data_nef_c16617_2kqy 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 3FS7 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 ALA start . . 2 A 2 ILE middle . . 3 A 3 THR middle . . 4 A 4 ASP middle . . 5 A 5 ILE middle . . 6 A 6 LEU middle . . 7 A 7 SER middle . . 8 A 8 ALA middle . . 9 A 9 LYS middle . . 10 A 10 ASP middle . . 11 A 11 ILE middle . . 12 A 12 GLU middle . . 13 A 13 SER middle . . 14 A 14 ALA middle . . 15 A 15 LEU middle . . 16 A 16 SER middle . . 17 A 17 SER middle . . 18 A 18 CYS middle . . 19 A 19 GLN middle . . 20 A 20 ALA middle . . 21 A 21 ALA middle . . 22 A 22 ASP middle . . 23 A 23 SER middle . . 24 A 24 PHE middle . . 25 A 25 ASN middle . . 26 A 26 TYR middle . . 27 A 27 LYS middle . . 28 A 28 SER middle . . 29 A 29 PHE middle . . 30 A 30 PHE middle . . 31 A 31 SER middle . . 32 A 32 THR middle . . 33 A 33 VAL middle . . 34 A 34 GLY middle . false 35 A 35 LEU middle . . 36 A 36 SER middle . . 37 A 37 SER middle . . 38 A 38 LYS middle . . 39 A 39 THR middle . . 40 A 40 PRO middle . false 41 A 41 ASP middle . . 42 A 42 GLN middle . . 43 A 43 ILE middle . . 44 A 44 LYS middle . . 45 A 45 LYS middle . . 46 A 46 VAL middle . . 47 A 47 PHE middle . . 48 A 48 GLY middle . false 49 A 49 ILE middle . . 50 A 50 LEU middle . . 51 A 51 ASP middle . . 52 A 52 GLN middle . . 53 A 53 ASP middle . . 54 A 54 LYS middle . . 55 A 55 SER middle . . 56 A 56 GLY middle . false 57 A 57 PHE middle . . 58 A 58 ILE middle . . 59 A 59 GLU middle . . 60 A 60 GLU middle . . 61 A 61 GLU middle . . 62 A 62 GLU middle . . 63 A 63 LEU middle . . 64 A 64 GLN middle . . 65 A 65 LEU middle . . 66 A 66 PHE middle . . 67 A 67 LEU middle . . 68 A 68 LYS middle . . 69 A 69 ASN middle . . 70 A 70 PHE middle . . 71 A 71 SER middle . . 72 A 72 SER middle . . 73 A 73 SER middle . . 74 A 74 ALA middle . . 75 A 75 ARG middle . . 76 A 76 VAL middle . . 77 A 77 LEU middle . . 78 A 78 THR middle . . 79 A 79 SER middle . . 80 A 80 ALA middle . . 81 A 81 GLU middle . . 82 A 82 THR middle . . 83 A 83 LYS middle . . 84 A 84 ALA middle . . 85 A 85 PHE middle . . 86 A 86 LEU middle . . 87 A 87 ALA middle . . 88 A 88 ALA middle . . 89 A 89 GLY middle . false 90 A 90 ASP middle . . 91 A 91 THR middle . . 92 A 92 ASP middle . . 93 A 93 GLY middle . false 94 A 94 ASP middle . . 95 A 95 GLY middle . false 96 A 96 LYS middle . . 97 A 97 ILE middle . . 98 A 98 GLY middle . false 99 A 99 VAL middle . . 100 A 100 GLU middle . . 101 A 101 GLU middle . . 102 A 102 PHE middle . . 103 A 103 GLN middle . . 104 A 104 SER middle . . 105 A 105 LEU middle . . 106 A 106 VAL middle . . 107 A 107 LYS middle . . 108 A 108 ALA end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 2 ILE HA H 1 3.897 0.02 A 2 ILE HB H 1 1.795 0.02 A 2 ILE HD1% H 1 0.480 0.02 A 2 ILE HG1x H 1 1.133 0.02 A 2 ILE HG1y H 1 1.426 0.02 A 2 ILE HG2% H 1 0.999 0.02 A 2 ILE C C 13 176.400 0.3 A 2 ILE CA C 13 63.860 0.3 A 2 ILE CB C 13 38.260 0.3 A 2 ILE CD1 C 13 13.900 0.3 A 2 ILE CG1 C 13 29.844 0.3 A 2 ILE CG2 C 13 18.400 0.3 A 3 THR H H 1 7.293 0.02 A 3 THR HA H 1 4.990 0.02 A 3 THR HB H 1 4.620 0.02 A 3 THR HG2% H 1 1.260 0.02 A 3 THR C C 13 175.010 0.3 A 3 THR CA C 13 62.290 0.3 A 3 THR CB C 13 67.900 0.3 A 3 THR CG2 C 13 22.533 0.3 A 3 THR N N 15 108.950 0.2 A 4 ASP H H 1 7.749 0.02 A 4 ASP HA H 1 4.690 0.02 A 4 ASP HBx H 1 2.780 0.02 A 4 ASP HBy H 1 2.850 0.02 A 4 ASP C C 13 176.010 0.3 A 4 ASP CA C 13 55.760 0.3 A 4 ASP CB C 13 41.190 0.3 A 4 ASP N N 15 118.685 0.2 A 5 ILE H H 1 7.456 0.02 A 5 ILE HA H 1 4.076 0.02 A 5 ILE HB H 1 1.668 0.02 A 5 ILE HD1% H 1 0.850 0.02 A 5 ILE HG1x H 1 1.098 0.02 A 5 ILE HG1y H 1 1.520 0.02 A 5 ILE HG2% H 1 0.880 0.02 A 5 ILE C C 13 174.200 0.3 A 5 ILE CA C 13 62.550 0.3 A 5 ILE CB C 13 41.380 0.3 A 5 ILE CD1 C 13 14.460 0.3 A 5 ILE CG1 C 13 28.200 0.3 A 5 ILE CG2 C 13 17.850 0.3 A 5 ILE N N 15 118.090 0.2 A 6 LEU H H 1 7.917 0.02 A 6 LEU HA H 1 4.730 0.02 A 6 LEU HBx H 1 1.596 0.02 A 6 LEU HBy H 1 1.686 0.02 A 6 LEU HDx% H 1 0.922 0.02 A 6 LEU HDy% H 1 1.153 0.02 A 6 LEU HG H 1 1.690 0.02 A 6 LEU C C 13 175.010 0.3 A 6 LEU CA C 13 51.900 0.3 A 6 LEU CB C 13 43.310 0.3 A 6 LEU CDx C 13 22.200 0.3 A 6 LEU CDy C 13 26.300 0.3 A 6 LEU CG C 13 26.900 0.3 A 6 LEU N N 15 117.867 0.2 A 7 SER H H 1 8.669 0.02 A 7 SER HA H 1 4.560 0.02 A 7 SER HBx H 1 3.931 0.02 A 7 SER HBy H 1 4.095 0.02 A 7 SER C C 13 176.300 0.3 A 7 SER CA C 13 56.900 0.3 A 7 SER CB C 13 63.800 0.3 A 7 SER N N 15 114.669 0.2 A 8 ALA H H 1 9.168 0.02 A 8 ALA HA H 1 4.051 0.02 A 8 ALA HB% H 1 1.522 0.02 A 8 ALA C C 13 180.200 0.3 A 8 ALA CA C 13 55.580 0.3 A 8 ALA CB C 13 18.190 0.3 A 8 ALA N N 15 129.537 0.2 A 9 LYS H H 1 8.278 0.02 A 9 LYS HA H 1 4.118 0.02 A 9 LYS HBx H 1 1.740 0.02 A 9 LYS HBy H 1 1.801 0.02 A 9 LYS HDx H 1 1.655 0.02 A 9 LYS HDy H 1 1.655 0.02 A 9 LYS HEx H 1 2.930 0.02 A 9 LYS HEy H 1 2.930 0.02 A 9 LYS HGx H 1 1.420 0.02 A 9 LYS HGy H 1 1.470 0.02 A 9 LYS C C 13 178.700 0.3 A 9 LYS CA C 13 58.800 0.3 A 9 LYS CB C 13 32.040 0.3 A 9 LYS CD C 13 28.900 0.3 A 9 LYS CE C 13 42.158 0.3 A 9 LYS CG C 13 24.420 0.3 A 9 LYS N N 15 117.852 0.2 A 10 ASP H H 1 7.239 0.02 A 10 ASP HA H 1 4.395 0.02 A 10 ASP HBy H 1 3.020 0.02 A 10 ASP HBx H 1 2.810 0.02 A 10 ASP C C 13 178.500 0.3 A 10 ASP CA C 13 56.990 0.3 A 10 ASP CB C 13 39.500 0.3 A 10 ASP N N 15 121.518 0.2 A 11 ILE H H 1 8.257 0.02 A 11 ILE HA H 1 3.465 0.02 A 11 ILE HB H 1 1.987 0.02 A 11 ILE HD1% H 1 0.950 0.02 A 11 ILE HG1y H 1 1.710 0.02 A 11 ILE HG1x H 1 0.810 0.02 A 11 ILE HG2% H 1 1.001 0.02 A 11 ILE C C 13 177.100 0.3 A 11 ILE CA C 13 66.300 0.3 A 11 ILE CB C 13 38.240 0.3 A 11 ILE CD1 C 13 14.410 0.3 A 11 ILE CG1 C 13 30.060 0.3 A 11 ILE CG2 C 13 18.200 0.3 A 11 ILE N N 15 121.045 0.2 A 12 GLU H H 1 8.111 0.02 A 12 GLU HA H 1 3.947 0.02 A 12 GLU HBx H 1 2.140 0.02 A 12 GLU HBy H 1 2.140 0.02 A 12 GLU HGx H 1 2.234 0.02 A 12 GLU HGy H 1 2.368 0.02 A 12 GLU C C 13 179.900 0.3 A 12 GLU CA C 13 59.810 0.3 A 12 GLU CB C 13 29.200 0.3 A 12 GLU CG C 13 36.090 0.3 A 12 GLU N N 15 119.151 0.2 A 13 SER H H 1 8.052 0.02 A 13 SER HA H 1 4.179 0.02 A 13 SER HBy H 1 3.967 0.02 A 13 SER HBx H 1 3.813 0.02 A 13 SER C C 13 177.010 0.3 A 13 SER CA C 13 61.400 0.3 A 13 SER CB C 13 62.800 0.3 A 13 SER N N 15 115.424 0.2 A 14 ALA H H 1 8.488 0.02 A 14 ALA HA H 1 3.766 0.02 A 14 ALA HB% H 1 0.756 0.02 A 14 ALA C C 13 180.900 0.3 A 14 ALA CA C 13 55.080 0.3 A 14 ALA CB C 13 18.360 0.3 A 14 ALA N N 15 125.024 0.2 A 15 LEU H H 1 8.695 0.02 A 15 LEU HA H 1 4.236 0.02 A 15 LEU HBy H 1 1.989 0.02 A 15 LEU HBx H 1 1.519 0.02 A 15 LEU HDx% H 1 0.909 0.02 A 15 LEU HDy% H 1 1.015 0.02 A 15 LEU HG H 1 1.920 0.02 A 15 LEU C C 13 180.700 0.3 A 15 LEU CA C 13 57.460 0.3 A 15 LEU CB C 13 41.280 0.3 A 15 LEU CDy C 13 27.550 0.3 A 15 LEU CDx C 13 24.350 0.3 A 15 LEU CG C 13 27.300 0.3 A 15 LEU N N 15 118.322 0.2 A 16 SER H H 1 8.341 0.02 A 16 SER HA H 1 4.277 0.02 A 16 SER HBx H 1 4.036 0.02 A 16 SER HBy H 1 4.036 0.02 A 16 SER C C 13 177.400 0.3 A 16 SER CA C 13 61.550 0.3 A 16 SER CB C 13 62.580 0.3 A 16 SER N N 15 115.956 0.2 A 17 SER H H 1 7.593 0.02 A 17 SER HA H 1 4.463 0.02 A 17 SER HBx H 1 4.001 0.02 A 17 SER HBy H 1 4.001 0.02 A 17 SER C C 13 174.900 0.3 A 17 SER CA C 13 60.520 0.3 A 17 SER CB C 13 63.810 0.3 A 17 SER N N 15 113.991 0.2 A 18 CYS H H 1 7.506 0.02 A 18 CYS HA H 1 5.740 0.02 A 18 CYS HBy H 1 3.128 0.02 A 18 CYS HBx H 1 2.944 0.02 A 18 CYS C C 13 174.700 0.3 A 18 CYS CA C 13 55.430 0.3 A 18 CYS CB C 13 27.780 0.3 A 18 CYS N N 15 114.491 0.2 A 19 GLN H H 1 7.339 0.02 A 19 GLN HA H 1 4.125 0.02 A 19 GLN HBx H 1 2.187 0.02 A 19 GLN HBy H 1 2.187 0.02 A 19 GLN HE2x H 1 6.910 0.02 A 19 GLN HE2y H 1 7.590 0.02 A 19 GLN HGx H 1 2.470 0.02 A 19 GLN HGy H 1 2.570 0.02 A 19 GLN C C 13 176.400 0.3 A 19 GLN CA C 13 59.200 0.3 A 19 GLN CB C 13 29.270 0.3 A 19 GLN CG C 13 33.970 0.3 A 19 GLN N N 15 122.591 0.2 A 19 GLN NE2 N 15 111.600 0.2 A 20 ALA H H 1 8.163 0.02 A 20 ALA HA H 1 4.290 0.02 A 20 ALA HB% H 1 1.332 0.02 A 20 ALA C C 13 178.500 0.3 A 20 ALA CA C 13 51.810 0.3 A 20 ALA CB C 13 19.060 0.3 A 20 ALA N N 15 119.740 0.2 A 21 ALA H H 1 8.906 0.02 A 21 ALA HA H 1 3.840 0.02 A 21 ALA HB% H 1 1.347 0.02 A 21 ALA C C 13 177.600 0.3 A 21 ALA CA C 13 54.150 0.3 A 21 ALA CB C 13 17.920 0.3 A 21 ALA N N 15 126.296 0.2 A 22 ASP H H 1 7.072 0.02 A 22 ASP HA H 1 4.517 0.02 A 22 ASP HBx H 1 2.920 0.02 A 22 ASP HBy H 1 2.920 0.02 A 22 ASP C C 13 175.200 0.3 A 22 ASP CA C 13 58.550 0.3 A 22 ASP CB C 13 38.420 0.3 A 22 ASP N N 15 113.934 0.2 A 23 SER H H 1 7.694 0.02 A 23 SER HA H 1 4.530 0.02 A 23 SER HBy H 1 4.133 0.02 A 23 SER HBx H 1 3.591 0.02 A 23 SER C C 13 175.800 0.3 A 23 SER CA C 13 58.950 0.3 A 23 SER CB C 13 65.270 0.3 A 23 SER N N 15 111.400 0.2 A 24 PHE H H 1 9.302 0.02 A 24 PHE HA H 1 4.169 0.02 A 24 PHE HBx H 1 2.876 0.02 A 24 PHE HBy H 1 2.876 0.02 A 24 PHE HDx H 1 7.198 0.02 A 24 PHE HDy H 1 7.198 0.02 A 24 PHE HEx H 1 6.171 0.02 A 24 PHE HEy H 1 6.171 0.02 A 24 PHE C C 13 174.200 0.3 A 24 PHE CA C 13 59.940 0.3 A 24 PHE CB C 13 40.150 0.3 A 24 PHE N N 15 125.587 0.2 A 25 ASN H H 1 7.483 0.02 A 25 ASN HA H 1 4.463 0.02 A 25 ASN HBx H 1 2.447 0.02 A 25 ASN HBy H 1 2.508 0.02 A 25 ASN HD2x H 1 6.742 0.02 A 25 ASN HD2y H 1 7.615 0.02 A 25 ASN C C 13 175.010 0.3 A 25 ASN CA C 13 51.600 0.3 A 25 ASN CB C 13 40.720 0.3 A 25 ASN N N 15 126.414 0.2 A 25 ASN ND2 N 15 113.200 0.2 A 26 TYR H H 1 8.321 0.02 A 26 TYR HA H 1 2.926 0.02 A 26 TYR HBy H 1 1.954 0.02 A 26 TYR HBx H 1 1.747 0.02 A 26 TYR HDx H 1 6.777 0.02 A 26 TYR HDy H 1 6.777 0.02 A 26 TYR HEx H 1 6.753 0.02 A 26 TYR HEy H 1 6.753 0.02 A 26 TYR C C 13 174.400 0.3 A 26 TYR CA C 13 60.400 0.3 A 26 TYR CB C 13 35.980 0.3 A 26 TYR N N 15 124.423 0.2 A 27 LYS H H 1 6.140 0.02 A 27 LYS HA H 1 3.702 0.02 A 27 LYS HBy H 1 1.460 0.02 A 27 LYS HBx H 1 1.160 0.02 A 27 LYS HDx H 1 1.528 0.02 A 27 LYS HDy H 1 1.528 0.02 A 27 LYS HEx H 1 2.910 0.02 A 27 LYS HEy H 1 2.910 0.02 A 27 LYS HGx H 1 0.969 0.02 A 27 LYS HGy H 1 1.066 0.02 A 27 LYS C C 13 179.800 0.3 A 27 LYS CA C 13 59.080 0.3 A 27 LYS CB C 13 31.750 0.3 A 27 LYS CD C 13 29.181 0.3 A 27 LYS CE C 13 42.050 0.3 A 27 LYS CG C 13 24.950 0.3 A 27 LYS N N 15 122.083 0.2 A 28 SER H H 1 7.313 0.02 A 28 SER HA H 1 4.145 0.02 A 28 SER HBx H 1 3.765 0.02 A 28 SER HBy H 1 3.765 0.02 A 28 SER C C 13 176.800 0.3 A 28 SER CA C 13 60.300 0.3 A 28 SER CB C 13 62.490 0.3 A 28 SER N N 15 114.583 0.2 A 29 PHE H H 1 8.138 0.02 A 29 PHE HA H 1 3.567 0.02 A 29 PHE HBy H 1 2.705 0.02 A 29 PHE HBx H 1 2.557 0.02 A 29 PHE HDx H 1 6.999 0.02 A 29 PHE HDy H 1 6.999 0.02 A 29 PHE HEx H 1 6.563 0.02 A 29 PHE HEy H 1 6.563 0.02 A 29 PHE C C 13 177.400 0.3 A 29 PHE CA C 13 61.570 0.3 A 29 PHE CB C 13 39.780 0.3 A 29 PHE N N 15 123.437 0.2 A 30 PHE H H 1 8.921 0.02 A 30 PHE HA H 1 4.567 0.02 A 30 PHE HBy H 1 3.467 0.02 A 30 PHE HBx H 1 3.287 0.02 A 30 PHE HDx H 1 7.509 0.02 A 30 PHE HDy H 1 7.509 0.02 A 30 PHE HEx H 1 7.346 0.02 A 30 PHE HEy H 1 7.346 0.02 A 30 PHE C C 13 178.600 0.3 A 30 PHE CA C 13 59.170 0.3 A 30 PHE CB C 13 37.310 0.3 A 30 PHE N N 15 116.125 0.2 A 31 SER H H 1 7.785 0.02 A 31 SER HA H 1 4.468 0.02 A 31 SER HBx H 1 3.998 0.02 A 31 SER HBy H 1 3.998 0.02 A 31 SER C C 13 178.010 0.3 A 31 SER CA C 13 60.600 0.3 A 31 SER CB C 13 62.890 0.3 A 31 SER N N 15 113.661 0.2 A 32 THR H H 1 8.595 0.02 A 32 THR HA H 1 3.799 0.02 A 32 THR HB H 1 3.803 0.02 A 32 THR HG2% H 1 1.040 0.02 A 32 THR C C 13 178.800 0.3 A 32 THR CA C 13 66.630 0.3 A 32 THR CB C 13 68.250 0.3 A 32 THR CG2 C 13 21.410 0.3 A 32 THR N N 15 120.336 0.2 A 33 VAL H H 1 8.390 0.02 A 33 VAL HA H 1 3.786 0.02 A 33 VAL HB H 1 1.443 0.02 A 33 VAL HGx% H 1 0.934 0.02 A 33 VAL HGy% H 1 0.885 0.02 A 33 VAL C C 13 174.600 0.3 A 33 VAL CA C 13 62.220 0.3 A 33 VAL CB C 13 31.800 0.3 A 33 VAL CGy C 13 24.100 0.3 A 33 VAL CGx C 13 21.620 0.3 A 33 VAL N N 15 115.700 0.2 A 34 GLY H H 1 7.264 0.02 A 34 GLY HAy H 1 4.225 0.02 A 34 GLY HAx H 1 3.957 0.02 A 34 GLY C C 13 175.700 0.3 A 34 GLY CA C 13 45.410 0.3 A 34 GLY N N 15 106.007 0.2 A 35 LEU H H 1 7.727 0.02 A 35 LEU HA H 1 4.108 0.02 A 35 LEU HBy H 1 1.704 0.02 A 35 LEU HBx H 1 1.540 0.02 A 35 LEU HDx% H 1 0.955 0.02 A 35 LEU HDy% H 1 1.060 0.02 A 35 LEU HG H 1 1.788 0.02 A 35 LEU C C 13 177.010 0.3 A 35 LEU CA C 13 56.920 0.3 A 35 LEU CB C 13 43.130 0.3 A 35 LEU CDy C 13 26.080 0.3 A 35 LEU CDx C 13 24.900 0.3 A 35 LEU CG C 13 27.190 0.3 A 35 LEU N N 15 120.477 0.2 A 36 SER H H 1 7.751 0.02 A 36 SER HA H 1 4.027 0.02 A 36 SER HBx H 1 3.927 0.02 A 36 SER HBy H 1 3.927 0.02 A 36 SER C C 13 174.300 0.3 A 36 SER CA C 13 60.880 0.3 A 36 SER CB C 13 63.080 0.3 A 36 SER N N 15 109.974 0.2 A 37 SER H H 1 7.273 0.02 A 37 SER HA H 1 4.621 0.02 A 37 SER HBy H 1 4.057 0.02 A 37 SER HBx H 1 3.838 0.02 A 37 SER C C 13 174.800 0.3 A 37 SER CA C 13 57.390 0.3 A 37 SER CB C 13 63.760 0.3 A 37 SER N N 15 112.837 0.2 A 38 LYS H H 1 7.267 0.02 A 38 LYS HA H 1 4.607 0.02 A 38 LYS HBy H 1 2.168 0.02 A 38 LYS HBx H 1 2.022 0.02 A 38 LYS HDx H 1 1.647 0.02 A 38 LYS HDy H 1 1.647 0.02 A 38 LYS HEx H 1 2.870 0.02 A 38 LYS HEy H 1 3.090 0.02 A 38 LYS HGx H 1 1.170 0.02 A 38 LYS HGy H 1 1.996 0.02 A 38 LYS C C 13 175.700 0.3 A 38 LYS CA C 13 53.550 0.3 A 38 LYS CB C 13 31.480 0.3 A 38 LYS CD C 13 26.970 0.3 A 38 LYS CE C 13 42.540 0.3 A 38 LYS CG C 13 24.780 0.3 A 38 LYS N N 15 120.732 0.2 A 39 THR H H 1 8.539 0.02 A 39 THR HA H 1 4.609 0.02 A 39 THR HB H 1 4.740 0.02 A 39 THR HG2% H 1 1.364 0.02 A 39 THR C C 13 174.200 0.3 A 39 THR CA C 13 60.300 0.3 A 39 THR CB C 13 68.300 0.3 A 39 THR CG2 C 13 22.010 0.3 A 39 THR N N 15 110.259 0.2 A 40 PRO HA H 1 4.267 0.02 A 40 PRO HBx H 1 2.371 0.02 A 40 PRO HBy H 1 2.371 0.02 A 40 PRO HDx H 1 3.899 0.02 A 40 PRO HDy H 1 3.944 0.02 A 40 PRO HGy H 1 2.209 0.02 A 40 PRO HGx H 1 1.953 0.02 A 40 PRO C C 13 175.600 0.3 A 40 PRO CA C 13 66.240 0.3 A 40 PRO CB C 13 31.780 0.3 A 40 PRO CD C 13 50.340 0.3 A 40 PRO CG C 13 28.300 0.3 A 41 ASP H H 1 8.380 0.02 A 41 ASP HA H 1 4.340 0.02 A 41 ASP HBx H 1 2.568 0.02 A 41 ASP HBy H 1 2.568 0.02 A 41 ASP C C 13 179.010 0.3 A 41 ASP CA C 13 57.500 0.3 A 41 ASP CB C 13 40.700 0.3 A 41 ASP N N 15 115.600 0.2 A 42 GLN H H 1 7.770 0.02 A 42 GLN HA H 1 3.993 0.02 A 42 GLN HBy H 1 2.627 0.02 A 42 GLN HBx H 1 1.740 0.02 A 42 GLN HE2x H 1 6.960 0.02 A 42 GLN HE2y H 1 7.700 0.02 A 42 GLN HGy H 1 2.603 0.02 A 42 GLN HGx H 1 2.358 0.02 A 42 GLN C C 13 178.500 0.3 A 42 GLN CA C 13 59.140 0.3 A 42 GLN CB C 13 29.400 0.3 A 42 GLN CG C 13 35.050 0.3 A 42 GLN N N 15 120.100 0.2 A 42 GLN NE2 N 15 112.300 0.2 A 43 ILE H H 1 8.600 0.02 A 43 ILE HA H 1 3.544 0.02 A 43 ILE HB H 1 2.008 0.02 A 43 ILE HD1% H 1 0.695 0.02 A 43 ILE HG1y H 1 1.710 0.02 A 43 ILE HG1x H 1 0.799 0.02 A 43 ILE HG2% H 1 0.914 0.02 A 43 ILE C C 13 178.200 0.3 A 43 ILE CA C 13 66.050 0.3 A 43 ILE CB C 13 37.300 0.3 A 43 ILE CD1 C 13 13.750 0.3 A 43 ILE CG1 C 13 30.083 0.3 A 43 ILE CG2 C 13 18.750 0.3 A 43 ILE N N 15 120.700 0.2 A 44 LYS H H 1 8.430 0.02 A 44 LYS HA H 1 3.925 0.02 A 44 LYS HBx H 1 1.930 0.02 A 44 LYS HBy H 1 1.930 0.02 A 44 LYS HDx H 1 1.626 0.02 A 44 LYS HDy H 1 1.639 0.02 A 44 LYS HEx H 1 2.846 0.02 A 44 LYS HEy H 1 2.846 0.02 A 44 LYS HGx H 1 1.293 0.02 A 44 LYS HGy H 1 1.502 0.02 A 44 LYS C C 13 179.500 0.3 A 44 LYS CA C 13 60.200 0.3 A 44 LYS CB C 13 32.100 0.3 A 44 LYS CD C 13 29.400 0.3 A 44 LYS CE C 13 42.000 0.3 A 44 LYS CG C 13 25.910 0.3 A 44 LYS N N 15 120.400 0.2 A 45 LYS H H 1 7.710 0.02 A 45 LYS HA H 1 4.078 0.02 A 45 LYS HBy H 1 2.083 0.02 A 45 LYS HBx H 1 1.845 0.02 A 45 LYS HDx H 1 1.654 0.02 A 45 LYS HDy H 1 1.654 0.02 A 45 LYS HEx H 1 2.930 0.02 A 45 LYS HEy H 1 2.930 0.02 A 45 LYS HGy H 1 1.647 0.02 A 45 LYS HGx H 1 1.417 0.02 A 45 LYS C C 13 179.900 0.3 A 45 LYS CA C 13 59.500 0.3 A 45 LYS CB C 13 32.200 0.3 A 45 LYS CD C 13 29.200 0.3 A 45 LYS CE C 13 42.290 0.3 A 45 LYS CG C 13 25.660 0.3 A 45 LYS N N 15 121.200 0.2 A 46 VAL H H 1 7.920 0.02 A 46 VAL HA H 1 3.457 0.02 A 46 VAL HB H 1 2.514 0.02 A 46 VAL HGx% H 1 1.114 0.02 A 46 VAL HGy% H 1 1.021 0.02 A 46 VAL C C 13 177.100 0.3 A 46 VAL CA C 13 67.250 0.3 A 46 VAL CB C 13 31.020 0.3 A 46 VAL CGy C 13 23.750 0.3 A 46 VAL CGx C 13 20.920 0.3 A 46 VAL N N 15 120.000 0.2 A 47 PHE H H 1 8.700 0.02 A 47 PHE HA H 1 3.130 0.02 A 47 PHE HBx H 1 2.830 0.02 A 47 PHE HBy H 1 3.260 0.02 A 47 PHE HDx H 1 6.549 0.02 A 47 PHE HDy H 1 6.549 0.02 A 47 PHE HEx H 1 6.853 0.02 A 47 PHE HEy H 1 6.853 0.02 A 47 PHE C C 13 177.500 0.3 A 47 PHE CA C 13 62.680 0.3 A 47 PHE CB C 13 38.710 0.3 A 47 PHE N N 15 121.200 0.2 A 48 GLY H H 1 7.807 0.02 A 48 GLY HAx H 1 3.759 0.02 A 48 GLY HAy H 1 3.759 0.02 A 48 GLY C C 13 174.800 0.3 A 48 GLY CA C 13 46.740 0.3 A 48 GLY N N 15 101.500 0.2 A 49 ILE H H 1 7.164 0.02 A 49 ILE HA H 1 3.537 0.02 A 49 ILE HB H 1 1.784 0.02 A 49 ILE HD1% H 1 0.661 0.02 A 49 ILE HG1y H 1 1.688 0.02 A 49 ILE HG1x H 1 0.947 0.02 A 49 ILE HG2% H 1 0.691 0.02 A 49 ILE C C 13 176.600 0.3 A 49 ILE CA C 13 63.770 0.3 A 49 ILE CB C 13 38.430 0.3 A 49 ILE CD1 C 13 13.580 0.3 A 49 ILE CG1 C 13 28.640 0.3 A 49 ILE CG2 C 13 17.010 0.3 A 49 ILE N N 15 119.916 0.2 A 50 LEU H H 1 7.130 0.02 A 50 LEU HA H 1 3.637 0.02 A 50 LEU HBy H 1 1.323 0.02 A 50 LEU HBx H 1 1.049 0.02 A 50 LEU HDx% H 1 0.648 0.02 A 50 LEU HDy% H 1 0.539 0.02 A 50 LEU HG H 1 1.795 0.02 A 50 LEU C C 13 177.600 0.3 A 50 LEU CA C 13 56.400 0.3 A 50 LEU CB C 13 41.280 0.3 A 50 LEU CDy C 13 26.620 0.3 A 50 LEU CDx C 13 23.270 0.3 A 50 LEU CG C 13 26.500 0.3 A 50 LEU N N 15 117.667 0.2 A 51 ASP H H 1 7.284 0.02 A 51 ASP HA H 1 4.217 0.02 A 51 ASP HBx H 1 2.409 0.02 A 51 ASP HBy H 1 2.409 0.02 A 51 ASP C C 13 176.900 0.3 A 51 ASP CA C 13 52.140 0.3 A 51 ASP CB C 13 38.680 0.3 A 51 ASP N N 15 117.036 0.2 A 52 GLN H H 1 7.666 0.02 A 52 GLN HA H 1 3.810 0.02 A 52 GLN HBx H 1 2.020 0.02 A 52 GLN HBy H 1 2.070 0.02 A 52 GLN HGx H 1 2.382 0.02 A 52 GLN HGy H 1 2.487 0.02 A 52 GLN C C 13 177.700 0.3 A 52 GLN CA C 13 58.860 0.3 A 52 GLN CB C 13 28.700 0.3 A 52 GLN CG C 13 33.950 0.3 A 52 GLN N N 15 125.059 0.2 A 53 ASP H H 1 8.601 0.02 A 53 ASP HA H 1 4.493 0.02 A 53 ASP HBy H 1 2.972 0.02 A 53 ASP HBx H 1 2.637 0.02 A 53 ASP C C 13 175.900 0.3 A 53 ASP CA C 13 52.600 0.3 A 53 ASP CB C 13 38.760 0.3 A 53 ASP N N 15 115.929 0.2 A 54 LYS H H 1 7.799 0.02 A 54 LYS HA H 1 3.941 0.02 A 54 LYS HBy H 1 1.964 0.02 A 54 LYS HBx H 1 1.817 0.02 A 54 LYS HDx H 1 1.562 0.02 A 54 LYS HDy H 1 1.687 0.02 A 54 LYS HEx H 1 2.985 0.02 A 54 LYS HEy H 1 2.985 0.02 A 54 LYS HGx H 1 1.273 0.02 A 54 LYS HGy H 1 1.342 0.02 A 54 LYS C C 13 176.800 0.3 A 54 LYS CA C 13 56.300 0.3 A 54 LYS CB C 13 28.350 0.3 A 54 LYS CD C 13 28.200 0.3 A 54 LYS CE C 13 42.560 0.3 A 54 LYS CG C 13 24.450 0.3 A 54 LYS N N 15 117.457 0.2 A 55 SER H H 1 9.236 0.02 A 55 SER HA H 1 4.327 0.02 A 55 SER HBy H 1 4.082 0.02 A 55 SER HBx H 1 3.807 0.02 A 55 SER C C 13 176.400 0.3 A 55 SER CA C 13 59.050 0.3 A 55 SER CB C 13 64.500 0.3 A 55 SER N N 15 118.163 0.2 A 56 GLY H H 1 10.882 0.02 A 56 GLY HAy H 1 4.053 0.02 A 56 GLY HAx H 1 3.344 0.02 A 56 GLY C C 13 171.800 0.3 A 56 GLY CA C 13 44.670 0.3 A 56 GLY N N 15 116.117 0.2 A 57 PHE H H 1 7.916 0.02 A 57 PHE HA H 1 5.258 0.02 A 57 PHE HBx H 1 2.627 0.02 A 57 PHE HBy H 1 2.627 0.02 A 57 PHE HDx H 1 6.945 0.02 A 57 PHE HDy H 1 6.945 0.02 A 57 PHE HEx H 1 7.384 0.02 A 57 PHE HEy H 1 7.384 0.02 A 57 PHE C C 13 173.500 0.3 A 57 PHE CA C 13 56.150 0.3 A 57 PHE CB C 13 43.770 0.3 A 57 PHE N N 15 115.699 0.2 A 58 ILE H H 1 9.242 0.02 A 58 ILE HA H 1 4.346 0.02 A 58 ILE HB H 1 1.614 0.02 A 58 ILE HD1% H 1 0.261 0.02 A 58 ILE HG1y H 1 1.159 0.02 A 58 ILE HG1x H 1 0.366 0.02 A 58 ILE HG2% H 1 0.688 0.02 A 58 ILE C C 13 176.100 0.3 A 58 ILE CA C 13 60.630 0.3 A 58 ILE CB C 13 38.790 0.3 A 58 ILE CD1 C 13 14.390 0.3 A 58 ILE CG1 C 13 25.990 0.3 A 58 ILE CG2 C 13 18.082 0.3 A 58 ILE N N 15 120.193 0.2 A 59 GLU H H 1 8.681 0.02 A 59 GLU HA H 1 4.584 0.02 A 59 GLU HBy H 1 2.410 0.02 A 59 GLU HBx H 1 1.890 0.02 A 59 GLU HGx H 1 2.240 0.02 A 59 GLU HGy H 1 2.370 0.02 A 59 GLU C C 13 177.400 0.3 A 59 GLU CA C 13 55.160 0.3 A 59 GLU CB C 13 30.890 0.3 A 59 GLU CG C 13 36.400 0.3 A 59 GLU N N 15 125.766 0.2 A 60 GLU H H 1 9.385 0.02 A 60 GLU HA H 1 3.566 0.02 A 60 GLU HBx H 1 1.986 0.02 A 60 GLU HBy H 1 2.071 0.02 A 60 GLU HGy H 1 2.147 0.02 A 60 GLU HGx H 1 2.051 0.02 A 60 GLU C C 13 177.900 0.3 A 60 GLU CA C 13 61.590 0.3 A 60 GLU CB C 13 29.510 0.3 A 60 GLU CG C 13 36.250 0.3 A 60 GLU N N 15 123.309 0.2 A 61 GLU H H 1 9.085 0.02 A 61 GLU HA H 1 4.024 0.02 A 61 GLU HBx H 1 1.970 0.02 A 61 GLU HBy H 1 2.060 0.02 A 61 GLU HGx H 1 2.293 0.02 A 61 GLU HGy H 1 2.293 0.02 A 61 GLU C C 13 178.800 0.3 A 61 GLU CA C 13 59.750 0.3 A 61 GLU CB C 13 29.260 0.3 A 61 GLU CG C 13 36.600 0.3 A 61 GLU N N 15 115.709 0.2 A 62 GLU H H 1 7.122 0.02 A 62 GLU HA H 1 4.055 0.02 A 62 GLU HBy H 1 2.448 0.02 A 62 GLU HBx H 1 1.988 0.02 A 62 GLU HGx H 1 2.290 0.02 A 62 GLU HGy H 1 2.360 0.02 A 62 GLU C C 13 180.010 0.3 A 62 GLU CA C 13 58.150 0.3 A 62 GLU CB C 13 30.100 0.3 A 62 GLU CG C 13 37.250 0.3 A 62 GLU N N 15 116.582 0.2 A 63 LEU H H 1 8.335 0.02 A 63 LEU HA H 1 3.938 0.02 A 63 LEU HBy H 1 1.590 0.02 A 63 LEU HBx H 1 1.439 0.02 A 63 LEU HDx% H 1 0.267 0.02 A 63 LEU HDy% H 1 0.149 0.02 A 63 LEU HG H 1 1.420 0.02 A 63 LEU C C 13 178.900 0.3 A 63 LEU CA C 13 56.820 0.3 A 63 LEU CB C 13 41.550 0.3 A 63 LEU CDy C 13 24.150 0.3 A 63 LEU CDx C 13 23.820 0.3 A 63 LEU CG C 13 25.900 0.3 A 63 LEU N N 15 123.335 0.2 A 64 GLN H H 1 7.792 0.02 A 64 GLN HA H 1 4.151 0.02 A 64 GLN HBx H 1 2.155 0.02 A 64 GLN HBy H 1 2.155 0.02 A 64 GLN HE2x H 1 6.805 0.02 A 64 GLN HE2y H 1 7.499 0.02 A 64 GLN HGy H 1 2.550 0.02 A 64 GLN HGx H 1 2.460 0.02 A 64 GLN C C 13 178.010 0.3 A 64 GLN CA C 13 58.810 0.3 A 64 GLN CB C 13 28.100 0.3 A 64 GLN CG C 13 34.001 0.3 A 64 GLN N N 15 116.942 0.2 A 64 GLN NE2 N 15 110.300 0.2 A 65 LEU H H 1 7.152 0.02 A 65 LEU HA H 1 4.425 0.02 A 65 LEU HBx H 1 1.788 0.02 A 65 LEU HBy H 1 1.788 0.02 A 65 LEU HDx% H 1 0.930 0.02 A 65 LEU HDy% H 1 0.818 0.02 A 65 LEU HG H 1 1.773 0.02 A 65 LEU C C 13 177.010 0.3 A 65 LEU CA C 13 53.860 0.3 A 65 LEU CB C 13 40.960 0.3 A 65 LEU CDy C 13 25.370 0.3 A 65 LEU CDx C 13 22.550 0.3 A 65 LEU CG C 13 26.640 0.3 A 65 LEU N N 15 117.250 0.2 A 66 PHE H H 1 7.757 0.02 A 66 PHE HA H 1 3.910 0.02 A 66 PHE HBx H 1 2.526 0.02 A 66 PHE HBy H 1 2.526 0.02 A 66 PHE HDx H 1 6.929 0.02 A 66 PHE HDy H 1 6.929 0.02 A 66 PHE HEx H 1 6.901 0.02 A 66 PHE HEy H 1 6.901 0.02 A 66 PHE C C 13 178.010 0.3 A 66 PHE CA C 13 62.550 0.3 A 66 PHE CB C 13 42.080 0.3 A 66 PHE N N 15 119.588 0.2 A 67 LEU H H 1 9.197 0.02 A 67 LEU HA H 1 3.930 0.02 A 67 LEU HBy H 1 2.030 0.02 A 67 LEU HBx H 1 1.290 0.02 A 67 LEU HDx% H 1 0.820 0.02 A 67 LEU HDy% H 1 0.496 0.02 A 67 LEU HG H 1 1.490 0.02 A 67 LEU C C 13 180.010 0.3 A 67 LEU CA C 13 57.200 0.3 A 67 LEU CB C 13 41.250 0.3 A 67 LEU CDy C 13 25.570 0.3 A 67 LEU CDx C 13 22.970 0.3 A 67 LEU CG C 13 26.800 0.3 A 67 LEU N N 15 114.236 0.2 A 68 LYS H H 1 7.568 0.02 A 68 LYS HA H 1 4.645 0.02 A 68 LYS HBy H 1 1.950 0.02 A 68 LYS HBx H 1 1.600 0.02 A 68 LYS HDy H 1 1.674 0.02 A 68 LYS HDx H 1 1.587 0.02 A 68 LYS HEx H 1 2.790 0.02 A 68 LYS HEy H 1 3.070 0.02 A 68 LYS HGx H 1 1.335 0.02 A 68 LYS HGy H 1 1.335 0.02 A 68 LYS C C 13 177.800 0.3 A 68 LYS CA C 13 56.940 0.3 A 68 LYS CB C 13 31.800 0.3 A 68 LYS CD C 13 29.680 0.3 A 68 LYS CE C 13 42.500 0.3 A 68 LYS CG C 13 26.020 0.3 A 68 LYS N N 15 117.421 0.2 A 69 ASN H H 1 7.037 0.02 A 69 ASN HA H 1 4.063 0.02 A 69 ASN HBy H 1 1.835 0.02 A 69 ASN HBx H 1 1.790 0.02 A 69 ASN C C 13 174.200 0.3 A 69 ASN CA C 13 55.100 0.3 A 69 ASN CB C 13 39.850 0.3 A 69 ASN N N 15 112.696 0.2 A 70 PHE H H 1 7.814 0.02 A 70 PHE HA H 1 4.158 0.02 A 70 PHE HBy H 1 3.183 0.02 A 70 PHE HBx H 1 3.108 0.02 A 70 PHE HDx H 1 7.205 0.02 A 70 PHE HDy H 1 7.205 0.02 A 70 PHE HEx H 1 6.298 0.02 A 70 PHE HEy H 1 6.298 0.02 A 70 PHE C C 13 175.300 0.3 A 70 PHE CA C 13 59.200 0.3 A 70 PHE CB C 13 38.800 0.3 A 70 PHE N N 15 116.154 0.2 A 71 SER H H 1 7.441 0.02 A 71 SER HA H 1 4.524 0.02 A 71 SER HBy H 1 3.868 0.02 A 71 SER HBx H 1 3.388 0.02 A 71 SER C C 13 177.500 0.3 A 71 SER CA C 13 57.250 0.3 A 71 SER CB C 13 64.800 0.3 A 71 SER N N 15 111.204 0.2 A 72 SER H H 1 9.224 0.02 A 72 SER HA H 1 4.270 0.02 A 72 SER HBx H 1 3.968 0.02 A 72 SER HBy H 1 3.968 0.02 A 72 SER C C 13 174.600 0.3 A 72 SER CA C 13 61.500 0.3 A 72 SER CB C 13 62.400 0.3 A 72 SER N N 15 124.882 0.2 A 73 SER H H 1 7.723 0.02 A 73 SER HA H 1 4.504 0.02 A 73 SER HBx H 1 3.789 0.02 A 73 SER HBy H 1 3.926 0.02 A 73 SER C C 13 174.300 0.3 A 73 SER CA C 13 57.700 0.3 A 73 SER CB C 13 63.400 0.3 A 73 SER N N 15 113.599 0.2 A 74 ALA H H 1 7.590 0.02 A 74 ALA HA H 1 4.301 0.02 A 74 ALA HB% H 1 1.385 0.02 A 74 ALA C C 13 175.600 0.3 A 74 ALA CA C 13 51.800 0.3 A 74 ALA CB C 13 21.650 0.3 A 74 ALA N N 15 124.800 0.2 A 75 ARG H H 1 8.210 0.02 A 75 ARG HA H 1 4.431 0.02 A 75 ARG HBy H 1 1.980 0.02 A 75 ARG HBx H 1 1.770 0.02 A 75 ARG HDy H 1 3.230 0.02 A 75 ARG HDx H 1 3.070 0.02 A 75 ARG HGy H 1 1.450 0.02 A 75 ARG HGx H 1 1.270 0.02 A 75 ARG C C 13 175.500 0.3 A 75 ARG CA C 13 54.650 0.3 A 75 ARG CB C 13 30.770 0.3 A 75 ARG CD C 13 42.900 0.3 A 75 ARG CG C 13 27.100 0.3 A 75 ARG N N 15 116.400 0.2 A 76 VAL H H 1 7.890 0.02 A 76 VAL HA H 1 4.032 0.02 A 76 VAL HB H 1 2.056 0.02 A 76 VAL HGx% H 1 1.030 0.02 A 76 VAL HGy% H 1 0.907 0.02 A 76 VAL C C 13 175.010 0.3 A 76 VAL CA C 13 62.100 0.3 A 76 VAL CB C 13 32.800 0.3 A 76 VAL CGy C 13 21.960 0.3 A 76 VAL CGx C 13 20.400 0.3 A 76 VAL N N 15 114.400 0.2 A 77 LEU H H 1 8.350 0.02 A 77 LEU HA H 1 4.512 0.02 A 77 LEU HBy H 1 1.930 0.02 A 77 LEU HBx H 1 1.580 0.02 A 77 LEU HDx% H 1 0.474 0.02 A 77 LEU HDy% H 1 0.304 0.02 A 77 LEU HG H 1 1.740 0.02 A 77 LEU C C 13 178.300 0.3 A 77 LEU CA C 13 55.070 0.3 A 77 LEU CB C 13 42.100 0.3 A 77 LEU CDy C 13 25.520 0.3 A 77 LEU CDx C 13 22.250 0.3 A 77 LEU CG C 13 27.250 0.3 A 77 LEU N N 15 124.400 0.2 A 78 THR H H 1 10.060 0.02 A 78 THR HA H 1 4.401 0.02 A 78 THR HB H 1 4.870 0.02 A 78 THR HG2% H 1 1.400 0.02 A 78 THR C C 13 176.900 0.3 A 78 THR CA C 13 60.900 0.3 A 78 THR CB C 13 71.100 0.3 A 78 THR CG2 C 13 22.090 0.3 A 78 THR N N 15 113.000 0.2 A 79 SER H H 1 9.263 0.02 A 79 SER HA H 1 4.270 0.02 A 79 SER HBx H 1 3.950 0.02 A 79 SER HBy H 1 3.950 0.02 A 79 SER C C 13 176.500 0.3 A 79 SER CA C 13 61.600 0.3 A 79 SER CB C 13 62.200 0.3 A 79 SER N N 15 118.800 0.2 A 80 ALA H H 1 8.600 0.02 A 80 ALA HA H 1 4.130 0.02 A 80 ALA HB% H 1 1.480 0.02 A 80 ALA C C 13 181.800 0.3 A 80 ALA CA C 13 55.400 0.3 A 80 ALA CB C 13 18.400 0.3 A 80 ALA N N 15 122.700 0.2 A 81 GLU H H 1 8.232 0.02 A 81 GLU HA H 1 4.185 0.02 A 81 GLU HBy H 1 2.660 0.02 A 81 GLU HBx H 1 1.930 0.02 A 81 GLU HGx H 1 2.550 0.02 A 81 GLU HGy H 1 2.890 0.02 A 81 GLU C C 13 180.100 0.3 A 81 GLU CA C 13 58.770 0.3 A 81 GLU CB C 13 31.800 0.3 A 81 GLU CG C 13 38.150 0.3 A 81 GLU N N 15 119.424 0.2 A 82 THR H H 1 8.798 0.02 A 82 THR HA H 1 3.635 0.02 A 82 THR HB H 1 4.323 0.02 A 82 THR HG2% H 1 1.120 0.02 A 82 THR C C 13 176.300 0.3 A 82 THR CA C 13 67.900 0.3 A 82 THR CB C 13 68.010 0.3 A 82 THR CG2 C 13 22.474 0.3 A 82 THR N N 15 116.782 0.2 A 83 LYS H H 1 8.509 0.02 A 83 LYS HA H 1 3.913 0.02 A 83 LYS HBy H 1 1.940 0.02 A 83 LYS HBx H 1 1.840 0.02 A 83 LYS HDx H 1 1.620 0.02 A 83 LYS HDy H 1 1.620 0.02 A 83 LYS HEx H 1 2.910 0.02 A 83 LYS HEy H 1 2.910 0.02 A 83 LYS HGx H 1 1.503 0.02 A 83 LYS HGy H 1 1.580 0.02 A 83 LYS C C 13 179.600 0.3 A 83 LYS CA C 13 59.500 0.3 A 83 LYS CB C 13 32.200 0.3 A 83 LYS CD C 13 29.001 0.3 A 83 LYS CE C 13 42.400 0.3 A 83 LYS CG C 13 25.400 0.3 A 83 LYS N N 15 120.581 0.2 A 84 ALA H H 1 7.789 0.02 A 84 ALA HA H 1 4.263 0.02 A 84 ALA HB% H 1 1.598 0.02 A 84 ALA C C 13 180.010 0.3 A 84 ALA CA C 13 55.010 0.3 A 84 ALA CB C 13 18.160 0.3 A 84 ALA N N 15 121.304 0.2 A 85 PHE H H 1 8.006 0.02 A 85 PHE HA H 1 4.460 0.02 A 85 PHE HBx H 1 3.450 0.02 A 85 PHE HBy H 1 3.450 0.02 A 85 PHE HDx H 1 6.889 0.02 A 85 PHE HDy H 1 6.889 0.02 A 85 PHE HEx H 1 6.320 0.02 A 85 PHE HEy H 1 6.320 0.02 A 85 PHE C C 13 177.600 0.3 A 85 PHE CA C 13 57.400 0.3 A 85 PHE CB C 13 38.900 0.3 A 85 PHE N N 15 122.534 0.2 A 86 LEU H H 1 8.500 0.02 A 86 LEU HA H 1 3.694 0.02 A 86 LEU HBy H 1 1.810 0.02 A 86 LEU HBx H 1 1.370 0.02 A 86 LEU HDx% H 1 0.752 0.02 A 86 LEU HDy% H 1 0.634 0.02 A 86 LEU HG H 1 1.554 0.02 A 86 LEU C C 13 177.900 0.3 A 86 LEU CA C 13 58.100 0.3 A 86 LEU CB C 13 41.950 0.3 A 86 LEU CDy C 13 25.700 0.3 A 86 LEU CDx C 13 23.130 0.3 A 86 LEU CG C 13 26.600 0.3 A 86 LEU N N 15 119.108 0.2 A 87 ALA H H 1 8.144 0.02 A 87 ALA HA H 1 4.103 0.02 A 87 ALA HB% H 1 1.460 0.02 A 87 ALA C C 13 179.900 0.3 A 87 ALA CA C 13 54.300 0.3 A 87 ALA CB C 13 18.200 0.3 A 87 ALA N N 15 117.694 0.2 A 88 ALA H H 1 7.394 0.02 A 88 ALA HA H 1 4.133 0.02 A 88 ALA HB% H 1 1.374 0.02 A 88 ALA C C 13 179.100 0.3 A 88 ALA CA C 13 53.800 0.3 A 88 ALA CB C 13 19.300 0.3 A 88 ALA N N 15 117.367 0.2 A 89 GLY H H 1 7.782 0.02 A 89 GLY HAy H 1 4.198 0.02 A 89 GLY HAx H 1 3.213 0.02 A 89 GLY C C 13 178.200 0.3 A 89 GLY CA C 13 46.200 0.3 A 89 GLY N N 15 101.358 0.2 A 90 ASP H H 1 8.404 0.02 A 90 ASP HA H 1 4.850 0.02 A 90 ASP HBy H 1 2.815 0.02 A 90 ASP HBx H 1 2.320 0.02 A 90 ASP C C 13 177.010 0.3 A 90 ASP CA C 13 53.300 0.3 A 90 ASP CB C 13 39.700 0.3 A 90 ASP N N 15 120.040 0.2 A 91 THR H H 1 8.831 0.02 A 91 THR HA H 1 4.190 0.02 A 91 THR HB H 1 4.325 0.02 A 91 THR HG2% H 1 1.230 0.02 A 91 THR C C 13 176.800 0.3 A 91 THR CA C 13 63.400 0.3 A 91 THR CB C 13 68.970 0.3 A 91 THR CG2 C 13 22.035 0.3 A 91 THR N N 15 119.250 0.2 A 92 ASP H H 1 8.865 0.02 A 92 ASP HA H 1 4.680 0.02 A 92 ASP HBy H 1 2.740 0.02 A 92 ASP HBx H 1 2.660 0.02 A 92 ASP C C 13 177.400 0.3 A 92 ASP CA C 13 54.380 0.3 A 92 ASP CB C 13 39.800 0.3 A 92 ASP N N 15 121.275 0.2 A 93 GLY H H 1 8.226 0.02 A 93 GLY HAy H 1 3.960 0.02 A 93 GLY HAx H 1 3.845 0.02 A 93 GLY C C 13 176.800 0.3 A 93 GLY CA C 13 46.900 0.3 A 93 GLY N N 15 110.695 0.2 A 94 ASP H H 1 8.948 0.02 A 94 ASP HA H 1 4.535 0.02 A 94 ASP HBy H 1 2.800 0.02 A 94 ASP HBx H 1 2.390 0.02 A 94 ASP C C 13 177.500 0.3 A 94 ASP CA C 13 53.100 0.3 A 94 ASP CB C 13 40.340 0.3 A 94 ASP N N 15 120.996 0.2 A 95 GLY H H 1 10.073 0.02 A 95 GLY HAy H 1 3.958 0.02 A 95 GLY HAx H 1 3.508 0.02 A 95 GLY C C 13 172.700 0.3 A 95 GLY CA C 13 46.300 0.3 A 95 GLY N N 15 112.499 0.2 A 96 LYS H H 1 7.694 0.02 A 96 LYS HA H 1 4.690 0.02 A 96 LYS HBy H 1 1.610 0.02 A 96 LYS HBx H 1 1.465 0.02 A 96 LYS HDy H 1 0.942 0.02 A 96 LYS HDx H 1 0.736 0.02 A 96 LYS HEx H 1 3.430 0.02 A 96 LYS HEy H 1 3.430 0.02 A 96 LYS HGx H 1 0.910 0.02 A 96 LYS HGy H 1 0.910 0.02 A 96 LYS C C 13 174.010 0.3 A 96 LYS CA C 13 54.100 0.3 A 96 LYS CB C 13 35.750 0.3 A 96 LYS CD C 13 29.100 0.3 A 96 LYS CE C 13 41.580 0.3 A 96 LYS CG C 13 23.030 0.3 A 96 LYS N N 15 116.366 0.2 A 97 ILE H H 1 8.461 0.02 A 97 ILE HA H 1 4.671 0.02 A 97 ILE HB H 1 1.857 0.02 A 97 ILE HD1% H 1 0.635 0.02 A 97 ILE HG1y H 1 1.440 0.02 A 97 ILE HG1x H 1 0.733 0.02 A 97 ILE HG2% H 1 1.116 0.02 A 97 ILE C C 13 176.400 0.3 A 97 ILE CA C 13 60.100 0.3 A 97 ILE CB C 13 40.100 0.3 A 97 ILE CD1 C 13 13.500 0.3 A 97 ILE CG1 C 13 27.200 0.3 A 97 ILE CG2 C 13 17.600 0.3 A 97 ILE N N 15 118.363 0.2 A 98 GLY H H 1 9.579 0.02 A 98 GLY HAy H 1 4.880 0.02 A 98 GLY HAx H 1 3.996 0.02 A 98 GLY C C 13 174.600 0.3 A 98 GLY CA C 13 44.400 0.3 A 98 GLY N N 15 115.847 0.2 A 99 VAL H H 1 8.143 0.02 A 99 VAL HA H 1 2.455 0.02 A 99 VAL HB H 1 1.254 0.02 A 99 VAL HGx% H 1 0.476 0.02 A 99 VAL HGy% H 1 0.673 0.02 A 99 VAL C C 13 177.200 0.3 A 99 VAL CA C 13 65.800 0.3 A 99 VAL CB C 13 30.980 0.3 A 99 VAL CGy C 13 22.259 0.3 A 99 VAL CGx C 13 19.700 0.3 A 99 VAL N N 15 120.169 0.2 A 100 GLU H H 1 8.298 0.02 A 100 GLU HA H 1 4.059 0.02 A 100 GLU HBx H 1 1.975 0.02 A 100 GLU HBy H 1 1.975 0.02 A 100 GLU HGx H 1 2.270 0.02 A 100 GLU HGy H 1 2.270 0.02 A 100 GLU C C 13 180.300 0.3 A 100 GLU CA C 13 59.700 0.3 A 100 GLU CB C 13 28.150 0.3 A 100 GLU CG C 13 36.600 0.3 A 100 GLU N N 15 121.589 0.2 A 101 GLU H H 1 7.996 0.02 A 101 GLU HA H 1 4.103 0.02 A 101 GLU HBx H 1 2.460 0.02 A 101 GLU HBy H 1 2.460 0.02 A 101 GLU HGy H 1 2.670 0.02 A 101 GLU HGx H 1 2.450 0.02 A 101 GLU C C 13 180.200 0.3 A 101 GLU CA C 13 59.050 0.3 A 101 GLU CB C 13 30.300 0.3 A 101 GLU CG C 13 37.850 0.3 A 101 GLU N N 15 121.301 0.2 A 102 PHE H H 1 8.945 0.02 A 102 PHE HA H 1 4.058 0.02 A 102 PHE HBx H 1 3.155 0.02 A 102 PHE HBy H 1 3.155 0.02 A 102 PHE HDx H 1 7.099 0.02 A 102 PHE HDy H 1 7.099 0.02 A 102 PHE HEx H 1 7.307 0.02 A 102 PHE HEy H 1 7.307 0.02 A 102 PHE C C 13 176.100 0.3 A 102 PHE CA C 13 62.130 0.3 A 102 PHE CB C 13 40.240 0.3 A 102 PHE N N 15 122.386 0.2 A 103 GLN H H 1 8.357 0.02 A 103 GLN HA H 1 3.652 0.02 A 103 GLN HBx H 1 2.090 0.02 A 103 GLN HBy H 1 2.230 0.02 A 103 GLN HE2x H 1 6.480 0.02 A 103 GLN HE2y H 1 7.521 0.02 A 103 GLN HGx H 1 2.260 0.02 A 103 GLN HGy H 1 2.380 0.02 A 103 GLN C C 13 178.100 0.3 A 103 GLN CA C 13 59.850 0.3 A 103 GLN CB C 13 28.450 0.3 A 103 GLN CG C 13 34.100 0.3 A 103 GLN N N 15 116.956 0.2 A 103 GLN NE2 N 15 112.300 0.2 A 104 SER H H 1 7.820 0.02 A 104 SER HA H 1 4.125 0.02 A 104 SER HBx H 1 3.910 0.02 A 104 SER HBy H 1 3.910 0.02 A 104 SER C C 13 176.100 0.3 A 104 SER CA C 13 61.550 0.3 A 104 SER CB C 13 62.860 0.3 A 104 SER N N 15 112.672 0.2 A 105 LEU H H 1 7.759 0.02 A 105 LEU HA H 1 4.159 0.02 A 105 LEU HBy H 1 1.750 0.02 A 105 LEU HBx H 1 1.670 0.02 A 105 LEU HDx% H 1 0.555 0.02 A 105 LEU HDy% H 1 0.560 0.02 A 105 LEU HG H 1 1.641 0.02 A 105 LEU C C 13 178.300 0.3 A 105 LEU CA C 13 57.200 0.3 A 105 LEU CB C 13 42.800 0.3 A 105 LEU CDx C 13 24.340 0.3 A 105 LEU CDy C 13 24.800 0.3 A 105 LEU CG C 13 26.300 0.3 A 105 LEU N N 15 122.074 0.2 A 106 VAL H H 1 7.506 0.02 A 106 VAL HA H 1 3.250 0.02 A 106 VAL HB H 1 1.619 0.02 A 106 VAL HGx% H 1 0.315 0.02 A 106 VAL HGy% H 1 -0.234 0.02 A 106 VAL C C 13 176.600 0.3 A 106 VAL CA C 13 64.700 0.3 A 106 VAL CB C 13 31.600 0.3 A 106 VAL CGy C 13 22.850 0.3 A 106 VAL CGx C 13 21.950 0.3 A 106 VAL N N 15 115.531 0.2 A 107 LYS H H 1 7.240 0.02 A 107 LYS HA H 1 4.290 0.02 A 107 LYS HBx H 1 1.740 0.02 A 107 LYS HBy H 1 1.950 0.02 A 107 LYS HDx H 1 1.670 0.02 A 107 LYS HDy H 1 1.670 0.02 A 107 LYS HEx H 1 2.960 0.02 A 107 LYS HEy H 1 2.960 0.02 A 107 LYS HGx H 1 1.440 0.02 A 107 LYS HGy H 1 1.485 0.02 A 107 LYS C C 13 175.500 0.3 A 107 LYS CA C 13 55.600 0.3 A 107 LYS CB C 13 32.300 0.3 A 107 LYS CD C 13 28.400 0.3 A 107 LYS CE C 13 42.100 0.3 A 107 LYS CG C 13 24.400 0.3 A 107 LYS N N 15 116.800 0.2 A 108 ALA H H 1 7.560 0.02 A 108 ALA HA H 1 4.054 0.02 A 108 ALA HB% H 1 1.480 0.02 A 108 ALA C C 13 183.100 0.3 A 108 ALA CA C 13 54.700 0.3 A 108 ALA CB C 13 19.700 0.3 A 108 ALA N N 15 129.800 0.2 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 106 VAL HGx% A 43 ILE HD1% 1.0 . 3.34 2 2 A 2 ILE HB A 49 ILE HD1% 1.0 . 2.92 3 3 A 49 ILE HB A 49 ILE HD1% 1.0 . 3.11 4 4 A 86 LEU HG A 97 ILE HD1% 1.0 . 3.78 5 5 A 49 ILE HG1y A 49 ILE HD1% 1.0 . 2.41 6 6 A 35 LEU HA A 43 ILE HD1% 1.0 . 5.50 7 7 A 103 GLN HA A 43 ILE HD1% 1.0 . 2.85 8 8 A 43 ILE HA A 43 ILE HD1% 1.0 . 4.98 9 9 A 49 ILE HD1% A 49 ILE HA 1.0 . 5.50 10 10 A 49 ILE HD1% A 49 ILE HA 1.0 . 5.50 11 11 A 38 LYS HBx A 43 ILE HD1% 1.0 . 5.50 12 12 A 38 LYS HBx A 43 ILE HD1% 1.0 . 5.50 13 13 A 97 ILE HD1% A 89 GLY HAx 1.0 . 5.50 14 14 A 97 ILE HD1% A 89 GLY HAy 1.0 . 4.16 15 15 A 43 ILE HD1% A 43 ILE H 1.0 . 3.93 16 16 A 43 ILE HD1% A 41 ASP H 1.0 . 4.89 17 17 A 43 ILE HD1% A 107 LYS H 1.0 . 4.61 18 18 A 97 ILE HD1% A 86 LEU H 1.0 . 4.76 19 19 A 97 ILE HD1% A 85 PHE HDy 1.0 . 5.22 20 20 A 97 ILE HD1% A 85 PHE HDy 1.0 . 5.39 21 21 A 43 ILE HD1% A 43 ILE HG2% 1.0 . 2.76 22 22 A 43 ILE HD1% A 43 ILE HG2% 1.0 . 3.01 23 23 A 2 ILE HB A 2 ILE HD1% 1.0 . 3.73 24 24 A 2 ILE HB A 2 ILE HD1% 1.0 . 4.07 25 25 A 2 ILE HD1% A 2 ILE HA 1.0 . 4.80 26 26 A 2 ILE HD1% A 2 ILE HA 1.0 . 4.55 27 27 A 58 ILE H A 58 ILE HD1% 1.0 . 5.50 28 28 A 58 ILE H A 58 ILE HD1% 1.0 . 5.50 29 29 A 58 ILE H A 58 ILE HD1% 1.0 . 5.50 30 30 A 58 ILE HD1% A 51 ASP H 1.0 . 4.72 31 31 A 58 ILE HD1% A 51 ASP H 1.0 . 5.37 32 32 A 58 ILE HD1% A 51 ASP H 1.0 . 5.26 33 33 A 58 ILE HD1% A 47 PHE HEy 1.0 . 4.24 34 34 A 58 ILE HD1% A 47 PHE HEy 1.0 . 4.73 35 35 A 58 ILE HD1% A 47 PHE HEy 1.0 . 4.77 36 36 A 58 ILE HD1% A 47 PHE HDy 1.0 . 4.05 37 37 A 58 ILE HD1% A 47 PHE HDy 1.0 . 4.36 38 38 A 58 ILE HD1% A 51 ASP HA 1.0 . 5.50 39 39 A 58 ILE HD1% A 51 ASP HA 1.0 . 5.50 40 40 A 58 ILE HD1% A 51 ASP HA 1.0 . 5.50 41 41 A 58 ILE HD1% A 58 ILE HB 1.0 . 4.12 42 42 A 58 ILE HD1% A 50 LEU HBy 1.0 . 2.76 43 43 A 58 ILE HD1% A 50 LEU HBy 1.0 . 2.96 44 44 A 58 ILE HD1% A 58 ILE HG2% 1.0 . 3.38 45 45 A 58 ILE HD1% A 58 ILE HG2% 1.0 . 3.76 46 46 A 58 ILE HD1% A 58 ILE HG2% 1.0 . 3.77 47 47 A 2 ILE HD1% A 6 LEU H 1.0 . 5.50 48 48 A 2 ILE HD1% A 6 LEU H 1.0 . 5.50 49 49 A 43 ILE HD1% A 42 GLN H 1.0 . 5.50 50 50 A 6 LEU HBx A 11 ILE HD1% 1.0 . 2.70 51 51 A 2 ILE HG1y A 11 ILE HD1% 1.0 . 4.22 52 52 A 11 ILE HG1x A 11 ILE HD1% 1.0 . 2.97 53 53 A 11 ILE HD1% A 11 ILE HA 1.0 . 4.97 54 54 A 11 ILE HD1% A 11 ILE HA 1.0 . 5.31 55 55 A 11 ILE HD1% A 11 ILE H 1.0 . 4.68 56 56 A 11 ILE HD1% A 12 GLU H 1.0 . 5.50 57 57 A 11 ILE HD1% A 12 GLU H 1.0 . 5.50 58 58 A 6 LEU H A 11 ILE HD1% 1.0 . 4.98 59 59 A 11 ILE HD1% A 70 PHE HDx 1.0 . 5.50 60 60 A 5 ILE H A 5 ILE HD1% 1.0 . 5.18 61 61 A 5 ILE H A 5 ILE HD1% 1.0 . 5.50 62 62 A 5 ILE H A 5 ILE HD1% 1.0 . 5.50 63 63 A 5 ILE HD1% A 42 GLN HBx 1.0 . 5.28 64 64 A 5 ILE HD1% A 42 GLN HBx 1.0 . 5.50 65 65 A 5 ILE HD1% A 45 LYS HBx 1.0 . 4.03 66 66 A 5 ILE HD1% A 45 LYS HBx 1.0 . 4.14 67 67 A 5 ILE HD1% A 45 LYS HBy 1.0 . 5.12 68 68 A 5 ILE HD1% A 5 ILE HB 1.0 . 4.09 69 69 A 49 ILE HG1y A 49 ILE HG2% 1.0 . 3.13 70 70 A 49 ILE HG1y A 49 ILE HG2% 1.0 . 3.47 71 71 A 97 ILE HG2% A 102 PHE HDx 1.0 . 3.67 72 72 A 47 PHE HEy A 97 ILE HG2% 1.0 . 4.34 73 73 A 47 PHE HDy A 97 ILE HG2% 1.0 . 5.50 74 74 A 47 PHE HDy A 97 ILE HG2% 1.0 . 5.50 75 75 A 97 ILE HG2% A 102 PHE HA 1.0 . 4.17 76 76 A 97 ILE HG2% A 102 PHE HA 1.0 . 4.76 77 77 A 97 ILE HG2% A 101 GLU HBx 1.0 . 3.89 78 78 A 97 ILE HG2% A 90 ASP HBy 1.0 . 5.50 79 79 A 97 ILE HG2% A 90 ASP HBy 1.0 . 5.50 80 80 A 58 ILE HB A 97 ILE HG2% 1.0 . 4.99 81 81 A 97 ILE HD1% A 97 ILE HG2% 1.0 . 2.92 82 82 A 4 ASP HBy A 5 ILE HG2% 1.0 . 5.50 83 83 A 5 ILE HA A 5 ILE HG2% 1.0 . 3.61 84 84 A 5 ILE HA A 5 ILE HG2% 1.0 . 4.17 85 85 A 5 ILE H A 5 ILE HG2% 1.0 . 5.01 86 86 A 5 ILE H A 5 ILE HG2% 1.0 . 5.40 87 87 A 22 ASP H A 21 ALA HB% 1.0 . 3.80 88 88 A 20 ALA HA A 21 ALA HB% 1.0 . 4.66 89 89 A 78 THR H A 80 ALA HB% 1.0 . 5.50 90 90 A 80 ALA HB% A 80 ALA H 1.0 . 3.79 91 91 A 80 ALA HB% A 80 ALA H 1.0 . 4.10 92 92 A 80 ALA HB% A 81 GLU H 1.0 . 3.00 93 93 A 86 LEU H A 87 ALA HB% 1.0 . 5.50 94 94 A 86 LEU H A 87 ALA HB% 1.0 . 5.50 95 95 A 80 ALA HB% A 84 ALA H 1.0 . 5.50 96 96 A 84 ALA H A 87 ALA HB% 1.0 . 5.50 97 97 A 88 ALA H A 87 ALA HB% 1.0 . 3.38 98 98 A 80 ALA HB% A 80 ALA HA 1.0 . 2.89 99 99 A 83 LYS HA A 87 ALA HB% 1.0 . 4.92 100 100 A 83 LYS HA A 87 ALA HB% 1.0 . 5.37 101 101 A 80 ALA HB% A 81 GLU HGy 1.0 . 4.08 102 102 A 83 LYS H A 84 ALA HB% 1.0 . 4.85 103 103 A 84 ALA HB% A 85 PHE HA 1.0 . 5.35 104 104 A 84 ALA HB% A 85 PHE HA 1.0 . 5.50 105 105 A 84 ALA HB% A 83 LYS HBy 1.0 . 4.22 106 106 A 58 ILE HG2% A 97 ILE HB 1.0 . 5.50 107 107 A 58 ILE HG2% A 97 ILE HB 1.0 . 5.50 108 108 A 58 ILE HG2% A 97 ILE HB 1.0 . 5.50 109 109 A 58 ILE HG2% A 63 LEU HBy 1.0 . 4.95 110 110 A 58 ILE HG2% A 63 LEU HBy 1.0 . 5.50 111 111 A 58 ILE HG2% A 63 LEU HDy% 1.0 . 5.50 112 112 A 58 ILE HG2% A 63 LEU HDy% 1.0 . 5.50 113 113 A 51 ASP HA A 58 ILE HG2% 1.0 . 5.50 114 114 A 51 ASP HA A 58 ILE HG2% 1.0 . 5.50 115 115 A 51 ASP HA A 58 ILE HG2% 1.0 . 5.50 116 116 A 58 ILE HG2% A 62 GLU HA 1.0 . 5.50 117 117 A 58 ILE HG2% A 62 GLU HA 1.0 . 5.50 118 118 A 58 ILE HG2% A 62 GLU HA 1.0 . 5.50 119 119 A 8 ALA HB% A 9 LYS H 1.0 . 5.50 120 120 A 8 ALA HB% A 9 LYS H 1.0 . 5.50 121 121 A 8 ALA HB% A 9 LYS H 1.0 . 5.50 122 122 A 8 ALA HB% A 7 SER HA 1.0 . 5.50 123 123 A 8 ALA HB% A 7 SER HA 1.0 . 5.50 124 124 A 8 ALA HB% A 7 SER HA 1.0 . 5.50 125 125 A 11 ILE HA A 14 ALA HB% 1.0 . 4.95 126 126 A 11 ILE HA A 14 ALA HB% 1.0 . 4.80 127 127 A 15 LEU HG A 14 ALA HB% 1.0 . 5.01 128 128 A 11 ILE HG2% A 15 LEU H 1.0 . 5.50 129 129 A 11 ILE HG2% A 15 LEU H 1.0 . 5.50 130 130 A 3 THR H A 2 ILE HG2% 1.0 . 2.40 131 131 A 4 ASP H A 2 ILE HG2% 1.0 . 5.50 132 132 A 11 ILE HG2% A 8 ALA HA 1.0 . 5.50 133 133 A 11 ILE HG2% A 8 ALA HA 1.0 . 5.50 134 134 A 11 ILE HA A 11 ILE HG2% 1.0 . 3.78 135 135 A 11 ILE HG2% A 11 ILE HB 1.0 . 2.86 136 136 A 3 THR HG2% A 2 ILE HG2% 1.0 . 3.79 137 137 A 49 ILE HD1% A 2 ILE HG2% 1.0 . 5.50 138 138 A 49 ILE HD1% A 2 ILE HG2% 1.0 . 5.50 139 139 A 43 ILE HG2% A 43 ILE HG1y 1.0 . 4.16 140 140 A 106 VAL HGx% A 43 ILE HG2% 1.0 . 5.50 141 141 A 43 ILE HG2% A 44 LYS HA 1.0 . 5.50 142 142 A 43 ILE HG2% A 44 LYS HA 1.0 . 5.50 143 143 A 103 GLN HA A 43 ILE HG2% 1.0 . 3.04 144 144 A 103 GLN HA A 43 ILE HG2% 1.0 . 3.35 145 145 A 43 ILE HG2% A 46 VAL HB 1.0 . 5.50 146 146 A 43 ILE HG2% A 46 VAL HB 1.0 . 5.50 147 147 A 43 ILE HG2% A 102 PHE HEy 1.0 . 5.50 148 148 A 43 ILE HG2% A 102 PHE HEy 1.0 . 5.50 149 149 A 43 ILE HG2% A 102 PHE HDy 1.0 . 3.58 150 150 A 43 ILE HG2% A 102 PHE HDy 1.0 . 3.89 151 151 A 43 ILE H A 43 ILE HG2% 1.0 . 5.50 152 152 A 43 ILE H A 43 ILE HG2% 1.0 . 5.50 153 153 A 43 ILE H A 43 ILE HG2% 1.0 . 5.50 154 154 A 43 ILE HG2% A 44 LYS H 1.0 . 5.04 155 155 A 43 ILE HG2% A 44 LYS H 1.0 . 5.13 156 156 A 23 SER HA A 20 ALA HB% 1.0 . 5.50 157 157 A 23 SER HA A 20 ALA HB% 1.0 . 5.50 158 158 A 20 ALA HB% A 23 SER HBx 1.0 . 4.36 159 159 A 20 ALA HB% A 23 SER HBx 1.0 . 4.42 160 160 A 18 CYS HA A 20 ALA HB% 1.0 . 5.50 161 161 A 18 CYS HA A 20 ALA HB% 1.0 . 5.50 162 162 A 85 PHE HDx A 88 ALA HB% 1.0 . 5.31 163 163 A 89 GLY HAy A 88 ALA HB% 1.0 . 5.24 164 164 A 107 LYS HA A 108 ALA HB% 1.0 . 5.50 165 165 A 99 VAL HGy% A 100 GLU H 1.0 . 3.45 166 166 A 99 VAL HGy% A 100 GLU H 1.0 . 3.57 167 167 A 99 VAL HGy% A 47 PHE HEx 1.0 . 5.50 168 168 A 99 VAL HGy% A 100 GLU HBx 1.0 . 4.77 169 169 A 76 VAL HGy% A 77 LEU H 1.0 . 4.96 170 170 A 76 VAL HGy% A 77 LEU H 1.0 . 5.50 171 171 A 76 VAL HGy% A 75 ARG HA 1.0 . 4.32 172 172 A 76 VAL HGy% A 64 GLN HGy 1.0 . 5.50 173 173 A 2 ILE HG1y A 46 VAL HGx% 1.0 . 4.18 174 174 A 49 ILE HD1% A 46 VAL HGx% 1.0 . 3.60 175 175 A 2 ILE HD1% A 46 VAL HGx% 1.0 . 3.99 176 176 A 2 ILE HD1% A 46 VAL HGx% 1.0 . 4.46 177 177 A 46 VAL HGx% A 46 VAL HA 1.0 . 3.55 178 178 A 46 VAL HGx% A 47 PHE HBy 1.0 . 5.50 179 179 A 46 VAL HGx% A 47 PHE H 1.0 . 5.50 180 180 A 46 VAL HGx% A 46 VAL H 1.0 . 5.20 181 181 A 46 VAL HGx% A 46 VAL H 1.0 . 5.50 182 182 A 46 VAL HGx% A 46 VAL H 1.0 . 5.50 183 183 A 11 ILE HA A 33 VAL HGx% 1.0 . 5.50 184 184 A 11 ILE HA A 33 VAL HGx% 1.0 . 5.50 185 185 A 33 VAL HGx% A 35 LEU HBx 1.0 . 4.13 186 186 A 33 VAL HGx% A 35 LEU HBx 1.0 . 4.54 187 187 A 33 VAL HGx% A 33 VAL HB 1.0 . 2.40 188 188 A 77 LEU H A 76 VAL HGx% 1.0 . 5.07 189 189 A 76 VAL H A 76 VAL HGx% 1.0 . 4.94 190 190 A 76 VAL H A 76 VAL HGx% 1.0 . 5.21 191 191 A 76 VAL HGx% A 65 LEU HA 1.0 . 4.70 192 192 A 76 VAL HGx% A 68 LYS HEy 1.0 . 5.50 193 193 A 76 VAL HGx% A 68 LYS HEy 1.0 . 5.50 194 194 A 76 VAL HGx% A 68 LYS HEx 1.0 . 5.50 195 195 A 76 VAL HGx% A 68 LYS HEx 1.0 . 5.50 196 196 A 76 VAL HGx% A 64 GLN HGx 1.0 . 4.05 197 197 A 64 GLN HGy A 76 VAL HGx% 1.0 . 5.50 198 198 A 64 GLN HGy A 76 VAL HGx% 1.0 . 5.50 199 199 A 76 VAL HGx% A 65 LEU HG 1.0 . 5.42 200 200 A 76 VAL HGx% A 65 LEU HG 1.0 . 5.50 201 201 A 76 VAL HGx% A 68 LYS HGy 1.0 . 4.55 202 202 A 76 VAL HGx% A 68 LYS HGx 1.0 . 4.90 203 203 A 78 THR H A 78 THR HG2% 1.0 . 4.22 204 204 A 78 THR H A 78 THR HG2% 1.0 . 4.58 205 205 A 39 THR H A 39 THR HG2% 1.0 . 3.32 206 206 A 41 ASP H A 39 THR HG2% 1.0 . 5.50 207 207 A 41 ASP H A 39 THR HG2% 1.0 . 5.50 208 208 A 67 LEU H A 74 ALA HB% 1.0 . 5.50 209 209 A 67 LEU H A 74 ALA HB% 1.0 . 5.50 210 210 A 72 SER H A 74 ALA HB% 1.0 . 5.50 211 211 A 75 ARG H A 74 ALA HB% 1.0 . 3.82 212 212 A 81 GLU H A 78 THR HG2% 1.0 . 4.08 213 213 A 76 VAL H A 74 ALA HB% 1.0 . 5.50 214 214 A 68 LYS HA A 74 ALA HB% 1.0 . 5.19 215 215 A 81 GLU HGy A 78 THR HG2% 1.0 . 4.60 216 216 A 81 GLU HGy A 78 THR HG2% 1.0 . 5.04 217 217 A 39 THR HG2% A 42 GLN HGx 1.0 . 5.50 218 218 A 38 LYS HBx A 39 THR HG2% 1.0 . 5.04 219 219 A 39 THR HG2% A 40 PRO HGx 1.0 . 5.47 220 220 A 67 LEU HDy% A 74 ALA HB% 1.0 . 5.03 221 221 A 67 LEU HDy% A 74 ALA HB% 1.0 . 5.50 222 222 A 8 ALA HA A 3 THR HG2% 1.0 . 5.22 223 223 A 8 ALA HA A 3 THR HG2% 1.0 . 5.47 224 224 A 2 ILE HA A 3 THR HG2% 1.0 . 5.50 225 225 A 91 THR HG2% A 101 GLU HBy 1.0 . 5.23 226 226 A 91 THR HG2% A 101 GLU HBy 1.0 . 5.50 227 227 A 3 THR HG2% A 2 ILE HG2% 1.0 . 3.00 228 228 A 6 LEU HDy% A 6 LEU HDx% 1.0 . 3.52 229 229 A 6 LEU HDy% A 6 LEU HDx% 1.0 . 3.80 230 230 A 6 LEU HDy% A 6 LEU HDx% 1.0 . 4.05 231 231 A 35 LEU HA A 6 LEU HDx% 1.0 . 5.00 232 232 A 35 LEU HA A 6 LEU HDx% 1.0 . 5.50 233 233 A 6 LEU HDx% A 7 SER H 1.0 . 5.50 234 234 A 6 LEU HDx% A 7 SER H 1.0 . 5.50 235 235 A 99 VAL H A 99 VAL HGx% 1.0 . 4.91 236 236 A 99 VAL H A 99 VAL HGx% 1.0 . 5.29 237 237 A 47 PHE HEx A 99 VAL HGx% 1.0 . 5.50 238 238 A 47 PHE HDx A 99 VAL HGx% 1.0 . 3.33 239 239 A 47 PHE HDx A 99 VAL HGx% 1.0 . 3.47 240 240 A 44 LYS HA A 99 VAL HGx% 1.0 . 3.01 241 241 A 47 PHE HBy A 99 VAL HGx% 1.0 . 4.25 242 242 A 47 PHE HBy A 99 VAL HGx% 1.0 . 4.66 243 243 A 102 PHE HBy A 99 VAL HGx% 1.0 . 5.50 244 244 A 103 GLN HGx A 99 VAL HGx% 1.0 . 5.50 245 245 A 44 LYS HBx A 99 VAL HGx% 1.0 . 4.58 246 246 A 44 LYS HBx A 99 VAL HGx% 1.0 . 5.10 247 247 A 99 VAL HGx% A 44 LYS HGy 1.0 . 5.50 248 248 A 99 VAL HGy% A 99 VAL HGx% 1.0 . 2.88 249 249 A 65 LEU H A 77 LEU HDy% 1.0 . 5.50 250 250 A 66 PHE HDy A 77 LEU HDy% 1.0 . 5.50 251 251 A 66 PHE HDy A 77 LEU HDy% 1.0 . 5.50 252 252 A 106 VAL HGx% A 107 LYS HA 1.0 . 4.91 253 253 A 77 LEU HDy% A 81 GLU HBy 1.0 . 5.50 254 254 A 77 LEU HDy% A 81 GLU HBy 1.0 . 5.37 255 255 A 106 VAL HGx% A 38 LYS HBy 1.0 . 5.27 256 256 A 106 VAL HGx% A 35 LEU HDy% 1.0 . 4.80 257 257 A 77 LEU HDy% A 81 GLU HBx 1.0 . 5.50 258 258 A 77 LEU HDy% A 67 LEU HG 1.0 . 4.23 259 259 A 77 LEU HDy% A 67 LEU HG 1.0 . 4.84 260 260 A 63 LEU HG A 82 THR HG2% 1.0 . 3.26 261 261 A 82 THR HG2% A 63 LEU HA 1.0 . 5.50 262 262 A 82 THR HG2% A 63 LEU HA 1.0 . 5.50 263 263 A 82 THR HG2% A 82 THR HA 1.0 . 3.63 264 264 A 82 THR HG2% A 64 GLN HBy 1.0 . 3.80 265 265 A 82 THR HG2% A 60 GLU HGx 1.0 . 4.03 266 266 A 82 THR HG2% A 64 GLN H 1.0 . 4.35 267 267 A 82 THR HG2% A 64 GLN H 1.0 . 4.50 268 268 A 64 GLN H A 65 LEU HDy% 1.0 . 5.50 269 269 A 65 LEU HDy% A 66 PHE H 1.0 . 5.50 270 270 A 65 LEU HDy% A 68 LYS H 1.0 . 5.50 271 271 A 65 LEU H A 65 LEU HDy% 1.0 . 5.50 272 272 A 65 LEU H A 65 LEU HDy% 1.0 . 5.50 273 273 A 65 LEU HDy% A 76 VAL HA 1.0 . 5.50 274 274 A 65 LEU HDy% A 68 LYS HEy 1.0 . 5.42 275 275 A 64 GLN HGy A 65 LEU HDy% 1.0 . 5.20 276 276 A 65 LEU HDy% A 65 LEU HBy 1.0 . 4.16 277 277 A 68 LYS H A 67 LEU HDy% 1.0 . 5.50 278 278 A 68 LYS H A 67 LEU HDy% 1.0 . 5.50 279 279 A 67 LEU HDy% A 67 LEU HA 1.0 . 3.75 280 280 A 67 LEU HDy% A 67 LEU HA 1.0 . 4.02 281 281 A 67 LEU HDy% A 66 PHE HBy 1.0 . 5.50 282 282 A 67 LEU HDy% A 67 LEU HDx% 1.0 . 3.53 283 283 A 57 PHE HBy A 96 LYS HGx 1.0 . 5.50 284 284 A 57 PHE HBy A 96 LYS HGy 1.0 . 5.50 285 285 A 60 GLU HBx A 86 LEU HDy% 1.0 . 4.34 286 286 A 60 GLU HGx A 86 LEU HDy% 1.0 . 4.88 287 287 A 86 LEU HA A 86 LEU HDy% 1.0 . 4.39 288 288 A 86 LEU HA A 86 LEU HDy% 1.0 . 4.70 289 289 A 86 LEU HDy% A 60 GLU HA 1.0 . 5.47 290 290 A 86 LEU HDy% A 90 ASP HBx 1.0 . 4.63 291 291 A 90 ASP HBy A 86 LEU HDy% 1.0 . 4.20 292 292 A 86 LEU H A 86 LEU HDy% 1.0 . 4.89 293 293 A 86 LEU HDy% A 95 GLY H 1.0 . 5.50 294 294 A 86 LEU HDy% A 95 GLY H 1.0 . 5.50 295 295 A 67 LEU H A 67 LEU HDy% 1.0 . 5.14 296 296 A 67 LEU H A 67 LEU HDy% 1.0 . 5.50 297 297 A 66 PHE HDx A 50 LEU HDy% 1.0 . 5.50 298 298 A 66 PHE HDx A 50 LEU HDy% 1.0 . 5.50 299 299 A 66 PHE HEx A 50 LEU HDy% 1.0 . 5.50 300 300 A 47 PHE HDy A 50 LEU HDy% 1.0 . 5.50 301 301 A 47 PHE HDy A 50 LEU HDy% 1.0 . 5.50 302 302 A 50 LEU HDy% A 69 ASN HA 1.0 . 5.50 303 303 A 50 LEU HDy% A 69 ASN HA 1.0 . 5.50 304 304 A 50 LEU HDy% A 66 PHE HA 1.0 . 5.50 305 305 A 50 LEU HDy% A 50 LEU HBx 1.0 . 3.71 306 306 A 46 VAL HA A 46 VAL HGy% 1.0 . 3.42 307 307 A 46 VAL HA A 46 VAL HGy% 1.0 . 3.85 308 308 A 47 PHE H A 46 VAL HGy% 1.0 . 4.47 309 309 A 45 LYS HA A 46 VAL HGy% 1.0 . 5.38 310 310 A 2 ILE HA A 46 VAL HGy% 1.0 . 5.48 311 311 A 45 LYS HBx A 46 VAL HGy% 1.0 . 5.00 312 312 A 45 LYS HBx A 46 VAL HGy% 1.0 . 5.22 313 313 A 5 ILE HB A 46 VAL HGy% 1.0 . 4.93 314 314 A 2 ILE HG1y A 46 VAL HGy% 1.0 . 5.22 315 315 A 2 ILE HG1y A 46 VAL HGy% 1.0 . 5.40 316 316 A 2 ILE HD1% A 46 VAL HGy% 1.0 . 4.77 317 317 A 102 PHE HEy A 46 VAL HGy% 1.0 . 5.50 318 318 A 102 PHE HEy A 46 VAL HGy% 1.0 . 5.50 319 319 A 85 PHE HDy A 63 LEU HDy% 1.0 . 4.50 320 320 A 85 PHE HDy A 63 LEU HDy% 1.0 . 4.92 321 321 A 63 LEU HDy% A 85 PHE HEy 1.0 . 5.50 322 322 A 63 LEU HDy% A 85 PHE HEy 1.0 . 5.50 323 323 A 63 LEU HA A 63 LEU HDy% 1.0 . 4.78 324 324 A 63 LEU HA A 63 LEU HDy% 1.0 . 4.97 325 325 A 63 LEU HDy% A 86 LEU HBx 1.0 . 5.39 326 326 A 63 LEU HDy% A 86 LEU HBx 1.0 . 5.50 327 327 A 63 LEU HDy% A 63 LEU HBx 1.0 . 2.89 328 328 A 82 THR HG2% A 63 LEU HDy% 1.0 . 4.66 329 329 A 6 LEU HDy% A 33 VAL HGy% 1.0 . 4.16 330 330 A 11 ILE HG1y A 33 VAL HGy% 1.0 . 3.75 331 331 A 35 LEU HA A 33 VAL HGy% 1.0 . 5.50 332 332 A 35 LEU H A 33 VAL HGy% 1.0 . 4.25 333 333 A 10 ASP H A 33 VAL HGy% 1.0 . 4.77 334 334 A 33 VAL H A 33 VAL HGy% 1.0 . 5.25 335 335 A 33 VAL H A 33 VAL HGy% 1.0 . 5.50 336 336 A 33 VAL H A 33 VAL HGy% 1.0 . 5.50 337 337 A 85 PHE HDy A 63 LEU HDx% 1.0 . 4.53 338 338 A 85 PHE HDy A 63 LEU HDx% 1.0 . 5.06 339 339 A 85 PHE HEy A 63 LEU HDx% 1.0 . 4.71 340 340 A 85 PHE HBy A 63 LEU HDx% 1.0 . 5.50 341 341 A 85 PHE HBy A 63 LEU HDx% 1.0 . 5.50 342 342 A 86 LEU HBx A 63 LEU HDx% 1.0 . 5.50 343 343 A 97 ILE HG2% A 63 LEU HDx% 1.0 . 5.50 344 344 A 97 ILE HD1% A 63 LEU HDx% 1.0 . 3.20 345 345 A 67 LEU HA A 15 LEU HDy% 1.0 . 4.94 346 346 A 67 LEU HA A 15 LEU HDy% 1.0 . 5.50 347 347 A 15 LEU HDy% A 70 PHE HBy 1.0 . 3.85 348 348 A 70 PHE HDx A 15 LEU HDy% 1.0 . 4.81 349 349 A 15 LEU HDy% A 70 PHE HDy 1.0 . 5.50 350 350 A 15 LEU H A 15 LEU HDy% 1.0 . 5.50 351 351 A 15 LEU H A 15 LEU HDy% 1.0 . 5.50 352 352 A 89 GLY H A 105 LEU HDx% 1.0 . 3.73 353 353 A 89 GLY H A 105 LEU HDx% 1.0 . 4.06 354 354 A 89 GLY HAx A 105 LEU HDx% 1.0 . 3.14 355 355 A 89 GLY HAy A 105 LEU HDx% 1.0 . 3.75 356 356 A 89 GLY HAy A 105 LEU HDx% 1.0 . 3.86 357 357 A 108 ALA HB% A 105 LEU HDy% 1.0 . 5.50 358 358 A 108 ALA HB% A 105 LEU HDy% 1.0 . 5.50 359 359 A 88 ALA HB% A 105 LEU HDx% 1.0 . 3.62 360 360 A 43 ILE HD1% A 107 LYS HGy 1.0 . 5.50 361 361 A 43 ILE HD1% A 107 LYS HGx 1.0 . 5.50 362 362 A 9 LYS HA A 9 LYS HGy 1.0 . 3.80 363 363 A 9 LYS H A 9 LYS HGy 1.0 . 5.50 364 364 A 9 LYS H A 9 LYS HGx 1.0 . 5.50 365 365 A 27 LYS H A 27 LYS HGy 1.0 . 4.55 366 366 A 35 LEU H A 35 LEU HDy% 1.0 . 5.50 367 367 A 35 LEU H A 35 LEU HDy% 1.0 . 5.50 368 368 A 102 PHE HEy A 35 LEU HDy% 1.0 . 4.65 369 369 A 102 PHE HEy A 35 LEU HDy% 1.0 . 4.83 370 370 A 102 PHE HDy A 35 LEU HDy% 1.0 . 5.50 371 371 A 102 PHE HDy A 35 LEU HDy% 1.0 . 5.50 372 372 A 26 TYR HEy A 27 LYS HGy 1.0 . 4.55 373 373 A 26 TYR HDy A 27 LYS HGy 1.0 . 4.93 374 374 A 35 LEU HA A 35 LEU HDy% 1.0 . 4.04 375 375 A 35 LEU HA A 35 LEU HDy% 1.0 . 4.37 376 376 A 46 VAL HB A 35 LEU HDy% 1.0 . 4.95 377 377 A 38 LYS HBx A 35 LEU HDy% 1.0 . 5.50 378 378 A 38 LYS HBx A 35 LEU HDy% 1.0 . 5.50 379 379 A 26 TYR HEy A 27 LYS HGx 1.0 . 4.55 380 380 A 26 TYR HDy A 27 LYS HGx 1.0 . 4.93 381 381 A 27 LYS H A 27 LYS HGx 1.0 . 4.55 382 382 A 65 LEU H A 65 LEU HDx% 1.0 . 5.16 383 383 A 65 LEU H A 65 LEU HDx% 1.0 . 5.38 384 384 A 77 LEU HDy% A 67 LEU HDx% 1.0 . 4.04 385 385 A 67 LEU HA A 67 LEU HDx% 1.0 . 5.45 386 386 A 67 LEU HA A 67 LEU HDx% 1.0 . 5.50 387 387 A 67 LEU HA A 67 LEU HDx% 1.0 . 5.50 388 388 A 78 THR H A 77 LEU HDx% 1.0 . 4.60 389 389 A 65 LEU H A 77 LEU HDx% 1.0 . 4.61 390 390 A 66 PHE HA A 77 LEU HDx% 1.0 . 5.50 391 391 A 66 PHE HA A 77 LEU HDx% 1.0 . 5.50 392 392 A 77 LEU HDx% A 77 LEU HBy 1.0 . 4.09 393 393 A 77 LEU HDx% A 77 LEU HBx 1.0 . 3.57 394 394 A 82 THR HG2% A 77 LEU HDx% 1.0 . 4.35 395 395 A 82 THR HG2% A 77 LEU HDx% 1.0 . 4.22 396 396 A 67 LEU HDx% A 77 LEU HDx% 1.0 . 5.50 397 397 A 67 LEU HDx% A 77 LEU HDx% 1.0 . 5.50 398 398 A 82 THR HG2% A 86 LEU HDx% 1.0 . 4.64 399 399 A 82 THR HG2% A 86 LEU HDx% 1.0 . 4.93 400 400 A 86 LEU HDx% A 63 LEU HDx% 1.0 . 5.50 401 401 A 86 LEU HDx% A 63 LEU HDx% 1.0 . 5.36 402 402 A 63 LEU HDy% A 86 LEU HDx% 1.0 . 5.50 403 403 A 63 LEU HDy% A 86 LEU HDx% 1.0 . 5.50 404 404 A 86 LEU HA A 86 LEU HDx% 1.0 . 4.67 405 405 A 86 LEU HA A 86 LEU HDx% 1.0 . 5.09 406 406 A 90 ASP HBy A 86 LEU HDx% 1.0 . 5.50 407 407 A 90 ASP HBy A 86 LEU HDx% 1.0 . 5.50 408 408 A 60 GLU HBx A 86 LEU HDx% 1.0 . 5.49 409 409 A 63 LEU HG A 63 LEU H 1.0 . 4.80 410 410 A 45 LYS H A 45 LYS HGx 1.0 . 3.96 411 411 A 63 LEU HG A 60 GLU HA 1.0 . 4.66 412 412 A 58 ILE HG2% A 63 LEU HG 1.0 . 4.50 413 413 A 105 LEU HA A 105 LEU HG 1.0 . 3.68 414 414 A 105 LEU HG A 106 VAL H 1.0 . 4.72 415 415 A 45 LYS H A 45 LYS HGy 1.0 . 3.96 416 416 A 68 LYS HGy A 65 LEU HBy 1.0 . 3.18 417 417 A 68 LYS HGy A 65 LEU HDx% 1.0 . 4.44 418 418 A 99 VAL HGx% A 44 LYS HGx 1.0 . 5.50 419 419 A 58 ILE HG2% A 58 ILE HG1y 1.0 . 4.25 420 420 A 58 ILE HG2% A 58 ILE HG1y 1.0 . 4.18 421 421 A 58 ILE H A 58 ILE HG1y 1.0 . 4.30 422 422 A 102 PHE HEy A 35 LEU HDx% 1.0 . 3.90 423 423 A 35 LEU HA A 35 LEU HDx% 1.0 . 5.47 424 424 A 35 LEU HA A 35 LEU HDx% 1.0 . 5.50 425 425 A 35 LEU HA A 35 LEU HDx% 1.0 . 5.50 426 426 A 43 ILE HA A 35 LEU HDx% 1.0 . 5.50 427 427 A 43 ILE HA A 35 LEU HDx% 1.0 . 5.50 428 428 A 43 ILE HA A 35 LEU HDx% 1.0 . 5.50 429 429 A 46 VAL HB A 35 LEU HDx% 1.0 . 5.34 430 430 A 46 VAL HB A 35 LEU HDx% 1.0 . 5.50 431 431 A 46 VAL HB A 35 LEU HDx% 1.0 . 5.50 432 432 A 35 LEU HBx A 35 LEU HDx% 1.0 . 4.21 433 433 A 2 ILE HG1y A 6 LEU HDy% 1.0 . 3.94 434 434 A 2 ILE HG1y A 6 LEU HDy% 1.0 . 4.41 435 435 A 6 LEU HDy% A 33 VAL HGy% 1.0 . 3.66 436 436 A 35 LEU HA A 6 LEU HDy% 1.0 . 5.50 437 437 A 35 LEU HA A 6 LEU HDy% 1.0 . 5.50 438 438 A 6 LEU H A 6 LEU HDy% 1.0 . 5.50 439 439 A 6 LEU H A 6 LEU HDy% 1.0 . 5.50 440 440 A 6 LEU H A 6 LEU HDy% 1.0 . 5.50 441 441 A 47 PHE HEy A 58 ILE HG1x 1.0 . 5.50 442 442 A 66 PHE HDx A 50 LEU HG 1.0 . 5.50 443 443 A 62 GLU HA A 65 LEU HG 1.0 . 3.00 444 444 A 65 LEU HG A 64 GLN HBx 1.0 . 5.26 445 445 A 65 LEU HG A 64 GLN HBy 1.0 . 5.50 446 446 A 50 LEU HA A 50 LEU HDx% 1.0 . 5.33 447 447 A 50 LEU HA A 50 LEU HDx% 1.0 . 5.50 448 448 A 50 LEU HA A 50 LEU HDx% 1.0 . 5.50 449 449 A 50 LEU HDx% A 50 LEU H 1.0 . 5.47 450 450 A 50 LEU HDx% A 50 LEU H 1.0 . 5.50 451 451 A 50 LEU HDx% A 50 LEU H 1.0 . 5.50 452 452 A 66 PHE HDx A 50 LEU HDx% 1.0 . 4.68 453 453 A 66 PHE HDx A 50 LEU HDx% 1.0 . 5.39 454 454 A 66 PHE HDx A 50 LEU HDx% 1.0 . 5.35 455 455 A 47 PHE HDy A 50 LEU HDx% 1.0 . 5.45 456 456 A 47 PHE HDy A 50 LEU HDx% 1.0 . 5.50 457 457 A 86 LEU HG A 86 LEU H 1.0 . 4.63 458 458 A 86 LEU HG A 87 ALA H 1.0 . 4.75 459 459 A 66 PHE HDy A 67 LEU HG 1.0 . 3.86 460 460 A 86 LEU HG A 63 LEU HDx% 1.0 . 4.03 461 461 A 6 LEU H A 6 LEU HG 1.0 . 4.64 462 462 A 38 LYS HBx A 38 LYS HDx 1.0 . 3.96 463 463 A 38 LYS HBx A 38 LYS HDy 1.0 . 3.96 464 464 A 97 ILE H A 97 ILE HG1x 1.0 . 3.95 465 465 A 97 ILE HG2% A 97 ILE HG1x 1.0 . 4.07 466 466 A 97 ILE HD1% A 97 ILE HG1y 1.0 . 2.76 467 467 A 97 ILE HD1% A 97 ILE HG1y 1.0 . 2.94 468 468 A 89 GLY HAy A 97 ILE HG1y 1.0 . 5.36 469 469 A 97 ILE H A 97 ILE HG1y 1.0 . 4.29 470 470 A 15 LEU HG A 15 LEU HA 1.0 . 4.17 471 471 A 15 LEU HG A 12 GLU HA 1.0 . 4.22 472 472 A 70 PHE HBy A 15 LEU HDx% 1.0 . 4.55 473 473 A 70 PHE HBx A 15 LEU HDx% 1.0 . 4.70 474 474 A 15 LEU HBy A 15 LEU HDx% 1.0 . 2.55 475 475 A 15 LEU HA A 15 LEU HDx% 1.0 . 5.36 476 476 A 15 LEU HA A 15 LEU HDx% 1.0 . 5.50 477 477 A 15 LEU HA A 15 LEU HDx% 1.0 . 5.50 478 478 A 12 GLU HA A 15 LEU HDx% 1.0 . 4.32 479 479 A 12 GLU HA A 15 LEU HDx% 1.0 . 4.68 480 480 A 15 LEU H A 15 LEU HDx% 1.0 . 4.78 481 481 A 15 LEU H A 15 LEU HDx% 1.0 . 5.10 482 482 A 18 CYS H A 18 CYS HBy 1.0 . 4.08 483 483 A 5 ILE HA A 5 ILE HG1x 1.0 . 3.86 484 484 A 64 GLN HBy A 64 GLN H 1.0 . 2.89 485 485 A 65 LEU H A 64 GLN HBx 1.0 . 4.83 486 486 A 64 GLN HBx A 64 GLN HA 1.0 . 2.40 487 487 A 64 GLN HGy A 64 GLN HBy 1.0 . 2.66 488 488 A 82 THR HG2% A 64 GLN HBy 1.0 . 4.03 489 489 A 5 ILE HA A 5 ILE HG1y 1.0 . 3.86 490 490 A 100 GLU H A 100 GLU HBx 1.0 . 2.92 491 491 A 99 VAL HGy% A 100 GLU HBx 1.0 . 4.98 492 492 A 103 GLN HBx A 104 SER H 1.0 . 4.65 493 493 A 43 ILE HG2% A 103 GLN HBx 1.0 . 4.76 494 494 A 43 ILE HG2% A 103 GLN HBx 1.0 . 5.22 495 495 A 43 ILE HG2% A 103 GLN HBx 1.0 . 5.46 496 496 A 43 ILE HD1% A 103 GLN HBx 1.0 . 4.71 497 497 A 43 ILE HD1% A 103 GLN HBx 1.0 . 4.92 498 498 A 43 ILE HG2% A 103 GLN HBy 1.0 . 4.71 499 499 A 43 ILE HG2% A 103 GLN HBy 1.0 . 4.88 500 500 A 86 LEU HG A 60 GLU HBx 1.0 . 5.15 501 501 A 53 ASP H A 52 GLN HBy 1.0 . 4.09 502 502 A 49 ILE H A 49 ILE HG1x 1.0 . 3.22 503 503 A 49 ILE HA A 49 ILE HG1x 1.0 . 3.27 504 504 A 83 LYS H A 83 LYS HDx 1.0 . 5.50 505 505 A 83 LYS H A 83 LYS HDy 1.0 . 5.50 506 506 A 9 LYS H A 9 LYS HDx 1.0 . 5.50 507 507 A 9 LYS H A 9 LYS HDy 1.0 . 5.50 508 508 A 49 ILE HD1% A 49 ILE HG1x 1.0 . 2.89 509 509 A 83 LYS HBx A 83 LYS HDx 1.0 . 2.91 510 510 A 83 LYS HBy A 83 LYS HDx 1.0 . 4.13 511 511 A 83 LYS HBy A 83 LYS HDy 1.0 . 4.13 512 512 A 49 ILE HG1y A 49 ILE HA 1.0 . 3.39 513 513 A 49 ILE HG1y A 50 LEU HDy% 1.0 . 5.50 514 514 A 60 GLU HBy A 61 GLU H 1.0 . 3.31 515 515 A 57 PHE HBx A 96 LYS HDx 1.0 . 3.82 516 516 A 15 LEU HBy A 12 GLU HBx 1.0 . 5.50 517 517 A 15 LEU HBy A 12 GLU HBy 1.0 . 5.50 518 518 A 60 GLU HBx A 60 GLU H 1.0 . 2.52 519 519 A 82 THR HG2% A 60 GLU HBx 1.0 . 5.50 520 520 A 82 THR HG2% A 60 GLU HBx 1.0 . 5.50 521 521 A 42 GLN HBx A 46 VAL HGy% 1.0 . 4.48 522 522 A 42 GLN HBx A 5 ILE HG2% 1.0 . 3.96 523 523 A 43 ILE H A 42 GLN HBx 1.0 . 4.20 524 524 A 42 GLN H A 42 GLN HBx 1.0 . 3.80 525 525 A 43 ILE H A 42 GLN HBy 1.0 . 3.18 526 526 A 35 LEU HA A 42 GLN HBy 1.0 . 5.50 527 527 A 38 LYS HBx A 42 GLN HBy 1.0 . 4.17 528 528 A 46 VAL HGy% A 42 GLN HBy 1.0 . 5.50 529 529 A 46 VAL HGy% A 42 GLN HBy 1.0 . 5.50 530 530 A 5 ILE HG2% A 42 GLN HBy 1.0 . 4.45 531 531 A 5 ILE HG2% A 42 GLN HBy 1.0 . 4.63 532 532 A 6 LEU HBx A 2 ILE HG1x 1.0 . 4.60 533 533 A 2 ILE HG2% A 2 ILE HG1x 1.0 . 3.90 534 534 A 46 VAL HGx% A 2 ILE HG1x 1.0 . 4.15 535 535 A 49 ILE HD1% A 2 ILE HG1x 1.0 . 5.33 536 536 A 49 ILE HD1% A 2 ILE HG1x 1.0 . 5.42 537 537 A 2 ILE HA A 2 ILE HG1x 1.0 . 4.19 538 538 A 2 ILE HA A 2 ILE HG1y 1.0 . 3.95 539 539 A 6 LEU HBx A 2 ILE HG1y 1.0 . 4.40 540 540 A 2 ILE HG1y A 3 THR HG2% 1.0 . 5.21 541 541 A 2 ILE HG1y A 2 ILE HG2% 1.0 . 3.71 542 542 A 49 ILE HD1% A 2 ILE HG1y 1.0 . 5.39 543 543 A 49 ILE HD1% A 2 ILE HG1y 1.0 . 5.49 544 544 A 58 ILE HG2% A 62 GLU HBx 1.0 . 4.11 545 545 A 58 ILE HG2% A 62 GLU HBx 1.0 . 4.08 546 546 A 82 THR HG2% A 60 GLU HBy 1.0 . 5.46 547 547 A 38 LYS HBx A 43 ILE HG1y 1.0 . 3.97 548 548 A 43 ILE HG1y A 38 LYS HBy 1.0 . 3.78 549 549 A 43 ILE HG1y A 35 LEU HDy% 1.0 . 4.00 550 550 A 43 ILE HG1y A 35 LEU HDy% 1.0 . 4.06 551 551 A 11 ILE HG1y A 33 VAL HGy% 1.0 . 3.06 552 552 A 106 VAL HGx% A 43 ILE HG1y 1.0 . 4.59 553 553 A 106 VAL HGx% A 43 ILE HG1y 1.0 . 4.97 554 554 A 43 ILE HA A 43 ILE HG1y 1.0 . 3.68 555 555 A 11 ILE HG1x A 10 ASP H 1.0 . 3.87 556 556 A 11 ILE HG1x A 11 ILE HA 1.0 . 2.85 557 557 A 38 LYS HBx A 43 ILE HG1x 1.0 . 4.20 558 558 A 11 ILE HG1x A 33 VAL HGy% 1.0 . 3.36 559 559 A 58 ILE HG2% A 62 GLU HBy 1.0 . 3.88 560 560 A 58 ILE HG2% A 62 GLU HBy 1.0 . 4.14 561 561 A 76 VAL H A 75 ARG HBy 1.0 . 3.93 562 562 A 76 VAL H A 75 ARG HBx 1.0 . 3.93 563 563 A 75 ARG HBy A 75 ARG HDy 1.0 . 3.84 564 564 A 75 ARG HBy A 75 ARG HDx 1.0 . 3.84 565 565 A 46 VAL HB A 46 VAL HGy% 1.0 . 2.77 566 566 A 46 VAL HB A 46 VAL HGy% 1.0 . 2.99 567 567 A 49 ILE HD1% A 46 VAL HB 1.0 . 5.32 568 568 A 43 ILE HA A 46 VAL HB 1.0 . 3.49 569 569 A 46 VAL HB A 47 PHE HBx 1.0 . 5.06 570 570 A 46 VAL HB A 102 PHE HEy 1.0 . 3.92 571 571 A 46 VAL HB A 47 PHE H 1.0 . 3.53 572 572 A 99 VAL H A 99 VAL HB 1.0 . 3.92 573 573 A 47 PHE HEx A 99 VAL HB 1.0 . 4.81 574 574 A 47 PHE HDx A 99 VAL HB 1.0 . 4.58 575 575 A 43 ILE HG2% A 106 VAL HB 1.0 . 4.17 576 576 A 43 ILE HG2% A 106 VAL HB 1.0 . 4.61 577 577 A 43 ILE HD1% A 106 VAL HB 1.0 . 4.42 578 578 A 103 GLN HA A 106 VAL HB 1.0 . 3.67 579 579 A 107 LYS H A 106 VAL HB 1.0 . 3.90 580 580 A 43 ILE HD1% A 40 PRO HBy 1.0 . 4.93 581 581 A 33 VAL HB A 14 ALA HB% 1.0 . 3.58 582 582 A 33 VAL HB A 14 ALA HB% 1.0 . 3.57 583 583 A 27 LYS HA A 27 LYS HBx 1.0 . 2.83 584 584 A 27 LYS HBx A 27 LYS HEx 1.0 . 5.50 585 585 A 27 LYS HBx A 27 LYS HEy 1.0 . 5.50 586 586 A 26 TYR HDy A 27 LYS HBx 1.0 . 5.50 587 587 A 27 LYS H A 27 LYS HBx 1.0 . 3.51 588 588 A 27 LYS HBy A 27 LYS HEx 1.0 . 5.50 589 589 A 27 LYS HBy A 27 LYS HEy 1.0 . 5.50 590 590 A 84 ALA H A 83 LYS HBy 1.0 . 2.55 591 591 A 80 ALA HA A 83 LYS HBy 1.0 . 3.00 592 592 A 45 LYS HBy A 46 VAL H 1.0 . 3.64 593 593 A 83 LYS HBx A 83 LYS HDy 1.0 . 2.91 594 594 A 45 LYS HBy A 46 VAL HGy% 1.0 . 4.22 595 595 A 5 ILE HD1% A 45 LYS HBy 1.0 . 4.80 596 596 A 76 VAL H A 76 VAL HB 1.0 . 3.96 597 597 A 64 GLN HGx A 76 VAL HB 1.0 . 3.07 598 598 A 64 GLN HGy A 76 VAL HB 1.0 . 5.23 599 599 A 64 GLN HGx A 65 LEU HG 1.0 . 4.93 600 600 A 64 GLN HGx A 77 LEU HBy 1.0 . 4.88 601 601 A 64 GLN HGy A 65 LEU HG 1.0 . 4.97 602 602 A 64 GLN HGy A 82 THR HG2% 1.0 . 5.50 603 603 A 64 GLN HGy A 82 THR HG2% 1.0 . 5.50 604 604 A 16 SER HA A 19 GLN HGy 1.0 . 2.88 605 605 A 16 SER HA A 19 GLN HGx 1.0 . 2.88 606 606 A 52 GLN HA A 52 GLN HGy 1.0 . 4.01 607 607 A 64 GLN HGx A 64 GLN H 1.0 . 4.25 608 608 A 100 GLU HA A 103 GLN HGy 1.0 . 4.45 609 609 A 52 GLN HA A 52 GLN HGx 1.0 . 4.01 610 610 A 103 GLN HA A 103 GLN HGy 1.0 . 3.98 611 611 A 103 GLN HA A 103 GLN HGx 1.0 . 3.97 612 612 A 43 ILE HD1% A 103 GLN HGy 1.0 . 5.50 613 613 A 43 ILE HD1% A 103 GLN HGy 1.0 . 5.50 614 614 A 39 THR HG2% A 42 GLN HGy 1.0 . 5.50 615 615 A 42 GLN HA A 42 GLN HGy 1.0 . 3.82 616 616 A 42 GLN HA A 42 GLN HGx 1.0 . 3.82 617 617 A 26 TYR HDy A 26 TYR HBy 1.0 . 3.26 618 618 A 26 TYR HBx A 26 TYR HDx 1.0 . 3.30 619 619 A 27 LYS H A 26 TYR HBy 1.0 . 4.08 620 620 A 27 LYS H A 26 TYR HBx 1.0 . 4.35 621 621 A 82 THR HG2% A 60 GLU HGy 1.0 . 3.04 622 622 A 60 GLU HGx A 86 LEU HDx% 1.0 . 4.41 623 623 A 60 GLU HGx A 86 LEU HDx% 1.0 . 4.82 624 624 A 86 LEU HDy% A 60 GLU HGy 1.0 . 5.50 625 625 A 60 GLU HA A 60 GLU HGy 1.0 . 2.78 626 626 A 60 GLU H A 60 GLU HGy 1.0 . 4.57 627 627 A 60 GLU HGx A 60 GLU H 1.0 . 4.74 628 628 A 61 GLU H A 60 GLU HGy 1.0 . 4.79 629 629 A 60 GLU HGx A 61 GLU H 1.0 . 5.50 630 630 A 103 GLN HGx A 43 ILE HB 1.0 . 4.86 631 631 A 103 GLN HBx A 43 ILE HB 1.0 . 5.50 632 632 A 43 ILE HD1% A 43 ILE HB 1.0 . 3.61 633 633 A 43 ILE HD1% A 43 ILE HB 1.0 . 3.81 634 634 A 44 LYS H A 43 ILE HB 1.0 . 4.17 635 635 A 31 SER H A 30 PHE HBy 1.0 . 3.67 636 636 A 31 SER H A 30 PHE HBx 1.0 . 3.67 637 637 A 97 ILE HG2% A 101 GLU HGx 1.0 . 5.50 638 638 A 97 ILE HG2% A 101 GLU HGy 1.0 . 5.50 639 639 A 101 GLU HA A 101 GLU HGx 1.0 . 3.78 640 640 A 98 GLY H A 101 GLU HGy 1.0 . 4.92 641 641 A 98 GLY H A 101 GLU HGx 1.0 . 4.92 642 642 A 102 PHE H A 101 GLU HGy 1.0 . 5.50 643 643 A 102 PHE H A 101 GLU HGx 1.0 . 5.50 644 644 A 81 GLU H A 81 GLU HGx 1.0 . 3.76 645 645 A 81 GLU HGx A 77 LEU HA 1.0 . 5.50 646 646 A 77 LEU HBx A 81 GLU HGx 1.0 . 5.37 647 647 A 80 ALA HB% A 81 GLU HGx 1.0 . 3.89 648 648 A 78 THR HG2% A 81 GLU HGx 1.0 . 5.50 649 649 A 78 THR HG2% A 81 GLU HGx 1.0 . 5.50 650 650 A 78 THR HG2% A 81 GLU HGx 1.0 . 5.50 651 651 A 2 ILE HB A 3 THR HG2% 1.0 . 5.50 652 652 A 2 ILE HB A 2 ILE HG1x 1.0 . 2.80 653 653 A 11 ILE HB A 10 ASP H 1.0 . 4.43 654 654 A 8 ALA HA A 11 ILE HB 1.0 . 3.51 655 655 A 81 GLU HGy A 81 GLU HA 1.0 . 3.75 656 656 A 81 GLU HGy A 81 GLU HBy 1.0 . 2.40 657 657 A 102 PHE HEy A 47 PHE HBx 1.0 . 4.04 658 658 A 47 PHE H A 47 PHE HBx 1.0 . 3.36 659 659 A 102 PHE HDy A 47 PHE HBx 1.0 . 5.50 660 660 A 47 PHE HDy A 47 PHE HBx 1.0 . 3.56 661 661 A 47 PHE HBy A 47 PHE H 1.0 . 3.44 662 662 A 47 PHE HBy A 47 PHE HDx 1.0 . 3.30 663 663 A 44 LYS HA A 47 PHE HBy 1.0 . 3.18 664 664 A 70 PHE HBx A 71 SER H 1.0 . 5.50 665 665 A 58 ILE HB A 97 ILE H 1.0 . 4.42 666 666 A 86 LEU H A 85 PHE HBy 1.0 . 3.08 667 667 A 82 THR HA A 85 PHE HBy 1.0 . 3.36 668 668 A 84 ALA HB% A 85 PHE HBx 1.0 . 4.14 669 669 A 63 LEU HG A 85 PHE HBy 1.0 . 5.34 670 670 A 85 PHE HBy A 86 LEU HBy 1.0 . 5.50 671 671 A 63 LEU HDy% A 85 PHE HBy 1.0 . 4.29 672 672 A 63 LEU HDy% A 85 PHE HBy 1.0 . 4.69 673 673 A 86 LEU HG A 90 ASP HBx 1.0 . 3.79 674 674 A 90 ASP HBx A 97 ILE HG1x 1.0 . 5.50 675 675 A 33 VAL HGy% A 10 ASP HBy 1.0 . 4.10 676 676 A 33 VAL HGy% A 10 ASP HBx 1.0 . 4.10 677 677 A 90 ASP HBx A 90 ASP H 1.0 . 3.14 678 678 A 11 ILE H A 10 ASP HBy 1.0 . 4.32 679 679 A 24 PHE H A 24 PHE HBx 1.0 . 3.48 680 680 A 24 PHE H A 24 PHE HBy 1.0 . 3.48 681 681 A 97 ILE HB A 97 ILE H 1.0 . 3.20 682 682 A 58 ILE HB A 97 ILE HB 1.0 . 3.88 683 683 A 97 ILE HB A 63 LEU HDx% 1.0 . 3.57 684 684 A 97 ILE HD1% A 97 ILE HB 1.0 . 2.70 685 685 A 50 LEU HDy% A 69 ASN HBx 1.0 . 4.76 686 686 A 50 LEU HDy% A 69 ASN HBy 1.0 . 4.76 687 687 A 90 ASP HBy A 97 ILE HG1y 1.0 . 2.64 688 688 A 97 ILE HD1% A 90 ASP HBy 1.0 . 5.50 689 689 A 101 GLU HBx A 90 ASP HBy 1.0 . 5.50 690 690 A 90 ASP HBy A 101 GLU HBy 1.0 . 5.50 691 691 A 86 LEU HG A 90 ASP HBy 1.0 . 4.25 692 692 A 90 ASP HBy A 97 ILE HG1x 1.0 . 4.76 693 693 A 90 ASP HBy A 90 ASP H 1.0 . 3.35 694 694 A 90 ASP HBy A 96 LYS H 1.0 . 4.24 695 695 A 29 PHE HBy A 29 PHE HDy 1.0 . 2.65 696 696 A 29 PHE HBy A 24 PHE HEy 1.0 . 3.93 697 697 A 24 PHE HEy A 29 PHE HBx 1.0 . 5.33 698 698 A 27 LYS H A 29 PHE HBx 1.0 . 5.50 699 699 A 102 PHE H A 102 PHE HBx 1.0 . 3.41 700 700 A 102 PHE HBy A 102 PHE H 1.0 . 3.55 701 701 A 102 PHE HBy A 103 GLN H 1.0 . 3.26 702 702 A 102 PHE HDx A 102 PHE HBx 1.0 . 3.45 703 703 A 102 PHE HDy A 102 PHE HBy 1.0 . 3.61 704 704 A 47 PHE HEy A 102 PHE HBx 1.0 . 4.62 705 705 A 47 PHE HDy A 102 PHE HBx 1.0 . 4.05 706 706 A 97 ILE HG2% A 102 PHE HBx 1.0 . 3.59 707 707 A 97 ILE HG2% A 102 PHE HBx 1.0 . 3.77 708 708 A 42 GLN HA A 41 ASP HBx 1.0 . 5.50 709 709 A 42 GLN HA A 41 ASP HBy 1.0 . 5.50 710 710 A 43 ILE H A 41 ASP HBx 1.0 . 5.50 711 711 A 43 ILE H A 41 ASP HBy 1.0 . 5.50 712 712 A 42 GLN H A 41 ASP HBx 1.0 . 4.55 713 713 A 42 GLN H A 41 ASP HBy 1.0 . 4.55 714 714 A 5 ILE H A 4 ASP HBy 1.0 . 3.84 715 715 A 4 ASP HBy A 5 ILE HG1y 1.0 . 4.64 716 716 A 4 ASP HBy A 5 ILE HG1x 1.0 . 4.64 717 717 A 5 ILE HD1% A 4 ASP HBx 1.0 . 5.50 718 718 A 5 ILE HD1% A 4 ASP HBx 1.0 . 5.50 719 719 A 5 ILE HD1% A 4 ASP HBx 1.0 . 5.50 720 720 A 88 ALA H A 86 LEU HBx 1.0 . 4.71 721 721 A 66 PHE H A 65 LEU HBx 1.0 . 4.23 722 722 A 68 LYS H A 65 LEU HBx 1.0 . 5.50 723 723 A 65 LEU H A 65 LEU HBx 1.0 . 3.34 724 724 A 62 GLU HA A 65 LEU HBx 1.0 . 4.13 725 725 A 64 GLN HGy A 65 LEU HBy 1.0 . 5.37 726 726 A 64 GLN HGy A 65 LEU HBx 1.0 . 5.50 727 727 A 76 VAL HGx% A 65 LEU HBy 1.0 . 4.40 728 728 A 65 LEU HDx% A 65 LEU HBx 1.0 . 2.52 729 729 A 15 LEU H A 15 LEU HBx 1.0 . 3.73 730 730 A 68 LYS H A 67 LEU HBy 1.0 . 5.00 731 731 A 15 LEU HDy% A 15 LEU HBx 1.0 . 2.63 732 732 A 86 LEU HA A 86 LEU HBy 1.0 . 2.62 733 733 A 68 LYS H A 67 LEU HBx 1.0 . 5.00 734 734 A 12 GLU HA A 15 LEU HBy 1.0 . 3.60 735 735 A 50 LEU HBx A 50 LEU HDx% 1.0 . 3.29 736 736 A 50 LEU HBx A 50 LEU HDx% 1.0 . 3.74 737 737 A 58 ILE HD1% A 50 LEU HBx 1.0 . 4.87 738 738 A 58 ILE HD1% A 50 LEU HBx 1.0 . 5.47 739 739 A 58 ILE HD1% A 50 LEU HBx 1.0 . 5.43 740 740 A 50 LEU HBx A 47 PHE HA 1.0 . 5.50 741 741 A 6 LEU H A 5 ILE HB 1.0 . 3.59 742 742 A 5 ILE H A 5 ILE HB 1.0 . 3.34 743 743 A 5 ILE HB A 46 VAL HGx% 1.0 . 5.50 744 744 A 5 ILE HB A 46 VAL HGx% 1.0 . 5.50 745 745 A 2 ILE HD1% A 5 ILE HB 1.0 . 5.50 746 746 A 2 ILE HD1% A 5 ILE HB 1.0 . 5.50 747 747 A 2 ILE HD1% A 5 ILE HB 1.0 . 5.50 748 748 A 64 GLN H A 63 LEU HBx 1.0 . 5.50 749 749 A 63 LEU HBy A 64 GLN H 1.0 . 4.63 750 750 A 65 LEU H A 63 LEU HBx 1.0 . 5.05 751 751 A 82 THR HG2% A 63 LEU HBx 1.0 . 3.18 752 752 A 82 THR HG2% A 63 LEU HBx 1.0 . 3.46 753 753 A 58 ILE HG2% A 63 LEU HBx 1.0 . 5.50 754 754 A 58 ILE HG2% A 63 LEU HBx 1.0 . 5.50 755 755 A 58 ILE HG2% A 63 LEU HBx 1.0 . 5.50 756 756 A 63 LEU HBy A 63 LEU HDx% 1.0 . 3.53 757 757 A 82 THR HG2% A 86 LEU HBx 1.0 . 5.50 758 758 A 82 THR HG2% A 86 LEU HBx 1.0 . 5.50 759 759 A 86 LEU HDy% A 86 LEU HBx 1.0 . 3.84 760 760 A 83 LYS HA A 86 LEU HBx 1.0 . 3.83 761 761 A 86 LEU H A 86 LEU HBx 1.0 . 3.35 762 762 A 82 THR HG2% A 86 LEU HBy 1.0 . 5.50 763 763 A 82 THR HG2% A 86 LEU HBy 1.0 . 5.50 764 764 A 86 LEU HDx% A 86 LEU HBy 1.0 . 3.68 765 765 A 63 LEU HDy% A 86 LEU HBy 1.0 . 4.95 766 766 A 87 ALA H A 86 LEU HBy 1.0 . 4.26 767 767 A 41 ASP HA A 44 LYS HEx 1.0 . 5.50 768 768 A 41 ASP HA A 44 LYS HEy 1.0 . 5.50 769 769 A 26 TYR HEy A 27 LYS HEx 1.0 . 5.50 770 770 A 26 TYR HEy A 27 LYS HEy 1.0 . 5.50 771 771 A 66 PHE HBy A 77 LEU HDx% 1.0 . 3.34 772 772 A 77 LEU HDy% A 66 PHE HBy 1.0 . 4.82 773 773 A 77 LEU HDy% A 66 PHE HBy 1.0 . 5.09 774 774 A 66 PHE HA A 66 PHE HBx 1.0 . 3.01 775 775 A 66 PHE H A 66 PHE HBx 1.0 . 3.98 776 776 A 65 LEU H A 66 PHE HBx 1.0 . 5.02 777 777 A 65 LEU H A 66 PHE HBy 1.0 . 5.50 778 778 A 66 PHE HDx A 66 PHE HBx 1.0 . 3.23 779 779 A 66 PHE HDy A 66 PHE HBy 1.0 . 3.46 780 780 A 65 LEU HDy% A 68 LYS HEx 1.0 . 5.42 781 781 A 75 ARG HDx A 75 ARG HBx 1.0 . 3.84 782 782 A 6 LEU H A 6 LEU HBx 1.0 . 2.70 783 783 A 35 LEU HBx A 35 LEU H 1.0 . 3.32 784 784 A 35 LEU HBx A 36 SER H 1.0 . 3.47 785 785 A 106 VAL H A 105 LEU HBy 1.0 . 4.94 786 786 A 6 LEU HBx A 3 THR HG2% 1.0 . 5.27 787 787 A 6 LEU HBx A 6 LEU HDx% 1.0 . 3.35 788 788 A 106 VAL HGx% A 35 LEU HBx 1.0 . 4.14 789 789 A 97 ILE HD1% A 105 LEU HBx 1.0 . 5.49 790 790 A 97 ILE HD1% A 105 LEU HBy 1.0 . 5.50 791 791 A 105 LEU HDx% A 105 LEU HBx 1.0 . 3.49 792 792 A 105 LEU HDy% A 105 LEU HBx 1.0 . 3.91 793 793 A 105 LEU HDx% A 105 LEU HBy 1.0 . 3.76 794 794 A 105 LEU HDx% A 105 LEU HBy 1.0 . 3.98 795 795 A 75 ARG HBx A 75 ARG HDy 1.0 . 3.84 796 796 A 6 LEU HBx A 7 SER H 1.0 . 3.81 797 797 A 6 LEU H A 6 LEU HBy 1.0 . 4.12 798 798 A 35 LEU HDy% A 35 LEU HBy 1.0 . 3.97 799 799 A 33 VAL HGx% A 35 LEU HBy 1.0 . 3.85 800 800 A 106 VAL HGx% A 35 LEU HBy 1.0 . 5.50 801 801 A 106 VAL HGx% A 35 LEU HBy 1.0 . 5.50 802 802 A 3 THR HG2% A 6 LEU HBy 1.0 . 5.50 803 803 A 57 PHE HBy A 57 PHE HEx 1.0 . 5.32 804 804 A 57 PHE HBy A 57 PHE HDx 1.0 . 3.44 805 805 A 57 PHE HBx A 57 PHE HDy 1.0 . 3.66 806 806 A 57 PHE HBx A 96 LYS HDy 1.0 . 3.82 807 807 A 57 PHE HBy A 96 LYS HDy 1.0 . 4.57 808 808 A 57 PHE HBy A 96 LYS HDx 1.0 . 4.57 809 809 A 98 GLY HAx A 99 VAL HA 1.0 . 5.07 810 810 A 101 GLU HBx A 98 GLY HAx 1.0 . 5.50 811 811 A 99 VAL HB A 98 GLY HAx 1.0 . 5.48 812 812 A 97 ILE HG2% A 98 GLY HAx 1.0 . 5.29 813 813 A 97 ILE HG2% A 98 GLY HAx 1.0 . 5.50 814 814 A 99 VAL HGy% A 98 GLY HAx 1.0 . 4.70 815 815 A 99 VAL HGy% A 98 GLY HAx 1.0 . 5.05 816 816 A 98 GLY HAx A 57 PHE HA 1.0 . 4.85 817 817 A 57 PHE HEx A 98 GLY HAx 1.0 . 4.61 818 818 A 57 PHE HDx A 98 GLY HAx 1.0 . 3.02 819 819 A 33 VAL HA A 34 GLY HAx 1.0 . 4.72 820 820 A 89 GLY HAx A 88 ALA H 1.0 . 5.50 821 821 A 89 GLY HAx A 86 LEU HA 1.0 . 5.50 822 822 A 89 GLY HAx A 105 LEU HBy 1.0 . 5.50 823 823 A 89 GLY HAx A 88 ALA HB% 1.0 . 4.68 824 824 A 89 GLY HAx A 91 THR HG2% 1.0 . 5.50 825 825 A 89 GLY HAx A 97 ILE HG2% 1.0 . 4.75 826 826 A 89 GLY HAx A 97 ILE HG2% 1.0 . 5.29 827 827 A 89 GLY HAy A 105 LEU HBx 1.0 . 3.75 828 828 A 89 GLY HAy A 105 LEU HBy 1.0 . 3.81 829 829 A 89 GLY HAy A 88 ALA HB% 1.0 . 4.53 830 830 A 89 GLY HAy A 97 ILE HG2% 1.0 . 5.50 831 831 A 89 GLY HAy A 97 ILE HG2% 1.0 . 5.50 832 832 A 86 LEU HDy% A 95 GLY HAx 1.0 . 5.50 833 833 A 86 LEU HDy% A 95 GLY HAx 1.0 . 5.50 834 834 A 86 LEU HDy% A 95 GLY HAy 1.0 . 5.50 835 835 A 86 LEU HDy% A 95 GLY HAy 1.0 . 5.50 836 836 A 45 LYS HA A 48 GLY HAy 1.0 . 4.28 837 837 A 75 ARG H A 74 ALA HA 1.0 . 2.97 838 838 A 74 ALA HA A 74 ALA HB% 1.0 . 2.60 839 839 A 74 ALA HA A 74 ALA HB% 1.0 . 2.91 840 840 A 51 ASP HA A 50 LEU HBy 1.0 . 5.50 841 841 A 51 ASP HA A 58 ILE HG1y 1.0 . 3.29 842 842 A 51 ASP HA A 58 ILE HG1x 1.0 . 5.26 843 843 A 51 ASP HA A 52 GLN HA 1.0 . 5.12 844 844 A 51 ASP HA A 53 ASP H 1.0 . 4.52 845 845 A 39 THR H A 38 LYS HA 1.0 . 3.15 846 846 A 85 PHE HA A 88 ALA HA 1.0 . 5.50 847 847 A 87 ALA HA A 87 ALA HB% 1.0 . 2.76 848 848 A 87 ALA HA A 87 ALA HB% 1.0 . 2.94 849 849 A 86 LEU HBy A 87 ALA HA 1.0 . 5.50 850 850 A 86 LEU HDy% A 87 ALA HA 1.0 . 4.89 851 851 A 86 LEU HDy% A 87 ALA HA 1.0 . 5.46 852 852 A 105 LEU HDx% A 88 ALA HA 1.0 . 4.51 853 853 A 90 ASP HBx A 87 ALA HA 1.0 . 4.31 854 854 A 21 ALA HA A 23 SER H 1.0 . 4.56 855 855 A 21 ALA HA A 22 ASP HA 1.0 . 4.94 856 856 A 69 ASN HA A 70 PHE H 1.0 . 3.49 857 857 A 107 LYS HA A 108 ALA HA 1.0 . 4.67 858 858 A 83 LYS HBx A 84 ALA HA 1.0 . 5.36 859 859 A 84 ALA HB% A 84 ALA HA 1.0 . 2.90 860 860 A 87 ALA HB% A 84 ALA HA 1.0 . 3.72 861 861 A 85 PHE HA A 84 ALA HA 1.0 . 5.13 862 862 A 83 LYS H A 84 ALA HA 1.0 . 5.50 863 863 A 75 ARG HA A 75 ARG HDy 1.0 . 5.50 864 864 A 75 ARG HA A 68 LYS HEy 1.0 . 5.35 865 865 A 75 ARG HA A 75 ARG HDx 1.0 . 5.50 866 866 A 75 ARG HA A 68 LYS HEx 1.0 . 5.35 867 867 A 33 VAL H A 14 ALA HA 1.0 . 5.50 868 868 A 33 VAL HGx% A 14 ALA HA 1.0 . 5.50 869 869 A 77 LEU HDx% A 77 LEU HA 1.0 . 5.35 870 870 A 77 LEU HDx% A 77 LEU HA 1.0 . 5.50 871 871 A 77 LEU HDx% A 77 LEU HA 1.0 . 5.50 872 872 A 77 LEU HDy% A 77 LEU HA 1.0 . 3.83 873 873 A 77 LEU HDy% A 77 LEU HA 1.0 . 3.76 874 874 A 78 THR HG2% A 77 LEU HA 1.0 . 5.50 875 875 A 78 THR HG2% A 77 LEU HA 1.0 . 5.50 876 876 A 11 ILE HD1% A 8 ALA HA 1.0 . 3.31 877 877 A 11 ILE HD1% A 8 ALA HA 1.0 . 3.77 878 878 A 12 GLU H A 8 ALA HA 1.0 . 5.50 879 879 A 107 LYS HA A 106 VAL H 1.0 . 5.44 880 880 A 25 ASN HA A 26 TYR H 1.0 . 2.72 881 881 A 25 ASN HA A 24 PHE HDy 1.0 . 5.39 882 882 A 26 TYR HDx A 25 ASN HA 1.0 . 5.23 883 883 A 60 GLU H A 59 GLU HA 1.0 . 2.88 884 884 A 54 LYS HA A 56 GLY H 1.0 . 4.36 885 885 A 43 ILE H A 41 ASP HA 1.0 . 4.43 886 886 A 33 VAL H A 10 ASP HA 1.0 . 5.50 887 887 A 78 THR H A 81 GLU HA 1.0 . 5.18 888 888 A 13 SER HA A 14 ALA H 1.0 . 3.32 889 889 A 13 SER HA A 16 SER H 1.0 . 5.50 890 890 A 79 SER HA A 82 THR H 1.0 . 4.67 891 891 A 32 THR H A 31 SER HBx 1.0 . 5.22 892 892 A 32 THR H A 31 SER HBy 1.0 . 5.22 893 893 A 7 SER H A 7 SER HBx 1.0 . 3.24 894 894 A 9 LYS H A 7 SER HBx 1.0 . 5.50 895 895 A 55 SER H A 55 SER HBx 1.0 . 3.93 896 896 A 11 ILE HA A 7 SER H 1.0 . 5.50 897 897 A 11 ILE HA A 33 VAL H 1.0 . 5.13 898 898 A 83 LYS H A 82 THR HA 1.0 . 3.52 899 899 A 82 THR H A 82 THR HB 1.0 . 3.29 900 900 A 55 SER H A 55 SER HBy 1.0 . 3.93 901 901 A 67 LEU HA A 70 PHE HDy 1.0 . 3.80 902 902 A 66 PHE HDy A 67 LEU HA 1.0 . 3.68 903 903 A 35 LEU HA A 37 SER H 1.0 . 5.50 904 904 A 35 LEU HA A 38 LYS H 1.0 . 5.50 905 905 A 15 LEU HA A 18 CYS H 1.0 . 5.28 906 906 A 85 PHE HA A 85 PHE HEx 1.0 . 5.16 907 907 A 62 GLU HA A 64 GLN H 1.0 . 5.05 908 908 A 62 GLU HA A 65 LEU H 1.0 . 3.95 909 909 A 30 PHE HA A 30 PHE HDx 1.0 . 4.58 910 910 A 30 PHE HA A 30 PHE HDy 1.0 . 4.87 911 911 A 27 LYS HA A 30 PHE HDx 1.0 . 5.17 912 912 A 27 LYS HA A 30 PHE HDy 1.0 . 5.50 913 913 A 70 PHE HDx A 70 PHE HA 1.0 . 4.13 914 914 A 70 PHE HDy A 70 PHE HA 1.0 . 4.44 915 915 A 30 PHE HA A 29 PHE HDx 1.0 . 4.84 916 916 A 26 TYR HDy A 27 LYS HA 1.0 . 3.59 917 917 A 103 GLN HA A 102 PHE HDy 1.0 . 4.55 918 918 A 28 SER H A 28 SER HA 1.0 . 2.92 919 919 A 44 LYS HA A 47 PHE HDx 1.0 . 4.60 920 920 A 23 SER H A 24 PHE HA 1.0 . 5.50 921 921 A 24 PHE HDy A 24 PHE HA 1.0 . 5.50 922 922 A 24 PHE HEy A 24 PHE HA 1.0 . 4.77 923 923 A 18 CYS HA A 24 PHE HA 1.0 . 5.50 924 924 A 58 ILE HA A 62 GLU H 1.0 . 5.27 925 925 A 106 VAL H A 104 SER HA 1.0 . 5.48 926 926 A 107 LYS H A 104 SER HA 1.0 . 4.55 927 927 A 24 PHE HDy A 29 PHE HA 1.0 . 5.50 928 928 A 102 PHE HA A 102 PHE HEx 1.0 . 5.50 929 929 A 102 PHE HDx A 102 PHE HA 1.0 . 3.32 930 930 A 13 SER H A 13 SER HBy 1.0 . 3.63 931 931 A 17 SER H A 16 SER HBx 1.0 . 5.41 932 932 A 17 SER H A 16 SER HBy 1.0 . 5.41 933 933 A 66 PHE HA A 69 ASN H 1.0 . 3.94 934 934 A 66 PHE HDx A 66 PHE HA 1.0 . 3.96 935 935 A 2 ILE HA A 6 LEU H 1.0 . 5.50 936 936 A 2 ILE HA A 4 ASP H 1.0 . 4.99 937 937 A 71 SER H A 71 SER HBy 1.0 . 3.99 938 938 A 18 CYS HA A 23 SER HBy 1.0 . 4.76 939 939 A 18 CYS HA A 23 SER HBx 1.0 . 4.76 940 940 A 43 ILE HA A 46 VAL H 1.0 . 3.86 941 941 A 43 ILE HA A 102 PHE HEy 1.0 . 4.42 942 942 A 82 THR HA A 85 PHE H 1.0 . 4.47 943 943 A 85 PHE HDy A 82 THR HA 1.0 . 5.33 944 944 A 91 THR HB A 92 ASP HA 1.0 . 5.50 945 945 A 83 LYS HA A 82 THR HB 1.0 . 4.22 946 946 A 82 THR HA A 64 GLN HA 1.0 . 5.50 947 947 A 82 THR HA A 81 GLU HA 1.0 . 5.50 948 948 A 2 ILE HA A 46 VAL HA 1.0 . 5.39 949 949 A 11 ILE HA A 12 GLU HA 1.0 . 5.50 950 950 A 35 LEU HA A 43 ILE HA 1.0 . 5.30 951 951 A 43 ILE HA A 42 GLN HA 1.0 . 5.50 952 952 A 43 ILE HA A 44 LYS HA 1.0 . 5.50 953 953 A 107 LYS HA A 36 SER HBx 1.0 . 5.50 954 954 A 107 LYS HA A 36 SER HBy 1.0 . 5.50 955 955 A 33 VAL HA A 10 ASP HA 1.0 . 5.50 956 956 A 33 VAL HA A 10 ASP HBy 1.0 . 4.09 957 957 A 33 VAL HA A 10 ASP HBx 1.0 . 4.09 958 958 A 79 SER HA A 78 THR HA 1.0 . 4.33 959 959 A 30 PHE HA A 31 SER HA 1.0 . 4.88 960 960 A 44 LYS HA A 102 PHE HBy 1.0 . 4.92 961 961 A 42 GLN HA A 41 ASP HA 1.0 . 5.20 962 962 A 27 LYS HA A 26 TYR HA 1.0 . 5.50 963 963 A 27 LYS HA A 27 LYS HEx 1.0 . 5.50 964 964 A 27 LYS HA A 27 LYS HEy 1.0 . 5.50 965 965 A 42 GLN HBx A 42 GLN HA 1.0 . 2.55 966 966 A 101 GLU HA A 101 GLU HGy 1.0 . 3.78 967 967 A 101 GLU HA A 90 ASP HA 1.0 . 5.22 968 968 A 9 LYS HA A 10 ASP HA 1.0 . 4.76 969 969 A 67 LEU HA A 70 PHE HBy 1.0 . 4.31 970 970 A 25 ASN HA A 26 TYR HA 1.0 . 5.50 971 971 A 20 ALA HA A 21 ALA HA 1.0 . 5.50 972 972 A 6 LEU HDx% A 6 LEU HA 1.0 . 4.03 973 973 A 50 LEU HDy% A 50 LEU HA 1.0 . 4.28 974 974 A 50 LEU HDy% A 50 LEU HA 1.0 . 4.67 975 975 A 68 LYS HA A 65 LEU HBy 1.0 . 5.50 976 976 A 68 LYS HGx A 68 LYS HA 1.0 . 3.86 977 977 A 35 LEU HA A 38 LYS HBx 1.0 . 4.12 978 978 A 35 LEU HA A 38 LYS HBy 1.0 . 3.77 979 979 A 35 LEU HA A 6 LEU HDx% 1.0 . 3.50 980 980 A 58 ILE HG2% A 63 LEU HA 1.0 . 4.28 981 981 A 58 ILE HG2% A 63 LEU HA 1.0 . 4.84 982 982 A 106 VAL HGx% A 35 LEU HA 1.0 . 5.50 983 983 A 106 VAL HGx% A 35 LEU HA 1.0 . 5.50 984 984 A 63 LEU HA A 63 LEU HDx% 1.0 . 3.37 985 985 A 63 LEU HA A 63 LEU HDx% 1.0 . 3.67 986 986 A 105 LEU HDy% A 105 LEU HA 1.0 . 5.17 987 987 A 63 LEU HA A 66 PHE HBx 1.0 . 4.34 988 988 A 41 ASP HA A 44 LYS HGy 1.0 . 5.50 989 989 A 85 PHE HA A 88 ALA HB% 1.0 . 3.37 990 990 A 41 ASP HA A 44 LYS HGx 1.0 . 5.50 991 991 A 15 LEU HDy% A 15 LEU HA 1.0 . 3.52 992 992 A 15 LEU HDy% A 15 LEU HA 1.0 . 3.70 993 993 A 15 LEU HA A 14 ALA HB% 1.0 . 5.50 994 994 A 15 LEU HA A 14 ALA HB% 1.0 . 5.50 995 995 A 108 ALA HB% A 105 LEU HA 1.0 . 3.89 996 996 A 10 ASP HA A 14 ALA HB% 1.0 . 5.50 997 997 A 86 LEU HG A 86 LEU HA 1.0 . 2.55 998 998 A 82 THR HG2% A 86 LEU HA 1.0 . 5.50 999 999 A 97 ILE HG2% A 86 LEU HA 1.0 . 5.50 1000 1000 A 97 ILE HD1% A 86 LEU HA 1.0 . 2.82 1001 1001 A 86 LEU HA A 63 LEU HDx% 1.0 . 3.70 1002 1002 A 86 LEU HA A 63 LEU HDy% 1.0 . 5.12 1003 1003 A 62 GLU HA A 65 LEU HDx% 1.0 . 3.96 1004 1004 A 62 GLU HA A 65 LEU HDx% 1.0 . 4.26 1005 1005 A 77 LEU HDx% A 64 GLN HA 1.0 . 3.35 1006 1006 A 77 LEU HDy% A 64 GLN HA 1.0 . 5.50 1007 1007 A 77 LEU HDy% A 64 GLN HA 1.0 . 5.50 1008 1008 A 45 LYS HBx A 42 GLN HA 1.0 . 4.43 1009 1009 A 46 VAL HGy% A 42 GLN HA 1.0 . 5.50 1010 1010 A 81 GLU HGx A 81 GLU HA 1.0 . 3.38 1011 1011 A 77 LEU HBy A 64 GLN HA 1.0 . 4.22 1012 1012 A 77 LEU HBx A 64 GLN HA 1.0 . 3.73 1013 1013 A 9 LYS HA A 9 LYS HGx 1.0 . 3.80 1014 1014 A 82 THR HG2% A 64 GLN HA 1.0 . 3.71 1015 1015 A 99 VAL HGy% A 100 GLU HA 1.0 . 5.50 1016 1016 A 99 VAL HGy% A 100 GLU HA 1.0 . 5.50 1017 1017 A 99 VAL HGx% A 100 GLU HA 1.0 . 5.50 1018 1018 A 99 VAL HGx% A 100 GLU HA 1.0 . 5.50 1019 1019 A 11 ILE HG2% A 12 GLU HA 1.0 . 3.48 1020 1020 A 83 LYS HA A 86 LEU HDy% 1.0 . 5.50 1021 1021 A 103 GLN HGx A 100 GLU HA 1.0 . 3.82 1022 1022 A 99 VAL HB A 100 GLU HA 1.0 . 5.50 1023 1023 A 45 LYS HA A 45 LYS HGy 1.0 . 3.88 1024 1024 A 45 LYS HA A 45 LYS HGx 1.0 . 3.88 1025 1025 A 106 VAL HGx% A 103 GLN HA 1.0 . 5.50 1026 1026 A 106 VAL HGx% A 103 GLN HA 1.0 . 5.50 1027 1027 A 39 THR HG2% A 39 THR HA 1.0 . 4.14 1028 1028 A 62 GLU HBy A 58 ILE HA 1.0 . 3.81 1029 1029 A 62 GLU HBx A 58 ILE HA 1.0 . 4.61 1030 1030 A 58 ILE HG2% A 58 ILE HA 1.0 . 3.93 1031 1031 A 58 ILE HG2% A 58 ILE HA 1.0 . 4.18 1032 1032 A 58 ILE HG1y A 58 ILE HA 1.0 . 3.06 1033 1033 A 58 ILE HD1% A 58 ILE HA 1.0 . 5.50 1034 1034 A 58 ILE HD1% A 58 ILE HA 1.0 . 5.50 1035 1035 A 58 ILE HD1% A 58 ILE HA 1.0 . 5.50 1036 1036 A 77 LEU HBx A 78 THR HA 1.0 . 5.50 1037 1037 A 35 LEU HBx A 36 SER HA 1.0 . 4.77 1038 1038 A 43 ILE HD1% A 36 SER HA 1.0 . 4.82 1039 1039 A 106 VAL HGx% A 36 SER HA 1.0 . 3.25 1040 1040 A 106 VAL HGx% A 36 SER HA 1.0 . 3.43 1041 1041 A 16 SER HA A 15 LEU HBx 1.0 . 4.46 1042 1042 A 104 SER HA A 107 LYS HGx 1.0 . 5.50 1043 1043 A 104 SER HA A 107 LYS HGy 1.0 . 5.50 1044 1044 A 13 SER HA A 12 GLU HBx 1.0 . 5.50 1045 1045 A 13 SER HA A 12 GLU HBy 1.0 . 5.50 1046 1046 A 60 GLU HGx A 60 GLU HA 1.0 . 3.93 1047 1047 A 60 GLU HA A 63 LEU HBx 1.0 . 2.97 1048 1048 A 63 LEU HBy A 60 GLU HA 1.0 . 4.14 1049 1049 A 82 THR HG2% A 60 GLU HA 1.0 . 4.81 1050 1050 A 82 THR HG2% A 60 GLU HA 1.0 . 5.00 1051 1051 A 60 GLU HA A 86 LEU HDx% 1.0 . 3.42 1052 1052 A 60 GLU HA A 86 LEU HDx% 1.0 . 3.47 1053 1053 A 60 GLU HA A 63 LEU HDx% 1.0 . 4.37 1054 1054 A 60 GLU HA A 63 LEU HDx% 1.0 . 4.90 1055 1055 A 60 GLU HA A 63 LEU HDy% 1.0 . 5.50 1056 1056 A 60 GLU HA A 63 LEU HDy% 1.0 . 5.50 1057 1057 A 76 VAL HA A 74 ALA HB% 1.0 . 5.05 1058 1058 A 76 VAL HGx% A 76 VAL HA 1.0 . 2.40 1059 1059 A 76 VAL HGy% A 76 VAL HA 1.0 . 4.00 1060 1060 A 76 VAL HGy% A 76 VAL HA 1.0 . 4.25 1061 1061 A 76 VAL HA A 67 LEU HDx% 1.0 . 5.50 1062 1062 A 3 THR HG2% A 3 THR HA 1.0 . 4.00 1063 1063 A 33 VAL HGy% A 33 VAL HA 1.0 . 3.55 1064 1064 A 33 VAL HA A 14 ALA HB% 1.0 . 4.16 1065 1065 A 102 PHE HA A 105 LEU HDx% 1.0 . 5.07 1066 1066 A 64 GLN HGx A 76 VAL HA 1.0 . 4.03 1067 1067 A 102 PHE HA A 101 GLU HBx 1.0 . 5.50 1068 1068 A 102 PHE HA A 101 GLU HBy 1.0 . 5.50 1069 1069 A 76 VAL HA A 64 GLN HBx 1.0 . 5.50 1070 1070 A 50 LEU HDy% A 66 PHE HA 1.0 . 4.62 1071 1071 A 80 ALA HB% A 79 SER HBx 1.0 . 5.50 1072 1072 A 80 ALA HB% A 79 SER HBy 1.0 . 5.50 1073 1073 A 77 LEU HDy% A 66 PHE HA 1.0 . 4.79 1074 1074 A 91 THR HG2% A 91 THR HA 1.0 . 3.30 1075 1075 A 91 THR HG2% A 91 THR HA 1.0 . 3.51 1076 1076 A 49 ILE HA A 49 ILE HG2% 1.0 . 4.16 1077 1077 A 2 ILE HA A 5 ILE HB 1.0 . 5.50 1078 1078 A 2 ILE HA A 6 LEU HBx 1.0 . 5.50 1079 1079 A 2 ILE HA A 5 ILE HD1% 1.0 . 5.50 1080 1080 A 2 ILE HA A 5 ILE HD1% 1.0 . 5.50 1081 1081 A 49 ILE HD1% A 2 ILE HA 1.0 . 4.46 1082 1082 A 49 ILE HD1% A 2 ILE HA 1.0 . 5.11 1083 1083 A 11 ILE HD1% A 7 SER HBy 1.0 . 5.50 1084 1084 A 33 VAL HGy% A 7 SER HBy 1.0 . 5.50 1085 1085 A 74 ALA HB% A 71 SER HBy 1.0 . 5.13 1086 1086 A 74 ALA HB% A 71 SER HBy 1.0 . 5.30 1087 1087 A 74 ALA HB% A 71 SER HBx 1.0 . 5.13 1088 1088 A 74 ALA HB% A 71 SER HBx 1.0 . 5.30 1089 1089 A 105 LEU HDy% A 106 VAL HA 1.0 . 5.50 1090 1090 A 105 LEU HDy% A 106 VAL HA 1.0 . 5.50 1091 1091 A 106 VAL HGx% A 106 VAL HA 1.0 . 3.11 1092 1092 A 105 LEU HA A 106 VAL HA 1.0 . 5.03 1093 1093 A 103 GLN HA A 106 VAL HA 1.0 . 5.37 1094 1094 A 106 VAL HA A 105 LEU H 1.0 . 5.19 1095 1095 A 20 ALA HB% A 23 SER HBy 1.0 . 4.36 1096 1096 A 20 ALA HB% A 23 SER HBy 1.0 . 4.42 1097 1097 A 43 ILE HA A 38 LYS HBx 1.0 . 5.03 1098 1098 A 43 ILE HA A 35 LEU HDy% 1.0 . 2.40 1099 1099 A 43 ILE HA A 43 ILE HG2% 1.0 . 3.91 1100 1100 A 43 ILE HA A 43 ILE HG2% 1.0 . 4.20 1101 1101 A 43 ILE HA A 43 ILE HG1x 1.0 . 4.00 1102 1102 A 43 ILE HA A 43 ILE HD1% 1.0 . 5.32 1103 1103 A 43 ILE HA A 43 ILE HD1% 1.0 . 5.50 1104 1104 A 40 PRO HA A 107 LYS HDx 1.0 . 5.50 1105 1105 A 40 PRO HA A 107 LYS HDy 1.0 . 5.50 1106 1106 A 39 THR HG2% A 40 PRO HA 1.0 . 5.50 1107 1107 A 39 THR HG2% A 40 PRO HA 1.0 . 5.50 1108 1108 A 43 ILE HD1% A 40 PRO HA 1.0 . 3.30 1109 1109 A 11 ILE HA A 15 LEU HG 1.0 . 4.62 1110 1110 A 11 ILE HA A 33 VAL HB 1.0 . 5.50 1111 1111 A 11 ILE HA A 33 VAL HGy% 1.0 . 3.52 1112 1112 A 11 ILE HA A 33 VAL HGy% 1.0 . 3.77 1113 1113 A 14 ALA HB% A 32 THR HA 1.0 . 5.05 1114 1114 A 14 ALA HB% A 32 THR HA 1.0 . 5.42 1115 1115 A 46 VAL HA A 49 ILE HG1x 1.0 . 4.33 1116 1116 A 2 ILE HG1y A 46 VAL HA 1.0 . 5.50 1117 1117 A 5 ILE HD1% A 46 VAL HA 1.0 . 5.50 1118 1118 A 5 ILE HD1% A 46 VAL HA 1.0 . 5.50 1119 1119 A 49 ILE HD1% A 46 VAL HA 1.0 . 3.65 1120 1120 A 2 ILE HD1% A 46 VAL HA 1.0 . 5.10 1121 1121 A 2 ILE HD1% A 46 VAL HA 1.0 . 5.50 1122 1122 A 2 ILE HD1% A 46 VAL HA 1.0 . 5.50 1123 1123 A 77 LEU HBy A 82 THR HB 1.0 . 4.87 1124 1124 A 77 LEU HDx% A 82 THR HB 1.0 . 4.77 1125 1125 A 77 LEU HDx% A 82 THR HB 1.0 . 5.23 1126 1126 A 63 LEU HG A 82 THR HB 1.0 . 5.50 1127 1127 A 82 THR HA A 77 LEU HBy 1.0 . 5.01 1128 1128 A 81 GLU HBx A 82 THR HA 1.0 . 5.46 1129 1129 A 82 THR HA A 63 LEU HBx 1.0 . 4.74 1130 1130 A 82 THR HA A 77 LEU HBx 1.0 . 4.96 1131 1131 A 63 LEU HG A 82 THR HA 1.0 . 5.40 1132 1132 A 82 THR HA A 77 LEU HDx% 1.0 . 4.11 1133 1133 A 77 LEU HDy% A 82 THR HA 1.0 . 5.50 1134 1134 A 77 LEU HDy% A 82 THR HA 1.0 . 5.50 1135 1135 A 77 LEU HDy% A 82 THR HA 1.0 . 5.50 1136 1136 A 18 CYS HA A 20 ALA H 1.0 . 4.26 1137 1137 A 107 LYS HA A 107 LYS HEx 1.0 . 5.50 1138 1138 A 107 LYS HA A 107 LYS HEy 1.0 . 5.50 1139 1139 A 107 LYS HA A 36 SER HA 1.0 . 4.25 1140 1140 A 58 ILE H A 57 PHE HA 1.0 . 3.28 1141 1141 A 57 PHE HDx A 57 PHE HA 1.0 . 3.23 1142 1142 A 58 ILE HB A 57 PHE HA 1.0 . 5.12 1143 1143 A 58 ILE HG1x A 57 PHE HA 1.0 . 4.29 1144 1144 A 86 LEU HA A 85 PHE HBy 1.0 . 4.59 1145 1145 A 83 LYS HA A 84 ALA HA 1.0 . 4.96 1146 1146 A 29 PHE HBy A 26 TYR HA 1.0 . 4.00 1147 1147 A 29 PHE HBx A 26 TYR HA 1.0 . 4.01 1148 1148 A 26 TYR HBy A 26 TYR HA 1.0 . 2.69 1149 1149 A 26 TYR HDx A 26 TYR HA 1.0 . 4.73 1150 1150 A 26 TYR HDy A 26 TYR HA 1.0 . 5.12 1151 1151 A 26 TYR HA A 30 PHE H 1.0 . 4.97 1152 1152 A 102 PHE HEy A 47 PHE HA 1.0 . 4.67 1153 1153 A 49 ILE H A 47 PHE HA 1.0 . 4.33 1154 1154 A 47 PHE HEy A 47 PHE HA 1.0 . 5.39 1155 1155 A 50 LEU HG A 47 PHE HA 1.0 . 4.30 1156 1156 A 46 VAL HGx% A 47 PHE HA 1.0 . 4.31 1157 1157 A 50 LEU HDx% A 47 PHE HA 1.0 . 4.83 1158 1158 A 50 LEU HDx% A 47 PHE HA 1.0 . 4.85 1159 1159 A 50 LEU HDy% A 47 PHE HA 1.0 . 5.14 1160 1160 A 50 LEU HDy% A 47 PHE HA 1.0 . 5.50 1161 1161 A 18 CYS HA A 17 SER HBx 1.0 . 5.50 1162 1162 A 18 CYS HA A 17 SER HBy 1.0 . 5.50 1163 1163 A 7 SER HA A 7 SER HBy 1.0 . 2.82 1164 1164 A 97 ILE HG2% A 99 VAL HA 1.0 . 5.50 1165 1165 A 97 ILE HG2% A 99 VAL HA 1.0 . 5.50 1166 1166 A 99 VAL HGy% A 99 VAL HA 1.0 . 4.16 1167 1167 A 99 VAL HGx% A 99 VAL HA 1.0 . 3.09 1168 1168 A 102 PHE HBx A 99 VAL HA 1.0 . 3.93 1169 1169 A 102 PHE HBy A 99 VAL HA 1.0 . 4.07 1170 1170 A 47 PHE HBx A 99 VAL HA 1.0 . 5.01 1171 1171 A 100 GLU HA A 99 VAL HA 1.0 . 4.79 1172 1172 A 47 PHE HEx A 99 VAL HA 1.0 . 4.16 1173 1173 A 47 PHE HDx A 99 VAL HA 1.0 . 4.08 1174 1174 A 102 PHE H A 99 VAL HA 1.0 . 3.95 1175 1175 A 28 SER HA A 32 THR HA 1.0 . 5.43 1176 1176 A 82 THR HA A 63 LEU HDy% 1.0 . 5.50 1177 1177 A 82 THR HA A 63 LEU HDy% 1.0 . 5.50 1178 1178 A 83 LYS HA A 82 THR HA 1.0 . 4.97 1179 1179 A 3 THR H A 3 THR HB 1.0 . 3.86 1180 1180 A 3 THR H A 4 ASP HBx 1.0 . 5.39 1181 1181 A 2 ILE HB A 3 THR H 1.0 . 4.28 1182 1182 A 6 LEU HBx A 3 THR H 1.0 . 5.39 1183 1183 A 2 ILE HG1y A 3 THR H 1.0 . 4.53 1184 1184 A 3 THR H A 3 THR HG2% 1.0 . 3.30 1185 1185 A 3 THR H A 3 THR HG2% 1.0 . 3.69 1186 1186 A 5 ILE H A 3 THR H 1.0 . 4.72 1187 1187 A 3 THR H A 4 ASP H 1.0 . 3.46 1188 1188 A 4 ASP H A 4 ASP HBx 1.0 . 3.15 1189 1189 A 4 ASP H A 3 THR HG2% 1.0 . 4.97 1190 1190 A 4 ASP H A 3 THR HG2% 1.0 . 5.43 1191 1191 A 2 ILE HA A 5 ILE H 1.0 . 4.26 1192 1192 A 5 ILE H A 4 ASP HBx 1.0 . 3.72 1193 1193 A 5 ILE H A 5 ILE HG1y 1.0 . 3.81 1194 1194 A 5 ILE H A 5 ILE HG1x 1.0 . 3.81 1195 1195 A 5 ILE H A 4 ASP H 1.0 . 2.85 1196 1196 A 5 ILE H A 3 THR HA 1.0 . 3.95 1197 1197 A 6 LEU H A 3 THR HA 1.0 . 3.63 1198 1198 A 6 LEU H A 2 ILE HG1y 1.0 . 4.06 1199 1199 A 6 LEU H A 2 ILE HG2% 1.0 . 5.46 1200 1200 A 6 LEU H A 6 LEU HDx% 1.0 . 4.53 1201 1201 A 6 LEU H A 6 LEU HDx% 1.0 . 4.79 1202 1202 A 6 LEU H A 5 ILE H 1.0 . 2.93 1203 1203 A 6 LEU H A 3 THR H 1.0 . 5.21 1204 1204 A 11 ILE HG1x A 7 SER H 1.0 . 3.11 1205 1205 A 7 SER H A 6 LEU HG 1.0 . 4.42 1206 1206 A 7 SER H A 6 LEU HBy 1.0 . 3.10 1207 1207 A 6 LEU HDy% A 7 SER H 1.0 . 5.05 1208 1208 A 6 LEU HDy% A 7 SER H 1.0 . 5.50 1209 1209 A 11 ILE HD1% A 7 SER H 1.0 . 4.18 1210 1210 A 7 SER H A 33 VAL HGy% 1.0 . 4.12 1211 1211 A 7 SER H A 34 GLY HAx 1.0 . 5.50 1212 1212 A 7 SER H A 33 VAL HA 1.0 . 5.44 1213 1213 A 7 SER H A 6 LEU HA 1.0 . 3.10 1214 1214 A 7 SER H A 7 SER HBy 1.0 . 3.71 1215 1215 A 11 ILE H A 7 SER H 1.0 . 4.29 1216 1216 A 7 SER H A 8 ALA H 1.0 . 4.60 1217 1217 A 6 LEU H A 7 SER H 1.0 . 4.55 1218 1218 A 11 ILE HB A 8 ALA H 1.0 . 5.50 1219 1219 A 8 ALA H A 9 LYS HBx 1.0 . 5.50 1220 1220 A 8 ALA H A 9 LYS HBy 1.0 . 5.50 1221 1221 A 8 ALA HB% A 8 ALA H 1.0 . 3.78 1222 1222 A 3 THR HG2% A 8 ALA H 1.0 . 4.67 1223 1223 A 11 ILE HD1% A 8 ALA H 1.0 . 4.44 1224 1224 A 3 THR HA A 8 ALA H 1.0 . 5.22 1225 1225 A 7 SER HBx A 8 ALA H 1.0 . 4.60 1226 1226 A 9 LYS H A 8 ALA H 1.0 . 3.81 1227 1227 A 7 SER HA A 8 ALA H 1.0 . 3.06 1228 1228 A 9 LYS H A 9 LYS HBx 1.0 . 3.29 1229 1229 A 9 LYS H A 9 LYS HBy 1.0 . 3.29 1230 1230 A 9 LYS H A 7 SER HA 1.0 . 4.73 1231 1231 A 9 LYS H A 7 SER HBy 1.0 . 3.30 1232 1232 A 9 LYS H A 10 ASP H 1.0 . 3.45 1233 1233 A 10 ASP H A 8 ALA H 1.0 . 4.69 1234 1234 A 7 SER H A 10 ASP H 1.0 . 4.61 1235 1235 A 11 ILE H A 10 ASP H 1.0 . 3.14 1236 1236 A 12 GLU H A 10 ASP H 1.0 . 4.23 1237 1237 A 11 ILE HA A 10 ASP H 1.0 . 4.73 1238 1238 A 10 ASP H A 10 ASP HBy 1.0 . 3.83 1239 1239 A 10 ASP H A 10 ASP HBx 1.0 . 3.83 1240 1240 A 11 ILE HD1% A 10 ASP H 1.0 . 5.17 1241 1241 A 7 SER HA A 10 ASP H 1.0 . 4.70 1242 1242 A 10 ASP H A 7 SER HBy 1.0 . 3.71 1243 1243 A 10 ASP H A 7 SER HBx 1.0 . 3.68 1244 1244 A 10 ASP H A 33 VAL HA 1.0 . 5.50 1245 1245 A 11 ILE H A 8 ALA HA 1.0 . 3.83 1246 1246 A 11 ILE H A 7 SER HBx 1.0 . 4.71 1247 1247 A 11 ILE H A 33 VAL HA 1.0 . 4.69 1248 1248 A 11 ILE H A 10 ASP HBx 1.0 . 4.32 1249 1249 A 11 ILE H A 11 ILE HB 1.0 . 2.55 1250 1250 A 11 ILE HD1% A 11 ILE H 1.0 . 3.98 1251 1251 A 11 ILE H A 33 VAL HGy% 1.0 . 4.18 1252 1252 A 11 ILE HG1x A 11 ILE H 1.0 . 2.55 1253 1253 A 12 GLU H A 11 ILE HB 1.0 . 3.39 1254 1254 A 12 GLU H A 11 ILE HG2% 1.0 . 3.62 1255 1255 A 12 GLU H A 10 ASP HA 1.0 . 5.01 1256 1256 A 12 GLU H A 15 LEU H 1.0 . 5.33 1257 1257 A 11 ILE H A 12 GLU H 1.0 . 3.32 1258 1258 A 15 LEU H A 13 SER H 1.0 . 4.18 1259 1259 A 14 ALA H A 13 SER H 1.0 . 3.35 1260 1260 A 11 ILE H A 13 SER H 1.0 . 4.06 1261 1261 A 10 ASP H A 13 SER H 1.0 . 4.90 1262 1262 A 10 ASP HA A 13 SER H 1.0 . 3.77 1263 1263 A 13 SER H A 13 SER HBx 1.0 . 3.63 1264 1264 A 11 ILE HA A 13 SER H 1.0 . 4.75 1265 1265 A 33 VAL HB A 13 SER H 1.0 . 5.50 1266 1266 A 13 SER H A 14 ALA HB% 1.0 . 4.66 1267 1267 A 13 SER H A 14 ALA HB% 1.0 . 5.19 1268 1268 A 11 ILE HA A 14 ALA H 1.0 . 4.15 1269 1269 A 14 ALA H A 12 GLU HBx 1.0 . 5.50 1270 1270 A 14 ALA H A 12 GLU HBy 1.0 . 5.50 1271 1271 A 15 LEU HG A 14 ALA H 1.0 . 4.36 1272 1272 A 33 VAL HB A 14 ALA H 1.0 . 4.62 1273 1273 A 14 ALA H A 14 ALA HB% 1.0 . 3.45 1274 1274 A 14 ALA H A 14 ALA HB% 1.0 . 3.73 1275 1275 A 12 GLU HA A 14 ALA H 1.0 . 3.70 1276 1276 A 15 LEU HG A 15 LEU H 1.0 . 3.27 1277 1277 A 15 LEU H A 15 LEU HBy 1.0 . 3.47 1278 1278 A 15 LEU H A 14 ALA HB% 1.0 . 4.36 1279 1279 A 15 LEU H A 14 ALA HB% 1.0 . 4.51 1280 1280 A 15 LEU H A 12 GLU HA 1.0 . 3.84 1281 1281 A 11 ILE HA A 15 LEU H 1.0 . 4.99 1282 1282 A 15 LEU H A 17 SER H 1.0 . 4.49 1283 1283 A 15 LEU H A 14 ALA H 1.0 . 2.89 1284 1284 A 15 LEU H A 16 SER H 1.0 . 3.27 1285 1285 A 15 LEU HBx A 16 SER H 1.0 . 3.53 1286 1286 A 15 LEU HBy A 16 SER H 1.0 . 3.00 1287 1287 A 16 SER H A 17 SER HA 1.0 . 5.08 1288 1288 A 16 SER H A 16 SER HBx 1.0 . 3.37 1289 1289 A 16 SER H A 16 SER HBy 1.0 . 3.37 1290 1290 A 14 ALA H A 16 SER H 1.0 . 4.43 1291 1291 A 16 SER H A 17 SER H 1.0 . 3.25 1292 1292 A 15 LEU HBx A 17 SER H 1.0 . 5.50 1293 1293 A 14 ALA HA A 17 SER H 1.0 . 3.90 1294 1294 A 14 ALA H A 17 SER H 1.0 . 5.12 1295 1295 A 18 CYS H A 17 SER H 1.0 . 3.12 1296 1296 A 18 CYS H A 20 ALA H 1.0 . 5.05 1297 1297 A 18 CYS H A 19 GLN H 1.0 . 3.13 1298 1298 A 18 CYS H A 16 SER H 1.0 . 5.06 1299 1299 A 18 CYS H A 14 ALA HA 1.0 . 5.07 1300 1300 A 18 CYS H A 19 GLN HA 1.0 . 5.50 1301 1301 A 18 CYS H A 18 CYS HBx 1.0 . 4.08 1302 1302 A 19 GLN H A 18 CYS HBy 1.0 . 4.79 1303 1303 A 19 GLN H A 18 CYS HBx 1.0 . 4.79 1304 1304 A 20 ALA HB% A 19 GLN H 1.0 . 5.50 1305 1305 A 20 ALA HB% A 19 GLN H 1.0 . 5.50 1306 1306 A 20 ALA HB% A 19 GLN H 1.0 . 5.50 1307 1307 A 17 SER HA A 19 GLN H 1.0 . 4.53 1308 1308 A 16 SER HA A 19 GLN H 1.0 . 4.47 1309 1309 A 19 GLN H A 17 SER HBx 1.0 . 5.50 1310 1310 A 19 GLN H A 17 SER HBy 1.0 . 5.50 1311 1311 A 20 ALA HB% A 20 ALA H 1.0 . 3.70 1312 1312 A 20 ALA HB% A 20 ALA H 1.0 . 3.91 1313 1313 A 23 SER HA A 20 ALA H 1.0 . 5.50 1314 1314 A 20 ALA H A 21 ALA H 1.0 . 4.72 1315 1315 A 20 ALA H A 19 GLN H 1.0 . 3.47 1316 1316 A 21 ALA HB% A 21 ALA H 1.0 . 3.09 1317 1317 A 20 ALA HA A 21 ALA H 1.0 . 2.93 1318 1318 A 22 ASP H A 20 ALA HA 1.0 . 5.10 1319 1319 A 22 ASP H A 23 SER HBy 1.0 . 5.26 1320 1320 A 22 ASP H A 21 ALA HA 1.0 . 3.57 1321 1321 A 22 ASP H A 23 SER HBx 1.0 . 5.26 1322 1322 A 22 ASP H A 22 ASP HBx 1.0 . 4.16 1323 1323 A 22 ASP H A 22 ASP HBy 1.0 . 4.16 1324 1324 A 22 ASP H A 24 PHE H 1.0 . 4.92 1325 1325 A 22 ASP H A 21 ALA H 1.0 . 4.54 1326 1326 A 24 PHE H A 23 SER H 1.0 . 3.44 1327 1327 A 23 SER H A 20 ALA H 1.0 . 4.82 1328 1328 A 23 SER H A 19 GLN H 1.0 . 5.50 1329 1329 A 22 ASP H A 23 SER H 1.0 . 3.46 1330 1330 A 18 CYS HA A 23 SER H 1.0 . 5.24 1331 1331 A 20 ALA HA A 23 SER H 1.0 . 5.50 1332 1332 A 23 SER H A 23 SER HBy 1.0 . 3.72 1333 1333 A 23 SER H A 23 SER HBx 1.0 . 3.72 1334 1334 A 23 SER H A 22 ASP HBx 1.0 . 5.50 1335 1335 A 23 SER H A 22 ASP HBy 1.0 . 5.50 1336 1336 A 20 ALA HB% A 23 SER H 1.0 . 5.09 1337 1337 A 20 ALA HB% A 23 SER H 1.0 . 4.94 1338 1338 A 24 PHE H A 22 ASP HA 1.0 . 4.24 1339 1339 A 24 PHE H A 19 GLN H 1.0 . 5.50 1340 1340 A 24 PHE H A 24 PHE HDx 1.0 . 5.30 1341 1341 A 24 PHE H A 24 PHE HDy 1.0 . 5.50 1342 1342 A 24 PHE HA A 25 ASN H 1.0 . 2.97 1343 1343 A 25 ASN H A 25 ASN HBx 1.0 . 3.78 1344 1344 A 25 ASN H A 25 ASN HBy 1.0 . 3.78 1345 1345 A 24 PHE HDy A 25 ASN H 1.0 . 4.20 1346 1346 A 27 LYS H A 25 ASN H 1.0 . 4.97 1347 1347 A 23 SER H A 25 ASN H 1.0 . 5.50 1348 1348 A 24 PHE H A 25 ASN H 1.0 . 4.46 1349 1349 A 77 LEU H A 76 VAL HB 1.0 . 2.73 1350 1350 A 77 LEU H A 77 LEU HBy 1.0 . 2.69 1351 1351 A 26 TYR HBx A 26 TYR H 1.0 . 3.24 1352 1352 A 77 LEU H A 77 LEU HG 1.0 . 3.56 1353 1353 A 77 LEU H A 77 LEU HBx 1.0 . 3.82 1354 1354 A 27 LYS HBy A 26 TYR H 1.0 . 4.97 1355 1355 A 77 LEU H A 76 VAL HGx% 1.0 . 3.63 1356 1356 A 77 LEU H A 77 LEU HDx% 1.0 . 4.49 1357 1357 A 77 LEU H A 77 LEU HDy% 1.0 . 5.10 1358 1358 A 77 LEU H A 77 LEU HDy% 1.0 . 5.45 1359 1359 A 27 LYS HA A 26 TYR H 1.0 . 5.50 1360 1360 A 77 LEU H A 64 GLN HA 1.0 . 3.98 1361 1361 A 77 LEU H A 76 VAL HA 1.0 . 3.26 1362 1362 A 77 LEU H A 64 GLN HGx 1.0 . 4.05 1363 1363 A 26 TYR H A 25 ASN H 1.0 . 4.63 1364 1364 A 26 TYR H A 28 SER H 1.0 . 4.69 1365 1365 A 26 TYR HDx A 26 TYR H 1.0 . 3.29 1366 1366 A 27 LYS H A 26 TYR H 1.0 . 3.56 1367 1367 A 77 LEU H A 76 VAL H 1.0 . 4.44 1368 1368 A 78 THR H A 77 LEU H 1.0 . 4.80 1369 1369 A 27 LYS H A 27 LYS HBy 1.0 . 3.24 1370 1370 A 27 LYS H A 26 TYR HDy 1.0 . 4.30 1371 1371 A 27 LYS H A 25 ASN HA 1.0 . 4.39 1372 1372 A 27 LYS H A 28 SER HA 1.0 . 5.49 1373 1373 A 27 LYS H A 29 PHE H 1.0 . 4.23 1374 1374 A 27 LYS HBx A 28 SER H 1.0 . 3.51 1375 1375 A 27 LYS HBy A 28 SER H 1.0 . 3.61 1376 1376 A 28 SER H A 29 PHE HA 1.0 . 5.50 1377 1377 A 28 SER H A 26 TYR HA 1.0 . 4.88 1378 1378 A 29 PHE HBy A 28 SER H 1.0 . 5.24 1379 1379 A 27 LYS H A 28 SER H 1.0 . 3.28 1380 1380 A 25 ASN HA A 28 SER H 1.0 . 4.97 1381 1381 A 26 TYR HA A 29 PHE H 1.0 . 4.24 1382 1382 A 29 PHE HBy A 29 PHE H 1.0 . 2.70 1383 1383 A 29 PHE HBx A 29 PHE H 1.0 . 2.76 1384 1384 A 27 LYS HBx A 29 PHE H 1.0 . 5.50 1385 1385 A 27 LYS HBy A 29 PHE H 1.0 . 5.38 1386 1386 A 29 PHE H A 28 SER HBx 1.0 . 4.62 1387 1387 A 29 PHE H A 28 SER HBy 1.0 . 4.62 1388 1388 A 32 THR H A 29 PHE H 1.0 . 5.50 1389 1389 A 25 ASN H A 29 PHE H 1.0 . 4.83 1390 1390 A 28 SER H A 29 PHE H 1.0 . 3.40 1391 1391 A 24 PHE HDy A 29 PHE H 1.0 . 5.13 1392 1392 A 29 PHE HDx A 29 PHE H 1.0 . 5.19 1393 1393 A 29 PHE HDy A 29 PHE H 1.0 . 5.50 1394 1394 A 31 SER H A 29 PHE H 1.0 . 4.44 1395 1395 A 30 PHE H A 30 PHE HBy 1.0 . 3.54 1396 1396 A 30 PHE H A 30 PHE HBx 1.0 . 3.54 1397 1397 A 29 PHE HBy A 30 PHE H 1.0 . 4.28 1398 1398 A 29 PHE HBx A 30 PHE H 1.0 . 3.55 1399 1399 A 27 LYS HBx A 30 PHE H 1.0 . 5.39 1400 1400 A 31 SER HA A 30 PHE H 1.0 . 5.33 1401 1401 A 28 SER HA A 30 PHE H 1.0 . 4.74 1402 1402 A 30 PHE H A 28 SER HBx 1.0 . 5.50 1403 1403 A 30 PHE H A 28 SER HBy 1.0 . 5.50 1404 1404 A 27 LYS HA A 30 PHE H 1.0 . 4.10 1405 1405 A 30 PHE H A 29 PHE H 1.0 . 3.61 1406 1406 A 31 SER H A 30 PHE H 1.0 . 3.48 1407 1407 A 30 PHE HDx A 30 PHE H 1.0 . 4.20 1408 1408 A 30 PHE HDy A 30 PHE H 1.0 . 4.46 1409 1409 A 28 SER H A 30 PHE H 1.0 . 4.15 1410 1410 A 29 PHE HDx A 30 PHE H 1.0 . 4.15 1411 1411 A 27 LYS H A 30 PHE H 1.0 . 5.14 1412 1412 A 31 SER H A 31 SER HBx 1.0 . 3.36 1413 1413 A 31 SER H A 31 SER HBy 1.0 . 3.36 1414 1414 A 31 SER H A 28 SER HA 1.0 . 3.92 1415 1415 A 31 SER H A 28 SER H 1.0 . 4.95 1416 1416 A 31 SER H A 29 PHE HDx 1.0 . 5.50 1417 1417 A 43 ILE H A 42 GLN HGy 1.0 . 5.30 1418 1418 A 43 ILE H A 42 GLN HGx 1.0 . 5.30 1419 1419 A 38 LYS HBx A 43 ILE H 1.0 . 4.54 1420 1420 A 43 ILE H A 43 ILE HB 1.0 . 3.04 1421 1421 A 43 ILE H A 43 ILE HG1y 1.0 . 3.82 1422 1422 A 43 ILE H A 40 PRO HA 1.0 . 4.31 1423 1423 A 32 THR H A 30 PHE HA 1.0 . 5.16 1424 1424 A 32 THR H A 28 SER HA 1.0 . 4.96 1425 1425 A 43 ILE H A 42 GLN HA 1.0 . 3.55 1426 1426 A 32 THR H A 32 THR HB 1.0 . 3.38 1427 1427 A 43 ILE H A 41 ASP H 1.0 . 2.55 1428 1428 A 31 SER H A 32 THR H 1.0 . 3.19 1429 1429 A 43 ILE H A 42 GLN H 1.0 . 3.36 1430 1430 A 32 THR H A 30 PHE H 1.0 . 4.15 1431 1431 A 32 THR H A 34 GLY H 1.0 . 5.08 1432 1432 A 43 ILE H A 43 ILE HG1x 1.0 . 2.71 1433 1433 A 33 VAL HB A 33 VAL H 1.0 . 3.15 1434 1434 A 33 VAL HGx% A 33 VAL H 1.0 . 3.26 1435 1435 A 33 VAL HGx% A 33 VAL H 1.0 . 3.54 1436 1436 A 33 VAL H A 14 ALA HB% 1.0 . 2.96 1437 1437 A 33 VAL H A 14 ALA HB% 1.0 . 3.13 1438 1438 A 41 ASP H A 42 GLN HBy 1.0 . 4.63 1439 1439 A 41 ASP H A 39 THR HA 1.0 . 4.90 1440 1440 A 33 VAL H A 32 THR HA 1.0 . 3.10 1441 1441 A 41 ASP H A 41 ASP HA 1.0 . 2.85 1442 1442 A 41 ASP H A 42 GLN H 1.0 . 3.37 1443 1443 A 33 VAL H A 34 GLY H 1.0 . 3.49 1444 1444 A 35 LEU H A 34 GLY H 1.0 . 3.40 1445 1445 A 35 LEU HA A 34 GLY H 1.0 . 5.36 1446 1446 A 32 THR HB A 34 GLY H 1.0 . 3.91 1447 1447 A 33 VAL HGx% A 34 GLY H 1.0 . 3.47 1448 1448 A 14 ALA HB% A 34 GLY H 1.0 . 5.50 1449 1449 A 14 ALA HB% A 34 GLY H 1.0 . 5.50 1450 1450 A 38 LYS HBy A 35 LEU H 1.0 . 5.31 1451 1451 A 35 LEU H A 38 LYS HGy 1.0 . 5.50 1452 1452 A 35 LEU H A 35 LEU HBy 1.0 . 2.55 1453 1453 A 33 VAL HB A 35 LEU H 1.0 . 5.05 1454 1454 A 6 LEU HDy% A 35 LEU H 1.0 . 5.48 1455 1455 A 35 LEU H A 38 LYS HGx 1.0 . 5.50 1456 1456 A 33 VAL HGx% A 35 LEU H 1.0 . 3.47 1457 1457 A 33 VAL HGx% A 35 LEU H 1.0 . 3.25 1458 1458 A 35 LEU HA A 35 LEU H 1.0 . 2.85 1459 1459 A 35 LEU H A 32 THR HB 1.0 . 5.46 1460 1460 A 35 LEU H A 33 VAL HA 1.0 . 5.50 1461 1461 A 36 SER H A 35 LEU HBy 1.0 . 4.18 1462 1462 A 36 SER H A 32 THR HG2% 1.0 . 5.50 1463 1463 A 33 VAL HGx% A 36 SER H 1.0 . 4.15 1464 1464 A 106 VAL HGx% A 36 SER H 1.0 . 4.75 1465 1465 A 106 VAL HGx% A 36 SER H 1.0 . 5.13 1466 1466 A 36 SER H A 37 SER HA 1.0 . 5.32 1467 1467 A 36 SER H A 32 THR HB 1.0 . 5.50 1468 1468 A 38 LYS HBy A 37 SER H 1.0 . 4.19 1469 1469 A 35 LEU HBx A 37 SER H 1.0 . 4.88 1470 1470 A 33 VAL HGx% A 37 SER H 1.0 . 5.26 1471 1471 A 106 VAL HGx% A 37 SER H 1.0 . 5.50 1472 1472 A 106 VAL HGx% A 37 SER H 1.0 . 5.50 1473 1473 A 43 ILE HD1% A 37 SER H 1.0 . 5.50 1474 1474 A 37 SER H A 37 SER HBy 1.0 . 4.16 1475 1475 A 37 SER H A 37 SER HBx 1.0 . 4.16 1476 1476 A 36 SER H A 37 SER H 1.0 . 3.48 1477 1477 A 43 ILE HD1% A 38 LYS H 1.0 . 4.49 1478 1478 A 106 VAL HGx% A 38 LYS H 1.0 . 5.33 1479 1479 A 38 LYS HBy A 38 LYS H 1.0 . 3.05 1480 1480 A 39 THR H A 38 LYS H 1.0 . 4.71 1481 1481 A 38 LYS HBx A 39 THR H 1.0 . 3.60 1482 1482 A 39 THR H A 38 LYS HBy 1.0 . 3.92 1483 1483 A 39 THR H A 42 GLN HBy 1.0 . 3.94 1484 1484 A 43 ILE HD1% A 39 THR H 1.0 . 5.50 1485 1485 A 43 ILE HD1% A 39 THR H 1.0 . 5.50 1486 1486 A 42 GLN H A 39 THR H 1.0 . 4.46 1487 1487 A 42 GLN H A 43 ILE HB 1.0 . 4.84 1488 1488 A 42 GLN H A 42 GLN HBy 1.0 . 2.70 1489 1489 A 42 GLN H A 39 THR HG2% 1.0 . 2.67 1490 1490 A 42 GLN H A 45 LYS HBy 1.0 . 5.50 1491 1491 A 66 PHE H A 77 LEU HBy 1.0 . 4.73 1492 1492 A 42 GLN H A 39 THR HB 1.0 . 4.86 1493 1493 A 42 GLN H A 39 THR HA 1.0 . 5.39 1494 1494 A 43 ILE HA A 42 GLN H 1.0 . 5.03 1495 1495 A 66 PHE H A 64 GLN HA 1.0 . 4.52 1496 1496 A 83 LYS H A 86 LEU HBy 1.0 . 5.50 1497 1497 A 83 LYS H A 83 LYS HBy 1.0 . 2.55 1498 1498 A 83 LYS H A 82 THR HG2% 1.0 . 5.50 1499 1499 A 83 LYS H A 82 THR HG2% 1.0 . 5.50 1500 1500 A 83 LYS H A 82 THR HB 1.0 . 3.34 1501 1501 A 80 ALA HA A 83 LYS H 1.0 . 4.15 1502 1502 A 81 GLU H A 83 LYS H 1.0 . 4.50 1503 1503 A 83 LYS H A 82 THR H 1.0 . 3.42 1504 1504 A 80 ALA H A 83 LYS H 1.0 . 3.45 1505 1505 A 83 LYS H A 85 PHE H 1.0 . 4.53 1506 1506 A 84 ALA H A 83 LYS H 1.0 . 2.70 1507 1507 A 44 LYS H A 44 LYS HBy 1.0 . 2.70 1508 1508 A 44 LYS H A 46 VAL HGy% 1.0 . 5.50 1509 1509 A 44 LYS H A 35 LEU HDy% 1.0 . 5.50 1510 1510 A 44 LYS H A 99 VAL HGx% 1.0 . 5.50 1511 1511 A 44 LYS H A 99 VAL HGx% 1.0 . 5.50 1512 1512 A 97 ILE HG1y A 90 ASP H 1.0 . 2.89 1513 1513 A 101 GLU HBy A 90 ASP H 1.0 . 5.50 1514 1514 A 91 THR HG2% A 90 ASP H 1.0 . 5.50 1515 1515 A 97 ILE HD1% A 90 ASP H 1.0 . 2.69 1516 1516 A 44 LYS HA A 44 LYS H 1.0 . 2.85 1517 1517 A 86 LEU HA A 90 ASP H 1.0 . 4.23 1518 1518 A 89 GLY HAx A 90 ASP H 1.0 . 2.70 1519 1519 A 44 LYS H A 46 VAL H 1.0 . 4.45 1520 1520 A 43 ILE H A 44 LYS H 1.0 . 2.85 1521 1521 A 44 LYS H A 45 LYS H 1.0 . 2.85 1522 1522 A 89 GLY H A 90 ASP H 1.0 . 2.85 1523 1523 A 88 ALA H A 90 ASP H 1.0 . 4.65 1524 1524 A 43 ILE HA A 45 LYS H 1.0 . 4.57 1525 1525 A 45 LYS H A 45 LYS HEx 1.0 . 5.50 1526 1526 A 45 LYS H A 45 LYS HEy 1.0 . 5.50 1527 1527 A 45 LYS HBx A 45 LYS H 1.0 . 3.67 1528 1528 A 45 LYS HBy A 45 LYS H 1.0 . 2.40 1529 1529 A 46 VAL HGy% A 45 LYS H 1.0 . 4.51 1530 1530 A 45 LYS H A 41 ASP HA 1.0 . 5.25 1531 1531 A 47 PHE H A 45 LYS H 1.0 . 4.44 1532 1532 A 43 ILE H A 45 LYS H 1.0 . 4.95 1533 1533 A 47 PHE HBy A 46 VAL H 1.0 . 5.06 1534 1534 A 42 GLN HBx A 46 VAL H 1.0 . 5.50 1535 1535 A 46 VAL H A 44 LYS HBx 1.0 . 5.50 1536 1536 A 46 VAL H A 47 PHE HBx 1.0 . 5.50 1537 1537 A 46 VAL HB A 46 VAL H 1.0 . 3.20 1538 1538 A 45 LYS HBx A 46 VAL H 1.0 . 3.95 1539 1539 A 46 VAL H A 46 VAL HGy% 1.0 . 3.07 1540 1540 A 49 ILE HD1% A 46 VAL H 1.0 . 5.39 1541 1541 A 2 ILE HD1% A 46 VAL H 1.0 . 5.50 1542 1542 A 2 ILE HD1% A 46 VAL H 1.0 . 5.50 1543 1543 A 43 ILE H A 46 VAL H 1.0 . 5.18 1544 1544 A 46 VAL H A 45 LYS H 1.0 . 3.03 1545 1545 A 102 PHE HDy A 46 VAL H 1.0 . 5.50 1546 1546 A 49 ILE HD1% A 47 PHE H 1.0 . 5.50 1547 1547 A 47 PHE H A 50 LEU HDx% 1.0 . 5.50 1548 1548 A 47 PHE H A 50 LEU HDx% 1.0 . 5.50 1549 1549 A 47 PHE H A 99 VAL HGx% 1.0 . 5.50 1550 1550 A 47 PHE H A 99 VAL HGx% 1.0 . 5.50 1551 1551 A 47 PHE H A 44 LYS HBx 1.0 . 5.50 1552 1552 A 47 PHE H A 44 LYS HBy 1.0 . 5.50 1553 1553 A 47 PHE H A 45 LYS HA 1.0 . 4.73 1554 1554 A 44 LYS HA A 47 PHE H 1.0 . 3.76 1555 1555 A 47 PHE H A 46 VAL H 1.0 . 2.72 1556 1556 A 102 PHE HEy A 47 PHE H 1.0 . 4.04 1557 1557 A 102 PHE HDy A 47 PHE H 1.0 . 4.50 1558 1558 A 47 PHE H A 47 PHE HDx 1.0 . 4.55 1559 1559 A 47 PHE H A 48 GLY H 1.0 . 2.70 1560 1560 A 90 ASP HBx A 89 GLY H 1.0 . 4.56 1561 1561 A 89 GLY H A 105 LEU HBy 1.0 . 4.90 1562 1562 A 85 PHE HBy A 89 GLY H 1.0 . 5.50 1563 1563 A 89 GLY H A 105 LEU HG 1.0 . 5.50 1564 1564 A 89 GLY H A 87 ALA HB% 1.0 . 5.50 1565 1565 A 88 ALA HB% A 89 GLY H 1.0 . 3.44 1566 1566 A 91 THR HG2% A 89 GLY H 1.0 . 5.50 1567 1567 A 89 GLY H A 87 ALA HA 1.0 . 4.45 1568 1568 A 85 PHE HDy A 89 GLY H 1.0 . 5.50 1569 1569 A 89 GLY H A 87 ALA H 1.0 . 4.63 1570 1570 A 49 ILE HB A 49 ILE H 1.0 . 3.14 1571 1571 A 49 ILE HG1y A 49 ILE H 1.0 . 3.55 1572 1572 A 49 ILE HD1% A 49 ILE H 1.0 . 4.83 1573 1573 A 50 LEU HDy% A 49 ILE H 1.0 . 4.02 1574 1574 A 45 LYS HA A 49 ILE H 1.0 . 5.50 1575 1575 A 47 PHE HBy A 49 ILE H 1.0 . 5.38 1576 1576 A 47 PHE H A 49 ILE H 1.0 . 4.94 1577 1577 A 51 ASP H A 49 ILE H 1.0 . 4.77 1578 1578 A 50 LEU H A 47 PHE HA 1.0 . 4.05 1579 1579 A 50 LEU HG A 50 LEU H 1.0 . 2.55 1580 1580 A 50 LEU H A 49 ILE HG1x 1.0 . 4.49 1581 1581 A 50 LEU HBy A 50 LEU H 1.0 . 3.38 1582 1582 A 50 LEU HBx A 50 LEU H 1.0 . 3.64 1583 1583 A 50 LEU HDy% A 50 LEU H 1.0 . 4.11 1584 1584 A 58 ILE HD1% A 50 LEU H 1.0 . 5.50 1585 1585 A 58 ILE HD1% A 50 LEU H 1.0 . 5.50 1586 1586 A 58 ILE HD1% A 50 LEU H 1.0 . 5.50 1587 1587 A 50 LEU H A 48 GLY HAx 1.0 . 4.73 1588 1588 A 51 ASP H A 50 LEU HBx 1.0 . 4.05 1589 1589 A 51 ASP H A 50 LEU HDx% 1.0 . 4.40 1590 1590 A 51 ASP H A 50 LEU HDy% 1.0 . 5.49 1591 1591 A 51 ASP H A 50 LEU HDy% 1.0 . 5.50 1592 1592 A 51 ASP H A 50 LEU HBy 1.0 . 2.40 1593 1593 A 51 ASP H A 48 GLY HAx 1.0 . 4.15 1594 1594 A 51 ASP H A 47 PHE HA 1.0 . 5.22 1595 1595 A 49 ILE HA A 51 ASP H 1.0 . 5.50 1596 1596 A 51 ASP H A 51 ASP HA 1.0 . 2.85 1597 1597 A 51 ASP H A 50 LEU H 1.0 . 3.50 1598 1598 A 51 ASP H A 47 PHE HDy 1.0 . 5.50 1599 1599 A 53 ASP H A 54 LYS HA 1.0 . 4.63 1600 1600 A 53 ASP H A 53 ASP HBy 1.0 . 3.80 1601 1601 A 53 ASP H A 53 ASP HBx 1.0 . 3.80 1602 1602 A 53 ASP H A 52 GLN HBx 1.0 . 4.09 1603 1603 A 53 ASP H A 55 SER H 1.0 . 4.59 1604 1604 A 53 ASP H A 54 LYS H 1.0 . 3.24 1605 1605 A 56 GLY H A 54 LYS H 1.0 . 4.80 1606 1606 A 55 SER H A 54 LYS H 1.0 . 3.46 1607 1607 A 54 LYS H A 55 SER HA 1.0 . 5.47 1608 1608 A 56 GLY H A 55 SER H 1.0 . 3.55 1609 1609 A 56 GLY H A 57 PHE H 1.0 . 3.29 1610 1610 A 55 SER H A 57 PHE H 1.0 . 5.17 1611 1611 A 57 PHE H A 57 PHE HEy 1.0 . 5.47 1612 1612 A 57 PHE HDy A 57 PHE H 1.0 . 3.66 1613 1613 A 54 LYS HA A 57 PHE H 1.0 . 5.50 1614 1614 A 57 PHE HBx A 57 PHE H 1.0 . 3.39 1615 1615 A 55 SER HA A 57 PHE H 1.0 . 5.50 1616 1616 A 58 ILE HA A 57 PHE H 1.0 . 5.50 1617 1617 A 58 ILE H A 57 PHE HBy 1.0 . 3.63 1618 1618 A 58 ILE H A 97 ILE HB 1.0 . 4.38 1619 1619 A 58 ILE H A 58 ILE HB 1.0 . 3.53 1620 1620 A 58 ILE H A 58 ILE HG1x 1.0 . 3.70 1621 1621 A 58 ILE H A 58 ILE HG2% 1.0 . 5.28 1622 1622 A 58 ILE H A 58 ILE HG2% 1.0 . 5.50 1623 1623 A 58 ILE H A 58 ILE HG2% 1.0 . 5.50 1624 1624 A 58 ILE H A 97 ILE H 1.0 . 3.89 1625 1625 A 58 ILE H A 57 PHE H 1.0 . 4.88 1626 1626 A 58 ILE HG1x A 59 GLU H 1.0 . 5.29 1627 1627 A 59 GLU H A 96 LYS HA 1.0 . 5.39 1628 1628 A 60 GLU H A 59 GLU HBy 1.0 . 3.46 1629 1629 A 60 GLU H A 59 GLU HBx 1.0 . 3.46 1630 1630 A 63 LEU HBx A 60 GLU H 1.0 . 5.50 1631 1631 A 63 LEU HBy A 60 GLU H 1.0 . 4.55 1632 1632 A 60 GLU H A 96 LYS HA 1.0 . 4.63 1633 1633 A 60 GLU H A 61 GLU HA 1.0 . 5.34 1634 1634 A 61 GLU H A 60 GLU H 1.0 . 3.97 1635 1635 A 58 ILE HG2% A 62 GLU H 1.0 . 5.07 1636 1636 A 58 ILE HG2% A 62 GLU H 1.0 . 5.50 1637 1637 A 58 ILE HG2% A 62 GLU H 1.0 . 5.50 1638 1638 A 62 GLU HBy A 62 GLU H 1.0 . 2.60 1639 1639 A 62 GLU H A 61 GLU HBx 1.0 . 2.55 1640 1640 A 63 LEU HBx A 62 GLU H 1.0 . 5.46 1641 1641 A 63 LEU HBy A 62 GLU H 1.0 . 4.38 1642 1642 A 60 GLU HA A 62 GLU H 1.0 . 4.96 1643 1643 A 63 LEU HA A 62 GLU H 1.0 . 5.19 1644 1644 A 60 GLU H A 62 GLU H 1.0 . 5.08 1645 1645 A 61 GLU H A 62 GLU H 1.0 . 3.57 1646 1646 A 63 LEU H A 62 GLU H 1.0 . 3.29 1647 1647 A 63 LEU H A 62 GLU HBy 1.0 . 3.72 1648 1648 A 63 LEU H A 60 GLU HGy 1.0 . 5.43 1649 1649 A 64 GLN HBy A 63 LEU H 1.0 . 5.50 1650 1650 A 65 LEU HG A 63 LEU H 1.0 . 5.20 1651 1651 A 63 LEU HBx A 63 LEU H 1.0 . 3.39 1652 1652 A 63 LEU HBy A 63 LEU H 1.0 . 3.26 1653 1653 A 82 THR HG2% A 63 LEU H 1.0 . 5.50 1654 1654 A 82 THR HG2% A 63 LEU H 1.0 . 5.50 1655 1655 A 58 ILE HG2% A 63 LEU H 1.0 . 4.30 1656 1656 A 58 ILE HG2% A 63 LEU H 1.0 . 4.79 1657 1657 A 58 ILE HG2% A 63 LEU H 1.0 . 4.97 1658 1658 A 63 LEU H A 63 LEU HDx% 1.0 . 4.17 1659 1659 A 63 LEU H A 62 GLU HBx 1.0 . 4.00 1660 1660 A 63 LEU H A 64 GLN HA 1.0 . 5.41 1661 1661 A 60 GLU HA A 63 LEU H 1.0 . 4.08 1662 1662 A 63 LEU H A 61 GLU H 1.0 . 4.90 1663 1663 A 64 GLN H A 63 LEU H 1.0 . 3.53 1664 1664 A 68 LYS HA A 70 PHE H 1.0 . 3.95 1665 1665 A 70 PHE H A 71 SER HA 1.0 . 4.90 1666 1666 A 67 LEU HA A 70 PHE H 1.0 . 3.94 1667 1667 A 66 PHE HA A 70 PHE H 1.0 . 5.50 1668 1668 A 70 PHE HBy A 70 PHE H 1.0 . 3.15 1669 1669 A 71 SER H A 70 PHE H 1.0 . 3.03 1670 1670 A 70 PHE HDy A 70 PHE H 1.0 . 3.24 1671 1671 A 65 LEU HG A 65 LEU H 1.0 . 2.54 1672 1672 A 64 GLN HGy A 65 LEU H 1.0 . 3.29 1673 1673 A 65 LEU H A 64 GLN HBy 1.0 . 4.18 1674 1674 A 65 LEU H A 62 GLU HBx 1.0 . 4.99 1675 1675 A 65 LEU H A 77 LEU HBy 1.0 . 5.43 1676 1676 A 65 LEU H A 63 LEU HA 1.0 . 3.91 1677 1677 A 65 LEU H A 63 LEU H 1.0 . 5.07 1678 1678 A 77 LEU H A 65 LEU H 1.0 . 5.50 1679 1679 A 65 LEU H A 64 GLN H 1.0 . 3.20 1680 1680 A 66 PHE H A 77 LEU HDx% 1.0 . 4.58 1681 1681 A 66 PHE H A 77 LEU HDx% 1.0 . 4.82 1682 1682 A 77 LEU HDy% A 66 PHE H 1.0 . 4.88 1683 1683 A 77 LEU HDy% A 66 PHE H 1.0 . 5.37 1684 1684 A 66 PHE H A 77 LEU HBx 1.0 . 5.48 1685 1685 A 66 PHE H A 66 PHE HBy 1.0 . 2.55 1686 1686 A 67 LEU H A 66 PHE H 1.0 . 4.05 1687 1687 A 65 LEU H A 66 PHE H 1.0 . 3.04 1688 1688 A 66 PHE H A 69 ASN H 1.0 . 5.50 1689 1689 A 66 PHE HDy A 66 PHE H 1.0 . 4.65 1690 1690 A 67 LEU H A 66 PHE HBy 1.0 . 3.91 1691 1691 A 67 LEU H A 67 LEU HBy 1.0 . 4.00 1692 1692 A 67 LEU H A 77 LEU HG 1.0 . 4.54 1693 1693 A 67 LEU H A 67 LEU HG 1.0 . 3.47 1694 1694 A 67 LEU H A 67 LEU HBx 1.0 . 4.00 1695 1695 A 68 LYS HGx A 67 LEU H 1.0 . 4.27 1696 1696 A 76 VAL HGx% A 67 LEU H 1.0 . 5.50 1697 1697 A 67 LEU H A 67 LEU HDx% 1.0 . 4.71 1698 1698 A 67 LEU H A 67 LEU HDx% 1.0 . 5.20 1699 1699 A 67 LEU H A 77 LEU HDx% 1.0 . 5.42 1700 1700 A 67 LEU H A 77 LEU HDy% 1.0 . 4.72 1701 1701 A 67 LEU H A 77 LEU HDy% 1.0 . 5.33 1702 1702 A 67 LEU H A 68 LYS HA 1.0 . 5.50 1703 1703 A 65 LEU HA A 67 LEU H 1.0 . 4.70 1704 1704 A 67 LEU H A 76 VAL HA 1.0 . 5.50 1705 1705 A 67 LEU H A 66 PHE HDy 1.0 . 4.21 1706 1706 A 67 LEU H A 65 LEU H 1.0 . 5.50 1707 1707 A 67 LEU H A 70 PHE HDy 1.0 . 5.50 1708 1708 A 68 LYS H A 65 LEU HBy 1.0 . 4.19 1709 1709 A 68 LYS H A 68 LYS HDy 1.0 . 5.50 1710 1710 A 68 LYS H A 68 LYS HDx 1.0 . 5.50 1711 1711 A 68 LYS HGx A 68 LYS H 1.0 . 2.40 1712 1712 A 67 LEU HG A 68 LYS H 1.0 . 5.12 1713 1713 A 65 LEU HA A 68 LYS H 1.0 . 4.08 1714 1714 A 68 LYS H A 69 ASN HA 1.0 . 5.50 1715 1715 A 68 LYS H A 76 VAL HA 1.0 . 5.50 1716 1716 A 68 LYS H A 66 PHE HA 1.0 . 4.49 1717 1717 A 66 PHE HDy A 68 LYS H 1.0 . 5.50 1718 1718 A 67 LEU H A 68 LYS H 1.0 . 3.45 1719 1719 A 70 PHE HBy A 69 ASN H 1.0 . 4.78 1720 1720 A 69 ASN H A 69 ASN HBy 1.0 . 3.57 1721 1721 A 69 ASN H A 69 ASN HBx 1.0 . 3.57 1722 1722 A 68 LYS HGx A 69 ASN H 1.0 . 4.52 1723 1723 A 50 LEU HBx A 69 ASN H 1.0 . 5.50 1724 1724 A 50 LEU HDy% A 69 ASN H 1.0 . 5.08 1725 1725 A 70 PHE HA A 69 ASN H 1.0 . 5.20 1726 1726 A 67 LEU HA A 69 ASN H 1.0 . 4.50 1727 1727 A 71 SER H A 69 ASN H 1.0 . 4.38 1728 1728 A 70 PHE H A 69 ASN H 1.0 . 3.24 1729 1729 A 68 LYS H A 69 ASN H 1.0 . 3.32 1730 1730 A 70 PHE HDy A 69 ASN H 1.0 . 3.60 1731 1731 A 67 LEU H A 69 ASN H 1.0 . 4.78 1732 1732 A 71 SER H A 71 SER HBx 1.0 . 3.99 1733 1733 A 70 PHE HBy A 71 SER H 1.0 . 3.40 1734 1734 A 71 SER H A 74 ALA HB% 1.0 . 4.65 1735 1735 A 15 LEU HDy% A 71 SER H 1.0 . 5.50 1736 1736 A 15 LEU HDx% A 71 SER H 1.0 . 4.14 1737 1737 A 68 LYS HA A 71 SER H 1.0 . 3.83 1738 1738 A 71 SER H A 72 SER HA 1.0 . 5.01 1739 1739 A 70 PHE HDy A 71 SER H 1.0 . 4.34 1740 1740 A 72 SER H A 71 SER H 1.0 . 4.51 1741 1741 A 72 SER H A 68 LYS HA 1.0 . 5.50 1742 1742 A 72 SER H A 71 SER HA 1.0 . 3.39 1743 1743 A 74 ALA HB% A 73 SER H 1.0 . 4.63 1744 1744 A 73 SER H A 73 SER HBy 1.0 . 3.00 1745 1745 A 73 SER H A 73 SER HBx 1.0 . 3.00 1746 1746 A 68 LYS HA A 73 SER H 1.0 . 5.50 1747 1747 A 72 SER H A 73 SER H 1.0 . 3.97 1748 1748 A 72 SER H A 74 ALA H 1.0 . 4.90 1749 1749 A 75 ARG H A 74 ALA H 1.0 . 4.58 1750 1750 A 73 SER H A 74 ALA H 1.0 . 2.70 1751 1751 A 71 SER H A 74 ALA H 1.0 . 5.28 1752 1752 A 74 ALA HB% A 74 ALA H 1.0 . 3.08 1753 1753 A 75 ARG H A 75 ARG HDy 1.0 . 4.65 1754 1754 A 75 ARG H A 75 ARG HDx 1.0 . 4.65 1755 1755 A 75 ARG H A 75 ARG HBy 1.0 . 3.62 1756 1756 A 75 ARG H A 75 ARG HBx 1.0 . 3.62 1757 1757 A 76 VAL HGy% A 76 VAL H 1.0 . 3.57 1758 1758 A 76 VAL HGy% A 76 VAL H 1.0 . 3.86 1759 1759 A 76 VAL H A 67 LEU HDx% 1.0 . 5.22 1760 1760 A 76 VAL H A 75 ARG HDy 1.0 . 5.09 1761 1761 A 76 VAL H A 75 ARG HDx 1.0 . 5.09 1762 1762 A 76 VAL H A 74 ALA HA 1.0 . 4.90 1763 1763 A 76 VAL H A 75 ARG H 1.0 . 4.48 1764 1764 A 78 THR H A 81 GLU HBy 1.0 . 3.67 1765 1765 A 78 THR H A 81 GLU HGx 1.0 . 4.76 1766 1766 A 78 THR H A 77 LEU HBy 1.0 . 3.85 1767 1767 A 78 THR H A 77 LEU HBx 1.0 . 3.73 1768 1768 A 78 THR H A 77 LEU HDy% 1.0 . 4.33 1769 1769 A 78 THR H A 77 LEU HDy% 1.0 . 4.61 1770 1770 A 78 THR H A 81 GLU HGy 1.0 . 4.28 1771 1771 A 78 THR H A 77 LEU HG 1.0 . 4.84 1772 1772 A 78 THR H A 77 LEU HA 1.0 . 3.29 1773 1773 A 78 THR H A 79 SER HA 1.0 . 5.50 1774 1774 A 78 THR H A 64 GLN HA 1.0 . 5.50 1775 1775 A 78 THR H A 79 SER H 1.0 . 4.79 1776 1776 A 78 THR H A 81 GLU H 1.0 . 3.92 1777 1777 A 78 THR H A 82 THR H 1.0 . 4.53 1778 1778 A 78 THR HG2% A 79 SER H 1.0 . 4.88 1779 1779 A 78 THR HG2% A 79 SER H 1.0 . 4.87 1780 1780 A 78 THR HA A 79 SER H 1.0 . 3.57 1781 1781 A 80 ALA H A 81 GLU HGy 1.0 . 4.56 1782 1782 A 80 ALA H A 81 GLU HBy 1.0 . 5.06 1783 1783 A 80 ALA H A 83 LYS HBy 1.0 . 4.60 1784 1784 A 80 ALA H A 77 LEU HBx 1.0 . 5.27 1785 1785 A 80 ALA H A 78 THR HA 1.0 . 4.78 1786 1786 A 80 ALA H A 79 SER H 1.0 . 3.74 1787 1787 A 80 ALA H A 82 THR H 1.0 . 3.67 1788 1788 A 80 ALA H A 81 GLU H 1.0 . 3.43 1789 1789 A 80 ALA H A 84 ALA H 1.0 . 4.83 1790 1790 A 81 GLU H A 77 LEU HDx% 1.0 . 5.29 1791 1791 A 81 GLU H A 77 LEU HBx 1.0 . 4.46 1792 1792 A 81 GLU H A 81 GLU HBx 1.0 . 3.64 1793 1793 A 81 GLU H A 77 LEU HA 1.0 . 5.50 1794 1794 A 81 GLU H A 78 THR HB 1.0 . 4.87 1795 1795 A 81 GLU H A 78 THR HA 1.0 . 5.00 1796 1796 A 81 GLU H A 82 THR HA 1.0 . 5.50 1797 1797 A 81 GLU H A 81 GLU HGy 1.0 . 3.57 1798 1798 A 81 GLU H A 81 GLU HBy 1.0 . 3.62 1799 1799 A 81 GLU H A 79 SER H 1.0 . 4.80 1800 1800 A 81 GLU H A 82 THR H 1.0 . 3.53 1801 1801 A 81 GLU HGy A 82 THR H 1.0 . 4.44 1802 1802 A 81 GLU HBy A 82 THR H 1.0 . 3.83 1803 1803 A 81 GLU HGx A 82 THR H 1.0 . 4.88 1804 1804 A 81 GLU HBx A 82 THR H 1.0 . 3.99 1805 1805 A 77 LEU HBx A 82 THR H 1.0 . 4.19 1806 1806 A 80 ALA HB% A 82 THR H 1.0 . 5.50 1807 1807 A 80 ALA HB% A 82 THR H 1.0 . 5.50 1808 1808 A 82 THR HG2% A 82 THR H 1.0 . 5.08 1809 1809 A 82 THR HG2% A 82 THR H 1.0 . 5.50 1810 1810 A 77 LEU HDx% A 82 THR H 1.0 . 4.69 1811 1811 A 77 LEU HDy% A 82 THR H 1.0 . 5.40 1812 1812 A 77 LEU HDy% A 82 THR H 1.0 . 5.50 1813 1813 A 77 LEU HA A 82 THR H 1.0 . 5.44 1814 1814 A 83 LYS HA A 82 THR H 1.0 . 5.50 1815 1815 A 85 PHE HBx A 82 THR H 1.0 . 5.50 1816 1816 A 85 PHE HBy A 82 THR H 1.0 . 5.50 1817 1817 A 84 ALA H A 82 THR HA 1.0 . 5.23 1818 1818 A 84 ALA H A 85 PHE HBx 1.0 . 4.83 1819 1819 A 84 ALA H A 84 ALA HB% 1.0 . 2.96 1820 1820 A 84 ALA H A 85 PHE HA 1.0 . 5.40 1821 1821 A 84 ALA H A 85 PHE H 1.0 . 3.13 1822 1822 A 84 ALA H A 87 ALA H 1.0 . 5.15 1823 1823 A 84 ALA H A 82 THR H 1.0 . 4.52 1824 1824 A 83 LYS HBy A 85 PHE H 1.0 . 4.75 1825 1825 A 86 LEU HBx A 85 PHE H 1.0 . 4.74 1826 1826 A 84 ALA HB% A 85 PHE H 1.0 . 3.37 1827 1827 A 87 ALA HB% A 85 PHE H 1.0 . 5.27 1828 1828 A 86 LEU HBy A 85 PHE H 1.0 . 5.02 1829 1829 A 88 ALA HB% A 85 PHE H 1.0 . 5.50 1830 1830 A 77 LEU HDx% A 85 PHE H 1.0 . 5.50 1831 1831 A 82 THR HG2% A 85 PHE H 1.0 . 5.50 1832 1832 A 83 LYS HA A 85 PHE H 1.0 . 4.39 1833 1833 A 85 PHE HBx A 85 PHE H 1.0 . 3.01 1834 1834 A 85 PHE HBy A 85 PHE H 1.0 . 3.31 1835 1835 A 85 PHE HDx A 85 PHE H 1.0 . 5.03 1836 1836 A 85 PHE HDy A 85 PHE H 1.0 . 5.50 1837 1837 A 87 ALA H A 85 PHE H 1.0 . 4.05 1838 1838 A 86 LEU H A 86 LEU HBy 1.0 . 3.29 1839 1839 A 86 LEU H A 82 THR HG2% 1.0 . 5.30 1840 1840 A 86 LEU H A 82 THR HG2% 1.0 . 5.50 1841 1841 A 86 LEU H A 86 LEU HDx% 1.0 . 4.86 1842 1842 A 86 LEU H A 63 LEU HDy% 1.0 . 4.43 1843 1843 A 86 LEU H A 63 LEU HDy% 1.0 . 5.01 1844 1844 A 86 LEU H A 84 ALA HA 1.0 . 5.07 1845 1845 A 86 LEU H A 87 ALA HA 1.0 . 5.50 1846 1846 A 86 LEU H A 83 LYS HA 1.0 . 4.11 1847 1847 A 86 LEU H A 87 ALA H 1.0 . 2.85 1848 1848 A 86 LEU H A 85 PHE H 1.0 . 2.73 1849 1849 A 86 LEU H A 84 ALA H 1.0 . 4.93 1850 1850 A 86 LEU H A 89 GLY H 1.0 . 5.34 1851 1851 A 86 LEU H A 88 ALA H 1.0 . 5.08 1852 1852 A 86 LEU H A 85 PHE HDy 1.0 . 4.83 1853 1853 A 83 LYS HBy A 87 ALA H 1.0 . 5.50 1854 1854 A 86 LEU HBx A 87 ALA H 1.0 . 2.55 1855 1855 A 87 ALA H A 87 ALA HB% 1.0 . 3.00 1856 1856 A 87 ALA H A 87 ALA HB% 1.0 . 3.15 1857 1857 A 86 LEU HDx% A 87 ALA H 1.0 . 5.50 1858 1858 A 86 LEU HDx% A 87 ALA H 1.0 . 5.50 1859 1859 A 86 LEU HDy% A 87 ALA H 1.0 . 5.21 1860 1860 A 87 ALA H A 84 ALA HA 1.0 . 4.45 1861 1861 A 83 LYS HA A 87 ALA H 1.0 . 3.51 1862 1862 A 88 ALA H A 105 LEU HDx% 1.0 . 4.27 1863 1863 A 88 ALA H A 88 ALA HB% 1.0 . 3.06 1864 1864 A 88 ALA H A 88 ALA HB% 1.0 . 3.22 1865 1865 A 88 ALA H A 83 LYS HA 1.0 . 5.50 1866 1866 A 88 ALA H A 86 LEU HA 1.0 . 4.82 1867 1867 A 88 ALA H A 85 PHE HA 1.0 . 4.11 1868 1868 A 89 GLY HAy A 88 ALA H 1.0 . 5.05 1869 1869 A 88 ALA H A 89 GLY H 1.0 . 2.40 1870 1870 A 88 ALA H A 87 ALA H 1.0 . 3.48 1871 1871 A 88 ALA H A 85 PHE H 1.0 . 4.44 1872 1872 A 90 ASP HBx A 91 THR H 1.0 . 4.79 1873 1873 A 91 THR H A 101 GLU HGy 1.0 . 4.48 1874 1874 A 101 GLU HBy A 91 THR H 1.0 . 4.13 1875 1875 A 91 THR H A 101 GLU HGx 1.0 . 4.48 1876 1876 A 90 ASP HBy A 91 THR H 1.0 . 4.49 1877 1877 A 91 THR HG2% A 91 THR H 1.0 . 3.67 1878 1878 A 97 ILE HG2% A 91 THR H 1.0 . 5.31 1879 1879 A 90 ASP HA A 91 THR H 1.0 . 3.23 1880 1880 A 92 ASP HA A 91 THR H 1.0 . 4.78 1881 1881 A 91 THR HB A 91 THR H 1.0 . 3.96 1882 1882 A 101 GLU HA A 91 THR H 1.0 . 5.07 1883 1883 A 90 ASP H A 91 THR H 1.0 . 4.74 1884 1884 A 91 THR H A 93 GLY H 1.0 . 4.66 1885 1885 A 91 THR HG2% A 92 ASP H 1.0 . 5.39 1886 1886 A 91 THR HG2% A 92 ASP H 1.0 . 5.50 1887 1887 A 91 THR HG2% A 92 ASP H 1.0 . 5.50 1888 1888 A 101 GLU HA A 92 ASP H 1.0 . 5.37 1889 1889 A 90 ASP HA A 92 ASP H 1.0 . 3.98 1890 1890 A 91 THR HB A 92 ASP H 1.0 . 4.05 1891 1891 A 90 ASP HA A 93 GLY H 1.0 . 4.68 1892 1892 A 91 THR HB A 93 GLY H 1.0 . 5.50 1893 1893 A 91 THR HA A 93 GLY H 1.0 . 4.69 1894 1894 A 93 GLY H A 92 ASP H 1.0 . 3.06 1895 1895 A 90 ASP HBx A 96 LYS H 1.0 . 5.50 1896 1896 A 96 LYS H A 96 LYS HBy 1.0 . 4.09 1897 1897 A 96 LYS H A 96 LYS HBx 1.0 . 4.09 1898 1898 A 96 LYS H A 94 ASP HA 1.0 . 5.11 1899 1899 A 57 PHE HBy A 97 ILE H 1.0 . 4.08 1900 1900 A 97 ILE H A 96 LYS HBy 1.0 . 3.71 1901 1901 A 97 ILE H A 96 LYS HBx 1.0 . 3.71 1902 1902 A 97 ILE HG2% A 97 ILE H 1.0 . 4.50 1903 1903 A 97 ILE H A 63 LEU HDx% 1.0 . 5.45 1904 1904 A 97 ILE H A 63 LEU HDx% 1.0 . 5.50 1905 1905 A 97 ILE H A 57 PHE HA 1.0 . 4.85 1906 1906 A 97 ILE H A 96 LYS HA 1.0 . 3.26 1907 1907 A 97 ILE H A 96 LYS H 1.0 . 5.03 1908 1908 A 97 ILE H A 57 PHE HDx 1.0 . 5.09 1909 1909 A 57 PHE HBy A 98 GLY H 1.0 . 5.28 1910 1910 A 101 GLU HBx A 98 GLY H 1.0 . 3.47 1911 1911 A 97 ILE HB A 98 GLY H 1.0 . 4.91 1912 1912 A 97 ILE HG1x A 98 GLY H 1.0 . 5.19 1913 1913 A 97 ILE HG2% A 98 GLY H 1.0 . 4.27 1914 1914 A 97 ILE HG2% A 98 GLY H 1.0 . 4.48 1915 1915 A 98 GLY H A 97 ILE HA 1.0 . 3.17 1916 1916 A 101 GLU HA A 98 GLY H 1.0 . 5.50 1917 1917 A 98 GLY H A 57 PHE HDx 1.0 . 4.55 1918 1918 A 97 ILE HG2% A 99 VAL H 1.0 . 5.50 1919 1919 A 97 ILE HG2% A 99 VAL H 1.0 . 5.50 1920 1920 A 99 VAL HGy% A 99 VAL H 1.0 . 3.84 1921 1921 A 99 VAL HGy% A 99 VAL H 1.0 . 4.07 1922 1922 A 99 VAL H A 99 VAL HGx% 1.0 . 5.36 1923 1923 A 100 GLU HBx A 99 VAL H 1.0 . 4.69 1924 1924 A 99 VAL H A 98 GLY HAx 1.0 . 3.36 1925 1925 A 99 VAL H A 98 GLY HAy 1.0 . 3.53 1926 1926 A 47 PHE HEx A 99 VAL H 1.0 . 4.31 1927 1927 A 100 GLU H A 99 VAL H 1.0 . 3.25 1928 1928 A 99 VAL H A 98 GLY H 1.0 . 4.42 1929 1929 A 100 GLU H A 99 VAL HB 1.0 . 4.17 1930 1930 A 100 GLU H A 99 VAL HGx% 1.0 . 5.50 1931 1931 A 100 GLU H A 99 VAL HGx% 1.0 . 5.50 1932 1932 A 100 GLU H A 98 GLY HAy 1.0 . 5.25 1933 1933 A 100 GLU H A 102 PHE H 1.0 . 4.36 1934 1934 A 102 PHE HBx A 101 GLU H 1.0 . 5.27 1935 1935 A 102 PHE HBy A 101 GLU H 1.0 . 5.50 1936 1936 A 101 GLU H A 101 GLU HGy 1.0 . 3.86 1937 1937 A 101 GLU HBx A 101 GLU H 1.0 . 3.08 1938 1938 A 101 GLU H A 101 GLU HGx 1.0 . 3.86 1939 1939 A 103 GLN HGx A 101 GLU H 1.0 . 5.16 1940 1940 A 100 GLU HBx A 101 GLU H 1.0 . 3.41 1941 1941 A 99 VAL HB A 101 GLU H 1.0 . 5.50 1942 1942 A 97 ILE HG2% A 101 GLU H 1.0 . 4.19 1943 1943 A 99 VAL HGy% A 101 GLU H 1.0 . 5.50 1944 1944 A 99 VAL HGy% A 101 GLU H 1.0 . 5.50 1945 1945 A 97 ILE HA A 101 GLU H 1.0 . 5.33 1946 1946 A 98 GLY H A 101 GLU H 1.0 . 4.32 1947 1947 A 91 THR H A 101 GLU H 1.0 . 5.50 1948 1948 A 100 GLU H A 101 GLU H 1.0 . 3.28 1949 1949 A 99 VAL H A 101 GLU H 1.0 . 3.81 1950 1950 A 101 GLU HBx A 102 PHE H 1.0 . 3.34 1951 1951 A 103 GLN HGx A 102 PHE H 1.0 . 4.50 1952 1952 A 103 GLN HBy A 102 PHE H 1.0 . 5.50 1953 1953 A 100 GLU HBx A 102 PHE H 1.0 . 5.50 1954 1954 A 102 PHE H A 100 GLU HBy 1.0 . 5.50 1955 1955 A 97 ILE HG2% A 102 PHE H 1.0 . 4.09 1956 1956 A 97 ILE HG2% A 102 PHE H 1.0 . 4.29 1957 1957 A 99 VAL HGx% A 102 PHE H 1.0 . 5.50 1958 1958 A 102 PHE H A 104 SER HBx 1.0 . 5.50 1959 1959 A 102 PHE H A 104 SER HBy 1.0 . 5.50 1960 1960 A 102 PHE H A 103 GLN H 1.0 . 3.60 1961 1961 A 99 VAL H A 102 PHE H 1.0 . 4.91 1962 1962 A 102 PHE H A 101 GLU H 1.0 . 3.56 1963 1963 A 102 PHE H A 105 LEU H 1.0 . 5.36 1964 1964 A 102 PHE HDx A 102 PHE H 1.0 . 5.41 1965 1965 A 102 PHE HDy A 102 PHE H 1.0 . 5.50 1966 1966 A 98 GLY H A 102 PHE H 1.0 . 5.09 1967 1967 A 106 VAL HB A 103 GLN H 1.0 . 5.50 1968 1968 A 43 ILE HG2% A 103 GLN H 1.0 . 5.34 1969 1969 A 43 ILE HG2% A 103 GLN H 1.0 . 5.50 1970 1970 A 43 ILE HD1% A 103 GLN H 1.0 . 5.50 1971 1971 A 99 VAL HGx% A 103 GLN H 1.0 . 5.42 1972 1972 A 103 GLN HGy A 103 GLN H 1.0 . 3.10 1973 1973 A 103 GLN HGx A 103 GLN H 1.0 . 2.93 1974 1974 A 103 GLN HBy A 103 GLN H 1.0 . 2.83 1975 1975 A 100 GLU HA A 103 GLN H 1.0 . 4.16 1976 1976 A 44 LYS HA A 103 GLN H 1.0 . 5.41 1977 1977 A 47 PHE HBy A 103 GLN H 1.0 . 5.50 1978 1978 A 103 GLN H A 101 GLU H 1.0 . 4.81 1979 1979 A 102 PHE HDy A 103 GLN H 1.0 . 4.07 1980 1980 A 102 PHE HBy A 104 SER H 1.0 . 5.02 1981 1981 A 104 SER H A 103 GLN HGy 1.0 . 2.74 1982 1982 A 103 GLN HGx A 104 SER H 1.0 . 3.49 1983 1983 A 104 SER H A 103 GLN HBy 1.0 . 4.40 1984 1984 A 104 SER H A 105 LEU HBy 1.0 . 5.50 1985 1985 A 104 SER H A 106 VAL HB 1.0 . 5.50 1986 1986 A 104 SER H A 104 SER HA 1.0 . 2.92 1987 1987 A 104 SER H A 104 SER HBx 1.0 . 3.48 1988 1988 A 104 SER H A 104 SER HBy 1.0 . 3.48 1989 1989 A 106 VAL H A 104 SER H 1.0 . 4.47 1990 1990 A 102 PHE HDy A 104 SER H 1.0 . 5.50 1991 1991 A 104 SER H A 103 GLN H 1.0 . 3.53 1992 1992 A 104 SER H A 102 PHE H 1.0 . 4.50 1993 1993 A 103 GLN HBx A 105 LEU H 1.0 . 5.12 1994 1994 A 103 GLN HBy A 105 LEU H 1.0 . 5.50 1995 1995 A 105 LEU HBx A 105 LEU H 1.0 . 3.19 1996 1996 A 105 LEU HBy A 105 LEU H 1.0 . 3.33 1997 1997 A 43 ILE HD1% A 105 LEU H 1.0 . 5.50 1998 1998 A 102 PHE HA A 105 LEU H 1.0 . 4.37 1999 1999 A 105 LEU H A 104 SER HBx 1.0 . 4.55 2000 2000 A 105 LEU H A 104 SER HBy 1.0 . 4.55 2001 2001 A 103 GLN HA A 105 LEU H 1.0 . 4.67 2002 2002 A 89 GLY HAy A 105 LEU H 1.0 . 5.21 2003 2003 A 107 LYS H A 105 LEU H 1.0 . 4.23 2004 2004 A 103 GLN H A 105 LEU H 1.0 . 4.39 2005 2005 A 106 VAL H A 105 LEU HBx 1.0 . 3.00 2006 2006 A 106 VAL H A 106 VAL HB 1.0 . 2.90 2007 2007 A 108 ALA HB% A 106 VAL H 1.0 . 5.50 2008 2008 A 43 ILE HG2% A 106 VAL H 1.0 . 5.50 2009 2009 A 43 ILE HG2% A 106 VAL H 1.0 . 5.50 2010 2010 A 43 ILE HD1% A 106 VAL H 1.0 . 5.03 2011 2011 A 105 LEU HDy% A 106 VAL H 1.0 . 5.23 2012 2012 A 105 LEU HDy% A 106 VAL H 1.0 . 5.16 2013 2013 A 106 VAL HGx% A 106 VAL H 1.0 . 5.14 2014 2014 A 106 VAL HGx% A 106 VAL H 1.0 . 5.50 2015 2015 A 106 VAL HGx% A 106 VAL H 1.0 . 5.50 2016 2016 A 103 GLN HA A 106 VAL H 1.0 . 4.06 2017 2017 A 106 VAL H A 105 LEU H 1.0 . 3.38 2018 2018 A 43 ILE HD1% A 107 LYS H 1.0 . 5.50 2019 2019 A 106 VAL HGx% A 107 LYS H 1.0 . 4.97 2020 2020 A 107 LYS H A 103 GLN HBy 1.0 . 5.50 2021 2021 A 107 LYS H A 105 LEU HA 1.0 . 5.34 2022 2022 A 103 GLN HA A 107 LYS H 1.0 . 4.78 2023 2023 A 107 LYS H A 106 VAL H 1.0 . 3.26 2024 2024 A 105 LEU HDy% A 108 ALA H 1.0 . 5.50 2025 2025 A 105 LEU HDy% A 108 ALA H 1.0 . 5.50 2026 2026 A 106 VAL HGx% A 108 ALA H 1.0 . 5.50 2027 2027 A 106 VAL HGx% A 108 ALA H 1.0 . 5.50 2028 2028 A 108 ALA H A 107 LYS HBy 1.0 . 4.37 2029 2029 A 108 ALA H A 107 LYS HBx 1.0 . 4.37 2030 2030 A 106 VAL HB A 108 ALA H 1.0 . 5.50 2031 2031 A 108 ALA HB% A 108 ALA H 1.0 . 3.42 2032 2032 A 108 ALA HB% A 108 ALA H 1.0 . 3.36 2033 2033 A 107 LYS HA A 108 ALA H 1.0 . 3.49 2034 2034 A 105 LEU HA A 108 ALA H 1.0 . 4.31 2035 2035 A 106 VAL HA A 108 ALA H 1.0 . 4.95 2036 2036 A 107 LYS H A 108 ALA H 1.0 . 3.41 2037 2037 A 2 ILE HB A 5 ILE HG1y 1.0 . 5.34 2038 2037 A 2 ILE HB A 5 ILE HG1x 1.0 . 5.34 2039 2038 A 2 ILE HG1y A 5 ILE HG1y 1.0 . 4.40 2040 2038 A 2 ILE HG1y A 5 ILE HG1x 1.0 . 4.40 2041 2039 A 4 ASP H A 5 ILE HG1y 1.0 . 3.88 2042 2039 A 4 ASP H A 5 ILE HG1x 1.0 . 3.88 2043 2040 A 4 ASP HBx A 5 ILE HG1y 1.0 . 4.25 2044 2040 A 4 ASP HBx A 5 ILE HG1x 1.0 . 4.25 2045 2041 A 4 ASP HBy A 5 ILE HG1y 1.0 . 3.85 2046 2041 A 4 ASP HBy A 5 ILE HG1x 1.0 . 3.85 2047 2042 A 5 ILE H A 5 ILE HG1y 1.0 . 3.28 2048 2042 A 5 ILE H A 5 ILE HG1x 1.0 . 3.28 2049 2043 A 5 ILE HA A 5 ILE HG1y 1.0 . 3.29 2050 2043 A 5 ILE HA A 5 ILE HG1x 1.0 . 3.29 2051 2044 A 5 ILE HA A 42 GLN HGx 1.0 . 5.34 2052 2044 A 5 ILE HA A 42 GLN HGy 1.0 . 5.34 2053 2045 A 5 ILE HG2% A 42 GLN HGx 1.0 . 4.56 2054 2045 A 5 ILE HG2% A 42 GLN HGy 1.0 . 4.56 2055 2046 A 5 ILE HG2% A 42 GLN HE2x 1.0 . 5.34 2056 2046 A 5 ILE HG2% A 42 GLN HE2y 1.0 . 5.34 2057 2047 A 5 ILE HG2% A 5 ILE HG1y 1.0 . 2.72 2058 2047 A 5 ILE HG2% A 5 ILE HG1x 1.0 . 2.72 2059 2048 A 5 ILE HG2% A 42 GLN HGy 1.0 . 5.10 2060 2048 A 5 ILE HG2% A 42 GLN HGx 1.0 . 5.10 2061 2049 A 5 ILE HG2% A 42 GLN HE2y 1.0 . 5.34 2062 2049 A 5 ILE HG2% A 42 GLN HE2x 1.0 . 5.34 2063 2050 A 5 ILE HG2% A 42 GLN HGy 1.0 . 5.13 2064 2050 A 5 ILE HG2% A 42 GLN HGx 1.0 . 5.13 2065 2051 A 5 ILE HG2% A 42 GLN HE2y 1.0 . 5.34 2066 2051 A 5 ILE HG2% A 42 GLN HE2x 1.0 . 5.34 2067 2052 A 6 LEU H A 5 ILE HG1y 1.0 . 4.29 2068 2052 A 6 LEU H A 5 ILE HG1x 1.0 . 4.29 2069 2053 A 45 LYS HBx A 5 ILE HG1y 1.0 . 5.34 2070 2053 A 45 LYS HBx A 5 ILE HG1x 1.0 . 5.34 2071 2054 A 5 ILE HD1% A 45 LYS HGy 1.0 . 5.34 2072 2054 A 5 ILE HD1% A 45 LYS HGx 1.0 . 5.34 2073 2055 A 5 ILE HD1% A 45 LYS HGy 1.0 . 5.34 2074 2055 A 5 ILE HD1% A 45 LYS HGx 1.0 . 5.34 2075 2056 A 6 LEU HDx% A 38 LYS HGy 1.0 . 3.94 2076 2056 A 6 LEU HDx% A 38 LYS HGx 1.0 . 3.94 2077 2057 A 6 LEU HDx% A 38 LYS HEx 1.0 . 3.91 2078 2057 A 6 LEU HDx% A 38 LYS HEy 1.0 . 3.91 2079 2058 A 7 SER H A 10 ASP HBx 1.0 . 3.96 2080 2058 A 7 SER H A 10 ASP HBy 1.0 . 3.96 2081 2059 A 7 SER HBx A 10 ASP HBx 1.0 . 2.39 2082 2059 A 7 SER HBx A 10 ASP HBy 1.0 . 2.39 2083 2060 A 7 SER HBy A 10 ASP HBx 1.0 . 3.97 2084 2060 A 7 SER HBy A 10 ASP HBy 1.0 . 3.97 2085 2061 A 8 ALA HA A 12 GLU HBx 1.0 . 5.34 2086 2061 A 8 ALA HA A 12 GLU HBy 1.0 . 5.34 2087 2062 A 9 LYS H A 9 LYS HBy 1.0 . 2.80 2088 2062 A 9 LYS H A 9 LYS HBx 1.0 . 2.80 2089 2063 A 9 LYS HA A 9 LYS HGy 1.0 . 3.20 2090 2063 A 9 LYS HA A 9 LYS HGx 1.0 . 3.20 2091 2064 A 10 ASP H A 9 LYS HBy 1.0 . 3.68 2092 2064 A 10 ASP H A 9 LYS HBx 1.0 . 3.68 2093 2065 A 10 ASP H A 10 ASP HBx 1.0 . 3.12 2094 2065 A 10 ASP H A 10 ASP HBy 1.0 . 3.12 2095 2066 A 10 ASP H A 13 SER HBx 1.0 . 5.23 2096 2066 A 10 ASP H A 13 SER HBy 1.0 . 5.23 2097 2067 A 10 ASP HA A 13 SER HBx 1.0 . 2.77 2098 2067 A 10 ASP HA A 13 SER HBy 1.0 . 2.77 2099 2068 A 11 ILE H A 10 ASP HBx 1.0 . 3.55 2100 2068 A 11 ILE H A 10 ASP HBy 1.0 . 3.55 2101 2069 A 13 SER H A 10 ASP HBx 1.0 . 5.34 2102 2069 A 13 SER H A 10 ASP HBy 1.0 . 5.34 2103 2070 A 33 VAL H A 10 ASP HBx 1.0 . 4.52 2104 2070 A 33 VAL H A 10 ASP HBy 1.0 . 4.52 2105 2071 A 33 VAL HA A 10 ASP HBx 1.0 . 3.43 2106 2071 A 33 VAL HA A 10 ASP HBy 1.0 . 3.43 2107 2072 A 33 VAL HB A 10 ASP HBx 1.0 . 5.34 2108 2072 A 33 VAL HB A 10 ASP HBy 1.0 . 5.34 2109 2073 A 33 VAL HGy% A 10 ASP HBx 1.0 . 3.58 2110 2073 A 33 VAL HGy% A 10 ASP HBy 1.0 . 3.58 2111 2074 A 34 GLY H A 10 ASP HBx 1.0 . 5.00 2112 2074 A 34 GLY H A 10 ASP HBy 1.0 . 5.00 2113 2075 A 11 ILE H A 12 GLU HBx 1.0 . 5.01 2114 2075 A 11 ILE H A 12 GLU HBy 1.0 . 5.01 2115 2076 A 11 ILE HB A 12 GLU HBx 1.0 . 4.50 2116 2076 A 11 ILE HB A 12 GLU HBy 1.0 . 4.50 2117 2077 A 11 ILE HG2% A 12 GLU HBy 1.0 . 5.22 2118 2077 A 11 ILE HG2% A 12 GLU HBx 1.0 . 5.22 2119 2078 A 12 GLU H A 12 GLU HBx 1.0 . 2.99 2120 2078 A 12 GLU H A 12 GLU HBy 1.0 . 2.99 2121 2079 A 12 GLU H A 12 GLU HGx 1.0 . 3.36 2122 2079 A 12 GLU H A 12 GLU HGy 1.0 . 3.36 2123 2080 A 12 GLU H A 13 SER HBx 1.0 . 4.90 2124 2080 A 12 GLU H A 13 SER HBy 1.0 . 4.90 2125 2081 A 12 GLU HA A 12 GLU HGx 1.0 . 3.48 2126 2081 A 12 GLU HA A 12 GLU HGy 1.0 . 3.48 2127 2082 A 13 SER H A 12 GLU HGx 1.0 . 5.12 2128 2082 A 13 SER H A 12 GLU HGy 1.0 . 5.12 2129 2083 A 13 SER H A 13 SER HBx 1.0 . 3.07 2130 2083 A 13 SER H A 13 SER HBy 1.0 . 3.07 2131 2084 A 14 ALA HA A 17 SER HBy 1.0 . 3.87 2132 2084 A 14 ALA HA A 17 SER HBx 1.0 . 3.87 2133 2085 A 14 ALA HB% A 17 SER HBy 1.0 . 5.34 2134 2085 A 14 ALA HB% A 17 SER HBx 1.0 . 5.34 2135 2086 A 15 LEU HDx% A 71 SER HBy 1.0 . 4.67 2136 2086 A 15 LEU HDx% A 71 SER HBx 1.0 . 4.67 2137 2087 A 15 LEU HDy% A 71 SER HBx 1.0 . 5.04 2138 2087 A 15 LEU HDy% A 71 SER HBy 1.0 . 5.04 2139 2088 A 16 SER H A 16 SER HBy 1.0 . 2.86 2140 2088 A 16 SER H A 16 SER HBx 1.0 . 2.86 2141 2089 A 16 SER HA A 17 SER HBy 1.0 . 5.34 2142 2089 A 16 SER HA A 17 SER HBx 1.0 . 5.34 2143 2090 A 16 SER HA A 19 GLN HBx 1.0 . 4.53 2144 2090 A 16 SER HA A 19 GLN HBy 1.0 . 4.53 2145 2091 A 16 SER HA A 19 GLN HGy 1.0 . 2.39 2146 2091 A 16 SER HA A 19 GLN HGx 1.0 . 2.39 2147 2092 A 19 GLN H A 16 SER HBy 1.0 . 5.34 2148 2092 A 19 GLN H A 16 SER HBx 1.0 . 5.34 2149 2093 A 16 SER HBy A 19 GLN HGy 1.0 . 4.76 2150 2093 A 19 GLN HGx A 16 SER HBy 1.0 . 4.76 2151 2093 A 16 SER HBx A 19 GLN HGx 1.0 . 4.76 2152 2093 A 16 SER HBx A 19 GLN HGy 1.0 . 4.76 2153 2094 A 17 SER H A 17 SER HBy 1.0 . 2.84 2154 2094 A 17 SER H A 17 SER HBx 1.0 . 2.84 2155 2095 A 18 CYS H A 17 SER HBy 1.0 . 2.97 2156 2095 A 18 CYS H A 17 SER HBx 1.0 . 2.97 2157 2096 A 18 CYS H A 18 CYS HBx 1.0 . 3.40 2158 2096 A 18 CYS H A 18 CYS HBy 1.0 . 3.40 2159 2097 A 18 CYS H A 19 GLN HGy 1.0 . 3.94 2160 2097 A 18 CYS H A 19 GLN HGx 1.0 . 3.94 2161 2098 A 18 CYS H A 23 SER HBx 1.0 . 5.34 2162 2098 A 18 CYS H A 23 SER HBy 1.0 . 5.34 2163 2099 A 18 CYS HA A 23 SER HBx 1.0 . 4.07 2164 2099 A 18 CYS HA A 23 SER HBy 1.0 . 4.07 2165 2100 A 18 CYS HBy A 19 GLN HGy 1.0 . 5.16 2166 2100 A 18 CYS HBx A 19 GLN HGy 1.0 . 5.16 2167 2100 A 19 GLN HGx A 18 CYS HBx 1.0 . 5.16 2168 2100 A 19 GLN HGx A 18 CYS HBy 1.0 . 5.16 2169 2101 A 19 GLN H A 19 GLN HBx 1.0 . 3.55 2170 2101 A 19 GLN H A 19 GLN HBy 1.0 . 3.55 2171 2102 A 19 GLN H A 19 GLN HGy 1.0 . 3.25 2172 2102 A 19 GLN H A 19 GLN HGx 1.0 . 3.25 2173 2103 A 19 GLN H A 19 GLN HE2x 1.0 . 5.00 2174 2103 A 19 GLN H A 19 GLN HE2y 1.0 . 5.00 2175 2104 A 20 ALA H A 19 GLN HGy 1.0 . 4.47 2176 2104 A 20 ALA H A 19 GLN HGx 1.0 . 4.47 2177 2105 A 20 ALA H A 23 SER HBx 1.0 . 4.42 2178 2105 A 20 ALA H A 23 SER HBy 1.0 . 4.42 2179 2106 A 20 ALA HA A 23 SER HBx 1.0 . 4.88 2180 2106 A 20 ALA HA A 23 SER HBy 1.0 . 4.88 2181 2107 A 20 ALA HB% A 23 SER HBy 1.0 . 3.65 2182 2107 A 20 ALA HB% A 23 SER HBx 1.0 . 3.65 2183 2108 A 20 ALA HB% A 23 SER HBy 1.0 . 3.85 2184 2108 A 20 ALA HB% A 23 SER HBx 1.0 . 3.85 2185 2109 A 21 ALA HA A 22 ASP HBy 1.0 . 5.34 2186 2109 A 21 ALA HA A 22 ASP HBx 1.0 . 5.34 2187 2110 A 21 ALA HB% A 22 ASP HBx 1.0 . 4.13 2188 2110 A 21 ALA HB% A 22 ASP HBy 1.0 . 4.13 2189 2111 A 22 ASP H A 22 ASP HBy 1.0 . 3.46 2190 2111 A 22 ASP H A 22 ASP HBx 1.0 . 3.46 2191 2112 A 24 PHE H A 24 PHE HBy 1.0 . 2.95 2192 2112 A 24 PHE H A 24 PHE HBx 1.0 . 2.95 2193 2113 A 24 PHE HDx A 24 PHE HBy 1.0 . 3.22 2194 2113 A 24 PHE HDx A 24 PHE HBx 1.0 . 3.22 2195 2114 A 25 ASN HA A 24 PHE HBy 1.0 . 5.24 2196 2114 A 25 ASN HA A 24 PHE HBx 1.0 . 5.24 2197 2115 A 25 ASN H A 25 ASN HBy 1.0 . 3.31 2198 2115 A 25 ASN H A 25 ASN HBx 1.0 . 3.31 2199 2116 A 25 ASN H A 28 SER HBy 1.0 . 2.68 2200 2116 A 25 ASN H A 28 SER HBx 1.0 . 2.68 2201 2117 A 25 ASN HA A 25 ASN HD2y 1.0 . 4.71 2202 2117 A 25 ASN HA A 25 ASN HD2x 1.0 . 4.71 2203 2118 A 25 ASN HBx A 25 ASN HD2y 1.0 . 2.95 2204 2118 A 25 ASN HBy A 25 ASN HD2y 1.0 . 2.95 2205 2118 A 25 ASN HD2x A 25 ASN HBy 1.0 . 2.95 2206 2118 A 25 ASN HBx A 25 ASN HD2x 1.0 . 2.95 2207 2119 A 26 TYR H A 25 ASN HBy 1.0 . 3.59 2208 2119 A 26 TYR H A 25 ASN HBx 1.0 . 3.59 2209 2120 A 27 LYS H A 25 ASN HBy 1.0 . 3.76 2210 2120 A 27 LYS H A 25 ASN HBx 1.0 . 3.76 2211 2121 A 28 SER H A 25 ASN HBy 1.0 . 4.08 2212 2121 A 28 SER H A 25 ASN HBx 1.0 . 4.08 2213 2122 A 25 ASN HBy A 28 SER HBy 1.0 . 3.89 2214 2122 A 25 ASN HBx A 28 SER HBy 1.0 . 3.89 2215 2122 A 28 SER HBx A 25 ASN HBy 1.0 . 3.89 2216 2122 A 25 ASN HBx A 28 SER HBx 1.0 . 3.89 2217 2123 A 27 LYS H A 25 ASN HD2y 1.0 . 3.80 2218 2123 A 27 LYS H A 25 ASN HD2x 1.0 . 3.80 2219 2124 A 27 LYS HBy A 25 ASN HD2y 1.0 . 4.36 2220 2124 A 27 LYS HBy A 25 ASN HD2x 1.0 . 4.36 2221 2125 A 27 LYS HBx A 25 ASN HD2y 1.0 . 4.81 2222 2125 A 27 LYS HBx A 25 ASN HD2x 1.0 . 4.81 2223 2126 A 28 SER H A 25 ASN HD2y 1.0 . 4.23 2224 2126 A 28 SER H A 25 ASN HD2x 1.0 . 4.23 2225 2127 A 26 TYR HDy A 27 LYS HGy 1.0 . 4.13 2226 2127 A 26 TYR HDy A 27 LYS HGx 1.0 . 4.13 2227 2128 A 27 LYS H A 27 LYS HGy 1.0 . 3.77 2228 2128 A 27 LYS H A 27 LYS HGx 1.0 . 3.77 2229 2129 A 27 LYS HA A 27 LYS HGy 1.0 . 2.52 2230 2129 A 27 LYS HA A 27 LYS HGx 1.0 . 2.52 2231 2130 A 27 LYS HA A 30 PHE HBx 1.0 . 3.45 2232 2130 A 27 LYS HA A 30 PHE HBy 1.0 . 3.45 2233 2131 A 27 LYS HBx A 27 LYS HEy 1.0 . 4.81 2234 2131 A 27 LYS HBx A 27 LYS HEx 1.0 . 4.81 2235 2132 A 28 SER H A 27 LYS HGy 1.0 . 4.85 2236 2132 A 28 SER H A 27 LYS HGx 1.0 . 4.85 2237 2133 A 28 SER H A 28 SER HBy 1.0 . 3.05 2238 2133 A 28 SER H A 28 SER HBx 1.0 . 3.05 2239 2134 A 28 SER H A 30 PHE HBx 1.0 . 5.34 2240 2134 A 28 SER H A 30 PHE HBy 1.0 . 5.34 2241 2135 A 29 PHE H A 28 SER HBy 1.0 . 4.05 2242 2135 A 29 PHE H A 28 SER HBx 1.0 . 4.05 2243 2136 A 29 PHE H A 30 PHE HBx 1.0 . 4.95 2244 2136 A 29 PHE H A 30 PHE HBy 1.0 . 4.95 2245 2137 A 30 PHE H A 30 PHE HBx 1.0 . 3.06 2246 2137 A 30 PHE H A 30 PHE HBy 1.0 . 3.06 2247 2138 A 31 SER H A 30 PHE HBx 1.0 . 3.20 2248 2138 A 31 SER H A 30 PHE HBy 1.0 . 3.20 2249 2139 A 31 SER H A 31 SER HBy 1.0 . 2.81 2250 2139 A 31 SER H A 31 SER HBx 1.0 . 2.81 2251 2140 A 32 THR H A 31 SER HBy 1.0 . 4.46 2252 2140 A 32 THR H A 31 SER HBx 1.0 . 4.46 2253 2141 A 35 LEU HA A 38 LYS HGy 1.0 . 2.73 2254 2141 A 35 LEU HA A 38 LYS HGx 1.0 . 2.73 2255 2142 A 35 LEU HA A 38 LYS HEx 1.0 . 4.23 2256 2142 A 35 LEU HA A 38 LYS HEy 1.0 . 4.23 2257 2143 A 37 SER H A 37 SER HBx 1.0 . 3.49 2258 2143 A 37 SER H A 37 SER HBy 1.0 . 3.49 2259 2144 A 37 SER H A 38 LYS HGy 1.0 . 4.30 2260 2144 A 37 SER H A 38 LYS HGx 1.0 . 4.30 2261 2145 A 38 LYS H A 38 LYS HGy 1.0 . 3.93 2262 2145 A 38 LYS H A 38 LYS HGx 1.0 . 3.93 2263 2146 A 38 LYS H A 38 LYS HEx 1.0 . 5.34 2264 2146 A 38 LYS H A 38 LYS HEy 1.0 . 5.34 2265 2147 A 38 LYS HA A 38 LYS HDy 1.0 . 3.53 2266 2147 A 38 LYS HA A 38 LYS HDx 1.0 . 3.53 2267 2148 A 38 LYS HBx A 38 LYS HDy 1.0 . 3.41 2268 2148 A 38 LYS HBx A 38 LYS HDx 1.0 . 3.41 2269 2149 A 38 LYS HBx A 38 LYS HEx 1.0 . 5.34 2270 2149 A 38 LYS HBx A 38 LYS HEy 1.0 . 5.34 2271 2150 A 38 LYS HBx A 42 GLN HGx 1.0 . 4.52 2272 2150 A 38 LYS HBx A 42 GLN HGy 1.0 . 4.52 2273 2151 A 38 LYS HEx A 38 LYS HGy 1.0 . 2.82 2274 2151 A 38 LYS HEy A 38 LYS HGy 1.0 . 2.82 2275 2151 A 38 LYS HGx A 38 LYS HEx 1.0 . 2.82 2276 2151 A 38 LYS HGx A 38 LYS HEy 1.0 . 2.82 2277 2152 A 39 THR H A 38 LYS HGy 1.0 . 4.57 2278 2152 A 39 THR H A 38 LYS HGx 1.0 . 4.57 2279 2153 A 43 ILE HG1y A 38 LYS HGy 1.0 . 4.76 2280 2153 A 43 ILE HG1y A 38 LYS HGx 1.0 . 4.76 2281 2154 A 39 THR H A 40 PRO HDx 1.0 . 4.79 2282 2154 A 39 THR H A 40 PRO HDy 1.0 . 4.79 2283 2155 A 39 THR H A 42 GLN HGx 1.0 . 3.88 2284 2155 A 39 THR H A 42 GLN HGy 1.0 . 3.88 2285 2156 A 39 THR HA A 40 PRO HDx 1.0 . 3.54 2286 2156 A 39 THR HA A 40 PRO HDy 1.0 . 3.54 2287 2157 A 39 THR HG2% A 40 PRO HDx 1.0 . 3.21 2288 2157 A 39 THR HG2% A 40 PRO HDy 1.0 . 3.21 2289 2158 A 39 THR HG2% A 42 GLN HGy 1.0 . 4.68 2290 2158 A 39 THR HG2% A 42 GLN HGx 1.0 . 4.68 2291 2159 A 40 PRO HA A 41 ASP HBy 1.0 . 4.56 2292 2159 A 40 PRO HA A 41 ASP HBx 1.0 . 4.56 2293 2160 A 40 PRO HA A 107 LYS HGy 1.0 . 5.34 2294 2160 A 40 PRO HA A 107 LYS HGx 1.0 . 5.34 2295 2161 A 40 PRO HBx A 41 ASP HBy 1.0 . 4.41 2296 2161 A 41 ASP HBx A 40 PRO HBx 1.0 . 4.41 2297 2162 A 40 PRO HGy A 41 ASP HBy 1.0 . 4.03 2298 2162 A 41 ASP HBx A 40 PRO HGy 1.0 . 4.03 2299 2163 A 41 ASP H A 40 PRO HDx 1.0 . 4.54 2300 2163 A 41 ASP H A 40 PRO HDy 1.0 . 4.54 2301 2164 A 41 ASP H A 41 ASP HBy 1.0 . 3.22 2302 2164 A 41 ASP H A 41 ASP HBx 1.0 . 3.22 2303 2165 A 41 ASP HA A 44 LYS HDx 1.0 . 5.34 2304 2165 A 41 ASP HA A 44 LYS HDy 1.0 . 5.34 2305 2166 A 42 GLN H A 41 ASP HBy 1.0 . 3.93 2306 2166 A 42 GLN H A 41 ASP HBx 1.0 . 3.93 2307 2167 A 42 GLN H A 42 GLN HGx 1.0 . 2.78 2308 2167 A 42 GLN H A 42 GLN HGy 1.0 . 2.78 2309 2168 A 42 GLN HA A 45 LYS HGx 1.0 . 5.34 2310 2168 A 42 GLN HA A 45 LYS HGy 1.0 . 5.34 2311 2169 A 43 ILE H A 42 GLN HGx 1.0 . 4.44 2312 2169 A 43 ILE H A 42 GLN HGy 1.0 . 4.44 2313 2170 A 43 ILE H A 44 LYS HGy 1.0 . 4.40 2314 2170 A 43 ILE H A 44 LYS HGx 1.0 . 4.40 2315 2171 A 43 ILE HD1% A 107 LYS HGy 1.0 . 4.60 2316 2171 A 43 ILE HD1% A 107 LYS HGx 1.0 . 4.60 2317 2172 A 43 ILE HD1% A 107 LYS HGx 1.0 . 5.22 2318 2172 A 43 ILE HD1% A 107 LYS HGy 1.0 . 5.22 2319 2173 A 44 LYS H A 44 LYS HGy 1.0 . 3.43 2320 2173 A 44 LYS H A 44 LYS HGx 1.0 . 3.43 2321 2174 A 44 LYS HBx A 44 LYS HDx 1.0 . 2.53 2322 2174 A 44 LYS HBx A 44 LYS HDy 1.0 . 2.53 2323 2175 A 44 LYS HBx A 44 LYS HEy 1.0 . 5.11 2324 2175 A 44 LYS HBx A 44 LYS HEx 1.0 . 5.11 2325 2176 A 44 LYS HBy A 44 LYS HEy 1.0 . 5.32 2326 2176 A 44 LYS HBy A 44 LYS HEx 1.0 . 5.32 2327 2177 A 44 LYS HEx A 44 LYS HGy 1.0 . 2.85 2328 2177 A 44 LYS HEy A 44 LYS HGy 1.0 . 2.85 2329 2177 A 44 LYS HGx A 44 LYS HEy 1.0 . 2.85 2330 2177 A 44 LYS HGx A 44 LYS HEx 1.0 . 2.85 2331 2178 A 45 LYS H A 44 LYS HGy 1.0 . 2.79 2332 2178 A 45 LYS H A 44 LYS HGx 1.0 . 2.79 2333 2179 A 45 LYS HA A 44 LYS HGy 1.0 . 5.34 2334 2179 A 45 LYS HA A 44 LYS HGx 1.0 . 5.34 2335 2180 A 44 LYS HGy A 45 LYS HGx 1.0 . 5.18 2336 2180 A 44 LYS HGx A 45 LYS HGx 1.0 . 5.18 2337 2180 A 45 LYS HGy A 44 LYS HGy 1.0 . 5.18 2338 2180 A 45 LYS HGy A 44 LYS HGx 1.0 . 5.18 2339 2181 A 99 VAL HGx% A 44 LYS HGy 1.0 . 4.28 2340 2181 A 99 VAL HGx% A 44 LYS HGx 1.0 . 4.28 2341 2182 A 99 VAL HGx% A 44 LYS HGx 1.0 . 4.65 2342 2182 A 99 VAL HGx% A 44 LYS HGy 1.0 . 4.65 2343 2183 A 99 VAL HB A 44 LYS HDx 1.0 . 5.34 2344 2183 A 99 VAL HB A 44 LYS HDy 1.0 . 5.34 2345 2184 A 99 VAL HGx% A 44 LYS HDx 1.0 . 4.73 2346 2184 A 99 VAL HGx% A 44 LYS HDy 1.0 . 4.73 2347 2185 A 99 VAL HGy% A 44 LYS HDy 1.0 . 5.34 2348 2185 A 99 VAL HGy% A 44 LYS HDx 1.0 . 5.34 2349 2186 A 99 VAL HGx% A 44 LYS HEy 1.0 . 4.43 2350 2186 A 99 VAL HGx% A 44 LYS HEx 1.0 . 4.43 2351 2187 A 45 LYS H A 45 LYS HGx 1.0 . 3.14 2352 2187 A 45 LYS H A 45 LYS HGy 1.0 . 3.14 2353 2188 A 45 LYS HA A 45 LYS HGx 1.0 . 3.39 2354 2188 A 45 LYS HA A 45 LYS HGy 1.0 . 3.39 2355 2189 A 45 LYS HA A 45 LYS HDx 1.0 . 4.38 2356 2189 A 45 LYS HA A 45 LYS HDy 1.0 . 4.38 2357 2190 A 45 LYS HBy A 45 LYS HGx 1.0 . 2.45 2358 2190 A 45 LYS HBy A 45 LYS HGy 1.0 . 2.45 2359 2191 A 48 GLY HAx A 51 ASP HBx 1.0 . 3.92 2360 2191 A 48 GLY HAx A 51 ASP HBy 1.0 . 3.92 2361 2192 A 50 LEU HA A 69 ASN HBx 1.0 . 5.18 2362 2192 A 50 LEU HA A 69 ASN HBy 1.0 . 5.18 2363 2193 A 50 LEU HDx% A 69 ASN HBx 1.0 . 5.34 2364 2193 A 50 LEU HDx% A 69 ASN HBy 1.0 . 5.34 2365 2194 A 50 LEU HDx% A 69 ASN HBy 1.0 . 5.34 2366 2194 A 50 LEU HDx% A 69 ASN HBx 1.0 . 5.34 2367 2195 A 50 LEU HDy% A 69 ASN HBy 1.0 . 3.94 2368 2195 A 50 LEU HDy% A 69 ASN HBx 1.0 . 3.94 2369 2196 A 51 ASP H A 51 ASP HBx 1.0 . 3.23 2370 2196 A 51 ASP H A 51 ASP HBy 1.0 . 3.23 2371 2197 A 51 ASP HA A 54 LYS HGx 1.0 . 5.34 2372 2197 A 51 ASP HA A 54 LYS HGy 1.0 . 5.34 2373 2198 A 51 ASP HA A 54 LYS HDx 1.0 . 5.34 2374 2198 A 51 ASP HA A 54 LYS HDy 1.0 . 5.34 2375 2199 A 51 ASP HBy A 54 LYS HDx 1.0 . 4.76 2376 2199 A 51 ASP HBx A 54 LYS HDx 1.0 . 4.76 2377 2199 A 54 LYS HDy A 51 ASP HBx 1.0 . 4.76 2378 2199 A 51 ASP HBy A 54 LYS HDy 1.0 . 4.76 2379 2200 A 52 GLN H A 52 GLN HGy 1.0 . 5.34 2380 2200 A 52 GLN H A 52 GLN HGx 1.0 . 5.34 2381 2201 A 52 GLN HA A 52 GLN HGy 1.0 . 3.45 2382 2201 A 52 GLN HA A 52 GLN HGx 1.0 . 3.45 2383 2202 A 52 GLN HBx A 52 GLN HGy 1.0 . 2.30 2384 2202 A 52 GLN HBy A 52 GLN HGy 1.0 . 2.30 2385 2202 A 52 GLN HGx A 52 GLN HBy 1.0 . 2.30 2386 2202 A 52 GLN HGx A 52 GLN HBx 1.0 . 2.30 2387 2203 A 53 ASP H A 52 GLN HGy 1.0 . 3.88 2388 2203 A 53 ASP H A 52 GLN HGx 1.0 . 3.88 2389 2204 A 52 GLN HGy A 53 ASP HBx 1.0 . 5.18 2390 2204 A 53 ASP HBy A 52 GLN HGy 1.0 . 5.18 2391 2204 A 52 GLN HGx A 53 ASP HBy 1.0 . 5.18 2392 2204 A 52 GLN HGx A 53 ASP HBx 1.0 . 5.18 2393 2205 A 54 LYS H A 52 GLN HGy 1.0 . 5.20 2394 2205 A 54 LYS H A 52 GLN HGx 1.0 . 5.20 2395 2206 A 54 LYS HA A 52 GLN HGy 1.0 . 5.34 2396 2206 A 54 LYS HA A 52 GLN HGx 1.0 . 5.34 2397 2207 A 53 ASP H A 53 ASP HBx 1.0 . 3.26 2398 2207 A 53 ASP H A 53 ASP HBy 1.0 . 3.26 2399 2208 A 53 ASP H A 54 LYS HBy 1.0 . 5.17 2400 2208 A 53 ASP H A 54 LYS HBx 1.0 . 5.17 2401 2209 A 53 ASP H A 54 LYS HGx 1.0 . 5.34 2402 2209 A 53 ASP H A 54 LYS HGy 1.0 . 5.34 2403 2210 A 54 LYS H A 54 LYS HGx 1.0 . 2.77 2404 2210 A 54 LYS H A 54 LYS HGy 1.0 . 2.77 2405 2211 A 54 LYS H A 54 LYS HDx 1.0 . 4.35 2406 2211 A 54 LYS H A 54 LYS HDy 1.0 . 4.35 2407 2212 A 54 LYS HA A 54 LYS HBy 1.0 . 2.63 2408 2212 A 54 LYS HA A 54 LYS HBx 1.0 . 2.63 2409 2213 A 54 LYS HA A 54 LYS HGx 1.0 . 3.38 2410 2213 A 54 LYS HA A 54 LYS HGy 1.0 . 3.38 2411 2214 A 54 LYS HA A 54 LYS HDx 1.0 . 2.70 2412 2214 A 54 LYS HA A 54 LYS HDy 1.0 . 2.70 2413 2215 A 54 LYS HBy A 54 LYS HEx 1.0 . 4.76 2414 2215 A 54 LYS HBx A 54 LYS HEx 1.0 . 4.76 2415 2215 A 54 LYS HEy A 54 LYS HBy 1.0 . 4.76 2416 2215 A 54 LYS HBx A 54 LYS HEy 1.0 . 4.76 2417 2216 A 54 LYS HDy A 54 LYS HGx 1.0 . 2.26 2418 2216 A 54 LYS HDx A 54 LYS HGx 1.0 . 2.26 2419 2216 A 54 LYS HGy A 54 LYS HDx 1.0 . 2.26 2420 2216 A 54 LYS HGy A 54 LYS HDy 1.0 . 2.26 2421 2217 A 55 SER H A 55 SER HBx 1.0 . 3.18 2422 2217 A 55 SER H A 55 SER HBy 1.0 . 3.18 2423 2218 A 55 SER H A 56 GLY HAy 1.0 . 5.04 2424 2218 A 55 SER H A 56 GLY HAx 1.0 . 5.04 2425 2219 A 57 PHE H A 55 SER HBx 1.0 . 4.34 2426 2219 A 57 PHE H A 55 SER HBy 1.0 . 4.34 2427 2220 A 57 PHE HA A 96 LYS HBx 1.0 . 5.31 2428 2220 A 57 PHE HA A 96 LYS HBy 1.0 . 5.31 2429 2221 A 57 PHE HBx A 59 GLU HGx 1.0 . 5.34 2430 2221 A 57 PHE HBx A 59 GLU HGy 1.0 . 5.34 2431 2222 A 57 PHE HBx A 96 LYS HBx 1.0 . 4.43 2432 2222 A 57 PHE HBx A 96 LYS HBy 1.0 . 4.43 2433 2223 A 57 PHE HBy A 59 GLU HGx 1.0 . 5.34 2434 2223 A 57 PHE HBy A 59 GLU HGy 1.0 . 5.34 2435 2224 A 57 PHE HBy A 96 LYS HBx 1.0 . 3.59 2436 2224 A 57 PHE HBy A 96 LYS HBy 1.0 . 3.59 2437 2225 A 57 PHE HBy A 96 LYS HDx 1.0 . 3.87 2438 2225 A 57 PHE HBy A 96 LYS HDy 1.0 . 3.87 2439 2226 A 57 PHE HDx A 96 LYS HBx 1.0 . 4.26 2440 2226 A 57 PHE HDx A 96 LYS HBy 1.0 . 4.26 2441 2227 A 58 ILE HA A 62 GLU HGx 1.0 . 5.34 2442 2227 A 58 ILE HA A 62 GLU HGy 1.0 . 5.34 2443 2228 A 58 ILE HG2% A 62 GLU HGx 1.0 . 5.34 2444 2228 A 58 ILE HG2% A 62 GLU HGy 1.0 . 5.34 2445 2229 A 58 ILE HG2% A 62 GLU HGy 1.0 . 5.34 2446 2229 A 58 ILE HG2% A 62 GLU HGx 1.0 . 5.34 2447 2230 A 58 ILE HG2% A 62 GLU HGy 1.0 . 5.34 2448 2230 A 58 ILE HG2% A 62 GLU HGx 1.0 . 5.34 2449 2231 A 59 GLU H A 59 GLU HBy 1.0 . 3.47 2450 2231 A 59 GLU H A 59 GLU HBx 1.0 . 3.47 2451 2232 A 60 GLU H A 59 GLU HBy 1.0 . 2.63 2452 2232 A 60 GLU H A 59 GLU HBx 1.0 . 2.63 2453 2233 A 61 GLU H A 59 GLU HBy 1.0 . 4.91 2454 2233 A 61 GLU H A 59 GLU HBx 1.0 . 4.91 2455 2234 A 59 GLU HGx A 96 LYS HBx 1.0 . 4.85 2456 2234 A 96 LYS HBy A 59 GLU HGx 1.0 . 4.85 2457 2234 A 96 LYS HBy A 59 GLU HGy 1.0 . 4.85 2458 2234 A 59 GLU HGy A 96 LYS HBx 1.0 . 4.85 2459 2235 A 59 GLU HGy A 96 LYS HGy 1.0 . 4.02 2460 2235 A 59 GLU HGx A 96 LYS HGy 1.0 . 4.02 2461 2235 A 96 LYS HGx A 59 GLU HGx 1.0 . 4.02 2462 2235 A 59 GLU HGy A 96 LYS HGx 1.0 . 4.02 2463 2236 A 60 GLU HA A 61 GLU HGx 1.0 . 5.30 2464 2236 A 60 GLU HA A 61 GLU HGy 1.0 . 5.30 2465 2237 A 61 GLU H A 61 GLU HGx 1.0 . 3.70 2466 2237 A 61 GLU H A 61 GLU HGy 1.0 . 3.70 2467 2238 A 62 GLU H A 62 GLU HGx 1.0 . 4.34 2468 2238 A 62 GLU H A 62 GLU HGy 1.0 . 4.34 2469 2239 A 62 GLU HA A 62 GLU HGx 1.0 . 2.37 2470 2239 A 62 GLU HA A 62 GLU HGy 1.0 . 2.37 2471 2240 A 62 GLU HBx A 62 GLU HGx 1.0 . 2.52 2472 2240 A 62 GLU HBx A 62 GLU HGy 1.0 . 2.52 2473 2241 A 63 LEU H A 62 GLU HGx 1.0 . 5.07 2474 2241 A 63 LEU H A 62 GLU HGy 1.0 . 5.07 2475 2242 A 65 LEU HDx% A 62 GLU HGx 1.0 . 5.34 2476 2242 A 65 LEU HDx% A 62 GLU HGy 1.0 . 5.34 2477 2243 A 65 LEU HDx% A 62 GLU HGy 1.0 . 5.34 2478 2243 A 65 LEU HDx% A 62 GLU HGx 1.0 . 5.34 2479 2244 A 65 LEU HDy% A 62 GLU HGx 1.0 . 5.34 2480 2244 A 65 LEU HDy% A 62 GLU HGy 1.0 . 5.34 2481 2245 A 65 LEU HDy% A 62 GLU HGy 1.0 . 5.34 2482 2245 A 65 LEU HDy% A 62 GLU HGx 1.0 . 5.34 2483 2246 A 65 LEU HA A 68 LYS HDx 1.0 . 5.22 2484 2246 A 65 LEU HA A 68 LYS HDy 1.0 . 5.22 2485 2247 A 65 LEU HBy A 68 LYS HBy 1.0 . 3.48 2486 2247 A 65 LEU HBy A 68 LYS HBx 1.0 . 3.48 2487 2248 A 65 LEU HDy% A 68 LYS HDy 1.0 . 4.77 2488 2248 A 65 LEU HDy% A 68 LYS HDx 1.0 . 4.77 2489 2249 A 65 LEU HDy% A 68 LYS HEx 1.0 . 4.59 2490 2249 A 65 LEU HDy% A 68 LYS HEy 1.0 . 4.59 2491 2250 A 65 LEU HDy% A 68 LYS HEx 1.0 . 5.34 2492 2250 A 65 LEU HDy% A 68 LYS HEy 1.0 . 5.34 2493 2251 A 66 PHE HA A 69 ASN HBx 1.0 . 5.34 2494 2251 A 66 PHE HA A 69 ASN HBy 1.0 . 5.34 2495 2252 A 67 LEU H A 67 LEU HBy 1.0 . 3.37 2496 2252 A 67 LEU H A 67 LEU HBx 1.0 . 3.37 2497 2253 A 67 LEU H A 68 LYS HDx 1.0 . 5.34 2498 2253 A 67 LEU H A 68 LYS HDy 1.0 . 5.34 2499 2254 A 67 LEU HG A 67 LEU HBy 1.0 . 2.63 2500 2254 A 67 LEU HG A 67 LEU HBx 1.0 . 2.63 2501 2255 A 67 LEU HDx% A 67 LEU HBy 1.0 . 2.38 2502 2255 A 67 LEU HDx% A 67 LEU HBx 1.0 . 2.38 2503 2256 A 67 LEU HDy% A 67 LEU HBy 1.0 . 2.54 2504 2256 A 67 LEU HDy% A 67 LEU HBx 1.0 . 2.54 2505 2257 A 68 LYS H A 67 LEU HBy 1.0 . 4.19 2506 2257 A 68 LYS H A 67 LEU HBx 1.0 . 4.19 2507 2258 A 74 ALA HB% A 67 LEU HBy 1.0 . 3.91 2508 2258 A 74 ALA HB% A 67 LEU HBx 1.0 . 3.91 2509 2259 A 74 ALA HB% A 67 LEU HBx 1.0 . 3.38 2510 2259 A 74 ALA HB% A 67 LEU HBy 1.0 . 3.38 2511 2260 A 76 VAL HA A 67 LEU HBy 1.0 . 5.34 2512 2260 A 76 VAL HA A 67 LEU HBx 1.0 . 5.34 2513 2261 A 77 LEU HDy% A 67 LEU HBy 1.0 . 5.34 2514 2261 A 77 LEU HDy% A 67 LEU HBx 1.0 . 5.34 2515 2262 A 77 LEU HDy% A 67 LEU HBy 1.0 . 5.34 2516 2262 A 77 LEU HDy% A 67 LEU HBx 1.0 . 5.34 2517 2263 A 77 LEU HDy% A 67 LEU HBy 1.0 . 5.34 2518 2263 A 77 LEU HDy% A 67 LEU HBx 1.0 . 5.34 2519 2264 A 68 LYS H A 68 LYS HBy 1.0 . 3.14 2520 2264 A 68 LYS H A 68 LYS HBx 1.0 . 3.14 2521 2265 A 68 LYS HGy A 68 LYS HBy 1.0 . 2.35 2522 2265 A 68 LYS HGy A 68 LYS HBx 1.0 . 2.35 2523 2266 A 70 PHE H A 68 LYS HBy 1.0 . 5.34 2524 2266 A 70 PHE H A 68 LYS HBx 1.0 . 5.34 2525 2267 A 75 ARG H A 68 LYS HDx 1.0 . 5.19 2526 2267 A 75 ARG H A 68 LYS HDy 1.0 . 5.19 2527 2268 A 76 VAL HGx% A 68 LYS HDx 1.0 . 4.29 2528 2268 A 76 VAL HGx% A 68 LYS HDy 1.0 . 4.29 2529 2269 A 76 VAL HGx% A 68 LYS HDy 1.0 . 4.78 2530 2269 A 76 VAL HGx% A 68 LYS HDx 1.0 . 4.78 2531 2270 A 75 ARG HA A 68 LYS HEy 1.0 . 4.53 2532 2270 A 75 ARG HA A 68 LYS HEx 1.0 . 4.53 2533 2271 A 76 VAL H A 68 LYS HEy 1.0 . 5.34 2534 2271 A 76 VAL H A 68 LYS HEx 1.0 . 5.34 2535 2272 A 76 VAL HGx% A 68 LYS HEy 1.0 . 4.74 2536 2272 A 76 VAL HGx% A 68 LYS HEx 1.0 . 4.74 2537 2273 A 69 ASN H A 69 ASN HBx 1.0 . 2.91 2538 2273 A 69 ASN H A 69 ASN HBy 1.0 . 2.91 2539 2274 A 70 PHE H A 69 ASN HBx 1.0 . 3.61 2540 2274 A 70 PHE H A 69 ASN HBy 1.0 . 3.61 2541 2275 A 70 PHE HDy A 69 ASN HBx 1.0 . 2.84 2542 2275 A 70 PHE HDy A 69 ASN HBy 1.0 . 2.84 2543 2276 A 70 PHE H A 71 SER HBx 1.0 . 4.96 2544 2276 A 70 PHE H A 71 SER HBy 1.0 . 4.96 2545 2277 A 70 PHE HA A 71 SER HBx 1.0 . 5.34 2546 2277 A 70 PHE HA A 71 SER HBy 1.0 . 5.34 2547 2278 A 71 SER H A 71 SER HBx 1.0 . 3.42 2548 2278 A 71 SER H A 71 SER HBy 1.0 . 3.42 2549 2279 A 72 SER H A 71 SER HBx 1.0 . 3.17 2550 2279 A 72 SER H A 71 SER HBy 1.0 . 3.17 2551 2280 A 73 SER H A 71 SER HBx 1.0 . 4.37 2552 2280 A 73 SER H A 71 SER HBy 1.0 . 4.37 2553 2281 A 74 ALA H A 71 SER HBx 1.0 . 3.38 2554 2281 A 74 ALA H A 71 SER HBy 1.0 . 3.38 2555 2282 A 74 ALA HB% A 71 SER HBx 1.0 . 4.51 2556 2282 A 74 ALA HB% A 71 SER HBy 1.0 . 4.51 2557 2283 A 74 ALA HB% A 71 SER HBy 1.0 . 4.66 2558 2283 A 74 ALA HB% A 71 SER HBx 1.0 . 4.66 2559 2284 A 72 SER H A 72 SER HBx 1.0 . 3.68 2560 2284 A 72 SER H A 72 SER HBy 1.0 . 3.68 2561 2285 A 73 SER H A 73 SER HBy 1.0 . 2.60 2562 2285 A 73 SER H A 73 SER HBx 1.0 . 2.60 2563 2286 A 73 SER HA A 73 SER HBy 1.0 . 2.59 2564 2286 A 73 SER HBx A 73 SER HA 1.0 . 2.59 2565 2287 A 74 ALA H A 73 SER HBy 1.0 . 3.71 2566 2287 A 74 ALA H A 73 SER HBx 1.0 . 3.71 2567 2288 A 74 ALA HA A 75 ARG HGy 1.0 . 5.34 2568 2288 A 74 ALA HA A 75 ARG HGx 1.0 . 5.34 2569 2289 A 75 ARG H A 75 ARG HBx 1.0 . 3.16 2570 2289 A 75 ARG H A 75 ARG HBy 1.0 . 3.16 2571 2290 A 75 ARG H A 75 ARG HGy 1.0 . 2.55 2572 2290 A 75 ARG H A 75 ARG HGx 1.0 . 2.55 2573 2291 A 75 ARG HBx A 75 ARG HDy 1.0 . 2.66 2574 2291 A 75 ARG HBy A 75 ARG HDy 1.0 . 2.66 2575 2291 A 75 ARG HDx A 75 ARG HBx 1.0 . 2.66 2576 2291 A 75 ARG HBy A 75 ARG HDx 1.0 . 2.66 2577 2292 A 76 VAL H A 75 ARG HBx 1.0 . 3.42 2578 2292 A 76 VAL H A 75 ARG HBy 1.0 . 3.42 2579 2293 A 76 VAL H A 75 ARG HGy 1.0 . 2.98 2580 2293 A 76 VAL H A 75 ARG HGx 1.0 . 2.98 2581 2294 A 76 VAL HA A 75 ARG HGy 1.0 . 5.34 2582 2294 A 76 VAL HA A 75 ARG HGx 1.0 . 5.34 2583 2295 A 76 VAL HGy% A 75 ARG HGy 1.0 . 5.34 2584 2295 A 76 VAL HGy% A 75 ARG HGx 1.0 . 5.34 2585 2296 A 76 VAL HGy% A 75 ARG HGy 1.0 . 5.34 2586 2296 A 76 VAL HGy% A 75 ARG HGx 1.0 . 5.34 2587 2297 A 76 VAL H A 75 ARG HDy 1.0 . 4.39 2588 2297 A 76 VAL H A 75 ARG HDx 1.0 . 4.39 2589 2298 A 76 VAL HGy% A 75 ARG HDy 1.0 . 4.33 2590 2298 A 76 VAL HGy% A 75 ARG HDx 1.0 . 4.33 2591 2299 A 76 VAL HGy% A 75 ARG HDy 1.0 . 4.61 2592 2299 A 76 VAL HGy% A 75 ARG HDx 1.0 . 4.61 2593 2300 A 79 SER H A 79 SER HBy 1.0 . 3.67 2594 2300 A 79 SER H A 79 SER HBx 1.0 . 3.67 2595 2301 A 80 ALA H A 83 LYS HGx 1.0 . 5.34 2596 2301 A 80 ALA H A 83 LYS HGy 1.0 . 5.34 2597 2302 A 82 THR HB A 83 LYS HGx 1.0 . 4.32 2598 2302 A 82 THR HB A 83 LYS HGy 1.0 . 4.32 2599 2303 A 83 LYS H A 83 LYS HGx 1.0 . 2.52 2600 2303 A 83 LYS H A 83 LYS HGy 1.0 . 2.52 2601 2304 A 83 LYS HA A 83 LYS HGx 1.0 . 2.81 2602 2304 A 83 LYS HA A 83 LYS HGy 1.0 . 2.81 2603 2305 A 83 LYS HA A 83 LYS HDy 1.0 . 3.96 2604 2305 A 83 LYS HA A 83 LYS HDx 1.0 . 3.96 2605 2306 A 83 LYS HBy A 83 LYS HDy 1.0 . 3.53 2606 2306 A 83 LYS HBy A 83 LYS HDx 1.0 . 3.53 2607 2307 A 83 LYS HBx A 83 LYS HDy 1.0 . 2.52 2608 2307 A 83 LYS HBx A 83 LYS HDx 1.0 . 2.52 2609 2308 A 83 LYS HEy A 83 LYS HGx 1.0 . 2.49 2610 2308 A 83 LYS HEx A 83 LYS HGx 1.0 . 2.49 2611 2308 A 83 LYS HGy A 83 LYS HEx 1.0 . 2.49 2612 2308 A 83 LYS HGy A 83 LYS HEy 1.0 . 2.49 2613 2309 A 84 ALA H A 83 LYS HGx 1.0 . 4.40 2614 2309 A 84 ALA H A 83 LYS HGy 1.0 . 4.40 2615 2310 A 86 LEU HDx% A 95 GLY HAx 1.0 . 5.34 2616 2310 A 86 LEU HDx% A 95 GLY HAy 1.0 . 5.34 2617 2311 A 86 LEU HDy% A 95 GLY HAy 1.0 . 4.78 2618 2311 A 86 LEU HDy% A 95 GLY HAx 1.0 . 4.78 2619 2312 A 86 LEU HDy% A 95 GLY HAy 1.0 . 4.81 2620 2312 A 86 LEU HDy% A 95 GLY HAx 1.0 . 4.81 2621 2313 A 91 THR H A 93 GLY HAy 1.0 . 5.34 2622 2313 A 91 THR H A 93 GLY HAx 1.0 . 5.34 2623 2314 A 91 THR H A 101 GLU HGy 1.0 . 3.70 2624 2314 A 91 THR H A 101 GLU HGx 1.0 . 3.70 2625 2315 A 91 THR HB A 92 ASP HBy 1.0 . 5.34 2626 2315 A 91 THR HB A 92 ASP HBx 1.0 . 5.34 2627 2316 A 91 THR HB A 101 GLU HGy 1.0 . 5.34 2628 2316 A 91 THR HB A 101 GLU HGx 1.0 . 5.34 2629 2317 A 91 THR HG2% A 101 GLU HGy 1.0 . 5.34 2630 2317 A 91 THR HG2% A 101 GLU HGx 1.0 . 5.34 2631 2318 A 91 THR HG2% A 101 GLU HGx 1.0 . 5.34 2632 2318 A 91 THR HG2% A 101 GLU HGy 1.0 . 5.34 2633 2319 A 92 ASP H A 101 GLU HGy 1.0 . 4.31 2634 2319 A 92 ASP H A 101 GLU HGx 1.0 . 4.31 2635 2320 A 93 GLY H A 101 GLU HGy 1.0 . 5.29 2636 2320 A 93 GLY H A 101 GLU HGx 1.0 . 5.29 2637 2321 A 94 ASP H A 94 ASP HBy 1.0 . 3.62 2638 2321 A 94 ASP H A 94 ASP HBx 1.0 . 3.62 2639 2322 A 94 ASP HA A 94 ASP HBy 1.0 . 2.42 2640 2322 A 94 ASP HA A 94 ASP HBx 1.0 . 2.42 2641 2323 A 96 LYS H A 94 ASP HBy 1.0 . 5.34 2642 2323 A 96 LYS H A 94 ASP HBx 1.0 . 5.34 2643 2324 A 95 GLY HAy A 96 LYS HGy 1.0 . 5.18 2644 2324 A 96 LYS HGx A 95 GLY HAx 1.0 . 5.18 2645 2324 A 96 LYS HGx A 95 GLY HAy 1.0 . 5.18 2646 2324 A 95 GLY HAx A 96 LYS HGy 1.0 . 5.18 2647 2325 A 96 LYS H A 96 LYS HBx 1.0 . 3.49 2648 2325 A 96 LYS H A 96 LYS HBy 1.0 . 3.49 2649 2326 A 96 LYS H A 96 LYS HGy 1.0 . 2.91 2650 2326 A 96 LYS H A 96 LYS HGx 1.0 . 2.91 2651 2327 A 96 LYS HBx A 96 LYS HDx 1.0 . 2.36 2652 2327 A 96 LYS HBy A 96 LYS HDx 1.0 . 2.36 2653 2327 A 96 LYS HDy A 96 LYS HBx 1.0 . 2.36 2654 2327 A 96 LYS HBy A 96 LYS HDy 1.0 . 2.36 2655 2328 A 97 ILE H A 96 LYS HBx 1.0 . 3.16 2656 2328 A 97 ILE H A 96 LYS HBy 1.0 . 3.16 2657 2329 A 97 ILE H A 96 LYS HDx 1.0 . 4.89 2658 2329 A 97 ILE H A 96 LYS HDy 1.0 . 4.89 2659 2330 A 97 ILE HG2% A 101 GLU HGx 1.0 . 4.76 2660 2330 A 97 ILE HG2% A 101 GLU HGy 1.0 . 4.76 2661 2331 A 98 GLY H A 101 GLU HGy 1.0 . 4.32 2662 2331 A 98 GLY H A 101 GLU HGx 1.0 . 4.32 2663 2332 A 98 GLY HAx A 101 GLU HGy 1.0 . 5.34 2664 2332 A 98 GLY HAx A 101 GLU HGx 1.0 . 5.34 2665 2333 A 99 VAL HB A 100 GLU HGx 1.0 . 5.34 2666 2333 A 99 VAL HB A 100 GLU HGy 1.0 . 5.34 2667 2334 A 99 VAL HGy% A 100 GLU HGy 1.0 . 4.22 2668 2334 A 99 VAL HGy% A 100 GLU HGx 1.0 . 4.22 2669 2335 A 100 GLU H A 100 GLU HGx 1.0 . 3.33 2670 2335 A 100 GLU H A 100 GLU HGy 1.0 . 3.33 2671 2336 A 100 GLU HA A 100 GLU HGx 1.0 . 3.17 2672 2336 A 100 GLU HA A 100 GLU HGy 1.0 . 3.17 2673 2337 A 100 GLU HBx A 100 GLU HGx 1.0 . 2.61 2674 2337 A 100 GLU HBx A 100 GLU HGy 1.0 . 2.61 2675 2338 A 100 GLU HBy A 100 GLU HGx 1.0 . 2.56 2676 2338 A 100 GLU HBy A 100 GLU HGy 1.0 . 2.56 2677 2339 A 101 GLU H A 101 GLU HGy 1.0 . 3.18 2678 2339 A 101 GLU H A 101 GLU HGx 1.0 . 3.18 2679 2340 A 101 GLU HA A 101 GLU HGy 1.0 . 3.21 2680 2340 A 101 GLU HA A 101 GLU HGx 1.0 . 3.21 2681 2341 A 101 GLU HBy A 101 GLU HGy 1.0 . 2.46 2682 2341 A 101 GLU HBy A 101 GLU HGx 1.0 . 2.46 2683 2342 A 103 GLN H A 104 SER HBy 1.0 . 5.34 2684 2342 A 103 GLN H A 104 SER HBx 1.0 . 5.34 2685 2343 A 103 GLN HGy A 104 SER HBy 1.0 . 4.57 2686 2343 A 103 GLN HGy A 104 SER HBx 1.0 . 4.57 2687 2344 A 104 SER H A 104 SER HBy 1.0 . 2.97 2688 2344 A 104 SER H A 104 SER HBx 1.0 . 2.97 2689 2345 A 104 SER HA A 107 LYS HBy 1.0 . 4.46 2690 2345 A 104 SER HA A 107 LYS HBx 1.0 . 4.46 2691 2346 A 105 LEU H A 104 SER HBy 1.0 . 3.96 2692 2346 A 105 LEU H A 104 SER HBx 1.0 . 3.96 2693 2347 A 106 VAL H A 107 LYS HBy 1.0 . 5.16 2694 2347 A 106 VAL H A 107 LYS HBx 1.0 . 5.16 2695 2348 A 106 VAL H A 107 LYS HGy 1.0 . 5.34 2696 2348 A 106 VAL H A 107 LYS HGx 1.0 . 5.34 2697 2349 A 106 VAL HGx% A 107 LYS HGy 1.0 . 4.92 2698 2349 A 106 VAL HGx% A 107 LYS HGx 1.0 . 4.92 2699 2350 A 107 LYS H A 107 LYS HBy 1.0 . 2.51 2700 2350 A 107 LYS H A 107 LYS HBx 1.0 . 2.51 2701 2351 A 107 LYS H A 107 LYS HGy 1.0 . 2.68 2702 2351 A 107 LYS H A 107 LYS HGx 1.0 . 2.68 2703 2352 A 107 LYS HA A 107 LYS HBy 1.0 . 2.52 2704 2352 A 107 LYS HA A 107 LYS HBx 1.0 . 2.52 2705 2353 A 107 LYS HA A 107 LYS HGy 1.0 . 3.49 2706 2353 A 107 LYS HA A 107 LYS HGx 1.0 . 3.49 2707 2354 A 107 LYS HBx A 107 LYS HDy 1.0 . 3.25 2708 2354 A 107 LYS HBy A 107 LYS HDy 1.0 . 3.25 2709 2354 A 107 LYS HDx A 107 LYS HBy 1.0 . 3.25 2710 2354 A 107 LYS HBx A 107 LYS HDx 1.0 . 3.25 2711 2355 A 108 ALA H A 107 LYS HBy 1.0 . 3.74 2712 2355 A 108 ALA H A 107 LYS HBx 1.0 . 3.74 stop_ save_ save_DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.potential_type undefined _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 2 ILE C A 3 THR N A 3 THR CA A 3 THR C 1.0 -92.30 238.94 PHI 2 2 A 3 THR N A 3 THR CA A 3 THR C A 4 ASP N 1.0 12.27 344.31 PSI 3 3 A 4 ASP C A 5 ILE N A 5 ILE CA A 5 ILE C 1.0 -79.57 252.25 PHI 4 4 A 5 ILE N A 5 ILE CA A 5 ILE C A 6 LEU N 1.0 -8.54 312.64 PSI 5 5 A 5 ILE C A 6 LEU N A 6 LEU CA A 6 LEU C 1.0 -97.14 234.00 PHI 6 6 A 6 LEU N A 6 LEU CA A 6 LEU C A 7 SER N 1.0 164.82 499.30 PSI 7 7 A 6 LEU C A 7 SER N A 7 SER CA A 7 SER C 1.0 -59.71 241.87 PHI 8 8 A 7 SER N A 7 SER CA A 7 SER C A 8 ALA N 1.0 159.46 490.86 PSI 9 9 A 7 SER C A 8 ALA N A 8 ALA CA A 8 ALA C 1.0 -55.16 295.64 PHI 10 10 A 8 ALA N A 8 ALA CA A 8 ALA C A 9 LYS N 1.0 -28.69 321.91 PSI 11 11 A 8 ALA C A 9 LYS N A 9 LYS CA A 9 LYS C 1.0 -60.31 289.55 PHI 12 12 A 9 LYS N A 9 LYS CA A 9 LYS C A 10 ASP N 1.0 -35.61 315.55 PSI 13 13 A 9 LYS C A 10 ASP N A 10 ASP CA A 10 ASP C 1.0 -63.13 284.91 PHI 14 14 A 10 ASP N A 10 ASP CA A 10 ASP C A 11 ILE N 1.0 -33.31 311.73 PSI 15 15 A 10 ASP C A 11 ILE N A 11 ILE CA A 11 ILE C 1.0 -61.60 291.08 PHI 16 16 A 11 ILE N A 11 ILE CA A 11 ILE C A 12 GLU N 1.0 -40.92 310.96 PSI 17 17 A 11 ILE C A 12 GLU N A 12 GLU CA A 12 GLU C 1.0 -56.41 292.43 PHI 18 18 A 12 GLU N A 12 GLU CA A 12 GLU C A 13 SER N 1.0 -36.36 313.14 PSI 19 19 A 12 GLU C A 13 SER N A 13 SER CA A 13 SER C 1.0 -59.85 290.69 PHI 20 20 A 13 SER N A 13 SER CA A 13 SER C A 14 ALA N 1.0 -35.56 313.62 PSI 21 21 A 13 SER C A 14 ALA N A 14 ALA CA A 14 ALA C 1.0 -57.51 288.81 PHI 22 22 A 14 ALA N A 14 ALA CA A 14 ALA C A 15 LEU N 1.0 -36.74 312.10 PSI 23 23 A 14 ALA C A 15 LEU N A 15 LEU CA A 15 LEU C 1.0 -56.97 290.81 PHI 24 24 A 15 LEU N A 15 LEU CA A 15 LEU C A 16 SER N 1.0 -34.89 309.63 PSI 25 25 A 15 LEU C A 16 SER N A 16 SER CA A 16 SER C 1.0 -57.42 290.16 PHI 26 26 A 16 SER N A 16 SER CA A 16 SER C A 17 SER N 1.0 -27.30 311.68 PSI 27 27 A 16 SER C A 17 SER N A 17 SER CA A 17 SER C 1.0 -59.45 275.65 PHI 28 28 A 17 SER N A 17 SER CA A 17 SER C A 18 CYS N 1.0 -8.27 325.45 PSI 29 29 A 19 GLN C A 20 ALA N A 20 ALA CA A 20 ALA C 1.0 -78.28 246.26 PHI 30 30 A 20 ALA N A 20 ALA CA A 20 ALA C A 21 ALA N 1.0 20.44 337.76 PSI 31 31 A 21 ALA C A 22 ASP N A 22 ASP CA A 22 ASP C 1.0 -60.48 285.20 PHI 32 32 A 22 ASP N A 22 ASP CA A 22 ASP C A 23 SER N 1.0 -15.29 329.47 PSI 33 33 A 22 ASP C A 23 SER N A 23 SER CA A 23 SER C 1.0 -85.27 255.41 PHI 34 34 A 23 SER N A 23 SER CA A 23 SER C A 24 PHE N 1.0 8.55 328.85 PSI 35 35 A 23 SER C A 24 PHE N A 24 PHE CA A 24 PHE C 1.0 -57.44 265.22 PHI 36 36 A 24 PHE N A 24 PHE CA A 24 PHE C A 25 ASN N 1.0 145.33 488.11 PSI 37 37 A 25 ASN C A 26 TYR N A 26 TYR CA A 26 TYR C 1.0 -49.68 296.08 PHI 38 38 A 26 TYR N A 26 TYR CA A 26 TYR C A 27 LYS N 1.0 -29.82 304.50 PSI 39 39 A 26 TYR C A 27 LYS N A 27 LYS CA A 27 LYS C 1.0 -57.52 294.80 PHI 40 40 A 27 LYS N A 27 LYS CA A 27 LYS C A 28 SER N 1.0 -38.95 313.01 PSI 41 41 A 27 LYS C A 28 SER N A 28 SER CA A 28 SER C 1.0 -62.46 290.42 PHI 42 42 A 28 SER N A 28 SER CA A 28 SER C A 29 PHE N 1.0 -34.37 313.31 PSI 43 43 A 28 SER C A 29 PHE N A 29 PHE CA A 29 PHE C 1.0 -59.30 286.18 PHI 44 44 A 29 PHE N A 29 PHE CA A 29 PHE C A 30 PHE N 1.0 -37.28 314.44 PSI 45 45 A 29 PHE C A 30 PHE N A 30 PHE CA A 30 PHE C 1.0 -54.20 295.56 PHI 46 46 A 30 PHE N A 30 PHE CA A 30 PHE C A 31 SER N 1.0 -37.07 310.03 PSI 47 47 A 30 PHE C A 31 SER N A 31 SER CA A 31 SER C 1.0 -60.64 288.90 PHI 48 48 A 31 SER N A 31 SER CA A 31 SER C A 32 THR N 1.0 -32.43 314.59 PSI 49 49 A 31 SER C A 32 THR N A 32 THR CA A 32 THR C 1.0 -57.21 295.31 PHI 50 50 A 32 THR N A 32 THR CA A 32 THR C A 33 VAL N 1.0 -36.62 315.16 PSI 51 51 A 32 THR C A 33 VAL N A 33 VAL CA A 33 VAL C 1.0 -70.13 266.11 PHI 52 52 A 33 VAL N A 33 VAL CA A 33 VAL C A 34 GLY N 1.0 15.79 343.35 PSI 53 53 A 34 GLY C A 35 LEU N A 35 LEU CA A 35 LEU C 1.0 -59.51 277.07 PHI 54 54 A 35 LEU N A 35 LEU CA A 35 LEU C A 36 SER N 1.0 -9.28 316.56 PSI 55 55 A 36 SER C A 37 SER N A 37 SER CA A 37 SER C 1.0 -84.72 249.00 PHI 56 56 A 37 SER N A 37 SER CA A 37 SER C A 38 LYS N 1.0 15.25 331.67 PSI 57 57 A 40 PRO N A 40 PRO CA A 40 PRO C A 41 ASP N 1.0 -23.40 318.38 PSI 58 58 A 40 PRO C A 41 ASP N A 41 ASP CA A 41 ASP C 1.0 -57.55 290.33 PHI 59 59 A 41 ASP N A 41 ASP CA A 41 ASP C A 42 GLN N 1.0 -31.70 313.14 PSI 60 60 A 41 ASP C A 42 GLN N A 42 GLN CA A 42 GLN C 1.0 -59.92 286.84 PHI 61 61 A 42 GLN N A 42 GLN CA A 42 GLN C A 43 ILE N 1.0 -35.40 308.70 PSI 62 62 A 42 GLN C A 43 ILE N A 43 ILE CA A 43 ILE C 1.0 -59.08 290.84 PHI 63 63 A 43 ILE N A 43 ILE CA A 43 ILE C A 44 LYS N 1.0 -35.65 309.01 PSI 64 64 A 43 ILE C A 44 LYS N A 44 LYS CA A 44 LYS C 1.0 -59.52 290.74 PHI 65 65 A 44 LYS N A 44 LYS CA A 44 LYS C A 45 LYS N 1.0 -34.60 315.70 PSI 66 66 A 44 LYS C A 45 LYS N A 45 LYS CA A 45 LYS C 1.0 -62.07 290.57 PHI 67 67 A 45 LYS N A 45 LYS CA A 45 LYS C A 46 VAL N 1.0 -38.13 313.23 PSI 68 68 A 45 LYS C A 46 VAL N A 46 VAL CA A 46 VAL C 1.0 -60.07 285.77 PHI 69 69 A 46 VAL N A 46 VAL CA A 46 VAL C A 47 PHE N 1.0 -21.53 314.61 PSI 70 70 A 48 GLY C A 49 ILE N A 49 ILE CA A 49 ILE C 1.0 -56.32 291.72 PHI 71 71 A 49 ILE N A 49 ILE CA A 49 ILE C A 50 LEU N 1.0 -33.58 311.40 PSI 72 72 A 49 ILE C A 50 LEU N A 50 LEU CA A 50 LEU C 1.0 -56.04 278.36 PHI 73 73 A 50 LEU N A 50 LEU CA A 50 LEU C A 51 ASP N 1.0 -22.76 305.66 PSI 74 74 A 51 ASP C A 52 GLN N A 52 GLN CA A 52 GLN C 1.0 -45.78 292.30 PHI 75 75 A 52 GLN N A 52 GLN CA A 52 GLN C A 53 ASP N 1.0 -27.94 312.66 PSI 76 76 A 52 GLN C A 53 ASP N A 53 ASP CA A 53 ASP C 1.0 -82.94 258.40 PHI 77 77 A 53 ASP N A 53 ASP CA A 53 ASP C A 54 LYS N 1.0 18.70 346.50 PSI 78 78 A 55 SER C A 56 GLY N A 56 GLY CA A 56 GLY C 1.0 91.59 432.01 PHI 79 79 A 56 GLY N A 56 GLY CA A 56 GLY C A 57 PHE N 1.0 12.83 358.89 PSI 80 80 A 56 GLY C A 57 PHE N A 57 PHE CA A 57 PHE C 1.0 -127.60 206.60 PHI 81 81 A 57 PHE N A 57 PHE CA A 57 PHE C A 58 ILE N 1.0 160.68 497.90 PSI 82 82 A 57 PHE C A 58 ILE N A 58 ILE CA A 58 ILE C 1.0 -83.59 245.01 PHI 83 83 A 58 ILE N A 58 ILE CA A 58 ILE C A 59 GLU N 1.0 132.04 474.06 PSI 84 84 A 59 GLU C A 60 GLU N A 60 GLU CA A 60 GLU C 1.0 -53.38 295.86 PHI 85 85 A 60 GLU N A 60 GLU CA A 60 GLU C A 61 GLU N 1.0 -31.23 311.17 PSI 86 86 A 60 GLU C A 61 GLU N A 61 GLU CA A 61 GLU C 1.0 -54.92 295.58 PHI 87 87 A 61 GLU N A 61 GLU CA A 61 GLU C A 62 GLU N 1.0 -36.67 311.55 PSI 88 88 A 61 GLU C A 62 GLU N A 62 GLU CA A 62 GLU C 1.0 -59.82 287.28 PHI 89 89 A 62 GLU N A 62 GLU CA A 62 GLU C A 63 LEU N 1.0 -38.18 311.62 PSI 90 90 A 62 GLU C A 63 LEU N A 63 LEU CA A 63 LEU C 1.0 -59.95 292.71 PHI 91 91 A 63 LEU N A 63 LEU CA A 63 LEU C A 64 GLN N 1.0 -33.53 315.95 PSI 92 92 A 63 LEU C A 64 GLN N A 64 GLN CA A 64 GLN C 1.0 -56.10 290.92 PHI 93 93 A 64 GLN N A 64 GLN CA A 64 GLN C A 65 LEU N 1.0 -22.99 322.91 PSI 94 94 A 64 GLN C A 65 LEU N A 65 LEU CA A 65 LEU C 1.0 -65.17 256.43 PHI 95 95 A 65 LEU N A 65 LEU CA A 65 LEU C A 66 PHE N 1.0 5.13 317.31 PSI 96 96 A 65 LEU C A 66 PHE N A 66 PHE CA A 66 PHE C 1.0 -50.33 294.61 PHI 97 97 A 66 PHE N A 66 PHE CA A 66 PHE C A 67 LEU N 1.0 -38.84 304.42 PSI 98 98 A 66 PHE C A 67 LEU N A 67 LEU CA A 67 LEU C 1.0 -56.33 290.69 PHI 99 99 A 67 LEU N A 67 LEU CA A 67 LEU C A 68 LYS N 1.0 -20.34 308.74 PSI 100 100 A 67 LEU C A 68 LYS N A 68 LYS CA A 68 LYS C 1.0 -60.52 279.92 PHI 101 101 A 68 LYS N A 68 LYS CA A 68 LYS C A 69 ASN N 1.0 -16.93 315.83 PSI 102 102 A 71 SER C A 72 SER N A 72 SER CA A 72 SER C 1.0 -56.95 292.87 PHI 103 103 A 72 SER N A 72 SER CA A 72 SER C A 73 SER N 1.0 -17.94 325.96 PSI 104 104 A 72 SER C A 73 SER N A 73 SER CA A 73 SER C 1.0 -75.81 257.69 PHI 105 105 A 73 SER N A 73 SER CA A 73 SER C A 74 ALA N 1.0 5.63 349.07 PSI 106 106 A 73 SER C A 74 ALA N A 74 ALA CA A 74 ALA C 1.0 -73.16 227.70 PHI 107 107 A 74 ALA N A 74 ALA CA A 74 ALA C A 75 ARG N 1.0 166.11 490.91 PSI 108 108 A 77 LEU C A 78 THR N A 78 THR CA A 78 THR C 1.0 -71.98 255.62 PHI 109 109 A 78 THR N A 78 THR CA A 78 THR C A 79 SER N 1.0 171.31 521.45 PSI 110 110 A 78 THR C A 79 SER N A 79 SER CA A 79 SER C 1.0 -54.72 295.74 PHI 111 111 A 79 SER N A 79 SER CA A 79 SER C A 80 ALA N 1.0 -29.19 316.55 PSI 112 112 A 79 SER C A 80 ALA N A 80 ALA CA A 80 ALA C 1.0 -54.89 292.95 PHI 113 113 A 80 ALA N A 80 ALA CA A 80 ALA C A 81 GLU N 1.0 -37.45 308.37 PSI 114 114 A 80 ALA C A 81 GLU N A 81 GLU CA A 81 GLU C 1.0 -58.97 286.61 PHI 115 115 A 81 GLU N A 81 GLU CA A 81 GLU C A 82 THR N 1.0 -37.12 313.32 PSI 116 116 A 81 GLU C A 82 THR N A 82 THR CA A 82 THR C 1.0 -61.75 290.75 PHI 117 117 A 82 THR N A 82 THR CA A 82 THR C A 83 LYS N 1.0 -37.43 310.91 PSI 118 118 A 82 THR C A 83 LYS N A 83 LYS CA A 83 LYS C 1.0 -56.07 291.51 PHI 119 119 A 83 LYS N A 83 LYS CA A 83 LYS C A 84 ALA N 1.0 -32.60 311.72 PSI 120 120 A 83 LYS C A 84 ALA N A 84 ALA CA A 84 ALA C 1.0 -58.45 290.93 PHI 121 121 A 84 ALA N A 84 ALA CA A 84 ALA C A 85 PHE N 1.0 -32.52 312.36 PSI 122 122 A 84 ALA C A 85 PHE N A 85 PHE CA A 85 PHE C 1.0 -57.01 284.39 PHI 123 123 A 85 PHE N A 85 PHE CA A 85 PHE C A 86 LEU N 1.0 -28.39 310.39 PSI 124 124 A 85 PHE C A 86 LEU N A 86 LEU CA A 86 LEU C 1.0 -55.45 294.33 PHI 125 125 A 86 LEU N A 86 LEU CA A 86 LEU C A 87 ALA N 1.0 -30.16 316.82 PSI 126 126 A 86 LEU C A 87 ALA N A 87 ALA CA A 87 ALA C 1.0 -52.06 294.36 PHI 127 127 A 87 ALA N A 87 ALA CA A 87 ALA C A 88 ALA N 1.0 -33.19 312.99 PSI 128 128 A 87 ALA C A 88 ALA N A 88 ALA CA A 88 ALA C 1.0 -60.05 288.13 PHI 129 129 A 88 ALA N A 88 ALA CA A 88 ALA C A 89 GLY N 1.0 -26.93 311.97 PSI 130 130 A 89 GLY C A 90 ASP N A 90 ASP CA A 90 ASP C 1.0 -70.63 256.85 PHI 131 131 A 90 ASP N A 90 ASP CA A 90 ASP C A 91 THR N 1.0 100.22 421.38 PSI 132 132 A 93 GLY C A 94 ASP N A 94 ASP CA A 94 ASP C 1.0 -82.04 257.34 PHI 133 133 A 94 ASP N A 94 ASP CA A 94 ASP C A 95 GLY N 1.0 12.19 354.39 PSI 134 134 A 95 GLY C A 96 LYS N A 96 LYS CA A 96 LYS C 1.0 -107.55 208.55 PHI 135 135 A 96 LYS N A 96 LYS CA A 96 LYS C A 97 ILE N 1.0 173.13 506.55 PSI 136 136 A 96 LYS C A 97 ILE N A 97 ILE CA A 97 ILE C 1.0 -76.76 239.04 PHI 137 137 A 97 ILE N A 97 ILE CA A 97 ILE C A 98 GLY N 1.0 145.31 481.79 PSI 138 138 A 98 GLY C A 99 VAL N A 99 VAL CA A 99 VAL C 1.0 -50.00 296.80 PHI 139 139 A 99 VAL N A 99 VAL CA A 99 VAL C A 100 GLU N 1.0 -38.05 304.87 PSI 140 140 A 99 VAL C A 100 GLU N A 100 GLU CA A 100 GLU C 1.0 -57.19 293.85 PHI 141 141 A 100 GLU N A 100 GLU CA A 100 GLU C A 101 GLU N 1.0 -31.97 309.09 PSI 142 142 A 100 GLU C A 101 GLU N A 101 GLU CA A 101 GLU C 1.0 -61.59 292.77 PHI 143 143 A 101 GLU N A 101 GLU CA A 101 GLU C A 102 PHE N 1.0 -33.92 314.52 PSI 144 144 A 101 GLU C A 102 PHE N A 102 PHE CA A 102 PHE C 1.0 -61.40 290.72 PHI 145 145 A 102 PHE N A 102 PHE CA A 102 PHE C A 103 GLN N 1.0 -32.67 310.17 PSI 146 146 A 102 PHE C A 103 GLN N A 103 GLN CA A 103 GLN C 1.0 -53.19 294.39 PHI 147 147 A 103 GLN N A 103 GLN CA A 103 GLN C A 104 SER N 1.0 -37.47 308.61 PSI 148 148 A 103 GLN C A 104 SER N A 104 SER CA A 104 SER C 1.0 -56.03 292.95 PHI 149 149 A 104 SER N A 104 SER CA A 104 SER C A 105 LEU N 1.0 -34.84 310.44 PSI stop_ save_