data_nef_c18629_2lwi 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_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 2 1 GNP O2G 3 1 MG MG 1 23 SER OG 3 1 MG MG 3 1 MG MG . . . . 3 1 MG MG . . . . 2 1 GNP O2B 3 1 MG MG 3 1 MG MG . . . . stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A -5 GLY start . false 2 A -4 PRO middle . false 3 A -3 LEU middle . . 4 A -2 GLY middle . false 5 A -1 SER middle . . 6 A 0 ASP middle . . 7 A 1 MET middle . . 8 A 2 THR middle . . 9 A 3 GLU middle . . 10 A 4 TYR middle . . 11 A 5 LYS middle . . 12 A 6 LEU middle . . 13 A 7 VAL middle . . 14 A 8 VAL middle . . 15 A 9 VAL middle . . 16 A 10 GLY middle . false 17 A 11 ALA middle . . 18 A 12 GLY middle . false 19 A 13 GLY middle . false 20 A 14 VAL middle . . 21 A 15 GLY middle . false 22 A 16 LYS middle . . 23 A 17 SER middle . . 24 A 18 ALA middle . . 25 A 19 LEU middle . . 26 A 20 THR middle . . 27 A 21 ILE middle . . 28 A 22 GLN middle . . 29 A 23 LEU middle . . 30 A 24 ILE middle . . 31 A 25 GLN middle . . 32 A 26 ASN middle . . 33 A 27 HIS middle . . 34 A 28 PHE middle . . 35 A 29 VAL middle . . 36 A 30 ASP middle . . 37 A 31 GLU middle . . 38 A 32 TYR middle . . 39 A 33 ASP middle . . 40 A 34 PRO middle . false 41 A 35 SER middle . . 42 A 36 ILE middle . . 43 A 37 GLU middle . . 44 A 38 ASP middle . . 45 A 39 SER middle . . 46 A 40 TYR middle . . 47 A 41 ARG middle . . 48 A 42 LYS middle . . 49 A 43 GLN middle . . 50 A 44 VAL middle . . 51 A 45 VAL middle . . 52 A 46 ILE middle . . 53 A 47 ASP middle . . 54 A 48 GLY middle . false 55 A 49 GLU middle . . 56 A 50 THR middle . . 57 A 51 CYS middle . . 58 A 52 LEU middle . . 59 A 53 LEU middle . . 60 A 54 ASP middle . . 61 A 55 ILE middle . . 62 A 56 LEU middle . . 63 A 57 ASP middle . . 64 A 58 THR middle . . 65 A 59 ALA middle . . 66 A 60 GLY middle . false 67 A 61 GLN middle . . 68 A 62 GLU middle . . 69 A 63 GLU middle . . 70 A 64 TYR middle . . 71 A 65 SER middle . . 72 A 66 ALA middle . . 73 A 67 MET middle . . 74 A 68 ARG middle . . 75 A 69 ASP middle . . 76 A 70 GLN middle . . 77 A 71 TYR middle . . 78 A 72 MET middle . . 79 A 73 ARG middle . . 80 A 74 THR middle . . 81 A 75 GLY middle . false 82 A 76 GLU middle . . 83 A 77 GLY middle . false 84 A 78 PHE middle . . 85 A 79 LEU middle . . 86 A 80 CYS middle . . 87 A 81 VAL middle . . 88 A 82 PHE middle . . 89 A 83 ALA middle . . 90 A 84 ILE middle . . 91 A 85 ASN middle . . 92 A 86 ASN middle . . 93 A 87 THR middle . . 94 A 88 LYS middle . . 95 A 89 SER middle . . 96 A 90 PHE middle . . 97 A 91 GLU middle . . 98 A 92 ASP middle . . 99 A 93 ILE middle . . 100 A 94 HIS middle . . 101 A 95 GLN middle . . 102 A 96 TYR middle . . 103 A 97 ARG middle . . 104 A 98 GLU middle . . 105 A 99 GLN middle . . 106 A 100 ILE middle . . 107 A 101 LYS middle . . 108 A 102 ARG middle . . 109 A 103 VAL middle . . 110 A 104 LYS middle . . 111 A 105 ASP middle . . 112 A 106 SER middle . . 113 A 107 ASP middle . . 114 A 108 ASP middle . . 115 A 109 VAL middle . . 116 A 110 PRO middle . false 117 A 111 MET middle . . 118 A 112 VAL middle . . 119 A 113 LEU middle . . 120 A 114 VAL middle . . 121 A 115 GLY middle . false 122 A 116 ASN middle . . 123 A 117 LYS middle . . 124 A 118 CYS middle . . 125 A 119 ASP middle . . 126 A 120 LEU middle . . 127 A 121 ALA middle . . 128 A 122 ALA middle . . 129 A 123 ARG middle . . 130 A 124 THR middle . . 131 A 125 VAL middle . . 132 A 126 GLU middle . . 133 A 127 SER middle . . 134 A 128 ARG middle . . 135 A 129 GLN middle . . 136 A 130 ALA middle . . 137 A 131 GLN middle . . 138 A 132 ASP middle . . 139 A 133 LEU middle . . 140 A 134 ALA middle . . 141 A 135 ARG middle . . 142 A 136 SER middle . . 143 A 137 TYR middle . . 144 A 138 GLY middle . false 145 A 139 ILE middle . . 146 A 140 PRO middle . false 147 A 141 TYR middle . . 148 A 142 ILE middle . . 149 A 143 GLU middle . . 150 A 144 THR middle . . 151 A 145 SER middle . . 152 A 146 ALA middle . . 153 A 147 LYS middle . . 154 A 148 THR middle . . 155 A 149 ARG middle . . 156 A 150 GLN middle . . 157 A 151 GLY middle . false 158 A 152 VAL middle . . 159 A 153 GLU middle . . 160 A 154 ASP middle . . 161 A 155 ALA middle . . 162 A 156 PHE middle . . 163 A 157 TYR middle . . 164 A 158 THR middle . . 165 A 159 LEU middle . . 166 A 160 VAL middle . . 167 A 161 ARG middle . . 168 A 162 GLU middle . . 169 A 163 ILE middle . . 170 A 164 ARG middle . . 171 A 165 GLN middle . . 172 A 166 HIS end . . 173 C 1 GNP . . . 174 B 1 MG . . . 175 D 1 KOB . . . 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 MET HE1 H 1 1.946 0.000 A 1 MET HE2 H 1 1.946 0.000 A 1 MET HE3 H 1 1.946 0.000 A 1 MET CE C 13 16.836 0.000 A 5 LYS HEx H 1 2.773 0.000 A 5 LYS HEy H 1 2.773 0.000 A 5 LYS CE C 13 41.672 0.000 A 6 LEU HDx% H 1 0.657 0.000 A 6 LEU HDy% H 1 0.981 0.000 A 6 LEU CD1 C 13 23.711 0.000 A 6 LEU CD2 C 13 26.648 0.000 A 8 VAL HGx% H 1 0.920 0.000 A 8 VAL HGy% H 1 0.948 0.000 A 8 VAL CG1 C 13 22.341 0.000 A 8 VAL CG2 C 13 20.444 0.000 A 11 ALA HB1 H 1 1.607 0.000 A 11 ALA HB2 H 1 1.607 0.000 A 11 ALA HB3 H 1 1.607 0.000 A 11 ALA CB C 13 19.731 0.000 A 18 ALA HB1 H 1 1.472 0.000 A 18 ALA HB2 H 1 1.472 0.000 A 18 ALA HB3 H 1 1.472 0.000 A 18 ALA CB C 13 18.620 0.000 A 19 LEU HDx% H 1 0.631 0.000 A 19 LEU CD1 C 13 26.586 0.000 A 20 THR HG21 H 1 0.545 0.000 A 20 THR HG22 H 1 0.545 0.000 A 20 THR HG23 H 1 0.545 0.000 A 20 THR CG2 C 13 22.138 0.000 A 21 ILE HD11 H 1 0.625 0.000 A 21 ILE HD12 H 1 0.625 0.000 A 21 ILE HD13 H 1 0.625 0.000 A 21 ILE HG21 H 1 0.677 0.000 A 21 ILE HG22 H 1 0.677 0.000 A 21 ILE HG23 H 1 0.677 0.000 A 21 ILE CD1 C 13 11.970 0.000 A 21 ILE CG2 C 13 17.585 0.000 A 23 LEU HDx% H 1 -0.191 0.000 A 23 LEU HDy% H 1 0.617 0.000 A 23 LEU CD1 C 13 23.758 0.000 A 23 LEU CD2 C 13 22.658 0.000 A 24 ILE HD11 H 1 0.479 0.000 A 24 ILE HD12 H 1 0.479 0.000 A 24 ILE HD13 H 1 0.479 0.000 A 24 ILE CD1 C 13 10.465 0.000 A 29 VAL HGx% H 1 0.625 0.000 A 29 VAL HGy% H 1 0.712 0.000 A 29 VAL CG1 C 13 19.906 0.000 A 29 VAL CG2 C 13 21.338 0.000 A 36 ILE HD11 H 1 0.841 0.000 A 36 ILE HD12 H 1 0.841 0.000 A 36 ILE HD13 H 1 0.841 0.000 A 36 ILE HG21 H 1 0.899 0.000 A 36 ILE HG22 H 1 0.899 0.000 A 36 ILE HG23 H 1 0.899 0.000 A 36 ILE CD1 C 13 13.453 0.000 A 36 ILE CG2 C 13 17.764 0.000 A 44 VAL HGx% H 1 0.670 0.000 A 44 VAL CG1 C 13 19.746 0.000 A 45 VAL HGx% H 1 0.647 0.000 A 45 VAL HGy% H 1 0.895 0.000 A 45 VAL CG1 C 13 20.945 0.000 A 45 VAL CG2 C 13 21.018 0.000 A 46 ILE HG21 H 1 0.526 0.000 A 46 ILE HG22 H 1 0.526 0.000 A 46 ILE HG23 H 1 0.526 0.000 A 46 ILE CG2 C 13 16.330 0.000 A 50 THR HG21 H 1 1.188 0.000 A 50 THR HG22 H 1 1.188 0.000 A 50 THR HG23 H 1 1.188 0.000 A 50 THR CG2 C 13 22.177 0.000 A 52 LEU HDx% H 1 0.773 0.000 A 52 LEU HDy% H 1 0.794 0.000 A 52 LEU CD1 C 13 24.634 0.000 A 52 LEU CD2 C 13 24.836 0.000 A 53 LEU HDx% H 1 0.802 0.000 A 53 LEU CD1 C 13 25.555 0.000 A 55 ILE HD11 H 1 0.540 0.000 A 55 ILE HD12 H 1 0.540 0.000 A 55 ILE HD13 H 1 0.540 0.000 A 55 ILE HG21 H 1 0.873 0.000 A 55 ILE HG22 H 1 0.873 0.000 A 55 ILE HG23 H 1 0.873 0.000 A 55 ILE CD1 C 13 14.679 0.000 A 55 ILE CG2 C 13 19.361 0.000 A 56 LEU HDx% H 1 0.604 0.000 A 56 LEU HDy% H 1 0.649 0.000 A 56 LEU CD1 C 13 25.728 0.000 A 56 LEU CD2 C 13 23.601 0.000 A 59 ALA HB1 H 1 1.469 0.000 A 59 ALA HB2 H 1 1.469 0.000 A 59 ALA HB3 H 1 1.469 0.000 A 59 ALA CB C 13 20.752 0.000 A 66 ALA HB1 H 1 1.480 0.000 A 66 ALA HB2 H 1 1.480 0.000 A 66 ALA HB3 H 1 1.480 0.000 A 66 ALA CB C 13 18.209 0.000 A 67 MET HE1 H 1 2.031 0.000 A 67 MET HE2 H 1 2.031 0.000 A 67 MET HE3 H 1 2.031 0.000 A 67 MET CE C 13 16.864 0.000 A 70 GLN HGx H 1 2.361 0.000 A 70 GLN HGy H 1 2.361 0.000 A 70 GLN CG C 13 33.530 0.000 A 71 TYR HDx H 1 6.995 0.000 A 71 TYR HDy H 1 6.995 0.000 A 71 TYR HEx H 1 6.647 0.000 A 71 TYR HEy H 1 6.647 0.000 A 72 MET HE1 H 1 2.062 0.000 A 72 MET HE2 H 1 2.062 0.000 A 72 MET HE3 H 1 2.062 0.000 A 72 MET CE C 13 17.831 0.000 A 74 THR HG21 H 1 1.280 0.000 A 74 THR HG22 H 1 1.280 0.000 A 74 THR HG23 H 1 1.280 0.000 A 74 THR CG2 C 13 22.002 0.000 A 79 LEU HDx% H 1 0.104 0.000 A 79 LEU HDy% H 1 0.127 0.000 A 79 LEU CD1 C 13 24.864 0.000 A 79 LEU CD2 C 13 25.557 0.000 A 81 VAL HGx% H 1 0.533 0.000 A 81 VAL CG1 C 13 22.770 0.000 A 83 ALA HB1 H 1 1.474 0.000 A 83 ALA HB2 H 1 1.474 0.000 A 83 ALA HB3 H 1 1.474 0.000 A 83 ALA CB C 13 21.736 0.000 A 84 ILE HD11 H 1 0.775 0.000 A 84 ILE HD12 H 1 0.775 0.000 A 84 ILE HD13 H 1 0.775 0.000 A 84 ILE HG21 H 1 0.797 0.000 A 84 ILE HG22 H 1 0.797 0.000 A 84 ILE HG23 H 1 0.797 0.000 A 84 ILE CD1 C 13 15.250 0.000 A 84 ILE CG2 C 13 20.142 0.000 A 87 THR HG21 H 1 1.305 0.000 A 87 THR HG22 H 1 1.305 0.000 A 87 THR HG23 H 1 1.305 0.000 A 87 THR CG2 C 13 22.740 0.000 A 93 ILE HD11 H 1 0.797 0.000 A 93 ILE HD12 H 1 0.797 0.000 A 93 ILE HD13 H 1 0.797 0.000 A 93 ILE HG21 H 1 0.968 0.000 A 93 ILE HG22 H 1 0.968 0.000 A 93 ILE HG23 H 1 0.968 0.000 A 93 ILE CD1 C 13 9.138 0.000 A 93 ILE CG2 C 13 17.357 0.000 A 100 ILE HD11 H 1 0.425 0.000 A 100 ILE HD12 H 1 0.425 0.000 A 100 ILE HD13 H 1 0.425 0.000 A 100 ILE HG21 H 1 -0.105 0.000 A 100 ILE HG22 H 1 -0.105 0.000 A 100 ILE HG23 H 1 -0.105 0.000 A 100 ILE CD1 C 13 15.850 0.000 A 100 ILE CG2 C 13 17.745 0.000 A 103 VAL HGx% H 1 0.995 0.000 A 103 VAL CG1 C 13 21.700 0.000 A 109 VAL HGx% H 1 0.755 0.000 A 109 VAL HGy% H 1 0.985 0.000 A 109 VAL CG1 C 13 21.286 0.000 A 109 VAL CG2 C 13 21.109 0.000 A 111 MET HE1 H 1 1.847 0.000 A 111 MET HE2 H 1 1.847 0.000 A 111 MET HE3 H 1 1.847 0.000 A 111 MET CE C 13 17.254 0.000 A 112 VAL HGx% H 1 0.748 0.000 A 112 VAL HGy% H 1 0.785 0.000 A 112 VAL CG1 C 13 21.808 0.000 A 112 VAL CG2 C 13 22.493 0.000 A 113 LEU HDx% H 1 1.096 0.000 A 113 LEU HDy% H 1 1.386 0.000 A 113 LEU CD1 C 13 27.674 0.000 A 113 LEU CD2 C 13 25.368 0.000 A 114 VAL HGx% H 1 0.607 0.000 A 114 VAL HGy% H 1 0.692 0.000 A 114 VAL CG1 C 13 23.147 0.000 A 114 VAL CG2 C 13 23.355 0.000 A 120 LEU HDx% H 1 0.836 0.000 A 120 LEU CD1 C 13 22.310 0.000 A 121 ALA HB1 H 1 1.434 0.000 A 121 ALA HB2 H 1 1.434 0.000 A 121 ALA HB3 H 1 1.434 0.000 A 121 ALA CB C 13 19.105 0.000 A 122 ALA HB1 H 1 1.319 0.000 A 122 ALA HB2 H 1 1.319 0.000 A 122 ALA HB3 H 1 1.319 0.000 A 122 ALA CB C 13 17.275 0.000 A 125 VAL HGx% H 1 -0.145 0.000 A 125 VAL CG1 C 13 19.113 0.000 A 130 ALA HB1 H 1 0.861 0.000 A 130 ALA HB2 H 1 0.861 0.000 A 130 ALA HB3 H 1 0.861 0.000 A 130 ALA CB C 13 18.613 0.000 A 133 LEU HDx% H 1 0.470 0.000 A 133 LEU HDy% H 1 0.502 0.000 A 133 LEU CD1 C 13 26.145 0.000 A 133 LEU CD2 C 13 22.860 0.000 A 134 ALA HB1 H 1 1.724 0.000 A 134 ALA HB2 H 1 1.724 0.000 A 134 ALA HB3 H 1 1.724 0.000 A 134 ALA CB C 13 18.088 0.000 A 139 ILE HD11 H 1 0.888 0.000 A 139 ILE HD12 H 1 0.888 0.000 A 139 ILE HD13 H 1 0.888 0.000 A 139 ILE CD1 C 13 15.271 0.000 A 142 ILE HD11 H 1 0.718 0.000 A 142 ILE HD12 H 1 0.718 0.000 A 142 ILE HD13 H 1 0.718 0.000 A 142 ILE HG21 H 1 0.675 0.000 A 142 ILE HG22 H 1 0.675 0.000 A 142 ILE HG23 H 1 0.675 0.000 A 142 ILE CD1 C 13 13.844 0.000 A 142 ILE CG2 C 13 17.724 0.000 A 146 ALA HB1 H 1 1.559 0.000 A 146 ALA HB2 H 1 1.559 0.000 A 146 ALA HB3 H 1 1.559 0.000 A 146 ALA CB C 13 18.722 0.000 A 148 THR HG21 H 1 1.046 0.000 A 148 THR HG22 H 1 1.046 0.000 A 148 THR HG23 H 1 1.046 0.000 A 148 THR CG2 C 13 21.022 0.000 A 155 ALA HB1 H 1 1.099 0.000 A 155 ALA HB2 H 1 1.099 0.000 A 155 ALA HB3 H 1 1.099 0.000 A 155 ALA CB C 13 17.352 0.000 A 158 THR HG21 H 1 1.190 0.000 A 158 THR HG22 H 1 1.190 0.000 A 158 THR HG23 H 1 1.190 0.000 A 158 THR CG2 C 13 21.396 0.000 A 160 VAL HGx% H 1 0.064 0.000 A 160 VAL HGy% H 1 0.713 0.000 A 160 VAL CG1 C 13 19.916 0.000 A 160 VAL CG2 C 13 23.731 0.000 A 163 ILE HD11 H 1 0.631 0.000 A 163 ILE HD12 H 1 0.631 0.000 A 163 ILE HD13 H 1 0.631 0.000 A 163 ILE HG21 H 1 1.071 0.000 A 163 ILE HG22 H 1 1.071 0.000 A 163 ILE HG23 H 1 1.071 0.000 A 163 ILE CD1 C 13 15.634 0.000 A 163 ILE CG2 C 13 17.926 0.000 D 1 KOB H1 H 1 7.102 0.008 D 1 KOB H2 H 1 7.542 0.004 D 1 KOB H3 H 1 7.327 0.001 D 1 KOB H4 H 1 7.982 0.003 D 1 KOB H5 H 1 8.919 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 undefined _nef_distance_restraint_list.potential_type . save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _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 95 GLN H A 95 GLN HGy 1.0 . 3.83 2 2 A 43 GLN HGx A 43 GLN HE2x 1.0 . 4.03 3 3 A 43 GLN HGx A 43 GLN HE2y 1.0 . 4.03 4 4 A 43 GLN HE2y A 43 GLN HGy 1.0 . 4.03 5 5 A 116 ASN HBx A 117 LYS H 1.0 . 4.93 6 6 A 116 ASN HBx A 116 ASN H 1.0 . 4.13 7 7 A 117 LYS H A 116 ASN HBy 1.0 . 4.93 8 8 A 41 ARG HA A 41 ARG HDx 1.0 . 5.28 9 9 A 97 ARG HA A 97 ARG HDx 1.0 . 5.19 10 10 A 164 ARG HA A 164 ARG HDy 1.0 . 4.94 11 11 A 164 ARG HA A 164 ARG HDx 1.0 . 4.94 12 12 A 90 PHE H A 90 PHE HBy 1.0 . 3.84 13 13 A 90 PHE H A 90 PHE HBx 1.0 . 3.84 14 14 A 125 VAL HGx% A 125 VAL HA 1.0 . 3.23 15 15 A 125 VAL HGx% A 125 VAL H 1.0 . 4.22 16 16 A 125 VAL H A 125 VAL HG21 1.0 . 4.22 17 17 A 146 ALA HB1 A 28 PHE HZ 1.0 . 5.45 18 18 A 84 ILE HD11 A 123 ARG HE 1.0 . 4.34 19 19 A 20 THR HA A 20 THR HG21 1.0 . 3.68 20 20 A 9 VAL HG21 A 10 GLY H 1.0 . 4.16 21 21 A 111 MET HE1 A 101 LYS H 1.0 . 4.13 22 22 A 111 MET HE1 A 109 VAL H 1.0 . 4.19 23 23 A 100 ILE HG21 A 100 ILE H 1.0 . 3.72 24 24 A 101 LYS H A 100 ILE HG21 1.0 . 4.17 25 25 A 111 MET HE1 A 100 ILE HG21 1.0 . 2.96 26 26 A 100 ILE H A 72 MET HE1 1.0 . 3.76 27 27 A 72 MET HE1 A 72 MET HA 1.0 . 4.19 28 28 A 67 MET HA A 67 MET HE1 1.0 . 3.95 29 29 A 1 MET HE1 A 1 MET HA 1.0 . 3.91 30 30 A 87 THR HB A 88 LYS H 1.0 . 3.80 31 31 A 2 THR H A 51 CYS HA 1.0 . 4.13 32 32 A 2 THR H A 1 MET HGy 1.0 . 4.65 33 33 A 2 THR H A 1 MET HGx 1.0 . 4.65 34 34 A 1 MET HA A 2 THR H 1.0 . 2.87 35 35 A 32 TYR HA A 33 ASP H 1.0 . 3.51 36 36 A 58 THR HA A 59 ALA H 1.0 . 3.19 37 37 A 2 THR HA A 3 GLU H 1.0 . 2.96 38 38 A 3 GLU H A 3 GLU HBy 1.0 . 4.15 39 39 A 3 GLU H A 3 GLU HBx 1.0 . 4.15 40 40 A 3 GLU H A 3 GLU HGy 1.0 . 4.72 41 41 A 3 GLU H A 3 GLU HGx 1.0 . 4.72 42 42 A 3 GLU HA A 4 TYR H 1.0 . 3.20 43 43 A 3 GLU HBx A 4 TYR H 1.0 . 4.71 44 44 A 52 LEU H A 52 LEU HBy 1.0 . 3.89 45 45 A 5 LYS HA A 6 LEU H 1.0 . 3.33 46 46 A 5 LYS H A 5 LYS HGy 1.0 . 4.12 47 47 A 6 LEU H A 6 LEU HDy% 1.0 . 4.30 48 48 A 11 ALA H A 93 ILE HD11 1.0 . 5.23 49 49 A 93 ILE HD11 A 93 ILE H 1.0 . 4.05 50 50 A 7 VAL H A 78 PHE HA 1.0 . 4.05 51 51 A 8 VAL H A 8 VAL HB 1.0 . 4.13 52 52 A 8 VAL H A 7 VAL HB 1.0 . 5.19 53 53 A 41 ARG HBy A 42 LYS H 1.0 . 4.73 54 54 A 42 LYS H A 41 ARG HBx 1.0 . 4.73 55 55 A 8 VAL H A 7 VAL HG21 1.0 . 4.35 56 56 A 8 VAL H A 8 VAL HGx% 1.0 . 4.17 57 57 A 8 VAL H A 8 VAL HGy% 1.0 . 4.17 58 58 A 8 VAL HB A 9 VAL H 1.0 . 5.25 59 59 A 43 GLN HGx A 44 VAL H 1.0 . 4.35 60 60 A 8 VAL HGx% A 9 VAL H 1.0 . 4.22 61 61 A 8 VAL HGy% A 9 VAL H 1.0 . 4.22 62 62 A 9 VAL HG21 A 9 VAL H 1.0 . 3.99 63 63 A 10 GLY H A 9 VAL HA 1.0 . 3.48 64 64 A 10 GLY H A 9 VAL HG11 1.0 . 4.16 65 65 A 11 ALA HB1 A 11 ALA H 1.0 . 3.43 66 66 A 11 ALA H A 14 VAL HG21 1.0 . 4.63 67 67 A 12 GLY H A 60 GLY HAy 1.0 . 4.88 68 68 A 12 GLY H A 60 GLY HAx 1.0 . 4.88 69 69 A 14 VAL H A 14 VAL HB 1.0 . 3.99 70 70 A 18 ALA HB1 A 18 ALA H 1.0 . 3.53 71 71 A 16 LYS HA A 19 LEU H 1.0 . 4.89 72 72 A 18 ALA HB1 A 19 LEU H 1.0 . 3.83 73 73 A 19 LEU H A 19 LEU HG 1.0 . 3.75 74 74 A 52 LEU H A 52 LEU HG 1.0 . 4.35 75 75 A 19 LEU HBx A 20 THR H 1.0 . 4.32 76 76 A 20 THR H A 20 THR HB 1.0 . 3.81 77 77 A 21 ILE H A 21 ILE HB 1.0 . 3.81 78 78 A 21 ILE H A 18 ALA HA 1.0 . 4.83 79 79 A 19 LEU HA A 22 GLN H 1.0 . 4.46 80 80 A 23 LEU H A 23 LEU HBx 1.0 . 3.79 81 81 A 68 ARG HA A 71 TYR H 1.0 . 4.25 82 82 A 23 LEU HBy A 24 ILE H 1.0 . 5.11 83 83 A 23 LEU HBx A 24 ILE H 1.0 . 5.11 84 84 A 112 VAL H A 112 VAL HB 1.0 . 3.95 85 85 A 20 THR HA A 23 LEU H 1.0 . 4.78 86 86 A 24 ILE H A 24 ILE HG1y 1.0 . 4.68 87 87 A 24 ILE H A 24 ILE HG21 1.0 . 3.93 88 88 A 112 VAL HB A 113 LEU H 1.0 . 4.58 89 89 A 25 GLN H A 25 GLN HGx 1.0 . 4.63 90 90 A 24 ILE HG21 A 25 GLN H 1.0 . 4.27 91 91 A 27 HIS HA A 28 PHE H 1.0 . 3.51 92 92 A 28 PHE H A 27 HIS HBy 1.0 . 4.35 93 93 A 28 PHE H A 27 HIS HBx 1.0 . 4.35 94 94 A 18 ALA HB1 A 29 VAL H 1.0 . 5.07 95 95 A 120 LEU HA A 122 ALA H 1.0 . 4.49 96 96 A 30 ASP HBx A 31 GLU H 1.0 . 4.14 97 97 A 31 GLU H A 29 VAL HGx% 1.0 . 4.57 98 98 A 32 TYR H A 31 GLU HA 1.0 . 3.26 99 99 A 33 ASP H A 33 ASP HBx 1.0 . 4.19 100 100 A 34 PRO HA A 35 SER H 1.0 . 3.47 101 101 A 35 SER H A 35 SER HBy 1.0 . 4.04 102 102 A 35 SER H A 35 SER HBx 1.0 . 4.04 103 103 A 35 SER HBy A 36 ILE H 1.0 . 4.41 104 104 A 35 SER HBx A 36 ILE H 1.0 . 4.41 105 105 A 36 ILE HA A 37 GLU H 1.0 . 3.21 106 106 A 37 GLU HA A 38 ASP H 1.0 . 3.19 107 107 A 37 GLU H A 37 GLU HBy 1.0 . 4.05 108 108 A 37 GLU H A 36 ILE HG21 1.0 . 3.78 109 109 A 39 SER HA A 40 TYR H 1.0 . 3.42 110 110 A 39 SER H A 39 SER HBy 1.0 . 3.89 111 111 A 39 SER H A 39 SER HBx 1.0 . 3.89 112 112 A 40 TYR H A 39 SER HBy 1.0 . 3.88 113 113 A 40 TYR H A 39 SER HBx 1.0 . 3.88 114 114 A 40 TYR HA A 41 ARG H 1.0 . 3.35 115 115 A 141 TYR H A 141 TYR HBy 1.0 . 3.93 116 116 A 55 ILE H A 55 ILE HD11 1.0 . 4.06 117 117 A 55 ILE HD11 A 56 LEU H 1.0 . 4.39 118 118 A 78 PHE H A 111 MET HA 1.0 . 3.74 119 119 A 41 ARG H A 24 ILE HD11 1.0 . 4.32 120 120 A 42 LYS H A 24 ILE HD11 1.0 . 4.45 121 121 A 44 VAL H A 43 GLN HA 1.0 . 3.25 122 122 A 42 LYS HGy A 43 GLN H 1.0 . 4.63 123 123 A 43 GLN H A 42 LYS HGx 1.0 . 4.63 124 124 A 44 VAL HA A 45 VAL H 1.0 . 2.95 125 125 A 52 LEU HA A 53 LEU H 1.0 . 3.37 126 126 A 45 VAL HA A 46 ILE H 1.0 . 3.41 127 127 A 45 VAL H A 45 VAL HB 1.0 . 3.38 128 128 A 46 ILE H A 50 THR HA 1.0 . 4.06 129 129 A 45 VAL H A 44 VAL HG21 1.0 . 3.66 130 130 A 163 ILE H A 163 ILE HG1x 1.0 . 4.95 131 131 A 163 ILE H A 163 ILE HG1y 1.0 . 4.95 132 132 A 156 PHE HBx A 157 TYR H 1.0 . 4.32 133 133 A 47 ASP HBx A 48 GLY H 1.0 . 5.48 134 134 A 46 ILE HG21 A 47 ASP H 1.0 . 4.58 135 135 A 48 GLY H A 46 ILE HA 1.0 . 4.79 136 136 A 49 GLU HA A 50 THR H 1.0 . 3.06 137 137 A 49 GLU H A 49 GLU HGy 1.0 . 4.64 138 138 A 49 GLU H A 49 GLU HGx 1.0 . 4.64 139 139 A 50 THR H A 49 GLU HGy 1.0 . 4.64 140 140 A 50 THR H A 49 GLU HGx 1.0 . 4.64 141 141 A 50 THR H A 50 THR HG21 1.0 . 4.29 142 142 A 50 THR HG21 A 51 CYS H 1.0 . 3.51 143 143 A 52 LEU H A 51 CYS HBy 1.0 . 4.02 144 144 A 43 GLN HA A 51 CYS H 1.0 . 4.81 145 145 A 52 LEU HBy A 53 LEU H 1.0 . 4.76 146 146 A 1 MET HGy A 52 LEU H 1.0 . 4.96 147 147 A 1 MET HGx A 52 LEU H 1.0 . 4.96 148 148 A 53 LEU HBx A 54 ASP H 1.0 . 4.78 149 149 A 54 ASP H A 53 LEU HBy 1.0 . 4.78 150 150 A 54 ASP H A 54 ASP HBy 1.0 . 4.06 151 151 A 54 ASP H A 54 ASP HBx 1.0 . 4.06 152 152 A 56 LEU HDy% A 57 ASP H 1.0 . 4.39 153 153 A 55 ILE H A 55 ILE HG1y 1.0 . 4.87 154 154 A 55 ILE H A 55 ILE HG1x 1.0 . 4.87 155 155 A 56 LEU H A 55 ILE HG21 1.0 . 3.71 156 156 A 39 SER HA A 57 ASP H 1.0 . 4.64 157 157 A 57 ASP HBy A 57 ASP H 1.0 . 4.21 158 158 A 57 ASP HBx A 57 ASP H 1.0 . 4.21 159 159 A 56 LEU HDx% A 57 ASP H 1.0 . 4.39 160 160 A 59 ALA H A 58 THR HB 1.0 . 3.54 161 161 A 58 THR H A 58 THR HG21 1.0 . 4.02 162 162 A 59 ALA HA A 60 GLY H 1.0 . 3.29 163 163 A 59 ALA H A 59 ALA HB1 1.0 . 3.29 164 164 A 103 VAL H A 103 VAL HG21 1.0 . 3.72 165 165 A 61 GLN H A 61 GLN HBy 1.0 . 3.87 166 166 A 126 GLU H A 126 GLU HBy 1.0 . 3.61 167 167 A 61 GLN H A 61 GLN HGx 1.0 . 4.37 168 168 A 61 GLN H A 61 GLN HGy 1.0 . 4.37 169 169 A 63 GLU HA A 64 TYR H 1.0 . 3.50 170 170 A 64 TYR H A 64 TYR HBx 1.0 . 3.90 171 171 A 64 TYR HBx A 65 SER H 1.0 . 5.10 172 172 A 66 ALA HB1 A 66 ALA H 1.0 . 4.02 173 173 A 66 ALA HB1 A 67 MET H 1.0 . 3.46 174 174 A 88 LYS HBy A 89 SER H 1.0 . 4.13 175 175 A 69 ASP HBx A 70 GLN H 1.0 . 4.03 176 176 A 70 GLN H A 70 GLN HBy 1.0 . 3.70 177 177 A 70 GLN H A 70 GLN HBx 1.0 . 3.70 178 178 A 71 TYR H A 71 TYR HBy 1.0 . 4.07 179 179 A 71 TYR HBy A 72 MET H 1.0 . 4.88 180 180 A 72 MET H A 71 TYR HBx 1.0 . 4.88 181 181 A 72 MET H A 72 MET HGx 1.0 . 4.17 182 182 A 72 MET H A 72 MET HGy 1.0 . 4.17 183 183 A 73 ARG H A 70 GLN HA 1.0 . 4.19 184 184 A 102 ARG HA A 105 ASP H 1.0 . 4.10 185 185 A 73 ARG H A 73 ARG HDy 1.0 . 4.89 186 186 A 73 ARG H A 73 ARG HGx 1.0 . 4.14 187 187 A 74 THR H A 74 THR HB 1.0 . 3.93 188 188 A 74 THR HB A 75 GLY H 1.0 . 4.25 189 189 A 74 THR H A 71 TYR HA 1.0 . 4.45 190 190 A 75 GLY HAx A 77 GLY H 1.0 . 5.06 191 191 A 74 THR H A 75 GLY HAy 1.0 . 4.96 192 192 A 74 THR H A 74 THR HG21 1.0 . 3.50 193 193 A 142 ILE HD11 A 143 GLU H 1.0 . 4.87 194 194 A 77 GLY H A 76 GLU HBy 1.0 . 4.50 195 195 A 77 GLY H A 76 GLU HBx 1.0 . 4.50 196 196 A 76 GLU H A 76 GLU HGy 1.0 . 4.49 197 197 A 76 GLU H A 76 GLU HGx 1.0 . 4.49 198 198 A 77 GLY H A 76 GLU HGy 1.0 . 5.24 199 199 A 77 GLY H A 76 GLU HGx 1.0 . 5.24 200 200 A 159 LEU H A 159 LEU HD21 1.0 . 4.34 201 201 A 79 LEU HA A 80 CYS H 1.0 . 3.10 202 202 A 80 CYS H A 79 LEU HBx 1.0 . 4.70 203 203 A 79 LEU H A 79 LEU HDx% 1.0 . 4.67 204 204 A 79 LEU H A 79 LEU HDy% 1.0 . 4.67 205 205 A 79 LEU H A 79 LEU HG 1.0 . 5.04 206 206 A 113 LEU HDx% A 114 VAL H 1.0 . 5.00 207 207 A 114 VAL H A 114 VAL HGy% 1.0 . 4.34 208 208 A 5 LYS HA A 54 ASP H 1.0 . 4.42 209 209 A 80 CYS H A 80 CYS HBy 1.0 . 4.12 210 210 A 80 CYS H A 80 CYS HBx 1.0 . 4.12 211 211 A 114 VAL H A 80 CYS HBx 1.0 . 5.50 212 212 A 113 LEU HDy% A 80 CYS H 1.0 . 5.33 213 213 A 80 CYS H A 79 LEU HDx% 1.0 . 4.48 214 214 A 80 CYS H A 79 LEU HDy% 1.0 . 4.48 215 215 A 81 VAL H A 81 VAL HB 1.0 . 4.13 216 216 A 81 VAL H A 81 VAL HGx% 1.0 . 4.41 217 217 A 82 PHE HBy A 83 ALA H 1.0 . 4.47 218 218 A 83 ALA H A 82 PHE HBx 1.0 . 4.47 219 219 A 82 PHE H A 114 VAL HB 1.0 . 4.38 220 220 A 82 PHE H A 81 VAL HG21 1.0 . 3.99 221 221 A 93 ILE HD11 A 82 PHE H 1.0 . 4.81 222 222 A 83 ALA HA A 84 ILE H 1.0 . 3.50 223 223 A 83 ALA H A 83 ALA HB1 1.0 . 3.84 224 224 A 84 ILE H A 83 ALA HB1 1.0 . 3.98 225 225 A 128 ARG H A 128 ARG HDy 1.0 . 5.26 226 226 A 128 ARG H A 128 ARG HDx 1.0 . 5.26 227 227 A 14 VAL HG21 A 83 ALA H 1.0 . 5.48 228 228 A 12 GLY H A 14 VAL HG11 1.0 . 5.41 229 229 A 142 ILE H A 142 ILE HG1y 1.0 . 4.64 230 230 A 84 ILE H A 84 ILE HG1y 1.0 . 4.20 231 231 A 83 ALA HB1 A 85 ASN H 1.0 . 3.70 232 232 A 85 ASN H A 84 ILE HG1x 1.0 . 5.07 233 233 A 84 ILE HG1y A 85 ASN H 1.0 . 5.07 234 234 A 84 ILE HG21 A 85 ASN H 1.0 . 4.63 235 235 A 84 ILE HD11 A 85 ASN H 1.0 . 3.93 236 236 A 84 ILE HD11 A 84 ILE H 1.0 . 4.23 237 237 A 88 LYS H A 86 ASN HA 1.0 . 4.86 238 238 A 87 THR H A 87 THR HG21 1.0 . 5.48 239 239 A 89 SER H A 89 SER HBy 1.0 . 4.19 240 240 A 134 ALA HA A 139 ILE H 1.0 . 4.55 241 241 A 134 ALA HA A 136 SER H 1.0 . 5.25 242 242 A 89 SER H A 87 THR HA 1.0 . 5.12 243 243 A 90 PHE H A 87 THR HA 1.0 . 4.08 244 244 A 90 PHE H A 125 VAL HG21 1.0 . 5.25 245 245 A 90 PHE H A 87 THR HG21 1.0 . 4.71 246 246 A 90 PHE H A 91 GLU HGy 1.0 . 5.09 247 247 A 91 GLU HGy A 91 GLU H 1.0 . 3.91 248 248 A 91 GLU H A 91 GLU HGx 1.0 . 3.91 249 249 A 89 SER HA A 92 ASP H 1.0 . 3.96 250 250 A 93 ILE H A 93 ILE HB 1.0 . 3.19 251 251 A 93 ILE HB A 94 HIS H 1.0 . 4.84 252 252 A 93 ILE H A 93 ILE HG21 1.0 . 3.98 253 253 A 133 LEU HDx% A 133 LEU H 1.0 . 4.39 254 254 A 94 HIS H A 94 HIS HBy 1.0 . 3.68 255 255 A 94 HIS H A 94 HIS HBx 1.0 . 3.68 256 256 A 95 GLN H A 94 HIS HBx 1.0 . 4.12 257 257 A 95 GLN H A 95 GLN HBy 1.0 . 3.77 258 258 A 95 GLN H A 95 GLN HBx 1.0 . 3.77 259 259 A 95 GLN HBx A 96 TYR H 1.0 . 4.27 260 260 A 95 GLN H A 95 GLN HGx 1.0 . 3.83 261 261 A 96 TYR HBx A 97 ARG H 1.0 . 4.86 262 262 A 97 ARG H A 96 TYR HBy 1.0 . 4.86 263 263 A 97 ARG HA A 100 ILE H 1.0 . 4.20 264 264 A 97 ARG H A 94 HIS HA 1.0 . 4.26 265 265 A 163 ILE HG21 A 164 ARG H 1.0 . 4.17 266 266 A 86 ASN H A 124 THR HG21 1.0 . 4.88 267 267 A 143 GLU H A 142 ILE HA 1.0 . 3.00 268 268 A 99 GLN H A 99 GLN HBy 1.0 . 3.65 269 269 A 99 GLN H A 99 GLN HBx 1.0 . 3.65 270 270 A 100 ILE H A 100 ILE HB 1.0 . 3.60 271 271 A 72 MET HGx A 73 ARG H 1.0 . 5.19 272 272 A 99 GLN H A 99 GLN HGx 1.0 . 3.94 273 273 A 101 LYS H A 101 LYS HBy 1.0 . 3.98 274 274 A 101 LYS H A 101 LYS HBx 1.0 . 3.98 275 275 A 129 GLN HA A 132 ASP H 1.0 . 4.03 276 276 A 101 LYS H A 101 LYS HGy 1.0 . 4.38 277 277 A 101 LYS H A 101 LYS HGx 1.0 . 4.38 278 278 A 102 ARG H A 102 ARG HGy 1.0 . 4.78 279 279 A 102 ARG H A 102 ARG HGx 1.0 . 4.78 280 280 A 103 VAL HB A 104 LYS H 1.0 . 4.05 281 281 A 103 VAL H A 100 ILE HA 1.0 . 4.41 282 282 A 41 ARG H A 41 ARG HGy 1.0 . 4.54 283 283 A 41 ARG H A 41 ARG HGx 1.0 . 4.54 284 284 A 104 LYS H A 104 LYS HGy 1.0 . 4.34 285 285 A 104 LYS H A 104 LYS HGx 1.0 . 4.34 286 286 A 104 LYS H A 103 VAL HGx% 1.0 . 3.93 287 287 A 103 VAL HG21 A 104 LYS H 1.0 . 3.93 288 288 A 105 ASP HA A 106 SER H 1.0 . 3.24 289 289 A 105 ASP H A 105 ASP HBy 1.0 . 4.01 290 290 A 106 SER H A 105 ASP HBx 1.0 . 4.91 291 291 A 106 SER H A 105 ASP HBy 1.0 . 4.91 292 292 A 105 ASP H A 103 VAL HA 1.0 . 4.68 293 293 A 106 SER HBy A 107 ASP H 1.0 . 4.60 294 294 A 107 ASP H A 106 SER HBx 1.0 . 4.60 295 295 A 107 ASP H A 107 ASP HBy 1.0 . 3.78 296 296 A 107 ASP H A 107 ASP HBx 1.0 . 3.78 297 297 A 109 VAL H A 108 ASP HA 1.0 . 3.11 298 298 A 109 VAL H A 109 VAL HB 1.0 . 3.86 299 299 A 110 PRO HA A 111 MET H 1.0 . 3.08 300 300 A 109 VAL H A 109 VAL HGx% 1.0 . 4.03 301 301 A 109 VAL H A 109 VAL HGy% 1.0 . 4.03 302 302 A 112 VAL H A 111 MET HA 1.0 . 3.11 303 303 A 111 MET H A 111 MET HGy 1.0 . 4.71 304 304 A 111 MET H A 111 MET HGx 1.0 . 4.71 305 305 A 113 LEU H A 112 VAL HA 1.0 . 3.56 306 306 A 112 VAL H A 111 MET HGy 1.0 . 4.55 307 307 A 112 VAL H A 111 MET HGx 1.0 . 4.55 308 308 A 7 VAL H A 7 VAL HG11 1.0 . 4.15 309 309 A 113 LEU HDx% A 113 LEU H 1.0 . 4.93 310 310 A 113 LEU HDy% A 113 LEU H 1.0 . 4.93 311 311 A 113 LEU H A 112 VAL HGy% 1.0 . 4.47 312 312 A 117 LYS HA A 118 CYS H 1.0 . 3.53 313 313 A 143 GLU HBx A 144 THR H 1.0 . 4.73 314 314 A 118 CYS H A 118 CYS HBx 1.0 . 4.05 315 315 A 118 CYS H A 118 CYS HBy 1.0 . 4.05 316 316 A 119 ASP H A 148 THR HG21 1.0 . 4.76 317 317 A 120 LEU HA A 121 ALA H 1.0 . 3.51 318 318 A 120 LEU H A 120 LEU HBx 1.0 . 3.86 319 319 A 122 ALA H A 120 LEU HBx 1.0 . 4.98 320 320 A 121 ALA H A 121 ALA HB1 1.0 . 3.19 321 321 A 122 ALA H A 121 ALA HB1 1.0 . 3.53 322 322 A 122 ALA H A 122 ALA HB1 1.0 . 2.98 323 323 A 122 ALA HB1 A 123 ARG H 1.0 . 3.68 324 324 A 123 ARG H A 123 ARG HBx 1.0 . 3.67 325 325 A 123 ARG H A 123 ARG HBy 1.0 . 3.67 326 326 A 124 THR HG21 A 124 THR H 1.0 . 3.83 327 327 A 124 THR H A 85 ASN HBx 1.0 . 5.03 328 328 A 124 THR H A 84 ILE HB 1.0 . 4.82 329 329 A 52 LEU HG A 53 LEU H 1.0 . 4.39 330 330 A 84 ILE HD11 A 124 THR H 1.0 . 4.41 331 331 A 125 VAL H A 84 ILE HB 1.0 . 5.02 332 332 A 126 GLU HA A 127 SER H 1.0 . 3.42 333 333 A 126 GLU H A 126 GLU HGy 1.0 . 3.82 334 334 A 127 SER H A 126 GLU HGy 1.0 . 4.96 335 335 A 125 VAL HGx% A 126 GLU H 1.0 . 4.18 336 336 A 125 VAL HG21 A 126 GLU H 1.0 . 4.18 337 337 A 128 ARG HBy A 129 GLN H 1.0 . 4.11 338 338 A 129 GLN H A 129 GLN HBy 1.0 . 3.61 339 339 A 129 GLN H A 129 GLN HBx 1.0 . 3.61 340 340 A 129 GLN HBx A 130 ALA H 1.0 . 3.91 341 341 A 132 ASP H A 131 GLN HBx 1.0 . 3.84 342 342 A 132 ASP H A 131 GLN HBy 1.0 . 3.84 343 343 A 154 ASP H A 154 ASP HBy 1.0 . 3.67 344 344 A 133 LEU H A 133 LEU HBx 1.0 . 3.62 345 345 A 133 LEU HBy A 134 ALA H 1.0 . 4.68 346 346 A 133 LEU HBx A 134 ALA H 1.0 . 4.68 347 347 A 133 LEU HDy% A 133 LEU H 1.0 . 4.39 348 348 A 133 LEU HDx% A 134 ALA H 1.0 . 4.53 349 349 A 133 LEU HDy% A 134 ALA H 1.0 . 4.53 350 350 A 134 ALA H A 133 LEU HG 1.0 . 4.44 351 351 A 132 ASP HA A 135 ARG H 1.0 . 4.04 352 352 A 135 ARG H A 135 ARG HBy 1.0 . 3.75 353 353 A 135 ARG H A 135 ARG HBx 1.0 . 3.75 354 354 A 137 TYR HBy A 138 GLY H 1.0 . 4.68 355 355 A 139 ILE H A 137 TYR HA 1.0 . 4.45 356 356 A 135 ARG HA A 137 TYR H 1.0 . 4.49 357 357 A 134 ALA HA A 137 TYR H 1.0 . 4.41 358 358 A 139 ILE H A 139 ILE HD11 1.0 . 4.10 359 359 A 139 ILE H A 139 ILE HG1y 1.0 . 3.98 360 360 A 138 GLY H A 139 ILE HG1x 1.0 . 4.85 361 361 A 137 TYR H A 139 ILE HD11 1.0 . 5.19 362 362 A 137 TYR H A 139 ILE HG1x 1.0 . 4.96 363 363 A 142 ILE H A 141 TYR HA 1.0 . 3.13 364 364 A 141 TYR H A 140 PRO HA 1.0 . 3.01 365 365 A 142 ILE H A 114 VAL HA 1.0 . 4.18 366 366 A 144 THR HA A 145 SER H 1.0 . 3.27 367 367 A 143 GLU H A 142 ILE HG1y 1.0 . 4.75 368 368 A 143 GLU H A 142 ILE HG1x 1.0 . 4.75 369 369 A 143 GLU H A 142 ILE HG21 1.0 . 3.47 370 370 A 145 SER H A 150 GLN HBy 1.0 . 4.94 371 371 A 145 SER HA A 147 LYS H 1.0 . 4.82 372 372 A 147 LYS HBy A 148 THR H 1.0 . 4.88 373 373 A 148 THR H A 147 LYS HBx 1.0 . 4.88 374 374 A 148 THR HG21 A 148 THR H 1.0 . 3.57 375 375 A 147 LYS H A 147 LYS HGy 1.0 . 4.77 376 376 A 147 LYS H A 147 LYS HGx 1.0 . 4.77 377 377 A 150 GLN HA A 151 GLY H 1.0 . 3.37 378 378 A 150 GLN HBy A 150 GLN H 1.0 . 3.49 379 379 A 151 GLY H A 150 GLN HBx 1.0 . 4.92 380 380 A 151 GLY H A 150 GLN HGx 1.0 . 4.31 381 381 A 21 ILE H A 21 ILE HG21 1.0 . 4.01 382 382 A 144 THR HA A 152 VAL H 1.0 . 5.16 383 383 A 153 GLU H A 153 GLU HBx 1.0 . 3.78 384 384 A 154 ASP H A 153 GLU HBx 1.0 . 3.94 385 385 A 153 GLU H A 153 GLU HGx 1.0 . 4.15 386 386 A 154 ASP H A 155 ALA HB1 1.0 . 4.85 387 387 A 155 ALA HB1 A 155 ALA H 1.0 . 3.14 388 388 A 155 ALA H A 152 VAL HA 1.0 . 4.45 389 389 A 142 ILE HG21 A 155 ALA H 1.0 . 3.51 390 390 A 142 ILE H A 142 ILE HG21 1.0 . 4.34 391 391 A 142 ILE HD11 A 142 ILE H 1.0 . 4.24 392 392 A 142 ILE HD11 A 155 ALA H 1.0 . 4.46 393 393 A 157 TYR H A 156 PHE HBy 1.0 . 4.32 394 394 A 153 GLU HA A 156 PHE H 1.0 . 4.54 395 395 A 157 TYR H A 157 TYR HBx 1.0 . 3.97 396 396 A 157 TYR H A 154 ASP HA 1.0 . 4.12 397 397 A 157 TYR H A 155 ALA HB1 1.0 . 5.03 398 398 A 46 ILE HD11 A 157 TYR H 1.0 . 4.86 399 399 A 158 THR H A 158 THR HB 1.0 . 3.46 400 400 A 158 THR H A 158 THR HG21 1.0 . 4.12 401 401 A 159 LEU H A 159 LEU HBy 1.0 . 3.83 402 402 A 159 LEU H A 159 LEU HBx 1.0 . 3.83 403 403 A 159 LEU H A 159 LEU HD11 1.0 . 4.34 404 404 A 157 TYR HA A 160 VAL H 1.0 . 4.31 405 405 A 163 ILE H A 160 VAL HA 1.0 . 4.43 406 406 A 160 VAL H A 160 VAL HB 1.0 . 3.63 407 407 A 158 THR HA A 161 ARG H 1.0 . 4.27 408 408 A 160 VAL HGx% A 161 ARG H 1.0 . 4.40 409 409 A 164 ARG H A 163 ILE HB 1.0 . 3.40 410 410 A 163 ILE HD11 A 163 ILE H 1.0 . 3.82 411 411 A 164 ARG H A 161 ARG HA 1.0 . 4.51 412 412 A 162 GLU HA A 165 GLN H 1.0 . 4.27 413 413 A 165 GLN H A 165 GLN HBx 1.0 . 3.73 414 414 A 165 GLN H A 165 GLN HGy 1.0 . 3.84 415 415 A 165 GLN H A 165 GLN HGx 1.0 . 3.84 416 416 A 163 ILE HG21 A 166 HIS H 1.0 . 5.23 417 417 A 166 HIS H A 166 HIS HBx 1.0 . 3.57 418 418 A 166 HIS H A 163 ILE HA 1.0 . 4.81 419 419 A 43 GLN HE2y A 50 THR HG21 1.0 . 3.96 420 420 A 15 GLY HAx A 116 ASN HD2x 1.0 . 4.72 421 421 A 15 GLY HAy A 116 ASN HD2y 1.0 . 4.72 422 422 A 15 GLY HAx A 116 ASN HD2y 1.0 . 4.72 423 423 A 22 GLN HE2x A 28 PHE HBy 1.0 . 5.41 424 424 A 21 ILE HD11 A 25 GLN HE2y 1.0 . 4.89 425 425 A 123 ARG HE A 123 ARG HBy 1.0 . 5.13 426 426 A 123 ARG HE A 84 ILE HB 1.0 . 5.10 427 427 A 123 ARG HE A 126 GLU HA 1.0 . 4.77 428 428 A 11 ALA HB1 A 89 SER HBy 1.0 . 4.51 429 429 A 1 MET HA A 2 THR HB 1.0 . 4.29 430 430 A 1 MET HA A 51 CYS HA 1.0 . 4.78 431 431 A 1 MET HA A 2 THR HG21 1.0 . 4.95 432 432 A 1 MET HGy A 1 MET H 1.0 . 4.62 433 433 A 1 MET HGx A 1 MET H 1.0 . 4.62 434 434 A 51 CYS HA A 1 MET HGx 1.0 . 4.46 435 435 A 51 CYS HA A 1 MET HGy 1.0 . 4.46 436 436 A 1 MET HGy A 52 LEU HG 1.0 . 4.46 437 437 A 1 MET HGx A 52 LEU HG 1.0 . 4.46 438 438 A 1 MET HGy A 50 THR HG21 1.0 . 4.48 439 439 A 1 MET HGx A 50 THR HG21 1.0 . 4.48 440 440 A 1 MET HE1 A 1 MET H 1.0 . 4.31 441 441 A 43 GLN HE2y A 1 MET HE1 1.0 . 4.34 442 442 A 43 GLN HE2x A 1 MET HE1 1.0 . 4.34 443 443 A 1 MET HE1 A 50 THR HB 1.0 . 4.04 444 444 A 2 THR HA A 3 GLU HA 1.0 . 4.99 445 445 A 2 THR HA A 2 THR HG21 1.0 . 3.18 446 446 A 52 LEU H A 2 THR HB 1.0 . 4.83 447 447 A 51 CYS HBy A 2 THR HB 1.0 . 4.86 448 448 A 2 THR HB A 51 CYS HBx 1.0 . 4.86 449 449 A 51 CYS HA A 2 THR HB 1.0 . 4.55 450 450 A 3 GLU HA A 2 THR HG21 1.0 . 5.05 451 451 A 29 VAL HA A 29 VAL HGy% 1.0 . 3.33 452 452 A 51 CYS HBy A 2 THR HG21 1.0 . 4.67 453 453 A 2 THR HG21 A 51 CYS HBx 1.0 . 4.67 454 454 A 3 GLU HA A 52 LEU HBy 1.0 . 4.01 455 455 A 3 GLU HA A 52 LEU HBx 1.0 . 4.01 456 456 A 3 GLU HGx A 4 TYR H 1.0 . 4.66 457 457 A 3 GLU HGy A 4 TYR H 1.0 . 4.66 458 458 A 3 GLU HGx A 52 LEU HBy 1.0 . 4.68 459 459 A 3 GLU HGx A 52 LEU HBx 1.0 . 4.68 460 460 A 3 GLU HGy A 52 LEU HBy 1.0 . 4.68 461 461 A 3 GLU HGy A 52 LEU HBx 1.0 . 4.68 462 462 A 5 LYS HA A 54 ASP HBy 1.0 . 4.15 463 463 A 5 LYS HA A 54 ASP HBx 1.0 . 4.15 464 464 A 76 GLU H A 5 LYS HBx 1.0 . 4.59 465 465 A 107 ASP HA A 101 LYS HGy 1.0 . 4.88 466 466 A 107 ASP HA A 101 LYS HGx 1.0 . 4.88 467 467 A 77 GLY H A 6 LEU HA 1.0 . 4.41 468 468 A 78 PHE HA A 6 LEU HA 1.0 . 4.83 469 469 A 6 LEU HA A 6 LEU HDx% 1.0 . 4.49 470 470 A 56 LEU HDy% A 56 LEU HA 1.0 . 3.77 471 471 A 114 VAL HA A 114 VAL HGx% 1.0 . 3.65 472 472 A 23 LEU HDy% A 23 LEU HA 1.0 . 4.11 473 473 A 152 VAL HA A 144 THR HG21 1.0 . 3.66 474 474 A 6 LEU HDy% A 6 LEU HA 1.0 . 4.49 475 475 A 7 VAL HB A 79 LEU H 1.0 . 5.09 476 476 A 78 PHE HA A 7 VAL HB 1.0 . 4.85 477 477 A 9 VAL HG21 A 100 ILE HD11 1.0 . 4.15 478 478 A 8 VAL HGx% A 8 VAL HA 1.0 . 3.65 479 479 A 8 VAL HGy% A 8 VAL HA 1.0 . 3.65 480 480 A 49 GLU HA A 49 GLU HGx 1.0 . 4.01 481 481 A 9 VAL HG11 A 80 CYS HA 1.0 . 4.60 482 482 A 11 ALA HB1 A 89 SER H 1.0 . 4.50 483 483 A 11 ALA HB1 A 89 SER HA 1.0 . 3.59 484 484 A 11 ALA HB1 A 14 VAL HG21 1.0 . 4.26 485 485 A 11 ALA HB1 A 14 VAL HG11 1.0 . 4.26 486 486 A 11 ALA HB1 A 14 VAL HB 1.0 . 4.63 487 487 A 11 ALA HB1 A 89 SER HBx 1.0 . 4.51 488 488 A 138 GLY HAy A 139 ILE HG21 1.0 . 5.39 489 489 A 139 ILE HG21 A 138 GLY HAx 1.0 . 5.39 490 490 A 14 VAL HG21 A 14 VAL HA 1.0 . 4.17 491 491 A 14 VAL HG11 A 14 VAL HA 1.0 . 4.17 492 492 A 14 VAL HG21 A 82 PHE HA 1.0 . 4.74 493 493 A 14 VAL HG11 A 82 PHE HA 1.0 . 4.74 494 494 A 18 ALA HB1 A 15 GLY HAy 1.0 . 4.77 495 495 A 18 ALA HB1 A 15 GLY HAx 1.0 . 4.77 496 496 A 21 ILE HD11 A 17 SER HA 1.0 . 4.76 497 497 A 133 LEU H A 130 ALA HA 1.0 . 4.44 498 498 A 19 LEU HA A 156 PHE HZ 1.0 . 5.14 499 499 A 146 ALA HB1 A 19 LEU HA 1.0 . 3.82 500 500 A 53 LEU H A 53 LEU HG 1.0 . 4.80 501 501 A 19 LEU HA A 19 LEU HDx% 1.0 . 5.06 502 502 A 19 LEU HA A 19 LEU HD21 1.0 . 5.06 503 503 A 20 THR HA A 156 PHE HZ 1.0 . 4.20 504 504 A 20 THR HB A 17 SER HA 1.0 . 4.50 505 505 A 20 THR HG21 A 21 ILE H 1.0 . 4.28 506 506 A 20 THR HG21 A 57 ASP HBy 1.0 . 4.12 507 507 A 20 THR HG21 A 57 ASP HBx 1.0 . 4.12 508 508 A 21 ILE HA A 21 ILE HG1y 1.0 . 4.25 509 509 A 21 ILE HB A 18 ALA HA 1.0 . 4.66 510 510 A 21 ILE H A 21 ILE HG1x 1.0 . 4.26 511 511 A 21 ILE HA A 21 ILE HG1x 1.0 . 4.25 512 512 A 114 VAL HA A 142 ILE HG21 1.0 . 4.65 513 513 A 142 ILE HG21 A 155 ALA HA 1.0 . 3.82 514 514 A 21 ILE HG21 A 21 ILE HA 1.0 . 3.68 515 515 A 27 HIS HBy A 21 ILE HG21 1.0 . 4.84 516 516 A 27 HIS HBx A 21 ILE HG21 1.0 . 4.84 517 517 A 21 ILE HD11 A 22 GLN H 1.0 . 5.01 518 518 A 21 ILE HD11 A 21 ILE HA 1.0 . 3.69 519 519 A 21 ILE HD11 A 29 VAL HA 1.0 . 4.79 520 520 A 21 ILE HD11 A 21 ILE HB 1.0 . 3.79 521 521 A 22 GLN HGy A 146 ALA HA 1.0 . 4.82 522 522 A 146 ALA HA A 22 GLN HGx 1.0 . 4.82 523 523 A 23 LEU HDx% A 23 LEU HA 1.0 . 4.11 524 524 A 23 LEU HDx% A 153 GLU HA 1.0 . 4.55 525 525 A 24 ILE HA A 42 LYS HDx 1.0 . 4.47 526 526 A 24 ILE HA A 42 LYS HDy 1.0 . 4.47 527 527 A 24 ILE HG21 A 40 TYR HA 1.0 . 4.43 528 528 A 24 ILE HG21 A 25 GLN HA 1.0 . 4.40 529 529 A 24 ILE HG21 A 24 ILE HA 1.0 . 3.55 530 530 A 137 TYR HBy A 139 ILE HG21 1.0 . 4.27 531 531 A 24 ILE HG21 A 24 ILE HD11 1.0 . 3.06 532 532 A 55 ILE H A 24 ILE HD11 1.0 . 5.09 533 533 A 25 GLN H A 24 ILE HD11 1.0 . 4.55 534 534 A 41 ARG HA A 24 ILE HD11 1.0 . 4.88 535 535 A 40 TYR HA A 24 ILE HD11 1.0 . 4.21 536 536 A 24 ILE HD11 A 24 ILE HA 1.0 . 3.27 537 537 A 24 ILE HD11 A 42 LYS HA 1.0 . 4.53 538 538 A 21 ILE HG21 A 25 GLN HA 1.0 . 4.92 539 539 A 21 ILE HG21 A 25 GLN HBx 1.0 . 4.62 540 540 A 21 ILE HG21 A 25 GLN HBy 1.0 . 4.62 541 541 A 25 GLN HGx A 25 GLN HA 1.0 . 3.82 542 542 A 25 GLN HA A 25 GLN HGy 1.0 . 3.82 543 543 A 21 ILE HG21 A 25 GLN HGy 1.0 . 4.52 544 544 A 25 GLN HGx A 21 ILE HG21 1.0 . 4.52 545 545 A 22 GLN HA A 26 ASN HBy 1.0 . 5.35 546 546 A 22 GLN HA A 26 ASN HBx 1.0 . 5.35 547 547 A 29 VAL HA A 30 ASP HBy 1.0 . 4.82 548 548 A 30 ASP HBx A 29 VAL HA 1.0 . 4.82 549 549 A 29 VAL HGx% A 27 HIS HE1 1.0 . 4.70 550 550 A 29 VAL HGx% A 29 VAL HA 1.0 . 3.33 551 551 A 98 GLU H A 98 GLU HGy 1.0 . 4.03 552 552 A 63 GLU H A 63 GLU HGy 1.0 . 4.80 553 553 A 63 GLU H A 63 GLU HGx 1.0 . 4.80 554 554 A 95 GLN HA A 98 GLU HGy 1.0 . 4.52 555 555 A 95 GLN HA A 98 GLU HGx 1.0 . 4.52 556 556 A 33 ASP HA A 34 PRO HDy 1.0 . 3.45 557 557 A 33 ASP HA A 34 PRO HDx 1.0 . 3.45 558 558 A 33 ASP HBx A 34 PRO HDy 1.0 . 4.82 559 559 A 104 LYS HDy A 78 PHE HZ 1.0 . 4.23 560 560 A 33 ASP H A 34 PRO HDy 1.0 . 5.13 561 561 A 33 ASP H A 34 PRO HDx 1.0 . 5.13 562 562 A 34 PRO HDx A 33 ASP HBy 1.0 . 4.82 563 563 A 33 ASP HBx A 34 PRO HDx 1.0 . 4.82 564 564 A 34 PRO HDy A 33 ASP HBy 1.0 . 4.82 565 565 A 36 ILE HG21 A 35 SER HA 1.0 . 5.14 566 566 A 36 ILE HA A 36 ILE HG1x 1.0 . 4.09 567 567 A 36 ILE HA A 36 ILE HG21 1.0 . 3.35 568 568 A 37 GLU H A 36 ILE HG1y 1.0 . 5.10 569 569 A 37 GLU H A 36 ILE HG1x 1.0 . 5.10 570 570 A 36 ILE HA A 36 ILE HG1y 1.0 . 4.09 571 571 A 36 ILE HG21 A 33 ASP HBy 1.0 . 4.71 572 572 A 33 ASP HBx A 36 ILE HG21 1.0 . 4.71 573 573 A 36 ILE HG21 A 36 ILE HG1y 1.0 . 3.29 574 574 A 36 ILE HG21 A 36 ILE HG1x 1.0 . 3.29 575 575 A 37 GLU H A 36 ILE HD11 1.0 . 4.63 576 576 A 36 ILE H A 36 ILE HD11 1.0 . 4.78 577 577 A 36 ILE HA A 36 ILE HD11 1.0 . 4.04 578 578 A 33 ASP HBy A 36 ILE HD11 1.0 . 4.74 579 579 A 33 ASP HBx A 36 ILE HD11 1.0 . 4.74 580 580 A 36 ILE HD11 A 36 ILE HB 1.0 . 3.50 581 581 A 39 SER HBy A 56 LEU HA 1.0 . 4.11 582 582 A 39 SER HBx A 56 LEU HA 1.0 . 4.11 583 583 A 41 ARG HA A 54 ASP HA 1.0 . 4.00 584 584 A 41 ARG HA A 41 ARG HDy 1.0 . 5.28 585 585 A 41 ARG HBy A 54 ASP HA 1.0 . 5.18 586 586 A 41 ARG HBx A 54 ASP HA 1.0 . 5.18 587 587 A 41 ARG HGy A 54 ASP HA 1.0 . 4.59 588 588 A 41 ARG HGx A 54 ASP HA 1.0 . 4.59 589 589 A 102 ARG HA A 102 ARG HGx 1.0 . 3.85 590 590 A 41 ARG H A 41 ARG HDy 1.0 . 5.22 591 591 A 41 ARG HDx A 41 ARG H 1.0 . 5.22 592 592 A 152 VAL HA A 152 VAL HG11 1.0 . 3.53 593 593 A 24 ILE HD11 A 42 LYS HBx 1.0 . 4.41 594 594 A 24 ILE HD11 A 42 LYS HBy 1.0 . 4.41 595 595 A 42 LYS HDy A 42 LYS HA 1.0 . 5.19 596 596 A 42 LYS HDx A 42 LYS HA 1.0 . 5.19 597 597 A 24 ILE HD11 A 42 LYS HDx 1.0 . 4.48 598 598 A 24 ILE HD11 A 42 LYS HDy 1.0 . 4.48 599 599 A 43 GLN HA A 52 LEU HA 1.0 . 3.74 600 600 A 43 GLN HGy A 43 GLN HA 1.0 . 4.12 601 601 A 43 GLN HGx A 43 GLN HA 1.0 . 4.12 602 602 A 44 VAL HGx% A 43 GLN HA 1.0 . 4.82 603 603 A 43 GLN HA A 50 THR HG21 1.0 . 4.74 604 604 A 43 GLN HA A 44 VAL HG21 1.0 . 4.82 605 605 A 43 GLN HGy A 50 THR HG21 1.0 . 3.96 606 606 A 43 GLN HGx A 50 THR HG21 1.0 . 3.96 607 607 A 93 ILE HD11 A 93 ILE HB 1.0 . 3.67 608 608 A 46 ILE HD11 A 44 VAL HB 1.0 . 5.21 609 609 A 44 VAL HGx% A 44 VAL H 1.0 . 3.86 610 610 A 44 VAL HGx% A 45 VAL H 1.0 . 3.66 611 611 A 44 VAL HGx% A 53 LEU HG 1.0 . 3.42 612 612 A 44 VAL HGx% A 46 ILE HD11 1.0 . 4.33 613 613 A 44 VAL H A 44 VAL HG21 1.0 . 3.86 614 614 A 44 VAL HG21 A 53 LEU HG 1.0 . 3.42 615 615 A 46 ILE HD11 A 44 VAL HG21 1.0 . 4.33 616 616 A 45 VAL HA A 49 GLU H 1.0 . 5.13 617 617 A 45 VAL HA A 50 THR HA 1.0 . 3.71 618 618 A 45 VAL HA A 45 VAL HGy% 1.0 . 3.53 619 619 A 45 VAL HA A 50 THR HG21 1.0 . 3.90 620 620 A 45 VAL HA A 45 VAL HGx% 1.0 . 3.53 621 621 A 46 ILE HD11 A 46 ILE HA 1.0 . 4.44 622 622 A 45 VAL HA A 46 ILE HB 1.0 . 5.31 623 623 A 159 LEU HD21 A 159 LEU HBx 1.0 . 4.23 624 624 A 160 VAL HGx% A 46 ILE HB 1.0 . 4.78 625 625 A 46 ILE H A 46 ILE HG1x 1.0 . 5.16 626 626 A 46 ILE H A 46 ILE HG1y 1.0 . 5.16 627 627 A 46 ILE HG21 A 46 ILE H 1.0 . 4.40 628 628 A 46 ILE HG21 A 157 TYR HA 1.0 . 4.93 629 629 A 46 ILE HG21 A 46 ILE HA 1.0 . 3.76 630 630 A 46 ILE HG21 A 160 VAL HA 1.0 . 4.78 631 631 A 46 ILE HG21 A 160 VAL HB 1.0 . 4.70 632 632 A 46 ILE HG21 A 161 ARG HGy 1.0 . 5.33 633 633 A 46 ILE HG21 A 161 ARG HGx 1.0 . 5.33 634 634 A 46 ILE HD11 A 46 ILE H 1.0 . 4.22 635 635 A 46 ILE HD11 A 157 TYR HA 1.0 . 3.80 636 636 A 46 ILE HD11 A 160 VAL HA 1.0 . 4.45 637 637 A 46 ILE HD11 A 46 ILE HB 1.0 . 3.62 638 638 A 46 ILE HD11 A 160 VAL HB 1.0 . 3.63 639 639 A 46 ILE HD11 A 160 VAL HGx% 1.0 . 3.33 640 640 A 49 GLU HA A 50 THR HB 1.0 . 4.49 641 641 A 49 GLU HA A 49 GLU HGy 1.0 . 4.01 642 642 A 127 SER H A 126 GLU HGx 1.0 . 4.96 643 643 A 126 GLU H A 126 GLU HGx 1.0 . 3.82 644 644 A 126 GLU HA A 126 GLU HGx 1.0 . 3.96 645 645 A 125 VAL HA A 126 GLU HGy 1.0 . 4.45 646 646 A 50 THR HA A 45 VAL HGy% 1.0 . 4.22 647 647 A 50 THR HA A 45 VAL HGx% 1.0 . 4.22 648 648 A 51 CYS HA A 50 THR HG21 1.0 . 4.39 649 649 A 50 THR HA A 50 THR HG21 1.0 . 3.30 650 650 A 51 CYS HA A 2 THR HG21 1.0 . 5.01 651 651 A 51 CYS HBy A 53 LEU HG 1.0 . 5.43 652 652 A 51 CYS HBx A 53 LEU HG 1.0 . 5.43 653 653 A 3 GLU HA A 52 LEU HG 1.0 . 4.41 654 654 A 52 LEU HG A 52 LEU HA 1.0 . 4.13 655 655 A 55 ILE HD11 A 53 LEU HBx 1.0 . 4.53 656 656 A 55 ILE HD11 A 53 LEU HBy 1.0 . 4.53 657 657 A 55 ILE HD11 A 54 ASP HA 1.0 . 4.92 658 658 A 6 LEU H A 54 ASP HBx 1.0 . 4.42 659 659 A 55 ILE HG21 A 55 ILE HA 1.0 . 3.92 660 660 A 55 ILE HD11 A 55 ILE HA 1.0 . 4.00 661 661 A 55 ILE HA A 6 LEU HBx 1.0 . 5.14 662 662 A 55 ILE HA A 6 LEU HBy 1.0 . 5.14 663 663 A 20 THR HA A 55 ILE HG21 1.0 . 4.80 664 664 A 8 VAL HB A 55 ILE HG21 1.0 . 4.73 665 665 A 55 ILE HD11 A 55 ILE HG21 1.0 . 2.91 666 666 A 55 ILE HD11 A 53 LEU HA 1.0 . 4.69 667 667 A 55 ILE HD11 A 55 ILE HB 1.0 . 3.34 668 668 A 133 LEU HBx A 90 PHE HZ 1.0 . 4.90 669 669 A 56 LEU H A 56 LEU HG 1.0 . 4.79 670 670 A 56 LEU HDx% A 56 LEU HA 1.0 . 3.77 671 671 A 56 LEU HDx% A 71 TYR HA 1.0 . 4.59 672 672 A 56 LEU HDx% A 58 THR HA 1.0 . 5.08 673 673 A 56 LEU HDx% A 58 THR HB 1.0 . 5.01 674 674 A 58 THR HA A 56 LEU HDy% 1.0 . 5.08 675 675 A 56 LEU HDy% A 58 THR HB 1.0 . 5.01 676 676 A 58 THR HA A 59 ALA HB1 1.0 . 4.31 677 677 A 58 THR HA A 58 THR HG21 1.0 . 3.56 678 678 A 58 THR HB A 59 ALA HB1 1.0 . 4.18 679 679 A 8 VAL H A 58 THR HG21 1.0 . 4.73 680 680 A 60 GLY HAx A 59 ALA HB1 1.0 . 4.76 681 681 A 60 GLY HAy A 59 ALA HB1 1.0 . 4.76 682 682 A 59 ALA HB1 A 64 TYR HBx 1.0 . 4.91 683 683 A 59 ALA HB1 A 64 TYR HBy 1.0 . 4.91 684 684 A 59 ALA HB1 A 61 GLN HA 1.0 . 4.90 685 685 A 154 ASP HA A 157 TYR HBy 1.0 . 4.53 686 686 A 157 TYR HBx A 154 ASP HA 1.0 . 4.53 687 687 A 142 ILE HG21 A 154 ASP HA 1.0 . 4.52 688 688 A 64 TYR HA A 65 SER HA 1.0 . 4.96 689 689 A 66 ALA HB1 A 67 MET HGx 1.0 . 5.13 690 690 A 103 VAL HGx% A 69 ASP HA 1.0 . 3.86 691 691 A 67 MET H A 67 MET HGy 1.0 . 4.88 692 692 A 67 MET H A 67 MET HGx 1.0 . 4.88 693 693 A 66 ALA HB1 A 67 MET HGy 1.0 . 5.13 694 694 A 67 MET HE1 A 64 TYR HA 1.0 . 4.48 695 695 A 68 ARG HA A 68 ARG HE 1.0 . 5.18 696 696 A 68 ARG HA A 71 TYR HBx 1.0 . 4.80 697 697 A 68 ARG HA A 71 TYR HBy 1.0 . 4.80 698 698 A 73 ARG HDy A 103 VAL HGx% 1.0 . 5.17 699 699 A 72 MET H A 69 ASP HA 1.0 . 4.56 700 700 A 103 VAL HG21 A 69 ASP HA 1.0 . 3.86 701 701 A 109 VAL HGy% A 109 VAL HA 1.0 . 3.61 702 702 A 164 ARG H A 162 GLU HA 1.0 . 4.73 703 703 A 82 PHE HBx A 90 PHE HA 1.0 . 4.94 704 704 A 70 GLN HA A 74 THR HG21 1.0 . 4.57 705 705 A 67 MET HA A 70 GLN HBy 1.0 . 4.33 706 706 A 67 MET HA A 70 GLN HBx 1.0 . 4.33 707 707 A 74 THR HB A 71 TYR HA 1.0 . 4.36 708 708 A 56 LEU HDy% A 71 TYR HA 1.0 . 4.59 709 709 A 71 TYR HA A 74 THR HG21 1.0 . 4.18 710 710 A 72 MET HA A 72 MET HGy 1.0 . 4.12 711 711 A 72 MET HA A 72 MET HGx 1.0 . 4.12 712 712 A 72 MET HE1 A 99 GLN HA 1.0 . 4.44 713 713 A 68 ARG HA A 72 MET HE1 1.0 . 4.71 714 714 A 72 MET HE1 A 100 ILE HA 1.0 . 3.77 715 715 A 100 ILE HG21 A 72 MET HE1 1.0 . 4.64 716 716 A 100 ILE HD11 A 72 MET HE1 1.0 . 3.44 717 717 A 72 MET HE1 A 100 ILE HB 1.0 . 4.79 718 718 A 73 ARG HGx A 103 VAL HGx% 1.0 . 4.50 719 719 A 103 VAL HGx% A 73 ARG HGy 1.0 . 4.50 720 720 A 103 VAL HG21 A 73 ARG HGx 1.0 . 4.50 721 721 A 103 VAL HG21 A 73 ARG HGy 1.0 . 4.50 722 722 A 102 ARG H A 102 ARG HDy 1.0 . 5.06 723 723 A 102 ARG H A 102 ARG HDx 1.0 . 5.06 724 724 A 103 VAL HG21 A 73 ARG HDx 1.0 . 5.17 725 725 A 103 VAL HGx% A 73 ARG HDx 1.0 . 5.17 726 726 A 103 VAL HG21 A 73 ARG HDy 1.0 . 5.17 727 727 A 74 THR HG21 A 74 THR HA 1.0 . 2.76 728 728 A 73 ARG H A 74 THR HG21 1.0 . 4.79 729 729 A 74 THR HG21 A 73 ARG HA 1.0 . 4.79 730 730 A 76 GLU HGx A 76 GLU HA 1.0 . 4.03 731 731 A 163 ILE HG21 A 76 GLU HA 1.0 . 5.00 732 732 A 163 ILE HD11 A 76 GLU HA 1.0 . 5.18 733 733 A 5 LYS H A 76 GLU HBx 1.0 . 5.30 734 734 A 76 GLU HBx A 163 ILE HG21 1.0 . 4.42 735 735 A 163 ILE HD11 A 76 GLU HBx 1.0 . 4.22 736 736 A 163 ILE HD11 A 76 GLU HBy 1.0 . 4.22 737 737 A 76 GLU HBy A 163 ILE HG21 1.0 . 4.42 738 738 A 76 GLU HGy A 76 GLU HA 1.0 . 4.03 739 739 A 76 GLU HGy A 5 LYS HBy 1.0 . 4.59 740 740 A 76 GLU HGx A 5 LYS HBy 1.0 . 4.59 741 741 A 76 GLU HGy A 5 LYS HBx 1.0 . 4.59 742 742 A 163 ILE HD11 A 76 GLU HGy 1.0 . 5.47 743 743 A 163 ILE HD11 A 76 GLU HGx 1.0 . 5.47 744 744 A 76 GLU HGx A 5 LYS HBx 1.0 . 4.59 745 745 A 77 GLY HAx A 110 PRO HBy 1.0 . 5.09 746 746 A 77 GLY HAx A 110 PRO HBx 1.0 . 5.09 747 747 A 110 PRO HBx A 77 GLY HAy 1.0 . 5.09 748 748 A 159 LEU HD21 A 77 GLY HAy 1.0 . 5.27 749 749 A 110 PRO HBy A 77 GLY HAy 1.0 . 5.09 750 750 A 159 LEU HD11 A 77 GLY HAx 1.0 . 5.27 751 751 A 159 LEU HD11 A 77 GLY HAy 1.0 . 5.27 752 752 A 163 ILE HD11 A 77 GLY HAy 1.0 . 4.18 753 753 A 163 ILE HD11 A 77 GLY HAx 1.0 . 4.18 754 754 A 78 PHE HA A 8 VAL HA 1.0 . 4.39 755 755 A 78 PHE HA A 79 LEU HBx 1.0 . 5.39 756 756 A 78 PHE HA A 79 LEU HBy 1.0 . 5.39 757 757 A 80 CYS H A 79 LEU HG 1.0 . 5.16 758 758 A 79 LEU HA A 79 LEU HDx% 1.0 . 3.84 759 759 A 79 LEU HDx% A 156 PHE HA 1.0 . 4.05 760 760 A 112 VAL HB A 79 LEU HDx% 1.0 . 3.74 761 761 A 79 LEU HBx A 79 LEU HDx% 1.0 . 3.92 762 762 A 79 LEU HDx% A 79 LEU HBy 1.0 . 3.92 763 763 A 79 LEU HA A 79 LEU HDy% 1.0 . 3.84 764 764 A 79 LEU HDy% A 156 PHE HA 1.0 . 4.05 765 765 A 112 VAL HB A 79 LEU HDy% 1.0 . 3.74 766 766 A 79 LEU HDy% A 79 LEU HBy 1.0 . 3.92 767 767 A 79 LEU HBx A 79 LEU HDy% 1.0 . 3.92 768 768 A 9 VAL HG21 A 80 CYS HA 1.0 . 4.60 769 769 A 80 CYS HBy A 113 LEU HA 1.0 . 4.59 770 770 A 80 CYS HBx A 113 LEU HA 1.0 . 4.59 771 771 A 93 ILE HD11 A 80 CYS HBx 1.0 . 4.02 772 772 A 93 ILE HD11 A 80 CYS HBy 1.0 . 4.02 773 773 A 114 VAL HB A 81 VAL HA 1.0 . 4.01 774 774 A 81 VAL HG21 A 81 VAL HA 1.0 . 3.69 775 775 A 81 VAL HGx% A 81 VAL HA 1.0 . 3.69 776 776 A 144 THR HA A 144 THR HG21 1.0 . 3.40 777 777 A 14 VAL HA A 82 PHE HA 1.0 . 4.65 778 778 A 82 PHE HBy A 90 PHE HA 1.0 . 4.94 779 779 A 93 ILE HD11 A 82 PHE HBx 1.0 . 5.01 780 780 A 93 ILE HD11 A 82 PHE HBy 1.0 . 5.01 781 781 A 83 ALA HA A 85 ASN H 1.0 . 5.10 782 782 A 83 ALA HA A 84 ILE HG1y 1.0 . 5.30 783 783 A 83 ALA HA A 84 ILE HG1x 1.0 . 5.30 784 784 A 84 ILE HG21 A 83 ALA HA 1.0 . 4.18 785 785 A 14 VAL H A 83 ALA HB1 1.0 . 5.03 786 786 A 83 ALA HB1 A 14 VAL HA 1.0 . 3.64 787 787 A 83 ALA HB1 A 86 ASN HBy 1.0 . 4.13 788 788 A 83 ALA HB1 A 86 ASN HBx 1.0 . 4.13 789 789 A 84 ILE HA A 125 VAL HB 1.0 . 3.97 790 790 A 84 ILE HG21 A 84 ILE HA 1.0 . 3.40 791 791 A 125 VAL HG21 A 84 ILE HA 1.0 . 4.71 792 792 A 125 VAL HGx% A 84 ILE HA 1.0 . 4.71 793 793 A 84 ILE HG1x A 118 CYS HA 1.0 . 4.32 794 794 A 84 ILE HG1y A 118 CYS HA 1.0 . 4.32 795 795 A 94 HIS HA A 97 ARG HBx 1.0 . 4.40 796 796 A 84 ILE HG21 A 84 ILE HG1y 1.0 . 3.55 797 797 A 84 ILE HD11 A 85 ASN HA 1.0 . 4.21 798 798 A 84 ILE HD11 A 118 CYS HA 1.0 . 3.29 799 799 A 84 ILE HD11 A 123 ARG HA 1.0 . 3.47 800 800 A 84 ILE HD11 A 84 ILE HB 1.0 . 3.30 801 801 A 84 ILE HD11 A 123 ARG HBy 1.0 . 3.61 802 802 A 84 ILE HD11 A 123 ARG HBx 1.0 . 3.61 803 803 A 84 ILE HG21 A 118 CYS HA 1.0 . 4.32 804 804 A 84 ILE HG21 A 84 ILE HG1x 1.0 . 3.55 805 805 A 85 ASN HA A 123 ARG HA 1.0 . 4.16 806 806 A 83 ALA HB1 A 86 ASN HA 1.0 . 4.76 807 807 A 124 THR HG21 A 85 ASN HA 1.0 . 3.73 808 808 A 124 THR HG21 A 85 ASN HBy 1.0 . 4.51 809 809 A 124 THR HG21 A 85 ASN HBx 1.0 . 4.51 810 810 A 90 PHE HBy A 87 THR HA 1.0 . 4.91 811 811 A 90 PHE HBx A 87 THR HA 1.0 . 4.91 812 812 A 87 THR HG21 A 87 THR HA 1.0 . 3.34 813 813 A 125 VAL HG21 A 87 THR HA 1.0 . 4.76 814 814 A 125 VAL HGx% A 87 THR HA 1.0 . 4.76 815 815 A 87 THR HB A 86 ASN HA 1.0 . 4.87 816 816 A 125 VAL H A 87 THR HG21 1.0 . 5.05 817 817 A 90 PHE HBy A 87 THR HG21 1.0 . 4.67 818 818 A 90 PHE HBx A 87 THR HG21 1.0 . 4.67 819 819 A 87 THR HG21 A 91 GLU HGy 1.0 . 3.80 820 820 A 87 THR HG21 A 91 GLU HGx 1.0 . 3.80 821 821 A 125 VAL HG21 A 87 THR HG21 1.0 . 4.73 822 822 A 125 VAL HGx% A 87 THR HG21 1.0 . 4.73 823 823 A 135 ARG HA A 138 GLY H 1.0 . 4.13 824 824 A 135 ARG HA A 139 ILE H 1.0 . 4.71 825 825 A 90 PHE H A 88 LYS HA 1.0 . 4.71 826 826 A 135 ARG HA A 135 ARG HGy 1.0 . 3.51 827 827 A 87 THR HG21 A 88 LYS HA 1.0 . 4.51 828 828 A 103 VAL HB A 100 ILE HA 1.0 . 4.54 829 829 A 135 ARG HA A 135 ARG HGx 1.0 . 3.51 830 830 A 90 PHE HA A 93 ILE HG1x 1.0 . 5.13 831 831 A 90 PHE HA A 93 ILE HG1y 1.0 . 5.13 832 832 A 90 PHE HBy A 125 VAL HG21 1.0 . 5.08 833 833 A 90 PHE HBx A 125 VAL HG21 1.0 . 5.08 834 834 A 91 GLU HGy A 91 GLU HA 1.0 . 3.70 835 835 A 91 GLU HGx A 91 GLU HA 1.0 . 3.70 836 836 A 101 LYS HA A 106 SER HA 1.0 . 4.94 837 837 A 96 TYR HBy A 93 ILE HA 1.0 . 4.96 838 838 A 96 TYR HBx A 93 ILE HA 1.0 . 4.96 839 839 A 93 ILE HG21 A 93 ILE HA 1.0 . 3.80 840 840 A 93 ILE HD11 A 81 VAL HA 1.0 . 5.03 841 841 A 93 ILE HD11 A 80 CYS HA 1.0 . 4.54 842 842 A 93 ILE HD11 A 93 ILE HA 1.0 . 3.51 843 843 A 5 LYS H A 163 ILE HG21 1.0 . 5.41 844 844 A 96 TYR H A 94 HIS HA 1.0 . 4.77 845 845 A 94 HIS HA A 97 ARG HBy 1.0 . 4.40 846 846 A 93 ILE HG21 A 94 HIS HA 1.0 . 4.28 847 847 A 95 GLN HA A 94 HIS HD2 1.0 . 4.89 848 848 A 99 GLN HA A 99 GLN HGy 1.0 . 3.84 849 849 A 99 GLN HGx A 99 GLN HA 1.0 . 3.84 850 850 A 95 GLN HBx A 92 ASP HA 1.0 . 4.98 851 851 A 95 GLN HBy A 92 ASP HA 1.0 . 4.98 852 852 A 95 GLN HGy A 94 HIS HD2 1.0 . 4.93 853 853 A 95 GLN HGx A 94 HIS HD2 1.0 . 4.93 854 854 A 100 ILE HD11 A 96 TYR HBy 1.0 . 5.39 855 855 A 100 ILE HD11 A 96 TYR HBx 1.0 . 5.39 856 856 A 97 ARG HA A 101 LYS H 1.0 . 4.83 857 857 A 97 ARG HA A 97 ARG HDy 1.0 . 5.19 858 858 A 97 ARG HA A 111 MET HE1 1.0 . 3.80 859 859 A 97 ARG HA A 100 ILE HG21 1.0 . 4.47 860 860 A 97 ARG HA A 100 ILE HD11 1.0 . 3.72 861 861 A 142 ILE HG1y A 155 ALA HA 1.0 . 4.30 862 862 A 142 ILE HG1x A 155 ALA HA 1.0 . 4.30 863 863 A 142 ILE HG1y A 142 ILE HA 1.0 . 4.09 864 864 A 98 GLU H A 98 GLU HGx 1.0 . 4.03 865 865 A 142 ILE HA A 142 ILE HG1x 1.0 . 4.09 866 866 A 142 ILE HA A 142 ILE HG21 1.0 . 3.35 867 867 A 130 ALA HB1 A 113 LEU HG 1.0 . 4.31 868 868 A 104 LYS H A 100 ILE HA 1.0 . 5.02 869 869 A 100 ILE HD11 A 100 ILE HA 1.0 . 4.04 870 870 A 97 ARG HA A 100 ILE HB 1.0 . 4.79 871 871 A 111 MET HE1 A 100 ILE HB 1.0 . 4.33 872 872 A 100 ILE HD11 A 100 ILE HB 1.0 . 3.39 873 873 A 100 ILE HD11 A 97 ARG H 1.0 . 5.14 874 874 A 100 ILE HD11 A 78 PHE H 1.0 . 4.97 875 875 A 101 LYS H A 100 ILE HD11 1.0 . 4.51 876 876 A 111 MET HE1 A 100 ILE HD11 1.0 . 3.11 877 877 A 100 ILE HD11 A 9 VAL HG11 1.0 . 4.15 878 878 A 7 VAL H A 7 VAL HG21 1.0 . 4.15 879 879 A 100 ILE HD11 A 100 ILE HG21 1.0 . 2.98 880 880 A 100 ILE HG21 A 104 LYS H 1.0 . 5.31 881 881 A 100 ILE HG21 A 101 LYS HA 1.0 . 4.87 882 882 A 100 ILE HG21 A 100 ILE HA 1.0 . 3.50 883 883 A 100 ILE HG21 A 109 VAL HB 1.0 . 4.10 884 884 A 100 ILE HG21 A 109 VAL HGy% 1.0 . 3.64 885 885 A 100 ILE HG21 A 109 VAL HGx% 1.0 . 3.64 886 886 A 101 LYS HBx A 98 GLU HA 1.0 . 4.75 887 887 A 101 LYS HBy A 98 GLU HA 1.0 . 4.75 888 888 A 158 THR HG21 A 140 PRO HBx 1.0 . 3.60 889 889 A 101 LYS HA A 101 LYS HDy 1.0 . 4.95 890 890 A 101 LYS HA A 101 LYS HDx 1.0 . 4.95 891 891 A 102 ARG HA A 102 ARG HGy 1.0 . 3.85 892 892 A 103 VAL HGx% A 103 VAL HA 1.0 . 3.37 893 893 A 152 VAL HA A 152 VAL HG21 1.0 . 3.53 894 894 A 103 VAL HG21 A 103 VAL HA 1.0 . 3.37 895 895 A 105 ASP H A 104 LYS HGx 1.0 . 5.21 896 896 A 105 ASP H A 104 LYS HGy 1.0 . 5.21 897 897 A 100 ILE HG21 A 104 LYS HGx 1.0 . 4.58 898 898 A 100 ILE HG21 A 104 LYS HGy 1.0 . 4.58 899 899 A 139 ILE HA A 140 PRO HGx 1.0 . 5.06 900 900 A 78 PHE HZ A 104 LYS HEy 1.0 . 4.82 901 901 A 78 PHE HZ A 104 LYS HEx 1.0 . 4.82 902 902 A 109 VAL HGy% A 104 LYS HEy 1.0 . 4.61 903 903 A 109 VAL HGy% A 104 LYS HEx 1.0 . 4.61 904 904 A 109 VAL HGx% A 104 LYS HEy 1.0 . 4.61 905 905 A 109 VAL HGx% A 104 LYS HEx 1.0 . 4.61 906 906 A 100 ILE HG21 A 104 LYS HEy 1.0 . 5.08 907 907 A 100 ILE HG21 A 104 LYS HEx 1.0 . 5.08 908 908 A 109 VAL H A 108 ASP HBy 1.0 . 4.53 909 909 A 109 VAL HGx% A 109 VAL HA 1.0 . 3.61 910 910 A 150 GLN HA A 150 GLN HGx 1.0 . 3.85 911 911 A 150 GLN HA A 150 GLN HGy 1.0 . 3.85 912 912 A 163 ILE HA A 110 PRO HGx 1.0 . 4.27 913 913 A 163 ILE HA A 110 PRO HGy 1.0 . 4.27 914 914 A 163 ILE HG21 A 110 PRO HGy 1.0 . 4.69 915 915 A 163 ILE HD11 A 110 PRO HGy 1.0 . 5.30 916 916 A 163 ILE HD11 A 110 PRO HGx 1.0 . 5.30 917 917 A 163 ILE HG21 A 110 PRO HGx 1.0 . 4.69 918 918 A 111 MET HE1 A 111 MET HGy 1.0 . 3.99 919 919 A 111 MET HE1 A 111 MET HGx 1.0 . 3.99 920 920 A 100 ILE HD11 A 111 MET HGy 1.0 . 5.12 921 921 A 100 ILE HD11 A 111 MET HGx 1.0 . 5.12 922 922 A 111 MET HE1 A 97 ARG H 1.0 . 4.96 923 923 A 111 MET HE1 A 78 PHE H 1.0 . 4.58 924 924 A 111 MET HE1 A 112 VAL H 1.0 . 4.73 925 925 A 111 MET HE1 A 111 MET HA 1.0 . 4.68 926 926 A 111 MET HE1 A 109 VAL HGy% 1.0 . 3.53 927 927 A 111 MET HE1 A 109 VAL HGx% 1.0 . 3.53 928 928 A 112 VAL HA A 139 ILE HA 1.0 . 5.04 929 929 A 112 VAL HB A 79 LEU HA 1.0 . 5.05 930 930 A 159 LEU HD21 A 159 LEU HA 1.0 . 4.45 931 931 A 112 VAL H A 113 LEU HA 1.0 . 4.94 932 932 A 113 LEU HDy% A 113 LEU HA 1.0 . 4.85 933 933 A 113 LEU HDx% A 113 LEU HA 1.0 . 4.85 934 934 A 139 ILE HD11 A 113 LEU HA 1.0 . 4.75 935 935 A 139 ILE HD11 A 139 ILE HA 1.0 . 4.59 936 936 A 113 LEU HBy A 134 ALA HB1 1.0 . 3.98 937 937 A 139 ILE HD11 A 113 LEU HBy 1.0 . 4.91 938 938 A 139 ILE HD11 A 113 LEU HBx 1.0 . 4.91 939 939 A 134 ALA HB1 A 113 LEU HBx 1.0 . 3.98 940 940 A 114 VAL HA A 155 ALA HB1 1.0 . 4.77 941 941 A 114 VAL HA A 142 ILE HB 1.0 . 4.78 942 942 A 114 VAL HGy% A 114 VAL HA 1.0 . 3.65 943 943 A 116 ASN HA A 144 THR HB 1.0 . 4.70 944 944 A 116 ASN H A 116 ASN HBy 1.0 . 4.13 945 945 A 148 THR HG21 A 119 ASP HA 1.0 . 4.27 946 946 A 5 LYS H A 4 TYR HBy 1.0 . 5.21 947 947 A 5 LYS H A 4 TYR HBx 1.0 . 5.21 948 948 A 122 ALA H A 120 LEU HBy 1.0 . 4.98 949 949 A 120 LEU HA A 120 LEU HDx% 1.0 . 4.31 950 950 A 120 LEU HA A 120 LEU HD21 1.0 . 4.31 951 951 A 121 ALA HA A 122 ALA HA 1.0 . 4.53 952 952 A 123 ARG HA A 122 ALA HA 1.0 . 4.94 953 953 A 121 ALA H A 122 ALA HB1 1.0 . 4.89 954 954 A 122 ALA HB1 A 121 ALA HA 1.0 . 4.33 955 955 A 122 ALA HB1 A 85 ASN HBy 1.0 . 4.71 956 956 A 122 ALA HB1 A 85 ASN HBx 1.0 . 4.71 957 957 A 125 VAL H A 123 ARG HA 1.0 . 4.31 958 958 A 84 ILE HB A 123 ARG HA 1.0 . 4.40 959 959 A 124 THR HG21 A 123 ARG HA 1.0 . 4.17 960 960 A 126 GLU HA A 123 ARG HDy 1.0 . 4.47 961 961 A 126 GLU HA A 123 ARG HDx 1.0 . 4.47 962 962 A 85 ASN HA A 124 THR HA 1.0 . 5.13 963 963 A 85 ASN HA A 124 THR HB 1.0 . 5.14 964 964 A 87 THR HA A 124 THR HB 1.0 . 5.07 965 965 A 124 THR HG21 A 124 THR HA 1.0 . 3.14 966 966 A 125 VAL HA A 126 GLU HGx 1.0 . 4.45 967 967 A 126 GLU HA A 126 GLU HGy 1.0 . 3.96 968 968 A 125 VAL HA A 125 VAL HG21 1.0 . 3.23 969 969 A 90 PHE HBy A 125 VAL HGx% 1.0 . 5.08 970 970 A 90 PHE HBx A 125 VAL HGx% 1.0 . 5.08 971 971 A 126 GLU HGy A 129 GLN H 1.0 . 4.52 972 972 A 129 GLN H A 126 GLU HGx 1.0 . 4.52 973 973 A 130 ALA H A 128 ARG HA 1.0 . 5.03 974 974 A 129 GLN HA A 131 GLN H 1.0 . 5.06 975 975 A 129 GLN HA A 132 ASP HBy 1.0 . 4.08 976 976 A 129 GLN HA A 132 ASP HBx 1.0 . 4.08 977 977 A 130 ALA HB1 A 129 GLN HA 1.0 . 5.10 978 978 A 131 GLN HA A 135 ARG H 1.0 . 4.24 979 979 A 141 TYR HBy A 131 GLN HA 1.0 . 4.62 980 980 A 131 GLN HA A 141 TYR HBx 1.0 . 4.62 981 981 A 131 GLN HA A 134 ALA HB1 1.0 . 3.60 982 982 A 130 ALA HB1 A 131 GLN HA 1.0 . 4.91 983 983 A 136 SER H A 132 ASP HA 1.0 . 4.82 984 984 A 136 SER H A 133 LEU HA 1.0 . 4.67 985 985 A 133 LEU HBy A 90 PHE HZ 1.0 . 4.90 986 986 A 133 LEU HDx% A 133 LEU HA 1.0 . 4.03 987 987 A 133 LEU HDy% A 133 LEU HA 1.0 . 4.03 988 988 A 134 ALA HA A 137 TYR HBy 1.0 . 4.59 989 989 A 134 ALA HA A 137 TYR HBx 1.0 . 4.59 990 990 A 134 ALA HA A 139 ILE HD11 1.0 . 4.18 991 991 A 113 LEU H A 134 ALA HB1 1.0 . 5.04 992 992 A 141 TYR H A 134 ALA HB1 1.0 . 4.35 993 993 A 139 ILE H A 134 ALA HB1 1.0 . 4.60 994 994 A 136 SER H A 134 ALA HB1 1.0 . 5.15 995 995 A 131 GLN HE2y A 134 ALA HB1 1.0 . 4.78 996 996 A 141 TYR HA A 134 ALA HB1 1.0 . 4.47 997 997 A 135 ARG HA A 134 ALA HB1 1.0 . 4.84 998 998 A 140 PRO HA A 134 ALA HB1 1.0 . 5.03 999 999 A 141 TYR HBy A 134 ALA HB1 1.0 . 3.79 1000 1000 A 134 ALA HB1 A 141 TYR HBx 1.0 . 3.79 1001 1001 A 130 ALA HB1 A 134 ALA HB1 1.0 . 4.06 1002 1002 A 138 GLY H A 136 SER HA 1.0 . 5.02 1003 1003 A 139 ILE HA A 140 PRO HDy 1.0 . 4.07 1004 1004 A 139 ILE HA A 140 PRO HDx 1.0 . 4.07 1005 1005 A 139 ILE HA A 140 PRO HGy 1.0 . 5.06 1006 1006 A 139 ILE HG21 A 139 ILE HA 1.0 . 3.54 1007 1007 A 140 PRO HDy A 139 ILE HB 1.0 . 4.36 1008 1008 A 140 PRO HDx A 139 ILE HB 1.0 . 4.36 1009 1009 A 112 VAL HA A 139 ILE HB 1.0 . 4.82 1010 1010 A 113 LEU H A 139 ILE HD11 1.0 . 4.27 1011 1011 A 137 TYR HA A 139 ILE HD11 1.0 . 4.87 1012 1012 A 112 VAL HA A 139 ILE HD11 1.0 . 4.23 1013 1013 A 137 TYR HBy A 139 ILE HD11 1.0 . 4.38 1014 1014 A 139 ILE HD11 A 137 TYR HBx 1.0 . 4.38 1015 1015 A 139 ILE HD11 A 139 ILE HB 1.0 . 3.66 1016 1016 A 139 ILE HG21 A 140 PRO HDy 1.0 . 4.83 1017 1017 A 139 ILE HG21 A 140 PRO HDx 1.0 . 4.83 1018 1018 A 139 ILE HG21 A 137 TYR HBx 1.0 . 4.27 1019 1019 A 158 THR HG21 A 140 PRO HBy 1.0 . 3.60 1020 1020 A 1 MET HE1 A 50 THR HG21 1.0 . 2.89 1021 1021 A 112 VAL HA A 140 PRO HDx 1.0 . 4.82 1022 1022 A 112 VAL HA A 140 PRO HDy 1.0 . 4.82 1023 1023 A 141 TYR HA A 113 LEU HG 1.0 . 5.38 1024 1024 A 141 TYR HA A 142 ILE HB 1.0 . 5.31 1025 1025 A 155 ALA HA A 142 ILE HB 1.0 . 4.72 1026 1026 A 113 LEU H A 142 ILE HD11 1.0 . 5.03 1027 1027 A 142 ILE HD11 A 142 ILE HA 1.0 . 3.89 1028 1028 A 142 ILE HD11 A 155 ALA HA 1.0 . 3.25 1029 1029 A 142 ILE HD11 A 158 THR HB 1.0 . 4.05 1030 1030 A 112 VAL HB A 142 ILE HD11 1.0 . 4.05 1031 1031 A 21 ILE HG21 A 22 GLN HA 1.0 . 5.12 1032 1032 A 154 ASP HBy A 142 ILE HG21 1.0 . 3.93 1033 1033 A 142 ILE HG21 A 154 ASP HBx 1.0 . 3.93 1034 1034 A 152 VAL HA A 144 THR HB 1.0 . 4.58 1035 1035 A 155 ALA HB1 A 144 THR HB 1.0 . 5.27 1036 1036 A 152 VAL HG11 A 144 THR HB 1.0 . 5.12 1037 1037 A 152 VAL HG21 A 144 THR HB 1.0 . 5.12 1038 1038 A 155 ALA HB1 A 156 PHE HA 1.0 . 4.20 1039 1039 A 155 ALA HB1 A 144 THR HG21 1.0 . 2.90 1040 1040 A 155 ALA H A 144 THR HG21 1.0 . 4.76 1041 1041 A 117 LYS H A 145 SER HA 1.0 . 4.32 1042 1042 A 145 SER HA A 116 ASN HA 1.0 . 4.88 1043 1043 A 148 THR HG21 A 145 SER HBx 1.0 . 4.93 1044 1044 A 148 THR HG21 A 145 SER HBy 1.0 . 4.93 1045 1045 A 146 ALA HB1 A 117 LYS HA 1.0 . 4.96 1046 1046 A 146 ALA HB1 A 19 LEU HG 1.0 . 3.92 1047 1047 A 28 PHE HZ A 147 LYS HA 1.0 . 5.36 1048 1048 A 147 LYS HA A 147 LYS HDy 1.0 . 4.89 1049 1049 A 147 LYS HA A 147 LYS HDx 1.0 . 4.89 1050 1050 A 147 LYS H A 147 LYS HDy 1.0 . 5.01 1051 1051 A 147 LYS H A 147 LYS HDx 1.0 . 5.01 1052 1052 A 147 LYS HGx A 147 LYS HEy 1.0 . 3.85 1053 1053 A 147 LYS HGx A 147 LYS HEx 1.0 . 3.85 1054 1054 A 147 LYS HGy A 147 LYS HEy 1.0 . 3.85 1055 1055 A 147 LYS HGy A 147 LYS HEx 1.0 . 3.85 1056 1056 A 148 THR HG21 A 148 THR HA 1.0 . 3.25 1057 1057 A 150 GLN HBy A 148 THR HB 1.0 . 5.21 1058 1058 A 150 GLN HBx A 148 THR HB 1.0 . 5.21 1059 1059 A 146 ALA HA A 149 ARG HA 1.0 . 4.78 1060 1060 A 150 GLN HA A 152 VAL H 1.0 . 4.93 1061 1061 A 154 ASP HBy A 151 GLY HAy 1.0 . 5.05 1062 1062 A 154 ASP HBy A 151 GLY HAx 1.0 . 5.05 1063 1063 A 154 ASP HBx A 151 GLY HAy 1.0 . 5.05 1064 1064 A 155 ALA HB1 A 152 VAL HA 1.0 . 4.07 1065 1065 A 157 TYR H A 153 GLU HA 1.0 . 5.08 1066 1066 A 155 ALA H A 153 GLU HA 1.0 . 5.24 1067 1067 A 156 PHE HBy A 153 GLU HA 1.0 . 5.24 1068 1068 A 156 PHE HBx A 153 GLU HA 1.0 . 5.24 1069 1069 A 153 GLU HA A 152 VAL HG21 1.0 . 5.31 1070 1070 A 153 GLU HA A 152 VAL HG11 1.0 . 5.31 1071 1071 A 153 GLU HA A 23 LEU HDy% 1.0 . 4.55 1072 1072 A 153 GLU HGx A 149 ARG HE 1.0 . 5.43 1073 1073 A 149 ARG HE A 153 GLU HGy 1.0 . 5.43 1074 1074 A 153 GLU HGx A 153 GLU HA 1.0 . 3.94 1075 1075 A 153 GLU HA A 153 GLU HGy 1.0 . 3.94 1076 1076 A 154 ASP HBx A 151 GLY HAx 1.0 . 5.05 1077 1077 A 154 ASP HBy A 155 ALA HB1 1.0 . 4.94 1078 1078 A 155 ALA HB1 A 154 ASP HA 1.0 . 5.07 1079 1079 A 155 ALA HB1 A 154 ASP HBx 1.0 . 4.94 1080 1080 A 158 THR HB A 155 ALA HA 1.0 . 4.35 1081 1081 A 155 ALA HB1 A 156 PHE HBy 1.0 . 5.32 1082 1082 A 156 PHE HBx A 155 ALA HB1 1.0 . 5.32 1083 1083 A 155 ALA HB1 A 142 ILE HB 1.0 . 3.63 1084 1084 A 159 LEU HBy A 156 PHE HA 1.0 . 5.24 1085 1085 A 159 LEU HBx A 156 PHE HA 1.0 . 5.24 1086 1086 A 158 THR HG21 A 158 THR HA 1.0 . 3.46 1087 1087 A 159 LEU HD21 A 159 LEU HBy 1.0 . 4.23 1088 1088 A 159 LEU HD11 A 159 LEU HA 1.0 . 4.45 1089 1089 A 159 LEU HBy A 159 LEU HD11 1.0 . 4.23 1090 1090 A 159 LEU HBx A 159 LEU HD11 1.0 . 4.23 1091 1091 A 159 LEU HD21 A 77 GLY HAx 1.0 . 5.27 1092 1092 A 160 VAL HA A 163 ILE HB 1.0 . 4.10 1093 1093 A 160 VAL HGx% A 160 VAL HA 1.0 . 3.40 1094 1094 A 163 ILE HD11 A 160 VAL HA 1.0 . 3.61 1095 1095 A 163 ILE HG21 A 160 VAL HA 1.0 . 4.48 1096 1096 A 160 VAL HGx% A 157 TYR HA 1.0 . 4.95 1097 1097 A 157 TYR HA A 160 VAL HGy% 1.0 . 4.95 1098 1098 A 160 VAL HA A 160 VAL HGy% 1.0 . 3.40 1099 1099 A 46 ILE HB A 160 VAL HGy% 1.0 . 4.78 1100 1100 A 46 ILE HD11 A 160 VAL HGy% 1.0 . 3.33 1101 1101 A 164 ARG HDy A 161 ARG HA 1.0 . 4.93 1102 1102 A 164 ARG HDx A 161 ARG HA 1.0 . 4.93 1103 1103 A 163 ILE HA A 166 HIS HBy 1.0 . 4.28 1104 1104 A 166 HIS HBx A 163 ILE HA 1.0 . 4.28 1105 1105 A 163 ILE HG21 A 163 ILE HA 1.0 . 3.62 1106 1106 A 163 ILE HD11 A 163 ILE HA 1.0 . 4.20 1107 1107 A 163 ILE HD11 A 163 ILE HB 1.0 . 3.86 1108 1108 A 163 ILE HD11 A 76 GLU H 1.0 . 5.02 1109 1109 A 163 ILE HD11 A 164 ARG H 1.0 . 5.01 1110 1110 A 163 ILE HD11 A 4 TYR HA 1.0 . 5.09 1111 1111 A 163 ILE HD11 A 159 LEU HG 1.0 . 4.01 1112 1112 A 164 ARG HA A 163 ILE HG21 1.0 . 4.43 1113 1113 A 163 ILE HD11 A 163 ILE HG21 1.0 . 3.08 1114 1114 A 164 ARG HDy A 164 ARG H 1.0 . 5.29 1115 1115 A 164 ARG HDx A 164 ARG H 1.0 . 5.29 1116 1116 A 166 HIS HA A 166 HIS HD2 1.0 . 4.55 1117 1117 A 72 MET HE1 A 99 GLN HE2x 1.0 . 4.76 1118 1118 A 43 GLN HE2x A 43 GLN HGy 1.0 . 4.03 1119 1119 A 129 GLN HE2y A 129 GLN HBy 1.0 . 4.86 1120 1120 A 129 GLN HE2y A 129 GLN HBx 1.0 . 4.86 1121 1121 A 129 GLN HE2x A 129 GLN HBy 1.0 . 4.86 1122 1122 A 129 GLN HE2x A 129 GLN HBx 1.0 . 4.86 1123 1123 A 123 ARG HE A 123 ARG HBx 1.0 . 5.13 1124 1124 A 69 ASP H A 69 ASP HBy 1.0 . 3.68 1125 1125 A 69 ASP HBx A 69 ASP H 1.0 . 3.68 1126 1126 A 126 GLU HBy A 127 SER H 1.0 . 4.39 1127 1127 A 127 SER H A 126 GLU HBx 1.0 . 4.39 1128 1128 A 38 ASP H A 38 ASP HBy 1.0 . 4.09 1129 1129 A 38 ASP H A 38 ASP HBx 1.0 . 4.09 1130 1130 A 39 SER H A 38 ASP HBy 1.0 . 4.48 1131 1131 A 39 SER H A 38 ASP HBx 1.0 . 4.48 1132 1132 A 90 PHE HBy A 91 GLU H 1.0 . 4.30 1133 1133 A 90 PHE HBx A 91 GLU H 1.0 . 4.30 1134 1134 A 91 GLU H A 91 GLU HBy 1.0 . 3.88 1135 1135 A 91 GLU H A 91 GLU HBx 1.0 . 3.88 1136 1136 A 134 ALA H A 134 ALA HB1 1.0 . 3.21 1137 1137 A 108 ASP HBy A 108 ASP H 1.0 . 3.74 1138 1138 A 108 ASP H A 108 ASP HBx 1.0 . 3.74 1139 1139 A 107 ASP H A 106 SER HA 1.0 . 3.08 1140 1140 A 10 GLY H A 9 VAL HB 1.0 . 3.67 1141 1141 A 33 ASP H A 33 ASP HBy 1.0 . 4.19 1142 1142 A 39 SER H A 38 ASP HA 1.0 . 3.42 1143 1143 A 70 GLN H A 69 ASP HBy 1.0 . 4.03 1144 1144 A 105 ASP H A 105 ASP HBx 1.0 . 4.01 1145 1145 A 135 ARG H A 134 ALA HB1 1.0 . 3.49 1146 1146 A 152 VAL H A 152 VAL HB 1.0 . 3.42 1147 1147 A 123 ARG H A 122 ALA HA 1.0 . 2.98 1148 1148 A 132 ASP H A 132 ASP HBy 1.0 . 3.45 1149 1149 A 132 ASP H A 132 ASP HBx 1.0 . 3.45 1150 1150 A 61 GLN H A 61 GLN HBx 1.0 . 3.87 1151 1151 A 23 LEU H A 22 GLN HBy 1.0 . 4.51 1152 1152 A 23 LEU H A 23 LEU HBy 1.0 . 3.79 1153 1153 A 137 TYR HBy A 137 TYR H 1.0 . 4.03 1154 1154 A 137 TYR H A 137 TYR HBx 1.0 . 4.03 1155 1155 A 138 GLY H A 137 TYR HBx 1.0 . 4.68 1156 1156 A 14 VAL HG11 A 15 GLY H 1.0 . 5.06 1157 1157 A 11 ALA HB1 A 12 GLY H 1.0 . 3.45 1158 1158 A 12 GLY H A 11 ALA HA 1.0 . 3.40 1159 1159 A 2 THR H A 2 THR HB 1.0 . 3.35 1160 1160 A 3 GLU HBy A 4 TYR H 1.0 . 4.71 1161 1161 A 51 CYS HA A 52 LEU H 1.0 . 3.36 1162 1162 A 52 LEU H A 51 CYS HBx 1.0 . 4.02 1163 1163 A 52 LEU H A 52 LEU HBx 1.0 . 3.89 1164 1164 A 3 GLU H A 2 THR HB 1.0 . 4.07 1165 1165 A 46 ILE H A 45 VAL HB 1.0 . 4.79 1166 1166 A 55 ILE H A 55 ILE HB 1.0 . 4.00 1167 1167 A 55 ILE H A 54 ASP HA 1.0 . 3.47 1168 1168 A 5 LYS H A 4 TYR HA 1.0 . 3.37 1169 1169 A 55 ILE H A 54 ASP HBy 1.0 . 5.10 1170 1170 A 55 ILE H A 54 ASP HBx 1.0 . 5.10 1171 1171 A 82 PHE H A 81 VAL HA 1.0 . 3.23 1172 1172 A 50 THR HA A 51 CYS H 1.0 . 3.17 1173 1173 A 45 VAL HA A 51 CYS H 1.0 . 3.93 1174 1174 A 51 CYS H A 50 THR HB 1.0 . 4.59 1175 1175 A 53 LEU H A 52 LEU HBx 1.0 . 4.76 1176 1176 A 6 LEU H A 55 ILE HA 1.0 . 4.19 1177 1177 A 6 LEU H A 6 LEU HG 1.0 . 4.24 1178 1178 A 6 LEU H A 54 ASP HBy 1.0 . 4.42 1179 1179 A 50 THR H A 50 THR HB 1.0 . 3.53 1180 1180 A 50 THR H A 49 GLU HBy 1.0 . 4.53 1181 1181 A 50 THR H A 49 GLU HBx 1.0 . 4.53 1182 1182 A 81 VAL H A 80 CYS HA 1.0 . 3.26 1183 1183 A 80 CYS HBy A 81 VAL H 1.0 . 5.26 1184 1184 A 80 CYS HBx A 81 VAL H 1.0 . 5.26 1185 1185 A 114 VAL H A 113 LEU HA 1.0 . 3.42 1186 1186 A 114 VAL H A 114 VAL HB 1.0 . 4.06 1187 1187 A 113 LEU HDy% A 114 VAL H 1.0 . 5.00 1188 1188 A 114 VAL H A 113 LEU HG 1.0 . 4.88 1189 1189 A 7 VAL H A 7 VAL HB 1.0 . 3.90 1190 1190 A 7 VAL H A 6 LEU HA 1.0 . 3.45 1191 1191 A 163 ILE H A 163 ILE HB 1.0 . 3.63 1192 1192 A 36 ILE H A 35 SER HA 1.0 . 3.29 1193 1193 A 36 ILE H A 36 ILE HB 1.0 . 3.79 1194 1194 A 36 ILE H A 36 ILE HG21 1.0 . 3.95 1195 1195 A 36 ILE H A 36 ILE HG1x 1.0 . 4.23 1196 1196 A 36 ILE H A 36 ILE HG1y 1.0 . 4.23 1197 1197 A 8 VAL H A 7 VAL HA 1.0 . 3.48 1198 1198 A 43 GLN H A 42 LYS HBy 1.0 . 4.17 1199 1199 A 43 GLN H A 42 LYS HBx 1.0 . 4.17 1200 1200 A 43 GLN H A 42 LYS HA 1.0 . 3.16 1201 1201 A 56 LEU H A 55 ILE HA 1.0 . 3.46 1202 1202 A 56 LEU H A 55 ILE HB 1.0 . 5.09 1203 1203 A 142 ILE H A 142 ILE HB 1.0 . 3.93 1204 1204 A 141 TYR HBy A 142 ILE H 1.0 . 5.15 1205 1205 A 142 ILE H A 141 TYR HBx 1.0 . 5.15 1206 1206 A 9 VAL H A 8 VAL HA 1.0 . 3.20 1207 1207 A 43 GLN HGy A 44 VAL H 1.0 . 4.35 1208 1208 A 20 THR HB A 21 ILE H 1.0 . 4.21 1209 1209 A 19 LEU H A 19 LEU HBx 1.0 . 3.89 1210 1210 A 19 LEU H A 19 LEU HBy 1.0 . 3.89 1211 1211 A 156 PHE HBx A 156 PHE H 1.0 . 3.89 1212 1212 A 156 PHE HBy A 156 PHE H 1.0 . 3.89 1213 1213 A 155 ALA HB1 A 156 PHE H 1.0 . 3.65 1214 1214 A 57 ASP HBx A 58 THR H 1.0 . 5.35 1215 1215 A 57 ASP HBy A 58 THR H 1.0 . 5.35 1216 1216 A 16 LYS HBx A 17 SER H 1.0 . 4.76 1217 1217 A 17 SER H A 16 LYS HBy 1.0 . 4.76 1218 1218 A 157 TYR H A 157 TYR HBy 1.0 . 3.97 1219 1219 A 20 THR H A 19 LEU HBy 1.0 . 4.32 1220 1220 A 19 LEU HG A 20 THR H 1.0 . 4.96 1221 1221 A 95 GLN H A 94 HIS HBy 1.0 . 4.12 1222 1222 A 165 GLN H A 165 GLN HBy 1.0 . 3.73 1223 1223 A 120 LEU H A 120 LEU HBy 1.0 . 3.86 1224 1224 A 120 LEU H A 120 LEU HG 1.0 . 3.59 1225 1225 A 45 VAL H A 44 VAL HB 1.0 . 3.26 1226 1226 A 64 TYR H A 64 TYR HBy 1.0 . 3.90 1227 1227 A 24 ILE H A 24 ILE HB 1.0 . 3.89 1228 1228 A 89 SER H A 89 SER HBx 1.0 . 4.19 1229 1229 A 89 SER H A 88 LYS HBx 1.0 . 4.13 1230 1230 A 114 VAL HA A 115 GLY H 1.0 . 3.44 1231 1231 A 25 GLN H A 25 GLN HGy 1.0 . 4.63 1232 1232 A 25 GLN H A 24 ILE HB 1.0 . 3.74 1233 1233 A 151 GLY H A 150 GLN HGy 1.0 . 4.31 1234 1234 A 150 GLN HBy A 151 GLY H 1.0 . 4.92 1235 1235 A 124 THR H A 85 ASN HA 1.0 . 3.84 1236 1236 A 145 SER H A 150 GLN HBx 1.0 . 4.94 1237 1237 A 144 THR H A 143 GLU HA 1.0 . 3.45 1238 1238 A 145 SER H A 144 THR HB 1.0 . 3.50 1239 1239 A 73 ARG H A 73 ARG HGy 1.0 . 4.14 1240 1240 A 22 GLN HA A 26 ASN H 1.0 . 4.05 1241 1241 A 148 THR HB A 149 ARG H 1.0 . 4.25 1242 1242 A 102 ARG H A 101 LYS HA 1.0 . 3.57 1243 1243 A 101 LYS H A 100 ILE HB 1.0 . 3.78 1244 1244 A 29 VAL H A 29 VAL HB 1.0 . 4.20 1245 1245 A 29 VAL H A 28 PHE HBy 1.0 . 5.18 1246 1246 A 29 VAL H A 28 PHE HBx 1.0 . 5.18 1247 1247 A 166 HIS H A 166 HIS HBy 1.0 . 3.57 1248 1248 A 166 HIS H A 165 GLN HBy 1.0 . 4.50 1249 1249 A 165 GLN HBx A 166 HIS H 1.0 . 4.50 1250 1250 A 150 GLN H A 150 GLN HBx 1.0 . 3.49 1251 1251 A 125 VAL H A 125 VAL HB 1.0 . 4.03 1252 1252 A 125 VAL H A 124 THR HB 1.0 . 5.19 1253 1253 A 133 LEU H A 132 ASP HBy 1.0 . 4.02 1254 1254 A 133 LEU H A 132 ASP HBx 1.0 . 4.02 1255 1255 A 133 LEU H A 133 LEU HBy 1.0 . 3.62 1256 1256 A 30 ASP HBy A 30 ASP H 1.0 . 4.12 1257 1257 A 109 VAL H A 108 ASP HBx 1.0 . 4.53 1258 1258 A 30 ASP HBx A 30 ASP H 1.0 . 4.12 1259 1259 A 29 VAL HA A 30 ASP H 1.0 . 3.27 1260 1260 A 49 GLU H A 49 GLU HBx 1.0 . 3.69 1261 1261 A 49 GLU H A 49 GLU HBy 1.0 . 3.69 1262 1262 A 31 GLU H A 30 ASP HBy 1.0 . 4.14 1263 1263 A 71 TYR H A 71 TYR HBx 1.0 . 4.07 1264 1264 A 103 VAL H A 103 VAL HB 1.0 . 3.45 1265 1265 A 31 GLU H A 29 VAL HA 1.0 . 4.46 1266 1266 A 65 SER H A 64 TYR HA 1.0 . 3.55 1267 1267 A 65 SER H A 64 TYR HBy 1.0 . 5.10 1268 1268 A 95 GLN HBy A 96 TYR H 1.0 . 4.27 1269 1269 A 154 ASP H A 154 ASP HBx 1.0 . 3.67 1270 1270 A 154 ASP H A 153 GLU HBy 1.0 . 3.94 1271 1271 A 153 GLU H A 153 GLU HGy 1.0 . 4.15 1272 1272 A 153 GLU H A 152 VAL HB 1.0 . 3.63 1273 1273 A 153 GLU H A 153 GLU HBy 1.0 . 3.78 1274 1274 A 158 THR H A 157 TYR HBy 1.0 . 4.67 1275 1275 A 157 TYR HBx A 158 THR H 1.0 . 4.67 1276 1276 A 92 ASP H A 91 GLU HBy 1.0 . 4.11 1277 1277 A 92 ASP H A 91 GLU HBx 1.0 . 4.11 1278 1278 A 128 ARG H A 128 ARG HBy 1.0 . 3.51 1279 1279 A 128 ARG H A 128 ARG HBx 1.0 . 3.51 1280 1280 A 131 GLN HBy A 131 GLN H 1.0 . 3.70 1281 1281 A 131 GLN HBx A 131 GLN H 1.0 . 3.70 1282 1282 A 130 ALA HB1 A 131 GLN H 1.0 . 3.58 1283 1283 A 131 GLN H A 128 ARG HA 1.0 . 3.60 1284 1284 A 159 LEU HA A 162 GLU H 1.0 . 4.27 1285 1285 A 37 GLU H A 37 GLU HBx 1.0 . 4.05 1286 1286 A 48 GLY H A 47 ASP HBy 1.0 . 5.48 1287 1287 A 54 ASP H A 53 LEU HA 1.0 . 3.36 1288 1288 A 57 ASP H A 56 LEU HA 1.0 . 3.51 1289 1289 A 125 VAL HA A 126 GLU H 1.0 . 3.14 1290 1290 A 126 GLU H A 126 GLU HBx 1.0 . 3.61 1291 1291 A 106 SER H A 106 SER HBx 1.0 . 4.00 1292 1292 A 106 SER H A 106 SER HBy 1.0 . 4.00 1293 1293 A 72 MET HA A 75 GLY H 1.0 . 4.78 1294 1294 A 154 ASP HBy A 155 ALA H 1.0 . 4.01 1295 1295 A 155 ALA H A 154 ASP HBx 1.0 . 4.01 1296 1296 A 88 LYS H A 88 LYS HBy 1.0 . 3.81 1297 1297 A 88 LYS H A 88 LYS HBx 1.0 . 3.81 1298 1298 A 129 GLN H A 128 ARG HBx 1.0 . 4.11 1299 1299 A 146 ALA HB1 A 147 LYS H 1.0 . 3.81 1300 1300 A 130 ALA HB1 A 130 ALA H 1.0 . 3.21 1301 1301 A 129 GLN HBy A 130 ALA H 1.0 . 3.91 1302 1302 A 141 TYR H A 141 TYR HBx 1.0 . 3.93 1303 1303 A 146 ALA HB1 A 146 ALA H 1.0 . 3.62 1304 1304 A 145 SER HA A 146 ALA H 1.0 . 3.54 1305 1305 A 159 LEU H A 158 THR HB 1.0 . 4.01 1306 1306 A 144 THR H A 143 GLU HBy 1.0 . 4.73 1307 1307 A 60 GLY H A 59 ALA HB1 1.0 . 3.82 1308 1308 A 91 GLU H A 88 LYS HA 1.0 . 4.01 1309 1309 A 2 THR H A 1 MET H 1.0 . 4.57 1310 1310 A 2 THR H A 3 GLU H 1.0 . 4.54 1311 1311 A 2 THR H A 2 THR HG21 1.0 . 4.04 1312 1312 A 3 GLU H A 2 THR HG21 1.0 . 3.35 1313 1313 A 3 GLU H A 4 TYR H 1.0 . 5.00 1314 1314 A 4 TYR H A 5 LYS H 1.0 . 4.83 1315 1315 A 4 TYR H A 52 LEU HBy 1.0 . 4.69 1316 1316 A 4 TYR H A 52 LEU HBx 1.0 . 4.69 1317 1317 A 5 LYS H A 5 LYS HGx 1.0 . 4.12 1318 1318 A 6 LEU H A 54 ASP H 1.0 . 4.34 1319 1319 A 6 LEU H A 6 LEU HDx% 1.0 . 4.30 1320 1320 A 7 VAL H A 79 LEU H 1.0 . 4.56 1321 1321 A 7 VAL H A 77 GLY H 1.0 . 4.80 1322 1322 A 8 VAL H A 7 VAL HG11 1.0 . 4.35 1323 1323 A 8 VAL H A 9 VAL H 1.0 . 5.07 1324 1324 A 44 VAL H A 51 CYS H 1.0 . 4.10 1325 1325 A 10 GLY H A 9 VAL H 1.0 . 5.50 1326 1326 A 44 VAL H A 52 LEU HA 1.0 . 4.03 1327 1327 A 44 VAL H A 45 VAL HA 1.0 . 5.08 1328 1328 A 44 VAL H A 50 THR HG21 1.0 . 4.39 1329 1329 A 9 VAL H A 9 VAL HG11 1.0 . 3.99 1330 1330 A 10 GLY H A 11 ALA H 1.0 . 4.77 1331 1331 A 11 ALA H A 14 VAL HG11 1.0 . 4.63 1332 1332 A 11 ALA H A 12 GLY H 1.0 . 5.03 1333 1333 A 12 GLY H A 13 GLY H 1.0 . 4.87 1334 1334 A 14 VAL H A 13 GLY H 1.0 . 4.37 1335 1335 A 14 VAL H A 16 LYS H 1.0 . 4.79 1336 1336 A 14 VAL H A 15 GLY H 1.0 . 3.85 1337 1337 A 14 VAL HG21 A 14 VAL H 1.0 . 3.59 1338 1338 A 14 VAL H A 14 VAL HG11 1.0 . 3.59 1339 1339 A 15 GLY H A 16 LYS H 1.0 . 3.87 1340 1340 A 15 GLY H A 17 SER H 1.0 . 5.14 1341 1341 A 14 VAL HG21 A 15 GLY H 1.0 . 5.06 1342 1342 A 17 SER H A 16 LYS H 1.0 . 5.44 1343 1343 A 18 ALA H A 17 SER H 1.0 . 4.15 1344 1344 A 18 ALA H A 19 LEU H 1.0 . 4.30 1345 1345 A 146 ALA HB1 A 19 LEU H 1.0 . 4.18 1346 1346 A 19 LEU H A 19 LEU HD21 1.0 . 4.31 1347 1347 A 19 LEU H A 19 LEU HDx% 1.0 . 4.31 1348 1348 A 19 LEU H A 20 THR H 1.0 . 4.06 1349 1349 A 20 THR HG21 A 20 THR H 1.0 . 4.19 1350 1350 A 21 ILE H A 22 GLN H 1.0 . 4.37 1351 1351 A 20 THR H A 21 ILE H 1.0 . 4.36 1352 1352 A 21 ILE H A 17 SER HA 1.0 . 5.25 1353 1353 A 21 ILE H A 21 ILE HG1y 1.0 . 4.26 1354 1354 A 21 ILE HD11 A 21 ILE H 1.0 . 4.03 1355 1355 A 38 ASP H A 39 SER H 1.0 . 3.57 1356 1356 A 68 ARG H A 69 ASP H 1.0 . 3.42 1357 1357 A 23 LEU H A 22 GLN HBx 1.0 . 4.51 1358 1358 A 23 LEU H A 23 LEU HDy% 1.0 . 4.31 1359 1359 A 23 LEU HDx% A 23 LEU H 1.0 . 4.31 1360 1360 A 23 LEU H A 24 ILE H 1.0 . 4.34 1361 1361 A 24 ILE H A 21 ILE HA 1.0 . 4.80 1362 1362 A 24 ILE H A 24 ILE HG1x 1.0 . 4.68 1363 1363 A 20 THR HG21 A 24 ILE H 1.0 . 4.70 1364 1364 A 24 ILE H A 24 ILE HD11 1.0 . 3.90 1365 1365 A 24 ILE H A 25 GLN H 1.0 . 4.10 1366 1366 A 25 GLN H A 21 ILE HA 1.0 . 4.72 1367 1367 A 25 GLN H A 21 ILE HG21 1.0 . 4.81 1368 1368 A 25 GLN H A 26 ASN H 1.0 . 3.59 1369 1369 A 72 MET H A 73 ARG H 1.0 . 3.69 1370 1370 A 103 VAL HG21 A 73 ARG H 1.0 . 4.26 1371 1371 A 73 ARG H A 103 VAL HGx% 1.0 . 4.26 1372 1372 A 26 ASN H A 27 HIS H 1.0 . 4.00 1373 1373 A 25 GLN H A 27 HIS H 1.0 . 4.87 1374 1374 A 22 GLN HA A 27 HIS H 1.0 . 3.64 1375 1375 A 43 GLN HE2x A 50 THR HG21 1.0 . 3.96 1376 1376 A 21 ILE HG21 A 27 HIS H 1.0 . 3.88 1377 1377 A 31 GLU H A 30 ASP H 1.0 . 3.97 1378 1378 A 29 VAL HGy% A 30 ASP H 1.0 . 4.64 1379 1379 A 29 VAL HGx% A 30 ASP H 1.0 . 4.64 1380 1380 A 31 GLU H A 32 TYR H 1.0 . 4.04 1381 1381 A 31 GLU H A 29 VAL HGy% 1.0 . 4.57 1382 1382 A 78 PHE H A 159 LEU HD11 1.0 . 4.59 1383 1383 A 35 SER H A 36 ILE H 1.0 . 4.69 1384 1384 A 37 GLU HA A 39 SER H 1.0 . 4.84 1385 1385 A 37 GLU HBy A 39 SER H 1.0 . 5.26 1386 1386 A 39 SER H A 37 GLU HBx 1.0 . 5.26 1387 1387 A 40 TYR H A 55 ILE H 1.0 . 4.23 1388 1388 A 40 TYR H A 57 ASP H 1.0 . 5.38 1389 1389 A 40 TYR H A 39 SER H 1.0 . 4.81 1390 1390 A 40 TYR H A 54 ASP HA 1.0 . 5.04 1391 1391 A 40 TYR H A 55 ILE HB 1.0 . 4.72 1392 1392 A 40 TYR H A 41 ARG H 1.0 . 4.80 1393 1393 A 132 ASP H A 134 ALA H 1.0 . 4.23 1394 1394 A 24 ILE HG21 A 41 ARG H 1.0 . 4.55 1395 1395 A 78 PHE H A 159 LEU HD21 1.0 . 4.59 1396 1396 A 42 LYS H A 53 LEU H 1.0 . 4.22 1397 1397 A 42 LYS H A 43 GLN H 1.0 . 4.82 1398 1398 A 43 GLN H A 52 LEU HA 1.0 . 5.28 1399 1399 A 43 GLN HGy A 43 GLN H 1.0 . 4.89 1400 1400 A 43 GLN HGx A 43 GLN H 1.0 . 4.89 1401 1401 A 113 LEU H A 112 VAL HGx% 1.0 . 4.47 1402 1402 A 44 VAL H A 43 GLN H 1.0 . 4.52 1403 1403 A 44 VAL H A 45 VAL H 1.0 . 5.37 1404 1404 A 46 ILE H A 51 CYS H 1.0 . 4.64 1405 1405 A 48 GLY H A 47 ASP H 1.0 . 4.87 1406 1406 A 46 ILE H A 47 ASP H 1.0 . 5.50 1407 1407 A 48 GLY H A 49 GLU H 1.0 . 4.07 1408 1408 A 46 ILE H A 48 GLY H 1.0 . 5.08 1409 1409 A 45 VAL HA A 48 GLY H 1.0 . 5.26 1410 1410 A 46 ILE H A 49 GLU H 1.0 . 3.88 1411 1411 A 50 THR H A 51 CYS H 1.0 . 5.13 1412 1412 A 50 THR H A 49 GLU H 1.0 . 4.80 1413 1413 A 45 VAL HA A 50 THR H 1.0 . 4.73 1414 1414 A 52 LEU H A 51 CYS H 1.0 . 5.18 1415 1415 A 52 LEU H A 53 LEU H 1.0 . 5.02 1416 1416 A 3 GLU HA A 52 LEU H 1.0 . 3.69 1417 1417 A 41 ARG HA A 53 LEU H 1.0 . 5.05 1418 1418 A 43 GLN HA A 53 LEU H 1.0 . 4.10 1419 1419 A 41 ARG HA A 54 ASP H 1.0 . 5.05 1420 1420 A 54 ASP H A 6 LEU HG 1.0 . 5.31 1421 1421 A 41 ARG HA A 55 ILE H 1.0 . 4.44 1422 1422 A 55 ILE H A 55 ILE HG21 1.0 . 4.49 1423 1423 A 6 LEU H A 56 LEU H 1.0 . 4.76 1424 1424 A 8 VAL H A 56 LEU H 1.0 . 4.81 1425 1425 A 56 LEU H A 7 VAL HA 1.0 . 4.25 1426 1426 A 56 LEU H A 56 LEU HDy% 1.0 . 4.39 1427 1427 A 56 LEU HDx% A 56 LEU H 1.0 . 4.39 1428 1428 A 57 ASP H A 56 LEU HG 1.0 . 5.05 1429 1429 A 8 VAL H A 58 THR H 1.0 . 4.99 1430 1430 A 59 ALA H A 58 THR H 1.0 . 5.31 1431 1431 A 8 VAL HB A 58 THR H 1.0 . 4.55 1432 1432 A 59 ALA H A 60 GLY H 1.0 . 5.27 1433 1433 A 59 ALA H A 58 THR HG21 1.0 . 4.20 1434 1434 A 60 GLY H A 61 GLN H 1.0 . 4.22 1435 1435 A 61 GLN H A 62 GLU H 1.0 . 4.54 1436 1436 A 59 ALA HB1 A 61 GLN H 1.0 . 3.92 1437 1437 A 64 TYR H A 63 GLU H 1.0 . 4.68 1438 1438 A 63 GLU H A 62 GLU HA 1.0 . 3.57 1439 1439 A 64 TYR H A 65 SER H 1.0 . 4.67 1440 1440 A 98 GLU H A 96 TYR HA 1.0 . 5.09 1441 1441 A 70 GLN H A 69 ASP H 1.0 . 3.39 1442 1442 A 95 GLN H A 94 HIS H 1.0 . 3.94 1443 1443 A 71 TYR H A 72 MET H 1.0 . 3.90 1444 1444 A 71 TYR H A 70 GLN H 1.0 . 3.85 1445 1445 A 97 ARG H A 98 GLU H 1.0 . 3.48 1446 1446 A 73 ARG H A 74 THR H 1.0 . 3.75 1447 1447 A 73 ARG H A 73 ARG HDx 1.0 . 4.89 1448 1448 A 72 MET HGy A 73 ARG H 1.0 . 5.19 1449 1449 A 72 MET H A 74 THR H 1.0 . 4.62 1450 1450 A 74 THR H A 75 GLY H 1.0 . 3.52 1451 1451 A 74 THR H A 75 GLY HAx 1.0 . 4.96 1452 1452 A 73 ARG H A 75 GLY H 1.0 . 4.32 1453 1453 A 75 GLY H A 71 TYR HA 1.0 . 4.99 1454 1454 A 75 GLY H A 73 ARG HA 1.0 . 4.91 1455 1455 A 28 PHE HBy A 22 GLN HE2y 1.0 . 5.41 1456 1456 A 28 PHE HBx A 22 GLN HE2y 1.0 . 5.41 1457 1457 A 75 GLY H A 74 THR HG21 1.0 . 4.15 1458 1458 A 75 GLY H A 76 GLU H 1.0 . 4.69 1459 1459 A 77 GLY H A 76 GLU H 1.0 . 3.58 1460 1460 A 76 GLU H A 6 LEU HA 1.0 . 5.16 1461 1461 A 76 GLU H A 5 LYS HBy 1.0 . 4.59 1462 1462 A 78 PHE H A 77 GLY H 1.0 . 4.85 1463 1463 A 5 LYS H A 77 GLY H 1.0 . 5.16 1464 1464 A 75 GLY H A 77 GLY H 1.0 . 5.24 1465 1465 A 77 GLY H A 75 GLY HAy 1.0 . 5.06 1466 1466 A 163 ILE HD11 A 77 GLY H 1.0 . 4.07 1467 1467 A 78 PHE H A 79 LEU H 1.0 . 5.17 1468 1468 A 80 CYS H A 113 LEU HA 1.0 . 4.21 1469 1469 A 80 CYS H A 79 LEU HBy 1.0 . 4.70 1470 1470 A 113 LEU HDx% A 80 CYS H 1.0 . 5.33 1471 1471 A 81 VAL H A 81 VAL HG21 1.0 . 4.41 1472 1472 A 114 VAL H A 82 PHE H 1.0 . 4.85 1473 1473 A 81 VAL H A 82 PHE H 1.0 . 5.16 1474 1474 A 116 ASN H A 82 PHE H 1.0 . 4.87 1475 1475 A 82 PHE H A 93 ILE HG21 1.0 . 5.20 1476 1476 A 81 VAL HGx% A 82 PHE H 1.0 . 3.99 1477 1477 A 89 SER H A 83 ALA H 1.0 . 5.02 1478 1478 A 14 VAL HB A 83 ALA H 1.0 . 5.10 1479 1479 A 83 ALA H A 14 VAL HG11 1.0 . 5.48 1480 1480 A 116 ASN H A 84 ILE H 1.0 . 4.61 1481 1481 A 84 ILE H A 85 ASN H 1.0 . 4.19 1482 1482 A 84 ILE H A 84 ILE HG1x 1.0 . 4.20 1483 1483 A 84 ILE HG21 A 84 ILE H 1.0 . 3.46 1484 1484 A 85 ASN H A 86 ASN HBy 1.0 . 5.22 1485 1485 A 85 ASN H A 86 ASN HBx 1.0 . 5.22 1486 1486 A 86 ASN H A 84 ILE HA 1.0 . 4.34 1487 1487 A 83 ALA HB1 A 86 ASN H 1.0 . 4.22 1488 1488 A 88 LYS H A 87 THR HG21 1.0 . 5.07 1489 1489 A 88 LYS H A 89 SER H 1.0 . 3.66 1490 1490 A 90 PHE H A 89 SER H 1.0 . 3.94 1491 1491 A 89 SER H A 86 ASN HBy 1.0 . 5.01 1492 1492 A 89 SER H A 86 ASN HBx 1.0 . 5.01 1493 1493 A 90 PHE H A 83 ALA H 1.0 . 5.21 1494 1494 A 90 PHE H A 91 GLU HGx 1.0 . 5.09 1495 1495 A 90 PHE H A 125 VAL HGx% 1.0 . 5.25 1496 1496 A 90 PHE H A 91 GLU H 1.0 . 3.70 1497 1497 A 90 PHE H A 92 ASP H 1.0 . 4.81 1498 1498 A 92 ASP H A 90 PHE HA 1.0 . 5.06 1499 1499 A 93 ILE H A 92 ASP H 1.0 . 4.01 1500 1500 A 93 ILE H A 94 HIS H 1.0 . 4.18 1501 1501 A 93 ILE H A 91 GLU HA 1.0 . 4.86 1502 1502 A 94 HIS H A 92 ASP HA 1.0 . 4.93 1503 1503 A 94 HIS H A 93 ILE HG21 1.0 . 4.21 1504 1504 A 95 GLN H A 94 HIS HD2 1.0 . 4.24 1505 1505 A 95 GLN H A 92 ASP HA 1.0 . 4.18 1506 1506 A 95 GLN H A 96 TYR H 1.0 . 3.41 1507 1507 A 96 TYR H A 97 ARG H 1.0 . 3.57 1508 1508 A 95 GLN H A 97 ARG H 1.0 . 4.73 1509 1509 A 97 ARG H A 95 GLN HA 1.0 . 4.78 1510 1510 A 93 ILE HG21 A 97 ARG H 1.0 . 4.70 1511 1511 A 97 ARG H A 99 GLN H 1.0 . 5.12 1512 1512 A 101 LYS H A 100 ILE H 1.0 . 3.63 1513 1513 A 99 GLN H A 96 TYR HA 1.0 . 4.09 1514 1514 A 99 GLN H A 99 GLN HGy 1.0 . 3.94 1515 1515 A 100 ILE HD11 A 100 ILE H 1.0 . 3.86 1516 1516 A 101 LYS H A 98 GLU HA 1.0 . 4.31 1517 1517 A 148 THR HG21 A 149 ARG H 1.0 . 4.56 1518 1518 A 103 VAL H A 104 LYS H 1.0 . 3.66 1519 1519 A 103 VAL H A 102 ARG H 1.0 . 3.62 1520 1520 A 103 VAL H A 99 GLN HA 1.0 . 4.44 1521 1521 A 103 VAL H A 103 VAL HGx% 1.0 . 3.72 1522 1522 A 154 ASP H A 153 GLU H 1.0 . 3.53 1523 1523 A 105 ASP H A 104 LYS H 1.0 . 3.59 1524 1524 A 103 VAL H A 105 ASP H 1.0 . 4.42 1525 1525 A 105 ASP H A 101 LYS HA 1.0 . 4.49 1526 1526 A 106 SER H A 107 ASP H 1.0 . 4.48 1527 1527 A 104 LYS H A 106 SER H 1.0 . 4.56 1528 1528 A 105 ASP H A 106 SER H 1.0 . 3.47 1529 1529 A 102 ARG HA A 106 SER H 1.0 . 4.83 1530 1530 A 106 SER H A 101 LYS HA 1.0 . 3.91 1531 1531 A 109 VAL H A 108 ASP H 1.0 . 4.08 1532 1532 A 111 MET H A 139 ILE HG21 1.0 . 4.55 1533 1533 A 161 ARG H A 160 VAL HGy% 1.0 . 4.40 1534 1534 A 112 VAL H A 80 CYS H 1.0 . 4.48 1535 1535 A 112 VAL H A 79 LEU HA 1.0 . 4.09 1536 1536 A 113 LEU H A 142 ILE H 1.0 . 5.29 1537 1537 A 113 LEU H A 141 TYR HA 1.0 . 4.72 1538 1538 A 114 VAL H A 81 VAL HA 1.0 . 4.21 1539 1539 A 114 VAL H A 80 CYS HA 1.0 . 5.19 1540 1540 A 114 VAL H A 80 CYS HBy 1.0 . 5.50 1541 1541 A 114 VAL H A 114 VAL HGx% 1.0 . 4.34 1542 1542 A 144 THR H A 115 GLY H 1.0 . 4.85 1543 1543 A 116 ASN H A 115 GLY H 1.0 . 5.09 1544 1544 A 117 LYS H A 116 ASN H 1.0 . 4.76 1545 1545 A 116 ASN H A 83 ALA HA 1.0 . 3.88 1546 1546 A 116 ASN H A 83 ALA HB1 1.0 . 4.77 1547 1547 A 117 LYS H A 118 CYS H 1.0 . 3.74 1548 1548 A 117 LYS H A 146 ALA H 1.0 . 5.36 1549 1549 A 118 CYS H A 146 ALA H 1.0 . 5.02 1550 1550 A 118 CYS H A 120 LEU H 1.0 . 4.91 1551 1551 A 118 CYS H A 116 ASN HA 1.0 . 4.35 1552 1552 A 118 CYS H A 145 SER HA 1.0 . 4.17 1553 1553 A 84 ILE HD11 A 118 CYS H 1.0 . 4.57 1554 1554 A 118 CYS H A 119 ASP H 1.0 . 4.10 1555 1555 A 119 ASP H A 145 SER HA 1.0 . 4.80 1556 1556 A 119 ASP H A 120 LEU H 1.0 . 3.77 1557 1557 A 120 LEU H A 145 SER HBy 1.0 . 5.50 1558 1558 A 120 LEU H A 145 SER HBx 1.0 . 5.50 1559 1559 A 121 ALA H A 120 LEU H 1.0 . 4.77 1560 1560 A 122 ALA H A 121 ALA H 1.0 . 3.83 1561 1561 A 121 ALA H A 122 ALA HA 1.0 . 5.22 1562 1562 A 123 ARG H A 124 THR H 1.0 . 4.67 1563 1563 A 122 ALA H A 123 ARG H 1.0 . 4.22 1564 1564 A 123 ARG HE A 123 ARG H 1.0 . 5.30 1565 1565 A 123 ARG H A 85 ASN HA 1.0 . 5.17 1566 1566 A 123 ARG H A 121 ALA HA 1.0 . 4.37 1567 1567 A 123 ARG H A 123 ARG HDy 1.0 . 5.06 1568 1568 A 123 ARG H A 123 ARG HDx 1.0 . 5.06 1569 1569 A 124 THR HG21 A 123 ARG H 1.0 . 5.23 1570 1570 A 84 ILE HD11 A 123 ARG H 1.0 . 4.39 1571 1571 A 85 ASN H A 124 THR H 1.0 . 4.88 1572 1572 A 125 VAL H A 124 THR H 1.0 . 3.71 1573 1573 A 124 THR H A 85 ASN HBy 1.0 . 5.03 1574 1574 A 125 VAL H A 126 GLU H 1.0 . 4.83 1575 1575 A 125 VAL H A 85 ASN HA 1.0 . 4.39 1576 1576 A 125 VAL H A 124 THR HG21 1.0 . 4.43 1577 1577 A 126 GLU H A 127 SER H 1.0 . 5.35 1578 1578 A 126 GLU H A 129 GLN H 1.0 . 4.74 1579 1579 A 128 ARG H A 127 SER H 1.0 . 4.22 1580 1580 A 123 ARG HE A 127 SER H 1.0 . 5.08 1581 1581 A 127 SER H A 123 ARG HDy 1.0 . 5.40 1582 1582 A 127 SER H A 123 ARG HDx 1.0 . 5.40 1583 1583 A 128 ARG H A 130 ALA H 1.0 . 4.81 1584 1584 A 128 ARG H A 126 GLU HA 1.0 . 4.68 1585 1585 A 128 ARG H A 129 GLN H 1.0 . 3.91 1586 1586 A 129 GLN H A 130 ALA H 1.0 . 3.26 1587 1587 A 130 ALA HB1 A 129 GLN H 1.0 . 4.36 1588 1588 A 132 ASP H A 130 ALA H 1.0 . 5.03 1589 1589 A 132 ASP H A 131 GLN H 1.0 . 3.57 1590 1590 A 130 ALA H A 131 GLN H 1.0 . 3.57 1591 1591 A 129 GLN H A 131 GLN H 1.0 . 4.19 1592 1592 A 133 LEU H A 131 GLN H 1.0 . 4.93 1593 1593 A 133 LEU H A 134 ALA H 1.0 . 3.57 1594 1594 A 133 LEU H A 132 ASP H 1.0 . 3.69 1595 1595 A 136 SER H A 133 LEU H 1.0 . 5.11 1596 1596 A 133 LEU H A 129 GLN HA 1.0 . 4.94 1597 1597 A 133 LEU H A 133 LEU HG 1.0 . 4.34 1598 1598 A 136 SER H A 135 ARG H 1.0 . 3.52 1599 1599 A 133 LEU H A 135 ARG H 1.0 . 5.02 1600 1600 A 136 SER H A 138 GLY H 1.0 . 4.42 1601 1601 A 135 ARG H A 137 TYR H 1.0 . 4.41 1602 1602 A 138 GLY H A 137 TYR H 1.0 . 3.50 1603 1603 A 136 SER H A 137 TYR H 1.0 . 3.69 1604 1604 A 137 TYR H A 139 ILE HG1y 1.0 . 4.96 1605 1605 A 139 ILE H A 138 GLY H 1.0 . 3.62 1606 1606 A 134 ALA HA A 138 GLY H 1.0 . 4.69 1607 1607 A 138 GLY H A 139 ILE HG1y 1.0 . 4.85 1608 1608 A 138 GLY H A 139 ILE HG21 1.0 . 4.83 1609 1609 A 138 GLY H A 139 ILE HD11 1.0 . 5.04 1610 1610 A 139 ILE H A 137 TYR H 1.0 . 4.69 1611 1611 A 139 ILE H A 139 ILE HG1x 1.0 . 3.98 1612 1612 A 139 ILE H A 139 ILE HG21 1.0 . 3.87 1613 1613 A 141 TYR H A 142 ILE HD11 1.0 . 5.01 1614 1614 A 141 TYR H A 142 ILE H 1.0 . 5.29 1615 1615 A 142 ILE H A 115 GLY H 1.0 . 5.17 1616 1616 A 142 ILE H A 142 ILE HG1x 1.0 . 4.64 1617 1617 A 143 GLU H A 142 ILE H 1.0 . 4.94 1618 1618 A 150 GLN H A 148 THR HB 1.0 . 4.48 1619 1619 A 145 SER H A 146 ALA H 1.0 . 4.72 1620 1620 A 145 SER H A 150 GLN H 1.0 . 4.23 1621 1621 A 117 LYS H A 144 THR H 1.0 . 5.00 1622 1622 A 144 THR H A 116 ASN HA 1.0 . 3.89 1623 1623 A 144 THR H A 144 THR HG21 1.0 . 3.52 1624 1624 A 147 LYS H A 146 ALA H 1.0 . 4.06 1625 1625 A 147 LYS H A 148 THR H 1.0 . 4.03 1626 1626 A 148 THR H A 149 ARG HA 1.0 . 4.88 1627 1627 A 151 GLY H A 150 GLN H 1.0 . 4.72 1628 1628 A 151 GLY H A 152 VAL H 1.0 . 4.07 1629 1629 A 144 THR HA A 151 GLY H 1.0 . 5.26 1630 1630 A 151 GLY H A 144 THR HG21 1.0 . 4.81 1631 1631 A 145 SER H A 152 VAL H 1.0 . 5.22 1632 1632 A 150 GLN H A 152 VAL H 1.0 . 5.31 1633 1633 A 152 VAL H A 149 ARG HA 1.0 . 4.90 1634 1634 A 152 VAL H A 152 VAL HG21 1.0 . 3.96 1635 1635 A 152 VAL H A 152 VAL HG11 1.0 . 3.96 1636 1636 A 152 VAL H A 144 THR HG21 1.0 . 4.19 1637 1637 A 151 GLY H A 153 GLU H 1.0 . 5.37 1638 1638 A 152 VAL H A 153 GLU H 1.0 . 3.82 1639 1639 A 153 GLU H A 149 ARG HE 1.0 . 5.42 1640 1640 A 153 GLU H A 152 VAL HG21 1.0 . 4.20 1641 1641 A 153 GLU H A 152 VAL HG11 1.0 . 4.20 1642 1642 A 154 ASP H A 155 ALA H 1.0 . 3.73 1643 1643 A 154 ASP H A 156 PHE H 1.0 . 5.25 1644 1644 A 154 ASP H A 152 VAL H 1.0 . 4.74 1645 1645 A 157 TYR H A 155 ALA H 1.0 . 5.08 1646 1646 A 153 GLU H A 155 ALA H 1.0 . 4.88 1647 1647 A 155 ALA H A 156 PHE H 1.0 . 3.82 1648 1648 A 155 ALA H A 142 ILE HB 1.0 . 5.01 1649 1649 A 156 PHE H A 154 ASP HA 1.0 . 5.07 1650 1650 A 157 TYR H A 158 THR H 1.0 . 3.88 1651 1651 A 157 TYR H A 156 PHE H 1.0 . 3.70 1652 1652 A 159 LEU H A 158 THR H 1.0 . 3.96 1653 1653 A 158 THR H A 155 ALA HA 1.0 . 4.95 1654 1654 A 142 ILE HD11 A 158 THR H 1.0 . 4.43 1655 1655 A 157 TYR H A 159 LEU H 1.0 . 5.19 1656 1656 A 159 LEU H A 161 ARG H 1.0 . 5.04 1657 1657 A 159 LEU H A 160 VAL H 1.0 . 3.89 1658 1658 A 159 LEU H A 155 ALA HA 1.0 . 5.22 1659 1659 A 160 VAL H A 161 ARG H 1.0 . 4.08 1660 1660 A 160 VAL H A 160 VAL HGy% 1.0 . 4.03 1661 1661 A 163 ILE HD11 A 160 VAL H 1.0 . 4.88 1662 1662 A 46 ILE HD11 A 160 VAL H 1.0 . 4.46 1663 1663 A 160 VAL HGx% A 160 VAL H 1.0 . 4.03 1664 1664 A 160 VAL H A 162 GLU H 1.0 . 4.89 1665 1665 A 163 ILE H A 164 ARG H 1.0 . 4.30 1666 1666 A 163 ILE H A 163 ILE HG21 1.0 . 4.14 1667 1667 A 164 ARG H A 165 GLN H 1.0 . 3.99 1668 1668 A 163 ILE H A 165 GLN H 1.0 . 4.84 1669 1669 A 161 ARG HA A 165 GLN H 1.0 . 5.31 1670 1670 A 164 ARG H A 166 HIS H 1.0 . 5.41 1671 1671 A 164 ARG HA A 166 HIS H 1.0 . 4.71 1672 1672 A 92 ASP HA A 95 GLN HE2x 1.0 . 4.64 1673 1673 A 85 ASN HA A 85 ASN HD2x 1.0 . 4.95 1674 1674 A 122 ALA HB1 A 85 ASN HD2x 1.0 . 5.23 1675 1675 A 85 ASN HA A 85 ASN HD2y 1.0 . 4.95 1676 1676 A 122 ALA HB1 A 85 ASN HD2y 1.0 . 5.23 1677 1677 A 86 ASN HA A 86 ASN HD2x 1.0 . 5.36 1678 1678 A 86 ASN HA A 86 ASN HD2y 1.0 . 5.36 1679 1679 A 116 ASN HD2x A 15 GLY HAy 1.0 . 4.72 1680 1680 A 22 GLN HE2x A 28 PHE HBx 1.0 . 5.41 1681 1681 A 21 ILE HD11 A 25 GLN HE2x 1.0 . 4.89 1682 1682 A 24 ILE HG21 A 25 GLN HE2y 1.0 . 4.74 1683 1683 A 92 ASP HA A 95 GLN HE2y 1.0 . 4.64 1684 1684 A 65 SER HA A 99 GLN HE2x 1.0 . 5.04 1685 1685 A 99 GLN HA A 99 GLN HE2x 1.0 . 5.50 1686 1686 A 65 SER HA A 99 GLN HE2y 1.0 . 5.04 1687 1687 A 99 GLN HA A 99 GLN HE2y 1.0 . 5.50 1688 1688 A 72 MET HE1 A 99 GLN HE2y 1.0 . 4.76 1689 1689 A 46 ILE HG21 A 161 ARG HE 1.0 . 4.56 1690 1690 A 14 VAL HG21 A 12 GLY H 1.0 . 5.41 1691 1691 A 5 LYS H A 76 GLU HBy 1.0 . 5.30 1692 1692 A 131 GLN HE2x A 134 ALA HB1 1.0 . 4.78 1693 1693 A 24 ILE HG21 A 25 GLN HE2x 1.0 . 4.74 1694 1694 A 104 LYS HDx A 78 PHE HZ 1.0 . 4.23 1695 1695 A 7 VAL HG21 A 78 PHE HZ 1.0 . 4.20 1696 1696 A 7 VAL HG11 A 78 PHE HZ 1.0 . 4.20 1697 1697 A 100 ILE HG21 A 78 PHE HZ 1.0 . 4.46 1698 1698 A 29 VAL HGy% A 27 HIS HE1 1.0 . 4.70 1699 1699 A 78 PHE HA A 79 LEU H 1.0 . 3.07 1700 1700 A 41 ARG HA A 42 LYS H 1.0 . 3.10 stop_ save_ save_DYANA/DIANA_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_4 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 1 MET C A 2 THR N A 2 THR CA A 2 THR C 1.0 -167.9 -51.8 PHI 2 2 A 2 THR C A 3 GLU N A 3 GLU CA A 3 GLU C 1.0 -158.4 -84.1 PHI 3 3 A 3 GLU C A 4 TYR N A 4 TYR CA A 4 TYR C 1.0 -149.9 -102.1 PHI 4 4 A 4 TYR C A 5 LYS N A 5 LYS CA A 5 LYS C 1.0 -124.1 -79.3 PHI 5 5 A 5 LYS C A 6 LEU N A 6 LEU CA A 6 LEU C 1.0 -139.4 -81.0 PHI 6 6 A 6 LEU C A 7 VAL N A 7 VAL CA A 7 VAL C 1.0 -138.0 -85.3 PHI 7 7 A 7 VAL C A 8 VAL N A 8 VAL CA A 8 VAL C 1.0 -127.6 -71.2 PHI 8 8 A 8 VAL C A 9 VAL N A 9 VAL CA A 9 VAL C 1.0 -172.5 -97.9 PHI 9 9 A 15 GLY C A 16 LYS N A 16 LYS CA A 16 LYS C 1.0 -80.3 -44.9 PHI 10 10 A 16 LYS C A 17 SER N A 17 SER CA A 17 SER C 1.0 -76.6 -47.8 PHI 11 11 A 17 SER C A 18 ALA N A 18 ALA CA A 18 ALA C 1.0 -71.6 -54.4 PHI 12 12 A 18 ALA C A 19 LEU N A 19 LEU CA A 19 LEU C 1.0 -74.9 -55.7 PHI 13 13 A 19 LEU C A 20 THR N A 20 THR CA A 20 THR C 1.0 -71.5 -56.3 PHI 14 14 A 20 THR C A 21 ILE N A 21 ILE CA A 21 ILE C 1.0 -73.3 -54.3 PHI 15 15 A 21 ILE C A 22 GLN N A 22 GLN CA A 22 GLN C 1.0 -76.7 -54.7 PHI 16 16 A 22 GLN C A 23 LEU N A 23 LEU CA A 23 LEU C 1.0 -71.6 -60.5 PHI 17 17 A 31 GLU C A 32 TYR N A 32 TYR CA A 32 TYR C 1.0 -142.1 -58.5 PHI 18 18 A 32 TYR C A 33 ASP N A 33 ASP CA A 33 ASP C 1.0 -137.0 -35.0 PHI 19 19 A 38 ASP C A 39 SER N A 39 SER CA A 39 SER C 1.0 -157.5 -59.1 PHI 20 20 A 39 SER C A 40 TYR N A 40 TYR CA A 40 TYR C 1.0 -157.3 -91.3 PHI 21 21 A 40 TYR C A 41 ARG N A 41 ARG CA A 41 ARG C 1.0 -142.5 -102.5 PHI 22 22 A 41 ARG C A 42 LYS N A 42 LYS CA A 42 LYS C 1.0 -173.8 -111.2 PHI 23 23 A 42 LYS C A 43 GLN N A 43 GLN CA A 43 GLN C 1.0 -146.4 -65.0 PHI 24 24 A 43 GLN C A 44 VAL N A 44 VAL CA A 44 VAL C 1.0 -170.9 -108.9 PHI 25 25 A 44 VAL C A 45 VAL N A 45 VAL CA A 45 VAL C 1.0 -122.8 -70.9 PHI 26 26 A 45 VAL C A 46 ILE N A 46 ILE CA A 46 ILE C 1.0 -156.7 -56.3 PHI 27 27 A 47 ASP C A 48 GLY N A 48 GLY CA A 48 GLY C 1.0 59.3 106.8 PHI 28 28 A 48 GLY C A 49 GLU N A 49 GLU CA A 49 GLU C 1.0 -143.4 -63.5 PHI 29 29 A 49 GLU C A 50 THR N A 50 THR CA A 50 THR C 1.0 -141.1 -44.1 PHI 30 30 A 50 THR C A 51 CYS N A 51 CYS CA A 51 CYS C 1.0 -173.6 -87.4 PHI 31 31 A 51 CYS C A 52 LEU N A 52 LEU CA A 52 LEU C 1.0 -142.7 -83.5 PHI 32 32 A 52 LEU C A 53 LEU N A 53 LEU CA A 53 LEU C 1.0 -150.7 -67.1 PHI 33 33 A 53 LEU C A 54 ASP N A 54 ASP CA A 54 ASP C 1.0 -149.4 -68.6 PHI 34 34 A 54 ASP C A 55 ILE N A 55 ILE CA A 55 ILE C 1.0 -139.8 -82.2 PHI 35 35 A 55 ILE C A 56 LEU N A 56 LEU CA A 56 LEU C 1.0 -140.2 -75.8 PHI 36 36 A 57 ASP C A 58 THR N A 58 THR CA A 58 THR C 1.0 -190.4 -80.3 PHI 37 37 A 58 THR C A 59 ALA N A 59 ALA CA A 59 ALA C 1.0 -161.9 -51.5 PHI 38 38 A 65 SER C A 66 ALA N A 66 ALA CA A 66 ALA C 1.0 -73.4 -51.6 PHI 39 39 A 66 ALA C A 67 MET N A 67 MET CA A 67 MET C 1.0 -78.8 -48.8 PHI 40 40 A 67 MET C A 68 ARG N A 68 ARG CA A 68 ARG C 1.0 -81.3 -42.8 PHI 41 41 A 68 ARG C A 69 ASP N A 69 ASP CA A 69 ASP C 1.0 -78.3 -45.7 PHI 42 42 A 69 ASP C A 70 GLN N A 70 GLN CA A 70 GLN C 1.0 -77.4 -56.6 PHI 43 43 A 70 GLN C A 71 TYR N A 71 TYR CA A 71 TYR C 1.0 -79.4 -56.1 PHI 44 44 A 71 TYR C A 72 MET N A 72 MET CA A 72 MET C 1.0 -68.7 -48.7 PHI 45 45 A 72 MET C A 73 ARG N A 73 ARG CA A 73 ARG C 1.0 -76.1 -55.7 PHI 46 46 A 73 ARG C A 74 THR N A 74 THR CA A 74 THR C 1.0 -114.7 -67.7 PHI 47 47 A 77 GLY C A 78 PHE N A 78 PHE CA A 78 PHE C 1.0 -171.2 -86.8 PHI 48 48 A 78 PHE C A 79 LEU N A 79 LEU CA A 79 LEU C 1.0 -123.1 -79.9 PHI 49 49 A 79 LEU C A 80 CYS N A 80 CYS CA A 80 CYS C 1.0 -125.3 -92.0 PHI 50 50 A 80 CYS C A 81 VAL N A 81 VAL CA A 81 VAL C 1.0 -129.4 -100.2 PHI 51 51 A 81 VAL C A 82 PHE N A 82 PHE CA A 82 PHE C 1.0 -179.6 -87.7 PHI 52 52 A 82 PHE C A 83 ALA N A 83 ALA CA A 83 ALA C 1.0 -151.4 -91.3 PHI 53 53 A 84 ILE C A 85 ASN N A 85 ASN CA A 85 ASN C 1.0 -126.8 -62.8 PHI 54 54 A 85 ASN C A 86 ASN N A 86 ASN CA A 86 ASN C 1.0 -133.3 -45.5 PHI 55 55 A 86 ASN C A 87 THR N A 87 THR CA A 87 THR C 1.0 -67.4 -44.6 PHI 56 56 A 87 THR C A 88 LYS N A 88 LYS CA A 88 LYS C 1.0 -74.2 -47.8 PHI 57 57 A 88 LYS C A 89 SER N A 89 SER CA A 89 SER C 1.0 -82.7 -54.3 PHI 58 58 A 89 SER C A 90 PHE N A 90 PHE CA A 90 PHE C 1.0 -75.6 -57.2 PHI 59 59 A 90 PHE C A 91 GLU N A 91 GLU CA A 91 GLU C 1.0 -74.8 -47.6 PHI 60 60 A 91 GLU C A 92 ASP N A 92 ASP CA A 92 ASP C 1.0 -71.2 -54.8 PHI 61 61 A 92 ASP C A 93 ILE N A 93 ILE CA A 93 ILE C 1.0 -76.6 -53.0 PHI 62 62 A 93 ILE C A 94 HIS N A 94 HIS CA A 94 HIS C 1.0 -78.0 -42.3 PHI 63 63 A 94 HIS C A 95 GLN N A 95 GLN CA A 95 GLN C 1.0 -68.9 -54.1 PHI 64 64 A 95 GLN C A 96 TYR N A 96 TYR CA A 96 TYR C 1.0 -78.5 -54.1 PHI 65 65 A 96 TYR C A 97 ARG N A 97 ARG CA A 97 ARG C 1.0 -69.1 -51.5 PHI 66 66 A 97 ARG C A 98 GLU N A 98 GLU CA A 98 GLU C 1.0 -67.5 -58.3 PHI 67 67 A 98 GLU C A 99 GLN N A 99 GLN CA A 99 GLN C 1.0 -81.3 -55.9 PHI 68 68 A 99 GLN C A 100 ILE N A 100 ILE CA A 100 ILE C 1.0 -71.5 -58.2 PHI 69 69 A 100 ILE C A 101 LYS N A 101 LYS CA A 101 LYS C 1.0 -72.3 -51.7 PHI 70 70 A 101 LYS C A 102 ARG N A 102 ARG CA A 102 ARG C 1.0 -69.9 -58.1 PHI 71 71 A 102 ARG C A 103 VAL N A 103 VAL CA A 103 VAL C 1.0 -78.4 -56.0 PHI 72 72 A 103 VAL C A 104 LYS N A 104 LYS CA A 104 LYS C 1.0 -120.1 -64.3 PHI 73 73 A 107 ASP C A 108 ASP N A 108 ASP CA A 108 ASP C 1.0 -121.3 -70.8 PHI 74 74 A 108 ASP C A 109 VAL N A 109 VAL CA A 109 VAL C 1.0 -162.0 -52.0 PHI 75 75 A 110 PRO C A 111 MET N A 111 MET CA A 111 MET C 1.0 -161.2 -106.9 PHI 76 76 A 111 MET C A 112 VAL N A 112 VAL CA A 112 VAL C 1.0 -151.5 -119.1 PHI 77 77 A 112 VAL C A 113 LEU N A 113 LEU CA A 113 LEU C 1.0 -142.0 -73.3 PHI 78 78 A 113 LEU C A 114 VAL N A 114 VAL CA A 114 VAL C 1.0 -149.8 -90.3 PHI 79 79 A 114 VAL C A 115 GLY N A 115 GLY CA A 115 GLY C 1.0 -191.7 -58.2 PHI 80 80 A 124 THR C A 125 VAL N A 125 VAL CA A 125 VAL C 1.0 -135.0 -55.0 PHI 81 81 A 125 VAL C A 126 GLU N A 126 GLU CA A 126 GLU C 1.0 -129.4 -45.4 PHI 82 82 A 126 GLU C A 127 SER N A 127 SER CA A 127 SER C 1.0 -70.5 -49.7 PHI 83 83 A 127 SER C A 128 ARG N A 128 ARG CA A 128 ARG C 1.0 -66.9 -51.0 PHI 84 84 A 128 ARG C A 129 GLN N A 129 GLN CA A 129 GLN C 1.0 -73.9 -59.1 PHI 85 85 A 129 GLN C A 130 ALA N A 130 ALA CA A 130 ALA C 1.0 -75.4 -56.2 PHI 86 86 A 130 ALA C A 131 GLN N A 131 GLN CA A 131 GLN C 1.0 -76.3 -55.1 PHI 87 87 A 131 GLN C A 132 ASP N A 132 ASP CA A 132 ASP C 1.0 -76.5 -56.3 PHI 88 88 A 132 ASP C A 133 LEU N A 133 LEU CA A 133 LEU C 1.0 -76.2 -58.6 PHI 89 89 A 133 LEU C A 134 ALA N A 134 ALA CA A 134 ALA C 1.0 -73.0 -50.2 PHI 90 90 A 134 ALA C A 135 ARG N A 135 ARG CA A 135 ARG C 1.0 -78.1 -56.5 PHI 91 91 A 135 ARG C A 136 SER N A 136 SER CA A 136 SER C 1.0 -76.1 -57.9 PHI 92 92 A 138 GLY C A 139 ILE N A 139 ILE CA A 139 ILE C 1.0 -158.2 -78.6 PHI 93 93 A 140 PRO C A 141 TYR N A 141 TYR CA A 141 TYR C 1.0 -143.2 -91.6 PHI 94 94 A 141 TYR C A 142 ILE N A 142 ILE CA A 142 ILE C 1.0 -150.5 -105.9 PHI 95 95 A 142 ILE C A 143 GLU N A 143 GLU CA A 143 GLU C 1.0 -137.3 -62.9 PHI 96 96 A 143 GLU C A 144 THR N A 144 THR CA A 144 THR C 1.0 -162.4 -96.1 PHI 97 97 A 144 THR C A 145 SER N A 145 SER CA A 145 SER C 1.0 -149.9 -52.7 PHI 98 98 A 145 SER C A 146 ALA N A 146 ALA CA A 146 ALA C 1.0 -80.5 -49.8 PHI 99 99 A 146 ALA C A 147 LYS N A 147 LYS CA A 147 LYS C 1.0 -107.7 -38.2 PHI 100 100 A 147 LYS C A 148 THR N A 148 THR CA A 148 THR C 1.0 -130.6 -39.5 PHI 101 101 A 149 ARG C A 150 GLN N A 150 GLN CA A 150 GLN C 1.0 -122.4 -39.1 PHI 102 102 A 151 GLY C A 152 VAL N A 152 VAL CA A 152 VAL C 1.0 -71.6 -42.4 PHI 103 103 A 152 VAL C A 153 GLU N A 153 GLU CA A 153 GLU C 1.0 -69.4 -51.8 PHI 104 104 A 153 GLU C A 154 ASP N A 154 ASP CA A 154 ASP C 1.0 -81.9 -53.1 PHI 105 105 A 154 ASP C A 155 ALA N A 155 ALA CA A 155 ALA C 1.0 -76.1 -50.3 PHI 106 106 A 155 ALA C A 156 PHE N A 156 PHE CA A 156 PHE C 1.0 -67.8 -57.4 PHI 107 107 A 156 PHE C A 157 TYR N A 157 TYR CA A 157 TYR C 1.0 -74.2 -53.6 PHI 108 108 A 157 TYR C A 158 THR N A 158 THR CA A 158 THR C 1.0 -68.8 -56.5 PHI 109 109 A 158 THR C A 159 LEU N A 159 LEU CA A 159 LEU C 1.0 -70.7 -55.7 PHI 110 110 A 159 LEU C A 160 VAL N A 160 VAL CA A 160 VAL C 1.0 -69.0 -55.8 PHI 111 111 A 160 VAL C A 161 ARG N A 161 ARG CA A 161 ARG C 1.0 -71.3 -48.8 PHI 112 112 A 161 ARG C A 162 GLU N A 162 GLU CA A 162 GLU C 1.0 -70.6 -57.8 PHI 113 113 A 162 GLU C A 163 ILE N A 163 ILE CA A 163 ILE C 1.0 -74.5 -56.5 PHI 114 114 A 163 ILE C A 164 ARG N A 164 ARG CA A 164 ARG C 1.0 -79.5 -50.7 PHI 115 115 A 2 THR N A 2 THR CA A 2 THR C A 3 GLU N 1.0 90.7 144.6 PSI 116 116 A 3 GLU N A 3 GLU CA A 3 GLU C A 4 TYR N 1.0 112.0 161.2 PSI 117 117 A 4 TYR N A 4 TYR CA A 4 TYR C A 5 LYS N 1.0 93.2 155.8 PSI 118 118 A 5 LYS N A 5 LYS CA A 5 LYS C A 6 LEU N 1.0 97.2 138.5 PSI 119 119 A 6 LEU N A 6 LEU CA A 6 LEU C A 7 VAL N 1.0 100.3 138.3 PSI 120 120 A 7 VAL N A 7 VAL CA A 7 VAL C A 8 VAL N 1.0 107.3 135.3 PSI 121 121 A 8 VAL N A 8 VAL CA A 8 VAL C A 9 VAL N 1.0 113.4 152.0 PSI 122 122 A 9 VAL N A 9 VAL CA A 9 VAL C A 10 GLY N 1.0 137.8 183.1 PSI 123 123 A 16 LYS N A 16 LYS CA A 16 LYS C A 17 SER N 1.0 -53.4 -19.4 PSI 124 124 A 17 SER N A 17 SER CA A 17 SER C A 18 ALA N 1.0 -63.3 -20.9 PSI 125 125 A 18 ALA N A 18 ALA CA A 18 ALA C A 19 LEU N 1.0 -58.4 -23.0 PSI 126 126 A 19 LEU N A 19 LEU CA A 19 LEU C A 20 THR N 1.0 -50.3 -26.2 PSI 127 127 A 20 THR N A 20 THR CA A 20 THR C A 21 ILE N 1.0 -58.8 -24.8 PSI 128 128 A 21 ILE N A 21 ILE CA A 21 ILE C A 22 GLN N 1.0 -52.5 -30.9 PSI 129 129 A 22 GLN N A 22 GLN CA A 22 GLN C A 23 LEU N 1.0 -52.6 -15.9 PSI 130 130 A 23 LEU N A 23 LEU CA A 23 LEU C A 24 ILE N 1.0 -66.3 -2.9 PSI 131 131 A 32 TYR N A 32 TYR CA A 32 TYR C A 33 ASP N 1.0 94.7 172.3 PSI 132 132 A 33 ASP N A 33 ASP CA A 33 ASP C A 34 PRO N 1.0 90.1 162.4 PSI 133 133 A 39 SER N A 39 SER CA A 39 SER C A 40 TYR N 1.0 99.3 183.4 PSI 134 134 A 40 TYR N A 40 TYR CA A 40 TYR C A 41 ARG N 1.0 119.4 169.3 PSI 135 135 A 41 ARG N A 41 ARG CA A 41 ARG C A 42 LYS N 1.0 111.5 164.9 PSI 136 136 A 42 LYS N A 42 LYS CA A 42 LYS C A 43 GLN N 1.0 103.0 151.0 PSI 137 137 A 43 GLN N A 43 GLN CA A 43 GLN C A 44 VAL N 1.0 107.9 145.5 PSI 138 138 A 44 VAL N A 44 VAL CA A 44 VAL C A 45 VAL N 1.0 133.9 180.9 PSI 139 139 A 45 VAL N A 45 VAL CA A 45 VAL C A 46 ILE N 1.0 105.9 145.9 PSI 140 140 A 46 ILE N A 46 ILE CA A 46 ILE C A 47 ASP N 1.0 101.3 137.7 PSI 141 141 A 48 GLY N A 48 GLY CA A 48 GLY C A 49 GLU N 1.0 -37.5 31.6 PSI 142 142 A 49 GLU N A 49 GLU CA A 49 GLU C A 50 THR N 1.0 88.8 150.0 PSI 143 143 A 50 THR N A 50 THR CA A 50 THR C A 51 CYS N 1.0 99.8 154.6 PSI 144 144 A 51 CYS N A 51 CYS CA A 51 CYS C A 52 LEU N 1.0 130.3 182.9 PSI 145 145 A 52 LEU N A 52 LEU CA A 52 LEU C A 53 LEU N 1.0 106.0 155.2 PSI 146 146 A 53 LEU N A 53 LEU CA A 53 LEU C A 54 ASP N 1.0 69.9 163.5 PSI 147 147 A 54 ASP N A 54 ASP CA A 54 ASP C A 55 ILE N 1.0 95.8 156.3 PSI 148 148 A 55 ILE N A 55 ILE CA A 55 ILE C A 56 LEU N 1.0 107.4 129.3 PSI 149 149 A 56 LEU N A 56 LEU CA A 56 LEU C A 57 ASP N 1.0 94.7 141.3 PSI 150 150 A 58 THR N A 58 THR CA A 58 THR C A 59 ALA N 1.0 134.0 181.2 PSI 151 151 A 59 ALA N A 59 ALA CA A 59 ALA C A 60 GLY N 1.0 101.8 157.4 PSI 152 152 A 66 ALA N A 66 ALA CA A 66 ALA C A 67 MET N 1.0 -61.0 -2.6 PSI 153 153 A 67 MET N A 67 MET CA A 67 MET C A 68 ARG N 1.0 -52.8 -27.4 PSI 154 154 A 68 ARG N A 68 ARG CA A 68 ARG C A 69 ASP N 1.0 -58.2 -29.4 PSI 155 155 A 69 ASP N A 69 ASP CA A 69 ASP C A 70 GLN N 1.0 -53.7 -26.7 PSI 156 156 A 70 GLN N A 70 GLN CA A 70 GLN C A 71 TYR N 1.0 -63.3 -27.2 PSI 157 157 A 71 TYR N A 71 TYR CA A 71 TYR C A 72 MET N 1.0 -55.5 -24.5 PSI 158 158 A 72 MET N A 72 MET CA A 72 MET C A 73 ARG N 1.0 -53.8 -33.8 PSI 159 159 A 73 ARG N A 73 ARG CA A 73 ARG C A 74 THR N 1.0 -51.3 -15.2 PSI 160 160 A 74 THR N A 74 THR CA A 74 THR C A 75 GLY N 1.0 -41.6 14.0 PSI 161 161 A 78 PHE N A 78 PHE CA A 78 PHE C A 79 LEU N 1.0 107.7 155.3 PSI 162 162 A 79 LEU N A 79 LEU CA A 79 LEU C A 80 CYS N 1.0 109.2 131.6 PSI 163 163 A 80 CYS N A 80 CYS CA A 80 CYS C A 81 VAL N 1.0 101.9 136.3 PSI 164 164 A 81 VAL N A 81 VAL CA A 81 VAL C A 82 PHE N 1.0 105.8 140.8 PSI 165 165 A 82 PHE N A 82 PHE CA A 82 PHE C A 83 ALA N 1.0 102.8 193.9 PSI 166 166 A 83 ALA N A 83 ALA CA A 83 ALA C A 84 ILE N 1.0 128.8 184.4 PSI 167 167 A 85 ASN N A 85 ASN CA A 85 ASN C A 86 ASN N 1.0 -30.4 35.2 PSI 168 168 A 86 ASN N A 86 ASN CA A 86 ASN C A 87 THR N 1.0 71.9 170.2 PSI 169 169 A 87 THR N A 87 THR CA A 87 THR C A 88 LYS N 1.0 -63.8 -17.7 PSI 170 170 A 88 LYS N A 88 LYS CA A 88 LYS C A 89 SER N 1.0 -55.8 -22.0 PSI 171 171 A 89 SER N A 89 SER CA A 89 SER C A 90 PHE N 1.0 -52.7 -26.3 PSI 172 172 A 90 PHE N A 90 PHE CA A 90 PHE C A 91 GLU N 1.0 -59.2 -23.2 PSI 173 173 A 91 GLU N A 91 GLU CA A 91 GLU C A 92 ASP N 1.0 -63.2 -19.3 PSI 174 174 A 92 ASP N A 92 ASP CA A 92 ASP C A 93 ILE N 1.0 -47.3 -36.3 PSI 175 175 A 93 ILE N A 93 ILE CA A 93 ILE C A 94 HIS N 1.0 -52.7 -25.2 PSI 176 176 A 94 HIS N A 94 HIS CA A 94 HIS C A 95 GLN N 1.0 -50.3 -31.3 PSI 177 177 A 95 GLN N A 95 GLN CA A 95 GLN C A 96 TYR N 1.0 -55.7 -32.9 PSI 178 178 A 96 TYR N A 96 TYR CA A 96 TYR C A 97 ARG N 1.0 -55.0 -31.1 PSI 179 179 A 97 ARG N A 97 ARG CA A 97 ARG C A 98 GLU N 1.0 -55.0 -35.4 PSI 180 180 A 98 GLU N A 98 GLU CA A 98 GLU C A 99 GLN N 1.0 -43.6 -32.2 PSI 181 181 A 99 GLN N A 99 GLN CA A 99 GLN C A 100 ILE N 1.0 -52.7 -22.8 PSI 182 182 A 100 ILE N A 100 ILE CA A 100 ILE C A 101 LYS N 1.0 -53.7 -32.3 PSI 183 183 A 101 LYS N A 101 LYS CA A 101 LYS C A 102 ARG N 1.0 -51.3 -29.2 PSI 184 184 A 102 ARG N A 102 ARG CA A 102 ARG C A 103 VAL N 1.0 -53.8 -35.2 PSI 185 185 A 103 VAL N A 103 VAL CA A 103 VAL C A 104 LYS N 1.0 -59.5 -5.9 PSI 186 186 A 104 LYS N A 104 LYS CA A 104 LYS C A 105 ASP N 1.0 -22.9 12.7 PSI 187 187 A 108 ASP N A 108 ASP CA A 108 ASP C A 109 VAL N 1.0 83.7 171.7 PSI 188 188 A 109 VAL N A 109 VAL CA A 109 VAL C A 110 PRO N 1.0 101.6 163.8 PSI 189 189 A 110 PRO N A 110 PRO CA A 110 PRO C A 111 MET N 1.0 106.1 157.7 PSI 190 190 A 111 MET N A 111 MET CA A 111 MET C A 112 VAL N 1.0 118.4 178.4 PSI 191 191 A 112 VAL N A 112 VAL CA A 112 VAL C A 113 LEU N 1.0 121.0 162.6 PSI 192 192 A 113 LEU N A 113 LEU CA A 113 LEU C A 114 VAL N 1.0 102.0 135.2 PSI 193 193 A 114 VAL N A 114 VAL CA A 114 VAL C A 115 GLY N 1.0 110.0 160.6 PSI 194 194 A 115 GLY N A 115 GLY CA A 115 GLY C A 116 ASN N 1.0 77.3 210.7 PSI 195 195 A 125 VAL N A 125 VAL CA A 125 VAL C A 126 GLU N 1.0 93.5 171.9 PSI 196 196 A 126 GLU N A 126 GLU CA A 126 GLU C A 127 SER N 1.0 69.9 175.6 PSI 197 197 A 127 SER N A 127 SER CA A 127 SER C A 128 ARG N 1.0 -61.9 -8.3 PSI 198 198 A 128 ARG N A 128 ARG CA A 128 ARG C A 129 GLN N 1.0 -55.5 -32.5 PSI 199 199 A 129 GLN N A 129 GLN CA A 129 GLN C A 130 ALA N 1.0 -50.0 -29.0 PSI 200 200 A 130 ALA N A 130 ALA CA A 130 ALA C A 131 GLN N 1.0 -48.9 -27.3 PSI 201 201 A 131 GLN N A 131 GLN CA A 131 GLN C A 132 ASP N 1.0 -60.0 -21.2 PSI 202 202 A 132 ASP N A 132 ASP CA A 132 ASP C A 133 LEU N 1.0 -55.3 -24.6 PSI 203 203 A 133 LEU N A 133 LEU CA A 133 LEU C A 134 ALA N 1.0 -46.4 -36.0 PSI 204 204 A 134 ALA N A 134 ALA CA A 134 ALA C A 135 ARG N 1.0 -52.5 -37.5 PSI 205 205 A 135 ARG N A 135 ARG CA A 135 ARG C A 136 SER N 1.0 -55.5 -17.1 PSI 206 206 A 136 SER N A 136 SER CA A 136 SER C A 137 TYR N 1.0 -46.1 -8.0 PSI 207 207 A 139 ILE N A 139 ILE CA A 139 ILE C A 140 PRO N 1.0 87.3 200.8 PSI 208 208 A 140 PRO N A 140 PRO CA A 140 PRO C A 141 TYR N 1.0 99.2 162.4 PSI 209 209 A 141 TYR N A 141 TYR CA A 141 TYR C A 142 ILE N 1.0 95.5 151.1 PSI 210 210 A 142 ILE N A 142 ILE CA A 142 ILE C A 143 GLU N 1.0 115.5 163.5 PSI 211 211 A 143 GLU N A 143 GLU CA A 143 GLU C A 144 THR N 1.0 99.3 159.4 PSI 212 212 A 144 THR N A 144 THR CA A 144 THR C A 145 SER N 1.0 124.8 190.3 PSI 213 213 A 145 SER N A 145 SER CA A 145 SER C A 146 ALA N 1.0 101.7 151.0 PSI 214 214 A 146 ALA N A 146 ALA CA A 146 ALA C A 147 LYS N 1.0 -52.4 9.2 PSI 215 215 A 147 LYS N A 147 LYS CA A 147 LYS C A 148 THR N 1.0 -61.1 -13.6 PSI 216 216 A 148 THR N A 148 THR CA A 148 THR C A 149 ARG N 1.0 -55.3 9.6 PSI 217 217 A 150 GLN N A 150 GLN CA A 150 GLN C A 151 GLY N 1.0 106.1 143.1 PSI 218 218 A 152 VAL N A 152 VAL CA A 152 VAL C A 153 GLU N 1.0 -58.9 -37.6 PSI 219 219 A 153 GLU N A 153 GLU CA A 153 GLU C A 154 ASP N 1.0 -55.7 -30.2 PSI 220 220 A 154 ASP N A 154 ASP CA A 154 ASP C A 155 ALA N 1.0 -58.7 -13.6 PSI 221 221 A 155 ALA N A 155 ALA CA A 155 ALA C A 156 PHE N 1.0 -51.6 -35.5 PSI 222 222 A 156 PHE N A 156 PHE CA A 156 PHE C A 157 TYR N 1.0 -51.7 -30.1 PSI 223 223 A 157 TYR N A 157 TYR CA A 157 TYR C A 158 THR N 1.0 -52.5 -28.1 PSI 224 224 A 158 THR N A 158 THR CA A 158 THR C A 159 LEU N 1.0 -48.8 -35.4 PSI 225 225 A 159 LEU N A 159 LEU CA A 159 LEU C A 160 VAL N 1.0 -46.6 -32.2 PSI 226 226 A 160 VAL N A 160 VAL CA A 160 VAL C A 161 ARG N 1.0 -52.2 -37.4 PSI 227 227 A 161 ARG N A 161 ARG CA A 161 ARG C A 162 GLU N 1.0 -54.0 -28.1 PSI 228 228 A 162 GLU N A 162 GLU CA A 162 GLU C A 163 ILE N 1.0 -50.3 -29.3 PSI 229 229 A 163 ILE N A 163 ILE CA A 163 ILE C A 164 ARG N 1.0 -52.5 -35.5 PSI 230 230 A 164 ARG N A 164 ARG CA A 164 ARG C A 165 GLN N 1.0 -52.6 -1.1 PSI stop_ save_