data_nef_c19298_2m9k save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 2m9k stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 26 MET start . . 2 A 27 GLU middle . . 3 A 28 GLU middle . . 4 A 29 GLU middle . . 5 A 30 VAL middle . . 6 A 31 ARG middle . . 7 A 32 THR middle . . 8 A 33 LEU middle . . 9 A 34 PHE middle . . 10 A 35 VAL middle . . 11 A 36 SER middle . . 12 A 37 GLY middle . false 13 A 38 LEU middle . . 14 A 39 PRO middle . false 15 A 40 VAL middle . . 16 A 41 ASP middle . . 17 A 42 ILE middle . . 18 A 43 LYS middle . . 19 A 44 PRO middle . false 20 A 45 ARG middle . . 21 A 46 GLU middle . . 22 A 47 LEU middle . . 23 A 48 TYR middle . . 24 A 49 LEU middle . . 25 A 50 LEU middle . . 26 A 51 PHE middle . . 27 A 52 ARG middle . . 28 A 53 PRO middle . false 29 A 54 PHE middle . . 30 A 55 LYS middle . . 31 A 56 GLY middle . false 32 A 57 TYR middle . . 33 A 58 GLU middle . . 34 A 59 GLY middle . false 35 A 60 SER middle . . 36 A 61 LEU middle . . 37 A 62 ILE middle . . 38 A 63 LYS middle . . 39 A 64 LEU middle . . 40 A 65 THR middle . . 41 A 66 ALA middle . . 42 A 67 ARG middle . . 43 A 68 GLN middle . . 44 A 69 PRO middle . false 45 A 70 VAL middle . . 46 A 71 GLY middle . false 47 A 72 PHE middle . . 48 A 73 VAL middle . . 49 A 74 ILE middle . . 50 A 75 PHE middle . . 51 A 76 ASP middle . . 52 A 77 SER middle . . 53 A 78 ARG middle . . 54 A 79 ALA middle . . 55 A 80 GLY middle . false 56 A 81 ALA middle . . 57 A 82 GLU middle . . 58 A 83 ALA middle . . 59 A 84 ALA middle . . 60 A 85 LYS middle . . 61 A 86 ASN middle . . 62 A 87 ALA middle . . 63 A 88 LEU middle . . 64 A 89 ASN middle . . 65 A 90 GLY middle . false 66 A 91 ILE middle . . 67 A 92 ARG middle . . 68 A 93 PHE middle . . 69 A 94 ASP middle . . 70 A 95 PRO middle . false 71 A 96 GLU middle . . 72 A 97 ASN middle . . 73 A 98 PRO middle . false 74 A 99 GLN middle . . 75 A 100 THR middle . . 76 A 101 LEU middle . . 77 A 102 ARG middle . . 78 A 103 LEU middle . . 79 A 104 GLU middle . . 80 A 105 PHE middle . . 81 A 106 ALA middle . . 82 A 107 LYS middle . . 83 A 108 ALA middle . . 84 A 109 ASN middle . . 85 A 110 THR middle . . 86 A 111 LYS middle . . 87 A 112 MET middle . . 88 A 113 ALA middle . . 89 A 114 LYS middle . . 90 A 115 SER middle . . 91 A 116 LYS middle . . 92 A 117 LEU middle . . 93 A 118 GLU end . . 94 B 26 MET start . . 95 B 27 GLU middle . . 96 B 28 GLU middle . . 97 B 29 GLU middle . . 98 B 30 VAL middle . . 99 B 31 ARG middle . . 100 B 32 THR middle . . 101 B 33 LEU middle . . 102 B 34 PHE middle . . 103 B 35 VAL middle . . 104 B 36 SER middle . . 105 B 37 GLY middle . false 106 B 38 LEU middle . . 107 B 39 PRO middle . false 108 B 40 VAL middle . . 109 B 41 ASP middle . . 110 B 42 ILE middle . . 111 B 43 LYS middle . . 112 B 44 PRO middle . false 113 B 45 ARG middle . . 114 B 46 GLU middle . . 115 B 47 LEU middle . . 116 B 48 TYR middle . . 117 B 49 LEU middle . . 118 B 50 LEU middle . . 119 B 51 PHE middle . . 120 B 52 ARG middle . . 121 B 53 PRO middle . false 122 B 54 PHE middle . . 123 B 55 LYS middle . . 124 B 56 GLY middle . false 125 B 57 TYR middle . . 126 B 58 GLU middle . . 127 B 59 GLY middle . false 128 B 60 SER middle . . 129 B 61 LEU middle . . 130 B 62 ILE middle . . 131 B 63 LYS middle . . 132 B 64 LEU middle . . 133 B 65 THR middle . . 134 B 66 ALA middle . . 135 B 67 ARG middle . . 136 B 68 GLN middle . . 137 B 69 PRO middle . false 138 B 70 VAL middle . . 139 B 71 GLY middle . false 140 B 72 PHE middle . . 141 B 73 VAL middle . . 142 B 74 ILE middle . . 143 B 75 PHE middle . . 144 B 76 ASP middle . . 145 B 77 SER middle . . 146 B 78 ARG middle . . 147 B 79 ALA middle . . 148 B 80 GLY middle . false 149 B 81 ALA middle . . 150 B 82 GLU middle . . 151 B 83 ALA middle . . 152 B 84 ALA middle . . 153 B 85 LYS middle . . 154 B 86 ASN middle . . 155 B 87 ALA middle . . 156 B 88 LEU middle . . 157 B 89 ASN middle . . 158 B 90 GLY middle . false 159 B 91 ILE middle . . 160 B 92 ARG middle . . 161 B 93 PHE middle . . 162 B 94 ASP middle . . 163 B 95 PRO middle . false 164 B 96 GLU middle . . 165 B 97 ASN middle . . 166 B 98 PRO middle . false 167 B 99 GLN middle . . 168 B 100 THR middle . . 169 B 101 LEU middle . . 170 B 102 ARG middle . . 171 B 103 LEU middle . . 172 B 104 GLU middle . . 173 B 105 PHE middle . . 174 B 106 ALA middle . . 175 B 107 LYS middle . . 176 B 108 ALA middle . . 177 B 109 ASN middle . . 178 B 110 THR middle . . 179 B 111 LYS middle . . 180 B 112 MET middle . . 181 B 113 ALA middle . . 182 B 114 LYS middle . . 183 B 115 SER middle . . 184 B 116 LYS middle . . 185 B 117 LEU middle . . 186 B 118 GLU end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 27 GLU HA H 1 4.366 0.01 A 27 GLU C C 13 176.23 0.01 A 27 GLU CA C 13 56.24 0.01 A 27 GLU CB C 13 30.72 0.01 A 28 GLU H H 1 8.521 0.01 A 28 GLU HA H 1 4.262 0.01 A 28 GLU C C 13 175.86 0.01 A 28 GLU CA C 13 56.36 0.01 A 28 GLU CB C 13 30.51 0.01 A 28 GLU N N 15 122.50 0.01 A 29 GLU H H 1 8.521 0.01 A 29 GLU HA H 1 4.231 0.01 A 29 GLU C C 13 176.74 0.01 A 29 GLU CA C 13 56.36 0.01 A 29 GLU CB C 13 30.84 0.01 A 29 GLU N N 15 123.29 0.01 A 30 VAL H H 1 8.715 0.01 A 30 VAL HA H 1 3.807 0.01 A 30 VAL C C 13 175.11 0.01 A 30 VAL CA C 13 65.08 0.01 A 30 VAL CB C 13 31.33 0.01 A 30 VAL N N 15 125.64 0.01 A 31 ARG H H 1 9.378 0.01 A 31 ARG HA H 1 4.674 0.01 A 31 ARG C C 13 172.60 0.01 A 31 ARG CA C 13 54.58 0.01 A 31 ARG CB C 13 29.75 0.01 A 31 ARG N N 15 124.73 0.01 A 32 THR H H 1 7.144 0.01 A 32 THR HA H 1 5.471 0.01 A 32 THR C C 13 173.81 0.01 A 32 THR CA C 13 61.25 0.01 A 32 THR CB C 13 71.36 0.01 A 32 THR N N 15 115.38 0.01 A 33 LEU H H 1 9.701 0.01 A 33 LEU HA H 1 4.927 0.01 A 33 LEU C C 13 174.96 0.01 A 33 LEU CA C 13 52.89 0.01 A 33 LEU CB C 13 44.91 0.01 A 33 LEU N N 15 124.60 0.01 A 34 PHE H H 1 9.411 0.01 A 34 PHE HA H 1 5.089 0.01 A 34 PHE C C 13 174.53 0.01 A 34 PHE CA C 13 55.74 0.01 A 34 PHE CB C 13 41.41 0.01 A 34 PHE N N 15 122.60 0.01 A 35 VAL H H 1 8.878 0.01 A 35 VAL HA H 1 4.726 0.01 A 35 VAL C C 13 173.52 0.01 A 35 VAL CA C 13 60.65 0.01 A 35 VAL CB C 13 34.17 0.01 A 35 VAL N N 15 127.05 0.01 A 36 SER H H 1 8.964 0.01 A 36 SER HA H 1 4.876 0.01 A 36 SER C C 13 173.17 0.01 A 36 SER CA C 13 56.70 0.01 A 36 SER CB C 13 65.44 0.01 A 36 SER N N 15 120.26 0.01 A 37 GLY H H 1 8.567 0.01 A 37 GLY HAx H 1 3.544 0.01 A 37 GLY HAy H 1 4.502 0.01 A 37 GLY C C 13 174.15 0.01 A 37 GLY CA C 13 45.53 0.01 A 37 GLY N N 15 108.69 0.01 A 38 LEU H H 1 7.426 0.01 A 38 LEU HA H 1 3.901 0.01 A 38 LEU CA C 13 51.41 0.01 A 38 LEU N N 15 118.64 0.01 A 39 PRO HA H 1 4.550 0.01 A 39 PRO C C 13 177.54 0.01 A 39 PRO CA C 13 62.13 0.01 A 39 PRO CB C 13 32.21 0.01 A 40 VAL H H 1 8.311 0.01 A 40 VAL HA H 1 3.684 0.01 A 40 VAL C C 13 175.65 0.01 A 40 VAL CA C 13 64.46 0.01 A 40 VAL CB C 13 31.73 0.01 A 40 VAL N N 15 114.99 0.01 A 41 ASP H H 1 7.809 0.01 A 41 ASP HA H 1 4.684 0.01 A 41 ASP C C 13 176.14 0.01 A 41 ASP CA C 13 51.80 0.01 A 41 ASP CB C 13 39.68 0.01 A 41 ASP N N 15 117.41 0.01 A 42 ILE H H 1 7.098 0.01 A 42 ILE HA H 1 4.084 0.01 A 42 ILE C C 13 173.94 0.01 A 42 ILE CA C 13 60.77 0.01 A 42 ILE CB C 13 38.74 0.01 A 42 ILE N N 15 119.18 0.01 A 43 LYS H H 1 8.963 0.01 A 43 LYS HA H 1 4.993 0.01 A 43 LYS CA C 13 53.60 0.01 A 43 LYS N N 15 126.52 0.01 A 44 PRO HA H 1 4.100 0.01 A 44 PRO C C 13 180.11 0.01 A 44 PRO CA C 13 66.69 0.01 A 44 PRO CB C 13 31.81 0.01 A 45 ARG H H 1 8.922 0.01 A 45 ARG HA H 1 4.243 0.01 A 45 ARG C C 13 176.20 0.01 A 45 ARG CA C 13 58.55 0.01 A 45 ARG CB C 13 30.42 0.01 A 45 ARG N N 15 115.44 0.01 A 46 GLU H H 1 8.340 0.01 A 46 GLU HA H 1 4.038 0.01 A 46 GLU C C 13 178.82 0.01 A 46 GLU CA C 13 60.21 0.01 A 46 GLU CB C 13 30.88 0.01 A 46 GLU N N 15 119.72 0.01 A 47 LEU H H 1 7.196 0.01 A 47 LEU HA H 1 4.373 0.01 A 47 LEU C C 13 178.38 0.01 A 47 LEU CA C 13 57.52 0.01 A 47 LEU CB C 13 41.68 0.01 A 47 LEU N N 15 115.57 0.01 A 48 TYR H H 1 6.816 0.01 A 48 TYR HA H 1 4.209 0.01 A 48 TYR C C 13 176.38 0.01 A 48 TYR CA C 13 60.63 0.01 A 48 TYR CB C 13 36.63 0.01 A 48 TYR N N 15 119.67 0.01 A 49 LEU H H 1 8.129 0.01 A 49 LEU HA H 1 3.202 0.01 A 49 LEU C C 13 179.03 0.01 A 49 LEU CA C 13 57.74 0.01 A 49 LEU CB C 13 43.23 0.01 A 49 LEU N N 15 118.19 0.01 A 50 LEU H H 1 7.543 0.01 A 50 LEU HA H 1 3.710 0.01 A 50 LEU C C 13 176.42 0.01 A 50 LEU CA C 13 57.29 0.01 A 50 LEU CB C 13 42.64 0.01 A 50 LEU N N 15 117.13 0.01 A 51 PHE H H 1 7.439 0.01 A 51 PHE HA H 1 4.660 0.01 A 51 PHE C C 13 175.11 0.01 A 51 PHE CA C 13 59.64 0.01 A 51 PHE CB C 13 40.25 0.01 A 51 PHE N N 15 110.42 0.01 A 52 ARG H H 1 7.865 0.01 A 52 ARG HA H 1 3.743 0.01 A 52 ARG CA C 13 59.92 0.01 A 52 ARG N N 15 120.68 0.01 A 53 PRO HA H 1 4.202 0.01 A 53 PRO C C 13 176.60 0.01 A 53 PRO CA C 13 64.54 0.01 A 53 PRO CB C 13 30.96 0.01 A 54 PHE H H 1 7.943 0.01 A 54 PHE HA H 1 4.256 0.01 A 54 PHE C C 13 175.50 0.01 A 54 PHE CA C 13 59.20 0.01 A 54 PHE CB C 13 38.68 0.01 A 54 PHE N N 15 117.47 0.01 A 55 LYS H H 1 8.571 0.01 A 55 LYS HA H 1 4.153 0.01 A 55 LYS C C 13 177.90 0.01 A 55 LYS CA C 13 58.04 0.01 A 55 LYS CB C 13 32.53 0.01 A 55 LYS N N 15 126.46 0.01 A 56 GLY H H 1 9.045 0.01 A 56 GLY HAx H 1 3.883 0.01 A 56 GLY HAy H 1 4.661 0.01 A 56 GLY C C 13 174.83 0.01 A 56 GLY CA C 13 45.15 0.01 A 56 GLY N N 15 112.78 0.01 A 57 TYR H H 1 7.560 0.01 A 57 TYR HA H 1 3.076 0.01 A 57 TYR C C 13 175.26 0.01 A 57 TYR CA C 13 59.65 0.01 A 57 TYR CB C 13 38.19 0.01 A 57 TYR N N 15 121.70 0.01 A 58 GLU H H 1 8.356 0.01 A 58 GLU HA H 1 4.268 0.01 A 58 GLU C C 13 175.70 0.01 A 58 GLU CA C 13 56.34 0.01 A 58 GLU CB C 13 31.73 0.01 A 58 GLU N N 15 128.50 0.01 A 59 GLY H H 1 6.411 0.01 A 59 GLY HAx H 1 3.645 0.01 A 59 GLY HAy H 1 4.007 0.01 A 59 GLY C C 13 170.31 0.01 A 59 GLY CA C 13 45.53 0.01 A 59 GLY N N 15 104.92 0.01 A 60 SER H H 1 8.280 0.01 A 60 SER HA H 1 5.468 0.01 A 60 SER C C 13 172.47 0.01 A 60 SER CA C 13 57.17 0.01 A 60 SER CB C 13 66.61 0.01 A 60 SER N N 15 110.02 0.01 A 61 LEU H H 1 8.953 0.01 A 61 LEU HA H 1 4.743 0.01 A 61 LEU C C 13 174.60 0.01 A 61 LEU CA C 13 54.68 0.01 A 61 LEU CB C 13 45.38 0.01 A 61 LEU N N 15 118.49 0.01 A 62 ILE H H 1 8.639 0.01 A 62 ILE HA H 1 4.917 0.01 A 62 ILE C C 13 175.60 0.01 A 62 ILE CA C 13 59.49 0.01 A 62 ILE CB C 13 39.92 0.01 A 62 ILE N N 15 120.76 0.01 A 63 LYS H H 1 9.145 0.01 A 63 LYS HA H 1 4.702 0.01 A 63 LYS C C 13 174.70 0.01 A 63 LYS CA C 13 54.55 0.01 A 63 LYS CB C 13 35.49 0.01 A 63 LYS N N 15 127.24 0.01 A 64 LEU H H 1 8.648 0.01 A 64 LEU HA H 1 4.702 0.01 A 64 LEU C C 13 177.47 0.01 A 64 LEU CA C 13 54.59 0.01 A 64 LEU CB C 13 42.42 0.01 A 64 LEU N N 15 124.70 0.01 A 65 THR H H 1 8.330 0.01 A 65 THR HA H 1 4.521 0.01 A 65 THR C C 13 174.16 0.01 A 65 THR CA C 13 60.99 0.01 A 65 THR CB C 13 70.63 0.01 A 65 THR N N 15 116.86 0.01 A 66 ALA H H 1 8.834 0.01 A 66 ALA HA H 1 4.170 0.01 A 66 ALA C C 13 177.06 0.01 A 66 ALA CA C 13 53.59 0.01 A 66 ALA CB C 13 18.06 0.01 A 66 ALA N N 15 127.31 0.01 A 67 ARG H H 1 8.335 0.01 A 67 ARG HA H 1 4.064 0.01 A 67 ARG C C 13 175.40 0.01 A 67 ARG CA C 13 57.31 0.01 A 67 ARG CB C 13 29.77 0.01 A 67 ARG N N 15 113.66 0.01 A 68 GLN H H 1 7.832 0.01 A 68 GLN HA H 1 4.815 0.01 A 68 GLN CA C 13 53.28 0.01 A 68 GLN N N 15 118.79 0.01 A 69 PRO HA H 1 4.846 0.01 A 69 PRO C C 13 175.48 0.01 A 69 PRO CA C 13 62.90 0.01 A 69 PRO CB C 13 32.45 0.01 A 70 VAL H H 1 8.722 0.01 A 70 VAL HA H 1 4.542 0.01 A 70 VAL C C 13 174.47 0.01 A 70 VAL CA C 13 60.04 0.01 A 70 VAL CB C 13 34.92 0.01 A 70 VAL N N 15 117.70 0.01 A 71 GLY H H 1 8.716 0.01 A 71 GLY HAx H 1 2.992 0.01 A 71 GLY HAy H 1 5.241 0.01 A 71 GLY C C 13 171.00 0.01 A 71 GLY CA C 13 43.99 0.01 A 71 GLY N N 15 107.93 0.01 A 72 PHE H H 1 8.934 0.01 A 72 PHE HA H 1 5.635 0.01 A 72 PHE C C 13 175.35 0.01 A 72 PHE CA C 13 56.83 0.01 A 72 PHE CB C 13 42.11 0.01 A 72 PHE N N 15 119.40 0.01 A 73 VAL H H 1 8.934 0.01 A 73 VAL HA H 1 4.563 0.01 A 73 VAL C C 13 172.93 0.01 A 73 VAL CA C 13 60.76 0.01 A 73 VAL CB C 13 34.57 0.01 A 73 VAL N N 15 122.00 0.01 A 74 ILE H H 1 8.702 0.01 A 74 ILE HA H 1 4.867 0.01 A 74 ILE C C 13 173.70 0.01 A 74 ILE CA C 13 60.88 0.01 A 74 ILE CB C 13 33.40 0.01 A 74 ILE N N 15 128.00 0.01 A 75 PHE H H 1 8.200 0.01 A 75 PHE HA H 1 5.147 0.01 A 75 PHE C C 13 175.88 0.01 A 75 PHE CA C 13 56.22 0.01 A 75 PHE CB C 13 44.68 0.01 A 75 PHE N N 15 125.20 0.01 A 76 ASP H H 1 9.400 0.01 A 76 ASP HA H 1 4.277 0.01 A 76 ASP C C 13 176.02 0.01 A 76 ASP CA C 13 55.58 0.01 A 76 ASP CB C 13 40.52 0.01 A 76 ASP N N 15 119.15 0.01 A 77 SER H H 1 7.804 0.01 A 77 SER HA H 1 4.683 0.01 A 77 SER C C 13 173.67 0.01 A 77 SER CA C 13 56.62 0.01 A 77 SER CB C 13 66.47 0.01 A 77 SER N N 15 111.28 0.01 A 78 ARG H H 1 9.348 0.01 A 78 ARG HA H 1 4.030 0.01 A 78 ARG C C 13 177.71 0.01 A 78 ARG CA C 13 59.87 0.01 A 78 ARG CB C 13 29.80 0.01 A 78 ARG N N 15 125.24 0.01 A 79 ALA H H 1 8.660 0.01 A 79 ALA HA H 1 4.200 0.01 A 79 ALA C C 13 181.36 0.01 A 79 ALA CA C 13 55.28 0.01 A 79 ALA CB C 13 18.15 0.01 A 79 ALA N N 15 120.70 0.01 A 80 GLY H H 1 8.161 0.01 A 80 GLY HAx H 1 3.925 0.01 A 80 GLY HAy H 1 3.925 0.01 A 80 GLY C C 13 175.71 0.01 A 80 GLY CA C 13 46.79 0.01 A 80 GLY N N 15 107.50 0.01 A 81 ALA H H 1 7.298 0.01 A 81 ALA HA H 1 2.576 0.01 A 81 ALA C C 13 178.57 0.01 A 81 ALA CA C 13 54.22 0.01 A 81 ALA CB C 13 18.18 0.01 A 81 ALA N N 15 124.65 0.01 A 82 GLU H H 1 8.930 0.01 A 82 GLU HA H 1 3.731 0.01 A 82 GLU C C 13 177.80 0.01 A 82 GLU CA C 13 59.56 0.01 A 82 GLU CB C 13 29.86 0.01 A 82 GLU N N 15 118.89 0.01 A 83 ALA H H 1 7.572 0.01 A 83 ALA HA H 1 4.117 0.01 A 83 ALA C C 13 180.81 0.01 A 83 ALA CA C 13 54.89 0.01 A 83 ALA CB C 13 18.15 0.01 A 83 ALA N N 15 119.41 0.01 A 84 ALA H H 1 6.950 0.01 A 84 ALA HA H 1 3.140 0.01 A 84 ALA C C 13 178.01 0.01 A 84 ALA CA C 13 54.73 0.01 A 84 ALA CB C 13 18.71 0.01 A 84 ALA N N 15 120.28 0.01 A 85 LYS H H 1 8.042 0.01 A 85 LYS HA H 1 3.588 0.01 A 85 LYS C C 13 177.70 0.01 A 85 LYS CA C 13 59.56 0.01 A 85 LYS CB C 13 32.09 0.01 A 85 LYS N N 15 118.04 0.01 A 86 ASN H H 1 8.087 0.01 A 86 ASN HA H 1 4.473 0.01 A 86 ASN C C 13 177.32 0.01 A 86 ASN CA C 13 55.07 0.01 A 86 ASN CB C 13 37.99 0.01 A 86 ASN N N 15 114.63 0.01 A 87 ALA H H 1 7.557 0.01 A 87 ALA HA H 1 4.307 0.01 A 87 ALA C C 13 179.63 0.01 A 87 ALA CA C 13 54.30 0.01 A 87 ALA CB C 13 20.18 0.01 A 87 ALA N N 15 120.20 0.01 A 88 LEU H H 1 7.561 0.01 A 88 LEU HA H 1 4.413 0.01 A 88 LEU C C 13 176.58 0.01 A 88 LEU CA C 13 54.41 0.01 A 88 LEU CB C 13 44.33 0.01 A 88 LEU N N 15 114.21 0.01 A 89 ASN H H 1 7.550 0.01 A 89 ASN HA H 1 4.256 0.01 A 89 ASN C C 13 177.70 0.01 A 89 ASN CA C 13 55.99 0.01 A 89 ASN CB C 13 38.57 0.01 A 89 ASN N N 15 117.97 0.01 A 90 GLY H H 1 8.734 0.01 A 90 GLY HAx H 1 3.741 0.01 A 90 GLY HAy H 1 4.318 0.01 A 90 GLY C C 13 174.36 0.01 A 90 GLY CA C 13 45.76 0.01 A 90 GLY N N 15 112.22 0.01 A 91 ILE H H 1 7.518 0.01 A 91 ILE HA H 1 4.476 0.01 A 91 ILE C C 13 175.94 0.01 A 91 ILE CA C 13 60.52 0.01 A 91 ILE CB C 13 39.02 0.01 A 91 ILE N N 15 115.84 0.01 A 92 ARG H H 1 8.461 0.01 A 92 ARG HA H 1 4.477 0.01 A 92 ARG C C 13 175.84 0.01 A 92 ARG CA C 13 56.66 0.01 A 92 ARG CB C 13 30.55 0.01 A 92 ARG N N 15 120.16 0.01 A 93 PHE H H 1 8.443 0.01 A 93 PHE HA H 1 4.057 0.01 A 93 PHE C C 13 171.62 0.01 A 93 PHE CA C 13 61.01 0.01 A 93 PHE CB C 13 40.48 0.01 A 93 PHE N N 15 126.78 0.01 A 94 ASP H H 1 7.860 0.01 A 94 ASP HA H 1 4.869 0.01 A 94 ASP CA C 13 48.53 0.01 A 94 ASP N N 15 110.65 0.01 A 95 PRO HA H 1 3.847 0.01 A 95 PRO C C 13 177.65 0.01 A 95 PRO CA C 13 63.29 0.01 A 95 PRO CB C 13 32.09 0.01 A 96 GLU H H 1 7.944 0.01 A 96 GLU HA H 1 4.225 0.01 A 96 GLU C C 13 175.31 0.01 A 96 GLU CA C 13 56.17 0.01 A 96 GLU CB C 13 30.00 0.01 A 96 GLU N N 15 115.27 0.01 A 97 ASN H H 1 8.190 0.01 A 97 ASN HA H 1 5.202 0.01 A 97 ASN CA C 13 49.86 0.01 A 97 ASN N N 15 121.61 0.01 A 98 PRO HA H 1 4.169 0.01 A 98 PRO C C 13 176.94 0.01 A 98 PRO CA C 13 63.29 0.01 A 98 PRO CB C 13 32.21 0.01 A 99 GLN H H 1 8.174 0.01 A 99 GLN HA H 1 4.183 0.01 A 99 GLN C C 13 176.66 0.01 A 99 GLN CA C 13 57.08 0.01 A 99 GLN CB C 13 28.99 0.01 A 99 GLN N N 15 120.23 0.01 A 100 THR H H 1 8.241 0.01 A 100 THR HA H 1 4.784 0.01 A 100 THR C C 13 174.54 0.01 A 100 THR CA C 13 59.87 0.01 A 100 THR CB C 13 71.92 0.01 A 100 THR N N 15 117.08 0.01 A 101 LEU H H 1 8.809 0.01 A 101 LEU HA H 1 4.639 0.01 A 101 LEU C C 13 177.93 0.01 A 101 LEU CA C 13 54.66 0.01 A 101 LEU CB C 13 44.48 0.01 A 101 LEU N N 15 120.72 0.01 A 102 ARG H H 1 8.327 0.01 A 102 ARG HA H 1 4.971 0.01 A 102 ARG C C 13 174.50 0.01 A 102 ARG CA C 13 54.71 0.01 A 102 ARG CB C 13 32.00 0.01 A 102 ARG N N 15 124.04 0.01 A 103 LEU H H 1 8.825 0.01 A 103 LEU HA H 1 5.370 0.01 A 103 LEU C C 13 174.66 0.01 A 103 LEU CA C 13 54.66 0.01 A 103 LEU CB C 13 44.78 0.01 A 103 LEU N N 15 125.78 0.01 A 104 GLU H H 1 8.348 0.01 A 104 GLU HA H 1 4.509 0.01 A 104 GLU C C 13 175.11 0.01 A 104 GLU CA C 13 53.44 0.01 A 104 GLU CB C 13 34.02 0.01 A 104 GLU N N 15 119.10 0.01 A 105 PHE H H 1 9.227 0.01 A 105 PHE HA H 1 4.611 0.01 A 105 PHE C C 13 177.06 0.01 A 105 PHE CA C 13 61.19 0.01 A 105 PHE CB C 13 39.18 0.01 A 105 PHE N N 15 121.07 0.01 A 106 ALA H H 1 9.567 0.01 A 106 ALA HA H 1 4.425 0.01 A 106 ALA C C 13 175.86 0.01 A 106 ALA CA C 13 51.28 0.01 A 106 ALA CB C 13 19.75 0.01 A 106 ALA N N 15 124.89 0.01 A 107 LYS H H 1 8.581 0.01 A 107 LYS HA H 1 4.172 0.01 A 107 LYS C C 13 176.06 0.01 A 107 LYS CA C 13 57.15 0.01 A 107 LYS CB C 13 32.50 0.01 A 107 LYS N N 15 117.51 0.01 A 108 ALA H H 1 7.731 0.01 A 108 ALA HA H 1 4.374 0.01 A 108 ALA C C 13 176.65 0.01 A 108 ALA CA C 13 50.87 0.01 A 108 ALA CB C 13 21.52 0.01 A 108 ALA N N 15 118.70 0.01 A 109 ASN H H 1 8.936 0.01 A 109 ASN HA H 1 4.973 0.01 A 109 ASN C C 13 175.94 0.01 A 109 ASN CA C 13 53.13 0.01 A 109 ASN CB C 13 38.67 0.01 A 109 ASN N N 15 116.53 0.01 A 110 THR H H 1 7.437 0.01 A 110 THR HA H 1 4.153 0.01 A 110 THR C C 13 173.24 0.01 A 110 THR CA C 13 61.99 0.01 A 110 THR CB C 13 69.83 0.01 A 110 THR N N 15 116.26 0.01 A 111 LYS H H 1 8.248 0.01 A 111 LYS HA H 1 4.247 0.01 A 111 LYS C C 13 176.14 0.01 A 111 LYS CA C 13 55.93 0.01 A 111 LYS CB C 13 32.70 0.01 A 111 LYS N N 15 124.50 0.01 A 112 MET H H 1 8.290 0.01 A 112 MET HA H 1 4.408 0.01 A 112 MET C C 13 175.55 0.01 A 112 MET CA C 13 54.78 0.01 A 112 MET CB C 13 33.28 0.01 A 112 MET N N 15 122.00 0.01 A 113 ALA H H 1 8.213 0.01 A 113 ALA HA H 1 4.256 0.01 A 113 ALA C C 13 177.58 0.01 A 113 ALA CA C 13 52.47 0.01 A 113 ALA CB C 13 19.14 0.01 A 113 ALA N N 15 125.15 0.01 A 114 LYS H H 1 8.261 0.01 A 114 LYS HA H 1 4.256 0.01 A 114 LYS C C 13 176.79 0.01 A 114 LYS CA C 13 56.34 0.01 A 114 LYS CB C 13 32.87 0.01 A 114 LYS N N 15 120.74 0.01 A 115 SER H H 1 8.268 0.01 A 115 SER HA H 1 4.393 0.01 A 115 SER C C 13 174.71 0.01 A 115 SER CA C 13 58.41 0.01 A 115 SER CB C 13 63.87 0.01 A 115 SER N N 15 116.78 0.01 A 116 LYS H H 1 8.346 0.01 A 116 LYS HA H 1 4.291 0.01 A 116 LYS C C 13 176.40 0.01 A 116 LYS CA C 13 56.33 0.01 A 116 LYS CB C 13 32.71 0.01 A 116 LYS N N 15 123.21 0.01 A 117 LEU H H 1 8.093 0.01 A 117 LEU HA H 1 4.276 0.01 A 117 LEU C C 13 177.08 0.01 A 117 LEU CA C 13 55.05 0.01 A 117 LEU CB C 13 42.21 0.01 A 117 LEU N N 15 122.47 0.01 A 118 GLU H H 1 8.202 0.01 A 118 GLU CA C 13 56.40 0.01 A 118 GLU N N 15 121.50 0.01 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 28 GLU H A 28 GLU HA 1.0 . 3.0 2 2 A 28 GLU H A 28 GLU HBx 1.0 . 5.4 3 2 A 28 GLU H A 28 GLU HBy 1.0 . 5.4 4 3 A 28 GLU H A 28 GLU HGy 1.0 . 5.0 5 4 A 28 GLU H A 28 GLU HGx 1.0 . 5.0 6 5 A 28 GLU HA A 29 GLU H 1.0 . 2.6 7 6 A 28 GLU H A 29 GLU H 1.0 . 4.6 8 7 A 29 GLU H A 28 GLU HBx 1.0 . 4.6 9 7 A 28 GLU HBy A 29 GLU H 1.0 . 4.6 10 8 A 29 GLU H A 29 GLU HA 1.0 . 3.0 11 9 A 29 GLU H A 78 ARG HDx 1.0 . 5.4 12 10 A 29 GLU H A 78 ARG HDy 1.0 . 5.4 13 11 A 29 GLU H A 109 ASN HD2x 1.0 . 5.8 14 12 A 29 GLU H A 109 ASN HD2y 1.0 . 5.8 15 13 A 29 GLU HA A 30 VAL H 1.0 . 3.4 16 14 A 29 GLU H A 30 VAL H 1.0 . 4.4 17 15 A 30 VAL H A 29 GLU HBx 1.0 . 5.4 18 15 A 30 VAL H A 29 GLU HBy 1.0 . 5.4 19 16 A 30 VAL H A 30 VAL HA 1.0 . 3.0 20 17 A 30 VAL H A 30 VAL HB 1.0 . 2.8 21 18 A 30 VAL H A 30 VAL HG21 1.0 . 5.4 22 19 A 30 VAL H A 30 VAL HG11 1.0 . 6.4 23 20 A 78 ARG HDx A 30 VAL H 1.0 . 5.0 24 21 A 78 ARG HDy A 30 VAL H 1.0 . 5.0 25 22 A 109 ASN HD2x A 30 VAL H 1.0 . 5.8 26 23 A 109 ASN HD2y A 30 VAL H 1.0 . 5.8 27 24 A 30 VAL HA A 31 ARG H 1.0 . 3.0 28 25 A 30 VAL H A 31 ARG H 1.0 . 4.8 29 26 A 30 VAL HB A 31 ARG H 1.0 . 4.4 30 27 A 30 VAL HG11 A 31 ARG H 1.0 . 6.0 31 28 A 30 VAL HG21 A 31 ARG H 1.0 . 6.4 32 29 A 31 ARG H A 31 ARG HA 1.0 . 3.0 33 30 A 31 ARG H A 31 ARG HBx 1.0 . 5.4 34 30 A 31 ARG H A 31 ARG HBy 1.0 . 5.4 35 31 A 31 ARG H A 31 ARG HGx 1.0 . 5.4 36 31 A 31 ARG H A 31 ARG HGy 1.0 . 5.4 37 32 A 31 ARG H A 31 ARG HDx 1.0 . 4.8 38 33 A 31 ARG H A 31 ARG HDy 1.0 . 4.8 39 34 A 109 ASN HD2x A 31 ARG H 1.0 . 4.8 40 35 A 109 ASN HD2y A 31 ARG H 1.0 . 4.8 41 36 A 31 ARG HA A 32 THR H 1.0 . 3.0 42 37 A 31 ARG H A 32 THR H 1.0 . 4.8 43 38 A 32 THR H A 31 ARG HBx 1.0 . 5.8 44 38 A 31 ARG HBy A 32 THR H 1.0 . 5.8 45 39 A 32 THR H A 31 ARG HGx 1.0 . 5.8 46 39 A 31 ARG HGy A 32 THR H 1.0 . 5.8 47 40 A 32 THR H A 32 THR HA 1.0 . 3.0 48 41 A 32 THR H A 32 THR HB 1.0 . 3.4 49 42 A 32 THR H A 32 THR HG21 1.0 . 5.8 50 43 A 109 ASN HD2x A 32 THR H 1.0 . 5.0 51 44 A 109 ASN HD2y A 32 THR H 1.0 . 5.2 52 45 A 32 THR H A 109 ASN HA 1.0 . 5.0 53 46 A 32 THR H A 109 ASN HBy 1.0 . 5.8 54 47 A 32 THR H A 109 ASN HBx 1.0 . 5.8 55 48 A 32 THR H A 106 ALA H 1.0 . 5.0 56 49 A 32 THR H A 74 ILE HA 1.0 . 5.4 57 50 A 32 THR H A 33 LEU HD21 1.0 . 6.8 58 51 A 32 THR H A 110 THR H 1.0 . 6.0 59 52 A 30 VAL HA A 32 THR H 1.0 . 4.4 60 53 A 30 VAL HG11 A 32 THR H 1.0 . 5.4 61 54 A 30 VAL HG21 A 32 THR H 1.0 . 6.4 62 55 A 32 THR HA A 33 LEU H 1.0 . 2.4 63 56 A 32 THR H A 33 LEU H 1.0 . 4.8 64 57 A 32 THR HB A 33 LEU H 1.0 . 5.0 65 58 A 32 THR HG21 A 33 LEU H 1.0 . 5.4 66 59 A 33 LEU H A 33 LEU HA 1.0 . 3.0 67 60 A 33 LEU H A 33 LEU HBx 1.0 . 5.8 68 60 A 33 LEU H A 33 LEU HBy 1.0 . 5.8 69 61 A 33 LEU H A 33 LEU HD11 1.0 . 6.0 70 62 A 33 LEU H A 33 LEU HD21 1.0 . 6.0 71 63 A 33 LEU H A 73 VAL H 1.0 . 3.6 72 64 A 33 LEU H A 74 ILE H 1.0 . 5.0 73 65 A 33 LEU H A 75 PHE H 1.0 . 5.0 74 66 A 106 ALA H A 33 LEU H 1.0 . 5.4 75 67 A 110 THR H A 33 LEU H 1.0 . 6.0 76 68 A 74 ILE HA A 33 LEU H 1.0 . 3.6 77 69 A 33 LEU H A 73 VAL HA 1.0 . 5.0 78 70 A 33 LEU H A 72 PHE HA 1.0 . 5.2 79 71 A 33 LEU H A 73 VAL HG11 1.0 . 6.4 80 72 A 33 LEU H A 73 VAL HG21 1.0 . 6.4 81 73 A 33 LEU HA A 34 PHE H 1.0 . 2.4 82 74 A 33 LEU H A 34 PHE H 1.0 . 4.8 83 75 A 34 PHE H A 33 LEU HBx 1.0 . 4.6 84 75 A 33 LEU HBy A 34 PHE H 1.0 . 4.6 85 76 A 34 PHE H A 33 LEU HD11 1.0 . 6.4 86 77 A 34 PHE H A 33 LEU HD21 1.0 . 6.4 87 78 A 34 PHE H A 34 PHE HA 1.0 . 3.0 88 79 A 34 PHE H A 34 PHE HBy 1.0 . 4.4 89 80 A 34 PHE H A 34 PHE HBx 1.0 . 4.4 90 81 A 34 PHE H A 105 PHE H 1.0 . 5.0 91 82 A 34 PHE H A 104 GLU H 1.0 . 3.2 92 83 A 106 ALA H A 34 PHE H 1.0 . 3.6 93 84 A 73 VAL H A 34 PHE H 1.0 . 5.0 94 85 A 73 VAL HG11 A 34 PHE H 1.0 . 7.2 95 86 A 72 PHE HA A 34 PHE H 1.0 . 5.2 96 87 A 34 PHE H A 103 LEU HA 1.0 . 5.4 97 88 A 34 PHE H A 104 GLU HA 1.0 . 5.0 98 89 A 34 PHE H A 105 PHE HA 1.0 . 4.0 99 90 A 34 PHE H A 105 PHE HBx 1.0 . 5.8 100 91 A 34 PHE H A 105 PHE HBy 1.0 . 5.8 101 92 A 34 PHE H A 85 LYS HEx 1.0 . 5.8 102 93 A 34 PHE H A 85 LYS HEy 1.0 . 5.8 103 94 A 34 PHE H A 104 GLU HGx 1.0 . 6.2 104 94 A 34 PHE H A 104 GLU HGy 1.0 . 6.2 105 95 A 34 PHE H A 104 GLU HBx 1.0 . 5.8 106 95 A 34 PHE H A 104 GLU HBy 1.0 . 5.8 107 96 A 34 PHE HA A 35 VAL H 1.0 . 2.4 108 97 A 34 PHE H A 35 VAL H 1.0 . 4.8 109 98 A 34 PHE HBy A 35 VAL H 1.0 . 4.4 110 99 A 34 PHE HBx A 35 VAL H 1.0 . 4.4 111 100 A 35 VAL H A 35 VAL HA 1.0 . 3.0 112 101 A 35 VAL H A 35 VAL HB 1.0 . 2.6 113 102 A 35 VAL H A 35 VAL HG21 1.0 . 5.4 114 103 A 35 VAL H A 35 VAL HG11 1.0 . 6.4 115 104 A 35 VAL H A 71 GLY H 1.0 . 3.4 116 105 A 35 VAL H A 72 PHE H 1.0 . 5.0 117 106 A 73 VAL H A 35 VAL H 1.0 . 5.2 118 107 A 72 PHE HA A 35 VAL H 1.0 . 4.0 119 108 A 35 VAL H A 71 GLY HAx 1.0 . 5.2 120 109 A 35 VAL H A 71 GLY HAy 1.0 . 5.2 121 110 A 35 VAL H A 70 VAL HA 1.0 . 5.4 122 111 A 35 VAL H A 38 LEU HD11 1.0 . 6.4 123 112 A 103 LEU HA A 35 VAL H 1.0 . 5.0 124 113 A 35 VAL HA A 36 SER H 1.0 . 2.4 125 114 A 35 VAL H A 36 SER H 1.0 . 4.8 126 115 A 35 VAL HB A 36 SER H 1.0 . 4.8 127 116 A 35 VAL HG11 A 36 SER H 1.0 . 5.4 128 117 A 35 VAL HG21 A 36 SER H 1.0 . 5.4 129 118 A 36 SER H A 36 SER HA 1.0 . 3.0 130 119 A 36 SER H A 36 SER HBy 1.0 . 4.4 131 120 A 36 SER H A 36 SER HBx 1.0 . 4.4 132 121 A 36 SER H A 102 ARG H 1.0 . 3.4 133 122 A 36 SER H A 103 LEU H 1.0 . 5.0 134 123 A 104 GLU H A 36 SER H 1.0 . 5.0 135 124 A 71 GLY H A 36 SER H 1.0 . 5.0 136 125 A 36 SER H A 38 LEU H 1.0 . 6.0 137 126 A 103 LEU HA A 36 SER H 1.0 . 4.0 138 127 A 36 SER H A 102 ARG HA 1.0 . 5.0 139 128 A 36 SER H A 101 LEU HA 1.0 . 4.8 140 129 A 34 PHE HBx A 36 SER H 1.0 . 5.8 141 130 A 36 SER H A 102 ARG HBx 1.0 . 5.4 142 130 A 36 SER H A 102 ARG HBy 1.0 . 5.4 143 131 A 36 SER H A 102 ARG HDx 1.0 . 5.8 144 131 A 36 SER H A 102 ARG HDy 1.0 . 5.8 145 132 A 36 SER H A 38 LEU HD21 1.0 . 6.8 146 133 A 36 SER HA A 37 GLY H 1.0 . 2.6 147 134 A 36 SER H A 37 GLY H 1.0 . 4.8 148 135 A 36 SER HBy A 37 GLY H 1.0 . 3.6 149 136 A 36 SER HBx A 37 GLY H 1.0 . 3.6 150 137 A 37 GLY H A 37 GLY HAy 1.0 . 2.8 151 138 A 37 GLY H A 37 GLY HAx 1.0 . 2.8 152 139 A 71 GLY H A 37 GLY H 1.0 . 6.4 153 140 A 102 ARG H A 37 GLY H 1.0 . 5.0 154 141 A 37 GLY H A 99 GLN HE2x 1.0 . 6.8 155 142 A 37 GLY H A 99 GLN HE2y 1.0 . 6.8 156 143 A 101 LEU HA A 37 GLY H 1.0 . 4.8 157 144 A 37 GLY H A 38 LEU HD21 1.0 . 6.4 158 145 A 37 GLY H A 38 LEU HD11 1.0 . 6.8 159 146 A 38 LEU H A 37 GLY HAx 1.0 . 3.6 160 147 A 38 LEU H A 37 GLY HAy 1.0 . 3.6 161 148 A 38 LEU H A 37 GLY H 1.0 . 2.4 162 149 A 38 LEU H A 38 LEU HA 1.0 . 3.0 163 150 A 38 LEU H A 38 LEU HBx 1.0 . 5.0 164 150 A 38 LEU H A 38 LEU HBy 1.0 . 5.0 165 151 A 38 LEU H A 38 LEU HG 1.0 . 4.0 166 152 A 38 LEU H A 38 LEU HD11 1.0 . 5.8 167 153 A 38 LEU H A 38 LEU HD21 1.0 . 5.8 168 154 A 102 ARG H A 38 LEU H 1.0 . 6.0 169 155 A 38 LEU H A 99 GLN HE2x 1.0 . 6.4 170 156 A 38 LEU H A 99 GLN HE2y 1.0 . 6.4 171 157 A 38 LEU H A 101 LEU HA 1.0 . 5.0 172 158 A 36 SER HA A 38 LEU H 1.0 . 4.0 173 159 A 36 SER HBy A 38 LEU H 1.0 . 6.0 174 160 A 36 SER HBx A 38 LEU H 1.0 . 6.0 175 161 A 38 LEU H A 39 PRO HDy 1.0 . 5.4 176 162 A 38 LEU H A 39 PRO HDx 1.0 . 5.4 177 163 A 38 LEU HA A 39 PRO HDy 1.0 . 3.2 178 164 A 38 LEU HA A 39 PRO HDx 1.0 . 3.2 179 165 A 39 PRO HDx A 38 LEU HD11 1.0 . 6.4 180 166 A 39 PRO HDy A 38 LEU HD11 1.0 . 6.4 181 167 A 38 LEU H A 68 GLN HGy 1.0 . 6.0 182 167 A 38 LEU H A 68 GLN HGx 1.0 . 6.0 183 168 A 39 PRO HA A 40 VAL H 1.0 . 2.6 184 169 A 39 PRO HDy A 40 VAL H 1.0 . 5.8 185 170 A 39 PRO HDx A 40 VAL H 1.0 . 5.8 186 171 A 40 VAL H A 40 VAL HA 1.0 . 2.8 187 172 A 40 VAL H A 40 VAL HB 1.0 . 2.6 188 173 A 40 VAL H A 40 VAL HG21 1.0 . 6.8 189 174 A 40 VAL H A 40 VAL HG11 1.0 . 5.4 190 175 A 99 GLN HE2x A 40 VAL H 1.0 . 6.8 191 176 A 99 GLN HE2y A 40 VAL H 1.0 . 6.8 192 177 A 40 VAL H A 42 ILE H 1.0 . 4.4 193 178 A 40 VAL H A 68 GLN HA 1.0 . 4.8 194 179 A 40 VAL H A 69 PRO HDx 1.0 . 4.4 195 180 A 40 VAL H A 69 PRO HDy 1.0 . 6.0 196 181 A 40 VAL H A 41 ASP HBx 1.0 . 5.4 197 182 A 40 VAL H A 41 ASP HBy 1.0 . 5.4 198 183 A 40 VAL HA A 41 ASP H 1.0 . 3.6 199 184 A 40 VAL H A 41 ASP H 1.0 . 2.8 200 185 A 40 VAL HB A 41 ASP H 1.0 . 4.4 201 186 A 40 VAL HG11 A 41 ASP H 1.0 . 5.8 202 187 A 40 VAL HG21 A 41 ASP H 1.0 . 6.8 203 188 A 41 ASP H A 41 ASP HA 1.0 . 2.8 204 189 A 41 ASP H A 41 ASP HBy 1.0 . 5.4 205 189 A 41 ASP H A 41 ASP HBx 1.0 . 5.4 206 190 A 38 LEU HA A 41 ASP H 1.0 . 6.4 207 191 A 39 PRO HA A 41 ASP H 1.0 . 4.4 208 192 A 41 ASP H A 43 LYS H 1.0 . 6.2 209 193 A 69 PRO HDx A 41 ASP H 1.0 . 5.0 210 194 A 68 GLN HA A 41 ASP H 1.0 . 5.8 211 195 A 42 ILE H A 41 ASP HA 1.0 . 3.6 212 196 A 42 ILE H A 41 ASP H 1.0 . 2.8 213 197 A 42 ILE H A 41 ASP HBy 1.0 . 5.8 214 197 A 42 ILE H A 41 ASP HBx 1.0 . 5.8 215 198 A 42 ILE H A 42 ILE HA 1.0 . 3.0 216 199 A 42 ILE H A 42 ILE HB 1.0 . 4.4 217 200 A 42 ILE H A 42 ILE HG21 1.0 . 6.8 218 201 A 42 ILE H A 42 ILE HD11 1.0 . 5.8 219 202 A 42 ILE H A 38 LEU HD21 1.0 . 6.8 220 203 A 42 ILE H A 38 LEU HD11 1.0 . 6.8 221 204 A 38 LEU HA A 42 ILE H 1.0 . 6.2 222 205 A 42 ILE H A 68 GLN HA 1.0 . 6.0 223 206 A 42 ILE H A 69 PRO HDx 1.0 . 5.0 224 207 A 39 PRO HDy A 42 ILE H 1.0 . 6.2 225 208 A 39 PRO HDx A 42 ILE H 1.0 . 5.8 226 209 A 39 PRO HA A 42 ILE H 1.0 . 6.0 227 210 A 40 VAL HB A 42 ILE H 1.0 . 6.0 228 211 A 40 VAL HA A 42 ILE H 1.0 . 4.0 229 212 A 43 LYS H A 42 ILE HA 1.0 . 3.2 230 213 A 42 ILE H A 43 LYS H 1.0 . 4.4 231 214 A 43 LYS H A 42 ILE HB 1.0 . 4.8 232 215 A 43 LYS H A 42 ILE HD11 1.0 . 6.8 233 216 A 43 LYS H A 42 ILE HG21 1.0 . 5.8 234 217 A 43 LYS H A 43 LYS HA 1.0 . 2.9 235 218 A 43 LYS H A 43 LYS HBx 1.0 . 5.4 236 218 A 43 LYS H A 43 LYS HBy 1.0 . 5.4 237 219 A 43 LYS H A 46 GLU H 1.0 . 5.8 238 220 A 43 LYS H A 47 LEU H 1.0 . 5.4 239 221 A 41 ASP HA A 43 LYS H 1.0 . 6.0 240 222 A 43 LYS H A 44 PRO HDy 1.0 . 5.2 241 223 A 43 LYS H A 44 PRO HDx 1.0 . 5.0 242 224 A 43 LYS HA A 44 PRO HDx 1.0 . 3.0 243 225 A 43 LYS HA A 44 PRO HDy 1.0 . 3.0 244 226 A 44 PRO HA A 45 ARG H 1.0 . 3.6 245 227 A 44 PRO HDx A 45 ARG H 1.0 . 3.6 246 228 A 45 ARG H A 44 PRO HGx 1.0 . 3.6 247 229 A 45 ARG H A 44 PRO HBx 1.0 . 5.8 248 229 A 45 ARG H A 44 PRO HBy 1.0 . 5.8 249 230 A 45 ARG H A 45 ARG HA 1.0 . 2.9 250 231 A 45 ARG H A 45 ARG HBy 1.0 . 5.4 251 231 A 45 ARG H A 45 ARG HBx 1.0 . 5.4 252 232 A 45 ARG H A 45 ARG HGx 1.0 . 5.4 253 232 A 45 ARG H A 45 ARG HGy 1.0 . 5.4 254 233 A 45 ARG H A 45 ARG HDx 1.0 . 4.0 255 234 A 45 ARG H A 45 ARG HDy 1.0 . 4.0 256 235 A 43 LYS HA A 45 ARG H 1.0 . 4.0 257 236 A 47 LEU H A 45 ARG H 1.0 . 4.8 258 237 A 45 ARG H A 48 TYR H 1.0 . 4.8 259 238 A 46 GLU H A 45 ARG HA 1.0 . 3.6 260 239 A 46 GLU H A 45 ARG H 1.0 . 2.8 261 240 A 46 GLU H A 45 ARG HBy 1.0 . 4.8 262 241 A 46 GLU H A 45 ARG HBx 1.0 . 4.8 263 242 A 46 GLU H A 45 ARG HDy 1.0 . 4.8 264 243 A 46 GLU H A 45 ARG HDx 1.0 . 5.4 265 244 A 46 GLU H A 46 GLU HA 1.0 . 2.9 266 245 A 46 GLU H A 46 GLU HBy 1.0 . 4.4 267 245 A 46 GLU H A 46 GLU HBx 1.0 . 4.4 268 246 A 46 GLU H A 46 GLU HGy 1.0 . 5.8 269 246 A 46 GLU H A 46 GLU HGx 1.0 . 5.8 270 247 A 46 GLU H A 44 PRO HA 1.0 . 5.0 271 248 A 46 GLU H A 48 TYR H 1.0 . 4.4 272 249 A 46 GLU H A 49 LEU H 1.0 . 5.2 273 250 A 47 LEU H A 46 GLU HA 1.0 . 3.6 274 251 A 46 GLU H A 47 LEU H 1.0 . 2.8 275 252 A 47 LEU H A 46 GLU HBy 1.0 . 5.4 276 252 A 47 LEU H A 46 GLU HBx 1.0 . 5.4 277 253 A 47 LEU H A 46 GLU HGy 1.0 . 5.8 278 253 A 47 LEU H A 46 GLU HGx 1.0 . 5.8 279 254 A 47 LEU H A 47 LEU HA 1.0 . 2.8 280 255 A 47 LEU H A 47 LEU HBx 1.0 . 4.6 281 255 A 47 LEU H A 47 LEU HBy 1.0 . 4.6 282 256 A 47 LEU H A 47 LEU HD21 1.0 . 6.8 283 257 A 47 LEU H A 47 LEU HD11 1.0 . 6.8 284 258 A 47 LEU H A 44 PRO HA 1.0 . 4.0 285 259 A 47 LEU H A 49 LEU H 1.0 . 4.4 286 260 A 48 TYR H A 47 LEU HA 1.0 . 3.6 287 261 A 47 LEU H A 48 TYR H 1.0 . 2.8 288 262 A 48 TYR H A 47 LEU HBx 1.0 . 5.4 289 262 A 48 TYR H A 47 LEU HBy 1.0 . 5.4 290 263 A 48 TYR H A 47 LEU HD11 1.0 . 6.4 291 264 A 48 TYR H A 47 LEU HD21 1.0 . 6.4 292 265 A 48 TYR H A 48 TYR HA 1.0 . 2.8 293 266 A 48 TYR H A 48 TYR HBx 1.0 . 5.4 294 266 A 48 TYR H A 48 TYR HBy 1.0 . 5.4 295 267 A 48 TYR H A 46 GLU HA 1.0 . 4.6 296 268 A 48 TYR H A 50 LEU H 1.0 . 4.2 297 269 A 49 LEU H A 48 TYR HA 1.0 . 3.6 298 270 A 48 TYR H A 49 LEU H 1.0 . 2.8 299 271 A 49 LEU H A 48 TYR HBx 1.0 . 5.4 300 271 A 49 LEU H A 48 TYR HBy 1.0 . 5.4 301 272 A 49 LEU H A 49 LEU HA 1.0 . 2.8 302 273 A 49 LEU H A 49 LEU HBy 1.0 . 4.4 303 274 A 49 LEU H A 49 LEU HBx 1.0 . 4.4 304 275 A 46 GLU HA A 49 LEU H 1.0 . 3.6 305 276 A 49 LEU H A 47 LEU HA 1.0 . 4.4 306 277 A 49 LEU H A 51 PHE H 1.0 . 4.2 307 278 A 50 LEU H A 49 LEU HA 1.0 . 3.6 308 279 A 49 LEU H A 50 LEU H 1.0 . 2.8 309 280 A 50 LEU H A 49 LEU HBy 1.0 . 4.6 310 281 A 50 LEU H A 49 LEU HBx 1.0 . 4.6 311 282 A 50 LEU H A 50 LEU HA 1.0 . 2.8 312 283 A 50 LEU H A 50 LEU HBy 1.0 . 4.4 313 284 A 50 LEU H A 50 LEU HBx 1.0 . 4.4 314 285 A 47 LEU HA A 50 LEU H 1.0 . 3.6 315 286 A 46 GLU HA A 50 LEU H 1.0 . 4.6 316 287 A 48 TYR HA A 50 LEU H 1.0 . 4.4 317 288 A 50 LEU H A 52 ARG H 1.0 . 4.2 318 289 A 51 PHE H A 50 LEU HA 1.0 . 3.6 319 290 A 50 LEU H A 51 PHE H 1.0 . 2.8 320 291 A 51 PHE H A 50 LEU HBy 1.0 . 4.6 321 292 A 51 PHE H A 50 LEU HBx 1.0 . 4.6 322 293 A 51 PHE H A 51 PHE HA 1.0 . 2.8 323 294 A 51 PHE H A 51 PHE HBy 1.0 . 5.4 324 294 A 51 PHE H A 51 PHE HBx 1.0 . 5.4 325 295 A 48 TYR HA A 51 PHE H 1.0 . 3.6 326 296 A 47 LEU HA A 51 PHE H 1.0 . 4.2 327 297 A 49 LEU HA A 51 PHE H 1.0 . 4.6 328 298 A 51 PHE H A 88 LEU HD11 1.0 . 6.4 329 299 A 52 ARG H A 51 PHE HA 1.0 . 3.6 330 300 A 51 PHE H A 52 ARG H 1.0 . 2.8 331 301 A 52 ARG H A 51 PHE HBy 1.0 . 5.4 332 301 A 52 ARG H A 51 PHE HBx 1.0 . 5.4 333 302 A 52 ARG H A 52 ARG HA 1.0 . 2.8 334 303 A 52 ARG H A 52 ARG HBx 1.0 . 5.4 335 303 A 52 ARG H A 52 ARG HBy 1.0 . 5.4 336 304 A 52 ARG H A 52 ARG HGx 1.0 . 5.4 337 304 A 52 ARG H A 52 ARG HGy 1.0 . 5.4 338 305 A 49 LEU HA A 52 ARG H 1.0 . 4.0 339 306 A 48 TYR HA A 52 ARG H 1.0 . 4.6 340 307 A 50 LEU HA A 52 ARG H 1.0 . 4.4 341 308 A 52 ARG H A 54 PHE H 1.0 . 5.0 342 309 A 52 ARG HA A 53 PRO HDx 1.0 . 4.8 343 310 A 52 ARG HA A 53 PRO HDy 1.0 . 4.8 344 311 A 52 ARG H A 53 PRO HDx 1.0 . 3.4 345 312 A 52 ARG H A 53 PRO HDy 1.0 . 4.4 346 313 A 54 PHE H A 53 PRO HA 1.0 . 3.6 347 314 A 54 PHE H A 53 PRO HDx 1.0 . 3.2 348 315 A 54 PHE H A 53 PRO HDy 1.0 . 5.0 349 316 A 54 PHE H A 54 PHE HA 1.0 . 2.8 350 317 A 54 PHE H A 54 PHE HBy 1.0 . 4.6 351 317 A 54 PHE H A 54 PHE HBx 1.0 . 4.6 352 318 A 52 ARG HA A 54 PHE H 1.0 . 4.4 353 319 A 51 PHE HA A 54 PHE H 1.0 . 4.4 354 320 A 54 PHE H A 56 GLY H 1.0 . 6.0 355 321 A 54 PHE H A 57 TYR H 1.0 . 5.8 356 322 A 54 PHE H A 57 TYR HBx 1.0 . 5.4 357 323 A 54 PHE H A 57 TYR HBy 1.0 . 5.4 358 324 A 51 PHE HBx A 54 PHE H 1.0 . 5.4 359 325 A 54 PHE H A 51 PHE HBy 1.0 . 5.4 360 326 A 88 LEU HD11 A 54 PHE H 1.0 . 6.4 361 327 A 54 PHE HA A 55 LYS H 1.0 . 2.2 362 328 A 54 PHE H A 55 LYS H 1.0 . 4.6 363 329 A 55 LYS H A 54 PHE HBy 1.0 . 5.8 364 329 A 54 PHE HBx A 55 LYS H 1.0 . 5.8 365 330 A 55 LYS H A 55 LYS HA 1.0 . 2.9 366 331 A 55 LYS H A 55 LYS HBy 1.0 . 4.0 367 331 A 55 LYS H A 55 LYS HBx 1.0 . 4.0 368 332 A 57 TYR H A 55 LYS H 1.0 . 5.0 369 333 A 56 GLY H A 55 LYS HA 1.0 . 2.4 370 334 A 56 GLY H A 55 LYS H 1.0 . 4.8 371 335 A 56 GLY H A 55 LYS HBy 1.0 . 4.8 372 336 A 56 GLY H A 55 LYS HBx 1.0 . 4.8 373 337 A 56 GLY H A 56 GLY HAx 1.0 . 2.8 374 338 A 56 GLY H A 56 GLY HAy 1.0 . 3.2 375 339 A 56 GLY H A 58 GLU H 1.0 . 6.0 376 340 A 56 GLY H A 76 ASP H 1.0 . 5.2 377 341 A 54 PHE HA A 56 GLY H 1.0 . 5.4 378 342 A 57 TYR H A 56 GLY HAx 1.0 . 3.6 379 343 A 57 TYR H A 56 GLY HAy 1.0 . 4.0 380 344 A 56 GLY H A 57 TYR H 1.0 . 2.8 381 345 A 57 TYR H A 57 TYR HA 1.0 . 2.8 382 346 A 57 TYR H A 57 TYR HBx 1.0 . 3.0 383 347 A 57 TYR H A 57 TYR HBy 1.0 . 3.4 384 348 A 57 TYR H A 76 ASP H 1.0 . 5.0 385 349 A 54 PHE HA A 57 TYR H 1.0 . 5.4 386 350 A 54 PHE HBx A 57 TYR H 1.0 . 5.4 387 351 A 57 TYR H A 54 PHE HBy 1.0 . 5.4 388 352 A 57 TYR H A 55 LYS HA 1.0 . 4.8 389 353 A 73 VAL HG11 A 57 TYR H 1.0 . 6.8 390 354 A 57 TYR H A 75 PHE HA 1.0 . 4.8 391 355 A 58 GLU H A 57 TYR HA 1.0 . 2.6 392 356 A 57 TYR H A 58 GLU H 1.0 . 4.8 393 357 A 58 GLU H A 57 TYR HBx 1.0 . 5.4 394 357 A 58 GLU H A 57 TYR HBy 1.0 . 5.4 395 358 A 58 GLU H A 58 GLU HA 1.0 . 2.9 396 359 A 58 GLU H A 58 GLU HBx 1.0 . 4.6 397 359 A 58 GLU H A 58 GLU HBy 1.0 . 4.6 398 360 A 58 GLU H A 58 GLU HGy 1.0 . 5.8 399 360 A 58 GLU H A 58 GLU HGx 1.0 . 5.8 400 361 A 74 ILE H A 58 GLU H 1.0 . 5.0 401 362 A 75 PHE H A 58 GLU H 1.0 . 5.4 402 363 A 58 GLU H A 76 ASP H 1.0 . 4.0 403 364 A 58 GLU H A 75 PHE HA 1.0 . 3.4 404 365 A 74 ILE HA A 58 GLU H 1.0 . 6.4 405 366 A 56 GLY HAx A 58 GLU H 1.0 . 6.0 406 367 A 56 GLY HAy A 58 GLU H 1.0 . 6.0 407 368 A 58 GLU H A 75 PHE HBx 1.0 . 6.0 408 369 A 58 GLU H A 75 PHE HBy 1.0 . 6.0 409 370 A 73 VAL HG11 A 58 GLU H 1.0 . 6.8 410 371 A 73 VAL HG21 A 58 GLU H 1.0 . 6.8 411 372 A 58 GLU HA A 59 GLY H 1.0 . 3.4 412 373 A 58 GLU H A 59 GLY H 1.0 . 2.6 413 374 A 59 GLY H A 58 GLU HBx 1.0 . 4.6 414 374 A 58 GLU HBy A 59 GLY H 1.0 . 4.6 415 375 A 59 GLY H A 58 GLU HGy 1.0 . 5.8 416 375 A 58 GLU HGx A 59 GLY H 1.0 . 5.8 417 376 A 59 GLY H A 59 GLY HAx 1.0 . 3.2 418 377 A 59 GLY H A 59 GLY HAy 1.0 . 3.2 419 378 A 74 ILE H A 59 GLY H 1.0 . 3.6 420 379 A 75 PHE H A 59 GLY H 1.0 . 5.4 421 380 A 76 ASP H A 59 GLY H 1.0 . 5.8 422 381 A 75 PHE HA A 59 GLY H 1.0 . 5.0 423 382 A 74 ILE HA A 59 GLY H 1.0 . 5.0 424 383 A 73 VAL HA A 59 GLY H 1.0 . 5.0 425 384 A 59 GLY H A 74 ILE HG21 1.0 . 5.4 426 385 A 73 VAL HG11 A 59 GLY H 1.0 . 6.8 427 386 A 73 VAL HG21 A 59 GLY H 1.0 . 6.8 428 387 A 59 GLY H A 112 MET HGy 1.0 . 6.4 429 388 A 59 GLY H A 112 MET HGx 1.0 . 6.4 430 389 A 59 GLY HAx A 60 SER H 1.0 . 2.6 431 390 A 59 GLY HAy A 60 SER H 1.0 . 3.4 432 391 A 59 GLY H A 60 SER H 1.0 . 4.4 433 392 A 60 SER H A 60 SER HA 1.0 . 3.0 434 393 A 60 SER H A 60 SER HBx 1.0 . 5.0 435 394 A 60 SER H A 60 SER HBy 1.0 . 5.0 436 395 A 74 ILE H A 60 SER H 1.0 . 5.4 437 396 A 73 VAL HA A 60 SER H 1.0 . 5.0 438 397 A 73 VAL HG11 A 60 SER H 1.0 . 6.8 439 398 A 73 VAL HG21 A 60 SER H 1.0 . 6.8 440 399 A 112 MET HGx A 60 SER H 1.0 . 6.0 441 400 A 112 MET HGy A 60 SER H 1.0 . 6.0 442 401 A 60 SER HA A 61 LEU H 1.0 . 2.4 443 402 A 60 SER H A 61 LEU H 1.0 . 4.6 444 403 A 60 SER HBx A 61 LEU H 1.0 . 4.0 445 404 A 60 SER HBy A 61 LEU H 1.0 . 4.0 446 405 A 61 LEU H A 61 LEU HA 1.0 . 3.0 447 406 A 61 LEU H A 61 LEU HBy 1.0 . 3.6 448 407 A 61 LEU H A 61 LEU HBx 1.0 . 3.6 449 408 A 72 PHE H A 61 LEU H 1.0 . 3.6 450 409 A 73 VAL H A 61 LEU H 1.0 . 5.2 451 410 A 74 ILE H A 61 LEU H 1.0 . 5.0 452 411 A 73 VAL HA A 61 LEU H 1.0 . 4.0 453 412 A 72 PHE HA A 61 LEU H 1.0 . 5.0 454 413 A 71 GLY HAx A 61 LEU H 1.0 . 5.2 455 414 A 71 GLY HAy A 61 LEU H 1.0 . 5.2 456 415 A 61 LEU H A 72 PHE HBx 1.0 . 5.0 457 416 A 61 LEU H A 72 PHE HBy 1.0 . 5.0 458 417 A 73 VAL HG11 A 61 LEU H 1.0 . 6.8 459 418 A 73 VAL HG21 A 61 LEU H 1.0 . 6.8 460 419 A 61 LEU HA A 62 ILE H 1.0 . 2.6 461 420 A 61 LEU H A 62 ILE H 1.0 . 4.8 462 421 A 61 LEU HBy A 62 ILE H 1.0 . 4.4 463 422 A 61 LEU HBx A 62 ILE H 1.0 . 4.4 464 423 A 62 ILE H A 62 ILE HA 1.0 . 3.0 465 424 A 62 ILE H A 62 ILE HB 1.0 . 3.6 466 425 A 62 ILE H A 62 ILE HD11 1.0 . 5.8 467 426 A 62 ILE H A 62 ILE HG21 1.0 . 5.8 468 427 A 72 PHE H A 62 ILE H 1.0 . 5.0 469 428 A 71 GLY HAx A 62 ILE H 1.0 . 5.0 470 429 A 71 GLY HAy A 62 ILE H 1.0 . 5.8 471 430 A 62 ILE HA A 63 LYS H 1.0 . 2.4 472 431 A 62 ILE H A 63 LYS H 1.0 . 4.8 473 432 A 62 ILE HG21 A 63 LYS H 1.0 . 5.4 474 433 A 63 LYS H A 63 LYS HA 1.0 . 3.0 475 434 A 63 LYS H A 63 LYS HBy 1.0 . 4.0 476 435 A 63 LYS H A 63 LYS HBx 1.0 . 4.0 477 436 A 63 LYS H A 70 VAL H 1.0 . 3.2 478 437 A 71 GLY H A 63 LYS H 1.0 . 5.0 479 438 A 72 PHE H A 63 LYS H 1.0 . 5.0 480 439 A 63 LYS H A 72 PHE HE% 1.0 . 7.0 481 440 A 63 LYS H A 72 PHE HD% 1.0 . 7.0 482 441 A 71 GLY HAx A 63 LYS H 1.0 . 4.0 483 442 A 71 GLY HAy A 63 LYS H 1.0 . 4.8 484 443 A 70 VAL HA A 63 LYS H 1.0 . 5.8 485 444 A 63 LYS H A 65 THR H 1.0 . 6.0 486 445 A 63 LYS HA A 64 LEU H 1.0 . 2.6 487 446 A 63 LYS H A 64 LEU H 1.0 . 4.6 488 447 A 63 LYS HBy A 64 LEU H 1.0 . 4.4 489 448 A 63 LYS HBx A 64 LEU H 1.0 . 4.4 490 449 A 64 LEU H A 64 LEU HA 1.0 . 3.0 491 450 A 64 LEU H A 64 LEU HBx 1.0 . 4.6 492 450 A 64 LEU H A 64 LEU HBy 1.0 . 4.6 493 451 A 70 VAL H A 64 LEU H 1.0 . 5.0 494 452 A 64 LEU H A 69 PRO HA 1.0 . 4.8 495 453 A 65 THR H A 64 LEU HA 1.0 . 2.8 496 454 A 65 THR H A 64 LEU H 1.0 . 4.6 497 455 A 65 THR H A 64 LEU HBx 1.0 . 5.4 498 455 A 65 THR H A 64 LEU HBy 1.0 . 5.4 499 456 A 65 THR H A 65 THR HA 1.0 . 2.8 500 457 A 65 THR H A 65 THR HB 1.0 . 3.4 501 458 A 65 THR H A 65 THR HG21 1.0 . 5.8 502 459 A 70 VAL H A 65 THR H 1.0 . 4.0 503 460 A 65 THR H A 68 GLN H 1.0 . 4.0 504 461 A 65 THR H A 69 PRO HA 1.0 . 3.6 505 462 A 65 THR H A 67 ARG HA 1.0 . 6.4 506 463 A 69 PRO HDx A 65 THR H 1.0 . 6.0 507 464 A 69 PRO HDy A 65 THR H 1.0 . 6.0 508 465 A 68 GLN HGx A 65 THR H 1.0 . 5.8 509 466 A 65 THR HA A 66 ALA H 1.0 . 2.8 510 467 A 65 THR H A 66 ALA H 1.0 . 4.8 511 468 A 65 THR HB A 66 ALA H 1.0 . 3.6 512 469 A 65 THR HG21 A 66 ALA H 1.0 . 6.4 513 470 A 66 ALA H A 66 ALA HA 1.0 . 2.8 514 471 A 66 ALA H A 66 ALA HB1 1.0 . 5.8 515 472 A 68 GLN H A 66 ALA H 1.0 . 4.8 516 473 A 66 ALA HA A 67 ARG H 1.0 . 3.6 517 474 A 66 ALA H A 67 ARG H 1.0 . 3.0 518 475 A 66 ALA HB1 A 67 ARG H 1.0 . 4.4 519 476 A 66 ALA HB1 A 67 ARG H 1.0 . 4.4 520 477 A 67 ARG HA A 67 ARG H 1.0 . 2.8 521 478 A 67 ARG H A 67 ARG HBx 1.0 . 5.0 522 478 A 67 ARG H A 67 ARG HBy 1.0 . 5.0 523 479 A 67 ARG H A 67 ARG HGx 1.0 . 5.0 524 479 A 67 ARG H A 67 ARG HGy 1.0 . 5.0 525 480 A 65 THR HA A 67 ARG H 1.0 . 4.4 526 481 A 65 THR HB A 67 ARG H 1.0 . 4.4 527 482 A 65 THR HG21 A 67 ARG H 1.0 . 6.4 528 483 A 68 GLN H A 67 ARG HA 1.0 . 3.4 529 484 A 68 GLN H A 67 ARG H 1.0 . 3.2 530 485 A 68 GLN H A 67 ARG HBx 1.0 . 4.6 531 485 A 68 GLN H A 67 ARG HBy 1.0 . 4.6 532 486 A 68 GLN H A 67 ARG HGx 1.0 . 5.8 533 486 A 68 GLN H A 67 ARG HGy 1.0 . 5.8 534 487 A 68 GLN HA A 68 GLN H 1.0 . 3.0 535 488 A 68 GLN H A 68 GLN HBx 1.0 . 5.0 536 488 A 68 GLN H A 68 GLN HBy 1.0 . 5.0 537 489 A 68 GLN H A 68 GLN HGy 1.0 . 5.4 538 489 A 68 GLN HGx A 68 GLN H 1.0 . 5.4 539 490 A 70 VAL H A 68 GLN H 1.0 . 5.8 540 491 A 65 THR HA A 68 GLN H 1.0 . 4.8 541 492 A 65 THR HB A 68 GLN H 1.0 . 4.4 542 493 A 65 THR HG21 A 68 GLN H 1.0 . 6.4 543 494 A 68 GLN H A 64 LEU HD11 1.0 . 6.4 544 495 A 68 GLN H A 64 LEU HD21 1.0 . 6.4 545 496 A 40 VAL HG21 A 68 GLN H 1.0 . 7.4 546 497 A 69 PRO HDx A 68 GLN H 1.0 . 4.8 547 498 A 69 PRO HDy A 68 GLN H 1.0 . 4.8 548 499 A 68 GLN HA A 69 PRO HDx 1.0 . 3.0 549 500 A 68 GLN HA A 69 PRO HDy 1.0 . 3.0 550 501 A 70 VAL H A 69 PRO HA 1.0 . 2.4 551 502 A 69 PRO HDx A 70 VAL H 1.0 . 5.4 552 503 A 69 PRO HDy A 70 VAL H 1.0 . 5.4 553 504 A 70 VAL HA A 70 VAL H 1.0 . 3.0 554 505 A 70 VAL H A 70 VAL HB 1.0 . 4.4 555 506 A 70 VAL H A 70 VAL HG21 1.0 . 5.8 556 507 A 70 VAL H A 70 VAL HG11 1.0 . 6.0 557 508 A 70 VAL H A 64 LEU HA 1.0 . 4.0 558 509 A 63 LYS HA A 70 VAL H 1.0 . 5.4 559 510 A 68 GLN HGx A 70 VAL H 1.0 . 6.0 560 511 A 70 VAL H A 68 GLN HGy 1.0 . 6.0 561 512 A 70 VAL H A 38 LEU HD21 1.0 . 7.4 562 512 A 70 VAL H A 38 LEU HD11 1.0 . 7.4 563 513 A 70 VAL H A 65 THR HB 1.0 . 6.4 564 514 A 70 VAL H A 65 THR HG21 1.0 . 6.4 565 515 A 71 GLY H A 70 VAL HA 1.0 . 2.6 566 516 A 71 GLY H A 70 VAL H 1.0 . 4.8 567 517 A 71 GLY H A 70 VAL HB 1.0 . 3.0 568 518 A 71 GLY H A 70 VAL HG11 1.0 . 5.4 569 519 A 71 GLY H A 70 VAL HG21 1.0 . 6.4 570 520 A 71 GLY H A 71 GLY HAy 1.0 . 3.0 571 521 A 71 GLY H A 71 GLY HAx 1.0 . 3.0 572 522 A 71 GLY H A 36 SER HA 1.0 . 4.0 573 523 A 35 VAL HA A 71 GLY H 1.0 . 5.2 574 524 A 34 PHE HA A 71 GLY H 1.0 . 5.2 575 525 A 71 GLY H A 62 ILE HA 1.0 . 5.2 576 526 A 71 GLY H A 36 SER HBx 1.0 . 5.8 577 527 A 71 GLY H A 36 SER HBy 1.0 . 5.2 578 528 A 34 PHE HBx A 71 GLY H 1.0 . 5.8 579 529 A 34 PHE HBy A 71 GLY H 1.0 . 6.2 580 530 A 71 GLY H A 38 LEU HD21 1.0 . 6.4 581 530 A 71 GLY H A 38 LEU HD11 1.0 . 6.4 582 531 A 72 PHE H A 71 GLY HAx 1.0 . 2.6 583 532 A 72 PHE H A 71 GLY HAy 1.0 . 3.2 584 533 A 71 GLY H A 72 PHE H 1.0 . 4.8 585 534 A 72 PHE HA A 72 PHE H 1.0 . 3.0 586 535 A 72 PHE H A 72 PHE HBy 1.0 . 4.0 587 535 A 72 PHE H A 72 PHE HBx 1.0 . 4.0 588 536 A 72 PHE H A 62 ILE HA 1.0 . 3.6 589 537 A 72 PHE H A 61 LEU HA 1.0 . 5.0 590 538 A 72 PHE H A 60 SER HA 1.0 . 5.0 591 539 A 72 PHE H A 60 SER HBx 1.0 . 5.8 592 540 A 72 PHE H A 60 SER HBy 1.0 . 5.8 593 541 A 72 PHE H A 61 LEU HD11 1.0 . 6.4 594 542 A 72 PHE H A 61 LEU HD21 1.0 . 6.4 595 543 A 72 PHE H A 62 ILE HG21 1.0 . 6.4 596 544 A 73 VAL H A 72 PHE HA 1.0 . 2.4 597 545 A 73 VAL H A 72 PHE H 1.0 . 4.8 598 546 A 73 VAL H A 72 PHE HBy 1.0 . 4.6 599 546 A 73 VAL H A 72 PHE HBx 1.0 . 4.6 600 547 A 73 VAL H A 73 VAL HA 1.0 . 3.0 601 548 A 73 VAL H A 73 VAL HB 1.0 . 3.6 602 549 A 73 VAL H A 73 VAL HG21 1.0 . 5.4 603 550 A 73 VAL H A 73 VAL HG11 1.0 . 6.4 604 551 A 73 VAL H A 57 TYR HE% 1.0 . 7.4 605 552 A 73 VAL H A 34 PHE HA 1.0 . 4.0 606 553 A 33 LEU HA A 73 VAL H 1.0 . 5.0 607 554 A 73 VAL H A 60 SER HBx 1.0 . 5.8 608 555 A 73 VAL H A 60 SER HBy 1.0 . 5.8 609 556 A 32 THR HG21 A 73 VAL H 1.0 . 6.0 610 557 A 73 VAL H A 33 LEU HD21 1.0 . 6.8 611 558 A 74 ILE H A 73 VAL HA 1.0 . 2.4 612 559 A 73 VAL H A 74 ILE H 1.0 . 4.8 613 560 A 74 ILE H A 73 VAL HB 1.0 . 4.4 614 561 A 74 ILE H A 73 VAL HG11 1.0 . 5.8 615 562 A 74 ILE H A 73 VAL HG21 1.0 . 6.8 616 563 A 74 ILE HA A 74 ILE H 1.0 . 3.0 617 564 A 74 ILE H A 74 ILE HG21 1.0 . 5.4 618 565 A 74 ILE H A 74 ILE HD11 1.0 . 6.4 619 566 A 74 ILE H A 60 SER HA 1.0 . 3.4 620 567 A 74 ILE H A 59 GLY HAx 1.0 . 5.4 621 568 A 74 ILE H A 59 GLY HAy 1.0 . 5.4 622 569 A 74 ILE H A 60 SER HBx 1.0 . 5.8 623 570 A 74 ILE H A 60 SER HBy 1.0 . 5.8 624 571 A 74 ILE H A 58 GLU HGy 1.0 . 5.8 625 571 A 74 ILE H A 58 GLU HGx 1.0 . 5.8 626 572 A 74 ILE HA A 75 PHE H 1.0 . 2.4 627 573 A 74 ILE H A 75 PHE H 1.0 . 4.8 628 574 A 75 PHE H A 74 ILE HB 1.0 . 4.4 629 575 A 75 PHE H A 74 ILE HG21 1.0 . 5.8 630 576 A 75 PHE H A 74 ILE HD11 1.0 . 6.8 631 577 A 75 PHE H A 75 PHE HA 1.0 . 3.0 632 578 A 75 PHE H A 75 PHE HBx 1.0 . 5.0 633 579 A 75 PHE H A 75 PHE HBy 1.0 . 5.0 634 580 A 75 PHE H A 77 SER H 1.0 . 5.4 635 581 A 32 THR HA A 75 PHE H 1.0 . 4.8 636 582 A 75 PHE H A 81 ALA HA 1.0 . 6.4 637 583 A 75 PHE H A 81 ALA HB1 1.0 . 6.8 638 584 A 76 ASP H A 75 PHE HA 1.0 . 2.6 639 585 A 75 PHE H A 76 ASP H 1.0 . 4.8 640 586 A 76 ASP H A 75 PHE HBy 1.0 . 5.8 641 586 A 76 ASP H A 75 PHE HBx 1.0 . 5.8 642 587 A 76 ASP H A 76 ASP HA 1.0 . 3.0 643 588 A 76 ASP H A 76 ASP HBx 1.0 . 4.0 644 589 A 76 ASP H A 76 ASP HBy 1.0 . 4.0 645 590 A 74 ILE HA A 76 ASP H 1.0 . 6.4 646 591 A 56 GLY HAx A 76 ASP H 1.0 . 4.0 647 592 A 56 GLY HAy A 76 ASP H 1.0 . 4.0 648 593 A 76 ASP H A 58 GLU HGx 1.0 . 4.4 649 594 A 76 ASP H A 58 GLU HGy 1.0 . 4.4 650 595 A 77 SER H A 76 ASP HA 1.0 . 3.6 651 596 A 76 ASP H A 77 SER H 1.0 . 2.8 652 597 A 77 SER H A 76 ASP HBx 1.0 . 4.0 653 598 A 77 SER H A 76 ASP HBy 1.0 . 4.0 654 599 A 77 SER H A 77 SER HA 1.0 . 2.8 655 600 A 77 SER H A 77 SER HBy 1.0 . 4.0 656 601 A 77 SER H A 77 SER HBx 1.0 . 4.0 657 602 A 77 SER H A 79 ALA H 1.0 . 5.0 658 603 A 77 SER H A 80 GLY H 1.0 . 4.8 659 604 A 77 SER H A 81 ALA H 1.0 . 4.8 660 605 A 77 SER H A 80 GLY HAy 1.0 . 4.4 661 606 A 77 SER H A 75 PHE HBx 1.0 . 3.4 662 607 A 77 SER H A 75 PHE HBy 1.0 . 3.4 663 608 A 75 PHE HA A 77 SER H 1.0 . 4.4 664 609 A 77 SER H A 81 ALA HA 1.0 . 6.0 665 610 A 77 SER H A 81 ALA HB1 1.0 . 6.2 666 611 A 77 SER H A 31 ARG HGx 1.0 . 6.4 667 611 A 31 ARG HGy A 77 SER H 1.0 . 6.4 668 612 A 77 SER HA A 78 ARG H 1.0 . 2.4 669 613 A 77 SER H A 78 ARG H 1.0 . 4.8 670 614 A 77 SER HBy A 78 ARG H 1.0 . 3.6 671 615 A 77 SER HBx A 78 ARG H 1.0 . 3.6 672 616 A 78 ARG H A 78 ARG HA 1.0 . 2.9 673 617 A 78 ARG H A 78 ARG HBy 1.0 . 4.6 674 617 A 78 ARG H A 78 ARG HBx 1.0 . 4.6 675 618 A 78 ARG H A 78 ARG HGx 1.0 . 5.8 676 618 A 78 ARG H A 78 ARG HGy 1.0 . 5.8 677 619 A 80 GLY H A 78 ARG H 1.0 . 4.8 678 620 A 81 ALA H A 78 ARG H 1.0 . 4.8 679 621 A 78 ARG H A 29 GLU HGx 1.0 . 6.4 680 621 A 78 ARG H A 29 GLU HGy 1.0 . 6.4 681 622 A 79 ALA H A 78 ARG HA 1.0 . 3.6 682 623 A 79 ALA H A 78 ARG H 1.0 . 2.8 683 624 A 79 ALA H A 78 ARG HBy 1.0 . 4.4 684 625 A 79 ALA H A 78 ARG HBx 1.0 . 4.4 685 626 A 79 ALA H A 78 ARG HGx 1.0 . 6.0 686 626 A 79 ALA H A 78 ARG HGy 1.0 . 6.0 687 627 A 79 ALA H A 79 ALA HA 1.0 . 2.8 688 628 A 79 ALA H A 79 ALA HB1 1.0 . 5.4 689 629 A 79 ALA H A 81 ALA H 1.0 . 5.0 690 630 A 79 ALA H A 82 GLU H 1.0 . 5.0 691 631 A 77 SER HA A 79 ALA H 1.0 . 4.4 692 632 A 79 ALA H A 82 GLU HGx 1.0 . 6.0 693 632 A 79 ALA H A 82 GLU HGy 1.0 . 6.0 694 633 A 79 ALA H A 82 GLU HBx 1.0 . 6.0 695 633 A 79 ALA H A 82 GLU HBy 1.0 . 6.0 696 634 A 80 GLY H A 79 ALA HA 1.0 . 3.6 697 635 A 79 ALA H A 80 GLY H 1.0 . 2.8 698 636 A 80 GLY H A 79 ALA HB1 1.0 . 5.8 699 637 A 80 GLY H A 80 GLY HAy 1.0 . 3.8 700 637 A 80 GLY H A 80 GLY HAx 1.0 . 3.8 701 638 A 80 GLY H A 78 ARG HA 1.0 . 4.4 702 639 A 78 ARG HDx A 80 GLY H 1.0 . 5.8 703 640 A 78 ARG HDy A 80 GLY H 1.0 . 5.4 704 641 A 80 GLY H A 82 GLU H 1.0 . 5.0 705 642 A 80 GLY H A 83 ALA H 1.0 . 5.0 706 643 A 80 GLY H A 84 ALA H 1.0 . 6.0 707 644 A 81 ALA H A 80 GLY HAy 1.0 . 4.6 708 644 A 81 ALA H A 80 GLY HAx 1.0 . 4.6 709 645 A 80 GLY H A 81 ALA H 1.0 . 2.8 710 646 A 81 ALA HA A 81 ALA H 1.0 . 2.8 711 647 A 81 ALA HB1 A 81 ALA H 1.0 . 5.8 712 648 A 81 ALA H A 78 ARG HA 1.0 . 3.6 713 649 A 81 ALA H A 79 ALA HA 1.0 . 4.8 714 650 A 75 PHE HBx A 81 ALA H 1.0 . 5.0 715 651 A 81 ALA H A 75 PHE HBy 1.0 . 5.0 716 652 A 81 ALA H A 79 ALA HB1 1.0 . 6.4 717 653 A 81 ALA H A 33 LEU HD11 1.0 . 6.4 718 654 A 81 ALA H A 83 ALA H 1.0 . 4.2 719 655 A 81 ALA HA A 82 GLU H 1.0 . 3.6 720 656 A 81 ALA H A 82 GLU H 1.0 . 2.8 721 657 A 81 ALA HB1 A 82 GLU H 1.0 . 5.8 722 658 A 82 GLU H A 82 GLU HA 1.0 . 2.8 723 659 A 82 GLU H A 82 GLU HBx 1.0 . 5.4 724 659 A 82 GLU H A 82 GLU HBy 1.0 . 5.4 725 660 A 79 ALA HA A 82 GLU H 1.0 . 4.4 726 661 A 78 ARG HA A 82 GLU H 1.0 . 4.2 727 662 A 82 GLU H A 80 GLY HAx 1.0 . 4.6 728 663 A 82 GLU H A 84 ALA H 1.0 . 4.2 729 664 A 83 ALA H A 82 GLU HA 1.0 . 3.6 730 665 A 82 GLU H A 83 ALA H 1.0 . 2.8 731 666 A 83 ALA H A 82 GLU HBx 1.0 . 5.8 732 666 A 82 GLU HBy A 83 ALA H 1.0 . 5.8 733 667 A 83 ALA H A 83 ALA HA 1.0 . 2.8 734 668 A 83 ALA H A 83 ALA HB1 1.0 . 3.8 735 669 A 80 GLY HAx A 83 ALA H 1.0 . 3.8 736 670 A 79 ALA HA A 83 ALA H 1.0 . 5.4 737 671 A 81 ALA HA A 83 ALA H 1.0 . 4.4 738 672 A 83 ALA H A 85 LYS H 1.0 . 4.2 739 673 A 84 ALA H A 83 ALA HA 1.0 . 3.6 740 674 A 83 ALA H A 84 ALA H 1.0 . 2.8 741 675 A 84 ALA H A 83 ALA HB1 1.0 . 5.8 742 676 A 84 ALA H A 84 ALA HA 1.0 . 2.8 743 677 A 84 ALA H A 84 ALA HB1 1.0 . 5.4 744 678 A 81 ALA HA A 84 ALA H 1.0 . 3.5 745 679 A 80 GLY HAx A 84 ALA H 1.0 . 4.6 746 680 A 84 ALA H A 82 GLU HA 1.0 . 4.4 747 681 A 84 ALA H A 86 ASN H 1.0 . 4.2 748 682 A 85 LYS H A 84 ALA HA 1.0 . 3.6 749 683 A 84 ALA H A 85 LYS H 1.0 . 2.8 750 684 A 85 LYS H A 84 ALA HB1 1.0 . 5.8 751 685 A 85 LYS H A 85 LYS HA 1.0 . 2.8 752 686 A 85 LYS H A 85 LYS HBx 1.0 . 5.0 753 686 A 85 LYS H A 85 LYS HBy 1.0 . 5.0 754 687 A 85 LYS H A 85 LYS HGx 1.0 . 5.8 755 687 A 85 LYS H A 85 LYS HGy 1.0 . 5.8 756 688 A 82 GLU HA A 85 LYS H 1.0 . 4.0 757 689 A 81 ALA HA A 85 LYS H 1.0 . 4.2 758 690 A 83 ALA HA A 85 LYS H 1.0 . 4.4 759 691 A 85 LYS H A 87 ALA H 1.0 . 4.2 760 692 A 86 ASN H A 85 LYS HA 1.0 . 3.6 761 693 A 85 LYS H A 86 ASN H 1.0 . 2.8 762 694 A 86 ASN H A 85 LYS HBx 1.0 . 5.4 763 694 A 86 ASN H A 85 LYS HBy 1.0 . 5.4 764 695 A 86 ASN H A 85 LYS HGx 1.0 . 5.8 765 695 A 86 ASN H A 85 LYS HGy 1.0 . 5.8 766 696 A 86 ASN H A 86 ASN HA 1.0 . 2.8 767 697 A 86 ASN H A 86 ASN HBy 1.0 . 5.4 768 697 A 86 ASN H A 86 ASN HBx 1.0 . 5.4 769 698 A 83 ALA HA A 86 ASN H 1.0 . 3.5 770 699 A 82 GLU HA A 86 ASN H 1.0 . 4.8 771 700 A 84 ALA HA A 86 ASN H 1.0 . 4.4 772 701 A 86 ASN H A 88 LEU H 1.0 . 4.2 773 702 A 87 ALA H A 86 ASN HA 1.0 . 3.6 774 703 A 86 ASN H A 87 ALA H 1.0 . 2.8 775 704 A 87 ALA H A 86 ASN HBy 1.0 . 5.4 776 704 A 87 ALA H A 86 ASN HBx 1.0 . 5.4 777 705 A 87 ALA H A 87 ALA HA 1.0 . 2.8 778 706 A 87 ALA H A 87 ALA HB1 1.0 . 5.4 779 707 A 84 ALA HA A 87 ALA H 1.0 . 3.5 780 708 A 83 ALA HA A 87 ALA H 1.0 . 4.8 781 709 A 85 LYS HA A 87 ALA H 1.0 . 4.4 782 710 A 87 ALA H A 89 ASN H 1.0 . 4.6 783 711 A 88 LEU H A 87 ALA HA 1.0 . 3.6 784 712 A 87 ALA H A 88 LEU H 1.0 . 2.8 785 713 A 88 LEU H A 87 ALA HB1 1.0 . 5.8 786 714 A 88 LEU H A 88 LEU HA 1.0 . 2.8 787 715 A 88 LEU H A 88 LEU HBy 1.0 . 3.6 788 716 A 88 LEU H A 88 LEU HBx 1.0 . 3.6 789 717 A 85 LYS HA A 88 LEU H 1.0 . 3.5 790 718 A 84 ALA HA A 88 LEU H 1.0 . 4.8 791 719 A 86 ASN HA A 88 LEU H 1.0 . 4.6 792 720 A 89 ASN H A 88 LEU HA 1.0 . 3.6 793 721 A 88 LEU H A 89 ASN H 1.0 . 2.8 794 722 A 89 ASN H A 88 LEU HBy 1.0 . 4.6 795 723 A 89 ASN H A 88 LEU HBx 1.0 . 4.6 796 724 A 89 ASN H A 89 ASN HA 1.0 . 2.8 797 725 A 89 ASN H A 89 ASN HBy 1.0 . 4.0 798 725 A 89 ASN H A 89 ASN HBx 1.0 . 4.0 799 726 A 86 ASN HA A 89 ASN H 1.0 . 4.4 800 727 A 85 LYS HA A 89 ASN H 1.0 . 5.0 801 728 A 103 LEU H A 89 ASN H 1.0 . 5.0 802 729 A 102 ARG HA A 89 ASN H 1.0 . 5.2 803 730 A 89 ASN HA A 90 GLY H 1.0 . 2.6 804 731 A 89 ASN H A 90 GLY H 1.0 . 4.6 805 732 A 90 GLY H A 89 ASN HBy 1.0 . 5.4 806 732 A 89 ASN HBx A 90 GLY H 1.0 . 5.4 807 733 A 90 GLY H A 90 GLY HAx 1.0 . 2.8 808 734 A 90 GLY H A 90 GLY HAy 1.0 . 3.0 809 735 A 90 GLY H A 101 LEU H 1.0 . 4.4 810 736 A 103 LEU H A 90 GLY H 1.0 . 4.0 811 737 A 102 ARG H A 90 GLY H 1.0 . 5.0 812 738 A 90 GLY H A 92 ARG H 1.0 . 5.8 813 739 A 102 ARG HA A 90 GLY H 1.0 . 4.6 814 740 A 90 GLY H A 100 THR HA 1.0 . 6.4 815 741 A 90 GLY H A 100 THR HB 1.0 . 5.2 816 742 A 90 GLY HAx A 91 ILE H 1.0 . 3.0 817 743 A 90 GLY HAy A 91 ILE H 1.0 . 3.6 818 744 A 90 GLY H A 91 ILE H 1.0 . 2.6 819 745 A 91 ILE H A 91 ILE HA 1.0 . 2.8 820 746 A 91 ILE H A 91 ILE HB 1.0 . 3.6 821 747 A 91 ILE H A 91 ILE HG1x 1.0 . 4.4 822 748 A 91 ILE H A 91 ILE HG1y 1.0 . 4.4 823 749 A 91 ILE H A 91 ILE HD11 1.0 . 6.8 824 750 A 91 ILE H A 91 ILE HG21 1.0 . 5.8 825 751 A 101 LEU H A 91 ILE H 1.0 . 4.0 826 752 A 102 ARG H A 91 ILE H 1.0 . 6.0 827 753 A 102 ARG HA A 91 ILE H 1.0 . 5.8 828 754 A 100 THR HA A 91 ILE H 1.0 . 5.4 829 755 A 100 THR HB A 91 ILE H 1.0 . 5.0 830 756 A 89 ASN HBx A 91 ILE H 1.0 . 5.8 831 757 A 91 ILE H A 89 ASN HBy 1.0 . 5.8 832 758 A 92 ARG H A 91 ILE HA 1.0 . 2.6 833 759 A 92 ARG H A 91 ILE H 1.0 . 4.8 834 760 A 92 ARG H A 91 ILE HB 1.0 . 4.4 835 761 A 92 ARG H A 91 ILE HG21 1.0 . 5.8 836 762 A 92 ARG H A 92 ARG HA 1.0 . 2.9 837 763 A 92 ARG H A 92 ARG HBx 1.0 . 5.4 838 763 A 92 ARG H A 92 ARG HBy 1.0 . 5.4 839 764 A 92 ARG H A 92 ARG HGx 1.0 . 5.4 840 764 A 92 ARG H A 92 ARG HGy 1.0 . 5.4 841 765 A 92 ARG H A 92 ARG HDx 1.0 . 4.8 842 766 A 92 ARG H A 92 ARG HDy 1.0 . 4.8 843 767 A 101 LEU H A 92 ARG H 1.0 . 5.4 844 768 A 92 ARG H A 94 ASP H 1.0 . 5.4 845 769 A 92 ARG H A 100 THR HA 1.0 . 5.4 846 770 A 92 ARG H A 100 THR HB 1.0 . 4.8 847 771 A 92 ARG H A 100 THR HG21 1.0 . 6.4 848 772 A 92 ARG HA A 93 PHE H 1.0 . 3.4 849 773 A 92 ARG H A 93 PHE H 1.0 . 4.4 850 774 A 93 PHE H A 92 ARG HBx 1.0 . 5.8 851 774 A 92 ARG HBy A 93 PHE H 1.0 . 5.8 852 775 A 93 PHE H A 92 ARG HGx 1.0 . 5.8 853 775 A 92 ARG HGy A 93 PHE H 1.0 . 5.8 854 776 A 93 PHE H A 93 PHE HA 1.0 . 2.9 855 777 A 93 PHE H A 93 PHE HBx 1.0 . 4.4 856 778 A 93 PHE H A 93 PHE HBy 1.0 . 4.4 857 779 A 101 LEU H A 93 PHE H 1.0 . 5.0 858 780 A 100 THR HA A 93 PHE H 1.0 . 4.8 859 781 A 100 THR HB A 93 PHE H 1.0 . 5.0 860 782 A 100 THR HG21 A 93 PHE H 1.0 . 6.8 861 783 A 94 ASP H A 93 PHE HA 1.0 . 3.6 862 784 A 94 ASP H A 93 PHE H 1.0 . 2.8 863 785 A 94 ASP H A 93 PHE HBx 1.0 . 4.0 864 786 A 94 ASP H A 93 PHE HBy 1.0 . 4.0 865 787 A 94 ASP H A 94 ASP HA 1.0 . 3.0 866 788 A 94 ASP H A 94 ASP HBx 1.0 . 4.4 867 789 A 94 ASP H A 94 ASP HBy 1.0 . 4.4 868 790 A 101 LEU H A 94 ASP H 1.0 . 6.2 869 791 A 94 ASP H A 97 ASN H 1.0 . 5.0 870 792 A 94 ASP H A 96 GLU H 1.0 . 5.4 871 793 A 94 ASP H A 92 ARG HBx 1.0 . 5.4 872 793 A 92 ARG HBy A 94 ASP H 1.0 . 5.4 873 794 A 100 THR HA A 94 ASP H 1.0 . 5.8 874 795 A 94 ASP H A 100 THR HG21 1.0 . 6.8 875 796 A 92 ARG HA A 94 ASP H 1.0 . 3.8 876 797 A 94 ASP H A 97 ASN HBx 1.0 . 5.4 877 798 A 94 ASP H A 97 ASN HBy 1.0 . 5.4 878 799 A 94 ASP H A 92 ARG HGx 1.0 . 5.8 879 799 A 92 ARG HGy A 94 ASP H 1.0 . 5.8 880 800 A 94 ASP H A 92 ARG HBx 1.0 . 5.8 881 800 A 92 ARG HBy A 94 ASP H 1.0 . 5.8 882 801 A 94 ASP H A 95 PRO HDx 1.0 . 5.0 883 802 A 94 ASP H A 95 PRO HDy 1.0 . 5.0 884 803 A 94 ASP HA A 95 PRO HDx 1.0 . 3.0 885 804 A 94 ASP HA A 95 PRO HDy 1.0 . 3.0 886 805 A 96 GLU H A 95 PRO HA 1.0 . 3.6 887 806 A 96 GLU H A 95 PRO HDx 1.0 . 3.6 888 807 A 96 GLU H A 95 PRO HDy 1.0 . 4.0 889 808 A 96 GLU H A 96 GLU HA 1.0 . 2.8 890 809 A 96 GLU H A 96 GLU HBx 1.0 . 4.6 891 809 A 96 GLU H A 96 GLU HBy 1.0 . 4.6 892 810 A 96 GLU H A 96 GLU HGx 1.0 . 4.6 893 810 A 96 GLU H A 96 GLU HGy 1.0 . 4.6 894 811 A 94 ASP HA A 96 GLU H 1.0 . 4.8 895 812 A 94 ASP HBx A 96 GLU H 1.0 . 4.8 896 813 A 94 ASP HBy A 96 GLU H 1.0 . 4.8 897 814 A 97 ASN H A 96 GLU HA 1.0 . 3.6 898 815 A 97 ASN H A 96 GLU H 1.0 . 2.8 899 816 A 97 ASN H A 97 ASN HA 1.0 . 3.0 900 817 A 97 ASN H A 97 ASN HBy 1.0 . 3.6 901 818 A 97 ASN H A 97 ASN HBx 1.0 . 3.6 902 819 A 97 ASN H A 95 PRO HA 1.0 . 4.0 903 820 A 97 ASN H A 95 PRO HDx 1.0 . 5.4 904 821 A 94 ASP HBx A 97 ASN H 1.0 . 4.8 905 822 A 94 ASP HBy A 97 ASN H 1.0 . 4.8 906 823 A 97 ASN H A 98 PRO HDx 1.0 . 5.4 907 824 A 97 ASN H A 98 PRO HDy 1.0 . 5.4 908 825 A 97 ASN HA A 98 PRO HDx 1.0 . 3.0 909 826 A 97 ASN HA A 98 PRO HDy 1.0 . 3.0 910 827 A 98 PRO HA A 99 GLN H 1.0 . 3.6 911 828 A 98 PRO HDx A 99 GLN H 1.0 . 3.2 912 829 A 98 PRO HDy A 99 GLN H 1.0 . 4.6 913 830 A 99 GLN H A 99 GLN HA 1.0 . 3.0 914 831 A 99 GLN H A 99 GLN HBy 1.0 . 2.8 915 832 A 99 GLN H A 99 GLN HBx 1.0 . 2.8 916 833 A 99 GLN H A 97 ASN HD2x 1.0 . 5.2 917 834 A 99 GLN H A 97 ASN HD2y 1.0 . 5.2 918 835 A 97 ASN HA A 99 GLN H 1.0 . 4.0 919 836 A 92 ARG HA A 99 GLN H 1.0 . 6.4 920 837 A 99 GLN HA A 100 THR H 1.0 . 2.4 921 838 A 99 GLN H A 100 THR H 1.0 . 4.8 922 839 A 99 GLN HBy A 100 THR H 1.0 . 4.4 923 840 A 99 GLN HBx A 100 THR H 1.0 . 4.8 924 841 A 99 GLN HE2x A 100 THR H 1.0 . 5.4 925 842 A 99 GLN HE2y A 100 THR H 1.0 . 5.4 926 843 A 100 THR HA A 100 THR H 1.0 . 3.0 927 844 A 100 THR HB A 100 THR H 1.0 . 5.0 928 845 A 100 THR HG21 A 100 THR H 1.0 . 5.4 929 846 A 92 ARG HA A 100 THR H 1.0 . 5.4 930 847 A 101 LEU H A 100 THR HA 1.0 . 2.6 931 848 A 101 LEU H A 100 THR H 1.0 . 4.8 932 849 A 101 LEU H A 100 THR HB 1.0 . 3.2 933 850 A 101 LEU H A 100 THR HG21 1.0 . 6.0 934 851 A 101 LEU HA A 101 LEU H 1.0 . 3.0 935 852 A 101 LEU H A 101 LEU HBx 1.0 . 4.6 936 852 A 101 LEU H A 101 LEU HBy 1.0 . 4.6 937 853 A 101 LEU H A 101 LEU HD11 1.0 . 6.2 938 854 A 101 LEU H A 101 LEU HD21 1.0 . 6.2 939 855 A 90 GLY HAx A 101 LEU H 1.0 . 5.8 940 856 A 90 GLY HAy A 101 LEU H 1.0 . 6.0 941 857 A 101 LEU H A 92 ARG HA 1.0 . 5.8 942 858 A 101 LEU H A 93 PHE HBx 1.0 . 6.2 943 859 A 101 LEU H A 93 PHE HBy 1.0 . 6.2 944 860 A 102 ARG H A 101 LEU HA 1.0 . 2.4 945 861 A 102 ARG H A 101 LEU H 1.0 . 4.8 946 862 A 102 ARG H A 101 LEU HD11 1.0 . 5.6 947 863 A 102 ARG H A 101 LEU HD21 1.0 . 5.6 948 864 A 102 ARG H A 102 ARG HA 1.0 . 3.0 949 865 A 102 ARG H A 102 ARG HBx 1.0 . 4.6 950 865 A 102 ARG H A 102 ARG HBy 1.0 . 4.6 951 866 A 102 ARG H A 102 ARG HGx 1.0 . 5.8 952 866 A 102 ARG H A 102 ARG HGy 1.0 . 5.8 953 867 A 102 ARG H A 102 ARG HDx 1.0 . 5.8 954 867 A 102 ARG H A 102 ARG HDy 1.0 . 5.8 955 868 A 102 ARG H A 37 GLY HAx 1.0 . 4.8 956 869 A 102 ARG H A 37 GLY HAy 1.0 . 4.4 957 870 A 36 SER HA A 102 ARG H 1.0 . 5.4 958 871 A 36 SER HBx A 102 ARG H 1.0 . 5.4 959 872 A 36 SER HBy A 102 ARG H 1.0 . 5.4 960 873 A 103 LEU H A 102 ARG HA 1.0 . 2.4 961 874 A 102 ARG H A 103 LEU H 1.0 . 4.8 962 875 A 103 LEU H A 102 ARG HBx 1.0 . 5.4 963 875 A 103 LEU H A 102 ARG HBy 1.0 . 5.4 964 876 A 103 LEU HA A 103 LEU H 1.0 . 3.0 965 877 A 103 LEU H A 103 LEU HBx 1.0 . 4.6 966 877 A 103 LEU H A 103 LEU HBy 1.0 . 4.6 967 878 A 103 LEU H A 103 LEU HD21 1.0 . 5.8 968 879 A 103 LEU H A 89 ASN HD2x 1.0 . 6.0 969 880 A 103 LEU H A 89 ASN HD2y 1.0 . 6.0 970 881 A 103 LEU H A 89 ASN HA 1.0 . 4.0 971 882 A 103 LEU H A 89 ASN HBx 1.0 . 5.4 972 883 A 103 LEU H A 89 ASN HBy 1.0 . 5.4 973 884 A 104 GLU H A 103 LEU HA 1.0 . 2.4 974 885 A 104 GLU H A 103 LEU H 1.0 . 4.8 975 886 A 104 GLU H A 103 LEU HBx 1.0 . 5.4 976 886 A 104 GLU H A 103 LEU HBy 1.0 . 5.4 977 887 A 104 GLU H A 103 LEU HD11 1.0 . 6.4 978 888 A 104 GLU H A 103 LEU HD21 1.0 . 6.4 979 889 A 104 GLU H A 104 GLU HA 1.0 . 3.0 980 890 A 104 GLU H A 104 GLU HBx 1.0 . 4.6 981 890 A 104 GLU H A 104 GLU HBy 1.0 . 4.6 982 891 A 104 GLU H A 104 GLU HGx 1.0 . 5.8 983 891 A 104 GLU H A 104 GLU HGy 1.0 . 5.8 984 892 A 104 GLU H A 35 VAL HA 1.0 . 4.0 985 893 A 34 PHE HA A 104 GLU H 1.0 . 5.0 986 894 A 33 LEU HA A 104 GLU H 1.0 . 5.0 987 895 A 34 PHE HBx A 104 GLU H 1.0 . 5.4 988 896 A 34 PHE HBy A 104 GLU H 1.0 . 5.4 989 897 A 104 GLU H A 33 LEU HD21 1.0 . 6.4 990 897 A 104 GLU H A 33 LEU HD11 1.0 . 6.4 991 898 A 105 PHE H A 104 GLU HA 1.0 . 2.8 992 899 A 105 PHE H A 104 GLU H 1.0 . 4.8 993 900 A 105 PHE H A 104 GLU HBx 1.0 . 5.0 994 900 A 105 PHE H A 104 GLU HBy 1.0 . 5.0 995 901 A 105 PHE H A 104 GLU HGx 1.0 . 5.8 996 901 A 105 PHE H A 104 GLU HGy 1.0 . 5.8 997 902 A 105 PHE H A 105 PHE HA 1.0 . 3.0 998 903 A 105 PHE H A 105 PHE HBy 1.0 . 3.6 999 904 A 105 PHE H A 105 PHE HBx 1.0 . 3.6 1000 905 A 33 LEU HA A 105 PHE H 1.0 . 6.0 1001 906 A 105 PHE H A 33 LEU HD21 1.0 . 6.4 1002 906 A 105 PHE H A 33 LEU HD11 1.0 . 6.4 1003 907 A 106 ALA H A 105 PHE HA 1.0 . 2.4 1004 908 A 106 ALA H A 105 PHE H 1.0 . 4.8 1005 909 A 106 ALA H A 105 PHE HBy 1.0 . 4.8 1006 910 A 106 ALA H A 105 PHE HBx 1.0 . 4.8 1007 911 A 106 ALA H A 106 ALA HA 1.0 . 3.0 1008 912 A 106 ALA H A 106 ALA HB1 1.0 . 5.4 1009 913 A 106 ALA H A 108 ALA H 1.0 . 4.6 1010 914 A 106 ALA H A 33 LEU HA 1.0 . 3.4 1011 915 A 106 ALA H A 34 PHE HA 1.0 . 5.8 1012 916 A 32 THR HA A 106 ALA H 1.0 . 6.2 1013 917 A 32 THR HB A 106 ALA H 1.0 . 6.0 1014 918 A 30 VAL HG11 A 106 ALA H 1.0 . 6.0 1015 919 A 30 VAL HG21 A 106 ALA H 1.0 . 6.8 1016 920 A 106 ALA HA A 107 LYS H 1.0 . 2.4 1017 921 A 106 ALA H A 107 LYS H 1.0 . 4.8 1018 922 A 106 ALA HB1 A 107 LYS H 1.0 . 5.8 1019 923 A 107 LYS H A 107 LYS HA 1.0 . 3.0 1020 924 A 107 LYS H A 107 LYS HBy 1.0 . 4.4 1021 925 A 107 LYS H A 107 LYS HBx 1.0 . 4.4 1022 926 A 107 LYS H A 34 PHE HE% 1.0 . 6.8 1023 927 A 107 LYS H A 34 PHE HD% 1.0 . 6.8 1024 928 A 34 PHE HBx A 107 LYS H 1.0 . 6.0 1025 929 A 34 PHE HBy A 107 LYS H 1.0 . 5.4 1026 930 A 30 VAL HG21 A 107 LYS H 1.0 . 7.2 1027 931 A 108 ALA H A 107 LYS HA 1.0 . 3.2 1028 932 A 108 ALA H A 107 LYS H 1.0 . 2.8 1029 933 A 108 ALA H A 108 ALA HA 1.0 . 3.0 1030 934 A 108 ALA H A 108 ALA HB1 1.0 . 5.4 1031 935 A 106 ALA HA A 108 ALA H 1.0 . 4.4 1032 936 A 34 PHE HBy A 108 ALA H 1.0 . 6.2 1033 937 A 32 THR HB A 108 ALA H 1.0 . 6.8 1034 938 A 30 VAL HG11 A 108 ALA H 1.0 . 6.0 1035 939 A 30 VAL HG21 A 108 ALA H 1.0 . 6.0 1036 940 A 108 ALA HA A 109 ASN H 1.0 . 2.4 1037 941 A 108 ALA H A 109 ASN H 1.0 . 4.8 1038 942 A 108 ALA HB1 A 109 ASN H 1.0 . 6.0 1039 943 A 109 ASN HA A 109 ASN H 1.0 . 3.0 1040 944 A 109 ASN HBx A 109 ASN H 1.0 . 4.6 1041 945 A 109 ASN HBy A 109 ASN H 1.0 . 4.6 1042 946 A 107 LYS HA A 109 ASN H 1.0 . 6.0 1043 947 A 30 VAL HG11 A 109 ASN H 1.0 . 6.8 1044 948 A 30 VAL HG21 A 109 ASN H 1.0 . 6.0 1045 949 A 30 VAL HA A 109 ASN H 1.0 . 5.8 1046 950 A 32 THR HB A 109 ASN H 1.0 . 6.2 1047 951 A 109 ASN HA A 110 THR H 1.0 . 2.4 1048 952 A 110 THR H A 109 ASN H 1.0 . 4.8 1049 953 A 109 ASN HBx A 110 THR H 1.0 . 4.4 1050 954 A 109 ASN HBy A 110 THR H 1.0 . 4.4 1051 955 A 110 THR H A 110 THR HA 1.0 . 3.0 1052 956 A 110 THR H A 110 THR HB 1.0 . 3.2 1053 957 A 110 THR H A 110 THR HG21 1.0 . 6.0 1054 958 A 32 THR HA A 110 THR H 1.0 . 5.8 1055 959 A 32 THR HB A 110 THR H 1.0 . 4.8 1056 960 A 30 VAL HG11 A 110 THR H 1.0 . 6.8 1057 961 A 110 THR HA A 111 LYS H 1.0 . 2.4 1058 962 A 110 THR H A 111 LYS H 1.0 . 4.6 1059 963 A 110 THR HB A 111 LYS H 1.0 . 4.6 1060 964 A 110 THR HG21 A 111 LYS H 1.0 . 6.4 1061 965 A 111 LYS H A 111 LYS HA 1.0 . 3.0 1062 966 A 111 LYS H A 111 LYS HBx 1.0 . 4.6 1063 966 A 111 LYS H A 111 LYS HBy 1.0 . 4.6 1064 967 A 109 ASN HBx A 111 LYS H 1.0 . 6.2 1065 968 A 109 ASN HBy A 111 LYS H 1.0 . 6.2 1066 969 A 111 LYS HA A 112 MET H 1.0 . 2.4 1067 970 A 111 LYS H A 112 MET H 1.0 . 4.8 1068 971 A 112 MET H A 112 MET HA 1.0 . 3.0 1069 972 A 112 MET H A 112 MET HBy 1.0 . 4.4 1070 973 A 112 MET H A 112 MET HBx 1.0 . 4.4 1071 974 A 113 ALA H A 113 ALA HA 1.0 . 3.0 1072 975 A 113 ALA H A 113 ALA HB1 1.0 . 5.4 1073 976 A 113 ALA HA A 114 LYS H 1.0 . 2.4 1074 977 A 113 ALA H A 114 LYS H 1.0 . 4.8 1075 978 A 113 ALA HB1 A 114 LYS H 1.0 . 5.6 1076 979 A 114 LYS H A 114 LYS HA 1.0 . 3.0 1077 980 A 114 LYS H A 114 LYS HBy 1.0 . 4.8 1078 980 A 114 LYS H A 114 LYS HBx 1.0 . 4.8 1079 981 A 114 LYS HA A 115 SER H 1.0 . 2.4 1080 982 A 114 LYS H A 115 SER H 1.0 . 4.8 1081 983 A 114 LYS HBx A 115 SER H 1.0 . 4.6 1082 984 A 115 SER H A 114 LYS HBy 1.0 . 4.6 1083 985 A 115 SER H A 115 SER HA 1.0 . 3.0 1084 986 A 115 SER H A 115 SER HBx 1.0 . 5.4 1085 986 A 115 SER H A 115 SER HBy 1.0 . 5.4 1086 987 A 72 PHE HA A 34 PHE HA 1.0 . 2.6 1087 988 A 72 PHE HA A 60 SER HA 1.0 . 5.4 1088 989 A 72 PHE HA A 71 GLY HAx 1.0 . 5.4 1089 990 A 73 VAL HA A 72 PHE HA 1.0 . 5.2 1090 991 A 72 PHE HA A 106 ALA HB1 1.0 . 6.8 1091 992 A 72 PHE HA A 73 VAL HB 1.0 . 5.2 1092 993 A 72 PHE HA A 73 VAL HG21 1.0 . 6.8 1093 994 A 32 THR HG21 A 72 PHE HA 1.0 . 6.4 1094 995 A 72 PHE HA A 110 THR HG21 1.0 . 6.8 1095 996 A 72 PHE HA A 35 VAL HG21 1.0 . 6.8 1096 997 A 73 VAL HA A 60 SER HA 1.0 . 2.4 1097 998 A 59 GLY HAx A 60 SER HA 1.0 . 5.4 1098 999 A 59 GLY HAy A 60 SER HA 1.0 . 5.4 1099 1000 A 60 SER HA A 72 PHE HBx 1.0 . 5.8 1100 1001 A 60 SER HA A 72 PHE HBy 1.0 . 5.8 1101 1002 A 60 SER HA A 73 VAL HB 1.0 . 4.8 1102 1003 A 60 SER HA A 62 ILE HD11 1.0 . 6.8 1103 1004 A 47 LEU HD11 A 60 SER HA 1.0 . 6.4 1104 1005 A 47 LEU HD21 A 60 SER HA 1.0 . 6.4 1105 1006 A 73 VAL HG11 A 60 SER HA 1.0 . 6.0 1106 1007 A 73 VAL HG21 A 60 SER HA 1.0 . 6.0 1107 1008 A 32 THR HA A 74 ILE HA 1.0 . 2.4 1108 1009 A 32 THR HA A 33 LEU HA 1.0 . 5.2 1109 1010 A 32 THR HA A 75 PHE HBx 1.0 . 6.2 1110 1011 A 32 THR HA A 75 PHE HBy 1.0 . 6.2 1111 1012 A 30 VAL HG11 A 32 THR HA 1.0 . 6.8 1112 1013 A 32 THR HA A 33 LEU HD11 1.0 . 6.8 1113 1014 A 32 THR HA A 33 LEU HD21 1.0 . 6.8 1114 1015 A 103 LEU HA A 35 VAL HA 1.0 . 2.6 1115 1016 A 103 LEU HA A 102 ARG HA 1.0 . 5.2 1116 1017 A 103 LEU HA A 85 LYS HA 1.0 . 5.4 1117 1018 A 103 LEU HA A 35 VAL HG11 1.0 . 6.4 1118 1019 A 103 LEU HA A 35 VAL HG21 1.0 . 6.4 1119 1020 A 71 GLY HAx A 62 ILE HA 1.0 . 2.6 1120 1021 A 71 GLY HAy A 62 ILE HA 1.0 . 3.4 1121 1022 A 71 GLY HAx A 72 PHE HBx 1.0 . 5.8 1122 1023 A 71 GLY HAx A 72 PHE HBy 1.0 . 5.8 1123 1024 A 71 GLY HAx A 62 ILE HD11 1.0 . 6.4 1124 1025 A 71 GLY HAx A 62 ILE HG21 1.0 . 6.4 1125 1026 A 96 GLU HA A 97 ASN HA 1.0 . 5.4 1126 1027 A 97 ASN HA A 98 PRO HA 1.0 . 5.2 1127 1028 A 57 TYR HA A 75 PHE HA 1.0 . 2.8 1128 1029 A 75 PHE HA A 57 TYR HBx 1.0 . 5.8 1129 1030 A 75 PHE HA A 57 TYR HBy 1.0 . 5.8 1130 1031 A 74 ILE HA A 75 PHE HA 1.0 . 5.4 1131 1032 A 75 PHE HA A 76 ASP HBx 1.0 . 5.4 1132 1033 A 75 PHE HA A 76 ASP HBx 1.0 . 5.4 1133 1034 A 75 PHE HA A 76 ASP HA 1.0 . 5.2 1134 1035 A 75 PHE HA A 81 ALA HB1 1.0 . 6.4 1135 1036 A 73 VAL HG11 A 75 PHE HA 1.0 . 6.8 1136 1037 A 42 ILE HA A 43 LYS HA 1.0 . 5.2 1137 1038 A 42 ILE HD11 A 43 LYS HA 1.0 . 6.8 1138 1039 A 42 ILE HG21 A 43 LYS HA 1.0 . 6.8 1139 1040 A 33 LEU HA A 34 PHE HA 1.0 . 5.2 1140 1041 A 34 PHE HA A 35 VAL HA 1.0 . 5.2 1141 1042 A 34 PHE HA A 106 ALA HA 1.0 . 5.4 1142 1043 A 34 PHE HA A 106 ALA HB1 1.0 . 6.8 1143 1044 A 102 ARG HA A 89 ASN HA 1.0 . 2.6 1144 1045 A 102 ARG HA A 89 ASN HBx 1.0 . 5.4 1145 1046 A 102 ARG HA A 89 ASN HBy 1.0 . 5.4 1146 1047 A 33 LEU HA A 105 PHE HA 1.0 . 2.4 1147 1048 A 33 LEU HA A 73 VAL HG11 1.0 . 6.8 1148 1049 A 32 THR HB A 109 ASN HA 1.0 . 3.2 1149 1050 A 32 THR HG21 A 109 ASN HA 1.0 . 5.8 1150 1051 A 70 VAL HA A 36 SER HA 1.0 . 3.2 1151 1052 A 36 SER HA A 70 VAL HG11 1.0 . 6.4 1152 1053 A 36 SER HA A 38 LEU HD11 1.0 . 6.4 1153 1054 A 36 SER HA A 38 LEU HD21 1.0 . 6.4 1154 1055 A 70 VAL HA A 38 LEU HD11 1.0 . 5.4 1155 1056 A 38 LEU HA A 38 LEU HD11 1.0 . 5.4 1156 1057 A 94 ASP HA A 97 ASN HBy 1.0 . 6.2 1157 1058 A 64 LEU HA A 69 PRO HA 1.0 . 2.6 1158 1059 A 69 PRO HA A 65 THR HG21 1.0 . 6.2 1159 1060 A 40 VAL HA A 68 GLN HA 1.0 . 4.0 1160 1061 A 40 VAL HG21 A 68 GLN HA 1.0 . 6.4 1161 1062 A 100 THR HA A 92 ARG HA 1.0 . 2.6 1162 1063 A 100 THR HA A 99 GLN HA 1.0 . 5.2 1163 1064 A 100 THR HA A 92 ARG HDx 1.0 . 5.2 1164 1065 A 100 THR HA A 92 ARG HDy 1.0 . 5.2 1165 1066 A 100 THR HA A 92 ARG HGx 1.0 . 5.8 1166 1066 A 100 THR HA A 92 ARG HGy 1.0 . 5.8 1167 1067 A 101 LEU HA A 37 GLY HAx 1.0 . 4.0 1168 1068 A 101 LEU HA A 37 GLY HAy 1.0 . 4.0 1169 1069 A 73 VAL HA A 60 SER HBx 1.0 . 4.8 1170 1070 A 73 VAL HA A 60 SER HBy 1.0 . 4.8 1171 1071 A 39 PRO HA A 40 VAL HA 1.0 . 5.0 1172 1072 A 104 GLU HA A 85 LYS HEx 1.0 . 4.8 1173 1073 A 104 GLU HA A 85 LYS HEy 1.0 . 4.8 1174 1074 A 100 THR HB A 92 ARG HA 1.0 . 3.6 1175 1075 A 92 ARG HA A 100 THR HG21 1.0 . 6.2 1176 1076 A 83 ALA HA A 86 ASN HA 1.0 . 5.8 1177 1077 A 34 PHE HBx A 106 ALA HA 1.0 . 5.0 1178 1078 A 34 PHE HBy A 106 ALA HA 1.0 . 5.0 1179 1079 A 90 GLY HAx A 100 THR HB 1.0 . 4.8 1180 1080 A 90 GLY HAx A 100 THR HG21 1.0 . 6.8 1181 1081 A 30 VAL HG21 A 108 ALA HA 1.0 . 5.8 1182 1082 A 83 ALA HA A 86 ASN HBx 1.0 . 4.8 1183 1083 A 83 ALA HA A 86 ASN HBy 1.0 . 4.8 1184 1084 A 92 ARG HDx A 98 PRO HA 1.0 . 5.2 1185 1085 A 92 ARG HDy A 98 PRO HA 1.0 . 5.8 1186 1086 A 92 ARG HDx A 95 PRO HA 1.0 . 4.0 1187 1087 A 92 ARG HDy A 95 PRO HA 1.0 . 3.4 1188 1088 A 36 SER HBx A 70 VAL HG11 1.0 . 6.0 1189 1089 A 36 SER HBy A 70 VAL HG11 1.0 . 6.0 1190 1090 A 73 VAL HG11 A 60 SER HBx 1.0 . 6.0 1191 1091 A 73 VAL HG11 A 60 SER HBy 1.0 . 6.0 1192 1092 A 81 ALA HB1 A 78 ARG HA 1.0 . 6.0 1193 1093 A 82 GLU HA A 33 LEU HD11 1.0 . 6.8 1194 1094 A 82 GLU HA A 33 LEU HD21 1.0 . 6.8 1195 1095 A 85 LYS HA A 33 LEU HD11 1.0 . 6.8 1196 1096 A 85 LYS HA A 33 LEU HD21 1.0 . 6.8 1197 1097 A 81 ALA HA A 33 LEU HD11 1.0 . 6.8 1198 1098 A 81 ALA HA A 33 LEU HD21 1.0 . 6.8 1199 1099 A 81 ALA HB1 A 75 PHE HBx 1.0 . 6.4 1200 1100 A 81 ALA HB1 A 75 PHE HBy 1.0 . 6.4 1201 1101 A 73 VAL HG11 A 57 TYR HBx 1.0 . 6.8 1202 1102 A 73 VAL HG11 A 57 TYR HBy 1.0 . 6.8 1203 1103 A 73 VAL HG11 A 51 PHE HBx 1.0 . 6.8 1204 1104 A 73 VAL HG11 A 51 PHE HBy 1.0 . 6.8 1205 1105 A 74 ILE H A 59 GLY O 1.0 . 2.0 1206 1106 A 59 GLY O A 74 ILE N 1.0 . 3.1 1207 1107 A 61 LEU H A 72 PHE O 1.0 . 2.0 1208 1108 A 72 PHE O A 61 LEU N 1.0 . 3.1 1209 1109 A 72 PHE H A 61 LEU O 1.0 . 2.0 1210 1110 A 61 LEU O A 72 PHE N 1.0 . 3.1 1211 1111 A 75 PHE H A 31 ARG O 1.0 . 2.0 1212 1112 A 31 ARG O A 75 PHE N 1.0 . 3.1 1213 1113 A 33 LEU H A 73 VAL O 1.0 . 2.0 1214 1114 A 73 VAL O A 33 LEU N 1.0 . 3.0 1215 1115 A 73 VAL H A 33 LEU O 1.0 . 2.0 1216 1116 A 33 LEU O A 73 VAL N 1.0 . 3.1 1217 1117 A 35 VAL H A 71 GLY O 1.0 . 2.0 1218 1118 A 71 GLY O A 35 VAL N 1.0 . 3.1 1219 1119 A 71 GLY H A 35 VAL O 1.0 . 2.0 1220 1120 A 35 VAL O A 71 GLY N 1.0 . 3.1 1221 1121 A 34 PHE H A 104 GLU O 1.0 . 2.0 1222 1122 A 104 GLU O A 34 PHE N 1.0 . 3.1 1223 1123 A 104 GLU H A 34 PHE O 1.0 . 2.0 1224 1124 A 34 PHE O A 104 GLU N 1.0 . 3.1 1225 1125 A 51 PHE HA A 54 PHE HBx 1.0 . 4.8 1226 1126 A 51 PHE HA A 54 PHE HBy 1.0 . 5.8 1227 1127 A 51 PHE HA A 54 PHE HDy 1.0 . 2.8 1228 1128 A 54 PHE H A 54 PHE HDy 1.0 . 3.0 1229 1129 A 84 ALA HB1 A 54 PHE HZ 1.0 . 5.4 1230 1130 A 84 ALA H A 54 PHE HDx 1.0 . 4.6 1231 1131 A 85 LYS H A 54 PHE HDx 1.0 . 6.0 1232 1132 A 88 LEU H A 54 PHE HEx 1.0 . 4.2 1233 1133 A 88 LEU H A 54 PHE HZ 1.0 . 5.0 1234 1134 A 82 GLU HA A 105 PHE HZ 1.0 . 4.2 1235 1135 A 82 GLU H A 105 PHE HZ 1.0 . 3.4 1236 1136 A 55 LYS H A 54 PHE HDy 1.0 . 5.4 1237 1137 A 84 ALA HB1 A 54 PHE HDx 1.0 . 6.0 1238 1138 A 84 ALA HB1 A 54 PHE HDy 1.0 . 6.4 1239 1139 A 84 ALA HA A 54 PHE HDx 1.0 . 3.4 1240 1140 A 54 PHE HBx A 84 ALA HB1 1.0 . 6.0 1241 1141 A 84 ALA HB1 A 54 PHE HBy 1.0 . 6.0 1242 1142 A 84 ALA HA A 54 PHE HEx 1.0 . 4.4 1243 1143 A 87 ALA HB1 A 54 PHE HDx 1.0 . 6.0 1244 1144 A 87 ALA HB1 A 54 PHE HEx 1.0 . 5.4 1245 1145 A 88 LEU HD11 A 54 PHE HZ 1.0 . 4.4 1246 1146 A 88 LEU HD11 A 54 PHE HEy 1.0 . 6.4 1247 1147 A 48 TYR HEx A 52 ARG HGx 1.0 . 5.8 1248 1147 A 52 ARG HGy A 48 TYR HEx 1.0 . 5.8 1249 1148 A 48 TYR HEx A 52 ARG HDy 1.0 . 4.4 1250 1149 A 48 TYR HEx A 52 ARG HDx 1.0 . 4.4 1251 1150 A 48 TYR HDx A 49 LEU HD21 1.0 . 5.4 1252 1151 A 48 TYR HEx A 49 LEU HD21 1.0 . 5.4 1253 1152 A 45 ARG HBx A 48 TYR HDx 1.0 . 4.8 1254 1153 A 48 TYR HDx A 45 ARG HBy 1.0 . 4.8 1255 1154 A 48 TYR HDx A 45 ARG HGx 1.0 . 5.8 1256 1154 A 45 ARG HGy A 48 TYR HDx 1.0 . 5.8 1257 1155 A 35 VAL HG21 A 51 PHE HZ 1.0 . 4.8 1258 1156 A 73 VAL HG11 A 51 PHE HDy 1.0 . 5.0 1259 1157 A 73 VAL HG21 A 51 PHE HEy 1.0 . 5.4 1260 1158 A 88 LEU HD11 A 51 PHE HEx 1.0 . 5.4 1261 1159 A 88 LEU HD11 A 51 PHE HEy 1.0 . 5.0 1262 1160 A 88 LEU HD11 A 51 PHE HDy 1.0 . 5.8 1263 1161 A 88 LEU HD11 A 51 PHE HZ 1.0 . 4.4 1264 1162 A 88 LEU HD11 A 51 PHE HEx 1.0 . 6.0 1265 1163 A 88 LEU HD11 A 51 PHE HDx 1.0 . 6.0 1266 1164 A 47 LEU HA A 51 PHE HDx 1.0 . 4.4 1267 1165 A 93 PHE HEx A 38 LEU HD21 1.0 . 5.8 1268 1166 A 93 PHE HDx A 38 LEU HD21 1.0 . 6.8 1269 1167 A 42 ILE HG21 A 93 PHE HEx 1.0 . 6.4 1270 1168 A 47 LEU HA A 93 PHE HEy 1.0 . 5.0 1271 1169 A 93 PHE HZ A 46 GLU HBy 1.0 . 3.6 1272 1170 A 93 PHE HZ A 46 GLU HGy 1.0 . 4.4 1273 1171 A 39 PRO HDx A 42 ILE HG21 1.0 . 6.8 1274 1172 A 39 PRO HDy A 42 ILE HG21 1.0 . 6.8 1275 1173 A 42 ILE HG21 A 46 GLU HBy 1.0 . 6.8 1276 1173 A 42 ILE HG21 A 46 GLU HBx 1.0 . 6.8 1277 1174 A 105 PHE HDx A 33 LEU HD21 1.0 . 6.0 1278 1175 A 93 PHE HBx A 38 LEU HD21 1.0 . 7.2 1279 1176 A 93 PHE HBy A 38 LEU HD21 1.0 . 7.2 1280 1177 A 42 ILE HD11 A 38 LEU HD11 1.0 . 7.4 1281 1178 A 42 ILE HG21 A 38 LEU HD11 1.0 . 6.4 1282 1179 A 42 ILE HG21 A 38 LEU HD21 1.0 . 6.4 1283 1180 A 35 VAL HG11 A 38 LEU HD11 1.0 . 6.8 1284 1181 A 35 VAL HG11 A 38 LEU HD21 1.0 . 6.8 1285 1182 A 93 PHE HEy A 50 LEU HD21 1.0 . 5.8 1286 1183 A 50 LEU HD21 A 93 PHE HDy 1.0 . 6.4 1287 1184 A 93 PHE HA A 50 LEU HD11 1.0 . 6.8 1288 1185 A 52 ARG HDx A 49 LEU HD21 1.0 . 5.8 1289 1186 A 52 ARG HDy A 49 LEU HD21 1.0 . 5.8 1290 1187 A 91 ILE HD11 A 93 PHE HA 1.0 . 6.4 1291 1188 A 38 LEU HD11 A 101 LEU HD11 1.0 . 6.8 1292 1189 A 93 PHE HBx A 101 LEU HD11 1.0 . 6.4 1293 1190 A 93 PHE HBy A 101 LEU HD11 1.0 . 6.4 1294 1191 A 47 LEU HD21 A 38 LEU HD11 1.0 . 6.8 1295 1192 A 47 LEU HD21 A 38 LEU HD21 1.0 . 6.8 1296 1193 A 47 LEU HA A 47 LEU HD21 1.0 . 5.4 1297 1194 A 47 LEU H A 47 LEU HG 1.0 . 2.8 1298 1195 A 50 LEU HA A 50 LEU HD11 1.0 . 5.4 1299 1196 A 50 LEU HA A 50 LEU HG 1.0 . 2.8 1300 1197 A 88 LEU HA A 88 LEU HD21 1.0 . 5.4 1301 1198 A 73 VAL HG21 A 35 VAL HG21 1.0 . 6.8 1302 1199 A 89 ASN HA A 103 LEU HD11 1.0 . 6.0 1303 1200 A 102 ARG HA A 103 LEU HD11 1.0 . 6.8 1304 1201 A 85 LYS HA A 103 LEU HD21 1.0 . 6.4 1305 1202 A 88 LEU HD11 A 103 LEU HD21 1.0 . 7.4 1306 1203 A 39 PRO HDx A 93 PHE HDx 1.0 . 4.4 1307 1204 A 39 PRO HDy A 93 PHE HDx 1.0 . 4.4 1308 1205 A 38 LEU HA A 93 PHE HDx 1.0 . 5.2 1309 1206 A 88 LEU HA A 91 ILE HG21 1.0 . 5.8 1310 1207 A 45 ARG HA A 48 TYR HBx 1.0 . 4.0 1311 1208 A 45 ARG HA A 48 TYR HBy 1.0 . 4.0 1312 1209 A 46 GLU HA A 49 LEU HD11 1.0 . 5.4 1313 1210 A 48 TYR HEy B 95 PRO HDx 1.0 . 4.4 1314 1211 A 48 TYR HEy B 95 PRO HDy 1.0 . 3.6 1315 1212 A 48 TYR HEy B 95 PRO HBx 1.0 . 5.4 1316 1213 A 48 TYR HEx B 91 ILE HD11 1.0 . 6.4 1317 1214 A 48 TYR HEx B 93 PHE HA 1.0 . 3.4 1318 1215 A 48 TYR HEx B 94 ASP HA 1.0 . 4.8 1319 1216 A 49 LEU HD11 B 93 PHE HEy 1.0 . 5.0 1320 1217 A 49 LEU HD11 B 93 PHE HZ 1.0 . 5.4 1321 1218 A 49 LEU HD11 B 93 PHE HDy 1.0 . 6.4 1322 1219 A 49 LEU HD21 B 93 PHE HEy 1.0 . 6.4 1323 1220 A 49 LEU HD21 B 93 PHE HDy 1.0 . 6.4 1324 1221 B 93 PHE HEx A 45 ARG HDx 1.0 . 4.0 1325 1222 B 93 PHE HEx A 45 ARG HDy 1.0 . 5.4 1326 1223 A 49 LEU HD21 B 101 LEU HD21 1.0 . 6.8 1327 1224 A 49 LEU HA B 101 LEU HD21 1.0 . 7.2 1328 1225 A 49 LEU HD21 B 91 ILE HD11 1.0 . 7.4 1329 1226 A 49 LEU HD11 B 46 GLU HA 1.0 . 6.4 1330 1227 A 49 LEU HD11 B 46 GLU HBx 1.0 . 6.8 1331 1227 A 49 LEU HD11 B 46 GLU HBy 1.0 . 6.8 1332 1228 A 49 LEU HD11 B 46 GLU HGx 1.0 . 5.4 1333 1228 A 49 LEU HD11 B 46 GLU HGy 1.0 . 5.4 1334 1229 A 49 LEU HD21 B 93 PHE HA 1.0 . 5.4 1335 1230 A 49 LEU HD11 B 93 PHE HA 1.0 . 6.4 1336 1231 A 49 LEU HD21 B 91 ILE HD11 1.0 . 7.4 1337 1232 A 49 LEU HD21 B 38 LEU HD21 1.0 . 8.4 1338 1233 A 49 LEU HD21 B 50 LEU HA 1.0 . 6.0 1339 1234 A 49 LEU HD21 B 50 LEU HD11 1.0 . 6.0 1340 1235 A 49 LEU HA B 50 LEU HD11 1.0 . 6.0 1341 1236 A 52 ARG HDx B 50 LEU HD11 1.0 . 6.0 1342 1237 A 52 ARG HDy B 50 LEU HD11 1.0 . 6.0 1343 1238 A 52 ARG HDx B 91 ILE HD11 1.0 . 6.4 1344 1239 A 52 ARG HDy B 91 ILE HD11 1.0 . 6.4 1345 1240 A 52 ARG HDx B 91 ILE HG21 1.0 . 6.8 1346 1241 A 52 ARG HDy B 91 ILE HG21 1.0 . 6.8 1347 1242 A 94 ASP HA B 45 ARG HA 1.0 . 5.8 1348 1243 A 94 ASP HA B 45 ARG HBx 1.0 . 4.8 1349 1244 A 94 ASP HA B 45 ARG HBy 1.0 . 4.8 1350 1245 A 94 ASP HA B 45 ARG HDx 1.0 . 5.2 1351 1246 A 94 ASP HA B 45 ARG HDy 1.0 . 5.2 1352 1247 A 45 ARG HA B 94 ASP HBx 1.0 . 5.8 1353 1248 A 45 ARG HA B 94 ASP HBy 1.0 . 5.8 1354 1249 B 94 ASP HBy A 45 ARG HDy 1.0 . 6.8 1355 1249 B 94 ASP HBy A 45 ARG HDx 1.0 . 6.8 1356 1250 B 94 ASP HBx A 45 ARG HDy 1.0 . 6.8 1357 1250 B 94 ASP HBx A 45 ARG HDx 1.0 . 6.8 1358 1251 A 45 ARG HA B 95 PRO HDx 1.0 . 5.4 1359 1252 A 45 ARG HA B 95 PRO HDy 1.0 . 5.4 stop_ save_ save_DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_4 _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 102 ARG H A 37 GLY HAy 1.0 . 3.4 2 2 A 102 ARG H A 37 GLY HAx 1.0 . 3.2 3 3 A 101 LEU HA A 37 GLY HAy 1.0 . 2.2 4 4 A 101 LEU HA A 37 GLY HAx 1.0 . 2.2 5 5 A 36 SER H A 37 GLY H 1.0 . 3.8 6 6 A 38 LEU H A 37 GLY H 1.0 . 2.0 7 7 A 37 GLY H A 38 LEU HD21 1.0 . 3.4 8 8 A 37 GLY H A 38 LEU HD11 1.0 . 3.4 9 9 A 101 LEU HA A 37 GLY H 1.0 . 4.0 10 10 A 38 LEU HA A 40 VAL H 1.0 . 4.2 11 11 A 38 LEU HA A 41 ASP H 1.0 . 4.4 12 12 A 38 LEU HA A 42 ILE H 1.0 . 4.2 13 13 A 40 VAL H A 69 PRO HDx 1.0 . 3.6 14 14 A 40 VAL H A 68 GLN HA 1.0 . 4.0 15 15 A 68 GLN HA A 41 ASP H 1.0 . 4.2 16 16 A 42 ILE H A 68 GLN HA 1.0 . 4.2 17 17 A 71 GLY HAx A 63 LYS H 1.0 . 3.4 18 18 A 65 THR H A 69 PRO HA 1.0 . 2.6 19 19 A 64 LEU H A 69 PRO HA 1.0 . 2.2 20 20 A 56 GLY H A 57 TYR H 1.0 . 2.2 21 21 A 56 GLY HAx A 76 ASP H 1.0 . 2.8 22 22 A 56 GLY HAy A 76 ASP H 1.0 . 2.8 23 23 A 77 SER H A 80 GLY H 1.0 . 3.8 24 24 A 77 SER H A 81 ALA H 1.0 . 3.8 25 25 A 102 ARG HA A 89 ASN HA 1.0 . 2.2 26 26 A 90 GLY H A 101 LEU H 1.0 . 3.6 27 27 A 90 GLY H A 92 ARG H 1.0 . 4.4 28 28 A 101 LEU H A 92 ARG H 1.0 . 4.2 29 29 A 100 THR HA A 93 PHE H 1.0 . 3.2 30 30 A 100 THR HB A 93 PHE H 1.0 . 3.8 31 31 A 93 PHE H A 100 THR H 1.0 . 4.4 32 32 A 94 ASP H A 99 GLN H 1.0 . 4.0 33 33 A 100 THR HA A 92 ARG HA 1.0 . 2.2 34 34 A 97 ASN H A 96 GLU H 1.0 . 2.2 35 35 A 47 LEU HA A 93 PHE HEx 1.0 . 3.4 36 36 A 42 ILE H A 41 ASP H 1.0 . 2.2 37 37 A 42 ILE H A 42 ILE HA 1.0 . 2.7 38 38 A 54 PHE HBx A 56 GLY H 1.0 . 4.4 39 39 A 56 GLY H A 54 PHE HBy 1.0 . 4.4 40 40 A 40 VAL H A 40 VAL HA 1.0 . 2.6 41 41 A 55 LYS H A 55 LYS HA 1.0 . 2.6 42 42 A 54 PHE H A 55 LYS H 1.0 . 4.0 43 43 A 45 ARG HA A 48 TYR HBx 1.0 . 2.4 44 44 A 45 ARG HA A 48 TYR HBy 1.0 . 2.4 45 45 A 46 GLU HA A 49 LEU HD11 1.0 . 2.2 46 46 A 73 VAL HA A 60 SER HA 1.0 . 2.2 47 47 A 49 LEU HA B 50 LEU HA 1.0 . 4.8 48 48 A 49 LEU HD21 B 50 LEU HD11 1.0 . 2.2 stop_ 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 hbond _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 74 ILE H A 59 GLY O 1.0 . 1.8 2 2 A 59 GLY O A 74 ILE N 1.0 . 2.7 3 3 A 61 LEU H A 72 PHE O 1.0 . 1.8 4 4 A 72 PHE O A 61 LEU N 1.0 . 2.7 5 5 A 72 PHE H A 61 LEU O 1.0 . 1.8 6 6 A 61 LEU O A 72 PHE N 1.0 . 2.7 7 7 A 75 PHE H A 31 ARG O 1.0 . 1.8 8 8 A 31 ARG O A 75 PHE N 1.0 . 2.7 9 9 A 33 LEU H A 73 VAL O 1.0 . 1.8 10 10 A 73 VAL O A 33 LEU N 1.0 . 2.7 11 11 A 73 VAL H A 33 LEU O 1.0 . 1.8 12 12 A 33 LEU O A 73 VAL N 1.0 . 2.7 13 13 A 35 VAL H A 71 GLY O 1.0 . 1.8 14 14 A 71 GLY O A 35 VAL N 1.0 . 2.7 15 15 A 71 GLY H A 35 VAL O 1.0 . 1.8 16 16 A 35 VAL O A 71 GLY N 1.0 . 2.7 17 17 A 34 PHE H A 104 GLU O 1.0 . 1.8 18 18 A 104 GLU O A 34 PHE N 1.0 . 2.7 19 19 A 104 GLU H A 34 PHE O 1.0 . 1.8 20 20 A 34 PHE O A 104 GLU N 1.0 . 2.7 stop_ save_ save_DYANA/DIANA_dihedral_5 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_5 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 28 GLU C A 29 GLU N A 29 GLU CA A 29 GLU C 1.0 -135.6 -48.5 PHI 2 2 A 29 GLU N A 29 GLU CA A 29 GLU C A 30 VAL N 1.0 96.4 178.9 PSI 3 3 A 29 GLU C A 30 VAL N A 30 VAL CA A 30 VAL C 1.0 -104.2 -43.4 PHI 4 4 A 30 VAL N A 30 VAL CA A 30 VAL C A 31 ARG N 1.0 112.1 152.1 PSI 5 5 A 30 VAL C A 31 ARG N A 31 ARG CA A 31 ARG C 1.0 -201.1 -61.1 PHI 6 6 A 31 ARG C A 32 THR N A 32 THR CA A 32 THR C 1.0 -160.6 -65.6 PHI 7 7 A 32 THR N A 32 THR CA A 32 THR C A 33 LEU N 1.0 106.5 162.8 PSI 8 8 A 32 THR C A 33 LEU N A 33 LEU CA A 33 LEU C 1.0 -146.4 -89.5 PHI 9 9 A 33 LEU N A 33 LEU CA A 33 LEU C A 34 PHE N 1.0 113.1 170.6 PSI 10 10 A 33 LEU C A 34 PHE N A 34 PHE CA A 34 PHE C 1.0 -151.6 -76.7 PHI 11 11 A 34 PHE N A 34 PHE CA A 34 PHE C A 35 VAL N 1.0 99.3 139.3 PSI 12 12 A 34 PHE C A 35 VAL N A 35 VAL CA A 35 VAL C 1.0 -140.4 -98.0 PHI 13 13 A 35 VAL N A 35 VAL CA A 35 VAL C A 36 SER N 1.0 109.3 149.3 PSI 14 14 A 35 VAL C A 36 SER N A 36 SER CA A 36 SER C 1.0 -169.1 -92.3 PHI 15 15 A 36 SER N A 36 SER CA A 36 SER C A 37 GLY N 1.0 104.5 204.3 PSI 16 16 A 36 SER C A 37 GLY N A 37 GLY CA A 37 GLY C 1.0 18.8 116.8 PHI 17 17 A 37 GLY N A 37 GLY CA A 37 GLY C A 38 LEU N 1.0 -17.8 72.5 PSI 18 18 A 37 GLY C A 38 LEU N A 38 LEU CA A 38 LEU C 1.0 -144.6 -52.4 PHI 19 19 A 38 LEU N A 38 LEU CA A 38 LEU C A 39 PRO N 1.0 66.1 189.4 PSI 20 20 A 39 PRO N A 39 PRO CA A 39 PRO C A 40 VAL N 1.0 124.1 183.7 PSI 21 21 A 39 PRO C A 40 VAL N A 40 VAL CA A 40 VAL C 1.0 -86.1 -44.0 PHI 22 22 A 40 VAL N A 40 VAL CA A 40 VAL C A 41 ASP N 1.0 -44.1 7.6 PSI 23 23 A 40 VAL C A 41 ASP N A 41 ASP CA A 41 ASP C 1.0 -127.7 -82.5 PHI 24 24 A 41 ASP N A 41 ASP CA A 41 ASP C A 42 ILE N 1.0 -33.6 40.4 PSI 25 25 A 41 ASP C A 42 ILE N A 42 ILE CA A 42 ILE C 1.0 -137.8 -49.8 PHI 26 26 A 42 ILE N A 42 ILE CA A 42 ILE C A 43 LYS N 1.0 98.6 150.2 PSI 27 27 A 42 ILE C A 43 LYS N A 43 LYS CA A 43 LYS C 1.0 -130.7 -36.7 PHI 28 28 A 43 LYS N A 43 LYS CA A 43 LYS C A 44 PRO N 1.0 100.2 183.8 PSI 29 29 A 44 PRO N A 44 PRO CA A 44 PRO C A 45 ARG N 1.0 -57.1 -17.1 PSI 30 30 A 44 PRO C A 45 ARG N A 45 ARG CA A 45 ARG C 1.0 -86.4 -46.4 PHI 31 31 A 45 ARG N A 45 ARG CA A 45 ARG C A 46 GLU N 1.0 -51.8 -10.8 PSI 32 32 A 45 ARG C A 46 GLU N A 46 GLU CA A 46 GLU C 1.0 -83.7 -43.7 PHI 33 33 A 46 GLU N A 46 GLU CA A 46 GLU C A 47 LEU N 1.0 -64.8 -24.8 PSI 34 34 A 46 GLU C A 47 LEU N A 47 LEU CA A 47 LEU C 1.0 -83.3 -43.3 PHI 35 35 A 47 LEU N A 47 LEU CA A 47 LEU C A 48 TYR N 1.0 -57.1 -9.0 PSI 36 36 A 47 LEU C A 48 TYR N A 48 TYR CA A 48 TYR C 1.0 -86.9 -46.9 PHI 37 37 A 48 TYR N A 48 TYR CA A 48 TYR C A 49 LEU N 1.0 -53.4 -13.4 PSI 38 38 A 48 TYR C A 49 LEU N A 49 LEU CA A 49 LEU C 1.0 -80.7 -40.7 PHI 39 39 A 49 LEU N A 49 LEU CA A 49 LEU C A 50 LEU N 1.0 -60.5 -20.5 PSI 40 40 A 49 LEU C A 50 LEU N A 50 LEU CA A 50 LEU C 1.0 -91.4 -43.0 PHI 41 41 A 50 LEU N A 50 LEU CA A 50 LEU C A 51 PHE N 1.0 -60.6 -20.6 PSI 42 42 A 50 LEU C A 51 PHE N A 51 PHE CA A 51 PHE C 1.0 -131.5 -63.0 PHI 43 43 A 51 PHE N A 51 PHE CA A 51 PHE C A 52 ARG N 1.0 -55.9 14.1 PSI 44 44 A 53 PRO N A 53 PRO CA A 53 PRO C A 54 PHE N 1.0 -42.4 -2.4 PSI 45 45 A 54 PHE C A 55 LYS N A 55 LYS CA A 55 LYS C 1.0 -80.6 -36.5 PHI 46 46 A 55 LYS N A 55 LYS CA A 55 LYS C A 56 GLY N 1.0 109.6 160.5 PSI 47 47 A 56 GLY C A 57 TYR N A 57 TYR CA A 57 TYR C 1.0 -105.0 -45.6 PHI 48 48 A 57 TYR N A 57 TYR CA A 57 TYR C A 58 GLU N 1.0 91.1 153.8 PSI 49 49 A 57 TYR C A 58 GLU N A 58 GLU CA A 58 GLU C 1.0 -121.1 -74.8 PHI 50 50 A 58 GLU N A 58 GLU CA A 58 GLU C A 59 GLY N 1.0 -59.8 -13.5 PSI 51 51 A 58 GLU C A 59 GLY N A 59 GLY CA A 59 GLY C 1.0 -241.0 -101.0 PHI 52 52 A 59 GLY N A 59 GLY CA A 59 GLY C A 60 SER N 1.0 143.3 187.3 PSI 53 53 A 59 GLY C A 60 SER N A 60 SER CA A 60 SER C 1.0 -171.7 -109.9 PHI 54 54 A 60 SER N A 60 SER CA A 60 SER C A 61 LEU N 1.0 138.2 178.2 PSI 55 55 A 60 SER C A 61 LEU N A 61 LEU CA A 61 LEU C 1.0 -184.2 -89.3 PHI 56 56 A 61 LEU N A 61 LEU CA A 61 LEU C A 62 ILE N 1.0 105.4 175.8 PSI 57 57 A 61 LEU C A 62 ILE N A 62 ILE CA A 62 ILE C 1.0 -149.0 -94.7 PHI 58 58 A 62 ILE N A 62 ILE CA A 62 ILE C A 63 LYS N 1.0 100.8 152.7 PSI 59 59 A 62 ILE C A 63 LYS N A 63 LYS CA A 63 LYS C 1.0 -163.1 -76.7 PHI 60 60 A 63 LYS N A 63 LYS CA A 63 LYS C A 64 LEU N 1.0 107.0 159.8 PSI 61 61 A 63 LYS C A 64 LEU N A 64 LEU CA A 64 LEU C 1.0 -127.2 -51.6 PHI 62 62 A 64 LEU N A 64 LEU CA A 64 LEU C A 65 THR N 1.0 108.5 161.2 PSI 63 63 A 64 LEU C A 65 THR N A 65 THR CA A 65 THR C 1.0 -129.8 -66.1 PHI 64 64 A 65 THR N A 65 THR CA A 65 THR C A 66 ALA N 1.0 85.7 187.2 PSI 65 65 A 65 THR C A 66 ALA N A 66 ALA CA A 66 ALA C 1.0 -81.9 -41.9 PHI 66 66 A 66 ALA N A 66 ALA CA A 66 ALA C A 67 ARG N 1.0 -48.5 -5.0 PSI 67 67 A 66 ALA C A 67 ARG N A 67 ARG CA A 67 ARG C 1.0 -104.0 -64.0 PHI 68 68 A 68 GLN N A 68 GLN CA A 68 GLN C A 69 PRO N 1.0 49.5 178.1 PSI 69 69 A 69 PRO C A 70 VAL N A 70 VAL CA A 70 VAL C 1.0 -190.7 -68.7 PHI 70 70 A 70 VAL N A 70 VAL CA A 70 VAL C A 71 GLY N 1.0 140.5 180.5 PSI 71 71 A 70 VAL C A 71 GLY N A 71 GLY CA A 71 GLY C 1.0 -246.9 -106.9 PHI 72 72 A 71 GLY N A 71 GLY CA A 71 GLY C A 72 PHE N 1.0 121.3 205.0 PSI 73 73 A 71 GLY C A 72 PHE N A 72 PHE CA A 72 PHE C 1.0 -146.4 -88.7 PHI 74 74 A 72 PHE N A 72 PHE CA A 72 PHE C A 73 VAL N 1.0 102.8 156.3 PSI 75 75 A 72 PHE C A 73 VAL N A 73 VAL CA A 73 VAL C 1.0 -152.3 -86.9 PHI 76 76 A 73 VAL N A 73 VAL CA A 73 VAL C A 74 ILE N 1.0 101.1 162.6 PSI 77 77 A 73 VAL C A 74 ILE N A 74 ILE CA A 74 ILE C 1.0 -159.5 -65.4 PHI 78 78 A 74 ILE N A 74 ILE CA A 74 ILE C A 75 PHE N 1.0 97.8 172.9 PSI 79 79 A 74 ILE C A 75 PHE N A 75 PHE CA A 75 PHE C 1.0 -170.0 -77.9 PHI 80 80 A 75 PHE N A 75 PHE CA A 75 PHE C A 76 ASP N 1.0 134.5 180.5 PSI 81 81 A 76 ASP C A 77 SER N A 77 SER CA A 77 SER C 1.0 -164.6 -49.8 PHI 82 82 A 77 SER N A 77 SER CA A 77 SER C A 78 ARG N 1.0 82.7 197.3 PSI 83 83 A 77 SER C A 78 ARG N A 78 ARG CA A 78 ARG C 1.0 -80.2 -40.2 PHI 84 84 A 78 ARG N A 78 ARG CA A 78 ARG C A 79 ALA N 1.0 -58.8 -18.8 PSI 85 85 A 78 ARG C A 79 ALA N A 79 ALA CA A 79 ALA C 1.0 -81.9 -41.9 PHI 86 86 A 79 ALA N A 79 ALA CA A 79 ALA C A 80 GLY N 1.0 -59.9 -19.9 PSI 87 87 A 79 ALA C A 80 GLY N A 80 GLY CA A 80 GLY C 1.0 -87.0 -47.0 PHI 88 88 A 80 GLY N A 80 GLY CA A 80 GLY C A 81 ALA N 1.0 -57.0 -17.0 PSI 89 89 A 80 GLY C A 81 ALA N A 81 ALA CA A 81 ALA C 1.0 -85.8 -45.8 PHI 90 90 A 81 ALA N A 81 ALA CA A 81 ALA C A 82 GLU N 1.0 -58.0 -18.0 PSI 91 91 A 81 ALA C A 82 GLU N A 82 GLU CA A 82 GLU C 1.0 -82.8 -42.8 PHI 92 92 A 82 GLU N A 82 GLU CA A 82 GLU C A 83 ALA N 1.0 -64.2 -24.2 PSI 93 93 A 82 GLU C A 83 ALA N A 83 ALA CA A 83 ALA C 1.0 -81.8 -41.8 PHI 94 94 A 83 ALA N A 83 ALA CA A 83 ALA C A 84 ALA N 1.0 -60.6 -20.6 PSI 95 95 A 83 ALA C A 84 ALA N A 84 ALA CA A 84 ALA C 1.0 -85.5 -45.5 PHI 96 96 A 84 ALA N A 84 ALA CA A 84 ALA C A 85 LYS N 1.0 -61.5 -21.5 PSI 97 97 A 84 ALA C A 85 LYS N A 85 LYS CA A 85 LYS C 1.0 -78.9 -38.9 PHI 98 98 A 85 LYS N A 85 LYS CA A 85 LYS C A 86 ASN N 1.0 -68.4 -28.4 PSI 99 99 A 85 LYS C A 86 ASN N A 86 ASN CA A 86 ASN C 1.0 -81.4 -41.4 PHI 100 100 A 86 ASN N A 86 ASN CA A 86 ASN C A 87 ALA N 1.0 -61.8 -12.1 PSI 101 101 A 86 ASN C A 87 ALA N A 87 ALA CA A 87 ALA C 1.0 -87.4 -45.8 PHI 102 102 A 87 ALA N A 87 ALA CA A 87 ALA C A 88 LEU N 1.0 -57.9 -17.9 PSI 103 103 A 87 ALA C A 88 LEU N A 88 LEU CA A 88 LEU C 1.0 -122.1 -69.7 PHI 104 104 A 88 LEU N A 88 LEU CA A 88 LEU C A 89 ASN N 1.0 -30.6 12.1 PSI 105 105 A 88 LEU C A 89 ASN N A 89 ASN CA A 89 ASN C 1.0 -78.3 -38.3 PHI 106 106 A 89 ASN N A 89 ASN CA A 89 ASN C A 90 GLY N 1.0 115.1 155.1 PSI 107 107 A 90 GLY C A 91 ILE N A 91 ILE CA A 91 ILE C 1.0 -181.9 -41.9 PHI 108 108 A 91 ILE N A 91 ILE CA A 91 ILE C A 92 ARG N 1.0 98.6 218.9 PSI 109 109 A 92 ARG C A 93 PHE N A 93 PHE CA A 93 PHE C 1.0 -119.3 -44.5 PHI 110 110 A 93 PHE N A 93 PHE CA A 93 PHE C A 94 ASP N 1.0 -72.7 3.4 PSI 111 111 A 93 PHE C A 94 ASP N A 94 ASP CA A 94 ASP C 1.0 -167.2 -90.1 PHI 112 112 A 94 ASP N A 94 ASP CA A 94 ASP C A 95 PRO N 1.0 72.6 190.6 PSI 113 113 A 95 PRO N A 95 PRO CA A 95 PRO C A 96 GLU N 1.0 -38.1 1.9 PSI 114 114 A 95 PRO C A 96 GLU N A 96 GLU CA A 96 GLU C 1.0 -117.9 -67.7 PHI 115 115 A 96 GLU N A 96 GLU CA A 96 GLU C A 97 ASN N 1.0 -24.6 28.7 PSI 116 116 A 96 GLU C A 97 ASN N A 97 ASN CA A 97 ASN C 1.0 -157.8 -27.1 PHI 117 117 A 97 ASN N A 97 ASN CA A 97 ASN C A 98 PRO N 1.0 49.8 179.8 PSI 118 118 A 99 GLN C A 100 THR N A 100 THR CA A 100 THR C 1.0 -141.1 -93.2 PHI 119 119 A 100 THR N A 100 THR CA A 100 THR C A 101 LEU N 1.0 133.1 185.3 PSI 120 120 A 100 THR C A 101 LEU N A 101 LEU CA A 101 LEU C 1.0 -155.7 -69.0 PHI 121 121 A 101 LEU N A 101 LEU CA A 101 LEU C A 102 ARG N 1.0 98.8 163.8 PSI 122 122 A 101 LEU C A 102 ARG N A 102 ARG CA A 102 ARG C 1.0 -148.4 -71.0 PHI 123 123 A 102 ARG N A 102 ARG CA A 102 ARG C A 103 LEU N 1.0 102.9 142.9 PSI 124 124 A 102 ARG C A 103 LEU N A 103 LEU CA A 103 LEU C 1.0 -156.0 -85.8 PHI 125 125 A 103 LEU N A 103 LEU CA A 103 LEU C A 104 GLU N 1.0 116.7 168.7 PSI 126 126 A 103 LEU C A 104 GLU N A 104 GLU CA A 104 GLU C 1.0 -156.7 -116.5 PHI 127 127 A 104 GLU N A 104 GLU CA A 104 GLU C A 105 PHE N 1.0 137.5 177.5 PSI 128 128 A 104 GLU C A 105 PHE N A 105 PHE CA A 105 PHE C 1.0 -90.9 -45.3 PHI 129 129 A 105 PHE N A 105 PHE CA A 105 PHE C A 106 ALA N 1.0 117.3 161.5 PSI 130 130 A 107 LYS C A 108 ALA N A 108 ALA CA A 108 ALA C 1.0 -190.6 -50.6 PHI 131 131 A 108 ALA N A 108 ALA CA A 108 ALA C A 109 ASN N 1.0 115.8 190.4 PSI 132 132 A 109 ASN C A 110 THR N A 110 THR CA A 110 THR C 1.0 -149.7 -9.7 PHI 133 133 A 110 THR N A 110 THR CA A 110 THR C A 111 LYS N 1.0 66.3 206.3 PSI 134 134 A 110 THR C A 111 LYS N A 111 LYS CA A 111 LYS C 1.0 -161.8 -21.8 PHI 135 135 A 111 LYS N A 111 LYS CA A 111 LYS C A 112 MET N 1.0 63.5 203.5 PSI 136 136 A 36 SER N A 36 SER CA A 36 SER CB A 36 SER OG 1.0 30.0 90.0 CHI1 137 137 A 60 SER N A 60 SER CA A 60 SER CB A 60 SER OG 1.0 30.0 90.0 CHI1 138 138 A 89 ASN N A 89 ASN CA A 89 ASN CB A 89 ASN CG 1.0 30.0 90.0 CHI1 139 139 A 75 PHE N A 75 PHE CA A 75 PHE CB A 75 PHE CG 1.0 -90.0 -30.0 CHI1 140 140 A 54 PHE N A 54 PHE CA A 54 PHE CB A 54 PHE CG 1.0 -90.0 -30.0 CHI1 141 141 A 51 PHE N A 51 PHE CA A 51 PHE CB A 51 PHE CG 1.0 -90.0 -30.0 CHI1 142 142 A 48 TYR N A 48 TYR CA A 48 TYR CB A 48 TYR CG 1.0 140.0 210.0 CHI1 143 143 A 93 PHE N A 93 PHE CA A 93 PHE CB A 93 PHE CG 1.0 140.0 210.0 CHI1 144 144 A 105 PHE N A 105 PHE CA A 105 PHE CB A 105 PHE CG 1.0 -90.0 -30.0 CHI1 145 145 A 103 LEU N A 103 LEU CA A 103 LEU CB A 103 LEU CG 1.0 -90.0 -30.0 CHI1 146 146 A 40 VAL N A 40 VAL CA A 40 VAL CB A 40 VAL CG1 1.0 30.0 90.0 CHI1 147 147 A 38 LEU N A 38 LEU CA A 38 LEU CB A 38 LEU CG 1.0 -90.0 -30.0 CHI1 148 148 A 47 LEU N A 47 LEU CA A 47 LEU CB A 47 LEU CG 1.0 -90.0 -30.0 CHI1 149 149 A 50 LEU N A 50 LEU CA A 50 LEU CB A 50 LEU CG 1.0 140.0 220.0 CHI1 150 150 A 88 LEU N A 88 LEU CA A 88 LEU CB A 88 LEU CG 1.0 -90.0 -30.0 CHI1 151 151 A 49 LEU N A 49 LEU CA A 49 LEU CB A 49 LEU CG 1.0 -100.0 -20.0 CHI1 152 152 A 49 LEU CA A 49 LEU CB A 49 LEU CG A 49 LEU CD1 1.0 -210.0 -150.0 CHI2 153 153 A 91 ILE N A 91 ILE CA A 91 ILE CB A 91 ILE CG1 1.0 140.0 210.0 CHI1 154 154 A 45 ARG N A 45 ARG CA A 45 ARG CB A 45 ARG CG 1.0 30.0 90.0 CHI1 155 155 B 28 GLU C B 29 GLU N B 29 GLU CA B 29 GLU C 1.0 -135.6 -48.5 PHI 156 156 B 29 GLU N B 29 GLU CA B 29 GLU C B 30 VAL N 1.0 96.4 178.9 PSI 157 157 B 29 GLU C B 30 VAL N B 30 VAL CA B 30 VAL C 1.0 -104.2 -43.4 PHI 158 158 B 30 VAL N B 30 VAL CA B 30 VAL C B 31 ARG N 1.0 112.1 152.1 PSI 159 159 B 30 VAL C B 31 ARG N B 31 ARG CA B 31 ARG C 1.0 -201.1 -61.1 PHI 160 160 B 31 ARG C B 32 THR N B 32 THR CA B 32 THR C 1.0 -160.6 -65.6 PHI 161 161 B 32 THR N B 32 THR CA B 32 THR C B 33 LEU N 1.0 106.5 162.8 PSI 162 162 B 32 THR C B 33 LEU N B 33 LEU CA B 33 LEU C 1.0 -146.4 -89.5 PHI 163 163 B 33 LEU N B 33 LEU CA B 33 LEU C B 34 PHE N 1.0 113.1 170.6 PSI 164 164 B 33 LEU C B 34 PHE N B 34 PHE CA B 34 PHE C 1.0 -151.6 -76.7 PHI 165 165 B 34 PHE N B 34 PHE CA B 34 PHE C B 35 VAL N 1.0 99.3 139.3 PSI 166 166 B 34 PHE C B 35 VAL N B 35 VAL CA B 35 VAL C 1.0 -140.4 -98.0 PHI 167 167 B 35 VAL N B 35 VAL CA B 35 VAL C B 36 SER N 1.0 109.3 149.3 PSI 168 168 B 35 VAL C B 36 SER N B 36 SER CA B 36 SER C 1.0 -169.1 -92.3 PHI 169 169 B 36 SER N B 36 SER CA B 36 SER C B 37 GLY N 1.0 104.5 204.3 PSI 170 170 B 36 SER C B 37 GLY N B 37 GLY CA B 37 GLY C 1.0 18.8 116.8 PHI 171 171 B 37 GLY N B 37 GLY CA B 37 GLY C B 38 LEU N 1.0 -17.8 72.5 PSI 172 172 B 37 GLY C B 38 LEU N B 38 LEU CA B 38 LEU C 1.0 -144.6 -52.4 PHI 173 173 B 38 LEU N B 38 LEU CA B 38 LEU C B 39 PRO N 1.0 66.1 189.4 PSI 174 174 B 39 PRO N B 39 PRO CA B 39 PRO C B 40 VAL N 1.0 124.1 183.7 PSI 175 175 B 39 PRO C B 40 VAL N B 40 VAL CA B 40 VAL C 1.0 -86.1 -44.0 PHI 176 176 B 40 VAL N B 40 VAL CA B 40 VAL C B 41 ASP N 1.0 -44.1 7.6 PSI 177 177 B 40 VAL C B 41 ASP N B 41 ASP CA B 41 ASP C 1.0 -127.7 -82.5 PHI 178 178 B 41 ASP N B 41 ASP CA B 41 ASP C B 42 ILE N 1.0 -33.6 40.4 PSI 179 179 B 41 ASP C B 42 ILE N B 42 ILE CA B 42 ILE C 1.0 -137.8 -49.8 PHI 180 180 B 42 ILE N B 42 ILE CA B 42 ILE C B 43 LYS N 1.0 98.6 150.2 PSI 181 181 B 42 ILE C B 43 LYS N B 43 LYS CA B 43 LYS C 1.0 -130.7 -36.7 PHI 182 182 B 43 LYS N B 43 LYS CA B 43 LYS C B 44 PRO N 1.0 100.2 183.8 PSI 183 183 B 44 PRO N B 44 PRO CA B 44 PRO C B 45 ARG N 1.0 -57.1 -17.1 PSI 184 184 B 44 PRO C B 45 ARG N B 45 ARG CA B 45 ARG C 1.0 -86.4 -46.4 PHI 185 185 B 45 ARG N B 45 ARG CA B 45 ARG C B 46 GLU N 1.0 -51.8 -10.8 PSI 186 186 B 45 ARG C B 46 GLU N B 46 GLU CA B 46 GLU C 1.0 -83.7 -43.7 PHI 187 187 B 46 GLU N B 46 GLU CA B 46 GLU C B 47 LEU N 1.0 -64.8 -24.8 PSI 188 188 B 46 GLU C B 47 LEU N B 47 LEU CA B 47 LEU C 1.0 -83.3 -43.3 PHI 189 189 B 47 LEU N B 47 LEU CA B 47 LEU C B 48 TYR N 1.0 -57.1 -9.0 PSI 190 190 B 47 LEU C B 48 TYR N B 48 TYR CA B 48 TYR C 1.0 -86.9 -46.9 PHI 191 191 B 48 TYR N B 48 TYR CA B 48 TYR C B 49 LEU N 1.0 -53.4 -13.4 PSI 192 192 B 48 TYR C B 49 LEU N B 49 LEU CA B 49 LEU C 1.0 -80.7 -40.7 PHI 193 193 B 49 LEU N B 49 LEU CA B 49 LEU C B 50 LEU N 1.0 -60.5 -20.5 PSI 194 194 B 49 LEU C B 50 LEU N B 50 LEU CA B 50 LEU C 1.0 -91.4 -43.0 PHI 195 195 B 50 LEU N B 50 LEU CA B 50 LEU C B 51 PHE N 1.0 -60.6 -20.6 PSI 196 196 B 50 LEU C B 51 PHE N B 51 PHE CA B 51 PHE C 1.0 -131.5 -63.0 PHI 197 197 B 51 PHE N B 51 PHE CA B 51 PHE C B 52 ARG N 1.0 -55.9 14.1 PSI 198 198 B 53 PRO N B 53 PRO CA B 53 PRO C B 54 PHE N 1.0 -42.4 -2.4 PSI 199 199 B 54 PHE C B 55 LYS N B 55 LYS CA B 55 LYS C 1.0 -80.6 -36.5 PHI 200 200 B 55 LYS N B 55 LYS CA B 55 LYS C B 56 GLY N 1.0 109.6 160.5 PSI 201 201 B 56 GLY C B 57 TYR N B 57 TYR CA B 57 TYR C 1.0 -105.0 -45.6 PHI 202 202 B 57 TYR N B 57 TYR CA B 57 TYR C B 58 GLU N 1.0 91.1 153.8 PSI 203 203 B 57 TYR C B 58 GLU N B 58 GLU CA B 58 GLU C 1.0 -121.1 -74.8 PHI 204 204 B 58 GLU N B 58 GLU CA B 58 GLU C B 59 GLY N 1.0 -59.8 -13.5 PSI 205 205 B 58 GLU C B 59 GLY N B 59 GLY CA B 59 GLY C 1.0 -241.0 -101.0 PHI 206 206 B 59 GLY N B 59 GLY CA B 59 GLY C B 60 SER N 1.0 143.3 187.3 PSI 207 207 B 59 GLY C B 60 SER N B 60 SER CA B 60 SER C 1.0 -171.7 -109.9 PHI 208 208 B 60 SER N B 60 SER CA B 60 SER C B 61 LEU N 1.0 138.2 178.2 PSI 209 209 B 60 SER C B 61 LEU N B 61 LEU CA B 61 LEU C 1.0 -184.2 -89.3 PHI 210 210 B 61 LEU N B 61 LEU CA B 61 LEU C B 62 ILE N 1.0 105.4 175.8 PSI 211 211 B 61 LEU C B 62 ILE N B 62 ILE CA B 62 ILE C 1.0 -149.0 -94.7 PHI 212 212 B 62 ILE N B 62 ILE CA B 62 ILE C B 63 LYS N 1.0 100.8 152.7 PSI 213 213 B 62 ILE C B 63 LYS N B 63 LYS CA B 63 LYS C 1.0 -163.1 -76.7 PHI 214 214 B 63 LYS N B 63 LYS CA B 63 LYS C B 64 LEU N 1.0 107.0 159.8 PSI 215 215 B 63 LYS C B 64 LEU N B 64 LEU CA B 64 LEU C 1.0 -127.2 -51.6 PHI 216 216 B 64 LEU N B 64 LEU CA B 64 LEU C B 65 THR N 1.0 108.5 161.2 PSI 217 217 B 64 LEU C B 65 THR N B 65 THR CA B 65 THR C 1.0 -129.8 -66.1 PHI 218 218 B 65 THR N B 65 THR CA B 65 THR C B 66 ALA N 1.0 85.7 187.2 PSI 219 219 B 65 THR C B 66 ALA N B 66 ALA CA B 66 ALA C 1.0 -81.9 -41.9 PHI 220 220 B 66 ALA N B 66 ALA CA B 66 ALA C B 67 ARG N 1.0 -48.5 -5.0 PSI 221 221 B 66 ALA C B 67 ARG N B 67 ARG CA B 67 ARG C 1.0 -104.0 -64.0 PHI 222 222 B 68 GLN N B 68 GLN CA B 68 GLN C B 69 PRO N 1.0 49.5 178.1 PSI 223 223 B 69 PRO C B 70 VAL N B 70 VAL CA B 70 VAL C 1.0 -190.7 -68.7 PHI 224 224 B 70 VAL N B 70 VAL CA B 70 VAL C B 71 GLY N 1.0 140.5 180.5 PSI 225 225 B 70 VAL C B 71 GLY N B 71 GLY CA B 71 GLY C 1.0 -246.9 -106.9 PHI 226 226 B 71 GLY N B 71 GLY CA B 71 GLY C B 72 PHE N 1.0 121.3 205.0 PSI 227 227 B 71 GLY C B 72 PHE N B 72 PHE CA B 72 PHE C 1.0 -146.4 -88.7 PHI 228 228 B 72 PHE N B 72 PHE CA B 72 PHE C B 73 VAL N 1.0 102.8 156.3 PSI 229 229 B 72 PHE C B 73 VAL N B 73 VAL CA B 73 VAL C 1.0 -152.3 -86.9 PHI 230 230 B 73 VAL N B 73 VAL CA B 73 VAL C B 74 ILE N 1.0 101.1 162.6 PSI 231 231 B 73 VAL C B 74 ILE N B 74 ILE CA B 74 ILE C 1.0 -159.5 -65.4 PHI 232 232 B 74 ILE N B 74 ILE CA B 74 ILE C B 75 PHE N 1.0 97.8 172.9 PSI 233 233 B 74 ILE C B 75 PHE N B 75 PHE CA B 75 PHE C 1.0 -170.0 -77.9 PHI 234 234 B 75 PHE N B 75 PHE CA B 75 PHE C B 76 ASP N 1.0 134.5 180.5 PSI 235 235 B 76 ASP C B 77 SER N B 77 SER CA B 77 SER C 1.0 -164.6 -49.8 PHI 236 236 B 77 SER N B 77 SER CA B 77 SER C B 78 ARG N 1.0 82.7 197.3 PSI 237 237 B 77 SER C B 78 ARG N B 78 ARG CA B 78 ARG C 1.0 -80.2 -40.2 PHI 238 238 B 78 ARG N B 78 ARG CA B 78 ARG C B 79 ALA N 1.0 -58.8 -18.8 PSI 239 239 B 78 ARG C B 79 ALA N B 79 ALA CA B 79 ALA C 1.0 -81.9 -41.9 PHI 240 240 B 79 ALA N B 79 ALA CA B 79 ALA C B 80 GLY N 1.0 -59.9 -19.9 PSI 241 241 B 79 ALA C B 80 GLY N B 80 GLY CA B 80 GLY C 1.0 -87.0 -47.0 PHI 242 242 B 80 GLY N B 80 GLY CA B 80 GLY C B 81 ALA N 1.0 -57.0 -17.0 PSI 243 243 B 80 GLY C B 81 ALA N B 81 ALA CA B 81 ALA C 1.0 -85.8 -45.8 PHI 244 244 B 81 ALA N B 81 ALA CA B 81 ALA C B 82 GLU N 1.0 -58.0 -18.0 PSI 245 245 B 81 ALA C B 82 GLU N B 82 GLU CA B 82 GLU C 1.0 -82.8 -42.8 PHI 246 246 B 82 GLU N B 82 GLU CA B 82 GLU C B 83 ALA N 1.0 -64.2 -24.2 PSI 247 247 B 82 GLU C B 83 ALA N B 83 ALA CA B 83 ALA C 1.0 -81.8 -41.8 PHI 248 248 B 83 ALA N B 83 ALA CA B 83 ALA C B 84 ALA N 1.0 -60.6 -20.6 PSI 249 249 B 83 ALA C B 84 ALA N B 84 ALA CA B 84 ALA C 1.0 -85.5 -45.5 PHI 250 250 B 84 ALA N B 84 ALA CA B 84 ALA C B 85 LYS N 1.0 -61.5 -21.5 PSI 251 251 B 84 ALA C B 85 LYS N B 85 LYS CA B 85 LYS C 1.0 -78.9 -38.9 PHI 252 252 B 85 LYS N B 85 LYS CA B 85 LYS C B 86 ASN N 1.0 -68.4 -28.4 PSI 253 253 B 85 LYS C B 86 ASN N B 86 ASN CA B 86 ASN C 1.0 -81.4 -41.4 PHI 254 254 B 86 ASN N B 86 ASN CA B 86 ASN C B 87 ALA N 1.0 -61.8 -12.1 PSI 255 255 B 86 ASN C B 87 ALA N B 87 ALA CA B 87 ALA C 1.0 -87.4 -45.8 PHI 256 256 B 87 ALA N B 87 ALA CA B 87 ALA C B 88 LEU N 1.0 -57.9 -17.9 PSI 257 257 B 87 ALA C B 88 LEU N B 88 LEU CA B 88 LEU C 1.0 -122.1 -69.7 PHI 258 258 B 88 LEU N B 88 LEU CA B 88 LEU C B 89 ASN N 1.0 -30.6 12.1 PSI 259 259 B 88 LEU C B 89 ASN N B 89 ASN CA B 89 ASN C 1.0 -78.3 -38.3 PHI 260 260 B 89 ASN N B 89 ASN CA B 89 ASN C B 90 GLY N 1.0 115.1 155.1 PSI 261 261 B 90 GLY C B 91 ILE N B 91 ILE CA B 91 ILE C 1.0 -181.9 -41.9 PHI 262 262 B 91 ILE N B 91 ILE CA B 91 ILE C B 92 ARG N 1.0 98.6 218.9 PSI 263 263 B 92 ARG C B 93 PHE N B 93 PHE CA B 93 PHE C 1.0 -119.3 -44.5 PHI 264 264 B 93 PHE N B 93 PHE CA B 93 PHE C B 94 ASP N 1.0 -72.7 3.4 PSI 265 265 B 93 PHE C B 94 ASP N B 94 ASP CA B 94 ASP C 1.0 -167.2 -90.1 PHI 266 266 B 94 ASP N B 94 ASP CA B 94 ASP C B 95 PRO N 1.0 72.6 190.6 PSI 267 267 B 95 PRO N B 95 PRO CA B 95 PRO C B 96 GLU N 1.0 -38.1 1.9 PSI 268 268 B 95 PRO C B 96 GLU N B 96 GLU CA B 96 GLU C 1.0 -117.9 -67.7 PHI 269 269 B 96 GLU N B 96 GLU CA B 96 GLU C B 97 ASN N 1.0 -24.6 28.7 PSI 270 270 B 96 GLU C B 97 ASN N B 97 ASN CA B 97 ASN C 1.0 -157.8 -27.1 PHI 271 271 B 97 ASN N B 97 ASN CA B 97 ASN C B 98 PRO N 1.0 49.8 179.8 PSI 272 272 B 99 GLN C B 100 THR N B 100 THR CA B 100 THR C 1.0 -141.1 -93.2 PHI 273 273 B 100 THR N B 100 THR CA B 100 THR C B 101 LEU N 1.0 133.1 185.3 PSI 274 274 B 100 THR C B 101 LEU N B 101 LEU CA B 101 LEU C 1.0 -155.7 -69.0 PHI 275 275 B 101 LEU N B 101 LEU CA B 101 LEU C B 102 ARG N 1.0 98.8 163.8 PSI 276 276 B 101 LEU C B 102 ARG N B 102 ARG CA B 102 ARG C 1.0 -148.4 -71.0 PHI 277 277 B 102 ARG N B 102 ARG CA B 102 ARG C B 103 LEU N 1.0 102.9 142.9 PSI 278 278 B 102 ARG C B 103 LEU N B 103 LEU CA B 103 LEU C 1.0 -156.0 -85.8 PHI 279 279 B 103 LEU N B 103 LEU CA B 103 LEU C B 104 GLU N 1.0 116.7 168.7 PSI 280 280 B 103 LEU C B 104 GLU N B 104 GLU CA B 104 GLU C 1.0 -156.7 -116.5 PHI 281 281 B 104 GLU N B 104 GLU CA B 104 GLU C B 105 PHE N 1.0 137.5 177.5 PSI 282 282 B 104 GLU C B 105 PHE N B 105 PHE CA B 105 PHE C 1.0 -90.9 -45.3 PHI 283 283 B 105 PHE N B 105 PHE CA B 105 PHE C B 106 ALA N 1.0 117.3 161.5 PSI 284 284 B 107 LYS C B 108 ALA N B 108 ALA CA B 108 ALA C 1.0 -190.6 -50.6 PHI 285 285 B 108 ALA N B 108 ALA CA B 108 ALA C B 109 ASN N 1.0 115.8 190.4 PSI 286 286 B 109 ASN C B 110 THR N B 110 THR CA B 110 THR C 1.0 -149.7 -9.7 PHI 287 287 B 110 THR N B 110 THR CA B 110 THR C B 111 LYS N 1.0 66.3 206.3 PSI 288 288 B 110 THR C B 111 LYS N B 111 LYS CA B 111 LYS C 1.0 -161.8 -21.8 PHI 289 289 B 111 LYS N B 111 LYS CA B 111 LYS C B 112 MET N 1.0 63.5 203.5 PSI 290 290 B 36 SER N B 36 SER CA B 36 SER CB B 36 SER OG 1.0 30.0 90.0 CHI1 291 291 B 60 SER N B 60 SER CA B 60 SER CB B 60 SER OG 1.0 30.0 90.0 CHI1 292 292 B 89 ASN N B 89 ASN CA B 89 ASN CB B 89 ASN CG 1.0 30.0 90.0 CHI1 293 293 B 75 PHE N B 75 PHE CA B 75 PHE CB B 75 PHE CG 1.0 -90.0 -30.0 CHI1 294 294 B 54 PHE N B 54 PHE CA B 54 PHE CB B 54 PHE CG 1.0 -90.0 -30.0 CHI1 295 295 B 51 PHE N B 51 PHE CA B 51 PHE CB B 51 PHE CG 1.0 -90.0 -30.0 CHI1 296 296 B 48 TYR N B 48 TYR CA B 48 TYR CB B 48 TYR CG 1.0 140.0 210.0 CHI1 297 297 B 93 PHE N B 93 PHE CA B 93 PHE CB B 93 PHE CG 1.0 140.0 210.0 CHI1 298 298 B 105 PHE N B 105 PHE CA B 105 PHE CB B 105 PHE CG 1.0 -90.0 -30.0 CHI1 299 299 B 103 LEU N B 103 LEU CA B 103 LEU CB B 103 LEU CG 1.0 -90.0 -30.0 CHI1 300 300 B 40 VAL N B 40 VAL CA B 40 VAL CB B 40 VAL CG1 1.0 30.0 90.0 CHI1 301 301 B 38 LEU N B 38 LEU CA B 38 LEU CB B 38 LEU CG 1.0 -90.0 -30.0 CHI1 302 302 B 47 LEU N B 47 LEU CA B 47 LEU CB B 47 LEU CG 1.0 -90.0 -30.0 CHI1 303 303 B 50 LEU N B 50 LEU CA B 50 LEU CB B 50 LEU CG 1.0 140.0 220.0 CHI1 304 304 B 88 LEU N B 88 LEU CA B 88 LEU CB B 88 LEU CG 1.0 -90.0 -30.0 CHI1 305 305 B 49 LEU N B 49 LEU CA B 49 LEU CB B 49 LEU CG 1.0 -100.0 -20.0 CHI1 306 306 B 49 LEU CA B 49 LEU CB B 49 LEU CG B 49 LEU CD1 1.0 -210.0 -150.0 CHI2 307 307 B 91 ILE N B 91 ILE CA B 91 ILE CB B 91 ILE CG1 1.0 140.0 210.0 CHI1 308 308 B 45 ARG N B 45 ARG CA B 45 ARG CB B 45 ARG CG 1.0 30.0 90.0 CHI1 stop_ save_