data_nef_c16572_2kpw 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 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 GLY middle . false 3 A 3 HIS middle . . 4 A 4 HIS middle . . 5 A 5 HIS middle . . 6 A 6 HIS middle . . 7 A 7 HIS middle . . 8 A 8 HIS middle . . 9 A 9 SER middle . . 10 A 10 HIS middle . . 11 A 11 MET middle . . 12 A 12 THR middle . . 13 A 13 GLY middle . false 14 A 14 ASN middle . . 15 A 15 VAL middle . . 16 A 16 CYS middle . . 17 A 17 ILE middle . . 18 A 18 GLU middle . . 19 A 19 GLU middle . . 20 A 20 ILE middle . . 21 A 21 ASP middle . . 22 A 22 VAL middle . . 23 A 23 ASP middle . . 24 A 24 GLY middle . false 25 A 25 LYS middle . . 26 A 26 PHE middle . . 27 A 27 ILE middle . . 28 A 28 ARG middle . . 29 A 29 LEU middle . . 30 A 30 LYS middle . . 31 A 31 ASN middle . . 32 A 32 THR middle . . 33 A 33 SER middle . . 34 A 34 GLU middle . . 35 A 35 GLN middle . . 36 A 36 ASP middle . . 37 A 37 GLN middle . . 38 A 38 PRO middle . false 39 A 39 MET middle . . 40 A 40 GLY middle . false 41 A 41 GLY middle . false 42 A 42 TRP middle . . 43 A 43 GLU middle . . 44 A 44 MET middle . . 45 A 45 ILE middle . . 46 A 46 ARG middle . . 47 A 47 LYS middle . . 48 A 48 ILE middle . . 49 A 49 GLY middle . false 50 A 50 ASP middle . . 51 A 51 THR middle . . 52 A 52 SER middle . . 53 A 53 VAL middle . . 54 A 54 SER middle . . 55 A 55 TYR middle . . 56 A 56 LYS middle . . 57 A 57 TYR middle . . 58 A 58 THR middle . . 59 A 59 SER middle . . 60 A 60 ARG middle . . 61 A 61 TYR middle . . 62 A 62 VAL middle . . 63 A 63 LEU middle . . 64 A 64 LYS middle . . 65 A 65 ALA middle . . 66 A 66 GLY middle . false 67 A 67 GLN middle . . 68 A 68 THR middle . . 69 A 69 VAL middle . . 70 A 70 THR middle . . 71 A 71 ILE middle . . 72 A 72 TRP middle . . 73 A 73 ALA middle . . 74 A 74 ALA middle . . 75 A 75 ASN middle . . 76 A 76 ALA middle . . 77 A 77 GLY middle . false 78 A 78 VAL middle . . 79 A 79 THR middle . . 80 A 80 ALA middle . . 81 A 81 SER middle . . 82 A 82 PRO middle . false 83 A 83 PRO middle . true 84 A 84 THR middle . . 85 A 85 ASP middle . . 86 A 86 LEU middle . . 87 A 87 ILE middle . . 88 A 88 TRP middle . . 89 A 89 LYS middle . . 90 A 90 ASN middle . . 91 A 91 GLN middle . . 92 A 92 ASN middle . . 93 A 93 SER middle . . 94 A 94 TRP middle . . 95 A 95 GLY middle . false 96 A 96 THR middle . . 97 A 97 GLY middle . false 98 A 98 GLU middle . . 99 A 99 ASP middle . . 100 A 100 VAL middle . . 101 A 101 LYS middle . . 102 A 102 VAL middle . . 103 A 103 ILE middle . . 104 A 104 LEU middle . . 105 A 105 LYS middle . . 106 A 106 ASN middle . . 107 A 107 SER middle . . 108 A 108 GLN middle . . 109 A 109 GLY middle . false 110 A 110 GLU middle . . 111 A 111 GLU middle . . 112 A 112 VAL middle . . 113 A 113 ALA middle . . 114 A 114 GLN middle . . 115 A 115 ARG middle . . 116 A 116 SER middle . . 117 A 117 THR middle . . 118 A 118 VAL middle . . 119 A 119 PHE middle . . 120 A 120 LYS middle . . 121 A 121 THR middle . . 122 A 122 THR end . . stop_ save_ save_assigned_chemical_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_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 3 HIS H H 1 8.528 0.05 A 3 HIS HA H 1 4.626 0.05 A 3 HIS HBx H 1 3.04 0.05 A 3 HIS HBy H 1 3.14 0.05 A 3 HIS CA C 13 55.26 0.5 A 3 HIS CB C 13 29.25 0.5 A 3 HIS N N 15 118.99 0.5 A 4 HIS H H 1 8.528 0.05 A 4 HIS HA H 1 4.624 0.05 A 4 HIS HBx H 1 3.05 0.05 A 4 HIS HBy H 1 3.11 0.05 A 4 HIS CA C 13 55.277 0.5 A 4 HIS CB C 13 29.002 0.5 A 4 HIS N N 15 118.99 0.5 A 5 HIS H H 1 8.579 0.05 A 5 HIS HA H 1 4.737 0.05 A 5 HIS HBx H 1 3.249 0.05 A 5 HIS HBy H 1 3.249 0.05 A 5 HIS CA C 13 55.33 0.5 A 5 HIS CB C 13 29.257 0.5 A 5 HIS N N 15 119.72 0.5 A 6 HIS H H 1 8.603 0.05 A 6 HIS HA H 1 4.674 0.05 A 6 HIS HBx H 1 3.157 0.05 A 6 HIS HBy H 1 3.157 0.05 A 6 HIS CA C 13 55.15 0.5 A 6 HIS CB C 13 27.34 0.5 A 6 HIS N N 15 121.42 0.5 A 7 HIS H H 1 8.706 0.05 A 7 HIS HA H 1 4.658 0.05 A 7 HIS HBx H 1 3.157 0.05 A 7 HIS HBy H 1 3.157 0.05 A 7 HIS CA C 13 55.1 0.5 A 7 HIS CB C 13 29.3 0.5 A 7 HIS N N 15 121.2 0.5 A 8 HIS H H 1 8.706 0.05 A 8 HIS HA H 1 4.706 0.05 A 8 HIS HBx H 1 3.178 0.05 A 8 HIS HBy H 1 3.180 0.05 A 8 HIS CA C 13 55.156 0.5 A 8 HIS CB C 13 29.396 0.5 A 8 HIS N N 15 121.2 0.5 A 9 SER H H 1 8.551 0.05 A 9 SER HA H 1 4.45 0.05 A 9 SER HBx H 1 3.849 0.05 A 9 SER HBy H 1 3.849 0.05 A 9 SER CA C 13 58.2 0.5 A 9 SER CB C 13 63.74 0.5 A 9 SER N N 15 118.046 0.5 A 10 HIS H H 1 8.77 0.05 A 10 HIS HA H 1 4.726 0.05 A 10 HIS HBx H 1 3.194 0.05 A 10 HIS HBy H 1 3.194 0.05 A 10 HIS CA C 13 55.640 0.5 A 10 HIS CB C 13 29.172 0.5 A 10 HIS N N 15 120.412 0.5 A 11 MET H H 1 8.528 0.05 A 11 MET HA H 1 4.658 0.05 A 11 MET HBx H 1 2.06 0.05 A 11 MET HBy H 1 2.17 0.05 A 11 MET HE% H 1 2.095 0.05 A 11 MET HGx H 1 2.271 0.05 A 11 MET HGy H 1 2.348 0.05 A 11 MET CA C 13 55.438 0.5 A 11 MET CB C 13 33.09 0.5 A 11 MET CE C 13 16.85 0.5 A 11 MET CG C 13 33.49 0.5 A 11 MET N N 15 122.4 0.5 A 12 THR H H 1 8.339 0.05 A 12 THR HA H 1 4.45 0.05 A 12 THR HB H 1 4.263 0.05 A 12 THR HG2% H 1 1.253 0.05 A 12 THR CA C 13 61.81 0.5 A 12 THR CB C 13 70.45 0.5 A 12 THR CG2 C 13 21.43 0.5 A 12 THR N N 15 115.7 0.5 A 13 GLY H H 1 8.426 0.05 A 13 GLY HAy H 1 4.287 0.05 A 13 GLY HAx H 1 3.877 0.05 A 13 GLY CA C 13 45.243 0.5 A 13 GLY N N 15 110.872 0.5 A 14 ASN H H 1 8.374 0.05 A 14 ASN HA H 1 4.72 0.05 A 14 ASN HBx H 1 2.82 0.05 A 14 ASN HBy H 1 2.935 0.05 A 14 ASN HD2x H 1 7.041 0.05 A 14 ASN HD2y H 1 7.47 0.05 A 14 ASN CA C 13 54.2 0.5 A 14 ASN CB C 13 39.21 0.5 A 14 ASN N N 15 117.789 0.5 A 14 ASN ND2 N 15 112.3 0.5 A 15 VAL H H 1 7.89 0.05 A 15 VAL HA H 1 4.843 0.05 A 15 VAL HB H 1 1.927 0.05 A 15 VAL HGx% H 1 0.688 0.05 A 15 VAL HGy% H 1 0.807 0.05 A 15 VAL CA C 13 61.759 0.5 A 15 VAL CB C 13 33.23 0.5 A 15 VAL CGy C 13 22.09 0.5 A 15 VAL CGx C 13 21.73 0.5 A 15 VAL N N 15 118.720 0.5 A 16 CYS H H 1 9.060 0.05 A 16 CYS HA H 1 4.899 0.05 A 16 CYS HBx H 1 2.947 0.05 A 16 CYS HBy H 1 3.02 0.05 A 16 CYS CA C 13 54.62 0.5 A 16 CYS CB C 13 30.9 0.5 A 16 CYS N N 15 122.674 0.5 A 17 ILE H H 1 8.845 0.05 A 17 ILE HA H 1 4.153 0.05 A 17 ILE HB H 1 1.736 0.05 A 17 ILE HD1% H 1 0.682 0.05 A 17 ILE HG1x H 1 1.429 0.05 A 17 ILE HG1y H 1 1.429 0.05 A 17 ILE HG2% H 1 0.660 0.05 A 17 ILE CA C 13 61.08 0.5 A 17 ILE CB C 13 36.397 0.5 A 17 ILE CD1 C 13 14.554 0.5 A 17 ILE CG1 C 13 27.23 0.5 A 17 ILE CG2 C 13 18.364 0.5 A 17 ILE N N 15 122.609 0.5 A 18 GLU H H 1 8.917 0.05 A 18 GLU HA H 1 4.23 0.05 A 18 GLU HBx H 1 1.74 0.05 A 18 GLU HBy H 1 1.77 0.05 A 18 GLU HGx H 1 2.25 0.05 A 18 GLU HGy H 1 2.25 0.05 A 18 GLU CA C 13 57.16 0.5 A 18 GLU CB C 13 30.55 0.5 A 18 GLU CG C 13 34.18 0.5 A 18 GLU N N 15 130.894 0.5 A 19 GLU H H 1 7.853 0.05 A 19 GLU HA H 1 4.47 0.05 A 19 GLU HBx H 1 1.802 0.05 A 19 GLU HBy H 1 2.181 0.05 A 19 GLU HGx H 1 2.030 0.05 A 19 GLU HGy H 1 2.370 0.05 A 19 GLU CA C 13 56.11 0.5 A 19 GLU CB C 13 33.847 0.5 A 19 GLU CG C 13 35.383 0.5 A 19 GLU N N 15 115.069 0.5 A 20 ILE H H 1 8.744 0.05 A 20 ILE HA H 1 4.080 0.05 A 20 ILE HB H 1 1.687 0.05 A 20 ILE HD1% H 1 0.754 0.05 A 20 ILE HG1x H 1 0.751 0.05 A 20 ILE HG1y H 1 0.751 0.05 A 20 ILE HG2% H 1 0.952 0.05 A 20 ILE CA C 13 60.619 0.5 A 20 ILE CB C 13 39.17 0.5 A 20 ILE CD1 C 13 14.186 0.5 A 20 ILE CG1 C 13 27.544 0.5 A 20 ILE CG2 C 13 17.63 0.5 A 20 ILE N N 15 127.309 0.5 A 21 ASP H H 1 7.468 0.05 A 21 ASP HA H 1 3.949 0.05 A 21 ASP HBx H 1 0.366 0.05 A 21 ASP HBy H 1 1.842 0.05 A 21 ASP CA C 13 54.97 0.5 A 21 ASP CB C 13 42.17 0.5 A 21 ASP N N 15 124.858 0.5 A 22 VAL H H 1 8.65 0.05 A 22 VAL HA H 1 3.998 0.05 A 22 VAL HB H 1 2.215 0.05 A 22 VAL HGx% H 1 1.057 0.05 A 22 VAL HGy% H 1 1.057 0.05 A 22 VAL CA C 13 64.445 0.5 A 22 VAL CB C 13 31.244 0.5 A 22 VAL CGx C 13 20.355 0.5 A 22 VAL CGy C 13 20.355 0.5 A 22 VAL N N 15 130.172 0.5 A 23 ASP H H 1 7.482 0.05 A 23 ASP HA H 1 4.711 0.05 A 23 ASP HBx H 1 2.812 0.05 A 23 ASP HBy H 1 2.812 0.05 A 23 ASP CA C 13 53.92 0.5 A 23 ASP CB C 13 40.100 0.5 A 23 ASP N N 15 118.547 0.5 A 24 GLY H H 1 7.22 0.05 A 24 GLY HAy H 1 2.95 0.05 A 24 GLY HAx H 1 2.407 0.05 A 24 GLY CA C 13 45.04 0.5 A 24 GLY N N 15 105.293 0.5 A 25 LYS H H 1 8.757 0.05 A 25 LYS HA H 1 3.964 0.05 A 25 LYS HBx H 1 2.105 0.05 A 25 LYS HBy H 1 2.105 0.05 A 25 LYS HDx H 1 1.772 0.05 A 25 LYS HDy H 1 1.772 0.05 A 25 LYS HEx H 1 3.019 0.05 A 25 LYS HEy H 1 3.019 0.05 A 25 LYS HGy H 1 1.33 0.05 A 25 LYS HGx H 1 1.194 0.05 A 25 LYS CA C 13 56.59 0.5 A 25 LYS CB C 13 33.66 0.5 A 25 LYS CD C 13 29.16 0.5 A 25 LYS CE C 13 41.92 0.5 A 25 LYS CG C 13 25.37 0.5 A 25 LYS N N 15 111.753 0.5 A 26 PHE H H 1 6.380 0.05 A 26 PHE HA H 1 5.753 0.05 A 26 PHE HBy H 1 2.230 0.05 A 26 PHE HBx H 1 1.865 0.05 A 26 PHE HDx H 1 6.51 0.05 A 26 PHE HDy H 1 6.51 0.05 A 26 PHE HEx H 1 6.911 0.05 A 26 PHE HEy H 1 6.911 0.05 A 26 PHE HZ H 1 7.15 0.05 A 26 PHE CA C 13 56.37 0.5 A 26 PHE CB C 13 40.03 0.5 A 26 PHE CDx C 13 132.9 0.5 A 26 PHE CDy C 13 132.9 0.5 A 26 PHE CEx C 13 130.0 0.5 A 26 PHE CEy C 13 130.0 0.5 A 26 PHE CZ C 13 130.0 0.5 A 26 PHE N N 15 110.097 0.5 A 27 ILE H H 1 8.601 0.05 A 27 ILE HA H 1 4.506 0.05 A 27 ILE HB H 1 1.422 0.05 A 27 ILE HD1% H 1 0.887 0.05 A 27 ILE HG1x H 1 1.155 0.05 A 27 ILE HG1y H 1 2.070 0.05 A 27 ILE HG2% H 1 0.962 0.05 A 27 ILE CA C 13 60.905 0.5 A 27 ILE CB C 13 43.249 0.5 A 27 ILE CD1 C 13 14.86 0.5 A 27 ILE CG1 C 13 29.33 0.5 A 27 ILE CG2 C 13 18.427 0.5 A 27 ILE N N 15 119.676 0.5 A 28 ARG H H 1 9.290 0.05 A 28 ARG HA H 1 5.561 0.05 A 28 ARG HBy H 1 1.80 0.05 A 28 ARG HBx H 1 1.615 0.05 A 28 ARG HDx H 1 3.034 0.05 A 28 ARG HDy H 1 3.034 0.05 A 28 ARG HGx H 1 1.40 0.05 A 28 ARG HGy H 1 1.60 0.05 A 28 ARG CA C 13 54.65 0.5 A 28 ARG CB C 13 34.18 0.5 A 28 ARG CD C 13 43.192 0.5 A 28 ARG CG C 13 28.379 0.5 A 28 ARG N N 15 127.516 0.5 A 29 LEU H H 1 9.502 0.05 A 29 LEU HA H 1 5.306 0.05 A 29 LEU HBx H 1 1.437 0.05 A 29 LEU HBy H 1 1.629 0.05 A 29 LEU HDx% H 1 0.758 0.05 A 29 LEU HDy% H 1 0.811 0.05 A 29 LEU HG H 1 1.57 0.05 A 29 LEU CA C 13 54.01 0.5 A 29 LEU CB C 13 44.02 0.5 A 29 LEU CDy C 13 26.6 0.5 A 29 LEU CDx C 13 26.07 0.5 A 29 LEU CG C 13 28.39 0.5 A 29 LEU N N 15 126.696 0.5 A 30 LYS H H 1 8.641 0.05 A 30 LYS HA H 1 5.108 0.05 A 30 LYS HBx H 1 1.493 0.05 A 30 LYS HBy H 1 1.63 0.05 A 30 LYS HDx H 1 1.357 0.05 A 30 LYS HDy H 1 1.357 0.05 A 30 LYS HEx H 1 2.698 0.05 A 30 LYS HEy H 1 2.698 0.05 A 30 LYS HGx H 1 0.81 0.05 A 30 LYS HGy H 1 0.998 0.05 A 30 LYS CA C 13 54.66 0.5 A 30 LYS CB C 13 38.07 0.5 A 30 LYS CD C 13 29.15 0.5 A 30 LYS CE C 13 41.81 0.5 A 30 LYS CG C 13 25.20 0.5 A 30 LYS N N 15 118.761 0.5 A 31 ASN H H 1 8.397 0.05 A 31 ASN HA H 1 5.319 0.05 A 31 ASN HBy H 1 3.426 0.05 A 31 ASN HBx H 1 2.269 0.05 A 31 ASN HD2x H 1 6.611 0.05 A 31 ASN HD2y H 1 8.038 0.05 A 31 ASN CA C 13 50.69 0.5 A 31 ASN CB C 13 37.49 0.5 A 31 ASN N N 15 123.996 0.5 A 31 ASN ND2 N 15 111.1 0.5 A 32 THR H H 1 8.455 0.05 A 32 THR HA H 1 4.302 0.05 A 32 THR HB H 1 4.591 0.05 A 32 THR HG2% H 1 1.156 0.05 A 32 THR CA C 13 61.492 0.5 A 32 THR CB C 13 68.11 0.5 A 32 THR CG2 C 13 22.15 0.5 A 32 THR N N 15 115.755 0.5 A 33 SER H H 1 8.487 0.05 A 33 SER HA H 1 4.793 0.05 A 33 SER HBy H 1 4.196 0.05 A 33 SER HBx H 1 3.96 0.05 A 33 SER CA C 13 57.500 0.5 A 33 SER CB C 13 66.51 0.5 A 33 SER N N 15 120.037 0.5 A 34 GLU H H 1 8.355 0.05 A 34 GLU HA H 1 4.335 0.05 A 34 GLU HBx H 1 1.878 0.05 A 34 GLU HBy H 1 2.324 0.05 A 34 GLU HGy H 1 2.393 0.05 A 34 GLU HGx H 1 2.296 0.05 A 34 GLU CA C 13 55.84 0.5 A 34 GLU CB C 13 28.93 0.5 A 34 GLU CG C 13 35.669 0.5 A 34 GLU N N 15 116.545 0.5 A 35 GLN H H 1 8.634 0.05 A 35 GLN HA H 1 4.664 0.05 A 35 GLN HBx H 1 1.880 0.05 A 35 GLN HBy H 1 1.963 0.05 A 35 GLN HE2y H 1 7.518 0.05 A 35 GLN HE2x H 1 6.838 0.05 A 35 GLN HGy H 1 2.325 0.05 A 35 GLN HGx H 1 2.253 0.05 A 35 GLN CA C 13 53.74 0.5 A 35 GLN CB C 13 31.696 0.5 A 35 GLN CG C 13 33.807 0.5 A 35 GLN N N 15 120.013 0.5 A 35 GLN NE2 N 15 112.3 0.5 A 36 ASP H H 1 8.859 0.05 A 36 ASP HA H 1 4.05 0.05 A 36 ASP HBx H 1 2.08 0.05 A 36 ASP HBy H 1 2.490 0.05 A 36 ASP CA C 13 54.64 0.5 A 36 ASP CB C 13 40.12 0.5 A 36 ASP N N 15 124.552 0.5 A 37 GLN H H 1 8.141 0.05 A 37 GLN HA H 1 4.786 0.05 A 37 GLN HBx H 1 1.618 0.05 A 37 GLN HBy H 1 1.89 0.05 A 37 GLN HE2x H 1 7.583 0.05 A 37 GLN HE2y H 1 7.989 0.05 A 37 GLN HGx H 1 1.320 0.05 A 37 GLN HGy H 1 1.845 0.05 A 37 GLN CA C 13 50.858 0.5 A 37 GLN CB C 13 31.86 0.5 A 37 GLN CG C 13 34.04 0.5 A 37 GLN N N 15 120.015 0.5 A 37 GLN NE2 N 15 118.1 0.5 A 38 PRO HA H 1 4.367 0.05 A 38 PRO HBy H 1 2.393 0.05 A 38 PRO HBx H 1 2.047 0.05 A 38 PRO HDx H 1 3.634 0.05 A 38 PRO HDy H 1 3.783 0.05 A 38 PRO HGx H 1 1.898 0.05 A 38 PRO HGy H 1 2.173 0.05 A 38 PRO CA C 13 63.33 0.5 A 38 PRO CB C 13 31.75 0.5 A 38 PRO CD C 13 51.4 0.5 A 38 PRO CG C 13 27.9 0.5 A 39 MET H H 1 8.392 0.05 A 39 MET HA H 1 2.792 0.05 A 39 MET HBx H 1 0.857 0.05 A 39 MET HBy H 1 1.54 0.05 A 39 MET HE% H 1 0.995 0.05 A 39 MET HGy H 1 1.663 0.05 A 39 MET HGx H 1 0.400 0.05 A 39 MET CA C 13 53.78 0.5 A 39 MET CB C 13 34.41 0.5 A 39 MET CE C 13 14.2 0.5 A 39 MET CG C 13 29.57 0.5 A 39 MET N N 15 124.427 0.5 A 40 GLY H H 1 7.94 0.05 A 40 GLY HAy H 1 4.154 0.05 A 40 GLY HAx H 1 3.763 0.05 A 40 GLY CA C 13 48.114 0.5 A 40 GLY N N 15 108.664 0.5 A 41 GLY H H 1 7.959 0.05 A 41 GLY HAy H 1 4.323 0.05 A 41 GLY HAx H 1 3.769 0.05 A 41 GLY CA C 13 46.02 0.5 A 41 GLY N N 15 114.027 0.5 A 42 TRP H H 1 8.667 0.05 A 42 TRP HA H 1 4.408 0.05 A 42 TRP HBx H 1 3.152 0.05 A 42 TRP HBy H 1 3.37 0.05 A 42 TRP HD1 H 1 7.075 0.05 A 42 TRP HE1 H 1 10.11 0.05 A 42 TRP HE3 H 1 6.78 0.05 A 42 TRP HH2 H 1 7.19 0.05 A 42 TRP HZ2 H 1 7.612 0.05 A 42 TRP HZ3 H 1 7.569 0.05 A 42 TRP CA C 13 58.925 0.5 A 42 TRP CB C 13 28.12 0.5 A 42 TRP CD1 C 13 124.8 0.5 A 42 TRP CE3 C 13 121.3 0.5 A 42 TRP CH2 C 13 124.4 0.5 A 42 TRP CZ2 C 13 115.9 0.5 A 42 TRP CZ3 C 13 121.2 0.5 A 42 TRP N N 15 122.097 0.5 A 42 TRP NE1 N 15 129.2 0.5 A 43 GLU H H 1 8.74 0.05 A 43 GLU HA H 1 5.462 0.05 A 43 GLU HBx H 1 1.763 0.05 A 43 GLU HBy H 1 1.955 0.05 A 43 GLU HGx H 1 2.036 0.05 A 43 GLU HGy H 1 2.117 0.05 A 43 GLU CA C 13 54.41 0.5 A 43 GLU CB C 13 33.980 0.5 A 43 GLU CG C 13 35.905 0.5 A 43 GLU N N 15 120.3 0.5 A 44 MET H H 1 9.658 0.05 A 44 MET HA H 1 5.488 0.05 A 44 MET HBx H 1 1.817 0.05 A 44 MET HBy H 1 2.226 0.05 A 44 MET HE% H 1 1.321 0.05 A 44 MET HGx H 1 2.059 0.05 A 44 MET HGy H 1 2.205 0.05 A 44 MET CA C 13 53.36 0.5 A 44 MET CB C 13 37.49 0.5 A 44 MET CE C 13 17.16 0.5 A 44 MET CG C 13 32.26 0.5 A 44 MET N N 15 126.477 0.5 A 45 ILE H H 1 9.658 0.05 A 45 ILE HA H 1 4.781 0.05 A 45 ILE HB H 1 1.732 0.05 A 45 ILE HD1% H 1 0.767 0.05 A 45 ILE HG1y H 1 1.415 0.05 A 45 ILE HG1x H 1 1.086 0.05 A 45 ILE HG2% H 1 0.812 0.05 A 45 ILE CA C 13 60.413 0.5 A 45 ILE CB C 13 40.804 0.5 A 45 ILE CD1 C 13 14.087 0.5 A 45 ILE CG1 C 13 27.956 0.5 A 45 ILE CG2 C 13 18.11 0.5 A 45 ILE N N 15 127.329 0.5 A 46 ARG H H 1 9.217 0.05 A 46 ARG HA H 1 5.083 0.05 A 46 ARG HBy H 1 1.935 0.05 A 46 ARG HBx H 1 1.331 0.05 A 46 ARG HDx H 1 2.87 0.05 A 46 ARG HDy H 1 2.87 0.05 A 46 ARG HE H 1 6.109 0.05 A 46 ARG HGy H 1 1.119 0.05 A 46 ARG HGx H 1 0.77 0.05 A 46 ARG CA C 13 53.76 0.5 A 46 ARG CB C 13 33.559 0.5 A 46 ARG CD C 13 41.80 0.5 A 46 ARG CG C 13 26.91 0.5 A 46 ARG N N 15 126.837 0.5 A 46 ARG NE N 15 81.81 0.5 A 47 LYS H H 1 9.876 0.05 A 47 LYS HA H 1 5.257 0.05 A 47 LYS HBy H 1 1.847 0.05 A 47 LYS HBx H 1 1.562 0.05 A 47 LYS HDx H 1 1.593 0.05 A 47 LYS HDy H 1 1.593 0.05 A 47 LYS HEx H 1 2.89 0.05 A 47 LYS HEy H 1 2.89 0.05 A 47 LYS HGx H 1 1.231 0.05 A 47 LYS HGy H 1 1.231 0.05 A 47 LYS CA C 13 55.26 0.5 A 47 LYS CB C 13 34.86 0.5 A 47 LYS CD C 13 29.00 0.5 A 47 LYS CE C 13 41.62 0.5 A 47 LYS CG C 13 24.55 0.5 A 47 LYS N N 15 132.271 0.5 A 48 ILE H H 1 7.909 0.05 A 48 ILE HA H 1 4.360 0.05 A 48 ILE HB H 1 1.588 0.05 A 48 ILE HD1% H 1 0.623 0.05 A 48 ILE HG1y H 1 1.344 0.05 A 48 ILE HG1x H 1 0.993 0.05 A 48 ILE HG2% H 1 0.865 0.05 A 48 ILE CA C 13 61.132 0.5 A 48 ILE CB C 13 40.316 0.5 A 48 ILE CD1 C 13 13.128 0.5 A 48 ILE CG1 C 13 27.8 0.5 A 48 ILE CG2 C 13 16.594 0.5 A 48 ILE N N 15 125.793 0.5 A 49 GLY H H 1 9.576 0.05 A 49 GLY HAy H 1 4.021 0.05 A 49 GLY HAx H 1 3.73 0.05 A 49 GLY CA C 13 46.91 0.5 A 49 GLY N N 15 120.665 0.5 A 50 ASP H H 1 8.935 0.05 A 50 ASP HA H 1 4.777 0.05 A 50 ASP HBx H 1 2.686 0.05 A 50 ASP HBy H 1 2.866 0.05 A 50 ASP CA C 13 54.00 0.5 A 50 ASP CB C 13 40.52 0.5 A 50 ASP N N 15 126.343 0.5 A 51 THR H H 1 8.253 0.05 A 51 THR HA H 1 4.638 0.05 A 51 THR HB H 1 4.212 0.05 A 51 THR HG2% H 1 1.223 0.05 A 51 THR CA C 13 61.69 0.5 A 51 THR CB C 13 71.08 0.5 A 51 THR CG2 C 13 21.336 0.5 A 51 THR N N 15 115.167 0.5 A 52 SER H H 1 8.710 0.05 A 52 SER HA H 1 5.318 0.05 A 52 SER HBy H 1 3.601 0.05 A 52 SER HBx H 1 3.558 0.05 A 52 SER CA C 13 57.29 0.5 A 52 SER CB C 13 64.73 0.5 A 52 SER N N 15 121.442 0.5 A 53 VAL H H 1 8.448 0.05 A 53 VAL HA H 1 4.650 0.05 A 53 VAL HB H 1 1.989 0.05 A 53 VAL HGx% H 1 0.884 0.05 A 53 VAL HGy% H 1 0.769 0.05 A 53 VAL CA C 13 60.449 0.5 A 53 VAL CB C 13 35.105 0.5 A 53 VAL CGy C 13 21.19 0.5 A 53 VAL CGx C 13 19.92 0.5 A 53 VAL N N 15 121.387 0.5 A 54 SER H H 1 8.761 0.05 A 54 SER HA H 1 5.76 0.05 A 54 SER HBy H 1 3.716 0.05 A 54 SER HBx H 1 3.673 0.05 A 54 SER CA C 13 57.18 0.5 A 54 SER CB C 13 65.91 0.5 A 54 SER N N 15 118.025 0.5 A 55 TYR H H 1 9.34 0.05 A 55 TYR HA H 1 4.175 0.05 A 55 TYR HBy H 1 1.91 0.05 A 55 TYR HBx H 1 0.788 0.05 A 55 TYR HDx H 1 5.76 0.05 A 55 TYR HDy H 1 5.76 0.05 A 55 TYR HEx H 1 5.59 0.05 A 55 TYR HEy H 1 5.59 0.05 A 55 TYR CA C 13 57.1 0.5 A 55 TYR CB C 13 39.87 0.5 A 55 TYR CDx C 13 132.2 0.5 A 55 TYR CDy C 13 132.2 0.5 A 55 TYR CEx C 13 116.9 0.5 A 55 TYR CEy C 13 116.9 0.5 A 55 TYR N N 15 128.024 0.5 A 56 LYS H H 1 7.551 0.05 A 56 LYS HA H 1 4.89 0.05 A 56 LYS HBx H 1 1.419 0.05 A 56 LYS HBy H 1 1.574 0.05 A 56 LYS HDx H 1 1.59 0.05 A 56 LYS HDy H 1 1.59 0.05 A 56 LYS HEx H 1 2.90 0.05 A 56 LYS HEy H 1 2.90 0.05 A 56 LYS HGx H 1 1.23 0.05 A 56 LYS HGy H 1 1.28 0.05 A 56 LYS CA C 13 54.117 0.5 A 56 LYS CB C 13 33.61 0.5 A 56 LYS CD C 13 29.2 0.5 A 56 LYS CE C 13 41.2 0.5 A 56 LYS CG C 13 24.44 0.5 A 56 LYS N N 15 127.706 0.5 A 57 TYR H H 1 8.247 0.05 A 57 TYR HA H 1 3.996 0.05 A 57 TYR HBx H 1 2.769 0.05 A 57 TYR HBy H 1 3.289 0.05 A 57 TYR HDx H 1 6.797 0.05 A 57 TYR HDy H 1 6.797 0.05 A 57 TYR HEx H 1 6.20 0.05 A 57 TYR HEy H 1 6.20 0.05 A 57 TYR CA C 13 59.032 0.5 A 57 TYR CB C 13 39.39 0.5 A 57 TYR CDx C 13 133.6 0.5 A 57 TYR CDy C 13 133.6 0.5 A 57 TYR CEx C 13 117.3 0.5 A 57 TYR CEy C 13 117.3 0.5 A 57 TYR N N 15 124.225 0.5 A 58 THR H H 1 8.722 0.05 A 58 THR HA H 1 4.259 0.05 A 58 THR HB H 1 4.609 0.05 A 58 THR HG2% H 1 1.437 0.05 A 58 THR CA C 13 62.25 0.5 A 58 THR CB C 13 69.28 0.5 A 58 THR CG2 C 13 21.62 0.5 A 58 THR N N 15 116.096 0.5 A 59 SER H H 1 8.402 0.05 A 59 SER HA H 1 4.05 0.05 A 59 SER HBy H 1 3.99 0.05 A 59 SER HBx H 1 3.966 0.05 A 59 SER CA C 13 61.68 0.5 A 59 SER CB C 13 63.21 0.5 A 59 SER N N 15 114.556 0.5 A 60 ARG H H 1 8.176 0.05 A 60 ARG HA H 1 4.489 0.05 A 60 ARG HBy H 1 2.029 0.05 A 60 ARG HBx H 1 1.750 0.05 A 60 ARG HDx H 1 3.20 0.05 A 60 ARG HDy H 1 3.20 0.05 A 60 ARG HGx H 1 1.588 0.05 A 60 ARG HGy H 1 1.676 0.05 A 60 ARG CA C 13 54.96 0.5 A 60 ARG CB C 13 29.846 0.5 A 60 ARG CD C 13 43.15 0.5 A 60 ARG CG C 13 26.99 0.5 A 60 ARG N N 15 118.244 0.5 A 61 TYR H H 1 7.617 0.05 A 61 TYR HA H 1 3.897 0.05 A 61 TYR HBy H 1 3.233 0.05 A 61 TYR HBx H 1 2.613 0.05 A 61 TYR HDx H 1 6.898 0.05 A 61 TYR HDy H 1 6.898 0.05 A 61 TYR HEx H 1 6.69 0.05 A 61 TYR HEy H 1 6.69 0.05 A 61 TYR CA C 13 61.93 0.5 A 61 TYR CB C 13 38.67 0.5 A 61 TYR CDx C 13 133.0 0.5 A 61 TYR CDy C 13 133.0 0.5 A 61 TYR CEx C 13 117.6 0.5 A 61 TYR CEy C 13 117.6 0.5 A 61 TYR N N 15 122.301 0.5 A 62 VAL H H 1 7.363 0.05 A 62 VAL HA H 1 3.893 0.05 A 62 VAL HB H 1 1.589 0.05 A 62 VAL HGx% H 1 0.387 0.05 A 62 VAL HGy% H 1 0.707 0.05 A 62 VAL CA C 13 60.59 0.5 A 62 VAL CB C 13 35.27 0.5 A 62 VAL CGx C 13 20.473 0.5 A 62 VAL CGy C 13 20.779 0.5 A 62 VAL N N 15 129.952 0.5 A 63 LEU H H 1 7.852 0.05 A 63 LEU HA H 1 4.558 0.05 A 63 LEU HBx H 1 1.423 0.05 A 63 LEU HBy H 1 1.837 0.05 A 63 LEU HDx% H 1 0.881 0.05 A 63 LEU HDy% H 1 0.881 0.05 A 63 LEU HG H 1 1.63 0.05 A 63 LEU CA C 13 51.98 0.5 A 63 LEU CB C 13 42.60 0.5 A 63 LEU CDx C 13 23.47 0.5 A 63 LEU CDy C 13 23.47 0.5 A 63 LEU CG C 13 27.0 0.5 A 63 LEU N N 15 128.635 0.5 A 64 LYS H H 1 8.77 0.05 A 64 LYS HA H 1 3.722 0.05 A 64 LYS HBy H 1 1.791 0.05 A 64 LYS HBx H 1 1.465 0.05 A 64 LYS HDx H 1 1.591 0.05 A 64 LYS HDy H 1 1.591 0.05 A 64 LYS HEx H 1 2.93 0.05 A 64 LYS HEy H 1 2.93 0.05 A 64 LYS HGy H 1 1.456 0.05 A 64 LYS HGx H 1 1.148 0.05 A 64 LYS CA C 13 57.36 0.5 A 64 LYS CB C 13 32.381 0.5 A 64 LYS CD C 13 28.6 0.5 A 64 LYS CE C 13 41.72 0.5 A 64 LYS CG C 13 25.887 0.5 A 64 LYS N N 15 130.633 0.5 A 65 ALA H H 1 8.628 0.05 A 65 ALA HA H 1 3.557 0.05 A 65 ALA HB% H 1 1.042 0.05 A 65 ALA CA C 13 53.7 0.5 A 65 ALA CB C 13 18.66 0.5 A 65 ALA N N 15 123.214 0.5 A 66 GLY H H 1 7.505 0.05 A 66 GLY HAx H 1 4.020 0.05 A 66 GLY HAy H 1 4.020 0.05 A 66 GLY CA C 13 46.864 0.5 A 66 GLY N N 15 112.913 0.5 A 67 GLN H H 1 8.136 0.05 A 67 GLN HA H 1 4.436 0.05 A 67 GLN HBx H 1 1.982 0.05 A 67 GLN HBy H 1 2.32 0.05 A 67 GLN HE2x H 1 6.875 0.05 A 67 GLN HE2y H 1 7.463 0.05 A 67 GLN HGx H 1 2.396 0.05 A 67 GLN HGy H 1 2.396 0.05 A 67 GLN CA C 13 55.029 0.5 A 67 GLN CB C 13 29.7 0.5 A 67 GLN CG C 13 34.376 0.5 A 67 GLN N N 15 118.759 0.5 A 67 GLN NE2 N 15 114.1 0.5 A 68 THR H H 1 8.066 0.05 A 68 THR HA H 1 5.414 0.05 A 68 THR HB H 1 4.064 0.05 A 68 THR HG2% H 1 1.13 0.05 A 68 THR CA C 13 60.05 0.5 A 68 THR CB C 13 72.052 0.5 A 68 THR CG2 C 13 20.69 0.5 A 68 THR N N 15 111.842 0.5 A 69 VAL H H 1 8.780 0.05 A 69 VAL HA H 1 4.989 0.05 A 69 VAL HB H 1 2.345 0.05 A 69 VAL HGx% H 1 0.9535 0.05 A 69 VAL HGy% H 1 0.9535 0.05 A 69 VAL CA C 13 59.265 0.5 A 69 VAL CB C 13 33.6 0.5 A 69 VAL CGx C 13 19.99 0.5 A 69 VAL CGy C 13 19.99 0.5 A 69 VAL N N 15 120.958 0.5 A 70 THR H H 1 8.66 0.05 A 70 THR HA H 1 4.618 0.05 A 70 THR HB H 1 4.07 0.05 A 70 THR HG2% H 1 -0.183 0.05 A 70 THR CA C 13 61.73 0.5 A 70 THR CB C 13 69.55 0.5 A 70 THR CG2 C 13 21.3 0.5 A 70 THR N N 15 125.533 0.5 A 71 ILE H H 1 8.994 0.05 A 71 ILE HA H 1 4.369 0.05 A 71 ILE HB H 1 1.552 0.05 A 71 ILE HD1% H 1 0.245 0.05 A 71 ILE HG1y H 1 0.755 0.05 A 71 ILE HG1x H 1 0.625 0.05 A 71 ILE HG2% H 1 0.013 0.05 A 71 ILE CA C 13 59.162 0.5 A 71 ILE CB C 13 36.826 0.5 A 71 ILE CD1 C 13 13.331 0.5 A 71 ILE CG1 C 13 27.475 0.5 A 71 ILE CG2 C 13 18.477 0.5 A 71 ILE N N 15 127.838 0.5 A 72 TRP H H 1 9.27 0.05 A 72 TRP HA H 1 5.167 0.05 A 72 TRP HBy H 1 3.41 0.05 A 72 TRP HBx H 1 3.034 0.05 A 72 TRP HD1 H 1 7.026 0.05 A 72 TRP HE1 H 1 11.50 0.05 A 72 TRP HE3 H 1 7.567 0.05 A 72 TRP HH2 H 1 6.88 0.05 A 72 TRP HZ2 H 1 7.182 0.05 A 72 TRP HZ3 H 1 7.075 0.05 A 72 TRP CA C 13 56.18 0.5 A 72 TRP CB C 13 31.49 0.5 A 72 TRP CD1 C 13 126.7 0.5 A 72 TRP CE3 C 13 121.050 0.5 A 72 TRP CH2 C 13 124.1 0.5 A 72 TRP CZ2 C 13 114.3 0.5 A 72 TRP CZ3 C 13 121.3 0.5 A 72 TRP N N 15 127.112 0.5 A 72 TRP NE1 N 15 132.2 0.5 A 73 ALA H H 1 9.010 0.05 A 73 ALA HA H 1 4.617 0.05 A 73 ALA HB% H 1 1.611 0.05 A 73 ALA CA C 13 52.11 0.5 A 73 ALA CB C 13 19.07 0.5 A 73 ALA N N 15 122.140 0.5 A 74 ALA H H 1 9.002 0.05 A 74 ALA HA H 1 4.042 0.05 A 74 ALA HB% H 1 1.59 0.05 A 74 ALA CA C 13 54.65 0.5 A 74 ALA CB C 13 18.07 0.5 A 74 ALA N N 15 123.213 0.5 A 75 ASN H H 1 8.162 0.05 A 75 ASN HA H 1 5.015 0.05 A 75 ASN HBx H 1 2.676 0.05 A 75 ASN HBy H 1 3.213 0.05 A 75 ASN HD2x H 1 7.24 0.05 A 75 ASN HD2y H 1 7.826 0.05 A 75 ASN CA C 13 51.65 0.5 A 75 ASN CB C 13 36.59 0.5 A 75 ASN N N 15 112.259 0.5 A 75 ASN ND2 N 15 112.6 0.5 A 76 ALA H H 1 7.605 0.05 A 76 ALA HA H 1 4.281 0.05 A 76 ALA HB% H 1 1.881 0.05 A 76 ALA CA C 13 53.203 0.5 A 76 ALA CB C 13 20.21 0.5 A 76 ALA N N 15 120.777 0.5 A 77 GLY H H 1 8.449 0.05 A 77 GLY HAy H 1 3.960 0.05 A 77 GLY HAx H 1 3.537 0.05 A 77 GLY CA C 13 45.410 0.5 A 77 GLY N N 15 107.064 0.5 A 78 VAL H H 1 7.286 0.05 A 78 VAL HA H 1 3.804 0.05 A 78 VAL HB H 1 0.822 0.05 A 78 VAL HGx% H 1 -0.585 0.05 A 78 VAL HGy% H 1 -0.249 0.05 A 78 VAL CA C 13 60.736 0.5 A 78 VAL CB C 13 33.59 0.5 A 78 VAL CGy C 13 19.204 0.5 A 78 VAL CGx C 13 18.793 0.5 A 78 VAL N N 15 120.566 0.5 A 79 THR H H 1 8.148 0.05 A 79 THR HA H 1 4.145 0.05 A 79 THR HB H 1 3.972 0.05 A 79 THR HG2% H 1 1.24 0.05 A 79 THR CA C 13 61.395 0.5 A 79 THR CB C 13 69.62 0.5 A 79 THR CG2 C 13 21.3 0.5 A 79 THR N N 15 121.617 0.5 A 80 ALA H H 1 8.593 0.05 A 80 ALA HA H 1 3.703 0.05 A 80 ALA HB% H 1 1.556 0.05 A 80 ALA CA C 13 53.41 0.5 A 80 ALA CB C 13 19.18 0.5 A 80 ALA N N 15 126.311 0.5 A 81 SER H H 1 9.101 0.05 A 81 SER HA H 1 4.747 0.05 A 81 SER HBx H 1 3.702 0.05 A 81 SER HBy H 1 4.074 0.05 A 81 SER CA C 13 55.046 0.5 A 81 SER CB C 13 62.68 0.5 A 81 SER N N 15 114.816 0.5 A 82 PRO HA H 1 4.328 0.05 A 82 PRO HBy H 1 2.483 0.05 A 82 PRO HBx H 1 2.099 0.05 A 82 PRO HDx H 1 3.59 0.05 A 82 PRO HDy H 1 3.85 0.05 A 82 PRO HGy H 1 2.223 0.05 A 82 PRO HGx H 1 2.081 0.05 A 82 PRO CA C 13 62.158 0.5 A 82 PRO CB C 13 30.48 0.5 A 82 PRO CD C 13 49.90 0.5 A 82 PRO CG C 13 27.808 0.5 A 83 PRO HA H 1 4.821 0.05 A 83 PRO HBy H 1 2.508 0.05 A 83 PRO HBx H 1 2.461 0.05 A 83 PRO HDx H 1 3.664 0.05 A 83 PRO HDy H 1 3.816 0.05 A 83 PRO HGx H 1 1.938 0.05 A 83 PRO HGy H 1 2.146 0.05 A 83 PRO CA C 13 64.384 0.5 A 83 PRO CB C 13 34.75 0.5 A 83 PRO CD C 13 49.83 0.5 A 83 PRO CG C 13 24.05 0.5 A 84 THR H H 1 8.007 0.05 A 84 THR HA H 1 4.567 0.05 A 84 THR HB H 1 4.406 0.05 A 84 THR HG2% H 1 1.395 0.05 A 84 THR CA C 13 64.77 0.5 A 84 THR CB C 13 69.37 0.5 A 84 THR CG2 C 13 21.51 0.5 A 84 THR N N 15 114.629 0.5 A 85 ASP H H 1 7.952 0.05 A 85 ASP HA H 1 5.950 0.05 A 85 ASP HBy H 1 2.582 0.05 A 85 ASP HBx H 1 2.335 0.05 A 85 ASP CA C 13 54.11 0.5 A 85 ASP CB C 13 43.51 0.5 A 85 ASP N N 15 124.539 0.5 A 86 LEU H H 1 9.271 0.05 A 86 LEU HA H 1 4.953 0.05 A 86 LEU HBx H 1 1.467 0.05 A 86 LEU HBy H 1 1.539 0.05 A 86 LEU HDx% H 1 0.603 0.05 A 86 LEU HDy% H 1 0.928 0.05 A 86 LEU HG H 1 1.452 0.05 A 86 LEU CA C 13 52.23 0.5 A 86 LEU CB C 13 44.07 0.5 A 86 LEU CDy C 13 24.99 0.5 A 86 LEU CDx C 13 22.31 0.5 A 86 LEU CG C 13 26.99 0.5 A 86 LEU N N 15 124.265 0.5 A 87 ILE H H 1 8.691 0.05 A 87 ILE HA H 1 4.802 0.05 A 87 ILE HB H 1 2.073 0.05 A 87 ILE HD1% H 1 0.703 0.05 A 87 ILE HG1x H 1 1.436 0.05 A 87 ILE HG1y H 1 1.508 0.05 A 87 ILE HG2% H 1 0.957 0.05 A 87 ILE CA C 13 58.694 0.5 A 87 ILE CB C 13 37.945 0.5 A 87 ILE CD1 C 13 10.495 0.5 A 87 ILE CG1 C 13 28.02 0.5 A 87 ILE CG2 C 13 17.389 0.5 A 87 ILE N N 15 119.475 0.5 A 88 TRP H H 1 9.755 0.05 A 88 TRP HA H 1 4.918 0.05 A 88 TRP HBx H 1 2.647 0.05 A 88 TRP HBy H 1 3.726 0.05 A 88 TRP HD1 H 1 7.414 0.05 A 88 TRP HE1 H 1 9.907 0.05 A 88 TRP HE3 H 1 7.20 0.05 A 88 TRP HH2 H 1 6.72 0.05 A 88 TRP HZ2 H 1 6.989 0.05 A 88 TRP HZ3 H 1 6.388 0.05 A 88 TRP CA C 13 54.900 0.5 A 88 TRP CB C 13 27.27 0.5 A 88 TRP CD1 C 13 123.9 0.5 A 88 TRP CE3 C 13 124.4 0.5 A 88 TRP CH2 C 13 123.8 0.5 A 88 TRP CZ2 C 13 115.1 0.5 A 88 TRP CZ3 C 13 119.8 0.5 A 88 TRP N N 15 132.610 0.5 A 88 TRP NE1 N 15 127.4 0.5 A 89 LYS H H 1 8.282 0.05 A 89 LYS HA H 1 3.996 0.05 A 89 LYS HBx H 1 1.913 0.05 A 89 LYS HBy H 1 2.015 0.05 A 89 LYS HDx H 1 1.818 0.05 A 89 LYS HDy H 1 1.818 0.05 A 89 LYS HEx H 1 3.089 0.05 A 89 LYS HEy H 1 3.089 0.05 A 89 LYS HGx H 1 1.521 0.05 A 89 LYS HGy H 1 1.666 0.05 A 89 LYS CA C 13 58.847 0.5 A 89 LYS CB C 13 32.36 0.5 A 89 LYS CD C 13 29.12 0.5 A 89 LYS CE C 13 41.90 0.5 A 89 LYS CG C 13 24.90 0.5 A 89 LYS N N 15 125.513 0.5 A 90 ASN H H 1 8.81 0.05 A 90 ASN HA H 1 4.434 0.05 A 90 ASN HBy H 1 3.069 0.05 A 90 ASN HBx H 1 3.048 0.05 A 90 ASN HD2x H 1 7.033 0.05 A 90 ASN HD2y H 1 7.676 0.05 A 90 ASN CA C 13 54.010 0.5 A 90 ASN CB C 13 37.77 0.5 A 90 ASN N N 15 114.946 0.5 A 90 ASN ND2 N 15 113.0 0.5 A 91 GLN H H 1 7.546 0.05 A 91 GLN HA H 1 4.412 0.05 A 91 GLN HBx H 1 0.929 0.05 A 91 GLN HBy H 1 1.22 0.05 A 91 GLN HE2x H 1 6.780 0.05 A 91 GLN HE2y H 1 7.408 0.05 A 91 GLN HGx H 1 0.784 0.05 A 91 GLN HGy H 1 1.373 0.05 A 91 GLN CA C 13 53.52 0.5 A 91 GLN CB C 13 28.47 0.5 A 91 GLN CG C 13 31.692 0.5 A 91 GLN N N 15 117.746 0.5 A 91 GLN NE2 N 15 113.000 0.5 A 92 ASN H H 1 8.451 0.05 A 92 ASN HA H 1 4.876 0.05 A 92 ASN HBx H 1 2.723 0.05 A 92 ASN HBy H 1 2.93 0.05 A 92 ASN HD2x H 1 6.675 0.05 A 92 ASN HD2y H 1 7.399 0.05 A 92 ASN CA C 13 52.08 0.5 A 92 ASN CB C 13 39.40 0.5 A 92 ASN N N 15 123.697 0.5 A 92 ASN ND2 N 15 110.0 0.5 A 93 SER H H 1 9.337 0.05 A 93 SER HA H 1 3.977 0.05 A 93 SER HBy H 1 3.736 0.05 A 93 SER HBx H 1 3.516 0.05 A 93 SER CA C 13 58.94 0.5 A 93 SER CB C 13 62.94 0.5 A 93 SER N N 15 117.010 0.5 A 94 TRP H H 1 7.857 0.05 A 94 TRP HA H 1 4.905 0.05 A 94 TRP HBy H 1 3.426 0.05 A 94 TRP HBx H 1 2.941 0.05 A 94 TRP HD1 H 1 7.065 0.05 A 94 TRP HE1 H 1 10.53 0.05 A 94 TRP HE3 H 1 7.066 0.05 A 94 TRP HH2 H 1 6.805 0.05 A 94 TRP HZ2 H 1 7.064 0.05 A 94 TRP HZ3 H 1 7.02 0.05 A 94 TRP CA C 13 56.77 0.5 A 94 TRP CB C 13 27.9 0.5 A 94 TRP CD1 C 13 128.00 0.5 A 94 TRP CH2 C 13 121.6 0.5 A 94 TRP CZ2 C 13 113.4 0.5 A 94 TRP CZ3 C 13 120.00 0.5 A 94 TRP N N 15 120.449 0.5 A 94 TRP NE1 N 15 131.6 0.5 A 95 GLY H H 1 7.795 0.05 A 95 GLY HAy H 1 3.953 0.05 A 95 GLY HAx H 1 3.763 0.05 A 95 GLY CA C 13 45.487 0.5 A 95 GLY N N 15 109.481 0.5 A 96 THR H H 1 8.028 0.05 A 96 THR HA H 1 4.696 0.05 A 96 THR HB H 1 4.127 0.05 A 96 THR HG2% H 1 1.174 0.05 A 96 THR CA C 13 60.88 0.5 A 96 THR CB C 13 70.04 0.5 A 96 THR CG2 C 13 20.688 0.5 A 96 THR N N 15 112.538 0.5 A 97 GLY H H 1 8.443 0.05 A 97 GLY HAx H 1 3.482 0.05 A 97 GLY HAy H 1 3.862 0.05 A 97 GLY CA C 13 45.945 0.5 A 97 GLY N N 15 111.464 0.5 A 98 GLU H H 1 8.010 0.05 A 98 GLU HA H 1 4.471 0.05 A 98 GLU HBx H 1 1.87 0.05 A 98 GLU HBy H 1 1.973 0.05 A 98 GLU HGy H 1 2.414 0.05 A 98 GLU HGx H 1 2.210 0.05 A 98 GLU CA C 13 54.73 0.5 A 98 GLU CB C 13 30.719 0.5 A 98 GLU CG C 13 33.35 0.5 A 98 GLU N N 15 118.563 0.5 A 99 ASP H H 1 8.68 0.05 A 99 ASP HA H 1 4.612 0.05 A 99 ASP HBx H 1 2.607 0.05 A 99 ASP HBy H 1 2.772 0.05 A 99 ASP CA C 13 54.451 0.5 A 99 ASP CB C 13 39.540 0.5 A 99 ASP N N 15 122.219 0.5 A 100 VAL H H 1 8.215 0.05 A 100 VAL HA H 1 4.495 0.05 A 100 VAL HB H 1 1.973 0.05 A 100 VAL HGx% H 1 0.827 0.05 A 100 VAL HGy% H 1 0.589 0.05 A 100 VAL CA C 13 60.920 0.5 A 100 VAL CB C 13 34.15 0.5 A 100 VAL CGx C 13 20.63 0.5 A 100 VAL CGy C 13 21.166 0.5 A 100 VAL N N 15 123.901 0.5 A 101 LYS H H 1 8.600 0.05 A 101 LYS HA H 1 5.112 0.05 A 101 LYS HBx H 1 1.761 0.05 A 101 LYS HBy H 1 1.761 0.05 A 101 LYS HDx H 1 1.60 0.05 A 101 LYS HDy H 1 1.60 0.05 A 101 LYS HEx H 1 2.868 0.05 A 101 LYS HEy H 1 2.868 0.05 A 101 LYS HGx H 1 1.226 0.05 A 101 LYS HGy H 1 1.372 0.05 A 101 LYS CA C 13 54.718 0.5 A 101 LYS CB C 13 35.326 0.5 A 101 LYS CD C 13 29.400 0.5 A 101 LYS CE C 13 41.984 0.5 A 101 LYS CG C 13 24.826 0.5 A 101 LYS N N 15 126.635 0.5 A 102 VAL H H 1 9.209 0.05 A 102 VAL HA H 1 5.405 0.05 A 102 VAL HB H 1 1.850 0.05 A 102 VAL HGx% H 1 0.894 0.05 A 102 VAL HGy% H 1 0.894 0.05 A 102 VAL CA C 13 59.95 0.5 A 102 VAL CB C 13 34.42 0.5 A 102 VAL CGx C 13 21.47 0.5 A 102 VAL CGy C 13 21.87 0.5 A 102 VAL N N 15 125.573 0.5 A 103 ILE H H 1 8.968 0.05 A 103 ILE HA H 1 4.671 0.05 A 103 ILE HB H 1 1.66 0.05 A 103 ILE HD1% H 1 0.809 0.05 A 103 ILE HG1x H 1 1.071 0.05 A 103 ILE HG1y H 1 1.414 0.05 A 103 ILE HG2% H 1 0.9126 0.05 A 103 ILE CA C 13 59.79 0.5 A 103 ILE CB C 13 42.522 0.5 A 103 ILE CD1 C 13 14.296 0.5 A 103 ILE CG1 C 13 28.072 0.5 A 103 ILE CG2 C 13 18.25 0.5 A 103 ILE N N 15 125.593 0.5 A 104 LEU H H 1 9.017 0.05 A 104 LEU HA H 1 5.361 0.05 A 104 LEU HBy H 1 1.983 0.05 A 104 LEU HBx H 1 1.036 0.05 A 104 LEU HDx% H 1 1.073 0.05 A 104 LEU HDy% H 1 1.073 0.05 A 104 LEU HG H 1 0.924 0.05 A 104 LEU CA C 13 52.8 0.5 A 104 LEU CB C 13 46.2 0.5 A 104 LEU CDx C 13 23.5 0.5 A 104 LEU CDy C 13 23.5 0.5 A 104 LEU CG C 13 26.630 0.5 A 104 LEU N N 15 127.791 0.5 A 105 LYS H H 1 9.674 0.05 A 105 LYS HA H 1 5.194 0.05 A 105 LYS HBy H 1 1.712 0.05 A 105 LYS HBx H 1 1.436 0.05 A 105 LYS HDx H 1 1.477 0.05 A 105 LYS HDy H 1 1.582 0.05 A 105 LYS HEx H 1 2.764 0.05 A 105 LYS HEy H 1 2.764 0.05 A 105 LYS HGy H 1 1.256 0.05 A 105 LYS HGx H 1 0.919 0.05 A 105 LYS CA C 13 53.78 0.5 A 105 LYS CB C 13 36.33 0.5 A 105 LYS CD C 13 29.64 0.5 A 105 LYS CE C 13 41.6 0.5 A 105 LYS CG C 13 25.12 0.5 A 105 LYS N N 15 126.536 0.5 A 106 ASN H H 1 7.774 0.05 A 106 ASN HA H 1 2.714 0.05 A 106 ASN HBy H 1 2.714 0.05 A 106 ASN HBx H 1 1.388 0.05 A 106 ASN HD2y H 1 7.449 0.05 A 106 ASN HD2x H 1 7.383 0.05 A 106 ASN CA C 13 49.53 0.5 A 106 ASN CB C 13 36.94 0.5 A 106 ASN N N 15 116.550 0.5 A 106 ASN ND2 N 15 112.3 0.5 A 107 SER H H 1 6.988 0.05 A 107 SER HA H 1 4.092 0.05 A 107 SER HBx H 1 4.151 0.05 A 107 SER HBy H 1 4.151 0.05 A 107 SER CA C 13 60.49 0.5 A 107 SER CB C 13 62.51 0.5 A 107 SER N N 15 112.4 0.5 A 108 GLN H H 1 7.414 0.05 A 108 GLN HA H 1 4.404 0.05 A 108 GLN HBx H 1 1.89 0.05 A 108 GLN HBy H 1 2.238 0.05 A 108 GLN HE2x H 1 6.780 0.05 A 108 GLN HE2y H 1 7.445 0.05 A 108 GLN HGy H 1 2.297 0.05 A 108 GLN HGx H 1 2.256 0.05 A 108 GLN CA C 13 55.47 0.5 A 108 GLN CB C 13 28.4 0.5 A 108 GLN CG C 13 34.543 0.5 A 108 GLN N N 15 119.000 0.5 A 108 GLN NE2 N 15 112.6 0.5 A 109 GLY H H 1 7.835 0.05 A 109 GLY HAy H 1 4.136 0.05 A 109 GLY HAx H 1 3.530 0.05 A 109 GLY CA C 13 45.549 0.5 A 109 GLY N N 15 107.333 0.5 A 110 GLU H H 1 7.562 0.05 A 110 GLU HA H 1 4.209 0.05 A 110 GLU HBy H 1 1.734 0.05 A 110 GLU HBx H 1 1.731 0.05 A 110 GLU HGx H 1 2.080 0.05 A 110 GLU HGy H 1 2.085 0.05 A 110 GLU CA C 13 54.32 0.5 A 110 GLU CB C 13 29.760 0.5 A 110 GLU CG C 13 35.231 0.5 A 110 GLU N N 15 120.137 0.5 A 111 GLU H H 1 8.799 0.05 A 111 GLU HA H 1 4.194 0.05 A 111 GLU HBy H 1 1.952 0.05 A 111 GLU HBx H 1 1.862 0.05 A 111 GLU HGy H 1 2.295 0.05 A 111 GLU HGx H 1 1.979 0.05 A 111 GLU CA C 13 57.16 0.5 A 111 GLU CB C 13 29.175 0.5 A 111 GLU CG C 13 35.45 0.5 A 111 GLU N N 15 123.867 0.5 A 112 VAL H H 1 9.093 0.05 A 112 VAL HA H 1 4.330 0.05 A 112 VAL HB H 1 2.03 0.05 A 112 VAL HGx% H 1 0.524 0.05 A 112 VAL HGy% H 1 0.851 0.05 A 112 VAL CA C 13 61.529 0.5 A 112 VAL CB C 13 33.23 0.5 A 112 VAL CGx C 13 19.357 0.5 A 112 VAL CGy C 13 21.273 0.5 A 112 VAL N N 15 122.642 0.5 A 113 ALA H H 1 7.793 0.05 A 113 ALA HA H 1 4.770 0.05 A 113 ALA HB% H 1 1.573 0.05 A 113 ALA CA C 13 52.449 0.5 A 113 ALA CB C 13 22.4 0.5 A 113 ALA N N 15 121.070 0.5 A 114 GLN H H 1 8.45 0.05 A 114 GLN HA H 1 5.404 0.05 A 114 GLN HBx H 1 2.050 0.05 A 114 GLN HBy H 1 2.120 0.05 A 114 GLN HE2x H 1 6.739 0.05 A 114 GLN HE2y H 1 7.806 0.05 A 114 GLN HGy H 1 2.299 0.05 A 114 GLN HGx H 1 2.215 0.05 A 114 GLN CA C 13 54.83 0.5 A 114 GLN CB C 13 32.307 0.5 A 114 GLN CG C 13 32.54 0.5 A 114 GLN N N 15 115.851 0.5 A 114 GLN NE2 N 15 112.00 0.5 A 115 ARG H H 1 8.989 0.05 A 115 ARG HA H 1 4.555 0.05 A 115 ARG HBx H 1 1.467 0.05 A 115 ARG HBy H 1 2.007 0.05 A 115 ARG HDx H 1 2.986 0.05 A 115 ARG HDy H 1 3.219 0.05 A 115 ARG HGy H 1 1.847 0.05 A 115 ARG HGx H 1 1.610 0.05 A 115 ARG CA C 13 56.35 0.5 A 115 ARG CB C 13 33.73 0.5 A 115 ARG CD C 13 43.170 0.5 A 115 ARG CG C 13 28.167 0.5 A 115 ARG N N 15 122.920 0.5 A 116 SER H H 1 8.511 0.05 A 116 SER HA H 1 5.756 0.05 A 116 SER HBx H 1 3.838 0.05 A 116 SER HBy H 1 3.888 0.05 A 116 SER CA C 13 56.4 0.5 A 116 SER CB C 13 65.77 0.5 A 116 SER N N 15 119.807 0.5 A 117 THR H H 1 8.801 0.05 A 117 THR HA H 1 4.378 0.05 A 117 THR HB H 1 4.23 0.05 A 117 THR HG2% H 1 1.242 0.05 A 117 THR CA C 13 62.16 0.5 A 117 THR CB C 13 70.01 0.5 A 117 THR CG2 C 13 22.753 0.5 A 117 THR N N 15 116.435 0.5 A 118 VAL H H 1 8.165 0.05 A 118 VAL HA H 1 4.227 0.05 A 118 VAL HB H 1 1.959 0.05 A 118 VAL HGx% H 1 0.876 0.05 A 118 VAL HGy% H 1 0.876 0.05 A 118 VAL CA C 13 61.32 0.5 A 118 VAL CB C 13 32.931 0.5 A 118 VAL CGx C 13 20.585 0.5 A 118 VAL CGy C 13 20.585 0.5 A 118 VAL N N 15 122.111 0.5 A 119 PHE H H 1 8.58 0.05 A 119 PHE HA H 1 4.655 0.05 A 119 PHE HBy H 1 3.08 0.05 A 119 PHE HBx H 1 2.97 0.05 A 119 PHE HDx H 1 7.268 0.05 A 119 PHE HDy H 1 7.268 0.05 A 119 PHE HEx H 1 7.36 0.05 A 119 PHE HEy H 1 7.36 0.05 A 119 PHE CA C 13 57.52 0.5 A 119 PHE CB C 13 39.55 0.5 A 119 PHE CDx C 13 131.8 0.5 A 119 PHE CDy C 13 131.8 0.5 A 119 PHE CEx C 13 131.8 0.5 A 119 PHE CEy C 13 131.8 0.5 A 119 PHE N N 15 126.006 0.5 A 120 LYS H H 1 8.346 0.05 A 120 LYS HA H 1 4.432 0.05 A 120 LYS HBx H 1 1.748 0.05 A 120 LYS HBy H 1 1.834 0.05 A 120 LYS HDx H 1 1.664 0.05 A 120 LYS HDy H 1 1.664 0.05 A 120 LYS HEx H 1 2.973 0.05 A 120 LYS HEy H 1 2.976 0.05 A 120 LYS HGx H 1 1.398 0.05 A 120 LYS HGy H 1 1.434 0.05 A 120 LYS CA C 13 55.74 0.5 A 120 LYS CB C 13 33.29 0.5 A 120 LYS CD C 13 29.190 0.5 A 120 LYS CE C 13 42.102 0.5 A 120 LYS CG C 13 24.83 0.5 A 120 LYS N N 15 124.095 0.5 A 121 THR H H 1 8.294 0.05 A 121 THR HA H 1 4.394 0.05 A 121 THR HB H 1 4.293 0.05 A 121 THR HG2% H 1 1.223 0.05 A 121 THR CA C 13 61.61 0.5 A 121 THR CB C 13 69.64 0.5 A 121 THR CG2 C 13 21.593 0.5 A 121 THR N N 15 116.359 0.5 A 122 THR H H 1 7.809 0.05 A 122 THR HA H 1 4.17 0.05 A 122 THR HB H 1 4.27 0.05 A 122 THR HG2% H 1 1.193 0.05 A 122 THR CA C 13 62.83 0.5 A 122 THR CB C 13 70.30 0.5 A 122 THR CG2 C 13 21.764 0.5 A 122 THR N N 15 121.0 0.5 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 37 GLN HE2x A 38 PRO HDy 1.0 0.94 7.05 2 2 A 111 GLU H A 112 VAL H 1.0 0.94 7.08 3 3 A 119 PHE H A 120 LYS H 1.0 0.80 6.02 4 4 A 106 ASN HA A 106 ASN HD2y 1.0 0.89 6.66 5 5 A 100 VAL H A 116 SER HA 1.0 1.09 8.17 6 6 A 116 SER H A 117 THR H 1.0 0.92 6.93 7 7 A 95 GLY H A 96 THR HA 1.0 1.02 7.64 8 8 A 37 GLN HE2y A 38 PRO HDx 1.0 0.94 7.05 9 9 A 39 MET HE% A 42 TRP H 1.0 1.08 8.11 10 10 A 55 TYR HDx A 56 LYS H 1.0 0.80 6.02 11 11 A 72 TRP HE3 A 73 ALA H 1.0 0.83 6.26 12 12 A 55 TYR HDx A 89 LYS H 1.0 0.93 7.01 13 13 A 100 VAL H A 100 VAL HGx% 1.0 0.68 5.13 14 14 A 88 TRP H A 88 TRP HE3 1.0 1.01 7.58 15 15 A 37 GLN HE2y A 38 PRO HDy 1.0 0.94 7.05 16 16 A 17 ILE HD1% A 104 LEU H 1.0 0.81 6.06 17 17 A 47 LYS HA A 51 THR H 1.0 1.04 7.79 18 18 A 26 PHE HBy A 71 ILE H 1.0 0.92 6.92 19 19 A 106 ASN HA A 106 ASN HD2x 1.0 0.89 6.66 20 20 A 88 TRP H A 71 ILE HA 1.0 1.09 8.14 21 21 A 75 ASN HBy A 77 GLY H 1.0 1.03 7.70 22 22 A 88 TRP HBy A 88 TRP HE1 1.0 1.03 7.74 23 23 A 8 HIS H A 9 SER H 1.0 0.93 6.96 24 24 A 14 ASN H A 15 VAL HB 1.0 0.91 6.84 25 25 A 18 GLU H A 30 LYS H 1.0 0.80 5.99 26 26 A 20 ILE HD1% A 102 VAL H 1.0 0.81 6.11 27 27 A 73 ALA H A 25 LYS HA 1.0 1.10 8.25 28 28 A 31 ASN HD2x A 37 GLN HA 1.0 1.15 8.60 29 29 A 37 GLN HA A 31 ASN HD2y 1.0 0.97 7.24 30 30 A 106 ASN H A 110 GLU H 1.0 0.75 5.63 31 31 A 100 VAL HGx% A 94 TRP HE1 1.0 0.73 5.49 32 32 A 102 VAL H A 47 LYS H 1.0 1.02 7.65 33 33 A 47 LYS H A 103 ILE H 1.0 0.97 7.29 34 34 A 95 GLY H A 48 ILE HD1% 1.0 0.99 7.41 35 35 A 57 TYR H A 57 TYR HDy 1.0 0.68 5.09 36 36 A 57 TYR HDx A 58 THR H 1.0 0.87 6.49 37 37 A 39 MET H A 62 VAL HGy% 1.0 1.04 7.82 38 38 A 65 ALA H A 67 GLN HBx 1.0 0.93 6.98 39 39 A 80 ALA HA A 87 ILE H 1.0 1.17 8.74 40 40 A 81 SER H A 82 PRO HDx 1.0 0.79 5.91 41 41 A 81 SER H A 82 PRO HDy 1.0 0.79 5.91 42 42 A 72 TRP H A 87 ILE HD1% 1.0 0.81 6.11 43 43 A 21 ASP HA A 24 GLY H 1.0 0.92 6.87 44 44 A 24 GLY H A 22 VAL HA 1.0 1.00 7.50 45 45 A 93 SER H A 94 TRP H 1.0 0.98 7.33 46 46 A 9 SER H A 8 HIS HA 1.0 0.56 4.21 47 47 A 9 SER H A 8 HIS HBx 1.0 1.05 7.89 48 48 A 9 SER H A 8 HIS HBy 1.0 1.05 7.89 49 49 A 9 SER H A 10 HIS H 1.0 0.95 7.15 50 50 A 11 MET H A 12 THR HA 1.0 1.06 7.93 51 51 A 10 HIS H A 9 SER HA 1.0 0.63 4.73 52 52 A 10 HIS H A 11 MET H 1.0 0.89 6.70 53 53 A 11 MET H A 10 HIS HA 1.0 0.55 4.15 54 54 A 11 MET HA A 12 THR H 1.0 0.54 4.05 55 55 A 11 MET HA A 13 GLY H 1.0 0.86 6.45 56 56 A 11 MET H A 11 MET HBx 1.0 0.65 4.86 57 57 A 12 THR H A 11 MET HBx 1.0 0.89 6.66 58 58 A 12 THR H A 11 MET HBy 1.0 0.78 5.88 59 59 A 11 MET H A 12 THR H 1.0 0.91 6.83 60 60 A 12 THR H A 12 THR HB 1.0 0.77 5.80 61 61 A 13 GLY H A 12 THR HG2% 1.0 0.85 6.37 62 62 A 12 THR H A 13 GLY H 1.0 0.71 5.29 63 63 A 14 ASN H A 13 GLY HAy 1.0 0.65 4.89 64 64 A 14 ASN H A 13 GLY HAx 1.0 0.65 4.89 65 65 A 14 ASN H A 15 VAL H 1.0 0.72 5.37 66 66 A 14 ASN H A 14 ASN HBy 1.0 0.81 6.06 67 67 A 15 VAL H A 14 ASN HBy 1.0 0.96 7.17 68 68 A 15 VAL HA A 16 CYS H 1.0 0.59 4.44 69 69 A 30 LYS H A 15 VAL HA 1.0 1.01 7.59 70 70 A 112 VAL H A 104 LEU HBy 1.0 0.77 5.80 71 71 A 15 VAL H A 15 VAL HGx% 1.0 0.81 6.05 72 72 A 16 CYS H A 15 VAL HGx% 1.0 0.83 6.26 73 73 A 15 VAL H A 15 VAL HGy% 1.0 0.81 6.05 74 74 A 30 LYS HGx A 32 THR H 1.0 0.79 5.96 75 75 A 15 VAL H A 16 CYS H 1.0 0.92 6.92 76 76 A 16 CYS H A 17 ILE H 1.0 0.92 6.93 77 77 A 30 LYS H A 16 CYS H 1.0 0.76 5.71 78 78 A 17 ILE H A 16 CYS HA 1.0 0.62 4.63 79 79 A 16 CYS H A 16 CYS HBx 1.0 0.80 5.97 80 80 A 16 CYS H A 16 CYS HBy 1.0 0.80 5.97 81 81 A 18 GLU H A 17 ILE HA 1.0 0.65 4.85 82 82 A 17 ILE HA A 19 GLU H 1.0 0.88 6.58 83 83 A 30 LYS H A 17 ILE HA 1.0 0.91 6.80 84 84 A 17 ILE H A 17 ILE HB 1.0 0.67 5.04 85 85 A 18 GLU H A 18 GLU HBx 1.0 0.77 5.79 86 86 A 18 GLU H A 18 GLU HBy 1.0 0.77 5.79 87 87 A 17 ILE HD1% A 115 ARG H 1.0 0.67 4.99 88 88 A 18 GLU H A 17 ILE HG2% 1.0 0.72 5.41 89 89 A 19 GLU H A 17 ILE HG2% 1.0 0.71 5.35 90 90 A 17 ILE HD1% A 17 ILE H 1.0 0.73 5.45 91 91 A 19 GLU H A 28 ARG HGx 1.0 0.95 7.10 92 92 A 18 GLU H A 19 GLU H 1.0 0.64 4.83 93 93 A 18 GLU H A 18 GLU HGx 1.0 1.03 7.74 94 94 A 18 GLU H A 18 GLU HGy 1.0 1.03 7.74 95 95 A 19 GLU H A 20 ILE H 1.0 0.88 6.58 96 96 A 19 GLU H A 28 ARG H 1.0 0.90 6.73 97 97 A 20 ILE H A 19 GLU HA 1.0 0.58 4.34 98 98 A 20 ILE H A 19 GLU HBx 1.0 0.87 6.51 99 99 A 20 ILE H A 19 GLU HBy 1.0 0.87 6.51 100 100 A 26 PHE HBy A 72 TRP H 1.0 0.92 6.90 101 101 A 19 GLU H A 19 GLU HGx 1.0 1.00 7.53 102 102 A 20 ILE H A 19 GLU HGx 1.0 0.77 5.76 103 103 A 19 GLU H A 19 GLU HGy 1.0 1.00 7.53 104 104 A 20 ILE H A 19 GLU HGy 1.0 0.77 5.76 105 105 A 20 ILE H A 21 ASP H 1.0 1.00 7.50 106 106 A 21 ASP H A 20 ILE HA 1.0 0.64 4.82 107 107 A 28 ARG H A 20 ILE HA 1.0 0.84 6.33 108 108 A 20 ILE H A 20 ILE HB 1.0 0.68 5.13 109 109 A 21 ASP H A 20 ILE HB 1.0 0.92 6.92 110 110 A 117 THR H A 20 ILE HD1% 1.0 0.79 5.93 111 111 A 20 ILE H A 20 ILE HG2% 1.0 0.78 5.88 112 112 A 21 ASP H A 20 ILE HG2% 1.0 0.72 5.41 113 113 A 21 ASP H A 26 PHE H 1.0 0.80 6.00 114 114 A 21 ASP H A 25 LYS H 1.0 1.01 7.56 115 115 A 21 ASP HA A 22 VAL H 1.0 0.57 4.29 116 116 A 21 ASP H A 21 ASP HBx 1.0 0.71 5.29 117 117 A 24 GLY H A 21 ASP HBx 1.0 0.90 6.73 118 118 A 25 LYS H A 21 ASP HBx 1.0 0.78 5.88 119 119 A 26 PHE H A 21 ASP HBx 1.0 0.67 5.05 120 120 A 21 ASP H A 21 ASP HBy 1.0 0.71 5.29 121 121 A 24 GLY H A 21 ASP HBy 1.0 0.90 6.73 122 122 A 25 LYS H A 21 ASP HBy 1.0 0.78 5.88 123 123 A 22 VAL H A 23 ASP H 1.0 0.67 5.05 124 124 A 24 GLY H A 22 VAL H 1.0 0.91 6.84 125 125 A 25 LYS H A 22 VAL H 1.0 1.17 8.74 126 126 A 21 ASP HA A 23 ASP H 1.0 0.81 6.11 127 127 A 22 VAL H A 22 VAL HB 1.0 0.65 4.90 128 128 A 23 ASP H A 22 VAL HB 1.0 0.84 6.27 129 129 A 23 ASP H A 22 VAL HGx% 1.0 0.61 4.59 130 130 A 24 GLY H A 23 ASP H 1.0 0.67 5.01 131 131 A 23 ASP H A 23 ASP HBx 1.0 0.70 5.22 132 132 A 23 ASP H A 23 ASP HBy 1.0 0.70 5.22 133 133 A 94 TRP HE1 A 24 GLY HAy 1.0 0.85 6.35 134 134 A 94 TRP HE1 A 24 GLY HAx 1.0 0.81 6.06 135 135 A 25 LYS H A 23 ASP H 1.0 0.90 6.77 136 136 A 24 GLY H A 25 LYS H 1.0 0.76 5.67 137 137 A 26 PHE H A 25 LYS H 1.0 0.66 4.96 138 138 A 25 LYS H A 25 LYS HGy 1.0 0.82 6.14 139 139 A 25 LYS H A 25 LYS HGx 1.0 0.82 6.14 140 140 A 24 GLY H A 26 PHE H 1.0 0.88 6.57 141 141 A 26 PHE HA A 27 ILE H 1.0 0.65 4.90 142 142 A 26 PHE HBy A 27 ILE H 1.0 0.77 5.77 143 143 A 73 ALA H A 26 PHE HBy 1.0 0.99 7.39 144 144 A 35 GLN H A 35 GLN HBx 1.0 0.73 5.48 145 145 A 71 ILE H A 28 ARG HBy 1.0 0.92 6.93 146 146 A 26 PHE H A 21 ASP HBy 1.0 0.67 5.05 147 147 A 27 ILE H A 26 PHE HDy 1.0 0.84 6.29 148 148 A 28 ARG H A 26 PHE HDy 1.0 0.83 6.24 149 149 A 26 PHE H A 27 ILE H 1.0 0.88 6.58 150 150 A 21 ASP H A 27 ILE HA 1.0 0.81 6.05 151 151 A 28 ARG H A 27 ILE HA 1.0 0.62 4.68 152 152 A 27 ILE H A 27 ILE HB 1.0 0.75 5.60 153 153 A 71 ILE H A 27 ILE HB 1.0 0.87 6.49 154 154 A 28 ARG H A 27 ILE HB 1.0 0.97 7.29 155 155 A 20 ILE HG2% A 26 PHE H 1.0 0.99 7.44 156 156 A 18 GLU H A 27 ILE HG2% 1.0 1.03 7.74 157 157 A 19 GLU H A 27 ILE HG2% 1.0 0.85 6.35 158 158 A 28 ARG H A 27 ILE HG2% 1.0 0.67 5.01 159 159 A 28 ARG H A 27 ILE H 1.0 0.89 6.69 160 160 A 28 ARG H A 29 LEU H 1.0 0.91 6.80 161 161 A 29 LEU H A 28 ARG HA 1.0 0.63 4.71 162 162 A 71 ILE H A 28 ARG HA 1.0 0.78 5.82 163 163 A 28 ARG H A 28 ARG HBy 1.0 0.71 5.34 164 164 A 28 ARG HBy A 29 LEU H 1.0 0.98 7.32 165 165 A 28 ARG H A 28 ARG HBx 1.0 0.75 5.60 166 166 A 29 LEU H A 28 ARG HGy 1.0 0.71 5.35 167 167 A 29 LEU H A 69 VAL H 1.0 0.76 5.67 168 168 A 71 ILE H A 29 LEU H 1.0 0.97 7.24 169 169 A 18 GLU H A 29 LEU HA 1.0 0.69 5.16 170 170 A 30 LYS H A 29 LEU HA 1.0 0.61 4.59 171 171 A 28 ARG HGx A 29 LEU H 1.0 0.78 5.84 172 172 A 28 ARG HGx A 69 VAL H 1.0 1.01 7.56 173 173 A 30 LYS H A 29 LEU HG 1.0 0.75 5.60 174 174 A 28 ARG H A 29 LEU HDx% 1.0 0.95 7.15 175 175 A 30 LYS H A 29 LEU HDx% 1.0 0.80 5.99 176 176 A 30 LYS H A 29 LEU H 1.0 0.90 6.72 177 177 A 30 LYS HA A 31 ASN H 1.0 0.64 4.77 178 178 A 31 ASN H A 30 LYS HBx 1.0 0.86 6.45 179 179 A 30 LYS HGx A 31 ASN H 1.0 0.72 5.43 180 180 A 92 ASN H A 91 GLN HGx 1.0 0.85 6.39 181 181 A 31 ASN H A 30 LYS HGy 1.0 0.74 5.57 182 182 A 92 ASN H A 91 GLN HGy 1.0 0.85 6.39 183 183 A 30 LYS H A 31 ASN H 1.0 0.90 6.77 184 184 A 16 CYS H A 31 ASN HA 1.0 0.75 5.61 185 185 A 32 THR H A 31 ASN HA 1.0 0.60 4.53 186 186 A 31 ASN HA A 33 SER H 1.0 0.85 6.40 187 187 A 31 ASN H A 31 ASN HBy 1.0 0.74 5.58 188 188 A 31 ASN H A 31 ASN HBx 1.0 0.74 5.58 189 189 A 31 ASN HD2x A 37 GLN H 1.0 0.75 5.61 190 190 A 16 CYS H A 32 THR H 1.0 0.91 6.86 191 191 A 32 THR HA A 66 GLY H 1.0 0.89 6.69 192 192 A 16 CYS H A 32 THR HG2% 1.0 0.96 7.18 193 193 A 33 SER H A 32 THR HG2% 1.0 0.87 6.54 194 194 A 33 SER H A 34 GLU H 1.0 0.93 6.96 195 195 A 33 SER H A 66 GLY H 1.0 0.90 6.73 196 196 A 34 GLU H A 33 SER HA 1.0 0.62 4.66 197 197 A 33 SER H A 33 SER HBy 1.0 0.77 5.74 198 198 A 34 GLU H A 33 SER HBy 1.0 0.75 5.60 199 199 A 33 SER H A 33 SER HBx 1.0 0.77 5.74 200 200 A 34 GLU H A 33 SER HBx 1.0 0.75 5.60 201 201 A 35 GLN H A 34 GLU H 1.0 0.66 4.95 202 202 A 34 GLU H A 34 GLU HBx 1.0 0.65 4.85 203 203 A 35 GLN H A 34 GLU HBx 1.0 0.71 5.32 204 204 A 34 GLU H A 34 GLU HGx 1.0 0.65 4.87 205 205 A 35 GLN H A 34 GLU HBy 1.0 0.91 6.84 206 206 A 35 GLN H A 34 GLU HGx 1.0 0.98 7.35 207 207 A 35 GLN H A 36 ASP H 1.0 0.99 7.39 208 208 A 34 GLU H A 35 GLN HA 1.0 1.01 7.58 209 209 A 36 ASP H A 35 GLN HA 1.0 0.56 4.17 210 210 A 35 GLN H A 35 GLN HBy 1.0 0.73 5.48 211 211 A 37 GLN H A 36 ASP H 1.0 0.94 7.04 212 212 A 65 ALA H A 36 ASP H 1.0 0.86 6.48 213 213 A 31 ASN HD2x A 36 ASP HA 1.0 0.83 6.21 214 214 A 31 ASN HD2y A 36 ASP HA 1.0 0.87 6.49 215 215 A 37 GLN H A 36 ASP HA 1.0 0.64 4.80 216 216 A 65 ALA H A 36 ASP HA 1.0 0.67 5.02 217 217 A 36 ASP H A 36 ASP HBy 1.0 0.75 5.65 218 218 A 37 GLN H A 36 ASP HBy 1.0 0.77 5.77 219 219 A 65 ALA H A 36 ASP HBy 1.0 0.93 6.99 220 220 A 36 ASP H A 36 ASP HBx 1.0 0.66 4.98 221 221 A 37 GLN H A 36 ASP HBx 1.0 0.82 6.17 222 222 A 37 GLN H A 63 LEU H 1.0 0.92 6.92 223 223 A 37 GLN HE2x A 37 GLN HA 1.0 0.91 6.80 224 224 A 37 GLN HE2y A 37 GLN HA 1.0 0.91 6.80 225 225 A 37 GLN H A 37 GLN HBx 1.0 0.78 5.85 226 226 A 37 GLN H A 37 GLN HBy 1.0 0.78 5.85 227 227 A 39 MET H A 38 PRO HA 1.0 0.63 4.74 228 228 A 38 PRO HA A 62 VAL H 1.0 1.05 7.89 229 229 A 63 LEU H A 38 PRO HA 1.0 0.77 5.76 230 230 A 39 MET H A 38 PRO HBy 1.0 0.86 6.46 231 231 A 40 GLY H A 38 PRO HBy 1.0 0.87 6.55 232 232 A 39 MET H A 38 PRO HBx 1.0 0.86 6.46 233 233 A 40 GLY H A 38 PRO HBx 1.0 0.87 6.55 234 234 A 39 MET H A 40 GLY H 1.0 0.66 4.93 235 235 A 39 MET H A 63 LEU H 1.0 0.95 7.15 236 236 A 31 ASN H A 30 LYS HBy 1.0 0.86 6.45 237 237 A 39 MET H A 39 MET HGx 1.0 0.96 7.17 238 238 A 39 MET H A 62 VAL HGx% 1.0 1.04 7.82 239 239 A 40 GLY H A 39 MET HGx 1.0 0.99 7.44 240 240 A 40 GLY HAx A 41 GLY H 1.0 0.66 4.92 241 241 A 42 TRP H A 40 GLY HAx 1.0 0.89 6.69 242 242 A 42 TRP H A 41 GLY H 1.0 0.70 5.25 243 243 A 42 TRP H A 42 TRP HE1 1.0 0.96 7.17 244 244 A 42 TRP HA A 107 SER H 1.0 0.86 6.48 245 245 A 42 TRP H A 42 TRP HBx 1.0 0.73 5.45 246 246 A 42 TRP H A 42 TRP HBy 1.0 0.73 5.45 247 247 A 43 GLU H A 42 TRP HBy 1.0 0.83 6.21 248 248 A 42 TRP H A 42 TRP HD1 1.0 0.66 4.96 249 249 A 42 TRP H A 43 GLU H 1.0 0.94 7.04 250 250 A 43 GLU HA A 44 MET H 1.0 0.59 4.44 251 251 A 43 GLU H A 43 GLU HBx 1.0 0.72 5.37 252 252 A 105 LYS H A 105 LYS HBy 1.0 0.72 5.43 253 253 A 43 GLU H A 43 GLU HBy 1.0 0.73 5.51 254 254 A 105 LYS H A 43 GLU HBy 1.0 0.82 6.15 255 255 A 104 LEU HBy A 105 LYS H 1.0 0.94 7.02 256 256 A 44 MET H A 43 GLU HGx 1.0 0.80 5.97 257 257 A 44 MET H A 55 TYR H 1.0 0.74 5.58 258 258 A 43 GLU H A 105 LYS H 1.0 0.73 5.45 259 259 A 44 MET HA A 45 ILE H 1.0 0.62 4.63 260 260 A 43 GLU HA A 55 TYR H 1.0 1.00 7.47 261 261 A 55 TYR H A 44 MET HA 1.0 1.09 8.17 262 262 A 45 ILE H A 44 MET HGx 1.0 0.81 6.11 263 263 A 45 ILE H A 44 MET HGy 1.0 0.82 6.18 264 264 A 43 GLU HGx A 55 TYR H 1.0 0.98 7.35 265 265 A 55 TYR H A 43 GLU HGy 1.0 1.03 7.76 266 266 A 103 ILE H A 44 MET HGy 1.0 0.96 7.23 267 267 A 45 ILE H A 46 ARG H 1.0 0.91 6.83 268 268 A 46 ARG H A 45 ILE HA 1.0 0.62 4.68 269 269 A 45 ILE HA A 53 VAL H 1.0 0.99 7.45 270 270 A 45 ILE HA A 54 SER H 1.0 1.00 7.50 271 271 A 55 TYR H A 45 ILE HA 1.0 0.81 6.09 272 272 A 45 ILE H A 45 ILE HB 1.0 0.69 5.15 273 273 A 46 ARG H A 45 ILE HB 1.0 0.91 6.80 274 274 A 45 ILE H A 45 ILE HG1x 1.0 0.75 5.65 275 275 A 46 ARG H A 45 ILE HG2% 1.0 0.64 4.83 276 276 A 45 ILE H A 45 ILE HD1% 1.0 0.72 5.38 277 277 A 47 LYS H A 46 ARG H 1.0 0.92 6.93 278 278 A 46 ARG H A 53 VAL H 1.0 0.74 5.58 279 279 A 47 LYS H A 46 ARG HA 1.0 0.63 4.71 280 280 A 46 ARG H A 46 ARG HBy 1.0 0.76 5.73 281 281 A 46 ARG HE A 46 ARG HBy 1.0 1.03 7.73 282 282 A 46 ARG HE A 100 VAL HB 1.0 1.17 8.80 283 283 A 47 LYS H A 46 ARG HBy 1.0 0.95 7.11 284 284 A 46 ARG H A 46 ARG HBx 1.0 0.76 5.73 285 285 A 46 ARG HE A 46 ARG HBx 1.0 1.03 7.73 286 286 A 47 LYS H A 46 ARG HBx 1.0 0.95 7.11 287 287 A 46 ARG H A 45 ILE HG1y 1.0 1.04 7.77 288 288 A 100 VAL HGx% A 101 LYS H 1.0 0.83 6.26 289 289 A 47 LYS H A 48 ILE H 1.0 0.91 6.86 290 290 A 47 LYS H A 101 LYS H 1.0 0.78 5.85 291 291 A 47 LYS HA A 48 ILE H 1.0 0.59 4.43 292 292 A 47 LYS HA A 46 ARG H 1.0 1.07 8.02 293 293 A 46 ARG H A 52 SER HA 1.0 1.13 8.46 294 294 A 47 LYS H A 47 LYS HBy 1.0 0.78 5.88 295 295 A 48 ILE H A 47 LYS HBy 1.0 0.82 6.12 296 296 A 47 LYS H A 47 LYS HBx 1.0 0.78 5.88 297 297 A 48 ILE H A 47 LYS HBx 1.0 0.82 6.12 298 298 A 48 ILE H A 51 THR HG2% 1.0 1.04 7.79 299 299 A 53 VAL H A 51 THR HG2% 1.0 1.09 8.16 300 300 A 48 ILE H A 49 GLY H 1.0 0.93 7.01 301 301 A 49 GLY H A 48 ILE HA 1.0 0.71 5.34 302 302 A 49 GLY H A 48 ILE HB 1.0 0.89 6.70 303 303 A 46 ARG HE A 100 VAL HGy% 1.0 0.89 6.70 304 304 A 48 ILE H A 100 VAL HGy% 1.0 1.20 9.02 305 305 A 101 LYS H A 101 LYS HGy 1.0 0.96 7.23 306 306 A 48 ILE H A 48 ILE HG1x 1.0 1.02 7.68 307 307 A 48 ILE H A 48 ILE HG2% 1.0 0.79 5.90 308 308 A 49 GLY H A 48 ILE HG2% 1.0 0.77 5.74 309 309 A 49 GLY H A 50 ASP H 1.0 0.87 6.55 310 310 A 51 THR H A 50 ASP H 1.0 0.63 4.74 311 311 A 50 ASP H A 50 ASP HBx 1.0 0.76 5.70 312 312 A 51 THR H A 50 ASP HBx 1.0 0.92 6.92 313 313 A 50 ASP H A 50 ASP HBy 1.0 0.76 5.70 314 314 A 51 THR H A 48 ILE H 1.0 0.85 6.35 315 315 A 51 THR H A 52 SER H 1.0 0.90 6.72 316 316 A 52 SER H A 51 THR HA 1.0 0.54 4.07 317 317 A 50 ASP H A 51 THR HB 1.0 1.08 8.13 318 318 A 52 SER H A 51 THR HB 1.0 0.75 5.60 319 319 A 51 THR HG2% A 50 ASP H 1.0 0.83 6.26 320 320 A 51 THR H A 51 THR HG2% 1.0 0.65 4.86 321 321 A 51 THR HG2% A 52 SER H 1.0 0.67 5.01 322 322 A 53 VAL H A 52 SER HA 1.0 0.59 4.41 323 323 A 52 SER H A 52 SER HBx 1.0 0.70 5.26 324 324 A 53 VAL H A 52 SER HBy 1.0 0.75 5.65 325 325 A 53 VAL H A 52 SER H 1.0 0.87 6.54 326 326 A 53 VAL H A 54 SER H 1.0 0.92 6.89 327 327 A 54 SER H A 53 VAL HA 1.0 0.56 4.18 328 328 A 53 VAL H A 53 VAL HB 1.0 0.74 5.55 329 329 A 54 SER H A 53 VAL HGx% 1.0 0.73 5.45 330 330 A 88 TRP HE1 A 53 VAL HGx% 1.0 0.92 6.93 331 331 A 53 VAL HGx% A 91 GLN HE2y 1.0 0.76 5.67 332 332 A 53 VAL H A 53 VAL HGy% 1.0 0.80 6.00 333 333 A 46 ARG H A 54 SER HA 1.0 0.79 5.91 334 334 A 55 TYR H A 54 SER HA 1.0 0.60 4.49 335 335 A 55 TYR H A 54 SER H 1.0 0.90 6.78 336 336 A 56 LYS H A 55 TYR H 1.0 0.91 6.84 337 337 A 88 TRP HE1 A 55 TYR H 1.0 1.08 8.10 338 338 A 56 LYS H A 55 TYR HA 1.0 0.57 4.30 339 339 A 88 TRP HE1 A 55 TYR HA 1.0 0.75 5.63 340 340 A 55 TYR H A 55 TYR HBy 1.0 0.75 5.63 341 341 A 56 LYS H A 55 TYR HBy 1.0 0.91 6.81 342 342 A 88 TRP HE1 A 55 TYR HBy 1.0 0.90 6.75 343 343 A 105 LYS H A 45 ILE HD1% 1.0 0.84 6.29 344 344 A 44 MET H A 55 TYR HBx 1.0 0.94 7.08 345 345 A 55 TYR H A 55 TYR HBx 1.0 0.74 5.57 346 346 A 56 LYS H A 55 TYR HBx 1.0 0.86 6.42 347 347 A 88 TRP HE1 A 55 TYR HBx 1.0 0.89 6.69 348 348 A 55 TYR HDx A 88 TRP HE1 1.0 0.78 5.85 349 349 A 44 MET H A 54 SER HA 1.0 1.02 7.64 350 350 A 88 TRP HE1 A 91 GLN H 1.0 0.89 6.70 351 351 A 57 TYR H A 56 LYS HA 1.0 0.63 4.70 352 352 A 56 LYS H A 56 LYS HBx 1.0 0.66 4.93 353 353 A 56 LYS H A 56 LYS HBy 1.0 0.66 4.93 354 354 A 56 LYS H A 57 TYR H 1.0 0.89 6.70 355 355 A 57 TYR H A 58 THR H 1.0 1.03 7.73 356 356 A 58 THR H A 60 ARG H 1.0 1.14 8.57 357 357 A 58 THR H A 57 TYR HA 1.0 0.60 4.47 358 358 A 57 TYR H A 57 TYR HBx 1.0 0.82 6.18 359 359 A 58 THR H A 57 TYR HBx 1.0 0.79 5.93 360 360 A 57 TYR H A 57 TYR HBy 1.0 0.74 5.52 361 361 A 58 THR H A 57 TYR HBy 1.0 0.82 6.15 362 362 A 57 TYR HDy A 44 MET H 1.0 0.95 7.15 363 363 A 58 THR HA A 59 SER H 1.0 0.57 4.24 364 364 A 60 ARG H A 58 THR HA 1.0 0.95 7.11 365 365 A 58 THR H A 58 THR HB 1.0 0.76 5.73 366 366 A 60 ARG H A 58 THR HB 1.0 0.98 7.36 367 367 A 59 SER H A 58 THR HG2% 1.0 0.70 5.22 368 368 A 58 THR HG2% A 61 TYR H 1.0 0.80 5.99 369 369 A 58 THR H A 59 SER H 1.0 0.94 7.07 370 370 A 60 ARG H A 59 SER H 1.0 0.74 5.52 371 371 A 61 TYR H A 59 SER HA 1.0 1.00 7.50 372 372 A 60 ARG H A 59 SER HA 1.0 0.70 5.26 373 373 A 59 SER H A 59 SER HBy 1.0 0.69 5.16 374 374 A 59 SER H A 59 SER HBx 1.0 0.69 5.16 375 375 A 60 ARG H A 61 TYR H 1.0 0.64 4.82 376 376 A 61 TYR H A 60 ARG HA 1.0 0.71 5.34 377 377 A 60 ARG H A 60 ARG HBy 1.0 0.80 5.99 378 378 A 61 TYR H A 60 ARG HBy 1.0 0.89 6.64 379 379 A 60 ARG H A 60 ARG HBx 1.0 0.80 5.99 380 380 A 61 TYR H A 60 ARG HBx 1.0 0.89 6.64 381 381 A 60 ARG H A 60 ARG HGy 1.0 0.81 6.05 382 382 A 62 VAL H A 61 TYR H 1.0 0.93 7.01 383 383 A 62 VAL H A 61 TYR HA 1.0 0.56 4.18 384 384 A 61 TYR H A 61 TYR HBy 1.0 0.75 5.61 385 385 A 62 VAL H A 61 TYR HBy 1.0 0.91 6.80 386 386 A 61 TYR H A 61 TYR HBx 1.0 0.75 5.61 387 387 A 62 VAL H A 61 TYR HBx 1.0 0.91 6.80 388 388 A 61 TYR H A 61 TYR HDy 1.0 0.78 5.87 389 389 A 62 VAL H A 61 TYR HDx 1.0 0.77 5.80 390 390 A 62 VAL H A 61 TYR HEx 1.0 0.96 7.23 391 391 A 39 MET H A 62 VAL HA 1.0 0.70 5.26 392 392 A 63 LEU H A 62 VAL HA 1.0 0.61 4.56 393 393 A 62 VAL H A 62 VAL HB 1.0 0.80 6.02 394 394 A 63 LEU H A 62 VAL HB 1.0 1.02 7.68 395 395 A 62 VAL H A 62 VAL HGx% 1.0 0.78 5.87 396 396 A 62 VAL H A 62 VAL HGy% 1.0 0.78 5.87 397 397 A 63 LEU H A 62 VAL HGy% 1.0 0.83 6.21 398 398 A 63 LEU H A 62 VAL H 1.0 0.88 6.61 399 399 A 63 LEU HA A 64 LYS H 1.0 0.62 4.62 400 400 A 63 LEU H A 63 LEU HBx 1.0 0.73 5.46 401 401 A 64 LYS H A 64 LYS HBx 1.0 0.73 5.48 402 402 A 63 LEU H A 63 LEU HBy 1.0 0.73 5.46 403 403 A 63 LEU H A 64 LYS H 1.0 0.91 6.86 404 404 A 31 ASN HD2x A 64 LYS HA 1.0 0.98 7.32 405 405 A 31 ASN HD2y A 64 LYS HA 1.0 1.04 7.79 406 406 A 36 ASP H A 64 LYS HA 1.0 0.91 6.80 407 407 A 37 GLN H A 64 LYS HA 1.0 0.78 5.82 408 408 A 65 ALA H A 64 LYS HA 1.0 0.61 4.57 409 409 A 64 LYS H A 64 LYS HBy 1.0 0.73 5.48 410 410 A 65 ALA H A 64 LYS HGy 1.0 0.90 6.77 411 411 A 64 LYS H A 64 LYS HGx 1.0 0.90 6.78 412 412 A 31 ASN HD2x A 65 ALA H 1.0 0.93 6.96 413 413 A 31 ASN HD2y A 35 GLN H 1.0 1.08 8.07 414 414 A 31 ASN HD2y A 65 ALA H 1.0 1.19 8.92 415 415 A 65 ALA H A 37 GLN H 1.0 0.98 7.35 416 416 A 65 ALA H A 64 LYS H 1.0 0.91 6.86 417 417 A 65 ALA H A 66 GLY H 1.0 0.92 6.92 418 418 A 31 ASN HD2x A 65 ALA HA 1.0 0.84 6.30 419 419 A 31 ASN HD2y A 65 ALA HA 1.0 0.83 6.24 420 420 A 35 GLN H A 65 ALA HA 1.0 0.97 7.26 421 421 A 66 GLY H A 65 ALA HA 1.0 0.61 4.57 422 422 A 65 ALA HA A 67 GLN H 1.0 0.79 5.96 423 423 A 31 ASN HD2x A 65 ALA HB% 1.0 0.93 6.98 424 424 A 31 ASN HD2y A 65 ALA HB% 1.0 0.97 7.26 425 425 A 34 GLU H A 65 ALA HB% 1.0 0.88 6.63 426 426 A 35 GLN H A 65 ALA HB% 1.0 0.75 5.63 427 427 A 36 ASP H A 65 ALA HB% 1.0 0.76 5.67 428 428 A 65 ALA H A 65 ALA HB% 1.0 0.59 4.43 429 429 A 66 GLY H A 65 ALA HB% 1.0 0.70 5.26 430 430 A 67 GLN H A 65 ALA HB% 1.0 0.86 6.43 431 431 A 66 GLY H A 67 GLN H 1.0 0.68 5.13 432 432 A 66 GLY HAy A 67 GLN HE2x 1.0 1.04 7.83 433 433 A 31 ASN H A 67 GLN H 1.0 0.88 6.57 434 434 A 37 GLN H A 64 LYS H 1.0 1.05 7.90 435 435 A 64 LYS H A 67 GLN H 1.0 1.14 8.58 436 436 A 67 GLN H A 67 GLN HE2y 1.0 1.10 8.22 437 437 A 67 GLN H A 67 GLN HE2x 1.0 0.85 6.36 438 438 A 65 ALA H A 67 GLN H 1.0 0.90 6.75 439 439 A 67 GLN HE2y A 67 GLN HA 1.0 0.91 6.81 440 440 A 67 GLN HA A 68 THR H 1.0 0.58 4.34 441 441 A 64 LYS H A 67 GLN HBy 1.0 0.84 6.30 442 442 A 67 GLN H A 67 GLN HBy 1.0 0.65 4.85 443 443 A 67 GLN HE2x A 67 GLN HBy 1.0 0.94 7.04 444 444 A 68 THR H A 67 GLN HBy 1.0 0.73 5.46 445 445 A 67 GLN HBx A 64 LYS H 1.0 0.80 6.00 446 446 A 67 GLN HBx A 67 GLN H 1.0 0.63 4.71 447 447 A 67 GLN HBx A 67 GLN HE2y 1.0 0.81 6.08 448 448 A 67 GLN HBx A 67 GLN HE2x 1.0 0.73 5.48 449 449 A 69 VAL H A 68 THR H 1.0 0.92 6.87 450 450 A 29 LEU H A 68 THR HA 1.0 0.98 7.38 451 451 A 69 VAL H A 68 THR HA 1.0 0.62 4.63 452 452 A 68 THR H A 68 THR HB 1.0 0.81 6.08 453 453 A 69 VAL H A 68 THR HB 1.0 0.70 5.28 454 454 A 29 LEU H A 68 THR HG2% 1.0 1.01 7.59 455 455 A 30 LYS H A 68 THR HG2% 1.0 0.93 6.96 456 456 A 31 ASN H A 68 THR HG2% 1.0 0.82 6.15 457 457 A 68 THR H A 68 THR HG2% 1.0 0.73 5.48 458 458 A 69 VAL H A 68 THR HG2% 1.0 0.74 5.55 459 459 A 30 LYS H A 69 VAL H 1.0 0.95 7.10 460 460 A 69 VAL H A 31 ASN H 1.0 1.15 8.65 461 461 A 69 VAL HA A 70 THR H 1.0 0.60 4.49 462 462 A 69 VAL H A 69 VAL HB 1.0 0.82 6.14 463 463 A 69 VAL H A 70 THR H 1.0 0.90 6.72 464 464 A 70 THR H A 70 THR HB 1.0 0.72 5.43 465 465 A 71 ILE H A 70 THR HB 1.0 0.92 6.87 466 466 A 70 THR HB A 72 TRP HE1 1.0 0.72 5.41 467 467 A 70 THR HB A 86 LEU H 1.0 0.92 6.92 468 468 A 27 ILE H A 70 THR HG2% 1.0 0.94 7.05 469 469 A 71 ILE H A 70 THR HG2% 1.0 0.71 5.31 470 470 A 71 ILE H A 27 ILE H 1.0 0.73 5.45 471 471 A 71 ILE H A 72 TRP H 1.0 0.86 6.42 472 472 A 18 GLU H A 29 LEU H 1.0 1.09 8.19 473 473 A 71 ILE HA A 72 TRP H 1.0 0.62 4.66 474 474 A 71 ILE HA A 86 LEU H 1.0 0.81 6.06 475 475 A 27 ILE H A 71 ILE HB 1.0 0.81 6.09 476 476 A 71 ILE H A 71 ILE HB 1.0 0.69 5.18 477 477 A 72 TRP H A 86 LEU HBx 1.0 0.85 6.39 478 478 A 86 LEU H A 71 ILE HD1% 1.0 0.89 6.64 479 479 A 71 ILE H A 71 ILE HG1y 1.0 0.77 5.80 480 480 A 71 ILE H A 71 ILE HG1x 1.0 0.83 6.26 481 481 A 88 TRP H A 71 ILE HG2% 1.0 0.81 6.11 482 482 A 71 ILE H A 28 ARG H 1.0 0.98 7.33 483 483 A 73 ALA H A 72 TRP H 1.0 0.98 7.33 484 484 A 27 ILE H A 72 TRP HA 1.0 0.89 6.67 485 485 A 73 ALA H A 72 TRP HA 1.0 0.63 4.76 486 486 A 72 TRP H A 72 TRP HBy 1.0 0.78 5.82 487 487 A 73 ALA H A 72 TRP HBy 1.0 0.86 6.42 488 488 A 72 TRP H A 72 TRP HBx 1.0 0.78 5.82 489 489 A 73 ALA H A 72 TRP HBx 1.0 0.86 6.42 490 490 A 86 LEU H A 72 TRP HD1 1.0 0.77 5.80 491 491 A 73 ALA H A 88 TRP H 1.0 1.04 7.82 492 492 A 88 TRP H A 74 ALA H 1.0 1.13 8.48 493 493 A 74 ALA H A 73 ALA HA 1.0 0.66 4.98 494 494 A 73 ALA HA A 75 ASN H 1.0 0.89 6.70 495 495 A 88 TRP H A 73 ALA HA 1.0 0.94 7.07 496 496 A 73 ALA H A 73 ALA HB% 1.0 0.63 4.74 497 497 A 77 GLY H A 73 ALA HB% 1.0 1.19 8.91 498 498 A 93 SER H A 73 ALA HB% 1.0 0.70 5.26 499 499 A 94 TRP H A 73 ALA HB% 1.0 0.91 6.86 500 500 A 92 ASN H A 74 ALA HB% 1.0 0.86 6.43 501 501 A 74 ALA H A 75 ASN H 1.0 0.72 5.37 502 502 A 91 GLN H A 74 ALA H 1.0 1.02 7.65 503 503 A 73 ALA H A 76 ALA H 1.0 0.95 7.14 504 504 A 76 ALA H A 74 ALA HA 1.0 0.92 6.89 505 505 A 91 GLN H A 74 ALA HB% 1.0 0.67 5.02 506 506 A 74 ALA HB% A 92 ASN HD2x 1.0 1.02 7.62 507 507 A 74 ALA HB% A 92 ASN HD2y 1.0 1.02 7.62 508 508 A 74 ALA H A 73 ALA HB% 1.0 0.60 4.51 509 509 A 75 ASN H A 73 ALA HB% 1.0 0.62 4.68 510 510 A 75 ASN H A 76 ALA H 1.0 0.67 4.99 511 511 A 77 GLY H A 75 ASN H 1.0 1.02 7.62 512 512 A 77 GLY H A 75 ASN HA 1.0 0.84 6.27 513 513 A 75 ASN H A 75 ASN HBx 1.0 0.77 5.76 514 514 A 75 ASN HBx A 75 ASN HD2x 1.0 0.81 6.05 515 515 A 75 ASN HBx A 75 ASN HD2y 1.0 0.81 6.05 516 516 A 75 ASN HBy A 75 ASN H 1.0 0.84 6.27 517 517 A 77 GLY H A 76 ALA H 1.0 0.67 5.05 518 518 A 74 ALA H A 76 ALA H 1.0 1.02 7.68 519 519 A 76 ALA HA A 78 VAL H 1.0 0.95 7.13 520 520 A 73 ALA H A 76 ALA HB% 1.0 0.74 5.54 521 521 A 75 ASN H A 76 ALA HB% 1.0 0.84 6.30 522 522 A 76 ALA H A 76 ALA HB% 1.0 0.59 4.40 523 523 A 77 GLY H A 76 ALA HB% 1.0 0.73 5.51 524 524 A 78 VAL H A 76 ALA HB% 1.0 0.71 5.34 525 525 A 77 GLY H A 78 VAL H 1.0 0.62 4.66 526 526 A 76 ALA H A 78 VAL H 1.0 0.88 6.58 527 527 A 78 VAL HA A 79 THR H 1.0 0.54 4.04 528 528 A 78 VAL H A 78 VAL HGx% 1.0 0.78 5.84 529 529 A 79 THR H A 78 VAL HGx% 1.0 0.82 6.14 530 530 A 78 VAL H A 78 VAL HGy% 1.0 0.78 5.84 531 531 A 79 THR H A 78 VAL HGy% 1.0 0.82 6.14 532 532 A 78 VAL H A 79 THR H 1.0 0.95 7.15 533 533 A 119 PHE H A 118 VAL H 1.0 1.07 8.02 534 534 A 79 THR HA A 80 ALA H 1.0 0.55 4.13 535 535 A 80 ALA H A 79 THR HB 1.0 0.73 5.46 536 536 A 80 ALA H A 79 THR HG2% 1.0 0.65 4.90 537 537 A 79 THR H A 80 ALA H 1.0 0.93 6.98 538 538 A 81 SER H A 80 ALA H 1.0 0.92 6.87 539 539 A 80 ALA H A 80 ALA HB% 1.0 0.56 4.17 540 540 A 81 SER H A 81 SER HBy 1.0 0.79 5.96 541 541 A 82 PRO HA A 84 THR H 1.0 0.80 6.00 542 542 A 82 PRO HA A 85 ASP H 1.0 0.88 6.58 543 543 A 84 THR H A 82 PRO HBy 1.0 0.90 6.78 544 544 A 84 THR H A 83 PRO HDy 1.0 0.80 6.03 545 545 A 84 THR H A 82 PRO HBx 1.0 0.90 6.78 546 546 A 84 THR H A 84 THR HG2% 1.0 0.62 4.63 547 547 A 70 THR H A 85 ASP HA 1.0 0.77 5.74 548 548 A 72 TRP HE1 A 85 ASP HA 1.0 0.94 7.02 549 549 A 86 LEU H A 85 ASP HA 1.0 0.62 4.68 550 550 A 72 TRP HE1 A 85 ASP HBx 1.0 0.80 6.02 551 551 A 86 LEU H A 85 ASP HBx 1.0 0.93 6.96 552 552 A 72 TRP HE1 A 85 ASP HBy 1.0 0.78 5.84 553 553 A 84 THR H A 85 ASP HBy 1.0 1.00 7.47 554 554 A 85 ASP H A 85 ASP HBy 1.0 0.77 5.76 555 555 A 86 LEU H A 85 ASP HBy 1.0 0.86 6.48 556 556 A 70 THR H A 86 LEU H 1.0 0.87 6.55 557 557 A 72 TRP H A 72 TRP HE1 1.0 0.98 7.36 558 558 A 72 TRP HE1 A 86 LEU H 1.0 1.03 7.71 559 559 A 86 LEU H A 85 ASP H 1.0 0.88 6.61 560 560 A 87 ILE H A 86 LEU H 1.0 0.91 6.86 561 561 A 87 ILE H A 86 LEU HA 1.0 0.61 4.60 562 562 A 46 ARG H A 45 ILE HG1x 1.0 0.96 7.20 563 563 A 86 LEU H A 86 LEU HBx 1.0 0.69 5.19 564 564 A 86 LEU H A 86 LEU HDx% 1.0 0.93 6.95 565 565 A 87 ILE H A 86 LEU HDx% 1.0 1.05 7.87 566 566 A 85 ASP H A 86 LEU HDy% 1.0 0.90 6.73 567 567 A 87 ILE H A 87 ILE HB 1.0 0.63 4.76 568 568 A 88 TRP H A 87 ILE HB 1.0 0.90 6.75 569 569 A 87 ILE HD1% A 78 VAL H 1.0 0.97 7.27 570 570 A 81 SER H A 87 ILE HD1% 1.0 0.92 6.89 571 571 A 88 TRP H A 87 ILE HD1% 1.0 0.86 6.42 572 572 A 88 TRP H A 87 ILE HG1x 1.0 1.01 7.56 573 573 A 88 TRP H A 87 ILE HG1y 1.0 0.90 6.73 574 574 A 88 TRP H A 87 ILE HG2% 1.0 0.68 5.10 575 575 A 88 TRP H A 72 TRP H 1.0 0.90 6.77 576 576 A 88 TRP H A 87 ILE H 1.0 0.93 6.98 577 577 A 89 LYS H A 88 TRP H 1.0 0.90 6.78 578 578 A 88 TRP HE1 A 88 TRP HA 1.0 0.97 7.29 579 579 A 89 LYS H A 88 TRP HA 1.0 0.61 4.57 580 580 A 88 TRP H A 88 TRP HBx 1.0 0.74 5.55 581 581 A 89 LYS H A 88 TRP HBx 1.0 0.93 6.98 582 582 A 88 TRP H A 88 TRP HBy 1.0 0.74 5.58 583 583 A 88 TRP H A 88 TRP HD1 1.0 1.06 7.95 584 584 A 56 LYS H A 88 TRP HE1 1.0 1.00 7.47 585 585 A 46 ARG H A 88 TRP HH2 1.0 0.85 6.37 586 586 A 55 TYR H A 88 TRP HZ2 1.0 0.88 6.61 587 587 A 89 LYS H A 88 TRP HE1 1.0 1.06 7.95 588 588 A 89 LYS HA A 90 ASN H 1.0 0.60 4.50 589 589 A 91 GLN H A 89 LYS HA 1.0 0.80 5.97 590 590 A 89 LYS H A 89 LYS HBy 1.0 0.72 5.41 591 591 A 89 LYS H A 89 LYS HGx 1.0 0.79 5.94 592 592 A 89 LYS H A 89 LYS HGy 1.0 0.79 5.94 593 593 A 88 TRP HE1 A 90 ASN H 1.0 0.89 6.64 594 594 A 89 LYS H A 90 ASN H 1.0 0.80 6.00 595 595 A 91 GLN H A 90 ASN H 1.0 0.70 5.22 596 596 A 91 GLN H A 90 ASN HBy 1.0 0.98 7.36 597 597 A 91 GLN H A 90 ASN HBx 1.0 0.98 7.36 598 598 A 92 ASN H A 91 GLN H 1.0 0.87 6.51 599 599 A 108 GLN HA A 108 GLN HE2y 1.0 1.24 9.30 600 600 A 92 ASN H A 91 GLN HA 1.0 0.58 4.35 601 601 A 108 GLN HA A 108 GLN HE2x 1.0 1.24 9.30 602 602 A 87 ILE HG2% A 90 ASN H 1.0 1.09 8.17 603 603 A 91 GLN H A 91 GLN HBx 1.0 0.75 5.64 604 604 A 92 ASN H A 91 GLN HBx 1.0 0.87 6.52 605 605 A 91 GLN H A 91 GLN HBy 1.0 0.75 5.64 606 606 A 92 ASN H A 91 GLN HBy 1.0 0.87 6.52 607 607 A 53 VAL HGy% A 91 GLN H 1.0 1.03 7.73 608 608 A 75 ASN H A 92 ASN HA 1.0 0.88 6.63 609 609 A 93 SER H A 92 ASN HA 1.0 0.70 5.22 610 610 A 92 ASN H A 92 ASN HBx 1.0 0.74 5.55 611 611 A 93 SER H A 75 ASN HBx 1.0 0.88 6.63 612 612 A 92 ASN H A 92 ASN HBy 1.0 0.74 5.55 613 613 A 93 SER H A 92 ASN HBy 1.0 0.85 6.37 614 614 A 93 SER H A 75 ASN H 1.0 0.85 6.40 615 615 A 93 SER H A 92 ASN H 1.0 0.94 7.04 616 616 A 94 TRP H A 93 SER HA 1.0 0.63 4.73 617 617 A 93 SER H A 93 SER HBy 1.0 0.83 6.20 618 618 A 94 TRP H A 93 SER HBy 1.0 0.80 6.03 619 619 A 93 SER H A 93 SER HBx 1.0 0.83 6.20 620 620 A 94 TRP H A 93 SER HBx 1.0 0.80 6.03 621 621 A 95 GLY H A 94 TRP HBy 1.0 0.79 5.90 622 622 A 95 GLY H A 94 TRP HBx 1.0 0.79 5.90 623 623 A 95 GLY H A 94 TRP HD1 1.0 0.93 6.99 624 624 A 94 TRP HE1 A 24 GLY H 1.0 0.96 7.17 625 625 A 95 GLY H A 96 THR H 1.0 0.79 5.93 626 626 A 96 THR H A 97 GLY H 1.0 0.73 5.46 627 627 A 96 THR HA A 97 GLY H 1.0 0.70 5.24 628 628 A 96 THR HA A 98 GLU H 1.0 1.04 7.82 629 629 A 96 THR H A 96 THR HB 1.0 0.73 5.51 630 630 A 97 GLY H A 96 THR HB 1.0 0.86 6.42 631 631 A 96 THR H A 96 THR HG2% 1.0 0.64 4.80 632 632 A 97 GLY H A 96 THR HG2% 1.0 0.73 5.48 633 633 A 98 GLU H A 96 THR HG2% 1.0 0.89 6.64 634 634 A 97 GLY H A 98 GLU H 1.0 0.66 4.98 635 635 A 97 GLY H A 98 GLU HBx 1.0 1.02 7.67 636 636 A 98 GLU H A 98 GLU HBx 1.0 0.65 4.87 637 637 A 98 GLU HBx A 99 ASP H 1.0 0.76 5.70 638 638 A 98 GLU H A 98 GLU HBy 1.0 0.75 5.63 639 639 A 99 ASP H A 98 GLU HBy 1.0 0.69 5.18 640 640 A 98 GLU H A 98 GLU HGy 1.0 0.82 6.15 641 641 A 99 ASP H A 98 GLU HGy 1.0 0.92 6.92 642 642 A 98 GLU H A 98 GLU HGx 1.0 0.82 6.15 643 643 A 99 ASP H A 98 GLU HGx 1.0 0.92 6.92 644 644 A 98 GLU H A 99 ASP H 1.0 0.92 6.89 645 645 A 100 VAL H A 99 ASP H 1.0 0.92 6.89 646 646 A 100 VAL H A 99 ASP HA 1.0 0.59 4.41 647 647 A 100 VAL H A 99 ASP HBx 1.0 0.89 6.64 648 648 A 42 TRP H A 57 TYR HBx 1.0 0.78 5.88 649 649 A 100 VAL H A 99 ASP HBy 1.0 0.89 6.64 650 650 A 42 TRP H A 57 TYR H 1.0 0.99 7.44 651 651 A 100 VAL H A 101 LYS H 1.0 0.91 6.81 652 652 A 101 LYS H A 100 VAL HA 1.0 0.60 4.47 653 653 A 94 TRP HE1 A 100 VAL HB 1.0 1.03 7.74 654 654 A 100 VAL H A 100 VAL HB 1.0 0.69 5.21 655 655 A 100 VAL HB A 101 LYS H 1.0 0.87 6.54 656 656 A 94 TRP HE1 A 100 VAL HGy% 1.0 0.84 6.29 657 657 A 100 VAL H A 100 VAL HGy% 1.0 0.78 5.84 658 658 A 101 LYS H A 100 VAL HGy% 1.0 0.67 4.99 659 659 A 116 SER H A 102 VAL H 1.0 1.07 8.04 660 660 A 102 VAL H A 101 LYS HA 1.0 0.61 4.54 661 661 A 115 ARG H A 101 LYS HA 1.0 1.02 7.62 662 662 A 116 SER H A 101 LYS HA 1.0 1.00 7.50 663 663 A 117 THR H A 101 LYS HA 1.0 0.79 5.96 664 664 A 102 VAL H A 101 LYS HGx 1.0 0.80 6.02 665 665 A 102 VAL H A 101 LYS HGy 1.0 0.77 5.79 666 666 A 101 LYS H A 101 LYS HBx 1.0 0.78 5.84 667 667 A 101 LYS H A 101 LYS HBy 1.0 0.78 5.84 668 668 A 102 VAL H A 101 LYS HBx 1.0 0.97 7.27 669 669 A 102 VAL H A 101 LYS HBy 1.0 0.97 7.27 670 670 A 102 VAL H A 101 LYS H 1.0 0.92 6.90 671 671 A 103 ILE H A 46 ARG H 1.0 1.04 7.77 672 672 A 102 VAL H A 103 ILE H 1.0 1.09 8.14 673 673 A 117 THR H A 102 VAL H 1.0 1.09 8.19 674 674 A 47 LYS H A 102 VAL HA 1.0 0.82 6.17 675 675 A 103 ILE H A 102 VAL HA 1.0 0.59 4.40 676 676 A 102 VAL H A 102 VAL HB 1.0 0.69 5.18 677 677 A 103 ILE H A 102 VAL HB 1.0 0.86 6.48 678 678 A 103 ILE H A 45 ILE H 1.0 0.75 5.61 679 679 A 102 VAL H A 115 ARG H 1.0 0.73 5.48 680 680 A 71 ILE H A 70 THR HA 1.0 0.65 4.87 681 681 A 103 ILE H A 103 ILE HB 1.0 0.70 5.26 682 682 A 103 ILE H A 45 ILE HG2% 1.0 0.83 6.20 683 683 A 103 ILE HG2% A 114 GLN H 1.0 1.24 9.30 684 684 A 104 LEU H A 104 LEU HG 1.0 0.74 5.54 685 685 A 104 LEU H A 105 LYS H 1.0 0.93 6.99 686 686 A 112 VAL H A 113 ALA H 1.0 0.59 4.40 687 687 A 45 ILE H A 104 LEU HA 1.0 0.77 5.79 688 688 A 105 LYS H A 104 LEU HA 1.0 0.61 4.56 689 689 A 104 LEU H A 114 GLN HA 1.0 0.82 6.18 690 690 A 104 LEU H A 104 LEU HBy 1.0 0.69 5.18 691 691 A 105 LYS H A 104 LEU HBx 1.0 0.67 5.04 692 692 A 113 ALA H A 104 LEU HBx 1.0 0.88 6.61 693 693 A 113 ALA H A 104 LEU HDx% 1.0 0.94 7.07 694 694 A 104 LEU H A 104 LEU HDy% 1.0 0.69 5.21 695 695 A 104 LEU H A 45 ILE H 1.0 1.02 7.65 696 696 A 106 ASN H A 105 LYS HA 1.0 0.60 4.51 697 697 A 110 GLU H A 105 LYS HA 1.0 0.99 7.42 698 698 A 111 GLU H A 105 LYS HA 1.0 0.96 7.20 699 699 A 112 VAL H A 105 LYS HA 1.0 0.75 5.63 700 700 A 113 ALA H A 105 LYS HA 1.0 0.99 7.41 701 701 A 106 ASN H A 105 LYS HBy 1.0 0.90 6.75 702 702 A 105 LYS H A 105 LYS HBx 1.0 0.76 5.68 703 703 A 106 ASN H A 105 LYS HBx 1.0 0.78 5.87 704 704 A 105 LYS H A 105 LYS HGx 1.0 0.79 5.96 705 705 A 106 ASN H A 105 LYS HGx 1.0 0.90 6.77 706 706 A 106 ASN H A 105 LYS H 1.0 0.89 6.66 707 707 A 111 GLU H A 106 ASN H 1.0 1.04 7.77 708 708 A 106 ASN H A 106 ASN HBy 1.0 0.81 6.09 709 709 A 106 ASN HA A 107 SER H 1.0 0.62 4.63 710 710 A 107 SER H A 106 ASN HBy 1.0 0.70 5.24 711 711 A 106 ASN HBy A 108 GLN H 1.0 0.79 5.93 712 712 A 106 ASN HBy A 109 GLY H 1.0 0.97 7.29 713 713 A 110 GLU H A 106 ASN HBy 1.0 0.94 7.08 714 714 A 106 ASN HD2y A 106 ASN H 1.0 0.99 7.41 715 715 A 106 ASN HD2x A 106 ASN H 1.0 0.99 7.41 716 716 A 107 SER H A 106 ASN HBx 1.0 0.70 5.24 717 717 A 108 GLN H A 106 ASN HBx 1.0 0.92 6.87 718 718 A 105 LYS HBx A 109 GLY H 1.0 0.86 6.43 719 719 A 110 GLU H A 105 LYS HBx 1.0 0.86 6.48 720 720 A 106 ASN H A 107 SER H 1.0 0.96 7.18 721 721 A 107 SER H A 109 GLY H 1.0 0.94 7.05 722 722 A 108 GLN H A 107 SER HBy 1.0 0.93 6.96 723 723 A 107 SER H A 108 GLN H 1.0 0.67 5.05 724 724 A 110 GLU H A 108 GLN H 1.0 0.70 5.28 725 725 A 110 GLU H A 108 GLN HA 1.0 0.92 6.90 726 726 A 107 SER H A 108 GLN HBx 1.0 0.98 7.38 727 727 A 108 GLN H A 108 GLN HBx 1.0 0.63 4.76 728 728 A 109 GLY H A 108 GLN HBx 1.0 0.81 6.11 729 729 A 110 GLU H A 108 GLN HBx 1.0 0.78 5.87 730 730 A 109 GLY H A 108 GLN HBy 1.0 0.91 6.86 731 731 A 110 GLU H A 108 GLN HBy 1.0 0.86 6.48 732 732 A 108 GLN H A 109 GLY H 1.0 0.60 4.51 733 733 A 110 GLU H A 109 GLY H 1.0 0.63 4.73 734 734 A 111 GLU H A 110 GLU H 1.0 0.91 6.81 735 735 A 111 GLU H A 110 GLU HA 1.0 0.55 4.15 736 736 A 108 GLN H A 110 GLU HBx 1.0 1.06 7.98 737 737 A 110 GLU H A 110 GLU HBx 1.0 0.60 4.53 738 738 A 111 GLU H A 110 GLU HBy 1.0 0.68 5.13 739 739 A 109 GLY H A 110 GLU HBx 1.0 1.07 8.04 740 740 A 109 GLY H A 110 GLU HGx 1.0 0.89 6.69 741 741 A 110 GLU H A 110 GLU HGx 1.0 0.63 4.74 742 742 A 106 ASN H A 111 GLU HA 1.0 0.82 6.12 743 743 A 112 VAL H A 111 GLU HA 1.0 0.63 4.73 744 744 A 111 GLU H A 111 GLU HBy 1.0 0.63 4.74 745 745 A 111 GLU H A 111 GLU HBx 1.0 0.63 4.74 746 746 A 112 VAL H A 106 ASN H 1.0 0.88 6.63 747 747 A 121 THR HA A 122 THR H 1.0 0.61 4.57 748 748 A 112 VAL H A 112 VAL HGy% 1.0 0.80 6.00 749 749 A 104 LEU HG A 113 ALA H 1.0 0.89 6.67 750 750 A 111 GLU H A 105 LYS HGy 1.0 0.83 6.24 751 751 A 104 LEU H A 113 ALA H 1.0 0.75 5.61 752 752 A 114 GLN H A 113 ALA H 1.0 0.87 6.55 753 753 A 114 GLN H A 113 ALA HA 1.0 0.55 4.13 754 754 A 16 CYS H A 29 LEU HG 1.0 1.03 7.73 755 755 A 113 ALA H A 113 ALA HB% 1.0 0.67 4.99 756 756 A 114 GLN H A 113 ALA HB% 1.0 0.61 4.59 757 757 A 115 ARG H A 114 GLN H 1.0 0.92 6.89 758 758 A 113 ALA H A 104 LEU HA 1.0 1.11 8.33 759 759 A 113 ALA H A 114 GLN HA 1.0 1.19 8.95 760 760 A 115 ARG H A 114 GLN HA 1.0 0.59 4.40 761 761 A 115 ARG H A 114 GLN HBy 1.0 0.74 5.52 762 762 A 114 GLN H A 114 GLN HGy 1.0 0.84 6.27 763 763 A 115 ARG H A 114 GLN HGx 1.0 0.99 7.41 764 764 A 113 ALA H A 114 GLN HGy 1.0 0.89 6.70 765 765 A 114 GLN H A 114 GLN HGx 1.0 0.72 5.38 766 766 A 116 SER H A 115 ARG HA 1.0 0.57 4.29 767 767 A 115 ARG H A 115 ARG HBx 1.0 0.83 6.23 768 768 A 116 SER H A 115 ARG HBx 1.0 0.82 6.14 769 769 A 116 SER H A 115 ARG HBy 1.0 0.82 6.14 770 770 A 115 ARG H A 114 GLN HBx 1.0 0.74 5.52 771 771 A 115 ARG H A 115 ARG HBy 1.0 0.83 6.23 772 772 A 116 SER H A 115 ARG HGy 1.0 0.71 5.29 773 773 A 115 ARG H A 102 VAL HB 1.0 0.95 7.11 774 774 A 116 SER H A 115 ARG HGx 1.0 0.71 5.29 775 775 A 116 SER H A 115 ARG H 1.0 0.89 6.64 776 776 A 116 SER HA A 101 LYS H 1.0 1.01 7.56 777 777 A 116 SER HA A 102 VAL H 1.0 0.77 5.76 778 778 A 116 SER HA A 115 ARG H 1.0 0.98 7.35 779 779 A 116 SER HA A 117 THR H 1.0 0.60 4.49 780 780 A 102 VAL H A 116 SER HBy 1.0 0.99 7.41 781 781 A 102 VAL H A 116 SER HBx 1.0 1.13 8.46 782 782 A 116 SER H A 116 SER HBy 1.0 0.69 5.18 783 783 A 117 THR H A 116 SER HBx 1.0 0.69 5.18 784 784 A 100 VAL H A 117 THR H 1.0 0.77 5.77 785 785 A 117 THR H A 118 VAL H 1.0 0.93 6.99 786 786 A 118 VAL H A 117 THR HA 1.0 0.56 4.21 787 787 A 117 THR H A 117 THR HB 1.0 0.75 5.65 788 788 A 117 THR H A 117 THR HG2% 1.0 0.67 5.02 789 789 A 118 VAL H A 117 THR HB 1.0 0.68 5.07 790 790 A 119 PHE H A 118 VAL HA 1.0 0.53 3.98 791 791 A 118 VAL H A 118 VAL HB 1.0 0.62 4.63 792 792 A 119 PHE H A 118 VAL HB 1.0 0.83 6.24 793 793 A 117 THR H A 100 VAL HGx% 1.0 0.84 6.33 794 794 A 79 THR H A 78 VAL HB 1.0 0.65 4.90 795 795 A 118 VAL H A 118 VAL HGy% 1.0 0.87 6.55 796 796 A 119 PHE H A 118 VAL HGx% 1.0 0.89 6.67 797 797 A 120 LYS H A 119 PHE HA 1.0 0.54 4.08 798 798 A 119 PHE H A 119 PHE HBy 1.0 0.75 5.64 799 799 A 120 LYS H A 119 PHE HBy 1.0 0.96 7.23 800 800 A 119 PHE H A 119 PHE HBx 1.0 0.75 5.64 801 801 A 120 LYS H A 119 PHE HBx 1.0 0.96 7.23 802 802 A 120 LYS HA A 121 THR H 1.0 0.62 4.66 803 803 A 120 LYS H A 120 LYS HBx 1.0 0.75 5.61 804 804 A 121 THR H A 120 LYS HBx 1.0 0.83 6.24 805 805 A 120 LYS H A 120 LYS HBy 1.0 0.75 5.61 806 806 A 121 THR H A 120 LYS HBy 1.0 0.83 6.24 807 807 A 120 LYS H A 120 LYS HGx 1.0 1.10 8.28 808 808 A 120 LYS H A 120 LYS HGy 1.0 1.10 8.28 809 809 A 121 THR H A 120 LYS HGx 1.0 1.08 8.10 810 810 A 121 THR H A 120 LYS HGy 1.0 1.08 8.10 811 811 A 122 THR H A 121 THR H 1.0 0.78 5.85 812 812 A 121 THR H A 121 THR HB 1.0 0.77 5.79 813 813 A 121 THR H A 121 THR HG2% 1.0 0.81 6.08 814 814 A 20 ILE H A 117 THR HG2% 1.0 1.13 8.46 815 815 A 94 TRP H A 94 TRP HE3 1.0 1.01 7.61 816 816 A 53 VAL HB A 91 GLN HE2y 1.0 0.97 7.24 817 817 A 47 LYS H A 100 VAL HGy% 1.0 0.82 6.14 818 818 A 85 ASP H A 85 ASP HBx 1.0 0.81 6.08 819 819 A 39 MET HE% A 39 MET HGx 1.0 0.75 5.65 820 820 A 39 MET HE% A 57 TYR HDx 1.0 0.88 6.58 821 821 A 39 MET HE% A 39 MET HA 1.0 0.84 6.32 822 822 A 88 TRP HE3 A 44 MET HE% 1.0 0.86 6.48 823 823 A 17 ILE HG2% A 115 ARG HDy 1.0 0.85 6.37 824 824 A 88 TRP HE3 A 71 ILE HG2% 1.0 0.76 5.68 825 825 A 100 VAL HGx% A 100 VAL HA 1.0 0.70 5.22 826 826 A 113 ALA HB% A 112 VAL HGy% 1.0 0.78 5.85 827 827 A 29 LEU HDy% A 29 LEU HBx 1.0 0.69 5.21 828 828 A 17 ILE HD1% A 104 LEU HG 1.0 0.68 5.10 829 829 A 120 LYS HA A 120 LYS HDx 1.0 1.08 8.10 830 830 A 120 LYS HA A 120 LYS HDy 1.0 1.08 8.10 831 831 A 56 LYS HA A 56 LYS HDx 1.0 1.09 8.17 832 832 A 56 LYS HA A 56 LYS HDy 1.0 1.09 8.17 833 833 A 114 GLN HA A 114 GLN HGx 1.0 0.84 6.32 834 834 A 103 ILE H A 44 MET HGx 1.0 1.11 8.31 835 835 A 104 LEU H A 114 GLN HGy 1.0 0.88 6.63 836 836 A 117 THR HA A 118 VAL HB 1.0 1.02 7.62 837 837 A 36 ASP H A 35 GLN HGy 1.0 0.84 6.33 838 838 A 44 MET H A 43 GLU HBx 1.0 0.99 7.41 839 839 A 43 GLU HBx A 105 LYS H 1.0 1.09 8.20 840 840 A 31 ASN HD2y A 37 GLN HGy 1.0 0.92 6.90 841 841 A 31 ASN HD2y A 37 GLN HGx 1.0 0.92 6.90 842 842 A 17 ILE HB A 115 ARG HDy 1.0 0.94 7.05 843 843 A 103 ILE HG2% A 105 LYS HEy 1.0 0.93 6.99 844 844 A 105 LYS HGy A 105 LYS HEx 1.0 0.83 6.26 845 845 A 105 LYS HGy A 105 LYS HEy 1.0 0.83 6.26 846 846 A 40 GLY HAx A 41 GLY HAy 1.0 0.95 7.14 847 847 A 40 GLY HAx A 41 GLY HAx 1.0 0.95 7.14 848 848 A 37 GLN HA A 38 PRO HDy 1.0 0.72 5.41 849 849 A 67 GLN HBx A 65 ALA HA 1.0 1.14 8.55 850 850 A 35 GLN HA A 65 ALA HB% 1.0 0.77 5.77 851 851 A 74 ALA HA A 76 ALA HB% 1.0 1.07 8.01 852 852 A 92 ASN HA A 93 SER HA 1.0 1.02 7.68 853 853 A 102 VAL HA A 103 ILE HD1% 1.0 0.93 6.98 854 854 A 79 THR HA A 79 THR HG2% 1.0 0.66 4.98 855 855 A 32 THR HA A 32 THR HG2% 1.0 0.67 4.99 856 856 A 57 TYR HA A 58 THR HA 1.0 0.96 7.17 857 857 A 58 THR HA A 59 SER HA 1.0 1.07 8.02 858 858 A 10 HIS H A 9 SER HBx 1.0 1.03 7.74 859 859 A 10 HIS H A 9 SER HBy 1.0 1.03 7.74 860 860 A 18 GLU H A 29 LEU HDx% 1.0 0.71 5.32 861 861 A 28 ARG HBy A 27 ILE HA 1.0 1.17 8.80 862 862 A 34 GLU HBy A 65 ALA HB% 1.0 1.05 7.85 863 863 A 67 GLN HBx A 65 ALA HB% 1.0 1.19 8.95 864 864 A 78 VAL H A 87 ILE HG1x 1.0 1.10 8.28 865 865 A 46 ARG H A 53 VAL HGx% 1.0 0.79 5.93 866 866 A 39 MET HE% A 39 MET HGy 1.0 0.73 5.48 867 867 A 8 HIS H A 7 HIS HA 1.0 0.64 4.83 868 868 A 42 TRP HA A 43 GLU H 1.0 0.66 4.93 869 869 A 11 MET H A 11 MET HBy 1.0 0.82 6.12 870 870 A 11 MET HA A 11 MET HE% 1.0 0.85 6.39 871 871 A 35 GLN HA A 35 GLN HGx 1.0 0.79 5.94 872 872 A 12 THR HA A 12 THR HB 1.0 0.57 4.27 873 873 A 12 THR HA A 12 THR HG2% 1.0 0.67 5.04 874 874 A 12 THR HA A 13 GLY H 1.0 0.70 5.26 875 875 A 12 THR H A 12 THR HG2% 1.0 0.62 4.68 876 876 A 14 ASN H A 14 ASN HBx 1.0 0.81 6.06 877 877 A 15 VAL H A 14 ASN HBx 1.0 0.96 7.17 878 878 A 15 VAL HB A 15 VAL H 1.0 0.73 5.48 879 879 A 15 VAL HA A 15 VAL HGx% 1.0 0.71 5.32 880 880 A 31 ASN HA A 15 VAL HGx% 1.0 0.80 5.97 881 881 A 15 VAL HA A 15 VAL HGy% 1.0 0.71 5.32 882 882 A 16 CYS H A 15 VAL HGy% 1.0 0.83 6.26 883 883 A 63 LEU HG A 15 VAL HGy% 1.0 0.88 6.61 884 884 A 31 ASN HA A 15 VAL HGy% 1.0 0.80 5.97 885 885 A 17 ILE H A 16 CYS HBx 1.0 0.81 6.05 886 886 A 17 ILE H A 16 CYS HBy 1.0 0.81 6.05 887 887 A 113 ALA HB% A 16 CYS HBx 1.0 0.92 6.92 888 888 A 113 ALA HB% A 16 CYS HBy 1.0 0.92 6.92 889 889 A 17 ILE HA A 29 LEU HA 1.0 0.77 5.74 890 890 A 17 ILE HA A 29 LEU HG 1.0 0.72 5.40 891 891 A 17 ILE HA A 17 ILE HG2% 1.0 0.66 4.98 892 892 A 105 LYS HBy A 43 GLU HBy 1.0 0.82 6.14 893 893 A 17 ILE HB A 115 ARG HDx 1.0 0.94 7.05 894 894 A 17 ILE HD1% A 17 ILE HA 1.0 0.87 6.55 895 895 A 17 ILE HD1% A 17 ILE HB 1.0 0.69 5.19 896 896 A 17 ILE HD1% A 103 ILE HA 1.0 0.88 6.57 897 897 A 17 ILE HD1% A 104 LEU HDx% 1.0 0.75 5.60 898 898 A 17 ILE HD1% A 114 GLN HA 1.0 0.69 5.19 899 899 A 17 ILE HG2% A 27 ILE HG2% 1.0 0.62 4.65 900 900 A 17 ILE HG2% A 29 LEU HG 1.0 0.82 6.17 901 901 A 17 ILE HG2% A 115 ARG HBy 1.0 0.87 6.51 902 902 A 17 ILE HG2% A 115 ARG HDx 1.0 0.85 6.37 903 903 A 18 GLU HA A 18 GLU HGx 1.0 0.80 6.03 904 904 A 18 GLU HA A 18 GLU HGy 1.0 0.80 6.03 905 905 A 29 LEU HA A 18 GLU HBx 1.0 1.04 7.77 906 906 A 29 LEU HA A 18 GLU HBy 1.0 1.04 7.77 907 907 A 19 GLU HA A 19 GLU HGy 1.0 0.80 6.02 908 908 A 19 GLU HA A 19 GLU HGx 1.0 0.80 6.02 909 909 A 20 ILE HD1% A 19 GLU HA 1.0 1.02 7.65 910 910 A 20 ILE HD1% A 115 ARG HA 1.0 1.09 8.16 911 911 A 20 ILE HD1% A 20 ILE HA 1.0 0.83 6.26 912 912 A 20 ILE HD1% A 20 ILE HG2% 1.0 0.58 4.32 913 913 A 102 VAL H A 103 ILE HD1% 1.0 0.88 6.63 914 914 A 20 ILE HD1% A 117 THR HG2% 1.0 0.67 5.05 915 915 A 20 ILE HD1% A 20 ILE H 1.0 0.86 6.46 916 916 A 20 ILE HD1% A 20 ILE HB 1.0 0.67 5.02 917 917 A 45 ILE HB A 45 ILE HD1% 1.0 0.72 5.40 918 918 A 20 ILE HA A 20 ILE HG2% 1.0 0.62 4.65 919 919 A 87 ILE HG2% A 89 LYS HGy 1.0 0.78 5.82 920 920 A 20 ILE HG2% A 117 THR HG2% 1.0 0.66 4.96 921 921 A 87 ILE H A 87 ILE HG2% 1.0 0.73 5.46 922 922 A 21 ASP HA A 22 VAL HB 1.0 0.96 7.21 923 923 A 21 ASP HA A 22 VAL HGx% 1.0 0.78 5.88 924 924 A 22 VAL H A 22 VAL HGx% 1.0 0.57 4.24 925 925 A 22 VAL HA A 22 VAL HGy% 1.0 0.59 4.41 926 926 A 22 VAL HGx% A 23 ASP HA 1.0 0.79 5.91 927 927 A 22 VAL HGy% A 23 ASP HA 1.0 0.87 6.52 928 928 A 25 LYS HA A 25 LYS HGy 1.0 0.83 6.21 929 929 A 25 LYS HA A 25 LYS HGx 1.0 0.83 6.21 930 930 A 25 LYS HA A 25 LYS HDx 1.0 1.08 8.10 931 931 A 25 LYS HA A 25 LYS HDy 1.0 1.08 8.10 932 932 A 25 LYS HA A 73 ALA HB% 1.0 0.82 6.15 933 933 A 25 LYS HA A 26 PHE HBx 1.0 1.19 8.91 934 934 A 89 LYS HA A 89 LYS HDx 1.0 1.01 7.56 935 935 A 89 LYS HA A 89 LYS HDy 1.0 1.01 7.56 936 936 A 24 GLY H A 25 LYS HGy 1.0 1.18 8.85 937 937 A 24 GLY H A 25 LYS HGx 1.0 1.18 8.85 938 938 A 73 ALA H A 26 PHE HA 1.0 0.85 6.37 939 939 A 116 SER HA A 101 LYS HA 1.0 0.68 5.07 940 940 A 26 PHE HA A 73 ALA HB% 1.0 0.90 6.73 941 941 A 27 ILE H A 26 PHE HBx 1.0 0.89 6.66 942 942 A 26 PHE HBy A 72 TRP HA 1.0 0.99 7.42 943 943 A 20 ILE HA A 27 ILE HA 1.0 0.78 5.87 944 944 A 27 ILE HA A 27 ILE HG1x 1.0 0.81 6.09 945 945 A 27 ILE HA A 27 ILE HG2% 1.0 0.70 5.25 946 946 A 27 ILE H A 27 ILE HD1% 1.0 0.86 6.42 947 947 A 27 ILE HA A 27 ILE HD1% 1.0 0.88 6.60 948 948 A 27 ILE HB A 27 ILE HD1% 1.0 0.67 5.04 949 949 A 71 ILE HB A 27 ILE HD1% 1.0 0.80 6.00 950 950 A 27 ILE HA A 27 ILE HG1y 1.0 0.81 6.09 951 951 A 27 ILE H A 27 ILE HG2% 1.0 0.80 5.97 952 952 A 27 ILE HG2% A 27 ILE HG1x 1.0 0.81 6.09 953 953 A 27 ILE HG2% A 27 ILE HG1y 1.0 0.81 6.09 954 954 A 103 ILE HG2% A 114 GLN HBx 1.0 0.94 7.04 955 955 A 27 ILE HG2% A 28 ARG HA 1.0 0.88 6.63 956 956 A 28 ARG HA A 29 LEU HDy% 1.0 1.01 7.58 957 957 A 44 MET HA A 45 ILE HG1x 1.0 1.04 7.79 958 958 A 17 ILE HA A 29 LEU HDx% 1.0 0.69 5.19 959 959 A 29 LEU HA A 29 LEU HDx% 1.0 0.69 5.21 960 960 A 17 ILE HA A 29 LEU HDy% 1.0 0.89 6.66 961 961 A 18 GLU H A 29 LEU HDy% 1.0 0.84 6.32 962 962 A 29 LEU HA A 29 LEU HDy% 1.0 0.81 6.11 963 963 A 71 ILE HD1% A 29 LEU HDy% 1.0 0.90 6.72 964 964 A 29 LEU HDy% A 29 LEU HBy 1.0 0.69 5.21 965 965 A 27 ILE HG2% A 29 LEU HG 1.0 1.04 7.82 966 966 A 28 ARG H A 28 ARG HGy 1.0 0.96 7.18 967 967 A 29 LEU HA A 29 LEU HG 1.0 0.80 5.97 968 968 A 30 LYS HGx A 30 LYS HA 1.0 0.77 5.76 969 969 A 30 LYS HBx A 30 LYS HEx 1.0 1.24 9.30 970 970 A 30 LYS HEy A 30 LYS HBx 1.0 1.24 9.30 971 971 A 30 LYS HBy A 30 LYS HEx 1.0 1.24 9.30 972 972 A 30 LYS HBy A 30 LYS HEy 1.0 1.24 9.30 973 973 A 68 THR HG2% A 30 LYS HBx 1.0 0.84 6.32 974 974 A 68 THR HG2% A 30 LYS HDx 1.0 0.85 6.37 975 975 A 68 THR HG2% A 30 LYS HDy 1.0 0.85 6.37 976 976 A 68 THR HG2% A 30 LYS HEx 1.0 1.04 7.77 977 977 A 68 THR HG2% A 30 LYS HEy 1.0 1.04 7.77 978 978 A 30 LYS HGy A 68 THR HG2% 1.0 0.78 5.87 979 979 A 15 VAL HA A 31 ASN HA 1.0 0.75 5.61 980 980 A 30 LYS HGx A 31 ASN HA 1.0 0.93 6.98 981 981 A 67 GLN H A 31 ASN HBy 1.0 0.98 7.32 982 982 A 67 GLN H A 31 ASN HBx 1.0 0.98 7.32 983 983 A 32 THR H A 32 THR HB 1.0 0.80 6.00 984 984 A 32 THR H A 32 THR HG2% 1.0 0.66 4.95 985 985 A 14 ASN HBx A 33 SER HBy 1.0 1.01 7.59 986 986 A 14 ASN HBx A 33 SER HBx 1.0 1.01 7.59 987 987 A 14 ASN HBy A 33 SER HBy 1.0 1.01 7.59 988 988 A 33 SER HBx A 14 ASN HBy 1.0 1.01 7.59 989 989 A 65 ALA HB% A 34 GLU HA 1.0 0.64 4.77 990 990 A 34 GLU H A 34 GLU HBy 1.0 0.79 5.91 991 991 A 34 GLU H A 34 GLU HGy 1.0 0.76 5.71 992 992 A 34 GLU HA A 34 GLU HGy 1.0 0.71 5.35 993 993 A 34 GLU HGx A 34 GLU HA 1.0 0.69 5.21 994 994 A 35 GLN HA A 35 GLN HGy 1.0 0.79 5.94 995 995 A 36 ASP H A 35 GLN HGx 1.0 0.84 6.33 996 996 A 37 GLN HA A 36 ASP HA 1.0 0.90 6.72 997 997 A 36 ASP HA A 64 LYS HA 1.0 0.76 5.68 998 998 A 36 ASP HBx A 64 LYS HA 1.0 0.93 6.98 999 999 A 36 ASP HBy A 62 VAL HB 1.0 1.15 8.63 1000 1000 A 36 ASP HBx A 62 VAL HB 1.0 1.24 9.30 1001 1001 A 38 PRO HA A 40 GLY H 1.0 0.89 6.69 1002 1002 A 40 GLY HAy A 38 PRO HBy 1.0 1.03 7.73 1003 1003 A 40 GLY HAy A 38 PRO HBx 1.0 1.03 7.73 1004 1004 A 39 MET HA A 39 MET HGy 1.0 0.82 6.14 1005 1005 A 39 MET HGx A 39 MET HA 1.0 0.78 5.85 1006 1006 A 57 TYR HBx A 39 MET HGy 1.0 0.86 6.48 1007 1007 A 39 MET HGx A 57 TYR HBx 1.0 0.95 7.11 1008 1008 A 106 ASN HA A 42 TRP HA 1.0 0.83 6.20 1009 1009 A 43 GLU H A 42 TRP HBx 1.0 0.83 6.21 1010 1010 A 43 GLU HA A 43 GLU HGy 1.0 0.82 6.12 1011 1011 A 44 MET H A 43 GLU HGy 1.0 0.86 6.48 1012 1012 A 43 GLU HGx A 45 ILE HD1% 1.0 1.01 7.61 1013 1013 A 43 GLU HGy A 45 ILE HD1% 1.0 1.19 8.92 1014 1014 A 43 GLU HGy A 45 ILE HG1x 1.0 0.88 6.63 1015 1015 A 44 MET HA A 104 LEU HG 1.0 1.04 7.77 1016 1016 A 44 MET HE% A 44 MET HBx 1.0 0.73 5.51 1017 1017 A 44 MET HGy A 44 MET HE% 1.0 0.68 5.13 1018 1018 A 55 TYR H A 44 MET HE% 1.0 0.91 6.83 1019 1019 A 55 TYR HBx A 44 MET HE% 1.0 0.65 4.89 1020 1020 A 44 MET HE% A 55 TYR HDy 1.0 0.75 5.61 1021 1021 A 71 ILE HG1x A 44 MET HE% 1.0 0.73 5.49 1022 1022 A 71 ILE HG2% A 44 MET HE% 1.0 0.68 5.07 1023 1023 A 88 TRP HH2 A 44 MET HE% 1.0 0.87 6.52 1024 1024 A 44 MET HE% A 88 TRP HZ3 1.0 0.78 5.82 1025 1025 A 44 MET HE% A 27 ILE HD1% 1.0 0.60 4.47 1026 1026 A 44 MET HE% A 44 MET HBy 1.0 0.73 5.51 1027 1027 A 44 MET HGx A 44 MET HE% 1.0 0.76 5.68 1028 1028 A 44 MET H A 44 MET HE% 1.0 1.05 7.89 1029 1029 A 45 ILE H A 44 MET HE% 1.0 1.16 8.68 1030 1030 A 44 MET HGy A 104 LEU HDy% 1.0 0.86 6.45 1031 1031 A 103 ILE HG2% A 114 GLN HBy 1.0 0.94 7.04 1032 1032 A 45 ILE HA A 45 ILE HG1y 1.0 0.69 5.15 1033 1033 A 45 ILE HA A 54 SER HBx 1.0 0.93 6.99 1034 1034 A 103 ILE H A 45 ILE HB 1.0 0.86 6.42 1035 1035 A 44 MET HA A 45 ILE HD1% 1.0 0.86 6.48 1036 1036 A 45 ILE HA A 45 ILE HD1% 1.0 0.76 5.68 1037 1037 A 45 ILE HD1% A 104 LEU HA 1.0 0.93 7.01 1038 1038 A 114 GLN HA A 103 ILE HD1% 1.0 0.95 7.15 1039 1039 A 116 SER HA A 20 ILE HD1% 1.0 0.78 5.85 1040 1040 A 45 ILE H A 45 ILE HG1y 1.0 0.93 7.01 1041 1041 A 45 ILE HG1x A 54 SER HA 1.0 0.90 6.77 1042 1042 A 80 ALA HA A 87 ILE HG1x 1.0 0.86 6.46 1043 1043 A 45 ILE HG1y A 54 SER HBy 1.0 1.04 7.83 1044 1044 A 45 ILE HG1y A 54 SER HBx 1.0 1.04 7.83 1045 1045 A 102 VAL H A 103 ILE HG1x 1.0 0.92 6.90 1046 1046 A 28 ARG HGx A 28 ARG H 1.0 0.96 7.21 1047 1047 A 45 ILE HA A 45 ILE HG1x 1.0 0.78 5.84 1048 1048 A 45 ILE H A 45 ILE HG2% 1.0 0.81 6.06 1049 1049 A 45 ILE HA A 45 ILE HG2% 1.0 0.72 5.37 1050 1050 A 45 ILE HG1x A 45 ILE HG2% 1.0 0.74 5.54 1051 1051 A 45 ILE HG2% A 45 ILE HG1y 1.0 0.67 5.05 1052 1052 A 45 ILE HG2% A 46 ARG HA 1.0 0.88 6.63 1053 1053 A 45 ILE HG2% A 47 LYS HDx 1.0 1.07 8.02 1054 1054 A 45 ILE HG2% A 47 LYS HDy 1.0 1.07 8.02 1055 1055 A 45 ILE HG2% A 47 LYS HGx 1.0 0.88 6.58 1056 1056 A 45 ILE HG2% A 47 LYS HGy 1.0 0.88 6.58 1057 1057 A 45 ILE HG2% A 52 SER HBy 1.0 0.70 5.24 1058 1058 A 53 VAL H A 45 ILE HG2% 1.0 0.80 6.02 1059 1059 A 46 ARG HA A 102 VAL HA 1.0 0.77 5.79 1060 1060 A 46 ARG HA A 102 VAL HGx% 1.0 0.84 6.32 1061 1061 A 46 ARG HA A 102 VAL HGy% 1.0 0.84 6.32 1062 1062 A 103 ILE H A 46 ARG HA 1.0 0.84 6.32 1063 1063 A 47 LYS HA A 48 ILE HG2% 1.0 0.93 6.95 1064 1064 A 47 LYS HA A 53 VAL H 1.0 0.88 6.61 1065 1065 A 101 LYS HGx A 103 ILE HD1% 1.0 0.80 6.03 1066 1066 A 48 ILE HA A 100 VAL HGy% 1.0 0.92 6.93 1067 1067 A 48 ILE HA A 48 ILE HG1y 1.0 0.83 6.24 1068 1068 A 48 ILE HA A 48 ILE HG1x 1.0 0.83 6.24 1069 1069 A 112 VAL HA A 112 VAL HGy% 1.0 0.69 5.19 1070 1070 A 48 ILE H A 48 ILE HB 1.0 0.84 6.27 1071 1071 A 48 ILE HD1% A 48 ILE H 1.0 1.01 7.59 1072 1072 A 48 ILE HD1% A 48 ILE HA 1.0 0.85 6.39 1073 1073 A 48 ILE HD1% A 48 ILE HB 1.0 0.67 5.01 1074 1074 A 48 ILE HD1% A 48 ILE HG2% 1.0 0.58 4.35 1075 1075 A 48 ILE HD1% A 94 TRP HBy 1.0 0.87 6.51 1076 1076 A 48 ILE HD1% A 94 TRP HBx 1.0 0.87 6.51 1077 1077 A 48 ILE HD1% A 94 TRP HD1 1.0 0.85 6.35 1078 1078 A 48 ILE HD1% A 100 VAL HA 1.0 0.88 6.60 1079 1079 A 48 ILE HG2% A 48 ILE HG1y 1.0 0.74 5.55 1080 1080 A 48 ILE HA A 48 ILE HG2% 1.0 0.67 5.04 1081 1081 A 48 ILE HG2% A 48 ILE HG1x 1.0 0.74 5.55 1082 1082 A 48 ILE HG2% A 50 ASP H 1.0 1.06 7.92 1083 1083 A 51 THR HG2% A 48 ILE HG2% 1.0 0.88 6.63 1084 1084 A 48 ILE HG2% A 100 VAL HA 1.0 0.89 6.66 1085 1085 A 51 THR H A 50 ASP HA 1.0 0.63 4.73 1086 1086 A 51 THR H A 50 ASP HBy 1.0 0.92 6.92 1087 1087 A 51 THR HA A 50 ASP HA 1.0 0.92 6.87 1088 1088 A 51 THR HG2% A 51 THR HA 1.0 0.66 4.93 1089 1089 A 51 THR H A 51 THR HB 1.0 0.73 5.45 1090 1090 A 45 ILE HG2% A 52 SER HA 1.0 0.81 6.08 1091 1091 A 52 SER HA A 51 THR HG2% 1.0 1.02 7.67 1092 1092 A 52 SER HBy A 53 VAL HA 1.0 1.11 8.31 1093 1093 A 51 THR HA A 52 SER HBx 1.0 0.90 6.72 1094 1094 A 103 ILE HD1% A 103 ILE HA 1.0 0.86 6.46 1095 1095 A 54 SER H A 53 VAL HB 1.0 0.83 6.24 1096 1096 A 53 VAL HB A 88 TRP HZ2 1.0 1.00 7.53 1097 1097 A 53 VAL H A 53 VAL HGx% 1.0 0.71 5.29 1098 1098 A 53 VAL HA A 53 VAL HGx% 1.0 0.65 4.86 1099 1099 A 53 VAL HGx% A 54 SER HA 1.0 0.77 5.79 1100 1100 A 53 VAL HGx% A 91 GLN HE2x 1.0 0.76 5.67 1101 1101 A 53 VAL HA A 53 VAL HGy% 1.0 0.73 5.45 1102 1102 A 53 VAL HGy% A 91 GLN HBx 1.0 0.77 5.80 1103 1103 A 54 SER H A 53 VAL HGy% 1.0 0.74 5.54 1104 1104 A 53 VAL HGy% A 54 SER HA 1.0 0.83 6.20 1105 1105 A 88 TRP HE1 A 53 VAL HGy% 1.0 0.75 5.63 1106 1106 A 53 VAL HGy% A 88 TRP HH2 1.0 0.83 6.26 1107 1107 A 53 VAL HGy% A 91 GLN HBy 1.0 0.77 5.80 1108 1108 A 45 ILE HA A 54 SER HA 1.0 0.75 5.64 1109 1109 A 45 ILE HG2% A 54 SER HA 1.0 0.84 6.30 1110 1110 A 45 ILE HA A 54 SER HBy 1.0 0.93 6.99 1111 1111 A 72 TRP HE3 A 26 PHE HBx 1.0 1.06 7.92 1112 1112 A 55 TYR HBy A 88 TRP HZ2 1.0 1.01 7.59 1113 1113 A 55 TYR HBx A 88 TRP HZ2 1.0 1.04 7.79 1114 1114 A 57 TYR H A 56 LYS HBx 1.0 0.94 7.05 1115 1115 A 57 TYR H A 56 LYS HBy 1.0 0.94 7.05 1116 1116 A 59 SER H A 58 THR HB 1.0 0.78 5.84 1117 1117 A 57 TYR HA A 58 THR HG2% 1.0 1.05 7.90 1118 1118 A 58 THR HG2% A 59 SER HA 1.0 1.12 8.40 1119 1119 A 58 THR H A 58 THR HG2% 1.0 0.64 4.79 1120 1120 A 58 THR HA A 58 THR HG2% 1.0 0.64 4.83 1121 1121 A 60 ARG H A 58 THR HG2% 1.0 0.80 6.02 1122 1122 A 60 ARG H A 59 SER HBy 1.0 1.07 8.02 1123 1123 A 60 ARG H A 59 SER HBx 1.0 1.07 8.02 1124 1124 A 60 ARG H A 60 ARG HGx 1.0 0.81 6.05 1125 1125 A 60 ARG HA A 60 ARG HGx 1.0 0.81 6.06 1126 1126 A 60 ARG HA A 60 ARG HGy 1.0 0.81 6.06 1127 1127 A 61 TYR HA A 61 TYR HDx 1.0 0.81 6.08 1128 1128 A 61 TYR HA A 62 VAL HB 1.0 1.22 9.15 1129 1129 A 38 PRO HA A 62 VAL HA 1.0 0.74 5.58 1130 1130 A 38 PRO HA A 62 VAL HGx% 1.0 0.79 5.93 1131 1131 A 62 VAL HA A 62 VAL HGx% 1.0 0.70 5.25 1132 1132 A 63 LEU H A 62 VAL HGx% 1.0 0.83 6.21 1133 1133 A 38 PRO HA A 62 VAL HGy% 1.0 0.79 5.93 1134 1134 A 61 TYR HDx A 62 VAL HGy% 1.0 0.99 7.45 1135 1135 A 62 VAL HA A 62 VAL HGy% 1.0 0.70 5.25 1136 1136 A 63 LEU HA A 67 GLN HBy 1.0 0.89 6.69 1137 1137 A 61 TYR HDx A 63 LEU HDx% 1.0 1.24 9.30 1138 1138 A 61 TYR HDx A 63 LEU HDy% 1.0 1.24 9.30 1139 1139 A 61 TYR HEx A 63 LEU HDy% 1.0 0.92 6.89 1140 1140 A 63 LEU HA A 63 LEU HDx% 1.0 0.76 5.70 1141 1141 A 63 LEU HA A 63 LEU HDy% 1.0 0.76 5.70 1142 1142 A 36 ASP HBy A 64 LYS HA 1.0 0.89 6.66 1143 1143 A 67 GLN HBy A 64 LYS HBy 1.0 0.91 6.84 1144 1144 A 67 GLN HBx A 64 LYS HBy 1.0 0.83 6.23 1145 1145 A 67 GLN HBx A 64 LYS HBx 1.0 0.83 6.23 1146 1146 A 64 LYS HA A 64 LYS HDx 1.0 1.04 7.83 1147 1147 A 64 LYS HA A 64 LYS HDy 1.0 1.04 7.83 1148 1148 A 64 LYS H A 64 LYS HGy 1.0 0.90 6.78 1149 1149 A 64 LYS HA A 64 LYS HGy 1.0 0.84 6.30 1150 1150 A 64 LYS HA A 64 LYS HGx 1.0 0.84 6.30 1151 1151 A 65 ALA H A 64 LYS HGx 1.0 0.90 6.77 1152 1152 A 64 LYS HA A 65 ALA HA 1.0 0.89 6.66 1153 1153 A 36 ASP HA A 65 ALA HA 1.0 0.84 6.30 1154 1154 A 64 LYS HA A 65 ALA HB% 1.0 0.87 6.49 1155 1155 A 36 ASP HA A 65 ALA HB% 1.0 0.75 5.65 1156 1156 A 32 THR HA A 66 GLY HAx 1.0 0.87 6.52 1157 1157 A 65 ALA HA A 66 GLY HAx 1.0 0.97 7.24 1158 1158 A 65 ALA HA A 66 GLY HAy 1.0 1.04 7.79 1159 1159 A 67 GLN HE2x A 67 GLN HA 1.0 0.80 5.99 1160 1160 A 67 GLN HBy A 64 LYS HBx 1.0 0.91 6.84 1161 1161 A 67 GLN HBx A 68 THR H 1.0 0.82 6.18 1162 1162 A 68 THR HA A 63 LEU HG 1.0 1.13 8.49 1163 1163 A 31 ASN H A 68 THR HA 1.0 0.87 6.55 1164 1164 A 30 LYS HA A 68 THR HA 1.0 0.71 5.31 1165 1165 A 30 LYS HA A 68 THR HG2% 1.0 0.77 5.74 1166 1166 A 68 THR HG2% A 30 LYS HBy 1.0 0.84 6.32 1167 1167 A 68 THR HA A 68 THR HG2% 1.0 0.68 5.10 1168 1168 A 70 THR H A 69 VAL HB 1.0 0.79 5.96 1169 1169 A 70 THR HA A 69 VAL HGx% 1.0 1.00 7.48 1170 1170 A 70 THR HA A 69 VAL HGy% 1.0 1.00 7.48 1171 1171 A 28 ARG HA A 70 THR HA 1.0 0.74 5.57 1172 1172 A 70 THR HB A 85 ASP HA 1.0 0.87 6.49 1173 1173 A 26 PHE HA A 70 THR HG2% 1.0 0.98 7.33 1174 1174 A 26 PHE HBy A 70 THR HG2% 1.0 0.81 6.05 1175 1175 A 70 THR HG2% A 26 PHE HBx 1.0 0.79 5.91 1176 1176 A 70 THR HG2% A 26 PHE HEy 1.0 0.89 6.64 1177 1177 A 28 ARG HA A 70 THR HG2% 1.0 0.86 6.45 1178 1178 A 70 THR HG2% A 70 THR HA 1.0 0.74 5.54 1179 1179 A 70 THR HG2% A 72 TRP HD1 1.0 0.87 6.52 1180 1180 A 28 ARG HBx A 70 THR HG2% 1.0 0.98 7.33 1181 1181 A 28 ARG HGy A 70 THR HG2% 1.0 1.06 7.92 1182 1182 A 70 THR H A 70 THR HG2% 1.0 0.82 6.18 1183 1183 A 70 THR HG2% A 72 TRP HZ2 1.0 0.81 6.05 1184 1184 A 27 ILE HG2% A 71 ILE HB 1.0 0.98 7.32 1185 1185 A 71 ILE HB A 44 MET HE% 1.0 0.85 6.39 1186 1186 A 71 ILE HD1% A 44 MET HE% 1.0 0.77 5.77 1187 1187 A 71 ILE HD1% A 55 TYR HEy 1.0 0.82 6.15 1188 1188 A 71 ILE HD1% A 57 TYR HEx 1.0 0.75 5.63 1189 1189 A 71 ILE HD1% A 69 VAL HGx% 1.0 0.72 5.37 1190 1190 A 71 ILE HD1% A 69 VAL HGy% 1.0 0.72 5.37 1191 1191 A 71 ILE H A 71 ILE HD1% 1.0 0.77 5.74 1192 1192 A 71 ILE HA A 71 ILE HD1% 1.0 0.70 5.28 1193 1193 A 71 ILE HB A 71 ILE HD1% 1.0 0.80 6.00 1194 1194 A 71 ILE HD1% A 86 LEU HBy 1.0 0.82 6.18 1195 1195 A 71 ILE HD1% A 86 LEU HDx% 1.0 0.71 5.29 1196 1196 A 71 ILE HD1% A 71 ILE HG2% 1.0 0.67 5.05 1197 1197 A 72 TRP H A 71 ILE HD1% 1.0 0.87 6.55 1198 1198 A 27 ILE HG2% A 71 ILE HG1x 1.0 0.84 6.32 1199 1199 A 71 ILE HG2% A 27 ILE HD1% 1.0 0.83 6.21 1200 1200 A 71 ILE H A 71 ILE HG2% 1.0 0.82 6.17 1201 1201 A 71 ILE HA A 71 ILE HG2% 1.0 0.72 5.43 1202 1202 A 71 ILE HG1y A 71 ILE HG2% 1.0 0.72 5.40 1203 1203 A 71 ILE HG1x A 71 ILE HG2% 1.0 0.72 5.40 1204 1204 A 72 TRP H A 71 ILE HG2% 1.0 0.75 5.60 1205 1205 A 71 ILE HG2% A 88 TRP HA 1.0 0.86 6.43 1206 1206 A 71 ILE HG2% A 88 TRP HBx 1.0 0.72 5.40 1207 1207 A 26 PHE HA A 72 TRP HA 1.0 0.81 6.09 1208 1208 A 72 TRP HA A 26 PHE HBx 1.0 0.85 6.37 1209 1209 A 72 TRP HE3 A 72 TRP HA 1.0 0.85 6.35 1210 1210 A 72 TRP HA A 73 ALA HB% 1.0 0.87 6.49 1211 1211 A 73 ALA HB% A 92 ASN HA 1.0 0.77 5.76 1212 1212 A 73 ALA HB% A 93 SER HA 1.0 0.66 4.96 1213 1213 A 88 TRP HBy A 73 ALA HB% 1.0 0.85 6.37 1214 1214 A 74 ALA HA A 87 ILE HG2% 1.0 0.62 4.66 1215 1215 A 74 ALA H A 74 ALA HB% 1.0 0.63 4.71 1216 1216 A 75 ASN H A 74 ALA HB% 1.0 0.73 5.45 1217 1217 A 74 ALA HB% A 87 ILE HG2% 1.0 0.79 5.94 1218 1218 A 74 ALA HB% A 90 ASN H 1.0 0.84 6.29 1219 1219 A 76 ALA HB% A 72 TRP HBy 1.0 0.80 6.03 1220 1220 A 76 ALA HB% A 72 TRP HBx 1.0 0.80 6.03 1221 1221 A 76 ALA HB% A 72 TRP HZ3 1.0 0.83 6.23 1222 1222 A 72 TRP HE3 A 76 ALA HB% 1.0 0.65 4.87 1223 1223 A 78 VAL HA A 78 VAL HGx% 1.0 0.67 5.02 1224 1224 A 76 ALA HB% A 78 VAL HB 1.0 0.98 7.32 1225 1225 A 78 VAL H A 78 VAL HB 1.0 0.75 5.60 1226 1226 A 78 VAL HA A 78 VAL HGy% 1.0 0.67 5.02 1227 1227 A 79 THR H A 79 THR HB 1.0 0.69 5.18 1228 1228 A 79 THR H A 79 THR HG2% 1.0 0.72 5.41 1229 1229 A 122 THR HA A 122 THR HG2% 1.0 0.77 5.74 1230 1230 A 80 ALA HA A 81 SER H 1.0 0.64 4.79 1231 1231 A 79 THR HA A 80 ALA HB% 1.0 0.83 6.26 1232 1232 A 81 SER H A 80 ALA HB% 1.0 0.73 5.45 1233 1233 A 80 ALA HB% A 81 SER HA 1.0 0.96 7.20 1234 1234 A 80 ALA HB% A 87 ILE HB 1.0 0.93 6.98 1235 1235 A 87 ILE HD1% A 80 ALA HB% 1.0 0.97 7.24 1236 1236 A 80 ALA HB% A 87 ILE HG1x 1.0 0.88 6.63 1237 1237 A 80 ALA HB% A 87 ILE HG2% 1.0 0.85 6.35 1238 1238 A 81 SER H A 81 SER HBx 1.0 0.79 5.96 1239 1239 A 83 PRO HDx A 82 PRO HBx 1.0 0.95 7.11 1240 1240 A 81 SER HA A 82 PRO HDx 1.0 0.67 5.01 1241 1241 A 81 SER HA A 82 PRO HDy 1.0 0.67 5.01 1242 1242 A 83 PRO HDx A 82 PRO HBy 1.0 0.95 7.11 1243 1243 A 83 PRO HBy A 84 THR HA 1.0 0.87 6.55 1244 1244 A 84 THR HG2% A 84 THR HA 1.0 0.67 4.99 1245 1245 A 84 THR HG2% A 83 PRO HA 1.0 0.99 7.45 1246 1246 A 85 ASP H A 84 THR HG2% 1.0 0.75 5.65 1247 1247 A 72 TRP HD1 A 85 ASP HA 1.0 0.91 6.84 1248 1248 A 85 ASP HA A 86 LEU HG 1.0 0.91 6.84 1249 1249 A 70 THR HB A 85 ASP HBx 1.0 0.86 6.43 1250 1250 A 70 THR HB A 85 ASP HBy 1.0 0.87 6.49 1251 1251 A 71 ILE HA A 86 LEU HBx 1.0 0.99 7.39 1252 1252 A 71 ILE HA A 86 LEU HBy 1.0 1.06 7.96 1253 1253 A 86 LEU HBx A 71 ILE HD1% 1.0 0.92 6.92 1254 1254 A 87 ILE H A 86 LEU HBx 1.0 0.90 6.75 1255 1255 A 61 TYR HDy A 86 LEU HDx% 1.0 0.85 6.40 1256 1256 A 71 ILE HA A 86 LEU HDx% 1.0 0.88 6.60 1257 1257 A 86 LEU HA A 86 LEU HDx% 1.0 0.81 6.06 1258 1258 A 86 LEU HDx% A 86 LEU HBy 1.0 0.66 4.98 1259 1259 A 86 LEU HBx A 86 LEU HDx% 1.0 0.66 4.93 1260 1260 A 86 LEU HDy% A 61 TYR HEy 1.0 0.80 6.03 1261 1261 A 87 ILE H A 86 LEU HDy% 1.0 0.73 5.51 1262 1262 A 71 ILE HD1% A 86 LEU HDy% 1.0 0.82 6.18 1263 1263 A 85 ASP HA A 86 LEU HDy% 1.0 0.98 7.35 1264 1264 A 86 LEU H A 86 LEU HDy% 1.0 0.83 6.23 1265 1265 A 86 LEU HA A 86 LEU HDy% 1.0 0.59 4.43 1266 1266 A 86 LEU HDy% A 86 LEU HBy 1.0 0.64 4.79 1267 1267 A 86 LEU H A 86 LEU HG 1.0 0.86 6.48 1268 1268 A 87 ILE HG1y A 87 ILE HA 1.0 0.52 3.93 1269 1269 A 88 TRP H A 87 ILE HA 1.0 0.59 4.43 1270 1270 A 87 ILE HD1% A 87 ILE HB 1.0 0.82 6.14 1271 1271 A 87 ILE HD1% A 72 TRP HBy 1.0 0.76 5.68 1272 1272 A 87 ILE HD1% A 72 TRP HBx 1.0 0.76 5.68 1273 1273 A 80 ALA HA A 87 ILE HD1% 1.0 0.76 5.68 1274 1274 A 87 ILE H A 87 ILE HD1% 1.0 0.77 5.77 1275 1275 A 87 ILE HD1% A 87 ILE HA 1.0 0.67 5.04 1276 1276 A 87 ILE HD1% A 87 ILE HG2% 1.0 0.68 5.10 1277 1277 A 87 ILE H A 87 ILE HG1x 1.0 0.92 6.93 1278 1278 A 87 ILE H A 87 ILE HG1y 1.0 0.87 6.51 1279 1279 A 43 GLU HGx A 45 ILE HG1x 1.0 0.78 5.84 1280 1280 A 87 ILE HG1x A 87 ILE HG2% 1.0 0.69 5.19 1281 1281 A 103 ILE HG2% A 103 ILE HG1y 1.0 0.74 5.58 1282 1282 A 87 ILE HG2% A 87 ILE HA 1.0 0.70 5.26 1283 1283 A 87 ILE HG1y A 87 ILE HG2% 1.0 0.68 5.10 1284 1284 A 87 ILE HG2% A 89 LYS HGx 1.0 0.78 5.82 1285 1285 A 89 LYS H A 87 ILE HG2% 1.0 0.79 5.96 1286 1286 A 88 TRP HBy A 71 ILE HG2% 1.0 0.91 6.81 1287 1287 A 87 ILE HG2% A 89 LYS HA 1.0 0.75 5.61 1288 1288 A 89 LYS H A 89 LYS HBx 1.0 0.72 5.41 1289 1289 A 89 LYS HBx A 89 LYS HEx 1.0 1.17 8.74 1290 1290 A 89 LYS HEy A 89 LYS HBx 1.0 1.17 8.74 1291 1291 A 89 LYS HBy A 89 LYS HEx 1.0 1.17 8.74 1292 1292 A 89 LYS HBy A 89 LYS HEy 1.0 1.17 8.74 1293 1293 A 90 ASN H A 89 LYS HBx 1.0 0.88 6.58 1294 1294 A 90 ASN H A 89 LYS HBy 1.0 0.88 6.58 1295 1295 A 89 LYS HA A 89 LYS HGx 1.0 0.85 6.36 1296 1296 A 89 LYS HA A 89 LYS HGy 1.0 0.85 6.36 1297 1297 A 89 LYS HA A 90 ASN HA 1.0 0.90 6.75 1298 1298 A 74 ALA HB% A 91 GLN HA 1.0 0.90 6.73 1299 1299 A 74 ALA H A 92 ASN HA 1.0 0.89 6.64 1300 1300 A 74 ALA HB% A 92 ASN HA 1.0 0.75 5.61 1301 1301 A 93 SER H A 92 ASN HBx 1.0 0.85 6.37 1302 1302 A 74 ALA HB% A 89 LYS HA 1.0 0.75 5.60 1303 1303 A 24 GLY HAx A 95 GLY HAy 1.0 1.24 9.30 1304 1304 A 24 GLY HAx A 95 GLY HAx 1.0 1.24 9.30 1305 1305 A 96 THR HA A 96 THR HG2% 1.0 0.64 4.83 1306 1306 A 99 ASP H A 98 GLU HA 1.0 0.62 4.68 1307 1307 A 48 ILE HB A 100 VAL HA 1.0 0.87 6.54 1308 1308 A 43 GLU HBy A 45 ILE HD1% 1.0 0.74 5.55 1309 1309 A 48 ILE HD1% A 100 VAL HB 1.0 0.76 5.67 1310 1310 A 48 ILE HB A 100 VAL HGy% 1.0 0.79 5.91 1311 1311 A 100 VAL HGy% A 100 VAL HA 1.0 0.70 5.28 1312 1312 A 46 ARG HA A 100 VAL HGy% 1.0 0.94 7.08 1313 1313 A 100 VAL HGy% A 101 LYS HA 1.0 0.99 7.44 1314 1314 A 117 THR H A 100 VAL HGy% 1.0 1.01 7.61 1315 1315 A 101 LYS HGy A 101 LYS HA 1.0 0.77 5.74 1316 1316 A 101 LYS H A 101 LYS HGx 1.0 0.95 7.10 1317 1317 A 45 ILE H A 102 VAL HA 1.0 1.06 7.96 1318 1318 A 20 ILE HD1% A 102 VAL HB 1.0 0.71 5.29 1319 1319 A 102 VAL HA A 102 VAL HGx% 1.0 0.80 6.03 1320 1320 A 102 VAL HA A 102 VAL HGy% 1.0 0.80 6.03 1321 1321 A 104 LEU H A 103 ILE HA 1.0 0.64 4.79 1322 1322 A 114 GLN HA A 103 ILE HA 1.0 0.76 5.67 1323 1323 A 45 ILE H A 103 ILE HB 1.0 0.88 6.63 1324 1324 A 45 ILE HD1% A 103 ILE HB 1.0 0.72 5.41 1325 1325 A 102 VAL HA A 103 ILE HB 1.0 1.07 8.04 1326 1326 A 103 ILE HB A 104 LEU HA 1.0 1.15 8.64 1327 1327 A 103 ILE H A 103 ILE HD1% 1.0 0.85 6.35 1328 1328 A 115 ARG H A 103 ILE HD1% 1.0 0.91 6.84 1329 1329 A 103 ILE HG2% A 103 ILE HD1% 1.0 0.61 4.60 1330 1330 A 101 LYS HGx A 103 ILE HG1x 1.0 0.85 6.37 1331 1331 A 101 LYS HGx A 103 ILE HG1y 1.0 0.83 6.20 1332 1332 A 103 ILE H A 103 ILE HG1y 1.0 0.86 6.42 1333 1333 A 103 ILE HA A 103 ILE HG1x 1.0 0.81 6.05 1334 1334 A 103 ILE HA A 103 ILE HG1y 1.0 0.80 6.02 1335 1335 A 102 VAL HA A 103 ILE HG1x 1.0 0.90 6.73 1336 1336 A 43 GLU HGx A 45 ILE HG1y 1.0 0.84 6.27 1337 1337 A 103 ILE H A 103 ILE HG1x 1.0 0.82 6.12 1338 1338 A 103 ILE HG2% A 103 ILE HA 1.0 0.71 5.29 1339 1339 A 103 ILE HG2% A 103 ILE HG1x 1.0 0.66 4.98 1340 1340 A 104 LEU H A 103 ILE HG2% 1.0 0.66 4.95 1341 1341 A 103 ILE HG2% A 105 LYS HGx 1.0 0.71 5.32 1342 1342 A 103 ILE HG2% A 105 LYS HEx 1.0 0.93 6.99 1343 1343 A 45 ILE H A 103 ILE HG2% 1.0 1.04 7.79 1344 1344 A 105 LYS H A 103 ILE HG2% 1.0 1.11 8.33 1345 1345 A 103 ILE HG2% A 104 LEU HA 1.0 0.94 7.04 1346 1346 A 103 ILE HG2% A 114 GLN HA 1.0 1.02 7.62 1347 1347 A 103 ILE HG2% A 114 GLN HGy 1.0 0.74 5.52 1348 1348 A 17 ILE HD1% A 104 LEU HBy 1.0 0.87 6.49 1349 1349 A 17 ILE HD1% A 104 LEU HBx 1.0 1.07 8.04 1350 1350 A 112 VAL H A 104 LEU HBx 1.0 0.99 7.42 1351 1351 A 104 LEU HBy A 112 VAL HGy% 1.0 0.95 7.10 1352 1352 A 104 LEU HBx A 112 VAL HGy% 1.0 0.97 7.24 1353 1353 A 104 LEU HBy A 113 ALA H 1.0 0.98 7.35 1354 1354 A 104 LEU HBx A 113 ALA HB% 1.0 0.88 6.61 1355 1355 A 44 MET HA A 104 LEU HDy% 1.0 0.74 5.57 1356 1356 A 104 LEU HDy% A 44 MET HBx 1.0 0.80 5.99 1357 1357 A 45 ILE H A 104 LEU HDy% 1.0 0.68 5.07 1358 1358 A 104 LEU H A 104 LEU HDx% 1.0 0.94 7.08 1359 1359 A 104 LEU HA A 104 LEU HDy% 1.0 0.67 5.04 1360 1360 A 104 LEU HBy A 104 LEU HDx% 1.0 0.76 5.70 1361 1361 A 104 LEU HDy% A 44 MET HBy 1.0 0.80 5.99 1362 1362 A 44 MET HGx A 104 LEU HDy% 1.0 0.84 6.32 1363 1363 A 104 LEU HA A 105 LYS HA 1.0 0.93 6.96 1364 1364 A 104 LEU HBy A 105 LYS HA 1.0 1.06 7.93 1365 1365 A 105 LYS HA A 105 LYS HGy 1.0 0.77 5.80 1366 1366 A 105 LYS HGx A 111 GLU HA 1.0 0.89 6.66 1367 1367 A 42 TRP HA A 107 SER HA 1.0 0.98 7.38 1368 1368 A 108 GLN HA A 107 SER HA 1.0 1.08 8.07 1369 1369 A 108 GLN H A 107 SER HBx 1.0 0.93 6.96 1370 1370 A 108 GLN H A 108 GLN HBy 1.0 0.77 5.79 1371 1371 A 105 LYS HBx A 109 GLY HAy 1.0 0.97 7.27 1372 1372 A 105 LYS HBx A 109 GLY HAx 1.0 0.97 7.27 1373 1373 A 110 GLU HA A 110 GLU HGx 1.0 0.83 6.24 1374 1374 A 111 GLU H A 110 GLU HGy 1.0 0.87 6.52 1375 1375 A 105 LYS HA A 111 GLU HA 1.0 0.76 5.68 1376 1376 A 111 GLU HA A 105 LYS HGy 1.0 0.76 5.71 1377 1377 A 112 VAL H A 112 VAL HB 1.0 0.79 5.91 1378 1378 A 113 ALA H A 112 VAL HB 1.0 1.00 7.47 1379 1379 A 104 LEU HBx A 112 VAL HGx% 1.0 0.97 7.24 1380 1380 A 112 VAL H A 112 VAL HGx% 1.0 0.80 6.00 1381 1381 A 112 VAL HA A 112 VAL HGx% 1.0 0.69 5.19 1382 1382 A 104 LEU HBy A 112 VAL HGx% 1.0 0.95 7.10 1383 1383 A 113 ALA HB% A 112 VAL HGx% 1.0 0.78 5.85 1384 1384 A 113 ALA H A 112 VAL HGx% 1.0 0.93 6.96 1385 1385 A 106 ASN H A 112 VAL HGy% 1.0 0.89 6.64 1386 1386 A 113 ALA H A 112 VAL HGy% 1.0 0.93 6.96 1387 1387 A 17 ILE H A 113 ALA HB% 1.0 0.72 5.40 1388 1388 A 104 LEU HG A 113 ALA HB% 1.0 0.69 5.16 1389 1389 A 16 CYS H A 113 ALA HB% 1.0 1.05 7.85 1390 1390 A 112 VAL H A 113 ALA HB% 1.0 1.10 8.22 1391 1391 A 104 LEU HBy A 113 ALA HB% 1.0 0.70 5.26 1392 1392 A 113 ALA HB% A 112 VAL HB 1.0 0.79 5.94 1393 1393 A 114 GLN HA A 17 ILE HG1x 1.0 1.04 7.83 1394 1394 A 114 GLN HA A 17 ILE HG1y 1.0 1.04 7.83 1395 1395 A 104 LEU HG A 114 GLN HA 1.0 0.96 7.23 1396 1396 A 115 ARG HA A 115 ARG HGy 1.0 0.78 5.88 1397 1397 A 115 ARG HA A 115 ARG HGx 1.0 0.78 5.88 1398 1398 A 17 ILE HG2% A 115 ARG HBx 1.0 0.87 6.51 1399 1399 A 101 LYS HA A 116 SER HBy 1.0 0.89 6.64 1400 1400 A 101 LYS HA A 116 SER HBx 1.0 0.84 6.33 1401 1401 A 115 ARG HA A 116 SER HBy 1.0 0.94 7.07 1402 1402 A 116 SER H A 116 SER HBx 1.0 0.81 6.08 1403 1403 A 117 THR HA A 117 THR HG2% 1.0 0.65 4.85 1404 1404 A 20 ILE HB A 117 THR HG2% 1.0 0.72 5.40 1405 1405 A 100 VAL HB A 117 THR HG2% 1.0 0.85 6.37 1406 1406 A 116 SER HA A 117 THR HG2% 1.0 0.84 6.30 1407 1407 A 100 VAL H A 117 THR HG2% 1.0 0.75 5.64 1408 1408 A 118 VAL H A 117 THR HG2% 1.0 0.83 6.26 1409 1409 A 118 VAL HA A 118 VAL HGx% 1.0 0.68 5.10 1410 1410 A 118 VAL HA A 118 VAL HGy% 1.0 0.68 5.10 1411 1411 A 118 VAL HA A 119 PHE HA 1.0 0.94 7.02 1412 1412 A 118 VAL H A 118 VAL HGx% 1.0 0.87 6.55 1413 1413 A 119 PHE H A 118 VAL HGy% 1.0 0.89 6.67 1414 1414 A 122 THR H A 121 THR HB 1.0 0.93 6.95 1415 1415 A 100 VAL HGx% A 94 TRP HD1 1.0 0.77 5.76 1416 1416 A 37 GLN HE2x A 38 PRO HDx 1.0 0.94 7.05 1417 1417 A 88 TRP HBy A 74 ALA H 1.0 1.03 7.76 1418 1418 A 89 LYS H A 88 TRP HBy 1.0 1.07 8.02 1419 1419 A 64 LYS HBx A 64 LYS HEx 1.0 1.12 8.43 1420 1420 A 64 LYS HBx A 64 LYS HEy 1.0 1.12 8.43 1421 1421 A 64 LYS HBy A 64 LYS HEx 1.0 1.12 8.43 1422 1422 A 64 LYS HEy A 64 LYS HBy 1.0 1.12 8.43 1423 1423 A 87 ILE HA A 72 TRP HBy 1.0 0.97 7.24 1424 1424 A 100 VAL HGx% A 117 THR HG2% 1.0 0.75 5.65 1425 1425 A 57 TYR HDx A 86 LEU HDx% 1.0 0.90 6.73 1426 1426 A 57 TYR HDx A 86 LEU HDy% 1.0 0.98 7.32 1427 1427 A 53 VAL HGx% A 46 ARG HBy 1.0 0.82 6.14 1428 1428 A 53 VAL HGx% A 46 ARG HBx 1.0 0.82 6.14 1429 1429 A 44 MET HGy A 104 LEU HG 1.0 0.91 6.81 1430 1430 A 44 MET HGx A 104 LEU HG 1.0 1.23 9.26 1431 1431 A 104 LEU HDx% A 113 ALA HB% 1.0 0.62 4.66 1432 1432 A 16 CYS HA A 113 ALA HB% 1.0 0.70 5.28 1433 1433 A 120 LYS HBx A 120 LYS HEx 1.0 1.24 9.30 1434 1434 A 120 LYS HEy A 120 LYS HBx 1.0 1.24 9.30 1435 1435 A 120 LYS HBy A 120 LYS HEx 1.0 1.24 9.30 1436 1436 A 120 LYS HBy A 120 LYS HEy 1.0 1.24 9.30 1437 1437 A 121 THR HA A 121 THR HG2% 1.0 0.73 5.46 1438 1438 A 122 THR H A 121 THR HG2% 1.0 0.90 6.78 1439 1439 A 122 THR H A 122 THR HG2% 1.0 0.93 6.99 1440 1440 A 29 LEU H A 29 LEU HDx% 1.0 0.72 5.40 1441 1441 A 29 LEU H A 29 LEU HDy% 1.0 0.84 6.27 1442 1442 A 37 GLN HA A 38 PRO HDx 1.0 0.72 5.41 1443 1443 A 48 ILE H A 48 ILE HG1y 1.0 1.02 7.68 1444 1444 A 87 ILE HA A 72 TRP HBx 1.0 0.97 7.24 1445 1445 A 73 ALA HA A 88 TRP HBx 1.0 0.94 7.04 1446 1446 A 88 TRP HBy A 73 ALA HA 1.0 0.90 6.78 1447 1447 A 73 ALA HA A 94 TRP HZ3 1.0 1.24 9.30 1448 1448 A 20 ILE HG2% A 117 THR HA 1.0 0.94 7.08 1449 1449 A 100 VAL HGy% A 117 THR HA 1.0 1.24 9.30 1450 1450 A 82 PRO HA A 83 PRO HA 1.0 0.92 6.93 1451 1451 A 28 ARG HA A 29 LEU HA 1.0 0.99 7.42 1452 1452 A 94 TRP HZ2 A 27 ILE HG1x 1.0 0.85 6.36 1453 1453 A 27 ILE HD1% A 94 TRP HZ2 1.0 0.69 5.19 1454 1454 A 94 TRP HZ2 A 27 ILE HG1y 1.0 0.85 6.36 1455 1455 A 54 SER H A 88 TRP HZ2 1.0 0.93 6.98 1456 1456 A 53 VAL HGx% A 88 TRP HZ2 1.0 0.70 5.24 1457 1457 A 53 VAL HGy% A 88 TRP HZ2 1.0 0.69 5.19 1458 1458 A 54 SER HA A 88 TRP HZ2 1.0 0.87 6.49 1459 1459 A 88 TRP HZ2 A 44 MET HE% 1.0 0.94 7.02 1460 1460 A 57 TYR HDx A 55 TYR HEy 1.0 0.94 7.02 1461 1461 A 57 TYR HDy A 55 TYR HEy 1.0 0.97 7.29 1462 1462 A 58 THR H A 55 TYR HEy 1.0 0.96 7.23 1463 1463 A 88 TRP HA A 55 TYR HEx 1.0 0.71 5.31 1464 1464 A 55 TYR HBx A 55 TYR HEy 1.0 0.97 7.30 1465 1465 A 89 LYS H A 55 TYR HEx 1.0 0.82 6.17 1466 1466 A 86 LEU HDx% A 55 TYR HEy 1.0 0.82 6.18 1467 1467 A 71 ILE HG2% A 55 TYR HEy 1.0 0.87 6.51 1468 1468 A 57 TYR HA A 55 TYR HEy 1.0 0.74 5.57 1469 1469 A 44 MET HA A 57 TYR HEy 1.0 0.94 7.05 1470 1470 A 44 MET H A 57 TYR HEy 1.0 0.84 6.30 1471 1471 A 57 TYR HEx A 69 VAL HGx% 1.0 0.89 6.69 1472 1472 A 57 TYR HEx A 69 VAL HGy% 1.0 0.89 6.69 1473 1473 A 104 LEU HDy% A 57 TYR HEy 1.0 0.75 5.60 1474 1474 A 86 LEU HDx% A 57 TYR HEx 1.0 0.74 5.57 1475 1475 A 57 TYR HEy A 44 MET HBx 1.0 0.77 5.77 1476 1476 A 57 TYR H A 57 TYR HEy 1.0 0.93 7.01 1477 1477 A 57 TYR HEy A 44 MET HBy 1.0 0.77 5.77 1478 1478 A 44 MET HGy A 57 TYR HEy 1.0 0.92 6.89 1479 1479 A 63 LEU H A 61 TYR HEx 1.0 0.86 6.46 1480 1480 A 61 TYR HEx A 63 LEU HA 1.0 0.78 5.88 1481 1481 A 86 LEU HDx% A 61 TYR HEy 1.0 0.73 5.46 1482 1482 A 61 TYR HEx A 63 LEU HDx% 1.0 0.92 6.89 1483 1483 A 61 TYR HEx A 62 VAL HA 1.0 0.89 6.70 1484 1484 A 27 ILE HD1% A 88 TRP HZ3 1.0 0.85 6.35 1485 1485 A 72 TRP HE3 A 73 ALA HB% 1.0 0.98 7.38 1486 1486 A 27 ILE HD1% A 94 TRP HH2 1.0 0.76 5.70 1487 1487 A 73 ALA HB% A 94 TRP HH2 1.0 0.84 6.33 1488 1488 A 53 VAL HGx% A 88 TRP HH2 1.0 0.76 5.68 1489 1489 A 88 TRP HH2 A 46 ARG HBy 1.0 0.76 5.67 1490 1490 A 88 TRP HH2 A 46 ARG HBx 1.0 0.76 5.67 1491 1491 A 88 TRP HD1 A 89 LYS HA 1.0 0.90 6.78 1492 1492 A 88 TRP HD1 A 55 TYR HEx 1.0 0.88 6.63 1493 1493 A 89 LYS H A 88 TRP HD1 1.0 0.71 5.32 1494 1494 A 88 TRP HD1 A 90 ASN H 1.0 0.79 5.94 1495 1495 A 88 TRP HA A 88 TRP HD1 1.0 0.68 5.12 1496 1496 A 55 TYR HDx A 88 TRP HD1 1.0 0.74 5.54 1497 1497 A 55 TYR HBy A 88 TRP HD1 1.0 0.88 6.61 1498 1498 A 42 TRP HA A 42 TRP HD1 1.0 0.75 5.63 1499 1499 A 72 TRP H A 72 TRP HD1 1.0 0.71 5.31 1500 1500 A 72 TRP HD1 A 87 ILE HA 1.0 0.91 6.80 1501 1501 A 87 ILE HD1% A 72 TRP HD1 1.0 0.76 5.68 1502 1502 A 72 TRP HD1 A 85 ASP HBy 1.0 0.75 5.61 1503 1503 A 72 TRP HD1 A 85 ASP HBx 1.0 0.82 6.14 1504 1504 A 72 TRP HD1 A 87 ILE HG1y 1.0 0.98 7.38 1505 1505 A 70 THR HB A 72 TRP HD1 1.0 0.87 6.52 1506 1506 A 100 VAL HGy% A 94 TRP HD1 1.0 0.95 7.11 1507 1507 A 100 VAL HB A 94 TRP HD1 1.0 0.89 6.64 1508 1508 A 24 GLY HAx A 94 TRP HD1 1.0 0.82 6.12 1509 1509 A 26 PHE HBy A 26 PHE HEy 1.0 0.97 7.26 1510 1510 A 119 PHE H A 119 PHE HDx 1.0 0.85 6.36 1511 1511 A 119 PHE H A 119 PHE HDy 1.0 0.92 6.90 1512 1512 A 119 PHE HA A 119 PHE HDx 1.0 0.98 7.36 1513 1513 A 119 PHE HA A 119 PHE HDy 1.0 1.03 7.74 1514 1514 A 55 TYR H A 55 TYR HDy 1.0 0.97 7.27 1515 1515 A 44 MET H A 55 TYR HDy 1.0 0.96 7.17 1516 1516 A 55 TYR HDy A 57 TYR HEy 1.0 0.77 5.80 1517 1517 A 55 TYR HDx A 55 TYR HBy 1.0 0.70 5.26 1518 1518 A 55 TYR HDx A 90 ASN H 1.0 0.90 6.78 1519 1519 A 71 ILE HG2% A 55 TYR HDy 1.0 0.85 6.36 1520 1520 A 55 TYR HBx A 55 TYR HDy 1.0 0.68 5.12 1521 1521 A 57 TYR H A 55 TYR HDy 1.0 0.98 7.36 1522 1522 A 55 TYR HDx A 88 TRP HA 1.0 0.90 6.77 1523 1523 A 71 ILE HD1% A 55 TYR HDy 1.0 0.90 6.77 1524 1524 A 57 TYR HA A 55 TYR HDy 1.0 0.90 6.75 1525 1525 A 55 TYR HDx A 55 TYR HA 1.0 0.75 5.61 1526 1526 A 57 TYR HDy A 55 TYR HDy 1.0 0.86 6.48 1527 1527 A 26 PHE HDx A 25 LYS HBx 1.0 0.90 6.78 1528 1528 A 26 PHE HDx A 25 LYS HBy 1.0 0.90 6.78 1529 1529 A 26 PHE HDy A 70 THR HG2% 1.0 0.75 5.61 1530 1530 A 26 PHE HBx A 26 PHE HDx 1.0 0.71 5.31 1531 1531 A 26 PHE HBy A 26 PHE HDy 1.0 0.74 5.58 1532 1532 A 26 PHE HDy A 27 ILE HA 1.0 0.85 6.36 1533 1533 A 26 PHE HA A 26 PHE HDx 1.0 0.94 7.02 1534 1534 A 26 PHE HA A 26 PHE HDy 1.0 1.00 7.48 1535 1535 A 63 LEU H A 61 TYR HDx 1.0 0.91 6.84 1536 1536 A 61 TYR HDx A 62 VAL HGx% 1.0 0.99 7.45 1537 1537 A 61 TYR HDx A 62 VAL HA 1.0 0.93 6.99 1538 1538 A 86 LEU HBx A 72 TRP HD1 1.0 1.02 7.64 1539 1539 A 71 ILE HA A 72 TRP HD1 1.0 0.90 6.72 1540 1540 A 57 TYR HDx A 57 TYR HA 1.0 0.92 6.93 1541 1541 A 57 TYR HDy A 57 TYR HA 1.0 0.96 7.21 1542 1542 A 73 ALA HB% A 94 TRP HZ3 1.0 0.88 6.61 1543 1543 A 15 VAL HB A 42 TRP HH2 1.0 0.86 6.46 1544 1544 A 8 HIS H A 7 HIS HBx 1.0 0.85 6.36 1545 1544 A 8 HIS H A 7 HIS HBy 1.0 0.85 6.36 1546 1545 A 9 SER H A 9 SER HBx 1.0 0.72 5.43 1547 1545 A 9 SER H A 9 SER HBy 1.0 0.72 5.43 1548 1546 A 10 HIS H A 10 HIS HBx 1.0 0.68 5.12 1549 1546 A 10 HIS H A 10 HIS HBy 1.0 0.68 5.12 1550 1547 A 11 MET H A 10 HIS HBx 1.0 0.85 6.39 1551 1547 A 11 MET H A 10 HIS HBy 1.0 0.85 6.39 1552 1548 A 14 ASN H A 14 ASN HBy 1.0 0.69 5.19 1553 1548 A 14 ASN H A 14 ASN HBx 1.0 0.69 5.19 1554 1549 A 14 ASN H A 14 ASN HD2y 1.0 0.94 7.05 1555 1549 A 14 ASN H A 14 ASN HD2x 1.0 0.94 7.05 1556 1550 A 14 ASN H A 15 VAL HGy% 1.0 0.79 5.94 1557 1550 A 14 ASN H A 15 VAL HGx% 1.0 0.79 5.94 1558 1551 A 14 ASN HA A 14 ASN HD2y 1.0 0.75 5.61 1559 1551 A 14 ASN HD2x A 14 ASN HA 1.0 0.75 5.61 1560 1552 A 14 ASN HBy A 14 ASN HD2y 1.0 0.64 4.80 1561 1552 A 14 ASN HBx A 14 ASN HD2y 1.0 0.64 4.80 1562 1552 A 14 ASN HD2x A 14 ASN HBy 1.0 0.64 4.80 1563 1552 A 14 ASN HBx A 14 ASN HD2x 1.0 0.64 4.80 1564 1553 A 15 VAL H A 14 ASN HBy 1.0 0.83 6.20 1565 1553 A 15 VAL H A 14 ASN HBx 1.0 0.83 6.20 1566 1554 A 33 SER H A 14 ASN HBy 1.0 1.05 7.87 1567 1554 A 33 SER H A 14 ASN HBx 1.0 1.05 7.87 1568 1555 A 14 ASN HBy A 33 SER HBy 1.0 0.73 5.45 1569 1555 A 14 ASN HBx A 33 SER HBy 1.0 0.73 5.45 1570 1555 A 33 SER HBx A 14 ASN HBy 1.0 0.73 5.45 1571 1555 A 14 ASN HBx A 33 SER HBx 1.0 0.73 5.45 1572 1556 A 15 VAL H A 15 VAL HGy% 1.0 0.61 4.57 1573 1556 A 15 VAL H A 15 VAL HGx% 1.0 0.61 4.57 1574 1557 A 16 CYS H A 15 VAL HGy% 1.0 0.64 4.80 1575 1557 A 16 CYS H A 15 VAL HGx% 1.0 0.64 4.80 1576 1558 A 16 CYS HA A 15 VAL HGy% 1.0 0.78 5.82 1577 1558 A 16 CYS HA A 15 VAL HGx% 1.0 0.78 5.82 1578 1559 A 15 VAL HGx% A 16 CYS HBy 1.0 0.97 7.26 1579 1559 A 15 VAL HGy% A 16 CYS HBy 1.0 0.97 7.26 1580 1559 A 16 CYS HBx A 15 VAL HGy% 1.0 0.97 7.26 1581 1559 A 15 VAL HGx% A 16 CYS HBx 1.0 0.97 7.26 1582 1560 A 15 VAL HGy% A 29 LEU HBx 1.0 0.73 5.51 1583 1560 A 15 VAL HGx% A 29 LEU HBx 1.0 0.73 5.51 1584 1560 A 29 LEU HBy A 15 VAL HGy% 1.0 0.73 5.51 1585 1560 A 15 VAL HGx% A 29 LEU HBy 1.0 0.73 5.51 1586 1561 A 29 LEU HG A 15 VAL HGy% 1.0 0.83 6.23 1587 1561 A 29 LEU HG A 15 VAL HGx% 1.0 0.83 6.23 1588 1562 A 29 LEU HDy% A 15 VAL HGy% 1.0 0.64 4.80 1589 1562 A 29 LEU HDy% A 15 VAL HGx% 1.0 0.64 4.80 1590 1563 A 30 LYS H A 15 VAL HGy% 1.0 0.71 5.35 1591 1563 A 30 LYS H A 15 VAL HGx% 1.0 0.71 5.35 1592 1564 A 31 ASN H A 15 VAL HGy% 1.0 0.95 7.10 1593 1564 A 31 ASN H A 15 VAL HGx% 1.0 0.95 7.10 1594 1565 A 31 ASN HA A 15 VAL HGy% 1.0 0.70 5.24 1595 1565 A 31 ASN HA A 15 VAL HGx% 1.0 0.70 5.24 1596 1566 A 15 VAL HGy% A 31 ASN HBx 1.0 0.78 5.88 1597 1566 A 31 ASN HBy A 15 VAL HGy% 1.0 0.78 5.88 1598 1566 A 15 VAL HGx% A 31 ASN HBy 1.0 0.78 5.88 1599 1566 A 15 VAL HGx% A 31 ASN HBx 1.0 0.78 5.88 1600 1567 A 31 ASN HD2x A 15 VAL HGy% 1.0 0.92 6.90 1601 1567 A 31 ASN HD2x A 15 VAL HGx% 1.0 0.92 6.90 1602 1568 A 31 ASN HD2y A 15 VAL HGy% 1.0 0.91 6.81 1603 1568 A 31 ASN HD2y A 15 VAL HGx% 1.0 0.91 6.81 1604 1569 A 42 TRP HH2 A 15 VAL HGy% 1.0 0.84 6.27 1605 1569 A 42 TRP HH2 A 15 VAL HGx% 1.0 0.84 6.27 1606 1570 A 16 CYS H A 16 CYS HBy 1.0 0.70 5.24 1607 1570 A 16 CYS H A 16 CYS HBx 1.0 0.70 5.24 1608 1571 A 32 THR HG2% A 16 CYS HBy 1.0 0.94 7.05 1609 1571 A 32 THR HG2% A 16 CYS HBx 1.0 0.94 7.05 1610 1572 A 113 ALA HB% A 16 CYS HBy 1.0 0.80 6.00 1611 1572 A 113 ALA HB% A 16 CYS HBx 1.0 0.80 6.00 1612 1573 A 17 ILE H A 17 ILE HG1y 1.0 0.72 5.41 1613 1573 A 17 ILE H A 17 ILE HG1x 1.0 0.72 5.41 1614 1574 A 17 ILE HA A 17 ILE HG1y 1.0 0.74 5.58 1615 1574 A 17 ILE HA A 17 ILE HG1x 1.0 0.74 5.58 1616 1575 A 17 ILE HB A 115 ARG HBy 1.0 0.89 6.69 1617 1575 A 17 ILE HB A 115 ARG HBx 1.0 0.89 6.69 1618 1576 A 17 ILE HG2% A 17 ILE HG1y 1.0 0.66 4.96 1619 1576 A 17 ILE HG2% A 17 ILE HG1x 1.0 0.66 4.96 1620 1577 A 17 ILE HG2% A 115 ARG HBy 1.0 0.74 5.52 1621 1577 A 17 ILE HG2% A 115 ARG HBx 1.0 0.74 5.52 1622 1578 A 17 ILE HG2% A 115 ARG HGx 1.0 1.04 7.79 1623 1578 A 17 ILE HG2% A 115 ARG HGy 1.0 1.04 7.79 1624 1579 A 17 ILE HG2% A 115 ARG HDx 1.0 0.72 5.40 1625 1579 A 17 ILE HG2% A 115 ARG HDy 1.0 0.72 5.40 1626 1580 A 29 LEU HDx% A 17 ILE HG1y 1.0 0.59 4.44 1627 1580 A 29 LEU HDx% A 17 ILE HG1x 1.0 0.59 4.44 1628 1581 A 114 GLN HA A 17 ILE HG1y 1.0 0.91 6.80 1629 1581 A 114 GLN HA A 17 ILE HG1x 1.0 0.91 6.80 1630 1582 A 17 ILE HD1% A 115 ARG HBy 1.0 0.69 5.16 1631 1582 A 17 ILE HD1% A 115 ARG HBx 1.0 0.69 5.16 1632 1583 A 17 ILE HD1% A 115 ARG HGx 1.0 1.17 8.74 1633 1583 A 17 ILE HD1% A 115 ARG HGy 1.0 1.17 8.74 1634 1584 A 18 GLU H A 18 GLU HBy 1.0 0.65 4.89 1635 1584 A 18 GLU H A 18 GLU HBx 1.0 0.65 4.89 1636 1585 A 18 GLU H A 18 GLU HGx 1.0 0.88 6.63 1637 1585 A 18 GLU H A 18 GLU HGy 1.0 0.88 6.63 1638 1586 A 18 GLU H A 29 LEU HBx 1.0 0.80 6.03 1639 1586 A 18 GLU H A 29 LEU HBy 1.0 0.80 6.03 1640 1587 A 18 GLU HA A 18 GLU HGx 1.0 0.69 5.16 1641 1587 A 18 GLU HA A 18 GLU HGy 1.0 0.69 5.16 1642 1588 A 19 GLU H A 18 GLU HBy 1.0 0.64 4.79 1643 1588 A 19 GLU H A 18 GLU HBx 1.0 0.64 4.79 1644 1589 A 28 ARG HGx A 18 GLU HBy 1.0 0.83 6.21 1645 1589 A 28 ARG HGx A 18 GLU HBx 1.0 0.83 6.21 1646 1590 A 29 LEU H A 18 GLU HBy 1.0 0.90 6.73 1647 1590 A 29 LEU H A 18 GLU HBx 1.0 0.90 6.73 1648 1591 A 29 LEU HA A 18 GLU HBy 1.0 0.90 6.73 1649 1591 A 29 LEU HA A 18 GLU HBx 1.0 0.90 6.73 1650 1592 A 30 LYS H A 18 GLU HBy 1.0 0.79 5.91 1651 1592 A 30 LYS H A 18 GLU HBx 1.0 0.79 5.91 1652 1593 A 19 GLU H A 18 GLU HGx 1.0 0.82 6.14 1653 1593 A 19 GLU H A 18 GLU HGy 1.0 0.82 6.14 1654 1594 A 30 LYS H A 18 GLU HGx 1.0 1.00 7.47 1655 1594 A 30 LYS H A 18 GLU HGy 1.0 1.00 7.47 1656 1595 A 19 GLU H A 19 GLU HBy 1.0 0.71 5.29 1657 1595 A 19 GLU H A 19 GLU HBx 1.0 0.71 5.29 1658 1596 A 19 GLU H A 19 GLU HGx 1.0 0.88 6.61 1659 1596 A 19 GLU H A 19 GLU HGy 1.0 0.88 6.61 1660 1597 A 19 GLU HA A 19 GLU HGx 1.0 0.69 5.15 1661 1597 A 19 GLU HA A 19 GLU HGy 1.0 0.69 5.15 1662 1598 A 20 ILE H A 19 GLU HBy 1.0 0.75 5.60 1663 1598 A 20 ILE H A 19 GLU HBx 1.0 0.75 5.60 1664 1599 A 20 ILE H A 19 GLU HGx 1.0 0.67 5.01 1665 1599 A 20 ILE H A 19 GLU HGy 1.0 0.67 5.01 1666 1600 A 20 ILE H A 20 ILE HG1x 1.0 0.72 5.38 1667 1600 A 20 ILE H A 20 ILE HG1y 1.0 0.72 5.38 1668 1601 A 20 ILE HA A 20 ILE HG1x 1.0 0.74 5.52 1669 1601 A 20 ILE HA A 20 ILE HG1y 1.0 0.74 5.52 1670 1602 A 20 ILE HG2% A 20 ILE HG1x 1.0 0.62 4.62 1671 1602 A 20 ILE HG2% A 20 ILE HG1y 1.0 0.62 4.62 1672 1603 A 20 ILE HG2% A 21 ASP HBy 1.0 0.81 6.08 1673 1603 A 20 ILE HG2% A 21 ASP HBx 1.0 0.81 6.08 1674 1604 A 21 ASP H A 20 ILE HG1x 1.0 0.90 6.77 1675 1604 A 21 ASP H A 20 ILE HG1y 1.0 0.90 6.77 1676 1605 A 20 ILE HD1% A 102 VAL HGy% 1.0 0.62 4.62 1677 1605 A 20 ILE HD1% A 102 VAL HGx% 1.0 0.62 4.62 1678 1606 A 20 ILE HD1% A 115 ARG HGx 1.0 0.81 6.09 1679 1606 A 20 ILE HD1% A 115 ARG HGy 1.0 0.81 6.09 1680 1607 A 24 GLY H A 21 ASP HBy 1.0 0.75 5.60 1681 1607 A 24 GLY H A 21 ASP HBx 1.0 0.75 5.60 1682 1608 A 25 LYS H A 21 ASP HBy 1.0 0.67 4.99 1683 1608 A 25 LYS H A 21 ASP HBx 1.0 0.67 4.99 1684 1609 A 25 LYS HA A 21 ASP HBy 1.0 1.05 7.90 1685 1609 A 25 LYS HA A 21 ASP HBx 1.0 1.05 7.90 1686 1610 A 21 ASP HBy A 25 LYS HBx 1.0 0.85 6.36 1687 1610 A 21 ASP HBx A 25 LYS HBx 1.0 0.85 6.36 1688 1610 A 25 LYS HBy A 21 ASP HBy 1.0 0.85 6.36 1689 1610 A 21 ASP HBx A 25 LYS HBy 1.0 0.85 6.36 1690 1611 A 26 PHE H A 21 ASP HBy 1.0 0.58 4.37 1691 1611 A 26 PHE H A 21 ASP HBx 1.0 0.58 4.37 1692 1612 A 27 ILE HA A 21 ASP HBy 1.0 1.07 8.05 1693 1612 A 27 ILE HA A 21 ASP HBx 1.0 1.07 8.05 1694 1613 A 22 VAL HGx% A 23 ASP HBy 1.0 0.83 6.20 1695 1613 A 22 VAL HGx% A 23 ASP HBx 1.0 0.83 6.20 1696 1614 A 23 ASP H A 23 ASP HBy 1.0 0.59 4.40 1697 1614 A 23 ASP H A 23 ASP HBx 1.0 0.59 4.40 1698 1615 A 24 GLY H A 23 ASP HBy 1.0 0.82 6.14 1699 1615 A 24 GLY H A 23 ASP HBx 1.0 0.82 6.14 1700 1616 A 25 LYS H A 23 ASP HBy 1.0 0.90 6.77 1701 1616 A 25 LYS H A 23 ASP HBx 1.0 0.90 6.77 1702 1617 A 25 LYS H A 25 LYS HBx 1.0 0.68 5.07 1703 1617 A 25 LYS H A 25 LYS HBy 1.0 0.68 5.07 1704 1618 A 25 LYS H A 25 LYS HGy 1.0 0.70 5.22 1705 1618 A 25 LYS H A 25 LYS HGx 1.0 0.70 5.22 1706 1619 A 25 LYS HA A 25 LYS HGy 1.0 0.72 5.38 1707 1619 A 25 LYS HA A 25 LYS HGx 1.0 0.72 5.38 1708 1620 A 25 LYS HA A 25 LYS HDy 1.0 0.93 6.98 1709 1620 A 25 LYS HA A 25 LYS HDx 1.0 0.93 6.98 1710 1621 A 25 LYS HBy A 25 LYS HEx 1.0 0.82 6.18 1711 1621 A 25 LYS HBx A 25 LYS HEx 1.0 0.82 6.18 1712 1621 A 25 LYS HEy A 25 LYS HBx 1.0 0.82 6.18 1713 1621 A 25 LYS HBy A 25 LYS HEy 1.0 0.82 6.18 1714 1622 A 26 PHE H A 25 LYS HBx 1.0 0.77 5.79 1715 1622 A 26 PHE H A 25 LYS HBy 1.0 0.77 5.79 1716 1623 A 26 PHE HBx A 25 LYS HBx 1.0 0.95 7.14 1717 1623 A 26 PHE HBx A 25 LYS HBy 1.0 0.95 7.14 1718 1624 A 26 PHE HDx A 25 LYS HBx 1.0 0.79 5.91 1719 1624 A 26 PHE HDx A 25 LYS HBy 1.0 0.79 5.91 1720 1625 A 25 LYS HEx A 25 LYS HGy 1.0 0.66 4.98 1721 1625 A 25 LYS HEy A 25 LYS HGy 1.0 0.66 4.98 1722 1625 A 25 LYS HGx A 25 LYS HEx 1.0 0.66 4.98 1723 1625 A 25 LYS HGx A 25 LYS HEy 1.0 0.66 4.98 1724 1626 A 26 PHE H A 25 LYS HGy 1.0 0.91 6.84 1725 1626 A 26 PHE H A 25 LYS HGx 1.0 0.91 6.84 1726 1627 A 27 ILE H A 27 ILE HG1y 1.0 0.84 6.27 1727 1627 A 27 ILE H A 27 ILE HG1x 1.0 0.84 6.27 1728 1628 A 27 ILE HA A 27 ILE HG1y 1.0 0.71 5.29 1729 1628 A 27 ILE HA A 27 ILE HG1x 1.0 0.71 5.29 1730 1629 A 27 ILE HG2% A 27 ILE HG1y 1.0 0.66 4.92 1731 1629 A 27 ILE HG2% A 27 ILE HG1x 1.0 0.66 4.92 1732 1630 A 28 ARG H A 27 ILE HG1y 1.0 1.00 7.50 1733 1630 A 28 ARG H A 27 ILE HG1x 1.0 1.00 7.50 1734 1631 A 94 TRP HE1 A 27 ILE HG1y 1.0 1.09 8.19 1735 1631 A 94 TRP HE1 A 27 ILE HG1x 1.0 1.09 8.19 1736 1632 A 94 TRP HZ2 A 27 ILE HG1y 1.0 0.73 5.48 1737 1632 A 94 TRP HZ2 A 27 ILE HG1x 1.0 0.73 5.48 1738 1633 A 28 ARG HBy A 28 ARG HDx 1.0 0.72 5.38 1739 1633 A 28 ARG HBy A 28 ARG HDy 1.0 0.72 5.38 1740 1634 A 28 ARG HBx A 28 ARG HDx 1.0 0.73 5.48 1741 1634 A 28 ARG HBx A 28 ARG HDy 1.0 0.73 5.48 1742 1635 A 28 ARG HGy A 69 VAL HGy% 1.0 1.11 8.36 1743 1635 A 28 ARG HGy A 69 VAL HGx% 1.0 1.11 8.36 1744 1636 A 68 THR HB A 28 ARG HDx 1.0 0.86 6.45 1745 1636 A 68 THR HB A 28 ARG HDy 1.0 0.86 6.45 1746 1637 A 68 THR HG2% A 28 ARG HDx 1.0 0.69 5.16 1747 1637 A 68 THR HG2% A 28 ARG HDy 1.0 0.69 5.16 1748 1638 A 29 LEU H A 29 LEU HBx 1.0 0.71 5.32 1749 1638 A 29 LEU H A 29 LEU HBy 1.0 0.71 5.32 1750 1639 A 29 LEU H A 69 VAL HGy% 1.0 0.71 5.34 1751 1639 A 29 LEU H A 69 VAL HGx% 1.0 0.71 5.34 1752 1640 A 30 LYS H A 29 LEU HBx 1.0 0.66 4.93 1753 1640 A 30 LYS H A 29 LEU HBy 1.0 0.66 4.93 1754 1641 A 68 THR HA A 29 LEU HBx 1.0 0.98 7.32 1755 1641 A 68 THR HA A 29 LEU HBy 1.0 0.98 7.32 1756 1642 A 69 VAL H A 29 LEU HBx 1.0 0.87 6.54 1757 1642 A 69 VAL H A 29 LEU HBy 1.0 0.87 6.54 1758 1643 A 29 LEU HBx A 69 VAL HGy% 1.0 0.66 4.95 1759 1643 A 29 LEU HBy A 69 VAL HGy% 1.0 0.66 4.95 1760 1643 A 69 VAL HGx% A 29 LEU HBx 1.0 0.66 4.95 1761 1643 A 29 LEU HBy A 69 VAL HGx% 1.0 0.66 4.95 1762 1644 A 29 LEU HG A 69 VAL HGy% 1.0 1.18 8.82 1763 1644 A 29 LEU HG A 69 VAL HGx% 1.0 1.18 8.82 1764 1645 A 29 LEU HDy% A 69 VAL HGy% 1.0 0.61 4.56 1765 1645 A 29 LEU HDy% A 69 VAL HGx% 1.0 0.61 4.56 1766 1646 A 30 LYS H A 30 LYS HBx 1.0 0.72 5.38 1767 1646 A 30 LYS H A 30 LYS HBy 1.0 0.72 5.38 1768 1647 A 30 LYS H A 63 LEU HDx% 1.0 0.99 7.39 1769 1647 A 30 LYS H A 63 LEU HDy% 1.0 0.99 7.39 1770 1648 A 30 LYS H A 69 VAL HGy% 1.0 0.87 6.55 1771 1648 A 30 LYS H A 69 VAL HGx% 1.0 0.87 6.55 1772 1649 A 30 LYS HBx A 30 LYS HDy 1.0 0.64 4.77 1773 1649 A 30 LYS HBy A 30 LYS HDy 1.0 0.64 4.77 1774 1649 A 30 LYS HDx A 30 LYS HBx 1.0 0.64 4.77 1775 1649 A 30 LYS HBy A 30 LYS HDx 1.0 0.64 4.77 1776 1650 A 30 LYS HBy A 30 LYS HEx 1.0 0.94 7.07 1777 1650 A 30 LYS HBx A 30 LYS HEx 1.0 0.94 7.07 1778 1650 A 30 LYS HEy A 30 LYS HBx 1.0 0.94 7.07 1779 1650 A 30 LYS HBy A 30 LYS HEy 1.0 0.94 7.07 1780 1651 A 31 ASN H A 30 LYS HBx 1.0 0.75 5.60 1781 1651 A 31 ASN H A 30 LYS HBy 1.0 0.75 5.60 1782 1652 A 68 THR HA A 30 LYS HBx 1.0 1.09 8.19 1783 1652 A 68 THR HA A 30 LYS HBy 1.0 1.09 8.19 1784 1653 A 68 THR HG2% A 30 LYS HBx 1.0 0.68 5.07 1785 1653 A 68 THR HG2% A 30 LYS HBy 1.0 0.68 5.07 1786 1654 A 30 LYS HGx A 30 LYS HEx 1.0 0.73 5.48 1787 1654 A 30 LYS HGx A 30 LYS HEy 1.0 0.73 5.48 1788 1655 A 30 LYS HGy A 30 LYS HEx 1.0 0.74 5.57 1789 1655 A 30 LYS HGy A 30 LYS HEy 1.0 0.74 5.57 1790 1656 A 68 THR HG2% A 30 LYS HDy 1.0 0.73 5.46 1791 1656 A 68 THR HG2% A 30 LYS HDx 1.0 0.73 5.46 1792 1657 A 68 THR HG2% A 30 LYS HEx 1.0 0.88 6.63 1793 1657 A 68 THR HG2% A 30 LYS HEy 1.0 0.88 6.63 1794 1658 A 31 ASN H A 31 ASN HBx 1.0 0.65 4.89 1795 1658 A 31 ASN H A 31 ASN HBy 1.0 0.65 4.89 1796 1659 A 31 ASN H A 63 LEU HDx% 1.0 0.83 6.26 1797 1659 A 31 ASN H A 63 LEU HDy% 1.0 0.83 6.26 1798 1660 A 31 ASN HBx A 63 LEU HDx% 1.0 0.83 6.24 1799 1660 A 31 ASN HBy A 63 LEU HDx% 1.0 0.83 6.24 1800 1660 A 63 LEU HDy% A 31 ASN HBx 1.0 0.83 6.24 1801 1660 A 31 ASN HBy A 63 LEU HDy% 1.0 0.83 6.24 1802 1661 A 65 ALA HA A 31 ASN HBx 1.0 1.05 7.87 1803 1661 A 65 ALA HA A 31 ASN HBy 1.0 1.05 7.87 1804 1662 A 66 GLY H A 31 ASN HBx 1.0 0.78 5.88 1805 1662 A 66 GLY H A 31 ASN HBy 1.0 0.78 5.88 1806 1663 A 67 GLN H A 31 ASN HBx 1.0 0.82 6.14 1807 1663 A 67 GLN H A 31 ASN HBy 1.0 0.82 6.14 1808 1664 A 31 ASN HD2x A 37 GLN HBy 1.0 0.89 6.67 1809 1664 A 31 ASN HD2x A 37 GLN HBx 1.0 0.89 6.67 1810 1665 A 31 ASN HD2x A 63 LEU HBx 1.0 0.99 7.45 1811 1665 A 31 ASN HD2x A 63 LEU HBy 1.0 0.99 7.45 1812 1666 A 31 ASN HD2y A 37 GLN HBy 1.0 0.91 6.80 1813 1666 A 31 ASN HD2y A 37 GLN HBx 1.0 0.91 6.80 1814 1667 A 31 ASN HD2y A 37 GLN HGy 1.0 0.81 6.05 1815 1667 A 31 ASN HD2y A 37 GLN HGx 1.0 0.81 6.05 1816 1668 A 32 THR H A 63 LEU HDx% 1.0 1.22 9.17 1817 1668 A 32 THR H A 63 LEU HDy% 1.0 1.22 9.17 1818 1669 A 33 SER H A 33 SER HBy 1.0 0.66 4.93 1819 1669 A 33 SER H A 33 SER HBx 1.0 0.66 4.93 1820 1670 A 34 GLU H A 33 SER HBy 1.0 0.62 4.66 1821 1670 A 34 GLU H A 33 SER HBx 1.0 0.62 4.66 1822 1671 A 34 GLU HGx A 33 SER HBy 1.0 0.86 6.42 1823 1671 A 34 GLU HGx A 33 SER HBx 1.0 0.86 6.42 1824 1672 A 35 GLN H A 33 SER HBy 1.0 0.74 5.54 1825 1672 A 35 GLN H A 33 SER HBx 1.0 0.74 5.54 1826 1673 A 35 GLN H A 35 GLN HGx 1.0 1.07 8.01 1827 1673 A 35 GLN H A 35 GLN HGy 1.0 1.07 8.01 1828 1674 A 36 ASP H A 35 GLN HBy 1.0 0.67 4.99 1829 1674 A 36 ASP H A 35 GLN HBx 1.0 0.67 4.99 1830 1675 A 35 GLN HE2y A 35 GLN HGx 1.0 0.62 4.62 1831 1675 A 35 GLN HGy A 35 GLN HE2y 1.0 0.62 4.62 1832 1675 A 35 GLN HGy A 35 GLN HE2x 1.0 0.62 4.62 1833 1675 A 35 GLN HE2x A 35 GLN HGx 1.0 0.62 4.62 1834 1676 A 36 ASP H A 35 GLN HGx 1.0 0.74 5.54 1835 1676 A 36 ASP H A 35 GLN HGy 1.0 0.74 5.54 1836 1677 A 65 ALA HB% A 35 GLN HGx 1.0 1.15 8.61 1837 1677 A 65 ALA HB% A 35 GLN HGy 1.0 1.15 8.61 1838 1678 A 36 ASP H A 62 VAL HGy% 1.0 1.13 8.45 1839 1678 A 36 ASP H A 62 VAL HGx% 1.0 1.13 8.45 1840 1679 A 36 ASP HA A 62 VAL HGy% 1.0 0.85 6.35 1841 1679 A 36 ASP HA A 62 VAL HGx% 1.0 0.85 6.35 1842 1680 A 36 ASP HBx A 62 VAL HGy% 1.0 0.74 5.57 1843 1680 A 36 ASP HBx A 62 VAL HGx% 1.0 0.74 5.57 1844 1681 A 36 ASP HBx A 64 LYS HDy 1.0 1.20 9.00 1845 1681 A 36 ASP HBx A 64 LYS HDx 1.0 1.20 9.00 1846 1682 A 36 ASP HBy A 62 VAL HGy% 1.0 0.71 5.32 1847 1682 A 36 ASP HBy A 62 VAL HGx% 1.0 0.71 5.32 1848 1683 A 36 ASP HBy A 64 LYS HDy 1.0 1.20 9.00 1849 1683 A 36 ASP HBy A 64 LYS HDx 1.0 1.20 9.00 1850 1684 A 37 GLN H A 37 GLN HBy 1.0 0.68 5.12 1851 1684 A 37 GLN H A 37 GLN HBx 1.0 0.68 5.12 1852 1685 A 37 GLN H A 62 VAL HGy% 1.0 0.78 5.85 1853 1685 A 37 GLN H A 62 VAL HGx% 1.0 0.78 5.85 1854 1686 A 37 GLN H A 63 LEU HBx 1.0 0.93 6.99 1855 1686 A 37 GLN H A 63 LEU HBy 1.0 0.93 6.99 1856 1687 A 37 GLN HA A 38 PRO HGx 1.0 0.89 6.69 1857 1687 A 37 GLN HA A 38 PRO HGy 1.0 0.89 6.69 1858 1688 A 37 GLN HA A 38 PRO HDx 1.0 0.60 4.53 1859 1688 A 37 GLN HA A 38 PRO HDy 1.0 0.60 4.53 1860 1689 A 37 GLN HBy A 38 PRO HDx 1.0 0.82 6.17 1861 1689 A 37 GLN HBx A 38 PRO HDx 1.0 0.82 6.17 1862 1689 A 38 PRO HDy A 37 GLN HBy 1.0 0.82 6.17 1863 1689 A 37 GLN HBx A 38 PRO HDy 1.0 0.82 6.17 1864 1690 A 37 GLN HE2x A 38 PRO HDy 1.0 0.69 5.21 1865 1690 A 37 GLN HE2y A 38 PRO HDy 1.0 0.69 5.21 1866 1690 A 37 GLN HE2x A 38 PRO HDx 1.0 0.69 5.21 1867 1690 A 37 GLN HE2y A 38 PRO HDx 1.0 0.69 5.21 1868 1691 A 38 PRO HA A 62 VAL HGy% 1.0 0.63 4.74 1869 1691 A 38 PRO HA A 62 VAL HGx% 1.0 0.63 4.74 1870 1692 A 39 MET H A 38 PRO HBx 1.0 0.74 5.54 1871 1692 A 39 MET H A 38 PRO HBy 1.0 0.74 5.54 1872 1693 A 40 GLY HAy A 38 PRO HBx 1.0 0.90 6.77 1873 1693 A 40 GLY HAy A 38 PRO HBy 1.0 0.90 6.77 1874 1694 A 38 PRO HBy A 62 VAL HGy% 1.0 0.68 5.12 1875 1694 A 38 PRO HBx A 62 VAL HGy% 1.0 0.68 5.12 1876 1694 A 62 VAL HGx% A 38 PRO HBx 1.0 0.68 5.12 1877 1694 A 62 VAL HGx% A 38 PRO HBy 1.0 0.68 5.12 1878 1695 A 38 PRO HGx A 62 VAL HGy% 1.0 0.96 7.23 1879 1695 A 38 PRO HGy A 62 VAL HGy% 1.0 0.96 7.23 1880 1695 A 62 VAL HGx% A 38 PRO HGx 1.0 0.96 7.23 1881 1695 A 62 VAL HGx% A 38 PRO HGy 1.0 0.96 7.23 1882 1696 A 39 MET H A 62 VAL HGy% 1.0 0.73 5.51 1883 1696 A 39 MET H A 62 VAL HGx% 1.0 0.73 5.51 1884 1697 A 39 MET HE% A 39 MET HBx 1.0 0.73 5.45 1885 1697 A 39 MET HE% A 39 MET HBy 1.0 0.73 5.45 1886 1698 A 61 TYR HDx A 39 MET HBx 1.0 1.17 8.74 1887 1698 A 61 TYR HDx A 39 MET HBy 1.0 1.17 8.74 1888 1699 A 61 TYR HEy A 39 MET HBx 1.0 0.91 6.84 1889 1699 A 61 TYR HEy A 39 MET HBy 1.0 0.91 6.84 1890 1700 A 61 TYR HDy A 39 MET HBx 1.0 0.93 6.95 1891 1700 A 61 TYR HDy A 39 MET HBy 1.0 0.93 6.95 1892 1701 A 63 LEU H A 39 MET HBx 1.0 0.95 7.10 1893 1701 A 63 LEU H A 39 MET HBy 1.0 0.95 7.10 1894 1702 A 39 MET HE% A 42 TRP HBy 1.0 0.78 5.87 1895 1702 A 39 MET HE% A 42 TRP HBx 1.0 0.78 5.87 1896 1703 A 40 GLY H A 62 VAL HGy% 1.0 0.94 7.07 1897 1703 A 40 GLY H A 62 VAL HGx% 1.0 0.94 7.07 1898 1704 A 40 GLY HAy A 41 GLY HAx 1.0 0.93 6.96 1899 1704 A 40 GLY HAy A 41 GLY HAy 1.0 0.93 6.96 1900 1705 A 42 TRP H A 42 TRP HBy 1.0 0.63 4.74 1901 1705 A 42 TRP H A 42 TRP HBx 1.0 0.63 4.74 1902 1706 A 106 ASN HD2y A 42 TRP HA 1.0 1.02 7.68 1903 1706 A 106 ASN HD2x A 42 TRP HA 1.0 1.02 7.68 1904 1707 A 43 GLU H A 42 TRP HBy 1.0 0.66 4.98 1905 1707 A 43 GLU H A 42 TRP HBx 1.0 0.66 4.98 1906 1708 A 57 TYR HDy A 42 TRP HBy 1.0 1.09 8.20 1907 1708 A 57 TYR HDy A 42 TRP HBx 1.0 1.09 8.20 1908 1709 A 42 TRP HZ2 A 112 VAL HGy% 1.0 0.89 6.67 1909 1709 A 42 TRP HZ2 A 112 VAL HGx% 1.0 0.89 6.67 1910 1710 A 43 GLU HGx A 54 SER HBy 1.0 0.87 6.51 1911 1710 A 43 GLU HGx A 54 SER HBx 1.0 0.87 6.51 1912 1711 A 43 GLU HGy A 54 SER HBy 1.0 0.82 6.15 1913 1711 A 43 GLU HGy A 54 SER HBx 1.0 0.82 6.15 1914 1712 A 44 MET H A 44 MET HBy 1.0 0.68 5.09 1915 1712 A 44 MET H A 44 MET HBx 1.0 0.68 5.09 1916 1713 A 44 MET H A 54 SER HBy 1.0 1.03 7.73 1917 1713 A 44 MET H A 54 SER HBx 1.0 1.03 7.73 1918 1714 A 44 MET HA A 102 VAL HGy% 1.0 0.92 6.93 1919 1714 A 44 MET HA A 102 VAL HGx% 1.0 0.92 6.93 1920 1715 A 55 TYR H A 44 MET HBy 1.0 0.85 6.36 1921 1715 A 55 TYR H A 44 MET HBx 1.0 0.85 6.36 1922 1716 A 55 TYR HBx A 44 MET HBy 1.0 0.90 6.73 1923 1716 A 55 TYR HBx A 44 MET HBx 1.0 0.90 6.73 1924 1717 A 55 TYR HDy A 44 MET HBy 1.0 0.79 5.91 1925 1717 A 55 TYR HDy A 44 MET HBx 1.0 0.79 5.91 1926 1718 A 57 TYR HEy A 44 MET HBy 1.0 0.66 4.96 1927 1718 A 57 TYR HEy A 44 MET HBx 1.0 0.66 4.96 1928 1719 A 44 MET HBx A 102 VAL HGy% 1.0 0.90 6.78 1929 1719 A 44 MET HBy A 102 VAL HGy% 1.0 0.90 6.78 1930 1719 A 102 VAL HGx% A 44 MET HBy 1.0 0.90 6.78 1931 1719 A 102 VAL HGx% A 44 MET HBx 1.0 0.90 6.78 1932 1720 A 104 LEU HDy% A 44 MET HBy 1.0 0.69 5.16 1933 1720 A 104 LEU HDy% A 44 MET HBx 1.0 0.69 5.16 1934 1721 A 44 MET HGx A 102 VAL HGy% 1.0 0.77 5.74 1935 1721 A 44 MET HGx A 102 VAL HGx% 1.0 0.77 5.74 1936 1722 A 44 MET HGy A 102 VAL HGy% 1.0 0.77 5.76 1937 1722 A 44 MET HGy A 102 VAL HGx% 1.0 0.77 5.76 1938 1723 A 44 MET HE% A 102 VAL HGy% 1.0 0.93 7.01 1939 1723 A 44 MET HE% A 102 VAL HGx% 1.0 0.93 7.01 1940 1724 A 45 ILE H A 102 VAL HGy% 1.0 0.75 5.64 1941 1724 A 45 ILE H A 102 VAL HGx% 1.0 0.75 5.64 1942 1725 A 45 ILE HA A 54 SER HBy 1.0 0.79 5.94 1943 1725 A 45 ILE HA A 54 SER HBx 1.0 0.79 5.94 1944 1726 A 45 ILE HG2% A 47 LYS HGx 1.0 0.75 5.64 1945 1726 A 45 ILE HG2% A 47 LYS HGy 1.0 0.75 5.64 1946 1727 A 45 ILE HG2% A 47 LYS HDy 1.0 0.92 6.93 1947 1727 A 45 ILE HG2% A 47 LYS HDx 1.0 0.92 6.93 1948 1728 A 45 ILE HG2% A 54 SER HBy 1.0 1.03 7.70 1949 1728 A 45 ILE HG2% A 54 SER HBx 1.0 1.03 7.70 1950 1729 A 45 ILE HG1y A 54 SER HBy 1.0 0.91 6.83 1951 1729 A 45 ILE HG1y A 54 SER HBx 1.0 0.91 6.83 1952 1730 A 45 ILE HG1x A 54 SER HBy 1.0 0.89 6.64 1953 1730 A 45 ILE HG1x A 54 SER HBx 1.0 0.89 6.64 1954 1731 A 45 ILE HD1% A 54 SER HBy 1.0 0.90 6.77 1955 1731 A 45 ILE HD1% A 54 SER HBx 1.0 0.90 6.77 1956 1732 A 46 ARG H A 46 ARG HBx 1.0 0.67 5.02 1957 1732 A 46 ARG H A 46 ARG HBy 1.0 0.67 5.02 1958 1733 A 46 ARG H A 46 ARG HGy 1.0 1.06 7.95 1959 1733 A 46 ARG H A 46 ARG HGx 1.0 1.06 7.95 1960 1734 A 46 ARG HA A 47 LYS HGx 1.0 0.91 6.83 1961 1734 A 46 ARG HA A 47 LYS HGy 1.0 0.91 6.83 1962 1735 A 46 ARG HA A 102 VAL HGy% 1.0 0.69 5.21 1963 1735 A 46 ARG HA A 102 VAL HGx% 1.0 0.69 5.21 1964 1736 A 46 ARG HE A 46 ARG HBx 1.0 0.88 6.63 1965 1736 A 46 ARG HE A 46 ARG HBy 1.0 0.88 6.63 1966 1737 A 47 LYS H A 46 ARG HBx 1.0 0.82 6.18 1967 1737 A 47 LYS H A 46 ARG HBy 1.0 0.82 6.18 1968 1738 A 53 VAL HGx% A 46 ARG HBx 1.0 0.70 5.26 1969 1738 A 53 VAL HGx% A 46 ARG HBy 1.0 0.70 5.26 1970 1739 A 88 TRP HZ3 A 46 ARG HBx 1.0 1.00 7.50 1971 1739 A 88 TRP HZ3 A 46 ARG HBy 1.0 1.00 7.50 1972 1740 A 88 TRP HZ2 A 46 ARG HBx 1.0 1.02 7.68 1973 1740 A 88 TRP HZ2 A 46 ARG HBy 1.0 1.02 7.68 1974 1741 A 100 VAL HGy% A 46 ARG HBx 1.0 0.98 7.32 1975 1741 A 100 VAL HGy% A 46 ARG HBy 1.0 0.98 7.32 1976 1742 A 46 ARG HBx A 102 VAL HGy% 1.0 0.81 6.11 1977 1742 A 46 ARG HBy A 102 VAL HGy% 1.0 0.81 6.11 1978 1742 A 102 VAL HGx% A 46 ARG HBx 1.0 0.81 6.11 1979 1742 A 102 VAL HGx% A 46 ARG HBy 1.0 0.81 6.11 1980 1743 A 47 LYS H A 46 ARG HGy 1.0 0.88 6.57 1981 1743 A 47 LYS H A 46 ARG HGx 1.0 0.88 6.57 1982 1744 A 88 TRP HH2 A 46 ARG HGy 1.0 0.84 6.30 1983 1744 A 88 TRP HH2 A 46 ARG HGx 1.0 0.84 6.30 1984 1745 A 100 VAL HGy% A 46 ARG HGy 1.0 0.78 5.82 1985 1745 A 100 VAL HGy% A 46 ARG HGx 1.0 0.78 5.82 1986 1746 A 102 VAL HA A 46 ARG HGy 1.0 0.97 7.26 1987 1746 A 102 VAL HA A 46 ARG HGx 1.0 0.97 7.26 1988 1747 A 47 LYS H A 47 LYS HBy 1.0 0.66 4.98 1989 1747 A 47 LYS H A 47 LYS HBx 1.0 0.66 4.98 1990 1748 A 47 LYS H A 47 LYS HGx 1.0 0.79 5.94 1991 1748 A 47 LYS H A 47 LYS HGy 1.0 0.79 5.94 1992 1749 A 47 LYS H A 101 LYS HBx 1.0 0.90 6.78 1993 1749 A 47 LYS H A 101 LYS HBy 1.0 0.90 6.78 1994 1750 A 47 LYS HA A 47 LYS HGx 1.0 0.73 5.48 1995 1750 A 47 LYS HA A 47 LYS HGy 1.0 0.73 5.48 1996 1751 A 47 LYS HBx A 47 LYS HEx 1.0 0.85 6.39 1997 1751 A 47 LYS HBy A 47 LYS HEx 1.0 0.85 6.39 1998 1751 A 47 LYS HEy A 47 LYS HBy 1.0 0.85 6.39 1999 1751 A 47 LYS HBx A 47 LYS HEy 1.0 0.85 6.39 2000 1752 A 47 LYS HEx A 47 LYS HGx 1.0 0.65 4.89 2001 1752 A 47 LYS HEy A 47 LYS HGx 1.0 0.65 4.89 2002 1752 A 47 LYS HGy A 47 LYS HEx 1.0 0.65 4.89 2003 1752 A 47 LYS HGy A 47 LYS HEy 1.0 0.65 4.89 2004 1753 A 48 ILE H A 47 LYS HGx 1.0 0.97 7.29 2005 1753 A 48 ILE H A 47 LYS HGy 1.0 0.97 7.29 2006 1754 A 52 SER HA A 47 LYS HGx 1.0 0.88 6.58 2007 1754 A 52 SER HA A 47 LYS HGy 1.0 0.88 6.58 2008 1755 A 52 SER HBy A 47 LYS HGx 1.0 0.88 6.60 2009 1755 A 52 SER HBy A 47 LYS HGy 1.0 0.88 6.60 2010 1756 A 52 SER HBx A 47 LYS HGx 1.0 0.97 7.29 2011 1756 A 52 SER HBx A 47 LYS HGy 1.0 0.97 7.29 2012 1757 A 53 VAL H A 47 LYS HGx 1.0 0.97 7.29 2013 1757 A 53 VAL H A 47 LYS HGy 1.0 0.97 7.29 2014 1758 A 48 ILE H A 48 ILE HG1x 1.0 0.90 6.73 2015 1758 A 48 ILE H A 48 ILE HG1y 1.0 0.90 6.73 2016 1759 A 48 ILE HA A 48 ILE HG1x 1.0 0.72 5.37 2017 1759 A 48 ILE HA A 48 ILE HG1y 1.0 0.72 5.37 2018 1760 A 48 ILE HG2% A 48 ILE HG1x 1.0 0.63 4.71 2019 1760 A 48 ILE HG2% A 48 ILE HG1y 1.0 0.63 4.71 2020 1761 A 48 ILE HG2% A 49 GLY HAy 1.0 0.83 6.23 2021 1761 A 48 ILE HG2% A 49 GLY HAx 1.0 0.83 6.23 2022 1762 A 48 ILE HG2% A 94 TRP HBx 1.0 1.20 9.00 2023 1762 A 48 ILE HG2% A 94 TRP HBy 1.0 1.20 9.00 2024 1763 A 49 GLY H A 48 ILE HG1x 1.0 0.91 6.80 2025 1763 A 49 GLY H A 48 ILE HG1y 1.0 0.91 6.80 2026 1764 A 100 VAL HA A 48 ILE HG1x 1.0 0.90 6.75 2027 1764 A 100 VAL HA A 48 ILE HG1y 1.0 0.90 6.75 2028 1765 A 100 VAL HGy% A 48 ILE HG1x 1.0 1.08 8.07 2029 1765 A 100 VAL HGy% A 48 ILE HG1y 1.0 1.08 8.07 2030 1766 A 50 ASP H A 49 GLY HAy 1.0 0.60 4.51 2031 1766 A 50 ASP H A 49 GLY HAx 1.0 0.60 4.51 2032 1767 A 51 THR H A 49 GLY HAy 1.0 0.82 6.14 2033 1767 A 51 THR H A 49 GLY HAx 1.0 0.82 6.14 2034 1768 A 50 ASP H A 50 ASP HBy 1.0 0.64 4.79 2035 1768 A 50 ASP H A 50 ASP HBx 1.0 0.64 4.79 2036 1769 A 51 THR H A 50 ASP HBy 1.0 0.81 6.06 2037 1769 A 51 THR H A 50 ASP HBx 1.0 0.81 6.06 2038 1770 A 53 VAL HA A 54 SER HBy 1.0 0.85 6.40 2039 1770 A 53 VAL HA A 54 SER HBx 1.0 0.85 6.40 2040 1771 A 53 VAL HGx% A 91 GLN HBy 1.0 0.73 5.45 2041 1771 A 53 VAL HGx% A 91 GLN HBx 1.0 0.73 5.45 2042 1772 A 53 VAL HGx% A 91 GLN HE2y 1.0 0.65 4.90 2043 1772 A 53 VAL HGx% A 91 GLN HE2x 1.0 0.65 4.90 2044 1773 A 53 VAL HGy% A 54 SER HBy 1.0 1.17 8.77 2045 1773 A 53 VAL HGy% A 54 SER HBx 1.0 1.17 8.77 2046 1774 A 53 VAL HGy% A 91 GLN HBy 1.0 0.64 4.83 2047 1774 A 53 VAL HGy% A 91 GLN HBx 1.0 0.64 4.83 2048 1775 A 53 VAL HGy% A 91 GLN HGy 1.0 0.88 6.58 2049 1775 A 53 VAL HGy% A 91 GLN HGx 1.0 0.88 6.58 2050 1776 A 54 SER H A 54 SER HBy 1.0 0.62 4.68 2051 1776 A 54 SER H A 54 SER HBx 1.0 0.62 4.68 2052 1777 A 55 TYR H A 54 SER HBy 1.0 0.71 5.34 2053 1777 A 55 TYR H A 54 SER HBx 1.0 0.71 5.34 2054 1778 A 56 LYS H A 56 LYS HGx 1.0 0.86 6.48 2055 1778 A 56 LYS H A 56 LYS HGy 1.0 0.86 6.48 2056 1779 A 56 LYS HA A 56 LYS HDy 1.0 0.93 6.98 2057 1779 A 56 LYS HA A 56 LYS HDx 1.0 0.93 6.98 2058 1780 A 57 TYR H A 56 LYS HBx 1.0 0.82 6.12 2059 1780 A 57 TYR H A 56 LYS HBy 1.0 0.82 6.12 2060 1781 A 57 TYR H A 56 LYS HGx 1.0 0.81 6.09 2061 1781 A 57 TYR H A 56 LYS HGy 1.0 0.81 6.09 2062 1782 A 57 TYR HDx A 69 VAL HGy% 1.0 1.07 8.02 2063 1782 A 57 TYR HDx A 69 VAL HGx% 1.0 1.07 8.02 2064 1783 A 57 TYR HEx A 69 VAL HGy% 1.0 0.75 5.65 2065 1783 A 57 TYR HEx A 69 VAL HGx% 1.0 0.75 5.65 2066 1784 A 58 THR HA A 59 SER HBy 1.0 1.07 7.99 2067 1784 A 58 THR HA A 59 SER HBx 1.0 1.07 7.99 2068 1785 A 58 THR HG2% A 60 ARG HDx 1.0 0.84 6.30 2069 1785 A 58 THR HG2% A 60 ARG HDy 1.0 0.84 6.30 2070 1786 A 59 SER H A 59 SER HBy 1.0 0.59 4.46 2071 1786 A 59 SER H A 59 SER HBx 1.0 0.59 4.46 2072 1787 A 60 ARG H A 60 ARG HBx 1.0 0.66 4.92 2073 1787 A 60 ARG H A 60 ARG HBy 1.0 0.66 4.92 2074 1788 A 60 ARG H A 60 ARG HGy 1.0 0.65 4.89 2075 1788 A 60 ARG H A 60 ARG HGx 1.0 0.65 4.89 2076 1789 A 60 ARG H A 60 ARG HDx 1.0 0.95 7.14 2077 1789 A 60 ARG H A 60 ARG HDy 1.0 0.95 7.14 2078 1790 A 60 ARG H A 61 TYR HBx 1.0 1.08 8.10 2079 1790 A 60 ARG H A 61 TYR HBy 1.0 1.08 8.10 2080 1791 A 60 ARG HA A 60 ARG HGy 1.0 0.69 5.18 2081 1791 A 60 ARG HA A 60 ARG HGx 1.0 0.69 5.18 2082 1792 A 60 ARG HBx A 60 ARG HDx 1.0 0.65 4.89 2083 1792 A 60 ARG HBy A 60 ARG HDx 1.0 0.65 4.89 2084 1792 A 60 ARG HDy A 60 ARG HBx 1.0 0.65 4.89 2085 1792 A 60 ARG HDy A 60 ARG HBy 1.0 0.65 4.89 2086 1793 A 61 TYR H A 60 ARG HBx 1.0 0.77 5.79 2087 1793 A 61 TYR H A 60 ARG HBy 1.0 0.77 5.79 2088 1794 A 61 TYR H A 60 ARG HGy 1.0 0.86 6.48 2089 1794 A 61 TYR H A 60 ARG HGx 1.0 0.86 6.48 2090 1795 A 61 TYR HA A 60 ARG HGy 1.0 1.08 8.13 2091 1795 A 61 TYR HA A 60 ARG HGx 1.0 1.08 8.13 2092 1796 A 61 TYR HDy A 60 ARG HGy 1.0 0.92 6.93 2093 1796 A 61 TYR HDy A 60 ARG HGx 1.0 0.92 6.93 2094 1797 A 61 TYR H A 61 TYR HBx 1.0 0.61 4.59 2095 1797 A 61 TYR H A 61 TYR HBy 1.0 0.61 4.59 2096 1798 A 61 TYR HA A 62 VAL HGy% 1.0 0.89 6.69 2097 1798 A 61 TYR HA A 62 VAL HGx% 1.0 0.89 6.69 2098 1799 A 61 TYR HDx A 61 TYR HBx 1.0 0.65 4.86 2099 1799 A 61 TYR HDx A 61 TYR HBy 1.0 0.65 4.86 2100 1800 A 61 TYR HEy A 61 TYR HBx 1.0 0.92 6.89 2101 1800 A 61 TYR HEy A 61 TYR HBy 1.0 0.92 6.89 2102 1801 A 61 TYR HDy A 61 TYR HBx 1.0 0.64 4.80 2103 1801 A 61 TYR HDy A 61 TYR HBy 1.0 0.64 4.80 2104 1802 A 61 TYR HDx A 62 VAL HGy% 1.0 0.87 6.51 2105 1802 A 61 TYR HDx A 62 VAL HGx% 1.0 0.87 6.51 2106 1803 A 61 TYR HDx A 63 LEU HDx% 1.0 1.04 7.80 2107 1803 A 61 TYR HDx A 63 LEU HDy% 1.0 1.04 7.80 2108 1804 A 61 TYR HEx A 63 LEU HBx 1.0 0.75 5.63 2109 1804 A 61 TYR HEx A 63 LEU HBy 1.0 0.75 5.63 2110 1805 A 61 TYR HEx A 63 LEU HDx% 1.0 0.73 5.45 2111 1805 A 61 TYR HEx A 63 LEU HDy% 1.0 0.73 5.45 2112 1806 A 62 VAL H A 62 VAL HGy% 1.0 0.64 4.79 2113 1806 A 62 VAL H A 62 VAL HGx% 1.0 0.64 4.79 2114 1807 A 62 VAL HA A 62 VAL HGy% 1.0 0.61 4.57 2115 1807 A 62 VAL HA A 62 VAL HGx% 1.0 0.61 4.57 2116 1808 A 63 LEU H A 62 VAL HGy% 1.0 0.71 5.34 2117 1808 A 63 LEU H A 62 VAL HGx% 1.0 0.71 5.34 2118 1809 A 62 VAL HGy% A 63 LEU HBx 1.0 1.03 7.70 2119 1809 A 62 VAL HGx% A 63 LEU HBx 1.0 1.03 7.70 2120 1809 A 63 LEU HBy A 62 VAL HGy% 1.0 1.03 7.70 2121 1809 A 63 LEU HBy A 62 VAL HGx% 1.0 1.03 7.70 2122 1810 A 64 LYS H A 62 VAL HGy% 1.0 0.88 6.57 2123 1810 A 64 LYS H A 62 VAL HGx% 1.0 0.88 6.57 2124 1811 A 64 LYS HA A 62 VAL HGy% 1.0 0.79 5.96 2125 1811 A 64 LYS HA A 62 VAL HGx% 1.0 0.79 5.96 2126 1812 A 62 VAL HGx% A 64 LYS HBy 1.0 1.13 8.51 2127 1812 A 64 LYS HBx A 62 VAL HGy% 1.0 1.13 8.51 2128 1812 A 62 VAL HGx% A 64 LYS HBx 1.0 1.13 8.51 2129 1812 A 62 VAL HGy% A 64 LYS HBy 1.0 1.13 8.51 2130 1813 A 62 VAL HGy% A 64 LYS HGy 1.0 0.80 5.97 2131 1813 A 62 VAL HGx% A 64 LYS HGy 1.0 0.80 5.97 2132 1813 A 64 LYS HGx A 62 VAL HGy% 1.0 0.80 5.97 2133 1813 A 62 VAL HGx% A 64 LYS HGx 1.0 0.80 5.97 2134 1814 A 65 ALA H A 62 VAL HGy% 1.0 1.15 8.64 2135 1814 A 65 ALA H A 62 VAL HGx% 1.0 1.15 8.64 2136 1815 A 63 LEU H A 63 LEU HBx 1.0 0.64 4.79 2137 1815 A 63 LEU H A 63 LEU HBy 1.0 0.64 4.79 2138 1816 A 63 LEU H A 63 LEU HDx% 1.0 0.80 5.99 2139 1816 A 63 LEU H A 63 LEU HDy% 1.0 0.80 5.99 2140 1817 A 63 LEU HA A 63 LEU HDx% 1.0 0.66 4.98 2141 1817 A 63 LEU HA A 63 LEU HDy% 1.0 0.66 4.98 2142 1818 A 64 LYS H A 63 LEU HDx% 1.0 0.77 5.80 2143 1818 A 64 LYS H A 63 LEU HDy% 1.0 0.77 5.80 2144 1819 A 67 GLN H A 63 LEU HDx% 1.0 0.84 6.27 2145 1819 A 67 GLN H A 63 LEU HDy% 1.0 0.84 6.27 2146 1820 A 67 GLN HBx A 63 LEU HDx% 1.0 0.78 5.84 2147 1820 A 67 GLN HBx A 63 LEU HDy% 1.0 0.78 5.84 2148 1821 A 67 GLN HBy A 63 LEU HDx% 1.0 0.82 6.18 2149 1821 A 67 GLN HBy A 63 LEU HDy% 1.0 0.82 6.18 2150 1822 A 68 THR H A 63 LEU HDx% 1.0 0.84 6.33 2151 1822 A 68 THR H A 63 LEU HDy% 1.0 0.84 6.33 2152 1823 A 68 THR HA A 63 LEU HDx% 1.0 0.72 5.38 2153 1823 A 68 THR HA A 63 LEU HDy% 1.0 0.72 5.38 2154 1824 A 69 VAL H A 63 LEU HDx% 1.0 0.89 6.64 2155 1824 A 69 VAL H A 63 LEU HDy% 1.0 0.89 6.64 2156 1825 A 64 LYS H A 64 LYS HBy 1.0 0.58 4.37 2157 1825 A 64 LYS H A 64 LYS HBx 1.0 0.58 4.37 2158 1826 A 64 LYS H A 64 LYS HGy 1.0 0.76 5.67 2159 1826 A 64 LYS H A 64 LYS HGx 1.0 0.76 5.67 2160 1827 A 64 LYS HA A 64 LYS HGy 1.0 0.71 5.35 2161 1827 A 64 LYS HA A 64 LYS HGx 1.0 0.71 5.35 2162 1828 A 64 LYS HA A 64 LYS HDy 1.0 0.89 6.70 2163 1828 A 64 LYS HA A 64 LYS HDx 1.0 0.89 6.70 2164 1829 A 64 LYS HBx A 64 LYS HDy 1.0 0.65 4.87 2165 1829 A 64 LYS HBy A 64 LYS HDy 1.0 0.65 4.87 2166 1829 A 64 LYS HDx A 64 LYS HBy 1.0 0.65 4.87 2167 1829 A 64 LYS HDx A 64 LYS HBx 1.0 0.65 4.87 2168 1830 A 64 LYS HBx A 64 LYS HEx 1.0 0.85 6.35 2169 1830 A 64 LYS HBy A 64 LYS HEx 1.0 0.85 6.35 2170 1830 A 64 LYS HEy A 64 LYS HBy 1.0 0.85 6.35 2171 1830 A 64 LYS HBx A 64 LYS HEy 1.0 0.85 6.35 2172 1831 A 65 ALA H A 64 LYS HBy 1.0 0.67 5.01 2173 1831 A 65 ALA H A 64 LYS HBx 1.0 0.67 5.01 2174 1832 A 67 GLN HBy A 64 LYS HBy 1.0 0.77 5.80 2175 1832 A 67 GLN HBy A 64 LYS HBx 1.0 0.77 5.80 2176 1833 A 64 LYS HBx A 67 GLN HGx 1.0 0.98 7.32 2177 1833 A 64 LYS HBy A 67 GLN HGx 1.0 0.98 7.32 2178 1833 A 67 GLN HGy A 64 LYS HBy 1.0 0.98 7.32 2179 1833 A 64 LYS HBx A 67 GLN HGy 1.0 0.98 7.32 2180 1834 A 65 ALA H A 64 LYS HDy 1.0 0.90 6.75 2181 1834 A 65 ALA H A 64 LYS HDx 1.0 0.90 6.75 2182 1835 A 67 GLN HA A 67 GLN HGx 1.0 0.75 5.61 2183 1835 A 67 GLN HA A 67 GLN HGy 1.0 0.75 5.61 2184 1836 A 68 THR H A 67 GLN HGx 1.0 0.78 5.88 2185 1836 A 68 THR H A 67 GLN HGy 1.0 0.78 5.88 2186 1837 A 68 THR HB A 69 VAL HGy% 1.0 0.96 7.18 2187 1837 A 68 THR HB A 69 VAL HGx% 1.0 0.96 7.18 2188 1838 A 69 VAL H A 69 VAL HGy% 1.0 0.62 4.66 2189 1838 A 69 VAL H A 69 VAL HGx% 1.0 0.62 4.66 2190 1839 A 70 THR H A 69 VAL HGy% 1.0 0.63 4.70 2191 1839 A 70 THR H A 69 VAL HGx% 1.0 0.63 4.70 2192 1840 A 70 THR HA A 69 VAL HGy% 1.0 0.86 6.42 2193 1840 A 70 THR HA A 69 VAL HGx% 1.0 0.86 6.42 2194 1841 A 70 THR HB A 69 VAL HGy% 1.0 1.04 7.80 2195 1841 A 70 THR HB A 69 VAL HGx% 1.0 1.04 7.80 2196 1842 A 71 ILE HG1x A 69 VAL HGy% 1.0 0.94 7.07 2197 1842 A 71 ILE HG1x A 69 VAL HGx% 1.0 0.94 7.07 2198 1843 A 71 ILE HD1% A 69 VAL HGy% 1.0 0.63 4.70 2199 1843 A 71 ILE HD1% A 69 VAL HGx% 1.0 0.63 4.70 2200 1844 A 85 ASP HA A 69 VAL HGy% 1.0 0.86 6.46 2201 1844 A 85 ASP HA A 69 VAL HGx% 1.0 0.86 6.46 2202 1845 A 86 LEU H A 69 VAL HGy% 1.0 0.93 6.99 2203 1845 A 86 LEU H A 69 VAL HGx% 1.0 0.93 6.99 2204 1846 A 86 LEU HG A 69 VAL HGy% 1.0 0.88 6.60 2205 1846 A 86 LEU HG A 69 VAL HGx% 1.0 0.88 6.60 2206 1847 A 72 TRP H A 72 TRP HBx 1.0 0.67 5.04 2207 1847 A 72 TRP H A 72 TRP HBy 1.0 0.67 5.04 2208 1848 A 73 ALA H A 72 TRP HBx 1.0 0.74 5.52 2209 1848 A 73 ALA H A 72 TRP HBy 1.0 0.74 5.52 2210 1849 A 87 ILE HA A 72 TRP HBx 1.0 0.85 6.37 2211 1849 A 87 ILE HA A 72 TRP HBy 1.0 0.85 6.37 2212 1850 A 87 ILE HD1% A 72 TRP HBx 1.0 0.66 4.95 2213 1850 A 87 ILE HD1% A 72 TRP HBy 1.0 0.66 4.95 2214 1851 A 88 TRP H A 72 TRP HBx 1.0 0.95 7.10 2215 1851 A 88 TRP H A 72 TRP HBy 1.0 0.95 7.10 2216 1852 A 72 TRP HD1 A 78 VAL HGy% 1.0 0.92 6.89 2217 1852 A 72 TRP HD1 A 78 VAL HGx% 1.0 0.92 6.89 2218 1853 A 72 TRP HE3 A 78 VAL HGy% 1.0 0.85 6.37 2219 1853 A 72 TRP HE3 A 78 VAL HGx% 1.0 0.85 6.37 2220 1854 A 72 TRP HE1 A 78 VAL HGy% 1.0 1.00 7.53 2221 1854 A 72 TRP HE1 A 78 VAL HGx% 1.0 1.00 7.53 2222 1855 A 72 TRP HZ3 A 78 VAL HGy% 1.0 0.87 6.51 2223 1855 A 72 TRP HZ3 A 78 VAL HGx% 1.0 0.87 6.51 2224 1856 A 72 TRP HZ2 A 78 VAL HGy% 1.0 0.86 6.48 2225 1856 A 72 TRP HZ2 A 78 VAL HGx% 1.0 0.86 6.48 2226 1857 A 72 TRP HH2 A 78 VAL HGy% 1.0 0.86 6.48 2227 1857 A 78 VAL HGx% A 72 TRP HH2 1.0 0.86 6.48 2228 1858 A 73 ALA HB% A 93 SER HBy 1.0 0.73 5.51 2229 1858 A 73 ALA HB% A 93 SER HBx 1.0 0.73 5.51 2230 1859 A 75 ASN HA A 75 ASN HD2x 1.0 0.93 6.99 2231 1859 A 75 ASN HA A 75 ASN HD2y 1.0 0.93 6.99 2232 1860 A 75 ASN HBy A 75 ASN HD2x 1.0 0.71 5.29 2233 1860 A 75 ASN HBy A 75 ASN HD2y 1.0 0.71 5.29 2234 1861 A 75 ASN HD2x A 92 ASN HBx 1.0 0.77 5.77 2235 1861 A 75 ASN HD2x A 92 ASN HBy 1.0 0.77 5.77 2236 1861 A 75 ASN HD2y A 92 ASN HBx 1.0 0.77 5.77 2237 1861 A 75 ASN HD2y A 92 ASN HBy 1.0 0.77 5.77 2238 1862 A 76 ALA H A 77 GLY HAy 1.0 0.96 7.21 2239 1862 A 76 ALA H A 77 GLY HAx 1.0 0.96 7.21 2240 1863 A 76 ALA HB% A 77 GLY HAy 1.0 0.88 6.60 2241 1863 A 76 ALA HB% A 77 GLY HAx 1.0 0.88 6.60 2242 1864 A 76 ALA HB% A 78 VAL HGy% 1.0 0.72 5.43 2243 1864 A 76 ALA HB% A 78 VAL HGx% 1.0 0.72 5.43 2244 1865 A 77 GLY H A 78 VAL HGy% 1.0 0.93 6.99 2245 1865 A 77 GLY H A 78 VAL HGx% 1.0 0.93 6.99 2246 1866 A 78 VAL HA A 77 GLY HAy 1.0 0.88 6.63 2247 1866 A 78 VAL HA A 77 GLY HAx 1.0 0.88 6.63 2248 1867 A 78 VAL H A 78 VAL HGy% 1.0 0.61 4.56 2249 1867 A 78 VAL H A 78 VAL HGx% 1.0 0.61 4.56 2250 1868 A 79 THR H A 78 VAL HGy% 1.0 0.60 4.51 2251 1868 A 79 THR H A 78 VAL HGx% 1.0 0.60 4.51 2252 1869 A 87 ILE HD1% A 78 VAL HGy% 1.0 0.79 5.91 2253 1869 A 87 ILE HD1% A 78 VAL HGx% 1.0 0.79 5.91 2254 1870 A 81 SER HA A 82 PRO HGy 1.0 0.87 6.51 2255 1870 A 81 SER HA A 82 PRO HGx 1.0 0.87 6.51 2256 1871 A 81 SER HA A 82 PRO HDx 1.0 0.58 4.38 2257 1871 A 81 SER HA A 82 PRO HDy 1.0 0.58 4.38 2258 1872 A 83 PRO HDx A 82 PRO HBx 1.0 0.81 6.05 2259 1872 A 83 PRO HDx A 82 PRO HBy 1.0 0.81 6.05 2260 1873 A 84 THR H A 82 PRO HBx 1.0 0.77 5.76 2261 1873 A 84 THR H A 82 PRO HBy 1.0 0.77 5.76 2262 1874 A 87 ILE HD1% A 82 PRO HGy 1.0 0.77 5.77 2263 1874 A 87 ILE HD1% A 82 PRO HGx 1.0 0.77 5.77 2264 1875 A 84 THR H A 83 PRO HGx 1.0 0.77 5.74 2265 1875 A 84 THR H A 83 PRO HGy 1.0 0.77 5.74 2266 1876 A 87 ILE HG2% A 89 LYS HGx 1.0 0.67 5.04 2267 1876 A 87 ILE HG2% A 89 LYS HGy 1.0 0.67 5.04 2268 1877 A 88 TRP HD1 A 90 ASN HBx 1.0 1.00 7.48 2269 1877 A 88 TRP HD1 A 90 ASN HBy 1.0 1.00 7.48 2270 1878 A 88 TRP HE1 A 90 ASN HBx 1.0 1.00 7.52 2271 1878 A 88 TRP HE1 A 90 ASN HBy 1.0 1.00 7.52 2272 1879 A 88 TRP HE1 A 91 GLN HBy 1.0 0.93 6.95 2273 1879 A 88 TRP HE1 A 91 GLN HBx 1.0 0.93 6.95 2274 1880 A 89 LYS H A 89 LYS HBx 1.0 0.58 4.38 2275 1880 A 89 LYS H A 89 LYS HBy 1.0 0.58 4.38 2276 1881 A 89 LYS H A 89 LYS HGx 1.0 0.67 5.01 2277 1881 A 89 LYS H A 89 LYS HGy 1.0 0.67 5.01 2278 1882 A 89 LYS HA A 89 LYS HGx 1.0 0.73 5.51 2279 1882 A 89 LYS HA A 89 LYS HGy 1.0 0.73 5.51 2280 1883 A 89 LYS HBx A 89 LYS HEx 1.0 0.85 6.37 2281 1883 A 89 LYS HBy A 89 LYS HEx 1.0 0.85 6.37 2282 1883 A 89 LYS HEy A 89 LYS HBx 1.0 0.85 6.37 2283 1883 A 89 LYS HBy A 89 LYS HEy 1.0 0.85 6.37 2284 1884 A 90 ASN H A 89 LYS HBx 1.0 0.77 5.76 2285 1884 A 90 ASN H A 89 LYS HBy 1.0 0.77 5.76 2286 1885 A 89 LYS HEx A 89 LYS HGx 1.0 0.66 4.95 2287 1885 A 89 LYS HEy A 89 LYS HGx 1.0 0.66 4.95 2288 1885 A 89 LYS HGy A 89 LYS HEx 1.0 0.66 4.95 2289 1885 A 89 LYS HGy A 89 LYS HEy 1.0 0.66 4.95 2290 1886 A 90 ASN H A 90 ASN HBx 1.0 0.70 5.26 2291 1886 A 90 ASN H A 90 ASN HBy 1.0 0.70 5.26 2292 1887 A 90 ASN H A 91 GLN HBy 1.0 1.11 8.33 2293 1887 A 90 ASN H A 91 GLN HBx 1.0 1.11 8.33 2294 1888 A 90 ASN HA A 90 ASN HD2y 1.0 0.89 6.69 2295 1888 A 90 ASN HA A 90 ASN HD2x 1.0 0.89 6.69 2296 1889 A 90 ASN HBx A 90 ASN HD2y 1.0 0.59 4.46 2297 1889 A 90 ASN HBy A 90 ASN HD2y 1.0 0.59 4.46 2298 1889 A 90 ASN HD2x A 90 ASN HBx 1.0 0.59 4.46 2299 1889 A 90 ASN HBy A 90 ASN HD2x 1.0 0.59 4.46 2300 1890 A 91 GLN H A 90 ASN HBx 1.0 0.84 6.29 2301 1890 A 91 GLN H A 90 ASN HBy 1.0 0.84 6.29 2302 1891 A 91 GLN H A 91 GLN HBy 1.0 0.65 4.86 2303 1891 A 91 GLN H A 91 GLN HBx 1.0 0.65 4.86 2304 1892 A 91 GLN H A 91 GLN HGy 1.0 1.07 8.01 2305 1892 A 91 GLN H A 91 GLN HGx 1.0 1.07 8.01 2306 1893 A 91 GLN HA A 91 GLN HE2x 1.0 1.05 7.89 2307 1893 A 91 GLN HE2y A 91 GLN HA 1.0 1.05 7.89 2308 1894 A 91 GLN HE2y A 91 GLN HBy 1.0 0.79 5.91 2309 1894 A 91 GLN HE2x A 91 GLN HBy 1.0 0.79 5.91 2310 1894 A 91 GLN HE2x A 91 GLN HBx 1.0 0.79 5.91 2311 1894 A 91 GLN HE2y A 91 GLN HBx 1.0 0.79 5.91 2312 1895 A 92 ASN H A 91 GLN HGy 1.0 0.72 5.37 2313 1895 A 92 ASN H A 91 GLN HGx 1.0 0.72 5.37 2314 1896 A 92 ASN H A 91 GLN HE2x 1.0 1.02 7.65 2315 1896 A 92 ASN H A 91 GLN HE2y 1.0 1.02 7.65 2316 1897 A 92 ASN H A 92 ASN HBy 1.0 0.63 4.70 2317 1897 A 92 ASN H A 92 ASN HBx 1.0 0.63 4.70 2318 1898 A 92 ASN H A 92 ASN HD2y 1.0 0.78 5.82 2319 1898 A 92 ASN H A 92 ASN HD2x 1.0 0.78 5.82 2320 1899 A 92 ASN HD2x A 92 ASN HBy 1.0 0.62 4.68 2321 1899 A 92 ASN HD2y A 92 ASN HBx 1.0 0.62 4.68 2322 1899 A 92 ASN HD2y A 92 ASN HBy 1.0 0.62 4.68 2323 1899 A 92 ASN HD2x A 92 ASN HBx 1.0 0.62 4.68 2324 1900 A 93 SER H A 92 ASN HBy 1.0 0.71 5.29 2325 1900 A 93 SER H A 92 ASN HBx 1.0 0.71 5.29 2326 1901 A 93 SER H A 93 SER HBy 1.0 0.70 5.26 2327 1901 A 93 SER H A 93 SER HBx 1.0 0.70 5.26 2328 1902 A 94 TRP H A 93 SER HBy 1.0 0.69 5.21 2329 1902 A 94 TRP H A 93 SER HBx 1.0 0.69 5.21 2330 1903 A 94 TRP H A 94 TRP HBx 1.0 0.71 5.29 2331 1903 A 94 TRP H A 94 TRP HBy 1.0 0.71 5.29 2332 1904 A 95 GLY H A 94 TRP HBx 1.0 0.68 5.07 2333 1904 A 95 GLY H A 94 TRP HBy 1.0 0.68 5.07 2334 1905 A 94 TRP HBx A 95 GLY HAx 1.0 0.90 6.73 2335 1905 A 94 TRP HBy A 95 GLY HAx 1.0 0.90 6.73 2336 1905 A 95 GLY HAy A 94 TRP HBx 1.0 0.90 6.73 2337 1905 A 94 TRP HBy A 95 GLY HAy 1.0 0.90 6.73 2338 1906 A 96 THR H A 95 GLY HAx 1.0 0.58 4.34 2339 1906 A 96 THR H A 95 GLY HAy 1.0 0.58 4.34 2340 1907 A 97 GLY H A 98 GLU HGy 1.0 1.00 7.48 2341 1907 A 97 GLY H A 98 GLU HGx 1.0 1.00 7.48 2342 1908 A 98 GLU H A 98 GLU HGy 1.0 0.66 4.93 2343 1908 A 98 GLU H A 98 GLU HGx 1.0 0.66 4.93 2344 1909 A 98 GLU HA A 98 GLU HGy 1.0 0.66 4.98 2345 1909 A 98 GLU HA A 98 GLU HGx 1.0 0.66 4.98 2346 1910 A 99 ASP H A 99 ASP HBy 1.0 0.63 4.74 2347 1910 A 99 ASP H A 99 ASP HBx 1.0 0.63 4.74 2348 1911 A 100 VAL H A 99 ASP HBy 1.0 0.75 5.63 2349 1911 A 100 VAL H A 99 ASP HBx 1.0 0.75 5.63 2350 1912 A 101 LYS H A 101 LYS HBx 1.0 0.68 5.10 2351 1912 A 101 LYS H A 101 LYS HBy 1.0 0.68 5.10 2352 1913 A 101 LYS HA A 101 LYS HDx 1.0 0.88 6.61 2353 1913 A 101 LYS HA A 101 LYS HDy 1.0 0.88 6.61 2354 1914 A 101 LYS HA A 102 VAL HGy% 1.0 0.90 6.72 2355 1914 A 101 LYS HA A 102 VAL HGx% 1.0 0.90 6.72 2356 1915 A 101 LYS HBy A 101 LYS HDx 1.0 0.60 4.53 2357 1915 A 101 LYS HBx A 101 LYS HDx 1.0 0.60 4.53 2358 1915 A 101 LYS HDy A 101 LYS HBx 1.0 0.60 4.53 2359 1915 A 101 LYS HBy A 101 LYS HDy 1.0 0.60 4.53 2360 1916 A 101 LYS HBx A 101 LYS HEx 1.0 0.87 6.49 2361 1916 A 101 LYS HBy A 101 LYS HEx 1.0 0.87 6.49 2362 1916 A 101 LYS HEy A 101 LYS HBx 1.0 0.87 6.49 2363 1916 A 101 LYS HBy A 101 LYS HEy 1.0 0.87 6.49 2364 1917 A 102 VAL H A 101 LYS HBx 1.0 0.83 6.26 2365 1917 A 102 VAL H A 101 LYS HBy 1.0 0.83 6.26 2366 1918 A 103 ILE HD1% A 101 LYS HDx 1.0 0.68 5.12 2367 1918 A 103 ILE HD1% A 101 LYS HDy 1.0 0.68 5.12 2368 1919 A 116 SER HBx A 101 LYS HDx 1.0 0.88 6.60 2369 1919 A 116 SER HBx A 101 LYS HDy 1.0 0.88 6.60 2370 1920 A 116 SER HBy A 101 LYS HDx 1.0 0.86 6.46 2371 1920 A 116 SER HBy A 101 LYS HDy 1.0 0.86 6.46 2372 1921 A 102 VAL H A 102 VAL HGy% 1.0 0.67 4.99 2373 1921 A 102 VAL H A 102 VAL HGx% 1.0 0.67 4.99 2374 1922 A 103 ILE H A 102 VAL HGy% 1.0 0.61 4.57 2375 1922 A 103 ILE H A 102 VAL HGx% 1.0 0.61 4.57 2376 1923 A 114 GLN H A 102 VAL HGy% 1.0 1.22 9.17 2377 1923 A 114 GLN H A 102 VAL HGx% 1.0 1.22 9.17 2378 1924 A 114 GLN HA A 102 VAL HGy% 1.0 0.90 6.78 2379 1924 A 114 GLN HA A 102 VAL HGx% 1.0 0.90 6.78 2380 1925 A 115 ARG H A 102 VAL HGy% 1.0 0.94 7.02 2381 1925 A 115 ARG H A 102 VAL HGx% 1.0 0.94 7.02 2382 1926 A 116 SER HA A 102 VAL HGy% 1.0 0.85 6.35 2383 1926 A 116 SER HA A 102 VAL HGx% 1.0 0.85 6.35 2384 1927 A 116 SER HBy A 102 VAL HGy% 1.0 1.07 8.05 2385 1927 A 116 SER HBy A 102 VAL HGx% 1.0 1.07 8.05 2386 1928 A 103 ILE HA A 114 GLN HBy 1.0 0.78 5.85 2387 1928 A 103 ILE HA A 114 GLN HBx 1.0 0.78 5.85 2388 1929 A 103 ILE HG2% A 105 LYS HEx 1.0 0.78 5.84 2389 1929 A 103 ILE HG2% A 105 LYS HEy 1.0 0.78 5.84 2390 1930 A 103 ILE HG2% A 111 GLU HBx 1.0 0.94 7.02 2391 1930 A 103 ILE HG2% A 111 GLU HBy 1.0 0.94 7.02 2392 1931 A 103 ILE HG2% A 114 GLN HBy 1.0 0.77 5.80 2393 1931 A 103 ILE HG2% A 114 GLN HBx 1.0 0.77 5.80 2394 1932 A 103 ILE HG2% A 114 GLN HE2x 1.0 0.90 6.77 2395 1932 A 103 ILE HG2% A 114 GLN HE2y 1.0 0.90 6.77 2396 1933 A 103 ILE HD1% A 114 GLN HBy 1.0 0.86 6.45 2397 1933 A 103 ILE HD1% A 114 GLN HBx 1.0 0.86 6.45 2398 1934 A 103 ILE HD1% A 114 GLN HE2x 1.0 0.84 6.27 2399 1934 A 103 ILE HD1% A 114 GLN HE2y 1.0 0.84 6.27 2400 1935 A 104 LEU H A 114 GLN HBy 1.0 0.89 6.66 2401 1935 A 104 LEU H A 114 GLN HBx 1.0 0.89 6.66 2402 1936 A 104 LEU HBy A 112 VAL HGy% 1.0 0.65 4.85 2403 1936 A 104 LEU HBy A 112 VAL HGx% 1.0 0.65 4.85 2404 1937 A 104 LEU HBx A 112 VAL HGy% 1.0 0.78 5.82 2405 1937 A 104 LEU HBx A 112 VAL HGx% 1.0 0.78 5.82 2406 1938 A 105 LYS H A 105 LYS HDx 1.0 0.89 6.64 2407 1938 A 105 LYS H A 105 LYS HDy 1.0 0.89 6.64 2408 1939 A 105 LYS HA A 111 GLU HBx 1.0 1.17 8.74 2409 1939 A 105 LYS HA A 111 GLU HBy 1.0 1.17 8.74 2410 1940 A 105 LYS HA A 111 GLU HGy 1.0 1.14 8.54 2411 1940 A 105 LYS HA A 111 GLU HGx 1.0 1.14 8.54 2412 1941 A 105 LYS HA A 112 VAL HGy% 1.0 0.77 5.80 2413 1941 A 105 LYS HA A 112 VAL HGx% 1.0 0.77 5.80 2414 1942 A 105 LYS HBy A 105 LYS HDx 1.0 0.70 5.26 2415 1942 A 105 LYS HBy A 105 LYS HDy 1.0 0.70 5.26 2416 1943 A 105 LYS HBx A 109 GLY HAx 1.0 0.81 6.05 2417 1943 A 105 LYS HBx A 109 GLY HAy 1.0 0.81 6.05 2418 1944 A 105 LYS HGy A 111 GLU HBx 1.0 0.97 7.27 2419 1944 A 105 LYS HGy A 111 GLU HBy 1.0 0.97 7.27 2420 1945 A 106 ASN HD2y A 106 ASN H 1.0 0.84 6.30 2421 1945 A 106 ASN HD2x A 106 ASN H 1.0 0.84 6.30 2422 1946 A 106 ASN H A 112 VAL HGy% 1.0 0.69 5.19 2423 1946 A 106 ASN H A 112 VAL HGx% 1.0 0.69 5.19 2424 1947 A 106 ASN HA A 112 VAL HGy% 1.0 0.77 5.79 2425 1947 A 106 ASN HA A 112 VAL HGx% 1.0 0.77 5.79 2426 1948 A 106 ASN HBx A 112 VAL HGy% 1.0 1.04 7.80 2427 1948 A 106 ASN HBx A 112 VAL HGx% 1.0 1.04 7.80 2428 1949 A 107 SER H A 107 SER HBx 1.0 0.72 5.43 2429 1949 A 107 SER H A 107 SER HBy 1.0 0.72 5.43 2430 1950 A 107 SER H A 108 GLN HGy 1.0 0.93 6.99 2431 1950 A 107 SER H A 108 GLN HGx 1.0 0.93 6.99 2432 1951 A 108 GLN H A 107 SER HBx 1.0 0.79 5.94 2433 1951 A 108 GLN H A 107 SER HBy 1.0 0.79 5.94 2434 1952 A 108 GLN H A 108 GLN HGy 1.0 0.63 4.74 2435 1952 A 108 GLN H A 108 GLN HGx 1.0 0.63 4.74 2436 1953 A 108 GLN H A 109 GLY HAx 1.0 0.95 7.10 2437 1953 A 108 GLN H A 109 GLY HAy 1.0 0.95 7.10 2438 1954 A 108 GLN HA A 108 GLN HGy 1.0 0.66 4.98 2439 1954 A 108 GLN HA A 108 GLN HGx 1.0 0.66 4.98 2440 1955 A 110 GLU HA A 111 GLU HBx 1.0 0.92 6.89 2441 1955 A 110 GLU HA A 111 GLU HBy 1.0 0.92 6.89 2442 1956 A 111 GLU H A 111 GLU HBx 1.0 0.55 4.13 2443 1956 A 111 GLU H A 111 GLU HBy 1.0 0.55 4.13 2444 1957 A 111 GLU HA A 111 GLU HGy 1.0 0.71 5.32 2445 1957 A 111 GLU HA A 111 GLU HGx 1.0 0.71 5.32 2446 1958 A 111 GLU HA A 112 VAL HGy% 1.0 0.78 5.88 2447 1958 A 111 GLU HA A 112 VAL HGx% 1.0 0.78 5.88 2448 1959 A 112 VAL H A 111 GLU HGy 1.0 0.81 6.08 2449 1959 A 112 VAL H A 111 GLU HGx 1.0 0.81 6.08 2450 1960 A 112 VAL H A 112 VAL HGy% 1.0 0.62 4.63 2451 1960 A 112 VAL H A 112 VAL HGx% 1.0 0.62 4.63 2452 1961 A 112 VAL HA A 112 VAL HGy% 1.0 0.58 4.35 2453 1961 A 112 VAL HA A 112 VAL HGx% 1.0 0.58 4.35 2454 1962 A 113 ALA H A 112 VAL HGy% 1.0 0.66 4.96 2455 1962 A 113 ALA H A 112 VAL HGx% 1.0 0.66 4.96 2456 1963 A 114 GLN H A 114 GLN HBy 1.0 0.73 5.45 2457 1963 A 114 GLN H A 114 GLN HBx 1.0 0.73 5.45 2458 1964 A 114 GLN HBx A 114 GLN HE2x 1.0 0.80 5.99 2459 1964 A 114 GLN HBy A 114 GLN HE2x 1.0 0.80 5.99 2460 1964 A 114 GLN HE2y A 114 GLN HBy 1.0 0.80 5.99 2461 1964 A 114 GLN HBx A 114 GLN HE2y 1.0 0.80 5.99 2462 1965 A 114 GLN HGy A 114 GLN HE2x 1.0 0.71 5.34 2463 1965 A 114 GLN HGy A 114 GLN HE2y 1.0 0.71 5.34 2464 1966 A 114 GLN HGx A 114 GLN HE2x 1.0 0.71 5.29 2465 1966 A 114 GLN HGx A 114 GLN HE2y 1.0 0.71 5.29 2466 1967 A 115 ARG H A 115 ARG HBy 1.0 0.71 5.29 2467 1967 A 115 ARG H A 115 ARG HBx 1.0 0.71 5.29 2468 1968 A 115 ARG HA A 115 ARG HGx 1.0 0.68 5.10 2469 1968 A 115 ARG HA A 115 ARG HGy 1.0 0.68 5.10 2470 1969 A 115 ARG HBy A 115 ARG HDx 1.0 0.63 4.73 2471 1969 A 115 ARG HBx A 115 ARG HDx 1.0 0.63 4.73 2472 1969 A 115 ARG HDy A 115 ARG HBy 1.0 0.63 4.73 2473 1969 A 115 ARG HBx A 115 ARG HDy 1.0 0.63 4.73 2474 1970 A 116 SER H A 115 ARG HDx 1.0 1.13 8.49 2475 1970 A 116 SER H A 115 ARG HDy 1.0 1.13 8.49 2476 1971 A 118 VAL H A 118 VAL HGy% 1.0 0.70 5.28 2477 1971 A 118 VAL H A 118 VAL HGx% 1.0 0.70 5.28 2478 1972 A 118 VAL HA A 118 VAL HGy% 1.0 0.59 4.41 2479 1972 A 118 VAL HA A 118 VAL HGx% 1.0 0.59 4.41 2480 1973 A 118 VAL HA A 119 PHE HBx 1.0 0.99 7.39 2481 1973 A 118 VAL HA A 119 PHE HBy 1.0 0.99 7.39 2482 1974 A 119 PHE H A 118 VAL HGy% 1.0 0.76 5.73 2483 1974 A 119 PHE H A 118 VAL HGx% 1.0 0.76 5.73 2484 1975 A 119 PHE H A 119 PHE HBx 1.0 0.64 4.82 2485 1975 A 119 PHE H A 119 PHE HBy 1.0 0.64 4.82 2486 1976 A 120 LYS H A 119 PHE HBx 1.0 0.81 6.06 2487 1976 A 120 LYS H A 119 PHE HBy 1.0 0.81 6.06 2488 1977 A 120 LYS H A 120 LYS HBx 1.0 0.61 4.56 2489 1977 A 120 LYS H A 120 LYS HBy 1.0 0.61 4.56 2490 1978 A 120 LYS H A 120 LYS HGx 1.0 0.94 7.07 2491 1978 A 120 LYS H A 120 LYS HGy 1.0 0.94 7.07 2492 1979 A 120 LYS HA A 120 LYS HDy 1.0 0.93 6.95 2493 1979 A 120 LYS HA A 120 LYS HDx 1.0 0.93 6.95 2494 1980 A 120 LYS HBy A 120 LYS HEx 1.0 0.98 7.32 2495 1980 A 120 LYS HBx A 120 LYS HEx 1.0 0.98 7.32 2496 1980 A 120 LYS HEy A 120 LYS HBx 1.0 0.98 7.32 2497 1980 A 120 LYS HBy A 120 LYS HEy 1.0 0.98 7.32 2498 1981 A 121 THR H A 120 LYS HBx 1.0 0.72 5.37 2499 1981 A 121 THR H A 120 LYS HBy 1.0 0.72 5.37 2500 1982 A 121 THR H A 120 LYS HGx 1.0 0.92 6.89 2501 1982 A 121 THR H A 120 LYS HGy 1.0 0.92 6.89 stop_ save_