data_nef_c15778_2k3u save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 1XEE stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 2 1 ACE C 2 2 THR N 2 5 ASP C 2 6 TYS N 2 6 TYS C 2 7 GLY N 2 8 HIS C 2 9 TYS N 2 9 TYS C 2 10 ASP N 2 23 LYS C 2 24 NH2 N stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 31 ASN start . . 2 A 32 SER middle . . 3 A 33 GLY middle . false 4 A 34 LEU middle . . 5 A 35 PRO middle . false 6 A 36 THR middle . . 7 A 37 THR middle . . 8 A 38 LEU middle . . 9 A 39 GLY middle . false 10 A 40 LYS middle . . 11 A 41 LEU middle . . 12 A 42 ASP middle . . 13 A 43 GLU middle . . 14 A 44 ARG middle . . 15 A 45 LEU middle . . 16 A 46 ARG middle . . 17 A 47 ASN middle . . 18 A 48 TYR middle . . 19 A 49 LEU middle . . 20 A 50 LYS middle . . 21 A 51 LYS middle . . 22 A 52 GLY middle . false 23 A 53 THR middle . . 24 A 54 LYS middle . . 25 A 55 ASN middle . . 26 A 56 SER middle . . 27 A 57 ALA middle . . 28 A 58 GLN middle . . 29 A 59 PHE middle . . 30 A 60 GLU middle . . 31 A 61 LYS middle . . 32 A 62 MET middle . . 33 A 63 VAL middle . . 34 A 64 ILE middle . . 35 A 65 LEU middle . . 36 A 66 THR middle . . 37 A 67 GLU middle . . 38 A 68 ASN middle . . 39 A 69 LYS middle . . 40 A 70 GLY middle . false 41 A 71 TYR middle . . 42 A 72 TYR middle . . 43 A 73 THR middle . . 44 A 74 VAL middle . . 45 A 75 TYR middle . . 46 A 76 LEU middle . . 47 A 77 ASN middle . . 48 A 78 THR middle . . 49 A 79 PRO middle . false 50 A 80 LEU middle . . 51 A 81 ALA middle . . 52 A 82 GLU middle . . 53 A 83 ASP middle . . 54 A 84 ARG middle . . 55 A 85 LYS middle . . 56 A 86 ASN middle . . 57 A 87 VAL middle . . 58 A 88 GLU middle . . 59 A 89 LEU middle . . 60 A 90 LEU middle . . 61 A 91 GLY middle . false 62 A 92 LYS middle . . 63 A 93 MET middle . . 64 A 94 TYR middle . . 65 A 95 LYS middle . . 66 A 96 THR middle . . 67 A 97 TYR middle . . 68 A 98 PHE middle . . 69 A 99 PHE middle . . 70 A 100 LYS middle . . 71 A 101 LYS middle . . 72 A 102 GLY middle . false 73 A 103 GLU middle . . 74 A 104 SER middle . . 75 A 105 LYS middle . . 76 A 106 SER middle . . 77 A 107 SER middle . . 78 A 108 TYR middle . . 79 A 109 VAL middle . . 80 A 110 ILE middle . . 81 A 111 ASN middle . . 82 A 112 GLY middle . false 83 A 113 PRO middle . false 84 A 114 GLY middle . false 85 A 115 LYS middle . . 86 A 116 THR middle . . 87 A 117 ASN middle . . 88 A 118 GLU middle . . 89 A 119 TYR middle . . 90 A 120 ALA middle . . 91 A 121 TYR end . . 92 B 6 ACE start . . 93 B 7 THR middle -H2 . 94 B 8 THR middle . . 95 B 9 PRO middle . false 96 B 10 ASP middle -OXT . 97 B 11 TYS middle -HN2,-OXT . 98 B 12 GLY middle -H2 false 99 B 13 HIS middle -OXT . 100 B 14 TYS middle -HN2,-OXT . 101 B 15 ASP middle -H2 . 102 B 16 ASP middle . . 103 B 17 LYS middle . . 104 B 18 ASP middle . . 105 B 19 THR middle . . 106 B 20 LEU middle . . 107 B 21 ASP middle . . 108 B 22 LEU middle . . 109 B 23 ASN middle . . 110 B 24 THR middle . . 111 B 25 PRO middle . false 112 B 26 VAL middle . . 113 B 27 ASP middle . . 114 B 28 LYS middle -OXT . 115 B 29 NH2 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 31 ASN HA H 1 4.073 0.029 A 31 ASN HBy H 1 2.833 0.020 A 31 ASN HBx H 1 2.792 0.020 A 31 ASN HD2y H 1 7.746 0.001 A 31 ASN HD2x H 1 7.008 0.005 A 31 ASN C C 13 175.511 0.000 A 31 ASN CA C 13 53.614 0.061 A 31 ASN CB C 13 40.529 0.000 A 31 ASN CG C 13 176.954 0.000 A 31 ASN ND2 N 15 113.096 0.057 A 32 SER HA H 1 4.469 0.016 A 32 SER HBx H 1 3.917 0.004 A 32 SER HBy H 1 3.917 0.004 A 32 SER C C 13 174.865 0.038 A 32 SER CA C 13 58.680 0.046 A 32 SER CB C 13 63.805 0.000 A 33 GLY H H 1 8.513 0.005 A 33 GLY HAx H 1 3.972 0.002 A 33 GLY HAy H 1 3.972 0.002 A 33 GLY C C 13 173.735 0.073 A 33 GLY CA C 13 45.132 0.005 A 33 GLY N N 15 110.526 0.058 A 34 LEU H H 1 8.145 0.004 A 34 LEU HA H 1 4.599 0.003 A 34 LEU HBy H 1 1.647 0.006 A 34 LEU HBx H 1 1.519 0.003 A 34 LEU HD1% H 1 0.968 0.001 A 34 LEU HD2% H 1 0.931 0.004 A 34 LEU HG H 1 1.698 0.004 A 34 LEU C C 13 175.201 0.000 A 34 LEU CA C 13 53.002 0.057 A 34 LEU CB C 13 41.772 0.059 A 34 LEU CD1 C 13 25.451 0.029 A 34 LEU CD2 C 13 23.467 0.112 A 34 LEU CG C 13 27.110 0.013 A 34 LEU N N 15 122.423 0.065 A 35 PRO HA H 1 4.551 0.005 A 35 PRO HBy H 1 2.233 0.003 A 35 PRO HBx H 1 1.819 0.004 A 35 PRO HDy H 1 3.869 0.005 A 35 PRO HDx H 1 3.567 0.007 A 35 PRO HGx H 1 1.947 0.005 A 35 PRO HGy H 1 1.947 0.005 A 35 PRO C C 13 176.487 0.028 A 35 PRO CA C 13 62.771 0.075 A 35 PRO CB C 13 32.488 0.007 A 35 PRO CD C 13 50.365 0.029 A 35 PRO CG C 13 27.576 0.057 A 36 THR H H 1 8.447 0.004 A 36 THR HA H 1 4.445 0.004 A 36 THR HB H 1 4.443 0.006 A 36 THR HG2% H 1 1.196 0.003 A 36 THR C C 13 174.231 0.026 A 36 THR CA C 13 61.727 0.047 A 36 THR CB C 13 69.213 0.084 A 36 THR CG2 C 13 21.640 0.026 A 36 THR N N 15 111.916 0.046 A 37 THR H H 1 7.303 0.004 A 37 THR HA H 1 5.232 0.004 A 37 THR HB H 1 4.497 0.008 A 37 THR HG2% H 1 1.146 0.003 A 37 THR C C 13 175.848 0.010 A 37 THR CA C 13 58.599 0.039 A 37 THR CB C 13 71.971 0.103 A 37 THR CG2 C 13 22.261 0.069 A 37 THR N N 15 110.288 0.141 A 38 LEU H H 1 9.065 0.007 A 38 LEU HA H 1 3.829 0.004 A 38 LEU HBy H 1 2.151 0.005 A 38 LEU HBx H 1 1.014 0.005 A 38 LEU HD1% H 1 0.843 0.003 A 38 LEU HD2% H 1 0.488 0.004 A 38 LEU HG H 1 1.419 0.005 A 38 LEU C C 13 177.964 0.029 A 38 LEU CA C 13 57.613 0.057 A 38 LEU CB C 13 41.058 0.024 A 38 LEU CD1 C 13 25.301 0.085 A 38 LEU CD2 C 13 22.004 0.073 A 38 LEU CG C 13 26.937 0.027 A 38 LEU N N 15 122.441 0.082 A 39 GLY H H 1 8.753 0.006 A 39 GLY HAy H 1 3.969 0.005 A 39 GLY HAx H 1 3.769 0.007 A 39 GLY C C 13 176.615 0.000 A 39 GLY CA C 13 47.314 0.024 A 39 GLY N N 15 104.356 0.008 A 40 LYS H H 1 7.341 0.007 A 40 LYS HA H 1 4.241 0.004 A 40 LYS HBx H 1 1.819 0.003 A 40 LYS HBy H 1 1.819 0.003 A 40 LYS HDx H 1 1.706 0.002 A 40 LYS HDy H 1 1.706 0.002 A 40 LYS HEx H 1 2.984 0.005 A 40 LYS HEy H 1 2.984 0.005 A 40 LYS HGy H 1 1.541 0.003 A 40 LYS HGx H 1 1.445 0.009 A 40 LYS C C 13 179.292 0.036 A 40 LYS CA C 13 58.108 0.083 A 40 LYS CB C 13 32.346 0.018 A 40 LYS CD C 13 28.403 0.000 A 40 LYS CE C 13 42.381 0.000 A 40 LYS CG C 13 25.221 0.035 A 40 LYS N N 15 120.741 0.010 A 41 LEU H H 1 8.033 0.004 A 41 LEU HA H 1 4.059 0.005 A 41 LEU HBy H 1 1.751 0.004 A 41 LEU HBx H 1 1.428 0.007 A 41 LEU HD1% H 1 0.816 0.003 A 41 LEU HD2% H 1 0.914 0.005 A 41 LEU HG H 1 1.620 0.003 A 41 LEU C C 13 177.253 0.017 A 41 LEU CA C 13 57.978 0.096 A 41 LEU CB C 13 41.760 0.043 A 41 LEU CD1 C 13 27.731 0.042 A 41 LEU CD2 C 13 22.814 0.015 A 41 LEU CG C 13 26.870 0.080 A 41 LEU N N 15 121.501 0.108 A 42 ASP H H 1 9.025 0.005 A 42 ASP HA H 1 4.045 0.004 A 42 ASP HBy H 1 2.707 0.002 A 42 ASP HBx H 1 2.454 0.005 A 42 ASP C C 13 176.536 0.001 A 42 ASP CA C 13 58.740 0.080 A 42 ASP CB C 13 44.783 0.055 A 42 ASP N N 15 119.776 0.011 A 43 GLU H H 1 7.253 0.007 A 43 GLU HA H 1 3.869 0.006 A 43 GLU HBy H 1 2.167 0.006 A 43 GLU HBx H 1 2.091 0.004 A 43 GLU HGy H 1 2.396 0.004 A 43 GLU HGx H 1 2.169 0.002 A 43 GLU C C 13 178.916 0.049 A 43 GLU CA C 13 59.511 0.084 A 43 GLU CB C 13 30.131 0.118 A 43 GLU CG C 13 36.002 0.045 A 43 GLU N N 15 116.304 0.051 A 44 ARG H H 1 7.234 0.002 A 44 ARG HA H 1 3.920 0.005 A 44 ARG HBy H 1 1.863 0.004 A 44 ARG HBx H 1 1.627 0.004 A 44 ARG HDy H 1 3.146 0.009 A 44 ARG HDx H 1 3.015 0.008 A 44 ARG HE H 1 7.417 0.000 A 44 ARG HGy H 1 1.340 0.004 A 44 ARG HGx H 1 1.218 0.012 A 44 ARG HH2x H 1 6.742 0.02 A 44 ARG C C 13 177.609 0.016 A 44 ARG CA C 13 58.607 0.125 A 44 ARG CB C 13 30.304 0.016 A 44 ARG CD C 13 43.224 0.145 A 44 ARG CG C 13 26.231 0.070 A 44 ARG N N 15 118.267 0.086 A 44 ARG NE N 15 83.805 0.1 A 44 ARG NH2 N 15 71.802 0.1 A 45 LEU H H 1 8.734 0.004 A 45 LEU HA H 1 3.809 0.004 A 45 LEU HBy H 1 1.925 0.004 A 45 LEU HBx H 1 1.450 0.003 A 45 LEU HD1% H 1 0.938 0.004 A 45 LEU HD2% H 1 0.911 0.003 A 45 LEU HG H 1 1.807 0.006 A 45 LEU C C 13 179.204 0.025 A 45 LEU CA C 13 58.248 0.069 A 45 LEU CB C 13 42.076 0.003 A 45 LEU CD1 C 13 27.245 0.011 A 45 LEU CD2 C 13 22.776 0.052 A 45 LEU CG C 13 27.094 0.099 A 45 LEU N N 15 117.856 0.003 A 46 ARG H H 1 8.280 0.004 A 46 ARG HA H 1 3.863 0.005 A 46 ARG HBy H 1 1.932 0.005 A 46 ARG HBx H 1 1.739 0.011 A 46 ARG HDy H 1 3.299 0.005 A 46 ARG HDx H 1 2.849 0.005 A 46 ARG HE H 1 9.533 0.003 A 46 ARG HGx H 1 1.411 0.005 A 46 ARG HGy H 1 1.411 0.005 A 46 ARG HH1x H 1 6.587 0.003 A 46 ARG HH2x H 1 6.229 0.005 A 46 ARG C C 13 179.432 0.020 A 46 ARG CA C 13 60.779 0.127 A 46 ARG CB C 13 29.824 0.027 A 46 ARG CD C 13 43.166 0.113 A 46 ARG CG C 13 29.796 0.033 A 46 ARG N N 15 115.954 0.022 A 46 ARG NE N 15 91.207 0.1 A 46 ARG NHy N 15 71.535 0.1 A 46 ARG NHx N 15 70.2 0.1 A 47 ASN H H 1 7.433 0.003 A 47 ASN HA H 1 4.458 0.003 A 47 ASN HBy H 1 2.965 0.003 A 47 ASN HBx H 1 2.864 0.003 A 47 ASN HD2y H 1 7.466 0.004 A 47 ASN HD2x H 1 7.056 0.007 A 47 ASN C C 13 177.657 0.032 A 47 ASN CA C 13 56.297 0.077 A 47 ASN CB C 13 38.540 0.022 A 47 ASN CG C 13 176.045 0.001 A 47 ASN N N 15 118.514 0.012 A 47 ASN ND2 N 15 112.729 0.011 A 48 TYR H H 1 8.945 0.004 A 48 TYR HA H 1 4.184 0.003 A 48 TYR HBy H 1 3.406 0.007 A 48 TYR HBx H 1 3.288 0.004 A 48 TYR HDx H 1 7.015 0.005 A 48 TYR HDy H 1 7.015 0.005 A 48 TYR HEx H 1 6.868 0.014 A 48 TYR HEy H 1 6.868 0.014 A 48 TYR C C 13 177.806 0.026 A 48 TYR CA C 13 58.651 0.070 A 48 TYR CB C 13 36.527 0.009 A 48 TYR CD1 C 13 131.269 0.1 A 48 TYR CE1 C 13 118.031 0.1 A 48 TYR N N 15 121.714 0.001 A 49 LEU H H 1 8.293 0.003 A 49 LEU HA H 1 3.410 0.004 A 49 LEU HBy H 1 1.609 0.004 A 49 LEU HBx H 1 1.049 0.005 A 49 LEU HD1% H 1 0.595 0.004 A 49 LEU HD2% H 1 -1.144 0.005 A 49 LEU HG H 1 0.795 0.006 A 49 LEU C C 13 179.153 0.052 A 49 LEU CA C 13 57.822 0.060 A 49 LEU CB C 13 41.929 0.049 A 49 LEU CD1 C 13 25.388 0.045 A 49 LEU CD2 C 13 21.213 0.103 A 49 LEU CG C 13 25.527 0.034 A 49 LEU N N 15 119.284 0.138 A 50 LYS H H 1 7.322 0.005 A 50 LYS HA H 1 3.893 0.005 A 50 LYS HBy H 1 1.949 0.010 A 50 LYS HBx H 1 1.910 0.010 A 50 LYS HDx H 1 1.689 0.003 A 50 LYS HDy H 1 1.689 0.003 A 50 LYS HEx H 1 2.972 0.004 A 50 LYS HEy H 1 2.972 0.004 A 50 LYS HGy H 1 1.551 0.010 A 50 LYS HGx H 1 1.450 0.004 A 50 LYS C C 13 177.980 0.044 A 50 LYS CA C 13 59.104 0.100 A 50 LYS CB C 13 32.348 0.035 A 50 LYS CD C 13 29.276 0.000 A 50 LYS CE C 13 42.325 0.095 A 50 LYS CG C 13 24.995 0.032 A 50 LYS N N 15 117.005 0.108 A 51 LYS H H 1 7.435 0.003 A 51 LYS HA H 1 4.080 0.003 A 51 LYS HBx H 1 1.313 0.006 A 51 LYS HBy H 1 1.313 0.006 A 51 LYS HDx H 1 1.285 0.005 A 51 LYS HDy H 1 1.285 0.005 A 51 LYS HEx H 1 2.843 0.003 A 51 LYS HEy H 1 2.843 0.003 A 51 LYS HGx H 1 1.169 0.003 A 51 LYS HGy H 1 1.169 0.003 A 51 LYS C C 13 178.971 0.025 A 51 LYS CA C 13 57.418 0.049 A 51 LYS CB C 13 32.675 0.031 A 51 LYS CD C 13 28.494 0.049 A 51 LYS CE C 13 42.198 0.040 A 51 LYS CG C 13 24.641 0.076 A 51 LYS N N 15 115.946 0.013 A 52 GLY H H 1 8.290 0.004 A 52 GLY HAx H 1 3.897 0.007 A 52 GLY HAy H 1 4.181 0.007 A 52 GLY C C 13 173.610 0.019 A 52 GLY CA C 13 45.088 0.069 A 52 GLY N N 15 105.432 0.104 A 53 THR H H 1 7.148 0.004 A 53 THR HA H 1 4.838 0.008 A 53 THR HB H 1 4.328 0.003 A 53 THR HG1 H 1 3.620 0.002 A 53 THR HG2% H 1 0.241 0.003 A 53 THR C C 13 174.444 0.005 A 53 THR CA C 13 59.766 0.106 A 53 THR CB C 13 72.471 0.075 A 53 THR CG2 C 13 22.949 0.045 A 53 THR N N 15 107.608 0.031 A 54 LYS H H 1 8.414 0.003 A 54 LYS HA H 1 4.355 0.003 A 54 LYS HBy H 1 1.885 0.001 A 54 LYS HBx H 1 1.849 0.002 A 54 LYS HDx H 1 1.709 0.004 A 54 LYS HDy H 1 1.709 0.004 A 54 LYS HEx H 1 3.029 0.004 A 54 LYS HEy H 1 3.029 0.004 A 54 LYS HGy H 1 1.571 0.001 A 54 LYS HGx H 1 1.517 0.003 A 54 LYS C C 13 177.632 0.007 A 54 LYS CA C 13 57.393 0.030 A 54 LYS CB C 13 32.806 0.027 A 54 LYS CD C 13 28.859 0.115 A 54 LYS CE C 13 42.450 0.000 A 54 LYS CG C 13 24.918 0.064 A 54 LYS N N 15 118.924 0.101 A 55 ASN H H 1 7.823 0.003 A 55 ASN HA H 1 4.992 0.004 A 55 ASN HBy H 1 2.888 0.003 A 55 ASN HBx H 1 2.651 0.002 A 55 ASN HD2y H 1 7.535 0.004 A 55 ASN HD2x H 1 6.831 0.004 A 55 ASN C C 13 174.882 0.055 A 55 ASN CA C 13 51.540 0.019 A 55 ASN CB C 13 38.209 0.010 A 55 ASN CG C 13 177.634 0.000 A 55 ASN N N 15 116.576 0.003 A 55 ASN ND2 N 15 110.263 0.114 A 56 SER H H 1 8.557 0.007 A 56 SER HA H 1 4.145 0.003 A 56 SER HBy H 1 3.780 0.005 A 56 SER HBx H 1 3.726 0.013 A 56 SER C C 13 176.886 0.038 A 56 SER CA C 13 61.051 0.117 A 56 SER CB C 13 62.398 0.093 A 56 SER N N 15 118.968 0.145 A 57 ALA H H 1 8.133 0.003 A 57 ALA HA H 1 4.277 0.004 A 57 ALA HB% H 1 1.490 0.004 A 57 ALA C C 13 177.779 0.001 A 57 ALA CA C 13 54.020 0.053 A 57 ALA CB C 13 18.258 0.030 A 57 ALA N N 15 125.334 0.084 A 58 GLN H H 1 7.113 0.003 A 58 GLN HA H 1 4.262 0.006 A 58 GLN HBy H 1 2.090 0.004 A 58 GLN HBx H 1 1.645 0.008 A 58 GLN HE2y H 1 7.163 0.004 A 58 GLN HE2x H 1 6.748 0.003 A 58 GLN HGy H 1 2.296 0.004 A 58 GLN HGx H 1 0.956 0.008 A 58 GLN C C 13 174.984 0.002 A 58 GLN CA C 13 56.272 0.066 A 58 GLN CB C 13 28.627 0.009 A 58 GLN CD C 13 179.597 0.004 A 58 GLN CG C 13 32.100 0.050 A 58 GLN N N 15 112.472 0.076 A 58 GLN NE2 N 15 112.434 0.037 A 59 PHE H H 1 7.361 0.009 A 59 PHE HA H 1 4.622 0.005 A 59 PHE HBy H 1 2.992 0.004 A 59 PHE HBx H 1 2.808 0.005 A 59 PHE HDx H 1 7.153 0.004 A 59 PHE HDy H 1 7.153 0.004 A 59 PHE HEx H 1 7.212 0.006 A 59 PHE HEy H 1 7.212 0.006 A 59 PHE HZ H 1 6.989 0.007 A 59 PHE C C 13 173.987 0.014 A 59 PHE CA C 13 59.534 0.050 A 59 PHE CB C 13 38.939 0.042 A 59 PHE CD1 C 13 131.9 0.1 A 59 PHE CE1 C 13 131.9 0.1 A 59 PHE CZ C 13 129.628 0.1 A 59 PHE N N 15 118.258 0.078 A 60 GLU H H 1 9.228 0.003 A 60 GLU HA H 1 4.479 0.005 A 60 GLU HBx H 1 2.033 0.003 A 60 GLU HBy H 1 2.033 0.003 A 60 GLU HGy H 1 2.466 0.004 A 60 GLU HGx H 1 2.284 0.003 A 60 GLU C C 13 176.282 0.022 A 60 GLU CA C 13 57.063 0.042 A 60 GLU CB C 13 33.512 0.017 A 60 GLU CG C 13 36.689 0.040 A 60 GLU N N 15 125.247 0.003 A 61 LYS H H 1 7.998 0.004 A 61 LYS HA H 1 5.074 0.007 A 61 LYS HBy H 1 1.262 0.006 A 61 LYS HBx H 1 1.099 0.005 A 61 LYS HDy H 1 0.992 0.006 A 61 LYS HDx H 1 0.880 0.005 A 61 LYS HEy H 1 2.259 0.004 A 61 LYS HEx H 1 2.088 0.008 A 61 LYS HGy H 1 1.139 0.007 A 61 LYS HGx H 1 0.739 0.004 A 61 LYS C C 13 172.325 0.016 A 61 LYS CA C 13 54.881 0.022 A 61 LYS CB C 13 35.683 0.022 A 61 LYS CD C 13 30.049 0.110 A 61 LYS CE C 13 41.443 0.075 A 61 LYS CG C 13 23.363 0.036 A 61 LYS N N 15 113.709 0.028 A 62 MET H H 1 9.051 0.006 A 62 MET HA H 1 5.630 0.004 A 62 MET HBy H 1 1.242 0.004 A 62 MET HBx H 1 0.859 0.005 A 62 MET HE% H 1 2.000 0.004 A 62 MET HGy H 1 2.419 0.006 A 62 MET HGx H 1 2.102 0.006 A 62 MET C C 13 172.898 0.013 A 62 MET CA C 13 53.043 0.005 A 62 MET CB C 13 35.214 0.059 A 62 MET CE C 13 19.540 0.044 A 62 MET CG C 13 31.968 0.034 A 62 MET N N 15 118.635 0.132 A 63 VAL H H 1 9.186 0.003 A 63 VAL HA H 1 4.700 0.004 A 63 VAL HB H 1 1.776 0.004 A 63 VAL HGx% H 1 0.756 0.003 A 63 VAL HGy% H 1 0.249 0.004 A 63 VAL C C 13 174.133 0.006 A 63 VAL CA C 13 61.351 0.065 A 63 VAL CB C 13 34.651 0.049 A 63 VAL CGy C 13 21.440 0.027 A 63 VAL CGx C 13 20.450 0.033 A 63 VAL N N 15 122.441 0.082 A 64 ILE H H 1 9.244 0.005 A 64 ILE HA H 1 4.302 0.005 A 64 ILE HB H 1 1.898 0.004 A 64 ILE HD1% H 1 0.619 0.004 A 64 ILE HG1y H 1 1.440 0.004 A 64 ILE HG1x H 1 1.109 0.003 A 64 ILE HG2% H 1 0.681 0.003 A 64 ILE C C 13 174.924 0.020 A 64 ILE CA C 13 60.422 0.078 A 64 ILE CB C 13 41.255 0.027 A 64 ILE CD1 C 13 14.568 0.050 A 64 ILE CG1 C 13 27.106 0.019 A 64 ILE CG2 C 13 17.605 0.067 A 64 ILE N N 15 127.876 0.056 A 65 LEU H H 1 9.117 0.006 A 65 LEU HA H 1 5.531 0.005 A 65 LEU HBy H 1 2.164 0.004 A 65 LEU HBx H 1 1.682 0.005 A 65 LEU HD1% H 1 1.138 0.004 A 65 LEU HD2% H 1 0.955 0.004 A 65 LEU HG H 1 1.864 0.005 A 65 LEU C C 13 178.538 0.059 A 65 LEU CA C 13 53.047 0.023 A 65 LEU CB C 13 43.797 0.026 A 65 LEU CD1 C 13 26.883 0.056 A 65 LEU CD2 C 13 24.821 0.057 A 65 LEU CG C 13 27.946 0.050 A 65 LEU N N 15 125.572 0.001 A 66 THR H H 1 8.634 0.003 A 66 THR HA H 1 5.212 0.004 A 66 THR HB H 1 4.155 0.003 A 66 THR HG2% H 1 1.043 0.004 A 66 THR C C 13 174.918 0.013 A 66 THR CA C 13 59.374 0.052 A 66 THR CB C 13 72.100 0.028 A 66 THR CG2 C 13 20.842 0.051 A 66 THR N N 15 112.840 0.122 A 67 GLU H H 1 8.580 0.002 A 67 GLU HA H 1 4.469 0.006 A 67 GLU HBx H 1 2.019 0.003 A 67 GLU HBy H 1 2.019 0.003 A 67 GLU HGy H 1 2.649 0.005 A 67 GLU HGx H 1 2.568 0.007 A 67 GLU C C 13 177.333 0.019 A 67 GLU CA C 13 57.348 0.102 A 67 GLU CB C 13 31.357 0.077 A 67 GLU CG C 13 37.372 0.001 A 67 GLU N N 15 118.675 0.058 A 68 ASN H H 1 8.580 0.003 A 68 ASN HA H 1 3.768 0.006 A 68 ASN HBy H 1 3.191 0.004 A 68 ASN HBx H 1 2.838 0.005 A 68 ASN HD2y H 1 7.840 0.006 A 68 ASN HD2x H 1 7.150 0.003 A 68 ASN C C 13 172.921 0.036 A 68 ASN CA C 13 54.686 0.072 A 68 ASN CB C 13 36.511 0.055 A 68 ASN CG C 13 178.146 0.000 A 68 ASN N N 15 114.341 0.016 A 68 ASN ND2 N 15 116.070 0.139 A 69 LYS H H 1 7.891 0.005 A 69 LYS HA H 1 3.936 0.005 A 69 LYS HBy H 1 1.933 0.005 A 69 LYS HBx H 1 1.889 0.007 A 69 LYS HDx H 1 1.533 0.003 A 69 LYS HDy H 1 1.533 0.003 A 69 LYS HEx H 1 2.834 0.004 A 69 LYS HEy H 1 2.834 0.004 A 69 LYS HGy H 1 1.047 0.006 A 69 LYS HGx H 1 0.958 0.006 A 69 LYS C C 13 177.032 0.029 A 69 LYS CA C 13 56.758 0.083 A 69 LYS CB C 13 28.099 0.005 A 69 LYS CD C 13 28.700 0.123 A 69 LYS CE C 13 41.870 0.076 A 69 LYS CG C 13 24.779 0.095 A 69 LYS N N 15 107.932 0.033 A 70 GLY H H 1 6.998 0.002 A 70 GLY HAy H 1 4.362 0.008 A 70 GLY HAx H 1 3.875 0.008 A 70 GLY C C 13 173.763 0.033 A 70 GLY CA C 13 46.628 0.046 A 70 GLY N N 15 107.011 0.076 A 71 TYR H H 1 7.679 0.002 A 71 TYR HA H 1 5.097 0.004 A 71 TYR HBy H 1 2.959 0.004 A 71 TYR HBx H 1 2.573 0.004 A 71 TYR HDx H 1 6.893 0.004 A 71 TYR HDy H 1 6.893 0.004 A 71 TYR HEx H 1 6.600 0.005 A 71 TYR HEy H 1 6.600 0.005 A 71 TYR C C 13 174.452 0.014 A 71 TYR CA C 13 57.730 0.046 A 71 TYR CB C 13 40.474 0.086 A 71 TYR CD1 C 13 133.102 0.1 A 71 TYR CE1 C 13 118.199 0.1 A 71 TYR N N 15 129.822 0.074 A 72 TYR H H 1 9.101 0.004 A 72 TYR HA H 1 4.875 0.004 A 72 TYR HBy H 1 2.870 0.003 A 72 TYR HBx H 1 2.691 0.003 A 72 TYR HDx H 1 7.010 0.005 A 72 TYR HDy H 1 7.010 0.005 A 72 TYR HEx H 1 6.804 0.007 A 72 TYR HEy H 1 6.804 0.007 A 72 TYR C C 13 174.448 0.010 A 72 TYR CA C 13 56.114 0.068 A 72 TYR CB C 13 41.115 0.010 A 72 TYR CD1 C 13 133.843 0.1 A 72 TYR CE1 C 13 118.059 0.1 A 72 TYR N N 15 126.527 0.008 A 73 THR H H 1 9.022 0.003 A 73 THR HA H 1 4.876 0.004 A 73 THR HB H 1 4.027 0.004 A 73 THR HG2% H 1 0.928 0.002 A 73 THR C C 13 174.791 0.042 A 73 THR CA C 13 62.821 0.111 A 73 THR CB C 13 68.769 0.012 A 73 THR CG2 C 13 21.210 0.023 A 73 THR N N 15 120.810 0.059 A 74 VAL H H 1 9.233 0.004 A 74 VAL HA H 1 4.427 0.005 A 74 VAL HB H 1 1.838 0.004 A 74 VAL HGx% H 1 0.973 0.004 A 74 VAL HGy% H 1 0.756 0.004 A 74 VAL C C 13 175.094 0.032 A 74 VAL CA C 13 61.457 0.079 A 74 VAL CB C 13 35.669 0.039 A 74 VAL CGy C 13 21.429 0.028 A 74 VAL CGx C 13 20.300 0.039 A 74 VAL N N 15 129.156 0.051 A 75 TYR H H 1 9.384 0.003 A 75 TYR HA H 1 4.528 0.005 A 75 TYR HBy H 1 3.349 0.005 A 75 TYR HBx H 1 3.057 0.006 A 75 TYR HDx H 1 7.289 0.004 A 75 TYR HDy H 1 7.289 0.004 A 75 TYR HEx H 1 6.788 0.004 A 75 TYR HEy H 1 6.788 0.004 A 75 TYR C C 13 176.497 0.038 A 75 TYR CA C 13 59.843 0.047 A 75 TYR CB C 13 38.245 0.016 A 75 TYR CD1 C 13 133.008 0.1 A 75 TYR CE1 C 13 118.147 0.1 A 75 TYR N N 15 128.465 0.001 A 76 LEU H H 1 8.524 0.002 A 76 LEU HA H 1 4.528 0.005 A 76 LEU HBy H 1 1.698 0.004 A 76 LEU HBx H 1 1.557 0.006 A 76 LEU HD1% H 1 0.924 0.003 A 76 LEU HD2% H 1 0.924 0.009 A 76 LEU HG H 1 1.502 0.005 A 76 LEU C C 13 177.001 0.001 A 76 LEU CA C 13 55.010 0.081 A 76 LEU CB C 13 42.094 0.025 A 76 LEU CD1 C 13 25.942 0.065 A 76 LEU CD2 C 13 21.675 0.087 A 76 LEU CG C 13 27.628 0.015 A 76 LEU N N 15 119.547 0.081 A 77 ASN H H 1 8.599 0.003 A 77 ASN HA H 1 4.618 0.006 A 77 ASN HBy H 1 3.181 0.002 A 77 ASN HBx H 1 3.046 0.004 A 77 ASN HD2y H 1 7.747 0.004 A 77 ASN HD2x H 1 6.986 0.004 A 77 ASN C C 13 173.844 0.027 A 77 ASN CA C 13 54.045 0.016 A 77 ASN CB C 13 37.058 0.058 A 77 ASN CG C 13 177.423 0.004 A 77 ASN N N 15 116.407 0.155 A 77 ASN ND2 N 15 111.798 0.044 A 78 THR H H 1 7.429 0.003 A 78 THR HA H 1 4.803 0.098 A 78 THR HB H 1 4.249 0.003 A 78 THR HG2% H 1 1.176 0.002 A 78 THR C C 13 175.201 0.000 A 78 THR CA C 13 58.577 0.057 A 78 THR CB C 13 70.494 0.133 A 78 THR CG2 C 13 21.041 0.030 A 78 THR N N 15 111.551 0.118 A 79 PRO HA H 1 4.462 0.004 A 79 PRO HBy H 1 2.309 0.005 A 79 PRO HBx H 1 1.783 0.003 A 79 PRO HDy H 1 3.797 0.005 A 79 PRO HDx H 1 3.679 0.004 A 79 PRO HGy H 1 2.010 0.004 A 79 PRO HGx H 1 1.909 0.004 A 79 PRO C C 13 176.670 0.022 A 79 PRO CA C 13 62.384 0.069 A 79 PRO CB C 13 32.205 0.102 A 79 PRO CD C 13 51.061 0.057 A 79 PRO CG C 13 27.583 0.064 A 80 LEU H H 1 9.049 0.003 A 80 LEU HA H 1 4.081 0.005 A 80 LEU HBy H 1 1.541 0.004 A 80 LEU HBx H 1 1.402 0.005 A 80 LEU HD1% H 1 0.707 0.004 A 80 LEU HD2% H 1 0.913 0.004 A 80 LEU HG H 1 1.813 0.002 A 80 LEU C C 13 176.758 0.012 A 80 LEU CA C 13 55.315 0.089 A 80 LEU CB C 13 41.915 0.007 A 80 LEU CD1 C 13 27.083 0.002 A 80 LEU CD2 C 13 24.052 0.063 A 80 LEU CG C 13 26.096 0.125 A 80 LEU N N 15 126.341 0.127 A 81 ALA H H 1 8.415 0.003 A 81 ALA HA H 1 4.187 0.004 A 81 ALA HB% H 1 1.495 0.002 A 81 ALA C C 13 179.005 0.018 A 81 ALA CA C 13 52.851 0.045 A 81 ALA CB C 13 19.625 0.070 A 81 ALA N N 15 129.745 0.003 A 82 GLU H H 1 8.739 0.003 A 82 GLU HA H 1 3.815 0.006 A 82 GLU HBx H 1 2.080 0.003 A 82 GLU HBy H 1 2.080 0.003 A 82 GLU HGx H 1 2.387 0.004 A 82 GLU HGy H 1 2.387 0.004 A 82 GLU C C 13 178.591 0.034 A 82 GLU CA C 13 59.566 0.101 A 82 GLU CB C 13 29.774 0.045 A 82 GLU CG C 13 35.767 0.107 A 82 GLU N N 15 121.424 0.030 A 83 ASP H H 1 8.511 0.005 A 83 ASP HA H 1 4.427 0.004 A 83 ASP HBy H 1 2.833 0.002 A 83 ASP HBx H 1 2.681 0.002 A 83 ASP C C 13 177.306 0.008 A 83 ASP CA C 13 55.398 0.014 A 83 ASP CB C 13 39.430 0.079 A 83 ASP N N 15 114.043 0.038 A 84 ARG H H 1 7.800 0.003 A 84 ARG HA H 1 4.527 0.005 A 84 ARG HBy H 1 2.186 0.005 A 84 ARG HBx H 1 1.729 0.005 A 84 ARG HDy H 1 3.433 0.004 A 84 ARG HDx H 1 3.177 0.004 A 84 ARG HE H 1 7.162 0.005 A 84 ARG HGy H 1 1.932 0.008 A 84 ARG HGx H 1 1.630 0.005 A 84 ARG HH21 H 1 6.681 0.005 A 84 ARG C C 13 176.966 0.042 A 84 ARG CA C 13 55.915 0.090 A 84 ARG CB C 13 31.804 0.023 A 84 ARG CD C 13 44.171 0.075 A 84 ARG CG C 13 26.828 0.070 A 84 ARG N N 15 118.147 0.034 A 84 ARG NE N 15 85.075 0.1 A 84 ARG NH2 N 15 69.950 0.1 A 85 LYS H H 1 7.335 0.004 A 85 LYS HA H 1 3.551 0.003 A 85 LYS HBx H 1 1.846 0.008 A 85 LYS HBy H 1 1.846 0.008 A 85 LYS HDx H 1 1.669 0.008 A 85 LYS HDy H 1 1.669 0.008 A 85 LYS HEy H 1 2.979 0.009 A 85 LYS HEx H 1 2.885 0.004 A 85 LYS HGy H 1 1.646 0.005 A 85 LYS HGx H 1 1.322 0.005 A 85 LYS C C 13 178.113 0.022 A 85 LYS CA C 13 59.887 0.032 A 85 LYS CB C 13 32.935 0.099 A 85 LYS CD C 13 29.659 0.050 A 85 LYS CE C 13 42.056 0.045 A 85 LYS CG C 13 26.064 0.061 A 85 LYS N N 15 116.576 0.003 A 86 ASN H H 1 8.347 0.003 A 86 ASN HA H 1 4.886 0.007 A 86 ASN HBy H 1 3.009 0.005 A 86 ASN HBx H 1 2.705 0.004 A 86 ASN HD2y H 1 7.587 0.000 A 86 ASN HD2x H 1 6.911 0.001 A 86 ASN C C 13 174.736 0.065 A 86 ASN CA C 13 52.265 0.086 A 86 ASN CB C 13 38.239 0.053 A 86 ASN CG C 13 177.287 0.001 A 86 ASN N N 15 114.341 0.016 A 86 ASN ND2 N 15 112.835 0.117 A 87 VAL H H 1 6.985 0.004 A 87 VAL HA H 1 3.746 0.003 A 87 VAL HB H 1 2.064 0.004 A 87 VAL HGx% H 1 1.147 0.002 A 87 VAL HGy% H 1 0.986 0.003 A 87 VAL C C 13 175.380 0.009 A 87 VAL CA C 13 63.723 0.067 A 87 VAL CB C 13 32.650 0.016 A 87 VAL CGy C 13 22.775 0.049 A 87 VAL CGx C 13 20.867 0.064 A 87 VAL N N 15 121.424 0.030 A 88 GLU H H 1 8.777 0.005 A 88 GLU HA H 1 4.339 0.004 A 88 GLU HBx H 1 1.972 0.003 A 88 GLU HBy H 1 1.972 0.003 A 88 GLU HGy H 1 2.363 0.003 A 88 GLU HGx H 1 2.233 0.005 A 88 GLU C C 13 176.364 0.060 A 88 GLU CA C 13 56.085 0.065 A 88 GLU CB C 13 29.861 0.043 A 88 GLU CG C 13 36.309 0.083 A 88 GLU N N 15 129.489 0.062 A 89 LEU H H 1 8.230 0.004 A 89 LEU HA H 1 4.299 0.005 A 89 LEU HBy H 1 1.755 0.004 A 89 LEU HBx H 1 1.546 0.005 A 89 LEU HD1% H 1 0.639 0.004 A 89 LEU HD2% H 1 0.229 0.003 A 89 LEU HG H 1 1.309 0.005 A 89 LEU C C 13 178.976 0.031 A 89 LEU CA C 13 54.651 0.079 A 89 LEU CB C 13 42.596 0.039 A 89 LEU CD1 C 13 26.716 0.048 A 89 LEU CD2 C 13 22.328 0.050 A 89 LEU CG C 13 27.373 0.082 A 89 LEU N N 15 124.395 0.109 A 90 LEU H H 1 7.777 0.004 A 90 LEU HA H 1 4.135 0.004 A 90 LEU HBy H 1 1.670 0.004 A 90 LEU HBx H 1 1.542 0.005 A 90 LEU HD1% H 1 0.947 0.004 A 90 LEU HD2% H 1 1.031 0.004 A 90 LEU HG H 1 1.870 0.005 A 90 LEU C C 13 176.394 0.012 A 90 LEU CA C 13 56.754 0.018 A 90 LEU CB C 13 42.413 0.015 A 90 LEU CD1 C 13 24.917 0.085 A 90 LEU CD2 C 13 22.923 0.065 A 90 LEU CG C 13 27.932 0.015 A 90 LEU N N 15 119.734 0.054 A 91 GLY H H 1 7.224 0.005 A 91 GLY HAy H 1 4.165 0.006 A 91 GLY HAx H 1 3.899 0.005 A 91 GLY C C 13 171.742 0.031 A 91 GLY CA C 13 44.969 0.025 A 91 GLY N N 15 103.707 0.014 A 92 LYS H H 1 8.771 0.004 A 92 LYS HA H 1 4.150 0.004 A 92 LYS HBy H 1 1.577 0.002 A 92 LYS HBx H 1 1.477 0.007 A 92 LYS HDx H 1 1.572 0.004 A 92 LYS HDy H 1 1.572 0.004 A 92 LYS HEx H 1 2.996 0.004 A 92 LYS HEy H 1 2.996 0.004 A 92 LYS HGy H 1 1.583 0.007 A 92 LYS HGx H 1 1.457 0.009 A 92 LYS C C 13 177.522 0.025 A 92 LYS CA C 13 56.750 0.019 A 92 LYS CB C 13 33.835 0.012 A 92 LYS CD C 13 29.640 0.064 A 92 LYS CE C 13 41.836 0.253 A 92 LYS CG C 13 24.991 0.080 A 92 LYS N N 15 118.635 0.132 A 93 MET H H 1 9.188 0.004 A 93 MET HA H 1 3.835 0.007 A 93 MET HBy H 1 2.077 0.007 A 93 MET HBx H 1 1.900 0.010 A 93 MET HE% H 1 1.876 0.003 A 93 MET HGx H 1 2.432 0.004 A 93 MET HGy H 1 2.432 0.004 A 93 MET C C 13 173.913 0.016 A 93 MET CA C 13 59.275 0.137 A 93 MET CB C 13 31.483 0.016 A 93 MET CE C 13 17.582 0.051 A 93 MET CG C 13 33.510 0.016 A 93 MET N N 15 123.413 0.091 A 94 TYR H H 1 9.421 0.006 A 94 TYR HA H 1 4.767 0.009 A 94 TYR HBy H 1 2.904 0.005 A 94 TYR HBx H 1 2.300 0.002 A 94 TYR HDx H 1 6.875 0.004 A 94 TYR HDy H 1 6.875 0.004 A 94 TYR HEx H 1 6.775 0.008 A 94 TYR HEy H 1 6.775 0.008 A 94 TYR C C 13 173.918 0.098 A 94 TYR CA C 13 56.933 0.033 A 94 TYR CB C 13 40.020 0.039 A 94 TYR CD1 C 13 133.098 0.1 A 94 TYR CE1 C 13 118.080 0.1 A 94 TYR N N 15 129.403 0.024 A 95 LYS H H 1 7.289 0.004 A 95 LYS HA H 1 4.688 0.005 A 95 LYS HBy H 1 0.943 0.004 A 95 LYS HBx H 1 0.840 0.007 A 95 LYS HDy H 1 1.203 0.005 A 95 LYS HDx H 1 1.035 0.006 A 95 LYS HEy H 1 2.566 0.003 A 95 LYS HEx H 1 2.455 0.003 A 95 LYS HGy H 1 0.640 0.007 A 95 LYS HGx H 1 0.069 0.007 A 95 LYS C C 13 175.000 0.018 A 95 LYS CA C 13 55.841 0.069 A 95 LYS CB C 13 40.404 0.014 A 95 LYS CD C 13 30.844 0.041 A 95 LYS CE C 13 42.114 0.046 A 95 LYS CG C 13 25.747 0.014 A 95 LYS N N 15 118.804 0.019 A 96 THR H H 1 8.727 0.003 A 96 THR HA H 1 5.149 0.004 A 96 THR HB H 1 3.670 0.004 A 96 THR HG1 H 1 3.306 0.003 A 96 THR HG2% H 1 0.642 0.004 A 96 THR C C 13 172.120 0.012 A 96 THR CA C 13 62.226 0.091 A 96 THR CB C 13 71.787 0.097 A 96 THR CG2 C 13 23.141 0.003 A 96 THR N N 15 116.235 0.018 A 97 TYR H H 1 8.969 0.003 A 97 TYR HA H 1 5.027 0.004 A 97 TYR HBy H 1 2.727 0.007 A 97 TYR HBx H 1 2.586 0.006 A 97 TYR HDx H 1 6.877 0.007 A 97 TYR HDy H 1 6.877 0.007 A 97 TYR HEx H 1 6.387 0.008 A 97 TYR HEy H 1 6.387 0.008 A 97 TYR C C 13 175.077 0.016 A 97 TYR CA C 13 57.278 0.043 A 97 TYR CB C 13 42.054 0.035 A 97 TYR CD1 C 13 133.691 0.1 A 97 TYR CE1 C 13 117.495 0.1 A 97 TYR N N 15 125.256 0.006 A 98 PHE H H 1 9.189 0.004 A 98 PHE HA H 1 5.177 0.004 A 98 PHE HBy H 1 2.767 0.004 A 98 PHE HBx H 1 2.562 0.006 A 98 PHE HDx H 1 6.898 0.006 A 98 PHE HDy H 1 6.898 0.006 A 98 PHE HEx H 1 7.006 0.004 A 98 PHE HEy H 1 7.006 0.004 A 98 PHE HZ H 1 6.999 0.004 A 98 PHE C C 13 174.791 0.041 A 98 PHE CA C 13 57.825 0.087 A 98 PHE CB C 13 42.377 0.015 A 98 PHE CD1 C 13 131.696 0.1 A 98 PHE CE1 C 13 131.812 0.1 A 98 PHE CZ C 13 129.938 0.1 A 98 PHE N N 15 118.574 0.072 A 99 PHE H H 1 8.976 0.005 A 99 PHE HA H 1 4.893 0.006 A 99 PHE HBy H 1 3.219 0.004 A 99 PHE HBx H 1 2.976 0.005 A 99 PHE HDx H 1 7.022 0.004 A 99 PHE HDy H 1 7.022 0.004 A 99 PHE HEx H 1 7.259 0.006 A 99 PHE HEy H 1 7.259 0.006 A 99 PHE HZ H 1 6.887 0.002 A 99 PHE C C 13 176.386 0.005 A 99 PHE CA C 13 56.777 0.048 A 99 PHE CB C 13 41.371 0.023 A 99 PHE CD1 C 13 131.812 0.1 A 99 PHE CE1 C 13 131.902 0.1 A 99 PHE CZ C 13 128.868 0.1 A 99 PHE N N 15 119.573 0.107 A 100 LYS H H 1 9.479 0.004 A 100 LYS HA H 1 4.533 0.004 A 100 LYS HBy H 1 1.885 0.003 A 100 LYS HBx H 1 1.491 0.004 A 100 LYS HDy H 1 1.661 0.009 A 100 LYS HDx H 1 1.516 0.004 A 100 LYS HEy H 1 3.063 0.004 A 100 LYS HEx H 1 2.725 0.004 A 100 LYS HGy H 1 1.341 0.005 A 100 LYS HGx H 1 0.474 0.005 A 100 LYS C C 13 176.156 0.007 A 100 LYS CA C 13 56.706 0.058 A 100 LYS CB C 13 33.667 0.009 A 100 LYS CD C 13 29.953 0.073 A 100 LYS CE C 13 41.615 0.065 A 100 LYS CG C 13 26.577 0.047 A 100 LYS N N 15 125.614 0.044 A 101 LYS H H 1 8.068 0.006 A 101 LYS HA H 1 4.188 0.004 A 101 LYS HBx H 1 1.808 0.005 A 101 LYS HBy H 1 1.808 0.005 A 101 LYS HDx H 1 1.692 0.002 A 101 LYS HDy H 1 1.692 0.002 A 101 LYS HEx H 1 3.006 0.005 A 101 LYS HEy H 1 3.006 0.005 A 101 LYS HGy H 1 1.427 0.010 A 101 LYS HGx H 1 1.394 0.010 A 101 LYS C C 13 177.655 0.030 A 101 LYS CA C 13 58.238 0.038 A 101 LYS CB C 13 32.342 0.022 A 101 LYS CD C 13 29.593 0.050 A 101 LYS CE C 13 42.439 0.007 A 101 LYS CG C 13 24.585 0.074 A 101 LYS N N 15 121.057 0.016 A 102 GLY H H 1 8.899 0.002 A 102 GLY HAy H 1 4.196 0.003 A 102 GLY HAx H 1 3.815 0.004 A 102 GLY C C 13 173.997 0.034 A 102 GLY CA C 13 45.802 0.011 A 102 GLY N N 15 114.112 0.107 A 103 GLU H H 1 8.047 0.002 A 103 GLU HA H 1 4.764 0.005 A 103 GLU HBy H 1 2.357 0.010 A 103 GLU HBx H 1 2.301 0.009 A 103 GLU HGy H 1 2.346 0.005 A 103 GLU HGx H 1 2.294 0.005 A 103 GLU C C 13 175.975 0.060 A 103 GLU CA C 13 56.295 0.077 A 103 GLU CB C 13 31.153 0.001 A 103 GLU CG C 13 37.067 0.059 A 103 GLU N N 15 119.538 0.072 A 104 SER H H 1 8.742 0.012 A 104 SER HA H 1 4.598 0.004 A 104 SER HBy H 1 4.019 0.006 A 104 SER HBx H 1 3.846 0.003 A 104 SER C C 13 171.916 0.042 A 104 SER CA C 13 58.363 0.071 A 104 SER CB C 13 64.025 0.069 A 104 SER N N 15 115.383 0.094 A 105 LYS H H 1 7.608 0.003 A 105 LYS HA H 1 5.588 0.005 A 105 LYS HBy H 1 1.826 0.005 A 105 LYS HBx H 1 1.765 0.005 A 105 LYS HDx H 1 1.740 0.008 A 105 LYS HDy H 1 1.740 0.008 A 105 LYS HEx H 1 3.025 0.004 A 105 LYS HEy H 1 3.025 0.004 A 105 LYS HGy H 1 1.574 0.005 A 105 LYS HGx H 1 1.439 0.005 A 105 LYS C C 13 176.017 0.025 A 105 LYS CA C 13 54.548 0.029 A 105 LYS CB C 13 35.211 0.057 A 105 LYS CD C 13 29.650 0.023 A 105 LYS CE C 13 41.749 0.073 A 105 LYS CG C 13 25.017 0.027 A 105 LYS N N 15 121.040 0.033 A 106 SER H H 1 8.231 0.004 A 106 SER HA H 1 3.377 0.005 A 106 SER HBy H 1 3.993 0.005 A 106 SER HBx H 1 2.775 0.005 A 106 SER C C 13 172.571 0.003 A 106 SER CA C 13 59.650 0.068 A 106 SER CB C 13 64.857 0.037 A 106 SER N N 15 121.783 0.068 A 107 SER H H 1 8.333 0.004 A 107 SER HA H 1 5.025 0.006 A 107 SER HBy H 1 4.229 0.004 A 107 SER HBx H 1 4.126 0.005 A 107 SER C C 13 174.507 0.010 A 107 SER CA C 13 57.561 0.037 A 107 SER CB C 13 65.330 0.036 A 107 SER N N 15 106.276 0.016 A 108 TYR H H 1 7.825 0.008 A 108 TYR HA H 1 4.754 0.010 A 108 TYR HBx H 1 2.216 0.006 A 108 TYR HBy H 1 2.216 0.006 A 108 TYR HDx H 1 5.268 0.007 A 108 TYR HDy H 1 5.268 0.007 A 108 TYR HEx H 1 5.891 0.004 A 108 TYR HEy H 1 5.891 0.004 A 108 TYR C C 13 171.725 0.005 A 108 TYR CA C 13 57.778 0.047 A 108 TYR CB C 13 43.223 0.023 A 108 TYR CD1 C 13 132.840 0.1 A 108 TYR CE1 C 13 116.616 0.1 A 108 TYR N N 15 126.289 0.075 A 109 VAL H H 1 7.760 0.006 A 109 VAL HA H 1 5.215 0.004 A 109 VAL HB H 1 1.459 0.003 A 109 VAL HGx% H 1 0.321 0.003 A 109 VAL HGy% H 1 0.325 0.002 A 109 VAL C C 13 172.526 0.029 A 109 VAL CA C 13 59.193 0.102 A 109 VAL CB C 13 36.173 0.029 A 109 VAL CGy C 13 21.848 0.128 A 109 VAL CGx C 13 19.284 0.077 A 109 VAL N N 15 127.825 0.005 A 110 ILE H H 1 8.616 0.004 A 110 ILE HA H 1 4.011 0.006 A 110 ILE HB H 1 1.447 0.004 A 110 ILE HD1% H 1 1.023 0.004 A 110 ILE HG1y H 1 1.703 0.007 A 110 ILE HG1x H 1 0.909 0.006 A 110 ILE HG2% H 1 0.811 0.004 A 110 ILE C C 13 174.690 0.017 A 110 ILE CA C 13 60.922 0.101 A 110 ILE CB C 13 42.047 0.058 A 110 ILE CD1 C 13 15.579 0.054 A 110 ILE CG1 C 13 28.975 0.016 A 110 ILE CG2 C 13 17.573 0.006 A 110 ILE N N 15 124.001 0.038 A 111 ASN H H 1 8.937 0.007 A 111 ASN HA H 1 4.760 0.007 A 111 ASN HBy H 1 2.827 0.006 A 111 ASN HBx H 1 2.681 0.003 A 111 ASN HD2y H 1 7.573 0.003 A 111 ASN HD2x H 1 7.042 0.001 A 111 ASN C C 13 175.326 0.045 A 111 ASN CA C 13 53.600 0.036 A 111 ASN CB C 13 40.412 0.029 A 111 ASN CG C 13 176.534 0.002 A 111 ASN N N 15 126.229 0.015 A 111 ASN ND2 N 15 111.755 0.012 A 112 GLY H H 1 7.984 0.003 A 112 GLY HAy H 1 4.457 0.004 A 112 GLY HAx H 1 3.847 0.004 A 112 GLY C C 13 171.875 0.000 A 112 GLY CA C 13 43.303 0.036 A 112 GLY N N 15 110.894 0.103 A 113 PRO HA H 1 4.609 0.003 A 113 PRO HBy H 1 2.302 0.004 A 113 PRO HBx H 1 1.984 0.005 A 113 PRO HDy H 1 4.001 0.005 A 113 PRO HDx H 1 3.633 0.006 A 113 PRO HGy H 1 2.237 0.006 A 113 PRO HGx H 1 1.895 0.005 A 113 PRO C C 13 178.327 0.002 A 113 PRO CA C 13 63.342 0.109 A 113 PRO CB C 13 32.232 0.079 A 113 PRO CD C 13 49.358 0.028 A 113 PRO CG C 13 26.919 0.038 A 114 GLY H H 1 8.939 0.002 A 114 GLY HAy H 1 4.055 0.005 A 114 GLY HAx H 1 3.192 0.005 A 114 GLY C C 13 172.587 0.018 A 114 GLY CA C 13 44.667 0.065 A 114 GLY N N 15 109.324 0.140 A 115 LYS H H 1 9.550 0.003 A 115 LYS HA H 1 4.527 0.004 A 115 LYS HBy H 1 1.888 0.004 A 115 LYS HBx H 1 1.703 0.007 A 115 LYS HDx H 1 1.679 0.008 A 115 LYS HDy H 1 1.679 0.008 A 115 LYS HEx H 1 2.998 0.003 A 115 LYS HEy H 1 2.998 0.003 A 115 LYS HGx H 1 1.460 0.006 A 115 LYS HGy H 1 1.460 0.006 A 115 LYS C C 13 175.690 0.009 A 115 LYS CA C 13 56.251 0.019 A 115 LYS CB C 13 34.217 0.047 A 115 LYS CD C 13 28.925 0.076 A 115 LYS CE C 13 42.441 0.009 A 115 LYS CG C 13 24.752 0.058 A 115 LYS N N 15 119.240 0.095 A 116 THR H H 1 7.327 0.003 A 116 THR HA H 1 3.572 0.007 A 116 THR HB H 1 4.077 0.003 A 116 THR HG2% H 1 0.870 0.005 A 116 THR C C 13 170.519 0.043 A 116 THR CA C 13 59.094 0.051 A 116 THR CB C 13 68.191 0.256 A 116 THR CG2 C 13 19.073 0.022 A 116 THR N N 15 113.403 0.042 A 117 ASN H H 1 8.035 0.003 A 117 ASN HA H 1 4.914 0.006 A 117 ASN HBy H 1 2.756 0.005 A 117 ASN HBx H 1 2.584 0.005 A 117 ASN HD2y H 1 8.267 0.002 A 117 ASN HD2x H 1 6.852 0.007 A 117 ASN C C 13 175.798 0.039 A 117 ASN CA C 13 52.062 0.046 A 117 ASN CB C 13 40.563 0.011 A 117 ASN CG C 13 176.931 0.003 A 117 ASN N N 15 118.907 0.084 A 117 ASN ND2 N 15 112.788 0.070 A 118 GLU H H 1 8.362 0.004 A 118 GLU HA H 1 4.116 0.004 A 118 GLU HBy H 1 2.191 0.003 A 118 GLU HBx H 1 1.799 0.003 A 118 GLU HGy H 1 2.289 0.003 A 118 GLU HGx H 1 2.115 0.004 A 118 GLU C C 13 175.935 0.019 A 118 GLU CA C 13 55.589 0.075 A 118 GLU CB C 13 29.435 0.071 A 118 GLU CG C 13 36.004 0.038 A 118 GLU N N 15 119.547 0.081 A 119 TYR H H 1 7.918 0.003 A 119 TYR HA H 1 4.639 0.005 A 119 TYR HBy H 1 2.927 0.004 A 119 TYR HBx H 1 2.771 0.004 A 119 TYR HDx H 1 7.217 0.006 A 119 TYR HDy H 1 7.217 0.006 A 119 TYR HEx H 1 6.814 0.002 A 119 TYR HEy H 1 6.814 0.002 A 119 TYR C C 13 175.750 0.010 A 119 TYR CA C 13 59.270 0.044 A 119 TYR CB C 13 38.274 0.051 A 119 TYR CD1 C 13 133.008 0.1 A 119 TYR CE1 C 13 118.275 0.1 A 119 TYR N N 15 118.293 0.112 A 120 ALA H H 1 8.285 0.003 A 120 ALA HA H 1 4.273 0.004 A 120 ALA HB% H 1 1.261 0.003 A 120 ALA C C 13 175.773 0.013 A 120 ALA CA C 13 52.014 0.039 A 120 ALA CB C 13 19.920 0.026 A 120 ALA N N 15 126.212 0.003 A 121 TYR H H 1 7.556 0.003 A 121 TYR HA H 1 4.404 0.003 A 121 TYR HBy H 1 3.081 0.004 A 121 TYR HBx H 1 2.887 0.003 A 121 TYR HDx H 1 7.106 0.003 A 121 TYR HDy H 1 7.106 0.003 A 121 TYR HEx H 1 6.778 0.002 A 121 TYR HEy H 1 6.778 0.002 A 121 TYR C C 13 180.328 0.000 A 121 TYR CA C 13 58.808 0.060 A 121 TYR CB C 13 39.292 0.074 A 121 TYR CD1 C 13 133.301 0.1 A 121 TYR CE1 C 13 117.978 0.1 A 121 TYR N N 15 124.421 0.135 B 6 THR_AC H H 1 8.201 0.002 B 6 THR_AC H21 H 1 2.079 0.001 B 6 THR_AC HA H 1 4.340 0.002 B 6 THR_AC HB H 1 4.172 0.009 B 6 THR_AC HG21 H 1 1.176 0.001 B 6 THR_AC HG22 H 1 1.176 0.001 B 6 THR_AC HG23 H 1 1.176 0.001 B 7 THR H H 1 8.162 0.001 B 7 THR HA H 1 4.575 0.002 B 7 THR HB H 1 4.094 0.003 B 7 THR HG2% H 1 1.212 0.005 B 8 PRO HA H 1 4.157 0.002 B 8 PRO HBy H 1 2.026 0.003 B 8 PRO HBx H 1 1.88 0.003 B 8 PRO HDy H 1 3.803 0.003 B 8 PRO HDx H 1 3.592 0.003 B 8 PRO HG2 H 1 1.883 0.002 B 8 PRO HG3 H 1 1.883 0.002 B 9 ASP H H 1 7.817 0.003 B 9 ASP HA H 1 4.379 0.003 B 9 ASP HBy H 1 2.776 0.003 B 9 ASP HBx H 1 2.510 0.002 B 10 TYS H H 1 8.140 0.002 B 10 TYS HA H 1 4.465 0.004 B 10 TYS HBx H 1 3.452 0.003 B 10 TYS HBy H 1 2.763 0.003 B 10 TYS HDx H 1 6.617 0.002 B 10 TYS HDy H 1 6.617 0.002 B 10 TYS HEx H 1 6.900 0.002 B 10 TYS HEy H 1 6.900 0.002 B 11 GLY H H 1 8.270 0.003 B 11 GLY HAy H 1 4.156 0.002 B 11 GLY HAx H 1 4.090 0.004 B 12 HIS H H 1 7.288 0.002 B 12 HIS HA H 1 4.681 0.002 B 12 HIS HBy H 1 3.272 0.004 B 12 HIS HBx H 1 3.209 0.003 B 12 HIS HD2 H 1 7.264 0.001 B 12 HIS HE1 H 1 8.409 0.001 B 13 TYS H H 1 8.965 0.001 B 13 TYS HA H 1 4.647 0.002 B 13 TYS HBy H 1 3.288 0.004 B 13 TYS HBx H 1 3.125 0.002 B 13 TYS HDx H 1 7.827 0.002 B 13 TYS HDy H 1 7.827 0.002 B 13 TYS HEx H 1 7.463 0.002 B 13 TYS HEy H 1 7.463 0.002 B 14 ASP H H 1 8.006 0.002 B 14 ASP HA H 1 4.682 0.001 B 14 ASP HBy H 1 2.883 0.002 B 14 ASP HBx H 1 2.023 0.002 B 15 ASP H H 1 8.469 0.002 B 15 ASP HA H 1 5.389 0.002 B 15 ASP HBy H 1 2.939 0.003 B 15 ASP HBx H 1 2.431 0.003 B 16 LYS H H 1 9.221 0.002 B 16 LYS HA H 1 4.507 0.004 B 16 LYS HBx H 1 1.905 0.002 B 16 LYS HBy H 1 1.905 0.002 B 16 LYS HDx H 1 1.697 0.002 B 16 LYS HDy H 1 1.697 0.002 B 16 LYS HEx H 1 3.026 0.001 B 16 LYS HEy H 1 3.026 0.001 B 16 LYS HGy H 1 1.526 0.005 B 16 LYS HGx H 1 1.419 0.004 B 17 ASP H H 1 8.468 0.002 B 17 ASP HA H 1 4.680 0.002 B 17 ASP HBy H 1 2.885 0.003 B 17 ASP HBx H 1 2.468 0.003 B 18 THR H H 1 7.276 0.003 B 18 THR HA H 1 4.254 0.002 B 18 THR HB H 1 3.875 0.002 B 18 THR HG1 H 1 6.397 0.004 B 18 THR HG2% H 1 0.910 0.002 B 19 LEU H H 1 7.850 0.003 B 19 LEU HA H 1 4.254 0.002 B 19 LEU HBy H 1 1.052 0.003 B 19 LEU HBx H 1 0.041 0.003 B 19 LEU HD1% H 1 0.865 0.002 B 19 LEU HD2% H 1 0.865 0.002 B 19 LEU HG H 1 1.194 0.002 B 21 LEU H H 1 9.076 0.002 B 21 LEU HA H 1 4.295 0.002 B 21 LEU HBx H 1 1.620 0.004 B 21 LEU HBy H 1 1.520 0.002 B 21 LEU HDx% H 1 0.603 0.002 B 21 LEU HDy% H 1 0.184 0.002 B 21 LEU HG H 1 1.521 0.005 B 22 ASN H H 1 8.767 0.002 B 22 ASN HA H 1 4.722 0.002 B 22 ASN HBy H 1 2.844 0.004 B 22 ASN HBx H 1 2.786 0.003 B 22 ASN HD2y H 1 7.840 0.002 B 22 ASN HD2x H 1 6.929 0.002 B 23 THR H H 1 7.833 0.004 B 23 THR HA H 1 4.526 0.006 B 23 THR HB H 1 4.121 0.002 B 23 THR HG2% H 1 1.232 0.003 B 24 PRO HA H 1 4.437 0.003 B 24 PRO HBy H 1 2.275 0.001 B 24 PRO HBx H 1 1.889 0.006 B 24 PRO HDy H 1 3.847 0.003 B 24 PRO HDx H 1 3.674 0.003 B 24 PRO HGy H 1 2.038 0.001 B 24 PRO HGx H 1 1.976 0.009 B 25 VAL H H 1 8.202 0.003 B 25 VAL HA H 1 4.012 0.003 B 25 VAL HB H 1 2.002 0.003 B 25 VAL HGx% H 1 0.908 0.003 B 25 VAL HGy% H 1 0.881 0.005 B 27 LYS_NH2 H H 1 8.271 0.002 B 27 LYS_NH2 H2 H 1 7.095 0.002 B 27 LYS_NH2 HA H 1 4.239 0.007 B 27 LYS_NH2 HB2 H 1 1.896 0.001 B 27 LYS_NH2 HB3 H 1 1.80 0.020 B 27 LYS_NH2 HD2 H 1 1.72 0.020 B 27 LYS_NH2 HD3 H 1 1.72 0.020 B 27 LYS_NH2 HE2 H 1 2.968 0.005 B 27 LYS_NH2 HE3 H 1 2.968 0.005 B 27 LYS_NH2 HG2 H 1 1.38 0.020 B 27 LYS_NH2 HG3 H 1 1.38 0.020 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 31 ASN HD2y A 31 ASN HD2x 1.0 1.6 3.0 2 2 A 34 LEU H A 34 LEU HBx 1.0 1.9 4.5 3 3 A 34 LEU H A 34 LEU HD1% 1.0 2.0 5.8 4 4 A 34 LEU H A 35 PRO HDx 1.0 1.9 6.0 5 5 A 37 THR H A 35 PRO HGx 1.0 1.8 6.0 6 5 A 37 THR H A 35 PRO HGy 1.0 1.8 6.0 7 6 A 37 THR H A 36 THR H 1.0 2.0 5.2 8 7 A 37 THR H A 37 THR HB 1.0 2.0 5.4 9 8 A 37 THR H A 38 LEU H 1.0 2.0 6.0 10 9 A 37 THR H A 40 LYS HBx 1.0 1.9 4.1 11 9 A 37 THR H A 40 LYS HBy 1.0 1.9 4.1 12 10 A 37 THR H A 40 LYS HDx 1.0 1.9 6.0 13 10 A 37 THR H A 40 LYS HDy 1.0 1.9 6.0 14 11 A 37 THR H A 40 LYS HGx 1.0 2.0 6.0 15 12 A 37 THR H A 40 LYS HGy 1.0 2.0 6.0 16 13 A 37 THR H A 41 LEU H 1.0 2.0 6.0 17 14 A 37 THR H A 88 GLU HA 1.0 2.0 6.0 18 15 A 37 THR H A 89 LEU HD2% 1.0 1.8 6.0 19 16 A 37 THR H A 89 LEU H 1.0 1.9 6.0 20 17 A 37 THR HB A 38 LEU H 1.0 1.8 3.8 21 18 A 38 LEU H A 38 LEU HA 1.0 1.7 3.5 22 19 A 38 LEU H A 38 LEU HBy 1.0 1.7 2.9 23 20 A 38 LEU H A 38 LEU HD1% 1.0 2.0 6.0 24 21 A 38 LEU H A 39 GLY HAy 1.0 1.8 6.0 25 22 A 38 LEU H A 80 LEU HD1% 1.0 2.0 6.0 26 23 A 38 LEU H A 87 VAL HB 1.0 2.0 6.0 27 24 A 38 LEU H A 87 VAL HGy% 1.0 2.0 5.4 28 25 A 38 LEU H A 87 VAL H 1.0 2.0 5.8 29 26 A 38 LEU H A 88 GLU HA 1.0 2.0 5.4 30 27 A 38 LEU H A 89 LEU HBx 1.0 1.8 6.0 31 28 A 38 LEU H A 89 LEU HD1% 1.0 2.0 5.6 32 29 A 38 LEU H A 89 LEU HD2% 1.0 2.0 5.0 33 30 A 38 LEU H A 89 LEU HG 1.0 2.0 4.8 34 31 A 38 LEU H A 89 LEU H 1.0 2.0 6.0 35 32 A 39 GLY H A 37 THR HA 1.0 2.0 6.0 36 33 A 37 THR HB A 39 GLY H 1.0 1.8 3.8 37 34 A 39 GLY H A 37 THR HG2% 1.0 2.0 6.0 38 35 A 39 GLY H A 38 LEU HBx 1.0 2.0 4.6 39 36 A 38 LEU HBy A 39 GLY H 1.0 1.8 4.2 40 37 A 38 LEU HD1% A 39 GLY H 1.0 2.0 6.0 41 38 A 39 GLY H A 38 LEU HG 1.0 2.0 6.0 42 39 A 38 LEU H A 39 GLY H 1.0 1.8 3.4 43 40 A 39 GLY H A 39 GLY HAx 1.0 1.7 2.9 44 41 A 39 GLY HAy A 39 GLY H 1.0 1.8 3.8 45 42 A 39 GLY H A 40 LYS HA 1.0 1.9 6.0 46 43 A 40 LYS HGx A 39 GLY H 1.0 1.7 6.0 47 44 A 39 GLY H A 41 LEU HBx 1.0 2.0 6.0 48 45 A 41 LEU H A 39 GLY H 1.0 2.0 6.0 49 46 A 80 LEU HD1% A 39 GLY H 1.0 2.0 5.4 50 47 A 39 GLY H A 85 LYS HA 1.0 1.8 3.8 51 48 A 39 GLY H A 85 LYS HBx 1.0 2.0 6.0 52 48 A 39 GLY H A 85 LYS HBy 1.0 2.0 6.0 53 49 A 39 GLY H A 85 LYS HDx 1.0 1.8 6.0 54 49 A 39 GLY H A 85 LYS HDy 1.0 1.8 6.0 55 50 A 39 GLY H A 85 LYS HGy 1.0 1.9 6.0 56 51 A 87 VAL HB A 39 GLY H 1.0 2.0 6.0 57 52 A 87 VAL H A 39 GLY H 1.0 2.0 5.6 58 53 A 89 LEU HD1% A 39 GLY H 1.0 1.9 6.0 59 54 A 89 LEU HD2% A 39 GLY H 1.0 1.8 6.0 60 55 A 37 THR HB A 40 LYS H 1.0 2.0 6.0 61 56 A 37 THR HG2% A 40 LYS H 1.0 1.9 6.0 62 57 A 39 GLY HAy A 40 LYS H 1.0 2.0 5.4 63 58 A 39 GLY H A 40 LYS H 1.0 1.8 3.4 64 59 A 40 LYS HA A 40 LYS H 1.0 1.8 3.8 65 60 A 40 LYS HBx A 40 LYS H 1.0 1.7 3.1 66 60 A 40 LYS HBy A 40 LYS H 1.0 1.7 3.1 67 61 A 40 LYS HDx A 40 LYS H 1.0 2.0 6.0 68 61 A 40 LYS HDy A 40 LYS H 1.0 2.0 6.0 69 62 A 40 LYS H A 40 LYS HEx 1.0 1.7 6.0 70 62 A 40 LYS H A 40 LYS HEy 1.0 1.7 6.0 71 63 A 40 LYS HGx A 40 LYS H 1.0 1.9 4.5 72 64 A 40 LYS HGy A 40 LYS H 1.0 1.8 3.6 73 65 A 40 LYS H A 41 LEU HA 1.0 1.8 6.0 74 66 A 41 LEU H A 40 LYS H 1.0 1.7 3.1 75 67 A 40 LYS H A 42 ASP H 1.0 2.0 5.6 76 68 A 80 LEU HD1% A 40 LYS H 1.0 1.9 6.0 77 69 A 85 LYS HA A 40 LYS H 1.0 1.8 6.0 78 70 A 41 LEU H A 35 PRO HBx 1.0 0.0 6.0 79 71 A 41 LEU H A 38 LEU HA 1.0 2.0 5.2 80 72 A 40 LYS HBx A 41 LEU H 1.0 1.8 3.6 81 72 A 40 LYS HBy A 41 LEU H 1.0 1.8 3.6 82 73 A 40 LYS HGx A 41 LEU H 1.0 1.9 6.0 83 74 A 41 LEU H A 41 LEU HBy 1.0 1.8 3.4 84 75 A 41 LEU H A 41 LEU HD1% 1.0 2.0 6.0 85 76 A 41 LEU H A 41 LEU HD2% 1.0 2.0 6.0 86 77 A 41 LEU H A 41 LEU HG 1.0 2.0 6.0 87 78 A 41 LEU H A 42 ASP HBx 1.0 1.9 6.0 88 79 A 41 LEU H A 42 ASP HBy 1.0 1.8 6.0 89 80 A 41 LEU H A 42 ASP H 1.0 1.8 3.4 90 81 A 41 LEU H A 43 GLU H 1.0 2.0 5.8 91 82 A 41 LEU H A 89 LEU HD1% 1.0 2.0 6.0 92 83 A 38 LEU HA A 42 ASP H 1.0 1.9 4.5 93 84 A 38 LEU HBx A 42 ASP H 1.0 2.0 5.4 94 85 A 42 ASP H A 38 LEU HD2% 1.0 2.0 5.4 95 86 A 39 GLY HAx A 42 ASP H 1.0 2.0 6.0 96 87 A 39 GLY HAy A 42 ASP H 1.0 2.0 5.2 97 88 A 39 GLY H A 42 ASP H 1.0 2.0 6.0 98 89 A 40 LYS HA A 42 ASP H 1.0 1.9 6.0 99 90 A 40 LYS HBx A 42 ASP H 1.0 2.0 4.8 100 90 A 40 LYS HBy A 42 ASP H 1.0 2.0 4.8 101 91 A 41 LEU HA A 42 ASP H 1.0 1.8 3.8 102 92 A 42 ASP H A 41 LEU HBy 1.0 2.0 5.6 103 93 A 42 ASP H A 41 LEU HD1% 1.0 1.9 6.0 104 94 A 42 ASP H A 41 LEU HD2% 1.0 1.9 4.3 105 95 A 42 ASP H A 41 LEU HG 1.0 2.0 5.8 106 96 A 42 ASP H A 42 ASP HBx 1.0 1.7 3.1 107 97 A 42 ASP H A 42 ASP HBy 1.0 1.7 3.5 108 98 A 42 ASP H A 43 GLU H 1.0 1.7 3.3 109 99 A 42 ASP H A 62 MET HE% 1.0 2.0 6.0 110 100 A 80 LEU HD1% A 42 ASP H 1.0 2.0 5.4 111 101 A 89 LEU HD1% A 42 ASP H 1.0 0.0 6.0 112 102 A 43 GLU H A 43 GLU HGy 1.0 1.6 3.0 113 102 A 43 GLU H A 43 GLU HBx 1.0 1.6 3.0 114 103 A 43 GLU H A 38 LEU HD2% 1.0 1.8 6.0 115 104 A 39 GLY HAy A 43 GLU H 1.0 2.0 5.4 116 105 A 40 LYS H A 43 GLU H 1.0 2.0 4.8 117 106 A 41 LEU HA A 43 GLU H 1.0 1.9 4.9 118 107 A 41 LEU HBx A 43 GLU H 1.0 1.9 6.0 119 108 A 41 LEU HBy A 43 GLU H 1.0 0.0 6.0 120 109 A 41 LEU HG A 43 GLU H 1.0 2.0 6.0 121 110 A 42 ASP HBx A 43 GLU H 1.0 1.8 3.6 122 111 A 42 ASP HBy A 43 GLU H 1.0 2.0 5.8 123 112 A 43 GLU H A 43 GLU HA 1.0 1.8 3.6 124 113 A 43 GLU H A 45 LEU H 1.0 1.9 6.0 125 114 A 43 GLU H A 47 ASN H 1.0 0.0 6.0 126 115 A 80 LEU HD1% A 43 GLU H 1.0 2.0 6.0 127 116 A 43 GLU H A 80 LEU HD2% 1.0 2.0 6.0 128 117 A 40 LYS HA A 44 ARG H 1.0 1.9 6.0 129 118 A 41 LEU HA A 44 ARG H 1.0 2.0 4.6 130 119 A 44 ARG H A 42 ASP HA 1.0 2.0 5.0 131 120 A 42 ASP H A 44 ARG H 1.0 2.0 6.0 132 121 A 43 GLU HA A 44 ARG H 1.0 2.0 4.8 133 122 A 43 GLU HBx A 44 ARG H 1.0 1.8 3.4 134 123 A 44 ARG H A 43 GLU HBy 1.0 2.0 5.2 135 124 A 44 ARG H A 43 GLU HGx 1.0 1.9 6.0 136 125 A 44 ARG H A 44 ARG HA 1.0 1.8 3.8 137 126 A 44 ARG H A 44 ARG HBx 1.0 1.8 3.6 138 127 A 44 ARG H A 44 ARG HBy 1.0 1.7 3.3 139 128 A 44 ARG H A 44 ARG HE 1.0 2.0 6.0 140 129 A 44 ARG H A 44 ARG HGy 1.0 2.0 6.0 141 130 A 44 ARG H A 45 LEU HBy 1.0 1.9 6.0 142 131 A 44 ARG H A 45 LEU HD2% 1.0 2.0 6.0 143 131 A 44 ARG H A 45 LEU HD1% 1.0 2.0 6.0 144 132 A 45 LEU H A 44 ARG H 1.0 1.7 3.1 145 133 A 44 ARG H A 46 ARG H 1.0 2.0 6.0 146 134 A 44 ARG H A 47 ASN HD2y 1.0 2.0 6.0 147 135 A 43 GLU HGy A 45 LEU H 1.0 2.0 5.4 148 135 A 43 GLU HBx A 45 LEU H 1.0 2.0 5.4 149 136 A 41 LEU HD1% A 45 LEU H 1.0 1.9 6.0 150 137 A 45 LEU H A 42 ASP HA 1.0 1.9 4.5 151 138 A 42 ASP H A 45 LEU H 1.0 1.9 6.0 152 139 A 45 LEU H A 43 GLU HBy 1.0 0.0 6.0 153 140 A 45 LEU H A 44 ARG HA 1.0 2.0 5.0 154 141 A 45 LEU H A 44 ARG HBx 1.0 1.7 3.1 155 142 A 45 LEU H A 44 ARG HBy 1.0 1.9 4.5 156 143 A 45 LEU H A 44 ARG HGx 1.0 2.0 6.0 157 144 A 45 LEU H A 45 LEU HBx 1.0 1.9 4.5 158 145 A 45 LEU H A 45 LEU HD1% 1.0 2.0 5.2 159 146 A 45 LEU H A 45 LEU HG 1.0 1.5 2.7 160 147 A 45 LEU H A 46 ARG H 1.0 1.8 3.4 161 148 A 45 LEU H A 47 ASN H 1.0 2.0 5.6 162 149 A 45 LEU H A 48 TYR H 1.0 2.0 5.4 163 150 A 45 LEU H A 64 ILE HD1% 1.0 1.5 6.0 164 151 A 46 ARG HE A 46 ARG HBx 1.0 2.0 6.0 165 152 A 46 ARG HE A 46 ARG HBy 1.0 2.0 6.0 166 153 A 46 ARG HE A 46 ARG HGx 1.0 2.0 4.8 167 153 A 46 ARG HE A 46 ARG HGy 1.0 2.0 4.8 168 154 A 46 ARG HE A 46 ARG HH1y 1.0 2.0 6.0 169 154 A 46 ARG HE A 46 ARG HH1x 1.0 2.0 6.0 170 155 A 46 ARG HE A 46 ARG HH2y 1.0 1.8 3.8 171 155 A 46 ARG HE A 46 ARG HH2x 1.0 1.8 3.8 172 156 A 46 ARG H A 47 ASN HBx 1.0 1.6 6.0 173 157 A 43 GLU HGy A 46 ARG H 1.0 1.9 6.0 174 157 A 43 GLU HBx A 46 ARG H 1.0 1.9 6.0 175 158 A 43 GLU H A 46 ARG H 1.0 2.0 6.0 176 159 A 45 LEU HD2% A 46 ARG H 1.0 2.0 6.0 177 159 A 45 LEU HD1% A 46 ARG H 1.0 2.0 6.0 178 160 A 46 ARG H A 46 ARG HBx 1.0 1.9 4.5 179 161 A 46 ARG H A 46 ARG HBy 1.0 1.8 3.4 180 162 A 46 ARG H A 46 ARG HDx 1.0 1.7 6.0 181 163 A 46 ARG H A 46 ARG HDy 1.0 2.0 6.0 182 164 A 46 ARG H A 46 ARG HE 1.0 1.9 6.0 183 165 A 46 ARG H A 46 ARG HGx 1.0 1.9 4.3 184 165 A 46 ARG H A 46 ARG HGy 1.0 1.9 4.3 185 166 A 47 ASN H A 46 ARG H 1.0 1.7 3.3 186 167 A 46 ARG H A 48 TYR H 1.0 2.0 6.0 187 168 A 43 GLU HGy A 47 ASN HD2y 1.0 2.0 6.0 188 169 A 44 ARG HA A 47 ASN HD2y 1.0 2.0 5.4 189 170 A 45 LEU H A 47 ASN HD2y 1.0 2.0 6.0 190 171 A 47 ASN HD2y A 47 ASN HA 1.0 2.0 5.8 191 172 A 47 ASN HD2y A 47 ASN HBx 1.0 1.9 4.9 192 173 A 47 ASN HD2y A 47 ASN HBy 1.0 1.9 4.5 193 174 A 43 GLU HGy A 47 ASN HD2x 1.0 2.0 5.4 194 175 A 44 ARG HA A 47 ASN HD2x 1.0 0.0 6.0 195 176 A 47 ASN HA A 47 ASN HD2x 1.0 2.0 6.0 196 177 A 47 ASN HBx A 47 ASN HD2x 1.0 2.0 6.0 197 178 A 47 ASN HBy A 47 ASN HD2x 1.0 2.0 6.0 198 179 A 47 ASN HD2y A 47 ASN HD2x 1.0 1.4 2.2 199 180 A 47 ASN H A 44 ARG H 1.0 2.0 5.6 200 181 A 47 ASN H A 46 ARG HA 1.0 2.0 4.6 201 182 A 47 ASN H A 46 ARG HBx 1.0 2.0 5.4 202 183 A 47 ASN H A 46 ARG HBy 1.0 1.9 4.1 203 184 A 47 ASN H A 46 ARG HDx 1.0 1.9 6.0 204 185 A 47 ASN H A 46 ARG HGx 1.0 2.0 6.0 205 185 A 47 ASN H A 46 ARG HGy 1.0 2.0 6.0 206 186 A 47 ASN H A 47 ASN HD2x 1.0 1.8 6.0 207 187 A 44 ARG HA A 48 TYR H 1.0 2.0 5.4 208 188 A 48 TYR H A 45 LEU HA 1.0 2.0 4.4 209 189 A 45 LEU HBx A 48 TYR H 1.0 1.9 6.0 210 190 A 45 LEU HBy A 48 TYR H 1.0 1.9 6.0 211 191 A 45 LEU HD2% A 48 TYR H 1.0 2.0 6.0 212 191 A 45 LEU HD1% A 48 TYR H 1.0 2.0 6.0 213 192 A 48 TYR H A 47 ASN HA 1.0 1.9 4.5 214 193 A 48 TYR H A 47 ASN HBx 1.0 1.9 4.5 215 194 A 48 TYR H A 47 ASN HBy 1.0 1.8 3.6 216 195 A 47 ASN H A 48 TYR H 1.0 1.7 2.9 217 196 A 48 TYR H A 48 TYR HA 1.0 1.9 3.9 218 197 A 48 TYR H A 48 TYR HBx 1.0 1.9 4.1 219 198 A 48 TYR H A 48 TYR HBy 1.0 1.7 3.3 220 199 A 48 TYR H A 48 TYR HD% 1.0 2.0 6.0 221 200 A 48 TYR H A 49 LEU H 1.0 1.7 3.1 222 201 A 48 TYR H A 50 LYS H 1.0 2.0 5.8 223 202 A 48 TYR H A 110 ILE HD1% 1.0 2.0 6.0 224 203 A 48 TYR H A 110 ILE HG2% 1.0 1.8 6.0 225 204 A 46 ARG HA A 49 LEU H 1.0 2.0 4.6 226 205 A 47 ASN HBx A 49 LEU H 1.0 1.9 6.0 227 206 A 47 ASN HBy A 49 LEU H 1.0 0.0 6.0 228 207 A 47 ASN H A 49 LEU H 1.0 2.0 4.8 229 208 A 48 TYR HBy A 49 LEU H 1.0 2.0 5.4 230 209 A 48 TYR HD% A 49 LEU H 1.0 1.9 6.0 231 210 A 49 LEU H A 49 LEU HA 1.0 1.8 3.4 232 211 A 49 LEU H A 49 LEU HBx 1.0 2.0 4.6 233 212 A 49 LEU H A 49 LEU HBy 1.0 1.6 3.0 234 213 A 49 LEU H A 49 LEU HD1% 1.0 2.0 6.0 235 214 A 49 LEU H A 49 LEU HG 1.0 1.9 4.1 236 215 A 49 LEU H A 50 LYS HBy 1.0 1.9 6.0 237 216 A 49 LEU H A 50 LYS H 1.0 1.7 3.3 238 217 A 49 LEU H A 76 LEU HD2% 1.0 2.0 6.0 239 217 A 49 LEU H A 76 LEU HD1% 1.0 2.0 6.0 240 218 A 47 ASN HA A 50 LYS H 1.0 2.0 4.8 241 219 A 48 TYR HA A 50 LYS H 1.0 2.0 6.0 242 220 A 50 LYS H A 49 LEU HA 1.0 2.0 5.2 243 221 A 50 LYS H A 49 LEU HD1% 1.0 1.8 6.0 244 222 A 50 LYS H A 49 LEU HD2% 1.0 1.8 6.0 245 223 A 50 LYS H A 50 LYS HA 1.0 1.8 3.8 246 224 A 50 LYS H A 50 LYS HBx 1.0 1.9 4.5 247 225 A 50 LYS H A 50 LYS HBy 1.0 1.7 3.3 248 226 A 50 LYS H A 50 LYS HDx 1.0 2.0 6.0 249 226 A 50 LYS H A 50 LYS HDy 1.0 2.0 6.0 250 227 A 50 LYS H A 50 LYS HEy 1.0 1.8 6.0 251 227 A 50 LYS H A 50 LYS HEx 1.0 1.8 6.0 252 228 A 50 LYS H A 51 LYS HBy 1.0 1.9 6.0 253 228 A 50 LYS H A 51 LYS HBx 1.0 1.9 6.0 254 229 A 50 LYS H A 51 LYS HGx 1.0 2.0 6.0 255 229 A 50 LYS H A 51 LYS HGy 1.0 2.0 6.0 256 230 A 50 LYS H A 51 LYS H 1.0 1.7 3.1 257 231 A 50 LYS H A 53 THR HG1 1.0 1.9 6.0 258 232 A 50 LYS H A 53 THR H 1.0 1.9 6.0 259 233 A 50 LYS H A 56 SER HBy 1.0 1.9 6.0 260 234 A 47 ASN HA A 51 LYS H 1.0 0.0 6.0 261 235 A 48 TYR HA A 51 LYS H 1.0 1.9 4.5 262 236 A 48 TYR H A 51 LYS H 1.0 0.0 6.0 263 237 A 49 LEU HA A 51 LYS H 1.0 2.0 6.0 264 238 A 50 LYS HA A 51 LYS H 1.0 2.0 4.8 265 239 A 50 LYS HBx A 51 LYS H 1.0 2.0 5.0 266 240 A 50 LYS HBy A 51 LYS H 1.0 1.8 3.6 267 241 A 50 LYS HDx A 51 LYS H 1.0 0.0 6.0 268 241 A 50 LYS HDy A 51 LYS H 1.0 0.0 6.0 269 242 A 51 LYS H A 50 LYS HGx 1.0 2.0 6.0 270 243 A 51 LYS H A 50 LYS HGy 1.0 2.0 6.0 271 244 A 51 LYS H A 51 LYS HBy 1.0 1.8 3.4 272 244 A 51 LYS H A 51 LYS HBx 1.0 1.8 3.4 273 245 A 51 LYS H A 51 LYS HEy 1.0 1.9 6.0 274 245 A 51 LYS H A 51 LYS HEx 1.0 1.9 6.0 275 246 A 51 LYS H A 52 GLY H 1.0 1.7 2.9 276 247 A 51 LYS H A 53 THR H 1.0 2.0 6.0 277 248 A 50 LYS HBx A 52 GLY H 1.0 0.0 6.0 278 249 A 50 LYS H A 52 GLY H 1.0 2.0 5.6 279 250 A 53 THR HG1 A 52 GLY H 1.0 1.9 6.0 280 251 A 52 GLY H A 53 THR HG2% 1.0 1.9 6.0 281 252 A 53 THR H A 51 LYS HA 1.0 1.9 6.0 282 253 A 53 THR H A 52 GLY H 1.0 1.7 3.3 283 254 A 53 THR H A 53 THR HB 1.0 2.0 5.6 284 255 A 53 THR HG1 A 53 THR H 1.0 1.7 3.1 285 256 A 53 THR H A 54 LYS H 1.0 2.0 6.0 286 257 A 53 THR H A 56 SER HBx 1.0 1.9 6.0 287 258 A 53 THR HG1 A 54 LYS H 1.0 2.0 6.0 288 259 A 53 THR HG2% A 54 LYS H 1.0 2.0 6.0 289 260 A 54 LYS H A 54 LYS HA 1.0 1.7 3.3 290 261 A 54 LYS H A 54 LYS HBx 1.0 1.9 3.9 291 262 A 54 LYS H A 54 LYS HBy 1.0 1.8 3.4 292 263 A 54 LYS H A 54 LYS HGx 1.0 1.8 3.8 293 264 A 54 LYS H A 54 LYS HGy 1.0 1.8 4.0 294 265 A 55 ASN HD2y A 55 ASN HA 1.0 1.9 6.0 295 266 A 55 ASN HD2y A 55 ASN HD2x 1.0 1.2 2.2 296 267 A 55 ASN HD2y A 57 ALA HB% 1.0 1.8 6.0 297 268 A 55 ASN HD2y A 58 GLN HBx 1.0 1.9 4.5 298 269 A 55 ASN HD2y A 58 GLN HBy 1.0 1.9 6.0 299 270 A 55 ASN HD2y A 58 GLN HE2y 1.0 2.0 6.0 300 271 A 55 ASN HD2y A 58 GLN H 1.0 2.0 6.0 301 272 A 55 ASN HD2x A 55 ASN HBy 1.0 2.0 6.0 302 273 A 55 ASN HD2x A 57 ALA H 1.0 2.0 5.8 303 274 A 55 ASN HD2x A 58 GLN HBx 1.0 2.0 5.8 304 275 A 55 ASN HD2x A 58 GLN HE2y 1.0 1.8 6.0 305 276 A 55 ASN H A 53 THR HA 1.0 2.0 6.0 306 277 A 53 THR HG1 A 55 ASN H 1.0 2.0 6.0 307 278 A 53 THR HG2% A 55 ASN H 1.0 2.0 6.0 308 279 A 54 LYS HA A 55 ASN H 1.0 1.8 3.6 309 280 A 55 ASN H A 54 LYS HBx 1.0 1.9 4.7 310 281 A 55 ASN H A 54 LYS HBy 1.0 1.9 3.9 311 282 A 55 ASN H A 54 LYS HDy 1.0 0.0 6.0 312 282 A 55 ASN H A 54 LYS HDx 1.0 0.0 6.0 313 283 A 55 ASN H A 54 LYS HGx 1.0 2.0 5.6 314 284 A 55 ASN H A 54 LYS HGy 1.0 2.0 6.0 315 285 A 54 LYS H A 55 ASN H 1.0 1.6 2.8 316 286 A 55 ASN HA A 55 ASN H 1.0 1.8 3.8 317 287 A 55 ASN H A 55 ASN HBx 1.0 1.8 3.6 318 288 A 55 ASN HBy A 55 ASN H 1.0 1.9 4.5 319 289 A 55 ASN HD2y A 55 ASN H 1.0 2.0 6.0 320 290 A 55 ASN HD2x A 55 ASN H 1.0 1.7 6.0 321 291 A 55 ASN H A 56 SER HA 1.0 2.0 6.0 322 292 A 55 ASN H A 56 SER H 1.0 2.0 6.0 323 293 A 58 GLN HE2y A 55 ASN H 1.0 1.9 4.1 324 294 A 55 ASN H A 58 GLN HE2x 1.0 2.0 6.0 325 295 A 58 GLN H A 56 SER H 1.0 2.0 6.0 326 296 A 50 LYS HA A 56 SER H 1.0 2.0 5.8 327 297 A 53 THR HG1 A 56 SER H 1.0 1.9 6.0 328 298 A 54 LYS H A 56 SER H 1.0 1.6 6.0 329 299 A 55 ASN HBx A 56 SER H 1.0 1.7 6.0 330 300 A 55 ASN HBy A 56 SER H 1.0 1.8 6.0 331 301 A 56 SER HA A 56 SER H 1.0 1.9 4.1 332 302 A 56 SER HBx A 56 SER H 1.0 1.9 4.1 333 303 A 56 SER HBy A 56 SER H 1.0 2.0 5.8 334 304 A 56 SER H A 57 ALA HA 1.0 1.9 6.0 335 305 A 57 ALA HB% A 56 SER H 1.0 2.0 6.0 336 306 A 57 ALA H A 56 SER H 1.0 1.8 3.8 337 307 A 55 ASN HA A 57 ALA H 1.0 2.0 5.2 338 308 A 57 ALA H A 55 ASN HBx 1.0 2.0 6.0 339 309 A 55 ASN HBy A 57 ALA H 1.0 1.9 6.0 340 310 A 57 ALA H A 56 SER HA 1.0 1.9 4.3 341 311 A 56 SER HBx A 57 ALA H 1.0 2.0 6.0 342 312 A 56 SER HBy A 57 ALA H 1.0 2.0 6.0 343 313 A 57 ALA H A 57 ALA HA 1.0 1.8 3.6 344 314 A 58 GLN H A 57 ALA H 1.0 1.6 3.0 345 315 A 58 GLN HE2y A 58 GLN HE2x 1.0 1.5 2.3 346 316 A 58 GLN HE2x A 58 GLN HGx 1.0 2.0 6.0 347 317 A 55 ASN HA A 58 GLN H 1.0 1.9 6.0 348 318 A 58 GLN H A 55 ASN HBx 1.0 2.0 6.0 349 319 A 58 GLN H A 55 ASN HBy 1.0 1.7 6.0 350 320 A 55 ASN HD2x A 58 GLN H 1.0 2.0 5.0 351 321 A 58 GLN H A 56 SER HA 1.0 2.0 5.6 352 322 A 58 GLN H A 57 ALA HA 1.0 1.7 3.3 353 323 A 58 GLN H A 59 PHE HBx 1.0 1.5 6.0 354 324 A 58 GLN H A 100 LYS HBx 1.0 1.8 6.0 355 325 A 58 GLN H A 100 LYS HGx 1.0 1.7 6.0 356 326 A 58 GLN H A 100 LYS HGy 1.0 1.6 6.0 357 327 A 49 LEU HD1% A 59 PHE H 1.0 2.0 5.8 358 328 A 49 LEU HD2% A 59 PHE H 1.0 1.7 6.0 359 329 A 56 SER HA A 59 PHE H 1.0 2.0 6.0 360 330 A 57 ALA HA A 59 PHE H 1.0 1.9 3.9 361 331 A 57 ALA H A 59 PHE H 1.0 2.0 6.0 362 332 A 58 GLN HBx A 59 PHE H 1.0 2.0 6.0 363 333 A 58 GLN HBy A 59 PHE H 1.0 2.0 6.0 364 334 A 58 GLN HGx A 59 PHE H 1.0 1.9 4.7 365 335 A 59 PHE H A 58 GLN HGy 1.0 1.9 4.5 366 336 A 58 GLN H A 59 PHE H 1.0 1.5 2.5 367 337 A 59 PHE H A 59 PHE HA 1.0 1.7 3.5 368 338 A 59 PHE HBx A 59 PHE H 1.0 1.9 4.3 369 339 A 59 PHE H A 59 PHE HBy 1.0 1.7 3.3 370 340 A 59 PHE H A 60 GLU H 1.0 2.0 6.0 371 341 A 59 PHE H A 100 LYS HA 1.0 2.0 6.0 372 342 A 100 LYS HGx A 59 PHE H 1.0 2.0 6.0 373 343 A 100 LYS HGy A 59 PHE H 1.0 1.8 6.0 374 344 A 59 PHE HBx A 60 GLU H 1.0 1.8 4.0 375 345 A 59 PHE HBy A 60 GLU H 1.0 2.0 6.0 376 346 A 60 GLU H A 60 GLU HA 1.0 1.8 3.8 377 347 A 60 GLU H A 60 GLU HGx 1.0 1.9 6.0 378 348 A 60 GLU H A 60 GLU HGy 1.0 2.0 6.0 379 349 A 60 GLU H A 61 LYS H 1.0 1.6 2.8 380 350 A 60 GLU H A 62 MET H 1.0 1.8 6.0 381 351 A 76 LEU HD2% A 60 GLU H 1.0 2.0 5.8 382 351 A 76 LEU HD1% A 60 GLU H 1.0 2.0 5.8 383 352 A 100 LYS HBx A 60 GLU H 1.0 1.8 6.0 384 353 A 60 GLU H A 100 LYS HBy 1.0 1.7 6.0 385 354 A 100 LYS HGx A 60 GLU H 1.0 1.9 6.0 386 355 A 59 PHE HA A 61 LYS H 1.0 1.9 6.0 387 356 A 59 PHE HBx A 61 LYS H 1.0 2.0 6.0 388 357 A 59 PHE HBy A 61 LYS H 1.0 1.7 6.0 389 358 A 60 GLU HA A 61 LYS H 1.0 2.0 5.2 390 359 A 60 GLU HGx A 61 LYS H 1.0 1.9 6.0 391 360 A 61 LYS H A 61 LYS HA 1.0 1.8 3.6 392 361 A 61 LYS H A 61 LYS HBx 1.0 1.9 4.3 393 362 A 61 LYS H A 61 LYS HBy 1.0 2.0 5.4 394 363 A 61 LYS H A 61 LYS HDx 1.0 1.9 6.0 395 364 A 61 LYS H A 61 LYS HDy 1.0 2.0 6.0 396 365 A 61 LYS H A 61 LYS HEy 1.0 2.0 6.0 397 366 A 61 LYS H A 61 LYS HGx 1.0 1.8 3.8 398 367 A 61 LYS H A 61 LYS HGy 1.0 2.0 5.4 399 368 A 61 LYS H A 62 MET H 1.0 1.9 5.7 400 369 A 61 LYS H A 75 TYR HA 1.0 2.0 6.0 401 370 A 61 LYS H A 76 LEU HBx 1.0 1.8 6.0 402 371 A 61 LYS H A 76 LEU HBy 1.0 2.0 6.0 403 372 A 76 LEU HD2% A 61 LYS H 1.0 1.9 4.5 404 372 A 76 LEU HD1% A 61 LYS H 1.0 1.9 4.5 405 373 A 61 LYS H A 76 LEU HG 1.0 2.0 6.0 406 374 A 61 LYS H A 76 LEU H 1.0 2.0 6.0 407 375 A 61 LYS H A 98 PHE HA 1.0 2.0 6.0 408 376 A 61 LYS H A 99 PHE HBx 1.0 2.0 6.0 409 377 A 61 LYS H A 99 PHE HBy 1.0 1.9 4.3 410 378 A 61 LYS H A 99 PHE HD% 1.0 1.9 6.0 411 379 A 61 LYS H A 99 PHE H 1.0 1.9 4.3 412 380 A 61 LYS H A 101 LYS HA 1.0 0.6 6.0 413 381 A 62 MET H A 61 LYS HA 1.0 1.6 2.8 414 382 A 62 MET H A 61 LYS HBx 1.0 2.0 5.6 415 383 A 62 MET H A 61 LYS HDx 1.0 1.9 4.5 416 384 A 62 MET H A 61 LYS HDy 1.0 1.9 4.7 417 385 A 62 MET H A 61 LYS HGx 1.0 1.9 4.3 418 386 A 62 MET H A 61 LYS HGy 1.0 2.0 6.0 419 387 A 62 MET H A 62 MET HBx 1.0 1.9 4.1 420 388 A 62 MET H A 62 MET HBy 1.0 2.0 6.0 421 389 A 62 MET H A 63 VAL H 1.0 2.0 5.8 422 390 A 62 MET H A 73 THR HA 1.0 2.0 6.0 423 391 A 62 MET H A 75 TYR HA 1.0 2.0 5.4 424 392 A 62 MET H A 76 LEU HBy 1.0 2.0 6.0 425 393 A 76 LEU HD2% A 62 MET H 1.0 2.0 5.0 426 393 A 76 LEU HD1% A 62 MET H 1.0 2.0 5.0 427 394 A 62 MET H A 76 LEU HG 1.0 2.0 4.6 428 395 A 62 MET H A 76 LEU H 1.0 2.0 6.0 429 396 A 62 MET H A 99 PHE H 1.0 2.0 6.0 430 397 A 62 MET HBx A 63 VAL H 1.0 2.0 6.0 431 398 A 62 MET HBy A 63 VAL H 1.0 1.9 4.1 432 399 A 63 VAL H A 62 MET HGx 1.0 2.0 6.0 433 400 A 63 VAL H A 62 MET HGy 1.0 1.7 6.0 434 401 A 63 VAL H A 63 VAL HA 1.0 1.9 4.5 435 402 A 63 VAL H A 63 VAL HGy% 1.0 2.0 6.0 436 403 A 63 VAL H A 64 ILE H 1.0 2.0 6.0 437 404 A 63 VAL H A 96 THR HA 1.0 2.0 6.0 438 405 A 63 VAL H A 97 TYR HBx 1.0 1.8 6.0 439 406 A 63 VAL H A 97 TYR HBy 1.0 2.0 6.0 440 407 A 63 VAL H A 97 TYR H 1.0 1.9 4.3 441 408 A 98 PHE HA A 63 VAL H 1.0 2.0 6.0 442 409 A 64 ILE H A 63 VAL HB 1.0 1.9 6.0 443 410 A 64 ILE H A 64 ILE HA 1.0 1.9 4.1 444 411 A 64 ILE HD1% A 64 ILE H 1.0 2.0 5.4 445 412 A 64 ILE H A 64 ILE HG1x 1.0 1.7 3.3 446 413 A 64 ILE H A 64 ILE HG1y 1.0 2.0 6.0 447 414 A 64 ILE H A 64 ILE HG2% 1.0 2.0 5.8 448 415 A 64 ILE H A 65 LEU HD2% 1.0 2.0 5.6 449 416 A 64 ILE H A 65 LEU H 1.0 2.0 5.6 450 417 A 64 ILE H A 72 TYR HBx 1.0 2.0 6.0 451 418 A 64 ILE H A 72 TYR HBy 1.0 2.0 6.0 452 419 A 64 ILE H A 72 TYR H 1.0 1.9 3.9 453 420 A 73 THR HA A 64 ILE H 1.0 1.8 4.0 454 421 A 65 LEU H A 65 LEU HG 1.0 1.8 3.8 455 422 A 63 VAL HGy% A 65 LEU H 1.0 1.9 6.0 456 423 A 64 ILE HA A 65 LEU H 1.0 1.6 2.8 457 424 A 64 ILE HD1% A 65 LEU H 1.0 1.9 6.0 458 425 A 64 ILE HG1x A 65 LEU H 1.0 1.7 6.0 459 426 A 64 ILE HG1y A 65 LEU H 1.0 1.9 6.0 460 427 A 65 LEU H A 65 LEU HBy 1.0 1.8 4.0 461 428 A 65 LEU H A 65 LEU HD1% 1.0 2.0 6.0 462 429 A 65 LEU H A 66 THR HG2% 1.0 2.0 5.8 463 430 A 65 LEU H A 66 THR H 1.0 2.0 6.0 464 431 A 65 LEU H A 93 MET HGy 1.0 2.0 6.0 465 431 A 65 LEU H A 93 MET HGx 1.0 2.0 6.0 466 432 A 65 LEU H A 95 LYS H 1.0 1.9 4.5 467 433 A 96 THR HA A 65 LEU H 1.0 1.9 4.1 468 434 A 65 LEU H A 96 THR HG1 1.0 2.0 5.6 469 435 A 65 LEU H A 96 THR H 1.0 2.0 6.0 470 436 A 97 TYR H A 65 LEU H 1.0 2.0 6.0 471 437 A 64 ILE HG2% A 66 THR H 1.0 2.0 6.0 472 438 A 66 THR H A 65 LEU HA 1.0 1.6 2.8 473 439 A 66 THR H A 65 LEU HBx 1.0 2.0 6.0 474 440 A 65 LEU HBy A 66 THR H 1.0 2.0 6.0 475 441 A 65 LEU HD1% A 66 THR H 1.0 1.7 6.0 476 442 A 65 LEU HD2% A 66 THR H 1.0 2.0 6.0 477 443 A 65 LEU HG A 66 THR H 1.0 1.7 6.0 478 444 A 66 THR H A 66 THR HA 1.0 1.9 4.1 479 445 A 66 THR H A 66 THR HB 1.0 2.0 6.0 480 446 A 66 THR HG2% A 66 THR H 1.0 1.8 3.4 481 447 A 66 THR H A 67 GLU H 1.0 2.0 5.2 482 448 A 66 THR H A 70 GLY HAx 1.0 1.9 4.7 483 449 A 66 THR H A 70 GLY HAy 1.0 2.0 6.0 484 450 A 66 THR H A 70 GLY H 1.0 1.9 4.3 485 451 A 66 THR H A 71 TYR HA 1.0 1.9 5.3 486 452 A 66 THR H A 71 TYR H 1.0 1.9 6.0 487 453 A 66 THR H A 94 TYR H 1.0 1.9 6.0 488 454 A 66 THR H A 117 ASN HD2y 1.0 2.0 4.4 489 455 A 66 THR H A 117 ASN HD2x 1.0 1.9 4.1 490 456 A 95 LYS H A 67 GLU H 1.0 1.7 6.0 491 457 A 66 THR HA A 67 GLU H 1.0 1.7 3.1 492 458 A 66 THR HB A 67 GLU H 1.0 1.7 2.9 493 459 A 67 GLU H A 67 GLU HGx 1.0 1.6 3.0 494 460 A 67 GLU H A 67 GLU HGy 1.0 2.0 4.6 495 461 A 67 GLU H A 70 GLY H 1.0 2.0 6.0 496 462 A 67 GLU H A 91 GLY H 1.0 2.0 6.0 497 463 A 67 GLU H A 92 LYS HBx 1.0 2.0 6.0 498 464 A 67 GLU H A 92 LYS HBy 1.0 1.9 6.0 499 465 A 67 GLU H A 93 MET HA 1.0 2.0 6.0 500 466 A 67 GLU H A 94 TYR HBx 1.0 2.0 6.0 501 467 A 67 GLU H A 94 TYR HBy 1.0 2.0 6.0 502 468 A 67 GLU H A 94 TYR H 1.0 2.0 6.0 503 469 A 67 GLU H A 116 THR HG2% 1.0 1.9 6.0 504 470 A 68 ASN HD2y A 68 ASN HD2x 1.0 1.3 2.2 505 471 A 68 ASN HD2y A 120 ALA HB% 1.0 1.8 6.0 506 472 A 68 ASN HD2x A 68 ASN HBx 1.0 2.0 6.0 507 473 A 68 ASN HD2x A 92 LYS H 1.0 1.5 6.0 508 474 A 68 ASN HD2x A 120 ALA HB% 1.0 2.0 6.0 509 475 A 68 ASN H A 67 GLU HA 1.0 1.7 3.1 510 476 A 68 ASN H A 67 GLU HBx 1.0 1.8 3.6 511 476 A 68 ASN H A 67 GLU HBy 1.0 1.8 3.6 512 477 A 68 ASN HBx A 68 ASN H 1.0 1.9 6.0 513 478 A 68 ASN H A 68 ASN HBy 1.0 2.0 5.4 514 479 A 68 ASN HD2x A 68 ASN H 1.0 2.0 6.0 515 480 A 68 ASN H A 69 LYS HA 1.0 1.9 6.0 516 481 A 68 ASN H A 69 LYS HDx 1.0 1.9 6.0 517 481 A 68 ASN H A 69 LYS HDy 1.0 1.9 6.0 518 482 A 68 ASN H A 69 LYS HGx 1.0 1.9 6.0 519 483 A 68 ASN H A 69 LYS HGy 1.0 1.9 6.0 520 484 A 68 ASN H A 69 LYS H 1.0 1.8 3.6 521 485 A 70 GLY H A 68 ASN H 1.0 2.0 6.0 522 486 A 68 ASN H A 91 GLY HAx 1.0 1.8 6.0 523 487 A 68 ASN H A 91 GLY HAy 1.0 1.6 6.0 524 488 A 92 LYS H A 68 ASN H 1.0 1.6 6.0 525 489 A 68 ASN H A 118 GLU HA 1.0 2.0 6.0 526 490 A 120 ALA HB% A 68 ASN H 1.0 2.0 6.0 527 491 A 67 GLU HA A 69 LYS H 1.0 2.0 5.0 528 492 A 69 LYS H A 69 LYS HBx 1.0 1.9 6.0 529 493 A 69 LYS H A 69 LYS HBy 1.0 2.0 5.8 530 494 A 69 LYS HDx A 69 LYS H 1.0 2.0 6.0 531 494 A 69 LYS HDy A 69 LYS H 1.0 2.0 6.0 532 495 A 69 LYS H A 69 LYS HEx 1.0 1.8 6.0 533 495 A 69 LYS H A 69 LYS HEy 1.0 1.8 6.0 534 496 A 70 GLY HAx A 69 LYS H 1.0 1.8 6.0 535 497 A 69 LYS H A 117 ASN HA 1.0 2.0 5.6 536 498 A 117 ASN HD2y A 69 LYS H 1.0 1.9 6.0 537 499 A 117 ASN HD2x A 69 LYS H 1.0 1.8 6.0 538 500 A 69 LYS H A 118 GLU HA 1.0 2.0 5.6 539 501 A 65 LEU HA A 70 GLY H 1.0 2.0 6.0 540 502 A 70 GLY H A 68 ASN HA 1.0 1.9 6.0 541 503 A 70 GLY H A 69 LYS HA 1.0 1.8 3.8 542 504 A 70 GLY H A 69 LYS HBx 1.0 2.0 6.0 543 505 A 70 GLY H A 69 LYS HBy 1.0 2.0 5.4 544 506 A 70 GLY H A 69 LYS HEx 1.0 0.0 6.0 545 506 A 70 GLY H A 69 LYS HEy 1.0 0.0 6.0 546 507 A 70 GLY H A 69 LYS H 1.0 1.8 3.8 547 508 A 70 GLY HAx A 70 GLY H 1.0 1.7 3.1 548 509 A 70 GLY H A 71 TYR H 1.0 2.0 6.0 549 510 A 70 GLY H A 90 LEU HA 1.0 1.9 6.0 550 511 A 70 GLY H A 90 LEU HBx 1.0 2.0 6.0 551 512 A 70 GLY H A 90 LEU HBy 1.0 2.0 5.4 552 513 A 70 GLY H A 90 LEU HD1% 1.0 2.0 6.0 553 514 A 70 GLY H A 117 ASN HD2y 1.0 1.9 5.5 554 515 A 70 GLY H A 117 ASN HD2x 1.0 2.0 6.0 555 516 A 65 LEU HA A 71 TYR H 1.0 2.0 6.0 556 517 A 70 GLY HAy A 71 TYR H 1.0 1.6 2.8 557 518 A 71 TYR HA A 71 TYR H 1.0 1.9 4.3 558 519 A 71 TYR H A 71 TYR HBx 1.0 1.8 3.8 559 520 A 71 TYR H A 71 TYR HBy 1.0 1.9 4.5 560 521 A 71 TYR H A 71 TYR HD% 1.0 1.9 6.0 561 522 A 72 TYR H A 71 TYR H 1.0 2.0 6.0 562 523 A 71 TYR H A 90 LEU HD1% 1.0 2.0 5.2 563 524 A 71 TYR H A 90 LEU HD2% 1.0 1.4 6.0 564 525 A 72 TYR H A 63 VAL HGx% 1.0 0.0 6.0 565 526 A 64 ILE HA A 72 TYR H 1.0 0.0 6.0 566 527 A 64 ILE HD1% A 72 TYR H 1.0 2.0 6.0 567 528 A 64 ILE HG2% A 72 TYR H 1.0 2.0 5.6 568 529 A 72 TYR H A 65 LEU HA 1.0 2.0 5.2 569 530 A 65 LEU HD2% A 72 TYR H 1.0 2.0 5.2 570 531 A 72 TYR H A 71 TYR HBx 1.0 2.0 6.0 571 532 A 72 TYR H A 71 TYR HBy 1.0 2.0 6.0 572 533 A 72 TYR H A 71 TYR HD% 1.0 1.9 5.3 573 534 A 72 TYR H A 71 TYR HE% 1.0 1.9 6.0 574 535 A 72 TYR H A 72 TYR HA 1.0 1.8 3.8 575 536 A 72 TYR HBx A 72 TYR H 1.0 2.0 5.4 576 537 A 72 TYR HBy A 72 TYR H 1.0 1.9 4.1 577 538 A 72 TYR H A 72 TYR HD% 1.0 2.0 5.2 578 539 A 72 TYR H A 72 TYR HE% 1.0 1.9 6.0 579 540 A 38 LEU HD1% A 73 THR H 1.0 1.9 6.0 580 541 A 63 VAL HGy% A 73 THR H 1.0 1.9 6.0 581 542 A 64 ILE HD1% A 73 THR H 1.0 2.0 6.0 582 543 A 72 TYR HBx A 73 THR H 1.0 2.0 5.6 583 544 A 72 TYR HBy A 73 THR H 1.0 2.0 6.0 584 545 A 72 TYR HD% A 73 THR H 1.0 1.9 6.0 585 546 A 73 THR H A 73 THR HB 1.0 1.8 3.8 586 547 A 73 THR H A 74 VAL HGy% 1.0 1.9 4.9 587 548 A 73 THR H A 74 VAL H 1.0 2.0 6.0 588 549 A 62 MET HBx A 74 VAL H 1.0 1.9 6.0 589 550 A 62 MET HE% A 74 VAL H 1.0 2.0 6.0 590 551 A 62 MET H A 74 VAL H 1.0 1.9 3.9 591 552 A 63 VAL HA A 74 VAL H 1.0 2.0 5.4 592 553 A 63 VAL HGy% A 74 VAL H 1.0 0.0 6.0 593 554 A 63 VAL H A 74 VAL H 1.0 0.0 6.0 594 555 A 64 ILE HD1% A 74 VAL H 1.0 2.0 5.8 595 556 A 73 THR HA A 74 VAL H 1.0 1.6 2.6 596 557 A 73 THR HB A 74 VAL H 1.0 2.0 6.0 597 558 A 74 VAL H A 73 THR HG2% 1.0 2.0 4.4 598 559 A 74 VAL H A 74 VAL HA 1.0 1.8 4.0 599 560 A 74 VAL H A 74 VAL HGx% 1.0 2.0 5.6 600 561 A 74 VAL HGy% A 74 VAL H 1.0 1.7 3.5 601 562 A 61 LYS HA A 75 TYR H 1.0 1.9 6.0 602 563 A 74 VAL HA A 75 TYR H 1.0 1.6 2.6 603 564 A 75 TYR H A 74 VAL HB 1.0 2.0 6.0 604 565 A 74 VAL HGx% A 75 TYR H 1.0 1.8 3.6 605 566 A 74 VAL HGy% A 75 TYR H 1.0 2.0 6.0 606 567 A 74 VAL H A 75 TYR H 1.0 2.0 5.8 607 568 A 75 TYR HA A 75 TYR H 1.0 1.9 3.7 608 569 A 75 TYR H A 75 TYR HBx 1.0 2.0 5.0 609 570 A 75 TYR H A 75 TYR HD% 1.0 1.9 5.3 610 571 A 76 LEU HD2% A 75 TYR H 1.0 2.0 5.4 611 571 A 76 LEU HD1% A 75 TYR H 1.0 2.0 5.4 612 572 A 76 LEU H A 75 TYR H 1.0 2.0 6.0 613 573 A 75 TYR H A 78 THR HG2% 1.0 1.9 6.0 614 574 A 60 GLU HGx A 76 LEU H 1.0 1.8 6.0 615 575 A 61 LYS HBy A 76 LEU H 1.0 2.0 6.0 616 576 A 61 LYS HGx A 76 LEU H 1.0 1.8 6.0 617 577 A 61 LYS HGy A 76 LEU H 1.0 0.7 6.0 618 578 A 76 LEU H A 62 MET HBx 1.0 2.0 6.0 619 579 A 76 LEU H A 75 TYR HBy 1.0 2.0 6.0 620 580 A 76 LEU HD2% A 76 LEU H 1.0 1.9 4.9 621 580 A 76 LEU HD1% A 76 LEU H 1.0 1.9 4.9 622 581 A 76 LEU HG A 76 LEU H 1.0 1.7 3.1 623 582 A 76 LEU H A 78 THR H 1.0 2.0 6.0 624 583 A 77 ASN HD2y A 77 ASN HD2x 1.0 1.4 2.2 625 584 A 61 LYS HA A 77 ASN H 1.0 2.0 6.0 626 585 A 75 TYR HBy A 77 ASN H 1.0 1.9 4.9 627 586 A 77 ASN H A 76 LEU HA 1.0 1.9 3.9 628 587 A 76 LEU HBx A 77 ASN H 1.0 2.0 6.0 629 588 A 76 LEU HBy A 77 ASN H 1.0 1.9 4.7 630 589 A 76 LEU HD2% A 77 ASN H 1.0 0.0 6.0 631 589 A 76 LEU HD1% A 77 ASN H 1.0 0.0 6.0 632 590 A 76 LEU HG A 77 ASN H 1.0 2.0 6.0 633 591 A 76 LEU H A 77 ASN H 1.0 1.6 2.8 634 592 A 77 ASN H A 77 ASN HBy 1.0 1.9 4.1 635 593 A 77 ASN HD2y A 77 ASN H 1.0 2.0 6.0 636 594 A 77 ASN HD2x A 77 ASN H 1.0 1.8 6.0 637 595 A 78 THR HG2% A 77 ASN H 1.0 2.0 6.0 638 596 A 78 THR H A 77 ASN H 1.0 1.6 3.0 639 597 A 46 ARG HH1y A 78 THR H 1.0 2.0 6.0 640 597 A 46 ARG HH1x A 78 THR H 1.0 2.0 6.0 641 598 A 46 ARG HH2y A 78 THR H 1.0 2.0 5.6 642 598 A 46 ARG HH2x A 78 THR H 1.0 2.0 5.6 643 599 A 75 TYR HBx A 78 THR H 1.0 2.0 5.4 644 600 A 76 LEU HD2% A 78 THR H 1.0 0.0 6.0 645 600 A 76 LEU HD1% A 78 THR H 1.0 0.0 6.0 646 601 A 78 THR H A 77 ASN HBx 1.0 2.0 5.8 647 602 A 78 THR H A 77 ASN HBy 1.0 2.0 6.0 648 603 A 78 THR H A 78 THR HA 1.0 1.7 3.1 649 604 A 78 THR H A 78 THR HB 1.0 2.0 5.4 650 605 A 78 THR H A 79 PRO HDy 1.0 1.7 6.0 651 606 A 78 THR H A 79 PRO HGx 1.0 1.7 6.0 652 607 A 46 ARG HE A 80 LEU H 1.0 0.0 6.0 653 608 A 46 ARG HH1y A 80 LEU H 1.0 2.0 6.0 654 608 A 46 ARG HH1x A 80 LEU H 1.0 2.0 6.0 655 609 A 46 ARG HH2y A 80 LEU H 1.0 1.8 4.2 656 609 A 46 ARG HH2x A 80 LEU H 1.0 1.8 4.2 657 610 A 80 LEU H A 79 PRO HA 1.0 1.5 2.5 658 611 A 80 LEU H A 79 PRO HDx 1.0 0.0 6.0 659 612 A 79 PRO HGx A 80 LEU H 1.0 0.0 6.0 660 613 A 80 LEU H A 79 PRO HGy 1.0 0.0 6.0 661 614 A 80 LEU H A 80 LEU HA 1.0 1.8 3.6 662 615 A 80 LEU HD1% A 80 LEU H 1.0 2.0 6.0 663 616 A 80 LEU H A 80 LEU HG 1.0 2.0 5.2 664 617 A 80 LEU H A 81 ALA H 1.0 2.0 6.0 665 618 A 80 LEU HA A 81 ALA H 1.0 1.5 2.7 666 619 A 81 ALA H A 80 LEU HBx 1.0 2.0 6.0 667 620 A 81 ALA H A 80 LEU HBy 1.0 1.9 4.1 668 621 A 80 LEU HD1% A 81 ALA H 1.0 2.0 6.0 669 622 A 80 LEU HD2% A 81 ALA H 1.0 2.0 4.8 670 623 A 80 LEU HG A 81 ALA H 1.0 1.9 4.1 671 624 A 81 ALA H A 81 ALA HA 1.0 1.8 3.6 672 625 A 81 ALA H A 83 ASP H 1.0 2.0 6.0 673 626 A 81 ALA H A 84 ARG HBx 1.0 1.8 6.0 674 627 A 81 ALA H A 84 ARG HBy 1.0 2.0 5.4 675 628 A 81 ALA H A 84 ARG HDx 1.0 1.9 6.0 676 629 A 81 ALA H A 84 ARG HGx 1.0 2.0 5.6 677 630 A 81 ALA H A 84 ARG HGy 1.0 1.9 6.0 678 631 A 81 ALA H A 84 ARG H 1.0 2.0 6.0 679 632 A 82 GLU H A 85 LYS HGx 1.0 2.0 6.0 680 632 A 85 LYS HDx A 82 GLU H 1.0 2.0 6.0 681 632 A 85 LYS HDy A 82 GLU H 1.0 2.0 6.0 682 633 A 81 ALA H A 82 GLU H 1.0 2.0 6.0 683 634 A 81 ALA HA A 83 ASP H 1.0 2.0 6.0 684 635 A 83 ASP H A 81 ALA HB% 1.0 1.7 3.3 685 636 A 83 ASP H A 82 GLU HA 1.0 1.8 4.0 686 637 A 83 ASP H A 82 GLU HBx 1.0 1.8 3.8 687 637 A 83 ASP H A 82 GLU HBy 1.0 1.8 3.8 688 638 A 83 ASP H A 82 GLU HGx 1.0 2.0 5.4 689 638 A 83 ASP H A 82 GLU HGy 1.0 2.0 5.4 690 639 A 83 ASP H A 82 GLU H 1.0 1.7 3.3 691 640 A 83 ASP H A 83 ASP HA 1.0 1.8 3.4 692 641 A 83 ASP H A 83 ASP HBx 1.0 1.9 4.1 693 642 A 83 ASP H A 83 ASP HBy 1.0 1.7 3.3 694 643 A 83 ASP H A 84 ARG HBx 1.0 1.6 6.0 695 644 A 83 ASP H A 84 ARG HBy 1.0 2.0 6.0 696 645 A 83 ASP H A 84 ARG HGx 1.0 2.0 6.0 697 646 A 83 ASP H A 84 ARG HGy 1.0 1.7 6.0 698 647 A 83 ASP H A 84 ARG H 1.0 1.6 2.8 699 648 A 83 ASP H A 85 LYS H 1.0 1.9 5.1 700 649 A 38 LEU HD1% A 84 ARG H 1.0 1.8 6.0 701 650 A 80 LEU HD1% A 84 ARG H 1.0 1.9 6.0 702 651 A 80 LEU HD2% A 84 ARG H 1.0 1.9 6.0 703 652 A 80 LEU HG A 84 ARG H 1.0 1.9 4.9 704 653 A 81 ALA HA A 84 ARG H 1.0 0.0 6.0 705 654 A 84 ARG H A 81 ALA HB% 1.0 1.8 3.8 706 655 A 84 ARG H A 82 GLU HA 1.0 1.9 5.1 707 656 A 84 ARG H A 82 GLU H 1.0 2.0 6.0 708 657 A 84 ARG H A 83 ASP HBx 1.0 2.0 5.2 709 658 A 84 ARG H A 83 ASP HBy 1.0 2.0 5.4 710 659 A 84 ARG H A 84 ARG HA 1.0 1.8 3.4 711 660 A 84 ARG HBx A 84 ARG H 1.0 2.0 5.0 712 661 A 84 ARG HBy A 84 ARG H 1.0 1.6 3.0 713 662 A 84 ARG HDx A 84 ARG H 1.0 1.9 6.0 714 663 A 84 ARG H A 84 ARG HDy 1.0 2.0 6.0 715 664 A 84 ARG HGy A 84 ARG H 1.0 2.0 4.8 716 665 A 85 LYS HA A 84 ARG H 1.0 2.0 6.0 717 666 A 85 LYS HGy A 84 ARG H 1.0 1.9 6.0 718 667 A 84 ARG H A 85 LYS H 1.0 1.5 2.5 719 668 A 84 ARG H A 86 ASN H 1.0 1.9 6.0 720 669 A 87 VAL HB A 84 ARG H 1.0 2.0 6.0 721 670 A 84 ARG H A 87 VAL HGx% 1.0 2.0 6.0 722 671 A 87 VAL HGy% A 84 ARG H 1.0 1.8 6.0 723 672 A 38 LEU HD1% A 85 LYS H 1.0 1.8 6.0 724 673 A 39 GLY HAx A 85 LYS H 1.0 1.7 6.0 725 674 A 39 GLY HAy A 85 LYS H 1.0 1.9 6.0 726 675 A 39 GLY H A 85 LYS H 1.0 2.0 6.0 727 676 A 80 LEU HD1% A 85 LYS H 1.0 2.0 5.0 728 677 A 80 LEU HD2% A 85 LYS H 1.0 2.0 6.0 729 678 A 82 GLU HA A 85 LYS H 1.0 1.9 4.5 730 679 A 83 ASP HA A 85 LYS H 1.0 2.0 5.2 731 680 A 84 ARG HBx A 85 LYS H 1.0 1.9 5.5 732 681 A 84 ARG HBy A 85 LYS H 1.0 1.8 3.8 733 682 A 84 ARG HGx A 85 LYS H 1.0 2.0 5.8 734 683 A 85 LYS HA A 85 LYS H 1.0 1.7 3.3 735 684 A 85 LYS HBx A 85 LYS H 1.0 2.0 4.6 736 684 A 85 LYS HBy A 85 LYS H 1.0 2.0 4.6 737 685 A 85 LYS HDx A 85 LYS H 1.0 1.9 4.9 738 685 A 85 LYS HDy A 85 LYS H 1.0 1.9 4.9 739 686 A 85 LYS HGx A 85 LYS H 1.0 1.6 2.8 740 687 A 85 LYS H A 86 ASN HBx 1.0 1.8 6.0 741 688 A 85 LYS H A 86 ASN HBy 1.0 1.9 6.0 742 689 A 85 LYS H A 86 ASN H 1.0 1.8 3.6 743 690 A 85 LYS H A 87 VAL HGx% 1.0 2.0 6.0 744 691 A 87 VAL H A 85 LYS H 1.0 2.0 6.0 745 692 A 86 ASN HBx A 86 ASN HD2x 1.0 2.0 6.0 746 693 A 86 ASN HD2x A 86 ASN HD2y 1.0 1.4 2.2 747 694 A 39 GLY HAy A 86 ASN H 1.0 0.0 6.0 748 695 A 39 GLY H A 86 ASN H 1.0 1.9 6.0 749 696 A 84 ARG HA A 86 ASN H 1.0 2.0 6.0 750 697 A 85 LYS HA A 86 ASN H 1.0 2.0 5.0 751 698 A 85 LYS HBx A 86 ASN H 1.0 2.0 5.4 752 698 A 85 LYS HBy A 86 ASN H 1.0 2.0 5.4 753 699 A 85 LYS HGx A 86 ASN H 1.0 2.0 6.0 754 700 A 85 LYS HGy A 86 ASN H 1.0 0.0 6.0 755 701 A 86 ASN H A 86 ASN HD2y 1.0 2.0 5.4 756 702 A 86 ASN H A 86 ASN HD2x 1.0 2.0 6.0 757 703 A 87 VAL HB A 86 ASN H 1.0 2.0 6.0 758 704 A 86 ASN H A 87 VAL HGx% 1.0 2.0 6.0 759 705 A 87 VAL HGy% A 86 ASN H 1.0 1.1 6.0 760 706 A 87 VAL H A 86 ASN H 1.0 1.7 3.1 761 707 A 87 VAL H A 37 THR HA 1.0 2.0 6.0 762 708 A 87 VAL H A 38 LEU HBx 1.0 1.9 6.0 763 709 A 38 LEU HD1% A 87 VAL H 1.0 1.8 6.0 764 710 A 87 VAL H A 84 ARG HA 1.0 1.9 4.9 765 711 A 87 VAL H A 85 LYS HA 1.0 2.0 5.2 766 712 A 87 VAL H A 86 ASN HA 1.0 1.8 3.8 767 713 A 87 VAL H A 86 ASN HBx 1.0 2.0 6.0 768 714 A 87 VAL H A 86 ASN HBy 1.0 2.0 6.0 769 715 A 87 VAL H A 87 VAL HA 1.0 1.7 3.5 770 716 A 87 VAL HB A 87 VAL H 1.0 1.6 2.6 771 717 A 87 VAL HGy% A 87 VAL H 1.0 2.0 5.0 772 718 A 87 VAL H A 88 GLU H 1.0 2.0 6.0 773 719 A 38 LEU H A 88 GLU H 1.0 1.9 6.0 774 720 A 87 VAL HA A 88 GLU H 1.0 1.5 2.5 775 721 A 87 VAL HGx% A 88 GLU H 1.0 1.9 4.1 776 722 A 87 VAL HGy% A 88 GLU H 1.0 1.7 3.1 777 723 A 88 GLU HA A 88 GLU H 1.0 1.8 3.8 778 724 A 88 GLU H A 88 GLU HBx 1.0 1.6 2.8 779 724 A 88 GLU H A 88 GLU HBy 1.0 1.6 2.8 780 725 A 89 LEU H A 36 THR HA 1.0 2.0 6.0 781 726 A 89 LEU H A 87 VAL HGy% 1.0 0.0 6.0 782 727 A 88 GLU HA A 89 LEU H 1.0 1.7 2.9 783 728 A 89 LEU H A 88 GLU H 1.0 2.0 6.0 784 729 A 89 LEU H A 89 LEU HA 1.0 1.7 3.3 785 730 A 89 LEU H A 89 LEU HG 1.0 1.7 3.3 786 731 A 89 LEU H A 91 GLY H 1.0 1.8 6.0 787 732 A 89 LEU HD1% A 90 LEU H 1.0 1.8 6.0 788 733 A 90 LEU H A 89 LEU HBy 1.0 1.9 4.7 789 734 A 89 LEU HG A 90 LEU H 1.0 1.9 6.0 790 735 A 89 LEU H A 90 LEU H 1.0 2.0 6.0 791 736 A 90 LEU HBy A 90 LEU H 1.0 1.6 2.8 792 737 A 91 GLY HAy A 90 LEU H 1.0 1.9 6.0 793 738 A 91 GLY H A 90 LEU H 1.0 1.7 3.5 794 739 A 91 GLY H A 68 ASN HD2y 1.0 1.9 6.0 795 740 A 91 GLY H A 68 ASN HD2x 1.0 1.9 6.0 796 741 A 91 GLY H A 89 LEU HA 1.0 2.0 6.0 797 742 A 89 LEU HD1% A 91 GLY H 1.0 1.9 6.0 798 743 A 91 GLY H A 90 LEU HBx 1.0 2.0 6.0 799 744 A 91 GLY H A 90 LEU HBy 1.0 1.8 3.8 800 745 A 91 GLY H A 90 LEU HD1% 1.0 0.0 6.0 801 746 A 91 GLY H A 90 LEU HD2% 1.0 0.0 6.0 802 747 A 91 GLY H A 90 LEU HG 1.0 1.9 6.0 803 748 A 66 THR HA A 92 LYS H 1.0 1.9 6.0 804 749 A 92 LYS H A 67 GLU HBx 1.0 1.8 3.6 805 749 A 92 LYS H A 67 GLU HBy 1.0 1.8 3.6 806 750 A 67 GLU HGy A 92 LYS H 1.0 1.9 6.0 807 751 A 67 GLU H A 92 LYS H 1.0 2.0 4.8 808 752 A 68 ASN HD2y A 92 LYS H 1.0 1.9 6.0 809 753 A 92 LYS H A 91 GLY HAy 1.0 1.7 3.5 810 754 A 91 GLY H A 92 LYS H 1.0 2.0 6.0 811 755 A 92 LYS HBx A 92 LYS H 1.0 1.7 3.3 812 756 A 92 LYS HBy A 92 LYS H 1.0 1.5 2.7 813 757 A 92 LYS H A 92 LYS HDx 1.0 1.8 4.0 814 757 A 92 LYS H A 92 LYS HDy 1.0 1.8 4.0 815 758 A 92 LYS H A 92 LYS HEx 1.0 1.9 6.0 816 758 A 92 LYS H A 92 LYS HEy 1.0 1.9 6.0 817 759 A 92 LYS H A 92 LYS HGx 1.0 1.9 4.7 818 760 A 92 LYS H A 93 MET H 1.0 2.0 6.0 819 761 A 120 ALA HB% A 92 LYS H 1.0 2.0 6.0 820 762 A 41 LEU HD1% A 93 MET H 1.0 2.0 6.0 821 763 A 41 LEU HD2% A 93 MET H 1.0 1.9 6.0 822 764 A 66 THR HA A 93 MET H 1.0 2.0 6.0 823 765 A 66 THR HG2% A 93 MET H 1.0 2.0 6.0 824 766 A 89 LEU HD1% A 93 MET H 1.0 2.0 6.0 825 767 A 89 LEU HD2% A 93 MET H 1.0 0.0 6.0 826 768 A 93 MET H A 92 LYS HA 1.0 1.6 2.8 827 769 A 92 LYS HBx A 93 MET H 1.0 1.9 4.3 828 770 A 92 LYS HBy A 93 MET H 1.0 2.0 5.8 829 771 A 93 MET HA A 93 MET H 1.0 1.8 3.8 830 772 A 93 MET H A 93 MET HBx 1.0 1.8 3.6 831 773 A 93 MET H A 93 MET HBy 1.0 1.7 3.1 832 774 A 93 MET H A 93 MET HGy 1.0 2.0 6.0 833 774 A 93 MET H A 93 MET HGx 1.0 2.0 6.0 834 775 A 94 TYR H A 93 MET H 1.0 2.0 6.0 835 776 A 93 MET H A 113 PRO HDx 1.0 1.8 6.0 836 777 A 93 MET H A 113 PRO HDy 1.0 2.0 6.0 837 778 A 65 LEU H A 94 TYR H 1.0 2.0 6.0 838 779 A 66 THR HB A 94 TYR H 1.0 1.9 6.0 839 780 A 94 TYR H A 93 MET HBy 1.0 1.9 6.0 840 781 A 94 TYR H A 94 TYR HD% 1.0 1.8 6.0 841 782 A 64 ILE HG2% A 95 LYS H 1.0 2.0 6.0 842 783 A 95 LYS H A 65 LEU HA 1.0 1.9 6.0 843 784 A 95 LYS H A 65 LEU HBx 1.0 2.0 5.4 844 785 A 65 LEU HBy A 95 LYS H 1.0 1.9 4.1 845 786 A 65 LEU HD1% A 95 LYS H 1.0 2.0 6.0 846 787 A 65 LEU HG A 95 LYS H 1.0 2.0 6.0 847 788 A 95 LYS H A 66 THR HA 1.0 2.0 6.0 848 789 A 95 LYS H A 93 MET HA 1.0 2.0 6.0 849 790 A 95 LYS H A 93 MET HGy 1.0 2.0 4.8 850 790 A 95 LYS H A 93 MET HGx 1.0 2.0 4.8 851 791 A 95 LYS H A 94 TYR HA 1.0 2.0 5.6 852 792 A 95 LYS H A 94 TYR HBx 1.0 1.8 3.6 853 793 A 95 LYS H A 94 TYR HBy 1.0 2.0 5.4 854 794 A 95 LYS H A 94 TYR HE% 1.0 1.9 6.0 855 795 A 95 LYS H A 94 TYR H 1.0 1.7 3.3 856 796 A 95 LYS H A 95 LYS HA 1.0 1.9 4.1 857 797 A 95 LYS H A 95 LYS HBx 1.0 1.9 4.5 858 798 A 95 LYS H A 95 LYS HBy 1.0 2.0 4.8 859 799 A 95 LYS H A 95 LYS HDy 1.0 1.9 6.0 860 800 A 95 LYS H A 95 LYS HGx 1.0 2.0 6.0 861 801 A 95 LYS H A 95 LYS HGy 1.0 2.0 6.0 862 802 A 95 LYS H A 96 THR HG1 1.0 2.0 6.0 863 803 A 95 LYS H A 96 THR H 1.0 2.0 6.0 864 804 A 96 THR H A 93 MET HE% 1.0 2.0 5.2 865 805 A 96 THR H A 93 MET HGy 1.0 1.9 6.0 866 805 A 96 THR H A 93 MET HGx 1.0 1.9 6.0 867 806 A 96 THR H A 95 LYS HA 1.0 1.6 2.8 868 807 A 96 THR H A 95 LYS HBx 1.0 1.9 4.9 869 808 A 96 THR H A 95 LYS HBy 1.0 2.0 5.2 870 809 A 96 THR H A 95 LYS HDx 1.0 1.9 6.0 871 810 A 96 THR H A 95 LYS HDy 1.0 1.9 6.0 872 811 A 96 THR H A 95 LYS HGy 1.0 1.9 6.0 873 812 A 96 THR HA A 96 THR H 1.0 1.9 4.1 874 813 A 96 THR H A 96 THR HB 1.0 1.8 3.6 875 814 A 96 THR HG1 A 96 THR H 1.0 1.9 4.1 876 815 A 96 THR H A 96 THR HG2% 1.0 2.0 5.4 877 816 A 97 TYR H A 96 THR H 1.0 2.0 6.0 878 817 A 96 THR H A 109 VAL HGy% 1.0 1.9 4.1 879 817 A 96 THR H A 109 VAL HGx% 1.0 1.9 4.1 880 818 A 96 THR H A 110 ILE HB 1.0 2.0 4.8 881 819 A 110 ILE HD1% A 96 THR H 1.0 1.9 6.0 882 820 A 96 THR H A 110 ILE H 1.0 1.8 3.8 883 821 A 96 THR H A 112 GLY H 1.0 1.9 6.0 884 822 A 62 MET HBy A 97 TYR H 1.0 2.0 5.0 885 823 A 97 TYR H A 63 VAL HB 1.0 2.0 6.0 886 824 A 63 VAL HGy% A 97 TYR H 1.0 1.9 4.5 887 825 A 96 THR HA A 97 TYR H 1.0 1.6 2.8 888 826 A 97 TYR H A 96 THR HB 1.0 1.9 6.0 889 827 A 97 TYR H A 96 THR HG1 1.0 1.7 6.0 890 828 A 97 TYR H A 97 TYR HA 1.0 1.9 4.1 891 829 A 97 TYR HBx A 97 TYR H 1.0 2.0 6.0 892 830 A 97 TYR H A 97 TYR HD% 1.0 1.9 4.7 893 831 A 97 TYR H A 97 TYR HE% 1.0 1.7 6.0 894 832 A 97 TYR H A 98 PHE H 1.0 2.0 5.6 895 833 A 97 TYR H A 109 VAL HGy% 1.0 1.9 6.0 896 833 A 97 TYR H A 109 VAL HGx% 1.0 1.9 6.0 897 834 A 98 PHE H A 107 SER H 1.0 2.0 6.0 898 835 A 49 LEU HD2% A 98 PHE H 1.0 1.8 6.0 899 836 A 96 THR HG2% A 98 PHE H 1.0 1.9 6.0 900 837 A 97 TYR HA A 98 PHE H 1.0 1.6 3.0 901 838 A 97 TYR HE% A 98 PHE H 1.0 1.7 6.0 902 839 A 98 PHE H A 98 PHE HBx 1.0 2.0 5.0 903 840 A 98 PHE H A 98 PHE HBy 1.0 1.8 3.6 904 841 A 98 PHE H A 98 PHE HD% 1.0 1.8 3.8 905 842 A 99 PHE HD% A 98 PHE H 1.0 1.9 5.5 906 843 A 98 PHE H A 106 SER HA 1.0 2.0 6.0 907 844 A 98 PHE H A 106 SER HBx 1.0 2.0 6.0 908 845 A 98 PHE H A 108 TYR HBy 1.0 2.0 5.8 909 845 A 98 PHE H A 108 TYR HBx 1.0 2.0 5.8 910 846 A 98 PHE H A 108 TYR H 1.0 2.0 4.4 911 847 A 98 PHE H A 109 VAL HB 1.0 1.8 6.0 912 848 A 109 VAL HGy% A 98 PHE H 1.0 1.9 6.0 913 848 A 109 VAL HGx% A 98 PHE H 1.0 1.9 6.0 914 849 A 110 ILE H A 98 PHE H 1.0 1.9 6.0 915 850 A 60 GLU H A 99 PHE H 1.0 2.0 5.8 916 851 A 61 LYS HGy A 99 PHE H 1.0 1.9 6.0 917 852 A 76 LEU HD2% A 99 PHE H 1.0 2.0 5.8 918 852 A 76 LEU HD1% A 99 PHE H 1.0 2.0 5.8 919 853 A 99 PHE H A 98 PHE HBx 1.0 2.0 5.4 920 854 A 99 PHE H A 98 PHE HBy 1.0 2.0 6.0 921 855 A 99 PHE H A 98 PHE HD% 1.0 2.0 6.0 922 856 A 99 PHE H A 98 PHE H 1.0 1.9 6.0 923 857 A 99 PHE H A 99 PHE HA 1.0 1.9 4.5 924 858 A 99 PHE HBx A 99 PHE H 1.0 2.0 6.0 925 859 A 99 PHE HD% A 99 PHE H 1.0 1.9 4.1 926 860 A 99 PHE H A 99 PHE HE% 1.0 1.9 6.0 927 861 A 99 PHE H A 100 LYS H 1.0 2.0 6.0 928 862 A 60 GLU H A 100 LYS H 1.0 1.9 6.0 929 863 A 99 PHE HA A 100 LYS H 1.0 1.7 3.1 930 864 A 99 PHE HBy A 100 LYS H 1.0 2.0 6.0 931 865 A 100 LYS HA A 100 LYS H 1.0 1.9 4.3 932 866 A 100 LYS HBy A 100 LYS H 1.0 1.9 3.7 933 867 A 100 LYS H A 100 LYS HDy 1.0 1.7 3.1 934 868 A 100 LYS H A 100 LYS HEx 1.0 1.7 6.0 935 869 A 100 LYS H A 100 LYS HEy 1.0 1.4 6.0 936 870 A 100 LYS H A 101 LYS H 1.0 1.9 6.0 937 871 A 100 LYS H A 103 GLU HBx 1.0 2.0 5.8 938 872 A 100 LYS H A 103 GLU HBy 1.0 1.9 4.3 939 873 A 106 SER HA A 100 LYS H 1.0 2.0 6.0 940 874 A 58 GLN HGx A 101 LYS H 1.0 2.0 6.0 941 875 A 58 GLN HGy A 101 LYS H 1.0 0.0 6.0 942 876 A 59 PHE HA A 101 LYS H 1.0 1.9 4.3 943 877 A 101 LYS H A 60 GLU HBx 1.0 1.8 4.2 944 877 A 101 LYS H A 60 GLU HBy 1.0 1.8 4.2 945 878 A 60 GLU HGy A 101 LYS H 1.0 1.9 6.0 946 879 A 60 GLU H A 101 LYS H 1.0 2.0 5.0 947 880 A 100 LYS HA A 101 LYS H 1.0 1.6 2.8 948 881 A 100 LYS HBx A 101 LYS H 1.0 1.6 3.0 949 882 A 100 LYS HBy A 101 LYS H 1.0 2.0 5.6 950 883 A 100 LYS HGx A 101 LYS H 1.0 2.0 6.0 951 884 A 100 LYS HGy A 101 LYS H 1.0 1.9 6.0 952 885 A 101 LYS H A 101 LYS HDx 1.0 1.9 6.0 953 885 A 101 LYS H A 101 LYS HDy 1.0 1.9 6.0 954 886 A 101 LYS H A 101 LYS HEx 1.0 1.9 6.0 955 886 A 101 LYS H A 101 LYS HEy 1.0 1.9 6.0 956 887 A 101 LYS H A 101 LYS HGy 1.0 2.0 5.8 957 887 A 101 LYS H A 101 LYS HGx 1.0 2.0 5.8 958 888 A 101 LYS H A 101 LYS HGy 1.0 2.0 6.0 959 888 A 101 LYS H A 101 LYS HGx 1.0 2.0 6.0 960 889 A 60 GLU HBx A 102 GLY H 1.0 2.0 6.0 961 889 A 60 GLU HBy A 102 GLY H 1.0 2.0 6.0 962 890 A 60 GLU HGx A 102 GLY H 1.0 0.0 6.0 963 891 A 60 GLU HGy A 102 GLY H 1.0 0.0 6.0 964 892 A 102 GLY H A 101 LYS HBx 1.0 2.0 6.0 965 892 A 102 GLY H A 101 LYS HBy 1.0 2.0 6.0 966 893 A 101 LYS HDx A 102 GLY H 1.0 0.0 6.0 967 893 A 101 LYS HDy A 102 GLY H 1.0 0.0 6.0 968 894 A 101 LYS HGy A 102 GLY H 1.0 1.9 4.7 969 894 A 101 LYS HGx A 102 GLY H 1.0 1.9 4.7 970 895 A 101 LYS HGy A 102 GLY H 1.0 1.9 4.5 971 895 A 101 LYS HGx A 102 GLY H 1.0 1.9 4.5 972 896 A 101 LYS H A 102 GLY H 1.0 1.9 4.7 973 897 A 102 GLY H A 102 GLY HAx 1.0 1.7 3.1 974 898 A 102 GLY H A 102 GLY HAy 1.0 1.7 3.1 975 899 A 60 GLU HBx A 103 GLU H 1.0 0.0 6.0 976 899 A 60 GLU HBy A 103 GLU H 1.0 0.0 6.0 977 900 A 100 LYS HBx A 103 GLU H 1.0 2.0 6.0 978 901 A 100 LYS HBy A 103 GLU H 1.0 2.0 6.0 979 902 A 100 LYS H A 103 GLU H 1.0 2.0 6.0 980 903 A 102 GLY HAx A 103 GLU H 1.0 1.9 4.1 981 904 A 102 GLY HAy A 103 GLU H 1.0 2.0 5.2 982 905 A 102 GLY H A 103 GLU H 1.0 1.8 3.6 983 906 A 103 GLU HBx A 103 GLU H 1.0 1.9 4.3 984 907 A 103 GLU HBy A 103 GLU H 1.0 1.7 3.1 985 908 A 103 GLU H A 104 SER H 1.0 2.0 6.0 986 909 A 103 GLU H A 105 LYS H 1.0 1.8 6.0 987 910 A 103 GLU HBx A 104 SER H 1.0 1.9 4.3 988 911 A 103 GLU HBy A 104 SER H 1.0 2.0 5.6 989 912 A 104 SER H A 104 SER HBx 1.0 2.0 4.8 990 913 A 104 SER H A 105 LYS HBy 1.0 1.8 6.0 991 914 A 104 SER H A 105 LYS H 1.0 1.6 3.0 992 915 A 99 PHE HD% A 105 LYS H 1.0 2.0 5.8 993 916 A 103 GLU HBx A 105 LYS H 1.0 1.8 3.8 994 917 A 103 GLU HBy A 105 LYS H 1.0 2.0 5.4 995 918 A 105 LYS H A 104 SER HA 1.0 2.0 4.8 996 919 A 105 LYS H A 104 SER HBx 1.0 2.0 6.0 997 920 A 105 LYS H A 104 SER HBy 1.0 2.0 6.0 998 921 A 105 LYS H A 105 LYS HA 1.0 1.8 4.0 999 922 A 105 LYS H A 105 LYS HBx 1.0 1.8 3.8 1000 923 A 105 LYS H A 105 LYS HBy 1.0 1.8 3.6 1001 924 A 105 LYS H A 105 LYS HGx 1.0 2.0 5.6 1002 925 A 105 LYS H A 105 LYS HGy 1.0 2.0 5.6 1003 926 A 105 LYS H A 106 SER H 1.0 2.0 6.0 1004 927 A 105 LYS HA A 106 SER H 1.0 1.6 3.0 1005 928 A 106 SER H A 105 LYS HBx 1.0 2.0 5.2 1006 929 A 106 SER H A 105 LYS HBy 1.0 2.0 5.6 1007 930 A 105 LYS HGx A 106 SER H 1.0 2.0 5.2 1008 931 A 105 LYS HGy A 106 SER H 1.0 2.0 5.0 1009 932 A 106 SER HA A 106 SER H 1.0 1.9 4.3 1010 933 A 106 SER HBx A 106 SER H 1.0 1.9 4.3 1011 934 A 106 SER H A 106 SER HBy 1.0 2.0 4.6 1012 935 A 107 SER H A 106 SER H 1.0 2.0 6.0 1013 936 A 107 SER H A 98 PHE HBy 1.0 2.0 6.0 1014 937 A 107 SER H A 99 PHE HA 1.0 2.0 5.0 1015 938 A 107 SER H A 100 LYS H 1.0 0.0 6.0 1016 939 A 107 SER H A 106 SER HA 1.0 1.7 3.3 1017 940 A 107 SER H A 106 SER HBx 1.0 2.0 5.8 1018 941 A 107 SER H A 106 SER HBy 1.0 2.0 5.2 1019 942 A 107 SER H A 107 SER HA 1.0 1.9 4.7 1020 943 A 107 SER H A 107 SER HBx 1.0 2.0 5.8 1021 944 A 107 SER H A 107 SER HBy 1.0 2.0 5.4 1022 945 A 107 SER H A 108 TYR HBy 1.0 1.7 6.0 1023 945 A 107 SER H A 108 TYR HBx 1.0 1.7 6.0 1024 946 A 107 SER H A 108 TYR H 1.0 1.6 2.8 1025 947 A 98 PHE HA A 108 TYR H 1.0 0.0 6.0 1026 948 A 98 PHE HBy A 108 TYR H 1.0 2.0 5.0 1027 949 A 108 TYR H A 99 PHE HA 1.0 0.0 6.0 1028 950 A 106 SER HA A 108 TYR H 1.0 1.9 6.0 1029 951 A 106 SER HBx A 108 TYR H 1.0 2.0 6.0 1030 952 A 108 TYR H A 106 SER HBy 1.0 2.0 6.0 1031 953 A 108 TYR H A 108 TYR HBy 1.0 1.9 3.9 1032 953 A 108 TYR H A 108 TYR HBx 1.0 1.9 3.9 1033 954 A 108 TYR H A 108 TYR HBy 1.0 1.9 4.5 1034 954 A 108 TYR H A 108 TYR HBx 1.0 1.9 4.5 1035 955 A 109 VAL HGy% A 108 TYR H 1.0 2.0 6.0 1036 955 A 109 VAL HGx% A 108 TYR H 1.0 2.0 6.0 1037 956 A 107 SER HA A 109 VAL H 1.0 0.0 6.0 1038 957 A 109 VAL H A 108 TYR HA 1.0 1.7 3.1 1039 958 A 109 VAL H A 108 TYR HBy 1.0 1.9 6.0 1040 958 A 109 VAL H A 108 TYR HBx 1.0 1.9 6.0 1041 959 A 108 TYR H A 109 VAL H 1.0 2.0 5.4 1042 960 A 109 VAL H A 109 VAL HA 1.0 1.8 4.0 1043 961 A 109 VAL HB A 109 VAL H 1.0 1.9 4.1 1044 962 A 109 VAL HGy% A 109 VAL H 1.0 1.7 3.5 1045 962 A 109 VAL HGx% A 109 VAL H 1.0 1.7 3.5 1046 963 A 110 ILE H A 109 VAL H 1.0 1.9 6.0 1047 964 A 96 THR HB A 110 ILE H 1.0 1.9 4.7 1048 965 A 96 THR HG1 A 110 ILE H 1.0 1.9 6.0 1049 966 A 96 THR HG2% A 110 ILE H 1.0 2.0 6.0 1050 967 A 110 ILE H A 97 TYR HA 1.0 2.0 5.4 1051 968 A 110 ILE H A 98 PHE HD% 1.0 2.0 5.8 1052 969 A 109 VAL HGy% A 110 ILE H 1.0 1.7 3.3 1053 969 A 109 VAL HGx% A 110 ILE H 1.0 1.7 3.3 1054 970 A 110 ILE H A 110 ILE HA 1.0 1.9 4.5 1055 971 A 110 ILE HB A 110 ILE H 1.0 1.8 3.4 1056 972 A 110 ILE H A 110 ILE HG1x 1.0 1.9 4.7 1057 973 A 110 ILE H A 110 ILE HG1y 1.0 2.0 6.0 1058 974 A 110 ILE HG2% A 110 ILE H 1.0 2.0 6.0 1059 975 A 110 ILE H A 111 ASN H 1.0 2.0 6.0 1060 976 A 111 ASN HD2y A 95 LYS HEy 1.0 2.0 6.0 1061 977 A 109 VAL HGy% A 111 ASN HD2y 1.0 1.9 4.9 1062 977 A 109 VAL HGx% A 111 ASN HD2y 1.0 1.9 4.9 1063 978 A 111 ASN HD2y A 111 ASN HD2x 1.0 1.3 2.2 1064 979 A 111 ASN HD2x A 95 LYS HEx 1.0 1.9 6.0 1065 980 A 109 VAL HGy% A 111 ASN HD2x 1.0 2.0 5.6 1066 980 A 109 VAL HGx% A 111 ASN HD2x 1.0 2.0 5.6 1067 981 A 111 ASN HD2x A 111 ASN HBy 1.0 1.9 6.0 1068 982 A 95 LYS HA A 111 ASN H 1.0 1.8 6.0 1069 983 A 109 VAL HGy% A 111 ASN H 1.0 2.0 5.8 1070 983 A 109 VAL HGx% A 111 ASN H 1.0 2.0 5.8 1071 984 A 110 ILE HA A 111 ASN H 1.0 1.7 3.1 1072 985 A 110 ILE HB A 111 ASN H 1.0 2.0 6.0 1073 986 A 110 ILE HD1% A 111 ASN H 1.0 0.0 6.0 1074 987 A 110 ILE HG2% A 111 ASN H 1.0 1.9 4.3 1075 988 A 111 ASN H A 111 ASN HBx 1.0 2.0 5.2 1076 989 A 111 ASN H A 111 ASN HBy 1.0 1.8 3.6 1077 990 A 111 ASN H A 111 ASN HD2y 1.0 2.0 5.2 1078 991 A 111 ASN H A 111 ASN HD2x 1.0 1.9 6.0 1079 992 A 95 LYS HA A 112 GLY H 1.0 1.9 4.5 1080 993 A 95 LYS HBx A 112 GLY H 1.0 0.0 6.0 1081 994 A 95 LYS HBy A 112 GLY H 1.0 2.0 6.0 1082 995 A 95 LYS HDy A 112 GLY H 1.0 0.0 6.0 1083 996 A 95 LYS HGx A 112 GLY H 1.0 0.0 6.0 1084 997 A 95 LYS H A 112 GLY H 1.0 1.9 6.0 1085 998 A 112 GLY H A 111 ASN HBy 1.0 2.0 6.0 1086 999 A 112 GLY H A 111 ASN H 1.0 2.0 6.0 1087 1000 A 112 GLY H A 112 GLY HAy 1.0 1.9 4.1 1088 1001 A 113 PRO HDx A 112 GLY H 1.0 1.9 6.0 1089 1002 A 113 PRO HDy A 112 GLY H 1.0 2.0 6.0 1090 1003 A 67 GLU HGx A 114 GLY H 1.0 1.9 6.0 1091 1004 A 67 GLU HGy A 114 GLY H 1.0 1.9 6.0 1092 1005 A 92 LYS HBx A 114 GLY H 1.0 1.9 4.7 1093 1006 A 92 LYS HBy A 114 GLY H 1.0 2.0 6.0 1094 1007 A 92 LYS HEx A 114 GLY H 1.0 0.0 6.0 1095 1007 A 92 LYS HEy A 114 GLY H 1.0 0.0 6.0 1096 1008 A 114 GLY H A 92 LYS HGy 1.0 2.0 6.0 1097 1009 A 93 MET H A 114 GLY H 1.0 1.9 6.0 1098 1010 A 94 TYR HBx A 114 GLY H 1.0 1.6 6.0 1099 1011 A 94 TYR HBy A 114 GLY H 1.0 2.0 6.0 1100 1012 A 112 GLY H A 114 GLY H 1.0 0.0 6.0 1101 1013 A 114 GLY H A 113 PRO HA 1.0 1.8 3.8 1102 1014 A 114 GLY H A 113 PRO HBx 1.0 2.0 6.0 1103 1015 A 114 GLY H A 113 PRO HBy 1.0 2.0 5.6 1104 1016 A 113 PRO HDy A 114 GLY H 1.0 0.0 6.0 1105 1017 A 114 GLY H A 113 PRO HGy 1.0 2.0 5.4 1106 1018 A 114 GLY H A 114 GLY HAx 1.0 1.7 3.3 1107 1019 A 114 GLY H A 114 GLY HAy 1.0 1.7 3.1 1108 1020 A 114 GLY H A 115 LYS H 1.0 1.9 4.1 1109 1021 A 67 GLU HGx A 115 LYS H 1.0 2.0 6.0 1110 1022 A 67 GLU HGy A 115 LYS H 1.0 2.0 6.0 1111 1023 A 115 LYS H A 115 LYS HDx 1.0 1.9 6.0 1112 1023 A 115 LYS H A 115 LYS HDy 1.0 1.9 6.0 1113 1024 A 115 LYS H A 115 LYS HEx 1.0 1.8 6.0 1114 1024 A 115 LYS H A 115 LYS HEy 1.0 1.8 6.0 1115 1025 A 116 THR HG2% A 115 LYS H 1.0 1.9 6.0 1116 1026 A 67 GLU HA A 116 THR H 1.0 2.0 6.0 1117 1027 A 67 GLU HBx A 116 THR H 1.0 1.9 6.0 1118 1027 A 67 GLU HBy A 116 THR H 1.0 1.9 6.0 1119 1028 A 67 GLU HGy A 116 THR H 1.0 1.9 4.3 1120 1029 A 67 GLU H A 116 THR H 1.0 1.8 6.0 1121 1030 A 94 TYR HBx A 116 THR H 1.0 1.9 6.0 1122 1031 A 114 GLY HAy A 116 THR H 1.0 2.0 6.0 1123 1032 A 116 THR H A 115 LYS HBy 1.0 2.0 6.0 1124 1033 A 115 LYS H A 116 THR H 1.0 1.8 4.0 1125 1034 A 116 THR H A 116 THR HB 1.0 2.0 5.2 1126 1035 A 117 ASN HD2x A 116 THR H 1.0 1.8 6.0 1127 1036 A 116 THR H A 117 ASN H 1.0 2.0 6.0 1128 1037 A 65 LEU HA A 117 ASN HD2y 1.0 2.0 6.0 1129 1038 A 65 LEU HBy A 117 ASN HD2y 1.0 1.8 6.0 1130 1039 A 117 ASN HD2y A 117 ASN HD2x 1.0 1.3 2.2 1131 1040 A 65 LEU HA A 117 ASN HD2x 1.0 2.0 5.8 1132 1041 A 65 LEU HBy A 117 ASN HD2x 1.0 2.0 5.0 1133 1042 A 65 LEU HD2% A 117 ASN HD2x 1.0 0.0 6.0 1134 1043 A 65 LEU HG A 117 ASN HD2x 1.0 0.0 6.0 1135 1044 A 117 ASN H A 116 THR HA 1.0 1.7 3.3 1136 1045 A 116 THR HB A 117 ASN H 1.0 2.0 6.0 1137 1046 A 116 THR HG2% A 117 ASN H 1.0 2.0 5.4 1138 1047 A 117 ASN HA A 117 ASN H 1.0 1.8 3.8 1139 1048 A 117 ASN HD2y A 117 ASN H 1.0 2.0 6.0 1140 1049 A 117 ASN HD2x A 117 ASN H 1.0 2.0 6.0 1141 1050 A 118 GLU HA A 117 ASN H 1.0 1.9 6.0 1142 1051 A 117 ASN H A 118 GLU HBx 1.0 1.8 6.0 1143 1052 A 117 ASN H A 118 GLU HBy 1.0 2.0 6.0 1144 1053 A 117 ASN H A 118 GLU HGx 1.0 2.0 6.0 1145 1054 A 117 ASN H A 118 GLU HGy 1.0 2.0 6.0 1146 1055 A 117 ASN H A 118 GLU H 1.0 1.6 3.0 1147 1056 A 116 THR HA A 118 GLU H 1.0 2.0 6.0 1148 1057 A 116 THR HG2% A 118 GLU H 1.0 1.7 3.1 1149 1058 A 117 ASN HA A 118 GLU H 1.0 1.9 3.9 1150 1059 A 118 GLU H A 117 ASN HBx 1.0 2.0 6.0 1151 1060 A 118 GLU H A 117 ASN HBy 1.0 2.0 5.8 1152 1061 A 118 GLU HA A 118 GLU H 1.0 1.8 3.6 1153 1062 A 118 GLU HBx A 118 GLU H 1.0 1.9 4.7 1154 1063 A 118 GLU HBy A 118 GLU H 1.0 1.7 3.3 1155 1064 A 118 GLU HGx A 118 GLU H 1.0 1.9 4.1 1156 1065 A 118 GLU HGy A 118 GLU H 1.0 1.8 3.8 1157 1066 A 118 GLU H A 119 TYR H 1.0 1.9 4.5 1158 1067 A 68 ASN HA A 119 TYR H 1.0 2.0 6.0 1159 1068 A 68 ASN HD2x A 119 TYR H 1.0 2.0 6.0 1160 1069 A 68 ASN H A 119 TYR H 1.0 2.0 5.6 1161 1070 A 69 LYS HDx A 119 TYR H 1.0 0.0 6.0 1162 1070 A 69 LYS HDy A 119 TYR H 1.0 0.0 6.0 1163 1071 A 69 LYS HGx A 119 TYR H 1.0 1.9 5.3 1164 1072 A 69 LYS HGy A 119 TYR H 1.0 2.0 6.0 1165 1073 A 116 THR HG2% A 119 TYR H 1.0 2.0 5.8 1166 1074 A 118 GLU HA A 119 TYR H 1.0 1.7 3.1 1167 1075 A 118 GLU HBx A 119 TYR H 1.0 0.0 6.0 1168 1076 A 118 GLU HBy A 119 TYR H 1.0 2.0 4.6 1169 1077 A 118 GLU HGx A 119 TYR H 1.0 2.0 5.8 1170 1078 A 118 GLU HGy A 119 TYR H 1.0 2.0 5.4 1171 1079 A 119 TYR H A 119 TYR HA 1.0 1.8 3.6 1172 1080 A 119 TYR H A 119 TYR HBx 1.0 1.9 4.5 1173 1081 A 119 TYR H A 119 TYR HBy 1.0 1.8 3.4 1174 1082 A 120 ALA HB% A 119 TYR H 1.0 1.8 6.0 1175 1083 A 67 GLU HBx A 120 ALA H 1.0 2.0 5.2 1176 1083 A 67 GLU HBy A 120 ALA H 1.0 2.0 5.2 1177 1084 A 68 ASN HA A 120 ALA H 1.0 2.0 6.0 1178 1085 A 68 ASN HD2y A 120 ALA H 1.0 1.9 6.0 1179 1086 A 68 ASN HD2x A 120 ALA H 1.0 1.9 4.9 1180 1087 A 68 ASN H A 120 ALA H 1.0 1.9 4.9 1181 1088 A 116 THR HG2% A 120 ALA H 1.0 2.0 5.8 1182 1089 A 116 THR H A 120 ALA H 1.0 2.0 6.0 1183 1090 A 119 TYR HA A 120 ALA H 1.0 1.5 2.5 1184 1091 A 119 TYR HBx A 120 ALA H 1.0 2.0 5.0 1185 1092 A 119 TYR HBy A 120 ALA H 1.0 2.0 6.0 1186 1093 A 119 TYR H A 120 ALA H 1.0 1.9 5.5 1187 1094 A 120 ALA H A 120 ALA HA 1.0 1.7 3.5 1188 1095 A 120 ALA HB% A 120 ALA H 1.0 1.7 2.9 1189 1096 A 120 ALA H A 121 TYR HA 1.0 2.0 6.0 1190 1097 A 116 THR HG2% A 121 TYR H 1.0 0.0 6.0 1191 1098 A 119 TYR HA A 121 TYR H 1.0 0.0 6.0 1192 1099 A 119 TYR HBy A 121 TYR H 1.0 0.0 6.0 1193 1100 A 120 ALA HA A 121 TYR H 1.0 1.5 2.7 1194 1101 A 120 ALA HB% A 121 TYR H 1.0 1.9 4.9 1195 1102 A 120 ALA H A 121 TYR H 1.0 2.0 4.8 1196 1103 A 121 TYR HA A 121 TYR H 1.0 1.8 3.4 1197 1104 A 121 TYR H A 121 TYR HBx 1.0 1.9 4.3 1198 1105 A 121 TYR H A 121 TYR HBy 1.0 1.8 3.4 1199 1106 A 35 PRO HGx A 41 LEU H 1.0 2.0 6.0 1200 1106 A 35 PRO HGy A 41 LEU H 1.0 2.0 6.0 1201 1107 A 38 LEU HD1% A 72 TYR HE% 1.0 2.0 6.0 1202 1108 A 41 LEU HBx A 41 LEU HD1% 1.0 1.9 3.7 1203 1109 A 41 LEU HBy A 41 LEU HD1% 1.0 1.6 2.6 1204 1110 A 47 ASN H A 42 ASP HA 1.0 1.9 6.0 1205 1111 A 46 ARG HA A 50 LYS H 1.0 2.0 6.0 1206 1112 A 48 TYR HA A 110 ILE HD1% 1.0 1.9 6.0 1207 1113 A 46 ARG HA A 49 LEU HD1% 1.0 1.9 4.5 1208 1114 A 49 LEU HD1% A 98 PHE HZ 1.0 1.7 3.3 1209 1114 A 49 LEU HD1% A 98 PHE HE% 1.0 1.7 3.3 1210 1115 A 53 THR HG2% A 56 SER HA 1.0 2.0 6.0 1211 1116 A 53 THR H A 55 ASN HA 1.0 1.9 6.0 1212 1117 A 62 MET HE% A 46 ARG HA 1.0 2.0 6.0 1213 1118 A 41 LEU HD1% A 64 ILE HG2% 1.0 1.6 2.8 1214 1119 A 67 GLU HGx A 114 GLY HAx 1.0 1.9 5.3 1215 1120 A 67 GLU HGy A 114 GLY HAx 1.0 2.0 5.2 1216 1121 A 74 VAL HA A 75 TYR HBy 1.0 1.9 6.0 1217 1122 A 61 LYS HBy A 74 VAL HB 1.0 2.0 6.0 1218 1123 A 76 LEU HD2% A 75 TYR HA 1.0 1.9 6.0 1219 1123 A 76 LEU HD1% A 75 TYR HA 1.0 1.9 6.0 1220 1124 A 87 VAL HGx% A 36 THR HB 1.0 2.0 6.0 1221 1124 A 87 VAL HGx% A 36 THR HA 1.0 2.0 6.0 1222 1125 A 67 GLU H A 91 GLY HAy 1.0 2.0 6.0 1223 1126 A 62 MET H A 96 THR HG2% 1.0 2.0 6.0 1224 1127 A 100 LYS HEx A 59 PHE HD% 1.0 2.0 6.0 1225 1128 A 100 LYS HEy A 59 PHE HD% 1.0 1.9 4.9 1226 1129 A 92 LYS HGx A 114 GLY H 1.0 1.9 6.0 1227 1130 A 114 GLY H A 92 LYS HGy 1.0 2.0 6.0 1228 1131 A 109 VAL HGy% A 111 ASN H 1.0 1.8 6.0 1229 1132 A 45 LEU HA A 110 ILE HG2% 1.0 2.0 6.0 1230 1133 A 118 GLU HA A 69 LYS HEx 1.0 0.0 6.0 1231 1133 A 118 GLU HA A 69 LYS HEy 1.0 0.0 6.0 1232 1134 A 69 LYS HDx A 118 GLU HA 1.0 2.0 4.6 1233 1134 A 69 LYS HDy A 118 GLU HA 1.0 2.0 4.6 1234 1135 A 33 GLY H A 33 GLY HAx 1.0 1.9 5.3 1235 1135 A 33 GLY HAy A 33 GLY H 1.0 1.9 5.3 1236 1136 A 34 LEU HBx A 34 LEU HA 1.0 1.8 3.6 1237 1137 A 34 LEU HA A 34 LEU HBy 1.0 1.8 3.8 1238 1138 A 34 LEU HD1% A 34 LEU HA 1.0 2.0 5.8 1239 1139 A 34 LEU HA A 34 LEU HD2% 1.0 1.8 3.6 1240 1140 A 34 LEU HA A 34 LEU HG 1.0 1.9 4.3 1241 1141 A 35 PRO HDx A 34 LEU HA 1.0 1.5 2.3 1242 1142 A 34 LEU HA A 35 PRO HDy 1.0 1.7 3.1 1243 1143 A 34 LEU HBx A 35 PRO HDy 1.0 1.9 4.3 1244 1144 A 35 PRO HDx A 34 LEU HBy 1.0 2.0 6.0 1245 1145 A 34 LEU HBy A 35 PRO HDy 1.0 1.9 4.9 1246 1146 A 34 LEU HD2% A 35 PRO HDy 1.0 2.0 4.8 1247 1147 A 34 LEU H A 33 GLY HAx 1.0 1.8 3.4 1248 1147 A 34 LEU H A 33 GLY HAy 1.0 1.8 3.4 1249 1148 A 34 LEU H A 34 LEU HA 1.0 1.9 4.1 1250 1149 A 34 LEU H A 34 LEU HBy 1.0 1.9 3.9 1251 1150 A 34 LEU H A 34 LEU HD2% 1.0 2.0 6.0 1252 1151 A 34 LEU H A 34 LEU HG 1.0 1.9 4.5 1253 1152 A 35 PRO HBx A 35 PRO HA 1.0 1.6 2.8 1254 1153 A 35 PRO HA A 35 PRO HBy 1.0 1.8 3.8 1255 1154 A 35 PRO HGx A 35 PRO HA 1.0 2.0 5.0 1256 1154 A 35 PRO HGy A 35 PRO HA 1.0 2.0 5.0 1257 1155 A 35 PRO HA A 36 THR HG2% 1.0 2.0 5.6 1258 1156 A 35 PRO HBx A 35 PRO HBy 1.0 1.3 2.2 1259 1157 A 35 PRO HDx A 35 PRO HBy 1.0 2.0 6.0 1260 1158 A 35 PRO HDy A 35 PRO HBy 1.0 1.9 4.7 1261 1159 A 34 LEU HBx A 35 PRO HDx 1.0 2.0 5.6 1262 1160 A 35 PRO HDx A 34 LEU HD2% 1.0 2.0 5.8 1263 1161 A 35 PRO HDx A 35 PRO HBx 1.0 2.0 5.6 1264 1162 A 35 PRO HDx A 35 PRO HGx 1.0 1.6 3.0 1265 1162 A 35 PRO HDx A 35 PRO HGy 1.0 1.6 3.0 1266 1163 A 34 LEU HG A 35 PRO HDy 1.0 2.0 6.0 1267 1164 A 35 PRO HBx A 35 PRO HDy 1.0 2.0 6.0 1268 1165 A 35 PRO HGx A 35 PRO HDy 1.0 1.7 3.1 1269 1165 A 35 PRO HGy A 35 PRO HDy 1.0 1.7 3.1 1270 1166 A 35 PRO HGx A 34 LEU HA 1.0 1.9 6.0 1271 1166 A 35 PRO HGy A 34 LEU HA 1.0 1.9 6.0 1272 1167 A 35 PRO HGx A 35 PRO HBx 1.0 1.6 2.8 1273 1167 A 35 PRO HGy A 35 PRO HBx 1.0 1.6 2.8 1274 1168 A 36 THR HB A 36 THR HG2% 1.0 1.5 2.5 1275 1169 A 89 LEU HBx A 36 THR HB 1.0 1.9 6.0 1276 1170 A 89 LEU HBy A 36 THR HB 1.0 2.0 5.8 1277 1171 A 89 LEU HD1% A 36 THR HB 1.0 2.0 4.8 1278 1172 A 89 LEU HG A 36 THR HB 1.0 2.0 6.0 1279 1173 A 36 THR HA A 36 THR HG2% 1.0 1.8 3.6 1280 1174 A 36 THR H A 35 PRO HA 1.0 1.9 4.1 1281 1175 A 36 THR H A 35 PRO HBx 1.0 2.0 6.0 1282 1176 A 36 THR H A 35 PRO HBy 1.0 2.0 4.8 1283 1177 A 36 THR H A 36 THR HA 1.0 2.0 5.6 1284 1178 A 36 THR H A 36 THR HG2% 1.0 2.0 5.8 1285 1179 A 37 THR HA A 37 THR HG2% 1.0 1.7 3.1 1286 1180 A 37 THR HA A 38 LEU HBx 1.0 0.9 6.0 1287 1181 A 38 LEU HBy A 37 THR HA 1.0 1.9 6.0 1288 1182 A 88 GLU HA A 37 THR HA 1.0 1.7 3.3 1289 1183 A 37 THR HA A 88 GLU HBx 1.0 2.0 6.0 1290 1183 A 37 THR HA A 88 GLU HBy 1.0 2.0 6.0 1291 1184 A 89 LEU HD1% A 37 THR HA 1.0 2.0 6.0 1292 1185 A 89 LEU HD2% A 37 THR HA 1.0 2.0 6.0 1293 1186 A 37 THR HB A 37 THR HA 1.0 1.7 3.3 1294 1187 A 37 THR HB A 37 THR HG2% 1.0 1.6 2.8 1295 1188 A 37 THR HB A 38 LEU HBx 1.0 1.5 6.0 1296 1189 A 37 THR HG2% A 88 GLU HBx 1.0 2.0 6.0 1297 1189 A 37 THR HG2% A 88 GLU HBy 1.0 2.0 6.0 1298 1190 A 37 THR HG2% A 88 GLU HGx 1.0 2.0 6.0 1299 1191 A 37 THR HG2% A 88 GLU HGy 1.0 1.9 4.7 1300 1192 A 37 THR H A 35 PRO HA 1.0 2.0 6.0 1301 1193 A 37 THR H A 35 PRO HBx 1.0 2.0 6.0 1302 1194 A 37 THR H A 35 PRO HBy 1.0 1.7 3.1 1303 1195 A 37 THR H A 36 THR HA 1.0 1.8 3.6 1304 1196 A 37 THR H A 36 THR HB 1.0 2.0 6.0 1305 1197 A 37 THR H A 36 THR HG2% 1.0 2.0 5.2 1306 1198 A 37 THR H A 37 THR HA 1.0 1.9 4.1 1307 1199 A 37 THR H A 37 THR HG2% 1.0 1.8 3.6 1308 1200 A 37 THR H A 89 LEU HD1% 1.0 2.0 5.4 1309 1201 A 38 LEU HA A 38 LEU HBx 1.0 1.7 3.5 1310 1202 A 38 LEU HA A 38 LEU HBy 1.0 1.8 3.6 1311 1203 A 38 LEU HA A 38 LEU HD2% 1.0 1.5 2.5 1312 1204 A 38 LEU HA A 41 LEU HBx 1.0 1.7 3.3 1313 1205 A 38 LEU HA A 41 LEU HBy 1.0 2.0 5.8 1314 1206 A 38 LEU HA A 89 LEU HD1% 1.0 1.9 4.5 1315 1207 A 89 LEU HD2% A 38 LEU HA 1.0 1.8 3.6 1316 1208 A 38 LEU HBy A 38 LEU HBx 1.0 1.3 2.2 1317 1209 A 38 LEU HD1% A 38 LEU HBx 1.0 1.7 3.1 1318 1210 A 38 LEU HBx A 38 LEU HD2% 1.0 1.8 3.4 1319 1211 A 38 LEU HBx A 38 LEU HG 1.0 1.8 3.8 1320 1212 A 38 LEU HBx A 85 LYS HA 1.0 1.9 6.0 1321 1213 A 38 LEU HBy A 38 LEU HD2% 1.0 1.9 4.1 1322 1214 A 89 LEU HD2% A 38 LEU HBy 1.0 2.0 4.8 1323 1215 A 38 LEU HBy A 38 LEU HD1% 1.0 1.7 3.3 1324 1216 A 38 LEU HD1% A 38 LEU HD2% 1.0 1.6 2.6 1325 1217 A 38 LEU HD1% A 84 ARG HBx 1.0 1.8 3.6 1326 1218 A 38 LEU HD1% A 84 ARG HBy 1.0 2.0 6.0 1327 1219 A 89 LEU HD2% A 38 LEU HD1% 1.0 2.0 4.8 1328 1220 A 41 LEU HBx A 38 LEU HD2% 1.0 2.0 5.4 1329 1221 A 41 LEU HBy A 38 LEU HD2% 1.0 1.8 6.0 1330 1222 A 41 LEU HD1% A 38 LEU HD2% 1.0 1.9 4.9 1331 1223 A 38 LEU HD2% A 64 ILE HD1% 1.0 1.6 2.6 1332 1224 A 38 LEU HA A 38 LEU HG 1.0 1.8 3.6 1333 1225 A 38 LEU HBy A 38 LEU HG 1.0 1.7 3.3 1334 1226 A 38 LEU HD1% A 38 LEU HG 1.0 1.6 2.6 1335 1227 A 38 LEU HG A 38 LEU HD2% 1.0 1.5 2.5 1336 1228 A 38 LEU HG A 42 ASP HBy 1.0 1.9 6.0 1337 1229 A 89 LEU HD2% A 38 LEU HG 1.0 1.7 3.3 1338 1230 A 38 LEU H A 37 THR HA 1.0 1.5 2.5 1339 1231 A 38 LEU H A 37 THR HG2% 1.0 1.9 5.5 1340 1232 A 38 LEU H A 38 LEU HBx 1.0 1.9 4.5 1341 1233 A 38 LEU H A 38 LEU HD2% 1.0 2.0 5.8 1342 1234 A 38 LEU H A 38 LEU HG 1.0 1.9 3.9 1343 1235 A 38 LEU H A 87 VAL HGx% 1.0 1.8 3.6 1344 1236 A 80 LEU HD1% A 39 GLY HAx 1.0 2.0 5.4 1345 1237 A 39 GLY HAx A 80 LEU HD2% 1.0 1.7 6.0 1346 1238 A 39 GLY HAx A 85 LYS HA 1.0 1.6 2.8 1347 1239 A 39 GLY HAx A 85 LYS HBx 1.0 2.0 5.6 1348 1239 A 39 GLY HAx A 85 LYS HBy 1.0 2.0 5.6 1349 1240 A 39 GLY HAx A 85 LYS HGx 1.0 1.9 6.0 1350 1241 A 39 GLY HAx A 85 LYS HGy 1.0 1.9 4.9 1351 1242 A 39 GLY HAy A 42 ASP HBy 1.0 2.0 6.0 1352 1243 A 39 GLY HAy A 80 LEU HD1% 1.0 1.6 3.0 1353 1244 A 39 GLY HAy A 80 LEU HD2% 1.0 2.0 6.0 1354 1245 A 38 LEU HA A 39 GLY H 1.0 1.9 4.7 1355 1246 A 39 GLY H A 38 LEU HD2% 1.0 2.0 6.0 1356 1247 A 39 GLY H A 85 LYS HBx 1.0 2.0 6.0 1357 1247 A 39 GLY H A 85 LYS HBy 1.0 2.0 6.0 1358 1248 A 39 GLY H A 85 LYS HGx 1.0 1.8 6.0 1359 1249 A 39 GLY H A 86 ASN HA 1.0 1.9 6.0 1360 1250 A 40 LYS HBx A 40 LYS HA 1.0 1.7 3.1 1361 1250 A 40 LYS HBy A 40 LYS HA 1.0 1.7 3.1 1362 1251 A 40 LYS HGx A 40 LYS HA 1.0 1.9 5.3 1363 1252 A 40 LYS HGy A 40 LYS HA 1.0 1.8 3.8 1364 1253 A 40 LYS HA A 43 GLU HBx 1.0 1.9 4.1 1365 1254 A 40 LYS HA A 43 GLU HBy 1.0 1.9 4.3 1366 1255 A 40 LYS HBx A 41 LEU HA 1.0 2.0 4.6 1367 1255 A 40 LYS HBy A 41 LEU HA 1.0 2.0 4.6 1368 1256 A 40 LYS HBx A 40 LYS HEy 1.0 2.0 6.0 1369 1256 A 40 LYS HBx A 40 LYS HEx 1.0 2.0 6.0 1370 1256 A 40 LYS HBy A 40 LYS HEx 1.0 2.0 6.0 1371 1256 A 40 LYS HBy A 40 LYS HEy 1.0 2.0 6.0 1372 1257 A 39 GLY HAx A 40 LYS H 1.0 1.9 3.7 1373 1258 A 41 LEU HBx A 41 LEU HA 1.0 1.9 4.7 1374 1259 A 41 LEU HA A 41 LEU HD1% 1.0 2.0 6.0 1375 1260 A 41 LEU HA A 41 LEU HD2% 1.0 1.8 3.8 1376 1261 A 41 LEU HA A 44 ARG HBx 1.0 1.9 4.9 1377 1262 A 41 LEU HA A 44 ARG HBy 1.0 1.9 4.3 1378 1263 A 89 LEU HD2% A 41 LEU HBx 1.0 1.8 4.0 1379 1264 A 41 LEU HA A 41 LEU HBy 1.0 1.8 3.6 1380 1265 A 41 LEU HBy A 41 LEU HD2% 1.0 1.8 3.6 1381 1266 A 41 LEU HD1% A 44 ARG HBy 1.0 1.9 6.0 1382 1267 A 41 LEU HD1% A 93 MET HGy 1.0 1.9 4.1 1383 1267 A 41 LEU HD1% A 93 MET HGx 1.0 1.9 4.1 1384 1268 A 41 LEU HBx A 41 LEU HD2% 1.0 1.6 2.8 1385 1269 A 41 LEU HD2% A 44 ARG HBx 1.0 2.0 5.8 1386 1270 A 41 LEU HD2% A 44 ARG HBy 1.0 2.0 6.0 1387 1271 A 41 LEU HD2% A 93 MET HGy 1.0 1.8 4.0 1388 1271 A 41 LEU HD2% A 93 MET HGx 1.0 1.8 4.0 1389 1272 A 41 LEU HA A 41 LEU HG 1.0 1.8 3.6 1390 1273 A 41 LEU HD1% A 41 LEU HG 1.0 1.7 3.1 1391 1274 A 41 LEU HD2% A 41 LEU HG 1.0 1.5 2.5 1392 1275 A 41 LEU H A 38 LEU HD2% 1.0 1.9 6.0 1393 1276 A 41 LEU H A 40 LYS HA 1.0 1.9 4.9 1394 1277 A 41 LEU H A 41 LEU HA 1.0 1.8 3.8 1395 1278 A 41 LEU H A 41 LEU HBx 1.0 1.7 3.1 1396 1279 A 38 LEU HD2% A 42 ASP HA 1.0 2.0 6.0 1397 1280 A 42 ASP HBx A 42 ASP HA 1.0 1.9 4.7 1398 1281 A 42 ASP HA A 45 LEU HD1% 1.0 1.8 4.2 1399 1282 A 62 MET HE% A 42 ASP HA 1.0 1.7 2.9 1400 1283 A 42 ASP HA A 64 ILE HD1% 1.0 2.0 6.0 1401 1284 A 39 GLY HAx A 42 ASP HBx 1.0 2.0 6.0 1402 1285 A 39 GLY HAy A 42 ASP HBx 1.0 1.9 4.3 1403 1286 A 80 LEU HD1% A 42 ASP HBx 1.0 1.9 3.9 1404 1287 A 42 ASP HBy A 38 LEU HD2% 1.0 1.9 4.9 1405 1288 A 42 ASP HBy A 42 ASP HA 1.0 1.7 3.1 1406 1289 A 80 LEU HD1% A 42 ASP HBy 1.0 1.9 4.5 1407 1290 A 42 ASP HBy A 80 LEU HD2% 1.0 0.0 6.0 1408 1291 A 38 LEU HG A 42 ASP H 1.0 1.9 6.0 1409 1292 A 41 LEU HBx A 42 ASP H 1.0 1.7 3.1 1410 1293 A 42 ASP H A 42 ASP HA 1.0 1.7 3.5 1411 1294 A 42 ASP H A 43 GLU HBx 1.0 1.7 6.0 1412 1295 A 42 ASP H A 43 GLU HBy 1.0 1.8 6.0 1413 1296 A 42 ASP H A 45 LEU HD1% 1.0 0.0 6.0 1414 1297 A 43 GLU HBx A 43 GLU HA 1.0 1.9 3.9 1415 1298 A 43 GLU HA A 43 GLU HBy 1.0 1.7 3.3 1416 1299 A 43 GLU HA A 43 GLU HGx 1.0 1.8 3.4 1417 1300 A 43 GLU HBx A 43 GLU HGx 1.0 1.7 3.3 1418 1301 A 43 GLU HBy A 43 GLU HGx 1.0 1.6 2.8 1419 1302 A 40 LYS HA A 43 GLU HGy 1.0 2.0 6.0 1420 1303 A 43 GLU HGy A 43 GLU HA 1.0 1.8 3.8 1421 1304 A 40 LYS HA A 43 GLU H 1.0 1.9 4.5 1422 1305 A 41 LEU HD2% A 43 GLU H 1.0 2.0 6.0 1423 1306 A 43 GLU H A 42 ASP HA 1.0 2.0 4.6 1424 1307 A 43 GLU H A 43 GLU HBx 1.0 1.6 3.0 1425 1308 A 43 GLU H A 43 GLU HBy 1.0 1.6 2.8 1426 1309 A 43 GLU H A 43 GLU HGx 1.0 2.0 5.8 1427 1310 A 43 GLU H A 43 GLU HGy 1.0 2.0 5.2 1428 1311 A 44 ARG HA A 44 ARG HBx 1.0 1.8 3.8 1429 1312 A 44 ARG HA A 44 ARG HBy 1.0 1.8 3.6 1430 1313 A 44 ARG HA A 44 ARG HDx 1.0 1.9 4.5 1431 1314 A 44 ARG HA A 44 ARG HDy 1.0 2.0 6.0 1432 1315 A 44 ARG HA A 44 ARG HGx 1.0 1.9 4.3 1433 1316 A 44 ARG HA A 44 ARG HGy 1.0 1.9 4.5 1434 1317 A 44 ARG HA A 47 ASN HBx 1.0 2.0 5.4 1435 1318 A 44 ARG HA A 47 ASN HBy 1.0 1.7 3.5 1436 1319 A 44 ARG HBx A 44 ARG HBy 1.0 1.3 2.2 1437 1320 A 44 ARG HBx A 44 ARG HDx 1.0 2.0 5.4 1438 1321 A 44 ARG HBx A 44 ARG HDy 1.0 2.0 5.0 1439 1322 A 44 ARG HBy A 44 ARG HDx 1.0 2.0 5.6 1440 1323 A 44 ARG HBy A 44 ARG HDy 1.0 2.0 5.2 1441 1324 A 44 ARG HGy A 44 ARG HDx 1.0 1.9 3.9 1442 1325 A 44 ARG HGx A 44 ARG HDy 1.0 1.8 3.8 1443 1326 A 44 ARG HBx A 44 ARG HGx 1.0 1.9 3.9 1444 1327 A 44 ARG HBy A 44 ARG HGx 1.0 1.8 3.4 1445 1328 A 44 ARG HGx A 44 ARG HDx 1.0 1.8 3.6 1446 1329 A 44 ARG HBx A 44 ARG HGy 1.0 1.8 4.0 1447 1330 A 44 ARG HBy A 44 ARG HGy 1.0 1.8 4.0 1448 1331 A 44 ARG HGy A 44 ARG HDy 1.0 1.9 3.7 1449 1332 A 41 LEU HD1% A 44 ARG H 1.0 1.8 6.0 1450 1333 A 44 ARG H A 44 ARG HDx 1.0 1.9 6.0 1451 1334 A 44 ARG H A 44 ARG HDy 1.0 1.8 6.0 1452 1335 A 44 ARG H A 44 ARG HGx 1.0 2.0 6.0 1453 1336 A 44 ARG H A 45 LEU HG 1.0 1.9 6.0 1454 1337 A 45 LEU HBx A 45 LEU HA 1.0 1.8 3.6 1455 1338 A 45 LEU HD1% A 45 LEU HA 1.0 2.0 6.0 1456 1339 A 45 LEU HD2% A 45 LEU HA 1.0 1.5 2.7 1457 1340 A 45 LEU HG A 45 LEU HA 1.0 2.0 5.2 1458 1341 A 45 LEU HA A 48 TYR HBy 1.0 1.9 4.3 1459 1342 A 42 ASP HA A 45 LEU HBx 1.0 2.0 5.8 1460 1343 A 45 LEU HBy A 45 LEU HBx 1.0 1.3 2.2 1461 1344 A 45 LEU HD2% A 45 LEU HBx 1.0 1.6 3.0 1462 1345 A 42 ASP HA A 45 LEU HBy 1.0 1.9 4.3 1463 1346 A 45 LEU HBy A 45 LEU HA 1.0 1.9 4.3 1464 1347 A 45 LEU HD2% A 45 LEU HBx 1.0 1.7 3.3 1465 1347 A 45 LEU HD1% A 45 LEU HBx 1.0 1.7 3.3 1466 1348 A 45 LEU HD2% A 93 MET HE% 1.0 1.6 2.8 1467 1348 A 45 LEU HD1% A 93 MET HE% 1.0 1.6 2.8 1468 1349 A 45 LEU HD1% A 48 TYR HBx 1.0 1.8 6.0 1469 1350 A 45 LEU HD1% A 48 TYR HBy 1.0 1.8 6.0 1470 1351 A 62 MET HE% A 45 LEU HD1% 1.0 1.6 2.6 1471 1352 A 45 LEU HD1% A 64 ILE HD1% 1.0 1.7 3.1 1472 1353 A 42 ASP HA A 45 LEU HG 1.0 1.9 4.3 1473 1354 A 45 LEU HD1% A 45 LEU HG 1.0 1.5 2.7 1474 1355 A 45 LEU HD2% A 45 LEU HG 1.0 1.4 2.4 1475 1356 A 41 LEU HA A 45 LEU H 1.0 2.0 6.0 1476 1357 A 45 LEU H A 44 ARG HGy 1.0 2.0 6.0 1477 1358 A 45 LEU H A 45 LEU HA 1.0 1.8 3.6 1478 1359 A 45 LEU H A 45 LEU HBy 1.0 1.7 3.3 1479 1360 A 45 LEU H A 45 LEU HD2% 1.0 1.8 3.4 1480 1361 A 62 MET HE% A 45 LEU H 1.0 0.0 6.0 1481 1362 A 46 ARG HBx A 46 ARG HA 1.0 1.8 4.0 1482 1363 A 46 ARG HBy A 46 ARG HA 1.0 1.8 3.6 1483 1364 A 46 ARG HDx A 46 ARG HA 1.0 2.0 6.0 1484 1365 A 46 ARG HDy A 46 ARG HA 1.0 2.0 6.0 1485 1366 A 46 ARG HGx A 46 ARG HA 1.0 1.9 3.9 1486 1366 A 46 ARG HGy A 46 ARG HA 1.0 1.9 3.9 1487 1367 A 46 ARG HA A 49 LEU HBy 1.0 1.9 4.9 1488 1368 A 46 ARG HBx A 46 ARG HDx 1.0 1.9 4.1 1489 1369 A 46 ARG HBx A 46 ARG HDy 1.0 1.9 4.3 1490 1370 A 46 ARG HBy A 46 ARG HDx 1.0 1.9 4.5 1491 1371 A 46 ARG HBy A 46 ARG HDy 1.0 1.8 3.4 1492 1372 A 43 GLU HA A 46 ARG HDx 1.0 1.7 6.0 1493 1373 A 46 ARG HDx A 46 ARG HDy 1.0 1.3 2.2 1494 1374 A 46 ARG HDx A 76 LEU HD2% 1.0 1.9 4.9 1495 1375 A 43 GLU HA A 46 ARG HDy 1.0 2.0 5.2 1496 1376 A 46 ARG HDy A 76 LEU HD2% 1.0 0.0 6.0 1497 1377 A 46 ARG HE A 46 ARG HDx 1.0 1.9 4.5 1498 1378 A 46 ARG HE A 46 ARG HDy 1.0 1.8 4.0 1499 1379 A 62 MET HE% A 46 ARG HE 1.0 1.9 4.5 1500 1380 A 46 ARG HE A 74 VAL HGx% 1.0 1.9 5.3 1501 1381 A 46 ARG HE A 76 LEU HD2% 1.0 1.9 4.1 1502 1382 A 46 ARG HGx A 46 ARG HDx 1.0 1.8 4.0 1503 1382 A 46 ARG HGy A 46 ARG HDx 1.0 1.8 4.0 1504 1383 A 46 ARG HGx A 46 ARG HDy 1.0 1.8 4.0 1505 1383 A 46 ARG HGy A 46 ARG HDy 1.0 1.8 4.0 1506 1384 A 46 ARG HH1y A 46 ARG HDx 1.0 1.9 4.5 1507 1384 A 46 ARG HH1x A 46 ARG HDx 1.0 1.9 4.5 1508 1385 A 46 ARG HH1y A 46 ARG HDy 1.0 2.0 6.0 1509 1385 A 46 ARG HH1x A 46 ARG HDy 1.0 2.0 6.0 1510 1386 A 46 ARG HH1y A 74 VAL HGx% 1.0 1.1 6.0 1511 1386 A 46 ARG HH1x A 74 VAL HGx% 1.0 1.1 6.0 1512 1387 A 46 ARG HH1y A 76 LEU HA 1.0 1.9 6.0 1513 1387 A 46 ARG HH1x A 76 LEU HA 1.0 1.9 6.0 1514 1388 A 46 ARG HH1y A 76 LEU HD2% 1.0 2.0 5.6 1515 1388 A 46 ARG HH1x A 76 LEU HD2% 1.0 2.0 5.6 1516 1389 A 46 ARG HH1y A 79 PRO HA 1.0 2.0 5.6 1517 1389 A 46 ARG HH1x A 79 PRO HA 1.0 2.0 5.6 1518 1390 A 46 ARG HH2y A 46 ARG HDx 1.0 1.8 6.0 1519 1390 A 46 ARG HH2x A 46 ARG HDx 1.0 1.8 6.0 1520 1391 A 46 ARG HH2y A 46 ARG HDy 1.0 1.7 6.0 1521 1391 A 46 ARG HH2x A 46 ARG HDy 1.0 1.7 6.0 1522 1392 A 46 ARG HH2y A 74 VAL HGx% 1.0 1.8 3.8 1523 1392 A 46 ARG HH2x A 74 VAL HGx% 1.0 1.8 3.8 1524 1393 A 46 ARG HH2y A 76 LEU HA 1.0 2.0 5.8 1525 1393 A 46 ARG HH2x A 76 LEU HA 1.0 2.0 5.8 1526 1394 A 46 ARG HH2y A 76 LEU HD2% 1.0 1.9 4.3 1527 1394 A 46 ARG HH2x A 76 LEU HD2% 1.0 1.9 4.3 1528 1395 A 46 ARG HH2y A 79 PRO HA 1.0 2.0 5.8 1529 1395 A 46 ARG HH2x A 79 PRO HA 1.0 2.0 5.8 1530 1396 A 42 ASP HA A 46 ARG H 1.0 2.0 5.4 1531 1397 A 43 GLU HA A 46 ARG H 1.0 2.0 4.8 1532 1398 A 44 ARG HA A 46 ARG H 1.0 2.0 6.0 1533 1399 A 46 ARG H A 45 LEU HA 1.0 2.0 4.8 1534 1400 A 46 ARG H A 45 LEU HBx 1.0 2.0 5.6 1535 1401 A 45 LEU HBy A 46 ARG H 1.0 1.8 4.0 1536 1402 A 45 LEU HD1% A 46 ARG H 1.0 1.9 6.0 1537 1403 A 45 LEU HD2% A 46 ARG H 1.0 2.0 6.0 1538 1404 A 46 ARG H A 45 LEU HG 1.0 1.9 6.0 1539 1405 A 46 ARG H A 46 ARG HA 1.0 1.8 3.6 1540 1406 A 62 MET HE% A 46 ARG H 1.0 2.0 5.6 1541 1407 A 47 ASN HBx A 47 ASN HA 1.0 1.7 3.1 1542 1408 A 47 ASN HA A 47 ASN HBy 1.0 1.8 3.6 1543 1409 A 47 ASN HA A 50 LYS HBy 1.0 1.8 4.2 1544 1409 A 47 ASN HA A 50 LYS HBx 1.0 1.8 4.2 1545 1410 A 43 GLU HGx A 47 ASN HD2y 1.0 2.0 6.0 1546 1411 A 43 GLU HGx A 47 ASN HD2x 1.0 2.0 6.0 1547 1412 A 47 ASN H A 44 ARG HA 1.0 1.9 4.5 1548 1413 A 47 ASN H A 47 ASN HA 1.0 1.7 3.3 1549 1414 A 47 ASN H A 47 ASN HBx 1.0 1.9 4.1 1550 1415 A 47 ASN H A 47 ASN HBy 1.0 1.5 2.7 1551 1416 A 48 TYR HA A 48 TYR HBy 1.0 1.8 4.0 1552 1417 A 48 TYR HA A 51 LYS HGy 1.0 2.0 4.6 1553 1417 A 48 TYR HA A 51 LYS HGx 1.0 2.0 4.6 1554 1418 A 45 LEU HA A 48 TYR HBx 1.0 1.9 4.5 1555 1419 A 48 TYR HA A 48 TYR HBx 1.0 2.0 4.8 1556 1420 A 48 TYR HBx A 110 ILE HD1% 1.0 1.7 3.3 1557 1421 A 45 LEU HA A 48 TYR HD% 1.0 2.0 6.0 1558 1422 A 45 LEU HD2% A 48 TYR HD% 1.0 0.0 6.0 1559 1423 A 48 TYR HA A 48 TYR HD% 1.0 1.8 3.8 1560 1424 A 48 TYR HBx A 48 TYR HD% 1.0 1.9 4.1 1561 1425 A 48 TYR HBy A 48 TYR HD% 1.0 1.8 3.8 1562 1426 A 48 TYR HD% A 51 LYS HDy 1.0 0.0 6.0 1563 1426 A 48 TYR HD% A 51 LYS HDx 1.0 0.0 6.0 1564 1427 A 48 TYR HD% A 93 MET HE% 1.0 1.9 6.0 1565 1428 A 48 TYR HD% A 110 ILE HG2% 1.0 1.9 4.3 1566 1429 A 44 ARG HDx A 48 TYR HE% 1.0 2.0 6.0 1567 1430 A 44 ARG HDy A 48 TYR HE% 1.0 2.0 6.0 1568 1431 A 45 LEU HD2% A 48 TYR HE% 1.0 2.0 6.0 1569 1432 A 93 MET HE% A 48 TYR HE% 1.0 2.0 6.0 1570 1433 A 110 ILE HG2% A 48 TYR HE% 1.0 2.0 5.6 1571 1434 A 45 LEU HD2% A 48 TYR H 1.0 1.9 6.0 1572 1435 A 48 TYR H A 46 ARG HA 1.0 2.0 6.0 1573 1436 A 49 LEU HA A 49 LEU HBx 1.0 1.8 3.6 1574 1437 A 49 LEU HA A 49 LEU HBy 1.0 1.9 4.1 1575 1438 A 49 LEU HA A 49 LEU HD1% 1.0 1.9 6.0 1576 1439 A 49 LEU HA A 49 LEU HD2% 1.0 1.5 2.7 1577 1440 A 49 LEU HA A 49 LEU HG 1.0 2.0 5.0 1578 1441 A 49 LEU HA A 53 THR HG2% 1.0 1.9 4.9 1579 1442 A 46 ARG HA A 49 LEU HBx 1.0 1.9 6.0 1580 1443 A 49 LEU HBx A 49 LEU HBy 1.0 1.3 2.2 1581 1444 A 49 LEU HBx A 49 LEU HD1% 1.0 1.8 3.6 1582 1445 A 49 LEU HBx A 49 LEU HD2% 1.0 1.8 3.6 1583 1446 A 49 LEU HBy A 49 LEU HD2% 1.0 2.0 4.6 1584 1447 A 49 LEU HBy A 49 LEU HD1% 1.0 1.8 3.6 1585 1448 A 49 LEU HD1% A 49 LEU HD2% 1.0 1.6 2.8 1586 1449 A 49 LEU HD1% A 53 THR HG2% 1.0 2.0 5.6 1587 1450 A 49 LEU HD1% A 76 LEU HD1% 1.0 1.7 3.1 1588 1451 A 49 LEU HD2% A 53 THR HG2% 1.0 1.7 3.5 1589 1452 A 49 LEU HD2% A 56 SER HA 1.0 2.0 6.0 1590 1453 A 49 LEU HD2% A 56 SER HBy 1.0 1.7 6.0 1591 1454 A 76 LEU HD1% A 49 LEU HD2% 1.0 2.0 6.0 1592 1455 A 110 ILE HD1% A 49 LEU HD2% 1.0 1.9 5.3 1593 1456 A 49 LEU HBx A 49 LEU HG 1.0 1.9 4.3 1594 1457 A 49 LEU HBy A 49 LEU HG 1.0 1.8 3.6 1595 1458 A 49 LEU HD1% A 49 LEU HG 1.0 1.6 2.8 1596 1459 A 49 LEU HG A 49 LEU HD2% 1.0 1.6 3.0 1597 1460 A 47 ASN HA A 49 LEU H 1.0 2.0 5.2 1598 1461 A 48 TYR HA A 49 LEU H 1.0 2.0 5.0 1599 1462 A 48 TYR HBx A 49 LEU H 1.0 1.8 3.6 1600 1463 A 49 LEU H A 49 LEU HD2% 1.0 2.0 5.2 1601 1464 A 49 LEU H A 50 LYS HBy 1.0 2.0 6.0 1602 1464 A 49 LEU H A 50 LYS HBx 1.0 2.0 6.0 1603 1465 A 49 LEU H A 53 THR HG2% 1.0 2.0 6.0 1604 1466 A 49 LEU H A 110 ILE HD1% 1.0 1.9 4.7 1605 1467 A 49 LEU H A 110 ILE HG2% 1.0 2.0 6.0 1606 1468 A 50 LYS HBy A 50 LYS HA 1.0 1.7 3.1 1607 1468 A 50 LYS HA A 50 LYS HBx 1.0 1.7 3.1 1608 1469 A 50 LYS HBy A 50 LYS HEx 1.0 2.0 5.8 1609 1469 A 50 LYS HBy A 50 LYS HEy 1.0 2.0 5.8 1610 1469 A 50 LYS HBx A 50 LYS HEy 1.0 2.0 5.8 1611 1469 A 50 LYS HBx A 50 LYS HEx 1.0 2.0 5.8 1612 1470 A 50 LYS HGx A 50 LYS HEy 1.0 1.8 3.8 1613 1470 A 50 LYS HGx A 50 LYS HEx 1.0 1.8 3.8 1614 1471 A 50 LYS HGy A 50 LYS HEy 1.0 1.8 3.6 1615 1471 A 50 LYS HGy A 50 LYS HEx 1.0 1.8 3.6 1616 1472 A 50 LYS H A 49 LEU HBx 1.0 1.9 4.7 1617 1473 A 50 LYS H A 49 LEU HBy 1.0 1.8 4.0 1618 1474 A 50 LYS H A 49 LEU HG 1.0 1.9 6.0 1619 1475 A 50 LYS H A 50 LYS HBy 1.0 1.6 3.0 1620 1475 A 50 LYS H A 50 LYS HBx 1.0 1.6 3.0 1621 1476 A 50 LYS H A 50 LYS HGx 1.0 1.7 3.3 1622 1477 A 50 LYS H A 50 LYS HGy 1.0 1.9 3.9 1623 1478 A 51 LYS HA A 51 LYS HBy 1.0 1.7 3.3 1624 1478 A 51 LYS HA A 51 LYS HBx 1.0 1.7 3.3 1625 1479 A 51 LYS HA A 51 LYS HDy 1.0 2.0 5.6 1626 1479 A 51 LYS HA A 51 LYS HDx 1.0 2.0 5.6 1627 1480 A 51 LYS HA A 51 LYS HGy 1.0 1.9 4.1 1628 1480 A 51 LYS HA A 51 LYS HGx 1.0 1.9 4.1 1629 1481 A 48 TYR HA A 51 LYS HBy 1.0 2.0 5.4 1630 1481 A 48 TYR HA A 51 LYS HBx 1.0 2.0 5.4 1631 1482 A 51 LYS HDx A 51 LYS HEy 1.0 1.6 2.8 1632 1482 A 51 LYS HEx A 51 LYS HDy 1.0 1.6 2.8 1633 1482 A 51 LYS HDy A 51 LYS HEy 1.0 1.6 2.8 1634 1482 A 51 LYS HDx A 51 LYS HEx 1.0 1.6 2.8 1635 1483 A 51 LYS HDy A 51 LYS HGy 1.0 1.5 2.3 1636 1483 A 51 LYS HDx A 51 LYS HGy 1.0 1.5 2.3 1637 1483 A 51 LYS HDx A 51 LYS HGx 1.0 1.5 2.3 1638 1483 A 51 LYS HGx A 51 LYS HDy 1.0 1.5 2.3 1639 1484 A 51 LYS HBx A 51 LYS HEy 1.0 2.0 6.0 1640 1484 A 51 LYS HBy A 51 LYS HEy 1.0 2.0 6.0 1641 1484 A 51 LYS HBx A 51 LYS HEx 1.0 2.0 6.0 1642 1484 A 51 LYS HEx A 51 LYS HBy 1.0 2.0 6.0 1643 1485 A 51 LYS HEy A 51 LYS HGy 1.0 1.8 4.0 1644 1485 A 51 LYS HEx A 51 LYS HGy 1.0 1.8 4.0 1645 1485 A 51 LYS HGx A 51 LYS HEy 1.0 1.8 4.0 1646 1485 A 51 LYS HGx A 51 LYS HEx 1.0 1.8 4.0 1647 1486 A 51 LYS HGx A 51 LYS HBy 1.0 1.6 2.8 1648 1486 A 51 LYS HBx A 51 LYS HGx 1.0 1.6 2.8 1649 1486 A 51 LYS HBx A 51 LYS HGy 1.0 1.6 2.8 1650 1486 A 51 LYS HBy A 51 LYS HGy 1.0 1.6 2.8 1651 1487 A 50 LYS HBy A 51 LYS H 1.0 1.7 3.1 1652 1487 A 50 LYS HBx A 51 LYS H 1.0 1.7 3.1 1653 1488 A 51 LYS H A 51 LYS HA 1.0 1.8 3.6 1654 1489 A 51 LYS H A 51 LYS HDy 1.0 2.0 5.6 1655 1489 A 51 LYS H A 51 LYS HDx 1.0 2.0 5.6 1656 1490 A 51 LYS H A 51 LYS HGy 1.0 1.7 3.1 1657 1490 A 51 LYS H A 51 LYS HGx 1.0 1.7 3.1 1658 1491 A 52 GLY HAy A 51 LYS HBy 1.0 1.9 6.0 1659 1491 A 52 GLY HAy A 51 LYS HBx 1.0 1.9 6.0 1660 1492 A 53 THR HG2% A 52 GLY HAy 1.0 2.0 5.0 1661 1493 A 52 GLY HAx A 51 LYS HBy 1.0 0.0 6.0 1662 1493 A 52 GLY HAx A 51 LYS HBx 1.0 0.0 6.0 1663 1494 A 52 GLY HAx A 51 LYS HDy 1.0 0.0 6.0 1664 1494 A 52 GLY HAx A 51 LYS HDx 1.0 0.0 6.0 1665 1495 A 49 LEU HA A 52 GLY H 1.0 1.7 3.3 1666 1496 A 50 LYS HA A 52 GLY H 1.0 2.0 5.6 1667 1497 A 52 GLY H A 51 LYS HA 1.0 1.9 4.7 1668 1498 A 52 GLY H A 51 LYS HBy 1.0 1.9 4.3 1669 1498 A 52 GLY H A 51 LYS HBx 1.0 1.9 4.3 1670 1499 A 52 GLY H A 51 LYS HDy 1.0 0.0 6.0 1671 1499 A 52 GLY H A 51 LYS HDx 1.0 0.0 6.0 1672 1500 A 52 GLY H A 51 LYS HGy 1.0 2.0 5.4 1673 1500 A 52 GLY H A 51 LYS HGx 1.0 2.0 5.4 1674 1501 A 52 GLY H A 52 GLY HAy 1.0 1.6 3.0 1675 1502 A 52 GLY H A 52 GLY HAx 1.0 1.8 4.0 1676 1503 A 53 THR HG2% A 53 THR HA 1.0 1.7 3.3 1677 1504 A 53 THR HB A 53 THR HA 1.0 1.7 3.3 1678 1505 A 53 THR HG2% A 53 THR HB 1.0 1.6 2.8 1679 1506 A 49 LEU HD1% A 53 THR HG1 1.0 2.0 6.0 1680 1507 A 49 LEU HD2% A 53 THR HG1 1.0 1.9 4.7 1681 1508 A 49 LEU HG A 53 THR HG1 1.0 1.9 6.0 1682 1509 A 53 THR HG1 A 53 THR HA 1.0 2.0 6.0 1683 1510 A 53 THR HG1 A 53 THR HB 1.0 1.9 4.1 1684 1511 A 53 THR HG1 A 53 THR HG2% 1.0 1.7 2.9 1685 1512 A 53 THR HG1 A 56 SER HA 1.0 1.9 4.9 1686 1513 A 49 LEU HA A 53 THR H 1.0 1.9 5.3 1687 1514 A 49 LEU HD2% A 53 THR H 1.0 2.0 5.0 1688 1515 A 49 LEU HG A 53 THR H 1.0 1.9 6.0 1689 1516 A 50 LYS HA A 53 THR H 1.0 2.0 5.2 1690 1517 A 53 THR H A 52 GLY HAy 1.0 1.9 3.9 1691 1518 A 53 THR H A 52 GLY HAx 1.0 1.9 5.5 1692 1519 A 53 THR H A 53 THR HA 1.0 1.8 4.0 1693 1520 A 53 THR H A 53 THR HG2% 1.0 1.7 3.3 1694 1521 A 54 LYS HA A 54 LYS HBy 1.0 1.7 3.1 1695 1521 A 54 LYS HA A 54 LYS HBx 1.0 1.7 3.1 1696 1522 A 54 LYS HA A 54 LYS HDy 1.0 2.0 5.6 1697 1522 A 54 LYS HA A 54 LYS HDx 1.0 2.0 5.6 1698 1523 A 54 LYS HA A 54 LYS HGx 1.0 1.8 4.0 1699 1523 A 54 LYS HA A 54 LYS HGy 1.0 1.8 4.0 1700 1524 A 53 THR HA A 54 LYS HBx 1.0 1.8 6.0 1701 1524 A 53 THR HA A 54 LYS HBy 1.0 1.8 6.0 1702 1525 A 54 LYS HA A 54 LYS HGx 1.0 1.9 5.3 1703 1526 A 54 LYS HA A 54 LYS HGy 1.0 2.0 4.6 1704 1527 A 54 LYS H A 53 THR HA 1.0 1.7 3.1 1705 1528 A 53 THR HB A 54 LYS H 1.0 1.6 3.0 1706 1529 A 54 LYS H A 54 LYS HBx 1.0 1.7 3.1 1707 1529 A 54 LYS H A 54 LYS HBy 1.0 1.7 3.1 1708 1530 A 54 LYS H A 54 LYS HDy 1.0 1.9 5.7 1709 1530 A 54 LYS H A 54 LYS HDx 1.0 1.9 5.7 1710 1531 A 54 LYS H A 54 LYS HGx 1.0 1.8 3.6 1711 1531 A 54 LYS H A 54 LYS HGy 1.0 1.8 3.6 1712 1532 A 55 ASN HA A 55 ASN HBx 1.0 1.9 4.7 1713 1533 A 55 ASN HA A 55 ASN HBy 1.0 1.7 3.3 1714 1534 A 55 ASN HBx A 54 LYS HBx 1.0 2.0 5.6 1715 1534 A 55 ASN HBx A 54 LYS HBy 1.0 2.0 5.6 1716 1535 A 55 ASN HD2y A 55 ASN HBx 1.0 1.6 3.0 1717 1536 A 55 ASN HD2y A 55 ASN HBy 1.0 1.9 4.7 1718 1537 A 55 ASN HD2x A 55 ASN HBx 1.0 2.0 5.6 1719 1538 A 55 ASN HD2x A 57 ALA HB% 1.0 1.8 4.0 1720 1539 A 55 ASN HD2x A 58 GLN HBy 1.0 2.0 6.0 1721 1540 A 55 ASN H A 54 LYS HBx 1.0 1.8 3.8 1722 1540 A 55 ASN H A 54 LYS HBy 1.0 1.8 3.8 1723 1541 A 55 ASN H A 54 LYS HGx 1.0 2.0 5.8 1724 1541 A 55 ASN H A 54 LYS HGy 1.0 2.0 5.8 1725 1542 A 49 LEU HD1% A 56 SER HA 1.0 1.9 5.1 1726 1543 A 49 LEU HG A 56 SER HA 1.0 1.9 6.0 1727 1544 A 56 SER HBy A 56 SER HA 1.0 1.7 3.1 1728 1544 A 56 SER HBx A 56 SER HA 1.0 1.7 3.1 1729 1545 A 56 SER HBx A 56 SER HA 1.0 1.7 3.5 1730 1546 A 49 LEU HD1% A 56 SER HBy 1.0 1.9 4.3 1731 1547 A 56 SER HBy A 56 SER HA 1.0 1.8 3.4 1732 1548 A 55 ASN HA A 56 SER H 1.0 1.7 3.1 1733 1549 A 56 SER HBy A 56 SER H 1.0 2.0 4.6 1734 1549 A 56 SER HBx A 56 SER H 1.0 2.0 4.6 1735 1550 A 57 ALA HB% A 57 ALA HA 1.0 1.5 2.5 1736 1551 A 55 ASN HA A 57 ALA HB% 1.0 1.8 6.0 1737 1552 A 57 ALA HB% A 57 ALA H 1.0 1.5 2.5 1738 1553 A 58 GLN HBx A 58 GLN HA 1.0 1.7 3.5 1739 1554 A 58 GLN HBy A 58 GLN HA 1.0 1.7 3.3 1740 1555 A 58 GLN HGx A 58 GLN HA 1.0 2.0 6.0 1741 1556 A 58 GLN HGy A 58 GLN HA 1.0 2.0 6.0 1742 1557 A 58 GLN HBx A 58 GLN HBy 1.0 1.4 2.2 1743 1558 A 58 GLN HBx A 58 GLN HGy 1.0 1.7 3.3 1744 1559 A 58 GLN HBy A 58 GLN HGy 1.0 1.9 4.7 1745 1560 A 58 GLN HE2y A 55 ASN HBx 1.0 1.8 3.6 1746 1561 A 58 GLN HE2y A 55 ASN HBy 1.0 2.0 6.0 1747 1562 A 58 GLN HBx A 58 GLN HE2y 1.0 2.0 5.2 1748 1563 A 58 GLN HBy A 58 GLN HE2y 1.0 2.0 6.0 1749 1564 A 58 GLN HE2y A 58 GLN HGx 1.0 1.9 4.5 1750 1565 A 58 GLN HE2y A 58 GLN HGy 1.0 1.7 3.1 1751 1566 A 58 GLN HE2y A 100 LYS HGx 1.0 2.0 6.0 1752 1567 A 58 GLN HE2y A 100 LYS HGy 1.0 2.0 6.0 1753 1568 A 55 ASN HBx A 58 GLN HE2x 1.0 1.9 4.9 1754 1569 A 55 ASN HBy A 58 GLN HE2x 1.0 1.7 6.0 1755 1570 A 58 GLN HBx A 58 GLN HE2x 1.0 1.9 6.0 1756 1571 A 58 GLN HE2x A 58 GLN HGy 1.0 2.0 6.0 1757 1572 A 58 GLN HBx A 58 GLN HGx 1.0 1.9 4.1 1758 1573 A 58 GLN HBy A 58 GLN HGx 1.0 1.7 3.3 1759 1574 A 58 GLN HGx A 58 GLN HGy 1.0 1.3 2.2 1760 1575 A 57 ALA HB% A 58 GLN H 1.0 1.9 4.3 1761 1576 A 58 GLN H A 58 GLN HA 1.0 1.8 3.4 1762 1577 A 58 GLN HBx A 58 GLN H 1.0 1.8 3.6 1763 1578 A 58 GLN HBy A 58 GLN H 1.0 2.0 4.6 1764 1579 A 58 GLN H A 58 GLN HGx 1.0 1.9 4.3 1765 1580 A 58 GLN H A 58 GLN HGy 1.0 1.7 2.9 1766 1581 A 59 PHE HBx A 59 PHE HA 1.0 1.8 3.8 1767 1582 A 59 PHE HA A 59 PHE HBy 1.0 1.9 4.3 1768 1583 A 100 LYS HBx A 59 PHE HA 1.0 2.0 5.4 1769 1584 A 59 PHE HA A 100 LYS HBy 1.0 1.9 6.0 1770 1585 A 49 LEU HD1% A 59 PHE HBx 1.0 1.9 4.9 1771 1586 A 76 LEU HD1% A 59 PHE HBx 1.0 1.8 3.4 1772 1587 A 49 LEU HD1% A 59 PHE HBy 1.0 2.0 4.8 1773 1588 A 76 LEU HD1% A 59 PHE HBy 1.0 1.9 4.1 1774 1589 A 49 LEU HD1% A 59 PHE HD% 1.0 1.8 3.8 1775 1590 A 56 SER HA A 59 PHE HD% 1.0 1.7 3.1 1776 1591 A 56 SER HBy A 59 PHE HD% 1.0 2.0 6.0 1777 1591 A 56 SER HBx A 59 PHE HD% 1.0 2.0 6.0 1778 1592 A 59 PHE HA A 59 PHE HD% 1.0 1.9 4.3 1779 1593 A 59 PHE HBx A 59 PHE HD% 1.0 1.7 3.3 1780 1594 A 59 PHE HBy A 59 PHE HD% 1.0 1.8 3.6 1781 1595 A 76 LEU HD1% A 59 PHE HD% 1.0 2.0 5.2 1782 1596 A 98 PHE HBx A 59 PHE HD% 1.0 1.8 4.0 1783 1597 A 98 PHE HBy A 59 PHE HD% 1.0 2.0 6.0 1784 1598 A 100 LYS HA A 59 PHE HD% 1.0 2.0 6.0 1785 1599 A 49 LEU HD1% A 59 PHE HE% 1.0 2.0 5.2 1786 1600 A 49 LEU HD2% A 59 PHE HE% 1.0 1.9 4.3 1787 1601 A 53 THR HB A 59 PHE HE% 1.0 2.0 6.0 1788 1602 A 53 THR HG2% A 59 PHE HE% 1.0 1.9 4.3 1789 1603 A 56 SER HA A 59 PHE HE% 1.0 1.7 3.5 1790 1604 A 59 PHE HBx A 59 PHE HE% 1.0 1.9 6.0 1791 1605 A 59 PHE HBy A 59 PHE HE% 1.0 2.0 6.0 1792 1606 A 100 LYS HDy A 59 PHE HE% 1.0 2.0 5.6 1793 1607 A 100 LYS HEx A 59 PHE HE% 1.0 1.9 4.9 1794 1608 A 100 LYS HEy A 59 PHE HE% 1.0 1.9 4.5 1795 1609 A 100 LYS HGx A 59 PHE HE% 1.0 1.9 4.3 1796 1610 A 100 LYS HGy A 59 PHE HE% 1.0 2.0 6.0 1797 1611 A 59 PHE HE% A 108 TYR HBy 1.0 1.9 4.7 1798 1611 A 59 PHE HE% A 108 TYR HBx 1.0 1.9 4.7 1799 1612 A 57 ALA HB% A 59 PHE H 1.0 1.9 6.0 1800 1613 A 59 PHE H A 58 GLN HA 1.0 1.9 4.7 1801 1614 A 100 LYS HBx A 59 PHE H 1.0 1.9 6.0 1802 1615 A 53 THR HG2% A 59 PHE HZ 1.0 1.9 3.9 1803 1616 A 100 LYS HEx A 59 PHE HZ 1.0 2.0 6.0 1804 1617 A 59 PHE HZ A 108 TYR HBy 1.0 2.0 5.4 1805 1617 A 59 PHE HZ A 108 TYR HBx 1.0 2.0 5.4 1806 1618 A 60 GLU HA A 60 GLU HBx 1.0 1.7 3.1 1807 1618 A 60 GLU HA A 60 GLU HBy 1.0 1.7 3.1 1808 1619 A 60 GLU HA A 60 GLU HGx 1.0 1.8 3.6 1809 1620 A 60 GLU HA A 60 GLU HGy 1.0 2.0 5.0 1810 1621 A 59 PHE HA A 60 GLU HBx 1.0 2.0 6.0 1811 1621 A 59 PHE HA A 60 GLU HBy 1.0 2.0 6.0 1812 1622 A 60 GLU HGx A 60 GLU HBx 1.0 1.7 3.1 1813 1622 A 60 GLU HGx A 60 GLU HBy 1.0 1.7 3.1 1814 1623 A 60 GLU HGy A 60 GLU HBx 1.0 1.6 2.8 1815 1623 A 60 GLU HGy A 60 GLU HBy 1.0 1.6 2.8 1816 1624 A 101 LYS HA A 60 GLU HBx 1.0 1.6 2.8 1817 1624 A 101 LYS HA A 60 GLU HBy 1.0 1.6 2.8 1818 1625 A 60 GLU HGx A 60 GLU HGy 1.0 1.3 2.2 1819 1626 A 60 GLU HGy A 99 PHE HBx 1.0 1.9 6.0 1820 1627 A 60 GLU HGy A 99 PHE HBy 1.0 2.0 5.6 1821 1628 A 59 PHE HA A 60 GLU H 1.0 1.7 2.9 1822 1629 A 60 GLU H A 60 GLU HBx 1.0 1.7 3.1 1823 1629 A 60 GLU H A 60 GLU HBy 1.0 1.7 3.1 1824 1630 A 60 GLU H A 61 LYS HBx 1.0 1.8 6.0 1825 1631 A 60 GLU H A 61 LYS HBy 1.0 1.8 6.0 1826 1632 A 60 GLU H A 100 LYS HA 1.0 1.7 3.3 1827 1633 A 60 GLU H A 101 LYS HA 1.0 2.0 6.0 1828 1634 A 60 GLU H A 101 LYS HBx 1.0 2.0 6.0 1829 1634 A 60 GLU H A 101 LYS HBy 1.0 2.0 6.0 1830 1635 A 61 LYS HA A 61 LYS HBx 1.0 1.8 3.4 1831 1636 A 61 LYS HA A 61 LYS HBy 1.0 1.7 3.1 1832 1637 A 61 LYS HA A 61 LYS HGx 1.0 2.0 5.6 1833 1638 A 61 LYS HA A 75 TYR HA 1.0 1.7 3.1 1834 1639 A 76 LEU HD1% A 61 LYS HA 1.0 2.0 5.4 1835 1640 A 76 LEU HD2% A 61 LYS HA 1.0 1.9 6.0 1836 1641 A 61 LYS HA A 76 LEU HG 1.0 1.7 3.3 1837 1642 A 60 GLU HGx A 61 LYS HBx 1.0 2.0 6.0 1838 1643 A 60 GLU HGy A 61 LYS HBx 1.0 1.9 4.1 1839 1644 A 61 LYS HBx A 61 LYS HDx 1.0 2.0 4.8 1840 1645 A 61 LYS HBx A 61 LYS HGx 1.0 1.7 3.1 1841 1646 A 61 LYS HBx A 61 LYS HGy 1.0 1.7 3.1 1842 1647 A 61 LYS HDx A 61 LYS HDy 1.0 1.3 2.2 1843 1648 A 61 LYS HDx A 61 LYS HEx 1.0 1.9 3.9 1844 1649 A 61 LYS HDx A 61 LYS HEy 1.0 1.7 3.3 1845 1650 A 61 LYS HBx A 61 LYS HDy 1.0 2.0 5.4 1846 1651 A 61 LYS HBy A 61 LYS HDy 1.0 1.9 4.3 1847 1652 A 61 LYS HDy A 61 LYS HEx 1.0 1.8 3.4 1848 1653 A 61 LYS HDy A 61 LYS HEy 1.0 1.9 3.9 1849 1654 A 61 LYS HBx A 61 LYS HEx 1.0 1.9 6.0 1850 1655 A 61 LYS HBy A 61 LYS HEx 1.0 2.0 6.0 1851 1656 A 61 LYS HBx A 61 LYS HEy 1.0 2.0 6.0 1852 1657 A 61 LYS HEy A 61 LYS HGx 1.0 2.0 5.2 1853 1658 A 61 LYS HDx A 61 LYS HGx 1.0 1.8 3.6 1854 1659 A 61 LYS HDy A 61 LYS HGx 1.0 1.6 2.8 1855 1660 A 61 LYS HGx A 61 LYS HEx 1.0 2.0 4.6 1856 1661 A 61 LYS HGx A 61 LYS HGy 1.0 1.3 2.2 1857 1662 A 61 LYS HGx A 63 VAL HGy% 1.0 2.0 6.0 1858 1663 A 61 LYS HGx A 99 PHE HBx 1.0 1.9 6.0 1859 1664 A 61 LYS HBy A 61 LYS HGy 1.0 1.8 3.8 1860 1665 A 61 LYS HDx A 61 LYS HGy 1.0 1.8 3.4 1861 1666 A 61 LYS HDy A 61 LYS HGy 1.0 1.9 3.7 1862 1667 A 61 LYS HGy A 61 LYS HEx 1.0 1.8 3.6 1863 1668 A 61 LYS HEy A 61 LYS HGy 1.0 1.8 3.8 1864 1669 A 61 LYS H A 60 GLU HBx 1.0 1.8 3.4 1865 1669 A 61 LYS H A 60 GLU HBy 1.0 1.8 3.4 1866 1670 A 60 GLU HGy A 61 LYS H 1.0 2.0 5.4 1867 1671 A 76 LEU HD1% A 61 LYS H 1.0 1.9 4.7 1868 1672 A 62 MET HBx A 62 MET HA 1.0 1.7 3.3 1869 1673 A 62 MET HBy A 62 MET HA 1.0 1.7 3.3 1870 1674 A 62 MET HGx A 62 MET HA 1.0 2.0 6.0 1871 1675 A 62 MET HGy A 62 MET HA 1.0 2.0 6.0 1872 1676 A 63 VAL HB A 62 MET HA 1.0 2.0 6.0 1873 1677 A 63 VAL HGx% A 62 MET HA 1.0 1.9 6.0 1874 1678 A 96 THR HG2% A 62 MET HA 1.0 2.0 6.0 1875 1679 A 62 MET HBx A 62 MET HGx 1.0 2.0 4.8 1876 1680 A 62 MET HBx A 62 MET HGy 1.0 1.8 3.6 1877 1681 A 62 MET HBx A 74 VAL HB 1.0 1.9 6.0 1878 1682 A 42 ASP HBy A 62 MET HE% 1.0 2.0 6.0 1879 1683 A 62 MET HE% A 62 MET HBx 1.0 1.9 6.0 1880 1684 A 62 MET HE% A 62 MET HBy 1.0 1.9 6.0 1881 1685 A 62 MET HE% A 64 ILE HD1% 1.0 1.6 2.8 1882 1686 A 62 MET HE% A 74 VAL HGx% 1.0 1.7 3.1 1883 1687 A 62 MET HE% A 74 VAL HGy% 1.0 1.8 3.8 1884 1688 A 62 MET HE% A 76 LEU HD2% 1.0 1.5 2.7 1885 1689 A 62 MET HE% A 96 THR HG2% 1.0 0.0 6.0 1886 1690 A 62 MET HBy A 62 MET HGx 1.0 1.9 4.1 1887 1691 A 62 MET HE% A 62 MET HGx 1.0 1.6 2.8 1888 1692 A 62 MET HGx A 62 MET HGy 1.0 1.3 2.2 1889 1693 A 62 MET HGx A 74 VAL HB 1.0 1.8 3.4 1890 1694 A 62 MET HGx A 74 VAL HGx% 1.0 2.0 6.0 1891 1695 A 62 MET HGx A 74 VAL HGy% 1.0 1.9 5.5 1892 1696 A 62 MET HBy A 62 MET HGy 1.0 2.0 4.8 1893 1697 A 64 ILE HD1% A 62 MET HGy 1.0 2.0 6.0 1894 1698 A 62 MET HGy A 74 VAL HB 1.0 1.7 3.5 1895 1699 A 62 MET HGy A 74 VAL HGx% 1.0 2.0 5.6 1896 1700 A 62 MET HGy A 74 VAL HGy% 1.0 2.0 6.0 1897 1701 A 62 MET H A 61 LYS HBy 1.0 1.7 3.1 1898 1702 A 62 MET H A 62 MET HA 1.0 1.8 3.8 1899 1703 A 62 MET HE% A 62 MET H 1.0 2.0 6.0 1900 1704 A 62 MET H A 62 MET HGx 1.0 1.8 3.8 1901 1705 A 62 MET H A 62 MET HGy 1.0 1.8 3.4 1902 1706 A 62 MET H A 63 VAL HGx% 1.0 1.9 6.0 1903 1707 A 64 ILE HD1% A 62 MET H 1.0 1.9 6.0 1904 1708 A 62 MET H A 74 VAL HB 1.0 2.0 5.2 1905 1709 A 62 MET H A 74 VAL HGy% 1.0 2.0 6.0 1906 1710 A 76 LEU HD1% A 62 MET H 1.0 2.0 6.0 1907 1711 A 76 LEU HD2% A 62 MET H 1.0 2.0 6.0 1908 1712 A 63 VAL HA A 63 VAL HB 1.0 1.8 3.8 1909 1713 A 63 VAL HA A 63 VAL HGx% 1.0 1.8 3.8 1910 1714 A 63 VAL HA A 63 VAL HGy% 1.0 1.7 3.3 1911 1715 A 64 ILE HD1% A 63 VAL HA 1.0 1.9 6.0 1912 1716 A 63 VAL HB A 63 VAL HGx% 1.0 1.6 2.8 1913 1717 A 63 VAL HGy% A 63 VAL HB 1.0 1.6 3.0 1914 1718 A 63 VAL HGy% A 63 VAL HGx% 1.0 1.6 2.8 1915 1719 A 63 VAL HGy% A 65 LEU HD1% 1.0 2.0 5.6 1916 1720 A 63 VAL HGy% A 65 LEU HD2% 1.0 1.7 3.3 1917 1721 A 73 THR HA A 63 VAL HGy% 1.0 2.0 6.0 1918 1722 A 63 VAL H A 62 MET HA 1.0 1.6 2.6 1919 1723 A 63 VAL H A 63 VAL HB 1.0 1.8 3.4 1920 1724 A 63 VAL H A 63 VAL HGx% 1.0 1.7 3.1 1921 1725 A 63 VAL H A 96 THR HG2% 1.0 1.9 4.3 1922 1726 A 45 LEU HD1% A 64 ILE HA 1.0 1.9 6.0 1923 1727 A 64 ILE HD1% A 64 ILE HA 1.0 1.9 6.0 1924 1728 A 64 ILE HA A 64 ILE HG1x 1.0 1.9 4.1 1925 1729 A 64 ILE HA A 64 ILE HG1y 1.0 1.8 3.8 1926 1730 A 64 ILE HA A 64 ILE HG2% 1.0 1.6 3.0 1927 1731 A 64 ILE HA A 65 LEU HD1% 1.0 2.0 6.0 1928 1732 A 64 ILE HA A 65 LEU HD2% 1.0 2.0 5.6 1929 1733 A 96 THR HA A 64 ILE HA 1.0 1.7 3.3 1930 1734 A 64 ILE HA A 96 THR HG2% 1.0 1.8 3.4 1931 1735 A 63 VAL HA A 64 ILE HB 1.0 1.9 6.0 1932 1736 A 64 ILE HA A 64 ILE HB 1.0 1.8 4.2 1933 1737 A 64 ILE HD1% A 64 ILE HB 1.0 1.7 3.1 1934 1738 A 64 ILE HG2% A 64 ILE HB 1.0 1.6 2.6 1935 1739 A 72 TYR HA A 64 ILE HB 1.0 1.9 6.0 1936 1740 A 41 LEU HD2% A 64 ILE HD1% 1.0 1.5 2.3 1937 1741 A 64 ILE HD1% A 74 VAL HB 1.0 2.0 5.2 1938 1742 A 62 MET HE% A 64 ILE HG1x 1.0 1.9 4.1 1939 1743 A 63 VAL HA A 64 ILE HG1x 1.0 2.0 6.0 1940 1744 A 64 ILE HG1x A 64 ILE HB 1.0 1.8 3.6 1941 1745 A 64 ILE HD1% A 64 ILE HG1x 1.0 1.6 2.8 1942 1746 A 64 ILE HG1x A 64 ILE HG2% 1.0 1.9 4.7 1943 1747 A 45 LEU HD1% A 64 ILE HG1y 1.0 1.6 3.0 1944 1748 A 64 ILE HG1y A 64 ILE HB 1.0 2.0 5.2 1945 1749 A 64 ILE HD1% A 64 ILE HG1y 1.0 1.6 2.8 1946 1750 A 64 ILE HG2% A 93 MET HA 1.0 2.0 6.0 1947 1751 A 64 ILE HG2% A 93 MET HBy 1.0 2.0 6.0 1948 1752 A 64 ILE HG2% A 93 MET HGy 1.0 1.7 3.1 1949 1752 A 64 ILE HG2% A 93 MET HGx 1.0 1.7 3.1 1950 1753 A 62 MET HE% A 64 ILE H 1.0 1.9 6.0 1951 1754 A 63 VAL HA A 64 ILE H 1.0 1.6 2.6 1952 1755 A 64 ILE H A 63 VAL HGx% 1.0 1.9 4.5 1953 1756 A 63 VAL HGy% A 64 ILE H 1.0 1.8 3.8 1954 1757 A 64 ILE H A 64 ILE HB 1.0 1.7 3.3 1955 1758 A 64 ILE H A 65 LEU HD1% 1.0 2.0 6.0 1956 1759 A 65 LEU HA A 65 LEU HBx 1.0 1.9 3.9 1957 1760 A 65 LEU HBy A 65 LEU HA 1.0 1.9 4.5 1958 1761 A 65 LEU HD1% A 65 LEU HA 1.0 1.9 6.0 1959 1762 A 65 LEU HD2% A 65 LEU HA 1.0 1.6 2.8 1960 1763 A 65 LEU HG A 65 LEU HA 1.0 2.0 5.2 1961 1764 A 65 LEU HA A 71 TYR HA 1.0 1.9 4.1 1962 1765 A 65 LEU HBy A 65 LEU HBx 1.0 1.5 2.3 1963 1766 A 65 LEU HD1% A 65 LEU HBx 1.0 1.9 4.1 1964 1767 A 65 LEU HBy A 65 LEU HD1% 1.0 1.8 4.0 1965 1768 A 65 LEU HD2% A 65 LEU HBy 1.0 1.9 4.3 1966 1769 A 65 LEU HBy A 94 TYR HBx 1.0 2.0 6.0 1967 1770 A 65 LEU HBy A 94 TYR HBy 1.0 1.8 6.0 1968 1771 A 65 LEU HBy A 117 ASN HBx 1.0 2.0 6.0 1969 1772 A 65 LEU HBy A 117 ASN HBy 1.0 1.9 6.0 1970 1773 A 65 LEU HD2% A 65 LEU HBx 1.0 1.9 4.5 1971 1774 A 65 LEU HD2% A 65 LEU HD1% 1.0 1.6 3.0 1972 1775 A 65 LEU HD2% A 71 TYR HBy 1.0 2.0 5.8 1973 1776 A 63 VAL HGy% A 65 LEU HG 1.0 1.9 4.1 1974 1777 A 65 LEU HG A 65 LEU HBx 1.0 1.9 4.3 1975 1778 A 65 LEU HG A 65 LEU HBy 1.0 1.8 3.4 1976 1779 A 65 LEU HG A 65 LEU HD1% 1.0 1.7 3.3 1977 1780 A 65 LEU HD2% A 65 LEU HG 1.0 1.5 2.5 1978 1781 A 64 ILE HG2% A 65 LEU H 1.0 1.8 3.6 1979 1782 A 65 LEU H A 65 LEU HA 1.0 1.9 3.9 1980 1783 A 65 LEU H A 65 LEU HBx 1.0 2.0 5.4 1981 1784 A 65 LEU HD2% A 65 LEU H 1.0 2.0 5.4 1982 1785 A 65 LEU H A 96 THR HG2% 1.0 2.0 6.0 1983 1786 A 66 THR HG2% A 66 THR HA 1.0 1.8 3.4 1984 1787 A 66 THR HA A 93 MET HGy 1.0 1.9 6.0 1985 1787 A 66 THR HA A 93 MET HGx 1.0 1.9 6.0 1986 1788 A 66 THR HA A 94 TYR HBx 1.0 2.0 5.0 1987 1789 A 66 THR HA A 94 TYR HBy 1.0 2.0 6.0 1988 1790 A 66 THR HA A 66 THR HB 1.0 1.7 3.1 1989 1791 A 66 THR HG2% A 66 THR HB 1.0 1.6 2.6 1990 1792 A 66 THR HG2% A 65 LEU HA 1.0 2.0 5.6 1991 1793 A 89 LEU HD2% A 66 THR HG2% 1.0 1.6 2.8 1992 1794 A 66 THR HG2% A 93 MET HBx 1.0 1.9 6.0 1993 1795 A 66 THR HG2% A 93 MET HBy 1.0 2.0 5.2 1994 1796 A 66 THR HG2% A 93 MET HGx 1.0 2.0 5.0 1995 1796 A 66 THR HG2% A 93 MET HGy 1.0 2.0 5.0 1996 1797 A 66 THR H A 117 ASN HA 1.0 2.0 6.0 1997 1798 A 67 GLU HA A 67 GLU HBx 1.0 1.7 3.1 1998 1798 A 67 GLU HA A 67 GLU HBy 1.0 1.7 3.1 1999 1799 A 67 GLU HGx A 67 GLU HA 1.0 2.0 4.6 2000 1800 A 67 GLU HGy A 67 GLU HA 1.0 1.8 3.8 2001 1801 A 116 THR HG2% A 67 GLU HA 1.0 1.9 5.5 2002 1802 A 67 GLU HA A 117 ASN HA 1.0 1.6 3.0 2003 1803 A 67 GLU HGx A 67 GLU HBx 1.0 1.7 3.3 2004 1803 A 67 GLU HGx A 67 GLU HBy 1.0 1.7 3.3 2005 1804 A 67 GLU HGy A 67 GLU HBx 1.0 1.7 3.5 2006 1804 A 67 GLU HGy A 67 GLU HBy 1.0 1.7 3.5 2007 1805 A 67 GLU HBx A 68 ASN HA 1.0 1.7 6.0 2008 1805 A 67 GLU HBy A 68 ASN HA 1.0 1.7 6.0 2009 1806 A 67 GLU HBx A 91 GLY HAx 1.0 1.7 3.1 2010 1806 A 67 GLU HBy A 91 GLY HAx 1.0 1.7 3.1 2011 1807 A 116 THR HG2% A 67 GLU HBx 1.0 2.0 5.8 2012 1807 A 116 THR HG2% A 67 GLU HBy 1.0 2.0 5.8 2013 1808 A 67 GLU HGy A 114 GLY HAx 1.0 2.0 5.6 2014 1808 A 67 GLU HGx A 114 GLY HAx 1.0 2.0 5.6 2015 1809 A 67 GLU HGy A 114 GLY HAy 1.0 2.0 4.8 2016 1809 A 67 GLU HGx A 114 GLY HAy 1.0 2.0 4.8 2017 1810 A 67 GLU HGx A 116 THR HG2% 1.0 2.0 5.8 2018 1811 A 66 THR HG2% A 67 GLU H 1.0 2.0 5.6 2019 1812 A 67 GLU H A 67 GLU HA 1.0 1.6 2.8 2020 1813 A 67 GLU H A 67 GLU HBx 1.0 1.7 3.1 2021 1813 A 67 GLU H A 67 GLU HBy 1.0 1.7 3.1 2022 1814 A 68 ASN HBx A 68 ASN HA 1.0 1.9 4.3 2023 1815 A 68 ASN HBy A 68 ASN HA 1.0 1.9 4.3 2024 1816 A 68 ASN HA A 119 TYR HA 1.0 1.8 3.4 2025 1817 A 68 ASN HBx A 90 LEU HBx 1.0 1.9 4.5 2026 1818 A 68 ASN HBy A 90 LEU HBx 1.0 1.8 3.6 2027 1819 A 68 ASN HD2y A 67 GLU HBx 1.0 1.9 4.1 2028 1819 A 68 ASN HD2y A 67 GLU HBy 1.0 1.9 4.1 2029 1820 A 68 ASN HD2y A 68 ASN HBx 1.0 1.9 4.7 2030 1821 A 68 ASN HD2y A 68 ASN HBy 1.0 1.6 3.0 2031 1822 A 68 ASN HD2y A 90 LEU HBx 1.0 2.0 6.0 2032 1823 A 68 ASN HD2y A 90 LEU HD2% 1.0 0.0 6.0 2033 1824 A 68 ASN HD2y A 91 GLY HAx 1.0 1.8 3.6 2034 1825 A 68 ASN HD2y A 91 GLY HAy 1.0 2.0 5.2 2035 1826 A 68 ASN HD2x A 67 GLU HBx 1.0 2.0 6.0 2036 1826 A 68 ASN HD2x A 67 GLU HBy 1.0 2.0 6.0 2037 1827 A 68 ASN HD2x A 68 ASN HBy 1.0 2.0 5.8 2038 1828 A 68 ASN HD2x A 90 LEU HD2% 1.0 0.0 6.0 2039 1829 A 68 ASN HD2x A 91 GLY HAx 1.0 2.0 5.6 2040 1830 A 68 ASN HD2x A 91 GLY HAy 1.0 2.0 5.6 2041 1831 A 67 GLU HGx A 68 ASN H 1.0 2.0 5.8 2042 1832 A 67 GLU HGy A 68 ASN H 1.0 1.9 4.9 2043 1833 A 68 ASN H A 68 ASN HA 1.0 1.7 3.1 2044 1834 A 116 THR HG2% A 68 ASN H 1.0 2.0 5.2 2045 1835 A 68 ASN H A 119 TYR HA 1.0 1.8 3.8 2046 1836 A 69 LYS HA A 69 LYS HBy 1.0 1.8 3.4 2047 1836 A 69 LYS HA A 69 LYS HBx 1.0 1.8 3.4 2048 1837 A 69 LYS HA A 69 LYS HDx 1.0 2.0 5.6 2049 1837 A 69 LYS HA A 69 LYS HDy 1.0 2.0 5.6 2050 1838 A 69 LYS HA A 69 LYS HEx 1.0 1.9 4.9 2051 1838 A 69 LYS HA A 69 LYS HEy 1.0 1.9 4.9 2052 1839 A 69 LYS HA A 69 LYS HGx 1.0 1.9 4.1 2053 1840 A 69 LYS HA A 69 LYS HGy 1.0 1.8 3.6 2054 1841 A 69 LYS HGx A 69 LYS HBy 1.0 1.8 3.6 2055 1841 A 69 LYS HGx A 69 LYS HBx 1.0 1.8 3.6 2056 1842 A 69 LYS HA A 69 LYS HBx 1.0 1.8 3.4 2057 1843 A 69 LYS HDx A 69 LYS HBx 1.0 1.9 3.9 2058 1843 A 69 LYS HDy A 69 LYS HBx 1.0 1.9 3.9 2059 1844 A 69 LYS HBx A 69 LYS HEx 1.0 1.9 4.5 2060 1844 A 69 LYS HBx A 69 LYS HEy 1.0 1.9 4.5 2061 1845 A 69 LYS HA A 69 LYS HBy 1.0 1.9 4.3 2062 1846 A 69 LYS HDx A 69 LYS HBy 1.0 1.8 3.8 2063 1846 A 69 LYS HDy A 69 LYS HBy 1.0 1.8 3.8 2064 1847 A 69 LYS HBy A 69 LYS HEx 1.0 1.8 4.0 2065 1847 A 69 LYS HBy A 69 LYS HEy 1.0 1.8 4.0 2066 1848 A 69 LYS HDy A 69 LYS HEx 1.0 1.7 3.1 2067 1848 A 69 LYS HDx A 69 LYS HEx 1.0 1.7 3.1 2068 1848 A 69 LYS HDx A 69 LYS HEy 1.0 1.7 3.1 2069 1848 A 69 LYS HDy A 69 LYS HEy 1.0 1.7 3.1 2070 1849 A 69 LYS HDx A 69 LYS HGx 1.0 1.8 3.6 2071 1849 A 69 LYS HDy A 69 LYS HGx 1.0 1.8 3.6 2072 1850 A 69 LYS HBy A 69 LYS HEy 1.0 2.0 5.2 2073 1850 A 69 LYS HBy A 69 LYS HEx 1.0 2.0 5.2 2074 1850 A 69 LYS HBx A 69 LYS HEx 1.0 2.0 5.2 2075 1850 A 69 LYS HBx A 69 LYS HEy 1.0 2.0 5.2 2076 1851 A 69 LYS HGy A 69 LYS HEx 1.0 2.0 5.0 2077 1851 A 69 LYS HGy A 69 LYS HEy 1.0 2.0 5.0 2078 1852 A 69 LYS HGx A 69 LYS HEx 1.0 2.0 4.8 2079 1852 A 69 LYS HGx A 69 LYS HEy 1.0 2.0 4.8 2080 1853 A 69 LYS HDx A 69 LYS HGy 1.0 1.8 3.4 2081 1853 A 69 LYS HDy A 69 LYS HGy 1.0 1.8 3.4 2082 1854 A 69 LYS H A 68 ASN HA 1.0 2.0 4.6 2083 1855 A 69 LYS HA A 69 LYS H 1.0 1.6 2.8 2084 1856 A 69 LYS H A 69 LYS HBy 1.0 2.0 6.0 2085 1856 A 69 LYS H A 69 LYS HBx 1.0 2.0 6.0 2086 1857 A 69 LYS HGx A 69 LYS H 1.0 1.8 3.6 2087 1858 A 69 LYS HGy A 69 LYS H 1.0 2.0 5.0 2088 1859 A 70 GLY HAx A 90 LEU HD1% 1.0 2.0 5.0 2089 1860 A 70 GLY HAy A 90 LEU HD1% 1.0 1.5 2.7 2090 1861 A 66 THR HA A 70 GLY H 1.0 2.0 6.0 2091 1862 A 70 GLY H A 69 LYS HBy 1.0 2.0 6.0 2092 1862 A 70 GLY H A 69 LYS HBx 1.0 2.0 6.0 2093 1863 A 70 GLY HAy A 70 GLY H 1.0 1.9 3.9 2094 1864 A 70 GLY H A 90 LEU HD2% 1.0 0.0 6.0 2095 1865 A 63 VAL HGy% A 71 TYR HA 1.0 2.0 6.0 2096 1866 A 65 LEU HD2% A 71 TYR HA 1.0 1.9 3.7 2097 1867 A 71 TYR HA A 71 TYR HBx 1.0 1.9 4.5 2098 1868 A 71 TYR HA A 71 TYR HBy 1.0 1.7 3.5 2099 1869 A 65 LEU HD2% A 71 TYR HBx 1.0 1.9 6.0 2100 1870 A 71 TYR HBx A 71 TYR HBy 1.0 1.3 2.2 2101 1871 A 63 VAL HGy% A 71 TYR HD% 1.0 2.0 5.0 2102 1872 A 65 LEU HD2% A 71 TYR HD% 1.0 1.7 3.1 2103 1873 A 71 TYR HBx A 71 TYR HD% 1.0 1.9 4.1 2104 1874 A 71 TYR HBy A 71 TYR HD% 1.0 1.7 3.5 2105 1875 A 71 TYR HD% A 72 TYR HA 1.0 2.0 5.8 2106 1876 A 63 VAL HGx% A 71 TYR HE% 1.0 2.0 6.0 2107 1877 A 63 VAL HGy% A 71 TYR HE% 1.0 1.9 4.5 2108 1878 A 65 LEU HD2% A 71 TYR HE% 1.0 1.9 4.5 2109 1879 A 70 GLY HAx A 71 TYR H 1.0 2.0 4.8 2110 1880 A 72 TYR HBy A 72 TYR HA 1.0 1.8 4.0 2111 1881 A 38 LEU HD2% A 72 TYR HBx 1.0 1.8 4.0 2112 1882 A 72 TYR HBx A 64 ILE HB 1.0 2.0 4.8 2113 1883 A 64 ILE HD1% A 72 TYR HBx 1.0 1.9 4.5 2114 1884 A 64 ILE HG2% A 72 TYR HBx 1.0 1.9 6.0 2115 1885 A 72 TYR HBx A 72 TYR HA 1.0 1.8 3.6 2116 1886 A 72 TYR HBx A 72 TYR HBy 1.0 1.3 2.2 2117 1887 A 72 TYR HBx A 74 VAL HGy% 1.0 1.9 4.9 2118 1888 A 38 LEU HD2% A 72 TYR HBy 1.0 1.9 4.1 2119 1889 A 72 TYR HBy A 64 ILE HB 1.0 1.6 3.0 2120 1890 A 64 ILE HD1% A 72 TYR HBy 1.0 1.9 4.5 2121 1891 A 64 ILE HG2% A 72 TYR HBy 1.0 2.0 6.0 2122 1892 A 72 TYR HBy A 74 VAL HGy% 1.0 0.0 6.0 2123 1893 A 38 LEU HD1% A 72 TYR HD% 1.0 1.8 3.6 2124 1894 A 38 LEU HD2% A 72 TYR HD% 1.0 2.0 5.8 2125 1895 A 72 TYR HD% A 64 ILE HB 1.0 2.0 5.2 2126 1896 A 64 ILE HD1% A 72 TYR HD% 1.0 1.9 6.0 2127 1897 A 64 ILE HG2% A 72 TYR HD% 1.0 1.9 4.3 2128 1898 A 66 THR HB A 72 TYR HD% 1.0 1.9 6.0 2129 1899 A 66 THR HG2% A 72 TYR HD% 1.0 1.7 3.3 2130 1900 A 72 TYR HA A 72 TYR HD% 1.0 1.8 4.2 2131 1901 A 72 TYR HBx A 72 TYR HD% 1.0 1.9 3.9 2132 1902 A 72 TYR HBy A 72 TYR HD% 1.0 1.8 3.4 2133 1903 A 72 TYR HD% A 74 VAL HGy% 1.0 0.0 6.0 2134 1904 A 87 VAL HGy% A 72 TYR HD% 1.0 2.0 5.0 2135 1905 A 89 LEU HD2% A 72 TYR HD% 1.0 1.9 4.5 2136 1906 A 38 LEU HD2% A 72 TYR HE% 1.0 1.9 6.0 2137 1907 A 64 ILE HD1% A 72 TYR HE% 1.0 1.7 6.0 2138 1908 A 66 THR HG2% A 72 TYR HE% 1.0 1.8 3.6 2139 1909 A 70 GLY HAx A 72 TYR HE% 1.0 1.9 4.5 2140 1910 A 70 GLY HAy A 72 TYR HE% 1.0 2.0 6.0 2141 1911 A 72 TYR HBx A 72 TYR HE% 1.0 1.7 6.0 2142 1912 A 72 TYR HBy A 72 TYR HE% 1.0 1.9 6.0 2143 1913 A 87 VAL HGy% A 72 TYR HE% 1.0 1.8 3.4 2144 1914 A 72 TYR HE% A 89 LEU HA 1.0 2.0 6.0 2145 1915 A 89 LEU HD2% A 72 TYR HE% 1.0 1.9 4.1 2146 1916 A 90 LEU HD2% A 72 TYR HE% 1.0 0.0 6.0 2147 1917 A 63 VAL HA A 72 TYR H 1.0 2.0 6.0 2148 1918 A 63 VAL HGy% A 72 TYR H 1.0 1.9 4.5 2149 1919 A 72 TYR H A 64 ILE HB 1.0 1.9 4.1 2150 1920 A 72 TYR H A 71 TYR HA 1.0 1.6 2.8 2151 1921 A 73 THR HA A 63 VAL HA 1.0 1.7 3.3 2152 1922 A 73 THR HA A 63 VAL HGx% 1.0 2.0 5.8 2153 1923 A 73 THR HA A 73 THR HB 1.0 1.8 3.6 2154 1924 A 73 THR HA A 73 THR HG2% 1.0 1.8 3.8 2155 1925 A 63 VAL HGx% A 73 THR HB 1.0 1.8 6.0 2156 1926 A 72 TYR HA A 73 THR HB 1.0 1.9 6.0 2157 1927 A 73 THR HB A 73 THR HG2% 1.0 1.5 2.7 2158 1928 A 72 TYR HA A 73 THR H 1.0 1.6 2.6 2159 1929 A 73 THR HA A 73 THR H 1.0 1.8 3.8 2160 1930 A 73 THR H A 73 THR HG2% 1.0 1.8 3.6 2161 1931 A 74 VAL HA A 74 VAL HB 1.0 2.0 4.4 2162 1932 A 74 VAL HA A 74 VAL HGx% 1.0 1.7 3.1 2163 1933 A 74 VAL HGy% A 74 VAL HA 1.0 1.7 3.1 2164 1934 A 62 MET HE% A 74 VAL HB 1.0 1.6 2.6 2165 1935 A 74 VAL HGx% A 74 VAL HB 1.0 1.5 2.7 2166 1936 A 74 VAL HGy% A 74 VAL HB 1.0 1.6 2.8 2167 1937 A 64 ILE HD1% A 74 VAL HGy% 1.0 1.6 2.8 2168 1938 A 61 LYS HA A 74 VAL H 1.0 2.0 6.0 2169 1939 A 62 MET HGx A 74 VAL H 1.0 2.0 4.4 2170 1940 A 62 MET HGy A 74 VAL H 1.0 2.0 5.0 2171 1941 A 74 VAL H A 74 VAL HB 1.0 1.8 3.4 2172 1942 A 76 LEU HD1% A 74 VAL H 1.0 0.0 6.0 2173 1943 A 61 LYS HBx A 75 TYR HA 1.0 1.9 4.3 2174 1944 A 61 LYS HBy A 75 TYR HA 1.0 1.7 3.1 2175 1945 A 75 TYR HA A 75 TYR HBx 1.0 1.7 3.3 2176 1946 A 75 TYR HA A 75 TYR HBy 1.0 1.9 4.3 2177 1947 A 76 LEU HD1% A 75 TYR HA 1.0 0.0 6.0 2178 1948 A 76 LEU HD2% A 75 TYR HA 1.0 0.0 6.0 2179 1949 A 75 TYR HBx A 75 TYR HBy 1.0 1.4 2.2 2180 1950 A 75 TYR HBx A 78 THR HG2% 1.0 2.0 5.8 2181 1951 A 78 THR HG2% A 75 TYR HBy 1.0 2.0 5.4 2182 1952 A 60 GLU HGx A 75 TYR HD% 1.0 2.0 6.0 2183 1953 A 60 GLU HGy A 75 TYR HD% 1.0 2.0 4.6 2184 1954 A 61 LYS HBx A 75 TYR HD% 1.0 1.9 4.5 2185 1955 A 61 LYS HBy A 75 TYR HD% 1.0 2.0 6.0 2186 1956 A 75 TYR HD% A 61 LYS HEx 1.0 1.9 6.0 2187 1957 A 61 LYS HEy A 75 TYR HD% 1.0 1.9 6.0 2188 1958 A 73 THR HG2% A 75 TYR HD% 1.0 1.9 5.1 2189 1959 A 75 TYR HA A 75 TYR HD% 1.0 2.0 4.6 2190 1960 A 75 TYR HBx A 75 TYR HD% 1.0 1.8 3.8 2191 1961 A 75 TYR HD% A 75 TYR HBy 1.0 1.8 3.6 2192 1962 A 60 GLU HGx A 75 TYR HE% 1.0 1.9 6.0 2193 1963 A 60 GLU HGy A 75 TYR HE% 1.0 2.0 6.0 2194 1964 A 61 LYS HDx A 75 TYR HE% 1.0 2.0 6.0 2195 1965 A 61 LYS HDy A 75 TYR HE% 1.0 1.7 6.0 2196 1966 A 61 LYS HEx A 75 TYR HE% 1.0 2.0 6.0 2197 1967 A 61 LYS HEy A 75 TYR HE% 1.0 2.0 6.0 2198 1968 A 73 THR HG2% A 75 TYR HE% 1.0 1.9 4.5 2199 1969 A 75 TYR H A 75 TYR HBy 1.0 1.6 2.8 2200 1970 A 76 LEU HBx A 76 LEU HA 1.0 1.8 3.4 2201 1971 A 76 LEU HBy A 76 LEU HA 1.0 1.9 4.3 2202 1972 A 76 LEU HG A 76 LEU HA 1.0 1.9 4.3 2203 1973 A 60 GLU HA A 76 LEU HBx 1.0 2.0 6.0 2204 1974 A 61 LYS HA A 76 LEU HBx 1.0 1.7 6.0 2205 1975 A 60 GLU HA A 76 LEU HBy 1.0 1.9 4.5 2206 1976 A 61 LYS HA A 76 LEU HBy 1.0 1.9 5.1 2207 1977 A 46 ARG HA A 76 LEU HD2% 1.0 2.0 5.8 2208 1977 A 46 ARG HA A 76 LEU HD1% 1.0 2.0 5.8 2209 1978 A 46 ARG HBx A 76 LEU HD2% 1.0 2.0 6.0 2210 1978 A 46 ARG HBx A 76 LEU HD1% 1.0 2.0 6.0 2211 1979 A 46 ARG HBy A 76 LEU HD2% 1.0 2.0 4.8 2212 1979 A 46 ARG HBy A 76 LEU HD1% 1.0 2.0 4.8 2213 1980 A 46 ARG HDx A 76 LEU HD2% 1.0 2.0 5.6 2214 1980 A 46 ARG HDx A 76 LEU HD1% 1.0 2.0 5.6 2215 1981 A 46 ARG HDy A 76 LEU HD2% 1.0 1.9 6.0 2216 1981 A 46 ARG HDy A 76 LEU HD1% 1.0 1.9 6.0 2217 1982 A 46 ARG HGx A 76 LEU HD1% 1.0 1.9 4.1 2218 1982 A 46 ARG HGx A 76 LEU HD2% 1.0 1.9 4.1 2219 1982 A 46 ARG HGy A 76 LEU HD2% 1.0 1.9 4.1 2220 1982 A 46 ARG HGy A 76 LEU HD1% 1.0 1.9 4.1 2221 1983 A 76 LEU HD2% A 59 PHE HBx 1.0 1.8 3.6 2222 1983 A 76 LEU HD1% A 59 PHE HBx 1.0 1.8 3.6 2223 1984 A 76 LEU HD2% A 59 PHE HBy 1.0 1.9 4.5 2224 1984 A 76 LEU HD1% A 59 PHE HBy 1.0 1.9 4.5 2225 1985 A 76 LEU HD2% A 60 GLU HA 1.0 2.0 6.0 2226 1985 A 76 LEU HD1% A 60 GLU HA 1.0 2.0 6.0 2227 1986 A 76 LEU HD2% A 61 LYS HA 1.0 2.0 5.2 2228 1986 A 76 LEU HD1% A 61 LYS HA 1.0 2.0 5.2 2229 1987 A 76 LEU HD2% A 62 MET HGx 1.0 2.0 5.4 2230 1987 A 76 LEU HD1% A 62 MET HGx 1.0 2.0 5.4 2231 1988 A 76 LEU HD2% A 62 MET HGy 1.0 1.8 3.8 2232 1988 A 76 LEU HD1% A 62 MET HGy 1.0 1.8 3.8 2233 1989 A 76 LEU HD2% A 76 LEU HA 1.0 1.6 3.0 2234 1989 A 76 LEU HD1% A 76 LEU HA 1.0 1.6 3.0 2235 1990 A 76 LEU HD2% A 76 LEU HG 1.0 1.5 2.7 2236 1990 A 76 LEU HD1% A 76 LEU HG 1.0 1.5 2.7 2237 1991 A 75 TYR HA A 76 LEU HG 1.0 2.0 6.0 2238 1992 A 61 LYS HA A 76 LEU H 1.0 1.4 2.2 2239 1993 A 61 LYS HBx A 76 LEU H 1.0 2.0 6.0 2240 1994 A 75 TYR HA A 76 LEU H 1.0 1.5 2.5 2241 1995 A 76 LEU H A 75 TYR HBx 1.0 1.9 4.7 2242 1996 A 76 LEU H A 76 LEU HA 1.0 1.8 3.8 2243 1997 A 76 LEU HBx A 76 LEU H 1.0 2.0 5.0 2244 1998 A 76 LEU HBy A 76 LEU H 1.0 1.6 3.0 2245 1999 A 76 LEU HD1% A 76 LEU H 1.0 2.0 5.4 2246 2000 A 76 LEU HD2% A 76 LEU H 1.0 2.0 5.4 2247 2001 A 60 GLU HBx A 77 ASN HA 1.0 1.9 6.0 2248 2001 A 60 GLU HBy A 77 ASN HA 1.0 1.9 6.0 2249 2002 A 77 ASN HBx A 77 ASN HA 1.0 1.7 3.5 2250 2003 A 77 ASN HBy A 77 ASN HA 1.0 1.6 3.0 2251 2004 A 78 THR HG2% A 77 ASN HBx 1.0 2.0 5.4 2252 2005 A 77 ASN HD2y A 77 ASN HA 1.0 2.0 6.0 2253 2006 A 77 ASN HD2y A 77 ASN HBx 1.0 1.8 3.6 2254 2007 A 77 ASN HD2y A 77 ASN HBy 1.0 1.8 4.0 2255 2008 A 78 THR HG2% A 77 ASN HD2y 1.0 2.0 5.2 2256 2009 A 77 ASN HD2x A 77 ASN HBx 1.0 2.0 6.0 2257 2010 A 77 ASN HD2x A 77 ASN HBy 1.0 2.0 6.0 2258 2011 A 78 THR HG2% A 77 ASN HD2x 1.0 2.0 5.4 2259 2012 A 75 TYR HA A 77 ASN H 1.0 1.9 4.9 2260 2013 A 75 TYR HBx A 77 ASN H 1.0 1.9 3.7 2261 2014 A 77 ASN H A 77 ASN HA 1.0 1.8 3.6 2262 2015 A 77 ASN H A 77 ASN HBx 1.0 1.8 3.6 2263 2016 A 77 ASN H A 78 THR HA 1.0 1.8 6.0 2264 2017 A 78 THR HA A 79 PRO HDx 1.0 1.4 2.2 2265 2018 A 78 THR HA A 78 THR HB 1.0 1.6 3.0 2266 2019 A 78 THR HG2% A 78 THR HB 1.0 1.6 2.6 2267 2020 A 78 THR HB A 79 PRO HDx 1.0 1.9 4.5 2268 2021 A 78 THR HB A 79 PRO HDy 1.0 1.6 3.0 2269 2022 A 78 THR HG2% A 78 THR HA 1.0 1.7 3.5 2270 2023 A 78 THR HG2% A 79 PRO HDx 1.0 2.0 6.0 2271 2024 A 78 THR HG2% A 79 PRO HDy 1.0 2.0 6.0 2272 2025 A 75 TYR HBy A 78 THR H 1.0 2.0 5.4 2273 2026 A 78 THR H A 76 LEU HA 1.0 2.0 4.8 2274 2027 A 78 THR H A 77 ASN HA 1.0 1.9 4.3 2275 2028 A 78 THR HG2% A 78 THR H 1.0 1.8 3.4 2276 2029 A 78 THR H A 79 PRO HDx 1.0 2.0 6.0 2277 2030 A 79 PRO HGx A 79 PRO HA 1.0 1.9 4.1 2278 2031 A 79 PRO HA A 79 PRO HBx 1.0 1.5 2.5 2279 2032 A 79 PRO HA A 79 PRO HBy 1.0 1.9 3.7 2280 2033 A 79 PRO HA A 79 PRO HDx 1.0 2.0 5.2 2281 2034 A 79 PRO HDy A 79 PRO HA 1.0 2.0 6.0 2282 2035 A 79 PRO HA A 79 PRO HGy 1.0 2.0 5.4 2283 2036 A 79 PRO HA A 80 LEU HBx 1.0 2.0 6.0 2284 2037 A 79 PRO HA A 80 LEU HBy 1.0 1.8 6.0 2285 2038 A 79 PRO HBx A 79 PRO HBy 1.0 1.3 2.2 2286 2039 A 79 PRO HGx A 79 PRO HBx 1.0 1.7 2.9 2287 2040 A 79 PRO HGy A 79 PRO HBx 1.0 1.7 3.5 2288 2041 A 79 PRO HDy A 79 PRO HBy 1.0 1.9 4.1 2289 2042 A 79 PRO HDx A 79 PRO HBx 1.0 2.0 6.0 2290 2043 A 79 PRO HDx A 79 PRO HBy 1.0 2.0 5.8 2291 2044 A 79 PRO HDx A 79 PRO HGy 1.0 1.8 3.6 2292 2045 A 79 PRO HDy A 79 PRO HGx 1.0 1.8 4.0 2293 2046 A 78 THR HA A 79 PRO HDy 1.0 1.8 3.8 2294 2047 A 79 PRO HDy A 79 PRO HBx 1.0 2.0 6.0 2295 2048 A 79 PRO HDy A 79 PRO HGy 1.0 1.7 3.1 2296 2049 A 78 THR HA A 79 PRO HGx 1.0 1.8 6.0 2297 2050 A 78 THR HB A 79 PRO HGx 1.0 1.6 6.0 2298 2051 A 79 PRO HGx A 79 PRO HDx 1.0 1.7 3.1 2299 2052 A 78 THR HA A 79 PRO HGy 1.0 1.7 6.0 2300 2053 A 80 LEU HA A 80 LEU HBx 1.0 1.9 3.7 2301 2054 A 80 LEU HA A 80 LEU HBy 1.0 1.7 3.1 2302 2055 A 80 LEU HD1% A 80 LEU HA 1.0 1.9 6.0 2303 2056 A 80 LEU HD2% A 80 LEU HA 1.0 1.9 4.3 2304 2057 A 80 LEU HA A 80 LEU HG 1.0 1.9 5.7 2305 2058 A 80 LEU HA A 81 ALA HB% 1.0 2.0 5.8 2306 2059 A 80 LEU HBx A 80 LEU HBy 1.0 1.2 2.2 2307 2060 A 80 LEU HD1% A 80 LEU HBx 1.0 1.7 3.3 2308 2061 A 80 LEU HD2% A 80 LEU HBx 1.0 1.8 3.4 2309 2062 A 80 LEU HD1% A 80 LEU HBy 1.0 1.6 2.8 2310 2063 A 80 LEU HD2% A 80 LEU HBy 1.0 1.9 4.3 2311 2064 A 80 LEU HD1% A 84 ARG HBx 1.0 2.0 5.2 2312 2065 A 80 LEU HD1% A 84 ARG HBy 1.0 1.8 3.8 2313 2066 A 80 LEU HD1% A 85 LYS HA 1.0 1.9 4.1 2314 2067 A 80 LEU HD1% A 85 LYS HBx 1.0 2.0 6.0 2315 2067 A 80 LEU HD1% A 85 LYS HBy 1.0 2.0 6.0 2316 2068 A 80 LEU HD1% A 85 LYS HGy 1.0 1.8 3.6 2317 2069 A 80 LEU HD1% A 80 LEU HD2% 1.0 1.6 3.0 2318 2070 A 80 LEU HD2% A 84 ARG HBy 1.0 1.9 6.0 2319 2071 A 80 LEU HD1% A 80 LEU HG 1.0 1.6 3.0 2320 2072 A 80 LEU HD2% A 80 LEU HG 1.0 1.6 2.8 2321 2073 A 80 LEU H A 79 PRO HBx 1.0 1.8 4.2 2322 2074 A 80 LEU H A 79 PRO HBy 1.0 1.9 4.7 2323 2075 A 79 PRO HDy A 80 LEU H 1.0 0.0 6.0 2324 2076 A 80 LEU H A 80 LEU HBx 1.0 1.6 2.6 2325 2077 A 80 LEU H A 80 LEU HBy 1.0 1.8 4.0 2326 2078 A 80 LEU HD2% A 80 LEU H 1.0 1.7 3.3 2327 2079 A 81 ALA HA A 81 ALA HB% 1.0 1.5 2.7 2328 2080 A 81 ALA HA A 82 GLU HGx 1.0 2.0 6.0 2329 2080 A 81 ALA HA A 82 GLU HGy 1.0 2.0 6.0 2330 2081 A 81 ALA HB% A 82 GLU HBx 1.0 2.0 6.0 2331 2081 A 81 ALA HB% A 82 GLU HBy 1.0 2.0 6.0 2332 2082 A 84 ARG HDx A 81 ALA HB% 1.0 2.0 6.0 2333 2083 A 81 ALA HB% A 84 ARG HDy 1.0 2.0 4.6 2334 2084 A 81 ALA H A 81 ALA HB% 1.0 1.6 2.6 2335 2085 A 81 ALA H A 84 ARG HDy 1.0 1.9 4.3 2336 2086 A 81 ALA HA A 82 GLU HA 1.0 2.0 5.4 2337 2087 A 82 GLU HA A 82 GLU HBx 1.0 1.6 2.8 2338 2087 A 82 GLU HA A 82 GLU HBy 1.0 1.6 2.8 2339 2088 A 82 GLU HA A 82 GLU HGx 1.0 1.8 3.8 2340 2088 A 82 GLU HA A 82 GLU HGy 1.0 1.8 3.8 2341 2089 A 85 LYS HDx A 82 GLU HA 1.0 1.6 2.8 2342 2089 A 85 LYS HDy A 82 GLU HA 1.0 1.6 2.8 2343 2090 A 85 LYS HGx A 82 GLU HA 1.0 1.7 3.3 2344 2091 A 85 LYS HGy A 82 GLU HA 1.0 2.0 6.0 2345 2092 A 81 ALA HA A 82 GLU HBx 1.0 2.0 6.0 2346 2092 A 81 ALA HA A 82 GLU HBy 1.0 2.0 6.0 2347 2093 A 81 ALA HA A 82 GLU H 1.0 1.5 2.5 2348 2094 A 82 GLU H A 81 ALA HB% 1.0 1.6 3.0 2349 2095 A 82 GLU H A 82 GLU HA 1.0 1.7 3.1 2350 2096 A 82 GLU H A 82 GLU HBx 1.0 1.6 2.8 2351 2096 A 82 GLU H A 82 GLU HBy 1.0 1.6 2.8 2352 2097 A 82 GLU H A 82 GLU HGx 1.0 1.7 3.1 2353 2097 A 82 GLU H A 82 GLU HGy 1.0 1.7 3.1 2354 2098 A 83 ASP HA A 83 ASP HBx 1.0 1.7 3.3 2355 2099 A 83 ASP HA A 83 ASP HBy 1.0 1.7 3.1 2356 2100 A 83 ASP HBx A 83 ASP HBy 1.0 1.3 2.2 2357 2101 A 38 LEU HD1% A 84 ARG HA 1.0 2.0 5.6 2358 2102 A 84 ARG HBx A 84 ARG HA 1.0 1.7 2.9 2359 2103 A 84 ARG HBy A 84 ARG HA 1.0 1.9 4.1 2360 2104 A 84 ARG HDx A 84 ARG HA 1.0 2.0 6.0 2361 2105 A 84 ARG HA A 84 ARG HDy 1.0 1.9 6.0 2362 2106 A 84 ARG HGy A 84 ARG HA 1.0 1.7 3.1 2363 2107 A 87 VAL HB A 84 ARG HA 1.0 1.8 3.4 2364 2108 A 84 ARG HA A 87 VAL HGx% 1.0 1.6 2.6 2365 2109 A 80 LEU HD2% A 84 ARG HBx 1.0 1.9 6.0 2366 2110 A 80 LEU HG A 84 ARG HBx 1.0 1.9 6.0 2367 2111 A 84 ARG HBx A 84 ARG HDx 1.0 1.8 3.8 2368 2112 A 84 ARG HBx A 84 ARG HDy 1.0 2.0 4.6 2369 2113 A 84 ARG HBx A 84 ARG HGy 1.0 1.7 3.1 2370 2114 A 84 ARG HBx A 87 VAL HGx% 1.0 1.8 3.8 2371 2115 A 84 ARG HBy A 84 ARG HDx 1.0 1.9 4.3 2372 2116 A 84 ARG HBy A 84 ARG HDy 1.0 1.8 3.4 2373 2117 A 80 LEU HD2% A 84 ARG HDx 1.0 1.7 6.0 2374 2118 A 80 LEU HD2% A 84 ARG HDy 1.0 1.9 6.0 2375 2119 A 84 ARG HGx A 84 ARG HDy 1.0 1.7 3.1 2376 2120 A 84 ARG HDx A 84 ARG HE 1.0 2.0 5.2 2377 2121 A 84 ARG HDy A 84 ARG HE 1.0 1.9 5.1 2378 2122 A 84 ARG HGx A 84 ARG HA 1.0 1.8 4.0 2379 2123 A 84 ARG HDx A 84 ARG HGx 1.0 1.9 3.7 2380 2124 A 84 ARG HDx A 84 ARG HGy 1.0 1.7 3.1 2381 2125 A 84 ARG HGy A 84 ARG HDy 1.0 1.9 4.3 2382 2126 A 84 ARG HGx A 84 ARG HGy 1.0 1.3 2.2 2383 2127 A 84 ARG H A 83 ASP HA 1.0 2.0 4.6 2384 2128 A 84 ARG HGx A 84 ARG H 1.0 1.6 2.8 2385 2129 A 84 ARG H A 85 LYS HGx 1.0 2.0 5.2 2386 2130 A 39 GLY HAy A 85 LYS HA 1.0 1.9 4.3 2387 2131 A 85 LYS HA A 80 LEU HD2% 1.0 1.9 6.0 2388 2132 A 85 LYS HA A 85 LYS HBx 1.0 1.7 3.3 2389 2132 A 85 LYS HA A 85 LYS HBy 1.0 1.7 3.3 2390 2133 A 85 LYS HA A 85 LYS HDx 1.0 2.0 6.0 2391 2133 A 85 LYS HA A 85 LYS HDy 1.0 2.0 6.0 2392 2134 A 85 LYS HA A 85 LYS HGx 1.0 1.8 4.2 2393 2135 A 85 LYS HA A 85 LYS HGy 1.0 1.6 3.0 2394 2136 A 39 GLY HAy A 85 LYS HBx 1.0 1.9 6.0 2395 2136 A 39 GLY HAy A 85 LYS HBy 1.0 1.9 6.0 2396 2137 A 39 GLY HAx A 85 LYS HDx 1.0 1.8 6.0 2397 2137 A 39 GLY HAx A 85 LYS HDy 1.0 1.8 6.0 2398 2138 A 39 GLY HAy A 85 LYS HDx 1.0 1.6 6.0 2399 2138 A 39 GLY HAy A 85 LYS HDy 1.0 1.6 6.0 2400 2139 A 85 LYS HBx A 85 LYS HEx 1.0 1.9 6.0 2401 2139 A 85 LYS HBy A 85 LYS HEx 1.0 1.9 6.0 2402 2140 A 85 LYS HGx A 85 LYS HEx 1.0 2.0 5.0 2403 2141 A 85 LYS HGy A 85 LYS HEx 1.0 1.9 4.1 2404 2142 A 82 GLU HA A 85 LYS HEy 1.0 2.0 5.6 2405 2143 A 85 LYS HDx A 85 LYS HEy 1.0 1.8 3.6 2406 2143 A 85 LYS HDy A 85 LYS HEy 1.0 1.8 3.6 2407 2144 A 85 LYS HGx A 85 LYS HEy 1.0 2.0 5.2 2408 2145 A 85 LYS HGy A 85 LYS HEy 1.0 2.0 5.2 2409 2146 A 80 LEU HD1% A 85 LYS HGx 1.0 1.9 4.1 2410 2147 A 39 GLY HAy A 85 LYS HGy 1.0 2.0 6.0 2411 2148 A 85 LYS HBx A 85 LYS HGy 1.0 1.8 3.4 2412 2148 A 85 LYS HBy A 85 LYS HGy 1.0 1.8 3.4 2413 2149 A 81 ALA HB% A 85 LYS H 1.0 2.0 6.0 2414 2150 A 82 GLU HBx A 85 LYS H 1.0 2.0 6.0 2415 2150 A 82 GLU HBy A 85 LYS H 1.0 2.0 6.0 2416 2151 A 85 LYS H A 84 ARG HA 1.0 1.8 3.6 2417 2152 A 84 ARG HGy A 85 LYS H 1.0 1.8 6.0 2418 2153 A 85 LYS HBx A 85 LYS H 1.0 1.6 2.8 2419 2153 A 85 LYS HBy A 85 LYS H 1.0 1.6 2.8 2420 2154 A 85 LYS HGy A 85 LYS H 1.0 2.0 5.2 2421 2155 A 37 THR HB A 86 ASN HA 1.0 1.8 4.2 2422 2156 A 37 THR HG2% A 86 ASN HA 1.0 1.7 3.5 2423 2157 A 86 ASN HBx A 86 ASN HA 1.0 1.7 3.3 2424 2158 A 86 ASN HBy A 86 ASN HA 1.0 1.9 3.9 2425 2159 A 37 THR HG2% A 86 ASN HBx 1.0 2.0 6.0 2426 2160 A 86 ASN HBx A 86 ASN HD2y 1.0 1.9 4.3 2427 2161 A 86 ASN HBy A 86 ASN HD2y 1.0 1.7 3.5 2428 2162 A 86 ASN HBy A 86 ASN HD2x 1.0 2.0 5.4 2429 2163 A 85 LYS HBx A 86 ASN H 1.0 1.8 4.0 2430 2163 A 85 LYS HBy A 86 ASN H 1.0 1.8 4.0 2431 2164 A 85 LYS HDx A 86 ASN H 1.0 0.0 6.0 2432 2164 A 85 LYS HDy A 86 ASN H 1.0 0.0 6.0 2433 2165 A 86 ASN H A 86 ASN HA 1.0 1.8 3.8 2434 2166 A 86 ASN H A 86 ASN HBx 1.0 1.9 4.1 2435 2167 A 86 ASN H A 86 ASN HBy 1.0 1.8 3.8 2436 2168 A 37 THR HG2% A 87 VAL HA 1.0 2.0 5.6 2437 2169 A 87 VAL HB A 87 VAL HA 1.0 1.8 3.6 2438 2170 A 87 VAL HGx% A 87 VAL HA 1.0 1.7 3.3 2439 2171 A 87 VAL HGy% A 87 VAL HA 1.0 1.7 3.3 2440 2172 A 87 VAL HA A 88 GLU HBx 1.0 2.0 6.0 2441 2172 A 87 VAL HA A 88 GLU HBy 1.0 2.0 6.0 2442 2173 A 38 LEU HBy A 87 VAL HB 1.0 2.0 5.0 2443 2174 A 38 LEU HD1% A 87 VAL HB 1.0 2.0 5.4 2444 2175 A 87 VAL HB A 87 VAL HGx% 1.0 1.5 2.3 2445 2176 A 87 VAL HB A 87 VAL HGy% 1.0 1.5 2.5 2446 2177 A 87 VAL HGy% A 88 GLU HBx 1.0 2.0 6.0 2447 2177 A 87 VAL HGy% A 88 GLU HBy 1.0 2.0 6.0 2448 2178 A 87 VAL HGy% A 89 LEU HA 1.0 0.0 6.0 2449 2179 A 87 VAL H A 37 THR HG2% 1.0 2.0 5.2 2450 2180 A 38 LEU HBy A 87 VAL H 1.0 2.0 6.0 2451 2181 A 87 VAL H A 38 LEU HG 1.0 1.7 6.0 2452 2182 A 87 VAL H A 87 VAL HGx% 1.0 1.4 2.2 2453 2183 A 88 GLU HA A 37 THR HG2% 1.0 1.8 3.6 2454 2184 A 88 GLU HA A 88 GLU HBx 1.0 1.7 3.1 2455 2184 A 88 GLU HA A 88 GLU HBy 1.0 1.7 3.1 2456 2185 A 88 GLU HA A 88 GLU HGx 1.0 2.0 4.8 2457 2186 A 88 GLU HA A 88 GLU HGy 1.0 1.8 4.0 2458 2187 A 88 GLU HBx A 88 GLU HGx 1.0 1.7 3.1 2459 2187 A 88 GLU HBy A 88 GLU HGx 1.0 1.7 3.1 2460 2188 A 88 GLU HBx A 88 GLU HGy 1.0 1.7 2.9 2461 2188 A 88 GLU HBy A 88 GLU HGy 1.0 1.7 2.9 2462 2189 A 37 THR HA A 88 GLU H 1.0 2.0 6.0 2463 2190 A 87 VAL HB A 88 GLU H 1.0 2.0 6.0 2464 2191 A 88 GLU H A 88 GLU HGx 1.0 1.9 3.9 2465 2192 A 88 GLU H A 88 GLU HGy 1.0 1.9 4.9 2466 2193 A 89 LEU HBx A 89 LEU HA 1.0 1.8 3.4 2467 2194 A 89 LEU HA A 89 LEU HBy 1.0 1.9 3.9 2468 2195 A 89 LEU HD1% A 89 LEU HA 1.0 2.0 6.0 2469 2196 A 89 LEU HD2% A 89 LEU HA 1.0 1.5 2.5 2470 2197 A 89 LEU HG A 89 LEU HA 1.0 1.9 4.3 2471 2198 A 89 LEU HA A 90 LEU HG 1.0 2.0 6.0 2472 2199 A 89 LEU HBx A 89 LEU HBy 1.0 1.3 2.2 2473 2200 A 89 LEU HBx A 89 LEU HD1% 1.0 1.7 3.1 2474 2201 A 89 LEU HD1% A 89 LEU HBy 1.0 1.7 3.3 2475 2202 A 89 LEU HD2% A 89 LEU HBy 1.0 1.9 4.5 2476 2203 A 89 LEU HD1% A 36 THR HA 1.0 1.9 4.1 2477 2204 A 89 LEU HD1% A 41 LEU HBx 1.0 1.9 4.5 2478 2205 A 89 LEU HD2% A 89 LEU HD1% 1.0 1.6 2.6 2479 2206 A 89 LEU HD2% A 38 LEU HBx 1.0 1.8 6.0 2480 2207 A 89 LEU HD2% A 41 LEU HD1% 1.0 2.0 4.4 2481 2208 A 89 LEU HD2% A 89 LEU HBx 1.0 1.9 4.1 2482 2209 A 89 LEU HG A 37 THR HA 1.0 1.9 4.1 2483 2210 A 88 GLU HA A 89 LEU HG 1.0 2.0 5.6 2484 2211 A 89 LEU HBx A 89 LEU HG 1.0 1.8 4.0 2485 2212 A 89 LEU HG A 89 LEU HBy 1.0 1.7 3.1 2486 2213 A 89 LEU HD1% A 89 LEU HG 1.0 1.7 3.1 2487 2214 A 89 LEU HD2% A 89 LEU HG 1.0 1.6 2.8 2488 2215 A 89 LEU H A 36 THR HB 1.0 2.0 5.8 2489 2216 A 89 LEU H A 36 THR HG2% 1.0 2.0 6.0 2490 2217 A 89 LEU H A 37 THR HA 1.0 1.9 4.3 2491 2218 A 89 LEU H A 37 THR HG2% 1.0 2.0 5.8 2492 2219 A 89 LEU H A 88 GLU HBx 1.0 1.9 4.1 2493 2219 A 89 LEU H A 88 GLU HBy 1.0 1.9 4.1 2494 2220 A 89 LEU H A 88 GLU HGx 1.0 1.8 6.0 2495 2221 A 89 LEU H A 88 GLU HGy 1.0 2.0 6.0 2496 2222 A 89 LEU H A 89 LEU HBx 1.0 1.9 4.9 2497 2223 A 89 LEU H A 89 LEU HBy 1.0 1.7 3.5 2498 2224 A 89 LEU H A 89 LEU HD1% 1.0 2.0 5.8 2499 2225 A 89 LEU HD2% A 89 LEU H 1.0 2.0 5.4 2500 2226 A 90 LEU HA A 90 LEU HBx 1.0 1.8 3.4 2501 2227 A 90 LEU HA A 90 LEU HBy 1.0 1.9 3.9 2502 2228 A 90 LEU HA A 90 LEU HD1% 1.0 2.0 6.0 2503 2229 A 90 LEU HA A 90 LEU HD2% 1.0 1.5 2.5 2504 2230 A 70 GLY HAx A 90 LEU HBx 1.0 1.9 6.0 2505 2231 A 90 LEU HBx A 90 LEU HD2% 1.0 1.6 3.0 2506 2232 A 68 ASN HBx A 90 LEU HBy 1.0 1.9 6.0 2507 2233 A 68 ASN HBy A 90 LEU HBy 1.0 2.0 6.0 2508 2234 A 70 GLY HAx A 90 LEU HBy 1.0 1.8 3.6 2509 2235 A 70 GLY HAy A 90 LEU HBy 1.0 1.9 4.7 2510 2236 A 90 LEU HBy A 90 LEU HD1% 1.0 1.6 3.0 2511 2237 A 90 LEU HBx A 90 LEU HD1% 1.0 1.7 3.3 2512 2238 A 90 LEU HD1% A 90 LEU HG 1.0 1.6 2.6 2513 2239 A 68 ASN HBy A 90 LEU HD2% 1.0 1.9 6.0 2514 2240 A 70 GLY HAx A 90 LEU HD2% 1.0 1.6 6.0 2515 2241 A 70 GLY HAy A 90 LEU HD2% 1.0 1.7 6.0 2516 2242 A 90 LEU HD2% A 89 LEU HA 1.0 1.9 6.0 2517 2243 A 90 LEU HBy A 90 LEU HD2% 1.0 1.9 4.7 2518 2244 A 90 LEU HA A 90 LEU HG 1.0 1.8 3.8 2519 2245 A 90 LEU HD2% A 90 LEU HG 1.0 1.5 2.5 2520 2246 A 66 THR HG2% A 90 LEU H 1.0 2.0 6.0 2521 2247 A 89 LEU HA A 90 LEU H 1.0 1.5 2.5 2522 2248 A 89 LEU HBx A 90 LEU H 1.0 1.8 4.2 2523 2249 A 89 LEU HD2% A 90 LEU H 1.0 1.9 4.9 2524 2250 A 90 LEU HA A 90 LEU H 1.0 1.8 3.4 2525 2251 A 90 LEU HBx A 90 LEU H 1.0 2.0 4.8 2526 2252 A 90 LEU HD1% A 90 LEU H 1.0 2.0 5.8 2527 2253 A 90 LEU HD2% A 90 LEU H 1.0 2.0 5.2 2528 2254 A 90 LEU H A 90 LEU HG 1.0 1.7 3.3 2529 2255 A 67 GLU HBx A 91 GLY HAy 1.0 2.0 5.2 2530 2255 A 67 GLU HBy A 91 GLY HAy 1.0 2.0 5.2 2531 2256 A 66 THR HB A 91 GLY H 1.0 2.0 5.2 2532 2257 A 66 THR HG2% A 91 GLY H 1.0 1.9 4.5 2533 2258 A 91 GLY H A 67 GLU HBx 1.0 1.7 6.0 2534 2258 A 91 GLY H A 67 GLU HBy 1.0 1.7 6.0 2535 2259 A 91 GLY H A 68 ASN HBx 1.0 1.8 6.0 2536 2260 A 91 GLY H A 68 ASN HBy 1.0 2.0 5.4 2537 2261 A 89 LEU HBx A 91 GLY H 1.0 1.8 3.6 2538 2262 A 91 GLY H A 89 LEU HBy 1.0 2.0 4.6 2539 2263 A 89 LEU HD2% A 91 GLY H 1.0 2.0 6.0 2540 2264 A 91 GLY H A 90 LEU HA 1.0 1.9 4.1 2541 2265 A 91 GLY H A 91 GLY HAx 1.0 1.8 3.4 2542 2266 A 91 GLY H A 91 GLY HAy 1.0 1.8 3.8 2543 2267 A 67 GLU HGx A 92 LYS HA 1.0 2.0 6.0 2544 2268 A 67 GLU HGy A 92 LYS HA 1.0 1.7 6.0 2545 2269 A 92 LYS HBx A 92 LYS HA 1.0 1.8 3.8 2546 2270 A 92 LYS HGx A 92 LYS HA 1.0 1.7 3.3 2547 2271 A 92 LYS HA A 92 LYS HGy 1.0 1.9 4.7 2548 2272 A 92 LYS HBx A 113 PRO HGx 1.0 1.9 6.0 2549 2273 A 92 LYS HBx A 114 GLY HAx 1.0 2.0 4.6 2550 2274 A 92 LYS HBx A 114 GLY HAy 1.0 1.6 3.0 2551 2275 A 92 LYS HBy A 92 LYS HA 1.0 1.7 3.1 2552 2276 A 92 LYS HBy A 92 LYS HEx 1.0 1.9 4.1 2553 2276 A 92 LYS HBy A 92 LYS HEy 1.0 1.9 4.1 2554 2277 A 92 LYS HBy A 113 PRO HGx 1.0 1.2 6.0 2555 2278 A 92 LYS HBy A 114 GLY HAx 1.0 1.8 6.0 2556 2279 A 92 LYS HBy A 114 GLY HAy 1.0 2.0 5.6 2557 2280 A 91 GLY HAx A 92 LYS HDx 1.0 1.9 6.0 2558 2280 A 91 GLY HAx A 92 LYS HDy 1.0 1.9 6.0 2559 2281 A 91 GLY HAy A 92 LYS HDx 1.0 1.9 6.0 2560 2281 A 91 GLY HAy A 92 LYS HDy 1.0 1.9 6.0 2561 2282 A 92 LYS HDx A 92 LYS HA 1.0 1.6 3.0 2562 2282 A 92 LYS HDy A 92 LYS HA 1.0 1.6 3.0 2563 2283 A 92 LYS HDy A 92 LYS HEx 1.0 1.6 2.8 2564 2283 A 92 LYS HDx A 92 LYS HEx 1.0 1.6 2.8 2565 2283 A 92 LYS HDx A 92 LYS HEy 1.0 1.6 2.8 2566 2283 A 92 LYS HDy A 92 LYS HEy 1.0 1.6 2.8 2567 2284 A 92 LYS HBx A 92 LYS HEx 1.0 2.0 6.0 2568 2284 A 92 LYS HBx A 92 LYS HEy 1.0 2.0 6.0 2569 2285 A 67 GLU HGx A 92 LYS H 1.0 1.9 4.5 2570 2286 A 92 LYS H A 91 GLY HAx 1.0 1.7 3.3 2571 2287 A 92 LYS H A 92 LYS HA 1.0 1.8 3.8 2572 2288 A 92 LYS H A 92 LYS HGx 1.0 2.0 5.4 2573 2289 A 92 LYS H A 92 LYS HGy 1.0 2.0 6.0 2574 2290 A 41 LEU HD1% A 93 MET HA 1.0 2.0 6.0 2575 2291 A 66 THR HA A 93 MET HA 1.0 1.8 3.4 2576 2292 A 66 THR HB A 93 MET HA 1.0 2.0 5.2 2577 2293 A 66 THR HG2% A 93 MET HA 1.0 1.4 2.4 2578 2294 A 93 MET HA A 93 MET HBy 1.0 1.7 3.3 2579 2295 A 93 MET HA A 93 MET HGy 1.0 1.7 3.3 2580 2295 A 93 MET HA A 93 MET HGx 1.0 1.7 3.3 2581 2296 A 93 MET HA A 94 TYR HBx 1.0 2.0 6.0 2582 2297 A 93 MET HA A 94 TYR HBy 1.0 2.0 6.0 2583 2298 A 41 LEU HD1% A 93 MET HBx 1.0 2.0 6.0 2584 2299 A 93 MET HBx A 93 MET HE% 1.0 1.7 3.1 2585 2300 A 93 MET HBx A 112 GLY HAx 1.0 2.0 6.0 2586 2301 A 93 MET HBx A 112 GLY HAy 1.0 1.7 6.0 2587 2302 A 93 MET HBx A 113 PRO HDx 1.0 1.9 6.0 2588 2303 A 93 MET HBx A 113 PRO HDy 1.0 1.8 4.2 2589 2304 A 41 LEU HD1% A 93 MET HBy 1.0 1.6 3.0 2590 2305 A 93 MET HBy A 93 MET HGx 1.0 1.6 2.8 2591 2305 A 93 MET HBy A 93 MET HGy 1.0 1.6 2.8 2592 2306 A 93 MET HBy A 113 PRO HDx 1.0 2.0 6.0 2593 2307 A 93 MET HBy A 113 PRO HDy 1.0 2.0 4.8 2594 2308 A 93 MET HBy A 113 PRO HGx 1.0 0.0 6.0 2595 2309 A 93 MET HE% A 96 THR HB 1.0 2.0 6.0 2596 2310 A 93 MET HE% A 111 ASN HA 1.0 2.0 6.0 2597 2311 A 93 MET HE% A 112 GLY HAx 1.0 1.8 3.4 2598 2312 A 41 LEU HD2% A 93 MET HGy 1.0 1.8 4.2 2599 2312 A 41 LEU HD2% A 93 MET HGx 1.0 1.8 4.2 2600 2313 A 45 LEU HD1% A 93 MET HGy 1.0 2.0 4.8 2601 2313 A 45 LEU HD1% A 93 MET HGx 1.0 2.0 4.8 2602 2314 A 93 MET HBx A 93 MET HGy 1.0 1.7 3.5 2603 2314 A 93 MET HBx A 93 MET HGx 1.0 1.7 3.5 2604 2315 A 93 MET HE% A 93 MET HGy 1.0 1.7 3.1 2605 2315 A 93 MET HE% A 93 MET HGx 1.0 1.7 3.1 2606 2316 A 96 THR HG2% A 93 MET HGy 1.0 0.0 6.0 2607 2316 A 96 THR HG2% A 93 MET HGx 1.0 0.0 6.0 2608 2317 A 112 GLY HAy A 93 MET HGy 1.0 1.8 6.0 2609 2317 A 112 GLY HAy A 93 MET HGx 1.0 1.8 6.0 2610 2318 A 92 LYS HDx A 93 MET H 1.0 2.0 6.0 2611 2318 A 92 LYS HDy A 93 MET H 1.0 2.0 6.0 2612 2319 A 92 LYS HGx A 93 MET H 1.0 1.8 4.0 2613 2320 A 93 MET H A 92 LYS HGy 1.0 1.9 6.0 2614 2321 A 93 MET H A 93 MET HE% 1.0 1.9 6.0 2615 2322 A 93 MET H A 113 PRO HGx 1.0 1.5 6.0 2616 2323 A 93 MET H A 113 PRO HGy 1.0 2.0 5.6 2617 2324 A 94 TYR HBx A 94 TYR HA 1.0 1.8 4.0 2618 2325 A 94 TYR HBx A 94 TYR HBy 1.0 1.3 2.2 2619 2326 A 94 TYR HBy A 94 TYR HA 1.0 1.8 3.4 2620 2327 A 65 LEU HBx A 94 TYR HD% 1.0 2.0 4.8 2621 2328 A 65 LEU HBy A 94 TYR HD% 1.0 1.8 4.2 2622 2329 A 65 LEU HG A 94 TYR HD% 1.0 2.0 6.0 2623 2330 A 94 TYR HD% A 94 TYR HA 1.0 1.8 3.6 2624 2331 A 94 TYR HBx A 94 TYR HD% 1.0 1.7 3.3 2625 2332 A 94 TYR HBy A 94 TYR HD% 1.0 1.8 3.8 2626 2333 A 94 TYR HD% A 95 LYS HBx 1.0 2.0 5.8 2627 2334 A 94 TYR HD% A 95 LYS HBy 1.0 1.9 5.1 2628 2335 A 94 TYR HD% A 95 LYS HDx 1.0 2.0 6.0 2629 2336 A 94 TYR HD% A 95 LYS HDy 1.0 1.9 6.0 2630 2337 A 94 TYR HD% A 95 LYS HEy 1.0 0.0 6.0 2631 2338 A 94 TYR HD% A 115 LYS HA 1.0 1.9 4.9 2632 2339 A 94 TYR HD% A 116 THR HA 1.0 2.0 5.6 2633 2340 A 65 LEU HD1% A 94 TYR HE% 1.0 2.0 5.2 2634 2341 A 94 TYR HA A 94 TYR HE% 1.0 1.8 6.0 2635 2342 A 94 TYR HBx A 94 TYR HE% 1.0 1.9 6.0 2636 2343 A 94 TYR HBy A 94 TYR HE% 1.0 1.7 6.0 2637 2344 A 94 TYR HE% A 95 LYS HDx 1.0 1.9 6.0 2638 2345 A 94 TYR HE% A 95 LYS HDy 1.0 2.0 6.0 2639 2346 A 94 TYR HE% A 95 LYS HEx 1.0 1.9 4.7 2640 2347 A 94 TYR HE% A 95 LYS HEy 1.0 1.9 4.9 2641 2348 A 94 TYR HE% A 95 LYS HGy 1.0 2.0 6.0 2642 2349 A 94 TYR HE% A 115 LYS HA 1.0 2.0 5.2 2643 2350 A 94 TYR HE% A 116 THR HA 1.0 2.0 6.0 2644 2351 A 94 TYR HE% A 117 ASN HBx 1.0 0.0 6.0 2645 2352 A 94 TYR HE% A 117 ASN HBy 1.0 0.0 6.0 2646 2353 A 64 ILE HG2% A 94 TYR H 1.0 1.9 6.0 2647 2354 A 66 THR HA A 94 TYR H 1.0 1.7 2.9 2648 2355 A 66 THR HG2% A 94 TYR H 1.0 2.0 5.4 2649 2356 A 94 TYR H A 93 MET HA 1.0 1.5 2.7 2650 2357 A 94 TYR H A 93 MET HBx 1.0 2.0 6.0 2651 2358 A 94 TYR H A 93 MET HE% 1.0 1.9 6.0 2652 2359 A 94 TYR H A 93 MET HGy 1.0 1.9 4.5 2653 2359 A 94 TYR H A 93 MET HGx 1.0 1.9 4.5 2654 2360 A 94 TYR H A 94 TYR HA 1.0 1.9 4.5 2655 2361 A 94 TYR H A 94 TYR HBx 1.0 1.7 3.1 2656 2362 A 94 TYR H A 94 TYR HBy 1.0 1.9 3.9 2657 2363 A 95 LYS HA A 95 LYS HBx 1.0 1.9 4.1 2658 2364 A 95 LYS HA A 95 LYS HBy 1.0 1.8 3.6 2659 2365 A 95 LYS HA A 95 LYS HGx 1.0 1.8 3.6 2660 2366 A 95 LYS HA A 95 LYS HGy 1.0 1.9 4.3 2661 2367 A 95 LYS HBx A 95 LYS HGy 1.0 1.8 3.6 2662 2368 A 95 LYS HBx A 111 ASN HA 1.0 1.9 6.0 2663 2369 A 95 LYS HBy A 95 LYS HDx 1.0 1.8 4.0 2664 2370 A 95 LYS HBy A 95 LYS HGy 1.0 1.9 4.5 2665 2371 A 95 LYS HBy A 111 ASN HA 1.0 2.0 6.0 2666 2372 A 95 LYS HBx A 95 LYS HDx 1.0 2.0 4.8 2667 2373 A 95 LYS HDx A 95 LYS HEx 1.0 1.9 4.1 2668 2374 A 95 LYS HDx A 95 LYS HEy 1.0 1.7 3.3 2669 2375 A 95 LYS HGx A 95 LYS HDx 1.0 1.9 4.3 2670 2376 A 95 LYS HGy A 95 LYS HDx 1.0 2.0 4.8 2671 2377 A 95 LYS HDy A 95 LYS HEx 1.0 1.9 3.9 2672 2378 A 95 LYS HDy A 95 LYS HEy 1.0 1.9 4.3 2673 2379 A 95 LYS HDy A 95 LYS HGy 1.0 1.8 4.2 2674 2380 A 95 LYS HGy A 95 LYS HEy 1.0 2.0 4.8 2675 2381 A 95 LYS HBx A 95 LYS HGx 1.0 1.9 4.3 2676 2382 A 95 LYS HBy A 95 LYS HGx 1.0 1.8 3.8 2677 2383 A 95 LYS HDy A 95 LYS HGx 1.0 1.9 4.1 2678 2384 A 95 LYS HGx A 95 LYS HEx 1.0 1.9 5.1 2679 2385 A 95 LYS HGx A 95 LYS HEy 1.0 2.0 5.2 2680 2386 A 95 LYS HGx A 95 LYS HGy 1.0 1.4 2.2 2681 2387 A 95 LYS HGx A 111 ASN HA 1.0 2.0 5.6 2682 2388 A 95 LYS HGy A 95 LYS HEx 1.0 1.9 3.9 2683 2389 A 96 THR HA A 64 ILE HG2% 1.0 2.0 6.0 2684 2390 A 96 THR HA A 96 THR HG2% 1.0 1.7 3.3 2685 2391 A 45 LEU HD1% A 96 THR HB 1.0 2.0 5.8 2686 2392 A 45 LEU HD2% A 96 THR HB 1.0 2.0 5.0 2687 2393 A 96 THR HA A 96 THR HB 1.0 1.9 4.7 2688 2394 A 96 THR HB A 96 THR HG2% 1.0 1.7 2.9 2689 2395 A 96 THR HB A 110 ILE HB 1.0 1.7 3.3 2690 2396 A 110 ILE HD1% A 96 THR HB 1.0 0.0 6.0 2691 2397 A 110 ILE HG2% A 96 THR HB 1.0 2.0 5.8 2692 2398 A 45 LEU HD1% A 96 THR HG1 1.0 1.9 4.3 2693 2399 A 45 LEU HD2% A 96 THR HG1 1.0 1.9 4.3 2694 2400 A 64 ILE HA A 96 THR HG1 1.0 2.0 5.6 2695 2401 A 64 ILE HG2% A 96 THR HG1 1.0 1.9 3.9 2696 2402 A 96 THR HG1 A 93 MET HE% 1.0 1.8 3.4 2697 2403 A 96 THR HG1 A 93 MET HGy 1.0 1.8 3.8 2698 2403 A 96 THR HG1 A 93 MET HGx 1.0 1.8 3.8 2699 2404 A 96 THR HG1 A 95 LYS HA 1.0 2.0 6.0 2700 2405 A 96 THR HA A 96 THR HG1 1.0 1.9 4.5 2701 2406 A 96 THR HG1 A 96 THR HB 1.0 1.7 3.3 2702 2407 A 96 THR HG1 A 96 THR HG2% 1.0 1.9 4.3 2703 2408 A 96 THR HG1 A 110 ILE HB 1.0 2.0 6.0 2704 2409 A 110 ILE HD1% A 96 THR HG1 1.0 0.0 6.0 2705 2410 A 110 ILE HG2% A 96 THR HG1 1.0 0.0 6.0 2706 2411 A 62 MET HBx A 96 THR HG2% 1.0 2.0 6.0 2707 2412 A 62 MET HBy A 96 THR HG2% 1.0 1.8 3.4 2708 2413 A 62 MET HGx A 96 THR HG2% 1.0 1.9 5.1 2709 2414 A 62 MET HGy A 96 THR HG2% 1.0 2.0 6.0 2710 2415 A 93 MET HE% A 96 THR HG2% 1.0 2.0 6.0 2711 2416 A 96 THR H A 109 VAL HGx% 1.0 1.9 4.5 2712 2417 A 110 ILE HG2% A 96 THR H 1.0 2.0 6.0 2713 2418 A 96 THR H A 111 ASN HA 1.0 2.0 5.6 2714 2419 A 97 TYR HBy A 97 TYR HA 1.0 2.0 4.8 2715 2420 A 97 TYR HA A 109 VAL HA 1.0 1.8 3.6 2716 2421 A 97 TYR HA A 109 VAL HB 1.0 1.9 6.0 2717 2422 A 109 VAL HGx% A 97 TYR HA 1.0 1.9 4.3 2718 2423 A 97 TYR HBx A 63 VAL HB 1.0 1.7 6.0 2719 2424 A 97 TYR HBx A 97 TYR HA 1.0 1.8 3.6 2720 2425 A 97 TYR HBy A 63 VAL HB 1.0 2.0 6.0 2721 2426 A 63 VAL HGy% A 97 TYR HBy 1.0 1.7 6.0 2722 2427 A 97 TYR HBy A 106 SER HBx 1.0 1.9 6.0 2723 2428 A 97 TYR HBy A 106 SER HBy 1.0 2.0 6.0 2724 2429 A 63 VAL HB A 97 TYR HD% 1.0 1.8 6.0 2725 2430 A 95 LYS HGy A 97 TYR HD% 1.0 2.0 5.4 2726 2431 A 97 TYR HBx A 97 TYR HD% 1.0 1.8 3.8 2727 2432 A 97 TYR HBy A 97 TYR HD% 1.0 1.7 3.5 2728 2433 A 97 TYR HD% A 106 SER HBx 1.0 2.0 5.8 2729 2434 A 97 TYR HD% A 106 SER HBy 1.0 2.0 5.4 2730 2435 A 97 TYR HD% A 109 VAL HB 1.0 1.9 6.0 2731 2436 A 109 VAL HGx% A 97 TYR HD% 1.0 1.9 4.5 2732 2437 A 109 VAL HGy% A 97 TYR HD% 1.0 1.9 5.3 2733 2438 A 65 LEU HD1% A 97 TYR HE% 1.0 1.9 3.7 2734 2439 A 95 LYS HBx A 97 TYR HE% 1.0 2.0 4.6 2735 2440 A 95 LYS HBy A 97 TYR HE% 1.0 2.0 6.0 2736 2441 A 95 LYS HDx A 97 TYR HE% 1.0 2.0 6.0 2737 2442 A 95 LYS HDy A 97 TYR HE% 1.0 2.0 5.4 2738 2443 A 95 LYS HGy A 97 TYR HE% 1.0 2.0 6.0 2739 2444 A 97 TYR HBx A 97 TYR HE% 1.0 1.8 6.0 2740 2445 A 97 TYR HBy A 97 TYR HE% 1.0 1.8 6.0 2741 2446 A 97 TYR HE% A 109 VAL HB 1.0 2.0 6.0 2742 2447 A 109 VAL HGx% A 97 TYR HE% 1.0 1.9 4.5 2743 2448 A 109 VAL HGy% A 97 TYR HE% 1.0 2.0 5.4 2744 2449 A 97 TYR H A 64 ILE HA 1.0 2.0 5.6 2745 2450 A 97 TYR H A 96 THR HG2% 1.0 1.7 3.5 2746 2451 A 97 TYR HBy A 97 TYR H 1.0 1.7 3.3 2747 2452 A 98 PHE HA A 62 MET HA 1.0 1.7 3.1 2748 2453 A 98 PHE HA A 62 MET HBx 1.0 2.0 4.8 2749 2454 A 98 PHE HA A 62 MET HBy 1.0 2.0 5.6 2750 2455 A 98 PHE HA A 98 PHE HBx 1.0 1.8 3.8 2751 2456 A 98 PHE HBx A 98 PHE HBy 1.0 1.4 2.2 2752 2457 A 98 PHE HBx A 108 TYR HBy 1.0 2.0 5.4 2753 2457 A 98 PHE HBx A 108 TYR HBx 1.0 2.0 5.4 2754 2458 A 98 PHE HA A 98 PHE HBy 1.0 1.9 4.3 2755 2459 A 98 PHE HBy A 108 TYR HBy 1.0 1.8 3.8 2756 2459 A 98 PHE HBy A 108 TYR HBx 1.0 1.8 3.8 2757 2460 A 49 LEU HD1% A 98 PHE HD% 1.0 1.8 3.8 2758 2461 A 49 LEU HD2% A 98 PHE HD% 1.0 1.9 4.1 2759 2462 A 59 PHE HBx A 98 PHE HD% 1.0 2.0 6.0 2760 2463 A 59 PHE HBy A 98 PHE HD% 1.0 1.9 6.0 2761 2464 A 62 MET HBx A 98 PHE HD% 1.0 1.8 4.2 2762 2465 A 62 MET HBy A 98 PHE HD% 1.0 1.9 6.0 2763 2466 A 76 LEU HD1% A 98 PHE HD% 1.0 1.6 3.0 2764 2467 A 96 THR HG2% A 98 PHE HD% 1.0 2.0 4.8 2765 2468 A 97 TYR HA A 98 PHE HD% 1.0 1.9 4.1 2766 2469 A 98 PHE HA A 98 PHE HD% 1.0 2.0 4.8 2767 2470 A 98 PHE HBx A 98 PHE HD% 1.0 1.7 3.3 2768 2471 A 98 PHE HBy A 98 PHE HD% 1.0 1.7 3.5 2769 2472 A 98 PHE HD% A 108 TYR HBy 1.0 2.0 6.0 2770 2472 A 98 PHE HD% A 108 TYR HBx 1.0 2.0 6.0 2771 2473 A 110 ILE HD1% A 98 PHE HD% 1.0 0.0 6.0 2772 2474 A 49 LEU HA A 98 PHE HE% 1.0 1.5 6.0 2773 2475 A 49 LEU HBx A 98 PHE HE% 1.0 1.3 6.0 2774 2476 A 49 LEU HBy A 98 PHE HE% 1.0 1.8 6.0 2775 2477 A 62 MET HBx A 98 PHE HE% 1.0 1.9 4.3 2776 2478 A 62 MET HBy A 98 PHE HE% 1.0 2.0 5.4 2777 2479 A 62 MET HE% A 98 PHE HE% 1.0 2.0 5.6 2778 2480 A 76 LEU HD1% A 98 PHE HE% 1.0 1.8 3.6 2779 2481 A 76 LEU HD2% A 98 PHE HE% 1.0 2.0 4.8 2780 2482 A 96 THR HB A 98 PHE HE% 1.0 1.9 4.5 2781 2483 A 96 THR HG2% A 98 PHE HE% 1.0 1.8 3.4 2782 2484 A 98 PHE HBx A 98 PHE HE% 1.0 1.9 6.0 2783 2485 A 98 PHE HBy A 98 PHE HE% 1.0 2.0 6.0 2784 2486 A 110 ILE HB A 98 PHE HE% 1.0 1.6 2.8 2785 2487 A 110 ILE HD1% A 98 PHE HE% 1.0 1.6 3.0 2786 2488 A 110 ILE HG1x A 98 PHE HE% 1.0 1.8 3.6 2787 2489 A 110 ILE HG1y A 98 PHE HE% 1.0 1.9 6.0 2788 2490 A 98 PHE HA A 98 PHE H 1.0 1.8 3.8 2789 2491 A 98 PHE H A 106 SER HBy 1.0 2.0 6.0 2790 2492 A 98 PHE H A 108 TYR HBy 1.0 2.0 6.0 2791 2492 A 98 PHE H A 108 TYR HBx 1.0 2.0 6.0 2792 2493 A 98 PHE H A 109 VAL HA 1.0 2.0 5.2 2793 2494 A 45 LEU HBx A 98 PHE HZ 1.0 1.9 3.9 2794 2495 A 45 LEU HD1% A 98 PHE HZ 1.0 1.9 4.7 2795 2496 A 46 ARG HA A 98 PHE HZ 1.0 1.9 6.0 2796 2497 A 106 SER HA A 99 PHE HA 1.0 1.9 3.9 2797 2498 A 99 PHE HBx A 61 LYS HEx 1.0 2.0 6.0 2798 2499 A 61 LYS HGy A 99 PHE HBx 1.0 1.8 6.0 2799 2500 A 99 PHE HBx A 99 PHE HA 1.0 1.8 4.0 2800 2501 A 99 PHE HBy A 61 LYS HEx 1.0 2.0 5.4 2801 2502 A 61 LYS HEy A 99 PHE HBy 1.0 2.0 6.0 2802 2503 A 61 LYS HGx A 99 PHE HBy 1.0 1.8 3.6 2803 2504 A 61 LYS HGy A 99 PHE HBy 1.0 2.0 5.2 2804 2505 A 99 PHE HBy A 99 PHE HA 1.0 2.0 5.2 2805 2506 A 99 PHE HBx A 99 PHE HBy 1.0 1.5 2.3 2806 2507 A 61 LYS HBx A 99 PHE HD% 1.0 1.9 6.0 2807 2508 A 61 LYS HBy A 99 PHE HD% 1.0 1.7 6.0 2808 2509 A 61 LYS HDx A 99 PHE HD% 1.0 1.9 6.0 2809 2510 A 61 LYS HDy A 99 PHE HD% 1.0 2.0 6.0 2810 2511 A 99 PHE HD% A 61 LYS HEx 1.0 2.0 5.6 2811 2512 A 61 LYS HEy A 99 PHE HD% 1.0 2.0 6.0 2812 2513 A 61 LYS HGx A 99 PHE HD% 1.0 1.9 4.3 2813 2514 A 61 LYS HGy A 99 PHE HD% 1.0 2.0 5.8 2814 2515 A 99 PHE HD% A 62 MET HA 1.0 1.9 4.1 2815 2516 A 99 PHE HD% A 63 VAL HB 1.0 2.0 6.0 2816 2517 A 99 PHE HD% A 63 VAL HGx% 1.0 2.0 5.4 2817 2518 A 99 PHE HD% A 63 VAL HGy% 1.0 1.8 6.0 2818 2519 A 98 PHE HA A 99 PHE HD% 1.0 1.9 4.9 2819 2520 A 99 PHE HD% A 99 PHE HA 1.0 2.0 4.8 2820 2521 A 99 PHE HBx A 99 PHE HD% 1.0 1.8 3.6 2821 2522 A 99 PHE HBy A 99 PHE HD% 1.0 1.8 3.8 2822 2523 A 99 PHE HD% A 103 GLU HGy 1.0 1.9 6.0 2823 2523 A 99 PHE HD% A 103 GLU HGx 1.0 1.9 6.0 2824 2524 A 99 PHE HD% A 104 SER HA 1.0 1.9 4.9 2825 2525 A 99 PHE HD% A 105 LYS HA 1.0 2.0 6.0 2826 2526 A 99 PHE HD% A 106 SER HA 1.0 2.0 5.4 2827 2527 A 99 PHE HE% A 62 MET HA 1.0 1.9 6.0 2828 2528 A 63 VAL HB A 99 PHE HE% 1.0 1.9 4.1 2829 2529 A 63 VAL HGx% A 99 PHE HE% 1.0 1.7 3.3 2830 2530 A 63 VAL HGy% A 99 PHE HE% 1.0 1.9 6.0 2831 2531 A 99 PHE HBx A 99 PHE HE% 1.0 1.8 6.0 2832 2532 A 99 PHE HBy A 99 PHE HE% 1.0 1.9 6.0 2833 2533 A 99 PHE HE% A 104 SER HA 1.0 2.0 6.0 2834 2534 A 99 PHE HE% A 105 LYS HA 1.0 1.9 4.3 2835 2535 A 99 PHE HE% A 105 LYS HBx 1.0 1.9 6.0 2836 2535 A 99 PHE HE% A 105 LYS HBy 1.0 1.9 6.0 2837 2536 A 61 LYS HGx A 99 PHE H 1.0 1.9 5.5 2838 2537 A 99 PHE H A 62 MET HA 1.0 1.9 4.3 2839 2538 A 98 PHE HA A 99 PHE H 1.0 1.6 2.8 2840 2539 A 99 PHE HBy A 99 PHE H 1.0 1.8 3.6 2841 2540 A 63 VAL HGx% A 99 PHE HZ 1.0 2.0 5.8 2842 2541 A 59 PHE HA A 100 LYS HA 1.0 1.3 2.2 2843 2542 A 100 LYS HGx A 100 LYS HA 1.0 1.9 4.1 2844 2543 A 100 LYS HGy A 100 LYS HA 1.0 2.0 5.6 2845 2544 A 100 LYS HBx A 100 LYS HA 1.0 1.7 3.1 2846 2545 A 100 LYS HBx A 100 LYS HBy 1.0 1.3 2.2 2847 2546 A 100 LYS HBx A 100 LYS HGy 1.0 1.8 3.4 2848 2547 A 100 LYS HBx A 103 GLU HGy 1.0 2.0 6.0 2849 2547 A 100 LYS HBx A 103 GLU HGx 1.0 2.0 6.0 2850 2548 A 100 LYS HA A 100 LYS HBy 1.0 1.9 4.3 2851 2549 A 100 LYS HBy A 103 GLU HBy 1.0 1.9 4.7 2852 2549 A 100 LYS HBy A 103 GLU HBx 1.0 1.9 4.7 2853 2550 A 100 LYS HBy A 103 GLU HGy 1.0 1.9 4.7 2854 2550 A 100 LYS HBy A 103 GLU HGx 1.0 1.9 4.7 2855 2551 A 100 LYS HEx A 100 LYS HDx 1.0 1.8 3.4 2856 2552 A 100 LYS HEy A 100 LYS HDx 1.0 1.9 4.1 2857 2553 A 100 LYS HGx A 100 LYS HDx 1.0 1.8 3.4 2858 2554 A 100 LYS HGy A 100 LYS HDx 1.0 1.8 3.8 2859 2555 A 100 LYS HDy A 100 LYS HEy 1.0 1.8 3.4 2860 2556 A 100 LYS HGy A 100 LYS HDy 1.0 1.9 3.9 2861 2557 A 100 LYS HDy A 100 LYS HEx 1.0 1.8 3.6 2862 2558 A 100 LYS HEx A 100 LYS HEy 1.0 1.2 2.2 2863 2559 A 100 LYS HEx A 107 SER HBx 1.0 2.0 6.0 2864 2560 A 100 LYS HBx A 100 LYS HGx 1.0 1.8 3.8 2865 2561 A 100 LYS HGx A 100 LYS HBy 1.0 1.9 4.3 2866 2562 A 100 LYS HGx A 100 LYS HEx 1.0 1.9 4.7 2867 2563 A 100 LYS HGx A 100 LYS HEy 1.0 1.9 4.1 2868 2564 A 100 LYS HGx A 100 LYS HGy 1.0 1.4 2.2 2869 2565 A 100 LYS HGy A 58 GLN HGy 1.0 1.9 6.0 2870 2566 A 100 LYS HGy A 100 LYS HBy 1.0 1.9 4.5 2871 2567 A 100 LYS HGy A 100 LYS HEx 1.0 2.0 5.6 2872 2568 A 100 LYS HGy A 100 LYS HEy 1.0 1.9 4.1 2873 2569 A 99 PHE HBx A 100 LYS H 1.0 2.0 5.8 2874 2570 A 100 LYS HBx A 100 LYS H 1.0 2.0 6.0 2875 2571 A 100 LYS H A 100 LYS HDx 1.0 2.0 5.8 2876 2572 A 100 LYS HGx A 100 LYS H 1.0 2.0 5.0 2877 2573 A 100 LYS HGy A 100 LYS H 1.0 2.0 6.0 2878 2574 A 100 LYS H A 103 GLU HBy 1.0 2.0 5.0 2879 2574 A 100 LYS H A 103 GLU HBx 1.0 2.0 5.0 2880 2575 A 100 LYS H A 103 GLU HGy 1.0 2.0 6.0 2881 2575 A 100 LYS H A 103 GLU HGx 1.0 2.0 6.0 2882 2576 A 60 GLU HGx A 101 LYS HA 1.0 2.0 6.0 2883 2577 A 60 GLU HGy A 101 LYS HA 1.0 1.9 6.0 2884 2578 A 101 LYS HA A 101 LYS HBx 1.0 1.7 2.9 2885 2578 A 101 LYS HA A 101 LYS HBy 1.0 1.7 2.9 2886 2579 A 101 LYS HA A 101 LYS HDx 1.0 2.0 5.8 2887 2579 A 101 LYS HA A 101 LYS HDy 1.0 2.0 5.8 2888 2580 A 101 LYS HA A 101 LYS HGy 1.0 1.8 3.6 2889 2580 A 101 LYS HA A 101 LYS HGx 1.0 1.8 3.6 2890 2581 A 101 LYS H A 58 GLN HA 1.0 2.0 6.0 2891 2582 A 60 GLU HGx A 101 LYS H 1.0 1.9 6.0 2892 2583 A 101 LYS HA A 101 LYS H 1.0 1.8 3.4 2893 2584 A 101 LYS H A 101 LYS HBx 1.0 1.6 2.6 2894 2584 A 101 LYS H A 101 LYS HBy 1.0 1.6 2.6 2895 2585 A 101 LYS H A 101 LYS HGy 1.0 2.0 6.0 2896 2585 A 101 LYS H A 101 LYS HGx 1.0 2.0 6.0 2897 2586 A 101 LYS HA A 102 GLY H 1.0 1.5 2.5 2898 2587 A 101 LYS HGy A 102 GLY H 1.0 1.9 4.5 2899 2587 A 101 LYS HGx A 102 GLY H 1.0 1.9 4.5 2900 2588 A 103 GLU HBx A 103 GLU HA 1.0 1.7 3.3 2901 2589 A 103 GLU HBy A 103 GLU HA 1.0 1.8 3.8 2902 2590 A 103 GLU H A 103 GLU HA 1.0 1.9 4.1 2903 2591 A 103 GLU HBy A 103 GLU H 1.0 1.9 3.9 2904 2591 A 103 GLU HBx A 103 GLU H 1.0 1.9 3.9 2905 2592 A 103 GLU H A 103 GLU HGy 1.0 1.9 4.3 2906 2592 A 103 GLU H A 103 GLU HGx 1.0 1.9 4.3 2907 2593 A 104 SER HBx A 104 SER HA 1.0 1.8 3.6 2908 2594 A 104 SER HA A 104 SER HBy 1.0 1.8 3.6 2909 2595 A 104 SER HBx A 104 SER HBy 1.0 1.3 2.2 2910 2596 A 104 SER H A 103 GLU HA 1.0 1.7 2.9 2911 2597 A 103 GLU HBy A 104 SER H 1.0 2.0 5.2 2912 2597 A 103 GLU HBx A 104 SER H 1.0 2.0 5.2 2913 2598 A 104 SER H A 103 GLU HGy 1.0 2.0 6.0 2914 2598 A 104 SER H A 103 GLU HGx 1.0 2.0 6.0 2915 2599 A 104 SER H A 104 SER HA 1.0 1.9 4.3 2916 2600 A 104 SER H A 104 SER HBy 1.0 2.0 4.6 2917 2601 A 105 LYS HA A 105 LYS HBx 1.0 1.8 3.6 2918 2601 A 105 LYS HA A 105 LYS HBy 1.0 1.8 3.6 2919 2602 A 105 LYS HA A 105 LYS HGx 1.0 2.0 5.2 2920 2603 A 105 LYS HA A 105 LYS HGy 1.0 2.0 4.8 2921 2604 A 105 LYS HA A 105 LYS HBx 1.0 2.0 4.4 2922 2605 A 105 LYS HA A 105 LYS HBy 1.0 1.9 4.1 2923 2606 A 105 LYS HBx A 105 LYS HEy 1.0 2.0 5.4 2924 2606 A 105 LYS HEx A 105 LYS HBx 1.0 2.0 5.4 2925 2606 A 105 LYS HBy A 105 LYS HEy 1.0 2.0 5.4 2926 2606 A 105 LYS HBy A 105 LYS HEx 1.0 2.0 5.4 2927 2607 A 105 LYS HGx A 105 LYS HEy 1.0 1.9 4.1 2928 2607 A 105 LYS HGx A 105 LYS HEx 1.0 1.9 4.1 2929 2608 A 105 LYS HGy A 105 LYS HEy 1.0 1.9 4.1 2930 2608 A 105 LYS HGy A 105 LYS HEx 1.0 1.9 4.1 2931 2609 A 105 LYS HGx A 105 LYS HBx 1.0 1.7 3.3 2932 2609 A 105 LYS HGx A 105 LYS HBy 1.0 1.7 3.3 2933 2610 A 105 LYS HGy A 105 LYS HBx 1.0 1.8 3.6 2934 2610 A 105 LYS HGy A 105 LYS HBy 1.0 1.8 3.6 2935 2611 A 105 LYS H A 103 GLU HA 1.0 2.0 6.0 2936 2612 A 103 GLU HBy A 105 LYS H 1.0 1.9 4.7 2937 2612 A 103 GLU HBx A 105 LYS H 1.0 1.9 4.7 2938 2613 A 105 LYS H A 103 GLU HGy 1.0 2.0 6.0 2939 2613 A 105 LYS H A 103 GLU HGx 1.0 2.0 6.0 2940 2614 A 105 LYS H A 105 LYS HBx 1.0 1.7 3.5 2941 2614 A 105 LYS H A 105 LYS HBy 1.0 1.7 3.5 2942 2615 A 106 SER HA A 106 SER HBx 1.0 1.9 4.5 2943 2616 A 106 SER HA A 106 SER HBy 1.0 1.8 4.2 2944 2617 A 106 SER HBx A 106 SER HBy 1.0 1.6 2.8 2945 2618 A 106 SER H A 105 LYS HBx 1.0 1.9 5.1 2946 2618 A 106 SER H A 105 LYS HBy 1.0 1.9 5.1 2947 2619 A 106 SER HA A 107 SER HA 1.0 2.0 6.0 2948 2620 A 107 SER HA A 107 SER HBx 1.0 1.9 4.1 2949 2621 A 107 SER HA A 107 SER HBy 1.0 1.9 4.1 2950 2622 A 109 VAL HGy% A 107 SER HA 1.0 0.0 6.0 2951 2623 A 108 TYR HA A 108 TYR HBy 1.0 1.9 4.3 2952 2623 A 108 TYR HA A 108 TYR HBx 1.0 1.9 4.3 2953 2624 A 53 THR HG2% A 108 TYR HD% 1.0 2.0 6.0 2954 2625 A 108 TYR HD% A 108 TYR HBy 1.0 1.9 4.7 2955 2625 A 108 TYR HD% A 108 TYR HBx 1.0 1.9 4.7 2956 2626 A 49 LEU HA A 108 TYR HE% 1.0 2.0 6.0 2957 2627 A 49 LEU HD2% A 108 TYR HE% 1.0 1.8 4.0 2958 2628 A 53 THR HG2% A 108 TYR HE% 1.0 1.8 3.8 2959 2629 A 110 ILE HD1% A 108 TYR HE% 1.0 1.8 3.4 2960 2630 A 110 ILE HG1x A 108 TYR HE% 1.0 1.9 4.3 2961 2631 A 110 ILE HG1y A 108 TYR HE% 1.0 2.0 5.4 2962 2632 A 98 PHE HBx A 108 TYR H 1.0 2.0 6.0 2963 2633 A 108 TYR H A 107 SER HA 1.0 2.0 5.0 2964 2634 A 108 TYR H A 107 SER HBx 1.0 1.9 5.3 2965 2635 A 108 TYR H A 107 SER HBy 1.0 2.0 5.8 2966 2636 A 108 TYR H A 108 TYR HA 1.0 1.8 3.8 2967 2637 A 109 VAL HB A 109 VAL HA 1.0 1.8 3.6 2968 2638 A 109 VAL HGx% A 109 VAL HA 1.0 1.7 3.3 2969 2639 A 109 VAL HGy% A 109 VAL HA 1.0 1.8 3.6 2970 2640 A 109 VAL HGx% A 109 VAL HB 1.0 1.6 3.0 2971 2641 A 109 VAL HGy% A 109 VAL HB 1.0 1.7 3.1 2972 2642 A 95 LYS HA A 109 VAL HGy% 1.0 2.0 6.0 2973 2642 A 95 LYS HA A 109 VAL HGx% 1.0 2.0 6.0 2974 2643 A 95 LYS HBx A 109 VAL HGy% 1.0 2.0 5.8 2975 2643 A 95 LYS HBx A 109 VAL HGx% 1.0 2.0 5.8 2976 2644 A 95 LYS HBy A 109 VAL HGy% 1.0 2.0 6.0 2977 2644 A 95 LYS HBy A 109 VAL HGx% 1.0 2.0 6.0 2978 2645 A 95 LYS HDx A 109 VAL HGy% 1.0 1.9 4.5 2979 2645 A 95 LYS HDx A 109 VAL HGx% 1.0 1.9 4.5 2980 2646 A 95 LYS HDy A 109 VAL HGy% 1.0 1.9 4.5 2981 2646 A 95 LYS HDy A 109 VAL HGx% 1.0 1.9 4.5 2982 2647 A 109 VAL HGy% A 95 LYS HEy 1.0 2.0 6.0 2983 2647 A 109 VAL HGx% A 95 LYS HEy 1.0 2.0 6.0 2984 2648 A 109 VAL HGy% A 97 TYR HA 1.0 1.9 4.9 2985 2648 A 109 VAL HGx% A 97 TYR HA 1.0 1.9 4.9 2986 2649 A 109 VAL HGy% A 108 TYR HA 1.0 1.9 6.0 2987 2649 A 109 VAL HGx% A 108 TYR HA 1.0 1.9 6.0 2988 2650 A 109 VAL HGy% A 109 VAL HA 1.0 1.8 3.6 2989 2650 A 109 VAL HGx% A 109 VAL HA 1.0 1.8 3.6 2990 2651 A 109 VAL HGy% A 109 VAL HB 1.0 1.6 2.8 2991 2651 A 109 VAL HGx% A 109 VAL HB 1.0 1.6 2.8 2992 2652 A 109 VAL H A 108 TYR HBy 1.0 1.9 6.0 2993 2652 A 109 VAL H A 108 TYR HBx 1.0 1.9 6.0 2994 2653 A 109 VAL HGx% A 109 VAL H 1.0 2.0 6.0 2995 2654 A 109 VAL HGy% A 109 VAL H 1.0 1.8 3.6 2996 2655 A 109 VAL HGy% A 110 ILE HA 1.0 1.8 6.0 2997 2656 A 110 ILE HD1% A 110 ILE HA 1.0 1.9 6.0 2998 2657 A 110 ILE HA A 110 ILE HG1x 1.0 2.0 4.8 2999 2658 A 110 ILE HA A 110 ILE HG1y 1.0 1.8 3.8 3000 2659 A 110 ILE HG2% A 110 ILE HA 1.0 1.8 3.6 3001 2660 A 110 ILE HB A 110 ILE HA 1.0 1.9 4.9 3002 2661 A 110 ILE HD1% A 110 ILE HB 1.0 1.8 3.4 3003 2662 A 110 ILE HB A 110 ILE HG1y 1.0 2.0 5.2 3004 2663 A 45 LEU HA A 110 ILE HD1% 1.0 1.9 4.3 3005 2664 A 48 TYR HBy A 110 ILE HD1% 1.0 1.9 5.1 3006 2665 A 110 ILE HD1% A 49 LEU HD1% 1.0 2.0 5.6 3007 2666 A 110 ILE HD1% A 110 ILE HG2% 1.0 1.6 2.8 3008 2667 A 49 LEU HD1% A 110 ILE HG1x 1.0 1.8 6.0 3009 2668 A 110 ILE HD1% A 110 ILE HG1x 1.0 1.6 3.0 3010 2669 A 110 ILE HG1x A 110 ILE HG1y 1.0 1.5 2.5 3011 2670 A 110 ILE HG2% A 110 ILE HG1x 1.0 2.0 6.0 3012 2671 A 110 ILE HD1% A 110 ILE HG1y 1.0 1.5 2.5 3013 2672 A 110 ILE HG2% A 93 MET HE% 1.0 1.6 2.8 3014 2673 A 110 ILE HG2% A 110 ILE HB 1.0 1.6 2.8 3015 2674 A 110 ILE H A 109 VAL HA 1.0 1.6 2.6 3016 2675 A 110 ILE H A 109 VAL HB 1.0 2.0 6.0 3017 2676 A 109 VAL HGx% A 110 ILE H 1.0 1.7 3.3 3018 2677 A 109 VAL HGy% A 110 ILE H 1.0 2.0 6.0 3019 2678 A 110 ILE HD1% A 110 ILE H 1.0 1.9 4.1 3020 2679 A 111 ASN HBx A 111 ASN HA 1.0 1.8 3.6 3021 2680 A 111 ASN HBy A 111 ASN HA 1.0 2.0 5.0 3022 2681 A 109 VAL HGy% A 111 ASN HD2y 1.0 1.8 6.0 3023 2682 A 111 ASN HD2y A 111 ASN HBx 1.0 1.9 4.5 3024 2683 A 111 ASN HD2y A 111 ASN HBy 1.0 2.0 5.2 3025 2684 A 95 LYS HEy A 111 ASN HD2x 1.0 1.9 5.3 3026 2685 A 109 VAL HGy% A 111 ASN HD2x 1.0 1.9 6.0 3027 2686 A 111 ASN HD2x A 111 ASN HBx 1.0 2.0 6.0 3028 2687 A 93 MET HE% A 111 ASN H 1.0 2.0 5.8 3029 2688 A 110 ILE HG1y A 111 ASN H 1.0 1.7 6.0 3030 2689 A 111 ASN H A 111 ASN HA 1.0 1.8 4.2 3031 2690 A 113 PRO HDx A 112 GLY HAx 1.0 1.9 4.3 3032 2691 A 113 PRO HDy A 112 GLY HAx 1.0 1.7 3.1 3033 2692 A 93 MET HE% A 112 GLY HAy 1.0 2.0 5.0 3034 2693 A 94 TYR HA A 112 GLY HAy 1.0 2.0 6.0 3035 2694 A 112 GLY HAy A 112 GLY HAx 1.0 1.5 2.3 3036 2695 A 113 PRO HDx A 112 GLY HAy 1.0 1.9 3.9 3037 2696 A 113 PRO HDy A 112 GLY HAy 1.0 2.0 4.8 3038 2697 A 93 MET HE% A 112 GLY H 1.0 2.0 5.2 3039 2698 A 94 TYR HA A 112 GLY H 1.0 2.0 5.2 3040 2699 A 112 GLY H A 111 ASN HA 1.0 1.6 2.8 3041 2700 A 112 GLY H A 111 ASN HBx 1.0 1.9 4.1 3042 2701 A 112 GLY H A 112 GLY HAx 1.0 1.8 3.6 3043 2702 A 113 PRO HA A 113 PRO HBx 1.0 1.5 2.7 3044 2703 A 113 PRO HA A 113 PRO HBy 1.0 1.7 3.3 3045 2704 A 113 PRO HA A 113 PRO HGx 1.0 2.0 6.0 3046 2705 A 113 PRO HA A 113 PRO HGy 1.0 2.0 6.0 3047 2706 A 113 PRO HDx A 113 PRO HBx 1.0 1.9 4.9 3048 2707 A 113 PRO HDy A 113 PRO HBx 1.0 2.0 5.8 3049 2708 A 113 PRO HDx A 113 PRO HBy 1.0 2.0 6.0 3050 2709 A 113 PRO HDy A 113 PRO HBy 1.0 2.0 6.0 3051 2710 A 113 PRO HBy A 113 PRO HGx 1.0 1.7 3.3 3052 2711 A 113 PRO HDx A 93 MET HE% 1.0 2.0 6.0 3053 2712 A 113 PRO HDx A 113 PRO HGx 1.0 1.8 3.4 3054 2713 A 113 PRO HDx A 113 PRO HGy 1.0 1.9 4.5 3055 2714 A 113 PRO HDy A 93 MET HE% 1.0 1.8 4.0 3056 2715 A 113 PRO HDy A 113 PRO HGx 1.0 1.9 3.9 3057 2716 A 113 PRO HDy A 113 PRO HGy 1.0 1.7 3.3 3058 2717 A 112 GLY HAy A 113 PRO HGx 1.0 1.3 6.0 3059 2718 A 92 LYS HDx A 114 GLY HAx 1.0 1.9 6.0 3060 2718 A 92 LYS HDy A 114 GLY HAx 1.0 1.9 6.0 3061 2719 A 94 TYR HA A 114 GLY HAx 1.0 1.9 4.5 3062 2720 A 114 GLY HAx A 114 GLY HAy 1.0 1.4 2.2 3063 2721 A 67 GLU HGx A 114 GLY HAy 1.0 1.9 4.3 3064 2722 A 67 GLU HGy A 114 GLY HAy 1.0 1.9 4.9 3065 2723 A 92 LYS HDx A 114 GLY HAy 1.0 1.8 6.0 3066 2723 A 92 LYS HDy A 114 GLY HAy 1.0 1.8 6.0 3067 2724 A 94 TYR HA A 114 GLY HAy 1.0 2.0 6.0 3068 2725 A 92 LYS HDx A 114 GLY H 1.0 1.8 6.0 3069 2725 A 92 LYS HDy A 114 GLY H 1.0 1.8 6.0 3070 2726 A 94 TYR HA A 114 GLY H 1.0 1.9 4.5 3071 2727 A 114 GLY H A 112 GLY HAx 1.0 2.0 6.0 3072 2728 A 112 GLY HAy A 114 GLY H 1.0 2.0 6.0 3073 2729 A 113 PRO HDx A 114 GLY H 1.0 0.0 6.0 3074 2730 A 114 GLY H A 113 PRO HGx 1.0 1.9 6.0 3075 2731 A 115 LYS HDx A 115 LYS HA 1.0 1.9 4.5 3076 2731 A 115 LYS HDy A 115 LYS HA 1.0 1.9 4.5 3077 2732 A 115 LYS HA A 115 LYS HGx 1.0 1.8 3.6 3078 2732 A 115 LYS HA A 115 LYS HGy 1.0 1.8 3.6 3079 2733 A 113 PRO HA A 115 LYS HBx 1.0 1.8 6.0 3080 2734 A 115 LYS HA A 115 LYS HBx 1.0 1.8 3.6 3081 2735 A 115 LYS HBy A 115 LYS HBx 1.0 1.3 2.2 3082 2736 A 115 LYS HBy A 115 LYS HA 1.0 1.7 3.1 3083 2737 A 116 THR HG2% A 115 LYS HBy 1.0 1.7 3.5 3084 2738 A 115 LYS HDx A 115 LYS HEy 1.0 1.7 3.1 3085 2738 A 115 LYS HDx A 115 LYS HEx 1.0 1.7 3.1 3086 2738 A 115 LYS HDy A 115 LYS HEx 1.0 1.7 3.1 3087 2738 A 115 LYS HDy A 115 LYS HEy 1.0 1.7 3.1 3088 2739 A 115 LYS HEx A 115 LYS HGx 1.0 1.7 3.5 3089 2739 A 115 LYS HEy A 115 LYS HGx 1.0 1.7 3.5 3090 2739 A 115 LYS HEx A 115 LYS HGy 1.0 1.7 3.5 3091 2739 A 115 LYS HEy A 115 LYS HGy 1.0 1.7 3.5 3092 2740 A 115 LYS HGx A 115 LYS HBx 1.0 1.6 3.0 3093 2740 A 115 LYS HGy A 115 LYS HBx 1.0 1.6 3.0 3094 2741 A 115 LYS HBy A 115 LYS HGx 1.0 1.7 3.3 3095 2741 A 115 LYS HBy A 115 LYS HGy 1.0 1.7 3.3 3096 2742 A 114 GLY HAx A 115 LYS H 1.0 1.8 3.4 3097 2743 A 114 GLY HAy A 115 LYS H 1.0 1.9 4.7 3098 2744 A 115 LYS H A 115 LYS HA 1.0 1.8 3.6 3099 2745 A 115 LYS H A 115 LYS HBx 1.0 2.0 4.8 3100 2746 A 115 LYS H A 115 LYS HBy 1.0 1.8 4.0 3101 2747 A 115 LYS H A 115 LYS HGx 1.0 2.0 5.2 3102 2747 A 115 LYS H A 115 LYS HGy 1.0 2.0 5.2 3103 2748 A 116 THR HG2% A 116 THR HA 1.0 1.9 5.1 3104 2749 A 116 THR HB A 116 THR HA 1.0 1.8 3.4 3105 2750 A 116 THR HG2% A 116 THR HB 1.0 1.6 2.8 3106 2751 A 67 GLU HGy A 116 THR HG2% 1.0 2.0 5.4 3107 2752 A 116 THR HG2% A 115 LYS HBx 1.0 2.0 4.6 3108 2753 A 116 THR HG2% A 118 GLU HBx 1.0 2.0 6.0 3109 2754 A 116 THR HG2% A 118 GLU HBy 1.0 2.0 4.6 3110 2755 A 116 THR HG2% A 118 GLU HGx 1.0 2.0 6.0 3111 2756 A 116 THR HG2% A 118 GLU HGy 1.0 2.0 6.0 3112 2757 A 116 THR HG2% A 120 ALA HA 1.0 2.0 4.4 3113 2758 A 67 GLU HGx A 116 THR H 1.0 2.0 5.8 3114 2759 A 114 GLY HAx A 116 THR H 1.0 2.0 5.6 3115 2760 A 116 THR H A 115 LYS HA 1.0 1.9 3.9 3116 2761 A 116 THR H A 115 LYS HBx 1.0 1.9 4.3 3117 2762 A 115 LYS HDx A 116 THR H 1.0 0.0 6.0 3118 2762 A 115 LYS HDy A 116 THR H 1.0 0.0 6.0 3119 2763 A 116 THR H A 115 LYS HGx 1.0 2.0 5.6 3120 2763 A 116 THR H A 115 LYS HGy 1.0 2.0 5.6 3121 2764 A 116 THR H A 116 THR HA 1.0 1.9 4.5 3122 2765 A 116 THR HG2% A 116 THR H 1.0 1.8 3.6 3123 2766 A 65 LEU HD1% A 117 ASN HBx 1.0 2.0 6.0 3124 2767 A 117 ASN HA A 117 ASN HBx 1.0 1.7 3.1 3125 2768 A 117 ASN HBx A 117 ASN HBy 1.0 1.3 2.2 3126 2769 A 65 LEU HD1% A 117 ASN HBy 1.0 2.0 5.8 3127 2770 A 65 LEU HD2% A 117 ASN HBy 1.0 2.0 5.6 3128 2771 A 116 THR HG2% A 117 ASN HBy 1.0 2.0 6.0 3129 2772 A 117 ASN HA A 117 ASN HBy 1.0 1.8 4.0 3130 2773 A 65 LEU HD2% A 117 ASN HD2y 1.0 1.9 6.0 3131 2774 A 117 ASN HD2y A 69 LYS HA 1.0 2.0 5.8 3132 2775 A 117 ASN HD2y A 117 ASN HA 1.0 1.4 2.2 3133 2776 A 117 ASN HD2y A 117 ASN HBx 1.0 2.0 4.4 3134 2777 A 117 ASN HD2y A 117 ASN HBy 1.0 2.0 5.8 3135 2778 A 117 ASN HD2x A 69 LYS HA 1.0 2.0 6.0 3136 2779 A 117 ASN HD2x A 117 ASN HA 1.0 2.0 5.2 3137 2780 A 117 ASN HD2x A 117 ASN HBx 1.0 1.9 4.9 3138 2781 A 117 ASN HD2x A 117 ASN HBy 1.0 2.0 5.0 3139 2782 A 117 ASN H A 117 ASN HBx 1.0 2.0 5.6 3140 2783 A 117 ASN H A 117 ASN HBy 1.0 1.8 3.4 3141 2784 A 69 LYS HGx A 118 GLU HA 1.0 1.8 3.6 3142 2785 A 118 GLU HA A 118 GLU HBx 1.0 1.8 3.4 3143 2786 A 118 GLU HA A 118 GLU HGx 1.0 2.0 5.2 3144 2787 A 118 GLU HA A 118 GLU HGy 1.0 1.9 4.1 3145 2788 A 118 GLU HA A 118 GLU HBy 1.0 1.9 4.1 3146 2789 A 118 GLU HBx A 118 GLU HBy 1.0 1.4 2.2 3147 2790 A 118 GLU HBy A 118 GLU HGx 1.0 1.7 3.3 3148 2791 A 118 GLU HBy A 118 GLU HGy 1.0 1.8 3.8 3149 2792 A 118 GLU HGx A 118 GLU HGy 1.0 1.4 2.2 3150 2793 A 116 THR HB A 118 GLU H 1.0 1.9 6.0 3151 2794 A 119 TYR HA A 119 TYR HBx 1.0 1.8 3.4 3152 2795 A 119 TYR HA A 119 TYR HBy 1.0 1.9 3.9 3153 2796 A 120 ALA HB% A 119 TYR HA 1.0 2.0 6.0 3154 2797 A 68 ASN HA A 119 TYR HD% 1.0 2.0 5.2 3155 2798 A 69 LYS HDx A 119 TYR HD% 1.0 2.0 6.0 3156 2798 A 69 LYS HDy A 119 TYR HD% 1.0 2.0 6.0 3157 2799 A 69 LYS HEx A 119 TYR HD% 1.0 0.0 6.0 3158 2799 A 69 LYS HEy A 119 TYR HD% 1.0 0.0 6.0 3159 2800 A 119 TYR HA A 119 TYR HD% 1.0 1.8 4.0 3160 2801 A 119 TYR HBx A 119 TYR HD% 1.0 1.8 3.8 3161 2802 A 119 TYR HBy A 119 TYR HD% 1.0 1.9 3.9 3162 2803 A 69 LYS HEx A 119 TYR H 1.0 0.0 6.0 3163 2803 A 69 LYS HEy A 119 TYR H 1.0 0.0 6.0 3164 2804 A 120 ALA HB% A 120 ALA HA 1.0 1.6 2.8 3165 2805 A 120 ALA HB% A 67 GLU HBx 1.0 1.9 4.3 3166 2805 A 120 ALA HB% A 67 GLU HBy 1.0 1.9 4.3 3167 2806 A 116 THR HG2% A 120 ALA HB% 1.0 1.8 3.8 3168 2807 A 121 TYR HA A 121 TYR HBx 1.0 1.8 3.8 3169 2808 A 121 TYR HA A 121 TYR HBy 1.0 1.8 3.4 3170 2809 A 121 TYR HBx A 121 TYR HBy 1.0 1.2 2.2 3171 2810 A 121 TYR HA A 121 TYR HD% 1.0 2.0 5.6 3172 2811 A 121 TYR HBx A 121 TYR HD% 1.0 1.9 4.1 3173 2812 A 121 TYR HBy A 121 TYR HD% 1.0 1.9 4.1 3174 2813 A 38 LEU H A 87 VAL HGx% 1.0 1.7 3.1 3175 2813 A 38 LEU H A 37 THR HG2% 1.0 1.7 3.1 3176 2814 A 38 LEU H A 80 LEU HD2% 1.0 1.9 6.0 3177 2814 A 38 LEU H A 45 LEU HD1% 1.0 1.9 6.0 3178 2814 A 38 LEU H A 41 LEU HD2% 1.0 1.9 6.0 3179 2815 A 40 LYS H A 45 LEU HD1% 1.0 1.6 6.0 3180 2815 A 40 LYS H A 41 LEU HD2% 1.0 1.6 6.0 3181 2816 A 43 GLU H A 44 ARG HBx 1.0 2.0 6.0 3182 2816 A 40 LYS HBy A 43 GLU H 1.0 2.0 6.0 3183 2817 A 47 ASN H A 76 LEU HD1% 1.0 2.0 6.0 3184 2817 A 47 ASN H A 76 LEU HD2% 1.0 2.0 6.0 3185 2817 A 47 ASN H A 45 LEU HD2% 1.0 2.0 6.0 3186 2817 A 47 ASN H A 45 LEU HD1% 1.0 2.0 6.0 3187 2818 A 76 LEU HD2% A 63 VAL H 1.0 1.8 6.0 3188 2818 A 76 LEU HD1% A 63 VAL H 1.0 1.8 6.0 3189 2818 A 63 VAL H A 73 THR HG2% 1.0 1.8 6.0 3190 2818 A 45 LEU HD1% A 63 VAL H 1.0 1.8 6.0 3191 2819 A 63 VAL H A 65 LEU HD1% 1.0 2.0 6.0 3192 2819 A 63 VAL H A 64 ILE HG1y 1.0 2.0 6.0 3193 2819 A 61 LYS HGx A 63 VAL H 1.0 2.0 6.0 3194 2820 A 70 GLY H A 69 LYS HGx 1.0 2.0 6.0 3195 2820 A 66 THR HG2% A 70 GLY H 1.0 2.0 6.0 3196 2820 A 70 GLY H A 90 LEU HD2% 1.0 2.0 6.0 3197 2821 A 73 THR HA A 73 THR H 1.0 1.6 2.6 3198 2821 A 72 TYR HA A 73 THR H 1.0 1.6 2.6 3199 2822 A 76 LEU H A 76 LEU HA 1.0 1.5 2.7 3200 2822 A 75 TYR HA A 76 LEU H 1.0 1.5 2.7 3201 2823 A 92 LYS H A 92 LYS HA 1.0 1.6 3.0 3202 2823 A 92 LYS H A 91 GLY HAx 1.0 1.6 3.0 3203 2823 A 66 THR HB A 92 LYS H 1.0 1.6 3.0 3204 2824 A 92 LYS H A 113 PRO HGy 1.0 1.8 6.0 3205 2824 A 92 LYS H A 93 MET HBy 1.0 1.8 6.0 3206 2825 A 38 LEU HA A 41 LEU HD1% 1.0 2.0 6.0 3207 2825 A 38 LEU HA A 38 LEU HD1% 1.0 2.0 6.0 3208 2826 A 42 ASP HBx A 76 LEU HD2% 1.0 1.7 6.0 3209 2826 A 42 ASP HBx A 45 LEU HD1% 1.0 1.7 6.0 3210 2827 A 42 ASP HBy A 45 LEU HD1% 1.0 2.0 6.0 3211 2827 A 41 LEU HD2% A 42 ASP HBy 1.0 2.0 6.0 3212 2828 A 43 GLU HA A 46 ARG HBx 1.0 1.9 5.1 3213 2828 A 43 GLU HA A 45 LEU HBx 1.0 1.9 5.1 3214 2829 A 45 LEU HD1% A 64 ILE HB 1.0 1.6 3.0 3215 2829 A 45 LEU HD1% A 45 LEU HBx 1.0 1.6 3.0 3216 2830 A 76 LEU HD2% A 49 LEU HD2% 1.0 2.0 5.8 3217 2830 A 49 LEU HD2% A 110 ILE HG1y 1.0 2.0 5.8 3218 2830 A 76 LEU HD1% A 49 LEU HD2% 1.0 2.0 5.8 3219 2830 A 45 LEU HD2% A 49 LEU HD2% 1.0 2.0 5.8 3220 2831 A 49 LEU HD2% A 98 PHE HZ 1.0 1.8 4.0 3221 2831 A 49 LEU HD2% A 98 PHE HE% 1.0 1.8 4.0 3222 2831 A 49 LEU HD2% A 59 PHE HZ 1.0 1.8 4.0 3223 2831 A 48 TYR HD% A 49 LEU HD2% 1.0 1.8 4.0 3224 2832 A 76 LEU HD1% A 59 PHE HA 1.0 2.0 6.0 3225 2832 A 58 GLN HGy A 59 PHE HA 1.0 2.0 6.0 3226 2833 A 61 LYS HGx A 74 VAL H 1.0 1.8 6.0 3227 2833 A 60 GLU H A 61 LYS HGx 1.0 1.8 6.0 3228 2834 A 96 THR HG2% A 62 MET HA 1.0 2.0 6.0 3229 2834 A 64 ILE HD1% A 62 MET HA 1.0 2.0 6.0 3230 2835 A 64 ILE HA A 95 LYS HBx 1.0 1.9 6.0 3231 2835 A 64 ILE HA A 65 LEU HD2% 1.0 1.9 6.0 3232 2835 A 45 LEU HD1% A 64 ILE HA 1.0 1.9 6.0 3233 2836 A 42 ASP HBy A 64 ILE HD1% 1.0 2.0 5.4 3234 2836 A 64 ILE HD1% A 62 MET HGx 1.0 2.0 5.4 3235 2836 A 64 ILE HD1% A 93 MET HGy 1.0 2.0 5.4 3236 2836 A 64 ILE HD1% A 93 MET HGx 1.0 2.0 5.4 3237 2837 A 64 ILE HG2% A 93 MET HA 1.0 2.0 6.0 3238 2837 A 38 LEU HA A 64 ILE HG2% 1.0 2.0 6.0 3239 2838 A 65 LEU HA A 117 ASN HD2x 1.0 2.0 5.8 3240 2838 A 65 LEU HA A 97 TYR HD% 1.0 2.0 5.8 3241 2838 A 65 LEU HA A 94 TYR HD% 1.0 2.0 5.8 3242 2839 A 65 LEU HA A 72 TYR HD% 1.0 2.0 6.0 3243 2839 A 65 LEU HA A 70 GLY H 1.0 2.0 6.0 3244 2840 A 85 LYS HBx A 83 ASP HBy 1.0 0.0 6.0 3245 2840 A 85 LYS HBx A 72 TYR HBy 1.0 0.0 6.0 3246 2840 A 85 LYS HBy A 83 ASP HBy 1.0 0.0 6.0 3247 2840 A 85 LYS HBy A 72 TYR HBy 1.0 0.0 6.0 3248 2841 A 89 LEU HD1% A 92 LYS HA 1.0 2.0 5.8 3249 2841 A 89 LEU HD1% A 91 GLY HAx 1.0 2.0 5.8 3250 2841 A 89 LEU HD1% A 90 LEU HA 1.0 2.0 5.8 3251 2841 A 89 LEU HD1% A 66 THR HB 1.0 2.0 5.8 3252 2842 A 68 ASN H A 91 GLY HAx 1.0 2.0 5.2 3253 2842 A 67 GLU H A 91 GLY HAx 1.0 2.0 5.2 3254 2843 A 93 MET HA A 92 LYS HA 1.0 2.0 4.6 3255 2843 A 66 THR HB A 93 MET HA 1.0 2.0 4.6 3256 2844 A 96 THR HA A 93 MET HE% 1.0 2.0 6.0 3257 2844 A 96 THR HA A 65 LEU HG 1.0 2.0 6.0 3258 2845 A 96 THR HB A 110 ILE HG1y 1.0 2.0 5.0 3259 2845 A 45 LEU HD2% A 96 THR HB 1.0 2.0 5.0 3260 2845 A 45 LEU HD1% A 96 THR HB 1.0 2.0 5.0 3261 2846 A 100 LYS HBx A 59 PHE HD% 1.0 1.7 6.0 3262 2846 A 58 GLN HE2y A 100 LYS HBx 1.0 1.7 6.0 3263 2847 A 100 LYS HBx A 103 GLU HGy 1.0 2.0 4.8 3264 2847 A 100 LYS HBx A 103 GLU HBy 1.0 2.0 4.8 3265 2847 A 58 GLN HGx A 100 LYS HBx 1.0 2.0 4.8 3266 2848 A 100 LYS HBy A 103 GLU HGy 1.0 1.9 4.1 3267 2848 A 100 LYS HBy A 103 GLU HBy 1.0 1.9 4.1 3268 2848 A 58 GLN HGx A 100 LYS HBy 1.0 1.9 4.1 3269 2849 A 110 ILE HD1% A 93 MET HE% 1.0 0.0 6.0 3270 2849 A 44 ARG HBx A 110 ILE HD1% 1.0 0.0 6.0 3271 2850 A 68 ASN H A 117 ASN HA 1.0 2.0 5.8 3272 2850 A 67 GLU H A 117 ASN HA 1.0 2.0 5.8 3273 2851 B 21 ASP HA B 22 LEU HG 1.0 1.8 6.0 3274 2851 B 22 LEU HBy B 21 ASP HA 1.0 1.8 6.0 3275 2852 B 7 THR HA B 7 THR HG2% 1.0 1.9 4.3 3276 2853 B 7 THR HA B 8 THR H 1.0 1.6 2.8 3277 2854 B 7 THR HA B 7 THR HB 1.0 1.5 2.7 3278 2855 B 8 THR H B 7 THR HB 1.0 2.0 5.4 3279 2856 B 7 THR HG2% B 7 THR HB 1.0 1.7 3.1 3280 2857 B 7 THR HG2% B 8 THR H 1.0 1.9 6.0 3281 2858 B 8 THR HA B 8 THR HG21 1.0 1.7 2.9 3282 2859 B 8 THR H B 8 THR HA 1.0 1.8 3.6 3283 2860 B 8 THR HA B 9 PRO HGy 1.0 2.0 6.0 3284 2860 B 8 THR HA B 9 PRO HGx 1.0 2.0 6.0 3285 2860 B 8 THR HA B 9 PRO HBy 1.0 2.0 6.0 3286 2861 B 8 THR HA B 8 THR HB 1.0 1.9 5.1 3287 2862 B 8 THR HG21 B 8 THR HB 1.0 1.5 2.5 3288 2863 B 8 THR H B 8 THR HB 1.0 1.8 3.8 3289 2864 B 8 THR HB B 9 PRO HBx 1.0 1.9 6.0 3290 2865 B 8 THR HB B 9 PRO HGy 1.0 1.6 6.0 3291 2865 B 8 THR HB B 9 PRO HGx 1.0 1.6 6.0 3292 2865 B 9 PRO HBy B 8 THR HB 1.0 1.6 6.0 3293 2866 B 8 THR H B 8 THR HG21 1.0 2.0 6.0 3294 2867 B 8 THR HG21 B 10 ASP H 1.0 2.0 6.0 3295 2868 B 9 PRO HA B 9 PRO HGy 1.0 1.9 4.5 3296 2868 B 9 PRO HA B 9 PRO HGx 1.0 1.9 4.5 3297 2868 B 9 PRO HBy B 9 PRO HA 1.0 1.9 4.5 3298 2869 B 9 PRO HA B 10 ASP HBy 1.0 1.9 6.0 3299 2870 B 9 PRO HA B 10 ASP HBx 1.0 1.9 6.0 3300 2871 B 10 ASP H B 9 PRO HA 1.0 1.5 2.5 3301 2872 B 9 PRO HBx B 9 PRO HA 1.0 1.8 3.4 3302 2873 B 9 PRO HBx B 10 ASP H 1.0 1.8 4.0 3303 2874 B 8 THR HA B 9 PRO HDy 1.0 1.9 4.3 3304 2875 B 8 THR HB B 9 PRO HDy 1.0 1.8 6.0 3305 2876 B 8 THR HG21 B 9 PRO HDy 1.0 2.0 4.6 3306 2877 B 8 THR H B 9 PRO HDy 1.0 1.9 6.0 3307 2878 B 9 PRO HBx B 9 PRO HDy 1.0 2.0 6.0 3308 2879 B 9 PRO HDy B 9 PRO HGy 1.0 1.7 2.9 3309 2879 B 9 PRO HDy B 9 PRO HGx 1.0 1.7 2.9 3310 2879 B 9 PRO HBy B 9 PRO HDy 1.0 1.7 2.9 3311 2880 B 10 ASP H B 9 PRO HDy 1.0 1.1 6.0 3312 2881 B 8 THR HG21 B 9 PRO HDx 1.0 1.7 3.1 3313 2882 B 8 THR H B 9 PRO HDx 1.0 1.8 6.0 3314 2883 B 9 PRO HBx B 9 PRO HDx 1.0 2.0 6.0 3315 2884 B 9 PRO HDx B 9 PRO HGy 1.0 1.6 3.0 3316 2884 B 9 PRO HDx B 9 PRO HGx 1.0 1.6 3.0 3317 2884 B 9 PRO HBy B 9 PRO HDx 1.0 1.6 3.0 3318 2885 B 10 ASP H B 9 PRO HDx 1.0 1.3 6.0 3319 2886 B 10 ASP H B 9 PRO HGy 1.0 1.9 6.0 3320 2886 B 10 ASP H B 9 PRO HGx 1.0 1.9 6.0 3321 2886 B 9 PRO HBy B 10 ASP H 1.0 1.9 6.0 3322 2887 B 10 ASP HBy B 10 ASP HA 1.0 1.8 3.6 3323 2888 B 10 ASP HBx B 10 ASP HA 1.0 1.8 3.8 3324 2889 B 10 ASP H B 10 ASP HA 1.0 1.7 3.5 3325 2890 B 10 ASP HA B 11 TYS H 1.0 1.5 2.3 3326 2891 B 10 ASP HA B 12 GLY H 1.0 2.0 5.6 3327 2892 B 10 ASP HBy B 10 ASP HBx 1.0 1.5 2.3 3328 2893 B 10 ASP H B 10 ASP HBy 1.0 1.9 3.9 3329 2894 B 10 ASP H B 10 ASP HBx 1.0 1.8 3.8 3330 2895 B 10 ASP HBx B 11 TYS H 1.0 2.0 6.0 3331 2896 B 10 ASP HBx B 12 GLY H 1.0 0.9 6.0 3332 2897 B 10 ASP H B 12 GLY H 1.0 0.7 6.0 3333 2898 B 11 TYS HA B 11 TYS HBy 1.0 1.8 4.0 3334 2899 B 11 TYS HA B 11 TYS HBx 1.0 1.8 3.8 3335 2900 B 11 TYS H B 11 TYS HA 1.0 1.8 3.8 3336 2901 B 12 GLY H B 11 TYS HA 1.0 2.0 4.8 3337 2902 B 11 TYS HBy B 11 TYS HBx 1.0 1.4 2.4 3338 2903 B 11 TYS H B 11 TYS HBy 1.0 1.9 4.5 3339 2904 B 12 GLY H B 11 TYS HBy 1.0 2.0 6.0 3340 2905 B 12 GLY H B 11 TYS HBx 1.0 2.0 6.0 3341 2906 B 10 ASP H B 11 TYS H 1.0 2.0 5.6 3342 2907 B 11 TYS H B 11 TYS HBx 1.0 1.9 4.7 3343 2908 B 11 TYS H B 12 GLY H 1.0 1.4 2.2 3344 2909 B 11 TYS H B 12 GLY HAy 1.0 1.9 6.0 3345 2910 B 12 GLY H B 12 GLY HAy 1.0 1.8 3.8 3346 2911 B 13 HIS H B 12 GLY HAy 1.0 1.9 4.5 3347 2912 B 11 TYS H B 12 GLY HAx 1.0 1.9 6.0 3348 2913 B 12 GLY H B 12 GLY HAx 1.0 1.8 3.8 3349 2914 B 13 HIS H B 12 GLY HAx 1.0 1.8 3.8 3350 2915 B 12 GLY H B 13 HIS H 1.0 2.0 5.0 3351 2916 B 13 HIS HA B 13 HIS HBx 1.0 1.9 4.3 3352 2917 B 13 HIS HA B 13 HIS HDy 1.0 0.0 6.0 3353 2918 B 13 HIS H B 13 HIS HA 1.0 1.7 2.9 3354 2919 B 13 HIS HA B 14 TYS HBy 1.0 2.0 6.0 3355 2920 B 13 HIS HA B 14 TYS H 1.0 1.9 4.1 3356 2921 B 13 HIS HBx B 13 HIS HDy 1.0 1.9 4.5 3357 2922 B 13 HIS HBx B 13 HIS HEx 1.0 1.5 6.0 3358 2923 B 13 HIS H B 13 HIS HBx 1.0 2.0 4.8 3359 2924 B 13 HIS HBx B 14 TYS H 1.0 2.0 4.8 3360 2925 B 13 HIS HDy B 13 HIS HBy 1.0 1.8 3.6 3361 2926 B 13 HIS HEx B 13 HIS HBy 1.0 1.6 6.0 3362 2927 B 13 HIS H B 13 HIS HBy 1.0 2.0 6.0 3363 2928 B 14 TYS H B 13 HIS HBy 1.0 1.7 3.5 3364 2929 B 13 HIS HDy B 13 HIS HEx 1.0 2.0 6.0 3365 2930 B 13 HIS H B 14 TYS H 1.0 2.0 6.0 3366 2931 B 13 HIS HBy B 14 TYS HA 1.0 1.9 4.7 3367 2932 B 13 HIS HDy B 14 TYS HA 1.0 1.8 4.0 3368 2933 B 13 HIS H B 14 TYS HA 1.0 0.0 6.0 3369 2934 B 14 TYS HA B 14 TYS HBx 1.0 1.7 3.1 3370 2935 B 14 TYS HBy B 14 TYS HA 1.0 1.9 4.7 3371 2936 B 14 TYS H B 14 TYS HA 1.0 1.7 3.1 3372 2937 B 14 TYS HA B 15 ASP H 1.0 2.0 5.0 3373 2938 B 14 TYS HBx B 15 ASP H 1.0 2.0 5.6 3374 2939 B 13 HIS HDy B 14 TYS HBy 1.0 1.9 6.0 3375 2940 B 14 TYS HBy B 14 TYS H 1.0 2.0 4.6 3376 2941 B 14 TYS HBy B 15 ASP H 1.0 2.0 5.2 3377 2942 B 13 HIS HDy B 14 TYS H 1.0 1.9 4.5 3378 2943 B 14 TYS H B 14 TYS HBx 1.0 1.9 4.1 3379 2944 B 14 TYS H B 15 ASP H 1.0 2.0 4.8 3380 2945 B 15 ASP H B 15 ASP HA 1.0 1.8 3.4 3381 2946 B 15 ASP HA B 16 ASP H 1.0 1.9 4.9 3382 2947 B 13 HIS HDy B 15 ASP HBx 1.0 1.9 3.9 3383 2948 B 15 ASP HBx B 15 ASP HBy 1.0 1.6 2.8 3384 2949 B 15 ASP H B 15 ASP HBx 1.0 2.0 5.4 3385 2950 B 16 ASP H B 15 ASP HBx 1.0 2.0 4.8 3386 2951 B 13 HIS HDy B 15 ASP HBy 1.0 1.8 3.4 3387 2952 B 15 ASP H B 15 ASP HBy 1.0 2.0 5.0 3388 2953 B 16 ASP H B 15 ASP HBy 1.0 2.0 6.0 3389 2954 B 15 ASP HBy B 17 LYS H 1.0 1.8 6.0 3390 2955 B 15 ASP HBy B 18 ASP H 1.0 1.8 6.0 3391 2956 B 13 HIS HDy B 15 ASP H 1.0 2.0 4.6 3392 2957 B 15 ASP H B 17 LYS H 1.0 1.7 6.0 3393 2958 B 15 ASP HBx B 16 ASP HA 1.0 0.0 6.0 3394 2959 B 15 ASP HBy B 16 ASP HA 1.0 2.0 4.6 3395 2960 B 16 ASP H B 16 ASP HA 1.0 1.7 3.1 3396 2961 B 17 LYS H B 16 ASP HA 1.0 1.9 4.5 3397 2962 B 16 ASP H B 16 ASP HBy 1.0 1.9 4.5 3398 2963 B 17 LYS H B 16 ASP HBy 1.0 2.0 6.0 3399 2964 B 16 ASP H B 16 ASP HBx 1.0 2.0 4.6 3400 2965 B 17 LYS H B 16 ASP HBx 1.0 2.0 6.0 3401 2966 B 13 HIS HDy B 16 ASP H 1.0 2.0 5.6 3402 2967 B 15 ASP H B 16 ASP H 1.0 1.9 5.3 3403 2968 B 16 ASP H B 17 LYS HDx 1.0 1.8 6.0 3404 2968 B 16 ASP H B 17 LYS HDy 1.0 1.8 6.0 3405 2969 B 16 ASP H B 17 LYS H 1.0 1.5 2.5 3406 2970 B 16 ASP H B 18 ASP H 1.0 2.0 5.6 3407 2971 B 16 ASP H B 19 THR HG21 1.0 2.0 6.0 3408 2972 B 16 ASP H B 17 LYS HA 1.0 1.9 6.0 3409 2973 B 17 LYS HA B 17 LYS HBy 1.0 1.6 2.8 3410 2973 B 17 LYS HA B 17 LYS HBx 1.0 1.6 2.8 3411 2974 B 17 LYS HDx B 17 LYS HA 1.0 2.0 5.0 3412 2974 B 17 LYS HDy B 17 LYS HA 1.0 2.0 5.0 3413 2975 B 17 LYS HA B 17 LYS HGy 1.0 1.9 4.9 3414 2976 B 17 LYS HA B 17 LYS HGx 1.0 1.9 4.5 3415 2977 B 17 LYS H B 17 LYS HA 1.0 1.7 3.3 3416 2978 B 18 ASP H B 17 LYS HA 1.0 1.9 4.3 3417 2979 B 19 THR HG21 B 17 LYS HA 1.0 1.9 4.7 3418 2980 B 17 LYS HA B 19 THR H 1.0 2.0 6.0 3419 2981 B 16 ASP H B 17 LYS HBy 1.0 2.0 6.0 3420 2981 B 16 ASP H B 17 LYS HBx 1.0 2.0 6.0 3421 2982 B 17 LYS HBy B 17 LYS HEy 1.0 2.0 5.8 3422 2982 B 17 LYS HBy B 17 LYS HEx 1.0 2.0 5.8 3423 2982 B 17 LYS HBx B 17 LYS HEx 1.0 2.0 5.8 3424 2982 B 17 LYS HBx B 17 LYS HEy 1.0 2.0 5.8 3425 2983 B 17 LYS H B 17 LYS HBy 1.0 1.8 3.4 3426 2983 B 17 LYS H B 17 LYS HBx 1.0 1.8 3.4 3427 2984 B 17 LYS HBy B 18 ASP HBy 1.0 2.0 6.0 3428 2984 B 17 LYS HBx B 18 ASP HBy 1.0 2.0 6.0 3429 2985 B 17 LYS HBy B 18 ASP HBx 1.0 1.9 6.0 3430 2985 B 17 LYS HBx B 18 ASP HBx 1.0 1.9 6.0 3431 2986 B 18 ASP H B 17 LYS HBy 1.0 1.8 3.6 3432 2986 B 18 ASP H B 17 LYS HBx 1.0 1.8 3.6 3433 2987 B 17 LYS HBy B 19 THR H 1.0 2.0 6.0 3434 2987 B 17 LYS HBx B 19 THR H 1.0 2.0 6.0 3435 2988 B 17 LYS HDx B 17 LYS HBx 1.0 1.8 3.8 3436 2988 B 17 LYS HDy B 17 LYS HBy 1.0 1.8 3.8 3437 2988 B 17 LYS HDy B 17 LYS HBx 1.0 1.8 3.8 3438 2988 B 17 LYS HDx B 17 LYS HBy 1.0 1.8 3.8 3439 2989 B 17 LYS HDx B 17 LYS HEx 1.0 1.6 2.8 3440 2989 B 17 LYS HDx B 17 LYS HEy 1.0 1.6 2.8 3441 2989 B 17 LYS HDy B 17 LYS HEx 1.0 1.6 2.8 3442 2989 B 17 LYS HDy B 17 LYS HEy 1.0 1.6 2.8 3443 2990 B 17 LYS HDx B 17 LYS HGy 1.0 1.7 3.1 3444 2990 B 17 LYS HDy B 17 LYS HGy 1.0 1.7 3.1 3445 2991 B 17 LYS HDx B 17 LYS HGx 1.0 1.7 3.1 3446 2991 B 17 LYS HDy B 17 LYS HGx 1.0 1.7 3.1 3447 2992 B 17 LYS H B 17 LYS HDx 1.0 2.0 6.0 3448 2992 B 17 LYS H B 17 LYS HDy 1.0 2.0 6.0 3449 2993 B 17 LYS H B 17 LYS HEx 1.0 1.9 6.0 3450 2993 B 17 LYS H B 17 LYS HEy 1.0 1.9 6.0 3451 2994 B 18 ASP H B 17 LYS HEx 1.0 0.0 6.0 3452 2994 B 18 ASP H B 17 LYS HEy 1.0 0.0 6.0 3453 2995 B 16 ASP H B 17 LYS HGy 1.0 1.9 6.0 3454 2996 B 17 LYS HBy B 17 LYS HGy 1.0 1.7 3.1 3455 2996 B 17 LYS HBx B 17 LYS HGy 1.0 1.7 3.1 3456 2997 B 17 LYS HGy B 17 LYS HEx 1.0 1.9 4.3 3457 2997 B 17 LYS HGy B 17 LYS HEy 1.0 1.9 4.3 3458 2998 B 17 LYS HGy B 17 LYS HGx 1.0 1.3 2.2 3459 2999 B 17 LYS H B 17 LYS HGy 1.0 1.9 4.3 3460 3000 B 18 ASP H B 17 LYS HGy 1.0 2.0 5.6 3461 3001 B 16 ASP H B 17 LYS HGx 1.0 2.0 6.0 3462 3002 B 17 LYS HBy B 17 LYS HGx 1.0 1.7 3.1 3463 3002 B 17 LYS HBx B 17 LYS HGx 1.0 1.7 3.1 3464 3003 B 17 LYS HGx B 17 LYS HEx 1.0 1.9 4.3 3465 3003 B 17 LYS HGx B 17 LYS HEy 1.0 1.9 4.3 3466 3004 B 17 LYS H B 17 LYS HGx 1.0 1.9 4.3 3467 3005 B 18 ASP H B 17 LYS HGx 1.0 2.0 6.0 3468 3006 B 17 LYS H B 18 ASP H 1.0 1.6 2.8 3469 3007 B 18 ASP HBy B 18 ASP HA 1.0 1.8 4.0 3470 3008 B 18 ASP HBx B 18 ASP HA 1.0 1.9 4.1 3471 3009 B 18 ASP H B 18 ASP HA 1.0 1.8 3.8 3472 3010 B 18 ASP HBy B 18 ASP HBx 1.0 1.6 2.6 3473 3011 B 18 ASP H B 18 ASP HBy 1.0 1.9 4.3 3474 3012 B 17 LYS H B 18 ASP HBx 1.0 2.0 6.0 3475 3013 B 18 ASP H B 18 ASP HBx 1.0 1.8 3.8 3476 3014 B 19 THR H B 18 ASP HBx 1.0 2.0 5.2 3477 3015 B 18 ASP H B 17 LYS HDx 1.0 1.9 4.5 3478 3015 B 18 ASP H B 17 LYS HDy 1.0 1.9 4.5 3479 3016 B 18 ASP H B 19 THR H 1.0 1.9 4.1 3480 3017 B 19 THR HA B 19 THR HG1 1.0 1.9 5.3 3481 3018 B 19 THR HG21 B 19 THR HA 1.0 1.8 4.2 3482 3019 B 19 THR H B 19 THR HA 1.0 1.9 4.1 3483 3020 B 18 ASP H B 19 THR HB 1.0 1.9 6.0 3484 3021 B 19 THR HA B 19 THR HB 1.0 1.8 3.8 3485 3022 B 19 THR HG1 B 19 THR HB 1.0 1.9 4.7 3486 3023 B 19 THR HG21 B 19 THR HB 1.0 1.7 3.1 3487 3024 B 19 THR H B 19 THR HB 1.0 2.0 5.2 3488 3025 B 19 THR HB B 20 LEU H 1.0 1.9 4.7 3489 3026 B 19 THR H B 19 THR HG1 1.0 1.9 6.0 3490 3027 B 16 ASP HBy B 19 THR HG21 1.0 0.0 6.0 3491 3028 B 16 ASP HBx B 19 THR HG21 1.0 0.0 6.0 3492 3029 B 17 LYS H B 19 THR HG21 1.0 2.0 4.8 3493 3030 B 18 ASP H B 19 THR HG21 1.0 2.0 5.0 3494 3031 B 19 THR HG21 B 19 THR HG1 1.0 2.0 5.0 3495 3032 B 19 THR HG21 B 19 THR H 1.0 1.8 3.4 3496 3033 B 19 THR HG21 B 20 LEU H 1.0 2.0 5.4 3497 3034 B 17 LYS H B 19 THR H 1.0 2.0 6.0 3498 3035 B 19 THR H B 18 ASP HBy 1.0 2.0 4.8 3499 3036 B 20 LEU HA B 20 LEU HBy 1.0 1.8 4.0 3500 3037 B 20 LEU HA B 20 LEU HBx 1.0 1.8 4.0 3501 3038 B 20 LEU HA B 20 LEU HD11 1.0 1.8 3.4 3502 3038 B 20 LEU HA B 20 LEU HD21 1.0 1.8 3.4 3503 3039 B 21 ASP HA B 20 LEU HA 1.0 1.9 6.0 3504 3040 B 20 LEU HA B 21 ASP HBy 1.0 2.0 6.0 3505 3041 B 20 LEU HA B 21 ASP HBx 1.0 2.0 6.0 3506 3042 B 20 LEU HBy B 20 LEU HD11 1.0 1.8 3.4 3507 3042 B 20 LEU HBy B 20 LEU HD21 1.0 1.8 3.4 3508 3043 B 20 LEU H B 20 LEU HBy 1.0 2.0 5.2 3509 3044 B 20 LEU HBy B 21 ASP H 1.0 1.9 5.1 3510 3045 B 20 LEU HBy B 22 LEU HD11 1.0 2.0 5.0 3511 3046 B 20 LEU HBy B 20 LEU HBx 1.0 1.5 2.3 3512 3047 B 20 LEU HBx B 20 LEU HD11 1.0 1.8 3.4 3513 3047 B 20 LEU HBx B 20 LEU HD21 1.0 1.8 3.4 3514 3048 B 20 LEU H B 20 LEU HBx 1.0 1.9 4.3 3515 3049 B 20 LEU HBx B 21 ASP H 1.0 2.0 6.0 3516 3050 B 19 THR HG1 B 20 LEU HD11 1.0 0.0 6.0 3517 3050 B 19 THR HG1 B 20 LEU HD21 1.0 0.0 6.0 3518 3051 B 20 LEU H B 20 LEU HD11 1.0 2.0 5.4 3519 3051 B 20 LEU H B 20 LEU HD21 1.0 2.0 5.4 3520 3052 B 21 ASP HBy B 20 LEU HD11 1.0 1.8 6.0 3521 3052 B 21 ASP HBy B 20 LEU HD21 1.0 1.8 6.0 3522 3053 B 21 ASP HBx B 20 LEU HD11 1.0 1.9 6.0 3523 3053 B 21 ASP HBx B 20 LEU HD21 1.0 1.9 6.0 3524 3054 B 21 ASP H B 20 LEU HD11 1.0 1.9 4.3 3525 3054 B 21 ASP H B 20 LEU HD21 1.0 1.9 4.3 3526 3055 B 22 LEU HBx B 20 LEU HD11 1.0 1.7 6.0 3527 3055 B 22 LEU HBx B 20 LEU HD21 1.0 1.7 6.0 3528 3056 B 22 LEU HBy B 20 LEU HD11 1.0 2.0 6.0 3529 3056 B 22 LEU HBy B 20 LEU HD21 1.0 2.0 6.0 3530 3057 B 22 LEU HD11 B 20 LEU HD11 1.0 1.7 3.5 3531 3057 B 22 LEU HD11 B 20 LEU HD21 1.0 1.7 3.5 3532 3058 B 22 LEU HD2y B 20 LEU HD11 1.0 2.0 5.4 3533 3058 B 22 LEU HD2y B 20 LEU HD21 1.0 2.0 5.4 3534 3059 B 22 LEU H B 20 LEU HD11 1.0 1.9 6.0 3535 3059 B 22 LEU H B 20 LEU HD21 1.0 1.9 6.0 3536 3060 B 20 LEU HBx B 20 LEU HG 1.0 2.0 4.6 3537 3061 B 20 LEU HG B 20 LEU HD11 1.0 1.6 2.8 3538 3061 B 20 LEU HG B 20 LEU HD21 1.0 1.6 2.8 3539 3062 B 20 LEU H B 20 LEU HG 1.0 2.0 6.0 3540 3063 B 21 ASP H B 20 LEU HG 1.0 2.0 5.8 3541 3064 B 22 LEU HD11 B 20 LEU HG 1.0 1.9 4.9 3542 3065 B 19 THR HG1 B 20 LEU H 1.0 2.0 5.2 3543 3066 B 19 THR H B 20 LEU H 1.0 1.9 5.3 3544 3067 B 20 LEU H B 20 LEU HA 1.0 2.0 4.8 3545 3068 B 20 LEU H B 21 ASP H 1.0 2.0 6.0 3546 3069 B 21 ASP HA B 20 LEU HD11 1.0 1.9 6.0 3547 3069 B 21 ASP HA B 20 LEU HD21 1.0 1.9 6.0 3548 3070 B 21 ASP HA B 20 LEU H 1.0 0.0 6.0 3549 3071 B 21 ASP HA B 21 ASP HBy 1.0 1.8 4.0 3550 3072 B 21 ASP HA B 21 ASP HBx 1.0 1.9 4.3 3551 3073 B 21 ASP HA B 21 ASP H 1.0 1.8 4.0 3552 3074 B 21 ASP HA B 22 LEU HBx 1.0 1.6 6.0 3553 3075 B 22 LEU HBy B 21 ASP HA 1.0 2.0 6.0 3554 3076 B 21 ASP HA B 22 LEU HD11 1.0 2.0 6.0 3555 3077 B 21 ASP HA B 22 LEU HD2y 1.0 1.6 6.0 3556 3078 B 21 ASP HA B 22 LEU H 1.0 1.6 2.8 3557 3079 B 21 ASP HA B 23 ASN H 1.0 2.0 5.8 3558 3080 B 21 ASP HBy B 21 ASP H 1.0 1.9 4.3 3559 3081 B 21 ASP HBy B 22 LEU H 1.0 1.9 6.0 3560 3082 B 21 ASP HBy B 23 ASN HD2x 1.0 1.9 6.0 3561 3083 B 21 ASP HBy B 23 ASN H 1.0 1.8 6.0 3562 3084 B 21 ASP HBy B 21 ASP HBx 1.0 1.5 2.3 3563 3085 B 21 ASP HBx B 21 ASP H 1.0 1.8 4.0 3564 3086 B 21 ASP HBx B 22 LEU H 1.0 1.9 6.0 3565 3087 B 21 ASP HBx B 23 ASN HD2x 1.0 1.9 6.0 3566 3088 B 21 ASP HBx B 23 ASN H 1.0 1.7 6.0 3567 3089 B 20 LEU HA B 21 ASP H 1.0 1.9 4.1 3568 3090 B 21 ASP H B 22 LEU HD11 1.0 2.0 6.0 3569 3091 B 21 ASP H B 22 LEU H 1.0 2.0 6.0 3570 3092 B 22 LEU HBx B 22 LEU HA 1.0 1.9 3.7 3571 3093 B 22 LEU HBy B 22 LEU HA 1.0 1.8 3.6 3572 3094 B 22 LEU HD11 B 22 LEU HA 1.0 1.7 3.1 3573 3095 B 22 LEU HD2y B 22 LEU HA 1.0 2.0 6.0 3574 3096 B 22 LEU H B 22 LEU HA 1.0 1.9 4.1 3575 3097 B 23 ASN H B 22 LEU HA 1.0 1.9 4.3 3576 3098 B 22 LEU HBx B 22 LEU HD2y 1.0 1.8 3.4 3577 3099 B 22 LEU HBx B 22 LEU H 1.0 2.0 5.2 3578 3100 B 22 LEU HBx B 23 ASN HD2x 1.0 1.7 6.0 3579 3101 B 22 LEU HBx B 23 ASN H 1.0 2.0 6.0 3580 3102 B 22 LEU HBy B 20 LEU HBy 1.0 2.0 6.0 3581 3103 B 22 LEU HBy B 22 LEU HBx 1.0 1.3 2.2 3582 3104 B 22 LEU HBy B 22 LEU H 1.0 1.6 2.8 3583 3105 B 22 LEU HBy B 23 ASN HD2x 1.0 1.9 6.0 3584 3106 B 22 LEU HBy B 23 ASN H 1.0 1.9 5.1 3585 3107 B 20 LEU H B 22 LEU HD11 1.0 1.8 4.0 3586 3108 B 22 LEU HD11 B 22 LEU HBx 1.0 2.0 5.0 3587 3109 B 22 LEU HBy B 22 LEU HD11 1.0 1.6 2.8 3588 3110 B 22 LEU HD11 B 22 LEU HD2y 1.0 1.6 2.8 3589 3111 B 22 LEU HD11 B 22 LEU H 1.0 1.8 4.0 3590 3112 B 22 LEU HD11 B 23 ASN H 1.0 0.0 6.0 3591 3113 B 20 LEU H B 22 LEU HD2y 1.0 0.0 6.0 3592 3114 B 21 ASP H B 22 LEU HD2y 1.0 0.0 6.0 3593 3115 B 22 LEU HBy B 22 LEU HD2y 1.0 1.7 3.1 3594 3116 B 22 LEU HD2y B 23 ASN H 1.0 0.0 6.0 3595 3117 B 22 LEU HG B 22 LEU HD11 1.0 1.5 2.7 3596 3118 B 22 LEU HG B 22 LEU HD2y 1.0 1.5 2.7 3597 3119 B 22 LEU HD2y B 22 LEU H 1.0 2.0 6.0 3598 3120 B 22 LEU H B 23 ASN HBy 1.0 1.4 6.0 3599 3121 B 22 LEU H B 23 ASN HBx 1.0 1.8 6.0 3600 3122 B 22 LEU H B 23 ASN HD2x 1.0 2.0 6.0 3601 3123 B 22 LEU H B 23 ASN H 1.0 1.7 3.3 3602 3124 B 22 LEU HBy B 23 ASN HA 1.0 2.0 6.0 3603 3125 B 23 ASN HBy B 23 ASN HA 1.0 1.6 3.0 3604 3126 B 23 ASN HBx B 23 ASN HA 1.0 1.8 4.0 3605 3127 B 23 ASN H B 23 ASN HA 1.0 1.8 3.4 3606 3128 B 23 ASN HA B 24 THR H 1.0 1.8 3.6 3607 3129 B 23 ASN HBy B 23 ASN HD2y 1.0 2.0 6.0 3608 3130 B 23 ASN H B 23 ASN HBy 1.0 1.9 4.7 3609 3131 B 23 ASN HBy B 24 THR H 1.0 2.0 5.2 3610 3132 B 23 ASN HD2x B 23 ASN HBx 1.0 1.7 3.5 3611 3133 B 23 ASN HBx B 23 ASN HD2y 1.0 2.0 5.6 3612 3134 B 23 ASN H B 23 ASN HBx 1.0 1.8 3.8 3613 3135 B 22 LEU HD11 B 23 ASN HD2x 1.0 0.0 6.0 3614 3136 B 23 ASN HD2x B 23 ASN HBy 1.0 2.0 4.4 3615 3137 B 23 ASN HD2x B 23 ASN HD2y 1.0 1.2 2.2 3616 3138 B 23 ASN H B 23 ASN HD2y 1.0 1.9 6.0 3617 3139 B 23 ASN H B 23 ASN HD2x 1.0 1.8 3.4 3618 3140 B 23 ASN H B 24 THR H 1.0 1.9 3.9 3619 3141 B 24 THR HA B 24 THR HG21 1.0 1.7 3.3 3620 3142 B 24 THR H B 24 THR HA 1.0 1.8 3.6 3621 3143 B 24 THR HA B 25 PRO HGy 1.0 1.9 6.0 3622 3144 B 23 ASN H B 24 THR HB 1.0 1.7 6.0 3623 3145 B 24 THR HA B 24 THR HB 1.0 1.8 3.8 3624 3146 B 24 THR HG21 B 24 THR HB 1.0 1.5 2.5 3625 3147 B 24 THR H B 24 THR HB 1.0 1.9 4.3 3626 3148 B 22 LEU H B 24 THR HG21 1.0 0.0 6.0 3627 3149 B 23 ASN HBy B 24 THR HG21 1.0 2.0 4.4 3628 3150 B 23 ASN HBx B 24 THR HG21 1.0 2.0 5.4 3629 3151 B 23 ASN HD2x B 24 THR HG21 1.0 0.0 6.0 3630 3152 B 23 ASN H B 24 THR HG21 1.0 1.9 6.0 3631 3153 B 24 THR H B 24 THR HG21 1.0 1.9 4.1 3632 3154 B 24 THR HG21 B 25 PRO HGy 1.0 2.0 4.8 3633 3155 B 24 THR HG21 B 25 PRO HBx 1.0 2.0 6.0 3634 3156 B 25 PRO HA B 25 PRO HBy 1.0 1.6 2.8 3635 3157 B 25 PRO HBx B 25 PRO HA 1.0 1.8 3.6 3636 3158 B 25 PRO HGy B 25 PRO HA 1.0 2.0 6.0 3637 3159 B 25 PRO HA B 25 PRO HGx 1.0 2.0 6.0 3638 3160 B 25 PRO HA B 26 VAL H 1.0 1.4 2.2 3639 3161 B 25 PRO HBx B 25 PRO HBy 1.0 1.3 2.2 3640 3162 B 25 PRO HGy B 25 PRO HBy 1.0 1.7 3.3 3641 3163 B 25 PRO HBy B 26 VAL H 1.0 2.0 6.0 3642 3164 B 25 PRO HBx B 25 PRO HDy 1.0 1.9 6.0 3643 3165 B 25 PRO HBx B 26 VAL HB 1.0 0.0 6.0 3644 3166 B 25 PRO HBx B 26 VAL H 1.0 2.0 5.4 3645 3167 B 24 THR HA B 25 PRO HDy 1.0 1.9 4.5 3646 3168 B 24 THR HB B 25 PRO HDy 1.0 1.9 4.7 3647 3169 B 24 THR HG21 B 25 PRO HDy 1.0 2.0 5.4 3648 3170 B 24 THR H B 25 PRO HDy 1.0 2.0 6.0 3649 3171 B 25 PRO HBy B 25 PRO HDy 1.0 1.9 5.1 3650 3172 B 25 PRO HGy B 25 PRO HDy 1.0 1.7 3.1 3651 3173 B 25 PRO HGx B 25 PRO HDy 1.0 1.8 4.0 3652 3174 B 24 THR HG21 B 25 PRO HDx 1.0 1.9 3.9 3653 3175 B 24 THR H B 25 PRO HDx 1.0 1.9 6.0 3654 3176 B 25 PRO HGy B 25 PRO HDx 1.0 1.8 3.6 3655 3177 B 25 PRO HBy B 25 PRO HGx 1.0 1.9 4.5 3656 3178 B 25 PRO HGx B 26 VAL HB 1.0 0.0 6.0 3657 3179 B 26 VAL HA B 26 VAL HG21 1.0 1.8 3.8 3658 3179 B 26 VAL HA B 26 VAL HG11 1.0 1.8 3.8 3659 3180 B 26 VAL H B 26 VAL HA 1.0 1.7 3.1 3660 3181 B 26 VAL HA B 27 ASP H 1.0 1.6 2.6 3661 3182 B 26 VAL HA B 28 LYS H 1.0 1.9 6.0 3662 3183 B 26 VAL HB B 26 VAL HA 1.0 1.9 4.3 3663 3184 B 26 VAL HB B 26 VAL HG21 1.0 1.7 3.1 3664 3184 B 26 VAL HB B 26 VAL HG11 1.0 1.7 3.1 3665 3185 B 26 VAL H B 26 VAL HB 1.0 1.8 4.2 3666 3186 B 26 VAL HB B 27 ASP H 1.0 2.0 6.0 3667 3187 B 26 VAL H B 26 VAL HG21 1.0 1.8 4.0 3668 3187 B 26 VAL H B 26 VAL HG11 1.0 1.8 4.0 3669 3188 B 26 VAL HG21 B 27 ASP H 1.0 2.0 5.8 3670 3188 B 26 VAL HG11 B 27 ASP H 1.0 2.0 5.8 3671 3189 B 25 PRO HGy B 26 VAL H 1.0 0.0 6.0 3672 3190 B 26 VAL H B 27 ASP H 1.0 2.0 6.0 3673 3191 B 27 ASP HA B 27 ASP HB2 1.0 1.8 3.6 3674 3192 B 27 ASP H B 27 ASP HA 1.0 1.8 4.2 3675 3193 B 28 LYS H B 27 ASP HA 1.0 1.8 3.6 3676 3194 B 27 ASP H B 27 ASP HB3 1.0 2.0 5.0 3677 3195 B 28 LYS H B 27 ASP HB3 1.0 2.0 6.0 3678 3196 B 27 ASP H B 27 ASP HB2 1.0 1.9 4.5 3679 3197 B 28 LYS H B 28 LYS HA 1.0 1.8 3.4 3680 3198 B 28 LYS HGy B 28 LYS HBx 1.0 1.8 3.6 3681 3198 B 28 LYS HGx B 28 LYS HBx 1.0 1.8 3.6 3682 3198 B 28 LYS HBy B 28 LYS HGx 1.0 1.8 3.6 3683 3198 B 28 LYS HBy B 28 LYS HGy 1.0 1.8 3.6 3684 3199 B 28 LYS H B 28 LYS HBx 1.0 2.0 5.8 3685 3199 B 28 LYS H B 28 LYS HBy 1.0 2.0 5.8 3686 3200 B 28 LYS HA B 28 LYS HDx 1.0 2.0 5.2 3687 3200 B 28 LYS HA B 28 LYS HDy 1.0 2.0 5.2 3688 3201 B 28 LYS H B 28 LYS HDx 1.0 2.0 6.0 3689 3201 B 28 LYS H B 28 LYS HDy 1.0 2.0 6.0 3690 3202 B 28 LYS H B 28 LYS HGx 1.0 2.0 6.0 3691 3202 B 28 LYS H B 28 LYS HGy 1.0 2.0 6.0 3692 3203 B 27 ASP H B 28 LYS H 1.0 1.9 4.7 3693 3204 B 11 TYS H B 11 TYS HBx 1.0 2.0 5.0 3694 3204 B 10 ASP HBy B 11 TYS H 1.0 2.0 5.0 3695 3205 B 17 LYS H B 18 ASP HBy 1.0 2.0 6.0 3696 3205 B 15 ASP HBx B 17 LYS H 1.0 2.0 6.0 3697 3206 B 17 LYS H B 18 ASP HA 1.0 2.0 6.0 3698 3206 B 15 ASP HA B 17 LYS H 1.0 2.0 6.0 3699 3207 B 13 HIS HA B 13 HIS HDy 1.0 1.6 3.0 3700 3207 B 13 HIS H B 18 ASP HA 1.0 1.6 3.0 3701 3207 B 13 HIS H B 13 HIS HA 1.0 1.6 3.0 3702 3207 B 13 HIS HDy B 15 ASP HA 1.0 1.6 3.0 3703 3207 B 13 HIS H B 15 ASP HA 1.0 1.6 3.0 3704 3207 B 13 HIS HDy B 18 ASP HA 1.0 1.6 3.0 3705 3208 B 20 LEU H B 20 LEU HA 1.0 1.7 3.5 3706 3208 B 19 THR HA B 20 LEU H 1.0 1.7 3.5 3707 3209 B 20 LEU HA B 21 ASP H 1.0 1.6 3.0 3708 3209 B 18 ASP H B 20 LEU HA 1.0 1.6 3.0 stop_ save_ save_CNS/XPLOR_distance_constraints_5 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_5 _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 109 VAL H B 13 HIS HBx 1.0 0.00 5.83 2 2 A 109 VAL H B 13 HIS H 1.0 0.00 3.41 3 3 A 109 VAL H B 14 TYS H 1.0 0.00 6.02 4 4 A 109 VAL H B 15 ASP HBx 1.0 0.00 5.38 5 5 A 109 VAL H B 15 ASP HBy 1.0 0.00 5.74 6 6 A 109 VAL H B 15 ASP H 1.0 0.00 4.49 7 7 A 106 SER H B 19 THR HA 1.0 0.00 4.60 8 8 A 106 SER H B 19 THR HB 1.0 0.00 4.14 9 9 A 106 SER H B 19 THR HG1 1.0 0.00 4.95 10 10 A 106 SER H B 19 THR HG21 1.0 0.00 4.83 11 11 A 108 TYR H B 19 THR HG1 1.0 0.00 5.15 12 12 A 106 SER H B 20 LEU HBy 1.0 0.00 4.95 13 13 A 106 SER H B 20 LEU HBx 1.0 0.00 6.38 14 14 A 106 SER H B 20 LEU HD11 1.0 0.00 4.55 15 14 A 106 SER H B 20 LEU HD21 1.0 0.00 4.55 16 15 A 106 SER H B 20 LEU H 1.0 0.00 3.75 17 16 A 105 LYS H B 21 ASP HA 1.0 0.00 4.86 18 17 A 106 SER H B 21 ASP HA 1.0 0.00 3.77 19 18 A 105 LYS H B 22 LEU H 1.0 0.00 6.36 20 19 A 106 SER H B 22 LEU H 1.0 0.00 5.28 21 20 A 48 TYR HBx B 11 TYS HA 1.0 0.00 5.10 22 21 A 48 TYR HBy B 11 TYS HA 1.0 0.00 4.28 23 22 A 110 ILE HD1% B 11 TYS HA 1.0 0.00 5.35 24 23 A 110 ILE HG2% B 11 TYS HA 1.0 0.00 5.24 25 24 B 11 TYS HBy A 51 LYS HBy 1.0 0.00 5.21 26 24 B 11 TYS HBy A 51 LYS HBx 1.0 0.00 5.21 27 25 A 52 GLY HAy B 11 TYS HBy 1.0 0.00 5.44 28 26 A 52 GLY HAx B 11 TYS HBy 1.0 0.00 5.76 29 27 B 11 TYS HBx A 51 LYS HBy 1.0 0.00 5.83 30 27 B 11 TYS HBx A 51 LYS HBx 1.0 0.00 5.83 31 28 A 52 GLY HAy B 11 TYS HBx 1.0 0.00 5.79 32 29 A 52 GLY HAx B 11 TYS HBx 1.0 0.00 5.50 33 30 A 110 ILE HA B 12 GLY HAy 1.0 0.00 3.99 34 30 A 110 ILE HA B 12 GLY HAx 1.0 0.00 3.99 35 31 A 110 ILE HD1% B 12 GLY HAy 1.0 0.00 4.50 36 32 A 110 ILE HG1x B 12 GLY HAy 1.0 0.00 4.58 37 33 A 110 ILE HG1y B 12 GLY HAy 1.0 0.00 4.69 38 34 A 110 ILE HG2% B 12 GLY HAy 1.0 0.00 5.28 39 35 A 110 ILE HD1% B 12 GLY HAx 1.0 0.00 5.22 40 36 A 110 ILE HG1x B 12 GLY HAx 1.0 0.00 4.85 41 37 A 110 ILE HG1y B 12 GLY HAx 1.0 0.00 4.55 42 38 A 110 ILE HG2% B 12 GLY HAx 1.0 0.00 4.67 43 39 A 110 ILE HA B 12 GLY H 1.0 0.00 5.41 44 40 A 110 ILE HG1x B 12 GLY H 1.0 0.00 5.72 45 41 A 110 ILE HG1y B 12 GLY H 1.0 0.00 5.63 46 42 A 109 VAL HB B 13 HIS HDy 1.0 0.00 6.66 47 43 A 109 VAL HGx% B 13 HIS HDy 1.0 0.00 5.01 48 44 A 109 VAL HGy% B 13 HIS HDy 1.0 0.00 3.64 49 45 A 109 VAL HB B 13 HIS HEx 1.0 0.00 5.66 50 46 A 109 VAL HGx% B 13 HIS HEx 1.0 0.00 5.55 51 47 A 109 VAL HGy% B 13 HIS HEx 1.0 0.00 3.10 52 48 A 110 ILE HA B 13 HIS H 1.0 0.00 6.07 53 49 A 110 ILE HG1x B 13 HIS H 1.0 0.00 5.39 54 50 A 110 ILE HG1y B 13 HIS H 1.0 0.00 6.38 55 51 B 14 TYS HA A 108 TYR HBy 1.0 0.00 5.11 56 51 B 14 TYS HA A 108 TYR HBx 1.0 0.00 5.11 57 52 A 109 VAL HB B 15 ASP HBx 1.0 0.00 6.06 58 53 A 109 VAL HGx% B 15 ASP HBx 1.0 0.00 3.92 59 54 A 109 VAL HGy% B 15 ASP HBx 1.0 0.00 3.39 60 55 A 109 VAL HB B 15 ASP HBy 1.0 0.00 6.05 61 56 A 109 VAL HGx% B 15 ASP HBy 1.0 0.00 5.16 62 57 A 109 VAL HGy% B 15 ASP HBy 1.0 0.00 3.73 63 58 A 108 TYR HA B 15 ASP H 1.0 0.00 4.02 64 59 A 109 VAL HGy% B 15 ASP H 1.0 0.00 5.53 65 60 A 109 VAL HGy% B 18 ASP HBx 1.0 0.00 5.19 66 61 B 19 THR HB A 105 LYS HBx 1.0 0.00 5.12 67 61 B 19 THR HB A 105 LYS HBy 1.0 0.00 5.12 68 62 A 105 LYS HGx B 19 THR HB 1.0 0.00 3.60 69 63 A 105 LYS HGy B 19 THR HB 1.0 0.00 3.44 70 64 A 106 SER HA B 19 THR HG1 1.0 0.00 5.93 71 65 A 106 SER HBx B 19 THR HG1 1.0 0.00 4.79 72 66 A 106 SER HBy B 19 THR HG1 1.0 0.00 5.01 73 67 B 19 THR HG21 A 105 LYS HBx 1.0 0.00 4.06 74 67 B 19 THR HG21 A 105 LYS HBy 1.0 0.00 4.06 75 68 A 105 LYS HGx B 19 THR HG21 1.0 0.00 3.97 76 69 A 105 LYS HGy B 19 THR HG21 1.0 0.00 3.96 77 70 A 107 SER HA B 19 THR HG21 1.0 0.00 5.13 78 71 A 106 SER HBy B 20 LEU HBy 1.0 0.00 6.22 79 72 A 63 VAL HA B 20 LEU HD11 1.0 0.00 5.56 80 72 A 63 VAL HA B 20 LEU HD21 1.0 0.00 5.56 81 73 A 63 VAL HB B 20 LEU HD11 1.0 0.00 3.36 82 73 A 63 VAL HB B 20 LEU HD21 1.0 0.00 3.36 83 74 A 63 VAL HGy% B 20 LEU HD11 1.0 0.00 2.65 84 74 A 63 VAL HGy% B 20 LEU HD21 1.0 0.00 2.65 85 75 A 65 LEU HD1% B 20 LEU HD11 1.0 0.00 3.30 86 75 A 65 LEU HD1% B 20 LEU HD21 1.0 0.00 3.30 87 76 A 65 LEU HD1% B 20 LEU HBx 1.0 0.00 4.78 88 77 A 97 TYR HBx B 20 LEU HD11 1.0 0.00 5.30 89 77 A 97 TYR HBx B 20 LEU HD21 1.0 0.00 5.30 90 78 A 97 TYR HBy B 20 LEU HD11 1.0 0.00 4.39 91 78 A 97 TYR HBy B 20 LEU HD21 1.0 0.00 4.39 92 79 A 105 LYS HA B 21 ASP HA 1.0 0.00 3.38 93 80 B 21 ASP HA A 105 LYS HBx 1.0 0.00 4.82 94 80 B 21 ASP HA A 105 LYS HBy 1.0 0.00 4.82 95 81 A 105 LYS HGx B 21 ASP HA 1.0 0.00 5.70 96 82 A 105 LYS HGy B 21 ASP HA 1.0 0.00 5.44 97 83 B 21 ASP HBy A 105 LYS HBx 1.0 0.00 7.47 98 83 B 21 ASP HBy A 105 LYS HBy 1.0 0.00 7.47 99 84 B 21 ASP HBx A 105 LYS HBx 1.0 0.00 5.01 100 84 B 21 ASP HBx A 105 LYS HBy 1.0 0.00 5.01 101 85 A 104 SER HA B 22 LEU HBx 1.0 0.00 5.40 102 86 A 104 SER HBx B 22 LEU HBx 1.0 0.00 5.09 103 87 A 104 SER HBy B 22 LEU HBx 1.0 0.00 5.27 104 88 A 104 SER HA B 22 LEU HBy 1.0 0.00 5.10 105 89 A 104 SER HBx B 22 LEU HBy 1.0 0.00 5.05 106 90 A 104 SER HBy B 22 LEU HBy 1.0 0.00 6.26 107 91 A 61 LYS HEy B 22 LEU HD11 1.0 0.00 5.15 108 92 A 63 VAL HGy% B 22 LEU HD11 1.0 0.00 3.99 109 93 A 104 SER HA B 22 LEU HD11 1.0 0.00 7.38 110 94 A 61 LYS HDx B 22 LEU HD2y 1.0 0.00 5.23 111 95 A 61 LYS HDy B 22 LEU HD2y 1.0 0.00 5.18 112 96 A 61 LYS HEx B 22 LEU HD2y 1.0 0.00 3.65 113 97 A 61 LYS HEy B 22 LEU HD2y 1.0 0.00 3.04 114 98 A 104 SER HA B 22 LEU HD2y 1.0 0.00 4.03 115 99 A 104 SER HBx B 22 LEU HD2y 1.0 0.00 5.89 116 100 A 104 SER HBy B 22 LEU HD2y 1.0 0.00 5.56 117 101 A 104 SER HA B 22 LEU H 1.0 0.00 6.17 118 102 A 104 SER HBx B 22 LEU H 1.0 0.00 5.39 119 103 A 104 SER HBy B 22 LEU H 1.0 0.00 6.08 120 104 A 105 LYS HA B 22 LEU H 1.0 0.00 4.58 121 105 A 104 SER HBx B 23 ASN HD2x 1.0 0.00 6.46 122 106 A 104 SER HBx B 23 ASN HD2y 1.0 0.00 6.62 123 107 A 104 SER HBy B 23 ASN HD2y 1.0 0.00 6.61 124 108 A 48 TYR HA B 11 TYS HBy 1.0 0.00 5.65 125 109 A 48 TYR HA B 11 TYS HBx 1.0 0.00 5.31 126 110 A 51 LYS HA B 11 TYS HBy 1.0 0.00 6.13 127 111 A 51 LYS HA B 11 TYS HBx 1.0 0.00 6.30 128 112 B 11 TYS HBy A 51 LYS HBy 1.0 0.00 5.35 129 112 B 11 TYS HBy A 51 LYS HBx 1.0 0.00 5.35 130 113 B 11 TYS HBx A 51 LYS HBy 1.0 0.00 5.18 131 113 B 11 TYS HBx A 51 LYS HBx 1.0 0.00 5.18 132 114 B 11 TYS H A 51 LYS HBy 1.0 0.00 6.93 133 114 B 11 TYS H A 51 LYS HBx 1.0 0.00 6.93 134 115 B 11 TYS HBy A 51 LYS HDy 1.0 0.00 6.07 135 115 B 11 TYS HBy A 51 LYS HDx 1.0 0.00 6.07 136 116 B 11 TYS HBx A 51 LYS HDy 1.0 0.00 5.79 137 116 B 11 TYS HBx A 51 LYS HDx 1.0 0.00 5.79 138 117 B 11 TYS HBy A 51 LYS HGy 1.0 0.00 6.07 139 117 B 11 TYS HBy A 51 LYS HGx 1.0 0.00 6.07 140 118 B 11 TYS HBx A 51 LYS HGy 1.0 0.00 5.77 141 118 B 11 TYS HBx A 51 LYS HGx 1.0 0.00 5.77 142 119 A 52 GLY HAy B 11 TYS HBy 1.0 0.00 5.67 143 120 A 52 GLY HAy B 11 TYS HBx 1.0 0.00 5.21 144 121 A 52 GLY HAy B 11 TYS H 1.0 0.00 6.57 145 122 A 52 GLY HAy B 12 GLY H 1.0 0.00 6.76 146 123 A 52 GLY HAx B 11 TYS HBy 1.0 0.00 5.35 147 124 A 52 GLY HAx B 11 TYS HBx 1.0 0.00 5.07 148 125 A 52 GLY HAx B 11 TYS H 1.0 0.00 6.63 149 126 A 52 GLY HAx B 12 GLY H 1.0 0.00 6.29 150 127 A 53 THR HG2% B 14 TYS H 1.0 0.00 5.96 151 128 A 61 LYS HBx B 22 LEU HD2y 1.0 0.00 6.85 152 129 A 61 LYS HBy B 22 LEU HD2y 1.0 0.00 6.07 153 130 A 61 LYS HDx B 22 LEU HD11 1.0 0.00 6.36 154 131 A 61 LYS HDx B 22 LEU HD2y 1.0 0.00 4.95 155 132 A 61 LYS HDy B 22 LEU HD11 1.0 0.00 5.60 156 133 A 61 LYS HDy B 22 LEU HD2y 1.0 0.00 4.63 157 134 A 61 LYS HEx B 22 LEU HBy 1.0 0.00 6.44 158 135 A 61 LYS HEx B 22 LEU HD11 1.0 0.00 5.24 159 136 A 61 LYS HEx B 22 LEU HD2y 1.0 0.00 3.97 160 137 A 61 LYS HEy B 22 LEU HBy 1.0 0.00 5.83 161 138 A 61 LYS HEy B 22 LEU HD11 1.0 0.00 4.99 162 139 A 61 LYS HEy B 22 LEU HD2y 1.0 0.00 3.60 163 140 A 61 LYS HGx B 22 LEU HD11 1.0 0.00 6.33 164 141 A 61 LYS HGx B 22 LEU HD2y 1.0 0.00 5.71 165 142 A 61 LYS HGy B 22 LEU HD11 1.0 0.00 6.60 166 143 A 61 LYS HGy B 22 LEU HD2y 1.0 0.00 5.32 167 144 A 63 VAL HA B 20 LEU HD11 1.0 0.00 5.05 168 144 A 63 VAL HA B 20 LEU HD21 1.0 0.00 5.05 169 145 A 63 VAL HA B 22 LEU HD11 1.0 0.00 6.01 170 146 A 63 VAL HB B 20 LEU HBy 1.0 0.00 5.86 171 147 A 63 VAL HB B 20 LEU HD11 1.0 0.00 3.72 172 147 A 63 VAL HB B 20 LEU HD21 1.0 0.00 3.72 173 148 A 63 VAL HB B 22 LEU HBy 1.0 0.00 6.55 174 149 A 63 VAL HB B 22 LEU HD11 1.0 0.00 5.29 175 150 A 63 VAL HB B 22 LEU HD2y 1.0 0.00 5.50 176 151 A 63 VAL HGx% B 20 LEU HBy 1.0 0.00 5.89 177 152 A 63 VAL HGx% B 20 LEU HBx 1.0 0.00 5.97 178 153 A 63 VAL HGx% B 20 LEU HD11 1.0 0.00 3.35 179 153 A 63 VAL HGx% B 20 LEU HD21 1.0 0.00 3.35 180 154 A 63 VAL HGx% B 20 LEU HG 1.0 0.00 5.54 181 155 A 63 VAL HGx% B 22 LEU HBy 1.0 0.00 4.99 182 156 A 63 VAL HGx% B 22 LEU HD11 1.0 0.00 3.59 183 157 A 63 VAL HGx% B 22 LEU HD2y 1.0 0.00 3.72 184 158 A 63 VAL HGy% B 20 LEU HBy 1.0 0.00 5.48 185 159 A 63 VAL HGy% B 20 LEU HBx 1.0 0.00 6.07 186 160 A 63 VAL HGy% B 20 LEU HD11 1.0 0.00 3.06 187 160 A 63 VAL HGy% B 20 LEU HD21 1.0 0.00 3.06 188 161 A 63 VAL HGy% B 20 LEU HG 1.0 0.00 6.26 189 162 A 63 VAL HGy% B 22 LEU HBy 1.0 0.00 6.08 190 163 A 63 VAL HGy% B 22 LEU HD11 1.0 0.00 4.38 191 164 A 63 VAL HGy% B 22 LEU HD2y 1.0 0.00 4.83 192 165 A 64 ILE HA B 20 LEU HD11 1.0 0.00 6.05 193 165 A 64 ILE HA B 20 LEU HD21 1.0 0.00 6.05 194 166 A 65 LEU HA B 20 LEU HD11 1.0 0.00 6.15 195 166 A 65 LEU HA B 20 LEU HD21 1.0 0.00 6.15 196 167 A 65 LEU HBx B 20 LEU HD11 1.0 0.00 6.74 197 167 A 65 LEU HBx B 20 LEU HD21 1.0 0.00 6.74 198 168 A 65 LEU HBy B 20 LEU HD11 1.0 0.00 5.91 199 168 A 65 LEU HBy B 20 LEU HD21 1.0 0.00 5.91 200 169 A 65 LEU HD1% B 20 LEU HBy 1.0 0.00 4.65 201 170 A 65 LEU HD1% B 20 LEU HBx 1.0 0.00 5.72 202 171 A 65 LEU HD1% B 20 LEU HD11 1.0 0.00 3.37 203 171 A 65 LEU HD1% B 20 LEU HD21 1.0 0.00 3.37 204 172 A 65 LEU HD1% B 20 LEU H 1.0 0.00 6.06 205 173 A 65 LEU HD1% B 21 ASP H 1.0 0.00 6.24 206 174 A 65 LEU HD2% B 20 LEU HBx 1.0 0.00 6.31 207 175 A 65 LEU HD2% B 20 LEU HD11 1.0 0.00 3.25 208 175 A 65 LEU HD2% B 20 LEU HD21 1.0 0.00 3.25 209 176 A 65 LEU HG B 20 LEU HD11 1.0 0.00 4.55 210 176 A 65 LEU HG B 20 LEU HD21 1.0 0.00 4.55 211 177 A 71 TYR HE% B 20 LEU HD11 1.0 0.00 3.73 212 177 A 71 TYR HE% B 20 LEU HD21 1.0 0.00 3.73 213 178 A 71 TYR HE% B 22 LEU HD11 1.0 0.00 4.85 214 179 A 71 TYR HE% B 22 LEU HD2y 1.0 0.00 5.85 215 180 A 73 THR HA B 20 LEU HD11 1.0 0.00 6.14 216 180 A 73 THR HA B 20 LEU HD21 1.0 0.00 6.14 217 181 A 73 THR HA B 22 LEU HD11 1.0 0.00 8.33 218 182 A 73 THR HG2% B 22 LEU HD11 1.0 0.00 4.94 219 183 A 73 THR HG2% B 22 LEU HD2y 1.0 0.00 4.70 220 184 A 75 TYR HE% B 22 LEU HD2y 1.0 0.00 6.58 221 185 A 96 THR HA B 20 LEU HD11 1.0 0.00 5.79 222 185 A 96 THR HA B 20 LEU HD21 1.0 0.00 5.79 223 186 A 97 TYR HA B 20 LEU HD11 1.0 0.00 5.07 224 186 A 97 TYR HA B 20 LEU HD21 1.0 0.00 5.07 225 187 A 97 TYR HBx B 19 THR HG1 1.0 0.00 5.73 226 188 A 97 TYR HBx B 20 LEU HBy 1.0 0.00 5.87 227 189 A 97 TYR HBx B 20 LEU HBx 1.0 0.00 6.61 228 190 A 97 TYR HBx B 20 LEU HD11 1.0 0.00 4.55 229 190 A 97 TYR HBx B 20 LEU HD21 1.0 0.00 4.55 230 191 A 97 TYR HBx B 20 LEU H 1.0 0.00 5.89 231 192 A 97 TYR HBx B 22 LEU HD11 1.0 0.00 6.67 232 193 A 97 TYR HBy B 19 THR HG1 1.0 0.00 5.92 233 194 A 97 TYR HBy B 20 LEU HBy 1.0 0.00 6.07 234 195 A 97 TYR HBy B 20 LEU HBx 1.0 0.00 6.13 235 196 A 97 TYR HBy B 20 LEU HD11 1.0 0.00 4.41 236 196 A 97 TYR HBy B 20 LEU HD21 1.0 0.00 4.41 237 197 A 97 TYR HBy B 20 LEU H 1.0 0.00 5.84 238 198 A 97 TYR HBy B 22 LEU HD11 1.0 0.00 6.85 239 199 A 97 TYR HBy B 22 LEU H 1.0 0.00 7.36 240 200 A 97 TYR HD% B 20 LEU HBx 1.0 0.00 6.26 241 201 A 97 TYR HE% B 20 LEU HBy 1.0 0.00 5.55 242 202 A 97 TYR HE% B 20 LEU HBx 1.0 0.00 5.80 243 203 A 97 TYR HE% B 20 LEU HD11 1.0 0.00 4.07 244 203 A 97 TYR HE% B 20 LEU HD21 1.0 0.00 4.07 245 204 A 99 PHE HBx B 22 LEU HD2y 1.0 0.00 6.47 246 205 A 99 PHE HBy B 22 LEU HD2y 1.0 0.00 6.08 247 206 A 104 SER HA B 20 LEU HD11 1.0 0.00 6.56 248 206 A 104 SER HA B 20 LEU HD21 1.0 0.00 6.56 249 207 A 104 SER HA B 22 LEU HBx 1.0 0.00 4.92 250 208 A 104 SER HA B 22 LEU HBy 1.0 0.00 4.75 251 209 A 104 SER HA B 22 LEU HD11 1.0 0.00 5.22 252 210 A 104 SER HA B 22 LEU HD2y 1.0 0.00 4.05 253 211 A 104 SER HA B 22 LEU H 1.0 0.00 5.36 254 212 A 104 SER HA B 23 ASN HBy 1.0 0.00 6.69 255 213 A 104 SER HA B 23 ASN HBx 1.0 0.00 6.77 256 214 A 104 SER HA B 23 ASN HD2x 1.0 0.00 6.86 257 215 A 104 SER HA B 23 ASN H 1.0 0.00 6.11 258 216 A 104 SER HBx B 22 LEU HBx 1.0 0.00 5.10 259 217 A 104 SER HBx B 22 LEU HBy 1.0 0.00 4.92 260 218 A 104 SER HBx B 22 LEU HD11 1.0 0.00 5.72 261 219 A 104 SER HBx B 22 LEU HD2y 1.0 0.00 4.88 262 220 A 104 SER HBx B 22 LEU H 1.0 0.00 5.32 263 221 A 104 SER HBx B 23 ASN HBy 1.0 0.00 5.45 264 222 A 104 SER HBx B 23 ASN HBx 1.0 0.00 5.67 265 223 A 104 SER HBx B 23 ASN HD2x 1.0 0.00 6.40 266 224 A 104 SER HBx B 23 ASN HD2y 1.0 0.00 5.47 267 225 A 104 SER HBx B 23 ASN H 1.0 0.00 5.76 268 226 A 104 SER HBy B 22 LEU HBx 1.0 0.00 5.11 269 227 A 104 SER HBy B 22 LEU HBy 1.0 0.00 5.00 270 228 A 104 SER HBy B 22 LEU HD11 1.0 0.00 5.73 271 229 A 104 SER HBy B 22 LEU HD2y 1.0 0.00 5.19 272 230 A 104 SER HBy B 22 LEU H 1.0 0.00 5.38 273 231 A 104 SER HBy B 23 ASN HBy 1.0 0.00 5.75 274 232 A 104 SER HBy B 23 ASN HBx 1.0 0.00 5.61 275 233 A 104 SER HBy B 23 ASN HD2x 1.0 0.00 6.06 276 234 A 104 SER HBy B 23 ASN HD2y 1.0 0.00 5.46 277 235 A 104 SER HBy B 23 ASN H 1.0 0.00 5.98 278 236 A 105 LYS HA B 19 THR HB 1.0 0.00 5.88 279 237 A 105 LYS HA B 19 THR HG21 1.0 0.00 6.10 280 238 A 105 LYS HA B 20 LEU HD11 1.0 0.00 5.18 281 238 A 105 LYS HA B 20 LEU HD21 1.0 0.00 5.18 282 239 A 105 LYS HA B 20 LEU H 1.0 0.00 5.39 283 240 A 105 LYS HA B 21 ASP HA 1.0 0.00 4.87 284 241 A 105 LYS HA B 21 ASP HBy 1.0 0.00 5.48 285 242 A 105 LYS HA B 21 ASP HBx 1.0 0.00 5.17 286 243 A 105 LYS HA B 21 ASP H 1.0 0.00 5.42 287 244 A 105 LYS HA B 22 LEU HBy 1.0 0.00 5.54 288 245 A 105 LYS HA B 22 LEU HD11 1.0 0.00 5.90 289 246 A 105 LYS HA B 22 LEU HD2y 1.0 0.00 5.85 290 247 A 105 LYS HA B 22 LEU H 1.0 0.00 4.69 291 248 A 105 LYS HA B 23 ASN H 1.0 0.00 7.19 292 249 B 19 THR HB A 105 LYS HBx 1.0 0.00 5.15 293 249 B 19 THR HB A 105 LYS HBy 1.0 0.00 5.15 294 250 B 19 THR HG21 A 105 LYS HBx 1.0 0.00 4.72 295 250 B 19 THR HG21 A 105 LYS HBy 1.0 0.00 4.72 296 251 B 20 LEU H A 105 LYS HBx 1.0 0.00 5.58 297 251 B 20 LEU H A 105 LYS HBy 1.0 0.00 5.58 298 252 B 21 ASP HA A 105 LYS HBx 1.0 0.00 5.83 299 252 B 21 ASP HA A 105 LYS HBy 1.0 0.00 5.83 300 253 B 21 ASP HBy A 105 LYS HBx 1.0 0.00 5.75 301 253 B 21 ASP HBy A 105 LYS HBy 1.0 0.00 5.75 302 254 B 21 ASP HBx A 105 LYS HBx 1.0 0.00 5.89 303 254 B 21 ASP HBx A 105 LYS HBy 1.0 0.00 5.89 304 255 B 21 ASP H A 105 LYS HBx 1.0 0.00 6.21 305 255 B 21 ASP H A 105 LYS HBy 1.0 0.00 6.21 306 256 B 22 LEU H A 105 LYS HBx 1.0 0.00 5.57 307 256 B 22 LEU H A 105 LYS HBy 1.0 0.00 5.57 308 257 B 19 THR HB A 105 LYS HDx 1.0 0.00 4.57 309 257 B 19 THR HB A 105 LYS HDy 1.0 0.00 4.57 310 258 B 19 THR HG21 A 105 LYS HDx 1.0 0.00 3.86 311 258 B 19 THR HG21 A 105 LYS HDy 1.0 0.00 3.86 312 259 B 20 LEU H A 105 LYS HDx 1.0 0.00 5.66 313 259 B 20 LEU H A 105 LYS HDy 1.0 0.00 5.66 314 260 B 21 ASP HA A 105 LYS HDx 1.0 0.00 6.05 315 260 B 21 ASP HA A 105 LYS HDy 1.0 0.00 6.05 316 261 B 21 ASP HBy A 105 LYS HDx 1.0 0.00 5.20 317 261 B 21 ASP HBy A 105 LYS HDy 1.0 0.00 5.20 318 262 B 21 ASP HBx A 105 LYS HDx 1.0 0.00 4.89 319 262 B 21 ASP HBx A 105 LYS HDy 1.0 0.00 4.89 320 263 B 21 ASP H A 105 LYS HDx 1.0 0.00 5.68 321 263 B 21 ASP H A 105 LYS HDy 1.0 0.00 5.68 322 264 B 22 LEU H A 105 LYS HDx 1.0 0.00 5.82 323 264 B 22 LEU H A 105 LYS HDy 1.0 0.00 5.82 324 265 B 19 THR HB A 105 LYS HEy 1.0 0.00 4.80 325 265 B 19 THR HB A 105 LYS HEx 1.0 0.00 4.80 326 266 B 19 THR HG21 A 105 LYS HEy 1.0 0.00 3.91 327 266 B 19 THR HG21 A 105 LYS HEx 1.0 0.00 3.91 328 267 B 21 ASP HA A 105 LYS HEy 1.0 0.00 6.43 329 267 B 21 ASP HA A 105 LYS HEx 1.0 0.00 6.43 330 268 B 21 ASP HBx A 105 LYS HEy 1.0 0.00 4.89 331 268 B 21 ASP HBx A 105 LYS HEx 1.0 0.00 4.89 332 269 B 21 ASP H A 105 LYS HEy 1.0 0.00 5.68 333 269 B 21 ASP H A 105 LYS HEx 1.0 0.00 5.68 334 270 B 22 LEU H A 105 LYS HEy 1.0 0.00 6.42 335 270 B 22 LEU H A 105 LYS HEx 1.0 0.00 6.42 336 271 A 105 LYS HGx B 19 THR HB 1.0 0.00 4.63 337 272 A 105 LYS HGx B 19 THR HG21 1.0 0.00 4.53 338 273 A 105 LYS HGx B 20 LEU H 1.0 0.00 5.51 339 274 A 105 LYS HGx B 21 ASP HA 1.0 0.00 5.92 340 275 A 105 LYS HGx B 21 ASP HBy 1.0 0.00 5.89 341 276 A 105 LYS HGx B 21 ASP HBx 1.0 0.00 5.29 342 277 A 105 LYS HGx B 21 ASP H 1.0 0.00 6.13 343 278 A 105 LYS HGx B 22 LEU H 1.0 0.00 5.96 344 279 A 105 LYS HGy B 19 THR HB 1.0 0.00 4.48 345 280 A 105 LYS HGy B 19 THR HG21 1.0 0.00 4.51 346 281 A 105 LYS HGy B 20 LEU H 1.0 0.00 5.34 347 282 A 105 LYS HGy B 21 ASP HA 1.0 0.00 6.09 348 283 A 105 LYS HGy B 21 ASP HBy 1.0 0.00 5.90 349 284 A 105 LYS HGy B 21 ASP HBx 1.0 0.00 5.05 350 285 A 105 LYS HGy B 21 ASP H 1.0 0.00 5.77 351 286 A 105 LYS HGy B 22 LEU H 1.0 0.00 5.74 352 287 A 106 SER HA B 19 THR HG1 1.0 0.00 5.31 353 288 A 106 SER HA B 19 THR HG21 1.0 0.00 6.40 354 289 A 106 SER HA B 20 LEU HD11 1.0 0.00 5.89 355 289 A 106 SER HA B 20 LEU HD21 1.0 0.00 5.89 356 290 A 106 SER HA B 20 LEU H 1.0 0.00 5.82 357 291 A 106 SER HBx B 19 THR HG1 1.0 0.00 5.45 358 292 A 106 SER HBx B 19 THR HG21 1.0 0.00 7.33 359 293 A 106 SER HBx B 20 LEU HBy 1.0 0.00 6.60 360 294 A 106 SER HBx B 20 LEU HBx 1.0 0.00 6.88 361 295 A 106 SER HBx B 20 LEU HD21 1.0 0.00 5.67 362 295 A 106 SER HBx B 20 LEU HD11 1.0 0.00 5.67 363 296 A 106 SER HBx B 20 LEU H 1.0 0.00 5.69 364 297 A 106 SER HBy B 19 THR HG1 1.0 0.00 5.48 365 298 A 106 SER HBy B 19 THR HG21 1.0 0.00 6.34 366 299 A 106 SER HBy B 20 LEU HBy 1.0 0.00 6.35 367 300 A 106 SER HBy B 20 LEU HBx 1.0 0.00 6.85 368 301 A 106 SER HBy B 20 LEU HD21 1.0 0.00 5.32 369 301 A 106 SER HBy B 20 LEU HD11 1.0 0.00 5.32 370 302 A 106 SER HBy B 20 LEU H 1.0 0.00 5.78 371 303 A 107 SER HA B 15 ASP H 1.0 0.00 5.06 372 304 A 107 SER HA B 19 THR HG1 1.0 0.00 5.76 373 305 A 107 SER HA B 19 THR HG21 1.0 0.00 5.30 374 306 A 107 SER HBy B 15 ASP H 1.0 0.00 7.40 375 307 A 108 TYR HA B 13 HIS HDy 1.0 0.00 5.57 376 308 A 108 TYR HA B 13 HIS H 1.0 0.00 5.35 377 309 A 108 TYR HA B 14 TYS HBy 1.0 0.00 5.82 378 310 A 108 TYR HA B 14 TYS H 1.0 0.00 5.59 379 311 A 108 TYR HA B 15 ASP HBx 1.0 0.00 6.30 380 312 A 108 TYR HA B 15 ASP HBy 1.0 0.00 6.56 381 313 A 108 TYR HA B 15 ASP H 1.0 0.00 4.03 382 314 B 14 TYS H A 108 TYR HBy 1.0 0.00 6.49 383 314 B 14 TYS H A 108 TYR HBx 1.0 0.00 6.49 384 315 B 15 ASP H A 108 TYR HBy 1.0 0.00 5.42 385 315 B 15 ASP H A 108 TYR HBx 1.0 0.00 5.42 386 316 A 108 TYR HE% B 12 GLY H 1.0 0.00 4.71 387 317 A 108 TYR HE% B 14 TYS H 1.0 0.00 4.99 388 318 A 109 VAL HA B 13 HIS HEx 1.0 0.00 6.71 389 319 A 109 VAL HA B 13 HIS H 1.0 0.00 5.64 390 320 A 109 VAL HB B 13 HIS HDy 1.0 0.00 5.13 391 321 A 109 VAL HB B 13 HIS HEx 1.0 0.00 4.65 392 322 A 109 VAL HB B 13 HIS H 1.0 0.00 5.34 393 323 A 109 VAL HB B 15 ASP HBx 1.0 0.00 5.36 394 324 A 109 VAL HB B 15 ASP HBy 1.0 0.00 5.96 395 325 A 109 VAL HB B 15 ASP H 1.0 0.00 6.54 396 326 A 109 VAL HGx% B 13 HIS HDy 1.0 0.00 4.58 397 327 A 109 VAL HGx% B 13 HIS HEx 1.0 0.00 4.38 398 328 A 109 VAL HGx% B 13 HIS H 1.0 0.00 4.96 399 329 A 109 VAL HGx% B 15 ASP HBx 1.0 0.00 4.25 400 330 A 109 VAL HGx% B 15 ASP H 1.0 0.00 5.23 401 331 A 109 VAL HGx% B 16 ASP H 1.0 0.00 6.98 402 332 A 109 VAL HGx% B 17 LYS H 1.0 0.00 6.77 403 333 A 109 VAL HGx% B 18 ASP HBx 1.0 0.00 5.86 404 334 A 109 VAL HGx% B 18 ASP H 1.0 0.00 5.74 405 335 A 109 VAL HGx% B 19 THR HG1 1.0 0.00 5.59 406 336 A 109 VAL HGx% B 19 THR HG21 1.0 0.00 5.42 407 337 A 109 VAL HGx% B 20 LEU H 1.0 0.00 5.98 408 338 A 109 VAL HGy% B 13 HIS HBy 1.0 0.00 6.01 409 339 A 109 VAL HGy% B 13 HIS HDy 1.0 0.00 3.81 410 340 A 109 VAL HGy% B 13 HIS HEx 1.0 0.00 3.35 411 341 A 109 VAL HGy% B 13 HIS H 1.0 0.00 4.13 412 342 A 109 VAL HGy% B 14 TYS H 1.0 0.00 6.08 413 343 A 109 VAL HGy% B 15 ASP HBx 1.0 0.00 3.86 414 344 A 109 VAL HGy% B 15 ASP HBy 1.0 0.00 4.95 415 345 A 109 VAL HGy% B 15 ASP HBy 1.0 0.00 4.26 416 346 A 109 VAL HGy% B 15 ASP H 1.0 0.00 4.76 417 347 A 109 VAL HGy% B 16 ASP H 1.0 0.00 5.74 418 348 A 109 VAL HGy% B 17 LYS H 1.0 0.00 6.15 419 349 A 109 VAL HGy% B 18 ASP HBx 1.0 0.00 5.20 420 350 A 109 VAL HGy% B 18 ASP H 1.0 0.00 5.15 421 351 A 109 VAL HGy% B 19 THR HG1 1.0 0.00 6.41 422 352 A 109 VAL HGy% B 19 THR HG21 1.0 0.00 6.00 423 353 A 109 VAL HGy% B 19 THR H 1.0 0.00 6.19 424 354 A 110 ILE HA B 12 GLY HAx 1.0 0.00 6.02 425 355 A 110 ILE HA B 12 GLY H 1.0 0.00 5.04 426 356 A 110 ILE HA B 13 HIS HEx 1.0 0.00 6.39 427 357 A 110 ILE HA B 13 HIS H 1.0 0.00 4.82 428 358 A 110 ILE HB B 12 GLY H 1.0 0.00 6.35 429 359 A 110 ILE HB B 13 HIS H 1.0 0.00 6.74 430 360 A 110 ILE HD1% B 11 TYS HBx 1.0 0.00 5.69 431 361 A 110 ILE HD1% B 11 TYS H 1.0 0.00 6.15 432 362 A 110 ILE HD1% B 12 GLY HAy 1.0 0.00 6.35 433 363 A 110 ILE HD1% B 12 GLY HAx 1.0 0.00 5.93 434 364 A 110 ILE HD1% B 12 GLY H 1.0 0.00 4.77 435 365 A 110 ILE HD1% B 13 HIS H 1.0 0.00 4.77 436 366 A 110 ILE HG1x B 12 GLY H 1.0 0.00 6.06 437 367 A 110 ILE HG1x B 13 HIS H 1.0 0.00 5.59 438 368 A 110 ILE HG1y B 12 GLY H 1.0 0.00 5.87 439 369 A 110 ILE HG1y B 13 HIS H 1.0 0.00 5.49 440 370 A 110 ILE HG2% B 10 ASP HBx 1.0 0.00 5.36 441 371 A 110 ILE HG2% B 10 ASP H 1.0 0.00 5.52 442 372 A 110 ILE HG2% B 11 TYS HBx 1.0 0.00 5.13 443 373 A 110 ILE HG2% B 11 TYS H 1.0 0.00 5.48 444 374 A 110 ILE HG2% B 12 GLY HAy 1.0 0.00 6.73 445 375 A 110 ILE HG2% B 12 GLY HAx 1.0 0.00 6.00 446 376 A 110 ILE HG2% B 12 GLY H 1.0 0.00 4.67 447 377 A 110 ILE HG2% B 13 HIS H 1.0 0.00 4.87 448 378 A 111 ASN HBx B 10 ASP HBx 1.0 0.00 6.78 449 379 A 111 ASN HBx B 13 HIS HEx 1.0 0.00 6.11 450 380 A 111 ASN HBy B 10 ASP HBx 1.0 0.00 6.30 451 381 A 111 ASN HBy B 13 HIS HEx 1.0 0.00 5.87 452 382 A 48 TYR HE% B 10 ASP H 1.0 0.00 6.00 453 383 A 48 TYR HD% B 11 TYS H 1.0 0.00 6.00 454 384 A 48 TYR HE% B 11 TYS H 1.0 0.00 6.00 455 385 A 48 TYR HD% B 11 TYS HBy 1.0 0.00 6.00 456 386 A 48 TYR HE% B 11 TYS HBy 1.0 0.00 6.00 457 387 A 108 TYR HE% B 12 GLY H 1.0 0.00 6.00 458 388 A 108 TYR HE% B 12 GLY HAy 1.0 0.00 6.00 459 389 A 108 TYR HE% B 13 HIS H 1.0 0.00 6.00 460 390 A 108 TYR HE% B 14 TYS H 1.0 0.00 6.00 461 391 A 108 TYR HE% B 14 TYS HBy 1.0 0.00 6.00 462 392 A 97 TYR HE% B 18 ASP H 1.0 0.00 6.00 463 393 A 97 TYR HE% B 18 ASP HBy 1.0 0.00 6.00 464 394 A 97 TYR HD% B 19 THR HB 1.0 0.00 6.00 465 395 A 97 TYR HD% B 19 THR HG1 1.0 0.00 6.00 466 396 A 97 TYR HE% B 19 THR HG1 1.0 0.00 6.00 467 397 A 97 TYR HD% B 19 THR HG21 1.0 0.00 6.00 468 398 A 97 TYR HE% B 19 THR HG21 1.0 0.00 6.00 469 399 A 97 TYR HD% B 20 LEU H 1.0 0.00 6.00 470 400 A 97 TYR HE% B 20 LEU H 1.0 0.00 6.00 471 401 A 99 PHE HZ B 20 LEU H 1.0 0.00 6.00 472 402 A 97 TYR HD% B 20 LEU HA 1.0 0.00 6.00 473 403 A 97 TYR HE% B 20 LEU HA 1.0 0.00 6.00 474 404 A 71 TYR HD% B 20 LEU HBx 1.0 0.00 6.00 475 405 A 71 TYR HE% B 20 LEU HBx 1.0 0.00 6.00 476 406 A 97 TYR HD% B 20 LEU HBx 1.0 0.00 6.00 477 407 A 97 TYR HE% B 20 LEU HBx 1.0 0.00 6.00 478 408 A 99 PHE HE% B 20 LEU HBx 1.0 0.00 6.00 479 409 A 99 PHE HZ B 20 LEU HBx 1.0 0.00 6.00 480 410 A 97 TYR HD% B 20 LEU HBy 1.0 0.00 6.00 481 411 A 97 TYR HE% B 20 LEU HBy 1.0 0.00 6.00 482 412 A 99 PHE HE% B 20 LEU HBy 1.0 0.00 6.00 483 413 A 99 PHE HZ B 20 LEU HBy 1.0 0.00 6.00 484 414 A 71 TYR HD% B 20 LEU HD21 1.0 0.00 6.00 485 414 A 71 TYR HD% B 20 LEU HD11 1.0 0.00 6.00 486 415 A 71 TYR HE% B 20 LEU HD21 1.0 0.00 6.00 487 415 A 71 TYR HE% B 20 LEU HD11 1.0 0.00 6.00 488 416 A 97 TYR HD% B 20 LEU HD21 1.0 0.00 6.00 489 416 A 97 TYR HD% B 20 LEU HD11 1.0 0.00 6.00 490 417 A 97 TYR HE% B 20 LEU HD21 1.0 0.00 6.00 491 417 A 97 TYR HE% B 20 LEU HD11 1.0 0.00 6.00 492 418 A 99 PHE HD% B 20 LEU HD21 1.0 0.00 6.00 493 418 A 99 PHE HD% B 20 LEU HD11 1.0 0.00 6.00 494 419 A 99 PHE HE% B 20 LEU HD21 1.0 0.00 6.00 495 419 A 99 PHE HE% B 20 LEU HD11 1.0 0.00 6.00 496 420 A 99 PHE HZ B 20 LEU HD21 1.0 0.00 6.00 497 420 A 99 PHE HZ B 20 LEU HD11 1.0 0.00 6.00 498 421 A 99 PHE HD% B 20 LEU HG 1.0 0.00 6.00 499 422 A 99 PHE HE% B 20 LEU HG 1.0 0.00 6.00 500 423 A 99 PHE HZ B 20 LEU HG 1.0 0.00 6.00 501 424 A 99 PHE HD% B 22 LEU H 1.0 0.00 6.00 502 425 A 99 PHE HE% B 22 LEU H 1.0 0.00 6.00 503 426 A 99 PHE HZ B 22 LEU H 1.0 0.00 6.00 504 427 A 99 PHE HE% B 22 LEU HBy 1.0 0.00 6.00 505 428 A 99 PHE HZ B 22 LEU HBy 1.0 0.00 6.00 506 429 A 99 PHE HD% B 22 LEU HBx 1.0 0.00 6.00 507 430 A 99 PHE HE% B 22 LEU HBx 1.0 0.00 6.00 508 431 A 99 PHE HZ B 22 LEU HBx 1.0 0.00 6.00 509 432 A 71 TYR HD% B 22 LEU HD11 1.0 0.00 6.00 510 433 A 71 TYR HE% B 22 LEU HD11 1.0 0.00 6.00 511 434 A 99 PHE HD% B 22 LEU HD11 1.0 0.00 6.00 512 435 A 99 PHE HE% B 22 LEU HD11 1.0 0.00 6.00 513 436 A 99 PHE HZ B 22 LEU HD11 1.0 0.00 6.00 514 437 A 71 TYR HE% B 22 LEU HD2y 1.0 0.00 6.00 515 438 A 99 PHE HD% B 22 LEU HD2y 1.0 0.00 6.00 516 439 A 99 PHE HE% B 22 LEU HD2y 1.0 0.00 6.00 517 440 A 99 PHE HZ B 22 LEU HD2y 1.0 0.00 6.00 518 441 A 48 TYR HE% B 8 THR HG21 1.0 0.00 6.27 519 442 A 48 TYR HE% B 9 PRO HBx 1.0 0.00 6.28 520 443 A 48 TYR HE% B 9 PRO HGy 1.0 0.00 5.80 521 443 A 48 TYR HE% B 9 PRO HGx 1.0 0.00 5.80 522 444 A 110 ILE HG2% B 10 ASP HBy 1.0 0.00 5.53 523 445 A 111 ASN H B 10 ASP HBy 1.0 0.00 7.00 524 446 A 110 ILE HG2% B 10 ASP HBx 1.0 0.00 7.16 525 447 A 111 ASN H B 10 ASP HBx 1.0 0.00 7.09 526 448 A 48 TYR HD% B 11 TYS HBy 1.0 0.00 7.03 527 449 B 11 TYS HBy A 51 LYS HBx 1.0 0.00 6.96 528 450 B 11 TYS HBy A 51 LYS HDx 1.0 0.00 6.77 529 451 A 52 GLY HAy B 11 TYS HBy 1.0 0.00 6.58 530 452 A 52 GLY HAx B 11 TYS HBy 1.0 0.00 4.70 531 453 A 110 ILE HD1% B 11 TYS HBy 1.0 0.00 5.80 532 454 A 48 TYR HBy B 11 TYS HBx 1.0 0.00 6.40 533 455 A 48 TYR HD% B 11 TYS HBx 1.0 0.00 6.64 534 456 A 48 TYR HE% B 11 TYS HBx 1.0 0.00 7.06 535 457 B 11 TYS HBx A 51 LYS HBx 1.0 0.00 6.49 536 458 B 11 TYS HBx A 51 LYS HDx 1.0 0.00 6.08 537 459 A 52 GLY HAy B 11 TYS HBx 1.0 0.00 5.52 538 460 A 52 GLY HAx B 11 TYS HBx 1.0 0.00 4.25 539 461 A 110 ILE HD1% B 11 TYS HBx 1.0 0.00 6.56 540 462 A 52 GLY HAy B 11 TYS H 1.0 0.00 8.00 541 463 A 110 ILE HD1% B 11 TYS H 1.0 0.00 7.45 542 464 A 110 ILE HG2% B 11 TYS H 1.0 0.00 6.73 543 465 A 108 TYR HE% B 12 GLY HAy 1.0 0.00 7.45 544 466 A 108 TYR HE% B 12 GLY HAx 1.0 0.00 7.20 545 467 A 48 TYR HBx B 12 GLY H 1.0 0.00 6.84 546 468 A 48 TYR HBy B 12 GLY H 1.0 0.00 7.60 547 469 A 48 TYR HD% B 12 GLY H 1.0 0.00 6.66 548 470 A 48 TYR HE% B 12 GLY H 1.0 0.00 7.10 549 471 A 49 LEU HD2% B 12 GLY H 1.0 0.00 6.85 550 472 A 52 GLY HAy B 12 GLY H 1.0 0.00 6.51 551 473 A 108 TYR HE% B 12 GLY H 1.0 0.00 4.15 552 474 A 110 ILE HA B 12 GLY H 1.0 0.00 4.96 553 475 A 110 ILE HB B 12 GLY H 1.0 0.00 6.60 554 476 A 110 ILE HD1% B 12 GLY H 1.0 0.00 4.79 555 477 A 110 ILE HG1x B 12 GLY H 1.0 0.00 5.74 556 478 A 110 ILE HG1y B 12 GLY H 1.0 0.00 5.28 557 479 A 110 ILE HG2% B 12 GLY H 1.0 0.00 5.01 558 480 A 111 ASN H B 12 GLY H 1.0 0.00 6.20 559 481 A 108 TYR HE% B 13 HIS HBx 1.0 0.00 5.81 560 482 A 108 TYR HE% B 13 HIS HBy 1.0 0.00 7.69 561 483 A 109 VAL HGy% B 13 HIS HDy 1.0 0.00 2.93 562 483 A 109 VAL HGx% B 13 HIS HDy 1.0 0.00 2.93 563 484 A 109 VAL HGy% B 13 HIS HEx 1.0 0.00 2.48 564 484 A 109 VAL HGx% B 13 HIS HEx 1.0 0.00 2.48 565 485 A 110 ILE HB B 13 HIS HEx 1.0 0.00 5.15 566 486 A 110 ILE HG2% B 13 HIS HEx 1.0 0.00 7.08 567 487 A 111 ASN HD2y B 13 HIS HEx 1.0 0.00 3.74 568 488 A 111 ASN HD2x B 13 HIS HEx 1.0 0.00 3.64 569 489 A 49 LEU HD2% B 13 HIS H 1.0 0.00 8.59 570 490 A 53 THR HG2% B 13 HIS H 1.0 0.00 6.82 571 491 A 108 TYR HE% B 13 HIS H 1.0 0.00 4.33 572 492 A 109 VAL HA B 13 HIS H 1.0 0.00 6.51 573 493 A 109 VAL HB B 13 HIS H 1.0 0.00 5.46 574 494 A 109 VAL HGy% B 13 HIS H 1.0 0.00 3.54 575 494 A 109 VAL HGx% B 13 HIS H 1.0 0.00 3.54 576 495 A 109 VAL H B 13 HIS H 1.0 0.00 3.47 577 496 A 110 ILE HA B 13 HIS H 1.0 0.00 4.54 578 497 A 110 ILE HD1% B 13 HIS H 1.0 0.00 4.93 579 498 A 110 ILE HG1x B 13 HIS H 1.0 0.00 5.59 580 499 A 110 ILE HG2% B 13 HIS H 1.0 0.00 5.54 581 500 A 110 ILE H B 13 HIS H 1.0 0.00 6.50 582 501 A 111 ASN H B 13 HIS H 1.0 0.00 5.72 583 502 A 108 TYR HA B 14 TYS HBx 1.0 0.00 5.92 584 503 A 108 TYR HE% B 14 TYS HBx 1.0 0.00 6.17 585 504 A 108 TYR HA B 14 TYS HBy 1.0 0.00 6.75 586 505 A 108 TYR HE% B 14 TYS HBy 1.0 0.00 7.03 587 506 B 14 TYS H A 108 TYR HBy 1.0 0.00 7.93 588 506 B 14 TYS H A 108 TYR HBx 1.0 0.00 7.93 589 507 A 108 TYR HE% B 14 TYS H 1.0 0.00 4.82 590 508 A 109 VAL H B 14 TYS H 1.0 0.00 6.65 591 509 A 109 VAL HGy% B 15 ASP HBx 1.0 0.00 3.24 592 509 A 109 VAL HGx% B 15 ASP HBx 1.0 0.00 3.24 593 510 A 109 VAL HGy% B 15 ASP HBy 1.0 0.00 3.72 594 510 A 109 VAL HGx% B 15 ASP HBy 1.0 0.00 3.72 595 511 A 107 SER HA B 15 ASP H 1.0 0.00 5.69 596 512 A 108 TYR HA B 15 ASP H 1.0 0.00 3.51 597 513 B 15 ASP H A 108 TYR HBy 1.0 0.00 6.32 598 513 B 15 ASP H A 108 TYR HBx 1.0 0.00 6.32 599 514 A 108 TYR HD% B 15 ASP H 1.0 0.00 7.82 600 515 A 108 TYR HE% B 15 ASP H 1.0 0.00 6.87 601 516 A 109 VAL HA B 15 ASP H 1.0 0.00 7.47 602 517 A 109 VAL HGy% B 15 ASP H 1.0 0.00 4.69 603 517 A 109 VAL HGx% B 15 ASP H 1.0 0.00 4.69 604 518 A 109 VAL H B 15 ASP H 1.0 0.00 4.60 605 519 A 109 VAL HGy% B 16 ASP H 1.0 0.00 7.15 606 519 A 109 VAL HGx% B 16 ASP H 1.0 0.00 7.15 607 520 A 109 VAL HGy% B 17 LYS H 1.0 0.00 7.13 608 520 A 109 VAL HGx% B 17 LYS H 1.0 0.00 7.13 609 521 A 109 VAL HGy% B 18 ASP HBy 1.0 0.00 3.02 610 521 A 109 VAL HGx% B 18 ASP HBy 1.0 0.00 3.02 611 522 A 109 VAL HGy% B 18 ASP HBx 1.0 0.00 5.09 612 522 A 109 VAL HGx% B 18 ASP HBx 1.0 0.00 5.09 613 523 A 97 TYR HD% B 18 ASP H 1.0 0.00 7.36 614 524 A 97 TYR HE% B 18 ASP H 1.0 0.00 8.28 615 525 A 109 VAL HGy% B 18 ASP H 1.0 0.00 5.15 616 525 A 109 VAL HGx% B 18 ASP H 1.0 0.00 5.15 617 526 A 105 LYS HA B 19 THR HB 1.0 0.00 6.95 618 527 B 19 THR HB A 105 LYS HBx 1.0 0.00 6.26 619 528 B 19 THR HB A 105 LYS HBy 1.0 0.00 5.90 620 529 B 19 THR HB A 105 LYS HDx 1.0 0.00 4.67 621 529 B 19 THR HB A 105 LYS HDy 1.0 0.00 4.67 622 530 A 105 LYS HGx B 19 THR HB 1.0 0.00 4.84 623 531 A 105 LYS HGy B 19 THR HB 1.0 0.00 4.90 624 532 A 106 SER H B 19 THR HB 1.0 0.00 5.12 625 533 A 97 TYR HBx B 19 THR HG1 1.0 0.00 6.05 626 534 A 97 TYR HBy B 19 THR HG1 1.0 0.00 7.04 627 535 A 97 TYR HD% B 19 THR HG1 1.0 0.00 4.89 628 536 A 98 PHE H B 19 THR HG1 1.0 0.00 7.84 629 537 A 106 SER HA B 19 THR HG1 1.0 0.00 6.62 630 538 A 106 SER HBx B 19 THR HG1 1.0 0.00 5.29 631 539 A 106 SER HBy B 19 THR HG1 1.0 0.00 5.49 632 540 A 106 SER H B 19 THR HG1 1.0 0.00 5.60 633 541 A 107 SER HA B 19 THR HG1 1.0 0.00 7.23 634 542 A 107 SER H B 19 THR HG1 1.0 0.00 6.71 635 543 A 108 TYR H B 19 THR HG1 1.0 0.00 6.69 636 544 A 109 VAL HGy% B 19 THR HG1 1.0 0.00 6.06 637 544 A 109 VAL HGx% B 19 THR HG1 1.0 0.00 6.06 638 545 A 105 LYS HA B 19 THR HG21 1.0 0.00 6.55 639 546 B 19 THR HG21 A 105 LYS HDx 1.0 0.00 3.11 640 546 B 19 THR HG21 A 105 LYS HDy 1.0 0.00 3.11 641 547 B 19 THR HG21 A 105 LYS HEy 1.0 0.00 3.67 642 547 B 19 THR HG21 A 105 LYS HEx 1.0 0.00 3.67 643 548 A 105 LYS HGx B 19 THR HG21 1.0 0.00 3.88 644 549 A 105 LYS HGy B 19 THR HG21 1.0 0.00 3.93 645 550 A 106 SER H B 19 THR HG21 1.0 0.00 4.55 646 551 A 107 SER HA B 19 THR HG21 1.0 0.00 4.91 647 552 A 97 TYR HD% B 19 THR H 1.0 0.00 5.72 648 553 A 97 TYR HE% B 19 THR H 1.0 0.00 5.24 649 554 B 19 THR H A 105 LYS HBy 1.0 0.00 8.06 650 555 A 105 LYS HGx B 19 THR H 1.0 0.00 8.73 651 556 A 105 LYS HGy B 19 THR H 1.0 0.00 6.03 652 557 A 63 VAL HGx% B 20 LEU HBy 1.0 0.00 6.40 653 558 A 97 TYR HBx B 20 LEU HBy 1.0 0.00 6.36 654 559 A 97 TYR HD% B 20 LEU HBy 1.0 0.00 4.41 655 560 A 97 TYR HE% B 20 LEU HBy 1.0 0.00 6.33 656 561 A 99 PHE HE% B 20 LEU HBy 1.0 0.00 5.68 657 562 A 99 PHE HZ B 20 LEU HBy 1.0 0.00 4.15 658 563 A 106 SER HBy B 20 LEU HBy 1.0 0.00 6.20 659 564 A 106 SER H B 20 LEU HBy 1.0 0.00 6.37 660 565 A 63 VAL HGx% B 20 LEU HBx 1.0 0.00 7.31 661 566 A 65 LEU HD1% B 20 LEU HBx 1.0 0.00 6.80 662 567 A 97 TYR HBx B 20 LEU HBx 1.0 0.00 7.49 663 568 A 97 TYR HD% B 20 LEU HBx 1.0 0.00 4.78 664 569 A 97 TYR HE% B 20 LEU HBx 1.0 0.00 6.14 665 570 A 99 PHE HE% B 20 LEU HBx 1.0 0.00 6.45 666 571 A 99 PHE HZ B 20 LEU HBx 1.0 0.00 4.58 667 572 A 106 SER HBy B 20 LEU HBx 1.0 0.00 6.83 668 573 A 106 SER H B 20 LEU HBx 1.0 0.00 7.34 669 574 A 62 MET HA B 20 LEU HD11 1.0 0.00 7.23 670 574 A 62 MET HA B 20 LEU HD21 1.0 0.00 7.23 671 575 A 63 VAL HA B 20 LEU HD11 1.0 0.00 5.30 672 575 A 63 VAL HA B 20 LEU HD21 1.0 0.00 5.30 673 576 A 63 VAL HB B 20 LEU HD11 1.0 0.00 3.09 674 576 A 63 VAL HB B 20 LEU HD21 1.0 0.00 3.09 675 577 A 63 VAL HGx% B 20 LEU HD11 1.0 0.00 2.45 676 577 A 63 VAL HGx% B 20 LEU HD21 1.0 0.00 2.45 677 578 A 63 VAL HGy% B 20 LEU HD11 1.0 0.00 2.20 678 578 A 63 VAL HGy% B 20 LEU HD21 1.0 0.00 2.20 679 579 A 63 VAL H B 20 LEU HD11 1.0 0.00 4.50 680 579 A 63 VAL H B 20 LEU HD21 1.0 0.00 4.50 681 580 A 64 ILE H B 20 LEU HD11 1.0 0.00 6.10 682 580 A 64 ILE H B 20 LEU HD21 1.0 0.00 6.10 683 581 A 65 LEU HD1% B 20 LEU HD11 1.0 0.00 2.49 684 581 A 65 LEU HD1% B 20 LEU HD21 1.0 0.00 2.49 685 582 A 65 LEU HD2% B 20 LEU HD11 1.0 0.00 2.43 686 582 A 65 LEU HD2% B 20 LEU HD21 1.0 0.00 2.43 687 583 A 65 LEU HG B 20 LEU HD11 1.0 0.00 4.69 688 583 A 65 LEU HG B 20 LEU HD21 1.0 0.00 4.69 689 584 A 71 TYR HD% B 20 LEU HD11 1.0 0.00 2.42 690 584 A 71 TYR HD% B 20 LEU HD21 1.0 0.00 2.42 691 585 A 71 TYR HE% B 20 LEU HD11 1.0 0.00 3.15 692 585 A 71 TYR HE% B 20 LEU HD21 1.0 0.00 3.15 693 586 A 72 TYR H B 20 LEU HD11 1.0 0.00 5.85 694 586 A 72 TYR H B 20 LEU HD21 1.0 0.00 5.85 695 587 A 96 THR HA B 20 LEU HD11 1.0 0.00 6.64 696 587 A 96 THR HA B 20 LEU HD21 1.0 0.00 6.64 697 588 A 97 TYR HA B 20 LEU HD11 1.0 0.00 6.16 698 588 A 97 TYR HA B 20 LEU HD21 1.0 0.00 6.16 699 589 A 97 TYR HBx B 20 LEU HD11 1.0 0.00 4.17 700 589 A 97 TYR HBx B 20 LEU HD21 1.0 0.00 4.17 701 590 A 97 TYR HBy B 20 LEU HD11 1.0 0.00 4.03 702 590 A 97 TYR HBy B 20 LEU HD21 1.0 0.00 4.03 703 591 A 97 TYR HD% B 20 LEU HD11 1.0 0.00 2.59 704 591 A 97 TYR HD% B 20 LEU HD21 1.0 0.00 2.59 705 592 A 97 TYR HE% B 20 LEU HD11 1.0 0.00 3.47 706 592 A 97 TYR HE% B 20 LEU HD21 1.0 0.00 3.47 707 593 A 97 TYR H B 20 LEU HD11 1.0 0.00 4.85 708 593 A 97 TYR H B 20 LEU HD21 1.0 0.00 4.85 709 594 A 99 PHE HD% B 20 LEU HD11 1.0 0.00 4.71 710 594 A 99 PHE HD% B 20 LEU HD21 1.0 0.00 4.71 711 595 A 99 PHE HE% B 20 LEU HD11 1.0 0.00 3.34 712 595 A 99 PHE HE% B 20 LEU HD21 1.0 0.00 3.34 713 596 A 99 PHE HZ B 20 LEU HD11 1.0 0.00 2.45 714 596 A 99 PHE HZ B 20 LEU HD21 1.0 0.00 2.45 715 597 A 105 LYS HA B 20 LEU HD11 1.0 0.00 6.11 716 597 A 105 LYS HA B 20 LEU HD21 1.0 0.00 6.11 717 598 A 106 SER HBy B 20 LEU HD21 1.0 0.00 4.70 718 598 A 106 SER HBy B 20 LEU HD11 1.0 0.00 4.70 719 599 A 106 SER H B 20 LEU HD11 1.0 0.00 4.89 720 599 A 106 SER H B 20 LEU HD21 1.0 0.00 4.89 721 600 A 99 PHE HE% B 20 LEU HG 1.0 0.00 6.18 722 601 A 99 PHE HZ B 20 LEU HG 1.0 0.00 4.43 723 602 A 97 TYR HD% B 20 LEU H 1.0 0.00 4.45 724 603 A 97 TYR HE% B 20 LEU H 1.0 0.00 4.23 725 604 A 105 LYS HA B 20 LEU H 1.0 0.00 6.75 726 605 B 20 LEU H A 105 LYS HBx 1.0 0.00 7.53 727 606 B 20 LEU H A 105 LYS HBy 1.0 0.00 6.98 728 607 B 20 LEU H A 105 LYS HDx 1.0 0.00 6.53 729 607 B 20 LEU H A 105 LYS HDy 1.0 0.00 6.53 730 608 A 105 LYS HGx B 20 LEU H 1.0 0.00 7.33 731 609 A 105 LYS HGy B 20 LEU H 1.0 0.00 7.00 732 610 A 106 SER HBx B 20 LEU H 1.0 0.00 5.94 733 611 A 106 SER H B 20 LEU H 1.0 0.00 4.41 734 612 A 107 SER H B 20 LEU H 1.0 0.00 7.15 735 613 A 109 VAL HGy% B 20 LEU H 1.0 0.00 7.28 736 613 A 109 VAL HGx% B 20 LEU H 1.0 0.00 7.28 737 614 A 99 PHE HE% B 21 ASP HA 1.0 0.00 6.93 738 615 A 105 LYS HA B 21 ASP HA 1.0 0.00 3.85 739 616 B 21 ASP HA A 105 LYS HBx 1.0 0.00 8.76 740 617 B 21 ASP HA A 105 LYS HBy 1.0 0.00 7.70 741 618 B 21 ASP HA A 105 LYS HDx 1.0 0.00 7.00 742 618 B 21 ASP HA A 105 LYS HDy 1.0 0.00 7.00 743 619 A 105 LYS HGx B 21 ASP HA 1.0 0.00 8.21 744 620 A 105 LYS HGy B 21 ASP HA 1.0 0.00 9.03 745 621 A 106 SER H B 21 ASP HA 1.0 0.00 6.49 746 622 A 105 LYS HA B 21 ASP HBy 1.0 0.00 6.84 747 623 B 21 ASP HBy A 105 LYS HBy 1.0 0.00 7.20 748 624 B 21 ASP HBy A 105 LYS HDx 1.0 0.00 6.14 749 624 B 21 ASP HBy A 105 LYS HDy 1.0 0.00 6.14 750 625 A 105 LYS HGy B 21 ASP HBy 1.0 0.00 6.42 751 626 A 105 LYS HA B 21 ASP HBx 1.0 0.00 6.72 752 627 B 21 ASP HBx A 105 LYS HBx 1.0 0.00 7.48 753 628 B 21 ASP HBx A 105 LYS HBy 1.0 0.00 6.92 754 629 B 21 ASP HBx A 105 LYS HDx 1.0 0.00 5.59 755 629 B 21 ASP HBx A 105 LYS HDy 1.0 0.00 5.59 756 630 A 105 LYS HGx B 21 ASP HBx 1.0 0.00 6.86 757 631 A 105 LYS HGy B 21 ASP HBx 1.0 0.00 6.14 758 632 B 21 ASP H A 105 LYS HBx 1.0 0.00 7.72 759 633 B 21 ASP H A 105 LYS HBy 1.0 0.00 7.72 760 634 A 105 LYS HA B 21 ASP H 1.0 0.00 6.51 761 635 A 105 LYS HGx B 21 ASP H 1.0 0.00 7.75 762 636 A 106 SER H B 21 ASP H 1.0 0.00 6.71 763 637 A 99 PHE HD% B 22 LEU HBx 1.0 0.00 7.62 764 638 A 99 PHE HE% B 22 LEU HBx 1.0 0.00 6.00 765 639 A 99 PHE HZ B 22 LEU HBx 1.0 0.00 7.00 766 640 A 104 SER HA B 22 LEU HBx 1.0 0.00 5.54 767 641 A 104 SER HBx B 22 LEU HBx 1.0 0.00 5.55 768 642 A 104 SER HBy B 22 LEU HBx 1.0 0.00 5.68 769 643 A 63 VAL HGx% B 22 LEU HBy 1.0 0.00 5.02 770 644 A 104 SER HA B 22 LEU HBy 1.0 0.00 4.91 771 645 A 104 SER HBx B 22 LEU HBy 1.0 0.00 5.31 772 646 A 104 SER HBy B 22 LEU HBy 1.0 0.00 5.42 773 647 A 105 LYS HA B 22 LEU HBy 1.0 0.00 6.82 774 648 A 61 LYS HEx B 22 LEU HD11 1.0 0.00 6.12 775 649 A 61 LYS HEy B 22 LEU HD11 1.0 0.00 5.63 776 650 A 61 LYS HGy B 22 LEU HD11 1.0 0.00 5.70 777 651 A 63 VAL HB B 22 LEU HD11 1.0 0.00 5.85 778 652 A 63 VAL HGx% B 22 LEU HD11 1.0 0.00 2.67 779 653 A 63 VAL HGy% B 22 LEU HD11 1.0 0.00 3.85 780 654 A 71 TYR HE% B 22 LEU HD11 1.0 0.00 5.21 781 655 A 99 PHE HD% B 22 LEU HD11 1.0 0.00 5.77 782 656 A 99 PHE HE% B 22 LEU HD11 1.0 0.00 4.21 783 657 A 99 PHE HZ B 22 LEU HD11 1.0 0.00 3.86 784 658 A 104 SER HA B 22 LEU HD11 1.0 0.00 6.01 785 659 A 104 SER HBx B 22 LEU HD11 1.0 0.00 6.52 786 660 A 104 SER HBy B 22 LEU HD11 1.0 0.00 6.87 787 661 A 105 LYS HA B 22 LEU HD11 1.0 0.00 7.18 788 662 A 61 LYS HDx B 22 LEU HD2y 1.0 0.00 5.09 789 663 A 61 LYS HEx B 22 LEU HD2y 1.0 0.00 3.58 790 664 A 61 LYS HEy B 22 LEU HD2y 1.0 0.00 3.05 791 665 A 61 LYS HGy B 22 LEU HD2y 1.0 0.00 5.78 792 666 A 62 MET HA B 22 LEU HD2y 1.0 0.00 7.58 793 667 A 63 VAL HB B 22 LEU HD2y 1.0 0.00 5.66 794 668 A 63 VAL HGx% B 22 LEU HD2y 1.0 0.00 2.87 795 669 A 71 TYR HE% B 22 LEU HD2y 1.0 0.00 7.20 796 670 A 73 THR HG2% B 22 LEU HD2y 1.0 0.00 4.68 797 671 A 99 PHE HBx B 22 LEU HD2y 1.0 0.00 6.58 798 672 A 99 PHE HD% B 22 LEU HD2y 1.0 0.00 4.49 799 673 A 99 PHE HE% B 22 LEU HD2y 1.0 0.00 3.94 800 674 A 99 PHE HZ B 22 LEU HD2y 1.0 0.00 4.28 801 675 A 104 SER HA B 22 LEU HD2y 1.0 0.00 3.60 802 676 A 104 SER HBx B 22 LEU HD2y 1.0 0.00 4.92 803 677 A 104 SER HBy B 22 LEU HD2y 1.0 0.00 5.11 804 678 A 105 LYS HA B 22 LEU HD2y 1.0 0.00 6.69 805 679 A 105 LYS H B 22 LEU HD2y 1.0 0.00 7.59 806 680 A 99 PHE HD% B 22 LEU HG 1.0 0.00 6.12 807 680 A 99 PHE HD% B 22 LEU HBy 1.0 0.00 6.12 808 681 A 99 PHE HE% B 22 LEU HG 1.0 0.00 4.21 809 681 A 99 PHE HE% B 22 LEU HBy 1.0 0.00 4.21 810 682 A 99 PHE HZ B 22 LEU HG 1.0 0.00 4.70 811 682 A 99 PHE HZ B 22 LEU HBy 1.0 0.00 4.70 812 683 A 63 VAL HGx% B 22 LEU H 1.0 0.00 8.29 813 684 A 99 PHE HD% B 22 LEU H 1.0 0.00 8.03 814 685 A 99 PHE HE% B 22 LEU H 1.0 0.00 5.60 815 686 A 99 PHE HZ B 22 LEU H 1.0 0.00 7.85 816 687 A 104 SER HA B 22 LEU H 1.0 0.00 6.16 817 688 A 104 SER HBx B 22 LEU H 1.0 0.00 6.11 818 689 A 104 SER HBy B 22 LEU H 1.0 0.00 6.05 819 690 A 105 LYS HA B 22 LEU H 1.0 0.00 4.98 820 691 B 22 LEU H A 105 LYS HBx 1.0 0.00 8.20 821 692 B 22 LEU H A 105 LYS HBy 1.0 0.00 7.17 822 693 B 22 LEU H A 105 LYS HDx 1.0 0.00 7.05 823 693 B 22 LEU H A 105 LYS HDy 1.0 0.00 7.05 824 694 A 105 LYS HGx B 22 LEU H 1.0 0.00 7.12 825 695 A 105 LYS HGy B 22 LEU H 1.0 0.00 7.12 826 696 A 105 LYS H B 22 LEU H 1.0 0.00 7.84 827 697 A 106 SER H B 22 LEU H 1.0 0.00 6.33 828 698 A 104 SER HBx B 23 ASN HBy 1.0 0.00 6.43 829 699 A 104 SER HBy B 23 ASN HBy 1.0 0.00 5.89 830 700 A 104 SER HBx B 23 ASN HBx 1.0 0.00 6.47 831 701 A 104 SER HBy B 23 ASN HBx 1.0 0.00 6.57 832 702 A 104 SER HBx B 23 ASN HD2x 1.0 0.00 6.08 833 703 A 104 SER HBx B 23 ASN HD2y 1.0 0.00 5.72 834 704 A 104 SER HBy B 23 ASN HD2y 1.0 0.00 5.46 835 705 A 104 SER HBx B 23 ASN H 1.0 0.00 6.73 836 706 A 104 SER HBy B 23 ASN H 1.0 0.00 6.59 837 707 A 49 LEU HA A 53 THR HG1 1.0 0.00 5.21 838 708 A 49 LEU HD1% A 53 THR HG1 1.0 0.00 5.06 839 709 A 49 LEU HD2% A 53 THR HG1 1.0 0.00 4.73 840 710 A 49 LEU HG A 53 THR HG1 1.0 0.00 5.14 841 711 A 50 LYS HA A 53 THR HG1 1.0 0.00 4.48 842 712 A 50 LYS HBx A 53 THR HG1 1.0 0.00 5.52 843 713 A 53 THR HG1 A 50 LYS HGx 1.0 0.00 5.81 844 714 A 53 THR HG1 A 50 LYS HGy 1.0 0.00 6.03 845 715 A 53 THR HG1 A 52 GLY HAy 1.0 0.00 6.88 846 716 A 53 THR HG1 A 52 GLY HAx 1.0 0.00 6.76 847 717 A 53 THR HG1 A 53 THR HA 1.0 0.00 4.72 848 718 A 53 THR HG1 A 53 THR HB 1.0 0.00 4.59 849 719 A 53 THR HG1 A 53 THR HG2% 1.0 0.00 3.53 850 720 A 53 THR HG1 A 56 SER HA 1.0 0.00 5.25 851 721 A 53 THR HG1 A 56 SER HBx 1.0 0.00 4.87 852 722 A 53 THR HG1 A 56 SER HBy 1.0 0.00 4.95 853 723 A 41 LEU HD2% A 96 THR HG1 1.0 0.00 4.00 854 724 A 41 LEU HD1% A 96 THR HG1 1.0 0.00 5.19 855 725 A 45 LEU HD2% A 96 THR HG1 1.0 0.00 4.00 856 726 A 45 LEU HD1% A 96 THR HG1 1.0 0.00 4.76 857 727 A 64 ILE HA A 96 THR HG1 1.0 0.00 4.75 858 728 A 64 ILE HD1% A 96 THR HG1 1.0 0.00 5.19 859 729 A 64 ILE HG1x A 96 THR HG1 1.0 0.00 5.75 860 730 A 64 ILE HG1y A 96 THR HG1 1.0 0.00 5.31 861 731 A 64 ILE HG2% A 96 THR HG1 1.0 0.00 4.09 862 732 A 66 THR HG2% A 96 THR HG1 1.0 0.00 7.00 863 733 A 96 THR HG1 A 93 MET HBx 1.0 0.00 6.19 864 734 A 96 THR HG1 A 93 MET HBy 1.0 0.00 5.77 865 735 A 96 THR HG1 A 93 MET HE% 1.0 0.00 3.60 866 736 A 96 THR HG1 A 93 MET HGx 1.0 0.00 4.37 867 736 A 96 THR HG1 A 93 MET HGy 1.0 0.00 4.37 868 737 A 96 THR HG1 A 95 LYS HA 1.0 0.00 4.99 869 738 A 96 THR HA A 96 THR HG1 1.0 0.00 4.43 870 739 A 96 THR HG1 A 96 THR HB 1.0 0.00 3.88 871 740 A 96 THR HG1 A 96 THR HG2% 1.0 0.00 3.84 872 741 A 96 THR HG1 A 97 TYR HA 1.0 0.00 6.44 873 742 A 96 THR HG1 A 109 VAL HGx% 1.0 1.09 7.00 874 743 A 96 THR HG1 A 109 VAL HGy% 1.0 1.25 7.00 875 744 A 96 THR HG1 A 110 ILE HB 1.0 0.00 4.93 876 745 A 110 ILE HD1% A 96 THR HG1 1.0 0.00 5.46 877 746 A 110 ILE HG2% A 96 THR HG1 1.0 0.00 4.49 878 747 A 53 THR HG1 A 53 THR H 1.0 0.00 3.79 879 748 A 45 LEU HA A 96 THR HG1 1.0 0.00 6.92 880 749 A 63 VAL H A 96 THR HG1 1.0 0.00 7.64 881 750 A 96 THR HG1 A 93 MET HA 1.0 0.00 7.02 882 751 A 96 THR HG1 A 96 THR H 1.0 0.00 4.68 883 752 A 97 TYR H A 96 THR HG1 1.0 0.00 4.27 884 753 A 96 THR HG1 A 109 VAL HA 1.0 0.10 7.00 885 754 A 96 THR HG1 A 109 VAL HB 1.0 1.82 7.00 886 755 A 96 THR HG1 A 109 VAL HGx% 1.0 0.00 6.27 887 756 A 96 THR HG1 A 110 ILE H 1.0 0.00 7.13 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 66 THR H A 70 GLY O 1.0 1.8 2.2 2 2 A 70 GLY O A 66 THR N 1.0 2.7 3.1 3 3 A 72 TYR H A 64 ILE O 1.0 1.8 2.2 4 4 A 64 ILE O A 72 TYR N 1.0 2.7 3.1 5 5 A 64 ILE H A 72 TYR O 1.0 1.8 2.2 6 6 A 72 TYR O A 64 ILE N 1.0 2.7 3.1 7 7 A 74 VAL H A 62 MET O 1.0 1.8 2.2 8 8 A 62 MET O A 74 VAL N 1.0 2.7 3.1 9 9 A 62 MET H A 74 VAL O 1.0 1.8 2.2 10 10 A 74 VAL O A 62 MET N 1.0 2.7 3.1 11 11 A 95 LYS H A 65 LEU O 1.0 1.8 2.2 12 12 A 65 LEU O A 95 LYS N 1.0 2.7 3.1 13 13 A 65 LEU H A 95 LYS O 1.0 1.8 2.2 14 14 A 95 LYS O A 65 LEU N 1.0 2.7 3.1 15 15 A 97 TYR H A 63 VAL O 1.0 1.8 2.2 16 16 A 63 VAL O A 97 TYR N 1.0 2.7 3.1 17 17 A 63 VAL H A 97 TYR O 1.0 1.8 2.2 18 18 A 97 TYR O A 63 VAL N 1.0 2.7 3.1 19 19 A 112 GLY H A 94 TYR O 1.0 1.8 2.2 20 20 A 94 TYR O A 112 GLY N 1.0 2.7 3.1 21 21 A 96 THR H A 110 ILE O 1.0 1.8 2.2 22 22 A 110 ILE O A 96 THR N 1.0 2.7 3.1 23 23 A 110 ILE H A 96 THR O 1.0 1.8 2.2 24 24 A 96 THR O A 110 ILE N 1.0 2.7 3.1 25 25 A 98 PHE H A 108 TYR O 1.0 1.8 2.2 26 26 A 108 TYR O A 98 PHE N 1.0 2.7 3.1 27 27 B 22 LEU H A 104 SER O 1.0 1.8 2.2 28 28 A 104 SER O B 22 LEU N 1.0 2.7 3.1 29 29 A 106 SER H B 20 LEU O 1.0 1.8 2.2 30 30 B 20 LEU O A 106 SER N 1.0 2.7 3.1 31 31 A 109 VAL H B 13 HIS O 1.0 1.8 2.2 32 32 B 13 HIS O A 109 VAL N 1.0 2.7 3.1 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 33 GLY C A 34 LEU N A 34 LEU CA A 34 LEU C 1.0 -147.0 -51.0 PHI 2 2 A 36 THR C A 37 THR N A 37 THR CA A 37 THR C 1.0 -152.0 -72.0 PHI 3 3 A 37 THR C A 38 LEU N A 38 LEU CA A 38 LEU C 1.0 -87.0 -43.0 PHI 4 4 A 38 LEU C A 39 GLY N A 39 GLY CA A 39 GLY C 1.0 -81.0 -53.0 PHI 5 5 A 39 GLY C A 40 LYS N A 40 LYS CA A 40 LYS C 1.0 -86.0 -50.0 PHI 6 6 A 40 LYS C A 41 LEU N A 41 LEU CA A 41 LEU C 1.0 -70.0 -58.0 PHI 7 7 A 41 LEU C A 42 ASP N A 42 ASP CA A 42 ASP C 1.0 -73.0 -49.0 PHI 8 8 A 42 ASP C A 43 GLU N A 43 GLU CA A 43 GLU C 1.0 -82.0 -46.0 PHI 9 9 A 43 GLU C A 44 ARG N A 44 ARG CA A 44 ARG C 1.0 -81.0 -53.0 PHI 10 10 A 44 ARG C A 45 LEU N A 45 LEU CA A 45 LEU C 1.0 -70.0 -50.0 PHI 11 11 A 45 LEU C A 46 ARG N A 46 ARG CA A 46 ARG C 1.0 -71.0 -55.0 PHI 12 12 A 46 ARG C A 47 ASN N A 47 ASN CA A 47 ASN C 1.0 -71.0 -55.0 PHI 13 13 A 47 ASN C A 48 TYR N A 48 TYR CA A 48 TYR C 1.0 -77.0 -53.0 PHI 14 14 A 48 TYR C A 49 LEU N A 49 LEU CA A 49 LEU C 1.0 -70.0 -54.0 PHI 15 15 A 49 LEU C A 50 LYS N A 50 LYS CA A 50 LYS C 1.0 -74.0 -54.0 PHI 16 16 A 50 LYS C A 51 LYS N A 51 LYS CA A 51 LYS C 1.0 -103.0 -51.0 PHI 17 17 A 60 GLU C A 61 LYS N A 61 LYS CA A 61 LYS C 1.0 -180.0 -136.0 PHI 18 18 A 61 LYS C A 62 MET N A 62 MET CA A 62 MET C 1.0 -159.0 -111.0 PHI 19 19 A 62 MET C A 63 VAL N A 63 VAL CA A 63 VAL C 1.0 -138.0 -102.0 PHI 20 20 A 63 VAL C A 64 ILE N A 64 ILE CA A 64 ILE C 1.0 -165.0 -93.0 PHI 21 21 A 64 ILE C A 65 LEU N A 65 LEU CA A 65 LEU C 1.0 -137.0 -77.0 PHI 22 22 A 65 LEU C A 66 THR N A 66 THR CA A 66 THR C 1.0 -166.0 -82.0 PHI 23 23 A 66 THR C A 67 GLU N A 67 GLU CA A 67 GLU C 1.0 -169.0 -21.0 PHI 24 24 A 70 GLY C A 71 TYR N A 71 TYR CA A 71 TYR C 1.0 -151.0 -83.0 PHI 25 25 A 71 TYR C A 72 TYR N A 72 TYR CA A 72 TYR C 1.0 -149.0 -89.0 PHI 26 26 A 72 TYR C A 73 THR N A 73 THR CA A 73 THR C 1.0 -135.0 -63.0 PHI 27 27 A 73 THR C A 74 VAL N A 74 VAL CA A 74 VAL C 1.0 -143.0 -95.0 PHI 28 28 A 74 VAL C A 75 TYR N A 75 TYR CA A 75 TYR C 1.0 -108.0 -40.0 PHI 29 29 A 75 TYR C A 76 LEU N A 76 LEU CA A 76 LEU C 1.0 -121.0 -57.0 PHI 30 30 A 76 LEU C A 77 ASN N A 77 ASN CA A 77 ASN C 1.0 -96.0 -68.0 PHI 31 31 A 77 ASN C A 78 THR N A 78 THR CA A 78 THR C 1.0 -149.0 -61.0 PHI 32 32 A 78 THR C A 79 PRO N A 79 PRO CA A 79 PRO C 1.0 -113.0 -37.0 PHI 33 33 A 79 PRO C A 80 LEU N A 80 LEU CA A 80 LEU C 1.0 -140.0 -32.0 PHI 34 34 A 80 LEU C A 81 ALA N A 81 ALA CA A 81 ALA C 1.0 -138.0 -30.0 PHI 35 35 A 81 ALA C A 82 GLU N A 82 GLU CA A 82 GLU C 1.0 -78.0 -46.0 PHI 36 36 A 82 GLU C A 83 ASP N A 83 ASP CA A 83 ASP C 1.0 -88.0 -52.0 PHI 37 37 A 83 ASP C A 84 ARG N A 84 ARG CA A 84 ARG C 1.0 -121.0 -57.0 PHI 38 38 A 84 ARG C A 85 LYS N A 85 LYS CA A 85 LYS C 1.0 -70.0 -46.0 PHI 39 39 A 85 LYS C A 86 ASN N A 86 ASN CA A 86 ASN C 1.0 -128.0 -80.0 PHI 40 40 A 86 ASN C A 87 VAL N A 87 VAL CA A 87 VAL C 1.0 -138.0 -42.0 PHI 41 41 A 87 VAL C A 88 GLU N A 88 GLU CA A 88 GLU C 1.0 -107.0 -55.0 PHI 42 42 A 91 GLY C A 92 LYS N A 92 LYS CA A 92 LYS C 1.0 -127.0 -47.0 PHI 43 43 A 92 LYS C A 93 MET N A 93 MET CA A 93 MET C 1.0 -89.0 -53.0 PHI 44 44 A 94 TYR C A 95 LYS N A 95 LYS CA A 95 LYS C 1.0 -175.0 -107.0 PHI 45 45 A 95 LYS C A 96 THR N A 96 THR CA A 96 THR C 1.0 -141.0 -97.0 PHI 46 46 A 96 THR C A 97 TYR N A 97 TYR CA A 97 TYR C 1.0 -147.0 -91.0 PHI 47 47 A 97 TYR C A 98 PHE N A 98 PHE CA A 98 PHE C 1.0 -145.0 -89.0 PHI 48 48 A 98 PHE C A 99 PHE N A 99 PHE CA A 99 PHE C 1.0 -146.0 -94.0 PHI 49 49 A 99 PHE C A 100 LYS N A 100 LYS CA A 100 LYS C 1.0 -104.0 -60.0 PHI 50 50 A 102 GLY C A 103 GLU N A 103 GLU CA A 103 GLU C 1.0 -175.0 -39.0 PHI 51 51 A 104 SER C A 105 LYS N A 105 LYS CA A 105 LYS C 1.0 -171.0 -75.0 PHI 52 52 A 107 SER C A 108 TYR N A 108 TYR CA A 108 TYR C 1.0 -172.0 -84.0 PHI 53 53 A 108 TYR C A 109 VAL N A 109 VAL CA A 109 VAL C 1.0 -165.0 -93.0 PHI 54 54 A 109 VAL C A 110 ILE N A 110 ILE CA A 110 ILE C 1.0 -170.0 -66.0 PHI 55 55 A 110 ILE C A 111 ASN N A 111 ASN CA A 111 ASN C 1.0 -122.0 -62.0 PHI 56 56 A 112 GLY C A 113 PRO N A 113 PRO CA A 113 PRO C 1.0 -120.0 -24.0 PHI 57 57 A 115 LYS C A 116 THR N A 116 THR CA A 116 THR C 1.0 -193.0 -41.0 PHI 58 58 A 34 LEU N A 34 LEU CA A 34 LEU C A 35 PRO N 1.0 44.0 176.0 PSI 59 59 A 37 THR N A 37 THR CA A 37 THR C A 38 LEU N 1.0 140.0 180.0 PSI 60 60 A 38 LEU N A 38 LEU CA A 38 LEU C A 39 GLY N 1.0 -58.0 -10.0 PSI 61 61 A 39 GLY N A 39 GLY CA A 39 GLY C A 40 LYS N 1.0 -49.0 -25.0 PSI 62 62 A 40 LYS N A 40 LYS CA A 40 LYS C A 41 LEU N 1.0 -60.0 -16.0 PSI 63 63 A 41 LEU N A 41 LEU CA A 41 LEU C A 42 ASP N 1.0 -53.0 -33.0 PSI 64 64 A 42 ASP N A 42 ASP CA A 42 ASP C A 43 GLU N 1.0 -59.0 -31.0 PSI 65 65 A 43 GLU N A 43 GLU CA A 43 GLU C A 44 ARG N 1.0 -52.0 -32.0 PSI 66 66 A 44 ARG N A 44 ARG CA A 44 ARG C A 45 LEU N 1.0 -56.0 -32.0 PSI 67 67 A 45 LEU N A 45 LEU CA A 45 LEU C A 46 ARG N 1.0 -56.0 -28.0 PSI 68 68 A 46 ARG N A 46 ARG CA A 46 ARG C A 47 ASN N 1.0 -50.0 -34.0 PSI 69 69 A 47 ASN N A 47 ASN CA A 47 ASN C A 48 TYR N 1.0 -52.0 -36.0 PSI 70 70 A 48 TYR N A 48 TYR CA A 48 TYR C A 49 LEU N 1.0 -50.0 -34.0 PSI 71 71 A 49 LEU N A 49 LEU CA A 49 LEU C A 50 LYS N 1.0 -51.0 -31.0 PSI 72 72 A 50 LYS N A 50 LYS CA A 50 LYS C A 51 LYS N 1.0 -59.0 -15.0 PSI 73 73 A 51 LYS N A 51 LYS CA A 51 LYS C A 52 GLY N 1.0 -53.0 -5.0 PSI 74 74 A 61 LYS N A 61 LYS CA A 61 LYS C A 62 MET N 1.0 135.0 175.0 PSI 75 75 A 62 MET N A 62 MET CA A 62 MET C A 63 VAL N 1.0 117.0 161.0 PSI 76 76 A 63 VAL N A 63 VAL CA A 63 VAL C A 64 ILE N 1.0 117.0 145.0 PSI 77 77 A 64 ILE N A 64 ILE CA A 64 ILE C A 65 LEU N 1.0 99.0 171.0 PSI 78 78 A 65 LEU N A 65 LEU CA A 65 LEU C A 66 THR N 1.0 116.0 152.0 PSI 79 79 A 66 THR N A 66 THR CA A 66 THR C A 67 GLU N 1.0 130.0 194.0 PSI 80 80 A 67 GLU N A 67 GLU CA A 67 GLU C A 68 ASN N 1.0 131.0 187.0 PSI 81 81 A 71 TYR N A 71 TYR CA A 71 TYR C A 72 TYR N 1.0 111.0 147.0 PSI 82 82 A 72 TYR N A 72 TYR CA A 72 TYR C A 73 THR N 1.0 112.0 144.0 PSI 83 83 A 73 THR N A 73 THR CA A 73 THR C A 74 VAL N 1.0 111.0 143.0 PSI 84 84 A 74 VAL N A 74 VAL CA A 74 VAL C A 75 TYR N 1.0 105.0 157.0 PSI 85 85 A 75 TYR N A 75 TYR CA A 75 TYR C A 76 LEU N 1.0 113.0 157.0 PSI 86 86 A 76 LEU N A 76 LEU CA A 76 LEU C A 77 ASN N 1.0 -53.0 31.0 PSI 87 87 A 77 ASN N A 77 ASN CA A 77 ASN C A 78 THR N 1.0 -40.0 28.0 PSI 88 88 A 78 THR N A 78 THR CA A 78 THR C A 79 PRO N 1.0 80.0 192.0 PSI 89 89 A 79 PRO N A 79 PRO CA A 79 PRO C A 80 LEU N 1.0 121.0 153.0 PSI 90 90 A 80 LEU N A 80 LEU CA A 80 LEU C A 81 ALA N 1.0 104.0 164.0 PSI 91 91 A 81 ALA N A 81 ALA CA A 81 ALA C A 82 GLU N 1.0 96.0 184.0 PSI 92 92 A 82 GLU N A 82 GLU CA A 82 GLU C A 83 ASP N 1.0 -53.0 -5.0 PSI 93 93 A 83 ASP N A 83 ASP CA A 83 ASP C A 84 ARG N 1.0 -48.0 12.0 PSI 94 94 A 84 ARG N A 84 ARG CA A 84 ARG C A 85 LYS N 1.0 -55.0 29.0 PSI 95 95 A 85 LYS N A 85 LYS CA A 85 LYS C A 86 ASN N 1.0 -45.0 -21.0 PSI 96 96 A 86 ASN N A 86 ASN CA A 86 ASN C A 87 VAL N 1.0 -29.0 27.0 PSI 97 97 A 87 VAL N A 87 VAL CA A 87 VAL C A 88 GLU N 1.0 114.0 154.0 PSI 98 98 A 88 GLU N A 88 GLU CA A 88 GLU C A 89 LEU N 1.0 92.0 152.0 PSI 99 99 A 92 LYS N A 92 LYS CA A 92 LYS C A 93 MET N 1.0 119.0 147.0 PSI 100 100 A 95 LYS N A 95 LYS CA A 95 LYS C A 96 THR N 1.0 122.0 174.0 PSI 101 101 A 96 THR N A 96 THR CA A 96 THR C A 97 TYR N 1.0 111.0 151.0 PSI 102 102 A 97 TYR N A 97 TYR CA A 97 TYR C A 98 PHE N 1.0 115.0 171.0 PSI 103 103 A 98 PHE N A 98 PHE CA A 98 PHE C A 99 PHE N 1.0 107.0 175.0 PSI 104 104 A 99 PHE N A 99 PHE CA A 99 PHE C A 100 LYS N 1.0 98.0 162.0 PSI 105 105 A 100 LYS N A 100 LYS CA A 100 LYS C A 101 LYS N 1.0 102.0 206.0 PSI 106 106 A 103 GLU N A 103 GLU CA A 103 GLU C A 104 SER N 1.0 138.0 178.0 PSI 107 107 A 105 LYS N A 105 LYS CA A 105 LYS C A 106 SER N 1.0 111.0 175.0 PSI 108 108 A 108 TYR N A 108 TYR CA A 108 TYR C A 109 VAL N 1.0 88.0 160.0 PSI 109 109 A 109 VAL N A 109 VAL CA A 109 VAL C A 110 ILE N 1.0 122.0 166.0 PSI 110 110 A 110 ILE N A 110 ILE CA A 110 ILE C A 111 ASN N 1.0 94.0 166.0 PSI 111 111 A 111 ASN N A 111 ASN CA A 111 ASN C A 112 GLY N 1.0 94.0 178.0 PSI 112 112 A 113 PRO N A 113 PRO CA A 113 PRO C A 114 GLY N 1.0 106.0 182.0 PSI 113 113 A 116 THR N A 116 THR CA A 116 THR C A 117 ASN N 1.0 113.0 205.0 PSI 114 114 B 8 THR O B 8 THR C B 9 PRO N B 9 PRO CD 1.0 162.0 198.0 OMEGA 115 115 B 8 THR CA B 8 THR C B 9 PRO N B 9 PRO CD 1.0 -18.0 18.0 . 116 116 B 24 THR O B 24 THR C B 25 PRO N B 25 PRO CD 1.0 162.0 198.0 OMEGA 117 117 B 24 THR CA B 24 THR C B 25 PRO N B 25 PRO CD 1.0 -18.0 18.0 . 118 118 A 44 ARG CD A 44 ARG NE A 44 ARG CZ A 44 ARG NH2 1.0 170.0 190.0 . 119 119 A 46 ARG CD A 46 ARG NE A 46 ARG CZ A 46 ARG NH2 1.0 170.0 190.0 . 120 120 A 84 ARG CD A 84 ARG NE A 84 ARG CZ A 84 ARG NH2 1.0 170.0 190.0 . 121 121 A 44 ARG CD A 44 ARG NE A 44 ARG CZ A 44 ARG NH1 1.0 -10.0 10.0 CHI5 122 122 A 46 ARG CD A 46 ARG NE A 46 ARG CZ A 46 ARG NH1 1.0 -10.0 10.0 CHI5 123 123 A 84 ARG CD A 84 ARG NE A 84 ARG CZ A 84 ARG NH1 1.0 -10.0 10.0 CHI5 stop_ save_