data_nef_c25987_2nbp save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 25986 PDB 2NBP stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY start . false 2 A 2 PRO middle . false 3 A 3 THR middle . . 4 A 4 GLY middle . false 5 A 5 THR middle . . 6 A 6 GLY middle . false 7 A 7 GLU middle . . 8 A 8 SER middle . . 9 A 9 LYS middle . . 10 A 10 CYS middle . . 11 A 11 PRO middle . false 12 A 12 LEU middle . . 13 A 13 MET middle . . 14 A 14 VAL middle . . 15 A 15 LYS middle . . 16 A 16 VAL middle . . 17 A 17 LEU middle . . 18 A 18 ASP middle . . 19 A 19 ALA middle . . 20 A 20 VAL middle . . 21 A 21 ARG middle . . 22 A 22 GLY middle . false 23 A 23 SER middle . . 24 A 24 PRO middle . false 25 A 25 ALA middle . . 26 A 26 ILE middle . . 27 A 27 ASN middle . . 28 A 28 VAL middle . . 29 A 29 ALA middle . . 30 A 30 VAL middle . . 31 A 31 HIS middle . . 32 A 32 VAL middle . . 33 A 33 PHE middle . . 34 A 34 ARG middle . . 35 A 35 LYS middle . . 36 A 36 ALA middle . . 37 A 37 ALA middle . . 38 A 38 ASP middle . . 39 A 39 ASP middle . . 40 A 40 THR middle . . 41 A 41 TRP middle . . 42 A 42 GLU middle . . 43 A 43 PRO middle . false 44 A 44 PHE middle . . 45 A 45 ALA middle . . 46 A 46 SER middle . . 47 A 47 GLY middle . false 48 A 48 LYS middle . . 49 A 49 THR middle . . 50 A 50 SER middle . . 51 A 51 GLU middle . . 52 A 52 SER middle . . 53 A 53 GLY middle . false 54 A 54 GLU middle . . 55 A 55 LEU middle . . 56 A 56 HIS middle . . 57 A 57 GLY middle . false 58 A 58 LEU middle . . 59 A 59 THR middle . . 60 A 60 THR middle . . 61 A 61 GLU middle . . 62 A 62 GLU middle . . 63 A 63 GLU middle . . 64 A 64 PHE middle . . 65 A 65 VAL middle . . 66 A 66 GLU middle . . 67 A 67 GLY middle . false 68 A 68 ILE middle . . 69 A 69 TYR middle . . 70 A 70 LYS middle . . 71 A 71 VAL middle . . 72 A 72 GLU middle . . 73 A 73 ILE middle . . 74 A 74 ASP middle . . 75 A 75 THR middle . . 76 A 76 LYS middle . . 77 A 77 SER middle . . 78 A 78 TYR middle . . 79 A 79 TRP middle . . 80 A 80 LYS middle . . 81 A 81 ALA middle . . 82 A 82 LEU middle . . 83 A 83 GLY middle . false 84 A 84 ILE middle . . 85 A 85 SER middle . . 86 A 86 PRO middle . false 87 A 87 MET middle . . 88 A 88 HIS middle . . 89 A 89 GLU middle . . 90 A 90 HIS middle . . 91 A 91 ALA middle . . 92 A 92 GLU middle . . 93 A 93 VAL middle . . 94 A 94 VAL middle . . 95 A 95 PHE middle . . 96 A 96 THR middle . . 97 A 97 ALA middle . . 98 A 98 ASN middle . . 99 A 99 ASP middle . . 100 A 100 SER middle . . 101 A 101 GLY middle . false 102 A 102 PRO middle . false 103 A 103 ARG middle . . 104 A 104 ARG middle . . 105 A 105 TYR middle . . 106 A 106 THR middle . . 107 A 107 ILE middle . . 108 A 108 ALA middle . . 109 A 109 ALA middle . . 110 A 110 MET middle . . 111 A 111 LEU middle . . 112 A 112 SER middle . . 113 A 113 PRO middle . false 114 A 114 TYR middle . . 115 A 115 SER middle . . 116 A 116 TYR middle . . 117 A 117 SER middle . . 118 A 118 THR middle . . 119 A 119 MET middle . . 120 A 120 ALA middle . . 121 A 121 VAL middle . . 122 A 122 VAL middle . . 123 A 123 THR middle . . 124 A 124 ASN middle . . 125 A 125 PRO middle . false 126 A 126 LYS middle . . 127 A 127 GLU end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 GLY HAy H 1 4.178 0.020 A 1 GLY HAx H 1 4.141 0.020 A 1 GLY CA C 13 44.637 0.400 A 2 PRO HA H 1 4.505 0.020 A 2 PRO HBy H 1 2.297 0.020 A 2 PRO HBx H 1 1.968 0.020 A 2 PRO HD2 H 1 3.641 0.020 A 2 PRO HD3 H 1 3.641 0.020 A 2 PRO HGy H 1 2.021 0.020 A 2 PRO HGx H 1 1.970 0.020 A 2 PRO CA C 13 63.384 0.400 A 2 PRO CB C 13 32.177 0.400 A 2 PRO CD C 13 49.887 0.400 A 2 PRO CG C 13 27.327 0.400 A 3 THR H H 1 8.322 0.020 A 3 THR HA H 1 4.366 0.020 A 3 THR HB H 1 4.262 0.020 A 3 THR HG2% H 1 1.221 0.020 A 3 THR CA C 13 62.018 0.400 A 3 THR CB C 13 69.875 0.400 A 3 THR CG2 C 13 21.633 0.400 A 3 THR N N 15 113.714 0.400 A 4 GLY H H 1 8.424 0.020 A 4 GLY HA2 H 1 4.042 0.020 A 4 GLY HA3 H 1 4.042 0.020 A 4 GLY CA C 13 45.517 0.400 A 4 GLY N N 15 111.126 0.400 A 5 THR H H 1 8.181 0.020 A 5 THR HA H 1 4.362 0.020 A 5 THR HB H 1 4.281 0.020 A 5 THR HG2% H 1 1.187 0.020 A 5 THR CA C 13 61.981 0.400 A 5 THR CB C 13 69.846 0.400 A 5 THR CG2 C 13 21.575 0.400 A 5 THR N N 15 112.922 0.400 A 6 GLY H H 1 8.507 0.020 A 6 GLY HAy H 1 3.968 0.020 A 6 GLY HAx H 1 3.951 0.020 A 6 GLY CA C 13 45.517 0.400 A 6 GLY N N 15 111.160 0.400 A 7 GLU H H 1 8.292 0.020 A 7 GLU HA H 1 4.296 0.020 A 7 GLU HBy H 1 2.019 0.020 A 7 GLU HBx H 1 1.900 0.020 A 7 GLU HG2 H 1 2.205 0.020 A 7 GLU HG3 H 1 2.205 0.020 A 7 GLU CA C 13 56.651 0.400 A 7 GLU CB C 13 30.456 0.400 A 7 GLU CG C 13 36.326 0.400 A 7 GLU N N 15 120.717 0.400 A 8 SER H H 1 8.405 0.020 A 8 SER HA H 1 4.424 0.020 A 8 SER HB2 H 1 3.878 0.020 A 8 SER HB3 H 1 3.878 0.020 A 8 SER CA C 13 58.635 0.400 A 8 SER CB C 13 63.700 0.400 A 8 SER N N 15 117.148 0.400 A 9 LYS H H 1 8.494 0.020 A 9 LYS HA H 1 4.374 0.020 A 9 LYS HBy H 1 1.860 0.020 A 9 LYS HBx H 1 1.719 0.020 A 9 LYS HD2 H 1 1.661 0.020 A 9 LYS HD3 H 1 1.661 0.020 A 9 LYS HE2 H 1 2.980 0.020 A 9 LYS HE3 H 1 2.980 0.020 A 9 LYS HGy H 1 1.450 0.020 A 9 LYS HGx H 1 1.384 0.020 A 9 LYS CA C 13 55.741 0.400 A 9 LYS CB C 13 32.914 0.400 A 9 LYS CD C 13 29.058 0.400 A 9 LYS CE C 13 42.193 0.400 A 9 LYS CG C 13 24.932 0.400 A 9 LYS N N 15 123.180 0.400 A 10 CYS H H 1 8.357 0.020 A 10 CYS HA H 1 4.822 0.020 A 10 CYS HB2 H 1 3.074 0.020 A 10 CYS HB3 H 1 3.074 0.020 A 10 CYS CA C 13 55.863 0.400 A 10 CYS CB C 13 27.755 0.400 A 10 CYS N N 15 122.188 0.400 A 11 PRO HA H 1 4.597 0.020 A 11 PRO HBy H 1 2.453 0.020 A 11 PRO HBx H 1 2.051 0.020 A 11 PRO CA C 13 64.379 0.400 A 11 PRO CB C 13 32.931 0.400 A 12 LEU H H 1 6.993 0.020 A 12 LEU HA H 1 5.092 0.020 A 12 LEU HB2 H 1 1.071 0.020 A 12 LEU HB3 H 1 1.071 0.020 A 12 LEU HDx% H 1 0.468 0.020 A 12 LEU HDy% H 1 0.610 0.020 A 12 LEU HG H 1 1.011 0.020 A 12 LEU CA C 13 53.695 0.400 A 12 LEU CB C 13 45.091 0.400 A 12 LEU CD1 C 13 25.397 0.400 A 12 LEU CD2 C 13 23.900 0.400 A 12 LEU CG C 13 27.382 0.400 A 12 LEU N N 15 119.799 0.400 A 13 MET H H 1 8.558 0.020 A 13 MET HA H 1 4.639 0.020 A 13 MET HB2 H 1 1.989 0.020 A 13 MET HB3 H 1 1.989 0.020 A 13 MET HE% H 1 1.826 0.020 A 13 MET HGx H 1 2.236 0.020 A 13 MET HGy H 1 2.292 0.020 A 13 MET CA C 13 54.652 0.400 A 13 MET CB C 13 35.230 0.400 A 13 MET CE C 13 17.284 0.400 A 13 MET CG C 13 32.213 0.400 A 13 MET N N 15 126.217 0.400 A 14 VAL H H 1 7.664 0.020 A 14 VAL HA H 1 5.006 0.020 A 14 VAL HB H 1 1.727 0.020 A 14 VAL HGx% H 1 0.656 0.020 A 14 VAL HGy% H 1 0.659 0.020 A 14 VAL CA C 13 60.422 0.400 A 14 VAL CB C 13 34.874 0.400 A 14 VAL CG1 C 13 20.703 0.400 A 14 VAL CG2 C 13 20.811 0.400 A 14 VAL N N 15 122.177 0.400 A 15 LYS H H 1 9.071 0.020 A 15 LYS HA H 1 5.082 0.020 A 15 LYS HBx H 1 1.506 0.020 A 15 LYS HBy H 1 1.687 0.020 A 15 LYS HD2 H 1 1.596 0.020 A 15 LYS HD3 H 1 1.596 0.020 A 15 LYS HE2 H 1 2.842 0.020 A 15 LYS HE3 H 1 2.842 0.020 A 15 LYS HG2 H 1 1.203 0.020 A 15 LYS HG3 H 1 1.203 0.020 A 15 LYS CA C 13 54.939 0.400 A 15 LYS CB C 13 35.853 0.400 A 15 LYS CD C 13 29.667 0.400 A 15 LYS CE C 13 42.157 0.400 A 15 LYS CG C 13 25.069 0.400 A 15 LYS N N 15 127.788 0.400 A 16 VAL H H 1 9.249 0.020 A 16 VAL HA H 1 4.839 0.020 A 16 VAL HB H 1 2.003 0.020 A 16 VAL HGx% H 1 0.662 0.020 A 16 VAL HGy% H 1 0.611 0.020 A 16 VAL CA C 13 61.161 0.400 A 16 VAL CB C 13 33.000 0.400 A 16 VAL CG1 C 13 23.344 0.400 A 16 VAL CG2 C 13 21.634 0.400 A 16 VAL N N 15 125.178 0.400 A 17 LEU H H 1 8.664 0.020 A 17 LEU HA H 1 4.715 0.020 A 17 LEU HBy H 1 1.700 0.020 A 17 LEU HBx H 1 1.364 0.020 A 17 LEU HDx% H 1 0.737 0.020 A 17 LEU HDy% H 1 0.745 0.020 A 17 LEU HG H 1 1.491 0.020 A 17 LEU CA C 13 53.405 0.400 A 17 LEU CB C 13 45.610 0.400 A 17 LEU CD1 C 13 24.119 0.400 A 17 LEU CD2 C 13 24.704 0.400 A 17 LEU CG C 13 27.502 0.400 A 17 LEU N N 15 127.533 0.400 A 18 ASP H H 1 8.819 0.020 A 18 ASP HA H 1 4.610 0.020 A 18 ASP HBy H 1 2.987 0.020 A 18 ASP HBx H 1 2.381 0.020 A 18 ASP CA C 13 53.608 0.400 A 18 ASP CB C 13 41.853 0.400 A 18 ASP N N 15 122.304 0.400 A 19 ALA H H 1 9.297 0.020 A 19 ALA HA H 1 4.197 0.020 A 19 ALA HB% H 1 1.442 0.020 A 19 ALA CA C 13 54.228 0.400 A 19 ALA CB C 13 19.812 0.400 A 19 ALA N N 15 128.045 0.400 A 20 VAL H H 1 8.843 0.020 A 20 VAL HA H 1 3.947 0.020 A 20 VAL HB H 1 2.535 0.020 A 20 VAL HGx% H 1 1.064 0.020 A 20 VAL HGy% H 1 1.132 0.020 A 20 VAL CA C 13 65.294 0.400 A 20 VAL CB C 13 32.052 0.400 A 20 VAL CG1 C 13 21.353 0.400 A 20 VAL CG2 C 13 22.774 0.400 A 20 VAL N N 15 118.963 0.400 A 21 ARG H H 1 8.381 0.020 A 21 ARG HA H 1 4.298 0.020 A 21 ARG HBx H 1 1.584 0.020 A 21 ARG HBy H 1 1.971 0.020 A 21 ARG HD2 H 1 3.244 0.020 A 21 ARG HD3 H 1 3.244 0.020 A 21 ARG HGx H 1 1.696 0.020 A 21 ARG HGy H 1 1.830 0.020 A 21 ARG CA C 13 56.734 0.400 A 21 ARG CB C 13 31.851 0.400 A 21 ARG CD C 13 43.552 0.400 A 21 ARG CG C 13 28.266 0.400 A 21 ARG N N 15 117.917 0.400 A 22 GLY H H 1 8.338 0.020 A 22 GLY HAy H 1 3.985 0.020 A 22 GLY HAx H 1 3.837 0.020 A 22 GLY CA C 13 46.532 0.400 A 22 GLY N N 15 109.293 0.400 A 23 SER H H 1 7.422 0.020 A 23 SER HA H 1 4.986 0.020 A 23 SER HBy H 1 3.923 0.020 A 23 SER HBx H 1 3.719 0.020 A 23 SER CA C 13 55.592 0.400 A 23 SER CB C 13 64.708 0.400 A 23 SER N N 15 112.563 0.400 A 24 PRO HA H 1 4.400 0.020 A 24 PRO HBy H 1 1.938 0.020 A 24 PRO HBx H 1 1.575 0.020 A 24 PRO HDx H 1 3.735 0.020 A 24 PRO HDy H 1 3.838 0.020 A 24 PRO HGy H 1 2.109 0.020 A 24 PRO HGx H 1 1.872 0.020 A 24 PRO CA C 13 63.576 0.400 A 24 PRO CB C 13 32.222 0.400 A 24 PRO CD C 13 50.783 0.400 A 24 PRO CG C 13 27.930 0.400 A 25 ALA H H 1 8.068 0.020 A 25 ALA HA H 1 4.464 0.020 A 25 ALA HB% H 1 0.372 0.020 A 25 ALA CA C 13 50.805 0.400 A 25 ALA CB C 13 19.106 0.400 A 25 ALA N N 15 126.967 0.400 A 26 ILE H H 1 8.073 0.020 A 26 ILE HA H 1 3.819 0.020 A 26 ILE HB H 1 1.643 0.020 A 26 ILE HD1% H 1 0.912 0.020 A 26 ILE HG1y H 1 1.436 0.020 A 26 ILE HG1x H 1 1.110 0.020 A 26 ILE HG2% H 1 0.821 0.020 A 26 ILE CA C 13 61.794 0.400 A 26 ILE CB C 13 39.761 0.400 A 26 ILE CD1 C 13 13.986 0.400 A 26 ILE CG1 C 13 26.955 0.400 A 26 ILE CG2 C 13 17.024 0.400 A 26 ILE N N 15 126.988 0.400 A 27 ASN H H 1 7.856 0.020 A 27 ASN HA H 1 4.307 0.020 A 27 ASN HBx H 1 2.696 0.020 A 27 ASN HBy H 1 3.198 0.020 A 27 ASN HD2x H 1 6.881 0.020 A 27 ASN HD2y H 1 7.624 0.020 A 27 ASN CA C 13 54.551 0.400 A 27 ASN CB C 13 37.201 0.400 A 27 ASN N N 15 122.121 0.400 A 27 ASN ND2 N 15 112.424 0.400 A 28 VAL H H 1 8.307 0.020 A 28 VAL HA H 1 3.945 0.020 A 28 VAL HB H 1 1.717 0.020 A 28 VAL HGx% H 1 0.587 0.020 A 28 VAL HGy% H 1 0.272 0.020 A 28 VAL CA C 13 62.192 0.400 A 28 VAL CB C 13 31.994 0.400 A 28 VAL CG1 C 13 22.410 0.400 A 28 VAL CG2 C 13 23.434 0.400 A 28 VAL N N 15 119.630 0.400 A 29 ALA H H 1 8.796 0.020 A 29 ALA HA H 1 4.570 0.020 A 29 ALA HB% H 1 1.519 0.020 A 29 ALA CA C 13 52.586 0.400 A 29 ALA CB C 13 19.838 0.400 A 29 ALA N N 15 130.417 0.400 A 30 VAL H H 1 8.505 0.020 A 30 VAL HA H 1 4.576 0.020 A 30 VAL HB H 1 1.521 0.020 A 30 VAL HGx% H 1 0.626 0.020 A 30 VAL HGy% H 1 0.651 0.020 A 30 VAL CA C 13 60.682 0.400 A 30 VAL CB C 13 34.462 0.400 A 30 VAL CG1 C 13 21.338 0.400 A 30 VAL CG2 C 13 20.936 0.400 A 30 VAL N N 15 122.626 0.400 A 31 HIS H H 1 9.124 0.020 A 31 HIS HA H 1 4.962 0.020 A 31 HIS HBy H 1 3.101 0.020 A 31 HIS HBx H 1 2.963 0.020 A 31 HIS HD2 H 1 7.115 0.020 A 31 HIS CA C 13 55.059 0.400 A 31 HIS CB C 13 33.104 0.400 A 31 HIS CD2 C 13 120.151 0.400 A 31 HIS N N 15 124.109 0.400 A 32 VAL H H 1 9.263 0.020 A 32 VAL HA H 1 5.510 0.020 A 32 VAL HB H 1 2.242 0.020 A 32 VAL HGx% H 1 1.251 0.020 A 32 VAL HGy% H 1 0.868 0.020 A 32 VAL CA C 13 60.161 0.400 A 32 VAL CB C 13 33.172 0.400 A 32 VAL CG1 C 13 22.428 0.400 A 32 VAL CG2 C 13 21.854 0.400 A 32 VAL N N 15 121.663 0.400 A 33 PHE H H 1 10.064 0.020 A 33 PHE HA H 1 5.529 0.020 A 33 PHE HBx H 1 2.694 0.020 A 33 PHE HBy H 1 3.258 0.020 A 33 PHE HD1 H 1 6.852 0.020 A 33 PHE HD2 H 1 6.852 0.020 A 33 PHE HE1 H 1 7.259 0.020 A 33 PHE HE2 H 1 7.259 0.020 A 33 PHE CA C 13 56.449 0.400 A 33 PHE CB C 13 44.635 0.400 A 33 PHE CD1 C 13 131.750 0.400 A 33 PHE CE1 C 13 131.490 0.400 A 33 PHE N N 15 128.596 0.400 A 34 ARG H H 1 9.624 0.020 A 34 ARG HA H 1 5.006 0.020 A 34 ARG HBy H 1 1.768 0.020 A 34 ARG HBx H 1 1.080 0.020 A 34 ARG HDy H 1 2.941 0.020 A 34 ARG HDx H 1 2.801 0.020 A 34 ARG HG2 H 1 1.249 0.020 A 34 ARG HG3 H 1 1.249 0.020 A 34 ARG HH11 H 1 6.998 0.020 A 34 ARG HH12 H 1 6.998 0.020 A 34 ARG CA C 13 54.295 0.400 A 34 ARG CB C 13 34.401 0.400 A 34 ARG CD C 13 43.324 0.400 A 34 ARG CG C 13 27.023 0.400 A 34 ARG N N 15 122.685 0.400 A 35 LYS H H 1 8.779 0.020 A 35 LYS HA H 1 3.775 0.020 A 35 LYS HBy H 1 1.366 0.020 A 35 LYS HBx H 1 0.797 0.020 A 35 LYS HD2 H 1 0.963 0.020 A 35 LYS HD3 H 1 0.963 0.020 A 35 LYS HE2 H 1 2.260 0.020 A 35 LYS HE3 H 1 2.260 0.020 A 35 LYS HG2 H 1 0.040 0.020 A 35 LYS HG3 H 1 0.040 0.020 A 35 LYS CA C 13 57.360 0.400 A 35 LYS CB C 13 32.049 0.400 A 35 LYS CD C 13 28.590 0.400 A 35 LYS CE C 13 41.383 0.400 A 35 LYS CG C 13 24.155 0.400 A 35 LYS N N 15 130.271 0.400 A 36 ALA H H 1 8.924 0.020 A 36 ALA HA H 1 4.486 0.020 A 36 ALA HB% H 1 1.456 0.020 A 36 ALA CA C 13 51.075 0.400 A 36 ALA CB C 13 20.680 0.400 A 36 ALA N N 15 131.457 0.400 A 37 ALA H H 1 8.545 0.020 A 37 ALA HA H 1 4.039 0.020 A 37 ALA HB% H 1 1.392 0.020 A 37 ALA CA C 13 54.391 0.400 A 37 ALA CB C 13 18.372 0.400 A 37 ALA N N 15 122.600 0.400 A 38 ASP H H 1 7.777 0.020 A 38 ASP HA H 1 4.411 0.020 A 38 ASP HBy H 1 2.946 0.020 A 38 ASP HBx H 1 2.474 0.020 A 38 ASP CA C 13 53.235 0.400 A 38 ASP CB C 13 39.609 0.400 A 38 ASP N N 15 115.711 0.400 A 39 ASP H H 1 8.004 0.020 A 39 ASP HA H 1 3.913 0.020 A 39 ASP HB2 H 1 2.774 0.020 A 39 ASP HB3 H 1 2.774 0.020 A 39 ASP CA C 13 56.276 0.400 A 39 ASP CB C 13 39.284 0.400 A 39 ASP N N 15 112.985 0.400 A 40 THR H H 1 7.372 0.020 A 40 THR HA H 1 4.199 0.020 A 40 THR HB H 1 4.127 0.020 A 40 THR HG2% H 1 1.088 0.020 A 40 THR CA C 13 61.544 0.400 A 40 THR CB C 13 71.016 0.400 A 40 THR CG2 C 13 21.585 0.400 A 40 THR N N 15 110.743 0.400 A 41 TRP H H 1 8.487 0.020 A 41 TRP HA H 1 4.871 0.020 A 41 TRP HBy H 1 2.850 0.020 A 41 TRP HBx H 1 2.726 0.020 A 41 TRP HD1 H 1 7.107 0.020 A 41 TRP HE1 H 1 9.975 0.020 A 41 TRP HE3 H 1 7.042 0.020 A 41 TRP HH2 H 1 6.938 0.020 A 41 TRP HZ2 H 1 7.444 0.020 A 41 TRP HZ3 H 1 6.793 0.020 A 41 TRP CA C 13 55.678 0.400 A 41 TRP CB C 13 30.357 0.400 A 41 TRP CD1 C 13 127.739 0.400 A 41 TRP CE3 C 13 119.132 0.400 A 41 TRP CH2 C 13 124.537 0.400 A 41 TRP CZ2 C 13 114.909 0.400 A 41 TRP CZ3 C 13 123.101 0.400 A 41 TRP N N 15 120.040 0.400 A 41 TRP NE1 N 15 128.540 0.400 A 42 GLU H H 1 9.361 0.020 A 42 GLU HA H 1 5.171 0.020 A 42 GLU HBx H 1 2.171 0.020 A 42 GLU HBy H 1 2.273 0.020 A 42 GLU HG2 H 1 2.392 0.020 A 42 GLU HG3 H 1 2.392 0.020 A 42 GLU CA C 13 53.190 0.400 A 42 GLU CB C 13 31.656 0.400 A 42 GLU CG C 13 35.987 0.400 A 42 GLU N N 15 126.826 0.400 A 43 PRO HA H 1 4.192 0.020 A 43 PRO HBy H 1 2.325 0.020 A 43 PRO HBx H 1 1.990 0.020 A 43 PRO HDx H 1 3.946 0.020 A 43 PRO HDy H 1 4.269 0.020 A 43 PRO HGy H 1 2.330 0.020 A 43 PRO HGx H 1 2.173 0.020 A 43 PRO CA C 13 65.013 0.400 A 43 PRO CB C 13 32.078 0.400 A 43 PRO CD C 13 51.359 0.400 A 43 PRO CG C 13 28.136 0.400 A 44 PHE H H 1 8.908 0.020 A 44 PHE HA H 1 4.857 0.020 A 44 PHE HBy H 1 3.169 0.020 A 44 PHE HBx H 1 2.632 0.020 A 44 PHE HD1 H 1 7.250 0.020 A 44 PHE HD2 H 1 7.250 0.020 A 44 PHE HE1 H 1 7.250 0.020 A 44 PHE HE2 H 1 7.250 0.020 A 44 PHE HZ H 1 7.250 0.020 A 44 PHE CA C 13 59.305 0.400 A 44 PHE CB C 13 42.769 0.400 A 44 PHE CD1 C 13 131.354 0.400 A 44 PHE N N 15 125.231 0.400 A 45 ALA H H 1 7.967 0.020 A 45 ALA HA H 1 4.554 0.020 A 45 ALA HB% H 1 1.222 0.020 A 45 ALA CA C 13 52.487 0.400 A 45 ALA CB C 13 23.311 0.400 A 45 ALA N N 15 118.836 0.400 A 46 SER H H 1 8.642 0.020 A 46 SER HA H 1 5.120 0.020 A 46 SER HBy H 1 3.914 0.020 A 46 SER HBx H 1 3.680 0.020 A 46 SER CA C 13 57.795 0.400 A 46 SER CB C 13 66.180 0.400 A 46 SER N N 15 113.505 0.400 A 47 GLY H H 1 8.454 0.020 A 47 GLY HAy H 1 4.193 0.020 A 47 GLY HAx H 1 3.917 0.020 A 47 GLY CA C 13 45.841 0.400 A 47 GLY N N 15 106.711 0.400 A 48 LYS H H 1 8.618 0.020 A 48 LYS HA H 1 5.564 0.020 A 48 LYS HB2 H 1 1.528 0.020 A 48 LYS HB3 H 1 1.528 0.020 A 48 LYS HDy H 1 1.580 0.020 A 48 LYS HDx H 1 1.518 0.020 A 48 LYS HE2 H 1 2.924 0.020 A 48 LYS HE3 H 1 2.924 0.020 A 48 LYS HGy H 1 1.334 0.020 A 48 LYS HGx H 1 1.194 0.020 A 48 LYS CA C 13 53.877 0.400 A 48 LYS CB C 13 36.253 0.400 A 48 LYS CD C 13 29.355 0.400 A 48 LYS CE C 13 42.236 0.400 A 48 LYS CG C 13 24.750 0.400 A 48 LYS N N 15 120.308 0.400 A 49 THR H H 1 8.685 0.020 A 49 THR HA H 1 4.006 0.020 A 49 THR HB H 1 4.172 0.020 A 49 THR HG2% H 1 0.988 0.020 A 49 THR CA C 13 62.188 0.400 A 49 THR CB C 13 70.555 0.400 A 49 THR CG2 C 13 23.725 0.400 A 49 THR N N 15 111.544 0.400 A 50 SER H H 1 8.634 0.020 A 50 SER HA H 1 4.737 0.020 A 50 SER HBy H 1 4.462 0.020 A 50 SER HBx H 1 4.195 0.020 A 50 SER CA C 13 57.222 0.400 A 50 SER CB C 13 65.692 0.400 A 50 SER N N 15 118.267 0.400 A 51 GLU H H 1 9.173 0.020 A 51 GLU HA H 1 4.103 0.020 A 51 GLU HB2 H 1 2.140 0.020 A 51 GLU HB3 H 1 2.140 0.020 A 51 GLU HG2 H 1 2.395 0.020 A 51 GLU HG3 H 1 2.395 0.020 A 51 GLU CA C 13 59.301 0.400 A 51 GLU CB C 13 29.134 0.400 A 51 GLU CG C 13 36.456 0.400 A 51 GLU N N 15 118.855 0.400 A 52 SER H H 1 8.168 0.020 A 52 SER HA H 1 4.484 0.020 A 52 SER HBx H 1 3.837 0.020 A 52 SER HBy H 1 4.048 0.020 A 52 SER CA C 13 57.737 0.400 A 52 SER CB C 13 64.030 0.400 A 52 SER N N 15 111.794 0.400 A 53 GLY H H 1 8.572 0.020 A 53 GLY HAy H 1 4.172 0.020 A 53 GLY HAx H 1 3.850 0.020 A 53 GLY CA C 13 45.609 0.400 A 53 GLY N N 15 111.637 0.400 A 54 GLU H H 1 7.298 0.020 A 54 GLU HA H 1 5.195 0.020 A 54 GLU HBy H 1 1.842 0.020 A 54 GLU HBx H 1 1.782 0.020 A 54 GLU CA C 13 54.638 0.400 A 54 GLU CB C 13 33.201 0.400 A 54 GLU N N 15 115.714 0.400 A 55 LEU H H 1 8.647 0.020 A 55 LEU HBy H 1 1.624 0.020 A 55 LEU HBx H 1 1.006 0.020 A 55 LEU HDx% H 1 0.532 0.020 A 55 LEU HDy% H 1 0.849 0.020 A 55 LEU HG H 1 1.332 0.020 A 55 LEU CA C 13 54.395 0.400 A 55 LEU CB C 13 44.373 0.400 A 55 LEU CD1 C 13 26.758 0.400 A 55 LEU CD2 C 13 22.971 0.400 A 55 LEU CG C 13 27.177 0.400 A 55 LEU N N 15 122.971 0.400 A 56 HIS HA H 1 4.960 0.020 A 56 HIS HBy H 1 3.241 0.020 A 56 HIS HBx H 1 3.003 0.020 A 56 HIS HD2 H 1 6.997 0.020 A 56 HIS CA C 13 55.532 0.400 A 56 HIS CB C 13 32.570 0.400 A 56 HIS CD2 C 13 118.400 0.400 A 57 GLY H H 1 8.263 0.020 A 57 GLY HAy H 1 4.092 0.020 A 57 GLY HAx H 1 3.914 0.020 A 57 GLY CA C 13 46.810 0.400 A 57 GLY N N 15 108.292 0.400 A 58 LEU H H 1 8.391 0.020 A 58 LEU HA H 1 3.950 0.020 A 58 LEU HBx H 1 1.057 0.020 A 58 LEU HBy H 1 1.507 0.020 A 58 LEU HDx% H 1 0.589 0.020 A 58 LEU HDy% H 1 0.551 0.020 A 58 LEU HG H 1 1.360 0.020 A 58 LEU CA C 13 57.454 0.400 A 58 LEU CB C 13 43.748 0.400 A 58 LEU CD1 C 13 23.406 0.400 A 58 LEU CD2 C 13 25.100 0.400 A 58 LEU CG C 13 27.281 0.400 A 58 LEU N N 15 119.766 0.400 A 59 THR H H 1 7.357 0.020 A 59 THR HA H 1 4.667 0.020 A 59 THR HB H 1 3.902 0.020 A 59 THR HG2% H 1 0.811 0.020 A 59 THR CA C 13 59.553 0.400 A 59 THR CB C 13 68.431 0.400 A 59 THR N N 15 108.077 0.400 A 60 THR H H 1 8.565 0.020 A 60 THR HA H 1 4.919 0.020 A 60 THR HB H 1 4.624 0.020 A 60 THR HG2% H 1 1.238 0.020 A 60 THR CA C 13 59.508 0.400 A 60 THR CB C 13 72.585 0.400 A 60 THR CG2 C 13 21.676 0.400 A 60 THR N N 15 111.725 0.400 A 61 GLU H H 1 9.115 0.020 A 61 GLU HA H 1 4.103 0.020 A 61 GLU HB2 H 1 2.127 0.020 A 61 GLU HB3 H 1 2.127 0.020 A 61 GLU CA C 13 60.072 0.400 A 61 GLU CB C 13 29.968 0.400 A 61 GLU N N 15 120.990 0.400 A 62 GLU H H 1 8.760 0.020 A 62 GLU HA H 1 4.054 0.020 A 62 GLU HBy H 1 2.080 0.020 A 62 GLU HBx H 1 1.984 0.020 A 62 GLU HGx H 1 2.302 0.020 A 62 GLU HGy H 1 2.417 0.020 A 62 GLU CA C 13 59.416 0.400 A 62 GLU CB C 13 29.511 0.400 A 62 GLU CG C 13 36.962 0.400 A 62 GLU N N 15 116.308 0.400 A 63 GLU H H 1 7.395 0.020 A 63 GLU HA H 1 4.349 0.020 A 63 GLU HBy H 1 2.295 0.020 A 63 GLU HBx H 1 2.117 0.020 A 63 GLU HG2 H 1 2.284 0.020 A 63 GLU HG3 H 1 2.284 0.020 A 63 GLU CA C 13 57.201 0.400 A 63 GLU CB C 13 31.434 0.400 A 63 GLU CG C 13 37.424 0.400 A 63 GLU N N 15 115.675 0.400 A 64 PHE H H 1 7.941 0.020 A 64 PHE HA H 1 5.084 0.020 A 64 PHE HB2 H 1 3.283 0.020 A 64 PHE HB3 H 1 3.283 0.020 A 64 PHE HD1 H 1 7.062 0.020 A 64 PHE HD2 H 1 7.062 0.020 A 64 PHE HE1 H 1 6.339 0.020 A 64 PHE HE2 H 1 6.339 0.020 A 64 PHE CA C 13 55.702 0.400 A 64 PHE CB C 13 37.558 0.400 A 64 PHE CD2 C 13 131.027 0.400 A 64 PHE CE2 C 13 130.681 0.400 A 64 PHE N N 15 123.522 0.400 A 65 VAL H H 1 7.207 0.020 A 65 VAL HA H 1 4.261 0.020 A 65 VAL HB H 1 2.380 0.020 A 65 VAL HGx% H 1 1.015 0.020 A 65 VAL HGy% H 1 0.854 0.020 A 65 VAL CA C 13 60.290 0.400 A 65 VAL CB C 13 33.293 0.400 A 65 VAL CG1 C 13 21.831 0.400 A 65 VAL CG2 C 13 17.863 0.400 A 65 VAL N N 15 116.073 0.400 A 66 GLU H H 1 8.665 0.020 A 66 GLU HA H 1 4.235 0.020 A 66 GLU HBy H 1 2.017 0.020 A 66 GLU HBx H 1 1.893 0.020 A 66 GLU HGy H 1 2.303 0.020 A 66 GLU HGx H 1 2.142 0.020 A 66 GLU CA C 13 57.285 0.400 A 66 GLU CB C 13 29.552 0.400 A 66 GLU CG C 13 36.492 0.400 A 66 GLU N N 15 121.605 0.400 A 67 GLY H H 1 8.054 0.020 A 67 GLY HAx H 1 3.749 0.020 A 67 GLY HAy H 1 3.874 0.020 A 67 GLY CA C 13 45.069 0.400 A 67 GLY N N 15 110.872 0.400 A 68 ILE H H 1 8.387 0.020 A 68 ILE HA H 1 4.442 0.020 A 68 ILE HB H 1 1.348 0.020 A 68 ILE HD1% H 1 0.734 0.020 A 68 ILE HG1y H 1 1.475 0.020 A 68 ILE HG1x H 1 1.033 0.020 A 68 ILE HG2% H 1 0.852 0.020 A 68 ILE CA C 13 61.056 0.400 A 68 ILE CB C 13 39.139 0.400 A 68 ILE CD1 C 13 13.754 0.400 A 68 ILE CG1 C 13 27.854 0.400 A 68 ILE CG2 C 13 18.437 0.400 A 68 ILE N N 15 121.496 0.400 A 69 TYR H H 1 8.802 0.020 A 69 TYR HA H 1 5.336 0.020 A 69 TYR HBx H 1 1.532 0.020 A 69 TYR HBy H 1 2.275 0.020 A 69 TYR HD1 H 1 6.378 0.020 A 69 TYR HD2 H 1 6.378 0.020 A 69 TYR CA C 13 56.487 0.400 A 69 TYR CB C 13 42.561 0.400 A 69 TYR CD1 C 13 132.670 0.400 A 69 TYR N N 15 125.082 0.400 A 70 LYS H H 1 8.738 0.020 A 70 LYS HA H 1 5.316 0.020 A 70 LYS HBx H 1 0.478 0.020 A 70 LYS HBy H 1 0.681 0.020 A 70 LYS HDx H 1 0.541 0.020 A 70 LYS HDy H 1 0.774 0.020 A 70 LYS HEy H 1 1.379 0.020 A 70 LYS HEx H 1 1.023 0.020 A 70 LYS HG2 H 1 0.982 0.020 A 70 LYS HG3 H 1 0.982 0.020 A 70 LYS CA C 13 53.759 0.400 A 70 LYS CB C 13 35.549 0.400 A 70 LYS CD C 13 28.396 0.400 A 70 LYS CE C 13 41.027 0.400 A 70 LYS CG C 13 25.413 0.400 A 70 LYS N N 15 119.070 0.400 A 71 VAL H H 1 9.089 0.020 A 71 VAL HA H 1 4.826 0.020 A 71 VAL HB H 1 1.971 0.020 A 71 VAL HGx% H 1 0.726 0.020 A 71 VAL HGy% H 1 1.049 0.020 A 71 VAL CA C 13 61.357 0.400 A 71 VAL CB C 13 33.316 0.400 A 71 VAL CG1 C 13 21.360 0.400 A 71 VAL CG2 C 13 21.769 0.400 A 71 VAL N N 15 126.394 0.400 A 72 GLU H H 1 9.590 0.020 A 72 GLU HA H 1 5.309 0.020 A 72 GLU HBx H 1 2.000 0.020 A 72 GLU HBy H 1 2.259 0.020 A 72 GLU HGy H 1 2.253 0.020 A 72 GLU HGx H 1 2.163 0.020 A 72 GLU CA C 13 54.397 0.400 A 72 GLU CB C 13 34.226 0.400 A 72 GLU CG C 13 36.846 0.400 A 72 GLU N N 15 126.877 0.400 A 73 ILE H H 1 9.001 0.020 A 73 ILE HA H 1 4.901 0.020 A 73 ILE HB H 1 1.643 0.020 A 73 ILE HD1% H 1 0.517 0.020 A 73 ILE HG1y H 1 1.375 0.020 A 73 ILE HG1x H 1 1.026 0.020 A 73 ILE HG2% H 1 0.623 0.020 A 73 ILE CA C 13 59.450 0.400 A 73 ILE CB C 13 40.241 0.400 A 73 ILE CD1 C 13 13.483 0.400 A 73 ILE CG1 C 13 27.252 0.400 A 73 ILE CG2 C 13 17.998 0.400 A 73 ILE N N 15 121.544 0.400 A 74 ASP H H 1 8.471 0.020 A 74 ASP HA H 1 5.152 0.020 A 74 ASP HBy H 1 3.182 0.020 A 74 ASP HBx H 1 2.839 0.020 A 74 ASP CA C 13 53.193 0.400 A 74 ASP CB C 13 40.977 0.400 A 74 ASP N N 15 125.292 0.400 A 75 THR H H 1 8.317 0.020 A 75 THR HA H 1 4.139 0.020 A 75 THR HB H 1 4.540 0.020 A 75 THR HG2% H 1 1.181 0.020 A 75 THR CA C 13 63.134 0.400 A 75 THR CB C 13 67.831 0.400 A 75 THR CG2 C 13 23.892 0.400 A 75 THR N N 15 116.795 0.400 A 76 LYS H H 1 8.355 0.020 A 76 LYS HA H 1 4.114 0.020 A 76 LYS HB2 H 1 2.087 0.020 A 76 LYS HB3 H 1 2.087 0.020 A 76 LYS HD2 H 1 1.792 0.020 A 76 LYS HD3 H 1 1.792 0.020 A 76 LYS HE2 H 1 3.040 0.020 A 76 LYS HE3 H 1 3.040 0.020 A 76 LYS HGy H 1 1.569 0.020 A 76 LYS HGx H 1 1.475 0.020 A 76 LYS CA C 13 61.157 0.400 A 76 LYS CB C 13 32.660 0.400 A 76 LYS CD C 13 29.506 0.400 A 76 LYS CE C 13 41.982 0.400 A 76 LYS CG C 13 25.036 0.400 A 76 LYS N N 15 123.971 0.400 A 77 SER H H 1 8.633 0.020 A 77 SER HA H 1 4.177 0.020 A 77 SER HB2 H 1 3.898 0.020 A 77 SER HB3 H 1 3.898 0.020 A 77 SER CA C 13 61.853 0.400 A 77 SER CB C 13 62.392 0.400 A 77 SER N N 15 113.535 0.400 A 78 TYR H H 1 7.321 0.020 A 78 TYR HA H 1 4.084 0.020 A 78 TYR HBx H 1 2.383 0.020 A 78 TYR HBy H 1 2.846 0.020 A 78 TYR HD1 H 1 5.802 0.020 A 78 TYR HD2 H 1 5.802 0.020 A 78 TYR HE1 H 1 5.802 0.020 A 78 TYR HE2 H 1 5.802 0.020 A 78 TYR CA C 13 61.048 0.400 A 78 TYR CB C 13 38.121 0.400 A 78 TYR N N 15 122.963 0.400 A 79 TRP H H 1 7.862 0.020 A 79 TRP HA H 1 4.407 0.020 A 79 TRP HBx H 1 2.927 0.020 A 79 TRP HBy H 1 3.444 0.020 A 79 TRP HD1 H 1 7.311 0.020 A 79 TRP HE1 H 1 9.708 0.020 A 79 TRP HE3 H 1 7.425 0.020 A 79 TRP HH2 H 1 7.323 0.020 A 79 TRP HZ2 H 1 7.001 0.020 A 79 TRP HZ3 H 1 7.162 0.020 A 79 TRP CA C 13 59.092 0.400 A 79 TRP CB C 13 29.376 0.400 A 79 TRP CD1 C 13 129.158 0.400 A 79 TRP CE3 C 13 122.126 0.400 A 79 TRP CH2 C 13 125.296 0.400 A 79 TRP CZ2 C 13 113.561 0.400 A 79 TRP CZ3 C 13 122.451 0.400 A 79 TRP N N 15 116.750 0.400 A 79 TRP NE1 N 15 125.554 0.400 A 80 LYS H H 1 8.471 0.020 A 80 LYS HA H 1 4.225 0.020 A 80 LYS HBy H 1 2.044 0.020 A 80 LYS HBx H 1 1.872 0.020 A 80 LYS HD2 H 1 1.730 0.020 A 80 LYS HD3 H 1 1.730 0.020 A 80 LYS HE2 H 1 3.004 0.020 A 80 LYS HE3 H 1 3.004 0.020 A 80 LYS HGy H 1 1.590 0.020 A 80 LYS HGx H 1 1.536 0.020 A 80 LYS CA C 13 59.591 0.400 A 80 LYS CB C 13 31.975 0.400 A 80 LYS CD C 13 29.219 0.400 A 80 LYS CE C 13 42.085 0.400 A 80 LYS CG C 13 25.102 0.400 A 80 LYS N N 15 119.582 0.400 A 81 ALA H H 1 7.403 0.020 A 81 ALA HA H 1 4.188 0.020 A 81 ALA HB% H 1 1.461 0.020 A 81 ALA CA C 13 54.497 0.400 A 81 ALA CB C 13 17.956 0.400 A 81 ALA N N 15 121.444 0.400 A 82 LEU H H 1 7.249 0.020 A 82 LEU HA H 1 4.373 0.020 A 82 LEU HBy H 1 1.811 0.020 A 82 LEU HBx H 1 1.782 0.020 A 82 LEU HDx% H 1 0.743 0.020 A 82 LEU HDy% H 1 0.511 0.020 A 82 LEU HG H 1 1.402 0.020 A 82 LEU CA C 13 54.564 0.400 A 82 LEU CB C 13 42.998 0.400 A 82 LEU CD1 C 13 22.724 0.400 A 82 LEU CD2 C 13 25.427 0.400 A 82 LEU CG C 13 27.047 0.400 A 82 LEU N N 15 117.234 0.400 A 83 GLY H H 1 7.974 0.020 A 83 GLY HAx H 1 3.839 0.020 A 83 GLY HAy H 1 4.115 0.020 A 83 GLY CA C 13 45.908 0.400 A 83 GLY N N 15 107.999 0.400 A 84 ILE H H 1 7.850 0.020 A 84 ILE HA H 1 4.212 0.020 A 84 ILE HB H 1 1.796 0.020 A 84 ILE HD1% H 1 0.872 0.020 A 84 ILE HG1y H 1 1.486 0.020 A 84 ILE HG1x H 1 1.057 0.020 A 84 ILE HG2% H 1 0.400 0.020 A 84 ILE CA C 13 59.764 0.400 A 84 ILE CB C 13 41.625 0.400 A 84 ILE CD1 C 13 13.528 0.400 A 84 ILE CG1 C 13 27.879 0.400 A 84 ILE CG2 C 13 16.708 0.400 A 84 ILE N N 15 121.903 0.400 A 85 SER H H 1 8.524 0.020 A 85 SER HA H 1 4.203 0.020 A 85 SER HBy H 1 3.886 0.020 A 85 SER HBx H 1 3.736 0.020 A 85 SER CA C 13 60.490 0.400 A 85 SER CB C 13 62.948 0.400 A 85 SER N N 15 122.858 0.400 A 86 PRO CA C 13 61.774 0.400 A 86 PRO CB C 13 32.561 0.400 A 87 MET H H 1 7.880 0.020 A 87 MET HA H 1 4.086 0.020 A 87 MET HBy H 1 1.811 0.020 A 87 MET HBx H 1 1.547 0.020 A 87 MET HE% H 1 1.956 0.020 A 87 MET HGy H 1 2.321 0.020 A 87 MET HGx H 1 2.123 0.020 A 87 MET CA C 13 57.342 0.400 A 87 MET CB C 13 32.942 0.400 A 87 MET CE C 13 17.196 0.400 A 87 MET CG C 13 32.014 0.400 A 87 MET N N 15 119.221 0.400 A 88 HIS H H 1 8.106 0.020 A 88 HIS HA H 1 4.882 0.020 A 88 HIS HBy H 1 3.252 0.020 A 88 HIS HBx H 1 2.959 0.020 A 88 HIS CA C 13 54.855 0.400 A 88 HIS CB C 13 32.083 0.400 A 88 HIS N N 15 115.687 0.400 A 89 GLU H H 1 8.742 0.020 A 89 GLU CA C 13 57.514 0.400 A 89 GLU CB C 13 30.892 0.400 A 89 GLU N N 15 121.001 0.400 A 90 HIS H H 1 8.134 0.020 A 90 HIS HA H 1 5.432 0.020 A 90 HIS HBx H 1 3.259 0.020 A 90 HIS HBy H 1 3.320 0.020 A 90 HIS HD2 H 1 7.161 0.020 A 90 HIS CA C 13 55.049 0.400 A 90 HIS CB C 13 31.809 0.400 A 90 HIS CD2 C 13 119.794 0.400 A 90 HIS N N 15 116.870 0.400 A 91 ALA H H 1 8.450 0.020 A 91 ALA HA H 1 4.733 0.020 A 91 ALA HB% H 1 1.307 0.020 A 91 ALA CA C 13 51.536 0.400 A 91 ALA CB C 13 21.727 0.400 A 91 ALA N N 15 125.156 0.400 A 92 GLU H H 1 8.449 0.020 A 92 GLU HA H 1 5.805 0.020 A 92 GLU HBy H 1 2.012 0.020 A 92 GLU HBx H 1 1.696 0.020 A 92 GLU HGy H 1 2.133 0.020 A 92 GLU HGx H 1 1.887 0.020 A 92 GLU CA C 13 54.527 0.400 A 92 GLU CB C 13 34.456 0.400 A 92 GLU CG C 13 35.178 0.400 A 92 GLU N N 15 117.886 0.400 A 93 VAL H H 1 8.547 0.020 A 93 VAL HA H 1 4.642 0.020 A 93 VAL HB H 1 2.105 0.020 A 93 VAL HGx% H 1 1.076 0.020 A 93 VAL HGy% H 1 0.849 0.020 A 93 VAL CA C 13 60.661 0.400 A 93 VAL CB C 13 35.063 0.400 A 93 VAL CG1 C 13 21.985 0.400 A 93 VAL CG2 C 13 20.344 0.400 A 93 VAL N N 15 118.383 0.400 A 94 VAL H H 1 8.319 0.020 A 94 VAL HA H 1 5.324 0.020 A 94 VAL HB H 1 1.945 0.020 A 94 VAL HGx% H 1 1.051 0.020 A 94 VAL HGy% H 1 0.870 0.020 A 94 VAL CA C 13 60.742 0.400 A 94 VAL CB C 13 34.295 0.400 A 94 VAL CG1 C 13 21.711 0.400 A 94 VAL CG2 C 13 21.586 0.400 A 94 VAL N N 15 127.591 0.400 A 95 PHE H H 1 9.402 0.020 A 95 PHE HA H 1 5.148 0.020 A 95 PHE HB2 H 1 3.097 0.020 A 95 PHE HB3 H 1 3.097 0.020 A 95 PHE HD1 H 1 6.785 0.020 A 95 PHE HD2 H 1 6.785 0.020 A 95 PHE HE1 H 1 6.426 0.020 A 95 PHE HE2 H 1 6.426 0.020 A 95 PHE HZ H 1 6.534 0.020 A 95 PHE CA C 13 55.897 0.400 A 95 PHE CB C 13 41.663 0.400 A 95 PHE CD2 C 13 132.529 0.400 A 95 PHE CE2 C 13 129.796 0.400 A 95 PHE CZ C 13 127.573 0.400 A 95 PHE N N 15 124.354 0.400 A 96 THR H H 1 8.587 0.020 A 96 THR HA H 1 4.668 0.020 A 96 THR HB H 1 4.042 0.020 A 96 THR HG2% H 1 1.102 0.020 A 96 THR CA C 13 62.001 0.400 A 96 THR CB C 13 69.670 0.400 A 96 THR CG2 C 13 21.696 0.400 A 96 THR N N 15 116.688 0.400 A 97 ALA H H 1 9.099 0.020 A 97 ALA HA H 1 4.868 0.020 A 97 ALA HB% H 1 0.846 0.020 A 97 ALA CA C 13 50.289 0.400 A 97 ALA N N 15 129.726 0.400 A 99 ASP H H 1 8.887 0.020 A 99 ASP HA H 1 4.547 0.020 A 99 ASP HBy H 1 2.715 0.020 A 99 ASP HBx H 1 2.601 0.020 A 99 ASP CA C 13 54.835 0.400 A 99 ASP CB C 13 40.718 0.400 A 99 ASP N N 15 117.982 0.400 A 100 SER H H 1 8.568 0.020 A 100 SER HA H 1 4.612 0.020 A 100 SER HB2 H 1 3.904 0.020 A 100 SER HB3 H 1 3.904 0.020 A 100 SER CA C 13 57.692 0.400 A 100 SER CB C 13 63.571 0.400 A 100 SER N N 15 116.347 0.400 A 101 GLY H H 1 7.703 0.020 A 101 GLY HAy H 1 4.303 0.020 A 101 GLY HAx H 1 3.990 0.020 A 101 GLY CA C 13 44.182 0.400 A 101 GLY N N 15 110.610 0.400 A 102 PRO HD2 H 1 3.625 0.020 A 102 PRO HD3 H 1 3.625 0.020 A 102 PRO CD C 13 49.782 0.400 A 105 TYR HA H 1 4.965 0.020 A 105 TYR HBy H 1 2.681 0.020 A 105 TYR HBx H 1 2.322 0.020 A 105 TYR HD1 H 1 6.946 0.020 A 105 TYR HD2 H 1 6.946 0.020 A 105 TYR HE1 H 1 6.946 0.020 A 105 TYR HE2 H 1 6.946 0.020 A 105 TYR CA C 13 57.573 0.400 A 105 TYR CB C 13 42.120 0.400 A 106 THR H H 1 9.055 0.020 A 106 THR HA H 1 4.951 0.020 A 106 THR HB H 1 3.837 0.020 A 106 THR HG2% H 1 0.935 0.020 A 106 THR CA C 13 61.483 0.400 A 106 THR CB C 13 70.812 0.400 A 106 THR CG2 C 13 20.993 0.400 A 106 THR N N 15 120.187 0.400 A 107 ILE H H 1 8.950 0.020 A 107 ILE HA H 1 4.872 0.020 A 107 ILE HB H 1 1.925 0.020 A 107 ILE HD1% H 1 0.416 0.020 A 107 ILE HG1x H 1 1.105 0.020 A 107 ILE HG1y H 1 1.226 0.020 A 107 ILE HG2% H 1 0.639 0.020 A 107 ILE CA C 13 58.833 0.400 A 107 ILE CB C 13 37.542 0.400 A 107 ILE CD1 C 13 13.104 0.400 A 107 ILE CG1 C 13 29.027 0.400 A 107 ILE CG2 C 13 18.304 0.400 A 107 ILE N N 15 128.167 0.400 A 108 ALA H H 1 8.884 0.020 A 108 ALA HA H 1 5.299 0.020 A 108 ALA HB% H 1 1.216 0.020 A 108 ALA CA C 13 50.015 0.400 A 108 ALA CB C 13 20.624 0.400 A 108 ALA N N 15 130.707 0.400 A 109 ALA H H 1 8.891 0.020 A 109 ALA HA H 1 5.442 0.020 A 109 ALA HB% H 1 1.188 0.020 A 109 ALA CA C 13 49.986 0.400 A 109 ALA CB C 13 23.638 0.400 A 109 ALA N N 15 126.097 0.400 A 110 MET H H 1 8.786 0.020 A 110 MET HA H 1 5.092 0.020 A 110 MET HBy H 1 2.195 0.020 A 110 MET HBx H 1 1.894 0.020 A 110 MET HE% H 1 2.002 0.020 A 110 MET HGy H 1 2.469 0.020 A 110 MET HGx H 1 2.198 0.020 A 110 MET CA C 13 53.806 0.400 A 110 MET CB C 13 33.092 0.400 A 110 MET CE C 13 17.086 0.400 A 110 MET CG C 13 32.234 0.400 A 110 MET N N 15 122.719 0.400 A 111 LEU H H 1 9.326 0.020 A 111 LEU HA H 1 4.758 0.020 A 111 LEU HBy H 1 1.848 0.020 A 111 LEU HBx H 1 1.630 0.020 A 111 LEU HDx% H 1 0.560 0.020 A 111 LEU HDy% H 1 0.094 0.020 A 111 LEU HG H 1 1.512 0.020 A 111 LEU CA C 13 54.372 0.400 A 111 LEU CB C 13 43.456 0.400 A 111 LEU CD1 C 13 21.969 0.400 A 111 LEU CD2 C 13 25.588 0.400 A 111 LEU CG C 13 26.363 0.400 A 111 LEU N N 15 122.593 0.400 A 112 SER H H 1 8.633 0.020 A 112 SER HA H 1 5.095 0.020 A 112 SER HBy H 1 3.775 0.020 A 112 SER HBx H 1 3.635 0.020 A 112 SER CA C 13 54.219 0.400 A 112 SER CB C 13 65.918 0.400 A 112 SER N N 15 116.273 0.400 A 113 PRO HA H 1 3.337 0.020 A 113 PRO HBx H 1 0.096 0.020 A 113 PRO HBy H 1 0.485 0.020 A 113 PRO HDy H 1 3.409 0.020 A 113 PRO HDx H 1 3.385 0.020 A 113 PRO HG2 H 1 2.036 0.020 A 113 PRO HG3 H 1 2.036 0.020 A 113 PRO CA C 13 63.535 0.400 A 113 PRO CB C 13 30.227 0.400 A 113 PRO CD C 13 49.396 0.400 A 113 PRO CG C 13 26.529 0.400 A 114 TYR H H 1 7.570 0.020 A 114 TYR HA H 1 4.813 0.020 A 114 TYR HBy H 1 3.345 0.020 A 114 TYR HBx H 1 2.647 0.020 A 114 TYR HD1 H 1 6.977 0.020 A 114 TYR HD2 H 1 6.977 0.020 A 114 TYR HE1 H 1 6.739 0.020 A 114 TYR HE2 H 1 6.739 0.020 A 114 TYR CA C 13 56.270 0.400 A 114 TYR CB C 13 39.119 0.400 A 114 TYR CD1 C 13 132.733 0.400 A 114 TYR CE1 C 13 118.062 0.400 A 114 TYR N N 15 117.176 0.400 A 115 SER H H 1 7.385 0.020 A 115 SER HA H 1 4.628 0.020 A 115 SER HBy H 1 3.860 0.020 A 115 SER HBx H 1 3.817 0.020 A 115 SER CA C 13 56.687 0.400 A 115 SER CB C 13 64.508 0.400 A 115 SER N N 15 113.072 0.400 A 116 TYR H H 1 8.215 0.020 A 116 TYR HA H 1 4.328 0.020 A 116 TYR HBy H 1 3.036 0.020 A 116 TYR HBx H 1 2.760 0.020 A 116 TYR HD1 H 1 7.016 0.020 A 116 TYR HD2 H 1 7.016 0.020 A 116 TYR HE1 H 1 6.791 0.020 A 116 TYR HE2 H 1 6.791 0.020 A 116 TYR CA C 13 59.303 0.400 A 116 TYR CB C 13 38.433 0.400 A 116 TYR CD2 C 13 133.124 0.400 A 116 TYR CE2 C 13 118.194 0.400 A 116 TYR N N 15 120.367 0.400 A 117 SER CA C 13 60.107 0.400 A 117 SER CB C 13 63.394 0.400 A 118 THR H H 1 8.265 0.020 A 118 THR HA H 1 4.521 0.020 A 118 THR HB H 1 4.154 0.020 A 118 THR HG2% H 1 1.246 0.020 A 118 THR CA C 13 61.850 0.400 A 118 THR CB C 13 70.442 0.400 A 118 THR CG2 C 13 21.643 0.400 A 118 THR N N 15 117.489 0.400 A 119 MET H H 1 8.537 0.020 A 119 MET HA H 1 4.887 0.020 A 119 MET HBy H 1 1.894 0.020 A 119 MET HBx H 1 1.582 0.020 A 119 MET HE% H 1 1.684 0.020 A 119 MET CA C 13 54.329 0.400 A 119 MET CB C 13 35.892 0.400 A 119 MET CE C 13 17.067 0.400 A 119 MET N N 15 122.708 0.400 A 120 ALA H H 1 8.676 0.020 A 120 ALA HA H 1 4.730 0.020 A 120 ALA HB% H 1 1.354 0.020 A 120 ALA CA C 13 51.062 0.400 A 120 ALA CB C 13 22.084 0.400 A 120 ALA N N 15 125.367 0.400 A 121 VAL H H 1 8.554 0.020 A 121 VAL HA H 1 4.402 0.020 A 121 VAL HB H 1 1.930 0.020 A 121 VAL HGx% H 1 0.502 0.020 A 121 VAL HGy% H 1 0.608 0.020 A 121 VAL CA C 13 61.836 0.400 A 121 VAL CB C 13 32.487 0.400 A 121 VAL CG1 C 13 20.705 0.400 A 121 VAL CG2 C 13 21.010 0.400 A 121 VAL N N 15 121.632 0.400 A 122 VAL H H 1 9.243 0.020 A 122 VAL HA H 1 4.395 0.020 A 122 VAL HB H 1 2.014 0.020 A 122 VAL HGx% H 1 0.864 0.020 A 122 VAL HGy% H 1 0.842 0.020 A 122 VAL CA C 13 61.364 0.400 A 122 VAL CB C 13 34.228 0.400 A 122 VAL CG1 C 13 21.126 0.400 A 122 VAL CG2 C 13 20.637 0.400 A 122 VAL N N 15 129.745 0.400 A 123 THR HB H 1 3.915 0.020 A 123 THR HG2% H 1 0.956 0.020 A 123 THR CB C 13 70.033 0.400 A 123 THR CG2 C 13 21.599 0.400 A 124 ASN HA H 1 4.932 0.020 A 124 ASN HBy H 1 2.732 0.020 A 124 ASN HBx H 1 2.422 0.020 A 124 ASN HD2y H 1 7.435 0.020 A 124 ASN HD2x H 1 6.780 0.020 A 124 ASN CA C 13 51.607 0.400 A 124 ASN CB C 13 39.710 0.400 A 124 ASN ND2 N 15 112.657 0.400 A 125 PRO HA H 1 4.416 0.020 A 125 PRO HBy H 1 2.280 0.020 A 125 PRO HBx H 1 1.943 0.020 A 125 PRO HDy H 1 3.730 0.020 A 125 PRO HDx H 1 3.632 0.020 A 125 PRO CA C 13 63.095 0.400 A 125 PRO CB C 13 32.158 0.400 A 125 PRO CD C 13 50.646 0.400 A 126 LYS H H 1 8.365 0.020 A 126 LYS HA H 1 4.143 0.020 A 126 LYS HBy H 1 1.813 0.020 A 126 LYS HBx H 1 1.667 0.020 A 126 LYS HD2 H 1 1.668 0.020 A 126 LYS HD3 H 1 1.668 0.020 A 126 LYS HE2 H 1 2.975 0.020 A 126 LYS HE3 H 1 2.975 0.020 A 126 LYS HG2 H 1 1.394 0.020 A 126 LYS HG3 H 1 1.394 0.020 A 126 LYS CA C 13 57.056 0.400 A 126 LYS CB C 13 32.976 0.400 A 126 LYS CD C 13 29.248 0.400 A 126 LYS CE C 13 42.143 0.400 A 126 LYS CG C 13 25.073 0.400 A 126 LYS N N 15 121.712 0.400 A 127 GLU H H 1 7.928 0.020 A 127 GLU HA H 1 4.098 0.020 A 127 GLU HBy H 1 2.019 0.020 A 127 GLU HBx H 1 1.862 0.020 A 127 GLU HG2 H 1 2.154 0.020 A 127 GLU HG3 H 1 2.154 0.020 A 127 GLU CA C 13 57.921 0.400 A 127 GLU CB C 13 31.264 0.400 A 127 GLU CG C 13 36.593 0.400 A 127 GLU N N 15 127.099 0.400 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 118 THR HA A 118 THR HG2% 1.0 . 3.74 2 2 A 21 ARG H A 21 ARG HBy 1.0 . 3.73 3 3 A 43 PRO HBx A 44 PHE H 1.0 . 4.23 4 4 A 125 PRO HBx A 127 GLU H 1.0 . 4.91 5 5 A 124 ASN HA A 125 PRO HDx 1.0 . 3.53 6 6 A 102 PRO HD3 A 101 GLY HAy 1.0 . 3.42 7 6 A 101 GLY HAy A 102 PRO HD2 1.0 . 3.42 8 7 A 3 THR HA A 3 THR HG2% 1.0 . 2.75 9 8 A 5 THR HA A 5 THR HG2% 1.0 . 3.09 10 9 A 5 THR HB A 6 GLY H 1.0 . 4.55 11 10 A 75 THR HG2% A 111 LEU HDx% 1.0 . 2.93 12 11 A 75 THR HG2% A 111 LEU HDy% 1.0 . 3.32 13 12 A 60 THR HG2% A 61 GLU H 1.0 . 3.78 14 13 A 108 ALA H A 108 ALA HB% 1.0 . 3.11 15 14 A 60 THR HG2% A 60 THR H 1.0 . 3.47 16 15 A 118 THR HG2% A 119 MET H 1.0 . 3.72 17 16 A 47 GLY HAx A 48 LYS HGx 1.0 . 5.49 18 17 A 7 GLU HA A 7 GLU HBy 1.0 . 3.00 19 18 A 7 GLU HA A 7 GLU HBx 1.0 . 3.00 20 19 A 20 VAL HGx% A 21 ARG HA 1.0 . 3.60 21 20 A 7 GLU HA A 7 GLU HG2 1.0 . 3.45 22 20 A 7 GLU HA A 7 GLU HG3 1.0 . 3.45 23 21 A 7 GLU HG3 A 7 GLU HBy 1.0 . 2.49 24 21 A 7 GLU HBy A 7 GLU HG2 1.0 . 2.49 25 22 A 8 SER HA A 8 SER HB2 1.0 . 2.58 26 22 A 8 SER HA A 8 SER HB3 1.0 . 2.58 27 23 A 44 PHE HD% A 34 ARG HDx 1.0 . 4.51 28 23 A 34 ARG HDx A 44 PHE HE% 1.0 . 4.51 29 24 A 17 LEU H A 110 MET HA 1.0 . 4.01 30 25 A 12 LEU H A 12 LEU HDy% 1.0 . 4.63 31 26 A 12 LEU H A 12 LEU HDx% 1.0 . 4.63 32 27 A 46 SER HA A 58 LEU HDx% 1.0 . 4.23 33 28 A 36 ALA H A 42 GLU HG2 1.0 . 4.31 34 28 A 36 ALA H A 42 GLU HG3 1.0 . 4.31 35 29 A 42 GLU HA A 42 GLU HG2 1.0 . 3.23 36 29 A 42 GLU HG3 A 42 GLU HA 1.0 . 3.23 37 30 A 53 GLY H A 51 GLU HG2 1.0 . 4.84 38 30 A 51 GLU HG3 A 53 GLY H 1.0 . 4.84 39 31 A 93 VAL HA A 94 VAL HB 1.0 . 4.78 40 32 A 93 VAL HA A 92 GLU HBx 1.0 . 5.17 41 33 A 93 VAL HA A 93 VAL HGx% 1.0 . 3.20 42 34 A 93 VAL HA A 93 VAL HGy% 1.0 . 3.35 43 35 A 106 THR H A 122 VAL HB 1.0 . 4.70 44 36 A 16 VAL H A 16 VAL HGy% 1.0 . 3.19 45 37 A 32 VAL H A 71 VAL HGx% 1.0 . 5.41 46 38 A 16 VAL H A 16 VAL HGx% 1.0 . 4.05 47 39 A 17 LEU H A 16 VAL HGx% 1.0 . 3.41 48 40 A 16 VAL HGx% A 28 VAL H 1.0 . 5.29 49 41 A 16 VAL HGx% A 25 ALA H 1.0 . 4.49 50 42 A 111 LEU HDy% A 16 VAL HGx% 1.0 . 2.98 51 43 A 110 MET HA A 17 LEU HBx 1.0 . 4.75 52 44 A 17 LEU HBx A 24 PRO HA 1.0 . 4.69 53 45 A 110 MET HA A 17 LEU HBy 1.0 . 4.47 54 46 A 17 LEU HBy A 16 VAL HA 1.0 . 4.42 55 47 A 17 LEU HBy A 15 LYS HG2 1.0 . 4.51 56 47 A 17 LEU HBy A 15 LYS HG3 1.0 . 4.51 57 48 A 17 LEU H A 17 LEU HG 1.0 . 4.54 58 49 A 18 ASP HA A 111 LEU H 1.0 . 3.91 59 50 A 18 ASP HBx A 21 ARG HBx 1.0 . 4.55 60 51 A 18 ASP HBx A 25 ALA HB% 1.0 . 4.99 61 52 A 81 ALA HA A 83 GLY H 1.0 . 4.76 62 53 A 19 ALA H A 19 ALA HB% 1.0 . 3.00 63 54 A 36 ALA HB% A 35 LYS HD2 1.0 . 3.93 64 54 A 35 LYS HD3 A 36 ALA HB% 1.0 . 3.93 65 55 A 29 ALA HB% A 48 LYS HA 1.0 . 4.64 66 56 A 29 ALA HB% A 74 ASP HA 1.0 . 5.12 67 57 A 110 MET HA A 19 ALA HB% 1.0 . 4.41 68 58 A 29 ALA HB% A 73 ILE HA 1.0 . 5.32 69 59 A 36 ALA HB% A 37 ALA HA 1.0 . 4.20 70 60 A 29 ALA HB% A 28 VAL HA 1.0 . 4.10 71 61 A 36 ALA HB% A 35 LYS HA 1.0 . 4.07 72 62 A 29 ALA HB% A 48 LYS HE2 1.0 . 3.27 73 62 A 29 ALA HB% A 48 LYS HE3 1.0 . 3.27 74 63 A 36 ALA H A 36 ALA HB% 1.0 . 2.83 75 64 A 29 ALA HB% A 29 ALA H 1.0 . 3.05 76 65 A 36 ALA HB% A 37 ALA H 1.0 . 2.93 77 66 A 29 ALA HB% A 30 VAL H 1.0 . 3.71 78 67 A 36 ALA HB% A 38 ASP H 1.0 . 3.19 79 68 A 20 VAL HGx% A 20 VAL HA 1.0 . 2.80 80 69 A 19 ALA HB% A 20 VAL HA 1.0 . 4.25 81 70 A 20 VAL HB A 79 TRP HH2 1.0 . 4.72 82 71 A 69 TYR H A 94 VAL HGx% 1.0 . 3.43 83 72 A 94 VAL HGx% A 41 TRP HH2 1.0 . 3.35 84 73 A 93 VAL HGx% A 95 PHE HD% 1.0 . 4.07 85 74 A 71 VAL HGy% A 95 PHE HE% 1.0 . 3.72 86 75 A 93 VAL HGx% A 95 PHE HE% 1.0 . 4.09 87 76 A 65 VAL H A 65 VAL HGx% 1.0 . 3.02 88 77 A 18 ASP H A 21 ARG HD2 1.0 . 5.50 89 77 A 18 ASP H A 21 ARG HD3 1.0 . 5.50 90 78 A 20 VAL H A 21 ARG HD2 1.0 . 5.50 91 78 A 21 ARG HD3 A 20 VAL H 1.0 . 5.50 92 79 A 21 ARG H A 21 ARG HD2 1.0 . 4.12 93 79 A 21 ARG H A 21 ARG HD3 1.0 . 4.12 94 80 A 23 SER HA A 24 PRO HDy 1.0 . 2.95 95 81 A 23 SER HA A 24 PRO HDx 1.0 . 2.84 96 82 A 23 SER HA A 24 PRO HBx 1.0 . 4.97 97 83 A 31 HIS HA A 32 VAL HGy% 1.0 . 3.79 98 84 A 23 SER HA A 17 LEU HDx% 1.0 . 4.90 99 85 A 23 SER H A 23 SER HBy 1.0 . 4.06 100 86 A 25 ALA H A 24 PRO HA 1.0 . 3.34 101 87 A 24 PRO HA A 18 ASP HBy 1.0 . 4.75 102 88 A 24 PRO HA A 17 LEU HDx% 1.0 . 3.73 103 89 A 24 PRO HA A 17 LEU HDy% 1.0 . 3.73 104 90 A 125 PRO HDy A 124 ASN HBy 1.0 . 4.64 105 91 A 124 ASN HBy A 125 PRO HDx 1.0 . 4.64 106 92 A 38 ASP H A 36 ALA HA 1.0 . 4.20 107 93 A 37 ALA HA A 36 ALA HA 1.0 . 4.45 108 94 A 25 ALA HA A 26 ILE HA 1.0 . 4.90 109 95 A 36 ALA HA A 42 GLU HG2 1.0 . 4.39 110 95 A 42 GLU HG3 A 36 ALA HA 1.0 . 4.39 111 96 A 25 ALA HA A 26 ILE HB 1.0 . 4.46 112 97 A 25 ALA HB% A 17 LEU HA 1.0 . 4.37 113 98 A 25 ALA HB% A 26 ILE HA 1.0 . 4.66 114 99 A 17 LEU H A 25 ALA HB% 1.0 . 5.11 115 100 A 25 ALA HB% A 78 TYR HBx 1.0 . 4.43 116 101 A 25 ALA HB% A 16 VAL HB 1.0 . 3.76 117 102 A 26 ILE HA A 26 ILE HG1x 1.0 . 3.93 118 103 A 26 ILE HA A 26 ILE HD1% 1.0 . 3.79 119 104 A 26 ILE HA A 28 VAL HGy% 1.0 . 4.62 120 105 A 26 ILE HB A 51 GLU HB2 1.0 . 5.50 121 105 A 26 ILE HB A 51 GLU HB3 1.0 . 5.50 122 106 A 26 ILE HB A 51 GLU HA 1.0 . 4.74 123 107 A 65 VAL H A 65 VAL HGy% 1.0 . 2.84 124 108 A 26 ILE HA A 26 ILE HG2% 1.0 . 3.03 125 109 A 65 VAL HGy% A 64 PHE HA 1.0 . 4.02 126 110 A 28 VAL H A 26 ILE HG2% 1.0 . 4.48 127 111 A 26 ILE HG2% A 26 ILE H 1.0 . 3.85 128 112 A 26 ILE HG2% A 27 ASN H 1.0 . 3.40 129 113 A 65 VAL HGy% A 66 GLU H 1.0 . 3.45 130 114 A 26 ILE HG2% A 27 ASN HBx 1.0 . 3.18 131 115 A 65 VAL HGy% A 34 ARG HDx 1.0 . 4.34 132 116 A 65 VAL HGy% A 34 ARG HDy 1.0 . 4.34 133 117 A 27 ASN H A 27 ASN HBy 1.0 . 4.15 134 118 A 27 ASN HBy A 48 LYS HE2 1.0 . 4.69 135 118 A 48 LYS HE3 A 27 ASN HBy 1.0 . 4.69 136 119 A 27 ASN HBy A 48 LYS HDx 1.0 . 3.54 137 120 A 27 ASN HBy A 48 LYS HGy 1.0 . 4.79 138 121 A 26 ILE HG2% A 27 ASN HBy 1.0 . 3.84 139 122 A 28 VAL H A 27 ASN HBx 1.0 . 4.43 140 123 A 27 ASN H A 27 ASN HBx 1.0 . 3.87 141 124 A 26 ILE HA A 27 ASN HBx 1.0 . 4.72 142 125 A 9 LYS H A 9 LYS HBx 1.0 . 3.75 143 126 A 25 ALA HA A 28 VAL HGy% 1.0 . 4.32 144 127 A 28 VAL HGy% A 27 ASN HA 1.0 . 4.74 145 128 A 28 VAL HGy% A 49 THR HB 1.0 . 3.97 146 129 A 28 VAL HA A 28 VAL HGy% 1.0 . 3.32 147 130 A 28 VAL HGy% A 78 TYR HBy 1.0 . 4.92 148 131 A 78 TYR HBx A 28 VAL HGy% 1.0 . 4.23 149 132 A 16 VAL HB A 28 VAL HGy% 1.0 . 4.14 150 133 A 28 VAL HGy% A 49 THR HG2% 1.0 . 3.56 151 134 A 29 ALA H A 28 VAL HGy% 1.0 . 4.26 152 135 A 25 ALA H A 28 VAL HGy% 1.0 . 4.93 153 136 A 28 VAL HGy% A 26 ILE H 1.0 . 5.22 154 137 A 28 VAL HGy% A 27 ASN H 1.0 . 4.29 155 138 A 28 VAL HGy% A 78 TYR H 1.0 . 4.50 156 139 A 28 VAL HGy% A 78 TYR HE% 1.0 . 4.61 157 139 A 28 VAL HGy% A 78 TYR HD% 1.0 . 4.61 158 140 A 30 VAL HA A 30 VAL HGx% 1.0 . 3.07 159 141 A 121 VAL HA A 121 VAL HGy% 1.0 . 3.83 160 142 A 111 LEU HDx% A 111 LEU H 1.0 . 3.65 161 143 A 28 VAL HGx% A 74 ASP HBx 1.0 . 5.50 162 144 A 111 LEU HDx% A 109 ALA HB% 1.0 . 3.59 163 145 A 16 VAL HGy% A 49 THR HG2% 1.0 . 2.63 164 146 A 48 LYS HA A 29 ALA HA 1.0 . 3.67 165 147 A 46 SER HA A 45 ALA HA 1.0 . 4.74 166 148 A 28 VAL HA A 29 ALA HA 1.0 . 4.49 167 149 A 49 THR HG2% A 29 ALA HA 1.0 . 5.50 168 150 A 32 VAL HGy% A 45 ALA HA 1.0 . 5.06 169 151 A 45 ALA HA A 44 PHE HE% 1.0 . 4.97 170 151 A 44 PHE HD% A 45 ALA HA 1.0 . 4.97 171 152 A 71 VAL H A 94 VAL HA 1.0 . 4.26 172 153 A 69 TYR H A 94 VAL HA 1.0 . 4.83 173 154 A 95 PHE HD% A 94 VAL HA 1.0 . 4.53 174 155 A 94 VAL HA A 70 LYS HBy 1.0 . 4.97 175 156 A 94 VAL HA A 70 LYS HBx 1.0 . 4.77 176 157 A 29 ALA H A 30 VAL HA 1.0 . 5.50 177 158 A 73 ILE HA A 30 VAL HA 1.0 . 3.84 178 159 A 32 VAL HGy% A 30 VAL HB 1.0 . 4.50 179 160 A 16 VAL H A 15 LYS HBx 1.0 . 4.68 180 161 A 30 VAL H A 30 VAL HGy% 1.0 . 3.05 181 162 A 14 VAL HGx% A 15 LYS H 1.0 . 3.01 182 163 A 14 VAL H A 14 VAL HGy% 1.0 . 3.99 183 164 A 14 VAL HGx% A 14 VAL HA 1.0 . 3.25 184 165 A 14 VAL HGy% A 14 VAL HA 1.0 . 3.47 185 166 A 30 VAL HA A 30 VAL HGy% 1.0 . 2.94 186 167 A 56 HIS HA A 56 HIS HD2 1.0 . 4.51 187 168 A 31 HIS HBy A 72 GLU HBy 1.0 . 4.55 188 169 A 30 VAL HGx% A 31 HIS HBy 1.0 . 4.83 189 170 A 32 VAL HA A 70 LYS H 1.0 . 4.70 190 171 A 32 VAL HA A 33 PHE HE% 1.0 . 5.05 191 172 A 32 VAL HA A 44 PHE HE% 1.0 . 5.50 192 172 A 44 PHE HD% A 32 VAL HA 1.0 . 5.50 193 173 A 32 VAL HA A 70 LYS HA 1.0 . 5.50 194 174 A 32 VAL HA A 71 VAL HA 1.0 . 4.09 195 175 A 71 VAL HGy% A 32 VAL HA 1.0 . 4.12 196 176 A 71 VAL HGx% A 32 VAL HA 1.0 . 4.20 197 177 A 94 VAL HGy% A 95 PHE H 1.0 . 4.21 198 178 A 45 ALA HB% A 44 PHE HE% 1.0 . 3.16 199 178 A 44 PHE HD% A 45 ALA HB% 1.0 . 3.16 200 179 A 32 VAL HGx% A 44 PHE HE% 1.0 . 3.21 201 179 A 44 PHE HD% A 32 VAL HGx% 1.0 . 3.21 202 180 A 32 VAL HA A 32 VAL HGx% 1.0 . 3.26 203 181 A 60 THR HG2% A 60 THR HA 1.0 . 2.96 204 182 A 45 ALA HB% A 58 LEU HA 1.0 . 3.43 205 183 A 3 THR HG2% A 2 PRO HGy 1.0 . 3.31 206 184 A 32 VAL HGx% A 44 PHE HBx 1.0 . 3.91 207 185 A 33 PHE HE% A 33 PHE HA 1.0 . 5.02 208 186 A 33 PHE HA A 44 PHE HE% 1.0 . 5.35 209 186 A 44 PHE HD% A 33 PHE HA 1.0 . 5.35 210 187 A 33 PHE HA A 33 PHE HD% 1.0 . 4.10 211 188 A 41 TRP HZ3 A 69 TYR HA 1.0 . 4.00 212 189 A 69 TYR HA A 69 TYR HD% 1.0 . 4.13 213 190 A 33 PHE HA A 44 PHE HA 1.0 . 4.58 214 191 A 33 PHE HA A 42 GLU HBy 1.0 . 5.50 215 192 A 32 VAL HGx% A 69 TYR HA 1.0 . 4.97 216 193 A 69 TYR HA A 34 ARG HG2 1.0 . 5.42 217 193 A 69 TYR HA A 34 ARG HG3 1.0 . 5.42 218 194 A 69 TYR HA A 34 ARG HBx 1.0 . 5.49 219 195 A 94 VAL HGx% A 69 TYR HA 1.0 . 5.50 220 196 A 69 TYR HA A 68 ILE HG2% 1.0 . 4.07 221 197 A 70 LYS HBy A 69 TYR HA 1.0 . 4.66 222 198 A 32 VAL HGx% A 33 PHE HA 1.0 . 4.49 223 199 A 70 LYS HBy A 33 PHE HBx 1.0 . 4.50 224 200 A 33 PHE HBx A 41 TRP HE3 1.0 . 4.31 225 201 A 33 PHE HBy A 41 TRP HBy 1.0 . 4.31 226 202 A 33 PHE HBy A 41 TRP HBx 1.0 . 4.41 227 203 A 18 ASP HBx A 21 ARG HD2 1.0 . 4.54 228 203 A 18 ASP HBx A 21 ARG HD3 1.0 . 4.54 229 204 A 44 PHE HD% A 34 ARG HDy 1.0 . 4.51 230 204 A 34 ARG HDy A 44 PHE HE% 1.0 . 4.51 231 205 A 48 LYS H A 48 LYS HE2 1.0 . 4.84 232 205 A 48 LYS HE3 A 48 LYS H 1.0 . 4.84 233 206 A 34 ARG HA A 34 ARG HG2 1.0 . 4.10 234 206 A 34 ARG HG3 A 34 ARG HA 1.0 . 4.10 235 207 A 35 LYS HA A 41 TRP HZ3 1.0 . 4.76 236 208 A 35 LYS HA A 35 LYS HD2 1.0 . 3.48 237 208 A 35 LYS HD3 A 35 LYS HA 1.0 . 3.48 238 209 A 35 LYS HA A 35 LYS HG2 1.0 . 3.80 239 209 A 35 LYS HA A 35 LYS HG3 1.0 . 3.80 240 210 A 35 LYS HA A 41 TRP HA 1.0 . 3.87 241 211 A 35 LYS HA A 36 ALA HA 1.0 . 4.56 242 212 A 41 TRP HZ3 A 35 LYS HBx 1.0 . 4.48 243 213 A 34 ARG HA A 35 LYS HBx 1.0 . 4.72 244 214 A 35 LYS HBx A 35 LYS HE2 1.0 . 4.36 245 214 A 35 LYS HBx A 35 LYS HE3 1.0 . 4.36 246 215 A 35 LYS HBx A 68 ILE HB 1.0 . 3.84 247 216 A 35 LYS HBx A 35 LYS HD2 1.0 . 3.43 248 216 A 35 LYS HD3 A 35 LYS HBx 1.0 . 3.43 249 217 A 41 TRP HZ3 A 35 LYS HBy 1.0 . 4.77 250 218 A 36 ALA H A 35 LYS HBy 1.0 . 4.59 251 219 A 35 LYS HD2 A 35 LYS HG2 1.0 . 2.80 252 219 A 35 LYS HD3 A 35 LYS HG2 1.0 . 2.80 253 219 A 35 LYS HG3 A 35 LYS HD2 1.0 . 2.80 254 219 A 35 LYS HD3 A 35 LYS HG3 1.0 . 2.80 255 220 A 41 TRP H A 35 LYS HD2 1.0 . 5.30 256 220 A 35 LYS HD3 A 41 TRP H 1.0 . 5.30 257 221 A 41 TRP HZ2 A 35 LYS HD2 1.0 . 5.11 258 221 A 35 LYS HD3 A 41 TRP HZ2 1.0 . 5.11 259 222 A 41 TRP HH2 A 35 LYS HD2 1.0 . 5.05 260 222 A 35 LYS HD3 A 41 TRP HH2 1.0 . 5.05 261 223 A 41 TRP HZ3 A 35 LYS HD2 1.0 . 4.96 262 223 A 35 LYS HD3 A 41 TRP HZ3 1.0 . 4.96 263 224 A 36 ALA HA A 35 LYS HD2 1.0 . 4.49 264 224 A 35 LYS HD3 A 36 ALA HA 1.0 . 4.49 265 225 A 35 LYS HD3 A 39 ASP HB2 1.0 . 4.15 266 225 A 35 LYS HD2 A 39 ASP HB2 1.0 . 4.15 267 225 A 39 ASP HB3 A 35 LYS HD2 1.0 . 4.15 268 225 A 35 LYS HD3 A 39 ASP HB3 1.0 . 4.15 269 226 A 35 LYS HBy A 35 LYS HD2 1.0 . 3.13 270 226 A 35 LYS HD3 A 35 LYS HBy 1.0 . 3.13 271 227 A 41 TRP HZ2 A 35 LYS HE2 1.0 . 3.78 272 227 A 35 LYS HE3 A 41 TRP HZ2 1.0 . 3.78 273 228 A 41 TRP HD1 A 35 LYS HE2 1.0 . 5.42 274 228 A 35 LYS HE3 A 41 TRP HD1 1.0 . 5.42 275 229 A 41 TRP HH2 A 35 LYS HE2 1.0 . 4.15 276 229 A 41 TRP HH2 A 35 LYS HE3 1.0 . 4.15 277 230 A 39 ASP HA A 35 LYS HE2 1.0 . 3.61 278 230 A 35 LYS HE3 A 39 ASP HA 1.0 . 3.61 279 231 A 35 LYS HA A 35 LYS HE2 1.0 . 4.21 280 231 A 35 LYS HA A 35 LYS HE3 1.0 . 4.21 281 232 A 35 LYS HE3 A 39 ASP HB2 1.0 . 3.85 282 232 A 35 LYS HE2 A 39 ASP HB2 1.0 . 3.85 283 232 A 39 ASP HB3 A 35 LYS HE2 1.0 . 3.85 284 232 A 35 LYS HE3 A 39 ASP HB3 1.0 . 3.85 285 233 A 35 LYS HBy A 35 LYS HE2 1.0 . 3.40 286 233 A 35 LYS HE3 A 35 LYS HBy 1.0 . 3.40 287 234 A 35 LYS HD3 A 35 LYS HE2 1.0 . 2.76 288 234 A 35 LYS HD2 A 35 LYS HE2 1.0 . 2.76 289 234 A 35 LYS HE3 A 35 LYS HD2 1.0 . 2.76 290 234 A 35 LYS HD3 A 35 LYS HE3 1.0 . 2.76 291 235 A 68 ILE HD1% A 35 LYS HE2 1.0 . 3.74 292 235 A 35 LYS HE3 A 68 ILE HD1% 1.0 . 3.74 293 236 A 35 LYS HE2 A 35 LYS HG2 1.0 . 3.59 294 236 A 35 LYS HE3 A 35 LYS HG2 1.0 . 3.59 295 236 A 35 LYS HG3 A 35 LYS HE2 1.0 . 3.59 296 236 A 35 LYS HG3 A 35 LYS HE3 1.0 . 3.59 297 237 A 81 ALA HA A 80 LYS H 1.0 . 5.01 298 238 A 37 ALA HA A 38 ASP H 1.0 . 3.35 299 239 A 37 ALA HB% A 39 ASP H 1.0 . 4.60 300 240 A 38 ASP H A 37 ALA HB% 1.0 . 3.33 301 241 A 39 ASP H A 38 ASP HBy 1.0 . 4.55 302 242 A 40 THR HG2% A 38 ASP HBx 1.0 . 4.34 303 243 A 37 ALA HA A 38 ASP HA 1.0 . 4.74 304 244 A 38 ASP HA A 39 ASP HB2 1.0 . 4.04 305 244 A 39 ASP HB3 A 38 ASP HA 1.0 . 4.04 306 245 A 37 ALA HB% A 38 ASP HA 1.0 . 4.24 307 246 A 40 THR HG2% A 38 ASP HA 1.0 . 4.41 308 247 A 38 ASP H A 39 ASP HA 1.0 . 4.79 309 248 A 36 ALA H A 39 ASP HA 1.0 . 5.00 310 249 A 39 ASP HA A 38 ASP HA 1.0 . 5.11 311 250 A 36 ALA HB% A 39 ASP HA 1.0 . 4.90 312 251 A 39 ASP HA A 35 LYS HD2 1.0 . 3.21 313 251 A 35 LYS HD3 A 39 ASP HA 1.0 . 3.21 314 252 A 39 ASP HA A 35 LYS HG2 1.0 . 3.96 315 252 A 35 LYS HG3 A 39 ASP HA 1.0 . 3.96 316 253 A 40 THR HA A 39 ASP HB2 1.0 . 4.28 317 253 A 39 ASP HB3 A 40 THR HA 1.0 . 4.28 318 254 A 39 ASP HA A 39 ASP HB2 1.0 . 2.83 319 254 A 39 ASP HB3 A 39 ASP HA 1.0 . 2.83 320 255 A 38 ASP H A 39 ASP HB2 1.0 . 5.27 321 255 A 38 ASP H A 39 ASP HB3 1.0 . 5.27 322 256 A 40 THR H A 39 ASP HB2 1.0 . 3.84 323 256 A 39 ASP HB3 A 40 THR H 1.0 . 3.84 324 257 A 85 SER H A 85 SER HA 1.0 . 2.93 325 258 A 40 THR HG2% A 40 THR HA 1.0 . 2.86 326 259 A 77 SER HA A 76 LYS HB2 1.0 . 4.63 327 259 A 76 LYS HB3 A 77 SER HA 1.0 . 4.63 328 260 A 77 SER HA A 80 LYS HBx 1.0 . 3.71 329 261 A 40 THR H A 40 THR HB 1.0 . 4.01 330 262 A 41 TRP H A 40 THR HB 1.0 . 3.20 331 263 A 41 TRP HBy A 40 THR HB 1.0 . 4.84 332 264 A 36 ALA HB% A 40 THR HB 1.0 . 4.16 333 265 A 40 THR HG2% A 38 ASP HBy 1.0 . 4.34 334 266 A 96 THR HA A 96 THR HG2% 1.0 . 3.52 335 267 A 41 TRP HBy A 40 THR HA 1.0 . 4.72 336 268 A 42 GLU HBy A 42 GLU H 1.0 . 3.64 337 269 A 51 GLU H A 51 GLU HG2 1.0 . 3.07 338 269 A 51 GLU HG3 A 51 GLU H 1.0 . 3.07 339 270 A 62 GLU H A 62 GLU HGy 1.0 . 3.45 340 271 A 52 SER H A 51 GLU HG2 1.0 . 3.60 341 271 A 51 GLU HG3 A 52 SER H 1.0 . 3.60 342 272 A 33 PHE HD% A 42 GLU HG2 1.0 . 5.11 343 272 A 42 GLU HG3 A 33 PHE HD% 1.0 . 5.11 344 273 A 60 THR HB A 62 GLU HGy 1.0 . 4.24 345 274 A 43 PRO HDy A 42 GLU HG2 1.0 . 3.52 346 274 A 42 GLU HG3 A 43 PRO HDy 1.0 . 3.52 347 275 A 51 GLU HA A 51 GLU HG2 1.0 . 3.36 348 275 A 51 GLU HG3 A 51 GLU HA 1.0 . 3.36 349 276 A 43 PRO HDx A 42 GLU HG2 1.0 . 3.30 350 276 A 42 GLU HG3 A 43 PRO HDx 1.0 . 3.30 351 277 A 52 SER HBx A 51 GLU HG2 1.0 . 3.87 352 277 A 51 GLU HG3 A 52 SER HBx 1.0 . 3.87 353 278 A 51 GLU HB2 A 51 GLU HG2 1.0 . 2.40 354 278 A 51 GLU HB3 A 51 GLU HG2 1.0 . 2.40 355 278 A 51 GLU HG3 A 51 GLU HB2 1.0 . 2.40 356 278 A 51 GLU HG3 A 51 GLU HB3 1.0 . 2.40 357 279 A 36 ALA HB% A 42 GLU HG2 1.0 . 2.98 358 279 A 42 GLU HG3 A 36 ALA HB% 1.0 . 2.98 359 280 A 26 ILE HD1% A 51 GLU HG2 1.0 . 3.50 360 280 A 51 GLU HG3 A 26 ILE HD1% 1.0 . 3.50 361 281 A 50 SER H A 50 SER HBx 1.0 . 4.17 362 282 A 43 PRO HA A 45 ALA H 1.0 . 4.19 363 283 A 33 PHE HE% A 43 PRO HA 1.0 . 4.13 364 284 A 33 PHE HD% A 43 PRO HA 1.0 . 3.79 365 285 A 33 PHE HA A 43 PRO HA 1.0 . 3.92 366 286 A 43 PRO HA A 44 PHE HBy 1.0 . 4.65 367 287 A 44 PHE HBx A 43 PRO HA 1.0 . 4.89 368 288 A 44 PHE H A 43 PRO HBy 1.0 . 3.92 369 289 A 33 PHE HE% A 43 PRO HBy 1.0 . 4.76 370 290 A 33 PHE HD% A 43 PRO HBy 1.0 . 5.02 371 291 A 33 PHE HA A 43 PRO HBy 1.0 . 5.50 372 292 A 3 THR HG2% A 2 PRO HBy 1.0 . 3.64 373 293 A 43 PRO HBx A 42 GLU HA 1.0 . 4.89 374 294 A 43 PRO HBx A 33 PHE HE% 1.0 . 4.36 375 295 A 33 PHE HE% A 43 PRO HGx 1.0 . 4.70 376 296 A 33 PHE HE% A 43 PRO HGy 1.0 . 5.49 377 297 A 33 PHE HD% A 43 PRO HGy 1.0 . 5.45 378 298 A 33 PHE HD% A 43 PRO HGx 1.0 . 5.34 379 299 A 42 GLU HA A 43 PRO HGy 1.0 . 4.71 380 300 A 42 GLU HA A 43 PRO HGx 1.0 . 4.59 381 301 A 108 ALA H A 107 ILE HA 1.0 . 3.38 382 302 A 44 PHE HA A 44 PHE HE% 1.0 . 3.33 383 302 A 44 PHE HD% A 44 PHE HA 1.0 . 3.33 384 303 A 44 PHE HBx A 33 PHE HA 1.0 . 4.42 385 304 A 33 PHE HA A 44 PHE HBy 1.0 . 4.42 386 305 A 32 VAL HGy% A 44 PHE HBx 1.0 . 4.64 387 306 A 32 VAL HGx% A 44 PHE HBy 1.0 . 3.81 388 307 A 15 LYS HBx A 15 LYS HG2 1.0 . 2.80 389 307 A 15 LYS HG3 A 15 LYS HBx 1.0 . 2.80 390 308 A 48 LYS HGx A 48 LYS HB2 1.0 . 2.98 391 308 A 48 LYS HGx A 48 LYS HB3 1.0 . 2.98 392 309 A 46 SER H A 46 SER HBy 1.0 . 3.83 393 310 A 46 SER HBy A 47 GLY H 1.0 . 3.66 394 311 A 2 PRO HD3 A 1 GLY HAy 1.0 . 2.74 395 311 A 1 GLY HAy A 2 PRO HD2 1.0 . 2.74 396 312 A 24 PRO HBx A 53 GLY HAy 1.0 . 3.85 397 313 A 48 LYS HGy A 47 GLY HAy 1.0 . 5.09 398 314 A 48 LYS HGx A 47 GLY HAy 1.0 . 4.58 399 315 A 47 GLY HAy A 55 LEU HDx% 1.0 . 4.04 400 316 A 47 GLY HAx A 55 LEU HDx% 1.0 . 3.74 401 317 A 47 GLY HAx A 30 VAL HB 1.0 . 5.34 402 318 A 47 GLY HAx A 48 LYS HB2 1.0 . 5.50 403 318 A 47 GLY HAx A 48 LYS HB3 1.0 . 5.50 404 319 A 47 GLY HAx A 55 LEU HG 1.0 . 4.78 405 320 A 47 GLY HAx A 58 LEU HG 1.0 . 5.19 406 321 A 47 GLY HAx A 48 LYS HA 1.0 . 4.51 407 322 A 48 LYS HA A 28 VAL HB 1.0 . 4.80 408 323 A 48 LYS HA A 48 LYS HGy 1.0 . 3.91 409 324 A 48 LYS HGx A 48 LYS HA 1.0 . 3.88 410 325 A 48 LYS HA A 49 THR HG2% 1.0 . 4.03 411 326 A 48 LYS HA A 30 VAL HGy% 1.0 . 4.02 412 327 A 48 LYS HA A 28 VAL HGx% 1.0 . 4.62 413 328 A 27 ASN HBy A 48 LYS HB2 1.0 . 4.79 414 328 A 27 ASN HBy A 48 LYS HB3 1.0 . 4.79 415 329 A 48 LYS HB2 A 48 LYS HE2 1.0 . 4.10 416 329 A 48 LYS HB3 A 48 LYS HE2 1.0 . 4.10 417 329 A 48 LYS HE3 A 48 LYS HB2 1.0 . 4.10 418 329 A 48 LYS HE3 A 48 LYS HB3 1.0 . 4.10 419 330 A 27 ASN HBx A 48 LYS HB2 1.0 . 5.07 420 330 A 27 ASN HBx A 48 LYS HB3 1.0 . 5.07 421 331 A 15 LYS HBx A 13 MET HB2 1.0 . 4.84 422 331 A 15 LYS HBx A 13 MET HB3 1.0 . 4.84 423 332 A 15 LYS HBx A 13 MET HE% 1.0 . 3.86 424 333 A 48 LYS HGy A 48 LYS H 1.0 . 4.11 425 334 A 30 VAL H A 48 LYS HGy 1.0 . 3.92 426 335 A 48 LYS H A 48 LYS HDy 1.0 . 4.36 427 336 A 48 LYS HA A 48 LYS HDy 1.0 . 4.75 428 337 A 48 LYS HA A 48 LYS HDx 1.0 . 4.65 429 338 A 27 ASN HA A 48 LYS HDy 1.0 . 3.94 430 339 A 48 LYS HDx A 27 ASN HA 1.0 . 4.00 431 340 A 15 LYS HA A 15 LYS HD2 1.0 . 4.26 432 340 A 15 LYS HA A 15 LYS HD3 1.0 . 4.26 433 341 A 48 LYS HDy A 48 LYS HE2 1.0 . 3.01 434 341 A 48 LYS HE3 A 48 LYS HDy 1.0 . 3.01 435 342 A 15 LYS HD3 A 15 LYS HG2 1.0 . 2.80 436 342 A 15 LYS HD2 A 15 LYS HG2 1.0 . 2.80 437 342 A 15 LYS HG3 A 15 LYS HD2 1.0 . 2.80 438 342 A 15 LYS HG3 A 15 LYS HD3 1.0 . 2.80 439 343 A 48 LYS HA A 48 LYS HE2 1.0 . 4.99 440 343 A 48 LYS HA A 48 LYS HE3 1.0 . 4.99 441 344 A 29 ALA HA A 48 LYS HE2 1.0 . 4.32 442 344 A 48 LYS HE3 A 29 ALA HA 1.0 . 4.32 443 345 A 27 ASN HA A 48 LYS HE2 1.0 . 5.15 444 345 A 48 LYS HE3 A 27 ASN HA 1.0 . 5.15 445 346 A 48 LYS HDx A 48 LYS HE2 1.0 . 2.40 446 346 A 48 LYS HE3 A 48 LYS HDx 1.0 . 2.40 447 347 A 48 LYS HGy A 48 LYS HE2 1.0 . 2.84 448 347 A 48 LYS HE3 A 48 LYS HGy 1.0 . 2.84 449 348 A 48 LYS HGx A 48 LYS HE2 1.0 . 2.92 450 348 A 48 LYS HGx A 48 LYS HE3 1.0 . 2.92 451 349 A 49 THR HA A 54 GLU H 1.0 . 5.43 452 350 A 55 LEU HG A 49 THR HA 1.0 . 5.35 453 351 A 110 MET H A 118 THR HB 1.0 . 4.43 454 352 A 16 VAL HGy% A 49 THR HB 1.0 . 4.35 455 353 A 118 THR HB A 110 MET HGy 1.0 . 4.64 456 354 A 118 THR HB A 110 MET HBy 1.0 . 4.04 457 355 A 118 THR HB A 110 MET HBx 1.0 . 4.14 458 356 A 49 THR HB A 28 VAL HB 1.0 . 4.64 459 357 A 16 VAL H A 49 THR HG2% 1.0 . 4.04 460 358 A 27 ASN H A 49 THR HG2% 1.0 . 5.05 461 359 A 49 THR HG2% A 15 LYS HA 1.0 . 4.37 462 360 A 49 THR HG2% A 49 THR HA 1.0 . 3.35 463 361 A 16 VAL HB A 49 THR HG2% 1.0 . 3.48 464 362 A 49 THR HG2% A 28 VAL HB 1.0 . 3.25 465 363 A 53 GLY H A 51 GLU HA 1.0 . 4.38 466 364 A 52 SER H A 51 GLU HB2 1.0 . 3.90 467 364 A 51 GLU HB3 A 52 SER H 1.0 . 3.90 468 365 A 23 SER HA A 24 PRO HGy 1.0 . 4.65 469 366 A 60 THR HA A 61 GLU HB2 1.0 . 4.50 470 366 A 60 THR HA A 61 GLU HB3 1.0 . 4.50 471 367 A 60 THR HB A 61 GLU HB2 1.0 . 4.11 472 367 A 60 THR HB A 61 GLU HB3 1.0 . 4.11 473 368 A 26 ILE HG2% A 51 GLU HB2 1.0 . 4.28 474 368 A 51 GLU HB3 A 26 ILE HG2% 1.0 . 4.28 475 369 A 52 SER HA A 51 GLU HG2 1.0 . 4.38 476 369 A 51 GLU HG3 A 52 SER HA 1.0 . 4.38 477 370 A 24 PRO HGy A 52 SER HA 1.0 . 3.66 478 371 A 52 SER HA A 24 PRO HGx 1.0 . 3.64 479 372 A 24 PRO HBx A 52 SER HA 1.0 . 4.35 480 373 A 52 SER H A 52 SER HBy 1.0 . 4.12 481 374 A 52 SER HBy A 51 GLU HG2 1.0 . 5.29 482 374 A 51 GLU HG3 A 52 SER HBy 1.0 . 5.29 483 375 A 52 SER HBx A 51 GLU HB2 1.0 . 5.34 484 375 A 51 GLU HB3 A 52 SER HBx 1.0 . 5.34 485 376 A 52 SER H A 53 GLY HAy 1.0 . 4.59 486 377 A 69 TYR HD% A 67 GLY HAy 1.0 . 5.41 487 378 A 2 PRO HD3 A 1 GLY HAx 1.0 . 2.74 488 378 A 1 GLY HAx A 2 PRO HD2 1.0 . 2.74 489 379 A 24 PRO HBx A 53 GLY HAx 1.0 . 3.99 490 380 A 49 THR HG2% A 53 GLY HAx 1.0 . 4.45 491 381 A 54 GLU HA A 15 LYS HD2 1.0 . 4.60 492 381 A 15 LYS HD3 A 54 GLU HA 1.0 . 4.60 493 382 A 49 THR HG2% A 54 GLU HA 1.0 . 4.26 494 383 A 18 ASP HA A 111 LEU HBx 1.0 . 4.55 495 384 A 55 LEU HBy A 55 LEU HDy% 1.0 . 3.92 496 385 A 55 LEU HBy A 55 LEU HDx% 1.0 . 3.92 497 386 A 55 LEU HBx A 55 LEU HDy% 1.0 . 3.92 498 387 A 55 LEU HDx% A 55 LEU HBx 1.0 . 3.92 499 388 A 56 HIS HA A 55 LEU HG 1.0 . 4.71 500 389 A 58 LEU HA A 58 LEU HG 1.0 . 3.88 501 390 A 47 GLY HAy A 55 LEU HDy% 1.0 . 4.04 502 391 A 47 GLY HAx A 55 LEU HDy% 1.0 . 3.74 503 392 A 108 ALA H A 120 ALA HB% 1.0 . 3.67 504 393 A 120 ALA HB% A 120 ALA H 1.0 . 3.55 505 394 A 120 ALA HB% A 121 VAL H 1.0 . 3.55 506 395 A 83 GLY HAy A 84 ILE HD1% 1.0 . 4.71 507 396 A 31 HIS HA A 46 SER H 1.0 . 5.15 508 397 A 30 VAL HA A 73 ILE HG1y 1.0 . 4.43 509 398 A 46 SER H A 58 LEU HDy% 1.0 . 4.19 510 399 A 58 LEU H A 58 LEU HDy% 1.0 . 4.30 511 400 A 83 GLY H A 82 LEU HDy% 1.0 . 4.45 512 401 A 46 SER HA A 58 LEU HDy% 1.0 . 4.23 513 402 A 32 VAL HB A 58 LEU HDy% 1.0 . 4.67 514 403 A 58 LEU HBy A 58 LEU HDy% 1.0 . 3.45 515 404 A 32 VAL HB A 58 LEU HDx% 1.0 . 4.67 516 405 A 59 THR HA A 63 GLU HG2 1.0 . 4.62 517 405 A 59 THR HA A 63 GLU HG3 1.0 . 4.62 518 406 A 60 THR HG2% A 59 THR HA 1.0 . 3.63 519 407 A 59 THR H A 59 THR HB 1.0 . 4.17 520 408 A 61 GLU H A 60 THR HA 1.0 . 3.53 521 409 A 60 THR HA A 59 THR HG2% 1.0 . 5.43 522 410 A 83 GLY H A 80 LYS HA 1.0 . 3.76 523 411 A 60 THR HB A 61 GLU HA 1.0 . 4.82 524 412 A 60 THR HB A 63 GLU HBx 1.0 . 5.50 525 413 A 60 THR HA A 61 GLU HA 1.0 . 4.59 526 414 A 61 GLU HA A 64 PHE HB2 1.0 . 4.37 527 414 A 61 GLU HA A 64 PHE HB3 1.0 . 4.37 528 415 A 51 GLU HA A 51 GLU HB2 1.0 . 2.75 529 415 A 51 GLU HB3 A 51 GLU HA 1.0 . 2.75 530 416 A 76 LYS HA A 76 LYS HD2 1.0 . 4.54 531 416 A 76 LYS HA A 76 LYS HD3 1.0 . 4.54 532 417 A 60 THR HG2% A 61 GLU HA 1.0 . 5.50 533 418 A 62 GLU H A 62 GLU HGx 1.0 . 3.45 534 419 A 60 THR H A 63 GLU HG2 1.0 . 4.01 535 419 A 60 THR H A 63 GLU HG3 1.0 . 4.01 536 420 A 60 THR HB A 62 GLU HGx 1.0 . 4.24 537 421 A 63 GLU HG2 A 64 PHE HB2 1.0 . 4.70 538 421 A 63 GLU HG3 A 64 PHE HB2 1.0 . 4.70 539 421 A 64 PHE HB3 A 63 GLU HG2 1.0 . 4.70 540 421 A 63 GLU HG3 A 64 PHE HB3 1.0 . 4.70 541 422 A 127 GLU HA A 127 GLU HG2 1.0 . 3.36 542 422 A 127 GLU HA A 127 GLU HG3 1.0 . 3.36 543 423 A 60 THR H A 63 GLU HA 1.0 . 5.38 544 424 A 65 VAL HGx% A 63 GLU HA 1.0 . 4.20 545 425 A 64 PHE H A 63 GLU HBy 1.0 . 4.33 546 426 A 60 THR H A 63 GLU HBy 1.0 . 3.92 547 427 A 127 GLU H A 126 LYS HA 1.0 . 3.55 548 428 A 63 GLU HA A 63 GLU HG2 1.0 . 3.24 549 428 A 63 GLU HG3 A 63 GLU HA 1.0 . 3.24 550 429 A 59 THR HG2% A 64 PHE HB2 1.0 . 4.77 551 429 A 59 THR HG2% A 64 PHE HB3 1.0 . 4.77 552 430 A 65 VAL HGy% A 65 VAL HA 1.0 . 3.23 553 431 A 65 VAL HGx% A 65 VAL HA 1.0 . 2.78 554 432 A 65 VAL HGx% A 66 GLU H 1.0 . 3.54 555 433 A 65 VAL HGx% A 64 PHE HA 1.0 . 4.34 556 434 A 94 VAL HGx% A 68 ILE HG2% 1.0 . 2.62 557 435 A 41 TRP HH2 A 68 ILE HG2% 1.0 . 3.16 558 436 A 41 TRP HZ3 A 68 ILE HG2% 1.0 . 3.46 559 437 A 94 VAL HA A 68 ILE HG2% 1.0 . 4.75 560 438 A 68 ILE HG2% A 68 ILE HA 1.0 . 3.42 561 439 A 68 ILE HG2% A 41 TRP HZ2 1.0 . 3.94 562 440 A 69 TYR H A 68 ILE HG2% 1.0 . 3.33 563 441 A 68 ILE HG2% A 35 LYS HG2 1.0 . 4.47 564 441 A 68 ILE HG2% A 35 LYS HG3 1.0 . 4.47 565 442 A 66 GLU HA A 66 GLU HGy 1.0 . 3.82 566 443 A 66 GLU HA A 97 ALA HB% 1.0 . 4.71 567 444 A 66 GLU H A 66 GLU HBx 1.0 . 3.71 568 445 A 66 GLU HA A 66 GLU HGx 1.0 . 3.82 569 446 A 65 VAL HGx% A 63 GLU HG2 1.0 . 4.81 570 446 A 65 VAL HGx% A 63 GLU HG3 1.0 . 4.81 571 447 A 59 THR HG2% A 63 GLU HG2 1.0 . 4.10 572 447 A 63 GLU HG3 A 59 THR HG2% 1.0 . 4.10 573 448 A 68 ILE HA A 67 GLY HAx 1.0 . 4.78 574 449 A 67 GLY HAx A 68 ILE HG1y 1.0 . 5.50 575 450 A 68 ILE HB A 67 GLY HAx 1.0 . 5.39 576 451 A 67 GLY HAx A 68 ILE HG1x 1.0 . 4.70 577 452 A 97 ALA HB% A 67 GLY HAx 1.0 . 4.35 578 453 A 24 PRO HGx A 53 GLY HAx 1.0 . 4.44 579 454 A 68 ILE HA A 68 ILE HG1y 1.0 . 3.89 580 455 A 68 ILE HA A 68 ILE HG1x 1.0 . 3.62 581 456 A 96 THR HA A 68 ILE HA 1.0 . 3.76 582 457 A 69 TYR HD% A 68 ILE HA 1.0 . 4.48 583 458 A 68 ILE HB A 35 LYS HE2 1.0 . 4.55 584 458 A 35 LYS HE3 A 68 ILE HB 1.0 . 4.55 585 459 A 68 ILE HB A 67 GLY HAy 1.0 . 5.35 586 460 A 35 LYS HA A 68 ILE HB 1.0 . 4.58 587 461 A 69 TYR H A 68 ILE HB 1.0 . 4.94 588 462 A 68 ILE HB A 68 ILE HD1% 1.0 . 2.96 589 463 A 68 ILE HG2% A 68 ILE HD1% 1.0 . 3.16 590 464 A 68 ILE HD1% A 35 LYS HG2 1.0 . 4.07 591 464 A 35 LYS HG3 A 68 ILE HD1% 1.0 . 4.07 592 465 A 68 ILE HD1% A 96 THR HA 1.0 . 4.34 593 466 A 68 ILE HD1% A 68 ILE HA 1.0 . 3.82 594 467 A 68 ILE HD1% A 67 GLY HAy 1.0 . 4.43 595 468 A 68 ILE HD1% A 67 GLY HAx 1.0 . 4.69 596 469 A 41 TRP HH2 A 68 ILE HD1% 1.0 . 4.49 597 470 A 41 TRP HZ3 A 68 ILE HD1% 1.0 . 4.93 598 471 A 68 ILE HD1% A 35 LYS H 1.0 . 4.44 599 472 A 69 TYR HD% A 68 ILE HG2% 1.0 . 4.61 600 473 A 69 TYR H A 68 ILE HG1x 1.0 . 4.70 601 474 A 68 ILE HG1y A 68 ILE H 1.0 . 4.17 602 475 A 79 TRP HA A 84 ILE HG1y 1.0 . 4.41 603 476 A 24 PRO HA A 17 LEU HG 1.0 . 4.20 604 477 A 84 ILE HG1y A 84 ILE HA 1.0 . 3.65 605 478 A 17 LEU HG A 24 PRO HDy 1.0 . 3.89 606 479 A 68 ILE HG2% A 68 ILE HG1y 1.0 . 3.17 607 480 A 45 ALA HB% A 58 LEU HBy 1.0 . 3.83 608 481 A 32 VAL HGy% A 58 LEU HBy 1.0 . 4.04 609 482 A 58 LEU HBy A 59 THR H 1.0 . 4.53 610 483 A 72 GLU HA A 92 GLU HGy 1.0 . 4.69 611 484 A 92 GLU HBx A 72 GLU HA 1.0 . 3.90 612 485 A 73 ILE HG1y A 72 GLU HA 1.0 . 4.83 613 486 A 71 VAL HGy% A 70 LYS HA 1.0 . 4.10 614 487 A 94 VAL HGx% A 70 LYS HA 1.0 . 4.37 615 488 A 70 LYS HA A 94 VAL HGy% 1.0 . 3.75 616 489 A 70 LYS HA A 95 PHE H 1.0 . 4.45 617 490 A 69 TYR H A 70 LYS HA 1.0 . 5.03 618 491 A 31 HIS HBy A 72 GLU HBx 1.0 . 4.48 619 492 A 106 THR HA A 13 MET HB2 1.0 . 3.60 620 492 A 13 MET HB3 A 106 THR HA 1.0 . 3.60 621 493 A 12 LEU HA A 13 MET HB2 1.0 . 4.23 622 493 A 13 MET HB3 A 12 LEU HA 1.0 . 4.23 623 494 A 14 VAL H A 13 MET HB2 1.0 . 4.38 624 494 A 14 VAL H A 13 MET HB3 1.0 . 4.38 625 495 A 13 MET H A 13 MET HB2 1.0 . 3.63 626 495 A 13 MET HB3 A 13 MET H 1.0 . 3.63 627 496 A 70 LYS HBy A 70 LYS HEx 1.0 . 5.18 628 497 A 70 LYS HBy A 94 VAL HGy% 1.0 . 4.32 629 498 A 70 LYS HBx A 94 VAL HGy% 1.0 . 4.17 630 499 A 70 LYS HA A 70 LYS HDx 1.0 . 5.09 631 500 A 70 LYS HA A 70 LYS HDy 1.0 . 4.64 632 501 A 70 LYS HDx A 92 GLU HBy 1.0 . 4.73 633 502 A 33 PHE HD% A 70 LYS HDy 1.0 . 5.50 634 503 A 71 VAL H A 70 LYS HG2 1.0 . 4.77 635 503 A 71 VAL H A 70 LYS HG3 1.0 . 4.77 636 504 A 127 GLU H A 126 LYS HG2 1.0 . 3.92 637 504 A 127 GLU H A 126 LYS HG3 1.0 . 3.92 638 505 A 82 LEU H A 82 LEU HG 1.0 . 3.64 639 506 A 126 LYS HG2 A 127 GLU HG2 1.0 . 3.93 640 506 A 126 LYS HG3 A 127 GLU HG2 1.0 . 3.93 641 506 A 127 GLU HG3 A 126 LYS HG2 1.0 . 3.93 642 506 A 127 GLU HG3 A 126 LYS HG3 1.0 . 3.93 643 507 A 9 LYS HGy A 9 LYS HD2 1.0 . 2.76 644 507 A 9 LYS HD3 A 9 LYS HGy 1.0 . 2.76 645 508 A 9 LYS HD2 A 9 LYS HGx 1.0 . 2.76 646 508 A 9 LYS HD3 A 9 LYS HGx 1.0 . 2.76 647 509 A 126 LYS HD3 A 126 LYS HG2 1.0 . 2.99 648 509 A 126 LYS HG3 A 126 LYS HD2 1.0 . 2.99 649 509 A 126 LYS HG3 A 126 LYS HD3 1.0 . 2.99 650 509 A 126 LYS HD2 A 126 LYS HG2 1.0 . 2.99 651 510 A 93 VAL HGy% A 93 VAL H 1.0 . 3.21 652 511 A 94 VAL HGy% A 94 VAL H 1.0 . 3.35 653 512 A 122 VAL H A 122 VAL HGy% 1.0 . 3.43 654 513 A 94 VAL HA A 94 VAL HGy% 1.0 . 2.94 655 514 A 71 VAL HGy% A 32 VAL HGy% 1.0 . 2.72 656 515 A 32 VAL HGy% A 30 VAL HGx% 1.0 . 2.95 657 516 A 46 SER HA A 32 VAL HGy% 1.0 . 3.88 658 517 A 93 VAL HA A 94 VAL HGy% 1.0 . 3.52 659 518 A 32 VAL HGy% A 32 VAL HA 1.0 . 3.37 660 519 A 71 VAL HGx% A 31 HIS H 1.0 . 3.62 661 520 A 71 VAL HGx% A 72 GLU HA 1.0 . 3.97 662 521 A 71 VAL HGx% A 71 VAL HA 1.0 . 3.35 663 522 A 14 VAL HGx% A 107 ILE HB 1.0 . 3.62 664 523 A 14 VAL HGy% A 107 ILE HB 1.0 . 3.80 665 524 A 49 THR HG2% A 30 VAL HGy% 1.0 . 2.72 666 525 A 94 VAL HGx% A 94 VAL HA 1.0 . 3.19 667 526 A 72 GLU H A 72 GLU HGx 1.0 . 4.71 668 527 A 73 ILE H A 73 ILE HD1% 1.0 . 4.09 669 528 A 73 ILE HD1% A 91 ALA H 1.0 . 4.86 670 529 A 16 VAL H A 73 ILE HD1% 1.0 . 5.50 671 530 A 17 LEU H A 73 ILE HD1% 1.0 . 5.50 672 531 A 122 VAL H A 107 ILE HD1% 1.0 . 4.54 673 532 A 106 THR H A 107 ILE HD1% 1.0 . 4.48 674 533 A 108 ALA H A 107 ILE HD1% 1.0 . 3.84 675 534 A 121 VAL H A 107 ILE HD1% 1.0 . 4.62 676 535 A 107 ILE HD1% A 105 TYR HE% 1.0 . 5.06 677 535 A 107 ILE HD1% A 105 TYR HD% 1.0 . 5.06 678 536 A 95 PHE HD% A 107 ILE HD1% 1.0 . 4.47 679 537 A 95 PHE HE% A 107 ILE HD1% 1.0 . 3.96 680 538 A 73 ILE HD1% A 109 ALA HA 1.0 . 5.50 681 539 A 72 GLU HA A 73 ILE HD1% 1.0 . 5.27 682 540 A 73 ILE HA A 73 ILE HD1% 1.0 . 4.00 683 541 A 107 ILE HA A 107 ILE HD1% 1.0 . 3.73 684 542 A 121 VAL HA A 107 ILE HD1% 1.0 . 4.00 685 543 A 16 VAL HB A 73 ILE HD1% 1.0 . 4.93 686 544 A 109 ALA HB% A 73 ILE HD1% 1.0 . 3.12 687 545 A 111 LEU HDy% A 73 ILE HD1% 1.0 . 4.22 688 546 A 107 ILE HD1% A 105 TYR HBy 1.0 . 5.10 689 547 A 107 ILE HB A 107 ILE HD1% 1.0 . 3.65 690 548 A 107 ILE HD1% A 119 MET HE% 1.0 . 5.07 691 549 A 122 VAL HGy% A 107 ILE HD1% 1.0 . 3.20 692 550 A 107 ILE HD1% A 107 ILE HG2% 1.0 . 2.77 693 551 A 73 ILE HG2% A 90 HIS HA 1.0 . 5.50 694 552 A 107 ILE HG2% A 108 ALA HA 1.0 . 4.06 695 553 A 74 ASP HA A 73 ILE HG2% 1.0 . 4.23 696 554 A 107 ILE HA A 107 ILE HG2% 1.0 . 3.82 697 555 A 30 VAL HA A 73 ILE HG2% 1.0 . 3.76 698 556 A 73 ILE HG2% A 75 THR HA 1.0 . 4.49 699 557 A 28 VAL HA A 73 ILE HG2% 1.0 . 4.86 700 558 A 73 ILE HG1y A 73 ILE HG2% 1.0 . 3.41 701 559 A 75 THR HG2% A 73 ILE HG2% 1.0 . 3.44 702 560 A 109 ALA HB% A 107 ILE HG2% 1.0 . 3.77 703 561 A 107 ILE HG2% A 107 ILE HG1x 1.0 . 3.22 704 562 A 111 LEU HDy% A 73 ILE HG2% 1.0 . 3.44 705 563 A 108 ALA H A 107 ILE HG2% 1.0 . 3.49 706 564 A 26 ILE HB A 27 ASN HBx 1.0 . 5.10 707 565 A 73 ILE HA A 73 ILE HG2% 1.0 . 3.43 708 566 A 44 PHE HA A 43 PRO HBy 1.0 . 4.80 709 567 A 42 GLU HA A 41 TRP HA 1.0 . 4.81 710 568 A 74 ASP HA A 73 ILE HA 1.0 . 5.16 711 569 A 42 GLU HA A 43 PRO HDy 1.0 . 3.10 712 570 A 15 LYS HD3 A 15 LYS HE2 1.0 . 2.68 713 570 A 15 LYS HD2 A 15 LYS HE2 1.0 . 2.68 714 570 A 15 LYS HE3 A 15 LYS HD2 1.0 . 2.68 715 570 A 15 LYS HD3 A 15 LYS HE3 1.0 . 2.68 716 571 A 15 LYS HE2 A 15 LYS HG2 1.0 . 2.81 717 571 A 15 LYS HE3 A 15 LYS HG2 1.0 . 2.81 718 571 A 15 LYS HG3 A 15 LYS HE2 1.0 . 2.81 719 571 A 15 LYS HG3 A 15 LYS HE3 1.0 . 2.81 720 572 A 106 THR HG2% A 15 LYS HE2 1.0 . 3.71 721 572 A 15 LYS HE3 A 106 THR HG2% 1.0 . 3.71 722 573 A 28 VAL HGx% A 74 ASP HBy 1.0 . 5.50 723 574 A 74 ASP HA A 75 THR HA 1.0 . 4.98 724 575 A 78 TYR HBx A 75 THR HA 1.0 . 5.09 725 576 A 28 VAL HGx% A 75 THR HA 1.0 . 4.31 726 577 A 75 THR HB A 79 TRP HE1 1.0 . 4.75 727 578 A 111 LEU HDx% A 75 THR HB 1.0 . 4.58 728 579 A 109 ALA HB% A 110 MET H 1.0 . 3.35 729 580 A 75 THR HG2% A 90 HIS HA 1.0 . 3.46 730 581 A 75 THR HG2% A 74 ASP HA 1.0 . 3.89 731 582 A 75 THR HG2% A 75 THR HA 1.0 . 3.50 732 583 A 28 VAL HGy% A 78 TYR HA 1.0 . 5.50 733 584 A 77 SER H A 76 LYS HD2 1.0 . 4.42 734 584 A 76 LYS HD3 A 77 SER H 1.0 . 4.42 735 585 A 23 SER H A 21 ARG HGy 1.0 . 4.98 736 586 A 76 LYS HB2 A 76 LYS HD2 1.0 . 2.79 737 586 A 76 LYS HB3 A 76 LYS HD2 1.0 . 2.79 738 586 A 76 LYS HD3 A 76 LYS HB2 1.0 . 2.79 739 586 A 76 LYS HB3 A 76 LYS HD3 1.0 . 2.79 740 587 A 81 ALA HA A 80 LYS HGx 1.0 . 3.48 741 588 A 79 TRP H A 80 LYS HGy 1.0 . 5.50 742 589 A 80 LYS HGx A 79 TRP H 1.0 . 5.06 743 590 A 80 LYS HGx A 81 ALA H 1.0 . 4.71 744 591 A 82 LEU H A 80 LYS HGx 1.0 . 5.06 745 592 A 80 LYS H A 80 LYS HGx 1.0 . 4.13 746 593 A 80 LYS H A 80 LYS HGy 1.0 . 4.18 747 594 A 80 LYS HGx A 80 LYS HD2 1.0 . 2.64 748 594 A 80 LYS HGx A 80 LYS HD3 1.0 . 2.64 749 595 A 76 LYS HB3 A 76 LYS HE2 1.0 . 3.42 750 595 A 76 LYS HB2 A 76 LYS HE2 1.0 . 3.42 751 595 A 76 LYS HE3 A 76 LYS HB2 1.0 . 3.42 752 595 A 76 LYS HB3 A 76 LYS HE3 1.0 . 3.42 753 596 A 76 LYS HD2 A 76 LYS HE2 1.0 . 2.59 754 596 A 76 LYS HD3 A 76 LYS HE2 1.0 . 2.59 755 596 A 76 LYS HE3 A 76 LYS HD2 1.0 . 2.59 756 596 A 76 LYS HD3 A 76 LYS HE3 1.0 . 2.59 757 597 A 100 SER HA A 100 SER HB2 1.0 . 3.01 758 597 A 100 SER HA A 100 SER HB3 1.0 . 3.01 759 598 A 77 SER HB3 A 74 ASP HBx 1.0 . 4.77 760 598 A 74 ASP HBx A 77 SER HB2 1.0 . 4.77 761 599 A 77 SER HB3 A 74 ASP HBy 1.0 . 4.77 762 599 A 74 ASP HBy A 77 SER HB2 1.0 . 4.77 763 600 A 28 VAL HA A 78 TYR HBy 1.0 . 5.50 764 601 A 29 ALA HB% A 77 SER HB2 1.0 . 3.79 765 601 A 29 ALA HB% A 77 SER HB3 1.0 . 3.79 766 602 A 28 VAL HA A 48 LYS HGy 1.0 . 5.19 767 603 A 84 ILE HG1x A 85 SER HBy 1.0 . 5.50 768 604 A 28 VAL HA A 28 VAL HGx% 1.0 . 3.23 769 605 A 77 SER HA A 80 LYS HE2 1.0 . 4.69 770 605 A 77 SER HA A 80 LYS HE3 1.0 . 4.69 771 606 A 75 THR HG2% A 78 TYR HBy 1.0 . 5.08 772 607 A 78 TYR HBy A 28 VAL HGx% 1.0 . 5.50 773 608 A 8 SER HA A 7 GLU HG2 1.0 . 4.82 774 608 A 7 GLU HG3 A 8 SER HA 1.0 . 4.82 775 609 A 79 TRP HA A 84 ILE HB 1.0 . 3.42 776 610 A 79 TRP HA A 82 LEU HG 1.0 . 3.96 777 611 A 79 TRP HA A 82 LEU HDy% 1.0 . 3.70 778 612 A 79 TRP HA A 84 ILE H 1.0 . 4.53 779 613 A 79 TRP HA A 79 TRP HE3 1.0 . 3.46 780 614 A 80 LYS H A 79 TRP HBx 1.0 . 4.86 781 615 A 84 ILE HB A 79 TRP HBx 1.0 . 4.73 782 616 A 84 ILE HB A 79 TRP HBy 1.0 . 4.73 783 617 A 80 LYS HA A 80 LYS HE2 1.0 . 4.88 784 617 A 80 LYS HA A 80 LYS HE3 1.0 . 4.88 785 618 A 80 LYS HA A 80 LYS HD2 1.0 . 3.69 786 618 A 80 LYS HA A 80 LYS HD3 1.0 . 3.69 787 619 A 80 LYS HA A 80 LYS HGx 1.0 . 3.79 788 620 A 80 LYS H A 80 LYS HBy 1.0 . 3.65 789 621 A 80 LYS HBx A 81 ALA H 1.0 . 4.00 790 622 A 80 LYS HBx A 80 LYS HE2 1.0 . 3.42 791 622 A 80 LYS HBx A 80 LYS HE3 1.0 . 3.42 792 623 A 80 LYS HBy A 80 LYS HD2 1.0 . 3.28 793 623 A 80 LYS HD3 A 80 LYS HBy 1.0 . 3.28 794 624 A 7 GLU HG3 A 7 GLU HBx 1.0 . 2.49 795 624 A 7 GLU HBx A 7 GLU HG2 1.0 . 2.49 796 625 A 19 ALA HB% A 110 MET HBx 1.0 . 2.85 797 626 A 126 LYS H A 126 LYS HE2 1.0 . 5.08 798 626 A 126 LYS H A 126 LYS HE3 1.0 . 5.08 799 627 A 83 GLY H A 80 LYS HD2 1.0 . 5.50 800 627 A 83 GLY H A 80 LYS HD3 1.0 . 5.50 801 628 A 81 ALA H A 80 LYS HD2 1.0 . 5.15 802 628 A 81 ALA H A 80 LYS HD3 1.0 . 5.15 803 629 A 80 LYS HD2 A 80 LYS HE2 1.0 . 2.86 804 629 A 80 LYS HD3 A 80 LYS HE2 1.0 . 2.86 805 629 A 80 LYS HE3 A 80 LYS HD2 1.0 . 2.86 806 629 A 80 LYS HD3 A 80 LYS HE3 1.0 . 2.86 807 630 A 81 ALA HA A 80 LYS HD2 1.0 . 4.18 808 630 A 81 ALA HA A 80 LYS HD3 1.0 . 4.18 809 631 A 18 ASP HA A 19 ALA HA 1.0 . 4.54 810 632 A 81 ALA HA A 80 LYS HE2 1.0 . 5.25 811 632 A 81 ALA HA A 80 LYS HE3 1.0 . 5.25 812 633 A 110 MET HGy A 19 ALA HA 1.0 . 4.87 813 634 A 110 MET HBy A 19 ALA HA 1.0 . 5.50 814 635 A 19 ALA HA A 110 MET HGx 1.0 . 5.50 815 636 A 81 ALA HB% A 82 LEU HA 1.0 . 4.22 816 637 A 81 ALA HB% A 77 SER HB2 1.0 . 5.32 817 637 A 77 SER HB3 A 81 ALA HB% 1.0 . 5.32 818 638 A 81 ALA HB% A 80 LYS HE2 1.0 . 5.50 819 638 A 80 LYS HE3 A 81 ALA HB% 1.0 . 5.50 820 639 A 78 TYR HBy A 81 ALA HB% 1.0 . 5.27 821 640 A 81 ALA HB% A 82 LEU HDx% 1.0 . 4.25 822 641 A 81 ALA HB% A 82 LEU HDy% 1.0 . 4.25 823 642 A 79 TRP H A 81 ALA HB% 1.0 . 4.85 824 643 A 84 ILE HB A 79 TRP HE3 1.0 . 4.05 825 644 A 79 TRP HE3 A 82 LEU HBy 1.0 . 5.19 826 645 A 84 ILE HB A 83 GLY HAx 1.0 . 5.11 827 646 A 82 LEU HBy A 82 LEU HDy% 1.0 . 3.15 828 647 A 83 GLY H A 82 LEU HDx% 1.0 . 4.45 829 648 A 82 LEU H A 82 LEU HDx% 1.0 . 3.75 830 649 A 79 TRP HA A 82 LEU HDx% 1.0 . 3.70 831 650 A 82 LEU HDx% A 21 ARG HD2 1.0 . 3.92 832 650 A 21 ARG HD3 A 82 LEU HDx% 1.0 . 3.92 833 651 A 82 LEU HBy A 82 LEU HDx% 1.0 . 3.15 834 652 A 83 GLY HAy A 82 LEU HBy 1.0 . 4.60 835 653 A 83 GLY HAy A 82 LEU H 1.0 . 4.83 836 654 A 84 ILE HD1% A 79 TRP HA 1.0 . 4.11 837 655 A 84 ILE HD1% A 84 ILE HA 1.0 . 3.56 838 656 A 84 ILE HD1% A 79 TRP HE3 1.0 . 3.65 839 657 A 84 ILE HD1% A 79 TRP HZ3 1.0 . 4.19 840 658 A 84 ILE HD1% A 84 ILE H 1.0 . 3.88 841 659 A 84 ILE HD1% A 82 LEU HBy 1.0 . 3.12 842 660 A 84 ILE HD1% A 84 ILE HB 1.0 . 3.54 843 661 A 84 ILE HD1% A 84 ILE HG2% 1.0 . 3.22 844 662 A 26 ILE HD1% A 27 ASN HBx 1.0 . 5.40 845 663 A 26 ILE HD1% A 50 SER HA 1.0 . 4.32 846 664 A 26 ILE HD1% A 51 GLU HA 1.0 . 2.97 847 665 A 26 ILE HD1% A 51 GLU HB2 1.0 . 3.12 848 665 A 26 ILE HD1% A 51 GLU HB3 1.0 . 3.12 849 666 A 26 ILE HB A 26 ILE HD1% 1.0 . 2.87 850 667 A 26 ILE HD1% A 27 ASN HD2x 1.0 . 4.49 851 668 A 26 ILE HD1% A 26 ILE H 1.0 . 4.21 852 669 A 26 ILE HD1% A 27 ASN H 1.0 . 4.73 853 670 A 84 ILE HG2% A 113 PRO HBx 1.0 . 4.20 854 671 A 84 ILE HA A 84 ILE HG2% 1.0 . 3.37 855 672 A 84 ILE HG2% A 85 SER HBy 1.0 . 4.51 856 673 A 84 ILE HG2% A 85 SER HBx 1.0 . 4.51 857 674 A 84 ILE HG2% A 79 TRP HBy 1.0 . 4.47 858 675 A 84 ILE HG2% A 79 TRP HBx 1.0 . 4.47 859 676 A 84 ILE HG1y A 84 ILE HG2% 1.0 . 3.53 860 677 A 84 ILE HG1x A 84 ILE HG2% 1.0 . 3.29 861 678 A 79 TRP HE3 A 84 ILE HG2% 1.0 . 3.99 862 679 A 79 TRP HZ3 A 84 ILE HG2% 1.0 . 4.55 863 680 A 84 ILE HG2% A 79 TRP HZ2 1.0 . 5.28 864 681 A 84 ILE HG2% A 114 TYR HD% 1.0 . 5.50 865 682 A 79 TRP H A 77 SER HB2 1.0 . 4.84 866 682 A 79 TRP H A 77 SER HB3 1.0 . 4.84 867 683 A 101 GLY H A 100 SER HB2 1.0 . 4.91 868 683 A 100 SER HB3 A 101 GLY H 1.0 . 4.91 869 684 A 84 ILE HG1x A 85 SER HBx 1.0 . 5.50 870 685 A 87 MET H A 87 MET HE% 1.0 . 5.06 871 686 A 114 TYR HD% A 87 MET HE% 1.0 . 4.27 872 687 A 87 MET HE% A 114 TYR HE% 1.0 . 4.72 873 688 A 87 MET HE% A 114 TYR HA 1.0 . 3.92 874 689 A 87 MET HE% A 87 MET HA 1.0 . 4.74 875 690 A 17 LEU HA A 110 MET HE% 1.0 . 4.66 876 691 A 19 ALA HA A 110 MET HE% 1.0 . 3.23 877 692 A 110 MET HE% A 22 GLY HAy 1.0 . 4.13 878 693 A 110 MET HE% A 22 GLY HAx 1.0 . 4.77 879 694 A 110 MET HGy A 110 MET HE% 1.0 . 2.93 880 695 A 17 LEU HBy A 110 MET HE% 1.0 . 3.45 881 696 A 19 ALA HB% A 110 MET HE% 1.0 . 3.12 882 697 A 17 LEU HBx A 110 MET HE% 1.0 . 3.19 883 698 A 19 ALA H A 110 MET HE% 1.0 . 4.36 884 699 A 18 ASP H A 110 MET HE% 1.0 . 3.82 885 700 A 17 LEU H A 110 MET HE% 1.0 . 4.84 886 701 A 110 MET HE% A 22 GLY H 1.0 . 4.39 887 702 A 19 ALA HB% A 112 SER HA 1.0 . 3.78 888 703 A 112 SER HA A 20 VAL HGy% 1.0 . 3.48 889 704 A 12 LEU HA A 12 LEU HDy% 1.0 . 3.97 890 705 A 12 LEU HA A 12 LEU HDx% 1.0 . 3.97 891 706 A 110 MET HA A 110 MET HE% 1.0 . 3.67 892 707 A 15 LYS HA A 54 GLU H 1.0 . 4.75 893 708 A 14 VAL HGy% A 13 MET HA 1.0 . 4.05 894 709 A 127 GLU HA A 126 LYS HE2 1.0 . 4.45 895 709 A 127 GLU HA A 126 LYS HE3 1.0 . 4.45 896 710 A 25 ALA H A 24 PRO HBx 1.0 . 4.24 897 711 A 126 LYS H A 126 LYS HBy 1.0 . 3.63 898 712 A 118 THR HB A 119 MET HA 1.0 . 4.33 899 713 A 119 MET HE% A 119 MET HA 1.0 . 4.33 900 714 A 32 VAL HGy% A 31 HIS HBx 1.0 . 5.30 901 715 A 73 ILE H A 90 HIS HBx 1.0 . 5.21 902 716 A 74 ASP HA A 90 HIS HBx 1.0 . 4.68 903 717 A 90 HIS HBx A 91 ALA HB% 1.0 . 5.08 904 718 A 75 THR HG2% A 90 HIS HBx 1.0 . 5.11 905 719 A 75 THR HG2% A 90 HIS HBy 1.0 . 4.88 906 720 A 74 ASP HA A 90 HIS HA 1.0 . 4.26 907 721 A 90 HIS HA A 91 ALA HA 1.0 . 4.55 908 722 A 90 HIS HA A 91 ALA HB% 1.0 . 4.62 909 723 A 73 ILE HG2% A 90 HIS HBx 1.0 . 5.50 910 724 A 91 ALA H A 90 HIS HBy 1.0 . 4.07 911 725 A 90 HIS HBx A 75 THR H 1.0 . 4.61 912 726 A 91 ALA HB% A 73 ILE HB 1.0 . 3.49 913 727 A 73 ILE HD1% A 91 ALA HB% 1.0 . 3.55 914 728 A 74 ASP HA A 91 ALA HB% 1.0 . 5.50 915 729 A 91 ALA H A 91 ALA HB% 1.0 . 3.56 916 730 A 73 ILE H A 92 GLU HA 1.0 . 4.46 917 731 A 72 GLU HA A 92 GLU HA 1.0 . 3.86 918 732 A 91 ALA HA A 92 GLU HA 1.0 . 5.10 919 733 A 91 ALA HB% A 92 GLU HA 1.0 . 4.91 920 734 A 92 GLU HA A 73 ILE HG1x 1.0 . 4.70 921 735 A 93 VAL HGy% A 92 GLU HA 1.0 . 4.25 922 736 A 71 VAL HGx% A 92 GLU HA 1.0 . 4.54 923 737 A 70 LYS HDx A 92 GLU HA 1.0 . 5.50 924 738 A 119 MET HE% A 93 VAL HB 1.0 . 4.21 925 739 A 72 GLU HA A 92 GLU HGx 1.0 . 4.69 926 740 A 93 VAL HA A 94 VAL HA 1.0 . 4.71 927 741 A 32 VAL HGy% A 72 GLU H 1.0 . 4.46 928 742 A 41 TRP HH2 A 94 VAL HGy% 1.0 . 3.49 929 743 A 94 VAL HGy% A 41 TRP HZ3 1.0 . 4.58 930 744 A 32 VAL HGy% A 44 PHE HE% 1.0 . 3.79 931 744 A 44 PHE HD% A 32 VAL HGy% 1.0 . 3.79 932 745 A 96 THR HG2% A 97 ALA H 1.0 . 3.66 933 746 A 21 ARG H A 20 VAL HGy% 1.0 . 4.27 934 747 A 79 TRP HH2 A 20 VAL HGy% 1.0 . 3.97 935 748 A 79 TRP HZ3 A 20 VAL HGy% 1.0 . 4.82 936 749 A 114 TYR HE% A 20 VAL HGy% 1.0 . 4.25 937 750 A 20 VAL HA A 20 VAL HGy% 1.0 . 2.85 938 751 A 20 VAL HGx% A 21 ARG HGx 1.0 . 3.81 939 752 A 71 VAL HGy% A 32 VAL HB 1.0 . 4.37 940 753 A 71 VAL HGy% A 69 TYR HBy 1.0 . 4.57 941 754 A 40 THR HG2% A 39 ASP HB2 1.0 . 3.62 942 754 A 39 ASP HB3 A 40 THR HG2% 1.0 . 3.62 943 755 A 121 VAL HGy% A 95 PHE HB2 1.0 . 5.00 944 755 A 121 VAL HGy% A 95 PHE HB3 1.0 . 5.00 945 756 A 95 PHE HA A 96 THR HB 1.0 . 5.00 946 757 A 93 VAL HGx% A 95 PHE HB2 1.0 . 4.49 947 757 A 93 VAL HGx% A 95 PHE HB3 1.0 . 4.49 948 758 A 96 THR HG2% A 97 ALA HA 1.0 . 4.51 949 759 A 23 SER HA A 17 LEU HDy% 1.0 . 4.90 950 760 A 17 LEU HA A 17 LEU HDx% 1.0 . 3.67 951 761 A 17 LEU HA A 17 LEU HDy% 1.0 . 3.67 952 762 A 24 PRO HDy A 17 LEU HDy% 1.0 . 4.44 953 763 A 41 TRP H A 35 LYS HE2 1.0 . 5.50 954 763 A 35 LYS HE3 A 41 TRP H 1.0 . 5.50 955 764 A 102 PRO HD3 A 101 GLY HAx 1.0 . 3.42 956 764 A 101 GLY HAx A 102 PRO HD2 1.0 . 3.42 957 765 A 100 SER HA A 101 GLY HAx 1.0 . 5.23 958 766 A 100 SER HA A 101 GLY HAy 1.0 . 5.23 959 767 A 101 GLY H A 102 PRO HD2 1.0 . 4.84 960 767 A 102 PRO HD3 A 101 GLY H 1.0 . 4.84 961 768 A 124 ASN HBx A 125 PRO HDx 1.0 . 4.64 962 769 A 15 LYS H A 15 LYS HE2 1.0 . 4.86 963 769 A 15 LYS H A 15 LYS HE3 1.0 . 4.86 964 770 A 107 ILE HD1% A 105 TYR HBx 1.0 . 5.10 965 771 A 106 THR HA A 13 MET H 1.0 . 4.18 966 772 A 106 THR HA A 107 ILE HD1% 1.0 . 4.58 967 773 A 106 THR HB A 13 MET HB2 1.0 . 4.20 968 773 A 13 MET HB3 A 106 THR HB 1.0 . 4.20 969 774 A 108 ALA HB% A 106 THR HB 1.0 . 5.48 970 775 A 106 THR H A 106 THR HB 1.0 . 4.06 971 776 A 106 THR HG2% A 13 MET HB2 1.0 . 3.10 972 776 A 13 MET HB3 A 106 THR HG2% 1.0 . 3.10 973 777 A 106 THR HG2% A 15 LYS HD2 1.0 . 3.85 974 777 A 15 LYS HD3 A 106 THR HG2% 1.0 . 3.85 975 778 A 106 THR HA A 106 THR HG2% 1.0 . 3.12 976 779 A 122 VAL H A 123 THR HG2% 1.0 . 4.67 977 780 A 15 LYS H A 106 THR HG2% 1.0 . 3.58 978 781 A 106 THR HG2% A 107 ILE H 1.0 . 3.37 979 782 A 119 MET HE% A 107 ILE HG1y 1.0 . 4.86 980 783 A 15 LYS H A 107 ILE HG1x 1.0 . 5.50 981 784 A 106 THR H A 107 ILE HG1x 1.0 . 5.50 982 785 A 14 VAL HA A 108 ALA HA 1.0 . 5.50 983 786 A 107 ILE HA A 108 ALA HA 1.0 . 5.10 984 787 A 110 MET HGy A 109 ALA HA 1.0 . 4.98 985 788 A 110 MET HBy A 109 ALA HA 1.0 . 4.71 986 789 A 109 ALA HA A 110 MET HGx 1.0 . 5.05 987 790 A 109 ALA HA A 119 MET HBy 1.0 . 4.60 988 791 A 109 ALA HA A 107 ILE HG2% 1.0 . 4.43 989 792 A 12 LEU HA A 13 MET HA 1.0 . 4.93 990 793 A 110 MET HA A 18 ASP HA 1.0 . 5.09 991 794 A 110 MET HA A 109 ALA HA 1.0 . 4.77 992 795 A 13 MET HE% A 55 LEU H 1.0 . 3.88 993 796 A 120 ALA H A 119 MET HE% 1.0 . 5.27 994 797 A 93 VAL H A 119 MET HE% 1.0 . 4.57 995 798 A 94 VAL H A 119 MET HE% 1.0 . 5.50 996 799 A 109 ALA HA A 119 MET HE% 1.0 . 4.33 997 800 A 93 VAL HA A 119 MET HE% 1.0 . 4.90 998 801 A 19 ALA H A 110 MET HBx 1.0 . 5.28 999 802 A 111 LEU H A 110 MET HBx 1.0 . 5.50 1000 803 A 13 MET HA A 13 MET HGx 1.0 . 3.87 1001 804 A 111 LEU H A 110 MET HGy 1.0 . 4.23 1002 805 A 110 MET H A 110 MET HGy 1.0 . 3.91 1003 806 A 110 MET HA A 110 MET HGy 1.0 . 3.68 1004 807 A 17 LEU HBy A 110 MET HGy 1.0 . 3.88 1005 808 A 110 MET HGx A 109 ALA H 1.0 . 5.45 1006 809 A 111 LEU HDy% A 25 ALA HB% 1.0 . 3.40 1007 810 A 111 LEU HDy% A 16 VAL HB 1.0 . 4.80 1008 811 A 111 LEU HDy% A 111 LEU HBy 1.0 . 3.81 1009 812 A 111 LEU HDy% A 111 LEU HBx 1.0 . 3.81 1010 813 A 111 LEU HDy% A 75 THR HA 1.0 . 4.37 1011 814 A 111 LEU HDy% A 111 LEU HA 1.0 . 4.04 1012 815 A 111 LEU HDy% A 75 THR HB 1.0 . 4.24 1013 816 A 111 LEU HDy% A 79 TRP HH2 1.0 . 4.66 1014 817 A 111 LEU HDy% A 79 TRP H 1.0 . 5.50 1015 818 A 111 LEU HDy% A 75 THR H 1.0 . 4.93 1016 819 A 111 LEU HDy% A 18 ASP H 1.0 . 5.50 1017 820 A 111 LEU HDy% A 112 SER H 1.0 . 5.47 1018 821 A 111 LEU HDx% A 110 MET HBy 1.0 . 5.22 1019 822 A 111 LEU HDx% A 109 ALA HA 1.0 . 5.19 1020 823 A 111 LEU HDx% A 79 TRP HE1 1.0 . 5.50 1021 824 A 95 PHE HE% A 121 VAL HGy% 1.0 . 5.06 1022 825 A 114 TYR HD% A 112 SER HBy 1.0 . 5.50 1023 826 A 114 TYR HD% A 112 SER HBx 1.0 . 5.50 1024 827 A 19 ALA HB% A 112 SER HBy 1.0 . 4.42 1025 828 A 19 ALA HB% A 112 SER HBx 1.0 . 4.42 1026 829 A 20 VAL HGy% A 112 SER HBx 1.0 . 4.45 1027 830 A 14 VAL HA A 107 ILE HB 1.0 . 4.14 1028 831 A 118 THR HB A 119 MET HBy 1.0 . 5.50 1029 832 A 109 ALA HB% A 119 MET HE% 1.0 . 2.92 1030 833 A 93 VAL HGx% A 119 MET HE% 1.0 . 3.17 1031 834 A 93 VAL HGy% A 119 MET HE% 1.0 . 2.85 1032 835 A 119 MET HE% A 107 ILE HG2% 1.0 . 2.88 1033 836 A 73 ILE HD1% A 119 MET HE% 1.0 . 3.12 1034 837 A 120 ALA HB% A 107 ILE HD1% 1.0 . 4.65 1035 838 A 120 ALA HB% A 109 ALA HA 1.0 . 4.76 1036 839 A 120 ALA HB% A 108 ALA HA 1.0 . 4.56 1037 840 A 121 VAL HA A 120 ALA HB% 1.0 . 4.63 1038 841 A 122 VAL HGy% A 122 VAL HA 1.0 . 3.08 1039 842 A 72 GLU HBx A 31 HIS HBx 1.0 . 4.96 1040 843 A 121 VAL H A 121 VAL HGx% 1.0 . 4.26 1041 844 A 95 PHE HD% A 121 VAL HGx% 1.0 . 4.67 1042 845 A 30 VAL HGx% A 72 GLU H 1.0 . 4.55 1043 846 A 95 PHE HA A 121 VAL HGx% 1.0 . 4.62 1044 847 A 30 VAL HGx% A 32 VAL HA 1.0 . 4.84 1045 848 A 25 ALA H A 24 PRO HBy 1.0 . 3.99 1046 849 A 126 LYS H A 125 PRO HBy 1.0 . 4.29 1047 850 A 126 LYS HA A 125 PRO HBy 1.0 . 5.16 1048 851 A 126 LYS HA A 126 LYS HG2 1.0 . 3.59 1049 851 A 126 LYS HA A 126 LYS HG3 1.0 . 3.59 1050 852 A 126 LYS HD2 A 127 GLU HG2 1.0 . 3.75 1051 852 A 126 LYS HD3 A 127 GLU HG2 1.0 . 3.75 1052 852 A 127 GLU HG3 A 126 LYS HD2 1.0 . 3.75 1053 852 A 127 GLU HG3 A 126 LYS HD3 1.0 . 3.75 1054 853 A 108 ALA H A 121 VAL HA 1.0 . 4.66 1055 854 A 126 LYS H A 125 PRO HDy 1.0 . 5.50 1056 855 A 126 LYS H A 125 PRO HDx 1.0 . 5.50 1057 856 A 24 PRO HDx A 23 SER H 1.0 . 5.13 1058 857 A 24 PRO HDy A 23 SER H 1.0 . 5.22 1059 858 A 21 ARG HBx A 18 ASP H 1.0 . 5.13 1060 859 A 21 ARG HBx A 20 VAL H 1.0 . 5.50 1061 860 A 20 VAL HGx% A 21 ARG HBx 1.0 . 4.91 1062 861 A 25 ALA HB% A 24 PRO HBx 1.0 . 5.50 1063 862 A 24 PRO HA A 17 LEU HA 1.0 . 3.40 1064 863 A 20 VAL H A 21 ARG HGx 1.0 . 5.33 1065 864 A 23 SER H A 21 ARG HGx 1.0 . 5.50 1066 865 A 124 ASN HBx A 125 PRO HDy 1.0 . 4.64 1067 866 A 24 PRO HDy A 17 LEU HDx% 1.0 . 4.44 1068 867 A 53 GLY HAx A 24 PRO HBy 1.0 . 3.45 1069 868 A 53 GLY HAy A 24 PRO HBy 1.0 . 3.40 1070 869 A 125 PRO HBx A 124 ASN HA 1.0 . 5.12 1071 870 A 42 GLU HBy A 43 PRO HDx 1.0 . 3.73 1072 871 A 54 GLU H A 24 PRO HBy 1.0 . 4.96 1073 872 A 43 PRO HBx A 33 PHE HA 1.0 . 5.50 1074 873 A 21 ARG HBy A 18 ASP HBy 1.0 . 5.09 1075 874 A 13 MET HE% A 13 MET HA 1.0 . 4.28 1076 875 A 56 HIS HD2 A 13 MET HE% 1.0 . 4.44 1077 876 A 13 MET HE% A 54 GLU H 1.0 . 5.10 1078 877 A 13 MET HE% A 54 GLU HA 1.0 . 3.73 1079 878 A 13 MET HE% A 15 LYS HA 1.0 . 3.79 1080 879 A 13 MET HE% A 15 LYS HE2 1.0 . 3.35 1081 879 A 13 MET HE% A 15 LYS HE3 1.0 . 3.35 1082 880 A 13 MET HE% A 13 MET HGy 1.0 . 3.44 1083 881 A 13 MET HE% A 13 MET HGx 1.0 . 3.44 1084 882 A 13 MET HE% A 15 LYS HD2 1.0 . 2.98 1085 882 A 13 MET HE% A 15 LYS HD3 1.0 . 2.98 1086 883 A 13 MET HE% A 106 THR HG2% 1.0 . 2.78 1087 884 A 13 MET HA A 13 MET HGy 1.0 . 3.87 1088 885 A 15 LYS HBx A 14 VAL HA 1.0 . 4.91 1089 886 A 13 MET HA A 14 VAL HB 1.0 . 4.92 1090 887 A 70 LYS HBx A 33 PHE HD% 1.0 . 5.50 1091 888 A 70 LYS HBx A 95 PHE H 1.0 . 5.23 1092 889 A 70 LYS HBy A 33 PHE HD% 1.0 . 4.99 1093 890 A 70 LYS HBx A 33 PHE HBy 1.0 . 5.50 1094 891 A 70 LYS HBx A 33 PHE HBx 1.0 . 5.49 1095 892 A 70 LYS HBx A 41 TRP HBx 1.0 . 5.50 1096 893 A 70 LYS HBy A 32 VAL HA 1.0 . 5.17 1097 894 A 70 LYS HBy A 70 LYS HEy 1.0 . 5.18 1098 895 A 15 LYS H A 15 LYS HD2 1.0 . 5.01 1099 895 A 15 LYS H A 15 LYS HD3 1.0 . 5.01 1100 896 A 9 LYS HA A 9 LYS HE2 1.0 . 4.65 1101 896 A 9 LYS HA A 9 LYS HE3 1.0 . 4.65 1102 897 A 124 ASN HA A 125 PRO HDy 1.0 . 3.53 1103 898 A 33 PHE HD% A 70 LYS HEy 1.0 . 4.67 1104 899 A 72 GLU HBx A 70 LYS HEy 1.0 . 5.50 1105 900 A 33 PHE HBx A 70 LYS HEy 1.0 . 5.06 1106 901 A 70 LYS HA A 70 LYS HEy 1.0 . 5.50 1107 902 A 33 PHE HD% A 70 LYS HEx 1.0 . 4.67 1108 903 A 70 LYS HA A 70 LYS HEx 1.0 . 5.50 1109 904 A 33 PHE HBx A 70 LYS HEx 1.0 . 5.06 1110 905 A 72 GLU HBx A 70 LYS HEx 1.0 . 5.50 1111 906 A 96 THR HA A 68 ILE HG1y 1.0 . 4.68 1112 907 A 9 LYS HD3 A 9 LYS HE2 1.0 . 2.58 1113 907 A 9 LYS HD2 A 9 LYS HE2 1.0 . 2.58 1114 907 A 9 LYS HE3 A 9 LYS HD2 1.0 . 2.58 1115 907 A 9 LYS HD3 A 9 LYS HE3 1.0 . 2.58 1116 908 A 126 LYS HD2 A 126 LYS HE2 1.0 . 2.77 1117 908 A 126 LYS HD3 A 126 LYS HE2 1.0 . 2.77 1118 908 A 126 LYS HE3 A 126 LYS HD2 1.0 . 2.77 1119 908 A 126 LYS HD3 A 126 LYS HE3 1.0 . 2.77 1120 909 A 126 LYS HE2 A 126 LYS HG2 1.0 . 2.63 1121 909 A 126 LYS HE3 A 126 LYS HG2 1.0 . 2.63 1122 909 A 126 LYS HG3 A 126 LYS HE2 1.0 . 2.63 1123 909 A 126 LYS HG3 A 126 LYS HE3 1.0 . 2.63 1124 910 A 25 ALA HB% A 18 ASP HBy 1.0 . 4.54 1125 911 A 80 LYS HBy A 80 LYS HE2 1.0 . 3.22 1126 911 A 80 LYS HE3 A 80 LYS HBy 1.0 . 3.22 1127 912 A 9 LYS HE3 A 9 LYS HBy 1.0 . 3.93 1128 912 A 9 LYS HBy A 9 LYS HE2 1.0 . 3.93 1129 913 A 53 GLY HAy A 15 LYS HA 1.0 . 4.77 1130 914 A 121 VAL HA A 107 ILE HG2% 1.0 . 4.12 1131 915 A 2 PRO HGy A 3 THR HB 1.0 . 5.24 1132 916 A 2 PRO HBy A 3 THR HB 1.0 . 5.38 1133 917 A 5 THR HG2% A 4 GLY HA2 1.0 . 3.77 1134 917 A 5 THR HG2% A 4 GLY HA3 1.0 . 3.77 1135 918 A 7 GLU HG3 A 6 GLY HAy 1.0 . 5.50 1136 918 A 6 GLY HAy A 7 GLU HG2 1.0 . 5.50 1137 919 A 7 GLU HG3 A 6 GLY HAx 1.0 . 5.50 1138 919 A 6 GLY HAx A 7 GLU HG2 1.0 . 5.50 1139 920 A 21 ARG HA A 21 ARG HD2 1.0 . 4.32 1140 920 A 21 ARG HA A 21 ARG HD3 1.0 . 4.32 1141 921 A 21 ARG HA A 20 VAL HB 1.0 . 4.74 1142 922 A 70 LYS HDy A 72 GLU HGx 1.0 . 5.47 1143 923 A 9 LYS HE3 A 9 LYS HBx 1.0 . 3.93 1144 923 A 9 LYS HBx A 9 LYS HE2 1.0 . 3.93 1145 924 A 25 ALA HB% A 28 VAL HB 1.0 . 4.66 1146 925 A 45 ALA HB% A 58 LEU HBx 1.0 . 3.96 1147 926 A 82 LEU H A 82 LEU HDy% 1.0 . 3.75 1148 927 A 12 LEU H A 12 LEU HG 1.0 . 4.98 1149 928 A 48 LYS HDy A 27 ASN HD2x 1.0 . 5.41 1150 929 A 48 LYS HDx A 27 ASN HD2x 1.0 . 5.25 1151 930 A 84 ILE HG1y A 84 ILE H 1.0 . 4.19 1152 931 A 16 VAL HGx% A 16 VAL HA 1.0 . 3.20 1153 932 A 16 VAL HGx% A 24 PRO HA 1.0 . 5.12 1154 933 A 16 VAL HGx% A 25 ALA HB% 1.0 . 2.81 1155 934 A 17 LEU HG A 17 LEU HA 1.0 . 3.72 1156 935 A 17 LEU HBx A 110 MET HGy 1.0 . 4.76 1157 936 A 17 LEU HBx A 110 MET HBx 1.0 . 4.96 1158 937 A 17 LEU HBx A 15 LYS HG2 1.0 . 5.50 1159 937 A 17 LEU HBx A 15 LYS HG3 1.0 . 5.50 1160 938 A 24 PRO HA A 17 LEU HBy 1.0 . 4.93 1161 939 A 84 ILE HG1y A 79 TRP HE3 1.0 . 4.53 1162 940 A 18 ASP HA A 111 LEU HBy 1.0 . 4.55 1163 941 A 111 LEU HDy% A 18 ASP HA 1.0 . 4.72 1164 942 A 29 ALA HA A 47 GLY HAy 1.0 . 5.32 1165 943 A 19 ALA HB% A 79 TRP HZ2 1.0 . 5.50 1166 944 A 36 ALA HB% A 35 LYS HG2 1.0 . 4.69 1167 944 A 36 ALA HB% A 35 LYS HG3 1.0 . 4.69 1168 945 A 20 VAL HA A 21 ARG HGx 1.0 . 5.50 1169 946 A 20 VAL HA A 19 ALA HA 1.0 . 4.71 1170 947 A 21 ARG HBx A 20 VAL HB 1.0 . 5.15 1171 948 A 20 VAL HGy% A 112 SER HBy 1.0 . 4.45 1172 949 A 94 VAL HGx% A 95 PHE HA 1.0 . 3.84 1173 950 A 20 VAL HB A 21 ARG HD2 1.0 . 4.72 1174 950 A 20 VAL HB A 21 ARG HD3 1.0 . 4.72 1175 951 A 21 ARG HBy A 21 ARG HD2 1.0 . 3.05 1176 951 A 21 ARG HBy A 21 ARG HD3 1.0 . 3.05 1177 952 A 21 ARG HGy A 21 ARG HD2 1.0 . 2.85 1178 952 A 21 ARG HD3 A 21 ARG HGy 1.0 . 2.85 1179 953 A 21 ARG HGx A 21 ARG HD2 1.0 . 2.79 1180 953 A 21 ARG HD3 A 21 ARG HGx 1.0 . 2.79 1181 954 A 21 ARG HBx A 21 ARG HD2 1.0 . 3.07 1182 954 A 21 ARG HBx A 21 ARG HD3 1.0 . 3.07 1183 955 A 20 VAL HGx% A 21 ARG HD2 1.0 . 4.39 1184 955 A 20 VAL HGx% A 21 ARG HD3 1.0 . 4.39 1185 956 A 21 ARG HD2 A 82 LEU HDy% 1.0 . 3.92 1186 956 A 21 ARG HD3 A 82 LEU HDy% 1.0 . 3.92 1187 957 A 25 ALA HB% A 21 ARG HD2 1.0 . 5.28 1188 957 A 25 ALA HB% A 21 ARG HD3 1.0 . 5.28 1189 958 A 84 ILE HD1% A 21 ARG HD2 1.0 . 4.65 1190 958 A 21 ARG HD3 A 84 ILE HD1% 1.0 . 4.65 1191 959 A 21 ARG HA A 21 ARG HGy 1.0 . 3.45 1192 960 A 20 VAL HB A 21 ARG HGx 1.0 . 4.37 1193 961 A 20 VAL HB A 21 ARG HGy 1.0 . 4.22 1194 962 A 20 VAL HGx% A 21 ARG HGy 1.0 . 3.73 1195 963 A 24 PRO HGx A 17 LEU HDx% 1.0 . 4.65 1196 964 A 24 PRO HGx A 17 LEU HDy% 1.0 . 4.65 1197 965 A 23 SER HA A 22 GLY HAy 1.0 . 4.58 1198 966 A 23 SER HA A 22 GLY HAx 1.0 . 4.91 1199 967 A 20 VAL H A 22 GLY HAy 1.0 . 5.50 1200 968 A 23 SER HA A 24 PRO HGx 1.0 . 4.73 1201 969 A 36 ALA HA A 40 THR H 1.0 . 4.93 1202 970 A 36 ALA HA A 42 GLU HBx 1.0 . 4.82 1203 971 A 111 LEU HDy% A 25 ALA HA 1.0 . 5.40 1204 972 A 25 ALA HB% A 78 TYR HE% 1.0 . 4.84 1205 972 A 25 ALA HB% A 78 TYR HD% 1.0 . 4.84 1206 973 A 28 VAL H A 25 ALA HB% 1.0 . 4.92 1207 974 A 16 VAL H A 25 ALA HB% 1.0 . 5.46 1208 975 A 68 ILE HD1% A 97 ALA H 1.0 . 5.04 1209 976 A 68 ILE HD1% A 67 GLY H 1.0 . 5.19 1210 977 A 26 ILE HA A 26 ILE HG1y 1.0 . 3.93 1211 978 A 27 ASN HA A 48 LYS HB2 1.0 . 3.23 1212 978 A 27 ASN HA A 48 LYS HB3 1.0 . 3.23 1213 979 A 48 LYS HGx A 27 ASN HA 1.0 . 5.03 1214 980 A 28 VAL HA A 27 ASN HBy 1.0 . 4.97 1215 981 A 45 ALA H A 58 LEU HDx% 1.0 . 5.50 1216 982 A 28 VAL HGy% A 27 ASN HBx 1.0 . 4.98 1217 983 A 46 SER HBy A 31 HIS HBx 1.0 . 4.71 1218 984 A 45 ALA HA A 46 SER HBx 1.0 . 4.30 1219 985 A 41 TRP HD1 A 40 THR HB 1.0 . 5.43 1220 986 A 35 LYS HBy A 68 ILE H 1.0 . 4.82 1221 987 A 34 ARG HA A 35 LYS HBy 1.0 . 5.06 1222 988 A 35 LYS HG3 A 39 ASP HB2 1.0 . 5.50 1223 988 A 39 ASP HB3 A 35 LYS HG2 1.0 . 5.50 1224 988 A 35 LYS HG3 A 39 ASP HB3 1.0 . 5.50 1225 988 A 35 LYS HG2 A 39 ASP HB2 1.0 . 5.50 1226 989 A 41 TRP HE3 A 35 LYS HG2 1.0 . 5.50 1227 989 A 41 TRP HE3 A 35 LYS HG3 1.0 . 5.50 1228 990 A 36 ALA H A 40 THR HA 1.0 . 4.76 1229 991 A 36 ALA H A 41 TRP HBx 1.0 . 5.50 1230 992 A 33 PHE HE% A 43 PRO HDy 1.0 . 4.59 1231 993 A 33 PHE HD% A 43 PRO HDy 1.0 . 4.79 1232 994 A 44 PHE H A 43 PRO HDy 1.0 . 5.50 1233 995 A 42 GLU HA A 43 PRO HDx 1.0 . 3.12 1234 996 A 33 PHE HA A 41 TRP HE3 1.0 . 5.17 1235 997 A 44 PHE HBy A 34 ARG H 1.0 . 4.89 1236 998 A 44 PHE HBx A 34 ARG H 1.0 . 4.96 1237 999 A 69 TYR HD% A 44 PHE HBy 1.0 . 5.19 1238 1000 A 33 PHE HA A 34 ARG HBx 1.0 . 5.50 1239 1001 A 69 TYR HA A 34 ARG HBy 1.0 . 5.49 1240 1002 A 96 THR HB A 95 PHE HB2 1.0 . 5.50 1241 1002 A 95 PHE HB3 A 96 THR HB 1.0 . 5.50 1242 1003 A 30 VAL HA A 72 GLU HBy 1.0 . 5.50 1243 1004 A 30 VAL HA A 31 HIS HBy 1.0 . 5.04 1244 1005 A 30 VAL HA A 31 HIS HBx 1.0 . 5.50 1245 1006 A 33 PHE HD% A 41 TRP HBx 1.0 . 4.37 1246 1007 A 33 PHE HE% A 31 HIS HBx 1.0 . 3.89 1247 1008 A 31 HIS HBy A 33 PHE HE% 1.0 . 3.95 1248 1009 A 109 ALA H A 15 LYS HBy 1.0 . 4.68 1249 1010 A 27 ASN HBx A 48 LYS HDx 1.0 . 4.60 1250 1011 A 108 ALA HA A 106 THR HG2% 1.0 . 4.25 1251 1012 A 47 GLY HAy A 46 SER HBx 1.0 . 5.25 1252 1013 A 33 PHE HA A 34 ARG HBy 1.0 . 5.50 1253 1014 A 41 TRP HZ3 A 34 ARG HA 1.0 . 4.54 1254 1015 A 69 TYR HA A 34 ARG HA 1.0 . 3.91 1255 1016 A 18 ASP HBx A 17 LEU HA 1.0 . 5.14 1256 1017 A 36 ALA H A 37 ALA HA 1.0 . 5.50 1257 1018 A 37 ALA HA A 40 THR H 1.0 . 5.46 1258 1019 A 37 ALA HA A 35 LYS HD2 1.0 . 4.92 1259 1019 A 35 LYS HD3 A 37 ALA HA 1.0 . 4.92 1260 1020 A 49 THR HB A 54 GLU H 1.0 . 4.94 1261 1021 A 111 LEU HDx% A 110 MET HGy 1.0 . 5.34 1262 1022 A 79 TRP HE3 A 21 ARG HD2 1.0 . 5.50 1263 1022 A 21 ARG HD3 A 79 TRP HE3 1.0 . 5.50 1264 1023 A 46 SER HA A 30 VAL HB 1.0 . 4.64 1265 1024 A 46 SER HA A 45 ALA HB% 1.0 . 4.37 1266 1025 A 46 SER HA A 47 GLY HAy 1.0 . 4.90 1267 1026 A 46 SER HA A 31 HIS HA 1.0 . 3.66 1268 1027 A 31 HIS HBy A 46 SER HBy 1.0 . 5.20 1269 1028 A 45 ALA HB% A 46 SER HBx 1.0 . 4.59 1270 1029 A 32 VAL HGy% A 46 SER HBx 1.0 . 5.50 1271 1030 A 48 LYS HA A 28 VAL HGy% 1.0 . 5.49 1272 1031 A 48 LYS HDx A 48 LYS H 1.0 . 5.26 1273 1032 A 48 LYS HGy A 29 ALA HA 1.0 . 3.98 1274 1033 A 26 ILE HA A 49 THR HB 1.0 . 4.58 1275 1034 A 49 THR HB A 53 GLY HAx 1.0 . 4.83 1276 1035 A 49 THR HG2% A 54 GLU H 1.0 . 4.91 1277 1036 A 58 LEU HBy A 58 LEU HDx% 1.0 . 3.45 1278 1037 A 46 SER H A 58 LEU HBx 1.0 . 5.50 1279 1038 A 28 VAL HGx% A 74 ASP H 1.0 . 4.15 1280 1039 A 60 THR HB A 63 GLU HBy 1.0 . 5.50 1281 1040 A 60 THR HB A 59 THR HB 1.0 . 5.50 1282 1041 A 62 GLU H A 62 GLU HBy 1.0 . 3.68 1283 1042 A 17 LEU HBy A 110 MET HGx 1.0 . 4.51 1284 1043 A 36 ALA HB% A 42 GLU HBx 1.0 . 3.48 1285 1044 A 43 PRO HDx A 42 GLU HBx 1.0 . 3.93 1286 1045 A 64 PHE HD% A 63 GLU HG2 1.0 . 5.43 1287 1045 A 63 GLU HG3 A 64 PHE HD% 1.0 . 5.43 1288 1046 A 68 ILE HB A 35 LYS HG2 1.0 . 4.93 1289 1046 A 35 LYS HG3 A 68 ILE HB 1.0 . 4.93 1290 1047 A 68 ILE HD1% A 96 THR HB 1.0 . 5.50 1291 1048 A 84 ILE HA A 84 ILE HG1x 1.0 . 3.80 1292 1049 A 70 LYS HDy A 72 GLU HGy 1.0 . 5.47 1293 1050 A 45 ALA H A 43 PRO HBy 1.0 . 5.21 1294 1051 A 73 ILE H A 90 HIS HA 1.0 . 5.38 1295 1052 A 106 THR H A 122 VAL HGy% 1.0 . 3.92 1296 1053 A 41 TRP HH2 A 94 VAL HA 1.0 . 4.89 1297 1054 A 32 VAL HGy% A 69 TYR HD% 1.0 . 5.50 1298 1055 A 95 PHE HE% A 94 VAL HGy% 1.0 . 5.50 1299 1056 A 68 ILE HG2% A 96 THR HB 1.0 . 4.34 1300 1057 A 15 LYS HBx A 106 THR HG2% 1.0 . 3.66 1301 1058 A 123 THR HG2% A 122 VAL HA 1.0 . 4.16 1302 1059 A 108 ALA HA A 15 LYS HBy 1.0 . 4.57 1303 1060 A 15 LYS HBx A 108 ALA HA 1.0 . 4.83 1304 1061 A 121 VAL HA A 121 VAL HGx% 1.0 . 3.85 1305 1062 A 121 VAL HGx% A 95 PHE HB2 1.0 . 4.79 1306 1062 A 95 PHE HB3 A 121 VAL HGx% 1.0 . 4.79 1307 1063 A 3 THR HG2% A 3 THR H 1.0 . 3.62 1308 1064 A 3 THR H A 2 PRO HBx 1.0 . 4.38 1309 1065 A 3 THR H A 2 PRO HGx 1.0 . 4.59 1310 1066 A 2 PRO HBy A 3 THR H 1.0 . 4.18 1311 1067 A 5 THR HG2% A 5 THR H 1.0 . 3.42 1312 1068 A 53 GLY H A 52 SER H 1.0 . 3.25 1313 1069 A 51 GLU H A 52 SER H 1.0 . 3.68 1314 1070 A 52 SER H A 54 GLU H 1.0 . 3.93 1315 1071 A 3 THR HG2% A 4 GLY H 1.0 . 4.39 1316 1072 A 5 THR HG2% A 6 GLY H 1.0 . 4.23 1317 1073 A 7 GLU H A 7 GLU HG2 1.0 . 3.52 1318 1073 A 7 GLU HG3 A 7 GLU H 1.0 . 3.52 1319 1074 A 8 SER H A 8 SER HB2 1.0 . 3.10 1320 1074 A 8 SER HB3 A 8 SER H 1.0 . 3.10 1321 1075 A 7 GLU HA A 8 SER H 1.0 . 2.70 1322 1076 A 10 CYS H A 10 CYS HB2 1.0 . 4.10 1323 1076 A 10 CYS H A 10 CYS HB3 1.0 . 4.10 1324 1077 A 12 LEU H A 11 PRO HBx 1.0 . 4.56 1325 1078 A 12 LEU H A 11 PRO HBy 1.0 . 4.56 1326 1079 A 12 LEU H A 12 LEU HB2 1.0 . 3.82 1327 1079 A 12 LEU H A 12 LEU HB3 1.0 . 3.82 1328 1080 A 13 MET H A 12 LEU HG 1.0 . 5.07 1329 1081 A 13 MET H A 12 LEU HDy% 1.0 . 4.66 1330 1082 A 13 MET H A 12 LEU HDx% 1.0 . 4.66 1331 1083 A 17 LEU H A 16 VAL H 1.0 . 4.55 1332 1084 A 16 VAL H A 54 GLU HA 1.0 . 4.26 1333 1085 A 16 VAL H A 15 LYS HA 1.0 . 3.24 1334 1086 A 16 VAL H A 49 THR HB 1.0 . 4.99 1335 1087 A 16 VAL H A 53 GLY HAy 1.0 . 5.14 1336 1088 A 16 VAL H A 16 VAL HB 1.0 . 3.62 1337 1089 A 16 VAL H A 15 LYS HBy 1.0 . 4.33 1338 1090 A 16 VAL H A 15 LYS HD2 1.0 . 4.17 1339 1090 A 16 VAL H A 15 LYS HD3 1.0 . 4.17 1340 1091 A 16 VAL H A 15 LYS HG2 1.0 . 3.65 1341 1091 A 16 VAL H A 15 LYS HG3 1.0 . 3.65 1342 1092 A 16 VAL H A 13 MET HE% 1.0 . 5.20 1343 1093 A 16 VAL H A 53 GLY HAx 1.0 . 4.72 1344 1094 A 17 LEU H A 18 ASP H 1.0 . 4.88 1345 1095 A 17 LEU H A 110 MET H 1.0 . 5.36 1346 1096 A 25 ALA H A 18 ASP H 1.0 . 4.10 1347 1097 A 19 ALA H A 18 ASP H 1.0 . 5.01 1348 1098 A 18 ASP H A 22 GLY H 1.0 . 4.37 1349 1099 A 18 ASP HBx A 18 ASP H 1.0 . 3.53 1350 1100 A 18 ASP H A 18 ASP HBy 1.0 . 3.42 1351 1101 A 19 ALA H A 20 VAL H 1.0 . 3.42 1352 1102 A 21 ARG H A 19 ALA H 1.0 . 4.14 1353 1103 A 19 ALA H A 79 TRP HZ2 1.0 . 5.31 1354 1104 A 110 MET HA A 19 ALA H 1.0 . 4.46 1355 1105 A 19 ALA H A 112 SER HA 1.0 . 4.89 1356 1106 A 18 ASP HA A 19 ALA H 1.0 . 3.18 1357 1107 A 19 ALA H A 20 VAL HA 1.0 . 5.16 1358 1108 A 19 ALA H A 18 ASP HBy 1.0 . 4.61 1359 1109 A 19 ALA H A 20 VAL HB 1.0 . 4.66 1360 1110 A 18 ASP HBx A 19 ALA H 1.0 . 4.33 1361 1111 A 19 ALA H A 20 VAL HGy% 1.0 . 4.14 1362 1112 A 111 LEU HDx% A 19 ALA H 1.0 . 4.83 1363 1113 A 21 ARG H A 20 VAL H 1.0 . 3.06 1364 1114 A 20 VAL H A 23 SER H 1.0 . 5.50 1365 1115 A 79 TRP HH2 A 20 VAL H 1.0 . 4.58 1366 1116 A 20 VAL H A 112 SER HA 1.0 . 4.70 1367 1117 A 18 ASP HA A 20 VAL H 1.0 . 4.14 1368 1118 A 21 ARG HA A 20 VAL H 1.0 . 5.10 1369 1119 A 20 VAL HB A 20 VAL H 1.0 . 3.15 1370 1120 A 20 VAL H A 110 MET HE% 1.0 . 4.77 1371 1121 A 20 VAL H A 21 ARG HGy 1.0 . 4.08 1372 1122 A 19 ALA HB% A 20 VAL H 1.0 . 3.55 1373 1123 A 20 VAL H A 20 VAL HGy% 1.0 . 3.05 1374 1124 A 21 ARG H A 23 SER H 1.0 . 4.28 1375 1125 A 21 ARG H A 18 ASP HBy 1.0 . 4.44 1376 1126 A 21 ARG H A 20 VAL HB 1.0 . 3.34 1377 1127 A 21 ARG H A 18 ASP HBx 1.0 . 4.46 1378 1128 A 21 ARG H A 21 ARG HGy 1.0 . 3.52 1379 1129 A 21 ARG H A 21 ARG HGx 1.0 . 3.61 1380 1130 A 21 ARG H A 21 ARG HBx 1.0 . 3.44 1381 1131 A 21 ARG H A 19 ALA HB% 1.0 . 4.85 1382 1132 A 21 ARG H A 20 VAL HGx% 1.0 . 3.50 1383 1133 A 20 VAL H A 22 GLY H 1.0 . 3.62 1384 1134 A 19 ALA H A 22 GLY H 1.0 . 4.84 1385 1135 A 22 GLY H A 21 ARG HD2 1.0 . 5.14 1386 1135 A 21 ARG HD3 A 22 GLY H 1.0 . 5.14 1387 1136 A 18 ASP HBy A 22 GLY H 1.0 . 4.40 1388 1137 A 20 VAL HB A 22 GLY H 1.0 . 5.14 1389 1138 A 18 ASP HBx A 22 GLY H 1.0 . 4.49 1390 1139 A 21 ARG HBy A 22 GLY H 1.0 . 4.51 1391 1140 A 21 ARG HGy A 22 GLY H 1.0 . 4.22 1392 1141 A 22 GLY H A 21 ARG HGx 1.0 . 5.00 1393 1142 A 21 ARG HBx A 22 GLY H 1.0 . 3.77 1394 1143 A 19 ALA HB% A 22 GLY H 1.0 . 5.01 1395 1144 A 20 VAL HGx% A 22 GLY H 1.0 . 5.02 1396 1145 A 23 SER HA A 22 GLY H 1.0 . 5.36 1397 1146 A 19 ALA HA A 22 GLY H 1.0 . 3.72 1398 1147 A 18 ASP H A 23 SER H 1.0 . 3.66 1399 1148 A 23 SER H A 22 GLY H 1.0 . 3.10 1400 1149 A 21 ARG HA A 23 SER H 1.0 . 4.78 1401 1150 A 23 SER H A 22 GLY HAy 1.0 . 3.46 1402 1151 A 23 SER H A 23 SER HBx 1.0 . 4.06 1403 1152 A 23 SER H A 21 ARG HD2 1.0 . 4.76 1404 1152 A 21 ARG HD3 A 23 SER H 1.0 . 4.76 1405 1153 A 23 SER H A 18 ASP HBy 1.0 . 3.89 1406 1154 A 18 ASP HBx A 23 SER H 1.0 . 4.36 1407 1155 A 21 ARG HBy A 23 SER H 1.0 . 3.91 1408 1156 A 26 ILE H A 78 TYR HE% 1.0 . 5.50 1409 1156 A 26 ILE H A 78 TYR HD% 1.0 . 5.50 1410 1157 A 25 ALA H A 17 LEU HA 1.0 . 3.70 1411 1158 A 25 ALA HA A 26 ILE H 1.0 . 3.24 1412 1159 A 25 ALA H A 53 GLY HAy 1.0 . 4.49 1413 1160 A 78 TYR HBx A 26 ILE H 1.0 . 5.06 1414 1161 A 26 ILE HB A 26 ILE H 1.0 . 3.53 1415 1162 A 26 ILE H A 26 ILE HG1y 1.0 . 4.17 1416 1163 A 26 ILE H A 26 ILE HG1x 1.0 . 4.17 1417 1164 A 25 ALA H A 25 ALA HB% 1.0 . 3.44 1418 1165 A 27 ASN H A 49 THR H 1.0 . 4.40 1419 1166 A 85 SER H A 84 ILE H 1.0 . 4.72 1420 1167 A 83 GLY H A 84 ILE H 1.0 . 2.99 1421 1168 A 27 ASN H A 27 ASN HD2y 1.0 . 4.42 1422 1169 A 84 ILE H A 79 TRP HE3 1.0 . 4.25 1423 1170 A 26 ILE HA A 27 ASN H 1.0 . 3.31 1424 1171 A 84 ILE H A 79 TRP HBy 1.0 . 4.63 1425 1172 A 84 ILE H A 79 TRP HBx 1.0 . 4.63 1426 1173 A 84 ILE HB A 84 ILE H 1.0 . 3.09 1427 1174 A 26 ILE HB A 27 ASN H 1.0 . 4.13 1428 1175 A 27 ASN H A 48 LYS HB2 1.0 . 4.11 1429 1175 A 27 ASN H A 48 LYS HB3 1.0 . 4.11 1430 1176 A 84 ILE HG1x A 84 ILE H 1.0 . 4.51 1431 1177 A 84 ILE H A 84 ILE HG2% 1.0 . 3.62 1432 1178 A 27 ASN H A 50 SER HA 1.0 . 4.22 1433 1179 A 27 ASN HBx A 27 ASN HD2y 1.0 . 3.78 1434 1180 A 27 ASN HD2y A 48 LYS HB2 1.0 . 4.81 1435 1180 A 48 LYS HB3 A 27 ASN HD2y 1.0 . 4.81 1436 1181 A 26 ILE HD1% A 27 ASN HD2y 1.0 . 4.99 1437 1182 A 26 ILE HG2% A 27 ASN HD2y 1.0 . 3.65 1438 1183 A 27 ASN HA A 27 ASN HD2y 1.0 . 4.29 1439 1184 A 27 ASN HBx A 27 ASN HD2x 1.0 . 3.36 1440 1185 A 28 VAL H A 27 ASN H 1.0 . 3.61 1441 1186 A 28 VAL H A 48 LYS HA 1.0 . 4.21 1442 1187 A 28 VAL H A 49 THR HB 1.0 . 4.32 1443 1188 A 28 VAL H A 26 ILE HA 1.0 . 3.82 1444 1189 A 28 VAL H A 27 ASN HBy 1.0 . 4.39 1445 1190 A 28 VAL H A 28 VAL HB 1.0 . 3.34 1446 1191 A 28 VAL H A 48 LYS HB2 1.0 . 3.74 1447 1191 A 28 VAL H A 48 LYS HB3 1.0 . 3.74 1448 1192 A 28 VAL H A 49 THR HG2% 1.0 . 3.51 1449 1193 A 28 VAL H A 28 VAL HGx% 1.0 . 3.93 1450 1194 A 28 VAL H A 28 VAL HGy% 1.0 . 3.36 1451 1195 A 29 ALA H A 30 VAL H 1.0 . 4.86 1452 1196 A 29 ALA H A 74 ASP H 1.0 . 5.25 1453 1197 A 41 TRP HZ3 A 35 LYS H 1.0 . 3.81 1454 1198 A 69 TYR HD% A 35 LYS H 1.0 . 4.72 1455 1199 A 41 TRP HE3 A 35 LYS H 1.0 . 4.14 1456 1200 A 48 LYS HA A 29 ALA H 1.0 . 4.54 1457 1201 A 69 TYR HA A 35 LYS H 1.0 . 3.97 1458 1202 A 34 ARG HA A 35 LYS H 1.0 . 3.35 1459 1203 A 28 VAL HA A 29 ALA H 1.0 . 3.26 1460 1204 A 29 ALA H A 27 ASN HBy 1.0 . 5.50 1461 1205 A 29 ALA H A 48 LYS HE2 1.0 . 4.76 1462 1205 A 48 LYS HE3 A 29 ALA H 1.0 . 4.76 1463 1206 A 35 LYS H A 35 LYS HE2 1.0 . 5.10 1464 1206 A 35 LYS HE3 A 35 LYS H 1.0 . 5.10 1465 1207 A 35 LYS HBy A 35 LYS H 1.0 . 3.43 1466 1208 A 68 ILE HB A 35 LYS H 1.0 . 3.93 1467 1209 A 35 LYS H A 34 ARG HG2 1.0 . 3.61 1468 1209 A 34 ARG HG3 A 35 LYS H 1.0 . 3.61 1469 1210 A 35 LYS H A 35 LYS HD2 1.0 . 4.50 1470 1210 A 35 LYS HD3 A 35 LYS H 1.0 . 4.50 1471 1211 A 35 LYS HBx A 35 LYS H 1.0 . 3.41 1472 1212 A 29 ALA H A 28 VAL HGx% 1.0 . 3.31 1473 1213 A 35 LYS H A 35 LYS HG2 1.0 . 4.28 1474 1213 A 35 LYS HG3 A 35 LYS H 1.0 . 4.28 1475 1214 A 31 HIS H A 72 GLU H 1.0 . 3.82 1476 1215 A 33 PHE HE% A 31 HIS H 1.0 . 5.01 1477 1216 A 72 GLU HA A 31 HIS H 1.0 . 4.84 1478 1217 A 71 VAL HA A 31 HIS H 1.0 . 4.52 1479 1218 A 30 VAL HA A 31 HIS H 1.0 . 2.98 1480 1219 A 46 SER HA A 31 HIS H 1.0 . 4.96 1481 1220 A 31 HIS HBy A 31 HIS H 1.0 . 3.72 1482 1221 A 31 HIS H A 31 HIS HBx 1.0 . 4.09 1483 1222 A 72 GLU HBy A 31 HIS H 1.0 . 4.88 1484 1223 A 72 GLU HBx A 31 HIS H 1.0 . 4.49 1485 1224 A 30 VAL HB A 31 HIS H 1.0 . 3.98 1486 1225 A 71 VAL HGy% A 31 HIS H 1.0 . 5.08 1487 1226 A 32 VAL HGy% A 31 HIS H 1.0 . 4.11 1488 1227 A 30 VAL HGx% A 31 HIS H 1.0 . 2.99 1489 1228 A 48 LYS HA A 30 VAL H 1.0 . 3.62 1490 1229 A 30 VAL H A 29 ALA HA 1.0 . 2.82 1491 1230 A 30 VAL H A 30 VAL HB 1.0 . 2.83 1492 1231 A 32 VAL H A 31 HIS H 1.0 . 4.56 1493 1232 A 44 PHE H A 32 VAL H 1.0 . 4.63 1494 1233 A 32 VAL H A 47 GLY H 1.0 . 5.37 1495 1234 A 32 VAL H A 33 PHE HE% 1.0 . 4.18 1496 1235 A 32 VAL H A 33 PHE HD% 1.0 . 4.69 1497 1236 A 32 VAL H A 72 GLU H 1.0 . 5.06 1498 1237 A 46 SER HA A 32 VAL H 1.0 . 3.76 1499 1238 A 32 VAL H A 31 HIS HA 1.0 . 3.04 1500 1239 A 32 VAL H A 45 ALA HA 1.0 . 5.02 1501 1240 A 32 VAL H A 46 SER HBy 1.0 . 4.07 1502 1241 A 32 VAL H A 46 SER HBx 1.0 . 4.79 1503 1242 A 32 VAL H A 31 HIS HBy 1.0 . 4.00 1504 1243 A 32 VAL H A 31 HIS HBx 1.0 . 3.82 1505 1244 A 32 VAL H A 44 PHE HBx 1.0 . 4.65 1506 1245 A 32 VAL H A 32 VAL HB 1.0 . 3.51 1507 1246 A 32 VAL H A 32 VAL HGx% 1.0 . 3.96 1508 1247 A 32 VAL H A 71 VAL HGy% 1.0 . 5.16 1509 1248 A 32 VAL H A 32 VAL HGy% 1.0 . 3.26 1510 1249 A 32 VAL H A 30 VAL HGx% 1.0 . 5.18 1511 1250 A 34 ARG H A 33 PHE H 1.0 . 4.56 1512 1251 A 44 PHE H A 33 PHE H 1.0 . 4.76 1513 1252 A 70 LYS H A 33 PHE H 1.0 . 3.79 1514 1253 A 45 ALA H A 33 PHE H 1.0 . 5.08 1515 1254 A 33 PHE HE% A 33 PHE H 1.0 . 5.36 1516 1255 A 33 PHE H A 44 PHE HE% 1.0 . 5.50 1517 1255 A 44 PHE HD% A 33 PHE H 1.0 . 5.50 1518 1256 A 41 TRP HE3 A 33 PHE H 1.0 . 5.11 1519 1257 A 33 PHE HD% A 33 PHE H 1.0 . 3.69 1520 1258 A 69 TYR HD% A 33 PHE H 1.0 . 4.62 1521 1259 A 32 VAL HA A 33 PHE H 1.0 . 3.22 1522 1260 A 69 TYR HA A 33 PHE H 1.0 . 5.04 1523 1261 A 70 LYS HA A 33 PHE H 1.0 . 5.45 1524 1262 A 71 VAL HA A 33 PHE H 1.0 . 4.24 1525 1263 A 33 PHE HBx A 33 PHE H 1.0 . 4.01 1526 1264 A 32 VAL HB A 33 PHE H 1.0 . 4.54 1527 1265 A 69 TYR HBy A 33 PHE H 1.0 . 4.89 1528 1266 A 32 VAL HGx% A 33 PHE H 1.0 . 3.33 1529 1267 A 71 VAL HGy% A 33 PHE H 1.0 . 4.28 1530 1268 A 32 VAL HGy% A 33 PHE H 1.0 . 4.47 1531 1269 A 70 LYS HBy A 33 PHE H 1.0 . 4.14 1532 1270 A 70 LYS HBx A 33 PHE H 1.0 . 5.04 1533 1271 A 42 GLU H A 34 ARG H 1.0 . 3.55 1534 1272 A 44 PHE H A 34 ARG H 1.0 . 4.11 1535 1273 A 35 LYS H A 34 ARG H 1.0 . 4.49 1536 1274 A 41 TRP HE3 A 34 ARG H 1.0 . 3.92 1537 1275 A 33 PHE HD% A 34 ARG H 1.0 . 4.08 1538 1276 A 69 TYR HD% A 34 ARG H 1.0 . 4.75 1539 1277 A 33 PHE HA A 34 ARG H 1.0 . 3.19 1540 1278 A 69 TYR HA A 34 ARG H 1.0 . 4.78 1541 1279 A 42 GLU HA A 34 ARG H 1.0 . 4.64 1542 1280 A 41 TRP HA A 34 ARG H 1.0 . 4.18 1543 1281 A 43 PRO HA A 34 ARG H 1.0 . 4.54 1544 1282 A 33 PHE HBy A 34 ARG H 1.0 . 3.66 1545 1283 A 33 PHE HBx A 34 ARG H 1.0 . 3.82 1546 1284 A 34 ARG H A 42 GLU HG2 1.0 . 5.10 1547 1284 A 42 GLU HG3 A 34 ARG H 1.0 . 5.10 1548 1285 A 42 GLU HBy A 34 ARG H 1.0 . 4.34 1549 1286 A 42 GLU HBx A 34 ARG H 1.0 . 3.96 1550 1287 A 34 ARG H A 34 ARG HBy 1.0 . 3.85 1551 1288 A 34 ARG H A 34 ARG HG2 1.0 . 4.09 1552 1288 A 34 ARG HG3 A 34 ARG H 1.0 . 4.09 1553 1289 A 34 ARG H A 34 ARG HBx 1.0 . 3.85 1554 1290 A 36 ALA H A 35 LYS HA 1.0 . 2.88 1555 1291 A 36 ALA H A 42 GLU H 1.0 . 3.83 1556 1292 A 36 ALA H A 37 ALA H 1.0 . 4.56 1557 1293 A 36 ALA H A 41 TRP HE3 1.0 . 4.86 1558 1294 A 36 ALA H A 41 TRP HA 1.0 . 3.52 1559 1295 A 36 ALA H A 35 LYS HG2 1.0 . 3.78 1560 1295 A 36 ALA H A 35 LYS HG3 1.0 . 3.78 1561 1296 A 36 ALA H A 35 LYS HD2 1.0 . 3.29 1562 1296 A 36 ALA H A 35 LYS HD3 1.0 . 3.29 1563 1297 A 36 ALA H A 35 LYS HBx 1.0 . 4.48 1564 1298 A 36 ALA H A 35 LYS HE2 1.0 . 4.66 1565 1298 A 36 ALA H A 35 LYS HE3 1.0 . 4.66 1566 1299 A 36 ALA H A 42 GLU HBx 1.0 . 4.92 1567 1300 A 38 ASP H A 39 ASP H 1.0 . 2.90 1568 1301 A 36 ALA H A 38 ASP H 1.0 . 4.40 1569 1302 A 37 ALA H A 38 ASP H 1.0 . 3.33 1570 1303 A 38 ASP H A 38 ASP HBy 1.0 . 3.26 1571 1304 A 38 ASP H A 38 ASP HBx 1.0 . 3.26 1572 1305 A 38 ASP H A 40 THR HG2% 1.0 . 4.11 1573 1306 A 38 ASP H A 35 LYS HD2 1.0 . 4.59 1574 1306 A 35 LYS HD3 A 38 ASP H 1.0 . 4.59 1575 1307 A 36 ALA H A 39 ASP H 1.0 . 4.78 1576 1308 A 37 ALA H A 39 ASP H 1.0 . 4.56 1577 1309 A 39 ASP H A 38 ASP HA 1.0 . 3.25 1578 1310 A 37 ALA HA A 39 ASP H 1.0 . 3.64 1579 1311 A 39 ASP HA A 39 ASP H 1.0 . 2.63 1580 1312 A 39 ASP H A 39 ASP HB2 1.0 . 3.31 1581 1312 A 39 ASP HB3 A 39 ASP H 1.0 . 3.31 1582 1313 A 39 ASP H A 38 ASP HBx 1.0 . 4.55 1583 1314 A 39 ASP H A 35 LYS HE2 1.0 . 4.79 1584 1314 A 35 LYS HE3 A 39 ASP H 1.0 . 4.79 1585 1315 A 36 ALA HB% A 39 ASP H 1.0 . 3.86 1586 1316 A 39 ASP H A 40 THR HG2% 1.0 . 4.32 1587 1317 A 39 ASP H A 35 LYS HD2 1.0 . 3.49 1588 1317 A 35 LYS HD3 A 39 ASP H 1.0 . 3.49 1589 1318 A 39 ASP H A 35 LYS HG2 1.0 . 4.63 1590 1318 A 35 LYS HG3 A 39 ASP H 1.0 . 4.63 1591 1319 A 40 THR H A 35 LYS HG2 1.0 . 4.80 1592 1319 A 35 LYS HG3 A 40 THR H 1.0 . 4.80 1593 1320 A 36 ALA HB% A 40 THR H 1.0 . 3.15 1594 1321 A 40 THR HG2% A 40 THR H 1.0 . 2.91 1595 1322 A 40 THR H A 35 LYS HD2 1.0 . 3.81 1596 1322 A 35 LYS HD3 A 40 THR H 1.0 . 3.81 1597 1323 A 40 THR H A 38 ASP HBy 1.0 . 4.76 1598 1324 A 40 THR H A 38 ASP HBx 1.0 . 4.76 1599 1325 A 40 THR H A 35 LYS HE2 1.0 . 4.42 1600 1325 A 35 LYS HE3 A 40 THR H 1.0 . 4.42 1601 1326 A 38 ASP HA A 40 THR H 1.0 . 4.71 1602 1327 A 39 ASP HA A 40 THR H 1.0 . 3.22 1603 1328 A 35 LYS HA A 40 THR H 1.0 . 4.69 1604 1329 A 36 ALA H A 40 THR H 1.0 . 3.88 1605 1330 A 41 TRP H A 40 THR H 1.0 . 4.48 1606 1331 A 39 ASP H A 40 THR H 1.0 . 3.02 1607 1332 A 38 ASP H A 40 THR H 1.0 . 3.61 1608 1333 A 41 TRP H A 42 GLU H 1.0 . 4.38 1609 1334 A 36 ALA H A 41 TRP H 1.0 . 4.83 1610 1335 A 83 GLY H A 80 LYS H 1.0 . 4.51 1611 1336 A 80 LYS H A 81 ALA H 1.0 . 3.39 1612 1337 A 42 GLU HA A 41 TRP H 1.0 . 4.90 1613 1338 A 41 TRP H A 40 THR HA 1.0 . 2.65 1614 1339 A 41 TRP HBy A 41 TRP H 1.0 . 3.14 1615 1340 A 41 TRP HBx A 41 TRP H 1.0 . 3.91 1616 1341 A 41 TRP H A 42 GLU HG2 1.0 . 4.92 1617 1341 A 42 GLU HG3 A 41 TRP H 1.0 . 4.92 1618 1342 A 80 LYS H A 81 ALA HB% 1.0 . 4.07 1619 1343 A 41 TRP HE1 A 35 LYS HE2 1.0 . 4.40 1620 1343 A 35 LYS HE3 A 41 TRP HE1 1.0 . 4.40 1621 1344 A 41 TRP HBy A 41 TRP HE1 1.0 . 4.89 1622 1345 A 41 TRP HE1 A 70 LYS HG2 1.0 . 5.22 1623 1345 A 70 LYS HG3 A 41 TRP HE1 1.0 . 5.22 1624 1346 A 94 VAL HGy% A 41 TRP HE1 1.0 . 4.50 1625 1347 A 70 LYS HDy A 41 TRP HE1 1.0 . 4.33 1626 1348 A 70 LYS HDx A 41 TRP HE1 1.0 . 5.24 1627 1349 A 42 GLU H A 35 LYS H 1.0 . 4.91 1628 1350 A 41 TRP HE3 A 42 GLU H 1.0 . 4.00 1629 1351 A 33 PHE HD% A 42 GLU H 1.0 . 4.14 1630 1352 A 33 PHE HA A 42 GLU H 1.0 . 4.91 1631 1353 A 41 TRP HA A 42 GLU H 1.0 . 3.04 1632 1354 A 42 GLU H A 43 PRO HDy 1.0 . 5.21 1633 1355 A 42 GLU H A 43 PRO HDx 1.0 . 4.97 1634 1356 A 35 LYS HA A 42 GLU H 1.0 . 3.97 1635 1357 A 33 PHE HBy A 42 GLU H 1.0 . 4.14 1636 1358 A 41 TRP HBy A 42 GLU H 1.0 . 4.47 1637 1359 A 41 TRP HBx A 42 GLU H 1.0 . 3.72 1638 1360 A 42 GLU H A 42 GLU HG2 1.0 . 3.34 1639 1360 A 42 GLU HG3 A 42 GLU H 1.0 . 3.34 1640 1361 A 42 GLU H A 42 GLU HBx 1.0 . 3.19 1641 1362 A 42 GLU H A 34 ARG HBy 1.0 . 5.34 1642 1363 A 36 ALA HB% A 42 GLU H 1.0 . 4.00 1643 1364 A 42 GLU H A 34 ARG HBx 1.0 . 5.34 1644 1365 A 42 GLU H A 35 LYS HD2 1.0 . 5.33 1645 1365 A 35 LYS HD3 A 42 GLU H 1.0 . 5.33 1646 1366 A 44 PHE H A 44 PHE HE% 1.0 . 4.31 1647 1366 A 44 PHE H A 44 PHE HD% 1.0 . 4.31 1648 1367 A 44 PHE H A 33 PHE HD% 1.0 . 4.27 1649 1368 A 44 PHE H A 33 PHE HA 1.0 . 3.57 1650 1369 A 44 PHE H A 45 ALA HA 1.0 . 4.80 1651 1370 A 44 PHE H A 43 PRO HA 1.0 . 3.26 1652 1371 A 44 PHE H A 43 PRO HDx 1.0 . 5.50 1653 1372 A 44 PHE H A 44 PHE HBy 1.0 . 3.72 1654 1373 A 44 PHE H A 44 PHE HBx 1.0 . 3.69 1655 1374 A 32 VAL H A 45 ALA H 1.0 . 3.47 1656 1375 A 44 PHE H A 45 ALA H 1.0 . 3.04 1657 1376 A 45 ALA H A 46 SER H 1.0 . 4.46 1658 1377 A 45 ALA H A 44 PHE HE% 1.0 . 3.71 1659 1377 A 44 PHE HD% A 45 ALA H 1.0 . 3.71 1660 1378 A 33 PHE HD% A 45 ALA H 1.0 . 5.35 1661 1379 A 33 PHE HA A 45 ALA H 1.0 . 3.96 1662 1380 A 46 SER HA A 45 ALA H 1.0 . 5.00 1663 1381 A 45 ALA H A 46 SER HBx 1.0 . 5.26 1664 1382 A 45 ALA H A 44 PHE HBy 1.0 . 3.82 1665 1383 A 44 PHE HBx A 45 ALA H 1.0 . 3.48 1666 1384 A 45 ALA H A 32 VAL HB 1.0 . 3.28 1667 1385 A 45 ALA H A 58 LEU HBy 1.0 . 5.50 1668 1386 A 45 ALA HB% A 45 ALA H 1.0 . 3.03 1669 1387 A 32 VAL HGy% A 45 ALA H 1.0 . 4.00 1670 1388 A 45 ALA H A 58 LEU HDy% 1.0 . 5.50 1671 1389 A 45 ALA HA A 46 SER H 1.0 . 2.71 1672 1390 A 77 SER H A 77 SER HB2 1.0 . 2.99 1673 1390 A 77 SER H A 77 SER HB3 1.0 . 2.99 1674 1391 A 46 SER H A 46 SER HBx 1.0 . 3.42 1675 1392 A 77 SER H A 76 LYS HE2 1.0 . 5.01 1676 1392 A 77 SER H A 76 LYS HE3 1.0 . 5.01 1677 1393 A 77 SER H A 76 LYS HB2 1.0 . 3.71 1678 1393 A 76 LYS HB3 A 77 SER H 1.0 . 3.71 1679 1394 A 80 LYS HBx A 77 SER H 1.0 . 5.42 1680 1395 A 46 SER H A 58 LEU HBy 1.0 . 4.23 1681 1396 A 45 ALA HB% A 46 SER H 1.0 . 2.69 1682 1397 A 32 VAL HGy% A 46 SER H 1.0 . 4.19 1683 1398 A 46 SER H A 58 LEU HDx% 1.0 . 4.19 1684 1399 A 32 VAL H A 46 SER H 1.0 . 4.98 1685 1400 A 77 SER H A 76 LYS H 1.0 . 3.60 1686 1401 A 78 TYR H A 77 SER H 1.0 . 3.64 1687 1402 A 47 GLY H A 31 HIS H 1.0 . 5.04 1688 1403 A 48 LYS H A 47 GLY H 1.0 . 4.50 1689 1404 A 48 LYS HA A 47 GLY H 1.0 . 4.78 1690 1405 A 46 SER HA A 47 GLY H 1.0 . 3.13 1691 1406 A 31 HIS HA A 47 GLY H 1.0 . 3.94 1692 1407 A 29 ALA HA A 47 GLY H 1.0 . 5.32 1693 1408 A 30 VAL HA A 47 GLY H 1.0 . 5.50 1694 1409 A 47 GLY H A 46 SER HBx 1.0 . 4.19 1695 1410 A 47 GLY H A 31 HIS HBx 1.0 . 5.50 1696 1411 A 30 VAL HB A 47 GLY H 1.0 . 3.63 1697 1412 A 48 LYS HGy A 47 GLY H 1.0 . 5.50 1698 1413 A 47 GLY H A 55 LEU HG 1.0 . 5.50 1699 1414 A 47 GLY H A 58 LEU HG 1.0 . 5.50 1700 1415 A 48 LYS HGx A 47 GLY H 1.0 . 5.16 1701 1416 A 32 VAL HGy% A 47 GLY H 1.0 . 4.79 1702 1417 A 29 ALA HA A 48 LYS H 1.0 . 5.18 1703 1418 A 48 LYS H A 47 GLY HAy 1.0 . 2.87 1704 1419 A 47 GLY HAx A 48 LYS H 1.0 . 2.89 1705 1420 A 48 LYS H A 48 LYS HB2 1.0 . 2.90 1706 1420 A 48 LYS H A 48 LYS HB3 1.0 . 2.90 1707 1421 A 48 LYS HGx A 48 LYS H 1.0 . 3.49 1708 1422 A 48 LYS H A 55 LEU HDy% 1.0 . 3.30 1709 1423 A 48 LYS H A 55 LEU HDx% 1.0 . 3.30 1710 1424 A 28 VAL H A 49 THR H 1.0 . 3.38 1711 1425 A 48 LYS HA A 49 THR H 1.0 . 3.13 1712 1426 A 29 ALA HA A 49 THR H 1.0 . 4.90 1713 1427 A 27 ASN HA A 49 THR H 1.0 . 4.01 1714 1428 A 49 THR HB A 49 THR H 1.0 . 3.89 1715 1429 A 28 VAL HB A 49 THR H 1.0 . 3.92 1716 1430 A 49 THR H A 48 LYS HB2 1.0 . 3.28 1717 1430 A 48 LYS HB3 A 49 THR H 1.0 . 3.28 1718 1431 A 48 LYS HGy A 49 THR H 1.0 . 4.29 1719 1432 A 48 LYS HGx A 49 THR H 1.0 . 4.80 1720 1433 A 49 THR HG2% A 49 THR H 1.0 . 3.14 1721 1434 A 30 VAL HGy% A 49 THR H 1.0 . 4.27 1722 1435 A 28 VAL HGy% A 49 THR H 1.0 . 4.16 1723 1436 A 50 SER H A 54 GLU H 1.0 . 4.13 1724 1437 A 50 SER H A 50 SER HBy 1.0 . 4.17 1725 1438 A 49 THR HB A 50 SER H 1.0 . 3.46 1726 1439 A 50 SER H A 49 THR HA 1.0 . 3.32 1727 1440 A 49 THR HG2% A 50 SER H 1.0 . 3.79 1728 1441 A 51 GLU H A 50 SER H 1.0 . 4.42 1729 1442 A 51 GLU H A 50 SER HA 1.0 . 2.98 1730 1443 A 51 GLU H A 50 SER HBy 1.0 . 3.38 1731 1444 A 51 GLU H A 50 SER HBx 1.0 . 3.38 1732 1445 A 26 ILE HA A 51 GLU H 1.0 . 5.24 1733 1446 A 51 GLU H A 52 SER HBx 1.0 . 5.50 1734 1447 A 51 GLU H A 51 GLU HB2 1.0 . 2.94 1735 1447 A 51 GLU HB3 A 51 GLU H 1.0 . 2.94 1736 1448 A 51 GLU H A 26 ILE HG1y 1.0 . 4.83 1737 1449 A 51 GLU H A 26 ILE HG1x 1.0 . 4.83 1738 1450 A 26 ILE HD1% A 51 GLU H 1.0 . 3.98 1739 1451 A 26 ILE HG2% A 51 GLU H 1.0 . 4.10 1740 1452 A 52 SER H A 52 SER HBx 1.0 . 3.44 1741 1453 A 52 SER H A 24 PRO HBy 1.0 . 4.78 1742 1454 A 26 ILE HD1% A 52 SER H 1.0 . 5.19 1743 1455 A 53 GLY H A 51 GLU H 1.0 . 4.49 1744 1456 A 53 GLY H A 54 GLU HA 1.0 . 5.36 1745 1457 A 53 GLY H A 52 SER HBy 1.0 . 4.07 1746 1458 A 60 THR H A 64 PHE HB2 1.0 . 4.52 1747 1458 A 60 THR H A 64 PHE HB3 1.0 . 4.52 1748 1459 A 60 THR H A 63 GLU HBx 1.0 . 3.92 1749 1460 A 53 GLY H A 24 PRO HBy 1.0 . 3.93 1750 1461 A 53 GLY H A 24 PRO HBx 1.0 . 4.19 1751 1462 A 60 THR H A 59 THR HG2% 1.0 . 3.67 1752 1463 A 53 GLY H A 49 THR HG2% 1.0 . 5.12 1753 1464 A 54 GLU H A 52 SER HA 1.0 . 4.43 1754 1465 A 54 GLU H A 52 SER HBy 1.0 . 3.77 1755 1466 A 52 SER HBx A 54 GLU H 1.0 . 4.39 1756 1467 A 53 GLY H A 54 GLU H 1.0 . 3.31 1757 1468 A 16 VAL H A 54 GLU H 1.0 . 5.29 1758 1469 A 54 GLU H A 15 LYS HD2 1.0 . 4.10 1759 1469 A 15 LYS HD3 A 54 GLU H 1.0 . 4.10 1760 1470 A 58 LEU H A 59 THR H 1.0 . 3.96 1761 1471 A 58 LEU H A 58 LEU HBy 1.0 . 3.79 1762 1472 A 58 LEU HG A 58 LEU H 1.0 . 3.81 1763 1473 A 58 LEU H A 58 LEU HBx 1.0 . 4.05 1764 1474 A 58 LEU H A 58 LEU HDx% 1.0 . 4.30 1765 1475 A 59 THR H A 58 LEU HBx 1.0 . 4.65 1766 1476 A 59 THR H A 59 THR HG2% 1.0 . 4.24 1767 1477 A 59 THR H A 58 LEU HDx% 1.0 . 5.32 1768 1478 A 59 THR H A 58 LEU HDy% 1.0 . 5.32 1769 1479 A 61 GLU H A 60 THR HB 1.0 . 3.92 1770 1480 A 61 GLU H A 62 GLU HGy 1.0 . 4.33 1771 1481 A 61 GLU H A 62 GLU HGx 1.0 . 4.33 1772 1482 A 61 GLU H A 61 GLU HB2 1.0 . 3.51 1773 1482 A 61 GLU H A 61 GLU HB3 1.0 . 3.51 1774 1483 A 61 GLU H A 62 GLU H 1.0 . 4.04 1775 1484 A 60 THR HA A 62 GLU H 1.0 . 4.29 1776 1485 A 62 GLU H A 60 THR HB 1.0 . 3.71 1777 1486 A 62 GLU H A 63 GLU HA 1.0 . 5.11 1778 1487 A 62 GLU H A 61 GLU HB2 1.0 . 3.04 1779 1487 A 62 GLU H A 61 GLU HB3 1.0 . 3.04 1780 1488 A 62 GLU H A 62 GLU HBx 1.0 . 3.68 1781 1489 A 60 THR HG2% A 62 GLU H 1.0 . 4.17 1782 1490 A 62 GLU H A 63 GLU H 1.0 . 4.38 1783 1491 A 64 PHE H A 63 GLU H 1.0 . 4.21 1784 1492 A 63 GLU H A 63 GLU HBx 1.0 . 4.03 1785 1493 A 63 GLU H A 63 GLU HBy 1.0 . 4.03 1786 1494 A 62 GLU H A 64 PHE H 1.0 . 4.58 1787 1495 A 64 PHE H A 64 PHE HD% 1.0 . 4.27 1788 1496 A 60 THR HB A 64 PHE H 1.0 . 5.37 1789 1497 A 61 GLU HA A 64 PHE H 1.0 . 4.03 1790 1498 A 64 PHE H A 64 PHE HB2 1.0 . 3.30 1791 1498 A 64 PHE HB3 A 64 PHE H 1.0 . 3.30 1792 1499 A 64 PHE H A 63 GLU HG2 1.0 . 3.87 1793 1499 A 63 GLU HG3 A 64 PHE H 1.0 . 3.87 1794 1500 A 64 PHE H A 63 GLU HBx 1.0 . 4.33 1795 1501 A 60 THR HG2% A 64 PHE H 1.0 . 5.50 1796 1502 A 65 VAL HGx% A 64 PHE H 1.0 . 4.99 1797 1503 A 59 THR HG2% A 64 PHE H 1.0 . 5.20 1798 1504 A 65 VAL H A 64 PHE HD% 1.0 . 4.06 1799 1505 A 65 VAL H A 65 VAL HB 1.0 . 4.18 1800 1506 A 66 GLU H A 67 GLY H 1.0 . 4.66 1801 1507 A 65 VAL H A 66 GLU H 1.0 . 4.78 1802 1508 A 66 GLU H A 65 VAL HA 1.0 . 3.03 1803 1509 A 66 GLU H A 65 VAL HB 1.0 . 2.99 1804 1510 A 66 GLU H A 66 GLU HBy 1.0 . 3.71 1805 1511 A 97 ALA H A 67 GLY H 1.0 . 4.08 1806 1512 A 69 TYR HD% A 67 GLY H 1.0 . 5.17 1807 1513 A 66 GLU HA A 67 GLY H 1.0 . 3.44 1808 1514 A 67 GLY H A 66 GLU HBy 1.0 . 4.13 1809 1515 A 67 GLY H A 66 GLU HBx 1.0 . 4.13 1810 1516 A 96 THR HG2% A 67 GLY H 1.0 . 5.05 1811 1517 A 97 ALA HB% A 67 GLY H 1.0 . 3.90 1812 1518 A 35 LYS H A 68 ILE H 1.0 . 3.99 1813 1519 A 68 ILE H A 67 GLY H 1.0 . 4.62 1814 1520 A 41 TRP HZ3 A 68 ILE H 1.0 . 5.23 1815 1521 A 69 TYR HD% A 68 ILE H 1.0 . 5.28 1816 1522 A 34 ARG HA A 68 ILE H 1.0 . 5.50 1817 1523 A 126 LYS H A 125 PRO HA 1.0 . 2.90 1818 1524 A 67 GLY HAy A 68 ILE H 1.0 . 3.15 1819 1525 A 67 GLY HAx A 68 ILE H 1.0 . 3.10 1820 1526 A 126 LYS H A 127 GLU HG2 1.0 . 4.50 1821 1526 A 127 GLU HG3 A 126 LYS H 1.0 . 4.50 1822 1527 A 126 LYS H A 126 LYS HBx 1.0 . 3.63 1823 1528 A 126 LYS H A 126 LYS HD2 1.0 . 3.62 1824 1528 A 126 LYS HD3 A 126 LYS H 1.0 . 3.62 1825 1529 A 68 ILE HB A 68 ILE H 1.0 . 3.40 1826 1530 A 126 LYS H A 126 LYS HG2 1.0 . 3.57 1827 1530 A 126 LYS HG3 A 126 LYS H 1.0 . 3.57 1828 1531 A 68 ILE HG1x A 68 ILE H 1.0 . 3.75 1829 1532 A 68 ILE HG2% A 68 ILE H 1.0 . 3.84 1830 1533 A 68 ILE HD1% A 68 ILE H 1.0 . 3.48 1831 1534 A 69 TYR H A 68 ILE H 1.0 . 4.70 1832 1535 A 69 TYR H A 97 ALA H 1.0 . 4.89 1833 1536 A 69 TYR H A 41 TRP HZ3 1.0 . 4.51 1834 1537 A 69 TYR H A 96 THR HA 1.0 . 4.19 1835 1538 A 69 TYR H A 68 ILE HA 1.0 . 3.40 1836 1539 A 69 TYR H A 69 TYR HBy 1.0 . 4.20 1837 1540 A 69 TYR H A 69 TYR HBx 1.0 . 3.91 1838 1541 A 71 VAL H A 70 LYS H 1.0 . 4.70 1839 1542 A 70 LYS H A 95 PHE H 1.0 . 5.02 1840 1543 A 70 LYS H A 41 TRP HE3 1.0 . 4.26 1841 1544 A 70 LYS H A 41 TRP HZ3 1.0 . 3.78 1842 1545 A 70 LYS H A 69 TYR HD% 1.0 . 3.98 1843 1546 A 70 LYS H A 33 PHE HA 1.0 . 5.23 1844 1547 A 70 LYS H A 69 TYR HA 1.0 . 3.15 1845 1548 A 70 LYS H A 34 ARG HA 1.0 . 3.88 1846 1549 A 70 LYS H A 33 PHE HBy 1.0 . 4.83 1847 1550 A 70 LYS H A 33 PHE HBx 1.0 . 4.18 1848 1551 A 70 LYS H A 69 TYR HBy 1.0 . 3.83 1849 1552 A 70 LYS H A 69 TYR HBx 1.0 . 4.06 1850 1553 A 70 LYS H A 32 VAL HGx% 1.0 . 3.81 1851 1554 A 71 VAL HGy% A 70 LYS H 1.0 . 4.43 1852 1555 A 70 LYS HBy A 70 LYS H 1.0 . 3.68 1853 1556 A 70 LYS HBx A 70 LYS H 1.0 . 3.89 1854 1557 A 71 VAL H A 92 GLU HA 1.0 . 4.75 1855 1558 A 93 VAL HA A 71 VAL H 1.0 . 5.13 1856 1559 A 71 VAL H A 70 LYS HA 1.0 . 3.42 1857 1560 A 71 VAL H A 71 VAL HB 1.0 . 3.83 1858 1561 A 92 GLU HBx A 71 VAL H 1.0 . 5.50 1859 1562 A 71 VAL H A 119 MET HE% 1.0 . 5.50 1860 1563 A 71 VAL HGy% A 71 VAL H 1.0 . 3.64 1861 1564 A 71 VAL H A 94 VAL HGy% 1.0 . 4.54 1862 1565 A 71 VAL HGx% A 71 VAL H 1.0 . 3.84 1863 1566 A 33 PHE HE% A 72 GLU H 1.0 . 4.61 1864 1567 A 33 PHE HD% A 72 GLU H 1.0 . 4.80 1865 1568 A 72 GLU H A 92 GLU HA 1.0 . 4.83 1866 1569 A 32 VAL HA A 72 GLU H 1.0 . 4.03 1867 1570 A 71 VAL HA A 72 GLU H 1.0 . 3.29 1868 1571 A 30 VAL HA A 72 GLU H 1.0 . 4.84 1869 1572 A 31 HIS HBy A 72 GLU H 1.0 . 4.68 1870 1573 A 72 GLU HBy A 72 GLU H 1.0 . 4.11 1871 1574 A 72 GLU H A 72 GLU HGy 1.0 . 4.71 1872 1575 A 72 GLU HBx A 72 GLU H 1.0 . 3.76 1873 1576 A 32 VAL HGx% A 72 GLU H 1.0 . 5.49 1874 1577 A 71 VAL HGy% A 72 GLU H 1.0 . 4.14 1875 1578 A 71 VAL HGx% A 72 GLU H 1.0 . 3.47 1876 1579 A 72 GLU HBy A 73 ILE H 1.0 . 4.56 1877 1580 A 72 GLU HBx A 73 ILE H 1.0 . 4.56 1878 1581 A 73 ILE HG1y A 73 ILE H 1.0 . 4.40 1879 1582 A 75 THR HG2% A 73 ILE H 1.0 . 4.98 1880 1583 A 73 ILE H A 73 ILE HG1x 1.0 . 4.36 1881 1584 A 71 VAL HGx% A 73 ILE H 1.0 . 4.51 1882 1585 A 30 VAL HGx% A 73 ILE H 1.0 . 4.56 1883 1586 A 73 ILE H A 73 ILE HG2% 1.0 . 4.78 1884 1587 A 73 ILE HA A 74 ASP H 1.0 . 3.35 1885 1588 A 30 VAL HA A 74 ASP H 1.0 . 3.83 1886 1589 A 74 ASP H A 74 ASP HBy 1.0 . 3.62 1887 1590 A 74 ASP H A 74 ASP HBx 1.0 . 3.62 1888 1591 A 73 ILE H A 73 ILE HB 1.0 . 4.03 1889 1592 A 91 ALA H A 73 ILE HB 1.0 . 4.10 1890 1593 A 29 ALA HB% A 74 ASP H 1.0 . 3.78 1891 1594 A 75 THR HG2% A 91 ALA H 1.0 . 3.95 1892 1595 A 91 ALA H A 73 ILE HG1x 1.0 . 4.65 1893 1596 A 73 ILE HG2% A 74 ASP H 1.0 . 3.34 1894 1597 A 91 ALA H A 90 HIS HBx 1.0 . 3.62 1895 1598 A 75 THR HA A 74 ASP H 1.0 . 5.28 1896 1599 A 28 VAL HA A 74 ASP H 1.0 . 5.50 1897 1600 A 91 ALA H A 90 HIS HA 1.0 . 3.36 1898 1601 A 72 GLU HA A 91 ALA H 1.0 . 5.13 1899 1602 A 91 ALA H A 90 HIS H 1.0 . 4.62 1900 1603 A 73 ILE H A 91 ALA H 1.0 . 3.99 1901 1604 A 90 HIS HA A 75 THR H 1.0 . 3.76 1902 1605 A 74 ASP HA A 75 THR H 1.0 . 3.23 1903 1606 A 90 HIS HBy A 75 THR H 1.0 . 4.31 1904 1607 A 75 THR H A 76 LYS HB2 1.0 . 4.92 1905 1607 A 76 LYS HB3 A 75 THR H 1.0 . 4.92 1906 1608 A 75 THR H A 73 ILE HB 1.0 . 4.89 1907 1609 A 75 THR H A 111 LEU HG 1.0 . 5.50 1908 1610 A 91 ALA HB% A 75 THR H 1.0 . 4.97 1909 1611 A 75 THR HG2% A 75 THR H 1.0 . 3.49 1910 1612 A 73 ILE HG2% A 75 THR H 1.0 . 4.32 1911 1613 A 75 THR HB A 76 LYS H 1.0 . 4.79 1912 1614 A 90 HIS HA A 76 LYS H 1.0 . 4.53 1913 1615 A 74 ASP HA A 76 LYS H 1.0 . 4.02 1914 1616 A 76 LYS H A 77 SER HB2 1.0 . 4.92 1915 1616 A 77 SER HB3 A 76 LYS H 1.0 . 4.92 1916 1617 A 90 HIS HBy A 76 LYS H 1.0 . 4.67 1917 1618 A 76 LYS H A 76 LYS HE2 1.0 . 5.09 1918 1618 A 76 LYS HE3 A 76 LYS H 1.0 . 5.09 1919 1619 A 78 TYR HBy A 76 LYS H 1.0 . 5.50 1920 1620 A 76 LYS H A 76 LYS HB2 1.0 . 2.99 1921 1620 A 76 LYS HB3 A 76 LYS H 1.0 . 2.99 1922 1621 A 76 LYS H A 76 LYS HD2 1.0 . 4.23 1923 1621 A 76 LYS HD3 A 76 LYS H 1.0 . 4.23 1924 1622 A 76 LYS H A 76 LYS HGy 1.0 . 4.00 1925 1623 A 75 THR HG2% A 76 LYS H 1.0 . 4.18 1926 1624 A 76 LYS H A 79 TRP HD1 1.0 . 4.88 1927 1625 A 76 LYS H A 76 LYS HGx 1.0 . 4.00 1928 1626 A 78 TYR H A 80 LYS H 1.0 . 4.31 1929 1627 A 78 TYR H A 78 TYR HE% 1.0 . 4.82 1930 1627 A 78 TYR H A 78 TYR HD% 1.0 . 4.82 1931 1628 A 78 TYR H A 77 SER HB2 1.0 . 3.97 1932 1628 A 78 TYR H A 77 SER HB3 1.0 . 3.97 1933 1629 A 78 TYR HBy A 78 TYR H 1.0 . 3.65 1934 1630 A 78 TYR HBx A 78 TYR H 1.0 . 3.74 1935 1631 A 78 TYR H A 76 LYS HB2 1.0 . 5.50 1936 1631 A 78 TYR H A 76 LYS HB3 1.0 . 5.50 1937 1632 A 78 TYR H A 28 VAL HGx% 1.0 . 5.50 1938 1633 A 80 LYS H A 79 TRP H 1.0 . 3.58 1939 1634 A 78 TYR H A 79 TRP H 1.0 . 3.42 1940 1635 A 75 THR HB A 79 TRP H 1.0 . 4.85 1941 1636 A 76 LYS HA A 79 TRP H 1.0 . 3.86 1942 1637 A 79 TRP H A 79 TRP HBy 1.0 . 3.94 1943 1638 A 79 TRP H A 79 TRP HBx 1.0 . 3.94 1944 1639 A 78 TYR HBx A 79 TRP H 1.0 . 4.19 1945 1640 A 79 TRP H A 76 LYS HB2 1.0 . 5.18 1946 1640 A 76 LYS HB3 A 79 TRP H 1.0 . 5.18 1947 1641 A 80 LYS HBx A 79 TRP H 1.0 . 4.51 1948 1642 A 79 TRP H A 76 LYS HD2 1.0 . 5.50 1949 1642 A 76 LYS HD3 A 79 TRP H 1.0 . 5.50 1950 1643 A 79 TRP H A 84 ILE HB 1.0 . 5.50 1951 1644 A 79 TRP H A 84 ILE HG2% 1.0 . 5.50 1952 1645 A 78 TYR HBy A 79 TRP H 1.0 . 3.65 1953 1646 A 80 LYS H A 79 TRP HBy 1.0 . 4.86 1954 1647 A 80 LYS H A 80 LYS HBx 1.0 . 3.25 1955 1648 A 80 LYS H A 80 LYS HD2 1.0 . 4.44 1956 1648 A 80 LYS H A 80 LYS HD3 1.0 . 4.44 1957 1649 A 79 TRP H A 81 ALA H 1.0 . 4.58 1958 1650 A 82 LEU H A 81 ALA H 1.0 . 3.17 1959 1651 A 79 TRP HA A 81 ALA H 1.0 . 4.17 1960 1652 A 81 ALA H A 77 SER HB2 1.0 . 5.50 1961 1652 A 81 ALA H A 77 SER HB3 1.0 . 5.50 1962 1653 A 81 ALA H A 80 LYS HBy 1.0 . 4.42 1963 1654 A 80 LYS HGy A 81 ALA H 1.0 . 4.39 1964 1655 A 81 ALA H A 81 ALA HB% 1.0 . 2.75 1965 1656 A 81 ALA H A 82 LEU HDx% 1.0 . 5.39 1966 1657 A 81 ALA H A 82 LEU HDy% 1.0 . 5.39 1967 1658 A 82 LEU H A 82 LEU HBy 1.0 . 3.88 1968 1659 A 82 LEU H A 82 LEU HBx 1.0 . 4.17 1969 1660 A 82 LEU H A 81 ALA HB% 1.0 . 3.04 1970 1661 A 82 LEU H A 83 GLY HAx 1.0 . 4.47 1971 1662 A 80 LYS H A 82 LEU H 1.0 . 4.38 1972 1663 A 82 LEU H A 84 ILE H 1.0 . 3.89 1973 1664 A 83 GLY H A 81 ALA H 1.0 . 3.74 1974 1665 A 83 GLY H A 82 LEU H 1.0 . 2.94 1975 1666 A 83 GLY H A 83 GLY HAy 1.0 . 2.94 1976 1667 A 83 GLY H A 83 GLY HAx 1.0 . 2.88 1977 1668 A 83 GLY H A 80 LYS HBy 1.0 . 5.44 1978 1669 A 83 GLY H A 82 LEU HBy 1.0 . 3.60 1979 1670 A 83 GLY H A 81 ALA HB% 1.0 . 4.47 1980 1671 A 83 GLY H A 84 ILE HD1% 1.0 . 4.27 1981 1672 A 85 SER H A 84 ILE HA 1.0 . 2.78 1982 1673 A 85 SER H A 85 SER HBy 1.0 . 3.09 1983 1674 A 85 SER H A 85 SER HBx 1.0 . 3.09 1984 1675 A 37 ALA H A 36 ALA HA 1.0 . 3.17 1985 1676 A 118 THR HA A 119 MET H 1.0 . 3.27 1986 1677 A 8 SER HA A 9 LYS H 1.0 . 2.93 1987 1678 A 119 MET H A 109 ALA HA 1.0 . 5.39 1988 1679 A 37 ALA H A 40 THR H 1.0 . 4.96 1989 1680 A 85 SER H A 114 TYR HE% 1.0 . 4.44 1990 1681 A 30 VAL H A 31 HIS H 1.0 . 4.50 1991 1682 A 119 MET H A 119 MET HBy 1.0 . 3.65 1992 1683 A 9 LYS H A 9 LYS HBy 1.0 . 3.75 1993 1684 A 85 SER H A 84 ILE HB 1.0 . 4.18 1994 1685 A 37 ALA H A 37 ALA HB% 1.0 . 2.59 1995 1686 A 85 SER H A 84 ILE HG1x 1.0 . 3.60 1996 1687 A 85 SER H A 84 ILE HD1% 1.0 . 3.87 1997 1688 A 85 SER H A 84 ILE HG2% 1.0 . 3.09 1998 1689 A 87 MET H A 88 HIS H 1.0 . 3.82 1999 1690 A 87 MET H A 87 MET HGy 1.0 . 4.03 2000 1691 A 87 MET H A 87 MET HGx 1.0 . 4.03 2001 1692 A 87 MET H A 87 MET HBy 1.0 . 3.68 2002 1693 A 87 MET H A 87 MET HBx 1.0 . 3.68 2003 1694 A 88 HIS H A 87 MET HBy 1.0 . 4.31 2004 1695 A 88 HIS H A 87 MET HBx 1.0 . 4.31 2005 1696 A 90 HIS HBy A 90 HIS H 1.0 . 4.09 2006 1697 A 90 HIS HBx A 90 HIS H 1.0 . 4.03 2007 1698 A 92 GLU H A 92 GLU HGy 1.0 . 3.93 2008 1699 A 92 GLU HBy A 92 GLU H 1.0 . 4.02 2009 1700 A 92 GLU H A 92 GLU HGx 1.0 . 3.93 2010 1701 A 92 GLU HBx A 92 GLU H 1.0 . 3.84 2011 1702 A 91 ALA HB% A 92 GLU H 1.0 . 3.63 2012 1703 A 93 VAL HGy% A 92 GLU H 1.0 . 4.37 2013 1704 A 71 VAL H A 93 VAL H 1.0 . 3.78 2014 1705 A 95 PHE HD% A 93 VAL H 1.0 . 5.50 2015 1706 A 93 VAL H A 92 GLU HA 1.0 . 3.16 2016 1707 A 72 GLU HA A 93 VAL H 1.0 . 4.01 2017 1708 A 93 VAL H A 93 VAL HB 1.0 . 3.76 2018 1709 A 93 VAL H A 71 VAL HB 1.0 . 4.05 2019 1710 A 92 GLU HBy A 93 VAL H 1.0 . 4.28 2020 1711 A 92 GLU HBx A 93 VAL H 1.0 . 3.30 2021 1712 A 93 VAL HGx% A 93 VAL H 1.0 . 4.13 2022 1713 A 71 VAL HGx% A 93 VAL H 1.0 . 4.63 2023 1714 A 94 VAL H A 93 VAL HB 1.0 . 4.21 2024 1715 A 94 VAL HB A 94 VAL H 1.0 . 3.47 2025 1716 A 93 VAL HGx% A 94 VAL H 1.0 . 3.27 2026 1717 A 93 VAL HA A 94 VAL H 1.0 . 3.28 2027 1718 A 93 VAL H A 94 VAL H 1.0 . 4.53 2028 1719 A 94 VAL HB A 95 PHE H 1.0 . 4.30 2029 1720 A 94 VAL HGx% A 95 PHE H 1.0 . 3.30 2030 1721 A 95 PHE H A 68 ILE HG2% 1.0 . 3.44 2031 1722 A 94 VAL HA A 95 PHE H 1.0 . 3.12 2032 1723 A 41 TRP HH2 A 95 PHE H 1.0 . 5.09 2033 1724 A 95 PHE HE% A 95 PHE H 1.0 . 4.54 2034 1725 A 71 VAL H A 95 PHE H 1.0 . 4.68 2035 1726 A 69 TYR H A 95 PHE H 1.0 . 4.13 2036 1727 A 95 PHE H A 94 VAL H 1.0 . 4.51 2037 1728 A 96 THR H A 95 PHE HB2 1.0 . 3.55 2038 1728 A 95 PHE HB3 A 96 THR H 1.0 . 3.55 2039 1729 A 95 PHE HD% A 96 THR H 1.0 . 4.87 2040 1730 A 97 ALA H A 96 THR H 1.0 . 4.66 2041 1731 A 95 PHE H A 96 THR H 1.0 . 4.56 2042 1732 A 95 PHE HA A 96 THR H 1.0 . 3.21 2043 1733 A 96 THR HB A 96 THR H 1.0 . 3.47 2044 1734 A 96 THR HG2% A 96 THR H 1.0 . 3.91 2045 1735 A 68 ILE HG2% A 96 THR H 1.0 . 3.98 2046 1736 A 68 ILE H A 97 ALA H 1.0 . 4.81 2047 1737 A 69 TYR HD% A 97 ALA H 1.0 . 4.69 2048 1738 A 96 THR HA A 97 ALA H 1.0 . 3.42 2049 1739 A 68 ILE HA A 97 ALA H 1.0 . 4.09 2050 1740 A 97 ALA H A 96 THR HB 1.0 . 4.54 2051 1741 A 68 ILE HG1y A 97 ALA H 1.0 . 4.67 2052 1742 A 97 ALA HB% A 97 ALA H 1.0 . 3.70 2053 1743 A 101 GLY H A 100 SER H 1.0 . 4.79 2054 1744 A 106 THR H A 105 TYR HE% 1.0 . 4.84 2055 1744 A 106 THR H A 105 TYR HD% 1.0 . 4.84 2056 1745 A 106 THR H A 13 MET HB2 1.0 . 4.94 2057 1745 A 106 THR H A 13 MET HB3 1.0 . 4.94 2058 1746 A 106 THR H A 106 THR HG2% 1.0 . 4.28 2059 1747 A 108 ALA HA A 107 ILE H 1.0 . 5.29 2060 1748 A 106 THR HA A 107 ILE H 1.0 . 3.37 2061 1749 A 107 ILE HB A 107 ILE H 1.0 . 3.87 2062 1750 A 107 ILE H A 107 ILE HG1y 1.0 . 4.26 2063 1751 A 107 ILE HG2% A 107 ILE H 1.0 . 3.92 2064 1752 A 107 ILE HD1% A 107 ILE H 1.0 . 4.23 2065 1753 A 107 ILE HG1x A 107 ILE H 1.0 . 4.38 2066 1754 A 108 ALA H A 120 ALA H 1.0 . 4.11 2067 1755 A 108 ALA H A 107 ILE HB 1.0 . 4.76 2068 1756 A 108 ALA HA A 109 ALA H 1.0 . 3.43 2069 1757 A 110 MET HGy A 109 ALA H 1.0 . 5.35 2070 1758 A 17 LEU HBy A 109 ALA H 1.0 . 5.50 2071 1759 A 120 ALA HB% A 109 ALA H 1.0 . 5.26 2072 1760 A 109 ALA HB% A 109 ALA H 1.0 . 3.28 2073 1761 A 107 ILE HG2% A 109 ALA H 1.0 . 4.30 2074 1762 A 110 MET H A 109 ALA HA 1.0 . 3.23 2075 1763 A 110 MET H A 110 MET HBy 1.0 . 3.70 2076 1764 A 110 MET H A 110 MET HBx 1.0 . 3.81 2077 1765 A 111 LEU HDx% A 110 MET H 1.0 . 4.27 2078 1766 A 110 MET HA A 111 LEU H 1.0 . 3.30 2079 1767 A 111 LEU H A 111 LEU HG 1.0 . 4.59 2080 1768 A 111 LEU H A 109 ALA HB% 1.0 . 5.24 2081 1769 A 16 VAL HGx% A 111 LEU H 1.0 . 4.59 2082 1770 A 111 LEU HDy% A 111 LEU H 1.0 . 3.99 2083 1771 A 111 LEU H A 79 TRP HZ2 1.0 . 5.35 2084 1772 A 111 LEU H A 18 ASP H 1.0 . 5.16 2085 1773 A 17 LEU H A 111 LEU H 1.0 . 4.86 2086 1774 A 111 LEU H A 112 SER H 1.0 . 5.28 2087 1775 A 111 LEU H A 110 MET H 1.0 . 4.54 2088 1776 A 19 ALA H A 112 SER H 1.0 . 5.02 2089 1777 A 79 TRP HH2 A 112 SER H 1.0 . 5.42 2090 1778 A 79 TRP HZ2 A 112 SER H 1.0 . 4.42 2091 1779 A 112 SER H A 112 SER HBy 1.0 . 3.95 2092 1780 A 112 SER H A 112 SER HBx 1.0 . 3.95 2093 1781 A 112 SER H A 111 LEU HBy 1.0 . 4.49 2094 1782 A 112 SER H A 111 LEU HBx 1.0 . 4.49 2095 1783 A 112 SER H A 111 LEU HG 1.0 . 4.46 2096 1784 A 111 LEU HDx% A 112 SER H 1.0 . 3.81 2097 1785 A 112 SER HA A 114 TYR H 1.0 . 4.31 2098 1786 A 114 TYR H A 115 SER HA 1.0 . 5.36 2099 1787 A 114 TYR H A 114 TYR HBy 1.0 . 3.79 2100 1788 A 114 TYR H A 114 TYR HBx 1.0 . 3.79 2101 1789 A 20 VAL HGy% A 114 TYR H 1.0 . 4.21 2102 1790 A 84 ILE HG2% A 114 TYR H 1.0 . 5.50 2103 1791 A 114 TYR HE% A 114 TYR H 1.0 . 4.64 2104 1792 A 68 ILE HA A 96 THR H 1.0 . 4.87 2105 1793 A 115 SER H A 114 TYR HBy 1.0 . 4.26 2106 1794 A 115 SER H A 114 TYR HBx 1.0 . 4.26 2107 1795 A 112 SER HA A 115 SER H 1.0 . 4.70 2108 1796 A 114 TYR H A 115 SER H 1.0 . 3.39 2109 1797 A 110 MET H A 118 THR H 1.0 . 4.41 2110 1798 A 118 THR HB A 118 THR H 1.0 . 3.85 2111 1799 A 110 MET HBy A 118 THR H 1.0 . 4.33 2112 1800 A 110 MET HBx A 118 THR H 1.0 . 5.32 2113 1801 A 119 MET HBy A 118 THR H 1.0 . 5.50 2114 1802 A 118 THR HG2% A 118 THR H 1.0 . 4.17 2115 1803 A 111 LEU HDx% A 118 THR H 1.0 . 5.24 2116 1804 A 120 ALA H A 109 ALA HA 1.0 . 4.27 2117 1805 A 107 ILE HA A 120 ALA H 1.0 . 5.50 2118 1806 A 119 MET H A 120 ALA H 1.0 . 4.56 2119 1807 A 120 ALA H A 121 VAL H 1.0 . 5.00 2120 1808 A 108 ALA HB% A 120 ALA H 1.0 . 3.99 2121 1809 A 120 ALA H A 119 MET HBx 1.0 . 4.47 2122 1810 A 120 ALA H A 119 MET HBy 1.0 . 4.66 2123 1811 A 120 ALA H A 107 ILE HG2% 1.0 . 4.81 2124 1812 A 121 VAL HGy% A 120 ALA H 1.0 . 5.50 2125 1813 A 121 VAL H A 121 VAL HB 1.0 . 3.41 2126 1814 A 121 VAL H A 122 VAL HGy% 1.0 . 4.41 2127 1815 A 121 VAL HGy% A 121 VAL H 1.0 . 3.54 2128 1816 A 122 VAL H A 121 VAL HGx% 1.0 . 4.47 2129 1817 A 107 ILE HA A 122 VAL H 1.0 . 4.71 2130 1818 A 127 GLU H A 125 PRO HA 1.0 . 3.99 2131 1819 A 127 GLU H A 126 LYS H 1.0 . 3.34 2132 1820 A 127 GLU H A 126 LYS HE2 1.0 . 4.44 2133 1820 A 127 GLU H A 126 LYS HE3 1.0 . 4.44 2134 1821 A 127 GLU H A 125 PRO HBy 1.0 . 3.99 2135 1822 A 127 GLU H A 127 GLU HG2 1.0 . 3.22 2136 1822 A 127 GLU H A 127 GLU HG3 1.0 . 3.22 2137 1823 A 127 GLU H A 126 LYS HD2 1.0 . 3.21 2138 1823 A 127 GLU H A 126 LYS HD3 1.0 . 3.21 2139 1824 A 21 ARG HBx A 23 SER H 1.0 . 3.77 2140 1825 A 17 LEU HBx A 23 SER H 1.0 . 5.50 2141 1826 A 12 LEU H A 13 MET H 1.0 . 4.48 2142 1827 A 15 LYS H A 107 ILE HB 1.0 . 4.13 2143 1828 A 15 LYS H A 15 LYS HBy 1.0 . 3.81 2144 1829 A 15 LYS HBx A 15 LYS H 1.0 . 3.93 2145 1830 A 15 LYS H A 15 LYS HG2 1.0 . 4.10 2146 1830 A 15 LYS HG3 A 15 LYS H 1.0 . 4.10 2147 1831 A 15 LYS H A 108 ALA HA 1.0 . 3.74 2148 1832 A 15 LYS H A 14 VAL HA 1.0 . 3.33 2149 1833 A 34 ARG HH1% A 34 ARG HDy 1.0 . 3.93 2150 1834 A 34 ARG HH1% A 34 ARG HDx 1.0 . 3.93 2151 1835 A 3 THR H A 2 PRO HD2 1.0 . 4.05 2152 1835 A 2 PRO HD3 A 3 THR H 1.0 . 4.05 2153 1836 A 3 THR HA A 4 GLY H 1.0 . 3.06 2154 1837 A 5 THR HA A 6 GLY H 1.0 . 3.06 2155 1838 A 3 THR HB A 4 GLY H 1.0 . 3.65 2156 1839 A 5 THR H A 4 GLY HA2 1.0 . 2.83 2157 1839 A 4 GLY HA3 A 5 THR H 1.0 . 2.83 2158 1840 A 8 SER H A 7 GLU HG2 1.0 . 3.89 2159 1840 A 7 GLU HG3 A 8 SER H 1.0 . 3.89 2160 1841 A 8 SER H A 7 GLU HBy 1.0 . 4.32 2161 1842 A 8 SER H A 7 GLU HBx 1.0 . 4.32 2162 1843 A 12 LEU H A 10 CYS HB2 1.0 . 4.80 2163 1843 A 12 LEU H A 10 CYS HB3 1.0 . 4.80 2164 1844 A 17 LEU H A 16 VAL HB 1.0 . 4.62 2165 1845 A 17 LEU H A 17 LEU HBy 1.0 . 3.93 2166 1846 A 17 LEU H A 109 ALA HB% 1.0 . 4.08 2167 1847 A 17 LEU H A 16 VAL HA 1.0 . 3.40 2168 1848 A 17 LEU HBy A 18 ASP H 1.0 . 4.22 2169 1849 A 17 LEU HG A 18 ASP H 1.0 . 4.66 2170 1850 A 17 LEU HBx A 18 ASP H 1.0 . 3.62 2171 1851 A 25 ALA HB% A 18 ASP H 1.0 . 4.69 2172 1852 A 18 ASP H A 24 PRO HDy 1.0 . 5.40 2173 1853 A 18 ASP H A 22 GLY HAy 1.0 . 5.02 2174 1854 A 24 PRO HA A 18 ASP H 1.0 . 3.80 2175 1855 A 18 ASP H A 17 LEU HA 1.0 . 3.04 2176 1856 A 16 VAL HGy% A 25 ALA H 1.0 . 5.50 2177 1857 A 25 ALA H A 28 VAL HGx% 1.0 . 5.50 2178 1858 A 27 ASN HD2x A 48 LYS HB2 1.0 . 4.19 2179 1858 A 48 LYS HB3 A 27 ASN HD2x 1.0 . 4.19 2180 1859 A 26 ILE HG2% A 27 ASN HD2x 1.0 . 3.77 2181 1860 A 26 ILE HB A 27 ASN HD2x 1.0 . 4.79 2182 1861 A 27 ASN HA A 27 ASN HD2x 1.0 . 4.38 2183 1862 A 65 VAL HB A 34 ARG HH1% 1.0 . 5.39 2184 1863 A 34 ARG HH1% A 34 ARG HBy 1.0 . 4.40 2185 1864 A 34 ARG HH1% A 34 ARG HG2 1.0 . 3.93 2186 1864 A 34 ARG HG3 A 34 ARG HH1% 1.0 . 3.93 2187 1865 A 34 ARG HH1% A 34 ARG HBx 1.0 . 4.40 2188 1866 A 65 VAL HGy% A 34 ARG HH1% 1.0 . 4.09 2189 1867 A 94 VAL HB A 41 TRP HZ2 1.0 . 5.11 2190 1868 A 35 LYS HBy A 41 TRP HZ2 1.0 . 4.57 2191 1869 A 94 VAL HGx% A 41 TRP HZ2 1.0 . 3.51 2192 1870 A 94 VAL HGy% A 41 TRP HZ2 1.0 . 3.27 2193 1871 A 41 TRP H A 41 TRP HD1 1.0 . 3.52 2194 1872 A 41 TRP HD1 A 40 THR HA 1.0 . 4.15 2195 1873 A 41 TRP HBy A 41 TRP HD1 1.0 . 3.38 2196 1874 A 41 TRP HD1 A 70 LYS HDy 1.0 . 4.38 2197 1875 A 79 TRP HH2 A 113 PRO HDy 1.0 . 5.14 2198 1876 A 79 TRP HH2 A 113 PRO HDx 1.0 . 5.14 2199 1877 A 79 TRP HH2 A 21 ARG HD2 1.0 . 4.49 2200 1877 A 79 TRP HH2 A 21 ARG HD3 1.0 . 4.49 2201 1878 A 79 TRP HH2 A 21 ARG HGy 1.0 . 4.50 2202 1879 A 79 TRP HH2 A 84 ILE HG1y 1.0 . 4.98 2203 1880 A 41 TRP HZ3 A 68 ILE HB 1.0 . 4.36 2204 1881 A 79 TRP HZ2 A 112 SER HA 1.0 . 4.14 2205 1882 A 79 TRP HZ2 A 113 PRO HA 1.0 . 5.27 2206 1883 A 79 TRP HZ2 A 111 LEU HBy 1.0 . 3.82 2207 1884 A 79 TRP HZ2 A 111 LEU HBx 1.0 . 3.82 2208 1885 A 79 TRP HZ2 A 20 VAL HGy% 1.0 . 4.74 2209 1886 A 111 LEU HDx% A 79 TRP HZ2 1.0 . 4.91 2210 1887 A 111 LEU HDy% A 79 TRP HZ2 1.0 . 4.10 2211 1888 A 79 TRP H A 79 TRP HD1 1.0 . 4.30 2212 1889 A 79 TRP HD1 A 76 LYS HB2 1.0 . 3.94 2213 1889 A 76 LYS HB3 A 79 TRP HD1 1.0 . 3.94 2214 1890 A 75 THR HG2% A 79 TRP HD1 1.0 . 4.49 2215 1891 A 75 THR HB A 79 TRP HD1 1.0 . 3.84 2216 1892 A 79 TRP HA A 79 TRP HD1 1.0 . 4.85 2217 1893 A 76 LYS HA A 79 TRP HD1 1.0 . 4.09 2218 1894 A 32 VAL HA A 33 PHE HD% 1.0 . 4.23 2219 1895 A 33 PHE HD% A 43 PRO HDx 1.0 . 4.56 2220 1896 A 33 PHE HD% A 41 TRP HBy 1.0 . 4.11 2221 1897 A 33 PHE HD% A 42 GLU HBy 1.0 . 5.18 2222 1898 A 43 PRO HBx A 33 PHE HD% 1.0 . 4.33 2223 1899 A 33 PHE HD% A 72 GLU HBx 1.0 . 4.85 2224 1900 A 32 VAL HB A 44 PHE HE% 1.0 . 3.83 2225 1900 A 44 PHE HD% A 32 VAL HB 1.0 . 3.83 2226 1901 A 44 PHE HE% A 63 GLU HG2 1.0 . 4.34 2227 1901 A 44 PHE HD% A 63 GLU HG2 1.0 . 4.34 2228 1901 A 63 GLU HG3 A 44 PHE HE% 1.0 . 4.34 2229 1901 A 44 PHE HD% A 63 GLU HG3 1.0 . 4.34 2230 1902 A 65 VAL HGy% A 44 PHE HE% 1.0 . 4.75 2231 1902 A 44 PHE HD% A 65 VAL HGy% 1.0 . 4.75 2232 1903 A 44 PHE HD% A 58 LEU HDx% 1.0 . 4.83 2233 1903 A 58 LEU HDx% A 44 PHE HE% 1.0 . 4.83 2234 1904 A 44 PHE HD% A 64 PHE HB2 1.0 . 4.36 2235 1904 A 44 PHE HE% A 64 PHE HB2 1.0 . 4.36 2236 1904 A 64 PHE HB3 A 44 PHE HE% 1.0 . 4.36 2237 1904 A 44 PHE HD% A 64 PHE HB3 1.0 . 4.36 2238 1905 A 59 THR HG2% A 44 PHE HE% 1.0 . 4.15 2239 1905 A 44 PHE HD% A 59 THR HG2% 1.0 . 4.15 2240 1906 A 44 PHE HD% A 58 LEU HDy% 1.0 . 4.83 2241 1906 A 44 PHE HE% A 58 LEU HDy% 1.0 . 4.83 2242 1907 A 64 PHE H A 44 PHE HE% 1.0 . 5.13 2243 1907 A 44 PHE HD% A 64 PHE H 1.0 . 5.13 2244 1908 A 34 ARG H A 44 PHE HE% 1.0 . 4.96 2245 1908 A 44 PHE HD% A 34 ARG H 1.0 . 4.96 2246 1909 A 56 HIS HD2 A 55 LEU H 1.0 . 4.01 2247 1910 A 64 PHE HA A 64 PHE HD% 1.0 . 4.04 2248 1911 A 69 TYR H A 69 TYR HD% 1.0 . 3.78 2249 1912 A 69 TYR HD% A 34 ARG HA 1.0 . 4.38 2250 1913 A 32 VAL HGx% A 69 TYR HD% 1.0 . 3.53 2251 1914 A 69 TYR HD% A 97 ALA HB% 1.0 . 3.68 2252 1915 A 91 ALA H A 90 HIS HD2 1.0 . 4.68 2253 1916 A 92 GLU H A 90 HIS HD2 1.0 . 4.89 2254 1917 A 90 HIS H A 90 HIS HD2 1.0 . 4.31 2255 1918 A 92 GLU HBx A 90 HIS HD2 1.0 . 5.12 2256 1919 A 91 ALA HB% A 90 HIS HD2 1.0 . 5.48 2257 1920 A 90 HIS HA A 90 HIS HD2 1.0 . 4.45 2258 1921 A 95 PHE HD% A 71 VAL HGy% 1.0 . 3.74 2259 1922 A 95 PHE HD% A 121 VAL HGy% 1.0 . 3.70 2260 1923 A 95 PHE HD% A 70 LYS HA 1.0 . 4.21 2261 1924 A 95 PHE HD% A 95 PHE H 1.0 . 3.74 2262 1925 A 93 VAL HGy% A 95 PHE HE% 1.0 . 3.92 2263 1926 A 95 PHE HE% A 107 ILE HG2% 1.0 . 3.80 2264 1927 A 95 PHE HE% A 70 LYS HA 1.0 . 4.78 2265 1928 A 95 PHE HE% A 94 VAL HA 1.0 . 5.30 2266 1929 A 95 PHE HE% A 71 VAL HA 1.0 . 4.77 2267 1930 A 95 PHE HD% A 71 VAL HB 1.0 . 4.61 2268 1931 A 95 PHE HD% A 121 VAL HB 1.0 . 5.14 2269 1932 A 114 TYR HD% A 114 TYR HA 1.0 . 3.01 2270 1933 A 114 TYR HD% A 114 TYR H 1.0 . 3.62 2271 1934 A 114 TYR HD% A 20 VAL HGy% 1.0 . 3.62 2272 1935 A 113 PRO HBx A 114 TYR HD% 1.0 . 4.55 2273 1936 A 20 VAL HGx% A 114 TYR HE% 1.0 . 3.43 2274 1937 A 84 ILE HD1% A 114 TYR HE% 1.0 . 4.77 2275 1938 A 84 ILE HG2% A 114 TYR HE% 1.0 . 3.66 2276 1939 A 116 TYR H A 116 TYR HD% 1.0 . 3.93 2277 1940 A 116 TYR HD% A 116 TYR HA 1.0 . 3.91 2278 1941 A 118 THR HG2% A 116 TYR HD% 1.0 . 4.48 2279 1942 A 118 THR HG2% A 116 TYR HE% 1.0 . 3.89 2280 1943 A 69 TYR HA A 41 TRP HE3 1.0 . 4.09 2281 1944 A 41 TRP HE3 A 41 TRP HA 1.0 . 3.61 2282 1945 A 35 LYS HA A 41 TRP HE3 1.0 . 4.02 2283 1946 A 41 TRP HE3 A 33 PHE HBy 1.0 . 3.99 2284 1947 A 41 TRP HE3 A 41 TRP HBx 1.0 . 3.79 2285 1948 A 41 TRP HE3 A 35 LYS HBy 1.0 . 4.11 2286 1949 A 41 TRP HE3 A 35 LYS HBx 1.0 . 4.65 2287 1950 A 93 VAL HGx% A 95 PHE HZ 1.0 . 4.17 2288 1951 A 93 VAL HGy% A 95 PHE HZ 1.0 . 4.36 2289 1952 A 107 ILE HG2% A 95 PHE HZ 1.0 . 4.02 2290 1953 A 121 VAL HGy% A 95 PHE HZ 1.0 . 4.53 2291 1954 A 59 THR HG2% A 64 PHE HD% 1.0 . 4.51 2292 1955 A 31 HIS HBx A 31 HIS HD2 1.0 . 3.65 2293 1956 A 29 ALA HB% A 31 HIS HD2 1.0 . 4.18 2294 1957 A 46 SER HBy A 31 HIS HD2 1.0 . 3.53 2295 1958 A 46 SER HBx A 31 HIS HD2 1.0 . 4.35 2296 1959 A 31 HIS HA A 31 HIS HD2 1.0 . 3.68 2297 1960 A 47 GLY H A 31 HIS HD2 1.0 . 4.04 2298 1961 A 32 VAL H A 31 HIS HD2 1.0 . 5.27 2299 1962 A 31 HIS H A 31 HIS HD2 1.0 . 4.09 2300 1963 A 95 PHE HD% A 95 PHE HA 1.0 . 3.93 2301 1964 A 2 PRO HGy A 1 GLY HAx 1.0 . 4.33 2302 1964 A 2 PRO HGy A 1 GLY HAy 1.0 . 4.33 2303 1965 A 5 THR HG2% A 6 GLY HAx 1.0 . 5.03 2304 1965 A 5 THR HG2% A 6 GLY HAy 1.0 . 5.03 2305 1966 A 7 GLU H A 6 GLY HAx 1.0 . 2.62 2306 1966 A 7 GLU H A 6 GLY HAy 1.0 . 2.62 2307 1967 A 6 GLY HAy A 7 GLU HBx 1.0 . 4.45 2308 1967 A 6 GLY HAx A 7 GLU HBx 1.0 . 4.45 2309 1967 A 7 GLU HBy A 6 GLY HAx 1.0 . 4.45 2310 1967 A 6 GLY HAy A 7 GLU HBy 1.0 . 4.45 2311 1968 A 7 GLU H A 7 GLU HBx 1.0 . 2.78 2312 1968 A 7 GLU H A 7 GLU HBy 1.0 . 2.78 2313 1969 A 7 GLU HA A 7 GLU HBx 1.0 . 2.59 2314 1969 A 7 GLU HA A 7 GLU HBy 1.0 . 2.59 2315 1970 A 8 SER H A 7 GLU HBx 1.0 . 3.45 2316 1970 A 8 SER H A 7 GLU HBy 1.0 . 3.45 2317 1971 A 8 SER HA A 7 GLU HBx 1.0 . 4.89 2318 1971 A 8 SER HA A 7 GLU HBy 1.0 . 4.89 2319 1972 A 9 LYS H A 9 LYS HGx 1.0 . 4.64 2320 1972 A 9 LYS H A 9 LYS HGy 1.0 . 4.64 2321 1973 A 9 LYS HA A 9 LYS HGx 1.0 . 2.82 2322 1973 A 9 LYS HA A 9 LYS HGy 1.0 . 2.82 2323 1974 A 9 LYS HBy A 9 LYS HGx 1.0 . 2.26 2324 1974 A 9 LYS HBx A 9 LYS HGx 1.0 . 2.26 2325 1974 A 9 LYS HGy A 9 LYS HBx 1.0 . 2.26 2326 1974 A 9 LYS HGy A 9 LYS HBy 1.0 . 2.26 2327 1975 A 9 LYS HBy A 9 LYS HE2 1.0 . 3.42 2328 1975 A 9 LYS HBx A 9 LYS HE2 1.0 . 3.42 2329 1975 A 9 LYS HE3 A 9 LYS HBx 1.0 . 3.42 2330 1975 A 9 LYS HE3 A 9 LYS HBy 1.0 . 3.42 2331 1976 A 9 LYS HD2 A 9 LYS HGx 1.0 . 2.30 2332 1976 A 9 LYS HGy A 9 LYS HD2 1.0 . 2.30 2333 1976 A 9 LYS HD3 A 9 LYS HGy 1.0 . 2.30 2334 1976 A 9 LYS HD3 A 9 LYS HGx 1.0 . 2.30 2335 1977 A 9 LYS HE2 A 9 LYS HGx 1.0 . 2.95 2336 1977 A 9 LYS HE3 A 9 LYS HGx 1.0 . 2.95 2337 1977 A 9 LYS HGy A 9 LYS HE2 1.0 . 2.95 2338 1977 A 9 LYS HE3 A 9 LYS HGy 1.0 . 2.95 2339 1978 A 10 CYS HB2 A 57 GLY HAy 1.0 . 4.52 2340 1978 A 10 CYS HB3 A 57 GLY HAy 1.0 . 4.52 2341 1978 A 57 GLY HAx A 10 CYS HB2 1.0 . 4.52 2342 1978 A 10 CYS HB3 A 57 GLY HAx 1.0 . 4.52 2343 1979 A 12 LEU H A 11 PRO HBx 1.0 . 4.01 2344 1979 A 12 LEU H A 11 PRO HBy 1.0 . 4.01 2345 1980 A 12 LEU H A 12 LEU HDy% 1.0 . 4.00 2346 1980 A 12 LEU H A 12 LEU HDx% 1.0 . 4.00 2347 1981 A 12 LEU HA A 12 LEU HDy% 1.0 . 3.16 2348 1981 A 12 LEU HA A 12 LEU HDx% 1.0 . 3.16 2349 1982 A 12 LEU HA A 105 TYR HBx 1.0 . 5.34 2350 1982 A 12 LEU HA A 105 TYR HBy 1.0 . 5.34 2351 1983 A 13 MET H A 12 LEU HDy% 1.0 . 3.87 2352 1983 A 13 MET H A 12 LEU HDx% 1.0 . 3.87 2353 1984 A 12 LEU HDx% A 13 MET HB2 1.0 . 5.37 2354 1984 A 12 LEU HDy% A 13 MET HB2 1.0 . 5.37 2355 1984 A 13 MET HB3 A 12 LEU HDy% 1.0 . 5.37 2356 1984 A 13 MET HB3 A 12 LEU HDx% 1.0 . 5.37 2357 1985 A 32 VAL HGx% A 12 LEU HDy% 1.0 . 3.88 2358 1985 A 32 VAL HGx% A 12 LEU HDx% 1.0 . 3.88 2359 1986 A 12 LEU HDx% A 44 PHE HE% 1.0 . 5.04 2360 1986 A 12 LEU HDy% A 44 PHE HE% 1.0 . 5.04 2361 1986 A 44 PHE HD% A 12 LEU HDy% 1.0 . 5.04 2362 1986 A 44 PHE HD% A 12 LEU HDx% 1.0 . 5.04 2363 1987 A 12 LEU HDx% A 105 TYR HBx 1.0 . 5.28 2364 1987 A 105 TYR HBy A 12 LEU HDy% 1.0 . 5.28 2365 1987 A 12 LEU HDx% A 105 TYR HBy 1.0 . 5.28 2366 1987 A 12 LEU HDy% A 105 TYR HBx 1.0 . 5.28 2367 1988 A 13 MET H A 13 MET HGx 1.0 . 4.96 2368 1988 A 13 MET H A 13 MET HGy 1.0 . 4.96 2369 1989 A 13 MET HA A 13 MET HGx 1.0 . 3.40 2370 1989 A 13 MET HA A 13 MET HGy 1.0 . 3.40 2371 1990 A 13 MET HE% A 13 MET HGx 1.0 . 2.73 2372 1990 A 13 MET HE% A 13 MET HGy 1.0 . 2.73 2373 1991 A 14 VAL H A 13 MET HGx 1.0 . 4.59 2374 1991 A 14 VAL H A 13 MET HGy 1.0 . 4.59 2375 1992 A 15 LYS HBx A 13 MET HGx 1.0 . 5.25 2376 1992 A 15 LYS HBx A 13 MET HGy 1.0 . 5.25 2377 1993 A 13 MET HGx A 15 LYS HE2 1.0 . 4.75 2378 1993 A 13 MET HGy A 15 LYS HE2 1.0 . 4.75 2379 1993 A 15 LYS HE3 A 13 MET HGx 1.0 . 4.75 2380 1993 A 15 LYS HE3 A 13 MET HGy 1.0 . 4.75 2381 1994 A 55 LEU H A 13 MET HGx 1.0 . 4.92 2382 1994 A 55 LEU H A 13 MET HGy 1.0 . 4.92 2383 1995 A 56 HIS HD2 A 13 MET HGx 1.0 . 3.85 2384 1995 A 56 HIS HD2 A 13 MET HGy 1.0 . 3.85 2385 1996 A 106 THR HB A 13 MET HGx 1.0 . 5.34 2386 1996 A 106 THR HB A 13 MET HGy 1.0 . 5.34 2387 1997 A 106 THR HG2% A 13 MET HGx 1.0 . 3.46 2388 1997 A 106 THR HG2% A 13 MET HGy 1.0 . 3.46 2389 1998 A 15 LYS HA A 17 LEU HDy% 1.0 . 4.57 2390 1998 A 15 LYS HA A 17 LEU HDx% 1.0 . 4.57 2391 1999 A 15 LYS HG2 A 17 LEU HDy% 1.0 . 3.11 2392 1999 A 15 LYS HG3 A 17 LEU HDy% 1.0 . 3.11 2393 1999 A 17 LEU HDx% A 15 LYS HG2 1.0 . 3.11 2394 1999 A 15 LYS HG3 A 17 LEU HDx% 1.0 . 3.11 2395 2000 A 15 LYS HD2 A 17 LEU HDy% 1.0 . 3.54 2396 2000 A 15 LYS HD3 A 17 LEU HDy% 1.0 . 3.54 2397 2000 A 17 LEU HDx% A 15 LYS HD2 1.0 . 3.54 2398 2000 A 15 LYS HD3 A 17 LEU HDx% 1.0 . 3.54 2399 2001 A 16 VAL H A 17 LEU HDy% 1.0 . 4.73 2400 2001 A 16 VAL H A 17 LEU HDx% 1.0 . 4.73 2401 2002 A 17 LEU H A 17 LEU HDy% 1.0 . 3.72 2402 2002 A 17 LEU H A 17 LEU HDx% 1.0 . 3.72 2403 2003 A 17 LEU HA A 17 LEU HDy% 1.0 . 3.14 2404 2003 A 17 LEU HA A 17 LEU HDx% 1.0 . 3.14 2405 2004 A 17 LEU HBy A 17 LEU HDy% 1.0 . 2.87 2406 2004 A 17 LEU HBy A 17 LEU HDx% 1.0 . 2.87 2407 2005 A 18 ASP H A 17 LEU HDy% 1.0 . 3.50 2408 2005 A 18 ASP H A 17 LEU HDx% 1.0 . 3.50 2409 2006 A 18 ASP HBx A 17 LEU HDy% 1.0 . 4.79 2410 2006 A 18 ASP HBx A 17 LEU HDx% 1.0 . 4.79 2411 2007 A 22 GLY H A 17 LEU HDy% 1.0 . 4.93 2412 2007 A 22 GLY H A 17 LEU HDx% 1.0 . 4.93 2413 2008 A 22 GLY HAy A 17 LEU HDy% 1.0 . 4.25 2414 2008 A 22 GLY HAy A 17 LEU HDx% 1.0 . 4.25 2415 2009 A 23 SER H A 17 LEU HDy% 1.0 . 3.86 2416 2009 A 23 SER H A 17 LEU HDx% 1.0 . 3.86 2417 2010 A 23 SER HA A 17 LEU HDy% 1.0 . 3.68 2418 2010 A 23 SER HA A 17 LEU HDx% 1.0 . 3.68 2419 2011 A 17 LEU HDx% A 23 SER HBx 1.0 . 4.69 2420 2011 A 17 LEU HDy% A 23 SER HBx 1.0 . 4.69 2421 2011 A 23 SER HBy A 17 LEU HDy% 1.0 . 4.69 2422 2011 A 17 LEU HDx% A 23 SER HBy 1.0 . 4.69 2423 2012 A 24 PRO HA A 17 LEU HDy% 1.0 . 3.21 2424 2012 A 24 PRO HA A 17 LEU HDx% 1.0 . 3.21 2425 2013 A 24 PRO HGx A 17 LEU HDy% 1.0 . 3.93 2426 2013 A 24 PRO HGx A 17 LEU HDx% 1.0 . 3.93 2427 2014 A 24 PRO HDx A 17 LEU HDy% 1.0 . 4.20 2428 2014 A 24 PRO HDx A 17 LEU HDx% 1.0 . 4.20 2429 2015 A 24 PRO HDy A 17 LEU HDy% 1.0 . 3.67 2430 2015 A 24 PRO HDy A 17 LEU HDx% 1.0 . 3.67 2431 2016 A 25 ALA H A 17 LEU HDy% 1.0 . 4.35 2432 2016 A 25 ALA H A 17 LEU HDx% 1.0 . 4.35 2433 2017 A 53 GLY HAx A 17 LEU HDy% 1.0 . 4.61 2434 2017 A 53 GLY HAx A 17 LEU HDx% 1.0 . 4.61 2435 2018 A 110 MET HGy A 17 LEU HDy% 1.0 . 3.58 2436 2018 A 110 MET HGy A 17 LEU HDx% 1.0 . 3.58 2437 2019 A 110 MET HE% A 17 LEU HDy% 1.0 . 3.12 2438 2019 A 110 MET HE% A 17 LEU HDx% 1.0 . 3.12 2439 2020 A 18 ASP HA A 111 LEU HBx 1.0 . 3.84 2440 2020 A 18 ASP HA A 111 LEU HBy 1.0 . 3.84 2441 2021 A 19 ALA H A 111 LEU HBx 1.0 . 4.01 2442 2021 A 19 ALA H A 111 LEU HBy 1.0 . 4.01 2443 2022 A 19 ALA HB% A 112 SER HBx 1.0 . 3.83 2444 2022 A 19 ALA HB% A 112 SER HBy 1.0 . 3.83 2445 2023 A 20 VAL HGy% A 112 SER HBx 1.0 . 3.84 2446 2023 A 20 VAL HGy% A 112 SER HBy 1.0 . 3.84 2447 2024 A 20 VAL HGy% A 113 PRO HDx 1.0 . 3.52 2448 2024 A 20 VAL HGy% A 113 PRO HDy 1.0 . 3.52 2449 2025 A 21 ARG HBx A 23 SER HBx 1.0 . 3.78 2450 2025 A 21 ARG HBx A 23 SER HBy 1.0 . 3.78 2451 2026 A 21 ARG HBy A 23 SER HBx 1.0 . 4.00 2452 2026 A 21 ARG HBy A 23 SER HBy 1.0 . 4.00 2453 2027 A 21 ARG HBy A 82 LEU HDy% 1.0 . 4.66 2454 2027 A 21 ARG HBy A 82 LEU HDx% 1.0 . 4.66 2455 2028 A 21 ARG HD2 A 23 SER HBx 1.0 . 4.52 2456 2028 A 23 SER HBy A 21 ARG HD2 1.0 . 4.52 2457 2028 A 21 ARG HD3 A 23 SER HBy 1.0 . 4.52 2458 2028 A 21 ARG HD3 A 23 SER HBx 1.0 . 4.52 2459 2029 A 21 ARG HD2 A 82 LEU HDy% 1.0 . 3.42 2460 2029 A 21 ARG HD3 A 82 LEU HDy% 1.0 . 3.42 2461 2029 A 82 LEU HDx% A 21 ARG HD2 1.0 . 3.42 2462 2029 A 21 ARG HD3 A 82 LEU HDx% 1.0 . 3.42 2463 2030 A 23 SER H A 23 SER HBx 1.0 . 3.25 2464 2030 A 23 SER H A 23 SER HBy 1.0 . 3.25 2465 2031 A 24 PRO HGy A 23 SER HBx 1.0 . 4.22 2466 2031 A 24 PRO HGy A 23 SER HBy 1.0 . 4.22 2467 2032 A 24 PRO HGx A 23 SER HBx 1.0 . 4.74 2468 2032 A 24 PRO HGx A 23 SER HBy 1.0 . 4.74 2469 2033 A 24 PRO HDx A 23 SER HBx 1.0 . 2.96 2470 2033 A 24 PRO HDx A 23 SER HBy 1.0 . 2.96 2471 2034 A 25 ALA HB% A 111 LEU HBx 1.0 . 5.34 2472 2034 A 25 ALA HB% A 111 LEU HBy 1.0 . 5.34 2473 2035 A 26 ILE H A 26 ILE HG1x 1.0 . 3.57 2474 2035 A 26 ILE H A 26 ILE HG1y 1.0 . 3.57 2475 2036 A 26 ILE HG2% A 26 ILE HG1x 1.0 . 3.19 2476 2036 A 26 ILE HG2% A 26 ILE HG1y 1.0 . 3.19 2477 2037 A 27 ASN HD2x A 26 ILE HG1x 1.0 . 4.47 2478 2037 A 27 ASN HD2x A 26 ILE HG1y 1.0 . 4.47 2479 2038 A 27 ASN HD2y A 26 ILE HG1x 1.0 . 5.34 2480 2038 A 27 ASN HD2y A 26 ILE HG1y 1.0 . 5.34 2481 2039 A 26 ILE HG1y A 50 SER HBx 1.0 . 5.18 2482 2039 A 26 ILE HG1x A 50 SER HBx 1.0 . 5.18 2483 2039 A 50 SER HBy A 26 ILE HG1x 1.0 . 5.18 2484 2039 A 26 ILE HG1y A 50 SER HBy 1.0 . 5.18 2485 2040 A 51 GLU HA A 26 ILE HG1x 1.0 . 3.56 2486 2040 A 51 GLU HA A 26 ILE HG1y 1.0 . 3.56 2487 2041 A 26 ILE HG1y A 51 GLU HB2 1.0 . 4.07 2488 2041 A 26 ILE HG1x A 51 GLU HB2 1.0 . 4.07 2489 2041 A 51 GLU HB3 A 26 ILE HG1x 1.0 . 4.07 2490 2041 A 51 GLU HB3 A 26 ILE HG1y 1.0 . 4.07 2491 2042 A 26 ILE HG1y A 51 GLU HG2 1.0 . 4.39 2492 2042 A 51 GLU HG3 A 26 ILE HG1x 1.0 . 4.39 2493 2042 A 51 GLU HG3 A 26 ILE HG1y 1.0 . 4.39 2494 2042 A 26 ILE HG1x A 51 GLU HG2 1.0 . 4.39 2495 2043 A 52 SER H A 26 ILE HG1x 1.0 . 4.44 2496 2043 A 52 SER H A 26 ILE HG1y 1.0 . 4.44 2497 2044 A 28 VAL HA A 74 ASP HBx 1.0 . 5.34 2498 2044 A 28 VAL HA A 74 ASP HBy 1.0 . 5.34 2499 2045 A 29 ALA H A 74 ASP HBx 1.0 . 4.39 2500 2045 A 29 ALA H A 74 ASP HBy 1.0 . 4.39 2501 2046 A 29 ALA HA A 74 ASP HBx 1.0 . 5.34 2502 2046 A 29 ALA HA A 74 ASP HBy 1.0 . 5.34 2503 2047 A 29 ALA HB% A 74 ASP HBx 1.0 . 3.46 2504 2047 A 29 ALA HB% A 74 ASP HBy 1.0 . 3.46 2505 2048 A 30 VAL HA A 74 ASP HBx 1.0 . 5.34 2506 2048 A 30 VAL HA A 74 ASP HBy 1.0 . 5.34 2507 2049 A 30 VAL HGy% A 55 LEU HBx 1.0 . 4.35 2508 2049 A 30 VAL HGy% A 55 LEU HBy 1.0 . 4.35 2509 2050 A 31 HIS HA A 55 LEU HDy% 1.0 . 5.44 2510 2050 A 31 HIS HA A 55 LEU HDx% 1.0 . 5.44 2511 2051 A 31 HIS HA A 58 LEU HDy% 1.0 . 4.89 2512 2051 A 31 HIS HA A 58 LEU HDx% 1.0 . 4.89 2513 2052 A 32 VAL H A 58 LEU HDy% 1.0 . 5.44 2514 2052 A 32 VAL H A 58 LEU HDx% 1.0 . 5.44 2515 2053 A 32 VAL HB A 58 LEU HDy% 1.0 . 4.09 2516 2053 A 32 VAL HB A 58 LEU HDx% 1.0 . 4.09 2517 2054 A 32 VAL HGy% A 58 LEU HDy% 1.0 . 2.47 2518 2054 A 32 VAL HGy% A 58 LEU HDx% 1.0 . 2.47 2519 2055 A 33 PHE HA A 34 ARG HBx 1.0 . 4.70 2520 2055 A 33 PHE HA A 34 ARG HBy 1.0 . 4.70 2521 2056 A 33 PHE HBx A 70 LYS HEy 1.0 . 4.43 2522 2056 A 33 PHE HBx A 70 LYS HEx 1.0 . 4.43 2523 2057 A 33 PHE HD% A 70 LYS HEy 1.0 . 3.95 2524 2057 A 33 PHE HD% A 70 LYS HEx 1.0 . 3.95 2525 2058 A 33 PHE HE% A 70 LYS HEy 1.0 . 5.04 2526 2058 A 33 PHE HE% A 70 LYS HEx 1.0 . 5.04 2527 2059 A 33 PHE HE% A 72 GLU HGx 1.0 . 5.02 2528 2059 A 33 PHE HE% A 72 GLU HGy 1.0 . 5.02 2529 2060 A 34 ARG H A 34 ARG HBx 1.0 . 3.37 2530 2060 A 34 ARG H A 34 ARG HBy 1.0 . 3.37 2531 2061 A 34 ARG H A 34 ARG HDx 1.0 . 4.87 2532 2061 A 34 ARG H A 34 ARG HDy 1.0 . 4.87 2533 2062 A 34 ARG HA A 34 ARG HDx 1.0 . 4.87 2534 2062 A 34 ARG HA A 34 ARG HDy 1.0 . 4.87 2535 2063 A 34 ARG HH1% A 34 ARG HBx 1.0 . 3.74 2536 2063 A 34 ARG HH1% A 34 ARG HBy 1.0 . 3.74 2537 2064 A 35 LYS H A 34 ARG HBx 1.0 . 3.92 2538 2064 A 35 LYS H A 34 ARG HBy 1.0 . 3.92 2539 2065 A 42 GLU H A 34 ARG HBx 1.0 . 4.68 2540 2065 A 42 GLU H A 34 ARG HBy 1.0 . 4.68 2541 2066 A 44 PHE H A 34 ARG HBx 1.0 . 5.34 2542 2066 A 44 PHE H A 34 ARG HBy 1.0 . 5.34 2543 2067 A 44 PHE HBy A 34 ARG HBx 1.0 . 4.39 2544 2067 A 44 PHE HBy A 34 ARG HBy 1.0 . 4.39 2545 2068 A 34 ARG HBx A 44 PHE HE% 1.0 . 4.73 2546 2068 A 34 ARG HBy A 44 PHE HE% 1.0 . 4.73 2547 2068 A 44 PHE HD% A 34 ARG HBx 1.0 . 4.73 2548 2068 A 44 PHE HD% A 34 ARG HBy 1.0 . 4.73 2549 2069 A 65 VAL HGy% A 34 ARG HBx 1.0 . 4.76 2550 2069 A 65 VAL HGy% A 34 ARG HBy 1.0 . 4.76 2551 2070 A 69 TYR HA A 34 ARG HBx 1.0 . 4.75 2552 2070 A 69 TYR HA A 34 ARG HBy 1.0 . 4.75 2553 2071 A 69 TYR HD% A 34 ARG HBx 1.0 . 3.97 2554 2071 A 69 TYR HD% A 34 ARG HBy 1.0 . 3.97 2555 2072 A 34 ARG HH1% A 34 ARG HDx 1.0 . 3.42 2556 2072 A 34 ARG HH1% A 34 ARG HDy 1.0 . 3.42 2557 2073 A 34 ARG HDx A 44 PHE HE% 1.0 . 3.95 2558 2073 A 34 ARG HDy A 44 PHE HE% 1.0 . 3.95 2559 2073 A 44 PHE HD% A 34 ARG HDx 1.0 . 3.95 2560 2073 A 44 PHE HD% A 34 ARG HDy 1.0 . 3.95 2561 2074 A 65 VAL HGy% A 34 ARG HDx 1.0 . 3.72 2562 2074 A 65 VAL HGy% A 34 ARG HDy 1.0 . 3.72 2563 2075 A 69 TYR HD% A 34 ARG HDx 1.0 . 5.19 2564 2075 A 69 TYR HD% A 34 ARG HDy 1.0 . 5.19 2565 2076 A 36 ALA HB% A 38 ASP HBx 1.0 . 4.09 2566 2076 A 36 ALA HB% A 38 ASP HBy 1.0 . 4.09 2567 2077 A 37 ALA H A 38 ASP HBx 1.0 . 4.23 2568 2077 A 37 ALA H A 38 ASP HBy 1.0 . 4.23 2569 2078 A 37 ALA HA A 38 ASP HBx 1.0 . 5.32 2570 2078 A 37 ALA HA A 38 ASP HBy 1.0 . 5.32 2571 2079 A 37 ALA HB% A 38 ASP HBx 1.0 . 4.07 2572 2079 A 37 ALA HB% A 38 ASP HBy 1.0 . 4.07 2573 2080 A 38 ASP HA A 38 ASP HBx 1.0 . 2.63 2574 2080 A 38 ASP HA A 38 ASP HBy 1.0 . 2.63 2575 2081 A 39 ASP H A 38 ASP HBx 1.0 . 3.77 2576 2081 A 39 ASP H A 38 ASP HBy 1.0 . 3.77 2577 2082 A 39 ASP HA A 38 ASP HBx 1.0 . 5.34 2578 2082 A 39 ASP HA A 38 ASP HBy 1.0 . 5.34 2579 2083 A 40 THR H A 38 ASP HBx 1.0 . 4.02 2580 2083 A 40 THR H A 38 ASP HBy 1.0 . 4.02 2581 2084 A 40 THR HG2% A 38 ASP HBx 1.0 . 3.70 2582 2084 A 40 THR HG2% A 38 ASP HBy 1.0 . 3.70 2583 2085 A 41 TRP HBx A 70 LYS HEy 1.0 . 5.34 2584 2085 A 41 TRP HBx A 70 LYS HEx 1.0 . 5.34 2585 2086 A 41 TRP HD1 A 70 LYS HEy 1.0 . 4.90 2586 2086 A 41 TRP HD1 A 70 LYS HEx 1.0 . 4.90 2587 2087 A 41 TRP HE1 A 70 LYS HEy 1.0 . 5.34 2588 2087 A 41 TRP HE1 A 70 LYS HEx 1.0 . 5.34 2589 2088 A 44 PHE HD% A 58 LEU HDy% 1.0 . 4.09 2590 2088 A 58 LEU HDx% A 44 PHE HE% 1.0 . 4.09 2591 2088 A 44 PHE HD% A 58 LEU HDx% 1.0 . 4.09 2592 2088 A 44 PHE HE% A 58 LEU HDy% 1.0 . 4.09 2593 2089 A 45 ALA H A 58 LEU HDy% 1.0 . 4.54 2594 2089 A 45 ALA H A 58 LEU HDx% 1.0 . 4.54 2595 2090 A 45 ALA HA A 58 LEU HDy% 1.0 . 3.96 2596 2090 A 45 ALA HA A 58 LEU HDx% 1.0 . 3.96 2597 2091 A 45 ALA HB% A 58 LEU HDy% 1.0 . 2.96 2598 2091 A 45 ALA HB% A 58 LEU HDx% 1.0 . 2.96 2599 2092 A 46 SER H A 58 LEU HDy% 1.0 . 3.09 2600 2092 A 46 SER H A 58 LEU HDx% 1.0 . 3.09 2601 2093 A 46 SER HA A 58 LEU HDy% 1.0 . 3.57 2602 2093 A 46 SER HA A 58 LEU HDx% 1.0 . 3.57 2603 2094 A 46 SER HBy A 58 LEU HDy% 1.0 . 4.51 2604 2094 A 46 SER HBy A 58 LEU HDx% 1.0 . 4.51 2605 2095 A 46 SER HBx A 58 LEU HDy% 1.0 . 4.30 2606 2095 A 46 SER HBx A 58 LEU HDx% 1.0 . 4.30 2607 2096 A 47 GLY H A 55 LEU HDy% 1.0 . 3.63 2608 2096 A 47 GLY H A 55 LEU HDx% 1.0 . 3.63 2609 2097 A 47 GLY H A 58 LEU HDy% 1.0 . 3.45 2610 2097 A 47 GLY H A 58 LEU HDx% 1.0 . 3.45 2611 2098 A 47 GLY HAy A 55 LEU HDy% 1.0 . 3.51 2612 2098 A 47 GLY HAy A 55 LEU HDx% 1.0 . 3.51 2613 2099 A 47 GLY HAx A 55 LEU HDy% 1.0 . 3.14 2614 2099 A 47 GLY HAx A 55 LEU HDx% 1.0 . 3.14 2615 2100 A 48 LYS H A 55 LEU HDy% 1.0 . 2.86 2616 2100 A 48 LYS H A 55 LEU HDx% 1.0 . 2.86 2617 2101 A 48 LYS HA A 55 LEU HDy% 1.0 . 4.85 2618 2101 A 48 LYS HA A 55 LEU HDx% 1.0 . 4.85 2619 2102 A 49 THR H A 55 LEU HDy% 1.0 . 4.82 2620 2102 A 49 THR H A 55 LEU HDx% 1.0 . 4.82 2621 2103 A 49 THR HA A 55 LEU HBx 1.0 . 3.86 2622 2103 A 49 THR HA A 55 LEU HBy 1.0 . 3.86 2623 2104 A 49 THR HA A 55 LEU HDy% 1.0 . 4.26 2624 2104 A 49 THR HA A 55 LEU HDx% 1.0 . 4.26 2625 2105 A 50 SER H A 50 SER HBx 1.0 . 3.66 2626 2105 A 50 SER H A 50 SER HBy 1.0 . 3.66 2627 2106 A 51 GLU H A 50 SER HBx 1.0 . 2.91 2628 2106 A 51 GLU H A 50 SER HBy 1.0 . 2.91 2629 2107 A 50 SER HBx A 51 GLU HB2 1.0 . 4.57 2630 2107 A 50 SER HBy A 51 GLU HB2 1.0 . 4.57 2631 2107 A 51 GLU HB3 A 50 SER HBx 1.0 . 4.57 2632 2107 A 51 GLU HB3 A 50 SER HBy 1.0 . 4.57 2633 2108 A 50 SER HBx A 51 GLU HG2 1.0 . 3.36 2634 2108 A 50 SER HBy A 51 GLU HG2 1.0 . 3.36 2635 2108 A 51 GLU HG3 A 50 SER HBx 1.0 . 3.36 2636 2108 A 51 GLU HG3 A 50 SER HBy 1.0 . 3.36 2637 2109 A 52 SER H A 50 SER HBx 1.0 . 3.50 2638 2109 A 52 SER H A 50 SER HBy 1.0 . 3.50 2639 2110 A 54 GLU H A 54 GLU HBy 1.0 . 3.37 2640 2110 A 54 GLU H A 54 GLU HBx 1.0 . 3.37 2641 2111 A 54 GLU HA A 55 LEU HBx 1.0 . 4.91 2642 2111 A 54 GLU HA A 55 LEU HBy 1.0 . 4.91 2643 2112 A 55 LEU H A 54 GLU HBy 1.0 . 3.76 2644 2112 A 55 LEU H A 54 GLU HBx 1.0 . 3.76 2645 2113 A 56 HIS HD2 A 54 GLU HBy 1.0 . 4.21 2646 2113 A 56 HIS HD2 A 54 GLU HBx 1.0 . 4.21 2647 2114 A 55 LEU H A 55 LEU HBx 1.0 . 3.57 2648 2114 A 55 LEU H A 55 LEU HBy 1.0 . 3.57 2649 2115 A 55 LEU H A 55 LEU HDy% 1.0 . 4.63 2650 2115 A 55 LEU H A 55 LEU HDx% 1.0 . 4.63 2651 2116 A 56 HIS HA A 55 LEU HDy% 1.0 . 5.44 2652 2116 A 56 HIS HA A 55 LEU HDx% 1.0 . 5.44 2653 2117 A 55 LEU HDx% A 56 HIS HBy 1.0 . 5.28 2654 2117 A 56 HIS HBx A 55 LEU HDy% 1.0 . 5.28 2655 2117 A 55 LEU HDx% A 56 HIS HBx 1.0 . 5.28 2656 2117 A 55 LEU HDy% A 56 HIS HBy 1.0 . 5.28 2657 2118 A 56 HIS HD2 A 56 HIS HBy 1.0 . 3.39 2658 2118 A 56 HIS HD2 A 56 HIS HBx 1.0 . 3.39 2659 2119 A 58 LEU H A 58 LEU HDy% 1.0 . 3.67 2660 2119 A 58 LEU H A 58 LEU HDx% 1.0 . 3.67 2661 2120 A 58 LEU HA A 58 LEU HDy% 1.0 . 2.80 2662 2120 A 58 LEU HA A 58 LEU HDx% 1.0 . 2.80 2663 2121 A 58 LEU HBx A 58 LEU HDy% 1.0 . 2.84 2664 2121 A 58 LEU HBx A 58 LEU HDx% 1.0 . 2.84 2665 2122 A 58 LEU HBy A 58 LEU HDy% 1.0 . 2.79 2666 2122 A 58 LEU HBy A 58 LEU HDx% 1.0 . 2.79 2667 2123 A 59 THR H A 58 LEU HDy% 1.0 . 4.61 2668 2123 A 59 THR H A 58 LEU HDx% 1.0 . 4.61 2669 2124 A 60 THR H A 63 GLU HBx 1.0 . 3.40 2670 2124 A 60 THR H A 63 GLU HBy 1.0 . 3.40 2671 2125 A 60 THR HA A 63 GLU HBx 1.0 . 5.04 2672 2125 A 60 THR HA A 63 GLU HBy 1.0 . 5.04 2673 2126 A 60 THR HB A 62 GLU HGy 1.0 . 3.68 2674 2126 A 60 THR HB A 62 GLU HGx 1.0 . 3.68 2675 2127 A 60 THR HB A 63 GLU HBx 1.0 . 4.65 2676 2127 A 60 THR HB A 63 GLU HBy 1.0 . 4.65 2677 2128 A 60 THR HG2% A 62 GLU HGy 1.0 . 4.26 2678 2128 A 60 THR HG2% A 62 GLU HGx 1.0 . 4.26 2679 2129 A 60 THR HG2% A 63 GLU HBx 1.0 . 3.92 2680 2129 A 60 THR HG2% A 63 GLU HBy 1.0 . 3.92 2681 2130 A 61 GLU H A 62 GLU HBx 1.0 . 5.34 2682 2130 A 61 GLU H A 62 GLU HBy 1.0 . 5.34 2683 2131 A 61 GLU H A 62 GLU HGy 1.0 . 3.81 2684 2131 A 61 GLU H A 62 GLU HGx 1.0 . 3.81 2685 2132 A 62 GLU H A 62 GLU HBx 1.0 . 3.10 2686 2132 A 62 GLU H A 62 GLU HBy 1.0 . 3.10 2687 2133 A 62 GLU H A 62 GLU HGy 1.0 . 2.98 2688 2133 A 62 GLU H A 62 GLU HGx 1.0 . 2.98 2689 2134 A 62 GLU HA A 62 GLU HGy 1.0 . 2.78 2690 2134 A 62 GLU HGx A 62 GLU HA 1.0 . 2.78 2691 2135 A 62 GLU HBx A 62 GLU HGy 1.0 . 2.33 2692 2135 A 62 GLU HBy A 62 GLU HGy 1.0 . 2.33 2693 2135 A 62 GLU HGx A 62 GLU HBx 1.0 . 2.33 2694 2135 A 62 GLU HGx A 62 GLU HBy 1.0 . 2.33 2695 2136 A 63 GLU H A 62 GLU HBx 1.0 . 4.06 2696 2136 A 63 GLU H A 62 GLU HBy 1.0 . 4.06 2697 2137 A 63 GLU H A 63 GLU HBx 1.0 . 3.42 2698 2137 A 63 GLU H A 63 GLU HBy 1.0 . 3.42 2699 2138 A 63 GLU HA A 63 GLU HBx 1.0 . 2.63 2700 2138 A 63 GLU HA A 63 GLU HBy 1.0 . 2.63 2701 2139 A 64 PHE H A 63 GLU HBx 1.0 . 3.59 2702 2139 A 64 PHE H A 63 GLU HBy 1.0 . 3.59 2703 2140 A 65 VAL HGx% A 66 GLU HBx 1.0 . 5.32 2704 2140 A 65 VAL HGx% A 66 GLU HBy 1.0 . 5.32 2705 2141 A 66 GLU H A 66 GLU HBx 1.0 . 3.03 2706 2141 A 66 GLU H A 66 GLU HBy 1.0 . 3.03 2707 2142 A 66 GLU H A 66 GLU HGx 1.0 . 4.44 2708 2142 A 66 GLU H A 66 GLU HGy 1.0 . 4.44 2709 2143 A 66 GLU HA A 66 GLU HGx 1.0 . 3.34 2710 2143 A 66 GLU HA A 66 GLU HGy 1.0 . 3.34 2711 2144 A 67 GLY H A 66 GLU HBx 1.0 . 3.61 2712 2144 A 67 GLY H A 66 GLU HBy 1.0 . 3.61 2713 2145 A 67 GLY H A 66 GLU HGx 1.0 . 3.92 2714 2145 A 67 GLY H A 66 GLU HGy 1.0 . 3.92 2715 2146 A 67 GLY HAy A 66 GLU HGx 1.0 . 4.63 2716 2146 A 67 GLY HAy A 66 GLU HGy 1.0 . 4.63 2717 2147 A 70 LYS H A 70 LYS HEy 1.0 . 4.55 2718 2147 A 70 LYS H A 70 LYS HEx 1.0 . 4.55 2719 2148 A 70 LYS HA A 70 LYS HEy 1.0 . 4.70 2720 2148 A 70 LYS HA A 70 LYS HEx 1.0 . 4.70 2721 2149 A 70 LYS HDy A 72 GLU HGx 1.0 . 4.79 2722 2149 A 70 LYS HDy A 72 GLU HGy 1.0 . 4.79 2723 2150 A 71 VAL H A 70 LYS HEy 1.0 . 5.34 2724 2150 A 71 VAL H A 70 LYS HEx 1.0 . 5.34 2725 2151 A 72 GLU HA A 70 LYS HEy 1.0 . 5.34 2726 2151 A 72 GLU HA A 70 LYS HEx 1.0 . 5.34 2727 2152 A 72 GLU HBx A 70 LYS HEy 1.0 . 4.77 2728 2152 A 72 GLU HBx A 70 LYS HEx 1.0 . 4.77 2729 2153 A 70 LYS HEy A 72 GLU HGx 1.0 . 4.97 2730 2153 A 70 LYS HEx A 72 GLU HGx 1.0 . 4.97 2731 2153 A 72 GLU HGy A 70 LYS HEy 1.0 . 4.97 2732 2153 A 70 LYS HEx A 72 GLU HGy 1.0 . 4.97 2733 2154 A 71 VAL HGx% A 72 GLU HGx 1.0 . 5.34 2734 2154 A 71 VAL HGx% A 72 GLU HGy 1.0 . 5.34 2735 2155 A 72 GLU H A 72 GLU HGx 1.0 . 4.12 2736 2155 A 72 GLU H A 72 GLU HGy 1.0 . 4.12 2737 2156 A 72 GLU HA A 72 GLU HGx 1.0 . 3.67 2738 2156 A 72 GLU HA A 72 GLU HGy 1.0 . 3.67 2739 2157 A 72 GLU HA A 92 GLU HGx 1.0 . 4.06 2740 2157 A 72 GLU HA A 92 GLU HGy 1.0 . 4.06 2741 2158 A 72 GLU HBx A 72 GLU HGx 1.0 . 2.54 2742 2158 A 72 GLU HBx A 72 GLU HGy 1.0 . 2.54 2743 2159 A 92 GLU HA A 72 GLU HGx 1.0 . 4.52 2744 2159 A 92 GLU HA A 72 GLU HGy 1.0 . 4.52 2745 2160 A 93 VAL H A 72 GLU HGx 1.0 . 4.58 2746 2160 A 93 VAL H A 72 GLU HGy 1.0 . 4.58 2747 2161 A 73 ILE H A 92 GLU HGx 1.0 . 4.60 2748 2161 A 73 ILE H A 92 GLU HGy 1.0 . 4.60 2749 2162 A 73 ILE HA A 74 ASP HBx 1.0 . 4.88 2750 2162 A 73 ILE HA A 74 ASP HBy 1.0 . 4.88 2751 2163 A 73 ILE HG2% A 74 ASP HBx 1.0 . 4.59 2752 2163 A 73 ILE HG2% A 74 ASP HBy 1.0 . 4.59 2753 2164 A 76 LYS H A 74 ASP HBx 1.0 . 5.31 2754 2164 A 76 LYS H A 74 ASP HBy 1.0 . 5.31 2755 2165 A 77 SER H A 74 ASP HBx 1.0 . 4.43 2756 2165 A 77 SER H A 74 ASP HBy 1.0 . 4.43 2757 2166 A 75 THR HG2% A 111 LEU HBx 1.0 . 5.00 2758 2166 A 75 THR HG2% A 111 LEU HBy 1.0 . 5.00 2759 2167 A 76 LYS HA A 76 LYS HGx 1.0 . 3.60 2760 2167 A 76 LYS HA A 76 LYS HGy 1.0 . 3.60 2761 2168 A 76 LYS HA A 79 TRP HBy 1.0 . 4.79 2762 2168 A 76 LYS HA A 79 TRP HBx 1.0 . 4.79 2763 2169 A 76 LYS HB2 A 79 TRP HBy 1.0 . 4.87 2764 2169 A 76 LYS HB3 A 79 TRP HBy 1.0 . 4.87 2765 2169 A 79 TRP HBx A 76 LYS HB2 1.0 . 4.87 2766 2169 A 76 LYS HB3 A 79 TRP HBx 1.0 . 4.87 2767 2170 A 77 SER H A 76 LYS HGx 1.0 . 4.63 2768 2170 A 77 SER H A 76 LYS HGy 1.0 . 4.63 2769 2171 A 76 LYS HGx A 77 SER HB2 1.0 . 5.04 2770 2171 A 76 LYS HGy A 77 SER HB2 1.0 . 5.04 2771 2171 A 77 SER HB3 A 76 LYS HGx 1.0 . 5.04 2772 2171 A 77 SER HB3 A 76 LYS HGy 1.0 . 5.04 2773 2172 A 79 TRP H A 76 LYS HGx 1.0 . 5.34 2774 2172 A 79 TRP H A 76 LYS HGy 1.0 . 5.34 2775 2173 A 79 TRP H A 79 TRP HBy 1.0 . 3.35 2776 2173 A 79 TRP H A 79 TRP HBx 1.0 . 3.35 2777 2174 A 79 TRP H A 82 LEU HDy% 1.0 . 5.44 2778 2174 A 79 TRP H A 82 LEU HDx% 1.0 . 5.44 2779 2175 A 79 TRP HA A 82 LEU HDy% 1.0 . 2.50 2780 2175 A 79 TRP HA A 82 LEU HDx% 1.0 . 2.50 2781 2176 A 80 LYS H A 79 TRP HBy 1.0 . 4.04 2782 2176 A 80 LYS H A 79 TRP HBx 1.0 . 4.04 2783 2177 A 80 LYS HA A 79 TRP HBy 1.0 . 4.71 2784 2177 A 80 LYS HA A 79 TRP HBx 1.0 . 4.71 2785 2178 A 84 ILE H A 79 TRP HBy 1.0 . 4.00 2786 2178 A 84 ILE H A 79 TRP HBx 1.0 . 4.00 2787 2179 A 84 ILE HB A 79 TRP HBy 1.0 . 4.00 2788 2179 A 84 ILE HB A 79 TRP HBx 1.0 . 4.00 2789 2180 A 84 ILE HG2% A 79 TRP HBy 1.0 . 3.90 2790 2180 A 84 ILE HG2% A 79 TRP HBx 1.0 . 3.90 2791 2181 A 79 TRP HE3 A 82 LEU HDy% 1.0 . 3.51 2792 2181 A 79 TRP HE3 A 82 LEU HDx% 1.0 . 3.51 2793 2182 A 79 TRP HH2 A 111 LEU HBx 1.0 . 5.14 2794 2182 A 79 TRP HH2 A 111 LEU HBy 1.0 . 5.14 2795 2183 A 79 TRP HH2 A 113 PRO HDx 1.0 . 4.48 2796 2183 A 79 TRP HH2 A 113 PRO HDy 1.0 . 4.48 2797 2184 A 81 ALA H A 82 LEU HDy% 1.0 . 4.48 2798 2184 A 81 ALA H A 82 LEU HDx% 1.0 . 4.48 2799 2185 A 81 ALA HA A 82 LEU HDy% 1.0 . 4.75 2800 2185 A 81 ALA HA A 82 LEU HDx% 1.0 . 4.75 2801 2186 A 81 ALA HB% A 82 LEU HDy% 1.0 . 3.44 2802 2186 A 81 ALA HB% A 82 LEU HDx% 1.0 . 3.44 2803 2187 A 82 LEU H A 82 LEU HDy% 1.0 . 3.13 2804 2187 A 82 LEU H A 82 LEU HDx% 1.0 . 3.13 2805 2188 A 82 LEU HA A 82 LEU HDy% 1.0 . 4.18 2806 2188 A 82 LEU HA A 82 LEU HDx% 1.0 . 4.18 2807 2189 A 82 LEU HBy A 82 LEU HDy% 1.0 . 2.70 2808 2189 A 82 LEU HBy A 82 LEU HDx% 1.0 . 2.70 2809 2190 A 83 GLY H A 82 LEU HDy% 1.0 . 3.56 2810 2190 A 83 GLY H A 82 LEU HDx% 1.0 . 3.56 2811 2191 A 83 GLY HAx A 82 LEU HDy% 1.0 . 3.90 2812 2191 A 83 GLY HAx A 82 LEU HDx% 1.0 . 3.90 2813 2192 A 83 GLY HAy A 82 LEU HDy% 1.0 . 4.88 2814 2192 A 83 GLY HAy A 82 LEU HDx% 1.0 . 4.88 2815 2193 A 84 ILE H A 82 LEU HDy% 1.0 . 4.68 2816 2193 A 84 ILE H A 82 LEU HDx% 1.0 . 4.68 2817 2194 A 84 ILE HA A 82 LEU HDy% 1.0 . 3.77 2818 2194 A 84 ILE HA A 82 LEU HDx% 1.0 . 3.77 2819 2195 A 84 ILE HB A 82 LEU HDy% 1.0 . 3.13 2820 2195 A 84 ILE HB A 82 LEU HDx% 1.0 . 3.13 2821 2196 A 84 ILE HA A 85 SER HBx 1.0 . 5.00 2822 2196 A 84 ILE HA A 85 SER HBy 1.0 . 5.00 2823 2197 A 84 ILE HG2% A 85 SER HBx 1.0 . 3.80 2824 2197 A 84 ILE HG2% A 85 SER HBy 1.0 . 3.80 2825 2198 A 84 ILE HG2% A 113 PRO HDx 1.0 . 4.75 2826 2198 A 84 ILE HG2% A 113 PRO HDy 1.0 . 4.75 2827 2199 A 84 ILE HD1% A 85 SER HBx 1.0 . 5.34 2828 2199 A 84 ILE HD1% A 85 SER HBy 1.0 . 5.34 2829 2200 A 87 MET H A 87 MET HBy 1.0 . 3.19 2830 2200 A 87 MET H A 87 MET HBx 1.0 . 3.19 2831 2201 A 87 MET H A 87 MET HGy 1.0 . 3.49 2832 2201 A 87 MET H A 87 MET HGx 1.0 . 3.49 2833 2202 A 87 MET HE% A 87 MET HBy 1.0 . 3.71 2834 2202 A 87 MET HE% A 87 MET HBx 1.0 . 3.71 2835 2203 A 88 HIS H A 87 MET HGy 1.0 . 4.64 2836 2203 A 88 HIS H A 87 MET HGx 1.0 . 4.64 2837 2204 A 114 TYR HD% A 87 MET HGy 1.0 . 4.35 2838 2204 A 114 TYR HD% A 87 MET HGx 1.0 . 4.35 2839 2205 A 87 MET HE% A 114 TYR HBx 1.0 . 4.59 2840 2205 A 87 MET HE% A 114 TYR HBy 1.0 . 4.59 2841 2206 A 90 HIS HA A 92 GLU HGx 1.0 . 5.34 2842 2206 A 90 HIS HA A 92 GLU HGy 1.0 . 5.34 2843 2207 A 90 HIS HBx A 92 GLU HGx 1.0 . 4.37 2844 2207 A 90 HIS HBx A 92 GLU HGy 1.0 . 4.37 2845 2208 A 90 HIS HBy A 92 GLU HGx 1.0 . 5.34 2846 2208 A 90 HIS HBy A 92 GLU HGy 1.0 . 5.34 2847 2209 A 90 HIS HD2 A 92 GLU HGx 1.0 . 3.56 2848 2209 A 90 HIS HD2 A 92 GLU HGy 1.0 . 3.56 2849 2210 A 97 ALA HB% A 124 ASN HD2y 1.0 . 4.61 2850 2210 A 97 ALA HB% A 124 ASN HD2x 1.0 . 4.61 2851 2211 A 100 SER H A 99 ASP HBy 1.0 . 4.28 2852 2211 A 100 SER H A 99 ASP HBx 1.0 . 4.28 2853 2212 A 100 SER HA A 101 GLY HAx 1.0 . 4.39 2854 2212 A 100 SER HA A 101 GLY HAy 1.0 . 4.39 2855 2213 A 107 ILE HD1% A 105 TYR HBx 1.0 . 4.31 2856 2213 A 107 ILE HD1% A 105 TYR HBy 1.0 . 4.31 2857 2214 A 111 LEU H A 111 LEU HBx 1.0 . 3.56 2858 2214 A 111 LEU H A 111 LEU HBy 1.0 . 3.56 2859 2215 A 111 LEU HDy% A 111 LEU HBx 1.0 . 3.21 2860 2215 A 111 LEU HDy% A 111 LEU HBy 1.0 . 3.21 2861 2216 A 112 SER H A 111 LEU HBx 1.0 . 3.90 2862 2216 A 112 SER H A 111 LEU HBy 1.0 . 3.90 2863 2217 A 112 SER HA A 111 LEU HBx 1.0 . 4.85 2864 2217 A 112 SER HA A 111 LEU HBy 1.0 . 4.85 2865 2218 A 112 SER HA A 113 PRO HDx 1.0 . 3.52 2866 2218 A 112 SER HA A 113 PRO HDy 1.0 . 3.52 2867 2219 A 112 SER HBx A 113 PRO HDx 1.0 . 4.04 2868 2219 A 112 SER HBy A 113 PRO HDx 1.0 . 4.04 2869 2219 A 113 PRO HDy A 112 SER HBx 1.0 . 4.04 2870 2219 A 112 SER HBy A 113 PRO HDy 1.0 . 4.04 2871 2220 A 114 TYR H A 112 SER HBx 1.0 . 4.17 2872 2220 A 114 TYR H A 112 SER HBy 1.0 . 4.17 2873 2221 A 115 SER H A 112 SER HBx 1.0 . 3.96 2874 2221 A 115 SER H A 112 SER HBy 1.0 . 3.96 2875 2222 A 114 TYR H A 114 TYR HBx 1.0 . 3.28 2876 2222 A 114 TYR H A 114 TYR HBy 1.0 . 3.28 2877 2223 A 115 SER H A 114 TYR HBx 1.0 . 3.67 2878 2223 A 115 SER H A 114 TYR HBy 1.0 . 3.67 2879 2224 A 114 TYR HBx A 115 SER HBy 1.0 . 4.98 2880 2224 A 115 SER HBx A 114 TYR HBx 1.0 . 4.98 2881 2224 A 114 TYR HBy A 115 SER HBx 1.0 . 4.98 2882 2224 A 114 TYR HBy A 115 SER HBy 1.0 . 4.98 2883 2225 A 114 TYR HD% A 115 SER HBy 1.0 . 5.34 2884 2225 A 114 TYR HD% A 115 SER HBx 1.0 . 5.34 2885 2226 A 115 SER H A 115 SER HBy 1.0 . 3.52 2886 2226 A 115 SER H A 115 SER HBx 1.0 . 3.52 2887 2227 A 116 TYR H A 115 SER HBy 1.0 . 4.08 2888 2227 A 116 TYR H A 115 SER HBx 1.0 . 4.08 2889 2228 A 115 SER HBy A 116 TYR HBy 1.0 . 5.18 2890 2228 A 115 SER HBx A 116 TYR HBy 1.0 . 5.18 2891 2228 A 116 TYR HBx A 115 SER HBy 1.0 . 5.18 2892 2228 A 115 SER HBx A 116 TYR HBx 1.0 . 5.18 2893 2229 A 116 TYR HD% A 115 SER HBy 1.0 . 4.22 2894 2229 A 116 TYR HD% A 115 SER HBx 1.0 . 4.22 2895 2230 A 125 PRO HA A 124 ASN HBy 1.0 . 4.97 2896 2230 A 125 PRO HA A 124 ASN HBx 1.0 . 4.97 2897 2231 A 124 ASN HBy A 125 PRO HDx 1.0 . 3.24 2898 2231 A 125 PRO HDy A 124 ASN HBy 1.0 . 3.24 2899 2231 A 124 ASN HBx A 125 PRO HDy 1.0 . 3.24 2900 2231 A 124 ASN HBx A 125 PRO HDx 1.0 . 3.24 2901 2232 A 126 LYS H A 124 ASN HBy 1.0 . 5.34 2902 2232 A 126 LYS H A 124 ASN HBx 1.0 . 5.34 2903 2233 A 124 ASN HD2y A 125 PRO HDx 1.0 . 5.18 2904 2233 A 124 ASN HD2x A 125 PRO HDx 1.0 . 5.18 2905 2233 A 125 PRO HDy A 124 ASN HD2y 1.0 . 5.18 2906 2233 A 124 ASN HD2x A 125 PRO HDy 1.0 . 5.18 2907 2234 A 126 LYS H A 126 LYS HBx 1.0 . 3.10 2908 2234 A 126 LYS H A 126 LYS HBy 1.0 . 3.10 2909 2235 A 127 GLU H A 126 LYS HBx 1.0 . 4.23 2910 2235 A 127 GLU H A 126 LYS HBy 1.0 . 4.23 2911 2236 A 127 GLU H A 127 GLU HBy 1.0 . 2.72 2912 2236 A 127 GLU H A 127 GLU HBx 1.0 . 2.72 2913 2237 A 127 GLU HA A 127 GLU HBy 1.0 . 2.62 2914 2237 A 127 GLU HA A 127 GLU HBx 1.0 . 2.62 2915 2238 A 127 GLU HBy A 127 GLU HG2 1.0 . 2.42 2916 2238 A 127 GLU HBx A 127 GLU HG2 1.0 . 2.42 2917 2238 A 127 GLU HG3 A 127 GLU HBy 1.0 . 2.42 2918 2238 A 127 GLU HG3 A 127 GLU HBx 1.0 . 2.42 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 15 LYS H A 107 ILE O 1.0 . 2.0 2 2 A 107 ILE O A 15 LYS N 1.0 . 3.0 3 3 A 16 VAL H A 53 GLY O 1.0 . 2.0 4 4 A 53 GLY O A 16 VAL N 1.0 . 3.0 5 5 A 17 LEU H A 109 ALA O 1.0 . 2.0 6 6 A 109 ALA O A 17 LEU N 1.0 . 3.0 7 7 A 18 ASP H A 23 SER O 1.0 . 2.0 8 8 A 23 SER O A 18 ASP N 1.0 . 3.0 9 9 A 19 ALA H A 111 LEU O 1.0 . 2.0 10 10 A 111 LEU O A 19 ALA N 1.0 . 3.0 11 11 A 25 ALA H A 16 VAL O 1.0 . 2.0 12 12 A 16 VAL O A 25 ALA N 1.0 . 3.0 13 13 A 27 ASN H A 49 THR O 1.0 . 2.0 14 14 A 49 THR O A 27 ASN N 1.0 . 3.0 15 15 A 27 ASN HD2x A 27 ASN N 1.0 . 2.0 16 16 A 27 ASN N A 27 ASN ND2 1.0 . 3.0 17 17 A 30 VAL H A 47 GLY O 1.0 . 2.0 18 18 A 47 GLY O A 30 VAL N 1.0 . 3.0 19 19 A 31 HIS H A 72 GLU O 1.0 . 2.0 20 20 A 72 GLU O A 31 HIS N 1.0 . 3.0 21 21 A 32 VAL H A 45 ALA O 1.0 . 2.0 22 22 A 45 ALA O A 32 VAL N 1.0 . 3.0 23 23 A 33 PHE H A 70 LYS O 1.0 . 2.0 24 24 A 70 LYS O A 33 PHE N 1.0 . 3.0 25 25 A 34 ARG H A 42 GLU O 1.0 . 2.0 26 26 A 42 GLU O A 34 ARG N 1.0 . 3.0 27 27 A 35 LYS H A 68 ILE O 1.0 . 2.0 28 28 A 68 ILE O A 35 LYS N 1.0 . 3.0 29 29 A 36 ALA H A 40 THR O 1.0 . 2.0 30 30 A 40 THR O A 36 ALA N 1.0 . 3.0 31 31 A 42 GLU H A 34 ARG O 1.0 . 2.0 32 32 A 34 ARG O A 42 GLU N 1.0 . 3.0 33 33 A 44 PHE H A 32 VAL O 1.0 . 2.0 34 34 A 32 VAL O A 44 PHE N 1.0 . 3.0 35 35 A 45 ALA H A 32 VAL O 1.0 . 2.0 36 36 A 32 VAL O A 45 ALA N 1.0 . 3.0 37 37 A 47 GLY H A 30 VAL O 1.0 . 2.0 38 38 A 30 VAL O A 47 GLY N 1.0 . 3.0 39 39 A 53 GLY H A 50 SER O 1.0 . 2.0 40 40 A 50 SER O A 53 GLY N 1.0 . 3.0 41 41 A 64 PHE H A 60 THR O 1.0 . 2.0 42 42 A 60 THR O A 64 PHE N 1.0 . 3.0 43 43 A 69 TYR H A 95 PHE O 1.0 . 2.0 44 44 A 95 PHE O A 69 TYR N 1.0 . 3.0 45 45 A 70 LYS H A 33 PHE O 1.0 . 2.0 46 46 A 33 PHE O A 70 LYS N 1.0 . 3.0 47 47 A 71 VAL H A 93 VAL O 1.0 . 2.0 48 48 A 93 VAL O A 71 VAL N 1.0 . 3.0 49 49 A 72 GLU H A 31 HIS O 1.0 . 2.0 50 50 A 31 HIS O A 72 GLU N 1.0 . 3.0 51 51 A 73 ILE H A 91 ALA O 1.0 . 2.0 52 52 A 91 ALA O A 73 ILE N 1.0 . 3.0 53 53 A 74 ASP H A 29 ALA O 1.0 . 2.0 54 54 A 29 ALA O A 74 ASP N 1.0 . 3.0 55 55 A 79 TRP H A 75 THR O 1.0 . 2.0 56 56 A 75 THR O A 79 TRP N 1.0 . 3.0 57 57 A 83 GLY H A 79 TRP O 1.0 . 2.0 58 58 A 79 TRP O A 83 GLY N 1.0 . 3.0 59 59 A 84 ILE H A 79 TRP O 1.0 . 2.0 60 60 A 79 TRP O A 84 ILE N 1.0 . 3.0 61 61 A 91 ALA H A 73 ILE O 1.0 . 2.0 62 62 A 73 ILE O A 91 ALA N 1.0 . 3.0 63 63 A 93 VAL H A 71 VAL O 1.0 . 2.0 64 64 A 71 VAL O A 93 VAL N 1.0 . 3.0 65 65 A 95 PHE H A 69 TYR O 1.0 . 2.0 66 66 A 69 TYR O A 95 PHE N 1.0 . 3.0 67 67 A 107 ILE H A 13 MET O 1.0 . 2.0 68 68 A 13 MET O A 107 ILE N 1.0 . 3.0 69 69 A 110 MET H A 118 THR O 1.0 . 2.0 70 70 A 118 THR O A 110 MET N 1.0 . 3.0 71 71 A 111 LEU H A 17 LEU O 1.0 . 2.0 72 72 A 17 LEU O A 111 LEU N 1.0 . 3.0 73 73 A 15 LYS H A 107 ILE O 1.0 . 1.8 74 74 A 107 ILE O A 15 LYS N 1.0 . 2.7 75 75 A 16 VAL H A 53 GLY O 1.0 . 1.8 76 76 A 53 GLY O A 16 VAL N 1.0 . 2.7 77 77 A 17 LEU H A 109 ALA O 1.0 . 1.8 78 78 A 109 ALA O A 17 LEU N 1.0 . 2.7 79 79 A 18 ASP H A 23 SER O 1.0 . 1.8 80 80 A 23 SER O A 18 ASP N 1.0 . 2.7 81 81 A 19 ALA H A 111 LEU O 1.0 . 1.8 82 82 A 111 LEU O A 19 ALA N 1.0 . 2.7 83 83 A 25 ALA H A 16 VAL O 1.0 . 1.8 84 84 A 16 VAL O A 25 ALA N 1.0 . 2.7 85 85 A 27 ASN H A 49 THR O 1.0 . 1.8 86 86 A 49 THR O A 27 ASN N 1.0 . 2.7 87 87 A 27 ASN HD2x A 27 ASN N 1.0 . 1.8 88 88 A 27 ASN N A 27 ASN ND2 1.0 . 2.7 89 89 A 30 VAL H A 47 GLY O 1.0 . 1.8 90 90 A 47 GLY O A 30 VAL N 1.0 . 2.7 91 91 A 31 HIS H A 72 GLU O 1.0 . 1.8 92 92 A 72 GLU O A 31 HIS N 1.0 . 2.7 93 93 A 32 VAL H A 45 ALA O 1.0 . 1.8 94 94 A 45 ALA O A 32 VAL N 1.0 . 2.7 95 95 A 33 PHE H A 70 LYS O 1.0 . 1.8 96 96 A 70 LYS O A 33 PHE N 1.0 . 2.7 97 97 A 34 ARG H A 42 GLU O 1.0 . 1.8 98 98 A 42 GLU O A 34 ARG N 1.0 . 2.7 99 99 A 35 LYS H A 68 ILE O 1.0 . 1.8 100 100 A 68 ILE O A 35 LYS N 1.0 . 2.7 101 101 A 36 ALA H A 40 THR O 1.0 . 1.8 102 102 A 40 THR O A 36 ALA N 1.0 . 2.7 103 103 A 42 GLU H A 34 ARG O 1.0 . 1.8 104 104 A 34 ARG O A 42 GLU N 1.0 . 2.7 105 105 A 44 PHE H A 32 VAL O 1.0 . 1.8 106 106 A 32 VAL O A 44 PHE N 1.0 . 2.7 107 107 A 45 ALA H A 32 VAL O 1.0 . 1.8 108 108 A 32 VAL O A 45 ALA N 1.0 . 2.7 109 109 A 47 GLY H A 30 VAL O 1.0 . 1.8 110 110 A 30 VAL O A 47 GLY N 1.0 . 2.7 111 111 A 53 GLY H A 50 SER O 1.0 . 1.8 112 112 A 50 SER O A 53 GLY N 1.0 . 2.7 113 113 A 64 PHE H A 60 THR O 1.0 . 1.8 114 114 A 60 THR O A 64 PHE N 1.0 . 2.7 115 115 A 69 TYR H A 95 PHE O 1.0 . 1.8 116 116 A 95 PHE O A 69 TYR N 1.0 . 2.7 117 117 A 70 LYS H A 33 PHE O 1.0 . 1.8 118 118 A 33 PHE O A 70 LYS N 1.0 . 2.7 119 119 A 71 VAL H A 93 VAL O 1.0 . 1.8 120 120 A 93 VAL O A 71 VAL N 1.0 . 2.7 121 121 A 72 GLU H A 31 HIS O 1.0 . 1.8 122 122 A 31 HIS O A 72 GLU N 1.0 . 2.7 123 123 A 73 ILE H A 91 ALA O 1.0 . 1.8 124 124 A 91 ALA O A 73 ILE N 1.0 . 2.7 125 125 A 74 ASP H A 29 ALA O 1.0 . 1.8 126 126 A 29 ALA O A 74 ASP N 1.0 . 2.7 127 127 A 79 TRP H A 75 THR O 1.0 . 1.8 128 128 A 75 THR O A 79 TRP N 1.0 . 2.7 129 129 A 83 GLY H A 79 TRP O 1.0 . 1.8 130 130 A 79 TRP O A 83 GLY N 1.0 . 2.7 131 131 A 84 ILE H A 79 TRP O 1.0 . 1.8 132 132 A 79 TRP O A 84 ILE N 1.0 . 2.7 133 133 A 91 ALA H A 73 ILE O 1.0 . 1.8 134 134 A 73 ILE O A 91 ALA N 1.0 . 2.7 135 135 A 93 VAL H A 71 VAL O 1.0 . 1.8 136 136 A 71 VAL O A 93 VAL N 1.0 . 2.7 137 137 A 95 PHE H A 69 TYR O 1.0 . 1.8 138 138 A 69 TYR O A 95 PHE N 1.0 . 2.7 139 139 A 107 ILE H A 13 MET O 1.0 . 1.8 140 140 A 13 MET O A 107 ILE N 1.0 . 2.7 141 141 A 110 MET H A 118 THR O 1.0 . 1.8 142 142 A 118 THR O A 110 MET N 1.0 . 2.7 143 143 A 111 LEU H A 17 LEU O 1.0 . 1.8 144 144 A 17 LEU O A 111 LEU N 1.0 . 2.7 stop_ save_ save_DYANA/DIANA_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_4 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 9 LYS C A 10 CYS N A 10 CYS CA A 10 CYS C 1.0 -99.0 -48.0 PHI 2 2 A 10 CYS N A 10 CYS CA A 10 CYS C A 11 PRO N 1.0 102.6 173.7 PSI 3 3 A 11 PRO N A 11 PRO CA A 11 PRO C A 12 LEU N 1.0 -44.2 -4.2 PSI 4 4 A 11 PRO C A 12 LEU N A 12 LEU CA A 12 LEU C 1.0 -151.5 -108.0 PHI 5 5 A 12 LEU N A 12 LEU CA A 12 LEU C A 13 MET N 1.0 111.7 151.7 PSI 6 6 A 12 LEU C A 13 MET N A 13 MET CA A 13 MET C 1.0 -136.5 -91.6 PHI 7 7 A 13 MET N A 13 MET CA A 13 MET C A 14 VAL N 1.0 108.1 148.1 PSI 8 8 A 13 MET C A 14 VAL N A 14 VAL CA A 14 VAL C 1.0 -139.4 -99.4 PHI 9 9 A 14 VAL N A 14 VAL CA A 14 VAL C A 15 LYS N 1.0 111.5 151.5 PSI 10 10 A 14 VAL C A 15 LYS N A 15 LYS CA A 15 LYS C 1.0 -141.2 -97.2 PHI 11 11 A 15 LYS N A 15 LYS CA A 15 LYS C A 16 VAL N 1.0 109.0 149.0 PSI 12 12 A 15 LYS C A 16 VAL N A 16 VAL CA A 16 VAL C 1.0 -124.8 -84.8 PHI 13 13 A 16 VAL N A 16 VAL CA A 16 VAL C A 17 LEU N 1.0 102.7 142.7 PSI 14 14 A 16 VAL C A 17 LEU N A 17 LEU CA A 17 LEU C 1.0 -139.6 -99.6 PHI 15 15 A 17 LEU N A 17 LEU CA A 17 LEU C A 18 ASP N 1.0 117.1 157.1 PSI 16 16 A 17 LEU C A 18 ASP N A 18 ASP CA A 18 ASP C 1.0 -105.3 -65.3 PHI 17 17 A 18 ASP N A 18 ASP CA A 18 ASP C A 19 ALA N 1.0 92.2 144.0 PSI 18 18 A 18 ASP C A 19 ALA N A 19 ALA CA A 19 ALA C 1.0 -87.5 -47.5 PHI 19 19 A 19 ALA N A 19 ALA CA A 19 ALA C A 20 VAL N 1.0 -43.7 -3.7 PSI 20 20 A 19 ALA C A 20 VAL N A 20 VAL CA A 20 VAL C 1.0 -92.7 -52.7 PHI 21 21 A 20 VAL N A 20 VAL CA A 20 VAL C A 21 ARG N 1.0 -60.8 -20.8 PSI 22 22 A 20 VAL C A 21 ARG N A 21 ARG CA A 21 ARG C 1.0 -128.5 -65.9 PHI 23 23 A 21 ARG N A 21 ARG CA A 21 ARG C A 22 GLY N 1.0 -36.5 9.2 PSI 24 24 A 21 ARG C A 22 GLY N A 22 GLY CA A 22 GLY C 1.0 52.4 92.4 PHI 25 25 A 22 GLY N A 22 GLY CA A 22 GLY C A 23 SER N 1.0 4.3 44.3 PSI 26 26 A 22 GLY C A 23 SER N A 23 SER CA A 23 SER C 1.0 -143.1 -67.9 PHI 27 27 A 23 SER N A 23 SER CA A 23 SER C A 24 PRO N 1.0 126.8 168.2 PSI 28 28 A 24 PRO N A 24 PRO CA A 24 PRO C A 25 ALA N 1.0 124.1 164.1 PSI 29 29 A 24 PRO C A 25 ALA N A 25 ALA CA A 25 ALA C 1.0 -122.4 -64.4 PHI 30 30 A 25 ALA N A 25 ALA CA A 25 ALA C A 26 ILE N 1.0 90.1 150.3 PSI 31 31 A 25 ALA C A 26 ILE N A 26 ILE CA A 26 ILE C 1.0 -107.5 -48.4 PHI 32 32 A 26 ILE N A 26 ILE CA A 26 ILE C A 27 ASN N 1.0 123.1 163.1 PSI 33 33 A 28 VAL C A 29 ALA N A 29 ALA CA A 29 ALA C 1.0 -102.4 -53.0 PHI 34 34 A 29 ALA N A 29 ALA CA A 29 ALA C A 30 VAL N 1.0 109.4 149.4 PSI 35 35 A 29 ALA C A 30 VAL N A 30 VAL CA A 30 VAL C 1.0 -135.7 -94.0 PHI 36 36 A 30 VAL N A 30 VAL CA A 30 VAL C A 31 HIS N 1.0 108.5 148.5 PSI 37 37 A 30 VAL C A 31 HIS N A 31 HIS CA A 31 HIS C 1.0 -132.9 -92.9 PHI 38 38 A 31 HIS N A 31 HIS CA A 31 HIS C A 32 VAL N 1.0 105.2 154.4 PSI 39 39 A 31 HIS C A 32 VAL N A 32 VAL CA A 32 VAL C 1.0 -130.7 -90.7 PHI 40 40 A 32 VAL N A 32 VAL CA A 32 VAL C A 33 PHE N 1.0 110.3 150.3 PSI 41 41 A 32 VAL C A 33 PHE N A 33 PHE CA A 33 PHE C 1.0 -143.9 -103.9 PHI 42 42 A 33 PHE N A 33 PHE CA A 33 PHE C A 34 ARG N 1.0 125.4 165.4 PSI 43 43 A 33 PHE C A 34 ARG N A 34 ARG CA A 34 ARG C 1.0 -147.3 -101.3 PHI 44 44 A 34 ARG N A 34 ARG CA A 34 ARG C A 35 LYS N 1.0 114.8 154.8 PSI 45 45 A 34 ARG C A 35 LYS N A 35 LYS CA A 35 LYS C 1.0 -92.0 -52.0 PHI 46 46 A 35 LYS N A 35 LYS CA A 35 LYS C A 36 ALA N 1.0 102.6 150.6 PSI 47 47 A 35 LYS C A 36 ALA N A 36 ALA CA A 36 ALA C 1.0 -102.3 -50.3 PHI 48 48 A 36 ALA N A 36 ALA CA A 36 ALA C A 37 ALA N 1.0 143.7 183.7 PSI 49 49 A 36 ALA C A 37 ALA N A 37 ALA CA A 37 ALA C 1.0 -84.0 -44.0 PHI 50 50 A 37 ALA N A 37 ALA CA A 37 ALA C A 38 ASP N 1.0 -41.3 -1.3 PSI 51 51 A 37 ALA C A 38 ASP N A 38 ASP CA A 38 ASP C 1.0 -107.4 -67.4 PHI 52 52 A 38 ASP N A 38 ASP CA A 38 ASP C A 39 ASP N 1.0 -9.9 30.1 PSI 53 53 A 38 ASP C A 39 ASP N A 39 ASP CA A 39 ASP C 1.0 45.5 85.5 PHI 54 54 A 39 ASP N A 39 ASP CA A 39 ASP C A 40 THR N 1.0 0.6 51.2 PSI 55 55 A 40 THR C A 41 TRP N A 41 TRP CA A 41 TRP C 1.0 -137.7 -61.5 PHI 56 56 A 41 TRP N A 41 TRP CA A 41 TRP C A 42 GLU N 1.0 114.3 161.9 PSI 57 57 A 41 TRP C A 42 GLU N A 42 GLU CA A 42 GLU C 1.0 -159.4 -48.4 PHI 58 58 A 42 GLU N A 42 GLU CA A 42 GLU C A 43 PRO N 1.0 89.6 171.4 PSI 59 59 A 43 PRO N A 43 PRO CA A 43 PRO C A 44 PHE N 1.0 113.9 153.9 PSI 60 60 A 43 PRO C A 44 PHE N A 44 PHE CA A 44 PHE C 1.0 -129.4 -83.4 PHI 61 61 A 44 PHE N A 44 PHE CA A 44 PHE C A 45 ALA N 1.0 -63.8 -13.9 PSI 62 62 A 44 PHE C A 45 ALA N A 45 ALA CA A 45 ALA C 1.0 -179.8 -139.8 PHI 63 63 A 45 ALA N A 45 ALA CA A 45 ALA C A 46 SER N 1.0 135.6 175.6 PSI 64 64 A 45 ALA C A 46 SER N A 46 SER CA A 46 SER C 1.0 -171.5 -96.9 PHI 65 65 A 46 SER N A 46 SER CA A 46 SER C A 47 GLY N 1.0 131.2 172.4 PSI 66 66 A 47 GLY C A 48 LYS N A 48 LYS CA A 48 LYS C 1.0 -156.8 -103.1 PHI 67 67 A 48 LYS N A 48 LYS CA A 48 LYS C A 49 THR N 1.0 125.8 169.0 PSI 68 68 A 48 LYS C A 49 THR N A 49 THR CA A 49 THR C 1.0 -109.9 -43.4 PHI 69 69 A 49 THR N A 49 THR CA A 49 THR C A 50 SER N 1.0 115.7 174.0 PSI 70 70 A 49 THR C A 50 SER N A 50 SER CA A 50 SER C 1.0 -125.9 -47.9 PHI 71 71 A 50 SER N A 50 SER CA A 50 SER C A 51 GLU N 1.0 155.0 195.0 PSI 72 72 A 50 SER C A 51 GLU N A 51 GLU CA A 51 GLU C 1.0 -83.8 -43.8 PHI 73 73 A 51 GLU N A 51 GLU CA A 51 GLU C A 52 SER N 1.0 -41.3 -1.3 PSI 74 74 A 51 GLU C A 52 SER N A 52 SER CA A 52 SER C 1.0 -107.6 -67.6 PHI 75 75 A 52 SER N A 52 SER CA A 52 SER C A 53 GLY N 1.0 -21.2 18.8 PSI 76 76 A 52 SER C A 53 GLY N A 53 GLY CA A 53 GLY C 1.0 59.9 99.9 PHI 77 77 A 53 GLY N A 53 GLY CA A 53 GLY C A 54 GLU N 1.0 -1.3 38.7 PSI 78 78 A 53 GLY C A 54 GLU N A 54 GLU CA A 54 GLU C 1.0 -136.1 -89.2 PHI 79 79 A 54 GLU N A 54 GLU CA A 54 GLU C A 55 LEU N 1.0 130.6 170.6 PSI 80 80 A 54 GLU C A 55 LEU N A 55 LEU CA A 55 LEU C 1.0 -132.2 -62.1 PHI 81 81 A 55 LEU N A 55 LEU CA A 55 LEU C A 56 HIS N 1.0 105.7 157.9 PSI 82 82 A 55 LEU C A 56 HIS N A 56 HIS CA A 56 HIS C 1.0 -165.5 -81.9 PHI 83 83 A 56 HIS N A 56 HIS CA A 56 HIS C A 57 GLY N 1.0 117.3 173.0 PSI 84 84 A 57 GLY C A 58 LEU N A 58 LEU CA A 58 LEU C 1.0 -92.5 -50.8 PHI 85 85 A 58 LEU N A 58 LEU CA A 58 LEU C A 59 THR N 1.0 -58.6 -8.1 PSI 86 86 A 59 THR C A 60 THR N A 60 THR CA A 60 THR C 1.0 -153.3 -83.0 PHI 87 87 A 60 THR N A 60 THR CA A 60 THR C A 61 GLU N 1.0 143.3 183.3 PSI 88 88 A 60 THR C A 61 GLU N A 61 GLU CA A 61 GLU C 1.0 -78.4 -38.4 PHI 89 89 A 61 GLU N A 61 GLU CA A 61 GLU C A 62 GLU N 1.0 -53.9 -13.9 PSI 90 90 A 61 GLU C A 62 GLU N A 62 GLU CA A 62 GLU C 1.0 -89.0 -49.0 PHI 91 91 A 62 GLU N A 62 GLU CA A 62 GLU C A 63 GLU N 1.0 -40.6 -0.6 PSI 92 92 A 62 GLU C A 63 GLU N A 63 GLU CA A 63 GLU C 1.0 -108.5 -68.5 PHI 93 93 A 63 GLU N A 63 GLU CA A 63 GLU C A 64 PHE N 1.0 -29.9 13.6 PSI 94 94 A 63 GLU C A 64 PHE N A 64 PHE CA A 64 PHE C 1.0 -107.6 -65.4 PHI 95 95 A 64 PHE N A 64 PHE CA A 64 PHE C A 65 VAL N 1.0 19.3 123.6 PSI 96 96 A 64 PHE C A 65 VAL N A 65 VAL CA A 65 VAL C 1.0 -159.9 -63.8 PHI 97 97 A 65 VAL N A 65 VAL CA A 65 VAL C A 66 GLU N 1.0 127.3 180.4 PSI 98 98 A 67 GLY C A 68 ILE N A 68 ILE CA A 68 ILE C 1.0 -130.0 -58.2 PHI 99 99 A 68 ILE N A 68 ILE CA A 68 ILE C A 69 TYR N 1.0 108.2 148.2 PSI 100 100 A 68 ILE C A 69 TYR N A 69 TYR CA A 69 TYR C 1.0 -141.9 -101.9 PHI 101 101 A 69 TYR N A 69 TYR CA A 69 TYR C A 70 LYS N 1.0 130.3 170.3 PSI 102 102 A 69 TYR C A 70 LYS N A 70 LYS CA A 70 LYS C 1.0 -146.3 -104.3 PHI 103 103 A 70 LYS N A 70 LYS CA A 70 LYS C A 71 VAL N 1.0 108.3 148.3 PSI 104 104 A 70 LYS C A 71 VAL N A 71 VAL CA A 71 VAL C 1.0 -132.5 -92.5 PHI 105 105 A 71 VAL N A 71 VAL CA A 71 VAL C A 72 GLU N 1.0 107.7 147.7 PSI 106 106 A 71 VAL C A 72 GLU N A 72 GLU CA A 72 GLU C 1.0 -136.4 -96.4 PHI 107 107 A 72 GLU N A 72 GLU CA A 72 GLU C A 73 ILE N 1.0 110.7 166.3 PSI 108 108 A 72 GLU C A 73 ILE N A 73 ILE CA A 73 ILE C 1.0 -135.3 -95.3 PHI 109 109 A 73 ILE N A 73 ILE CA A 73 ILE C A 74 ASP N 1.0 109.4 149.4 PSI 110 110 A 73 ILE C A 74 ASP N A 74 ASP CA A 74 ASP C 1.0 -104.8 -61.9 PHI 111 111 A 74 ASP N A 74 ASP CA A 74 ASP C A 75 THR N 1.0 81.8 149.8 PSI 112 112 A 75 THR C A 76 LYS N A 76 LYS CA A 76 LYS C 1.0 -82.2 -42.2 PHI 113 113 A 76 LYS N A 76 LYS CA A 76 LYS C A 77 SER N 1.0 -64.7 -24.7 PSI 114 114 A 76 LYS C A 77 SER N A 77 SER CA A 77 SER C 1.0 -87.8 -47.8 PHI 115 115 A 77 SER N A 77 SER CA A 77 SER C A 78 TYR N 1.0 -54.6 -14.6 PSI 116 116 A 77 SER C A 78 TYR N A 78 TYR CA A 78 TYR C 1.0 -84.2 -44.2 PHI 117 117 A 78 TYR N A 78 TYR CA A 78 TYR C A 79 TRP N 1.0 -67.4 -27.4 PSI 118 118 A 78 TYR C A 79 TRP N A 79 TRP CA A 79 TRP C 1.0 -86.6 -46.6 PHI 119 119 A 79 TRP N A 79 TRP CA A 79 TRP C A 80 LYS N 1.0 -55.6 -15.6 PSI 120 120 A 79 TRP C A 80 LYS N A 80 LYS CA A 80 LYS C 1.0 -84.2 -44.2 PHI 121 121 A 80 LYS N A 80 LYS CA A 80 LYS C A 81 ALA N 1.0 -59.2 -19.2 PSI 122 122 A 80 LYS C A 81 ALA N A 81 ALA CA A 81 ALA C 1.0 -87.6 -47.6 PHI 123 123 A 81 ALA N A 81 ALA CA A 81 ALA C A 82 LEU N 1.0 -48.9 -8.9 PSI 124 124 A 81 ALA C A 82 LEU N A 82 LEU CA A 82 LEU C 1.0 -106.7 -66.7 PHI 125 125 A 82 LEU N A 82 LEU CA A 82 LEU C A 83 GLY N 1.0 -21.2 18.8 PSI 126 126 A 82 LEU C A 83 GLY N A 83 GLY CA A 83 GLY C 1.0 55.7 95.7 PHI 127 127 A 83 GLY N A 83 GLY CA A 83 GLY C A 84 ILE N 1.0 6.2 46.2 PSI 128 128 A 83 GLY C A 84 ILE N A 84 ILE CA A 84 ILE C 1.0 -130.5 -89.3 PHI 129 129 A 84 ILE N A 84 ILE CA A 84 ILE C A 85 SER N 1.0 110.9 173.7 PSI 130 130 A 84 ILE C A 85 SER N A 85 SER CA A 85 SER C 1.0 -97.4 -53.7 PHI 131 131 A 85 SER N A 85 SER CA A 85 SER C A 86 PRO N 1.0 105.1 163.3 PSI 132 132 A 86 PRO C A 87 MET N A 87 MET CA A 87 MET C 1.0 -98.4 -49.4 PHI 133 133 A 87 MET N A 87 MET CA A 87 MET C A 88 HIS N 1.0 -55.7 -6.7 PSI 134 134 A 87 MET C A 88 HIS N A 88 HIS CA A 88 HIS C 1.0 -149.9 -84.0 PHI 135 135 A 88 HIS N A 88 HIS CA A 88 HIS C A 89 GLU N 1.0 119.2 175.9 PSI 136 136 A 89 GLU C A 90 HIS N A 90 HIS CA A 90 HIS C 1.0 -159.2 -103.1 PHI 137 137 A 90 HIS N A 90 HIS CA A 90 HIS C A 91 ALA N 1.0 112.8 169.6 PSI 138 138 A 90 HIS C A 91 ALA N A 91 ALA CA A 91 ALA C 1.0 -164.6 -88.2 PHI 139 139 A 91 ALA N A 91 ALA CA A 91 ALA C A 92 GLU N 1.0 117.9 159.7 PSI 140 140 A 91 ALA C A 92 GLU N A 92 GLU CA A 92 GLU C 1.0 -151.5 -106.0 PHI 141 141 A 92 GLU N A 92 GLU CA A 92 GLU C A 93 VAL N 1.0 128.8 168.8 PSI 142 142 A 92 GLU C A 93 VAL N A 93 VAL CA A 93 VAL C 1.0 -145.9 -105.9 PHI 143 143 A 93 VAL N A 93 VAL CA A 93 VAL C A 94 VAL N 1.0 113.2 153.2 PSI 144 144 A 93 VAL C A 94 VAL N A 94 VAL CA A 94 VAL C 1.0 -131.2 -91.2 PHI 145 145 A 94 VAL N A 94 VAL CA A 94 VAL C A 95 PHE N 1.0 109.0 149.0 PSI 146 146 A 94 VAL C A 95 PHE N A 95 PHE CA A 95 PHE C 1.0 -139.0 -96.5 PHI 147 147 A 95 PHE N A 95 PHE CA A 95 PHE C A 96 THR N 1.0 108.4 149.1 PSI 148 148 A 95 PHE C A 96 THR N A 96 THR CA A 96 THR C 1.0 -121.3 -78.0 PHI 149 149 A 96 THR N A 96 THR CA A 96 THR C A 97 ALA N 1.0 106.8 147.6 PSI 150 150 A 96 THR C A 97 ALA N A 97 ALA CA A 97 ALA C 1.0 -121.1 -79.5 PHI 151 151 A 97 ALA N A 97 ALA CA A 97 ALA C A 98 ASN N 1.0 95.2 159.1 PSI 152 152 A 104 ARG C A 105 TYR N A 105 TYR CA A 105 TYR C 1.0 -148.6 -76.8 PHI 153 153 A 105 TYR N A 105 TYR CA A 105 TYR C A 106 THR N 1.0 120.4 160.4 PSI 154 154 A 105 TYR C A 106 THR N A 106 THR CA A 106 THR C 1.0 -133.0 -93.0 PHI 155 155 A 106 THR N A 106 THR CA A 106 THR C A 107 ILE N 1.0 105.5 145.5 PSI 156 156 A 106 THR C A 107 ILE N A 107 ILE CA A 107 ILE C 1.0 -125.7 -85.7 PHI 157 157 A 107 ILE N A 107 ILE CA A 107 ILE C A 108 ALA N 1.0 103.3 143.3 PSI 158 158 A 107 ILE C A 108 ALA N A 108 ALA CA A 108 ALA C 1.0 -132.8 -92.8 PHI 159 159 A 108 ALA N A 108 ALA CA A 108 ALA C A 109 ALA N 1.0 111.1 151.1 PSI 160 160 A 108 ALA C A 109 ALA N A 109 ALA CA A 109 ALA C 1.0 -145.9 -105.9 PHI 161 161 A 109 ALA N A 109 ALA CA A 109 ALA C A 110 MET N 1.0 114.7 154.7 PSI 162 162 A 109 ALA C A 110 MET N A 110 MET CA A 110 MET C 1.0 -121.9 -81.9 PHI 163 163 A 110 MET N A 110 MET CA A 110 MET C A 111 LEU N 1.0 98.0 147.3 PSI 164 164 A 110 MET C A 111 LEU N A 111 LEU CA A 111 LEU C 1.0 -129.5 -72.1 PHI 165 165 A 111 LEU N A 111 LEU CA A 111 LEU C A 112 SER N 1.0 104.6 158.5 PSI 166 166 A 111 LEU C A 112 SER N A 112 SER CA A 112 SER C 1.0 -160.5 -84.6 PHI 167 167 A 112 SER N A 112 SER CA A 112 SER C A 113 PRO N 1.0 98.1 199.4 PSI 168 168 A 113 PRO N A 113 PRO CA A 113 PRO C A 114 TYR N 1.0 -39.6 3.3 PSI 169 169 A 114 TYR C A 115 SER N A 115 SER CA A 115 SER C 1.0 -162.8 -33.3 PHI 170 170 A 115 SER N A 115 SER CA A 115 SER C A 116 TYR N 1.0 121.2 181.0 PSI 171 171 A 118 THR C A 119 MET N A 119 MET CA A 119 MET C 1.0 -154.1 -84.4 PHI 172 172 A 119 MET N A 119 MET CA A 119 MET C A 120 ALA N 1.0 116.1 156.1 PSI 173 173 A 119 MET C A 120 ALA N A 120 ALA CA A 120 ALA C 1.0 -142.7 -94.9 PHI 174 174 A 120 ALA N A 120 ALA CA A 120 ALA C A 121 VAL N 1.0 112.9 152.9 PSI 175 175 A 120 ALA C A 121 VAL N A 121 VAL CA A 121 VAL C 1.0 -125.7 -83.3 PHI 176 176 A 121 VAL N A 121 VAL CA A 121 VAL C A 122 VAL N 1.0 107.2 147.2 PSI 177 177 A 121 VAL C A 122 VAL N A 122 VAL CA A 122 VAL C 1.0 -127.1 -87.1 PHI 178 178 A 122 VAL N A 122 VAL CA A 122 VAL C A 123 THR N 1.0 109.3 149.3 PSI 179 179 A 122 VAL C A 123 THR N A 123 THR CA A 123 THR C 1.0 -130.5 -75.3 PHI 180 180 A 123 THR N A 123 THR CA A 123 THR C A 124 ASN N 1.0 105.6 153.7 PSI 181 181 A 27 ASN C A 28 VAL N A 28 VAL CA A 28 VAL C 1.0 -134.1 -34.7 PHI 182 182 A 28 VAL N A 28 VAL CA A 28 VAL C A 29 ALA N 1.0 99.6 170.0 PSI 183 183 A 46 SER C A 47 GLY N A 47 GLY CA A 47 GLY C 1.0 -249.0 -75.4 PHI 184 184 A 47 GLY N A 47 GLY CA A 47 GLY C A 48 LYS N 1.0 113.9 240.2 PSI 185 185 A 58 LEU C A 59 THR N A 59 THR CA A 59 THR C 1.0 -185.5 -109.4 PHI 186 186 A 59 THR N A 59 THR CA A 59 THR C A 60 THR N 1.0 135.0 203.5 PSI 187 187 A 65 VAL C A 66 GLU N A 66 GLU CA A 66 GLU C 1.0 -95.5 -35.5 PHI 188 188 A 66 GLU N A 66 GLU CA A 66 GLU C A 67 GLY N 1.0 105.9 165.9 PSI 189 189 A 100 SER C A 101 GLY N A 101 GLY CA A 101 GLY C 1.0 28.7 161.2 PHI 190 190 A 101 GLY N A 101 GLY CA A 101 GLY C A 102 PRO N 1.0 -216.0 -131.5 PSI 191 191 A 3 THR N A 3 THR CA A 3 THR CB A 3 THR OG1 1.0 41.8 74.2 CHI1 192 192 A 14 VAL N A 14 VAL CA A 14 VAL CB A 14 VAL CG1 1.0 -189.6 -165.6 CHI1 193 193 A 16 VAL N A 16 VAL CA A 16 VAL CB A 16 VAL CG1 1.0 -191.5 -159.9 CHI1 194 194 A 20 VAL N A 20 VAL CA A 20 VAL CB A 20 VAL CG1 1.0 162.4 194.8 CHI1 195 195 A 26 ILE N A 26 ILE CA A 26 ILE CB A 26 ILE CG1 1.0 -72.3 -47.5 CHI1 196 196 A 28 VAL N A 28 VAL CA A 28 VAL CB A 28 VAL CG1 1.0 -190.5 -160.9 CHI1 197 197 A 30 VAL N A 30 VAL CA A 30 VAL CB A 30 VAL CG1 1.0 -187.9 -161.5 CHI1 198 198 A 32 VAL N A 32 VAL CA A 32 VAL CB A 32 VAL CG1 1.0 -202.1 -148.5 CHI1 199 199 A 40 THR N A 40 THR CA A 40 THR CB A 40 THR OG1 1.0 33.6 78.4 CHI1 200 200 A 49 THR N A 49 THR CA A 49 THR CB A 49 THR OG1 1.0 43.7 71.7 CHI1 201 201 A 59 THR N A 59 THR CA A 59 THR CB A 59 THR OG1 1.0 44.0 78.4 CHI1 202 202 A 60 THR N A 60 THR CA A 60 THR CB A 60 THR OG1 1.0 53.6 74.4 CHI1 203 203 A 65 VAL N A 65 VAL CA A 65 VAL CB A 65 VAL CG1 1.0 -78.1 -38.9 CHI1 204 204 A 68 ILE N A 68 ILE CA A 68 ILE CB A 68 ILE CG1 1.0 -74.4 -44.4 CHI1 205 205 A 71 VAL N A 71 VAL CA A 71 VAL CB A 71 VAL CG1 1.0 -190.8 -160.8 CHI1 206 206 A 73 ILE N A 73 ILE CA A 73 ILE CB A 73 ILE CG1 1.0 -72.7 -43.1 CHI1 207 207 A 75 THR N A 75 THR CA A 75 THR CB A 75 THR OG1 1.0 45.4 75.8 CHI1 208 208 A 93 VAL N A 93 VAL CA A 93 VAL CB A 93 VAL CG1 1.0 -207.0 -140.6 CHI1 209 209 A 94 VAL N A 94 VAL CA A 94 VAL CB A 94 VAL CG1 1.0 -187.8 -161.4 CHI1 210 210 A 96 THR N A 96 THR CA A 96 THR CB A 96 THR OG1 1.0 -87.4 -32.6 CHI1 211 211 A 106 THR N A 106 THR CA A 106 THR CB A 106 THR OG1 1.0 -79.9 -42.7 CHI1 212 212 A 107 ILE N A 107 ILE CA A 107 ILE CB A 107 ILE CG1 1.0 -75.4 -43.4 CHI1 213 213 A 121 VAL N A 121 VAL CA A 121 VAL CB A 121 VAL CG1 1.0 -187.4 -164.6 CHI1 214 214 A 122 VAL N A 122 VAL CA A 122 VAL CB A 122 VAL CG1 1.0 -185.1 -168.3 CHI1 stop_ save_