data_nef_c17612_2lch save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_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 MET start . . 2 A 2 GLY middle . false 3 A 3 SER middle . . 4 A 4 HIS middle . . 5 A 5 GLN middle . . 6 A 6 GLU middle . . 7 A 7 TYR middle . . 8 A 8 ILE middle . . 9 A 9 LYS middle . . 10 A 10 LYS middle . . 11 A 11 VAL middle . . 12 A 12 THR middle . . 13 A 13 ASP middle . . 14 A 14 GLU middle . . 15 A 15 LEU middle . . 16 A 16 LYS middle . . 17 A 17 GLU middle . . 18 A 18 LEU middle . . 19 A 19 ILE middle . . 20 A 20 GLN middle . . 21 A 21 ASN middle . . 22 A 22 VAL middle . . 23 A 23 ASN middle . . 24 A 24 ASP middle . . 25 A 25 ASP middle . . 26 A 26 ILE middle . . 27 A 27 LYS middle . . 28 A 28 GLU middle . . 29 A 29 VAL middle . . 30 A 30 GLU middle . . 31 A 31 LYS middle . . 32 A 32 ASN middle . . 33 A 33 PRO middle . false 34 A 34 GLU middle . . 35 A 35 ASP middle . . 36 A 36 MET middle . . 37 A 37 GLU middle . . 38 A 38 TYR middle . . 39 A 39 TRP middle . . 40 A 40 ASN middle . . 41 A 41 LYS middle . . 42 A 42 ILE middle . . 43 A 43 TYR middle . . 44 A 44 ARG middle . . 45 A 45 LEU middle . . 46 A 46 VAL middle . . 47 A 47 HIS middle . . 48 A 48 THR middle . . 49 A 49 MET middle . . 50 A 50 LYS middle . . 51 A 51 GLU middle . . 52 A 52 ILE middle . . 53 A 53 THR middle . . 54 A 54 GLU middle . . 55 A 55 THR middle . . 56 A 56 MET middle . . 57 A 57 GLY middle . false 58 A 58 PHE middle . . 59 A 59 SER middle . . 60 A 60 SER middle . . 61 A 61 VAL middle . . 62 A 62 ALA middle . . 63 A 63 LYS middle . . 64 A 64 VAL middle . . 65 A 65 LEU middle . . 66 A 66 HIS middle . . 67 A 67 THR middle . . 68 A 68 ILE middle . . 69 A 69 MET middle . . 70 A 70 ASN middle . . 71 A 71 LEU middle . . 72 A 72 VAL middle . . 73 A 73 ASP middle . . 74 A 74 LYS middle . . 75 A 75 MET middle . . 76 A 76 LEU middle . . 77 A 77 ASN middle . . 78 A 78 SER middle . . 79 A 79 GLU middle . . 80 A 80 ILE middle . . 81 A 81 LYS middle . . 82 A 82 ILE middle . . 83 A 83 THR middle . . 84 A 84 SER middle . . 85 A 85 ASP middle . . 86 A 86 LEU middle . . 87 A 87 ILE middle . . 88 A 88 ASP middle . . 89 A 89 LYS middle . . 90 A 90 VAL middle . . 91 A 91 LYS middle . . 92 A 92 LYS middle . . 93 A 93 LYS middle . . 94 A 94 LEU middle . . 95 A 95 ASP middle . . 96 A 96 MET middle . . 97 A 97 VAL middle . . 98 A 98 THR middle . . 99 A 99 ARG middle . . 100 A 100 GLU middle . . 101 A 101 LEU middle . . 102 A 102 ASP middle . . 103 A 103 LYS middle . . 104 A 104 LYS middle . . 105 A 105 VAL middle . . 106 A 106 SER middle . . 107 A 107 GLY middle . false 108 A 108 SER middle . . 109 A 109 TYR middle . . 110 A 110 LEU middle . . 111 A 111 VAL middle . . 112 A 112 PRO middle . false 113 A 113 ARG 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 GLY HAx H 1 3.910 0.020 A 2 GLY HAy H 1 3.910 0.020 A 2 GLY CA C 13 43.503 0.300 A 4 HIS HA H 1 4.589 0.020 A 4 HIS HBx H 1 3.180 0.020 A 4 HIS HBy H 1 3.180 0.020 A 4 HIS HD2 H 1 7.047 0.020 A 4 HIS CA C 13 58.691 0.300 A 4 HIS CB C 13 30.166 0.300 A 4 HIS CD2 C 13 119.252 0.300 A 5 GLN HA H 1 3.996 0.020 A 5 GLN HBy H 1 2.088 0.020 A 5 GLN HBx H 1 2.047 0.020 A 5 GLN HE2y H 1 7.214 0.020 A 5 GLN HE2x H 1 7.073 0.020 A 5 GLN HGy H 1 2.419 0.020 A 5 GLN HGx H 1 2.377 0.020 A 5 GLN C C 13 178.083 0.300 A 5 GLN CA C 13 58.933 0.300 A 5 GLN CB C 13 28.189 0.300 A 5 GLN CG C 13 34.090 0.300 A 5 GLN NE2 N 15 110.615 0.300 A 6 GLU H H 1 8.144 0.020 A 6 GLU HA H 1 4.037 0.020 A 6 GLU HBx H 1 2.080 0.020 A 6 GLU HBy H 1 2.080 0.020 A 6 GLU HGy H 1 2.346 0.020 A 6 GLU HGx H 1 2.290 0.020 A 6 GLU C C 13 178.298 0.300 A 6 GLU CA C 13 58.917 0.300 A 6 GLU CB C 13 29.503 0.300 A 6 GLU CG C 13 36.647 0.300 A 6 GLU N N 15 119.732 0.300 A 7 TYR H H 1 7.964 0.020 A 7 TYR HA H 1 4.361 0.020 A 7 TYR HB2 H 1 3.174 0.020 A 7 TYR HB3 H 1 3.100 0.020 A 7 TYR HDx H 1 7.023 0.020 A 7 TYR HDy H 1 7.023 0.020 A 7 TYR HEx H 1 6.731 0.020 A 7 TYR HEy H 1 6.731 0.020 A 7 TYR C C 13 176.609 0.300 A 7 TYR CA C 13 60.558 0.300 A 7 TYR CB C 13 37.802 0.300 A 7 TYR CD1 C 13 132.685 0.300 A 7 TYR CE1 C 13 118.223 0.300 A 7 TYR N N 15 121.809 0.300 A 8 ILE H H 1 8.076 0.020 A 8 ILE HA H 1 3.550 0.020 A 8 ILE HB H 1 1.912 0.020 A 8 ILE HD1% H 1 0.797 0.020 A 8 ILE HG1y H 1 1.424 0.020 A 8 ILE HG1x H 1 1.184 0.020 A 8 ILE HG2% H 1 0.860 0.020 A 8 ILE C C 13 178.724 0.300 A 8 ILE CA C 13 62.962 0.300 A 8 ILE CB C 13 36.940 0.300 A 8 ILE CD1 C 13 11.623 0.300 A 8 ILE CG1 C 13 27.992 0.300 A 8 ILE CG2 C 13 17.296 0.300 A 8 ILE N N 15 118.625 0.300 A 9 LYS H H 1 7.998 0.020 A 9 LYS HA H 1 3.938 0.020 A 9 LYS HBy H 1 1.897 0.020 A 9 LYS HBx H 1 1.856 0.020 A 9 LYS HDx H 1 1.681 0.020 A 9 LYS HDy H 1 1.681 0.020 A 9 LYS HEx H 1 2.967 0.020 A 9 LYS HEy H 1 2.967 0.020 A 9 LYS HGy H 1 1.441 0.020 A 9 LYS HGx H 1 1.398 0.020 A 9 LYS C C 13 177.204 0.300 A 9 LYS CA C 13 59.430 0.300 A 9 LYS CB C 13 32.170 0.300 A 9 LYS CD C 13 29.003 0.300 A 9 LYS CE C 13 42.054 0.300 A 9 LYS CG C 13 25.021 0.300 A 9 LYS N N 15 122.943 0.300 A 10 LYS H H 1 7.793 0.020 A 10 LYS HA H 1 3.979 0.020 A 10 LYS HBx H 1 1.931 0.020 A 10 LYS HBy H 1 1.931 0.020 A 10 LYS HDy H 1 1.691 0.020 A 10 LYS HDx H 1 1.633 0.020 A 10 LYS HEy H 1 2.901 0.020 A 10 LYS HEx H 1 2.856 0.020 A 10 LYS HGx H 1 1.384 0.020 A 10 LYS HGy H 1 1.384 0.020 A 10 LYS C C 13 179.665 0.300 A 10 LYS CA C 13 59.386 0.300 A 10 LYS CB C 13 32.432 0.300 A 10 LYS CD C 13 29.461 0.300 A 10 LYS CE C 13 42.054 0.300 A 10 LYS CG C 13 25.021 0.300 A 10 LYS N N 15 119.595 0.300 A 11 VAL H H 1 8.166 0.020 A 11 VAL HA H 1 3.880 0.020 A 11 VAL HB H 1 1.906 0.020 A 11 VAL HGx% H 1 0.734 0.020 A 11 VAL HGy% H 1 0.734 0.020 A 11 VAL C C 13 178.259 0.300 A 11 VAL CA C 13 65.597 0.300 A 11 VAL CB C 13 31.964 0.300 A 11 VAL N N 15 118.041 0.300 A 12 THR H H 1 8.293 0.020 A 12 THR HA H 1 3.902 0.020 A 12 THR HB H 1 4.267 0.020 A 12 THR HG2% H 1 1.252 0.020 A 12 THR C C 13 176.677 0.300 A 12 THR CA C 13 67.123 0.300 A 12 THR CB C 13 68.112 0.300 A 12 THR CG2 C 13 22.062 0.300 A 12 THR N N 15 114.990 0.300 A 13 ASP H H 1 8.351 0.020 A 13 ASP HA H 1 4.435 0.020 A 13 ASP HBy H 1 2.918 0.020 A 13 ASP HBx H 1 2.633 0.020 A 13 ASP C C 13 179.337 0.300 A 13 ASP CA C 13 57.745 0.300 A 13 ASP CB C 13 39.572 0.300 A 13 ASP N N 15 122.990 0.300 A 14 GLU H H 1 7.872 0.020 A 14 GLU HA H 1 4.058 0.020 A 14 GLU HBy H 1 2.206 0.020 A 14 GLU HBx H 1 2.107 0.020 A 14 GLU HGy H 1 2.404 0.020 A 14 GLU HGx H 1 2.144 0.020 A 14 GLU C C 13 179.559 0.300 A 14 GLU CA C 13 59.738 0.300 A 14 GLU CB C 13 29.083 0.300 A 14 GLU CG C 13 36.062 0.300 A 14 GLU N N 15 121.856 0.300 A 15 LEU H H 1 8.483 0.020 A 15 LEU HA H 1 4.021 0.020 A 15 LEU HB2 H 1 1.391 0.020 A 15 LEU HB3 H 1 2.088 0.020 A 15 LEU HDx% H 1 0.869 0.020 A 15 LEU HDy% H 1 0.964 0.020 A 15 LEU HG H 1 1.466 0.020 A 15 LEU C C 13 178.317 0.300 A 15 LEU CA C 13 58.159 0.300 A 15 LEU CB C 13 42.217 0.300 A 15 LEU CD1 C 13 24.942 0.300 A 15 LEU CD2 C 13 23.562 0.300 A 15 LEU CG C 13 27.012 0.300 A 15 LEU N N 15 119.623 0.300 A 16 LYS H H 1 8.379 0.020 A 16 LYS HA H 1 3.886 0.020 A 16 LYS HBy H 1 1.997 0.020 A 16 LYS HBx H 1 1.897 0.020 A 16 LYS HDx H 1 1.688 0.020 A 16 LYS HDy H 1 1.688 0.020 A 16 LYS HEx H 1 2.941 0.020 A 16 LYS HEy H 1 2.941 0.020 A 16 LYS HGy H 1 1.707 0.020 A 16 LYS HGx H 1 1.405 0.020 A 16 LYS C C 13 179.489 0.300 A 16 LYS CA C 13 60.105 0.300 A 16 LYS CB C 13 32.081 0.300 A 16 LYS CD C 13 29.193 0.300 A 16 LYS CE C 13 41.980 0.300 A 16 LYS CG C 13 26.026 0.300 A 16 LYS N N 15 117.822 0.300 A 17 GLU H H 1 7.710 0.020 A 17 GLU HA H 1 4.095 0.020 A 17 GLU HBx H 1 2.148 0.020 A 17 GLU HBy H 1 2.148 0.020 A 17 GLU HGy H 1 2.377 0.020 A 17 GLU HGx H 1 2.253 0.020 A 17 GLU C C 13 178.632 0.300 A 17 GLU CA C 13 59.386 0.300 A 17 GLU CB C 13 29.249 0.300 A 17 GLU CG C 13 36.041 0.300 A 17 GLU N N 15 120.797 0.300 A 18 LEU H H 1 7.957 0.020 A 18 LEU HA H 1 4.046 0.020 A 18 LEU HB2 H 1 2.213 0.020 A 18 LEU HB3 H 1 2.088 0.020 A 18 LEU HDx% H 1 0.944 0.020 A 18 LEU HDy% H 1 0.840 0.020 A 18 LEU HG H 1 1.410 0.020 A 18 LEU C C 13 179.430 0.300 A 18 LEU CA C 13 58.566 0.300 A 18 LEU CB C 13 42.042 0.300 A 18 LEU CDx C 13 25.980 0.300 A 18 LEU CDy C 13 25.980 0.300 A 18 LEU CG C 13 29.371 0.300 A 18 LEU N N 15 120.815 0.300 A 19 ILE H H 1 8.467 0.020 A 19 ILE HA H 1 3.490 0.020 A 19 ILE HB H 1 1.854 0.020 A 19 ILE HD1% H 1 0.776 0.020 A 19 ILE HG12 H 1 0.801 0.020 A 19 ILE HG13 H 1 1.860 0.020 A 19 ILE HG2% H 1 0.858 0.020 A 19 ILE C C 13 177.673 0.300 A 19 ILE CA C 13 65.245 0.300 A 19 ILE CB C 13 37.842 0.300 A 19 ILE CD1 C 13 13.767 0.300 A 19 ILE CG1 C 13 30.572 0.300 A 19 ILE CG2 C 13 17.374 0.300 A 19 ILE N N 15 119.518 0.300 A 20 GLN H H 1 7.773 0.020 A 20 GLN HA H 1 3.988 0.020 A 20 GLN HBx H 1 2.221 0.020 A 20 GLN HBy H 1 2.221 0.020 A 20 GLN HE2y H 1 7.684 0.020 A 20 GLN HE2x H 1 6.882 0.020 A 20 GLN HGx H 1 2.403 0.020 A 20 GLN HGy H 1 2.403 0.020 A 20 GLN C C 13 177.990 0.300 A 20 GLN CA C 13 58.800 0.300 A 20 GLN CB C 13 27.809 0.300 A 20 GLN CG C 13 33.469 0.300 A 20 GLN N N 15 119.992 0.300 A 20 GLN NE2 N 15 114.937 0.300 A 21 ASN H H 1 8.172 0.020 A 21 ASN HA H 1 4.485 0.020 A 21 ASN HBy H 1 3.080 0.020 A 21 ASN HBx H 1 2.909 0.020 A 21 ASN HD2y H 1 7.577 0.020 A 21 ASN HD2x H 1 6.949 0.020 A 21 ASN C C 13 177.723 0.300 A 21 ASN CA C 13 56.222 0.300 A 21 ASN CB C 13 38.571 0.300 A 21 ASN N N 15 117.797 0.300 A 21 ASN ND2 N 15 112.185 0.300 A 22 VAL H H 1 8.574 0.020 A 22 VAL HA H 1 3.673 0.020 A 22 VAL HB H 1 2.188 0.020 A 22 VAL HGx% H 1 0.943 0.020 A 22 VAL HGy% H 1 1.095 0.020 A 22 VAL C C 13 177.296 0.300 A 22 VAL CA C 13 66.643 0.300 A 22 VAL CB C 13 30.931 0.300 A 22 VAL CG1 C 13 23.104 0.300 A 22 VAL CG2 C 13 25.390 0.300 A 22 VAL N N 15 120.531 0.300 A 23 ASN H H 1 8.484 0.020 A 23 ASN HA H 1 4.295 0.020 A 23 ASN HB2 H 1 2.896 0.020 A 23 ASN HB3 H 1 2.665 0.020 A 23 ASN HD2y H 1 7.129 0.020 A 23 ASN HD2x H 1 6.757 0.020 A 23 ASN C C 13 178.669 0.300 A 23 ASN CA C 13 56.412 0.300 A 23 ASN CB C 13 37.916 0.300 A 23 ASN N N 15 119.585 0.300 A 23 ASN ND2 N 15 110.667 0.300 A 24 ASP H H 1 8.341 0.020 A 24 ASP HA H 1 4.436 0.020 A 24 ASP HBy H 1 2.893 0.020 A 24 ASP HBx H 1 2.676 0.020 A 24 ASP C C 13 178.854 0.300 A 24 ASP CA C 13 57.527 0.300 A 24 ASP CB C 13 39.815 0.300 A 24 ASP N N 15 121.739 0.300 A 25 ASP H H 1 8.087 0.020 A 25 ASP HA H 1 4.392 0.020 A 25 ASP HB2 H 1 2.414 0.020 A 25 ASP HB3 H 1 2.802 0.020 A 25 ASP C C 13 178.780 0.300 A 25 ASP CA C 13 57.511 0.300 A 25 ASP CB C 13 39.479 0.300 A 25 ASP N N 15 122.666 0.300 A 26 ILE H H 1 8.709 0.020 A 26 ILE HA H 1 3.546 0.020 A 26 ILE HB H 1 2.023 0.020 A 26 ILE HD1% H 1 0.672 0.020 A 26 ILE HG1y H 1 1.579 0.020 A 26 ILE HG1x H 1 1.024 0.020 A 26 ILE HG2% H 1 0.750 0.020 A 26 ILE C C 13 177.047 0.300 A 26 ILE CA C 13 62.784 0.300 A 26 ILE CB C 13 36.110 0.300 A 26 ILE CD1 C 13 12.377 0.300 A 26 ILE CG1 C 13 29.074 0.300 A 26 ILE CG2 C 13 17.300 0.300 A 26 ILE N N 15 122.326 0.300 A 27 LYS H H 1 7.315 0.020 A 27 LYS HA H 1 4.066 0.020 A 27 LYS HB2 H 1 1.941 0.020 A 27 LYS HB3 H 1 1.812 0.020 A 27 LYS HDx H 1 1.573 0.020 A 27 LYS HDy H 1 1.573 0.020 A 27 LYS HEx H 1 2.972 0.020 A 27 LYS HEy H 1 2.972 0.020 A 27 LYS HGy H 1 1.627 0.020 A 27 LYS HGx H 1 1.433 0.020 A 27 LYS C C 13 179.572 0.300 A 27 LYS CA C 13 59.152 0.300 A 27 LYS CB C 13 31.901 0.300 A 27 LYS CD C 13 29.224 0.300 A 27 LYS CE C 13 42.162 0.300 A 27 LYS CG C 13 25.105 0.300 A 27 LYS N N 15 118.066 0.300 A 28 GLU H H 1 7.028 0.020 A 28 GLU HA H 1 3.996 0.020 A 28 GLU HBx H 1 1.295 0.020 A 28 GLU HBy H 1 1.295 0.020 A 28 GLU HGy H 1 2.090 0.020 A 28 GLU HGx H 1 1.977 0.020 A 28 GLU C C 13 180.075 0.300 A 28 GLU CA C 13 57.679 0.300 A 28 GLU CB C 13 27.850 0.300 A 28 GLU CG C 13 34.691 0.300 A 28 GLU N N 15 115.851 0.300 A 29 VAL H H 1 7.606 0.020 A 29 VAL HA H 1 3.796 0.020 A 29 VAL HB H 1 1.608 0.020 A 29 VAL HGx% H 1 0.211 0.020 A 29 VAL HGy% H 1 0.266 0.020 A 29 VAL C C 13 177.262 0.300 A 29 VAL CA C 13 63.754 0.300 A 29 VAL CB C 13 30.891 0.300 A 29 VAL CG1 C 13 21.208 0.300 A 29 VAL CG2 C 13 22.325 0.300 A 29 VAL N N 15 119.685 0.300 A 30 GLU H H 1 7.906 0.020 A 30 GLU HA H 1 3.819 0.020 A 30 GLU HBy H 1 2.057 0.020 A 30 GLU HBx H 1 1.890 0.020 A 30 GLU HGy H 1 2.493 0.020 A 30 GLU HGx H 1 2.096 0.020 A 30 GLU C C 13 178.743 0.300 A 30 GLU CA C 13 59.301 0.300 A 30 GLU CB C 13 29.728 0.300 A 30 GLU CG C 13 37.817 0.300 A 30 GLU N N 15 118.004 0.300 A 31 LYS H H 1 6.923 0.020 A 31 LYS HA H 1 4.098 0.020 A 31 LYS HBy H 1 1.872 0.020 A 31 LYS HBx H 1 1.826 0.020 A 31 LYS HDx H 1 1.683 0.020 A 31 LYS HDy H 1 1.683 0.020 A 31 LYS HEx H 1 2.868 0.020 A 31 LYS HEy H 1 2.868 0.020 A 31 LYS HGx H 1 1.553 0.020 A 31 LYS HGy H 1 1.553 0.020 A 31 LYS C C 13 176.962 0.300 A 31 LYS CA C 13 57.799 0.300 A 31 LYS CB C 13 33.063 0.300 A 31 LYS CD C 13 29.481 0.300 A 31 LYS CE C 13 42.014 0.300 A 31 LYS CG C 13 24.947 0.300 A 31 LYS N N 15 115.367 0.300 A 32 ASN H H 1 7.400 0.020 A 32 ASN HA H 1 5.039 0.020 A 32 ASN HBy H 1 2.941 0.020 A 32 ASN HBx H 1 2.714 0.020 A 32 ASN HD2y H 1 7.921 0.020 A 32 ASN HD2x H 1 6.933 0.020 A 32 ASN C C 13 171.859 0.300 A 32 ASN CA C 13 50.952 0.300 A 32 ASN CB C 13 38.869 0.300 A 32 ASN N N 15 114.257 0.300 A 32 ASN ND2 N 15 112.826 0.300 A 33 PRO HA H 1 4.737 0.020 A 33 PRO HB2 H 1 2.016 0.020 A 33 PRO HB3 H 1 2.296 0.020 A 33 PRO HDy H 1 3.764 0.020 A 33 PRO HDx H 1 3.452 0.020 A 33 PRO HGx H 1 2.020 0.020 A 33 PRO HGy H 1 2.020 0.020 A 33 PRO C C 13 176.564 0.300 A 33 PRO CA C 13 65.236 0.300 A 33 PRO CB C 13 32.589 0.300 A 33 PRO CD C 13 50.051 0.300 A 33 PRO CG C 13 26.812 0.300 A 34 GLU H H 1 7.722 0.020 A 34 GLU HA H 1 4.503 0.020 A 34 GLU HBy H 1 2.401 0.020 A 34 GLU HBx H 1 1.923 0.020 A 34 GLU HGy H 1 2.310 0.020 A 34 GLU HGx H 1 2.264 0.020 A 34 GLU C C 13 176.164 0.300 A 34 GLU CA C 13 55.636 0.300 A 34 GLU CB C 13 28.844 0.300 A 34 GLU CG C 13 36.939 0.300 A 34 GLU N N 15 112.053 0.300 A 35 ASP H H 1 7.721 0.020 A 35 ASP HA H 1 4.702 0.020 A 35 ASP HBy H 1 3.265 0.020 A 35 ASP HBx H 1 2.688 0.020 A 35 ASP C C 13 176.275 0.300 A 35 ASP CA C 13 53.948 0.300 A 35 ASP CB C 13 40.028 0.300 A 35 ASP N N 15 119.261 0.300 A 36 MET H H 1 8.478 0.020 A 36 MET HA H 1 4.683 0.020 A 36 MET HBy H 1 2.214 0.020 A 36 MET HBx H 1 2.143 0.020 A 36 MET HE% H 1 2.060 0.020 A 36 MET HG2 H 1 3.027 0.020 A 36 MET HG3 H 1 2.771 0.020 A 36 MET C C 13 179.263 0.300 A 36 MET CA C 13 56.339 0.300 A 36 MET CB C 13 30.544 0.300 A 36 MET CE C 13 17.471 0.300 A 36 MET CG C 13 32.521 0.300 A 36 MET N N 15 124.147 0.300 A 37 GLU H H 1 8.569 0.020 A 37 GLU HA H 1 4.159 0.020 A 37 GLU HBy H 1 2.114 0.020 A 37 GLU HBx H 1 1.905 0.020 A 37 GLU HGy H 1 2.175 0.020 A 37 GLU HGx H 1 2.042 0.020 A 37 GLU C C 13 180.450 0.300 A 37 GLU CA C 13 59.503 0.300 A 37 GLU CB C 13 28.635 0.300 A 37 GLU CG C 13 36.007 0.300 A 37 GLU N N 15 121.405 0.300 A 38 TYR H H 1 7.542 0.020 A 38 TYR HA H 1 4.032 0.020 A 38 TYR HBy H 1 2.599 0.020 A 38 TYR HBx H 1 2.520 0.020 A 38 TYR HDx H 1 7.128 0.020 A 38 TYR HDy H 1 7.128 0.020 A 38 TYR C C 13 178.706 0.300 A 38 TYR CA C 13 63.019 0.300 A 38 TYR CB C 13 38.653 0.300 A 38 TYR CD1 C 13 132.800 0.300 A 38 TYR N N 15 117.494 0.300 A 39 TRP H H 1 7.416 0.020 A 39 TRP HA H 1 4.708 0.020 A 39 TRP HBx H 1 3.235 0.020 A 39 TRP HBy H 1 3.235 0.020 A 39 TRP HD1 H 1 7.238 0.020 A 39 TRP HE1 H 1 10.670 0.020 A 39 TRP HH2 H 1 6.770 0.020 A 39 TRP HZ2 H 1 7.109 0.020 A 39 TRP C C 13 178.316 0.300 A 39 TRP CA C 13 61.027 0.300 A 39 TRP CB C 13 29.548 0.300 A 39 TRP CD1 C 13 128.585 0.300 A 39 TRP CH2 C 13 122.257 0.300 A 39 TRP CZ2 C 13 114.827 0.300 A 39 TRP N N 15 118.339 0.300 A 39 TRP NE1 N 15 130.574 0.300 A 40 ASN H H 1 8.361 0.020 A 40 ASN HA H 1 4.503 0.020 A 40 ASN HBy H 1 2.917 0.020 A 40 ASN HBx H 1 2.733 0.020 A 40 ASN HD2y H 1 7.359 0.020 A 40 ASN HD2x H 1 6.999 0.020 A 40 ASN C C 13 177.555 0.300 A 40 ASN CA C 13 57.159 0.300 A 40 ASN CB C 13 38.914 0.300 A 40 ASN N N 15 118.079 0.300 A 40 ASN ND2 N 15 113.536 0.300 A 41 LYS H H 1 7.661 0.020 A 41 LYS HA H 1 4.011 0.020 A 41 LYS HBy H 1 2.061 0.020 A 41 LYS HBx H 1 1.963 0.020 A 41 LYS HGx H 1 1.543 0.020 A 41 LYS HGy H 1 1.543 0.020 A 41 LYS C C 13 179.337 0.300 A 41 LYS CA C 13 60.323 0.300 A 41 LYS CB C 13 32.583 0.300 A 41 LYS CG C 13 25.153 0.300 A 41 LYS N N 15 120.815 0.300 A 42 ILE H H 1 8.471 0.020 A 42 ILE HA H 1 3.696 0.020 A 42 ILE HB H 1 2.214 0.020 A 42 ILE HD1% H 1 0.305 0.020 A 42 ILE HG1y H 1 1.950 0.020 A 42 ILE HG1x H 1 0.978 0.020 A 42 ILE HG2% H 1 1.002 0.020 A 42 ILE C C 13 177.036 0.300 A 42 ILE CA C 13 66.183 0.300 A 42 ILE CB C 13 38.299 0.300 A 42 ILE CD1 C 13 13.681 0.300 A 42 ILE CG1 C 13 30.878 0.300 A 42 ILE CG2 C 13 16.057 0.300 A 42 ILE N N 15 119.928 0.300 A 43 TYR H H 1 8.813 0.020 A 43 TYR HA H 1 3.757 0.020 A 43 TYR HBy H 1 3.402 0.020 A 43 TYR HBx H 1 3.229 0.020 A 43 TYR HDx H 1 6.951 0.020 A 43 TYR HDy H 1 6.951 0.020 A 43 TYR HEx H 1 6.840 0.020 A 43 TYR HEy H 1 6.840 0.020 A 43 TYR C C 13 176.758 0.300 A 43 TYR CA C 13 63.181 0.300 A 43 TYR CB C 13 38.517 0.300 A 43 TYR CD1 C 13 132.353 0.300 A 43 TYR CE1 C 13 118.310 0.300 A 43 TYR N N 15 119.814 0.300 A 44 ARG H H 1 8.004 0.020 A 44 ARG HA H 1 4.093 0.020 A 44 ARG HBx H 1 2.041 0.020 A 44 ARG HBy H 1 2.041 0.020 A 44 ARG HDy H 1 3.283 0.020 A 44 ARG HDx H 1 3.235 0.020 A 44 ARG HGy H 1 1.985 0.020 A 44 ARG HGx H 1 1.792 0.020 A 44 ARG C C 13 179.764 0.300 A 44 ARG CA C 13 59.503 0.300 A 44 ARG CB C 13 29.962 0.300 A 44 ARG CD C 13 43.454 0.300 A 44 ARG CG C 13 27.749 0.300 A 44 ARG N N 15 116.221 0.300 A 45 LEU H H 1 8.176 0.020 A 45 LEU HA H 1 4.138 0.020 A 45 LEU HBy H 1 2.053 0.020 A 45 LEU HBx H 1 1.299 0.020 A 45 LEU HDx% H 1 0.905 0.020 A 45 LEU HDy% H 1 0.972 0.020 A 45 LEU HG H 1 1.897 0.020 A 45 LEU C C 13 179.374 0.300 A 45 LEU CA C 13 58.448 0.300 A 45 LEU CB C 13 42.631 0.300 A 45 LEU CD1 C 13 26.037 0.300 A 45 LEU CD2 C 13 23.688 0.300 A 45 LEU CG C 13 27.385 0.300 A 45 LEU N N 15 121.211 0.300 A 46 VAL H H 1 8.717 0.020 A 46 VAL HA H 1 3.634 0.020 A 46 VAL HB H 1 2.070 0.020 A 46 VAL HGx% H 1 0.944 0.020 A 46 VAL HGy% H 1 1.008 0.020 A 46 VAL C C 13 177.407 0.300 A 46 VAL CA C 13 66.741 0.300 A 46 VAL CB C 13 30.915 0.300 A 46 VAL CG1 C 13 23.104 0.300 A 46 VAL CG2 C 13 23.473 0.300 A 46 VAL N N 15 119.274 0.300 A 47 HIS H H 1 8.738 0.020 A 47 HIS HA H 1 4.265 0.020 A 47 HIS HBy H 1 3.294 0.020 A 47 HIS HBx H 1 2.803 0.020 A 47 HIS HD2 H 1 6.978 0.020 A 47 HIS C C 13 177.741 0.300 A 47 HIS CA C 13 60.089 0.300 A 47 HIS CB C 13 29.899 0.300 A 47 HIS CD2 C 13 119.870 0.300 A 47 HIS N N 15 121.429 0.300 A 48 THR H H 1 8.188 0.020 A 48 THR HA H 1 3.913 0.020 A 48 THR HB H 1 4.417 0.020 A 48 THR HG2% H 1 1.249 0.020 A 48 THR C C 13 176.501 0.300 A 48 THR CA C 13 67.003 0.300 A 48 THR CB C 13 68.644 0.300 A 48 THR CG2 C 13 21.777 0.300 A 48 THR N N 15 117.163 0.300 A 49 MET H H 1 8.354 0.020 A 49 MET HA H 1 3.708 0.020 A 49 MET HBy H 1 2.442 0.020 A 49 MET HBx H 1 1.918 0.020 A 49 MET HE% H 1 1.841 0.020 A 49 MET HGy H 1 2.858 0.020 A 49 MET HGx H 1 2.224 0.020 A 49 MET C C 13 178.094 0.300 A 49 MET CA C 13 60.206 0.300 A 49 MET CB C 13 34.821 0.300 A 49 MET CE C 13 17.191 0.300 A 49 MET CG C 13 33.427 0.300 A 49 MET N N 15 118.989 0.300 A 50 LYS H H 1 9.019 0.020 A 50 LYS HA H 1 3.688 0.020 A 50 LYS HBy H 1 2.133 0.020 A 50 LYS HBx H 1 1.684 0.020 A 50 LYS HDx H 1 1.650 0.020 A 50 LYS HDy H 1 1.650 0.020 A 50 LYS HEx H 1 2.984 0.020 A 50 LYS HEy H 1 2.984 0.020 A 50 LYS HGy H 1 1.384 0.020 A 50 LYS HGx H 1 1.305 0.020 A 50 LYS C C 13 177.463 0.300 A 50 LYS CA C 13 60.441 0.300 A 50 LYS CB C 13 31.711 0.300 A 50 LYS CD C 13 29.445 0.300 A 50 LYS CE C 13 42.088 0.300 A 50 LYS CG C 13 25.021 0.300 A 50 LYS N N 15 123.588 0.300 A 51 GLU H H 1 7.990 0.020 A 51 GLU HA H 1 4.016 0.020 A 51 GLU HBy H 1 2.114 0.020 A 51 GLU HBx H 1 2.073 0.020 A 51 GLU HGy H 1 2.248 0.020 A 51 GLU HGx H 1 2.058 0.020 A 51 GLU C C 13 179.893 0.300 A 51 GLU CA C 13 59.678 0.300 A 51 GLU CB C 13 29.385 0.300 A 51 GLU CG C 13 36.343 0.300 A 51 GLU N N 15 119.262 0.300 A 52 ILE H H 1 8.074 0.020 A 52 ILE HA H 1 3.684 0.020 A 52 ILE HB H 1 1.727 0.020 A 52 ILE HD1% H 1 0.702 0.020 A 52 ILE HG1y H 1 1.850 0.020 A 52 ILE HG1x H 1 0.953 0.020 A 52 ILE HG2% H 1 0.787 0.020 A 52 ILE C C 13 179.003 0.300 A 52 ILE CA C 13 65.714 0.300 A 52 ILE CB C 13 38.806 0.300 A 52 ILE CD1 C 13 14.109 0.300 A 52 ILE CG1 C 13 28.508 0.300 A 52 ILE CG2 C 13 17.721 0.300 A 52 ILE N N 15 119.582 0.300 A 53 THR H H 1 8.471 0.020 A 53 THR HA H 1 3.766 0.020 A 53 THR HB H 1 4.339 0.020 A 53 THR HG2% H 1 1.345 0.020 A 53 THR C C 13 177.351 0.300 A 53 THR CA C 13 66.534 0.300 A 53 THR CB C 13 68.644 0.300 A 53 THR CG2 C 13 24.084 0.300 A 53 THR N N 15 110.050 0.300 A 54 GLU H H 1 8.465 0.020 A 54 GLU HA H 1 3.987 0.020 A 54 GLU HBy H 1 2.139 0.020 A 54 GLU HBx H 1 1.987 0.020 A 54 GLU HGy H 1 2.372 0.020 A 54 GLU HGx H 1 2.172 0.020 A 54 GLU C C 13 180.617 0.300 A 54 GLU CA C 13 59.738 0.300 A 54 GLU CB C 13 29.268 0.300 A 54 GLU CG C 13 36.966 0.300 A 54 GLU N N 15 122.358 0.300 A 55 THR H H 1 8.012 0.020 A 55 THR HA H 1 3.962 0.020 A 55 THR HB H 1 4.351 0.020 A 55 THR HG2% H 1 1.248 0.020 A 55 THR C C 13 176.053 0.300 A 55 THR CA C 13 66.300 0.300 A 55 THR CB C 13 68.644 0.300 A 55 THR CG2 C 13 21.629 0.300 A 55 THR N N 15 117.720 0.300 A 56 MET H H 1 7.649 0.020 A 56 MET HA H 1 4.282 0.020 A 56 MET HBx H 1 1.356 0.020 A 56 MET HBy H 1 1.356 0.020 A 56 MET HE% H 1 1.769 0.020 A 56 MET HGx H 1 2.210 0.020 A 56 MET HGy H 1 2.352 0.020 A 56 MET C C 13 175.888 0.300 A 56 MET CA C 13 55.284 0.300 A 56 MET CB C 13 32.135 0.300 A 56 MET CE C 13 17.178 0.300 A 56 MET CG C 13 32.135 0.300 A 56 MET N N 15 116.847 0.300 A 57 GLY H H 1 7.543 0.020 A 57 GLY HAy H 1 4.187 0.020 A 57 GLY HAx H 1 3.842 0.020 A 57 GLY C C 13 175.915 0.300 A 57 GLY CA C 13 45.285 0.300 A 57 GLY N N 15 105.724 0.300 A 58 PHE H H 1 8.176 0.020 A 58 PHE HA H 1 5.348 0.020 A 58 PHE HBy H 1 3.301 0.020 A 58 PHE HBx H 1 3.075 0.020 A 58 PHE HDx H 1 6.974 0.020 A 58 PHE HDy H 1 6.974 0.020 A 58 PHE HEx H 1 7.206 0.020 A 58 PHE HEy H 1 7.206 0.020 A 58 PHE C C 13 176.702 0.300 A 58 PHE CA C 13 52.165 0.300 A 58 PHE CB C 13 35.192 0.300 A 58 PHE CD1 C 13 129.969 0.300 A 58 PHE CE1 C 13 131.496 0.300 A 58 PHE N N 15 122.363 0.300 A 59 SER H H 1 7.983 0.020 A 59 SER HA H 1 4.081 0.020 A 59 SER HBy H 1 3.963 0.020 A 59 SER HBx H 1 3.922 0.020 A 59 SER CA C 13 61.964 0.300 A 59 SER CB C 13 62.803 0.300 A 59 SER N N 15 117.743 0.300 A 60 SER HA H 1 4.245 0.020 A 60 SER HBy H 1 4.004 0.020 A 60 SER HBx H 1 3.963 0.020 A 60 SER C C 13 177.028 0.300 A 60 SER CA C 13 61.753 0.300 A 60 SER CB C 13 61.753 0.300 A 61 VAL H H 1 7.331 0.020 A 61 VAL HA H 1 3.689 0.020 A 61 VAL HB H 1 2.163 0.020 A 61 VAL HGx% H 1 1.069 0.020 A 61 VAL HGy% H 1 0.944 0.020 A 61 VAL C C 13 177.500 0.300 A 61 VAL CA C 13 65.714 0.300 A 61 VAL CB C 13 31.705 0.300 A 61 VAL CG1 C 13 23.334 0.300 A 61 VAL CG2 C 13 22.619 0.300 A 61 VAL N N 15 122.050 0.300 A 62 ALA H H 1 8.238 0.020 A 62 ALA HA H 1 4.021 0.020 A 62 ALA HB% H 1 1.491 0.020 A 62 ALA C C 13 179.467 0.300 A 62 ALA CA C 13 56.096 0.300 A 62 ALA CB C 13 18.180 0.300 A 62 ALA N N 15 122.716 0.300 A 63 LYS H H 1 7.806 0.020 A 63 LYS HA H 1 4.120 0.020 A 63 LYS HBx H 1 1.947 0.020 A 63 LYS HBy H 1 1.947 0.020 A 63 LYS HDx H 1 1.684 0.020 A 63 LYS HDy H 1 1.684 0.020 A 63 LYS HEx H 1 2.973 0.020 A 63 LYS HEy H 1 2.973 0.020 A 63 LYS HGy H 1 1.689 0.020 A 63 LYS HGx H 1 1.470 0.020 A 63 LYS C C 13 179.467 0.300 A 63 LYS CA C 13 59.620 0.300 A 63 LYS CB C 13 32.315 0.300 A 63 LYS CD C 13 29.150 0.300 A 63 LYS CE C 13 42.054 0.300 A 63 LYS CG C 13 25.095 0.300 A 63 LYS N N 15 116.207 0.300 A 64 VAL H H 1 7.334 0.020 A 64 VAL HA H 1 3.813 0.020 A 64 VAL HB H 1 2.146 0.020 A 64 VAL HGx% H 1 0.990 0.020 A 64 VAL HGy% H 1 0.986 0.020 A 64 VAL C C 13 179.801 0.300 A 64 VAL CA C 13 66.300 0.300 A 64 VAL CB C 13 31.846 0.300 A 64 VAL CGx C 13 22.894 0.300 A 64 VAL CGy C 13 22.922 0.300 A 64 VAL N N 15 119.903 0.300 A 65 LEU H H 1 8.232 0.020 A 65 LEU HA H 1 3.913 0.020 A 65 LEU HBy H 1 2.047 0.020 A 65 LEU HBx H 1 1.242 0.020 A 65 LEU HDx% H 1 1.072 0.020 A 65 LEU HDy% H 1 0.969 0.020 A 65 LEU HG H 1 0.822 0.020 A 65 LEU C C 13 178.446 0.300 A 65 LEU CA C 13 58.259 0.300 A 65 LEU CB C 13 40.681 0.300 A 65 LEU CDy C 13 23.841 0.300 A 65 LEU CDx C 13 23.399 0.300 A 65 LEU CG C 13 26.882 0.300 A 65 LEU N N 15 120.633 0.300 A 66 HIS H H 1 8.711 0.020 A 66 HIS HA H 1 4.319 0.020 A 66 HIS HBy H 1 3.473 0.020 A 66 HIS HBx H 1 3.119 0.020 A 66 HIS HD2 H 1 7.020 0.020 A 66 HIS C C 13 177.611 0.300 A 66 HIS CA C 13 59.620 0.300 A 66 HIS CB C 13 30.890 0.300 A 66 HIS CD2 C 13 118.705 0.300 A 66 HIS N N 15 120.041 0.300 A 67 THR H H 1 7.944 0.020 A 67 THR HA H 1 4.070 0.020 A 67 THR HB H 1 4.469 0.020 A 67 THR HG2% H 1 1.382 0.020 A 67 THR C C 13 177.497 0.300 A 67 THR CA C 13 66.300 0.300 A 67 THR CB C 13 68.644 0.300 A 67 THR CG2 C 13 22.072 0.300 A 67 THR N N 15 113.383 0.300 A 68 ILE H H 1 7.916 0.020 A 68 ILE HA H 1 3.606 0.020 A 68 ILE HB H 1 2.163 0.020 A 68 ILE HD1% H 1 0.834 0.020 A 68 ILE HG1y H 1 2.065 0.020 A 68 ILE HG1x H 1 1.895 0.020 A 68 ILE HG2% H 1 0.939 0.020 A 68 ILE C C 13 177.203 0.300 A 68 ILE CA C 13 66.417 0.300 A 68 ILE CB C 13 37.651 0.300 A 68 ILE CD1 C 13 13.887 0.300 A 68 ILE CG1 C 13 29.814 0.300 A 68 ILE CG2 C 13 17.985 0.300 A 68 ILE N N 15 122.196 0.300 A 69 MET H H 1 8.401 0.020 A 69 MET HA H 1 3.689 0.020 A 69 MET HB2 H 1 2.183 0.020 A 69 MET HB3 H 1 2.304 0.020 A 69 MET HE% H 1 1.809 0.020 A 69 MET HG2 H 1 2.034 0.020 A 69 MET HG3 H 1 2.372 0.020 A 69 MET C C 13 177.314 0.300 A 69 MET CA C 13 60.441 0.300 A 69 MET CB C 13 33.116 0.300 A 69 MET CE C 13 16.192 0.300 A 69 MET CG C 13 31.952 0.300 A 69 MET N N 15 119.236 0.300 A 70 ASN H H 1 8.216 0.020 A 70 ASN HA H 1 4.502 0.020 A 70 ASN HBx H 1 2.760 0.020 A 70 ASN HBy H 1 2.760 0.020 A 70 ASN HD2y H 1 7.519 0.020 A 70 ASN HD2x H 1 6.419 0.020 A 70 ASN C C 13 177.463 0.300 A 70 ASN CA C 13 56.222 0.300 A 70 ASN CB C 13 38.253 0.300 A 70 ASN N N 15 116.217 0.300 A 70 ASN ND2 N 15 110.665 0.300 A 71 LEU H H 1 7.623 0.020 A 71 LEU HA H 1 4.046 0.020 A 71 LEU HB2 H 1 1.532 0.020 A 71 LEU HB3 H 1 1.881 0.020 A 71 LEU HDy% H 1 0.819 0.020 A 71 LEU HG H 1 1.721 0.020 A 71 LEU C C 13 178.205 0.300 A 71 LEU CA C 13 57.980 0.300 A 71 LEU CB C 13 42.276 0.300 A 71 LEU CD2 C 13 24.173 0.300 A 71 LEU CG C 13 26.500 0.300 A 71 LEU N N 15 120.531 0.300 A 72 VAL H H 1 8.534 0.020 A 72 VAL HA H 1 3.623 0.020 A 72 VAL HB H 1 2.314 0.020 A 72 VAL HGx% H 1 1.339 0.020 A 72 VAL HGy% H 1 1.215 0.020 A 72 VAL C C 13 177.889 0.300 A 72 VAL CA C 13 66.300 0.300 A 72 VAL CB C 13 31.733 0.300 A 72 VAL CG1 C 13 23.457 0.300 A 72 VAL CG2 C 13 22.735 0.300 A 72 VAL N N 15 118.362 0.300 A 73 ASP H H 1 8.889 0.020 A 73 ASP HA H 1 4.228 0.020 A 73 ASP HBy H 1 2.934 0.020 A 73 ASP HBx H 1 2.743 0.020 A 73 ASP C C 13 178.520 0.300 A 73 ASP CA C 13 57.980 0.300 A 73 ASP CB C 13 41.761 0.300 A 73 ASP N N 15 120.519 0.300 A 74 LYS H H 1 7.492 0.020 A 74 LYS HA H 1 4.012 0.020 A 74 LYS HBy H 1 2.065 0.020 A 74 LYS HBx H 1 1.557 0.020 A 74 LYS HDx H 1 1.698 0.020 A 74 LYS HDy H 1 1.698 0.020 A 74 LYS HEx H 1 2.932 0.020 A 74 LYS HEy H 1 2.932 0.020 A 74 LYS HGx H 1 1.617 0.020 A 74 LYS HGy H 1 1.617 0.020 A 74 LYS C C 13 179.430 0.300 A 74 LYS CA C 13 59.546 0.300 A 74 LYS CB C 13 32.558 0.300 A 74 LYS CD C 13 29.202 0.300 A 74 LYS CE C 13 41.912 0.300 A 74 LYS CG C 13 25.537 0.300 A 74 LYS N N 15 116.878 0.300 A 75 MET H H 1 7.677 0.020 A 75 MET HA H 1 3.834 0.020 A 75 MET HBy H 1 2.336 0.020 A 75 MET HBx H 1 1.885 0.020 A 75 MET HE% H 1 1.140 0.020 A 75 MET HGy H 1 2.301 0.020 A 75 MET HGx H 1 1.745 0.020 A 75 MET C C 13 179.448 0.300 A 75 MET CA C 13 59.142 0.300 A 75 MET CB C 13 32.283 0.300 A 75 MET CE C 13 16.836 0.300 A 75 MET CG C 13 32.098 0.300 A 75 MET N N 15 119.582 0.300 A 76 LEU H H 1 8.546 0.020 A 76 LEU HA H 1 4.021 0.020 A 76 LEU HBy H 1 1.863 0.020 A 76 LEU HBx H 1 1.300 0.020 A 76 LEU HDx% H 1 0.816 0.020 A 76 LEU HDy% H 1 0.816 0.020 A 76 LEU HG H 1 1.923 0.020 A 76 LEU C C 13 178.610 0.300 A 76 LEU CA C 13 57.394 0.300 A 76 LEU CB C 13 41.802 0.300 A 76 LEU CDx C 13 23.399 0.300 A 76 LEU CG C 13 26.904 0.300 A 76 LEU N N 15 119.905 0.300 A 77 ASN H H 1 7.691 0.020 A 77 ASN HA H 1 4.800 0.020 A 77 ASN HBy H 1 2.909 0.020 A 77 ASN HBx H 1 2.619 0.020 A 77 ASN HD2y H 1 7.506 0.020 A 77 ASN HD2x H 1 6.671 0.020 A 77 ASN C C 13 174.391 0.300 A 77 ASN CA C 13 53.175 0.300 A 77 ASN CB C 13 39.103 0.300 A 77 ASN N N 15 114.977 0.300 A 77 ASN ND2 N 15 115.063 0.300 A 78 SER H H 1 7.793 0.020 A 78 SER HA H 1 4.344 0.020 A 78 SER HBx H 1 4.054 0.020 A 78 SER HBy H 1 4.054 0.020 A 78 SER C C 13 174.157 0.300 A 78 SER CA C 13 59.269 0.300 A 78 SER CB C 13 61.455 0.300 A 78 SER N N 15 111.535 0.300 A 79 GLU H H 1 8.505 0.020 A 79 GLU HA H 1 4.187 0.020 A 79 GLU HBy H 1 2.080 0.020 A 79 GLU HBx H 1 1.839 0.020 A 79 GLU HGy H 1 2.203 0.020 A 79 GLU HGx H 1 2.165 0.020 A 79 GLU C C 13 176.201 0.300 A 79 GLU CA C 13 57.033 0.300 A 79 GLU CB C 13 30.729 0.300 A 79 GLU CG C 13 36.966 0.300 A 79 GLU N N 15 117.835 0.300 A 80 ILE H H 1 7.139 0.020 A 80 ILE HA H 1 4.352 0.020 A 80 ILE HB H 1 1.615 0.020 A 80 ILE HD1% H 1 0.762 0.020 A 80 ILE HG1y H 1 1.242 0.020 A 80 ILE HG1x H 1 0.870 0.020 A 80 ILE HG2% H 1 0.673 0.020 A 80 ILE C C 13 173.696 0.300 A 80 ILE CA C 13 59.016 0.300 A 80 ILE CB C 13 41.032 0.300 A 80 ILE CD1 C 13 13.887 0.300 A 80 ILE CG1 C 13 26.085 0.300 A 80 ILE CG2 C 13 17.229 0.300 A 80 ILE N N 15 114.369 0.300 A 81 LYS H H 1 8.192 0.020 A 81 LYS HA H 1 4.211 0.020 A 81 LYS HBx H 1 1.673 0.020 A 81 LYS HBy H 1 1.673 0.020 A 81 LYS HDx H 1 1.630 0.020 A 81 LYS HDy H 1 1.630 0.020 A 81 LYS HEx H 1 2.971 0.020 A 81 LYS HEy H 1 2.971 0.020 A 81 LYS HGy H 1 1.420 0.020 A 81 LYS HGx H 1 1.331 0.020 A 81 LYS C C 13 175.997 0.300 A 81 LYS CA C 13 55.392 0.300 A 81 LYS CB C 13 32.649 0.300 A 81 LYS CD C 13 28.855 0.300 A 81 LYS CE C 13 42.214 0.300 A 81 LYS CG C 13 24.652 0.300 A 81 LYS N N 15 124.675 0.300 A 82 ILE H H 1 8.775 0.020 A 82 ILE HA H 1 3.743 0.020 A 82 ILE HB H 1 1.779 0.020 A 82 ILE HD1% H 1 0.736 0.020 A 82 ILE HG1y H 1 1.647 0.020 A 82 ILE HG1x H 1 0.725 0.020 A 82 ILE HG2% H 1 0.962 0.020 A 82 ILE C C 13 175.570 0.300 A 82 ILE CA C 13 63.253 0.300 A 82 ILE CB C 13 37.165 0.300 A 82 ILE CD1 C 13 13.734 0.300 A 82 ILE CG1 C 13 27.749 0.300 A 82 ILE CG2 C 13 18.196 0.300 A 82 ILE N N 15 124.676 0.300 A 83 THR H H 1 6.852 0.020 A 83 THR HA H 1 4.749 0.020 A 83 THR HB H 1 4.628 0.020 A 83 THR HG2% H 1 1.170 0.020 A 83 THR CA C 13 59.269 0.300 A 83 THR CB C 13 72.277 0.300 A 83 THR CG2 C 13 21.663 0.300 A 83 THR N N 15 116.218 0.300 A 85 ASP HA H 1 4.435 0.020 A 85 ASP HBx H 1 2.611 0.020 A 85 ASP HBy H 1 2.611 0.020 A 85 ASP C C 13 178.141 0.300 A 85 ASP CA C 13 56.887 0.300 A 85 ASP CB C 13 40.686 0.300 A 86 LEU H H 1 7.615 0.020 A 86 LEU HA H 1 4.135 0.020 A 86 LEU HBy H 1 1.815 0.020 A 86 LEU HBx H 1 1.726 0.020 A 86 LEU HDx% H 1 0.950 0.020 A 86 LEU HDy% H 1 0.813 0.020 A 86 LEU HG H 1 1.647 0.020 A 86 LEU C C 13 178.711 0.300 A 86 LEU CA C 13 57.556 0.300 A 86 LEU CB C 13 41.798 0.300 A 86 LEU CDx C 13 25.352 0.300 A 86 LEU CDy C 13 25.352 0.300 A 86 LEU CG C 13 27.096 0.300 A 86 LEU N N 15 121.469 0.300 A 87 ILE H H 1 7.795 0.020 A 87 ILE HA H 1 3.567 0.020 A 87 ILE HB H 1 2.096 0.020 A 87 ILE HD1% H 1 0.979 0.020 A 87 ILE HG1x H 1 2.036 0.020 A 87 ILE HG1y H 1 2.036 0.020 A 87 ILE HG2% H 1 0.950 0.020 A 87 ILE C C 13 177.853 0.300 A 87 ILE CA C 13 66.652 0.300 A 87 ILE CB C 13 37.399 0.300 A 87 ILE CD1 C 13 13.757 0.300 A 87 ILE CG1 C 13 29.814 0.300 A 87 ILE CG2 C 13 17.743 0.300 A 87 ILE N N 15 118.953 0.300 A 88 ASP H H 1 8.182 0.020 A 88 ASP HA H 1 4.377 0.020 A 88 ASP HBy H 1 2.818 0.020 A 88 ASP HBx H 1 2.702 0.020 A 88 ASP C C 13 178.297 0.300 A 88 ASP CA C 13 57.862 0.300 A 88 ASP CB C 13 40.915 0.300 A 88 ASP N N 15 118.991 0.300 A 89 LYS H H 1 7.855 0.020 A 89 LYS HA H 1 4.012 0.020 A 89 LYS HBy H 1 2.088 0.020 A 89 LYS HBx H 1 1.889 0.020 A 89 LYS HDx H 1 1.563 0.020 A 89 LYS HDy H 1 1.563 0.020 A 89 LYS HEx H 1 2.895 0.020 A 89 LYS HEy H 1 2.895 0.020 A 89 LYS HGx H 1 1.372 0.020 A 89 LYS HGy H 1 1.372 0.020 A 89 LYS C C 13 179.374 0.300 A 89 LYS CA C 13 59.972 0.300 A 89 LYS CB C 13 32.432 0.300 A 89 LYS CD C 13 29.445 0.300 A 89 LYS CE C 13 42.054 0.300 A 89 LYS CG C 13 25.464 0.300 A 89 LYS N N 15 119.570 0.300 A 90 VAL H H 1 8.046 0.020 A 90 VAL HA H 1 3.390 0.020 A 90 VAL HB H 1 2.486 0.020 A 90 VAL HGx% H 1 0.961 0.020 A 90 VAL HGy% H 1 1.110 0.020 A 90 VAL C C 13 177.555 0.300 A 90 VAL CA C 13 67.941 0.300 A 90 VAL CB C 13 31.495 0.300 A 90 VAL CG1 C 13 21.187 0.300 A 90 VAL CG2 C 13 23.325 0.300 A 90 VAL N N 15 119.608 0.300 A 91 LYS H H 1 8.567 0.020 A 91 LYS HA H 1 3.838 0.020 A 91 LYS HB2 H 1 1.952 0.020 A 91 LYS HB3 H 1 1.980 0.020 A 91 LYS HDx H 1 1.563 0.020 A 91 LYS HDy H 1 1.563 0.020 A 91 LYS HEx H 1 2.924 0.020 A 91 LYS HEy H 1 2.924 0.020 A 91 LYS HGx H 1 1.732 0.020 A 91 LYS HGy H 1 1.732 0.020 A 91 LYS C C 13 179.255 0.300 A 91 LYS CA C 13 60.600 0.300 A 91 LYS CB C 13 32.315 0.300 A 91 LYS CD C 13 29.477 0.300 A 91 LYS CE C 13 42.048 0.300 A 91 LYS CG C 13 25.712 0.300 A 91 LYS N N 15 119.055 0.300 A 92 LYS H H 1 8.459 0.020 A 92 LYS HA H 1 4.104 0.020 A 92 LYS HBy H 1 1.972 0.020 A 92 LYS HBx H 1 1.906 0.020 A 92 LYS HDx H 1 1.690 0.020 A 92 LYS HDy H 1 1.690 0.020 A 92 LYS HEx H 1 2.951 0.020 A 92 LYS HEy H 1 2.951 0.020 A 92 LYS HG2 H 1 1.492 0.020 A 92 LYS HG3 H 1 1.610 0.020 A 92 LYS C C 13 180.469 0.300 A 92 LYS CA C 13 59.386 0.300 A 92 LYS CB C 13 32.180 0.300 A 92 LYS CD C 13 29.111 0.300 A 92 LYS CE C 13 42.054 0.300 A 92 LYS CG C 13 25.634 0.300 A 92 LYS N N 15 119.273 0.300 A 93 LYS H H 1 7.944 0.020 A 93 LYS HA H 1 4.178 0.020 A 93 LYS HBy H 1 1.978 0.020 A 93 LYS HBx H 1 1.572 0.020 A 93 LYS HDx H 1 1.612 0.020 A 93 LYS HDy H 1 1.612 0.020 A 93 LYS HEx H 1 2.862 0.020 A 93 LYS HEy H 1 2.862 0.020 A 93 LYS HGx H 1 1.371 0.020 A 93 LYS HGy H 1 1.371 0.020 A 93 LYS C C 13 178.706 0.300 A 93 LYS CA C 13 59.184 0.300 A 93 LYS CB C 13 32.853 0.300 A 93 LYS CD C 13 29.445 0.300 A 93 LYS CE C 13 41.906 0.300 A 93 LYS CG C 13 25.390 0.300 A 93 LYS N N 15 119.903 0.300 A 94 LEU H H 1 8.464 0.020 A 94 LEU HA H 1 3.938 0.020 A 94 LEU HBy H 1 1.864 0.020 A 94 LEU HBx H 1 1.624 0.020 A 94 LEU HDx% H 1 0.801 0.020 A 94 LEU HDy% H 1 0.801 0.020 A 94 LEU C C 13 179.665 0.300 A 94 LEU CA C 13 57.879 0.300 A 94 LEU CB C 13 41.137 0.300 A 94 LEU CG C 13 26.275 0.300 A 94 LEU N N 15 120.828 0.300 A 95 ASP H H 1 8.345 0.020 A 95 ASP HA H 1 4.402 0.020 A 95 ASP HB2 H 1 2.835 0.020 A 95 ASP HB3 H 1 2.727 0.020 A 95 ASP C C 13 178.317 0.300 A 95 ASP CA C 13 57.628 0.300 A 95 ASP CB C 13 40.870 0.300 A 95 ASP N N 15 121.408 0.300 A 96 MET H H 1 7.699 0.020 A 96 MET HA H 1 4.104 0.020 A 96 MET HB2 H 1 2.336 0.020 A 96 MET HB3 H 1 2.411 0.020 A 96 MET HGy H 1 2.815 0.020 A 96 MET HGx H 1 2.604 0.020 A 96 MET C C 13 178.727 0.300 A 96 MET CA C 13 59.269 0.300 A 96 MET CB C 13 32.111 0.300 A 96 MET CG C 13 31.861 0.300 A 96 MET N N 15 119.286 0.300 A 97 VAL H H 1 8.126 0.020 A 97 VAL HA H 1 3.498 0.020 A 97 VAL HB H 1 2.470 0.020 A 97 VAL HGx% H 1 0.886 0.020 A 97 VAL HGy% H 1 1.109 0.020 A 97 VAL C C 13 177.073 0.300 A 97 VAL CA C 13 67.120 0.300 A 97 VAL CB C 13 31.261 0.300 A 97 VAL CG1 C 13 21.187 0.300 A 97 VAL CG2 C 13 23.178 0.300 A 97 VAL N N 15 119.903 0.300 A 98 THR H H 1 8.224 0.020 A 98 THR HA H 1 3.631 0.020 A 98 THR HB H 1 4.366 0.020 A 98 THR HG2% H 1 1.228 0.020 A 98 THR C C 13 176.091 0.300 A 98 THR CA C 13 67.355 0.300 A 98 THR CB C 13 68.410 0.300 A 98 THR CG2 C 13 21.777 0.300 A 98 THR N N 15 115.598 0.300 A 99 ARG H H 1 7.944 0.020 A 99 ARG HA H 1 4.095 0.020 A 99 ARG HBy H 1 1.941 0.020 A 99 ARG HBx H 1 1.869 0.020 A 99 ARG HDy H 1 3.227 0.020 A 99 ARG HDx H 1 3.138 0.020 A 99 ARG HGy H 1 1.806 0.020 A 99 ARG HGx H 1 1.627 0.020 A 99 ARG C C 13 179.606 0.300 A 99 ARG CA C 13 59.386 0.300 A 99 ARG CB C 13 30.070 0.300 A 99 ARG CD C 13 43.454 0.300 A 99 ARG CG C 13 27.781 0.300 A 99 ARG N N 15 119.903 0.300 A 100 GLU H H 1 8.208 0.020 A 100 GLU HA H 1 4.012 0.020 A 100 GLU HBy H 1 2.050 0.020 A 100 GLU HBx H 1 1.933 0.020 A 100 GLU HGx H 1 2.314 0.020 A 100 GLU HGy H 1 2.314 0.020 A 100 GLU C C 13 179.548 0.300 A 100 GLU CA C 13 58.800 0.300 A 100 GLU CB C 13 29.503 0.300 A 100 GLU CG C 13 36.337 0.300 A 100 GLU N N 15 119.262 0.300 A 101 LEU H H 1 8.450 0.020 A 101 LEU HA H 1 3.863 0.020 A 101 LEU HBy H 1 1.873 0.020 A 101 LEU HBx H 1 1.453 0.020 A 101 LEU HDx% H 1 0.792 0.020 A 101 LEU HDy% H 1 0.792 0.020 A 101 LEU HG H 1 0.797 0.020 A 101 LEU C C 13 178.434 0.300 A 101 LEU CA C 13 57.547 0.300 A 101 LEU CB C 13 41.456 0.300 A 101 LEU CG C 13 26.570 0.300 A 101 LEU N N 15 119.890 0.300 A 102 ASP H H 1 8.036 0.020 A 102 ASP HA H 1 4.427 0.020 A 102 ASP HBy H 1 2.727 0.020 A 102 ASP HBx H 1 2.619 0.020 A 102 ASP C C 13 178.552 0.300 A 102 ASP CA C 13 57.042 0.300 A 102 ASP CB C 13 40.753 0.300 A 102 ASP N N 15 118.529 0.300 A 103 LYS H H 1 7.498 0.020 A 103 LYS HA H 1 4.052 0.020 A 103 LYS HBx H 1 1.856 0.020 A 103 LYS HBy H 1 1.856 0.020 A 103 LYS HDx H 1 1.684 0.020 A 103 LYS HDy H 1 1.684 0.020 A 103 LYS HEx H 1 2.882 0.020 A 103 LYS HEy H 1 2.882 0.020 A 103 LYS HGx H 1 1.554 0.020 A 103 LYS HGy H 1 1.554 0.020 A 103 LYS C C 13 178.669 0.300 A 103 LYS CA C 13 58.427 0.300 A 103 LYS CB C 13 32.559 0.300 A 103 LYS CD C 13 29.476 0.300 A 103 LYS CE C 13 41.980 0.300 A 103 LYS CG C 13 25.021 0.300 A 103 LYS N N 15 118.311 0.300 A 104 LYS H H 1 7.782 0.020 A 104 LYS HA H 1 4.104 0.020 A 104 LYS HBy H 1 1.694 0.020 A 104 LYS HBx H 1 1.532 0.020 A 104 LYS HDy H 1 1.296 0.020 A 104 LYS HDx H 1 1.262 0.020 A 104 LYS HEy H 1 2.619 0.020 A 104 LYS HEx H 1 2.495 0.020 A 104 LYS HGy H 1 1.217 0.020 A 104 LYS HGx H 1 0.968 0.020 A 104 LYS C C 13 178.083 0.300 A 104 LYS CA C 13 57.042 0.300 A 104 LYS CB C 13 32.072 0.300 A 104 LYS CD C 13 27.889 0.300 A 104 LYS CE C 13 41.832 0.300 A 104 LYS CG C 13 24.021 0.300 A 104 LYS N N 15 118.117 0.300 A 105 VAL H H 1 7.908 0.020 A 105 VAL HA H 1 4.062 0.020 A 105 VAL HB H 1 2.221 0.020 A 105 VAL HGx% H 1 0.923 0.020 A 105 VAL HGy% H 1 0.923 0.020 A 105 VAL C C 13 176.911 0.300 A 105 VAL CA C 13 63.370 0.300 A 105 VAL CB C 13 32.198 0.300 A 105 VAL N N 15 116.447 0.300 A 106 SER H H 1 8.060 0.020 A 106 SER HA H 1 4.386 0.020 A 106 SER HBx H 1 3.923 0.020 A 106 SER HBy H 1 3.923 0.020 A 106 SER C C 13 175.626 0.300 A 106 SER CA C 13 59.503 0.300 A 106 SER CB C 13 63.526 0.300 A 106 SER N N 15 116.819 0.300 A 107 GLY H H 1 8.203 0.020 A 107 GLY HAy H 1 4.000 0.020 A 107 GLY HAx H 1 3.965 0.020 A 107 GLY C C 13 174.508 0.300 A 107 GLY CA C 13 45.675 0.300 A 107 GLY N N 15 109.747 0.300 A 108 SER H H 1 8.037 0.020 A 108 SER HA H 1 4.411 0.020 A 108 SER HBx H 1 3.789 0.020 A 108 SER HBy H 1 3.789 0.020 A 108 SER C C 13 174.157 0.300 A 108 SER CA C 13 58.800 0.300 A 108 SER CB C 13 63.644 0.300 A 108 SER N N 15 115.307 0.300 A 109 TYR H H 1 7.982 0.020 A 109 TYR HA H 1 4.543 0.020 A 109 TYR HBy H 1 3.059 0.020 A 109 TYR HBx H 1 2.942 0.020 A 109 TYR HDx H 1 7.108 0.020 A 109 TYR HDy H 1 7.108 0.020 A 109 TYR HEx H 1 6.799 0.020 A 109 TYR HEy H 1 6.799 0.020 A 109 TYR C C 13 175.329 0.300 A 109 TYR CA C 13 57.980 0.300 A 109 TYR CB C 13 38.391 0.300 A 109 TYR CD1 C 13 133.197 0.300 A 109 TYR CE1 C 13 118.207 0.300 A 109 TYR N N 15 121.136 0.300 A 110 LEU H H 1 7.999 0.020 A 110 LEU HA H 1 4.294 0.020 A 110 LEU HBy H 1 1.557 0.020 A 110 LEU HBx H 1 1.508 0.020 A 110 LEU HDx% H 1 0.752 0.020 A 110 LEU HDy% H 1 0.752 0.020 A 110 LEU HG H 1 0.853 0.020 A 110 LEU C C 13 176.501 0.300 A 110 LEU CA C 13 54.933 0.300 A 110 LEU CB C 13 42.237 0.300 A 110 LEU CG C 13 26.791 0.300 A 110 LEU N N 15 122.989 0.300 A 111 VAL H H 1 7.882 0.020 A 111 VAL HA H 1 4.331 0.020 A 111 VAL HB H 1 2.055 0.020 A 111 VAL HGx% H 1 0.960 0.020 A 111 VAL HGy% H 1 0.960 0.020 A 111 VAL C C 13 174.271 0.300 A 111 VAL CA C 13 59.738 0.300 A 111 VAL CB C 13 32.667 0.300 A 111 VAL N N 15 122.072 0.300 A 112 PRO HA H 1 4.369 0.020 A 112 PRO HBy H 1 2.237 0.020 A 112 PRO HBx H 1 1.922 0.020 A 112 PRO HDy H 1 3.841 0.020 A 112 PRO HDx H 1 3.660 0.020 A 112 PRO HGy H 1 2.030 0.020 A 112 PRO HGx H 1 1.936 0.020 A 112 PRO C C 13 175.973 0.300 A 112 PRO CA C 13 63.356 0.300 A 112 PRO CB C 13 31.949 0.300 A 112 PRO CD C 13 50.923 0.300 A 112 PRO CG C 13 27.307 0.300 A 113 ARG H H 1 7.937 0.020 A 113 ARG HA H 1 4.136 0.020 A 113 ARG HBy H 1 1.821 0.020 A 113 ARG HBx H 1 1.688 0.020 A 113 ARG HDx H 1 3.148 0.020 A 113 ARG HDy H 1 3.148 0.020 A 113 ARG HGx H 1 1.592 0.020 A 113 ARG HGy H 1 1.592 0.020 A 113 ARG CA C 13 57.394 0.300 A 113 ARG CB C 13 31.729 0.300 A 113 ARG CD C 13 43.454 0.300 A 113 ARG CG C 13 27.086 0.300 A 113 ARG N N 15 126.392 0.300 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 5 GLN HE2x A 5 GLN HE2y 1.0 0.0 2.83 2 2 A 5 GLN HE2x A 5 GLN HE2y 1.0 0.0 2.79 3 3 A 23 ASN HD2x A 23 ASN HD2y 1.0 0.0 3.08 4 4 A 6 GLU H A 7 TYR H 1.0 0.0 4.87 5 5 A 6 GLU H A 5 GLN HA 1.0 0.0 4.70 6 6 A 97 VAL H A 97 VAL HA 1.0 0.0 4.36 7 7 A 97 VAL H A 97 VAL HB 1.0 0.0 3.83 8 8 A 6 GLU H A 5 GLN HBy 1.0 0.0 4.12 9 9 A 97 VAL H A 97 VAL HGy% 1.0 0.0 3.84 10 10 A 97 VAL H A 64 VAL HGx% 1.0 0.0 4.97 11 11 A 97 VAL H A 97 VAL HGx% 1.0 0.0 4.66 12 12 A 7 TYR H A 7 TYR HA 1.0 0.0 4.72 13 13 A 7 TYR H A 5 GLN HA 1.0 0.0 5.51 14 14 A 7 TYR H A 7 TYR HB3 1.0 0.0 4.23 15 15 A 7 TYR H A 6 GLU HBx 1.0 0.0 5.07 16 15 A 7 TYR H A 6 GLU HBy 1.0 0.0 5.07 17 16 A 8 ILE H A 8 ILE HA 1.0 0.0 4.79 18 17 A 7 TYR HB3 A 8 ILE H 1.0 0.0 4.80 19 18 A 8 ILE H A 8 ILE HB 1.0 0.0 4.20 20 19 A 8 ILE H A 8 ILE HG1y 1.0 0.0 4.93 21 20 A 8 ILE H A 8 ILE HG1x 1.0 0.0 4.72 22 21 A 8 ILE H A 8 ILE HG2% 1.0 0.0 4.74 23 22 A 9 LYS H A 10 LYS H 1.0 0.0 5.18 24 23 A 109 TYR HA A 110 LEU H 1.0 0.0 4.32 25 24 A 110 LEU H A 110 LEU HA 1.0 0.0 4.62 26 25 A 9 LYS H A 9 LYS HA 1.0 0.0 4.60 27 26 A 8 ILE HB A 9 LYS H 1.0 0.0 3.86 28 27 A 110 LEU H A 110 LEU HBy 1.0 0.0 4.27 29 28 A 8 ILE HG2% A 9 LYS H 1.0 0.0 4.68 30 29 A 20 GLN H A 21 ASN H 1.0 0.0 4.15 31 30 A 10 LYS H A 9 LYS HBy 1.0 0.0 3.74 32 31 A 21 ASN H A 22 VAL H 1.0 0.0 4.21 33 32 A 10 LYS H A 11 VAL H 1.0 0.0 4.17 34 33 A 21 ASN H A 21 ASN HA 1.0 0.0 4.45 35 34 A 21 ASN H A 17 GLU HA 1.0 0.0 4.48 36 35 A 11 VAL H A 11 VAL HA 1.0 0.0 4.41 37 36 A 21 ASN H A 21 ASN HBy 1.0 0.0 4.09 38 37 A 21 ASN H A 21 ASN HBx 1.0 0.0 4.32 39 38 A 21 ASN H A 20 GLN HBx 1.0 0.0 4.17 40 38 A 21 ASN H A 20 GLN HBy 1.0 0.0 4.17 41 39 A 11 VAL H A 10 LYS HBx 1.0 0.0 3.83 42 39 A 11 VAL H A 10 LYS HBy 1.0 0.0 3.83 43 40 A 11 VAL H A 11 VAL HGx% 1.0 0.0 4.06 44 40 A 11 VAL H A 11 VAL HGy% 1.0 0.0 4.06 45 41 A 12 THR H A 12 THR HB 1.0 0.0 4.58 46 42 A 11 VAL HA A 12 THR H 1.0 0.0 4.28 47 43 A 12 THR H A 11 VAL HB 1.0 0.0 4.68 48 44 A 12 THR H A 12 THR HG2% 1.0 0.0 4.52 49 45 A 13 ASP H A 14 GLU H 1.0 0.0 4.32 50 46 A 13 ASP H A 13 ASP HA 1.0 0.0 4.86 51 47 A 12 THR HB A 13 ASP H 1.0 0.0 4.73 52 48 A 13 ASP H A 14 GLU HA 1.0 0.0 5.25 53 49 A 11 VAL HA A 13 ASP H 1.0 0.0 4.97 54 50 A 13 ASP H A 13 ASP HBy 1.0 0.0 4.14 55 51 A 13 ASP H A 13 ASP HBx 1.0 0.0 4.71 56 52 A 14 GLU H A 15 LEU H 1.0 0.0 4.10 57 53 A 13 ASP H A 14 GLU H 1.0 0.0 4.19 58 54 A 110 LEU HA A 111 VAL H 1.0 0.0 3.77 59 55 A 14 GLU H A 14 GLU HA 1.0 0.0 4.15 60 56 A 11 VAL HA A 14 GLU H 1.0 0.0 4.69 61 57 A 14 GLU H A 13 ASP HBy 1.0 0.0 4.65 62 58 A 14 GLU H A 13 ASP HBx 1.0 0.0 4.98 63 59 A 14 GLU H A 14 GLU HGy 1.0 0.0 4.61 64 60 A 14 GLU H A 14 GLU HBy 1.0 0.0 3.98 65 61 A 18 LEU H A 19 ILE H 1.0 0.0 4.02 66 62 A 23 ASN H A 23 ASN HA 1.0 0.0 4.46 67 63 A 15 LEU H A 15 LEU HA 1.0 0.0 3.97 68 64 A 19 ILE H A 16 LYS HA 1.0 0.0 4.15 69 65 A 42 ILE H A 42 ILE HA 1.0 0.0 4.39 70 66 A 19 ILE H A 19 ILE HA 1.0 0.0 4.49 71 67 A 23 ASN H A 23 ASN HB2 1.0 0.0 4.05 72 68 A 23 ASN H A 23 ASN HB3 1.0 0.0 4.48 73 69 A 19 ILE H A 18 LEU HB2 1.0 0.0 3.74 74 70 A 19 ILE H A 19 ILE HB 1.0 0.0 3.26 75 71 A 15 LEU H A 15 LEU HB2 1.0 0.0 4.28 76 72 A 19 ILE H A 19 ILE HG12 1.0 0.0 3.80 77 73 A 16 LYS H A 17 GLU H 1.0 0.0 4.43 78 74 A 13 ASP HA A 16 LYS H 1.0 0.0 5.60 79 75 A 16 LYS HA A 16 LYS H 1.0 0.0 4.40 80 76 A 16 LYS H A 16 LYS HBy 1.0 0.0 4.11 81 77 A 16 LYS H A 16 LYS HDx 1.0 0.0 4.23 82 77 A 16 LYS H A 16 LYS HDy 1.0 0.0 4.23 83 78 A 15 LEU HB2 A 16 LYS H 1.0 0.0 4.59 84 79 A 40 ASN H A 76 LEU HDx% 1.0 0.0 4.69 85 79 A 40 ASN H A 76 LEU HDy% 1.0 0.0 4.69 86 80 A 16 LYS H A 17 GLU H 1.0 0.0 4.24 87 81 A 17 GLU HA A 17 GLU H 1.0 0.0 3.96 88 82 A 16 LYS HA A 17 GLU H 1.0 0.0 5.32 89 83 A 17 GLU H A 17 GLU HGy 1.0 0.0 4.98 90 84 A 17 GLU H A 17 GLU HBx 1.0 0.0 3.59 91 84 A 17 GLU H A 17 GLU HBy 1.0 0.0 3.59 92 85 A 17 GLU H A 16 LYS HBy 1.0 0.0 4.51 93 86 A 17 GLU H A 16 LYS HDx 1.0 0.0 5.21 94 86 A 17 GLU H A 16 LYS HDy 1.0 0.0 5.21 95 87 A 18 LEU H A 19 ILE H 1.0 0.0 4.42 96 88 A 18 LEU H A 17 GLU H 1.0 0.0 4.21 97 89 A 17 GLU HA A 18 LEU H 1.0 0.0 4.33 98 90 A 18 LEU H A 17 GLU HBx 1.0 0.0 3.85 99 90 A 18 LEU H A 17 GLU HBy 1.0 0.0 3.85 100 91 A 18 LEU H A 18 LEU HG 1.0 0.0 4.69 101 92 A 18 LEU H A 18 LEU HDx% 1.0 0.0 4.76 102 93 A 18 LEU H A 18 LEU HDy% 1.0 0.0 5.06 103 94 A 42 ILE H A 43 TYR H 1.0 0.0 4.36 104 95 A 100 GLU H A 101 LEU H 1.0 0.0 4.38 105 96 A 20 GLN H A 19 ILE H 1.0 0.0 4.56 106 97 A 15 LEU H A 14 GLU HBx 1.0 0.0 3.95 107 98 A 92 LYS H A 92 LYS HG3 1.0 0.0 4.38 108 99 A 76 LEU H A 77 ASN H 1.0 0.0 4.17 109 100 A 20 GLN HE2x A 20 GLN HE2y 1.0 0.0 2.82 110 101 A 77 ASN H A 77 ASN HA 1.0 0.0 4.26 111 102 A 77 ASN H A 76 LEU HA 1.0 0.0 4.41 112 103 A 77 ASN H A 77 ASN HBy 1.0 0.0 4.42 113 104 A 77 ASN H A 77 ASN HBx 1.0 0.0 3.93 114 105 A 20 GLN HE2y A 20 GLN HGx 1.0 0.0 4.10 115 105 A 20 GLN HE2y A 20 GLN HGy 1.0 0.0 4.10 116 106 A 20 GLN HE2y A 20 GLN HBx 1.0 0.0 5.17 117 106 A 20 GLN HBy A 20 GLN HE2y 1.0 0.0 5.17 118 107 A 77 ASN H A 76 LEU HBy 1.0 0.0 4.50 119 108 A 77 ASN H A 76 LEU HBx 1.0 0.0 4.88 120 109 A 20 GLN H A 19 ILE H 1.0 0.0 4.38 121 110 A 20 GLN H A 17 GLU HA 1.0 0.0 4.84 122 111 A 20 GLN H A 20 GLN HA 1.0 0.0 4.41 123 112 A 20 GLN H A 20 GLN HGx 1.0 0.0 4.50 124 112 A 20 GLN H A 20 GLN HGy 1.0 0.0 4.50 125 113 A 20 GLN H A 20 GLN HBx 1.0 0.0 3.63 126 113 A 20 GLN H A 20 GLN HBy 1.0 0.0 3.63 127 114 A 20 GLN H A 19 ILE HG2% 1.0 0.0 4.56 128 115 A 20 GLN HE2x A 20 GLN HE2y 1.0 0.0 2.76 129 116 A 20 GLN HE2x A 20 GLN HGx 1.0 0.0 4.73 130 116 A 20 GLN HE2x A 20 GLN HGy 1.0 0.0 4.73 131 117 A 21 ASN HD2x A 21 ASN HD2y 1.0 0.0 3.36 132 118 A 21 ASN HD2y A 20 GLN HGx 1.0 0.0 5.19 133 118 A 20 GLN HGy A 21 ASN HD2y 1.0 0.0 5.19 134 119 A 21 ASN H A 20 GLN HGx 1.0 0.0 5.14 135 119 A 21 ASN H A 20 GLN HGy 1.0 0.0 5.14 136 120 A 32 ASN HD2y A 32 ASN HD2x 1.0 0.0 2.84 137 121 A 21 ASN HD2x A 21 ASN HD2y 1.0 0.0 3.38 138 122 A 21 ASN H A 22 VAL H 1.0 0.0 4.57 139 123 A 22 VAL H A 21 ASN HA 1.0 0.0 5.36 140 124 A 22 VAL H A 22 VAL HA 1.0 0.0 4.62 141 125 A 22 VAL H A 19 ILE HA 1.0 0.0 5.05 142 126 A 22 VAL H A 21 ASN HBy 1.0 0.0 4.69 143 127 A 22 VAL H A 21 ASN HBx 1.0 0.0 4.93 144 128 A 22 VAL H A 22 VAL HB 1.0 0.0 4.15 145 129 A 22 VAL H A 22 VAL HGy% 1.0 0.0 4.23 146 130 A 22 VAL H A 22 VAL HGx% 1.0 0.0 4.68 147 131 A 23 ASN HD2y A 20 GLN HA 1.0 0.0 5.39 148 132 A 23 ASN HD2y A 23 ASN HB2 1.0 0.0 4.57 149 133 A 23 ASN HD2y A 23 ASN HB3 1.0 0.0 5.09 150 134 A 23 ASN HD2y A 19 ILE HG2% 1.0 0.0 4.73 151 135 A 23 ASN HD2x A 23 ASN HD2y 1.0 0.0 3.06 152 136 A 23 ASN HD2x A 23 ASN HB2 1.0 0.0 4.77 153 137 A 23 ASN HD2x A 23 ASN HB3 1.0 0.0 5.24 154 138 A 23 ASN HD2x A 19 ILE HG2% 1.0 0.0 4.41 155 139 A 23 ASN H A 24 ASP H 1.0 0.0 3.70 156 140 A 24 ASP H A 24 ASP HA 1.0 0.0 4.10 157 141 A 20 GLN HA A 24 ASP H 1.0 0.0 5.32 158 142 A 23 ASN HB2 A 24 ASP H 1.0 0.0 3.58 159 143 A 23 ASN HB3 A 24 ASP H 1.0 0.0 3.93 160 144 A 94 LEU HBy A 95 ASP H 1.0 0.0 4.55 161 145 A 25 ASP H A 26 ILE H 1.0 0.0 4.27 162 146 A 24 ASP H A 25 ASP H 1.0 0.0 4.04 163 147 A 24 ASP HA A 25 ASP H 1.0 0.0 4.17 164 148 A 22 VAL HA A 25 ASP H 1.0 0.0 4.69 165 149 A 25 ASP H A 25 ASP HB3 1.0 0.0 4.12 166 150 A 25 ASP H A 25 ASP HB2 1.0 0.0 4.62 167 151 A 25 ASP H A 26 ILE H 1.0 0.0 4.58 168 152 A 26 ILE H A 27 LYS H 1.0 0.0 4.60 169 153 A 23 ASN HA A 26 ILE H 1.0 0.0 5.07 170 154 A 26 ILE H A 26 ILE HA 1.0 0.0 4.69 171 155 A 26 ILE H A 25 ASP HB3 1.0 0.0 5.01 172 156 A 26 ILE H A 25 ASP HB2 1.0 0.0 5.18 173 157 A 26 ILE H A 26 ILE HB 1.0 0.0 4.00 174 158 A 26 ILE H A 26 ILE HG1y 1.0 0.0 4.59 175 159 A 26 ILE H A 26 ILE HG1x 1.0 0.0 4.71 176 160 A 26 ILE H A 26 ILE HG2% 1.0 0.0 4.84 177 161 A 26 ILE H A 29 VAL HGy% 1.0 0.0 5.39 178 162 A 26 ILE H A 27 LYS H 1.0 0.0 4.60 179 163 A 24 ASP HA A 27 LYS H 1.0 0.0 5.02 180 164 A 27 LYS H A 27 LYS HA 1.0 0.0 4.28 181 165 A 27 LYS H A 27 LYS HB2 1.0 0.0 4.04 182 166 A 27 LYS H A 27 LYS HB3 1.0 0.0 4.55 183 167 A 27 LYS H A 27 LYS HGy 1.0 0.0 4.18 184 168 A 27 LYS H A 26 ILE HG2% 1.0 0.0 4.93 185 169 A 28 GLU H A 29 VAL H 1.0 0.0 4.26 186 170 A 27 LYS H A 28 GLU H 1.0 0.0 4.51 187 171 A 28 GLU H A 25 ASP HA 1.0 0.0 5.04 188 172 A 28 GLU H A 28 GLU HA 1.0 0.0 4.51 189 173 A 28 GLU H A 28 GLU HGy 1.0 0.0 4.44 190 174 A 27 LYS HB2 A 28 GLU H 1.0 0.0 4.49 191 175 A 28 GLU H A 28 GLU HBx 1.0 0.0 4.17 192 175 A 28 GLU H A 28 GLU HBy 1.0 0.0 4.17 193 176 A 29 VAL H A 30 GLU H 1.0 0.0 4.15 194 177 A 28 GLU H A 29 VAL H 1.0 0.0 4.15 195 178 A 29 VAL H A 28 GLU HA 1.0 0.0 5.18 196 179 A 29 VAL H A 29 VAL HA 1.0 0.0 4.22 197 180 A 26 ILE HA A 29 VAL H 1.0 0.0 4.87 198 181 A 29 VAL H A 29 VAL HB 1.0 0.0 4.32 199 182 A 29 VAL H A 28 GLU HBx 1.0 0.0 4.72 200 182 A 29 VAL H A 28 GLU HBy 1.0 0.0 4.72 201 183 A 29 VAL HGy% A 29 VAL H 1.0 0.0 3.94 202 184 A 29 VAL H A 30 GLU H 1.0 0.0 4.25 203 185 A 30 GLU H A 31 LYS H 1.0 0.0 4.27 204 186 A 30 GLU H A 29 VAL HA 1.0 0.0 4.15 205 187 A 26 ILE HA A 30 GLU H 1.0 0.0 5.49 206 188 A 30 GLU H A 30 GLU HGy 1.0 0.0 4.26 207 189 A 30 GLU H A 30 GLU HBy 1.0 0.0 3.89 208 190 A 30 GLU H A 30 GLU HBx 1.0 0.0 4.50 209 191 A 29 VAL HGy% A 30 GLU H 1.0 0.0 4.50 210 192 A 30 GLU H A 31 LYS H 1.0 0.0 4.50 211 193 A 31 LYS H A 32 ASN H 1.0 0.0 4.15 212 194 A 31 LYS H A 31 LYS HA 1.0 0.0 4.45 213 195 A 29 VAL HA A 31 LYS H 1.0 0.0 5.16 214 196 A 31 LYS H A 30 GLU HBy 1.0 0.0 4.93 215 197 A 31 LYS H A 31 LYS HBy 1.0 0.0 4.06 216 198 A 31 LYS H A 31 LYS HGx 1.0 0.0 4.48 217 198 A 31 LYS H A 31 LYS HGy 1.0 0.0 4.48 218 199 A 32 ASN HD2y A 32 ASN HD2x 1.0 0.0 2.86 219 200 A 32 ASN HD2y A 32 ASN HBy 1.0 0.0 4.35 220 201 A 32 ASN HD2y A 32 ASN HBx 1.0 0.0 4.33 221 202 A 31 LYS H A 32 ASN H 1.0 0.0 4.06 222 203 A 32 ASN H A 32 ASN HA 1.0 0.0 4.51 223 204 A 32 ASN H A 31 LYS HA 1.0 0.0 5.28 224 205 A 29 VAL HA A 32 ASN H 1.0 0.0 4.29 225 206 A 32 ASN H A 33 PRO HDx 1.0 0.0 4.96 226 207 A 32 ASN H A 32 ASN HBy 1.0 0.0 4.70 227 208 A 32 ASN H A 32 ASN HBx 1.0 0.0 4.86 228 209 A 32 ASN H A 31 LYS HBx 1.0 0.0 4.51 229 210 A 32 ASN HD2x A 32 ASN HBy 1.0 0.0 5.00 230 211 A 32 ASN HD2x A 32 ASN HBx 1.0 0.0 4.51 231 212 A 34 GLU H A 34 GLU HA 1.0 0.0 4.76 232 213 A 34 GLU H A 33 PRO HDy 1.0 0.0 5.12 233 214 A 34 GLU H A 34 GLU HGy 1.0 0.0 4.40 234 215 A 34 GLU H A 34 GLU HBx 1.0 0.0 4.15 235 216 A 95 ASP H A 96 MET H 1.0 0.0 4.20 236 217 A 97 VAL H A 96 MET H 1.0 0.0 4.14 237 218 A 35 ASP H A 35 ASP HA 1.0 0.0 4.38 238 219 A 34 GLU HA A 35 ASP H 1.0 0.0 4.72 239 220 A 96 MET H A 96 MET HA 1.0 0.0 4.14 240 221 A 35 ASP H A 35 ASP HBy 1.0 0.0 4.04 241 222 A 35 ASP H A 35 ASP HBx 1.0 0.0 3.91 242 223 A 96 MET H A 96 MET HB3 1.0 0.0 3.92 243 224 A 34 GLU HBx A 35 ASP H 1.0 0.0 5.13 244 225 A 35 ASP H A 29 VAL HGx% 1.0 0.0 5.10 245 226 A 35 ASP HA A 36 MET H 1.0 0.0 3.66 246 227 A 36 MET H A 36 MET HG2 1.0 0.0 4.84 247 228 A 36 MET H A 36 MET HG3 1.0 0.0 4.11 248 229 A 36 MET H A 36 MET HBy 1.0 0.0 4.45 249 230 A 37 GLU H A 38 TYR H 1.0 0.0 3.97 250 231 A 35 ASP HA A 37 GLU H 1.0 0.0 4.65 251 232 A 37 GLU H A 37 GLU HA 1.0 0.0 4.24 252 233 A 37 GLU H A 36 MET HBx 1.0 0.0 3.73 253 234 A 37 GLU H A 37 GLU HBx 1.0 0.0 4.11 254 235 A 37 GLU H A 38 TYR H 1.0 0.0 4.03 255 236 A 35 ASP HA A 38 TYR H 1.0 0.0 5.39 256 237 A 38 TYR H A 37 GLU HA 1.0 0.0 5.20 257 238 A 38 TYR H A 38 TYR HA 1.0 0.0 4.42 258 239 A 38 TYR H A 38 TYR HBy 1.0 0.0 4.11 259 240 A 38 TYR H A 37 GLU HBy 1.0 0.0 4.69 260 241 A 38 TYR H A 37 GLU HBx 1.0 0.0 4.58 261 242 A 29 VAL HGy% A 38 TYR H 1.0 0.0 5.41 262 243 A 39 TRP HD1 A 39 TRP HE1 1.0 0.0 4.34 263 244 A 39 TRP HE1 A 39 TRP HZ2 1.0 0.0 4.73 264 245 A 39 TRP HE1 A 33 PRO HA 1.0 0.0 5.23 265 246 A 39 TRP HE1 A 82 ILE HG2% 1.0 0.0 4.84 266 247 A 39 TRP HE1 A 82 ILE HD1% 1.0 0.0 4.80 267 248 A 29 VAL HGy% A 39 TRP HE1 1.0 0.0 5.03 268 249 A 40 ASN H A 39 TRP H 1.0 0.0 4.34 269 250 A 39 TRP H A 36 MET HA 1.0 0.0 4.04 270 251 A 39 TRP H A 39 TRP HBx 1.0 0.0 4.07 271 251 A 39 TRP H A 39 TRP HBy 1.0 0.0 4.07 272 252 A 39 TRP H A 38 TYR HBx 1.0 0.0 4.91 273 253 A 29 VAL HGx% A 39 TRP H 1.0 0.0 5.30 274 254 A 40 ASN HD2x A 40 ASN HD2y 1.0 0.0 2.93 275 255 A 40 ASN HD2y A 40 ASN HBy 1.0 0.0 4.46 276 256 A 40 ASN HD2y A 40 ASN HBx 1.0 0.0 4.79 277 257 A 40 ASN H A 39 TRP H 1.0 0.0 4.29 278 258 A 40 ASN H A 37 GLU HA 1.0 0.0 5.12 279 259 A 40 ASN H A 39 TRP HBx 1.0 0.0 4.56 280 259 A 40 ASN H A 39 TRP HBy 1.0 0.0 4.56 281 260 A 40 ASN H A 40 ASN HBy 1.0 0.0 3.84 282 261 A 40 ASN H A 40 ASN HBx 1.0 0.0 4.31 283 262 A 40 ASN HD2x A 40 ASN HD2y 1.0 0.0 2.93 284 263 A 40 ASN HD2x A 40 ASN HBy 1.0 0.0 5.07 285 264 A 42 ILE H A 41 LYS H 1.0 0.0 4.40 286 265 A 40 ASN H A 41 LYS H 1.0 0.0 4.50 287 266 A 41 LYS H A 40 ASN HA 1.0 0.0 5.53 288 267 A 38 TYR HA A 41 LYS H 1.0 0.0 4.16 289 268 A 40 ASN HBy A 41 LYS H 1.0 0.0 4.67 290 269 A 40 ASN HBx A 41 LYS H 1.0 0.0 4.87 291 270 A 41 LYS H A 41 LYS HBx 1.0 0.0 3.85 292 271 A 41 LYS H A 41 LYS HGx 1.0 0.0 4.64 293 271 A 41 LYS H A 41 LYS HGy 1.0 0.0 4.64 294 272 A 42 ILE H A 41 LYS H 1.0 0.0 4.46 295 273 A 42 ILE H A 39 TRP HA 1.0 0.0 4.96 296 274 A 23 ASN H A 22 VAL HGx% 1.0 0.0 4.17 297 275 A 42 ILE H A 42 ILE HD1% 1.0 0.0 5.00 298 276 A 42 ILE H A 43 TYR H 1.0 0.0 4.39 299 277 A 43 TYR H A 44 ARG H 1.0 0.0 4.51 300 278 A 43 TYR H A 39 TRP HA 1.0 0.0 5.44 301 279 A 43 TYR H A 40 ASN HA 1.0 0.0 4.94 302 280 A 43 TYR H A 43 TYR HA 1.0 0.0 4.33 303 281 A 43 TYR H A 43 TYR HBy 1.0 0.0 4.02 304 282 A 43 TYR H A 43 TYR HBx 1.0 0.0 3.95 305 283 A 43 TYR H A 42 ILE HB 1.0 0.0 4.42 306 284 A 43 TYR H A 44 ARG HBx 1.0 0.0 5.47 307 284 A 43 TYR H A 44 ARG HBy 1.0 0.0 5.47 308 285 A 43 TYR H A 72 VAL HGx% 1.0 0.0 4.80 309 286 A 43 TYR H A 42 ILE HG2% 1.0 0.0 4.67 310 287 A 43 TYR H A 44 ARG H 1.0 0.0 4.65 311 288 A 44 ARG H A 45 LEU H 1.0 0.0 4.42 312 289 A 44 ARG H A 44 ARG HA 1.0 0.0 4.62 313 290 A 44 ARG H A 43 TYR HBy 1.0 0.0 4.47 314 291 A 44 ARG H A 43 TYR HBx 1.0 0.0 4.70 315 292 A 44 ARG H A 44 ARG HBx 1.0 0.0 3.89 316 292 A 44 ARG H A 44 ARG HBy 1.0 0.0 3.89 317 293 A 44 ARG H A 44 ARG HGx 1.0 0.0 5.36 318 294 A 45 LEU H A 46 VAL H 1.0 0.0 4.11 319 295 A 44 ARG H A 45 LEU H 1.0 0.0 4.64 320 296 A 45 LEU H A 44 ARG HA 1.0 0.0 4.36 321 297 A 42 ILE HA A 45 LEU H 1.0 0.0 5.13 322 298 A 45 LEU H A 44 ARG HBx 1.0 0.0 3.78 323 298 A 44 ARG HBy A 45 LEU H 1.0 0.0 3.78 324 299 A 45 LEU H A 45 LEU HG 1.0 0.0 4.05 325 300 A 45 LEU H A 45 LEU HBx 1.0 0.0 4.61 326 301 A 45 LEU H A 45 LEU HDy% 1.0 0.0 4.54 327 302 A 45 LEU H A 46 VAL H 1.0 0.0 4.16 328 303 A 44 ARG HA A 46 VAL H 1.0 0.0 5.13 329 304 A 46 VAL H A 46 VAL HA 1.0 0.0 4.36 330 305 A 46 VAL H A 45 LEU HBy 1.0 0.0 3.60 331 306 A 46 VAL H A 45 LEU HBx 1.0 0.0 4.89 332 307 A 46 VAL H A 46 VAL HGy% 1.0 0.0 3.76 333 308 A 47 HIS H A 48 THR H 1.0 0.0 4.45 334 309 A 47 HIS H A 47 HIS HA 1.0 0.0 4.57 335 310 A 44 ARG HA A 47 HIS H 1.0 0.0 5.25 336 311 A 47 HIS H A 47 HIS HBy 1.0 0.0 4.07 337 312 A 47 HIS H A 47 HIS HBx 1.0 0.0 4.17 338 313 A 47 HIS H A 46 VAL HB 1.0 0.0 4.41 339 314 A 46 VAL HGy% A 47 HIS H 1.0 0.0 4.94 340 315 A 47 HIS H A 48 THR H 1.0 0.0 4.28 341 316 A 48 THR H A 48 THR HB 1.0 0.0 4.04 342 317 A 48 THR H A 47 HIS HA 1.0 0.0 5.36 343 318 A 48 THR H A 48 THR HA 1.0 0.0 4.36 344 319 A 48 THR H A 47 HIS HBy 1.0 0.0 4.36 345 320 A 48 THR H A 47 HIS HBx 1.0 0.0 5.02 346 321 A 48 THR H A 48 THR HG2% 1.0 0.0 4.85 347 322 A 49 MET H A 50 LYS H 1.0 0.0 4.45 348 323 A 48 THR H A 49 MET H 1.0 0.0 4.25 349 324 A 48 THR HB A 49 MET H 1.0 0.0 4.42 350 325 A 49 MET H A 49 MET HA 1.0 0.0 4.37 351 326 A 49 MET H A 49 MET HBy 1.0 0.0 4.38 352 327 A 68 ILE HB A 69 MET H 1.0 0.0 3.88 353 328 A 49 MET H A 49 MET HBx 1.0 0.0 5.02 354 329 A 48 THR HG2% A 49 MET H 1.0 0.0 4.96 355 330 A 18 LEU HDx% A 49 MET H 1.0 0.0 5.05 356 331 A 18 LEU HDy% A 49 MET H 1.0 0.0 4.67 357 332 A 49 MET H A 50 LYS H 1.0 0.0 4.67 358 333 A 50 LYS H A 51 GLU H 1.0 0.0 4.38 359 334 A 47 HIS HA A 50 LYS H 1.0 0.0 5.14 360 335 A 50 LYS H A 49 MET HA 1.0 0.0 4.49 361 336 A 50 LYS H A 49 MET HBy 1.0 0.0 5.00 362 337 A 50 LYS H A 50 LYS HBy 1.0 0.0 4.18 363 338 A 50 LYS H A 49 MET HBx 1.0 0.0 5.24 364 339 A 50 LYS H A 50 LYS HBx 1.0 0.0 4.27 365 340 A 50 LYS H A 65 LEU HG 1.0 0.0 4.83 366 341 A 50 LYS H A 51 GLU H 1.0 0.0 4.34 367 342 A 51 GLU H A 51 GLU HA 1.0 0.0 4.30 368 343 A 49 MET HA A 51 GLU H 1.0 0.0 5.26 369 344 A 51 GLU H A 50 LYS HBy 1.0 0.0 3.64 370 345 A 51 GLU H A 50 LYS HBx 1.0 0.0 4.74 371 346 A 52 ILE H A 53 THR H 1.0 0.0 4.34 372 347 A 89 LYS H A 90 VAL H 1.0 0.0 4.25 373 348 A 51 GLU HA A 52 ILE H 1.0 0.0 5.26 374 349 A 49 MET HA A 52 ILE H 1.0 0.0 4.24 375 350 A 90 VAL H A 90 VAL HA 1.0 0.0 4.49 376 351 A 90 VAL H A 90 VAL HB 1.0 0.0 3.93 377 352 A 52 ILE H A 51 GLU HBy 1.0 0.0 4.25 378 353 A 52 ILE H A 52 ILE HG1y 1.0 0.0 4.00 379 354 A 52 ILE H A 52 ILE HB 1.0 0.0 4.00 380 355 A 90 VAL H A 90 VAL HGy% 1.0 0.0 3.86 381 356 A 52 ILE H A 52 ILE HG1x 1.0 0.0 4.29 382 357 A 52 ILE H A 52 ILE HG2% 1.0 0.0 4.52 383 358 A 52 ILE H A 53 THR H 1.0 0.0 4.62 384 359 A 53 THR H A 53 THR HB 1.0 0.0 5.41 385 360 A 53 THR H A 52 ILE HA 1.0 0.0 4.38 386 361 A 53 THR H A 52 ILE HB 1.0 0.0 4.40 387 362 A 53 THR H A 53 THR HG2% 1.0 0.0 4.10 388 363 A 53 THR H A 52 ILE HG2% 1.0 0.0 4.66 389 364 A 54 GLU H A 55 THR H 1.0 0.0 4.25 390 365 A 53 THR HB A 54 GLU H 1.0 0.0 4.90 391 366 A 54 GLU H A 54 GLU HA 1.0 0.0 3.84 392 367 A 54 GLU H A 54 GLU HGy 1.0 0.0 4.42 393 368 A 54 GLU H A 54 GLU HBy 1.0 0.0 3.78 394 369 A 54 GLU H A 54 GLU HBx 1.0 0.0 4.44 395 370 A 54 GLU H A 62 ALA HB% 1.0 0.0 4.85 396 371 A 53 THR HG2% A 54 GLU H 1.0 0.0 4.93 397 372 A 54 GLU H A 55 THR H 1.0 0.0 4.13 398 373 A 55 THR H A 56 MET H 1.0 0.0 4.36 399 374 A 55 THR H A 55 THR HB 1.0 0.0 3.94 400 375 A 55 THR H A 54 GLU HA 1.0 0.0 3.96 401 376 A 52 ILE HA A 55 THR H 1.0 0.0 5.30 402 377 A 55 THR H A 54 GLU HBy 1.0 0.0 4.28 403 378 A 55 THR H A 54 GLU HBx 1.0 0.0 4.48 404 379 A 55 THR H A 55 THR HG2% 1.0 0.0 4.44 405 380 A 53 THR H A 56 MET H 1.0 0.0 5.22 406 381 A 55 THR H A 56 MET H 1.0 0.0 4.21 407 382 A 56 MET H A 56 MET HA 1.0 0.0 4.18 408 383 A 54 GLU HA A 56 MET H 1.0 0.0 5.14 409 384 A 56 MET H A 53 THR HA 1.0 0.0 5.15 410 385 A 56 MET H A 56 MET HGy 1.0 0.0 4.64 411 386 A 56 MET H A 56 MET HGx 1.0 0.0 4.91 412 387 A 56 MET H A 56 MET HBx 1.0 0.0 4.02 413 387 A 56 MET H A 56 MET HBy 1.0 0.0 4.02 414 388 A 57 GLY H A 58 PHE H 1.0 0.0 4.29 415 389 A 57 GLY H A 57 GLY HAy 1.0 0.0 4.70 416 390 A 54 GLU HA A 57 GLY H 1.0 0.0 4.62 417 391 A 57 GLY H A 57 GLY HAx 1.0 0.0 4.31 418 392 A 57 GLY H A 56 MET HBx 1.0 0.0 5.39 419 392 A 56 MET HBy A 57 GLY H 1.0 0.0 5.39 420 393 A 57 GLY H A 58 PHE H 1.0 0.0 4.18 421 394 A 58 PHE H A 58 PHE HA 1.0 0.0 4.65 422 395 A 53 THR HB A 58 PHE H 1.0 0.0 5.23 423 396 A 58 PHE H A 57 GLY HAx 1.0 0.0 5.02 424 397 A 53 THR HA A 58 PHE H 1.0 0.0 5.24 425 398 A 58 PHE H A 58 PHE HBy 1.0 0.0 4.53 426 399 A 58 PHE H A 58 PHE HBx 1.0 0.0 4.26 427 400 A 58 PHE H A 56 MET HBx 1.0 0.0 4.79 428 400 A 56 MET HBy A 58 PHE H 1.0 0.0 4.79 429 401 A 58 PHE HA A 59 SER H 1.0 0.0 4.64 430 402 A 61 VAL H A 62 ALA H 1.0 0.0 4.10 431 403 A 61 VAL H A 61 VAL HA 1.0 0.0 4.32 432 404 A 61 VAL H A 61 VAL HB 1.0 0.0 4.08 433 405 A 61 VAL H A 61 VAL HGx% 1.0 0.0 4.82 434 406 A 61 VAL H A 61 VAL HGy% 1.0 0.0 3.95 435 407 A 62 ALA H A 63 LYS H 1.0 0.0 4.56 436 408 A 61 VAL H A 62 ALA H 1.0 0.0 4.21 437 409 A 53 THR HB A 62 ALA H 1.0 0.0 5.22 438 410 A 62 ALA H A 62 ALA HA 1.0 0.0 4.26 439 411 A 62 ALA H A 61 VAL HB 1.0 0.0 4.28 440 412 A 62 ALA HB% A 62 ALA H 1.0 0.0 3.71 441 413 A 62 ALA H A 61 VAL HGx% 1.0 0.0 5.15 442 414 A 62 ALA H A 61 VAL HGy% 1.0 0.0 5.26 443 415 A 62 ALA H A 63 LYS H 1.0 0.0 4.26 444 416 A 63 LYS H A 64 VAL H 1.0 0.0 4.23 445 417 A 63 LYS H A 63 LYS HA 1.0 0.0 4.21 446 418 A 63 LYS H A 63 LYS HBx 1.0 0.0 3.62 447 418 A 63 LYS H A 63 LYS HBy 1.0 0.0 3.62 448 419 A 62 ALA HB% A 63 LYS H 1.0 0.0 4.12 449 420 A 64 VAL H A 65 LEU H 1.0 0.0 4.04 450 421 A 63 LYS H A 64 VAL H 1.0 0.0 4.15 451 422 A 64 VAL H A 64 VAL HA 1.0 0.0 4.41 452 423 A 64 VAL H A 64 VAL HB 1.0 0.0 4.00 453 424 A 64 VAL H A 63 LYS HBx 1.0 0.0 4.16 454 424 A 64 VAL H A 63 LYS HBy 1.0 0.0 4.16 455 425 A 64 VAL HGx% A 64 VAL H 1.0 0.0 4.87 456 426 A 65 LEU H A 66 HIS H 1.0 0.0 4.72 457 427 A 64 VAL H A 65 LEU H 1.0 0.0 4.33 458 428 A 65 LEU H A 65 LEU HA 1.0 0.0 4.82 459 429 A 65 LEU H A 64 VAL HB 1.0 0.0 4.48 460 430 A 65 LEU H A 65 LEU HBy 1.0 0.0 4.44 461 431 A 65 LEU H A 65 LEU HBx 1.0 0.0 4.71 462 432 A 65 LEU H A 65 LEU HDx% 1.0 0.0 4.83 463 433 A 64 VAL HGx% A 65 LEU H 1.0 0.0 4.55 464 434 A 65 LEU HG A 65 LEU H 1.0 0.0 4.76 465 435 A 65 LEU H A 66 HIS H 1.0 0.0 4.71 466 436 A 66 HIS H A 67 THR H 1.0 0.0 4.39 467 437 A 66 HIS H A 66 HIS HA 1.0 0.0 4.53 468 438 A 63 LYS HA A 66 HIS H 1.0 0.0 4.80 469 439 A 66 HIS H A 66 HIS HBy 1.0 0.0 4.20 470 440 A 66 HIS H A 66 HIS HBx 1.0 0.0 4.02 471 441 A 66 HIS H A 65 LEU HBx 1.0 0.0 5.25 472 442 A 66 HIS H A 67 THR H 1.0 0.0 4.44 473 443 A 65 LEU H A 67 THR H 1.0 0.0 5.28 474 444 A 67 THR H A 67 THR HB 1.0 0.0 4.31 475 445 A 67 THR H A 66 HIS HA 1.0 0.0 5.21 476 446 A 67 THR H A 67 THR HA 1.0 0.0 4.28 477 447 A 64 VAL HA A 67 THR H 1.0 0.0 5.34 478 448 A 67 THR H A 66 HIS HBy 1.0 0.0 4.40 479 449 A 67 THR H A 66 HIS HBx 1.0 0.0 4.99 480 450 A 67 THR H A 67 THR HG2% 1.0 0.0 4.16 481 451 A 69 MET H A 68 ILE H 1.0 0.0 4.42 482 452 A 67 THR HB A 68 ILE H 1.0 0.0 4.97 483 453 A 65 LEU HA A 68 ILE H 1.0 0.0 5.03 484 454 A 68 ILE H A 68 ILE HA 1.0 0.0 4.69 485 455 A 68 ILE HB A 68 ILE H 1.0 0.0 4.11 486 456 A 111 VAL H A 111 VAL HB 1.0 0.0 4.02 487 457 A 68 ILE H A 69 MET HG2 1.0 0.0 4.31 488 458 A 68 ILE H A 68 ILE HD1% 1.0 0.0 4.47 489 459 A 69 MET H A 68 ILE H 1.0 0.0 4.44 490 460 A 69 MET H A 66 HIS HA 1.0 0.0 5.17 491 461 A 69 MET H A 69 MET HA 1.0 0.0 4.51 492 462 A 69 MET H A 69 MET HG3 1.0 0.0 4.26 493 463 A 69 MET H A 46 VAL HGx% 1.0 0.0 4.44 494 464 A 70 ASN HD2x A 70 ASN HD2y 1.0 0.0 3.22 495 465 A 70 ASN HD2y A 70 ASN HBx 1.0 0.0 4.67 496 465 A 70 ASN HD2y A 70 ASN HBy 1.0 0.0 4.67 497 466 A 70 ASN H A 71 LEU H 1.0 0.0 4.37 498 467 A 70 ASN H A 70 ASN HA 1.0 0.0 4.30 499 468 A 98 THR H A 98 THR HB 1.0 0.0 4.08 500 469 A 67 THR HA A 70 ASN H 1.0 0.0 4.97 501 470 A 98 THR H A 98 THR HA 1.0 0.0 4.37 502 471 A 70 ASN H A 70 ASN HBx 1.0 0.0 3.69 503 471 A 70 ASN HBy A 70 ASN H 1.0 0.0 3.69 504 472 A 70 ASN H A 69 MET HB3 1.0 0.0 4.57 505 473 A 70 ASN H A 69 MET HB2 1.0 0.0 4.54 506 474 A 70 ASN HD2x A 70 ASN HD2y 1.0 0.0 3.21 507 475 A 71 LEU H A 72 VAL H 1.0 0.0 4.04 508 476 A 70 ASN H A 71 LEU H 1.0 0.0 4.32 509 477 A 71 LEU H A 70 ASN HA 1.0 0.0 5.26 510 478 A 71 LEU H A 71 LEU HA 1.0 0.0 4.20 511 479 A 68 ILE HA A 71 LEU H 1.0 0.0 5.12 512 480 A 71 LEU H A 70 ASN HBx 1.0 0.0 4.22 513 480 A 70 ASN HBy A 71 LEU H 1.0 0.0 4.22 514 481 A 71 LEU H A 71 LEU HB3 1.0 0.0 4.07 515 482 A 71 LEU H A 71 LEU HG 1.0 0.0 4.49 516 483 A 71 LEU H A 71 LEU HB2 1.0 0.0 4.26 517 484 A 71 LEU H A 71 LEU HDy% 1.0 0.0 4.99 518 485 A 72 VAL H A 73 ASP H 1.0 0.0 4.17 519 486 A 71 LEU H A 72 VAL H 1.0 0.0 4.15 520 487 A 72 VAL H A 71 LEU HA 1.0 0.0 5.00 521 488 A 72 VAL H A 72 VAL HA 1.0 0.0 4.31 522 489 A 72 VAL H A 72 VAL HB 1.0 0.0 3.89 523 490 A 72 VAL H A 71 LEU HB3 1.0 0.0 4.51 524 491 A 72 VAL H A 71 LEU HB2 1.0 0.0 4.53 525 492 A 72 VAL H A 72 VAL HGy% 1.0 0.0 3.78 526 493 A 72 VAL H A 68 ILE HG2% 1.0 0.0 5.19 527 494 A 72 VAL H A 71 LEU HDy% 1.0 0.0 5.18 528 495 A 72 VAL H A 73 ASP H 1.0 0.0 4.23 529 496 A 73 ASP H A 74 LYS H 1.0 0.0 4.29 530 497 A 73 ASP H A 43 TYR HE% 1.0 0.0 4.89 531 498 A 70 ASN HA A 73 ASP H 1.0 0.0 4.90 532 499 A 73 ASP H A 73 ASP HA 1.0 0.0 4.23 533 500 A 73 ASP H A 72 VAL HA 1.0 0.0 4.97 534 501 A 73 ASP H A 73 ASP HBy 1.0 0.0 3.90 535 502 A 73 ASP H A 73 ASP HBx 1.0 0.0 4.00 536 503 A 73 ASP H A 72 VAL HB 1.0 0.0 4.50 537 504 A 72 VAL HGx% A 73 ASP H 1.0 0.0 4.99 538 505 A 73 ASP H A 74 LYS H 1.0 0.0 4.47 539 506 A 74 LYS H A 75 MET H 1.0 0.0 4.32 540 507 A 74 LYS H A 74 LYS HA 1.0 0.0 4.17 541 508 A 74 LYS H A 73 ASP HBy 1.0 0.0 4.89 542 509 A 74 LYS H A 73 ASP HBx 1.0 0.0 4.40 543 510 A 74 LYS H A 74 LYS HBy 1.0 0.0 4.12 544 511 A 74 LYS H A 75 MET HGx 1.0 0.0 4.36 545 512 A 74 LYS H A 74 LYS HBx 1.0 0.0 4.21 546 513 A 76 LEU H A 75 MET H 1.0 0.0 4.32 547 514 A 74 LYS H A 75 MET H 1.0 0.0 4.51 548 515 A 75 MET H A 74 LYS HA 1.0 0.0 5.04 549 516 A 75 MET H A 75 MET HA 1.0 0.0 4.58 550 517 A 72 VAL HA A 75 MET H 1.0 0.0 5.19 551 518 A 75 MET H A 75 MET HGy 1.0 0.0 4.40 552 519 A 75 MET H A 74 LYS HBy 1.0 0.0 4.82 553 520 A 75 MET H A 75 MET HBx 1.0 0.0 4.41 554 521 A 75 MET H A 75 MET HGx 1.0 0.0 4.74 555 522 A 75 MET H A 74 LYS HBx 1.0 0.0 5.00 556 523 A 72 VAL HGx% A 75 MET H 1.0 0.0 4.88 557 524 A 76 LEU H A 75 MET H 1.0 0.0 4.05 558 525 A 76 LEU H A 73 ASP HA 1.0 0.0 5.09 559 526 A 76 LEU H A 76 LEU HA 1.0 0.0 4.56 560 527 A 76 LEU H A 75 MET HA 1.0 0.0 5.55 561 528 A 76 LEU H A 75 MET HBx 1.0 0.0 4.02 562 529 A 76 LEU H A 72 VAL HGx% 1.0 0.0 4.32 563 530 A 77 ASN HD2x A 77 ASN HD2y 1.0 0.0 2.98 564 531 A 77 ASN HBy A 77 ASN HD2y 1.0 0.0 4.91 565 532 A 77 ASN HBx A 77 ASN HD2y 1.0 0.0 4.41 566 533 A 77 ASN HD2x A 77 ASN HD2y 1.0 0.0 3.01 567 534 A 77 ASN HBy A 77 ASN HD2x 1.0 0.0 5.07 568 535 A 77 ASN HBx A 77 ASN HD2x 1.0 0.0 4.83 569 536 A 78 SER H A 79 GLU H 1.0 0.0 4.48 570 537 A 77 ASN HA A 78 SER H 1.0 0.0 4.52 571 538 A 78 SER H A 78 SER HA 1.0 0.0 3.70 572 539 A 78 SER H A 78 SER HBx 1.0 0.0 4.46 573 539 A 78 SER H A 78 SER HBy 1.0 0.0 4.46 574 540 A 78 SER H A 79 GLU H 1.0 0.0 4.84 575 541 A 79 GLU H A 80 ILE H 1.0 0.0 4.13 576 542 A 79 GLU H A 78 SER HA 1.0 0.0 4.48 577 543 A 79 GLU H A 79 GLU HA 1.0 0.0 4.65 578 544 A 79 GLU H A 78 SER HBx 1.0 0.0 4.98 579 544 A 79 GLU H A 78 SER HBy 1.0 0.0 4.98 580 545 A 79 GLU H A 79 GLU HGy 1.0 0.0 4.46 581 546 A 79 GLU H A 79 GLU HBx 1.0 0.0 4.26 582 547 A 79 GLU H A 80 ILE H 1.0 0.0 4.20 583 548 A 78 SER HA A 80 ILE H 1.0 0.0 4.29 584 549 A 80 ILE H A 79 GLU HA 1.0 0.0 4.77 585 550 A 80 ILE H A 79 GLU HBy 1.0 0.0 5.18 586 551 A 80 ILE H A 79 GLU HBx 1.0 0.0 5.19 587 552 A 80 ILE H A 80 ILE HB 1.0 0.0 4.57 588 553 A 80 ILE H A 80 ILE HG1y 1.0 0.0 4.95 589 554 A 80 ILE H A 80 ILE HG1x 1.0 0.0 4.58 590 555 A 80 ILE H A 80 ILE HG2% 1.0 0.0 4.54 591 556 A 80 ILE HA A 81 LYS H 1.0 0.0 3.88 592 557 A 81 LYS H A 81 LYS HA 1.0 0.0 5.11 593 558 A 81 LYS H A 81 LYS HBx 1.0 0.0 3.86 594 558 A 81 LYS H A 81 LYS HBy 1.0 0.0 3.86 595 559 A 80 ILE HG1y A 81 LYS H 1.0 0.0 5.41 596 560 A 80 ILE HG1x A 81 LYS H 1.0 0.0 5.58 597 561 A 82 ILE H A 83 THR HA 1.0 0.0 4.99 598 562 A 81 LYS HA A 82 ILE H 1.0 0.0 3.79 599 563 A 82 ILE H A 82 ILE HA 1.0 0.0 4.95 600 564 A 82 ILE H A 82 ILE HB 1.0 0.0 4.35 601 565 A 82 ILE H A 81 LYS HBx 1.0 0.0 4.07 602 565 A 81 LYS HBy A 82 ILE H 1.0 0.0 4.07 603 566 A 82 ILE HG2% A 82 ILE H 1.0 0.0 5.24 604 567 A 82 ILE H A 82 ILE HG1x 1.0 0.0 4.63 605 568 A 83 THR HA A 83 THR H 1.0 0.0 4.38 606 569 A 82 ILE HA A 83 THR H 1.0 0.0 4.04 607 570 A 83 THR H A 86 LEU HBx 1.0 0.0 4.76 608 571 A 83 THR H A 75 MET HE% 1.0 0.0 4.99 609 572 A 82 ILE HG2% A 83 THR H 1.0 0.0 4.82 610 573 A 83 THR H A 86 LEU HDy% 1.0 0.0 5.34 611 574 A 86 LEU H A 88 ASP H 1.0 0.0 4.78 612 575 A 86 LEU H A 87 ILE H 1.0 0.0 4.27 613 576 A 83 THR HA A 86 LEU H 1.0 0.0 4.58 614 577 A 86 LEU H A 86 LEU HA 1.0 0.0 4.41 615 578 A 86 LEU H A 85 ASP HBx 1.0 0.0 4.66 616 578 A 86 LEU H A 85 ASP HBy 1.0 0.0 4.66 617 579 A 86 LEU H A 87 ILE HB 1.0 0.0 5.36 618 580 A 86 LEU H A 86 LEU HBy 1.0 0.0 4.10 619 581 A 86 LEU H A 86 LEU HDx% 1.0 0.0 5.11 620 582 A 88 ASP H A 87 ILE H 1.0 0.0 4.22 621 583 A 87 ILE H A 86 LEU HA 1.0 0.0 5.23 622 584 A 87 ILE H A 87 ILE HA 1.0 0.0 4.68 623 585 A 87 ILE H A 87 ILE HB 1.0 0.0 3.81 624 586 A 104 LYS H A 104 LYS HBy 1.0 0.0 4.27 625 587 A 75 MET HE% A 87 ILE H 1.0 0.0 4.61 626 588 A 87 ILE H A 87 ILE HG2% 1.0 0.0 4.29 627 589 A 100 GLU H A 101 LEU H 1.0 0.0 4.15 628 590 A 88 ASP H A 87 ILE H 1.0 0.0 3.98 629 591 A 88 ASP H A 88 ASP HA 1.0 0.0 4.06 630 592 A 88 ASP H A 86 LEU HA 1.0 0.0 5.07 631 593 A 100 GLU H A 100 GLU HA 1.0 0.0 4.20 632 594 A 88 ASP H A 87 ILE HA 1.0 0.0 5.17 633 595 A 88 ASP H A 88 ASP HBy 1.0 0.0 3.81 634 596 A 88 ASP H A 88 ASP HBx 1.0 0.0 4.16 635 597 A 88 ASP H A 87 ILE HB 1.0 0.0 4.02 636 598 A 88 ASP H A 86 LEU HG 1.0 0.0 5.44 637 599 A 88 ASP H A 87 ILE HG2% 1.0 0.0 4.64 638 600 A 89 LYS H A 88 ASP H 1.0 0.0 4.29 639 601 A 89 LYS H A 90 VAL H 1.0 0.0 4.20 640 602 A 89 LYS H A 86 LEU HA 1.0 0.0 4.74 641 603 A 89 LYS H A 89 LYS HA 1.0 0.0 4.32 642 604 A 89 LYS H A 88 ASP HBy 1.0 0.0 4.94 643 605 A 89 LYS H A 88 ASP HBx 1.0 0.0 4.77 644 606 A 89 LYS H A 89 LYS HBy 1.0 0.0 4.00 645 607 A 89 LYS H A 89 LYS HBx 1.0 0.0 4.30 646 608 A 89 LYS H A 86 LEU HG 1.0 0.0 4.51 647 609 A 90 VAL H A 91 LYS H 1.0 0.0 4.24 648 610 A 90 VAL H A 87 ILE HA 1.0 0.0 5.17 649 611 A 90 VAL H A 91 LYS H 1.0 0.0 4.39 650 612 A 88 ASP HA A 91 LYS H 1.0 0.0 5.14 651 613 A 91 LYS H A 91 LYS HA 1.0 0.0 4.65 652 614 A 90 VAL HB A 91 LYS H 1.0 0.0 4.52 653 615 A 91 LYS H A 91 LYS HB3 1.0 0.0 4.04 654 616 A 91 LYS H A 91 LYS HGx 1.0 0.0 4.34 655 616 A 91 LYS H A 91 LYS HGy 1.0 0.0 4.34 656 617 A 87 ILE HG2% A 91 LYS H 1.0 0.0 4.98 657 618 A 92 LYS H A 92 LYS HA 1.0 0.0 4.15 658 619 A 92 LYS H A 93 LYS H 1.0 0.0 3.85 659 620 A 98 THR H A 99 ARG H 1.0 0.0 4.04 660 621 A 98 THR HB A 99 ARG H 1.0 0.0 4.41 661 622 A 90 VAL HA A 93 LYS H 1.0 0.0 5.20 662 623 A 93 LYS H A 92 LYS HBx 1.0 0.0 3.67 663 624 A 92 LYS HG3 A 93 LYS H 1.0 0.0 3.82 664 625 A 93 LYS H A 94 LEU H 1.0 0.0 4.34 665 626 A 94 LEU H A 94 LEU HA 1.0 0.0 4.44 666 627 A 94 LEU HBy A 94 LEU H 1.0 0.0 3.97 667 628 A 94 LEU H A 94 LEU HBx 1.0 0.0 4.19 668 629 A 94 LEU H A 90 VAL HGx% 1.0 0.0 5.16 669 630 A 94 LEU H A 94 LEU HDx% 1.0 0.0 4.53 670 630 A 94 LEU H A 94 LEU HDy% 1.0 0.0 4.53 671 631 A 24 ASP H A 25 ASP H 1.0 0.0 4.24 672 632 A 95 ASP H A 96 MET H 1.0 0.0 4.27 673 633 A 95 ASP H A 92 LYS HA 1.0 0.0 4.82 674 634 A 95 ASP H A 94 LEU HBx 1.0 0.0 4.76 675 635 A 96 MET H A 93 LYS H 1.0 0.0 4.67 676 636 A 97 VAL H A 96 MET H 1.0 0.0 4.35 677 637 A 97 VAL H A 96 MET HA 1.0 0.0 5.19 678 638 A 69 MET H A 70 ASN H 1.0 0.0 4.35 679 639 A 98 THR H A 99 ARG H 1.0 0.0 4.39 680 640 A 97 VAL HB A 98 THR H 1.0 0.0 4.24 681 641 A 98 THR H A 98 THR HG2% 1.0 0.0 4.86 682 642 A 19 ILE HG2% A 98 THR H 1.0 0.0 4.63 683 643 A 100 GLU H A 99 ARG H 1.0 0.0 4.37 684 644 A 100 GLU H A 100 GLU HGx 1.0 0.0 4.40 685 644 A 100 GLU H A 100 GLU HGy 1.0 0.0 4.40 686 645 A 100 GLU H A 99 ARG HBy 1.0 0.0 4.01 687 646 A 101 LEU H A 102 ASP H 1.0 0.0 4.34 688 647 A 101 LEU H A 101 LEU HBx 1.0 0.0 4.70 689 648 A 101 LEU H A 102 ASP H 1.0 0.0 4.21 690 649 A 102 ASP H A 103 LYS H 1.0 0.0 4.36 691 650 A 102 ASP H A 102 ASP HA 1.0 0.0 4.24 692 651 A 102 ASP H A 99 ARG HA 1.0 0.0 5.01 693 652 A 102 ASP H A 101 LEU HA 1.0 0.0 5.04 694 653 A 102 ASP H A 102 ASP HBy 1.0 0.0 3.92 695 654 A 102 ASP H A 101 LEU HBy 1.0 0.0 4.43 696 655 A 102 ASP H A 101 LEU HBx 1.0 0.0 5.03 697 656 A 102 ASP H A 103 LYS H 1.0 0.0 4.45 698 657 A 104 LYS H A 103 LYS H 1.0 0.0 4.31 699 658 A 103 LYS H A 102 ASP HA 1.0 0.0 5.09 700 659 A 103 LYS H A 103 LYS HA 1.0 0.0 4.00 701 660 A 103 LYS H A 102 ASP HBy 1.0 0.0 4.89 702 661 A 103 LYS H A 102 ASP HBx 1.0 0.0 5.02 703 662 A 103 LYS H A 103 LYS HBx 1.0 0.0 3.74 704 662 A 103 LYS H A 103 LYS HBy 1.0 0.0 3.74 705 663 A 103 LYS H A 103 LYS HGx 1.0 0.0 4.41 706 663 A 103 LYS H A 103 LYS HGy 1.0 0.0 4.41 707 664 A 104 LYS H A 103 LYS H 1.0 0.0 4.43 708 665 A 104 LYS H A 103 LYS HA 1.0 0.0 4.22 709 666 A 104 LYS H A 101 LEU HA 1.0 0.0 5.11 710 667 A 104 LYS H A 103 LYS HBx 1.0 0.0 4.45 711 667 A 104 LYS H A 103 LYS HBy 1.0 0.0 4.45 712 668 A 104 LYS H A 103 LYS HGx 1.0 0.0 4.58 713 668 A 104 LYS H A 103 LYS HGy 1.0 0.0 4.58 714 669 A 104 LYS H A 104 LYS HGy 1.0 0.0 4.71 715 670 A 105 VAL H A 105 VAL HA 1.0 0.0 4.23 716 671 A 105 VAL H A 105 VAL HB 1.0 0.0 4.32 717 672 A 104 LYS HBy A 105 VAL H 1.0 0.0 5.16 718 673 A 105 VAL H A 104 LYS HBx 1.0 0.0 5.02 719 674 A 105 VAL H A 105 VAL HGx% 1.0 0.0 3.96 720 674 A 105 VAL H A 105 VAL HGy% 1.0 0.0 3.96 721 675 A 106 SER H A 106 SER HA 1.0 0.0 4.72 722 676 A 105 VAL HA A 106 SER H 1.0 0.0 4.64 723 677 A 106 SER H A 106 SER HBx 1.0 0.0 4.40 724 677 A 106 SER H A 106 SER HBy 1.0 0.0 4.40 725 678 A 105 VAL HB A 106 SER H 1.0 0.0 5.03 726 679 A 106 SER H A 105 VAL HGx% 1.0 0.0 5.24 727 679 A 105 VAL HGy% A 106 SER H 1.0 0.0 5.24 728 680 A 107 GLY H A 106 SER HBx 1.0 0.0 5.21 729 680 A 106 SER HBy A 107 GLY H 1.0 0.0 5.21 730 681 A 109 TYR HA A 109 TYR H 1.0 0.0 5.11 731 682 A 109 TYR H A 108 SER HA 1.0 0.0 5.30 732 683 A 109 TYR H A 109 TYR HBy 1.0 0.0 5.20 733 684 A 109 TYR H A 109 TYR HBx 1.0 0.0 5.00 734 685 A 14 GLU H A 13 ASP HA 1.0 0.0 5.32 735 686 A 111 VAL H A 110 LEU HBx 1.0 0.0 5.13 736 687 A 112 PRO HA A 113 ARG H 1.0 0.0 3.93 737 688 A 113 ARG H A 113 ARG HA 1.0 0.0 4.99 738 689 A 113 ARG H A 113 ARG HBx 1.0 0.0 5.17 739 690 A 6 GLU H A 6 GLU HGy 1.0 0.0 4.69 740 691 A 7 TYR H A 7 TYR HD% 1.0 0.0 5.52 741 692 A 8 ILE H A 7 TYR HD% 1.0 0.0 5.59 742 693 A 9 LYS H A 9 LYS HGy 1.0 0.0 4.44 743 694 A 8 ILE HG2% A 12 THR H 1.0 0.0 5.49 744 695 A 15 LEU HA A 16 LYS H 1.0 0.0 5.44 745 696 A 13 ASP HA A 17 GLU H 1.0 0.0 6.00 746 697 A 18 LEU HB2 A 17 GLU H 1.0 0.0 4.64 747 698 A 23 ASN HD2y A 23 ASN H 1.0 0.0 5.42 748 699 A 25 ASP H A 24 ASP HBx 1.0 0.0 4.83 749 700 A 25 ASP H A 24 ASP HBy 1.0 0.0 4.35 750 701 A 30 GLU H A 32 ASN H 1.0 0.0 5.44 751 702 A 34 GLU H A 33 PRO HB2 1.0 0.0 4.70 752 703 A 35 ASP HBx A 36 MET H 1.0 0.0 5.25 753 704 A 36 MET H A 36 MET HBx 1.0 0.0 5.02 754 705 A 35 ASP HBy A 38 TYR H 1.0 0.0 5.61 755 706 A 38 TYR HA A 39 TRP H 1.0 0.0 5.53 756 707 A 36 MET H A 39 TRP H 1.0 0.0 5.43 757 708 A 37 GLU H A 39 TRP H 1.0 0.0 5.49 758 709 A 40 ASN H A 40 ASN HD2y 1.0 0.0 6.00 759 710 A 40 ASN H A 40 ASN HD2x 1.0 0.0 5.18 760 711 A 40 ASN H A 39 TRP HA 1.0 0.0 4.91 761 712 A 40 ASN H A 40 ASN HA 1.0 0.0 4.52 762 713 A 40 ASN H A 40 ASN HD2y 1.0 0.0 5.26 763 714 A 37 GLU HA A 40 ASN HD2y 1.0 0.0 5.39 764 715 A 40 ASN HD2x A 41 LYS H 1.0 0.0 5.49 765 716 A 44 ARG H A 43 TYR HD% 1.0 0.0 5.49 766 717 A 46 VAL H A 45 LEU HG 1.0 0.0 5.48 767 718 A 46 VAL H A 46 VAL HGx% 1.0 0.0 4.58 768 719 A 42 ILE HA A 46 VAL H 1.0 0.0 5.67 769 720 A 43 TYR HA A 46 VAL H 1.0 0.0 5.29 770 721 A 48 THR H A 45 LEU HA 1.0 0.0 5.12 771 722 A 49 MET H A 49 MET HGy 1.0 0.0 4.61 772 723 A 49 MET H A 49 MET HGx 1.0 0.0 4.67 773 724 A 48 THR HA A 51 GLU H 1.0 0.0 5.06 774 725 A 54 GLU H A 50 LYS HA 1.0 0.0 5.06 775 726 A 56 MET H A 55 THR HG2% 1.0 0.0 5.01 776 727 A 56 MET H A 58 PHE H 1.0 0.0 5.42 777 728 A 56 MET HA A 57 GLY H 1.0 0.0 5.05 778 729 A 58 PHE HBy A 61 VAL H 1.0 0.0 5.22 779 730 A 61 VAL H A 60 SER HBx 1.0 0.0 5.36 780 731 A 61 VAL H A 60 SER HA 1.0 0.0 5.54 781 732 A 53 THR HG2% A 62 ALA H 1.0 0.0 5.28 782 733 A 63 LYS H A 60 SER HA 1.0 0.0 5.19 783 734 A 63 LYS H A 62 ALA HA 1.0 0.0 5.11 784 735 A 64 VAL H A 63 LYS HA 1.0 0.0 5.37 785 736 A 62 ALA HB% A 64 VAL H 1.0 0.0 5.24 786 737 A 62 ALA HA A 65 LEU H 1.0 0.0 5.24 787 738 A 64 VAL HGx% A 68 ILE H 1.0 0.0 5.32 788 739 A 69 MET HA A 70 ASN H 1.0 0.0 5.93 789 740 A 69 MET HA A 72 VAL H 1.0 0.0 5.06 790 741 A 77 ASN H A 77 ASN HD2x 1.0 0.0 5.31 791 742 A 77 ASN H A 77 ASN HD2y 1.0 0.0 4.49 792 743 A 77 ASN H A 77 ASN HD2x 1.0 0.0 5.29 793 744 A 83 THR H A 86 LEU H 1.0 0.0 5.41 794 745 A 92 LYS H A 91 LYS HB2 1.0 0.0 3.62 795 746 A 92 LYS HA A 93 LYS H 1.0 0.0 4.06 796 747 A 108 SER HA A 108 SER H 1.0 0.0 4.82 797 748 A 109 TYR H A 109 TYR HD% 1.0 0.0 5.49 798 749 A 4 HIS HA A 4 HIS HBx 1.0 0.0 3.63 799 749 A 4 HIS HA A 4 HIS HBy 1.0 0.0 3.63 800 750 A 4 HIS HD2 A 4 HIS HBx 1.0 0.0 5.12 801 750 A 4 HIS HBy A 4 HIS HD2 1.0 0.0 5.12 802 751 A 4 HIS HA A 4 HIS HBx 1.0 0.0 4.36 803 751 A 4 HIS HA A 4 HIS HBy 1.0 0.0 4.36 804 752 A 54 GLU H A 54 GLU HA 1.0 0.0 3.86 805 753 A 100 GLU H A 100 GLU HA 1.0 0.0 4.07 806 754 A 51 GLU H A 51 GLU HA 1.0 0.0 3.87 807 755 A 20 GLN H A 20 GLN HA 1.0 0.0 4.11 808 756 A 23 ASN HB2 A 20 GLN HA 1.0 0.0 4.12 809 757 A 5 GLN HA A 5 GLN HGy 1.0 0.0 3.81 810 758 A 6 GLU HA A 6 GLU HGx 1.0 0.0 3.89 811 759 A 20 GLN HA A 20 GLN HBx 1.0 0.0 3.50 812 759 A 20 GLN HBy A 20 GLN HA 1.0 0.0 3.50 813 760 A 51 GLU HA A 51 GLU HBy 1.0 0.0 3.17 814 761 A 74 LYS HA A 74 LYS HBx 1.0 0.0 3.98 815 762 A 100 GLU H A 100 GLU HBy 1.0 0.0 4.08 816 763 A 5 GLN HA A 5 GLN HBx 1.0 0.0 4.15 817 764 A 5 GLN HGy A 5 GLN HBx 1.0 0.0 4.25 818 765 A 21 ASN H A 20 GLN HGx 1.0 0.0 5.03 819 765 A 21 ASN H A 20 GLN HGy 1.0 0.0 5.03 820 766 A 20 GLN HE2y A 20 GLN HGx 1.0 0.0 4.11 821 766 A 20 GLN HE2y A 20 GLN HGy 1.0 0.0 4.11 822 767 A 20 GLN HE2x A 20 GLN HGx 1.0 0.0 4.91 823 767 A 20 GLN HE2x A 20 GLN HGy 1.0 0.0 4.91 824 768 A 20 GLN HA A 20 GLN HGx 1.0 0.0 4.32 825 768 A 20 GLN HGy A 20 GLN HA 1.0 0.0 4.32 826 769 A 20 GLN HBy A 20 GLN HGx 1.0 0.0 2.86 827 769 A 20 GLN HBx A 20 GLN HGx 1.0 0.0 2.86 828 769 A 20 GLN HGy A 20 GLN HBx 1.0 0.0 2.86 829 769 A 20 GLN HBy A 20 GLN HGy 1.0 0.0 2.86 830 770 A 37 GLU H A 37 GLU HBy 1.0 0.0 3.98 831 771 A 51 GLU HA A 51 GLU HBx 1.0 0.0 3.63 832 772 A 17 GLU HGy A 17 GLU HBx 1.0 0.0 3.30 833 772 A 17 GLU HGy A 17 GLU HBy 1.0 0.0 3.30 834 773 A 96 MET HA A 99 ARG H 1.0 0.0 3.64 835 774 A 20 GLN H A 18 LEU HA 1.0 0.0 6.00 836 775 A 103 LYS H A 103 LYS HA 1.0 0.0 4.00 837 776 A 17 GLU HA A 17 GLU HBx 1.0 0.0 3.14 838 776 A 17 GLU HA A 17 GLU HBy 1.0 0.0 3.14 839 777 A 92 LYS HA A 92 LYS HBx 1.0 0.0 2.91 840 778 A 103 LYS HA A 103 LYS HBx 1.0 0.0 3.21 841 778 A 103 LYS HA A 103 LYS HBy 1.0 0.0 3.21 842 779 A 27 LYS HA A 27 LYS HGy 1.0 0.0 6.00 843 780 A 18 LEU HG A 18 LEU HA 1.0 0.0 4.26 844 781 A 54 GLU H A 54 GLU HBy 1.0 0.0 3.96 845 782 A 51 GLU H A 51 GLU HBx 1.0 0.0 3.91 846 783 A 75 MET HE% A 87 ILE HG1x 1.0 0.0 3.72 847 783 A 75 MET HE% A 87 ILE HG1y 1.0 0.0 3.72 848 784 A 82 ILE HG2% A 87 ILE HG1x 1.0 0.0 3.94 849 784 A 82 ILE HG2% A 87 ILE HG1y 1.0 0.0 3.94 850 785 A 54 GLU H A 54 GLU HGy 1.0 0.0 4.32 851 786 A 34 GLU HA A 34 GLU HGy 1.0 0.0 4.23 852 787 A 6 GLU HGy A 6 GLU HA 1.0 0.0 4.21 853 788 A 54 GLU HGy A 54 GLU HBy 1.0 0.0 2.95 854 789 A 54 GLU HGy A 62 ALA HB% 1.0 0.0 4.08 855 790 A 34 GLU H A 34 GLU HGy 1.0 0.0 4.82 856 791 A 51 GLU HA A 51 GLU HGy 1.0 0.0 4.21 857 792 A 100 GLU HBx A 100 GLU HGx 1.0 0.0 4.12 858 792 A 100 GLU HGy A 100 GLU HBx 1.0 0.0 4.12 859 793 A 7 TYR H A 7 TYR HB3 1.0 0.0 4.98 860 794 A 7 TYR HB3 A 7 TYR HD% 1.0 0.0 4.57 861 795 A 109 TYR HA A 109 TYR HBy 1.0 0.0 4.12 862 796 A 7 TYR HA A 7 TYR HB3 1.0 0.0 4.72 863 797 A 109 TYR HBy A 109 TYR HBx 1.0 0.0 2.74 864 798 A 7 TYR HB3 A 8 ILE HB 1.0 0.0 5.62 865 799 A 8 ILE H A 7 TYR HB2 1.0 0.0 5.36 866 800 A 7 TYR H A 7 TYR HB2 1.0 0.0 4.86 867 801 A 7 TYR HD% A 7 TYR HB2 1.0 0.0 4.58 868 802 A 7 TYR HA A 7 TYR HB2 1.0 0.0 4.52 869 803 A 8 ILE H A 8 ILE HB 1.0 0.0 4.17 870 804 A 5 GLN HA A 8 ILE HB 1.0 0.0 4.51 871 805 A 8 ILE HA A 8 ILE HB 1.0 0.0 4.65 872 806 A 8 ILE HB A 8 ILE HG1y 1.0 0.0 4.33 873 807 A 8 ILE HB A 8 ILE HG1x 1.0 0.0 4.85 874 808 A 8 ILE HB A 8 ILE HG2% 1.0 0.0 3.93 875 809 A 26 ILE H A 26 ILE HA 1.0 0.0 4.74 876 810 A 8 ILE H A 8 ILE HA 1.0 0.0 4.76 877 811 A 26 ILE HA A 26 ILE HB 1.0 0.0 4.78 878 812 A 8 ILE HA A 8 ILE HB 1.0 0.0 4.35 879 813 A 26 ILE HA A 26 ILE HG1y 1.0 0.0 4.62 880 814 A 8 ILE HA A 8 ILE HG1y 1.0 0.0 5.08 881 815 A 8 ILE HA A 8 ILE HG1x 1.0 0.0 4.89 882 816 A 26 ILE HA A 26 ILE HG1x 1.0 0.0 4.73 883 817 A 26 ILE HA A 26 ILE HG2% 1.0 0.0 3.87 884 818 A 26 ILE HA A 29 VAL HGy% 1.0 0.0 3.85 885 819 A 8 ILE H A 8 ILE HD1% 1.0 0.0 5.30 886 820 A 7 TYR HD% A 8 ILE HD1% 1.0 0.0 4.53 887 821 A 5 GLN HA A 8 ILE HD1% 1.0 0.0 4.90 888 822 A 8 ILE HA A 8 ILE HD1% 1.0 0.0 4.15 889 823 A 8 ILE HB A 8 ILE HD1% 1.0 0.0 5.12 890 824 A 8 ILE HD1% A 56 MET HE% 1.0 0.0 4.81 891 825 A 8 ILE HG1y A 8 ILE HD1% 1.0 0.0 3.87 892 826 A 8 ILE HG1x A 8 ILE HD1% 1.0 0.0 3.92 893 827 A 19 ILE H A 19 ILE HG2% 1.0 0.0 4.37 894 828 A 8 ILE H A 8 ILE HG2% 1.0 0.0 4.89 895 829 A 20 GLN H A 19 ILE HG2% 1.0 0.0 4.69 896 830 A 23 ASN HD2y A 19 ILE HG2% 1.0 0.0 4.21 897 831 A 23 ASN HD2x A 19 ILE HG2% 1.0 0.0 4.27 898 832 A 19 ILE HG2% A 98 THR HB 1.0 0.0 5.36 899 833 A 20 GLN HA A 19 ILE HG2% 1.0 0.0 4.35 900 834 A 19 ILE HA A 19 ILE HG2% 1.0 0.0 3.79 901 835 A 19 ILE HB A 19 ILE HG2% 1.0 0.0 3.23 902 836 A 8 ILE HG1y A 8 ILE HG2% 1.0 0.0 4.49 903 837 A 8 ILE HG1x A 8 ILE HG2% 1.0 0.0 4.05 904 838 A 8 ILE H A 8 ILE HG1x 1.0 0.0 4.65 905 839 A 8 ILE HG1x A 7 TYR HD% 1.0 0.0 5.34 906 840 A 8 ILE HA A 8 ILE HG1x 1.0 0.0 5.15 907 841 A 8 ILE HB A 8 ILE HG1x 1.0 0.0 5.07 908 842 A 8 ILE HG1y A 8 ILE HG1x 1.0 0.0 3.33 909 843 A 8 ILE HG1x A 8 ILE HD1% 1.0 0.0 4.03 910 844 A 8 ILE H A 8 ILE HG1y 1.0 0.0 4.83 911 845 A 8 ILE HG1y A 7 TYR HD% 1.0 0.0 5.47 912 846 A 8 ILE HA A 8 ILE HG1y 1.0 0.0 5.10 913 847 A 8 ILE HB A 8 ILE HG1y 1.0 0.0 4.74 914 848 A 8 ILE HG1y A 8 ILE HG1x 1.0 0.0 3.39 915 849 A 8 ILE HG1y A 8 ILE HG2% 1.0 0.0 4.04 916 850 A 9 LYS HA A 9 LYS HBy 1.0 0.0 3.78 917 851 A 9 LYS HA A 9 LYS HGy 1.0 0.0 4.34 918 852 A 27 LYS H A 27 LYS HGx 1.0 0.0 4.87 919 853 A 24 ASP HA A 27 LYS HGx 1.0 0.0 5.35 920 854 A 27 LYS HA A 27 LYS HGx 1.0 0.0 4.29 921 855 A 9 LYS HGy A 9 LYS HEx 1.0 0.0 4.17 922 855 A 9 LYS HGy A 9 LYS HEy 1.0 0.0 4.17 923 856 A 73 ASP H A 73 ASP HBy 1.0 0.0 3.87 924 857 A 70 ASN HA A 73 ASP HBy 1.0 0.0 4.18 925 858 A 73 ASP HA A 73 ASP HBy 1.0 0.0 3.87 926 859 A 74 LYS HA A 74 LYS HEx 1.0 0.0 4.58 927 859 A 74 LYS HA A 74 LYS HEy 1.0 0.0 4.58 928 860 A 9 LYS HBy A 9 LYS HEx 1.0 0.0 3.71 929 860 A 9 LYS HBy A 9 LYS HEy 1.0 0.0 3.71 930 861 A 9 LYS HDx A 9 LYS HEx 1.0 0.0 2.82 931 861 A 9 LYS HDy A 9 LYS HEx 1.0 0.0 2.82 932 861 A 9 LYS HEy A 9 LYS HDx 1.0 0.0 2.82 933 861 A 9 LYS HEy A 9 LYS HDy 1.0 0.0 2.82 934 862 A 9 LYS HGy A 9 LYS HEx 1.0 0.0 3.23 935 862 A 9 LYS HGy A 9 LYS HEy 1.0 0.0 3.23 936 863 A 15 LEU HDy% A 16 LYS HEx 1.0 0.0 4.13 937 863 A 15 LEU HDy% A 16 LYS HEy 1.0 0.0 4.13 938 864 A 16 LYS HEx A 101 LEU HDx% 1.0 0.0 3.73 939 864 A 16 LYS HEy A 101 LEU HDx% 1.0 0.0 3.73 940 864 A 101 LEU HDy% A 16 LYS HEx 1.0 0.0 3.73 941 864 A 16 LYS HEy A 101 LEU HDy% 1.0 0.0 3.73 942 865 A 51 GLU HA A 50 LYS HGy 1.0 0.0 3.99 943 866 A 50 LYS HA A 50 LYS HGy 1.0 0.0 4.77 944 867 A 50 LYS HBy A 50 LYS HGy 1.0 0.0 4.45 945 868 A 11 VAL H A 11 VAL HB 1.0 0.0 4.88 946 869 A 9 LYS H A 9 LYS HBx 1.0 0.0 4.54 947 870 A 10 LYS H A 9 LYS HBx 1.0 0.0 4.31 948 871 A 103 LYS H A 103 LYS HBx 1.0 0.0 3.80 949 871 A 103 LYS H A 103 LYS HBy 1.0 0.0 3.80 950 872 A 112 PRO HA A 112 PRO HBx 1.0 0.0 3.88 951 873 A 103 LYS HA A 103 LYS HBx 1.0 0.0 3.45 952 873 A 103 LYS HA A 103 LYS HBy 1.0 0.0 3.45 953 874 A 9 LYS HBy A 9 LYS HDx 1.0 0.0 3.31 954 874 A 9 LYS HBy A 9 LYS HDy 1.0 0.0 3.31 955 875 A 27 LYS HB2 A 27 LYS HGy 1.0 0.0 3.22 956 876 A 27 LYS HB2 A 27 LYS HGx 1.0 0.0 3.38 957 877 A 9 LYS HBy A 9 LYS HGx 1.0 0.0 3.29 958 878 A 8 ILE HG2% A 9 LYS HBx 1.0 0.0 5.50 959 879 A 16 LYS H A 16 LYS HDx 1.0 0.0 4.76 960 879 A 16 LYS H A 16 LYS HDy 1.0 0.0 4.76 961 880 A 13 ASP HA A 16 LYS HDx 1.0 0.0 3.97 962 880 A 13 ASP HA A 16 LYS HDy 1.0 0.0 3.97 963 881 A 60 SER HA A 63 LYS HDx 1.0 0.0 4.46 964 881 A 60 SER HA A 63 LYS HDy 1.0 0.0 4.46 965 882 A 74 LYS HA A 74 LYS HDx 1.0 0.0 4.24 966 882 A 74 LYS HA A 74 LYS HDy 1.0 0.0 4.24 967 883 A 16 LYS HA A 16 LYS HDx 1.0 0.0 4.25 968 883 A 16 LYS HA A 16 LYS HDy 1.0 0.0 4.25 969 884 A 9 LYS HDx A 9 LYS HEx 1.0 0.0 3.05 970 884 A 9 LYS HDy A 9 LYS HEx 1.0 0.0 3.05 971 884 A 9 LYS HEy A 9 LYS HDx 1.0 0.0 3.05 972 884 A 9 LYS HEy A 9 LYS HDy 1.0 0.0 3.05 973 885 A 9 LYS HBy A 9 LYS HDx 1.0 0.0 3.12 974 885 A 9 LYS HBy A 9 LYS HDy 1.0 0.0 3.12 975 886 A 9 LYS HGy A 9 LYS HDx 1.0 0.0 2.61 976 886 A 9 LYS HGy A 9 LYS HDy 1.0 0.0 2.61 977 887 A 15 LEU HDy% A 16 LYS HDx 1.0 0.0 3.76 978 887 A 16 LYS HDy A 15 LEU HDy% 1.0 0.0 3.76 979 888 A 19 ILE HD1% A 16 LYS HDx 1.0 0.0 3.63 980 888 A 16 LYS HDy A 19 ILE HD1% 1.0 0.0 3.63 981 889 A 92 LYS H A 92 LYS HBx 1.0 0.0 4.04 982 890 A 9 LYS H A 9 LYS HBy 1.0 0.0 4.15 983 891 A 10 LYS H A 10 LYS HBx 1.0 0.0 3.35 984 891 A 10 LYS H A 10 LYS HBy 1.0 0.0 3.35 985 892 A 63 LYS HA A 63 LYS HBx 1.0 0.0 3.28 986 892 A 63 LYS HA A 63 LYS HBy 1.0 0.0 3.28 987 893 A 11 VAL HA A 11 VAL HB 1.0 0.0 3.77 988 894 A 91 LYS HB2 A 91 LYS HEx 1.0 0.0 4.68 989 894 A 91 LYS HB2 A 91 LYS HEy 1.0 0.0 4.68 990 895 A 15 LEU HDy% A 16 LYS HBx 1.0 0.0 4.86 991 896 A 11 VAL HB A 11 VAL HGx% 1.0 0.0 3.53 992 896 A 11 VAL HGy% A 11 VAL HB 1.0 0.0 3.53 993 897 A 54 GLU HA A 62 ALA HB% 1.0 0.0 3.91 994 898 A 9 LYS H A 9 LYS HGx 1.0 0.0 5.38 995 899 A 10 LYS H A 10 LYS HGx 1.0 0.0 5.28 996 899 A 10 LYS H A 10 LYS HGy 1.0 0.0 5.28 997 900 A 10 LYS HEy A 10 LYS HGx 1.0 0.0 4.16 998 900 A 10 LYS HGy A 10 LYS HEy 1.0 0.0 4.16 999 901 A 74 LYS H A 73 ASP HBy 1.0 0.0 4.58 1000 902 A 89 LYS HA A 89 LYS HEx 1.0 0.0 4.67 1001 902 A 89 LYS HA A 89 LYS HEy 1.0 0.0 4.67 1002 903 A 103 LYS HBx A 103 LYS HEx 1.0 0.0 3.94 1003 903 A 103 LYS HBy A 103 LYS HEx 1.0 0.0 3.94 1004 903 A 103 LYS HEy A 103 LYS HBx 1.0 0.0 3.94 1005 903 A 103 LYS HBy A 103 LYS HEy 1.0 0.0 3.94 1006 904 A 10 LYS HDx A 10 LYS HEx 1.0 0.0 3.37 1007 905 A 10 LYS HEx A 10 LYS HGx 1.0 0.0 3.62 1008 905 A 10 LYS HGy A 10 LYS HEx 1.0 0.0 3.62 1009 906 A 42 ILE H A 41 LYS HBx 1.0 0.0 3.85 1010 907 A 41 LYS H A 41 LYS HBx 1.0 0.0 4.11 1011 908 A 27 LYS H A 27 LYS HB2 1.0 0.0 3.87 1012 909 A 112 PRO HBx A 112 PRO HBy 1.0 0.0 2.98 1013 910 A 93 LYS H A 92 LYS HDx 1.0 0.0 5.15 1014 910 A 93 LYS H A 92 LYS HDy 1.0 0.0 5.15 1015 911 A 7 TYR HA A 10 LYS HDx 1.0 0.0 5.07 1016 912 A 64 VAL HA A 93 LYS HDx 1.0 0.0 5.20 1017 912 A 64 VAL HA A 93 LYS HDy 1.0 0.0 5.20 1018 913 A 10 LYS HEy A 10 LYS HDx 1.0 0.0 3.50 1019 914 A 26 ILE HG1y A 26 ILE HG1x 1.0 0.0 3.20 1020 915 A 26 ILE HG1y A 26 ILE HG2% 1.0 0.0 3.84 1021 916 A 11 VAL H A 11 VAL HA 1.0 0.0 4.46 1022 917 A 11 VAL HA A 14 GLU H 1.0 0.0 4.82 1023 918 A 11 VAL HA A 14 GLU HBy 1.0 0.0 4.14 1024 919 A 11 VAL HA A 14 GLU HBx 1.0 0.0 4.14 1025 920 A 11 VAL HA A 11 VAL HB 1.0 0.0 4.16 1026 921 A 11 VAL HA A 11 VAL HGx% 1.0 0.0 3.70 1027 921 A 11 VAL HA A 11 VAL HGy% 1.0 0.0 3.70 1028 922 A 60 SER HA A 63 LYS HBx 1.0 0.0 4.18 1029 922 A 63 LYS HBy A 60 SER HA 1.0 0.0 4.18 1030 923 A 12 THR HB A 13 ASP H 1.0 0.0 4.42 1031 924 A 12 THR HB A 12 THR HG2% 1.0 0.0 3.77 1032 925 A 13 ASP H A 12 THR HA 1.0 0.0 4.86 1033 926 A 48 THR H A 48 THR HA 1.0 0.0 4.29 1034 927 A 12 THR HA A 15 LEU HB3 1.0 0.0 4.14 1035 928 A 12 THR HG2% A 12 THR HA 1.0 0.0 3.62 1036 929 A 12 THR HA A 15 LEU HDx% 1.0 0.0 4.47 1037 930 A 12 THR H A 12 THR HG2% 1.0 0.0 4.11 1038 931 A 55 THR HB A 55 THR HG2% 1.0 0.0 3.12 1039 932 A 12 THR HB A 12 THR HG2% 1.0 0.0 3.48 1040 933 A 12 THR HG2% A 12 THR HA 1.0 0.0 3.24 1041 934 A 48 THR HG2% A 49 MET HGy 1.0 0.0 4.69 1042 935 A 18 LEU HB2 A 48 THR HG2% 1.0 0.0 5.50 1043 936 A 12 THR HG2% A 15 LEU HB3 1.0 0.0 5.23 1044 937 A 48 THR HG2% A 52 ILE HG1y 1.0 0.0 4.19 1045 938 A 18 LEU HDy% A 48 THR HG2% 1.0 0.0 3.03 1046 939 A 77 ASN HBx A 79 GLU H 1.0 0.0 5.41 1047 940 A 13 ASP H A 13 ASP HBx 1.0 0.0 4.50 1048 941 A 14 GLU H A 13 ASP HBx 1.0 0.0 4.71 1049 942 A 77 ASN H A 77 ASN HBx 1.0 0.0 4.14 1050 943 A 38 TYR H A 38 TYR HBy 1.0 0.0 4.47 1051 944 A 77 ASN HBx A 77 ASN HD2x 1.0 0.0 4.86 1052 945 A 77 ASN HA A 77 ASN HBx 1.0 0.0 4.38 1053 946 A 85 ASP HA A 85 ASP HBx 1.0 0.0 3.32 1054 946 A 85 ASP HBy A 85 ASP HA 1.0 0.0 3.32 1055 947 A 35 ASP HBy A 35 ASP HBx 1.0 0.0 3.36 1056 948 A 77 ASN HBy A 77 ASN HBx 1.0 0.0 2.80 1057 949 A 23 ASN H A 23 ASN HB2 1.0 0.0 4.34 1058 950 A 25 ASP H A 24 ASP HBy 1.0 0.0 4.89 1059 951 A 14 GLU H A 13 ASP HBy 1.0 0.0 4.63 1060 952 A 40 ASN HBy A 41 LYS H 1.0 0.0 4.01 1061 953 A 77 ASN HBy A 77 ASN HD2y 1.0 0.0 4.62 1062 954 A 32 ASN H A 32 ASN HBy 1.0 0.0 4.36 1063 955 A 77 ASN HA A 77 ASN HBy 1.0 0.0 4.07 1064 956 A 13 ASP HA A 13 ASP HBy 1.0 0.0 3.92 1065 957 A 37 GLU HA A 40 ASN HBy 1.0 0.0 4.07 1066 958 A 77 ASN HBy A 77 ASN HBx 1.0 0.0 2.88 1067 959 A 77 ASN HBy A 79 GLU HGy 1.0 0.0 4.30 1068 960 A 77 ASN HBy A 79 GLU HBx 1.0 0.0 4.93 1069 961 A 92 LYS H A 92 LYS HA 1.0 0.0 3.82 1070 962 A 17 GLU HA A 17 GLU HGy 1.0 0.0 3.53 1071 963 A 18 LEU H A 17 GLU HBx 1.0 0.0 3.77 1072 963 A 18 LEU H A 17 GLU HBy 1.0 0.0 3.77 1073 964 A 17 GLU H A 17 GLU HBx 1.0 0.0 3.68 1074 964 A 17 GLU H A 17 GLU HBy 1.0 0.0 3.68 1075 965 A 17 GLU HA A 17 GLU HBx 1.0 0.0 3.35 1076 965 A 17 GLU HA A 17 GLU HBy 1.0 0.0 3.35 1077 966 A 14 GLU HBx A 11 VAL HGx% 1.0 0.0 4.91 1078 966 A 11 VAL HGy% A 14 GLU HBx 1.0 0.0 4.91 1079 967 A 14 GLU H A 14 GLU HGy 1.0 0.0 4.61 1080 968 A 17 GLU H A 17 GLU HGy 1.0 0.0 4.97 1081 969 A 14 GLU HA A 14 GLU HGy 1.0 0.0 4.13 1082 970 A 11 VAL HA A 14 GLU HGy 1.0 0.0 5.14 1083 971 A 14 GLU HGy A 14 GLU HBx 1.0 0.0 2.91 1084 972 A 14 GLU HGy A 10 LYS HBx 1.0 0.0 4.74 1085 972 A 10 LYS HBy A 14 GLU HGy 1.0 0.0 4.74 1086 973 A 14 GLU H A 14 GLU HBy 1.0 0.0 4.09 1087 974 A 11 VAL HA A 14 GLU HBy 1.0 0.0 4.46 1088 975 A 14 GLU HGy A 14 GLU HBy 1.0 0.0 4.27 1089 976 A 14 GLU HBy A 11 VAL HGx% 1.0 0.0 5.60 1090 976 A 11 VAL HGy% A 14 GLU HBy 1.0 0.0 5.60 1091 977 A 54 GLU H A 54 GLU HGx 1.0 0.0 4.23 1092 978 A 11 VAL H A 14 GLU HGx 1.0 0.0 4.83 1093 979 A 14 GLU H A 14 GLU HGx 1.0 0.0 4.88 1094 980 A 14 GLU HA A 14 GLU HGx 1.0 0.0 4.19 1095 981 A 11 VAL HA A 14 GLU HGx 1.0 0.0 5.05 1096 982 A 14 GLU HGy A 14 GLU HGx 1.0 0.0 3.01 1097 983 A 37 GLU HBx A 37 GLU HGy 1.0 0.0 3.42 1098 984 A 14 GLU HGx A 11 VAL HGx% 1.0 0.0 5.15 1099 984 A 11 VAL HGy% A 14 GLU HGx 1.0 0.0 5.15 1100 985 A 15 LEU H A 15 LEU HA 1.0 0.0 4.34 1101 986 A 28 GLU HA A 28 GLU HBx 1.0 0.0 3.61 1102 986 A 28 GLU HA A 28 GLU HBy 1.0 0.0 3.61 1103 987 A 15 LEU H A 15 LEU HB2 1.0 0.0 4.63 1104 988 A 15 LEU HA A 15 LEU HB2 1.0 0.0 4.34 1105 989 A 15 LEU HB2 A 12 THR HA 1.0 0.0 4.94 1106 990 A 15 LEU HB2 A 15 LEU HB3 1.0 0.0 3.46 1107 991 A 15 LEU HB2 A 15 LEU HDx% 1.0 0.0 3.69 1108 992 A 47 HIS H A 46 VAL HGx% 1.0 0.0 4.10 1109 993 A 69 MET H A 46 VAL HGx% 1.0 0.0 4.78 1110 994 A 45 LEU H A 45 LEU HDy% 1.0 0.0 4.40 1111 995 A 67 THR H A 65 LEU HDy% 1.0 0.0 5.03 1112 996 A 13 ASP HA A 15 LEU HDy% 1.0 0.0 4.82 1113 997 A 45 LEU HDy% A 45 LEU HA 1.0 0.0 3.38 1114 998 A 16 LYS HA A 15 LEU HDy% 1.0 0.0 3.70 1115 999 A 22 VAL HA A 22 VAL HGx% 1.0 0.0 3.36 1116 1000 A 19 ILE HA A 22 VAL HGx% 1.0 0.0 3.98 1117 1001 A 21 ASN HBy A 45 LEU HDy% 1.0 0.0 5.06 1118 1002 A 21 ASN HBx A 45 LEU HDy% 1.0 0.0 4.94 1119 1003 A 69 MET HG3 A 46 VAL HGx% 1.0 0.0 3.88 1120 1004 A 22 VAL HB A 22 VAL HGx% 1.0 0.0 3.17 1121 1005 A 46 VAL HB A 46 VAL HGx% 1.0 0.0 3.30 1122 1006 A 45 LEU HG A 45 LEU HDy% 1.0 0.0 3.29 1123 1007 A 104 LYS HGy A 104 LYS HGx 1.0 0.0 3.11 1124 1008 A 15 LEU H A 15 LEU HB3 1.0 0.0 4.59 1125 1009 A 45 LEU H A 45 LEU HBy 1.0 0.0 4.63 1126 1010 A 45 LEU HBy A 45 LEU HA 1.0 0.0 5.09 1127 1011 A 15 LEU HA A 15 LEU HB3 1.0 0.0 4.86 1128 1012 A 12 THR HA A 15 LEU HB3 1.0 0.0 4.69 1129 1013 A 45 LEU HG A 45 LEU HBy 1.0 0.0 4.29 1130 1014 A 18 LEU HB3 A 19 ILE HG13 1.0 0.0 4.39 1131 1015 A 15 LEU HB2 A 15 LEU HB3 1.0 0.0 3.57 1132 1016 A 22 VAL HGy% A 45 LEU HBy 1.0 0.0 4.63 1133 1017 A 15 LEU HB3 A 15 LEU HDx% 1.0 0.0 3.90 1134 1018 A 16 LYS HA A 16 LYS H 1.0 0.0 4.39 1135 1019 A 16 LYS HA A 16 LYS HBx 1.0 0.0 3.71 1136 1020 A 16 LYS HA A 16 LYS HGy 1.0 0.0 4.19 1137 1021 A 16 LYS HA A 16 LYS HGx 1.0 0.0 4.31 1138 1022 A 16 LYS HA A 19 ILE HD1% 1.0 0.0 4.23 1139 1023 A 91 LYS H A 91 LYS HGx 1.0 0.0 4.62 1140 1023 A 91 LYS H A 91 LYS HGy 1.0 0.0 4.62 1141 1024 A 16 LYS H A 16 LYS HGy 1.0 0.0 4.71 1142 1025 A 71 LEU H A 71 LEU HG 1.0 0.0 4.68 1143 1026 A 13 ASP HA A 16 LYS HGy 1.0 0.0 5.47 1144 1027 A 71 LEU HA A 71 LEU HG 1.0 0.0 5.07 1145 1028 A 16 LYS HA A 16 LYS HGy 1.0 0.0 4.41 1146 1029 A 16 LYS HBx A 16 LYS HGy 1.0 0.0 3.65 1147 1030 A 71 LEU HB3 A 71 LEU HG 1.0 0.0 3.95 1148 1031 A 90 VAL HGy% A 71 LEU HG 1.0 0.0 5.01 1149 1032 A 15 LEU HDy% A 16 LYS HGy 1.0 0.0 5.09 1150 1033 A 71 LEU HG A 71 LEU HDy% 1.0 0.0 4.39 1151 1034 A 43 TYR HE% A 73 ASP HBy 1.0 0.0 4.36 1152 1035 A 16 LYS H A 16 LYS HGx 1.0 0.0 4.98 1153 1036 A 16 LYS HA A 16 LYS HGx 1.0 0.0 4.23 1154 1037 A 16 LYS HGy A 16 LYS HGx 1.0 0.0 3.01 1155 1038 A 19 ILE HD1% A 16 LYS HGx 1.0 0.0 5.08 1156 1039 A 33 PRO HA A 33 PRO HB2 1.0 0.0 4.33 1157 1040 A 69 MET HG2 A 69 MET HA 1.0 0.0 4.58 1158 1041 A 92 LYS HBy A 95 ASP HB2 1.0 0.0 4.88 1159 1042 A 33 PRO HB2 A 33 PRO HB3 1.0 0.0 3.23 1160 1043 A 68 ILE HB A 69 MET HG2 1.0 0.0 3.91 1161 1044 A 82 ILE HG2% A 33 PRO HB2 1.0 0.0 3.51 1162 1045 A 68 ILE HD1% A 93 LYS HBy 1.0 0.0 4.47 1163 1046 A 44 ARG HA A 47 HIS H 1.0 0.0 4.40 1164 1047 A 45 LEU H A 44 ARG HA 1.0 0.0 3.96 1165 1048 A 17 GLU HA A 17 GLU H 1.0 0.0 3.63 1166 1049 A 99 ARG HA A 102 ASP HBy 1.0 0.0 3.82 1167 1050 A 96 MET HA A 96 MET HGx 1.0 0.0 4.04 1168 1051 A 92 LYS HG3 A 92 LYS HA 1.0 0.0 3.62 1169 1052 A 54 GLU HBy A 62 ALA HB% 1.0 0.0 4.41 1170 1053 A 18 LEU HDx% A 17 GLU HBx 1.0 0.0 4.82 1171 1053 A 17 GLU HBy A 18 LEU HDx% 1.0 0.0 4.82 1172 1054 A 18 LEU HDy% A 17 GLU HBx 1.0 0.0 5.02 1173 1054 A 17 GLU HBy A 18 LEU HDy% 1.0 0.0 5.02 1174 1055 A 51 GLU H A 51 GLU HGy 1.0 0.0 4.33 1175 1056 A 51 GLU HBx A 51 GLU HGy 1.0 0.0 2.80 1176 1057 A 71 LEU HA A 71 LEU HB2 1.0 0.0 3.86 1177 1058 A 17 GLU HA A 18 LEU HDx% 1.0 0.0 5.36 1178 1059 A 18 LEU HDx% A 18 LEU HB3 1.0 0.0 4.18 1179 1060 A 18 LEU HDx% A 49 MET HE% 1.0 0.0 4.25 1180 1061 A 18 LEU HDx% A 45 LEU HBx 1.0 0.0 4.65 1181 1062 A 65 LEU HG A 62 ALA HA 1.0 0.0 4.57 1182 1063 A 65 LEU HG A 50 LYS HA 1.0 0.0 4.05 1183 1064 A 49 MET HBy A 65 LEU HG 1.0 0.0 4.53 1184 1065 A 80 ILE HG1y A 80 ILE HG1x 1.0 0.0 3.20 1185 1066 A 18 LEU HG A 45 LEU HA 1.0 0.0 5.55 1186 1067 A 18 LEU HG A 49 MET HGy 1.0 0.0 4.79 1187 1068 A 18 LEU HG A 18 LEU HDx% 1.0 0.0 5.16 1188 1069 A 18 LEU HG A 18 LEU HDy% 1.0 0.0 5.20 1189 1070 A 19 ILE H A 19 ILE HB 1.0 0.0 4.31 1190 1071 A 20 GLN H A 19 ILE HB 1.0 0.0 4.54 1191 1072 A 16 LYS HA A 19 ILE HB 1.0 0.0 4.30 1192 1073 A 19 ILE HA A 19 ILE HB 1.0 0.0 5.02 1193 1074 A 19 ILE HB A 19 ILE HG2% 1.0 0.0 3.77 1194 1075 A 19 ILE H A 19 ILE HA 1.0 0.0 4.47 1195 1076 A 19 ILE HA A 22 VAL HB 1.0 0.0 4.38 1196 1077 A 19 ILE HA A 19 ILE HB 1.0 0.0 3.98 1197 1078 A 19 ILE HA A 22 VAL HGy% 1.0 0.0 4.92 1198 1079 A 19 ILE HA A 19 ILE HG2% 1.0 0.0 3.89 1199 1080 A 19 ILE H A 19 ILE HD1% 1.0 0.0 4.59 1200 1081 A 81 LYS H A 80 ILE HD1% 1.0 0.0 5.35 1201 1082 A 80 ILE H A 80 ILE HD1% 1.0 0.0 5.16 1202 1083 A 80 ILE HA A 80 ILE HD1% 1.0 0.0 4.62 1203 1084 A 16 LYS HA A 19 ILE HD1% 1.0 0.0 4.08 1204 1085 A 98 THR HA A 19 ILE HD1% 1.0 0.0 4.72 1205 1086 A 19 ILE HA A 19 ILE HD1% 1.0 0.0 4.33 1206 1087 A 82 ILE HD1% A 36 MET HE% 1.0 0.0 3.88 1207 1088 A 68 ILE HD1% A 93 LYS HBy 1.0 0.0 3.43 1208 1089 A 19 ILE HB A 19 ILE HD1% 1.0 0.0 3.20 1209 1090 A 82 ILE HD1% A 82 ILE HG1y 1.0 0.0 3.30 1210 1091 A 80 ILE HG1y A 80 ILE HD1% 1.0 0.0 3.54 1211 1092 A 64 VAL HGx% A 68 ILE HD1% 1.0 0.0 3.05 1212 1093 A 8 ILE HG2% A 9 LYS HA 1.0 0.0 4.34 1213 1094 A 19 ILE H A 19 ILE HG13 1.0 0.0 4.25 1214 1095 A 30 GLU H A 30 GLU HBx 1.0 0.0 4.44 1215 1096 A 79 GLU HA A 79 GLU HBx 1.0 0.0 4.33 1216 1097 A 99 ARG HA A 99 ARG HBx 1.0 0.0 4.27 1217 1098 A 19 ILE HA A 19 ILE HG13 1.0 0.0 4.80 1218 1099 A 99 ARG HBx A 99 ARG HGx 1.0 0.0 4.21 1219 1100 A 19 ILE HG12 A 19 ILE HG13 1.0 0.0 3.48 1220 1101 A 23 ASN HD2y A 20 GLN HA 1.0 0.0 4.66 1221 1102 A 23 ASN HB3 A 20 GLN HA 1.0 0.0 4.55 1222 1103 A 19 ILE H A 20 GLN HBx 1.0 0.0 5.62 1223 1103 A 20 GLN HBy A 19 ILE H 1.0 0.0 5.62 1224 1104 A 21 ASN H A 20 GLN HBx 1.0 0.0 4.29 1225 1104 A 21 ASN H A 20 GLN HBy 1.0 0.0 4.29 1226 1105 A 20 GLN H A 20 GLN HBx 1.0 0.0 3.79 1227 1105 A 20 GLN H A 20 GLN HBy 1.0 0.0 3.79 1228 1106 A 20 GLN HA A 20 GLN HBx 1.0 0.0 3.81 1229 1106 A 20 GLN HBy A 20 GLN HA 1.0 0.0 3.81 1230 1107 A 20 GLN HBy A 20 GLN HGx 1.0 0.0 3.09 1231 1107 A 20 GLN HBx A 20 GLN HGx 1.0 0.0 3.09 1232 1107 A 20 GLN HGy A 20 GLN HBx 1.0 0.0 3.09 1233 1107 A 20 GLN HBy A 20 GLN HGy 1.0 0.0 3.09 1234 1108 A 21 ASN HA A 20 GLN HGx 1.0 0.0 5.63 1235 1108 A 21 ASN HA A 20 GLN HGy 1.0 0.0 5.63 1236 1109 A 21 ASN H A 21 ASN HA 1.0 0.0 3.64 1237 1110 A 21 ASN HA A 21 ASN HBx 1.0 0.0 3.50 1238 1111 A 70 ASN HA A 70 ASN HBx 1.0 0.0 3.38 1239 1111 A 70 ASN HBy A 70 ASN HA 1.0 0.0 3.38 1240 1112 A 22 VAL H A 21 ASN HBx 1.0 0.0 4.68 1241 1113 A 21 ASN H A 21 ASN HBx 1.0 0.0 4.48 1242 1114 A 32 ASN HD2y A 32 ASN HBy 1.0 0.0 4.31 1243 1115 A 109 TYR HBx A 109 TYR HD% 1.0 0.0 4.25 1244 1116 A 21 ASN HBx A 21 ASN HD2x 1.0 0.0 4.86 1245 1117 A 21 ASN HA A 21 ASN HBx 1.0 0.0 3.81 1246 1118 A 32 ASN HBy A 32 ASN HBx 1.0 0.0 2.77 1247 1119 A 21 ASN HBx A 45 LEU HDx% 1.0 0.0 4.30 1248 1120 A 22 VAL H A 21 ASN HBy 1.0 0.0 4.78 1249 1121 A 21 ASN H A 21 ASN HBy 1.0 0.0 4.35 1250 1122 A 109 TYR HBy A 109 TYR HD% 1.0 0.0 4.21 1251 1123 A 21 ASN HBy A 45 LEU HDx% 1.0 0.0 4.50 1252 1124 A 46 VAL H A 46 VAL HA 1.0 0.0 4.25 1253 1125 A 22 VAL H A 22 VAL HA 1.0 0.0 4.35 1254 1126 A 22 VAL HA A 25 ASP HB3 1.0 0.0 4.54 1255 1127 A 46 VAL HA A 49 MET HBy 1.0 0.0 4.33 1256 1128 A 61 VAL HA A 61 VAL HB 1.0 0.0 3.79 1257 1129 A 61 VAL HA A 61 VAL HGx% 1.0 0.0 3.61 1258 1130 A 46 VAL HA A 46 VAL HGx% 1.0 0.0 3.65 1259 1131 A 23 ASN H A 22 VAL HGx% 1.0 0.0 4.33 1260 1132 A 62 ALA H A 61 VAL HGy% 1.0 0.0 4.53 1261 1133 A 61 VAL H A 61 VAL HGy% 1.0 0.0 3.81 1262 1134 A 61 VAL HGy% A 58 PHE HD% 1.0 0.0 4.88 1263 1135 A 23 ASN HA A 22 VAL HGx% 1.0 0.0 4.39 1264 1136 A 58 PHE HBy A 61 VAL HGy% 1.0 0.0 4.09 1265 1137 A 58 PHE HBx A 61 VAL HGy% 1.0 0.0 4.63 1266 1138 A 46 VAL HGx% A 49 MET HGy 1.0 0.0 5.32 1267 1139 A 22 VAL HGx% A 26 ILE HG1y 1.0 0.0 6.00 1268 1140 A 22 VAL HGx% A 42 ILE HD1% 1.0 0.0 4.08 1269 1141 A 22 VAL HGy% A 46 VAL H 1.0 0.0 4.73 1270 1142 A 22 VAL H A 22 VAL HGy% 1.0 0.0 3.85 1271 1143 A 21 ASN H A 22 VAL HGy% 1.0 0.0 5.05 1272 1144 A 22 VAL HA A 22 VAL HGy% 1.0 0.0 3.53 1273 1145 A 19 ILE HA A 22 VAL HGy% 1.0 0.0 4.47 1274 1146 A 21 ASN HBx A 22 VAL HGy% 1.0 0.0 5.01 1275 1147 A 22 VAL HB A 22 VAL HGy% 1.0 0.0 3.65 1276 1148 A 22 VAL HGy% A 45 LEU HBy 1.0 0.0 3.98 1277 1149 A 22 VAL HGy% A 49 MET HE% 1.0 0.0 3.87 1278 1150 A 22 VAL HGy% A 45 LEU HBx 1.0 0.0 3.99 1279 1151 A 22 VAL HGy% A 22 VAL HGx% 1.0 0.0 2.94 1280 1152 A 22 VAL H A 22 VAL HB 1.0 0.0 3.89 1281 1153 A 36 MET HBy A 36 MET HA 1.0 0.0 5.01 1282 1154 A 61 VAL HA A 61 VAL HB 1.0 0.0 4.07 1283 1155 A 19 ILE HA A 22 VAL HB 1.0 0.0 4.27 1284 1156 A 36 MET HG2 A 36 MET HBy 1.0 0.0 4.66 1285 1157 A 22 VAL HB A 49 MET HE% 1.0 0.0 4.76 1286 1158 A 61 VAL HB A 61 VAL HGx% 1.0 0.0 3.49 1287 1159 A 105 VAL HB A 105 VAL HGx% 1.0 0.0 3.41 1288 1159 A 105 VAL HB A 105 VAL HGy% 1.0 0.0 3.41 1289 1160 A 23 ASN H A 23 ASN HA 1.0 0.0 4.23 1290 1161 A 23 ASN HA A 23 ASN HB3 1.0 0.0 3.99 1291 1162 A 23 ASN HA A 26 ILE HB 1.0 0.0 4.11 1292 1163 A 23 ASN H A 23 ASN HB3 1.0 0.0 4.49 1293 1164 A 23 ASN HB3 A 24 ASP H 1.0 0.0 4.88 1294 1165 A 23 ASN HD2y A 23 ASN HB3 1.0 0.0 4.69 1295 1166 A 23 ASN HD2x A 23 ASN HB3 1.0 0.0 5.23 1296 1167 A 23 ASN HA A 23 ASN HB3 1.0 0.0 4.25 1297 1168 A 23 ASN HB3 A 20 GLN HA 1.0 0.0 4.84 1298 1169 A 23 ASN HB2 A 23 ASN HB3 1.0 0.0 3.22 1299 1170 A 23 ASN HD2x A 23 ASN HB2 1.0 0.0 5.08 1300 1171 A 23 ASN HA A 23 ASN HB2 1.0 0.0 4.49 1301 1172 A 23 ASN HB2 A 20 GLN HA 1.0 0.0 4.46 1302 1173 A 23 ASN HB2 A 23 ASN HB3 1.0 0.0 3.29 1303 1174 A 13 ASP H A 13 ASP HA 1.0 0.0 3.58 1304 1175 A 24 ASP HA A 24 ASP HBy 1.0 0.0 3.75 1305 1176 A 85 ASP HA A 85 ASP HBx 1.0 0.0 3.27 1306 1176 A 85 ASP HBy A 85 ASP HA 1.0 0.0 3.27 1307 1177 A 24 ASP HA A 27 LYS HB2 1.0 0.0 4.03 1308 1178 A 13 ASP HA A 16 LYS HDx 1.0 0.0 3.90 1309 1178 A 13 ASP HA A 16 LYS HDy 1.0 0.0 3.90 1310 1179 A 24 ASP H A 24 ASP HBx 1.0 0.0 4.81 1311 1180 A 25 ASP H A 24 ASP HBx 1.0 0.0 4.97 1312 1181 A 35 ASP H A 35 ASP HBx 1.0 0.0 4.34 1313 1182 A 35 ASP HA A 35 ASP HBx 1.0 0.0 4.39 1314 1183 A 24 ASP HA A 24 ASP HBx 1.0 0.0 4.03 1315 1184 A 25 ASP HB3 A 25 ASP HA 1.0 0.0 3.67 1316 1185 A 88 ASP HA A 91 LYS HB2 1.0 0.0 3.78 1317 1186 A 26 ILE H A 25 ASP HB2 1.0 0.0 5.25 1318 1187 A 25 ASP H A 25 ASP HB2 1.0 0.0 4.81 1319 1188 A 25 ASP HB2 A 25 ASP HA 1.0 0.0 4.60 1320 1189 A 22 VAL HA A 25 ASP HB2 1.0 0.0 4.97 1321 1190 A 25 ASP HB3 A 25 ASP HB2 1.0 0.0 3.65 1322 1191 A 25 ASP HB2 A 42 ILE HG1y 1.0 0.0 4.90 1323 1192 A 22 VAL HGx% A 25 ASP HB2 1.0 0.0 5.00 1324 1193 A 25 ASP HB2 A 42 ILE HD1% 1.0 0.0 5.07 1325 1194 A 26 ILE H A 25 ASP HB3 1.0 0.0 5.41 1326 1195 A 25 ASP H A 25 ASP HB3 1.0 0.0 4.82 1327 1196 A 25 ASP HB3 A 25 ASP HA 1.0 0.0 4.75 1328 1197 A 22 VAL HA A 25 ASP HB3 1.0 0.0 4.75 1329 1198 A 25 ASP HB3 A 25 ASP HB2 1.0 0.0 3.68 1330 1199 A 25 ASP HB3 A 42 ILE HG1y 1.0 0.0 5.02 1331 1200 A 22 VAL HGx% A 25 ASP HB3 1.0 0.0 4.84 1332 1201 A 25 ASP HB3 A 29 VAL HGy% 1.0 0.0 5.12 1333 1202 A 26 ILE H A 26 ILE HB 1.0 0.0 4.07 1334 1203 A 27 LYS H A 26 ILE HB 1.0 0.0 4.77 1335 1204 A 23 ASN HA A 26 ILE HB 1.0 0.0 4.15 1336 1205 A 26 ILE HA A 26 ILE HB 1.0 0.0 4.82 1337 1206 A 26 ILE HB A 26 ILE HG1y 1.0 0.0 4.22 1338 1207 A 26 ILE HB A 26 ILE HG1x 1.0 0.0 4.75 1339 1208 A 26 ILE HB A 26 ILE HG2% 1.0 0.0 3.83 1340 1209 A 26 ILE H A 26 ILE HD1% 1.0 0.0 4.94 1341 1210 A 91 LYS H A 26 ILE HD1% 1.0 0.0 5.23 1342 1211 A 26 ILE HD1% A 39 TRP HH2 1.0 0.0 4.53 1343 1212 A 23 ASN HA A 26 ILE HD1% 1.0 0.0 4.47 1344 1213 A 91 LYS HA A 26 ILE HD1% 1.0 0.0 4.93 1345 1214 A 26 ILE HA A 26 ILE HD1% 1.0 0.0 4.08 1346 1215 A 90 VAL HB A 26 ILE HD1% 1.0 0.0 5.10 1347 1216 A 26 ILE HB A 26 ILE HD1% 1.0 0.0 4.16 1348 1217 A 26 ILE HG1y A 26 ILE HD1% 1.0 0.0 3.96 1349 1218 A 22 VAL HGx% A 26 ILE HD1% 1.0 0.0 3.24 1350 1219 A 42 ILE HD1% A 26 ILE HD1% 1.0 0.0 3.71 1351 1220 A 26 ILE H A 26 ILE HG2% 1.0 0.0 4.83 1352 1221 A 27 LYS H A 26 ILE HG2% 1.0 0.0 4.80 1353 1222 A 23 ASN HA A 26 ILE HG2% 1.0 0.0 4.75 1354 1223 A 26 ILE HG2% A 27 LYS HA 1.0 0.0 4.77 1355 1224 A 52 ILE HG2% A 52 ILE HA 1.0 0.0 3.86 1356 1225 A 26 ILE HA A 26 ILE HG2% 1.0 0.0 4.06 1357 1226 A 26 ILE HG2% A 30 GLU HGy 1.0 0.0 4.29 1358 1227 A 26 ILE HB A 26 ILE HG2% 1.0 0.0 3.47 1359 1228 A 26 ILE HG2% A 91 LYS HGx 1.0 0.0 4.62 1360 1228 A 26 ILE HG2% A 91 LYS HGy 1.0 0.0 4.62 1361 1229 A 26 ILE HG2% A 27 LYS HGx 1.0 0.0 4.34 1362 1230 A 26 ILE HG2% A 29 VAL HGy% 1.0 0.0 4.10 1363 1231 A 26 ILE H A 26 ILE HG1x 1.0 0.0 4.75 1364 1232 A 23 ASN HA A 26 ILE HG1x 1.0 0.0 5.58 1365 1233 A 26 ILE HA A 26 ILE HG1x 1.0 0.0 4.39 1366 1234 A 26 ILE HB A 26 ILE HG1x 1.0 0.0 4.42 1367 1235 A 26 ILE HG1y A 26 ILE HG1x 1.0 0.0 3.23 1368 1236 A 26 ILE HG1x A 26 ILE HD1% 1.0 0.0 4.00 1369 1237 A 26 ILE HG1x A 29 VAL HGy% 1.0 0.0 4.42 1370 1238 A 26 ILE H A 26 ILE HG1y 1.0 0.0 4.52 1371 1239 A 23 ASN HA A 26 ILE HG1y 1.0 0.0 5.16 1372 1240 A 89 LYS HA A 89 LYS HDx 1.0 0.0 4.72 1373 1240 A 89 LYS HA A 89 LYS HDy 1.0 0.0 4.72 1374 1241 A 26 ILE HA A 26 ILE HG1y 1.0 0.0 4.65 1375 1242 A 89 LYS HDx A 89 LYS HEx 1.0 0.0 3.63 1376 1242 A 89 LYS HDy A 89 LYS HEx 1.0 0.0 3.63 1377 1242 A 89 LYS HEy A 89 LYS HDx 1.0 0.0 3.63 1378 1242 A 89 LYS HEy A 89 LYS HDy 1.0 0.0 3.63 1379 1243 A 26 ILE HB A 26 ILE HG1y 1.0 0.0 3.81 1380 1244 A 27 LYS HB3 A 27 LYS HDx 1.0 0.0 4.59 1381 1244 A 27 LYS HB3 A 27 LYS HDy 1.0 0.0 4.59 1382 1245 A 26 ILE HG1y A 42 ILE HD1% 1.0 0.0 4.48 1383 1246 A 20 GLN H A 17 GLU HA 1.0 0.0 3.76 1384 1247 A 27 LYS H A 27 LYS HA 1.0 0.0 4.44 1385 1248 A 92 LYS HA A 92 LYS HG2 1.0 0.0 3.81 1386 1249 A 92 LYS H A 92 LYS HG3 1.0 0.0 4.53 1387 1250 A 92 LYS HG3 A 93 LYS H 1.0 0.0 4.35 1388 1251 A 27 LYS H A 27 LYS HGy 1.0 0.0 4.57 1389 1252 A 24 ASP HA A 27 LYS HGy 1.0 0.0 5.14 1390 1253 A 27 LYS HA A 27 LYS HGy 1.0 0.0 4.40 1391 1254 A 27 LYS HGy A 27 LYS HEx 1.0 0.0 4.16 1392 1254 A 27 LYS HGy A 27 LYS HEy 1.0 0.0 4.16 1393 1255 A 27 LYS HB2 A 27 LYS HGy 1.0 0.0 4.38 1394 1256 A 27 LYS HGy A 27 LYS HGx 1.0 0.0 2.68 1395 1257 A 82 ILE HG1x A 82 ILE HG1y 1.0 0.0 3.30 1396 1258 A 63 LYS HGx A 63 LYS HBx 1.0 0.0 4.10 1397 1258 A 63 LYS HBy A 63 LYS HGx 1.0 0.0 4.10 1398 1259 A 9 LYS HBy A 9 LYS HGy 1.0 0.0 4.04 1399 1260 A 27 LYS H A 27 LYS HB3 1.0 0.0 4.46 1400 1261 A 27 LYS HB3 A 28 GLU H 1.0 0.0 5.33 1401 1262 A 24 ASP HA A 27 LYS HB3 1.0 0.0 5.16 1402 1263 A 113 ARG HBx A 113 ARG HBy 1.0 0.0 2.69 1403 1264 A 27 LYS HB3 A 27 LYS HGx 1.0 0.0 3.87 1404 1265 A 91 LYS H A 91 LYS HB3 1.0 0.0 4.62 1405 1266 A 11 VAL H A 11 VAL HB 1.0 0.0 4.23 1406 1267 A 41 LYS HBx A 41 LYS HA 1.0 0.0 3.90 1407 1268 A 89 LYS HBy A 89 LYS HBx 1.0 0.0 3.13 1408 1269 A 28 GLU H A 28 GLU HA 1.0 0.0 4.33 1409 1270 A 29 VAL H A 28 GLU HBx 1.0 0.0 5.04 1410 1270 A 29 VAL H A 28 GLU HBy 1.0 0.0 5.04 1411 1271 A 28 GLU H A 28 GLU HBx 1.0 0.0 4.39 1412 1271 A 28 GLU H A 28 GLU HBy 1.0 0.0 4.39 1413 1272 A 25 ASP HA A 28 GLU HBx 1.0 0.0 5.11 1414 1272 A 25 ASP HA A 28 GLU HBy 1.0 0.0 5.11 1415 1273 A 104 LYS HA A 104 LYS HDy 1.0 0.0 4.30 1416 1274 A 104 LYS HDx A 104 LYS HEy 1.0 0.0 4.71 1417 1275 A 104 LYS HDy A 104 LYS HEx 1.0 0.0 4.67 1418 1276 A 28 GLU HGy A 28 GLU HBx 1.0 0.0 4.50 1419 1276 A 28 GLU HGy A 28 GLU HBy 1.0 0.0 4.50 1420 1277 A 28 GLU HGx A 28 GLU HBx 1.0 0.0 4.10 1421 1277 A 28 GLU HBy A 28 GLU HGx 1.0 0.0 4.10 1422 1278 A 104 LYS HGx A 104 LYS HDy 1.0 0.0 3.89 1423 1279 A 28 GLU H A 28 GLU HGx 1.0 0.0 4.72 1424 1280 A 25 ASP HA A 28 GLU HGx 1.0 0.0 5.27 1425 1281 A 28 GLU HA A 28 GLU HGx 1.0 0.0 5.12 1426 1282 A 28 GLU HGy A 28 GLU HGx 1.0 0.0 3.32 1427 1283 A 28 GLU HGx A 28 GLU HBx 1.0 0.0 3.88 1428 1283 A 28 GLU HBy A 28 GLU HGx 1.0 0.0 3.88 1429 1284 A 108 SER H A 108 SER HBx 1.0 0.0 5.00 1430 1284 A 108 SER H A 108 SER HBy 1.0 0.0 5.00 1431 1285 A 29 VAL H A 29 VAL HA 1.0 0.0 4.22 1432 1286 A 29 VAL HA A 32 ASN H 1.0 0.0 4.20 1433 1287 A 108 SER HA A 108 SER HBx 1.0 0.0 3.58 1434 1287 A 108 SER HA A 108 SER HBy 1.0 0.0 3.58 1435 1288 A 29 VAL HA A 29 VAL HB 1.0 0.0 3.86 1436 1289 A 29 VAL HGy% A 29 VAL HA 1.0 0.0 3.69 1437 1290 A 29 VAL HGx% A 39 TRP HE1 1.0 0.0 4.81 1438 1291 A 30 GLU H A 29 VAL HGx% 1.0 0.0 5.01 1439 1292 A 34 GLU H A 29 VAL HGx% 1.0 0.0 5.55 1440 1293 A 29 VAL H A 29 VAL HGx% 1.0 0.0 4.32 1441 1294 A 29 VAL HGx% A 39 TRP HZ2 1.0 0.0 4.54 1442 1295 A 29 VAL HGx% A 39 TRP HH2 1.0 0.0 5.53 1443 1296 A 29 VAL HA A 29 VAL HGx% 1.0 0.0 4.01 1444 1297 A 26 ILE HA A 29 VAL HGx% 1.0 0.0 4.18 1445 1298 A 29 VAL HGx% A 38 TYR HBx 1.0 0.0 4.29 1446 1299 A 29 VAL HGx% A 36 MET HE% 1.0 0.0 5.41 1447 1300 A 29 VAL HB A 29 VAL HGx% 1.0 0.0 3.91 1448 1301 A 29 VAL HGx% A 82 ILE HG2% 1.0 0.0 4.66 1449 1302 A 29 VAL HGy% A 39 TRP HE1 1.0 0.0 4.83 1450 1303 A 29 VAL HGy% A 30 GLU H 1.0 0.0 4.71 1451 1304 A 29 VAL HGy% A 29 VAL H 1.0 0.0 3.92 1452 1305 A 29 VAL HGy% A 32 ASN H 1.0 0.0 5.29 1453 1306 A 29 VAL HGy% A 39 TRP HD1 1.0 0.0 5.35 1454 1307 A 29 VAL HGy% A 38 TYR HD% 1.0 0.0 4.79 1455 1308 A 29 VAL HGy% A 28 GLU H 1.0 0.0 5.16 1456 1309 A 29 VAL HGy% A 39 TRP HH2 1.0 0.0 4.88 1457 1310 A 29 VAL HGy% A 29 VAL HA 1.0 0.0 3.98 1458 1311 A 26 ILE HA A 29 VAL HGy% 1.0 0.0 3.64 1459 1312 A 29 VAL HGy% A 35 ASP HBy 1.0 0.0 5.15 1460 1313 A 29 VAL HGy% A 38 TYR HBx 1.0 0.0 4.45 1461 1314 A 26 ILE HB A 29 VAL HGy% 1.0 0.0 4.89 1462 1315 A 29 VAL HGy% A 29 VAL HB 1.0 0.0 3.68 1463 1316 A 29 VAL HGy% A 26 ILE HD1% 1.0 0.0 5.37 1464 1317 A 29 VAL H A 29 VAL HB 1.0 0.0 4.39 1465 1318 A 29 VAL HB A 39 TRP HZ2 1.0 0.0 5.29 1466 1319 A 29 VAL HB A 33 PRO HA 1.0 0.0 4.65 1467 1320 A 29 VAL HA A 29 VAL HB 1.0 0.0 4.07 1468 1321 A 26 ILE HA A 29 VAL HB 1.0 0.0 4.79 1469 1322 A 29 VAL HB A 30 GLU HGy 1.0 0.0 5.40 1470 1323 A 29 VAL HGy% A 29 VAL HB 1.0 0.0 3.57 1471 1324 A 30 GLU H A 30 GLU HA 1.0 0.0 4.29 1472 1325 A 75 MET H A 75 MET HA 1.0 0.0 4.49 1473 1326 A 31 LYS H A 30 GLU HA 1.0 0.0 4.90 1474 1327 A 30 GLU HGy A 30 GLU HA 1.0 0.0 4.69 1475 1328 A 30 GLU HBy A 30 GLU HA 1.0 0.0 3.57 1476 1329 A 30 GLU HBx A 30 GLU HA 1.0 0.0 3.65 1477 1330 A 87 ILE HG2% A 30 GLU HA 1.0 0.0 3.99 1478 1331 A 75 MET HA A 80 ILE HG2% 1.0 0.0 4.66 1479 1332 A 100 GLU H A 99 ARG HBx 1.0 0.0 5.79 1480 1333 A 31 LYS H A 30 GLU HBx 1.0 0.0 5.20 1481 1334 A 100 GLU HA A 100 GLU HBx 1.0 0.0 3.90 1482 1335 A 30 GLU HBx A 30 GLU HA 1.0 0.0 4.18 1483 1336 A 30 GLU HGy A 30 GLU HBx 1.0 0.0 4.35 1484 1337 A 30 GLU H A 30 GLU HGy 1.0 0.0 4.29 1485 1338 A 27 LYS HA A 30 GLU HGy 1.0 0.0 5.11 1486 1339 A 30 GLU HGy A 30 GLU HA 1.0 0.0 4.50 1487 1340 A 30 GLU HGy A 30 GLU HBy 1.0 0.0 3.04 1488 1341 A 30 GLU HGy A 30 GLU HBx 1.0 0.0 4.09 1489 1342 A 29 VAL HB A 30 GLU HGy 1.0 0.0 5.43 1490 1343 A 30 GLU HGy A 87 ILE HG2% 1.0 0.0 4.50 1491 1344 A 26 ILE HG2% A 30 GLU HGy 1.0 0.0 4.46 1492 1345 A 29 VAL HGy% A 38 TYR HBx 1.0 0.0 4.69 1493 1346 A 31 LYS H A 30 GLU HBy 1.0 0.0 5.34 1494 1347 A 87 ILE HA A 87 ILE HG1x 1.0 0.0 4.76 1495 1347 A 87 ILE HA A 87 ILE HG1y 1.0 0.0 4.76 1496 1348 A 30 GLU HGy A 30 GLU HBy 1.0 0.0 4.06 1497 1349 A 30 GLU HBy A 30 GLU HBx 1.0 0.0 2.97 1498 1350 A 68 ILE HG1y A 93 LYS HBx 1.0 0.0 5.31 1499 1351 A 88 ASP H A 87 ILE HB 1.0 0.0 4.59 1500 1352 A 30 GLU H A 30 GLU HGx 1.0 0.0 4.53 1501 1353 A 87 ILE H A 87 ILE HB 1.0 0.0 4.30 1502 1354 A 30 GLU HA A 30 GLU HGx 1.0 0.0 4.17 1503 1355 A 87 ILE HB A 87 ILE HA 1.0 0.0 4.83 1504 1356 A 30 GLU HGy A 30 GLU HGx 1.0 0.0 3.17 1505 1357 A 30 GLU HBx A 30 GLU HGx 1.0 0.0 3.84 1506 1358 A 90 VAL HGy% A 87 ILE HB 1.0 0.0 4.89 1507 1359 A 87 ILE HB A 87 ILE HG2% 1.0 0.0 3.61 1508 1360 A 68 ILE HB A 68 ILE HD1% 1.0 0.0 4.51 1509 1361 A 26 ILE HG2% A 30 GLU HGx 1.0 0.0 5.24 1510 1362 A 29 VAL HGx% A 30 GLU HGx 1.0 0.0 5.61 1511 1363 A 31 LYS H A 31 LYS HA 1.0 0.0 4.14 1512 1364 A 31 LYS HA A 31 LYS HBy 1.0 0.0 3.58 1513 1365 A 31 LYS HA A 31 LYS HGx 1.0 0.0 4.60 1514 1365 A 31 LYS HA A 31 LYS HGy 1.0 0.0 4.60 1515 1366 A 41 LYS H A 41 LYS HGx 1.0 0.0 4.75 1516 1366 A 41 LYS H A 41 LYS HGy 1.0 0.0 4.75 1517 1367 A 103 LYS H A 103 LYS HGx 1.0 0.0 4.61 1518 1367 A 103 LYS H A 103 LYS HGy 1.0 0.0 4.61 1519 1368 A 31 LYS H A 31 LYS HGx 1.0 0.0 4.65 1520 1368 A 31 LYS H A 31 LYS HGy 1.0 0.0 4.65 1521 1369 A 31 LYS HA A 31 LYS HGx 1.0 0.0 4.16 1522 1369 A 31 LYS HA A 31 LYS HGy 1.0 0.0 4.16 1523 1370 A 31 LYS HEx A 31 LYS HGx 1.0 0.0 4.42 1524 1370 A 31 LYS HEy A 31 LYS HGx 1.0 0.0 4.42 1525 1370 A 31 LYS HGy A 31 LYS HEx 1.0 0.0 4.42 1526 1370 A 31 LYS HGy A 31 LYS HEy 1.0 0.0 4.42 1527 1371 A 31 LYS HBy A 31 LYS HGx 1.0 0.0 3.63 1528 1371 A 31 LYS HBy A 31 LYS HGy 1.0 0.0 3.63 1529 1372 A 31 LYS H A 31 LYS HBx 1.0 0.0 4.86 1530 1373 A 31 LYS H A 31 LYS HBy 1.0 0.0 4.71 1531 1374 A 103 LYS HBx A 103 LYS HEx 1.0 0.0 5.13 1532 1374 A 103 LYS HBy A 103 LYS HEx 1.0 0.0 5.13 1533 1374 A 103 LYS HEy A 103 LYS HBx 1.0 0.0 5.13 1534 1374 A 103 LYS HBy A 103 LYS HEy 1.0 0.0 5.13 1535 1375 A 32 ASN HA A 33 PRO HDy 1.0 0.0 3.73 1536 1376 A 32 ASN HA A 33 PRO HDx 1.0 0.0 3.75 1537 1377 A 40 ASN H A 40 ASN HBx 1.0 0.0 4.25 1538 1378 A 70 ASN H A 70 ASN HBx 1.0 0.0 3.66 1539 1378 A 70 ASN HBy A 70 ASN H 1.0 0.0 3.66 1540 1379 A 32 ASN HD2y A 32 ASN HBx 1.0 0.0 4.33 1541 1380 A 40 ASN HBx A 41 LYS H 1.0 0.0 4.65 1542 1381 A 32 ASN H A 32 ASN HBx 1.0 0.0 4.40 1543 1382 A 32 ASN HD2x A 32 ASN HBx 1.0 0.0 4.91 1544 1383 A 32 ASN HBx A 32 ASN HA 1.0 0.0 4.14 1545 1384 A 70 ASN HA A 70 ASN HBx 1.0 0.0 3.69 1546 1384 A 70 ASN HBy A 70 ASN HA 1.0 0.0 3.69 1547 1385 A 67 THR HA A 70 ASN HBx 1.0 0.0 3.99 1548 1385 A 67 THR HA A 70 ASN HBy 1.0 0.0 3.99 1549 1386 A 32 ASN HBy A 32 ASN HBx 1.0 0.0 2.74 1550 1387 A 32 ASN HBy A 32 ASN HA 1.0 0.0 4.26 1551 1388 A 33 PRO HDx A 33 PRO HB2 1.0 0.0 4.83 1552 1389 A 41 LYS HBy A 41 LYS HGx 1.0 0.0 3.37 1553 1389 A 41 LYS HGy A 41 LYS HBy 1.0 0.0 3.37 1554 1390 A 34 GLU H A 33 PRO HGx 1.0 0.0 5.00 1555 1390 A 34 GLU H A 33 PRO HGy 1.0 0.0 5.00 1556 1391 A 32 ASN HA A 33 PRO HGx 1.0 0.0 5.31 1557 1391 A 32 ASN HA A 33 PRO HGy 1.0 0.0 5.31 1558 1392 A 33 PRO HDy A 33 PRO HGx 1.0 0.0 3.92 1559 1392 A 33 PRO HDy A 33 PRO HGy 1.0 0.0 3.92 1560 1393 A 33 PRO HDx A 33 PRO HGx 1.0 0.0 4.04 1561 1393 A 33 PRO HDx A 33 PRO HGy 1.0 0.0 4.04 1562 1394 A 33 PRO HB3 A 33 PRO HGx 1.0 0.0 3.64 1563 1394 A 33 PRO HB3 A 33 PRO HGy 1.0 0.0 3.64 1564 1395 A 82 ILE HG2% A 33 PRO HGx 1.0 0.0 4.34 1565 1395 A 82 ILE HG2% A 33 PRO HGy 1.0 0.0 4.34 1566 1396 A 32 ASN HA A 33 PRO HDy 1.0 0.0 4.48 1567 1397 A 33 PRO HDx A 33 PRO HDy 1.0 0.0 3.29 1568 1398 A 33 PRO HDy A 33 PRO HGx 1.0 0.0 4.16 1569 1398 A 33 PRO HDy A 33 PRO HGy 1.0 0.0 4.16 1570 1399 A 69 MET H A 69 MET HB3 1.0 0.0 5.07 1571 1400 A 33 PRO HA A 33 PRO HB3 1.0 0.0 4.18 1572 1401 A 75 MET HA A 75 MET HGy 1.0 0.0 5.03 1573 1402 A 33 PRO HDx A 33 PRO HB3 1.0 0.0 5.07 1574 1403 A 33 PRO HB2 A 33 PRO HB3 1.0 0.0 3.07 1575 1404 A 69 MET HB3 A 69 MET HE% 1.0 0.0 4.58 1576 1405 A 56 MET HGy A 56 MET HBx 1.0 0.0 3.82 1577 1405 A 56 MET HGy A 56 MET HBy 1.0 0.0 3.82 1578 1406 A 82 ILE HG2% A 33 PRO HB3 1.0 0.0 4.05 1579 1407 A 32 ASN HA A 33 PRO HDx 1.0 0.0 4.14 1580 1408 A 33 PRO HDx A 33 PRO HDy 1.0 0.0 3.26 1581 1409 A 33 PRO HDx A 33 PRO HGx 1.0 0.0 4.10 1582 1409 A 33 PRO HDx A 33 PRO HGy 1.0 0.0 4.10 1583 1410 A 34 GLU HA A 34 GLU HBy 1.0 0.0 3.79 1584 1411 A 37 GLU H A 37 GLU HBx 1.0 0.0 4.07 1585 1412 A 34 GLU H A 34 GLU HBx 1.0 0.0 4.04 1586 1413 A 38 TYR H A 37 GLU HBx 1.0 0.0 4.61 1587 1414 A 34 GLU HA A 34 GLU HBx 1.0 0.0 4.18 1588 1415 A 37 GLU HA A 37 GLU HBx 1.0 0.0 3.98 1589 1416 A 34 GLU HBx A 34 GLU HBy 1.0 0.0 3.08 1590 1417 A 37 GLU HBx A 37 GLU HBy 1.0 0.0 2.88 1591 1418 A 34 GLU HGy A 82 ILE HB 1.0 0.0 4.74 1592 1419 A 34 GLU HGy A 82 ILE HD1% 1.0 0.0 5.11 1593 1420 A 34 GLU H A 34 GLU HBy 1.0 0.0 4.40 1594 1421 A 34 GLU HA A 34 GLU HBy 1.0 0.0 4.07 1595 1422 A 34 GLU HBx A 34 GLU HBy 1.0 0.0 3.16 1596 1423 A 34 GLU HA A 34 GLU HGx 1.0 0.0 4.33 1597 1424 A 34 GLU HBx A 34 GLU HGx 1.0 0.0 3.79 1598 1425 A 82 ILE HD1% A 34 GLU HGx 1.0 0.0 5.39 1599 1426 A 89 LYS H A 88 ASP HBx 1.0 0.0 4.38 1600 1427 A 88 ASP HA A 88 ASP HBx 1.0 0.0 3.58 1601 1428 A 35 ASP H A 35 ASP HBy 1.0 0.0 4.25 1602 1429 A 35 ASP HA A 35 ASP HBy 1.0 0.0 4.52 1603 1430 A 35 ASP HBy A 35 ASP HBx 1.0 0.0 3.39 1604 1431 A 35 ASP HBy A 29 VAL HGx% 1.0 0.0 5.37 1605 1432 A 36 MET HBx A 36 MET HA 1.0 0.0 5.02 1606 1433 A 36 MET HG2 A 36 MET HBx 1.0 0.0 4.65 1607 1434 A 36 MET HG3 A 36 MET HBx 1.0 0.0 5.27 1608 1435 A 36 MET H A 36 MET HG2 1.0 0.0 4.50 1609 1436 A 35 ASP HA A 36 MET HG2 1.0 0.0 5.03 1610 1437 A 36 MET HG2 A 36 MET HG3 1.0 0.0 3.19 1611 1438 A 36 MET HG2 A 36 MET HBx 1.0 0.0 3.99 1612 1439 A 36 MET HG2 A 76 LEU HDx% 1.0 0.0 5.66 1613 1439 A 76 LEU HDy% A 36 MET HG2 1.0 0.0 5.66 1614 1440 A 39 TRP HE1 A 36 MET HE% 1.0 0.0 5.40 1615 1441 A 36 MET H A 36 MET HE% 1.0 0.0 5.10 1616 1442 A 35 ASP H A 36 MET HE% 1.0 0.0 5.31 1617 1443 A 39 TRP HD1 A 36 MET HE% 1.0 0.0 4.38 1618 1444 A 36 MET HA A 36 MET HE% 1.0 0.0 4.39 1619 1445 A 34 GLU HA A 36 MET HE% 1.0 0.0 4.41 1620 1446 A 76 LEU HA A 36 MET HE% 1.0 0.0 4.11 1621 1447 A 36 MET HE% A 39 TRP HBx 1.0 0.0 4.58 1622 1447 A 39 TRP HBy A 36 MET HE% 1.0 0.0 4.58 1623 1448 A 36 MET HG2 A 36 MET HE% 1.0 0.0 4.29 1624 1449 A 34 GLU HGy A 36 MET HE% 1.0 0.0 4.93 1625 1450 A 82 ILE HB A 36 MET HE% 1.0 0.0 4.22 1626 1451 A 36 MET HE% A 82 ILE HG1y 1.0 0.0 4.11 1627 1452 A 72 VAL HGx% A 36 MET HE% 1.0 0.0 4.28 1628 1453 A 36 MET HE% A 76 LEU HDx% 1.0 0.0 3.70 1629 1453 A 76 LEU HDy% A 36 MET HE% 1.0 0.0 3.70 1630 1454 A 82 ILE HD1% A 36 MET HE% 1.0 0.0 3.61 1631 1455 A 76 LEU HA A 36 MET HBy 1.0 0.0 4.66 1632 1456 A 36 MET H A 36 MET HG3 1.0 0.0 4.27 1633 1457 A 36 MET HG3 A 36 MET HA 1.0 0.0 4.81 1634 1458 A 36 MET HG2 A 36 MET HG3 1.0 0.0 3.28 1635 1459 A 36 MET HG3 A 36 MET HBy 1.0 0.0 4.30 1636 1460 A 37 GLU H A 37 GLU HA 1.0 0.0 4.16 1637 1461 A 37 GLU HA A 40 ASN HBy 1.0 0.0 4.22 1638 1462 A 37 GLU HA A 37 GLU HBy 1.0 0.0 3.82 1639 1463 A 34 GLU HBx A 34 GLU HGx 1.0 0.0 3.60 1640 1464 A 37 GLU H A 37 GLU HGy 1.0 0.0 4.80 1641 1465 A 62 ALA HB% A 54 GLU HGx 1.0 0.0 4.10 1642 1466 A 14 GLU H A 14 GLU HBx 1.0 0.0 4.13 1643 1467 A 38 TYR H A 37 GLU HBy 1.0 0.0 4.72 1644 1468 A 37 GLU HBx A 37 GLU HBy 1.0 0.0 2.96 1645 1469 A 37 GLU H A 37 GLU HGx 1.0 0.0 4.82 1646 1470 A 51 GLU H A 51 GLU HGx 1.0 0.0 4.38 1647 1471 A 37 GLU HA A 37 GLU HGx 1.0 0.0 4.58 1648 1472 A 51 GLU HA A 51 GLU HGx 1.0 0.0 4.48 1649 1473 A 37 GLU HGy A 37 GLU HGx 1.0 0.0 2.56 1650 1474 A 38 TYR HA A 38 TYR HBx 1.0 0.0 4.11 1651 1475 A 105 VAL HA A 105 VAL HB 1.0 0.0 3.94 1652 1476 A 105 VAL HA A 105 VAL HGx% 1.0 0.0 3.58 1653 1476 A 105 VAL HA A 105 VAL HGy% 1.0 0.0 3.58 1654 1477 A 38 TYR H A 38 TYR HBx 1.0 0.0 4.74 1655 1478 A 39 TRP H A 38 TYR HBx 1.0 0.0 5.47 1656 1479 A 38 TYR HA A 38 TYR HBx 1.0 0.0 4.90 1657 1480 A 38 TYR HA A 38 TYR HBy 1.0 0.0 4.77 1658 1481 A 29 VAL HGy% A 38 TYR HBy 1.0 0.0 4.83 1659 1482 A 39 TRP H A 39 TRP HBx 1.0 0.0 4.84 1660 1482 A 39 TRP H A 39 TRP HBy 1.0 0.0 4.84 1661 1483 A 39 TRP HD1 A 39 TRP HBx 1.0 0.0 5.21 1662 1483 A 39 TRP HD1 A 39 TRP HBy 1.0 0.0 5.21 1663 1484 A 47 HIS HBy A 47 HIS HBx 1.0 0.0 3.42 1664 1485 A 72 VAL HGx% A 39 TRP HBx 1.0 0.0 5.13 1665 1485 A 39 TRP HBy A 72 VAL HGx% 1.0 0.0 5.13 1666 1486 A 37 GLU HA A 40 ASN HBx 1.0 0.0 4.76 1667 1487 A 109 TYR HBy A 109 TYR HBx 1.0 0.0 2.76 1668 1488 A 89 LYS H A 89 LYS HA 1.0 0.0 4.31 1669 1489 A 74 LYS HA A 74 LYS HDx 1.0 0.0 3.86 1670 1489 A 74 LYS HA A 74 LYS HDy 1.0 0.0 3.86 1671 1490 A 53 THR HG2% A 54 GLU HA 1.0 0.0 4.05 1672 1491 A 89 LYS H A 89 LYS HBy 1.0 0.0 4.18 1673 1492 A 41 LYS H A 41 LYS HBy 1.0 0.0 4.93 1674 1493 A 74 LYS H A 74 LYS HBy 1.0 0.0 4.50 1675 1494 A 89 LYS HA A 89 LYS HBy 1.0 0.0 4.26 1676 1495 A 53 THR H A 52 ILE HA 1.0 0.0 4.42 1677 1496 A 42 ILE HA A 42 ILE HG1y 1.0 0.0 4.23 1678 1497 A 42 ILE HA A 45 LEU HBx 1.0 0.0 5.36 1679 1498 A 52 ILE HG1x A 52 ILE HA 1.0 0.0 3.32 1680 1499 A 26 ILE H A 42 ILE HD1% 1.0 0.0 5.17 1681 1500 A 42 ILE H A 42 ILE HD1% 1.0 0.0 4.71 1682 1501 A 29 VAL H A 42 ILE HD1% 1.0 0.0 4.49 1683 1502 A 42 ILE HD1% A 39 TRP HH2 1.0 0.0 4.74 1684 1503 A 39 TRP HA A 42 ILE HD1% 1.0 0.0 4.26 1685 1504 A 42 ILE HA A 42 ILE HD1% 1.0 0.0 4.65 1686 1505 A 26 ILE HA A 42 ILE HD1% 1.0 0.0 4.33 1687 1506 A 25 ASP HB3 A 42 ILE HD1% 1.0 0.0 4.74 1688 1507 A 25 ASP HB2 A 42 ILE HD1% 1.0 0.0 4.64 1689 1508 A 42 ILE HD1% A 42 ILE HB 1.0 0.0 4.07 1690 1509 A 42 ILE HD1% A 42 ILE HG1y 1.0 0.0 3.87 1691 1510 A 26 ILE HG1y A 42 ILE HD1% 1.0 0.0 4.67 1692 1511 A 42 ILE HD1% A 42 ILE HG2% 1.0 0.0 3.21 1693 1512 A 42 ILE HD1% A 26 ILE HD1% 1.0 0.0 4.21 1694 1513 A 43 TYR H A 42 ILE HG2% 1.0 0.0 4.82 1695 1514 A 42 ILE H A 42 ILE HG2% 1.0 0.0 4.66 1696 1515 A 42 ILE HG2% A 39 TRP HH2 1.0 0.0 4.49 1697 1516 A 39 TRP HA A 42 ILE HG2% 1.0 0.0 4.79 1698 1517 A 42 ILE HA A 42 ILE HG2% 1.0 0.0 3.95 1699 1518 A 42 ILE HB A 42 ILE HG2% 1.0 0.0 3.69 1700 1519 A 42 ILE HG2% A 42 ILE HG1y 1.0 0.0 4.49 1701 1520 A 72 VAL HGx% A 42 ILE HG2% 1.0 0.0 4.78 1702 1521 A 42 ILE HG2% A 72 VAL HGy% 1.0 0.0 4.23 1703 1522 A 42 ILE HD1% A 42 ILE HG2% 1.0 0.0 3.57 1704 1523 A 42 ILE H A 42 ILE HG1x 1.0 0.0 5.28 1705 1524 A 42 ILE HA A 42 ILE HG1x 1.0 0.0 4.90 1706 1525 A 25 ASP HB3 A 42 ILE HG1x 1.0 0.0 5.50 1707 1526 A 41 LYS HBx A 42 ILE HG1x 1.0 0.0 4.07 1708 1527 A 42 ILE HD1% A 42 ILE HG1x 1.0 0.0 4.51 1709 1528 A 42 ILE H A 42 ILE HG1y 1.0 0.0 4.97 1710 1529 A 22 VAL HA A 42 ILE HG1y 1.0 0.0 5.08 1711 1530 A 42 ILE HG2% A 42 ILE HG1y 1.0 0.0 3.84 1712 1531 A 42 ILE HD1% A 42 ILE HG1y 1.0 0.0 4.54 1713 1532 A 43 TYR H A 43 TYR HA 1.0 0.0 4.04 1714 1533 A 44 ARG H A 43 TYR HA 1.0 0.0 5.07 1715 1534 A 43 TYR HA A 43 TYR HD% 1.0 0.0 4.52 1716 1535 A 82 ILE HA A 83 THR H 1.0 0.0 4.07 1717 1536 A 43 TYR HA A 43 TYR HBy 1.0 0.0 4.19 1718 1537 A 43 TYR HA A 43 TYR HBx 1.0 0.0 4.00 1719 1538 A 43 TYR HA A 46 VAL HB 1.0 0.0 4.37 1720 1539 A 43 TYR HA A 46 VAL HGy% 1.0 0.0 3.89 1721 1540 A 43 TYR H A 43 TYR HBx 1.0 0.0 4.53 1722 1541 A 43 TYR HBx A 43 TYR HD% 1.0 0.0 4.93 1723 1542 A 40 ASN HA A 43 TYR HBx 1.0 0.0 5.26 1724 1543 A 43 TYR HA A 43 TYR HBx 1.0 0.0 4.73 1725 1544 A 43 TYR HBy A 43 TYR HBx 1.0 0.0 3.89 1726 1545 A 43 TYR HBx A 72 VAL HGx% 1.0 0.0 4.87 1727 1546 A 43 TYR H A 43 TYR HBy 1.0 0.0 4.51 1728 1547 A 44 ARG H A 43 TYR HBy 1.0 0.0 5.04 1729 1548 A 43 TYR HBy A 43 TYR HD% 1.0 0.0 4.74 1730 1549 A 40 ASN HA A 43 TYR HBy 1.0 0.0 4.94 1731 1550 A 43 TYR HA A 43 TYR HBy 1.0 0.0 4.98 1732 1551 A 43 TYR HBy A 43 TYR HBx 1.0 0.0 3.81 1733 1552 A 43 TYR HBy A 72 VAL HGx% 1.0 0.0 5.07 1734 1553 A 44 ARG H A 44 ARG HGy 1.0 0.0 5.34 1735 1554 A 44 ARG HGy A 44 ARG HDy 1.0 0.0 4.43 1736 1555 A 44 ARG HGx A 44 ARG HGy 1.0 0.0 3.28 1737 1556 A 45 LEU H A 44 ARG HGx 1.0 0.0 5.65 1738 1557 A 99 ARG H A 99 ARG HGy 1.0 0.0 4.68 1739 1558 A 44 ARG HA A 44 ARG HGx 1.0 0.0 4.44 1740 1559 A 43 TYR HBx A 44 ARG HGx 1.0 0.0 4.07 1741 1560 A 44 ARG HGx A 44 ARG HGy 1.0 0.0 3.15 1742 1561 A 99 ARG HGx A 99 ARG HGy 1.0 0.0 3.20 1743 1562 A 87 ILE H A 87 ILE HG1x 1.0 0.0 4.63 1744 1562 A 87 ILE H A 87 ILE HG1y 1.0 0.0 4.63 1745 1563 A 39 TRP HZ2 A 87 ILE HG1x 1.0 0.0 5.10 1746 1563 A 39 TRP HZ2 A 87 ILE HG1y 1.0 0.0 5.10 1747 1564 A 39 TRP HH2 A 87 ILE HG1x 1.0 0.0 5.23 1748 1564 A 87 ILE HG1y A 39 TRP HH2 1.0 0.0 5.23 1749 1565 A 44 ARG HDy A 44 ARG HBx 1.0 0.0 4.26 1750 1565 A 44 ARG HBy A 44 ARG HDy 1.0 0.0 4.26 1751 1566 A 44 ARG HGx A 44 ARG HDy 1.0 0.0 4.53 1752 1567 A 44 ARG HA A 44 ARG HDx 1.0 0.0 4.91 1753 1568 A 44 ARG HGy A 44 ARG HDx 1.0 0.0 4.32 1754 1569 A 44 ARG HGx A 44 ARG HDx 1.0 0.0 4.00 1755 1570 A 99 ARG HGx A 99 ARG HDy 1.0 0.0 4.36 1756 1571 A 45 LEU H A 45 LEU HA 1.0 0.0 4.11 1757 1572 A 45 LEU HDy% A 45 LEU HA 1.0 0.0 3.30 1758 1573 A 46 VAL H A 45 LEU HDx% 1.0 0.0 5.45 1759 1574 A 22 VAL H A 45 LEU HDx% 1.0 0.0 5.08 1760 1575 A 45 LEU H A 45 LEU HDx% 1.0 0.0 4.92 1761 1576 A 45 LEU HA A 45 LEU HDx% 1.0 0.0 5.17 1762 1577 A 22 VAL HA A 45 LEU HDx% 1.0 0.0 3.92 1763 1578 A 21 ASN HBy A 45 LEU HDx% 1.0 0.0 4.48 1764 1579 A 21 ASN HBx A 45 LEU HDx% 1.0 0.0 4.21 1765 1580 A 25 ASP HB3 A 45 LEU HDx% 1.0 0.0 5.07 1766 1581 A 22 VAL HB A 45 LEU HDx% 1.0 0.0 5.05 1767 1582 A 45 LEU HBy A 45 LEU HDx% 1.0 0.0 3.92 1768 1583 A 45 LEU HG A 45 LEU HDx% 1.0 0.0 4.62 1769 1584 A 46 VAL H A 45 LEU HBx 1.0 0.0 5.22 1770 1585 A 45 LEU H A 45 LEU HBx 1.0 0.0 4.92 1771 1586 A 45 LEU HBx A 45 LEU HA 1.0 0.0 4.75 1772 1587 A 22 VAL HA A 45 LEU HBx 1.0 0.0 5.40 1773 1588 A 45 LEU HBx A 45 LEU HBy 1.0 0.0 3.64 1774 1589 A 76 LEU HBy A 76 LEU HBx 1.0 0.0 3.42 1775 1590 A 22 VAL HGy% A 45 LEU HBx 1.0 0.0 4.61 1776 1591 A 49 MET HBy A 65 LEU HDy% 1.0 0.0 5.37 1777 1592 A 46 VAL H A 45 LEU HBy 1.0 0.0 5.07 1778 1593 A 22 VAL HA A 45 LEU HBy 1.0 0.0 5.15 1779 1594 A 45 LEU HBx A 45 LEU HBy 1.0 0.0 3.65 1780 1595 A 45 LEU H A 45 LEU HG 1.0 0.0 4.25 1781 1596 A 45 LEU HG A 45 LEU HA 1.0 0.0 4.63 1782 1597 A 45 LEU HG A 45 LEU HBx 1.0 0.0 4.65 1783 1598 A 22 VAL HGy% A 45 LEU HG 1.0 0.0 5.47 1784 1599 A 45 LEU HG A 45 LEU HDy% 1.0 0.0 3.91 1785 1600 A 76 LEU HG A 76 LEU HDx% 1.0 0.0 3.64 1786 1600 A 76 LEU HDy% A 76 LEU HG 1.0 0.0 3.64 1787 1601 A 72 VAL H A 72 VAL HA 1.0 0.0 4.30 1788 1602 A 46 VAL HA A 49 MET H 1.0 0.0 4.98 1789 1603 A 72 VAL HA A 72 VAL HB 1.0 0.0 4.21 1790 1604 A 46 VAL HA A 46 VAL HB 1.0 0.0 4.33 1791 1605 A 46 VAL HA A 49 MET HE% 1.0 0.0 4.19 1792 1606 A 72 VAL HGx% A 72 VAL HA 1.0 0.0 3.79 1793 1607 A 72 VAL HA A 72 VAL HGy% 1.0 0.0 3.77 1794 1608 A 90 VAL HGy% A 87 ILE HA 1.0 0.0 4.01 1795 1609 A 64 VAL HGx% A 64 VAL H 1.0 0.0 6.00 1796 1610 A 64 VAL HGx% A 64 VAL HA 1.0 0.0 3.79 1797 1611 A 64 VAL HGx% A 96 MET HB3 1.0 0.0 4.55 1798 1612 A 46 VAL H A 46 VAL HB 1.0 0.0 3.78 1799 1613 A 79 GLU H A 79 GLU HBy 1.0 0.0 4.89 1800 1614 A 79 GLU HA A 79 GLU HBy 1.0 0.0 4.16 1801 1615 A 46 VAL HA A 46 VAL HB 1.0 0.0 4.54 1802 1616 A 46 VAL HGy% A 46 VAL HB 1.0 0.0 3.71 1803 1617 A 47 HIS HA A 47 HIS HBx 1.0 0.0 4.41 1804 1618 A 47 HIS H A 47 HIS HBx 1.0 0.0 4.23 1805 1619 A 48 THR H A 47 HIS HBx 1.0 0.0 5.03 1806 1620 A 47 HIS HBx A 43 TYR HD% 1.0 0.0 5.49 1807 1621 A 47 HIS HA A 47 HIS HBx 1.0 0.0 4.34 1808 1622 A 44 ARG HA A 47 HIS HBx 1.0 0.0 4.94 1809 1623 A 47 HIS HBy A 47 HIS HBx 1.0 0.0 3.46 1810 1624 A 47 HIS H A 47 HIS HBy 1.0 0.0 4.19 1811 1625 A 48 THR H A 47 HIS HBy 1.0 0.0 4.72 1812 1626 A 47 HIS HA A 47 HIS HBy 1.0 0.0 4.50 1813 1627 A 44 ARG HA A 47 HIS HBy 1.0 0.0 4.53 1814 1628 A 47 HIS HBy A 44 ARG HBx 1.0 0.0 5.35 1815 1628 A 44 ARG HBy A 47 HIS HBy 1.0 0.0 5.35 1816 1629 A 48 THR H A 48 THR HB 1.0 0.0 4.01 1817 1630 A 48 THR HB A 48 THR HG2% 1.0 0.0 3.78 1818 1631 A 55 THR H A 55 THR HG2% 1.0 0.0 4.64 1819 1632 A 48 THR HG2% A 49 MET HA 1.0 0.0 4.55 1820 1633 A 50 LYS H A 49 MET HA 1.0 0.0 4.72 1821 1634 A 69 MET H A 69 MET HA 1.0 0.0 4.22 1822 1635 A 49 MET HA A 49 MET HGx 1.0 0.0 4.04 1823 1636 A 69 MET HG2 A 69 MET HA 1.0 0.0 3.97 1824 1637 A 49 MET HA A 49 MET HBx 1.0 0.0 4.22 1825 1638 A 50 LYS HBx A 50 LYS HA 1.0 0.0 4.07 1826 1639 A 50 LYS HA A 50 LYS HGx 1.0 0.0 4.14 1827 1640 A 18 LEU HDy% A 49 MET HA 1.0 0.0 3.73 1828 1641 A 50 LYS H A 49 MET HBx 1.0 0.0 5.47 1829 1642 A 49 MET H A 49 MET HBx 1.0 0.0 5.43 1830 1643 A 49 MET HA A 49 MET HBx 1.0 0.0 4.77 1831 1644 A 49 MET HBy A 49 MET HBx 1.0 0.0 3.76 1832 1645 A 18 LEU HDy% A 49 MET HBx 1.0 0.0 4.76 1833 1646 A 49 MET H A 49 MET HGy 1.0 0.0 4.70 1834 1647 A 49 MET HA A 49 MET HGy 1.0 0.0 5.02 1835 1648 A 49 MET HBy A 49 MET HGy 1.0 0.0 4.84 1836 1649 A 49 MET HGy A 49 MET HGx 1.0 0.0 3.56 1837 1650 A 49 MET HGy A 49 MET HE% 1.0 0.0 4.87 1838 1651 A 18 LEU HDy% A 49 MET HGy 1.0 0.0 4.31 1839 1652 A 46 VAL H A 49 MET HE% 1.0 0.0 5.33 1840 1653 A 19 ILE H A 49 MET HE% 1.0 0.0 4.81 1841 1654 A 48 THR H A 49 MET HE% 1.0 0.0 5.61 1842 1655 A 45 LEU HA A 49 MET HE% 1.0 0.0 4.98 1843 1656 A 18 LEU HA A 49 MET HE% 1.0 0.0 5.12 1844 1657 A 46 VAL HA A 49 MET HE% 1.0 0.0 3.82 1845 1658 A 19 ILE HA A 49 MET HE% 1.0 0.0 4.09 1846 1659 A 49 MET HGy A 49 MET HE% 1.0 0.0 4.43 1847 1660 A 18 LEU HB3 A 49 MET HE% 1.0 0.0 3.88 1848 1661 A 18 LEU HDy% A 49 MET HE% 1.0 0.0 3.11 1849 1662 A 50 LYS H A 49 MET HBy 1.0 0.0 5.45 1850 1663 A 49 MET H A 49 MET HBy 1.0 0.0 4.91 1851 1664 A 46 VAL HA A 49 MET HBy 1.0 0.0 4.76 1852 1665 A 49 MET HBy A 49 MET HGy 1.0 0.0 5.46 1853 1666 A 49 MET HBy A 49 MET HBx 1.0 0.0 3.80 1854 1667 A 18 LEU HDy% A 49 MET HBy 1.0 0.0 4.71 1855 1668 A 69 MET H A 69 MET HB2 1.0 0.0 4.77 1856 1669 A 49 MET HA A 49 MET HGx 1.0 0.0 4.91 1857 1670 A 49 MET HGy A 49 MET HGx 1.0 0.0 3.61 1858 1671 A 49 MET HBx A 49 MET HGx 1.0 0.0 4.33 1859 1672 A 18 LEU HDy% A 49 MET HGx 1.0 0.0 4.23 1860 1673 A 69 MET HA A 43 TYR HD% 1.0 0.0 4.85 1861 1674 A 69 MET HA A 69 MET HB3 1.0 0.0 3.75 1862 1675 A 62 ALA HB% A 50 LYS HA 1.0 0.0 4.81 1863 1676 A 50 LYS H A 50 LYS HGx 1.0 0.0 5.41 1864 1677 A 51 GLU HA A 50 LYS HGx 1.0 0.0 5.38 1865 1678 A 53 THR HG2% A 53 THR HA 1.0 0.0 3.56 1866 1679 A 50 LYS HBy A 50 LYS HGx 1.0 0.0 5.14 1867 1680 A 50 LYS H A 50 LYS HBx 1.0 0.0 4.45 1868 1681 A 113 ARG H A 113 ARG HBx 1.0 0.0 4.85 1869 1682 A 104 LYS H A 104 LYS HBy 1.0 0.0 4.60 1870 1683 A 81 LYS HA A 81 LYS HBx 1.0 0.0 3.88 1871 1683 A 81 LYS HA A 81 LYS HBy 1.0 0.0 3.88 1872 1684 A 104 LYS HBy A 104 LYS HA 1.0 0.0 4.29 1873 1685 A 104 LYS HBy A 101 LEU HA 1.0 0.0 4.84 1874 1686 A 50 LYS HBx A 50 LYS HA 1.0 0.0 4.53 1875 1687 A 50 LYS HBy A 50 LYS HBx 1.0 0.0 3.65 1876 1688 A 113 ARG HBx A 113 ARG HBy 1.0 0.0 2.85 1877 1689 A 104 LYS HBy A 104 LYS HDy 1.0 0.0 3.89 1878 1690 A 104 LYS HBy A 104 LYS HGx 1.0 0.0 4.15 1879 1691 A 50 LYS H A 50 LYS HBy 1.0 0.0 4.41 1880 1692 A 62 ALA H A 61 VAL HB 1.0 0.0 3.96 1881 1693 A 51 GLU H A 50 LYS HBy 1.0 0.0 4.79 1882 1694 A 61 VAL H A 61 VAL HB 1.0 0.0 3.78 1883 1695 A 47 HIS HA A 50 LYS HBy 1.0 0.0 4.77 1884 1696 A 64 VAL HA A 64 VAL HB 1.0 0.0 4.70 1885 1697 A 58 PHE HBy A 61 VAL HB 1.0 0.0 4.34 1886 1698 A 58 PHE HBx A 61 VAL HB 1.0 0.0 4.85 1887 1699 A 89 LYS HBy A 89 LYS HBx 1.0 0.0 3.08 1888 1700 A 50 LYS HBy A 50 LYS HBx 1.0 0.0 3.62 1889 1701 A 50 LYS HBy A 50 LYS HGy 1.0 0.0 4.21 1890 1702 A 61 VAL HB A 61 VAL HGy% 1.0 0.0 3.57 1891 1703 A 74 LYS H A 74 LYS HA 1.0 0.0 4.17 1892 1704 A 53 THR H A 52 ILE HB 1.0 0.0 4.68 1893 1705 A 52 ILE H A 52 ILE HB 1.0 0.0 4.38 1894 1706 A 49 MET HA A 52 ILE HB 1.0 0.0 4.49 1895 1707 A 52 ILE HB A 53 THR HG2% 1.0 0.0 5.40 1896 1708 A 52 ILE HB A 52 ILE HG2% 1.0 0.0 4.03 1897 1709 A 62 ALA H A 61 VAL HA 1.0 0.0 4.86 1898 1710 A 52 ILE H A 52 ILE HA 1.0 0.0 4.28 1899 1711 A 61 VAL H A 61 VAL HA 1.0 0.0 4.16 1900 1712 A 52 ILE HA A 55 THR HB 1.0 0.0 4.50 1901 1713 A 52 ILE HG2% A 52 ILE HA 1.0 0.0 3.89 1902 1714 A 52 ILE H A 52 ILE HD1% 1.0 0.0 4.73 1903 1715 A 74 LYS HA A 80 ILE HD1% 1.0 0.0 4.63 1904 1716 A 49 MET HA A 52 ILE HD1% 1.0 0.0 3.93 1905 1717 A 52 ILE HG1y A 52 ILE HD1% 1.0 0.0 3.77 1906 1718 A 48 THR HG2% A 52 ILE HD1% 1.0 0.0 3.98 1907 1719 A 82 ILE HG2% A 82 ILE HD1% 1.0 0.0 3.28 1908 1720 A 53 THR H A 52 ILE HG2% 1.0 0.0 4.66 1909 1721 A 52 ILE H A 52 ILE HG2% 1.0 0.0 4.80 1910 1722 A 52 ILE HG2% A 12 THR HA 1.0 0.0 5.49 1911 1723 A 52 ILE HG2% A 56 MET HGy 1.0 0.0 4.82 1912 1724 A 52 ILE HG2% A 56 MET HGx 1.0 0.0 4.73 1913 1725 A 52 ILE HB A 52 ILE HG2% 1.0 0.0 3.70 1914 1726 A 98 THR H A 98 THR HB 1.0 0.0 4.17 1915 1727 A 55 THR H A 55 THR HB 1.0 0.0 3.77 1916 1728 A 55 THR HB A 55 THR HA 1.0 0.0 3.92 1917 1729 A 55 THR HB A 55 THR HG2% 1.0 0.0 3.26 1918 1730 A 53 THR H A 53 THR HA 1.0 0.0 4.31 1919 1731 A 56 MET H A 53 THR HA 1.0 0.0 4.81 1920 1732 A 53 THR HB A 53 THR HA 1.0 0.0 3.77 1921 1733 A 53 THR HG2% A 53 THR HA 1.0 0.0 3.56 1922 1734 A 52 ILE HG2% A 53 THR HA 1.0 0.0 4.53 1923 1735 A 53 THR H A 53 THR HG2% 1.0 0.0 3.74 1924 1736 A 53 THR HG2% A 58 PHE H 1.0 0.0 4.99 1925 1737 A 72 VAL HGx% A 43 TYR HD% 1.0 0.0 3.92 1926 1738 A 53 THR HB A 53 THR HG2% 1.0 0.0 3.55 1927 1739 A 53 THR HG2% A 54 GLU HA 1.0 0.0 3.74 1928 1740 A 72 VAL HGx% A 39 TRP HBx 1.0 0.0 3.83 1929 1740 A 39 TRP HBy A 72 VAL HGx% 1.0 0.0 3.83 1930 1741 A 53 THR HG2% A 58 PHE HBx 1.0 0.0 4.44 1931 1742 A 53 THR HG2% A 54 GLU HBy 1.0 0.0 4.41 1932 1743 A 72 VAL HGx% A 72 VAL HGy% 1.0 0.0 3.11 1933 1744 A 53 THR HG2% A 61 VAL HGx% 1.0 0.0 3.44 1934 1745 A 54 GLU H A 54 GLU HBx 1.0 0.0 4.36 1935 1746 A 55 THR H A 54 GLU HBx 1.0 0.0 5.08 1936 1747 A 54 GLU HA A 54 GLU HBx 1.0 0.0 3.91 1937 1748 A 54 GLU HBy A 54 GLU HBx 1.0 0.0 2.84 1938 1749 A 54 GLU HBx A 62 ALA HB% 1.0 0.0 4.97 1939 1750 A 55 THR H A 54 GLU HGy 1.0 0.0 5.70 1940 1751 A 54 GLU HGy A 54 GLU HBx 1.0 0.0 3.84 1941 1752 A 54 GLU HBy A 55 THR HG2% 1.0 0.0 4.94 1942 1753 A 54 GLU HA A 54 GLU HGx 1.0 0.0 3.93 1943 1754 A 54 GLU HGy A 54 GLU HGx 1.0 0.0 3.02 1944 1755 A 55 THR H A 55 THR HA 1.0 0.0 4.05 1945 1756 A 56 MET H A 55 THR HA 1.0 0.0 4.66 1946 1757 A 55 THR HB A 55 THR HA 1.0 0.0 4.22 1947 1758 A 55 THR HG2% A 55 THR HA 1.0 0.0 3.69 1948 1759 A 56 MET HA A 56 MET HBx 1.0 0.0 4.02 1949 1759 A 56 MET HA A 56 MET HBy 1.0 0.0 4.02 1950 1760 A 56 MET H A 56 MET HBx 1.0 0.0 4.36 1951 1760 A 56 MET H A 56 MET HBy 1.0 0.0 4.36 1952 1761 A 56 MET HA A 56 MET HBx 1.0 0.0 4.56 1953 1761 A 56 MET HA A 56 MET HBy 1.0 0.0 4.56 1954 1762 A 54 GLU HA A 56 MET HBx 1.0 0.0 5.52 1955 1762 A 54 GLU HA A 56 MET HBy 1.0 0.0 5.52 1956 1763 A 57 GLY HAx A 56 MET HBx 1.0 0.0 4.62 1957 1763 A 56 MET HBy A 57 GLY HAx 1.0 0.0 4.62 1958 1764 A 56 MET HGx A 56 MET HBx 1.0 0.0 3.74 1959 1764 A 56 MET HGx A 56 MET HBy 1.0 0.0 3.74 1960 1765 A 61 VAL HGy% A 56 MET HBx 1.0 0.0 5.14 1961 1765 A 56 MET HBy A 61 VAL HGy% 1.0 0.0 5.14 1962 1766 A 52 ILE HG2% A 56 MET HBx 1.0 0.0 4.45 1963 1766 A 52 ILE HG2% A 56 MET HBy 1.0 0.0 4.45 1964 1767 A 105 VAL HB A 106 SER H 1.0 0.0 5.09 1965 1768 A 105 VAL H A 105 VAL HB 1.0 0.0 4.22 1966 1769 A 112 PRO HA A 112 PRO HBy 1.0 0.0 4.10 1967 1770 A 56 MET HE% A 58 PHE HE% 1.0 0.0 4.79 1968 1771 A 56 MET HA A 56 MET HE% 1.0 0.0 5.17 1969 1772 A 8 ILE HA A 56 MET HE% 1.0 0.0 4.75 1970 1773 A 56 MET HGx A 56 MET HE% 1.0 0.0 4.51 1971 1774 A 56 MET HE% A 56 MET HBx 1.0 0.0 3.74 1972 1774 A 56 MET HBy A 56 MET HE% 1.0 0.0 3.74 1973 1775 A 52 ILE HG2% A 56 MET HE% 1.0 0.0 3.47 1974 1776 A 69 MET H A 69 MET HG3 1.0 0.0 4.70 1975 1777 A 97 VAL H A 96 MET HB2 1.0 0.0 5.09 1976 1778 A 56 MET H A 56 MET HGy 1.0 0.0 4.30 1977 1779 A 56 MET HA A 56 MET HGy 1.0 0.0 4.57 1978 1780 A 96 MET HA A 96 MET HB2 1.0 0.0 4.30 1979 1781 A 69 MET HA A 72 VAL HB 1.0 0.0 4.29 1980 1782 A 96 MET HB2 A 96 MET HGy 1.0 0.0 3.65 1981 1783 A 96 MET HGx A 96 MET HB2 1.0 0.0 3.61 1982 1784 A 69 MET HG2 A 69 MET HG3 1.0 0.0 3.41 1983 1785 A 72 VAL HB A 72 VAL HGy% 1.0 0.0 3.79 1984 1786 A 69 MET HG3 A 46 VAL HGx% 1.0 0.0 4.19 1985 1787 A 52 ILE HG2% A 56 MET HGy 1.0 0.0 4.40 1986 1788 A 57 GLY H A 57 GLY HAx 1.0 0.0 4.18 1987 1789 A 57 GLY HAy A 57 GLY HAx 1.0 0.0 3.29 1988 1790 A 57 GLY H A 57 GLY HAy 1.0 0.0 4.25 1989 1791 A 57 GLY HAy A 57 GLY HAx 1.0 0.0 3.33 1990 1792 A 58 PHE HA A 58 PHE HD% 1.0 0.0 4.55 1991 1793 A 58 PHE H A 58 PHE HBx 1.0 0.0 5.02 1992 1794 A 58 PHE HBx A 58 PHE HD% 1.0 0.0 5.35 1993 1795 A 58 PHE HA A 58 PHE HBx 1.0 0.0 5.47 1994 1796 A 53 THR HB A 58 PHE HBx 1.0 0.0 4.86 1995 1797 A 58 PHE HBy A 58 PHE HBx 1.0 0.0 3.81 1996 1798 A 58 PHE HBx A 61 VAL HB 1.0 0.0 5.42 1997 1799 A 53 THR HG2% A 58 PHE HBx 1.0 0.0 5.13 1998 1800 A 58 PHE HBx A 61 VAL HGy% 1.0 0.0 5.34 1999 1801 A 58 PHE H A 58 PHE HBy 1.0 0.0 4.96 2000 1802 A 58 PHE HBy A 58 PHE HD% 1.0 0.0 5.44 2001 1803 A 58 PHE HA A 58 PHE HBy 1.0 0.0 4.92 2002 1804 A 53 THR HB A 58 PHE HBy 1.0 0.0 4.77 2003 1805 A 58 PHE HBy A 58 PHE HBx 1.0 0.0 3.76 2004 1806 A 58 PHE HBy A 61 VAL HB 1.0 0.0 4.95 2005 1807 A 58 PHE HBy A 61 VAL HGy% 1.0 0.0 4.76 2006 1808 A 62 ALA HB% A 59 SER HA 1.0 0.0 3.96 2007 1809 A 60 SER HA A 60 SER HBy 1.0 0.0 3.32 2008 1810 A 22 VAL HGx% A 94 LEU HDx% 1.0 0.0 2.88 2009 1810 A 22 VAL HGx% A 94 LEU HDy% 1.0 0.0 2.88 2010 1811 A 53 THR H A 61 VAL HGx% 1.0 0.0 5.36 2011 1812 A 62 ALA H A 61 VAL HGx% 1.0 0.0 4.42 2012 1813 A 90 VAL H A 90 VAL HGy% 1.0 0.0 3.65 2013 1814 A 61 VAL H A 61 VAL HGx% 1.0 0.0 4.93 2014 1815 A 53 THR HB A 61 VAL HGx% 1.0 0.0 4.77 2015 1816 A 97 VAL HGy% A 94 LEU HA 1.0 0.0 3.86 2016 1817 A 61 VAL HA A 61 VAL HGx% 1.0 0.0 3.79 2017 1818 A 97 VAL HA A 97 VAL HGy% 1.0 0.0 3.62 2018 1819 A 90 VAL HB A 90 VAL HGy% 1.0 0.0 3.32 2019 1820 A 61 VAL HB A 61 VAL HGx% 1.0 0.0 3.54 2020 1821 A 53 THR HG2% A 61 VAL HGx% 1.0 0.0 3.55 2021 1822 A 61 VAL HB A 62 ALA HA 1.0 0.0 6.00 2022 1823 A 54 GLU H A 62 ALA HB% 1.0 0.0 4.55 2023 1824 A 62 ALA HB% A 62 ALA H 1.0 0.0 3.56 2024 1825 A 62 ALA HB% A 63 LYS H 1.0 0.0 4.12 2025 1826 A 62 ALA HB% A 61 VAL H 1.0 0.0 5.17 2026 1827 A 53 THR HB A 62 ALA HB% 1.0 0.0 4.65 2027 1828 A 62 ALA HB% A 62 ALA HA 1.0 0.0 3.26 2028 1829 A 62 ALA HB% A 50 LYS HA 1.0 0.0 4.76 2029 1830 A 54 GLU HGy A 62 ALA HB% 1.0 0.0 4.29 2030 1831 A 62 ALA HB% A 54 GLU HGx 1.0 0.0 3.92 2031 1832 A 53 THR HG2% A 62 ALA HB% 1.0 0.0 3.36 2032 1833 A 63 LYS H A 63 LYS HGy 1.0 0.0 4.88 2033 1834 A 63 LYS H A 63 LYS HGx 1.0 0.0 5.10 2034 1835 A 64 VAL HA A 67 THR H 1.0 0.0 5.03 2035 1836 A 64 VAL H A 64 VAL HA 1.0 0.0 4.24 2036 1837 A 64 VAL HA A 64 VAL HB 1.0 0.0 4.45 2037 1838 A 64 VAL HGx% A 64 VAL HA 1.0 0.0 3.82 2038 1839 A 64 VAL HA A 68 ILE HD1% 1.0 0.0 5.26 2039 1840 A 64 VAL HGx% A 65 LEU H 1.0 0.0 5.09 2040 1841 A 97 VAL HA A 64 VAL HGx% 1.0 0.0 6.00 2041 1842 A 64 VAL HGx% A 93 LYS HDx 1.0 0.0 3.84 2042 1842 A 64 VAL HGx% A 93 LYS HDy 1.0 0.0 3.84 2043 1843 A 64 VAL HGx% A 67 THR HG2% 1.0 0.0 5.18 2044 1844 A 65 LEU HA A 67 THR H 1.0 0.0 4.71 2045 1845 A 68 ILE HB A 65 LEU HA 1.0 0.0 4.47 2046 1846 A 65 LEU HA A 65 LEU HBx 1.0 0.0 4.57 2047 1847 A 65 LEU HA A 65 LEU HDy% 1.0 0.0 3.71 2048 1848 A 94 LEU HA A 94 LEU HDx% 1.0 0.0 4.02 2049 1848 A 94 LEU HA A 94 LEU HDy% 1.0 0.0 4.02 2050 1849 A 65 LEU H A 65 LEU HBx 1.0 0.0 5.31 2051 1850 A 65 LEU HA A 65 LEU HBx 1.0 0.0 4.94 2052 1851 A 65 LEU HBy A 65 LEU HBx 1.0 0.0 3.99 2053 1852 A 50 LYS HBx A 65 LEU HBx 1.0 0.0 5.33 2054 1853 A 65 LEU HBx A 65 LEU HDy% 1.0 0.0 4.59 2055 1854 A 65 LEU HG A 65 LEU HBx 1.0 0.0 4.53 2056 1855 A 65 LEU H A 65 LEU HBy 1.0 0.0 5.17 2057 1856 A 62 ALA HA A 65 LEU HBy 1.0 0.0 5.21 2058 1857 A 65 LEU HBy A 65 LEU HBx 1.0 0.0 4.04 2059 1858 A 65 LEU HBy A 65 LEU HDy% 1.0 0.0 4.64 2060 1859 A 65 LEU HG A 65 LEU HBy 1.0 0.0 4.94 2061 1860 A 50 LYS H A 65 LEU HG 1.0 0.0 5.15 2062 1861 A 65 LEU HG A 65 LEU H 1.0 0.0 4.48 2063 1862 A 101 LEU HBx A 101 LEU HG 1.0 0.0 3.61 2064 1863 A 111 VAL HA A 112 PRO HDy 1.0 0.0 3.53 2065 1864 A 111 VAL HA A 112 PRO HDx 1.0 0.0 3.70 2066 1865 A 66 HIS HA A 69 MET HB2 1.0 0.0 4.27 2067 1866 A 111 VAL HA A 111 VAL HGx% 1.0 0.0 3.72 2068 1866 A 111 VAL HA A 111 VAL HGy% 1.0 0.0 3.72 2069 1867 A 66 HIS H A 66 HIS HBx 1.0 0.0 4.03 2070 1868 A 67 THR H A 66 HIS HBx 1.0 0.0 4.96 2071 1869 A 66 HIS HA A 66 HIS HBx 1.0 0.0 4.23 2072 1870 A 63 LYS HA A 66 HIS HBx 1.0 0.0 4.44 2073 1871 A 66 HIS HBy A 66 HIS HBx 1.0 0.0 3.23 2074 1872 A 62 ALA HB% A 66 HIS HBx 1.0 0.0 4.91 2075 1873 A 66 HIS H A 66 HIS HBy 1.0 0.0 4.07 2076 1874 A 67 THR H A 66 HIS HBy 1.0 0.0 4.67 2077 1875 A 66 HIS HA A 66 HIS HBy 1.0 0.0 4.47 2078 1876 A 63 LYS HA A 66 HIS HBy 1.0 0.0 4.27 2079 1877 A 66 HIS HBy A 66 HIS HBx 1.0 0.0 3.24 2080 1878 A 67 THR H A 67 THR HB 1.0 0.0 3.92 2081 1879 A 67 THR HB A 67 THR HA 1.0 0.0 3.93 2082 1880 A 67 THR HB A 67 THR HG2% 1.0 0.0 3.57 2083 1881 A 67 THR H A 67 THR HA 1.0 0.0 4.13 2084 1882 A 67 THR HB A 67 THR HA 1.0 0.0 4.03 2085 1883 A 67 THR HA A 70 ASN HBx 1.0 0.0 3.97 2086 1883 A 67 THR HA A 70 ASN HBy 1.0 0.0 3.97 2087 1884 A 67 THR HA A 67 THR HG2% 1.0 0.0 3.76 2088 1885 A 67 THR H A 67 THR HG2% 1.0 0.0 3.88 2089 1886 A 67 THR HB A 67 THR HG2% 1.0 0.0 3.39 2090 1887 A 67 THR HA A 67 THR HG2% 1.0 0.0 3.73 2091 1888 A 64 VAL HA A 67 THR HG2% 1.0 0.0 4.36 2092 1889 A 66 HIS HBy A 67 THR HG2% 1.0 0.0 5.39 2093 1890 A 67 THR HG2% A 70 ASN HBx 1.0 0.0 5.14 2094 1890 A 67 THR HG2% A 70 ASN HBy 1.0 0.0 5.14 2095 1891 A 67 THR HG2% A 93 LYS HDx 1.0 0.0 4.94 2096 1891 A 67 THR HG2% A 93 LYS HDy 1.0 0.0 4.94 2097 1892 A 67 THR HG2% A 68 ILE HD1% 1.0 0.0 3.90 2098 1893 A 68 ILE HB A 69 MET H 1.0 0.0 4.86 2099 1894 A 68 ILE HB A 68 ILE H 1.0 0.0 4.63 2100 1895 A 68 ILE HB A 46 VAL HGx% 1.0 0.0 4.23 2101 1896 A 68 ILE H A 68 ILE HA 1.0 0.0 4.57 2102 1897 A 72 VAL HA A 75 MET H 1.0 0.0 4.52 2103 1898 A 68 ILE HA A 68 ILE HG1x 1.0 0.0 4.19 2104 1899 A 68 ILE HA A 71 LEU HB2 1.0 0.0 4.72 2105 1900 A 68 ILE HA A 68 ILE HG2% 1.0 0.0 3.68 2106 1901 A 68 ILE HA A 68 ILE HD1% 1.0 0.0 3.69 2107 1902 A 68 ILE HD1% A 94 LEU H 1.0 0.0 5.71 2108 1903 A 67 THR H A 68 ILE HD1% 1.0 0.0 4.63 2109 1904 A 65 LEU HA A 68 ILE HD1% 1.0 0.0 3.95 2110 1905 A 68 ILE HA A 68 ILE HD1% 1.0 0.0 4.73 2111 1906 A 68 ILE HB A 68 ILE HD1% 1.0 0.0 3.90 2112 1907 A 68 ILE HD1% A 93 LYS HBx 1.0 0.0 4.03 2113 1908 A 72 VAL H A 68 ILE HG2% 1.0 0.0 4.99 2114 1909 A 69 MET H A 68 ILE HG2% 1.0 0.0 5.07 2115 1910 A 30 GLU H A 87 ILE HG2% 1.0 0.0 4.89 2116 1911 A 39 TRP HZ2 A 82 ILE HG2% 1.0 0.0 4.12 2117 1912 A 87 ILE HG2% A 39 TRP HH2 1.0 0.0 4.79 2118 1913 A 68 ILE HA A 68 ILE HG2% 1.0 0.0 3.55 2119 1914 A 90 VAL HA A 68 ILE HG2% 1.0 0.0 5.22 2120 1915 A 82 ILE HG2% A 33 PRO HB3 1.0 0.0 4.19 2121 1916 A 87 ILE HG2% A 30 GLU HGx 1.0 0.0 3.22 2122 1917 A 82 ILE HG2% A 82 ILE HB 1.0 0.0 3.46 2123 1918 A 72 VAL HGy% A 68 ILE HG2% 1.0 0.0 3.90 2124 1919 A 70 ASN H A 69 MET HB2 1.0 0.0 4.98 2125 1920 A 69 MET HB2 A 43 TYR HE% 1.0 0.0 5.68 2126 1921 A 66 HIS HA A 69 MET HB2 1.0 0.0 4.74 2127 1922 A 69 MET HA A 69 MET HB2 1.0 0.0 5.13 2128 1923 A 69 MET HB3 A 69 MET HB2 1.0 0.0 3.49 2129 1924 A 69 MET HB2 A 69 MET HE% 1.0 0.0 5.33 2130 1925 A 96 MET HA A 96 MET HB3 1.0 0.0 4.31 2131 1926 A 96 MET HB3 A 96 MET HGy 1.0 0.0 3.74 2132 1927 A 96 MET HB3 A 96 MET HGx 1.0 0.0 3.59 2133 1928 A 47 HIS H A 69 MET HE% 1.0 0.0 5.22 2134 1929 A 69 MET HE% A 47 HIS HD2 1.0 0.0 3.90 2135 1930 A 43 TYR HE% A 69 MET HE% 1.0 0.0 4.25 2136 1931 A 47 HIS HA A 69 MET HE% 1.0 0.0 4.01 2137 1932 A 69 MET HA A 69 MET HE% 1.0 0.0 4.82 2138 1933 A 47 HIS HBx A 69 MET HE% 1.0 0.0 4.19 2139 1934 A 69 MET HB3 A 69 MET HE% 1.0 0.0 3.65 2140 1935 A 69 MET HB2 A 69 MET HE% 1.0 0.0 4.05 2141 1936 A 18 LEU HDx% A 49 MET HE% 1.0 0.0 3.21 2142 1937 A 70 ASN H A 69 MET HB3 1.0 0.0 5.34 2143 1938 A 69 MET HB3 A 43 TYR HE% 1.0 0.0 5.27 2144 1939 A 66 HIS HA A 69 MET HB3 1.0 0.0 5.56 2145 1940 A 69 MET HA A 69 MET HB3 1.0 0.0 4.73 2146 1941 A 69 MET HB3 A 69 MET HB2 1.0 0.0 3.47 2147 1942 A 69 MET HG2 A 70 ASN H 1.0 0.0 5.19 2148 1943 A 41 LYS HA A 41 LYS HBy 1.0 0.0 4.45 2149 1944 A 71 LEU H A 70 ASN HBx 1.0 0.0 4.28 2150 1944 A 70 ASN HBy A 71 LEU H 1.0 0.0 4.28 2151 1945 A 70 ASN HD2x A 70 ASN HBx 1.0 0.0 5.44 2152 1945 A 70 ASN HD2x A 70 ASN HBy 1.0 0.0 5.44 2153 1946 A 71 LEU HG A 70 ASN HBx 1.0 0.0 5.39 2154 1946 A 70 ASN HBy A 71 LEU HG 1.0 0.0 5.39 2155 1947 A 71 LEU H A 71 LEU HA 1.0 0.0 4.31 2156 1948 A 15 LEU HA A 15 LEU HB2 1.0 0.0 4.13 2157 1949 A 71 LEU H A 71 LEU HDy% 1.0 0.0 5.09 2158 1950 A 71 LEU HA A 71 LEU HDy% 1.0 0.0 3.71 2159 1951 A 71 LEU HDy% A 72 VAL HA 1.0 0.0 4.50 2160 1952 A 71 LEU HB3 A 71 LEU HDy% 1.0 0.0 4.64 2161 1953 A 71 LEU HG A 71 LEU HDy% 1.0 0.0 3.58 2162 1954 A 71 LEU HB2 A 71 LEU HDy% 1.0 0.0 3.68 2163 1955 A 72 VAL HGx% A 71 LEU HDy% 1.0 0.0 4.29 2164 1956 A 72 VAL H A 71 LEU HB2 1.0 0.0 4.71 2165 1957 A 71 LEU H A 71 LEU HB2 1.0 0.0 4.38 2166 1958 A 110 LEU HA A 110 LEU HBy 1.0 0.0 4.55 2167 1959 A 71 LEU HA A 71 LEU HB2 1.0 0.0 4.27 2168 1960 A 68 ILE HA A 71 LEU HB2 1.0 0.0 4.88 2169 1961 A 71 LEU HB3 A 71 LEU HB2 1.0 0.0 3.27 2170 1962 A 71 LEU HG A 71 LEU HB2 1.0 0.0 3.69 2171 1963 A 90 VAL HGy% A 71 LEU HB2 1.0 0.0 4.73 2172 1964 A 71 LEU HB2 A 71 LEU HDy% 1.0 0.0 3.69 2173 1965 A 72 VAL H A 71 LEU HB3 1.0 0.0 4.35 2174 1966 A 71 LEU H A 71 LEU HB3 1.0 0.0 4.19 2175 1967 A 76 LEU HBy A 73 ASP HA 1.0 0.0 4.80 2176 1968 A 71 LEU HA A 71 LEU HB3 1.0 0.0 4.15 2177 1969 A 86 LEU HBx A 86 LEU HBy 1.0 0.0 3.48 2178 1970 A 71 LEU HB3 A 71 LEU HG 1.0 0.0 3.87 2179 1971 A 86 LEU HBx A 86 LEU HBy 1.0 0.0 3.26 2180 1972 A 71 LEU HB3 A 71 LEU HB2 1.0 0.0 3.29 2181 1973 A 76 LEU HBy A 76 LEU HBx 1.0 0.0 3.47 2182 1974 A 22 VAL HGx% A 94 LEU HBy 1.0 0.0 4.76 2183 1975 A 94 LEU HBy A 94 LEU HDx% 1.0 0.0 3.71 2184 1975 A 94 LEU HBy A 94 LEU HDy% 1.0 0.0 3.71 2185 1976 A 68 ILE HA A 71 LEU HG 1.0 0.0 5.44 2186 1977 A 71 LEU HG A 71 LEU HB2 1.0 0.0 3.74 2187 1978 A 71 LEU HG A 71 LEU HDy% 1.0 0.0 4.10 2188 1979 A 73 ASP H A 72 VAL HGy% 1.0 0.0 5.05 2189 1980 A 72 VAL H A 72 VAL HGy% 1.0 0.0 3.60 2190 1981 A 71 LEU H A 72 VAL HGy% 1.0 0.0 4.27 2191 1982 A 72 VAL HGy% A 43 TYR HD% 1.0 0.0 5.09 2192 1983 A 72 VAL HA A 72 VAL HGy% 1.0 0.0 3.71 2193 1984 A 72 VAL HB A 72 VAL HGy% 1.0 0.0 3.57 2194 1985 A 72 VAL HGx% A 72 VAL HGy% 1.0 0.0 3.77 2195 1986 A 43 TYR H A 72 VAL HGx% 1.0 0.0 4.61 2196 1987 A 39 TRP HA A 72 VAL HGx% 1.0 0.0 5.19 2197 1988 A 72 VAL HGx% A 72 VAL HA 1.0 0.0 3.97 2198 1989 A 43 TYR HBy A 72 VAL HGx% 1.0 0.0 4.57 2199 1990 A 72 VAL HGx% A 72 VAL HB 1.0 0.0 3.69 2200 1991 A 81 LYS HGx A 81 LYS HDx 1.0 0.0 3.38 2201 1991 A 81 LYS HGx A 81 LYS HDy 1.0 0.0 3.38 2202 1992 A 73 ASP H A 72 VAL HB 1.0 0.0 4.72 2203 1993 A 72 VAL H A 72 VAL HB 1.0 0.0 4.04 2204 1994 A 72 VAL HB A 43 TYR HD% 1.0 0.0 4.38 2205 1995 A 72 VAL HGx% A 72 VAL HB 1.0 0.0 4.06 2206 1996 A 73 ASP H A 73 ASP HA 1.0 0.0 4.17 2207 1997 A 73 ASP HA A 73 ASP HBy 1.0 0.0 3.96 2208 1998 A 73 ASP HA A 73 ASP HBx 1.0 0.0 4.36 2209 1999 A 76 LEU HBy A 73 ASP HA 1.0 0.0 4.11 2210 2000 A 73 ASP H A 73 ASP HBx 1.0 0.0 4.04 2211 2001 A 74 LYS H A 73 ASP HBx 1.0 0.0 4.30 2212 2002 A 43 TYR HE% A 73 ASP HBx 1.0 0.0 4.89 2213 2003 A 70 ASN HA A 73 ASP HBx 1.0 0.0 4.28 2214 2004 A 73 ASP HA A 73 ASP HBx 1.0 0.0 4.25 2215 2005 A 73 ASP HBy A 73 ASP HBx 1.0 0.0 2.85 2216 2006 A 92 LYS HG3 A 93 LYS HA 1.0 0.0 4.21 2217 2007 A 92 LYS HG3 A 92 LYS HBy 1.0 0.0 3.64 2218 2008 A 104 LYS H A 104 LYS HBx 1.0 0.0 4.73 2219 2009 A 75 MET H A 74 LYS HBx 1.0 0.0 5.59 2220 2010 A 74 LYS H A 74 LYS HBx 1.0 0.0 4.79 2221 2011 A 104 LYS HBx A 104 LYS HA 1.0 0.0 4.25 2222 2012 A 74 LYS HBy A 74 LYS HBx 1.0 0.0 3.57 2223 2013 A 104 LYS HBy A 104 LYS HBx 1.0 0.0 3.24 2224 2014 A 64 VAL HGx% A 93 LYS HBx 1.0 0.0 4.79 2225 2015 A 104 LYS HBx A 104 LYS HGx 1.0 0.0 4.33 2226 2016 A 68 ILE HD1% A 93 LYS HBx 1.0 0.0 4.46 2227 2017 A 90 VAL H A 89 LYS HBy 1.0 0.0 5.09 2228 2018 A 89 LYS HBy A 89 LYS HBx 1.0 0.0 4.03 2229 2019 A 39 TRP HE1 A 75 MET HE% 1.0 0.0 5.26 2230 2020 A 72 VAL H A 75 MET HE% 1.0 0.0 4.92 2231 2021 A 39 TRP HZ2 A 75 MET HE% 1.0 0.0 4.84 2232 2022 A 75 MET HE% A 39 TRP HH2 1.0 0.0 3.94 2233 2023 A 71 LEU HA A 75 MET HE% 1.0 0.0 5.21 2234 2024 A 75 MET HA A 75 MET HE% 1.0 0.0 5.17 2235 2025 A 72 VAL HA A 75 MET HE% 1.0 0.0 3.93 2236 2026 A 75 MET HGy A 75 MET HE% 1.0 0.0 4.08 2237 2027 A 75 MET HE% A 36 MET HE% 1.0 0.0 4.75 2238 2028 A 75 MET HGx A 75 MET HE% 1.0 0.0 3.72 2239 2029 A 82 ILE HG2% A 75 MET HE% 1.0 0.0 3.08 2240 2030 A 71 LEU HDy% A 75 MET HE% 1.0 0.0 3.33 2241 2031 A 76 LEU H A 76 LEU HBx 1.0 0.0 4.86 2242 2032 A 77 ASN H A 76 LEU HBx 1.0 0.0 5.52 2243 2033 A 76 LEU HBx A 73 ASP HA 1.0 0.0 5.04 2244 2034 A 76 LEU HA A 76 LEU HBx 1.0 0.0 4.40 2245 2035 A 77 ASN HBx A 76 LEU HBx 1.0 0.0 4.53 2246 2036 A 102 ASP H A 101 LEU HBy 1.0 0.0 4.86 2247 2037 A 101 LEU HA A 101 LEU HBy 1.0 0.0 4.11 2248 2038 A 101 LEU HBx A 101 LEU HBy 1.0 0.0 3.34 2249 2039 A 111 VAL HA A 112 PRO HGx 1.0 0.0 5.53 2250 2040 A 112 PRO HDy A 112 PRO HGx 1.0 0.0 4.68 2251 2041 A 112 PRO HDx A 112 PRO HGx 1.0 0.0 5.00 2252 2042 A 112 PRO HBy A 112 PRO HGx 1.0 0.0 3.80 2253 2043 A 77 ASN HBx A 79 GLU HBx 1.0 0.0 5.19 2254 2044 A 77 ASN HBy A 77 ASN HD2x 1.0 0.0 5.27 2255 2045 A 40 ASN HBy A 41 LYS HGx 1.0 0.0 5.26 2256 2045 A 40 ASN HBy A 41 LYS HGy 1.0 0.0 5.26 2257 2046 A 80 ILE HA A 81 LYS H 1.0 0.0 3.88 2258 2047 A 78 SER H A 78 SER HA 1.0 0.0 3.60 2259 2048 A 78 SER HA A 78 SER HBx 1.0 0.0 3.61 2260 2048 A 78 SER HA A 78 SER HBy 1.0 0.0 3.61 2261 2049 A 80 ILE HB A 80 ILE HA 1.0 0.0 4.02 2262 2050 A 79 GLU H A 79 GLU HA 1.0 0.0 4.38 2263 2051 A 79 GLU HA A 79 GLU HBy 1.0 0.0 3.64 2264 2052 A 79 GLU HA A 79 GLU HBx 1.0 0.0 4.18 2265 2053 A 80 ILE H A 79 GLU HBx 1.0 0.0 5.38 2266 2054 A 79 GLU HBx A 79 GLU HBy 1.0 0.0 3.23 2267 2055 A 79 GLU HA A 79 GLU HGy 1.0 0.0 4.79 2268 2056 A 80 ILE H A 79 GLU HBy 1.0 0.0 5.59 2269 2057 A 79 GLU HGy A 79 GLU HBy 1.0 0.0 3.42 2270 2058 A 79 GLU HBx A 79 GLU HBy 1.0 0.0 3.18 2271 2059 A 94 LEU H A 94 LEU HBx 1.0 0.0 4.70 2272 2060 A 95 ASP H A 94 LEU HBx 1.0 0.0 5.15 2273 2061 A 80 ILE HB A 81 LYS H 1.0 0.0 4.68 2274 2062 A 80 ILE H A 80 ILE HB 1.0 0.0 4.79 2275 2063 A 80 ILE HB A 80 ILE HA 1.0 0.0 4.00 2276 2064 A 94 LEU HA A 94 LEU HBx 1.0 0.0 4.45 2277 2065 A 94 LEU HBy A 94 LEU HBx 1.0 0.0 3.35 2278 2066 A 80 ILE HB A 80 ILE HG1y 1.0 0.0 4.08 2279 2067 A 39 TRP HE1 A 82 ILE HD1% 1.0 0.0 4.41 2280 2068 A 82 ILE HD1% A 82 ILE H 1.0 0.0 4.68 2281 2069 A 34 GLU HA A 82 ILE HD1% 1.0 0.0 4.37 2282 2070 A 34 GLU HGy A 82 ILE HD1% 1.0 0.0 4.34 2283 2071 A 82 ILE HD1% A 82 ILE HB 1.0 0.0 3.67 2284 2072 A 80 ILE HG2% A 81 LYS H 1.0 0.0 5.18 2285 2073 A 75 MET H A 80 ILE HG2% 1.0 0.0 5.37 2286 2074 A 80 ILE H A 80 ILE HG2% 1.0 0.0 4.61 2287 2075 A 80 ILE HG2% A 80 ILE HA 1.0 0.0 4.05 2288 2076 A 74 LYS HA A 80 ILE HG2% 1.0 0.0 5.22 2289 2077 A 75 MET HA A 80 ILE HG2% 1.0 0.0 4.54 2290 2078 A 74 LYS HBy A 80 ILE HG2% 1.0 0.0 4.59 2291 2079 A 75 MET HGx A 80 ILE HG2% 1.0 0.0 4.45 2292 2080 A 80 ILE HB A 80 ILE HG2% 1.0 0.0 3.47 2293 2081 A 80 ILE HG1y A 80 ILE HG2% 1.0 0.0 5.06 2294 2082 A 79 GLU H A 80 ILE HG1x 1.0 0.0 5.26 2295 2083 A 80 ILE H A 80 ILE HG1x 1.0 0.0 4.85 2296 2084 A 18 LEU HDy% A 48 THR HA 1.0 0.0 4.39 2297 2085 A 79 GLU HBx A 80 ILE HG1x 1.0 0.0 6.00 2298 2086 A 80 ILE HG1x A 74 LYS HGx 1.0 0.0 4.72 2299 2086 A 80 ILE HG1x A 74 LYS HGy 1.0 0.0 4.72 2300 2087 A 22 VAL HGy% A 45 LEU HDx% 1.0 0.0 4.04 2301 2088 A 80 ILE HG1y A 81 LYS H 1.0 0.0 5.78 2302 2089 A 80 ILE H A 80 ILE HG1y 1.0 0.0 5.29 2303 2090 A 80 ILE HG1y A 80 ILE HA 1.0 0.0 4.56 2304 2091 A 75 MET HA A 80 ILE HG1y 1.0 0.0 5.70 2305 2092 A 80 ILE HG1y A 74 LYS HGx 1.0 0.0 4.42 2306 2092 A 80 ILE HG1y A 74 LYS HGy 1.0 0.0 4.42 2307 2093 A 80 ILE HG1y A 80 ILE HG1x 1.0 0.0 3.11 2308 2094 A 81 LYS HA A 82 ILE H 1.0 0.0 3.66 2309 2095 A 81 LYS HA A 81 LYS HBx 1.0 0.0 3.58 2310 2095 A 81 LYS HA A 81 LYS HBy 1.0 0.0 3.58 2311 2096 A 81 LYS HA A 81 LYS HGy 1.0 0.0 4.50 2312 2097 A 81 LYS H A 81 LYS HGy 1.0 0.0 5.20 2313 2098 A 81 LYS H A 81 LYS HGx 1.0 0.0 6.00 2314 2099 A 81 LYS HA A 81 LYS HGx 1.0 0.0 4.68 2315 2100 A 82 ILE H A 81 LYS HBx 1.0 0.0 4.75 2316 2100 A 81 LYS HBy A 82 ILE H 1.0 0.0 4.75 2317 2101 A 81 LYS H A 81 LYS HBx 1.0 0.0 4.18 2318 2101 A 81 LYS H A 81 LYS HBy 1.0 0.0 4.18 2319 2102 A 83 THR HA A 81 LYS HBx 1.0 0.0 5.59 2320 2102 A 81 LYS HBy A 83 THR HA 1.0 0.0 5.59 2321 2103 A 81 LYS HGy A 81 LYS HBx 1.0 0.0 3.81 2322 2103 A 81 LYS HBy A 81 LYS HGy 1.0 0.0 3.81 2323 2104 A 82 ILE H A 82 ILE HB 1.0 0.0 4.28 2324 2105 A 82 ILE HA A 82 ILE HB 1.0 0.0 5.25 2325 2106 A 82 ILE HG2% A 82 ILE HB 1.0 0.0 3.92 2326 2107 A 82 ILE HB A 82 ILE HG1x 1.0 0.0 4.19 2327 2108 A 82 ILE HA A 82 ILE HG1x 1.0 0.0 4.33 2328 2109 A 39 TRP HD1 A 82 ILE HD1% 1.0 0.0 4.93 2329 2110 A 39 TRP HE1 A 82 ILE HG2% 1.0 0.0 4.37 2330 2111 A 82 ILE HG2% A 82 ILE H 1.0 0.0 4.96 2331 2112 A 82 ILE HG2% A 83 THR H 1.0 0.0 4.70 2332 2113 A 33 PRO HA A 82 ILE HG2% 1.0 0.0 4.56 2333 2114 A 34 GLU HA A 82 ILE HG2% 1.0 0.0 5.26 2334 2115 A 82 ILE HG2% A 82 ILE HA 1.0 0.0 3.87 2335 2116 A 30 GLU HGy A 87 ILE HG2% 1.0 0.0 4.31 2336 2117 A 82 ILE HG2% A 82 ILE HD1% 1.0 0.0 3.09 2337 2118 A 29 VAL HGy% A 87 ILE HG2% 1.0 0.0 4.39 2338 2119 A 82 ILE H A 82 ILE HG1x 1.0 0.0 5.05 2339 2120 A 82 ILE HA A 82 ILE HG1x 1.0 0.0 5.31 2340 2121 A 82 ILE HG1x A 82 ILE HG1y 1.0 0.0 3.59 2341 2122 A 82 ILE HG2% A 82 ILE HG1x 1.0 0.0 5.11 2342 2123 A 82 ILE H A 82 ILE HG1y 1.0 0.0 4.52 2343 2124 A 96 MET HA A 99 ARG HGx 1.0 0.0 4.49 2344 2125 A 82 ILE HA A 82 ILE HG1y 1.0 0.0 4.93 2345 2126 A 99 ARG HGx A 99 ARG HGy 1.0 0.0 3.20 2346 2127 A 83 THR H A 83 THR HG2% 1.0 0.0 4.84 2347 2128 A 83 THR HG2% A 83 THR HB 1.0 0.0 3.55 2348 2129 A 88 ASP H A 85 ASP HBx 1.0 0.0 4.39 2349 2129 A 88 ASP H A 85 ASP HBy 1.0 0.0 4.39 2350 2130 A 102 ASP H A 102 ASP HBx 1.0 0.0 4.10 2351 2131 A 86 LEU H A 85 ASP HBx 1.0 0.0 4.39 2352 2131 A 86 LEU H A 85 ASP HBy 1.0 0.0 4.39 2353 2132 A 103 LYS H A 102 ASP HBx 1.0 0.0 4.78 2354 2133 A 99 ARG HA A 102 ASP HBx 1.0 0.0 4.27 2355 2134 A 89 LYS H A 86 LEU HA 1.0 0.0 4.54 2356 2135 A 86 LEU H A 86 LEU HA 1.0 0.0 4.57 2357 2136 A 86 LEU HDy% A 86 LEU HA 1.0 0.0 4.25 2358 2137 A 86 LEU HBx A 87 ILE H 1.0 0.0 5.01 2359 2138 A 86 LEU HBx A 86 LEU H 1.0 0.0 4.50 2360 2139 A 83 THR H A 86 LEU HBx 1.0 0.0 5.04 2361 2140 A 86 LEU HBx A 86 LEU HA 1.0 0.0 4.33 2362 2141 A 86 LEU HBx A 75 MET HE% 1.0 0.0 5.01 2363 2142 A 86 LEU HBx A 86 LEU HDx% 1.0 0.0 4.62 2364 2143 A 86 LEU HBx A 86 LEU HDy% 1.0 0.0 4.42 2365 2144 A 83 THR H A 86 LEU HDy% 1.0 0.0 5.35 2366 2145 A 86 LEU HDy% A 86 LEU HA 1.0 0.0 4.25 2367 2146 A 86 LEU HDy% A 86 LEU HG 1.0 0.0 3.95 2368 2147 A 90 VAL HGy% A 86 LEU HDy% 1.0 0.0 4.94 2369 2148 A 65 LEU HG A 61 VAL HGx% 1.0 0.0 3.94 2370 2149 A 87 ILE H A 86 LEU HBy 1.0 0.0 5.03 2371 2150 A 86 LEU H A 86 LEU HBy 1.0 0.0 4.54 2372 2151 A 83 THR H A 86 LEU HBy 1.0 0.0 4.94 2373 2152 A 86 LEU HA A 86 LEU HBy 1.0 0.0 4.28 2374 2153 A 86 LEU HBy A 86 LEU HDx% 1.0 0.0 4.34 2375 2154 A 86 LEU HDy% A 86 LEU HBy 1.0 0.0 4.22 2376 2155 A 86 LEU H A 86 LEU HG 1.0 0.0 5.18 2377 2156 A 75 MET HE% A 86 LEU HG 1.0 0.0 4.61 2378 2157 A 90 VAL H A 87 ILE HA 1.0 0.0 4.90 2379 2158 A 87 ILE H A 87 ILE HA 1.0 0.0 4.70 2380 2159 A 87 ILE HA A 39 TRP HH2 1.0 0.0 4.73 2381 2160 A 90 VAL HB A 87 ILE HA 1.0 0.0 4.47 2382 2161 A 87 ILE H A 87 ILE HD1% 1.0 0.0 4.78 2383 2162 A 39 TRP HZ2 A 87 ILE HD1% 1.0 0.0 4.14 2384 2163 A 39 TRP HH2 A 87 ILE HD1% 1.0 0.0 4.91 2385 2164 A 33 PRO HA A 87 ILE HD1% 1.0 0.0 4.56 2386 2165 A 30 GLU HA A 87 ILE HD1% 1.0 0.0 4.11 2387 2166 A 87 ILE HA A 87 ILE HD1% 1.0 0.0 4.46 2388 2167 A 30 GLU HGy A 87 ILE HD1% 1.0 0.0 5.36 2389 2168 A 33 PRO HB3 A 87 ILE HD1% 1.0 0.0 4.16 2390 2169 A 87 ILE HD1% A 87 ILE HG1x 1.0 0.0 3.25 2391 2169 A 87 ILE HG1y A 87 ILE HD1% 1.0 0.0 3.25 2392 2170 A 29 VAL HGx% A 87 ILE HD1% 1.0 0.0 4.02 2393 2171 A 88 ASP H A 87 ILE HG2% 1.0 0.0 4.88 2394 2172 A 87 ILE H A 87 ILE HG2% 1.0 0.0 4.78 2395 2173 A 87 ILE HG2% A 88 ASP HA 1.0 0.0 5.09 2396 2174 A 43 TYR HBx A 44 ARG HBx 1.0 0.0 5.28 2397 2174 A 43 TYR HBx A 44 ARG HBy 1.0 0.0 5.28 2398 2175 A 95 ASP H A 95 ASP HB3 1.0 0.0 4.08 2399 2176 A 88 ASP H A 88 ASP HBx 1.0 0.0 3.94 2400 2177 A 102 ASP H A 102 ASP HBy 1.0 0.0 4.03 2401 2178 A 92 LYS HA A 95 ASP HB3 1.0 0.0 3.98 2402 2179 A 92 LYS HG3 A 95 ASP HB3 1.0 0.0 5.12 2403 2180 A 95 ASP H A 95 ASP HB2 1.0 0.0 4.01 2404 2181 A 88 ASP H A 88 ASP HBy 1.0 0.0 3.83 2405 2182 A 89 LYS H A 88 ASP HBy 1.0 0.0 4.42 2406 2183 A 96 MET H A 95 ASP HB2 1.0 0.0 4.56 2407 2184 A 88 ASP HA A 88 ASP HBy 1.0 0.0 3.51 2408 2185 A 92 LYS HA A 95 ASP HB2 1.0 0.0 4.21 2409 2186 A 10 LYS HDy A 10 LYS HGx 1.0 0.0 2.90 2410 2186 A 10 LYS HGy A 10 LYS HDy 1.0 0.0 2.90 2411 2187 A 92 LYS H A 90 VAL HA 1.0 0.0 5.12 2412 2188 A 90 VAL H A 90 VAL HA 1.0 0.0 4.35 2413 2189 A 90 VAL HA A 90 VAL HB 1.0 0.0 4.59 2414 2190 A 90 VAL HA A 93 LYS HBy 1.0 0.0 4.45 2415 2191 A 90 VAL HA A 93 LYS HBx 1.0 0.0 4.69 2416 2192 A 90 VAL HA A 90 VAL HGy% 1.0 0.0 3.77 2417 2193 A 90 VAL HA A 90 VAL HGx% 1.0 0.0 3.86 2418 2194 A 90 VAL HA A 68 ILE HD1% 1.0 0.0 4.35 2419 2195 A 90 VAL H A 90 VAL HGx% 1.0 0.0 4.50 2420 2196 A 90 VAL HGx% A 39 TRP HH2 1.0 0.0 4.75 2421 2197 A 90 VAL HA A 90 VAL HGx% 1.0 0.0 3.83 2422 2198 A 90 VAL HB A 90 VAL HGx% 1.0 0.0 3.59 2423 2199 A 90 VAL HGx% A 26 ILE HD1% 1.0 0.0 3.83 2424 2200 A 90 VAL HGy% A 91 LYS H 1.0 0.0 4.87 2425 2201 A 90 VAL HGy% A 39 TRP HH2 1.0 0.0 4.21 2426 2202 A 90 VAL HA A 90 VAL HGy% 1.0 0.0 3.55 2427 2203 A 97 VAL HGy% A 94 LEU HBy 1.0 0.0 4.16 2428 2204 A 90 VAL HB A 91 LYS H 1.0 0.0 4.34 2429 2205 A 90 VAL H A 90 VAL HB 1.0 0.0 4.09 2430 2206 A 97 VAL HB A 94 LEU HA 1.0 0.0 4.23 2431 2207 A 90 VAL HB A 87 ILE HA 1.0 0.0 4.41 2432 2208 A 90 VAL HA A 90 VAL HB 1.0 0.0 4.85 2433 2209 A 90 VAL HB A 90 VAL HGy% 1.0 0.0 3.45 2434 2210 A 90 VAL HB A 90 VAL HGx% 1.0 0.0 3.59 2435 2211 A 91 LYS H A 91 LYS HA 1.0 0.0 4.39 2436 2212 A 92 LYS H A 91 LYS HA 1.0 0.0 4.87 2437 2213 A 91 LYS HA A 91 LYS HGx 1.0 0.0 4.25 2438 2213 A 91 LYS HA A 91 LYS HGy 1.0 0.0 4.25 2439 2214 A 91 LYS HA A 90 VAL HGx% 1.0 0.0 4.72 2440 2215 A 26 ILE HG2% A 91 LYS HA 1.0 0.0 4.97 2441 2216 A 91 LYS HDx A 91 LYS HGx 1.0 0.0 3.39 2442 2216 A 91 LYS HDy A 91 LYS HGx 1.0 0.0 3.39 2443 2216 A 91 LYS HGy A 91 LYS HDx 1.0 0.0 3.39 2444 2216 A 91 LYS HGy A 91 LYS HDy 1.0 0.0 3.39 2445 2217 A 26 ILE HD1% A 91 LYS HGx 1.0 0.0 5.27 2446 2217 A 91 LYS HGy A 26 ILE HD1% 1.0 0.0 5.27 2447 2218 A 92 LYS HG3 A 95 ASP HB2 1.0 0.0 4.76 2448 2219 A 92 LYS H A 92 LYS HG2 1.0 0.0 4.92 2449 2220 A 92 LYS HA A 92 LYS HG2 1.0 0.0 4.40 2450 2221 A 92 LYS HBy A 92 LYS HG2 1.0 0.0 5.04 2451 2222 A 64 VAL H A 63 LYS HDx 1.0 0.0 5.13 2452 2222 A 64 VAL H A 63 LYS HDy 1.0 0.0 5.13 2453 2223 A 93 LYS HBx A 93 LYS HA 1.0 0.0 3.73 2454 2224 A 10 LYS HEy A 10 LYS HDx 1.0 0.0 3.64 2455 2225 A 93 LYS H A 93 LYS HBx 1.0 0.0 5.13 2456 2226 A 93 LYS HBx A 93 LYS HA 1.0 0.0 4.75 2457 2227 A 93 LYS HBy A 93 LYS HBx 1.0 0.0 4.03 2458 2228 A 97 VAL HB A 94 LEU HA 1.0 0.0 4.16 2459 2229 A 94 LEU HBy A 94 LEU HA 1.0 0.0 4.23 2460 2230 A 94 LEU HA A 94 LEU HBx 1.0 0.0 4.39 2461 2231 A 97 VAL HGy% A 94 LEU HA 1.0 0.0 4.47 2462 2232 A 80 ILE HB A 80 ILE HD1% 1.0 0.0 3.66 2463 2233 A 94 LEU HBy A 94 LEU H 1.0 0.0 3.92 2464 2234 A 94 LEU HBy A 94 LEU HBx 1.0 0.0 3.33 2465 2235 A 88 ASP HBx A 91 LYS HB2 1.0 0.0 5.12 2466 2236 A 97 VAL H A 96 MET HGy 1.0 0.0 5.49 2467 2237 A 96 MET H A 96 MET HGy 1.0 0.0 4.50 2468 2238 A 96 MET HA A 96 MET HGy 1.0 0.0 4.43 2469 2239 A 96 MET HGx A 96 MET HGy 1.0 0.0 2.99 2470 2240 A 96 MET HB3 A 96 MET HGy 1.0 0.0 3.39 2471 2241 A 97 VAL HGy% A 96 MET HGy 1.0 0.0 5.36 2472 2242 A 97 VAL H A 96 MET HB3 1.0 0.0 5.44 2473 2243 A 96 MET H A 96 MET HB3 1.0 0.0 4.43 2474 2244 A 97 VAL H A 96 MET HGx 1.0 0.0 5.23 2475 2245 A 96 MET H A 96 MET HGx 1.0 0.0 4.64 2476 2246 A 96 MET HA A 96 MET HGx 1.0 0.0 4.34 2477 2247 A 96 MET HGx A 96 MET HGy 1.0 0.0 2.96 2478 2248 A 96 MET HB3 A 96 MET HGx 1.0 0.0 3.30 2479 2249 A 97 VAL HGy% A 96 MET HGx 1.0 0.0 5.06 2480 2250 A 64 VAL HGx% A 96 MET HGx 1.0 0.0 5.17 2481 2251 A 97 VAL HA A 101 LEU H 1.0 0.0 5.24 2482 2252 A 97 VAL H A 97 VAL HA 1.0 0.0 4.23 2483 2253 A 97 VAL HA A 97 VAL HB 1.0 0.0 4.55 2484 2254 A 97 VAL HA A 100 GLU HBy 1.0 0.0 4.73 2485 2255 A 97 VAL HA A 97 VAL HGy% 1.0 0.0 3.71 2486 2256 A 97 VAL HA A 97 VAL HGx% 1.0 0.0 3.90 2487 2257 A 97 VAL HGx% A 101 LEU H 1.0 0.0 5.56 2488 2258 A 97 VAL HGx% A 98 THR H 1.0 0.0 4.90 2489 2259 A 97 VAL H A 97 VAL HGx% 1.0 0.0 4.72 2490 2260 A 97 VAL HGx% A 98 THR HA 1.0 0.0 5.13 2491 2261 A 97 VAL HA A 97 VAL HGx% 1.0 0.0 3.89 2492 2262 A 97 VAL HB A 97 VAL HGx% 1.0 0.0 3.57 2493 2263 A 97 VAL HGx% A 19 ILE HG13 1.0 0.0 3.74 2494 2264 A 97 VAL HGy% A 97 VAL HGx% 1.0 0.0 3.32 2495 2265 A 101 LEU H A 98 THR HA 1.0 0.0 5.01 2496 2266 A 98 THR H A 98 THR HA 1.0 0.0 4.50 2497 2267 A 98 THR HA A 98 THR HG2% 1.0 0.0 4.06 2498 2268 A 98 THR HA A 19 ILE HD1% 1.0 0.0 4.13 2499 2269 A 98 THR H A 98 THR HG2% 1.0 0.0 4.47 2500 2270 A 98 THR HG2% A 99 ARG HA 1.0 0.0 4.64 2501 2271 A 44 ARG HA A 44 ARG HGx 1.0 0.0 6.00 2502 2272 A 99 ARG H A 99 ARG HGx 1.0 0.0 5.53 2503 2273 A 81 LYS HDx A 81 LYS HEx 1.0 0.0 4.27 2504 2273 A 81 LYS HDy A 81 LYS HEx 1.0 0.0 4.27 2505 2273 A 81 LYS HEy A 81 LYS HDx 1.0 0.0 4.27 2506 2273 A 81 LYS HDy A 81 LYS HEy 1.0 0.0 4.27 2507 2274 A 99 ARG HBx A 99 ARG HDx 1.0 0.0 5.44 2508 2275 A 100 GLU H A 100 GLU HBx 1.0 0.0 4.50 2509 2276 A 99 ARG H A 99 ARG HBy 1.0 0.0 4.62 2510 2277 A 96 MET HA A 99 ARG HBy 1.0 0.0 4.24 2511 2278 A 99 ARG HBy A 99 ARG HDx 1.0 0.0 5.11 2512 2279 A 99 ARG HBy A 99 ARG HGx 1.0 0.0 4.40 2513 2280 A 99 ARG HGy A 99 ARG HDx 1.0 0.0 4.05 2514 2281 A 99 ARG HGx A 99 ARG HDx 1.0 0.0 3.86 2515 2282 A 97 VAL HA A 100 GLU HBx 1.0 0.0 4.92 2516 2283 A 30 GLU HBy A 31 LYS HGx 1.0 0.0 5.32 2517 2283 A 30 GLU HBy A 31 LYS HGy 1.0 0.0 5.32 2518 2284 A 101 LEU H A 101 LEU HA 1.0 0.0 4.75 2519 2285 A 101 LEU HA A 101 LEU HBy 1.0 0.0 4.33 2520 2286 A 101 LEU HBx A 101 LEU HA 1.0 0.0 4.42 2521 2287 A 101 LEU HA A 104 LYS HGy 1.0 0.0 5.01 2522 2288 A 101 LEU HA A 101 LEU HG 1.0 0.0 3.72 2523 2289 A 101 LEU H A 101 LEU HBx 1.0 0.0 4.64 2524 2290 A 102 ASP H A 101 LEU HBx 1.0 0.0 5.32 2525 2291 A 101 LEU HBx A 101 LEU HA 1.0 0.0 4.38 2526 2292 A 98 THR HA A 101 LEU HBx 1.0 0.0 5.19 2527 2293 A 101 LEU HBx A 101 LEU HBy 1.0 0.0 3.26 2528 2294 A 98 THR HG2% A 101 LEU HBx 1.0 0.0 4.94 2529 2295 A 101 LEU HBx A 101 LEU HG 1.0 0.0 3.87 2530 2296 A 102 ASP H A 102 ASP HA 1.0 0.0 4.01 2531 2297 A 104 LYS HDy A 104 LYS HEy 1.0 0.0 3.93 2532 2298 A 104 LYS HGx A 104 LYS HEy 1.0 0.0 4.42 2533 2299 A 104 LYS H A 104 LYS HA 1.0 0.0 4.43 2534 2300 A 104 LYS HBy A 104 LYS HA 1.0 0.0 4.33 2535 2301 A 104 LYS HBx A 104 LYS HA 1.0 0.0 4.61 2536 2302 A 104 LYS HGy A 104 LYS HA 1.0 0.0 4.00 2537 2303 A 104 LYS HEy A 104 LYS HEx 1.0 0.0 2.82 2538 2304 A 104 LYS HEy A 101 LEU HDx% 1.0 0.0 5.07 2539 2304 A 101 LEU HDy% A 104 LYS HEy 1.0 0.0 5.07 2540 2305 A 104 LYS HEy A 104 LYS HEx 1.0 0.0 2.81 2541 2306 A 104 LYS HGy A 104 LYS HEx 1.0 0.0 4.08 2542 2307 A 104 LYS HGx A 104 LYS HEx 1.0 0.0 4.37 2543 2308 A 104 LYS HEx A 101 LEU HDx% 1.0 0.0 5.05 2544 2308 A 101 LEU HDy% A 104 LYS HEx 1.0 0.0 5.05 2545 2309 A 101 LEU HA A 104 LYS HBx 1.0 0.0 5.14 2546 2310 A 104 LYS HGy A 104 LYS HBx 1.0 0.0 4.19 2547 2311 A 104 LYS HBy A 104 LYS HBx 1.0 0.0 3.16 2548 2312 A 105 VAL HA A 106 SER H 1.0 0.0 4.60 2549 2313 A 105 VAL H A 105 VAL HA 1.0 0.0 4.48 2550 2314 A 105 VAL HA A 105 VAL HB 1.0 0.0 4.17 2551 2315 A 112 PRO HBx A 112 PRO HBy 1.0 0.0 3.00 2552 2316 A 106 SER HA A 106 SER HBx 1.0 0.0 3.39 2553 2316 A 106 SER HA A 106 SER HBy 1.0 0.0 3.39 2554 2317 A 106 SER H A 106 SER HBx 1.0 0.0 4.46 2555 2317 A 106 SER H A 106 SER HBy 1.0 0.0 4.46 2556 2318 A 106 SER HA A 106 SER HBx 1.0 0.0 3.75 2557 2318 A 106 SER HA A 106 SER HBy 1.0 0.0 3.75 2558 2319 A 108 SER HA A 108 SER HBx 1.0 0.0 3.50 2559 2319 A 108 SER HA A 108 SER HBy 1.0 0.0 3.50 2560 2320 A 109 TYR H A 109 TYR HBy 1.0 0.0 4.99 2561 2321 A 110 LEU HA A 110 LEU HBx 1.0 0.0 3.95 2562 2322 A 110 LEU HA A 110 LEU HG 1.0 0.0 3.99 2563 2323 A 110 LEU H A 110 LEU HBx 1.0 0.0 5.04 2564 2324 A 110 LEU HA A 110 LEU HBx 1.0 0.0 4.57 2565 2325 A 112 PRO HA A 113 ARG H 1.0 0.0 3.72 2566 2326 A 112 PRO HA A 112 PRO HBy 1.0 0.0 3.94 2567 2327 A 91 LYS H A 91 LYS HB2 1.0 0.0 4.70 2568 2328 A 112 PRO HBy A 112 PRO HGy 1.0 0.0 4.27 2569 2329 A 111 VAL HA A 112 PRO HDy 1.0 0.0 3.67 2570 2330 A 112 PRO HDy A 112 PRO HDx 1.0 0.0 2.83 2571 2331 A 111 VAL HB A 112 PRO HDy 1.0 0.0 4.46 2572 2332 A 112 PRO HDy A 112 PRO HGx 1.0 0.0 4.20 2573 2333 A 111 VAL HA A 112 PRO HDx 1.0 0.0 3.84 2574 2334 A 112 PRO HDy A 112 PRO HDx 1.0 0.0 2.85 2575 2335 A 111 VAL HB A 112 PRO HDx 1.0 0.0 4.16 2576 2336 A 112 PRO HDx A 111 VAL HGx% 1.0 0.0 5.02 2577 2336 A 112 PRO HDx A 111 VAL HGy% 1.0 0.0 5.02 2578 2337 A 113 ARG HA A 113 ARG HGx 1.0 0.0 5.12 2579 2337 A 113 ARG HA A 113 ARG HGy 1.0 0.0 5.12 2580 2338 A 113 ARG HDx A 113 ARG HGx 1.0 0.0 4.47 2581 2338 A 113 ARG HDy A 113 ARG HGx 1.0 0.0 4.47 2582 2338 A 113 ARG HGy A 113 ARG HDx 1.0 0.0 4.47 2583 2338 A 113 ARG HGy A 113 ARG HDy 1.0 0.0 4.47 2584 2339 A 5 GLN HA A 5 GLN HGy 1.0 0.0 4.60 2585 2340 A 5 GLN HA A 5 GLN HGx 1.0 0.0 6.00 2586 2341 A 6 GLU H A 6 GLU HGy 1.0 0.0 5.65 2587 2342 A 6 GLU H A 6 GLU HGx 1.0 0.0 5.27 2588 2343 A 7 TYR HA A 7 TYR HD% 1.0 0.0 4.59 2589 2344 A 7 TYR HA A 7 TYR HE% 1.0 0.0 4.75 2590 2345 A 7 TYR HA A 7 TYR HB2 1.0 0.0 4.48 2591 2346 A 7 TYR HA A 7 TYR HB3 1.0 0.0 4.49 2592 2347 A 7 TYR HA A 10 LYS HBx 1.0 0.0 4.33 2593 2347 A 7 TYR HA A 10 LYS HBy 1.0 0.0 4.33 2594 2348 A 7 TYR H A 7 TYR HA 1.0 0.0 4.72 2595 2349 A 8 ILE HA A 7 TYR HD% 1.0 0.0 5.58 2596 2350 A 8 ILE HB A 9 LYS H 1.0 0.0 4.85 2597 2351 A 8 ILE HB A 8 ILE HD1% 1.0 0.0 5.72 2598 2352 A 5 GLN HA A 8 ILE HG1y 1.0 0.0 5.96 2599 2353 A 5 GLN HA A 8 ILE HG1x 1.0 0.0 6.00 2600 2354 A 8 ILE HG2% A 9 LYS HA 1.0 0.0 5.15 2601 2355 A 10 LYS H A 9 LYS HA 1.0 0.0 5.17 2602 2356 A 9 LYS H A 9 LYS HA 1.0 0.0 5.29 2603 2357 A 9 LYS HA A 12 THR H 1.0 0.0 5.19 2604 2358 A 48 THR HB A 48 THR HA 1.0 0.0 5.15 2605 2359 A 13 ASP HBy A 13 ASP HBx 1.0 0.0 3.60 2606 2360 A 13 ASP H A 13 ASP HBy 1.0 0.0 4.56 2607 2361 A 14 GLU HGy A 11 VAL HGx% 1.0 0.0 5.51 2608 2361 A 11 VAL HGy% A 14 GLU HGy 1.0 0.0 5.51 2609 2362 A 13 ASP HBy A 14 GLU HGx 1.0 0.0 6.00 2610 2363 A 15 LEU HB3 A 11 VAL HGx% 1.0 0.0 5.37 2611 2363 A 11 VAL HGy% A 15 LEU HB3 1.0 0.0 5.37 2612 2364 A 15 LEU HB3 A 16 LYS HEx 1.0 0.0 4.24 2613 2364 A 16 LYS HEy A 15 LEU HB3 1.0 0.0 4.24 2614 2365 A 16 LYS H A 15 LEU HB3 1.0 0.0 5.11 2615 2366 A 15 LEU HB2 A 16 LYS H 1.0 0.0 5.27 2616 2367 A 15 LEU HB2 A 15 LEU HDy% 1.0 0.0 4.51 2617 2368 A 15 LEU HB3 A 15 LEU HG 1.0 0.0 5.63 2618 2369 A 16 LYS HA A 17 GLU H 1.0 0.0 5.61 2619 2370 A 16 LYS HA A 16 LYS HEx 1.0 0.0 5.70 2620 2370 A 16 LYS HA A 16 LYS HEy 1.0 0.0 5.70 2621 2371 A 16 LYS HA A 16 LYS HBy 1.0 0.0 4.31 2622 2372 A 16 LYS HA A 18 LEU HB2 1.0 0.0 5.68 2623 2373 A 16 LYS HA A 19 ILE HG2% 1.0 0.0 5.19 2624 2374 A 44 ARG HA A 43 TYR HD% 1.0 0.0 4.94 2625 2375 A 17 GLU H A 17 GLU HGx 1.0 0.0 5.00 2626 2376 A 18 LEU HDy% A 18 LEU HA 1.0 0.0 4.18 2627 2377 A 18 LEU HA A 18 LEU HB3 1.0 0.0 3.52 2628 2378 A 22 VAL H A 19 ILE HA 1.0 0.0 5.34 2629 2379 A 19 ILE HD1% A 16 LYS HGx 1.0 0.0 5.27 2630 2380 A 97 VAL HB A 19 ILE HD1% 1.0 0.0 6.00 2631 2381 A 18 LEU H A 19 ILE HG13 1.0 0.0 4.91 2632 2382 A 19 ILE HB A 19 ILE HG12 1.0 0.0 3.80 2633 2383 A 19 ILE HG2% A 98 THR H 1.0 0.0 5.79 2634 2384 A 19 ILE HG2% A 20 GLN HBx 1.0 0.0 5.65 2635 2384 A 20 GLN HBy A 19 ILE HG2% 1.0 0.0 5.65 2636 2385 A 5 GLN HA A 8 ILE HG2% 1.0 0.0 5.41 2637 2386 A 20 GLN HA A 24 ASP H 1.0 0.0 4.78 2638 2387 A 21 ASN HA A 20 GLN HBx 1.0 0.0 5.75 2639 2387 A 21 ASN HA A 20 GLN HBy 1.0 0.0 5.75 2640 2388 A 20 GLN H A 20 GLN HGx 1.0 0.0 4.46 2641 2388 A 20 GLN H A 20 GLN HGy 1.0 0.0 4.46 2642 2389 A 21 ASN HA A 20 GLN HBx 1.0 0.0 5.56 2643 2389 A 21 ASN HA A 20 GLN HBy 1.0 0.0 5.56 2644 2390 A 21 ASN HA A 20 GLN HGx 1.0 0.0 6.00 2645 2390 A 21 ASN HA A 20 GLN HGy 1.0 0.0 6.00 2646 2391 A 21 ASN HA A 45 LEU HDx% 1.0 0.0 5.22 2647 2392 A 21 ASN HA A 21 ASN HD2y 1.0 0.0 5.44 2648 2393 A 22 VAL HA A 25 ASP H 1.0 0.0 5.87 2649 2394 A 22 VAL HA A 22 VAL HB 1.0 0.0 4.68 2650 2395 A 22 VAL HB A 22 VAL HGy% 1.0 0.0 4.19 2651 2396 A 22 VAL HB A 94 LEU HDx% 1.0 0.0 4.97 2652 2396 A 22 VAL HB A 94 LEU HDy% 1.0 0.0 4.97 2653 2397 A 22 VAL HB A 22 VAL HGx% 1.0 0.0 3.79 2654 2398 A 22 VAL HGy% A 94 LEU HDx% 1.0 0.0 3.97 2655 2398 A 22 VAL HGy% A 94 LEU HDy% 1.0 0.0 3.97 2656 2399 A 22 VAL HGy% A 26 ILE HD1% 1.0 0.0 4.43 2657 2400 A 23 ASN HB2 A 20 GLN HBx 1.0 0.0 5.48 2658 2400 A 20 GLN HBy A 23 ASN HB2 1.0 0.0 5.48 2659 2401 A 24 ASP HBx A 20 GLN HGx 1.0 0.0 5.57 2660 2401 A 20 GLN HGy A 24 ASP HBx 1.0 0.0 5.57 2661 2402 A 29 VAL HGy% A 25 ASP HA 1.0 0.0 4.85 2662 2403 A 25 ASP HA A 28 GLU HBx 1.0 0.0 5.55 2663 2403 A 25 ASP HA A 28 GLU HBy 1.0 0.0 5.55 2664 2404 A 25 ASP H A 25 ASP HA 1.0 0.0 5.21 2665 2405 A 26 ILE H A 25 ASP HA 1.0 0.0 5.47 2666 2406 A 25 ASP HB2 A 24 ASP HBx 1.0 0.0 5.50 2667 2407 A 26 ILE HB A 29 VAL HGy% 1.0 0.0 5.56 2668 2408 A 26 ILE HG2% A 30 GLU H 1.0 0.0 5.74 2669 2409 A 26 ILE HG2% A 30 GLU HA 1.0 0.0 6.00 2670 2410 A 26 ILE HG1x A 26 ILE HG2% 1.0 0.0 4.12 2671 2411 A 26 ILE HG2% A 27 LYS HA 1.0 0.0 5.63 2672 2412 A 29 VAL HGy% A 28 GLU HA 1.0 0.0 5.49 2673 2413 A 29 VAL HA A 28 GLU HBx 1.0 0.0 5.75 2674 2413 A 28 GLU HBy A 29 VAL HA 1.0 0.0 5.75 2675 2414 A 29 VAL HGy% A 28 GLU HBx 1.0 0.0 5.67 2676 2414 A 29 VAL HGy% A 28 GLU HBy 1.0 0.0 5.67 2677 2415 A 28 GLU HA A 28 GLU HGy 1.0 0.0 5.82 2678 2416 A 29 VAL HA A 33 PRO HA 1.0 0.0 3.86 2679 2417 A 29 VAL HA A 31 LYS H 1.0 0.0 6.00 2680 2418 A 30 GLU H A 29 VAL HA 1.0 0.0 5.10 2681 2419 A 29 VAL HGy% A 39 TRP HA 1.0 0.0 4.29 2682 2420 A 29 VAL HGx% A 33 PRO HA 1.0 0.0 4.86 2683 2421 A 29 VAL HGx% A 30 GLU HA 1.0 0.0 5.18 2684 2422 A 30 GLU HGx A 91 LYS HGx 1.0 0.0 5.45 2685 2422 A 91 LYS HGy A 30 GLU HGx 1.0 0.0 5.45 2686 2423 A 32 ASN H A 31 LYS HBy 1.0 0.0 5.19 2687 2424 A 32 ASN H A 31 LYS HBx 1.0 0.0 5.39 2688 2425 A 31 LYS HA A 31 LYS HBx 1.0 0.0 4.48 2689 2426 A 31 LYS HA A 31 LYS HBy 1.0 0.0 4.26 2690 2427 A 32 ASN HBx A 32 ASN HA 1.0 0.0 4.41 2691 2428 A 32 ASN HBy A 32 ASN HA 1.0 0.0 5.05 2692 2429 A 32 ASN HA A 31 LYS HGx 1.0 0.0 5.35 2693 2429 A 31 LYS HGy A 32 ASN HA 1.0 0.0 5.35 2694 2430 A 32 ASN H A 32 ASN HA 1.0 0.0 4.83 2695 2431 A 32 ASN HA A 34 GLU H 1.0 0.0 5.09 2696 2432 A 32 ASN HD2y A 32 ASN HA 1.0 0.0 4.89 2697 2433 A 32 ASN HBy A 35 ASP HBy 1.0 0.0 4.71 2698 2434 A 32 ASN HBx A 35 ASP HBy 1.0 0.0 6.00 2699 2435 A 33 PRO HB3 A 30 GLU HA 1.0 0.0 5.53 2700 2436 A 33 PRO HDy A 33 PRO HB2 1.0 0.0 4.60 2701 2437 A 82 ILE HD1% A 33 PRO HB2 1.0 0.0 5.43 2702 2438 A 34 GLU H A 33 PRO HDy 1.0 0.0 5.70 2703 2439 A 33 PRO HA A 33 PRO HGx 1.0 0.0 4.60 2704 2439 A 33 PRO HA A 33 PRO HGy 1.0 0.0 4.60 2705 2440 A 34 GLU HA A 82 ILE HG1x 1.0 0.0 5.29 2706 2441 A 34 GLU HA A 82 ILE HB 1.0 0.0 4.71 2707 2442 A 34 GLU HA A 36 MET HG2 1.0 0.0 4.22 2708 2443 A 34 GLU H A 34 GLU HA 1.0 0.0 4.22 2709 2444 A 34 GLU HA A 39 TRP HE1 1.0 0.0 4.73 2710 2445 A 35 ASP HA A 35 ASP HBx 1.0 0.0 4.43 2711 2446 A 35 ASP HA A 35 ASP HBy 1.0 0.0 4.16 2712 2447 A 35 ASP H A 35 ASP HA 1.0 0.0 4.81 2713 2448 A 35 ASP HA A 37 GLU H 1.0 0.0 4.48 2714 2449 A 32 ASN HBy A 35 ASP HBy 1.0 0.0 5.20 2715 2450 A 32 ASN HBy A 35 ASP HBx 1.0 0.0 5.99 2716 2451 A 36 MET HBx A 36 MET HA 1.0 0.0 3.71 2717 2452 A 36 MET HG3 A 36 MET HA 1.0 0.0 4.36 2718 2453 A 36 MET HG2 A 36 MET HA 1.0 0.0 4.13 2719 2454 A 40 ASN H A 36 MET HA 1.0 0.0 5.18 2720 2455 A 36 MET H A 36 MET HA 1.0 0.0 3.78 2721 2456 A 29 VAL HGy% A 36 MET HE% 1.0 0.0 5.40 2722 2457 A 82 ILE HG2% A 36 MET HE% 1.0 0.0 4.69 2723 2458 A 76 LEU HA A 36 MET HG3 1.0 0.0 6.00 2724 2459 A 37 GLU HA A 40 ASN HD2y 1.0 0.0 5.21 2725 2460 A 38 TYR H A 37 GLU HA 1.0 0.0 4.56 2726 2461 A 40 ASN HBx A 37 GLU HGx 1.0 0.0 6.00 2727 2462 A 38 TYR HA A 39 TRP H 1.0 0.0 5.41 2728 2463 A 38 TYR HA A 41 LYS H 1.0 0.0 5.40 2729 2464 A 36 MET HA A 39 TRP HBx 1.0 0.0 4.54 2730 2464 A 36 MET HA A 39 TRP HBy 1.0 0.0 4.54 2731 2465 A 40 ASN H A 39 TRP HBx 1.0 0.0 6.00 2732 2465 A 40 ASN H A 39 TRP HBy 1.0 0.0 6.00 2733 2466 A 40 ASN HA A 43 TYR HBy 1.0 0.0 4.98 2734 2467 A 40 ASN HA A 39 TRP HBx 1.0 0.0 4.52 2735 2467 A 39 TRP HBy A 40 ASN HA 1.0 0.0 4.52 2736 2468 A 40 ASN HA A 72 VAL HGx% 1.0 0.0 5.07 2737 2469 A 40 ASN HA A 76 LEU HDx% 1.0 0.0 4.91 2738 2469 A 76 LEU HDy% A 40 ASN HA 1.0 0.0 4.91 2739 2470 A 40 ASN H A 40 ASN HA 1.0 0.0 4.41 2740 2471 A 43 TYR H A 40 ASN HA 1.0 0.0 4.12 2741 2472 A 40 ASN HBx A 40 ASN HA 1.0 0.0 4.67 2742 2473 A 40 ASN HA A 41 LYS HA 1.0 0.0 5.50 2743 2474 A 43 TYR H A 41 LYS HA 1.0 0.0 5.50 2744 2475 A 42 ILE H A 41 LYS HA 1.0 0.0 5.15 2745 2476 A 38 TYR HA A 41 LYS HGx 1.0 0.0 4.53 2746 2476 A 38 TYR HA A 41 LYS HGy 1.0 0.0 4.53 2747 2477 A 41 LYS HBx A 41 LYS HGx 1.0 0.0 4.16 2748 2477 A 41 LYS HBx A 41 LYS HGy 1.0 0.0 4.16 2749 2478 A 42 ILE HA A 46 VAL H 1.0 0.0 5.91 2750 2479 A 39 TRP HA A 42 ILE HB 1.0 0.0 4.67 2751 2480 A 43 TYR H A 42 ILE HB 1.0 0.0 4.97 2752 2481 A 42 ILE H A 42 ILE HB 1.0 0.0 4.38 2753 2482 A 42 ILE HD1% A 42 ILE HB 1.0 0.0 4.62 2754 2483 A 42 ILE HB A 42 ILE HG2% 1.0 0.0 4.11 2755 2484 A 42 ILE HD1% A 90 VAL HB 1.0 0.0 5.15 2756 2485 A 43 TYR HA A 72 VAL HGx% 1.0 0.0 5.17 2757 2486 A 43 TYR HA A 72 VAL HGy% 1.0 0.0 5.78 2758 2487 A 43 TYR HA A 72 VAL HB 1.0 0.0 5.24 2759 2488 A 44 ARG HA A 44 ARG HGy 1.0 0.0 5.56 2760 2489 A 44 ARG HGx A 43 TYR HD% 1.0 0.0 6.00 2761 2490 A 45 LEU HBx A 45 LEU HA 1.0 0.0 4.14 2762 2491 A 47 HIS HA A 50 LYS HBx 1.0 0.0 4.91 2763 2492 A 47 HIS HA A 46 VAL HGx% 1.0 0.0 5.62 2764 2493 A 47 HIS HA A 51 GLU H 1.0 0.0 5.16 2765 2494 A 47 HIS H A 47 HIS HA 1.0 0.0 4.65 2766 2495 A 47 HIS HA A 50 LYS H 1.0 0.0 5.11 2767 2496 A 47 HIS HBx A 69 MET HE% 1.0 0.0 5.45 2768 2497 A 48 THR HA A 51 GLU H 1.0 0.0 5.64 2769 2498 A 18 LEU HDx% A 48 THR HB 1.0 0.0 4.75 2770 2499 A 48 THR HB A 49 MET H 1.0 0.0 4.21 2771 2500 A 49 MET HA A 52 ILE H 1.0 0.0 5.68 2772 2501 A 49 MET HA A 52 ILE HD1% 1.0 0.0 4.62 2773 2502 A 49 MET HBy A 49 MET HE% 1.0 0.0 4.42 2774 2503 A 18 LEU HG A 49 MET HE% 1.0 0.0 4.02 2775 2504 A 113 ARG HA A 113 ARG HDx 1.0 0.0 6.00 2776 2504 A 113 ARG HA A 113 ARG HDy 1.0 0.0 6.00 2777 2505 A 112 PRO HDy A 111 VAL HGx% 1.0 0.0 6.00 2778 2505 A 112 PRO HDy A 111 VAL HGy% 1.0 0.0 6.00 2779 2506 A 66 HIS HA A 68 ILE H 1.0 0.0 5.25 2780 2507 A 110 LEU HA A 111 VAL H 1.0 0.0 4.42 2781 2508 A 110 LEU H A 110 LEU HA 1.0 0.0 4.76 2782 2509 A 109 TYR HA A 109 TYR HD% 1.0 0.0 4.59 2783 2510 A 109 TYR HA A 109 TYR H 1.0 0.0 4.20 2784 2511 A 109 TYR HA A 109 TYR HBy 1.0 0.0 5.04 2785 2512 A 109 TYR HA A 109 TYR HBx 1.0 0.0 4.47 2786 2513 A 107 GLY H A 107 GLY HAy 1.0 0.0 6.00 2787 2514 A 107 GLY H A 107 GLY HAx 1.0 0.0 5.39 2788 2515 A 105 VAL HGx% A 106 SER HBx 1.0 0.0 5.49 2789 2515 A 105 VAL HGy% A 106 SER HBx 1.0 0.0 5.49 2790 2515 A 106 SER HBy A 105 VAL HGx% 1.0 0.0 5.49 2791 2515 A 105 VAL HGy% A 106 SER HBy 1.0 0.0 5.49 2792 2516 A 104 LYS HBx A 101 LEU HDx% 1.0 0.0 5.21 2793 2516 A 104 LYS HBx A 101 LEU HDy% 1.0 0.0 5.21 2794 2517 A 104 LYS HBy A 101 LEU HDx% 1.0 0.0 5.05 2795 2517 A 104 LYS HBy A 101 LEU HDy% 1.0 0.0 5.05 2796 2518 A 30 GLU H A 28 GLU HBx 1.0 0.0 6.00 2797 2518 A 28 GLU HBy A 30 GLU H 1.0 0.0 6.00 2798 2519 A 104 LYS HBy A 104 LYS HDy 1.0 0.0 5.52 2799 2520 A 104 LYS HBx A 104 LYS HDy 1.0 0.0 5.02 2800 2521 A 104 LYS HDy A 101 LEU HDx% 1.0 0.0 4.59 2801 2521 A 101 LEU HDy% A 104 LYS HDy 1.0 0.0 4.59 2802 2522 A 104 LYS H A 104 LYS HGy 1.0 0.0 5.21 2803 2523 A 104 LYS HGy A 104 LYS HA 1.0 0.0 4.89 2804 2524 A 104 LYS HGy A 104 LYS HEx 1.0 0.0 5.45 2805 2525 A 102 ASP HA A 101 LEU HDx% 1.0 0.0 5.54 2806 2525 A 102 ASP HA A 101 LEU HDy% 1.0 0.0 5.54 2807 2526 A 101 LEU HA A 105 VAL H 1.0 0.0 5.64 2808 2527 A 104 LYS H A 101 LEU HA 1.0 0.0 5.42 2809 2528 A 104 LYS HBy A 101 LEU HA 1.0 0.0 5.07 2810 2529 A 101 LEU HA A 104 LYS HBx 1.0 0.0 5.55 2811 2530 A 101 LEU H A 100 GLU HBx 1.0 0.0 5.54 2812 2531 A 101 LEU H A 100 GLU HBy 1.0 0.0 5.00 2813 2532 A 97 VAL HGy% A 100 GLU HBx 1.0 0.0 5.51 2814 2533 A 98 THR HA A 99 ARG H 1.0 0.0 5.71 2815 2534 A 97 VAL HB A 98 THR HA 1.0 0.0 6.00 2816 2535 A 19 ILE HG2% A 98 THR HB 1.0 0.0 4.85 2817 2536 A 97 VAL HB A 98 THR H 1.0 0.0 4.37 2818 2537 A 97 VAL H A 97 VAL HB 1.0 0.0 4.33 2819 2538 A 97 VAL HB A 19 ILE HG13 1.0 0.0 5.56 2820 2539 A 97 VAL HGy% A 96 MET HB3 1.0 0.0 5.69 2821 2540 A 75 MET HE% A 75 MET HBy 1.0 0.0 4.75 2822 2541 A 8 ILE HG2% A 56 MET HGy 1.0 0.0 6.00 2823 2542 A 19 ILE HG2% A 95 ASP HA 1.0 0.0 4.93 2824 2543 A 23 ASN HD2x A 95 ASP HA 1.0 0.0 4.75 2825 2544 A 96 MET H A 95 ASP HA 1.0 0.0 5.52 2826 2545 A 92 LYS H A 95 ASP HB2 1.0 0.0 5.53 2827 2546 A 101 LEU H A 102 ASP HBy 1.0 0.0 5.41 2828 2547 A 92 LYS HA A 95 ASP HB3 1.0 0.0 4.91 2829 2548 A 96 MET HB3 A 95 ASP HB3 1.0 0.0 5.40 2830 2549 A 96 MET HB2 A 95 ASP HB3 1.0 0.0 5.52 2831 2550 A 96 MET HB3 A 95 ASP HB2 1.0 0.0 5.49 2832 2551 A 95 ASP HB2 A 96 MET HB2 1.0 0.0 5.53 2833 2552 A 92 LYS HBy A 95 ASP HB2 1.0 0.0 4.85 2834 2553 A 95 ASP HB2 A 92 LYS HDx 1.0 0.0 4.95 2835 2553 A 92 LYS HDy A 95 ASP HB2 1.0 0.0 4.95 2836 2554 A 92 LYS HG3 A 95 ASP HB2 1.0 0.0 5.28 2837 2555 A 102 ASP HBy A 99 ARG HBx 1.0 0.0 6.00 2838 2556 A 94 LEU H A 94 LEU HA 1.0 0.0 5.14 2839 2557 A 97 VAL H A 94 LEU HA 1.0 0.0 5.52 2840 2558 A 94 LEU HA A 93 LYS HBy 1.0 0.0 5.24 2841 2559 A 93 LYS HA A 93 LYS HGx 1.0 0.0 5.88 2842 2559 A 93 LYS HA A 93 LYS HGy 1.0 0.0 5.88 2843 2560 A 64 VAL HGx% A 93 LYS HA 1.0 0.0 4.91 2844 2561 A 68 ILE HD1% A 93 LYS HA 1.0 0.0 5.15 2845 2562 A 96 MET HB3 A 93 LYS HA 1.0 0.0 4.62 2846 2563 A 96 MET H A 93 LYS HA 1.0 0.0 4.92 2847 2564 A 93 LYS H A 93 LYS HA 1.0 0.0 4.81 2848 2565 A 42 ILE H A 41 LYS HBx 1.0 0.0 6.00 2849 2566 A 93 LYS HBy A 93 LYS HA 1.0 0.0 5.13 2850 2567 A 94 LEU HA A 93 LYS HBy 1.0 0.0 5.39 2851 2568 A 41 LYS HBx A 41 LYS HGx 1.0 0.0 3.48 2852 2568 A 41 LYS HBx A 41 LYS HGy 1.0 0.0 3.48 2853 2569 A 68 ILE HG2% A 93 LYS HBy 1.0 0.0 4.79 2854 2570 A 95 ASP H A 92 LYS HA 1.0 0.0 4.19 2855 2571 A 15 LEU H A 16 LYS HDx 1.0 0.0 5.36 2856 2571 A 15 LEU H A 16 LYS HDy 1.0 0.0 5.36 2857 2572 A 95 ASP H A 91 LYS HA 1.0 0.0 6.00 2858 2573 A 26 ILE HD1% A 91 LYS HDx 1.0 0.0 4.28 2859 2573 A 26 ILE HD1% A 91 LYS HDy 1.0 0.0 4.28 2860 2574 A 26 ILE HG2% A 91 LYS HDx 1.0 0.0 6.00 2861 2574 A 26 ILE HG2% A 91 LYS HDy 1.0 0.0 6.00 2862 2575 A 90 VAL HA A 93 LYS H 1.0 0.0 5.39 2863 2576 A 90 VAL HA A 68 ILE HD1% 1.0 0.0 6.00 2864 2577 A 90 VAL HA A 68 ILE HD1% 1.0 0.0 6.00 2865 2578 A 97 VAL HB A 19 ILE HD1% 1.0 0.0 5.02 2866 2579 A 90 VAL HGy% A 87 ILE H 1.0 0.0 5.98 2867 2580 A 42 ILE HD1% A 90 VAL HGy% 1.0 0.0 4.84 2868 2581 A 90 VAL HGy% A 26 ILE HD1% 1.0 0.0 4.08 2869 2582 A 90 VAL HGy% A 71 LEU HG 1.0 0.0 4.76 2870 2583 A 90 VAL HGy% A 87 ILE HA 1.0 0.0 4.27 2871 2584 A 90 VAL HGy% A 86 LEU HA 1.0 0.0 5.53 2872 2585 A 90 VAL HGx% A 91 LYS HGx 1.0 0.0 4.89 2873 2585 A 91 LYS HGy A 90 VAL HGx% 1.0 0.0 4.89 2874 2586 A 42 ILE HD1% A 90 VAL HGx% 1.0 0.0 5.00 2875 2587 A 26 ILE HG1y A 90 VAL HGx% 1.0 0.0 5.42 2876 2588 A 86 LEU HG A 89 LYS HBy 1.0 0.0 4.43 2877 2589 A 86 LEU HA A 89 LYS HBy 1.0 0.0 5.85 2878 2590 A 9 LYS HBy A 9 LYS HDx 1.0 0.0 4.12 2879 2590 A 9 LYS HBy A 9 LYS HDy 1.0 0.0 4.12 2880 2591 A 88 ASP H A 89 LYS HBx 1.0 0.0 6.00 2881 2592 A 90 VAL H A 89 LYS HGx 1.0 0.0 6.00 2882 2592 A 90 VAL H A 89 LYS HGy 1.0 0.0 6.00 2883 2593 A 68 ILE HD1% A 93 LYS HGx 1.0 0.0 6.00 2884 2593 A 68 ILE HD1% A 93 LYS HGy 1.0 0.0 6.00 2885 2594 A 87 ILE HA A 88 ASP HA 1.0 0.0 5.59 2886 2595 A 88 ASP H A 87 ILE HA 1.0 0.0 5.97 2887 2596 A 87 ILE HB A 87 ILE HA 1.0 0.0 4.50 2888 2597 A 86 LEU HBx A 87 ILE HA 1.0 0.0 6.00 2889 2598 A 86 LEU HDy% A 87 ILE HA 1.0 0.0 4.76 2890 2599 A 87 ILE HG2% A 30 GLU HA 1.0 0.0 5.00 2891 2600 A 29 VAL HB A 87 ILE HG2% 1.0 0.0 4.42 2892 2601 A 26 ILE HG2% A 87 ILE HG1x 1.0 0.0 6.00 2893 2601 A 26 ILE HG2% A 87 ILE HG1y 1.0 0.0 6.00 2894 2602 A 71 LEU HDy% A 87 ILE HG1x 1.0 0.0 5.12 2895 2602 A 71 LEU HDy% A 87 ILE HG1y 1.0 0.0 5.12 2896 2603 A 29 VAL HB A 87 ILE HD1% 1.0 0.0 6.00 2897 2604 A 88 ASP H A 86 LEU HA 1.0 0.0 6.00 2898 2605 A 86 LEU HA A 88 ASP HBy 1.0 0.0 5.56 2899 2606 A 86 LEU HA A 89 LYS HBy 1.0 0.0 4.84 2900 2607 A 86 LEU HA A 86 LEU HG 1.0 0.0 4.32 2901 2608 A 86 LEU HA A 89 LYS HDx 1.0 0.0 6.00 2902 2608 A 86 LEU HA A 89 LYS HDy 1.0 0.0 6.00 2903 2609 A 86 LEU HA A 89 LYS HGx 1.0 0.0 4.96 2904 2609 A 86 LEU HA A 89 LYS HGy 1.0 0.0 4.96 2905 2610 A 86 LEU HA A 83 THR HG2% 1.0 0.0 5.95 2906 2611 A 83 THR HA A 86 LEU HBy 1.0 0.0 5.54 2907 2612 A 86 LEU H A 85 ASP HA 1.0 0.0 5.59 2908 2613 A 88 ASP H A 85 ASP HA 1.0 0.0 4.42 2909 2614 A 83 THR HA A 82 ILE HA 1.0 0.0 4.28 2910 2615 A 83 THR HG2% A 83 THR HB 1.0 0.0 3.75 2911 2616 A 86 LEU HDx% A 83 THR HB 1.0 0.0 5.03 2912 2617 A 83 THR HA A 82 ILE HA 1.0 0.0 5.84 2913 2618 A 82 ILE HB A 33 PRO HB3 1.0 0.0 5.88 2914 2619 A 34 GLU H A 82 ILE HD1% 1.0 0.0 6.00 2915 2620 A 82 ILE HD1% A 36 MET HA 1.0 0.0 5.40 2916 2621 A 81 LYS HA A 82 ILE HG1x 1.0 0.0 4.81 2917 2622 A 81 LYS HA A 82 ILE HB 1.0 0.0 4.83 2918 2623 A 81 LYS H A 81 LYS HA 1.0 0.0 4.68 2919 2624 A 80 ILE HA A 81 LYS HBx 1.0 0.0 5.56 2920 2624 A 80 ILE HA A 81 LYS HBy 1.0 0.0 5.56 2921 2625 A 9 LYS HDx A 9 LYS HEx 1.0 0.0 3.80 2922 2625 A 9 LYS HDy A 9 LYS HEx 1.0 0.0 3.80 2923 2625 A 9 LYS HEy A 9 LYS HDx 1.0 0.0 3.80 2924 2625 A 9 LYS HEy A 9 LYS HDy 1.0 0.0 3.80 2925 2626 A 78 SER HA A 80 ILE H 1.0 0.0 5.45 2926 2627 A 79 GLU H A 78 SER HA 1.0 0.0 4.84 2927 2628 A 80 ILE HG2% A 80 ILE HA 1.0 0.0 4.53 2928 2629 A 80 ILE HA A 80 ILE HD1% 1.0 0.0 5.26 2929 2630 A 19 ILE HD1% A 16 LYS HEx 1.0 0.0 5.46 2930 2630 A 16 LYS HEy A 19 ILE HD1% 1.0 0.0 5.46 2931 2631 A 19 ILE HG2% A 19 ILE HD1% 1.0 0.0 2.80 2932 2632 A 17 GLU H A 19 ILE HD1% 1.0 0.0 5.57 2933 2633 A 80 ILE HG2% A 75 MET HBy 1.0 0.0 6.00 2934 2634 A 80 ILE HG1x A 80 ILE HG2% 1.0 0.0 3.78 2935 2635 A 80 ILE H A 79 GLU HA 1.0 0.0 4.77 2936 2636 A 79 GLU HA A 79 GLU HGx 1.0 0.0 4.81 2937 2637 A 79 GLU HA A 79 GLU HGy 1.0 0.0 4.83 2938 2638 A 79 GLU H A 78 SER HA 1.0 0.0 4.40 2939 2639 A 78 SER HA A 80 ILE H 1.0 0.0 4.49 2940 2640 A 77 ASN HA A 78 SER HA 1.0 0.0 6.00 2941 2641 A 78 SER H A 78 SER HBx 1.0 0.0 5.28 2942 2641 A 78 SER H A 78 SER HBy 1.0 0.0 5.28 2943 2642 A 77 ASN HA A 78 SER HBx 1.0 0.0 5.35 2944 2642 A 77 ASN HA A 78 SER HBy 1.0 0.0 5.35 2945 2643 A 77 ASN HA A 76 LEU HDx% 1.0 0.0 6.00 2946 2643 A 76 LEU HDy% A 77 ASN HA 1.0 0.0 6.00 2947 2644 A 77 ASN HA A 76 LEU HBy 1.0 0.0 6.00 2948 2645 A 77 ASN HA A 78 SER HBx 1.0 0.0 4.52 2949 2645 A 77 ASN HA A 78 SER HBy 1.0 0.0 4.52 2950 2646 A 77 ASN HBy A 80 ILE HG1x 1.0 0.0 5.14 2951 2647 A 77 ASN HBx A 78 SER HBx 1.0 0.0 5.49 2952 2647 A 77 ASN HBx A 78 SER HBy 1.0 0.0 5.49 2953 2648 A 76 LEU H A 76 LEU HA 1.0 0.0 5.05 2954 2649 A 76 LEU HA A 76 LEU HDx% 1.0 0.0 5.09 2955 2649 A 76 LEU HDy% A 76 LEU HA 1.0 0.0 5.09 2956 2650 A 40 ASN HA A 76 LEU HDx% 1.0 0.0 5.65 2957 2650 A 76 LEU HDy% A 40 ASN HA 1.0 0.0 5.65 2958 2651 A 75 MET HA A 80 ILE H 1.0 0.0 5.45 2959 2652 A 33 PRO HB3 A 30 GLU HA 1.0 0.0 5.11 2960 2653 A 26 ILE HG2% A 30 GLU HA 1.0 0.0 6.00 2961 2654 A 75 MET HGx A 75 MET HA 1.0 0.0 4.62 2962 2655 A 29 VAL HGy% A 75 MET HE% 1.0 0.0 4.92 2963 2656 A 29 VAL HGx% A 75 MET HE% 1.0 0.0 5.24 2964 2657 A 82 ILE HG1x A 75 MET HE% 1.0 0.0 3.80 2965 2658 A 75 MET HE% A 82 ILE HG1y 1.0 0.0 3.97 2966 2659 A 75 MET HBx A 75 MET HE% 1.0 0.0 4.14 2967 2660 A 75 MET HE% A 36 MET HE% 1.0 0.0 5.47 2968 2661 A 72 VAL HB A 75 MET HE% 1.0 0.0 6.00 2969 2662 A 74 LYS HBy A 80 ILE HG2% 1.0 0.0 5.74 2970 2663 A 74 LYS HBx A 80 ILE HG2% 1.0 0.0 5.44 2971 2664 A 80 ILE HG2% A 74 LYS HGx 1.0 0.0 5.87 2972 2664 A 80 ILE HG2% A 74 LYS HGy 1.0 0.0 5.87 2973 2665 A 80 ILE HD1% A 74 LYS HGx 1.0 0.0 5.24 2974 2665 A 80 ILE HD1% A 74 LYS HGy 1.0 0.0 5.24 2975 2666 A 80 ILE HG1x A 74 LYS HGx 1.0 0.0 5.42 2976 2666 A 80 ILE HG1x A 74 LYS HGy 1.0 0.0 5.42 2977 2667 A 80 ILE HG1y A 74 LYS HGx 1.0 0.0 4.99 2978 2667 A 80 ILE HG1y A 74 LYS HGy 1.0 0.0 4.99 2979 2668 A 72 VAL HGx% A 73 ASP HA 1.0 0.0 5.08 2980 2669 A 43 TYR HE% A 73 ASP HA 1.0 0.0 5.21 2981 2670 A 73 ASP HBy A 43 TYR HD% 1.0 0.0 6.00 2982 2671 A 72 VAL HA A 75 MET HGx 1.0 0.0 5.00 2983 2672 A 71 LEU H A 72 VAL HB 1.0 0.0 5.93 2984 2673 A 72 VAL HGx% A 72 VAL H 1.0 0.0 4.97 2985 2674 A 72 VAL HGx% A 75 MET H 1.0 0.0 5.22 2986 2675 A 72 VAL HGx% A 43 TYR HE% 1.0 0.0 5.11 2987 2676 A 43 TYR HA A 72 VAL HGx% 1.0 0.0 5.61 2988 2677 A 42 ILE HD1% A 72 VAL HGx% 1.0 0.0 5.78 2989 2678 A 43 TYR HA A 72 VAL HGy% 1.0 0.0 5.63 2990 2679 A 72 VAL HGy% A 68 ILE HG2% 1.0 0.0 3.93 2991 2680 A 71 LEU HB3 A 71 LEU HDy% 1.0 0.0 4.22 2992 2681 A 71 LEU HB3 A 68 ILE HG2% 1.0 0.0 5.23 2993 2682 A 71 LEU HB3 A 72 VAL HGy% 1.0 0.0 4.86 2994 2683 A 72 VAL HGx% A 71 LEU HB3 1.0 0.0 6.00 2995 2684 A 71 LEU HB2 A 68 ILE HG2% 1.0 0.0 4.69 2996 2685 A 21 ASN HA A 20 GLN HBx 1.0 0.0 4.23 2997 2685 A 21 ASN HA A 20 GLN HBy 1.0 0.0 4.23 2998 2686 A 70 ASN HD2y A 70 ASN HA 1.0 0.0 4.43 2999 2687 A 70 ASN HA A 73 ASP H 1.0 0.0 5.23 3000 2688 A 69 MET HG3 A 70 ASN HBx 1.0 0.0 5.67 3001 2688 A 69 MET HG3 A 70 ASN HBy 1.0 0.0 5.67 3002 2689 A 69 MET HB3 A 70 ASN HBx 1.0 0.0 5.77 3003 2689 A 70 ASN HBy A 69 MET HB3 1.0 0.0 5.77 3004 2690 A 71 LEU HB2 A 70 ASN HBx 1.0 0.0 5.57 3005 2690 A 70 ASN HBy A 71 LEU HB2 1.0 0.0 5.57 3006 2691 A 69 MET HA A 46 VAL HGx% 1.0 0.0 4.40 3007 2692 A 50 LYS HBx A 50 LYS HA 1.0 0.0 6.00 3008 2693 A 69 MET HA A 70 ASN HA 1.0 0.0 6.00 3009 2694 A 69 MET HA A 71 LEU H 1.0 0.0 5.82 3010 2695 A 69 MET HA A 43 TYR HE% 1.0 0.0 5.26 3011 2696 A 69 MET HA A 70 ASN H 1.0 0.0 5.69 3012 2697 A 69 MET HA A 72 VAL H 1.0 0.0 4.71 3013 2698 A 46 VAL HGx% A 69 MET HB2 1.0 0.0 5.34 3014 2699 A 47 HIS HBy A 69 MET HE% 1.0 0.0 5.12 3015 2700 A 69 MET H A 69 MET HE% 1.0 0.0 5.57 3016 2701 A 66 HIS HA A 69 MET HE% 1.0 0.0 5.20 3017 2702 A 46 VAL HGx% A 69 MET HE% 1.0 0.0 5.83 3018 2703 A 68 ILE HB A 65 LEU HA 1.0 0.0 4.95 3019 2704 A 90 VAL HA A 68 ILE HD1% 1.0 0.0 5.77 3020 2705 A 65 LEU HA A 68 ILE HG2% 1.0 0.0 5.68 3021 2706 A 67 THR HG2% A 68 ILE HA 1.0 0.0 5.71 3022 2707 A 67 THR HA A 71 LEU H 1.0 0.0 5.47 3023 2708 A 66 HIS HBy A 66 HIS HD2 1.0 0.0 5.61 3024 2709 A 65 LEU HBx A 66 HIS HA 1.0 0.0 5.41 3025 2710 A 66 HIS HA A 66 HIS HBx 1.0 0.0 4.84 3026 2711 A 66 HIS HA A 66 HIS HBy 1.0 0.0 5.15 3027 2712 A 69 MET H A 66 HIS HA 1.0 0.0 4.97 3028 2713 A 66 HIS H A 66 HIS HA 1.0 0.0 4.46 3029 2714 A 65 LEU H A 65 LEU HA 1.0 0.0 5.12 3030 2715 A 65 LEU HA A 66 HIS HA 1.0 0.0 5.51 3031 2716 A 65 LEU HG A 65 LEU HA 1.0 0.0 4.29 3032 2717 A 62 ALA HA A 65 LEU HBx 1.0 0.0 5.46 3033 2718 A 65 LEU HG A 62 ALA HA 1.0 0.0 4.31 3034 2719 A 65 LEU HG A 65 LEU HA 1.0 0.0 4.69 3035 2720 A 64 VAL HA A 63 LYS HBx 1.0 0.0 5.87 3036 2720 A 63 LYS HBy A 64 VAL HA 1.0 0.0 5.87 3037 2721 A 63 LYS HA A 64 VAL HGy% 1.0 0.0 6.00 3038 2722 A 64 VAL H A 63 LYS HA 1.0 0.0 5.55 3039 2723 A 62 ALA H A 62 ALA HA 1.0 0.0 4.03 3040 2724 A 53 THR H A 62 ALA HA 1.0 0.0 5.56 3041 2725 A 62 ALA HA A 65 LEU HBx 1.0 0.0 5.55 3042 2726 A 61 VAL HGx% A 62 ALA HA 1.0 0.0 5.16 3043 2727 A 65 LEU HG A 62 ALA HA 1.0 0.0 4.15 3044 2728 A 62 ALA HB% A 62 ALA HA 1.0 0.0 3.72 3045 2729 A 62 ALA HA A 65 LEU HBy 1.0 0.0 4.70 3046 2730 A 62 ALA HA A 54 GLU HGx 1.0 0.0 5.57 3047 2731 A 62 ALA HA A 54 GLU HGx 1.0 0.0 5.45 3048 2732 A 62 ALA HB% A 61 VAL HGx% 1.0 0.0 4.48 3049 2733 A 62 ALA HB% A 63 LYS HBx 1.0 0.0 4.91 3050 2733 A 62 ALA HB% A 63 LYS HBy 1.0 0.0 4.91 3051 2734 A 62 ALA HB% A 65 LEU HBy 1.0 0.0 5.37 3052 2735 A 62 ALA HB% A 59 SER HBx 1.0 0.0 4.09 3053 2736 A 62 ALA HB% A 59 SER HA 1.0 0.0 4.06 3054 2737 A 58 PHE HA A 61 VAL HGy% 1.0 0.0 5.38 3055 2738 A 61 VAL H A 60 SER HBx 1.0 0.0 5.66 3056 2739 A 61 VAL H A 60 SER HBy 1.0 0.0 5.81 3057 2740 A 60 SER HA A 63 LYS HBx 1.0 0.0 5.04 3058 2740 A 63 LYS HBy A 60 SER HA 1.0 0.0 5.04 3059 2741 A 61 VAL H A 60 SER HA 1.0 0.0 5.17 3060 2742 A 53 THR HG2% A 58 PHE HBy 1.0 0.0 5.57 3061 2743 A 58 PHE HA A 58 PHE HBx 1.0 0.0 5.14 3062 2744 A 58 PHE HA A 58 PHE HBy 1.0 0.0 4.86 3063 2745 A 58 PHE HA A 59 SER H 1.0 0.0 5.39 3064 2746 A 58 PHE H A 58 PHE HA 1.0 0.0 5.55 3065 2747 A 58 PHE H A 57 GLY HAx 1.0 0.0 5.52 3066 2748 A 56 MET H A 56 MET HA 1.0 0.0 4.64 3067 2749 A 56 MET HA A 57 GLY H 1.0 0.0 5.46 3068 2750 A 56 MET HA A 56 MET HGy 1.0 0.0 4.54 3069 2751 A 56 MET HA A 56 MET HGx 1.0 0.0 4.51 3070 2752 A 56 MET HE% A 12 THR HA 1.0 0.0 5.41 3071 2753 A 54 GLU HBy A 55 THR HA 1.0 0.0 5.23 3072 2754 A 56 MET H A 55 THR HB 1.0 0.0 4.65 3073 2755 A 53 THR HB A 53 THR HA 1.0 0.0 4.57 3074 2756 A 53 THR HA A 58 PHE HBx 1.0 0.0 5.52 3075 2757 A 53 THR HA A 56 MET HE% 1.0 0.0 5.79 3076 2758 A 55 THR H A 53 THR HA 1.0 0.0 5.70 3077 2759 A 53 THR HA A 58 PHE H 1.0 0.0 5.70 3078 2760 A 53 THR H A 53 THR HB 1.0 0.0 4.63 3079 2761 A 53 THR HB A 58 PHE HBx 1.0 0.0 4.67 3080 2762 A 53 THR HB A 58 PHE HBy 1.0 0.0 4.62 3081 2763 A 53 THR HB A 61 VAL HB 1.0 0.0 4.79 3082 2764 A 53 THR HB A 53 THR HG2% 1.0 0.0 3.84 3083 2765 A 52 ILE HG1y A 52 ILE HB 1.0 0.0 4.73 3084 2766 A 49 MET HA A 52 ILE HG1y 1.0 0.0 4.82 3085 2767 A 52 ILE HG1y A 52 ILE HG1x 1.0 0.0 3.71 3086 2768 A 52 ILE HG1y A 52 ILE HD1% 1.0 0.0 4.37 3087 2769 A 52 ILE H A 52 ILE HG1y 1.0 0.0 4.68 3088 2770 A 52 ILE H A 52 ILE HG1x 1.0 0.0 5.05 3089 2771 A 49 MET HA A 52 ILE HG1x 1.0 0.0 4.86 3090 2772 A 52 ILE HG1y A 52 ILE HG1x 1.0 0.0 3.74 3091 2773 A 48 THR HG2% A 52 ILE HG1x 1.0 0.0 5.63 3092 2774 A 52 ILE HG1x A 52 ILE HD1% 1.0 0.0 4.33 3093 2775 A 52 ILE HG1y A 52 ILE HG2% 1.0 0.0 4.23 3094 2776 A 52 ILE HG2% A 53 THR HG2% 1.0 0.0 5.15 3095 2777 A 15 LEU H A 52 ILE HD1% 1.0 0.0 5.54 3096 2778 A 14 GLU HBx A 52 ILE HD1% 1.0 0.0 4.73 3097 2779 A 48 THR HG2% A 51 GLU HGy 1.0 0.0 5.32 3098 2780 A 48 THR HA A 51 GLU HGx 1.0 0.0 5.74 3099 2781 A 52 ILE H A 51 GLU HGx 1.0 0.0 5.37 3100 2782 A 51 GLU H A 50 LYS HA 1.0 0.0 5.73 3101 2783 A 53 THR HB A 50 LYS HA 1.0 0.0 6.00 3102 2784 A 47 HIS HA A 50 LYS HBx 1.0 0.0 4.98 3103 2785 A 4 HIS HD2 A 4 HIS HBx 1.0 0.0 4.34 3104 2785 A 4 HIS HBy A 4 HIS HD2 1.0 0.0 4.34 3105 2786 A 7 TYR HD% A 7 TYR HE% 1.0 0.0 2.91 3106 2787 A 7 TYR HE% A 11 VAL HGx% 1.0 0.0 4.07 3107 2787 A 11 VAL HGy% A 7 TYR HE% 1.0 0.0 4.07 3108 2788 A 7 TYR HD% A 7 TYR HE% 1.0 0.0 3.76 3109 2789 A 7 TYR HA A 7 TYR HD% 1.0 0.0 4.24 3110 2790 A 7 TYR HB3 A 7 TYR HD% 1.0 0.0 3.96 3111 2791 A 7 TYR HD% A 11 VAL HGx% 1.0 0.0 4.79 3112 2791 A 11 VAL HGy% A 7 TYR HD% 1.0 0.0 4.79 3113 2792 A 39 TRP HE1 A 39 TRP HZ2 1.0 0.0 4.43 3114 2793 A 39 TRP HZ2 A 39 TRP HH2 1.0 0.0 3.89 3115 2794 A 39 TRP HZ2 A 87 ILE HG1x 1.0 0.0 4.65 3116 2794 A 39 TRP HZ2 A 87 ILE HG1y 1.0 0.0 4.65 3117 2795 A 39 TRP HZ2 A 75 MET HE% 1.0 0.0 4.21 3118 2796 A 39 TRP HZ2 A 87 ILE HG2% 1.0 0.0 3.79 3119 2797 A 26 ILE HG2% A 39 TRP HZ2 1.0 0.0 5.33 3120 2798 A 29 VAL HGy% A 39 TRP HZ2 1.0 0.0 4.54 3121 2799 A 39 TRP HD1 A 39 TRP HE1 1.0 0.0 3.90 3122 2800 A 39 TRP HD1 A 36 MET HA 1.0 0.0 4.05 3123 2801 A 39 TRP HD1 A 39 TRP HBx 1.0 0.0 4.39 3124 2801 A 39 TRP HD1 A 39 TRP HBy 1.0 0.0 4.39 3125 2802 A 39 TRP HD1 A 36 MET HE% 1.0 0.0 4.87 3126 2803 A 39 TRP HD1 A 82 ILE HD1% 1.0 0.0 4.92 3127 2804 A 39 TRP HZ2 A 39 TRP HH2 1.0 0.0 4.00 3128 2805 A 87 ILE HA A 39 TRP HH2 1.0 0.0 4.99 3129 2806 A 75 MET HE% A 39 TRP HH2 1.0 0.0 4.22 3130 2807 A 87 ILE HG2% A 39 TRP HH2 1.0 0.0 4.16 3131 2808 A 43 TYR HE% A 73 ASP HBy 1.0 0.0 3.93 3132 2809 A 43 TYR HE% A 73 ASP HBx 1.0 0.0 4.51 3133 2810 A 69 MET HB3 A 43 TYR HE% 1.0 0.0 3.99 3134 2811 A 43 TYR H A 43 TYR HD% 1.0 0.0 5.50 3135 2812 A 44 ARG H A 43 TYR HD% 1.0 0.0 5.40 3136 2813 A 44 ARG HA A 43 TYR HD% 1.0 0.0 4.99 3137 2814 A 43 TYR HA A 43 TYR HD% 1.0 0.0 4.52 3138 2815 A 43 TYR HBy A 43 TYR HD% 1.0 0.0 4.43 3139 2816 A 43 TYR HBx A 43 TYR HD% 1.0 0.0 4.31 3140 2817 A 72 VAL HB A 43 TYR HD% 1.0 0.0 4.28 3141 2818 A 43 TYR HD% A 44 ARG HBx 1.0 0.0 5.32 3142 2818 A 44 ARG HBy A 43 TYR HD% 1.0 0.0 5.32 3143 2819 A 44 ARG HGx A 43 TYR HD% 1.0 0.0 5.28 3144 2820 A 72 VAL HGx% A 43 TYR HD% 1.0 0.0 4.26 3145 2821 A 47 HIS HA A 47 HIS HD2 1.0 0.0 4.45 3146 2822 A 47 HIS HBx A 47 HIS HD2 1.0 0.0 4.73 3147 2823 A 69 MET HE% A 47 HIS HD2 1.0 0.0 4.18 3148 2824 A 58 PHE HD% A 58 PHE HE% 1.0 0.0 3.00 3149 2825 A 56 MET HE% A 58 PHE HE% 1.0 0.0 5.13 3150 2826 A 58 PHE HD% A 58 PHE HE% 1.0 0.0 2.90 3151 2827 A 58 PHE HA A 58 PHE HD% 1.0 0.0 3.91 3152 2828 A 58 PHE HBy A 58 PHE HD% 1.0 0.0 4.58 3153 2829 A 58 PHE HBx A 58 PHE HD% 1.0 0.0 4.53 3154 2830 A 58 PHE HD% A 56 MET HBx 1.0 0.0 4.06 3155 2830 A 56 MET HBy A 58 PHE HD% 1.0 0.0 4.06 3156 2831 A 61 VAL HGy% A 58 PHE HD% 1.0 0.0 4.53 3157 2832 A 66 HIS HA A 66 HIS HD2 1.0 0.0 4.19 3158 2833 A 66 HIS HBy A 66 HIS HD2 1.0 0.0 4.89 3159 2834 A 66 HIS HBx A 66 HIS HD2 1.0 0.0 5.25 3160 2835 A 69 MET HB2 A 66 HIS HD2 1.0 0.0 4.71 3161 2836 A 69 MET HE% A 66 HIS HD2 1.0 0.0 4.70 3162 2837 A 62 ALA HB% A 66 HIS HD2 1.0 0.0 4.94 3163 2838 A 109 TYR HD% A 109 TYR HE% 1.0 0.0 2.85 3164 2839 A 109 TYR HD% A 109 TYR HE% 1.0 0.0 3.16 3165 2840 A 109 TYR HA A 109 TYR HD% 1.0 0.0 4.28 3166 2841 A 109 TYR HBy A 109 TYR HD% 1.0 0.0 3.85 3167 2842 A 109 TYR HBx A 109 TYR HD% 1.0 0.0 3.86 3168 2843 A 7 TYR HA A 7 TYR HE% 1.0 0.0 5.77 3169 2844 A 73 ASP H A 43 TYR HE% 1.0 0.0 4.47 3170 2845 A 43 TYR HE% A 73 ASP HA 1.0 0.0 5.03 3171 2846 A 69 MET HA A 43 TYR HE% 1.0 0.0 4.49 3172 2847 A 43 TYR HBx A 43 TYR HE% 1.0 0.0 5.37 3173 2848 A 69 MET HG2 A 43 TYR HE% 1.0 0.0 4.57 3174 2849 A 43 TYR HE% A 69 MET HE% 1.0 0.0 4.47 3175 2850 A 58 PHE H A 58 PHE HD% 1.0 0.0 5.26 3176 2851 A 58 PHE HE% A 56 MET HBx 1.0 0.0 4.90 3177 2851 A 56 MET HBy A 58 PHE HE% 1.0 0.0 4.90 3178 2852 A 61 VAL HGy% A 58 PHE HE% 1.0 0.0 4.85 3179 2853 A 66 HIS H A 66 HIS HD2 1.0 0.0 5.24 3180 2854 A 109 TYR H A 109 TYR HD% 1.0 0.0 4.70 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 4 HIS C A 5 GLN N A 5 GLN CA A 5 GLN C 1.0 -72.0 -52.0 PHI 2 2 A 5 GLN N A 5 GLN CA A 5 GLN C A 6 GLU N 1.0 -51.0 -31.0 PSI 3 3 A 5 GLN C A 6 GLU N A 6 GLU CA A 6 GLU C 1.0 -79.0 -51.0 PHI 4 4 A 6 GLU N A 6 GLU CA A 6 GLU C A 7 TYR N 1.0 -55.0 -27.0 PSI 5 5 A 6 GLU C A 7 TYR N A 7 TYR CA A 7 TYR C 1.0 -74.0 -54.0 PHI 6 6 A 7 TYR N A 7 TYR CA A 7 TYR C A 8 ILE N 1.0 -55.0 -35.0 PSI 7 7 A 7 TYR C A 8 ILE N A 8 ILE CA A 8 ILE C 1.0 -77.0 -53.0 PHI 8 8 A 8 ILE N A 8 ILE CA A 8 ILE C A 9 LYS N 1.0 -50.0 -30.0 PSI 9 9 A 8 ILE C A 9 LYS N A 9 LYS CA A 9 LYS C 1.0 -73.0 -53.0 PHI 10 10 A 9 LYS N A 9 LYS CA A 9 LYS C A 10 LYS N 1.0 -50.0 -30.0 PSI 11 11 A 9 LYS C A 10 LYS N A 10 LYS CA A 10 LYS C 1.0 -73.0 -53.0 PHI 12 12 A 10 LYS N A 10 LYS CA A 10 LYS C A 11 VAL N 1.0 -51.0 -27.0 PSI 13 13 A 10 LYS C A 11 VAL N A 11 VAL CA A 11 VAL C 1.0 -83.0 -51.0 PHI 14 14 A 11 VAL N A 11 VAL CA A 11 VAL C A 12 THR N 1.0 -59.0 -23.0 PSI 15 15 A 11 VAL C A 12 THR N A 12 THR CA A 12 THR C 1.0 -73.0 -49.0 PHI 16 16 A 12 THR N A 12 THR CA A 12 THR C A 13 ASP N 1.0 -51.0 -31.0 PSI 17 17 A 12 THR C A 13 ASP N A 13 ASP CA A 13 ASP C 1.0 -75.0 -55.0 PHI 18 18 A 13 ASP N A 13 ASP CA A 13 ASP C A 14 GLU N 1.0 -52.0 -32.0 PSI 19 19 A 13 ASP C A 14 GLU N A 14 GLU CA A 14 GLU C 1.0 -77.0 -57.0 PHI 20 20 A 14 GLU N A 14 GLU CA A 14 GLU C A 15 LEU N 1.0 -55.0 -27.0 PSI 21 21 A 14 GLU C A 15 LEU N A 15 LEU CA A 15 LEU C 1.0 -72.0 -52.0 PHI 22 22 A 15 LEU N A 15 LEU CA A 15 LEU C A 16 LYS N 1.0 -55.0 -31.0 PSI 23 23 A 15 LEU C A 16 LYS N A 16 LYS CA A 16 LYS C 1.0 -76.0 -56.0 PHI 24 24 A 16 LYS N A 16 LYS CA A 16 LYS C A 17 GLU N 1.0 -49.0 -29.0 PSI 25 25 A 16 LYS C A 17 GLU N A 17 GLU CA A 17 GLU C 1.0 -76.0 -56.0 PHI 26 26 A 17 GLU N A 17 GLU CA A 17 GLU C A 18 LEU N 1.0 -53.0 -29.0 PSI 27 27 A 17 GLU C A 18 LEU N A 18 LEU CA A 18 LEU C 1.0 -76.0 -56.0 PHI 28 28 A 18 LEU N A 18 LEU CA A 18 LEU C A 19 ILE N 1.0 -57.0 -25.0 PSI 29 29 A 18 LEU C A 19 ILE N A 19 ILE CA A 19 ILE C 1.0 -75.0 -55.0 PHI 30 30 A 19 ILE N A 19 ILE CA A 19 ILE C A 20 GLN N 1.0 -54.0 -34.0 PSI 31 31 A 19 ILE C A 20 GLN N A 20 GLN CA A 20 GLN C 1.0 -74.0 -50.0 PHI 32 32 A 20 GLN N A 20 GLN CA A 20 GLN C A 21 ASN N 1.0 -56.0 -28.0 PSI 33 33 A 20 GLN C A 21 ASN N A 21 ASN CA A 21 ASN C 1.0 -76.0 -52.0 PHI 34 34 A 21 ASN N A 21 ASN CA A 21 ASN C A 22 VAL N 1.0 -53.0 -29.0 PSI 35 35 A 21 ASN C A 22 VAL N A 22 VAL CA A 22 VAL C 1.0 -79.0 -51.0 PHI 36 36 A 22 VAL N A 22 VAL CA A 22 VAL C A 23 ASN N 1.0 -58.0 -30.0 PSI 37 37 A 22 VAL C A 23 ASN N A 23 ASN CA A 23 ASN C 1.0 -70.0 -50.0 PHI 38 38 A 23 ASN N A 23 ASN CA A 23 ASN C A 24 ASP N 1.0 -56.0 -28.0 PSI 39 39 A 23 ASN C A 24 ASP N A 24 ASP CA A 24 ASP C 1.0 -77.0 -57.0 PHI 40 40 A 24 ASP N A 24 ASP CA A 24 ASP C A 25 ASP N 1.0 -54.0 -26.0 PSI 41 41 A 24 ASP C A 25 ASP N A 25 ASP CA A 25 ASP C 1.0 -75.0 -55.0 PHI 42 42 A 25 ASP N A 25 ASP CA A 25 ASP C A 26 ILE N 1.0 -53.0 -29.0 PSI 43 43 A 25 ASP C A 26 ILE N A 26 ILE CA A 26 ILE C 1.0 -75.0 -55.0 PHI 44 44 A 26 ILE N A 26 ILE CA A 26 ILE C A 27 LYS N 1.0 -54.0 -26.0 PSI 45 45 A 26 ILE C A 27 LYS N A 27 LYS CA A 27 LYS C 1.0 -77.0 -49.0 PHI 46 46 A 27 LYS N A 27 LYS CA A 27 LYS C A 28 GLU N 1.0 -59.0 -31.0 PSI 47 47 A 27 LYS C A 28 GLU N A 28 GLU CA A 28 GLU C 1.0 -76.0 -52.0 PHI 48 48 A 28 GLU N A 28 GLU CA A 28 GLU C A 29 VAL N 1.0 -48.0 -28.0 PSI 49 49 A 28 GLU C A 29 VAL N A 29 VAL CA A 29 VAL C 1.0 -78.0 -58.0 PHI 50 50 A 29 VAL N A 29 VAL CA A 29 VAL C A 30 GLU N 1.0 -54.0 -22.0 PSI 51 51 A 29 VAL C A 30 GLU N A 30 GLU CA A 30 GLU C 1.0 -85.0 -49.0 PHI 52 52 A 30 GLU N A 30 GLU CA A 30 GLU C A 31 LYS N 1.0 -54.0 -22.0 PSI 53 53 A 30 GLU C A 31 LYS N A 31 LYS CA A 31 LYS C 1.0 -92.0 -56.0 PHI 54 54 A 31 LYS N A 31 LYS CA A 31 LYS C A 32 ASN N 1.0 -51.0 -11.0 PSI 55 55 A 35 ASP C A 36 MET N A 36 MET CA A 36 MET C 1.0 -101.0 -37.0 PHI 56 56 A 36 MET N A 36 MET CA A 36 MET C A 37 GLU N 1.0 -55.0 5.0 PSI 57 57 A 36 MET C A 37 GLU N A 37 GLU CA A 37 GLU C 1.0 -72.0 -52.0 PHI 58 58 A 37 GLU N A 37 GLU CA A 37 GLU C A 38 TYR N 1.0 -52.0 -32.0 PSI 59 59 A 37 GLU C A 38 TYR N A 38 TYR CA A 38 TYR C 1.0 -72.0 -52.0 PHI 60 60 A 38 TYR N A 38 TYR CA A 38 TYR C A 39 TRP N 1.0 -66.0 -22.0 PSI 61 61 A 38 TYR C A 39 TRP N A 39 TRP CA A 39 TRP C 1.0 -74.0 -54.0 PHI 62 62 A 39 TRP N A 39 TRP CA A 39 TRP C A 40 ASN N 1.0 -58.0 -30.0 PSI 63 63 A 39 TRP C A 40 ASN N A 40 ASN CA A 40 ASN C 1.0 -75.0 -55.0 PHI 64 64 A 40 ASN N A 40 ASN CA A 40 ASN C A 41 LYS N 1.0 -49.0 -29.0 PSI 65 65 A 40 ASN C A 41 LYS N A 41 LYS CA A 41 LYS C 1.0 -72.0 -52.0 PHI 66 66 A 41 LYS N A 41 LYS CA A 41 LYS C A 42 ILE N 1.0 -54.0 -34.0 PSI 67 67 A 41 LYS C A 42 ILE N A 42 ILE CA A 42 ILE C 1.0 -74.0 -54.0 PHI 68 68 A 42 ILE N A 42 ILE CA A 42 ILE C A 43 TYR N 1.0 -53.0 -33.0 PSI 69 69 A 42 ILE C A 43 TYR N A 43 TYR CA A 43 TYR C 1.0 -73.0 -45.0 PHI 70 70 A 43 TYR N A 43 TYR CA A 43 TYR C A 44 ARG N 1.0 -58.0 -34.0 PSI 71 71 A 43 TYR C A 44 ARG N A 44 ARG CA A 44 ARG C 1.0 -70.0 -50.0 PHI 72 72 A 44 ARG N A 44 ARG CA A 44 ARG C A 45 LEU N 1.0 -52.0 -28.0 PSI 73 73 A 44 ARG C A 45 LEU N A 45 LEU CA A 45 LEU C 1.0 -78.0 -54.0 PHI 74 74 A 45 LEU N A 45 LEU CA A 45 LEU C A 46 VAL N 1.0 -58.0 -30.0 PSI 75 75 A 45 LEU C A 46 VAL N A 46 VAL CA A 46 VAL C 1.0 -86.0 -50.0 PHI 76 76 A 46 VAL N A 46 VAL CA A 46 VAL C A 47 HIS N 1.0 -53.0 -29.0 PSI 77 77 A 46 VAL C A 47 HIS N A 47 HIS CA A 47 HIS C 1.0 -80.0 -52.0 PHI 78 78 A 47 HIS N A 47 HIS CA A 47 HIS C A 48 THR N 1.0 -56.0 -12.0 PSI 79 79 A 47 HIS C A 48 THR N A 48 THR CA A 48 THR C 1.0 -74.0 -54.0 PHI 80 80 A 48 THR N A 48 THR CA A 48 THR C A 49 MET N 1.0 -55.0 -35.0 PSI 81 81 A 48 THR C A 49 MET N A 49 MET CA A 49 MET C 1.0 -74.0 -54.0 PHI 82 82 A 49 MET N A 49 MET CA A 49 MET C A 50 LYS N 1.0 -53.0 -25.0 PSI 83 83 A 49 MET C A 50 LYS N A 50 LYS CA A 50 LYS C 1.0 -75.0 -51.0 PHI 84 84 A 50 LYS N A 50 LYS CA A 50 LYS C A 51 GLU N 1.0 -53.0 -33.0 PSI 85 85 A 50 LYS C A 51 GLU N A 51 GLU CA A 51 GLU C 1.0 -74.0 -54.0 PHI 86 86 A 51 GLU N A 51 GLU CA A 51 GLU C A 52 ILE N 1.0 -52.0 -32.0 PSI 87 87 A 51 GLU C A 52 ILE N A 52 ILE CA A 52 ILE C 1.0 -74.0 -54.0 PHI 88 88 A 52 ILE N A 52 ILE CA A 52 ILE C A 53 THR N 1.0 -59.0 -39.0 PSI 89 89 A 52 ILE C A 53 THR N A 53 THR CA A 53 THR C 1.0 -68.0 -48.0 PHI 90 90 A 53 THR N A 53 THR CA A 53 THR C A 54 GLU N 1.0 -54.0 -30.0 PSI 91 91 A 53 THR C A 54 GLU N A 54 GLU CA A 54 GLU C 1.0 -78.0 -58.0 PHI 92 92 A 54 GLU N A 54 GLU CA A 54 GLU C A 55 THR N 1.0 -49.0 -29.0 PSI 93 93 A 54 GLU C A 55 THR N A 55 THR CA A 55 THR C 1.0 -83.0 -51.0 PHI 94 94 A 55 THR N A 55 THR CA A 55 THR C A 56 MET N 1.0 -58.0 -22.0 PSI 95 95 A 58 PHE C A 59 SER N A 59 SER CA A 59 SER C 1.0 -78.0 -34.0 PHI 96 96 A 59 SER N A 59 SER CA A 59 SER C A 60 SER N 1.0 -68.0 -16.0 PSI 97 97 A 59 SER C A 60 SER N A 60 SER CA A 60 SER C 1.0 -80.0 -60.0 PHI 98 98 A 60 SER N A 60 SER CA A 60 SER C A 61 VAL N 1.0 -49.0 -21.0 PSI 99 99 A 60 SER C A 61 VAL N A 61 VAL CA A 61 VAL C 1.0 -74.0 -54.0 PHI 100 100 A 61 VAL N A 61 VAL CA A 61 VAL C A 62 ALA N 1.0 -54.0 -34.0 PSI 101 101 A 61 VAL C A 62 ALA N A 62 ALA CA A 62 ALA C 1.0 -73.0 -53.0 PHI 102 102 A 62 ALA N A 62 ALA CA A 62 ALA C A 63 LYS N 1.0 -54.0 -34.0 PSI 103 103 A 62 ALA C A 63 LYS N A 63 LYS CA A 63 LYS C 1.0 -70.0 -50.0 PHI 104 104 A 63 LYS N A 63 LYS CA A 63 LYS C A 64 VAL N 1.0 -56.0 -32.0 PSI 105 105 A 63 LYS C A 64 VAL N A 64 VAL CA A 64 VAL C 1.0 -77.0 -57.0 PHI 106 106 A 64 VAL N A 64 VAL CA A 64 VAL C A 65 LEU N 1.0 -58.0 -30.0 PSI 107 107 A 64 VAL C A 65 LEU N A 65 LEU CA A 65 LEU C 1.0 -74.0 -54.0 PHI 108 108 A 65 LEU N A 65 LEU CA A 65 LEU C A 66 HIS N 1.0 -53.0 -29.0 PSI 109 109 A 65 LEU C A 66 HIS N A 66 HIS CA A 66 HIS C 1.0 -74.0 -54.0 PHI 110 110 A 66 HIS N A 66 HIS CA A 66 HIS C A 67 THR N 1.0 -59.0 -31.0 PSI 111 111 A 66 HIS C A 67 THR N A 67 THR CA A 67 THR C 1.0 -78.0 -50.0 PHI 112 112 A 67 THR N A 67 THR CA A 67 THR C A 68 ILE N 1.0 -55.0 -27.0 PSI 113 113 A 67 THR C A 68 ILE N A 68 ILE CA A 68 ILE C 1.0 -74.0 -54.0 PHI 114 114 A 68 ILE N A 68 ILE CA A 68 ILE C A 69 MET N 1.0 -54.0 -34.0 PSI 115 115 A 68 ILE C A 69 MET N A 69 MET CA A 69 MET C 1.0 -71.0 -51.0 PHI 116 116 A 69 MET N A 69 MET CA A 69 MET C A 70 ASN N 1.0 -52.0 -32.0 PSI 117 117 A 69 MET C A 70 ASN N A 70 ASN CA A 70 ASN C 1.0 -74.0 -54.0 PHI 118 118 A 70 ASN N A 70 ASN CA A 70 ASN C A 71 LEU N 1.0 -55.0 -19.0 PSI 119 119 A 70 ASN C A 71 LEU N A 71 LEU CA A 71 LEU C 1.0 -74.0 -54.0 PHI 120 120 A 71 LEU N A 71 LEU CA A 71 LEU C A 72 VAL N 1.0 -57.0 -33.0 PSI 121 121 A 71 LEU C A 72 VAL N A 72 VAL CA A 72 VAL C 1.0 -73.0 -53.0 PHI 122 122 A 72 VAL N A 72 VAL CA A 72 VAL C A 73 ASP N 1.0 -58.0 -30.0 PSI 123 123 A 72 VAL C A 73 ASP N A 73 ASP CA A 73 ASP C 1.0 -73.0 -53.0 PHI 124 124 A 73 ASP N A 73 ASP CA A 73 ASP C A 74 LYS N 1.0 -51.0 -31.0 PSI 125 125 A 73 ASP C A 74 LYS N A 74 LYS CA A 74 LYS C 1.0 -75.0 -51.0 PHI 126 126 A 74 LYS N A 74 LYS CA A 74 LYS C A 75 MET N 1.0 -51.0 -31.0 PSI 127 127 A 74 LYS C A 75 MET N A 75 MET CA A 75 MET C 1.0 -75.0 -55.0 PHI 128 128 A 75 MET N A 75 MET CA A 75 MET C A 76 LEU N 1.0 -54.0 -34.0 PSI 129 129 A 75 MET C A 76 LEU N A 76 LEU CA A 76 LEU C 1.0 -75.0 -51.0 PHI 130 130 A 76 LEU N A 76 LEU CA A 76 LEU C A 77 ASN N 1.0 -48.0 -8.0 PSI 131 131 A 84 SER C A 85 ASP N A 85 ASP CA A 85 ASP C 1.0 -76.0 -56.0 PHI 132 132 A 85 ASP N A 85 ASP CA A 85 ASP C A 86 LEU N 1.0 -52.0 -20.0 PSI 133 133 A 85 ASP C A 86 LEU N A 86 LEU CA A 86 LEU C 1.0 -74.0 -54.0 PHI 134 134 A 86 LEU N A 86 LEU CA A 86 LEU C A 87 ILE N 1.0 -55.0 -35.0 PSI 135 135 A 86 LEU C A 87 ILE N A 87 ILE CA A 87 ILE C 1.0 -73.0 -53.0 PHI 136 136 A 87 ILE N A 87 ILE CA A 87 ILE C A 88 ASP N 1.0 -53.0 -33.0 PSI 137 137 A 87 ILE C A 88 ASP N A 88 ASP CA A 88 ASP C 1.0 -71.0 -51.0 PHI 138 138 A 88 ASP N A 88 ASP CA A 88 ASP C A 89 LYS N 1.0 -50.0 -30.0 PSI 139 139 A 88 ASP C A 89 LYS N A 89 LYS CA A 89 LYS C 1.0 -75.0 -55.0 PHI 140 140 A 89 LYS N A 89 LYS CA A 89 LYS C A 90 VAL N 1.0 -58.0 -30.0 PSI 141 141 A 89 LYS C A 90 VAL N A 90 VAL CA A 90 VAL C 1.0 -73.0 -53.0 PHI 142 142 A 90 VAL N A 90 VAL CA A 90 VAL C A 91 LYS N 1.0 -55.0 -31.0 PSI 143 143 A 90 VAL C A 91 LYS N A 91 LYS CA A 91 LYS C 1.0 -72.0 -52.0 PHI 144 144 A 91 LYS N A 91 LYS CA A 91 LYS C A 92 LYS N 1.0 -50.0 -30.0 PSI 145 145 A 91 LYS C A 92 LYS N A 92 LYS CA A 92 LYS C 1.0 -72.0 -52.0 PHI 146 146 A 92 LYS N A 92 LYS CA A 92 LYS C A 93 LYS N 1.0 -56.0 -32.0 PSI 147 147 A 92 LYS C A 93 LYS N A 93 LYS CA A 93 LYS C 1.0 -76.0 -56.0 PHI 148 148 A 93 LYS N A 93 LYS CA A 93 LYS C A 94 LEU N 1.0 -57.0 -21.0 PSI 149 149 A 93 LYS C A 94 LEU N A 94 LEU CA A 94 LEU C 1.0 -79.0 -55.0 PHI 150 150 A 94 LEU N A 94 LEU CA A 94 LEU C A 95 ASP N 1.0 -60.0 -20.0 PSI 151 151 A 94 LEU C A 95 ASP N A 95 ASP CA A 95 ASP C 1.0 -78.0 -50.0 PHI 152 152 A 95 ASP N A 95 ASP CA A 95 ASP C A 96 MET N 1.0 -48.0 -28.0 PSI 153 153 A 95 ASP C A 96 MET N A 96 MET CA A 96 MET C 1.0 -76.0 -56.0 PHI 154 154 A 96 MET N A 96 MET CA A 96 MET C A 97 VAL N 1.0 -56.0 -28.0 PSI 155 155 A 96 MET C A 97 VAL N A 97 VAL CA A 97 VAL C 1.0 -77.0 -53.0 PHI 156 156 A 97 VAL N A 97 VAL CA A 97 VAL C A 98 THR N 1.0 -52.0 -32.0 PSI 157 157 A 97 VAL C A 98 THR N A 98 THR CA A 98 THR C 1.0 -72.0 -52.0 PHI 158 158 A 98 THR N A 98 THR CA A 98 THR C A 99 ARG N 1.0 -56.0 -28.0 PSI 159 159 A 98 THR C A 99 ARG N A 99 ARG CA A 99 ARG C 1.0 -70.0 -50.0 PHI 160 160 A 99 ARG N A 99 ARG CA A 99 ARG C A 100 GLU N 1.0 -57.0 -29.0 PSI 161 161 A 99 ARG C A 100 GLU N A 100 GLU CA A 100 GLU C 1.0 -76.0 -52.0 PHI 162 162 A 100 GLU N A 100 GLU CA A 100 GLU C A 101 LEU N 1.0 -59.0 -27.0 PSI 163 163 A 100 GLU C A 101 LEU N A 101 LEU CA A 101 LEU C 1.0 -72.0 -52.0 PHI 164 164 A 101 LEU N A 101 LEU CA A 101 LEU C A 102 ASP N 1.0 -54.0 -30.0 PSI 165 165 A 101 LEU C A 102 ASP N A 102 ASP CA A 102 ASP C 1.0 -78.0 -54.0 PHI 166 166 A 102 ASP N A 102 ASP CA A 102 ASP C A 103 LYS N 1.0 -55.0 -27.0 PSI 167 167 A 102 ASP C A 103 LYS N A 103 LYS CA A 103 LYS C 1.0 -85.0 -49.0 PHI 168 168 A 103 LYS N A 103 LYS CA A 103 LYS C A 104 LYS N 1.0 -55.0 -19.0 PSI 169 169 A 103 LYS C A 104 LYS N A 104 LYS CA A 104 LYS C 1.0 -90.0 -58.0 PHI 170 170 A 104 LYS N A 104 LYS CA A 104 LYS C A 105 VAL N 1.0 -79.0 33.0 PSI 171 171 A 104 LYS C A 105 VAL N A 105 VAL CA A 105 VAL C 1.0 -120.0 -40.0 PHI 172 172 A 105 VAL N A 105 VAL CA A 105 VAL C A 106 SER N 1.0 -69.0 -1.0 PSI stop_ save_