data_nef_c18846_4cio 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 18845 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 25 GLY start . false 2 A 26 ALA middle . . 3 A 27 MET middle . . 4 A 28 GLY middle . false 5 A 29 SER middle . . 6 A 30 ARG middle . . 7 A 31 ASP middle . . 8 A 32 THR middle . . 9 A 33 MET middle . . 10 A 34 PHE middle . . 11 A 35 THR middle . . 12 A 36 LYS middle . . 13 A 37 ILE middle . . 14 A 38 PHE middle . . 15 A 39 VAL middle . . 16 A 40 GLY middle . false 17 A 41 GLY middle . false 18 A 42 LEU middle . . 19 A 43 PRO middle . false 20 A 44 TYR middle . . 21 A 45 HIS middle . . 22 A 46 THR middle . . 23 A 47 SER middle . . 24 A 48 ASP middle . . 25 A 49 LYS middle . . 26 A 50 THR middle . . 27 A 51 LEU middle . . 28 A 52 HIS middle . . 29 A 53 GLU middle . . 30 A 54 TYR middle . . 31 A 55 PHE middle . . 32 A 56 GLU middle . . 33 A 57 GLN middle . . 34 A 58 PHE middle . . 35 A 59 GLY middle . false 36 A 60 ASP middle . . 37 A 61 ILE middle . . 38 A 62 GLU middle . . 39 A 63 GLU middle . . 40 A 64 ALA middle . . 41 A 65 VAL middle . . 42 A 66 VAL middle . . 43 A 67 ILE middle . . 44 A 68 THR middle . . 45 A 69 ASP middle . . 46 A 70 ARG middle . . 47 A 71 ASN middle . . 48 A 72 THR middle . . 49 A 73 GLN middle . . 50 A 74 LYS middle . . 51 A 75 SER middle . . 52 A 76 ARG middle . . 53 A 77 GLY middle . false 54 A 78 TYR middle . . 55 A 79 GLY middle . false 56 A 80 PHE middle . . 57 A 81 VAL middle . . 58 A 82 THR middle . . 59 A 83 MET middle . . 60 A 84 LYS middle . . 61 A 85 ASP middle . . 62 A 86 ARG middle . . 63 A 87 ALA middle . . 64 A 88 SER middle . . 65 A 89 ALA middle . . 66 A 90 GLU middle . . 67 A 91 ARG middle . . 68 A 92 ALA middle . . 69 A 93 CYS middle . . 70 A 94 LYS middle . . 71 A 95 ASP middle . . 72 A 96 PRO middle . false 73 A 97 ASN middle . . 74 A 98 PRO middle . false 75 A 99 ILE middle . . 76 A 100 ILE middle . . 77 A 101 ASP middle . . 78 A 102 GLY middle . false 79 A 103 ARG middle . . 80 A 104 LYS middle . . 81 A 105 ALA middle . . 82 A 106 ASN middle . . 83 A 107 VAL middle . . 84 A 108 ASN middle . . 85 A 109 LEU middle . . 86 A 110 ALA middle . . 87 A 111 TYR middle . . 88 A 112 LEU middle . . 89 A 113 GLY middle . false 90 A 114 ALA middle . . 91 A 115 LYS middle . . 92 A 116 PRO middle . false 93 A 117 ARG middle . . 94 A 118 THR middle . . 95 A 119 ASN middle . . 96 A 120 VAL middle . . 97 A 121 GLN end . . 98 B 1 G start . . 99 B 2 G middle . . 100 B 3 U middle . . 101 B 4 G middle . . 102 B 5 U middle . . 103 B 6 G middle . . 104 B 7 C 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 25 GLY HAx H 1 3.858 0.02 A 25 GLY HAy H 1 3.858 0.02 A 25 GLY CA C 13 43.129 0.2 A 26 ALA HA H 1 4.335 0.02 A 26 ALA HB% H 1 1.38 0.02 A 26 ALA C C 13 177.861 0.2 A 26 ALA CA C 13 52.556 0.2 A 26 ALA CB C 13 19.247 0.2 A 27 MET H H 1 8.566 0.02 A 27 MET HA H 1 4.455 0.02 A 27 MET HBy H 1 2.096 0.02 A 27 MET HBx H 1 2.032 0.02 A 27 MET HE% H 1 2.069 0.02 A 27 MET HGx H 1 2.536 0.02 A 27 MET HGy H 1 2.608 0.02 A 27 MET C C 13 176.632 0.2 A 27 MET CA C 13 55.698 0.2 A 27 MET CB C 13 32.838 0.2 A 27 MET CE C 13 16.897 0.2 A 27 MET CG C 13 32.041 0.2 A 27 MET N N 15 119.982 0.2 A 28 GLY H H 1 8.453 0.02 A 28 GLY HAx H 1 3.984 0.02 A 28 GLY HAy H 1 3.984 0.02 A 28 GLY C C 13 174.1 0.2 A 28 GLY CA C 13 45.265 0.2 A 28 GLY N N 15 110.71 0.2 A 29 SER H H 1 8.261 0.02 A 29 SER HA H 1 4.43 0.02 A 29 SER HBx H 1 3.861 0.02 A 29 SER HBy H 1 3.888 0.02 A 29 SER C C 13 174.7 0.2 A 29 SER CA C 13 58.264 0.2 A 29 SER CB C 13 63.705 0.2 A 29 SER N N 15 116.004 0.2 A 30 ARG H H 1 8.438 0.02 A 30 ARG HA H 1 4.306 0.02 A 30 ARG HBx H 1 1.789 0.02 A 30 ARG HBy H 1 1.881 0.02 A 30 ARG HD2 H 1 3.206 0.02 A 30 ARG HD3 H 1 3.206 0.02 A 30 ARG HGy H 1 1.664 0.02 A 30 ARG HGx H 1 1.613 0.02 A 30 ARG C C 13 176.047 0.2 A 30 ARG CA C 13 56.326 0.2 A 30 ARG CB C 13 30.481 0.2 A 30 ARG CD C 13 43.197 0.2 A 30 ARG CG C 13 27.087 0.2 A 30 ARG N N 15 123.046 0.2 A 31 ASP H H 1 8.427 0.02 A 31 ASP HA H 1 4.665 0.02 A 31 ASP HBy H 1 2.829 0.02 A 31 ASP HBx H 1 2.662 0.02 A 31 ASP C C 13 177.387 0.2 A 31 ASP CA C 13 54.77 0.2 A 31 ASP CB C 13 40.945 0.2 A 31 ASP N N 15 121.519 0.2 A 32 THR H H 1 8.116 0.02 A 32 THR HA H 1 4.677 0.02 A 32 THR HB H 1 4.64 0.02 A 32 THR HG2% H 1 1.096 0.02 A 32 THR C C 13 175.473 0.2 A 32 THR CA C 13 60.948 0.2 A 32 THR CB C 13 68.83 0.2 A 32 THR CG2 C 13 21.05 0.2 A 32 THR N N 15 113.209 0.2 A 33 MET H H 1 8.063 0.02 A 33 MET HA H 1 3.756 0.02 A 33 MET HBy H 1 1.8 0.02 A 33 MET HBx H 1 1.286 0.02 A 33 MET HE% H 1 1.493 0.02 A 33 MET HGy H 1 1.274 0.02 A 33 MET HGx H 1 0.91 0.02 A 33 MET C C 13 177.009 0.2 A 33 MET CA C 13 60.172 0.2 A 33 MET CB C 13 32.787 0.2 A 33 MET CE C 13 16.547 0.2 A 33 MET CG C 13 30.874 0.2 A 33 MET N N 15 124.022 0.2 A 34 PHE H H 1 8.466 0.02 A 34 PHE HA H 1 4.979 0.02 A 34 PHE HBy H 1 3.546 0.02 A 34 PHE HBx H 1 2.754 0.02 A 34 PHE HD1 H 1 7.251 0.02 A 34 PHE HD2 H 1 7.251 0.02 A 34 PHE HE1 H 1 7.27 0.02 A 34 PHE HE2 H 1 7.27 0.02 A 34 PHE HZ H 1 7.25 0.02 A 34 PHE C C 13 174.448 0.2 A 34 PHE CA C 13 57.93 0.2 A 34 PHE CB C 13 39.102 0.2 A 34 PHE CD1 C 13 129.592 0.2 A 34 PHE CD2 C 13 129.592 0.2 A 34 PHE CE1 C 13 131.9 0.2 A 34 PHE CE2 C 13 131.9 0.2 A 34 PHE CZ C 13 129.4 0.2 A 34 PHE N N 15 111.217 0.2 A 35 THR H H 1 7.444 0.02 A 35 THR HA H 1 4.421 0.02 A 35 THR HB H 1 4.6 0.02 A 35 THR HG2% H 1 0.82 0.02 A 35 THR C C 13 173.81 0.2 A 35 THR CA C 13 61.308 0.2 A 35 THR CB C 13 69.819 0.2 A 35 THR CG2 C 13 22.287 0.2 A 35 THR N N 15 105.178 0.2 A 36 LYS H H 1 7.943 0.02 A 36 LYS HA H 1 4.988 0.02 A 36 LYS HBy H 1 2.084 0.02 A 36 LYS HBx H 1 1.794 0.02 A 36 LYS HDy H 1 1.635 0.02 A 36 LYS HDx H 1 1.545 0.02 A 36 LYS HEx H 1 2.37 0.02 A 36 LYS HEy H 1 2.847 0.02 A 36 LYS HG2 H 1 1 0.02 A 36 LYS HG3 H 1 1 0.02 A 36 LYS C C 13 174.945 0.2 A 36 LYS CA C 13 56.743 0.2 A 36 LYS CB C 13 33.998 0.2 A 36 LYS CD C 13 30.009 0.2 A 36 LYS CE C 13 41.675 0.2 A 36 LYS CG C 13 25.444 0.2 A 36 LYS N N 15 122.789 0.2 A 37 ILE H H 1 10.132 0.02 A 37 ILE HA H 1 4.224 0.02 A 37 ILE HB H 1 1.899 0.02 A 37 ILE HD1% H 1 0.727 0.02 A 37 ILE HG1x H 1 0.573 0.02 A 37 ILE HG1y H 1 1.802 0.02 A 37 ILE HG2% H 1 0.689 0.02 A 37 ILE C C 13 175.423 0.2 A 37 ILE CA C 13 61.831 0.2 A 37 ILE CB C 13 40.717 0.2 A 37 ILE CD1 C 13 15.764 0.2 A 37 ILE CG1 C 13 28.186 0.2 A 37 ILE CG2 C 13 18.498 0.2 A 37 ILE N N 15 133.81 0.2 A 38 PHE H H 1 9.278 0.02 A 38 PHE HA H 1 4.624 0.02 A 38 PHE HBx H 1 2.69 0.02 A 38 PHE HBy H 1 2.834 0.02 A 38 PHE HD1 H 1 6.665 0.02 A 38 PHE HD2 H 1 6.665 0.02 A 38 PHE HE1 H 1 6.616 0.02 A 38 PHE HE2 H 1 6.616 0.02 A 38 PHE HZ H 1 5.55 0.02 A 38 PHE C C 13 174.413 0.2 A 38 PHE CA C 13 57.542 0.2 A 38 PHE CB C 13 40.812 0.2 A 38 PHE CD1 C 13 131.067 0.2 A 38 PHE CD2 C 13 131.067 0.2 A 38 PHE CE1 C 13 131.2 0.2 A 38 PHE CE2 C 13 131.2 0.2 A 38 PHE CZ C 13 130.899 0.2 A 38 PHE N N 15 127.751 0.2 A 39 VAL H H 1 7.791 0.02 A 39 VAL HA H 1 4.336 0.02 A 39 VAL HB H 1 1.452 0.02 A 39 VAL HG1% H 1 0.666 0.02 A 39 VAL HG2% H 1 0.575 0.02 A 39 VAL C C 13 173.121 0.2 A 39 VAL CA C 13 58.557 0.2 A 39 VAL CB C 13 31.248 0.2 A 39 VAL CG1 C 13 21.636 0.2 A 39 VAL CG2 C 13 21.433 0.2 A 39 VAL N N 15 126.95 0.2 A 40 GLY H H 1 8.788 0.02 A 40 GLY HAy H 1 4.09 0.02 A 40 GLY HAx H 1 3.61 0.02 A 40 GLY C C 13 174.421 0.2 A 40 GLY CA C 13 43.393 0.2 A 40 GLY N N 15 112.873 0.2 A 41 GLY H H 1 8.36 0.02 A 41 GLY HAx H 1 3.789 0.02 A 41 GLY HAy H 1 3.981 0.02 A 41 GLY C C 13 174.596 0.2 A 41 GLY CA C 13 46.905 0.2 A 41 GLY N N 15 106.737 0.2 A 42 LEU H H 1 7.488 0.02 A 42 LEU HA H 1 4.287 0.02 A 42 LEU HBx H 1 0.924 0.02 A 42 LEU HBy H 1 1.12 0.02 A 42 LEU HD1% H 1 0.435 0.02 A 42 LEU HD2% H 1 0.624 0.02 A 42 LEU HG H 1 1.237 0.02 A 42 LEU C C 13 175.673 0.2 A 42 LEU CA C 13 52.243 0.2 A 42 LEU CB C 13 41.699 0.2 A 42 LEU CD1 C 13 26.03 0.2 A 42 LEU CD2 C 13 23.053 0.2 A 42 LEU CG C 13 26.387 0.2 A 42 LEU N N 15 117.218 0.2 A 43 PRO HA H 1 4.48 0.02 A 43 PRO HBx H 1 1.622 0.02 A 43 PRO HBy H 1 2.067 0.02 A 43 PRO HDy H 1 3.784 0.02 A 43 PRO HDx H 1 3.765 0.02 A 43 PRO HGx H 1 1.804 0.02 A 43 PRO HGy H 1 2.189 0.02 A 43 PRO C C 13 176.305 0.2 A 43 PRO CA C 13 63.201 0.2 A 43 PRO CB C 13 31.137 0.2 A 43 PRO CD C 13 50.633 0.2 A 43 PRO CG C 13 28.168 0.2 A 44 TYR H H 1 8.25 0.02 A 44 TYR HA H 1 4.124 0.02 A 44 TYR HBx H 1 2.782 0.02 A 44 TYR HBy H 1 3.287 0.02 A 44 TYR HD1 H 1 6.806 0.02 A 44 TYR HD2 H 1 6.806 0.02 A 44 TYR HE1 H 1 5.999 0.02 A 44 TYR HE2 H 1 5.999 0.02 A 44 TYR C C 13 174.667 0.2 A 44 TYR CA C 13 61.077 0.2 A 44 TYR CB C 13 37.003 0.2 A 44 TYR CD1 C 13 131.771 0.2 A 44 TYR CD2 C 13 131.771 0.2 A 44 TYR CE1 C 13 116.962 0.2 A 44 TYR CE2 C 13 116.962 0.2 A 44 TYR N N 15 121.733 0.2 A 45 HIS H H 1 7.482 0.02 A 45 HIS HA H 1 4.806 0.02 A 45 HIS HBy H 1 3.445 0.02 A 45 HIS HBx H 1 3.073 0.02 A 45 HIS HD2 H 1 7.154 0.02 A 45 HIS HE1 H 1 8.049 0.02 A 45 HIS C C 13 176.011 0.2 A 45 HIS CA C 13 55.68 0.2 A 45 HIS CB C 13 29.064 0.2 A 45 HIS CD2 C 13 119.52 0.2 A 45 HIS CE1 C 13 138.544 0.2 A 45 HIS N N 15 113.887 0.2 A 46 THR H H 1 7.194 0.02 A 46 THR HA H 1 4.036 0.02 A 46 THR HB H 1 3.685 0.02 A 46 THR HG2% H 1 1.144 0.02 A 46 THR C C 13 173.896 0.2 A 46 THR CA C 13 65.998 0.2 A 46 THR CB C 13 67.595 0.2 A 46 THR CG2 C 13 22.875 0.2 A 46 THR N N 15 123.625 0.2 A 47 SER H H 1 8.431 0.02 A 47 SER HA H 1 4.816 0.02 A 47 SER HBy H 1 4.422 0.02 A 47 SER HBx H 1 4.01 0.02 A 47 SER C C 13 174.224 0.2 A 47 SER CA C 13 55.705 0.2 A 47 SER CB C 13 67.55 0.2 A 47 SER N N 15 123.897 0.2 A 48 ASP H H 1 8.717 0.02 A 48 ASP HA H 1 4.072 0.02 A 48 ASP HBx H 1 2.761 0.02 A 48 ASP HBy H 1 2.983 0.02 A 48 ASP C C 13 177.831 0.2 A 48 ASP CA C 13 58.043 0.2 A 48 ASP CB C 13 39.999 0.2 A 48 ASP N N 15 119.765 0.2 A 49 LYS H H 1 7.967 0.02 A 49 LYS HA H 1 4.155 0.02 A 49 LYS HBx H 1 1.816 0.02 A 49 LYS HBy H 1 1.916 0.02 A 49 LYS HD2 H 1 1.721 0.02 A 49 LYS HD3 H 1 1.721 0.02 A 49 LYS HEy H 1 3.014 0.02 A 49 LYS HEx H 1 2.961 0.02 A 49 LYS HGx H 1 1.38 0.02 A 49 LYS HGy H 1 1.454 0.02 A 49 LYS C C 13 178.395 0.2 A 49 LYS CA C 13 59.472 0.2 A 49 LYS CB C 13 32.694 0.2 A 49 LYS CD C 13 29.077 0.2 A 49 LYS CE C 13 41.895 0.2 A 49 LYS CG C 13 24.56 0.2 A 49 LYS N N 15 118.78 0.2 A 50 THR H H 1 7.869 0.02 A 50 THR HA H 1 4.162 0.02 A 50 THR HB H 1 4.455 0.02 A 50 THR HG2% H 1 1.272 0.02 A 50 THR C C 13 177.696 0.2 A 50 THR CA C 13 66.02 0.2 A 50 THR CB C 13 67.417 0.2 A 50 THR CG2 C 13 22.746 0.2 A 50 THR N N 15 116.137 0.2 A 51 LEU H H 1 8.255 0.02 A 51 LEU HA H 1 4.14 0.02 A 51 LEU HBx H 1 1.297 0.02 A 51 LEU HBy H 1 1.945 0.02 A 51 LEU HD1% H 1 0.545 0.02 A 51 LEU HD2% H 1 0.936 0.02 A 51 LEU HG H 1 1.46 0.02 A 51 LEU C C 13 177.866 0.2 A 51 LEU CA C 13 58.216 0.2 A 51 LEU CB C 13 42.398 0.2 A 51 LEU CD1 C 13 26.226 0.2 A 51 LEU CD2 C 13 24.889 0.2 A 51 LEU CG C 13 26 0.2 A 51 LEU N N 15 124.158 0.2 A 52 HIS H H 1 8.57 0.02 A 52 HIS HA H 1 3.769 0.02 A 52 HIS HB2 H 1 3.576 0.02 A 52 HIS HB3 H 1 3.576 0.02 A 52 HIS HD2 H 1 7.316 0.02 A 52 HIS HE1 H 1 8.39 0.02 A 52 HIS C C 13 176.677 0.2 A 52 HIS CA C 13 60.625 0.2 A 52 HIS CB C 13 29.504 0.2 A 52 HIS CD2 C 13 119.543 0.2 A 52 HIS CE1 C 13 138.074 0.2 A 52 HIS N N 15 118.64 0.2 A 53 GLU H H 1 8.54 0.02 A 53 GLU HA H 1 4.082 0.02 A 53 GLU HBy H 1 2.274 0.02 A 53 GLU HBx H 1 2.081 0.02 A 53 GLU HGy H 1 2.65 0.02 A 53 GLU HGx H 1 2.34 0.02 A 53 GLU C C 13 178.506 0.2 A 53 GLU CA C 13 59.218 0.2 A 53 GLU CB C 13 29.667 0.2 A 53 GLU CG C 13 37.029 0.2 A 53 GLU N N 15 116.159 0.2 A 54 TYR H H 1 7.839 0.02 A 54 TYR HA H 1 4.093 0.02 A 54 TYR HBy H 1 3.223 0.02 A 54 TYR HBx H 1 2.896 0.02 A 54 TYR HD1 H 1 6.319 0.02 A 54 TYR HD2 H 1 6.319 0.02 A 54 TYR HE1 H 1 6.511 0.02 A 54 TYR HE2 H 1 6.511 0.02 A 54 TYR C C 13 177.103 0.2 A 54 TYR CA C 13 62.657 0.2 A 54 TYR CB C 13 37.858 0.2 A 54 TYR CD1 C 13 132.877 0.2 A 54 TYR CD2 C 13 132.877 0.2 A 54 TYR CE1 C 13 117.534 0.2 A 54 TYR CE2 C 13 117.534 0.2 A 54 TYR N N 15 117.816 0.2 A 55 PHE H H 1 7.806 0.02 A 55 PHE HA H 1 4.339 0.02 A 55 PHE HBy H 1 3.257 0.02 A 55 PHE HBx H 1 2.885 0.02 A 55 PHE HD1 H 1 7.814 0.02 A 55 PHE HD2 H 1 7.814 0.02 A 55 PHE HE1 H 1 7.34 0.02 A 55 PHE HE2 H 1 7.34 0.02 A 55 PHE HZ H 1 7.195 0.02 A 55 PHE C C 13 177.11 0.2 A 55 PHE CA C 13 62.056 0.2 A 55 PHE CB C 13 40.08 0.2 A 55 PHE CD1 C 13 132.341 0.2 A 55 PHE CD2 C 13 132.341 0.2 A 55 PHE CE1 C 13 131.402 0.2 A 55 PHE CE2 C 13 131.402 0.2 A 55 PHE CZ C 13 130.329 0.2 A 55 PHE N N 15 113.627 0.2 A 56 GLU H H 1 8.432 0.02 A 56 GLU HA H 1 4.431 0.02 A 56 GLU HBy H 1 2.16 0.02 A 56 GLU HBx H 1 2.072 0.02 A 56 GLU HGy H 1 2.62 0.02 A 56 GLU HGx H 1 2.429 0.02 A 56 GLU C C 13 177.139 0.2 A 56 GLU CA C 13 57.962 0.2 A 56 GLU CB C 13 28.728 0.2 A 56 GLU CG C 13 36.125 0.2 A 56 GLU N N 15 121.367 0.2 A 57 GLN H H 1 6.705 0.02 A 57 GLN HA H 1 4.083 0.02 A 57 GLN HBx H 1 1.554 0.02 A 57 GLN HBy H 1 1.554 0.02 A 57 GLN HE2y H 1 6.758 0.02 A 57 GLN HE2x H 1 6.045 0.02 A 57 GLN HGx H 1 0.144 0.02 A 57 GLN HGy H 1 1.5 0.02 A 57 GLN C C 13 175.834 0.2 A 57 GLN CA C 13 56.91 0.2 A 57 GLN CB C 13 28.45 0.2 A 57 GLN CG C 13 31.085 0.2 A 57 GLN N N 15 114.459 0.2 A 57 GLN NE2 N 15 112.518 0.2 A 58 PHE H H 1 7.646 0.02 A 58 PHE HA H 1 4.457 0.02 A 58 PHE HBy H 1 3.674 0.02 A 58 PHE HBx H 1 2.909 0.02 A 58 PHE HD1 H 1 7.369 0.02 A 58 PHE HD2 H 1 7.369 0.02 A 58 PHE HE1 H 1 7.021 0.02 A 58 PHE HE2 H 1 7.021 0.02 A 58 PHE HZ H 1 7.273 0.02 A 58 PHE C C 13 174.486 0.2 A 58 PHE CA C 13 58.661 0.2 A 58 PHE CB C 13 40.127 0.2 A 58 PHE CD1 C 13 131.838 0.2 A 58 PHE CD2 C 13 131.838 0.2 A 58 PHE CE1 C 13 132.173 0.2 A 58 PHE CE2 C 13 132.173 0.2 A 58 PHE CZ C 13 130.53 0.2 A 58 PHE N N 15 117.859 0.2 A 59 GLY H H 1 7.33 0.02 A 59 GLY HAx H 1 3.852 0.02 A 59 GLY HAy H 1 4.588 0.02 A 59 GLY C C 13 170.42 0.2 A 59 GLY CA C 13 44.285 0.2 A 59 GLY N N 15 105.908 0.2 A 60 ASP H H 1 8.22 0.02 A 60 ASP HA H 1 4.726 0.02 A 60 ASP HBy H 1 2.61 0.02 A 60 ASP HBx H 1 2.561 0.02 A 60 ASP C C 13 176.017 0.2 A 60 ASP CA C 13 54.721 0.2 A 60 ASP CB C 13 41.617 0.2 A 60 ASP N N 15 117.324 0.2 A 61 ILE H H 1 8.813 0.02 A 61 ILE HA H 1 4.13 0.02 A 61 ILE HB H 1 1.501 0.02 A 61 ILE HD1% H 1 0.344 0.02 A 61 ILE HG1x H 1 0.943 0.02 A 61 ILE HG1y H 1 1.529 0.02 A 61 ILE HG2% H 1 0.618 0.02 A 61 ILE C C 13 176.18 0.2 A 61 ILE CA C 13 61.3 0.2 A 61 ILE CB C 13 41.452 0.2 A 61 ILE CD1 C 13 14.484 0.2 A 61 ILE CG1 C 13 27.179 0.2 A 61 ILE CG2 C 13 18.415 0.2 A 61 ILE N N 15 124.156 0.2 A 62 GLU H H 1 9.164 0.02 A 62 GLU HA H 1 4.415 0.02 A 62 GLU HBy H 1 1.783 0.02 A 62 GLU HBx H 1 1.71 0.02 A 62 GLU HG2 H 1 2.113 0.02 A 62 GLU HG3 H 1 2.113 0.02 A 62 GLU C C 13 175.627 0.2 A 62 GLU CA C 13 57.696 0.2 A 62 GLU CB C 13 30.747 0.2 A 62 GLU CG C 13 35.452 0.2 A 62 GLU N N 15 128.45 0.2 A 63 GLU H H 1 7.604 0.02 A 63 GLU HA H 1 4.542 0.02 A 63 GLU HBy H 1 2.112 0.02 A 63 GLU HBx H 1 1.986 0.02 A 63 GLU HGx H 1 2.015 0.02 A 63 GLU HGy H 1 2.366 0.02 A 63 GLU C C 13 173.04 0.2 A 63 GLU CA C 13 55.804 0.2 A 63 GLU CB C 13 33.681 0.2 A 63 GLU CG C 13 37.082 0.2 A 63 GLU N N 15 118.647 0.2 A 64 ALA H H 1 8.937 0.02 A 64 ALA HA H 1 5.264 0.02 A 64 ALA HB% H 1 1.328 0.02 A 64 ALA C C 13 174.059 0.2 A 64 ALA CA C 13 51.763 0.2 A 64 ALA CB C 13 20.606 0.2 A 64 ALA N N 15 130.555 0.2 A 65 VAL H H 1 8.892 0.02 A 65 VAL HA H 1 4.762 0.02 A 65 VAL HB H 1 1.951 0.02 A 65 VAL HG1% H 1 0.946 0.02 A 65 VAL HG2% H 1 0.959 0.02 A 65 VAL C C 13 172.099 0.2 A 65 VAL CA C 13 58.764 0.2 A 65 VAL CB C 13 36.191 0.2 A 65 VAL CG1 C 13 20.224 0.2 A 65 VAL CG2 C 13 20.979 0.2 A 65 VAL N N 15 120.093 0.2 A 66 VAL H H 1 8.453 0.02 A 66 VAL HA H 1 3.75 0.02 A 66 VAL HB H 1 1.855 0.02 A 66 VAL HG1% H 1 0.706 0.02 A 66 VAL HG2% H 1 0.582 0.02 A 66 VAL C C 13 176.285 0.2 A 66 VAL CA C 13 62.282 0.2 A 66 VAL CB C 13 33.228 0.2 A 66 VAL CG1 C 13 20.868 0.2 A 66 VAL CG2 C 13 22.165 0.2 A 66 VAL N N 15 125.381 0.2 A 67 ILE H H 1 8.264 0.02 A 67 ILE HA H 1 4.112 0.02 A 67 ILE HB H 1 0.967 0.02 A 67 ILE HD1% H 1 0.807 0.02 A 67 ILE HG1x H 1 1.196 0.02 A 67 ILE HG1y H 1 1.473 0.02 A 67 ILE HG2% H 1 0.927 0.02 A 67 ILE C C 13 174.566 0.2 A 67 ILE CA C 13 58.912 0.2 A 67 ILE CB C 13 33.809 0.2 A 67 ILE CD1 C 13 9.048 0.2 A 67 ILE CG1 C 13 27.321 0.2 A 67 ILE CG2 C 13 17.428 0.2 A 67 ILE N N 15 129.463 0.2 A 68 THR H H 1 7.941 0.02 A 68 THR HA H 1 4.816 0.02 A 68 THR HB H 1 3.698 0.02 A 68 THR HG2% H 1 0.992 0.02 A 68 THR C C 13 174.517 0.2 A 68 THR CA C 13 59.171 0.2 A 68 THR CB C 13 71.835 0.2 A 68 THR CG2 C 13 21.289 0.2 A 68 THR N N 15 116.587 0.2 A 69 ASP H H 1 8.615 0.02 A 69 ASP HA H 1 4.617 0.02 A 69 ASP HBy H 1 3.116 0.02 A 69 ASP HBx H 1 2.511 0.02 A 69 ASP C C 13 177.348 0.2 A 69 ASP CA C 13 54.031 0.2 A 69 ASP CB C 13 42.786 0.2 A 69 ASP N N 15 122.61 0.2 A 70 ARG H H 1 8.982 0.02 A 70 ARG HA H 1 4.08 0.02 A 70 ARG HBy H 1 1.883 0.02 A 70 ARG HBx H 1 1.86 0.02 A 70 ARG HD2 H 1 3.206 0.02 A 70 ARG HD3 H 1 3.206 0.02 A 70 ARG HG2 H 1 1.703 0.02 A 70 ARG HG3 H 1 1.703 0.02 A 70 ARG C C 13 176.706 0.2 A 70 ARG CA C 13 58.298 0.2 A 70 ARG CB C 13 30.071 0.2 A 70 ARG CD C 13 43.196 0.2 A 70 ARG CG C 13 27.078 0.2 A 70 ARG N N 15 126.787 0.2 A 71 ASN H H 1 8.844 0.02 A 71 ASN HA H 1 4.602 0.02 A 71 ASN HBx H 1 2.869 0.02 A 71 ASN HBy H 1 3.021 0.02 A 71 ASN HD2y H 1 7.927 0.02 A 71 ASN HD2x H 1 7.04 0.02 A 71 ASN C C 13 176.816 0.2 A 71 ASN CA C 13 55.174 0.2 A 71 ASN CB C 13 39.128 0.2 A 71 ASN N N 15 115.971 0.2 A 71 ASN ND2 N 15 114.861 0.2 A 72 THR H H 1 8.139 0.02 A 72 THR HA H 1 4.381 0.02 A 72 THR HB H 1 4.339 0.02 A 72 THR HG2% H 1 1.195 0.02 A 72 THR C C 13 175.368 0.2 A 72 THR CA C 13 61.743 0.2 A 72 THR CB C 13 70.549 0.2 A 72 THR CG2 C 13 21.147 0.2 A 72 THR N N 15 108.673 0.2 A 73 GLN H H 1 8.323 0.02 A 73 GLN HA H 1 3.989 0.02 A 73 GLN HB2 H 1 2.398 0.02 A 73 GLN HB3 H 1 2.398 0.02 A 73 GLN HE2y H 1 7.435 0.02 A 73 GLN HE2x H 1 6.769 0.02 A 73 GLN HG2 H 1 2.304 0.02 A 73 GLN HG3 H 1 2.304 0.02 A 73 GLN C C 13 174.394 0.2 A 73 GLN CA C 13 57.373 0.2 A 73 GLN CB C 13 25.934 0.2 A 73 GLN CG C 13 34.296 0.2 A 73 GLN N N 15 115.083 0.2 A 73 GLN NE2 N 15 112.987 0.2 A 74 LYS H H 1 7.676 0.02 A 74 LYS HA H 1 4.433 0.02 A 74 LYS HBy H 1 1.852 0.02 A 74 LYS HBx H 1 1.643 0.02 A 74 LYS HD2 H 1 1.594 0.02 A 74 LYS HD3 H 1 1.594 0.02 A 74 LYS HEy H 1 2.912 0.02 A 74 LYS HEx H 1 2.852 0.02 A 74 LYS HG2 H 1 1.386 0.02 A 74 LYS HG3 H 1 1.386 0.02 A 74 LYS C C 13 176.502 0.2 A 74 LYS CA C 13 55.541 0.2 A 74 LYS CB C 13 33.612 0.2 A 74 LYS CD C 13 28.706 0.2 A 74 LYS CE C 13 42.098 0.2 A 74 LYS CG C 13 24.42 0.2 A 74 LYS N N 15 118.343 0.2 A 75 SER H H 1 8.816 0.02 A 75 SER HA H 1 4.212 0.02 A 75 SER HBy H 1 4.205 0.02 A 75 SER HBx H 1 4.082 0.02 A 75 SER C C 13 175.838 0.2 A 75 SER CA C 13 58.209 0.2 A 75 SER CB C 13 64.335 0.2 A 75 SER N N 15 117.054 0.2 A 76 ARG H H 1 9.124 0.02 A 76 ARG HA H 1 4.323 0.02 A 76 ARG HBy H 1 2.27 0.02 A 76 ARG HBx H 1 1.37 0.02 A 76 ARG HDx H 1 3.16 0.02 A 76 ARG HDy H 1 3.39 0.02 A 76 ARG HGx H 1 1.597 0.02 A 76 ARG HGy H 1 1.719 0.02 A 76 ARG C C 13 175.86 0.2 A 76 ARG CA C 13 56.384 0.2 A 76 ARG CB C 13 30.841 0.2 A 76 ARG CD C 13 43.46 0.2 A 76 ARG CG C 13 27.888 0.2 A 76 ARG N N 15 123.664 0.2 A 77 GLY H H 1 9.678 0.02 A 77 GLY HAy H 1 4.147 0.02 A 77 GLY HAx H 1 3.05 0.02 A 77 GLY C C 13 170.843 0.2 A 77 GLY CA C 13 45.345 0.2 A 77 GLY N N 15 108.147 0.2 A 78 TYR H H 1 7.035 0.02 A 78 TYR HA H 1 4.925 0.02 A 78 TYR HBy H 1 2.537 0.02 A 78 TYR HBx H 1 2.178 0.02 A 78 TYR HD1 H 1 6.368 0.02 A 78 TYR HD2 H 1 6.368 0.02 A 78 TYR HE1 H 1 6.676 0.02 A 78 TYR HE2 H 1 6.676 0.02 A 78 TYR C C 13 171.032 0.2 A 78 TYR CA C 13 54.789 0.2 A 78 TYR CB C 13 40.954 0.2 A 78 TYR CD1 C 13 132.877 0.2 A 78 TYR CD2 C 13 132.877 0.2 A 78 TYR CE1 C 13 117.655 0.2 A 78 TYR CE2 C 13 117.655 0.2 A 78 TYR N N 15 111.447 0.2 A 79 GLY H H 1 8.738 0.02 A 79 GLY HAy H 1 3.956 0.02 A 79 GLY HAx H 1 3.809 0.02 A 79 GLY C C 13 169.412 0.2 A 79 GLY CA C 13 45.034 0.2 A 79 GLY N N 15 106.901 0.2 A 80 PHE H H 1 8.421 0.02 A 80 PHE HA H 1 5.551 0.02 A 80 PHE HBy H 1 2.793 0.02 A 80 PHE HBx H 1 2.186 0.02 A 80 PHE HD1 H 1 6.625 0.02 A 80 PHE HD2 H 1 6.625 0.02 A 80 PHE HE1 H 1 7.184 0.02 A 80 PHE HE2 H 1 7.184 0.02 A 80 PHE HZ H 1 7.314 0.02 A 80 PHE C C 13 174.745 0.2 A 80 PHE CA C 13 56.115 0.2 A 80 PHE CB C 13 44.296 0.2 A 80 PHE CD1 C 13 132.475 0.2 A 80 PHE CD2 C 13 132.475 0.2 A 80 PHE CE1 C 13 132.408 0.2 A 80 PHE CE2 C 13 132.408 0.2 A 80 PHE CZ C 13 128.385 0.2 A 80 PHE N N 15 112.755 0.2 A 81 VAL H H 1 8.823 0.02 A 81 VAL HA H 1 4.813 0.02 A 81 VAL HB H 1 1.116 0.02 A 81 VAL HG1% H 1 0.545 0.02 A 81 VAL HG2% H 1 0.28 0.02 A 81 VAL C C 13 174.649 0.2 A 81 VAL CA C 13 60.421 0.2 A 81 VAL CB C 13 35.214 0.2 A 81 VAL CG1 C 13 21.676 0.2 A 81 VAL CG2 C 13 21.129 0.2 A 81 VAL N N 15 121.216 0.2 A 82 THR H H 1 9.586 0.02 A 82 THR HA H 1 5.241 0.02 A 82 THR HB H 1 3.932 0.02 A 82 THR HG2% H 1 1.189 0.02 A 82 THR C C 13 175 0.2 A 82 THR CA C 13 61.807 0.2 A 82 THR CB C 13 69.379 0.2 A 82 THR CG2 C 13 20.929 0.2 A 82 THR N N 15 125.086 0.2 A 83 MET H H 1 8.46 0.02 A 83 MET HA H 1 5.104 0.02 A 83 MET HBx H 1 2.273 0.02 A 83 MET HBy H 1 2.573 0.02 A 83 MET HE% H 1 1.946 0.02 A 83 MET HG2 H 1 2.291 0.02 A 83 MET HG3 H 1 2.291 0.02 A 83 MET C C 13 175.78 0.2 A 83 MET CA C 13 52.848 0.2 A 83 MET CB C 13 32.509 0.2 A 83 MET CE C 13 16.815 0.2 A 83 MET CG C 13 31.69 0.2 A 83 MET N N 15 125.43 0.2 A 84 LYS H H 1 8.354 0.02 A 84 LYS HA H 1 4.107 0.02 A 84 LYS HBy H 1 1.916 0.02 A 84 LYS HBx H 1 1.746 0.02 A 84 LYS HD2 H 1 1.724 0.02 A 84 LYS HD3 H 1 1.724 0.02 A 84 LYS HE2 H 1 2.93 0.02 A 84 LYS HE3 H 1 2.93 0.02 A 84 LYS HG2 H 1 1.381 0.02 A 84 LYS HG3 H 1 1.381 0.02 A 84 LYS C C 13 175.477 0.2 A 84 LYS CA C 13 58.949 0.2 A 84 LYS CB C 13 33.115 0.2 A 84 LYS CD C 13 29.088 0.2 A 84 LYS CE C 13 41.16 0.2 A 84 LYS CG C 13 25.983 0.2 A 84 LYS N N 15 117.657 0.2 A 85 ASP H H 1 7.739 0.02 A 85 ASP HA H 1 4.903 0.02 A 85 ASP HBx H 1 2.755 0.02 A 85 ASP HBy H 1 3.004 0.02 A 85 ASP C C 13 175.055 0.2 A 85 ASP CA C 13 52.188 0.2 A 85 ASP CB C 13 43.948 0.2 A 85 ASP N N 15 112.419 0.2 A 86 ARG H H 1 8.764 0.02 A 86 ARG HA H 1 4.085 0.02 A 86 ARG HBy H 1 1.931 0.02 A 86 ARG HBx H 1 1.867 0.02 A 86 ARG HDy H 1 3.058 0.02 A 86 ARG HDx H 1 2.997 0.02 A 86 ARG HGx H 1 1.655 0.02 A 86 ARG HGy H 1 1.831 0.02 A 86 ARG C C 13 177.882 0.2 A 86 ARG CA C 13 59.168 0.2 A 86 ARG CB C 13 30.375 0.2 A 86 ARG CD C 13 43.81 0.2 A 86 ARG CG C 13 26.673 0.2 A 86 ARG N N 15 121.842 0.2 A 87 ALA H H 1 8.69 0.02 A 87 ALA HA H 1 4.248 0.02 A 87 ALA HB% H 1 1.532 0.02 A 87 ALA C C 13 180.986 0.2 A 87 ALA CA C 13 55.392 0.2 A 87 ALA CB C 13 17.98 0.2 A 87 ALA N N 15 123.692 0.2 A 88 SER H H 1 8.361 0.02 A 88 SER HA H 1 4.337 0.02 A 88 SER HBy H 1 4.161 0.02 A 88 SER HBx H 1 3.914 0.02 A 88 SER C C 13 176.014 0.2 A 88 SER CA C 13 61.947 0.2 A 88 SER CB C 13 63.153 0.2 A 88 SER N N 15 115.41 0.2 A 89 ALA H H 1 7.573 0.02 A 89 ALA HA H 1 4.111 0.02 A 89 ALA HB% H 1 1.6 0.02 A 89 ALA C C 13 178.214 0.2 A 89 ALA CA C 13 55.552 0.2 A 89 ALA CB C 13 18.587 0.2 A 89 ALA N N 15 124.262 0.2 A 90 GLU H H 1 8.56 0.02 A 90 GLU HA H 1 4.048 0.02 A 90 GLU HBx H 1 2.107 0.02 A 90 GLU HBy H 1 2.241 0.02 A 90 GLU HGy H 1 2.566 0.02 A 90 GLU HGx H 1 2.25 0.02 A 90 GLU C C 13 180.601 0.2 A 90 GLU CA C 13 59.771 0.2 A 90 GLU CB C 13 29.174 0.2 A 90 GLU CG C 13 36.826 0.2 A 90 GLU N N 15 119.33 0.2 A 91 ARG H H 1 7.902 0.02 A 91 ARG HA H 1 3.983 0.02 A 91 ARG HBx H 1 2.069 0.02 A 91 ARG HBy H 1 2.352 0.02 A 91 ARG HDy H 1 3.601 0.02 A 91 ARG HDx H 1 3.432 0.02 A 91 ARG HGy H 1 2.104 0.02 A 91 ARG HGx H 1 1.727 0.02 A 91 ARG C C 13 178.433 0.2 A 91 ARG CA C 13 60.195 0.2 A 91 ARG CB C 13 31.09 0.2 A 91 ARG CD C 13 43.985 0.2 A 91 ARG CG C 13 29.172 0.2 A 91 ARG N N 15 118.992 0.2 A 92 ALA H H 1 7.915 0.02 A 92 ALA HA H 1 1.963 0.02 A 92 ALA HB% H 1 1.423 0.02 A 92 ALA C C 13 176.603 0.2 A 92 ALA CA C 13 53.213 0.2 A 92 ALA CB C 13 19.953 0.2 A 92 ALA N N 15 121.29 0.2 A 93 CYS H H 1 7.177 0.02 A 93 CYS HA H 1 4.267 0.02 A 93 CYS HBx H 1 2.82 0.02 A 93 CYS HBy H 1 3.057 0.02 A 93 CYS C C 13 174.36 0.2 A 93 CYS CA C 13 59.723 0.2 A 93 CYS CB C 13 28.533 0.2 A 93 CYS N N 15 111.039 0.2 A 94 LYS H H 1 7.04 0.02 A 94 LYS HA H 1 3.896 0.02 A 94 LYS HBy H 1 1.895 0.02 A 94 LYS HBx H 1 1.829 0.02 A 94 LYS HD2 H 1 1.779 0.02 A 94 LYS HD3 H 1 1.779 0.02 A 94 LYS HE2 H 1 3.013 0.02 A 94 LYS HE3 H 1 3.013 0.02 A 94 LYS HGy H 1 1.596 0.02 A 94 LYS HGx H 1 1.546 0.02 A 94 LYS C C 13 176.492 0.2 A 94 LYS CA C 13 59.405 0.2 A 94 LYS CB C 13 32.109 0.2 A 94 LYS CD C 13 28.777 0.2 A 94 LYS CE C 13 41.902 0.2 A 94 LYS CG C 13 24.574 0.2 A 94 LYS N N 15 121.896 0.2 A 95 ASP H H 1 7.79 0.02 A 95 ASP HA H 1 5.146 0.02 A 95 ASP HBy H 1 2.83 0.02 A 95 ASP HBx H 1 2.496 0.02 A 95 ASP C C 13 174.804 0.2 A 95 ASP CA C 13 49.5 0.2 A 95 ASP CB C 13 40.789 0.2 A 95 ASP N N 15 116.844 0.2 A 96 PRO HA H 1 4.675 0.02 A 96 PRO HBx H 1 2.156 0.02 A 96 PRO HBy H 1 2.515 0.02 A 96 PRO HDy H 1 4.113 0.02 A 96 PRO HDx H 1 4.009 0.02 A 96 PRO HG2 H 1 2.091 0.02 A 96 PRO HG3 H 1 2.091 0.02 A 96 PRO C C 13 176.759 0.2 A 96 PRO CA C 13 63.376 0.2 A 96 PRO CB C 13 33.002 0.2 A 96 PRO CD C 13 50.98 0.2 A 96 PRO CG C 13 26.335 0.2 A 97 ASN H H 1 8.157 0.02 A 97 ASN HA H 1 5.92 0.02 A 97 ASN HBy H 1 2.787 0.02 A 97 ASN HBx H 1 2.451 0.02 A 97 ASN HD2y H 1 8.086 0.02 A 97 ASN HD2x H 1 7.09 0.02 A 97 ASN C C 13 170.803 0.2 A 97 ASN CA C 13 51.166 0.2 A 97 ASN CB C 13 41.752 0.2 A 97 ASN N N 15 116.74 0.2 A 97 ASN ND2 N 15 113.491 0.2 A 98 PRO HA H 1 4.45 0.02 A 98 PRO HBx H 1 1.558 0.02 A 98 PRO HBy H 1 2.084 0.02 A 98 PRO HDx H 1 3.141 0.02 A 98 PRO HDy H 1 3.591 0.02 A 98 PRO HGx H 1 1.588 0.02 A 98 PRO HGy H 1 1.948 0.02 A 98 PRO C C 13 174.311 0.2 A 98 PRO CA C 13 62.982 0.2 A 98 PRO CB C 13 31.73 0.2 A 98 PRO CD C 13 49.188 0.2 A 98 PRO CG C 13 26.555 0.2 A 99 ILE H H 1 8.059 0.02 A 99 ILE HA H 1 4.216 0.02 A 99 ILE HB H 1 1.802 0.02 A 99 ILE HD1% H 1 0.721 0.02 A 99 ILE HG1x H 1 1.13 0.02 A 99 ILE HG1y H 1 1.477 0.02 A 99 ILE HG2% H 1 0.556 0.02 A 99 ILE C C 13 175.508 0.2 A 99 ILE CA C 13 59.76 0.2 A 99 ILE CB C 13 35.792 0.2 A 99 ILE CD1 C 13 11.122 0.2 A 99 ILE CG1 C 13 27.322 0.2 A 99 ILE CG2 C 13 17.214 0.2 A 99 ILE N N 15 119.035 0.2 A 100 ILE H H 1 8.348 0.02 A 100 ILE HA H 1 3.769 0.02 A 100 ILE HB H 1 1.294 0.02 A 100 ILE HD1% H 1 0.226 0.02 A 100 ILE HG1x H 1 -0.469 0.02 A 100 ILE HG1y H 1 0.782 0.02 A 100 ILE HG2% H 1 0.447 0.02 A 100 ILE C C 13 174.214 0.2 A 100 ILE CA C 13 60.777 0.2 A 100 ILE CB C 13 39.525 0.2 A 100 ILE CD1 C 13 13.706 0.2 A 100 ILE CG1 C 13 25.681 0.2 A 100 ILE CG2 C 13 15.747 0.2 A 100 ILE N N 15 128.537 0.2 A 101 ASP H H 1 8.938 0.02 A 101 ASP HA H 1 4.23 0.02 A 101 ASP HBy H 1 3.025 0.02 A 101 ASP HBx H 1 2.206 0.02 A 101 ASP C C 13 175.86 0.2 A 101 ASP CA C 13 54.755 0.2 A 101 ASP CB C 13 40.061 0.2 A 101 ASP N N 15 125.976 0.2 A 102 GLY H H 1 7.978 0.02 A 102 GLY HAy H 1 4.143 0.02 A 102 GLY HAx H 1 3.453 0.02 A 102 GLY C C 13 173.326 0.2 A 102 GLY CA C 13 45.341 0.2 A 102 GLY N N 15 100.097 0.2 A 103 ARG H H 1 7.774 0.02 A 103 ARG HA H 1 4.585 0.02 A 103 ARG HBy H 1 1.603 0.02 A 103 ARG HBx H 1 1.497 0.02 A 103 ARG HD2 H 1 2.78 0.02 A 103 ARG HD3 H 1 2.78 0.02 A 103 ARG HGy H 1 1.741 0.02 A 103 ARG HGx H 1 1.402 0.02 A 103 ARG C C 13 172.983 0.2 A 103 ARG CA C 13 54.551 0.2 A 103 ARG CB C 13 34.693 0.2 A 103 ARG CD C 13 42.512 0.2 A 103 ARG CG C 13 28.601 0.2 A 103 ARG N N 15 123.576 0.2 A 104 LYS H H 1 8.379 0.02 A 104 LYS HA H 1 4.098 0.02 A 104 LYS HBy H 1 1.703 0.02 A 104 LYS HBx H 1 1.534 0.02 A 104 LYS HD2 H 1 1.659 0.02 A 104 LYS HD3 H 1 1.659 0.02 A 104 LYS HE2 H 1 2.947 0.02 A 104 LYS HE3 H 1 2.947 0.02 A 104 LYS HG2 H 1 1.333 0.02 A 104 LYS HG3 H 1 1.333 0.02 A 104 LYS C C 13 173.563 0.2 A 104 LYS CA C 13 57.866 0.2 A 104 LYS CB C 13 31.643 0.2 A 104 LYS CD C 13 29.282 0.2 A 104 LYS CE C 13 41.459 0.2 A 104 LYS CG C 13 24.479 0.2 A 104 LYS N N 15 126.527 0.2 A 105 ALA H H 1 8.836 0.02 A 105 ALA HA H 1 4.664 0.02 A 105 ALA HB% H 1 1.291 0.02 A 105 ALA C C 13 175.007 0.2 A 105 ALA CA C 13 51.023 0.2 A 105 ALA CB C 13 20.981 0.2 A 105 ALA N N 15 134.842 0.2 A 106 ASN H H 1 8.115 0.02 A 106 ASN HA H 1 5.491 0.02 A 106 ASN HBy H 1 2.688 0.02 A 106 ASN HBx H 1 2.617 0.02 A 106 ASN HD2y H 1 7.726 0.02 A 106 ASN HD2x H 1 6.997 0.02 A 106 ASN C C 13 172.917 0.2 A 106 ASN CA C 13 52.84 0.2 A 106 ASN CB C 13 40.901 0.2 A 106 ASN N N 15 115.208 0.2 A 106 ASN ND2 N 15 114.155 0.2 A 107 VAL H H 1 8.872 0.02 A 107 VAL HA H 1 5.229 0.02 A 107 VAL HB H 1 2.016 0.02 A 107 VAL HG1% H 1 1.05 0.02 A 107 VAL HG2% H 1 1.019 0.02 A 107 VAL C C 13 175.778 0.2 A 107 VAL CA C 13 60.513 0.2 A 107 VAL CB C 13 35.329 0.2 A 107 VAL CG1 C 13 22.762 0.2 A 107 VAL CG2 C 13 22.607 0.2 A 107 VAL N N 15 121.606 0.2 A 108 ASN H H 1 8.656 0.02 A 108 ASN HA H 1 4.939 0.02 A 108 ASN HBx H 1 2.813 0.02 A 108 ASN HBy H 1 3.013 0.02 A 108 ASN HD2x H 1 6.762 0.02 A 108 ASN HD2y H 1 7.151 0.02 A 108 ASN C C 13 173.767 0.2 A 108 ASN CA C 13 52.95 0.2 A 108 ASN CB C 13 42.21 0.2 A 108 ASN N N 15 118.778 0.2 A 108 ASN ND2 N 15 112.607 0.2 A 109 LEU H H 1 9.36 0.02 A 109 LEU HA H 1 4.495 0.02 A 109 LEU HBy H 1 1.909 0.02 A 109 LEU HBx H 1 1.819 0.02 A 109 LEU HD1% H 1 1.372 0.02 A 109 LEU HD2% H 1 0.906 0.02 A 109 LEU HG H 1 2.108 0.02 A 109 LEU C C 13 179.511 0.2 A 109 LEU CA C 13 56.906 0.2 A 109 LEU CB C 13 41.791 0.2 A 109 LEU CD1 C 13 26.548 0.2 A 109 LEU CD2 C 13 22.996 0.2 A 109 LEU CG C 13 27.234 0.2 A 109 LEU N N 15 123.897 0.2 A 110 ALA H H 1 9.637 0.02 A 110 ALA HA H 1 4.131 0.02 A 110 ALA HB% H 1 1.673 0.02 A 110 ALA C C 13 180.365 0.2 A 110 ALA CA C 13 55.643 0.2 A 110 ALA CB C 13 18.018 0.2 A 110 ALA N N 15 127.945 0.2 A 111 TYR H H 1 9.09 0.02 A 111 TYR HA H 1 4.429 0.02 A 111 TYR HBy H 1 3.228 0.02 A 111 TYR HBx H 1 2.968 0.02 A 111 TYR HD1 H 1 7.132 0.02 A 111 TYR HD2 H 1 7.132 0.02 A 111 TYR HE1 H 1 6.782 0.02 A 111 TYR HE2 H 1 6.782 0.02 A 111 TYR C C 13 175.692 0.2 A 111 TYR CA C 13 59.765 0.2 A 111 TYR CB C 13 36.913 0.2 A 111 TYR CD1 C 13 133.615 0.2 A 111 TYR CD2 C 13 133.615 0.2 A 111 TYR CE1 C 13 118.316 0.2 A 111 TYR CE2 C 13 118.316 0.2 A 111 TYR N N 15 115.38 0.2 A 112 LEU H H 1 6.678 0.02 A 112 LEU HA H 1 3.615 0.02 A 112 LEU HBx H 1 1.357 0.02 A 112 LEU HBy H 1 1.51 0.02 A 112 LEU HD1% H 1 0.977 0.02 A 112 LEU HD2% H 1 0.648 0.02 A 112 LEU HG H 1 0.707 0.02 A 112 LEU C C 13 177.367 0.2 A 112 LEU CA C 13 56.58 0.2 A 112 LEU CB C 13 42.08 0.2 A 112 LEU CD1 C 13 26.089 0.2 A 112 LEU CD2 C 13 22.777 0.2 A 112 LEU CG C 13 26.724 0.2 A 112 LEU N N 15 120.658 0.2 A 113 GLY H H 1 6.956 0.02 A 113 GLY HAx H 1 3.324 0.02 A 113 GLY HAy H 1 4.313 0.02 A 113 GLY C C 13 172.888 0.2 A 113 GLY CA C 13 44.316 0.2 A 113 GLY N N 15 103.604 0.2 A 114 ALA H H 1 6.841 0.02 A 114 ALA HA H 1 3.884 0.02 A 114 ALA HB% H 1 1.321 0.02 A 114 ALA C C 13 176.756 0.2 A 114 ALA CA C 13 52.168 0.2 A 114 ALA CB C 13 19.36 0.2 A 114 ALA N N 15 123.038 0.2 A 115 LYS H H 1 8.114 0.02 A 115 LYS HA H 1 4.48 0.02 A 115 LYS HBx H 1 1.721 0.02 A 115 LYS HBy H 1 1.808 0.02 A 115 LYS HD2 H 1 1.696 0.02 A 115 LYS HD3 H 1 1.696 0.02 A 115 LYS HE2 H 1 2.993 0.02 A 115 LYS HE3 H 1 2.993 0.02 A 115 LYS HGy H 1 1.505 0.02 A 115 LYS HGx H 1 1.416 0.02 A 115 LYS C C 13 174.011 0.2 A 115 LYS CA C 13 54.186 0.2 A 115 LYS CB C 13 32.085 0.2 A 115 LYS CD C 13 28.38 0.2 A 115 LYS CE C 13 43.88 0.2 A 115 LYS CG C 13 24.548 0.2 A 115 LYS N N 15 123.18 0.2 A 116 PRO HA H 1 4.423 0.02 A 116 PRO HBx H 1 1.928 0.02 A 116 PRO HBy H 1 2.29 0.02 A 116 PRO HDx H 1 3.624 0.02 A 116 PRO HDy H 1 3.811 0.02 A 116 PRO HG2 H 1 2.02 0.02 A 116 PRO HG3 H 1 2.02 0.02 A 116 PRO C C 13 176.489 0.2 A 116 PRO CA C 13 63.105 0.2 A 116 PRO CB C 13 32.072 0.2 A 116 PRO CD C 13 50.648 0.2 A 116 PRO CG C 13 27.329 0.2 A 117 ARG H H 1 8.528 0.2 A 117 ARG HA H 1 4.458 0.02 A 117 ARG HBx H 1 1.787 0.02 A 117 ARG HBy H 1 1.898 0.02 A 117 ARG HD2 H 1 3.203 0.02 A 117 ARG HD3 H 1 3.203 0.02 A 117 ARG HGy H 1 1.707 0.02 A 117 ARG HGx H 1 1.663 0.02 A 117 ARG C C 13 176.532 0.2 A 117 ARG CA C 13 55.789 0.2 A 117 ARG CB C 13 30.877 0.2 A 117 ARG CD C 13 43.217 0.2 A 117 ARG CG C 13 27.314 0.2 A 117 ARG N N 15 122.255 0.2 A 118 THR H H 1 8.423 0.02 A 118 THR HA H 1 4.369 0.02 A 118 THR HB H 1 4.212 0.02 A 118 THR HG2% H 1 1.204 0.02 A 118 THR C C 13 173.789 0.2 A 118 THR CA C 13 61.609 0.2 A 118 THR CB C 13 69.594 0.2 A 118 THR CG2 C 13 21.534 0.2 A 118 THR N N 15 115.952 0.2 A 119 ASN H H 1 8.577 0.02 A 119 ASN HA H 1 4.865 0.02 A 119 ASN HBy H 1 2.849 0.02 A 119 ASN HBx H 1 2.776 0.02 A 119 ASN HD2y H 1 7.603 0.02 A 119 ASN HD2x H 1 6.912 0.02 A 119 ASN C C 13 174.527 0.2 A 119 ASN CA C 13 53.171 0.2 A 119 ASN CB C 13 38.806 0.2 A 119 ASN N N 15 121.572 0.2 A 119 ASN ND2 N 15 113.185 0.2 A 120 VAL H H 1 8.095 0.02 A 120 VAL HA H 1 4.132 0.02 A 120 VAL HB H 1 2.105 0.02 A 120 VAL HG1% H 1 0.935 0.02 A 120 VAL HG2% H 1 0.919 0.02 A 120 VAL C C 13 175.088 0.2 A 120 VAL CA C 13 62.42 0.2 A 120 VAL CB C 13 32.692 0.2 A 120 VAL CG1 C 13 21.19 0.2 A 120 VAL CG2 C 13 20.337 0.2 A 120 VAL N N 15 120.608 0.2 A 121 GLN H H 1 8.021 0.02 A 121 GLN HA H 1 4.171 0.02 A 121 GLN HBx H 1 1.929 0.02 A 121 GLN HBy H 1 2.096 0.02 A 121 GLN HE2y H 1 7.52 0.02 A 121 GLN HE2x H 1 6.831 0.02 A 121 GLN HG2 H 1 2.302 0.02 A 121 GLN HG3 H 1 2.302 0.02 A 121 GLN C C 13 180.607 0.2 A 121 GLN CA C 13 57.403 0.2 A 121 GLN CB C 13 30.462 0.2 A 121 GLN CG C 13 34.296 0.2 A 121 GLN N N 15 129.094 0.2 A 121 GLN NE2 N 15 112.462 0.2 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 108 ASN HBy A 108 ASN HBx 1.0 1.4 2.4 2 2 A 55 PHE HBy A 56 GLU HA 1.0 2.0 6.0 3 3 A 56 GLU HA A 56 GLU HGy 1.0 2.0 5.0 4 4 A 56 GLU HA A 56 GLU HGx 1.0 2.0 5.0 5 5 A 62 GLU HBy A 82 THR HB 1.0 1.9 4.9 6 6 A 82 THR HB A 62 GLU HBx 1.0 1.8 3.6 7 7 A 56 GLU HA A 56 GLU HBx 1.0 1.7 3.3 8 8 A 94 LYS HD2 A 94 LYS HA 1.0 1.8 3.6 9 9 A 49 LYS HBx A 49 LYS HA 1.0 1.7 3.3 10 10 A 115 LYS HBy A 116 PRO HDy 1.0 2.0 6.0 11 11 A 43 PRO HBy A 43 PRO HDy 1.0 2.0 6.0 12 11 A 43 PRO HBy A 43 PRO HDx 1.0 2.0 6.0 13 12 A 99 ILE HG1y A 99 ILE HA 1.0 2.0 5.2 14 13 A 99 ILE HA A 99 ILE HG1x 1.0 1.9 4.1 15 14 A 67 ILE HG1x A 79 GLY HAy 1.0 1.8 3.8 16 15 A 76 ARG HGx A 76 ARG HA 1.0 1.8 3.8 17 16 A 76 ARG HA A 76 ARG HGy 1.0 1.9 3.9 18 17 A 118 THR HG2% A 118 THR HB 1.0 1.8 3.6 19 18 A 72 THR HG2% A 71 ASN HBx 1.0 1.8 3.6 20 19 A 82 THR HG2% A 83 MET HBy 1.0 0.0 6.0 21 19 A 82 THR HG2% A 83 MET HG2 1.0 0.0 6.0 22 20 A 72 THR HG2% A 69 ASP HBx 1.0 2.0 6.0 23 21 A 68 THR HG2% A 73 GLN HG3 1.0 2.0 6.0 24 21 A 68 THR HG2% A 73 GLN HG2 1.0 2.0 6.0 25 22 A 36 LYS HG2 A 36 LYS HEx 1.0 1.9 4.3 26 23 A 73 GLN HG2 A 70 ARG HG2 1.0 2.0 5.4 27 23 A 73 GLN HG2 A 70 ARG HG3 1.0 2.0 5.4 28 23 A 73 GLN HG3 A 70 ARG HG2 1.0 2.0 5.4 29 23 A 73 GLN HG3 A 70 ARG HG3 1.0 2.0 5.4 30 24 A 60 ASP HBy A 84 LYS HD3 1.0 1.8 3.8 31 24 A 84 LYS HD2 A 60 ASP HBy 1.0 1.8 3.8 32 25 A 91 ARG HGx A 91 ARG HBy 1.0 1.8 3.8 33 26 A 76 ARG HGy A 76 ARG HDy 1.0 1.8 3.8 34 27 A 76 ARG HGx A 76 ARG HDy 1.0 1.9 4.3 35 28 A 76 ARG HGy A 68 THR HB 1.0 2.0 6.0 36 29 A 56 GLU HGx A 53 GLU HBx 1.0 0.0 6.0 37 30 A 56 GLU HGy A 56 GLU HBx 1.0 1.8 3.4 38 31 A 56 GLU HGy A 56 GLU HBy 1.0 2.0 4.4 39 32 A 56 GLU HGx A 56 GLU HBy 1.0 1.7 3.5 40 33 A 33 MET HGy A 111 TYR HBx 1.0 2.0 5.4 41 34 A 84 LYS HE2 A 62 GLU HG3 1.0 1.9 5.5 42 34 A 84 LYS HE3 A 62 GLU HG3 1.0 1.9 5.5 43 34 A 62 GLU HG2 A 84 LYS HE3 1.0 1.9 5.5 44 34 A 62 GLU HG2 A 84 LYS HE2 1.0 1.9 5.5 45 35 A 97 ASN HBx A 104 LYS HG2 1.0 1.9 4.5 46 35 A 97 ASN HBx A 104 LYS HG3 1.0 1.9 4.5 47 36 A 61 ILE HB A 64 ALA HB% 1.0 1.9 4.3 48 37 A 61 ILE HB A 84 LYS HBy 1.0 0.0 6.0 49 38 A 91 ARG HBy A 94 LYS HGx 1.0 2.0 5.2 50 38 A 91 ARG HBy A 94 LYS HGy 1.0 2.0 5.2 51 39 A 62 GLU HBx A 84 LYS HG3 1.0 2.0 6.0 52 39 A 62 GLU HBx A 84 LYS HG2 1.0 2.0 6.0 53 40 A 43 PRO HBy A 43 PRO HBx 1.0 1.4 2.4 54 41 A 43 PRO HBy A 43 PRO HGx 1.0 1.9 4.1 55 42 A 103 ARG HGy A 103 ARG HGx 1.0 1.6 2.6 56 43 A 99 ILE HG1y A 99 ILE HD1% 1.0 1.7 3.1 57 44 A 99 ILE HG1y A 99 ILE HG2% 1.0 1.6 3.0 58 45 A 61 ILE HG1y A 61 ILE HG2% 1.0 1.9 4.5 59 46 A 61 ILE HG1y A 61 ILE HG1x 1.0 1.4 2.2 60 47 A 67 ILE HG1x A 67 ILE HD1% 1.0 1.8 3.4 61 48 A 67 ILE HG1y A 67 ILE HB 1.0 1.7 3.1 62 48 A 67 ILE HG1y A 67 ILE HG2% 1.0 1.7 3.1 63 49 A 99 ILE HG1x A 99 ILE HD1% 1.0 1.6 3.0 64 50 A 99 ILE HG1y A 99 ILE HG1x 1.0 1.4 2.2 65 51 A 99 ILE HG1x A 99 ILE HB 1.0 1.8 3.4 66 52 A 61 ILE HG1x A 61 ILE HD1% 1.0 1.8 3.6 67 53 A 61 ILE HG1x A 81 VAL HG1% 1.0 1.9 4.1 68 54 A 61 ILE HG2% A 61 ILE HG1x 1.0 1.7 3.1 69 55 A 99 ILE HG1y A 99 ILE HB 1.0 1.7 3.1 70 56 A 49 LYS HBx A 49 LYS HGy 1.0 1.8 3.4 71 57 A 42 LEU HD2% A 42 LEU HG 1.0 1.7 3.3 72 58 A 66 VAL HG2% A 42 LEU HD1% 1.0 0.0 6.0 73 59 A 109 LEU HD2% A 37 ILE HG1y 1.0 1.9 3.7 74 60 A 50 THR HG2% A 46 THR HG2% 1.0 1.5 2.5 75 61 A 82 THR HG2% A 37 ILE HG2% 1.0 0.0 6.0 76 61 A 82 THR HG2% A 37 ILE HD1% 1.0 0.0 6.0 77 62 A 72 THR HG2% A 74 LYS HG2 1.0 1.8 3.6 78 62 A 72 THR HG2% A 74 LYS HG3 1.0 1.8 3.6 79 63 A 67 ILE HD1% A 65 VAL HG1% 1.0 1.7 3.3 80 64 A 100 ILE HG2% A 51 LEU HG 1.0 1.9 4.1 81 64 A 100 ILE HG2% A 51 LEU HD2% 1.0 1.9 4.1 82 65 A 67 ILE HG1y A 80 PHE HD% 1.0 2.0 5.6 83 66 A 67 ILE HG1x A 80 PHE HD% 1.0 1.9 4.7 84 67 A 96 PRO HDy A 96 PRO HBx 1.0 2.0 6.0 85 68 A 87 ALA HA A 90 GLU HGx 1.0 1.7 3.3 86 68 A 87 ALA HA A 90 GLU HBx 1.0 1.7 3.3 87 69 A 117 ARG HA A 117 ARG HBy 1.0 1.9 4.3 88 70 A 84 LYS HD3 A 60 ASP HA 1.0 2.0 6.0 89 70 A 84 LYS HD2 A 60 ASP HA 1.0 2.0 6.0 90 70 A 60 ASP HA A 84 LYS HBx 1.0 2.0 6.0 91 71 A 56 GLU HGx A 53 GLU HA 1.0 2.0 5.4 92 72 A 91 ARG HA A 94 LYS HBy 1.0 1.8 4.0 93 73 A 30 ARG HGx A 29 SER HBy 1.0 2.0 5.6 94 73 A 29 SER HBx A 30 ARG HGx 1.0 2.0 5.6 95 74 A 56 GLU HA A 61 ILE HG1x 1.0 2.0 5.8 96 75 A 86 ARG HA A 89 ALA HB% 1.0 1.7 2.9 97 76 A 104 LYS HA A 104 LYS HBx 1.0 1.9 3.9 98 77 A 57 GLN HA A 57 GLN HGx 1.0 1.9 4.3 99 78 A 85 ASP HA A 35 THR HG2% 1.0 1.8 3.8 100 79 A 58 PHE HZ A 54 TYR HE% 1.0 1.9 5.1 101 80 A 37 ILE HG1y A 37 ILE HB 1.0 1.8 3.8 102 81 A 42 LEU HD2% A 100 ILE HD1% 1.0 1.8 4.0 103 82 A 108 ASN HBx A 112 LEU HD1% 1.0 1.9 4.5 104 83 A 61 ILE HG1x A 57 GLN HBy 1.0 0.0 6.0 105 83 A 61 ILE HG1x A 57 GLN HBx 1.0 0.0 6.0 106 84 A 31 ASP HA A 32 THR HG2% 1.0 2.0 5.6 107 85 A 27 MET HBx A 27 MET HBy 1.0 1.8 3.6 108 86 A 98 PRO HBx A 98 PRO HGy 1.0 1.9 4.5 109 87 A 86 ARG HGy A 34 PHE HBy 1.0 1.9 5.1 110 88 A 72 THR HG2% A 69 ASP HBy 1.0 2.0 6.0 111 89 A 26 ALA HA A 26 ALA HB% 1.0 2.0 5.2 112 90 A 29 SER HBy A 29 SER HA 1.0 1.8 3.6 113 90 A 29 SER HBx A 29 SER HA 1.0 1.8 3.6 114 91 A 30 ARG HA A 30 ARG HBy 1.0 1.7 3.3 115 92 A 30 ARG HA A 30 ARG HBx 1.0 1.8 3.6 116 93 A 30 ARG HGx A 30 ARG HA 1.0 1.9 4.7 117 94 A 30 ARG HA A 30 ARG HD3 1.0 1.9 4.3 118 94 A 30 ARG HA A 30 ARG HD2 1.0 1.9 4.3 119 95 A 30 ARG HD3 A 30 ARG HGy 1.0 1.7 3.1 120 95 A 30 ARG HD2 A 30 ARG HGy 1.0 1.7 3.1 121 96 A 30 ARG HA A 30 ARG HGy 1.0 1.8 3.6 122 97 A 31 ASP HA A 31 ASP HBx 1.0 1.7 3.3 123 98 A 31 ASP HA A 31 ASP HBy 1.0 1.8 3.4 124 99 A 31 ASP HBx A 31 ASP HBy 1.0 1.4 2.2 125 100 A 32 THR HG2% A 32 THR HA 1.0 1.6 3.0 126 101 A 32 THR HA A 36 LYS HBx 1.0 2.0 6.0 127 102 A 82 THR HG2% A 32 THR HA 1.0 2.0 5.2 128 103 A 36 LYS HBx A 32 THR HB 1.0 1.9 4.7 129 104 A 32 THR HB A 36 LYS HBy 1.0 1.8 3.6 130 105 A 82 THR HG2% A 32 THR HB 1.0 1.9 4.1 131 106 A 32 THR HG2% A 32 THR HA 1.0 1.6 2.8 132 106 A 32 THR HG2% A 32 THR HB 1.0 1.6 2.8 133 107 A 32 THR HG2% A 32 THR HB 1.0 1.6 2.8 134 108 A 33 MET HA A 33 MET HBx 1.0 1.8 3.6 135 109 A 33 MET HA A 33 MET HBy 1.0 1.6 3.0 136 110 A 33 MET HBx A 33 MET HBy 1.0 1.3 2.2 137 111 A 33 MET HBx A 33 MET HE% 1.0 1.7 3.3 138 112 A 33 MET HBy A 33 MET HE% 1.0 2.0 6.0 139 113 A 33 MET HE% A 34 PHE HD% 1.0 2.0 5.0 140 114 A 33 MET HE% A 34 PHE HE% 1.0 2.0 5.2 141 115 A 33 MET HE% A 86 ARG HBx 1.0 0.0 6.0 142 116 A 33 MET HE% A 111 TYR HBy 1.0 2.0 5.8 143 117 A 33 MET HE% A 111 TYR HD% 1.0 1.9 4.5 144 118 A 33 MET HE% A 111 TYR HE% 1.0 1.9 4.3 145 119 A 33 MET HA A 33 MET HGx 1.0 1.9 4.1 146 120 A 33 MET HBx A 33 MET HGx 1.0 1.9 4.5 147 121 A 33 MET HBy A 33 MET HGx 1.0 1.5 2.5 148 122 A 33 MET HE% A 33 MET HGx 1.0 2.0 6.0 149 123 A 111 TYR HD% A 33 MET HGx 1.0 2.0 5.4 150 124 A 111 TYR HE% A 33 MET HGx 1.0 2.0 6.0 151 125 A 33 MET HGy A 33 MET HA 1.0 1.9 3.9 152 126 A 33 MET HGy A 33 MET HBx 1.0 1.7 3.1 153 127 A 33 MET HGy A 33 MET HGx 1.0 1.4 2.4 154 128 A 33 MET HGy A 34 PHE HD% 1.0 2.0 5.2 155 129 A 33 MET HGy A 111 TYR HD% 1.0 1.9 4.7 156 130 A 35 THR HG2% A 34 PHE HA 1.0 2.0 6.0 157 131 A 33 MET HGx A 34 PHE HA 1.0 0.0 6.0 158 132 A 34 PHE HA A 34 PHE HBx 1.0 1.7 3.5 159 133 A 34 PHE HBy A 34 PHE HA 1.0 1.8 3.8 160 134 A 34 PHE HD% A 34 PHE HA 1.0 1.8 3.6 161 135 A 34 PHE HE% A 34 PHE HA 1.0 2.0 6.0 162 136 A 34 PHE HA A 34 PHE HZ 1.0 1.9 6.0 163 137 A 36 LYS HBx A 34 PHE HA 1.0 2.0 5.8 164 138 A 36 LYS HBy A 34 PHE HA 1.0 2.0 6.0 165 139 A 34 PHE HA A 109 LEU HD1% 1.0 1.7 3.5 166 140 A 109 LEU HD2% A 34 PHE HA 1.0 1.9 4.7 167 141 A 111 TYR HBx A 34 PHE HA 1.0 2.0 5.2 168 142 A 111 TYR HD% A 34 PHE HA 1.0 2.0 5.6 169 143 A 111 TYR HE% A 34 PHE HA 1.0 2.0 6.0 170 144 A 34 PHE HD% A 34 PHE HBx 1.0 1.9 4.5 171 145 A 34 PHE HE% A 34 PHE HBx 1.0 2.0 6.0 172 146 A 34 PHE HBx A 86 ARG HDy 1.0 2.0 6.0 173 147 A 34 PHE HBy A 34 PHE HBx 1.0 1.5 2.3 174 148 A 34 PHE HBy A 34 PHE HD% 1.0 1.8 4.0 175 149 A 34 PHE HBy A 34 PHE HE% 1.0 2.0 6.0 176 150 A 34 PHE HBy A 86 ARG HBy 1.0 1.9 4.7 177 151 A 34 PHE HBy A 86 ARG HDy 1.0 2.0 6.0 178 152 A 34 PHE HBy A 86 ARG HGx 1.0 2.0 5.6 179 153 A 34 PHE HBy A 109 LEU HD1% 1.0 2.0 6.0 180 154 A 35 THR HA A 35 THR HB 1.0 1.5 2.7 181 155 A 83 MET HBy A 35 THR HA 1.0 2.0 6.0 182 156 A 35 THR HA A 83 MET HBx 1.0 1.9 4.7 183 157 A 35 THR HA A 83 MET HG3 1.0 2.0 5.2 184 158 A 86 ARG HA A 35 THR HA 1.0 1.9 4.3 185 159 A 86 ARG HBx A 35 THR HA 1.0 2.0 6.0 186 160 A 89 ALA HB% A 35 THR HA 1.0 1.5 2.5 187 161 A 109 LEU HD2% A 35 THR HA 1.0 2.0 5.6 188 162 A 37 ILE HD1% A 35 THR HB 1.0 2.0 6.0 189 163 A 62 GLU HBx A 35 THR HB 1.0 2.0 6.0 190 164 A 82 THR HG2% A 35 THR HB 1.0 1.9 4.1 191 165 A 83 MET HBy A 35 THR HB 1.0 2.0 6.0 192 166 A 35 THR HB A 83 MET HE% 1.0 1.8 6.0 193 167 A 35 THR HB A 83 MET HG3 1.0 2.0 5.8 194 168 A 89 ALA HB% A 35 THR HB 1.0 1.9 4.9 195 169 A 35 THR HG2% A 35 THR HA 1.0 1.6 2.8 196 170 A 90 GLU HBx A 35 THR HG2% 1.0 2.0 6.0 197 170 A 90 GLU HGx A 35 THR HG2% 1.0 2.0 6.0 198 171 A 35 THR HG2% A 34 PHE HBy 1.0 2.0 4.8 199 172 A 35 THR HG2% A 35 THR HB 1.0 1.5 2.5 200 173 A 83 MET HBy A 35 THR HG2% 1.0 2.0 5.6 201 174 A 35 THR HG2% A 83 MET HG3 1.0 2.0 5.6 202 175 A 35 THR HG2% A 85 ASP HBy 1.0 2.0 5.4 203 176 A 86 ARG HA A 35 THR HG2% 1.0 1.7 2.9 204 177 A 35 THR HG2% A 86 ARG HBy 1.0 1.9 4.1 205 178 A 35 THR HG2% A 86 ARG HGy 1.0 2.0 4.8 206 179 A 35 THR HG2% A 86 ARG HGx 1.0 1.9 4.9 207 180 A 89 ALA HB% A 35 THR HG2% 1.0 1.8 3.8 208 181 A 36 LYS HG2 A 36 LYS HA 1.0 1.9 4.9 209 182 A 36 LYS HBx A 36 LYS HA 1.0 1.9 4.5 210 183 A 36 LYS HBy A 36 LYS HA 1.0 1.9 4.1 211 184 A 36 LYS HA A 82 THR HA 1.0 1.6 3.0 212 185 A 82 THR HG2% A 36 LYS HA 1.0 2.0 4.4 213 186 A 36 LYS HBx A 36 LYS HBy 1.0 1.6 2.6 214 187 A 36 LYS HG2 A 36 LYS HBy 1.0 1.9 4.9 215 188 A 36 LYS HBy A 36 LYS HG3 1.0 2.0 4.4 216 189 A 36 LYS HBy A 36 LYS HDx 1.0 1.9 3.9 217 190 A 36 LYS HBy A 36 LYS HDy 1.0 1.9 4.1 218 191 A 36 LYS HBx A 36 LYS HDx 1.0 2.0 4.4 219 192 A 36 LYS HDx A 36 LYS HEy 1.0 1.9 4.3 220 193 A 36 LYS HDy A 36 LYS HEy 1.0 1.8 3.6 221 194 A 36 LYS HEx A 36 LYS HEy 1.0 1.4 2.2 222 195 A 36 LYS HG3 A 36 LYS HEy 1.0 2.0 5.6 223 196 A 36 LYS HEx A 36 LYS HDx 1.0 1.9 4.1 224 197 A 36 LYS HEx A 36 LYS HDy 1.0 1.9 3.9 225 198 A 36 LYS HEx A 36 LYS HG3 1.0 2.0 5.2 226 199 A 37 ILE HB A 37 ILE HA 1.0 1.8 4.2 227 200 A 37 ILE HG1y A 37 ILE HA 1.0 1.9 3.9 228 201 A 37 ILE HA A 37 ILE HG1x 1.0 1.9 4.3 229 202 A 37 ILE HG2% A 37 ILE HA 1.0 1.7 3.3 230 203 A 37 ILE HA A 38 PHE HBy 1.0 1.9 6.0 231 204 A 37 ILE HA A 38 PHE HBx 1.0 2.0 6.0 232 205 A 37 ILE HA A 110 ALA HB% 1.0 1.9 5.3 233 206 A 81 VAL HG1% A 37 ILE HB 1.0 1.9 5.1 234 207 A 37 ILE HD1% A 37 ILE HA 1.0 2.0 5.2 235 208 A 37 ILE HD1% A 37 ILE HB 1.0 1.7 3.1 236 209 A 37 ILE HG1y A 37 ILE HD1% 1.0 1.6 2.8 237 210 A 37 ILE HD1% A 55 PHE HBx 1.0 2.0 5.8 238 211 A 37 ILE HD1% A 55 PHE HD% 1.0 2.0 4.6 239 212 A 37 ILE HD1% A 55 PHE HE% 1.0 1.9 4.5 240 213 A 37 ILE HD1% A 81 VAL HB 1.0 1.9 4.1 241 214 A 37 ILE HD1% A 83 MET HBx 1.0 2.0 4.6 242 215 A 37 ILE HD1% A 83 MET HG3 1.0 1.9 4.3 243 216 A 37 ILE HD1% A 89 ALA HA 1.0 1.7 2.9 244 217 A 37 ILE HD1% A 89 ALA HB% 1.0 1.7 3.3 245 218 A 37 ILE HD1% A 92 ALA HA 1.0 2.0 6.0 246 219 A 37 ILE HD1% A 92 ALA HB% 1.0 1.6 2.8 247 220 A 37 ILE HG1y A 81 VAL HB 1.0 2.0 6.0 248 221 A 37 ILE HG1y A 37 ILE HG1x 1.0 1.5 2.5 249 222 A 37 ILE HG1y A 37 ILE HG2% 1.0 1.8 4.0 250 223 A 37 ILE HG1y A 89 ALA HA 1.0 1.9 5.3 251 224 A 109 LEU HD2% A 37 ILE HG1x 1.0 1.9 4.7 252 225 A 37 ILE HG1x A 81 VAL HB 1.0 2.0 6.0 253 226 A 37 ILE HB A 37 ILE HG1x 1.0 1.9 4.3 254 227 A 37 ILE HG2% A 37 ILE HG1x 1.0 1.6 2.8 255 228 A 37 ILE HG2% A 37 ILE HB 1.0 1.6 2.8 256 229 A 37 ILE HG2% A 55 PHE HZ 1.0 2.0 6.0 257 230 A 37 ILE HG2% A 80 PHE HA 1.0 2.0 6.0 258 231 A 37 ILE HG2% A 83 MET HG3 1.0 0.0 6.0 259 232 A 37 ILE HG2% A 107 VAL HG1% 1.0 1.7 3.1 260 233 A 37 ILE HG2% A 107 VAL HG2% 1.0 1.8 3.6 261 234 A 37 ILE HG2% A 108 ASN HA 1.0 2.0 4.8 262 235 A 108 ASN HBy A 37 ILE HG2% 1.0 2.0 6.0 263 236 A 108 ASN HBx A 37 ILE HG2% 1.0 2.0 5.6 264 237 A 38 PHE HBy A 38 PHE HA 1.0 2.0 4.6 265 238 A 38 PHE HBx A 38 PHE HA 1.0 1.8 3.8 266 239 A 38 PHE HA A 38 PHE HD% 1.0 1.9 4.3 267 240 A 38 PHE HA A 38 PHE HE% 1.0 2.0 6.0 268 241 A 38 PHE HA A 39 VAL HG1% 1.0 1.9 6.0 269 242 A 38 PHE HA A 39 VAL HG2% 1.0 2.0 6.0 270 243 A 38 PHE HA A 80 PHE HBy 1.0 1.8 6.0 271 244 A 80 PHE HD% A 38 PHE HA 1.0 1.9 4.5 272 245 A 38 PHE HA A 110 ALA HA 1.0 2.0 6.0 273 246 A 110 ALA HB% A 38 PHE HA 1.0 1.9 5.3 274 247 A 38 PHE HBy A 38 PHE HD% 1.0 1.9 4.1 275 248 A 38 PHE HBy A 38 PHE HE% 1.0 1.9 6.0 276 249 A 38 PHE HBy A 80 PHE HE% 1.0 1.8 6.0 277 250 A 38 PHE HBy A 80 PHE HZ 1.0 1.7 6.0 278 251 A 38 PHE HBx A 38 PHE HD% 1.0 1.9 4.3 279 252 A 38 PHE HBx A 38 PHE HE% 1.0 2.0 6.0 280 253 A 38 PHE HBx A 80 PHE HE% 1.0 1.9 4.5 281 254 A 38 PHE HD% A 38 PHE HE% 1.0 1.8 3.8 282 255 A 39 VAL HA A 39 VAL HB 1.0 1.9 4.1 283 256 A 39 VAL HA A 107 VAL HA 1.0 1.7 3.3 284 257 A 39 VAL HG1% A 39 VAL HA 1.0 1.7 3.1 285 258 A 39 VAL HG1% A 39 VAL HB 1.0 1.5 2.7 286 259 A 42 LEU HD1% A 39 VAL HG1% 1.0 1.7 3.1 287 260 A 55 PHE HE% A 39 VAL HG1% 1.0 1.9 4.7 288 261 A 55 PHE HZ A 39 VAL HG1% 1.0 1.9 4.3 289 262 A 81 VAL HB A 39 VAL HG1% 1.0 2.0 5.0 290 263 A 39 VAL HG1% A 81 VAL HG2% 1.0 1.8 4.2 291 264 A 39 VAL HG1% A 105 ALA HB% 1.0 1.7 3.5 292 265 A 39 VAL HG1% A 107 VAL HA 1.0 1.9 4.7 293 266 A 107 VAL HG2% A 39 VAL HG1% 1.0 1.7 3.1 294 267 A 39 VAL HG2% A 39 VAL HA 1.0 1.7 3.3 295 268 A 55 PHE HE% A 39 VAL HG2% 1.0 1.8 4.0 296 269 A 55 PHE HZ A 39 VAL HG2% 1.0 1.8 3.8 297 270 A 80 PHE HA A 39 VAL HG2% 1.0 1.9 4.3 298 271 A 39 VAL HG2% A 107 VAL HA 1.0 1.9 4.5 299 272 A 38 PHE HE% A 40 GLY HAx 1.0 2.0 5.6 300 273 A 40 GLY HAx A 40 GLY HAy 1.0 1.7 3.1 301 274 A 40 GLY HAx A 78 TYR HBx 1.0 1.9 6.0 302 275 A 38 PHE HE% A 40 GLY HAy 1.0 2.0 6.0 303 276 A 40 GLY HAy A 78 TYR HBy 1.0 1.9 6.0 304 277 A 41 GLY HAy A 41 GLY HAx 1.0 1.6 2.6 305 278 A 43 PRO HDy A 42 LEU HA 1.0 1.7 3.1 306 278 A 43 PRO HDx A 42 LEU HA 1.0 1.7 3.1 307 279 A 41 GLY HAy A 42 LEU HA 1.0 0.0 6.0 308 280 A 42 LEU HA A 42 LEU HBy 1.0 1.8 3.6 309 281 A 42 LEU HA A 42 LEU HBx 1.0 1.9 4.7 310 282 A 42 LEU HG A 42 LEU HA 1.0 1.9 4.5 311 283 A 43 PRO HBx A 42 LEU HA 1.0 2.0 6.0 312 284 A 42 LEU HA A 43 PRO HGy 1.0 2.0 6.0 313 285 A 43 PRO HGx A 42 LEU HA 1.0 1.9 6.0 314 286 A 42 LEU HA A 46 THR HB 1.0 2.0 6.0 315 287 A 105 ALA HB% A 42 LEU HA 1.0 1.9 4.5 316 288 A 42 LEU HBy A 42 LEU HBx 1.0 1.5 2.5 317 289 A 42 LEU HD2% A 42 LEU HBy 1.0 1.9 4.5 318 290 A 42 LEU HG A 42 LEU HBy 1.0 1.7 3.3 319 291 A 43 PRO HDy A 42 LEU HBy 1.0 2.0 4.4 320 292 A 42 LEU HD2% A 42 LEU HBx 1.0 1.9 4.5 321 293 A 42 LEU HG A 42 LEU HBx 1.0 1.8 3.8 322 294 A 43 PRO HDy A 42 LEU HBx 1.0 1.9 6.0 323 295 A 42 LEU HBx A 77 GLY HAx 1.0 2.0 6.0 324 296 A 42 LEU HBx A 77 GLY HAy 1.0 1.9 4.3 325 297 A 42 LEU HD1% A 39 VAL HB 1.0 1.9 4.7 326 298 A 42 LEU HD1% A 42 LEU HA 1.0 1.9 4.3 327 299 A 42 LEU HD1% A 42 LEU HBy 1.0 1.7 3.3 328 300 A 42 LEU HD1% A 42 LEU HBx 1.0 1.7 3.3 329 301 A 42 LEU HD2% A 42 LEU HD1% 1.0 1.7 3.1 330 302 A 42 LEU HG A 42 LEU HD1% 1.0 1.7 3.1 331 303 A 43 PRO HDx A 42 LEU HD1% 1.0 1.9 5.7 332 304 A 43 PRO HDy A 42 LEU HD1% 1.0 2.0 5.2 333 305 A 42 LEU HD1% A 46 THR HB 1.0 2.0 5.6 334 306 A 42 LEU HD1% A 46 THR HG2% 1.0 1.9 4.1 335 307 A 42 LEU HD1% A 78 TYR HA 1.0 1.8 3.8 336 308 A 42 LEU HD2% A 42 LEU HA 1.0 1.7 3.5 337 309 A 43 PRO HDx A 42 LEU HD2% 1.0 2.0 4.4 338 310 A 43 PRO HDy A 42 LEU HD2% 1.0 2.0 4.8 339 311 A 42 LEU HD2% A 46 THR HA 1.0 2.0 5.0 340 312 A 42 LEU HD2% A 46 THR HB 1.0 2.0 5.6 341 313 A 42 LEU HG A 39 VAL HG2% 1.0 2.0 5.4 342 314 A 43 PRO HDx A 42 LEU HBy 1.0 1.9 4.7 343 314 A 43 PRO HDy A 42 LEU HBy 1.0 1.9 4.7 344 315 A 43 PRO HDx A 42 LEU HBx 1.0 2.0 6.0 345 315 A 43 PRO HDy A 42 LEU HBx 1.0 2.0 6.0 346 316 A 43 PRO HDx A 42 LEU HD1% 1.0 1.9 6.0 347 316 A 43 PRO HDy A 42 LEU HD1% 1.0 1.9 6.0 348 317 A 43 PRO HDx A 42 LEU HD2% 1.0 2.0 5.8 349 317 A 43 PRO HDy A 42 LEU HD2% 1.0 2.0 5.8 350 318 A 43 PRO HDx A 43 PRO HBx 1.0 1.9 4.3 351 318 A 43 PRO HDy A 43 PRO HBx 1.0 1.9 4.3 352 319 A 43 PRO HDy A 43 PRO HGy 1.0 1.8 3.4 353 319 A 43 PRO HDx A 43 PRO HGy 1.0 1.8 3.4 354 320 A 43 PRO HDx A 100 ILE HB 1.0 1.9 5.1 355 320 A 43 PRO HDy A 100 ILE HB 1.0 1.9 5.1 356 321 A 43 PRO HDx A 101 ASP HBy 1.0 1.9 6.0 357 321 A 43 PRO HDy A 101 ASP HBy 1.0 1.9 6.0 358 322 A 43 PRO HDy A 103 ARG HBx 1.0 1.9 5.1 359 322 A 43 PRO HDx A 103 ARG HBx 1.0 1.9 5.1 360 323 A 56 GLU HA A 56 GLU HBy 1.0 1.8 3.4 361 324 A 43 PRO HBy A 43 PRO HGy 1.0 1.5 2.5 362 325 A 43 PRO HBx A 43 PRO HGy 1.0 1.8 4.2 363 326 A 43 PRO HDx A 43 PRO HGy 1.0 1.8 3.6 364 327 A 43 PRO HDy A 43 PRO HGy 1.0 1.9 4.9 365 328 A 43 PRO HGx A 43 PRO HGy 1.0 1.5 2.3 366 329 A 43 PRO HGy A 101 ASP HBy 1.0 2.0 6.0 367 330 A 43 PRO HBx A 43 PRO HGx 1.0 1.5 2.7 368 331 A 43 PRO HDx A 43 PRO HGx 1.0 1.9 4.5 369 332 A 43 PRO HDy A 43 PRO HGx 1.0 1.7 3.5 370 333 A 43 PRO HGx A 101 ASP HBy 1.0 1.9 4.5 371 334 A 44 TYR HA A 44 TYR HBy 1.0 1.9 4.1 372 335 A 44 TYR HA A 44 TYR HBx 1.0 1.9 4.3 373 336 A 44 TYR HA A 44 TYR HE% 1.0 1.9 6.0 374 337 A 77 GLY HAx A 44 TYR HA 1.0 2.0 6.0 375 338 A 44 TYR HBy A 44 TYR HBx 1.0 1.6 2.8 376 339 A 44 TYR HBy A 44 TYR HE% 1.0 1.9 6.0 377 340 A 44 TYR HA A 44 TYR HD% 1.0 1.8 3.6 378 341 A 44 TYR HBy A 44 TYR HD% 1.0 2.0 4.6 379 342 A 44 TYR HBx A 44 TYR HD% 1.0 1.9 3.9 380 343 A 44 TYR HE% A 44 TYR HD% 1.0 1.7 3.3 381 344 A 44 TYR HE% B 2 G H8 1.0 2.0 6.0 382 345 A 45 HIS HA A 45 HIS HBx 1.0 1.8 3.6 383 346 A 45 HIS HA A 45 HIS HBy 1.0 1.8 3.6 384 347 A 45 HIS HBx A 45 HIS HBy 1.0 1.5 2.5 385 348 A 45 HIS HBy A 45 HIS HD2 1.0 2.0 5.6 386 349 A 45 HIS HBx A 45 HIS HD2 1.0 2.0 5.0 387 350 A 46 THR HA A 45 HIS HD2 1.0 1.9 4.9 388 351 A 42 LEU HBy A 46 THR HA 1.0 1.9 4.9 389 352 A 42 LEU HG A 46 THR HA 1.0 1.9 6.0 390 353 A 46 THR HB A 46 THR HA 1.0 1.8 3.6 391 354 A 46 THR HA A 50 THR HB 1.0 2.0 5.0 392 355 A 42 LEU HBy A 46 THR HB 1.0 1.5 2.5 393 356 A 42 LEU HBx A 46 THR HB 1.0 2.0 6.0 394 357 A 42 LEU HG A 46 THR HB 1.0 2.0 6.0 395 358 A 43 PRO HGy A 46 THR HB 1.0 1.9 6.0 396 359 A 66 VAL HG2% A 46 THR HB 1.0 1.9 4.9 397 360 A 43 PRO HDx A 46 THR HG2% 1.0 1.9 6.0 398 361 A 43 PRO HGx A 46 THR HG2% 1.0 2.0 5.8 399 362 A 46 THR HG2% A 46 THR HA 1.0 1.6 2.8 400 363 A 46 THR HG2% A 46 THR HB 1.0 1.5 2.5 401 364 A 46 THR HG2% A 50 THR HB 1.0 1.6 2.8 402 365 A 46 THR HG2% A 101 ASP HBx 1.0 2.0 5.2 403 366 A 46 THR HG2% A 101 ASP HBy 1.0 2.0 5.0 404 367 A 47 SER HA A 47 SER HBx 1.0 1.6 2.8 405 368 A 47 SER HA A 47 SER HBy 1.0 1.6 2.8 406 369 A 47 SER HA A 66 VAL HB 1.0 2.0 6.0 407 370 A 47 SER HA A 66 VAL HG1% 1.0 2.0 5.8 408 371 A 66 VAL HG2% A 47 SER HA 1.0 1.9 4.1 409 372 A 47 SER HBx A 47 SER HBy 1.0 1.3 2.2 410 373 A 48 ASP HA A 48 ASP HBy 1.0 1.7 3.1 411 374 A 48 ASP HA A 48 ASP HBx 1.0 1.8 4.0 412 375 A 48 ASP HBy A 48 ASP HBx 1.0 1.4 2.2 413 376 A 49 LYS HA A 49 LYS HBy 1.0 1.7 3.1 414 377 A 49 LYS HA A 52 HIS HA 1.0 2.0 6.0 415 378 A 49 LYS HA A 49 LYS HGy 1.0 1.9 4.3 416 379 A 49 LYS HA A 49 LYS HGx 1.0 1.9 4.1 417 380 A 49 LYS HGy A 50 THR HA 1.0 2.0 5.0 418 381 A 46 THR HG2% A 50 THR HA 1.0 1.9 6.0 419 382 A 50 THR HB A 50 THR HA 1.0 1.6 3.0 420 383 A 53 GLU HBx A 50 THR HA 1.0 2.0 5.2 421 384 A 50 THR HA A 53 GLU HBy 1.0 1.6 3.0 422 385 A 50 THR HA A 53 GLU HGx 1.0 1.9 5.1 423 386 A 50 THR HA A 53 GLU HGy 1.0 2.0 5.2 424 387 A 42 LEU HBy A 50 THR HB 1.0 0.0 6.0 425 388 A 42 LEU HG A 50 THR HB 1.0 0.0 6.0 426 389 A 66 VAL HG2% A 50 THR HB 1.0 2.0 6.0 427 390 A 100 ILE HG2% A 50 THR HB 1.0 2.0 6.0 428 391 A 50 THR HG2% A 53 GLU HGy 1.0 0.0 6.0 429 392 A 50 THR HG2% A 46 THR HA 1.0 1.9 4.7 430 393 A 50 THR HG2% A 50 THR HA 1.0 1.6 2.8 431 394 A 50 THR HG2% A 50 THR HB 1.0 1.4 2.4 432 395 A 50 THR HG2% A 100 ILE HG2% 1.0 1.7 3.3 433 396 A 50 THR HG2% A 101 ASP HBy 1.0 1.9 4.1 434 397 A 51 LEU HA A 54 TYR HBx 1.0 1.9 4.9 435 398 A 55 PHE HBy A 51 LEU HA 1.0 0.0 6.0 436 399 A 100 ILE HG2% A 51 LEU HA 1.0 2.0 5.0 437 400 A 51 LEU HBy A 51 LEU HBx 1.0 1.5 2.3 438 401 A 81 VAL HG2% A 51 LEU HBy 1.0 1.9 4.5 439 402 A 81 VAL HG2% A 51 LEU HBx 1.0 2.0 6.0 440 403 A 39 VAL HB A 51 LEU HD1% 1.0 1.7 3.1 441 404 A 42 LEU HD2% A 51 LEU HD1% 1.0 1.7 2.9 442 405 A 42 LEU HG A 51 LEU HD1% 1.0 1.9 4.7 443 406 A 48 ASP HA A 51 LEU HD1% 1.0 1.9 4.5 444 407 A 51 LEU HA A 51 LEU HD1% 1.0 2.0 5.4 445 408 A 51 LEU HBy A 51 LEU HD1% 1.0 1.7 3.3 446 409 A 51 LEU HBx A 51 LEU HD1% 1.0 1.7 3.1 447 410 A 51 LEU HD1% A 66 VAL HA 1.0 2.0 4.6 448 411 A 66 VAL HB A 51 LEU HD1% 1.0 2.0 6.0 449 412 A 81 VAL HB A 51 LEU HD1% 1.0 2.0 5.4 450 413 A 81 VAL HG2% A 51 LEU HD1% 1.0 1.7 3.3 451 414 A 51 LEU HD2% A 39 VAL HB 1.0 1.7 3.3 452 415 A 51 LEU HD2% A 39 VAL HG1% 1.0 1.7 2.9 453 416 A 42 LEU HD1% A 51 LEU HD2% 1.0 1.7 3.1 454 417 A 42 LEU HG A 51 LEU HD2% 1.0 2.0 4.6 455 418 A 51 LEU HD2% A 51 LEU HA 1.0 1.6 2.8 456 419 A 51 LEU HD2% A 51 LEU HBy 1.0 1.7 3.3 457 420 A 51 LEU HD2% A 51 LEU HBx 1.0 1.9 4.1 458 421 A 51 LEU HD2% A 51 LEU HD1% 1.0 1.5 2.7 459 422 A 51 LEU HD2% A 55 PHE HD% 1.0 1.8 4.0 460 423 A 51 LEU HD2% A 55 PHE HE% 1.0 1.7 3.3 461 424 A 51 LEU HD2% A 55 PHE HZ 1.0 2.0 5.4 462 425 A 51 LEU HD2% A 81 VAL HG2% 1.0 1.7 3.5 463 426 A 51 LEU HD2% A 100 ILE HD1% 1.0 1.9 4.1 464 427 A 52 HIS HA A 52 HIS HB3 1.0 1.6 2.8 465 427 A 52 HIS HA A 52 HIS HB2 1.0 1.6 2.8 466 428 A 61 ILE HD1% A 52 HIS HA 1.0 1.8 3.6 467 429 A 61 ILE HG2% A 52 HIS HA 1.0 2.0 5.4 468 430 A 81 VAL HG2% A 52 HIS HA 1.0 2.0 4.4 469 431 A 49 LYS HA A 52 HIS HB2 1.0 1.8 3.4 470 431 A 49 LYS HA A 52 HIS HB3 1.0 1.8 3.4 471 432 A 64 ALA HB% A 52 HIS HB3 1.0 1.7 3.5 472 432 A 64 ALA HB% A 52 HIS HB2 1.0 1.7 3.5 473 433 A 81 VAL HG2% A 52 HIS HB3 1.0 2.0 6.0 474 433 A 81 VAL HG2% A 52 HIS HB2 1.0 2.0 6.0 475 434 A 52 HIS HA A 52 HIS HD2 1.0 2.0 5.0 476 435 A 52 HIS HB3 A 52 HIS HD2 1.0 1.9 4.1 477 435 A 52 HIS HB2 A 52 HIS HD2 1.0 1.9 4.1 478 436 A 61 ILE HG2% A 52 HIS HD2 1.0 1.9 4.5 479 437 A 64 ALA HB% A 52 HIS HD2 1.0 1.9 4.1 480 438 A 53 GLU HBx A 53 GLU HA 1.0 1.6 3.0 481 439 A 53 GLU HA A 53 GLU HBy 1.0 1.9 3.9 482 440 A 53 GLU HBx A 53 GLU HGy 1.0 1.9 4.1 483 441 A 53 GLU HBx A 53 GLU HBy 1.0 1.3 2.2 484 442 A 53 GLU HBy A 53 GLU HGx 1.0 1.6 3.0 485 443 A 53 GLU HBy A 53 GLU HGy 1.0 1.8 3.6 486 444 A 49 LYS HA A 53 GLU HGx 1.0 0.0 6.0 487 445 A 53 GLU HGx A 52 HIS HB2 1.0 1.9 6.0 488 445 A 53 GLU HGx A 52 HIS HB3 1.0 1.9 6.0 489 446 A 53 GLU HA A 53 GLU HGx 1.0 1.9 4.1 490 447 A 53 GLU HBx A 53 GLU HGx 1.0 1.7 3.1 491 448 A 53 GLU HGx A 53 GLU HGy 1.0 1.3 2.2 492 449 A 49 LYS HA A 53 GLU HGy 1.0 1.9 4.3 493 450 A 53 GLU HGy A 52 HIS HB2 1.0 2.0 5.0 494 450 A 53 GLU HGy A 52 HIS HB3 1.0 2.0 5.0 495 451 A 53 GLU HA A 53 GLU HGy 1.0 1.8 3.4 496 452 A 54 TYR HBx A 54 TYR HA 1.0 1.9 4.3 497 453 A 54 TYR HA A 54 TYR HD% 1.0 1.9 4.3 498 454 A 54 TYR HE% A 54 TYR HA 1.0 2.0 6.0 499 455 A 54 TYR HE% A 54 TYR HD% 1.0 1.8 3.4 500 456 A 54 TYR HE% A 55 PHE HE% 1.0 2.0 5.6 501 457 A 54 TYR HE% A 54 TYR HBx 1.0 2.0 6.0 502 458 A 54 TYR HE% A 58 PHE HE% 1.0 1.9 4.7 503 459 A 54 TYR HE% A 98 PRO HBx 1.0 1.9 4.7 504 460 A 54 TYR HE% A 100 ILE HB 1.0 1.9 6.0 505 461 A 54 TYR HE% A 100 ILE HD1% 1.0 2.0 6.0 506 462 A 54 TYR HD% A 55 PHE HA 1.0 2.0 5.2 507 463 A 55 PHE HBx A 55 PHE HA 1.0 1.8 3.6 508 464 A 56 GLU HBx A 55 PHE HA 1.0 0.0 6.0 509 465 A 55 PHE HA A 58 PHE HD% 1.0 1.7 3.5 510 466 A 58 PHE HE% A 55 PHE HA 1.0 1.9 4.7 511 467 A 92 ALA HB% A 55 PHE HA 1.0 2.0 5.6 512 468 A 55 PHE HBx A 55 PHE HD% 1.0 1.8 3.4 513 469 A 55 PHE HBx A 81 VAL HG2% 1.0 2.0 5.4 514 470 A 83 MET HE% A 55 PHE HBx 1.0 1.8 3.6 515 471 A 55 PHE HBx A 92 ALA HB% 1.0 2.0 4.6 516 472 A 55 PHE HBy A 55 PHE HA 1.0 1.8 4.0 517 473 A 55 PHE HBy A 55 PHE HBx 1.0 1.5 2.5 518 474 A 55 PHE HBy A 55 PHE HD% 1.0 1.9 4.1 519 475 A 55 PHE HBy A 81 VAL HG2% 1.0 1.9 4.5 520 476 A 55 PHE HBy A 83 MET HE% 1.0 2.0 6.0 521 477 A 55 PHE HBy A 92 ALA HB% 1.0 2.0 6.0 522 478 A 55 PHE HD% A 54 TYR HD% 1.0 2.0 5.8 523 479 A 55 PHE HD% A 55 PHE HA 1.0 1.9 4.3 524 480 A 55 PHE HD% A 58 PHE HD% 1.0 1.9 4.7 525 481 A 55 PHE HD% A 92 ALA HA 1.0 2.0 6.0 526 482 A 37 ILE HG1x A 55 PHE HE% 1.0 1.9 4.7 527 483 A 37 ILE HG2% A 55 PHE HE% 1.0 1.8 3.8 528 484 A 55 PHE HBx A 55 PHE HE% 1.0 2.0 5.8 529 485 A 55 PHE HBy A 55 PHE HE% 1.0 2.0 6.0 530 486 A 55 PHE HD% A 55 PHE HE% 1.0 1.7 3.3 531 487 A 55 PHE HE% A 92 ALA HB% 1.0 1.8 3.6 532 488 A 55 PHE HE% A 107 VAL HG1% 1.0 2.0 5.2 533 489 A 55 PHE HD% A 55 PHE HZ 1.0 2.0 6.0 534 490 A 55 PHE HZ A 58 PHE HE% 1.0 0.0 6.0 535 491 A 56 GLU HA A 61 ILE HD1% 1.0 1.8 3.8 536 492 A 56 GLU HGx A 56 GLU HBx 1.0 1.9 4.5 537 493 A 56 GLU HGy A 56 GLU HGx 1.0 1.5 2.3 538 494 A 56 GLU HGx A 61 ILE HD1% 1.0 2.0 6.0 539 495 A 57 GLN HA A 57 GLN HBx 1.0 1.7 3.1 540 495 A 57 GLN HA A 57 GLN HBy 1.0 1.7 3.1 541 496 A 57 GLN HGx A 57 GLN HBx 1.0 1.9 3.9 542 496 A 57 GLN HGx A 57 GLN HBy 1.0 1.9 3.9 543 497 A 57 GLN HA A 57 GLN HGy 1.0 2.0 4.6 544 498 A 57 GLN HGx A 57 GLN HGy 1.0 1.5 2.5 545 499 A 58 PHE HD% A 58 PHE HA 1.0 1.8 3.8 546 500 A 58 PHE HD% A 58 PHE HBx 1.0 1.9 4.1 547 501 A 58 PHE HA A 58 PHE HBy 1.0 2.0 5.4 548 502 A 58 PHE HBx A 58 PHE HBy 1.0 1.5 2.5 549 503 A 91 ARG HBy A 58 PHE HBy 1.0 2.0 6.0 550 504 A 58 PHE HBy A 91 ARG HBx 1.0 2.0 6.0 551 505 A 58 PHE HD% A 58 PHE HBy 1.0 1.9 4.1 552 506 A 58 PHE HE% A 58 PHE HD% 1.0 1.9 4.1 553 507 A 55 PHE HE% A 58 PHE HE% 1.0 2.0 4.8 554 508 A 58 PHE HZ A 58 PHE HE% 1.0 2.0 4.6 555 509 A 59 GLY HAy A 88 SER HBy 1.0 2.0 5.8 556 510 A 59 GLY HAy A 59 GLY HAx 1.0 1.4 2.4 557 511 A 83 MET HE% A 59 GLY HAy 1.0 1.9 5.3 558 512 A 88 SER HBy A 59 GLY HAx 1.0 1.9 6.0 559 513 A 83 MET HE% A 59 GLY HAx 1.0 2.0 6.0 560 514 A 60 ASP HA A 60 ASP HBx 1.0 1.7 3.1 561 515 A 60 ASP HBy A 60 ASP HA 1.0 1.7 3.5 562 516 A 61 ILE HG1y A 60 ASP HA 1.0 2.0 5.8 563 517 A 60 ASP HBy A 84 LYS HA 1.0 2.0 6.0 564 517 A 60 ASP HBx A 84 LYS HA 1.0 2.0 6.0 565 518 A 84 LYS HBy A 60 ASP HBx 1.0 1.9 3.9 566 518 A 60 ASP HBy A 84 LYS HBy 1.0 1.9 3.9 567 519 A 84 LYS HD3 A 60 ASP HBx 1.0 1.7 3.1 568 519 A 60 ASP HBy A 84 LYS HD3 1.0 1.7 3.1 569 519 A 84 LYS HD2 A 60 ASP HBx 1.0 1.7 3.1 570 519 A 84 LYS HD2 A 60 ASP HBy 1.0 1.7 3.1 571 520 A 60 ASP HBy A 84 LYS HG2 1.0 2.0 6.0 572 520 A 84 LYS HG2 A 60 ASP HBx 1.0 2.0 6.0 573 520 A 60 ASP HBy A 84 LYS HG3 1.0 2.0 6.0 574 520 A 84 LYS HG3 A 60 ASP HBx 1.0 2.0 6.0 575 521 A 61 ILE HB A 61 ILE HA 1.0 1.8 3.6 576 522 A 61 ILE HD1% A 61 ILE HA 1.0 2.0 6.0 577 523 A 61 ILE HG1y A 61 ILE HA 1.0 1.8 3.6 578 524 A 61 ILE HG1x A 61 ILE HA 1.0 1.7 3.3 579 525 A 61 ILE HG2% A 61 ILE HA 1.0 1.6 3.0 580 526 A 81 VAL HG1% A 61 ILE HA 1.0 2.0 6.0 581 527 A 61 ILE HA A 83 MET HA 1.0 1.5 2.5 582 528 A 83 MET HE% A 61 ILE HA 1.0 1.9 4.5 583 529 A 61 ILE HB A 52 HIS HE1 1.0 0.0 6.0 584 530 A 61 ILE HB A 61 ILE HD1% 1.0 1.8 3.6 585 531 A 61 ILE HB A 61 ILE HG2% 1.0 1.6 2.6 586 532 A 61 ILE HB A 81 VAL HG2% 1.0 0.0 6.0 587 533 A 61 ILE HD1% A 81 VAL HG1% 1.0 1.9 4.3 588 534 A 61 ILE HD1% A 51 LEU HA 1.0 0.0 6.0 589 535 A 61 ILE HD1% A 51 LEU HD2% 1.0 0.0 6.0 590 536 A 61 ILE HD1% A 52 HIS HB3 1.0 2.0 5.6 591 536 A 61 ILE HD1% A 52 HIS HB2 1.0 2.0 5.6 592 537 A 61 ILE HD1% A 55 PHE HBx 1.0 1.8 3.6 593 538 A 55 PHE HBy A 61 ILE HD1% 1.0 1.6 3.0 594 539 A 56 GLU HBx A 61 ILE HD1% 1.0 1.8 3.8 595 540 A 56 GLU HGy A 61 ILE HD1% 1.0 2.0 4.8 596 541 A 61 ILE HG1y A 61 ILE HD1% 1.0 1.5 2.7 597 542 A 61 ILE HG2% A 61 ILE HD1% 1.0 1.5 2.5 598 543 A 64 ALA HB% A 61 ILE HD1% 1.0 1.8 4.0 599 544 A 82 THR HG2% A 61 ILE HG2% 1.0 2.0 5.2 600 545 A 61 ILE HG1y A 61 ILE HG2% 1.0 1.6 2.6 601 545 A 61 ILE HB A 61 ILE HG2% 1.0 1.6 2.6 602 546 A 61 ILE HG2% A 51 LEU HD2% 1.0 0.0 6.0 603 547 A 62 GLU HG2 A 61 ILE HG2% 1.0 2.0 6.0 604 547 A 62 GLU HG3 A 61 ILE HG2% 1.0 2.0 6.0 605 548 A 64 ALA HB% A 61 ILE HG2% 1.0 1.7 2.9 606 549 A 61 ILE HG2% A 81 VAL HG2% 1.0 1.8 3.6 607 550 A 61 ILE HG2% A 83 MET HA 1.0 1.9 4.5 608 551 A 82 THR HG2% A 62 GLU HA 1.0 2.0 6.0 609 552 A 62 GLU HBx A 62 GLU HA 1.0 1.8 3.4 610 553 A 62 GLU HBy A 62 GLU HA 1.0 1.7 3.1 611 554 A 84 LYS HE2 A 62 GLU HA 1.0 1.9 4.7 612 554 A 84 LYS HE3 A 62 GLU HA 1.0 1.9 4.7 613 555 A 62 GLU HBx A 82 THR HG2% 1.0 1.8 3.8 614 556 A 62 GLU HBy A 82 THR HG2% 1.0 2.0 4.6 615 557 A 62 GLU HG2 A 63 GLU HGx 1.0 2.0 6.0 616 557 A 62 GLU HG3 A 63 GLU HGx 1.0 2.0 6.0 617 558 A 62 GLU HG3 A 30 ARG HD2 1.0 1.9 4.5 618 558 A 62 GLU HG2 A 30 ARG HD2 1.0 1.9 4.5 619 558 A 62 GLU HG3 A 30 ARG HD3 1.0 1.9 4.5 620 558 A 62 GLU HG2 A 30 ARG HD3 1.0 1.9 4.5 621 559 A 62 GLU HG3 A 62 GLU HA 1.0 1.7 3.3 622 559 A 62 GLU HG2 A 62 GLU HA 1.0 1.7 3.3 623 560 A 62 GLU HBx A 62 GLU HG3 1.0 1.6 2.8 624 560 A 62 GLU HBx A 62 GLU HG2 1.0 1.6 2.8 625 561 A 62 GLU HBy A 62 GLU HG2 1.0 1.6 2.8 626 561 A 62 GLU HBy A 62 GLU HG3 1.0 1.6 2.8 627 562 A 62 GLU HG2 A 63 GLU HA 1.0 2.0 5.0 628 562 A 62 GLU HG3 A 63 GLU HA 1.0 2.0 5.0 629 563 A 82 THR HB A 62 GLU HG2 1.0 1.9 4.9 630 563 A 82 THR HB A 62 GLU HG3 1.0 1.9 4.9 631 564 A 82 THR HG2% A 62 GLU HG2 1.0 1.9 4.5 632 564 A 82 THR HG2% A 62 GLU HG3 1.0 1.9 4.5 633 565 A 62 GLU HG3 A 84 LYS HA 1.0 1.8 4.0 634 565 A 62 GLU HG2 A 84 LYS HA 1.0 1.8 4.0 635 566 A 62 GLU HG3 A 84 LYS HG3 1.0 2.0 5.6 636 566 A 62 GLU HG2 A 84 LYS HG3 1.0 2.0 5.6 637 566 A 62 GLU HG3 A 84 LYS HG2 1.0 2.0 5.6 638 566 A 62 GLU HG2 A 84 LYS HG2 1.0 2.0 5.6 639 567 A 63 GLU HA A 63 GLU HBx 1.0 1.8 3.8 640 568 A 63 GLU HA A 63 GLU HBy 1.0 1.7 3.1 641 569 A 63 GLU HGx A 63 GLU HA 1.0 1.9 4.3 642 570 A 63 GLU HBx A 63 GLU HBy 1.0 1.6 2.6 643 571 A 63 GLU HGx A 63 GLU HBx 1.0 1.7 3.3 644 572 A 63 GLU HGx A 63 GLU HBy 1.0 1.8 3.6 645 573 A 63 GLU HBy A 63 GLU HGy 1.0 1.8 3.8 646 574 A 63 GLU HGx A 63 GLU HGy 1.0 1.4 2.4 647 575 A 63 GLU HGy A 64 ALA HA 1.0 2.0 5.2 648 576 A 63 GLU HGx A 64 ALA HA 1.0 2.0 6.0 649 577 A 51 LEU HBy A 64 ALA HA 1.0 2.0 6.0 650 578 A 51 LEU HD1% A 64 ALA HA 1.0 1.9 4.5 651 579 A 61 ILE HG2% A 64 ALA HA 1.0 1.9 4.7 652 580 A 64 ALA HB% A 64 ALA HA 1.0 1.6 3.0 653 581 A 65 VAL HG1% A 64 ALA HA 1.0 2.0 4.8 654 582 A 64 ALA HB% A 42 LEU HD2% 1.0 0.0 6.0 655 583 A 64 ALA HB% A 51 LEU HD1% 1.0 1.7 3.3 656 584 A 64 ALA HB% A 52 HIS HA 1.0 1.7 3.1 657 585 A 48 ASP HBy A 65 VAL HA 1.0 1.9 4.3 658 586 A 48 ASP HBx A 65 VAL HA 1.0 2.0 6.0 659 587 A 65 VAL HA A 65 VAL HB 1.0 1.6 3.0 660 588 A 65 VAL HG1% A 65 VAL HA 1.0 1.7 3.1 661 588 A 65 VAL HA A 65 VAL HG2% 1.0 1.7 3.1 662 589 A 66 VAL HB A 65 VAL HA 1.0 2.0 6.0 663 590 A 66 VAL HG2% A 65 VAL HA 1.0 2.0 5.6 664 591 A 65 VAL HB A 65 VAL HG2% 1.0 1.5 2.5 665 591 A 65 VAL HG1% A 65 VAL HB 1.0 1.5 2.5 666 592 A 67 ILE HD1% A 65 VAL HB 1.0 2.0 5.4 667 593 A 65 VAL HG1% B 6 G H1' 1.0 2.0 5.6 668 593 A 65 VAL HG2% B 6 G H1' 1.0 2.0 5.6 669 594 A 48 ASP HBy A 65 VAL HG2% 1.0 2.0 5.2 670 594 A 65 VAL HG1% A 48 ASP HBy 1.0 2.0 5.2 671 595 A 48 ASP HBx A 65 VAL HG2% 1.0 0.0 6.0 672 595 A 65 VAL HG1% A 48 ASP HBx 1.0 0.0 6.0 673 596 A 63 GLU HGy A 65 VAL HG2% 1.0 1.7 3.3 674 596 A 65 VAL HG1% A 63 GLU HGy 1.0 1.7 3.3 675 597 A 63 GLU HGx A 65 VAL HG2% 1.0 1.8 3.8 676 597 A 65 VAL HG1% A 63 GLU HGx 1.0 1.8 3.8 677 598 A 64 ALA HA A 65 VAL HG2% 1.0 2.0 4.6 678 598 A 65 VAL HG1% A 64 ALA HA 1.0 2.0 4.6 679 599 A 80 PHE HA A 65 VAL HG2% 1.0 2.0 5.6 680 599 A 65 VAL HG1% A 80 PHE HA 1.0 2.0 5.6 681 600 A 65 VAL HG1% A 80 PHE HD% 1.0 1.9 4.3 682 600 A 80 PHE HD% A 65 VAL HG2% 1.0 1.9 4.3 683 601 A 79 GLY HAy A 66 VAL HA 1.0 1.7 3.3 684 602 A 65 VAL HG1% A 66 VAL HA 1.0 1.9 4.5 685 602 A 66 VAL HA A 65 VAL HG2% 1.0 1.9 4.5 686 603 A 67 ILE HD1% A 66 VAL HA 1.0 2.0 6.0 687 604 A 65 VAL HG1% A 66 VAL HB 1.0 2.0 6.0 688 604 A 66 VAL HB A 65 VAL HG2% 1.0 2.0 6.0 689 605 A 66 VAL HB A 66 VAL HA 1.0 1.7 3.5 690 606 A 66 VAL HG1% A 79 GLY HAx 1.0 2.0 5.0 691 607 A 46 THR HB A 66 VAL HG1% 1.0 1.9 4.9 692 608 A 66 VAL HG1% A 66 VAL HA 1.0 1.7 3.1 693 609 A 66 VAL HB A 66 VAL HG1% 1.0 1.5 2.7 694 610 A 66 VAL HG2% A 66 VAL HG1% 1.0 1.5 2.7 695 611 A 66 VAL HG1% A 67 ILE HA 1.0 1.9 4.5 696 612 A 66 VAL HG1% A 75 SER HBx 1.0 1.9 4.1 697 613 A 66 VAL HG2% A 48 ASP HBy 1.0 2.0 5.2 698 614 A 66 VAL HG2% A 48 ASP HBx 1.0 1.9 4.5 699 615 A 66 VAL HG2% A 49 LYS HGx 1.0 0.0 6.0 700 616 A 66 VAL HG2% A 51 LEU HBy 1.0 2.0 4.6 701 617 A 64 ALA HB% A 66 VAL HG2% 1.0 0.0 6.0 702 618 A 66 VAL HG2% A 66 VAL HA 1.0 1.7 2.9 703 619 A 66 VAL HG2% A 66 VAL HB 1.0 1.5 2.7 704 620 A 67 ILE HB A 67 ILE HA 1.0 1.8 3.8 705 621 A 67 ILE HG1x A 67 ILE HA 1.0 1.9 4.5 706 622 A 67 ILE HG2% A 67 ILE HA 1.0 1.7 2.9 707 623 A 67 ILE HD1% A 67 ILE HB 1.0 2.0 5.0 708 624 A 67 ILE HG1y A 67 ILE HB 1.0 1.8 3.6 709 625 A 67 ILE HG1x A 67 ILE HB 1.0 1.7 3.5 710 626 A 67 ILE HG2% A 67 ILE HB 1.0 1.6 2.8 711 627 A 67 ILE HB A 78 TYR HE% 1.0 2.0 6.0 712 628 A 67 ILE HD1% B 6 G H1' 1.0 1.6 3.0 713 629 A 67 ILE HD1% B 6 G H4' 1.0 2.0 5.2 714 630 A 67 ILE HD1% A 65 VAL HG1% 1.0 0.0 6.0 715 630 A 67 ILE HD1% A 65 VAL HG2% 1.0 0.0 6.0 716 631 A 67 ILE HD1% A 67 ILE HA 1.0 1.6 2.8 717 632 A 67 ILE HD1% A 67 ILE HG1y 1.0 1.7 3.1 718 633 A 67 ILE HD1% A 80 PHE HD% 1.0 1.8 3.8 719 634 A 67 ILE HD1% A 80 PHE HE% 1.0 2.0 5.2 720 635 A 73 GLN HG3 A 67 ILE HG2% 1.0 0.0 6.0 721 635 A 73 GLN HG2 A 67 ILE HG2% 1.0 0.0 6.0 722 636 A 67 ILE HG2% A 78 TYR HBy 1.0 2.0 5.8 723 637 A 67 ILE HG2% B 6 G H1' 1.0 2.0 4.8 724 638 A 67 ILE HG1y A 67 ILE HG2% 1.0 1.7 3.3 725 639 A 67 ILE HG1x A 67 ILE HG2% 1.0 1.8 3.6 726 640 A 76 ARG HDy A 67 ILE HG2% 1.0 1.8 4.0 727 641 A 67 ILE HG2% A 76 ARG HDx 1.0 1.9 3.9 728 642 A 76 ARG HGy A 67 ILE HG2% 1.0 2.0 5.0 729 643 A 76 ARG HGx A 67 ILE HG2% 1.0 2.0 5.6 730 644 A 67 ILE HG2% A 78 TYR HE% 1.0 2.0 5.2 731 645 A 68 THR HA A 73 GLN HA 1.0 2.0 6.0 732 646 A 75 SER HBx A 68 THR HA 1.0 2.0 5.8 733 647 A 76 ARG HGy A 68 THR HA 1.0 1.9 3.9 734 648 A 76 ARG HGx A 68 THR HA 1.0 2.0 6.0 735 649 A 73 GLN HG3 A 68 THR HB 1.0 2.0 6.0 736 649 A 73 GLN HG2 A 68 THR HB 1.0 2.0 6.0 737 650 A 68 THR HB A 75 SER HA 1.0 1.9 4.3 738 651 A 68 THR HB A 75 SER HBx 1.0 2.0 6.0 739 652 A 68 THR HG2% A 68 THR HA 1.0 1.6 2.8 740 653 A 68 THR HG2% A 68 THR HB 1.0 1.5 2.5 741 654 A 68 THR HG2% A 73 GLN HA 1.0 2.0 4.8 742 655 A 68 THR HG2% A 75 SER HA 1.0 1.5 2.7 743 656 A 68 THR HG2% A 75 SER HBx 1.0 1.9 4.7 744 657 A 69 ASP HBx A 69 ASP HA 1.0 1.8 3.4 745 658 A 69 ASP HBx A 69 ASP HBy 1.0 1.4 2.2 746 659 A 69 ASP HBx A 76 ARG HDy 1.0 2.0 6.0 747 660 A 69 ASP HBy A 69 ASP HA 1.0 1.7 3.3 748 661 A 70 ARG HA A 70 ARG HBy 1.0 1.6 2.8 749 661 A 70 ARG HA A 70 ARG HBx 1.0 1.6 2.8 750 662 A 70 ARG HA A 70 ARG HD2 1.0 1.9 4.5 751 662 A 70 ARG HA A 70 ARG HD3 1.0 1.9 4.5 752 663 A 70 ARG HBx A 70 ARG HD2 1.0 1.7 3.1 753 663 A 70 ARG HBy A 70 ARG HD2 1.0 1.7 3.1 754 663 A 70 ARG HBy A 70 ARG HD3 1.0 1.7 3.1 755 663 A 70 ARG HBx A 70 ARG HD3 1.0 1.7 3.1 756 664 A 70 ARG HG2 A 70 ARG HD2 1.0 1.6 2.6 757 664 A 70 ARG HG3 A 70 ARG HD3 1.0 1.6 2.6 758 664 A 70 ARG HG2 A 70 ARG HD3 1.0 1.6 2.6 759 664 A 70 ARG HG3 A 70 ARG HD2 1.0 1.6 2.6 760 665 A 70 ARG HG3 A 70 ARG HA 1.0 1.7 3.3 761 665 A 70 ARG HG2 A 70 ARG HA 1.0 1.7 3.3 762 666 A 70 ARG HG3 A 70 ARG HBx 1.0 1.3 2.2 763 666 A 70 ARG HG2 A 70 ARG HBy 1.0 1.3 2.2 764 666 A 70 ARG HG3 A 70 ARG HBy 1.0 1.3 2.2 765 666 A 70 ARG HG2 A 70 ARG HBx 1.0 1.3 2.2 766 667 A 71 ASN HBx A 71 ASN HBy 1.0 1.4 2.2 767 668 A 72 THR HG2% A 71 ASN HBy 1.0 2.0 4.4 768 669 A 72 THR HB A 72 THR HA 1.0 1.5 2.5 769 670 A 72 THR HB A 74 LYS HBy 1.0 2.0 6.0 770 671 A 72 THR HB A 74 LYS HD2 1.0 2.0 5.2 771 671 A 72 THR HB A 74 LYS HD3 1.0 2.0 5.2 772 672 A 72 THR HB A 74 LYS HEx 1.0 2.0 6.0 773 673 A 74 LYS HG2 A 72 THR HB 1.0 1.8 3.8 774 673 A 74 LYS HG3 A 72 THR HB 1.0 1.8 3.8 775 674 A 72 THR HG2% A 72 THR HA 1.0 1.6 2.6 776 675 A 72 THR HG2% A 72 THR HB 1.0 1.4 2.4 777 676 A 68 THR HB A 73 GLN HA 1.0 1.6 2.8 778 677 A 69 ASP HBx A 73 GLN HA 1.0 2.0 5.0 779 678 A 73 GLN HA A 73 GLN HB3 1.0 1.7 2.9 780 678 A 73 GLN HA A 73 GLN HB2 1.0 1.7 2.9 781 679 A 73 GLN HG3 A 73 GLN HA 1.0 1.6 2.8 782 679 A 73 GLN HG2 A 73 GLN HA 1.0 1.6 2.8 783 680 A 68 THR HB A 73 GLN HB3 1.0 2.0 4.8 784 680 A 68 THR HB A 73 GLN HB2 1.0 2.0 4.8 785 681 A 68 THR HG2% A 73 GLN HB3 1.0 2.0 5.8 786 681 A 68 THR HG2% A 73 GLN HB2 1.0 2.0 5.8 787 682 A 69 ASP HBx A 73 GLN HB2 1.0 2.0 5.2 788 682 A 69 ASP HBx A 73 GLN HB3 1.0 2.0 5.2 789 683 A 73 GLN HG3 A 73 GLN HB2 1.0 1.5 2.5 790 683 A 73 GLN HG2 A 73 GLN HB3 1.0 1.5 2.5 791 683 A 73 GLN HG2 A 73 GLN HB2 1.0 1.5 2.5 792 683 A 73 GLN HG3 A 73 GLN HB3 1.0 1.5 2.5 793 684 A 73 GLN HG3 A 70 ARG HA 1.0 1.9 4.3 794 684 A 73 GLN HG2 A 70 ARG HA 1.0 1.9 4.3 795 685 A 73 GLN HG3 A 72 THR HA 1.0 1.9 4.5 796 686 A 68 THR HG2% A 74 LYS HA 1.0 2.0 5.4 797 687 A 74 LYS HA A 74 LYS HBx 1.0 1.6 3.0 798 688 A 74 LYS HBy A 74 LYS HA 1.0 1.7 3.5 799 689 A 74 LYS HD3 A 74 LYS HA 1.0 2.0 5.0 800 689 A 74 LYS HD2 A 74 LYS HA 1.0 2.0 5.0 801 690 A 74 LYS HG3 A 74 LYS HA 1.0 1.8 3.6 802 690 A 74 LYS HG2 A 74 LYS HA 1.0 1.8 3.6 803 691 A 74 LYS HBy A 74 LYS HBx 1.0 1.4 2.2 804 692 A 74 LYS HEx A 74 LYS HBx 1.0 2.0 6.0 805 693 A 74 LYS HG3 A 74 LYS HBx 1.0 1.8 3.4 806 693 A 74 LYS HG2 A 74 LYS HBx 1.0 1.8 3.4 807 694 A 74 LYS HBy A 74 LYS HEx 1.0 2.0 5.4 808 695 A 74 LYS HG2 A 74 LYS HBy 1.0 1.8 3.4 809 695 A 74 LYS HG3 A 74 LYS HBy 1.0 1.8 3.4 810 696 A 74 LYS HBy A 74 LYS HD3 1.0 1.8 3.8 811 696 A 74 LYS HBy A 74 LYS HD2 1.0 1.8 3.8 812 697 A 74 LYS HD2 A 74 LYS HEx 1.0 1.7 3.5 813 697 A 74 LYS HD3 A 74 LYS HEx 1.0 1.7 3.5 814 698 A 74 LYS HD3 A 74 LYS HEy 1.0 1.8 3.4 815 698 A 74 LYS HD2 A 74 LYS HEy 1.0 1.8 3.4 816 699 A 74 LYS HG3 A 74 LYS HD3 1.0 1.5 2.5 817 699 A 74 LYS HG3 A 74 LYS HD2 1.0 1.5 2.5 818 699 A 74 LYS HG2 A 74 LYS HD2 1.0 1.5 2.5 819 699 A 74 LYS HG2 A 74 LYS HD3 1.0 1.5 2.5 820 700 A 74 LYS HD2 A 74 LYS HEx 1.0 1.7 3.1 821 700 A 74 LYS HD3 A 74 LYS HEy 1.0 1.7 3.1 822 700 A 74 LYS HD3 A 74 LYS HEx 1.0 1.7 3.1 823 700 A 74 LYS HD2 A 74 LYS HEy 1.0 1.7 3.1 824 701 A 74 LYS HG2 A 74 LYS HEy 1.0 1.8 3.8 825 701 A 74 LYS HG2 A 74 LYS HEx 1.0 1.8 3.8 826 701 A 74 LYS HG3 A 74 LYS HEy 1.0 1.8 3.8 827 701 A 74 LYS HG3 A 74 LYS HEx 1.0 1.8 3.8 828 702 A 66 VAL HG1% A 75 SER HA 1.0 2.0 4.6 829 703 A 44 TYR HBy A 75 SER HBx 1.0 1.9 5.5 830 703 A 44 TYR HBy A 75 SER HBy 1.0 1.9 5.5 831 704 A 44 TYR HBx A 75 SER HBx 1.0 0.0 6.0 832 705 A 44 TYR HD% A 75 SER HBx 1.0 2.0 4.8 833 706 A 75 SER HBx A 75 SER HBy 1.0 1.5 2.3 834 707 A 44 TYR HBx A 75 SER HBy 1.0 1.9 4.5 835 708 A 76 ARG HA A 44 TYR HD% 1.0 2.0 6.0 836 709 A 76 ARG HA A 44 TYR HE% 1.0 2.0 4.8 837 710 A 76 ARG HA A 76 ARG HDy 1.0 1.9 6.0 838 711 A 76 ARG HA A 78 TYR HD% 1.0 1.9 6.0 839 712 A 76 ARG HDy A 67 ILE HG1y 1.0 2.0 6.0 840 713 A 76 ARG HDy A 78 TYR HBx 1.0 2.0 6.0 841 714 A 73 GLN HG3 A 76 ARG HDy 1.0 0.0 6.0 842 714 A 73 GLN HG2 A 76 ARG HDy 1.0 0.0 6.0 843 715 A 76 ARG HDy A 78 TYR HE% 1.0 2.0 5.8 844 716 A 78 TYR HE% A 76 ARG HDx 1.0 2.0 6.0 845 717 A 77 GLY HAx A 44 TYR HD% 1.0 2.0 5.8 846 718 A 77 GLY HAx A 44 TYR HE% 1.0 2.0 5.0 847 719 A 77 GLY HAx A 77 GLY HAy 1.0 1.6 2.8 848 720 A 77 GLY HAy A 44 TYR HD% 1.0 2.0 6.0 849 721 A 77 GLY HAy A 44 TYR HE% 1.0 1.9 5.3 850 722 A 40 GLY HAx A 78 TYR HA 1.0 2.0 6.0 851 723 A 40 GLY HAy A 78 TYR HA 1.0 1.9 3.9 852 724 A 42 LEU HBy A 78 TYR HA 1.0 0.0 6.0 853 725 A 42 LEU HBx A 78 TYR HA 1.0 2.0 5.2 854 726 A 42 LEU HD2% A 78 TYR HA 1.0 2.0 5.6 855 727 A 42 LEU HG A 78 TYR HA 1.0 2.0 5.4 856 728 A 78 TYR HBx A 78 TYR HA 1.0 1.8 3.6 857 729 A 78 TYR HBy A 78 TYR HA 1.0 1.9 4.5 858 730 A 78 TYR HBx B 4 G H1' 1.0 2.0 6.0 859 731 A 78 TYR HBx A 78 TYR HBy 1.0 1.7 3.3 860 732 A 78 TYR HBx A 78 TYR HD% 1.0 2.0 5.2 861 733 A 78 TYR HBy A 76 ARG HDx 1.0 2.0 6.0 862 734 A 78 TYR HBy B 4 G H1' 1.0 2.0 6.0 863 735 A 78 TYR HE% A 78 TYR HD% 1.0 2.0 5.0 864 736 A 39 VAL HG1% A 79 GLY HAx 1.0 0.0 6.0 865 737 A 51 LEU HD1% A 79 GLY HAx 1.0 2.0 4.6 866 738 A 65 VAL HG1% A 79 GLY HAx 1.0 2.0 6.0 867 738 A 65 VAL HG2% A 79 GLY HAx 1.0 2.0 6.0 868 739 A 66 VAL HA A 79 GLY HAx 1.0 1.8 3.8 869 740 A 67 ILE HG1x A 79 GLY HAx 1.0 2.0 6.0 870 741 A 79 GLY HAy A 79 GLY HAx 1.0 1.5 2.5 871 742 A 79 GLY HAy A 51 LEU HD1% 1.0 2.0 6.0 872 743 A 79 GLY HAy A 65 VAL HG1% 1.0 1.9 5.1 873 743 A 79 GLY HAy A 65 VAL HG2% 1.0 1.9 5.1 874 744 A 79 GLY HAy A 67 ILE HD1% 1.0 1.9 6.0 875 745 A 79 GLY HAy A 67 ILE HG1y 1.0 2.0 6.0 876 746 A 80 PHE HA A 38 PHE HA 1.0 1.9 4.1 877 747 A 80 PHE HA A 39 VAL HG1% 1.0 0.0 6.0 878 748 A 80 PHE HA A 80 PHE HBx 1.0 1.8 3.6 879 749 A 80 PHE HA A 80 PHE HBy 1.0 1.9 4.5 880 750 A 80 PHE HD% A 80 PHE HA 1.0 1.9 4.7 881 751 A 65 VAL HG2% A 80 PHE HBx 1.0 2.0 5.8 882 751 A 65 VAL HG1% A 80 PHE HBx 1.0 2.0 5.8 883 752 A 80 PHE HBy A 80 PHE HBx 1.0 1.5 2.5 884 753 A 80 PHE HD% A 80 PHE HBx 1.0 1.9 4.1 885 754 A 80 PHE HE% A 80 PHE HBx 1.0 2.0 6.0 886 755 A 65 VAL HG1% A 80 PHE HBy 1.0 1.8 3.8 887 755 A 80 PHE HBy A 65 VAL HG2% 1.0 1.8 3.8 888 756 A 80 PHE HD% A 80 PHE HBy 1.0 1.9 4.1 889 757 A 36 LYS HEx A 80 PHE HD% 1.0 2.0 5.6 890 758 A 80 PHE HD% A 38 PHE HD% 1.0 1.8 4.2 891 759 A 80 PHE HD% A 80 PHE HE% 1.0 1.9 4.1 892 760 A 80 PHE HD% A 110 ALA HB% 1.0 2.0 4.8 893 761 A 80 PHE HE% B 5 U H1' 1.0 2.0 5.0 894 762 A 38 PHE HD% A 80 PHE HE% 1.0 2.0 4.8 895 763 A 80 PHE HZ B 5 U H1' 1.0 1.8 3.6 896 764 A 80 PHE HZ B 5 U H6 1.0 2.0 6.0 897 765 A 80 PHE HZ B 6 G H8 1.0 2.0 5.4 898 766 A 38 PHE HE% A 80 PHE HZ 1.0 2.0 5.6 899 767 A 61 ILE HG2% A 81 VAL HA 1.0 2.0 6.0 900 768 A 64 ALA HA A 81 VAL HA 1.0 1.6 3.0 901 769 A 64 ALA HB% A 81 VAL HA 1.0 2.0 5.0 902 770 A 81 VAL HB A 81 VAL HA 1.0 1.9 4.3 903 771 A 81 VAL HG1% A 81 VAL HA 1.0 1.7 3.3 904 772 A 81 VAL HG2% A 81 VAL HA 1.0 1.7 3.3 905 773 A 37 ILE HB A 81 VAL HB 1.0 1.7 3.3 906 774 A 37 ILE HG2% A 81 VAL HB 1.0 2.0 4.4 907 775 A 81 VAL HB A 80 PHE HA 1.0 2.0 6.0 908 776 A 80 PHE HD% A 81 VAL HB 1.0 2.0 6.0 909 777 A 81 VAL HG1% A 81 VAL HB 1.0 1.6 3.0 910 778 A 55 PHE HBy A 81 VAL HG1% 1.0 1.9 3.9 911 779 A 81 VAL HG1% A 55 PHE HD% 1.0 1.8 3.8 912 780 A 81 VAL HG1% A 64 ALA HA 1.0 1.8 4.0 913 781 A 81 VAL HG1% A 55 PHE HBx 1.0 1.8 3.8 914 782 A 37 ILE HB A 81 VAL HG2% 1.0 2.0 5.8 915 783 A 37 ILE HG2% A 81 VAL HG2% 1.0 0.0 6.0 916 784 A 39 VAL HB A 81 VAL HG2% 1.0 1.8 3.8 917 785 A 55 PHE HD% A 81 VAL HG2% 1.0 1.9 4.1 918 786 A 55 PHE HE% A 81 VAL HG2% 1.0 2.0 5.0 919 787 A 61 ILE HD1% A 81 VAL HG2% 1.0 0.0 6.0 920 788 A 61 ILE HG1x A 81 VAL HG2% 1.0 0.0 6.0 921 789 A 81 VAL HG2% A 64 ALA HA 1.0 1.7 3.5 922 790 A 64 ALA HB% A 81 VAL HG2% 1.0 1.7 3.1 923 791 A 80 PHE HA A 81 VAL HG2% 1.0 2.0 5.8 924 792 A 81 VAL HB A 81 VAL HG2% 1.0 1.6 2.8 925 793 A 81 VAL HG1% A 81 VAL HG2% 1.0 1.5 2.5 926 794 A 83 MET HE% A 81 VAL HG2% 1.0 2.0 5.4 927 795 A 36 LYS HBx A 82 THR HA 1.0 0.0 6.0 928 796 A 36 LYS HBy A 82 THR HA 1.0 2.0 6.0 929 797 A 82 THR HA A 36 LYS HG3 1.0 2.0 6.0 930 798 A 36 LYS HG2 A 82 THR HA 1.0 1.9 6.0 931 799 A 81 VAL HG1% A 82 THR HA 1.0 2.0 5.2 932 800 A 82 THR HB A 63 GLU HBx 1.0 1.8 3.4 933 801 A 82 THR HB A 63 GLU HBy 1.0 1.9 5.3 934 802 A 82 THR HB A 63 GLU HGx 1.0 2.0 6.0 935 803 A 82 THR HB A 81 VAL HG1% 1.0 2.0 6.0 936 804 A 82 THR HB A 82 THR HA 1.0 1.9 3.9 937 805 A 82 THR HG2% A 82 THR HA 1.0 1.6 3.0 938 806 A 82 THR HB A 82 THR HG2% 1.0 1.6 2.6 939 807 A 61 ILE HG1y A 83 MET HA 1.0 2.0 6.0 940 808 A 61 ILE HG1x A 83 MET HA 1.0 2.0 6.0 941 809 A 81 VAL HG1% A 83 MET HA 1.0 2.0 5.8 942 810 A 83 MET HBx A 83 MET HA 1.0 2.0 4.6 943 811 A 83 MET HG3 A 83 MET HA 1.0 1.9 4.5 944 812 A 83 MET HBy A 37 ILE HD1% 1.0 2.0 6.0 945 813 A 83 MET HBy A 83 MET HA 1.0 1.7 3.1 946 814 A 83 MET HBy A 83 MET HBx 1.0 1.5 2.3 947 815 A 83 MET HBy A 83 MET HG3 1.0 1.7 3.3 948 816 A 83 MET HBy A 89 ALA HB% 1.0 2.0 5.4 949 817 A 83 MET HBy A 92 ALA HB% 1.0 2.0 6.0 950 818 A 81 VAL HG1% A 83 MET HBx 1.0 1.9 6.0 951 819 A 83 MET HBx A 83 MET HG3 1.0 1.7 2.9 952 820 A 83 MET HBx A 88 SER HBx 1.0 2.0 6.0 953 821 A 83 MET HBx A 92 ALA HB% 1.0 2.0 6.0 954 822 A 83 MET HE% A 88 SER HBy 1.0 1.7 3.3 955 823 A 83 MET HE% A 55 PHE HD% 1.0 2.0 4.8 956 824 A 83 MET HE% A 58 PHE HBx 1.0 1.9 4.3 957 825 A 83 MET HE% A 58 PHE HBy 1.0 1.7 3.3 958 826 A 83 MET HE% A 58 PHE HD% 1.0 1.9 4.9 959 827 A 61 ILE HD1% A 83 MET HE% 1.0 1.8 3.6 960 828 A 61 ILE HG1y A 83 MET HE% 1.0 1.8 3.8 961 829 A 61 ILE HG1x A 83 MET HE% 1.0 1.7 3.3 962 830 A 61 ILE HG2% A 83 MET HE% 1.0 2.0 5.6 963 831 A 81 VAL HG1% A 83 MET HE% 1.0 1.8 3.6 964 832 A 83 MET HE% A 83 MET HA 1.0 1.9 4.1 965 833 A 83 MET HBy A 83 MET HE% 1.0 1.5 2.7 966 834 A 83 MET HBx A 83 MET HE% 1.0 1.9 4.7 967 835 A 83 MET HE% A 88 SER HBx 1.0 1.6 2.8 968 836 A 83 MET HE% A 89 ALA HA 1.0 1.8 3.8 969 837 A 89 ALA HB% A 83 MET HE% 1.0 2.0 5.6 970 838 A 83 MET HE% A 92 ALA HB% 1.0 1.8 3.8 971 839 A 84 LYS HBx A 60 ASP HBx 1.0 1.9 4.3 972 840 A 60 ASP HBy A 84 LYS HBx 1.0 1.7 3.3 973 841 A 84 LYS HBx A 84 LYS HA 1.0 1.8 3.4 974 842 A 84 LYS HBy A 60 ASP HBx 1.0 1.9 4.3 975 843 A 60 ASP HBy A 84 LYS HBy 1.0 1.9 4.5 976 844 A 84 LYS HBy A 84 LYS HA 1.0 1.6 2.8 977 845 A 84 LYS HBy A 84 LYS HG3 1.0 1.7 3.3 978 845 A 84 LYS HBy A 84 LYS HG2 1.0 1.7 3.3 979 846 A 84 LYS HBy A 85 ASP HBy 1.0 2.0 6.0 980 847 A 84 LYS HD3 A 60 ASP HBx 1.0 1.7 3.5 981 847 A 84 LYS HD2 A 60 ASP HBx 1.0 1.7 3.5 982 848 A 84 LYS HG3 A 84 LYS HA 1.0 1.7 3.1 983 848 A 84 LYS HG2 A 84 LYS HA 1.0 1.7 3.1 984 849 A 85 ASP HA A 85 ASP HBx 1.0 1.6 3.0 985 850 A 85 ASP HA A 85 ASP HBy 1.0 1.6 3.0 986 851 A 85 ASP HBy A 85 ASP HBx 1.0 1.4 2.2 987 852 A 34 PHE HBx A 86 ARG HBy 1.0 1.8 3.8 988 853 A 34 PHE HBy A 86 ARG HDx 1.0 0.0 6.0 989 853 A 34 PHE HBy A 86 ARG HDy 1.0 0.0 6.0 990 854 A 34 PHE HD% A 86 ARG HDy 1.0 0.0 6.0 991 854 A 34 PHE HD% A 86 ARG HDx 1.0 0.0 6.0 992 855 A 35 THR HG2% A 86 ARG HDx 1.0 2.0 6.0 993 855 A 35 THR HG2% A 86 ARG HDy 1.0 2.0 6.0 994 856 A 86 ARG HA A 86 ARG HDx 1.0 2.0 5.2 995 856 A 86 ARG HA A 86 ARG HDy 1.0 2.0 5.2 996 857 A 86 ARG HBy A 86 ARG HDx 1.0 1.9 4.3 997 857 A 86 ARG HDy A 86 ARG HBy 1.0 1.9 4.3 998 858 A 86 ARG HDy A 86 ARG HGx 1.0 1.7 3.3 999 858 A 86 ARG HGx A 86 ARG HDx 1.0 1.7 3.3 1000 859 A 86 ARG HGy A 86 ARG HDy 1.0 1.8 3.4 1001 860 A 86 ARG HGy A 34 PHE HBx 1.0 2.0 4.6 1002 861 A 86 ARG HA A 86 ARG HGy 1.0 1.9 4.7 1003 862 A 86 ARG HGy A 86 ARG HDx 1.0 1.8 3.6 1004 863 A 86 ARG HGy A 86 ARG HGx 1.0 1.3 2.2 1005 864 A 34 PHE HBx A 86 ARG HGx 1.0 2.0 5.0 1006 865 A 86 ARG HA A 86 ARG HGx 1.0 1.8 3.8 1007 866 A 86 ARG HBy A 86 ARG HGx 1.0 1.8 3.4 1008 867 A 86 ARG HGx A 86 ARG HDx 1.0 1.7 3.5 1009 868 A 86 ARG HDy A 86 ARG HGx 1.0 1.8 3.6 1010 869 A 90 GLU HBx A 86 ARG HGx 1.0 2.0 6.0 1011 870 A 86 ARG HGx A 90 GLU HGy 1.0 2.0 4.6 1012 871 A 86 ARG HDy A 87 ALA HB% 1.0 2.0 4.6 1013 871 A 86 ARG HDx A 87 ALA HB% 1.0 2.0 4.6 1014 872 A 87 ALA HA A 87 ALA HB% 1.0 1.4 2.4 1015 873 A 87 ALA HB% A 88 SER HA 1.0 2.0 5.0 1016 874 A 90 GLU HBx A 87 ALA HB% 1.0 2.0 4.6 1017 875 A 90 GLU HGy A 87 ALA HB% 1.0 2.0 6.0 1018 876 A 91 ARG HBy A 87 ALA HB% 1.0 2.0 6.0 1019 877 A 87 ALA HB% A 91 ARG HGy 1.0 0.0 6.0 1020 878 A 88 SER HBx A 88 SER HA 1.0 1.7 3.1 1021 879 A 88 SER HBy A 88 SER HA 1.0 1.9 4.1 1022 880 A 88 SER HBy A 88 SER HBx 1.0 1.5 2.3 1023 881 A 83 MET HBx A 88 SER HBy 1.0 2.0 5.6 1024 882 A 37 ILE HG1x A 89 ALA HA 1.0 2.0 5.6 1025 883 A 83 MET HBy A 89 ALA HA 1.0 1.9 4.3 1026 884 A 83 MET HBx A 89 ALA HA 1.0 1.8 3.8 1027 885 A 83 MET HG3 A 89 ALA HA 1.0 1.8 4.0 1028 886 A 89 ALA HB% A 89 ALA HA 1.0 1.5 2.7 1029 887 A 89 ALA HA A 92 ALA HB% 1.0 1.7 3.3 1030 888 A 109 LEU HD2% A 89 ALA HB% 1.0 1.8 3.6 1031 889 A 89 ALA HB% A 83 MET HG3 1.0 1.8 3.6 1032 890 A 89 ALA HB% A 37 ILE HG1x 1.0 2.0 4.8 1033 891 A 37 ILE HG2% A 89 ALA HB% 1.0 0.0 6.0 1034 892 A 89 ALA HB% A 83 MET HBx 1.0 1.7 3.3 1035 893 A 90 GLU HA A 90 GLU HBy 1.0 1.6 3.0 1036 894 A 90 GLU HBx A 90 GLU HA 1.0 1.7 3.1 1037 895 A 90 GLU HA A 93 CYS HBy 1.0 1.9 3.9 1038 896 A 90 GLU HA A 93 CYS HBx 1.0 2.0 4.6 1039 897 A 87 ALA HA A 90 GLU HBx 1.0 1.7 3.3 1040 898 A 87 ALA HA A 90 GLU HGx 1.0 1.8 4.2 1041 899 A 90 GLU HGx A 90 GLU HA 1.0 1.8 4.0 1042 900 A 90 GLU HGx A 90 GLU HGy 1.0 1.3 2.2 1043 901 A 86 ARG HGy A 90 GLU HGy 1.0 2.0 5.4 1044 902 A 87 ALA HA A 90 GLU HGy 1.0 2.0 4.6 1045 903 A 89 ALA HB% A 90 GLU HGy 1.0 2.0 5.6 1046 904 A 90 GLU HGy A 90 GLU HA 1.0 1.8 3.6 1047 905 A 90 GLU HBx A 90 GLU HGy 1.0 1.4 2.4 1048 906 A 91 ARG HBy A 91 ARG HA 1.0 1.7 3.5 1049 907 A 91 ARG HA A 91 ARG HBx 1.0 1.7 3.5 1050 908 A 91 ARG HBy A 58 PHE HBx 1.0 1.9 4.9 1051 909 A 91 ARG HBy A 58 PHE HD% 1.0 1.9 4.5 1052 910 A 91 ARG HBy A 88 SER HA 1.0 2.0 5.6 1053 911 A 91 ARG HBy A 91 ARG HBx 1.0 1.5 2.3 1054 912 A 91 ARG HBy A 91 ARG HDy 1.0 1.9 4.5 1055 913 A 58 PHE HD% A 91 ARG HBx 1.0 2.0 5.0 1056 914 A 91 ARG HBx A 88 SER HA 1.0 0.0 6.0 1057 915 A 91 ARG HBx A 91 ARG HDy 1.0 1.9 4.3 1058 916 A 91 ARG HGx A 91 ARG HBx 1.0 1.7 3.1 1059 917 A 91 ARG HA A 91 ARG HDx 1.0 2.0 5.0 1060 918 A 91 ARG HBy A 91 ARG HDx 1.0 1.8 4.0 1061 919 A 91 ARG HBx A 91 ARG HDx 1.0 1.8 3.8 1062 920 A 91 ARG HDy A 91 ARG HDx 1.0 1.4 2.2 1063 921 A 91 ARG HGx A 91 ARG HDx 1.0 1.8 3.6 1064 922 A 91 ARG HA A 91 ARG HDy 1.0 2.0 5.8 1065 923 A 91 ARG HGx A 91 ARG HDy 1.0 1.7 3.1 1066 924 A 91 ARG HGy A 91 ARG HDy 1.0 1.8 3.4 1067 925 A 91 ARG HGx A 91 ARG HGy 1.0 1.4 2.2 1068 926 A 91 ARG HA A 91 ARG HGy 1.0 1.7 3.5 1069 927 A 91 ARG HGy A 91 ARG HDx 1.0 1.8 3.8 1070 928 A 92 ALA HA A 58 PHE HBx 1.0 2.0 5.4 1071 929 A 92 ALA HA A 58 PHE HD% 1.0 1.9 4.7 1072 930 A 92 ALA HA A 58 PHE HE% 1.0 1.9 4.7 1073 931 A 37 ILE HG2% A 92 ALA HB% 1.0 1.7 3.3 1074 932 A 55 PHE HD% A 92 ALA HB% 1.0 1.7 3.3 1075 933 A 92 ALA HB% A 58 PHE HBy 1.0 1.9 3.9 1076 934 A 92 ALA HB% A 58 PHE HD% 1.0 1.8 3.8 1077 935 A 92 ALA HB% A 58 PHE HE% 1.0 2.0 5.4 1078 936 A 91 ARG HBy A 92 ALA HB% 1.0 2.0 6.0 1079 937 A 92 ALA HA A 92 ALA HB% 1.0 1.5 2.7 1080 938 A 93 CYS HBy A 93 CYS HA 1.0 1.8 3.8 1081 939 A 93 CYS HBx A 93 CYS HA 1.0 1.7 3.3 1082 940 A 93 CYS HA A 107 VAL HB 1.0 2.0 5.8 1083 941 A 107 VAL HG1% A 93 CYS HA 1.0 1.9 3.9 1084 942 A 93 CYS HBy A 93 CYS HBx 1.0 1.4 2.4 1085 943 A 94 LYS HA A 93 CYS HBy 1.0 2.0 6.0 1086 944 A 94 LYS HA A 93 CYS HBx 1.0 1.9 6.0 1087 945 A 94 LYS HA A 94 LYS HBx 1.0 1.7 3.3 1088 946 A 94 LYS HA A 94 LYS HBy 1.0 1.6 3.0 1089 947 A 94 LYS HA A 94 LYS HGx 1.0 1.9 4.5 1090 948 A 94 LYS HA A 94 LYS HGy 1.0 2.0 4.6 1091 949 A 94 LYS HGx A 91 ARG HA 1.0 1.8 3.6 1092 949 A 94 LYS HGy A 91 ARG HA 1.0 1.8 3.6 1093 950 A 91 ARG HGx A 94 LYS HGx 1.0 0.0 6.0 1094 950 A 91 ARG HGx A 94 LYS HGy 1.0 0.0 6.0 1095 951 A 94 LYS HA A 94 LYS HGx 1.0 1.7 3.5 1096 951 A 94 LYS HA A 94 LYS HGy 1.0 1.7 3.5 1097 952 A 94 LYS HGy A 94 LYS HBx 1.0 1.6 3.0 1098 952 A 94 LYS HGx A 94 LYS HBx 1.0 1.6 3.0 1099 953 A 94 LYS HGx A 94 LYS HBy 1.0 1.6 3.0 1100 953 A 94 LYS HGy A 94 LYS HBy 1.0 1.6 3.0 1101 954 A 94 LYS HGx A 94 LYS HE3 1.0 1.7 3.5 1102 954 A 94 LYS HGx A 94 LYS HE2 1.0 1.7 3.5 1103 954 A 94 LYS HGy A 94 LYS HE3 1.0 1.7 3.5 1104 954 A 94 LYS HGy A 94 LYS HE2 1.0 1.7 3.5 1105 955 A 95 ASP HA A 95 ASP HBx 1.0 1.9 3.9 1106 956 A 95 ASP HA A 95 ASP HBy 1.0 1.8 3.6 1107 957 A 95 ASP HA A 96 PRO HDx 1.0 1.7 3.3 1108 958 A 95 ASP HBx A 95 ASP HBy 1.0 1.5 2.3 1109 959 A 96 PRO HA A 96 PRO HBy 1.0 1.7 2.9 1110 960 A 96 PRO HBx A 96 PRO HA 1.0 1.8 3.6 1111 961 A 96 PRO HA A 96 PRO HG3 1.0 2.0 5.4 1112 961 A 96 PRO HA A 96 PRO HG2 1.0 2.0 5.4 1113 962 A 107 VAL HB A 96 PRO HA 1.0 1.8 3.6 1114 963 A 107 VAL HG2% A 96 PRO HA 1.0 1.9 5.1 1115 964 A 96 PRO HBx A 96 PRO HBy 1.0 1.4 2.2 1116 965 A 96 PRO HDx A 96 PRO HBy 1.0 1.9 4.1 1117 966 A 96 PRO HBx A 96 PRO HDx 1.0 2.0 6.0 1118 967 A 96 PRO HDy A 96 PRO HDx 1.0 1.4 2.2 1119 968 A 96 PRO HDx A 96 PRO HG3 1.0 1.7 3.3 1120 968 A 96 PRO HDx A 96 PRO HG2 1.0 1.7 3.3 1121 969 A 96 PRO HDy A 95 ASP HA 1.0 1.6 2.8 1122 970 A 96 PRO HDy A 96 PRO HBy 1.0 2.0 5.6 1123 971 A 96 PRO HDy A 96 PRO HG2 1.0 1.7 3.1 1124 971 A 96 PRO HDy A 96 PRO HG3 1.0 1.7 3.1 1125 972 A 95 ASP HA A 96 PRO HG3 1.0 2.0 6.0 1126 972 A 95 ASP HA A 96 PRO HG2 1.0 2.0 6.0 1127 973 A 96 PRO HBy A 96 PRO HG3 1.0 1.7 3.1 1128 973 A 96 PRO HBy A 96 PRO HG2 1.0 1.7 3.1 1129 974 A 96 PRO HBx A 96 PRO HG2 1.0 1.6 3.0 1130 974 A 96 PRO HBx A 96 PRO HG3 1.0 1.6 3.0 1131 975 A 97 ASN HBx A 97 ASN HA 1.0 1.8 3.6 1132 976 A 97 ASN HA A 97 ASN HBy 1.0 1.8 3.8 1133 977 A 97 ASN HA A 98 PRO HDy 1.0 1.9 3.9 1134 978 A 97 ASN HA A 98 PRO HDx 1.0 1.7 3.1 1135 979 A 97 ASN HA A 106 ASN HA 1.0 1.8 3.6 1136 980 A 107 VAL HG2% A 97 ASN HA 1.0 2.0 6.0 1137 981 A 97 ASN HBx A 97 ASN HBy 1.0 1.3 2.2 1138 982 A 54 TYR HE% A 98 PRO HA 1.0 2.0 6.0 1139 983 A 97 ASN HA A 98 PRO HA 1.0 2.0 5.6 1140 984 A 98 PRO HA A 98 PRO HBy 1.0 1.7 3.1 1141 985 A 98 PRO HBx A 98 PRO HA 1.0 1.8 3.6 1142 986 A 98 PRO HDy A 98 PRO HA 1.0 2.0 5.2 1143 987 A 98 PRO HDx A 98 PRO HA 1.0 2.0 5.8 1144 988 A 54 TYR HE% A 98 PRO HBy 1.0 2.0 5.6 1145 989 A 98 PRO HBx A 98 PRO HBy 1.0 1.5 2.5 1146 990 A 98 PRO HDx A 98 PRO HBy 1.0 2.0 6.0 1147 991 A 98 PRO HDy A 98 PRO HBy 1.0 1.9 4.9 1148 992 A 98 PRO HBx A 98 PRO HDy 1.0 2.0 5.4 1149 993 A 98 PRO HDy A 98 PRO HDx 1.0 1.5 2.5 1150 994 A 98 PRO HGy A 98 PRO HDy 1.0 1.8 3.6 1151 995 A 105 ALA HB% A 98 PRO HDy 1.0 2.0 6.0 1152 996 A 98 PRO HBx A 98 PRO HDx 1.0 2.0 5.6 1153 997 A 98 PRO HGy A 98 PRO HDx 1.0 1.9 4.5 1154 998 A 98 PRO HDx A 106 ASN HA 1.0 2.0 4.8 1155 999 A 107 VAL HB A 98 PRO HDx 1.0 2.0 5.8 1156 1000 A 54 TYR HE% A 98 PRO HGy 1.0 2.0 5.4 1157 1001 A 98 PRO HGy A 97 ASN HA 1.0 1.9 6.0 1158 1002 A 98 PRO HGy A 98 PRO HBy 1.0 1.7 3.3 1159 1003 A 98 PRO HGy A 98 PRO HGx 1.0 1.5 2.5 1160 1004 A 98 PRO HGy A 107 VAL HG1% 1.0 1.9 4.5 1161 1004 A 98 PRO HGy A 107 VAL HG2% 1.0 1.9 4.5 1162 1005 A 97 ASN HA A 98 PRO HGx 1.0 2.0 6.0 1163 1006 A 98 PRO HBy A 98 PRO HGx 1.0 1.9 4.9 1164 1007 A 98 PRO HDy A 98 PRO HGx 1.0 2.0 5.2 1165 1008 A 98 PRO HDx A 98 PRO HGx 1.0 1.9 4.1 1166 1009 A 105 ALA HB% A 98 PRO HGx 1.0 1.8 3.8 1167 1010 A 99 ILE HA A 99 ILE HB 1.0 1.9 4.1 1168 1011 A 99 ILE HA A 99 ILE HD1% 1.0 1.8 3.4 1169 1012 A 99 ILE HA A 99 ILE HG2% 1.0 1.7 3.1 1170 1013 A 99 ILE HA A 100 ILE HB 1.0 2.0 6.0 1171 1014 A 99 ILE HB A 104 LYS HA 1.0 2.0 6.0 1172 1015 A 99 ILE HD1% A 99 ILE HB 1.0 1.9 4.3 1173 1016 A 99 ILE HD1% A 104 LYS HA 1.0 1.7 3.1 1174 1017 A 99 ILE HD1% A 104 LYS HBy 1.0 1.7 3.3 1175 1018 A 99 ILE HD1% A 104 LYS HD3 1.0 1.9 4.1 1176 1018 A 99 ILE HD1% A 104 LYS HD2 1.0 1.9 4.1 1177 1019 A 99 ILE HD1% A 104 LYS HE3 1.0 1.9 4.5 1178 1019 A 99 ILE HD1% A 104 LYS HE2 1.0 1.9 4.5 1179 1020 A 104 LYS HG2 A 99 ILE HD1% 1.0 1.8 3.6 1180 1020 A 104 LYS HG3 A 99 ILE HD1% 1.0 1.8 3.6 1181 1021 A 99 ILE HG2% A 99 ILE HB 1.0 1.5 2.5 1182 1022 A 99 ILE HD1% A 99 ILE HG2% 1.0 1.5 2.7 1183 1023 A 99 ILE HG1x A 99 ILE HG2% 1.0 1.9 4.1 1184 1024 A 99 ILE HG2% A 102 GLY HAx 1.0 2.0 4.8 1185 1025 A 99 ILE HG2% A 102 GLY HAy 1.0 1.8 3.8 1186 1026 A 54 TYR HE% A 100 ILE HA 1.0 1.9 5.1 1187 1027 A 42 LEU HD2% A 100 ILE HB 1.0 1.8 3.8 1188 1028 A 100 ILE HB A 100 ILE HA 1.0 1.9 3.9 1189 1029 A 100 ILE HD1% A 100 ILE HB 1.0 1.9 4.1 1190 1030 A 100 ILE HB A 100 ILE HG1y 1.0 1.8 3.8 1191 1031 A 100 ILE HB A 100 ILE HG1x 1.0 1.9 4.9 1192 1032 A 100 ILE HD1% A 39 VAL HG1% 1.0 1.6 3.0 1193 1033 A 100 ILE HD1% A 55 PHE HE% 1.0 1.8 3.6 1194 1034 A 100 ILE HD1% A 55 PHE HZ 1.0 1.9 4.9 1195 1035 A 100 ILE HD1% A 98 PRO HBy 1.0 0.0 6.0 1196 1036 A 100 ILE HD1% A 98 PRO HDx 1.0 2.0 6.0 1197 1037 A 100 ILE HD1% A 98 PRO HGy 1.0 2.0 5.0 1198 1038 A 100 ILE HD1% A 100 ILE HA 1.0 2.0 5.0 1199 1039 A 100 ILE HD1% A 100 ILE HG1y 1.0 1.7 3.1 1200 1040 A 100 ILE HD1% A 100 ILE HG1x 1.0 1.7 3.3 1201 1041 A 100 ILE HG2% A 100 ILE HD1% 1.0 1.6 3.0 1202 1042 A 100 ILE HD1% A 105 ALA HA 1.0 2.0 6.0 1203 1043 A 100 ILE HD1% A 105 ALA HB% 1.0 1.5 2.7 1204 1044 A 100 ILE HD1% A 107 VAL HG2% 1.0 2.0 4.6 1205 1045 A 98 PRO HBx A 100 ILE HG1y 1.0 1.9 4.3 1206 1046 A 100 ILE HA A 100 ILE HG1y 1.0 1.9 4.1 1207 1047 A 100 ILE HG1y A 100 ILE HG1x 1.0 1.5 2.7 1208 1048 A 105 ALA HB% A 100 ILE HG1y 1.0 1.8 3.6 1209 1049 A 54 TYR HE% A 100 ILE HG1x 1.0 2.0 5.4 1210 1050 A 98 PRO HBx A 100 ILE HG1x 1.0 2.0 4.8 1211 1051 A 100 ILE HA A 100 ILE HG1x 1.0 1.8 3.6 1212 1052 A 105 ALA HB% A 100 ILE HG1x 1.0 2.0 5.6 1213 1053 A 100 ILE HG2% A 54 TYR HBx 1.0 2.0 5.2 1214 1054 A 46 THR HG2% A 100 ILE HG2% 1.0 1.9 4.1 1215 1055 A 100 ILE HG2% A 54 TYR HD% 1.0 2.0 5.6 1216 1056 A 100 ILE HG2% A 54 TYR HE% 1.0 2.0 5.8 1217 1057 A 100 ILE HG2% A 100 ILE HA 1.0 1.6 2.8 1218 1058 A 100 ILE HG2% A 100 ILE HG1x 1.0 1.8 3.6 1219 1059 A 100 ILE HG2% A 101 ASP HBy 1.0 1.9 3.9 1220 1060 A 100 ILE HG2% A 101 ASP HA 1.0 1.9 6.0 1221 1061 A 101 ASP HBy A 101 ASP HA 1.0 1.7 3.3 1222 1062 A 43 PRO HBx A 101 ASP HBx 1.0 2.0 6.0 1223 1063 A 43 PRO HGx A 101 ASP HBx 1.0 1.8 3.6 1224 1064 A 50 THR HG2% A 101 ASP HBx 1.0 2.0 6.0 1225 1065 A 101 ASP HBx A 100 ILE HA 1.0 2.0 6.0 1226 1066 A 100 ILE HB A 101 ASP HBx 1.0 2.0 5.2 1227 1067 A 100 ILE HG2% A 101 ASP HBx 1.0 1.9 5.3 1228 1068 A 101 ASP HBx A 101 ASP HA 1.0 1.9 3.7 1229 1069 A 101 ASP HBy A 101 ASP HBx 1.0 1.4 2.2 1230 1070 A 43 PRO HBx A 101 ASP HBy 1.0 1.9 6.0 1231 1071 A 102 GLY HAx A 102 GLY HAy 1.0 1.5 2.5 1232 1072 A 99 ILE HD1% A 103 ARG HA 1.0 2.0 6.0 1233 1073 A 99 ILE HG2% A 103 ARG HA 1.0 2.0 4.8 1234 1074 A 103 ARG HBx A 103 ARG HA 1.0 1.8 3.6 1235 1075 A 103 ARG HA A 103 ARG HBy 1.0 1.8 3.8 1236 1076 A 103 ARG HGx A 103 ARG HA 1.0 1.8 3.8 1237 1077 A 104 LYS HBy A 103 ARG HA 1.0 2.0 5.6 1238 1078 A 43 PRO HBy A 103 ARG HBx 1.0 2.0 6.0 1239 1079 A 43 PRO HGy A 103 ARG HBx 1.0 2.0 4.8 1240 1080 A 43 PRO HGx A 103 ARG HBx 1.0 2.0 5.6 1241 1081 A 103 ARG HBx A 103 ARG HD3 1.0 2.0 5.0 1242 1082 A 103 ARG HBx A 103 ARG HD2 1.0 2.0 4.8 1243 1083 A 103 ARG HGx A 103 ARG HBx 1.0 1.8 3.6 1244 1084 A 43 PRO HBy A 103 ARG HBy 1.0 2.0 6.0 1245 1085 A 43 PRO HGy A 103 ARG HBy 1.0 1.9 4.1 1246 1086 A 103 ARG HBy A 103 ARG HD3 1.0 1.9 4.5 1247 1087 A 103 ARG HBy A 103 ARG HD2 1.0 2.0 5.0 1248 1088 A 103 ARG HBx A 103 ARG HD2 1.0 1.9 4.3 1249 1088 A 103 ARG HBx A 103 ARG HD3 1.0 1.9 4.3 1250 1089 A 103 ARG HBy A 103 ARG HD3 1.0 1.9 4.3 1251 1089 A 103 ARG HBy A 103 ARG HD2 1.0 1.9 4.3 1252 1090 A 103 ARG HGx A 103 ARG HD3 1.0 1.8 3.8 1253 1090 A 103 ARG HGx A 103 ARG HD2 1.0 1.8 3.8 1254 1091 A 103 ARG HGy A 103 ARG HD2 1.0 1.9 4.1 1255 1091 A 103 ARG HGy A 103 ARG HD3 1.0 1.9 4.1 1256 1092 A 103 ARG HGx A 42 LEU HA 1.0 1.9 6.0 1257 1093 A 103 ARG HGx A 103 ARG HD3 1.0 1.9 5.1 1258 1094 A 103 ARG HGx A 103 ARG HD2 1.0 1.8 3.8 1259 1095 A 103 ARG HGy A 103 ARG HD3 1.0 1.8 3.4 1260 1096 A 103 ARG HGy A 103 ARG HD2 1.0 1.9 4.9 1261 1097 A 99 ILE HG2% A 104 LYS HA 1.0 1.9 4.1 1262 1098 A 104 LYS HA A 104 LYS HBy 1.0 1.6 2.8 1263 1099 A 104 LYS HA A 105 ALA HB% 1.0 1.9 4.3 1264 1100 A 99 ILE HA A 104 LYS HBx 1.0 1.9 6.0 1265 1101 A 99 ILE HD1% A 104 LYS HBx 1.0 2.0 5.2 1266 1102 A 104 LYS HBx A 104 LYS HBy 1.0 1.3 2.2 1267 1103 A 104 LYS HBx A 104 LYS HE3 1.0 2.0 4.8 1268 1103 A 104 LYS HBx A 104 LYS HE2 1.0 2.0 4.8 1269 1104 A 104 LYS HG3 A 104 LYS HBx 1.0 1.7 3.1 1270 1104 A 104 LYS HG2 A 104 LYS HBx 1.0 1.7 3.1 1271 1105 A 115 LYS HBx A 115 LYS HGx 1.0 1.9 4.1 1272 1106 A 99 ILE HA A 104 LYS HBy 1.0 2.0 6.0 1273 1107 A 99 ILE HG2% A 104 LYS HBy 1.0 2.0 6.0 1274 1108 A 104 LYS HBy A 104 LYS HE3 1.0 1.9 4.1 1275 1108 A 104 LYS HBy A 104 LYS HE2 1.0 1.9 4.1 1276 1109 A 104 LYS HG2 A 104 LYS HBy 1.0 1.8 3.4 1277 1109 A 104 LYS HG3 A 104 LYS HBy 1.0 1.8 3.4 1278 1110 A 104 LYS HD3 A 104 LYS HE2 1.0 1.6 2.8 1279 1110 A 104 LYS HD2 A 104 LYS HE2 1.0 1.6 2.8 1280 1110 A 104 LYS HD3 A 104 LYS HE3 1.0 1.6 2.8 1281 1110 A 104 LYS HD2 A 104 LYS HE3 1.0 1.6 2.8 1282 1111 A 97 ASN HA A 104 LYS HD2 1.0 2.0 6.0 1283 1111 A 97 ASN HA A 104 LYS HD3 1.0 2.0 6.0 1284 1112 A 97 ASN HBx A 104 LYS HD2 1.0 1.9 4.1 1285 1112 A 97 ASN HBx A 104 LYS HD3 1.0 1.9 4.1 1286 1113 A 97 ASN HBy A 104 LYS HD2 1.0 1.8 3.6 1287 1113 A 97 ASN HBy A 104 LYS HD3 1.0 1.8 3.6 1288 1114 A 104 LYS HA A 104 LYS HD3 1.0 2.0 5.6 1289 1114 A 104 LYS HA A 104 LYS HD2 1.0 2.0 5.6 1290 1115 A 104 LYS HG3 A 104 LYS HD3 1.0 1.6 2.8 1291 1115 A 104 LYS HG2 A 104 LYS HD2 1.0 1.6 2.8 1292 1115 A 104 LYS HG3 A 104 LYS HD2 1.0 1.6 2.8 1293 1115 A 104 LYS HG2 A 104 LYS HD3 1.0 1.6 2.8 1294 1116 A 97 ASN HA A 104 LYS HE3 1.0 0.0 6.0 1295 1116 A 97 ASN HA A 104 LYS HE2 1.0 0.0 6.0 1296 1117 A 104 LYS HG3 A 104 LYS HE2 1.0 1.9 4.1 1297 1117 A 104 LYS HG3 A 104 LYS HE3 1.0 1.9 4.1 1298 1117 A 104 LYS HG2 A 104 LYS HE3 1.0 1.9 4.1 1299 1117 A 104 LYS HG2 A 104 LYS HE2 1.0 1.9 4.1 1300 1118 A 104 LYS HG2 A 97 ASN HA 1.0 1.9 4.5 1301 1118 A 104 LYS HG3 A 97 ASN HA 1.0 1.9 4.5 1302 1119 A 104 LYS HG2 A 97 ASN HBy 1.0 1.8 3.6 1303 1119 A 104 LYS HG3 A 97 ASN HBy 1.0 1.8 3.6 1304 1120 A 104 LYS HG2 A 104 LYS HA 1.0 1.7 3.1 1305 1120 A 104 LYS HG3 A 104 LYS HA 1.0 1.7 3.1 1306 1121 A 41 GLY HAy A 105 ALA HA 1.0 1.9 4.1 1307 1122 A 41 GLY HAx A 105 ALA HA 1.0 2.0 5.8 1308 1123 A 42 LEU HD2% A 105 ALA HA 1.0 0.0 6.0 1309 1124 A 105 ALA HB% A 105 ALA HA 1.0 1.7 2.9 1310 1125 A 42 LEU HD1% A 105 ALA HB% 1.0 1.9 4.1 1311 1126 A 105 ALA HB% A 97 ASN HA 1.0 2.0 5.4 1312 1127 A 105 ALA HB% A 98 PRO HBy 1.0 0.0 6.0 1313 1128 A 105 ALA HB% A 98 PRO HDx 1.0 1.9 3.9 1314 1129 A 98 PRO HGy A 105 ALA HB% 1.0 1.9 5.1 1315 1130 A 105 ALA HB% A 106 ASN HA 1.0 2.0 5.4 1316 1131 A 98 PRO HDy A 106 ASN HA 1.0 2.0 6.0 1317 1132 A 106 ASN HA A 106 ASN HBx 1.0 1.8 3.4 1318 1133 A 106 ASN HA A 106 ASN HBy 1.0 1.7 3.1 1319 1134 A 37 ILE HG2% A 107 VAL HA 1.0 2.0 4.6 1320 1135 A 107 VAL HG2% A 107 VAL HA 1.0 1.7 3.3 1321 1136 A 37 ILE HG2% A 107 VAL HB 1.0 2.0 5.8 1322 1137 A 107 VAL HB A 98 PRO HDy 1.0 2.0 4.8 1323 1138 A 107 VAL HA A 107 VAL HB 1.0 1.8 3.6 1324 1139 A 107 VAL HG1% A 107 VAL HB 1.0 1.7 3.3 1325 1140 A 107 VAL HG2% A 107 VAL HB 1.0 1.7 3.1 1326 1141 A 107 VAL HG1% A 98 PRO HGx 1.0 1.8 3.6 1327 1141 A 107 VAL HG2% A 98 PRO HGx 1.0 1.8 3.6 1328 1142 A 107 VAL HG1% A 39 VAL HA 1.0 1.8 3.6 1329 1142 A 107 VAL HG2% A 39 VAL HA 1.0 1.8 3.6 1330 1143 A 107 VAL HG1% A 39 VAL HG1% 1.0 1.5 2.5 1331 1143 A 107 VAL HG2% A 39 VAL HG1% 1.0 1.5 2.5 1332 1144 A 107 VAL HG1% A 39 VAL HG2% 1.0 1.7 3.1 1333 1144 A 107 VAL HG2% A 39 VAL HG2% 1.0 1.7 3.1 1334 1145 A 55 PHE HE% A 107 VAL HG2% 1.0 1.9 4.1 1335 1145 A 55 PHE HE% A 107 VAL HG1% 1.0 1.9 4.1 1336 1146 A 55 PHE HZ A 107 VAL HG1% 1.0 1.7 3.5 1337 1146 A 55 PHE HZ A 107 VAL HG2% 1.0 1.7 3.5 1338 1147 A 107 VAL HG1% A 97 ASN HA 1.0 2.0 5.0 1339 1147 A 107 VAL HG2% A 97 ASN HA 1.0 2.0 5.0 1340 1148 A 107 VAL HG1% A 98 PRO HBy 1.0 0.0 6.0 1341 1148 A 107 VAL HG2% A 98 PRO HBy 1.0 0.0 6.0 1342 1149 A 107 VAL HG1% A 98 PRO HDy 1.0 1.8 3.6 1343 1149 A 107 VAL HG2% A 98 PRO HDy 1.0 1.8 3.6 1344 1150 A 107 VAL HG1% A 98 PRO HDx 1.0 1.7 3.3 1345 1150 A 107 VAL HG2% A 98 PRO HDx 1.0 1.7 3.3 1346 1151 A 107 VAL HG1% A 105 ALA HB% 1.0 1.8 3.8 1347 1151 A 107 VAL HG2% A 105 ALA HB% 1.0 1.8 3.8 1348 1152 A 107 VAL HG1% A 106 ASN HA 1.0 2.0 5.2 1349 1152 A 107 VAL HG2% A 106 ASN HA 1.0 2.0 5.2 1350 1153 A 107 VAL HG1% A 107 VAL HA 1.0 1.5 2.7 1351 1153 A 107 VAL HG2% A 107 VAL HA 1.0 1.5 2.7 1352 1154 A 107 VAL HG1% A 107 VAL HB 1.0 1.4 2.4 1353 1154 A 107 VAL HG2% A 107 VAL HB 1.0 1.4 2.4 1354 1155 A 37 ILE HB A 107 VAL HG1% 1.0 0.0 6.0 1355 1156 A 37 ILE HG1y A 107 VAL HG1% 1.0 2.0 6.0 1356 1157 A 107 VAL HG1% A 108 ASN HA 1.0 1.8 3.8 1357 1158 A 54 TYR HE% A 107 VAL HG2% 1.0 0.0 6.0 1358 1159 A 92 ALA HA A 107 VAL HG2% 1.0 0.0 6.0 1359 1160 A 108 ASN HBx A 108 ASN HA 1.0 1.7 3.1 1360 1161 A 108 ASN HBy A 112 LEU HD1% 1.0 2.0 4.8 1361 1162 A 108 ASN HBy A 108 ASN HA 1.0 1.7 3.3 1362 1163 A 37 ILE HA A 109 LEU HA 1.0 1.7 2.9 1363 1164 A 37 ILE HG1x A 109 LEU HA 1.0 1.9 5.1 1364 1165 A 37 ILE HG2% A 109 LEU HA 1.0 1.8 4.0 1365 1166 A 109 LEU HA A 109 LEU HBx 1.0 1.8 3.4 1366 1167 A 109 LEU HA A 109 LEU HBy 1.0 1.8 3.6 1367 1168 A 109 LEU HA A 109 LEU HG 1.0 1.9 4.5 1368 1169 A 111 TYR HD% A 109 LEU HA 1.0 2.0 6.0 1369 1170 A 111 TYR HE% A 109 LEU HA 1.0 1.8 6.0 1370 1171 A 37 ILE HA A 109 LEU HBx 1.0 2.0 6.0 1371 1172 A 109 LEU HBx A 109 LEU HBy 1.0 1.4 2.2 1372 1173 A 109 LEU HD1% A 109 LEU HBx 1.0 1.7 3.3 1373 1174 A 109 LEU HD2% A 109 LEU HBx 1.0 1.9 4.9 1374 1175 A 109 LEU HBx A 109 LEU HG 1.0 1.8 3.4 1375 1176 A 111 TYR HD% A 109 LEU HBx 1.0 1.7 3.1 1376 1177 A 111 TYR HE% A 109 LEU HBx 1.0 1.8 3.6 1377 1178 A 109 LEU HD1% A 109 LEU HBy 1.0 1.8 4.0 1378 1179 A 109 LEU HD2% A 109 LEU HBy 1.0 1.9 4.3 1379 1180 A 111 TYR HD% A 109 LEU HBy 1.0 2.0 6.0 1380 1181 A 111 TYR HE% A 109 LEU HBy 1.0 1.9 4.7 1381 1182 A 84 LYS HG3 A 84 LYS HBx 1.0 1.5 2.5 1382 1182 A 84 LYS HD3 A 84 LYS HG3 1.0 1.5 2.5 1383 1182 A 84 LYS HG2 A 84 LYS HBx 1.0 1.5 2.5 1384 1182 A 84 LYS HD2 A 84 LYS HG3 1.0 1.5 2.5 1385 1182 A 84 LYS HD3 A 84 LYS HG2 1.0 1.5 2.5 1386 1182 A 84 LYS HD2 A 84 LYS HG2 1.0 1.5 2.5 1387 1183 A 34 PHE HBx A 109 LEU HD1% 1.0 0.0 6.0 1388 1184 A 34 PHE HD% A 109 LEU HD1% 1.0 1.9 4.1 1389 1185 A 34 PHE HE% A 109 LEU HD1% 1.0 2.0 5.6 1390 1186 A 109 LEU HD1% A 108 ASN HA 1.0 0.0 6.0 1391 1187 A 109 LEU HD1% A 109 LEU HA 1.0 1.8 3.8 1392 1188 A 109 LEU HD1% A 109 LEU HG 1.0 1.6 2.8 1393 1189 A 109 LEU HD1% A 111 TYR HA 1.0 2.0 5.8 1394 1190 A 111 TYR HD% A 109 LEU HD1% 1.0 1.8 3.8 1395 1191 A 111 TYR HE% A 109 LEU HD1% 1.0 1.7 3.3 1396 1192 A 109 LEU HD2% A 34 PHE HD% 1.0 2.0 5.8 1397 1193 A 109 LEU HD2% A 37 ILE HA 1.0 1.9 4.1 1398 1194 A 109 LEU HD2% A 37 ILE HB 1.0 0.0 6.0 1399 1195 A 109 LEU HD2% A 109 LEU HA 1.0 1.5 2.5 1400 1196 A 109 LEU HD2% A 109 LEU HD1% 1.0 1.6 2.6 1401 1197 A 109 LEU HD2% A 109 LEU HG 1.0 1.6 2.8 1402 1198 A 109 LEU HD2% A 111 TYR HD% 1.0 2.0 6.0 1403 1199 A 111 TYR HD% A 109 LEU HG 1.0 1.9 6.0 1404 1200 A 111 TYR HE% A 109 LEU HG 1.0 2.0 5.2 1405 1201 A 38 PHE HBy A 110 ALA HA 1.0 1.8 3.6 1406 1202 A 38 PHE HBx A 110 ALA HA 1.0 1.7 3.3 1407 1203 A 110 ALA HA A 80 PHE HE% 1.0 2.0 6.0 1408 1204 A 36 LYS HEx A 110 ALA HB% 1.0 1.9 4.1 1409 1205 A 110 ALA HB% B 5 U H1' 1.0 2.0 6.0 1410 1206 A 36 LYS HBx A 110 ALA HB% 1.0 1.7 3.3 1411 1207 A 36 LYS HBy A 110 ALA HB% 1.0 2.0 5.8 1412 1208 A 38 PHE HBy A 110 ALA HB% 1.0 1.9 4.3 1413 1209 A 110 ALA HB% A 80 PHE HBy 1.0 0.0 6.0 1414 1210 A 110 ALA HB% A 80 PHE HE% 1.0 1.9 4.3 1415 1211 A 110 ALA HB% A 110 ALA HA 1.0 1.6 2.8 1416 1212 A 111 TYR HE% A 110 ALA HB% 1.0 2.0 6.0 1417 1213 A 110 ALA HB% A 111 TYR HA 1.0 2.0 5.6 1418 1214 A 111 TYR HBx A 111 TYR HA 1.0 1.7 3.3 1419 1215 A 111 TYR HBy A 111 TYR HA 1.0 1.6 2.8 1420 1216 A 111 TYR HBx A 33 MET HA 1.0 1.9 4.5 1421 1217 A 111 TYR HBx A 33 MET HGx 1.0 2.0 6.0 1422 1218 A 111 TYR HBx A 111 TYR HBy 1.0 1.5 2.3 1423 1219 A 111 TYR HBx A 111 TYR HD% 1.0 1.8 3.6 1424 1220 A 111 TYR HBx A 111 TYR HE% 1.0 2.0 6.0 1425 1221 A 111 TYR HBx A 114 ALA HB% 1.0 1.8 6.0 1426 1222 A 33 MET HA A 111 TYR HBy 1.0 2.0 5.4 1427 1223 A 111 TYR HBy A 33 MET HGx 1.0 2.0 5.4 1428 1224 A 33 MET HGy A 111 TYR HBy 1.0 2.0 6.0 1429 1225 A 111 TYR HBy A 111 TYR HD% 1.0 1.7 3.1 1430 1226 A 111 TYR HBy A 111 TYR HE% 1.0 2.0 6.0 1431 1227 A 33 MET HA A 111 TYR HD% 1.0 2.0 5.6 1432 1228 A 111 TYR HD% A 111 TYR HA 1.0 2.0 5.0 1433 1229 A 111 TYR HD% A 111 TYR HE% 1.0 1.6 2.6 1434 1230 A 111 TYR HD% A 112 LEU HBy 1.0 2.0 6.0 1435 1231 A 111 TYR HD% A 112 LEU HBx 1.0 2.0 5.4 1436 1232 A 33 MET HGy A 111 TYR HE% 1.0 2.0 5.0 1437 1233 A 34 PHE HD% A 111 TYR HE% 1.0 1.9 4.3 1438 1234 A 34 PHE HE% A 111 TYR HE% 1.0 1.9 4.3 1439 1235 A 111 TYR HE% A 34 PHE HZ 1.0 2.0 5.8 1440 1236 A 109 LEU HD2% A 111 TYR HE% 1.0 1.8 4.0 1441 1237 A 111 TYR HE% A 112 LEU HA 1.0 2.0 6.0 1442 1238 A 111 TYR HD% A 112 LEU HA 1.0 1.9 5.1 1443 1239 A 112 LEU HBy A 112 LEU HA 1.0 1.8 3.4 1444 1240 A 112 LEU HBx A 112 LEU HA 1.0 1.8 3.8 1445 1241 A 112 LEU HD1% A 112 LEU HA 1.0 2.0 6.0 1446 1242 A 112 LEU HA A 112 LEU HG 1.0 1.9 4.1 1447 1243 A 112 LEU HBy A 112 LEU HBx 1.0 1.4 2.2 1448 1244 A 112 LEU HBy A 112 LEU HG 1.0 1.9 4.1 1449 1245 A 112 LEU HBx A 112 LEU HG 1.0 1.8 3.6 1450 1246 A 112 LEU HD1% A 112 LEU HD2% 1.0 1.7 3.1 1451 1247 A 112 LEU HD1% A 109 LEU HBx 1.0 1.8 4.2 1452 1248 A 112 LEU HD1% A 109 LEU HBy 1.0 1.8 3.6 1453 1249 A 112 LEU HD1% A 109 LEU HG 1.0 0.0 6.0 1454 1250 A 112 LEU HD1% A 111 TYR HD% 1.0 2.0 6.0 1455 1251 A 112 LEU HD1% A 111 TYR HE% 1.0 2.0 5.0 1456 1252 A 112 LEU HD1% A 112 LEU HBy 1.0 1.7 3.1 1457 1253 A 112 LEU HD1% A 112 LEU HBx 1.0 1.6 3.0 1458 1254 A 112 LEU HD1% A 112 LEU HG 1.0 1.6 2.8 1459 1255 A 111 TYR HD% A 112 LEU HD2% 1.0 1.9 4.9 1460 1256 A 111 TYR HE% A 112 LEU HD2% 1.0 1.8 3.4 1461 1257 A 112 LEU HA A 112 LEU HD2% 1.0 1.6 2.6 1462 1258 A 112 LEU HBy A 112 LEU HD2% 1.0 1.6 3.0 1463 1259 A 112 LEU HBx A 112 LEU HD2% 1.0 1.8 4.0 1464 1260 A 109 LEU HBx A 112 LEU HG 1.0 1.9 4.7 1465 1261 A 109 LEU HBy A 112 LEU HG 1.0 1.9 4.9 1466 1262 A 111 TYR HD% A 112 LEU HG 1.0 2.0 5.2 1467 1263 A 111 TYR HE% A 112 LEU HG 1.0 1.9 4.5 1468 1264 A 113 GLY HAy A 113 GLY HAx 1.0 1.5 2.5 1469 1265 B 5 U H1' A 113 GLY HAx 1.0 2.0 6.0 1470 1266 B 5 U H1' A 114 ALA HA 1.0 2.0 5.4 1471 1267 A 114 ALA HA B 5 U H2' 1.0 2.0 5.0 1472 1268 A 114 ALA HA A 115 LYS HE3 1.0 2.0 6.0 1473 1268 A 114 ALA HA A 115 LYS HE2 1.0 2.0 6.0 1474 1269 B 5 U H1' A 114 ALA HB% 1.0 2.0 5.6 1475 1270 A 114 ALA HB% B 5 U H2' 1.0 2.0 6.0 1476 1271 A 111 TYR HA A 114 ALA HB% 1.0 1.7 2.9 1477 1272 A 111 TYR HBy A 114 ALA HB% 1.0 2.0 5.6 1478 1273 A 114 ALA HB% A 114 ALA HA 1.0 1.6 2.6 1479 1274 A 115 LYS HA A 119 ASN HBx 1.0 2.0 6.0 1480 1275 A 115 LYS HBy A 115 LYS HA 1.0 1.7 3.1 1481 1276 A 115 LYS HBx A 115 LYS HA 1.0 1.8 3.6 1482 1277 A 116 PRO HDy A 115 LYS HA 1.0 1.5 2.7 1483 1278 A 115 LYS HA A 116 PRO HDx 1.0 1.5 2.7 1484 1279 A 115 LYS HA A 116 PRO HG3 1.0 2.0 6.0 1485 1279 A 115 LYS HA A 116 PRO HG2 1.0 2.0 6.0 1486 1280 B 5 U H1' A 115 LYS HBx 1.0 0.0 6.0 1487 1280 A 115 LYS HBx B 5 U H4' 1.0 0.0 6.0 1488 1280 A 115 LYS HBx B 5 U H2' 1.0 0.0 6.0 1489 1280 A 115 LYS HBx B 5 U H3' 1.0 0.0 6.0 1490 1281 A 113 GLY HAx A 115 LYS HE3 1.0 0.0 6.0 1491 1281 A 113 GLY HAx A 115 LYS HE2 1.0 0.0 6.0 1492 1282 A 115 LYS HGx A 115 LYS HA 1.0 1.9 4.3 1493 1283 A 115 LYS HA A 115 LYS HGy 1.0 1.8 3.8 1494 1284 A 116 PRO HA A 116 PRO HBy 1.0 1.7 3.1 1495 1285 A 116 PRO HA A 116 PRO HBx 1.0 1.9 4.7 1496 1286 A 116 PRO HA A 117 ARG HBx 1.0 0.0 6.0 1497 1287 A 116 PRO HA A 117 ARG HGx 1.0 1.9 6.0 1498 1287 A 116 PRO HA A 117 ARG HGy 1.0 1.9 6.0 1499 1288 A 116 PRO HBy A 116 PRO HBx 1.0 1.5 2.3 1500 1289 A 116 PRO HDy A 116 PRO HBy 1.0 1.9 4.7 1501 1290 A 116 PRO HDy A 116 PRO HDx 1.0 1.3 2.2 1502 1291 A 116 PRO HDy A 116 PRO HG2 1.0 1.8 4.0 1503 1292 A 116 PRO HDy A 117 ARG HBx 1.0 2.0 6.0 1504 1293 A 115 LYS HBy A 116 PRO HDx 1.0 1.9 4.7 1505 1294 A 115 LYS HBx A 116 PRO HDx 1.0 2.0 5.8 1506 1295 A 116 PRO HDx A 116 PRO HBy 1.0 2.0 6.0 1507 1296 A 116 PRO HDx A 116 PRO HG3 1.0 1.9 3.9 1508 1297 A 116 PRO HDx A 117 ARG HBx 1.0 1.9 4.9 1509 1298 A 116 PRO HG3 A 116 PRO HA 1.0 2.0 5.0 1510 1298 A 116 PRO HG2 A 116 PRO HA 1.0 2.0 5.0 1511 1299 A 116 PRO HG3 A 116 PRO HBy 1.0 1.8 3.4 1512 1299 A 116 PRO HG2 A 116 PRO HBy 1.0 1.8 3.4 1513 1300 A 116 PRO HDy A 116 PRO HG2 1.0 1.6 3.0 1514 1300 A 116 PRO HDy A 116 PRO HG3 1.0 1.6 3.0 1515 1301 A 116 PRO HDx A 116 PRO HG3 1.0 1.6 3.0 1516 1301 A 116 PRO HDx A 116 PRO HG2 1.0 1.6 3.0 1517 1302 A 116 PRO HG3 A 117 ARG HBx 1.0 0.0 6.0 1518 1302 A 116 PRO HG2 A 117 ARG HBx 1.0 0.0 6.0 1519 1303 A 117 ARG HBy A 117 ARG HD2 1.0 1.8 3.6 1520 1303 A 117 ARG HBy A 117 ARG HD3 1.0 1.8 3.6 1521 1304 A 117 ARG HBx A 117 ARG HD2 1.0 1.7 3.1 1522 1304 A 117 ARG HBx A 117 ARG HD3 1.0 1.7 3.1 1523 1305 A 117 ARG HA A 117 ARG HD2 1.0 2.0 4.6 1524 1305 A 117 ARG HA A 117 ARG HD3 1.0 2.0 4.6 1525 1306 A 118 THR HG2% A 117 ARG HGy 1.0 1.7 3.1 1526 1307 A 119 ASN HBx A 119 ASN HA 1.0 2.0 5.4 1527 1308 A 119 ASN HA A 119 ASN HBy 1.0 1.9 4.3 1528 1309 A 120 VAL HB A 120 VAL HG1% 1.0 1.9 4.3 1529 1309 A 120 VAL HB A 120 VAL HG2% 1.0 1.9 4.3 1530 1310 B 5 U H1' B 6 G H8 1.0 2.0 6.0 1531 1311 B 1 G H2' B 1 G H1' 1.0 1.9 4.3 1532 1312 B 1 G H1' B 1 G H3' 1.0 2.0 6.0 1533 1313 B 1 G H1' B 1 G H4' 1.0 1.9 4.7 1534 1314 B 1 G H1' B 1 G H5'' 1.0 2.0 6.0 1535 1315 B 2 G H2' B 2 G H1' 1.0 1.9 4.5 1536 1316 B 2 G H1' B 2 G H4' 1.0 1.9 5.1 1537 1317 B 2 G H8 B 1 G H2' 1.0 2.0 5.6 1538 1318 B 2 G H8 B 2 G H1' 1.0 1.9 4.5 1539 1319 B 2 G H8 B 2 G H2' 1.0 1.8 3.8 1540 1320 B 2 G H8 B 2 G H3' 1.0 2.0 5.8 1541 1321 B 2 G H8 B 2 G H4' 1.0 1.9 6.0 1542 1322 B 2 G H8 B 2 G H5' 1.0 2.0 5.8 1543 1322 B 2 G H8 B 2 G H5'' 1.0 2.0 5.8 1544 1323 B 3 U H2' B 3 U H1' 1.0 2.0 5.4 1545 1324 B 3 U H1' B 3 U H4' 1.0 2.0 6.0 1546 1325 B 3 U H2' B 3 U H5 1.0 1.9 6.0 1547 1326 B 3 U H1' B 3 U H6 1.0 2.0 5.8 1548 1327 B 3 U H2' B 3 U H6 1.0 1.7 2.9 1549 1328 B 3 U H6 B 3 U H3' 1.0 2.0 6.0 1550 1329 B 3 U H4' B 3 U H6 1.0 2.0 6.0 1551 1330 B 3 U H5 B 3 U H6 1.0 1.7 3.3 1552 1331 B 3 U H6 B 3 U H5' 1.0 2.0 6.0 1553 1332 B 4 G H1' B 4 G H2' 1.0 1.9 4.1 1554 1333 B 4 G H1' B 4 G H4' 1.0 2.0 4.6 1555 1334 B 4 G H1' B 4 G H8 1.0 1.8 3.6 1556 1335 B 5 U H1' B 5 U H2' 1.0 1.9 4.9 1557 1336 B 5 U H1' B 5 U H3' 1.0 2.0 6.0 1558 1337 B 5 U H1' B 5 U H4' 1.0 1.9 4.9 1559 1338 B 5 U H1' B 5 U H6 1.0 1.9 4.5 1560 1339 B 5 U H6 B 5 U H2' 1.0 1.9 3.9 1561 1340 B 5 U H6 B 5 U H3' 1.0 1.9 6.0 1562 1341 B 5 U H6 B 5 U H5 1.0 1.8 3.8 1563 1342 B 6 G H1' B 6 G H2' 1.0 1.9 4.5 1564 1343 B 6 G H1' B 6 G H8 1.0 2.0 4.8 1565 1344 B 6 G H8 B 6 G H2' 1.0 1.7 3.1 1566 1345 B 6 G H8 B 6 G H5' 1.0 2.0 5.6 1567 1345 B 6 G H8 B 6 G H5'' 1.0 2.0 5.6 1568 1346 B 6 G H8 B 7 C H5 1.0 2.0 5.6 1569 1347 B 7 C H2' B 7 C H1' 1.0 1.8 3.6 1570 1348 B 7 C H5 B 7 C H2' 1.0 2.0 6.0 1571 1349 B 7 C H5 B 7 C H6 1.0 1.7 3.1 1572 1350 B 7 C H1' B 7 C H6 1.0 1.9 4.7 1573 1351 B 7 C H2' B 7 C H6 1.0 1.5 2.5 1574 1352 B 7 C H6 B 7 C H3' 1.0 2.0 5.8 1575 1353 B 7 C H6 B 7 C H5'' 1.0 1.8 3.8 1576 1354 A 41 GLY HAx B 3 U H6 1.0 0.0 6.0 1577 1355 A 67 ILE HG2% B 6 G H8 1.0 2.0 6.0 1578 1356 A 80 PHE HE% B 6 G H8 1.0 2.0 5.6 1579 1357 A 84 LYS HBy A 83 MET HBx 1.0 0.0 6.0 1580 1357 A 49 LYS HBx A 53 GLU HBy 1.0 0.0 6.0 1581 1358 A 75 SER HBx A 68 THR HA 1.0 2.0 4.8 1582 1358 A 65 VAL HA A 67 ILE HA 1.0 2.0 4.8 1583 1358 A 48 ASP HA A 65 VAL HA 1.0 2.0 4.8 1584 1358 A 67 ILE HA A 68 THR HA 1.0 2.0 4.8 1585 1359 A 56 GLU HGx A 57 GLN HA 1.0 1.9 4.5 1586 1359 A 56 GLU HGx A 53 GLU HA 1.0 1.9 4.5 1587 1360 A 98 PRO HBx A 51 LEU HA 1.0 0.0 6.0 1588 1360 A 104 LYS HA A 98 PRO HBx 1.0 0.0 6.0 1589 1361 A 35 THR HA A 83 MET HBx 1.0 1.6 2.8 1590 1361 A 116 PRO HA A 116 PRO HBy 1.0 1.6 2.8 1591 1362 A 49 LYS HA A 53 GLU HBx 1.0 2.0 5.4 1592 1362 A 53 GLU HBx A 50 THR HA 1.0 2.0 5.4 1593 1363 A 49 LYS HA A 53 GLU HBy 1.0 1.7 3.1 1594 1363 A 50 THR HA A 53 GLU HBy 1.0 1.7 3.1 1595 1364 A 90 GLU HA A 90 GLU HBy 1.0 1.6 3.0 1596 1364 A 53 GLU HBx A 53 GLU HA 1.0 1.6 3.0 1597 1365 A 49 LYS HBx A 47 SER HBx 1.0 1.8 3.6 1598 1365 A 91 ARG HA A 94 LYS HBy 1.0 1.8 3.6 1599 1366 A 99 ILE HG1x A 104 LYS HA 1.0 2.0 5.0 1600 1366 A 67 ILE HG1x A 67 ILE HA 1.0 2.0 5.0 1601 1367 A 115 LYS HGx A 118 THR HA 1.0 0.0 6.0 1602 1367 A 115 LYS HGx A 113 GLY HAy 1.0 0.0 6.0 1603 1368 A 49 LYS HGy A 47 SER HBy 1.0 1.7 3.1 1604 1368 A 49 LYS HGy A 50 THR HB 1.0 1.7 3.1 1605 1368 A 47 SER HBy A 49 LYS HGx 1.0 1.7 3.1 1606 1368 A 50 THR HB A 49 LYS HGx 1.0 1.7 3.1 1607 1369 A 49 LYS HA A 46 THR HG2% 1.0 2.0 5.2 1608 1369 A 46 THR HG2% A 77 GLY HAy 1.0 2.0 5.2 1609 1369 A 46 THR HG2% A 50 THR HA 1.0 2.0 5.2 1610 1369 A 46 THR HG2% A 51 LEU HA 1.0 2.0 5.2 1611 1370 A 79 GLY HAy A 42 LEU HD2% 1.0 2.0 6.0 1612 1370 A 42 LEU HD2% A 41 GLY HAx 1.0 2.0 6.0 1613 1371 A 109 LEU HD2% A 108 ASN HA 1.0 0.0 6.0 1614 1371 A 109 LEU HD2% A 34 PHE HA 1.0 0.0 6.0 1615 1372 A 82 THR HG2% A 32 THR HB 1.0 1.8 3.6 1616 1372 A 82 THR HG2% A 35 THR HB 1.0 1.8 3.6 1617 1373 A 61 ILE HG2% A 82 THR HA 1.0 2.0 4.6 1618 1373 A 61 ILE HG2% A 64 ALA HA 1.0 2.0 4.6 1619 1374 A 72 THR HG2% A 74 LYS HEx 1.0 1.9 3.9 1620 1374 A 72 THR HG2% A 71 ASN HBy 1.0 1.9 3.9 1621 1375 A 72 THR HG2% A 73 GLN HG2 1.0 2.0 5.2 1622 1375 A 72 THR HG2% A 73 GLN HG3 1.0 2.0 5.2 1623 1375 A 82 THR HG2% A 83 MET HBx 1.0 2.0 5.2 1624 1376 A 68 THR HG2% A 73 GLN HB2 1.0 1.9 4.3 1625 1376 A 63 GLU HGx A 65 VAL HG2% 1.0 1.9 4.3 1626 1376 A 68 THR HG2% A 73 GLN HB3 1.0 1.9 4.3 1627 1377 A 115 LYS HGx A 119 ASN HBy 1.0 1.9 3.9 1628 1377 A 36 LYS HG2 A 36 LYS HEy 1.0 1.9 3.9 1629 1378 A 30 ARG HD3 A 30 ARG HGy 1.0 1.6 3.0 1630 1378 A 30 ARG HD2 A 30 ARG HGy 1.0 1.6 3.0 1631 1378 A 30 ARG HGx A 30 ARG HD2 1.0 1.6 3.0 1632 1378 A 117 ARG HGx A 117 ARG HD3 1.0 1.6 3.0 1633 1378 A 117 ARG HGx A 117 ARG HD2 1.0 1.6 3.0 1634 1378 A 30 ARG HGx A 30 ARG HD3 1.0 1.6 3.0 1635 1379 A 53 GLU HGx A 49 LYS HD3 1.0 1.9 4.9 1636 1379 A 53 GLU HGx A 49 LYS HD2 1.0 1.9 4.9 1637 1379 A 91 ARG HGx A 90 GLU HBx 1.0 1.9 4.9 1638 1379 A 53 GLU HBy A 49 LYS HD2 1.0 1.9 4.9 1639 1380 A 84 LYS HD2 A 84 LYS HE3 1.0 1.5 2.7 1640 1380 A 49 LYS HD3 A 49 LYS HEx 1.0 1.5 2.7 1641 1380 A 84 LYS HD3 A 84 LYS HE3 1.0 1.5 2.7 1642 1380 A 49 LYS HD2 A 49 LYS HEx 1.0 1.5 2.7 1643 1380 A 84 LYS HD3 A 84 LYS HE2 1.0 1.5 2.7 1644 1380 A 84 LYS HD2 A 84 LYS HE2 1.0 1.5 2.7 1645 1380 A 49 LYS HD3 A 49 LYS HEy 1.0 1.5 2.7 1646 1380 A 49 LYS HD2 A 49 LYS HEy 1.0 1.5 2.7 1647 1381 A 86 ARG HBx A 85 ASP HBy 1.0 1.8 3.6 1648 1381 A 86 ARG HBx A 86 ARG HDy 1.0 1.8 3.6 1649 1381 A 86 ARG HDy A 86 ARG HBy 1.0 1.8 3.6 1650 1382 A 86 ARG HBx A 85 ASP HBy 1.0 1.9 3.9 1651 1382 A 86 ARG HBx A 86 ARG HDx 1.0 1.9 3.9 1652 1382 A 86 ARG HBy A 86 ARG HDx 1.0 1.9 3.9 1653 1383 A 84 LYS HD3 A 30 ARG HD3 1.0 0.0 6.0 1654 1383 A 84 LYS HD3 A 30 ARG HD2 1.0 0.0 6.0 1655 1383 A 84 LYS HD2 A 30 ARG HD2 1.0 0.0 6.0 1656 1383 A 84 LYS HD2 A 30 ARG HD3 1.0 0.0 6.0 1657 1383 A 55 PHE HBy A 49 LYS HD2 1.0 0.0 6.0 1658 1383 A 55 PHE HBy A 49 LYS HD3 1.0 0.0 6.0 1659 1384 A 91 ARG HBy A 37 ILE HG1y 1.0 0.0 6.0 1660 1384 A 36 LYS HEx A 37 ILE HG1y 1.0 0.0 6.0 1661 1384 A 76 ARG HGy A 73 GLN HG2 1.0 0.0 6.0 1662 1384 A 76 ARG HGy A 73 GLN HG3 1.0 0.0 6.0 1663 1385 A 76 ARG HGy A 78 TYR HBx 1.0 1.9 4.9 1664 1385 A 76 ARG HGy A 69 ASP HBx 1.0 1.9 4.9 1665 1386 A 121 GLN HBy A 121 GLN HG2 1.0 1.4 2.2 1666 1386 A 121 GLN HBy A 121 GLN HG3 1.0 1.4 2.2 1667 1386 A 53 GLU HBx A 53 GLU HBy 1.0 1.4 2.2 1668 1387 A 97 ASN HBy A 104 LYS HBy 1.0 2.0 5.8 1669 1387 A 115 LYS HBx A 119 ASN HBx 1.0 2.0 5.8 1670 1388 A 43 PRO HBy A 101 ASP HBx 1.0 1.7 3.1 1671 1388 A 43 PRO HBy A 43 PRO HGy 1.0 1.7 3.1 1672 1389 A 30 ARG HBy A 30 ARG HD2 1.0 1.8 3.6 1673 1389 A 30 ARG HBy A 30 ARG HD3 1.0 1.8 3.6 1674 1389 A 117 ARG HBy A 117 ARG HD2 1.0 1.8 3.6 1675 1389 A 117 ARG HBy A 117 ARG HD3 1.0 1.8 3.6 1676 1390 A 84 LYS HE3 A 62 GLU HG3 1.0 1.8 3.6 1677 1390 A 108 ASN HBy A 109 LEU HG 1.0 1.8 3.6 1678 1390 A 90 GLU HBy A 94 LYS HE3 1.0 1.8 3.6 1679 1390 A 90 GLU HBy A 94 LYS HE2 1.0 1.8 3.6 1680 1390 A 91 ARG HBx A 94 LYS HE2 1.0 1.8 3.6 1681 1390 A 91 ARG HGy A 94 LYS HE2 1.0 1.8 3.6 1682 1390 A 91 ARG HGy A 94 LYS HE3 1.0 1.8 3.6 1683 1390 A 84 LYS HE2 A 62 GLU HG3 1.0 1.8 3.6 1684 1390 A 62 GLU HG2 A 84 LYS HE2 1.0 1.8 3.6 1685 1390 A 91 ARG HBx A 94 LYS HE3 1.0 1.8 3.6 1686 1390 A 62 GLU HG2 A 84 LYS HE3 1.0 1.8 3.6 1687 1391 A 94 LYS HD2 A 94 LYS HE2 1.0 1.8 3.6 1688 1391 A 94 LYS HBx A 94 LYS HE2 1.0 1.8 3.6 1689 1391 A 94 LYS HD2 A 94 LYS HE3 1.0 1.8 3.6 1690 1391 A 49 LYS HBy A 49 LYS HEy 1.0 1.8 3.6 1691 1391 A 115 LYS HBy A 115 LYS HE2 1.0 1.8 3.6 1692 1391 A 94 LYS HBx A 94 LYS HE3 1.0 1.8 3.6 1693 1392 A 115 LYS HE3 A 115 LYS HGy 1.0 1.9 4.1 1694 1392 A 94 LYS HGx A 94 LYS HE2 1.0 1.9 4.1 1695 1392 A 94 LYS HGx A 94 LYS HE3 1.0 1.9 4.1 1696 1392 A 115 LYS HE2 A 115 LYS HGy 1.0 1.9 4.1 1697 1393 A 49 LYS HGx A 49 LYS HEy 1.0 1.9 4.1 1698 1393 A 49 LYS HGx A 49 LYS HEx 1.0 1.9 4.1 1699 1393 A 115 LYS HE3 A 115 LYS HGy 1.0 1.9 4.1 1700 1393 A 115 LYS HE2 A 115 LYS HGy 1.0 1.9 4.1 1701 1394 A 49 LYS HGx A 49 LYS HEy 1.0 1.9 4.1 1702 1394 A 115 LYS HGx A 115 LYS HE3 1.0 1.9 4.1 1703 1394 A 49 LYS HGx A 49 LYS HEx 1.0 1.9 4.1 1704 1394 A 115 LYS HGx A 115 LYS HE2 1.0 1.9 4.1 1705 1395 A 84 LYS HD3 A 84 LYS HE2 1.0 1.5 2.5 1706 1395 A 84 LYS HD2 A 84 LYS HE3 1.0 1.5 2.5 1707 1395 A 49 LYS HD3 A 49 LYS HEy 1.0 1.5 2.5 1708 1395 A 115 LYS HE3 A 115 LYS HD2 1.0 1.5 2.5 1709 1395 A 84 LYS HD3 A 84 LYS HE3 1.0 1.5 2.5 1710 1395 A 115 LYS HE3 A 115 LYS HD3 1.0 1.5 2.5 1711 1395 A 94 LYS HD2 A 94 LYS HE3 1.0 1.5 2.5 1712 1395 A 49 LYS HD2 A 49 LYS HEy 1.0 1.5 2.5 1713 1395 A 49 LYS HD2 A 49 LYS HEx 1.0 1.5 2.5 1714 1395 A 94 LYS HD2 A 94 LYS HE2 1.0 1.5 2.5 1715 1395 A 115 LYS HE2 A 115 LYS HD3 1.0 1.5 2.5 1716 1395 A 84 LYS HD2 A 84 LYS HE2 1.0 1.5 2.5 1717 1395 A 115 LYS HE2 A 115 LYS HD2 1.0 1.5 2.5 1718 1395 A 49 LYS HD3 A 49 LYS HEx 1.0 1.5 2.5 1719 1396 A 108 ASN HBx A 112 LEU HBx 1.0 1.8 4.2 1720 1396 A 36 LYS HEy A 114 ALA HB% 1.0 1.8 4.2 1721 1396 A 105 ALA HB% A 97 ASN HBy 1.0 1.8 4.2 1722 1396 A 104 LYS HG3 A 97 ASN HBy 1.0 1.8 4.2 1723 1396 A 104 LYS HG2 A 97 ASN HBy 1.0 1.8 4.2 1724 1397 A 49 LYS HGy A 49 LYS HBy 1.0 1.7 3.5 1725 1397 A 84 LYS HG3 A 84 LYS HBx 1.0 1.7 3.5 1726 1397 A 84 LYS HG2 A 84 LYS HBx 1.0 1.7 3.5 1727 1398 A 62 GLU HBy A 81 VAL HG1% 1.0 1.9 6.0 1728 1398 A 62 GLU HBy A 61 ILE HG2% 1.0 1.9 6.0 1729 1399 A 94 LYS HD2 A 94 LYS HGy 1.0 1.4 2.2 1730 1399 A 103 ARG HGy A 103 ARG HBy 1.0 1.4 2.2 1731 1399 A 94 LYS HD2 A 94 LYS HGx 1.0 1.4 2.2 1732 1399 A 76 ARG HGx A 76 ARG HGy 1.0 1.4 2.2 1733 1400 A 42 LEU HG A 39 VAL HG2% 1.0 1.9 4.9 1734 1400 A 42 LEU HG A 66 VAL HG2% 1.0 1.9 4.9 1735 1400 A 42 LEU HG A 51 LEU HD1% 1.0 1.9 4.9 1736 1401 A 115 LYS HGx A 120 VAL HG1% 1.0 2.0 5.4 1737 1401 A 51 LEU HG A 49 LYS HGx 1.0 2.0 5.4 1738 1401 A 49 LYS HGy A 51 LEU HG 1.0 2.0 5.4 1739 1401 A 51 LEU HD2% A 49 LYS HGx 1.0 2.0 5.4 1740 1401 A 115 LYS HGx A 120 VAL HG2% 1.0 2.0 5.4 1741 1401 A 49 LYS HGy A 51 LEU HD2% 1.0 2.0 5.4 1742 1402 A 84 LYS HD3 A 84 LYS HG3 1.0 1.5 2.7 1743 1402 A 49 LYS HGy A 49 LYS HD2 1.0 1.5 2.7 1744 1402 A 84 LYS HD2 A 84 LYS HG3 1.0 1.5 2.7 1745 1402 A 84 LYS HD3 A 84 LYS HG2 1.0 1.5 2.7 1746 1402 A 49 LYS HGy A 49 LYS HD3 1.0 1.5 2.7 1747 1402 A 84 LYS HD2 A 84 LYS HG2 1.0 1.5 2.7 1748 1403 A 61 ILE HG2% A 49 LYS HD3 1.0 0.0 6.0 1749 1403 A 91 ARG HGx A 37 ILE HG1x 1.0 0.0 6.0 1750 1403 A 51 LEU HD1% A 49 LYS HD3 1.0 0.0 6.0 1751 1403 A 61 ILE HG2% A 49 LYS HD2 1.0 0.0 6.0 1752 1403 A 84 LYS HD2 A 61 ILE HG2% 1.0 0.0 6.0 1753 1403 A 66 VAL HG2% A 49 LYS HD2 1.0 0.0 6.0 1754 1403 A 66 VAL HG2% A 49 LYS HD3 1.0 0.0 6.0 1755 1403 A 51 LEU HD1% A 49 LYS HD2 1.0 0.0 6.0 1756 1403 A 84 LYS HD3 A 61 ILE HG2% 1.0 0.0 6.0 1757 1403 A 84 LYS HD2 A 81 VAL HG1% 1.0 0.0 6.0 1758 1404 A 103 ARG HBx A 104 LYS HD2 1.0 0.0 6.0 1759 1404 A 99 ILE HG1y A 104 LYS HD2 1.0 0.0 6.0 1760 1404 A 99 ILE HG1y A 104 LYS HD3 1.0 0.0 6.0 1761 1405 A 30 ARG HGx A 30 ARG HBx 1.0 1.3 2.2 1762 1405 A 117 ARG HBx A 117 ARG HGy 1.0 1.3 2.2 1763 1405 A 86 ARG HGy A 86 ARG HBx 1.0 1.3 2.2 1764 1405 A 62 GLU HBy A 62 GLU HBx 1.0 1.3 2.2 1765 1405 A 117 ARG HBx A 117 ARG HGx 1.0 1.3 2.2 1766 1406 A 109 LEU HD1% A 112 LEU HD2% 1.0 1.9 5.5 1767 1406 A 109 LEU HD1% A 37 ILE HG1x 1.0 1.9 5.5 1768 1407 A 94 LYS HGy A 107 VAL HB 1.0 2.0 5.6 1769 1407 A 94 LYS HGx A 92 ALA HA 1.0 2.0 5.6 1770 1407 A 94 LYS HGy A 92 ALA HA 1.0 2.0 5.6 1771 1408 A 115 LYS HBy A 115 LYS HGy 1.0 1.7 2.9 1772 1408 A 115 LYS HBy A 115 LYS HGx 1.0 1.7 2.9 1773 1408 A 49 LYS HBy A 49 LYS HGx 1.0 1.7 2.9 1774 1409 A 49 LYS HGy A 49 LYS HBy 1.0 1.7 2.9 1775 1409 A 115 LYS HBy A 115 LYS HGx 1.0 1.7 2.9 1776 1409 A 49 LYS HBy A 49 LYS HGx 1.0 1.7 2.9 1777 1410 A 49 LYS HGy A 49 LYS HBy 1.0 1.7 3.5 1778 1410 A 115 LYS HBy A 115 LYS HGx 1.0 1.7 3.5 1779 1411 A 42 LEU HD2% A 46 THR HG2% 1.0 1.8 3.4 1780 1411 A 42 LEU HD2% A 42 LEU HBy 1.0 1.8 3.4 1781 1412 A 81 VAL HG1% A 35 THR HG2% 1.0 2.0 5.2 1782 1412 A 67 ILE HD1% A 66 VAL HG2% 1.0 2.0 5.2 1783 1413 A 66 VAL HG2% A 100 ILE HG2% 1.0 0.0 6.0 1784 1413 A 66 VAL HG2% A 42 LEU HD1% 1.0 0.0 6.0 1785 1413 A 81 VAL HG1% A 42 LEU HD1% 1.0 0.0 6.0 1786 1414 A 46 THR HG2% A 103 ARG HBy 1.0 2.0 6.0 1787 1414 A 43 PRO HBx A 46 THR HG2% 1.0 2.0 6.0 1788 1415 A 72 THR HG2% A 68 THR HG2% 1.0 0.0 6.0 1789 1415 A 118 THR HG2% A 120 VAL HG1% 1.0 0.0 6.0 1790 1415 A 82 THR HG2% A 36 LYS HG3 1.0 0.0 6.0 1791 1415 A 82 THR HG2% A 61 ILE HG1x 1.0 0.0 6.0 1792 1415 A 118 THR HG2% A 120 VAL HG2% 1.0 0.0 6.0 1793 1415 A 82 THR HG2% A 109 LEU HD2% 1.0 0.0 6.0 1794 1416 A 82 THR HG2% A 89 ALA HB% 1.0 1.9 3.9 1795 1416 A 72 THR HG2% A 74 LYS HD2 1.0 1.9 3.9 1796 1416 A 72 THR HG2% A 74 LYS HD3 1.0 1.9 3.9 1797 1416 A 82 THR HG2% A 36 LYS HDy 1.0 1.9 3.9 1798 1416 A 72 THR HG2% A 74 LYS HBx 1.0 1.9 3.9 1799 1417 A 72 THR HG2% A 74 LYS HBy 1.0 1.9 3.9 1800 1417 A 115 LYS HBy A 118 THR HG2% 1.0 1.9 3.9 1801 1417 A 62 GLU HBy A 82 THR HG2% 1.0 1.9 3.9 1802 1418 A 82 THR HG2% A 83 MET HG3 1.0 0.0 6.0 1803 1418 A 82 THR HG2% A 63 GLU HBx 1.0 0.0 6.0 1804 1419 A 119 ASN HBy A 120 VAL HB 1.0 2.0 4.6 1805 1419 A 119 ASN HBx A 120 VAL HB 1.0 2.0 4.6 1806 1419 A 95 ASP HBy A 98 PRO HBy 1.0 2.0 4.6 1807 1419 A 97 ASN HBy A 98 PRO HBy 1.0 2.0 4.6 1808 1420 A 67 ILE HG1y A 78 TYR HE% 1.0 2.0 5.6 1809 1420 A 67 ILE HG1y A 80 PHE HD% 1.0 2.0 5.6 1810 1421 A 67 ILE HG1x A 78 TYR HE% 1.0 2.0 5.2 1811 1421 A 67 ILE HG1x A 80 PHE HD% 1.0 2.0 5.2 1812 1422 A 43 PRO HBx A 101 ASP HA 1.0 2.0 6.0 1813 1422 A 87 ALA HA A 86 ARG HGy 1.0 2.0 6.0 1814 1423 A 87 ALA HA A 83 MET HE% 1.0 2.0 5.0 1815 1423 A 87 ALA HA A 86 ARG HBy 1.0 2.0 5.0 1816 1423 A 70 ARG HBy A 71 ASN HA 1.0 2.0 5.0 1817 1424 A 84 LYS HBy A 60 ASP HA 1.0 2.0 6.0 1818 1424 A 60 ASP HA A 83 MET HE% 1.0 2.0 6.0 1819 1425 A 83 MET HBy A 62 GLU HA 1.0 1.9 4.5 1820 1425 A 60 ASP HBy A 62 GLU HA 1.0 1.9 4.5 1821 1425 A 56 GLU HA A 56 GLU HGy 1.0 1.9 4.5 1822 1426 A 84 LYS HBy A 62 GLU HA 1.0 2.0 5.0 1823 1426 A 56 GLU HA A 83 MET HE% 1.0 2.0 5.0 1824 1427 A 56 GLU HGy A 53 GLU HA 1.0 1.7 3.5 1825 1427 A 53 GLU HA A 53 GLU HGy 1.0 1.7 3.5 1826 1428 A 94 LYS HD2 A 91 ARG HA 1.0 1.8 3.6 1827 1428 A 91 ARG HGx A 91 ARG HA 1.0 1.8 3.6 1828 1429 A 48 ASP HBy A 52 HIS HA 1.0 2.0 4.8 1829 1429 A 111 TYR HBx A 33 MET HA 1.0 2.0 4.8 1830 1430 A 84 LYS HD2 A 61 ILE HA 1.0 2.0 6.0 1831 1430 A 84 LYS HBx A 61 ILE HA 1.0 2.0 6.0 1832 1430 A 62 GLU HBx A 61 ILE HA 1.0 2.0 6.0 1833 1431 A 53 GLU HBx A 54 TYR HA 1.0 2.0 5.2 1834 1431 A 120 VAL HB A 120 VAL HA 1.0 2.0 5.2 1835 1432 A 33 MET HA A 33 MET HE% 1.0 2.0 6.0 1836 1432 A 61 ILE HG1y A 52 HIS HA 1.0 2.0 6.0 1837 1432 A 61 ILE HB A 52 HIS HA 1.0 2.0 6.0 1838 1433 A 52 HIS HA A 51 LEU HD1% 1.0 1.9 5.1 1839 1433 A 81 VAL HG1% A 52 HIS HA 1.0 1.9 5.1 1840 1433 A 99 ILE HG2% A 100 ILE HA 1.0 1.9 5.1 1841 1434 A 67 ILE HG1y A 67 ILE HA 1.0 1.8 3.4 1842 1434 A 84 LYS HG2 A 84 LYS HA 1.0 1.8 3.4 1843 1434 A 84 LYS HG3 A 84 LYS HA 1.0 1.8 3.4 1844 1435 A 86 ARG HA A 35 THR HG2% 1.0 1.6 2.6 1845 1435 A 67 ILE HD1% A 67 ILE HA 1.0 1.6 2.6 1846 1436 A 39 VAL HG1% A 51 LEU HA 1.0 1.9 6.0 1847 1436 A 42 LEU HD2% A 51 LEU HA 1.0 1.9 6.0 1848 1437 A 46 THR HG2% A 48 ASP HA 1.0 2.0 5.4 1849 1437 A 99 ILE HG1x A 104 LYS HA 1.0 2.0 5.4 1850 1437 A 46 THR HG2% A 51 LEU HA 1.0 2.0 5.4 1851 1438 A 56 GLU HA A 57 GLN HBx 1.0 1.9 4.1 1852 1438 A 56 GLU HA A 61 ILE HB 1.0 1.9 4.1 1853 1438 A 56 GLU HA A 61 ILE HG1y 1.0 1.9 4.1 1854 1439 A 56 GLU HA A 61 ILE HG2% 1.0 2.0 5.4 1855 1439 A 61 ILE HG2% A 62 GLU HA 1.0 2.0 5.4 1856 1440 A 48 ASP HA A 51 LEU HD1% 1.0 1.8 3.8 1857 1440 A 99 ILE HG2% A 104 LYS HA 1.0 1.8 3.8 1858 1440 A 66 VAL HG2% A 48 ASP HA 1.0 1.8 3.8 1859 1440 A 51 LEU HA A 51 LEU HD1% 1.0 1.8 3.8 1860 1441 A 39 VAL HB A 51 LEU HA 1.0 2.0 6.0 1861 1441 A 99 ILE HG1y A 104 LYS HA 1.0 2.0 6.0 1862 1442 A 76 ARG HA A 67 ILE HB 1.0 2.0 5.8 1863 1442 A 63 GLU HA A 65 VAL HG2% 1.0 2.0 5.8 1864 1442 A 61 ILE HG1x A 63 GLU HA 1.0 2.0 5.8 1865 1442 A 76 ARG HA A 67 ILE HG2% 1.0 2.0 5.8 1866 1442 A 65 VAL HG1% A 63 GLU HA 1.0 2.0 5.8 1867 1443 A 34 PHE HD% A 86 ARG HBy 1.0 1.9 5.5 1868 1443 A 55 PHE HE% A 51 LEU HBy 1.0 1.9 5.5 1869 1443 A 37 ILE HB A 55 PHE HE% 1.0 1.9 5.5 1870 1443 A 55 PHE HE% A 92 ALA HA 1.0 1.9 5.5 1871 1443 A 34 PHE HD% A 109 LEU HBy 1.0 1.9 5.5 1872 1443 A 98 PRO HGy A 55 PHE HE% 1.0 1.9 5.5 1873 1444 A 55 PHE HE% A 89 ALA HA 1.0 2.0 6.0 1874 1444 A 55 PHE HE% A 51 LEU HA 1.0 2.0 6.0 1875 1445 A 54 TYR HE% A 58 PHE HD% 1.0 2.0 6.0 1876 1445 A 54 TYR HE% A 55 PHE HE% 1.0 2.0 6.0 1877 1446 A 84 LYS HG3 A 61 ILE HD1% 1.0 2.0 6.0 1878 1446 A 84 LYS HG2 A 61 ILE HD1% 1.0 2.0 6.0 1879 1446 A 61 ILE HD1% A 39 VAL HB 1.0 2.0 6.0 1880 1446 A 61 ILE HD1% A 92 ALA HB% 1.0 2.0 6.0 1881 1447 A 55 PHE HBy A 48 ASP HBy 1.0 0.0 6.0 1882 1447 A 71 ASN HBx A 70 ARG HD3 1.0 0.0 6.0 1883 1447 A 71 ASN HBx A 70 ARG HD2 1.0 0.0 6.0 1884 1448 A 54 TYR HBx A 100 ILE HA 1.0 1.8 6.0 1885 1448 A 55 PHE HBx A 52 HIS HA 1.0 1.8 6.0 1886 1449 A 51 LEU HD2% A 57 GLN HBx 1.0 0.0 6.0 1887 1449 A 61 ILE HG1x A 57 GLN HBy 1.0 0.0 6.0 1888 1449 A 61 ILE HG1x A 57 GLN HBx 1.0 0.0 6.0 1889 1450 A 82 THR HG2% A 62 GLU HG2 1.0 1.8 3.6 1890 1450 A 82 THR HG2% A 62 GLU HG3 1.0 1.8 3.6 1891 1450 A 82 THR HG2% A 36 LYS HBy 1.0 1.8 3.6 1892 1451 A 56 GLU HBx A 58 PHE HD% 1.0 2.0 6.0 1893 1451 A 58 PHE HD% A 91 ARG HGy 1.0 2.0 6.0 1894 1452 A 42 LEU HD2% A 51 LEU HD2% 1.0 1.6 2.8 1895 1452 A 42 LEU HD2% A 42 LEU HBx 1.0 1.6 2.8 1896 1453 A 89 ALA HB% A 33 MET HE% 1.0 0.0 6.0 1897 1453 A 86 ARG HGy A 33 MET HE% 1.0 0.0 6.0 1898 1453 A 33 MET HE% A 110 ALA HB% 1.0 0.0 6.0 1899 1454 A 111 TYR HBx A 34 PHE HBy 1.0 2.0 6.0 1900 1454 A 34 PHE HBy A 86 ARG HDx 1.0 2.0 6.0 1901 1455 A 35 THR HG2% A 85 ASP HBx 1.0 2.0 4.8 1902 1455 A 35 THR HG2% A 34 PHE HBx 1.0 2.0 4.8 1903 1456 A 81 VAL HG1% A 37 ILE HD1% 1.0 1.6 2.6 1904 1456 A 37 ILE HD1% A 37 ILE HG1x 1.0 1.6 2.6 1905 1457 A 37 ILE HD1% A 80 PHE HBx 1.0 2.0 6.0 1906 1457 A 37 ILE HD1% A 36 LYS HEy 1.0 2.0 6.0 1907 1457 A 37 ILE HD1% A 38 PHE HBx 1.0 2.0 6.0 1908 1457 A 37 ILE HD1% A 93 CYS HBx 1.0 2.0 6.0 1909 1458 A 76 ARG HGy A 67 ILE HG2% 1.0 2.0 4.6 1910 1458 A 109 LEU HD2% A 37 ILE HG1y 1.0 2.0 4.6 1911 1459 A 109 LEU HD1% A 37 ILE HG1x 1.0 2.0 4.8 1912 1459 A 37 ILE HG1x A 92 ALA HB% 1.0 2.0 4.8 1913 1460 A 100 ILE HD1% A 37 ILE HG1x 1.0 1.9 6.0 1914 1460 A 37 ILE HG1x A 81 VAL HG2% 1.0 1.9 6.0 1915 1461 A 37 ILE HG2% A 36 LYS HDx 1.0 2.0 6.0 1916 1461 A 37 ILE HG2% A 98 PRO HGx 1.0 2.0 6.0 1917 1461 A 37 ILE HG2% A 89 ALA HB% 1.0 2.0 6.0 1918 1462 A 40 GLY HAy A 42 LEU HBy 1.0 2.0 6.0 1919 1462 A 42 LEU HBy A 51 LEU HA 1.0 2.0 6.0 1920 1462 A 42 LEU HBy A 44 TYR HA 1.0 2.0 6.0 1921 1462 A 42 LEU HBy A 77 GLY HAy 1.0 2.0 6.0 1922 1463 A 41 GLY HAy A 42 LEU HBy 1.0 1.9 4.1 1923 1463 A 43 PRO HDy A 42 LEU HBy 1.0 1.9 4.1 1924 1464 A 42 LEU HD1% A 98 PRO HBx 1.0 2.0 6.0 1925 1464 A 43 PRO HBx A 42 LEU HD1% 1.0 2.0 6.0 1926 1464 A 42 LEU HD1% A 98 PRO HGx 1.0 2.0 6.0 1927 1464 A 42 LEU HD1% A 103 ARG HBy 1.0 2.0 6.0 1928 1465 A 42 LEU HD1% A 41 GLY HAx 1.0 2.0 6.0 1929 1465 A 79 GLY HAy A 42 LEU HD1% 1.0 2.0 6.0 1930 1466 A 104 LYS HA A 43 PRO HGy 1.0 2.0 6.0 1931 1466 A 43 PRO HGy A 46 THR HA 1.0 2.0 6.0 1932 1467 A 43 PRO HGy A 101 ASP HA 1.0 2.0 6.0 1933 1467 A 42 LEU HA A 43 PRO HGy 1.0 2.0 6.0 1934 1468 A 77 GLY HAy A 44 TYR HE% 1.0 2.0 6.0 1935 1468 A 44 TYR HA A 44 TYR HE% 1.0 2.0 6.0 1936 1469 A 46 THR HG2% A 77 GLY HAy 1.0 2.0 5.4 1937 1469 A 46 THR HG2% A 50 THR HA 1.0 2.0 5.4 1938 1469 A 46 THR HG2% A 51 LEU HA 1.0 2.0 5.4 1939 1470 A 46 THR HG2% A 39 VAL HB 1.0 0.0 6.0 1940 1470 A 49 LYS HGy A 46 THR HG2% 1.0 0.0 6.0 1941 1471 A 50 THR HG2% A 98 PRO HBx 1.0 0.0 6.0 1942 1471 A 50 THR HG2% A 103 ARG HBx 1.0 0.0 6.0 1943 1471 A 50 THR HG2% A 57 GLN HBy 1.0 0.0 6.0 1944 1471 A 50 THR HG2% A 57 GLN HGy 1.0 0.0 6.0 1945 1471 A 61 ILE HG1y A 50 THR HG2% 1.0 0.0 6.0 1946 1471 A 50 THR HG2% A 57 GLN HBx 1.0 0.0 6.0 1947 1471 A 50 THR HG2% A 98 PRO HGx 1.0 0.0 6.0 1948 1472 A 61 ILE HB A 51 LEU HBy 1.0 0.0 6.0 1949 1472 A 39 VAL HB A 51 LEU HBy 1.0 0.0 6.0 1950 1473 A 92 ALA HB% A 51 LEU HBx 1.0 0.0 6.0 1951 1473 A 61 ILE HB A 51 LEU HBx 1.0 0.0 6.0 1952 1473 A 39 VAL HB A 51 LEU HBx 1.0 0.0 6.0 1953 1474 A 51 LEU HD1% A 66 VAL HA 1.0 1.9 4.1 1954 1474 A 51 LEU HD1% A 79 GLY HAx 1.0 1.9 4.1 1955 1475 A 66 VAL HG2% A 51 LEU HD1% 1.0 1.6 2.8 1956 1475 A 39 VAL HG2% A 51 LEU HD1% 1.0 1.6 2.8 1957 1475 A 42 LEU HD2% A 51 LEU HD1% 1.0 1.6 2.8 1958 1476 A 51 LEU HD2% A 54 TYR HBx 1.0 2.0 5.4 1959 1476 A 51 LEU HD2% A 55 PHE HBx 1.0 2.0 5.4 1960 1477 A 53 GLU HBx A 51 LEU HD2% 1.0 0.0 6.0 1961 1477 A 51 LEU HD2% A 107 VAL HB 1.0 0.0 6.0 1962 1477 A 43 PRO HBy A 51 LEU HD2% 1.0 0.0 6.0 1963 1477 A 56 GLU HBx A 51 LEU HD2% 1.0 0.0 6.0 1964 1478 A 51 LEU HD2% A 52 HIS HA 1.0 2.0 5.6 1965 1478 A 51 LEU HD2% A 66 VAL HA 1.0 2.0 5.6 1966 1478 A 51 LEU HD2% A 100 ILE HA 1.0 2.0 5.6 1967 1478 A 51 LEU HD2% A 79 GLY HAx 1.0 2.0 5.6 1968 1478 A 43 PRO HDy A 51 LEU HD2% 1.0 2.0 5.6 1969 1478 A 43 PRO HDx A 51 LEU HD2% 1.0 2.0 5.6 1970 1479 A 83 MET HE% A 55 PHE HA 1.0 2.0 5.2 1971 1479 A 83 MET HE% A 58 PHE HA 1.0 2.0 5.2 1972 1479 A 92 ALA HA A 88 SER HA 1.0 2.0 5.2 1973 1479 A 92 ALA HA A 58 PHE HA 1.0 2.0 5.2 1974 1479 A 83 MET HE% A 88 SER HA 1.0 2.0 5.2 1975 1479 A 92 ALA HA A 55 PHE HA 1.0 2.0 5.2 1976 1480 A 61 ILE HB A 55 PHE HA 1.0 2.0 5.6 1977 1480 A 55 PHE HA A 57 GLN HGy 1.0 2.0 5.6 1978 1480 A 94 LYS HGx A 88 SER HA 1.0 2.0 5.6 1979 1480 A 61 ILE HG1y A 55 PHE HA 1.0 2.0 5.6 1980 1480 A 87 ALA HB% A 88 SER HA 1.0 2.0 5.6 1981 1481 A 57 GLN HBy A 58 PHE HA 1.0 1.9 4.3 1982 1481 A 72 THR HB A 74 LYS HD3 1.0 1.9 4.3 1983 1481 A 57 GLN HBx A 58 PHE HA 1.0 1.9 4.3 1984 1481 A 57 GLN HBy A 55 PHE HA 1.0 1.9 4.3 1985 1481 A 57 GLN HBx A 55 PHE HA 1.0 1.9 4.3 1986 1481 A 72 THR HB A 74 LYS HD2 1.0 1.9 4.3 1987 1482 A 56 GLU HA A 57 GLN HBx 1.0 1.9 4.3 1988 1482 A 74 LYS HD2 A 74 LYS HA 1.0 1.9 4.3 1989 1482 A 74 LYS HD3 A 74 LYS HA 1.0 1.9 4.3 1990 1483 A 58 PHE HBy A 91 ARG HGy 1.0 2.0 6.0 1991 1483 A 83 MET HG3 A 58 PHE HBy 1.0 2.0 6.0 1992 1483 A 58 PHE HBy A 91 ARG HBx 1.0 2.0 6.0 1993 1484 A 83 MET HE% A 58 PHE HE% 1.0 2.0 5.8 1994 1484 A 92 ALA HA A 58 PHE HE% 1.0 2.0 5.8 1995 1485 A 61 ILE HD1% A 51 LEU HBy 1.0 1.9 4.5 1996 1485 A 61 ILE HD1% A 83 MET HE% 1.0 1.9 4.5 1997 1486 A 60 ASP HBy A 62 GLU HG3 1.0 1.9 6.0 1998 1486 A 83 MET HBy A 62 GLU HG3 1.0 1.9 6.0 1999 1486 A 62 GLU HG2 A 60 ASP HBx 1.0 1.9 6.0 2000 1486 A 83 MET HBy A 62 GLU HG2 1.0 1.9 6.0 2001 1486 A 83 MET HG2 A 62 GLU HG2 1.0 1.9 6.0 2002 1486 A 60 ASP HBy A 62 GLU HG2 1.0 1.9 6.0 2003 1486 A 62 GLU HG3 A 60 ASP HBx 1.0 1.9 6.0 2004 1487 A 39 VAL HB A 105 ALA HB% 1.0 1.8 3.8 2005 1487 A 105 ALA HB% A 103 ARG HBx 1.0 1.8 3.8 2006 1487 A 61 ILE HB A 64 ALA HB% 1.0 1.8 3.8 2007 1487 A 64 ALA HB% A 39 VAL HB 1.0 1.8 3.8 2008 1488 A 76 ARG HA A 69 ASP HBy 1.0 2.0 6.0 2009 1488 A 76 ARG HA A 76 ARG HDx 1.0 2.0 6.0 2010 1489 A 76 ARG HDy A 78 TYR HBx 1.0 2.0 6.0 2011 1489 A 69 ASP HBx A 76 ARG HDy 1.0 2.0 6.0 2012 1490 A 84 LYS HG3 A 30 ARG HD2 1.0 2.0 4.8 2013 1490 A 84 LYS HG3 A 30 ARG HD3 1.0 2.0 4.8 2014 1490 A 67 ILE HG1y A 76 ARG HDx 1.0 2.0 4.8 2015 1490 A 84 LYS HG2 A 30 ARG HD3 1.0 2.0 4.8 2016 1491 A 81 VAL HG1% A 88 SER HBy 1.0 2.0 5.0 2017 1491 A 66 VAL HG2% A 67 ILE HA 1.0 2.0 5.0 2018 1491 A 81 VAL HG1% A 61 ILE HA 1.0 2.0 5.0 2019 1491 A 81 VAL HG1% A 89 ALA HA 1.0 2.0 5.0 2020 1491 A 66 VAL HG2% A 77 GLY HAy 1.0 2.0 5.0 2021 1491 A 39 VAL HG2% A 110 ALA HA 1.0 2.0 5.0 2022 1491 A 89 ALA HA A 39 VAL HG2% 1.0 2.0 5.0 2023 1491 A 39 VAL HG2% A 40 GLY HAy 1.0 2.0 5.0 2024 1491 A 39 VAL HG2% A 51 LEU HA 1.0 2.0 5.0 2025 1492 A 83 MET HBy A 37 ILE HG1x 1.0 1.9 6.0 2026 1492 A 83 MET HBy A 81 VAL HG1% 1.0 1.9 6.0 2027 1493 A 83 MET HBy A 84 LYS HA 1.0 1.9 4.5 2028 1493 A 83 MET HBy A 89 ALA HA 1.0 1.9 4.5 2029 1493 A 83 MET HBy A 88 SER HBy 1.0 1.9 4.5 2030 1494 A 83 MET HBx A 88 SER HBy 1.0 1.9 5.3 2031 1494 A 86 ARG HA A 83 MET HBx 1.0 1.9 5.3 2032 1494 A 83 MET HBx A 89 ALA HA 1.0 1.9 5.3 2033 1495 A 83 MET HE% A 58 PHE HA 1.0 1.9 5.3 2034 1495 A 83 MET HE% A 88 SER HA 1.0 1.9 5.3 2035 1496 A 35 THR HA A 83 MET HE% 1.0 1.9 4.9 2036 1496 A 56 GLU HA A 83 MET HE% 1.0 1.9 4.9 2037 1497 A 89 ALA HB% A 89 ALA HA 1.0 1.5 2.5 2038 1497 A 86 ARG HA A 89 ALA HB% 1.0 1.5 2.5 2039 1498 A 94 LYS HA A 92 ALA HB% 1.0 2.0 4.8 2040 1498 A 92 ALA HB% A 88 SER HBx 1.0 2.0 4.8 2041 1499 A 104 LYS HBx A 97 ASN HA 1.0 2.0 6.0 2042 1499 A 98 PRO HBx A 97 ASN HA 1.0 2.0 6.0 2043 1499 A 97 ASN HA A 98 PRO HGx 1.0 2.0 6.0 2044 1500 A 104 LYS HA A 100 ILE HD1% 1.0 2.0 5.2 2045 1500 A 100 ILE HD1% A 51 LEU HA 1.0 2.0 5.2 2046 1501 A 99 ILE HG2% A 100 ILE HD1% 1.0 1.9 4.1 2047 1501 A 100 ILE HD1% A 39 VAL HG2% 1.0 1.9 4.1 2048 1501 A 42 LEU HD2% A 100 ILE HD1% 1.0 1.9 4.1 2049 1502 A 100 ILE HG2% A 104 LYS HA 1.0 2.0 4.4 2050 1502 A 100 ILE HG2% A 51 LEU HA 1.0 2.0 4.4 2051 1502 A 100 ILE HG2% A 102 GLY HAy 1.0 2.0 4.4 2052 1503 A 99 ILE HA A 100 ILE HG2% 1.0 2.0 5.8 2053 1503 A 100 ILE HG2% A 101 ASP HA 1.0 2.0 5.8 2054 1504 A 50 THR HG2% A 100 ILE HG2% 1.0 1.6 2.6 2055 1504 A 100 ILE HG2% A 100 ILE HB 1.0 1.6 2.6 2056 1505 A 103 ARG HGy A 43 PRO HA 1.0 1.9 3.9 2057 1505 A 103 ARG HGy A 103 ARG HA 1.0 1.9 3.9 2058 1506 A 48 ASP HA A 51 LEU HBy 1.0 1.7 3.5 2059 1506 A 51 LEU HA A 51 LEU HBy 1.0 1.7 3.5 2060 1507 A 104 LYS HG2 A 104 LYS HA 1.0 1.7 3.3 2061 1507 A 104 LYS HG3 A 104 LYS HA 1.0 1.7 3.3 2062 1507 A 48 ASP HA A 51 LEU HBx 1.0 1.7 3.3 2063 1507 A 51 LEU HA A 51 LEU HBx 1.0 1.7 3.3 2064 1507 A 50 THR HG2% A 51 LEU HA 1.0 1.7 3.3 2065 1507 A 104 LYS HA A 105 ALA HB% 1.0 1.7 3.3 2066 1507 A 64 ALA HB% A 48 ASP HA 1.0 1.7 3.3 2067 1508 A 115 LYS HGx A 115 LYS HE2 1.0 1.8 3.4 2068 1508 A 84 LYS HE3 A 84 LYS HG3 1.0 1.8 3.4 2069 1508 A 49 LYS HGy A 49 LYS HEy 1.0 1.8 3.4 2070 1508 A 84 LYS HE2 A 84 LYS HG3 1.0 1.8 3.4 2071 1508 A 49 LYS HGy A 49 LYS HEx 1.0 1.8 3.4 2072 1508 A 115 LYS HGx A 115 LYS HE3 1.0 1.8 3.4 2073 1508 A 84 LYS HE3 A 84 LYS HG2 1.0 1.8 3.4 2074 1508 A 84 LYS HE2 A 84 LYS HG2 1.0 1.8 3.4 2075 1509 A 37 ILE HG1x A 107 VAL HB 1.0 2.0 6.0 2076 1509 A 39 VAL HG2% A 107 VAL HB 1.0 2.0 6.0 2077 1510 A 107 VAL HG2% A 93 CYS HA 1.0 1.7 3.1 2078 1510 A 37 ILE HA A 107 VAL HG1% 1.0 1.7 3.1 2079 1510 A 107 VAL HG1% A 93 CYS HA 1.0 1.7 3.1 2080 1511 A 107 VAL HG1% A 38 PHE HA 1.0 1.9 4.1 2081 1511 A 107 VAL HG2% A 96 PRO HA 1.0 1.9 4.1 2082 1511 A 107 VAL HG1% A 96 PRO HA 1.0 1.9 4.1 2083 1512 A 107 VAL HG2% A 93 CYS HBx 1.0 2.0 4.8 2084 1512 A 108 ASN HBx A 107 VAL HG2% 1.0 2.0 4.8 2085 1512 A 108 ASN HBx A 107 VAL HG1% 1.0 2.0 4.8 2086 1512 A 107 VAL HG1% A 93 CYS HBx 1.0 2.0 4.8 2087 1512 A 38 PHE HBx A 107 VAL HG1% 1.0 2.0 4.8 2088 1513 A 36 LYS HEx A 107 VAL HG2% 1.0 0.0 6.0 2089 1513 A 36 LYS HEx A 107 VAL HG1% 1.0 0.0 6.0 2090 1513 A 97 ASN HBx A 107 VAL HG1% 1.0 0.0 6.0 2091 1513 A 97 ASN HBx A 107 VAL HG2% 1.0 0.0 6.0 2092 1514 A 107 VAL HG2% A 39 VAL HB 1.0 1.8 3.8 2093 1514 A 92 ALA HB% A 107 VAL HG1% 1.0 1.8 3.8 2094 1515 A 108 ASN HBy A 107 VAL HG2% 1.0 2.0 5.8 2095 1515 A 107 VAL HG1% A 93 CYS HBy 1.0 2.0 5.8 2096 1515 A 108 ASN HBy A 107 VAL HG1% 1.0 2.0 5.8 2097 1516 A 98 PRO HDx A 103 ARG HD3 1.0 0.0 6.0 2098 1516 A 98 PRO HDx A 103 ARG HD2 1.0 0.0 6.0 2099 1516 A 108 ASN HBx A 98 PRO HDx 1.0 0.0 6.0 2100 1516 A 69 ASP HBy A 74 LYS HEx 1.0 0.0 6.0 2101 1517 A 84 LYS HE3 A 84 LYS HG3 1.0 1.8 3.8 2102 1517 A 84 LYS HE2 A 84 LYS HG3 1.0 1.8 3.8 2103 1517 A 74 LYS HG3 A 74 LYS HEy 1.0 1.8 3.8 2104 1517 A 84 LYS HE2 A 84 LYS HG2 1.0 1.8 3.8 2105 1517 A 84 LYS HE3 A 84 LYS HG2 1.0 1.8 3.8 2106 1517 A 74 LYS HG2 A 74 LYS HEy 1.0 1.8 3.8 2107 1518 A 83 MET HBy A 84 LYS HG3 1.0 1.9 4.9 2108 1518 A 60 ASP HBy A 84 LYS HG2 1.0 1.9 4.9 2109 1518 A 60 ASP HBy A 84 LYS HG3 1.0 1.9 4.9 2110 1519 A 83 MET HBy A 84 LYS HG2 1.0 2.0 4.6 2111 1519 A 83 MET HBy A 84 LYS HG3 1.0 2.0 4.6 2112 1519 A 69 ASP HBx A 74 LYS HG3 1.0 2.0 4.6 2113 1519 A 84 LYS HG3 A 60 ASP HBx 1.0 2.0 4.6 2114 1519 A 84 LYS HG2 A 60 ASP HBx 1.0 2.0 4.6 2115 1520 A 109 LEU HD1% A 36 LYS HG3 1.0 2.0 4.6 2116 1520 A 112 LEU HD1% A 109 LEU HD1% 1.0 2.0 4.6 2117 1521 A 109 LEU HD1% A 109 LEU HBy 1.0 1.6 3.0 2118 1521 A 84 LYS HBy A 84 LYS HG2 1.0 1.6 3.0 2119 1521 A 84 LYS HBy A 84 LYS HG3 1.0 1.6 3.0 2120 1522 A 109 LEU HD2% A 83 MET HBx 1.0 0.0 6.0 2121 1522 A 109 LEU HD2% A 90 GLU HBx 1.0 0.0 6.0 2122 1522 A 109 LEU HD2% A 90 GLU HGx 1.0 0.0 6.0 2123 1523 A 89 ALA HA A 86 ARG HDx 1.0 2.0 6.0 2124 1523 A 89 ALA HA A 93 CYS HBy 1.0 2.0 6.0 2125 1523 A 111 TYR HBx A 110 ALA HA 1.0 2.0 6.0 2126 1523 A 108 ASN HBy A 110 ALA HA 1.0 2.0 6.0 2127 1524 A 36 LYS HEy A 110 ALA HB% 1.0 1.7 3.5 2128 1524 A 38 PHE HBx A 110 ALA HB% 1.0 1.7 3.5 2129 1525 A 109 LEU HD1% A 110 ALA HB% 1.0 1.8 3.6 2130 1525 A 36 LYS HG2 A 110 ALA HB% 1.0 1.8 3.6 2131 1526 A 32 THR HG2% A 110 ALA HB% 1.0 0.0 6.0 2132 1526 A 110 ALA HB% A 81 VAL HB 1.0 0.0 6.0 2133 1527 A 112 LEU HD1% A 115 LYS HD3 1.0 0.0 6.0 2134 1527 A 112 LEU HD1% A 36 LYS HDy 1.0 0.0 6.0 2135 1527 A 112 LEU HD1% A 110 ALA HB% 1.0 0.0 6.0 2136 1528 A 42 LEU HD2% A 51 LEU HD2% 1.0 1.5 2.5 2137 1528 A 42 LEU HD2% A 42 LEU HBx 1.0 1.5 2.5 2138 1528 A 112 LEU HD1% A 112 LEU HD2% 1.0 1.5 2.5 2139 1529 A 114 ALA HB% A 115 LYS HE3 1.0 1.9 4.5 2140 1529 A 114 ALA HB% A 115 LYS HE2 1.0 1.9 4.5 2141 1529 A 111 TYR HBx A 114 ALA HB% 1.0 1.9 4.5 2142 1530 A 82 THR HG2% A 114 ALA HB% 1.0 0.0 6.0 2143 1530 A 118 THR HG2% A 114 ALA HB% 1.0 0.0 6.0 2144 1531 A 114 ALA HB% A 117 ARG HBx 1.0 0.0 6.0 2145 1531 A 109 LEU HBy A 114 ALA HB% 1.0 0.0 6.0 2146 1531 A 109 LEU HBx A 114 ALA HB% 1.0 0.0 6.0 2147 1532 A 49 LYS HGx A 52 HIS HB3 1.0 2.0 6.0 2148 1532 A 49 LYS HGx A 52 HIS HB2 1.0 2.0 6.0 2149 1532 A 116 PRO HDx A 115 LYS HGy 1.0 2.0 6.0 2150 1533 A 38 PHE HA A 54 TYR HD% 1.0 2.0 6.0 2151 1533 A 54 TYR HD% A 96 PRO HA 1.0 2.0 6.0 2152 1533 A 38 PHE HA B 5 U H1' 1.0 2.0 6.0 2153 1534 B 7 C H1' B 7 C H3' 1.0 2.0 5.8 2154 1534 B 6 G H1' B 6 G H2' 1.0 2.0 5.8 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 81 VAL O A 37 ILE N 1.0 2.74 3.24 2 2 A 81 VAL O A 37 ILE H 1.0 1.79 2.29 3 3 A 108 ASN O A 38 PHE N 1.0 2.74 3.24 4 4 A 108 ASN O A 38 PHE H 1.0 1.79 2.29 5 5 A 79 GLY O A 39 VAL N 1.0 2.74 3.24 6 6 A 79 GLY O A 39 VAL H 1.0 1.79 2.29 7 7 A 106 ASN O A 40 GLY N 1.0 2.74 3.24 8 8 A 106 ASN O A 40 GLY H 1.0 1.79 2.29 9 9 A 47 SER O A 51 LEU N 1.0 2.74 3.24 10 10 A 47 SER O A 51 LEU H 1.0 1.79 2.29 11 11 A 48 ASP O A 52 HIS N 1.0 2.74 3.24 12 12 A 48 ASP O A 52 HIS H 1.0 1.79 2.29 13 13 A 49 LYS O A 53 GLU N 1.0 2.74 3.24 14 14 A 49 LYS O A 53 GLU H 1.0 1.79 2.29 15 15 A 50 THR O A 54 TYR N 1.0 2.74 3.24 16 16 A 50 THR O A 54 TYR H 1.0 1.79 2.29 17 17 A 51 LEU O A 55 PHE N 1.0 2.74 3.24 18 18 A 51 LEU O A 55 PHE H 1.0 1.79 2.29 19 19 A 52 HIS O A 56 GLU N 1.0 2.74 3.24 20 20 A 52 HIS O A 56 GLU H 1.0 1.79 2.29 21 21 A 82 THR O A 63 GLU N 1.0 2.74 3.24 22 22 A 82 THR O A 63 GLU H 1.0 1.79 2.29 23 23 A 80 PHE O A 65 VAL N 1.0 2.74 3.24 24 24 A 80 PHE O A 65 VAL H 1.0 1.79 2.29 25 25 A 39 VAL O A 79 GLY N 1.0 2.74 3.24 26 26 A 39 VAL O A 79 GLY H 1.0 1.79 2.29 27 27 A 65 VAL O A 80 PHE N 1.0 2.74 3.24 28 28 A 65 VAL O A 80 PHE H 1.0 1.79 2.29 29 29 A 37 ILE O A 81 VAL N 1.0 2.74 3.24 30 30 A 37 ILE O A 81 VAL H 1.0 1.79 2.29 31 31 A 63 GLU O A 82 THR N 1.0 2.74 3.24 32 32 A 63 GLU O A 82 THR H 1.0 1.79 2.29 33 33 A 85 ASP O A 89 ALA N 1.0 2.74 3.24 34 34 A 85 ASP O A 89 ALA H 1.0 1.79 2.29 35 35 A 86 ARG O A 90 GLU N 1.0 2.74 3.24 36 36 A 86 ARG O A 90 GLU H 1.0 1.79 2.29 37 37 A 87 ALA O A 91 ARG N 1.0 2.74 3.24 38 38 A 87 ALA O A 91 ARG H 1.0 1.79 2.29 39 39 A 88 SER O A 92 ALA N 1.0 2.74 3.24 40 40 A 88 SER O A 92 ALA H 1.0 1.79 2.29 41 41 A 89 ALA O A 93 CYS N 1.0 2.74 3.24 42 42 A 89 ALA O A 93 CYS H 1.0 1.79 2.29 43 43 A 90 GLU O A 94 LYS N 1.0 2.74 3.24 44 44 A 90 GLU O A 94 LYS H 1.0 1.79 2.29 45 45 A 103 ARG O A 100 ILE N 1.0 2.74 3.24 46 46 A 103 ARG O A 100 ILE H 1.0 1.79 2.29 47 47 A 100 ILE O A 103 ARG N 1.0 2.74 3.24 48 48 A 100 ILE O A 103 ARG H 1.0 1.79 2.29 49 49 A 98 PRO O A 105 ALA N 1.0 2.74 3.24 50 50 A 98 PRO O A 105 ALA H 1.0 1.79 2.29 stop_ save_ save_CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_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 41 GLY C A 42 LEU N A 42 LEU CA A 42 LEU C 1.0 -92.756 -62.756 PHI 2 2 A 42 LEU N A 42 LEU CA A 42 LEU C A 43 PRO N 1.0 114.672 159.072 PSI 3 3 A 42 LEU C A 43 PRO N A 43 PRO CA A 43 PRO C 1.0 -72.288 -46.288 PHI 4 4 A 43 PRO N A 43 PRO CA A 43 PRO C A 44 TYR N 1.0 123.920 159.120 PSI 5 5 A 43 PRO C A 44 TYR N A 44 TYR CA A 44 TYR C 1.0 -81.978 -51.978 PHI 6 6 A 44 TYR N A 44 TYR CA A 44 TYR C A 45 HIS N 1.0 -43.767 2.633 PSI 7 7 A 44 TYR C A 45 HIS N A 45 HIS CA A 45 HIS C 1.0 -110.464 -74.064 PHI 8 8 A 45 HIS N A 45 HIS CA A 45 HIS C A 46 THR N 1.0 -25.303 30.697 PSI 9 9 A 45 HIS C A 46 THR N A 46 THR CA A 46 THR C 1.0 -78.592 -53.792 PHI 10 10 A 49 LYS C A 50 THR N A 50 THR CA A 50 THR C 1.0 -75.676 -59.276 PHI 11 11 A 65 VAL C A 66 VAL N A 66 VAL CA A 66 VAL C 1.0 -126.807 -67.607 PHI 12 12 A 72 THR C A 73 GLN N A 73 GLN CA A 73 GLN C 1.0 56.953 70.953 PHI 13 13 A 76 ARG C A 77 GLY N A 77 GLY CA A 77 GLY C 1.0 68.737 104.337 PHI 14 14 A 77 GLY N A 77 GLY CA A 77 GLY C A 78 TYR N 1.0 -10.844 35.356 PSI 15 15 A 77 GLY C A 78 TYR N A 78 TYR CA A 78 TYR C 1.0 -173.866 -112.466 PHI 16 16 A 87 ALA C A 88 SER N A 88 SER CA A 88 SER C 1.0 -72.302 -60.302 PHI 17 17 A 97 ASN C A 98 PRO N A 98 PRO CA A 98 PRO C 1.0 -80.906 -48.306 PHI 18 18 A 105 ALA C A 106 ASN N A 106 ASN CA A 106 ASN C 1.0 -154.973 -94.973 PHI 19 19 A 110 ALA C A 111 TYR N A 111 TYR CA A 111 TYR C 1.0 -77.363 -56.763 PHI 20 20 A 111 TYR N A 111 TYR CA A 111 TYR C A 112 LEU N 1.0 -38.896 -3.296 PSI 21 21 A 111 TYR C A 112 LEU N A 112 LEU CA A 112 LEU C 1.0 -84.308 -61.708 PHI 22 22 A 32 THR N A 32 THR CA A 32 THR CB A 32 THR OG1 1.0 45.000 75.000 CHI1 23 23 A 42 LEU N A 42 LEU CA A 42 LEU CB A 42 LEU CG 1.0 -75.000 -45.000 CHI1 24 24 A 44 TYR N A 44 TYR CA A 44 TYR CB A 44 TYR CG 1.0 -75.000 -45.000 CHI1 25 25 A 46 THR N A 46 THR CA A 46 THR CB A 46 THR OG1 1.0 -75.000 -45.000 CHI1 26 26 A 50 THR N A 50 THR CA A 50 THR CB A 50 THR OG1 1.0 -75.000 -45.000 CHI1 27 27 A 66 VAL N A 66 VAL CA A 66 VAL CB A 66 VAL CG1 1.0 165.000 195.000 CHI1 28 28 A 73 GLN N A 73 GLN CA A 73 GLN CB A 73 GLN CG 1.0 -75.000 -45.000 CHI1 29 29 A 78 TYR N A 78 TYR CA A 78 TYR CB A 78 TYR CG 1.0 -75.000 -45.000 CHI1 30 30 A 120 VAL N A 120 VAL CA A 120 VAL CB A 120 VAL CG1 1.0 165.000 195.000 CHI1 31 31 B 1 G O3' B 2 G P B 2 G O5' B 2 G C5' 1.0 45.000 315.000 ALPHA 32 32 B 2 G O3' B 3 U P B 3 U O5' B 3 U C5' 1.0 45.000 315.000 ALPHA 33 33 B 3 U O3' B 4 G P B 4 G O5' B 4 G C5' 1.0 45.000 315.000 ALPHA 34 34 B 4 G O3' B 5 U P B 5 U O5' B 5 U C5' 1.0 45.000 315.000 ALPHA 35 35 B 5 U O3' B 6 G P B 6 G O5' B 6 G C5' 1.0 45.000 315.000 ALPHA 36 36 B 6 G O3' B 7 C P B 7 C O5' B 7 C C5' 1.0 45.000 315.000 ALPHA 37 37 B 2 G P B 2 G O5' B 2 G C5' B 2 G C4' 1.0 75.000 255.000 BETA 38 38 B 3 U P B 3 U O5' B 3 U C5' B 3 U C4' 1.0 75.000 255.000 BETA 39 39 B 4 G P B 4 G O5' B 4 G C5' B 4 G C4' 1.0 75.000 255.000 BETA 40 40 B 5 U P B 5 U O5' B 5 U C5' B 5 U C4' 1.0 75.000 255.000 BETA 41 41 B 6 G P B 6 G O5' B 6 G C5' B 6 G C4' 1.0 75.000 255.000 BETA 42 42 B 7 C P B 7 C O5' B 7 C C5' B 7 C C4' 1.0 75.000 255.000 BETA 43 43 B 1 G O5' B 1 G C5' B 1 G C4' B 1 G C3' 1.0 40.000 210.000 GAMMA 44 44 B 2 G O5' B 2 G C5' B 2 G C4' B 2 G C3' 1.0 40.000 210.000 GAMMA 45 45 B 3 U O5' B 3 U C5' B 3 U C4' B 3 U C3' 1.0 40.000 210.000 GAMMA 46 46 B 4 G O5' B 4 G C5' B 4 G C4' B 4 G C3' 1.0 40.000 210.000 GAMMA 47 47 B 5 U O5' B 5 U C5' B 5 U C4' B 5 U C3' 1.0 40.000 210.000 GAMMA 48 48 B 6 G O5' B 6 G C5' B 6 G C4' B 6 G C3' 1.0 40.000 210.000 GAMMA 49 49 B 7 C O5' B 7 C C5' B 7 C C4' B 7 C C3' 1.0 40.000 210.000 GAMMA 50 50 B 1 G C5' B 1 G C4' B 1 G C3' B 1 G O3' 1.0 65.000 165.000 DELTA 51 51 B 2 G C5' B 2 G C4' B 2 G C3' B 2 G O3' 1.0 65.000 165.000 DELTA 52 52 B 3 U C5' B 3 U C4' B 3 U C3' B 3 U O3' 1.0 65.000 165.000 DELTA 53 53 B 4 G C5' B 4 G C4' B 4 G C3' B 4 G O3' 1.0 65.000 165.000 DELTA 54 54 B 5 U C5' B 5 U C4' B 5 U C3' B 5 U O3' 1.0 65.000 165.000 DELTA 55 55 B 6 G C5' B 6 G C4' B 6 G C3' B 6 G O3' 1.0 65.000 165.000 DELTA 56 56 B 7 C C5' B 7 C C4' B 7 C C3' B 7 C O3' 1.0 65.000 165.000 DELTA 57 57 B 1 G C4' B 1 G C3' B 1 G O3' B 2 G P 1.0 -182.000 -72.000 EPSILON 58 58 B 2 G C4' B 2 G C3' B 2 G O3' B 3 U P 1.0 -182.000 -72.000 EPSILON 59 59 B 3 U C4' B 3 U C3' B 3 U O3' B 4 G P 1.0 -182.000 -72.000 EPSILON 60 60 B 4 G C4' B 4 G C3' B 4 G O3' B 5 U P 1.0 -182.000 -72.000 EPSILON 61 61 B 5 U C4' B 5 U C3' B 5 U O3' B 6 G P 1.0 -182.000 -72.000 EPSILON 62 62 B 6 G C4' B 6 G C3' B 6 G O3' B 7 C P 1.0 -182.000 -72.000 EPSILON 63 63 B 1 G C3' B 1 G O3' B 2 G P B 2 G O5' 1.0 45.000 305.000 ZETA 64 64 B 2 G C3' B 2 G O3' B 3 U P B 3 U O5' 1.0 45.000 305.000 ZETA 65 65 B 3 U C3' B 3 U O3' B 4 G P B 4 G O5' 1.0 45.000 305.000 ZETA 66 66 B 4 G C3' B 4 G O3' B 5 U P B 5 U O5' 1.0 45.000 305.000 ZETA 67 67 B 5 U C3' B 5 U O3' B 6 G P B 6 G O5' 1.0 45.000 305.000 ZETA 68 68 B 6 G C3' B 6 G O3' B 7 C P B 7 C O5' 1.0 45.000 305.000 ZETA 69 69 B 1 G O4' B 1 G C1' B 1 G N9 B 1 G C4 1.0 -180.000 -60.000 CHI 70 70 B 2 G O4' B 2 G C1' B 2 G N9 B 2 G C4 1.0 -180.000 -60.000 CHI 71 71 B 3 U O4' B 3 U C1' B 3 U N1 B 3 U C2 1.0 -180.000 -60.000 CHI 72 72 B 4 G O4' B 4 G C1' B 4 G N9 B 4 G C4 1.0 60.000 80.000 CHI 73 73 B 5 U O4' B 5 U C1' B 5 U N1 B 5 U C2 1.0 -180.000 -60.000 CHI 74 74 B 6 G O4' B 6 G C1' B 6 G N9 B 6 G C4 1.0 -180.000 -60.000 CHI 75 75 B 1 G C4' B 1 G O4' B 1 G C1' B 1 G C2' 1.0 -26.000 -16.000 NU0 76 76 B 1 G O4' B 1 G C1' B 1 G C2' B 1 G C3' 1.0 30.000 40.000 NU1 77 77 B 1 G C1' B 1 G C2' B 1 G C3' B 1 G C4' 1.0 -40.000 -30.000 NU2 78 78 B 1 G C2' B 1 G C3' B 1 G C4' B 1 G O4' 1.0 19.000 29.000 NU3 79 79 B 2 G C4' B 2 G O4' B 2 G C1' B 2 G C2' 1.0 -26.000 -16.000 NU0 80 80 B 2 G O4' B 2 G C1' B 2 G C2' B 2 G C3' 1.0 30.000 40.000 NU1 81 81 B 2 G C1' B 2 G C2' B 2 G C3' B 2 G C4' 1.0 -40.000 -30.000 NU2 82 82 B 2 G C2' B 2 G C3' B 2 G C4' B 2 G O4' 1.0 19.000 29.000 NU3 83 83 B 3 U C4' B 3 U O4' B 3 U C1' B 3 U C2' 1.0 -26.000 -16.000 NU0 84 84 B 3 U O4' B 3 U C1' B 3 U C2' B 3 U C3' 1.0 30.000 40.000 NU1 85 85 B 3 U C1' B 3 U C2' B 3 U C3' B 3 U C4' 1.0 -40.000 -30.000 NU2 86 86 B 3 U C2' B 3 U C3' B 3 U C4' B 3 U O4' 1.0 19.000 29.000 NU3 87 87 B 4 G C4' B 4 G O4' B 4 G C1' B 4 G C2' 1.0 -2.000 8.000 NU0 88 88 B 4 G O4' B 4 G C1' B 4 G C2' B 4 G C3' 1.0 -30.000 -20.000 NU1 89 89 B 4 G C1' B 4 G C2' B 4 G C3' B 4 G C4' 1.0 31.000 41.000 NU2 90 90 B 4 G C2' B 4 G C3' B 4 G C4' B 4 G O4' 1.0 -40.000 -30.000 NU3 91 91 B 5 U C4' B 5 U O4' B 5 U C1' B 5 U C2' 1.0 -26.000 -16.000 NU0 92 92 B 5 U O4' B 5 U C1' B 5 U C2' B 5 U C3' 1.0 30.000 40.000 NU1 93 93 B 5 U C1' B 5 U C2' B 5 U C3' B 5 U C4' 1.0 -40.000 -30.000 NU2 94 94 B 5 U C2' B 5 U C3' B 5 U C4' B 5 U O4' 1.0 19.000 29.000 NU3 95 95 B 6 G C4' B 6 G O4' B 6 G C1' B 6 G C2' 1.0 -26.000 -16.000 NU0 96 96 B 6 G O4' B 6 G C1' B 6 G C2' B 6 G C3' 1.0 30.000 40.000 NU1 97 97 B 6 G C1' B 6 G C2' B 6 G C3' B 6 G C4' 1.0 -40.000 -30.000 NU2 98 98 B 6 G C2' B 6 G C3' B 6 G C4' B 6 G O4' 1.0 19.000 29.000 NU3 99 99 A 32 THR C A 33 MET N A 33 MET CA A 33 MET C 1.0 -72.320 -47.720 PHI 100 100 A 34 PHE N A 34 PHE CA A 34 PHE CB A 34 PHE CG 1.0 -75.000 -45.000 CHI1 101 101 A 35 THR N A 35 THR CA A 35 THR CB A 35 THR OG1 1.0 45.000 75.000 CHI1 102 102 A 35 THR C A 36 LYS N A 36 LYS CA A 36 LYS C 1.0 -120.230 -57.830 PHI 103 103 A 36 LYS N A 36 LYS CA A 36 LYS CB A 36 LYS CG 1.0 165.000 195.000 CHI1 104 104 A 36 LYS C A 37 ILE N A 37 ILE CA A 37 ILE C 1.0 -125.969 -82.769 PHI 105 105 A 36 LYS N A 36 LYS CA A 36 LYS C A 37 ILE N 1.0 104.574 142.574 PSI 106 106 A 37 ILE N A 37 ILE CA A 37 ILE CB A 37 ILE CG1 1.0 -75.000 -45.000 CHI1 107 107 A 37 ILE C A 38 PHE N A 38 PHE CA A 38 PHE C 1.0 -119.657 -84.457 PHI 108 108 A 38 PHE N A 38 PHE CA A 38 PHE CB A 38 PHE CG 1.0 165.000 195.000 CHI1 109 109 A 37 ILE N A 37 ILE CA A 37 ILE C A 38 PHE N 1.0 112.547 141.947 PSI 110 110 A 38 PHE C A 39 VAL N A 39 VAL CA A 39 VAL C 1.0 -132.193 -83.593 PHI 111 111 A 38 PHE N A 38 PHE CA A 38 PHE C A 39 VAL N 1.0 109.838 138.638 PSI 112 112 A 39 VAL N A 39 VAL CA A 39 VAL CB A 39 VAL CG1 1.0 165.000 195.000 CHI1 113 113 A 39 VAL C A 40 GLY N A 40 GLY CA A 40 GLY C 1.0 -139.632 -56.032 PHI 114 114 A 39 VAL N A 39 VAL CA A 39 VAL C A 40 GLY N 1.0 98.379 136.179 PSI 115 115 A 40 GLY N A 40 GLY CA A 40 GLY C A 41 GLY N 1.0 138.816 203.616 PSI 116 116 A 46 THR N A 46 THR CA A 46 THR C A 47 SER N 1.0 118.666 147.866 PSI 117 117 A 46 THR C A 47 SER N A 47 SER CA A 47 SER C 1.0 -159.250 -94.450 PHI 118 118 A 47 SER N A 47 SER CA A 47 SER CB A 47 SER OG 1.0 45.000 75.000 CHI1 119 119 A 47 SER C A 48 ASP N A 48 ASP CA A 48 ASP C 1.0 -71.232 -49.632 PHI 120 120 A 47 SER N A 47 SER CA A 47 SER C A 48 ASP N 1.0 153.608 180.808 PSI 121 121 A 48 ASP N A 48 ASP CA A 48 ASP CB A 48 ASP CG 1.0 -75.000 -45.000 CHI1 122 122 A 48 ASP C A 49 LYS N A 49 LYS CA A 49 LYS C 1.0 -73.884 -56.284 PHI 123 123 A 49 LYS N A 49 LYS CA A 49 LYS C A 50 THR N 1.0 -51.660 -30.260 PSI 124 124 A 48 ASP N A 48 ASP CA A 48 ASP C A 49 LYS N 1.0 -47.077 -26.077 PSI 125 125 A 50 THR N A 50 THR CA A 50 THR C A 51 LEU N 1.0 -44.467 -30.667 PSI 126 126 A 50 THR C A 51 LEU N A 51 LEU CA A 51 LEU C 1.0 -72.686 -61.286 PHI 127 127 A 51 LEU C A 52 HIS N A 52 HIS CA A 52 HIS C 1.0 -67.969 -53.369 PHI 128 128 A 51 LEU N A 51 LEU CA A 51 LEU C A 52 HIS N 1.0 -50.005 -36.005 PSI 129 129 A 52 HIS N A 52 HIS CA A 52 HIS CB A 52 HIS CG 1.0 165.000 195.000 CHI1 130 130 A 52 HIS C A 53 GLU N A 53 GLU CA A 53 GLU C 1.0 -71.961 -58.361 PHI 131 131 A 53 GLU N A 53 GLU CA A 53 GLU CB A 53 GLU CG 1.0 -75.000 -45.000 CHI1 132 132 A 52 HIS N A 52 HIS CA A 52 HIS C A 53 GLU N 1.0 -52.955 -32.955 PSI 133 133 A 53 GLU C A 54 TYR N A 54 TYR CA A 54 TYR C 1.0 -74.664 -51.064 PHI 134 134 A 53 GLU N A 53 GLU CA A 53 GLU C A 54 TYR N 1.0 -49.657 -26.457 PSI 135 135 A 54 TYR C A 55 PHE N A 55 PHE CA A 55 PHE C 1.0 -78.573 -54.573 PHI 136 136 A 55 PHE N A 55 PHE CA A 55 PHE CB A 55 PHE CG 1.0 -75.000 -45.000 CHI1 137 137 A 54 TYR N A 54 TYR CA A 54 TYR C A 55 PHE N 1.0 -55.348 -35.148 PSI 138 138 A 55 PHE C A 56 GLU N A 56 GLU CA A 56 GLU C 1.0 -76.658 -57.458 PHI 139 139 A 55 PHE N A 55 PHE CA A 55 PHE C A 56 GLU N 1.0 -47.558 -26.158 PSI 140 140 A 56 GLU C A 57 GLN N A 57 GLN CA A 57 GLN C 1.0 -96.014 -58.014 PHI 141 141 A 57 GLN N A 57 GLN CA A 57 GLN CB A 57 GLN CG 1.0 -75.000 -45.000 CHI1 142 142 A 56 GLU N A 56 GLU CA A 56 GLU C A 57 GLN N 1.0 -38.864 -3.664 PSI 143 143 A 57 GLN C A 58 PHE N A 58 PHE CA A 58 PHE C 1.0 -132.680 -69.080 PHI 144 144 A 57 GLN N A 57 GLN CA A 57 GLN C A 58 PHE N 1.0 -30.061 -6.861 PSI 145 145 A 58 PHE N A 58 PHE CA A 58 PHE CB A 58 PHE CG 1.0 -75.000 -45.000 CHI1 146 146 A 58 PHE N A 58 PHE CA A 58 PHE C A 59 GLY N 1.0 -51.107 9.693 PSI 147 147 A 59 GLY C A 60 ASP N A 60 ASP CA A 60 ASP C 1.0 -111.469 -49.469 PHI 148 148 A 60 ASP N A 60 ASP CA A 60 ASP CB A 60 ASP CG 1.0 -75.000 -45.000 CHI1 149 149 A 60 ASP C A 61 ILE N A 61 ILE CA A 61 ILE C 1.0 -134.732 -75.532 PHI 150 150 A 61 ILE N A 61 ILE CA A 61 ILE CB A 61 ILE CG1 1.0 -75.000 -45.000 CHI1 151 151 A 60 ASP N A 60 ASP CA A 60 ASP C A 61 ILE N 1.0 93.980 169.580 PSI 152 152 A 61 ILE N A 61 ILE CA A 61 ILE C A 62 GLU N 1.0 116.466 141.666 PSI 153 153 A 62 GLU C A 63 GLU N A 63 GLU CA A 63 GLU C 1.0 -165.328 -140.128 PHI 154 154 A 63 GLU C A 64 ALA N A 64 ALA CA A 64 ALA C 1.0 -144.782 -104.582 PHI 155 155 A 63 GLU N A 63 GLU CA A 63 GLU C A 64 ALA N 1.0 126.923 159.123 PSI 156 156 A 64 ALA C A 65 VAL N A 65 VAL CA A 65 VAL C 1.0 -143.976 -110.376 PHI 157 157 A 65 VAL N A 65 VAL CA A 65 VAL C A 66 VAL N 1.0 113.409 160.609 PSI 158 158 A 64 ALA N A 64 ALA CA A 64 ALA C A 65 VAL N 1.0 117.103 144.303 PSI 159 159 A 66 VAL N A 66 VAL CA A 66 VAL C A 67 ILE N 1.0 110.763 140.963 PSI 160 160 A 66 VAL C A 67 ILE N A 67 ILE CA A 67 ILE C 1.0 -103.683 -74.483 PHI 161 161 A 67 ILE N A 67 ILE CA A 67 ILE CB A 67 ILE CG1 1.0 -75.000 -45.000 CHI1 162 162 A 67 ILE C A 68 THR N A 68 THR CA A 68 THR C 1.0 -168.292 -95.892 PHI 163 163 A 68 THR N A 68 THR CA A 68 THR CB A 68 THR OG1 1.0 45.000 75.000 CHI1 164 164 A 67 ILE N A 67 ILE CA A 67 ILE C A 68 THR N 1.0 53.180 147.580 PSI 165 165 A 68 THR C A 69 ASP N A 69 ASP CA A 69 ASP C 1.0 -98.521 -46.521 PHI 166 166 A 68 THR N A 68 THR CA A 68 THR C A 69 ASP N 1.0 134.908 177.308 PSI 167 167 A 69 ASP N A 69 ASP CA A 69 ASP CB A 69 ASP CG 1.0 165.000 195.000 CHI1 168 168 A 69 ASP C A 70 ARG N A 70 ARG CA A 70 ARG C 1.0 -81.663 -50.263 PHI 169 169 A 69 ASP N A 69 ASP CA A 69 ASP C A 70 ARG N 1.0 106.335 156.335 PSI 170 170 A 70 ARG C A 71 ASN N A 71 ASN CA A 71 ASN C 1.0 -107.373 -63.573 PHI 171 171 A 71 ASN N A 71 ASN CA A 71 ASN CB A 71 ASN CG 1.0 -75.000 -45.000 CHI1 172 172 A 70 ARG N A 70 ARG CA A 70 ARG C A 71 ASN N 1.0 -54.098 -4.898 PSI 173 173 A 71 ASN C A 72 THR N A 72 THR CA A 72 THR C 1.0 -131.382 -76.982 PHI 174 174 A 72 THR N A 72 THR CA A 72 THR CB A 72 THR OG1 1.0 45.000 75.000 CHI1 175 175 A 72 THR N A 72 THR CA A 72 THR C A 73 GLN N 1.0 -28.010 -6.610 PSI 176 176 A 71 ASN N A 71 ASN CA A 71 ASN C A 72 THR N 1.0 -61.329 -17.529 PSI 177 177 A 74 LYS N A 74 LYS CA A 74 LYS CB A 74 LYS CG 1.0 -75.000 -45.000 CHI1 178 178 A 76 ARG N A 76 ARG CA A 76 ARG CB A 76 ARG CG 1.0 -75.000 -45.000 CHI1 179 179 A 78 TYR N A 78 TYR CA A 78 TYR C A 79 GLY N 1.0 137.927 179.727 PSI 180 180 A 78 TYR C A 79 GLY N A 79 GLY CA A 79 GLY C 1.0 -201.646 -116.046 PHI 181 181 A 79 GLY C A 80 PHE N A 80 PHE CA A 80 PHE C 1.0 -160.668 -110.868 PHI 182 182 A 80 PHE N A 80 PHE CA A 80 PHE CB A 80 PHE CG 1.0 -75.000 -45.000 CHI1 183 183 A 79 GLY N A 79 GLY CA A 79 GLY C A 80 PHE N 1.0 145.309 204.909 PSI 184 184 A 80 PHE C A 81 VAL N A 81 VAL CA A 81 VAL C 1.0 -143.734 -102.934 PHI 185 185 A 81 VAL N A 81 VAL CA A 81 VAL CB A 81 VAL CG1 1.0 165.000 195.000 CHI1 186 186 A 80 PHE N A 80 PHE CA A 80 PHE C A 81 VAL N 1.0 125.250 165.050 PSI 187 187 A 81 VAL C A 82 THR N A 82 THR CA A 82 THR C 1.0 -137.065 -75.865 PHI 188 188 A 82 THR N A 82 THR CA A 82 THR CB A 82 THR OG1 1.0 -75.000 -45.000 CHI1 189 189 A 81 VAL N A 81 VAL CA A 81 VAL C A 82 THR N 1.0 109.686 142.886 PSI 190 190 A 82 THR C A 83 MET N A 83 MET CA A 83 MET C 1.0 -142.871 -88.871 PHI 191 191 A 82 THR N A 82 THR CA A 82 THR C A 83 MET N 1.0 94.783 154.583 PSI 192 192 A 83 MET N A 83 MET CA A 83 MET CB A 83 MET CG 1.0 -75.000 -45.000 CHI1 193 193 A 83 MET C A 84 LYS N A 84 LYS CA A 84 LYS C 1.0 -82.637 -53.637 PHI 194 194 A 83 MET N A 83 MET CA A 83 MET C A 84 LYS N 1.0 119.765 185.565 PSI 195 195 A 84 LYS C A 85 ASP N A 85 ASP CA A 85 ASP C 1.0 -168.190 -132.790 PHI 196 196 A 84 LYS N A 84 LYS CA A 84 LYS C A 85 ASP N 1.0 -48.586 -8.986 PSI 197 197 A 85 ASP C A 86 ARG N A 86 ARG CA A 86 ARG C 1.0 -72.839 -56.639 PHI 198 198 A 85 ASP N A 85 ASP CA A 85 ASP C A 86 ARG N 1.0 149.979 177.779 PSI 199 199 A 86 ARG C A 87 ALA N A 87 ALA CA A 87 ALA C 1.0 -71.337 -47.737 PHI 200 200 A 86 ARG N A 86 ARG CA A 86 ARG C A 87 ALA N 1.0 -47.233 -23.833 PSI 201 201 A 87 ALA N A 87 ALA CA A 87 ALA C A 88 SER N 1.0 -51.932 -30.132 PSI 202 202 A 88 SER N A 88 SER CA A 88 SER C A 89 ALA N 1.0 -50.737 -28.937 PSI 203 203 A 88 SER C A 89 ALA N A 89 ALA CA A 89 ALA C 1.0 -70.889 -59.889 PHI 204 204 A 89 ALA C A 90 GLU N A 90 GLU CA A 90 GLU C 1.0 -71.657 -56.457 PHI 205 205 A 89 ALA N A 89 ALA CA A 89 ALA C A 90 GLU N 1.0 -49.295 -33.295 PSI 206 206 A 90 GLU C A 91 ARG N A 91 ARG CA A 91 ARG C 1.0 -73.887 -58.287 PHI 207 207 A 90 GLU N A 90 GLU CA A 90 GLU C A 91 ARG N 1.0 -48.982 -32.982 PSI 208 208 A 91 ARG C A 92 ALA N A 92 ALA CA A 92 ALA C 1.0 -71.857 -58.057 PHI 209 209 A 91 ARG N A 91 ARG CA A 91 ARG C A 92 ALA N 1.0 -50.284 -33.484 PSI 210 210 A 92 ALA C A 93 CYS N A 93 CYS CA A 93 CYS C 1.0 -86.589 -52.989 PHI 211 211 A 92 ALA N A 92 ALA CA A 92 ALA C A 93 CYS N 1.0 -45.943 -24.343 PSI 212 212 A 93 CYS C A 94 LYS N A 94 LYS CA A 94 LYS C 1.0 -93.004 -58.204 PHI 213 213 A 93 CYS N A 93 CYS CA A 93 CYS C A 94 LYS N 1.0 -48.538 -1.338 PSI 214 214 A 94 LYS C A 95 ASP N A 95 ASP CA A 95 ASP C 1.0 -157.219 -103.819 PHI 215 215 A 94 LYS N A 94 LYS CA A 94 LYS C A 95 ASP N 1.0 -54.094 6.306 PSI 216 216 A 95 ASP N A 95 ASP CA A 95 ASP CB A 95 ASP CG 1.0 165.000 195.000 CHI1 217 217 A 95 ASP N A 95 ASP CA A 95 ASP C A 96 PRO N 1.0 34.151 149.951 PSI 218 218 A 98 PRO N A 98 PRO CA A 98 PRO C A 99 ILE N 1.0 124.356 164.356 PSI 219 219 A 99 ILE N A 99 ILE CA A 99 ILE CB A 99 ILE CG1 1.0 -75.000 -45.000 CHI1 220 220 A 99 ILE C A 100 ILE N A 100 ILE CA A 100 ILE C 1.0 -155.493 -94.293 PHI 221 221 A 100 ILE N A 100 ILE CA A 100 ILE CB A 100 ILE CG1 1.0 -75.000 -45.000 CHI1 222 222 A 99 ILE N A 99 ILE CA A 99 ILE C A 100 ILE N 1.0 93.792 151.192 PSI 223 223 A 100 ILE C A 101 ASP N A 101 ASP CA A 101 ASP C 1.0 44.772 62.572 PHI 224 224 A 100 ILE N A 100 ILE CA A 100 ILE C A 101 ASP N 1.0 107.344 142.944 PSI 225 225 A 101 ASP C A 102 GLY N A 102 GLY CA A 102 GLY C 1.0 70.016 88.616 PHI 226 226 A 101 ASP N A 101 ASP CA A 101 ASP C A 102 GLY N 1.0 28.600 50.400 PSI 227 227 A 102 GLY C A 103 ARG N A 103 ARG CA A 103 ARG C 1.0 -142.858 -107.658 PHI 228 228 A 102 GLY N A 102 GLY CA A 102 GLY C A 103 ARG N 1.0 -6.362 21.638 PSI 229 229 A 103 ARG C A 104 LYS N A 104 LYS CA A 104 LYS C 1.0 -97.810 -59.810 PHI 230 230 A 103 ARG N A 103 ARG CA A 103 ARG C A 104 LYS N 1.0 125.412 161.412 PSI 231 231 A 104 LYS N A 104 LYS CA A 104 LYS CB A 104 LYS CG 1.0 165.000 195.000 CHI1 232 232 A 104 LYS C A 105 ALA N A 105 ALA CA A 105 ALA C 1.0 -149.394 -89.394 PHI 233 233 A 104 LYS N A 104 LYS CA A 104 LYS C A 105 ALA N 1.0 112.699 149.099 PSI 234 234 A 105 ALA N A 105 ALA CA A 105 ALA C A 106 ASN N 1.0 119.487 164.087 PSI 235 235 A 106 ASN N A 106 ASN CA A 106 ASN C A 107 VAL N 1.0 113.963 147.363 PSI 236 236 A 106 ASN C A 107 VAL N A 107 VAL CA A 107 VAL C 1.0 -139.398 -100.798 PHI 237 237 A 107 VAL N A 107 VAL CA A 107 VAL CB A 107 VAL CG1 1.0 165.000 195.000 CHI1 238 238 A 107 VAL C A 108 ASN N A 108 ASN CA A 108 ASN C 1.0 -172.765 -122.765 PHI 239 239 A 107 VAL N A 107 VAL CA A 107 VAL C A 108 ASN N 1.0 114.958 158.758 PSI 240 240 A 108 ASN N A 108 ASN CA A 108 ASN C A 109 LEU N 1.0 126.594 187.394 PSI 241 241 A 109 LEU C A 110 ALA N A 110 ALA CA A 110 ALA C 1.0 -68.107 -47.707 PHI 242 242 A 110 ALA N A 110 ALA CA A 110 ALA C A 111 TYR N 1.0 -45.364 -22.164 PSI 243 243 A 112 LEU N A 112 LEU CA A 112 LEU C A 113 GLY N 1.0 -45.923 0.077 PSI 244 244 A 113 GLY C A 114 ALA N A 114 ALA CA A 114 ALA C 1.0 -85.973 -55.973 PHI 245 245 A 115 LYS N A 115 LYS CA A 115 LYS CB A 115 LYS CG 1.0 -75.000 -45.000 CHI1 246 246 A 114 ALA N A 114 ALA CA A 114 ALA C A 115 LYS N 1.0 113.671 159.271 PSI stop_ save_ save_CNS/XPLOR_dipolar_coupling_5 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode CNS/XPLOR_dipolar_coupling_5 _nef_rdc_restraint_list.potential_type parabolic _nef_rdc_restraint_list.restraint_origin . loop_ _nef_rdc_restraint.index _nef_rdc_restraint.restraint_id _nef_rdc_restraint.chain_code_1 _nef_rdc_restraint.sequence_code_1 _nef_rdc_restraint.residue_name_1 _nef_rdc_restraint.atom_name_1 _nef_rdc_restraint.chain_code_2 _nef_rdc_restraint.sequence_code_2 _nef_rdc_restraint.residue_name_2 _nef_rdc_restraint.atom_name_2 _nef_rdc_restraint.weight _nef_rdc_restraint.lower_limit _nef_rdc_restraint.upper_limit _nef_rdc_restraint.scale 1 1 A 33 MET H A 33 MET N 1.0 . . . 2 2 A 34 PHE H A 34 PHE N 1.0 . . . 3 3 A 35 THR H A 35 THR N 1.0 . . . 4 4 A 36 LYS H A 36 LYS N 1.0 . . . 5 5 A 40 GLY H A 40 GLY N 1.0 . . . 6 6 A 47 SER H A 47 SER N 1.0 . . . 7 7 A 48 ASP H A 48 ASP N 1.0 . . . 8 8 A 49 LYS H A 49 LYS N 1.0 . . . 9 9 A 52 HIS H A 52 HIS N 1.0 . . . 10 10 A 53 GLU H A 53 GLU N 1.0 . . . 11 11 A 54 TYR H A 54 TYR N 1.0 . . . 12 12 A 55 PHE H A 55 PHE N 1.0 . . . 13 13 A 56 GLU H A 56 GLU N 1.0 . . . 14 14 A 57 GLN H A 57 GLN N 1.0 . . . 15 15 A 58 PHE H A 58 PHE N 1.0 . . . 16 16 A 59 GLY H A 59 GLY N 1.0 . . . 17 17 A 60 ASP H A 60 ASP N 1.0 . . . 18 18 A 61 ILE H A 61 ILE N 1.0 . . . 19 19 A 62 GLU H A 62 GLU N 1.0 . . . 20 20 A 63 GLU H A 63 GLU N 1.0 . . . 21 21 A 64 ALA H A 64 ALA N 1.0 . . . 22 22 A 65 VAL H A 65 VAL N 1.0 . . . 23 23 A 67 ILE H A 67 ILE N 1.0 . . . 24 24 A 68 THR H A 68 THR N 1.0 . . . 25 25 A 69 ASP H A 69 ASP N 1.0 . . . 26 26 A 70 ARG H A 70 ARG N 1.0 . . . 27 27 A 71 ASN H A 71 ASN N 1.0 . . . 28 28 A 72 THR H A 72 THR N 1.0 . . . 29 29 A 74 LYS H A 74 LYS N 1.0 . . . 30 30 A 76 ARG H A 76 ARG N 1.0 . . . 31 31 A 79 GLY H A 79 GLY N 1.0 . . . 32 32 A 80 PHE H A 80 PHE N 1.0 . . . 33 33 A 82 THR H A 82 THR N 1.0 . . . 34 34 A 83 MET H A 83 MET N 1.0 . . . 35 35 A 84 LYS H A 84 LYS N 1.0 . . . 36 36 A 85 ASP H A 85 ASP N 1.0 . . . 37 37 A 86 ARG H A 86 ARG N 1.0 . . . 38 38 A 87 ALA H A 87 ALA N 1.0 . . . 39 39 A 89 ALA H A 89 ALA N 1.0 . . . 40 40 A 90 GLU H A 90 GLU N 1.0 . . . 41 41 A 91 ARG H A 91 ARG N 1.0 . . . 42 42 A 92 ALA H A 92 ALA N 1.0 . . . 43 43 A 93 CYS H A 93 CYS N 1.0 . . . 44 44 A 94 LYS H A 94 LYS N 1.0 . . . 45 45 A 95 ASP H A 95 ASP N 1.0 . . . 46 46 A 97 ASN H A 97 ASN N 1.0 . . . 47 47 A 99 ILE H A 99 ILE N 1.0 . . . 48 48 A 100 ILE H A 100 ILE N 1.0 . . . 49 49 A 101 ASP H A 101 ASP N 1.0 . . . 50 50 A 102 GLY H A 102 GLY N 1.0 . . . 51 51 A 103 ARG H A 103 ARG N 1.0 . . . 52 52 A 104 LYS H A 104 LYS N 1.0 . . . 53 53 A 105 ALA H A 105 ALA N 1.0 . . . 54 54 A 107 VAL H A 107 VAL N 1.0 . . . 55 55 A 108 ASN H A 108 ASN N 1.0 . . . 56 56 A 109 LEU H A 109 LEU N 1.0 . . . 57 57 A 110 ALA H A 110 ALA N 1.0 . . . 58 58 A 113 GLY H A 113 GLY N 1.0 . . . 59 59 A 114 ALA H A 114 ALA N 1.0 . . . 60 60 A 115 LYS H A 115 LYS N 1.0 . . . stop_ save_