data_nef_c18797_2m07 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 4936 PDB 1q9f PDB 1qj8 BMRB 18796 PDB 2m06 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 ALA start . . 2 A 2 THR middle . . 3 A 3 SER middle . . 4 A 4 THR middle . . 5 A 5 VAL middle . . 6 A 6 THR middle . . 7 A 7 GLY middle . false 8 A 8 GLY middle . false 9 A 9 TYR middle . . 10 A 10 ALA middle . . 11 A 11 GLN middle . . 12 A 12 SER middle . . 13 A 13 ASP middle . . 14 A 14 ALA middle . . 15 A 15 GLN middle . . 16 A 16 GLY middle . false 17 A 17 GLN middle . . 18 A 18 MET middle . . 19 A 19 ASN middle . . 20 A 20 LYS middle . . 21 A 21 MET middle . . 22 A 22 GLY middle . false 23 A 23 GLY middle . false 24 A 24 PHE middle . . 25 A 25 ASN middle . . 26 A 26 LEU middle . . 27 A 27 LYS middle . . 28 A 28 TYR middle . . 29 A 29 ARG middle . . 30 A 30 TYR middle . . 31 A 31 GLU middle . . 32 A 32 GLU middle . . 33 A 33 ASP middle . . 34 A 34 ASN middle . . 35 A 35 SER middle . . 36 A 36 PRO middle . false 37 A 37 LEU middle . . 38 A 38 GLY middle . false 39 A 39 VAL middle . . 40 A 40 ILE middle . . 41 A 41 GLY middle . false 42 A 42 SER middle . . 43 A 43 PHE middle . . 44 A 44 THR middle . . 45 A 45 TYR middle . . 46 A 46 THR middle . . 47 A 47 GLU middle . . 48 A 48 LYS middle . . 49 A 49 SER middle . . 50 A 50 ARG middle . . 51 A 51 THR middle . . 52 A 52 ALA middle . . 53 A 53 SER middle . . 54 A 54 SER middle . . 55 A 55 GLY middle . false 56 A 56 ASP middle . . 57 A 57 TYR middle . . 58 A 58 ASN middle . . 59 A 59 LYS middle . . 60 A 60 ASN middle . . 61 A 61 GLN middle . . 62 A 62 TYR middle . . 63 A 63 TYR middle . . 64 A 64 GLY middle . false 65 A 65 ILE middle . . 66 A 66 THR middle . . 67 A 67 ALA middle . . 68 A 68 GLY middle . false 69 A 69 PRO middle . false 70 A 70 ALA middle . . 71 A 71 TYR middle . . 72 A 72 ARG middle . . 73 A 73 ILE middle . . 74 A 74 ASN middle . . 75 A 75 ASP middle . . 76 A 76 TRP middle . . 77 A 77 ALA middle . . 78 A 78 SER middle . . 79 A 79 ILE middle . . 80 A 80 TYR middle . . 81 A 81 GLY middle . false 82 A 82 VAL middle . . 83 A 83 VAL middle . . 84 A 84 GLY middle . false 85 A 85 VAL middle . . 86 A 86 GLY middle . false 87 A 87 TYR middle . . 88 A 88 GLY middle . false 89 A 89 LYS middle . . 90 A 90 PHE middle . . 91 A 91 GLN middle . . 92 A 92 THR middle . . 93 A 93 THR middle . . 94 A 94 GLU middle . . 95 A 95 TYR middle . . 96 A 96 PRO middle . false 97 A 97 THR middle . . 98 A 98 TYR middle . . 99 A 99 LYS middle . . 100 A 100 HIS middle . . 101 A 101 ASP middle . . 102 A 102 THR middle . . 103 A 103 SER middle . . 104 A 104 ASP middle . . 105 A 105 TYR middle . . 106 A 106 GLY middle . false 107 A 107 PHE middle . . 108 A 108 SER middle . . 109 A 109 TYR middle . . 110 A 110 GLY middle . false 111 A 111 ALA middle . . 112 A 112 GLY middle . false 113 A 113 LEU middle . . 114 A 114 GLN middle . . 115 A 115 PHE middle . . 116 A 116 ASN middle . . 117 A 117 PRO middle . false 118 A 118 MET middle . . 119 A 119 GLU middle . . 120 A 120 ASN middle . . 121 A 121 VAL middle . . 122 A 122 ALA middle . . 123 A 123 LEU middle . . 124 A 124 ASP middle . . 125 A 125 PHE middle . . 126 A 126 SER middle . . 127 A 127 TYR middle . . 128 A 128 GLU middle . . 129 A 129 GLN middle . . 130 A 130 SER middle . . 131 A 131 ARG middle . . 132 A 132 ILE middle . . 133 A 133 ARG middle . . 134 A 134 SER middle . . 135 A 135 VAL middle . . 136 A 136 ASP middle . . 137 A 137 VAL middle . . 138 A 138 GLY middle . false 139 A 139 THR middle . . 140 A 140 TRP middle . . 141 A 141 ILE middle . . 142 A 142 ALA middle . . 143 A 143 GLY middle . false 144 A 144 VAL middle . . 145 A 145 GLY middle . false 146 A 146 TYR middle . . 147 A 147 ARG middle . . 148 A 148 PHE end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 ALA C C 13 174.17 0.05 A 1 ALA CA C 13 51.56 0.05 A 1 ALA CB C 13 19.31 0.05 A 2 THR H H 1 8.49 0.02 A 2 THR C C 13 173.57 0.05 A 2 THR CA C 13 61.04 0.05 A 2 THR CB C 13 71.93 0.05 A 2 THR N N 15 114.28 0.05 A 3 SER H H 1 9.00 0.02 A 3 SER C C 13 172.59 0.05 A 3 SER CA C 13 56.76 0.05 A 3 SER CB C 13 65.48 0.05 A 3 SER N N 15 122.43 0.05 A 4 THR H H 1 8.61 0.02 A 4 THR C C 13 174.64 0.05 A 4 THR CA C 13 61.39 0.05 A 4 THR CB C 13 70.68 0.05 A 4 THR N N 15 117.24 0.05 A 5 VAL H H 1 8.75 0.02 A 5 VAL C C 13 174.77 0.05 A 5 VAL CA C 13 59.76 0.05 A 5 VAL CB C 13 33.49 0.05 A 5 VAL N N 15 129.44 0.05 A 6 THR H H 1 8.89 0.02 A 6 THR C C 13 172.93 0.05 A 6 THR CA C 13 58.59 0.05 A 6 THR CB C 13 70.93 0.05 A 6 THR N N 15 116.43 0.05 A 7 GLY H H 1 8.76 0.02 A 7 GLY C C 13 172.43 0.05 A 7 GLY CA C 13 44.32 0.05 A 7 GLY N N 15 105.59 0.05 A 8 GLY H H 1 9.10 0.02 A 8 GLY C C 13 173.03 0.05 A 8 GLY CA C 13 45.93 0.05 A 8 GLY N N 15 106.53 0.05 A 9 TYR H H 1 8.41 0.02 A 9 TYR C C 13 172.39 0.05 A 9 TYR CA C 13 56.84 0.05 A 9 TYR CB C 13 41.08 0.05 A 9 TYR N N 15 121.73 0.05 A 10 ALA H H 1 6.91 0.02 A 10 ALA C C 13 174.02 0.05 A 10 ALA CA C 13 48.21 0.05 A 10 ALA CB C 13 22.22 0.05 A 10 ALA N N 15 128.46 0.05 A 11 GLN H H 1 8.10 0.02 A 11 GLN C C 13 175.65 0.05 A 11 GLN CA C 13 53.83 0.05 A 11 GLN CB C 13 32.06 0.05 A 11 GLN N N 15 118.83 0.05 A 12 SER H H 1 9.16 0.02 A 12 SER C C 13 172.71 0.05 A 12 SER CA C 13 57.19 0.05 A 12 SER CB C 13 64.18 0.05 A 12 SER N N 15 124.20 0.05 A 13 ASP H H 1 9.07 0.02 A 13 ASP C C 13 174.86 0.05 A 13 ASP CA C 13 52.96 0.05 A 13 ASP CB C 13 42.92 0.05 A 13 ASP N N 15 124.95 0.05 A 14 ALA H H 1 8.56 0.02 A 14 ALA C C 13 176.23 0.05 A 14 ALA CA C 13 49.81 0.05 A 14 ALA CB C 13 19.50 0.05 A 14 ALA N N 15 128.73 0.05 A 15 GLN H H 1 8.34 0.02 A 15 GLN C C 13 176.66 0.05 A 15 GLN CA C 13 57.12 0.05 A 15 GLN CB C 13 28.16 0.05 A 15 GLN N N 15 122.75 0.05 A 16 GLY H H 1 8.65 0.02 A 16 GLY C C 13 174.40 0.05 A 16 GLY CA C 13 45.18 0.05 A 16 GLY N N 15 112.80 0.05 A 17 GLN H H 1 8.08 .02 A 17 GLN C C 13 175.72 0.05 A 17 GLN CA C 13 54.60 0.05 A 17 GLN CB C 13 32.80 0.05 A 17 GLN N N 15 119.30 0.05 A 18 MET H H 1 8.37 0.02 A 18 MET C C 13 175.40 0.05 A 18 MET CA C 13 55.98 0.05 A 18 MET CB C 13 35.59 0.05 A 18 MET N N 15 120.17 0.05 A 19 ASN H H 1 7.99 0.02 A 19 ASN C C 13 174.40 0.05 A 19 ASN CA C 13 52.30 0.05 A 19 ASN CB C 13 39.40 0.05 A 19 ASN N N 15 117.90 0.05 A 20 LYS H H 1 8.34 0.02 A 20 LYS C C 13 176.41 0.05 A 20 LYS CA C 13 55.70 0.05 A 20 LYS CB C 13 31.90 0.05 A 20 LYS N N 15 120.80 0.05 A 21 MET H H 1 8.58 0.02 A 21 MET C C 13 175.27 0.05 A 21 MET CA C 13 54.80 0.05 A 21 MET CB C 13 34.73 0.05 A 21 MET N N 15 120.50 0.05 A 22 GLY H H 1 8.43 0.02 A 22 GLY C C 13 174.03 0.05 A 22 GLY CA C 13 43.81 0.05 A 22 GLY N N 15 111.28 0.05 A 23 GLY H H 1 8.18 0.02 A 23 GLY C C 13 171.85 0.05 A 23 GLY CA C 13 46.15 0.05 A 23 GLY N N 15 120.17 0.05 A 24 PHE H H 1 9.23 0.02 A 24 PHE C C 13 171.57 0.05 A 24 PHE CA C 13 54.73 0.05 A 24 PHE CB C 13 43.51 0.05 A 24 PHE N N 15 121.37 0.05 A 25 ASN H H 1 8.52 0.02 A 25 ASN C C 13 172.08 0.05 A 25 ASN CA C 13 50.87 0.05 A 25 ASN CB C 13 46.45 0.05 A 25 ASN N N 15 118.95 0.05 A 26 LEU H H 1 9.34 0.02 A 26 LEU C C 13 175.62 0.05 A 26 LEU CA C 13 53.49 0.05 A 26 LEU CB C 13 46.63 0.05 A 26 LEU N N 15 126.15 0.05 A 27 LYS H H 1 8.85 0.02 A 27 LYS C C 13 175.12 0.05 A 27 LYS CA C 13 55.19 0.05 A 27 LYS CB C 13 36.57 0.05 A 27 LYS N N 15 117.98 0.05 A 28 TYR H H 1 8.43 0.02 A 28 TYR C C 13 172.48 0.05 A 28 TYR CA C 13 56.28 0.05 A 28 TYR CB C 13 41.90 0.05 A 28 TYR N N 15 120.82 0.05 A 29 ARG H H 1 8.67 0.02 A 29 ARG C C 13 172.78 0.05 A 29 ARG CA C 13 53.00 0.05 A 29 ARG CB C 13 34.01 0.05 A 29 ARG N N 15 129.66 0.05 A 30 TYR H H 1 8.93 0.02 A 30 TYR C C 13 175.00 0.05 A 30 TYR CA C 13 56.83 0.05 A 30 TYR CB C 13 42.14 0.05 A 30 TYR N N 15 127.21 0.05 A 31 GLU H H 1 8.17 0.02 A 31 GLU C C 13 174.25 0.05 A 31 GLU CA C 13 54.63 0.05 A 31 GLU CB C 13 32.49 0.05 A 31 GLU N N 15 128.09 0.05 A 32 GLU H H 1 9.12 0.02 A 32 GLU C C 13 176.92 0.05 A 32 GLU CA C 13 54.57 0.05 A 32 GLU CB C 13 30.77 0.05 A 32 GLU N N 15 122.61 0.05 A 33 ASP H H 1 8.60 0.02 A 33 ASP C C 13 176.99 0.05 A 33 ASP CA C 13 55.87 0.05 A 33 ASP CB C 13 40.27 0.05 A 33 ASP N N 15 121.92 0.05 A 34 ASN H H 1 8.42 0.02 A 34 ASN C C 13 174.28 0.05 A 34 ASN CA C 13 53.36 0.05 A 34 ASN CB C 13 37.95 0.05 A 34 ASN N N 15 115.30 0.05 A 35 SER H H 1 7.27 0.02 A 35 SER CA C 13 54.26 0.05 A 35 SER CB C 13 64.92 0.05 A 35 SER N N 15 112.97 0.05 A 36 PRO CA C 13 63.36 0.05 A 36 PRO CB C 13 31.47 0.05 A 37 LEU H H 1 7.91 0.02 A 37 LEU C C 13 176.30 0.05 A 37 LEU CA C 13 53.84 0.05 A 37 LEU CB C 13 43.69 0.05 A 37 LEU N N 15 123.00 0.05 A 38 GLY H H 1 9.11 0.02 A 38 GLY C C 13 172.34 0.05 A 38 GLY CA C 13 44.43 0.05 A 38 GLY N N 15 117.32 0.05 A 39 VAL H H 1 7.98 0.02 A 39 VAL C C 13 171.72 0.05 A 39 VAL CA C 13 59.00 0.05 A 39 VAL CB C 13 35.61 0.05 A 39 VAL N N 15 116.55 0.05 A 40 ILE H H 1 9.16 0.02 A 40 ILE C C 13 171.60 0.05 A 40 ILE CA C 13 58.54 0.05 A 40 ILE CB C 13 44.13 0.05 A 40 ILE N N 15 125.64 0.05 A 41 GLY H H 1 8.93 0.02 A 41 GLY C C 13 172.00 0.05 A 41 GLY CA C 13 43.15 0.05 A 41 GLY N N 15 111.83 0.05 A 42 SER H H 1 9.19 0.02 A 42 SER C C 13 172.10 0.05 A 42 SER CA C 13 56.22 0.05 A 42 SER CB C 13 62.92 0.05 A 42 SER N N 15 116.94 0.05 A 43 PHE H H 1 9.30 0.02 A 43 PHE C C 13 172.92 0.05 A 43 PHE CA C 13 55.96 0.05 A 43 PHE CB C 13 42.43 0.05 A 43 PHE N N 15 129.23 0.05 A 44 THR H H 1 8.82 0.02 A 44 THR C C 13 171.34 0.05 A 44 THR CA C 13 60.41 0.05 A 44 THR CB C 13 70.22 0.05 A 44 THR N N 15 126.53 0.05 A 45 TYR H H 1 8.21 0.02 A 45 TYR C C 13 174.00 0.05 A 45 TYR CA C 13 55.67 0.05 A 45 TYR CB C 13 41.00 0.05 A 45 TYR N N 15 125.84 0.05 A 46 THR H H 1 8.55 0.02 A 46 THR C C 13 171.91 0.05 A 46 THR CA C 13 58.72 0.05 A 46 THR CB C 13 71.71 0.05 A 46 THR N N 15 117.67 0.05 A 47 GLU H H 1 8.17 0.02 A 47 GLU CA C 13 54.58 0.05 A 47 GLU CB C 13 32.67 0.05 A 47 GLU N N 15 112.16 0.05 A 49 SER C C 13 174.13 0.05 A 49 SER CA C 13 58.21 0.05 A 49 SER CB C 13 64.07 0.05 A 50 ARG H H 1 8.60 0.02 A 50 ARG C C 13 176.27 0.05 A 50 ARG CA C 13 55.96 0.05 A 50 ARG CB C 13 30.98 0.05 A 50 ARG N N 15 124.00 0.05 A 51 THR H H 1 8.24 0.02 A 51 THR C C 13 174.40 0.05 A 51 THR CA C 13 61.82 0.05 A 51 THR N N 15 115.72 0.05 A 52 ALA C C 13 175.23 0.05 A 52 ALA CA C 13 52.00 0.05 A 52 ALA CB C 13 18.80 0.05 A 53 SER H H 1 8.00 0.02 A 53 SER C C 13 175.36 0.05 A 53 SER CA C 13 58.35 0.05 A 53 SER CB C 13 62.93 0.05 A 53 SER N N 15 113.99 0.05 A 54 SER H H 1 8.05 0.02 A 54 SER C C 13 173.88 0.05 A 54 SER CA C 13 58.50 0.05 A 54 SER CB C 13 62.96 0.05 A 54 SER N N 15 113.51 0.05 A 55 GLY H H 1 8.14 0.02 A 55 GLY CA C 13 44.20 0.05 A 55 GLY N N 15 112.64 0.05 A 56 ASP C C 13 175.60 0.05 A 56 ASP CA C 13 54.10 0.05 A 56 ASP CB C 13 41.00 0.05 A 57 TYR H H 1 8.15 0.02 A 57 TYR CA C 13 57.28 0.05 A 57 TYR CB C 13 38.40 0.05 A 57 TYR N N 15 121.14 0.05 A 59 LYS CA C 13 55.41 0.05 A 59 LYS CB C 13 34.22 0.05 A 60 ASN H H 1 8.36 0.02 A 60 ASN C C 13 175.26 0.05 A 60 ASN CA C 13 52.20 0.05 A 60 ASN CB C 13 40.23 0.05 A 60 ASN N N 15 122.74 0.05 A 61 GLN H H 1 8.53 0.02 A 61 GLN C C 13 172.50 0.05 A 61 GLN CA C 13 54.74 0.05 A 61 GLN CB C 13 34.84 0.05 A 61 GLN N N 15 120.45 0.05 A 62 TYR H H 1 8.61 0.02 A 62 TYR C C 13 171.43 0.05 A 62 TYR CA C 13 56.84 0.05 A 62 TYR CB C 13 39.93 0.05 A 62 TYR N N 15 123.62 0.05 A 63 TYR H H 1 8.40 0.02 A 63 TYR C C 13 174.28 0.05 A 63 TYR CA C 13 54.58 0.05 A 63 TYR CB C 13 41.32 0.05 A 63 TYR N N 15 123.92 0.05 A 64 GLY H H 1 8.76 0.02 A 64 GLY C C 13 174.09 0.05 A 64 GLY CA C 13 44.57 0.05 A 64 GLY N N 15 107.51 0.05 A 65 ILE H H 1 8.90 0.02 A 65 ILE C C 13 174.35 0.05 A 65 ILE CA C 13 59.96 0.05 A 65 ILE CB C 13 39.74 0.05 A 65 ILE N N 15 128.47 0.05 A 66 THR H H 1 8.90 0.02 A 66 THR C C 13 172.60 0.05 A 66 THR CA C 13 58.67 0.05 A 66 THR CB C 13 73.10 0.05 A 66 THR N N 15 115.89 0.05 A 67 ALA H H 1 9.37 0.02 A 67 ALA C C 13 176.67 0.05 A 67 ALA CA C 13 51.50 0.05 A 67 ALA CB C 13 22.06 0.05 A 67 ALA N N 15 119.73 0.05 A 68 GLY H H 1 8.90 0.02 A 68 GLY CA C 13 45.92 0.05 A 68 GLY N N 15 104.24 0.05 A 69 PRO CA C 13 61.04 0.05 A 69 PRO CB C 13 32.69 0.05 A 70 ALA H H 1 7.87 0.02 A 70 ALA C C 13 175.59 0.05 A 70 ALA CA C 13 49.49 0.05 A 70 ALA CB C 13 20.98 0.05 A 70 ALA N N 15 120.22 0.05 A 71 TYR H H 1 9.78 0.02 A 71 TYR C C 13 174.09 0.05 A 71 TYR CA C 13 56.12 0.05 A 71 TYR CB C 13 41.92 0.05 A 71 TYR N N 15 126.08 0.05 A 72 ARG H H 1 8.77 0.02 A 72 ARG C C 13 174.16 0.05 A 72 ARG CA C 13 56.02 0.05 A 72 ARG CB C 13 29.62 0.05 A 72 ARG N N 15 131.41 0.05 A 73 ILE H H 1 8.40 0.02 A 73 ILE C C 13 175.73 0.05 A 73 ILE CA C 13 62.95 0.05 A 73 ILE CB C 13 38.51 0.05 A 73 ILE N N 15 129.55 0.05 A 74 ASN H H 1 7.92 0.02 A 74 ASN C C 13 174.86 0.05 A 74 ASN CA C 13 51.83 0.05 A 74 ASN CB C 13 36.84 0.05 A 74 ASN N N 15 114.87 0.05 A 75 ASP H H 1 8.32 0.02 A 75 ASP C C 13 175.82 0.05 A 75 ASP CA C 13 56.92 0.05 A 75 ASP CB C 13 40.23 0.05 A 75 ASP N N 15 113.98 0.05 A 76 TRP H H 1 7.97 0.02 A 76 TRP C C 13 176.31 0.05 A 76 TRP CA C 13 55.41 0.05 A 76 TRP CB C 13 31.16 0.05 A 76 TRP N N 15 113.60 0.05 A 77 ALA H H 1 7.74 0.02 A 77 ALA C C 13 175.62 0.05 A 77 ALA CA C 13 52.07 0.05 A 77 ALA CB C 13 21.14 0.05 A 77 ALA N N 15 125.52 0.05 A 78 SER H H 1 8.10 0.02 A 78 SER C C 13 170.06 0.05 A 78 SER CA C 13 57.25 0.05 A 78 SER CB C 13 65.32 0.05 A 78 SER N N 15 114.14 0.05 A 79 ILE H H 1 8.96 0.02 A 79 ILE C C 13 172.47 0.05 A 79 ILE CA C 13 58.45 0.05 A 79 ILE CB C 13 42.10 0.05 A 79 ILE N N 15 120.65 0.05 A 80 TYR H H 1 8.36 0.02 A 80 TYR C C 13 173.00 0.05 A 80 TYR CA C 13 55.98 0.05 A 80 TYR CB C 13 41.03 0.05 A 80 TYR N N 15 120.58 0.05 A 81 GLY H H 1 8.05 0.02 A 81 GLY C C 13 170.92 0.05 A 81 GLY CA C 13 44.00 0.05 A 81 GLY N N 15 106.14 0.05 A 82 VAL H H 1 8.49 0.02 A 82 VAL C C 13 174.37 0.05 A 82 VAL CA C 13 58.18 0.05 A 82 VAL CB C 13 35.44 0.05 A 82 VAL N N 15 111.38 0.05 A 83 VAL H H 1 8.97 0.02 A 83 VAL C C 13 174.68 0.05 A 83 VAL CA C 13 59.09 0.05 A 83 VAL CB C 13 36.02 0.05 A 83 VAL N N 15 113.66 0.05 A 84 GLY H H 1 8.48 0.02 A 84 GLY C C 13 171.44 0.05 A 84 GLY CA C 13 46.77 0.05 A 84 GLY N N 15 108.31 0.05 A 85 VAL H H 1 8.92 0.02 A 85 VAL C C 13 172.56 0.05 A 85 VAL CA C 13 59.17 0.05 A 85 VAL CB C 13 35.81 0.05 A 85 VAL N N 15 122.52 0.05 A 86 GLY H H 1 8.88 0.02 A 86 GLY C C 13 172.21 0.05 A 86 GLY CA C 13 43.28 0.05 A 86 GLY N N 15 113.36 0.05 A 87 TYR H H 1 9.31 0.02 A 87 TYR C C 13 174.03 0.05 A 87 TYR CA C 13 55.93 0.05 A 87 TYR CB C 13 42.03 0.05 A 87 TYR N N 15 123.83 0.05 A 88 GLY H H 1 8.00 0.02 A 88 GLY C C 13 170.62 0.05 A 88 GLY CA C 13 44.40 0.05 A 88 GLY N N 15 112.30 0.05 A 89 LYS H H 1 8.23 0.02 A 89 LYS CA C 13 54.48 0.05 A 89 LYS N N 15 122.41 0.05 A 90 PHE C C 13 175.19 0.05 A 90 PHE CA C 13 55.03 0.05 A 90 PHE CB C 13 40.51 0.05 A 91 GLN H H 1 8.37 0.02 A 91 GLN CA C 13 55.33 0.05 A 91 GLN CB C 13 29.70 0.05 A 91 GLN N N 15 122.38 0.05 A 94 GLU C C 13 175.78 0.05 A 94 GLU CA C 13 57.03 0.05 A 94 GLU CB C 13 29.46 0.05 A 95 TYR H H 1 7.83 0.02 A 95 TYR CA C 13 55.29 0.05 A 95 TYR CB C 13 37.73 0.05 A 95 TYR N N 15 120.24 0.05 A 97 THR C C 13 174.32 0.05 A 97 THR CA C 13 62.21 0.05 A 98 TYR H H 1 8.04 0.02 A 98 TYR C C 13 175.00 0.05 A 98 TYR CA C 13 57.53 0.05 A 98 TYR CB C 13 38.35 0.05 A 98 TYR N N 15 122.54 0.05 A 101 ASP C C 13 176.04 0.05 A 101 ASP CA C 13 54.02 0.05 A 101 ASP CB C 13 39.70 0.05 A 102 THR H H 1 8.52 0.02 A 102 THR C C 13 173.84 0.05 A 102 THR CA C 13 61.59 0.05 A 102 THR CB C 13 69.97 0.05 A 102 THR N N 15 117.65 0.05 A 103 SER H H 1 8.24 0.02 A 103 SER C C 13 173.58 0.05 A 103 SER CA C 13 57.31 0.05 A 103 SER N N 15 119.47 0.05 A 104 ASP H H 1 8.27 0.02 A 104 ASP C C 13 173.10 0.05 A 104 ASP CA C 13 53.60 0.05 A 104 ASP CB C 13 44.06 0.05 A 104 ASP N N 15 122.25 0.05 A 105 TYR H H 1 8.56 0.02 A 105 TYR C C 13 175.86 0.05 A 105 TYR CA C 13 55.55 0.05 A 105 TYR CB C 13 41.63 0.05 A 105 TYR N N 15 116.04 0.05 A 106 GLY H H 1 9.19 0.02 A 106 GLY C C 13 172.03 0.05 A 106 GLY CA C 13 44.49 0.05 A 106 GLY N N 15 108.50 0.05 A 107 PHE H H 1 8.86 0.02 A 107 PHE C C 13 175.43 0.05 A 107 PHE CA C 13 57.54 0.05 A 107 PHE CB C 13 40.20 0.05 A 107 PHE N N 15 121.42 0.05 A 108 SER H H 1 8.11 0.02 A 108 SER C C 13 171.43 0.05 A 108 SER CA C 13 56.10 0.05 A 108 SER CB C 13 65.72 0.05 A 108 SER N N 15 123.25 0.05 A 109 TYR H H 1 8.48 0.02 A 109 TYR C C 13 173.56 0.05 A 109 TYR CA C 13 55.32 0.05 A 109 TYR CB C 13 39.56 0.05 A 109 TYR N N 15 117.84 0.05 A 110 GLY H H 1 8.98 0.02 A 110 GLY C C 13 171.35 0.05 A 110 GLY CA C 13 46.16 0.05 A 110 GLY N N 15 106.40 0.05 A 111 ALA H H 1 8.39 0.02 A 111 ALA C C 13 174.64 0.05 A 111 ALA CA C 13 50.97 0.05 A 111 ALA CB C 13 22.15 0.05 A 111 ALA N N 15 119.14 0.05 A 112 GLY H H 1 7.82 0.02 A 112 GLY C C 13 169.77 0.05 A 112 GLY CA C 13 45.27 0.05 A 112 GLY N N 15 106.07 0.05 A 113 LEU H H 1 8.93 0.02 A 113 LEU C C 13 175.09 0.05 A 113 LEU CA C 13 52.69 0.05 A 113 LEU CB C 13 46.56 0.05 A 113 LEU N N 15 116.37 0.05 A 114 GLN H H 1 7.86 0.02 A 114 GLN C C 13 176.91 0.05 A 114 GLN CA C 13 53.73 0.05 A 114 GLN CB C 13 33.29 0.05 A 114 GLN N N 15 115.86 0.05 A 115 PHE H H 1 9.75 0.02 A 115 PHE C C 13 175.74 0.05 A 115 PHE CA C 13 55.20 0.05 A 115 PHE CB C 13 43.37 0.05 A 115 PHE N N 15 126.58 0.05 A 116 ASN H H 1 9.45 0.02 A 116 ASN CA C 13 51.20 0.05 A 116 ASN CB C 13 40.65 0.05 A 116 ASN N N 15 119.92 0.05 A 117 PRO CA C 13 63.70 0.05 A 118 MET H H 1 7.31 0.02 A 118 MET C C 13 176.13 0.05 A 118 MET CA C 13 53.98 0.05 A 118 MET CB C 13 36.31 0.05 A 118 MET N N 15 110.53 0.05 A 119 GLU H H 1 9.12 0.02 A 119 GLU C C 13 176.81 0.05 A 119 GLU CA C 13 59.60 0.05 A 119 GLU CB C 13 29.15 0.05 A 119 GLU N N 15 120.32 0.05 A 120 ASN H H 1 8.43 0.02 A 120 ASN C C 13 174.08 0.05 A 120 ASN CA C 13 53.40 0.05 A 120 ASN CB C 13 38.83 0.05 A 120 ASN N N 15 112.49 0.05 A 121 VAL H H 1 7.50 0.02 A 121 VAL C C 13 174.75 0.05 A 121 VAL CA C 13 60.69 0.05 A 121 VAL CB C 13 34.90 0.05 A 121 VAL N N 15 117.76 0.05 A 122 ALA H H 1 8.23 0.02 A 122 ALA C C 13 175.14 0.05 A 122 ALA CA C 13 49.39 0.05 A 122 ALA CB C 13 22.82 0.05 A 122 ALA N N 15 127.19 0.05 A 123 LEU H H 1 8.91 0.02 A 123 LEU C C 13 174.31 0.05 A 123 LEU CA C 13 53.66 0.05 A 123 LEU CB C 13 44.51 0.05 A 123 LEU N N 15 120.27 0.05 A 124 ASP H H 1 8.58 0.02 A 124 ASP C C 13 171.83 0.05 A 124 ASP CA C 13 53.82 0.05 A 124 ASP CB C 13 47.49 0.05 A 124 ASP N N 15 127.35 0.05 A 125 PHE H H 1 8.67 0.02 A 125 PHE C C 13 174.13 0.05 A 125 PHE CA C 13 55.66 0.05 A 125 PHE CB C 13 42.70 0.05 A 125 PHE N N 15 123.39 0.05 A 126 SER H H 1 9.39 0.02 A 126 SER C C 13 169.98 0.05 A 126 SER CA C 13 58.12 0.05 A 126 SER CB C 13 66.95 0.05 A 126 SER N N 15 118.68 0.05 A 127 TYR H H 1 8.61 0.02 A 127 TYR C C 13 174.39 0.05 A 127 TYR CA C 13 55.44 0.05 A 127 TYR CB C 13 43.10 0.05 A 127 TYR N N 15 119.08 0.05 A 128 GLU H H 1 8.51 0.02 A 128 GLU C C 13 172.59 0.05 A 128 GLU CA C 13 54.13 0.05 A 128 GLU CB C 13 33.50 0.05 A 128 GLU N N 15 130.07 0.05 A 129 GLN H H 1 9.33 0.02 A 129 GLN C C 13 173.69 0.05 A 129 GLN CA C 13 53.21 0.05 A 129 GLN CB C 13 31.05 0.05 A 129 GLN N N 15 128.67 0.05 A 130 SER H H 1 8.58 0.02 A 130 SER C C 13 174.21 0.05 A 130 SER CA C 13 56.45 0.05 A 130 SER CB C 13 66.26 0.05 A 130 SER N N 15 118.63 0.05 A 131 ARG H H 1 7.69 0.02 A 131 ARG C C 13 174.74 0.05 A 131 ARG CA C 13 55.34 0.05 A 131 ARG CB C 13 30.91 0.05 A 131 ARG N N 15 126.85 0.05 A 132 ILE H H 1 8.73 0.02 A 132 ILE C C 13 175.50 0.05 A 132 ILE CA C 13 58.89 0.05 A 132 ILE CB C 13 38.32 0.05 A 132 ILE N N 15 129.47 0.05 A 133 ARG H H 1 9.40 0.02 A 133 ARG CA C 13 58.11 0.05 A 133 ARG CB C 13 27.32 0.05 A 133 ARG N N 15 127.22 0.05 A 134 SER C C 13 173.29 0.05 A 134 SER CA C 13 58.49 0.05 A 134 SER CB C 13 62.86 0.05 A 135 VAL H H 1 8.27 0.02 A 135 VAL C C 13 174.65 0.05 A 135 VAL CA C 13 61.87 0.05 A 135 VAL CB C 13 32.06 0.05 A 135 VAL N N 15 124.81 0.05 A 136 ASP H H 1 8.01 0.02 A 136 ASP C C 13 175.13 0.05 A 136 ASP CA C 13 54.22 0.05 A 136 ASP CB C 13 41.75 0.05 A 136 ASP N N 15 127.75 0.05 A 137 VAL H H 1 8.72 0.02 A 137 VAL C C 13 174.69 0.05 A 137 VAL CA C 13 60.45 0.05 A 137 VAL CB C 13 32.80 0.05 A 137 VAL N N 15 124.52 0.05 A 138 GLY H H 1 8.24 0.02 A 138 GLY C C 13 172.93 0.05 A 138 GLY CA C 13 44.48 0.05 A 138 GLY N N 15 116.92 0.05 A 139 THR H H 1 8.71 0.02 A 139 THR C C 13 171.92 0.05 A 139 THR CA C 13 60.89 0.05 A 139 THR CB C 13 70.29 0.05 A 139 THR N N 15 125.07 0.05 A 140 TRP H H 1 8.33 0.02 A 140 TRP C C 13 175.07 0.05 A 140 TRP CA C 13 55.13 0.05 A 140 TRP CB C 13 32.10 0.05 A 140 TRP N N 15 125.84 0.05 A 141 ILE H H 1 8.98 0.02 A 141 ILE C C 13 174.87 0.05 A 141 ILE CA C 13 60.39 0.05 A 141 ILE CB C 13 40.63 0.05 A 141 ILE N N 15 123.24 0.05 A 142 ALA H H 1 8.35 0.02 A 142 ALA C C 13 175.70 0.05 A 142 ALA CA C 13 50.53 0.05 A 142 ALA CB C 13 22.21 0.05 A 142 ALA N N 15 127.68 0.05 A 143 GLY H H 1 9.52 0.02 A 143 GLY C C 13 172.09 0.05 A 143 GLY CA C 13 45.43 0.05 A 143 GLY N N 15 109.03 0.05 A 144 VAL H H 1 8.75 0.02 A 144 VAL C C 13 174.01 0.05 A 144 VAL CA C 13 58.27 0.05 A 144 VAL CB C 13 35.49 0.05 A 144 VAL N N 15 114.11 0.05 A 145 GLY H H 1 8.59 0.02 A 145 GLY C C 13 171.21 0.05 A 145 GLY CA C 13 46.77 0.05 A 145 GLY N N 15 107.36 0.05 A 146 TYR H H 1 8.37 0.02 A 146 TYR C C 13 172.44 0.05 A 146 TYR CA C 13 55.25 0.05 A 146 TYR CB C 13 44.27 0.05 A 146 TYR N N 15 121.96 0.05 A 147 ARG H H 1 7.69 0.02 A 147 ARG C C 13 173.85 0.05 A 147 ARG CA C 13 53.36 0.05 A 147 ARG CB C 13 32.42 0.05 A 147 ARG N N 15 129.59 0.05 A 148 PHE H H 1 8.80 0.02 A 148 PHE CA C 13 57.68 0.05 A 148 PHE CB C 13 39.99 0.05 A 148 PHE N N 15 128.55 0.05 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 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 SER H A 148 PHE H 1.0 0.0 2.8 2 2 A 4 THR H A 29 ARG H 1.0 0.0 2.8 3 3 A 5 VAL H A 146 TYR H 1.0 0.0 2.8 4 4 A 6 THR H A 27 LYS H 1.0 0.0 2.8 5 5 A 7 GLY H A 144 VAL H 1.0 0.0 2.8 6 6 A 8 GLY H A 25 ASN H 1.0 0.0 2.8 7 7 A 9 TYR H A 142 ALA H 1.0 0.0 2.8 8 8 A 10 ALA H A 23 GLY H 1.0 0.0 2.8 9 9 A 11 GLN H A 140 TRP H 1.0 0.0 2.8 10 10 A 12 SER H A 21 MET H 1.0 0.0 2.8 11 11 A 13 ASP H A 138 GLY H 1.0 0.0 2.8 12 12 A 22 GLY H A 47 GLU H 1.0 0.0 2.9 13 13 A 24 PHE H A 45 TYR H 1.0 0.0 2.8 14 14 A 26 LEU H A 43 PHE H 1.0 0.0 2.8 15 15 A 28 TYR H A 41 GLY H 1.0 0.0 2.8 16 16 A 30 TYR H A 39 VAL H 1.0 0.0 2.8 17 17 A 31 GLU H A 2 THR H 1.0 0.0 5.0 18 18 A 3 SER H A 31 GLU H 1.0 0.0 5.0 19 19 A 38 GLY H A 70 ALA H 1.0 0.0 3.2 20 20 A 40 ILE H A 68 GLY H 1.0 0.0 2.8 21 21 A 42 SER H A 66 THR H 1.0 0.0 2.8 22 22 A 44 THR H A 64 GLY H 1.0 0.0 2.8 23 23 A 46 THR H A 62 TYR H 1.0 0.0 2.8 24 24 A 50 ARG H A 58 ASN H 1.0 0.0 5.0 25 25 A 54 SER H A 56 ASP H 1.0 0.0 5.0 26 26 A 61 GLN H A 89 LYS H 1.0 0.0 2.8 27 27 A 63 TYR H A 87 TYR H 1.0 0.0 2.8 28 28 A 65 ILE H A 85 VAL H 1.0 0.0 2.8 29 29 A 67 ALA H A 83 VAL H 1.0 0.0 2.8 30 30 A 71 TYR H A 79 ILE H 1.0 0.0 3.2 31 31 A 78 SER H A 114 GLN H 1.0 0.0 2.8 32 32 A 80 TYR H A 112 GLY H 1.0 0.0 2.8 33 33 A 82 VAL H A 110 GLY H 1.0 0.0 2.8 34 34 A 84 GLY H A 108 SER H 1.0 0.0 2.9 35 35 A 86 GLY H A 106 GLY H 1.0 0.0 2.8 36 36 A 88 GLY H A 104 ASP H 1.0 0.0 2.8 37 37 A 90 PHE H A 102 THR H 1.0 0.0 2.8 38 38 A 107 PHE H A 131 ARG H 1.0 0.0 4.0 39 39 A 108 SER H A 86 GLY H 1.0 0.0 4.0 40 40 A 109 TYR H A 129 GLN H 1.0 0.0 2.8 41 41 A 111 ALA H A 127 TYR H 1.0 0.0 2.8 42 42 A 113 LEU H A 125 PHE H 1.0 0.0 2.8 43 43 A 115 PHE H A 123 LEU H 1.0 0.0 3.2 44 44 A 120 ASN H A 121 VAL H 1.0 0.0 2.8 45 45 A 122 ALA H A 145 GLY H 1.0 0.0 3.2 46 46 A 124 ASP H A 143 GLY H 1.0 0.0 2.9 47 47 A 126 SER H A 141 ILE H 1.0 0.0 2.8 48 48 A 128 GLU H A 139 THR H 1.0 0.0 2.8 49 49 A 130 SER H A 137 VAL H 1.0 0.0 3.2 50 50 A 137 VAL H A 129 GLN HE2y 1.0 0.0 5.7 51 50 A 137 VAL H A 129 GLN HE2x 1.0 0.0 5.7 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 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 8 GLY H A 25 ASN O 1.0 1.8 2.6 2 2 A 25 ASN O A 8 GLY N 1.0 2.6 3.5 3 3 A 25 ASN H A 8 GLY O 1.0 1.8 2.6 4 4 A 8 GLY O A 25 ASN N 1.0 2.6 3.5 5 5 A 10 ALA H A 23 GLY O 1.0 1.8 2.6 6 6 A 23 GLY O A 10 ALA N 1.0 2.6 3.5 7 7 A 23 GLY H A 10 ALA O 1.0 1.8 2.6 8 8 A 10 ALA O A 23 GLY N 1.0 2.6 3.5 9 9 A 12 SER H A 21 MET O 1.0 1.8 2.6 10 10 A 21 MET O A 12 SER N 1.0 2.6 3.5 11 11 A 21 MET H A 12 SER O 1.0 1.8 2.6 12 12 A 12 SER O A 21 MET N 1.0 2.6 3.5 13 13 A 5 VAL H A 146 TYR O 1.0 1.8 2.6 14 14 A 146 TYR O A 5 VAL N 1.0 2.6 3.5 15 15 A 7 GLY H A 144 VAL O 1.0 1.8 2.6 16 16 A 144 VAL O A 7 GLY N 1.0 2.6 3.5 17 17 A 144 VAL H A 7 GLY O 1.0 1.8 2.6 18 18 A 7 GLY O A 144 VAL N 1.0 2.6 3.5 19 19 A 9 TYR H A 142 ALA O 1.0 1.8 2.6 20 20 A 142 ALA O A 9 TYR N 1.0 2.6 3.5 21 21 A 142 ALA H A 9 TYR O 1.0 1.8 2.6 22 22 A 9 TYR O A 142 ALA N 1.0 2.6 3.5 23 23 A 11 GLN H A 140 TRP O 1.0 1.8 2.6 24 24 A 140 TRP O A 11 GLN N 1.0 2.6 3.5 25 25 A 140 TRP H A 11 GLN O 1.0 1.8 2.6 26 26 A 11 GLN O A 140 TRP N 1.0 2.6 3.5 27 27 A 13 ASP H A 138 GLY O 1.0 1.8 2.6 28 28 A 138 GLY O A 13 ASP N 1.0 2.6 3.5 29 29 A 22 GLY H A 47 GLU O 1.0 1.8 2.6 30 30 A 47 GLU O A 22 GLY N 1.0 2.6 3.5 31 31 A 47 GLU H A 22 GLY O 1.0 1.8 2.6 32 32 A 22 GLY O A 47 GLU N 1.0 2.6 3.5 33 33 A 24 PHE H A 45 TYR O 1.0 1.8 2.6 34 34 A 45 TYR O A 24 PHE N 1.0 2.6 3.5 35 35 A 45 TYR H A 24 PHE O 1.0 1.8 2.6 36 36 A 24 PHE O A 45 TYR N 1.0 2.6 3.5 37 37 A 26 LEU H A 43 PHE O 1.0 1.8 2.6 38 38 A 43 PHE O A 26 LEU N 1.0 2.6 3.5 39 39 A 43 PHE H A 26 LEU O 1.0 1.8 2.6 40 40 A 26 LEU O A 43 PHE N 1.0 2.6 3.5 41 41 A 28 TYR H A 41 GLY O 1.0 1.8 2.6 42 42 A 41 GLY O A 28 TYR N 1.0 2.6 3.5 43 43 A 41 GLY H A 28 TYR O 1.0 1.8 2.6 44 44 A 28 TYR O A 41 GLY N 1.0 2.6 3.5 45 45 A 38 GLY H A 70 ALA O 1.0 1.8 2.6 46 46 A 70 ALA O A 38 GLY N 1.0 2.6 3.5 47 47 A 70 ALA H A 38 GLY O 1.0 1.8 2.6 48 48 A 38 GLY O A 70 ALA N 1.0 2.6 3.5 49 49 A 40 ILE H A 68 GLY O 1.0 1.8 2.6 50 50 A 68 GLY O A 40 ILE N 1.0 2.6 3.5 51 51 A 68 GLY H A 40 ILE O 1.0 1.8 2.6 52 52 A 40 ILE O A 68 GLY N 1.0 2.6 3.5 53 53 A 42 SER H A 66 THR O 1.0 1.8 2.6 54 54 A 66 THR O A 42 SER N 1.0 2.6 3.5 55 55 A 66 THR H A 42 SER O 1.0 1.8 2.6 56 56 A 42 SER O A 66 THR N 1.0 2.6 3.5 57 57 A 44 THR H A 64 GLY O 1.0 1.8 2.6 58 58 A 64 GLY O A 44 THR N 1.0 2.6 3.5 59 59 A 64 GLY H A 44 THR O 1.0 1.8 2.6 60 60 A 44 THR O A 64 GLY N 1.0 2.6 3.5 61 61 A 61 GLN H A 89 LYS O 1.0 1.8 2.6 62 62 A 89 LYS O A 61 GLN N 1.0 2.6 3.5 63 63 A 89 LYS H A 61 GLN O 1.0 1.8 2.6 64 64 A 61 GLN O A 89 LYS N 1.0 2.6 3.5 65 65 A 63 TYR H A 87 TYR O 1.0 1.8 2.6 66 66 A 87 TYR O A 63 TYR N 1.0 2.6 3.5 67 67 A 87 TYR H A 63 TYR O 1.0 1.8 2.6 68 68 A 63 TYR O A 87 TYR N 1.0 2.6 3.5 69 69 A 65 ILE H A 85 VAL O 1.0 1.8 2.6 70 70 A 85 VAL O A 65 ILE N 1.0 2.6 3.5 71 71 A 85 VAL H A 65 ILE O 1.0 1.8 2.6 72 72 A 65 ILE O A 85 VAL N 1.0 2.6 3.5 73 73 A 67 ALA H A 83 VAL O 1.0 1.8 2.6 74 74 A 83 VAL O A 67 ALA N 1.0 2.6 3.5 75 75 A 83 VAL H A 67 ALA O 1.0 1.8 2.6 76 76 A 67 ALA O A 83 VAL N 1.0 2.6 3.5 77 77 A 81 GLY H A 69 PRO O 1.0 1.8 2.6 78 78 A 69 PRO O A 81 GLY N 1.0 2.6 3.5 79 79 A 71 TYR H A 79 ILE O 1.0 1.8 2.6 80 80 A 79 ILE O A 71 TYR N 1.0 2.6 3.5 81 81 A 79 ILE H A 71 TYR O 1.0 1.8 2.6 82 82 A 71 TYR O A 79 ILE N 1.0 2.6 3.5 83 83 A 88 GLY H A 104 ASP O 1.0 1.8 2.6 84 84 A 104 ASP O A 88 GLY N 1.0 2.6 3.5 85 85 A 86 GLY H A 106 GLY O 1.0 1.8 2.6 86 86 A 106 GLY O A 86 GLY N 1.0 2.6 3.5 87 87 A 106 GLY H A 86 GLY O 1.0 1.8 2.6 88 88 A 86 GLY O A 106 GLY N 1.0 2.6 3.5 89 89 A 84 GLY H A 108 SER O 1.0 1.8 2.6 90 90 A 108 SER O A 84 GLY N 1.0 2.6 3.5 91 91 A 108 SER H A 84 GLY O 1.0 1.8 2.6 92 92 A 84 GLY O A 108 SER N 1.0 2.6 3.5 93 93 A 82 VAL H A 110 GLY O 1.0 1.8 2.6 94 94 A 110 GLY O A 82 VAL N 1.0 2.6 3.5 95 95 A 110 GLY H A 82 VAL O 1.0 1.8 2.6 96 96 A 82 VAL O A 110 GLY N 1.0 2.6 3.5 97 97 A 80 TYR H A 112 GLY O 1.0 1.8 2.6 98 98 A 112 GLY O A 80 TYR N 1.0 2.6 3.5 99 99 A 112 GLY H A 80 TYR O 1.0 1.8 2.6 100 100 A 80 TYR O A 112 GLY N 1.0 2.6 3.5 101 101 A 109 TYR H A 129 GLN O 1.0 1.8 2.6 102 102 A 129 GLN O A 109 TYR N 1.0 2.6 3.5 103 103 A 129 GLN H A 109 TYR O 1.0 1.8 2.6 104 104 A 109 TYR O A 129 GLN N 1.0 2.6 3.5 105 105 A 111 ALA H A 127 TYR O 1.0 1.8 2.6 106 106 A 127 TYR O A 111 ALA N 1.0 2.6 3.5 107 107 A 113 LEU H A 125 PHE O 1.0 1.8 2.6 108 108 A 125 PHE O A 113 LEU N 1.0 2.6 3.5 109 109 A 125 PHE H A 113 LEU O 1.0 1.8 2.6 110 110 A 113 LEU O A 125 PHE N 1.0 2.6 3.5 111 111 A 115 PHE H A 123 LEU O 1.0 1.8 2.6 112 112 A 123 LEU O A 115 PHE N 1.0 2.6 3.5 113 113 A 123 LEU H A 115 PHE O 1.0 1.8 2.6 114 114 A 115 PHE O A 123 LEU N 1.0 2.6 3.5 115 115 A 122 ALA H A 145 GLY O 1.0 1.8 2.6 116 116 A 145 GLY O A 122 ALA N 1.0 2.6 3.5 117 117 A 145 GLY H A 122 ALA O 1.0 1.8 2.6 118 118 A 122 ALA O A 145 GLY N 1.0 2.6 3.5 119 119 A 124 ASP H A 143 GLY O 1.0 1.8 2.6 120 120 A 143 GLY O A 124 ASP N 1.0 2.6 3.5 121 121 A 143 GLY H A 124 ASP O 1.0 1.8 2.6 122 122 A 124 ASP O A 143 GLY N 1.0 2.6 3.5 123 123 A 126 SER H A 141 ILE O 1.0 1.8 2.6 124 124 A 141 ILE O A 126 SER N 1.0 2.6 3.5 125 125 A 141 ILE H A 126 SER O 1.0 1.8 2.6 126 126 A 126 SER O A 141 ILE N 1.0 2.6 3.5 127 127 A 128 GLU H A 139 THR O 1.0 1.8 2.6 128 128 A 139 THR O A 128 GLU N 1.0 2.6 3.5 129 129 A 137 VAL H A 130 SER O 1.0 1.8 2.6 130 130 A 130 SER O A 137 VAL N 1.0 2.6 3.5 stop_ save_