 A 67 ASN HA A 67 ASN HBx 1.0 1.538 2.618 695 668 A 21 ALA H A 21 ALA HA 1.0 1.675 3.099 696 669 A 22 ASN H A 21 ALA HA 1.0 1.767 3.503 697 670 A 20 ARG HBy A 21 ALA HA 1.0 1.856 4.000 698 671 A 23 VAL H A 21 ALA HA 1.0 1.831 3.841 699 672 A 21 ALA HA A 21 ALA HB% 1.0 1.445 2.339 700 673 A 9 CYS HA A 10 PRO HDx 1.0 1.471 2.413 701 674 A 9 CYS HBy A 9 CYS HA 1.0 1.631 2.931 702 675 A 22 ASN HBy A 22 ASN HA 1.0 1.576 2.740 703 676 A 22 ASN HA A 43 LYS HDy 1.0 1.630 2.928 704 677 A 22 ASN HA A 22 ASN H 1.0 1.657 3.029 705 678 A 30 ASN HA A 30 ASN HBy 1.0 1.666 3.062 706 679 A 30 ASN H A 30 ASN HA 1.0 1.833 3.853 707 680 A 30 ASN HA A 30 ASN HBx 1.0 1.641 2.967 708 681 A 35 ALA HA A 36 LEU H 1.0 1.533 2.601 709 682 A 52 ASP HA A 53 PRO HDy 1.0 1.560 2.688 710 683 A 52 ASP HA A 52 ASP HBx 1.0 1.716 3.270 711 684 A 32 PRO HDx A 32 PRO HBy 1.0 1.674 3.096 712 685 A 37 GLN HE2y A 10 PRO HDx 1.0 1.887 4.205 713 686 A 9 CYS HBy A 10 PRO HDx 1.0 1.689 3.153 714 687 A 9 CYS HBx A 10 PRO HDx 1.0 1.772 3.528 715 688 A 31 THR HG2% A 10 PRO HDx 1.0 1.648 2.996 716 689 A 31 THR HG2% A 32 PRO HDx 1.0 1.722 3.294 717 690 A 31 THR HA A 32 PRO HDx 1.0 1.579 2.753 718 691 A 31 THR HB A 32 PRO HDx 1.0 1.652 3.010 719 692 A 14 PHE HEx A 53 PRO HDy 1.0 1.909 4.389 720 692 A 14 PHE HEy A 53 PRO HDy 1.0 1.909 4.389 721 693 A 14 PHE HBy A 53 PRO HDy 1.0 1.850 3.956 722 694 A 53 PRO HDy A 53 PRO HBx 1.0 1.723 3.301 723 695 A 53 PRO HDy A 53 PRO HGx 1.0 1.599 2.819 724 696 A 52 ASP HA A 53 PRO HDx 1.0 1.536 2.612 725 697 A 53 PRO HDy A 53 PRO HDx 1.0 1.457 2.375 726 698 A 53 PRO HDx A 53 PRO HGx 1.0 1.582 2.758 727 699 A 19 ALA HA A 57 TRP HE1 1.0 1.753 3.435 728 700 A 19 ALA HA A 19 ALA H 1.0 1.730 3.332 729 701 A 19 ALA HA A 20 ARG H 1.0 1.525 2.577 730 702 A 19 ALA HA A 19 ALA HB% 1.0 1.498 2.492 731 703 A 40 ALA HA A 26 LEU HA 1.0 1.637 2.955 732 704 A 14 PHE HA A 50 CYS HBy 1.0 1.784 3.584 733 705 A 50 CYS HBy A 49 VAL HGx% 1.0 1.891 4.241 734 706 A 50 CYS HBx A 50 CYS HBy 1.0 1.502 2.506 735 707 A 50 CYS HBx A 51 ILE H 1.0 1.835 3.867 736 708 A 50 CYS HBx A 14 PHE HA 1.0 1.822 3.794 737 709 A 50 CYS HBx A 50 CYS HA 1.0 1.723 3.297 738 710 A 26 LEU HBy A 26 LEU HA 1.0 1.790 3.616 739 711 A 34 CYS HBy A 37 GLN HE2x 1.0 1.920 4.478 740 712 A 34 CYS HBy A 34 CYS HBx 1.0 1.465 2.397 741 713 A 34 CYS HBy A 37 GLN HGx 1.0 1.841 3.901 742 714 A 34 CYS HBx A 31 THR HB 1.0 1.822 3.792 743 715 A 26 LEU HA A 26 LEU HBx 1.0 1.753 3.437 744 716 A 27 LYS H A 26 LEU HBx 1.0 1.851 3.967 745 717 A 26 LEU HBy A 26 LEU HBx 1.0 1.374 2.150 746 718 A 26 LEU HBy A 27 LYS H 1.0 1.894 4.264 747 719 A 47 ARG HGx A 47 ARG HDx 1.0 1.425 2.287 748 720 A 47 ARG HBx A 47 ARG HDy 1.0 1.506 2.518 749 721 A 42 LEU HDx% A 47 ARG HDy 1.0 1.851 3.965 750 722 A 29 LEU HBx A 29 LEU HA 1.0 1.726 3.314 751 723 A 37 GLN HBx A 29 LEU HBx 1.0 1.846 3.934 752 724 A 20 ARG HBy A 20 ARG HDx 1.0 1.678 3.114 753 725 A 37 GLN HBx A 29 LEU HBy 1.0 1.878 4.142 754 726 A 29 LEU HG A 29 LEU HBy 1.0 1.631 2.935 755 727 A 42 LEU H A 41 ARG HDx 1.0 1.901 4.323 756 728 A 41 ARG HDx A 41 ARG HGx 1.0 1.500 2.502 757 729 A 52 ASP H A 52 ASP HBy 1.0 1.765 3.489 758 730 A 52 ASP HBy A 55 LEU HG 1.0 1.784 3.588 759 731 A 16 SER HA A 52 ASP HBx 1.0 1.878 4.146 760 732 A 52 ASP HBx A 52 ASP HBy 1.0 1.562 2.692 761 733 A 52 ASP HBx A 55 LEU HG 1.0 1.797 3.651 762 734 A 5 LEU HA A 5 LEU HBy 1.0 1.658 3.036 763 735 A 56 LYS HDy A 56 LYS HEx 1.0 1.539 2.619 764 736 A 46 ASN HA A 24 LYS HEy 1.0 1.814 3.746 765 737 A 43 LYS HA A 24 LYS HEy 1.0 1.745 3.397 766 738 A 24 LYS HDy A 24 LYS HEy 1.0 1.461 2.385 767 739 A 24 LYS HGy A 24 LYS HEy 1.0 1.658 3.032 768 740 A 66 LEU HBy A 66 LEU HA 1.0 1.704 3.218 769 741 A 66 LEU HBy A 66 LEU HBx 1.0 1.292 1.950 770 742 A 66 LEU HBx A 66 LEU HA 1.0 1.603 2.833 771 743 A 66 LEU HBx A 66 LEU HG 1.0 1.447 2.345 772 744 A 36 LEU HBx A 36 LEU HA 1.0 1.756 3.448 773 745 A 68 LYS HEy A 68 LYS HDy 1.0 1.445 2.341 774 746 A 62 LEU HBy A 59 GLN HA 1.0 1.663 3.053 775 747 A 62 LEU HBy A 62 LEU HBx 1.0 1.415 2.257 776 748 A 55 LEU HBx A 55 LEU HG 1.0 1.767 3.499 777 749 A 55 LEU HBx A 55 LEU H 1.0 1.755 3.443 778 750 A 55 LEU HA A 55 LEU HBy 1.0 1.786 3.596 779 751 A 55 LEU HBx A 55 LEU HBy 1.0 1.521 2.565 780 752 A 58 ILE H A 55 LEU HBy 1.0 1.892 4.250 781 753 A 55 LEU HG A 55 LEU HBy 1.0 1.780 3.564 782 754 A 54 LYS HEx A 54 LYS HDy 1.0 1.436 2.314 783 755 A 54 LYS HGx A 54 LYS HEx 1.0 1.637 2.953 784 756 A 42 LEU HBy A 43 LYS H 1.0 1.882 4.174 785 757 A 42 LEU HBy A 42 LEU HDx% 1.0 1.707 3.229 786 758 A 42 LEU HA A 42 LEU HBy 1.0 1.774 3.540 787 759 A 42 LEU HBy A 42 LEU HBx 1.0 1.514 2.542 788 760 A 42 LEU HBy A 42 LEU HDy% 1.0 1.777 3.551 789 761 A 42 LEU H A 42 LEU HBx 1.0 1.828 3.826 790 762 A 42 LEU HA A 42 LEU HBx 1.0 1.761 3.469 791 763 A 14 PHE HBy A 14 PHE H 1.0 1.697 3.191 792 764 A 14 PHE HA A 14 PHE HBy 1.0 1.602 2.832 793 765 A 14 PHE HBy A 51 ILE HA 1.0 1.788 3.612 794 766 A 52 ASP HA A 14 PHE HBy 1.0 1.689 3.159 795 767 A 13 PHE HBx A 13 PHE H 1.0 1.866 4.066 796 768 A 13 PHE HBy A 13 PHE HBx 1.0 1.332 2.046 797 769 A 13 PHE HBy A 13 PHE HA 1.0 1.685 3.137 798 770 A 23 VAL H A 22 ASN HBy 1.0 1.857 4.005 799 771 A 22 ASN HBy A 42 LEU HDy% 1.0 1.684 3.134 800 772 A 19 ALA HB% A 22 ASN HBy 1.0 1.797 3.653 801 773 A 11 CYS HBx A 11 CYS HBy 1.0 1.458 2.376 802 774 A 22 ASN H A 22 ASN HBx 1.0 1.634 2.946 803 775 A 22 ASN HBy A 22 ASN HBx 1.0 1.359 2.111 804 776 A 19 ALA HB% A 22 ASN HBx 1.0 1.781 3.571 805 777 A 9 CYS HBy A 9 CYS HBx 1.0 1.427 2.291 806 778 A 51 ILE HG2% A 18 ILE HB 1.0 1.747 3.407 807 779 A 19 ALA H A 18 ILE HB 1.0 1.858 4.012 808 780 A 30 ASN H A 30 ASN HBy 1.0 1.902 4.324 809 781 A 30 ASN HD2x A 30 ASN HBy 1.0 1.920 4.478 810 782 A 42 LEU HBy A 45 ASN HBx 1.0 1.979 5.203 811 783 A 42 LEU HG A 45 ASN HBx 1.0 1.992 5.494 812 784 A 45 ASN HBx A 45 ASN HBy 1.0 1.337 2.057 813 785 A 30 ASN HD2x A 30 ASN HBx 1.0 1.943 4.701 814 786 A 30 ASN H A 30 ASN HBx 1.0 1.884 4.186 815 787 A 29 LEU HDx% A 30 ASN HBx 1.0 1.760 3.466 816 788 A 46 ASN HBx A 46 ASN HD2y 1.0 1.848 3.946 817 789 A 45 ASN HBy A 45 ASN HD2x 1.0 1.758 3.460 818 790 A 45 ASN HA A 45 ASN HBy 1.0 1.617 2.883 819 791 A 31 THR H A 30 ASN HBy 1.0 1.856 4.000 820 792 A 30 ASN HD2y A 30 ASN HBy 1.0 1.791 3.619 821 793 A 45 ASN HBx A 45 ASN HA 1.0 1.565 2.705 822 794 A 46 ASN HBx A 46 ASN HBy 1.0 1.300 1.968 823 795 A 30 ASN HD2y A 30 ASN HBx 1.0 1.871 4.097 824 796 A 30 ASN HBy A 30 ASN HBx 1.0 1.347 2.081 825 797 A 31 THR H A 30 ASN HBx 1.0 1.940 4.674 826 798 A 7 TYR HDx A 7 TYR HBx 1.0 1.693 3.171 827 798 A 7 TYR HDy A 7 TYR HBx 1.0 1.693 3.171 828 799 A 7 TYR HDx A 7 TYR HBy 1.0 1.694 3.178 829 799 A 7 TYR HDy A 7 TYR HBy 1.0 1.694 3.178 830 800 A 7 TYR HBy A 7 TYR HA 1.0 1.656 3.028 831 801 A 7 TYR HBx A 7 TYR HBy 1.0 1.241 1.831 832 802 A 68 LYS H A 67 ASN HBy 1.0 1.861 4.033 833 803 A 67 ASN HA A 67 ASN HBy 1.0 1.585 2.769 834 804 A 46 ASN HD2y A 46 ASN HBy 1.0 1.855 3.995 835 805 A 28 ILE H A 28 ILE HB 1.0 1.678 3.110 836 806 A 28 ILE HA A 28 ILE HB 1.0 1.780 3.566 837 807 A 28 ILE HG2% A 28 ILE HB 1.0 1.509 2.529 838 808 A 28 ILE HG1x A 28 ILE HB 1.0 1.767 3.503 839 809 A 61 TYR HBy A 57 TRP HZ3 1.0 1.879 4.151 840 810 A 61 TYR HDy A 61 TYR HBy 1.0 1.659 3.039 841 811 A 67 ASN HBx A 67 ASN H 1.0 1.762 3.480 842 812 A 67 ASN HBx A 67 ASN HD2x 1.0 1.853 3.975 843 813 A 67 ASN HBx A 67 ASN HBy 1.0 1.151 1.637 844 814 A 67 ASN HBy A 67 ASN HD2x 1.0 1.843 3.917 845 815 A 33 ASN H A 33 ASN HBx 1.0 1.871 4.101 846 816 A 33 ASN HD2x A 33 ASN HBx 1.0 1.790 3.618 847 817 A 33 ASN HD2y A 33 ASN HBx 1.0 1.872 4.108 848 818 A 44 ASN HD2x A 44 ASN HBx 1.0 1.838 3.884 849 819 A 44 ASN HBx A 44 ASN HA 1.0 1.619 2.887 850 820 A 44 ASN HBx A 44 ASN HBy 1.0 1.252 1.856 851 821 A 44 ASN HD2x A 44 ASN HBy 1.0 1.821 3.785 852 822 A 60 GLU HA A 63 GLU HGy 1.0 1.662 3.050 853 823 A 15 GLU HGx A 15 GLU HBy 1.0 1.580 2.754 854 824 A 18 ILE HD1% A 15 GLU HGx 1.0 1.727 3.319 855 825 A 18 ILE HG1y A 15 GLU HGy 1.0 1.896 4.282 856 826 A 18 ILE HD1% A 15 GLU HGy 1.0 1.684 3.134 857 827 A 63 GLU H A 63 GLU HGy 1.0 1.817 3.759 858 828 A 15 GLU HA A 15 GLU HGy 1.0 1.851 3.963 859 829 A 27 LYS H A 27 LYS HBx 1.0 1.803 3.689 860 830 A 28 ILE H A 27 LYS HBx 1.0 1.846 3.932 861 831 A 27 LYS HGx A 27 LYS HBx 1.0 1.661 3.047 862 832 A 39 VAL HGx% A 27 LYS HBx 1.0 1.732 3.336 863 833 A 27 LYS HA A 27 LYS HBy 1.0 1.727 3.319 864 834 A 27 LYS HBy A 28 ILE H 1.0 1.854 3.988 865 835 A 49 VAL HGx% A 49 VAL HB 1.0 1.584 2.768 866 836 A 49 VAL HGy% A 49 VAL HB 1.0 1.623 2.903 867 837 A 24 LYS H A 24 LYS HBx 1.0 1.817 3.759 868 838 A 39 VAL HA A 39 VAL HB 1.0 1.778 3.558 869 839 A 23 VAL HB A 23 VAL HA 1.0 1.764 3.490 870 840 A 37 GLN HGx A 37 GLN HE2x 1.0 1.802 3.680 871 841 A 37 GLN HGx A 37 GLN HE2y 1.0 1.884 4.190 872 842 A 23 VAL HB A 23 VAL HGx% 1.0 1.534 2.604 873 843 A 59 GLN HGy A 59 GLN HE2x 1.0 1.724 3.302 874 844 A 59 GLN HA A 59 GLN HGy 1.0 1.633 2.939 875 845 A 68 LYS H A 68 LYS HBx 1.0 1.825 3.809 876 846 A 41 ARG HA A 41 ARG HBy 1.0 1.807 3.709 877 847 A 41 ARG HDx A 41 ARG HBx 1.0 1.857 4.001 878 848 A 54 LYS H A 53 PRO HBy 1.0 1.789 3.615 879 849 A 41 ARG HBy A 41 ARG HDx 1.0 1.819 3.771 880 850 A 41 ARG HBy A 25 HIS HBy 1.0 1.845 3.925 881 851 A 41 ARG H A 41 ARG HBx 1.0 1.855 3.989 882 852 A 10 PRO HBx A 29 LEU HG 1.0 1.805 3.697 883 853 A 2 PRO HBy A 2 PRO HA 1.0 1.718 3.278 884 854 A 53 PRO HBx A 53 PRO HA 1.0 1.616 2.880 885 855 A 53 PRO HBx A 53 PRO HDx 1.0 1.820 3.780 886 856 A 62 LEU HDx% A 53 PRO HBx 1.0 1.673 3.091 887 857 A 10 PRO HBy A 29 LEU HG 1.0 1.719 3.285 888 858 A 32 PRO HBy A 32 PRO HBx 1.0 1.410 2.244 889 859 A 53 PRO HBy A 53 PRO HA 1.0 1.593 2.799 890 860 A 53 PRO HDy A 53 PRO HBy 1.0 1.831 3.847 891 861 A 62 LEU HDx% A 53 PRO HBy 1.0 1.707 3.229 892 862 A 58 ILE HG2% A 53 PRO HBy 1.0 1.870 4.086 893 863 A 54 LYS H A 54 LYS HBy 1.0 1.693 3.175 894 864 A 47 ARG HA A 47 ARG HBx 1.0 1.681 3.125 895 865 A 48 GLN H A 47 ARG HBx 1.0 1.859 4.017 896 866 A 15 GLU HGx A 15 GLU HBx 1.0 1.647 2.993 897 867 A 13 PHE HEy A 12 ARG HBy 1.0 1.910 4.396 898 867 A 13 PHE HEx A 12 ARG HBy 1.0 1.910 4.396 899 868 A 12 ARG HBy A 12 ARG HDy 1.0 1.733 3.343 900 869 A 8 ARG HA A 8 ARG HBy 1.0 1.564 2.700 901 870 A 8 ARG HBy A 8 ARG HDy 1.0 1.654 3.016 902 871 A 26 LEU H A 25 HIS HBy 1.0 1.865 4.057 903 872 A 25 HIS HD2 A 25 HIS HBy 1.0 1.883 4.183 904 873 A 41 ARG H A 25 HIS HBy 1.0 1.889 4.225 905 874 A 25 HIS HA A 25 HIS HBy 1.0 1.659 3.035 906 875 A 60 GLU HBy A 60 GLU HBx 1.0 1.274 1.906 907 876 A 61 TYR H A 60 GLU HBx 1.0 1.803 3.687 908 877 A 60 GLU HA A 60 GLU HBx 1.0 1.688 3.152 909 878 A 24 LYS HDy A 24 LYS HGy 1.0 1.716 3.270 910 879 A 63 GLU HBy A 63 GLU HA 1.0 1.624 2.910 911 880 A 20 ARG HBy A 20 ARG HBx 1.0 1.542 2.628 912 881 A 20 ARG HGx A 20 ARG HBx 1.0 1.709 3.237 913 882 A 19 ALA HA A 20 ARG HBx 1.0 1.985 5.327 914 883 A 54 LYS HA A 54 LYS HDy 1.0 1.875 4.123 915 884 A 17 HIS HBx A 17 HIS HBy 1.0 1.370 2.142 916 885 A 28 ILE HG1x A 28 ILE HG1y 1.0 1.473 2.419 917 886 A 60 GLU H A 59 GLN HBy 1.0 1.759 3.463 918 887 A 56 LYS HA A 59 GLN HBy 1.0 1.736 3.354 919 888 A 59 GLN HA A 59 GLN HBy 1.0 1.617 2.881 920 889 A 51 ILE HA A 51 ILE HG1x 1.0 1.857 4.007 921 890 A 57 TRP HD1 A 57 TRP HBx 1.0 1.781 3.571 922 891 A 57 TRP HA A 57 TRP HBx 1.0 1.646 2.988 923 892 A 57 TRP HBy A 57 TRP HBx 1.0 1.501 2.503 924 893 A 18 ILE HG1y A 18 ILE HA 1.0 1.807 3.705 925 894 A 38 ILE H A 38 ILE HG1y 1.0 1.854 3.986 926 895 A 51 ILE H A 51 ILE HG1x 1.0 1.830 3.838 927 896 A 57 TRP HBy A 57 TRP H 1.0 1.790 3.618 928 897 A 32 PRO HDx A 32 PRO HGy 1.0 1.659 3.037 929 898 A 41 ARG H A 41 ARG HGx 1.0 1.853 3.981 930 899 A 8 ARG HGx A 8 ARG HDy 1.0 1.599 2.817 931 900 A 58 ILE HB A 58 ILE HG1y 1.0 1.626 2.916 932 901 A 55 LEU HA A 55 LEU HG 1.0 1.745 3.401 933 902 A 53 PRO HDy A 53 PRO HGy 1.0 1.780 3.564 934 903 A 53 PRO HDx A 53 PRO HGy 1.0 1.731 3.335 935 904 A 54 LYS H A 53 PRO HGy 1.0 1.881 4.171 936 905 A 12 ARG HA A 12 ARG HGy 1.0 1.845 3.929 937 906 A 58 ILE HA A 58 ILE HG1y 1.0 1.880 4.156 938 907 A 20 ARG HGx A 20 ARG HGy 1.0 1.601 2.827 939 908 A 20 ARG HGx A 20 ARG HA 1.0 1.896 4.274 940 909 A 9 CYS HBx A 9 CYS HA 1.0 1.714 3.262 941 910 A 10 PRO HBx A 10 PRO HA 1.0 1.555 2.673 942 911 A 10 PRO HA A 10 PRO HGy 1.0 1.673 3.089 943 912 A 10 PRO HBy A 10 PRO HA 1.0 1.626 2.916 944 913 A 10 PRO HDx A 10 PRO HA 1.0 1.818 3.770 945 914 A 31 THR HA A 32 PRO HDy 1.0 1.569 2.717 946 915 A 2 PRO HBx A 2 PRO HA 1.0 1.855 3.993 947 916 A 12 ARG HA A 12 ARG HGx 1.0 1.728 3.322 948 917 A 12 ARG HDy A 12 ARG HGy 1.0 1.701 3.205 949 918 A 12 ARG HDy A 12 ARG HGx 1.0 1.649 3.001 950 919 A 14 PHE HBy A 52 ASP HBx 1.0 1.837 3.881 951 920 A 15 GLU H A 15 GLU HA 1.0 1.716 3.266 952 921 A 15 GLU HGx A 49 VAL HGx% 1.0 1.805 3.695 953 922 A 18 ILE HD1% A 15 GLU HBy 1.0 1.812 3.732 954 923 A 49 VAL HGx% A 15 GLU HBx 1.0 1.848 3.944 955 924 A 15 GLU HBy A 49 VAL HGx% 1.0 1.835 3.869 956 925 A 55 LEU HDy% A 16 SER HBy 1.0 1.829 3.829 957 926 A 52 ASP HBx A 16 SER HBy 1.0 1.939 4.667 958 927 A 52 ASP HBx A 16 SER HBx 1.0 1.934 4.612 959 928 A 16 SER HA A 16 SER HBy 1.0 1.693 3.175 960 929 A 16 SER HA A 16 SER HBx 1.0 1.724 3.304 961 930 A 16 SER HBy A 16 SER HBx 1.0 1.435 2.311 962 931 A 17 HIS HA A 17 HIS HBx 1.0 1.673 3.091 963 932 A 57 TRP HZ2 A 18 ILE HG2% 1.0 1.743 3.393 964 933 A 18 ILE H A 18 ILE HG2% 1.0 1.846 3.932 965 934 A 28 ILE HA A 28 ILE HG2% 1.0 1.674 3.096 966 935 A 18 ILE HB A 18 ILE HG2% 1.0 1.557 2.677 967 936 A 18 ILE HB A 18 ILE HG1x 1.0 1.721 3.291 968 937 A 18 ILE HB A 18 ILE HG1y 1.0 1.631 2.935 969 938 A 18 ILE HD1% A 18 ILE HG1x 1.0 1.611 2.859 970 939 A 55 LEU HDx% A 18 ILE HB 1.0 1.868 4.078 971 940 A 18 ILE HD1% A 18 ILE HG1y 1.0 1.647 2.993 972 941 A 18 ILE HD1% A 18 ILE HB 1.0 1.702 3.210 973 942 A 18 ILE HD1% A 15 GLU HBx 1.0 1.786 3.596 974 943 A 57 TRP HZ2 A 19 ALA HA 1.0 1.945 4.729 975 944 A 19 ALA HB% A 19 ALA H 1.0 1.602 2.830 976 945 A 21 ALA H A 19 ALA HB% 1.0 1.759 3.465 977 946 A 20 ARG HA A 20 ARG HGy 1.0 1.808 3.712 978 947 A 20 ARG HBx A 20 ARG HGy 1.0 1.852 3.974 979 948 A 22 ASN HA A 21 ALA HB% 1.0 1.951 4.799 980 949 A 22 ASN HA A 21 ALA HA 1.0 1.905 4.355 981 950 A 21 ALA H A 21 ALA HB% 1.0 1.571 2.725 982 951 A 22 ASN H A 21 ALA HB% 1.0 1.747 3.407 983 952 A 42 LEU HA A 23 VAL HA 1.0 1.606 2.844 984 953 A 24 LYS H A 23 VAL HA 1.0 1.686 3.146 985 954 A 24 LYS H A 23 VAL HGx% 1.0 1.915 4.435 986 955 A 23 VAL HGx% A 23 VAL HA 1.0 1.750 3.420 987 956 A 23 VAL HB A 23 VAL HGy% 1.0 1.587 2.777 988 957 A 23 VAL HGy% A 23 VAL HA 1.0 1.697 3.187 989 958 A 42 LEU HA A 23 VAL HGy% 1.0 1.749 3.419 990 959 A 23 VAL H A 23 VAL HGy% 1.0 1.801 3.673 991 960 A 57 TRP HH2 A 23 VAL HGy% 1.0 1.833 3.857 992 961 A 23 VAL HGy% A 25 HIS H 1.0 1.913 4.419 993 962 A 25 HIS H A 24 LYS HA 1.0 1.709 3.241 994 963 A 24 LYS HGy A 24 LYS HA 1.0 1.860 4.024 995 964 A 23 VAL HGx% A 24 LYS HA 1.0 1.846 3.934 996 965 A 24 LYS HGy A 24 LYS HGx 1.0 1.528 2.586 997 966 A 24 LYS HGx A 24 LYS HBx 1.0 1.513 2.537 998 967 A 24 LYS HGx A 24 LYS HEy 1.0 1.844 3.924 999 968 A 42 LEU HA A 24 LYS HGx 1.0 1.969 5.043 1000 969 A 24 LYS HGy A 42 LEU HA 1.0 1.946 4.730 1001 970 A 43 LYS HA A 24 LYS HGx 1.0 1.974 5.116 1002 971 A 24 LYS HDy A 24 LYS HGx 1.0 1.718 3.276 1003 972 A 43 LYS HDy A 43 LYS HEy 1.0 1.600 2.822 1004 973 A 26 LEU H A 26 LEU HA 1.0 1.830 3.842 1005 974 A 26 LEU HDy% A 61 TYR HDy 1.0 1.909 4.383 1006 975 A 26 LEU HDy% A 57 TRP HH2 1.0 1.798 3.658 1007 976 A 26 LEU HDy% A 27 LYS H 1.0 1.994 5.570 1008 977 A 27 LYS H A 26 LEU HG 1.0 1.979 5.191 1009 978 A 26 LEU H A 26 LEU HG 1.0 1.963 4.947 1010 979 A 26 LEU HDy% A 26 LEU HBy 1.0 1.863 4.045 1011 980 A 26 LEU HDy% A 58 ILE HD1% 1.0 1.823 3.797 1012 981 A 27 LYS HA A 27 LYS HBx 1.0 1.640 2.968 1013 982 A 27 LYS HGx A 27 LYS HEy 1.0 1.812 3.734 1014 983 A 28 ILE H A 28 ILE HG1y 1.0 1.838 3.886 1015 984 A 28 ILE HA A 28 ILE HG1y 1.0 1.855 3.995 1016 985 A 28 ILE HD1% A 28 ILE HG1y 1.0 1.524 2.574 1017 986 A 28 ILE HD1% A 28 ILE HG1x 1.0 1.394 2.202 1018 987 A 28 ILE HD1% A 28 ILE HA 1.0 1.813 3.743 1019 988 A 28 ILE HD1% A 62 LEU HA 1.0 1.943 4.705 1020 989 A 28 ILE HD1% A 28 ILE H 1.0 1.859 4.013 1021 990 A 29 LEU HBy A 29 LEU HA 1.0 1.682 3.126 1022 991 A 37 GLN HBy A 29 LEU HBx 1.0 1.887 4.215 1023 992 A 37 GLN HBy A 29 LEU HBy 1.0 1.898 4.296 1024 993 A 29 LEU HG A 29 LEU HA 1.0 1.872 4.106 1025 994 A 31 THR HA A 31 THR HB 1.0 1.792 3.628 1026 995 A 31 THR HB A 32 PRO HDy 1.0 1.751 3.423 1027 996 A 31 THR HA A 31 THR HG2% 1.0 1.659 3.039 1028 997 A 31 THR HB A 31 THR HG2% 1.0 1.627 2.919 1029 998 A 29 LEU HDx% A 31 THR HG2% 1.0 1.723 3.303 1030 999 A 9 CYS HA A 31 THR HG2% 1.0 1.863 4.041 1031 1000 A 34 CYS HBx A 31 THR HG2% 1.0 1.881 4.169 1032 1001 A 34 CYS HBy A 31 THR HG2% 1.0 1.957 4.875 1033 1002 A 32 PRO HGy A 32 PRO HA 1.0 1.719 3.283 1034 1003 A 32 PRO HDx A 32 PRO HA 1.0 1.935 4.625 1035 1004 A 32 PRO HDy A 32 PRO HA 1.0 1.916 4.444 1036 1005 A 33 ASN H A 32 PRO HA 1.0 1.721 3.291 1037 1006 A 29 LEU HDx% A 10 PRO HGy 1.0 1.725 3.307 1038 1007 A 32 PRO HBy A 32 PRO HA 1.0 1.672 3.090 1039 1008 A 32 PRO HBy A 32 PRO HDy 1.0 1.870 4.090 1040 1009 A 31 THR HG2% A 32 PRO HGy 1.0 1.920 4.474 1041 1010 A 33 ASN H A 33 ASN HBy 1.0 1.919 4.469 1042 1011 A 33 ASN HD2x A 33 ASN HBy 1.0 1.898 4.294 1043 1012 A 33 ASN HD2y A 33 ASN HBy 1.0 1.939 4.659 1044 1013 A 34 CYS HBy A 31 THR HB 1.0 1.834 3.860 1045 1014 A 35 ALA HB% A 34 CYS HA 1.0 1.936 4.638 1046 1015 A 35 ALA HA A 35 ALA HB% 1.0 1.544 2.636 1047 1016 A 37 GLN H A 36 LEU HA 1.0 1.524 2.572 1048 1017 A 37 GLN HBx A 37 GLN HA 1.0 1.780 3.566 1049 1018 A 38 ILE HA A 38 ILE HB 1.0 1.938 4.658 1050 1019 A 38 ILE HG2% A 38 ILE H 1.0 1.950 4.786 1051 1020 A 38 ILE HG2% A 51 ILE H 1.0 1.925 4.523 1052 1021 A 38 ILE HG2% A 38 ILE HA 1.0 1.659 3.041 1053 1022 A 38 ILE HG2% A 38 ILE HB 1.0 1.574 2.736 1054 1023 A 38 ILE HG2% A 28 ILE HG1y 1.0 1.829 3.837 1055 1024 A 38 ILE HG2% A 38 ILE HG1y 1.0 1.573 2.731 1056 1025 A 38 ILE HG2% A 58 ILE HD1% 1.0 1.693 3.173 1057 1026 A 38 ILE HG1x A 38 ILE HG1y 1.0 1.473 2.421 1058 1027 A 38 ILE HA A 38 ILE HG1y 1.0 1.938 4.648 1059 1028 A 38 ILE HA A 38 ILE HG1x 1.0 1.930 4.572 1060 1029 A 37 GLN HA A 38 ILE HG1x 1.0 1.938 4.654 1061 1030 A 38 ILE HB A 38 ILE HG1x 1.0 1.794 3.640 1062 1031 A 38 ILE HD1% A 38 ILE HG1y 1.0 1.634 2.942 1063 1032 A 38 ILE HD1% A 38 ILE HG1x 1.0 1.593 2.797 1064 1033 A 38 ILE HD1% A 36 LEU HBy 1.0 1.820 3.780 1065 1034 A 38 ILE HD1% A 58 ILE HD1% 1.0 1.805 3.695 1066 1035 A 38 ILE HD1% A 53 PRO HBx 1.0 1.667 3.067 1067 1036 A 38 ILE HD1% A 38 ILE HA 1.0 1.831 3.843 1068 1037 A 38 ILE HD1% A 38 ILE H 1.0 1.912 4.410 1069 1038 A 49 VAL H A 39 VAL HA 1.0 1.975 5.129 1070 1039 A 40 ALA H A 39 VAL HGy% 1.0 1.760 3.470 1071 1040 A 49 VAL H A 39 VAL HGy% 1.0 1.739 3.373 1072 1041 A 57 TRP HZ2 A 23 VAL HGx% 1.0 1.908 4.372 1073 1042 A 57 TRP HH2 A 23 VAL HGx% 1.0 1.725 3.311 1074 1043 A 50 CYS HA A 39 VAL HGy% 1.0 1.860 4.024 1075 1044 A 39 VAL HA A 39 VAL HGy% 1.0 1.641 2.971 1076 1045 A 39 VAL HGx% A 39 VAL HB 1.0 1.575 2.737 1077 1046 A 27 LYS HBy A 39 VAL HGx% 1.0 1.675 3.103 1078 1047 A 39 VAL HGx% A 27 LYS HGx 1.0 1.624 2.904 1079 1048 A 39 VAL HB A 29 LEU HBy 1.0 1.924 4.516 1080 1049 A 39 VAL HB A 39 VAL HGy% 1.0 1.514 2.542 1081 1050 A 26 LEU HDx% A 40 ALA HA 1.0 1.839 3.893 1082 1051 A 40 ALA HA A 23 VAL HGy% 1.0 1.860 4.024 1083 1052 A 40 ALA HB% A 40 ALA H 1.0 1.667 3.067 1084 1053 A 40 ALA HB% A 49 VAL H 1.0 1.864 4.052 1085 1054 A 40 ALA HB% A 40 ALA HA 1.0 1.550 2.656 1086 1055 A 40 ALA HB% A 26 LEU HA 1.0 1.743 3.387 1087 1056 A 40 ALA HB% A 23 VAL HB 1.0 1.671 3.085 1088 1057 A 40 ALA HB% A 23 VAL HGy% 1.0 1.462 2.388 1089 1058 A 40 ALA HB% A 51 ILE HD1% 1.0 1.552 2.662 1090 1059 A 26 LEU HDx% A 40 ALA HB% 1.0 1.594 2.802 1091 1060 A 41 ARG HA A 41 ARG HBx 1.0 1.740 3.376 1092 1061 A 41 ARG HGy A 41 ARG HA 1.0 1.778 3.554 1093 1062 A 41 ARG HGy A 41 ARG H 1.0 1.898 4.296 1094 1063 A 41 ARG HBy A 41 ARG HBx 1.0 1.500 2.500 1095 1064 A 41 ARG HGy A 41 ARG HDx 1.0 1.636 2.950 1096 1065 A 46 ASN HA A 41 ARG HDx 1.0 1.873 4.107 1097 1066 A 47 ARG H A 42 LEU HBx 1.0 1.878 4.144 1098 1067 A 43 LYS H A 42 LEU HBx 1.0 1.908 4.376 1099 1068 A 55 LEU HDy% A 55 LEU HG 1.0 1.628 2.920 1100 1069 A 55 LEU HDy% A 52 ASP HBy 1.0 1.864 4.048 1101 1070 A 16 SER HA A 55 LEU HDy% 1.0 1.805 3.699 1102 1071 A 57 TRP HD1 A 55 LEU HDy% 1.0 1.850 3.956 1103 1072 A 55 LEU HDy% A 55 LEU H 1.0 1.815 3.751 1104 1073 A 55 LEU HDy% A 57 TRP HE1 1.0 1.858 4.010 1105 1074 A 57 TRP HZ2 A 55 LEU HDx% 1.0 1.927 4.543 1106 1075 A 42 LEU HDx% A 45 ASN HD2y 1.0 1.929 4.565 1107 1076 A 55 LEU HDx% A 16 SER HA 1.0 1.776 3.550 1108 1077 A 53 PRO HA A 53 PRO HGy 1.0 1.878 4.144 1109 1078 A 55 LEU HDy% A 16 SER HBx 1.0 1.912 4.410 1110 1079 A 52 ASP HA A 53 PRO HGy 1.0 1.921 4.489 1111 1080 A 55 LEU HDx% A 52 ASP HBy 1.0 1.800 3.670 1112 1081 A 42 LEU HDy% A 42 LEU HDx% 1.0 1.393 2.201 1113 1082 A 42 LEU HDx% A 42 LEU HBx 1.0 1.615 2.875 1114 1083 A 43 LYS HA A 44 ASN H 1.0 1.927 4.543 1115 1084 A 43 LYS HA A 43 LYS HGx 1.0 1.954 4.826 1116 1085 A 43 LYS HA A 43 LYS HGy 1.0 1.960 4.904 1117 1086 A 43 LYS HEy A 43 LYS HGx 1.0 1.931 4.583 1118 1087 A 43 LYS HEy A 43 LYS HGy 1.0 1.932 4.596 1119 1088 A 43 LYS HBy A 43 LYS HGy 1.0 1.882 4.172 1120 1089 A 43 LYS H A 43 LYS HGy 1.0 1.975 5.131 1121 1090 A 43 LYS H A 43 LYS HGx 1.0 1.989 5.411 1122 1091 A 45 ASN HA A 44 ASN HBx 1.0 1.901 4.319 1123 1092 A 45 ASN HA A 44 ASN HBy 1.0 1.873 4.113 1124 1093 A 47 ARG H A 45 ASN HBy 1.0 1.911 4.405 1125 1094 A 45 ASN HBy A 45 ASN HD2y 1.0 1.897 4.281 1126 1095 A 46 ASN HBy A 46 ASN HD2x 1.0 1.832 3.850 1127 1096 A 46 ASN HA A 46 ASN HBy 1.0 1.684 3.136 1128 1097 A 47 ARG HBx A 42 LEU HDx% 1.0 1.787 3.601 1129 1098 A 47 ARG HBx A 47 ARG HDx 1.0 1.812 3.736 1130 1099 A 41 ARG HGy A 48 GLN HA 1.0 1.862 4.038 1131 1100 A 41 ARG HGx A 48 GLN HGx 1.0 1.905 4.345 1132 1101 A 48 GLN HA A 41 ARG HDx 1.0 1.920 4.478 1133 1102 A 48 GLN HBx A 39 VAL HGy% 1.0 1.862 4.038 1134 1103 A 51 ILE HA A 51 ILE HB 1.0 1.847 3.939 1135 1104 A 51 ILE HB A 58 ILE HD1% 1.0 1.931 4.589 1136 1105 A 51 ILE HB A 51 ILE HG1y 1.0 1.832 3.854 1137 1106 A 38 ILE HB A 51 ILE HB 1.0 1.862 4.032 1138 1107 A 51 ILE HG2% A 51 ILE H 1.0 1.883 4.183 1139 1108 A 51 ILE HG2% A 57 TRP HZ2 1.0 1.874 4.118 1140 1109 A 51 ILE HG2% A 57 TRP HH2 1.0 1.926 4.540 1141 1110 A 51 ILE HG2% A 51 ILE HA 1.0 1.710 3.244 1142 1111 A 51 ILE HG2% A 16 SER HA 1.0 1.895 4.275 1143 1112 A 51 ILE HG2% A 51 ILE HB 1.0 1.576 2.740 1144 1113 A 51 ILE HG2% A 51 ILE HG1x 1.0 1.624 2.906 1145 1114 A 51 ILE HG2% A 55 LEU HDx% 1.0 1.538 2.616 1146 1115 A 51 ILE HG2% A 58 ILE HD1% 1.0 1.654 3.016 1147 1116 A 51 ILE HA A 51 ILE HG1y 1.0 1.881 4.167 1148 1117 A 38 ILE HA A 51 ILE HG1y 1.0 1.911 4.407 1149 1118 A 51 ILE HG1y A 51 ILE HG1x 1.0 1.501 2.501 1150 1119 A 58 ILE HD1% A 51 ILE HD1% 1.0 1.744 3.390 1151 1120 A 51 ILE HG1y A 51 ILE HD1% 1.0 1.581 2.759 1152 1121 A 51 ILE HB A 51 ILE HD1% 1.0 1.614 2.872 1153 1122 A 38 ILE HB A 51 ILE HD1% 1.0 1.820 3.778 1154 1123 A 51 ILE HA A 51 ILE HD1% 1.0 1.861 4.029 1155 1124 A 57 TRP HH2 A 51 ILE HD1% 1.0 1.782 3.578 1156 1125 A 57 TRP HZ2 A 51 ILE HD1% 1.0 1.821 3.783 1157 1126 A 51 ILE H A 51 ILE HD1% 1.0 1.977 5.163 1158 1127 A 52 ASP HA A 52 ASP HBy 1.0 1.819 3.775 1159 1128 A 16 SER HA A 52 ASP HBy 1.0 1.901 4.313 1160 1129 A 38 ILE HD1% A 53 PRO HA 1.0 1.688 3.152 1161 1130 A 58 ILE HG2% A 53 PRO HA 1.0 1.635 2.949 1162 1131 A 58 ILE HB A 53 PRO HA 1.0 1.880 4.160 1163 1132 A 58 ILE HD1% A 53 PRO HA 1.0 1.883 4.185 1164 1133 A 54 LYS H A 53 PRO HA 1.0 1.888 4.220 1165 1134 A 55 LEU H A 53 PRO HA 1.0 1.923 4.505 1166 1135 A 14 PHE HBy A 53 PRO HDx 1.0 1.894 4.262 1167 1136 A 53 PRO HDy A 53 PRO HA 1.0 1.888 4.216 1168 1137 A 53 PRO HDx A 53 PRO HA 1.0 1.914 4.422 1169 1138 A 14 PHE HEx A 53 PRO HDx 1.0 1.976 5.142 1170 1138 A 14 PHE HEy A 53 PRO HDx 1.0 1.976 5.142 1171 1139 A 14 PHE HDx A 53 PRO HDx 1.0 1.960 4.912 1172 1139 A 14 PHE HDy A 53 PRO HDx 1.0 1.960 4.912 1173 1140 A 14 PHE HDx A 53 PRO HDy 1.0 1.962 4.936 1174 1140 A 14 PHE HDy A 53 PRO HDy 1.0 1.962 4.936 1175 1141 A 55 LEU H A 54 LYS HA 1.0 1.849 3.957 1176 1142 A 55 LEU HDx% A 55 LEU HA 1.0 1.968 5.022 1177 1143 A 55 LEU HDy% A 55 LEU HBx 1.0 1.509 2.527 1178 1144 A 55 LEU HBy A 58 ILE HG1y 1.0 1.884 4.190 1179 1145 A 42 LEU HG A 42 LEU HBy 1.0 1.757 3.453 1180 1146 A 57 TRP HD1 A 55 LEU HBx 1.0 1.989 5.427 1181 1147 A 56 LYS HA A 59 GLN HGy 1.0 1.757 3.455 1182 1148 A 56 LYS HDy A 56 LYS HA 1.0 1.773 3.533 1183 1149 A 56 LYS HA A 56 LYS HEx 1.0 1.967 4.995 1184 1150 A 57 TRP HA A 60 GLU HBy 1.0 1.759 3.465 1185 1151 A 58 ILE HA A 58 ILE HB 1.0 1.776 3.546 1186 1152 A 58 ILE HA A 58 ILE HG2% 1.0 1.721 3.293 1187 1153 A 58 ILE HA A 58 ILE HD1% 1.0 1.662 3.050 1188 1154 A 58 ILE HA A 58 ILE HG1x 1.0 1.730 3.330 1189 1155 A 57 TRP HZ3 A 58 ILE HA 1.0 1.871 4.097 1190 1156 A 57 TRP HE3 A 58 ILE HA 1.0 1.953 4.827 1191 1157 A 58 ILE HA A 60 GLU H 1.0 1.971 5.073 1192 1158 A 58 ILE HA A 62 LEU H 1.0 1.962 4.928 1193 1159 A 61 TYR HBy A 58 ILE HA 1.0 1.660 3.040 1194 1160 A 58 ILE HB A 58 ILE HG1x 1.0 1.822 3.790 1195 1161 A 58 ILE H A 58 ILE HG2% 1.0 1.846 3.938 1196 1162 A 58 ILE HG2% A 59 GLN HA 1.0 1.762 3.480 1197 1163 A 58 ILE HG2% A 59 GLN HBy 1.0 1.943 4.705 1198 1164 A 58 ILE HG2% A 59 GLN HGy 1.0 1.945 4.719 1199 1165 A 58 ILE HG2% A 53 PRO HBx 1.0 1.825 3.809 1200 1166 A 62 LEU HBy A 58 ILE HG2% 1.0 1.682 3.126 1201 1167 A 58 ILE HB A 58 ILE HG2% 1.0 1.604 2.836 1202 1168 A 62 LEU HDx% A 58 ILE HG2% 1.0 1.487 2.463 1203 1169 A 58 ILE HG1x A 58 ILE HG2% 1.0 1.689 3.157 1204 1170 A 58 ILE HG2% A 58 ILE HD1% 1.0 1.620 2.892 1205 1171 A 58 ILE HG1x A 58 ILE HG1y 1.0 1.580 2.754 1206 1172 A 58 ILE HD1% A 58 ILE HG1y 1.0 1.688 3.152 1207 1173 A 57 TRP HH2 A 58 ILE HD1% 1.0 1.820 3.782 1208 1174 A 57 TRP HZ3 A 58 ILE HD1% 1.0 1.958 4.880 1209 1175 A 61 TYR HBy A 58 ILE HD1% 1.0 1.833 3.851 1210 1176 A 38 ILE HB A 58 ILE HD1% 1.0 1.867 4.069 1211 1177 A 58 ILE HB A 58 ILE HD1% 1.0 1.732 3.340 1212 1178 A 55 LEU HBx A 58 ILE HG1x 1.0 1.929 4.559 1213 1179 A 58 ILE HB A 55 LEU HBy 1.0 1.793 3.631 1214 1180 A 55 LEU HBx A 58 ILE HB 1.0 1.766 3.498 1215 1181 A 59 GLN HA A 63 GLU H 1.0 1.887 4.215 1216 1182 A 58 ILE H A 59 GLN HBy 1.0 1.973 5.107 1217 1183 A 60 GLU H A 59 GLN HGy 1.0 1.915 4.435 1218 1184 A 64 LYS H A 60 GLU HA 1.0 1.983 5.285 1219 1185 A 57 TRP HA A 60 GLU HGy 1.0 1.861 4.033 1220 1186 A 61 TYR HA A 64 LYS HDy 1.0 1.888 4.218 1221 1187 A 61 TYR HA A 64 LYS HBx 1.0 1.733 3.343 1222 1188 A 61 TYR HA A 64 LYS H 1.0 1.909 4.379 1223 1189 A 61 TYR HBy A 60 GLU H 1.0 1.951 4.793 1224 1190 A 61 TYR HBy A 58 ILE HG2% 1.0 1.930 4.566 1225 1191 A 26 LEU HDy% A 61 TYR HBy 1.0 1.944 4.710 1226 1192 A 66 LEU HDx% A 66 LEU HA 1.0 1.505 2.515 1227 1193 A 42 LEU HG A 42 LEU HDy% 1.0 1.466 2.400 1228 1194 A 66 LEU HBy A 66 LEU HDx% 1.0 1.428 2.292 1229 1195 A 62 LEU HBx A 62 LEU HG 1.0 1.550 2.656 1230 1196 A 62 LEU HBy A 62 LEU HG 1.0 1.719 3.281 1231 1197 A 62 LEU HA A 62 LEU HG 1.0 1.782 3.574 1232 1198 A 64 LYS H A 63 GLU HBx 1.0 1.884 4.192 1233 1199 A 63 GLU H A 63 GLU HBx 1.0 1.727 3.321 1234 1200 A 64 LYS HA A 64 LYS HDy 1.0 1.747 3.405 1235 1201 A 64 LYS HA A 64 LYS HGy 1.0 1.884 4.190 1236 1202 A 64 LYS HGx A 64 LYS HEx 1.0 1.866 4.058 1237 1203 A 65 ALA HB% A 36 LEU HDx% 1.0 1.747 3.407 1238 1204 A 65 ALA HB% A 36 LEU HBy 1.0 1.791 3.625 1239 1205 A 65 ALA HB% A 28 ILE HG1y 1.0 1.736 3.356 1240 1206 A 67 ASN HBx A 64 LYS HA 1.0 1.907 4.365 1241 1207 A 67 ASN HBy A 67 ASN HD2y 1.0 1.840 3.898 1242 1208 A 67 ASN HBx A 67 ASN HD2y 1.0 1.851 3.965 1243 1209 A 68 LYS HBx A 69 GLY HAy 1.0 1.855 3.991 1244 1210 A 14 PHE HEx A 50 CYS HBy 1.0 1.958 4.886 1245 1210 A 14 PHE HEy A 50 CYS HBy 1.0 1.958 4.886 1246 1211 A 49 VAL H A 41 ARG HGx 1.0 1.921 4.481 1247 1212 A 25 HIS HE1 A 41 ARG HBy 1.0 1.971 5.059 1248 1212 A 24 LYS HDy A 25 HIS HE1 1.0 1.971 5.059 1249 1212 A 25 HIS HE1 A 24 LYS HBx 1.0 1.971 5.059 1250 1213 A 61 TYR HDy A 64 LYS HDy 1.0 1.992 5.512 1251 1213 A 61 TYR HDy A 28 ILE HG1y 1.0 1.992 5.512 1252 1214 A 57 TRP HZ3 A 58 ILE HG1y 1.0 1.991 5.475 1253 1214 A 51 ILE HG2% A 57 TRP HZ3 1.0 1.991 5.475 1254 1215 A 62 LEU HDx% A 61 TYR HDx 1.0 1.953 4.825 1255 1215 A 61 TYR HDx A 20 ARG HGx 1.0 1.953 4.825 1256 1215 A 61 TYR HDx A 23 VAL HGx% 1.0 1.953 4.825 1257 1215 A 28 ILE HD1% A 61 TYR HDx 1.0 1.953 4.825 1258 1216 A 52 ASP H A 55 LEU HG 1.0 1.814 3.742 1259 1216 A 52 ASP H A 18 ILE HB 1.0 1.814 3.742 1260 1217 A 40 ALA H A 50 CYS H 1.0 1.869 4.081 1261 1217 A 40 ALA H A 39 VAL H 1.0 1.869 4.081 1262 1218 A 40 ALA H A 39 VAL HGx% 1.0 1.699 3.201 1263 1218 A 40 ALA H A 39 VAL HGy% 1.0 1.699 3.201 1264 1219 A 35 ALA H A 28 ILE HG2% 1.0 1.960 4.904 1265 1219 A 35 ALA H A 36 LEU HDy% 1.0 1.960 4.904 1266 1219 A 35 ALA H A 36 LEU HDx% 1.0 1.960 4.904 1267 1220 A 38 ILE H A 51 ILE HB 1.0 1.772 3.526 1268 1220 A 38 ILE H A 38 ILE HG1y 1.0 1.772 3.526 1269 1221 A 28 ILE HD1% A 38 ILE H 1.0 1.790 3.616 1270 1221 A 38 ILE H A 28 ILE HG2% 1.0 1.790 3.616 1271 1222 A 42 LEU H A 42 LEU HDx% 1.0 1.787 3.601 1272 1222 A 24 LYS HGy A 42 LEU H 1.0 1.787 3.601 1273 1223 A 42 LEU H A 45 ASN HBy 1.0 1.879 4.157 1274 1223 A 42 LEU H A 41 ARG HDx 1.0 1.879 4.157 1275 1224 A 41 ARG H A 27 LYS H 1.0 1.917 4.455 1276 1224 A 27 LYS H A 28 ILE H 1.0 1.917 4.455 1277 1225 A 40 ALA HB% A 27 LYS H 1.0 1.664 3.058 1278 1225 A 27 LYS H A 26 LEU HG 1.0 1.664 3.058 1279 1225 A 27 LYS H A 26 LEU HBx 1.0 1.664 3.058 1280 1226 A 27 LYS H A 51 ILE HD1% 1.0 1.833 3.855 1281 1226 A 38 ILE HG2% A 27 LYS H 1.0 1.833 3.855 1282 1227 A 30 ASN H A 29 LEU H 1.0 1.911 4.403 1283 1227 A 49 VAL H A 48 GLN H 1.0 1.911 4.403 1284 1228 A 20 ARG H A 22 ASN HBx 1.0 1.871 4.093 1285 1228 A 20 ARG H A 20 ARG HDx 1.0 1.871 4.093 1286 1229 A 20 ARG H A 23 VAL HGx% 1.0 1.773 3.535 1287 1229 A 20 ARG HGx A 20 ARG H 1.0 1.773 3.535 1288 1230 A 40 ALA H A 39 VAL H 1.0 1.723 3.299 1289 1230 A 39 VAL H A 27 LYS H 1.0 1.723 3.299 1290 1231 A 58 ILE H A 60 GLU HGy 1.0 1.872 4.102 1291 1231 A 58 ILE H A 59 GLN HGy 1.0 1.872 4.102 1292 1232 A 58 ILE H A 59 GLN H 1.0 1.553 2.665 1293 1232 A 57 TRP H A 58 ILE H 1.0 1.553 2.665 1294 1233 A 57 TRP HBy A 58 ILE H 1.0 1.849 3.951 1295 1233 A 61 TYR HBy A 58 ILE H 1.0 1.849 3.951 1296 1234 A 55 LEU HDx% A 58 ILE H 1.0 1.713 3.259 1297 1234 A 58 ILE H A 55 LEU HBy 1.0 1.713 3.259 1298 1235 A 34 CYS HBx A 37 GLN H 1.0 1.949 4.773 1299 1235 A 28 ILE H A 27 LYS HEy 1.0 1.949 4.773 1300 1236 A 27 LYS H A 28 ILE H 1.0 1.844 3.922 1301 1236 A 37 GLN H A 29 LEU H 1.0 1.844 3.922 1302 1237 A 28 ILE HA A 28 ILE H 1.0 1.512 2.538 1303 1237 A 27 LYS HA A 28 ILE H 1.0 1.512 2.538 1304 1238 A 51 ILE H A 39 VAL HGy% 1.0 1.847 3.937 1305 1238 A 51 ILE H A 49 VAL HGx% 1.0 1.847 3.937 1306 1238 A 51 ILE H A 18 ILE HG2% 1.0 1.847 3.937 1307 1239 A 51 ILE H A 50 CYS H 1.0 1.924 4.516 1308 1239 A 39 VAL H A 51 ILE H 1.0 1.924 4.516 1309 1240 A 38 ILE HG2% A 51 ILE H 1.0 1.726 3.310 1310 1240 A 51 ILE H A 51 ILE HD1% 1.0 1.726 3.310 1311 1240 A 51 ILE HG2% A 51 ILE H 1.0 1.726 3.310 1312 1241 A 24 LYS H A 41 ARG HBy 1.0 1.717 3.271 1313 1241 A 24 LYS H A 24 LYS HBx 1.0 1.717 3.271 1314 1242 A 52 ASP HA A 15 GLU H 1.0 1.847 3.943 1315 1242 A 50 CYS HBy A 15 GLU H 1.0 1.847 3.943 1316 1243 A 36 LEU H A 36 LEU HA 1.0 1.490 2.470 1317 1243 A 35 ALA HA A 36 LEU H 1.0 1.490 2.470 1318 1244 A 65 ALA H A 65 ALA HA 1.0 1.580 2.752 1319 1244 A 65 ALA H A 64 LYS HA 1.0 1.580 2.752 1320 1245 A 61 TYR H A 62 LEU HG 1.0 1.874 4.116 1321 1245 A 61 TYR H A 62 LEU HDx% 1.0 1.874 4.116 1322 1246 A 47 ARG H A 47 ARG HDy 1.0 1.806 3.698 1323 1246 A 47 ARG H A 46 ASN HBx 1.0 1.806 3.698 1324 1247 A 62 LEU H A 62 LEU HA 1.0 1.684 3.134 1325 1247 A 59 GLN HA A 62 LEU H 1.0 1.684 3.134 1326 1248 A 31 THR H A 29 LEU HDx% 1.0 1.859 4.015 1327 1248 A 31 THR H A 28 ILE HG2% 1.0 1.859 4.015 1328 1249 A 55 LEU HDy% A 16 SER H 1.0 1.961 4.923 1329 1249 A 55 LEU HDx% A 16 SER H 1.0 1.961 4.923 1330 1250 A 63 GLU H A 62 LEU HA 1.0 1.719 3.283 1331 1250 A 59 GLN HA A 63 GLU H 1.0 1.719 3.283 1332 1251 A 61 TYR H A 60 GLU H 1.0 1.591 2.793 1333 1251 A 60 GLU H A 59 GLN H 1.0 1.591 2.793 1334 1252 A 60 GLU H A 60 GLU HBx 1.0 1.508 2.526 1335 1252 A 60 GLU H A 59 GLN HBy 1.0 1.508 2.526 1336 1253 A 60 GLU H A 62 LEU HG 1.0 1.941 4.693 1337 1253 A 62 LEU HDx% A 60 GLU H 1.0 1.941 4.693 1338 1254 A 67 ASN H A 66 LEU HG 1.0 1.817 3.763 1339 1254 A 67 ASN H A 66 LEU HDx% 1.0 1.817 3.763 1340 1255 A 64 LYS HBx A 66 LEU H 1.0 1.905 4.345 1341 1255 A 62 LEU HBy A 66 LEU H 1.0 1.905 4.345 1342 1256 A 20 ARG H A 21 ALA H 1.0 1.639 2.961 1343 1256 A 21 ALA H A 22 ASN H 1.0 1.639 2.961 1344 1257 A 21 ALA H A 22 ASN HBx 1.0 1.873 4.113 1345 1257 A 21 ALA H A 20 ARG HDx 1.0 1.873 4.113 1346 1258 A 21 ALA H A 21 ALA HB% 1.0 1.512 2.538 1347 1258 A 21 ALA H A 19 ALA HB% 1.0 1.512 2.538 1348 1259 A 21 ALA H A 23 VAL HGx% 1.0 1.807 3.705 1349 1259 A 20 ARG HGx A 21 ALA H 1.0 1.807 3.705 1350 1260 A 40 ALA HB% A 23 VAL H 1.0 1.796 3.644 1351 1260 A 23 VAL H A 21 ALA HB% 1.0 1.796 3.644 1352 1260 A 19 ALA HB% A 23 VAL H 1.0 1.796 3.644 1353 1261 A 46 ASN H A 46 ASN HBy 1.0 1.798 3.658 1354 1261 A 45 ASN HBx A 46 ASN H 1.0 1.798 3.658 1355 1262 A 5 LEU HDy% A 6 SER H 1.0 1.973 5.103 1356 1262 A 6 SER H A 5 LEU HDx% 1.0 1.973 5.103 1357 1263 A 6 SER H A 6 SER HA 1.0 1.677 3.107 1358 1263 A 5 LEU HA A 6 SER H 1.0 1.677 3.107 1359 1264 A 54 LYS H A 54 LYS HBy 1.0 1.510 2.530 1360 1264 A 54 LYS H A 53 PRO HGy 1.0 1.510 2.530 1361 1265 A 55 LEU HDx% A 54 LYS H 1.0 1.810 3.724 1362 1265 A 55 LEU HBy A 54 LYS H 1.0 1.810 3.724 1363 1266 A 57 TRP H A 55 LEU HDy% 1.0 1.755 3.449 1364 1266 A 57 TRP H A 55 LEU HBy 1.0 1.755 3.449 1365 1267 A 33 ASN HD2x A 33 ASN HBx 1.0 1.768 3.508 1366 1267 A 33 ASN HD2x A 33 ASN HBy 1.0 1.768 3.508 1367 1268 A 59 GLN HE2y A 62 LEU HG 1.0 1.910 4.394 1368 1268 A 62 LEU HDx% A 59 GLN HE2y 1.0 1.910 4.394 1369 1269 A 40 ALA HB% A 15 GLU H 1.0 1.984 5.310 1370 1269 A 15 GLU H A 51 ILE HG1x 1.0 1.984 5.310 1371 1270 A 51 ILE HB A 15 GLU H 1.0 1.980 5.228 1372 1270 A 15 GLU H A 18 ILE HG1y 1.0 1.980 5.228 1373 1271 A 49 VAL HGx% A 16 SER H 1.0 1.998 5.792 1374 1271 A 16 SER H A 18 ILE HG2% 1.0 1.998 5.792 1375 1272 A 52 ASP HA A 18 ILE H 1.0 1.996 6.360 1376 1272 A 18 ILE H A 16 SER HBx 1.0 1.996 6.360 1377 1273 A 19 ALA H A 22 ASN HD2y 1.0 1.867 4.067 1378 1273 A 19 ALA H A 22 ASN H 1.0 1.867 4.067 1379 1273 A 20 ARG H A 19 ALA H 1.0 1.867 4.067 1380 1274 A 18 ILE H A 19 ALA H 1.0 1.924 4.516 1381 1274 A 19 ALA H A 22 ASN HD2x 1.0 1.924 4.516 1382 1275 A 55 LEU HDy% A 19 ALA H 1.0 1.969 5.033 1383 1275 A 42 LEU HDx% A 19 ALA H 1.0 1.969 5.033 1384 1275 A 55 LEU HDx% A 19 ALA H 1.0 1.969 5.033 1385 1276 A 19 ALA H A 51 ILE HD1% 1.0 1.979 5.205 1386 1276 A 51 ILE HG2% A 19 ALA H 1.0 1.979 5.205 1387 1277 A 22 ASN H A 21 ALA HB% 1.0 1.693 3.173 1388 1277 A 19 ALA HB% A 22 ASN H 1.0 1.693 3.173 1389 1278 A 42 LEU HDy% A 22 ASN HD2x 1.0 1.964 4.964 1390 1278 A 18 ILE HG2% A 22 ASN HD2x 1.0 1.964 4.964 1391 1279 A 42 LEU HDy% A 22 ASN HD2y 1.0 1.953 4.821 1392 1279 A 18 ILE HG2% A 22 ASN HD2y 1.0 1.953 4.821 1393 1280 A 43 LYS HDy A 22 ASN HD2y 1.0 1.999 5.919 1394 1280 A 42 LEU HBx A 22 ASN HD2y 1.0 1.999 5.919 1395 1281 A 26 LEU HDx% A 26 LEU H 1.0 1.951 4.795 1396 1281 A 26 LEU HDy% A 26 LEU H 1.0 1.951 4.795 1397 1282 A 37 GLN H A 29 LEU H 1.0 1.879 4.157 1398 1282 A 28 ILE H A 29 LEU H 1.0 1.879 4.157 1399 1283 A 31 THR HG2% A 29 LEU H 1.0 1.980 5.204 1400 1283 A 27 LYS HGx A 29 LEU H 1.0 1.980 5.204 1401 1284 A 29 LEU H A 38 ILE HG1x 1.0 1.942 4.696 1402 1284 A 28 ILE HG1x A 29 LEU H 1.0 1.942 4.696 1403 1285 A 29 LEU HDx% A 30 ASN HD2x 1.0 1.922 4.496 1404 1285 A 30 ASN HD2x A 36 LEU HDx% 1.0 1.922 4.496 1405 1285 A 28 ILE HG2% A 30 ASN HD2x 1.0 1.922 4.496 1406 1286 A 31 THR H A 37 GLN HE2x 1.0 1.990 5.454 1407 1286 A 31 THR H A 33 ASN HD2x 1.0 1.990 5.454 1408 1287 A 33 ASN H A 33 ASN HBx 1.0 1.872 4.104 1409 1287 A 33 ASN H A 33 ASN HBy 1.0 1.872 4.104 1410 1288 A 33 ASN HD2y A 33 ASN HBx 1.0 1.895 4.271 1411 1288 A 33 ASN HD2y A 33 ASN HBy 1.0 1.895 4.271 1412 1289 A 36 LEU HDy% A 34 CYS H 1.0 1.992 5.516 1413 1289 A 34 CYS H A 36 LEU HDx% 1.0 1.992 5.516 1414 1290 A 34 CYS H A 32 PRO HDy 1.0 1.985 5.317 1415 1290 A 34 CYS H A 10 PRO HDx 1.0 1.985 5.317 1416 1291 A 34 CYS HBx A 37 GLN HE2y 1.0 1.974 5.126 1417 1291 A 37 GLN HE2y A 11 CYS HBx 1.0 1.974 5.126 1418 1292 A 37 GLN HE2y A 10 PRO HGy 1.0 1.974 5.108 1419 1292 A 37 GLN HBy A 37 GLN HE2y 1.0 1.974 5.108 1420 1293 A 36 LEU HDy% A 37 GLN HE2y 1.0 1.997 5.677 1421 1293 A 37 GLN HE2y A 39 VAL HGy% 1.0 1.997 5.677 1422 1293 A 37 GLN HE2y A 28 ILE HG2% 1.0 1.997 5.677 1423 1293 A 37 GLN HE2y A 36 LEU HDx% 1.0 1.997 5.677 1424 1293 A 37 GLN HE2y A 29 LEU HG 1.0 1.997 5.677 1425 1294 A 34 CYS HBx A 37 GLN HE2x 1.0 1.978 5.192 1426 1294 A 11 CYS HBx A 37 GLN HE2x 1.0 1.978 5.192 1427 1295 A 37 GLN HBy A 37 GLN HE2x 1.0 1.972 5.080 1428 1295 A 37 GLN HE2x A 10 PRO HGy 1.0 1.972 5.080 1429 1296 A 37 GLN HE2x A 39 VAL HGy% 1.0 1.993 5.527 1430 1296 A 37 GLN HE2x A 36 LEU HDx% 1.0 1.993 5.527 1431 1296 A 37 GLN HE2x A 29 LEU HG 1.0 1.993 5.527 1432 1296 A 37 GLN HE2x A 28 ILE HG2% 1.0 1.993 5.527 1433 1296 A 36 LEU HDy% A 37 GLN HE2x 1.0 1.993 5.527 1434 1297 A 34 CYS HA A 37 GLN HE2y 1.0 1.998 6.284 1435 1297 A 9 CYS HA A 37 GLN HE2y 1.0 1.998 6.284 1436 1298 A 37 GLN H A 37 GLN HE2x 1.0 1.981 6.801 1437 1298 A 35 ALA H A 37 GLN HE2x 1.0 1.981 6.801 1438 1299 A 37 GLN H A 37 GLN HE2y 1.0 1.988 6.642 1439 1299 A 35 ALA H A 37 GLN HE2y 1.0 1.988 6.642 1440 1300 A 38 ILE HG2% A 38 ILE H 1.0 1.878 4.148 1441 1300 A 38 ILE H A 51 ILE HD1% 1.0 1.878 4.148 1442 1301 A 40 ALA HB% A 39 VAL H 1.0 1.924 4.516 1443 1301 A 39 VAL H A 27 LYS HGx 1.0 1.924 4.516 1444 1301 A 39 VAL H A 26 LEU HG 1.0 1.924 4.516 1445 1302 A 39 VAL H A 28 ILE HG1y 1.0 1.934 4.608 1446 1302 A 39 VAL H A 27 LYS HBy 1.0 1.934 4.608 1447 1303 A 40 ALA H A 38 ILE HA 1.0 1.966 4.990 1448 1303 A 40 ALA H A 26 LEU HA 1.0 1.966 4.990 1449 1304 A 41 ARG H A 51 ILE HG1y 1.0 1.962 4.944 1450 1304 A 24 LYS HGy A 41 ARG H 1.0 1.962 4.944 1451 1305 A 47 ARG HBx A 45 ASN HD2y 1.0 1.960 4.914 1452 1305 A 42 LEU HBx A 45 ASN HD2y 1.0 1.960 4.914 1453 1306 A 41 ARG HBy A 46 ASN H 1.0 1.973 5.101 1454 1306 A 24 LYS HDy A 46 ASN H 1.0 1.973 5.101 1455 1306 A 46 ASN H A 24 LYS HBx 1.0 1.973 5.101 1456 1307 A 42 LEU HDx% A 46 ASN H 1.0 1.984 6.732 1457 1307 A 24 LYS HGy A 46 ASN H 1.0 1.984 6.732 1458 1308 A 47 ARG H A 48 GLN HA 1.0 1.987 5.363 1459 1308 A 41 ARG HA A 47 ARG H 1.0 1.987 5.363 1460 1309 A 48 GLN H A 47 ARG HDy 1.0 1.981 5.237 1461 1309 A 48 GLN H A 46 ASN HBx 1.0 1.981 5.237 1462 1310 A 48 GLN HE2y A 48 GLN HGx 1.0 1.961 4.911 1463 1310 A 48 GLN HGy A 48 GLN HE2y 1.0 1.961 4.911 1464 1311 A 49 VAL H A 49 VAL HGx% 1.0 1.786 3.594 1465 1311 A 49 VAL H A 39 VAL HGy% 1.0 1.786 3.594 1466 1312 A 57 TRP H A 55 LEU H 1.0 1.986 5.334 1467 1312 A 59 GLN H A 55 LEU H 1.0 1.986 5.334 1468 1313 A 57 TRP HD1 A 55 LEU H 1.0 1.996 5.670 1469 1313 A 52 ASP H A 55 LEU H 1.0 1.996 5.670 1470 1314 A 57 TRP H A 56 LYS HDy 1.0 1.977 5.155 1471 1314 A 57 TRP H A 55 LEU HG 1.0 1.977 5.155 1472 1315 A 57 TRP HE3 A 57 TRP HE1 1.0 1.962 4.940 1473 1315 A 57 TRP HH2 A 57 TRP HE1 1.0 1.962 4.940 1474 1316 A 19 ALA HB% A 57 TRP HE1 1.0 1.918 4.458 1475 1316 A 57 TRP HE1 A 18 ILE HG1x 1.0 1.918 4.458 1476 1317 A 57 TRP HE1 A 23 VAL HGx% 1.0 1.815 3.753 1477 1317 A 57 TRP HE1 A 18 ILE HG2% 1.0 1.815 3.753 1478 1318 A 61 TYR H A 58 ILE H 1.0 1.775 3.543 1479 1318 A 57 TRP HD1 A 58 ILE H 1.0 1.775 3.543 1480 1319 A 58 ILE H A 55 LEU HG 1.0 1.963 4.949 1481 1319 A 56 LYS HDy A 58 ILE H 1.0 1.963 4.949 1482 1320 A 55 LEU HDx% A 59 GLN H 1.0 1.946 4.740 1483 1320 A 59 GLN H A 55 LEU HBy 1.0 1.946 4.740 1484 1321 A 59 GLN HE2y A 54 LYS HBx 1.0 1.983 5.275 1485 1321 A 59 GLN HE2y A 53 PRO HBy 1.0 1.983 5.275 1486 1322 A 62 LEU HBx A 59 GLN HE2x 1.0 2.000 5.880 1487 1322 A 58 ILE HB A 59 GLN HE2x 1.0 2.000 5.880 1488 1323 A 59 GLN HE2x A 54 LYS HBx 1.0 1.970 5.044 1489 1323 A 59 GLN HE2x A 54 LYS HBy 1.0 1.970 5.044 1490 1323 A 59 GLN HE2x A 53 PRO HBy 1.0 1.970 5.044 1491 1324 A 60 GLU HA A 63 GLU HGy 1.0 1.489 2.469 1492 1324 A 60 GLU HA A 60 GLU HBx 1.0 1.489 2.469 1493 1325 A 63 GLU HBy A 63 GLU HA 1.0 1.489 2.469 1494 1325 A 63 GLU HA A 63 GLU HBx 1.0 1.489 2.469 1495 1326 A 63 GLU HA A 66 LEU HDx% 1.0 1.808 3.712 1496 1326 A 63 GLU HA A 66 LEU HG 1.0 1.808 3.712 1497 1327 A 43 LYS HA A 43 LYS HGy 1.0 1.586 2.774 1498 1327 A 43 LYS HA A 43 LYS HGx 1.0 1.586 2.774 1499 1328 A 20 ARG HA A 22 ASN H 1.0 1.695 3.181 1500 1328 A 20 ARG H A 20 ARG HA 1.0 1.695 3.181 1501 1329 A 5 LEU H A 4 SER HA 1.0 1.702 3.212 1502 1329 A 4 SER HA A 4 SER H 1.0 1.702 3.212 1503 1330 A 66 LEU H A 62 LEU HA 1.0 1.725 3.311 1504 1330 A 63 GLU H A 62 LEU HA 1.0 1.725 3.311 1505 1331 A 62 LEU HA A 62 LEU HG 1.0 1.452 2.362 1506 1331 A 62 LEU HDx% A 62 LEU HA 1.0 1.452 2.362 1507 1332 A 47 ARG HA A 47 ARG HGx 1.0 1.502 2.504 1508 1332 A 36 LEU HA A 36 LEU HBy 1.0 1.502 2.504 1509 1333 A 48 GLN HA A 47 ARG HA 1.0 1.845 3.933 1510 1333 A 41 ARG HA A 47 ARG HA 1.0 1.845 3.933 1511 1334 A 47 ARG H A 47 ARG HA 1.0 1.607 2.847 1512 1334 A 36 LEU H A 36 LEU HA 1.0 1.607 2.847 1513 1335 A 36 LEU HDy% A 36 LEU HA 1.0 1.556 2.676 1514 1335 A 36 LEU HA A 36 LEU HDx% 1.0 1.556 2.676 1515 1336 A 54 LYS HA A 54 LYS HBx 1.0 1.472 2.418 1516 1336 A 54 LYS HA A 54 LYS HBy 1.0 1.472 2.418 1517 1337 A 50 CYS HA A 49 VAL HGx% 1.0 1.725 3.307 1518 1337 A 50 CYS HA A 39 VAL HGy% 1.0 1.725 3.307 1519 1338 A 51 ILE HG2% A 50 CYS HA 1.0 1.875 4.119 1520 1338 A 38 ILE HG2% A 50 CYS HA 1.0 1.875 4.119 1521 1338 A 50 CYS HA A 51 ILE HD1% 1.0 1.875 4.119 1522 1339 A 48 GLN HA A 48 GLN HGx 1.0 1.690 3.160 1523 1339 A 48 GLN HGy A 48 GLN HA 1.0 1.690 3.160 1524 1340 A 66 LEU HA A 66 LEU HG 1.0 1.442 2.332 1525 1340 A 66 LEU HDx% A 66 LEU HA 1.0 1.442 2.332 1526 1341 A 40 ALA HB% A 26 LEU HA 1.0 1.589 2.785 1527 1341 A 26 LEU HA A 26 LEU HBx 1.0 1.589 2.785 1528 1342 A 27 LYS HA A 27 LYS HDy 1.0 1.559 2.687 1529 1342 A 27 LYS HA A 27 LYS HBy 1.0 1.559 2.687 1530 1343 A 27 LYS HA A 27 LYS HGx 1.0 1.648 2.996 1531 1343 A 27 LYS HA A 26 LEU HG 1.0 1.648 2.996 1532 1344 A 29 LEU HG A 29 LEU HA 1.0 1.554 2.668 1533 1344 A 29 LEU HDx% A 29 LEU HA 1.0 1.554 2.668 1534 1345 A 41 ARG HA A 48 GLN HGx 1.0 1.819 3.773 1535 1345 A 48 GLN HGy A 41 ARG HA 1.0 1.819 3.773 1536 1345 A 41 ARG HA A 42 LEU HBy 1.0 1.819 3.773 1537 1346 A 9 CYS HA A 32 PRO HGx 1.0 1.797 3.659 1538 1346 A 9 CYS HA A 10 PRO HGy 1.0 1.797 3.659 1539 1347 A 29 LEU HDx% A 30 ASN HA 1.0 1.737 3.361 1540 1347 A 30 ASN HA A 28 ILE HG2% 1.0 1.737 3.361 1541 1348 A 2 PRO HDy A 2 PRO HGx 1.0 1.423 2.279 1542 1348 A 32 PRO HGx A 32 PRO HDy 1.0 1.423 2.279 1543 1348 A 10 PRO HDx A 10 PRO HGy 1.0 1.423 2.279 1544 1349 A 32 PRO HBx A 32 PRO HDy 1.0 1.653 3.013 1545 1349 A 10 PRO HDx A 10 PRO HBx 1.0 1.653 3.013 1546 1349 A 2 PRO HBy A 2 PRO HDy 1.0 1.653 3.013 1547 1350 A 29 LEU HDx% A 32 PRO HDy 1.0 1.801 3.677 1548 1350 A 29 LEU HDx% A 10 PRO HDx 1.0 1.801 3.677 1549 1351 A 2 PRO HGx A 2 PRO HDx 1.0 1.574 2.732 1550 1351 A 32 PRO HDx A 32 PRO HGy 1.0 1.574 2.732 1551 1351 A 32 PRO HDx A 32 PRO HGx 1.0 1.574 2.732 1552 1352 A 32 PRO HDx A 32 PRO HDy 1.0 1.252 1.856 1553 1352 A 2 PRO HDy A 2 PRO HDx 1.0 1.252 1.856 1554 1353 A 27 LYS H A 40 ALA HA 1.0 1.700 3.200 1555 1353 A 40 ALA H A 40 ALA HA 1.0 1.700 3.200 1556 1354 A 14 PHE HBy A 50 CYS HBy 1.0 1.781 3.571 1557 1354 A 50 CYS HBy A 11 CYS HBy 1.0 1.781 3.571 1558 1355 A 50 CYS HBx A 14 PHE HBy 1.0 1.727 3.317 1559 1355 A 50 CYS HBx A 11 CYS HBy 1.0 1.727 3.317 1560 1356 A 26 LEU HDx% A 26 LEU HBx 1.0 1.700 3.204 1561 1356 A 26 LEU HDy% A 26 LEU HBx 1.0 1.700 3.204 1562 1357 A 26 LEU HDx% A 26 LEU HBy 1.0 1.717 3.271 1563 1357 A 26 LEU HDy% A 26 LEU HBy 1.0 1.717 3.271 1564 1358 A 57 TRP HZ3 A 20 ARG HDy 1.0 1.878 4.148 1565 1358 A 57 TRP HZ3 A 20 ARG HDx 1.0 1.878 4.148 1566 1359 A 57 TRP HE3 A 20 ARG HDx 1.0 1.852 3.974 1567 1359 A 57 TRP HE3 A 20 ARG HDy 1.0 1.852 3.974 1568 1360 A 20 ARG HGx A 20 ARG HDy 1.0 1.629 2.925 1569 1360 A 20 ARG HGx A 20 ARG HDx 1.0 1.629 2.925 1570 1361 A 20 ARG HBx A 20 ARG HDy 1.0 1.734 3.348 1571 1361 A 20 ARG HBx A 20 ARG HDx 1.0 1.734 3.348 1572 1362 A 20 ARG HGy A 20 ARG HDy 1.0 1.643 2.975 1573 1362 A 20 ARG HDx A 20 ARG HGy 1.0 1.643 2.975 1574 1363 A 29 LEU HBx A 29 LEU HG 1.0 1.562 2.694 1575 1363 A 29 LEU HDx% A 29 LEU HBx 1.0 1.562 2.694 1576 1364 A 48 GLN HA A 41 ARG HDx 1.0 1.680 3.122 1577 1364 A 41 ARG HA A 41 ARG HDx 1.0 1.680 3.122 1578 1365 A 55 LEU HDx% A 52 ASP HBy 1.0 1.775 3.543 1579 1365 A 55 LEU HDy% A 52 ASP HBy 1.0 1.775 3.543 1580 1366 A 52 ASP HBx A 55 LEU HDy% 1.0 1.815 3.749 1581 1366 A 55 LEU HDx% A 52 ASP HBx 1.0 1.815 3.749 1582 1367 A 43 LYS HEy A 43 LYS HGx 1.0 1.529 2.591 1583 1367 A 24 LYS HGx A 24 LYS HEy 1.0 1.529 2.591 1584 1368 A 36 LEU H A 36 LEU HBy 1.0 1.673 3.091 1585 1368 A 5 LEU HBy A 7 TYR H 1.0 1.673 3.091 1586 1369 A 62 LEU HBy A 62 LEU HDx% 1.0 1.537 2.613 1587 1369 A 62 LEU HBy A 62 LEU HG 1.0 1.537 2.613 1588 1370 A 66 LEU HBy A 66 LEU HG 1.0 1.529 2.587 1589 1370 A 66 LEU HBy A 66 LEU HDx% 1.0 1.529 2.587 1590 1371 A 62 LEU HBx A 62 LEU HA 1.0 1.666 3.066 1591 1371 A 59 GLN HA A 62 LEU HBx 1.0 1.666 3.066 1592 1372 A 62 LEU HBx A 66 LEU HDx% 1.0 1.462 2.390 1593 1372 A 62 LEU HBx A 62 LEU HG 1.0 1.462 2.390 1594 1373 A 55 LEU HBx A 55 LEU HBy 1.0 1.458 2.378 1595 1373 A 55 LEU HDy% A 55 LEU HBx 1.0 1.458 2.378 1596 1374 A 57 TRP HD1 A 55 LEU HBy 1.0 1.900 4.306 1597 1374 A 52 ASP H A 55 LEU HBy 1.0 1.900 4.306 1598 1375 A 22 ASN HA A 22 ASN HBx 1.0 1.609 2.853 1599 1375 A 11 CYS HA A 11 CYS HBy 1.0 1.609 2.853 1600 1376 A 23 VAL HGx% A 22 ASN HBx 1.0 1.695 3.179 1601 1376 A 42 LEU HDy% A 22 ASN HBx 1.0 1.695 3.179 1602 1376 A 22 ASN HBx A 18 ILE HG2% 1.0 1.695 3.179 1603 1377 A 51 ILE HB A 51 ILE HD1% 1.0 1.596 2.810 1604 1377 A 51 ILE HG2% A 51 ILE HB 1.0 1.596 2.810 1605 1378 A 45 ASN HBx A 45 ASN HD2x 1.0 1.740 3.376 1606 1378 A 45 ASN HBx A 45 ASN H 1.0 1.740 3.376 1607 1379 A 28 ILE HD1% A 61 TYR HBy 1.0 1.833 3.857 1608 1379 A 62 LEU HDx% A 61 TYR HBy 1.0 1.833 3.857 1609 1380 A 67 ASN HBx A 68 LYS HDy 1.0 1.861 4.029 1610 1380 A 7 TYR HBy A 8 ARG HBx 1.0 1.861 4.029 1611 1381 A 15 GLU HGx A 50 CYS H 1.0 1.886 4.202 1612 1381 A 15 GLU HGx A 16 SER H 1.0 1.886 4.202 1613 1382 A 48 GLN H A 48 GLN HGx 1.0 1.838 3.886 1614 1382 A 48 GLN HGy A 48 GLN H 1.0 1.838 3.886 1615 1383 A 48 GLN HE2x A 48 GLN HGx 1.0 1.803 3.687 1616 1383 A 48 GLN HGy A 48 GLN HE2x 1.0 1.803 3.687 1617 1384 A 48 GLN HBy A 48 GLN HGx 1.0 1.507 2.521 1618 1384 A 48 GLN HGy A 48 GLN HBy 1.0 1.507 2.521 1619 1385 A 49 VAL H A 48 GLN HGx 1.0 1.795 3.645 1620 1385 A 49 VAL H A 48 GLN HGy 1.0 1.795 3.645 1621 1386 A 40 ALA HB% A 39 VAL HB 1.0 1.860 4.024 1622 1386 A 39 VAL HB A 27 LYS HGx 1.0 1.860 4.024 1623 1387 A 39 VAL HGx% A 39 VAL HB 1.0 1.540 2.622 1624 1387 A 39 VAL HB A 39 VAL HGy% 1.0 1.540 2.622 1625 1388 A 56 LYS HA A 59 GLN HGy 1.0 1.687 3.147 1626 1388 A 59 GLN HGy A 54 LYS HA 1.0 1.687 3.147 1627 1389 A 62 LEU HDx% A 59 GLN HGy 1.0 1.784 3.590 1628 1389 A 37 GLN HGx A 36 LEU HDy% 1.0 1.784 3.590 1629 1389 A 37 GLN HGx A 29 LEU HG 1.0 1.784 3.590 1630 1389 A 37 GLN HGx A 28 ILE HG2% 1.0 1.784 3.590 1631 1389 A 29 LEU HDx% A 37 GLN HGx 1.0 1.784 3.590 1632 1390 A 43 LYS HBy A 43 LYS HGy 1.0 1.682 3.130 1633 1390 A 43 LYS HBy A 43 LYS HGx 1.0 1.682 3.130 1634 1391 A 11 CYS H A 10 PRO HBy 1.0 1.846 3.934 1635 1391 A 3 VAL H A 2 PRO HBx 1.0 1.846 3.934 1636 1392 A 68 LYS HBx A 68 LYS HA 1.0 1.562 2.692 1637 1392 A 10 PRO HBy A 10 PRO HA 1.0 1.562 2.692 1638 1393 A 11 CYS H A 10 PRO HBx 1.0 1.916 4.442 1639 1393 A 3 VAL H A 2 PRO HBy 1.0 1.916 4.442 1640 1394 A 10 PRO HBx A 10 PRO HA 1.0 1.506 2.520 1641 1394 A 32 PRO HBx A 32 PRO HA 1.0 1.506 2.520 1642 1395 A 32 PRO HBx A 32 PRO HGx 1.0 1.294 1.952 1643 1395 A 10 PRO HBx A 10 PRO HGy 1.0 1.294 1.952 1644 1395 A 2 PRO HBy A 2 PRO HGx 1.0 1.294 1.952 1645 1396 A 10 PRO HBx A 10 PRO HBy 1.0 1.232 1.812 1646 1396 A 2 PRO HBy A 2 PRO HBx 1.0 1.232 1.812 1647 1397 A 56 LYS HGx A 56 LYS HBy 1.0 1.531 2.593 1648 1397 A 56 LYS HBy A 56 LYS HGy 1.0 1.531 2.593 1649 1398 A 54 LYS HGx A 54 LYS HBx 1.0 1.553 2.667 1650 1398 A 54 LYS HGx A 54 LYS HBy 1.0 1.553 2.667 1651 1399 A 17 HIS H A 15 GLU HBx 1.0 1.793 3.637 1652 1399 A 15 GLU H A 15 GLU HBx 1.0 1.793 3.637 1653 1400 A 41 ARG HBy A 25 HIS HBy 1.0 1.766 3.498 1654 1400 A 25 HIS HBy A 24 LYS HBx 1.0 1.766 3.498 1655 1401 A 63 GLU HGx A 63 GLU HBy 1.0 1.451 2.355 1656 1401 A 60 GLU HBy A 60 GLU HGy 1.0 1.451 2.355 1657 1402 A 28 ILE HA A 28 ILE HG1x 1.0 1.796 3.652 1658 1402 A 27 LYS HA A 28 ILE HG1x 1.0 1.796 3.652 1659 1403 A 57 TRP HBy A 57 TRP HD1 1.0 1.764 3.490 1660 1403 A 57 TRP HBy A 20 ARG H 1.0 1.764 3.490 1661 1404 A 31 THR HA A 32 PRO HGx 1.0 1.823 3.793 1662 1404 A 31 THR HA A 10 PRO HGy 1.0 1.823 3.793 1663 1405 A 32 PRO HDx A 32 PRO HGx 1.0 1.633 2.941 1664 1405 A 2 PRO HGx A 2 PRO HDx 1.0 1.633 2.941 1665 1406 A 51 ILE HG1x A 51 ILE HD1% 1.0 1.542 2.630 1666 1406 A 51 ILE HG2% A 51 ILE HG1x 1.0 1.542 2.630 1667 1407 A 11 CYS H A 10 PRO HGy 1.0 1.865 4.055 1668 1407 A 3 VAL H A 2 PRO HGx 1.0 1.865 4.055 1669 1408 A 31 THR HG2% A 10 PRO HGy 1.0 1.763 3.481 1670 1408 A 31 THR HG2% A 32 PRO HGx 1.0 1.763 3.481 1671 1409 A 48 GLN HA A 41 ARG HGx 1.0 1.802 3.682 1672 1409 A 41 ARG HA A 41 ARG HGx 1.0 1.802 3.682 1673 1410 A 55 LEU HG A 54 LYS H 1.0 1.869 4.081 1674 1410 A 54 LYS H A 53 PRO HGx 1.0 1.869 4.081 1675 1411 A 16 SER HA A 55 LEU HG 1.0 1.820 3.778 1676 1411 A 42 LEU HA A 42 LEU HG 1.0 1.820 3.778 1677 1412 A 9 CYS H A 8 ARG HA 1.0 1.554 2.670 1678 1412 A 8 ARG H A 8 ARG HA 1.0 1.554 2.670 1679 1413 A 2 PRO HBx A 2 PRO HDy 1.0 1.674 3.098 1680 1413 A 10 PRO HDx A 10 PRO HBy 1.0 1.674 3.098 1681 1414 A 2 PRO HBy A 2 PRO HDx 1.0 1.872 4.104 1682 1414 A 32 PRO HDx A 32 PRO HBx 1.0 1.872 4.104 1683 1415 A 14 PHE HDx A 11 CYS HBx 1.0 1.898 4.296 1684 1415 A 14 PHE HDy A 11 CYS HBx 1.0 1.898 4.296 1685 1415 A 11 CYS HBx A 37 GLN HE2x 1.0 1.898 4.296 1686 1416 A 11 CYS HBy A 37 GLN HE2x 1.0 1.923 4.509 1687 1416 A 14 PHE HDx A 11 CYS HBy 1.0 1.923 4.509 1688 1416 A 14 PHE HDy A 11 CYS HBy 1.0 1.923 4.509 1689 1417 A 12 ARG HBy A 12 ARG HDy 1.0 1.649 2.999 1690 1417 A 8 ARG HGx A 8 ARG HDx 1.0 1.649 2.999 1691 1418 A 55 LEU HDx% A 16 SER HBx 1.0 1.869 4.085 1692 1418 A 55 LEU HDy% A 16 SER HBx 1.0 1.869 4.085 1693 1419 A 37 GLN H A 28 ILE HG2% 1.0 1.778 3.558 1694 1419 A 28 ILE H A 28 ILE HG2% 1.0 1.778 3.558 1695 1420 A 20 ARG H A 18 ILE HG2% 1.0 1.923 4.509 1696 1420 A 22 ASN H A 18 ILE HG2% 1.0 1.923 4.509 1697 1420 A 18 ILE HG2% A 22 ASN HD2y 1.0 1.923 4.509 1698 1421 A 18 ILE HD1% A 18 ILE HG1y 1.0 1.557 2.677 1699 1421 A 18 ILE HG1y A 18 ILE HG2% 1.0 1.557 2.677 1700 1422 A 19 ALA HA A 23 VAL HGx% 1.0 1.867 4.071 1701 1422 A 19 ALA HA A 18 ILE HG2% 1.0 1.867 4.071 1702 1423 A 19 ALA HA A 20 ARG HBy 1.0 1.877 4.137 1703 1423 A 19 ALA HA A 55 LEU HDy% 1.0 1.877 4.137 1704 1423 A 19 ALA HA A 55 LEU HDx% 1.0 1.877 4.137 1705 1424 A 19 ALA HB% A 22 ASN H 1.0 1.635 2.949 1706 1424 A 20 ARG H A 19 ALA HB% 1.0 1.635 2.949 1707 1425 A 42 LEU HDy% A 23 VAL HA 1.0 1.693 3.171 1708 1425 A 23 VAL HGy% A 23 VAL HA 1.0 1.693 3.171 1709 1426 A 40 ALA HB% A 23 VAL HGx% 1.0 1.619 2.889 1710 1426 A 26 LEU HBx A 23 VAL HGx% 1.0 1.619 2.889 1711 1426 A 19 ALA HB% A 23 VAL HGx% 1.0 1.619 2.889 1712 1427 A 26 LEU HDx% A 23 VAL HGy% 1.0 1.697 3.191 1713 1427 A 26 LEU HDy% A 23 VAL HGy% 1.0 1.697 3.191 1714 1428 A 44 ASN HA A 43 LYS HEy 1.0 1.882 4.178 1715 1428 A 44 ASN HA A 24 LYS HEy 1.0 1.882 4.178 1716 1428 A 24 LYS HEy A 24 LYS HA 1.0 1.882 4.178 1717 1429 A 24 LYS HDy A 24 LYS HGy 1.0 1.636 2.950 1718 1429 A 24 LYS HGy A 24 LYS HBx 1.0 1.636 2.950 1719 1430 A 26 LEU HBx A 23 VAL HGx% 1.0 1.858 4.008 1720 1430 A 23 VAL HGy% A 26 LEU HBx 1.0 1.858 4.008 1721 1431 A 38 ILE HG2% A 26 LEU HBx 1.0 1.874 4.116 1722 1431 A 26 LEU HBx A 51 ILE HD1% 1.0 1.874 4.116 1723 1432 A 38 ILE HG2% A 26 LEU HBy 1.0 1.882 4.174 1724 1432 A 26 LEU HBy A 51 ILE HD1% 1.0 1.882 4.174 1725 1433 A 28 ILE HD1% A 26 LEU HBy 1.0 1.921 4.493 1726 1433 A 26 LEU HBy A 23 VAL HGx% 1.0 1.921 4.493 1727 1433 A 26 LEU HBy A 23 VAL HGy% 1.0 1.921 4.493 1728 1434 A 26 LEU HA A 26 LEU HG 1.0 1.952 4.812 1729 1434 A 11 CYS HA A 12 ARG HGx 1.0 1.952 4.812 1730 1435 A 26 LEU HDy% A 23 VAL HGx% 1.0 1.619 2.887 1731 1435 A 26 LEU HDy% A 23 VAL HGy% 1.0 1.619 2.887 1732 1436 A 26 LEU HDy% A 26 LEU HBx 1.0 1.908 4.370 1733 1436 A 26 LEU HDy% A 26 LEU HG 1.0 1.908 4.370 1734 1437 A 27 LYS HA A 39 VAL HGx% 1.0 1.786 3.596 1735 1437 A 28 ILE HD1% A 27 LYS HA 1.0 1.786 3.596 1736 1438 A 28 ILE HA A 27 LYS HGx 1.0 1.842 3.908 1737 1438 A 27 LYS HA A 27 LYS HGx 1.0 1.842 3.908 1738 1439 A 27 LYS HGx A 29 LEU H 1.0 1.953 4.813 1739 1439 A 27 LYS H A 27 LYS HGx 1.0 1.953 4.813 1740 1440 A 28 ILE HG2% A 28 ILE HG1y 1.0 1.599 2.819 1741 1440 A 28 ILE HD1% A 28 ILE HG1y 1.0 1.599 2.819 1742 1441 A 28 ILE HD1% A 61 TYR HEx 1.0 1.884 4.190 1743 1441 A 28 ILE HD1% A 61 TYR HDx 1.0 1.884 4.190 1744 1442 A 10 PRO HDx A 29 LEU HG 1.0 1.802 3.682 1745 1442 A 5 LEU HDy% A 4 SER HBx 1.0 1.802 3.682 1746 1442 A 62 LEU HA A 66 LEU HG 1.0 1.802 3.682 1747 1443 A 28 ILE HG2% A 30 ASN HBy 1.0 1.833 3.857 1748 1443 A 29 LEU HDx% A 30 ASN HBy 1.0 1.833 3.857 1749 1444 A 34 CYS HBy A 32 PRO HDy 1.0 1.904 4.346 1750 1444 A 34 CYS HBy A 10 PRO HDx 1.0 1.904 4.346 1751 1445 A 34 CYS HBx A 32 PRO HDy 1.0 1.973 5.101 1752 1445 A 34 CYS HBx A 10 PRO HDx 1.0 1.973 5.101 1753 1446 A 35 ALA HB% A 66 LEU HDx% 1.0 1.889 4.229 1754 1446 A 62 LEU HDx% A 35 ALA HB% 1.0 1.889 4.229 1755 1446 A 35 ALA HB% A 36 LEU HDx% 1.0 1.889 4.229 1756 1447 A 35 ALA HB% A 66 LEU HDx% 1.0 1.861 4.031 1757 1447 A 35 ALA HB% A 36 LEU HDy% 1.0 1.861 4.031 1758 1448 A 36 LEU HDy% A 36 LEU HA 1.0 1.787 3.603 1759 1448 A 35 ALA HA A 36 LEU HDy% 1.0 1.787 3.603 1760 1449 A 38 ILE HB A 51 ILE HB 1.0 1.704 3.216 1761 1449 A 38 ILE HB A 38 ILE HG1y 1.0 1.704 3.216 1762 1450 A 38 ILE HG2% A 40 ALA H 1.0 1.837 3.879 1763 1450 A 38 ILE HG2% A 27 LYS H 1.0 1.837 3.879 1764 1451 A 38 ILE HG2% A 28 ILE HA 1.0 1.878 4.150 1765 1451 A 38 ILE HG2% A 27 LYS HA 1.0 1.878 4.150 1766 1452 A 38 ILE HG2% A 39 VAL HA 1.0 1.933 4.607 1767 1452 A 38 ILE HG2% A 40 ALA HA 1.0 1.933 4.607 1768 1453 A 38 ILE HG2% A 51 ILE HG1y 1.0 1.597 2.811 1769 1453 A 38 ILE HG2% A 38 ILE HG1x 1.0 1.597 2.811 1770 1454 A 38 ILE HD1% A 28 ILE HG1y 1.0 1.807 3.707 1771 1454 A 38 ILE HD1% A 53 PRO HGy 1.0 1.807 3.707 1772 1455 A 38 ILE HD1% A 28 ILE HA 1.0 1.907 4.369 1773 1455 A 38 ILE HD1% A 37 GLN HA 1.0 1.907 4.369 1774 1456 A 40 ALA HB% A 39 VAL HA 1.0 1.964 4.970 1775 1456 A 39 VAL HA A 51 ILE HG1x 1.0 1.964 4.970 1776 1457 A 39 VAL HA A 27 LYS HBy 1.0 1.966 4.990 1777 1457 A 39 VAL HA A 29 LEU HBy 1.0 1.966 4.990 1778 1458 A 39 VAL HA A 39 VAL HGx% 1.0 1.762 3.476 1779 1458 A 40 ALA HA A 39 VAL HGx% 1.0 1.762 3.476 1780 1459 A 40 ALA HA A 39 VAL HGx% 1.0 1.844 3.922 1781 1459 A 40 ALA HA A 39 VAL HGy% 1.0 1.844 3.922 1782 1460 A 52 ASP HA A 55 LEU HG 1.0 1.866 4.066 1783 1460 A 52 ASP HA A 53 PRO HGx 1.0 1.866 4.066 1784 1461 A 43 LYS HBx A 43 LYS HGy 1.0 1.762 3.478 1785 1461 A 43 LYS HBx A 43 LYS HGx 1.0 1.762 3.478 1786 1462 A 48 GLN HA A 49 VAL HGx% 1.0 1.837 3.881 1787 1462 A 48 GLN HA A 39 VAL HGy% 1.0 1.837 3.881 1788 1463 A 41 ARG HGy A 48 GLN HGx 1.0 1.912 4.414 1789 1463 A 41 ARG HGy A 48 GLN HGy 1.0 1.912 4.414 1790 1464 A 48 GLN HBx A 48 GLN HGx 1.0 1.506 2.518 1791 1464 A 48 GLN HGy A 48 GLN HBx 1.0 1.506 2.518 1792 1465 A 49 VAL HB A 51 ILE HG1x 1.0 1.941 4.689 1793 1465 A 40 ALA HB% A 49 VAL HB 1.0 1.941 4.689 1794 1466 A 48 GLN HGy A 39 VAL HGy% 1.0 1.643 2.977 1795 1466 A 39 VAL HGy% A 48 GLN HGx 1.0 1.643 2.977 1796 1467 A 51 ILE HA A 55 LEU HDx% 1.0 1.833 3.855 1797 1467 A 51 ILE HA A 51 ILE HG1y 1.0 1.833 3.855 1798 1468 A 51 ILE HG2% A 53 PRO HA 1.0 1.946 4.734 1799 1468 A 51 ILE HG2% A 55 LEU HA 1.0 1.946 4.734 1800 1469 A 38 ILE HG2% A 51 ILE HG1y 1.0 1.611 2.863 1801 1469 A 51 ILE HG1y A 51 ILE HD1% 1.0 1.611 2.863 1802 1470 A 40 ALA HB% A 51 ILE HD1% 1.0 1.508 2.524 1803 1470 A 51 ILE HG1x A 51 ILE HD1% 1.0 1.508 2.524 1804 1471 A 54 LYS HEx A 54 LYS HBx 1.0 1.547 2.643 1805 1471 A 54 LYS HEx A 54 LYS HBy 1.0 1.547 2.643 1806 1472 A 59 GLN H A 55 LEU HA 1.0 1.933 4.599 1807 1472 A 57 TRP H A 55 LEU HA 1.0 1.933 4.599 1808 1473 A 55 LEU HBx A 58 ILE HG1y 1.0 1.883 4.177 1809 1473 A 51 ILE HG2% A 55 LEU HBx 1.0 1.883 4.177 1810 1474 A 57 TRP H A 56 LYS HA 1.0 1.809 3.719 1811 1474 A 59 GLN H A 56 LYS HA 1.0 1.809 3.719 1812 1475 A 56 LYS HGx A 56 LYS HA 1.0 1.727 3.319 1813 1475 A 56 LYS HA A 56 LYS HGy 1.0 1.727 3.319 1814 1476 A 56 LYS HGx A 56 LYS HEx 1.0 1.646 2.990 1815 1476 A 56 LYS HEx A 56 LYS HGy 1.0 1.646 2.990 1816 1477 A 57 TRP HA A 59 GLN HBy 1.0 1.750 3.424 1817 1477 A 57 TRP HA A 60 GLU HGx 1.0 1.750 3.424 1818 1478 A 51 ILE HG2% A 58 ILE HA 1.0 1.831 3.847 1819 1478 A 58 ILE HA A 58 ILE HG1y 1.0 1.831 3.847 1820 1479 A 61 TYR HDy A 58 ILE HA 1.0 1.915 4.433 1821 1479 A 58 ILE HA A 55 LEU H 1.0 1.915 4.433 1822 1480 A 58 ILE HB A 55 LEU HA 1.0 1.967 5.017 1823 1480 A 58 ILE HB A 53 PRO HA 1.0 1.967 5.017 1824 1481 A 61 TYR HDy A 58 ILE HG2% 1.0 1.902 4.332 1825 1481 A 58 ILE HG2% A 55 LEU H 1.0 1.902 4.332 1826 1482 A 58 ILE HG2% A 55 LEU HBy 1.0 1.725 3.311 1827 1482 A 55 LEU HDx% A 58 ILE HG2% 1.0 1.725 3.311 1828 1482 A 58 ILE HG2% A 38 ILE HG1x 1.0 1.725 3.311 1829 1483 A 58 ILE HD1% A 55 LEU H 1.0 1.892 4.248 1830 1483 A 61 TYR HDy A 58 ILE HD1% 1.0 1.892 4.248 1831 1484 A 51 ILE HG1y A 58 ILE HD1% 1.0 1.759 3.465 1832 1484 A 55 LEU HDx% A 58 ILE HD1% 1.0 1.759 3.465 1833 1484 A 58 ILE HD1% A 55 LEU HBy 1.0 1.759 3.465 1834 1485 A 58 ILE HD1% A 51 ILE HD1% 1.0 1.453 2.361 1835 1485 A 51 ILE HG2% A 58 ILE HD1% 1.0 1.453 2.361 1836 1486 A 55 LEU HBx A 58 ILE HD1% 1.0 1.832 3.852 1837 1486 A 65 ALA HB% A 58 ILE HD1% 1.0 1.832 3.852 1838 1487 A 58 ILE HG1x A 55 LEU HBy 1.0 1.918 4.458 1839 1487 A 55 LEU HDx% A 58 ILE HG1x 1.0 1.918 4.458 1840 1488 A 59 GLN HGy A 59 GLN HBy 1.0 1.379 2.163 1841 1488 A 37 GLN HBx A 37 GLN HGx 1.0 1.379 2.163 1842 1489 A 61 TYR HBy A 64 LYS HBx 1.0 1.911 4.395 1843 1489 A 62 LEU HBy A 61 TYR HBy 1.0 1.911 4.395 1844 1490 A 42 LEU HDy% A 22 ASN HD2x 1.0 1.919 4.465 1845 1490 A 61 TYR HDy A 66 LEU HDx% 1.0 1.919 4.465 1846 1491 A 36 LEU HBx A 66 LEU HDx% 1.0 1.551 2.657 1847 1491 A 62 LEU HBx A 66 LEU HDx% 1.0 1.551 2.657 1848 1492 A 65 ALA HA A 28 ILE HG2% 1.0 1.846 3.936 1849 1492 A 65 ALA HA A 66 LEU HDx% 1.0 1.846 3.936 1850 1492 A 65 ALA HA A 36 LEU HDx% 1.0 1.846 3.936 1851 1492 A 28 ILE HD1% A 65 ALA HA 1.0 1.846 3.936 1852 1493 A 66 LEU HBy A 65 ALA HA 1.0 1.886 4.202 1853 1493 A 65 ALA HA A 28 ILE HG1y 1.0 1.886 4.202 1854 1494 A 65 ALA HB% A 28 ILE HG2% 1.0 1.575 2.739 1855 1494 A 28 ILE HD1% A 65 ALA HB% 1.0 1.575 2.739 1856 1494 A 65 ALA HB% A 66 LEU HDx% 1.0 1.575 2.739 1857 1495 A 65 ALA HB% A 66 LEU HA 1.0 1.813 3.741 1858 1495 A 61 TYR HA A 65 ALA HB% 1.0 1.813 3.741 1859 1496 A 68 LYS H A 67 ASN HBx 1.0 1.897 4.289 1860 1496 A 8 ARG H A 7 TYR HBy 1.0 1.897 4.289 1861 1497 A 67 ASN HBy A 66 LEU HBy 1.0 1.924 4.520 1862 1497 A 67 ASN HBy A 64 LYS HDy 1.0 1.924 4.520 1863 1497 A 67 ASN HBy A 68 LYS HDy 1.0 1.924 4.520 1864 1498 A 26 LEU HDy% A 61 TYR HDx 1.0 1.854 3.984 1865 1498 A 26 LEU HDy% A 61 TYR HEx 1.0 1.854 3.984 1866 1499 A 58 ILE HD1% A 38 ILE HG1y 1.0 1.772 3.528 1867 1499 A 51 ILE HB A 58 ILE HD1% 1.0 1.772 3.528 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 Hz . . 5000.0000 . . . . 2 Hz . . 850.68402 . . . . 3 Hz . . 6716.2368 . . . . 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 Hz . . 7225.4341 . . . . 2 Hz . . 1500.0090 . aliased . . 3 Hz . . 6751.0552 . . . . 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 Hz . . 7225.4341 . . . . 2 Hz . . 5000.0000 . folded . . 3 Hz . . 6751.0552 . . . . stop_ save_ save_spectral_peak_list_4 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_4 _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 Hz . . 7575.7578 . . . . 2 Hz . . 2400.0000 . folded . . 3 Hz . . 2400.0239 . . . . stop_ save_