data_nef_c19215_2m7w 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 2LP7 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY start . false 2 A 2 TYR middle . . 3 A 3 ILE middle . . 4 A 4 PRO middle . false 5 A 5 GLU middle . . 6 A 6 ALA middle . . 7 A 7 PRO middle . false 8 A 8 ARG middle . . 9 A 9 ASP middle . . 10 A 10 GLY middle . false 11 A 11 GLN middle . . 12 A 12 ALA middle . . 13 A 13 TYR middle . . 14 A 14 VAL middle . . 15 A 15 ARG middle . . 16 A 16 LYS middle . . 17 A 17 ASP middle . . 18 A 18 GLY middle . false 19 A 19 GLU middle . . 20 A 20 TRP middle . . 21 A 21 VAL middle . . 22 A 22 LEU middle . . 23 A 23 LEU middle . . 24 A 24 SER middle . . 25 A 25 THR middle . . 26 A 26 PHE middle . . 27 A 27 LEU middle . . 28 A 28 GLY middle . false 29 A 29 SER middle . . 30 A 30 SER middle . . 31 A 31 GLY middle . false 32 A 32 ASN middle . . 33 A 33 GLU middle . . 34 A 34 GLN middle . . 35 A 35 GLU middle . . 36 A 36 LEU middle . . 37 A 37 LEU middle . . 38 A 38 GLU middle . . 39 A 39 LEU middle . . 40 A 40 ASP middle . . 41 A 41 LYS middle . . 42 A 42 TRP middle . . 43 A 43 ALA middle . . 44 A 44 SER middle . . 45 A 45 LEU middle . . 46 A 46 TRP middle . . 47 A 47 ASN middle . . 48 A 48 TRP middle . . 49 A 49 PHE middle . . 50 A 50 ASN middle . . 51 A 51 ILE middle . . 52 A 52 THR middle . . 53 A 53 ASN middle . . 54 A 54 TRP middle . . 55 A 55 LEU middle . . 56 A 56 TRP middle . . 57 A 57 TYR middle . . 58 A 58 ILE middle . . 59 A 59 LYS end . . 60 B 1 GLY start . false 61 B 2 TYR middle . . 62 B 3 ILE middle . . 63 B 4 PRO middle . false 64 B 5 GLU middle . . 65 B 6 ALA middle . . 66 B 7 PRO middle . false 67 B 8 ARG middle . . 68 B 9 ASP middle . . 69 B 10 GLY middle . false 70 B 11 GLN middle . . 71 B 12 ALA middle . . 72 B 13 TYR middle . . 73 B 14 VAL middle . . 74 B 15 ARG middle . . 75 B 16 LYS middle . . 76 B 17 ASP middle . . 77 B 18 GLY middle . false 78 B 19 GLU middle . . 79 B 20 TRP middle . . 80 B 21 VAL middle . . 81 B 22 LEU middle . . 82 B 23 LEU middle . . 83 B 24 SER middle . . 84 B 25 THR middle . . 85 B 26 PHE middle . . 86 B 27 LEU middle . . 87 B 28 GLY middle . false 88 B 29 SER middle . . 89 B 30 SER middle . . 90 B 31 GLY middle . false 91 B 32 ASN middle . . 92 B 33 GLU middle . . 93 B 34 GLN middle . . 94 B 35 GLU middle . . 95 B 36 LEU middle . . 96 B 37 LEU middle . . 97 B 38 GLU middle . . 98 B 39 LEU middle . . 99 B 40 ASP middle . . 100 B 41 LYS middle . . 101 B 42 TRP middle . . 102 B 43 ALA middle . . 103 B 44 SER middle . . 104 B 45 LEU middle . . 105 B 46 TRP middle . . 106 B 47 ASN middle . . 107 B 48 TRP middle . . 108 B 49 PHE middle . . 109 B 50 ASN middle . . 110 B 51 ILE middle . . 111 B 52 THR middle . . 112 B 53 ASN middle . . 113 B 54 TRP middle . . 114 B 55 LEU middle . . 115 B 56 TRP middle . . 116 B 57 TYR middle . . 117 B 58 ILE middle . . 118 B 59 LYS end . . 119 C 1 GLY start . false 120 C 2 TYR middle . . 121 C 3 ILE middle . . 122 C 4 PRO middle . false 123 C 5 GLU middle . . 124 C 6 ALA middle . . 125 C 7 PRO middle . false 126 C 8 ARG middle . . 127 C 9 ASP middle . . 128 C 10 GLY middle . false 129 C 11 GLN middle . . 130 C 12 ALA middle . . 131 C 13 TYR middle . . 132 C 14 VAL middle . . 133 C 15 ARG middle . . 134 C 16 LYS middle . . 135 C 17 ASP middle . . 136 C 18 GLY middle . false 137 C 19 GLU middle . . 138 C 20 TRP middle . . 139 C 21 VAL middle . . 140 C 22 LEU middle . . 141 C 23 LEU middle . . 142 C 24 SER middle . . 143 C 25 THR middle . . 144 C 26 PHE middle . . 145 C 27 LEU middle . . 146 C 28 GLY middle . false 147 C 29 SER middle . . 148 C 30 SER middle . . 149 C 31 GLY middle . false 150 C 32 ASN middle . . 151 C 33 GLU middle . . 152 C 34 GLN middle . . 153 C 35 GLU middle . . 154 C 36 LEU middle . . 155 C 37 LEU middle . . 156 C 38 GLU middle . . 157 C 39 LEU middle . . 158 C 40 ASP middle . . 159 C 41 LYS middle . . 160 C 42 TRP middle . . 161 C 43 ALA middle . . 162 C 44 SER middle . . 163 C 45 LEU middle . . 164 C 46 TRP middle . . 165 C 47 ASN middle . . 166 C 48 TRP middle . . 167 C 49 PHE middle . . 168 C 50 ASN middle . . 169 C 51 ILE middle . . 170 C 52 THR middle . . 171 C 53 ASN middle . . 172 C 54 TRP middle . . 173 C 55 LEU middle . . 174 C 56 TRP middle . . 175 C 57 TYR middle . . 176 C 58 ILE middle . . 177 C 59 LYS 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 2 TYR H H 1 7.951 0.020 A 2 TYR C C 13 176.535 0.3 A 2 TYR CA C 13 55.995 0.3 A 2 TYR CB C 13 37.313 0.3 A 2 TYR N N 15 120.470 0.3 A 3 ILE H H 1 8.381 0.020 A 3 ILE CA C 13 58.968 0.3 A 3 ILE CB C 13 38.074 0.3 A 3 ILE N N 15 118.307 0.3 A 5 GLU H H 1 7.710 0.020 A 5 GLU HA H 1 4.255 0.020 A 5 GLU C C 13 176.267 0.3 A 5 GLU CA C 13 55.959 0.3 A 5 GLU CB C 13 30.034 0.3 A 5 GLU N N 15 118.785 0.3 A 6 ALA H H 1 8.338 0.020 A 6 ALA HA H 1 3.575 0.020 A 6 ALA HB% H 1 -0.416 0.020 A 6 ALA CA C 13 50.959 0.3 A 6 ALA CB C 13 14.389 0.3 A 6 ALA N N 15 131.546 0.3 A 8 ARG H H 1 8.725 0.020 A 8 ARG HA H 1 4.070 0.020 A 8 ARG HD2 H 1 3.128 0.020 A 8 ARG HD3 H 1 3.128 0.020 A 8 ARG HG2 H 1 1.715 0.020 A 8 ARG HG3 H 1 1.715 0.020 A 8 ARG C C 13 175.110 0.3 A 8 ARG CA C 13 54.699 0.3 A 8 ARG CB C 13 28.078 0.3 A 8 ARG N N 15 126.915 0.3 A 9 ASP H H 1 8.432 0.020 A 9 ASP C C 13 178.015 0.3 A 9 ASP CA C 13 52.747 0.3 A 9 ASP CB C 13 40.844 0.3 A 9 ASP N N 15 123.653 0.3 A 10 GLY H H 1 9.727 0.020 A 10 GLY C C 13 174.822 0.3 A 10 GLY CA C 13 45.244 0.3 A 10 GLY N N 15 111.908 0.3 A 11 GLN H H 1 8.416 0.020 A 11 GLN C C 13 174.711 0.3 A 11 GLN CA C 13 53.398 0.3 A 11 GLN CB C 13 30.306 0.3 A 11 GLN N N 15 118.395 0.3 A 12 ALA H H 1 7.933 0.020 A 12 ALA HA H 1 4.943 0.020 A 12 ALA HB% H 1 0.718 0.020 A 12 ALA C C 13 177.990 0.3 A 12 ALA CA C 13 50.511 0.3 A 12 ALA CB C 13 20.147 0.3 A 12 ALA N N 15 121.020 0.3 A 13 TYR H H 1 9.575 0.020 A 13 TYR C C 13 175.519 0.3 A 13 TYR CA C 13 59.090 0.3 A 13 TYR CB C 13 43.180 0.3 A 13 TYR N N 15 121.755 0.3 A 14 VAL H H 1 9.659 0.020 A 14 VAL HB H 1 2.668 0.020 A 14 VAL HG1% H 1 1.056 0.020 A 14 VAL HG2% H 1 0.790 0.020 A 14 VAL C C 13 174.074 0.3 A 14 VAL CA C 13 59.090 0.3 A 14 VAL CB C 13 32.750 0.3 A 14 VAL N N 15 112.251 0.3 A 15 ARG H H 1 8.503 0.020 A 15 ARG C C 13 174.948 0.3 A 15 ARG CA C 13 53.520 0.3 A 15 ARG CB C 13 32.533 0.3 A 15 ARG N N 15 124.657 0.3 A 16 LYS H H 1 9.052 0.020 A 16 LYS C C 13 175.974 0.3 A 16 LYS CA C 13 55.776 0.3 A 16 LYS CB C 13 36.553 0.3 A 16 LYS N N 15 128.240 0.3 A 17 ASP H H 1 10.886 0.020 A 17 ASP C C 13 175.822 0.3 A 17 ASP CA C 13 56.447 0.3 A 17 ASP CB C 13 40.192 0.3 A 17 ASP N N 15 130.562 0.3 A 18 GLY H H 1 9.353 0.020 A 18 GLY C C 13 173.104 0.3 A 18 GLY CA C 13 45.244 0.3 A 18 GLY N N 15 104.754 0.3 A 19 GLU H H 1 7.813 0.020 A 19 GLU HA H 1 4.648 0.020 A 19 GLU HB3 H 1 2.151 0.020 A 19 GLU HGx H 1 2.276 0.020 A 19 GLU HGy H 1 2.358 0.020 A 19 GLU C C 13 176.166 0.3 A 19 GLU CA C 13 53.865 0.3 A 19 GLU CB C 13 33.130 0.3 A 19 GLU N N 15 117.501 0.3 A 20 TRP H H 1 9.094 0.020 A 20 TRP HA H 1 4.667 0.020 A 20 TRP HB2 H 1 3.178 0.020 A 20 TRP HB3 H 1 3.178 0.020 A 20 TRP HE1 H 1 10.317 0.020 A 20 TRP C C 13 176.302 0.3 A 20 TRP CA C 13 55.878 0.3 A 20 TRP CB C 13 29.545 0.3 A 20 TRP N N 15 122.768 0.3 A 20 TRP NE1 N 15 131.575 0.3 A 21 VAL H H 1 9.868 0.020 A 21 VAL HA H 1 4.985 0.020 A 21 VAL HB H 1 2.247 0.020 A 21 VAL HG1% H 1 1.129 0.020 A 21 VAL HG2% H 1 1.059 0.020 A 21 VAL C C 13 175.640 0.3 A 21 VAL CA C 13 59.537 0.3 A 21 VAL CB C 13 34.651 0.3 A 21 VAL CG1 C 13 22.664 0.3 A 21 VAL N N 15 123.071 0.3 A 22 LEU H H 1 8.812 0.020 A 22 LEU HA H 1 4.422 0.020 A 22 LEU HB2 H 1 1.632 0.020 A 22 LEU HB3 H 1 1.632 0.020 A 22 LEU HD1% H 1 0.819 0.020 A 22 LEU HD2% H 1 0.856 0.020 A 22 LEU C C 13 179.268 0.3 A 22 LEU CA C 13 55.634 0.3 A 22 LEU CB C 13 41.279 0.3 A 22 LEU N N 15 127.193 0.3 A 23 LEU H H 1 8.562 0.020 A 23 LEU C C 13 178.844 0.3 A 23 LEU CA C 13 57.403 0.3 A 23 LEU CB C 13 41.061 0.3 A 23 LEU N N 15 126.386 0.3 A 24 SER H H 1 9.098 0.020 A 24 SER HA H 1 4.621 0.020 A 24 SER HB2 H 1 3.835 0.020 A 24 SER HB3 H 1 3.835 0.020 A 24 SER C C 13 176.676 0.3 A 24 SER CA C 13 60.960 0.3 A 24 SER CB C 13 61.650 0.3 A 24 SER N N 15 113.100 0.3 A 25 THR H H 1 7.238 0.020 A 25 THR HA H 1 3.915 0.020 A 25 THR HB H 1 3.548 0.020 A 25 THR HG2% H 1 0.851 0.020 A 25 THR CA C 13 64.599 0.3 A 25 THR CB C 13 68.657 0.3 A 25 THR CG2 C 13 21.953 0.3 A 25 THR N N 15 116.715 0.3 A 26 PHE H H 1 7.945 0.020 A 26 PHE HA H 1 4.110 0.020 A 26 PHE C C 13 176.181 0.3 A 26 PHE CA C 13 58.627 0.3 A 26 PHE CB C 13 39.793 0.3 A 26 PHE N N 15 118.488 0.3 A 27 LEU H H 1 7.290 0.020 A 27 LEU HA H 1 4.523 0.020 A 27 LEU HB2 H 1 1.824 0.020 A 27 LEU HB3 H 1 1.824 0.020 A 27 LEU HD1% H 1 0.827 0.020 A 27 LEU HD2% H 1 0.827 0.020 A 27 LEU C C 13 177.752 0.3 A 27 LEU CA C 13 54.679 0.3 A 27 LEU CB C 13 41.333 0.3 A 27 LEU N N 15 118.525 0.3 A 28 GLY H H 1 8.242 0.020 A 28 GLY HA2 H 1 4.079 0.020 A 28 GLY HA3 H 1 4.079 0.020 A 28 GLY C C 13 174.630 0.3 A 28 GLY CA C 13 45.374 0.3 A 28 GLY N N 15 108.823 0.3 A 29 SER H H 1 8.310 0.020 A 29 SER HA H 1 4.626 0.020 A 29 SER HBx H 1 3.858 0.020 A 29 SER HBy H 1 3.903 0.020 A 29 SER C C 13 175.312 0.3 A 29 SER CA C 13 57.992 0.3 A 29 SER CB C 13 63.605 0.3 A 29 SER N N 15 116.210 0.3 A 30 SER H H 1 8.593 0.020 A 30 SER HA H 1 4.597 0.020 A 30 SER HBx H 1 3.903 0.020 A 30 SER HBy H 1 3.923 0.020 A 30 SER C C 13 175.479 0.3 A 30 SER CA C 13 58.582 0.3 A 30 SER CB C 13 63.605 0.3 A 30 SER N N 15 118.892 0.3 A 31 GLY H H 1 8.584 0.020 A 31 GLY HA2 H 1 4.059 0.020 A 31 GLY HA3 H 1 4.059 0.020 A 31 GLY C C 13 174.428 0.3 A 31 GLY CA C 13 45.456 0.3 A 31 GLY N N 15 111.354 0.3 A 32 ASN H H 1 8.393 0.020 A 32 ASN HA H 1 4.817 0.020 A 32 ASN HBx H 1 2.826 0.020 A 32 ASN HBy H 1 2.888 0.020 A 32 ASN HD21 H 1 7.663 0.020 A 32 ASN HD22 H 1 6.972 0.020 A 32 ASN C C 13 175.928 0.3 A 32 ASN CA C 13 53.215 0.3 A 32 ASN CB C 13 38.780 0.3 A 32 ASN N N 15 119.486 0.3 A 33 GLU H H 1 8.711 0.020 A 33 GLU HA H 1 4.271 0.020 A 33 GLU HBx H 1 2.059 0.020 A 33 GLU HBy H 1 2.141 0.020 A 33 GLU HG2 H 1 2.361 0.020 A 33 GLU HG3 H 1 2.361 0.020 A 33 GLU CA C 13 57.426 0.3 A 33 GLU CB C 13 29.328 0.3 A 33 GLU N N 15 122.031 0.3 A 34 GLN H H 1 8.438 0.020 A 34 GLN HA H 1 4.271 0.020 A 34 GLN HB2 H 1 2.083 0.020 A 34 GLN HB3 H 1 2.083 0.020 A 34 GLN HE21 H 1 7.673 0.020 A 34 GLN HE22 H 1 6.922 0.020 A 34 GLN HG2 H 1 2.420 0.020 A 34 GLN HG3 H 1 2.420 0.020 A 34 GLN CA C 13 56.226 0.3 A 34 GLN CB C 13 28.839 0.3 A 34 GLN N N 15 120.866 0.3 A 34 GLN NE2 N 15 113.072 0.3 A 35 GLU H H 1 8.424 0.020 A 35 GLU HA H 1 4.319 0.020 A 35 GLU HBx H 1 2.055 0.020 A 35 GLU HBy H 1 2.113 0.020 A 35 GLU HG2 H 1 2.353 0.020 A 35 GLU HG3 H 1 2.353 0.020 A 35 GLU C C 13 177.176 0.3 A 35 GLU CA C 13 56.996 0.3 A 35 GLU CB C 13 29.545 0.3 A 35 GLU N N 15 122.323 0.3 A 36 LEU H H 1 8.342 0.020 A 36 LEU HA H 1 4.319 0.020 A 36 LEU HBx H 1 2.064 0.020 A 36 LEU HBy H 1 2.324 0.020 A 36 LEU HD1% H 1 0.921 0.020 A 36 LEU HD2% H 1 0.921 0.020 A 36 LEU HG H 1 1.719 0.020 A 36 LEU CA C 13 55.898 0.3 A 36 LEU CB C 13 41.496 0.3 A 36 LEU N N 15 122.904 0.3 A 38 GLU H H 1 8.342 0.020 A 38 GLU HA H 1 4.396 0.020 A 38 GLU HBx H 1 2.329 0.020 A 38 GLU HBy H 1 2.373 0.020 A 38 GLU HGy H 1 2.113 0.020 A 38 GLU HGx H 1 2.062 0.020 A 38 GLU C C 13 177.318 0.3 A 38 GLU CA C 13 56.366 0.3 A 38 GLU CB C 13 29.328 0.3 A 38 GLU N N 15 121.931 0.3 A 39 LEU H H 1 8.342 0.020 A 39 LEU HA H 1 4.348 0.020 A 39 LEU HBy H 1 2.333 0.020 A 39 LEU HBx H 1 2.093 0.020 A 39 LEU HD1% H 1 0.941 0.020 A 39 LEU HD2% H 1 0.941 0.020 A 39 LEU HG H 1 1.747 0.020 A 39 LEU CA C 13 56.833 0.3 A 39 LEU CB C 13 41.387 0.3 A 39 LEU N N 15 123.317 0.3 A 40 ASP H H 1 8.530 0.020 A 40 ASP HA H 1 4.571 0.020 A 40 ASP HB2 H 1 2.786 0.020 A 40 ASP HB3 H 1 2.786 0.020 A 40 ASP CA C 13 55.589 0.3 A 40 ASP N N 15 119.726 0.3 A 41 LYS H H 1 8.145 0.020 A 41 LYS HA H 1 4.164 0.020 A 41 LYS CA C 13 58.220 0.3 A 41 LYS N N 15 121.200 0.3 A 42 TRP H H 1 8.025 0.020 A 42 TRP HA H 1 4.597 0.020 A 42 TRP HBx H 1 3.313 0.020 A 42 TRP HBy H 1 3.476 0.020 A 42 TRP HE1 H 1 10.718 0.020 A 42 TRP C C 13 177.641 0.3 A 42 TRP CA C 13 58.561 0.3 A 42 TRP CB C 13 28.839 0.3 A 42 TRP N N 15 120.615 0.3 A 42 TRP NE1 N 15 130.765 0.3 A 43 ALA H H 1 8.199 0.020 A 43 ALA HA H 1 4.140 0.020 A 43 ALA HB% H 1 1.579 0.020 A 43 ALA C C 13 172.776 0.3 A 43 ALA CA C 13 54.864 0.3 A 43 ALA CB C 13 17.974 0.3 A 43 ALA N N 15 122.056 0.3 A 44 SER H H 1 8.210 0.020 A 44 SER HA H 1 4.376 0.020 A 44 SER HBx H 1 3.903 0.020 A 44 SER HBy H 1 3.980 0.020 A 44 SER C C 13 176.767 0.3 A 44 SER CA C 13 60.980 0.3 A 44 SER CB C 13 62.410 0.3 A 44 SER N N 15 113.378 0.3 A 45 LEU H H 1 7.906 0.020 A 45 LEU HA H 1 4.194 0.020 A 45 LEU HB2 H 1 1.747 0.020 A 45 LEU HB3 H 1 1.747 0.020 A 45 LEU HD1% H 1 0.839 0.020 A 45 LEU HD2% H 1 0.774 0.020 A 45 LEU CA C 13 57.606 0.3 A 45 LEU CB C 13 41.170 0.3 A 45 LEU N N 15 123.425 0.3 A 46 TRP H H 1 8.043 0.020 A 46 TRP HA H 1 4.655 0.020 A 46 TRP HBy H 1 3.450 0.020 A 46 TRP HBx H 1 3.320 0.020 A 46 TRP HE1 H 1 10.398 0.020 A 46 TRP C C 13 177.838 0.3 A 46 TRP CA C 13 58.907 0.3 A 46 TRP CB C 13 29.219 0.3 A 46 TRP N N 15 118.572 0.3 A 46 TRP NE1 N 15 130.537 0.3 A 47 ASN H H 1 8.174 0.020 A 47 ASN HA H 1 4.626 0.020 A 47 ASN HBx H 1 2.879 0.020 A 47 ASN HBy H 1 2.945 0.020 A 47 ASN HD21 H 1 7.716 0.020 A 47 ASN HD22 H 1 7.100 0.020 A 47 ASN C C 13 176.904 0.3 A 47 ASN CA C 13 55.045 0.3 A 47 ASN CB C 13 38.563 0.3 A 47 ASN N N 15 116.564 0.3 A 47 ASN ND2 N 15 113.344 0.3 A 48 TRP H H 1 8.145 0.020 A 48 TRP HA H 1 4.367 0.020 A 48 TRP HB3 H 1 3.380 0.020 A 48 TRP HE1 H 1 10.531 0.020 A 48 TRP CA C 13 59.517 0.3 A 48 TRP CB C 13 28.893 0.3 A 48 TRP N N 15 121.421 0.3 A 48 TRP NE1 N 15 130.993 0.3 A 49 PHE H H 1 8.036 0.020 A 49 PHE HA H 1 4.252 0.020 A 49 PHE HBx H 1 3.042 0.020 A 49 PHE HBy H 1 3.177 0.020 A 49 PHE C C 13 175.565 0.3 A 49 PHE CA C 13 58.887 0.3 A 49 PHE CB C 13 38.671 0.3 A 49 PHE N N 15 118.299 0.3 A 50 ASN H H 1 7.795 0.020 A 50 ASN HA H 1 4.626 0.020 A 50 ASN HBx H 1 2.655 0.020 A 50 ASN HBy H 1 2.888 0.020 A 50 ASN C C 13 176.439 0.3 A 50 ASN CA C 13 53.215 0.3 A 50 ASN CB C 13 38.128 0.3 A 50 ASN N N 15 118.836 0.3 A 51 ILE H H 1 8.147 0.020 A 51 ILE HA H 1 3.791 0.020 A 51 ILE HB H 1 1.720 0.020 A 51 ILE HG1x H 1 1.215 0.020 A 51 ILE HG1y H 1 1.452 0.020 A 51 ILE HG2% H 1 0.766 0.020 A 51 ILE C C 13 177.202 0.3 A 51 ILE CA C 13 63.102 0.3 A 51 ILE CB C 13 37.367 0.3 A 51 ILE N N 15 120.218 0.3 A 52 THR H H 1 8.009 0.020 A 52 THR HA H 1 4.031 0.020 A 52 THR C C 13 176.095 0.3 A 52 THR CA C 13 65.148 0.3 A 52 THR CB C 13 68.277 0.3 A 52 THR CG2 C 13 22.227 0.3 A 52 THR N N 15 115.352 0.3 A 53 ASN H H 1 7.972 0.020 A 53 ASN HA H 1 4.636 0.020 A 53 ASN HB2 H 1 2.765 0.020 A 53 ASN HB3 H 1 2.765 0.020 A 53 ASN HD21 H 1 7.633 0.020 A 53 ASN HD22 H 1 6.860 0.020 A 53 ASN C C 13 176.530 0.3 A 53 ASN CA C 13 54.457 0.3 A 53 ASN CB C 13 37.802 0.3 A 53 ASN N N 15 119.874 0.3 A 53 ASN ND2 N 15 112.731 0.3 A 54 TRP H H 1 7.897 0.020 A 54 TRP HA H 1 4.655 0.020 A 54 TRP HB3 H 1 3.349 0.020 A 54 TRP HE1 H 1 10.353 0.020 A 54 TRP CA C 13 58.643 0.3 A 54 TRP CB C 13 29.165 0.3 A 54 TRP N N 15 120.192 0.3 A 54 TRP NE1 N 15 130.290 0.3 A 55 LEU H H 1 7.931 0.020 A 55 LEU HA H 1 4.088 0.020 A 55 LEU HBx H 1 1.444 0.020 A 55 LEU HBy H 1 1.684 0.020 A 55 LEU HD1% H 1 0.770 0.020 A 55 LEU HD2% H 1 0.856 0.020 A 55 LEU C C 13 177.975 0.3 A 55 LEU CA C 13 56.470 0.3 A 55 LEU CB C 13 40.898 0.3 A 55 LEU N N 15 118.354 0.3 A 56 TRP H H 1 7.665 0.020 A 56 TRP HA H 1 4.367 0.020 A 56 TRP HBx H 1 3.234 0.020 A 56 TRP HBy H 1 3.344 0.020 A 56 TRP HE1 H 1 10.301 0.020 A 56 TRP C C 13 176.863 0.3 A 56 TRP CA C 13 59.070 0.3 A 56 TRP CB C 13 28.839 0.3 A 56 TRP N N 15 118.335 0.3 A 56 TRP NE1 N 15 130.740 0.3 A 57 TYR H H 1 7.578 0.020 A 57 TYR HA H 1 4.172 0.020 A 57 TYR HBy H 1 3.062 0.020 A 57 TYR HBx H 1 2.957 0.020 A 57 TYR C C 13 176.085 0.3 A 57 TYR CA C 13 59.865 0.3 A 57 TYR CB C 13 38.563 0.3 A 57 TYR N N 15 116.808 0.3 A 58 ILE H H 1 7.586 0.020 A 58 ILE HA H 1 4.265 0.020 A 58 ILE HB H 1 2.061 0.020 A 58 ILE HD1% H 1 0.864 0.020 A 58 ILE HG1x H 1 1.325 0.020 A 58 ILE HG1y H 1 1.566 0.020 A 58 ILE HG2% H 1 0.905 0.020 A 58 ILE C C 13 174.782 0.3 A 58 ILE CA C 13 60.940 0.3 A 58 ILE CB C 13 38.182 0.3 A 58 ILE N N 15 115.526 0.3 A 59 LYS H H 1 7.481 0.020 A 59 LYS HA H 1 4.152 0.020 A 59 LYS HBx H 1 1.749 0.020 A 59 LYS HBy H 1 1.819 0.020 A 59 LYS HD2 H 1 1.684 0.020 A 59 LYS HD3 H 1 1.684 0.020 A 59 LYS HE2 H 1 2.957 0.020 A 59 LYS HE3 H 1 2.957 0.020 A 59 LYS HG2 H 1 1.451 0.020 A 59 LYS HG3 H 1 1.451 0.020 A 59 LYS CA C 13 57.710 0.3 A 59 LYS CB C 13 33.022 0.3 A 59 LYS CD C 13 29.589 0.3 A 59 LYS CE C 13 42.207 0.3 A 59 LYS CG C 13 25.178 0.3 A 59 LYS N N 15 127.736 0.3 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 42 TRP HE1 C 39 LEU HD11 1.0 0.0 6.50 2 2 C 42 TRP HE1 B 39 LEU HD11 1.0 0.0 6.50 3 3 B 42 TRP HE1 A 39 LEU HD1% 1.0 0.0 6.50 4 4 A 28 GLY H C 27 LEU HD21 1.0 0.0 6.50 5 5 C 28 GLY H B 27 LEU HD21 1.0 0.0 6.50 6 6 B 28 GLY H A 27 LEU HD2% 1.0 0.0 6.50 7 7 A 27 LEU H C 27 LEU HD11 1.0 0.0 5.50 8 7 A 27 LEU H C 27 LEU HD21 1.0 0.0 5.50 9 8 C 27 LEU H B 27 LEU HD11 1.0 0.0 5.50 10 8 C 27 LEU H B 27 LEU HD21 1.0 0.0 5.50 11 9 B 27 LEU H A 27 LEU HD1% 1.0 0.0 5.50 12 9 B 27 LEU H A 27 LEU HD2% 1.0 0.0 5.50 13 10 C 27 LEU HD21 A 26 PHE H 1.0 0.0 5.50 14 11 B 27 LEU HD21 C 26 PHE H 1.0 0.0 5.50 15 12 A 27 LEU HD2% B 26 PHE H 1.0 0.0 5.50 16 13 A 38 GLU H C 39 LEU HD21 1.0 0.0 6.50 17 14 C 38 GLU H B 39 LEU HD21 1.0 0.0 6.50 18 15 B 38 GLU H A 39 LEU HD2% 1.0 0.0 6.50 19 16 B 9 ASP H C 17 ASP H 1.0 0.0 3.50 20 17 B 13 TYR H C 15 ARG H 1.0 0.0 3.50 21 18 A 15 ARG H C 13 TYR H 1.0 0.0 3.50 22 19 A 17 ASP H C 9 ASP H 1.0 0.0 3.50 23 20 A 9 ASP H B 17 ASP H 1.0 0.0 3.50 24 21 A 13 TYR H B 15 ARG H 1.0 0.0 3.50 25 22 A 5 GLU H B 3 ILE HD11 1.0 0.0 4.50 26 23 B 5 GLU H C 3 ILE HD11 1.0 0.0 4.50 27 24 C 5 GLU H A 3 ILE HD11 1.0 0.0 4.50 28 25 A 18 GLY H C 8 ARG HDx 1.0 0.0 4.50 29 25 A 18 GLY H C 8 ARG HDy 1.0 0.0 4.50 30 26 C 18 GLY H B 8 ARG HDx 1.0 0.0 4.50 31 26 C 18 GLY H B 8 ARG HDy 1.0 0.0 4.50 32 27 B 18 GLY H A 8 ARG HD2 1.0 0.0 4.50 33 27 B 18 GLY H A 8 ARG HD3 1.0 0.0 4.50 34 28 A 17 ASP H C 10 GLY H 1.0 0.0 4.50 35 29 C 17 ASP H B 10 GLY H 1.0 0.0 4.50 36 30 B 17 ASP H A 10 GLY H 1.0 0.0 4.50 37 31 A 15 ARG H C 14 VAL H 1.0 0.0 5.50 38 32 C 15 ARG H B 14 VAL H 1.0 0.0 5.50 39 33 B 15 ARG H A 14 VAL H 1.0 0.0 5.50 40 34 A 23 LEU H B 14 VAL HG21 1.0 0.0 4.50 41 35 B 23 LEU H C 14 VAL HG21 1.0 0.0 4.50 42 36 C 23 LEU H A 14 VAL HG2% 1.0 0.0 4.50 43 37 A 14 VAL H B 14 VAL HG21 1.0 0.0 4.50 44 38 B 14 VAL H C 14 VAL HG21 1.0 0.0 4.50 45 39 C 14 VAL H A 14 VAL HG2% 1.0 0.0 4.50 46 40 A 13 TYR H B 14 VAL HG21 1.0 0.0 4.50 47 41 B 13 TYR H C 14 VAL HG21 1.0 0.0 4.50 48 42 C 13 TYR H A 14 VAL HG2% 1.0 0.0 4.50 49 43 A 32 ASN H A 33 GLU HA 1.0 0.0 4.50 50 44 B 32 ASN H B 33 GLU HA 1.0 0.0 4.50 51 45 C 32 ASN H C 33 GLU HA 1.0 0.0 4.50 52 46 A 32 ASN HA A 34 GLN H 1.0 0.0 4.50 53 47 B 32 ASN HA B 34 GLN H 1.0 0.0 4.50 54 48 C 32 ASN HA C 34 GLN H 1.0 0.0 4.50 55 49 A 34 GLN H A 36 LEU HG 1.0 0.0 4.50 56 50 B 34 GLN H B 36 LEU HG 1.0 0.0 4.50 57 51 C 34 GLN H C 36 LEU HG 1.0 0.0 4.50 58 52 A 32 ASN HA A 35 GLU H 1.0 0.0 4.50 59 53 B 32 ASN HA B 35 GLU H 1.0 0.0 4.50 60 54 C 32 ASN HA C 35 GLU H 1.0 0.0 4.50 61 55 A 26 PHE H A 29 SER H 1.0 0.0 6.50 62 56 B 26 PHE H B 29 SER H 1.0 0.0 6.50 63 57 C 26 PHE H C 29 SER H 1.0 0.0 6.50 64 58 A 28 GLY H A 27 LEU HB2 1.0 0.0 4.50 65 58 A 28 GLY H A 27 LEU HB3 1.0 0.0 4.50 66 59 B 28 GLY H B 27 LEU HBx 1.0 0.0 4.50 67 59 B 28 GLY H B 27 LEU HBy 1.0 0.0 4.50 68 60 C 28 GLY H C 27 LEU HBx 1.0 0.0 4.50 69 60 C 28 GLY H C 27 LEU HBy 1.0 0.0 4.50 70 61 A 29 SER H A 27 LEU HB2 1.0 0.0 5.50 71 61 A 29 SER H A 27 LEU HB3 1.0 0.0 5.50 72 62 B 29 SER H B 27 LEU HBx 1.0 0.0 5.50 73 62 B 29 SER H B 27 LEU HBy 1.0 0.0 5.50 74 63 C 29 SER H C 27 LEU HBx 1.0 0.0 5.50 75 63 C 29 SER H C 27 LEU HBy 1.0 0.0 5.50 76 64 A 31 GLY H A 36 LEU HD1% 1.0 0.0 6.50 77 64 A 36 LEU HD2% A 31 GLY H 1.0 0.0 6.50 78 65 B 31 GLY H B 36 LEU HD11 1.0 0.0 6.50 79 65 B 36 LEU HD21 B 31 GLY H 1.0 0.0 6.50 80 66 C 31 GLY H C 36 LEU HD11 1.0 0.0 6.50 81 66 C 36 LEU HD21 C 31 GLY H 1.0 0.0 6.50 82 67 A 32 ASN H A 36 LEU HD1% 1.0 0.0 6.50 83 67 A 32 ASN H A 36 LEU HD2% 1.0 0.0 6.50 84 68 B 32 ASN H B 36 LEU HD11 1.0 0.0 6.50 85 68 B 32 ASN H B 36 LEU HD21 1.0 0.0 6.50 86 69 C 32 ASN H C 36 LEU HD11 1.0 0.0 6.50 87 69 C 32 ASN H C 36 LEU HD21 1.0 0.0 6.50 88 70 A 34 GLN H A 36 LEU HD1% 1.0 0.0 6.50 89 70 A 34 GLN H A 36 LEU HD2% 1.0 0.0 6.50 90 71 B 34 GLN H B 36 LEU HD11 1.0 0.0 6.50 91 71 B 34 GLN H B 36 LEU HD21 1.0 0.0 6.50 92 72 C 34 GLN H C 36 LEU HD11 1.0 0.0 6.50 93 72 C 34 GLN H C 36 LEU HD21 1.0 0.0 6.50 94 73 A 31 GLY H A 33 GLU HG2 1.0 0.0 5.50 95 73 A 31 GLY H A 33 GLU HG3 1.0 0.0 5.50 96 74 B 31 GLY H B 33 GLU HGx 1.0 0.0 5.50 97 74 B 31 GLY H B 33 GLU HGy 1.0 0.0 5.50 98 75 C 31 GLY H C 33 GLU HGx 1.0 0.0 5.50 99 75 C 31 GLY H C 33 GLU HGy 1.0 0.0 5.50 100 76 A 32 ASN H A 31 GLY HA2 1.0 0.0 3.50 101 76 A 32 ASN H A 31 GLY HA3 1.0 0.0 3.50 102 77 B 32 ASN H B 31 GLY HAx 1.0 0.0 3.50 103 77 B 32 ASN H B 31 GLY HAy 1.0 0.0 3.50 104 78 C 32 ASN H C 31 GLY HAx 1.0 0.0 3.50 105 78 C 32 ASN H C 31 GLY HAy 1.0 0.0 3.50 106 79 A 34 GLN H A 31 GLY HA2 1.0 0.0 4.50 107 79 A 34 GLN H A 31 GLY HA3 1.0 0.0 4.50 108 80 B 34 GLN H B 31 GLY HAx 1.0 0.0 4.50 109 80 B 34 GLN H B 31 GLY HAy 1.0 0.0 4.50 110 81 C 34 GLN H C 31 GLY HAx 1.0 0.0 4.50 111 81 C 34 GLN H C 31 GLY HAy 1.0 0.0 4.50 112 82 A 38 GLU H A 40 ASP HB2 1.0 0.0 5.50 113 82 A 38 GLU H A 40 ASP HB3 1.0 0.0 5.50 114 83 B 38 GLU H B 40 ASP HBx 1.0 0.0 5.50 115 83 B 38 GLU H B 40 ASP HBy 1.0 0.0 5.50 116 84 C 38 GLU H C 40 ASP HBx 1.0 0.0 5.50 117 84 C 38 GLU H C 40 ASP HBy 1.0 0.0 5.50 118 85 A 51 ILE HA A 54 TRP H 1.0 0.0 5.50 119 86 B 51 ILE HA B 54 TRP H 1.0 0.0 5.50 120 87 C 51 ILE HA C 54 TRP H 1.0 0.0 5.50 121 88 A 51 ILE HG2% A 48 TRP HE1 1.0 0.0 5.50 122 89 B 51 ILE HG21 B 48 TRP HE1 1.0 0.0 5.50 123 90 C 51 ILE HG21 C 48 TRP HE1 1.0 0.0 5.50 124 91 A 48 TRP HE1 A 51 ILE HG1x 1.0 0.0 6.00 125 91 A 48 TRP HE1 A 51 ILE HG1y 1.0 0.0 6.00 126 92 B 48 TRP HE1 B 51 ILE HG1x 1.0 0.0 6.00 127 92 B 48 TRP HE1 B 51 ILE HG1y 1.0 0.0 6.00 128 93 C 48 TRP HE1 C 51 ILE HG1x 1.0 0.0 6.00 129 93 C 48 TRP HE1 C 51 ILE HG1y 1.0 0.0 6.00 130 94 A 29 SER H A 31 GLY H 1.0 0.0 5.50 131 95 B 29 SER H B 31 GLY H 1.0 0.0 5.50 132 96 C 29 SER H C 31 GLY H 1.0 0.0 5.50 133 97 A 50 ASN H A 47 ASN H 1.0 0.0 5.50 134 98 B 50 ASN H B 47 ASN H 1.0 0.0 5.50 135 99 C 50 ASN H C 47 ASN H 1.0 0.0 5.50 136 100 A 43 ALA H A 46 TRP H 1.0 0.0 5.50 137 101 B 43 ALA H B 46 TRP H 1.0 0.0 5.50 138 102 C 43 ALA H C 46 TRP H 1.0 0.0 5.50 139 103 A 34 GLN H A 31 GLY H 1.0 0.0 5.50 140 104 B 34 GLN H B 31 GLY H 1.0 0.0 5.50 141 105 C 34 GLN H C 31 GLY H 1.0 0.0 5.50 142 106 A 47 ASN H A 43 ALA H 1.0 0.0 5.50 143 107 B 47 ASN H B 43 ALA H 1.0 0.0 5.50 144 108 C 47 ASN H C 43 ALA H 1.0 0.0 5.50 145 109 A 43 ALA H A 40 ASP H 1.0 0.0 5.50 146 110 B 43 ALA H B 40 ASP H 1.0 0.0 5.50 147 111 C 43 ALA H C 40 ASP H 1.0 0.0 5.50 148 112 A 43 ALA H A 41 LYS H 1.0 0.0 5.50 149 113 B 43 ALA H B 41 LYS H 1.0 0.0 5.50 150 114 C 43 ALA H C 41 LYS H 1.0 0.0 5.50 151 115 A 45 LEU H A 42 TRP H 1.0 0.0 5.50 152 116 B 45 LEU H B 42 TRP H 1.0 0.0 5.50 153 117 C 45 LEU H C 42 TRP H 1.0 0.0 5.50 154 118 A 47 ASN H A 44 SER H 1.0 0.0 4.50 155 119 B 47 ASN H B 44 SER H 1.0 0.0 4.50 156 120 C 47 ASN H C 44 SER H 1.0 0.0 4.50 157 121 A 50 ASN H A 53 ASN H 1.0 0.0 4.50 158 122 B 50 ASN H B 53 ASN H 1.0 0.0 4.50 159 123 C 50 ASN H C 53 ASN H 1.0 0.0 4.50 160 124 A 38 GLU H A 36 LEU H 1.0 0.0 4.50 161 125 B 38 GLU H B 36 LEU H 1.0 0.0 4.50 162 126 C 38 GLU H C 36 LEU H 1.0 0.0 4.50 163 127 A 38 GLU H A 35 GLU H 1.0 0.0 4.50 164 128 B 38 GLU H B 35 GLU H 1.0 0.0 4.50 165 129 C 38 GLU H C 35 GLU H 1.0 0.0 4.50 166 130 A 34 GLN H A 30 SER H 1.0 0.0 5.50 167 131 B 34 GLN H B 30 SER H 1.0 0.0 5.50 168 132 C 34 GLN H C 30 SER H 1.0 0.0 5.50 169 133 A 5 GLU H A 20 TRP HE1 1.0 0.0 4.50 170 134 B 5 GLU H B 20 TRP HE1 1.0 0.0 4.50 171 135 C 5 GLU H C 20 TRP HE1 1.0 0.0 4.50 172 136 A 28 GLY H A 25 THR HA 1.0 0.0 4.50 173 137 B 28 GLY H B 25 THR HA 1.0 0.0 4.50 174 138 C 28 GLY H C 25 THR HA 1.0 0.0 4.50 175 139 A 12 ALA H A 22 LEU HD2% 1.0 0.0 4.50 176 140 B 12 ALA H B 22 LEU HD21 1.0 0.0 4.50 177 141 C 12 ALA H C 22 LEU HD21 1.0 0.0 4.50 178 142 A 31 GLY H A 32 ASN HBx 1.0 0.0 5.50 179 142 A 31 GLY H A 32 ASN HBy 1.0 0.0 5.50 180 143 B 31 GLY H B 32 ASN HBx 1.0 0.0 5.50 181 143 B 31 GLY H B 32 ASN HBy 1.0 0.0 5.50 182 144 C 31 GLY H C 32 ASN HBx 1.0 0.0 5.50 183 144 C 31 GLY H C 32 ASN HBy 1.0 0.0 5.50 184 145 A 31 GLY H A 33 GLU HG2 1.0 0.0 5.50 185 145 A 31 GLY H A 33 GLU HG3 1.0 0.0 5.50 186 146 B 31 GLY H B 33 GLU HGx 1.0 0.0 5.50 187 146 B 31 GLY H B 33 GLU HGy 1.0 0.0 5.50 188 147 C 31 GLY H C 33 GLU HGx 1.0 0.0 5.50 189 147 C 31 GLY H C 33 GLU HGy 1.0 0.0 5.50 190 148 A 31 GLY H A 33 GLU HBx 1.0 0.0 5.50 191 148 A 31 GLY H A 33 GLU HBy 1.0 0.0 5.50 192 149 B 31 GLY H B 33 GLU HBx 1.0 0.0 5.50 193 149 B 31 GLY H B 33 GLU HBy 1.0 0.0 5.50 194 150 C 31 GLY H C 33 GLU HBx 1.0 0.0 5.50 195 150 C 31 GLY H C 33 GLU HBy 1.0 0.0 5.50 196 151 A 33 GLU H A 36 LEU HD1% 1.0 0.0 4.50 197 152 B 33 GLU H B 36 LEU HD11 1.0 0.0 4.50 198 153 C 33 GLU H C 36 LEU HD11 1.0 0.0 4.50 199 154 A 28 GLY H A 24 SER H 1.0 0.0 6.50 200 155 B 28 GLY H B 24 SER H 1.0 0.0 6.50 201 156 C 28 GLY H C 24 SER H 1.0 0.0 6.50 202 157 A 48 TRP HE1 A 45 LEU HB2 1.0 0.0 4.50 203 157 A 48 TRP HE1 A 45 LEU HB3 1.0 0.0 4.50 204 158 B 48 TRP HE1 B 45 LEU HBx 1.0 0.0 4.50 205 158 B 48 TRP HE1 B 45 LEU HBy 1.0 0.0 4.50 206 159 C 48 TRP HE1 C 45 LEU HBx 1.0 0.0 4.50 207 159 C 48 TRP HE1 C 45 LEU HBy 1.0 0.0 4.50 208 160 A 14 VAL H A 21 VAL H 1.0 0.0 3.00 209 161 A 34 GLN H A 35 GLU H 1.0 0.0 3.00 210 162 A 34 GLN H A 33 GLU H 1.0 0.0 3.00 211 163 A 38 GLU H A 39 LEU H 1.0 0.0 3.00 212 164 A 35 GLU H A 36 LEU H 1.0 0.0 3.00 213 165 A 14 VAL H A 21 VAL H 1.0 0.0 3.00 214 166 A 34 GLN H A 33 GLU H 1.0 0.0 3.00 215 167 A 35 GLU H A 36 LEU H 1.0 0.0 3.00 216 168 A 34 GLN H A 35 GLU H 1.0 0.0 3.00 217 169 A 38 GLU H A 39 LEU H 1.0 0.0 3.00 218 170 A 43 ALA H A 42 TRP H 1.0 0.0 3.00 219 171 A 27 LEU H A 26 PHE H 1.0 0.0 3.00 220 172 A 16 LYS H A 19 GLU H 1.0 0.0 3.00 221 173 A 56 TRP H A 57 TYR H 1.0 0.0 3.00 222 174 A 57 TYR H A 58 ILE H 1.0 0.0 3.00 223 175 A 58 ILE H A 59 LYS H 1.0 0.0 3.00 224 176 A 33 GLU HA A 33 GLU H 1.0 0.0 3.00 225 177 A 43 ALA H A 43 ALA HB% 1.0 0.0 3.00 226 178 A 34 GLN H A 34 GLN HA 1.0 0.0 3.00 227 179 A 48 TRP H A 48 TRP HA 1.0 0.0 3.00 228 180 A 28 GLY H A 28 GLY HA2 1.0 0.0 3.00 229 180 A 28 GLY H A 28 GLY HA3 1.0 0.0 3.00 230 181 A 32 ASN H A 31 GLY HA2 1.0 0.0 3.00 231 181 A 32 ASN H A 31 GLY HA3 1.0 0.0 3.00 232 182 A 33 GLU H A 32 ASN HBx 1.0 0.0 3.50 233 182 A 32 ASN HBy A 33 GLU H 1.0 0.0 3.50 234 183 A 42 TRP HE1 A 42 TRP H 1.0 0.0 4.50 235 184 A 42 TRP HE1 A 38 GLU H 1.0 0.0 4.75 236 185 A 50 ASN H A 54 TRP HE1 1.0 0.0 4.50 237 186 A 54 TRP H A 54 TRP HE1 1.0 0.0 4.50 238 187 A 21 VAL H A 20 TRP H 1.0 0.0 4.50 239 188 A 21 VAL H A 22 LEU H 1.0 0.0 4.50 240 189 A 21 VAL H A 16 LYS H 1.0 0.0 4.50 241 190 A 10 GLY H A 11 GLN H 1.0 0.0 4.50 242 191 A 15 ARG H A 14 VAL H 1.0 0.0 4.50 243 192 A 14 VAL H A 23 LEU H 1.0 0.0 4.50 244 193 A 13 TYR H A 14 VAL H 1.0 0.0 4.50 245 194 A 18 GLY H A 16 LYS H 1.0 0.0 4.50 246 195 A 23 LEU H A 24 SER H 1.0 0.0 4.50 247 196 A 19 GLU H A 20 TRP H 1.0 0.0 4.50 248 197 A 24 SER H A 25 THR H 1.0 0.0 4.50 249 198 A 23 LEU H A 22 LEU H 1.0 0.0 4.50 250 199 A 14 VAL H A 22 LEU H 1.0 0.0 4.50 251 200 A 9 ASP H A 8 ARG H 1.0 0.0 4.50 252 201 A 31 GLY H A 33 GLU H 1.0 0.0 4.50 253 202 A 32 ASN H A 31 GLY H 1.0 0.0 4.50 254 203 A 31 GLY H A 30 SER H 1.0 0.0 4.50 255 204 A 23 LEU H A 25 THR H 1.0 0.0 4.50 256 205 A 9 ASP H A 10 GLY H 1.0 0.0 4.50 257 206 A 9 ASP H A 11 GLN H 1.0 0.0 4.50 258 207 A 35 GLU H A 33 GLU H 1.0 0.0 4.50 259 208 A 40 ASP H A 39 LEU H 1.0 0.0 4.50 260 209 A 29 SER H A 30 SER H 1.0 0.0 4.50 261 210 A 46 TRP H A 44 SER H 1.0 0.0 4.50 262 211 A 43 ALA H A 45 LEU H 1.0 0.0 4.50 263 212 A 45 LEU H A 44 SER H 1.0 0.0 4.50 264 213 A 43 ALA H A 44 SER H 1.0 0.0 4.50 265 214 A 28 GLY H A 29 SER H 1.0 0.0 4.50 266 215 A 51 ILE H A 52 THR H 1.0 0.0 4.50 267 216 A 47 ASN H A 48 TRP H 1.0 0.0 4.50 268 217 A 42 TRP HE1 A 42 TRP H 1.0 0.0 4.50 269 218 A 54 TRP H A 54 TRP HE1 1.0 0.0 4.50 270 219 A 21 VAL H A 16 LYS H 1.0 0.0 4.50 271 220 A 13 TYR H A 14 VAL H 1.0 0.0 4.50 272 221 A 15 ARG H A 14 VAL H 1.0 0.0 4.50 273 222 A 18 GLY H A 16 LYS H 1.0 0.0 4.50 274 223 A 21 VAL H A 20 TRP H 1.0 0.0 4.50 275 224 A 24 SER H A 25 THR H 1.0 0.0 4.50 276 225 A 23 LEU H A 24 SER H 1.0 0.0 4.50 277 226 A 23 LEU H A 22 LEU H 1.0 0.0 4.50 278 227 A 21 VAL H A 22 LEU H 1.0 0.0 4.50 279 228 A 14 VAL H A 22 LEU H 1.0 0.0 4.50 280 229 A 35 GLU H A 33 GLU H 1.0 0.0 4.50 281 230 A 31 GLY H A 33 GLU H 1.0 0.0 4.50 282 231 A 14 VAL H A 23 LEU H 1.0 0.0 4.50 283 232 A 32 ASN H A 31 GLY H 1.0 0.0 4.50 284 233 A 31 GLY H A 30 SER H 1.0 0.0 4.50 285 234 A 23 LEU H A 25 THR H 1.0 0.0 4.50 286 235 A 40 ASP H A 42 TRP H 1.0 0.0 4.50 287 236 A 9 ASP H A 10 GLY H 1.0 0.0 4.50 288 237 A 10 GLY H A 11 GLN H 1.0 0.0 4.50 289 238 A 9 ASP H A 11 GLN H 1.0 0.0 4.50 290 239 A 32 ASN H A 34 GLN H 1.0 0.0 4.50 291 240 A 9 ASP H A 8 ARG H 1.0 0.0 4.50 292 241 A 40 ASP H A 39 LEU H 1.0 0.0 4.50 293 242 A 29 SER H A 30 SER H 1.0 0.0 4.50 294 243 A 46 TRP H A 44 SER H 1.0 0.0 4.50 295 244 A 42 TRP H A 44 SER H 1.0 0.0 4.50 296 245 A 43 ALA H A 45 LEU H 1.0 0.0 4.50 297 246 A 28 GLY H A 29 SER H 1.0 0.0 4.50 298 247 A 43 ALA H A 44 SER H 1.0 0.0 4.50 299 248 A 47 ASN H A 48 TRP H 1.0 0.0 4.50 300 249 A 50 ASN H A 51 ILE H 1.0 0.0 4.50 301 250 A 48 TRP H A 49 PHE H 1.0 0.0 4.50 302 251 A 46 TRP H A 45 LEU H 1.0 0.0 4.50 303 252 A 47 ASN H A 46 TRP H 1.0 0.0 4.50 304 253 A 53 ASN H A 52 THR H 1.0 0.0 4.50 305 254 A 53 ASN H A 51 ILE H 1.0 0.0 4.50 306 255 A 51 ILE H A 52 THR H 1.0 0.0 4.50 307 256 A 53 ASN H A 55 LEU H 1.0 0.0 4.50 308 257 A 26 PHE H A 25 THR H 1.0 0.0 4.50 309 258 A 57 TYR H A 55 LEU H 1.0 0.0 4.50 310 259 A 28 GLY H A 26 PHE H 1.0 0.0 4.50 311 260 A 45 LEU H A 44 SER H 1.0 0.0 4.50 312 261 A 54 TRP H A 55 LEU H 1.0 0.0 4.50 313 262 A 54 TRP H A 53 ASN H 1.0 0.0 4.50 314 263 A 47 ASN H A 45 LEU H 1.0 0.0 4.50 315 264 A 54 TRP H A 52 THR H 1.0 0.0 4.50 316 265 A 19 GLU H A 20 TRP H 1.0 0.0 4.50 317 266 A 50 ASN H A 49 PHE H 1.0 0.0 4.50 318 267 A 18 GLY H A 19 GLU H 1.0 0.0 4.50 319 268 A 50 ASN H A 52 THR H 1.0 0.0 4.50 320 269 A 50 ASN H A 48 TRP H 1.0 0.0 4.50 321 270 A 50 ASN H A 54 TRP HE1 1.0 0.0 4.50 322 271 A 56 TRP H A 56 TRP HE1 1.0 0.0 4.50 323 272 A 56 TRP H A 59 LYS H 1.0 0.0 4.50 324 273 A 54 TRP H A 56 TRP H 1.0 0.0 4.50 325 274 A 56 TRP H A 55 LEU H 1.0 0.0 4.50 326 275 A 56 TRP H A 58 ILE H 1.0 0.0 4.50 327 276 A 57 TYR H A 59 LYS H 1.0 0.0 4.50 328 277 A 28 GLY H A 27 LEU H 1.0 0.0 4.50 329 278 A 27 LEU H A 24 SER H 1.0 0.0 4.50 330 279 A 27 LEU H A 25 THR H 1.0 0.0 4.50 331 280 A 32 ASN H A 33 GLU H 1.0 0.0 4.50 332 281 A 50 ASN H A 53 ASN H 1.0 0.0 4.50 333 282 A 33 GLU H A 30 SER HA 1.0 0.0 4.50 334 283 A 33 GLU H A 36 LEU HG 1.0 0.0 4.50 335 284 A 32 ASN H A 29 SER HA 1.0 0.0 4.50 336 285 A 34 GLN H A 36 LEU HG 1.0 0.0 4.50 337 286 A 40 ASP H A 39 LEU HG 1.0 0.0 4.50 338 287 A 28 GLY H A 27 LEU HA 1.0 0.0 4.50 339 288 A 16 LYS H A 19 GLU H 1.0 0.0 4.50 340 289 A 57 TYR H A 59 LYS H 1.0 0.0 4.50 341 290 A 58 ILE H A 59 LYS H 1.0 0.0 4.50 342 291 A 23 LEU H A 24 SER H 1.0 0.0 4.50 343 292 A 38 GLU H A 39 LEU H 1.0 0.0 4.50 344 293 A 41 LYS H A 39 LEU H 1.0 0.0 4.50 345 294 A 34 GLN H A 35 GLU H 1.0 0.0 4.50 346 295 A 40 ASP H A 39 LEU H 1.0 0.0 4.50 347 296 A 46 TRP H A 45 LEU H 1.0 0.0 4.50 348 297 A 14 VAL H A 21 VAL H 1.0 0.0 4.50 349 298 A 38 GLU H A 39 LEU H 1.0 0.0 4.50 350 299 A 34 GLN H A 35 GLU H 1.0 0.0 4.50 351 300 A 34 GLN H A 33 GLU H 1.0 0.0 4.50 352 301 A 51 ILE H A 52 THR H 1.0 0.0 4.50 353 302 A 50 ASN H A 51 ILE H 1.0 0.0 4.50 354 303 A 54 TRP H A 56 TRP H 1.0 0.0 4.50 355 304 A 56 TRP H A 57 TYR H 1.0 0.0 4.50 356 305 A 28 GLY H A 27 LEU H 1.0 0.0 4.50 357 306 A 57 TYR H A 59 LYS H 1.0 0.0 4.50 358 307 A 56 TRP H A 57 TYR H 1.0 0.0 4.50 359 308 A 27 LEU H A 25 THR H 1.0 0.0 4.50 360 309 A 57 TYR H A 58 ILE H 1.0 0.0 4.50 361 310 A 58 ILE H A 59 LYS H 1.0 0.0 4.50 362 311 A 54 TRP H A 52 THR H 1.0 0.0 4.50 363 312 A 57 TYR H A 58 ILE H 1.0 0.0 4.50 364 313 A 14 VAL H A 21 VAL H 1.0 0.0 4.50 365 314 A 45 LEU H A 44 SER H 1.0 0.0 4.50 366 315 A 28 GLY H A 27 LEU H 1.0 0.0 4.50 367 316 A 28 GLY H A 27 LEU HB2 1.0 0.0 4.50 368 316 A 28 GLY H A 27 LEU HB3 1.0 0.0 4.50 369 317 A 29 SER H A 27 LEU HB2 1.0 0.0 4.50 370 317 A 29 SER H A 27 LEU HB3 1.0 0.0 4.50 371 318 A 33 GLU H A 31 GLY HA2 1.0 0.0 4.50 372 318 A 31 GLY HA3 A 33 GLU H 1.0 0.0 4.50 373 319 A 34 GLN H A 32 ASN HBx 1.0 0.0 4.50 374 319 A 34 GLN H A 32 ASN HBy 1.0 0.0 4.50 375 320 A 35 GLU H A 32 ASN HBx 1.0 0.0 4.50 376 320 A 35 GLU H A 32 ASN HBy 1.0 0.0 4.50 377 321 A 38 GLU H A 40 ASP HB2 1.0 0.0 4.50 378 321 A 38 GLU H A 40 ASP HB3 1.0 0.0 4.50 379 322 A 39 LEU H A 40 ASP HB2 1.0 0.0 4.50 380 322 A 40 ASP HB3 A 39 LEU H 1.0 0.0 4.50 381 323 A 40 ASP H A 40 ASP HB2 1.0 0.0 4.50 382 323 A 40 ASP HB3 A 40 ASP H 1.0 0.0 4.50 383 324 A 45 LEU H A 45 LEU HB2 1.0 0.0 4.50 384 324 A 45 LEU H A 45 LEU HB3 1.0 0.0 4.50 385 325 A 53 ASN H A 53 ASN HB2 1.0 0.0 4.50 386 325 A 53 ASN H A 53 ASN HB3 1.0 0.0 4.50 387 326 A 54 TRP H A 53 ASN HB2 1.0 0.0 4.50 388 326 A 54 TRP H A 53 ASN HB3 1.0 0.0 4.50 389 327 A 34 GLN H A 36 LEU H 1.0 0.0 4.50 390 328 A 38 GLU H A 40 ASP H 1.0 0.0 4.50 391 329 A 32 ASN H A 29 SER HA 1.0 0.0 4.50 392 330 A 33 GLU H A 30 SER HA 1.0 0.0 4.50 393 331 A 33 GLU H A 31 GLY HA2 1.0 0.0 4.50 394 331 A 31 GLY HA3 A 33 GLU H 1.0 0.0 4.50 395 332 A 17 ASP H A 18 GLY H 1.0 0.0 5.50 396 333 A 42 TRP HE1 A 39 LEU H 1.0 0.0 5.50 397 334 A 48 TRP HE1 A 48 TRP H 1.0 0.0 5.50 398 335 A 15 ARG H A 21 VAL H 1.0 0.0 5.50 399 336 A 21 VAL H A 19 GLU H 1.0 0.0 5.50 400 337 A 10 GLY H A 8 ARG H 1.0 0.0 5.50 401 338 A 14 VAL H A 16 LYS H 1.0 0.0 5.50 402 339 A 13 TYR H A 23 LEU H 1.0 0.0 5.50 403 340 A 26 PHE H A 24 SER H 1.0 0.0 5.50 404 341 A 16 LYS H A 20 TRP H 1.0 0.0 5.50 405 342 A 24 SER H A 22 LEU H 1.0 0.0 5.50 406 343 A 22 LEU H A 25 THR H 1.0 0.0 5.50 407 344 A 23 LEU H A 21 VAL H 1.0 0.0 5.50 408 345 A 15 ARG H A 16 LYS H 1.0 0.0 5.50 409 346 A 28 GLY H A 25 THR H 1.0 0.0 5.50 410 347 A 48 TRP HE1 A 48 TRP H 1.0 0.0 5.50 411 348 A 20 TRP HE1 A 6 ALA H 1.0 0.0 5.50 412 349 A 15 ARG H A 21 VAL H 1.0 0.0 5.50 413 350 A 23 LEU H A 21 VAL H 1.0 0.0 5.50 414 351 A 21 VAL H A 19 GLU H 1.0 0.0 5.50 415 352 A 10 GLY H A 8 ARG H 1.0 0.0 5.50 416 353 A 14 VAL H A 16 LYS H 1.0 0.0 5.50 417 354 A 13 TYR H A 12 ALA H 1.0 0.0 5.50 418 355 A 17 ASP H A 18 GLY H 1.0 0.0 5.50 419 356 A 24 SER H A 22 LEU H 1.0 0.0 5.50 420 357 A 20 TRP HE1 A 20 TRP H 1.0 0.0 5.50 421 358 A 16 LYS H A 20 TRP H 1.0 0.0 5.50 422 359 A 15 ARG H A 16 LYS H 1.0 0.0 5.50 423 360 A 22 LEU H A 25 THR H 1.0 0.0 5.50 424 361 A 13 TYR H A 23 LEU H 1.0 0.0 5.50 425 362 A 32 ASN H A 35 GLU H 1.0 0.0 5.50 426 363 A 28 GLY H A 25 THR H 1.0 0.0 5.50 427 364 A 51 ILE H A 49 PHE H 1.0 0.0 5.50 428 365 A 23 LEU H A 12 ALA H 1.0 0.0 5.50 429 366 A 12 ALA H A 24 SER H 1.0 0.0 5.50 430 367 A 26 PHE H A 24 SER H 1.0 0.0 5.50 431 368 A 50 ASN H A 47 ASN H 1.0 0.0 5.50 432 369 A 5 GLU H A 6 ALA H 1.0 0.0 5.50 433 370 A 54 TRP H A 57 TYR H 1.0 0.0 5.50 434 371 A 27 LEU H A 29 SER H 1.0 0.0 5.50 435 372 A 32 ASN H A 30 SER H 1.0 0.0 5.50 436 373 A 56 TRP H A 59 LYS H 1.0 0.0 5.50 437 374 A 23 LEU H A 25 THR H 1.0 0.0 5.50 438 375 A 43 ALA H A 45 LEU H 1.0 0.0 5.50 439 376 A 47 ASN H A 45 LEU H 1.0 0.0 5.50 440 377 A 43 ALA H A 45 LEU H 1.0 0.0 5.50 441 378 A 54 TRP H A 52 THR H 1.0 0.0 5.50 442 379 A 9 ASP H A 11 GLN H 1.0 0.0 5.50 443 380 A 50 ASN H A 48 TRP H 1.0 0.0 5.50 444 381 A 53 ASN H A 55 LEU H 1.0 0.0 5.50 445 382 A 27 LEU H A 25 THR H 1.0 0.0 5.50 446 383 A 56 TRP H A 58 ILE H 1.0 0.0 5.50 447 384 A 46 TRP H A 44 SER H 1.0 0.0 5.50 448 385 A 28 GLY H A 26 PHE H 1.0 0.0 5.50 449 386 A 47 ASN H A 45 LEU H 1.0 0.0 5.50 450 387 A 56 TRP H A 58 ILE H 1.0 0.0 5.50 451 388 A 42 TRP H A 44 SER H 1.0 0.0 5.50 452 389 A 27 LEU H A 24 SER H 1.0 0.0 5.50 453 390 A 46 TRP H A 44 SER H 1.0 0.0 5.50 454 391 A 34 GLN H A 31 GLY HA2 1.0 0.0 5.50 455 391 A 34 GLN H A 31 GLY HA3 1.0 0.0 5.50 456 392 A 43 ALA H A 40 ASP HB2 1.0 0.0 5.50 457 392 A 40 ASP HB3 A 43 ALA H 1.0 0.0 5.50 458 393 A 34 GLN H A 31 GLY HA2 1.0 0.0 5.50 459 393 A 34 GLN H A 31 GLY HA3 1.0 0.0 5.50 460 394 A 17 ASP H A 16 LYS H 1.0 0.0 6.50 461 395 A 42 TRP HE1 A 43 ALA H 1.0 0.0 6.50 462 396 A 48 TRP HE1 A 49 PHE H 1.0 0.0 6.50 463 397 A 54 TRP HE1 A 55 LEU H 1.0 0.0 6.50 464 398 A 54 TRP HE1 A 51 ILE H 1.0 0.0 6.50 465 399 A 14 VAL H A 20 TRP H 1.0 0.0 6.50 466 400 A 26 PHE H A 23 LEU H 1.0 0.0 6.50 467 401 A 42 TRP HE1 A 43 ALA H 1.0 0.0 6.50 468 402 A 54 TRP HE1 A 51 ILE H 1.0 0.0 6.50 469 403 A 17 ASP H A 16 LYS H 1.0 0.0 6.50 470 404 A 26 PHE H A 23 LEU H 1.0 0.0 6.50 471 405 A 12 ALA H A 11 GLN H 1.0 0.0 6.50 472 406 A 17 ASP H A 19 GLU H 1.0 0.0 6.50 473 407 A 58 ILE H A 55 LEU H 1.0 0.0 6.50 474 408 A 42 TRP H A 39 LEU H 1.0 0.0 6.50 475 409 A 27 LEU H A 23 LEU H 1.0 0.0 6.50 476 410 A 30 SER H A 33 GLU H 1.0 0.0 6.50 477 411 A 52 THR H A 55 LEU H 1.0 0.0 6.50 478 412 A 43 ALA H A 42 TRP HBx 1.0 0.0 6.50 479 412 A 43 ALA H A 42 TRP HBy 1.0 0.0 6.50 480 413 A 43 ALA H A 42 TRP HBx 1.0 0.0 6.50 481 413 A 43 ALA H A 42 TRP HBy 1.0 0.0 6.50 482 414 A 57 TYR H A 54 TRP HA 1.0 0.0 6.50 483 415 A 21 VAL H A 16 LYS H 1.0 0.0 6.50 484 416 A 38 GLU H A 40 ASP H 1.0 0.0 6.50 485 417 A 43 ALA H A 40 ASP H 1.0 0.0 6.50 486 418 A 23 LEU H A 25 THR H 1.0 0.0 6.50 487 419 A 54 TRP H A 57 TYR H 1.0 0.0 6.50 488 420 A 50 ASN H A 52 THR H 1.0 0.0 6.50 489 421 A 28 GLY H A 25 THR H 1.0 0.0 6.50 490 422 B 14 VAL H B 21 VAL H 1.0 0.0 3.00 491 423 B 34 GLN H B 35 GLU H 1.0 0.0 3.00 492 424 B 34 GLN H B 33 GLU H 1.0 0.0 3.00 493 425 B 38 GLU H B 39 LEU H 1.0 0.0 3.00 494 426 B 35 GLU H B 36 LEU H 1.0 0.0 3.00 495 427 B 14 VAL H B 21 VAL H 1.0 0.0 3.00 496 428 B 34 GLN H B 33 GLU H 1.0 0.0 3.00 497 429 B 35 GLU H B 36 LEU H 1.0 0.0 3.00 498 430 B 34 GLN H B 35 GLU H 1.0 0.0 3.00 499 431 B 38 GLU H B 39 LEU H 1.0 0.0 3.00 500 432 B 43 ALA H B 42 TRP H 1.0 0.0 3.00 501 433 B 27 LEU H B 26 PHE H 1.0 0.0 3.00 502 434 B 16 LYS H B 19 GLU H 1.0 0.0 3.00 503 435 B 56 TRP H B 57 TYR H 1.0 0.0 3.00 504 436 B 57 TYR H B 58 ILE H 1.0 0.0 3.00 505 437 B 58 ILE H B 59 LYS H 1.0 0.0 3.00 506 438 B 33 GLU HA B 33 GLU H 1.0 0.0 3.00 507 439 B 43 ALA H B 43 ALA HB1 1.0 0.0 3.00 508 440 B 34 GLN H B 34 GLN HA 1.0 0.0 3.00 509 441 B 48 TRP H B 48 TRP HA 1.0 0.0 3.00 510 442 B 28 GLY H B 28 GLY HAx 1.0 0.0 3.00 511 442 B 28 GLY H B 28 GLY HAy 1.0 0.0 3.00 512 443 B 32 ASN H B 31 GLY HAx 1.0 0.0 3.00 513 443 B 32 ASN H B 31 GLY HAy 1.0 0.0 3.00 514 444 B 33 GLU H B 32 ASN HBx 1.0 0.0 3.50 515 444 B 32 ASN HBy B 33 GLU H 1.0 0.0 3.50 516 445 B 42 TRP HE1 B 42 TRP H 1.0 0.0 4.50 517 446 B 42 TRP HE1 B 38 GLU H 1.0 0.0 4.75 518 447 B 50 ASN H B 54 TRP HE1 1.0 0.0 4.50 519 448 B 54 TRP H B 54 TRP HE1 1.0 0.0 4.50 520 449 B 21 VAL H B 20 TRP H 1.0 0.0 4.50 521 450 B 21 VAL H B 22 LEU H 1.0 0.0 4.50 522 451 B 21 VAL H B 16 LYS H 1.0 0.0 4.50 523 452 B 10 GLY H B 11 GLN H 1.0 0.0 4.50 524 453 B 15 ARG H B 14 VAL H 1.0 0.0 4.50 525 454 B 14 VAL H B 23 LEU H 1.0 0.0 4.50 526 455 B 13 TYR H B 14 VAL H 1.0 0.0 4.50 527 456 B 18 GLY H B 16 LYS H 1.0 0.0 4.50 528 457 B 23 LEU H B 24 SER H 1.0 0.0 4.50 529 458 B 19 GLU H B 20 TRP H 1.0 0.0 4.50 530 459 B 24 SER H B 25 THR H 1.0 0.0 4.50 531 460 B 23 LEU H B 22 LEU H 1.0 0.0 4.50 532 461 B 14 VAL H B 22 LEU H 1.0 0.0 4.50 533 462 B 9 ASP H B 8 ARG H 1.0 0.0 4.50 534 463 B 31 GLY H B 33 GLU H 1.0 0.0 4.50 535 464 B 32 ASN H B 31 GLY H 1.0 0.0 4.50 536 465 B 31 GLY H B 30 SER H 1.0 0.0 4.50 537 466 B 23 LEU H B 25 THR H 1.0 0.0 4.50 538 467 B 9 ASP H B 10 GLY H 1.0 0.0 4.50 539 468 B 9 ASP H B 11 GLN H 1.0 0.0 4.50 540 469 B 35 GLU H B 33 GLU H 1.0 0.0 4.50 541 470 B 40 ASP H B 39 LEU H 1.0 0.0 4.50 542 471 B 29 SER H B 30 SER H 1.0 0.0 4.50 543 472 B 46 TRP H B 44 SER H 1.0 0.0 4.50 544 473 B 43 ALA H B 45 LEU H 1.0 0.0 4.50 545 474 B 45 LEU H B 44 SER H 1.0 0.0 4.50 546 475 B 43 ALA H B 44 SER H 1.0 0.0 4.50 547 476 B 28 GLY H B 29 SER H 1.0 0.0 4.50 548 477 B 51 ILE H B 52 THR H 1.0 0.0 4.50 549 478 B 47 ASN H B 48 TRP H 1.0 0.0 4.50 550 479 B 42 TRP HE1 B 42 TRP H 1.0 0.0 4.50 551 480 B 54 TRP H B 54 TRP HE1 1.0 0.0 4.50 552 481 B 21 VAL H B 16 LYS H 1.0 0.0 4.50 553 482 B 13 TYR H B 14 VAL H 1.0 0.0 4.50 554 483 B 15 ARG H B 14 VAL H 1.0 0.0 4.50 555 484 B 18 GLY H B 16 LYS H 1.0 0.0 4.50 556 485 B 21 VAL H B 20 TRP H 1.0 0.0 4.50 557 486 B 24 SER H B 25 THR H 1.0 0.0 4.50 558 487 B 23 LEU H B 24 SER H 1.0 0.0 4.50 559 488 B 23 LEU H B 22 LEU H 1.0 0.0 4.50 560 489 B 21 VAL H B 22 LEU H 1.0 0.0 4.50 561 490 B 14 VAL H B 22 LEU H 1.0 0.0 4.50 562 491 B 35 GLU H B 33 GLU H 1.0 0.0 4.50 563 492 B 31 GLY H B 33 GLU H 1.0 0.0 4.50 564 493 B 14 VAL H B 23 LEU H 1.0 0.0 4.50 565 494 B 32 ASN H B 31 GLY H 1.0 0.0 4.50 566 495 B 31 GLY H B 30 SER H 1.0 0.0 4.50 567 496 B 23 LEU H B 25 THR H 1.0 0.0 4.50 568 497 B 40 ASP H B 42 TRP H 1.0 0.0 4.50 569 498 B 9 ASP H B 10 GLY H 1.0 0.0 4.50 570 499 B 10 GLY H B 11 GLN H 1.0 0.0 4.50 571 500 B 9 ASP H B 11 GLN H 1.0 0.0 4.50 572 501 B 32 ASN H B 34 GLN H 1.0 0.0 4.50 573 502 B 9 ASP H B 8 ARG H 1.0 0.0 4.50 574 503 B 40 ASP H B 39 LEU H 1.0 0.0 4.50 575 504 B 29 SER H B 30 SER H 1.0 0.0 4.50 576 505 B 46 TRP H B 44 SER H 1.0 0.0 4.50 577 506 B 42 TRP H B 44 SER H 1.0 0.0 4.50 578 507 B 43 ALA H B 45 LEU H 1.0 0.0 4.50 579 508 B 28 GLY H B 29 SER H 1.0 0.0 4.50 580 509 B 43 ALA H B 44 SER H 1.0 0.0 4.50 581 510 B 47 ASN H B 48 TRP H 1.0 0.0 4.50 582 511 B 50 ASN H B 51 ILE H 1.0 0.0 4.50 583 512 B 48 TRP H B 49 PHE H 1.0 0.0 4.50 584 513 B 46 TRP H B 45 LEU H 1.0 0.0 4.50 585 514 B 47 ASN H B 46 TRP H 1.0 0.0 4.50 586 515 B 53 ASN H B 52 THR H 1.0 0.0 4.50 587 516 B 53 ASN H B 51 ILE H 1.0 0.0 4.50 588 517 B 51 ILE H B 52 THR H 1.0 0.0 4.50 589 518 B 53 ASN H B 55 LEU H 1.0 0.0 4.50 590 519 B 26 PHE H B 25 THR H 1.0 0.0 4.50 591 520 B 57 TYR H B 55 LEU H 1.0 0.0 4.50 592 521 B 28 GLY H B 26 PHE H 1.0 0.0 4.50 593 522 B 45 LEU H B 44 SER H 1.0 0.0 4.50 594 523 B 54 TRP H B 55 LEU H 1.0 0.0 4.50 595 524 B 54 TRP H B 53 ASN H 1.0 0.0 4.50 596 525 B 47 ASN H B 45 LEU H 1.0 0.0 4.50 597 526 B 54 TRP H B 52 THR H 1.0 0.0 4.50 598 527 B 19 GLU H B 20 TRP H 1.0 0.0 4.50 599 528 B 50 ASN H B 49 PHE H 1.0 0.0 4.50 600 529 B 18 GLY H B 19 GLU H 1.0 0.0 4.50 601 530 B 50 ASN H B 52 THR H 1.0 0.0 4.50 602 531 B 50 ASN H B 48 TRP H 1.0 0.0 4.50 603 532 B 50 ASN H B 54 TRP HE1 1.0 0.0 4.50 604 533 B 56 TRP H B 56 TRP HE1 1.0 0.0 4.50 605 534 B 56 TRP H B 59 LYS H 1.0 0.0 4.50 606 535 B 54 TRP H B 56 TRP H 1.0 0.0 4.50 607 536 B 56 TRP H B 55 LEU H 1.0 0.0 4.50 608 537 B 56 TRP H B 58 ILE H 1.0 0.0 4.50 609 538 B 57 TYR H B 59 LYS H 1.0 0.0 4.50 610 539 B 28 GLY H B 27 LEU H 1.0 0.0 4.50 611 540 B 27 LEU H B 24 SER H 1.0 0.0 4.50 612 541 B 27 LEU H B 25 THR H 1.0 0.0 4.50 613 542 B 32 ASN H B 33 GLU H 1.0 0.0 4.50 614 543 B 50 ASN H B 53 ASN H 1.0 0.0 4.50 615 544 B 33 GLU H B 30 SER HA 1.0 0.0 4.50 616 545 B 33 GLU H B 36 LEU HG 1.0 0.0 4.50 617 546 B 32 ASN H B 29 SER HA 1.0 0.0 4.50 618 547 B 34 GLN H B 36 LEU HG 1.0 0.0 4.50 619 548 B 40 ASP H B 39 LEU HG 1.0 0.0 4.50 620 549 B 28 GLY H B 27 LEU HA 1.0 0.0 4.50 621 550 B 16 LYS H B 19 GLU H 1.0 0.0 4.50 622 551 B 57 TYR H B 59 LYS H 1.0 0.0 4.50 623 552 B 58 ILE H B 59 LYS H 1.0 0.0 4.50 624 553 B 23 LEU H B 24 SER H 1.0 0.0 4.50 625 554 B 38 GLU H B 39 LEU H 1.0 0.0 4.50 626 555 B 41 LYS H B 39 LEU H 1.0 0.0 4.50 627 556 B 34 GLN H B 35 GLU H 1.0 0.0 4.50 628 557 B 40 ASP H B 39 LEU H 1.0 0.0 4.50 629 558 B 46 TRP H B 45 LEU H 1.0 0.0 4.50 630 559 B 14 VAL H B 21 VAL H 1.0 0.0 4.50 631 560 B 38 GLU H B 39 LEU H 1.0 0.0 4.50 632 561 B 34 GLN H B 35 GLU H 1.0 0.0 4.50 633 562 B 34 GLN H B 33 GLU H 1.0 0.0 4.50 634 563 B 51 ILE H B 52 THR H 1.0 0.0 4.50 635 564 B 50 ASN H B 51 ILE H 1.0 0.0 4.50 636 565 B 54 TRP H B 56 TRP H 1.0 0.0 4.50 637 566 B 56 TRP H B 57 TYR H 1.0 0.0 4.50 638 567 B 28 GLY H B 27 LEU H 1.0 0.0 4.50 639 568 B 57 TYR H B 59 LYS H 1.0 0.0 4.50 640 569 B 56 TRP H B 57 TYR H 1.0 0.0 4.50 641 570 B 27 LEU H B 25 THR H 1.0 0.0 4.50 642 571 B 57 TYR H B 58 ILE H 1.0 0.0 4.50 643 572 B 58 ILE H B 59 LYS H 1.0 0.0 4.50 644 573 B 54 TRP H B 52 THR H 1.0 0.0 4.50 645 574 B 57 TYR H B 58 ILE H 1.0 0.0 4.50 646 575 B 14 VAL H B 21 VAL H 1.0 0.0 4.50 647 576 B 45 LEU H B 44 SER H 1.0 0.0 4.50 648 577 B 28 GLY H B 27 LEU H 1.0 0.0 4.50 649 578 B 28 GLY H B 27 LEU HBx 1.0 0.0 4.50 650 578 B 28 GLY H B 27 LEU HBy 1.0 0.0 4.50 651 579 B 29 SER H B 27 LEU HBx 1.0 0.0 4.50 652 579 B 29 SER H B 27 LEU HBy 1.0 0.0 4.50 653 580 B 33 GLU H B 31 GLY HAx 1.0 0.0 4.50 654 580 B 31 GLY HAy B 33 GLU H 1.0 0.0 4.50 655 581 B 34 GLN H B 32 ASN HBx 1.0 0.0 4.50 656 581 B 34 GLN H B 32 ASN HBy 1.0 0.0 4.50 657 582 B 35 GLU H B 32 ASN HBx 1.0 0.0 4.50 658 582 B 35 GLU H B 32 ASN HBy 1.0 0.0 4.50 659 583 B 38 GLU H B 40 ASP HBx 1.0 0.0 4.50 660 583 B 38 GLU H B 40 ASP HBy 1.0 0.0 4.50 661 584 B 39 LEU H B 40 ASP HBx 1.0 0.0 4.50 662 584 B 40 ASP HBy B 39 LEU H 1.0 0.0 4.50 663 585 B 40 ASP H B 40 ASP HBx 1.0 0.0 4.50 664 585 B 40 ASP HBy B 40 ASP H 1.0 0.0 4.50 665 586 B 45 LEU H B 45 LEU HBx 1.0 0.0 4.50 666 586 B 45 LEU H B 45 LEU HBy 1.0 0.0 4.50 667 587 B 53 ASN H B 53 ASN HBx 1.0 0.0 4.50 668 587 B 53 ASN H B 53 ASN HBy 1.0 0.0 4.50 669 588 B 54 TRP H B 53 ASN HBx 1.0 0.0 4.50 670 588 B 54 TRP H B 53 ASN HBy 1.0 0.0 4.50 671 589 B 34 GLN H B 36 LEU H 1.0 0.0 4.50 672 590 B 38 GLU H B 40 ASP H 1.0 0.0 4.50 673 591 B 32 ASN H B 29 SER HA 1.0 0.0 4.50 674 592 B 33 GLU H B 30 SER HA 1.0 0.0 4.50 675 593 B 33 GLU H B 31 GLY HAx 1.0 0.0 4.50 676 593 B 31 GLY HAy B 33 GLU H 1.0 0.0 4.50 677 594 B 17 ASP H B 18 GLY H 1.0 0.0 5.50 678 595 B 48 TRP HE1 B 48 TRP H 1.0 0.0 5.50 679 596 B 13 TYR H B 21 VAL H 1.0 0.0 5.50 680 597 B 15 ARG H B 21 VAL H 1.0 0.0 5.50 681 598 B 21 VAL H B 19 GLU H 1.0 0.0 5.50 682 599 B 10 GLY H B 8 ARG H 1.0 0.0 5.50 683 600 B 14 VAL H B 16 LYS H 1.0 0.0 5.50 684 601 B 13 TYR H B 23 LEU H 1.0 0.0 5.50 685 602 B 26 PHE H B 24 SER H 1.0 0.0 5.50 686 603 B 16 LYS H B 20 TRP H 1.0 0.0 5.50 687 604 B 24 SER H B 22 LEU H 1.0 0.0 5.50 688 605 B 22 LEU H B 25 THR H 1.0 0.0 5.50 689 606 B 23 LEU H B 21 VAL H 1.0 0.0 5.50 690 607 B 15 ARG H B 16 LYS H 1.0 0.0 5.50 691 608 B 28 GLY H B 25 THR H 1.0 0.0 5.50 692 609 B 42 TRP HE1 B 39 LEU H 1.0 0.0 5.50 693 610 B 48 TRP HE1 B 48 TRP H 1.0 0.0 5.50 694 611 B 20 TRP HE1 B 6 ALA H 1.0 0.0 5.50 695 612 B 15 ARG H B 21 VAL H 1.0 0.0 5.50 696 613 B 23 LEU H B 21 VAL H 1.0 0.0 5.50 697 614 B 21 VAL H B 19 GLU H 1.0 0.0 5.50 698 615 B 10 GLY H B 8 ARG H 1.0 0.0 5.50 699 616 B 14 VAL H B 16 LYS H 1.0 0.0 5.50 700 617 B 13 TYR H B 12 ALA H 1.0 0.0 5.50 701 618 B 13 TYR H B 21 VAL H 1.0 0.0 5.50 702 619 B 17 ASP H B 18 GLY H 1.0 0.0 5.50 703 620 B 24 SER H B 22 LEU H 1.0 0.0 5.50 704 621 B 20 TRP HE1 B 20 TRP H 1.0 0.0 5.50 705 622 B 16 LYS H B 20 TRP H 1.0 0.0 5.50 706 623 B 15 ARG H B 16 LYS H 1.0 0.0 5.50 707 624 B 22 LEU H B 25 THR H 1.0 0.0 5.50 708 625 B 13 TYR H B 23 LEU H 1.0 0.0 5.50 709 626 B 32 ASN H B 35 GLU H 1.0 0.0 5.50 710 627 B 28 GLY H B 25 THR H 1.0 0.0 5.50 711 628 B 51 ILE H B 49 PHE H 1.0 0.0 5.50 712 629 B 23 LEU H B 12 ALA H 1.0 0.0 5.50 713 630 B 12 ALA H B 24 SER H 1.0 0.0 5.50 714 631 B 26 PHE H B 24 SER H 1.0 0.0 5.50 715 632 B 50 ASN H B 47 ASN H 1.0 0.0 5.50 716 633 B 5 GLU H B 6 ALA H 1.0 0.0 5.50 717 634 B 54 TRP H B 57 TYR H 1.0 0.0 5.50 718 635 B 27 LEU H B 29 SER H 1.0 0.0 5.50 719 636 B 32 ASN H B 30 SER H 1.0 0.0 5.50 720 637 B 56 TRP H B 59 LYS H 1.0 0.0 5.50 721 638 B 23 LEU H B 25 THR H 1.0 0.0 5.50 722 639 B 43 ALA H B 45 LEU H 1.0 0.0 5.50 723 640 B 47 ASN H B 45 LEU H 1.0 0.0 5.50 724 641 B 43 ALA H B 45 LEU H 1.0 0.0 5.50 725 642 B 54 TRP H B 52 THR H 1.0 0.0 5.50 726 643 B 9 ASP H B 11 GLN H 1.0 0.0 5.50 727 644 B 50 ASN H B 48 TRP H 1.0 0.0 5.50 728 645 B 53 ASN H B 55 LEU H 1.0 0.0 5.50 729 646 B 27 LEU H B 25 THR H 1.0 0.0 5.50 730 647 B 56 TRP H B 58 ILE H 1.0 0.0 5.50 731 648 B 46 TRP H B 44 SER H 1.0 0.0 5.50 732 649 B 28 GLY H B 26 PHE H 1.0 0.0 5.50 733 650 B 47 ASN H B 45 LEU H 1.0 0.0 5.50 734 651 B 56 TRP H B 58 ILE H 1.0 0.0 5.50 735 652 B 42 TRP H B 44 SER H 1.0 0.0 5.50 736 653 B 27 LEU H B 24 SER H 1.0 0.0 5.50 737 654 B 46 TRP H B 44 SER H 1.0 0.0 5.50 738 655 B 34 GLN H B 31 GLY HAx 1.0 0.0 5.50 739 655 B 34 GLN H B 31 GLY HAy 1.0 0.0 5.50 740 656 B 43 ALA H B 40 ASP HBx 1.0 0.0 5.50 741 656 B 40 ASP HBy B 43 ALA H 1.0 0.0 5.50 742 657 B 34 GLN H B 31 GLY HAx 1.0 0.0 5.50 743 657 B 34 GLN H B 31 GLY HAy 1.0 0.0 5.50 744 658 B 17 ASP H B 16 LYS H 1.0 0.0 6.50 745 659 B 42 TRP HE1 B 43 ALA H 1.0 0.0 6.50 746 660 B 48 TRP HE1 B 49 PHE H 1.0 0.0 6.50 747 661 B 54 TRP HE1 B 55 LEU H 1.0 0.0 6.50 748 662 B 54 TRP HE1 B 51 ILE H 1.0 0.0 6.50 749 663 B 14 VAL H B 20 TRP H 1.0 0.0 6.50 750 664 B 26 PHE H B 23 LEU H 1.0 0.0 6.50 751 665 B 42 TRP HE1 B 43 ALA H 1.0 0.0 6.50 752 666 B 54 TRP HE1 B 51 ILE H 1.0 0.0 6.50 753 667 B 17 ASP H B 16 LYS H 1.0 0.0 6.50 754 668 B 26 PHE H B 23 LEU H 1.0 0.0 6.50 755 669 B 12 ALA H B 11 GLN H 1.0 0.0 6.50 756 670 B 17 ASP H B 19 GLU H 1.0 0.0 6.50 757 671 B 58 ILE H B 55 LEU H 1.0 0.0 6.50 758 672 B 42 TRP H B 39 LEU H 1.0 0.0 6.50 759 673 B 27 LEU H B 23 LEU H 1.0 0.0 6.50 760 674 B 30 SER H B 33 GLU H 1.0 0.0 6.50 761 675 B 52 THR H B 55 LEU H 1.0 0.0 6.50 762 676 B 43 ALA H B 42 TRP HBx 1.0 0.0 6.50 763 676 B 43 ALA H B 42 TRP HBy 1.0 0.0 6.50 764 677 B 43 ALA H B 42 TRP HBx 1.0 0.0 6.50 765 677 B 43 ALA H B 42 TRP HBy 1.0 0.0 6.50 766 678 B 57 TYR H B 54 TRP HA 1.0 0.0 6.50 767 679 B 21 VAL H B 16 LYS H 1.0 0.0 6.50 768 680 B 38 GLU H B 40 ASP H 1.0 0.0 6.50 769 681 B 43 ALA H B 40 ASP H 1.0 0.0 6.50 770 682 B 23 LEU H B 25 THR H 1.0 0.0 6.50 771 683 B 54 TRP H B 57 TYR H 1.0 0.0 6.50 772 684 B 50 ASN H B 52 THR H 1.0 0.0 6.50 773 685 B 28 GLY H B 25 THR H 1.0 0.0 6.50 774 686 C 14 VAL H C 21 VAL H 1.0 0.0 3.00 775 687 C 34 GLN H C 35 GLU H 1.0 0.0 3.00 776 688 C 34 GLN H C 33 GLU H 1.0 0.0 3.00 777 689 C 38 GLU H C 39 LEU H 1.0 0.0 3.00 778 690 C 35 GLU H C 36 LEU H 1.0 0.0 3.00 779 691 C 14 VAL H C 21 VAL H 1.0 0.0 3.00 780 692 C 34 GLN H C 33 GLU H 1.0 0.0 3.00 781 693 C 35 GLU H C 36 LEU H 1.0 0.0 3.00 782 694 C 34 GLN H C 35 GLU H 1.0 0.0 3.00 783 695 C 38 GLU H C 39 LEU H 1.0 0.0 3.00 784 696 C 43 ALA H C 42 TRP H 1.0 0.0 3.00 785 697 C 27 LEU H C 26 PHE H 1.0 0.0 3.00 786 698 C 16 LYS H C 19 GLU H 1.0 0.0 3.00 787 699 C 56 TRP H C 57 TYR H 1.0 0.0 3.00 788 700 C 57 TYR H C 58 ILE H 1.0 0.0 3.00 789 701 C 58 ILE H C 59 LYS H 1.0 0.0 3.00 790 702 C 33 GLU HA C 33 GLU H 1.0 0.0 3.00 791 703 C 43 ALA H C 43 ALA HB1 1.0 0.0 3.00 792 704 C 34 GLN H C 34 GLN HA 1.0 0.0 3.00 793 705 C 48 TRP H C 48 TRP HA 1.0 0.0 3.00 794 706 C 28 GLY H C 28 GLY HAx 1.0 0.0 3.00 795 706 C 28 GLY H C 28 GLY HAy 1.0 0.0 3.00 796 707 C 32 ASN H C 31 GLY HAx 1.0 0.0 3.00 797 707 C 32 ASN H C 31 GLY HAy 1.0 0.0 3.00 798 708 C 33 GLU H C 32 ASN HBx 1.0 0.0 3.50 799 708 C 32 ASN HBy C 33 GLU H 1.0 0.0 3.50 800 709 C 42 TRP HE1 C 42 TRP H 1.0 0.0 4.50 801 710 C 42 TRP HE1 C 38 GLU H 1.0 0.0 4.75 802 711 C 50 ASN H C 54 TRP HE1 1.0 0.0 4.50 803 712 C 54 TRP H C 54 TRP HE1 1.0 0.0 4.50 804 713 C 21 VAL H C 20 TRP H 1.0 0.0 4.50 805 714 C 21 VAL H C 22 LEU H 1.0 0.0 4.50 806 715 C 21 VAL H C 16 LYS H 1.0 0.0 4.50 807 716 C 10 GLY H C 11 GLN H 1.0 0.0 4.50 808 717 C 15 ARG H C 14 VAL H 1.0 0.0 4.50 809 718 C 14 VAL H C 23 LEU H 1.0 0.0 4.50 810 719 C 13 TYR H C 14 VAL H 1.0 0.0 4.50 811 720 C 18 GLY H C 16 LYS H 1.0 0.0 4.50 812 721 C 23 LEU H C 24 SER H 1.0 0.0 4.50 813 722 C 19 GLU H C 20 TRP H 1.0 0.0 4.50 814 723 C 24 SER H C 25 THR H 1.0 0.0 4.50 815 724 C 23 LEU H C 22 LEU H 1.0 0.0 4.50 816 725 C 14 VAL H C 22 LEU H 1.0 0.0 4.50 817 726 C 9 ASP H C 8 ARG H 1.0 0.0 4.50 818 727 C 31 GLY H C 33 GLU H 1.0 0.0 4.50 819 728 C 32 ASN H C 31 GLY H 1.0 0.0 4.50 820 729 C 31 GLY H C 30 SER H 1.0 0.0 4.50 821 730 C 23 LEU H C 25 THR H 1.0 0.0 4.50 822 731 C 9 ASP H C 10 GLY H 1.0 0.0 4.50 823 732 C 9 ASP H C 11 GLN H 1.0 0.0 4.50 824 733 C 35 GLU H C 33 GLU H 1.0 0.0 4.50 825 734 C 40 ASP H C 39 LEU H 1.0 0.0 4.50 826 735 C 29 SER H C 30 SER H 1.0 0.0 4.50 827 736 C 46 TRP H C 44 SER H 1.0 0.0 4.50 828 737 C 43 ALA H C 45 LEU H 1.0 0.0 4.50 829 738 C 45 LEU H C 44 SER H 1.0 0.0 4.50 830 739 C 43 ALA H C 44 SER H 1.0 0.0 4.50 831 740 C 28 GLY H C 29 SER H 1.0 0.0 4.50 832 741 C 51 ILE H C 52 THR H 1.0 0.0 4.50 833 742 C 47 ASN H C 48 TRP H 1.0 0.0 4.50 834 743 C 42 TRP HE1 C 42 TRP H 1.0 0.0 4.50 835 744 C 54 TRP H C 54 TRP HE1 1.0 0.0 4.50 836 745 C 21 VAL H C 16 LYS H 1.0 0.0 4.50 837 746 C 13 TYR H C 14 VAL H 1.0 0.0 4.50 838 747 C 15 ARG H C 14 VAL H 1.0 0.0 4.50 839 748 C 18 GLY H C 16 LYS H 1.0 0.0 4.50 840 749 C 21 VAL H C 20 TRP H 1.0 0.0 4.50 841 750 C 24 SER H C 25 THR H 1.0 0.0 4.50 842 751 C 23 LEU H C 24 SER H 1.0 0.0 4.50 843 752 C 23 LEU H C 22 LEU H 1.0 0.0 4.50 844 753 C 21 VAL H C 22 LEU H 1.0 0.0 4.50 845 754 C 14 VAL H C 22 LEU H 1.0 0.0 4.50 846 755 C 35 GLU H C 33 GLU H 1.0 0.0 4.50 847 756 C 31 GLY H C 33 GLU H 1.0 0.0 4.50 848 757 C 14 VAL H C 23 LEU H 1.0 0.0 4.50 849 758 C 32 ASN H C 31 GLY H 1.0 0.0 4.50 850 759 C 31 GLY H C 30 SER H 1.0 0.0 4.50 851 760 C 23 LEU H C 25 THR H 1.0 0.0 4.50 852 761 C 40 ASP H C 42 TRP H 1.0 0.0 4.50 853 762 C 9 ASP H C 10 GLY H 1.0 0.0 4.50 854 763 C 10 GLY H C 11 GLN H 1.0 0.0 4.50 855 764 C 9 ASP H C 11 GLN H 1.0 0.0 4.50 856 765 C 32 ASN H C 34 GLN H 1.0 0.0 4.50 857 766 C 9 ASP H C 8 ARG H 1.0 0.0 4.50 858 767 C 40 ASP H C 39 LEU H 1.0 0.0 4.50 859 768 C 29 SER H C 30 SER H 1.0 0.0 4.50 860 769 C 46 TRP H C 44 SER H 1.0 0.0 4.50 861 770 C 42 TRP H C 44 SER H 1.0 0.0 4.50 862 771 C 43 ALA H C 45 LEU H 1.0 0.0 4.50 863 772 C 28 GLY H C 29 SER H 1.0 0.0 4.50 864 773 C 43 ALA H C 44 SER H 1.0 0.0 4.50 865 774 C 47 ASN H C 48 TRP H 1.0 0.0 4.50 866 775 C 50 ASN H C 51 ILE H 1.0 0.0 4.50 867 776 C 48 TRP H C 49 PHE H 1.0 0.0 4.50 868 777 C 46 TRP H C 45 LEU H 1.0 0.0 4.50 869 778 C 47 ASN H C 46 TRP H 1.0 0.0 4.50 870 779 C 53 ASN H C 52 THR H 1.0 0.0 4.50 871 780 C 53 ASN H C 51 ILE H 1.0 0.0 4.50 872 781 C 51 ILE H C 52 THR H 1.0 0.0 4.50 873 782 C 53 ASN H C 55 LEU H 1.0 0.0 4.50 874 783 C 26 PHE H C 25 THR H 1.0 0.0 4.50 875 784 C 57 TYR H C 55 LEU H 1.0 0.0 4.50 876 785 C 28 GLY H C 26 PHE H 1.0 0.0 4.50 877 786 C 45 LEU H C 44 SER H 1.0 0.0 4.50 878 787 C 54 TRP H C 55 LEU H 1.0 0.0 4.50 879 788 C 54 TRP H C 53 ASN H 1.0 0.0 4.50 880 789 C 47 ASN H C 45 LEU H 1.0 0.0 4.50 881 790 C 54 TRP H C 52 THR H 1.0 0.0 4.50 882 791 C 19 GLU H C 20 TRP H 1.0 0.0 4.50 883 792 C 50 ASN H C 49 PHE H 1.0 0.0 4.50 884 793 C 18 GLY H C 19 GLU H 1.0 0.0 4.50 885 794 C 50 ASN H C 52 THR H 1.0 0.0 4.50 886 795 C 50 ASN H C 48 TRP H 1.0 0.0 4.50 887 796 C 50 ASN H C 54 TRP HE1 1.0 0.0 4.50 888 797 C 56 TRP H C 56 TRP HE1 1.0 0.0 4.50 889 798 C 56 TRP H C 59 LYS H 1.0 0.0 4.50 890 799 C 54 TRP H C 56 TRP H 1.0 0.0 4.50 891 800 C 56 TRP H C 55 LEU H 1.0 0.0 4.50 892 801 C 56 TRP H C 58 ILE H 1.0 0.0 4.50 893 802 C 57 TYR H C 59 LYS H 1.0 0.0 4.50 894 803 C 28 GLY H C 27 LEU H 1.0 0.0 4.50 895 804 C 27 LEU H C 24 SER H 1.0 0.0 4.50 896 805 C 27 LEU H C 25 THR H 1.0 0.0 4.50 897 806 C 32 ASN H C 33 GLU H 1.0 0.0 4.50 898 807 C 50 ASN H C 53 ASN H 1.0 0.0 4.50 899 808 C 33 GLU H C 30 SER HA 1.0 0.0 4.50 900 809 C 33 GLU H C 36 LEU HG 1.0 0.0 4.50 901 810 C 32 ASN H C 29 SER HA 1.0 0.0 4.50 902 811 C 34 GLN H C 36 LEU HG 1.0 0.0 4.50 903 812 C 40 ASP H C 39 LEU HG 1.0 0.0 4.50 904 813 C 28 GLY H C 27 LEU HA 1.0 0.0 4.50 905 814 C 16 LYS H C 19 GLU H 1.0 0.0 4.50 906 815 C 57 TYR H C 59 LYS H 1.0 0.0 4.50 907 816 C 58 ILE H C 59 LYS H 1.0 0.0 4.50 908 817 C 23 LEU H C 24 SER H 1.0 0.0 4.50 909 818 C 38 GLU H C 39 LEU H 1.0 0.0 4.50 910 819 C 41 LYS H C 39 LEU H 1.0 0.0 4.50 911 820 C 34 GLN H C 35 GLU H 1.0 0.0 4.50 912 821 C 40 ASP H C 39 LEU H 1.0 0.0 4.50 913 822 C 46 TRP H C 45 LEU H 1.0 0.0 4.50 914 823 C 14 VAL H C 21 VAL H 1.0 0.0 4.50 915 824 C 38 GLU H C 39 LEU H 1.0 0.0 4.50 916 825 C 34 GLN H C 35 GLU H 1.0 0.0 4.50 917 826 C 34 GLN H C 33 GLU H 1.0 0.0 4.50 918 827 C 51 ILE H C 52 THR H 1.0 0.0 4.50 919 828 C 50 ASN H C 51 ILE H 1.0 0.0 4.50 920 829 C 54 TRP H C 56 TRP H 1.0 0.0 4.50 921 830 C 56 TRP H C 57 TYR H 1.0 0.0 4.50 922 831 C 28 GLY H C 27 LEU H 1.0 0.0 4.50 923 832 C 57 TYR H C 59 LYS H 1.0 0.0 4.50 924 833 C 56 TRP H C 57 TYR H 1.0 0.0 4.50 925 834 C 27 LEU H C 25 THR H 1.0 0.0 4.50 926 835 C 57 TYR H C 58 ILE H 1.0 0.0 4.50 927 836 C 58 ILE H C 59 LYS H 1.0 0.0 4.50 928 837 C 54 TRP H C 52 THR H 1.0 0.0 4.50 929 838 C 57 TYR H C 58 ILE H 1.0 0.0 4.50 930 839 C 14 VAL H C 21 VAL H 1.0 0.0 4.50 931 840 C 45 LEU H C 44 SER H 1.0 0.0 4.50 932 841 C 28 GLY H C 27 LEU H 1.0 0.0 4.50 933 842 C 28 GLY H C 27 LEU HBx 1.0 0.0 4.50 934 842 C 28 GLY H C 27 LEU HBy 1.0 0.0 4.50 935 843 C 29 SER H C 27 LEU HBx 1.0 0.0 4.50 936 843 C 29 SER H C 27 LEU HBy 1.0 0.0 4.50 937 844 C 33 GLU H C 31 GLY HAx 1.0 0.0 4.50 938 844 C 31 GLY HAy C 33 GLU H 1.0 0.0 4.50 939 845 C 34 GLN H C 32 ASN HBx 1.0 0.0 4.50 940 845 C 34 GLN H C 32 ASN HBy 1.0 0.0 4.50 941 846 C 35 GLU H C 32 ASN HBx 1.0 0.0 4.50 942 846 C 35 GLU H C 32 ASN HBy 1.0 0.0 4.50 943 847 C 38 GLU H C 40 ASP HBx 1.0 0.0 4.50 944 847 C 38 GLU H C 40 ASP HBy 1.0 0.0 4.50 945 848 C 39 LEU H C 40 ASP HBx 1.0 0.0 4.50 946 848 C 40 ASP HBy C 39 LEU H 1.0 0.0 4.50 947 849 C 40 ASP H C 40 ASP HBx 1.0 0.0 4.50 948 849 C 40 ASP HBy C 40 ASP H 1.0 0.0 4.50 949 850 C 45 LEU H C 45 LEU HBx 1.0 0.0 4.50 950 850 C 45 LEU H C 45 LEU HBy 1.0 0.0 4.50 951 851 C 53 ASN H C 53 ASN HBx 1.0 0.0 4.50 952 851 C 53 ASN H C 53 ASN HBy 1.0 0.0 4.50 953 852 C 54 TRP H C 53 ASN HBx 1.0 0.0 4.50 954 852 C 54 TRP H C 53 ASN HBy 1.0 0.0 4.50 955 853 C 34 GLN H C 36 LEU H 1.0 0.0 4.50 956 854 C 38 GLU H C 40 ASP H 1.0 0.0 4.50 957 855 C 32 ASN H C 29 SER HA 1.0 0.0 4.50 958 856 C 33 GLU H C 30 SER HA 1.0 0.0 4.50 959 857 C 33 GLU H C 31 GLY HAx 1.0 0.0 4.50 960 857 C 31 GLY HAy C 33 GLU H 1.0 0.0 4.50 961 858 C 17 ASP H C 18 GLY H 1.0 0.0 5.50 962 859 C 48 TRP HE1 C 48 TRP H 1.0 0.0 5.50 963 860 C 13 TYR H C 21 VAL H 1.0 0.0 5.50 964 861 C 15 ARG H C 21 VAL H 1.0 0.0 5.50 965 862 C 21 VAL H C 19 GLU H 1.0 0.0 5.50 966 863 C 10 GLY H C 8 ARG H 1.0 0.0 5.50 967 864 C 14 VAL H C 16 LYS H 1.0 0.0 5.50 968 865 C 13 TYR H C 23 LEU H 1.0 0.0 5.50 969 866 C 26 PHE H C 24 SER H 1.0 0.0 5.50 970 867 C 16 LYS H C 20 TRP H 1.0 0.0 5.50 971 868 C 24 SER H C 22 LEU H 1.0 0.0 5.50 972 869 C 22 LEU H C 25 THR H 1.0 0.0 5.50 973 870 C 23 LEU H C 21 VAL H 1.0 0.0 5.50 974 871 C 15 ARG H C 16 LYS H 1.0 0.0 5.50 975 872 C 28 GLY H C 25 THR H 1.0 0.0 5.50 976 873 C 42 TRP HE1 C 39 LEU H 1.0 0.0 5.50 977 874 C 48 TRP HE1 C 48 TRP H 1.0 0.0 5.50 978 875 C 20 TRP HE1 C 6 ALA H 1.0 0.0 5.50 979 876 C 15 ARG H C 21 VAL H 1.0 0.0 5.50 980 877 C 23 LEU H C 21 VAL H 1.0 0.0 5.50 981 878 C 21 VAL H C 19 GLU H 1.0 0.0 5.50 982 879 C 10 GLY H C 8 ARG H 1.0 0.0 5.50 983 880 C 14 VAL H C 16 LYS H 1.0 0.0 5.50 984 881 C 13 TYR H C 12 ALA H 1.0 0.0 5.50 985 882 C 13 TYR H C 21 VAL H 1.0 0.0 5.50 986 883 C 17 ASP H C 18 GLY H 1.0 0.0 5.50 987 884 C 24 SER H C 22 LEU H 1.0 0.0 5.50 988 885 C 20 TRP HE1 C 20 TRP H 1.0 0.0 5.50 989 886 C 16 LYS H C 20 TRP H 1.0 0.0 5.50 990 887 C 15 ARG H C 16 LYS H 1.0 0.0 5.50 991 888 C 22 LEU H C 25 THR H 1.0 0.0 5.50 992 889 C 13 TYR H C 23 LEU H 1.0 0.0 5.50 993 890 C 32 ASN H C 35 GLU H 1.0 0.0 5.50 994 891 C 28 GLY H C 25 THR H 1.0 0.0 5.50 995 892 C 51 ILE H C 49 PHE H 1.0 0.0 5.50 996 893 C 23 LEU H C 12 ALA H 1.0 0.0 5.50 997 894 C 12 ALA H C 24 SER H 1.0 0.0 5.50 998 895 C 26 PHE H C 24 SER H 1.0 0.0 5.50 999 896 C 50 ASN H C 47 ASN H 1.0 0.0 5.50 1000 897 C 5 GLU H C 6 ALA H 1.0 0.0 5.50 1001 898 C 54 TRP H C 57 TYR H 1.0 0.0 5.50 1002 899 C 27 LEU H C 29 SER H 1.0 0.0 5.50 1003 900 C 32 ASN H C 30 SER H 1.0 0.0 5.50 1004 901 C 56 TRP H C 59 LYS H 1.0 0.0 5.50 1005 902 C 23 LEU H C 25 THR H 1.0 0.0 5.50 1006 903 C 43 ALA H C 45 LEU H 1.0 0.0 5.50 1007 904 C 47 ASN H C 45 LEU H 1.0 0.0 5.50 1008 905 C 43 ALA H C 45 LEU H 1.0 0.0 5.50 1009 906 C 54 TRP H C 52 THR H 1.0 0.0 5.50 1010 907 C 9 ASP H C 11 GLN H 1.0 0.0 5.50 1011 908 C 50 ASN H C 48 TRP H 1.0 0.0 5.50 1012 909 C 53 ASN H C 55 LEU H 1.0 0.0 5.50 1013 910 C 27 LEU H C 25 THR H 1.0 0.0 5.50 1014 911 C 56 TRP H C 58 ILE H 1.0 0.0 5.50 1015 912 C 46 TRP H C 44 SER H 1.0 0.0 5.50 1016 913 C 28 GLY H C 26 PHE H 1.0 0.0 5.50 1017 914 C 47 ASN H C 45 LEU H 1.0 0.0 5.50 1018 915 C 56 TRP H C 58 ILE H 1.0 0.0 5.50 1019 916 C 42 TRP H C 44 SER H 1.0 0.0 5.50 1020 917 C 27 LEU H C 24 SER H 1.0 0.0 5.50 1021 918 C 46 TRP H C 44 SER H 1.0 0.0 5.50 1022 919 C 34 GLN H C 31 GLY HAx 1.0 0.0 5.50 1023 919 C 34 GLN H C 31 GLY HAy 1.0 0.0 5.50 1024 920 C 43 ALA H C 40 ASP HBx 1.0 0.0 5.50 1025 920 C 40 ASP HBy C 43 ALA H 1.0 0.0 5.50 1026 921 C 34 GLN H C 31 GLY HAx 1.0 0.0 5.50 1027 921 C 34 GLN H C 31 GLY HAy 1.0 0.0 5.50 1028 922 C 17 ASP H C 16 LYS H 1.0 0.0 6.50 1029 923 C 42 TRP HE1 C 43 ALA H 1.0 0.0 6.50 1030 924 C 48 TRP HE1 C 49 PHE H 1.0 0.0 6.50 1031 925 C 54 TRP HE1 C 55 LEU H 1.0 0.0 6.50 1032 926 C 54 TRP HE1 C 51 ILE H 1.0 0.0 6.50 1033 927 C 14 VAL H C 20 TRP H 1.0 0.0 6.50 1034 928 C 26 PHE H C 23 LEU H 1.0 0.0 6.50 1035 929 C 42 TRP HE1 C 43 ALA H 1.0 0.0 6.50 1036 930 C 54 TRP HE1 C 51 ILE H 1.0 0.0 6.50 1037 931 C 17 ASP H C 16 LYS H 1.0 0.0 6.50 1038 932 C 26 PHE H C 23 LEU H 1.0 0.0 6.50 1039 933 C 12 ALA H C 11 GLN H 1.0 0.0 6.50 1040 934 C 17 ASP H C 19 GLU H 1.0 0.0 6.50 1041 935 C 58 ILE H C 55 LEU H 1.0 0.0 6.50 1042 936 C 42 TRP H C 39 LEU H 1.0 0.0 6.50 1043 937 C 27 LEU H C 23 LEU H 1.0 0.0 6.50 1044 938 C 30 SER H C 33 GLU H 1.0 0.0 6.50 1045 939 C 52 THR H C 55 LEU H 1.0 0.0 6.50 1046 940 C 43 ALA H C 42 TRP HBx 1.0 0.0 6.50 1047 940 C 43 ALA H C 42 TRP HBy 1.0 0.0 6.50 1048 941 C 43 ALA H C 42 TRP HBx 1.0 0.0 6.50 1049 941 C 43 ALA H C 42 TRP HBy 1.0 0.0 6.50 1050 942 C 57 TYR H C 54 TRP HA 1.0 0.0 6.50 1051 943 C 21 VAL H C 16 LYS H 1.0 0.0 6.50 1052 944 C 38 GLU H C 40 ASP H 1.0 0.0 6.50 1053 945 C 43 ALA H C 40 ASP H 1.0 0.0 6.50 1054 946 C 23 LEU H C 25 THR H 1.0 0.0 6.50 1055 947 C 54 TRP H C 57 TYR H 1.0 0.0 6.50 1056 948 C 50 ASN H C 52 THR H 1.0 0.0 6.50 1057 949 C 28 GLY H C 25 THR H 1.0 0.0 6.50 stop_ save_ save_CNS/XPLOR_dihedral_5 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_5 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 7 PRO C A 8 ARG N A 8 ARG CA A 8 ARG C 1.0 -143.12 -49.58 PHI 2 2 A 9 ASP C A 10 GLY N A 10 GLY CA A 10 GLY C 1.0 61.10 101.10 PHI 3 3 A 10 GLY C A 11 GLN N A 11 GLN CA A 11 GLN C 1.0 -144.57 -73.77 PHI 4 4 A 11 GLN C A 12 ALA N A 12 ALA CA A 12 ALA C 1.0 -145.67 -79.31 PHI 5 5 A 13 TYR C A 14 VAL N A 14 VAL CA A 14 VAL C 1.0 -163.86 -111.72 PHI 6 6 A 14 VAL C A 15 ARG N A 15 ARG CA A 15 ARG C 1.0 -137.69 -93.97 PHI 7 7 A 15 ARG C A 16 LYS N A 16 LYS CA A 16 LYS C 1.0 -160.18 -67.08 PHI 8 8 A 17 ASP C A 18 GLY N A 18 GLY CA A 18 GLY C 1.0 54.97 97.33 PHI 9 9 A 18 GLY C A 19 GLU N A 19 GLU CA A 19 GLU C 1.0 -152.25 -112.25 PHI 10 10 A 19 GLU C A 20 TRP N A 20 TRP CA A 20 TRP C 1.0 -125.26 -73.12 PHI 11 11 A 20 TRP C A 21 VAL N A 21 VAL CA A 21 VAL C 1.0 -141.81 -101.81 PHI 12 12 A 21 VAL C A 22 LEU N A 22 LEU CA A 22 LEU C 1.0 -125.41 -48.43 PHI 13 13 A 22 LEU C A 23 LEU N A 23 LEU CA A 23 LEU C 1.0 -82.69 -42.69 PHI 14 14 A 23 LEU C A 24 SER N A 24 SER CA A 24 SER C 1.0 -83.76 -43.76 PHI 15 15 A 24 SER C A 25 THR N A 25 THR CA A 25 THR C 1.0 -93.42 -53.42 PHI 16 16 A 25 THR C A 26 PHE N A 26 PHE CA A 26 PHE C 1.0 -92.83 -52.83 PHI 17 17 A 32 ASN C A 33 GLU N A 33 GLU CA A 33 GLU C 1.0 -88.77 -48.77 PHI 18 18 A 34 GLN C A 35 GLU N A 35 GLU CA A 35 GLU C 1.0 -88.80 -48.80 PHI 19 19 A 35 GLU C A 36 LEU N A 36 LEU CA A 36 LEU C 1.0 -87.68 -47.68 PHI 20 20 A 36 LEU C A 37 LEU N A 37 LEU CA A 37 LEU C 1.0 -117.62 -31.90 PHI 21 21 A 38 GLU C A 39 LEU N A 39 LEU CA A 39 LEU C 1.0 -84.85 -44.85 PHI 22 22 A 39 LEU C A 40 ASP N A 40 ASP CA A 40 ASP C 1.0 -83.76 -43.76 PHI 23 23 A 40 ASP C A 41 LYS N A 41 LYS CA A 41 LYS C 1.0 -83.02 -43.02 PHI 24 24 A 41 LYS C A 42 TRP N A 42 TRP CA A 42 TRP C 1.0 -87.52 -47.52 PHI 25 25 A 42 TRP C A 43 ALA N A 43 ALA CA A 43 ALA C 1.0 -86.68 -46.68 PHI 26 26 A 43 ALA C A 44 SER N A 44 SER CA A 44 SER C 1.0 -83.63 -43.63 PHI 27 27 A 44 SER C A 45 LEU N A 45 LEU CA A 45 LEU C 1.0 -86.33 -46.33 PHI 28 28 A 45 LEU C A 46 TRP N A 46 TRP CA A 46 TRP C 1.0 -85.44 -45.44 PHI 29 29 A 46 TRP C A 47 ASN N A 47 ASN CA A 47 ASN C 1.0 -82.42 -42.42 PHI 30 30 A 47 ASN C A 48 TRP N A 48 TRP CA A 48 TRP C 1.0 -87.02 -47.02 PHI 31 31 A 48 TRP C A 49 PHE N A 49 PHE CA A 49 PHE C 1.0 -127.35 -45.57 PHI 32 32 A 49 PHE C A 50 ASN N A 50 ASN CA A 50 ASN C 1.0 -88.18 -48.18 PHI 33 33 A 50 ASN C A 51 ILE N A 51 ILE CA A 51 ILE C 1.0 -94.70 -37.58 PHI 34 34 A 51 ILE C A 52 THR N A 52 THR CA A 52 THR C 1.0 -82.80 -42.80 PHI 35 35 A 52 THR C A 53 ASN N A 53 ASN CA A 53 ASN C 1.0 -80.53 -40.53 PHI 36 36 A 53 ASN C A 54 TRP N A 54 TRP CA A 54 TRP C 1.0 -82.00 -42.00 PHI 37 37 A 54 TRP C A 55 LEU N A 55 LEU CA A 55 LEU C 1.0 -87.00 -47.00 PHI 38 38 A 55 LEU C A 56 TRP N A 56 TRP CA A 56 TRP C 1.0 -87.04 -47.04 PHI 39 39 A 56 TRP C A 57 TYR N A 57 TYR CA A 57 TYR C 1.0 -90.97 -50.97 PHI 40 40 A 57 TYR C A 58 ILE N A 58 ILE CA A 58 ILE C 1.0 -122.12 -73.20 PHI 41 41 A 8 ARG N A 8 ARG CA A 8 ARG C A 9 ASP N 1.0 72.43 164.95 PSI 42 42 A 10 GLY N A 10 GLY CA A 10 GLY C A 11 GLN N 1.0 -9.57 30.43 PSI 43 43 A 11 GLN N A 11 GLN CA A 11 GLN C A 12 ALA N 1.0 137.44 177.44 PSI 44 44 A 12 ALA N A 12 ALA CA A 12 ALA C A 13 TYR N 1.0 119.09 159.09 PSI 45 45 A 14 VAL N A 14 VAL CA A 14 VAL C A 15 ARG N 1.0 134.66 174.66 PSI 46 46 A 15 ARG N A 15 ARG CA A 15 ARG C A 16 LYS N 1.0 105.55 155.01 PSI 47 47 A 16 LYS N A 16 LYS CA A 16 LYS C A 17 ASP N 1.0 104.80 144.80 PSI 48 48 A 18 GLY N A 18 GLY CA A 18 GLY C A 19 GLU N 1.0 -27.43 39.65 PSI 49 49 A 19 GLU N A 19 GLU CA A 19 GLU C A 20 TRP N 1.0 127.77 176.09 PSI 50 50 A 20 TRP N A 20 TRP CA A 20 TRP C A 21 VAL N 1.0 108.03 148.03 PSI 51 51 A 21 VAL N A 21 VAL CA A 21 VAL C A 22 LEU N 1.0 110.75 150.75 PSI 52 52 A 22 LEU N A 22 LEU CA A 22 LEU C A 23 LEU N 1.0 107.70 159.90 PSI 53 53 A 23 LEU N A 23 LEU CA A 23 LEU C A 24 SER N 1.0 -57.89 -17.89 PSI 54 54 A 24 SER N A 24 SER CA A 24 SER C A 25 THR N 1.0 -59.13 -19.13 PSI 55 55 A 25 THR N A 25 THR CA A 25 THR C A 26 PHE N 1.0 -60.26 -20.26 PSI 56 56 A 26 PHE N A 26 PHE CA A 26 PHE C A 27 LEU N 1.0 -50.06 0.16 PSI 57 57 A 33 GLU N A 33 GLU CA A 33 GLU C A 34 GLN N 1.0 -56.77 -16.77 PSI 58 58 A 35 GLU N A 35 GLU CA A 35 GLU C A 36 LEU N 1.0 -57.75 -17.75 PSI 59 59 A 36 LEU N A 36 LEU CA A 36 LEU C A 37 LEU N 1.0 -65.68 0.94 PSI 60 60 A 37 LEU N A 37 LEU CA A 37 LEU C A 38 GLU N 1.0 -56.16 -0.30 PSI 61 61 A 39 LEU N A 39 LEU CA A 39 LEU C A 40 ASP N 1.0 -61.33 -21.33 PSI 62 62 A 40 ASP N A 40 ASP CA A 40 ASP C A 41 LYS N 1.0 -57.69 -17.69 PSI 63 63 A 41 LYS N A 41 LYS CA A 41 LYS C A 42 TRP N 1.0 -59.57 -19.57 PSI 64 64 A 42 TRP N A 42 TRP CA A 42 TRP C A 43 ALA N 1.0 -59.31 -19.31 PSI 65 65 A 43 ALA N A 43 ALA CA A 43 ALA C A 44 SER N 1.0 -66.18 3.40 PSI 66 66 A 44 SER N A 44 SER CA A 44 SER C A 45 LEU N 1.0 -60.39 -20.39 PSI 67 67 A 45 LEU N A 45 LEU CA A 45 LEU C A 46 TRP N 1.0 -58.57 -18.57 PSI 68 68 A 46 TRP N A 46 TRP CA A 46 TRP C A 47 ASN N 1.0 -55.51 -15.51 PSI 69 69 A 47 ASN N A 47 ASN CA A 47 ASN C A 48 TRP N 1.0 -65.60 -25.60 PSI 70 70 A 48 TRP N A 48 TRP CA A 48 TRP C A 49 PHE N 1.0 -53.48 -13.48 PSI 71 71 A 49 PHE N A 49 PHE CA A 49 PHE C A 50 ASN N 1.0 -59.21 5.45 PSI 72 72 A 50 ASN N A 50 ASN CA A 50 ASN C A 51 ILE N 1.0 -55.35 -15.35 PSI 73 73 A 51 ILE N A 51 ILE CA A 51 ILE C A 52 THR N 1.0 -59.41 -19.41 PSI 74 74 A 52 THR N A 52 THR CA A 52 THR C A 53 ASN N 1.0 -65.25 -25.25 PSI 75 75 A 53 ASN N A 53 ASN CA A 53 ASN C A 54 TRP N 1.0 -62.22 -22.22 PSI 76 76 A 54 TRP N A 54 TRP CA A 54 TRP C A 55 LEU N 1.0 -59.00 -19.00 PSI 77 77 A 55 LEU N A 55 LEU CA A 55 LEU C A 56 TRP N 1.0 -53.00 -13.00 PSI 78 78 A 56 TRP N A 56 TRP CA A 56 TRP C A 57 TYR N 1.0 -51.89 -11.89 PSI 79 79 A 57 TYR N A 57 TYR CA A 57 TYR C A 58 ILE N 1.0 -53.80 -13.80 PSI 80 80 A 58 ILE N A 58 ILE CA A 58 ILE C A 59 LYS N 1.0 -36.26 41.48 PSI 81 81 A 37 LEU C A 38 GLU N A 38 GLU CA A 38 GLU C 1.0 -90.00 -50.00 PHI 82 82 A 38 GLU N A 38 GLU CA A 38 GLU C A 39 LEU N 1.0 -54.00 -14.00 PSI 83 83 A 34 GLN N A 34 GLN CA A 34 GLN C A 35 GLU N 1.0 -64.00 -4.00 PSI 84 84 A 33 GLU C A 34 GLN N A 34 GLN CA A 34 GLN C 1.0 -89.00 -49.00 PHI 85 85 A 26 PHE C A 27 LEU N A 27 LEU CA A 27 LEU C 1.0 -104.00 -44.00 PHI 86 86 B 7 PRO C B 8 ARG N B 8 ARG CA B 8 ARG C 1.0 -143.12 -49.58 PHI 87 87 B 9 ASP C B 10 GLY N B 10 GLY CA B 10 GLY C 1.0 61.10 101.10 PHI 88 88 B 10 GLY C B 11 GLN N B 11 GLN CA B 11 GLN C 1.0 -144.57 -73.77 PHI 89 89 B 11 GLN C B 12 ALA N B 12 ALA CA B 12 ALA C 1.0 -145.67 -79.31 PHI 90 90 B 13 TYR C B 14 VAL N B 14 VAL CA B 14 VAL C 1.0 -163.86 -111.72 PHI 91 91 B 14 VAL C B 15 ARG N B 15 ARG CA B 15 ARG C 1.0 -137.69 -93.97 PHI 92 92 B 15 ARG C B 16 LYS N B 16 LYS CA B 16 LYS C 1.0 -160.18 -67.08 PHI 93 93 B 17 ASP C B 18 GLY N B 18 GLY CA B 18 GLY C 1.0 54.97 97.33 PHI 94 94 B 18 GLY C B 19 GLU N B 19 GLU CA B 19 GLU C 1.0 -152.25 -112.25 PHI 95 95 B 19 GLU C B 20 TRP N B 20 TRP CA B 20 TRP C 1.0 -125.26 -73.12 PHI 96 96 B 20 TRP C B 21 VAL N B 21 VAL CA B 21 VAL C 1.0 -141.81 -101.81 PHI 97 97 B 21 VAL C B 22 LEU N B 22 LEU CA B 22 LEU C 1.0 -125.41 -48.43 PHI 98 98 B 22 LEU C B 23 LEU N B 23 LEU CA B 23 LEU C 1.0 -82.69 -42.69 PHI 99 99 B 23 LEU C B 24 SER N B 24 SER CA B 24 SER C 1.0 -83.76 -43.76 PHI 100 100 B 24 SER C B 25 THR N B 25 THR CA B 25 THR C 1.0 -93.42 -53.42 PHI 101 101 B 25 THR C B 26 PHE N B 26 PHE CA B 26 PHE C 1.0 -92.83 -52.83 PHI 102 102 B 32 ASN C B 33 GLU N B 33 GLU CA B 33 GLU C 1.0 -88.77 -48.77 PHI 103 103 B 34 GLN C B 35 GLU N B 35 GLU CA B 35 GLU C 1.0 -88.80 -48.80 PHI 104 104 B 35 GLU C B 36 LEU N B 36 LEU CA B 36 LEU C 1.0 -87.68 -47.68 PHI 105 105 B 36 LEU C B 37 LEU N B 37 LEU CA B 37 LEU C 1.0 -117.62 -31.90 PHI 106 106 B 38 GLU C B 39 LEU N B 39 LEU CA B 39 LEU C 1.0 -84.85 -44.85 PHI 107 107 B 39 LEU C B 40 ASP N B 40 ASP CA B 40 ASP C 1.0 -83.76 -43.76 PHI 108 108 B 40 ASP C B 41 LYS N B 41 LYS CA B 41 LYS C 1.0 -83.02 -43.02 PHI 109 109 B 41 LYS C B 42 TRP N B 42 TRP CA B 42 TRP C 1.0 -87.52 -47.52 PHI 110 110 B 42 TRP C B 43 ALA N B 43 ALA CA B 43 ALA C 1.0 -86.68 -46.68 PHI 111 111 B 43 ALA C B 44 SER N B 44 SER CA B 44 SER C 1.0 -83.63 -43.63 PHI 112 112 B 44 SER C B 45 LEU N B 45 LEU CA B 45 LEU C 1.0 -86.33 -46.33 PHI 113 113 B 45 LEU C B 46 TRP N B 46 TRP CA B 46 TRP C 1.0 -85.44 -45.44 PHI 114 114 B 46 TRP C B 47 ASN N B 47 ASN CA B 47 ASN C 1.0 -82.42 -42.42 PHI 115 115 B 47 ASN C B 48 TRP N B 48 TRP CA B 48 TRP C 1.0 -87.02 -47.02 PHI 116 116 B 48 TRP C B 49 PHE N B 49 PHE CA B 49 PHE C 1.0 -127.35 -45.57 PHI 117 117 B 49 PHE C B 50 ASN N B 50 ASN CA B 50 ASN C 1.0 -88.18 -48.18 PHI 118 118 B 50 ASN C B 51 ILE N B 51 ILE CA B 51 ILE C 1.0 -94.70 -37.58 PHI 119 119 B 51 ILE C B 52 THR N B 52 THR CA B 52 THR C 1.0 -82.80 -42.80 PHI 120 120 B 52 THR C B 53 ASN N B 53 ASN CA B 53 ASN C 1.0 -80.53 -40.53 PHI 121 121 B 53 ASN C B 54 TRP N B 54 TRP CA B 54 TRP C 1.0 -82.00 -42.00 PHI 122 122 B 54 TRP C B 55 LEU N B 55 LEU CA B 55 LEU C 1.0 -87.00 -47.00 PHI 123 123 B 55 LEU C B 56 TRP N B 56 TRP CA B 56 TRP C 1.0 -87.04 -47.04 PHI 124 124 B 56 TRP C B 57 TYR N B 57 TYR CA B 57 TYR C 1.0 -90.97 -50.97 PHI 125 125 B 57 TYR C B 58 ILE N B 58 ILE CA B 58 ILE C 1.0 -122.12 -73.20 PHI 126 126 B 8 ARG N B 8 ARG CA B 8 ARG C B 9 ASP N 1.0 72.43 164.95 PSI 127 127 B 10 GLY N B 10 GLY CA B 10 GLY C B 11 GLN N 1.0 -9.57 30.43 PSI 128 128 B 11 GLN N B 11 GLN CA B 11 GLN C B 12 ALA N 1.0 137.44 177.44 PSI 129 129 B 12 ALA N B 12 ALA CA B 12 ALA C B 13 TYR N 1.0 119.09 159.09 PSI 130 130 B 14 VAL N B 14 VAL CA B 14 VAL C B 15 ARG N 1.0 134.66 174.66 PSI 131 131 B 15 ARG N B 15 ARG CA B 15 ARG C B 16 LYS N 1.0 105.55 155.01 PSI 132 132 B 16 LYS N B 16 LYS CA B 16 LYS C B 17 ASP N 1.0 104.80 144.80 PSI 133 133 B 18 GLY N B 18 GLY CA B 18 GLY C B 19 GLU N 1.0 -27.43 39.65 PSI 134 134 B 19 GLU N B 19 GLU CA B 19 GLU C B 20 TRP N 1.0 127.77 176.09 PSI 135 135 B 20 TRP N B 20 TRP CA B 20 TRP C B 21 VAL N 1.0 108.03 148.03 PSI 136 136 B 21 VAL N B 21 VAL CA B 21 VAL C B 22 LEU N 1.0 110.75 150.75 PSI 137 137 B 22 LEU N B 22 LEU CA B 22 LEU C B 23 LEU N 1.0 107.70 159.90 PSI 138 138 B 23 LEU N B 23 LEU CA B 23 LEU C B 24 SER N 1.0 -57.89 -17.89 PSI 139 139 B 24 SER N B 24 SER CA B 24 SER C B 25 THR N 1.0 -59.13 -19.13 PSI 140 140 B 25 THR N B 25 THR CA B 25 THR C B 26 PHE N 1.0 -60.26 -20.26 PSI 141 141 B 26 PHE N B 26 PHE CA B 26 PHE C B 27 LEU N 1.0 -50.06 0.16 PSI 142 142 B 33 GLU N B 33 GLU CA B 33 GLU C B 34 GLN N 1.0 -56.77 -16.77 PSI 143 143 B 35 GLU N B 35 GLU CA B 35 GLU C B 36 LEU N 1.0 -57.75 -17.75 PSI 144 144 B 36 LEU N B 36 LEU CA B 36 LEU C B 37 LEU N 1.0 -65.68 0.94 PSI 145 145 B 37 LEU N B 37 LEU CA B 37 LEU C B 38 GLU N 1.0 -56.16 -0.30 PSI 146 146 B 39 LEU N B 39 LEU CA B 39 LEU C B 40 ASP N 1.0 -61.33 -21.33 PSI 147 147 B 40 ASP N B 40 ASP CA B 40 ASP C B 41 LYS N 1.0 -57.69 -17.69 PSI 148 148 B 41 LYS N B 41 LYS CA B 41 LYS C B 42 TRP N 1.0 -59.57 -19.57 PSI 149 149 B 42 TRP N B 42 TRP CA B 42 TRP C B 43 ALA N 1.0 -59.31 -19.31 PSI 150 150 B 43 ALA N B 43 ALA CA B 43 ALA C B 44 SER N 1.0 -66.18 3.40 PSI 151 151 B 44 SER N B 44 SER CA B 44 SER C B 45 LEU N 1.0 -60.39 -20.39 PSI 152 152 B 45 LEU N B 45 LEU CA B 45 LEU C B 46 TRP N 1.0 -58.57 -18.57 PSI 153 153 B 46 TRP N B 46 TRP CA B 46 TRP C B 47 ASN N 1.0 -55.51 -15.51 PSI 154 154 B 47 ASN N B 47 ASN CA B 47 ASN C B 48 TRP N 1.0 -65.60 -25.60 PSI 155 155 B 48 TRP N B 48 TRP CA B 48 TRP C B 49 PHE N 1.0 -53.48 -13.48 PSI 156 156 B 49 PHE N B 49 PHE CA B 49 PHE C B 50 ASN N 1.0 -59.21 5.45 PSI 157 157 B 50 ASN N B 50 ASN CA B 50 ASN C B 51 ILE N 1.0 -55.35 -15.35 PSI 158 158 B 51 ILE N B 51 ILE CA B 51 ILE C B 52 THR N 1.0 -59.41 -19.41 PSI 159 159 B 52 THR N B 52 THR CA B 52 THR C B 53 ASN N 1.0 -65.25 -25.25 PSI 160 160 B 53 ASN N B 53 ASN CA B 53 ASN C B 54 TRP N 1.0 -62.22 -22.22 PSI 161 161 B 54 TRP N B 54 TRP CA B 54 TRP C B 55 LEU N 1.0 -59.00 -19.00 PSI 162 162 B 55 LEU N B 55 LEU CA B 55 LEU C B 56 TRP N 1.0 -53.00 -13.00 PSI 163 163 B 56 TRP N B 56 TRP CA B 56 TRP C B 57 TYR N 1.0 -51.89 -11.89 PSI 164 164 B 57 TYR N B 57 TYR CA B 57 TYR C B 58 ILE N 1.0 -53.80 -13.80 PSI 165 165 B 58 ILE N B 58 ILE CA B 58 ILE C B 59 LYS N 1.0 -36.26 41.48 PSI 166 166 B 37 LEU C B 38 GLU N B 38 GLU CA B 38 GLU C 1.0 -90.00 -50.00 PHI 167 167 B 38 GLU N B 38 GLU CA B 38 GLU C B 39 LEU N 1.0 -54.00 -14.00 PSI 168 168 B 34 GLN N B 34 GLN CA B 34 GLN C B 35 GLU N 1.0 -64.00 -4.00 PSI 169 169 B 33 GLU C B 34 GLN N B 34 GLN CA B 34 GLN C 1.0 -89.00 -49.00 PHI 170 170 B 26 PHE C B 27 LEU N B 27 LEU CA B 27 LEU C 1.0 -104.00 -44.00 PHI 171 171 C 7 PRO C C 8 ARG N C 8 ARG CA C 8 ARG C 1.0 -143.12 -49.58 PHI 172 172 C 9 ASP C C 10 GLY N C 10 GLY CA C 10 GLY C 1.0 61.10 101.10 PHI 173 173 C 10 GLY C C 11 GLN N C 11 GLN CA C 11 GLN C 1.0 -144.57 -73.77 PHI 174 174 C 11 GLN C C 12 ALA N C 12 ALA CA C 12 ALA C 1.0 -145.67 -79.31 PHI 175 175 C 13 TYR C C 14 VAL N C 14 VAL CA C 14 VAL C 1.0 -163.86 -111.72 PHI 176 176 C 14 VAL C C 15 ARG N C 15 ARG CA C 15 ARG C 1.0 -137.69 -93.97 PHI 177 177 C 15 ARG C C 16 LYS N C 16 LYS CA C 16 LYS C 1.0 -160.18 -67.08 PHI 178 178 C 17 ASP C C 18 GLY N C 18 GLY CA C 18 GLY C 1.0 54.97 97.33 PHI 179 179 C 18 GLY C C 19 GLU N C 19 GLU CA C 19 GLU C 1.0 -152.25 -112.25 PHI 180 180 C 19 GLU C C 20 TRP N C 20 TRP CA C 20 TRP C 1.0 -125.26 -73.12 PHI 181 181 C 20 TRP C C 21 VAL N C 21 VAL CA C 21 VAL C 1.0 -141.81 -101.81 PHI 182 182 C 21 VAL C C 22 LEU N C 22 LEU CA C 22 LEU C 1.0 -125.41 -48.43 PHI 183 183 C 22 LEU C C 23 LEU N C 23 LEU CA C 23 LEU C 1.0 -82.69 -42.69 PHI 184 184 C 23 LEU C C 24 SER N C 24 SER CA C 24 SER C 1.0 -83.76 -43.76 PHI 185 185 C 24 SER C C 25 THR N C 25 THR CA C 25 THR C 1.0 -93.42 -53.42 PHI 186 186 C 25 THR C C 26 PHE N C 26 PHE CA C 26 PHE C 1.0 -92.83 -52.83 PHI 187 187 C 32 ASN C C 33 GLU N C 33 GLU CA C 33 GLU C 1.0 -88.77 -48.77 PHI 188 188 C 34 GLN C C 35 GLU N C 35 GLU CA C 35 GLU C 1.0 -88.80 -48.80 PHI 189 189 C 35 GLU C C 36 LEU N C 36 LEU CA C 36 LEU C 1.0 -87.68 -47.68 PHI 190 190 C 36 LEU C C 37 LEU N C 37 LEU CA C 37 LEU C 1.0 -117.62 -31.90 PHI 191 191 C 38 GLU C C 39 LEU N C 39 LEU CA C 39 LEU C 1.0 -84.85 -44.85 PHI 192 192 C 39 LEU C C 40 ASP N C 40 ASP CA C 40 ASP C 1.0 -83.76 -43.76 PHI 193 193 C 40 ASP C C 41 LYS N C 41 LYS CA C 41 LYS C 1.0 -83.02 -43.02 PHI 194 194 C 41 LYS C C 42 TRP N C 42 TRP CA C 42 TRP C 1.0 -87.52 -47.52 PHI 195 195 C 42 TRP C C 43 ALA N C 43 ALA CA C 43 ALA C 1.0 -86.68 -46.68 PHI 196 196 C 43 ALA C C 44 SER N C 44 SER CA C 44 SER C 1.0 -83.63 -43.63 PHI 197 197 C 44 SER C C 45 LEU N C 45 LEU CA C 45 LEU C 1.0 -86.33 -46.33 PHI 198 198 C 45 LEU C C 46 TRP N C 46 TRP CA C 46 TRP C 1.0 -85.44 -45.44 PHI 199 199 C 46 TRP C C 47 ASN N C 47 ASN CA C 47 ASN C 1.0 -82.42 -42.42 PHI 200 200 C 47 ASN C C 48 TRP N C 48 TRP CA C 48 TRP C 1.0 -87.02 -47.02 PHI 201 201 C 48 TRP C C 49 PHE N C 49 PHE CA C 49 PHE C 1.0 -127.35 -45.57 PHI 202 202 C 49 PHE C C 50 ASN N C 50 ASN CA C 50 ASN C 1.0 -88.18 -48.18 PHI 203 203 C 50 ASN C C 51 ILE N C 51 ILE CA C 51 ILE C 1.0 -94.70 -37.58 PHI 204 204 C 51 ILE C C 52 THR N C 52 THR CA C 52 THR C 1.0 -82.80 -42.80 PHI 205 205 C 52 THR C C 53 ASN N C 53 ASN CA C 53 ASN C 1.0 -80.53 -40.53 PHI 206 206 C 53 ASN C C 54 TRP N C 54 TRP CA C 54 TRP C 1.0 -82.00 -42.00 PHI 207 207 C 54 TRP C C 55 LEU N C 55 LEU CA C 55 LEU C 1.0 -87.00 -47.00 PHI 208 208 C 55 LEU C C 56 TRP N C 56 TRP CA C 56 TRP C 1.0 -87.04 -47.04 PHI 209 209 C 56 TRP C C 57 TYR N C 57 TYR CA C 57 TYR C 1.0 -90.97 -50.97 PHI 210 210 C 57 TYR C C 58 ILE N C 58 ILE CA C 58 ILE C 1.0 -122.12 -73.20 PHI 211 211 C 8 ARG N C 8 ARG CA C 8 ARG C C 9 ASP N 1.0 72.43 164.95 PSI 212 212 C 10 GLY N C 10 GLY CA C 10 GLY C C 11 GLN N 1.0 -9.57 30.43 PSI 213 213 C 11 GLN N C 11 GLN CA C 11 GLN C C 12 ALA N 1.0 137.44 177.44 PSI 214 214 C 12 ALA N C 12 ALA CA C 12 ALA C C 13 TYR N 1.0 119.09 159.09 PSI 215 215 C 14 VAL N C 14 VAL CA C 14 VAL C C 15 ARG N 1.0 134.66 174.66 PSI 216 216 C 15 ARG N C 15 ARG CA C 15 ARG C C 16 LYS N 1.0 105.55 155.01 PSI 217 217 C 16 LYS N C 16 LYS CA C 16 LYS C C 17 ASP N 1.0 104.80 144.80 PSI 218 218 C 18 GLY N C 18 GLY CA C 18 GLY C C 19 GLU N 1.0 -27.43 39.65 PSI 219 219 C 19 GLU N C 19 GLU CA C 19 GLU C C 20 TRP N 1.0 127.77 176.09 PSI 220 220 C 20 TRP N C 20 TRP CA C 20 TRP C C 21 VAL N 1.0 108.03 148.03 PSI 221 221 C 21 VAL N C 21 VAL CA C 21 VAL C C 22 LEU N 1.0 110.75 150.75 PSI 222 222 C 22 LEU N C 22 LEU CA C 22 LEU C C 23 LEU N 1.0 107.70 159.90 PSI 223 223 C 23 LEU N C 23 LEU CA C 23 LEU C C 24 SER N 1.0 -57.89 -17.89 PSI 224 224 C 24 SER N C 24 SER CA C 24 SER C C 25 THR N 1.0 -59.13 -19.13 PSI 225 225 C 25 THR N C 25 THR CA C 25 THR C C 26 PHE N 1.0 -60.26 -20.26 PSI 226 226 C 26 PHE N C 26 PHE CA C 26 PHE C C 27 LEU N 1.0 -50.06 0.16 PSI 227 227 C 33 GLU N C 33 GLU CA C 33 GLU C C 34 GLN N 1.0 -56.77 -16.77 PSI 228 228 C 35 GLU N C 35 GLU CA C 35 GLU C C 36 LEU N 1.0 -57.75 -17.75 PSI 229 229 C 36 LEU N C 36 LEU CA C 36 LEU C C 37 LEU N 1.0 -65.68 0.94 PSI 230 230 C 37 LEU N C 37 LEU CA C 37 LEU C C 38 GLU N 1.0 -56.16 -0.30 PSI 231 231 C 39 LEU N C 39 LEU CA C 39 LEU C C 40 ASP N 1.0 -61.33 -21.33 PSI 232 232 C 40 ASP N C 40 ASP CA C 40 ASP C C 41 LYS N 1.0 -57.69 -17.69 PSI 233 233 C 41 LYS N C 41 LYS CA C 41 LYS C C 42 TRP N 1.0 -59.57 -19.57 PSI 234 234 C 42 TRP N C 42 TRP CA C 42 TRP C C 43 ALA N 1.0 -59.31 -19.31 PSI 235 235 C 43 ALA N C 43 ALA CA C 43 ALA C C 44 SER N 1.0 -66.18 3.40 PSI 236 236 C 44 SER N C 44 SER CA C 44 SER C C 45 LEU N 1.0 -60.39 -20.39 PSI 237 237 C 45 LEU N C 45 LEU CA C 45 LEU C C 46 TRP N 1.0 -58.57 -18.57 PSI 238 238 C 46 TRP N C 46 TRP CA C 46 TRP C C 47 ASN N 1.0 -55.51 -15.51 PSI 239 239 C 47 ASN N C 47 ASN CA C 47 ASN C C 48 TRP N 1.0 -65.60 -25.60 PSI 240 240 C 48 TRP N C 48 TRP CA C 48 TRP C C 49 PHE N 1.0 -53.48 -13.48 PSI 241 241 C 49 PHE N C 49 PHE CA C 49 PHE C C 50 ASN N 1.0 -59.21 5.45 PSI 242 242 C 50 ASN N C 50 ASN CA C 50 ASN C C 51 ILE N 1.0 -55.35 -15.35 PSI 243 243 C 51 ILE N C 51 ILE CA C 51 ILE C C 52 THR N 1.0 -59.41 -19.41 PSI 244 244 C 52 THR N C 52 THR CA C 52 THR C C 53 ASN N 1.0 -65.25 -25.25 PSI 245 245 C 53 ASN N C 53 ASN CA C 53 ASN C C 54 TRP N 1.0 -62.22 -22.22 PSI 246 246 C 54 TRP N C 54 TRP CA C 54 TRP C C 55 LEU N 1.0 -59.00 -19.00 PSI 247 247 C 55 LEU N C 55 LEU CA C 55 LEU C C 56 TRP N 1.0 -53.00 -13.00 PSI 248 248 C 56 TRP N C 56 TRP CA C 56 TRP C C 57 TYR N 1.0 -51.89 -11.89 PSI 249 249 C 57 TYR N C 57 TYR CA C 57 TYR C C 58 ILE N 1.0 -53.80 -13.80 PSI 250 250 C 58 ILE N C 58 ILE CA C 58 ILE C C 59 LYS N 1.0 -36.26 41.48 PSI 251 251 C 37 LEU C C 38 GLU N C 38 GLU CA C 38 GLU C 1.0 -90.00 -50.00 PHI 252 252 C 38 GLU N C 38 GLU CA C 38 GLU C C 39 LEU N 1.0 -54.00 -14.00 PSI 253 253 C 34 GLN N C 34 GLN CA C 34 GLN C C 35 GLU N 1.0 -64.00 -4.00 PSI 254 254 C 33 GLU C C 34 GLN N C 34 GLN CA C 34 GLN C 1.0 -89.00 -49.00 PHI 255 255 C 26 PHE C C 27 LEU N C 27 LEU CA C 27 LEU C 1.0 -104.00 -44.00 PHI stop_ save_ save_CNS/XPLOR_dipolar_coupling_3 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode CNS/XPLOR_dipolar_coupling_3 _nef_rdc_restraint_list.potential_type parabolic _nef_rdc_restraint_list.restraint_origin . loop_ _nef_rdc_restraint.index _nef_rdc_restraint.restraint_id _nef_rdc_restraint.chain_code_1 _nef_rdc_restraint.sequence_code_1 _nef_rdc_restraint.residue_name_1 _nef_rdc_restraint.atom_name_1 _nef_rdc_restraint.chain_code_2 _nef_rdc_restraint.sequence_code_2 _nef_rdc_restraint.residue_name_2 _nef_rdc_restraint.atom_name_2 _nef_rdc_restraint.weight _nef_rdc_restraint.lower_limit _nef_rdc_restraint.upper_limit _nef_rdc_restraint.scale 1 1 A 3 ILE H A 3 ILE N 1.0 . . . 2 2 A 5 GLU H A 5 GLU N 1.0 . . . 3 3 A 6 ALA H A 6 ALA N 1.0 . . . 4 4 A 8 ARG H A 8 ARG N 1.0 . . . 5 5 A 9 ASP H A 9 ASP N 1.0 . . . 6 6 A 10 GLY H A 10 GLY N 1.0 . . . 7 7 A 11 GLN H A 11 GLN N 1.0 . . . 8 8 A 12 ALA H A 12 ALA N 1.0 . . . 9 9 A 13 TYR H A 13 TYR N 1.0 . . . 10 10 A 14 VAL H A 14 VAL N 1.0 . . . 11 11 A 15 ARG H A 15 ARG N 1.0 . . . 12 12 A 16 LYS H A 16 LYS N 1.0 . . . 13 13 A 17 ASP H A 17 ASP N 1.0 . . . 14 14 A 18 GLY H A 18 GLY N 1.0 . . . 15 15 A 19 GLU H A 19 GLU N 1.0 . . . 16 16 A 20 TRP H A 20 TRP N 1.0 . . . 17 17 A 21 VAL H A 21 VAL N 1.0 . . . 18 18 A 22 LEU H A 22 LEU N 1.0 . . . 19 19 A 23 LEU H A 23 LEU N 1.0 . . . 20 20 A 24 SER H A 24 SER N 1.0 . . . 21 21 A 25 THR H A 25 THR N 1.0 . . . 22 22 A 26 PHE H A 26 PHE N 1.0 . . . 23 23 A 27 LEU H A 27 LEU N 1.0 . . . 24 24 A 32 ASN H A 32 ASN N 1.0 . . . 25 25 A 33 GLU H A 33 GLU N 1.0 . . . 26 26 A 34 GLN H A 34 GLN N 1.0 . . . 27 27 A 35 GLU H A 35 GLU N 1.0 . . . 28 28 A 36 LEU H A 36 LEU N 1.0 . . . 29 29 A 38 GLU H A 38 GLU N 1.0 . . . 30 30 A 39 LEU H A 39 LEU N 1.0 . . . 31 31 A 40 ASP H A 40 ASP N 1.0 . . . 32 32 A 42 TRP H A 42 TRP N 1.0 . . . 33 33 A 43 ALA H A 43 ALA N 1.0 . . . 34 34 A 44 SER H A 44 SER N 1.0 . . . 35 35 A 45 LEU H A 45 LEU N 1.0 . . . 36 36 A 46 TRP H A 46 TRP N 1.0 . . . 37 37 A 47 ASN H A 47 ASN N 1.0 . . . 38 38 A 49 PHE H A 49 PHE N 1.0 . . . 39 39 A 50 ASN H A 50 ASN N 1.0 . . . 40 40 A 51 ILE H A 51 ILE N 1.0 . . . 41 41 A 52 THR H A 52 THR N 1.0 . . . 42 42 A 53 ASN H A 53 ASN N 1.0 . . . 43 43 A 54 TRP H A 54 TRP N 1.0 . . . 44 44 A 55 LEU H A 55 LEU N 1.0 . . . 45 45 A 56 TRP H A 56 TRP N 1.0 . . . 46 46 A 57 TYR H A 57 TYR N 1.0 . . . 47 47 A 58 ILE H A 58 ILE N 1.0 . . . 48 48 A 59 LYS H A 59 LYS N 1.0 . . . 49 49 B 3 ILE H B 3 ILE N 1.0 . . . 50 50 B 5 GLU H B 5 GLU N 1.0 . . . 51 51 B 6 ALA H B 6 ALA N 1.0 . . . 52 52 B 8 ARG H B 8 ARG N 1.0 . . . 53 53 B 9 ASP H B 9 ASP N 1.0 . . . 54 54 B 10 GLY H B 10 GLY N 1.0 . . . 55 55 B 11 GLN H B 11 GLN N 1.0 . . . 56 56 B 12 ALA H B 12 ALA N 1.0 . . . 57 57 B 13 TYR H B 13 TYR N 1.0 . . . 58 58 B 14 VAL H B 14 VAL N 1.0 . . . 59 59 B 15 ARG H B 15 ARG N 1.0 . . . 60 60 B 16 LYS H B 16 LYS N 1.0 . . . 61 61 B 17 ASP H B 17 ASP N 1.0 . . . 62 62 B 18 GLY H B 18 GLY N 1.0 . . . 63 63 B 19 GLU H B 19 GLU N 1.0 . . . 64 64 B 20 TRP H B 20 TRP N 1.0 . . . 65 65 B 21 VAL H B 21 VAL N 1.0 . . . 66 66 B 22 LEU H B 22 LEU N 1.0 . . . 67 67 B 23 LEU H B 23 LEU N 1.0 . . . 68 68 B 24 SER H B 24 SER N 1.0 . . . 69 69 B 25 THR H B 25 THR N 1.0 . . . 70 70 B 26 PHE H B 26 PHE N 1.0 . . . 71 71 B 27 LEU H B 27 LEU N 1.0 . . . 72 72 B 32 ASN H B 32 ASN N 1.0 . . . 73 73 B 33 GLU H B 33 GLU N 1.0 . . . 74 74 B 34 GLN H B 34 GLN N 1.0 . . . 75 75 B 35 GLU H B 35 GLU N 1.0 . . . 76 76 B 36 LEU H B 36 LEU N 1.0 . . . 77 77 B 38 GLU H B 38 GLU N 1.0 . . . 78 78 B 39 LEU H B 39 LEU N 1.0 . . . 79 79 B 40 ASP H B 40 ASP N 1.0 . . . 80 80 B 42 TRP H B 42 TRP N 1.0 . . . 81 81 B 43 ALA H B 43 ALA N 1.0 . . . 82 82 B 44 SER H B 44 SER N 1.0 . . . 83 83 B 45 LEU H B 45 LEU N 1.0 . . . 84 84 B 46 TRP H B 46 TRP N 1.0 . . . 85 85 B 47 ASN H B 47 ASN N 1.0 . . . 86 86 B 49 PHE H B 49 PHE N 1.0 . . . 87 87 B 50 ASN H B 50 ASN N 1.0 . . . 88 88 B 51 ILE H B 51 ILE N 1.0 . . . 89 89 B 52 THR H B 52 THR N 1.0 . . . 90 90 B 53 ASN H B 53 ASN N 1.0 . . . 91 91 B 54 TRP H B 54 TRP N 1.0 . . . 92 92 B 55 LEU H B 55 LEU N 1.0 . . . 93 93 B 56 TRP H B 56 TRP N 1.0 . . . 94 94 B 57 TYR H B 57 TYR N 1.0 . . . 95 95 B 58 ILE H B 58 ILE N 1.0 . . . 96 96 B 59 LYS H B 59 LYS N 1.0 . . . 97 97 C 3 ILE H C 3 ILE N 1.0 . . . 98 98 C 5 GLU H C 5 GLU N 1.0 . . . 99 99 C 6 ALA H C 6 ALA N 1.0 . . . 100 100 C 8 ARG H C 8 ARG N 1.0 . . . 101 101 C 9 ASP H C 9 ASP N 1.0 . . . 102 102 C 10 GLY H C 10 GLY N 1.0 . . . 103 103 C 11 GLN H C 11 GLN N 1.0 . . . 104 104 C 12 ALA H C 12 ALA N 1.0 . . . 105 105 C 13 TYR H C 13 TYR N 1.0 . . . 106 106 C 14 VAL H C 14 VAL N 1.0 . . . 107 107 C 15 ARG H C 15 ARG N 1.0 . . . 108 108 C 16 LYS H C 16 LYS N 1.0 . . . 109 109 C 17 ASP H C 17 ASP N 1.0 . . . 110 110 C 18 GLY H C 18 GLY N 1.0 . . . 111 111 C 19 GLU H C 19 GLU N 1.0 . . . 112 112 C 20 TRP H C 20 TRP N 1.0 . . . 113 113 C 21 VAL H C 21 VAL N 1.0 . . . 114 114 C 22 LEU H C 22 LEU N 1.0 . . . 115 115 C 23 LEU H C 23 LEU N 1.0 . . . 116 116 C 24 SER H C 24 SER N 1.0 . . . 117 117 C 25 THR H C 25 THR N 1.0 . . . 118 118 C 26 PHE H C 26 PHE N 1.0 . . . 119 119 C 27 LEU H C 27 LEU N 1.0 . . . 120 120 C 32 ASN H C 32 ASN N 1.0 . . . 121 121 C 33 GLU H C 33 GLU N 1.0 . . . 122 122 C 34 GLN H C 34 GLN N 1.0 . . . 123 123 C 35 GLU H C 35 GLU N 1.0 . . . 124 124 C 36 LEU H C 36 LEU N 1.0 . . . 125 125 C 38 GLU H C 38 GLU N 1.0 . . . 126 126 C 39 LEU H C 39 LEU N 1.0 . . . 127 127 C 40 ASP H C 40 ASP N 1.0 . . . 128 128 C 42 TRP H C 42 TRP N 1.0 . . . 129 129 C 43 ALA H C 43 ALA N 1.0 . . . 130 130 C 44 SER H C 44 SER N 1.0 . . . 131 131 C 45 LEU H C 45 LEU N 1.0 . . . 132 132 C 46 TRP H C 46 TRP N 1.0 . . . 133 133 C 47 ASN H C 47 ASN N 1.0 . . . 134 134 C 49 PHE H C 49 PHE N 1.0 . . . 135 135 C 50 ASN H C 50 ASN N 1.0 . . . 136 136 C 51 ILE H C 51 ILE N 1.0 . . . 137 137 C 52 THR H C 52 THR N 1.0 . . . 138 138 C 53 ASN H C 53 ASN N 1.0 . . . 139 139 C 54 TRP H C 54 TRP N 1.0 . . . 140 140 C 55 LEU H C 55 LEU N 1.0 . . . 141 141 C 56 TRP H C 56 TRP N 1.0 . . . 142 142 C 57 TYR H C 57 TYR N 1.0 . . . 143 143 C 58 ILE H C 58 ILE N 1.0 . . . 144 144 C 59 LYS H C 59 LYS N 1.0 . . . stop_ save_