data_nef_c18009_2lkq save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 SER start . . 2 A 2 ARG middle . . 3 A 3 SER middle . . 4 A 4 SER middle . . 5 A 5 LEU middle . . 6 A 6 ARG middle . . 7 A 7 SER middle . . 8 A 8 ARG middle . . 9 A 9 TRP middle . . 10 A 10 GLY middle . false 11 A 11 ARG middle . . 12 A 12 PHE middle . . 13 A 13 LEU middle . . 14 A 14 LEU middle . . 15 A 15 GLN middle . . 16 A 16 ARG middle . . 17 A 17 GLY middle . false 18 A 18 SER middle . . 19 A 19 TRP middle . . 20 A 20 THR middle . . 21 A 21 GLY middle . false 22 A 22 PRO middle . false 23 A 23 ARG middle . . 24 A 24 CYS 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 SER HA H 1 4.044 0.000 A 2 ARG H H 1 8.714 0.005 A 2 ARG HA H 1 4.263 0.005 A 2 ARG HBy H 1 1.721 0.002 A 2 ARG HBx H 1 1.650 0.002 A 2 ARG HDx H 1 3.035 0.009 A 2 ARG HDy H 1 3.035 0.009 A 2 ARG HGx H 1 1.510 0.000 A 2 ARG HGy H 1 1.510 0.000 A 3 SER H H 1 8.369 0.003 A 3 SER HA H 1 4.320 0.002 A 3 SER HBy H 1 3.739 0.000 A 3 SER HBx H 1 3.695 0.001 A 4 SER H H 1 8.318 0.001 A 4 SER HA H 1 4.317 0.002 A 4 SER HBy H 1 3.767 0.006 A 4 SER HBx H 1 3.714 0.003 A 5 LEU H H 1 8.125 0.001 A 5 LEU HA H 1 4.160 0.006 A 5 LEU HBx H 1 1.491 0.002 A 5 LEU HBy H 1 1.491 0.002 A 5 LEU HDx% H 1 0.729 0.023 A 5 LEU HDy% H 1 0.749 0.030 A 5 LEU HG H 1 1.466 0.009 A 6 ARG H H 1 8.154 0.003 A 6 ARG HA H 1 4.107 0.002 A 6 ARG HBy H 1 1.653 0.002 A 6 ARG HBx H 1 1.567 0.004 A 6 ARG HDx H 1 2.962 0.007 A 6 ARG HDy H 1 2.962 0.007 A 6 ARG HGx H 1 1.378 0.004 A 6 ARG HGy H 1 1.378 0.004 A 7 SER H H 1 8.091 0.002 A 7 SER HA H 1 4.235 0.002 A 7 SER HBy H 1 3.712 0.000 A 7 SER HBx H 1 3.636 0.002 A 8 ARG H H 1 8.166 0.005 A 8 ARG HA H 1 4.060 0.002 A 8 ARG HBx H 1 1.447 0.005 A 8 ARG HBy H 1 1.447 0.005 A 8 ARG HDx H 1 2.834 0.004 A 8 ARG HDy H 1 2.834 0.004 A 8 ARG HE H 1 6.873 0.001 A 8 ARG HGx H 1 1.172 0.001 A 8 ARG HGy H 1 1.172 0.001 A 9 TRP H H 1 7.934 0.002 A 9 TRP HA H 1 4.570 0.003 A 9 TRP HBy H 1 3.193 0.001 A 9 TRP HBx H 1 3.048 0.002 A 9 TRP HD1 H 1 7.073 0.003 A 9 TRP HE1 H 1 9.986 0.001 A 9 TRP HE3 H 1 7.432 0.005 A 9 TRP HZ2 H 1 7.321 0.004 A 10 GLY H H 1 7.995 0.002 A 10 GLY HAx H 1 3.645 0.002 A 10 GLY HAy H 1 3.700 0.005 A 11 ARG H H 1 7.931 0.002 A 11 ARG HA H 1 4.024 0.002 A 11 ARG HBy H 1 1.477 0.005 A 11 ARG HBx H 1 1.430 0.006 A 11 ARG HDx H 1 2.920 0.004 A 11 ARG HDy H 1 2.920 0.004 A 11 ARG HE H 1 6.968 0.002 A 11 ARG HGx H 1 1.245 0.003 A 11 ARG HGy H 1 1.245 0.003 A 12 PHE H H 1 8.027 0.001 A 12 PHE HA H 1 4.447 0.002 A 12 PHE HBy H 1 2.984 0.004 A 12 PHE HBx H 1 2.822 0.006 A 12 PHE HDx H 1 7.041 0.001 A 12 PHE HDy H 1 7.041 0.001 A 12 PHE HEx H 1 7.140 0.005 A 12 PHE HEy H 1 7.140 0.005 A 13 LEU H H 1 7.893 0.001 A 13 LEU HA H 1 4.106 0.003 A 13 LEU HBy H 1 1.676 0.000 A 13 LEU HBx H 1 1.580 0.000 A 13 LEU HDx% H 1 0.665 0.001 A 13 LEU HDy% H 1 0.709 0.001 A 13 LEU HG H 1 1.348 0.003 A 14 LEU H H 1 7.920 0.001 A 14 LEU HA H 1 4.132 0.010 A 14 LEU HBx H 1 1.424 0.002 A 14 LEU HBy H 1 1.424 0.002 A 14 LEU HDx% H 1 0.737 0.001 A 14 LEU HDy% H 1 0.700 0.003 A 14 LEU HG H 1 1.352 0.000 A 15 GLN H H 1 8.117 0.002 A 15 GLN HA H 1 4.145 0.006 A 15 GLN HBx H 1 1.811 0.007 A 15 GLN HBy H 1 1.910 0.001 A 15 GLN HE2y H 1 7.336 0.000 A 15 GLN HE2x H 1 6.690 0.000 A 15 GLN HGx H 1 2.146 0.005 A 15 GLN HGy H 1 2.146 0.005 A 16 ARG H H 1 8.123 0.002 A 16 ARG HA H 1 4.167 0.007 A 16 ARG HBy H 1 1.681 0.005 A 16 ARG HBx H 1 1.585 0.007 A 16 ARG HDx H 1 2.956 0.005 A 16 ARG HDy H 1 2.956 0.005 A 16 ARG HE H 1 6.980 0.002 A 16 ARG HGy H 1 1.481 0.004 A 16 ARG HGx H 1 1.432 0.001 A 17 GLY H H 1 8.252 0.002 A 17 GLY HAx H 1 3.769 0.001 A 17 GLY HAy H 1 4.100 0.005 A 18 SER H H 1 8.029 0.002 A 18 SER HA H 1 4.315 0.002 A 18 SER HBx H 1 3.675 0.002 A 18 SER HBy H 1 3.675 0.002 A 19 TRP H H 1 8.159 0.001 A 19 TRP HA H 1 4.594 0.011 A 19 TRP HBx H 1 3.115 0.004 A 19 TRP HBy H 1 3.115 0.004 A 19 TRP HD1 H 1 7.050 0.002 A 19 TRP HE1 H 1 9.890 0.001 A 19 TRP HE3 H 1 7.440 0.003 A 19 TRP HZ2 H 1 7.312 0.000 A 20 THR H H 1 7.844 0.001 A 20 THR HA H 1 4.162 0.002 A 20 THR HB H 1 3.986 0.001 A 20 THR HG2% H 1 0.934 0.001 A 21 GLY H H 1 7.268 0.002 A 21 GLY HAy H 1 3.717 0.000 A 21 GLY HAx H 1 3.665 0.000 A 22 PRO HA H 1 4.287 0.001 A 22 PRO HBx H 1 2.140 0.011 A 22 PRO HBy H 1 2.140 0.011 A 22 PRO HDy H 1 3.447 0.000 A 22 PRO HDx H 1 3.412 0.012 A 22 PRO HGy H 1 1.876 0.001 A 22 PRO HGx H 1 1.847 0.001 A 23 ARG H H 1 8.392 0.004 A 23 ARG HA H 1 4.167 0.000 A 23 ARG HBy H 1 1.694 0.002 A 23 ARG HBx H 1 1.575 0.004 A 23 ARG HDx H 1 2.940 0.003 A 23 ARG HDy H 1 2.940 0.003 A 23 ARG HE H 1 6.946 0.007 A 23 ARG HGx H 1 1.426 0.004 A 23 ARG HGy H 1 1.426 0.004 A 24 CYS HA H 1 4.431 0.003 A 24 CYS HBy H 1 2.995 0.000 A 24 CYS HBx H 1 2.823 0.000 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-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 23 ARG H A 23 ARG HDx 1.0 . 5.50 2 1 A 23 ARG H A 23 ARG HDy 1.0 . 5.50 3 2 A 23 ARG H A 23 ARG HGx 1.0 . 5.50 4 2 A 23 ARG H A 23 ARG HGy 1.0 . 5.50 5 3 A 23 ARG HE A 23 ARG HBx 1.0 . 5.50 6 4 A 23 ARG HE A 23 ARG HBy 1.0 . 5.50 7 5 A 23 ARG H A 22 PRO HA 1.0 . 3.18 8 6 A 20 THR H A 21 GLY H 1.0 . 3.77 9 7 A 20 THR H A 20 THR HG2% 1.0 . 4.35 10 8 A 20 THR HG2% A 20 THR HA 1.0 . 3.65 11 9 A 21 GLY H A 20 THR HG2% 1.0 . 5.50 12 10 A 21 GLY H A 20 THR HB 1.0 . 4.77 13 11 A 20 THR H A 20 THR HB 1.0 . 3.86 14 12 A 20 THR HA A 19 TRP HD1 1.0 . 5.50 15 13 A 21 GLY H A 20 THR HA 1.0 . 3.34 16 14 A 20 THR H A 19 TRP H 1.0 . 3.85 17 15 A 20 THR H A 19 TRP HBx 1.0 . 4.73 18 15 A 20 THR H A 19 TRP HBy 1.0 . 4.73 19 16 A 19 TRP HE3 A 19 TRP HBx 1.0 . 3.79 20 16 A 19 TRP HBy A 19 TRP HE3 1.0 . 3.79 21 17 A 19 TRP H A 19 TRP HBx 1.0 . 3.07 22 17 A 19 TRP H A 19 TRP HBy 1.0 . 3.07 23 18 A 19 TRP H A 19 TRP HE3 1.0 . 5.50 24 19 A 19 TRP HD1 A 19 TRP H 1.0 . 4.86 25 20 A 19 TRP HD1 A 19 TRP HA 1.0 . 3.97 26 21 A 20 THR H A 19 TRP HA 1.0 . 3.02 27 22 A 19 TRP H A 17 GLY H 1.0 . 2.60 28 23 A 18 SER H A 18 SER HBx 1.0 . 3.30 29 23 A 18 SER H A 18 SER HBy 1.0 . 3.30 30 24 A 19 TRP H A 18 SER HBx 1.0 . 4.55 31 24 A 19 TRP H A 18 SER HBy 1.0 . 4.55 32 25 A 19 TRP H A 18 SER HA 1.0 . 3.03 33 26 A 18 SER H A 16 ARG H 1.0 . 2.73 34 27 A 19 TRP H A 18 SER H 1.0 . 3.20 35 28 A 17 GLY H A 18 SER H 1.0 . 3.55 36 29 A 20 THR HB A 17 GLY HAx 1.0 . 5.22 37 30 A 17 GLY H A 17 GLY HAx 1.0 . 2.93 38 31 A 18 SER H A 17 GLY HAx 1.0 . 3.14 39 32 A 17 GLY H A 17 GLY HAy 1.0 . 2.83 40 33 A 16 ARG HA A 16 ARG HDx 1.0 . 5.50 41 33 A 16 ARG HA A 16 ARG HDy 1.0 . 5.50 42 34 A 16 ARG H A 16 ARG HGx 1.0 . 3.20 43 35 A 16 ARG H A 16 ARG HGy 1.0 . 3.20 44 36 A 16 ARG HE A 16 ARG HBx 1.0 . 5.50 45 37 A 17 GLY H A 16 ARG HBx 1.0 . 3.93 46 38 A 16 ARG HE A 16 ARG HBy 1.0 . 5.50 47 39 A 17 GLY H A 16 ARG HBy 1.0 . 3.93 48 40 A 16 ARG H A 16 ARG HA 1.0 . 2.48 49 41 A 17 GLY H A 16 ARG HA 1.0 . 3.18 50 42 A 17 GLY H A 16 ARG H 1.0 . 3.16 51 43 A 15 GLN H A 15 GLN HGx 1.0 . 3.48 52 43 A 15 GLN H A 15 GLN HGy 1.0 . 3.48 53 44 A 15 GLN HGy A 15 GLN HBy 1.0 . 2.40 54 44 A 15 GLN HBy A 15 GLN HGx 1.0 . 2.40 55 45 A 15 GLN HGy A 15 GLN HBx 1.0 . 2.40 56 45 A 15 GLN HBx A 15 GLN HGx 1.0 . 2.40 57 46 A 15 GLN H A 15 GLN HA 1.0 . 2.47 58 47 A 18 SER H A 15 GLN HA 1.0 . 4.17 59 48 A 19 TRP H A 15 GLN HA 1.0 . 3.02 60 49 A 14 LEU HBy A 14 LEU HDy% 1.0 . 2.90 61 49 A 14 LEU HBx A 14 LEU HDy% 1.0 . 2.90 62 50 A 14 LEU HA A 14 LEU HDy% 1.0 . 4.50 63 51 A 14 LEU HDx% A 14 LEU HBx 1.0 . 2.90 64 51 A 14 LEU HBy A 14 LEU HDx% 1.0 . 2.90 65 52 A 14 LEU HA A 14 LEU HDx% 1.0 . 4.50 66 53 A 14 LEU H A 14 LEU HBx 1.0 . 2.44 67 53 A 14 LEU HBy A 14 LEU H 1.0 . 2.44 68 54 A 14 LEU HA A 14 LEU HBx 1.0 . 2.40 69 54 A 14 LEU HBy A 14 LEU HA 1.0 . 2.40 70 55 A 11 ARG HA A 14 LEU HBx 1.0 . 5.12 71 55 A 14 LEU HBy A 11 ARG HA 1.0 . 5.12 72 56 A 14 LEU H A 14 LEU HG 1.0 . 3.88 73 57 A 17 GLY H A 14 LEU HA 1.0 . 2.68 74 58 A 18 SER H A 14 LEU HA 1.0 . 3.77 75 59 A 14 LEU HA A 14 LEU H 1.0 . 2.94 76 60 A 15 GLN H A 14 LEU HA 1.0 . 3.36 77 61 A 15 GLN H A 14 LEU H 1.0 . 3.17 78 62 A 13 LEU H A 13 LEU HDx% 1.0 . 5.50 79 63 A 13 LEU HDx% A 13 LEU HA 1.0 . 2.94 80 64 A 13 LEU HA A 13 LEU HDy% 1.0 . 2.40 81 65 A 13 LEU HDy% A 10 GLY HAy 1.0 . 5.50 82 66 A 13 LEU HDy% A 10 GLY HAx 1.0 . 5.50 83 67 A 13 LEU H A 13 LEU HG 1.0 . 3.29 84 68 A 13 LEU HA A 13 LEU HG 1.0 . 3.68 85 69 A 14 LEU H A 13 LEU HA 1.0 . 3.36 86 70 A 16 ARG H A 13 LEU HA 1.0 . 2.95 87 71 A 13 LEU H A 12 PHE H 1.0 . 3.08 88 72 A 12 PHE H A 12 PHE HD% 1.0 . 4.15 89 73 A 13 LEU H A 12 PHE HD% 1.0 . 5.37 90 74 A 12 PHE H A 12 PHE HBx 1.0 . 3.53 91 75 A 12 PHE H A 12 PHE HBy 1.0 . 3.53 92 76 A 16 ARG H A 12 PHE HA 1.0 . 5.50 93 77 A 12 PHE HD% A 12 PHE HA 1.0 . 3.39 94 78 A 12 PHE HA A 12 PHE HE% 1.0 . 4.77 95 79 A 13 LEU H A 12 PHE HA 1.0 . 3.31 96 80 A 11 ARG HBy A 11 ARG HGx 1.0 . 2.40 97 80 A 11 ARG HBy A 11 ARG HGy 1.0 . 2.40 98 81 A 11 ARG HBx A 11 ARG HGx 1.0 . 2.57 99 81 A 11 ARG HGy A 11 ARG HBx 1.0 . 2.57 100 82 A 12 PHE H A 11 ARG HGx 1.0 . 4.58 101 82 A 12 PHE H A 11 ARG HGy 1.0 . 4.58 102 83 A 11 ARG H A 11 ARG HGx 1.0 . 4.58 103 83 A 11 ARG HGy A 11 ARG H 1.0 . 4.58 104 84 A 11 ARG HA A 11 ARG HDx 1.0 . 5.50 105 84 A 11 ARG HA A 11 ARG HDy 1.0 . 5.50 106 85 A 12 PHE H A 11 ARG HBx 1.0 . 3.85 107 86 A 11 ARG HBx A 11 ARG HDx 1.0 . 3.08 108 86 A 11 ARG HBx A 11 ARG HDy 1.0 . 3.08 109 87 A 11 ARG HBx A 11 ARG H 1.0 . 2.51 110 88 A 11 ARG HBy A 11 ARG HDx 1.0 . 3.27 111 88 A 11 ARG HBy A 11 ARG HDy 1.0 . 3.27 112 89 A 12 PHE H A 11 ARG HBy 1.0 . 3.63 113 90 A 11 ARG HBy A 11 ARG HE 1.0 . 5.32 114 91 A 11 ARG HBy A 11 ARG H 1.0 . 2.44 115 92 A 11 ARG HA A 11 ARG HBy 1.0 . 2.40 116 93 A 11 ARG HA A 12 PHE H 1.0 . 3.19 117 94 A 14 LEU H A 11 ARG HA 1.0 . 3.63 118 95 A 12 PHE H A 11 ARG H 1.0 . 2.62 119 96 A 13 LEU H A 10 GLY HAx 1.0 . 4.80 120 97 A 10 GLY HAy A 11 ARG H 1.0 . 3.46 121 98 A 9 TRP H A 9 TRP HZ2 1.0 . 5.50 122 99 A 12 PHE HE% A 9 TRP HE3 1.0 . 5.02 123 100 A 9 TRP H A 9 TRP HE3 1.0 . 4.97 124 101 A 9 TRP H A 9 TRP HD1 1.0 . 4.77 125 102 A 9 TRP HBx A 10 GLY H 1.0 . 5.50 126 103 A 9 TRP H A 9 TRP HBx 1.0 . 3.34 127 104 A 9 TRP HE3 A 9 TRP HBx 1.0 . 3.25 128 105 A 9 TRP H A 9 TRP HBy 1.0 . 3.50 129 106 A 10 GLY H A 9 TRP HBy 1.0 . 4.57 130 107 A 9 TRP HD1 A 9 TRP HA 1.0 . 4.32 131 108 A 9 TRP HA A 12 PHE HBx 1.0 . 5.50 132 109 A 9 TRP HA A 12 PHE HBy 1.0 . 5.50 133 110 A 12 PHE H A 9 TRP HA 1.0 . 5.50 134 111 A 10 GLY H A 9 TRP HA 1.0 . 3.08 135 112 A 9 TRP HE3 A 9 TRP HA 1.0 . 2.94 136 113 A 9 TRP H A 8 ARG H 1.0 . 3.12 137 114 A 9 TRP H A 10 GLY H 1.0 . 2.71 138 115 A 8 ARG H A 8 ARG HGx 1.0 . 3.84 139 115 A 8 ARG H A 8 ARG HGy 1.0 . 3.84 140 116 A 8 ARG HBx A 8 ARG HGx 1.0 . 2.40 141 116 A 8 ARG HBy A 8 ARG HGx 1.0 . 2.40 142 116 A 8 ARG HGy A 8 ARG HBx 1.0 . 2.40 143 116 A 8 ARG HGy A 8 ARG HBy 1.0 . 2.40 144 117 A 9 TRP H A 8 ARG HGx 1.0 . 4.34 145 117 A 9 TRP H A 8 ARG HGy 1.0 . 4.34 146 118 A 9 TRP H A 8 ARG HDx 1.0 . 2.40 147 118 A 9 TRP H A 8 ARG HDy 1.0 . 2.40 148 119 A 8 ARG HBx A 8 ARG HDx 1.0 . 3.74 149 119 A 8 ARG HBy A 8 ARG HDx 1.0 . 3.74 150 119 A 8 ARG HDy A 8 ARG HBx 1.0 . 3.74 151 119 A 8 ARG HBy A 8 ARG HDy 1.0 . 3.74 152 120 A 5 LEU HA A 8 ARG HBx 1.0 . 2.40 153 120 A 8 ARG HBy A 5 LEU HA 1.0 . 2.40 154 121 A 8 ARG HE A 8 ARG HBx 1.0 . 5.50 155 121 A 8 ARG HBy A 8 ARG HE 1.0 . 5.50 156 122 A 8 ARG HA A 8 ARG HBx 1.0 . 2.46 157 122 A 8 ARG HBy A 8 ARG HA 1.0 . 2.46 158 123 A 9 TRP HE3 A 8 ARG HBx 1.0 . 5.42 159 123 A 9 TRP HE3 A 8 ARG HBy 1.0 . 5.42 160 124 A 8 ARG H A 8 ARG HBx 1.0 . 3.02 161 124 A 8 ARG H A 8 ARG HBy 1.0 . 3.02 162 125 A 12 PHE H A 8 ARG HA 1.0 . 4.27 163 126 A 9 TRP H A 8 ARG HA 1.0 . 2.85 164 127 A 8 ARG H A 7 SER HBx 1.0 . 4.42 165 128 A 8 ARG H A 7 SER HBy 1.0 . 4.42 166 129 A 11 ARG H A 7 SER HA 1.0 . 5.50 167 130 A 8 ARG H A 7 SER HA 1.0 . 3.02 168 131 A 10 GLY H A 7 SER HA 1.0 . 5.50 169 132 A 6 ARG HA A 6 ARG HGx 1.0 . 2.75 170 132 A 6 ARG HA A 6 ARG HGy 1.0 . 2.75 171 133 A 6 ARG H A 6 ARG HGx 1.0 . 3.99 172 133 A 6 ARG HGy A 6 ARG H 1.0 . 3.99 173 134 A 6 ARG H A 6 ARG HDx 1.0 . 4.30 174 134 A 6 ARG H A 6 ARG HDy 1.0 . 4.30 175 135 A 9 TRP H A 6 ARG HA 1.0 . 4.78 176 136 A 6 ARG HA A 7 SER H 1.0 . 2.90 177 137 A 5 LEU H A 5 LEU HDy% 1.0 . 4.46 178 138 A 5 LEU HBx A 5 LEU HDy% 1.0 . 4.13 179 138 A 5 LEU HBy A 5 LEU HDy% 1.0 . 4.13 180 139 A 5 LEU HDx% A 5 LEU HBx 1.0 . 4.13 181 139 A 5 LEU HBy A 5 LEU HDx% 1.0 . 4.13 182 140 A 5 LEU H A 5 LEU HBx 1.0 . 3.58 183 140 A 5 LEU H A 5 LEU HBy 1.0 . 3.58 184 141 A 5 LEU HA A 5 LEU HG 1.0 . 3.93 185 142 A 5 LEU H A 5 LEU HG 1.0 . 2.87 186 143 A 9 TRP H A 5 LEU HA 1.0 . 5.49 187 144 A 8 ARG H A 5 LEU HA 1.0 . 3.03 188 145 A 5 LEU H A 4 SER H 1.0 . 3.48 189 146 A 4 SER H A 4 SER HBx 1.0 . 4.00 190 147 A 4 SER H A 4 SER HBy 1.0 . 4.00 191 148 A 8 ARG H A 4 SER HA 1.0 . 4.16 192 149 A 5 LEU H A 4 SER HA 1.0 . 3.36 193 150 A 3 SER H A 3 SER HBx 1.0 . 4.21 194 151 A 3 SER H A 3 SER HBy 1.0 . 4.21 195 152 A 7 SER H A 3 SER HA 1.0 . 3.43 196 153 A 5 LEU H A 3 SER H 1.0 . 4.93 197 154 A 3 SER H A 2 ARG H 1.0 . 4.00 198 155 A 2 ARG H A 2 ARG HDx 1.0 . 5.50 199 155 A 2 ARG H A 2 ARG HDy 1.0 . 5.50 200 156 A 2 ARG HA A 2 ARG HDx 1.0 . 5.50 201 156 A 2 ARG HDy A 2 ARG HA 1.0 . 5.50 202 157 A 3 SER H A 2 ARG HA 1.0 . 3.21 203 158 A 21 GLY HAy A 22 PRO HDy 1.0 . 3.69 204 159 A 21 GLY HAy A 22 PRO HDx 1.0 . 3.69 205 160 A 23 ARG H A 22 PRO HBx 1.0 . 4.57 206 160 A 23 ARG H A 22 PRO HBy 1.0 . 4.57 207 161 A 12 PHE HD% A 8 ARG HBx 1.0 . 5.50 208 161 A 12 PHE HD% A 8 ARG HBy 1.0 . 5.50 209 162 A 6 ARG HA A 6 ARG HDx 1.0 . 4.06 210 162 A 6 ARG HA A 6 ARG HDy 1.0 . 4.06 211 163 A 13 LEU HA A 16 ARG HDx 1.0 . 4.37 212 163 A 16 ARG HDy A 13 LEU HA 1.0 . 4.37 213 164 A 13 LEU HA A 12 PHE HD% 1.0 . 5.50 214 165 A 13 LEU HDy% A 10 GLY H 1.0 . 5.50 215 166 A 13 LEU HDy% A 12 PHE H 1.0 . 5.50 216 167 A 21 GLY HAx A 22 PRO HDy 1.0 . 3.69 217 168 A 22 PRO HDx A 21 GLY HAx 1.0 . 3.69 218 169 A 9 TRP HD1 A 10 GLY H 1.0 . 5.50 219 170 A 13 LEU HDy% A 9 TRP HD1 1.0 . 5.41 220 171 A 13 LEU HDy% A 12 PHE HD% 1.0 . 3.87 221 172 A 19 TRP HE3 A 15 GLN HA 1.0 . 5.50 222 173 A 20 THR H A 19 TRP HE3 1.0 . 5.50 223 174 A 7 SER H A 6 ARG HGx 1.0 . 4.82 224 174 A 6 ARG HGy A 7 SER H 1.0 . 4.82 225 175 A 10 GLY H A 8 ARG HBx 1.0 . 4.69 226 175 A 10 GLY H A 8 ARG HBy 1.0 . 4.69 227 176 A 9 TRP HD1 A 8 ARG HBx 1.0 . 5.46 228 176 A 9 TRP HD1 A 8 ARG HBy 1.0 . 5.46 229 177 A 13 LEU HA A 9 TRP HE3 1.0 . 5.50 230 178 A 15 GLN H A 14 LEU HBx 1.0 . 4.38 231 178 A 15 GLN H A 14 LEU HBy 1.0 . 4.38 232 179 A 8 ARG HA A 8 ARG HDx 1.0 . 5.50 233 179 A 8 ARG HDy A 8 ARG HA 1.0 . 5.50 234 180 A 19 TRP HE3 A 18 SER HBx 1.0 . 5.12 235 180 A 19 TRP HE3 A 18 SER HBy 1.0 . 5.12 236 181 A 13 LEU H A 13 LEU HDy% 1.0 . 3.49 237 182 A 13 LEU HDy% A 12 PHE HE% 1.0 . 5.47 238 183 A 13 LEU HDx% A 12 PHE HD% 1.0 . 5.50 239 184 A 21 GLY H A 19 TRP HA 1.0 . 5.28 240 185 A 5 LEU H A 5 LEU HDx% 1.0 . 4.46 241 186 A 19 TRP HZ2 A 21 GLY HAy 1.0 . 5.50 242 187 A 14 LEU HBy A 18 SER HBx 1.0 . 4.75 243 187 A 14 LEU HBx A 18 SER HBx 1.0 . 4.75 244 187 A 18 SER HBy A 14 LEU HBx 1.0 . 4.75 245 187 A 18 SER HBy A 14 LEU HBy 1.0 . 4.75 246 188 A 10 GLY HAy A 11 ARG HBx 1.0 . 5.50 247 189 A 13 LEU HA A 12 PHE HE% 1.0 . 5.50 248 190 A 19 TRP HZ2 A 21 GLY HAx 1.0 . 5.50 249 191 A 17 GLY H A 15 GLN HGx 1.0 . 5.50 250 191 A 17 GLY H A 15 GLN HGy 1.0 . 5.50 251 192 A 11 ARG HA A 13 LEU H 1.0 . 4.82 252 193 A 7 SER H A 8 ARG HBx 1.0 . 4.10 253 193 A 8 ARG HBy A 7 SER H 1.0 . 4.10 254 194 A 14 LEU H A 12 PHE HA 1.0 . 5.50 255 195 A 23 ARG HGy A 23 ARG HBy 1.0 . 2.98 256 195 A 23 ARG HBy A 23 ARG HGx 1.0 . 2.98 257 196 A 21 GLY H A 22 PRO HDy 1.0 . 5.50 258 197 A 21 GLY H A 22 PRO HDx 1.0 . 5.50 259 198 A 23 ARG HGy A 23 ARG HBx 1.0 . 2.98 260 198 A 23 ARG HBx A 23 ARG HGx 1.0 . 2.98 261 199 A 19 TRP H A 17 GLY HAx 1.0 . 5.09 262 200 A 2 ARG HBy A 2 ARG HGx 1.0 . 2.33 263 200 A 2 ARG HBx A 2 ARG HGx 1.0 . 2.33 264 200 A 2 ARG HGy A 2 ARG HBy 1.0 . 2.33 265 200 A 2 ARG HBx A 2 ARG HGy 1.0 . 2.33 266 201 A 3 SER H A 3 SER HBx 1.0 . 3.70 267 201 A 3 SER H A 3 SER HBy 1.0 . 3.70 268 202 A 3 SER HA A 3 SER HBx 1.0 . 2.37 269 202 A 3 SER HA A 3 SER HBy 1.0 . 2.37 270 203 A 5 LEU H A 4 SER HBx 1.0 . 3.08 271 203 A 5 LEU H A 4 SER HBy 1.0 . 3.08 272 204 A 4 SER HBx A 5 LEU HBx 1.0 . 5.34 273 204 A 4 SER HBy A 5 LEU HBx 1.0 . 5.34 274 204 A 5 LEU HBy A 4 SER HBx 1.0 . 5.34 275 204 A 5 LEU HBy A 4 SER HBy 1.0 . 5.34 276 205 A 5 LEU HG A 4 SER HBx 1.0 . 5.34 277 205 A 5 LEU HG A 4 SER HBy 1.0 . 5.34 278 206 A 4 SER HBx A 8 ARG HBx 1.0 . 5.34 279 206 A 4 SER HBy A 8 ARG HBx 1.0 . 5.34 280 206 A 8 ARG HBy A 4 SER HBx 1.0 . 5.34 281 206 A 8 ARG HBy A 4 SER HBy 1.0 . 5.34 282 207 A 6 ARG H A 5 LEU HDy% 1.0 . 4.62 283 207 A 6 ARG H A 5 LEU HDx% 1.0 . 4.62 284 208 A 6 ARG H A 6 ARG HBy 1.0 . 3.50 285 208 A 6 ARG H A 6 ARG HBx 1.0 . 3.50 286 209 A 8 ARG H A 7 SER HBx 1.0 . 3.87 287 209 A 8 ARG H A 7 SER HBy 1.0 . 3.87 288 210 A 7 SER HBy A 8 ARG HBx 1.0 . 5.34 289 210 A 7 SER HBx A 8 ARG HBx 1.0 . 5.34 290 210 A 8 ARG HBy A 7 SER HBx 1.0 . 5.34 291 210 A 8 ARG HBy A 7 SER HBy 1.0 . 5.34 292 211 A 9 TRP HE3 A 12 PHE HBx 1.0 . 5.34 293 211 A 9 TRP HE3 A 12 PHE HBy 1.0 . 5.34 294 212 A 12 PHE H A 12 PHE HBx 1.0 . 2.96 295 212 A 12 PHE H A 12 PHE HBy 1.0 . 2.96 296 213 A 13 LEU H A 12 PHE HBx 1.0 . 3.67 297 213 A 13 LEU H A 12 PHE HBy 1.0 . 3.67 298 214 A 13 LEU HA A 12 PHE HBx 1.0 . 5.34 299 214 A 13 LEU HA A 12 PHE HBy 1.0 . 5.34 300 215 A 12 PHE HD% A 16 ARG HGy 1.0 . 5.34 301 215 A 12 PHE HD% A 16 ARG HGx 1.0 . 5.34 302 216 A 14 LEU H A 14 LEU HDy% 1.0 . 3.32 303 216 A 14 LEU H A 14 LEU HDx% 1.0 . 3.32 304 217 A 14 LEU HA A 14 LEU HDy% 1.0 . 3.07 305 217 A 14 LEU HA A 14 LEU HDx% 1.0 . 3.07 306 218 A 18 SER H A 14 LEU HDy% 1.0 . 5.44 307 218 A 18 SER H A 14 LEU HDx% 1.0 . 5.44 308 219 A 15 GLN H A 15 GLN HBy 1.0 . 3.36 309 219 A 15 GLN H A 15 GLN HBx 1.0 . 3.36 310 220 A 15 GLN HA A 15 GLN HE2x 1.0 . 5.34 311 220 A 15 GLN HA A 15 GLN HE2y 1.0 . 5.34 312 221 A 16 ARG H A 16 ARG HGy 1.0 . 2.79 313 221 A 16 ARG H A 16 ARG HGx 1.0 . 2.79 314 222 A 16 ARG HA A 16 ARG HGy 1.0 . 3.28 315 222 A 16 ARG HA A 16 ARG HGx 1.0 . 3.28 316 223 A 16 ARG HBx A 16 ARG HGy 1.0 . 2.36 317 223 A 16 ARG HBy A 16 ARG HGy 1.0 . 2.36 318 223 A 16 ARG HGx A 16 ARG HBy 1.0 . 2.36 319 223 A 16 ARG HGx A 16 ARG HBx 1.0 . 2.36 320 224 A 17 GLY H A 16 ARG HBy 1.0 . 3.26 321 224 A 17 GLY H A 16 ARG HBx 1.0 . 3.26 322 225 A 17 GLY HAx A 16 ARG HBy 1.0 . 5.34 323 225 A 17 GLY HAx A 16 ARG HBx 1.0 . 5.34 324 226 A 17 GLY H A 16 ARG HGy 1.0 . 3.60 325 226 A 17 GLY H A 16 ARG HGx 1.0 . 3.60 326 227 A 17 GLY HAx A 16 ARG HGy 1.0 . 5.33 327 227 A 17 GLY HAx A 16 ARG HGx 1.0 . 5.33 328 228 A 19 TRP HD1 A 21 GLY HAx 1.0 . 4.34 329 228 A 19 TRP HD1 A 21 GLY HAy 1.0 . 4.34 330 229 A 19 TRP HZ2 A 22 PRO HDy 1.0 . 4.86 331 229 A 19 TRP HZ2 A 22 PRO HDx 1.0 . 4.86 332 230 A 21 GLY HAx A 22 PRO HDy 1.0 . 2.81 333 230 A 21 GLY HAy A 22 PRO HDy 1.0 . 2.81 334 230 A 22 PRO HDx A 21 GLY HAx 1.0 . 2.81 335 230 A 21 GLY HAy A 22 PRO HDx 1.0 . 2.81 336 231 A 23 ARG HBx A 23 ARG HGx 1.0 . 2.31 337 231 A 23 ARG HBy A 23 ARG HGx 1.0 . 2.31 338 231 A 23 ARG HGy A 23 ARG HBy 1.0 . 2.31 339 231 A 23 ARG HGy A 23 ARG HBx 1.0 . 2.31 stop_ save_