data_nef_c30205_5u3h 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 5U3H 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 THR middle . . 3 A 3 ILE middle . . 4 A 4 ASP middle . . 5 A 5 TYR middle . . 6 A 6 GLN middle . . 7 A 7 ALA middle . . 8 A 8 LEU middle . . 9 A 9 LYS middle . . 10 A 10 ARG middle . . 11 A 11 ARG middle . . 12 A 12 HIS middle . . 13 A 13 THR middle . . 14 A 14 PRO middle . false 15 A 15 GLU middle . . 16 A 16 ALA middle . . 17 A 17 GLU middle . . 18 A 18 ASN middle . . 19 A 19 PRO middle . false 20 A 20 ALA middle . . 21 A 21 GLU middle . . 22 A 22 ALA middle . . 23 A 23 ASP middle . . 24 A 24 LEU middle . . 25 A 25 PRO middle . false 26 A 26 GLN middle . . 27 A 27 GLY middle . false 28 A 28 ASP middle . . 29 A 29 ILE middle . . 30 A 30 GLU middle . . 31 A 31 LYS middle . . 32 A 32 GLN middle . . 33 A 33 VAL middle . . 34 A 34 ALA middle . . 35 A 35 ALA middle . . 36 A 36 LEU middle . . 37 A 37 TRP middle . . 38 A 38 GLN middle . . 39 A 39 GLN middle . . 40 A 40 LEU middle . . 41 A 41 LEU middle . . 42 A 42 SER middle . . 43 A 43 THR middle . . 44 A 44 GLY middle . false 45 A 45 ASN middle . . 46 A 46 VAL middle . . 47 A 47 THR middle . . 48 A 48 ARG middle . . 49 A 49 GLU middle . . 50 A 50 THR middle . . 51 A 51 ASP middle . . 52 A 52 PHE middle . . 53 A 53 PHE middle . . 54 A 54 GLN middle . . 55 A 55 GLN middle . . 56 A 56 GLY middle . false 57 A 57 GLY middle . false 58 A 58 ASP middle . . 59 A 59 SER middle . . 60 A 60 LEU middle . . 61 A 61 LEU middle . . 62 A 62 ALA middle . . 63 A 63 THR middle . . 64 A 64 ARG middle . . 65 A 65 LEU middle . . 66 A 66 THR middle . . 67 A 67 GLY middle . false 68 A 68 GLN middle . . 69 A 69 LEU middle . . 70 A 70 HIS middle . . 71 A 71 GLN middle . . 72 A 72 ALA middle . . 73 A 73 GLY middle . false 74 A 74 TYR middle . . 75 A 75 GLU middle . . 76 A 76 ALA middle . . 77 A 77 GLN middle . . 78 A 78 LEU middle . . 79 A 79 SER middle . . 80 A 80 ASP middle . . 81 A 81 LEU middle . . 82 A 82 PHE middle . . 83 A 83 ASN middle . . 84 A 84 HIS middle . . 85 A 85 PRO middle . false 86 A 86 ARG middle . . 87 A 87 LEU middle . . 88 A 88 ALA middle . . 89 A 89 ASP middle . . 90 A 90 PHE middle . . 91 A 91 ALA middle . . 92 A 92 ALA middle . . 93 A 93 THR middle . . 94 A 94 LEU middle . . 95 A 95 ARG middle . . 96 A 96 LYS middle . . 97 A 97 THR middle . . 98 A 98 ASP middle . . 99 A 99 VAL middle . . 100 A 100 PRO middle . false 101 A 101 VAL middle . . 102 A 102 GLU middle . . 103 A 103 GLN middle . . 104 A 104 PRO middle . false 105 A 105 PHE middle . . 106 A 106 VAL middle . . 107 A 107 HIS middle . . 108 A 108 SER middle . . 109 A 109 PRO middle . false 110 A 110 GLU middle . . 111 A 111 ASP end . . stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 GLY HA2 H 1 3.921 0.020 A 1 GLY HA3 H 1 3.921 0.020 A 1 GLY CA C 13 43.216 0.3 A 2 THR HA H 1 4.364 0.020 A 2 THR HB H 1 4.162 0.020 A 2 THR HG2% H 1 1.206 0.020 A 2 THR CA C 13 62.043 0.3 A 2 THR CB C 13 69.806 0.3 A 2 THR CG2 C 13 21.600 0.3 A 3 ILE H H 1 8.255 0.020 A 3 ILE HA H 1 4.050 0.020 A 3 ILE HB H 1 1.678 0.020 A 3 ILE HD1% H 1 0.817 0.020 A 3 ILE HG1x H 1 1.073 0.020 A 3 ILE HG1y H 1 1.405 0.020 A 3 ILE HG2% H 1 0.606 0.020 A 3 ILE C C 13 175.304 0.3 A 3 ILE CA C 13 60.969 0.3 A 3 ILE CB C 13 38.961 0.3 A 3 ILE CD1 C 13 12.891 0.3 A 3 ILE CG1 C 13 27.367 0.3 A 3 ILE CG2 C 13 17.205 0.3 A 3 ILE N N 15 123.551 0.3 A 4 ASP H H 1 8.283 0.020 A 4 ASP HA H 1 4.637 0.020 A 4 ASP HBx H 1 2.551 0.020 A 4 ASP HBy H 1 2.742 0.020 A 4 ASP C C 13 176.356 0.3 A 4 ASP CA C 13 53.405 0.3 A 4 ASP CB C 13 40.877 0.3 A 4 ASP N N 15 124.793 0.3 A 5 TYR H H 1 8.210 0.020 A 5 TYR HA H 1 4.315 0.020 A 5 TYR HBx H 1 2.975 0.020 A 5 TYR HBy H 1 3.077 0.020 A 5 TYR HD1 H 1 7.139 0.020 A 5 TYR HD2 H 1 7.139 0.020 A 5 TYR HE1 H 1 6.823 0.020 A 5 TYR HE2 H 1 6.823 0.020 A 5 TYR C C 13 176.951 0.3 A 5 TYR CA C 13 59.900 0.3 A 5 TYR CB C 13 38.363 0.3 A 5 TYR CD1 C 13 133.220 0.3 A 5 TYR CE1 C 13 118.264 0.3 A 5 TYR N N 15 122.633 0.3 A 6 GLN H H 1 8.273 0.020 A 6 GLN HA H 1 4.149 0.020 A 6 GLN HB2 H 1 2.076 0.020 A 6 GLN HB3 H 1 2.076 0.020 A 6 GLN HG2 H 1 2.342 0.020 A 6 GLN HG3 H 1 2.342 0.020 A 6 GLN C C 13 176.676 0.3 A 6 GLN CA C 13 57.021 0.3 A 6 GLN CB C 13 28.725 0.3 A 6 GLN CG C 13 33.921 0.3 A 6 GLN N N 15 120.186 0.3 A 7 ALA H H 1 7.873 0.020 A 7 ALA HA H 1 4.161 0.020 A 7 ALA HB% H 1 1.396 0.020 A 7 ALA C C 13 178.609 0.3 A 7 ALA CA C 13 53.300 0.3 A 7 ALA CB C 13 18.798 0.3 A 7 ALA N N 15 123.259 0.3 A 8 LEU H H 1 7.838 0.020 A 8 LEU HA H 1 4.205 0.020 A 8 LEU HBx H 1 1.595 0.020 A 8 LEU HBy H 1 1.670 0.020 A 8 LEU HDx% H 1 0.857 0.020 A 8 LEU HDy% H 1 0.890 0.020 A 8 LEU HG H 1 1.645 0.020 A 8 LEU C C 13 177.889 0.3 A 8 LEU CA C 13 55.915 0.3 A 8 LEU CB C 13 42.194 0.3 A 8 LEU CD1 C 13 23.467 0.3 A 8 LEU CD2 C 13 24.877 0.3 A 8 LEU CG C 13 26.843 0.3 A 8 LEU N N 15 119.415 0.3 A 9 LYS H H 1 7.977 0.020 A 9 LYS HA H 1 4.232 0.020 A 9 LYS HBx H 1 1.780 0.020 A 9 LYS HBy H 1 1.841 0.020 A 9 LYS HD2 H 1 1.676 0.020 A 9 LYS HD3 H 1 1.676 0.020 A 9 LYS HE2 H 1 2.985 0.020 A 9 LYS HE3 H 1 2.985 0.020 A 9 LYS HGx H 1 1.405 0.020 A 9 LYS HGy H 1 1.474 0.020 A 9 LYS C C 13 176.814 0.3 A 9 LYS CA C 13 56.692 0.3 A 9 LYS CB C 13 32.676 0.3 A 9 LYS CD C 13 29.071 0.3 A 9 LYS CE C 13 42.039 0.3 A 9 LYS CG C 13 24.888 0.3 A 9 LYS N N 15 120.546 0.3 A 10 ARG H H 1 8.051 0.020 A 10 ARG HA H 1 4.289 0.020 A 10 ARG HBx H 1 1.760 0.020 A 10 ARG HBy H 1 1.829 0.020 A 10 ARG HD2 H 1 3.176 0.020 A 10 ARG HD3 H 1 3.176 0.020 A 10 ARG HGx H 1 1.596 0.020 A 10 ARG HGy H 1 1.644 0.020 A 10 ARG C C 13 176.276 0.3 A 10 ARG CA C 13 56.304 0.3 A 10 ARG CB C 13 30.820 0.3 A 10 ARG CD C 13 43.341 0.3 A 10 ARG CG C 13 27.292 0.3 A 10 ARG N N 15 121.030 0.3 A 11 ARG H H 1 8.213 0.020 A 11 ARG HB2 H 1 1.791 0.020 A 11 ARG HB3 H 1 1.791 0.020 A 11 ARG HD2 H 1 3.179 0.020 A 11 ARG HD3 H 1 3.179 0.020 A 11 ARG C C 13 176.047 0.3 A 11 ARG CA C 13 56.304 0.3 A 11 ARG CB C 13 30.929 0.3 A 11 ARG CD C 13 43.556 0.3 A 11 ARG CG C 13 27.302 0.3 A 11 ARG N N 15 121.751 0.3 A 12 HIS H H 1 8.466 0.020 A 12 HIS HA H 1 4.718 0.020 A 12 HIS HBx H 1 3.136 0.020 A 12 HIS HBy H 1 3.201 0.020 A 12 HIS HD2 H 1 7.166 0.020 A 12 HIS C C 13 174.824 0.3 A 12 HIS CA C 13 55.655 0.3 A 12 HIS CB C 13 29.927 0.3 A 12 HIS CD2 C 13 119.960 0.3 A 12 HIS N N 15 120.812 0.3 A 13 THR H H 1 8.113 0.020 A 13 THR HA H 1 4.595 0.020 A 13 THR HB H 1 4.177 0.020 A 13 THR HG2% H 1 1.210 0.020 A 13 THR C C 13 172.696 0.3 A 13 THR CA C 13 59.599 0.3 A 13 THR CB C 13 69.477 0.3 A 13 THR CG2 C 13 21.459 0.3 A 13 THR N N 15 118.223 0.3 A 14 PRO HA H 1 4.382 0.020 A 14 PRO HB2 H 1 2.330 0.020 A 14 PRO HB3 H 1 2.330 0.020 A 14 PRO HDx H 1 3.721 0.020 A 14 PRO HDy H 1 3.774 0.020 A 14 PRO HG2 H 1 1.955 0.020 A 14 PRO HG3 H 1 1.955 0.020 A 14 PRO CA C 13 63.505 0.3 A 14 PRO CB C 13 32.137 0.3 A 14 PRO CD C 13 51.028 0.3 A 14 PRO CG C 13 27.367 0.3 A 15 GLU H H 1 8.592 0.020 A 15 GLU HA H 1 4.206 0.020 A 15 GLU HBx H 1 1.939 0.020 A 15 GLU HBy H 1 2.033 0.020 A 15 GLU HG2 H 1 2.296 0.020 A 15 GLU HG3 H 1 2.296 0.020 A 15 GLU C C 13 176.345 0.3 A 15 GLU CA C 13 56.931 0.3 A 15 GLU CB C 13 29.982 0.3 A 15 GLU CG C 13 36.346 0.3 A 15 GLU N N 15 120.931 0.3 A 16 ALA H H 1 8.229 0.020 A 16 ALA HA H 1 4.285 0.020 A 16 ALA HB% H 1 1.388 0.020 A 16 ALA C C 13 177.500 0.3 A 16 ALA CA C 13 52.435 0.3 A 16 ALA CB C 13 19.362 0.3 A 16 ALA N N 15 124.376 0.3 A 17 GLU H H 1 8.288 0.020 A 17 GLU HA H 1 4.232 0.020 A 17 GLU HBx H 1 1.904 0.020 A 17 GLU HBy H 1 2.015 0.020 A 17 GLU HG2 H 1 2.234 0.020 A 17 GLU HG3 H 1 2.234 0.020 A 17 GLU C C 13 175.967 0.3 A 17 GLU CA C 13 56.543 0.3 A 17 GLU CB C 13 30.461 0.3 A 17 GLU CG C 13 36.137 0.3 A 17 GLU N N 15 119.900 0.3 A 18 ASN H H 1 8.445 0.020 A 18 ASN HA H 1 4.986 0.020 A 18 ASN HBx H 1 2.687 0.020 A 18 ASN HBy H 1 2.843 0.020 A 18 ASN C C 13 173.337 0.3 A 18 ASN CA C 13 51.134 0.3 A 18 ASN CB C 13 38.901 0.3 A 18 ASN N N 15 120.148 0.3 A 19 PRO HA H 1 4.390 0.020 A 19 PRO HBx H 1 1.980 0.020 A 19 PRO HBy H 1 2.300 0.020 A 19 PRO HD2 H 1 3.743 0.020 A 19 PRO HD3 H 1 3.743 0.020 A 19 PRO HG2 H 1 1.985 0.020 A 19 PRO HG3 H 1 1.985 0.020 A 19 PRO C C 13 176.825 0.3 A 19 PRO CA C 13 63.475 0.3 A 19 PRO CB C 13 32.137 0.3 A 19 PRO CD C 13 50.762 0.3 A 19 PRO CG C 13 27.236 0.3 A 20 ALA H H 1 8.359 0.020 A 20 ALA HA H 1 4.293 0.020 A 20 ALA HB% H 1 1.404 0.020 A 20 ALA C C 13 178.335 0.3 A 20 ALA CA C 13 52.688 0.3 A 20 ALA CB C 13 19.027 0.3 A 20 ALA N N 15 123.447 0.3 A 21 GLU H H 1 8.236 0.020 A 21 GLU HA H 1 4.175 0.020 A 21 GLU HBx H 1 1.966 0.020 A 21 GLU HBy H 1 2.076 0.020 A 21 GLU HG2 H 1 2.265 0.020 A 21 GLU HG3 H 1 2.265 0.020 A 21 GLU C C 13 176.974 0.3 A 21 GLU CA C 13 57.230 0.3 A 21 GLU CB C 13 29.982 0.3 A 21 GLU CG C 13 36.412 0.3 A 21 GLU N N 15 119.776 0.3 A 22 ALA H H 1 8.092 0.020 A 22 ALA HA H 1 4.234 0.020 A 22 ALA HB% H 1 1.390 0.020 A 22 ALA C C 13 177.294 0.3 A 22 ALA CA C 13 53.011 0.3 A 22 ALA CB C 13 19.387 0.3 A 22 ALA N N 15 122.810 0.3 A 23 ASP H H 1 8.227 0.020 A 23 ASP HA H 1 4.669 0.020 A 23 ASP HBx H 1 2.659 0.020 A 23 ASP HBy H 1 2.773 0.020 A 23 ASP C C 13 175.784 0.3 A 23 ASP CA C 13 54.122 0.3 A 23 ASP CB C 13 41.020 0.3 A 23 ASP N N 15 117.143 0.3 A 24 LEU H H 1 7.691 0.020 A 24 LEU HA H 1 4.432 0.020 A 24 LEU HBx H 1 1.534 0.020 A 24 LEU HBy H 1 1.641 0.020 A 24 LEU HDx% H 1 0.960 0.020 A 24 LEU HDy% H 1 0.900 0.020 A 24 LEU HG H 1 1.770 0.020 A 24 LEU C C 13 174.801 0.3 A 24 LEU CA C 13 53.829 0.3 A 24 LEU CB C 13 40.530 0.3 A 24 LEU CD1 C 13 25.317 0.3 A 24 LEU CD2 C 13 22.745 0.3 A 24 LEU CG C 13 26.991 0.3 A 24 LEU N N 15 121.863 0.3 A 25 PRO HA H 1 4.237 0.020 A 25 PRO HBy H 1 1.788 0.020 A 25 PRO HBx H 1 1.665 0.020 A 25 PRO HDx H 1 3.634 0.020 A 25 PRO HDy H 1 3.841 0.020 A 25 PRO HGx H 1 1.412 0.020 A 25 PRO HGy H 1 1.994 0.020 A 25 PRO C C 13 174.984 0.3 A 25 PRO CA C 13 63.894 0.3 A 25 PRO CB C 13 31.938 0.3 A 25 PRO CD C 13 50.569 0.3 A 25 PRO CG C 13 28.216 0.3 A 26 GLN H H 1 9.120 0.020 A 26 GLN HA H 1 4.411 0.020 A 26 GLN HBx H 1 1.843 0.020 A 26 GLN HBy H 1 1.968 0.020 A 26 GLN HE21 H 1 7.588 0.020 A 26 GLN HE22 H 1 6.745 0.020 A 26 GLN HG2 H 1 2.396 0.020 A 26 GLN HG3 H 1 2.396 0.020 A 26 GLN C C 13 175.658 0.3 A 26 GLN CA C 13 54.780 0.3 A 26 GLN CB C 13 30.833 0.3 A 26 GLN CG C 13 33.028 0.3 A 26 GLN N N 15 125.117 0.3 A 26 GLN NE2 N 15 112.600 0.3 A 27 GLY H H 1 8.446 0.020 A 27 GLY HAx H 1 3.837 0.020 A 27 GLY HAy H 1 4.255 0.020 A 27 GLY C C 13 173.463 0.3 A 27 GLY CA C 13 44.193 0.3 A 27 GLY N N 15 111.022 0.3 A 28 ASP H H 1 8.307 0.020 A 28 ASP HA H 1 4.219 0.020 A 28 ASP HBx H 1 2.591 0.020 A 28 ASP HBy H 1 2.675 0.020 A 28 ASP C C 13 178.575 0.3 A 28 ASP CA C 13 57.858 0.3 A 28 ASP CB C 13 40.937 0.3 A 28 ASP N N 15 117.308 0.3 A 29 ILE H H 1 7.985 0.020 A 29 ILE HA H 1 3.678 0.020 A 29 ILE HB H 1 1.749 0.020 A 29 ILE HD1% H 1 0.876 0.020 A 29 ILE HG12 H 1 1.143 0.020 A 29 ILE HG13 H 1 1.143 0.020 A 29 ILE HG2% H 1 0.652 0.020 A 29 ILE C C 13 178.209 0.3 A 29 ILE CA C 13 65.587 0.3 A 29 ILE CB C 13 37.165 0.3 A 29 ILE CD1 C 13 13.013 0.3 A 29 ILE CG1 C 13 28.744 0.3 A 29 ILE CG2 C 13 18.446 0.3 A 29 ILE N N 15 120.024 0.3 A 30 GLU H H 1 8.647 0.020 A 30 GLU HA H 1 3.322 0.020 A 30 GLU HB2 H 1 1.838 0.020 A 30 GLU HB3 H 1 1.838 0.020 A 30 GLU HGx H 1 1.702 0.020 A 30 GLU HGy H 1 2.449 0.020 A 30 GLU C C 13 179.158 0.3 A 30 GLU CA C 13 60.837 0.3 A 30 GLU CB C 13 29.223 0.3 A 30 GLU CG C 13 37.854 0.3 A 30 GLU N N 15 119.240 0.3 A 31 LYS H H 1 7.839 0.020 A 31 LYS HA H 1 3.681 0.020 A 31 LYS HB2 H 1 1.785 0.020 A 31 LYS HB3 H 1 1.785 0.020 A 31 LYS HDx H 1 1.516 0.020 A 31 LYS HDy H 1 1.590 0.020 A 31 LYS HE2 H 1 2.899 0.020 A 31 LYS HE3 H 1 2.899 0.020 A 31 LYS HGx H 1 1.242 0.020 A 31 LYS HGy H 1 1.478 0.020 A 31 LYS C C 13 179.215 0.3 A 31 LYS CA C 13 60.427 0.3 A 31 LYS CB C 13 32.676 0.3 A 31 LYS CD C 13 29.624 0.3 A 31 LYS CE C 13 42.095 0.3 A 31 LYS CG C 13 26.712 0.3 A 31 LYS N N 15 115.738 0.3 A 32 GLN H H 1 7.945 0.020 A 32 GLN HA H 1 4.130 0.020 A 32 GLN HBx H 1 2.215 0.020 A 32 GLN HBy H 1 2.431 0.020 A 32 GLN HGx H 1 2.243 0.020 A 32 GLN HGy H 1 2.340 0.020 A 32 GLN C C 13 179.138 0.3 A 32 GLN CA C 13 58.651 0.3 A 32 GLN CB C 13 28.321 0.3 A 32 GLN CG C 13 33.864 0.3 A 32 GLN N N 15 121.254 0.3 A 33 VAL H H 1 8.520 0.020 A 33 VAL HA H 1 3.273 0.020 A 33 VAL HB H 1 1.688 0.020 A 33 VAL HGx% H 1 0.717 0.020 A 33 VAL HGy% H 1 0.368 0.020 A 33 VAL C C 13 176.905 0.3 A 33 VAL CA C 13 67.070 0.3 A 33 VAL CB C 13 30.999 0.3 A 33 VAL CG1 C 13 24.221 0.3 A 33 VAL CG2 C 13 22.714 0.3 A 33 VAL N N 15 119.488 0.3 A 34 ALA H H 1 8.560 0.020 A 34 ALA HA H 1 3.522 0.020 A 34 ALA HB% H 1 1.267 0.020 A 34 ALA C C 13 178.986 0.3 A 34 ALA CA C 13 55.536 0.3 A 34 ALA CB C 13 18.274 0.3 A 34 ALA N N 15 120.931 0.3 A 35 ALA H H 1 7.672 0.020 A 35 ALA HA H 1 4.194 0.020 A 35 ALA HB% H 1 1.511 0.020 A 35 ALA C C 13 181.217 0.3 A 35 ALA CA C 13 55.014 0.3 A 35 ALA CB C 13 17.798 0.3 A 35 ALA N N 15 119.229 0.3 A 36 LEU H H 1 7.547 0.020 A 36 LEU HA H 1 4.352 0.020 A 36 LEU HBx H 1 1.527 0.020 A 36 LEU HBy H 1 2.151 0.020 A 36 LEU HDx% H 1 0.894 0.020 A 36 LEU HDy% H 1 0.951 0.020 A 36 LEU HG H 1 1.962 0.020 A 36 LEU C C 13 180.359 0.3 A 36 LEU CA C 13 57.648 0.3 A 36 LEU CB C 13 41.919 0.3 A 36 LEU CD1 C 13 25.663 0.3 A 36 LEU CD2 C 13 22.739 0.3 A 36 LEU CG C 13 26.714 0.3 A 36 LEU N N 15 117.996 0.3 A 37 TRP H H 1 9.382 0.020 A 37 TRP HA H 1 4.376 0.020 A 37 TRP HBx H 1 3.243 0.020 A 37 TRP HBy H 1 3.443 0.020 A 37 TRP HD1 H 1 6.915 0.020 A 37 TRP HE3 H 1 7.225 0.020 A 37 TRP HH2 H 1 7.603 0.020 A 37 TRP HZ2 H 1 6.676 0.020 A 37 TRP HZ3 H 1 7.297 0.020 A 37 TRP C C 13 177.843 0.3 A 37 TRP CA C 13 60.935 0.3 A 37 TRP CB C 13 28.908 0.3 A 37 TRP CD1 C 13 122.560 0.3 A 37 TRP CE3 C 13 122.880 0.3 A 37 TRP CH2 C 13 126.844 0.3 A 37 TRP CZ2 C 13 113.700 0.3 A 37 TRP CZ3 C 13 119.971 0.3 A 37 TRP N N 15 121.279 0.3 A 38 GLN H H 1 8.839 0.020 A 38 GLN HA H 1 4.220 0.020 A 38 GLN HBx H 1 2.230 0.020 A 38 GLN HBy H 1 2.319 0.020 A 38 GLN HE21 H 1 7.561 0.020 A 38 GLN HE22 H 1 6.803 0.020 A 38 GLN HGx H 1 2.491 0.020 A 38 GLN HGy H 1 2.656 0.020 A 38 GLN C C 13 178.478 0.3 A 38 GLN CA C 13 59.352 0.3 A 38 GLN CB C 13 28.766 0.3 A 38 GLN CG C 13 34.783 0.3 A 38 GLN N N 15 118.619 0.3 A 38 GLN NE2 N 15 112.418 0.3 A 39 GLN H H 1 7.266 0.020 A 39 GLN HA H 1 4.202 0.020 A 39 GLN HB2 H 1 2.276 0.020 A 39 GLN HB3 H 1 2.276 0.020 A 39 GLN HGx H 1 2.471 0.020 A 39 GLN HGy H 1 2.601 0.020 A 39 GLN C C 13 178.232 0.3 A 39 GLN CA C 13 57.888 0.3 A 39 GLN CB C 13 28.962 0.3 A 39 GLN CG C 13 33.921 0.3 A 39 GLN N N 15 115.393 0.3 A 40 LEU H H 1 8.222 0.020 A 40 LEU HA H 1 4.177 0.020 A 40 LEU HBy H 1 1.812 0.020 A 40 LEU HBx H 1 1.440 0.020 A 40 LEU HDx% H 1 0.945 0.020 A 40 LEU HDy% H 1 0.947 0.020 A 40 LEU HG H 1 1.981 0.020 A 40 LEU C C 13 177.694 0.3 A 40 LEU CA C 13 57.332 0.3 A 40 LEU CB C 13 43.643 0.3 A 40 LEU CD1 C 13 26.725 0.3 A 40 LEU CD2 C 13 23.831 0.3 A 40 LEU CG C 13 26.789 0.3 A 40 LEU N N 15 118.844 0.3 A 41 LEU H H 1 8.425 0.020 A 41 LEU HA H 1 4.098 0.020 A 41 LEU HB2 H 1 1.713 0.020 A 41 LEU HB3 H 1 1.713 0.020 A 41 LEU HDx% H 1 0.348 0.020 A 41 LEU HDy% H 1 -0.172 0.020 A 41 LEU HG H 1 1.334 0.020 A 41 LEU C C 13 176.676 0.3 A 41 LEU CA C 13 54.242 0.3 A 41 LEU CB C 13 41.948 0.3 A 41 LEU CD1 C 13 24.802 0.3 A 41 LEU CD2 C 13 20.944 0.3 A 41 LEU CG C 13 26.712 0.3 A 41 LEU N N 15 114.894 0.3 A 42 SER H H 1 7.695 0.020 A 42 SER HA H 1 4.168 0.020 A 42 SER HB2 H 1 3.893 0.020 A 42 SER HB3 H 1 3.893 0.020 A 42 SER C C 13 174.011 0.3 A 42 SER CA C 13 58.306 0.3 A 42 SER CB C 13 62.004 0.3 A 42 SER N N 15 113.356 0.3 A 43 THR H H 1 7.732 0.020 A 43 THR HA H 1 4.621 0.020 A 43 THR HB H 1 4.070 0.020 A 43 THR HG2% H 1 1.049 0.020 A 43 THR C C 13 173.291 0.3 A 43 THR CA C 13 59.599 0.3 A 43 THR CB C 13 69.775 0.3 A 43 THR CG2 C 13 20.225 0.3 A 43 THR N N 15 112.540 0.3 A 44 GLY H H 1 8.332 0.020 A 44 GLY HAx H 1 3.815 0.020 A 44 GLY HAy H 1 4.168 0.020 A 44 GLY C C 13 174.183 0.3 A 44 GLY CA C 13 45.012 0.3 A 44 GLY N N 15 111.219 0.3 A 45 ASN H H 1 8.294 0.020 A 45 ASN HA H 1 4.743 0.020 A 45 ASN HBx H 1 2.628 0.020 A 45 ASN HBy H 1 2.747 0.020 A 45 ASN C C 13 174.069 0.3 A 45 ASN CA C 13 53.077 0.3 A 45 ASN CB C 13 38.722 0.3 A 45 ASN N N 15 119.044 0.3 A 46 VAL H H 1 8.053 0.020 A 46 VAL HA H 1 4.277 0.020 A 46 VAL HB H 1 2.016 0.020 A 46 VAL HGx% H 1 1.001 0.020 A 46 VAL HGy% H 1 1.014 0.020 A 46 VAL C C 13 175.144 0.3 A 46 VAL CA C 13 62.283 0.3 A 46 VAL CB C 13 33.031 0.3 A 46 VAL CG1 C 13 22.256 0.3 A 46 VAL CG2 C 13 23.017 0.3 A 46 VAL N N 15 121.788 0.3 A 47 THR H H 1 9.278 0.020 A 47 THR HA H 1 4.710 0.020 A 47 THR HB H 1 4.783 0.020 A 47 THR HG2% H 1 1.083 0.020 A 47 THR C C 13 175.085 0.3 A 47 THR CA C 13 59.420 0.3 A 47 THR CB C 13 71.345 0.3 A 47 THR CG2 C 13 20.772 0.3 A 47 THR N N 15 118.113 0.3 A 48 ARG H H 1 8.670 0.020 A 48 ARG HA H 1 3.990 0.020 A 48 ARG HBx H 1 1.676 0.020 A 48 ARG HBy H 1 1.933 0.020 A 48 ARG HD2 H 1 3.256 0.020 A 48 ARG HD3 H 1 3.256 0.020 A 48 ARG HG2 H 1 1.555 0.020 A 48 ARG HG3 H 1 1.555 0.020 A 48 ARG C C 13 175.670 0.3 A 48 ARG CA C 13 60.158 0.3 A 48 ARG CB C 13 31.179 0.3 A 48 ARG CD C 13 43.175 0.3 A 48 ARG CG C 13 28.317 0.3 A 48 ARG N N 15 115.641 0.3 A 49 GLU H H 1 7.902 0.020 A 49 GLU HA H 1 4.476 0.020 A 49 GLU HBx H 1 1.694 0.020 A 49 GLU HBy H 1 2.340 0.020 A 49 GLU HGx H 1 2.174 0.020 A 49 GLU HGy H 1 2.345 0.020 A 49 GLU C C 13 176.196 0.3 A 49 GLU CA C 13 54.959 0.3 A 49 GLU CB C 13 30.083 0.3 A 49 GLU CG C 13 35.543 0.3 A 49 GLU N N 15 113.601 0.3 A 50 THR H H 1 7.617 0.020 A 50 THR HA H 1 3.931 0.020 A 50 THR HB H 1 4.285 0.020 A 50 THR HG2% H 1 1.436 0.020 A 50 THR C C 13 172.113 0.3 A 50 THR CA C 13 65.582 0.3 A 50 THR CB C 13 69.601 0.3 A 50 THR CG2 C 13 22.267 0.3 A 50 THR N N 15 120.248 0.3 A 51 ASP H H 1 8.864 0.020 A 51 ASP HA H 1 5.207 0.020 A 51 ASP HBx H 1 2.476 0.020 A 51 ASP HBy H 1 2.924 0.020 A 51 ASP C C 13 175.750 0.3 A 51 ASP CA C 13 52.419 0.3 A 51 ASP CB C 13 43.511 0.3 A 51 ASP N N 15 129.249 0.3 A 52 PHE H H 1 8.480 0.020 A 52 PHE HA H 1 2.870 0.020 A 52 PHE HBx H 1 1.513 0.020 A 52 PHE HBy H 1 2.027 0.020 A 52 PHE HD1 H 1 4.469 0.020 A 52 PHE HD2 H 1 4.469 0.020 A 52 PHE HE1 H 1 6.287 0.020 A 52 PHE HE2 H 1 6.287 0.020 A 52 PHE HZ H 1 6.362 0.020 A 52 PHE C C 13 175.647 0.3 A 52 PHE CA C 13 61.826 0.3 A 52 PHE CB C 13 40.377 0.3 A 52 PHE CD1 C 13 131.980 0.3 A 52 PHE CE1 C 13 129.419 0.3 A 52 PHE CZ C 13 127.534 0.3 A 52 PHE N N 15 125.857 0.3 A 53 PHE H H 1 7.761 0.020 A 53 PHE HA H 1 3.951 0.020 A 53 PHE HBx H 1 3.044 0.020 A 53 PHE HBy H 1 3.141 0.020 A 53 PHE HD1 H 1 7.214 0.020 A 53 PHE HD2 H 1 7.214 0.020 A 53 PHE HE1 H 1 6.853 0.020 A 53 PHE HE2 H 1 6.853 0.020 A 53 PHE HZ H 1 5.891 0.020 A 53 PHE C C 13 179.661 0.3 A 53 PHE CA C 13 60.069 0.3 A 53 PHE CB C 13 38.326 0.3 A 53 PHE CD1 C 13 132.228 0.3 A 53 PHE CE1 C 13 130.543 0.3 A 53 PHE CZ C 13 129.509 0.3 A 53 PHE N N 15 112.744 0.3 A 54 GLN H H 1 8.894 0.020 A 54 GLN HA H 1 4.105 0.020 A 54 GLN HBx H 1 2.065 0.020 A 54 GLN HBy H 1 2.329 0.020 A 54 GLN HGx H 1 2.433 0.020 A 54 GLN HGy H 1 2.542 0.020 A 54 GLN C C 13 178.072 0.3 A 54 GLN CA C 13 58.273 0.3 A 54 GLN CB C 13 28.605 0.3 A 54 GLN CG C 13 33.987 0.3 A 54 GLN N N 15 123.708 0.3 A 55 GLN H H 1 7.471 0.020 A 55 GLN HA H 1 4.330 0.020 A 55 GLN HBx H 1 1.752 0.020 A 55 GLN HBy H 1 2.211 0.020 A 55 GLN HG2 H 1 2.480 0.020 A 55 GLN HG3 H 1 2.480 0.020 A 55 GLN C C 13 174.961 0.3 A 55 GLN CA C 13 54.180 0.3 A 55 GLN CB C 13 28.545 0.3 A 55 GLN CG C 13 34.751 0.3 A 55 GLN N N 15 114.459 0.3 A 56 GLY H H 1 7.294 0.020 A 56 GLY HAx H 1 3.554 0.020 A 56 GLY HAy H 1 4.273 0.020 A 56 GLY C C 13 174.641 0.3 A 56 GLY CA C 13 44.612 0.3 A 56 GLY N N 15 104.631 0.3 A 57 GLY H H 1 8.002 0.020 A 57 GLY HAx H 1 2.190 0.020 A 57 GLY HAy H 1 3.001 0.020 A 57 GLY C C 13 170.331 0.3 A 57 GLY CA C 13 45.269 0.3 A 57 GLY N N 15 109.777 0.3 A 58 ASP H H 1 6.689 0.020 A 58 ASP HA H 1 5.001 0.020 A 58 ASP HBx H 1 2.907 0.020 A 58 ASP HBy H 1 3.245 0.020 A 58 ASP C C 13 176.802 0.3 A 58 ASP CA C 13 52.721 0.3 A 58 ASP CB C 13 42.411 0.3 A 58 ASP N N 15 117.592 0.3 A 59 SER H H 1 8.907 0.020 A 59 SER HA H 1 4.109 0.020 A 59 SER HB2 H 1 4.317 0.020 A 59 SER HB3 H 1 4.317 0.020 A 59 SER C C 13 176.196 0.3 A 59 SER CA C 13 62.629 0.3 A 59 SER CB C 13 62.679 0.3 A 59 SER N N 15 113.791 0.3 A 60 LEU H H 1 7.983 0.020 A 60 LEU HA H 1 4.275 0.020 A 60 LEU HBx H 1 1.797 0.020 A 60 LEU HBy H 1 1.912 0.020 A 60 LEU HDx% H 1 0.933 0.020 A 60 LEU HDy% H 1 0.971 0.020 A 60 LEU HG H 1 1.658 0.020 A 60 LEU C C 13 180.713 0.3 A 60 LEU CA C 13 58.279 0.3 A 60 LEU CB C 13 41.167 0.3 A 60 LEU CD1 C 13 24.172 0.3 A 60 LEU CD2 C 13 24.496 0.3 A 60 LEU CG C 13 27.387 0.3 A 60 LEU N N 15 125.649 0.3 A 61 LEU H H 1 9.175 0.020 A 61 LEU HA H 1 4.093 0.020 A 61 LEU HBx H 1 1.461 0.020 A 61 LEU HBy H 1 1.715 0.020 A 61 LEU HDx% H 1 0.833 0.020 A 61 LEU HDy% H 1 0.825 0.020 A 61 LEU HG H 1 1.980 0.020 A 61 LEU C C 13 179.295 0.3 A 61 LEU CA C 13 57.828 0.3 A 61 LEU CB C 13 42.553 0.3 A 61 LEU CD1 C 13 25.488 0.3 A 61 LEU CD2 C 13 23.516 0.3 A 61 LEU CG C 13 27.070 0.3 A 61 LEU N N 15 122.472 0.3 A 62 ALA H H 1 8.816 0.020 A 62 ALA HA H 1 3.579 0.020 A 62 ALA HB% H 1 1.375 0.020 A 62 ALA C C 13 179.467 0.3 A 62 ALA CA C 13 55.079 0.3 A 62 ALA CB C 13 19.367 0.3 A 62 ALA N N 15 121.080 0.3 A 63 THR H H 1 8.036 0.020 A 63 THR HA H 1 4.020 0.020 A 63 THR HB H 1 4.463 0.020 A 63 THR HG2% H 1 1.345 0.020 A 63 THR C C 13 177.248 0.3 A 63 THR CA C 13 66.859 0.3 A 63 THR CB C 13 68.640 0.3 A 63 THR CG2 C 13 21.465 0.3 A 63 THR N N 15 116.577 0.3 A 64 ARG H H 1 7.969 0.020 A 64 ARG HA H 1 4.174 0.020 A 64 ARG HB2 H 1 2.003 0.020 A 64 ARG HB3 H 1 2.003 0.020 A 64 ARG HD2 H 1 3.173 0.020 A 64 ARG HD3 H 1 3.173 0.020 A 64 ARG HGx H 1 1.665 0.020 A 64 ARG HGy H 1 1.872 0.020 A 64 ARG C C 13 179.112 0.3 A 64 ARG CA C 13 59.835 0.3 A 64 ARG CB C 13 29.820 0.3 A 64 ARG CD C 13 43.818 0.3 A 64 ARG CG C 13 27.232 0.3 A 64 ARG N N 15 124.449 0.3 A 65 LEU H H 1 8.564 0.020 A 65 LEU HA H 1 4.088 0.020 A 65 LEU HBx H 1 1.464 0.020 A 65 LEU HBy H 1 2.022 0.020 A 65 LEU HDx% H 1 0.544 0.020 A 65 LEU HDy% H 1 1.074 0.020 A 65 LEU HG H 1 1.507 0.020 A 65 LEU C C 13 178.335 0.3 A 65 LEU CA C 13 57.977 0.3 A 65 LEU CB C 13 40.368 0.3 A 65 LEU CD1 C 13 27.937 0.3 A 65 LEU CD2 C 13 24.504 0.3 A 65 LEU CG C 13 27.097 0.3 A 65 LEU N N 15 120.049 0.3 A 66 THR H H 1 8.180 0.020 A 66 THR HA H 1 4.231 0.020 A 66 THR HB H 1 3.682 0.020 A 66 THR HG2% H 1 1.090 0.020 A 66 THR C C 13 177.042 0.3 A 66 THR CA C 13 67.781 0.3 A 66 THR CB C 13 67.505 0.3 A 66 THR CG2 C 13 21.436 0.3 A 66 THR N N 15 112.689 0.3 A 67 GLY H H 1 7.894 0.020 A 67 GLY HAy H 1 4.099 0.020 A 67 GLY HAx H 1 4.028 0.020 A 67 GLY C C 13 176.916 0.3 A 67 GLY CA C 13 47.523 0.3 A 67 GLY N N 15 109.241 0.3 A 68 GLN H H 1 8.229 0.020 A 68 GLN HA H 1 4.187 0.020 A 68 GLN HBy H 1 2.444 0.020 A 68 GLN HBx H 1 2.091 0.020 A 68 GLN HGx H 1 2.464 0.020 A 68 GLN HGy H 1 2.634 0.020 A 68 GLN C C 13 180.485 0.3 A 68 GLN CA C 13 59.352 0.3 A 68 GLN CB C 13 28.609 0.3 A 68 GLN CG C 13 34.533 0.3 A 68 GLN N N 15 122.476 0.3 A 69 LEU H H 1 8.718 0.020 A 69 LEU HA H 1 4.175 0.020 A 69 LEU HBx H 1 1.362 0.020 A 69 LEU HBy H 1 2.038 0.020 A 69 LEU HDx% H 1 0.643 0.020 A 69 LEU HDy% H 1 0.960 0.020 A 69 LEU HG H 1 1.806 0.020 A 69 LEU C C 13 179.067 0.3 A 69 LEU CA C 13 58.097 0.3 A 69 LEU CB C 13 40.932 0.3 A 69 LEU CD1 C 13 23.272 0.3 A 69 LEU CD2 C 13 27.338 0.3 A 69 LEU CG C 13 27.287 0.3 A 69 LEU N N 15 121.005 0.3 A 70 HIS H H 1 8.315 0.020 A 70 HIS HA H 1 5.086 0.020 A 70 HIS HBx H 1 3.512 0.020 A 70 HIS HBy H 1 3.611 0.020 A 70 HIS HD2 H 1 7.535 0.020 A 70 HIS HE1 H 1 8.569 0.020 A 70 HIS C C 13 180.176 0.3 A 70 HIS CA C 13 58.292 0.3 A 70 HIS CB C 13 28.455 0.3 A 70 HIS CD2 C 13 119.300 0.3 A 70 HIS CE1 C 13 136.754 0.3 A 70 HIS N N 15 120.061 0.3 A 71 GLN H H 1 8.111 0.020 A 71 GLN HA H 1 4.102 0.020 A 71 GLN HB2 H 1 2.292 0.020 A 71 GLN HB3 H 1 2.292 0.020 A 71 GLN HGy H 1 2.641 0.020 A 71 GLN HGx H 1 2.554 0.020 A 71 GLN C C 13 176.768 0.3 A 71 GLN CA C 13 58.551 0.3 A 71 GLN CB C 13 28.560 0.3 A 71 GLN CG C 13 34.249 0.3 A 71 GLN N N 15 120.111 0.3 A 72 ALA H H 1 7.589 0.020 A 72 ALA HA H 1 4.471 0.020 A 72 ALA HB% H 1 1.686 0.020 A 72 ALA C C 13 176.367 0.3 A 72 ALA CA C 13 51.876 0.3 A 72 ALA CB C 13 18.434 0.3 A 72 ALA N N 15 119.701 0.3 A 73 GLY H H 1 7.725 0.020 A 73 GLY HAx H 1 3.652 0.020 A 73 GLY HAy H 1 4.075 0.020 A 73 GLY C C 13 173.909 0.3 A 73 GLY CA C 13 45.397 0.3 A 73 GLY N N 15 104.997 0.3 A 74 TYR H H 1 8.254 0.020 A 74 TYR HA H 1 5.040 0.020 A 74 TYR HBx H 1 2.502 0.020 A 74 TYR HBy H 1 2.772 0.020 A 74 TYR HD1 H 1 6.851 0.020 A 74 TYR HD2 H 1 6.851 0.020 A 74 TYR HE1 H 1 6.579 0.020 A 74 TYR HE2 H 1 6.579 0.020 A 74 TYR C C 13 176.127 0.3 A 74 TYR CA C 13 57.635 0.3 A 74 TYR CB C 13 40.817 0.3 A 74 TYR CD1 C 13 132.962 0.3 A 74 TYR CE1 C 13 117.540 0.3 A 74 TYR N N 15 118.297 0.3 A 75 GLU H H 1 9.043 0.020 A 75 GLU HA H 1 4.454 0.020 A 75 GLU HBx H 1 1.865 0.020 A 75 GLU HBy H 1 2.058 0.020 A 75 GLU HGx H 1 2.196 0.020 A 75 GLU HGy H 1 2.259 0.020 A 75 GLU C C 13 175.590 0.3 A 75 GLU CA C 13 55.292 0.3 A 75 GLU CB C 13 29.623 0.3 A 75 GLU CG C 13 35.771 0.3 A 75 GLU N N 15 122.316 0.3 A 76 ALA H H 1 8.122 0.020 A 76 ALA HA H 1 4.719 0.020 A 76 ALA HB% H 1 1.321 0.020 A 76 ALA C C 13 176.184 0.3 A 76 ALA CA C 13 51.476 0.3 A 76 ALA CB C 13 23.016 0.3 A 76 ALA N N 15 125.200 0.3 A 77 GLN H H 1 8.988 0.020 A 77 GLN HA H 1 4.875 0.020 A 77 GLN HBx H 1 2.053 0.020 A 77 GLN HBy H 1 2.308 0.020 A 77 GLN HGx H 1 2.422 0.020 A 77 GLN HGy H 1 2.497 0.020 A 77 GLN C C 13 177.008 0.3 A 77 GLN CA C 13 53.741 0.3 A 77 GLN CB C 13 30.700 0.3 A 77 GLN CG C 13 33.541 0.3 A 77 GLN N N 15 120.024 0.3 A 78 LEU H H 1 9.112 0.020 A 78 LEU HA H 1 3.905 0.020 A 78 LEU HB2 H 1 1.735 0.020 A 78 LEU HB3 H 1 1.735 0.020 A 78 LEU HD1% H 1 0.898 0.020 A 78 LEU HD2% H 1 0.898 0.020 A 78 LEU HG H 1 1.648 0.020 A 78 LEU C C 13 179.009 0.3 A 78 LEU CA C 13 58.690 0.3 A 78 LEU CB C 13 42.057 0.3 A 78 LEU CD1 C 13 24.960 0.3 A 78 LEU CG C 13 27.212 0.3 A 78 LEU N N 15 127.684 0.3 A 79 SER H H 1 8.721 0.020 A 79 SER HA H 1 4.162 0.020 A 79 SER C C 13 176.573 0.3 A 79 SER CA C 13 61.384 0.3 A 79 SER CB C 13 62.188 0.3 A 79 SER N N 15 110.879 0.3 A 80 ASP H H 1 7.340 0.020 A 80 ASP HA H 1 4.819 0.020 A 80 ASP HBx H 1 2.995 0.020 A 80 ASP HBy H 1 3.369 0.020 A 80 ASP C C 13 177.774 0.3 A 80 ASP CA C 13 58.007 0.3 A 80 ASP CB C 13 40.877 0.3 A 80 ASP N N 15 120.273 0.3 A 81 LEU H H 1 7.348 0.020 A 81 LEU HA H 1 4.073 0.020 A 81 LEU HBx H 1 0.808 0.020 A 81 LEU HBy H 1 1.565 0.020 A 81 LEU HDx% H 1 -0.517 0.020 A 81 LEU HDy% H 1 -0.371 0.020 A 81 LEU HG H 1 0.804 0.020 A 81 LEU C C 13 177.157 0.3 A 81 LEU CA C 13 56.662 0.3 A 81 LEU CB C 13 41.168 0.3 A 81 LEU CD1 C 13 25.766 0.3 A 81 LEU CD2 C 13 21.272 0.3 A 81 LEU CG C 13 26.002 0.3 A 81 LEU N N 15 120.844 0.3 A 82 PHE H H 1 7.423 0.020 A 82 PHE HA H 1 4.146 0.020 A 82 PHE HBx H 1 2.885 0.020 A 82 PHE HBy H 1 2.971 0.020 A 82 PHE HD1 H 1 7.084 0.020 A 82 PHE HD2 H 1 7.084 0.020 A 82 PHE HE1 H 1 7.152 0.020 A 82 PHE HE2 H 1 7.152 0.020 A 82 PHE C C 13 178.598 0.3 A 82 PHE CA C 13 61.084 0.3 A 82 PHE CB C 13 38.535 0.3 A 82 PHE CD1 C 13 131.372 0.3 A 82 PHE CE1 C 13 129.130 0.3 A 82 PHE N N 15 113.227 0.3 A 83 ASN H H 1 8.054 0.020 A 83 ASN HA H 1 4.583 0.020 A 83 ASN HBx H 1 2.321 0.020 A 83 ASN HBy H 1 2.728 0.020 A 83 ASN HD21 H 1 7.681 0.020 A 83 ASN HD22 H 1 6.973 0.020 A 83 ASN C C 13 175.270 0.3 A 83 ASN CA C 13 54.237 0.3 A 83 ASN CB C 13 39.168 0.3 A 83 ASN N N 15 113.216 0.3 A 83 ASN ND2 N 15 112.980 0.3 A 84 HIS H H 1 7.643 0.020 A 84 HIS HA H 1 5.221 0.020 A 84 HIS HBx H 1 2.768 0.020 A 84 HIS HBy H 1 3.780 0.020 A 84 HIS HD2 H 1 7.464 0.020 A 84 HIS HE1 H 1 8.602 0.020 A 84 HIS C C 13 180.885 0.3 A 84 HIS CA C 13 52.939 0.3 A 84 HIS CB C 13 27.785 0.3 A 84 HIS CD2 C 13 121.000 0.3 A 84 HIS CE1 C 13 136.522 0.3 A 84 HIS N N 15 117.846 0.3 A 85 PRO HA H 1 4.738 0.020 A 85 PRO HB2 H 1 2.492 0.020 A 85 PRO HB3 H 1 2.492 0.020 A 85 PRO HDy H 1 3.671 0.020 A 85 PRO HDx H 1 3.396 0.020 A 85 PRO HGx H 1 2.067 0.020 A 85 PRO HGy H 1 2.191 0.020 A 85 PRO C C 13 177.626 0.3 A 85 PRO CA C 13 64.880 0.3 A 85 PRO CB C 13 33.108 0.3 A 85 PRO CD C 13 49.483 0.3 A 85 PRO CG C 13 27.676 0.3 A 86 ARG H H 1 7.877 0.020 A 86 ARG HA H 1 5.309 0.020 A 86 ARG HBx H 1 1.888 0.020 A 86 ARG HBy H 1 2.053 0.020 A 86 ARG HDx H 1 3.338 0.020 A 86 ARG HDy H 1 3.375 0.020 A 86 ARG HGx H 1 1.562 0.020 A 86 ARG HGy H 1 1.842 0.020 A 86 ARG C C 13 178.872 0.3 A 86 ARG CA C 13 55.322 0.3 A 86 ARG CB C 13 31.503 0.3 A 86 ARG CD C 13 43.969 0.3 A 86 ARG CG C 13 28.730 0.3 A 86 ARG N N 15 118.993 0.3 A 87 LEU H H 1 8.627 0.020 A 87 LEU HA H 1 3.513 0.020 A 87 LEU HBx H 1 1.318 0.020 A 87 LEU HBy H 1 1.743 0.020 A 87 LEU HDx% H 1 0.336 0.020 A 87 LEU HDy% H 1 0.078 0.020 A 87 LEU HG H 1 0.810 0.020 A 87 LEU C C 13 178.506 0.3 A 87 LEU CA C 13 60.934 0.3 A 87 LEU CB C 13 40.205 0.3 A 87 LEU CD1 C 13 23.493 0.3 A 87 LEU CD2 C 13 24.658 0.3 A 87 LEU CG C 13 27.629 0.3 A 87 LEU N N 15 125.941 0.3 A 88 ALA H H 1 8.592 0.020 A 88 ALA HA H 1 3.726 0.020 A 88 ALA HB% H 1 1.356 0.020 A 88 ALA C C 13 179.890 0.3 A 88 ALA CA C 13 56.005 0.3 A 88 ALA CB C 13 18.147 0.3 A 88 ALA N N 15 117.848 0.3 A 89 ASP H H 1 7.293 0.020 A 89 ASP HA H 1 4.422 0.020 A 89 ASP HBx H 1 2.825 0.020 A 89 ASP HBy H 1 2.903 0.020 A 89 ASP C C 13 178.014 0.3 A 89 ASP CA C 13 56.513 0.3 A 89 ASP CB C 13 41.122 0.3 A 89 ASP N N 15 117.028 0.3 A 90 PHE H H 1 9.088 0.020 A 90 PHE HA H 1 4.296 0.020 A 90 PHE HBx H 1 2.776 0.020 A 90 PHE HBy H 1 4.656 0.020 A 90 PHE HD1 H 1 7.058 0.020 A 90 PHE HD2 H 1 7.058 0.020 A 90 PHE HE1 H 1 6.901 0.020 A 90 PHE HE2 H 1 6.901 0.020 A 90 PHE C C 13 179.730 0.3 A 90 PHE CA C 13 61.254 0.3 A 90 PHE CB C 13 38.363 0.3 A 90 PHE CD1 C 13 131.113 0.3 A 90 PHE CE1 C 13 129.111 0.3 A 90 PHE N N 15 121.947 0.3 A 91 ALA H H 1 9.165 0.020 A 91 ALA HA H 1 3.425 0.020 A 91 ALA HB% H 1 1.237 0.020 A 91 ALA C C 13 178.049 0.3 A 91 ALA CA C 13 54.749 0.3 A 91 ALA CB C 13 18.219 0.3 A 91 ALA N N 15 121.142 0.3 A 92 ALA H H 1 7.006 0.020 A 92 ALA HA H 1 4.173 0.020 A 92 ALA HB% H 1 1.498 0.020 A 92 ALA C C 13 178.369 0.3 A 92 ALA CA C 13 53.551 0.3 A 92 ALA CB C 13 18.062 0.3 A 92 ALA N N 15 116.380 0.3 A 93 THR H H 1 7.595 0.020 A 93 THR HA H 1 4.200 0.020 A 93 THR HB H 1 4.177 0.020 A 93 THR HG2% H 1 1.106 0.020 A 93 THR C C 13 174.961 0.3 A 93 THR CA C 13 62.514 0.3 A 93 THR CB C 13 69.950 0.3 A 93 THR CG2 C 13 21.206 0.3 A 93 THR N N 15 108.661 0.3 A 94 LEU H H 1 6.807 0.020 A 94 LEU HA H 1 4.231 0.020 A 94 LEU HBx H 1 1.059 0.020 A 94 LEU HBy H 1 1.677 0.020 A 94 LEU HDx% H 1 0.114 0.020 A 94 LEU HDy% H 1 0.377 0.020 A 94 LEU HG H 1 1.247 0.020 A 94 LEU C C 13 176.928 0.3 A 94 LEU CA C 13 55.241 0.3 A 94 LEU CB C 13 42.271 0.3 A 94 LEU CD1 C 13 26.010 0.3 A 94 LEU CD2 C 13 23.219 0.3 A 94 LEU CG C 13 25.965 0.3 A 94 LEU N N 15 120.260 0.3 A 95 ARG H H 1 7.762 0.020 A 95 ARG HA H 1 4.720 0.020 A 95 ARG HBx H 1 1.750 0.020 A 95 ARG HBy H 1 1.855 0.020 A 95 ARG HDx H 1 3.208 0.020 A 95 ARG HDy H 1 3.249 0.020 A 95 ARG HG2 H 1 1.627 0.020 A 95 ARG HG3 H 1 1.627 0.020 A 95 ARG C C 13 175.167 0.3 A 95 ARG CA C 13 54.391 0.3 A 95 ARG CB C 13 33.072 0.3 A 95 ARG CD C 13 43.359 0.3 A 95 ARG CG C 13 26.843 0.3 A 95 ARG N N 15 118.620 0.3 A 96 LYS H H 1 8.906 0.020 A 96 LYS HA H 1 4.425 0.020 A 96 LYS HBx H 1 1.622 0.020 A 96 LYS HBy H 1 1.795 0.020 A 96 LYS HD2 H 1 1.455 0.020 A 96 LYS HD3 H 1 1.455 0.020 A 96 LYS HE2 H 1 2.888 0.020 A 96 LYS HE3 H 1 2.888 0.020 A 96 LYS HGx H 1 1.208 0.020 A 96 LYS HGy H 1 1.304 0.020 A 96 LYS C C 13 176.848 0.3 A 96 LYS CA C 13 56.421 0.3 A 96 LYS CB C 13 32.891 0.3 A 96 LYS CD C 13 28.875 0.3 A 96 LYS CE C 13 42.034 0.3 A 96 LYS CG C 13 25.008 0.3 A 96 LYS N N 15 124.636 0.3 A 97 THR H H 1 8.332 0.020 A 97 THR HA H 1 4.217 0.020 A 97 THR HB H 1 3.989 0.020 A 97 THR HG2% H 1 1.127 0.020 A 97 THR C C 13 174.069 0.3 A 97 THR CA C 13 62.338 0.3 A 97 THR CB C 13 69.524 0.3 A 97 THR CG2 C 13 21.410 0.3 A 97 THR N N 15 118.652 0.3 A 98 ASP H H 1 8.469 0.020 A 98 ASP HA H 1 4.598 0.020 A 98 ASP HBx H 1 2.572 0.020 A 98 ASP HBy H 1 2.647 0.020 A 98 ASP C C 13 175.658 0.3 A 98 ASP CA C 13 54.391 0.3 A 98 ASP CB C 13 41.176 0.3 A 98 ASP N N 15 123.290 0.3 A 99 VAL H H 1 8.002 0.020 A 99 VAL HA H 1 4.377 0.020 A 99 VAL HB H 1 2.036 0.020 A 99 VAL HGx% H 1 0.909 0.020 A 99 VAL HGy% H 1 0.949 0.020 A 99 VAL C C 13 174.309 0.3 A 99 VAL CA C 13 59.890 0.3 A 99 VAL CB C 13 32.676 0.3 A 99 VAL CG1 C 13 20.326 0.3 A 99 VAL CG2 C 13 21.021 0.3 A 99 VAL N N 15 121.863 0.3 A 100 PRO HA H 1 4.415 0.020 A 100 PRO HB2 H 1 2.314 0.020 A 100 PRO HB3 H 1 2.314 0.020 A 100 PRO HDx H 1 3.656 0.020 A 100 PRO HDy H 1 3.832 0.020 A 100 PRO HGx H 1 1.886 0.020 A 100 PRO HGy H 1 1.956 0.020 A 100 PRO C C 13 176.814 0.3 A 100 PRO CA C 13 62.929 0.3 A 100 PRO CB C 13 32.137 0.3 A 100 PRO CD C 13 51.017 0.3 A 100 PRO CG C 13 27.367 0.3 A 101 VAL H H 1 8.245 0.020 A 101 VAL HA H 1 4.045 0.020 A 101 VAL HB H 1 2.038 0.020 A 101 VAL HG1% H 1 0.941 0.020 A 101 VAL C C 13 176.276 0.3 A 101 VAL CA C 13 62.181 0.3 A 101 VAL CB C 13 32.828 0.3 A 101 VAL CG1 C 13 20.944 0.3 A 101 VAL N N 15 120.856 0.3 A 102 GLU H H 1 8.462 0.020 A 102 GLU HA H 1 4.282 0.020 A 102 GLU HBx H 1 1.911 0.020 A 102 GLU HBy H 1 1.997 0.020 A 102 GLU HG2 H 1 2.256 0.020 A 102 GLU HG3 H 1 2.256 0.020 A 102 GLU C C 13 176.036 0.3 A 102 GLU CA C 13 56.364 0.3 A 102 GLU CB C 13 30.461 0.3 A 102 GLU CG C 13 36.130 0.3 A 102 GLU N N 15 124.918 0.3 A 103 GLN H H 1 8.455 0.020 A 103 GLN HA H 1 4.587 0.020 A 103 GLN HBx H 1 1.887 0.020 A 103 GLN HBy H 1 2.039 0.020 A 103 GLN HG2 H 1 2.344 0.020 A 103 GLN HG3 H 1 2.344 0.020 A 103 GLN C C 13 173.920 0.3 A 103 GLN CA C 13 53.453 0.3 A 103 GLN CB C 13 29.024 0.3 A 103 GLN CG C 13 33.373 0.3 A 103 GLN N N 15 122.904 0.3 A 104 PRO HA H 1 4.369 0.020 A 104 PRO HB2 H 1 2.225 0.020 A 104 PRO HB3 H 1 2.225 0.020 A 104 PRO HDx H 1 3.649 0.020 A 104 PRO HDy H 1 3.823 0.020 A 104 PRO HGx H 1 1.782 0.020 A 104 PRO HGy H 1 1.953 0.020 A 104 PRO C C 13 176.402 0.3 A 104 PRO CA C 13 63.206 0.3 A 104 PRO CB C 13 32.017 0.3 A 104 PRO CD C 13 50.976 0.3 A 104 PRO CG C 13 27.302 0.3 A 105 PHE H H 1 8.236 0.020 A 105 PHE HA H 1 4.604 0.020 A 105 PHE HB2 H 1 3.058 0.020 A 105 PHE HB3 H 1 3.058 0.020 A 105 PHE HD1 H 1 7.195 0.020 A 105 PHE HD2 H 1 7.195 0.020 A 105 PHE HE1 H 1 7.288 0.020 A 105 PHE HE2 H 1 7.288 0.020 A 105 PHE HZ H 1 7.283 0.020 A 105 PHE C C 13 175.407 0.3 A 105 PHE CA C 13 57.488 0.3 A 105 PHE CB C 13 39.500 0.3 A 105 PHE CD1 C 13 131.720 0.3 A 105 PHE CE1 C 13 131.620 0.3 A 105 PHE CZ C 13 129.846 0.3 A 105 PHE N N 15 120.322 0.3 A 106 VAL H H 1 7.980 0.020 A 106 VAL HA H 1 4.021 0.020 A 106 VAL HB H 1 1.924 0.020 A 106 VAL HG1% H 1 0.841 0.020 A 106 VAL C C 13 175.258 0.3 A 106 VAL CA C 13 61.946 0.3 A 106 VAL CB C 13 33.022 0.3 A 106 VAL CG1 C 13 20.789 0.3 A 106 VAL N N 15 123.322 0.3 A 107 HIS H H 1 8.455 0.020 A 107 HIS HA H 1 4.639 0.020 A 107 HIS HBx H 1 3.113 0.020 A 107 HIS HBy H 1 3.171 0.020 A 107 HIS HD2 H 1 7.231 0.020 A 107 HIS C C 13 174.560 0.3 A 107 HIS CA C 13 55.277 0.3 A 107 HIS CB C 13 29.760 0.3 A 107 HIS CD2 C 13 120.120 0.3 A 107 HIS N N 15 123.697 0.3 A 108 SER H H 1 8.528 0.020 A 108 SER HA H 1 4.739 0.020 A 108 SER HBx H 1 3.831 0.020 A 108 SER HBy H 1 3.871 0.020 A 108 SER C C 13 172.753 0.3 A 108 SER CA C 13 56.417 0.3 A 108 SER CB C 13 63.170 0.3 A 108 SER N N 15 120.359 0.3 A 109 PRO HA H 1 4.422 0.020 A 109 PRO HB2 H 1 2.285 0.020 A 109 PRO HB3 H 1 2.285 0.020 A 109 PRO HD2 H 1 3.743 0.020 A 109 PRO HD3 H 1 3.743 0.020 A 109 PRO HG2 H 1 2.000 0.020 A 109 PRO HG3 H 1 2.000 0.020 A 109 PRO C C 13 176.859 0.3 A 109 PRO CA C 13 63.417 0.3 A 109 PRO CB C 13 32.077 0.3 A 109 PRO CD C 13 50.766 0.3 A 109 PRO CG C 13 27.433 0.3 A 110 GLU H H 1 8.424 0.020 A 110 GLU HA H 1 4.283 0.020 A 110 GLU HB2 H 1 1.912 0.020 A 110 GLU HB3 H 1 1.912 0.020 A 110 GLU HG2 H 1 2.263 0.020 A 110 GLU HG3 H 1 2.263 0.020 A 110 GLU C C 13 175.430 0.3 A 110 GLU CA C 13 56.233 0.3 A 110 GLU CB C 13 30.304 0.3 A 110 GLU CG C 13 36.543 0.3 A 110 GLU N N 15 120.608 0.3 A 111 ASP H H 1 7.873 0.020 A 111 ASP HA H 1 4.364 0.020 A 111 ASP HBx H 1 2.567 0.020 A 111 ASP HBy H 1 2.672 0.020 A 111 ASP C C 13 180.954 0.3 A 111 ASP CA C 13 55.895 0.3 A 111 ASP CB C 13 42.169 0.3 A 111 ASP N N 15 126.661 0.3 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 noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 23 ASP HA A 25 PRO HA 1.0 . 7.00 2 2 A 28 ASP HA A 29 ILE HA 1.0 . 4.96 3 3 A 25 PRO HA A 30 GLU HA 1.0 . 5.68 4 4 A 33 VAL HA A 36 LEU HA 1.0 . 6.78 5 5 A 35 ALA HA A 38 GLN HBx 1.0 . 3.98 6 6 A 35 ALA HA A 38 GLN HBy 1.0 . 3.98 7 7 A 36 LEU HA A 39 GLN HB2 1.0 . 5.46 8 7 A 36 LEU HA A 39 GLN HB3 1.0 . 5.46 9 8 A 37 TRP HA A 40 LEU HBy 1.0 . 5.13 10 9 A 37 TRP HA A 40 LEU HBx 1.0 . 5.13 11 10 A 24 LEU HA A 47 THR HA 1.0 . 4.25 12 11 A 48 ARG HA A 87 LEU HA 1.0 . 5.46 13 12 A 51 ASP HA A 86 ARG HA 1.0 . 3.92 14 13 A 52 PHE HA A 53 PHE HA 1.0 . 5.51 15 14 A 51 ASP HA A 54 GLN HBx 1.0 . 5.79 16 15 A 51 ASP HA A 54 GLN HBy 1.0 . 5.79 17 16 A 53 PHE HA A 58 ASP HA 1.0 . 7.00 18 17 A 58 ASP HA A 59 SER HA 1.0 . 6.23 19 18 A 60 LEU HA A 63 THR HB 1.0 . 4.03 20 19 A 61 LEU HA A 64 ARG HB2 1.0 . 5.46 21 19 A 61 LEU HA A 64 ARG HB3 1.0 . 5.46 22 20 A 61 LEU HA A 62 ALA HA 1.0 . 5.57 23 21 A 62 ALA HA A 65 LEU HA 1.0 . 6.72 24 22 A 66 THR HA A 77 GLN HA 1.0 . 6.45 25 23 A 67 GLY HAy A 70 HIS HBx 1.0 . 5.84 26 24 A 67 GLY HAy A 70 HIS HBy 1.0 . 5.84 27 25 A 70 HIS HBx A 67 GLY HAx 1.0 . 5.84 28 26 A 74 TYR HA A 96 LYS HA 1.0 . 4.08 29 27 A 77 GLN HA A 78 LEU HA 1.0 . 6.56 30 28 A 77 GLN HA A 78 LEU HB2 1.0 . 7.50 31 28 A 77 GLN HA A 78 LEU HB3 1.0 . 7.50 32 29 A 80 ASP HA A 83 ASN HBx 1.0 . 5.35 33 30 A 80 ASP HA A 83 ASN HBy 1.0 . 5.35 34 31 A 81 LEU HA A 85 PRO HA 1.0 . 6.01 35 32 A 87 LEU HA A 86 ARG HA 1.0 . 6.95 36 33 A 87 LEU HA A 90 PHE HA 1.0 . 6.40 37 34 A 30 GLU HA A 88 ALA HA 1.0 . 5.79 38 35 A 90 PHE HA A 84 HIS HA 1.0 . 6.50 39 36 A 76 ALA HA A 94 LEU HA 1.0 . 4.96 40 37 A 3 ILE HB A 5 TYR HD% 1.0 . 9.13 41 38 A 3 ILE HB A 5 TYR HE% 1.0 . 9.13 42 39 A 5 TYR HD% A 5 TYR HA 1.0 . 9.13 43 40 A 9 LYS HE3 A 9 LYS HBx 1.0 . 7.88 44 40 A 9 LYS HBx A 9 LYS HE2 1.0 . 7.88 45 41 A 9 LYS HE3 A 9 LYS HBy 1.0 . 7.88 46 41 A 9 LYS HBy A 9 LYS HE2 1.0 . 7.88 47 42 A 9 LYS HA A 9 LYS HD2 1.0 . 7.11 48 42 A 9 LYS HA A 9 LYS HD3 1.0 . 7.11 49 43 A 10 ARG HA A 10 ARG HD2 1.0 . 7.88 50 43 A 10 ARG HA A 10 ARG HD3 1.0 . 7.88 51 44 A 12 HIS HA A 12 HIS HD2 1.0 . 7.00 52 45 A 23 ASP HA A 48 ARG HD2 1.0 . 6.62 53 45 A 23 ASP HA A 48 ARG HD3 1.0 . 6.62 54 46 A 25 PRO HA A 47 THR HB 1.0 . 7.00 55 47 A 25 PRO HA A 48 ARG HD2 1.0 . 7.00 56 47 A 25 PRO HA A 48 ARG HD3 1.0 . 7.00 57 48 A 26 GLN HG2 A 48 ARG HD2 1.0 . 8.76 58 48 A 26 GLN HG3 A 48 ARG HD2 1.0 . 8.76 59 48 A 48 ARG HD3 A 26 GLN HG2 1.0 . 8.76 60 48 A 48 ARG HD3 A 26 GLN HG3 1.0 . 8.76 61 49 A 28 ASP HA A 31 LYS HE2 1.0 . 7.88 62 49 A 28 ASP HA A 31 LYS HE3 1.0 . 7.88 63 50 A 29 ILE HA A 74 TYR HD% 1.0 . 9.13 64 51 A 74 TYR HD% A 29 ILE HG12 1.0 . 10.01 65 51 A 74 TYR HD% A 29 ILE HG13 1.0 . 10.01 66 52 A 31 LYS HB3 A 31 LYS HE2 1.0 . 8.76 67 52 A 31 LYS HB2 A 31 LYS HE2 1.0 . 8.76 68 52 A 31 LYS HE3 A 31 LYS HB2 1.0 . 8.76 69 52 A 31 LYS HE3 A 31 LYS HB3 1.0 . 8.76 70 53 A 31 LYS HA A 31 LYS HE2 1.0 . 7.88 71 53 A 31 LYS HE3 A 31 LYS HA 1.0 . 7.88 72 54 A 74 TYR HE% A 32 GLN HBx 1.0 . 9.13 73 55 A 74 TYR HE% A 32 GLN HBy 1.0 . 9.13 74 56 A 74 TYR HE% A 32 GLN HGy 1.0 . 9.13 75 57 A 33 VAL HA A 90 PHE HD% 1.0 . 9.13 76 58 A 34 ALA HA A 37 TRP HZ3 1.0 . 7.00 77 59 A 35 ALA HA A 38 GLN HGy 1.0 . 6.67 78 60 A 33 VAL HA A 36 LEU HG 1.0 . 6.29 79 61 A 37 TRP HA A 40 LEU HG 1.0 . 7.00 80 62 A 37 TRP HA A 52 PHE HE% 1.0 . 9.13 81 63 A 34 ALA HA A 37 TRP HD1 1.0 . 7.00 82 64 A 37 TRP HD1 A 36 LEU HBx 1.0 . 7.00 83 65 A 37 TRP HD1 A 36 LEU HBy 1.0 . 7.00 84 66 A 36 LEU HG A 37 TRP HD1 1.0 . 7.00 85 67 A 37 TRP HA A 37 TRP HD1 1.0 . 5.84 86 68 A 65 LEU HA A 37 TRP HD1 1.0 . 7.00 87 69 A 37 TRP HE3 A 50 THR HA 1.0 . 7.00 88 70 A 37 TRP HE3 A 50 THR HB 1.0 . 6.72 89 71 A 37 TRP HE3 A 52 PHE HBx 1.0 . 7.00 90 72 A 37 TRP HE3 A 52 PHE HBy 1.0 . 7.00 91 73 A 86 ARG HA A 37 TRP HE3 1.0 . 7.00 92 74 A 87 LEU HA A 37 TRP HE3 1.0 . 7.00 93 75 A 37 TRP HE3 A 87 LEU HBy 1.0 . 7.00 94 76 A 37 TRP HE3 A 87 LEU HG 1.0 . 7.00 95 77 A 52 PHE HA A 37 TRP HZ2 1.0 . 7.00 96 78 A 37 TRP HZ2 A 52 PHE HBy 1.0 . 7.00 97 79 A 37 TRP HZ2 A 52 PHE HD% 1.0 . 9.13 98 80 A 87 LEU HA A 37 TRP HZ2 1.0 . 7.00 99 81 A 37 TRP HZ2 A 90 PHE HBx 1.0 . 7.00 100 82 A 37 TRP HZ2 A 90 PHE HBy 1.0 . 7.00 101 83 A 90 PHE HD% A 37 TRP HZ2 1.0 . 9.13 102 84 A 37 TRP HZ3 A 50 THR HB 1.0 . 7.00 103 85 A 52 PHE HA A 37 TRP HZ3 1.0 . 7.00 104 86 A 37 TRP HZ3 A 52 PHE HD% 1.0 . 9.13 105 87 A 87 LEU HA A 37 TRP HZ3 1.0 . 7.00 106 88 A 37 TRP HZ3 A 87 LEU HBx 1.0 . 7.00 107 89 A 37 TRP HZ3 A 87 LEU HBy 1.0 . 7.00 108 90 A 51 ASP HA A 37 TRP HH2 1.0 . 7.00 109 91 A 52 PHE HA A 37 TRP HH2 1.0 . 7.00 110 92 A 87 LEU HA A 37 TRP HH2 1.0 . 6.67 111 93 A 37 TRP HH2 A 87 LEU HBx 1.0 . 7.00 112 94 A 35 ALA HA A 38 GLN HGx 1.0 . 6.67 113 95 A 38 GLN HGx A 44 GLY HAy 1.0 . 7.00 114 96 A 38 GLN HGy A 44 GLY HAy 1.0 . 7.00 115 97 A 41 LEU HG A 43 THR HB 1.0 . 7.00 116 98 A 43 THR HB A 55 GLN HBx 1.0 . 7.00 117 99 A 43 THR HB A 55 GLN HBy 1.0 . 7.00 118 100 A 43 THR HB A 55 GLN HG2 1.0 . 6.29 119 100 A 43 THR HB A 55 GLN HG3 1.0 . 6.29 120 101 A 34 ALA HA A 46 VAL HB 1.0 . 7.00 121 102 A 24 LEU HA A 47 THR HB 1.0 . 5.40 122 103 A 48 ARG HA A 48 ARG HD2 1.0 . 7.88 123 103 A 48 ARG HA A 48 ARG HD3 1.0 . 7.88 124 104 A 49 GLU HA A 86 ARG HDx 1.0 . 5.74 125 105 A 49 GLU HA A 86 ARG HDy 1.0 . 5.74 126 106 A 49 GLU HGy A 86 ARG HDx 1.0 . 7.00 127 107 A 49 GLU HGy A 86 ARG HDy 1.0 . 7.00 128 108 A 37 TRP HZ3 A 50 THR HA 1.0 . 7.00 129 109 A 50 THR HB A 87 LEU HG 1.0 . 7.00 130 110 A 51 ASP HA A 37 TRP HE3 1.0 . 7.00 131 111 A 86 ARG HDx A 51 ASP HBy 1.0 . 7.00 132 112 A 52 PHE HA A 37 TRP HE3 1.0 . 7.00 133 113 A 52 PHE HA A 52 PHE HD% 1.0 . 9.02 134 114 A 37 TRP HZ2 A 52 PHE HBx 1.0 . 7.00 135 115 A 37 TRP HH2 A 52 PHE HBx 1.0 . 7.00 136 116 A 53 PHE HD% A 52 PHE HBx 1.0 . 9.13 137 117 A 53 PHE HE% A 52 PHE HBx 1.0 . 9.13 138 118 A 37 TRP HH2 A 52 PHE HBy 1.0 . 7.00 139 119 A 37 TRP HD1 A 52 PHE HD% 1.0 . 9.13 140 120 A 52 PHE HD% A 37 TRP HH2 1.0 . 9.13 141 121 A 52 PHE HD% A 53 PHE HD% 1.0 . 11.26 142 122 A 52 PHE HD% A 57 GLY HAy 1.0 . 9.13 143 123 A 62 ALA HA A 52 PHE HD% 1.0 . 9.13 144 124 A 52 PHE HE% A 37 TRP HD1 1.0 . 9.13 145 125 A 53 PHE HA A 52 PHE HE% 1.0 . 9.13 146 126 A 52 PHE HE% A 53 PHE HD% 1.0 . 11.26 147 127 A 52 PHE HE% A 53 PHE HE% 1.0 . 11.26 148 128 A 52 PHE HE% A 57 GLY HAx 1.0 . 9.13 149 129 A 65 LEU HA A 52 PHE HE% 1.0 . 9.13 150 130 A 52 PHE HZ A 57 GLY HAy 1.0 . 7.00 151 131 A 52 PHE HZ A 61 LEU HBy 1.0 . 6.62 152 132 A 62 ALA HA A 52 PHE HZ 1.0 . 6.40 153 133 A 53 PHE HA A 53 PHE HD% 1.0 . 8.85 154 134 A 53 PHE HD% A 85 PRO HB2 1.0 . 10.01 155 134 A 53 PHE HD% A 85 PRO HB3 1.0 . 10.01 156 135 A 52 PHE HD% A 53 PHE HE% 1.0 . 11.26 157 136 A 58 ASP HA A 53 PHE HE% 1.0 . 9.13 158 137 A 52 PHE HD% A 53 PHE HZ 1.0 . 9.13 159 138 A 58 ASP HA A 53 PHE HZ 1.0 . 7.00 160 139 A 53 PHE HZ A 81 LEU HG 1.0 . 7.00 161 140 A 53 PHE HZ A 82 PHE HA 1.0 . 7.00 162 141 A 43 THR HA A 55 GLN HG2 1.0 . 7.88 163 141 A 55 GLN HG3 A 43 THR HA 1.0 . 7.88 164 142 A 52 PHE HD% A 57 GLY HAx 1.0 . 9.13 165 143 A 52 PHE HZ A 57 GLY HAx 1.0 . 7.00 166 144 A 52 PHE HE% A 57 GLY HAy 1.0 . 9.13 167 145 A 53 PHE HD% A 57 GLY HAy 1.0 . 9.13 168 146 A 58 ASP HA A 52 PHE HE% 1.0 . 9.13 169 147 A 58 ASP HA A 53 PHE HD% 1.0 . 9.13 170 148 A 59 SER HA A 53 PHE HE% 1.0 . 9.13 171 149 A 59 SER HA A 82 PHE HD% 1.0 . 7.92 172 150 A 59 SER HA A 82 PHE HE% 1.0 . 9.13 173 151 A 53 PHE HD% A 59 SER HB2 1.0 . 10.01 174 151 A 53 PHE HD% A 59 SER HB3 1.0 . 10.01 175 152 A 53 PHE HE% A 59 SER HB2 1.0 . 10.01 176 152 A 53 PHE HE% A 59 SER HB3 1.0 . 10.01 177 153 A 53 PHE HZ A 59 SER HB2 1.0 . 7.88 178 153 A 53 PHE HZ A 59 SER HB3 1.0 . 7.88 179 154 A 82 PHE HD% A 59 SER HB2 1.0 . 10.01 180 154 A 82 PHE HD% A 59 SER HB3 1.0 . 10.01 181 155 A 61 LEU HA A 64 ARG HD2 1.0 . 7.88 182 155 A 61 LEU HA A 64 ARG HD3 1.0 . 7.88 183 156 A 52 PHE HE% A 61 LEU HBx 1.0 . 9.13 184 157 A 52 PHE HZ A 61 LEU HBx 1.0 . 6.62 185 158 A 52 PHE HE% A 61 LEU HG 1.0 . 9.13 186 159 A 52 PHE HZ A 61 LEU HG 1.0 . 7.00 187 160 A 62 ALA HA A 52 PHE HE% 1.0 . 9.13 188 161 A 64 ARG HA A 64 ARG HD2 1.0 . 7.55 189 161 A 64 ARG HD3 A 64 ARG HA 1.0 . 7.55 190 162 A 65 LEU HA A 52 PHE HZ 1.0 . 7.00 191 163 A 62 ALA HA A 65 LEU HG 1.0 . 6.07 192 164 A 65 LEU HA A 65 LEU HG 1.0 . 3.48 193 165 A 66 THR HB A 69 LEU HBy 1.0 . 6.50 194 166 A 66 THR HB A 69 LEU HG 1.0 . 7.00 195 167 A 66 THR HB A 70 HIS HE1 1.0 . 7.00 196 168 A 74 TYR HE% A 69 LEU HA 1.0 . 9.13 197 169 A 66 THR HB A 69 LEU HBx 1.0 . 6.50 198 170 A 70 HIS HD2 A 69 LEU HBx 1.0 . 7.00 199 171 A 70 HIS HD2 A 69 LEU HBy 1.0 . 7.00 200 172 A 69 LEU HG A 69 LEU HA 1.0 . 3.65 201 173 A 70 HIS HD2 A 70 HIS HA 1.0 . 6.17 202 174 A 66 THR HA A 70 HIS HD2 1.0 . 7.00 203 175 A 66 THR HB A 70 HIS HD2 1.0 . 7.00 204 176 A 70 HIS HD2 A 71 GLN HB2 1.0 . 7.88 205 176 A 70 HIS HD2 A 71 GLN HB3 1.0 . 7.88 206 177 A 70 HIS HD2 A 75 GLU HA 1.0 . 7.00 207 178 A 66 THR HA A 70 HIS HE1 1.0 . 7.00 208 179 A 70 HIS HE1 A 75 GLU HA 1.0 . 7.00 209 180 A 70 HIS HD2 A 71 GLN HA 1.0 . 7.00 210 181 A 70 HIS HD2 A 71 GLN HGx 1.0 . 7.00 211 182 A 74 TYR HD% A 72 ALA HA 1.0 . 9.13 212 183 A 74 TYR HA A 96 LYS HBx 1.0 . 7.00 213 184 A 74 TYR HA A 96 LYS HD2 1.0 . 7.88 214 184 A 74 TYR HA A 96 LYS HD3 1.0 . 7.88 215 185 A 74 TYR HA A 96 LYS HE2 1.0 . 7.88 216 185 A 74 TYR HA A 96 LYS HE3 1.0 . 7.88 217 186 A 74 TYR HD% A 69 LEU HA 1.0 . 9.13 218 187 A 74 TYR HD% A 69 LEU HBx 1.0 . 9.13 219 188 A 74 TYR HD% A 69 LEU HBy 1.0 . 9.13 220 189 A 74 TYR HA A 74 TYR HD% 1.0 . 9.02 221 190 A 94 LEU HA A 74 TYR HD% 1.0 . 9.13 222 191 A 74 TYR HD% A 94 LEU HBy 1.0 . 9.13 223 192 A 96 LYS HA A 74 TYR HD% 1.0 . 9.13 224 193 A 74 TYR HD% A 96 LYS HBx 1.0 . 9.13 225 194 A 74 TYR HD% A 96 LYS HGx 1.0 . 9.13 226 195 A 74 TYR HD% A 96 LYS HE2 1.0 . 10.01 227 195 A 74 TYR HD% A 96 LYS HE3 1.0 . 10.01 228 196 A 29 ILE HA A 74 TYR HE% 1.0 . 9.13 229 197 A 74 TYR HE% A 29 ILE HB 1.0 . 9.13 230 198 A 74 TYR HE% A 29 ILE HG12 1.0 . 10.01 231 198 A 29 ILE HG13 A 74 TYR HE% 1.0 . 10.01 232 199 A 74 TYR HE% A 32 GLN HGx 1.0 . 9.13 233 200 A 74 TYR HE% A 72 ALA HA 1.0 . 9.13 234 201 A 94 LEU HA A 74 TYR HE% 1.0 . 9.13 235 202 A 74 TYR HE% A 94 LEU HBy 1.0 . 9.13 236 203 A 74 TYR HE% A 96 LYS HBx 1.0 . 9.13 237 204 A 74 TYR HE% A 96 LYS HGx 1.0 . 9.13 238 205 A 74 TYR HE% A 96 LYS HGy 1.0 . 9.13 239 206 A 74 TYR HE% A 96 LYS HD2 1.0 . 10.02 240 206 A 74 TYR HE% A 96 LYS HD3 1.0 . 10.02 241 207 A 97 THR HB A 75 GLU HGx 1.0 . 7.00 242 208 A 97 THR HB A 75 GLU HGy 1.0 . 7.00 243 209 A 76 ALA HA A 70 HIS HD2 1.0 . 7.00 244 210 A 76 ALA HA A 77 GLN HGy 1.0 . 7.00 245 211 A 77 GLN HA A 70 HIS HE1 1.0 . 7.00 246 212 A 76 ALA HA A 77 GLN HGx 1.0 . 7.00 247 213 A 82 PHE HE% A 78 LEU HB2 1.0 . 10.01 248 213 A 78 LEU HB3 A 82 PHE HE% 1.0 . 10.01 249 214 A 82 PHE HD% A 78 LEU HG 1.0 . 9.02 250 215 A 82 PHE HE% A 78 LEU HG 1.0 . 9.13 251 216 A 80 ASP HA A 84 HIS HD2 1.0 . 5.79 252 217 A 80 ASP HA A 84 HIS HE1 1.0 . 7.00 253 218 A 80 ASP HA A 90 PHE HD% 1.0 . 9.13 254 219 A 77 GLN HBx A 80 ASP HBx 1.0 . 7.00 255 220 A 77 GLN HBx A 80 ASP HBy 1.0 . 7.00 256 221 A 77 GLN HBy A 80 ASP HBy 1.0 . 7.00 257 222 A 84 HIS HD2 A 80 ASP HBy 1.0 . 7.00 258 223 A 93 THR HB A 80 ASP HBy 1.0 . 7.00 259 224 A 53 PHE HD% A 81 LEU HG 1.0 . 9.13 260 225 A 53 PHE HE% A 81 LEU HG 1.0 . 9.13 261 226 A 53 PHE HD% A 82 PHE HA 1.0 . 9.13 262 227 A 53 PHE HE% A 82 PHE HA 1.0 . 8.86 263 228 A 81 LEU HG A 82 PHE HA 1.0 . 7.00 264 229 A 82 PHE HA A 82 PHE HD% 1.0 . 8.19 265 230 A 53 PHE HZ A 82 PHE HD% 1.0 . 9.13 266 231 A 78 LEU HA A 82 PHE HD% 1.0 . 9.13 267 232 A 82 PHE HD% A 78 LEU HB2 1.0 . 10.01 268 232 A 78 LEU HB3 A 82 PHE HD% 1.0 . 10.01 269 233 A 53 PHE HZ A 82 PHE HE% 1.0 . 9.13 270 234 A 82 PHE HE% A 59 SER HB2 1.0 . 10.01 271 234 A 82 PHE HE% A 59 SER HB3 1.0 . 10.01 272 235 A 84 HIS HE1 A 83 ASN HBx 1.0 . 7.00 273 236 A 84 HIS HE1 A 83 ASN HBy 1.0 . 7.00 274 237 A 84 HIS HA A 84 HIS HD2 1.0 . 7.00 275 238 A 90 PHE HA A 84 HIS HBx 1.0 . 7.00 276 239 A 90 PHE HA A 84 HIS HBy 1.0 . 7.00 277 240 A 84 HIS HD2 A 80 ASP HBx 1.0 . 7.00 278 241 A 84 HIS HD2 A 83 ASN HA 1.0 . 7.00 279 242 A 85 PRO HA A 37 TRP HZ2 1.0 . 7.00 280 243 A 85 PRO HA A 37 TRP HH2 1.0 . 7.00 281 244 A 85 PRO HA A 81 LEU HG 1.0 . 7.00 282 245 A 53 PHE HE% A 85 PRO HB2 1.0 . 10.02 283 245 A 53 PHE HE% A 85 PRO HB3 1.0 . 10.02 284 246 A 53 PHE HD% A 85 PRO HGx 1.0 . 9.13 285 247 A 53 PHE HE% A 85 PRO HGx 1.0 . 9.13 286 248 A 53 PHE HD% A 85 PRO HGy 1.0 . 9.13 287 249 A 53 PHE HD% A 85 PRO HDx 1.0 . 9.13 288 250 A 86 ARG HA A 37 TRP HH2 1.0 . 7.00 289 251 A 86 ARG HA A 51 ASP HBx 1.0 . 7.00 290 252 A 86 ARG HA A 51 ASP HBy 1.0 . 7.00 291 253 A 86 ARG HA A 86 ARG HDy 1.0 . 7.00 292 254 A 86 ARG HA A 86 ARG HDx 1.0 . 7.00 293 255 A 51 ASP HA A 86 ARG HDy 1.0 . 7.00 294 256 A 51 ASP HBx A 86 ARG HDy 1.0 . 7.00 295 257 A 37 TRP HE3 A 87 LEU HBx 1.0 . 7.00 296 258 A 37 TRP HH2 A 87 LEU HBy 1.0 . 7.00 297 259 A 87 LEU HG A 37 TRP HZ2 1.0 . 7.00 298 260 A 87 LEU HG A 37 TRP HH2 1.0 . 7.00 299 261 A 48 ARG HA A 87 LEU HG 1.0 . 7.00 300 262 A 90 PHE HA A 37 TRP HZ2 1.0 . 7.00 301 263 A 90 PHE HA A 84 HIS HD2 1.0 . 7.00 302 264 A 90 PHE HD% A 37 TRP HH2 1.0 . 9.13 303 265 A 90 PHE HD% A 66 THR HB 1.0 . 9.13 304 266 A 90 PHE HD% A 80 ASP HBx 1.0 . 9.13 305 267 A 81 LEU HA A 90 PHE HD% 1.0 . 8.47 306 268 A 90 PHE HD% A 81 LEU HG 1.0 . 9.13 307 269 A 87 LEU HA A 90 PHE HD% 1.0 . 9.13 308 270 A 90 PHE HA A 90 PHE HD% 1.0 . 8.19 309 271 A 90 PHE HD% A 91 ALA HA 1.0 . 9.13 310 272 A 66 THR HB A 90 PHE HE% 1.0 . 9.13 311 273 A 76 ALA HA A 90 PHE HE% 1.0 . 9.13 312 274 A 93 THR HB A 80 ASP HBx 1.0 . 7.00 313 275 A 84 HIS HD2 A 93 THR HB 1.0 . 7.00 314 276 A 90 PHE HD% A 93 THR HB 1.0 . 9.13 315 277 A 74 TYR HD% A 94 LEU HBx 1.0 . 9.13 316 278 A 74 TYR HD% A 95 ARG HA 1.0 . 9.13 317 279 A 74 TYR HE% A 95 ARG HA 1.0 . 9.13 318 280 A 96 LYS HA A 74 TYR HE% 1.0 . 9.13 319 281 A 96 LYS HA A 96 LYS HD2 1.0 . 6.51 320 281 A 96 LYS HA A 96 LYS HD3 1.0 . 6.51 321 282 A 74 TYR HA A 96 LYS HBy 1.0 . 7.00 322 283 A 74 TYR HD% A 96 LYS HBy 1.0 . 9.13 323 284 A 74 TYR HE% A 96 LYS HBy 1.0 . 9.13 324 285 A 74 TYR HA A 96 LYS HGx 1.0 . 7.00 325 286 A 74 TYR HA A 96 LYS HGy 1.0 . 7.00 326 287 A 74 TYR HD% A 96 LYS HGy 1.0 . 9.13 327 288 A 74 TYR HD% A 96 LYS HD2 1.0 . 10.01 328 288 A 74 TYR HD% A 96 LYS HD3 1.0 . 10.01 329 289 A 74 TYR HE% A 96 LYS HE2 1.0 . 10.02 330 289 A 74 TYR HE% A 96 LYS HE3 1.0 . 10.02 331 290 A 105 PHE HA A 105 PHE HD% 1.0 . 9.13 332 291 A 107 HIS HA A 107 HIS HD2 1.0 . 7.00 333 292 A 3 ILE HA A 3 ILE HD1% 1.0 . 8.02 334 293 A 3 ILE HD1% A 3 ILE HG2% 1.0 . 7.39 335 294 A 5 TYR HD% A 3 ILE HD1% 1.0 . 10.15 336 295 A 3 ILE HG2% A 4 ASP HA 1.0 . 8.02 337 296 A 5 TYR HA A 3 ILE HG2% 1.0 . 8.02 338 297 A 5 TYR HD% A 3 ILE HG2% 1.0 . 10.15 339 298 A 5 TYR HE% A 3 ILE HG2% 1.0 . 10.15 340 299 A 8 LEU HA A 8 LEU HDx% 1.0 . 6.04 341 300 A 23 ASP HA A 22 ALA HB% 1.0 . 6.81 342 301 A 47 THR HB A 22 ALA HB% 1.0 . 7.80 343 302 A 23 ASP HA A 47 THR HG2% 1.0 . 7.52 344 303 A 24 LEU HA A 24 LEU HDx% 1.0 . 5.93 345 304 A 24 LEU HA A 24 LEU HDy% 1.0 . 5.93 346 305 A 24 LEU HDy% A 25 PRO HDx 1.0 . 6.31 347 306 A 24 LEU HDy% A 25 PRO HDy 1.0 . 6.31 348 307 A 87 LEU HDy% A 25 PRO HBy 1.0 . 5.93 349 308 A 25 PRO HBx A 87 LEU HDx% 1.0 . 5.93 350 309 A 87 LEU HDy% A 25 PRO HBx 1.0 . 5.93 351 310 A 24 LEU HDx% A 25 PRO HDx 1.0 . 6.31 352 311 A 25 PRO HDx A 87 LEU HDx% 1.0 . 8.02 353 312 A 25 PRO HDy A 24 LEU HDx% 1.0 . 6.31 354 313 A 25 PRO HDy A 87 LEU HDy% 1.0 . 8.02 355 314 A 29 ILE HA A 29 ILE HD1% 1.0 . 6.54 356 315 A 29 ILE HA A 94 LEU HDx% 1.0 . 8.02 357 316 A 29 ILE HA A 94 LEU HDy% 1.0 . 8.02 358 317 A 74 TYR HD% A 29 ILE HG2% 1.0 . 9.82 359 318 A 74 TYR HE% A 29 ILE HG2% 1.0 . 9.22 360 319 A 91 ALA HA A 29 ILE HG2% 1.0 . 6.81 361 320 A 29 ILE HG2% A 91 ALA HB% 1.0 . 7.50 362 321 A 29 ILE HG2% A 94 LEU HDx% 1.0 . 7.50 363 322 A 29 ILE HG2% A 94 LEU HDy% 1.0 . 7.50 364 323 A 95 ARG HA A 29 ILE HG2% 1.0 . 8.02 365 324 A 96 LYS HA A 29 ILE HG2% 1.0 . 8.02 366 325 A 29 ILE HD1% A 29 ILE HG2% 1.0 . 7.11 367 326 A 29 ILE HD1% A 72 ALA HB% 1.0 . 6.95 368 327 A 74 TYR HE% A 29 ILE HD1% 1.0 . 9.38 369 328 A 29 ILE HD1% A 94 LEU HDx% 1.0 . 9.04 370 329 A 29 ILE HD1% A 94 LEU HDy% 1.0 . 9.04 371 330 A 29 ILE HD1% A 96 LYS HE2 1.0 . 8.90 372 330 A 96 LYS HE3 A 29 ILE HD1% 1.0 . 8.90 373 331 A 30 GLU HA A 29 ILE HG2% 1.0 . 7.30 374 332 A 30 GLU HA A 87 LEU HDx% 1.0 . 6.75 375 333 A 30 GLU HA A 87 LEU HDy% 1.0 . 6.75 376 334 A 30 GLU HA A 91 ALA HB% 1.0 . 5.43 377 335 A 31 LYS HA A 34 ALA HB% 1.0 . 6.42 378 336 A 31 LYS HA A 87 LEU HDx% 1.0 . 8.02 379 337 A 32 GLN HA A 35 ALA HB% 1.0 . 5.54 380 338 A 32 GLN HGy A 33 VAL HGy% 1.0 . 8.02 381 339 A 33 VAL HA A 36 LEU HDx% 1.0 . 6.31 382 340 A 33 VAL HA A 65 LEU HDx% 1.0 . 8.02 383 341 A 33 VAL HA A 65 LEU HDy% 1.0 . 8.02 384 342 A 33 VAL HB A 87 LEU HDy% 1.0 . 4.94 385 343 A 32 GLN HGx A 33 VAL HGx% 1.0 . 8.02 386 344 A 33 VAL HGx% A 32 GLN HGy 1.0 . 8.02 387 345 A 90 PHE HD% A 33 VAL HGx% 1.0 . 9.65 388 346 A 37 TRP HD1 A 33 VAL HGy% 1.0 . 8.02 389 347 A 34 ALA HA A 87 LEU HDx% 1.0 . 6.81 390 348 A 47 THR HB A 34 ALA HB% 1.0 . 8.02 391 349 A 33 VAL HA A 35 ALA HB% 1.0 . 7.47 392 350 A 36 LEU HA A 36 LEU HDx% 1.0 . 5.27 393 351 A 33 VAL HA A 36 LEU HDy% 1.0 . 6.31 394 352 A 36 LEU HA A 36 LEU HDy% 1.0 . 5.27 395 353 A 37 TRP HD1 A 36 LEU HDy% 1.0 . 7.96 396 354 A 37 TRP HA A 41 LEU HDx% 1.0 . 7.96 397 355 A 37 TRP HA A 41 LEU HDy% 1.0 . 7.96 398 356 A 37 TRP HD1 A 33 VAL HGx% 1.0 . 8.02 399 357 A 37 TRP HE3 A 46 VAL HGy% 1.0 . 8.02 400 358 A 37 TRP HZ2 A 33 VAL HGx% 1.0 . 8.02 401 359 A 37 TRP HZ2 A 33 VAL HGy% 1.0 . 8.02 402 360 A 37 TRP HZ2 A 50 THR HG2% 1.0 . 8.02 403 361 A 37 TRP HZ2 A 87 LEU HDy% 1.0 . 8.02 404 362 A 37 TRP HH2 A 50 THR HG2% 1.0 . 8.02 405 363 A 37 TRP HH2 A 81 LEU HDy% 1.0 . 8.02 406 364 A 37 TRP HH2 A 87 LEU HDy% 1.0 . 8.02 407 365 A 38 GLN HA A 41 LEU HDy% 1.0 . 8.02 408 366 A 38 GLN HA A 43 THR HG2% 1.0 . 5.82 409 367 A 46 VAL HGx% A 38 GLN HGx 1.0 . 6.92 410 368 A 38 GLN HGx A 46 VAL HGy% 1.0 . 6.92 411 369 A 40 LEU HA A 40 LEU HDx% 1.0 . 5.38 412 370 A 40 LEU HBy A 41 LEU HDx% 1.0 . 7.30 413 371 A 40 LEU HBx A 41 LEU HDx% 1.0 . 7.30 414 372 A 41 LEU HDy% A 40 LEU HBx 1.0 . 7.30 415 373 A 52 PHE HD% A 40 LEU HDx% 1.0 . 10.15 416 374 A 52 PHE HZ A 40 LEU HDx% 1.0 . 7.91 417 375 A 41 LEU HA A 41 LEU HDy% 1.0 . 6.53 418 376 A 38 GLN HA A 41 LEU HDx% 1.0 . 8.02 419 377 A 41 LEU HA A 41 LEU HDx% 1.0 . 6.53 420 378 A 43 THR HG2% A 41 LEU HDx% 1.0 . 9.04 421 379 A 52 PHE HD% A 41 LEU HDx% 1.0 . 10.15 422 380 A 52 PHE HE% A 41 LEU HDx% 1.0 . 10.15 423 381 A 55 GLN HA A 41 LEU HDx% 1.0 . 7.08 424 382 A 55 GLN HBx A 41 LEU HDx% 1.0 . 6.86 425 383 A 41 LEU HDx% A 55 GLN HBy 1.0 . 6.86 426 384 A 55 GLN HG3 A 41 LEU HDx% 1.0 . 8.90 427 384 A 41 LEU HDx% A 55 GLN HG2 1.0 . 8.90 428 385 A 41 LEU HDx% A 56 GLY HAy 1.0 . 8.02 429 386 A 41 LEU HDy% A 40 LEU HBy 1.0 . 7.30 430 387 A 43 THR HB A 41 LEU HDy% 1.0 . 8.02 431 388 A 43 THR HG2% A 41 LEU HDy% 1.0 . 9.04 432 389 A 52 PHE HZ A 41 LEU HDy% 1.0 . 8.02 433 390 A 41 LEU HDy% A 55 GLN HBx 1.0 . 6.86 434 391 A 41 LEU HDy% A 55 GLN HBy 1.0 . 6.86 435 392 A 55 GLN HG3 A 41 LEU HDy% 1.0 . 8.90 436 392 A 41 LEU HDy% A 55 GLN HG2 1.0 . 8.90 437 393 A 41 LEU HDy% A 56 GLY HAy 1.0 . 8.02 438 394 A 41 LEU HDy% A 57 GLY HAx 1.0 . 8.02 439 395 A 43 THR HB A 41 LEU HDx% 1.0 . 8.02 440 396 A 43 THR HG2% A 41 LEU HB2 1.0 . 7.03 441 396 A 43 THR HG2% A 41 LEU HB3 1.0 . 7.03 442 397 A 43 THR HG2% A 55 GLN HG2 1.0 . 7.64 443 397 A 55 GLN HG3 A 43 THR HG2% 1.0 . 7.64 444 398 A 43 THR HG2% A 44 GLY HAx 1.0 . 8.02 445 399 A 46 VAL HA A 87 LEU HDx% 1.0 . 8.02 446 400 A 46 VAL HA A 87 LEU HDy% 1.0 . 8.02 447 401 A 38 GLN HGy A 46 VAL HGy% 1.0 . 6.92 448 402 A 46 VAL HGy% A 87 LEU HDx% 1.0 . 9.04 449 403 A 47 THR HA A 34 ALA HB% 1.0 . 7.63 450 404 A 47 THR HA A 87 LEU HDx% 1.0 . 8.02 451 405 A 47 THR HA A 87 LEU HDy% 1.0 . 8.02 452 406 A 47 THR HG2% A 23 ASP HBx 1.0 . 6.31 453 407 A 47 THR HG2% A 23 ASP HBy 1.0 . 6.31 454 408 A 24 LEU HA A 47 THR HG2% 1.0 . 4.17 455 409 A 48 ARG HA A 87 LEU HDx% 1.0 . 6.70 456 410 A 48 ARG HA A 87 LEU HDy% 1.0 . 6.70 457 411 A 48 ARG HA A 88 ALA HB% 1.0 . 5.93 458 412 A 37 TRP HE3 A 50 THR HG2% 1.0 . 5.60 459 413 A 37 TRP HZ3 A 50 THR HG2% 1.0 . 5.65 460 414 A 50 THR HG2% A 41 LEU HDx% 1.0 . 9.04 461 415 A 50 THR HG2% A 41 LEU HDy% 1.0 . 9.04 462 416 A 50 THR HG2% A 46 VAL HA 1.0 . 6.75 463 417 A 50 THR HG2% A 55 GLN HG2 1.0 . 7.09 464 417 A 55 GLN HG3 A 50 THR HG2% 1.0 . 7.09 465 418 A 50 THR HG2% A 87 LEU HDy% 1.0 . 9.04 466 419 A 51 ASP HA A 50 THR HG2% 1.0 . 8.02 467 420 A 52 PHE HA A 50 THR HG2% 1.0 . 7.08 468 421 A 52 PHE HBx A 81 LEU HDx% 1.0 . 7.41 469 422 A 81 LEU HDy% A 52 PHE HBx 1.0 . 7.41 470 423 A 52 PHE HD% A 40 LEU HDy% 1.0 . 10.15 471 424 A 52 PHE HD% A 41 LEU HDy% 1.0 . 10.15 472 425 A 52 PHE HD% A 61 LEU HDy% 1.0 . 10.15 473 426 A 52 PHE HD% A 65 LEU HDx% 1.0 . 10.15 474 427 A 52 PHE HD% A 81 LEU HDx% 1.0 . 10.15 475 428 A 52 PHE HD% A 81 LEU HDy% 1.0 . 10.15 476 429 A 52 PHE HE% A 40 LEU HDx% 1.0 . 10.15 477 430 A 52 PHE HE% A 40 LEU HDy% 1.0 . 10.15 478 431 A 52 PHE HE% A 41 LEU HDy% 1.0 . 10.15 479 432 A 52 PHE HE% A 61 LEU HDx% 1.0 . 10.15 480 433 A 52 PHE HE% A 61 LEU HDy% 1.0 . 10.15 481 434 A 52 PHE HE% A 65 LEU HDy% 1.0 . 10.15 482 435 A 52 PHE HE% A 81 LEU HDy% 1.0 . 10.15 483 436 A 52 PHE HZ A 40 LEU HDy% 1.0 . 7.91 484 437 A 52 PHE HZ A 41 LEU HDx% 1.0 . 8.02 485 438 A 52 PHE HZ A 62 ALA HB% 1.0 . 6.75 486 439 A 52 PHE HZ A 65 LEU HDx% 1.0 . 8.02 487 440 A 52 PHE HZ A 81 LEU HDx% 1.0 . 8.02 488 441 A 52 PHE HZ A 81 LEU HDy% 1.0 . 8.02 489 442 A 53 PHE HE% A 62 ALA HB% 1.0 . 10.15 490 443 A 53 PHE HE% A 81 LEU HDx% 1.0 . 10.15 491 444 A 53 PHE HE% A 81 LEU HDy% 1.0 . 10.15 492 445 A 53 PHE HZ A 78 LEU HD1% 1.0 . 9.10 493 445 A 53 PHE HZ A 78 LEU HD2% 1.0 . 9.10 494 446 A 53 PHE HZ A 81 LEU HDy% 1.0 . 8.02 495 447 A 55 GLN HA A 41 LEU HDy% 1.0 . 7.08 496 448 A 43 THR HG2% A 55 GLN HBx 1.0 . 5.65 497 449 A 43 THR HG2% A 55 GLN HBy 1.0 . 5.65 498 450 A 41 LEU HDy% A 56 GLY HAx 1.0 . 8.02 499 451 A 57 GLY HAx A 41 LEU HDx% 1.0 . 8.02 500 452 A 41 LEU HDx% A 57 GLY HAy 1.0 . 8.02 501 453 A 41 LEU HDy% A 57 GLY HAy 1.0 . 8.02 502 454 A 59 SER HA A 62 ALA HB% 1.0 . 5.82 503 455 A 59 SER HA A 78 LEU HD1% 1.0 . 7.50 504 455 A 59 SER HA A 78 LEU HD2% 1.0 . 7.50 505 456 A 59 SER HB3 A 78 LEU HD1% 1.0 . 8.88 506 456 A 59 SER HB2 A 78 LEU HD1% 1.0 . 8.88 507 456 A 78 LEU HD2% A 59 SER HB2 1.0 . 8.88 508 456 A 59 SER HB3 A 78 LEU HD2% 1.0 . 8.88 509 457 A 60 LEU HA A 63 THR HG2% 1.0 . 6.20 510 458 A 52 PHE HZ A 61 LEU HDx% 1.0 . 7.96 511 459 A 58 ASP HA A 61 LEU HDx% 1.0 . 8.02 512 460 A 64 ARG HD3 A 61 LEU HDx% 1.0 . 8.30 513 460 A 61 LEU HDx% A 64 ARG HD2 1.0 . 8.30 514 461 A 52 PHE HZ A 61 LEU HDy% 1.0 . 7.96 515 462 A 58 ASP HA A 61 LEU HDy% 1.0 . 8.02 516 463 A 64 ARG HB3 A 61 LEU HDy% 1.0 . 7.96 517 463 A 61 LEU HDy% A 64 ARG HB2 1.0 . 7.96 518 464 A 62 ALA HA A 65 LEU HDx% 1.0 . 8.02 519 465 A 62 ALA HA A 78 LEU HD1% 1.0 . 8.93 520 465 A 62 ALA HA A 78 LEU HD2% 1.0 . 8.93 521 466 A 52 PHE HD% A 62 ALA HB% 1.0 . 9.54 522 467 A 52 PHE HE% A 62 ALA HB% 1.0 . 9.16 523 468 A 53 PHE HD% A 62 ALA HB% 1.0 . 10.15 524 469 A 53 PHE HZ A 62 ALA HB% 1.0 . 7.30 525 470 A 58 ASP HA A 62 ALA HB% 1.0 . 8.02 526 471 A 62 ALA HB% A 59 SER HB2 1.0 . 6.32 527 471 A 59 SER HB3 A 62 ALA HB% 1.0 . 6.32 528 472 A 62 ALA HB% A 78 LEU HD1% 1.0 . 7.86 529 472 A 62 ALA HB% A 78 LEU HD2% 1.0 . 7.86 530 473 A 82 PHE HD% A 62 ALA HB% 1.0 . 9.60 531 474 A 82 PHE HE% A 62 ALA HB% 1.0 . 10.15 532 475 A 63 THR HA A 66 THR HG2% 1.0 . 4.66 533 476 A 63 THR HA A 78 LEU HD1% 1.0 . 7.12 534 476 A 78 LEU HD2% A 63 THR HA 1.0 . 7.12 535 477 A 64 ARG HA A 63 THR HG2% 1.0 . 6.31 536 478 A 64 ARG HB3 A 40 LEU HDx% 1.0 . 7.03 537 478 A 40 LEU HDx% A 64 ARG HB2 1.0 . 7.03 538 479 A 64 ARG HB3 A 40 LEU HDy% 1.0 . 7.03 539 479 A 40 LEU HDy% A 64 ARG HB2 1.0 . 7.03 540 480 A 64 ARG HB3 A 61 LEU HDx% 1.0 . 7.96 541 480 A 61 LEU HDx% A 64 ARG HB2 1.0 . 7.96 542 481 A 64 ARG HD3 A 40 LEU HDx% 1.0 . 8.57 543 481 A 40 LEU HDx% A 64 ARG HD2 1.0 . 8.57 544 482 A 64 ARG HD3 A 40 LEU HDy% 1.0 . 8.57 545 482 A 40 LEU HDy% A 64 ARG HD2 1.0 . 8.57 546 483 A 64 ARG HD3 A 61 LEU HDy% 1.0 . 8.30 547 483 A 61 LEU HDy% A 64 ARG HD2 1.0 . 8.30 548 484 A 52 PHE HE% A 65 LEU HDx% 1.0 . 10.15 549 485 A 66 THR HB A 65 LEU HDx% 1.0 . 8.02 550 486 A 69 LEU HG A 65 LEU HDx% 1.0 . 6.48 551 487 A 52 PHE HD% A 65 LEU HDy% 1.0 . 10.15 552 488 A 52 PHE HZ A 65 LEU HDy% 1.0 . 8.02 553 489 A 62 ALA HA A 65 LEU HDy% 1.0 . 8.02 554 490 A 66 THR HB A 65 LEU HDy% 1.0 . 8.02 555 491 A 69 LEU HG A 65 LEU HDy% 1.0 . 6.48 556 492 A 65 LEU HDy% A 81 LEU HDx% 1.0 . 9.04 557 493 A 65 LEU HDy% A 81 LEU HDy% 1.0 . 9.04 558 494 A 66 THR HG2% A 76 ALA HB% 1.0 . 5.90 559 495 A 66 THR HG2% A 81 LEU HDx% 1.0 . 9.04 560 496 A 66 THR HG2% A 81 LEU HDy% 1.0 . 9.04 561 497 A 66 THR HG2% A 67 GLY HAy 1.0 . 8.02 562 498 A 68 GLN HA A 36 LEU HDx% 1.0 . 5.82 563 499 A 68 GLN HBy A 36 LEU HDx% 1.0 . 6.59 564 500 A 36 LEU HDy% A 68 GLN HBy 1.0 . 6.59 565 501 A 36 LEU HDx% A 68 GLN HBx 1.0 . 6.59 566 502 A 36 LEU HDy% A 68 GLN HBx 1.0 . 6.59 567 503 A 69 LEU HA A 69 LEU HDx% 1.0 . 5.05 568 504 A 74 TYR HBx A 69 LEU HDx% 1.0 . 7.63 569 505 A 69 LEU HDx% A 74 TYR HBy 1.0 . 7.63 570 506 A 69 LEU HA A 69 LEU HDy% 1.0 . 5.05 571 507 A 69 LEU HDy% A 74 TYR HBy 1.0 . 7.63 572 508 A 70 HIS HA A 76 ALA HB% 1.0 . 8.02 573 509 A 70 HIS HD2 A 66 THR HG2% 1.0 . 7.63 574 510 A 70 HIS HD2 A 76 ALA HB% 1.0 . 6.97 575 511 A 70 HIS HE1 A 66 THR HG2% 1.0 . 6.86 576 512 A 70 HIS HE1 A 76 ALA HB% 1.0 . 8.02 577 513 A 29 ILE HG2% A 72 ALA HB% 1.0 . 8.98 578 514 A 69 LEU HA A 72 ALA HB% 1.0 . 4.83 579 515 A 72 ALA HB% A 69 LEU HDy% 1.0 . 9.04 580 516 A 70 HIS HA A 72 ALA HB% 1.0 . 8.02 581 517 A 74 TYR HA A 72 ALA HB% 1.0 . 7.69 582 518 A 72 ALA HB% A 94 LEU HDx% 1.0 . 9.04 583 519 A 72 ALA HB% A 94 LEU HDy% 1.0 . 9.04 584 520 A 74 TYR HA A 94 LEU HDx% 1.0 . 8.02 585 521 A 69 LEU HDy% A 74 TYR HBx 1.0 . 7.63 586 522 A 74 TYR HBx A 94 LEU HDx% 1.0 . 8.02 587 523 A 94 LEU HDy% A 74 TYR HBx 1.0 . 8.02 588 524 A 74 TYR HBy A 94 LEU HDx% 1.0 . 8.02 589 525 A 74 TYR HD% A 29 ILE HD1% 1.0 . 10.15 590 526 A 74 TYR HD% A 72 ALA HB% 1.0 . 8.99 591 527 A 74 TYR HD% A 94 LEU HDx% 1.0 . 10.15 592 528 A 74 TYR HD% A 94 LEU HDy% 1.0 . 10.15 593 529 A 74 TYR HE% A 72 ALA HB% 1.0 . 8.23 594 530 A 74 TYR HE% A 94 LEU HDx% 1.0 . 10.15 595 531 A 74 TYR HE% A 94 LEU HDy% 1.0 . 10.15 596 532 A 97 THR HG2% A 75 GLU HGx 1.0 . 6.59 597 533 A 97 THR HG2% A 75 GLU HGy 1.0 . 6.59 598 534 A 66 THR HA A 76 ALA HB% 1.0 . 6.64 599 535 A 66 THR HB A 76 ALA HB% 1.0 . 6.70 600 536 A 74 TYR HA A 76 ALA HB% 1.0 . 8.02 601 537 A 75 GLU HA A 76 ALA HB% 1.0 . 5.21 602 538 A 77 GLN HA A 76 ALA HB% 1.0 . 8.02 603 539 A 76 ALA HB% A 81 LEU HDy% 1.0 . 9.04 604 540 A 90 PHE HE% A 76 ALA HB% 1.0 . 9.38 605 541 A 77 GLN HA A 66 THR HG2% 1.0 . 6.04 606 542 A 77 GLN HA A 78 LEU HD1% 1.0 . 9.10 607 542 A 77 GLN HA A 78 LEU HD2% 1.0 . 9.10 608 543 A 78 LEU HA A 66 THR HG2% 1.0 . 5.82 609 544 A 78 LEU HA A 81 LEU HDy% 1.0 . 8.02 610 545 A 63 THR HG2% A 78 LEU HD1% 1.0 . 9.62 611 545 A 78 LEU HD2% A 63 THR HG2% 1.0 . 9.62 612 546 A 78 LEU HA A 78 LEU HD1% 1.0 . 6.90 613 546 A 78 LEU HA A 78 LEU HD2% 1.0 . 6.90 614 547 A 82 PHE HD% A 78 LEU HD1% 1.0 . 9.91 615 547 A 82 PHE HD% A 78 LEU HD2% 1.0 . 9.91 616 548 A 82 PHE HE% A 78 LEU HD1% 1.0 . 11.06 617 548 A 82 PHE HE% A 78 LEU HD2% 1.0 . 11.06 618 549 A 80 ASP HA A 93 THR HG2% 1.0 . 7.80 619 550 A 37 TRP HH2 A 81 LEU HDx% 1.0 . 8.02 620 551 A 52 PHE HA A 81 LEU HDx% 1.0 . 8.02 621 552 A 52 PHE HE% A 81 LEU HDx% 1.0 . 10.15 622 553 A 53 PHE HD% A 81 LEU HDx% 1.0 . 10.15 623 554 A 53 PHE HZ A 81 LEU HDx% 1.0 . 8.02 624 555 A 65 LEU HDx% A 81 LEU HDx% 1.0 . 9.04 625 556 A 78 LEU HA A 81 LEU HDx% 1.0 . 8.02 626 557 A 82 PHE HA A 81 LEU HDx% 1.0 . 7.91 627 558 A 85 PRO HB3 A 81 LEU HDx% 1.0 . 8.90 628 558 A 81 LEU HDx% A 85 PRO HB2 1.0 . 8.90 629 559 A 52 PHE HA A 81 LEU HDy% 1.0 . 8.02 630 560 A 81 LEU HDy% A 65 LEU HDx% 1.0 . 9.04 631 561 A 82 PHE HA A 81 LEU HDy% 1.0 . 7.91 632 562 A 82 PHE HD% A 81 LEU HDy% 1.0 . 10.15 633 563 A 85 PRO HB3 A 81 LEU HDy% 1.0 . 8.90 634 563 A 81 LEU HDy% A 85 PRO HB2 1.0 . 8.90 635 564 A 90 PHE HD% A 81 LEU HDy% 1.0 . 10.15 636 565 A 90 PHE HE% A 81 LEU HDy% 1.0 . 10.15 637 566 A 82 PHE HA A 78 LEU HD1% 1.0 . 9.10 638 566 A 82 PHE HA A 78 LEU HD2% 1.0 . 9.10 639 567 A 82 PHE HD% A 81 LEU HDx% 1.0 . 10.15 640 568 A 86 ARG HA A 50 THR HG2% 1.0 . 8.02 641 569 A 87 LEU HA A 87 LEU HDy% 1.0 . 6.37 642 570 A 30 GLU HGx A 87 LEU HDx% 1.0 . 8.02 643 571 A 33 VAL HB A 87 LEU HDx% 1.0 . 4.94 644 572 A 34 ALA HB% A 87 LEU HDx% 1.0 . 7.33 645 573 A 37 TRP HE3 A 87 LEU HDx% 1.0 . 7.91 646 574 A 37 TRP HZ2 A 87 LEU HDx% 1.0 . 8.02 647 575 A 37 TRP HZ3 A 87 LEU HDx% 1.0 . 7.96 648 576 A 37 TRP HH2 A 87 LEU HDx% 1.0 . 8.02 649 577 A 50 THR HG2% A 87 LEU HDx% 1.0 . 9.04 650 578 A 87 LEU HA A 87 LEU HDx% 1.0 . 6.37 651 579 A 87 LEU HDy% A 30 GLU HGx 1.0 . 8.02 652 580 A 34 ALA HB% A 87 LEU HDy% 1.0 . 7.33 653 581 A 37 TRP HE3 A 87 LEU HDy% 1.0 . 7.91 654 582 A 37 TRP HZ3 A 87 LEU HDy% 1.0 . 7.96 655 583 A 87 LEU HDy% A 46 VAL HGy% 1.0 . 9.04 656 584 A 88 ALA HA A 87 LEU HDy% 1.0 . 7.30 657 585 A 88 ALA HA A 87 LEU HDx% 1.0 . 7.30 658 586 A 88 ALA HA A 91 ALA HB% 1.0 . 4.55 659 587 A 89 ASP HA A 92 ALA HB% 1.0 . 5.71 660 588 A 90 PHE HD% A 29 ILE HG2% 1.0 . 10.15 661 589 A 90 PHE HD% A 65 LEU HDx% 1.0 . 10.09 662 590 A 90 PHE HD% A 65 LEU HDy% 1.0 . 10.09 663 591 A 90 PHE HD% A 76 ALA HB% 1.0 . 9.76 664 592 A 90 PHE HD% A 81 LEU HDx% 1.0 . 10.15 665 593 A 90 PHE HD% A 94 LEU HDx% 1.0 . 10.09 666 594 A 90 PHE HE% A 66 THR HG2% 1.0 . 10.15 667 595 A 90 PHE HE% A 94 LEU HDx% 1.0 . 10.15 668 596 A 90 PHE HE% A 94 LEU HDy% 1.0 . 10.15 669 597 A 91 ALA HA A 94 LEU HDy% 1.0 . 6.26 670 598 A 90 PHE HD% A 91 ALA HB% 1.0 . 10.15 671 599 A 29 ILE HG2% A 92 ALA HA 1.0 . 8.02 672 600 A 91 ALA HB% A 92 ALA HA 1.0 . 5.82 673 601 A 91 ALA HA A 92 ALA HB% 1.0 . 8.02 674 602 A 92 ALA HB% A 93 THR HA 1.0 . 6.48 675 603 A 93 THR HB A 92 ALA HB% 1.0 . 6.42 676 604 A 84 HIS HD2 A 93 THR HG2% 1.0 . 6.26 677 605 A 90 PHE HD% A 93 THR HG2% 1.0 . 9.71 678 606 A 93 THR HG2% A 92 ALA HB% 1.0 . 7.88 679 607 A 91 ALA HA A 94 LEU HDx% 1.0 . 6.26 680 608 A 95 ARG HA A 94 LEU HDx% 1.0 . 8.02 681 609 A 74 TYR HA A 94 LEU HDy% 1.0 . 8.02 682 610 A 94 LEU HDy% A 74 TYR HBy 1.0 . 8.02 683 611 A 90 PHE HD% A 94 LEU HDy% 1.0 . 10.09 684 612 A 95 ARG HA A 29 ILE HD1% 1.0 . 7.53 685 613 A 95 ARG HA A 94 LEU HDy% 1.0 . 8.02 686 614 A 96 LYS HA A 94 LEU HDx% 1.0 . 8.02 687 615 A 29 ILE HG2% A 96 LYS HE2 1.0 . 8.90 688 615 A 96 LYS HE3 A 29 ILE HG2% 1.0 . 8.90 689 616 A 74 TYR HA A 97 THR HG2% 1.0 . 7.41 690 617 A 97 THR HG2% A 98 ASP HA 1.0 . 7.80 691 618 A 98 ASP HA A 99 VAL HGx% 1.0 . 7.47 692 619 A 97 THR HG2% A 100 PRO HA 1.0 . 8.02 693 620 A 30 GLU HA A 31 LYS HA 1.0 . 6.12 694 621 A 58 ASP HA A 59 SER HB2 1.0 . 6.95 695 621 A 58 ASP HA A 59 SER HB3 1.0 . 6.95 696 622 A 67 GLY HAx A 70 HIS HBy 1.0 . 5.84 697 623 A 70 HIS HA A 75 GLU HA 1.0 . 7.00 698 624 A 82 PHE HA A 78 LEU HB2 1.0 . 7.88 699 624 A 78 LEU HB3 A 82 PHE HA 1.0 . 7.88 700 625 A 66 THR HA A 63 THR HA 1.0 . 7.00 701 626 A 47 THR HA A 25 PRO HBy 1.0 . 7.00 702 627 A 47 THR HA A 25 PRO HBx 1.0 . 7.00 703 628 A 47 THR HB A 25 PRO HBx 1.0 . 7.00 704 629 A 33 VAL HA A 37 TRP HD1 1.0 . 7.00 705 630 A 37 TRP HZ3 A 87 LEU HG 1.0 . 7.00 706 631 A 38 GLN HGx A 44 GLY HAx 1.0 . 7.00 707 632 A 44 GLY HAx A 38 GLN HGy 1.0 . 7.00 708 633 A 43 THR HB A 41 LEU HB2 1.0 . 7.88 709 633 A 43 THR HB A 41 LEU HB3 1.0 . 7.88 710 634 A 47 THR HB A 25 PRO HBy 1.0 . 7.00 711 635 A 86 ARG HDx A 49 GLU HGx 1.0 . 7.00 712 636 A 51 ASP HA A 86 ARG HDx 1.0 . 7.00 713 637 A 53 PHE HD% A 52 PHE HBy 1.0 . 9.13 714 638 A 53 PHE HE% A 52 PHE HBy 1.0 . 9.13 715 639 A 52 PHE HE% A 59 SER HB2 1.0 . 10.01 716 639 A 52 PHE HE% A 59 SER HB3 1.0 . 10.01 717 640 A 52 PHE HE% A 61 LEU HBy 1.0 . 9.13 718 641 A 53 PHE HD% A 57 GLY HAx 1.0 . 9.13 719 642 A 85 PRO HA A 53 PHE HD% 1.0 . 9.13 720 643 A 53 PHE HD% A 85 PRO HDy 1.0 . 9.13 721 644 A 52 PHE HA A 53 PHE HE% 1.0 . 9.13 722 645 A 85 PRO HA A 53 PHE HE% 1.0 . 9.13 723 646 A 53 PHE HA A 53 PHE HZ 1.0 . 7.00 724 647 A 70 HIS HD2 A 71 GLN HGy 1.0 . 7.00 725 648 A 74 TYR HE% A 94 LEU HBx 1.0 . 9.13 726 649 A 80 ASP HBx A 77 GLN HBy 1.0 . 7.00 727 650 A 81 LEU HG A 82 PHE HD% 1.0 . 9.13 728 651 A 53 PHE HE% A 85 PRO HGy 1.0 . 9.13 729 652 A 86 ARG HDx A 51 ASP HBx 1.0 . 7.00 730 653 A 49 GLU HGx A 86 ARG HDy 1.0 . 7.00 731 654 A 51 ASP HBy A 86 ARG HDy 1.0 . 7.00 732 655 A 76 ALA HA A 90 PHE HD% 1.0 . 9.13 733 656 A 90 PHE HD% A 80 ASP HBy 1.0 . 9.13 734 657 A 90 PHE HD% A 84 HIS HBx 1.0 . 9.13 735 658 A 90 PHE HD% A 84 HIS HBy 1.0 . 9.13 736 659 A 90 PHE HD% A 87 LEU HG 1.0 . 9.13 737 660 A 33 VAL HA A 90 PHE HE% 1.0 . 9.13 738 661 A 96 LYS HA A 96 LYS HE2 1.0 . 7.88 739 661 A 96 LYS HA A 96 LYS HE3 1.0 . 7.88 740 662 A 105 PHE HA A 105 PHE HZ 1.0 . 7.00 741 663 A 4 ASP HA A 7 ALA HB% 1.0 . 8.02 742 664 A 8 LEU HA A 8 LEU HDy% 1.0 . 6.04 743 665 A 32 GLN HGx A 33 VAL HGy% 1.0 . 8.02 744 666 A 37 TRP HD1 A 36 LEU HDx% 1.0 . 7.96 745 667 A 68 GLN HA A 36 LEU HDy% 1.0 . 5.82 746 668 A 38 GLN HA A 46 VAL HGx% 1.0 . 8.02 747 669 A 46 VAL HGx% A 38 GLN HGy 1.0 . 6.92 748 670 A 40 LEU HA A 40 LEU HDy% 1.0 . 5.38 749 671 A 43 THR HG2% A 41 LEU HA 1.0 . 8.02 750 672 A 41 LEU HG A 43 THR HG2% 1.0 . 4.22 751 673 A 56 GLY HAx A 41 LEU HDx% 1.0 . 8.02 752 674 A 43 THR HG2% A 44 GLY HAy 1.0 . 8.02 753 675 A 46 VAL HGx% A 44 GLY HAx 1.0 . 8.02 754 676 A 46 VAL HGx% A 44 GLY HAy 1.0 . 8.02 755 677 A 37 TRP HD1 A 46 VAL HGx% 1.0 . 8.02 756 678 A 37 TRP HE3 A 46 VAL HGx% 1.0 . 8.02 757 679 A 46 VAL HGx% A 87 LEU HDx% 1.0 . 9.04 758 680 A 87 LEU HDy% A 46 VAL HGx% 1.0 . 9.04 759 681 A 37 TRP HD1 A 46 VAL HGy% 1.0 . 8.02 760 682 A 38 GLN HA A 46 VAL HGy% 1.0 . 8.02 761 683 A 44 GLY HAx A 46 VAL HGy% 1.0 . 8.02 762 684 A 44 GLY HAy A 46 VAL HGy% 1.0 . 8.02 763 685 A 47 THR HG2% A 45 ASN HA 1.0 . 6.86 764 686 A 52 PHE HBy A 81 LEU HDx% 1.0 . 7.41 765 687 A 52 PHE HBy A 81 LEU HDy% 1.0 . 7.41 766 688 A 52 PHE HD% A 61 LEU HDx% 1.0 . 10.15 767 689 A 66 THR HA A 63 THR HG2% 1.0 . 8.02 768 690 A 66 THR HG2% A 67 GLY HAx 1.0 . 8.02 769 691 A 76 ALA HA A 66 THR HG2% 1.0 . 8.02 770 692 A 72 ALA HB% A 69 LEU HDx% 1.0 . 9.04 771 693 A 74 TYR HE% A 76 ALA HB% 1.0 . 10.15 772 694 A 66 THR HA A 78 LEU HD1% 1.0 . 9.10 773 694 A 66 THR HA A 78 LEU HD2% 1.0 . 9.10 774 695 A 66 THR HB A 78 LEU HD1% 1.0 . 9.10 775 695 A 66 THR HB A 78 LEU HD2% 1.0 . 9.10 776 696 A 76 ALA HB% A 81 LEU HDx% 1.0 . 9.04 777 697 A 53 PHE HD% A 81 LEU HDy% 1.0 . 10.15 778 698 A 25 PRO HBy A 87 LEU HDx% 1.0 . 5.93 779 699 A 25 PRO HDy A 87 LEU HDx% 1.0 . 8.02 780 700 A 30 GLU HGy A 87 LEU HDx% 1.0 . 8.02 781 701 A 87 LEU HDy% A 25 PRO HDx 1.0 . 8.02 782 702 A 87 LEU HDy% A 30 GLU HGy 1.0 . 8.02 783 703 A 31 LYS HA A 87 LEU HDy% 1.0 . 8.02 784 704 A 34 ALA HA A 87 LEU HDy% 1.0 . 6.81 785 705 A 90 PHE HA A 93 THR HG2% 1.0 . 4.77 786 706 A 90 PHE HD% A 33 VAL HGy% 1.0 . 9.65 787 707 A 90 PHE HE% A 81 LEU HDx% 1.0 . 10.15 788 708 A 29 ILE HA A 91 ALA HB% 1.0 . 6.97 789 709 A 96 LYS HA A 94 LEU HDy% 1.0 . 8.02 790 710 A 97 THR HG2% A 99 VAL HA 1.0 . 8.02 791 711 A 98 ASP HA A 99 VAL HGy% 1.0 . 7.47 792 712 A 6 GLN H A 7 ALA H 1.0 . 4.63 793 713 A 7 ALA H A 6 GLN HB2 1.0 . 7.22 794 713 A 7 ALA H A 6 GLN HB3 1.0 . 7.22 795 714 A 15 GLU H A 15 GLU HBx 1.0 . 4.08 796 715 A 15 GLU H A 15 GLU HBy 1.0 . 4.08 797 716 A 15 GLU HBx A 16 ALA H 1.0 . 5.46 798 717 A 15 GLU HBy A 16 ALA H 1.0 . 5.46 799 718 A 21 GLU H A 22 ALA H 1.0 . 4.63 800 719 A 22 ALA H A 21 GLU HBx 1.0 . 5.13 801 720 A 22 ALA H A 21 GLU HBy 1.0 . 5.13 802 721 A 22 ALA H A 24 LEU H 1.0 . 4.80 803 722 A 23 ASP H A 21 GLU HBx 1.0 . 5.84 804 723 A 23 ASP H A 21 GLU HBy 1.0 . 5.84 805 724 A 24 LEU H A 23 ASP H 1.0 . 4.14 806 725 A 24 LEU HA A 23 ASP H 1.0 . 5.40 807 726 A 23 ASP H A 24 LEU HBx 1.0 . 5.51 808 727 A 23 ASP H A 24 LEU HBy 1.0 . 5.51 809 728 A 24 LEU H A 22 ALA HA 1.0 . 5.19 810 729 A 24 LEU H A 23 ASP HBx 1.0 . 5.29 811 730 A 24 LEU H A 23 ASP HBy 1.0 . 5.29 812 731 A 24 LEU H A 24 LEU HBx 1.0 . 3.87 813 732 A 24 LEU H A 24 LEU HBy 1.0 . 3.87 814 733 A 26 GLN H A 31 LYS H 1.0 . 5.90 815 734 A 26 GLN H A 27 GLY H 1.0 . 5.24 816 735 A 27 GLY H A 26 GLN HBx 1.0 . 5.68 817 736 A 27 GLY H A 26 GLN HBy 1.0 . 5.68 818 737 A 28 ASP H A 28 ASP HBx 1.0 . 4.14 819 738 A 28 ASP H A 28 ASP HBy 1.0 . 4.14 820 739 A 28 ASP H A 29 ILE H 1.0 . 4.53 821 740 A 29 ILE H A 28 ASP HBx 1.0 . 4.63 822 741 A 29 ILE H A 28 ASP HBy 1.0 . 4.63 823 742 A 29 ILE HB A 29 ILE H 1.0 . 3.70 824 743 A 29 ILE H A 30 GLU H 1.0 . 4.25 825 744 A 30 GLU HA A 29 ILE H 1.0 . 6.40 826 745 A 26 GLN H A 30 GLU H 1.0 . 5.19 827 746 A 30 GLU H A 27 GLY HAx 1.0 . 5.90 828 747 A 30 GLU H A 27 GLY HAy 1.0 . 5.90 829 748 A 28 ASP H A 30 GLU H 1.0 . 4.08 830 749 A 28 ASP HA A 30 GLU H 1.0 . 6.17 831 750 A 29 ILE HA A 31 LYS H 1.0 . 7.00 832 751 A 31 LYS H A 30 GLU H 1.0 . 4.36 833 752 A 31 LYS H A 32 GLN H 1.0 . 3.87 834 753 A 32 GLN H A 31 LYS HB2 1.0 . 5.35 835 753 A 31 LYS HB3 A 32 GLN H 1.0 . 5.35 836 754 A 32 GLN H A 33 VAL H 1.0 . 4.20 837 755 A 33 VAL HA A 32 GLN H 1.0 . 5.90 838 756 A 31 LYS HA A 33 VAL H 1.0 . 5.24 839 757 A 33 VAL HB A 33 VAL H 1.0 . 3.92 840 758 A 33 VAL H A 35 ALA H 1.0 . 5.79 841 759 A 31 LYS HA A 34 ALA H 1.0 . 4.91 842 760 A 33 VAL HB A 34 ALA H 1.0 . 4.20 843 761 A 35 ALA H A 34 ALA H 1.0 . 4.58 844 762 A 34 ALA H A 37 TRP H 1.0 . 5.13 845 763 A 31 LYS HA A 35 ALA H 1.0 . 5.79 846 764 A 33 VAL HA A 35 ALA H 1.0 . 5.96 847 765 A 35 ALA H A 38 GLN H 1.0 . 5.35 848 766 A 33 VAL HA A 36 LEU H 1.0 . 5.40 849 767 A 34 ALA H A 36 LEU H 1.0 . 5.79 850 768 A 34 ALA HA A 36 LEU H 1.0 . 5.84 851 769 A 35 ALA H A 36 LEU H 1.0 . 4.20 852 770 A 36 LEU H A 36 LEU HBx 1.0 . 4.08 853 771 A 36 LEU H A 36 LEU HBy 1.0 . 4.08 854 772 A 37 TRP H A 36 LEU H 1.0 . 4.36 855 773 A 36 LEU H A 37 TRP HBx 1.0 . 5.84 856 774 A 36 LEU H A 37 TRP HBy 1.0 . 5.84 857 775 A 34 ALA HA A 37 TRP H 1.0 . 4.14 858 776 A 35 ALA H A 37 TRP H 1.0 . 5.96 859 777 A 37 TRP H A 38 GLN H 1.0 . 4.47 860 778 A 38 GLN HA A 37 TRP H 1.0 . 5.51 861 779 A 37 TRP H A 39 GLN H 1.0 . 5.51 862 780 A 34 ALA HA A 38 GLN H 1.0 . 4.69 863 781 A 38 GLN H A 36 LEU H 1.0 . 5.96 864 782 A 38 GLN H A 37 TRP HBx 1.0 . 5.02 865 783 A 38 GLN H A 37 TRP HBy 1.0 . 5.02 866 784 A 38 GLN H A 40 LEU H 1.0 . 4.91 867 785 A 36 LEU HA A 39 GLN H 1.0 . 4.86 868 786 A 38 GLN H A 39 GLN H 1.0 . 4.42 869 787 A 39 GLN H A 40 LEU H 1.0 . 4.25 870 788 A 39 GLN H A 41 LEU H 1.0 . 5.84 871 789 A 37 TRP HA A 40 LEU H 1.0 . 4.53 872 790 A 40 LEU H A 39 GLN HB2 1.0 . 5.46 873 790 A 39 GLN HB3 A 40 LEU H 1.0 . 5.46 874 791 A 40 LEU H A 40 LEU HBy 1.0 . 4.08 875 792 A 40 LEU H A 40 LEU HBx 1.0 . 4.08 876 793 A 37 TRP HA A 41 LEU H 1.0 . 5.46 877 794 A 40 LEU H A 41 LEU H 1.0 . 4.14 878 795 A 41 LEU H A 40 LEU HBy 1.0 . 4.20 879 796 A 41 LEU H A 40 LEU HBx 1.0 . 4.20 880 797 A 41 LEU H A 42 SER H 1.0 . 4.25 881 798 A 41 LEU H A 43 THR H 1.0 . 5.96 882 799 A 39 GLN H A 42 SER H 1.0 . 6.01 883 800 A 40 LEU H A 42 SER H 1.0 . 5.13 884 801 A 42 SER H A 41 LEU HB2 1.0 . 6.34 885 801 A 41 LEU HB3 A 42 SER H 1.0 . 6.34 886 802 A 43 THR H A 44 GLY H 1.0 . 4.63 887 803 A 45 ASN H A 46 VAL H 1.0 . 4.42 888 804 A 46 VAL H A 45 ASN HBx 1.0 . 5.29 889 805 A 46 VAL H A 45 ASN HBy 1.0 . 5.29 890 806 A 46 VAL HB A 46 VAL H 1.0 . 3.87 891 807 A 46 VAL H A 47 THR H 1.0 . 5.51 892 808 A 46 VAL HB A 47 THR H 1.0 . 5.35 893 809 A 24 LEU HA A 48 ARG H 1.0 . 5.40 894 810 A 25 PRO HA A 48 ARG H 1.0 . 5.57 895 811 A 47 THR HB A 48 ARG H 1.0 . 4.03 896 812 A 48 ARG H A 49 GLU H 1.0 . 4.58 897 813 A 47 THR H A 49 GLU H 1.0 . 5.96 898 814 A 47 THR HB A 49 GLU H 1.0 . 4.86 899 815 A 49 GLU H A 50 THR H 1.0 . 3.92 900 816 A 50 THR HB A 49 GLU H 1.0 . 5.08 901 817 A 47 THR H A 50 THR H 1.0 . 5.19 902 818 A 47 THR HB A 50 THR H 1.0 . 5.08 903 819 A 48 ARG H A 50 THR H 1.0 . 5.40 904 820 A 50 THR HB A 50 THR H 1.0 . 3.87 905 821 A 50 THR H A 51 ASP H 1.0 . 5.40 906 822 A 50 THR HB A 51 ASP H 1.0 . 5.46 907 823 A 51 ASP H A 52 PHE H 1.0 . 5.19 908 824 A 51 ASP HA A 53 PHE H 1.0 . 5.35 909 825 A 52 PHE H A 53 PHE H 1.0 . 5.13 910 826 A 53 PHE H A 52 PHE HBx 1.0 . 4.63 911 827 A 53 PHE H A 52 PHE HBy 1.0 . 4.63 912 828 A 53 PHE H A 55 GLN H 1.0 . 3.75 913 829 A 51 ASP HA A 54 GLN H 1.0 . 6.40 914 830 A 53 PHE H A 54 GLN H 1.0 . 4.03 915 831 A 54 GLN H A 53 PHE HBx 1.0 . 4.91 916 832 A 54 GLN H A 53 PHE HBy 1.0 . 4.91 917 833 A 55 GLN H A 54 GLN H 1.0 . 4.36 918 834 A 53 PHE HA A 55 GLN H 1.0 . 5.90 919 835 A 55 GLN H A 54 GLN HBx 1.0 . 4.80 920 836 A 55 GLN H A 54 GLN HBy 1.0 . 4.80 921 837 A 53 PHE HA A 56 GLY H 1.0 . 5.29 922 838 A 56 GLY H A 54 GLN HA 1.0 . 5.35 923 839 A 55 GLN H A 56 GLY H 1.0 . 4.03 924 840 A 53 PHE HA A 57 GLY H 1.0 . 4.47 925 841 A 54 GLN H A 57 GLY H 1.0 . 6.72 926 842 A 54 GLN HA A 57 GLY H 1.0 . 5.51 927 843 A 55 GLN H A 57 GLY H 1.0 . 5.40 928 844 A 55 GLN HA A 57 GLY H 1.0 . 4.86 929 845 A 56 GLY H A 57 GLY H 1.0 . 4.03 930 846 A 57 GLY H A 58 ASP H 1.0 . 5.62 931 847 A 53 PHE HA A 58 ASP H 1.0 . 6.62 932 848 A 58 ASP H A 61 LEU H 1.0 . 5.02 933 849 A 58 ASP H A 61 LEU HBx 1.0 . 4.53 934 850 A 58 ASP H A 61 LEU HBy 1.0 . 4.53 935 851 A 58 ASP H A 60 LEU H 1.0 . 5.74 936 852 A 58 ASP HA A 60 LEU H 1.0 . 5.68 937 853 A 60 LEU H A 58 ASP HBx 1.0 . 5.46 938 854 A 60 LEU H A 58 ASP HBy 1.0 . 5.46 939 855 A 60 LEU H A 60 LEU HBx 1.0 . 3.92 940 856 A 60 LEU H A 60 LEU HBy 1.0 . 3.92 941 857 A 63 THR HB A 60 LEU H 1.0 . 5.08 942 858 A 61 LEU H A 60 LEU H 1.0 . 4.14 943 859 A 63 THR HB A 61 LEU H 1.0 . 5.57 944 860 A 58 ASP H A 62 ALA H 1.0 . 5.24 945 861 A 62 ALA H A 59 SER HB2 1.0 . 6.23 946 861 A 59 SER HB3 A 62 ALA H 1.0 . 6.23 947 862 A 60 LEU H A 62 ALA H 1.0 . 4.75 948 863 A 61 LEU H A 62 ALA H 1.0 . 4.30 949 864 A 63 THR HB A 62 ALA H 1.0 . 5.57 950 865 A 60 LEU HA A 63 THR H 1.0 . 4.53 951 866 A 61 LEU H A 63 THR H 1.0 . 5.84 952 867 A 62 ALA H A 63 THR H 1.0 . 4.30 953 868 A 63 THR HB A 63 THR H 1.0 . 3.92 954 869 A 61 LEU H A 64 ARG H 1.0 . 5.79 955 870 A 62 ALA HA A 64 ARG H 1.0 . 6.40 956 871 A 63 THR HB A 64 ARG H 1.0 . 4.30 957 872 A 64 ARG H A 65 LEU H 1.0 . 4.20 958 873 A 63 THR H A 65 LEU H 1.0 . 4.36 959 874 A 65 LEU H A 64 ARG HB2 1.0 . 6.23 960 874 A 64 ARG HB3 A 65 LEU H 1.0 . 6.23 961 875 A 65 LEU H A 65 LEU HBx 1.0 . 3.87 962 876 A 65 LEU H A 65 LEU HBy 1.0 . 3.87 963 877 A 65 LEU H A 66 THR H 1.0 . 4.20 964 878 A 62 ALA HA A 66 THR H 1.0 . 4.75 965 879 A 63 THR HB A 66 THR H 1.0 . 6.45 966 880 A 66 THR H A 65 LEU HBx 1.0 . 4.25 967 881 A 66 THR H A 65 LEU HBy 1.0 . 4.25 968 882 A 65 LEU H A 67 GLY H 1.0 . 6.07 969 883 A 67 GLY H A 65 LEU HBx 1.0 . 5.51 970 884 A 67 GLY H A 65 LEU HBy 1.0 . 5.51 971 885 A 66 THR H A 67 GLY H 1.0 . 4.36 972 886 A 66 THR HB A 67 GLY H 1.0 . 5.29 973 887 A 66 THR HB A 68 GLN H 1.0 . 6.01 974 888 A 67 GLY H A 68 GLN H 1.0 . 4.25 975 889 A 66 THR HB A 69 LEU H 1.0 . 5.08 976 890 A 67 GLY H A 69 LEU H 1.0 . 5.84 977 891 A 68 GLN H A 69 LEU H 1.0 . 4.36 978 892 A 69 LEU H A 70 HIS H 1.0 . 4.47 979 893 A 70 HIS HA A 69 LEU H 1.0 . 6.95 980 894 A 66 THR HB A 70 HIS H 1.0 . 5.08 981 895 A 70 HIS H A 69 LEU HBx 1.0 . 4.58 982 896 A 70 HIS H A 69 LEU HBy 1.0 . 4.58 983 897 A 69 LEU HA A 71 GLN H 1.0 . 4.14 984 898 A 70 HIS H A 71 GLN H 1.0 . 4.20 985 899 A 72 ALA HA A 71 GLN H 1.0 . 4.86 986 900 A 69 LEU HA A 72 ALA H 1.0 . 4.25 987 901 A 70 HIS H A 72 ALA H 1.0 . 5.13 988 902 A 70 HIS HA A 72 ALA H 1.0 . 5.79 989 903 A 71 GLN H A 72 ALA H 1.0 . 4.14 990 904 A 72 ALA H A 71 GLN HB2 1.0 . 5.79 991 904 A 71 GLN HB3 A 72 ALA H 1.0 . 5.79 992 905 A 70 HIS HA A 73 GLY H 1.0 . 5.08 993 906 A 73 GLY H A 71 GLN HB2 1.0 . 7.66 994 906 A 71 GLN HB3 A 73 GLY H 1.0 . 7.66 995 907 A 72 ALA H A 73 GLY H 1.0 . 3.75 996 908 A 73 GLY H A 74 TYR H 1.0 . 3.92 997 909 A 70 HIS HA A 74 TYR H 1.0 . 4.36 998 910 A 72 ALA H A 74 TYR H 1.0 . 4.91 999 911 A 75 GLU H A 76 ALA H 1.0 . 6.01 1000 912 A 74 TYR HA A 76 ALA H 1.0 . 5.57 1001 913 A 75 GLU HA A 76 ALA H 1.0 . 3.48 1002 914 A 76 ALA H A 75 GLU HBx 1.0 . 5.29 1003 915 A 76 ALA H A 75 GLU HBy 1.0 . 5.29 1004 916 A 76 ALA H A 77 GLN H 1.0 . 5.57 1005 917 A 77 GLN H A 80 ASP H 1.0 . 5.68 1006 918 A 78 LEU H A 77 GLN HBx 1.0 . 5.68 1007 919 A 78 LEU H A 77 GLN HBy 1.0 . 5.68 1008 920 A 78 LEU H A 79 SER H 1.0 . 5.02 1009 921 A 79 SER H A 77 GLN HBx 1.0 . 5.29 1010 922 A 79 SER H A 77 GLN HBy 1.0 . 5.29 1011 923 A 79 SER H A 78 LEU HB2 1.0 . 5.63 1012 923 A 78 LEU HB3 A 79 SER H 1.0 . 5.63 1013 924 A 79 SER H A 81 LEU H 1.0 . 5.90 1014 925 A 80 ASP H A 77 GLN HBx 1.0 . 4.58 1015 926 A 80 ASP H A 77 GLN HBy 1.0 . 4.58 1016 927 A 80 ASP H A 78 LEU H 1.0 . 6.17 1017 928 A 78 LEU HA A 80 ASP H 1.0 . 3.98 1018 929 A 80 ASP H A 79 SER H 1.0 . 4.53 1019 930 A 78 LEU HA A 81 LEU H 1.0 . 4.58 1020 931 A 81 LEU H A 79 SER HA 1.0 . 4.80 1021 932 A 81 LEU H A 80 ASP HBx 1.0 . 4.30 1022 933 A 81 LEU H A 80 ASP HBy 1.0 . 4.30 1023 934 A 78 LEU HA A 82 PHE H 1.0 . 5.51 1024 935 A 79 SER H A 82 PHE H 1.0 . 6.45 1025 936 A 80 ASP HA A 82 PHE H 1.0 . 6.34 1026 937 A 82 PHE H A 83 ASN H 1.0 . 4.30 1027 938 A 78 LEU HA A 83 ASN H 1.0 . 5.96 1028 939 A 80 ASP HA A 83 ASN H 1.0 . 5.08 1029 940 A 83 ASN H A 84 HIS H 1.0 . 3.92 1030 941 A 84 HIS HA A 83 ASN H 1.0 . 6.01 1031 942 A 80 ASP HA A 84 HIS H 1.0 . 5.35 1032 943 A 81 LEU HA A 84 HIS H 1.0 . 5.02 1033 944 A 49 GLU HA A 86 ARG H 1.0 . 5.29 1034 945 A 86 ARG H A 86 ARG HBx 1.0 . 4.14 1035 946 A 86 ARG H A 86 ARG HBy 1.0 . 4.14 1036 947 A 48 ARG HA A 87 LEU H 1.0 . 5.79 1037 948 A 49 GLU HA A 87 LEU H 1.0 . 6.07 1038 949 A 86 ARG H A 87 LEU H 1.0 . 5.57 1039 950 A 48 ARG HA A 88 ALA H 1.0 . 4.91 1040 951 A 49 GLU HA A 88 ALA H 1.0 . 5.79 1041 952 A 86 ARG HA A 88 ALA H 1.0 . 6.34 1042 953 A 88 ALA H A 89 ASP H 1.0 . 4.58 1043 954 A 88 ALA H A 90 PHE H 1.0 . 5.90 1044 955 A 86 ARG H A 89 ASP H 1.0 . 5.40 1045 956 A 86 ARG HA A 89 ASP H 1.0 . 7.00 1046 957 A 89 ASP H A 86 ARG HBx 1.0 . 5.35 1047 958 A 89 ASP H A 86 ARG HBy 1.0 . 5.35 1048 959 A 87 LEU HA A 89 ASP H 1.0 . 6.34 1049 960 A 90 PHE HA A 89 ASP H 1.0 . 5.90 1050 961 A 89 ASP H A 92 ALA H 1.0 . 4.58 1051 962 A 86 ARG H A 90 PHE H 1.0 . 6.12 1052 963 A 87 LEU HA A 90 PHE H 1.0 . 5.68 1053 964 A 88 ALA HA A 90 PHE H 1.0 . 5.51 1054 965 A 89 ASP H A 90 PHE H 1.0 . 4.08 1055 966 A 90 PHE H A 89 ASP HBx 1.0 . 4.58 1056 967 A 90 PHE H A 89 ASP HBy 1.0 . 4.58 1057 968 A 88 ALA HA A 91 ALA H 1.0 . 5.24 1058 969 A 89 ASP H A 91 ALA H 1.0 . 4.30 1059 970 A 89 ASP HA A 91 ALA H 1.0 . 6.12 1060 971 A 91 ALA H A 90 PHE HBx 1.0 . 5.02 1061 972 A 91 ALA H A 90 PHE HBy 1.0 . 5.02 1062 973 A 92 ALA H A 91 ALA H 1.0 . 4.08 1063 974 A 88 ALA HA A 92 ALA H 1.0 . 5.84 1064 975 A 89 ASP HA A 92 ALA H 1.0 . 5.19 1065 976 A 90 PHE HA A 92 ALA H 1.0 . 5.57 1066 977 A 89 ASP HA A 93 THR H 1.0 . 6.12 1067 978 A 90 PHE HA A 93 THR H 1.0 . 4.58 1068 979 A 91 ALA H A 93 THR H 1.0 . 5.96 1069 980 A 91 ALA HA A 93 THR H 1.0 . 5.62 1070 981 A 92 ALA H A 93 THR H 1.0 . 4.25 1071 982 A 93 THR H A 94 LEU H 1.0 . 3.98 1072 983 A 91 ALA HA A 94 LEU H 1.0 . 5.08 1073 984 A 94 LEU H A 95 ARG H 1.0 . 5.35 1074 985 A 74 TYR HA A 95 ARG H 1.0 . 6.23 1075 986 A 75 GLU H A 95 ARG H 1.0 . 4.96 1076 987 A 94 LEU HA A 95 ARG H 1.0 . 3.48 1077 988 A 95 ARG H A 96 LYS H 1.0 . 5.24 1078 989 A 74 TYR HA A 96 LYS H 1.0 . 6.12 1079 990 A 96 LYS H A 96 LYS HBx 1.0 . 4.08 1080 991 A 96 LYS H A 96 LYS HBy 1.0 . 4.08 1081 992 A 74 TYR HA A 97 THR H 1.0 . 4.36 1082 993 A 75 GLU H A 97 THR H 1.0 . 5.24 1083 994 A 96 LYS H A 97 THR H 1.0 . 5.68 1084 995 A 96 LYS HA A 97 THR H 1.0 . 3.54 1085 996 A 97 THR H A 96 LYS HBx 1.0 . 5.13 1086 997 A 97 THR H A 96 LYS HBy 1.0 . 5.13 1087 998 A 98 ASP H A 96 LYS HBy 1.0 . 7.00 1088 999 A 97 THR HB A 98 ASP H 1.0 . 4.69 1089 1000 A 98 ASP H A 99 VAL H 1.0 . 4.69 1090 1001 A 97 THR HB A 99 VAL H 1.0 . 5.35 1091 1002 A 99 VAL H A 99 VAL HB 1.0 . 4.08 1092 1003 A 106 VAL H A 105 PHE HB2 1.0 . 7.61 1093 1003 A 105 PHE HB3 A 106 VAL H 1.0 . 7.61 1094 1004 A 3 ILE H A 3 ILE HG1y 1.0 . 7.00 1095 1005 A 5 TYR HD% A 5 TYR H 1.0 . 9.13 1096 1006 A 6 GLN H A 6 GLN HG2 1.0 . 7.66 1097 1006 A 6 GLN H A 6 GLN HG3 1.0 . 7.66 1098 1007 A 10 ARG H A 10 ARG HGx 1.0 . 7.00 1099 1008 A 15 GLU H A 15 GLU HG2 1.0 . 7.88 1100 1008 A 15 GLU H A 15 GLU HG3 1.0 . 7.88 1101 1009 A 16 ALA H A 15 GLU HG2 1.0 . 7.88 1102 1009 A 16 ALA H A 15 GLU HG3 1.0 . 7.88 1103 1010 A 17 GLU H A 17 GLU HG2 1.0 . 6.95 1104 1010 A 17 GLU H A 17 GLU HG3 1.0 . 6.95 1105 1011 A 18 ASN H A 17 GLU HG2 1.0 . 7.88 1106 1011 A 17 GLU HG3 A 18 ASN H 1.0 . 7.88 1107 1012 A 21 GLU H A 21 GLU HG2 1.0 . 6.67 1108 1012 A 21 GLU H A 21 GLU HG3 1.0 . 6.67 1109 1013 A 22 ALA H A 21 GLU HG2 1.0 . 7.88 1110 1013 A 22 ALA H A 21 GLU HG3 1.0 . 7.88 1111 1014 A 23 ASP H A 21 GLU HG2 1.0 . 7.88 1112 1014 A 23 ASP H A 21 GLU HG3 1.0 . 7.88 1113 1015 A 23 ASP H A 24 LEU HG 1.0 . 6.67 1114 1016 A 23 ASP H A 48 ARG HD2 1.0 . 7.88 1115 1016 A 48 ARG HD3 A 23 ASP H 1.0 . 7.88 1116 1017 A 24 LEU H A 24 LEU HG 1.0 . 4.08 1117 1018 A 24 LEU H A 25 PRO HDx 1.0 . 7.00 1118 1019 A 24 LEU H A 25 PRO HDy 1.0 . 7.00 1119 1020 A 24 LEU H A 26 GLN HG2 1.0 . 7.88 1120 1020 A 26 GLN HG3 A 24 LEU H 1.0 . 7.88 1121 1021 A 24 LEU H A 48 ARG HD2 1.0 . 7.88 1122 1021 A 48 ARG HD3 A 24 LEU H 1.0 . 7.88 1123 1022 A 26 GLN H A 26 GLN HG2 1.0 . 6.62 1124 1022 A 26 GLN HG3 A 26 GLN H 1.0 . 6.62 1125 1023 A 26 GLN H A 48 ARG HD2 1.0 . 7.22 1126 1023 A 48 ARG HD3 A 26 GLN H 1.0 . 7.22 1127 1024 A 26 GLN HE21 A 48 ARG HD2 1.0 . 7.88 1128 1024 A 48 ARG HD3 A 26 GLN HE21 1.0 . 7.88 1129 1025 A 26 GLN HE22 A 48 ARG HD2 1.0 . 7.88 1130 1025 A 48 ARG HD3 A 26 GLN HE22 1.0 . 7.88 1131 1026 A 27 GLY H A 26 GLN HG2 1.0 . 7.88 1132 1026 A 26 GLN HG3 A 27 GLY H 1.0 . 7.88 1133 1027 A 27 GLY H A 31 LYS HE2 1.0 . 7.88 1134 1027 A 31 LYS HE3 A 27 GLY H 1.0 . 7.88 1135 1028 A 29 ILE H A 29 ILE HG12 1.0 . 6.73 1136 1028 A 29 ILE HG13 A 29 ILE H 1.0 . 6.73 1137 1029 A 30 GLU H A 29 ILE HG12 1.0 . 7.50 1138 1029 A 29 ILE HG13 A 30 GLU H 1.0 . 7.50 1139 1030 A 31 LYS H A 31 LYS HE2 1.0 . 7.88 1140 1030 A 31 LYS HE3 A 31 LYS H 1.0 . 7.88 1141 1031 A 32 GLN H A 31 LYS HGy 1.0 . 7.00 1142 1032 A 36 LEU HG A 36 LEU H 1.0 . 3.92 1143 1033 A 36 LEU HG A 37 TRP H 1.0 . 5.96 1144 1034 A 37 TRP HD1 A 37 TRP H 1.0 . 4.75 1145 1035 A 37 TRP HD1 A 38 GLN H 1.0 . 7.00 1146 1036 A 39 GLN H A 39 GLN HGx 1.0 . 5.08 1147 1037 A 39 GLN H A 39 GLN HGy 1.0 . 5.08 1148 1038 A 40 LEU HG A 39 GLN H 1.0 . 6.50 1149 1039 A 40 LEU HG A 40 LEU H 1.0 . 3.42 1150 1040 A 40 LEU HG A 41 LEU H 1.0 . 6.34 1151 1041 A 41 LEU HG A 41 LEU H 1.0 . 3.92 1152 1042 A 41 LEU HG A 42 SER H 1.0 . 5.24 1153 1043 A 48 ARG H A 48 ARG HG2 1.0 . 5.63 1154 1043 A 48 ARG H A 48 ARG HG3 1.0 . 5.63 1155 1044 A 48 ARG H A 48 ARG HD2 1.0 . 7.88 1156 1044 A 48 ARG HD3 A 48 ARG H 1.0 . 7.88 1157 1045 A 49 GLU H A 23 ASP HBx 1.0 . 7.00 1158 1046 A 52 PHE HD% A 52 PHE H 1.0 . 9.13 1159 1047 A 52 PHE HD% A 53 PHE H 1.0 . 9.07 1160 1048 A 53 PHE HD% A 53 PHE H 1.0 . 7.37 1161 1049 A 55 GLN H A 55 GLN HG2 1.0 . 6.23 1162 1049 A 55 GLN HG3 A 55 GLN H 1.0 . 6.23 1163 1050 A 52 PHE HE% A 57 GLY H 1.0 . 9.13 1164 1051 A 52 PHE HE% A 58 ASP H 1.0 . 7.76 1165 1052 A 52 PHE HZ A 58 ASP H 1.0 . 4.69 1166 1053 A 53 PHE HD% A 58 ASP H 1.0 . 9.13 1167 1054 A 53 PHE HE% A 58 ASP H 1.0 . 9.13 1168 1055 A 61 LEU HG A 58 ASP H 1.0 . 5.96 1169 1056 A 60 LEU H A 60 LEU HG 1.0 . 4.75 1170 1057 A 52 PHE HZ A 61 LEU H 1.0 . 7.00 1171 1058 A 61 LEU HG A 61 LEU H 1.0 . 3.92 1172 1059 A 52 PHE HE% A 62 ALA H 1.0 . 7.81 1173 1060 A 52 PHE HZ A 62 ALA H 1.0 . 5.29 1174 1061 A 61 LEU HG A 62 ALA H 1.0 . 5.79 1175 1062 A 64 ARG H A 64 ARG HD2 1.0 . 7.88 1176 1062 A 64 ARG HD3 A 64 ARG H 1.0 . 7.88 1177 1063 A 65 LEU H A 64 ARG HD2 1.0 . 7.88 1178 1063 A 64 ARG HD3 A 65 LEU H 1.0 . 7.88 1179 1064 A 67 GLY H A 68 GLN HGx 1.0 . 7.00 1180 1065 A 67 GLY H A 68 GLN HGy 1.0 . 7.00 1181 1066 A 68 GLN H A 68 GLN HGx 1.0 . 4.63 1182 1067 A 68 GLN H A 68 GLN HGy 1.0 . 4.63 1183 1068 A 69 LEU HG A 69 LEU H 1.0 . 4.25 1184 1069 A 69 LEU HG A 70 HIS H 1.0 . 6.01 1185 1070 A 74 TYR HD% A 72 ALA H 1.0 . 9.13 1186 1071 A 74 TYR HD% A 73 GLY H 1.0 . 9.13 1187 1072 A 74 TYR HD% A 74 TYR H 1.0 . 7.75 1188 1073 A 74 TYR HE% A 74 TYR H 1.0 . 9.13 1189 1074 A 74 TYR HD% A 75 GLU H 1.0 . 9.13 1190 1075 A 90 PHE HE% A 76 ALA H 1.0 . 9.13 1191 1076 A 90 PHE HD% A 77 GLN H 1.0 . 9.13 1192 1077 A 90 PHE HE% A 77 GLN H 1.0 . 9.13 1193 1078 A 82 PHE HD% A 79 SER H 1.0 . 9.13 1194 1079 A 81 LEU HG A 81 LEU H 1.0 . 3.26 1195 1080 A 53 PHE HZ A 82 PHE H 1.0 . 7.00 1196 1081 A 81 LEU HG A 82 PHE H 1.0 . 5.40 1197 1082 A 86 ARG H A 86 ARG HDx 1.0 . 6.56 1198 1083 A 86 ARG H A 86 ARG HDy 1.0 . 6.56 1199 1084 A 37 TRP HE3 A 87 LEU H 1.0 . 5.29 1200 1085 A 37 TRP HZ2 A 87 LEU H 1.0 . 7.00 1201 1086 A 37 TRP HZ3 A 87 LEU H 1.0 . 6.12 1202 1087 A 37 TRP HH2 A 87 LEU H 1.0 . 5.24 1203 1088 A 87 LEU HG A 87 LEU H 1.0 . 7.00 1204 1089 A 37 TRP HH2 A 88 ALA H 1.0 . 7.00 1205 1090 A 87 LEU HG A 88 ALA H 1.0 . 7.00 1206 1091 A 90 PHE HD% A 90 PHE H 1.0 . 8.63 1207 1092 A 87 LEU HG A 91 ALA H 1.0 . 7.00 1208 1093 A 94 LEU H A 94 LEU HG 1.0 . 3.98 1209 1094 A 74 TYR HD% A 95 ARG H 1.0 . 9.13 1210 1095 A 74 TYR HE% A 95 ARG H 1.0 . 9.13 1211 1096 A 95 ARG H A 94 LEU HG 1.0 . 5.35 1212 1097 A 95 ARG H A 95 ARG HG2 1.0 . 6.12 1213 1097 A 95 ARG H A 95 ARG HG3 1.0 . 6.12 1214 1098 A 95 ARG H A 95 ARG HDx 1.0 . 7.00 1215 1099 A 95 ARG H A 95 ARG HDy 1.0 . 7.00 1216 1100 A 74 TYR HD% A 96 LYS H 1.0 . 9.13 1217 1101 A 74 TYR HE% A 96 LYS H 1.0 . 9.13 1218 1102 A 96 LYS H A 96 LYS HD2 1.0 . 7.88 1219 1102 A 96 LYS HD3 A 96 LYS H 1.0 . 7.88 1220 1103 A 96 LYS H A 96 LYS HE2 1.0 . 7.88 1221 1103 A 96 LYS HE3 A 96 LYS H 1.0 . 7.88 1222 1104 A 74 TYR HD% A 97 THR H 1.0 . 9.13 1223 1105 A 97 THR H A 96 LYS HD2 1.0 . 7.88 1224 1105 A 96 LYS HD3 A 97 THR H 1.0 . 7.88 1225 1106 A 102 GLU H A 102 GLU HG2 1.0 . 7.88 1226 1106 A 102 GLU H A 102 GLU HG3 1.0 . 7.88 1227 1107 A 103 GLN H A 103 GLN HG2 1.0 . 7.88 1228 1107 A 103 GLN H A 103 GLN HG3 1.0 . 7.88 1229 1108 A 3 ILE HG2% A 3 ILE H 1.0 . 8.02 1230 1109 A 3 ILE HD1% A 3 ILE H 1.0 . 8.02 1231 1110 A 3 ILE HG2% A 4 ASP H 1.0 . 7.91 1232 1111 A 7 ALA HB% A 8 LEU H 1.0 . 6.20 1233 1112 A 8 LEU H A 8 LEU HDy% 1.0 . 8.02 1234 1113 A 17 GLU H A 16 ALA HB% 1.0 . 5.49 1235 1114 A 21 GLU H A 20 ALA HB% 1.0 . 5.05 1236 1115 A 22 ALA HB% A 22 ALA H 1.0 . 4.06 1237 1116 A 22 ALA HB% A 23 ASP H 1.0 . 4.77 1238 1117 A 23 ASP H A 24 LEU HDx% 1.0 . 7.91 1239 1118 A 23 ASP H A 24 LEU HDy% 1.0 . 7.91 1240 1119 A 22 ALA HB% A 24 LEU H 1.0 . 5.76 1241 1120 A 24 LEU H A 24 LEU HDx% 1.0 . 5.98 1242 1121 A 24 LEU H A 24 LEU HDy% 1.0 . 5.98 1243 1122 A 29 ILE HG2% A 29 ILE H 1.0 . 5.65 1244 1123 A 29 ILE HD1% A 29 ILE H 1.0 . 5.49 1245 1124 A 29 ILE HG2% A 30 GLU H 1.0 . 5.27 1246 1125 A 29 ILE HD1% A 30 GLU H 1.0 . 6.76 1247 1126 A 29 ILE HG2% A 32 GLN H 1.0 . 7.63 1248 1127 A 34 ALA HB% A 32 GLN H 1.0 . 6.64 1249 1128 A 33 VAL H A 33 VAL HGx% 1.0 . 5.60 1250 1129 A 33 VAL H A 33 VAL HGy% 1.0 . 5.60 1251 1130 A 34 ALA HB% A 33 VAL H 1.0 . 5.87 1252 1131 A 34 ALA H A 33 VAL HGx% 1.0 . 5.65 1253 1132 A 34 ALA H A 33 VAL HGy% 1.0 . 5.65 1254 1133 A 34 ALA HB% A 34 ALA H 1.0 . 4.00 1255 1134 A 34 ALA HB% A 35 ALA H 1.0 . 4.50 1256 1135 A 35 ALA HB% A 35 ALA H 1.0 . 4.00 1257 1136 A 34 ALA HB% A 36 LEU H 1.0 . 6.59 1258 1137 A 34 ALA HB% A 37 TRP H 1.0 . 6.53 1259 1138 A 35 ALA HB% A 37 TRP H 1.0 . 5.43 1260 1139 A 34 ALA HB% A 38 GLN H 1.0 . 6.81 1261 1140 A 35 ALA HB% A 38 GLN H 1.0 . 6.48 1262 1141 A 35 ALA HB% A 39 GLN H 1.0 . 6.81 1263 1142 A 40 LEU H A 41 LEU HDx% 1.0 . 8.02 1264 1143 A 40 LEU H A 41 LEU HDy% 1.0 . 8.02 1265 1144 A 41 LEU H A 41 LEU HDx% 1.0 . 6.09 1266 1145 A 41 LEU H A 41 LEU HDy% 1.0 . 6.09 1267 1146 A 43 THR HG2% A 41 LEU H 1.0 . 6.20 1268 1147 A 43 THR HG2% A 42 SER H 1.0 . 5.82 1269 1148 A 43 THR HG2% A 43 THR H 1.0 . 4.61 1270 1149 A 43 THR HG2% A 44 GLY H 1.0 . 6.53 1271 1150 A 43 THR HG2% A 45 ASN H 1.0 . 5.49 1272 1151 A 47 THR HG2% A 47 THR H 1.0 . 4.44 1273 1152 A 47 THR HG2% A 48 ARG H 1.0 . 5.54 1274 1153 A 47 THR HG2% A 49 GLU H 1.0 . 6.15 1275 1154 A 47 THR HG2% A 50 THR H 1.0 . 6.04 1276 1155 A 50 THR HG2% A 50 THR H 1.0 . 5.43 1277 1156 A 50 THR H A 87 LEU HDx% 1.0 . 7.80 1278 1157 A 50 THR H A 87 LEU HDy% 1.0 . 7.80 1279 1158 A 50 THR HG2% A 51 ASP H 1.0 . 4.88 1280 1159 A 56 GLY H A 41 LEU HDx% 1.0 . 8.02 1281 1160 A 56 GLY H A 41 LEU HDy% 1.0 . 8.02 1282 1161 A 62 ALA HB% A 62 ALA H 1.0 . 4.11 1283 1162 A 63 THR HG2% A 63 THR H 1.0 . 4.28 1284 1163 A 64 ARG H A 60 LEU HDx% 1.0 . 7.25 1285 1164 A 64 ARG H A 60 LEU HDy% 1.0 . 7.25 1286 1165 A 63 THR HG2% A 64 ARG H 1.0 . 5.27 1287 1166 A 65 LEU H A 65 LEU HDx% 1.0 . 5.98 1288 1167 A 65 LEU H A 65 LEU HDy% 1.0 . 5.98 1289 1168 A 66 THR HG2% A 66 THR H 1.0 . 4.72 1290 1169 A 63 THR HG2% A 67 GLY H 1.0 . 6.48 1291 1170 A 66 THR HG2% A 67 GLY H 1.0 . 6.20 1292 1171 A 66 THR HG2% A 68 GLN H 1.0 . 6.81 1293 1172 A 66 THR HG2% A 69 LEU H 1.0 . 5.98 1294 1173 A 69 LEU H A 69 LEU HDx% 1.0 . 5.60 1295 1174 A 69 LEU H A 69 LEU HDy% 1.0 . 5.60 1296 1175 A 66 THR HG2% A 70 HIS H 1.0 . 7.08 1297 1176 A 72 ALA HB% A 71 GLN H 1.0 . 5.87 1298 1177 A 72 ALA HB% A 72 ALA H 1.0 . 4.06 1299 1178 A 72 ALA HB% A 73 GLY H 1.0 . 5.38 1300 1179 A 72 ALA HB% A 74 TYR H 1.0 . 5.32 1301 1180 A 66 THR HG2% A 76 ALA H 1.0 . 7.41 1302 1181 A 66 THR HG2% A 77 GLN H 1.0 . 6.97 1303 1182 A 76 ALA HB% A 77 GLN H 1.0 . 4.94 1304 1183 A 66 THR HG2% A 78 LEU H 1.0 . 6.53 1305 1184 A 78 LEU H A 78 LEU HD1% 1.0 . 8.60 1306 1184 A 78 LEU HD2% A 78 LEU H 1.0 . 8.60 1307 1185 A 79 SER H A 78 LEU HD1% 1.0 . 8.82 1308 1185 A 78 LEU HD2% A 79 SER H 1.0 . 8.82 1309 1186 A 81 LEU H A 81 LEU HDx% 1.0 . 6.64 1310 1187 A 81 LEU H A 81 LEU HDy% 1.0 . 6.64 1311 1188 A 82 PHE H A 81 LEU HDx% 1.0 . 7.80 1312 1189 A 82 PHE H A 81 LEU HDy% 1.0 . 7.80 1313 1190 A 87 LEU H A 87 LEU HDx% 1.0 . 7.19 1314 1191 A 87 LEU H A 87 LEU HDy% 1.0 . 7.19 1315 1192 A 88 ALA H A 87 LEU HDx% 1.0 . 6.70 1316 1193 A 88 ALA H A 87 LEU HDy% 1.0 . 6.70 1317 1194 A 88 ALA HB% A 88 ALA H 1.0 . 4.00 1318 1195 A 88 ALA HB% A 89 ASP H 1.0 . 4.77 1319 1196 A 29 ILE HG2% A 91 ALA H 1.0 . 5.98 1320 1197 A 91 ALA HB% A 91 ALA H 1.0 . 4.17 1321 1198 A 91 ALA H A 94 LEU HDx% 1.0 . 7.14 1322 1199 A 91 ALA H A 94 LEU HDy% 1.0 . 7.14 1323 1200 A 91 ALA HB% A 92 ALA H 1.0 . 4.83 1324 1201 A 92 ALA HB% A 92 ALA H 1.0 . 4.00 1325 1202 A 91 ALA HB% A 93 THR H 1.0 . 5.38 1326 1203 A 92 ALA HB% A 93 THR H 1.0 . 5.32 1327 1204 A 93 THR HG2% A 93 THR H 1.0 . 4.44 1328 1205 A 93 THR H A 94 LEU HDx% 1.0 . 7.69 1329 1206 A 93 THR H A 94 LEU HDy% 1.0 . 7.69 1330 1207 A 29 ILE HG2% A 94 LEU H 1.0 . 6.31 1331 1208 A 92 ALA HB% A 94 LEU H 1.0 . 6.26 1332 1209 A 94 LEU H A 94 LEU HDx% 1.0 . 5.65 1333 1210 A 94 LEU H A 94 LEU HDy% 1.0 . 5.65 1334 1211 A 97 THR HG2% A 97 THR H 1.0 . 5.10 1335 1212 A 97 THR HG2% A 98 ASP H 1.0 . 5.76 1336 1213 A 97 THR HG2% A 99 VAL H 1.0 . 6.42 1337 1214 A 99 VAL H A 99 VAL HGx% 1.0 . 5.54 1338 1215 A 99 VAL H A 99 VAL HGy% 1.0 . 5.54 1339 1216 A 21 GLU H A 20 ALA H 1.0 . 3.59 1340 1217 A 22 ALA H A 23 ASP H 1.0 . 4.14 1341 1218 A 27 GLY H A 28 ASP H 1.0 . 4.80 1342 1219 A 31 LYS H A 28 ASP H 1.0 . 6.56 1343 1220 A 32 GLN HA A 31 LYS H 1.0 . 7.00 1344 1221 A 33 VAL HB A 32 GLN H 1.0 . 7.00 1345 1222 A 31 LYS H A 33 VAL H 1.0 . 7.00 1346 1223 A 34 ALA HA A 33 VAL H 1.0 . 7.00 1347 1224 A 31 LYS H A 34 ALA H 1.0 . 7.00 1348 1225 A 32 GLN HA A 35 ALA H 1.0 . 7.00 1349 1226 A 32 GLN HA A 36 LEU H 1.0 . 7.00 1350 1227 A 35 ALA HA A 37 TRP H 1.0 . 7.00 1351 1228 A 43 THR H A 41 LEU HB2 1.0 . 7.88 1352 1228 A 41 LEU HB3 A 43 THR H 1.0 . 7.88 1353 1229 A 43 THR H A 42 SER HB2 1.0 . 7.88 1354 1229 A 43 THR H A 42 SER HB3 1.0 . 7.88 1355 1230 A 43 THR HB A 44 GLY H 1.0 . 7.00 1356 1231 A 43 THR HA A 45 ASN H 1.0 . 7.00 1357 1232 A 43 THR HB A 45 ASN H 1.0 . 7.00 1358 1233 A 47 THR HA A 49 GLU H 1.0 . 7.00 1359 1234 A 47 THR HA A 50 THR H 1.0 . 7.00 1360 1235 A 52 PHE H A 54 GLN H 1.0 . 5.19 1361 1236 A 55 GLN HA A 54 GLN H 1.0 . 7.00 1362 1237 A 62 ALA H A 64 ARG H 1.0 . 6.45 1363 1238 A 61 LEU HA A 64 ARG H 1.0 . 7.00 1364 1239 A 62 ALA HA A 65 LEU H 1.0 . 7.00 1365 1240 A 63 THR HB A 65 LEU H 1.0 . 7.00 1366 1241 A 62 ALA HA A 67 GLY H 1.0 . 7.00 1367 1242 A 69 LEU H A 67 GLY HAy 1.0 . 7.00 1368 1243 A 69 LEU H A 67 GLY HAx 1.0 . 7.00 1369 1244 A 69 LEU H A 70 HIS HBx 1.0 . 7.00 1370 1245 A 69 LEU H A 70 HIS HBy 1.0 . 7.00 1371 1246 A 69 LEU H A 71 GLN H 1.0 . 7.00 1372 1247 A 71 GLN H A 73 GLY H 1.0 . 5.74 1373 1248 A 75 GLU HA A 74 TYR H 1.0 . 7.00 1374 1249 A 74 TYR H A 75 GLU H 1.0 . 5.84 1375 1250 A 76 ALA HA A 75 GLU H 1.0 . 7.00 1376 1251 A 76 ALA HA A 78 LEU H 1.0 . 7.00 1377 1252 A 78 LEU H A 81 LEU H 1.0 . 6.72 1378 1253 A 76 ALA HA A 79 SER H 1.0 . 7.00 1379 1254 A 77 GLN HA A 79 SER H 1.0 . 7.00 1380 1255 A 81 LEU HA A 83 ASN H 1.0 . 7.00 1381 1256 A 81 LEU H A 84 HIS H 1.0 . 5.24 1382 1257 A 84 HIS HA A 86 ARG H 1.0 . 7.00 1383 1258 A 51 ASP HA A 87 LEU H 1.0 . 7.00 1384 1259 A 91 ALA HA A 90 PHE H 1.0 . 7.00 1385 1260 A 87 LEU HA A 91 ALA H 1.0 . 7.00 1386 1261 A 90 PHE H A 92 ALA H 1.0 . 7.00 1387 1262 A 92 ALA H A 94 LEU H 1.0 . 5.19 1388 1263 A 90 PHE H A 93 THR H 1.0 . 5.96 1389 1264 A 90 PHE HA A 94 LEU H 1.0 . 7.00 1390 1265 A 98 ASP H A 96 LYS HBx 1.0 . 7.00 1391 1266 A 76 ALA HA A 66 THR H 1.0 . 7.00 1392 1267 A 76 ALA HA A 67 GLY H 1.0 . 7.00 1393 1268 A 80 ASP HA A 79 SER H 1.0 . 7.00 1394 1269 A 90 PHE HA A 87 LEU H 1.0 . 7.00 1395 1270 A 3 ILE H A 3 ILE HG1x 1.0 . 7.00 1396 1271 A 8 LEU H A 8 LEU HG 1.0 . 7.00 1397 1272 A 9 LYS H A 9 LYS HGx 1.0 . 7.00 1398 1273 A 9 LYS H A 9 LYS HGy 1.0 . 7.00 1399 1274 A 9 LYS H A 9 LYS HD2 1.0 . 7.88 1400 1274 A 9 LYS HD3 A 9 LYS H 1.0 . 7.88 1401 1275 A 10 ARG H A 10 ARG HGy 1.0 . 7.00 1402 1276 A 12 HIS HD2 A 12 HIS H 1.0 . 7.00 1403 1277 A 32 GLN H A 31 LYS HGx 1.0 . 7.00 1404 1278 A 41 LEU HG A 43 THR H 1.0 . 7.00 1405 1279 A 49 GLU H A 23 ASP HBy 1.0 . 7.00 1406 1280 A 49 GLU H A 48 ARG HG2 1.0 . 7.88 1407 1280 A 49 GLU H A 48 ARG HG3 1.0 . 7.88 1408 1281 A 53 PHE HE% A 53 PHE H 1.0 . 9.13 1409 1282 A 52 PHE HE% A 61 LEU H 1.0 . 9.13 1410 1283 A 78 LEU HG A 78 LEU H 1.0 . 7.00 1411 1284 A 78 LEU HG A 79 SER H 1.0 . 7.00 1412 1285 A 90 PHE HD% A 89 ASP H 1.0 . 9.13 1413 1286 A 8 LEU H A 8 LEU HDx% 1.0 . 8.02 1414 1287 A 18 ASN H A 16 ALA HB% 1.0 . 8.02 1415 1288 A 37 TRP H A 36 LEU HDx% 1.0 . 8.02 1416 1289 A 37 TRP H A 36 LEU HDy% 1.0 . 8.02 1417 1290 A 58 ASP H A 60 LEU HDx% 1.0 . 8.02 1418 1291 A 58 ASP H A 60 LEU HDy% 1.0 . 8.02 1419 1292 A 64 ARG H A 61 LEU HDx% 1.0 . 8.02 1420 1293 A 64 ARG H A 61 LEU HDy% 1.0 . 8.02 1421 1294 A 63 THR HG2% A 65 LEU H 1.0 . 8.02 1422 1295 A 63 THR HG2% A 66 THR H 1.0 . 8.02 1423 1296 A 7 ALA HB% A 4 ASP HBx 1.0 . 5.94 1424 1296 A 7 ALA HB% A 4 ASP HBy 1.0 . 5.94 1425 1297 A 8 LEU H A 8 LEU HDx% 1.0 . 6.61 1426 1297 A 8 LEU H A 8 LEU HDy% 1.0 . 6.61 1427 1298 A 9 LYS H A 9 LYS HBx 1.0 . 3.44 1428 1298 A 9 LYS H A 9 LYS HBy 1.0 . 3.44 1429 1299 A 9 LYS HBx A 9 LYS HD2 1.0 . 3.37 1430 1299 A 9 LYS HBy A 9 LYS HD2 1.0 . 3.37 1431 1299 A 9 LYS HD3 A 9 LYS HBx 1.0 . 3.37 1432 1299 A 9 LYS HD3 A 9 LYS HBy 1.0 . 3.37 1433 1300 A 10 ARG HBx A 10 ARG HGy 1.0 . 2.32 1434 1300 A 10 ARG HBy A 10 ARG HGy 1.0 . 2.32 1435 1300 A 10 ARG HGx A 10 ARG HBx 1.0 . 2.32 1436 1300 A 10 ARG HBy A 10 ARG HGx 1.0 . 2.32 1437 1301 A 13 THR HB A 14 PRO HDx 1.0 . 5.49 1438 1301 A 13 THR HB A 14 PRO HDy 1.0 . 5.49 1439 1302 A 21 GLU H A 18 ASN HBx 1.0 . 6.23 1440 1302 A 21 GLU H A 18 ASN HBy 1.0 . 6.23 1441 1303 A 20 ALA H A 23 ASP HBy 1.0 . 5.67 1442 1303 A 20 ALA H A 23 ASP HBx 1.0 . 5.67 1443 1304 A 21 GLU H A 21 GLU HBy 1.0 . 3.69 1444 1304 A 21 GLU H A 21 GLU HBx 1.0 . 3.69 1445 1305 A 23 ASP H A 21 GLU HBy 1.0 . 5.13 1446 1305 A 23 ASP H A 21 GLU HBx 1.0 . 5.13 1447 1306 A 23 ASP H A 24 LEU HBx 1.0 . 4.75 1448 1306 A 23 ASP H A 24 LEU HBy 1.0 . 4.75 1449 1307 A 23 ASP H A 24 LEU HDx% 1.0 . 6.58 1450 1307 A 23 ASP H A 24 LEU HDy% 1.0 . 6.58 1451 1308 A 47 THR HA A 23 ASP HBy 1.0 . 5.32 1452 1308 A 47 THR HA A 23 ASP HBx 1.0 . 5.32 1453 1309 A 47 THR HB A 23 ASP HBy 1.0 . 4.41 1454 1309 A 47 THR HB A 23 ASP HBx 1.0 . 4.41 1455 1310 A 47 THR HG2% A 23 ASP HBy 1.0 . 5.49 1456 1310 A 47 THR HG2% A 23 ASP HBx 1.0 . 5.49 1457 1311 A 48 ARG H A 23 ASP HBy 1.0 . 5.86 1458 1311 A 48 ARG H A 23 ASP HBx 1.0 . 5.86 1459 1312 A 24 LEU H A 24 LEU HDx% 1.0 . 5.04 1460 1312 A 24 LEU H A 24 LEU HDy% 1.0 . 5.04 1461 1313 A 24 LEU HDx% A 25 PRO HDx 1.0 . 4.54 1462 1313 A 24 LEU HDy% A 25 PRO HDx 1.0 . 4.54 1463 1313 A 25 PRO HDy A 24 LEU HDx% 1.0 . 4.54 1464 1313 A 24 LEU HDy% A 25 PRO HDy 1.0 . 4.54 1465 1314 A 47 THR HA A 24 LEU HDx% 1.0 . 6.28 1466 1314 A 47 THR HA A 24 LEU HDy% 1.0 . 6.28 1467 1315 A 47 THR HB A 24 LEU HDx% 1.0 . 7.12 1468 1315 A 47 THR HB A 24 LEU HDy% 1.0 . 7.12 1469 1316 A 25 PRO HA A 87 LEU HDx% 1.0 . 6.00 1470 1316 A 25 PRO HA A 87 LEU HDy% 1.0 . 6.00 1471 1317 A 25 PRO HBy A 87 LEU HDx% 1.0 . 4.23 1472 1317 A 87 LEU HDy% A 25 PRO HBy 1.0 . 4.23 1473 1317 A 87 LEU HDy% A 25 PRO HBx 1.0 . 4.23 1474 1317 A 25 PRO HBx A 87 LEU HDx% 1.0 . 4.23 1475 1318 A 34 ALA HB% A 25 PRO HGx 1.0 . 5.07 1476 1318 A 34 ALA HB% A 25 PRO HGy 1.0 . 5.07 1477 1319 A 25 PRO HGy A 38 GLN HE21 1.0 . 6.46 1478 1319 A 38 GLN HE22 A 25 PRO HGx 1.0 . 6.46 1479 1319 A 25 PRO HGy A 38 GLN HE22 1.0 . 6.46 1480 1319 A 25 PRO HGx A 38 GLN HE21 1.0 . 6.46 1481 1320 A 47 THR HA A 25 PRO HGx 1.0 . 6.08 1482 1320 A 47 THR HA A 25 PRO HGy 1.0 . 6.08 1483 1321 A 47 THR HB A 25 PRO HGx 1.0 . 6.74 1484 1321 A 47 THR HB A 25 PRO HGy 1.0 . 6.74 1485 1322 A 25 PRO HGy A 87 LEU HDx% 1.0 . 4.75 1486 1322 A 25 PRO HGx A 87 LEU HDx% 1.0 . 4.75 1487 1322 A 87 LEU HDy% A 25 PRO HGx 1.0 . 4.75 1488 1322 A 87 LEU HDy% A 25 PRO HGy 1.0 . 4.75 1489 1323 A 47 THR HA A 25 PRO HDx 1.0 . 5.65 1490 1323 A 47 THR HA A 25 PRO HDy 1.0 . 5.65 1491 1324 A 48 ARG H A 25 PRO HDx 1.0 . 5.86 1492 1324 A 48 ARG H A 25 PRO HDy 1.0 . 5.86 1493 1325 A 25 PRO HDy A 87 LEU HDx% 1.0 . 6.13 1494 1325 A 25 PRO HDx A 87 LEU HDx% 1.0 . 6.13 1495 1325 A 87 LEU HDy% A 25 PRO HDx 1.0 . 6.13 1496 1325 A 25 PRO HDy A 87 LEU HDy% 1.0 . 6.13 1497 1326 A 26 GLN H A 26 GLN HBy 1.0 . 3.54 1498 1326 A 26 GLN H A 26 GLN HBx 1.0 . 3.54 1499 1327 A 26 GLN HE21 A 26 GLN HA 1.0 . 6.73 1500 1327 A 26 GLN HE22 A 26 GLN HA 1.0 . 6.73 1501 1328 A 29 ILE H A 27 GLY HAy 1.0 . 5.19 1502 1328 A 29 ILE H A 27 GLY HAx 1.0 . 5.19 1503 1329 A 30 GLU H A 27 GLY HAy 1.0 . 5.03 1504 1329 A 30 GLU H A 27 GLY HAx 1.0 . 5.03 1505 1330 A 28 ASP H A 28 ASP HBy 1.0 . 3.64 1506 1330 A 28 ASP H A 28 ASP HBx 1.0 . 3.64 1507 1331 A 28 ASP HA A 31 LYS HDx 1.0 . 3.81 1508 1331 A 28 ASP HA A 31 LYS HDy 1.0 . 3.81 1509 1332 A 29 ILE HA A 28 ASP HBy 1.0 . 4.99 1510 1332 A 29 ILE HA A 28 ASP HBx 1.0 . 4.99 1511 1333 A 29 ILE HA A 32 GLN HBy 1.0 . 3.27 1512 1333 A 29 ILE HA A 32 GLN HBx 1.0 . 3.27 1513 1334 A 29 ILE HA A 32 GLN HGy 1.0 . 5.69 1514 1334 A 29 ILE HA A 32 GLN HGx 1.0 . 5.69 1515 1335 A 29 ILE HA A 33 VAL HGy% 1.0 . 7.16 1516 1335 A 29 ILE HA A 33 VAL HGx% 1.0 . 7.16 1517 1336 A 29 ILE HB A 94 LEU HDx% 1.0 . 6.95 1518 1336 A 29 ILE HB A 94 LEU HDy% 1.0 . 6.95 1519 1337 A 29 ILE HG2% A 30 GLU HGx 1.0 . 7.62 1520 1337 A 29 ILE HG2% A 30 GLU HGy 1.0 . 7.62 1521 1338 A 29 ILE HG2% A 94 LEU HDx% 1.0 . 6.27 1522 1338 A 29 ILE HG2% A 94 LEU HDy% 1.0 . 6.27 1523 1339 A 29 ILE HG12 A 94 LEU HDx% 1.0 . 8.67 1524 1339 A 29 ILE HG13 A 94 LEU HDx% 1.0 . 8.67 1525 1339 A 94 LEU HDy% A 29 ILE HG12 1.0 . 8.67 1526 1339 A 29 ILE HG13 A 94 LEU HDy% 1.0 . 8.67 1527 1340 A 30 GLU H A 30 GLU HGx 1.0 . 4.33 1528 1340 A 30 GLU H A 30 GLU HGy 1.0 . 4.33 1529 1341 A 30 GLU HA A 33 VAL HGy% 1.0 . 5.80 1530 1341 A 30 GLU HA A 33 VAL HGx% 1.0 . 5.80 1531 1342 A 30 GLU HA A 87 LEU HDx% 1.0 . 5.45 1532 1342 A 30 GLU HA A 87 LEU HDy% 1.0 . 5.45 1533 1343 A 31 LYS H A 30 GLU HGx 1.0 . 6.48 1534 1343 A 31 LYS H A 30 GLU HGy 1.0 . 6.48 1535 1344 A 30 GLU HGy A 87 LEU HDx% 1.0 . 5.67 1536 1344 A 30 GLU HGx A 87 LEU HDx% 1.0 . 5.67 1537 1344 A 87 LEU HDy% A 30 GLU HGx 1.0 . 5.67 1538 1344 A 87 LEU HDy% A 30 GLU HGy 1.0 . 5.67 1539 1345 A 88 ALA HA A 30 GLU HGx 1.0 . 5.65 1540 1345 A 88 ALA HA A 30 GLU HGy 1.0 . 5.65 1541 1346 A 88 ALA HB% A 30 GLU HGx 1.0 . 3.99 1542 1346 A 88 ALA HB% A 30 GLU HGy 1.0 . 3.99 1543 1347 A 91 ALA HB% A 30 GLU HGx 1.0 . 4.22 1544 1347 A 91 ALA HB% A 30 GLU HGy 1.0 . 4.22 1545 1348 A 31 LYS H A 31 LYS HGy 1.0 . 4.67 1546 1348 A 31 LYS H A 31 LYS HGx 1.0 . 4.67 1547 1349 A 31 LYS H A 31 LYS HDx 1.0 . 4.22 1548 1349 A 31 LYS H A 31 LYS HDy 1.0 . 4.22 1549 1350 A 31 LYS HA A 31 LYS HDx 1.0 . 5.23 1550 1350 A 31 LYS HA A 31 LYS HDy 1.0 . 5.23 1551 1351 A 32 GLN H A 31 LYS HDx 1.0 . 5.00 1552 1351 A 32 GLN H A 31 LYS HDy 1.0 . 5.00 1553 1352 A 32 GLN H A 32 GLN HBy 1.0 . 3.28 1554 1352 A 32 GLN H A 32 GLN HBx 1.0 . 3.28 1555 1353 A 32 GLN H A 32 GLN HGy 1.0 . 4.01 1556 1353 A 32 GLN H A 32 GLN HGx 1.0 . 4.01 1557 1354 A 32 GLN H A 33 VAL HGy% 1.0 . 6.85 1558 1354 A 32 GLN H A 33 VAL HGx% 1.0 . 6.85 1559 1355 A 32 GLN HBx A 32 GLN HGy 1.0 . 2.31 1560 1355 A 32 GLN HBy A 32 GLN HGy 1.0 . 2.31 1561 1355 A 32 GLN HGx A 32 GLN HBy 1.0 . 2.31 1562 1355 A 32 GLN HBx A 32 GLN HGx 1.0 . 2.31 1563 1356 A 33 VAL H A 32 GLN HBy 1.0 . 3.97 1564 1356 A 33 VAL H A 32 GLN HBx 1.0 . 3.97 1565 1357 A 32 GLN HBx A 33 VAL HGy% 1.0 . 6.21 1566 1357 A 32 GLN HBy A 33 VAL HGy% 1.0 . 6.21 1567 1357 A 33 VAL HGx% A 32 GLN HBy 1.0 . 6.21 1568 1357 A 32 GLN HBx A 33 VAL HGx% 1.0 . 6.21 1569 1358 A 33 VAL H A 32 GLN HGy 1.0 . 4.38 1570 1358 A 33 VAL H A 32 GLN HGx 1.0 . 4.38 1571 1359 A 33 VAL HA A 32 GLN HGy 1.0 . 6.74 1572 1359 A 33 VAL HA A 32 GLN HGx 1.0 . 6.74 1573 1360 A 32 GLN HGy A 33 VAL HGy% 1.0 . 6.23 1574 1360 A 32 GLN HGx A 33 VAL HGy% 1.0 . 6.23 1575 1360 A 33 VAL HGx% A 32 GLN HGy 1.0 . 6.23 1576 1360 A 32 GLN HGx A 33 VAL HGx% 1.0 . 6.23 1577 1361 A 32 GLN HGx A 36 LEU HDx% 1.0 . 5.15 1578 1361 A 32 GLN HGy A 36 LEU HDx% 1.0 . 5.15 1579 1361 A 36 LEU HDy% A 32 GLN HGy 1.0 . 5.15 1580 1361 A 32 GLN HGx A 36 LEU HDy% 1.0 . 5.15 1581 1362 A 32 GLN HGx A 69 LEU HDx% 1.0 . 6.40 1582 1362 A 32 GLN HGy A 69 LEU HDx% 1.0 . 6.40 1583 1362 A 69 LEU HDy% A 32 GLN HGy 1.0 . 6.40 1584 1362 A 32 GLN HGx A 69 LEU HDy% 1.0 . 6.40 1585 1363 A 74 TYR HD% A 32 GLN HGy 1.0 . 8.69 1586 1363 A 74 TYR HD% A 32 GLN HGx 1.0 . 8.69 1587 1364 A 33 VAL H A 33 VAL HGy% 1.0 . 4.15 1588 1364 A 33 VAL H A 33 VAL HGx% 1.0 . 4.15 1589 1365 A 33 VAL H A 87 LEU HDx% 1.0 . 6.32 1590 1365 A 33 VAL H A 87 LEU HDy% 1.0 . 6.32 1591 1366 A 33 VAL HA A 36 LEU HBx 1.0 . 5.00 1592 1366 A 33 VAL HA A 36 LEU HBy 1.0 . 5.00 1593 1367 A 33 VAL HA A 36 LEU HDx% 1.0 . 5.02 1594 1367 A 33 VAL HA A 36 LEU HDy% 1.0 . 5.02 1595 1368 A 33 VAL HA A 65 LEU HDx% 1.0 . 7.04 1596 1368 A 33 VAL HA A 65 LEU HDy% 1.0 . 7.04 1597 1369 A 33 VAL HA A 69 LEU HDx% 1.0 . 6.42 1598 1369 A 33 VAL HA A 69 LEU HDy% 1.0 . 6.42 1599 1370 A 33 VAL HA A 87 LEU HDx% 1.0 . 7.85 1600 1370 A 33 VAL HA A 87 LEU HDy% 1.0 . 7.85 1601 1371 A 33 VAL HA A 94 LEU HDx% 1.0 . 7.85 1602 1371 A 33 VAL HA A 94 LEU HDy% 1.0 . 7.85 1603 1372 A 33 VAL HB A 87 LEU HDx% 1.0 . 4.17 1604 1372 A 33 VAL HB A 87 LEU HDy% 1.0 . 4.17 1605 1373 A 34 ALA H A 33 VAL HGy% 1.0 . 4.87 1606 1373 A 34 ALA H A 33 VAL HGx% 1.0 . 4.87 1607 1374 A 35 ALA H A 33 VAL HGy% 1.0 . 7.27 1608 1374 A 35 ALA H A 33 VAL HGx% 1.0 . 7.27 1609 1375 A 36 LEU H A 33 VAL HGy% 1.0 . 7.48 1610 1375 A 36 LEU H A 33 VAL HGx% 1.0 . 7.48 1611 1376 A 33 VAL HGy% A 36 LEU HBx 1.0 . 6.28 1612 1376 A 33 VAL HGx% A 36 LEU HBx 1.0 . 6.28 1613 1376 A 36 LEU HBy A 33 VAL HGy% 1.0 . 6.28 1614 1376 A 33 VAL HGx% A 36 LEU HBy 1.0 . 6.28 1615 1377 A 37 TRP H A 33 VAL HGy% 1.0 . 6.11 1616 1377 A 37 TRP H A 33 VAL HGx% 1.0 . 6.11 1617 1378 A 37 TRP HD1 A 33 VAL HGy% 1.0 . 6.74 1618 1378 A 37 TRP HD1 A 33 VAL HGx% 1.0 . 6.74 1619 1379 A 37 TRP HE3 A 33 VAL HGy% 1.0 . 7.85 1620 1379 A 37 TRP HE3 A 33 VAL HGx% 1.0 . 7.85 1621 1380 A 37 TRP HZ3 A 33 VAL HGy% 1.0 . 7.85 1622 1380 A 37 TRP HZ3 A 33 VAL HGx% 1.0 . 7.85 1623 1381 A 37 TRP HZ2 A 33 VAL HGy% 1.0 . 7.07 1624 1381 A 37 TRP HZ2 A 33 VAL HGx% 1.0 . 7.07 1625 1382 A 37 TRP HH2 A 33 VAL HGy% 1.0 . 7.85 1626 1382 A 37 TRP HH2 A 33 VAL HGx% 1.0 . 7.85 1627 1383 A 38 GLN H A 33 VAL HGy% 1.0 . 7.85 1628 1383 A 38 GLN H A 33 VAL HGx% 1.0 . 7.85 1629 1384 A 33 VAL HGy% A 65 LEU HDx% 1.0 . 7.46 1630 1384 A 33 VAL HGx% A 65 LEU HDx% 1.0 . 7.46 1631 1384 A 65 LEU HDy% A 33 VAL HGy% 1.0 . 7.46 1632 1384 A 33 VAL HGx% A 65 LEU HDy% 1.0 . 7.46 1633 1385 A 33 VAL HGx% A 74 TYR HBy 1.0 . 6.89 1634 1385 A 33 VAL HGy% A 74 TYR HBy 1.0 . 6.89 1635 1385 A 74 TYR HBx A 33 VAL HGy% 1.0 . 6.89 1636 1385 A 33 VAL HGx% A 74 TYR HBx 1.0 . 6.89 1637 1386 A 74 TYR HD% A 33 VAL HGy% 1.0 . 9.84 1638 1386 A 74 TYR HD% A 33 VAL HGx% 1.0 . 9.84 1639 1387 A 74 TYR HE% A 33 VAL HGy% 1.0 . 9.84 1640 1387 A 74 TYR HE% A 33 VAL HGx% 1.0 . 9.84 1641 1388 A 90 PHE HD% A 33 VAL HGy% 1.0 . 8.11 1642 1388 A 90 PHE HD% A 33 VAL HGx% 1.0 . 8.11 1643 1389 A 90 PHE HE% A 33 VAL HGy% 1.0 . 9.84 1644 1389 A 90 PHE HE% A 33 VAL HGx% 1.0 . 9.84 1645 1390 A 91 ALA HA A 33 VAL HGy% 1.0 . 6.59 1646 1390 A 91 ALA HA A 33 VAL HGx% 1.0 . 6.59 1647 1391 A 91 ALA HB% A 33 VAL HGy% 1.0 . 7.71 1648 1391 A 91 ALA HB% A 33 VAL HGx% 1.0 . 7.71 1649 1392 A 33 VAL HGy% A 94 LEU HDx% 1.0 . 7.20 1650 1392 A 33 VAL HGx% A 94 LEU HDx% 1.0 . 7.20 1651 1392 A 94 LEU HDy% A 33 VAL HGy% 1.0 . 7.20 1652 1392 A 33 VAL HGx% A 94 LEU HDy% 1.0 . 7.20 1653 1393 A 34 ALA H A 87 LEU HDx% 1.0 . 5.64 1654 1393 A 34 ALA H A 87 LEU HDy% 1.0 . 5.64 1655 1394 A 34 ALA HA A 46 VAL HGy% 1.0 . 5.54 1656 1394 A 34 ALA HA A 46 VAL HGx% 1.0 . 5.54 1657 1395 A 34 ALA HA A 87 LEU HDx% 1.0 . 5.68 1658 1395 A 34 ALA HA A 87 LEU HDy% 1.0 . 5.68 1659 1396 A 34 ALA HB% A 46 VAL HGy% 1.0 . 7.11 1660 1396 A 34 ALA HB% A 46 VAL HGx% 1.0 . 7.11 1661 1397 A 34 ALA HB% A 87 LEU HDx% 1.0 . 6.43 1662 1397 A 34 ALA HB% A 87 LEU HDy% 1.0 . 6.43 1663 1398 A 35 ALA H A 37 TRP HBy 1.0 . 6.74 1664 1398 A 35 ALA H A 37 TRP HBx 1.0 . 6.74 1665 1399 A 35 ALA H A 87 LEU HDx% 1.0 . 7.85 1666 1399 A 35 ALA H A 87 LEU HDy% 1.0 . 7.85 1667 1400 A 35 ALA HA A 38 GLN HBy 1.0 . 3.38 1668 1400 A 35 ALA HA A 38 GLN HBx 1.0 . 3.38 1669 1401 A 36 LEU H A 36 LEU HDx% 1.0 . 4.73 1670 1401 A 36 LEU H A 36 LEU HDy% 1.0 . 4.73 1671 1402 A 36 LEU H A 37 TRP HBy 1.0 . 5.04 1672 1402 A 36 LEU H A 37 TRP HBx 1.0 . 5.04 1673 1403 A 36 LEU HA A 36 LEU HDx% 1.0 . 4.29 1674 1403 A 36 LEU HA A 36 LEU HDy% 1.0 . 4.29 1675 1404 A 36 LEU HA A 39 GLN HGy 1.0 . 5.28 1676 1404 A 36 LEU HA A 39 GLN HGx 1.0 . 5.28 1677 1405 A 36 LEU HA A 65 LEU HDx% 1.0 . 6.30 1678 1405 A 36 LEU HA A 65 LEU HDy% 1.0 . 6.30 1679 1406 A 37 TRP H A 36 LEU HBx 1.0 . 4.33 1680 1406 A 37 TRP H A 36 LEU HBy 1.0 . 4.33 1681 1407 A 36 LEU HBy A 65 LEU HDx% 1.0 . 4.78 1682 1407 A 65 LEU HDy% A 36 LEU HBx 1.0 . 4.78 1683 1407 A 36 LEU HBy A 65 LEU HDy% 1.0 . 4.78 1684 1407 A 36 LEU HBx A 65 LEU HDx% 1.0 . 4.78 1685 1408 A 36 LEU HBx A 69 LEU HDx% 1.0 . 6.54 1686 1408 A 69 LEU HDy% A 36 LEU HBx 1.0 . 6.54 1687 1408 A 69 LEU HDy% A 36 LEU HBy 1.0 . 6.54 1688 1408 A 36 LEU HBy A 69 LEU HDx% 1.0 . 6.54 1689 1409 A 37 TRP HD1 A 36 LEU HDx% 1.0 . 6.72 1690 1409 A 37 TRP HD1 A 36 LEU HDy% 1.0 . 6.72 1691 1410 A 68 GLN HA A 36 LEU HDx% 1.0 . 4.61 1692 1410 A 68 GLN HA A 36 LEU HDy% 1.0 . 4.61 1693 1411 A 36 LEU HDx% A 68 GLN HBx 1.0 . 4.26 1694 1411 A 36 LEU HDy% A 68 GLN HBx 1.0 . 4.26 1695 1411 A 68 GLN HBy A 36 LEU HDx% 1.0 . 4.26 1696 1411 A 36 LEU HDy% A 68 GLN HBy 1.0 . 4.26 1697 1412 A 36 LEU HDx% A 68 GLN HGy 1.0 . 4.85 1698 1412 A 36 LEU HDy% A 68 GLN HGy 1.0 . 4.85 1699 1412 A 68 GLN HGx A 36 LEU HDx% 1.0 . 4.85 1700 1412 A 36 LEU HDy% A 68 GLN HGx 1.0 . 4.85 1701 1413 A 36 LEU HDy% A 69 LEU HDx% 1.0 . 6.85 1702 1413 A 36 LEU HDx% A 69 LEU HDx% 1.0 . 6.85 1703 1413 A 69 LEU HDy% A 36 LEU HDx% 1.0 . 6.85 1704 1413 A 36 LEU HDy% A 69 LEU HDy% 1.0 . 6.85 1705 1414 A 72 ALA HB% A 36 LEU HDx% 1.0 . 8.81 1706 1414 A 72 ALA HB% A 36 LEU HDy% 1.0 . 8.81 1707 1415 A 37 TRP H A 46 VAL HGy% 1.0 . 5.25 1708 1415 A 37 TRP H A 46 VAL HGx% 1.0 . 5.25 1709 1416 A 37 TRP H A 87 LEU HDx% 1.0 . 7.64 1710 1416 A 37 TRP H A 87 LEU HDy% 1.0 . 7.64 1711 1417 A 37 TRP HA A 40 LEU HDx% 1.0 . 6.38 1712 1417 A 37 TRP HA A 40 LEU HDy% 1.0 . 6.38 1713 1418 A 37 TRP HA A 41 LEU HDx% 1.0 . 6.48 1714 1418 A 37 TRP HA A 41 LEU HDy% 1.0 . 6.48 1715 1419 A 37 TRP HA A 61 LEU HDx% 1.0 . 7.85 1716 1419 A 37 TRP HA A 61 LEU HDy% 1.0 . 7.85 1717 1420 A 37 TRP HA A 65 LEU HDx% 1.0 . 5.10 1718 1420 A 37 TRP HA A 65 LEU HDy% 1.0 . 5.10 1719 1421 A 37 TRP HA A 87 LEU HDx% 1.0 . 7.85 1720 1421 A 37 TRP HA A 87 LEU HDy% 1.0 . 7.85 1721 1422 A 38 GLN H A 37 TRP HBy 1.0 . 4.27 1722 1422 A 38 GLN H A 37 TRP HBx 1.0 . 4.27 1723 1423 A 37 TRP HBy A 41 LEU HDx% 1.0 . 6.12 1724 1423 A 37 TRP HBx A 41 LEU HDx% 1.0 . 6.12 1725 1423 A 41 LEU HDy% A 37 TRP HBy 1.0 . 6.12 1726 1423 A 37 TRP HBx A 41 LEU HDy% 1.0 . 6.12 1727 1424 A 37 TRP HBx A 46 VAL HGy% 1.0 . 5.37 1728 1424 A 37 TRP HBy A 46 VAL HGy% 1.0 . 5.37 1729 1424 A 46 VAL HGx% A 37 TRP HBy 1.0 . 5.37 1730 1424 A 46 VAL HGx% A 37 TRP HBx 1.0 . 5.37 1731 1425 A 37 TRP HBx A 87 LEU HDx% 1.0 . 5.38 1732 1425 A 37 TRP HBy A 87 LEU HDx% 1.0 . 5.38 1733 1425 A 87 LEU HDy% A 37 TRP HBy 1.0 . 5.38 1734 1425 A 87 LEU HDy% A 37 TRP HBx 1.0 . 5.38 1735 1426 A 37 TRP HD1 A 40 LEU HDx% 1.0 . 7.48 1736 1426 A 37 TRP HD1 A 40 LEU HDy% 1.0 . 7.48 1737 1427 A 37 TRP HD1 A 41 LEU HDx% 1.0 . 7.85 1738 1427 A 37 TRP HD1 A 41 LEU HDy% 1.0 . 7.85 1739 1428 A 37 TRP HD1 A 52 PHE HBx 1.0 . 6.74 1740 1428 A 37 TRP HD1 A 52 PHE HBy 1.0 . 6.74 1741 1429 A 37 TRP HD1 A 65 LEU HDx% 1.0 . 5.44 1742 1429 A 37 TRP HD1 A 65 LEU HDy% 1.0 . 5.44 1743 1430 A 37 TRP HD1 A 87 LEU HDx% 1.0 . 7.85 1744 1430 A 37 TRP HD1 A 87 LEU HDy% 1.0 . 7.85 1745 1431 A 37 TRP HE3 A 41 LEU HDx% 1.0 . 7.85 1746 1431 A 37 TRP HE3 A 41 LEU HDy% 1.0 . 7.85 1747 1432 A 37 TRP HE3 A 81 LEU HDx% 1.0 . 7.85 1748 1432 A 37 TRP HE3 A 81 LEU HDy% 1.0 . 7.85 1749 1433 A 37 TRP HE3 A 87 LEU HDx% 1.0 . 6.80 1750 1433 A 37 TRP HE3 A 87 LEU HDy% 1.0 . 6.80 1751 1434 A 37 TRP HZ3 A 41 LEU HDx% 1.0 . 7.16 1752 1434 A 37 TRP HZ3 A 41 LEU HDy% 1.0 . 7.16 1753 1435 A 37 TRP HZ3 A 46 VAL HGy% 1.0 . 6.17 1754 1435 A 37 TRP HZ3 A 46 VAL HGx% 1.0 . 6.17 1755 1436 A 37 TRP HZ3 A 52 PHE HBx 1.0 . 6.74 1756 1436 A 37 TRP HZ3 A 52 PHE HBy 1.0 . 6.74 1757 1437 A 37 TRP HZ3 A 87 LEU HDx% 1.0 . 6.72 1758 1437 A 37 TRP HZ3 A 87 LEU HDy% 1.0 . 6.72 1759 1438 A 37 TRP HZ2 A 65 LEU HDx% 1.0 . 7.85 1760 1438 A 37 TRP HZ2 A 65 LEU HDy% 1.0 . 7.85 1761 1439 A 37 TRP HZ2 A 81 LEU HDx% 1.0 . 5.96 1762 1439 A 37 TRP HZ2 A 81 LEU HDy% 1.0 . 5.96 1763 1440 A 37 TRP HH2 A 46 VAL HGy% 1.0 . 7.85 1764 1440 A 37 TRP HH2 A 46 VAL HGx% 1.0 . 7.85 1765 1441 A 37 TRP HH2 A 81 LEU HDx% 1.0 . 6.84 1766 1441 A 37 TRP HH2 A 81 LEU HDy% 1.0 . 6.84 1767 1442 A 37 TRP HH2 A 90 PHE HBx 1.0 . 6.74 1768 1442 A 37 TRP HH2 A 90 PHE HBy 1.0 . 6.74 1769 1443 A 38 GLN H A 38 GLN HBy 1.0 . 3.66 1770 1443 A 38 GLN H A 38 GLN HBx 1.0 . 3.66 1771 1444 A 38 GLN H A 38 GLN HGy 1.0 . 4.39 1772 1444 A 38 GLN H A 38 GLN HGx 1.0 . 4.39 1773 1445 A 38 GLN H A 46 VAL HGy% 1.0 . 5.05 1774 1445 A 38 GLN H A 46 VAL HGx% 1.0 . 5.05 1775 1446 A 38 GLN HA A 41 LEU HDx% 1.0 . 7.09 1776 1446 A 38 GLN HA A 41 LEU HDy% 1.0 . 7.09 1777 1447 A 38 GLN HBx A 44 GLY HAy 1.0 . 6.47 1778 1447 A 38 GLN HBy A 44 GLY HAy 1.0 . 6.47 1779 1447 A 44 GLY HAx A 38 GLN HBy 1.0 . 6.47 1780 1447 A 38 GLN HBx A 44 GLY HAx 1.0 . 6.47 1781 1448 A 38 GLN HBx A 46 VAL HGy% 1.0 . 5.76 1782 1448 A 38 GLN HBy A 46 VAL HGy% 1.0 . 5.76 1783 1448 A 46 VAL HGx% A 38 GLN HBy 1.0 . 5.76 1784 1448 A 46 VAL HGx% A 38 GLN HBx 1.0 . 5.76 1785 1449 A 40 LEU H A 38 GLN HGy 1.0 . 6.74 1786 1449 A 40 LEU H A 38 GLN HGx 1.0 . 6.74 1787 1450 A 38 GLN HGy A 46 VAL HGy% 1.0 . 4.68 1788 1450 A 38 GLN HGx A 46 VAL HGy% 1.0 . 4.68 1789 1450 A 46 VAL HGx% A 38 GLN HGy 1.0 . 4.68 1790 1450 A 46 VAL HGx% A 38 GLN HGx 1.0 . 4.68 1791 1451 A 45 ASN HA A 38 GLN HE21 1.0 . 4.33 1792 1451 A 45 ASN HA A 38 GLN HE22 1.0 . 4.33 1793 1452 A 38 GLN HE22 A 45 ASN HBx 1.0 . 4.97 1794 1452 A 38 GLN HE21 A 45 ASN HBx 1.0 . 4.97 1795 1452 A 45 ASN HBy A 38 GLN HE21 1.0 . 4.97 1796 1452 A 38 GLN HE22 A 45 ASN HBy 1.0 . 4.97 1797 1453 A 47 THR HG2% A 38 GLN HE21 1.0 . 6.23 1798 1453 A 47 THR HG2% A 38 GLN HE22 1.0 . 6.23 1799 1454 A 39 GLN H A 39 GLN HGy 1.0 . 4.47 1800 1454 A 39 GLN H A 39 GLN HGx 1.0 . 4.47 1801 1455 A 39 GLN H A 40 LEU HDx% 1.0 . 5.78 1802 1455 A 39 GLN H A 40 LEU HDy% 1.0 . 5.78 1803 1456 A 40 LEU H A 39 GLN HGy 1.0 . 6.74 1804 1456 A 40 LEU H A 39 GLN HGx 1.0 . 6.74 1805 1457 A 40 LEU H A 40 LEU HDx% 1.0 . 4.97 1806 1457 A 40 LEU H A 40 LEU HDy% 1.0 . 4.97 1807 1458 A 40 LEU HA A 40 LEU HDx% 1.0 . 4.43 1808 1458 A 40 LEU HA A 40 LEU HDy% 1.0 . 4.43 1809 1459 A 40 LEU HBx A 41 LEU HDx% 1.0 . 5.54 1810 1459 A 40 LEU HBy A 41 LEU HDx% 1.0 . 5.54 1811 1459 A 41 LEU HDy% A 40 LEU HBy 1.0 . 5.54 1812 1459 A 41 LEU HDy% A 40 LEU HBx 1.0 . 5.54 1813 1460 A 52 PHE HE% A 40 LEU HBy 1.0 . 8.69 1814 1460 A 52 PHE HE% A 40 LEU HBx 1.0 . 8.69 1815 1461 A 40 LEU HBx A 61 LEU HDx% 1.0 . 5.92 1816 1461 A 40 LEU HBy A 61 LEU HDx% 1.0 . 5.92 1817 1461 A 61 LEU HDy% A 40 LEU HBy 1.0 . 5.92 1818 1461 A 61 LEU HDy% A 40 LEU HBx 1.0 . 5.92 1819 1462 A 41 LEU H A 40 LEU HDx% 1.0 . 5.87 1820 1462 A 41 LEU H A 40 LEU HDy% 1.0 . 5.87 1821 1463 A 41 LEU HA A 40 LEU HDx% 1.0 . 7.85 1822 1463 A 41 LEU HA A 40 LEU HDy% 1.0 . 7.85 1823 1464 A 40 LEU HDx% A 41 LEU HDx% 1.0 . 7.84 1824 1464 A 40 LEU HDy% A 41 LEU HDx% 1.0 . 7.84 1825 1464 A 41 LEU HDy% A 40 LEU HDx% 1.0 . 7.84 1826 1464 A 40 LEU HDy% A 41 LEU HDy% 1.0 . 7.84 1827 1465 A 52 PHE HZ A 40 LEU HDx% 1.0 . 6.77 1828 1465 A 52 PHE HZ A 40 LEU HDy% 1.0 . 6.77 1829 1466 A 40 LEU HDx% A 64 ARG HB2 1.0 . 6.07 1830 1466 A 40 LEU HDy% A 64 ARG HB2 1.0 . 6.07 1831 1466 A 64 ARG HB3 A 40 LEU HDx% 1.0 . 6.07 1832 1466 A 64 ARG HB3 A 40 LEU HDy% 1.0 . 6.07 1833 1467 A 40 LEU HDx% A 64 ARG HD2 1.0 . 7.07 1834 1467 A 40 LEU HDy% A 64 ARG HD2 1.0 . 7.07 1835 1467 A 64 ARG HD3 A 40 LEU HDx% 1.0 . 7.07 1836 1467 A 64 ARG HD3 A 40 LEU HDy% 1.0 . 7.07 1837 1468 A 65 LEU HA A 40 LEU HDx% 1.0 . 4.58 1838 1468 A 65 LEU HA A 40 LEU HDy% 1.0 . 4.58 1839 1469 A 40 LEU HDx% A 65 LEU HDx% 1.0 . 7.84 1840 1469 A 40 LEU HDy% A 65 LEU HDx% 1.0 . 7.84 1841 1469 A 65 LEU HDy% A 40 LEU HDx% 1.0 . 7.84 1842 1469 A 65 LEU HDy% A 40 LEU HDy% 1.0 . 7.84 1843 1470 A 41 LEU H A 41 LEU HDx% 1.0 . 5.32 1844 1470 A 41 LEU H A 41 LEU HDy% 1.0 . 5.32 1845 1471 A 41 LEU HA A 61 LEU HDx% 1.0 . 4.77 1846 1471 A 41 LEU HA A 61 LEU HDy% 1.0 . 4.77 1847 1472 A 41 LEU HB3 A 57 GLY HAy 1.0 . 7.54 1848 1472 A 41 LEU HB2 A 57 GLY HAy 1.0 . 7.54 1849 1472 A 57 GLY HAx A 41 LEU HB2 1.0 . 7.54 1850 1472 A 41 LEU HB3 A 57 GLY HAx 1.0 . 7.54 1851 1473 A 42 SER H A 41 LEU HDx% 1.0 . 6.42 1852 1473 A 42 SER H A 41 LEU HDy% 1.0 . 6.42 1853 1474 A 43 THR H A 41 LEU HDx% 1.0 . 7.85 1854 1474 A 43 THR H A 41 LEU HDy% 1.0 . 7.85 1855 1475 A 43 THR HB A 41 LEU HDx% 1.0 . 6.74 1856 1475 A 43 THR HB A 41 LEU HDy% 1.0 . 6.74 1857 1476 A 43 THR HG2% A 41 LEU HDx% 1.0 . 8.00 1858 1476 A 43 THR HG2% A 41 LEU HDy% 1.0 . 8.00 1859 1477 A 41 LEU HDy% A 46 VAL HGy% 1.0 . 7.19 1860 1477 A 41 LEU HDx% A 46 VAL HGy% 1.0 . 7.19 1861 1477 A 46 VAL HGx% A 41 LEU HDx% 1.0 . 7.19 1862 1477 A 46 VAL HGx% A 41 LEU HDy% 1.0 . 7.19 1863 1478 A 52 PHE HA A 41 LEU HDx% 1.0 . 6.34 1864 1478 A 52 PHE HA A 41 LEU HDy% 1.0 . 6.34 1865 1479 A 52 PHE HD% A 41 LEU HDx% 1.0 . 8.83 1866 1479 A 52 PHE HD% A 41 LEU HDy% 1.0 . 8.83 1867 1480 A 52 PHE HZ A 41 LEU HDx% 1.0 . 6.99 1868 1480 A 52 PHE HZ A 41 LEU HDy% 1.0 . 6.99 1869 1481 A 53 PHE HA A 41 LEU HDx% 1.0 . 7.85 1870 1481 A 53 PHE HA A 41 LEU HDy% 1.0 . 7.85 1871 1482 A 55 GLN H A 41 LEU HDx% 1.0 . 6.40 1872 1482 A 55 GLN H A 41 LEU HDy% 1.0 . 6.40 1873 1483 A 55 GLN HA A 41 LEU HDx% 1.0 . 5.96 1874 1483 A 55 GLN HA A 41 LEU HDy% 1.0 . 5.96 1875 1484 A 41 LEU HDy% A 55 GLN HBy 1.0 . 4.73 1876 1484 A 41 LEU HDx% A 55 GLN HBy 1.0 . 4.73 1877 1484 A 55 GLN HBx A 41 LEU HDx% 1.0 . 4.73 1878 1484 A 41 LEU HDy% A 55 GLN HBx 1.0 . 4.73 1879 1485 A 41 LEU HDy% A 55 GLN HG2 1.0 . 7.57 1880 1485 A 41 LEU HDx% A 55 GLN HG2 1.0 . 7.57 1881 1485 A 55 GLN HG3 A 41 LEU HDx% 1.0 . 7.57 1882 1485 A 55 GLN HG3 A 41 LEU HDy% 1.0 . 7.57 1883 1486 A 56 GLY H A 41 LEU HDx% 1.0 . 6.67 1884 1486 A 56 GLY H A 41 LEU HDy% 1.0 . 6.67 1885 1487 A 41 LEU HDy% A 56 GLY HAy 1.0 . 5.90 1886 1487 A 41 LEU HDx% A 56 GLY HAy 1.0 . 5.90 1887 1487 A 56 GLY HAx A 41 LEU HDx% 1.0 . 5.90 1888 1487 A 41 LEU HDy% A 56 GLY HAx 1.0 . 5.90 1889 1488 A 57 GLY H A 41 LEU HDx% 1.0 . 5.19 1890 1488 A 57 GLY H A 41 LEU HDy% 1.0 . 5.19 1891 1489 A 41 LEU HDy% A 57 GLY HAy 1.0 . 5.62 1892 1489 A 41 LEU HDx% A 57 GLY HAy 1.0 . 5.62 1893 1489 A 57 GLY HAx A 41 LEU HDx% 1.0 . 5.62 1894 1489 A 41 LEU HDy% A 57 GLY HAx 1.0 . 5.62 1895 1490 A 58 ASP H A 41 LEU HDx% 1.0 . 6.85 1896 1490 A 58 ASP H A 41 LEU HDy% 1.0 . 6.85 1897 1491 A 61 LEU HA A 41 LEU HDx% 1.0 . 7.64 1898 1491 A 61 LEU HA A 41 LEU HDy% 1.0 . 7.64 1899 1492 A 41 LEU HDy% A 61 LEU HDx% 1.0 . 7.35 1900 1492 A 41 LEU HDx% A 61 LEU HDx% 1.0 . 7.35 1901 1492 A 61 LEU HDy% A 41 LEU HDx% 1.0 . 7.35 1902 1492 A 41 LEU HDy% A 61 LEU HDy% 1.0 . 7.35 1903 1493 A 43 THR HA A 44 GLY HAy 1.0 . 5.40 1904 1493 A 43 THR HA A 44 GLY HAx 1.0 . 5.40 1905 1494 A 43 THR HB A 46 VAL HGy% 1.0 . 5.37 1906 1494 A 43 THR HB A 46 VAL HGx% 1.0 . 5.37 1907 1495 A 45 ASN HA A 44 GLY HAy 1.0 . 6.02 1908 1495 A 45 ASN HA A 44 GLY HAx 1.0 . 6.02 1909 1496 A 45 ASN HA A 46 VAL HGy% 1.0 . 7.74 1910 1496 A 45 ASN HA A 46 VAL HGx% 1.0 . 7.74 1911 1497 A 46 VAL H A 45 ASN HBx 1.0 . 4.43 1912 1497 A 46 VAL H A 45 ASN HBy 1.0 . 4.43 1913 1498 A 45 ASN HBx A 46 VAL HGy% 1.0 . 6.99 1914 1498 A 45 ASN HBy A 46 VAL HGy% 1.0 . 6.99 1915 1498 A 46 VAL HGx% A 45 ASN HBx 1.0 . 6.99 1916 1498 A 46 VAL HGx% A 45 ASN HBy 1.0 . 6.99 1917 1499 A 47 THR HG2% A 45 ASN HBx 1.0 . 5.85 1918 1499 A 47 THR HG2% A 45 ASN HBy 1.0 . 5.85 1919 1500 A 46 VAL H A 46 VAL HGy% 1.0 . 4.25 1920 1500 A 46 VAL H A 46 VAL HGx% 1.0 . 4.25 1921 1501 A 47 THR H A 46 VAL HGy% 1.0 . 4.30 1922 1501 A 47 THR H A 46 VAL HGx% 1.0 . 4.30 1923 1502 A 50 THR H A 46 VAL HGy% 1.0 . 7.85 1924 1502 A 50 THR H A 46 VAL HGx% 1.0 . 7.85 1925 1503 A 50 THR HG2% A 46 VAL HGy% 1.0 . 6.95 1926 1503 A 50 THR HG2% A 46 VAL HGx% 1.0 . 6.95 1927 1504 A 46 VAL HGy% A 87 LEU HDx% 1.0 . 6.95 1928 1504 A 87 LEU HDy% A 46 VAL HGy% 1.0 . 6.95 1929 1504 A 87 LEU HDy% A 46 VAL HGx% 1.0 . 6.95 1930 1504 A 46 VAL HGx% A 87 LEU HDx% 1.0 . 6.95 1931 1505 A 47 THR H A 87 LEU HDx% 1.0 . 7.27 1932 1505 A 47 THR H A 87 LEU HDy% 1.0 . 7.27 1933 1506 A 47 THR HA A 87 LEU HDx% 1.0 . 6.64 1934 1506 A 47 THR HA A 87 LEU HDy% 1.0 . 6.64 1935 1507 A 47 THR HB A 87 LEU HDx% 1.0 . 6.26 1936 1507 A 47 THR HB A 87 LEU HDy% 1.0 . 6.26 1937 1508 A 48 ARG H A 87 LEU HDx% 1.0 . 7.64 1938 1508 A 48 ARG H A 87 LEU HDy% 1.0 . 7.64 1939 1509 A 48 ARG HA A 87 LEU HBx 1.0 . 4.95 1940 1509 A 48 ARG HA A 87 LEU HBy 1.0 . 4.95 1941 1510 A 48 ARG HA A 87 LEU HDx% 1.0 . 5.41 1942 1510 A 48 ARG HA A 87 LEU HDy% 1.0 . 5.41 1943 1511 A 48 ARG HD3 A 87 LEU HDx% 1.0 . 8.67 1944 1511 A 48 ARG HD2 A 87 LEU HDx% 1.0 . 8.67 1945 1511 A 87 LEU HDy% A 48 ARG HD2 1.0 . 8.67 1946 1511 A 48 ARG HD3 A 87 LEU HDy% 1.0 . 8.67 1947 1512 A 49 GLU H A 49 GLU HBx 1.0 . 3.66 1948 1512 A 49 GLU H A 49 GLU HBy 1.0 . 3.66 1949 1513 A 49 GLU H A 49 GLU HGx 1.0 . 5.00 1950 1513 A 49 GLU H A 49 GLU HGy 1.0 . 5.00 1951 1514 A 49 GLU H A 87 LEU HDx% 1.0 . 7.85 1952 1514 A 49 GLU H A 87 LEU HDy% 1.0 . 7.85 1953 1515 A 49 GLU HA A 49 GLU HGx 1.0 . 3.68 1954 1515 A 49 GLU HA A 49 GLU HGy 1.0 . 3.68 1955 1516 A 50 THR H A 49 GLU HBx 1.0 . 4.33 1956 1516 A 50 THR H A 49 GLU HBy 1.0 . 4.33 1957 1517 A 49 GLU HBy A 86 ARG HDy 1.0 . 5.14 1958 1517 A 49 GLU HBx A 86 ARG HDy 1.0 . 5.14 1959 1517 A 86 ARG HDx A 49 GLU HBx 1.0 . 5.14 1960 1517 A 49 GLU HBy A 86 ARG HDx 1.0 . 5.14 1961 1518 A 50 THR H A 49 GLU HGx 1.0 . 5.49 1962 1518 A 50 THR H A 49 GLU HGy 1.0 . 5.49 1963 1519 A 50 THR HB A 87 LEU HDx% 1.0 . 6.46 1964 1519 A 50 THR HB A 87 LEU HDy% 1.0 . 6.46 1965 1520 A 50 THR HG2% A 55 GLN HBy 1.0 . 4.09 1966 1520 A 50 THR HG2% A 55 GLN HBx 1.0 . 4.09 1967 1521 A 50 THR HG2% A 87 LEU HBx 1.0 . 6.93 1968 1521 A 50 THR HG2% A 87 LEU HBy 1.0 . 6.93 1969 1522 A 50 THR HG2% A 87 LEU HDx% 1.0 . 7.69 1970 1522 A 50 THR HG2% A 87 LEU HDy% 1.0 . 7.69 1971 1523 A 51 ASP HBx A 54 GLN HBy 1.0 . 4.58 1972 1523 A 51 ASP HBy A 54 GLN HBy 1.0 . 4.58 1973 1523 A 54 GLN HBx A 51 ASP HBy 1.0 . 4.58 1974 1523 A 51 ASP HBx A 54 GLN HBx 1.0 . 4.58 1975 1524 A 52 PHE H A 81 LEU HDx% 1.0 . 6.91 1976 1524 A 52 PHE H A 81 LEU HDy% 1.0 . 6.91 1977 1525 A 52 PHE H A 87 LEU HDx% 1.0 . 7.85 1978 1525 A 52 PHE H A 87 LEU HDy% 1.0 . 7.85 1979 1526 A 53 PHE H A 52 PHE HBx 1.0 . 4.05 1980 1526 A 53 PHE H A 52 PHE HBy 1.0 . 4.05 1981 1527 A 52 PHE HBx A 81 LEU HDx% 1.0 . 5.06 1982 1527 A 52 PHE HBy A 81 LEU HDx% 1.0 . 5.06 1983 1527 A 81 LEU HDy% A 52 PHE HBx 1.0 . 5.06 1984 1527 A 52 PHE HBy A 81 LEU HDy% 1.0 . 5.06 1985 1528 A 90 PHE HD% A 52 PHE HBx 1.0 . 8.69 1986 1528 A 90 PHE HD% A 52 PHE HBy 1.0 . 8.69 1987 1529 A 52 PHE HE% A 65 LEU HBx 1.0 . 8.69 1988 1529 A 52 PHE HE% A 65 LEU HBy 1.0 . 8.69 1989 1530 A 52 PHE HZ A 61 LEU HDx% 1.0 . 7.04 1990 1530 A 52 PHE HZ A 61 LEU HDy% 1.0 . 7.04 1991 1531 A 52 PHE HZ A 65 LEU HBx 1.0 . 6.74 1992 1531 A 52 PHE HZ A 65 LEU HBy 1.0 . 6.74 1993 1532 A 52 PHE HZ A 65 LEU HDx% 1.0 . 7.07 1994 1532 A 52 PHE HZ A 65 LEU HDy% 1.0 . 7.07 1995 1533 A 52 PHE HZ A 81 LEU HDx% 1.0 . 7.09 1996 1533 A 52 PHE HZ A 81 LEU HDy% 1.0 . 7.09 1997 1534 A 53 PHE HA A 57 GLY HAy 1.0 . 4.89 1998 1534 A 53 PHE HA A 57 GLY HAx 1.0 . 4.89 1999 1535 A 54 GLN H A 53 PHE HBx 1.0 . 4.15 2000 1535 A 54 GLN H A 53 PHE HBy 1.0 . 4.15 2001 1536 A 53 PHE HZ A 81 LEU HDx% 1.0 . 6.81 2002 1536 A 53 PHE HZ A 81 LEU HDy% 1.0 . 6.81 2003 1537 A 54 GLN H A 54 GLN HGx 1.0 . 4.58 2004 1537 A 54 GLN H A 54 GLN HGy 1.0 . 4.58 2005 1538 A 54 GLN HA A 54 GLN HGx 1.0 . 3.59 2006 1538 A 54 GLN HA A 54 GLN HGy 1.0 . 3.59 2007 1539 A 55 GLN H A 54 GLN HBy 1.0 . 4.23 2008 1539 A 55 GLN H A 54 GLN HBx 1.0 . 4.23 2009 1540 A 55 GLN H A 55 GLN HBy 1.0 . 3.69 2010 1540 A 55 GLN H A 55 GLN HBx 1.0 . 3.69 2011 1541 A 55 GLN H A 56 GLY HAy 1.0 . 6.08 2012 1541 A 55 GLN H A 56 GLY HAx 1.0 . 6.08 2013 1542 A 58 ASP H A 56 GLY HAy 1.0 . 6.53 2014 1542 A 58 ASP H A 56 GLY HAx 1.0 . 6.53 2015 1543 A 57 GLY H A 61 LEU HDx% 1.0 . 6.09 2016 1543 A 57 GLY H A 61 LEU HDy% 1.0 . 6.09 2017 1544 A 58 ASP HA A 57 GLY HAy 1.0 . 5.22 2018 1544 A 58 ASP HA A 57 GLY HAx 1.0 . 5.22 2019 1545 A 57 GLY HAx A 61 LEU HDx% 1.0 . 4.49 2020 1545 A 57 GLY HAy A 61 LEU HDx% 1.0 . 4.49 2021 1545 A 61 LEU HDy% A 57 GLY HAy 1.0 . 4.49 2022 1545 A 61 LEU HDy% A 57 GLY HAx 1.0 . 4.49 2023 1546 A 58 ASP H A 61 LEU HBx 1.0 . 3.80 2024 1546 A 58 ASP H A 61 LEU HBy 1.0 . 3.80 2025 1547 A 58 ASP H A 61 LEU HDx% 1.0 . 4.68 2026 1547 A 58 ASP H A 61 LEU HDy% 1.0 . 4.68 2027 1548 A 60 LEU H A 58 ASP HBy 1.0 . 4.81 2028 1548 A 60 LEU H A 58 ASP HBx 1.0 . 4.81 2029 1549 A 59 SER HB2 A 81 LEU HDx% 1.0 . 8.67 2030 1549 A 59 SER HB3 A 81 LEU HDx% 1.0 . 8.67 2031 1549 A 81 LEU HDy% A 59 SER HB2 1.0 . 8.67 2032 1549 A 59 SER HB3 A 81 LEU HDy% 1.0 . 8.67 2033 1550 A 60 LEU H A 60 LEU HDx% 1.0 . 5.86 2034 1550 A 60 LEU H A 60 LEU HDy% 1.0 . 5.86 2035 1551 A 60 LEU HA A 60 LEU HDx% 1.0 . 3.50 2036 1551 A 60 LEU HA A 60 LEU HDy% 1.0 . 3.50 2037 1552 A 61 LEU H A 60 LEU HDx% 1.0 . 5.87 2038 1552 A 61 LEU H A 60 LEU HDy% 1.0 . 5.87 2039 1553 A 64 ARG H A 60 LEU HDx% 1.0 . 5.91 2040 1553 A 64 ARG H A 60 LEU HDy% 1.0 . 5.91 2041 1554 A 61 LEU H A 61 LEU HBx 1.0 . 3.54 2042 1554 A 61 LEU H A 61 LEU HBy 1.0 . 3.54 2043 1555 A 61 LEU H A 61 LEU HDx% 1.0 . 5.15 2044 1555 A 61 LEU H A 61 LEU HDy% 1.0 . 5.15 2045 1556 A 62 ALA HA A 61 LEU HBx 1.0 . 5.89 2046 1556 A 62 ALA HA A 61 LEU HBy 1.0 . 5.89 2047 1557 A 61 LEU HDy% A 64 ARG HD2 1.0 . 6.93 2048 1557 A 61 LEU HDx% A 64 ARG HD2 1.0 . 6.93 2049 1557 A 64 ARG HD3 A 61 LEU HDx% 1.0 . 6.93 2050 1557 A 64 ARG HD3 A 61 LEU HDy% 1.0 . 6.93 2051 1558 A 62 ALA H A 81 LEU HDx% 1.0 . 7.22 2052 1558 A 62 ALA H A 81 LEU HDy% 1.0 . 7.22 2053 1559 A 62 ALA HA A 65 LEU HBx 1.0 . 3.96 2054 1559 A 62 ALA HA A 65 LEU HBy 1.0 . 3.96 2055 1560 A 62 ALA HA A 65 LEU HDx% 1.0 . 6.74 2056 1560 A 62 ALA HA A 65 LEU HDy% 1.0 . 6.74 2057 1561 A 62 ALA HA A 81 LEU HDx% 1.0 . 6.26 2058 1561 A 62 ALA HA A 81 LEU HDy% 1.0 . 6.26 2059 1562 A 62 ALA HB% A 65 LEU HDx% 1.0 . 8.65 2060 1562 A 62 ALA HB% A 65 LEU HDy% 1.0 . 8.65 2061 1563 A 62 ALA HB% A 81 LEU HDx% 1.0 . 7.23 2062 1563 A 62 ALA HB% A 81 LEU HDy% 1.0 . 7.23 2063 1564 A 63 THR H A 81 LEU HDx% 1.0 . 7.85 2064 1564 A 63 THR H A 81 LEU HDy% 1.0 . 7.85 2065 1565 A 63 THR HA A 81 LEU HDx% 1.0 . 7.85 2066 1565 A 63 THR HA A 81 LEU HDy% 1.0 . 7.85 2067 1566 A 64 ARG H A 64 ARG HGx 1.0 . 4.48 2068 1566 A 64 ARG H A 64 ARG HGy 1.0 . 4.48 2069 1567 A 65 LEU H A 65 LEU HBx 1.0 . 3.39 2070 1567 A 65 LEU H A 65 LEU HBy 1.0 . 3.39 2071 1568 A 65 LEU H A 65 LEU HDx% 1.0 . 5.17 2072 1568 A 65 LEU H A 65 LEU HDy% 1.0 . 5.17 2073 1569 A 65 LEU HA A 81 LEU HDx% 1.0 . 7.32 2074 1569 A 65 LEU HA A 81 LEU HDy% 1.0 . 7.32 2075 1570 A 66 THR H A 65 LEU HBx 1.0 . 3.74 2076 1570 A 66 THR H A 65 LEU HBy 1.0 . 3.74 2077 1571 A 66 THR H A 65 LEU HDx% 1.0 . 6.01 2078 1571 A 66 THR H A 65 LEU HDy% 1.0 . 6.01 2079 1572 A 65 LEU HDx% A 68 GLN HBx 1.0 . 5.26 2080 1572 A 65 LEU HDy% A 68 GLN HBx 1.0 . 5.26 2081 1572 A 68 GLN HBy A 65 LEU HDx% 1.0 . 5.26 2082 1572 A 65 LEU HDy% A 68 GLN HBy 1.0 . 5.26 2083 1573 A 69 LEU HG A 65 LEU HDx% 1.0 . 5.01 2084 1573 A 69 LEU HG A 65 LEU HDy% 1.0 . 5.01 2085 1574 A 65 LEU HDx% A 69 LEU HDx% 1.0 . 7.11 2086 1574 A 65 LEU HDy% A 69 LEU HDx% 1.0 . 7.11 2087 1574 A 69 LEU HDy% A 65 LEU HDx% 1.0 . 7.11 2088 1574 A 69 LEU HDy% A 65 LEU HDy% 1.0 . 7.11 2089 1575 A 65 LEU HDx% A 81 LEU HDx% 1.0 . 7.00 2090 1575 A 65 LEU HDy% A 81 LEU HDx% 1.0 . 7.00 2091 1575 A 81 LEU HDy% A 65 LEU HDx% 1.0 . 7.00 2092 1575 A 65 LEU HDy% A 81 LEU HDy% 1.0 . 7.00 2093 1576 A 90 PHE HD% A 65 LEU HDx% 1.0 . 8.81 2094 1576 A 90 PHE HD% A 65 LEU HDy% 1.0 . 8.81 2095 1577 A 90 PHE HE% A 65 LEU HDx% 1.0 . 9.84 2096 1577 A 90 PHE HE% A 65 LEU HDy% 1.0 . 9.84 2097 1578 A 66 THR H A 81 LEU HDx% 1.0 . 7.85 2098 1578 A 66 THR H A 81 LEU HDy% 1.0 . 7.85 2099 1579 A 66 THR HB A 69 LEU HDx% 1.0 . 6.17 2100 1579 A 66 THR HB A 69 LEU HDy% 1.0 . 6.17 2101 1580 A 66 THR HB A 94 LEU HDx% 1.0 . 7.85 2102 1580 A 66 THR HB A 94 LEU HDy% 1.0 . 7.85 2103 1581 A 67 GLY H A 68 GLN HBx 1.0 . 5.32 2104 1581 A 67 GLY H A 68 GLN HBy 1.0 . 5.32 2105 1582 A 70 HIS H A 67 GLY HAx 1.0 . 4.01 2106 1582 A 70 HIS H A 67 GLY HAy 1.0 . 4.01 2107 1583 A 70 HIS HA A 67 GLY HAx 1.0 . 6.73 2108 1583 A 70 HIS HA A 67 GLY HAy 1.0 . 6.73 2109 1584 A 67 GLY HAx A 70 HIS HBy 1.0 . 4.14 2110 1584 A 67 GLY HAy A 70 HIS HBy 1.0 . 4.14 2111 1584 A 70 HIS HBx A 67 GLY HAx 1.0 . 4.14 2112 1584 A 67 GLY HAy A 70 HIS HBx 1.0 . 4.14 2113 1585 A 68 GLN H A 68 GLN HGy 1.0 . 3.99 2114 1585 A 68 GLN H A 68 GLN HGx 1.0 . 3.99 2115 1586 A 68 GLN H A 69 LEU HDx% 1.0 . 7.64 2116 1586 A 68 GLN H A 69 LEU HDy% 1.0 . 7.64 2117 1587 A 69 LEU H A 68 GLN HBx 1.0 . 4.05 2118 1587 A 69 LEU H A 68 GLN HBy 1.0 . 4.05 2119 1588 A 69 LEU H A 68 GLN HGy 1.0 . 5.54 2120 1588 A 69 LEU H A 68 GLN HGx 1.0 . 5.54 2121 1589 A 69 LEU H A 69 LEU HBx 1.0 . 3.60 2122 1589 A 69 LEU H A 69 LEU HBy 1.0 . 3.60 2123 1590 A 69 LEU H A 69 LEU HDx% 1.0 . 4.63 2124 1590 A 69 LEU H A 69 LEU HDy% 1.0 . 4.63 2125 1591 A 69 LEU HA A 69 LEU HDx% 1.0 . 3.64 2126 1591 A 69 LEU HA A 69 LEU HDy% 1.0 . 3.64 2127 1592 A 69 LEU HA A 94 LEU HDx% 1.0 . 7.85 2128 1592 A 69 LEU HA A 94 LEU HDy% 1.0 . 7.85 2129 1593 A 70 HIS H A 69 LEU HBx 1.0 . 4.00 2130 1593 A 70 HIS H A 69 LEU HBy 1.0 . 4.00 2131 1594 A 69 LEU HBx A 74 TYR HBy 1.0 . 5.53 2132 1594 A 69 LEU HBy A 74 TYR HBy 1.0 . 5.53 2133 1594 A 74 TYR HBx A 69 LEU HBx 1.0 . 5.53 2134 1594 A 74 TYR HBx A 69 LEU HBy 1.0 . 5.53 2135 1595 A 74 TYR HE% A 69 LEU HBx 1.0 . 8.69 2136 1595 A 74 TYR HE% A 69 LEU HBy 1.0 . 8.69 2137 1596 A 69 LEU HBx A 94 LEU HDx% 1.0 . 5.51 2138 1596 A 69 LEU HBy A 94 LEU HDx% 1.0 . 5.51 2139 1596 A 94 LEU HDy% A 69 LEU HBx 1.0 . 5.51 2140 1596 A 94 LEU HDy% A 69 LEU HBy 1.0 . 5.51 2141 1597 A 69 LEU HG A 94 LEU HDx% 1.0 . 7.85 2142 1597 A 69 LEU HG A 94 LEU HDy% 1.0 . 7.85 2143 1598 A 70 HIS H A 69 LEU HDx% 1.0 . 5.81 2144 1598 A 70 HIS H A 69 LEU HDy% 1.0 . 5.81 2145 1599 A 72 ALA H A 69 LEU HDx% 1.0 . 6.85 2146 1599 A 72 ALA H A 69 LEU HDy% 1.0 . 6.85 2147 1600 A 72 ALA HA A 69 LEU HDx% 1.0 . 7.85 2148 1600 A 72 ALA HA A 69 LEU HDy% 1.0 . 7.85 2149 1601 A 72 ALA HB% A 69 LEU HDx% 1.0 . 7.59 2150 1601 A 72 ALA HB% A 69 LEU HDy% 1.0 . 7.59 2151 1602 A 74 TYR H A 69 LEU HDx% 1.0 . 6.85 2152 1602 A 74 TYR H A 69 LEU HDy% 1.0 . 6.85 2153 1603 A 74 TYR HA A 69 LEU HDx% 1.0 . 7.85 2154 1603 A 74 TYR HA A 69 LEU HDy% 1.0 . 7.85 2155 1604 A 69 LEU HDx% A 74 TYR HBy 1.0 . 5.55 2156 1604 A 69 LEU HDy% A 74 TYR HBy 1.0 . 5.55 2157 1604 A 74 TYR HBx A 69 LEU HDx% 1.0 . 5.55 2158 1604 A 69 LEU HDy% A 74 TYR HBx 1.0 . 5.55 2159 1605 A 74 TYR HD% A 69 LEU HDx% 1.0 . 9.23 2160 1605 A 74 TYR HD% A 69 LEU HDy% 1.0 . 9.23 2161 1606 A 74 TYR HE% A 69 LEU HDx% 1.0 . 9.84 2162 1606 A 74 TYR HE% A 69 LEU HDy% 1.0 . 9.84 2163 1607 A 76 ALA HA A 69 LEU HDx% 1.0 . 7.85 2164 1607 A 76 ALA HA A 69 LEU HDy% 1.0 . 7.85 2165 1608 A 76 ALA HB% A 69 LEU HDx% 1.0 . 6.99 2166 1608 A 76 ALA HB% A 69 LEU HDy% 1.0 . 6.99 2167 1609 A 69 LEU HDy% A 81 LEU HDx% 1.0 . 7.84 2168 1609 A 69 LEU HDx% A 81 LEU HDx% 1.0 . 7.84 2169 1609 A 81 LEU HDy% A 69 LEU HDx% 1.0 . 7.84 2170 1609 A 69 LEU HDy% A 81 LEU HDy% 1.0 . 7.84 2171 1610 A 90 PHE HD% A 69 LEU HDx% 1.0 . 8.23 2172 1610 A 90 PHE HD% A 69 LEU HDy% 1.0 . 8.23 2173 1611 A 90 PHE HE% A 69 LEU HDx% 1.0 . 8.46 2174 1611 A 90 PHE HE% A 69 LEU HDy% 1.0 . 8.46 2175 1612 A 69 LEU HDy% A 94 LEU HDx% 1.0 . 5.89 2176 1612 A 69 LEU HDx% A 94 LEU HDx% 1.0 . 5.89 2177 1612 A 94 LEU HDy% A 69 LEU HDx% 1.0 . 5.89 2178 1612 A 94 LEU HDy% A 69 LEU HDy% 1.0 . 5.89 2179 1613 A 70 HIS H A 70 HIS HBy 1.0 . 3.66 2180 1613 A 70 HIS H A 70 HIS HBx 1.0 . 3.66 2181 1614 A 71 GLN H A 70 HIS HBy 1.0 . 3.63 2182 1614 A 71 GLN H A 70 HIS HBx 1.0 . 3.63 2183 1615 A 70 HIS HD2 A 94 LEU HDx% 1.0 . 7.85 2184 1615 A 70 HIS HD2 A 94 LEU HDy% 1.0 . 7.85 2185 1616 A 71 GLN H A 71 GLN HGx 1.0 . 4.38 2186 1616 A 71 GLN H A 71 GLN HGy 1.0 . 4.38 2187 1617 A 72 ALA H A 71 GLN HGx 1.0 . 5.86 2188 1617 A 72 ALA H A 71 GLN HGy 1.0 . 5.86 2189 1618 A 72 ALA H A 73 GLY HAx 1.0 . 5.66 2190 1618 A 72 ALA H A 73 GLY HAy 1.0 . 5.66 2191 1619 A 72 ALA HB% A 73 GLY HAx 1.0 . 6.87 2192 1619 A 72 ALA HB% A 73 GLY HAy 1.0 . 6.87 2193 1620 A 73 GLY H A 74 TYR HBy 1.0 . 5.65 2194 1620 A 73 GLY H A 74 TYR HBx 1.0 . 5.65 2195 1621 A 73 GLY HAx A 96 LYS HE2 1.0 . 7.54 2196 1621 A 96 LYS HE3 A 73 GLY HAx 1.0 . 7.54 2197 1621 A 96 LYS HE3 A 73 GLY HAy 1.0 . 7.54 2198 1621 A 73 GLY HAy A 96 LYS HE2 1.0 . 7.54 2199 1622 A 97 THR HG2% A 73 GLY HAx 1.0 . 5.07 2200 1622 A 97 THR HG2% A 73 GLY HAy 1.0 . 5.07 2201 1623 A 75 GLU H A 74 TYR HBy 1.0 . 4.02 2202 1623 A 75 GLU H A 74 TYR HBx 1.0 . 4.02 2203 1624 A 76 ALA H A 74 TYR HBy 1.0 . 5.86 2204 1624 A 76 ALA H A 74 TYR HBx 1.0 . 5.86 2205 1625 A 74 TYR HBx A 94 LEU HDx% 1.0 . 5.62 2206 1625 A 94 LEU HDy% A 74 TYR HBy 1.0 . 5.62 2207 1625 A 94 LEU HDy% A 74 TYR HBx 1.0 . 5.62 2208 1625 A 74 TYR HBy A 94 LEU HDx% 1.0 . 5.62 2209 1626 A 74 TYR HD% A 94 LEU HDx% 1.0 . 8.68 2210 1626 A 74 TYR HD% A 94 LEU HDy% 1.0 . 8.68 2211 1627 A 75 GLU H A 75 GLU HGx 1.0 . 4.39 2212 1627 A 75 GLU H A 75 GLU HGy 1.0 . 4.39 2213 1628 A 75 GLU H A 94 LEU HDx% 1.0 . 7.43 2214 1628 A 75 GLU H A 94 LEU HDy% 1.0 . 7.43 2215 1629 A 76 ALA HA A 75 GLU HBy 1.0 . 6.05 2216 1629 A 76 ALA HA A 75 GLU HBx 1.0 . 6.05 2217 1630 A 97 THR HG2% A 75 GLU HBy 1.0 . 4.60 2218 1630 A 97 THR HG2% A 75 GLU HBx 1.0 . 4.60 2219 1631 A 76 ALA H A 75 GLU HGx 1.0 . 5.64 2220 1631 A 76 ALA H A 75 GLU HGy 1.0 . 5.64 2221 1632 A 97 THR HA A 75 GLU HGx 1.0 . 5.83 2222 1632 A 75 GLU HGy A 97 THR HA 1.0 . 5.83 2223 1633 A 97 THR HG2% A 75 GLU HGx 1.0 . 5.82 2224 1633 A 97 THR HG2% A 75 GLU HGy 1.0 . 5.82 2225 1634 A 76 ALA H A 94 LEU HDx% 1.0 . 6.85 2226 1634 A 76 ALA H A 94 LEU HDy% 1.0 . 6.85 2227 1635 A 76 ALA HA A 77 GLN HBy 1.0 . 5.69 2228 1635 A 76 ALA HA A 77 GLN HBx 1.0 . 5.69 2229 1636 A 76 ALA HA A 94 LEU HDx% 1.0 . 5.69 2230 1636 A 76 ALA HA A 94 LEU HDy% 1.0 . 5.69 2231 1637 A 76 ALA HB% A 94 LEU HDx% 1.0 . 6.88 2232 1637 A 76 ALA HB% A 94 LEU HDy% 1.0 . 6.88 2233 1638 A 77 GLN H A 77 GLN HGy 1.0 . 4.43 2234 1638 A 77 GLN H A 77 GLN HGx 1.0 . 4.43 2235 1639 A 77 GLN H A 80 ASP HBy 1.0 . 4.80 2236 1639 A 77 GLN H A 80 ASP HBx 1.0 . 4.80 2237 1640 A 77 GLN H A 94 LEU HDx% 1.0 . 6.28 2238 1640 A 77 GLN H A 94 LEU HDy% 1.0 . 6.28 2239 1641 A 77 GLN HBx A 77 GLN HGy 1.0 . 2.23 2240 1641 A 77 GLN HBy A 77 GLN HGy 1.0 . 2.23 2241 1641 A 77 GLN HGx A 77 GLN HBy 1.0 . 2.23 2242 1641 A 77 GLN HBx A 77 GLN HGx 1.0 . 2.23 2243 1642 A 79 SER H A 77 GLN HBy 1.0 . 4.49 2244 1642 A 79 SER H A 77 GLN HBx 1.0 . 4.49 2245 1643 A 80 ASP H A 77 GLN HBy 1.0 . 4.03 2246 1643 A 80 ASP H A 77 GLN HBx 1.0 . 4.03 2247 1644 A 77 GLN HBx A 80 ASP HBy 1.0 . 5.48 2248 1644 A 77 GLN HBy A 80 ASP HBy 1.0 . 5.48 2249 1644 A 80 ASP HBx A 77 GLN HBy 1.0 . 5.48 2250 1644 A 77 GLN HBx A 80 ASP HBx 1.0 . 5.48 2251 1645 A 78 LEU HA A 81 LEU HBx 1.0 . 4.21 2252 1645 A 78 LEU HA A 81 LEU HBy 1.0 . 4.21 2253 1646 A 78 LEU HD2% A 81 LEU HDx% 1.0 . 9.81 2254 1646 A 78 LEU HD1% A 81 LEU HDx% 1.0 . 9.81 2255 1646 A 81 LEU HDy% A 78 LEU HD1% 1.0 . 9.81 2256 1646 A 78 LEU HD2% A 81 LEU HDy% 1.0 . 9.81 2257 1647 A 80 ASP H A 80 ASP HBy 1.0 . 3.64 2258 1647 A 80 ASP H A 80 ASP HBx 1.0 . 3.64 2259 1648 A 80 ASP HA A 83 ASN HBx 1.0 . 4.48 2260 1648 A 80 ASP HA A 83 ASN HBy 1.0 . 4.48 2261 1649 A 81 LEU H A 80 ASP HBy 1.0 . 3.67 2262 1649 A 81 LEU H A 80 ASP HBx 1.0 . 3.67 2263 1650 A 84 HIS H A 80 ASP HBy 1.0 . 5.25 2264 1650 A 84 HIS H A 80 ASP HBx 1.0 . 5.25 2265 1651 A 93 THR HG2% A 80 ASP HBy 1.0 . 5.85 2266 1651 A 93 THR HG2% A 80 ASP HBx 1.0 . 5.85 2267 1652 A 81 LEU H A 81 LEU HDx% 1.0 . 5.81 2268 1652 A 81 LEU H A 81 LEU HDy% 1.0 . 5.81 2269 1653 A 81 LEU HA A 90 PHE HBx 1.0 . 6.74 2270 1653 A 81 LEU HA A 90 PHE HBy 1.0 . 6.74 2271 1654 A 82 PHE H A 81 LEU HBx 1.0 . 4.38 2272 1654 A 82 PHE H A 81 LEU HBy 1.0 . 4.38 2273 1655 A 82 PHE HA A 81 LEU HBx 1.0 . 6.33 2274 1655 A 82 PHE HA A 81 LEU HBy 1.0 . 6.33 2275 1656 A 82 PHE H A 81 LEU HDx% 1.0 . 6.54 2276 1656 A 82 PHE H A 81 LEU HDy% 1.0 . 6.54 2277 1657 A 82 PHE HA A 81 LEU HDx% 1.0 . 6.51 2278 1657 A 82 PHE HA A 81 LEU HDy% 1.0 . 6.51 2279 1658 A 82 PHE HE% A 81 LEU HDx% 1.0 . 9.84 2280 1658 A 82 PHE HE% A 81 LEU HDy% 1.0 . 9.84 2281 1659 A 85 PRO HA A 81 LEU HDx% 1.0 . 5.87 2282 1659 A 85 PRO HA A 81 LEU HDy% 1.0 . 5.87 2283 1660 A 87 LEU HA A 81 LEU HDx% 1.0 . 7.85 2284 1660 A 87 LEU HA A 81 LEU HDy% 1.0 . 7.85 2285 1661 A 90 PHE HA A 81 LEU HDx% 1.0 . 7.85 2286 1661 A 90 PHE HA A 81 LEU HDy% 1.0 . 7.85 2287 1662 A 90 PHE HD% A 81 LEU HDx% 1.0 . 8.74 2288 1662 A 90 PHE HD% A 81 LEU HDy% 1.0 . 8.74 2289 1663 A 82 PHE H A 82 PHE HBx 1.0 . 3.58 2290 1663 A 82 PHE H A 82 PHE HBy 1.0 . 3.58 2291 1664 A 82 PHE H A 83 ASN HBx 1.0 . 4.85 2292 1664 A 82 PHE H A 83 ASN HBy 1.0 . 4.85 2293 1665 A 83 ASN H A 83 ASN HBx 1.0 . 3.69 2294 1665 A 83 ASN H A 83 ASN HBy 1.0 . 3.69 2295 1666 A 83 ASN H A 83 ASN HD22 1.0 . 6.43 2296 1666 A 83 ASN H A 83 ASN HD21 1.0 . 6.43 2297 1667 A 83 ASN HA A 85 PRO HDy 1.0 . 5.00 2298 1667 A 83 ASN HA A 85 PRO HDx 1.0 . 5.00 2299 1668 A 84 HIS HD2 A 83 ASN HBx 1.0 . 6.02 2300 1668 A 84 HIS HD2 A 83 ASN HBy 1.0 . 6.02 2301 1669 A 84 HIS H A 85 PRO HDy 1.0 . 5.10 2302 1669 A 84 HIS H A 85 PRO HDx 1.0 . 5.10 2303 1670 A 84 HIS HBy A 89 ASP HBy 1.0 . 5.13 2304 1670 A 84 HIS HBx A 89 ASP HBy 1.0 . 5.13 2305 1670 A 89 ASP HBx A 84 HIS HBy 1.0 . 5.13 2306 1670 A 84 HIS HBx A 89 ASP HBx 1.0 . 5.13 2307 1671 A 90 PHE HA A 84 HIS HBy 1.0 . 6.19 2308 1671 A 90 PHE HA A 84 HIS HBx 1.0 . 6.19 2309 1672 A 93 THR HG2% A 84 HIS HBy 1.0 . 7.07 2310 1672 A 93 THR HG2% A 84 HIS HBx 1.0 . 7.07 2311 1673 A 86 ARG H A 86 ARG HBy 1.0 . 3.58 2312 1673 A 86 ARG H A 86 ARG HBx 1.0 . 3.58 2313 1674 A 86 ARG H A 86 ARG HGx 1.0 . 4.12 2314 1674 A 86 ARG H A 86 ARG HGy 1.0 . 4.12 2315 1675 A 86 ARG H A 86 ARG HDy 1.0 . 5.79 2316 1675 A 86 ARG H A 86 ARG HDx 1.0 . 5.79 2317 1676 A 86 ARG H A 89 ASP HBy 1.0 . 5.05 2318 1676 A 86 ARG H A 89 ASP HBx 1.0 . 5.05 2319 1677 A 86 ARG HBx A 86 ARG HGx 1.0 . 2.33 2320 1677 A 86 ARG HBy A 86 ARG HGx 1.0 . 2.33 2321 1677 A 86 ARG HGy A 86 ARG HBy 1.0 . 2.33 2322 1677 A 86 ARG HBx A 86 ARG HGy 1.0 . 2.33 2323 1678 A 88 ALA H A 86 ARG HBy 1.0 . 6.73 2324 1678 A 88 ALA H A 86 ARG HBx 1.0 . 6.73 2325 1679 A 89 ASP H A 86 ARG HBy 1.0 . 4.54 2326 1679 A 89 ASP H A 86 ARG HBx 1.0 . 4.54 2327 1680 A 87 LEU H A 86 ARG HGx 1.0 . 5.72 2328 1680 A 87 LEU H A 86 ARG HGy 1.0 . 5.72 2329 1681 A 88 ALA H A 86 ARG HGx 1.0 . 4.69 2330 1681 A 88 ALA H A 86 ARG HGy 1.0 . 4.69 2331 1682 A 89 ASP H A 86 ARG HGx 1.0 . 5.61 2332 1682 A 89 ASP H A 86 ARG HGy 1.0 . 5.61 2333 1683 A 87 LEU H A 87 LEU HDx% 1.0 . 6.22 2334 1683 A 87 LEU H A 87 LEU HDy% 1.0 . 6.22 2335 1684 A 87 LEU HA A 90 PHE HBx 1.0 . 4.95 2336 1684 A 87 LEU HA A 90 PHE HBy 1.0 . 4.95 2337 1685 A 88 ALA H A 87 LEU HBx 1.0 . 4.06 2338 1685 A 88 ALA H A 87 LEU HBy 1.0 . 4.06 2339 1686 A 89 ASP H A 87 LEU HBx 1.0 . 6.74 2340 1686 A 89 ASP H A 87 LEU HBy 1.0 . 6.74 2341 1687 A 88 ALA H A 87 LEU HDx% 1.0 . 5.59 2342 1687 A 88 ALA H A 87 LEU HDy% 1.0 . 5.59 2343 1688 A 88 ALA HA A 87 LEU HDx% 1.0 . 5.95 2344 1688 A 88 ALA HA A 87 LEU HDy% 1.0 . 5.95 2345 1689 A 90 PHE HD% A 87 LEU HDx% 1.0 . 9.84 2346 1689 A 90 PHE HD% A 87 LEU HDy% 1.0 . 9.84 2347 1690 A 91 ALA H A 87 LEU HDx% 1.0 . 6.95 2348 1690 A 91 ALA H A 87 LEU HDy% 1.0 . 6.95 2349 1691 A 89 ASP H A 90 PHE HBx 1.0 . 5.46 2350 1691 A 89 ASP H A 90 PHE HBy 1.0 . 5.46 2351 1692 A 90 PHE H A 89 ASP HBy 1.0 . 3.71 2352 1692 A 90 PHE H A 89 ASP HBx 1.0 . 3.71 2353 1693 A 91 ALA H A 90 PHE HBx 1.0 . 4.15 2354 1693 A 91 ALA H A 90 PHE HBy 1.0 . 4.15 2355 1694 A 92 ALA H A 90 PHE HBx 1.0 . 5.65 2356 1694 A 92 ALA H A 90 PHE HBy 1.0 . 5.65 2357 1695 A 90 PHE HD% A 94 LEU HDx% 1.0 . 8.69 2358 1695 A 90 PHE HD% A 94 LEU HDy% 1.0 . 8.69 2359 1696 A 90 PHE HE% A 94 LEU HDx% 1.0 . 8.71 2360 1696 A 90 PHE HE% A 94 LEU HDy% 1.0 . 8.71 2361 1697 A 91 ALA H A 94 LEU HDx% 1.0 . 6.02 2362 1697 A 91 ALA H A 94 LEU HDy% 1.0 . 6.02 2363 1698 A 91 ALA HA A 94 LEU HBx 1.0 . 6.23 2364 1698 A 91 ALA HA A 94 LEU HBy 1.0 . 6.23 2365 1699 A 91 ALA HA A 94 LEU HDx% 1.0 . 5.38 2366 1699 A 91 ALA HA A 94 LEU HDy% 1.0 . 5.38 2367 1700 A 92 ALA HA A 94 LEU HDx% 1.0 . 7.85 2368 1700 A 92 ALA HA A 94 LEU HDy% 1.0 . 7.85 2369 1701 A 93 THR H A 94 LEU HDx% 1.0 . 6.80 2370 1701 A 93 THR H A 94 LEU HDy% 1.0 . 6.80 2371 1702 A 93 THR HB A 94 LEU HDx% 1.0 . 7.85 2372 1702 A 93 THR HB A 94 LEU HDy% 1.0 . 7.85 2373 1703 A 94 LEU H A 94 LEU HDx% 1.0 . 4.93 2374 1703 A 94 LEU H A 94 LEU HDy% 1.0 . 4.93 2375 1704 A 95 ARG H A 94 LEU HDx% 1.0 . 5.23 2376 1704 A 95 ARG H A 94 LEU HDy% 1.0 . 5.23 2377 1705 A 95 ARG HA A 95 ARG HDy 1.0 . 5.03 2378 1705 A 95 ARG HA A 95 ARG HDx 1.0 . 5.03 2379 1706 A 95 ARG HBx A 95 ARG HDy 1.0 . 2.87 2380 1706 A 95 ARG HBy A 95 ARG HDy 1.0 . 2.87 2381 1706 A 95 ARG HDx A 95 ARG HBx 1.0 . 2.87 2382 1706 A 95 ARG HDx A 95 ARG HBy 1.0 . 2.87 2383 1707 A 96 LYS H A 96 LYS HBx 1.0 . 3.56 2384 1707 A 96 LYS H A 96 LYS HBy 1.0 . 3.56 2385 1708 A 96 LYS H A 96 LYS HGy 1.0 . 4.27 2386 1708 A 96 LYS H A 96 LYS HGx 1.0 . 4.27 2387 1709 A 96 LYS HBy A 96 LYS HE2 1.0 . 6.14 2388 1709 A 96 LYS HBx A 96 LYS HE2 1.0 . 6.14 2389 1709 A 96 LYS HE3 A 96 LYS HBx 1.0 . 6.14 2390 1709 A 96 LYS HE3 A 96 LYS HBy 1.0 . 6.14 2391 1710 A 97 THR H A 96 LYS HBx 1.0 . 4.34 2392 1710 A 97 THR H A 96 LYS HBy 1.0 . 4.34 2393 1711 A 97 THR H A 96 LYS HGy 1.0 . 5.53 2394 1711 A 97 THR H A 96 LYS HGx 1.0 . 5.53 2395 1712 A 98 ASP HA A 99 VAL HGy% 1.0 . 6.28 2396 1712 A 98 ASP HA A 99 VAL HGx% 1.0 . 6.28 2397 1713 A 99 VAL H A 100 PRO HDx 1.0 . 5.82 2398 1713 A 99 VAL H A 100 PRO HDy 1.0 . 5.82 2399 1714 A 101 VAL H A 100 PRO HGx 1.0 . 4.42 2400 1714 A 100 PRO HGy A 101 VAL H 1.0 . 4.42 2401 1715 A 102 GLU H A 101 VAL HG1% 1.0 . 5.90 2402 1715 A 102 GLU H A 101 VAL HG21 1.0 . 5.90 2403 1716 A 102 GLU H A 102 GLU HBx 1.0 . 3.69 2404 1716 A 102 GLU H A 102 GLU HBy 1.0 . 3.69 stop_ save_ save_DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_2 _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 3 ILE C A 4 ASP N A 4 ASP CA A 4 ASP C 1.0 -105.6 -65.6 PHI 2 2 A 4 ASP N A 4 ASP CA A 4 ASP C A 5 TYR N 1.0 80.2 130.4 PSI 3 3 A 4 ASP C A 5 TYR N A 5 TYR CA A 5 TYR C 1.0 -85.0 -45.0 PHI 4 4 A 5 TYR N A 5 TYR CA A 5 TYR C A 6 GLN N 1.0 -46.7 -6.7 PSI 5 5 A 5 TYR C A 6 GLN N A 6 GLN CA A 6 GLN C 1.0 -87.8 -47.8 PHI 6 6 A 6 GLN N A 6 GLN CA A 6 GLN C A 7 ALA N 1.0 -55.5 -15.5 PSI 7 7 A 6 GLN C A 7 ALA N A 7 ALA CA A 7 ALA C 1.0 -88.5 -48.5 PHI 8 8 A 7 ALA N A 7 ALA CA A 7 ALA C A 8 LEU N 1.0 -55.4 -15.4 PSI 9 9 A 22 ALA C A 23 ASP N A 23 ASP CA A 23 ASP C 1.0 -121.3 -74.4 PHI 10 10 A 23 ASP N A 23 ASP CA A 23 ASP C A 24 LEU N 1.0 -21.1 27.5 PSI 11 11 A 23 ASP C A 24 LEU N A 24 LEU CA A 24 LEU C 1.0 -91.2 -51.2 PHI 12 12 A 24 LEU N A 24 LEU CA A 24 LEU C A 25 PRO N 1.0 113.8 159.0 PSI 13 13 A 25 PRO N A 25 PRO CA A 25 PRO C A 26 GLN N 1.0 122.9 162.9 PSI 14 14 A 25 PRO C A 26 GLN N A 26 GLN CA A 26 GLN C 1.0 -149.5 -43.1 PHI 15 15 A 26 GLN N A 26 GLN CA A 26 GLN C A 27 GLY N 1.0 56.9 196.9 PSI 16 16 A 27 GLY C A 28 ASP N A 28 ASP CA A 28 ASP C 1.0 -82.2 -42.2 PHI 17 17 A 28 ASP N A 28 ASP CA A 28 ASP C A 29 ILE N 1.0 -58.1 -18.1 PSI 18 18 A 28 ASP C A 29 ILE N A 29 ILE CA A 29 ILE C 1.0 -83.9 -43.9 PHI 19 19 A 29 ILE N A 29 ILE CA A 29 ILE C A 30 GLU N 1.0 -66.0 -26.0 PSI 20 20 A 29 ILE C A 30 GLU N A 30 GLU CA A 30 GLU C 1.0 -82.7 -42.7 PHI 21 21 A 30 GLU N A 30 GLU CA A 30 GLU C A 31 LYS N 1.0 -62.2 -22.2 PSI 22 22 A 30 GLU C A 31 LYS N A 31 LYS CA A 31 LYS C 1.0 -84.3 -44.3 PHI 23 23 A 31 LYS N A 31 LYS CA A 31 LYS C A 32 GLN N 1.0 -61.4 -21.4 PSI 24 24 A 31 LYS C A 32 GLN N A 32 GLN CA A 32 GLN C 1.0 -85.2 -45.2 PHI 25 25 A 32 GLN N A 32 GLN CA A 32 GLN C A 33 VAL N 1.0 -61.8 -21.8 PSI 26 26 A 32 GLN C A 33 VAL N A 33 VAL CA A 33 VAL C 1.0 -83.6 -43.6 PHI 27 27 A 33 VAL N A 33 VAL CA A 33 VAL C A 34 ALA N 1.0 -63.6 -23.6 PSI 28 28 A 33 VAL C A 34 ALA N A 34 ALA CA A 34 ALA C 1.0 -83.8 -43.8 PHI 29 29 A 34 ALA N A 34 ALA CA A 34 ALA C A 35 ALA N 1.0 -60.0 -20.0 PSI 30 30 A 34 ALA C A 35 ALA N A 35 ALA CA A 35 ALA C 1.0 -85.2 -45.2 PHI 31 31 A 35 ALA N A 35 ALA CA A 35 ALA C A 36 LEU N 1.0 -61.2 -21.2 PSI 32 32 A 35 ALA C A 36 LEU N A 36 LEU CA A 36 LEU C 1.0 -85.4 -45.4 PHI 33 33 A 36 LEU N A 36 LEU CA A 36 LEU C A 37 TRP N 1.0 -62.4 -22.4 PSI 34 34 A 36 LEU C A 37 TRP N A 37 TRP CA A 37 TRP C 1.0 -82.9 -42.9 PHI 35 35 A 37 TRP N A 37 TRP CA A 37 TRP C A 38 GLN N 1.0 -63.6 -23.6 PSI 36 36 A 37 TRP C A 38 GLN N A 38 GLN CA A 38 GLN C 1.0 -83.4 -43.4 PHI 37 37 A 38 GLN N A 38 GLN CA A 38 GLN C A 39 GLN N 1.0 -59.0 -19.0 PSI 38 38 A 38 GLN C A 39 GLN N A 39 GLN CA A 39 GLN C 1.0 -89.5 -49.5 PHI 39 39 A 39 GLN N A 39 GLN CA A 39 GLN C A 40 LEU N 1.0 -61.6 -21.6 PSI 40 40 A 39 GLN C A 40 LEU N A 40 LEU CA A 40 LEU C 1.0 -89.2 -49.2 PHI 41 41 A 40 LEU N A 40 LEU CA A 40 LEU C A 41 LEU N 1.0 -56.7 -16.7 PSI 42 42 A 40 LEU C A 41 LEU N A 41 LEU CA A 41 LEU C 1.0 -111.7 -71.7 PHI 43 43 A 41 LEU N A 41 LEU CA A 41 LEU C A 42 SER N 1.0 -23.7 16.3 PSI 44 44 A 42 SER C A 43 THR N A 43 THR CA A 43 THR C 1.0 -154.6 -102.2 PHI 45 45 A 43 THR N A 43 THR CA A 43 THR C A 44 GLY N 1.0 125.2 185.6 PSI 46 46 A 45 ASN C A 46 VAL N A 46 VAL CA A 46 VAL C 1.0 -134.0 -57.5 PHI 47 47 A 46 VAL N A 46 VAL CA A 46 VAL C A 47 THR N 1.0 106.2 161.6 PSI 48 48 A 46 VAL C A 47 THR N A 47 THR CA A 47 THR C 1.0 -150.8 -103.0 PHI 49 49 A 47 THR N A 47 THR CA A 47 THR C A 48 ARG N 1.0 155.9 195.9 PSI 50 50 A 47 THR C A 48 ARG N A 48 ARG CA A 48 ARG C 1.0 -84.1 -44.1 PHI 51 51 A 48 ARG N A 48 ARG CA A 48 ARG C A 49 GLU N 1.0 -46.4 -4.2 PSI 52 52 A 49 GLU C A 50 THR N A 50 THR CA A 50 THR C 1.0 -85.4 -45.4 PHI 53 53 A 50 THR N A 50 THR CA A 50 THR C A 51 ASP N 1.0 118.3 158.3 PSI 54 54 A 50 THR C A 51 ASP N A 51 ASP CA A 51 ASP C 1.0 -150.6 -96.4 PHI 55 55 A 51 ASP N A 51 ASP CA A 51 ASP C A 52 PHE N 1.0 81.4 153.7 PSI 56 56 A 51 ASP C A 52 PHE N A 52 PHE CA A 52 PHE C 1.0 -78.0 -38.0 PHI 57 57 A 52 PHE N A 52 PHE CA A 52 PHE C A 53 PHE N 1.0 -62.4 -22.4 PSI 58 58 A 52 PHE C A 53 PHE N A 53 PHE CA A 53 PHE C 1.0 -84.8 -44.8 PHI 59 59 A 53 PHE N A 53 PHE CA A 53 PHE C A 54 GLN N 1.0 -53.5 -9.1 PSI 60 60 A 53 PHE C A 54 GLN N A 54 GLN CA A 54 GLN C 1.0 -90.9 -50.9 PHI 61 61 A 54 GLN N A 54 GLN CA A 54 GLN C A 55 GLN N 1.0 -40.8 -0.8 PSI 62 62 A 54 GLN C A 55 GLN N A 55 GLN CA A 55 GLN C 1.0 -106.8 -66.8 PHI 63 63 A 55 GLN N A 55 GLN CA A 55 GLN C A 56 GLY N 1.0 -18.8 21.2 PSI 64 64 A 55 GLN C A 56 GLY N A 56 GLY CA A 56 GLY C 1.0 80.7 120.7 PHI 65 65 A 56 GLY N A 56 GLY CA A 56 GLY C A 57 GLY N 1.0 -12.8 27.2 PSI 66 66 A 56 GLY C A 57 GLY N A 57 GLY CA A 57 GLY C 1.0 -96.0 -50.1 PHI 67 67 A 57 GLY N A 57 GLY CA A 57 GLY C A 58 ASP N 1.0 132.4 178.7 PSI 68 68 A 57 GLY C A 58 ASP N A 58 ASP CA A 58 ASP C 1.0 -146.6 -45.3 PHI 69 69 A 58 ASP N A 58 ASP CA A 58 ASP C A 59 SER N 1.0 114.2 206.2 PSI 70 70 A 58 ASP C A 59 SER N A 59 SER CA A 59 SER C 1.0 -78.3 -38.3 PHI 71 71 A 59 SER N A 59 SER CA A 59 SER C A 60 LEU N 1.0 -58.7 -18.7 PSI 72 72 A 59 SER C A 60 LEU N A 60 LEU CA A 60 LEU C 1.0 -84.1 -44.1 PHI 73 73 A 60 LEU N A 60 LEU CA A 60 LEU C A 61 LEU N 1.0 -62.9 -22.9 PSI 74 74 A 60 LEU C A 61 LEU N A 61 LEU CA A 61 LEU C 1.0 -87.2 -47.2 PHI 75 75 A 61 LEU N A 61 LEU CA A 61 LEU C A 62 ALA N 1.0 -60.6 -20.6 PSI 76 76 A 61 LEU C A 62 ALA N A 62 ALA CA A 62 ALA C 1.0 -84.8 -44.8 PHI 77 77 A 62 ALA N A 62 ALA CA A 62 ALA C A 63 THR N 1.0 -59.3 -19.3 PSI 78 78 A 62 ALA C A 63 THR N A 63 THR CA A 63 THR C 1.0 -83.9 -43.9 PHI 79 79 A 63 THR N A 63 THR CA A 63 THR C A 64 ARG N 1.0 -62.9 -22.9 PSI 80 80 A 63 THR C A 64 ARG N A 64 ARG CA A 64 ARG C 1.0 -84.7 -44.7 PHI 81 81 A 64 ARG N A 64 ARG CA A 64 ARG C A 65 LEU N 1.0 -61.9 -21.9 PSI 82 82 A 64 ARG C A 65 LEU N A 65 LEU CA A 65 LEU C 1.0 -85.2 -45.2 PHI 83 83 A 65 LEU N A 65 LEU CA A 65 LEU C A 66 THR N 1.0 -60.8 -20.8 PSI 84 84 A 65 LEU C A 66 THR N A 66 THR CA A 66 THR C 1.0 -83.2 -43.2 PHI 85 85 A 66 THR N A 66 THR CA A 66 THR C A 67 GLY N 1.0 -62.1 -22.1 PSI 86 86 A 66 THR C A 67 GLY N A 67 GLY CA A 67 GLY C 1.0 -84.6 -44.6 PHI 87 87 A 67 GLY N A 67 GLY CA A 67 GLY C A 68 GLN N 1.0 -61.9 -21.9 PSI 88 88 A 67 GLY C A 68 GLN N A 68 GLN CA A 68 GLN C 1.0 -86.7 -46.7 PHI 89 89 A 68 GLN N A 68 GLN CA A 68 GLN C A 69 LEU N 1.0 -59.1 -19.1 PSI 90 90 A 68 GLN C A 69 LEU N A 69 LEU CA A 69 LEU C 1.0 -85.1 -45.1 PHI 91 91 A 69 LEU N A 69 LEU CA A 69 LEU C A 70 HIS N 1.0 -59.3 -19.3 PSI 92 92 A 69 LEU C A 70 HIS N A 70 HIS CA A 70 HIS C 1.0 -85.5 -45.5 PHI 93 93 A 70 HIS N A 70 HIS CA A 70 HIS C A 71 GLN N 1.0 -56.7 -16.7 PSI 94 94 A 70 HIS C A 71 GLN N A 71 GLN CA A 71 GLN C 1.0 -87.0 -47.0 PHI 95 95 A 71 GLN N A 71 GLN CA A 71 GLN C A 72 ALA N 1.0 -44.2 -4.2 PSI 96 96 A 71 GLN C A 72 ALA N A 72 ALA CA A 72 ALA C 1.0 -103.8 -63.8 PHI 97 97 A 72 ALA N A 72 ALA CA A 72 ALA C A 73 GLY N 1.0 -23.1 16.9 PSI 98 98 A 72 ALA C A 73 GLY N A 73 GLY CA A 73 GLY C 1.0 71.2 111.2 PHI 99 99 A 73 GLY N A 73 GLY CA A 73 GLY C A 74 TYR N 1.0 -6.9 33.1 PSI 100 100 A 73 GLY C A 74 TYR N A 74 TYR CA A 74 TYR C 1.0 -118.8 -69.3 PHI 101 101 A 74 TYR N A 74 TYR CA A 74 TYR C A 75 GLU N 1.0 128.4 168.4 PSI 102 102 A 74 TYR C A 75 GLU N A 75 GLU CA A 75 GLU C 1.0 -101.1 -58.7 PHI 103 103 A 75 GLU N A 75 GLU CA A 75 GLU C A 76 ALA N 1.0 109.9 149.9 PSI 104 104 A 75 GLU C A 76 ALA N A 76 ALA CA A 76 ALA C 1.0 -155.0 -106.8 PHI 105 105 A 76 ALA N A 76 ALA CA A 76 ALA C A 77 GLN N 1.0 113.6 165.2 PSI 106 106 A 76 ALA C A 77 GLN N A 77 GLN CA A 77 GLN C 1.0 -133.6 -74.1 PHI 107 107 A 77 GLN N A 77 GLN CA A 77 GLN C A 78 LEU N 1.0 95.2 159.9 PSI 108 108 A 77 GLN C A 78 LEU N A 78 LEU CA A 78 LEU C 1.0 -76.3 -36.3 PHI 109 109 A 78 LEU N A 78 LEU CA A 78 LEU C A 79 SER N 1.0 -60.8 -20.8 PSI 110 110 A 78 LEU C A 79 SER N A 79 SER CA A 79 SER C 1.0 -83.8 -43.8 PHI 111 111 A 79 SER N A 79 SER CA A 79 SER C A 80 ASP N 1.0 -55.1 -15.1 PSI 112 112 A 79 SER C A 80 ASP N A 80 ASP CA A 80 ASP C 1.0 -89.9 -49.9 PHI 113 113 A 80 ASP N A 80 ASP CA A 80 ASP C A 81 LEU N 1.0 -56.8 -16.8 PSI 114 114 A 80 ASP C A 81 LEU N A 81 LEU CA A 81 LEU C 1.0 -87.3 -47.3 PHI 115 115 A 81 LEU N A 81 LEU CA A 81 LEU C A 82 PHE N 1.0 -61.9 -21.9 PSI 116 116 A 81 LEU C A 82 PHE N A 82 PHE CA A 82 PHE C 1.0 -87.2 -47.2 PHI 117 117 A 82 PHE N A 82 PHE CA A 82 PHE C A 83 ASN N 1.0 -46.2 -6.2 PSI 118 118 A 82 PHE C A 83 ASN N A 83 ASN CA A 83 ASN C 1.0 -100.2 -60.2 PHI 119 119 A 83 ASN N A 83 ASN CA A 83 ASN C A 84 HIS N 1.0 -29.9 10.1 PSI 120 120 A 85 PRO N A 85 PRO CA A 85 PRO C A 86 ARG N 1.0 -50.5 -9.1 PSI 121 121 A 86 ARG C A 87 LEU N A 87 LEU CA A 87 LEU C 1.0 -81.5 -41.5 PHI 122 122 A 87 LEU N A 87 LEU CA A 87 LEU C A 88 ALA N 1.0 -64.5 -24.5 PSI 123 123 A 87 LEU C A 88 ALA N A 88 ALA CA A 88 ALA C 1.0 -84.1 -44.1 PHI 124 124 A 88 ALA N A 88 ALA CA A 88 ALA C A 89 ASP N 1.0 -59.3 -19.3 PSI 125 125 A 88 ALA C A 89 ASP N A 89 ASP CA A 89 ASP C 1.0 -88.3 -48.3 PHI 126 126 A 89 ASP N A 89 ASP CA A 89 ASP C A 90 PHE N 1.0 -59.9 -19.9 PSI 127 127 A 89 ASP C A 90 PHE N A 90 PHE CA A 90 PHE C 1.0 -83.2 -43.2 PHI 128 128 A 90 PHE N A 90 PHE CA A 90 PHE C A 91 ALA N 1.0 -63.5 -23.5 PSI 129 129 A 90 PHE C A 91 ALA N A 91 ALA CA A 91 ALA C 1.0 -83.2 -43.2 PHI 130 130 A 91 ALA N A 91 ALA CA A 91 ALA C A 92 ALA N 1.0 -54.0 -14.0 PSI 131 131 A 91 ALA C A 92 ALA N A 92 ALA CA A 92 ALA C 1.0 -89.5 -49.5 PHI 132 132 A 92 ALA N A 92 ALA CA A 92 ALA C A 93 THR N 1.0 -38.5 1.5 PSI 133 133 A 92 ALA C A 93 THR N A 93 THR CA A 93 THR C 1.0 -110.2 -70.2 PHI 134 134 A 93 THR N A 93 THR CA A 93 THR C A 94 LEU N 1.0 -29.3 12.6 PSI 135 135 A 93 THR C A 94 LEU N A 94 LEU CA A 94 LEU C 1.0 -91.8 -51.8 PHI 136 136 A 94 LEU N A 94 LEU CA A 94 LEU C A 95 ARG N 1.0 122.0 163.3 PSI 137 137 A 94 LEU C A 95 ARG N A 95 ARG CA A 95 ARG C 1.0 -158.9 -96.3 PHI 138 138 A 95 ARG N A 95 ARG CA A 95 ARG C A 96 LYS N 1.0 114.5 168.9 PSI 139 139 A 95 ARG C A 96 LYS N A 96 LYS CA A 96 LYS C 1.0 -90.2 -50.2 PHI 140 140 A 96 LYS N A 96 LYS CA A 96 LYS C A 97 THR N 1.0 107.4 166.0 PSI 141 141 A 96 LYS C A 97 THR N A 97 THR CA A 97 THR C 1.0 -93.8 -49.9 PHI 142 142 A 97 THR N A 97 THR CA A 97 THR C A 98 ASP N 1.0 120.7 170.6 PSI 143 143 A 97 THR C A 98 ASP N A 98 ASP CA A 98 ASP C 1.0 -92.1 -52.1 PHI 144 144 A 98 ASP N A 98 ASP CA A 98 ASP C A 99 VAL N 1.0 105.7 165.5 PSI 145 145 A 98 ASP C A 99 VAL N A 99 VAL CA A 99 VAL C 1.0 -127.1 -63.5 PHI 146 146 A 99 VAL N A 99 VAL CA A 99 VAL C A 100 PRO N 1.0 100.0 169.6 PSI stop_ save_