data_nef_c15783_2k43 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 15785 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 TYR start . . 2 A 2 LYS middle . . 3 A 3 LYS middle . . 4 A 4 PRO middle . false 5 A 5 LYS middle . . 6 A 6 LEU middle . . 7 A 7 LEU middle . . 8 A 8 TYR middle . . 9 A 9 CYS middle . . 10 A 10 SER middle . . 11 A 11 ASN middle . . 12 A 12 GLY middle . false 13 A 13 GLY middle . false 14 A 14 HIS middle . . 15 A 15 PHE middle . . 16 A 16 LEU middle . . 17 A 17 ARG middle . . 18 A 18 ILE middle . . 19 A 19 LEU middle . . 20 A 20 PRO middle . false 21 A 21 ASP middle . . 22 A 22 GLY middle . false 23 A 23 THR middle . . 24 A 24 VAL middle . . 25 A 25 ASP middle . . 26 A 26 GLY middle . false 27 A 27 THR middle . . 28 A 28 ARG middle . . 29 A 29 ASP middle . . 30 A 30 ARG middle . . 31 A 31 SER middle . . 32 A 32 ASP middle . . 33 A 33 GLN middle . . 34 A 34 HIS middle . . 35 A 35 ILE middle . . 36 A 36 GLN middle . . 37 A 37 LEU middle . . 38 A 38 GLN middle . . 39 A 39 LEU middle . . 40 A 40 SER middle . . 41 A 41 ALA middle . . 42 A 42 GLU middle . . 43 A 43 SER middle . . 44 A 44 VAL middle . . 45 A 45 GLY middle . false 46 A 46 GLU middle . . 47 A 47 VAL middle . . 48 A 48 TYR middle . . 49 A 49 ILE middle . . 50 A 50 LYS middle . . 51 A 51 SER middle . . 52 A 52 THR middle . . 53 A 53 GLU middle . . 54 A 54 THR middle . . 55 A 55 GLY middle . false 56 A 56 GLN middle . . 57 A 57 TYR middle . . 58 A 58 LEU middle . . 59 A 59 ALA middle . . 60 A 60 MET middle . . 61 A 61 ASP middle . . 62 A 62 THR middle . . 63 A 63 ASP middle . . 64 A 64 GLY middle . false 65 A 65 LEU middle . . 66 A 66 LEU middle . . 67 A 67 TYR middle . . 68 A 68 GLY middle . false 69 A 69 SER middle . . 70 A 70 GLN middle . . 71 A 71 THR middle . . 72 A 72 PRO middle . false 73 A 73 ASN middle . . 74 A 74 GLU middle . . 75 A 75 GLU middle . . 76 A 76 CYS middle . . 77 A 77 LEU middle . . 78 A 78 PHE middle . . 79 A 79 LEU middle . . 80 A 80 GLU middle . . 81 A 81 ARG middle . . 82 A 82 LEU middle . . 83 A 83 GLU middle . . 84 A 84 GLU middle . . 85 A 85 ASN middle . . 86 A 86 HIS middle . . 87 A 87 TYR middle . . 88 A 88 ASN middle . . 89 A 89 THR middle . . 90 A 90 TYR middle . . 91 A 91 ILE middle . . 92 A 92 SER middle . . 93 A 93 LYS middle . . 94 A 94 LYS middle . . 95 A 95 HIS middle . . 96 A 96 ALA middle . . 97 A 97 GLU middle . . 98 A 98 LYS middle . . 99 A 99 ASN middle . . 100 A 100 TRP middle . . 101 A 101 PHE middle . . 102 A 102 VAL middle . . 103 A 103 GLY middle . false 104 A 104 LEU middle . . 105 A 105 LYS middle . . 106 A 106 LYS middle . . 107 A 107 ASN middle . . 108 A 108 GLY middle . false 109 A 109 SER middle . . 110 A 110 CYS middle . . 111 A 111 LYS middle . . 112 A 112 ARG middle . . 113 A 113 GLY middle . false 114 A 114 PRO middle . false 115 A 115 ARG middle . . 116 A 116 THR middle . . 117 A 117 HIS middle . . 118 A 118 TYR middle . . 119 A 119 GLY middle . false 120 A 120 GLN middle . . 121 A 121 LYS middle . . 122 A 122 ALA middle . . 123 A 123 ILE middle . . 124 A 124 LEU middle . . 125 A 125 PHE middle . . 126 A 126 LEU middle . . 127 A 127 PRO middle . false 128 A 128 LEU middle . . 129 A 129 PRO middle . false 130 A 130 VAL middle . . 131 A 131 SER middle . . 132 A 132 SER middle . . 133 A 133 ASP end . . stop_ save_ save_chemical_shift_set _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode chemical_shift_set loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 TYR H1 H 1 8.416 0.0 A 1 TYR HA H 1 4.696 0.0 A 1 TYR HBx H 1 2.927 0.0 A 1 TYR HBy H 1 3.36 0.0 A 1 TYR HDx H 1 7.1 0.0 A 1 TYR HDy H 1 7.1 0.0 A 1 TYR HEx H 1 6.89 0.0 A 1 TYR HEy H 1 6.89 0.0 A 1 TYR C C 13 174.229 0.0 A 1 TYR CA C 13 55.442 0.0 A 1 TYR N N 15 120.6 0.0 A 2 LYS H H 1 7.955 0.0 A 2 LYS HA H 1 4.27 0.0 A 2 LYS HBx H 1 1.89 0.0 A 2 LYS C C 13 174.3 0.0 A 2 LYS CA C 13 51.913 0.0 A 2 LYS N N 15 120.0 0.0 A 3 LYS H H 1 7.96 0.0 A 3 LYS HA H 1 4.6 0.0 A 3 LYS HBx H 1 1.6 0.0 A 3 LYS HBy H 1 1.77 0.0 A 3 LYS CA C 13 51.9 0.0 A 3 LYS N N 15 119.64 0.0 A 4 PRO HA H 1 4.716 0.0 A 4 PRO HBy H 1 2.171 0.0 A 4 PRO C C 13 172.359 0.0 A 4 PRO CA C 13 60.687 0.0 A 4 PRO CB C 13 30.627 0.0 A 5 LYS H H 1 9.357 0.0 A 5 LYS HA H 1 5.062 0.0 A 5 LYS HBx H 1 1.507 0.0 A 5 LYS HBy H 1 1.835 0.0 A 5 LYS C C 13 171.776 0.0 A 5 LYS CA C 13 51.445 0.0 A 5 LYS CB C 13 34.945 0.0 A 5 LYS N N 15 119.1 0.0 A 6 LEU H H 1 8.944 0.0 A 6 LEU HA H 1 4.984 0.0 A 6 LEU HBx H 1 1.641 0.0 A 6 LEU HBy H 1 1.806 0.0 A 6 LEU HDx% H 1 0.769 0.0 A 6 LEU HDy% H 1 0.646 0.0 A 6 LEU C C 13 174.676 0.0 A 6 LEU CA C 13 50.259 0.0 A 6 LEU CB C 13 41.472 0.0 A 6 LEU N N 15 117.4 0.0 A 7 LEU H H 1 10.297 0.0 A 7 LEU HA H 1 5.083 0.0 A 7 LEU HBx H 1 1.335 0.0 A 7 LEU HBy H 1 1.65 0.0 A 7 LEU HDx% H 1 0.625 0.0 A 7 LEU HDy% H 1 0.528 0.0 A 7 LEU HG H 1 1.46 0.0 A 7 LEU C C 13 172.29 0.0 A 7 LEU CA C 13 53.596 0.0 A 7 LEU N N 15 125.0 0.0 A 8 TYR H H 1 8.483 0.0 A 8 TYR HA H 1 4.592 0.0 A 8 TYR HBx H 1 2.922 0.0 A 8 TYR HBy H 1 3.405 0.0 A 8 TYR C C 13 171.27 0.0 A 8 TYR CA C 13 54.761 0.0 A 8 TYR CB C 13 37.988 0.0 A 8 TYR N N 15 125.0 0.0 A 9 CYS H H 1 9.235 0.0 A 9 CYS HA H 1 4.163 0.0 A 9 CYS HBx H 1 2.581 0.0 A 9 CYS HBy H 1 2.581 0.0 A 9 CYS C C 13 172.619 0.0 A 9 CYS CA C 13 55.588 0.0 A 9 CYS CB C 13 26.864 0.0 A 9 CYS N N 15 130.104 0.0 A 10 SER H H 1 8.173 0.0 A 10 SER HA H 1 3.92 0.0 A 10 SER HBx H 1 3.9 0.0 A 10 SER C C 13 172.21 0.0 A 10 SER CA C 13 57.853 0.0 A 10 SER CB C 13 61.82 0.0 A 10 SER N N 15 122.6 0.0 A 11 ASN H H 1 7.45 0.0 A 11 ASN HA H 1 4.36 0.0 A 11 ASN HBx H 1 4.36 0.0 A 11 ASN CA C 13 52.43 0.0 A 11 ASN N N 15 119.55 0.0 A 12 GLY H H 1 7.096 0.0 A 12 GLY HAy H 1 3.927 0.0 A 12 GLY C C 13 171.806 0.0 A 12 GLY CA C 13 41.915 0.0 A 12 GLY N N 15 109.3 0.0 A 13 GLY H H 1 7.096 0.0 A 13 GLY HAy H 1 3.598 0.0 A 13 GLY HAx H 1 3.204 0.0 A 13 GLY C C 13 170.445 0.0 A 13 GLY CA C 13 44.272 0.0 A 13 GLY N N 15 109.3 0.0 A 14 HIS H H 1 6.302 0.0 A 14 HIS HA H 1 4.104 0.0 A 14 HIS HBx H 1 2.488 0.0 A 14 HIS HBy H 1 2.651 0.0 A 14 HIS C C 13 171.281 0.0 A 14 HIS CA C 13 54.319 0.0 A 14 HIS CB C 13 31.792 0.0 A 14 HIS N N 15 113.6 0.0 A 15 PHE H H 1 9.298 0.0 A 15 PHE HA H 1 5.39 0.0 A 15 PHE HBx H 1 2.936 0.0 A 15 PHE HBy H 1 3.547 0.0 A 15 PHE C C 13 173.938 0.0 A 15 PHE CA C 13 54.273 0.0 A 15 PHE CB C 13 37.632 0.0 A 15 PHE N N 15 120.7 0.0 A 16 LEU H H 1 8.48 0.0 A 16 LEU HA H 1 4.394 0.0 A 16 LEU HBx H 1 1.384 0.0 A 16 LEU HBy H 1 1.897 0.0 A 16 LEU C C 13 171.758 0.0 A 16 LEU CA C 13 54.44 0.0 A 16 LEU CB C 13 41.301 0.0 A 16 LEU N N 15 124.7 0.0 A 17 ARG H H 1 9.339 0.0 A 17 ARG HA H 1 4.715 0.0 A 17 ARG HBx H 1 1.236 0.0 A 17 ARG HBy H 1 2.587 0.0 A 17 ARG HDx H 1 3.196 0.0 A 17 ARG HDy H 1 3.416 0.0 A 17 ARG HGx H 1 1.23 0.0 A 17 ARG HGy H 1 1.503 0.0 A 17 ARG C C 13 171.302 0.0 A 17 ARG CA C 13 53.301 0.0 A 17 ARG CB C 13 32.62 0.0 A 17 ARG N N 15 126.971 0.0 A 18 ILE H H 1 6.989 0.0 A 18 ILE HA H 1 4.563 0.0 A 18 ILE HB H 1 1.653 0.0 A 18 ILE HG2% H 1 0.641 0.0 A 18 ILE C C 13 173.747 0.0 A 18 ILE CA C 13 57.903 0.0 A 18 ILE N N 15 120.966 0.0 A 19 LEU H H 1 8.94 0.0 A 19 LEU CA C 13 51.419 0.0 A 19 LEU N N 15 128.097 0.0 A 20 PRO HA H 1 4.319 0.0 A 20 PRO HBx H 1 1.971 0.0 A 20 PRO HBy H 1 2.343 0.0 A 20 PRO HDx H 1 3.673 0.0 A 20 PRO HGx H 1 1.939 0.0 A 20 PRO C C 13 173.966 0.0 A 20 PRO CA C 13 62.71 0.0 A 20 PRO CB C 13 29.518 0.0 A 21 ASP H H 1 7.415 0.0 A 21 ASP HA H 1 4.513 0.0 A 21 ASP HBx H 1 2.606 0.0 A 21 ASP HBy H 1 3.094 0.0 A 21 ASP C C 13 174.57 0.0 A 21 ASP CA C 13 51.361 0.0 A 21 ASP CB C 13 37.419 0.0 A 21 ASP N N 15 114.0 0.0 A 22 GLY H H 1 8.404 0.0 A 22 GLY HAx H 1 3.838 0.0 A 22 GLY HAy H 1 4.632 0.0 A 22 GLY C C 13 172.565 0.0 A 22 GLY CA C 13 43.166 0.0 A 22 GLY N N 15 109.1 0.0 A 23 THR H H 1 7.894 0.0 A 23 THR HA H 1 4.489 0.0 A 23 THR HB H 1 4.206 0.0 A 23 THR HG2% H 1 1.154 0.0 A 23 THR C C 13 170.17 0.0 A 23 THR CA C 13 61.304 0.0 A 23 THR CB C 13 67.455 0.0 A 23 THR N N 15 116.8 0.0 A 24 VAL H H 1 7.792 0.0 A 24 VAL HA H 1 5.084 0.0 A 24 VAL HB H 1 1.601 0.0 A 24 VAL HGx% H 1 0.83 0.0 A 24 VAL C C 13 171.629 0.0 A 24 VAL CA C 13 58.203 0.0 A 24 VAL CB C 13 31.847 0.0 A 24 VAL N N 15 123.1 0.0 A 25 ASP H H 1 8.906 0.0 A 25 ASP HA H 1 4.313 0.0 A 25 ASP HBx H 1 2.734 0.0 A 25 ASP HBy H 1 3.018 0.0 A 25 ASP C C 13 170.281 0.0 A 25 ASP CA C 13 50.847 0.0 A 25 ASP CB C 13 38.73 0.0 A 25 ASP N N 15 131.2 0.0 A 26 GLY H H 1 7.891 0.0 A 26 GLY HAx H 1 3.015 0.0 A 26 GLY HAy H 1 5.529 0.0 A 26 GLY C C 13 169.975 0.0 A 26 GLY CA C 13 42.057 0.0 A 26 GLY N N 15 102.5 0.0 A 27 THR H H 1 8.529 0.0 A 27 THR HA H 1 5.189 0.0 A 27 THR HB H 1 3.986 0.0 A 27 THR HG2% H 1 1.344 0.0 A 27 THR C C 13 170.554 0.0 A 27 THR CA C 13 56.74 0.0 A 27 THR CB C 13 67.326 0.0 A 27 THR N N 15 112.7 0.0 A 28 ARG H H 1 8.993 0.0 A 28 ARG HA H 1 4.691 0.0 A 28 ARG HBx H 1 1.744 0.0 A 28 ARG HBy H 1 2.078 0.0 A 28 ARG C C 13 173.45 0.0 A 28 ARG CA C 13 54.938 0.0 A 28 ARG CB C 13 37.26 0.0 A 28 ARG N N 15 127.5 0.0 A 29 ASP H H 1 8.323 0.0 A 29 ASP HA H 1 4.661 0.0 A 29 ASP HBx H 1 2.671 0.0 A 29 ASP HBy H 1 3.222 0.0 A 29 ASP C C 13 172.275 0.0 A 29 ASP CA C 13 50.779 0.0 A 29 ASP N N 15 121.0 0.0 A 30 ARG H H 1 8.342 0.0 A 30 ARG HA H 1 3.592 0.0 A 30 ARG HBy H 1 1.777 0.0 A 30 ARG HDx H 1 3.124 0.0 A 30 ARG HGx H 1 1.446 0.0 A 30 ARG C C 13 173.454 0.0 A 30 ARG CA C 13 54.924 0.0 A 30 ARG CB C 13 28.367 0.0 A 30 ARG N N 15 126.1 0.0 A 31 SER H H 1 8.379 0.0 A 31 SER HA H 1 4.397 0.0 A 31 SER HBx H 1 4.033 0.0 A 31 SER HBy H 1 4.033 0.0 A 31 SER C C 13 171.758 0.0 A 31 SER CA C 13 55.918 0.0 A 31 SER CB C 13 61.807 0.0 A 31 SER N N 15 113.6 0.0 A 32 ASP H H 1 7.105 0.0 A 32 ASP HA H 1 4.276 0.0 A 32 ASP HBx H 1 2.707 0.0 A 32 ASP HBy H 1 2.771 0.0 A 32 ASP C C 13 174.497 0.0 A 32 ASP CA C 13 53.116 0.0 A 32 ASP CB C 13 41.585 0.0 A 32 ASP N N 15 125.0 0.0 A 33 GLN H H 1 8.775 0.0 A 33 GLN HA H 1 4.061 0.0 A 33 GLN HBx H 1 1.52 0.0 A 33 GLN HBy H 1 1.643 0.0 A 33 GLN HE2y H 1 7.36 0.0 A 33 GLN HE2x H 1 6.66 0.0 A 33 GLN HGx H 1 2.098 0.0 A 33 GLN C C 13 174.9 0.0 A 33 GLN CA C 13 55.127 0.0 A 33 GLN CB C 13 26.601 0.0 A 33 GLN N N 15 124.7 0.0 A 33 GLN NE2 N 15 112.0 0.0 A 34 HIS H H 1 9.681 0.0 A 34 HIS HA H 1 4.885 0.0 A 34 HIS HBx H 1 3.037 0.0 A 34 HIS HBy H 1 3.964 0.0 A 34 HIS C C 13 172.307 0.0 A 34 HIS CA C 13 55.739 0.0 A 34 HIS CB C 13 26.065 0.0 A 34 HIS N N 15 116.7 0.0 A 35 ILE H H 1 6.711 0.0 A 35 ILE HA H 1 5.114 0.0 A 35 ILE HB H 1 2.427 0.0 A 35 ILE HD1% H 1 0.54 0.0 A 35 ILE HG1x H 1 1.113 0.0 A 35 ILE HG2% H 1 0.83 0.0 A 35 ILE C C 13 172.249 0.0 A 35 ILE CA C 13 58.395 0.0 A 35 ILE CB C 13 35.989 0.0 A 35 ILE N N 15 108.6 0.0 A 36 GLN H H 1 7.148 0.0 A 36 GLN HA H 1 4.261 0.0 A 36 GLN HBx H 1 1.877 0.0 A 36 GLN HBy H 1 2.112 0.0 A 36 GLN HE2y H 1 7.438 0.0 A 36 GLN HE2x H 1 6.63 0.0 A 36 GLN HGx H 1 2.082 0.0 A 36 GLN C C 13 172.952 0.0 A 36 GLN CA C 13 55.111 0.0 A 36 GLN CB C 13 25.19 0.0 A 36 GLN N N 15 120.018 0.0 A 36 GLN NE2 N 15 110.1 0.0 A 37 LEU H H 1 9.11 0.0 A 37 LEU HA H 1 5.315 0.0 A 37 LEU HBx H 1 1.047 0.0 A 37 LEU HBy H 1 1.599 0.0 A 37 LEU HDx% H 1 0.72 0.0 A 37 LEU HDy% H 1 0.59 0.0 A 37 LEU C C 13 172.877 0.0 A 37 LEU CA C 13 51.329 0.0 A 37 LEU CB C 13 42.165 0.0 A 37 LEU N N 15 127.6 0.0 A 38 GLN H H 1 9.556 0.0 A 38 GLN HA H 1 4.623 0.0 A 38 GLN HBx H 1 1.789 0.0 A 38 GLN HBy H 1 1.874 0.0 A 38 GLN HGx H 1 2.041 0.0 A 38 GLN C C 13 172.676 0.0 A 38 GLN CA C 13 51.81 0.0 A 38 GLN CB C 13 29.259 0.0 A 38 GLN N N 15 120.583 0.0 A 39 LEU H H 1 8.926 0.0 A 39 LEU HA H 1 5.506 0.0 A 39 LEU HBx H 1 1.569 0.0 A 39 LEU HBy H 1 1.668 0.0 A 39 LEU HDx% H 1 0.892 0.0 A 39 LEU HDy% H 1 0.779 0.0 A 39 LEU C C 13 174.601 0.0 A 39 LEU CA C 13 53.062 0.0 A 39 LEU N N 15 131.7 0.0 A 40 SER H H 1 8.569 0.0 A 40 SER HA H 1 4.676 0.0 A 40 SER HBx H 1 3.809 0.0 A 40 SER HBy H 1 3.873 0.0 A 40 SER C C 13 170.046 0.0 A 40 SER CA C 13 54.925 0.0 A 40 SER CB C 13 46.694 0.0 A 40 SER N N 15 115.9 0.0 A 41 ALA H H 1 8.357 0.0 A 41 ALA HA H 1 5.016 0.0 A 41 ALA HB% H 1 1.34 0.0 A 41 ALA C C 13 175.352 0.0 A 41 ALA CA C 13 49.309 0.0 A 41 ALA CB C 13 27.376 0.0 A 41 ALA N N 15 125.9 0.0 A 42 GLU H H 1 8.485 0.0 A 42 GLU HA H 1 4.444 0.0 A 42 GLU HBx H 1 1.814 0.0 A 42 GLU HBy H 1 2.2 0.0 A 42 GLU HGx H 1 2.2 0.0 A 42 GLU HGy H 1 2.324 0.0 A 42 GLU C C 13 174.014 0.0 A 42 GLU CA C 13 54.611 0.0 A 42 GLU CB C 13 28.181 0.0 A 42 GLU N N 15 125.4 0.0 A 43 SER H H 1 8.02 0.0 A 43 SER HA H 1 4.516 0.0 A 43 SER HBx H 1 3.722 0.0 A 43 SER HBy H 1 3.814 0.0 A 43 SER C C 13 171.119 0.0 A 43 SER CA C 13 55.014 0.0 A 43 SER CB C 13 61.687 0.0 A 43 SER N N 15 113.9 0.0 A 44 VAL H H 1 8.113 0.0 A 44 VAL HA H 1 3.868 0.0 A 44 VAL HB H 1 2.057 0.0 A 44 VAL HGx% H 1 1.154 0.0 A 44 VAL HGy% H 1 1.082 0.0 A 44 VAL C C 13 175.533 0.0 A 44 VAL CA C 13 62.838 0.0 A 44 VAL CB C 13 28.991 0.0 A 44 VAL N N 15 121.1 0.0 A 45 GLY H H 1 8.807 0.0 A 45 GLY HAx H 1 3.995 0.0 A 45 GLY HAy H 1 4.296 0.0 A 45 GLY C C 13 170.948 0.0 A 45 GLY CA C 13 43.553 0.0 A 45 GLY N N 15 115.545 0.0 A 46 GLU H H 1 7.985 0.0 A 46 GLU HA H 1 5.442 0.0 A 46 GLU HBx H 1 1.82 0.0 A 46 GLU HBy H 1 1.842 0.0 A 46 GLU HGx H 1 2.087 0.0 A 46 GLU HGy H 1 2.149 0.0 A 46 GLU C C 13 173.583 0.0 A 46 GLU CA C 13 52.751 0.0 A 46 GLU CB C 13 29.432 0.0 A 46 GLU N N 15 121.2 0.0 A 47 VAL H H 1 9.56 0.0 A 47 VAL HA H 1 5.505 0.0 A 47 VAL HB H 1 2.296 0.0 A 47 VAL HGx% H 1 0.979 0.0 A 47 VAL HGy% H 1 0.871 0.0 A 47 VAL C C 13 172.96 0.0 A 47 VAL CA C 13 56.846 0.0 A 47 VAL CB C 13 33.714 0.0 A 47 VAL N N 15 116.4 0.0 A 48 TYR H H 1 8.415 0.0 A 48 TYR HA H 1 5.29 0.0 A 48 TYR HBx H 1 3.035 0.0 A 48 TYR HBy H 1 3.286 0.0 A 48 TYR C C 13 173.423 0.0 A 48 TYR CA C 13 54.331 0.0 A 48 TYR CB C 13 39.296 0.0 A 48 TYR N N 15 117.4 0.0 A 49 ILE H H 1 10.532 0.0 A 49 ILE HA H 1 4.341 0.0 A 49 ILE HB H 1 1.65 0.0 A 49 ILE HD1% H 1 -0.17 0.0 A 49 ILE HG1x H 1 0.487 0.0 A 49 ILE HG1y H 1 1.231 0.0 A 49 ILE C C 13 170.853 0.0 A 49 ILE CA C 13 59.573 0.0 A 49 ILE CB C 13 40.504 0.0 A 49 ILE N N 15 123.1 0.0 A 50 LYS H H 1 8.511 0.0 A 50 LYS HA H 1 4.991 0.0 A 50 LYS HBx H 1 1.113 0.0 A 50 LYS HBy H 1 1.303 0.0 A 50 LYS HDx H 1 1.302 0.0 A 50 LYS HEx H 1 2.5 0.0 A 50 LYS HEy H 1 2.6 0.0 A 50 LYS HGx H 1 0.399 0.0 A 50 LYS HGy H 1 0.861 0.0 A 50 LYS C C 13 173.759 0.0 A 50 LYS CA C 13 51.179 0.0 A 50 LYS CB C 13 34.816 0.0 A 50 LYS N N 15 125.8 0.0 A 51 SER H H 1 8.92 0.0 A 51 SER HA H 1 4.666 0.0 A 51 SER HBx H 1 3.883 0.0 A 51 SER HBy H 1 3.883 0.0 A 51 SER C C 13 175.084 0.0 A 51 SER CA C 13 55.043 0.0 A 51 SER CB C 13 61.065 0.0 A 51 SER N N 15 117.579 0.0 A 52 THR H H 1 8.342 0.0 A 52 THR HA H 1 3.996 0.0 A 52 THR HB H 1 4.193 0.0 A 52 THR HG2% H 1 1.446 0.0 A 52 THR C C 13 173.566 0.0 A 52 THR CA C 13 62.792 0.0 A 52 THR CB C 13 65.611 0.0 A 52 THR N N 15 123.2 0.0 A 53 GLU H H 1 8.312 0.0 A 53 GLU HA H 1 4.311 0.0 A 53 GLU HBx H 1 1.912 0.0 A 53 GLU HBy H 1 2.207 0.0 A 53 GLU C C 13 175.327 0.0 A 53 GLU CA C 13 55.889 0.0 A 53 GLU CB C 13 28.359 0.0 A 53 GLU N N 15 122.0 0.0 A 54 THR H H 1 7.724 0.0 A 54 THR HA H 1 4.681 0.0 A 54 THR HB H 1 4.528 0.0 A 54 THR HG2% H 1 1.184 0.0 A 54 THR C C 13 173.942 0.0 A 54 THR CA C 13 58.555 0.0 A 54 THR CB C 13 69.03 0.0 A 54 THR N N 15 103.1 0.0 A 55 GLY H H 1 7.643 0.0 A 55 GLY HAx H 1 3.591 0.0 A 55 GLY HAy H 1 4.15 0.0 A 55 GLY C C 13 170.694 0.0 A 55 GLY CA C 13 43.594 0.0 A 55 GLY N N 15 110.7 0.0 A 56 GLN H H 1 7.211 0.0 A 56 GLN HA H 1 4.311 0.0 A 56 GLN HBx H 1 1.591 0.0 A 56 GLN HBy H 1 1.591 0.0 A 56 GLN HE2y H 1 7.02 0.0 A 56 GLN HE2x H 1 6.38 0.0 A 56 GLN C C 13 172.141 0.0 A 56 GLN CA C 13 53.898 0.0 A 56 GLN CB C 13 30.456 0.0 A 56 GLN N N 15 115.7 0.0 A 56 GLN NE2 N 15 106.6 0.0 A 57 TYR H H 1 9.254 0.0 A 57 TYR HA H 1 4.128 0.0 A 57 TYR HBx H 1 2.811 0.0 A 57 TYR HBy H 1 3.161 0.0 A 57 TYR C C 13 173.32 0.0 A 57 TYR CA C 13 53.356 0.0 A 57 TYR CB C 13 40.466 0.0 A 57 TYR N N 15 119.4 0.0 A 58 LEU H H 1 9.126 0.0 A 58 LEU HA H 1 4.128 0.0 A 58 LEU HBx H 1 1.037 0.0 A 58 LEU HBy H 1 1.939 0.0 A 58 LEU HDx% H 1 0.435 0.0 A 58 LEU HG H 1 1.733 0.0 A 58 LEU C C 13 172.32 0.0 A 58 LEU CA C 13 53.256 0.0 A 58 LEU CB C 13 40.466 0.0 A 58 LEU N N 15 123.6 0.0 A 59 ALA H H 1 8.656 0.0 A 59 ALA HA H 1 5.124 0.0 A 59 ALA HB% H 1 0.611 0.0 A 59 ALA C C 13 172.722 0.0 A 59 ALA CA C 13 48.45 0.0 A 59 ALA CB C 13 21.261 0.0 A 59 ALA N N 15 126.947 0.0 A 60 MET H H 1 7.521 0.0 A 60 MET HA H 1 5.527 0.0 A 60 MET HBx H 1 2.192 0.0 A 60 MET HBy H 1 2.385 0.0 A 60 MET HGx H 1 2.2 0.0 A 60 MET HGy H 1 2.785 0.0 A 60 MET C C 13 173.753 0.0 A 60 MET CA C 13 52.251 0.0 A 60 MET CB C 13 35.046 0.0 A 60 MET N N 15 116.602 0.0 A 61 ASP H H 1 9.159 0.0 A 61 ASP HA H 1 5.046 0.0 A 61 ASP HBx H 1 2.87 0.0 A 61 ASP HBy H 1 3.586 0.0 A 61 ASP C C 13 175.8 0.0 A 61 ASP CA C 13 51.48 0.0 A 61 ASP CB C 13 39.346 0.0 A 61 ASP N N 15 128.445 0.0 A 62 THR H H 1 7.972 0.0 A 62 THR HA H 1 4.134 0.0 A 62 THR HB H 1 4.503 0.0 A 62 THR HG2% H 1 1.662 0.0 A 62 THR C C 13 172.355 0.0 A 62 THR CA C 13 62.626 0.0 A 62 THR CB C 13 66.955 0.0 A 62 THR N N 15 107.806 0.0 A 63 ASP H H 1 8.333 0.0 A 63 ASP HA H 1 4.964 0.0 A 63 ASP HBy H 1 2.769 0.0 A 63 ASP HBx H 1 2.749 0.0 A 63 ASP C C 13 174.438 0.0 A 63 ASP CA C 13 51.865 0.0 A 63 ASP CB C 13 39.182 0.0 A 63 ASP N N 15 119.831 0.0 A 64 GLY H H 1 8.264 0.0 A 64 GLY HAx H 1 3.397 0.0 A 64 GLY HAy H 1 3.652 0.0 A 64 GLY C C 13 171.248 0.0 A 64 GLY CA C 13 42.923 0.0 A 64 GLY N N 15 109.142 0.0 A 65 LEU H H 1 8.636 0.0 A 65 LEU HA H 1 4.529 0.0 A 65 LEU HBx H 1 1.567 0.0 A 65 LEU HBy H 1 2.054 0.0 A 65 LEU HDx% H 1 1.143 0.0 A 65 LEU HDy% H 1 0.995 0.0 A 65 LEU HG H 1 2.447 0.0 A 65 LEU C C 13 174.507 0.0 A 65 LEU CA C 13 52.224 0.0 A 65 LEU CB C 13 40.557 0.0 A 65 LEU N N 15 123.137 0.0 A 66 LEU H H 1 7.431 0.0 A 66 LEU HA H 1 5.714 0.0 A 66 LEU HBy H 1 1.434 0.0 A 66 LEU HBx H 1 1.139 0.0 A 66 LEU HDx% H 1 1.42 0.0 A 66 LEU HDy% H 1 1.02 0.0 A 66 LEU HG H 1 2.164 0.0 A 66 LEU C C 13 174.07 0.0 A 66 LEU CA C 13 51.635 0.0 A 66 LEU CB C 13 40.474 0.0 A 66 LEU N N 15 124.493 0.0 A 67 TYR H H 1 9.237 0.0 A 67 TYR HA H 1 5.023 0.0 A 67 TYR HBx H 1 3.111 0.0 A 67 TYR C C 13 169.64 0.0 A 67 TYR CA C 13 54.076 0.0 A 67 TYR CB C 13 38.903 0.0 A 67 TYR N N 15 120.36 0.0 A 68 GLY H H 1 8.928 0.0 A 68 GLY HAx H 1 4.676 0.0 A 68 GLY C C 13 170.551 0.0 A 68 GLY CA C 13 41.569 0.0 A 68 GLY N N 15 105.646 0.0 A 69 SER H H 1 9.608 0.0 A 69 SER HA H 1 4.966 0.0 A 69 SER HBx H 1 3.552 0.0 A 69 SER HBy H 1 3.915 0.0 A 69 SER C C 13 174.219 0.0 A 69 SER CA C 13 53.737 0.0 A 69 SER CB C 13 63.042 0.0 A 69 SER N N 15 120.1 0.0 A 70 GLN H H 1 9.343 0.0 A 70 GLN HA H 1 4.286 0.0 A 70 GLN HBx H 1 2.216 0.0 A 70 GLN HBy H 1 2.331 0.0 A 70 GLN HE2y H 1 7.36 0.0 A 70 GLN HE2x H 1 6.86 0.0 A 70 GLN HGx H 1 2.539 0.0 A 70 GLN HGy H 1 2.667 0.0 A 70 GLN C C 13 173.241 0.0 A 70 GLN CA C 13 56.139 0.0 A 70 GLN CB C 13 27.092 0.0 A 70 GLN N N 15 127.339 0.0 A 70 GLN NE2 N 15 112.2 0.0 A 71 THR H H 1 7.532 0.0 A 71 THR HA H 1 4.78 0.0 A 71 THR HB H 1 4.15 0.0 A 71 THR CA C 13 55.203 0.0 A 71 THR N N 15 108.1 0.0 A 72 PRO HA H 1 4.173 0.0 A 72 PRO HBx H 1 0.325 0.0 A 72 PRO HBy H 1 1.31 0.0 A 72 PRO C C 13 172.92 0.0 A 72 PRO CA C 13 60.05 0.0 A 72 PRO CB C 13 26.678 0.0 A 73 ASN H H 1 7.321 0.0 A 73 ASN CA C 13 49.994 0.0 A 73 ASN N N 15 119.2 0.0 A 74 GLU H H 1 9.03 0.0 A 74 GLU HA H 1 4.13 0.0 A 74 GLU HBy H 1 2.12 0.0 A 74 GLU HBx H 1 2.117 0.0 A 74 GLU HGx H 1 2.529 0.0 A 74 GLU HGy H 1 2.529 0.0 A 74 GLU C C 13 176.352 0.0 A 74 GLU CA C 13 57.131 0.0 A 74 GLU CB C 13 27.005 0.0 A 75 GLU H H 1 8.574 0.0 A 75 GLU HA H 1 4.206 0.0 A 75 GLU HBx H 1 2.468 0.0 A 75 GLU HBy H 1 2.631 0.0 A 75 GLU HGx H 1 2.434 0.0 A 75 GLU HGy H 1 2.621 0.0 A 75 GLU C C 13 173.866 0.0 A 75 GLU CA C 13 56.343 0.0 A 75 GLU CB C 13 26.028 0.0 A 75 GLU N N 15 119.2 0.0 A 76 CYS H H 1 7.727 0.0 A 76 CYS HA H 1 5.426 0.0 A 76 CYS HBx H 1 3.315 0.0 A 76 CYS HBy H 1 3.71 0.0 A 76 CYS C C 13 170.849 0.0 A 76 CYS CA C 13 55.635 0.0 A 76 CYS CB C 13 26.036 0.0 A 76 CYS N N 15 113.8 0.0 A 77 LEU H H 1 6.241 0.0 A 77 LEU HA H 1 4.555 0.0 A 77 LEU HBx H 1 1.163 0.0 A 77 LEU HBy H 1 1.423 0.0 A 77 LEU HDx% H 1 0.65 0.0 A 77 LEU HDy% H 1 0.38 0.0 A 77 LEU HG H 1 1.27 0.0 A 77 LEU C C 13 173.882 0.0 A 77 LEU CA C 13 51.793 0.0 A 77 LEU CB C 13 42.123 0.0 A 77 LEU N N 15 118.069 0.0 A 78 PHE H H 1 9.067 0.0 A 78 PHE HA H 1 5.169 0.0 A 78 PHE HBx H 1 2.804 0.0 A 78 PHE HBy H 1 2.936 0.0 A 78 PHE C C 13 171.853 0.0 A 78 PHE CA C 13 54.917 0.0 A 78 PHE CB C 13 40.597 0.0 A 78 PHE N N 15 122.377 0.0 A 79 LEU H H 1 9.958 0.0 A 79 LEU HA H 1 4.686 0.0 A 79 LEU HBx H 1 1.9 0.0 A 79 LEU HDx% H 1 0.935 0.0 A 79 LEU HG H 1 1.573 0.0 A 79 LEU C C 13 173.055 0.0 A 79 LEU CA C 13 51.232 0.0 A 79 LEU CB C 13 38.511 0.0 A 79 LEU N N 15 122.126 0.0 A 80 GLU H H 1 8.347 0.0 A 80 GLU HA H 1 4.832 0.0 A 80 GLU HBx H 1 1.926 0.0 A 80 GLU HBy H 1 2.079 0.0 A 80 GLU C C 13 173.355 0.0 A 80 GLU CA C 13 52.558 0.0 A 80 GLU CB C 13 30.892 0.0 A 80 GLU N N 15 126.3 0.0 A 81 ARG H H 1 8.84 0.0 A 81 ARG HA H 1 4.659 0.0 A 81 ARG HBx H 1 1.83 0.0 A 81 ARG HBy H 1 1.84 0.0 A 81 ARG HDx H 1 3.19 0.0 A 81 ARG HGx H 1 1.482 0.0 A 81 ARG HGy H 1 1.567 0.0 A 81 ARG C C 13 172.258 0.0 A 81 ARG CA C 13 52.288 0.0 A 81 ARG CB C 13 38.588 0.0 A 81 ARG N N 15 129.522 0.0 A 82 LEU H H 1 8.347 0.0 A 82 LEU HA H 1 4.875 0.0 A 82 LEU HBx H 1 1.505 0.0 A 82 LEU HBy H 1 1.746 0.0 A 82 LEU HDx% H 1 0.848 0.0 A 82 LEU HG H 1 1.706 0.0 A 82 LEU C C 13 174.567 0.0 A 82 LEU CA C 13 52.631 0.0 A 82 LEU CB C 13 40.304 0.0 A 82 LEU N N 15 125.7 0.0 A 83 GLU H H 1 9.064 0.0 A 83 GLU HA H 1 4.974 0.0 A 83 GLU HGx H 1 2.208 0.0 A 83 GLU HGy H 1 2.208 0.0 A 83 GLU C C 13 174.885 0.0 A 83 GLU CA C 13 51.723 0.0 A 83 GLU CB C 13 43.703 0.0 A 83 GLU N N 15 125.6 0.0 A 84 GLU H H 1 8.806 0.0 A 84 GLU HA H 1 4.112 0.0 A 84 GLU HBx H 1 2.165 0.0 A 84 GLU HGx H 1 2.355 0.0 A 84 GLU HGy H 1 2.355 0.0 A 84 GLU C C 13 174.261 0.0 A 84 GLU CA C 13 55.553 0.0 A 84 GLU CB C 13 27.117 0.0 A 84 GLU N N 15 120.3 0.0 A 85 ASN H H 1 8.429 0.0 A 85 ASN HA H 1 4.343 0.0 A 85 ASN HBx H 1 2.998 0.0 A 85 ASN HBy H 1 3.092 0.0 A 85 ASN C C 13 172.203 0.0 A 85 ASN CA C 13 51.788 0.0 A 85 ASN CB C 13 35.301 0.0 A 85 ASN N N 15 114.8 0.0 A 86 HIS H H 1 8.081 0.0 A 86 HIS HA H 1 4.26 0.0 A 86 HIS HBx H 1 3.284 0.0 A 86 HIS HBy H 1 3.442 0.0 A 86 HIS C C 13 171.039 0.0 A 86 HIS CA C 13 55.255 0.0 A 86 HIS CB C 13 24.858 0.0 A 86 HIS N N 15 108.737 0.0 A 87 TYR H H 1 7.592 0.0 A 87 TYR HA H 1 4.836 0.0 A 87 TYR HBx H 1 2.959 0.0 A 87 TYR C C 13 171.983 0.0 A 87 TYR CA C 13 56.163 0.0 A 87 TYR CB C 13 38.643 0.0 A 87 TYR N N 15 117.738 0.0 A 88 ASN H H 1 9.84 0.0 A 88 ASN HA H 1 5.837 0.0 A 88 ASN HBx H 1 2.486 0.0 A 88 ASN HBy H 1 2.658 0.0 A 88 ASN HD2y H 1 6.72 0.0 A 88 ASN HD2x H 1 6.5 0.0 A 88 ASN C C 13 172.471 0.0 A 88 ASN CA C 13 50.063 0.0 A 88 ASN CB C 13 40.242 0.0 A 88 ASN N N 15 118.891 0.0 A 88 ASN ND2 N 15 106.93 0.0 A 89 THR H H 1 8.38 0.0 A 89 THR HA H 1 5.127 0.0 A 89 THR HB H 1 4.58 0.0 A 89 THR HG2% H 1 1.319 0.0 A 89 THR C C 13 170.548 0.0 A 89 THR CA C 13 57.357 0.0 A 89 THR CB C 13 70.868 0.0 A 89 THR N N 15 108.521 0.0 A 90 TYR H H 1 10.247 0.0 A 90 TYR HA H 1 5.472 0.0 A 90 TYR HBx H 1 2.471 0.0 A 90 TYR C C 13 172.442 0.0 A 90 TYR CA C 13 55.106 0.0 A 90 TYR CB C 13 39.047 0.0 A 90 TYR N N 15 119.0 0.0 A 91 ILE H H 1 8.781 0.0 A 91 ILE HA H 1 4.673 0.0 A 91 ILE HD1% H 1 0.562 0.0 A 91 ILE HG1x H 1 0.036 0.0 A 91 ILE HG1y H 1 1.288 0.0 A 91 ILE HG2% H 1 0.631 0.0 A 91 ILE C C 13 172.924 0.0 A 91 ILE CA C 13 56.346 0.0 A 91 ILE CB C 13 36.627 0.0 A 91 ILE N N 15 122.546 0.0 A 92 SER H H 1 8.191 0.0 A 92 SER HA H 1 4.016 0.0 A 92 SER HBx H 1 3.816 0.0 A 92 SER C C 13 172.863 0.0 A 92 SER CA C 13 55.781 0.0 A 92 SER CB C 13 62.382 0.0 A 92 SER N N 15 120.2 0.0 A 93 LYS H H 1 7.993 0.0 A 93 LYS HA H 1 3.779 0.0 A 93 LYS HBx H 1 1.19 0.0 A 93 LYS HBy H 1 1.766 0.0 A 93 LYS HEx H 1 2.657 0.0 A 93 LYS HEy H 1 2.912 0.0 A 93 LYS HGx H 1 1.203 0.0 A 93 LYS C C 13 176.938 0.0 A 93 LYS CA C 13 57.942 0.0 A 93 LYS CB C 13 30.889 0.0 A 93 LYS N N 15 130.618 0.0 A 94 LYS H H 1 8.616 0.0 A 94 LYS HA H 1 3.851 0.0 A 94 LYS HBx H 1 1.342 0.0 A 94 LYS HBy H 1 1.475 0.0 A 94 LYS HDx H 1 1.435 0.0 A 94 LYS HEx H 1 2.919 0.0 A 94 LYS HGx H 1 0.593 0.0 A 94 LYS HGy H 1 0.948 0.0 A 94 LYS C C 13 174.491 0.0 A 94 LYS CA C 13 55.868 0.0 A 94 LYS CB C 13 30.329 0.0 A 94 LYS N N 15 120.044 0.0 A 95 HIS H H 1 7.249 0.0 A 95 HIS HA H 1 4.604 0.0 A 95 HIS HBx H 1 2.47 0.0 A 95 HIS HBy H 1 2.524 0.0 A 95 HIS C C 13 173.734 0.0 A 95 HIS CA C 13 51.18 0.0 A 95 HIS CB C 13 26.844 0.0 A 95 HIS N N 15 114.486 0.0 A 96 ALA H H 1 7.104 0.0 A 96 ALA HA H 1 4.131 0.0 A 96 ALA HB% H 1 2.116 0.0 A 96 ALA C C 13 178.508 0.0 A 96 ALA CA C 13 53.758 0.0 A 96 ALA CB C 13 16.578 0.0 A 96 ALA N N 15 125.204 0.0 A 97 GLU H H 1 8.857 0.0 A 97 GLU HA H 1 4.063 0.0 A 97 GLU HBx H 1 1.965 0.0 A 97 GLU HGx H 1 2.154 0.0 A 97 GLU HGy H 1 2.278 0.0 A 97 GLU C C 13 174.813 0.0 A 97 GLU CA C 13 56.153 0.0 A 97 GLU CB C 13 26.241 0.0 A 97 GLU N N 15 118.007 0.0 A 98 LYS H H 1 7.116 0.0 A 98 LYS HA H 1 4.28 0.0 A 98 LYS HBx H 1 0.756 0.0 A 98 LYS HBy H 1 1.735 0.0 A 98 LYS HDx H 1 1.459 0.0 A 98 LYS HEx H 1 2.278 0.0 A 98 LYS HGx H 1 0.431 0.0 A 98 LYS C C 13 173.361 0.0 A 98 LYS CA C 13 52.852 0.0 A 98 LYS CB C 13 29.959 0.0 A 98 LYS N N 15 116.241 0.0 A 99 ASN H H 1 7.842 0.0 A 99 ASN HA H 1 3.772 0.0 A 99 ASN HBx H 1 2.816 0.0 A 99 ASN HBy H 1 2.973 0.0 A 99 ASN HD2y H 1 7.4 0.0 A 99 ASN HD2x H 1 6.47 0.0 A 99 ASN C C 13 170.506 0.0 A 99 ASN CA C 13 52.24 0.0 A 99 ASN CB C 13 35.289 0.0 A 99 ASN N N 15 113.0 0.0 A 99 ASN ND2 N 15 112.85 0.0 A 100 TRP H H 1 6.369 0.0 A 100 TRP HA H 1 4.816 0.0 A 100 TRP HBx H 1 2.92 0.0 A 100 TRP HBy H 1 3.141 0.0 A 100 TRP C C 13 171.701 0.0 A 100 TRP CA C 13 53.179 0.0 A 100 TRP CB C 13 28.228 0.0 A 100 TRP N N 15 116.0 0.0 A 101 PHE H H 1 8.026 0.0 A 101 PHE HA H 1 5.373 0.0 A 101 PHE HBx H 1 2.722 0.0 A 101 PHE HBy H 1 3.456 0.0 A 101 PHE C C 13 175.044 0.0 A 101 PHE CA C 13 55.472 0.0 A 101 PHE CB C 13 39.22 0.0 A 101 PHE N N 15 124.185 0.0 A 102 VAL H H 1 8.499 0.0 A 102 VAL HA H 1 3.939 0.0 A 102 VAL HB H 1 2.027 0.0 A 102 VAL HGx% H 1 0.508 0.0 A 102 VAL C C 13 174.22 0.0 A 102 VAL CA C 13 60.975 0.0 A 102 VAL CB C 13 30.243 0.0 A 102 VAL N N 15 120.282 0.0 A 103 GLY H H 1 8.996 0.0 A 103 GLY HAy H 1 5.275 0.0 A 103 GLY HAx H 1 3.18 0.0 A 103 GLY C C 13 169.388 0.0 A 103 GLY CA C 13 43.802 0.0 A 103 GLY N N 15 114.668 0.0 A 104 LEU H H 1 8.118 0.0 A 104 LEU HA H 1 4.959 0.0 A 104 LEU HBx H 1 2.229 0.0 A 104 LEU HDx% H 1 0.747 0.0 A 104 LEU HDy% H 1 0.631 0.0 A 104 LEU HG H 1 1.629 0.0 A 104 LEU C C 13 174.252 0.0 A 104 LEU CA C 13 51.207 0.0 A 104 LEU CB C 13 43.579 0.0 A 104 LEU N N 15 119.1 0.0 A 105 LYS H H 1 8.847 0.0 A 105 LYS HA H 1 4.215 0.0 A 105 LYS HBx H 1 1.781 0.0 A 105 LYS HBy H 1 2.121 0.0 A 105 LYS HDx H 1 1.59 0.0 A 105 LYS HDy H 1 1.737 0.0 A 105 LYS HEx H 1 3.128 0.0 A 105 LYS C C 13 176.404 0.0 A 105 LYS CA C 13 54.035 0.0 A 105 LYS N N 15 118.9 0.0 A 106 LYS H H 1 8.98 0.0 A 106 LYS HA H 1 3.624 0.0 A 106 LYS HBx H 1 1.475 0.0 A 106 LYS HBy H 1 1.761 0.0 A 106 LYS HEx H 1 3.082 0.0 A 106 LYS HGx H 1 1.536 0.0 A 106 LYS C C 13 174.499 0.0 A 106 LYS CA C 13 57.672 0.0 A 106 LYS CB C 13 29.78 0.0 A 106 LYS N N 15 122.172 0.0 A 107 ASN H H 1 7.352 0.0 A 107 ASN HA H 1 4.678 0.0 A 107 ASN HBx H 1 2.762 0.0 A 107 ASN HBy H 1 3.318 0.0 A 107 ASN C C 13 174.511 0.0 A 107 ASN CA C 13 49.523 0.0 A 107 ASN CB C 13 35.121 0.0 A 107 ASN N N 15 112.743 0.0 A 108 GLY H H 1 7.656 0.0 A 108 GLY HAx H 1 2.111 0.0 A 108 GLY HAy H 1 3.358 0.0 A 108 GLY C C 13 169.305 0.0 A 108 GLY CA C 13 42.207 0.0 A 108 GLY N N 15 109.9 0.0 A 109 SER H H 1 7.28 0.0 A 109 SER HA H 1 4.755 0.0 A 109 SER HBx H 1 3.913 0.0 A 109 SER HBy H 1 3.913 0.0 A 109 SER C C 13 171.244 0.0 A 109 SER CA C 13 55.139 0.0 A 109 SER CB C 13 62.749 0.0 A 109 SER N N 15 112.357 0.0 A 110 CYS H H 1 9.07 0.0 A 110 CYS HA H 1 4.296 0.0 A 110 CYS HBx H 1 3.143 0.0 A 110 CYS HBy H 1 3.217 0.0 A 110 CYS C C 13 172.131 0.0 A 110 CYS CA C 13 57.858 0.0 A 110 CYS CB C 13 37.322 0.0 A 110 CYS N N 15 119.883 0.0 A 111 LYS H H 1 8.095 0.0 A 111 LYS HA H 1 4.38 0.0 A 111 LYS HBx H 1 1.458 0.0 A 111 LYS HBy H 1 1.458 0.0 A 111 LYS HDx H 1 1.25 0.0 A 111 LYS HGx H 1 1.134 0.0 A 111 LYS C C 13 172.265 0.0 A 111 LYS CA C 13 52.117 0.0 A 111 LYS CB C 13 30.98 0.0 A 111 LYS N N 15 128.642 0.0 A 112 ARG H H 1 8.566 0.0 A 112 ARG HA H 1 4.252 0.0 A 112 ARG HBx H 1 1.554 0.0 A 112 ARG HBy H 1 1.554 0.0 A 112 ARG HDx H 1 3.143 0.0 A 112 ARG HDy H 1 3.143 0.0 A 112 ARG HGx H 1 1.65 0.0 A 112 ARG C C 13 175.24 0.0 A 112 ARG CA C 13 54.295 0.0 A 112 ARG CB C 13 28.927 0.0 A 112 ARG N N 15 124.7 0.0 A 113 GLY H H 1 9.408 0.0 A 113 GLY HAx H 1 1.51 0.0 A 113 GLY C C 13 169.61 0.0 A 113 GLY CA C 13 44.552 0.0 A 113 GLY N N 15 106.636 0.0 A 114 PRO HA H 1 4.321 0.0 A 114 PRO HBx H 1 1.892 0.0 A 114 PRO HBy H 1 2.36 0.0 A 114 PRO HGx H 1 1.505 0.0 A 114 PRO HGy H 1 1.652 0.0 A 114 PRO C C 13 174.543 0.0 A 114 PRO CA C 13 62.529 0.0 A 115 ARG H H 1 8.067 0.0 A 115 ARG HA H 1 4.508 0.0 A 115 ARG HBx H 1 1.926 0.0 A 115 ARG HBy H 1 2.133 0.0 A 115 ARG HDx H 1 3.082 0.0 A 115 ARG HDy H 1 3.205 0.0 A 115 ARG C C 13 174.68 0.0 A 115 ARG CA C 13 52.011 0.0 A 115 ARG CB C 13 27.143 0.0 A 115 ARG N N 15 114.5 0.0 A 116 THR H H 1 7.643 0.0 A 116 THR HA H 1 5.198 0.0 A 116 THR HB H 1 4.104 0.0 A 116 THR HG2% H 1 1.118 0.0 A 116 THR C C 13 172.573 0.0 A 116 THR CA C 13 58.712 0.0 A 116 THR CB C 13 70.086 0.0 A 116 THR N N 15 111.716 0.0 A 117 HIS H H 1 7.091 0.0 A 117 HIS HA H 1 4.868 0.0 A 117 HIS HBx H 1 3.222 0.0 A 117 HIS HBy H 1 3.4 0.0 A 117 HIS C C 13 170.344 0.0 A 117 HIS CA C 13 53.291 0.0 A 117 HIS CB C 13 29.133 0.0 A 117 HIS N N 15 112.914 0.0 A 118 TYR H H 1 9.02 0.0 A 118 TYR HA H 1 3.897 0.0 A 118 TYR HBx H 1 2.936 0.0 A 118 TYR HBy H 1 3.089 0.0 A 118 TYR C C 13 174.446 0.0 A 118 TYR CA C 13 58.801 0.0 A 118 TYR CB C 13 29.959 0.0 A 118 TYR N N 15 123.051 0.0 A 119 GLY H H 1 7.999 0.0 A 119 GLY HAx H 1 3.296 0.0 A 119 GLY HAy H 1 4.385 0.0 A 119 GLY C C 13 172.439 0.0 A 119 GLY CA C 13 42.599 0.0 A 119 GLY N N 15 116.885 0.0 A 120 GLN H H 1 7.003 0.0 A 120 GLN HA H 1 4.262 0.0 A 120 GLN HBx H 1 2.005 0.0 A 120 GLN HBy H 1 2.118 0.0 A 120 GLN C C 13 174.995 0.0 A 120 GLN CA C 13 52.617 0.0 A 120 GLN CB C 13 27.324 0.0 A 120 GLN N N 15 118.266 0.0 A 121 LYS H H 1 8.477 0.0 A 121 LYS HA H 1 3.809 0.0 A 121 LYS HBx H 1 1.443 0.0 A 121 LYS HBy H 1 1.567 0.0 A 121 LYS HDx H 1 1.56 0.0 A 121 LYS HGx H 1 1.28 0.0 A 121 LYS C C 13 172.702 0.0 A 121 LYS CA C 13 56.243 0.0 A 121 LYS CB C 13 29.598 0.0 A 121 LYS N N 15 121.222 0.0 A 122 ALA H H 1 7.526 0.0 A 122 ALA HA H 1 3.947 0.0 A 122 ALA HB% H 1 1.143 0.0 A 122 ALA C C 13 172.756 0.0 A 122 ALA CA C 13 52.338 0.0 A 122 ALA CB C 13 18.675 0.0 A 122 ALA N N 15 116.019 0.0 A 123 ILE H H 1 5.794 0.0 A 123 ILE HA H 1 5.184 0.0 A 123 ILE HB H 1 2.232 0.0 A 123 ILE HD1% H 1 -0.126 0.0 A 123 ILE HG1x H 1 1.064 0.0 A 123 ILE HG2% H 1 0.601 0.0 A 123 ILE C C 13 172.79 0.0 A 123 ILE CA C 13 57.297 0.0 A 123 ILE CB C 13 35.425 0.0 A 123 ILE N N 15 101.2 0.0 A 124 LEU H H 1 6.716 0.0 A 124 LEU HA H 1 4.597 0.0 A 124 LEU HBx H 1 0.67 0.0 A 124 LEU HBy H 1 0.67 0.0 A 124 LEU HDx% H 1 0.407 0.0 A 124 LEU HDy% H 1 0.407 0.0 A 124 LEU C C 13 173.411 0.0 A 124 LEU CA C 13 51.686 0.0 A 124 LEU CB C 13 39.622 0.0 A 124 LEU N N 15 121.554 0.0 A 125 PHE H H 1 9.226 0.0 A 125 PHE HA H 1 5.612 0.0 A 125 PHE HBx H 1 2.803 0.0 A 125 PHE HBy H 1 3.178 0.0 A 125 PHE C C 13 172.768 0.0 A 125 PHE CA C 13 54.604 0.0 A 125 PHE CB C 13 41.692 0.0 A 125 PHE N N 15 121.9 0.0 A 126 LEU H H 1 9.932 0.0 A 126 LEU CA C 13 48.875 0.0 A 126 LEU N N 15 125.427 0.0 A 127 PRO HA H 1 5.587 0.0 A 127 PRO HBx H 1 2.04 0.0 A 127 PRO HGx H 1 2.386 0.0 A 127 PRO C C 13 174.541 0.0 A 127 PRO CA C 13 58.907 0.0 A 127 PRO CB C 13 28.73 0.0 A 128 LEU H H 1 9.674 0.0 A 128 LEU C C 13 175.96 0.0 A 128 LEU CA C 13 49.523 0.0 A 128 LEU N N 15 129.196 0.0 A 129 PRO HA H 1 4.71 0.0 A 129 PRO HBx H 1 1.961 0.0 A 129 PRO HBy H 1 2.355 0.0 A 129 PRO HDx H 1 3.654 0.0 A 129 PRO HDy H 1 3.901 0.0 A 129 PRO HGx H 1 2.146 0.0 A 129 PRO C C 13 174.414 0.0 A 129 PRO CA C 13 60.043 0.0 A 129 PRO CB C 13 29.8 0.0 A 130 VAL H H 1 7.992 0.0 A 130 VAL HA H 1 3.794 0.0 A 130 VAL HB H 1 1.985 0.0 A 130 VAL HGx% H 1 0.832 0.0 A 130 VAL HGy% H 1 0.832 0.0 A 130 VAL C C 13 174.097 0.0 A 130 VAL CA C 13 61.494 0.0 A 130 VAL CB C 13 29.649 0.0 A 130 VAL N N 15 118.275 0.0 A 131 SER H H 1 7.844 0.0 A 131 SER HA H 1 4.218 0.0 A 131 SER HBx H 1 3.153 0.0 A 131 SER HBy H 1 3.153 0.0 A 131 SER C C 13 173.574 0.0 A 131 SER CA C 13 55.233 0.0 A 131 SER CB C 13 61.375 0.0 A 131 SER N N 15 115.853 0.0 A 132 SER H H 1 8.196 0.0 A 132 SER HA H 1 4.484 0.0 A 132 SER HBx H 1 3.873 0.0 A 132 SER HBy H 1 3.873 0.0 A 132 SER C C 13 170.997 0.0 A 132 SER CA C 13 56.021 0.0 A 132 SER CB C 13 61.848 0.0 A 132 SER N N 15 118.1 0.0 A 133 ASP H H 1 7.926 0.0 A 133 ASP CA C 13 53.567 0.0 A 133 ASP N N 15 127.281 0.0 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 7 LEU H A 7 LEU HDy% 1.0 1.8 6.00 2 2 A 2 LYS H A 132 SER H 1.0 0.0 6.00 3 3 A 3 LYS H A 3 LYS HA 1.0 1.6 3.00 4 4 A 2 LYS H A 1 TYR HBx 1.0 2.0 5.60 5 5 A 5 LYS H A 130 VAL H 1.0 1.9 5.50 6 6 A 3 LYS HA A 5 LYS H 1.0 0.0 6.00 7 7 A 6 LEU H A 128 LEU H 1.0 1.9 4.10 8 8 A 51 SER H A 50 LYS H 1.0 1.8 6.00 9 9 A 6 LEU H A 6 LEU HDx% 1.0 2.0 6.00 10 10 A 8 TYR H A 126 LEU H 1.0 2.0 6.00 11 11 A 16 LEU H A 15 PHE HA 1.0 2.0 4.80 12 12 A 8 TYR H A 125 PHE HBx 1.0 2.0 6.00 13 13 A 16 LEU H A 16 LEU HBy 1.0 1.8 3.60 14 14 A 16 LEU H A 17 ARG HBx 1.0 0.0 6.00 15 15 A 9 CYS H A 6 LEU HDy% 1.0 1.7 6.00 16 16 A 125 PHE HBx A 9 CYS H 1.0 2.0 6.00 17 17 A 9 CYS H A 14 HIS H 1.0 0.0 6.00 18 18 A 126 LEU H A 10 SER H 1.0 2.0 6.00 19 19 A 10 SER H A 107 ASN H 1.0 0.0 6.00 20 20 A 10 SER H A 107 ASN HA 1.0 1.9 6.00 21 21 A 10 SER H A 107 ASN HBx 1.0 1.7 6.00 22 22 A 13 GLY H A 106 LYS HEx 1.0 1.8 3.40 23 23 A 14 HIS H A 107 ASN H 1.0 0.0 6.00 24 24 A 14 HIS H A 13 GLY H 1.0 1.8 3.80 25 25 A 14 HIS H A 107 ASN HA 1.0 2.0 4.60 26 26 A 14 HIS H A 106 LYS HEx 1.0 1.9 4.30 27 27 A 15 PHE H A 27 THR HB 1.0 1.9 4.70 28 28 A 15 PHE H A 17 ARG HDy 1.0 0.0 6.00 29 29 A 15 PHE H A 106 LYS HGx 1.0 2.0 6.00 30 30 A 17 ARG HBx A 15 PHE H 1.0 2.0 6.00 31 31 A 16 LEU H A 25 ASP HA 1.0 0.6 6.00 32 32 A 17 ARG H A 25 ASP H 1.0 2.0 4.80 33 33 A 16 LEU H A 17 ARG H 1.0 1.8 6.00 34 34 A 17 ARG H A 18 ILE H 1.0 2.0 6.00 35 35 A 15 PHE HA A 17 ARG H 1.0 1.9 6.00 36 36 A 17 ARG H A 17 ARG HA 1.0 1.8 3.40 37 37 A 17 ARG H A 23 THR HB 1.0 0.0 6.00 38 38 A 17 ARG HDy A 17 ARG H 1.0 1.9 6.00 39 39 A 17 ARG H A 106 LYS HBy 1.0 1.6 6.00 40 40 A 17 ARG H A 37 LEU HDy% 1.0 0.0 6.00 41 41 A 18 ILE H A 54 THR HA 1.0 0.0 6.00 42 42 A 18 ILE H A 19 LEU H 1.0 1.8 6.00 43 43 A 18 ILE H A 34 HIS H 1.0 0.4 6.00 44 44 A 21 ASP H A 18 ILE HB 1.0 1.9 6.00 45 45 A 21 ASP H A 22 GLY HAx 1.0 1.9 6.00 46 46 A 21 ASP H A 23 THR H 1.0 2.0 5.20 47 47 A 21 ASP H A 22 GLY H 1.0 1.7 3.10 48 48 A 19 LEU H A 21 ASP H 1.0 1.8 6.00 49 49 A 22 GLY H A 23 THR HA 1.0 2.0 5.00 50 50 A 23 THR H A 22 GLY H 1.0 1.8 3.40 51 51 A 19 LEU H A 23 THR H 1.0 1.9 4.10 52 52 A 24 VAL H A 69 SER HA 1.0 0.0 6.00 53 53 A 24 VAL H A 68 GLY HAx 1.0 0.0 6.00 54 54 A 25 ASP H A 23 THR HB 1.0 1.9 4.10 55 55 A 25 ASP H A 23 THR HA 1.0 0.0 6.00 56 56 A 26 GLY H A 110 CYS H 1.0 1.8 6.00 57 57 A 25 ASP H A 26 GLY H 1.0 1.9 6.00 58 58 A 15 PHE H A 26 GLY H 1.0 0.5 6.00 59 59 A 26 GLY H A 7 LEU HDy% 1.0 2.0 5.00 60 60 A 17 ARG HBx A 27 THR H 1.0 0.0 6.00 61 61 A 27 THR H A 14 HIS HBx 1.0 2.0 5.00 62 62 A 17 ARG HDy A 27 THR H 1.0 1.9 6.00 63 63 A 27 THR HB A 27 THR H 1.0 1.9 3.90 64 64 A 15 PHE HA A 27 THR H 1.0 0.0 6.00 65 65 A 15 PHE H A 27 THR H 1.0 1.7 3.30 66 66 A 27 THR H A 28 ARG H 1.0 2.0 6.00 67 67 A 28 ARG H A 28 ARG HA 1.0 1.9 4.70 68 68 A 29 ASP H A 30 ARG HBy 1.0 2.0 6.00 69 69 A 29 ASP H A 28 ARG HBy 1.0 2.0 6.00 70 70 A 28 ARG HA A 29 ASP H 1.0 1.5 2.70 71 71 A 28 ARG H A 29 ASP H 1.0 1.9 4.50 72 72 A 31 SER H A 32 ASP HA 1.0 2.0 5.00 73 73 A 32 ASP H A 33 GLN HBx 1.0 2.0 6.00 74 74 A 96 ALA H A 94 LYS HBx 1.0 0.0 6.00 75 75 A 32 ASP H A 30 ARG HDx 1.0 0.0 6.00 76 76 A 31 SER H A 32 ASP H 1.0 1.7 3.10 77 77 A 96 ALA H A 97 GLU H 1.0 1.9 4.30 78 78 A 34 HIS H A 33 GLN H 1.0 1.8 3.80 79 79 A 32 ASP H A 33 GLN H 1.0 1.9 6.00 80 80 A 33 GLN H A 35 ILE H 1.0 2.0 6.00 81 81 A 17 ARG HA A 34 HIS H 1.0 2.0 5.80 82 82 A 34 HIS H A 32 ASP H 1.0 2.0 5.40 83 83 A 35 ILE H A 36 GLN HE2y 1.0 1.8 3.60 84 84 A 34 HIS H A 35 ILE H 1.0 1.7 3.10 85 85 A 17 ARG HA A 35 ILE H 1.0 0.0 6.00 86 86 A 35 ILE H A 29 ASP HBx 1.0 0.0 6.00 87 87 A 35 ILE H A 30 ARG HBy 1.0 1.3 6.00 88 88 A 35 ILE H A 6 LEU HDx% 1.0 0.0 6.00 89 89 A 36 GLN H A 4 PRO HBy 1.0 2.0 5.20 90 90 A 36 GLN H A 6 LEU HA 1.0 0.0 6.00 91 91 A 36 GLN H A 55 GLY HAx 1.0 1.9 6.00 92 92 A 36 GLN H A 34 HIS HBy 1.0 1.8 6.00 93 93 A 54 THR HA A 36 GLN H 1.0 0.0 6.00 94 94 A 35 ILE H A 36 GLN H 1.0 1.7 3.50 95 95 A 34 HIS H A 36 GLN H 1.0 2.0 6.00 96 96 A 36 GLN H A 37 LEU H 1.0 1.9 5.70 97 97 A 5 LYS H A 37 LEU H 1.0 1.9 4.10 98 98 A 37 LEU H A 38 GLN H 1.0 1.5 6.00 99 99 A 55 GLY HAx A 37 LEU H 1.0 0.0 6.00 100 100 A 4 PRO HBy A 37 LEU H 1.0 1.9 6.00 101 101 A 37 LEU H A 38 GLN HBx 1.0 0.0 6.00 102 102 A 50 LYS H A 38 GLN H 1.0 2.0 4.60 103 103 A 39 LEU H A 129 PRO HBx 1.0 2.0 6.00 104 104 A 40 SER H A 48 TYR H 1.0 1.8 3.60 105 105 A 40 SER H A 50 LYS HDx 1.0 0.4 6.00 106 106 A 40 SER H A 39 LEU HDy% 1.0 1.9 4.50 107 107 A 80 GLU H A 93 LYS HGx 1.0 0.0 6.00 108 108 A 30 ARG H A 6 LEU HDx% 1.0 0.0 6.00 109 109 A 82 LEU H A 82 LEU HA 1.0 1.8 3.80 110 110 A 82 LEU H A 89 THR HB 1.0 1.9 4.90 111 111 A 82 LEU H A 83 GLU H 1.0 1.9 6.00 112 112 A 8 TYR H A 6 LEU HDx% 1.0 1.9 4.70 113 113 A 43 SER H A 42 GLU H 1.0 1.6 3.00 114 114 A 44 VAL H A 45 GLY H 1.0 2.0 5.80 115 115 A 44 VAL H A 43 SER HBx 1.0 1.8 3.40 116 116 A 45 GLY H A 80 GLU HBx 1.0 2.0 6.00 117 117 A 45 GLY H A 46 GLU H 1.0 1.7 3.30 118 118 A 46 GLU H A 47 VAL H 1.0 2.0 6.00 119 119 A 46 GLU H A 93 LYS HEx 1.0 1.7 6.00 120 120 A 47 VAL H A 80 GLU HBx 1.0 2.0 4.80 121 121 A 48 TYR H A 49 ILE H 1.0 2.0 6.00 122 122 A 48 TYR H A 47 VAL H 1.0 2.0 6.00 123 123 A 48 TYR H A 39 LEU HDy% 1.0 1.8 3.80 124 124 A 42 GLU H A 46 GLU HA 1.0 2.0 5.80 125 125 A 50 LYS H A 39 LEU HDy% 1.0 1.8 4.20 126 126 A 51 SER H A 51 SER HA 1.0 0.0 6.00 127 127 A 97 GLU H A 99 ASN H 1.0 2.0 6.00 128 128 A 38 GLN H A 52 THR H 1.0 2.0 5.80 129 129 A 52 THR H A 38 GLN HGx 1.0 0.0 6.00 130 130 A 38 GLN HBx A 52 THR H 1.0 0.0 6.00 131 131 A 52 THR H A 37 LEU HBx 1.0 1.9 4.50 132 132 A 53 GLU H A 36 GLN HGx 1.0 1.9 3.90 133 133 A 38 GLN HBx A 53 GLU H 1.0 0.0 6.00 134 134 A 53 GLU H A 52 THR HB 1.0 1.6 2.80 135 135 A 36 GLN H A 53 GLU H 1.0 1.9 6.00 136 136 A 53 GLU H A 54 THR H 1.0 1.8 3.40 137 137 A 54 THR HA A 54 THR H 1.0 1.7 3.10 138 138 A 52 THR HB A 54 THR H 1.0 2.0 5.40 139 139 A 54 THR H A 54 THR HB 1.0 2.0 5.20 140 140 A 36 GLN HGx A 54 THR H 1.0 1.9 4.10 141 141 A 55 GLY H A 37 LEU HBx 1.0 2.0 6.00 142 142 A 52 THR H A 55 GLY H 1.0 1.9 4.90 143 143 A 51 SER HA A 56 GLN H 1.0 1.8 4.00 144 144 A 51 SER H A 56 GLN H 1.0 2.0 6.00 145 145 A 57 TYR H A 72 PRO HA 1.0 0.0 6.00 146 146 A 57 TYR H A 68 GLY HAx 1.0 2.0 4.80 147 147 A 57 TYR H A 56 GLN HE2y 1.0 0.0 6.00 148 148 A 58 LEU H A 68 GLY HAx 1.0 1.8 3.80 149 149 A 58 LEU H A 58 LEU HDx% 1.0 1.9 4.70 150 150 A 59 ALA H A 67 TYR HA 1.0 2.0 4.80 151 151 A 59 ALA H A 68 GLY HAx 1.0 1.8 6.00 152 152 A 56 GLN HE2y A 59 ALA H 1.0 2.0 6.00 153 153 A 59 ALA H A 67 TYR H 1.0 1.8 3.60 154 154 A 59 ALA H A 69 SER H 1.0 1.6 6.00 155 155 A 60 MET H A 60 MET HBy 1.0 0.0 6.00 156 156 A 61 ASP H A 66 LEU HBy 1.0 2.0 6.00 157 156 A 61 ASP H A 66 LEU HDx% 1.0 2.0 6.00 158 157 A 61 ASP H A 63 ASP HBx 1.0 0.0 6.00 159 158 A 60 MET H A 61 ASP H 1.0 1.9 6.00 160 159 A 61 ASP H A 65 LEU H 1.0 1.9 5.10 161 160 A 62 THR H A 63 ASP HBx 1.0 0.0 6.00 162 161 A 61 ASP H A 62 THR H 1.0 2.0 6.00 163 162 A 62 THR H A 94 LYS HBx 1.0 0.0 6.00 164 163 A 63 ASP H A 94 LYS HGx 1.0 2.0 6.00 165 164 A 62 THR H A 63 ASP H 1.0 1.8 3.60 166 165 A 65 LEU H A 63 ASP H 1.0 2.0 5.00 167 166 A 61 ASP H A 64 GLY H 1.0 1.9 6.00 168 167 A 65 LEU H A 64 GLY H 1.0 1.7 3.30 169 168 A 64 GLY H A 66 LEU HBy 1.0 1.9 6.00 170 168 A 64 GLY H A 66 LEU HDx% 1.0 1.9 6.00 171 169 A 94 LYS HGx A 64 GLY H 1.0 2.0 6.00 172 170 A 65 LEU H A 66 LEU H 1.0 2.0 6.00 173 171 A 67 TYR H A 66 LEU H 1.0 2.0 6.00 174 172 A 66 LEU H A 112 ARG HGx 1.0 0.0 6.00 175 173 A 66 LEU H A 66 LEU HBy 1.0 1.8 3.60 176 173 A 66 LEU H A 66 LEU HDx% 1.0 1.8 3.60 177 174 A 67 TYR H A 68 GLY HAx 1.0 1.8 6.00 178 175 A 56 GLN HE2y A 67 TYR H 1.0 2.0 6.00 179 176 A 67 TYR H A 68 GLY H 1.0 1.5 6.00 180 177 A 69 SER H A 68 GLY H 1.0 2.0 6.00 181 178 A 57 TYR H A 68 GLY H 1.0 1.9 6.00 182 179 A 56 GLN HE2y A 68 GLY H 1.0 1.9 4.50 183 180 A 69 SER H A 58 LEU HG 1.0 0.0 6.00 184 181 A 56 GLN HE2y A 69 SER H 1.0 0.0 6.00 185 182 A 57 TYR H A 69 SER H 1.0 1.9 4.70 186 183 A 71 THR H A 70 GLN H 1.0 1.8 3.40 187 184 A 69 SER H A 71 THR H 1.0 1.9 6.00 188 185 A 72 PRO HA A 71 THR H 1.0 0.0 6.00 189 186 A 73 ASN H A 72 PRO HBy 1.0 2.0 6.00 190 187 A 73 ASN H A 57 TYR HBx 1.0 0.0 6.00 191 188 A 73 ASN H A 76 CYS H 1.0 1.9 4.70 192 189 A 73 ASN H A 75 GLU H 1.0 1.9 5.10 193 190 A 76 CYS H A 75 GLU H 1.0 1.4 2.20 194 191 A 75 GLU H A 60 MET HBx 1.0 0.0 6.00 195 192 A 76 CYS H A 77 LEU HG 1.0 1.9 6.00 196 193 A 76 CYS H A 58 LEU HBx 1.0 0.0 6.00 197 194 A 76 CYS H A 60 MET HBx 1.0 1.9 6.00 198 195 A 76 CYS H A 77 LEU H 1.0 1.7 3.30 199 196 A 77 LEU H A 78 PHE H 1.0 1.9 6.00 200 197 A 75 GLU H A 77 LEU H 1.0 2.0 5.40 201 198 A 77 LEU H A 48 TYR HA 1.0 2.0 5.80 202 199 A 77 LEU HG A 78 PHE H 1.0 2.0 6.00 203 200 A 78 PHE H A 78 PHE HBx 1.0 1.9 4.10 204 201 A 78 PHE H A 79 LEU HA 1.0 2.0 6.00 205 202 A 78 PHE H A 93 LYS H 1.0 1.9 6.00 206 203 A 47 VAL H A 78 PHE H 1.0 1.9 4.10 207 204 A 78 PHE H A 79 LEU H 1.0 1.6 6.00 208 205 A 79 LEU H A 93 LYS HBy 1.0 2.0 6.00 209 206 A 78 PHE HBx A 79 LEU H 1.0 0.0 6.00 210 207 A 80 GLU H A 93 LYS HBx 1.0 2.0 6.00 211 207 A 80 GLU H A 93 LYS HGx 1.0 2.0 6.00 212 208 A 80 GLU H A 81 ARG H 1.0 2.0 6.00 213 209 A 81 ARG H A 89 THR H 1.0 1.9 4.10 214 210 A 79 LEU HA A 81 ARG H 1.0 0.0 6.00 215 211 A 81 ARG H A 82 LEU HG 1.0 0.0 6.00 216 212 A 81 ARG H A 80 GLU HBx 1.0 2.0 6.00 217 213 A 31 SER H A 30 ARG H 1.0 1.8 3.60 218 214 A 82 LEU H A 81 ARG H 1.0 1.1 6.00 219 215 A 83 GLU H A 89 THR H 1.0 2.0 5.80 220 216 A 83 GLU H A 87 TYR H 1.0 1.9 5.10 221 217 A 83 GLU H A 81 ARG HGx 1.0 1.9 4.90 222 218 A 87 TYR H A 86 HIS H 1.0 1.7 3.50 223 219 A 83 GLU H A 86 HIS H 1.0 1.9 6.00 224 220 A 86 HIS H A 84 GLU H 1.0 2.0 6.00 225 221 A 88 ASN H A 88 ASN HD2y 1.0 1.5 6.00 226 222 A 89 THR H A 88 ASN H 1.0 1.9 6.00 227 223 A 88 ASN H A 125 PHE H 1.0 1.9 5.10 228 224 A 90 TYR H A 91 ILE HA 1.0 2.0 5.20 229 225 A 79 LEU H A 91 ILE H 1.0 1.8 4.00 230 226 A 78 PHE HBx A 91 ILE H 1.0 1.9 6.00 231 227 A 91 ILE H A 93 LYS HBy 1.0 1.9 6.00 232 228 A 92 SER H A 93 LYS HBy 1.0 1.8 6.00 233 229 A 78 PHE HBx A 92 SER H 1.0 0.0 6.00 234 230 A 91 ILE HA A 92 SER H 1.0 1.5 2.70 235 231 A 93 LYS H A 79 LEU H 1.0 2.0 5.60 236 232 A 93 LYS H A 94 LYS HBx 1.0 1.9 5.10 237 233 A 93 LYS H A 91 ILE HG1x 1.0 1.8 6.00 238 234 A 94 LYS H A 94 LYS HBx 1.0 1.8 3.60 239 235 A 96 ALA H A 94 LYS H 1.0 1.9 4.70 240 236 A 93 LYS H A 94 LYS H 1.0 1.9 4.30 241 237 A 94 LYS H A 95 HIS H 1.0 1.9 3.90 242 238 A 93 LYS H A 95 HIS H 1.0 1.9 6.00 243 239 A 96 ALA H A 95 HIS H 1.0 1.7 3.30 244 240 A 95 HIS H A 63 ASP HBy 1.0 2.0 6.00 245 240 A 95 HIS H A 63 ASP HBx 1.0 2.0 6.00 246 241 A 95 HIS H A 60 MET HBy 1.0 0.0 6.00 247 242 A 96 ALA H A 98 LYS HBx 1.0 0.0 6.00 248 243 A 96 ALA H A 91 ILE HA 1.0 0.0 6.00 249 244 A 96 ALA H A 98 LYS H 1.0 1.9 4.30 250 245 A 99 ASN H A 98 LYS H 1.0 1.7 3.10 251 246 A 97 GLU H A 98 LYS H 1.0 1.8 3.60 252 247 A 100 TRP H A 99 ASN HBx 1.0 1.9 4.90 253 248 A 99 ASN H A 100 TRP H 1.0 1.9 4.10 254 249 A 100 TRP H A 101 PHE H 1.0 2.0 6.00 255 250 A 101 PHE H A 116 THR H 1.0 2.0 6.00 256 251 A 101 PHE H A 102 VAL H 1.0 1.9 6.00 257 252 A 102 VAL H A 92 SER HBx 1.0 2.0 6.00 258 253 A 102 VAL H A 103 GLY H 1.0 1.9 6.00 259 254 A 103 GLY H A 104 LEU H 1.0 2.0 6.00 260 255 A 104 LEU H A 7 LEU HDy% 1.0 0.0 6.00 261 256 A 104 LEU H A 66 LEU HDy% 1.0 0.0 6.00 262 257 A 104 LEU H A 105 LYS H 1.0 2.0 5.20 263 258 A 105 LYS H A 112 ARG HA 1.0 0.0 6.00 264 259 A 105 LYS H A 105 LYS HBy 1.0 1.9 4.30 265 260 A 112 ARG HGx A 105 LYS H 1.0 1.9 3.90 266 261 A 105 LYS H A 7 LEU HDy% 1.0 0.0 6.00 267 262 A 106 LYS H A 104 LEU HG 1.0 0.0 6.00 268 263 A 106 LYS H A 7 LEU HG 1.0 0.0 6.00 269 264 A 10 SER H A 106 LYS H 1.0 0.0 6.00 270 265 A 107 ASN H A 106 LYS H 1.0 1.7 3.50 271 266 A 107 ASN HA A 108 GLY H 1.0 2.0 6.00 272 267 A 105 LYS H A 109 SER H 1.0 2.0 5.00 273 268 A 26 GLY H A 109 SER H 1.0 2.0 5.20 274 269 A 107 ASN HA A 109 SER H 1.0 0.0 6.00 275 270 A 109 SER H A 111 LYS HDx 1.0 2.0 4.60 276 271 A 110 CYS H A 7 LEU HDy% 1.0 0.0 6.00 277 272 A 110 CYS H A 111 LYS HDx 1.0 1.6 6.00 278 273 A 110 CYS H A 109 SER H 1.0 2.0 5.80 279 274 A 110 CYS H A 111 LYS H 1.0 2.0 5.60 280 275 A 105 LYS H A 111 LYS H 1.0 1.9 5.10 281 276 A 111 LYS H A 110 CYS HA 1.0 1.6 2.80 282 277 A 111 LYS H A 66 LEU HDy% 1.0 1.8 3.60 283 278 A 112 ARG H A 66 LEU HDy% 1.0 1.7 3.50 284 279 A 112 ARG H A 66 LEU HDx% 1.0 0.0 6.00 285 280 A 112 ARG HA A 112 ARG H 1.0 1.7 2.90 286 281 A 111 LYS H A 112 ARG H 1.0 2.0 5.20 287 282 A 112 ARG H A 113 GLY H 1.0 2.0 6.00 288 283 A 113 GLY H A 66 LEU HDx% 1.0 0.0 6.00 289 284 A 113 GLY H A 65 LEU HDy% 1.0 0.0 6.00 290 285 A 115 ARG H A 119 GLY HAx 1.0 1.9 6.00 291 286 A 115 ARG H A 120 GLN HBx 1.0 0.3 6.00 292 287 A 116 THR H A 113 GLY H 1.0 1.8 6.00 293 288 A 116 THR H A 115 ARG H 1.0 1.7 3.30 294 289 A 116 THR H A 119 GLY HAx 1.0 0.0 6.00 295 290 A 116 THR H A 101 PHE HBy 1.0 0.0 6.00 296 291 A 116 THR H A 120 GLN HBx 1.0 1.9 6.00 297 292 A 117 HIS H A 120 GLN HBx 1.0 0.0 6.00 298 293 A 117 HIS H A 118 TYR HBy 1.0 0.0 6.00 299 294 A 117 HIS H A 119 GLY HAy 1.0 0.0 6.00 300 295 A 116 THR H A 117 HIS H 1.0 2.0 5.40 301 296 A 118 TYR H A 119 GLY H 1.0 2.0 5.80 302 297 A 117 HIS H A 118 TYR H 1.0 1.9 4.30 303 298 A 119 GLY HAx A 118 TYR H 1.0 2.0 5.40 304 299 A 119 GLY HAy A 118 TYR H 1.0 2.0 5.20 305 300 A 119 GLY H A 123 ILE HB 1.0 2.0 6.00 306 301 A 119 GLY H A 120 GLN HA 1.0 2.0 5.20 307 302 A 119 GLY H A 121 LYS HA 1.0 0.0 6.00 308 303 A 119 GLY H A 120 GLN H 1.0 1.7 2.90 309 304 A 120 GLN H A 121 LYS H 1.0 2.0 5.80 310 305 A 120 GLN H A 123 ILE H 1.0 2.0 6.00 311 306 A 121 LYS HA A 120 GLN H 1.0 0.0 6.00 312 307 A 120 GLN H A 120 GLN HBx 1.0 0.0 6.00 313 308 A 121 LYS H A 121 LYS HBx 1.0 1.7 3.30 314 309 A 123 ILE HB A 121 LYS H 1.0 0.0 6.00 315 310 A 121 LYS H A 122 ALA H 1.0 1.8 3.80 316 311 A 121 LYS HA A 122 ALA H 1.0 1.9 4.10 317 312 A 122 ALA H A 121 LYS HBx 1.0 1.9 4.50 318 313 A 121 LYS H A 123 ILE H 1.0 1.8 6.00 319 314 A 125 PHE H A 124 LEU H 1.0 2.0 5.60 320 315 A 10 SER H A 124 LEU H 1.0 1.9 6.00 321 316 A 123 ILE H A 124 LEU H 1.0 1.7 3.30 322 317 A 124 LEU H A 120 GLN HBy 1.0 0.0 6.00 323 318 A 125 PHE H A 104 LEU HDx% 1.0 0.9 6.00 324 319 A 128 LEU H A 129 PRO HBx 1.0 2.0 6.00 325 320 A 128 LEU H A 6 LEU HDx% 1.0 0.0 6.00 326 321 A 130 VAL H A 6 LEU H 1.0 1.7 6.00 327 322 A 130 VAL H A 131 SER H 1.0 2.0 5.80 328 323 A 3 LYS HA A 130 VAL H 1.0 0.0 6.00 329 324 A 130 VAL H A 2 LYS HA 1.0 0.0 6.00 330 325 A 1 TYR HBx A 130 VAL H 1.0 0.0 6.00 331 326 A 130 VAL H A 36 GLN HBx 1.0 0.0 6.00 332 327 A 130 VAL H A 3 LYS HBx 1.0 0.0 6.00 333 328 A 1 TYR HBx A 131 SER H 1.0 0.0 6.00 334 329 A 132 SER H A 1 TYR HA 1.0 2.0 4.80 335 330 A 1 TYR HA A 133 ASP H 1.0 0.0 6.00 336 331 A 3 LYS H A 2 LYS HA 1.0 1.8 2.60 337 332 A 5 LYS H A 6 LEU H 1.0 1.8 5.00 338 333 A 5 LYS H A 37 LEU H 1.0 1.8 5.00 339 334 A 6 LEU H A 5 LYS HA 1.0 1.8 2.60 340 335 A 6 LEU H A 6 LEU HDy% 1.0 1.8 4.50 341 336 A 6 LEU H A 6 LEU HDx% 1.0 1.8 4.50 342 337 A 6 LEU H A 127 PRO HA 1.0 1.8 5.00 343 338 A 6 LEU H A 128 LEU H 1.0 1.8 3.50 344 339 A 130 VAL H A 6 LEU H 1.0 1.8 5.00 345 340 A 7 LEU H A 6 LEU HA 1.0 1.8 2.60 346 341 A 7 LEU H A 6 LEU HBx 1.0 1.8 5.00 347 342 A 7 LEU H A 6 LEU HBy 1.0 1.8 5.00 348 343 A 7 LEU H A 7 LEU HBx 1.0 1.8 3.50 349 344 A 7 LEU H A 7 LEU HG 1.0 1.8 5.00 350 345 A 7 LEU H A 7 LEU HDx% 1.0 1.8 6.00 351 346 A 7 LEU H A 7 LEU HDy% 1.0 1.8 6.00 352 347 A 7 LEU H A 15 PHE HD% 1.0 1.8 7.20 353 348 A 8 TYR H A 7 LEU HA 1.0 1.8 2.60 354 349 A 8 TYR H A 7 LEU HBy 1.0 1.8 5.00 355 350 A 8 TYR H A 8 TYR HBx 1.0 1.8 3.50 356 351 A 8 TYR H A 8 TYR HBy 1.0 1.8 3.50 357 352 A 8 TYR H A 15 PHE HE% 1.0 1.8 7.20 358 353 A 8 TYR H A 126 LEU H 1.0 1.8 5.00 359 354 A 8 TYR H A 127 PRO HA 1.0 1.8 3.50 360 355 A 15 PHE HA A 8 TYR HA 1.0 1.8 5.00 361 356 A 15 PHE HA A 8 TYR HD% 1.0 1.8 7.20 362 357 A 8 TYR HD% A 126 LEU HBx 1.0 1.8 5.70 363 358 A 8 TYR HD% A 126 LEU HD21 1.0 1.8 8.20 364 359 A 10 SER H A 9 CYS HA 1.0 1.8 2.60 365 360 A 10 SER H A 11 ASN H 1.0 1.8 5.00 366 361 A 10 SER H A 125 PHE HA 1.0 1.8 5.00 367 362 A 11 ASN H A 12 GLY H 1.0 1.8 5.00 368 363 A 11 ASN H A 122 ALA HB% 1.0 1.8 7.00 369 364 A 13 GLY H A 8 TYR HD% 1.0 1.8 7.20 370 365 A 14 HIS H A 13 GLY H 1.0 1.8 3.50 371 366 A 14 HIS H A 13 GLY HAy 1.0 1.8 3.50 372 367 A 14 HIS H A 13 GLY HAx 1.0 1.8 3.50 373 368 A 14 HIS H A 15 PHE H 1.0 1.8 5.00 374 369 A 14 HIS H A 26 GLY HAx 1.0 1.8 5.50 375 370 A 14 HIS HA A 14 HIS HD2 1.0 1.8 5.00 376 371 A 15 PHE H A 14 HIS HA 1.0 1.8 2.60 377 372 A 15 PHE H A 14 HIS HBx 1.0 1.8 5.00 378 373 A 15 PHE H A 14 HIS HBy 1.0 1.8 5.00 379 374 A 15 PHE H A 14 HIS HD2 1.0 1.8 5.00 380 375 A 16 LEU H A 15 PHE H 1.0 1.8 5.00 381 376 A 15 PHE H A 27 THR H 1.0 1.8 5.00 382 377 A 15 PHE H A 27 THR HG2% 1.0 1.8 6.00 383 378 A 15 PHE H A 28 ARG HA 1.0 1.8 5.00 384 379 A 16 LEU H A 7 LEU HBx 1.0 1.8 5.00 385 380 A 16 LEU H A 15 PHE HA 1.0 1.8 2.60 386 381 A 16 LEU H A 16 LEU HD11 1.0 1.8 6.00 387 382 A 16 LEU HD21 A 49 ILE HD1% 1.0 1.8 7.00 388 383 A 16 LEU H A 17 ARG H 1.0 1.8 5.00 389 384 A 17 ARG H A 16 LEU HA 1.0 1.8 2.60 390 385 A 17 ARG H A 16 LEU HBx 1.0 1.8 5.00 391 386 A 17 ARG H A 16 LEU HBy 1.0 1.8 5.00 392 387 A 17 ARG H A 16 LEU HG 1.0 1.8 3.50 393 388 A 17 ARG H A 16 LEU HD11 1.0 1.8 3.60 394 389 A 17 ARG H A 16 LEU HD21 1.0 1.8 6.00 395 390 A 17 ARG H A 24 VAL HA 1.0 1.8 5.00 396 391 A 17 ARG H A 25 ASP H 1.0 1.8 5.00 397 392 A 17 ARG H A 26 GLY HAx 1.0 1.8 5.00 398 393 A 17 ARG H A 26 GLY HAy 1.0 1.8 5.00 399 394 A 17 ARG H A 18 ILE H 1.0 1.8 5.00 400 395 A 18 ILE H A 17 ARG HA 1.0 1.8 2.60 401 396 A 18 ILE H A 17 ARG HGx 1.0 1.8 5.00 402 397 A 18 ILE H A 17 ARG HGy 1.0 1.8 5.00 403 398 A 18 ILE H A 18 ILE HB 1.0 1.8 3.50 404 399 A 18 ILE H A 18 ILE HG2% 1.0 1.8 3.60 405 400 A 18 ILE H A 19 LEU H 1.0 1.8 5.00 406 401 A 18 ILE H A 35 ILE HA 1.0 1.8 5.00 407 402 A 19 LEU H A 18 ILE HA 1.0 1.8 2.60 408 403 A 19 LEU H A 18 ILE HB 1.0 1.8 5.00 409 404 A 19 LEU H A 18 ILE HG2% 1.0 1.8 4.50 410 405 A 19 LEU H A 19 LEU HBx 1.0 1.8 3.50 411 406 A 19 LEU H A 19 LEU HBy 1.0 1.8 3.50 412 407 A 19 LEU H A 22 GLY H 1.0 1.8 5.00 413 408 A 19 LEU H A 24 VAL HA 1.0 1.8 5.00 414 409 A 21 ASP H A 19 LEU HBx 1.0 1.8 5.00 415 410 A 21 ASP H A 19 LEU HBy 1.0 1.8 3.50 416 411 A 21 ASP H A 19 LEU HD11 1.0 1.8 6.00 417 412 A 21 ASP H A 19 LEU HD21 1.0 1.8 6.00 418 413 A 21 ASP H A 20 PRO HA 1.0 1.8 3.50 419 414 A 21 ASP H A 20 PRO HBx 1.0 1.8 3.50 420 415 A 21 ASP H A 21 ASP HBx 1.0 1.8 3.50 421 416 A 21 ASP H A 21 ASP HBy 1.0 1.8 3.50 422 417 A 21 ASP H A 22 GLY H 1.0 1.8 3.50 423 418 A 21 ASP H A 23 THR H 1.0 1.8 5.00 424 419 A 21 ASP H A 23 THR HG2% 1.0 1.8 6.00 425 420 A 22 GLY H A 20 PRO HBx 1.0 1.8 5.30 426 421 A 22 GLY H A 21 ASP HA 1.0 1.8 3.50 427 422 A 22 GLY H A 21 ASP HBx 1.0 1.8 5.00 428 423 A 22 GLY H A 21 ASP HBy 1.0 1.8 5.00 429 424 A 23 THR H A 22 GLY H 1.0 1.8 2.60 430 425 A 22 GLY H A 23 THR HG2% 1.0 1.8 6.00 431 426 A 19 LEU H A 23 THR H 1.0 1.8 5.00 432 427 A 23 THR HB A 23 THR H 1.0 1.8 2.60 433 428 A 23 THR H A 23 THR HG2% 1.0 1.8 3.60 434 429 A 23 THR HA A 24 VAL HG21 1.0 1.8 6.00 435 430 A 23 THR HA A 24 VAL H 1.0 1.8 2.60 436 431 A 23 THR HB A 24 VAL H 1.0 1.8 3.50 437 432 A 24 VAL H A 23 THR HG2% 1.0 1.8 3.60 438 433 A 24 VAL H A 24 VAL HB 1.0 1.8 3.50 439 434 A 24 VAL H A 24 VAL HGx% 1.0 1.8 4.50 440 435 A 25 ASP H A 24 VAL H 1.0 1.8 5.00 441 436 A 25 ASP H A 17 ARG HA 1.0 1.8 5.00 442 437 A 25 ASP H A 18 ILE HA 1.0 1.8 5.00 443 438 A 25 ASP H A 23 THR HG2% 1.0 1.8 6.00 444 439 A 25 ASP H A 24 VAL HA 1.0 1.8 2.60 445 440 A 25 ASP H A 24 VAL HG21 1.0 1.8 3.60 446 441 A 25 ASP H A 24 VAL HGx% 1.0 1.8 3.60 447 442 A 25 ASP HA A 26 GLY H 1.0 1.8 3.50 448 443 A 26 GLY H A 104 LEU HDx% 1.0 1.8 6.00 449 444 A 26 GLY H A 104 LEU HDy% 1.0 1.8 6.00 450 445 A 27 THR H A 14 HIS HA 1.0 1.8 5.00 451 446 A 27 THR H A 14 HIS HD2 1.0 1.8 5.00 452 447 A 27 THR H A 15 PHE HD% 1.0 1.8 7.20 453 448 A 27 THR H A 16 LEU HA 1.0 1.8 5.00 454 449 A 27 THR H A 26 GLY HAx 1.0 1.8 2.60 455 450 A 27 THR H A 26 GLY HAy 1.0 1.8 2.90 456 451 A 27 THR H A 27 THR HG2% 1.0 1.8 3.60 457 452 A 28 ARG H A 27 THR HA 1.0 1.8 2.60 458 453 A 28 ARG H A 29 ASP H 1.0 1.8 5.00 459 454 A 29 ASP H A 15 PHE HD% 1.0 1.8 7.20 460 455 A 29 ASP H A 27 THR HA 1.0 1.8 5.00 461 456 A 27 THR HB A 29 ASP H 1.0 1.8 5.00 462 457 A 29 ASP H A 27 THR HG2% 1.0 1.8 3.60 463 458 A 28 ARG HA A 29 ASP H 1.0 1.8 3.50 464 459 A 29 ASP H A 29 ASP HBx 1.0 1.8 3.10 465 460 A 29 ASP H A 29 ASP HBy 1.0 1.8 3.10 466 461 A 30 ARG H A 15 PHE HD% 1.0 1.8 5.70 467 462 A 30 ARG H A 15 PHE HE% 1.0 1.8 7.20 468 463 A 30 ARG H A 29 ASP HA 1.0 1.8 2.60 469 464 A 30 ARG H A 29 ASP HBx 1.0 1.8 5.00 470 465 A 30 ARG H A 29 ASP HBy 1.0 1.8 5.00 471 466 A 30 ARG H A 35 ILE HD1% 1.0 1.8 6.00 472 467 A 31 SER H A 30 ARG H 1.0 1.8 3.50 473 468 A 31 SER H A 31 SER HBx 1.0 1.8 3.50 474 469 A 31 SER H A 31 SER HBy 1.0 1.8 3.50 475 470 A 31 SER H A 32 ASP H 1.0 1.8 2.60 476 471 A 31 SER H A 32 ASP HBx 1.0 1.8 5.00 477 472 A 31 SER H A 32 ASP HBy 1.0 1.8 5.00 478 473 A 31 SER H A 35 ILE HD1% 1.0 1.8 6.00 479 474 A 32 ASP H A 30 ARG HA 1.0 1.8 5.00 480 475 A 32 ASP H A 31 SER HA 1.0 1.8 3.50 481 476 A 32 ASP H A 32 ASP HBx 1.0 1.8 3.50 482 477 A 32 ASP H A 32 ASP HBy 1.0 1.8 3.50 483 478 A 32 ASP H A 35 ILE HG2% 1.0 1.8 4.50 484 479 A 32 ASP HA A 33 GLN H 1.0 1.8 2.60 485 480 A 33 GLN H A 32 ASP HBx 1.0 1.8 5.00 486 481 A 33 GLN H A 32 ASP HBy 1.0 1.8 5.00 487 482 A 34 HIS H A 33 GLN H 1.0 1.8 5.00 488 483 A 34 HIS H A 32 ASP HA 1.0 1.8 5.00 489 484 A 34 HIS H A 33 GLN HBx 1.0 1.8 5.00 490 485 A 34 HIS H A 33 GLN HBy 1.0 1.8 5.00 491 486 A 34 HIS H A 35 ILE H 1.0 1.8 3.50 492 487 A 34 HIS H A 35 ILE HG2% 1.0 1.8 6.00 493 488 A 35 ILE H A 33 GLN HA 1.0 1.8 5.00 494 489 A 35 ILE H A 34 HIS HA 1.0 1.8 3.50 495 490 A 35 ILE H A 35 ILE HG2% 1.0 1.8 4.50 496 491 A 35 ILE H A 35 ILE HD1% 1.0 1.8 3.60 497 492 A 35 ILE H A 36 GLN H 1.0 1.8 3.50 498 493 A 36 GLN H A 35 ILE HG2% 1.0 1.8 6.00 499 494 A 36 GLN H A 35 ILE HD1% 1.0 1.8 4.50 500 495 A 37 LEU H A 36 GLN HA 1.0 1.8 2.60 501 496 A 37 LEU H A 37 LEU HG 1.0 1.8 2.60 502 497 A 37 LEU H A 37 LEU HDx% 1.0 1.8 6.00 503 498 A 37 LEU H A 37 LEU HDy% 1.0 1.8 6.00 504 499 A 38 GLN H A 37 LEU HA 1.0 1.8 2.60 505 500 A 38 GLN H A 37 LEU HBx 1.0 1.8 3.50 506 501 A 38 GLN H A 37 LEU HBy 1.0 1.8 3.50 507 502 A 38 GLN H A 38 GLN HBx 1.0 1.8 2.60 508 503 A 38 GLN H A 38 GLN HBy 1.0 1.8 3.50 509 504 A 38 GLN H A 49 ILE HA 1.0 1.8 5.00 510 505 A 38 GLN H A 49 ILE HG21 1.0 1.8 6.00 511 506 A 50 LYS H A 38 GLN H 1.0 1.8 3.50 512 507 A 38 GLN H A 52 THR HG2% 1.0 1.8 6.00 513 508 A 39 LEU H A 38 GLN HA 1.0 1.8 2.60 514 509 A 39 LEU H A 40 SER H 1.0 1.8 5.00 515 510 A 39 LEU HA A 40 SER HA 1.0 1.8 5.00 516 511 A 50 LYS H A 39 LEU HA 1.0 1.8 3.50 517 512 A 40 SER H A 39 LEU HA 1.0 1.8 2.60 518 513 A 40 SER H A 39 LEU HDx% 1.0 1.8 6.00 519 514 A 40 SER H A 39 LEU HDy% 1.0 1.8 6.00 520 515 A 40 SER H A 47 VAL HB 1.0 1.8 5.00 521 516 A 40 SER H A 47 VAL HGy% 1.0 1.8 6.00 522 517 A 40 SER H A 48 TYR H 1.0 1.8 3.50 523 518 A 40 SER H A 49 ILE HA 1.0 1.8 5.00 524 519 A 40 SER HA A 41 ALA H 1.0 1.8 2.60 525 520 A 41 ALA H A 40 SER HBx 1.0 1.8 5.00 526 521 A 41 ALA H A 40 SER HBy 1.0 1.8 5.00 527 522 A 41 ALA H A 41 ALA HB% 1.0 1.8 3.60 528 523 A 41 ALA H A 47 VAL HA 1.0 1.8 5.00 529 524 A 41 ALA H A 47 VAL HGx% 1.0 1.8 6.00 530 525 A 42 GLU H A 41 ALA HA 1.0 1.8 2.60 531 526 A 42 GLU H A 41 ALA HB% 1.0 1.8 3.60 532 527 A 43 SER H A 42 GLU H 1.0 1.8 2.60 533 528 A 42 GLU H A 46 GLU H 1.0 1.8 5.00 534 529 A 42 GLU H A 46 GLU HGx 1.0 1.8 5.00 535 530 A 42 GLU H A 46 GLU HGy 1.0 1.8 5.00 536 531 A 42 GLU H A 47 VAL HA 1.0 1.8 3.50 537 532 A 42 GLU H A 47 VAL HGx% 1.0 1.8 6.00 538 533 A 77 LEU HDy% A 42 GLU HBx 1.0 1.8 9.14 539 534 A 43 SER H A 41 ALA HA 1.0 1.8 5.00 540 535 A 43 SER H A 41 ALA HB% 1.0 1.8 4.50 541 536 A 43 SER H A 42 GLU HA 1.0 1.8 3.50 542 537 A 43 SER H A 42 GLU HBx 1.0 1.8 5.00 543 538 A 43 SER H A 42 GLU HBy 1.0 1.8 5.00 544 539 A 43 SER H A 42 GLU HGx 1.0 1.8 5.00 545 540 A 43 SER H A 42 GLU HGy 1.0 1.8 5.00 546 541 A 43 SER H A 43 SER HBy 1.0 1.8 3.50 547 542 A 43 SER H A 43 SER HBx 1.0 1.8 3.50 548 543 A 43 SER H A 46 GLU HA 1.0 1.8 5.00 549 544 A 43 SER H A 46 GLU HBx 1.0 1.8 5.00 550 545 A 43 SER H A 46 GLU HBy 1.0 1.8 5.00 551 546 A 43 SER H A 47 VAL HA 1.0 1.8 5.00 552 547 A 43 SER HA A 44 VAL HGx% 1.0 1.8 6.00 553 548 A 44 VAL H A 43 SER HA 1.0 1.8 2.60 554 549 A 44 VAL H A 43 SER HBy 1.0 1.8 3.50 555 550 A 44 VAL H A 43 SER HBx 1.0 1.8 5.00 556 551 A 44 VAL H A 44 VAL HB 1.0 1.8 3.50 557 552 A 44 VAL H A 45 GLY H 1.0 1.8 5.00 558 553 A 45 GLY H A 43 SER HA 1.0 1.8 5.50 559 554 A 45 GLY H A 44 VAL HA 1.0 1.8 2.60 560 555 A 45 GLY H A 44 VAL HB 1.0 1.8 5.00 561 556 A 45 GLY H A 44 VAL HGx% 1.0 1.8 6.00 562 557 A 45 GLY H A 44 VAL HGy% 1.0 1.8 6.00 563 558 A 45 GLY H A 45 GLY HAx 1.0 1.8 2.60 564 559 A 45 GLY H A 46 GLU HA 1.0 1.8 5.00 565 560 A 45 GLY H A 46 GLU H 1.0 1.8 3.50 566 561 A 46 GLU H A 41 ALA HB% 1.0 1.8 6.00 567 562 A 46 GLU H A 43 SER HA 1.0 1.8 5.00 568 563 A 46 GLU H A 43 SER HBy 1.0 1.8 5.00 569 564 A 46 GLU H A 44 VAL HA 1.0 1.8 5.00 570 565 A 46 GLU H A 45 GLY HAy 1.0 1.8 3.50 571 566 A 46 GLU H A 45 GLY HAx 1.0 1.8 3.50 572 567 A 46 GLU H A 46 GLU HBx 1.0 1.8 3.50 573 568 A 46 GLU H A 46 GLU HGx 1.0 1.8 3.50 574 569 A 46 GLU H A 46 GLU HGy 1.0 1.8 3.50 575 570 A 46 GLU H A 47 VAL H 1.0 1.8 5.00 576 571 A 46 GLU H A 47 VAL HGx% 1.0 1.8 7.00 577 571 A 46 GLU H A 47 VAL HGy% 1.0 1.8 7.00 578 572 A 46 GLU H A 79 LEU HA 1.0 1.8 5.50 579 573 A 46 GLU HA A 47 VAL HGx% 1.0 1.8 6.00 580 574 A 47 VAL H A 46 GLU HA 1.0 1.8 2.60 581 575 A 47 VAL H A 46 GLU HBx 1.0 1.8 3.50 582 576 A 47 VAL H A 46 GLU HBy 1.0 1.8 3.50 583 577 A 47 VAL H A 46 GLU HGx 1.0 1.8 5.00 584 578 A 47 VAL H A 46 GLU HGy 1.0 1.8 5.00 585 579 A 47 VAL H A 47 VAL HGy% 1.0 1.8 3.60 586 580 A 47 VAL H A 47 VAL HGx% 1.0 1.8 4.50 587 581 A 48 TYR H A 47 VAL H 1.0 1.8 5.00 588 582 A 47 VAL H A 77 LEU HDx% 1.0 1.8 6.00 589 583 A 47 VAL H A 77 LEU HDy% 1.0 1.8 6.00 590 584 A 47 VAL H A 78 PHE H 1.0 1.8 3.50 591 585 A 47 VAL H A 79 LEU HA 1.0 1.8 5.00 592 586 A 47 VAL H A 79 LEU HG 1.0 1.8 7.00 593 587 A 48 TYR H A 41 ALA HA 1.0 1.8 3.50 594 588 A 48 TYR H A 41 ALA HB% 1.0 1.8 6.00 595 589 A 48 TYR H A 47 VAL HA 1.0 1.8 2.60 596 590 A 48 TYR H A 47 VAL HB 1.0 1.8 2.60 597 591 A 48 TYR H A 47 VAL HGy% 1.0 1.8 6.00 598 592 A 48 TYR H A 47 VAL HGx% 1.0 1.8 4.50 599 593 A 48 TYR H A 48 TYR HBy 1.0 1.8 3.50 600 594 A 48 TYR H A 48 TYR HBx 1.0 1.8 3.50 601 595 A 48 TYR H A 48 TYR HE% 1.0 1.8 7.20 602 596 A 49 ILE H A 48 TYR HA 1.0 1.8 2.60 603 597 A 49 ILE H A 48 TYR HBy 1.0 1.8 3.50 604 598 A 49 ILE H A 48 TYR HBx 1.0 1.8 5.00 605 599 A 49 ILE H A 48 TYR HD% 1.0 1.8 5.70 606 600 A 49 ILE H A 49 ILE HB 1.0 1.8 3.50 607 601 A 49 ILE H A 49 ILE HG21 1.0 1.8 4.50 608 602 A 49 ILE H A 49 ILE HD1% 1.0 1.8 6.00 609 603 A 49 ILE H A 78 PHE HD% 1.0 1.8 7.20 610 604 A 49 ILE HB A 78 PHE HD% 1.0 1.8 7.20 611 605 A 50 LYS H A 49 ILE H 1.0 1.8 5.00 612 606 A 50 LYS H A 49 ILE HA 1.0 1.8 2.60 613 607 A 50 LYS H A 49 ILE HB 1.0 1.8 5.00 614 608 A 50 LYS H A 49 ILE HD1% 1.0 1.8 6.00 615 609 A 51 SER H A 50 LYS H 1.0 1.8 5.00 616 610 A 51 SER H A 50 LYS HA 1.0 1.8 2.60 617 611 A 51 SER H A 55 GLY H 1.0 1.8 5.00 618 612 A 51 SER H A 55 GLY HAx 1.0 1.8 5.00 619 613 A 51 SER H A 56 GLN H 1.0 1.8 3.50 620 614 A 52 THR H A 37 LEU HA 1.0 1.8 3.50 621 615 A 51 SER HA A 52 THR H 1.0 1.8 2.60 622 616 A 52 THR H A 52 THR HB 1.0 1.8 3.50 623 617 A 52 THR H A 52 THR HG2% 1.0 1.8 3.60 624 618 A 52 THR H A 53 GLU H 1.0 1.8 3.50 625 619 A 51 SER HA A 53 GLU H 1.0 1.8 5.00 626 620 A 53 GLU H A 52 THR HA 1.0 1.8 3.50 627 621 A 53 GLU H A 52 THR HG2% 1.0 1.8 6.00 628 622 A 53 GLU H A 53 GLU HBx 1.0 1.8 3.50 629 623 A 53 GLU H A 53 GLU HBy 1.0 1.8 3.50 630 624 A 53 GLU H A 54 THR H 1.0 1.8 3.50 631 625 A 53 GLU H A 54 THR HG2% 1.0 1.8 6.00 632 626 A 53 GLU H A 55 GLY H 1.0 1.8 5.00 633 627 A 54 THR H A 53 GLU HBx 1.0 1.8 5.00 634 628 A 54 THR H A 53 GLU HBy 1.0 1.8 5.00 635 629 A 54 THR H A 54 THR HG2% 1.0 1.8 4.50 636 630 A 54 THR H A 55 GLY HAy 1.0 1.8 5.00 637 631 A 55 GLY H A 52 THR HA 1.0 1.8 5.00 638 632 A 54 THR HA A 55 GLY H 1.0 1.8 3.50 639 633 A 55 GLY HAx A 55 GLY H 1.0 1.8 2.60 640 634 A 55 GLY H A 56 GLN H 1.0 1.8 3.50 641 635 A 51 SER HA A 56 GLN H 1.0 1.8 5.00 642 636 A 55 GLY HAx A 56 GLN H 1.0 1.8 3.50 643 637 A 56 GLN H A 55 GLY HAy 1.0 1.8 3.50 644 638 A 56 GLN H A 56 GLN HE2y 1.0 1.8 6.00 645 638 A 56 GLN H A 56 GLN HE2x 1.0 1.8 6.00 646 639 A 57 TYR H A 56 GLN HA 1.0 1.8 2.60 647 640 A 57 TYR H A 57 TYR HBx 1.0 1.8 3.50 648 641 A 57 TYR H A 57 TYR HBy 1.0 1.8 3.50 649 642 A 57 TYR H A 57 TYR HE% 1.0 1.8 7.20 650 643 A 57 TYR H A 69 SER H 1.0 1.8 5.00 651 644 A 58 LEU H A 49 ILE HG21 1.0 1.8 4.50 652 645 A 58 LEU H A 50 LYS HA 1.0 1.8 5.00 653 646 A 58 LEU H A 57 TYR HA 1.0 1.8 2.60 654 647 A 58 LEU H A 57 TYR HBx 1.0 1.8 5.00 655 648 A 58 LEU H A 57 TYR HBy 1.0 1.8 5.00 656 649 A 58 LEU H A 57 TYR HD% 1.0 1.8 7.20 657 650 A 58 LEU H A 58 LEU HBx 1.0 1.8 3.50 658 651 A 58 LEU H A 58 LEU HBy 1.0 1.8 3.50 659 652 A 58 LEU H A 58 LEU HG 1.0 1.8 3.90 660 653 A 58 LEU H A 59 ALA H 1.0 1.8 5.00 661 654 A 59 ALA H A 24 VAL HGx% 1.0 1.8 6.00 662 655 A 59 ALA H A 58 LEU HA 1.0 1.8 2.60 663 656 A 59 ALA H A 58 LEU HBx 1.0 1.8 5.00 664 657 A 59 ALA H A 58 LEU HBy 1.0 1.8 5.00 665 658 A 59 ALA H A 58 LEU HG 1.0 1.8 3.50 666 659 A 59 ALA H A 59 ALA HB% 1.0 1.8 3.60 667 660 A 59 ALA H A 60 MET H 1.0 1.8 5.00 668 661 A 59 ALA H A 66 LEU HA 1.0 1.8 5.00 669 662 A 59 ALA H A 67 TYR H 1.0 1.8 3.50 670 663 A 59 ALA H A 67 TYR HD% 1.0 1.8 7.20 671 664 A 60 MET H A 59 ALA HA 1.0 1.8 2.60 672 665 A 60 MET H A 59 ALA HB% 1.0 1.8 3.60 673 666 A 60 MET H A 60 MET HGx 1.0 1.8 5.00 674 667 A 60 MET H A 60 MET HGy 1.0 1.8 5.00 675 668 A 60 MET H A 61 ASP H 1.0 1.8 5.00 676 669 A 60 MET H A 67 TYR HD% 1.0 1.8 7.20 677 670 A 60 MET H A 67 TYR HE% 1.0 1.8 7.20 678 671 A 60 MET H A 75 GLU HBx 1.0 1.8 5.00 679 672 A 60 MET H A 76 CYS HA 1.0 1.8 3.50 680 673 A 60 MET H A 78 PHE HZ 1.0 1.8 5.00 681 674 A 61 ASP H A 59 ALA HB% 1.0 1.8 6.00 682 675 A 61 ASP H A 60 MET HA 1.0 1.8 2.60 683 676 A 61 ASP H A 61 ASP HBx 1.0 1.8 3.50 684 677 A 61 ASP H A 62 THR H 1.0 1.8 5.00 685 678 A 61 ASP H A 63 ASP H 1.0 1.8 5.00 686 679 A 61 ASP H A 65 LEU H 1.0 1.8 5.00 687 680 A 61 ASP H A 66 LEU HA 1.0 1.8 5.00 688 681 A 61 ASP H A 67 TYR HD% 1.0 1.8 5.70 689 682 A 61 ASP H A 67 TYR HE% 1.0 1.8 5.70 690 683 A 62 THR H A 61 ASP HA 1.0 1.8 3.50 691 684 A 62 THR H A 61 ASP HBy 1.0 1.8 2.60 692 685 A 62 THR H A 61 ASP HBx 1.0 1.8 3.50 693 686 A 62 THR H A 62 THR HB 1.0 1.8 3.50 694 687 A 62 THR H A 62 THR HG2% 1.0 1.8 3.80 695 688 A 62 THR H A 63 ASP H 1.0 1.8 3.50 696 689 A 62 THR H A 64 GLY H 1.0 1.8 5.00 697 690 A 62 THR H A 67 TYR HD% 1.0 1.8 7.20 698 691 A 62 THR H A 67 TYR HE% 1.0 1.8 7.20 699 692 A 63 ASP H A 61 ASP HBy 1.0 1.8 5.00 700 693 A 63 ASP H A 61 ASP HBx 1.0 1.8 5.00 701 694 A 63 ASP H A 62 THR HB 1.0 1.8 5.00 702 695 A 63 ASP H A 62 THR HG2% 1.0 1.8 6.00 703 696 A 63 ASP H A 64 GLY H 1.0 1.8 5.00 704 697 A 63 ASP H A 64 GLY HAx 1.0 1.8 5.00 705 698 A 63 ASP H A 64 GLY HAy 1.0 1.8 5.00 706 699 A 65 LEU H A 63 ASP H 1.0 1.8 3.50 707 700 A 63 ASP H A 100 TRP HZ3 1.0 1.8 5.00 708 701 A 63 ASP H A 100 TRP HH2 1.0 1.8 5.00 709 702 A 64 GLY H A 62 THR HA 1.0 1.8 5.00 710 703 A 64 GLY H A 62 THR HB 1.0 1.8 5.50 711 704 A 64 GLY H A 62 THR HG2% 1.0 1.8 6.00 712 705 A 64 GLY H A 63 ASP HA 1.0 1.8 3.50 713 706 A 64 GLY H A 64 GLY HAx 1.0 1.8 2.60 714 707 A 65 LEU H A 64 GLY H 1.0 1.8 2.60 715 708 A 64 GLY H A 100 TRP HE3 1.0 1.8 5.00 716 709 A 64 GLY H A 100 TRP HZ3 1.0 1.8 3.50 717 710 A 64 GLY H A 100 TRP HH2 1.0 1.8 5.00 718 711 A 64 GLY H A 113 GLY HAy 1.0 1.8 5.00 719 712 A 64 GLY HAx A 100 TRP HZ3 1.0 1.8 5.00 720 713 A 113 GLY H A 64 GLY HAx 1.0 1.8 5.00 721 714 A 113 GLY H A 64 GLY HAy 1.0 1.8 3.50 722 715 A 65 LEU H A 65 LEU HG 1.0 1.8 5.00 723 716 A 65 LEU H A 65 LEU HDx% 1.0 1.8 6.00 724 717 A 65 LEU H A 65 LEU HDy% 1.0 1.8 6.00 725 718 A 65 LEU H A 66 LEU H 1.0 1.8 5.00 726 719 A 65 LEU H A 100 TRP HZ3 1.0 1.8 5.00 727 720 A 66 LEU H A 65 LEU HA 1.0 1.8 2.60 728 721 A 66 LEU H A 65 LEU HG 1.0 1.8 5.00 729 722 A 66 LEU H A 66 LEU HG 1.0 1.8 3.50 730 723 A 67 TYR H A 66 LEU H 1.0 1.8 5.00 731 724 A 67 TYR H A 59 ALA HB% 1.0 1.8 6.00 732 725 A 67 TYR H A 60 MET HA 1.0 1.8 3.50 733 726 A 67 TYR H A 66 LEU HA 1.0 1.8 2.60 734 727 A 67 TYR H A 66 LEU HBy 1.0 1.8 5.00 735 728 A 67 TYR H A 66 LEU HBx 1.0 1.8 5.00 736 729 A 67 TYR H A 66 LEU HG 1.0 1.8 5.00 737 730 A 67 TYR H A 67 TYR HE% 1.0 1.8 7.20 738 731 A 67 TYR H A 68 GLY H 1.0 1.8 5.00 739 732 A 67 TYR HA A 68 GLY H 1.0 1.8 2.60 740 733 A 68 GLY H A 67 TYR HD% 1.0 1.8 7.20 741 734 A 69 SER H A 68 GLY H 1.0 1.8 5.00 742 735 A 69 SER H A 59 ALA HB% 1.0 1.8 4.50 743 736 A 69 SER H A 67 TYR HE% 1.0 1.8 7.20 744 737 A 69 SER H A 69 SER HBx 1.0 1.8 3.50 745 738 A 69 SER H A 69 SER HBy 1.0 1.8 3.50 746 739 A 69 SER HA A 70 GLN H 1.0 1.8 2.60 747 740 A 71 THR H A 70 GLN H 1.0 1.8 5.00 748 741 A 70 GLN H A 71 THR HG1 1.0 1.8 5.00 749 742 A 69 SER HA A 71 THR H 1.0 1.8 5.00 750 743 A 71 THR H A 69 SER HBx 1.0 1.8 5.00 751 744 A 71 THR H A 69 SER HBy 1.0 1.8 5.00 752 745 A 71 THR H A 70 GLN HA 1.0 1.8 3.50 753 746 A 71 THR H A 70 GLN HBx 1.0 1.8 3.50 754 747 A 71 THR H A 70 GLN HBy 1.0 1.8 3.50 755 748 A 71 THR H A 70 GLN HGx 1.0 1.8 5.00 756 749 A 71 THR H A 70 GLN HGy 1.0 1.8 5.00 757 750 A 71 THR H A 71 THR HB 1.0 1.8 3.50 758 751 A 71 THR H A 71 THR HG21 1.0 1.8 4.50 759 752 A 71 THR H A 71 THR HG1 1.0 1.8 3.50 760 753 A 73 ASN H A 48 TYR HE% 1.0 1.8 5.70 761 754 A 72 PRO HA A 73 ASN H 1.0 1.8 2.60 762 755 A 73 ASN H A 75 GLU HBx 1.0 1.8 5.00 763 756 A 73 ASN H A 76 CYS H 1.0 1.8 3.50 764 757 A 73 ASN H A 76 CYS HA 1.0 1.8 5.00 765 758 A 73 ASN H A 76 CYS HBx 1.0 1.8 5.00 766 759 A 73 ASN H A 76 CYS HBy 1.0 1.8 5.00 767 760 A 75 GLU H A 48 TYR HE% 1.0 1.8 7.20 768 761 A 75 GLU H A 74 GLU HA 1.0 1.8 3.50 769 762 A 75 GLU H A 75 GLU HBx 1.0 1.8 2.60 770 763 A 75 GLU H A 75 GLU HGx 1.0 1.8 3.50 771 764 A 75 GLU H A 75 GLU HGy 1.0 1.8 3.50 772 765 A 76 CYS H A 75 GLU H 1.0 1.8 3.50 773 766 A 75 GLU H A 76 CYS HA 1.0 1.8 5.00 774 767 A 75 GLU H A 77 LEU H 1.0 1.8 5.00 775 768 A 76 CYS H A 48 TYR HD% 1.0 1.8 7.20 776 769 A 76 CYS H A 48 TYR HE% 1.0 1.8 7.20 777 770 A 76 CYS H A 59 ALA HA 1.0 1.8 5.00 778 771 A 76 CYS H A 74 GLU HA 1.0 1.8 5.00 779 772 A 76 CYS H A 75 GLU HA 1.0 1.8 3.50 780 773 A 76 CYS H A 75 GLU HBx 1.0 1.8 2.60 781 774 A 76 CYS H A 75 GLU HBy 1.0 1.8 5.00 782 775 A 76 CYS H A 75 GLU HGx 1.0 1.8 5.00 783 776 A 76 CYS H A 75 GLU HGy 1.0 1.8 5.00 784 777 A 76 CYS H A 76 CYS HBx 1.0 1.8 3.50 785 778 A 76 CYS H A 76 CYS HBy 1.0 1.8 3.50 786 779 A 76 CYS H A 77 LEU H 1.0 1.8 2.60 787 780 A 77 LEU H A 48 TYR HE% 1.0 1.8 7.20 788 781 A 77 LEU H A 74 GLU HA 1.0 1.8 5.00 789 782 A 77 LEU H A 75 GLU HBx 1.0 1.8 5.00 790 783 A 77 LEU H A 76 CYS HA 1.0 1.8 3.50 791 784 A 77 LEU H A 76 CYS HBx 1.0 1.8 5.00 792 785 A 77 LEU H A 76 CYS HBy 1.0 1.8 5.00 793 786 A 77 LEU HG A 77 LEU H 1.0 1.8 5.00 794 787 A 77 LEU H A 77 LEU HDx% 1.0 1.8 6.00 795 788 A 77 LEU H A 77 LEU HDy% 1.0 1.8 6.00 796 789 A 77 LEU H A 78 PHE HA 1.0 1.8 5.00 797 790 A 77 LEU H A 78 PHE HE% 1.0 1.8 7.20 798 791 A 46 GLU HA A 78 PHE H 1.0 1.8 5.00 799 792 A 78 PHE H A 47 VAL HGy% 1.0 1.8 4.50 800 793 A 78 PHE H A 47 VAL HGx% 1.0 1.8 6.00 801 794 A 78 PHE H A 77 LEU HA 1.0 1.8 2.60 802 795 A 78 PHE H A 77 LEU HDx% 1.0 1.8 6.00 803 796 A 78 PHE H A 77 LEU HDy% 1.0 1.8 6.00 804 797 A 78 PHE H A 78 PHE HBx 1.0 1.8 3.50 805 798 A 78 PHE H A 78 PHE HE% 1.0 1.8 7.20 806 799 A 78 PHE H A 79 LEU H 1.0 1.8 5.00 807 800 A 78 PHE H A 93 LYS H 1.0 1.8 5.00 808 801 A 46 GLU HA A 79 LEU H 1.0 1.8 5.00 809 802 A 79 LEU H A 78 PHE HA 1.0 1.8 2.60 810 803 A 79 LEU H A 78 PHE HBy 1.0 1.8 5.00 811 804 A 78 PHE HBx A 79 LEU H 1.0 1.8 5.00 812 805 A 79 LEU H A 78 PHE HD% 1.0 1.8 7.20 813 806 A 79 LEU H A 79 LEU HG 1.0 1.8 5.00 814 807 A 80 GLU H A 79 LEU H 1.0 1.8 5.00 815 808 A 79 LEU H A 80 GLU HA 1.0 1.8 5.00 816 809 A 79 LEU H A 90 TYR HD% 1.0 1.8 7.20 817 810 A 79 LEU H A 91 ILE H 1.0 1.8 5.00 818 811 A 79 LEU H A 91 ILE HB 1.0 1.8 5.00 819 812 A 79 LEU H A 91 ILE HG2% 1.0 1.8 6.00 820 813 A 79 LEU H A 91 ILE HD1% 1.0 1.8 6.00 821 814 A 79 LEU H A 92 SER HA 1.0 1.8 5.00 822 815 A 93 LYS H A 79 LEU H 1.0 1.8 5.00 823 816 A 80 GLU H A 45 GLY HAy 1.0 1.8 5.00 824 817 A 80 GLU H A 45 GLY HAx 1.0 1.8 5.00 825 818 A 80 GLU H A 46 GLU HA 1.0 1.8 3.50 826 819 A 80 GLU H A 47 VAL H 1.0 1.8 5.00 827 820 A 80 GLU H A 47 VAL HGy% 1.0 1.8 4.50 828 821 A 80 GLU H A 79 LEU HA 1.0 1.8 2.60 829 822 A 80 GLU H A 79 LEU HG 1.0 1.8 3.50 830 823 A 80 GLU H A 80 GLU HBx 1.0 1.8 3.50 831 824 A 80 GLU H A 80 GLU HBy 1.0 1.8 3.50 832 825 A 80 GLU H A 81 ARG H 1.0 1.8 5.00 833 826 A 80 GLU H A 90 TYR HD% 1.0 1.8 7.20 834 827 A 80 GLU H A 90 TYR HE% 1.0 1.8 7.20 835 828 A 81 ARG H A 80 GLU HA 1.0 1.8 2.60 836 829 A 82 LEU H A 81 ARG H 1.0 1.8 5.00 837 830 A 81 ARG H A 88 ASN HA 1.0 1.8 5.00 838 831 A 81 ARG H A 89 THR H 1.0 1.8 5.00 839 832 A 81 ARG H A 89 THR HA 1.0 1.8 5.50 840 833 A 81 ARG H A 90 TYR HA 1.0 1.8 5.00 841 834 A 81 ARG H A 90 TYR HD% 1.0 1.8 7.20 842 835 A 81 ARG H A 90 TYR HE% 1.0 1.8 7.20 843 836 A 82 LEU H A 81 ARG HA 1.0 1.8 3.50 844 837 A 82 LEU H A 82 LEU HBx 1.0 1.8 3.50 845 838 A 82 LEU H A 82 LEU HBy 1.0 1.8 3.50 846 839 A 82 LEU H A 82 LEU HG 1.0 1.8 3.50 847 840 A 82 LEU H A 83 GLU H 1.0 1.8 5.00 848 841 A 82 LEU HA A 83 GLU H 1.0 1.8 2.60 849 842 A 83 GLU H A 82 LEU HBx 1.0 1.8 5.00 850 843 A 83 GLU H A 82 LEU HBy 1.0 1.8 5.00 851 844 A 83 GLU H A 82 LEU HG 1.0 1.8 5.00 852 845 A 83 GLU H A 83 GLU HBx 1.0 1.8 3.50 853 846 A 83 GLU H A 83 GLU HBy 1.0 1.8 3.50 854 847 A 83 GLU H A 87 TYR H 1.0 1.8 5.00 855 848 A 83 GLU H A 88 ASN HA 1.0 1.8 3.50 856 849 A 83 GLU H A 89 THR HG2% 1.0 1.8 6.00 857 850 A 86 HIS H A 84 GLU HA 1.0 1.8 5.00 858 851 A 86 HIS H A 85 ASN HA 1.0 1.8 2.60 859 852 A 86 HIS H A 86 HIS HA 1.0 1.8 2.60 860 853 A 86 HIS H A 86 HIS HD2 1.0 1.8 5.00 861 854 A 87 TYR H A 86 HIS H 1.0 1.8 3.50 862 855 A 87 TYR H A 86 HIS HA 1.0 1.8 3.50 863 856 A 87 TYR H A 87 TYR HE% 1.0 1.8 7.20 864 857 A 87 TYR H A 88 ASN H 1.0 1.8 5.00 865 858 A 88 ASN H A 87 TYR HA 1.0 1.8 2.60 866 859 A 88 ASN H A 87 TYR HD% 1.0 1.8 5.70 867 860 A 88 ASN H A 88 ASN HBx 1.0 1.8 3.50 868 861 A 88 ASN H A 88 ASN HBy 1.0 1.8 3.50 869 862 A 88 ASN H A 88 ASN HD2y 1.0 1.8 6.00 870 862 A 88 ASN H A 88 ASN HD2x 1.0 1.8 6.00 871 863 A 89 THR H A 88 ASN H 1.0 1.8 5.00 872 864 A 88 ASN H A 90 TYR HE% 1.0 1.8 7.20 873 865 A 88 ASN H A 125 PHE H 1.0 1.8 5.00 874 866 A 88 ASN H A 125 PHE HA 1.0 1.8 5.00 875 867 A 125 PHE HBx A 88 ASN H 1.0 1.8 5.00 876 868 A 88 ASN H A 125 PHE HBy 1.0 1.8 5.00 877 869 A 88 ASN H A 126 LEU HA 1.0 1.8 5.00 878 870 A 82 LEU HA A 89 THR H 1.0 1.8 5.00 879 871 A 89 THR H A 88 ASN HA 1.0 1.8 2.60 880 872 A 89 THR H A 88 ASN HBx 1.0 1.8 3.50 881 873 A 89 THR H A 88 ASN HBy 1.0 1.8 2.60 882 874 A 89 THR H A 88 ASN HD2y 1.0 1.8 6.00 883 874 A 89 THR H A 88 ASN HD2x 1.0 1.8 6.00 884 875 A 89 THR H A 89 THR HG2% 1.0 1.8 4.50 885 876 A 89 THR H A 90 TYR HD% 1.0 1.8 7.20 886 877 A 89 THR H A 90 TYR HE% 1.0 1.8 7.20 887 878 A 90 TYR H A 89 THR HA 1.0 1.8 2.60 888 879 A 89 THR HB A 90 TYR H 1.0 1.8 3.50 889 880 A 90 TYR H A 89 THR HG2% 1.0 1.8 6.00 890 881 A 90 TYR H A 91 ILE H 1.0 1.8 5.00 891 882 A 90 TYR H A 101 PHE HD% 1.0 1.8 7.20 892 883 A 90 TYR H A 101 PHE HE% 1.0 1.8 7.20 893 884 A 78 PHE HBx A 91 ILE H 1.0 1.8 5.00 894 885 A 91 ILE H A 78 PHE HD% 1.0 1.8 7.20 895 886 A 91 ILE H A 90 TYR HA 1.0 1.8 2.60 896 887 A 91 ILE H A 90 TYR HD% 1.0 1.8 7.20 897 888 A 91 ILE H A 91 ILE HB 1.0 1.8 2.60 898 889 A 91 ILE H A 91 ILE HG1y 1.0 1.8 3.50 899 890 A 91 ILE H A 91 ILE HG1x 1.0 1.8 5.00 900 891 A 91 ILE H A 91 ILE HD1% 1.0 1.8 4.50 901 892 A 91 ILE H A 92 SER H 1.0 1.8 5.00 902 893 A 92 SER H A 78 PHE HD% 1.0 1.8 7.20 903 894 A 92 SER H A 78 PHE HE% 1.0 1.8 7.20 904 895 A 91 ILE HA A 92 SER H 1.0 1.8 2.60 905 896 A 92 SER H A 91 ILE HB 1.0 1.8 5.00 906 897 A 92 SER H A 91 ILE HG1y 1.0 1.8 5.00 907 898 A 92 SER H A 91 ILE HG1x 1.0 1.8 5.00 908 899 A 92 SER H A 91 ILE HG2% 1.0 1.8 4.50 909 900 A 93 LYS H A 92 SER H 1.0 1.8 5.00 910 901 A 92 SER H A 100 TRP HBx 1.0 1.8 5.00 911 902 A 92 SER H A 101 PHE HA 1.0 1.8 3.50 912 903 A 93 LYS H A 78 PHE HA 1.0 1.8 3.50 913 904 A 93 LYS H A 78 PHE HD% 1.0 1.8 7.20 914 905 A 93 LYS H A 78 PHE HE% 1.0 1.8 7.20 915 906 A 93 LYS H A 92 SER HA 1.0 1.8 2.60 916 907 A 93 LYS H A 94 LYS H 1.0 1.8 5.00 917 908 A 94 LYS H A 92 SER HA 1.0 1.8 5.00 918 909 A 94 LYS HGx A 94 LYS H 1.0 1.8 5.00 919 910 A 94 LYS H A 94 LYS HGy 1.0 1.8 5.00 920 911 A 94 LYS H A 95 HIS H 1.0 1.8 3.50 921 912 A 94 LYS H A 95 HIS HA 1.0 1.8 5.00 922 913 A 95 HIS H A 92 SER HA 1.0 1.8 5.00 923 914 A 95 HIS H A 94 LYS HA 1.0 1.8 3.50 924 915 A 94 LYS HGx A 95 HIS H 1.0 1.8 5.00 925 916 A 95 HIS H A 94 LYS HGy 1.0 1.8 5.00 926 917 A 95 HIS H A 95 HIS HE1 1.0 1.8 5.00 927 918 A 96 ALA H A 95 HIS H 1.0 1.8 3.50 928 919 A 96 ALA H A 95 HIS HA 1.0 1.8 2.60 929 920 A 96 ALA H A 97 GLU H 1.0 1.8 5.00 930 921 A 97 GLU H A 95 HIS HA 1.0 1.8 5.00 931 922 A 97 GLU H A 97 GLU HGx 1.0 1.8 5.00 932 923 A 97 GLU H A 97 GLU HGy 1.0 1.8 5.00 933 924 A 97 GLU H A 98 LYS H 1.0 1.8 3.50 934 925 A 97 GLU H A 99 ASN H 1.0 1.8 5.00 935 926 A 98 LYS H A 95 HIS HA 1.0 1.8 5.00 936 927 A 98 LYS H A 97 GLU HA 1.0 1.8 3.50 937 928 A 98 LYS H A 97 GLU HGx 1.0 1.8 5.00 938 929 A 98 LYS H A 97 GLU HGy 1.0 1.8 5.00 939 930 A 98 LYS H A 98 LYS HBy 1.0 1.8 3.50 940 931 A 98 LYS HBx A 98 LYS H 1.0 1.8 2.60 941 932 A 98 LYS H A 98 LYS HEx 1.0 1.8 5.00 942 933 A 98 LYS H A 98 LYS HEy 1.0 1.8 5.00 943 934 A 98 LYS H A 99 ASN HA 1.0 1.8 5.00 944 935 A 99 ASN H A 98 LYS H 1.0 1.8 2.60 945 936 A 99 ASN H A 91 ILE HG2% 1.0 1.8 6.00 946 937 A 99 ASN H A 96 ALA HA 1.0 1.8 5.00 947 938 A 99 ASN H A 97 GLU HA 1.0 1.8 5.00 948 939 A 99 ASN H A 98 LYS HBy 1.0 1.8 5.00 949 940 A 99 ASN H A 98 LYS HBx 1.0 1.8 3.50 950 941 A 99 ASN H A 99 ASN HA 1.0 1.8 2.60 951 942 A 99 ASN H A 99 ASN HD2x 1.0 1.8 6.00 952 942 A 99 ASN H A 99 ASN HD2y 1.0 1.8 6.00 953 943 A 99 ASN H A 100 TRP H 1.0 1.8 3.50 954 944 A 100 TRP H A 91 ILE HG2% 1.0 1.8 6.00 955 945 A 100 TRP H A 98 LYS HBy 1.0 1.8 5.00 956 946 A 98 LYS HBx A 100 TRP H 1.0 1.8 5.00 957 947 A 100 TRP H A 99 ASN HA 1.0 1.8 3.50 958 948 A 100 TRP H A 100 TRP HBx 1.0 1.8 2.60 959 949 A 100 TRP H A 100 TRP HBy 1.0 1.8 3.50 960 950 A 100 TRP H A 100 TRP HD1 1.0 1.8 5.00 961 951 A 100 TRP H A 100 TRP HE3 1.0 1.8 5.00 962 952 A 101 PHE H A 100 TRP HA 1.0 1.8 2.60 963 953 A 101 PHE H A 100 TRP HBx 1.0 1.8 5.00 964 954 A 101 PHE H A 100 TRP HBy 1.0 1.8 5.00 965 955 A 101 PHE H A 100 TRP HD1 1.0 1.8 5.00 966 956 A 101 PHE H A 101 PHE HE% 1.0 1.8 7.20 967 957 A 101 PHE H A 102 VAL H 1.0 1.8 5.00 968 958 A 101 PHE H A 113 GLY HAx 1.0 1.8 5.00 969 959 A 101 PHE H A 116 THR HG1 1.0 1.8 3.50 970 960 A 101 PHE H A 116 THR HG2% 1.0 1.8 6.00 971 961 A 101 PHE H A 123 ILE HG2% 1.0 1.8 6.00 972 962 A 102 VAL H A 90 TYR HD% 1.0 1.8 7.20 973 963 A 91 ILE HA A 102 VAL H 1.0 1.8 5.00 974 964 A 102 VAL H A 101 PHE HA 1.0 1.8 2.60 975 965 A 102 VAL H A 101 PHE HBx 1.0 1.8 5.00 976 966 A 102 VAL H A 101 PHE HBy 1.0 1.8 5.00 977 967 A 102 VAL H A 101 PHE HD% 1.0 1.8 7.20 978 968 A 102 VAL H A 102 VAL HB 1.0 1.8 3.50 979 969 A 103 GLY H A 66 LEU HDx% 1.0 1.8 6.00 980 970 A 103 GLY H A 66 LEU HDy% 1.0 1.8 6.00 981 971 A 103 GLY H A 102 VAL HA 1.0 1.8 2.60 982 972 A 103 GLY H A 104 LEU H 1.0 1.8 5.00 983 973 A 103 GLY H A 116 THR HG2% 1.0 1.8 4.50 984 974 A 104 LEU H A 103 GLY HAy 1.0 1.8 2.60 985 975 A 104 LEU H A 103 GLY HAx 1.0 1.8 2.60 986 976 A 104 LEU H A 104 LEU HG 1.0 1.8 3.50 987 977 A 104 LEU H A 122 ALA HB% 1.0 1.8 4.50 988 978 A 104 LEU H A 125 PHE HE% 1.0 1.8 7.20 989 979 A 104 LEU H A 125 PHE HZ 1.0 1.8 5.00 990 980 A 105 LYS H A 104 LEU HA 1.0 1.8 2.60 991 981 A 105 LYS H A 110 CYS HA 1.0 1.8 3.50 992 982 A 105 LYS H A 111 LYS H 1.0 1.8 5.00 993 983 A 106 LYS H A 105 LYS HA 1.0 1.8 2.60 994 984 A 107 ASN H A 106 LYS H 1.0 1.8 5.00 995 985 A 106 LYS H A 108 GLY H 1.0 1.8 5.00 996 986 A 107 ASN H A 105 LYS HA 1.0 1.8 5.00 997 987 A 107 ASN H A 108 GLY H 1.0 1.8 2.70 998 988 A 108 GLY H A 106 LYS HA 1.0 1.8 3.90 999 989 A 107 ASN HA A 108 GLY H 1.0 1.8 3.50 1000 990 A 108 GLY H A 109 SER H 1.0 1.8 3.50 1001 991 A 25 ASP HA A 110 CYS H 1.0 1.8 5.00 1002 992 A 110 CYS H A 109 SER HA 1.0 1.8 2.60 1003 993 A 110 CYS H A 111 LYS H 1.0 1.8 5.00 1004 994 A 111 LYS H A 104 LEU HA 1.0 1.8 3.50 1005 995 A 111 LYS H A 110 CYS HA 1.0 1.8 2.60 1006 996 A 111 LYS H A 116 THR HG2% 1.0 1.8 6.00 1007 997 A 112 ARG H A 111 LYS HA 1.0 1.8 2.60 1008 998 A 112 ARG H A 116 THR HG2% 1.0 1.8 6.00 1009 999 A 112 ARG HA A 113 GLY H 1.0 1.8 2.60 1010 1000 A 113 GLY H A 113 GLY HAy 1.0 1.8 2.60 1011 1001 A 113 GLY H A 116 THR HG2% 1.0 1.8 6.00 1012 1002 A 115 ARG H A 113 GLY HAy 1.0 1.8 5.00 1013 1003 A 116 THR H A 115 ARG H 1.0 1.8 2.60 1014 1004 A 115 ARG H A 116 THR HG2% 1.0 1.8 4.50 1015 1005 A 115 ARG H A 116 THR HG1 1.0 1.8 5.00 1016 1006 A 116 THR H A 114 PRO HA 1.0 1.8 5.00 1017 1007 A 116 THR H A 115 ARG HA 1.0 1.8 3.50 1018 1008 A 116 THR H A 115 ARG HBx 1.0 1.8 5.00 1019 1009 A 116 THR H A 115 ARG HBy 1.0 1.8 5.00 1020 1010 A 116 THR H A 115 ARG HDx 1.0 1.8 5.00 1021 1011 A 116 THR H A 115 ARG HDy 1.0 1.8 5.00 1022 1012 A 116 THR H A 116 THR HB 1.0 1.8 3.50 1023 1013 A 116 THR H A 116 THR HG2% 1.0 1.8 3.60 1024 1014 A 116 THR H A 116 THR HG1 1.0 1.8 3.50 1025 1015 A 117 HIS H A 116 THR HA 1.0 1.8 3.50 1026 1016 A 117 HIS H A 116 THR HB 1.0 1.8 3.50 1027 1017 A 117 HIS H A 116 THR HG2% 1.0 1.8 4.50 1028 1018 A 117 HIS H A 123 ILE HG2% 1.0 1.8 4.50 1029 1019 A 117 HIS H A 123 ILE HD1% 1.0 1.8 6.00 1030 1020 A 118 TYR H A 101 PHE HZ 1.0 1.8 5.00 1031 1021 A 118 TYR H A 101 PHE HE% 1.0 1.8 7.20 1032 1022 A 118 TYR H A 119 GLY H 1.0 1.8 5.00 1033 1023 A 118 TYR H A 123 ILE HD1% 1.0 1.8 6.00 1034 1024 A 119 GLY H A 118 TYR HA 1.0 1.8 2.60 1035 1025 A 119 GLY H A 118 TYR HD% 1.0 1.8 6.00 1036 1026 A 119 GLY H A 120 GLN H 1.0 1.8 3.50 1037 1027 A 119 GLY H A 123 ILE HD1% 1.0 1.8 4.50 1038 1028 A 120 GLN H A 122 ALA HB% 1.0 1.8 6.00 1039 1029 A 120 GLN H A 123 ILE HG2% 1.0 1.8 6.00 1040 1030 A 120 GLN H A 123 ILE HD1% 1.0 1.8 6.00 1041 1031 A 122 ALA H A 122 ALA HB% 1.0 1.8 3.50 1042 1032 A 123 ILE H A 122 ALA H 1.0 1.8 3.50 1043 1033 A 122 ALA H A 123 ILE HG2% 1.0 1.8 6.00 1044 1034 A 121 LYS HA A 123 ILE H 1.0 1.8 5.00 1045 1035 A 123 ILE H A 123 ILE HG1x 1.0 1.8 5.00 1046 1036 A 123 ILE H A 123 ILE HG1y 1.0 1.8 5.00 1047 1037 A 123 ILE H A 123 ILE HG2% 1.0 1.8 4.50 1048 1038 A 123 ILE H A 123 ILE HD1% 1.0 1.8 6.00 1049 1039 A 123 ILE H A 124 LEU H 1.0 1.8 3.50 1050 1040 A 121 LYS HA A 124 LEU H 1.0 1.8 3.50 1051 1041 A 124 LEU H A 123 ILE HG2% 1.0 1.8 6.00 1052 1042 A 125 PHE H A 124 LEU H 1.0 1.8 5.00 1053 1043 A 125 PHE H A 88 ASN HBx 1.0 1.8 5.00 1054 1044 A 125 PHE H A 89 THR HG2% 1.0 1.8 4.50 1055 1045 A 125 PHE H A 124 LEU HA 1.0 1.8 2.60 1056 1046 A 125 PHE HBx A 125 PHE H 1.0 1.8 3.50 1057 1047 A 125 PHE H A 125 PHE HE% 1.0 1.8 7.20 1058 1048 A 126 LEU H A 125 PHE H 1.0 1.8 5.00 1059 1049 A 126 LEU H A 7 LEU HA 1.0 1.8 5.00 1060 1050 A 126 LEU H A 8 TYR HBx 1.0 1.8 5.00 1061 1051 A 126 LEU H A 8 TYR HBy 1.0 1.8 5.00 1062 1052 A 126 LEU H A 8 TYR HD% 1.0 1.8 7.20 1063 1053 A 126 LEU H A 9 CYS HA 1.0 1.8 5.00 1064 1054 A 126 LEU H A 125 PHE HA 1.0 1.8 2.60 1065 1055 A 126 LEU H A 125 PHE HBx 1.0 1.8 5.00 1066 1056 A 126 LEU H A 125 PHE HBy 1.0 1.8 5.00 1067 1057 A 126 LEU H A 125 PHE HD% 1.0 1.8 7.20 1068 1058 A 126 LEU H A 126 LEU HBx 1.0 1.8 3.50 1069 1059 A 126 LEU H A 126 LEU HBy 1.0 1.8 3.50 1070 1060 A 126 LEU H A 126 LEU HG 1.0 1.8 5.00 1071 1061 A 128 LEU H A 127 PRO HA 1.0 1.8 2.60 1072 1062 A 128 LEU H A 128 LEU HG 1.0 1.8 3.50 1073 1063 A 130 VAL H A 5 LYS HA 1.0 1.8 3.50 1074 1064 A 130 VAL H A 129 PRO HA 1.0 1.8 2.60 1075 1065 A 130 VAL H A 130 VAL HB 1.0 1.8 3.50 1076 1066 A 130 VAL H A 131 SER H 1.0 1.8 5.00 1077 1067 A 131 SER H A 130 VAL HB 1.0 1.8 3.50 1078 1068 A 132 SER H A 131 SER HA 1.0 1.8 2.60 1079 1069 A 133 ASP H A 132 SER HA 1.0 1.8 2.60 1080 1070 A 133 ASP H A 132 SER HBx 1.0 1.8 5.00 1081 1071 A 133 ASP H A 132 SER HBy 1.0 1.8 5.00 1082 1072 A 133 ASP H A 133 ASP HBx 1.0 1.8 3.50 1083 1073 A 133 ASP H A 133 ASP HBy 1.0 1.8 3.50 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _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 3 LYS H A 4 PRO HDx 1.0 1.8 5.88 2 1 A 3 LYS H A 4 PRO HDy 1.0 1.8 5.88 3 2 A 5 LYS H A 5 LYS HBx 1.0 1.8 3.38 4 2 A 5 LYS H A 5 LYS HBy 1.0 1.8 3.38 5 3 A 6 LEU H A 5 LYS HBx 1.0 1.8 3.48 6 3 A 6 LEU H A 5 LYS HBy 1.0 1.8 3.48 7 4 A 128 LEU H A 5 LYS HBx 1.0 1.8 5.88 8 4 A 128 LEU H A 5 LYS HBy 1.0 1.8 5.88 9 5 A 6 LEU H A 6 LEU HDx% 1.0 1.8 3.76 10 5 A 6 LEU H A 6 LEU HDy% 1.0 1.8 3.76 11 6 A 7 LEU H A 6 LEU HBy 1.0 1.8 4.23 12 6 A 7 LEU H A 6 LEU HBx 1.0 1.8 4.23 13 7 A 128 LEU H A 6 LEU HBy 1.0 1.8 4.38 14 7 A 128 LEU H A 6 LEU HBx 1.0 1.8 4.38 15 8 A 7 LEU H A 6 LEU HDx% 1.0 1.8 6.07 16 8 A 7 LEU H A 6 LEU HDy% 1.0 1.8 6.07 17 9 A 7 LEU H A 7 LEU HDx% 1.0 1.8 5.07 18 9 A 7 LEU H A 7 LEU HDy% 1.0 1.8 5.07 19 10 A 8 TYR H A 7 LEU HDx% 1.0 1.8 6.07 20 10 A 8 TYR H A 7 LEU HDy% 1.0 1.8 6.07 21 11 A 9 CYS H A 9 CYS HBx 1.0 1.8 3.77 22 11 A 9 CYS H A 9 CYS HBy 1.0 1.8 3.77 23 12 A 10 SER H A 9 CYS HBx 1.0 1.8 5.88 24 12 A 10 SER H A 9 CYS HBy 1.0 1.8 5.88 25 13 A 11 ASN H A 121 LYS HBx 1.0 1.8 5.88 26 13 A 11 ASN H A 121 LYS HBy 1.0 1.8 5.88 27 14 A 14 HIS H A 12 GLY HAx 1.0 1.8 5.88 28 14 A 14 HIS H A 12 GLY HAy 1.0 1.8 5.88 29 15 A 13 GLY H A 13 GLY HAx 1.0 1.8 2.64 30 15 A 13 GLY H A 13 GLY HAy 1.0 1.8 2.64 31 16 A 14 HIS H A 13 GLY HAx 1.0 1.8 2.96 32 16 A 14 HIS H A 13 GLY HAy 1.0 1.8 2.96 33 17 A 14 HIS H A 28 ARG HBx 1.0 1.8 5.88 34 17 A 14 HIS H A 28 ARG HBy 1.0 1.8 5.88 35 18 A 14 HIS H A 104 LEU HDx% 1.0 1.8 7.57 36 18 A 14 HIS H A 104 LEU HDy% 1.0 1.8 7.57 37 19 A 15 PHE H A 14 HIS HBy 1.0 1.8 4.23 38 19 A 15 PHE H A 14 HIS HBx 1.0 1.8 4.23 39 20 A 27 THR H A 14 HIS HBy 1.0 1.8 3.48 40 20 A 27 THR H A 14 HIS HBx 1.0 1.8 3.48 41 21 A 18 ILE H A 17 ARG HGy 1.0 1.8 4.23 42 21 A 18 ILE H A 17 ARG HGx 1.0 1.8 4.23 43 22 A 35 ILE H A 17 ARG HGy 1.0 1.8 5.88 44 22 A 35 ILE H A 17 ARG HGx 1.0 1.8 5.88 45 23 A 18 ILE H A 34 HIS HBy 1.0 1.8 5.88 46 23 A 18 ILE H A 34 HIS HBx 1.0 1.8 5.88 47 24 A 19 LEU H A 19 LEU HD11 1.0 1.8 5.17 48 24 A 19 LEU H A 19 LEU HD21 1.0 1.8 5.17 49 25 A 19 LEU H A 20 PRO HDx 1.0 1.8 5.88 50 25 A 19 LEU H A 20 PRO HDy 1.0 1.8 5.88 51 26 A 21 ASP H A 20 PRO HGx 1.0 1.8 5.37 52 26 A 21 ASP H A 20 PRO HGy 1.0 1.8 5.37 53 27 A 21 ASP H A 20 PRO HDx 1.0 1.8 5.35 54 27 A 21 ASP H A 20 PRO HDy 1.0 1.8 5.35 55 28 A 21 ASP H A 21 ASP HBy 1.0 1.8 2.96 56 28 A 21 ASP H A 21 ASP HBx 1.0 1.8 2.96 57 29 A 21 ASP H A 22 GLY HAy 1.0 1.8 5.88 58 29 A 21 ASP H A 22 GLY HAx 1.0 1.8 5.88 59 30 A 22 GLY H A 22 GLY HAy 1.0 1.8 2.64 60 30 A 22 GLY H A 22 GLY HAx 1.0 1.8 2.64 61 31 A 26 GLY H A 25 ASP HBy 1.0 1.8 2.96 62 31 A 26 GLY H A 25 ASP HBx 1.0 1.8 2.96 63 32 A 110 CYS H A 25 ASP HBy 1.0 1.8 5.88 64 32 A 110 CYS H A 25 ASP HBx 1.0 1.8 5.88 65 33 A 28 ARG H A 28 ARG HBx 1.0 1.8 3.77 66 33 A 28 ARG H A 28 ARG HBy 1.0 1.8 3.77 67 34 A 29 ASP H A 28 ARG HBx 1.0 1.8 3.48 68 34 A 29 ASP H A 28 ARG HBy 1.0 1.8 3.48 69 35 A 29 ASP H A 29 ASP HBy 1.0 1.8 2.72 70 35 A 29 ASP H A 29 ASP HBx 1.0 1.8 2.72 71 36 A 30 ARG H A 30 ARG HBx 1.0 1.8 3.38 72 36 A 30 ARG H A 30 ARG HBy 1.0 1.8 3.38 73 37 A 30 ARG H A 30 ARG HGx 1.0 1.8 4.38 74 37 A 30 ARG H A 30 ARG HGy 1.0 1.8 4.38 75 38 A 30 ARG H A 30 ARG HDy 1.0 1.8 5.88 76 38 A 30 ARG H A 30 ARG HDx 1.0 1.8 5.88 77 39 A 31 SER H A 30 ARG HBx 1.0 1.8 4.38 78 39 A 31 SER H A 30 ARG HBy 1.0 1.8 4.38 79 40 A 31 SER H A 30 ARG HGx 1.0 1.8 5.88 80 40 A 31 SER H A 30 ARG HGy 1.0 1.8 5.88 81 41 A 31 SER H A 31 SER HBy 1.0 1.8 2.96 82 41 A 31 SER H A 31 SER HBx 1.0 1.8 2.96 83 42 A 32 ASP H A 32 ASP HBy 1.0 1.8 2.96 84 42 A 32 ASP H A 32 ASP HBx 1.0 1.8 2.96 85 43 A 33 GLN H A 33 GLN HBx 1.0 1.8 3.77 86 43 A 33 GLN H A 33 GLN HBy 1.0 1.8 3.77 87 44 A 33 GLN H A 33 GLN HGx 1.0 1.8 3.48 88 44 A 33 GLN H A 33 GLN HGy 1.0 1.8 3.48 89 45 A 34 HIS H A 33 GLN HGx 1.0 1.8 5.88 90 45 A 34 HIS H A 33 GLN HGy 1.0 1.8 5.88 91 46 A 35 ILE H A 35 ILE HG1x 1.0 1.8 4.38 92 46 A 35 ILE H A 35 ILE HG1y 1.0 1.8 4.38 93 47 A 35 ILE H A 36 GLN HBx 1.0 1.8 5.88 94 47 A 35 ILE H A 36 GLN HBy 1.0 1.8 5.88 95 48 A 36 GLN H A 35 ILE HG1x 1.0 1.8 5.88 96 48 A 36 GLN H A 35 ILE HG1y 1.0 1.8 5.88 97 49 A 36 GLN H A 36 GLN HBx 1.0 1.8 3.38 98 49 A 36 GLN H A 36 GLN HBy 1.0 1.8 3.38 99 50 A 37 LEU H A 37 LEU HBy 1.0 1.8 3.76 100 50 A 37 LEU H A 37 LEU HBx 1.0 1.8 3.76 101 51 A 37 LEU H A 37 LEU HDx% 1.0 1.8 4.69 102 51 A 37 LEU H A 37 LEU HDy% 1.0 1.8 4.69 103 52 A 38 GLN H A 37 LEU HDx% 1.0 1.8 6.07 104 52 A 38 GLN H A 37 LEU HDy% 1.0 1.8 6.07 105 53 A 38 GLN H A 38 GLN HGx 1.0 1.8 5.88 106 53 A 38 GLN H A 38 GLN HGy 1.0 1.8 5.88 107 54 A 39 LEU H A 39 LEU HBy 1.0 1.8 2.96 108 54 A 39 LEU H A 39 LEU HBx 1.0 1.8 2.96 109 55 A 39 LEU H A 39 LEU HDx% 1.0 1.8 6.07 110 55 A 39 LEU H A 39 LEU HDy% 1.0 1.8 6.07 111 56 A 40 SER H A 39 LEU HDx% 1.0 1.8 5.07 112 56 A 40 SER H A 39 LEU HDy% 1.0 1.8 5.07 113 57 A 50 LYS H A 39 LEU HDx% 1.0 1.8 7.57 114 57 A 50 LYS H A 39 LEU HDy% 1.0 1.8 7.57 115 58 A 42 GLU H A 42 GLU HGy 1.0 1.8 5.88 116 58 A 42 GLU H A 42 GLU HGx 1.0 1.8 5.88 117 59 A 43 SER H A 42 GLU HBy 1.0 1.8 4.23 118 59 A 43 SER H A 42 GLU HBx 1.0 1.8 4.23 119 60 A 43 SER H A 42 GLU HGy 1.0 1.8 4.23 120 60 A 43 SER H A 42 GLU HGx 1.0 1.8 4.23 121 61 A 43 SER H A 44 VAL HGx% 1.0 1.8 7.56 122 61 A 43 SER H A 44 VAL HGy% 1.0 1.8 7.56 123 62 A 43 SER H A 77 LEU HDx% 1.0 1.8 7.57 124 62 A 43 SER H A 77 LEU HDy% 1.0 1.8 7.57 125 63 A 44 VAL H A 44 VAL HGx% 1.0 1.8 4.01 126 63 A 44 VAL H A 44 VAL HGy% 1.0 1.8 4.01 127 64 A 45 GLY H A 44 VAL HGx% 1.0 1.8 5.07 128 64 A 45 GLY H A 44 VAL HGy% 1.0 1.8 5.07 129 65 A 46 GLU H A 44 VAL HGx% 1.0 1.8 7.56 130 65 A 46 GLU H A 44 VAL HGy% 1.0 1.8 7.56 131 66 A 49 ILE H A 49 ILE HG1x 1.0 1.8 5.88 132 66 A 49 ILE H A 49 ILE HG1y 1.0 1.8 5.88 133 67 A 50 LYS H A 50 LYS HBx 1.0 1.8 3.38 134 67 A 50 LYS H A 50 LYS HBy 1.0 1.8 3.38 135 68 A 50 LYS H A 50 LYS HGx 1.0 1.8 5.88 136 68 A 50 LYS H A 50 LYS HGy 1.0 1.8 5.88 137 69 A 51 SER H A 50 LYS HGx 1.0 1.8 5.88 138 69 A 51 SER H A 50 LYS HGy 1.0 1.8 5.88 139 70 A 51 SER H A 51 SER HBx 1.0 1.8 3.38 140 70 A 51 SER H A 51 SER HBy 1.0 1.8 3.38 141 71 A 55 GLY H A 51 SER HBx 1.0 1.8 4.38 142 71 A 55 GLY H A 51 SER HBy 1.0 1.8 4.38 143 72 A 56 GLN H A 51 SER HBx 1.0 1.8 3.48 144 72 A 56 GLN H A 51 SER HBy 1.0 1.8 3.48 145 73 A 53 GLU H A 53 GLU HBy 1.0 1.8 2.96 146 73 A 53 GLU H A 53 GLU HBx 1.0 1.8 2.96 147 74 A 54 THR H A 53 GLU HBy 1.0 1.8 4.23 148 74 A 54 THR H A 53 GLU HBx 1.0 1.8 4.23 149 75 A 56 GLN H A 56 GLN HBx 1.0 1.8 3.38 150 75 A 56 GLN H A 56 GLN HBy 1.0 1.8 3.38 151 76 A 56 GLN H A 56 GLN HGx 1.0 1.8 4.38 152 76 A 56 GLN H A 56 GLN HGy 1.0 1.8 4.38 153 77 A 69 SER H A 57 TYR HBy 1.0 1.8 3.48 154 77 A 69 SER H A 57 TYR HBx 1.0 1.8 3.48 155 78 A 58 LEU H A 58 LEU HDx% 1.0 1.8 7.57 156 78 A 58 LEU H A 58 LEU HD21 1.0 1.8 7.57 157 79 A 59 ALA H A 58 LEU HBy 1.0 1.8 4.23 158 79 A 59 ALA H A 58 LEU HBx 1.0 1.8 4.23 159 80 A 59 ALA H A 58 LEU HDx% 1.0 1.8 7.57 160 80 A 59 ALA H A 58 LEU HD21 1.0 1.8 7.57 161 81 A 60 MET H A 60 MET HBy 1.0 1.8 3.76 162 81 A 60 MET H A 60 MET HBx 1.0 1.8 3.76 163 82 A 60 MET H A 60 MET HGy 1.0 1.8 4.23 164 82 A 60 MET H A 60 MET HGx 1.0 1.8 4.23 165 83 A 61 ASP H A 60 MET HGy 1.0 1.8 4.38 166 83 A 61 ASP H A 60 MET HGx 1.0 1.8 4.38 167 84 A 61 ASP H A 65 LEU HBy 1.0 1.8 5.88 168 84 A 61 ASP H A 65 LEU HBx 1.0 1.8 5.88 169 85 A 61 ASP H A 67 TYR HBx 1.0 1.8 5.88 170 85 A 61 ASP H A 67 TYR HBy 1.0 1.8 5.88 171 86 A 63 ASP H A 63 ASP HBx 1.0 1.8 3.38 172 86 A 63 ASP H A 63 ASP HBy 1.0 1.8 3.38 173 87 A 63 ASP H A 65 LEU HBy 1.0 1.8 5.88 174 87 A 63 ASP H A 65 LEU HBx 1.0 1.8 5.88 175 88 A 64 GLY H A 63 ASP HBx 1.0 1.8 4.38 176 88 A 64 GLY H A 63 ASP HBy 1.0 1.8 4.38 177 89 A 65 LEU H A 63 ASP HBx 1.0 1.8 5.88 178 89 A 65 LEU H A 63 ASP HBy 1.0 1.8 5.88 179 90 A 65 LEU H A 65 LEU HBy 1.0 1.8 2.96 180 90 A 65 LEU H A 65 LEU HBx 1.0 1.8 2.96 181 91 A 66 LEU H A 65 LEU HDx% 1.0 1.8 7.57 182 91 A 66 LEU H A 65 LEU HDy% 1.0 1.8 7.57 183 92 A 66 LEU H A 66 LEU HBx 1.0 1.8 3.76 184 92 A 66 LEU H A 66 LEU HBy 1.0 1.8 3.76 185 93 A 66 LEU H A 66 LEU HDx% 1.0 1.8 5.17 186 93 A 66 LEU H A 66 LEU HDy% 1.0 1.8 5.17 187 94 A 67 TYR H A 66 LEU HBx 1.0 1.8 4.23 188 94 A 67 TYR H A 66 LEU HBy 1.0 1.8 4.23 189 95 A 67 TYR H A 66 LEU HDx% 1.0 1.8 5.17 190 95 A 67 TYR H A 66 LEU HDy% 1.0 1.8 5.17 191 96 A 67 TYR H A 67 TYR HBx 1.0 1.8 3.75 192 96 A 67 TYR H A 67 TYR HBy 1.0 1.8 3.75 193 97 A 68 GLY H A 67 TYR HBx 1.0 1.8 4.38 194 97 A 68 GLY H A 67 TYR HBy 1.0 1.8 4.38 195 98 A 68 GLY H A 68 GLY HAy 1.0 1.8 2.64 196 98 A 68 GLY H A 68 GLY HAx 1.0 1.8 2.64 197 99 A 69 SER H A 68 GLY HAy 1.0 1.8 3.04 198 99 A 69 SER H A 68 GLY HAx 1.0 1.8 3.04 199 100 A 73 ASN H A 73 ASN HBx 1.0 1.8 3.77 200 100 A 73 ASN H A 73 ASN HBy 1.0 1.8 3.77 201 101 A 73 ASN H A 76 CYS HBy 1.0 1.8 4.23 202 101 A 73 ASN H A 76 CYS HBx 1.0 1.8 4.23 203 102 A 74 GLU H A 74 GLU HBy 1.0 1.8 3.77 204 102 A 74 GLU H A 74 GLU HBx 1.0 1.8 3.77 205 103 A 74 GLU H A 74 GLU HGx 1.0 1.8 5.88 206 103 A 74 GLU H A 74 GLU HGy 1.0 1.8 5.88 207 104 A 75 GLU H A 74 GLU HBy 1.0 1.8 4.38 208 104 A 75 GLU H A 74 GLU HBx 1.0 1.8 4.38 209 105 A 75 GLU H A 75 GLU HGy 1.0 1.8 2.96 210 105 A 75 GLU H A 75 GLU HGx 1.0 1.8 2.96 211 106 A 75 GLU H A 76 CYS HBy 1.0 1.8 5.88 212 106 A 75 GLU H A 76 CYS HBx 1.0 1.8 5.88 213 107 A 75 GLU H A 77 LEU HBy 1.0 1.8 5.88 214 107 A 75 GLU H A 77 LEU HBx 1.0 1.8 5.88 215 108 A 75 GLU H A 77 LEU HDx% 1.0 1.8 7.57 216 108 A 75 GLU H A 77 LEU HDy% 1.0 1.8 7.57 217 109 A 77 LEU H A 75 GLU HGy 1.0 1.8 5.88 218 109 A 77 LEU H A 75 GLU HGx 1.0 1.8 5.88 219 110 A 76 CYS H A 77 LEU HBy 1.0 1.8 5.88 220 110 A 76 CYS H A 77 LEU HBx 1.0 1.8 5.88 221 111 A 76 CYS H A 77 LEU HDx% 1.0 1.8 7.57 222 111 A 76 CYS H A 77 LEU HDy% 1.0 1.8 7.57 223 112 A 77 LEU H A 76 CYS HBy 1.0 1.8 4.23 224 112 A 77 LEU H A 76 CYS HBx 1.0 1.8 4.23 225 113 A 77 LEU H A 77 LEU HBy 1.0 1.8 2.96 226 113 A 77 LEU H A 77 LEU HBx 1.0 1.8 2.96 227 114 A 78 PHE H A 77 LEU HBy 1.0 1.8 4.23 228 114 A 78 PHE H A 77 LEU HBx 1.0 1.8 4.23 229 115 A 78 PHE H A 77 LEU HDx% 1.0 1.8 5.07 230 115 A 78 PHE H A 77 LEU HDy% 1.0 1.8 5.07 231 116 A 79 LEU H A 79 LEU HBx 1.0 1.8 3.76 232 116 A 79 LEU H A 79 LEU HBy 1.0 1.8 3.76 233 117 A 79 LEU H A 79 LEU HDx% 1.0 1.8 6.07 234 117 A 79 LEU H A 79 LEU HD21 1.0 1.8 6.07 235 118 A 80 GLU H A 79 LEU HBx 1.0 1.8 5.88 236 118 A 80 GLU H A 79 LEU HBy 1.0 1.8 5.88 237 119 A 91 ILE H A 79 LEU HBx 1.0 1.8 4.38 238 119 A 91 ILE H A 79 LEU HBy 1.0 1.8 4.38 239 120 A 80 GLU H A 79 LEU HDx% 1.0 1.8 5.17 240 120 A 80 GLU H A 79 LEU HD21 1.0 1.8 5.17 241 121 A 91 ILE H A 79 LEU HDx% 1.0 1.8 7.57 242 121 A 91 ILE H A 79 LEU HD21 1.0 1.8 7.57 243 122 A 93 LYS H A 79 LEU HDx% 1.0 1.8 7.57 244 122 A 93 LYS H A 79 LEU HD21 1.0 1.8 7.57 245 123 A 80 GLU H A 80 GLU HBy 1.0 1.8 2.96 246 123 A 80 GLU H A 80 GLU HBx 1.0 1.8 2.96 247 124 A 80 GLU H A 80 GLU HGx 1.0 1.8 5.88 248 124 A 80 GLU H A 80 GLU HGy 1.0 1.8 5.88 249 125 A 89 THR H A 81 ARG HBx 1.0 1.8 5.88 250 125 A 89 THR H A 81 ARG HBy 1.0 1.8 5.88 251 126 A 82 LEU H A 81 ARG HDx 1.0 1.8 5.88 252 126 A 82 LEU H A 81 ARG HDy 1.0 1.8 5.88 253 127 A 82 LEU H A 82 LEU HBy 1.0 1.8 2.96 254 127 A 82 LEU H A 82 LEU HBx 1.0 1.8 2.96 255 128 A 82 LEU H A 82 LEU HDx% 1.0 1.8 7.57 256 128 A 82 LEU H A 82 LEU HD21 1.0 1.8 7.57 257 129 A 89 THR H A 82 LEU HBy 1.0 1.8 5.88 258 129 A 89 THR H A 82 LEU HBx 1.0 1.8 5.88 259 130 A 83 GLU H A 82 LEU HDx% 1.0 1.8 5.17 260 130 A 83 GLU H A 82 LEU HD21 1.0 1.8 5.17 261 131 A 86 HIS H A 82 LEU HDx% 1.0 1.8 6.07 262 131 A 86 HIS H A 82 LEU HD21 1.0 1.8 6.07 263 132 A 88 ASN H A 82 LEU HDx% 1.0 1.8 7.57 264 132 A 88 ASN H A 82 LEU HD21 1.0 1.8 7.57 265 133 A 89 THR H A 82 LEU HDx% 1.0 1.8 7.57 266 133 A 89 THR H A 82 LEU HD21 1.0 1.8 7.57 267 134 A 83 GLU H A 83 GLU HGx 1.0 1.8 4.38 268 134 A 83 GLU H A 83 GLU HGy 1.0 1.8 4.38 269 135 A 85 ASN H A 85 ASN HBx 1.0 1.8 3.77 270 135 A 85 ASN H A 85 ASN HBy 1.0 1.8 3.77 271 136 A 87 TYR H A 85 ASN HBx 1.0 1.8 5.88 272 136 A 87 TYR H A 85 ASN HBy 1.0 1.8 5.88 273 137 A 86 HIS H A 87 TYR HBx 1.0 1.8 5.88 274 137 A 86 HIS H A 87 TYR HBy 1.0 1.8 5.88 275 138 A 87 TYR H A 87 TYR HBx 1.0 1.8 3.36 276 138 A 87 TYR H A 87 TYR HBy 1.0 1.8 3.36 277 139 A 88 ASN H A 87 TYR HBx 1.0 1.8 3.48 278 139 A 88 ASN H A 87 TYR HBy 1.0 1.8 3.48 279 140 A 125 PHE H A 87 TYR HBx 1.0 1.8 4.38 280 140 A 125 PHE H A 87 TYR HBy 1.0 1.8 4.38 281 141 A 91 ILE H A 90 TYR HBx 1.0 1.8 4.38 282 141 A 91 ILE H A 90 TYR HBy 1.0 1.8 4.38 283 142 A 102 VAL H A 90 TYR HBx 1.0 1.8 5.88 284 142 A 102 VAL H A 90 TYR HBy 1.0 1.8 5.88 285 143 A 92 SER H A 92 SER HBy 1.0 1.8 3.77 286 143 A 92 SER H A 92 SER HBx 1.0 1.8 3.77 287 144 A 93 LYS H A 93 LYS HBx 1.0 1.8 3.77 288 144 A 93 LYS H A 93 LYS HBy 1.0 1.8 3.77 289 145 A 93 LYS H A 93 LYS HGy 1.0 1.8 5.88 290 145 A 93 LYS H A 93 LYS HGx 1.0 1.8 5.88 291 146 A 93 LYS H A 93 LYS HDx 1.0 1.8 5.88 292 146 A 93 LYS H A 93 LYS HDy 1.0 1.8 5.88 293 147 A 93 LYS H A 93 LYS HEy 1.0 1.8 5.88 294 147 A 93 LYS H A 93 LYS HEx 1.0 1.8 5.88 295 148 A 94 LYS H A 93 LYS HBx 1.0 1.8 5.88 296 148 A 94 LYS H A 93 LYS HBy 1.0 1.8 5.88 297 149 A 94 LYS H A 93 LYS HGy 1.0 1.8 4.38 298 149 A 94 LYS H A 93 LYS HGx 1.0 1.8 4.38 299 150 A 94 LYS H A 94 LYS HBx 1.0 1.8 3.38 300 150 A 94 LYS H A 94 LYS HBy 1.0 1.8 3.38 301 151 A 94 LYS H A 94 LYS HDx 1.0 1.8 5.88 302 151 A 94 LYS H A 94 LYS HDy 1.0 1.8 5.88 303 152 A 95 HIS H A 94 LYS HBx 1.0 1.8 5.88 304 152 A 95 HIS H A 94 LYS HBy 1.0 1.8 5.88 305 153 A 95 HIS H A 94 LYS HDx 1.0 1.8 4.68 306 153 A 95 HIS H A 94 LYS HDy 1.0 1.8 4.68 307 154 A 95 HIS H A 95 HIS HBx 1.0 1.8 3.76 308 154 A 95 HIS H A 95 HIS HBy 1.0 1.8 3.76 309 155 A 96 ALA H A 95 HIS HBx 1.0 1.8 5.88 310 155 A 96 ALA H A 95 HIS HBy 1.0 1.8 5.88 311 156 A 100 TRP H A 95 HIS HBx 1.0 1.8 5.88 312 156 A 100 TRP H A 95 HIS HBy 1.0 1.8 5.88 313 157 A 97 GLU H A 97 GLU HBx 1.0 1.8 3.38 314 157 A 97 GLU H A 97 GLU HBy 1.0 1.8 3.38 315 158 A 98 LYS H A 97 GLU HBx 1.0 1.8 4.38 316 158 A 98 LYS H A 97 GLU HBy 1.0 1.8 4.38 317 159 A 99 ASN H A 97 GLU HBx 1.0 1.8 5.88 318 159 A 99 ASN H A 97 GLU HBy 1.0 1.8 5.88 319 160 A 98 LYS H A 98 LYS HGx 1.0 1.8 4.38 320 160 A 98 LYS H A 98 LYS HGy 1.0 1.8 4.38 321 161 A 99 ASN H A 99 ASN HBy 1.0 1.8 3.77 322 161 A 99 ASN H A 99 ASN HBx 1.0 1.8 3.77 323 162 A 102 VAL H A 102 VAL HGx% 1.0 1.8 4.01 324 162 A 102 VAL H A 102 VAL HG21 1.0 1.8 4.01 325 163 A 103 GLY H A 102 VAL HGx% 1.0 1.8 5.16 326 163 A 103 GLY H A 102 VAL HG21 1.0 1.8 5.16 327 164 A 104 LEU H A 104 LEU HBx 1.0 1.8 3.76 328 164 A 104 LEU H A 104 LEU HBy 1.0 1.8 3.76 329 165 A 104 LEU H A 104 LEU HDx% 1.0 1.8 7.57 330 165 A 104 LEU H A 104 LEU HDy% 1.0 1.8 7.57 331 166 A 105 LYS H A 104 LEU HBx 1.0 1.8 4.38 332 166 A 105 LYS H A 104 LEU HBy 1.0 1.8 4.38 333 167 A 105 LYS H A 104 LEU HDx% 1.0 1.8 6.07 334 167 A 105 LYS H A 104 LEU HDy% 1.0 1.8 6.07 335 168 A 110 CYS H A 104 LEU HDx% 1.0 1.8 7.57 336 168 A 110 CYS H A 104 LEU HDy% 1.0 1.8 7.57 337 169 A 111 LYS H A 104 LEU HDx% 1.0 1.8 6.07 338 169 A 111 LYS H A 104 LEU HDy% 1.0 1.8 6.07 339 170 A 105 LYS H A 109 SER HBx 1.0 1.8 5.88 340 170 A 105 LYS H A 109 SER HBy 1.0 1.8 5.88 341 171 A 105 LYS H A 111 LYS HGx 1.0 1.8 4.38 342 171 A 105 LYS H A 111 LYS HGy 1.0 1.8 4.38 343 172 A 105 LYS H A 111 LYS HDx 1.0 1.8 6.38 344 172 A 105 LYS H A 111 LYS HDy 1.0 1.8 6.38 345 173 A 106 LYS H A 105 LYS HDx 1.0 1.8 4.38 346 173 A 106 LYS H A 105 LYS HDy 1.0 1.8 4.38 347 174 A 106 LYS H A 111 LYS HDx 1.0 1.8 5.88 348 174 A 106 LYS H A 111 LYS HDy 1.0 1.8 5.88 349 175 A 107 ASN H A 107 ASN HBy 1.0 1.8 3.77 350 175 A 107 ASN H A 107 ASN HBx 1.0 1.8 3.77 351 176 A 108 GLY H A 108 GLY HAx 1.0 1.8 2.64 352 176 A 108 GLY H A 108 GLY HAy 1.0 1.8 2.64 353 177 A 108 GLY H A 109 SER HBx 1.0 1.8 5.88 354 177 A 108 GLY H A 109 SER HBy 1.0 1.8 5.88 355 178 A 109 SER H A 109 SER HBx 1.0 1.8 3.77 356 178 A 109 SER H A 109 SER HBy 1.0 1.8 3.77 357 179 A 110 CYS H A 109 SER HBx 1.0 1.8 3.48 358 179 A 110 CYS H A 109 SER HBy 1.0 1.8 3.48 359 180 A 110 CYS H A 110 CYS HBy 1.0 1.8 2.96 360 180 A 110 CYS H A 110 CYS HBx 1.0 1.8 2.96 361 181 A 111 LYS H A 110 CYS HBy 1.0 1.8 4.23 362 181 A 111 LYS H A 110 CYS HBx 1.0 1.8 4.23 363 182 A 111 LYS H A 111 LYS HDx 1.0 1.8 5.88 364 182 A 111 LYS H A 111 LYS HDy 1.0 1.8 5.88 365 183 A 112 ARG H A 111 LYS HBx 1.0 1.8 3.48 366 183 A 112 ARG H A 111 LYS HBy 1.0 1.8 3.48 367 184 A 112 ARG H A 111 LYS HGx 1.0 1.8 5.88 368 184 A 112 ARG H A 111 LYS HGy 1.0 1.8 5.88 369 185 A 112 ARG H A 111 LYS HDx 1.0 1.8 5.88 370 185 A 112 ARG H A 111 LYS HDy 1.0 1.8 5.88 371 186 A 113 GLY H A 112 ARG HBx 1.0 1.8 4.38 372 186 A 113 GLY H A 112 ARG HBy 1.0 1.8 4.38 373 187 A 115 ARG H A 115 ARG HBx 1.0 1.8 3.77 374 187 A 115 ARG H A 115 ARG HBy 1.0 1.8 3.77 375 188 A 115 ARG HA A 115 ARG HDy 1.0 1.8 4.38 376 188 A 115 ARG HA A 115 ARG HDx 1.0 1.8 4.38 377 189 A 117 HIS H A 117 HIS HBx 1.0 1.8 3.76 378 189 A 117 HIS H A 117 HIS HBy 1.0 1.8 3.76 379 190 A 117 HIS H A 123 ILE HG1x 1.0 1.8 5.88 380 190 A 117 HIS H A 123 ILE HG1y 1.0 1.8 5.88 381 191 A 120 GLN H A 120 GLN HBx 1.0 1.8 3.77 382 191 A 120 GLN H A 120 GLN HBy 1.0 1.8 3.77 383 192 A 120 GLN H A 120 GLN HGx 1.0 1.8 4.38 384 192 A 120 GLN H A 120 GLN HGy 1.0 1.8 4.38 385 193 A 123 ILE H A 124 LEU HDx% 1.0 1.8 7.57 386 193 A 123 ILE H A 124 LEU HDy% 1.0 1.8 7.57 387 194 A 124 LEU H A 123 ILE HG1x 1.0 1.8 5.88 388 194 A 124 LEU H A 123 ILE HG1y 1.0 1.8 5.88 389 195 A 124 LEU H A 124 LEU HBx 1.0 1.8 3.37 390 195 A 124 LEU H A 124 LEU HBy 1.0 1.8 3.37 391 196 A 124 LEU H A 124 LEU HDx% 1.0 1.8 6.07 392 196 A 124 LEU H A 124 LEU HDy% 1.0 1.8 6.07 393 197 A 125 PHE H A 124 LEU HBx 1.0 1.8 5.88 394 197 A 125 PHE H A 124 LEU HBy 1.0 1.8 5.88 395 198 A 125 PHE H A 124 LEU HDx% 1.0 1.8 7.57 396 198 A 125 PHE H A 124 LEU HDy% 1.0 1.8 7.57 397 199 A 126 LEU H A 126 LEU HD11 1.0 1.8 6.07 398 199 A 126 LEU H A 126 LEU HD21 1.0 1.8 6.07 399 200 A 126 LEU H A 128 LEU HD11 1.0 1.8 8.97 400 200 A 126 LEU H A 128 LEU HD21 1.0 1.8 8.97 401 201 A 128 LEU H A 127 PRO HBx 1.0 1.8 4.08 402 201 A 128 LEU H A 127 PRO HBy 1.0 1.8 4.08 403 202 A 130 VAL H A 129 PRO HBx 1.0 1.8 4.08 404 202 A 130 VAL H A 129 PRO HBy 1.0 1.8 4.08 405 203 A 130 VAL H A 129 PRO HGx 1.0 1.8 5.37 406 203 A 130 VAL H A 129 PRO HGy 1.0 1.8 5.37 407 204 A 130 VAL H A 129 PRO HDx 1.0 1.8 5.59 408 204 A 130 VAL H A 129 PRO HDy 1.0 1.8 5.59 409 205 A 131 SER H A 130 VAL HGx% 1.0 1.8 6.06 410 205 A 131 SER H A 130 VAL HGy% 1.0 1.8 6.06 411 206 A 132 SER H A 132 SER HBy 1.0 1.8 3.77 412 206 A 132 SER H A 132 SER HBx 1.0 1.8 3.77 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 10 SER H A 124 LEU O 1.0 1.8 2.5 2 2 A 50 LYS H A 38 GLN O 1.0 1.8 2.5 3 3 A 38 GLN H A 50 LYS O 1.0 1.8 2.5 4 4 A 48 TYR H A 40 SER O 1.0 1.8 2.5 5 5 A 40 SER H A 48 TYR O 1.0 1.8 2.5 6 6 A 91 ILE H A 79 LEU O 1.0 1.8 2.5 7 7 A 79 LEU H A 91 ILE O 1.0 1.8 2.5 8 8 A 89 THR H A 81 ARG O 1.0 1.8 2.5 9 9 A 81 ARG H A 89 THR O 1.0 1.8 2.5 10 10 A 83 GLU H A 87 TYR O 1.0 1.8 2.5 11 11 A 128 LEU H A 6 LEU O 1.0 1.8 2.5 12 12 A 6 LEU H A 128 LEU O 1.0 1.8 2.5 13 13 A 126 LEU H A 8 TYR O 1.0 1.8 2.5 14 14 A 8 TYR H A 126 LEU O 1.0 1.8 2.5 15 15 A 25 ASP H A 17 ARG O 1.0 1.8 2.5 16 16 A 17 ARG H A 25 ASP O 1.0 1.8 2.5 17 17 A 27 THR H A 15 PHE O 1.0 1.8 2.5 18 18 A 15 PHE H A 27 THR O 1.0 1.8 2.5 19 19 A 61 ASP H A 65 LEU O 1.0 1.8 2.5 20 20 A 67 TYR H A 59 ALA O 1.0 1.8 2.5 21 21 A 59 ALA H A 67 TYR O 1.0 1.8 2.5 22 22 A 111 LYS H A 103 GLY O 1.0 1.8 2.5 23 23 A 105 LYS H A 109 SER O 1.0 1.8 2.5 stop_ save_ save_CNS/XPLOR_dihedral_5 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_5 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 2 LYS C A 3 LYS N A 3 LYS CA A 3 LYS C 1.0 -157.62 -77.12 PHI 2 2 A 4 PRO C A 5 LYS N A 5 LYS CA A 5 LYS C 1.0 -133.66 -56.98 PHI 3 3 A 5 LYS C A 6 LEU N A 6 LEU CA A 6 LEU C 1.0 -135.19 -98.91 PHI 4 4 A 6 LEU C A 7 LEU N A 7 LEU CA A 7 LEU C 1.0 -123.59 -96.85 PHI 5 5 A 7 LEU C A 8 TYR N A 8 TYR CA A 8 TYR C 1.0 -127.52 -89.44 PHI 6 6 A 8 TYR C A 9 CYS N A 9 CYS CA A 9 CYS C 1.0 -119.40 -84.90 PHI 7 7 A 9 CYS C A 10 SER N A 10 SER CA A 10 SER C 1.0 -115.25 -88.69 PHI 8 8 A 10 SER C A 11 ASN N A 11 ASN CA A 11 ASN C 1.0 -96.41 -82.23 PHI 9 9 A 11 ASN C A 12 GLY N A 12 GLY CA A 12 GLY C 1.0 -142.49 -70.65 PHI 10 10 A 13 GLY C A 14 HIS N A 14 HIS CA A 14 HIS C 1.0 -122.60 -60.50 PHI 11 11 A 14 HIS C A 15 PHE N A 15 PHE CA A 15 PHE C 1.0 -155.53 -92.57 PHI 12 12 A 15 PHE C A 16 LEU N A 16 LEU CA A 16 LEU C 1.0 -132.76 -97.22 PHI 13 13 A 16 LEU C A 17 ARG N A 17 ARG CA A 17 ARG C 1.0 -125.68 -89.76 PHI 14 14 A 17 ARG C A 18 ILE N A 18 ILE CA A 18 ILE C 1.0 -128.37 -98.67 PHI 15 15 A 18 ILE C A 19 LEU N A 19 LEU CA A 19 LEU C 1.0 -136.38 -105.50 PHI 16 16 A 19 LEU C A 20 PRO N A 20 PRO CA A 20 PRO C 1.0 -130.99 -80.09 PHI 17 17 A 23 THR C A 24 VAL N A 24 VAL CA A 24 VAL C 1.0 -132.06 -93.68 PHI 18 18 A 24 VAL C A 25 ASP N A 25 ASP CA A 25 ASP C 1.0 -123.13 -101.97 PHI 19 19 A 26 GLY C A 27 THR N A 27 THR CA A 27 THR C 1.0 -167.98 -124.80 PHI 20 20 A 27 THR C A 28 ARG N A 28 ARG CA A 28 ARG C 1.0 -120.22 -83.10 PHI 21 21 A 28 ARG C A 29 ASP N A 29 ASP CA A 29 ASP C 1.0 -140.48 -107.02 PHI 22 22 A 29 ASP C A 30 ARG N A 30 ARG CA A 30 ARG C 1.0 -126.43 -87.15 PHI 23 23 A 32 ASP C A 33 GLN N A 33 GLN CA A 33 GLN C 1.0 -101.26 -67.88 PHI 24 24 A 34 HIS C A 35 ILE N A 35 ILE CA A 35 ILE C 1.0 -87.35 -59.73 PHI 25 25 A 35 ILE C A 36 GLN N A 36 GLN CA A 36 GLN C 1.0 -118.39 -93.37 PHI 26 26 A 36 GLN C A 37 LEU N A 37 LEU CA A 37 LEU C 1.0 -113.28 -64.78 PHI 27 27 A 37 LEU C A 38 GLN N A 38 GLN CA A 38 GLN C 1.0 -122.46 -93.08 PHI 28 28 A 38 GLN C A 39 LEU N A 39 LEU CA A 39 LEU C 1.0 -116.00 -89.26 PHI 29 29 A 39 LEU C A 40 SER N A 40 SER CA A 40 SER C 1.0 -107.84 -90.60 PHI 30 30 A 40 SER C A 41 ALA N A 41 ALA CA A 41 ALA C 1.0 -154.11 -117.47 PHI 31 31 A 41 ALA C A 42 GLU N A 42 GLU CA A 42 GLU C 1.0 -115.17 -79.07 PHI 32 32 A 42 GLU C A 43 SER N A 43 SER CA A 43 SER C 1.0 -109.69 -87.75 PHI 33 33 A 43 SER C A 44 VAL N A 44 VAL CA A 44 VAL C 1.0 -74.93 -58.59 PHI 34 34 A 46 GLU C A 47 VAL N A 47 VAL CA A 47 VAL C 1.0 -117.87 -97.31 PHI 35 35 A 47 VAL C A 48 TYR N A 48 TYR CA A 48 TYR C 1.0 -136.66 -121.38 PHI 36 36 A 48 TYR C A 49 ILE N A 49 ILE CA A 49 ILE C 1.0 -140.98 -98.14 PHI 37 37 A 49 ILE C A 50 LYS N A 50 LYS CA A 50 LYS C 1.0 -121.57 -99.41 PHI 38 38 A 50 LYS C A 51 SER N A 51 SER CA A 51 SER C 1.0 -118.67 -92.89 PHI 39 39 A 51 SER C A 52 THR N A 52 THR CA A 52 THR C 1.0 -130.74 -85.46 PHI 40 40 A 52 THR C A 53 GLU N A 53 GLU CA A 53 GLU C 1.0 -84.84 -65.92 PHI 41 41 A 53 GLU C A 54 THR N A 54 THR CA A 54 THR C 1.0 -101.28 -65.06 PHI 42 42 A 54 THR C A 55 GLY N A 55 GLY CA A 55 GLY C 1.0 -131.99 -95.19 PHI 43 43 A 55 GLY C A 56 GLN N A 56 GLN CA A 56 GLN C 1.0 78.07 114.93 PHI 44 44 A 56 GLN C A 57 TYR N A 57 TYR CA A 57 TYR C 1.0 -138.14 -84.98 PHI 45 45 A 58 LEU C A 59 ALA N A 59 ALA CA A 59 ALA C 1.0 -136.79 -94.35 PHI 46 46 A 59 ALA C A 60 MET N A 60 MET CA A 60 MET C 1.0 -130.76 -88.32 PHI 47 47 A 60 MET C A 61 ASP N A 61 ASP CA A 61 ASP C 1.0 -133.18 -99.52 PHI 48 48 A 63 ASP C A 64 GLY N A 64 GLY CA A 64 GLY C 1.0 -110.43 -95.43 PHI 49 49 A 65 LEU C A 66 LEU N A 66 LEU CA A 66 LEU C 1.0 -137.50 -87.84 PHI 50 50 A 66 LEU C A 67 TYR N A 67 TYR CA A 67 TYR C 1.0 -122.52 -90.34 PHI 51 51 A 67 TYR C A 68 GLY N A 68 GLY CA A 68 GLY C 1.0 -158.63 -129.63 PHI 52 52 A 68 GLY C A 69 SER N A 69 SER CA A 69 SER C 1.0 -142.61 -97.59 PHI 53 53 A 69 SER C A 70 GLN N A 70 GLN CA A 70 GLN C 1.0 -76.12 -52.36 PHI 54 54 A 70 GLN C A 71 THR N A 71 THR CA A 71 THR C 1.0 -124.33 -76.79 PHI 55 55 A 71 THR C A 72 PRO N A 72 PRO CA A 72 PRO C 1.0 -138.82 -123.34 PHI 56 56 A 72 PRO C A 73 ASN N A 73 ASN CA A 73 ASN C 1.0 -78.72 -55.22 PHI 57 57 A 73 ASN C A 74 GLU N A 74 GLU CA A 74 GLU C 1.0 -147.74 -114.62 PHI 58 58 A 74 GLU C A 75 GLU N A 75 GLU CA A 75 GLU C 1.0 -121.99 -67.09 PHI 59 59 A 77 LEU C A 78 PHE N A 78 PHE CA A 78 PHE C 1.0 -134.69 -89.31 PHI 60 60 A 78 PHE C A 79 LEU N A 79 LEU CA A 79 LEU C 1.0 -138.63 -85.03 PHI 61 61 A 79 LEU C A 80 GLU N A 80 GLU CA A 80 GLU C 1.0 -129.49 -100.55 PHI 62 62 A 80 GLU C A 81 ARG N A 81 ARG CA A 81 ARG C 1.0 -137.42 -103.18 PHI 63 63 A 81 ARG C A 82 LEU N A 82 LEU CA A 82 LEU C 1.0 -115.61 -93.23 PHI 64 64 A 82 LEU C A 83 GLU N A 83 GLU CA A 83 GLU C 1.0 -107.33 -86.59 PHI 65 65 A 83 GLU C A 84 GLU N A 84 GLU CA A 84 GLU C 1.0 -137.25 -95.67 PHI 66 66 A 87 TYR C A 88 ASN N A 88 ASN CA A 88 ASN C 1.0 -139.85 -95.31 PHI 67 67 A 88 ASN C A 89 THR N A 89 THR CA A 89 THR C 1.0 -123.55 -106.65 PHI 68 68 A 89 THR C A 90 TYR N A 90 TYR CA A 90 TYR C 1.0 -150.42 -123.04 PHI 69 69 A 90 TYR C A 91 ILE N A 91 ILE CA A 91 ILE C 1.0 -135.28 -102.26 PHI 70 70 A 91 ILE C A 92 SER N A 92 SER CA A 92 SER C 1.0 -118.26 -93.50 PHI 71 71 A 92 SER C A 93 LYS N A 93 LYS CA A 93 LYS C 1.0 -89.67 -73.87 PHI 72 72 A 93 LYS C A 94 LYS N A 94 LYS CA A 94 LYS C 1.0 -83.63 -48.11 PHI 73 73 A 94 LYS C A 95 HIS N A 95 HIS CA A 95 HIS C 1.0 -89.45 -66.23 PHI 74 74 A 97 GLU C A 98 LYS N A 98 LYS CA A 98 LYS C 1.0 -93.11 -61.73 PHI 75 75 A 98 LYS C A 99 ASN N A 99 ASN CA A 99 ASN C 1.0 85.80 104.56 PHI 76 76 A 99 ASN C A 100 TRP N A 100 TRP CA A 100 TRP C 1.0 -76.42 -46.42 PHI 77 77 A 100 TRP C A 101 PHE N A 101 PHE CA A 101 PHE C 1.0 -136.45 -91.25 PHI 78 78 A 101 PHE C A 102 VAL N A 102 VAL CA A 102 VAL C 1.0 -114.33 -90.99 PHI 79 79 A 102 VAL C A 103 GLY N A 103 GLY CA A 103 GLY C 1.0 -133.14 -84.72 PHI 80 80 A 103 GLY C A 104 LEU N A 104 LEU CA A 104 LEU C 1.0 -128.14 -99.36 PHI 81 81 A 104 LEU C A 105 LYS N A 105 LYS CA A 105 LYS C 1.0 -134.24 -96.86 PHI 82 82 A 105 LYS C A 106 LYS N A 106 LYS CA A 106 LYS C 1.0 -113.39 -72.25 PHI 83 83 A 106 LYS C A 107 ASN N A 107 ASN CA A 107 ASN C 1.0 -70.11 -51.93 PHI 84 84 A 107 ASN C A 108 GLY N A 108 GLY CA A 108 GLY C 1.0 -108.43 -82.49 PHI 85 85 A 109 SER C A 110 CYS N A 110 CYS CA A 110 CYS C 1.0 -168.21 -95.35 PHI 86 86 A 110 CYS C A 111 LYS N A 111 LYS CA A 111 LYS C 1.0 -107.56 -67.54 PHI 87 87 A 111 LYS C A 112 ARG N A 112 ARG CA A 112 ARG C 1.0 -139.96 -98.28 PHI 88 88 A 112 ARG C A 113 GLY N A 113 GLY CA A 113 GLY C 1.0 -112.11 -71.11 PHI 89 89 A 117 HIS C A 118 TYR N A 118 TYR CA A 118 TYR C 1.0 -164.43 -93.23 PHI 90 90 A 118 TYR C A 119 GLY N A 119 GLY CA A 119 GLY C 1.0 -99.82 -68.22 PHI 91 91 A 120 GLN C A 121 LYS N A 121 LYS CA A 121 LYS C 1.0 -130.20 -74.86 PHI 92 92 A 122 ALA C A 123 ILE N A 123 ILE CA A 123 ILE C 1.0 -89.95 -69.47 PHI 93 93 A 123 ILE C A 124 LEU N A 124 LEU CA A 124 LEU C 1.0 -116.71 -96.15 PHI 94 94 A 125 PHE C A 126 LEU N A 126 LEU CA A 126 LEU C 1.0 -133.42 -111.34 PHI 95 95 A 126 LEU C A 127 PRO N A 127 PRO CA A 127 PRO C 1.0 -130.52 -109.76 PHI 96 96 A 127 PRO C A 128 LEU N A 128 LEU CA A 128 LEU C 1.0 -138.60 -88.10 PHI 97 97 A 128 LEU C A 129 PRO N A 129 PRO CA A 129 PRO C 1.0 -133.62 -86.96 PHI 98 98 A 129 PRO C A 130 VAL N A 130 VAL CA A 130 VAL C 1.0 -89.54 -57.54 PHI 99 99 A 130 VAL C A 131 SER N A 131 SER CA A 131 SER C 1.0 -109.36 -73.74 PHI 100 100 A 131 SER C A 132 SER N A 132 SER CA A 132 SER C 1.0 -138.24 -95.46 PHI 101 101 A 132 SER C A 133 ASP N A 133 ASP CA A 133 ASP C 1.0 -130.57 -77.57 PHI 102 102 A 2 LYS N A 2 LYS CA A 2 LYS C A 3 LYS N 1.0 144.77 169.15 PSI 103 103 A 4 PRO N A 4 PRO CA A 4 PRO C A 5 LYS N 1.0 111.12 168.16 PSI 104 104 A 5 LYS N A 5 LYS CA A 5 LYS C A 6 LEU N 1.0 144.43 173.87 PSI 105 105 A 6 LEU N A 6 LEU CA A 6 LEU C A 7 LEU N 1.0 124.37 148.87 PSI 106 106 A 7 LEU N A 7 LEU CA A 7 LEU C A 8 TYR N 1.0 94.18 132.20 PSI 107 107 A 8 TYR N A 8 TYR CA A 8 TYR C A 9 CYS N 1.0 105.70 129.00 PSI 108 108 A 9 CYS N A 9 CYS CA A 9 CYS C A 10 SER N 1.0 100.34 135.24 PSI 109 109 A 10 SER N A 10 SER CA A 10 SER C A 11 ASN N 1.0 122.28 148.88 PSI 110 110 A 11 ASN N A 11 ASN CA A 11 ASN C A 12 GLY N 1.0 115.85 156.03 PSI 111 111 A 13 GLY N A 13 GLY CA A 13 GLY C A 14 HIS N 1.0 89.56 188.10 PSI 112 112 A 14 HIS N A 14 HIS CA A 14 HIS C A 15 PHE N 1.0 134.48 162.74 PSI 113 113 A 15 PHE N A 15 PHE CA A 15 PHE C A 16 LEU N 1.0 118.71 137.89 PSI 114 114 A 16 LEU N A 16 LEU CA A 16 LEU C A 17 ARG N 1.0 110.40 138.66 PSI 115 115 A 17 ARG N A 17 ARG CA A 17 ARG C A 18 ILE N 1.0 124.22 148.70 PSI 116 116 A 18 ILE N A 18 ILE CA A 18 ILE C A 19 LEU N 1.0 121.90 143.06 PSI 117 117 A 19 LEU N A 19 LEU CA A 19 LEU C A 20 PRO N 1.0 104.85 157.33 PSI 118 118 A 23 THR N A 23 THR CA A 23 THR C A 24 VAL N 1.0 123.90 147.20 PSI 119 119 A 24 VAL N A 24 VAL CA A 24 VAL C A 25 ASP N 1.0 109.73 133.03 PSI 120 120 A 26 GLY N A 26 GLY CA A 26 GLY C A 27 THR N 1.0 143.39 181.79 PSI 121 121 A 27 THR N A 27 THR CA A 27 THR C A 28 ARG N 1.0 121.74 143.64 PSI 122 122 A 28 ARG N A 28 ARG CA A 28 ARG C A 29 ASP N 1.0 124.69 154.95 PSI 123 123 A 29 ASP N A 29 ASP CA A 29 ASP C A 30 ARG N 1.0 119.32 160.08 PSI 124 124 A 32 ASP N A 32 ASP CA A 32 ASP C A 33 GLN N 1.0 -138.70 -109.52 PSI 125 125 A 34 HIS N A 34 HIS CA A 34 HIS C A 35 ILE N 1.0 -30.83 -6.93 PSI 126 126 A 35 ILE N A 35 ILE CA A 35 ILE C A 36 GLN N 1.0 -4.31 22.67 PSI 127 127 A 36 GLN N A 36 GLN CA A 36 GLN C A 37 LEU N 1.0 105.72 140.72 PSI 128 128 A 37 LEU N A 37 LEU CA A 37 LEU C A 38 GLN N 1.0 96.55 153.47 PSI 129 129 A 38 GLN N A 38 GLN CA A 38 GLN C A 39 LEU N 1.0 109.36 131.86 PSI 130 130 A 39 LEU N A 39 LEU CA A 39 LEU C A 40 SER N 1.0 96.75 138.41 PSI 131 131 A 40 SER N A 40 SER CA A 40 SER C A 41 ALA N 1.0 138.35 167.99 PSI 132 132 A 41 ALA N A 41 ALA CA A 41 ALA C A 42 GLU N 1.0 99.99 133.59 PSI 133 133 A 4 PRO N A 42 GLU CA A 42 GLU C A 43 SER N 1.0 96.35 151.71 . 134 134 A 44 VAL N A 44 VAL CA A 44 VAL C A 45 GLY N 1.0 119.03 145.99 PSI 135 135 A 46 GLU N A 46 GLU CA A 46 GLU C A 47 VAL N 1.0 123.74 149.60 PSI 136 136 A 47 VAL N A 47 VAL CA A 47 VAL C A 48 TYR N 1.0 102.80 136.80 PSI 137 137 A 48 TYR N A 48 TYR CA A 48 TYR C A 49 ILE N 1.0 125.79 154.29 PSI 138 138 A 49 ILE N A 49 ILE CA A 49 ILE C A 50 LYS N 1.0 102.78 136.82 PSI 139 139 A 50 LYS N A 50 LYS CA A 50 LYS C A 51 SER N 1.0 125.03 146.25 PSI 140 140 A 51 SER N A 51 SER CA A 51 SER C A 52 THR N 1.0 109.75 138.39 PSI 141 141 A 52 THR N A 52 THR CA A 52 THR C A 53 GLU N 1.0 -135.97 -106.61 PSI 142 142 A 53 GLU N A 53 GLU CA A 53 GLU C A 54 THR N 1.0 -37.06 -2.14 PSI 143 143 A 54 THR N A 54 THR CA A 54 THR C A 55 GLY N 1.0 -8.17 16.71 PSI 144 144 A 55 GLY N A 55 GLY CA A 55 GLY C A 56 GLN N 1.0 -12.12 23.02 PSI 145 145 A 56 GLN N A 56 GLN CA A 56 GLN C A 57 TYR N 1.0 136.41 166.11 PSI 146 146 A 58 LEU N A 58 LEU CA A 58 LEU C A 59 ALA N 1.0 94.69 143.77 PSI 147 147 A 59 ALA N A 59 ALA CA A 59 ALA C A 60 MET N 1.0 106.99 155.57 PSI 148 148 A 60 MET N A 60 MET CA A 60 MET C A 61 ASP N 1.0 122.06 142.98 PSI 149 149 A 63 ASP N A 63 ASP CA A 63 ASP C A 64 GLY N 1.0 -3.15 16.83 PSI 150 150 A 65 LEU N A 65 LEU CA A 65 LEU C A 66 LEU N 1.0 112.07 167.99 PSI 151 151 A 66 LEU N A 66 LEU CA A 66 LEU C A 67 TYR N 1.0 117.45 137.67 PSI 152 152 A 67 TYR N A 67 TYR CA A 67 TYR C A 68 GLY N 1.0 158.36 174.30 PSI 153 153 A 68 GLY N A 68 GLY CA A 68 GLY C A 69 SER N 1.0 131.05 170.57 PSI 154 154 A 69 SER N A 69 SER CA A 69 SER C A 70 GLN N 1.0 -42.38 -20.60 PSI 155 155 A 70 GLN N A 70 GLN CA A 70 GLN C A 71 THR N 1.0 -35.04 22.36 PSI 156 156 A 71 THR N A 71 THR CA A 71 THR C A 72 PRO N 1.0 126.43 175.19 PSI 157 157 A 72 PRO N A 72 PRO CA A 72 PRO C A 73 ASN N 1.0 108.50 166.56 PSI 158 158 A 73 ASN N A 73 ASN CA A 73 ASN C A 74 GLU N 1.0 148.30 176.48 PSI 159 159 A 74 GLU N A 74 GLU CA A 74 GLU C A 75 GLU N 1.0 130.06 172.72 PSI 160 160 A 77 LEU N A 77 LEU CA A 77 LEU C A 78 PHE N 1.0 125.93 159.27 PSI 161 161 A 78 PHE N A 78 PHE CA A 78 PHE C A 79 LEU N 1.0 120.00 160.10 PSI 162 162 A 79 LEU N A 79 LEU CA A 79 LEU C A 80 GLU N 1.0 111.06 133.30 PSI 163 163 A 80 GLU N A 80 GLU CA A 80 GLU C A 81 ARG N 1.0 113.86 131.08 PSI 164 164 A 81 ARG N A 81 ARG CA A 81 ARG C A 82 LEU N 1.0 108.51 130.79 PSI 165 165 A 82 LEU N A 82 LEU CA A 82 LEU C A 83 GLU N 1.0 106.83 126.97 PSI 166 166 A 83 GLU N A 83 GLU CA A 83 GLU C A 84 GLU N 1.0 117.83 158.03 PSI 167 167 A 87 TYR N A 87 TYR CA A 87 TYR C A 88 ASN N 1.0 115.41 160.91 PSI 168 168 A 88 ASN N A 88 ASN CA A 88 ASN C A 89 THR N 1.0 137.62 170.36 PSI 169 169 A 89 THR N A 89 THR CA A 89 THR C A 90 TYR N 1.0 142.83 169.51 PSI 170 170 A 90 TYR N A 90 TYR CA A 90 TYR C A 91 ILE N 1.0 122.98 155.18 PSI 171 171 A 91 ILE N A 91 ILE CA A 91 ILE C A 92 SER N 1.0 129.17 151.35 PSI 172 172 A 92 SER N A 92 SER CA A 92 SER C A 93 LYS N 1.0 98.04 136.86 PSI 173 173 A 93 LYS N A 93 LYS CA A 93 LYS C A 94 LYS N 1.0 0.90 21.94 PSI 174 174 A 97 GLU N A 97 GLU CA A 97 GLU C A 98 LYS N 1.0 -33.13 8.09 PSI 175 175 A 98 LYS N A 98 LYS CA A 98 LYS C A 99 ASN N 1.0 1.70 19.30 PSI 176 176 A 99 ASN N A 99 ASN CA A 99 ASN C A 100 TRP N 1.0 20.42 52.56 PSI 177 177 A 100 TRP N A 100 TRP CA A 100 TRP C A 101 PHE N 1.0 95.63 166.91 PSI 178 178 A 101 PHE N A 101 PHE CA A 101 PHE C A 102 VAL N 1.0 106.76 143.16 PSI 179 179 A 102 VAL N A 102 VAL CA A 102 VAL C A 103 GLY N 1.0 118.01 145.61 PSI 180 180 A 103 GLY N A 103 GLY CA A 103 GLY C A 104 LEU N 1.0 121.75 160.29 PSI 181 181 A 104 LEU N A 104 LEU CA A 104 LEU C A 105 LYS N 1.0 120.56 175.34 PSI 182 182 A 105 LYS N A 105 LYS CA A 105 LYS C A 106 LYS N 1.0 112.53 167.57 PSI 183 183 A 106 LYS N A 106 LYS CA A 106 LYS C A 107 ASN N 1.0 -42.99 -20.73 PSI 184 184 A 107 ASN N A 107 ASN CA A 107 ASN C A 108 GLY N 1.0 1.55 16.35 PSI 185 185 A 109 SER N A 109 SER CA A 109 SER C A 110 CYS N 1.0 134.84 163.92 PSI 186 186 A 110 CYS N A 110 CYS CA A 110 CYS C A 111 LYS N 1.0 120.23 183.61 PSI 187 187 A 111 LYS N A 111 LYS CA A 111 LYS C A 112 ARG N 1.0 118.38 146.66 PSI 188 188 A 112 ARG N A 112 ARG CA A 112 ARG C A 113 GLY N 1.0 98.93 164.01 PSI 189 189 A 117 HIS N A 117 HIS CA A 117 HIS C A 118 TYR N 1.0 115.55 176.37 PSI 190 190 A 118 TYR N A 118 TYR CA A 118 TYR C A 119 GLY N 1.0 100.12 141.10 PSI 191 191 A 120 GLN N A 120 GLN CA A 120 GLN C A 121 LYS N 1.0 141.56 179.68 PSI 192 192 A 122 ALA N A 122 ALA CA A 122 ALA C A 123 ILE N 1.0 -21.09 1.57 PSI 193 193 A 123 ILE N A 123 ILE CA A 123 ILE C A 124 LEU N 1.0 2.08 27.78 PSI 194 194 A 125 PHE N A 125 PHE CA A 125 PHE C A 126 LEU N 1.0 126.63 158.75 PSI 195 195 A 126 LEU N A 126 LEU CA A 126 LEU C A 127 PRO N 1.0 119.33 140.61 PSI 196 196 A 127 PRO N A 127 PRO CA A 127 PRO C A 128 LEU N 1.0 107.80 138.50 PSI 197 197 A 128 LEU N A 128 LEU CA A 128 LEU C A 129 PRO N 1.0 81.81 159.71 PSI 198 198 A 129 PRO N A 129 PRO CA A 129 PRO C A 130 VAL N 1.0 145.61 168.31 PSI 199 199 A 130 VAL N A 130 VAL CA A 130 VAL C A 131 SER N 1.0 116.63 155.03 PSI 200 200 A 131 SER N A 131 SER CA A 131 SER C A 132 SER N 1.0 125.19 161.05 PSI 201 201 A 132 SER N A 132 SER CA A 132 SER C A 133 ASP N 1.0 82.66 119.32 PSI stop_ save_