data_nef_c19354_2mah 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_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 16 CYS SG 1 81 CYS SG 1 26 CYS SG 1 74 CYS SG 1 65 CYS SG 1 105 CYS SG 1 98 CYS SG 1 120 CYS SG stop_ 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 12 SER start . . 2 A 13 GLY middle . false 3 A 14 LEU middle . . 4 A 15 VAL middle . . 5 A 16 PRO middle . false 6 A 17 ARG middle . . 7 A 18 GLY middle . false 8 A 19 SER middle . . 9 A 20 HIS middle . . 10 A 21 MET middle . . 11 A 22 VAL middle . . 12 A 23 ARG middle . . 13 A 24 ARG middle . . 14 A 25 ALA middle . . 15 A 26 ARG middle . . 16 A 27 CYS middle -HG . 17 A 28 TYR middle . . 18 A 29 PRO middle . false 19 A 30 THR middle . . 20 A 31 SER middle . . 21 A 32 ASN middle . . 22 A 33 ALA middle . . 23 A 34 THR middle . . 24 A 35 ASN middle . . 25 A 36 THR middle . . 26 A 37 CYS middle -HG . 27 A 38 PHE middle . . 28 A 39 GLY middle . false 29 A 40 SER middle . . 30 A 41 LYS middle . . 31 A 42 LEU middle . . 32 A 43 PRO middle . false 33 A 44 TYR middle . . 34 A 45 GLU middle . . 35 A 46 LEU middle . . 36 A 47 SER middle . . 37 A 48 SER middle . . 38 A 49 LEU middle . . 39 A 50 ASP middle . . 40 A 51 LEU middle . . 41 A 52 THR middle . . 42 A 53 ASP middle . . 43 A 54 PHE middle . . 44 A 55 HIS middle . . 45 A 56 THR middle . . 46 A 57 GLU middle . . 47 A 58 LYS middle . . 48 A 59 GLU middle . . 49 A 60 LEU middle . . 50 A 61 ASN middle . . 51 A 62 ASP middle . . 52 A 63 LYS middle . . 53 A 64 LEU middle . . 54 A 65 ASN middle . . 55 A 66 ASP middle . . 56 A 67 TYR middle . . 57 A 68 TYR middle . . 58 A 69 ALA middle . . 59 A 70 LEU middle . . 60 A 71 LYS middle . . 61 A 72 HIS middle . . 62 A 73 VAL middle . . 63 A 74 PRO middle . false 64 A 75 LYS middle . . 65 A 76 CYS middle -HG . 66 A 77 TRP middle . . 67 A 78 ALA middle . . 68 A 79 ALA middle . . 69 A 80 ILE middle . . 70 A 81 GLN middle . . 71 A 82 PRO middle . false 72 A 83 PHE middle . . 73 A 84 LEU middle . . 74 A 85 CYS middle -HG . 75 A 86 ALA middle . . 76 A 87 VAL middle . . 77 A 88 PHE middle . . 78 A 89 LYS middle . . 79 A 90 PRO middle . false 80 A 91 LYS middle . . 81 A 92 CYS middle -HG . 82 A 93 GLU middle . . 83 A 94 LYS middle . . 84 A 95 ILE middle . . 85 A 96 ASN middle . . 86 A 97 GLY middle . false 87 A 98 GLU middle . . 88 A 99 ASP middle . . 89 A 100 MET middle . . 90 A 101 VAL middle . . 91 A 102 TYR middle . . 92 A 103 LEU middle . . 93 A 104 PRO middle . false 94 A 105 SER middle . . 95 A 106 TYR middle . . 96 A 107 GLU middle . . 97 A 108 MET middle . . 98 A 109 CYS middle -HG . 99 A 110 ARG middle . . 100 A 111 ILE middle . . 101 A 112 THR middle . . 102 A 113 MET middle . . 103 A 114 GLU middle . . 104 A 115 PRO middle . false 105 A 116 CYS middle -HG . 106 A 117 ARG middle . . 107 A 118 ILE middle . . 108 A 119 LEU middle . . 109 A 120 TYR middle . . 110 A 121 ASN middle . . 111 A 122 THR middle . . 112 A 123 THR middle . . 113 A 124 PHE middle . . 114 A 125 PHE middle . . 115 A 126 PRO middle . false 116 A 127 LYS middle . . 117 A 128 PHE middle . . 118 A 129 LEU middle . . 119 A 130 ARG middle . . 120 A 131 CYS middle -HG . 121 A 132 ASN middle . . 122 A 133 GLU middle . . 123 A 134 THR middle . . 124 A 135 LEU middle . . 125 A 136 PHE middle . . 126 A 137 PRO middle . false 127 A 138 THR middle . . 128 A 139 LYS end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 12 SER H1 H 1 8.442 0.020 A 12 SER HA H 1 4.394 0.020 A 12 SER HBx H 1 3.739 0.020 A 12 SER HBy H 1 3.739 0.020 A 12 SER C C 13 175.080 0.300 A 12 SER CA C 13 58.057 0.300 A 12 SER CB C 13 63.889 0.300 A 12 SER N N 15 118.102 0.300 A 13 GLY H H 1 8.335 0.020 A 13 GLY HAx H 1 3.816 0.020 A 13 GLY HAy H 1 3.816 0.020 A 13 GLY C C 13 173.560 0.300 A 13 GLY CA C 13 45.111 0.300 A 13 GLY N N 15 110.400 0.300 A 14 LEU H H 1 7.915 0.020 A 14 LEU HA H 1 4.378 0.020 A 14 LEU HBy H 1 1.495 0.020 A 14 LEU HBx H 1 1.366 0.020 A 14 LEU HDx% H 1 0.666 0.020 A 14 LEU HDy% H 1 0.666 0.020 A 14 LEU C C 13 177.119 0.300 A 14 LEU CA C 13 54.838 0.300 A 14 LEU CB C 13 42.429 0.300 A 14 LEU CDx C 13 23.463 0.300 A 14 LEU CG C 13 27.222 0.300 A 14 LEU N N 15 121.222 0.300 A 15 VAL H H 1 8.297 0.020 A 15 VAL HA H 1 4.335 0.020 A 15 VAL HB H 1 1.867 0.020 A 15 VAL HGx% H 1 0.755 0.020 A 15 VAL HGy% H 1 0.734 0.020 A 15 VAL C C 13 175.602 0.300 A 15 VAL CA C 13 59.375 0.300 A 15 VAL CB C 13 33.197 0.300 A 15 VAL CGy C 13 20.610 0.300 A 15 VAL CGx C 13 20.218 0.300 A 15 VAL N N 15 123.222 0.300 A 16 PRO HA H 1 4.379 0.020 A 16 PRO HBx H 1 2.131 0.020 A 16 PRO HBy H 1 2.131 0.020 A 16 PRO HDx H 1 3.672 0.020 A 16 PRO HDy H 1 3.672 0.020 A 16 PRO HGx H 1 1.788 0.020 A 16 PRO HGy H 1 1.788 0.020 A 16 PRO CA C 13 62.925 0.300 A 16 PRO CB C 13 32.043 0.300 A 16 PRO CD C 13 50.834 0.300 A 16 PRO CG C 13 27.031 0.300 A 17 ARG H H 1 8.469 0.020 A 17 ARG HA H 1 4.219 0.020 A 17 ARG HBx H 1 1.688 0.020 A 17 ARG HBy H 1 1.688 0.020 A 17 ARG HDx H 1 3.028 0.020 A 17 ARG HDy H 1 3.028 0.020 A 17 ARG HE H 1 7.198 0.020 A 17 ARG HGx H 1 1.485 0.020 A 17 ARG HGy H 1 1.485 0.020 A 17 ARG C C 13 176.586 0.300 A 17 ARG CA C 13 55.479 0.300 A 17 ARG CB C 13 30.889 0.300 A 17 ARG CD C 13 43.224 0.300 A 17 ARG CG C 13 30.815 0.300 A 17 ARG N N 15 122.742 0.300 A 18 GLY H H 1 8.538 0.020 A 18 GLY HAy H 1 3.933 0.020 A 18 GLY HAx H 1 3.750 0.020 A 18 GLY C C 13 174.453 0.300 A 18 GLY CA C 13 45.670 0.300 A 18 GLY N N 15 111.993 0.300 A 19 SER HA H 1 4.318 0.020 A 19 SER HBx H 1 3.685 0.020 A 19 SER HBy H 1 3.685 0.020 A 19 SER CA C 13 58.480 0.300 A 19 SER CB C 13 63.535 0.300 A 20 HIS H H 1 8.344 0.020 A 20 HIS HA H 1 4.678 0.020 A 20 HIS HBy H 1 3.096 0.020 A 20 HIS HBx H 1 2.960 0.020 A 20 HIS HD2 H 1 6.971 0.020 A 20 HIS HE1 H 1 7.694 0.020 A 20 HIS C C 13 174.263 0.300 A 20 HIS CA C 13 55.889 0.300 A 20 HIS CB C 13 32.027 0.300 A 20 HIS CD2 C 13 120.436 0.300 A 20 HIS CE1 C 13 138.640 0.300 A 20 HIS N N 15 120.039 0.300 A 21 MET H H 1 8.587 0.020 A 21 MET HA H 1 4.676 0.020 A 21 MET HBx H 1 1.838 0.020 A 21 MET HBy H 1 1.838 0.020 A 21 MET HE% H 1 1.845 0.020 A 21 MET HGy H 1 2.155 0.020 A 21 MET HGx H 1 1.906 0.020 A 21 MET C C 13 174.808 0.300 A 21 MET CA C 13 54.232 0.300 A 21 MET CB C 13 32.377 0.300 A 21 MET CE C 13 16.821 0.300 A 21 MET CG C 13 32.481 0.300 A 21 MET N N 15 120.453 0.300 A 22 VAL H H 1 7.805 0.020 A 22 VAL HA H 1 5.297 0.020 A 22 VAL HB H 1 1.461 0.020 A 22 VAL HG1% H 1 0.422 0.020 A 22 VAL HG2% H 1 -0.260 0.020 A 22 VAL C C 13 175.218 0.300 A 22 VAL CA C 13 57.885 0.300 A 22 VAL CB C 13 35.895 0.300 A 22 VAL CGx C 13 18.515 0.300 A 22 VAL CGy C 13 20.273 0.300 A 22 VAL N N 15 112.794 0.300 A 23 ARG H H 1 8.430 0.020 A 23 ARG HA H 1 4.578 0.020 A 23 ARG HBy H 1 1.638 0.020 A 23 ARG HBx H 1 1.534 0.020 A 23 ARG HDx H 1 2.977 0.020 A 23 ARG HDy H 1 2.977 0.020 A 23 ARG HGx H 1 1.480 0.020 A 23 ARG HGy H 1 1.480 0.020 A 23 ARG C C 13 174.128 0.300 A 23 ARG CA C 13 54.192 0.300 A 23 ARG CB C 13 34.757 0.300 A 23 ARG CD C 13 43.850 0.300 A 23 ARG CG C 13 26.618 0.300 A 23 ARG N N 15 117.854 0.300 A 24 ARG H H 1 8.569 0.020 A 24 ARG HA H 1 4.619 0.020 A 24 ARG HBx H 1 1.723 0.020 A 24 ARG HBy H 1 1.723 0.020 A 24 ARG HDx H 1 3.168 0.020 A 24 ARG HDy H 1 3.168 0.020 A 24 ARG HE H 1 7.419 0.020 A 24 ARG HGx H 1 1.517 0.020 A 24 ARG HGy H 1 1.517 0.020 A 24 ARG C C 13 176.265 0.300 A 24 ARG CA C 13 57.824 0.300 A 24 ARG CB C 13 29.913 0.300 A 24 ARG CD C 13 43.181 0.300 A 24 ARG CG C 13 28.214 0.300 A 24 ARG N N 15 124.928 0.300 A 25 ALA H H 1 8.082 0.020 A 25 ALA HA H 1 4.379 0.020 A 25 ALA HB% H 1 1.236 0.020 A 25 ALA C C 13 174.173 0.300 A 25 ALA CA C 13 51.382 0.300 A 25 ALA CB C 13 23.050 0.300 A 25 ALA N N 15 127.390 0.300 A 26 ARG H H 1 8.133 0.020 A 26 ARG HA H 1 4.692 0.020 A 26 ARG HBy H 1 1.800 0.020 A 26 ARG HBx H 1 1.745 0.020 A 26 ARG HDx H 1 3.180 0.020 A 26 ARG HDy H 1 3.180 0.020 A 26 ARG HE H 1 7.313 0.020 A 26 ARG HGx H 1 1.587 0.020 A 26 ARG HGy H 1 1.587 0.020 A 26 ARG C C 13 177.847 0.300 A 26 ARG CA C 13 55.271 0.300 A 26 ARG CB C 13 31.215 0.300 A 26 ARG CD C 13 43.086 0.300 A 26 ARG CG C 13 26.896 0.300 A 26 ARG N N 15 116.820 0.300 A 27 CYS H H 1 9.709 0.020 A 27 CYS HA H 1 5.732 0.020 A 27 CYS HBy H 1 3.014 0.020 A 27 CYS HBx H 1 2.514 0.020 A 27 CYS C C 13 175.288 0.300 A 27 CYS CA C 13 51.785 0.300 A 27 CYS CB C 13 38.246 0.300 A 27 CYS N N 15 126.567 0.300 A 28 TYR H H 1 8.870 0.020 A 28 TYR HA H 1 5.079 0.020 A 28 TYR HB2 H 1 3.040 0.020 A 28 TYR HB3 H 1 2.699 0.020 A 28 TYR HD1 H 1 6.785 0.020 A 28 TYR HD2 H 1 6.785 0.020 A 28 TYR HE1 H 1 6.318 0.020 A 28 TYR HE2 H 1 6.318 0.020 A 28 TYR CA C 13 54.951 0.300 A 28 TYR CB C 13 39.807 0.300 A 28 TYR CDy C 13 134.091 0.300 A 28 TYR CEy C 13 116.951 0.300 A 28 TYR N N 15 120.309 0.300 A 29 PRO HA H 1 4.836 0.020 A 29 PRO HBy H 1 2.030 0.020 A 29 PRO HBx H 1 1.936 0.020 A 29 PRO HDy H 1 3.862 0.020 A 29 PRO HDx H 1 3.712 0.020 A 29 PRO HG2 H 1 2.185 0.020 A 29 PRO HG3 H 1 1.994 0.020 A 29 PRO CA C 13 61.773 0.300 A 29 PRO CB C 13 31.173 0.300 A 29 PRO CD C 13 50.108 0.300 A 29 PRO CG C 13 27.009 0.300 A 30 THR H H 1 7.978 0.020 A 30 THR HA H 1 4.253 0.020 A 30 THR HB H 1 4.041 0.020 A 30 THR HG2% H 1 0.885 0.020 A 30 THR C C 13 173.688 0.300 A 30 THR CA C 13 61.324 0.300 A 30 THR CB C 13 70.191 0.300 A 30 THR CG2 C 13 21.227 0.300 A 30 THR N N 15 115.177 0.300 A 31 SER H H 1 8.451 0.020 A 31 SER HA H 1 4.702 0.020 A 31 SER HBy H 1 4.058 0.020 A 31 SER HBx H 1 3.811 0.020 A 31 SER C C 13 175.079 0.300 A 31 SER CA C 13 57.057 0.300 A 31 SER CB C 13 66.020 0.300 A 31 SER N N 15 116.822 0.300 A 32 ASN H H 1 8.802 0.020 A 32 ASN HA H 1 4.385 0.020 A 32 ASN HBx H 1 2.715 0.020 A 32 ASN HBy H 1 2.715 0.020 A 32 ASN HD2y H 1 7.564 0.020 A 32 ASN HD2x H 1 6.893 0.020 A 32 ASN C C 13 175.705 0.300 A 32 ASN CA C 13 55.564 0.300 A 32 ASN CB C 13 37.637 0.300 A 32 ASN N N 15 118.803 0.300 A 32 ASN ND2 N 15 112.721 0.300 A 33 ALA H H 1 8.004 0.020 A 33 ALA HA H 1 4.262 0.020 A 33 ALA HB% H 1 1.299 0.020 A 33 ALA C C 13 179.229 0.300 A 33 ALA CA C 13 53.087 0.300 A 33 ALA CB C 13 19.563 0.300 A 33 ALA N N 15 118.571 0.300 A 34 THR H H 1 7.551 0.020 A 34 THR HA H 1 4.581 0.020 A 34 THR HB H 1 4.653 0.020 A 34 THR HG2% H 1 0.945 0.020 A 34 THR C C 13 175.334 0.300 A 34 THR CA C 13 60.586 0.300 A 34 THR CB C 13 70.195 0.300 A 34 THR CG2 C 13 21.698 0.300 A 34 THR N N 15 106.312 0.300 A 35 ASN H H 1 7.897 0.020 A 35 ASN HA H 1 4.528 0.020 A 35 ASN HBy H 1 3.194 0.020 A 35 ASN HBx H 1 2.633 0.020 A 35 ASN HD2y H 1 7.285 0.020 A 35 ASN HD2x H 1 6.414 0.020 A 35 ASN C C 13 174.221 0.300 A 35 ASN CA C 13 52.790 0.300 A 35 ASN CB C 13 36.768 0.300 A 35 ASN N N 15 122.599 0.300 A 35 ASN ND2 N 15 106.804 0.300 A 36 THR H H 1 7.490 0.020 A 36 THR HA H 1 4.979 0.020 A 36 THR HB H 1 3.486 0.020 A 36 THR HG2% H 1 0.841 0.020 A 36 THR C C 13 173.651 0.300 A 36 THR CA C 13 59.011 0.300 A 36 THR CB C 13 72.745 0.300 A 36 THR CG2 C 13 20.913 0.300 A 36 THR N N 15 107.151 0.300 A 37 CYS H H 1 8.632 0.020 A 37 CYS HA H 1 4.095 0.020 A 37 CYS HBy H 1 2.919 0.020 A 37 CYS HBx H 1 2.802 0.020 A 37 CYS C C 13 173.688 0.300 A 37 CYS CA C 13 55.634 0.300 A 37 CYS CB C 13 45.854 0.300 A 37 CYS N N 15 118.809 0.300 A 38 PHE H H 1 9.018 0.020 A 38 PHE HA H 1 4.275 0.020 A 38 PHE HBy H 1 3.301 0.020 A 38 PHE HBx H 1 3.021 0.020 A 38 PHE HDx H 1 6.883 0.020 A 38 PHE HDy H 1 6.883 0.020 A 38 PHE HEx H 1 6.886 0.020 A 38 PHE HEy H 1 6.886 0.020 A 38 PHE HZ H 1 7.334 0.020 A 38 PHE C C 13 176.261 0.300 A 38 PHE CA C 13 59.067 0.300 A 38 PHE CB C 13 36.576 0.300 A 38 PHE CDy C 13 132.752 0.300 A 38 PHE CEy C 13 130.730 0.300 A 38 PHE CZ C 13 131.440 0.300 A 38 PHE N N 15 128.190 0.300 A 39 GLY H H 1 8.566 0.020 A 39 GLY HAy H 1 4.239 0.020 A 39 GLY HAx H 1 3.561 0.020 A 39 GLY C C 13 174.173 0.300 A 39 GLY CA C 13 45.112 0.300 A 39 GLY N N 15 104.504 0.300 A 40 SER H H 1 7.533 0.020 A 40 SER HA H 1 4.529 0.020 A 40 SER HBx H 1 3.730 0.020 A 40 SER HBy H 1 3.730 0.020 A 40 SER C C 13 173.873 0.300 A 40 SER CA C 13 57.436 0.300 A 40 SER CB C 13 63.718 0.300 A 40 SER N N 15 116.201 0.300 A 41 LYS H H 1 8.768 0.020 A 41 LYS HA H 1 4.056 0.020 A 41 LYS HBx H 1 1.538 0.020 A 41 LYS HBy H 1 1.538 0.020 A 41 LYS HDx H 1 1.417 0.020 A 41 LYS HDy H 1 1.417 0.020 A 41 LYS HEx H 1 2.785 0.020 A 41 LYS HEy H 1 2.785 0.020 A 41 LYS HGx H 1 1.198 0.020 A 41 LYS HGy H 1 1.198 0.020 A 41 LYS C C 13 176.632 0.300 A 41 LYS CA C 13 56.409 0.300 A 41 LYS CB C 13 32.169 0.300 A 41 LYS CD C 13 28.605 0.300 A 41 LYS CE C 13 41.628 0.300 A 41 LYS CG C 13 24.365 0.300 A 41 LYS N N 15 127.456 0.300 A 42 LEU H H 1 8.304 0.020 A 42 LEU HA H 1 4.120 0.020 A 42 LEU HBy H 1 1.323 0.020 A 42 LEU HBx H 1 0.205 0.020 A 42 LEU HDx% H 1 0.630 0.020 A 42 LEU HDy% H 1 0.626 0.020 A 42 LEU HG H 1 1.239 0.020 A 42 LEU CA C 13 52.010 0.300 A 42 LEU CB C 13 40.680 0.300 A 42 LEU CDy C 13 25.453 0.300 A 42 LEU CDx C 13 22.219 0.300 A 42 LEU CG C 13 26.621 0.300 A 42 LEU N N 15 128.016 0.300 A 43 PRO HA H 1 4.453 0.020 A 43 PRO HBy H 1 2.145 0.020 A 43 PRO HBx H 1 1.926 0.020 A 43 PRO HDy H 1 3.530 0.020 A 43 PRO HDx H 1 3.027 0.020 A 43 PRO HGy H 1 1.950 0.020 A 43 PRO HGx H 1 1.776 0.020 A 43 PRO CA C 13 62.807 0.300 A 43 PRO CB C 13 29.625 0.300 A 43 PRO CD C 13 49.961 0.300 A 43 PRO CG C 13 26.537 0.300 A 44 TYR H H 1 6.311 0.020 A 44 TYR HA H 1 4.689 0.020 A 44 TYR HBy H 1 3.173 0.020 A 44 TYR HBx H 1 3.026 0.020 A 44 TYR HDx H 1 6.836 0.020 A 44 TYR HDy H 1 6.836 0.020 A 44 TYR HEx H 1 6.525 0.020 A 44 TYR HEy H 1 6.525 0.020 A 44 TYR C C 13 175.239 0.300 A 44 TYR CA C 13 53.718 0.300 A 44 TYR CB C 13 38.637 0.300 A 44 TYR CDx C 13 134.566 0.300 A 44 TYR CEx C 13 117.894 0.300 A 44 TYR N N 15 116.871 0.300 A 45 GLU H H 1 8.591 0.020 A 45 GLU HA H 1 4.138 0.020 A 45 GLU HBx H 1 1.864 0.020 A 45 GLU HBy H 1 1.864 0.020 A 45 GLU HGx H 1 2.135 0.020 A 45 GLU HGy H 1 2.135 0.020 A 45 GLU C C 13 176.282 0.300 A 45 GLU CA C 13 57.502 0.300 A 45 GLU CB C 13 31.105 0.300 A 45 GLU CG C 13 36.100 0.300 A 45 GLU N N 15 118.221 0.300 A 46 LEU H H 1 8.176 0.020 A 46 LEU HA H 1 4.974 0.020 A 46 LEU HBy H 1 2.217 0.020 A 46 LEU HBx H 1 0.963 0.020 A 46 LEU HDx% H 1 0.713 0.020 A 46 LEU HDy% H 1 0.588 0.020 A 46 LEU HG H 1 1.507 0.020 A 46 LEU C C 13 175.420 0.300 A 46 LEU CA C 13 53.202 0.300 A 46 LEU CB C 13 43.587 0.300 A 46 LEU CDy C 13 25.498 0.300 A 46 LEU CDx C 13 23.139 0.300 A 46 LEU CG C 13 27.153 0.300 A 46 LEU N N 15 119.826 0.300 A 47 SER H H 1 7.924 0.020 A 47 SER HA H 1 5.020 0.020 A 47 SER HBy H 1 3.208 0.020 A 47 SER HBx H 1 2.838 0.020 A 47 SER C C 13 173.833 0.300 A 47 SER CA C 13 53.006 0.300 A 47 SER CB C 13 64.691 0.300 A 47 SER N N 15 111.561 0.300 A 48 SER H H 1 8.628 0.020 A 48 SER HA H 1 4.841 0.020 A 48 SER HBx H 1 3.016 0.020 A 48 SER HBy H 1 3.016 0.020 A 48 SER C C 13 175.602 0.300 A 48 SER CA C 13 57.388 0.300 A 48 SER CB C 13 66.333 0.300 A 48 SER N N 15 111.459 0.300 A 49 LEU H H 1 9.519 0.020 A 49 LEU HA H 1 4.383 0.020 A 49 LEU HBx H 1 1.551 0.020 A 49 LEU HBy H 1 1.551 0.020 A 49 LEU HDx% H 1 0.413 0.020 A 49 LEU HDy% H 1 0.552 0.020 A 49 LEU HG H 1 1.294 0.020 A 49 LEU C C 13 179.571 0.300 A 49 LEU CA C 13 56.032 0.300 A 49 LEU CB C 13 41.904 0.300 A 49 LEU CDy C 13 25.003 0.300 A 49 LEU CDx C 13 24.013 0.300 A 49 LEU CG C 13 26.938 0.300 A 49 LEU N N 15 128.995 0.300 A 50 ASP H H 1 8.191 0.020 A 50 ASP HA H 1 4.168 0.020 A 50 ASP HBy H 1 2.754 0.020 A 50 ASP HBx H 1 2.418 0.020 A 50 ASP C C 13 176.486 0.300 A 50 ASP CA C 13 58.352 0.300 A 50 ASP CB C 13 41.259 0.300 A 50 ASP N N 15 115.013 0.300 A 51 LEU H H 1 8.732 0.020 A 51 LEU HA H 1 4.329 0.020 A 51 LEU HBy H 1 2.141 0.020 A 51 LEU HBx H 1 1.470 0.020 A 51 LEU HDx% H 1 0.645 0.020 A 51 LEU HDy% H 1 0.645 0.020 A 51 LEU HG H 1 1.056 0.020 A 51 LEU C C 13 175.556 0.300 A 51 LEU CA C 13 54.483 0.300 A 51 LEU CB C 13 39.219 0.300 A 51 LEU CDx C 13 21.976 0.300 A 51 LEU CG C 13 26.318 0.300 A 51 LEU N N 15 118.298 0.300 A 52 THR H H 1 7.574 0.020 A 52 THR HA H 1 2.784 0.020 A 52 THR HB H 1 2.647 0.020 A 52 THR HG2% H 1 0.328 0.020 A 52 THR C C 13 172.812 0.300 A 52 THR CA C 13 58.759 0.300 A 52 THR CB C 13 71.985 0.300 A 52 THR CG2 C 13 20.435 0.300 A 52 THR N N 15 106.427 0.300 A 53 ASP HA H 1 4.398 0.020 A 53 ASP HB2 H 1 2.459 0.020 A 53 ASP HB3 H 1 2.076 0.020 A 53 ASP CA C 13 52.757 0.300 A 53 ASP CB C 13 40.737 0.300 A 54 PHE H H 1 7.575 0.020 A 54 PHE HA H 1 4.498 0.020 A 54 PHE HBy H 1 3.109 0.020 A 54 PHE HBx H 1 2.648 0.020 A 54 PHE HDx H 1 7.151 0.020 A 54 PHE HDy H 1 7.151 0.020 A 54 PHE HEx H 1 7.407 0.020 A 54 PHE HEy H 1 7.407 0.020 A 54 PHE HZ H 1 6.935 0.020 A 54 PHE C C 13 176.169 0.300 A 54 PHE CA C 13 57.477 0.300 A 54 PHE CB C 13 39.270 0.300 A 54 PHE CDx C 13 131.518 0.300 A 54 PHE CEx C 13 132.594 0.300 A 54 PHE CZ C 13 131.862 0.300 A 54 PHE N N 15 117.929 0.300 A 55 HIS H H 1 9.230 0.020 A 55 HIS HA H 1 4.585 0.020 A 55 HIS HBy H 1 3.258 0.020 A 55 HIS HBx H 1 3.071 0.020 A 55 HIS HD2 H 1 7.098 0.020 A 55 HIS HE1 H 1 8.077 0.020 A 55 HIS C C 13 175.080 0.300 A 55 HIS CA C 13 56.439 0.300 A 55 HIS CB C 13 31.104 0.300 A 55 HIS CD2 C 13 119.685 0.300 A 55 HIS CE1 C 13 137.643 0.300 A 55 HIS N N 15 115.333 0.300 A 56 THR H H 1 7.343 0.020 A 56 THR HA H 1 4.528 0.020 A 56 THR HB H 1 4.387 0.020 A 56 THR HG2% H 1 1.096 0.020 A 56 THR C C 13 173.696 0.300 A 56 THR CA C 13 58.725 0.300 A 56 THR CB C 13 72.851 0.300 A 56 THR CG2 C 13 21.622 0.300 A 56 THR N N 15 106.891 0.300 A 57 GLU H H 1 8.841 0.020 A 57 GLU HA H 1 3.611 0.020 A 57 GLU HBy H 1 1.797 0.020 A 57 GLU HBx H 1 1.528 0.020 A 57 GLU HGy H 1 1.890 0.020 A 57 GLU HGx H 1 1.617 0.020 A 57 GLU C C 13 178.417 0.300 A 57 GLU CA C 13 59.380 0.300 A 57 GLU CB C 13 29.873 0.300 A 57 GLU CG C 13 36.482 0.300 A 57 GLU N N 15 121.798 0.300 A 58 LYS H H 1 8.307 0.020 A 58 LYS HA H 1 3.903 0.020 A 58 LYS HBx H 1 1.751 0.020 A 58 LYS HBy H 1 1.751 0.020 A 58 LYS HDx H 1 1.599 0.020 A 58 LYS HDy H 1 1.599 0.020 A 58 LYS HEx H 1 2.897 0.020 A 58 LYS HEy H 1 2.897 0.020 A 58 LYS HGy H 1 1.288 0.020 A 58 LYS HGx H 1 1.214 0.020 A 58 LYS C C 13 177.745 0.300 A 58 LYS CA C 13 59.470 0.300 A 58 LYS CB C 13 32.130 0.300 A 58 LYS CD C 13 28.386 0.300 A 58 LYS CE C 13 42.016 0.300 A 58 LYS CG C 13 24.437 0.300 A 58 LYS N N 15 121.091 0.300 A 59 GLU H H 1 7.537 0.020 A 59 GLU HA H 1 3.852 0.020 A 59 GLU HBx H 1 1.948 0.020 A 59 GLU HBy H 1 1.948 0.020 A 59 GLU HGy H 1 2.143 0.020 A 59 GLU HGx H 1 2.039 0.020 A 59 GLU C C 13 178.051 0.300 A 59 GLU CA C 13 59.094 0.300 A 59 GLU CB C 13 30.468 0.300 A 59 GLU CG C 13 36.919 0.300 A 59 GLU N N 15 117.790 0.300 A 60 LEU H H 1 7.321 0.020 A 60 LEU HA H 1 3.211 0.020 A 60 LEU HBy H 1 1.810 0.020 A 60 LEU HBx H 1 1.569 0.020 A 60 LEU HDx% H 1 1.021 0.020 A 60 LEU HDy% H 1 1.021 0.020 A 60 LEU HG H 1 1.295 0.020 A 60 LEU C C 13 178.070 0.300 A 60 LEU CA C 13 59.007 0.300 A 60 LEU CB C 13 42.750 0.300 A 60 LEU CDx C 13 24.927 0.300 A 60 LEU CG C 13 27.001 0.300 A 60 LEU N N 15 118.763 0.300 A 61 ASN H H 1 8.335 0.020 A 61 ASN HA H 1 4.127 0.020 A 61 ASN HBy H 1 2.714 0.020 A 61 ASN HBx H 1 2.529 0.020 A 61 ASN HD2y H 1 7.498 0.020 A 61 ASN HD2x H 1 6.842 0.020 A 61 ASN C C 13 177.689 0.300 A 61 ASN CA C 13 57.310 0.300 A 61 ASN CB C 13 39.288 0.300 A 61 ASN N N 15 116.987 0.300 A 61 ASN ND2 N 15 112.590 0.300 A 62 ASP H H 1 8.376 0.020 A 62 ASP HA H 1 4.306 0.020 A 62 ASP HBy H 1 2.629 0.020 A 62 ASP HBx H 1 2.510 0.020 A 62 ASP C C 13 178.868 0.300 A 62 ASP CA C 13 57.510 0.300 A 62 ASP CB C 13 39.596 0.300 A 62 ASP N N 15 120.935 0.300 A 63 LYS H H 1 7.748 0.020 A 63 LYS HA H 1 4.168 0.020 A 63 LYS HBx H 1 1.780 0.020 A 63 LYS HBy H 1 1.780 0.020 A 63 LYS HDx H 1 1.726 0.020 A 63 LYS HDy H 1 1.726 0.020 A 63 LYS HEx H 1 2.938 0.020 A 63 LYS HEy H 1 2.938 0.020 A 63 LYS HGx H 1 1.171 0.020 A 63 LYS HGy H 1 1.171 0.020 A 63 LYS C C 13 179.458 0.300 A 63 LYS CA C 13 55.698 0.300 A 63 LYS CB C 13 31.082 0.300 A 63 LYS CD C 13 28.082 0.300 A 63 LYS CE C 13 41.937 0.300 A 63 LYS CG C 13 24.521 0.300 A 63 LYS N N 15 119.626 0.300 A 64 LEU H H 1 8.221 0.020 A 64 LEU HA H 1 3.688 0.020 A 64 LEU HBy H 1 1.661 0.020 A 64 LEU HBx H 1 1.339 0.020 A 64 LEU HDx% H 1 0.392 0.020 A 64 LEU HDy% H 1 0.046 0.020 A 64 LEU HG H 1 1.130 0.020 A 64 LEU C C 13 178.732 0.300 A 64 LEU CA C 13 57.722 0.300 A 64 LEU CB C 13 41.236 0.300 A 64 LEU CDy C 13 25.602 0.300 A 64 LEU CDx C 13 22.655 0.300 A 64 LEU CG C 13 25.852 0.300 A 64 LEU N N 15 120.255 0.300 A 65 ASN H H 1 7.482 0.020 A 65 ASN HA H 1 4.580 0.020 A 65 ASN HBy H 1 2.914 0.020 A 65 ASN HBx H 1 2.864 0.020 A 65 ASN HD2y H 1 7.775 0.020 A 65 ASN HD2x H 1 6.846 0.020 A 65 ASN C C 13 178.394 0.300 A 65 ASN CA C 13 55.628 0.300 A 65 ASN CB C 13 38.269 0.300 A 65 ASN N N 15 113.630 0.300 A 65 ASN ND2 N 15 113.685 0.300 A 66 ASP H H 1 7.834 0.020 A 66 ASP HA H 1 4.482 0.020 A 66 ASP HBy H 1 2.866 0.020 A 66 ASP HBx H 1 2.455 0.020 A 66 ASP C C 13 179.095 0.300 A 66 ASP CA C 13 56.623 0.300 A 66 ASP CB C 13 39.883 0.300 A 66 ASP N N 15 120.683 0.300 A 67 TYR H H 1 8.132 0.020 A 67 TYR HA H 1 3.984 0.020 A 67 TYR HBy H 1 3.380 0.020 A 67 TYR HBx H 1 3.100 0.020 A 67 TYR HDx H 1 7.330 0.020 A 67 TYR HDy H 1 7.330 0.020 A 67 TYR HEx H 1 6.750 0.020 A 67 TYR HEy H 1 6.750 0.020 A 67 TYR C C 13 176.554 0.300 A 67 TYR CA C 13 62.142 0.300 A 67 TYR CB C 13 37.436 0.300 A 67 TYR CDy C 13 133.432 0.300 A 67 TYR CEy C 13 118.373 0.300 A 67 TYR N N 15 116.512 0.300 A 68 TYR H H 1 7.558 0.020 A 68 TYR HA H 1 3.632 0.020 A 68 TYR HBx H 1 2.851 0.020 A 68 TYR HBy H 1 2.851 0.020 A 68 TYR HDx H 1 7.174 0.020 A 68 TYR HDy H 1 7.174 0.020 A 68 TYR HEx H 1 6.895 0.020 A 68 TYR HEy H 1 6.895 0.020 A 68 TYR C C 13 177.915 0.300 A 68 TYR CA C 13 61.395 0.300 A 68 TYR CB C 13 37.345 0.300 A 68 TYR CDx C 13 133.470 0.300 A 68 TYR CEx C 13 118.363 0.300 A 68 TYR N N 15 118.786 0.300 A 69 ALA H H 1 7.453 0.020 A 69 ALA HA H 1 3.935 0.020 A 69 ALA HB% H 1 1.354 0.020 A 69 ALA C C 13 179.390 0.300 A 69 ALA CA C 13 54.015 0.300 A 69 ALA CB C 13 18.529 0.300 A 69 ALA N N 15 120.715 0.300 A 70 LEU H H 1 7.764 0.020 A 70 LEU HA H 1 3.765 0.020 A 70 LEU HBy H 1 2.069 0.020 A 70 LEU HBx H 1 1.570 0.020 A 70 LEU HDx% H 1 0.868 0.020 A 70 LEU HDy% H 1 0.670 0.020 A 70 LEU HG H 1 1.641 0.020 A 70 LEU C C 13 177.280 0.300 A 70 LEU CA C 13 56.634 0.300 A 70 LEU CB C 13 41.045 0.300 A 70 LEU CDy C 13 26.081 0.300 A 70 LEU CDx C 13 23.773 0.300 A 70 LEU CG C 13 28.196 0.300 A 70 LEU N N 15 117.212 0.300 A 71 LYS H H 1 7.001 0.020 A 71 LYS HA H 1 3.039 0.020 A 71 LYS HBy H 1 0.896 0.020 A 71 LYS HBx H 1 0.818 0.020 A 71 LYS HDx H 1 1.077 0.020 A 71 LYS HDy H 1 1.077 0.020 A 71 LYS HEy H 1 2.529 0.020 A 71 LYS HEx H 1 2.460 0.020 A 71 LYS HGy H 1 0.127 0.020 A 71 LYS HGx H 1 0.047 0.020 A 71 LYS C C 13 177.121 0.300 A 71 LYS CA C 13 58.865 0.300 A 71 LYS CB C 13 31.247 0.300 A 71 LYS CD C 13 28.957 0.300 A 71 LYS CE C 13 41.183 0.300 A 71 LYS CG C 13 23.834 0.300 A 71 LYS N N 15 118.756 0.300 A 72 HIS H H 1 6.973 0.020 A 72 HIS HA H 1 4.304 0.020 A 72 HIS HBy H 1 3.129 0.020 A 72 HIS HBx H 1 2.868 0.020 A 72 HIS HD2 H 1 7.035 0.020 A 72 HIS HE1 H 1 7.623 0.020 A 72 HIS C C 13 174.232 0.300 A 72 HIS CA C 13 57.245 0.300 A 72 HIS CB C 13 30.221 0.300 A 72 HIS CD2 C 13 120.468 0.300 A 72 HIS CE1 C 13 138.791 0.300 A 72 HIS N N 15 113.331 0.300 A 73 VAL H H 1 7.821 0.020 A 73 VAL HA H 1 4.531 0.020 A 73 VAL HB H 1 2.150 0.020 A 73 VAL HGx% H 1 0.935 0.020 A 73 VAL HGy% H 1 0.770 0.020 A 73 VAL CA C 13 59.159 0.300 A 73 VAL CB C 13 30.604 0.300 A 73 VAL CGy C 13 22.649 0.300 A 73 VAL CGx C 13 20.108 0.300 A 73 VAL N N 15 121.486 0.300 A 74 PRO HA H 1 4.070 0.020 A 74 PRO HBy H 1 2.405 0.020 A 74 PRO HBx H 1 1.977 0.020 A 74 PRO HDy H 1 3.750 0.020 A 74 PRO HDx H 1 3.568 0.020 A 74 PRO HGx H 1 1.998 0.020 A 74 PRO HGy H 1 1.998 0.020 A 74 PRO CA C 13 66.637 0.300 A 74 PRO CB C 13 32.212 0.300 A 74 PRO CD C 13 51.022 0.300 A 74 PRO CG C 13 27.321 0.300 A 75 LYS H H 1 9.234 0.020 A 75 LYS HA H 1 4.099 0.020 A 75 LYS HBx H 1 1.877 0.020 A 75 LYS HBy H 1 1.877 0.020 A 75 LYS HDx H 1 1.718 0.020 A 75 LYS HDy H 1 1.718 0.020 A 75 LYS HEx H 1 2.931 0.020 A 75 LYS HEy H 1 2.931 0.020 A 75 LYS HGx H 1 1.597 0.020 A 75 LYS HGy H 1 1.597 0.020 A 75 LYS C C 13 180.048 0.300 A 75 LYS CA C 13 59.398 0.300 A 75 LYS CB C 13 31.296 0.300 A 75 LYS CD C 13 27.876 0.300 A 75 LYS CE C 13 41.760 0.300 A 75 LYS CG C 13 24.657 0.300 A 75 LYS N N 15 116.832 0.300 A 76 CYS H H 1 7.496 0.020 A 76 CYS HA H 1 4.320 0.020 A 76 CYS HBy H 1 3.230 0.020 A 76 CYS HBx H 1 3.031 0.020 A 76 CYS C C 13 175.012 0.300 A 76 CYS CA C 13 58.297 0.300 A 76 CYS CB C 13 38.803 0.300 A 76 CYS N N 15 116.333 0.300 A 77 TRP H H 1 8.254 0.020 A 77 TRP HA H 1 4.452 0.020 A 77 TRP HBy H 1 3.234 0.020 A 77 TRP HBx H 1 2.964 0.020 A 77 TRP HD1 H 1 7.061 0.020 A 77 TRP HE1 H 1 9.844 0.020 A 77 TRP HE3 H 1 6.825 0.020 A 77 TRP HH2 H 1 5.215 0.020 A 77 TRP HZ2 H 1 6.824 0.020 A 77 TRP HZ3 H 1 6.175 0.020 A 77 TRP C C 13 177.462 0.300 A 77 TRP CA C 13 58.821 0.300 A 77 TRP CB C 13 30.425 0.300 A 77 TRP CD1 C 13 126.832 0.300 A 77 TRP CE3 C 13 119.770 0.300 A 77 TRP CH2 C 13 124.328 0.300 A 77 TRP CZ2 C 13 113.921 0.300 A 77 TRP CZ3 C 13 122.123 0.300 A 77 TRP N N 15 119.987 0.300 A 77 TRP NE1 N 15 128.198 0.300 A 78 ALA H H 1 7.968 0.020 A 78 ALA HA H 1 3.736 0.020 A 78 ALA HB% H 1 1.324 0.020 A 78 ALA C C 13 178.845 0.300 A 78 ALA CA C 13 54.188 0.300 A 78 ALA CB C 13 18.323 0.300 A 78 ALA N N 15 116.093 0.300 A 79 ALA H H 1 6.929 0.020 A 79 ALA HA H 1 4.147 0.020 A 79 ALA HB% H 1 1.321 0.020 A 79 ALA C C 13 178.414 0.300 A 79 ALA CA C 13 53.243 0.300 A 79 ALA CB C 13 19.832 0.300 A 79 ALA N N 15 116.351 0.300 A 80 ILE H H 1 8.695 0.020 A 80 ILE HA H 1 4.218 0.020 A 80 ILE HB H 1 2.045 0.020 A 80 ILE HD1% H 1 1.128 0.020 A 80 ILE HG1x H 1 1.697 0.020 A 80 ILE HG2% H 1 0.958 0.020 A 80 ILE C C 13 176.350 0.300 A 80 ILE CA C 13 62.069 0.300 A 80 ILE CB C 13 39.375 0.300 A 80 ILE CD1 C 13 14.590 0.300 A 80 ILE CG1 C 13 31.092 0.300 A 80 ILE CG2 C 13 17.874 0.300 A 80 ILE N N 15 115.150 0.300 A 81 GLN H H 1 7.315 0.020 A 81 GLN HA H 1 3.332 0.020 A 81 GLN HBx H 1 1.555 0.020 A 81 GLN HBy H 1 1.555 0.020 A 81 GLN HE2y H 1 6.316 0.020 A 81 GLN HE2x H 1 5.640 0.020 A 81 GLN HGy H 1 1.265 0.020 A 81 GLN HGx H 1 1.028 0.020 A 81 GLN C C 13 173.470 0.300 A 81 GLN CA C 13 61.829 0.300 A 81 GLN CB C 13 25.973 0.300 A 81 GLN CG C 13 33.328 0.300 A 81 GLN N N 15 122.564 0.300 A 81 GLN NE2 N 15 109.407 0.300 A 82 PRO HA H 1 4.076 0.020 A 82 PRO HBx H 1 2.131 0.020 A 82 PRO HBy H 1 2.131 0.020 A 82 PRO HDy H 1 3.375 0.020 A 82 PRO HDx H 1 3.268 0.020 A 82 PRO HGx H 1 1.913 0.020 A 82 PRO CA C 13 65.894 0.300 A 82 PRO CB C 13 30.481 0.300 A 82 PRO CD C 13 49.756 0.300 A 82 PRO CG C 13 27.833 0.300 A 83 PHE H H 1 6.892 0.020 A 83 PHE HA H 1 4.289 0.020 A 83 PHE HBy H 1 3.230 0.020 A 83 PHE HBx H 1 2.868 0.020 A 83 PHE HDx H 1 6.865 0.020 A 83 PHE HDy H 1 6.865 0.020 A 83 PHE HEx H 1 7.009 0.020 A 83 PHE HEy H 1 7.009 0.020 A 83 PHE HZ H 1 7.309 0.020 A 83 PHE C C 13 175.919 0.300 A 83 PHE CA C 13 59.712 0.300 A 83 PHE CB C 13 39.329 0.300 A 83 PHE CDy C 13 132.442 0.300 A 83 PHE CEy C 13 130.945 0.300 A 83 PHE CZ C 13 132.380 0.300 A 83 PHE N N 15 119.137 0.300 A 84 LEU H H 1 8.589 0.020 A 84 LEU HA H 1 3.611 0.020 A 84 LEU HBy H 1 1.918 0.020 A 84 LEU HBx H 1 1.004 0.020 A 84 LEU HDx% H 1 0.565 0.020 A 84 LEU HDy% H 1 0.323 0.020 A 84 LEU HG H 1 1.643 0.020 A 84 LEU C C 13 180.297 0.300 A 84 LEU CA C 13 57.952 0.300 A 84 LEU CB C 13 41.645 0.300 A 84 LEU CDy C 13 27.209 0.300 A 84 LEU CDx C 13 22.994 0.300 A 84 LEU CG C 13 26.484 0.300 A 84 LEU N N 15 116.693 0.300 A 85 CYS H H 1 8.001 0.020 A 85 CYS HA H 1 4.127 0.020 A 85 CYS HBy H 1 2.898 0.020 A 85 CYS HBx H 1 2.706 0.020 A 85 CYS C C 13 175.556 0.300 A 85 CYS CA C 13 57.678 0.300 A 85 CYS CB C 13 39.396 0.300 A 85 CYS N N 15 115.085 0.300 A 86 ALA H H 1 7.671 0.020 A 86 ALA HA H 1 3.922 0.020 A 86 ALA HB% H 1 1.380 0.020 A 86 ALA C C 13 177.745 0.300 A 86 ALA CA C 13 54.306 0.300 A 86 ALA CB C 13 18.778 0.300 A 86 ALA N N 15 121.743 0.300 A 87 VAL H H 1 7.460 0.020 A 87 VAL HA H 1 3.735 0.020 A 87 VAL HB H 1 1.511 0.020 A 87 VAL HGx% H 1 0.609 0.020 A 87 VAL HGy% H 1 0.296 0.020 A 87 VAL C C 13 175.806 0.300 A 87 VAL CA C 13 64.622 0.300 A 87 VAL CB C 13 32.936 0.300 A 87 VAL CGx C 13 21.660 0.300 A 87 VAL CGy C 13 23.716 0.300 A 87 VAL N N 15 115.667 0.300 A 88 PHE H H 1 8.930 0.020 A 88 PHE HA H 1 4.048 0.020 A 88 PHE HBy H 1 3.143 0.020 A 88 PHE HBx H 1 2.704 0.020 A 88 PHE HDx H 1 7.374 0.020 A 88 PHE HDy H 1 7.374 0.020 A 88 PHE HEx H 1 7.148 0.020 A 88 PHE HEy H 1 7.148 0.020 A 88 PHE HZ H 1 6.935 0.020 A 88 PHE C C 13 176.192 0.300 A 88 PHE CA C 13 60.420 0.300 A 88 PHE CB C 13 40.182 0.300 A 88 PHE CDx C 13 132.710 0.300 A 88 PHE CEx C 13 129.398 0.300 A 88 PHE CZ C 13 130.249 0.300 A 88 PHE N N 15 115.306 0.300 A 89 LYS H H 1 7.802 0.020 A 89 LYS HA H 1 4.816 0.020 A 89 LYS HBx H 1 1.785 0.020 A 89 LYS HBy H 1 1.785 0.020 A 89 LYS HDy H 1 1.675 0.020 A 89 LYS HDx H 1 1.379 0.020 A 89 LYS HEy H 1 2.815 0.020 A 89 LYS HEx H 1 2.708 0.020 A 89 LYS HGx H 1 1.226 0.020 A 89 LYS HGy H 1 1.226 0.020 A 89 LYS C C 13 184.176 0.300 A 89 LYS CA C 13 53.428 0.300 A 89 LYS CB C 13 33.274 0.300 A 89 LYS CD C 13 29.658 0.300 A 89 LYS CE C 13 42.810 0.300 A 89 LYS CG C 13 25.540 0.300 A 89 LYS N N 15 115.470 0.300 A 90 PRO HA H 1 4.250 0.020 A 90 PRO HBx H 1 2.543 0.020 A 90 PRO HBy H 1 2.543 0.020 A 90 PRO HDy H 1 3.449 0.020 A 90 PRO HDx H 1 3.158 0.020 A 90 PRO HGx H 1 1.902 0.020 A 90 PRO HGy H 1 1.902 0.020 A 90 PRO CA C 13 62.682 0.300 A 90 PRO CB C 13 32.358 0.300 A 90 PRO CD C 13 50.340 0.300 A 90 PRO CG C 13 27.595 0.300 A 91 LYS H H 1 8.537 0.020 A 91 LYS HA H 1 3.039 0.020 A 91 LYS HBy H 1 0.687 0.020 A 91 LYS HBx H 1 -0.075 0.020 A 91 LYS HDy H 1 0.749 0.020 A 91 LYS HDx H 1 0.354 0.020 A 91 LYS HEy H 1 2.183 0.020 A 91 LYS HEx H 1 2.081 0.020 A 91 LYS HGx H 1 0.411 0.020 A 91 LYS HGy H 1 0.411 0.020 A 91 LYS C C 13 173.356 0.300 A 91 LYS CA C 13 58.027 0.300 A 91 LYS CB C 13 31.285 0.300 A 91 LYS CD C 13 28.730 0.300 A 91 LYS CE C 13 40.857 0.300 A 91 LYS CG C 13 25.275 0.300 A 91 LYS N N 15 122.391 0.300 A 92 CYS H H 1 7.037 0.020 A 92 CYS HA H 1 5.391 0.020 A 92 CYS HBy H 1 2.309 0.020 A 92 CYS HBx H 1 1.792 0.020 A 92 CYS C C 13 171.655 0.300 A 92 CYS CA C 13 53.804 0.300 A 92 CYS CB C 13 41.219 0.300 A 92 CYS N N 15 127.562 0.300 A 93 GLU H H 1 9.401 0.020 A 93 GLU HA H 1 4.492 0.020 A 93 GLU HBy H 1 1.894 0.020 A 93 GLU HBx H 1 1.839 0.020 A 93 GLU HGy H 1 2.070 0.020 A 93 GLU HGx H 1 2.026 0.020 A 93 GLU C C 13 173.371 0.300 A 93 GLU CA C 13 54.874 0.300 A 93 GLU CB C 13 34.630 0.300 A 93 GLU CG C 13 35.918 0.300 A 93 GLU N N 15 124.483 0.300 A 94 LYS H H 1 8.526 0.020 A 94 LYS HA H 1 4.581 0.020 A 94 LYS HBy H 1 1.531 0.020 A 94 LYS HBx H 1 1.391 0.020 A 94 LYS HDx H 1 1.433 0.020 A 94 LYS HDy H 1 1.433 0.020 A 94 LYS HEy H 1 2.822 0.020 A 94 LYS HEx H 1 2.767 0.020 A 94 LYS HGy H 1 1.135 0.020 A 94 LYS HGx H 1 1.042 0.020 A 94 LYS C C 13 176.509 0.300 A 94 LYS CA C 13 55.856 0.300 A 94 LYS CB C 13 31.809 0.300 A 94 LYS CD C 13 28.476 0.300 A 94 LYS CE C 13 41.177 0.300 A 94 LYS CG C 13 24.612 0.300 A 94 LYS N N 15 122.694 0.300 A 95 ILE H H 1 9.001 0.020 A 95 ILE HA H 1 4.049 0.020 A 95 ILE HB H 1 1.556 0.020 A 95 ILE HD1% H 1 0.580 0.020 A 95 ILE HG1y H 1 1.365 0.020 A 95 ILE HG1x H 1 1.294 0.020 A 95 ILE HG2% H 1 0.666 0.020 A 95 ILE C C 13 176.337 0.300 A 95 ILE CA C 13 60.847 0.300 A 95 ILE CB C 13 39.625 0.300 A 95 ILE CD1 C 13 12.600 0.300 A 95 ILE CG1 C 13 27.170 0.300 A 95 ILE CG2 C 13 16.511 0.300 A 95 ILE N N 15 128.382 0.300 A 96 ASN H H 1 9.474 0.020 A 96 ASN HA H 1 4.212 0.020 A 96 ASN HBy H 1 2.949 0.020 A 96 ASN HBx H 1 2.666 0.020 A 96 ASN HD2y H 1 7.578 0.020 A 96 ASN HD2x H 1 6.795 0.020 A 96 ASN C C 13 175.496 0.300 A 96 ASN CA C 13 53.970 0.300 A 96 ASN CB C 13 37.238 0.300 A 96 ASN N N 15 127.596 0.300 A 96 ASN ND2 N 15 112.813 0.300 A 97 GLY H H 1 8.476 0.020 A 97 GLY HAy H 1 4.094 0.020 A 97 GLY HAx H 1 3.373 0.020 A 97 GLY C C 13 173.651 0.300 A 97 GLY CA C 13 45.167 0.300 A 97 GLY N N 15 101.656 0.300 A 98 GLU H H 1 7.591 0.020 A 98 GLU HA H 1 4.587 0.020 A 98 GLU HBx H 1 1.804 0.020 A 98 GLU HBy H 1 1.804 0.020 A 98 GLU HGy H 1 2.105 0.020 A 98 GLU HGx H 1 1.999 0.020 A 98 GLU C C 13 174.422 0.300 A 98 GLU CA C 13 54.294 0.300 A 98 GLU CB C 13 32.934 0.300 A 98 GLU CG C 13 35.875 0.300 A 98 GLU N N 15 120.042 0.300 A 99 ASP H H 1 8.489 0.020 A 99 ASP HA H 1 4.340 0.020 A 99 ASP HBy H 1 2.908 0.020 A 99 ASP HBx H 1 2.555 0.020 A 99 ASP C C 13 176.214 0.300 A 99 ASP CA C 13 55.408 0.300 A 99 ASP CB C 13 41.629 0.300 A 99 ASP N N 15 126.603 0.300 A 100 MET H H 1 8.853 0.020 A 100 MET HA H 1 4.911 0.020 A 100 MET HBy H 1 1.787 0.020 A 100 MET HBx H 1 1.278 0.020 A 100 MET HE% H 1 1.723 0.020 A 100 MET HGy H 1 2.468 0.020 A 100 MET HGx H 1 2.342 0.020 A 100 MET C C 13 172.900 0.300 A 100 MET CA C 13 53.649 0.300 A 100 MET CB C 13 35.529 0.300 A 100 MET CE C 13 18.224 0.300 A 100 MET CG C 13 32.804 0.300 A 100 MET N N 15 121.977 0.300 A 101 VAL H H 1 8.964 0.020 A 101 VAL HA H 1 4.814 0.020 A 101 VAL HB H 1 1.559 0.020 A 101 VAL HGx% H 1 0.907 0.020 A 101 VAL HGy% H 1 0.685 0.020 A 101 VAL C C 13 172.991 0.300 A 101 VAL CA C 13 58.203 0.300 A 101 VAL CB C 13 34.629 0.300 A 101 VAL CGy C 13 24.114 0.300 A 101 VAL CGx C 13 21.050 0.300 A 101 VAL N N 15 119.963 0.300 A 102 TYR H H 1 8.137 0.020 A 102 TYR HA H 1 4.444 0.020 A 102 TYR HBy H 1 2.789 0.020 A 102 TYR HBx H 1 2.581 0.020 A 102 TYR HDx H 1 6.750 0.020 A 102 TYR HDy H 1 6.750 0.020 A 102 TYR HEx H 1 6.348 0.020 A 102 TYR HEy H 1 6.348 0.020 A 102 TYR C C 13 176.464 0.300 A 102 TYR CA C 13 57.549 0.300 A 102 TYR CB C 13 38.274 0.300 A 102 TYR CD2 C 13 133.471 0.300 A 102 TYR CE2 C 13 117.567 0.300 A 102 TYR N N 15 125.849 0.300 A 103 LEU H H 1 8.308 0.020 A 103 LEU HA H 1 4.683 0.020 A 103 LEU HBx H 1 1.505 0.020 A 103 LEU HBy H 1 1.505 0.020 A 103 LEU HDx% H 1 0.769 0.020 A 103 LEU HDy% H 1 0.701 0.020 A 103 LEU HG H 1 1.582 0.020 A 103 LEU CA C 13 52.426 0.300 A 103 LEU CB C 13 42.038 0.300 A 103 LEU CDx C 13 24.515 0.300 A 103 LEU CDy C 13 24.681 0.300 A 103 LEU CG C 13 27.028 0.300 A 103 LEU N N 15 123.151 0.300 A 104 PRO HA H 1 4.678 0.020 A 104 PRO HBy H 1 2.237 0.020 A 104 PRO HBx H 1 2.117 0.020 A 104 PRO HDy H 1 3.824 0.020 A 104 PRO HDx H 1 3.659 0.020 A 104 PRO HGy H 1 1.957 0.020 A 104 PRO HGx H 1 1.875 0.020 A 104 PRO CA C 13 61.704 0.300 A 104 PRO CB C 13 32.020 0.300 A 104 PRO CD C 13 50.256 0.300 A 104 PRO CG C 13 27.297 0.300 A 105 SER H H 1 7.668 0.020 A 105 SER HA H 1 4.632 0.020 A 105 SER HB2 H 1 4.265 0.020 A 105 SER HB3 H 1 3.894 0.020 A 105 SER C C 13 175.473 0.300 A 105 SER CA C 13 56.324 0.300 A 105 SER CB C 13 65.193 0.300 A 105 SER N N 15 113.955 0.300 A 106 TYR H H 1 8.492 0.020 A 106 TYR HA H 1 3.724 0.020 A 106 TYR HBy H 1 3.294 0.020 A 106 TYR HBx H 1 2.626 0.020 A 106 TYR HDx H 1 6.950 0.020 A 106 TYR HDy H 1 6.950 0.020 A 106 TYR HEx H 1 6.688 0.020 A 106 TYR HEy H 1 6.688 0.020 A 106 TYR C C 13 178.116 0.300 A 106 TYR CA C 13 62.057 0.300 A 106 TYR CB C 13 37.925 0.300 A 106 TYR CD1 C 13 133.485 0.300 A 106 TYR CE1 C 13 118.180 0.300 A 106 TYR N N 15 122.582 0.300 A 107 GLU H H 1 8.503 0.020 A 107 GLU HA H 1 3.846 0.020 A 107 GLU HBy H 1 1.932 0.020 A 107 GLU HBx H 1 1.701 0.020 A 107 GLU HGx H 1 2.150 0.020 A 107 GLU HGy H 1 2.150 0.020 A 107 GLU C C 13 177.421 0.300 A 107 GLU CA C 13 58.867 0.300 A 107 GLU CB C 13 28.969 0.300 A 107 GLU CG C 13 36.427 0.300 A 107 GLU N N 15 118.362 0.300 A 108 MET H H 1 7.409 0.020 A 108 MET HA H 1 3.708 0.020 A 108 MET HBx H 1 2.139 0.020 A 108 MET HBy H 1 2.139 0.020 A 108 MET HE% H 1 2.006 0.020 A 108 MET HGy H 1 2.526 0.020 A 108 MET HGx H 1 2.456 0.020 A 108 MET C C 13 176.804 0.300 A 108 MET CA C 13 58.648 0.300 A 108 MET CB C 13 33.058 0.300 A 108 MET CE C 13 16.827 0.300 A 108 MET CG C 13 32.282 0.300 A 108 MET N N 15 116.221 0.300 A 109 CYS H H 1 6.817 0.020 A 109 CYS HA H 1 3.857 0.020 A 109 CYS HBy H 1 2.278 0.020 A 109 CYS HBx H 1 2.131 0.020 A 109 CYS C C 13 178.047 0.300 A 109 CYS CA C 13 58.737 0.300 A 109 CYS CB C 13 35.006 0.300 A 109 CYS N N 15 114.131 0.300 A 110 ARG H H 1 8.885 0.020 A 110 ARG HA H 1 3.376 0.020 A 110 ARG HBy H 1 1.404 0.020 A 110 ARG HBx H 1 1.192 0.020 A 110 ARG HDx H 1 2.872 0.020 A 110 ARG HDy H 1 2.872 0.020 A 110 ARG HGx H 1 1.381 0.020 A 110 ARG HGy H 1 1.381 0.020 A 110 ARG C C 13 179.435 0.300 A 110 ARG CA C 13 59.641 0.300 A 110 ARG CB C 13 29.273 0.300 A 110 ARG CD C 13 43.003 0.300 A 110 ARG CG C 13 25.796 0.300 A 110 ARG N N 15 124.629 0.300 A 111 ILE H H 1 7.422 0.020 A 111 ILE HA H 1 3.796 0.020 A 111 ILE HB H 1 1.853 0.020 A 111 ILE HD1% H 1 0.780 0.020 A 111 ILE HG1y H 1 1.412 0.020 A 111 ILE HG1x H 1 1.150 0.020 A 111 ILE HG2% H 1 0.846 0.020 A 111 ILE C C 13 175.624 0.300 A 111 ILE CA C 13 63.811 0.300 A 111 ILE CB C 13 38.229 0.300 A 111 ILE CD1 C 13 14.098 0.300 A 111 ILE CG1 C 13 26.623 0.300 A 111 ILE CG2 C 13 17.501 0.300 A 111 ILE N N 15 113.379 0.300 A 112 THR H H 1 7.574 0.020 A 112 THR HA H 1 3.889 0.020 A 112 THR HB H 1 4.129 0.020 A 112 THR HG2% H 1 1.111 0.020 A 112 THR C C 13 175.798 0.300 A 112 THR CA C 13 62.856 0.300 A 112 THR CB C 13 70.168 0.300 A 112 THR CG2 C 13 22.263 0.300 A 112 THR N N 15 109.403 0.300 A 113 MET H H 1 7.152 0.020 A 113 MET HA H 1 3.541 0.020 A 113 MET HBx H 1 2.070 0.020 A 113 MET HBy H 1 2.070 0.020 A 113 MET HE% H 1 1.862 0.020 A 113 MET HGx H 1 2.455 0.020 A 113 MET HGy H 1 2.455 0.020 A 113 MET C C 13 177.174 0.300 A 113 MET CA C 13 60.235 0.300 A 113 MET CB C 13 32.338 0.300 A 113 MET CE C 13 16.098 0.300 A 113 MET CG C 13 32.327 0.300 A 113 MET N N 15 119.638 0.300 A 114 GLU H H 1 8.580 0.020 A 114 GLU HA H 1 4.114 0.020 A 114 GLU HBy H 1 1.952 0.020 A 114 GLU HBx H 1 1.872 0.020 A 114 GLU HGx H 1 2.105 0.020 A 114 GLU HGy H 1 2.105 0.020 A 114 GLU CA C 13 60.422 0.300 A 114 GLU CB C 13 26.103 0.300 A 114 GLU CG C 13 36.005 0.300 A 114 GLU N N 15 117.224 0.300 A 115 PRO HA H 1 4.304 0.020 A 115 PRO HBy H 1 1.981 0.020 A 115 PRO HBx H 1 1.437 0.020 A 115 PRO HDy H 1 3.597 0.020 A 115 PRO HDx H 1 3.423 0.020 A 115 PRO HGy H 1 1.978 0.020 A 115 PRO HGx H 1 1.907 0.020 A 115 PRO CA C 13 65.128 0.300 A 115 PRO CB C 13 31.141 0.300 A 115 PRO CD C 13 50.204 0.300 A 115 PRO CG C 13 27.893 0.300 A 116 CYS H H 1 7.208 0.020 A 116 CYS HA H 1 4.679 0.020 A 116 CYS HBy H 1 3.187 0.020 A 116 CYS HBx H 1 3.071 0.020 A 116 CYS C C 13 174.808 0.300 A 116 CYS CA C 13 54.060 0.300 A 116 CYS CB C 13 42.879 0.300 A 116 CYS N N 15 111.879 0.300 A 117 ARG H H 1 7.436 0.020 A 117 ARG HA H 1 3.161 0.020 A 117 ARG HBy H 1 1.906 0.020 A 117 ARG HBx H 1 1.642 0.020 A 117 ARG HDx H 1 3.049 0.020 A 117 ARG HDy H 1 3.049 0.020 A 117 ARG HE H 1 7.016 0.020 A 117 ARG HGx H 1 1.368 0.020 A 117 ARG HGy H 1 1.368 0.020 A 117 ARG C C 13 178.210 0.300 A 117 ARG CA C 13 59.743 0.300 A 117 ARG CB C 13 29.486 0.300 A 117 ARG CD C 13 43.243 0.300 A 117 ARG CG C 13 26.057 0.300 A 117 ARG N N 15 123.750 0.300 A 118 ILE H H 1 8.130 0.020 A 118 ILE HA H 1 4.000 0.020 A 118 ILE HB H 1 1.844 0.020 A 118 ILE HD1% H 1 0.788 0.020 A 118 ILE HG1y H 1 1.363 0.020 A 118 ILE HG1x H 1 1.214 0.020 A 118 ILE HG2% H 1 0.831 0.020 A 118 ILE C C 13 176.577 0.300 A 118 ILE CA C 13 63.166 0.300 A 118 ILE CB C 13 37.781 0.300 A 118 ILE CD1 C 13 13.593 0.300 A 118 ILE CG1 C 13 27.844 0.300 A 118 ILE CG2 C 13 17.306 0.300 A 118 ILE N N 15 116.384 0.300 A 119 LEU H H 1 7.771 0.020 A 119 LEU HA H 1 4.540 0.020 A 119 LEU HBy H 1 1.805 0.020 A 119 LEU HBx H 1 1.685 0.020 A 119 LEU HDx% H 1 0.910 0.020 A 119 LEU HDy% H 1 0.826 0.020 A 119 LEU HG H 1 1.504 0.020 A 119 LEU C C 13 178.346 0.300 A 119 LEU CA C 13 54.697 0.300 A 119 LEU CB C 13 42.872 0.300 A 119 LEU CDy C 13 26.603 0.300 A 119 LEU CDx C 13 22.845 0.300 A 119 LEU CG C 13 27.304 0.300 A 119 LEU N N 15 119.738 0.300 A 120 TYR H H 1 7.886 0.020 A 120 TYR HA H 1 4.125 0.020 A 120 TYR HBy H 1 2.965 0.020 A 120 TYR HBx H 1 2.903 0.020 A 120 TYR HDx H 1 6.459 0.020 A 120 TYR HDy H 1 6.459 0.020 A 120 TYR HEx H 1 7.004 0.020 A 120 TYR HEy H 1 7.004 0.020 A 120 TYR C C 13 176.169 0.300 A 120 TYR CA C 13 59.682 0.300 A 120 TYR CB C 13 37.180 0.300 A 120 TYR CD1 C 13 131.938 0.300 A 120 TYR CE1 C 13 120.703 0.300 A 120 TYR N N 15 121.945 0.300 A 121 ASN H H 1 8.228 0.020 A 121 ASN HA H 1 4.885 0.020 A 121 ASN HBy H 1 2.886 0.020 A 121 ASN HBx H 1 2.805 0.020 A 121 ASN HD2y H 1 7.568 0.020 A 121 ASN HD2x H 1 6.795 0.020 A 121 ASN C C 13 175.612 0.300 A 121 ASN CA C 13 52.670 0.300 A 121 ASN CB C 13 38.058 0.300 A 121 ASN N N 15 115.992 0.300 A 121 ASN ND2 N 15 111.975 0.300 A 122 THR H H 1 7.649 0.020 A 122 THR HA H 1 4.682 0.020 A 122 THR HB H 1 4.469 0.020 A 122 THR HG2% H 1 1.288 0.020 A 122 THR C C 13 175.844 0.300 A 122 THR CA C 13 61.815 0.300 A 122 THR CB C 13 72.484 0.300 A 122 THR CG2 C 13 21.264 0.300 A 122 THR N N 15 109.094 0.300 A 123 THR H H 1 8.261 0.020 A 123 THR HA H 1 4.026 0.020 A 123 THR HB H 1 4.134 0.020 A 123 THR HG2% H 1 0.981 0.020 A 123 THR C C 13 175.033 0.300 A 123 THR CA C 13 63.174 0.300 A 123 THR CB C 13 68.529 0.300 A 123 THR CG2 C 13 21.201 0.300 A 123 THR N N 15 112.067 0.300 A 124 PHE H H 1 7.764 0.020 A 124 PHE HA H 1 4.153 0.020 A 124 PHE HBx H 1 2.884 0.020 A 124 PHE HBy H 1 2.884 0.020 A 124 PHE HDx H 1 6.844 0.020 A 124 PHE HDy H 1 6.844 0.020 A 124 PHE HEx H 1 7.025 0.020 A 124 PHE HEy H 1 7.025 0.020 A 124 PHE C C 13 175.398 0.300 A 124 PHE CA C 13 59.890 0.300 A 124 PHE CB C 13 39.668 0.300 A 124 PHE CDy C 13 131.517 0.300 A 124 PHE CEy C 13 131.784 0.300 A 124 PHE N N 15 118.139 0.300 A 125 PHE H H 1 7.670 0.020 A 125 PHE HA H 1 4.662 0.020 A 125 PHE HBy H 1 2.789 0.020 A 125 PHE HBx H 1 2.574 0.020 A 125 PHE HDx H 1 6.754 0.020 A 125 PHE HDy H 1 6.754 0.020 A 125 PHE HEx H 1 7.029 0.020 A 125 PHE HEy H 1 7.029 0.020 A 125 PHE CA C 13 56.245 0.300 A 125 PHE CB C 13 38.810 0.300 A 125 PHE CDx C 13 132.999 0.300 A 125 PHE CEx C 13 130.252 0.300 A 125 PHE N N 15 118.447 0.300 A 126 PRO HA H 1 4.398 0.020 A 126 PRO HBy H 1 2.140 0.020 A 126 PRO HBx H 1 1.387 0.020 A 126 PRO HDy H 1 3.327 0.020 A 126 PRO HDx H 1 3.128 0.020 A 126 PRO HGx H 1 1.651 0.020 A 126 PRO HGy H 1 1.651 0.020 A 126 PRO CA C 13 62.432 0.300 A 126 PRO CB C 13 32.670 0.300 A 126 PRO CD C 13 50.420 0.300 A 126 PRO CG C 13 26.937 0.300 A 127 LYS H H 1 8.565 0.020 A 127 LYS HA H 1 3.580 0.020 A 127 LYS HBx H 1 1.753 0.020 A 127 LYS HBy H 1 1.753 0.020 A 127 LYS HDx H 1 1.587 0.020 A 127 LYS HDy H 1 1.587 0.020 A 127 LYS HEx H 1 2.836 0.020 A 127 LYS HEy H 1 2.836 0.020 A 127 LYS HGy H 1 1.401 0.020 A 127 LYS HGx H 1 1.314 0.020 A 127 LYS C C 13 177.977 0.300 A 127 LYS CA C 13 60.279 0.300 A 127 LYS CB C 13 31.599 0.300 A 127 LYS CD C 13 28.946 0.300 A 127 LYS CE C 13 42.607 0.300 A 127 LYS CG C 13 24.915 0.300 A 127 LYS N N 15 118.753 0.300 A 128 PHE H H 1 6.795 0.020 A 128 PHE HA H 1 4.481 0.020 A 128 PHE HBy H 1 3.487 0.020 A 128 PHE HBx H 1 2.661 0.020 A 128 PHE HDx H 1 7.036 0.020 A 128 PHE HDy H 1 7.036 0.020 A 128 PHE HEx H 1 6.900 0.020 A 128 PHE HEy H 1 6.900 0.020 A 128 PHE HZ H 1 7.343 0.020 A 128 PHE C C 13 173.946 0.300 A 128 PHE CA C 13 57.841 0.300 A 128 PHE CB C 13 36.807 0.300 A 128 PHE CD1 C 13 133.281 0.300 A 128 PHE CE1 C 13 132.398 0.300 A 128 PHE CZ C 13 131.403 0.300 A 128 PHE N N 15 110.638 0.300 A 129 LEU H H 1 7.204 0.020 A 129 LEU HA H 1 4.710 0.020 A 129 LEU HBy H 1 1.792 0.020 A 129 LEU HBx H 1 1.024 0.020 A 129 LEU HDx% H 1 0.736 0.020 A 129 LEU HDy% H 1 0.691 0.020 A 129 LEU HG H 1 1.826 0.020 A 129 LEU C C 13 175.398 0.300 A 129 LEU CA C 13 53.169 0.300 A 129 LEU CB C 13 44.901 0.300 A 129 LEU CDx C 13 25.563 0.300 A 129 LEU CDy C 13 25.567 0.300 A 129 LEU CG C 13 24.522 0.300 A 129 LEU N N 15 119.653 0.300 A 130 ARG H H 1 7.090 0.020 A 130 ARG HA H 1 4.328 0.020 A 130 ARG HBx H 1 1.742 0.020 A 130 ARG HBy H 1 1.742 0.020 A 130 ARG HDx H 1 2.791 0.020 A 130 ARG HDy H 1 2.791 0.020 A 130 ARG HGx H 1 1.587 0.020 A 130 ARG HGy H 1 1.587 0.020 A 130 ARG C C 13 177.099 0.300 A 130 ARG CA C 13 55.250 0.300 A 130 ARG CB C 13 30.355 0.300 A 130 ARG CD C 13 42.817 0.300 A 130 ARG CG C 13 27.160 0.300 A 130 ARG N N 15 116.807 0.300 A 131 CYS H H 1 8.210 0.020 A 131 CYS HA H 1 4.588 0.020 A 131 CYS HBy H 1 2.881 0.020 A 131 CYS HBx H 1 2.733 0.020 A 131 CYS C C 13 175.022 0.300 A 131 CYS CA C 13 54.449 0.300 A 131 CYS CB C 13 34.958 0.300 A 131 CYS N N 15 117.271 0.300 A 132 ASN H H 1 7.801 0.020 A 132 ASN HA H 1 4.811 0.020 A 132 ASN HBy H 1 2.839 0.020 A 132 ASN HBx H 1 2.670 0.020 A 132 ASN HD2y H 1 7.657 0.020 A 132 ASN HD2x H 1 6.952 0.020 A 132 ASN C C 13 175.080 0.300 A 132 ASN CA C 13 53.188 0.300 A 132 ASN CB C 13 40.003 0.300 A 132 ASN N N 15 120.232 0.300 A 132 ASN ND2 N 15 114.087 0.300 A 133 GLU H H 1 9.086 0.020 A 133 GLU HA H 1 4.225 0.020 A 133 GLU HBx H 1 1.911 0.020 A 133 GLU HBy H 1 1.911 0.020 A 133 GLU HGx H 1 1.924 0.020 A 133 GLU HGy H 1 1.924 0.020 A 133 GLU C C 13 176.447 0.300 A 133 GLU CA C 13 57.928 0.300 A 133 GLU CB C 13 29.822 0.300 A 133 GLU CG C 13 36.338 0.300 A 133 GLU N N 15 123.435 0.300 A 134 THR H H 1 8.067 0.020 A 134 THR HA H 1 3.964 0.020 A 134 THR HB H 1 3.951 0.020 A 134 THR HG2% H 1 1.012 0.020 A 134 THR C C 13 174.853 0.300 A 134 THR CA C 13 63.694 0.300 A 134 THR CB C 13 68.841 0.300 A 134 THR CG2 C 13 21.608 0.300 A 134 THR N N 15 113.403 0.300 A 135 LEU H H 1 7.448 0.020 A 135 LEU HA H 1 3.964 0.020 A 135 LEU HBy H 1 1.079 0.020 A 135 LEU HBx H 1 0.643 0.020 A 135 LEU HDx% H 1 0.761 0.020 A 135 LEU HDy% H 1 0.617 0.020 A 135 LEU HG H 1 1.204 0.020 A 135 LEU C C 13 176.215 0.300 A 135 LEU CA C 13 55.656 0.300 A 135 LEU CB C 13 42.291 0.300 A 135 LEU CDy C 13 24.960 0.300 A 135 LEU CDx C 13 23.206 0.300 A 135 LEU CG C 13 26.850 0.300 A 135 LEU N N 15 121.377 0.300 A 136 PHE H H 1 7.542 0.020 A 136 PHE HA H 1 5.202 0.020 A 136 PHE HBy H 1 3.008 0.020 A 136 PHE HBx H 1 2.814 0.020 A 136 PHE HDx H 1 7.259 0.020 A 136 PHE HDy H 1 7.259 0.020 A 136 PHE HEx H 1 7.161 0.020 A 136 PHE HEy H 1 7.161 0.020 A 136 PHE C C 13 179.412 0.300 A 136 PHE CA C 13 53.495 0.300 A 136 PHE CB C 13 39.248 0.300 A 136 PHE CD2 C 13 132.342 0.300 A 136 PHE CE2 C 13 130.432 0.300 A 136 PHE N N 15 117.704 0.300 A 137 PRO HA H 1 4.528 0.020 A 137 PRO HBy H 1 2.214 0.020 A 137 PRO HBx H 1 1.891 0.020 A 137 PRO HDy H 1 3.754 0.020 A 137 PRO HDx H 1 3.492 0.020 A 137 PRO HGy H 1 1.852 0.020 A 137 PRO HGx H 1 1.792 0.020 A 137 PRO CA C 13 62.949 0.300 A 137 PRO CB C 13 32.242 0.300 A 137 PRO CD C 13 50.414 0.300 A 137 PRO CG C 13 27.435 0.300 A 138 THR H H 1 8.452 0.020 A 138 THR HA H 1 4.324 0.020 A 138 THR HB H 1 4.123 0.020 A 138 THR HG2% H 1 1.076 0.020 A 138 THR C C 13 174.175 0.300 A 138 THR CA C 13 61.863 0.300 A 138 THR CB C 13 69.742 0.300 A 138 THR CG2 C 13 21.498 0.300 A 138 THR N N 15 114.025 0.300 A 139 LYS H H 1 7.831 0.020 A 139 LYS HA H 1 4.046 0.020 A 139 LYS HBy H 1 1.692 0.020 A 139 LYS HBx H 1 1.605 0.020 A 139 LYS HDx H 1 1.417 0.020 A 139 LYS HDy H 1 1.417 0.020 A 139 LYS HEx H 1 3.185 0.020 A 139 LYS HEy H 1 3.185 0.020 A 139 LYS HGx H 1 1.248 0.020 A 139 LYS HGy H 1 1.248 0.020 A 139 LYS CA C 13 57.661 0.300 A 139 LYS CB C 13 33.467 0.300 A 139 LYS CD C 13 28.887 0.300 A 139 LYS CE C 13 42.239 0.300 A 139 LYS CG C 13 24.484 0.300 A 139 LYS N N 15 127.089 0.300 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 49 LEU H A 49 LEU HDy% 1.0 . 5.02 2 2 A 49 LEU H A 49 LEU HDx% 1.0 . 5.07 3 3 A 49 LEU H A 49 LEU HG 1.0 . 5.03 4 4 A 49 LEU H A 28 TYR HD% 1.0 . 4.70 5 5 A 49 LEU H A 49 LEU HBx 1.0 . 3.39 6 5 A 49 LEU H A 49 LEU HBy 1.0 . 3.39 7 6 A 95 ILE H A 99 ASP HA 1.0 . 4.24 8 7 A 77 TRP HE1 A 81 GLN HGx 1.0 . 4.64 9 8 A 95 ILE H A 94 LYS HGx 1.0 . 4.68 10 9 A 95 ILE H A 94 LYS HA 1.0 . 3.18 11 10 A 95 ILE H A 100 MET HBy 1.0 . 4.45 12 11 A 95 ILE H A 95 ILE HB 1.0 . 3.75 13 12 A 95 ILE H A 94 LYS HBx 1.0 . 4.05 14 13 A 95 ILE H A 100 MET H 1.0 . 3.82 15 14 A 77 TRP HE1 A 81 GLN HE2y 1.0 . 4.75 16 15 A 38 PHE H A 38 PHE HD% 1.0 . 4.26 17 16 A 38 PHE H A 37 CYS HA 1.0 . 3.34 18 17 A 38 PHE H A 39 GLY H 1.0 . 4.38 19 18 A 36 THR HA A 42 LEU H 1.0 . 4.09 20 19 A 42 LEU H A 41 LYS HA 1.0 . 3.11 21 20 A 42 LEU H A 42 LEU HDy% 1.0 . 4.24 22 20 A 42 LEU H A 42 LEU HDx% 1.0 . 4.24 23 21 A 42 LEU H A 42 LEU HBx 1.0 . 4.17 24 22 A 42 LEU H A 41 LYS HBx 1.0 . 3.89 25 22 A 42 LEU H A 41 LYS HBy 1.0 . 3.89 26 23 A 42 LEU H A 36 THR HG2% 1.0 . 4.46 27 24 A 92 CYS H A 91 LYS HGx 1.0 . 4.20 28 24 A 91 LYS HGy A 92 CYS H 1.0 . 4.20 29 25 A 92 CYS H A 91 LYS HBy 1.0 . 4.87 30 26 A 92 CYS H A 91 LYS HA 1.0 . 3.22 31 27 A 40 SER HA A 41 LYS H 1.0 . 3.24 32 28 A 41 LYS H A 40 SER HBx 1.0 . 3.75 33 28 A 41 LYS H A 40 SER HBy 1.0 . 3.75 34 29 A 41 LYS H A 41 LYS HBx 1.0 . 3.17 35 29 A 41 LYS HBy A 41 LYS H 1.0 . 3.17 36 30 A 41 LYS H A 41 LYS HGx 1.0 . 4.74 37 30 A 41 LYS H A 41 LYS HGy 1.0 . 4.74 38 31 A 24 ARG H A 25 ALA H 1.0 . 4.70 39 32 A 25 ALA H A 100 MET HA 1.0 . 3.93 40 33 A 25 ALA H A 25 ALA HB% 1.0 . 4.09 41 34 A 25 ALA H A 101 VAL H 1.0 . 3.96 42 35 A 25 ALA H A 24 ARG HA 1.0 . 3.10 43 36 A 25 ALA H A 100 MET HGy 1.0 . 4.41 44 37 A 25 ALA H A 24 ARG HBx 1.0 . 4.32 45 37 A 25 ALA H A 24 ARG HBy 1.0 . 4.32 46 38 A 92 CYS H A 93 GLU H 1.0 . 4.62 47 39 A 92 CYS H A 47 SER HA 1.0 . 4.53 48 40 A 138 THR H A 139 LYS H 1.0 . 3.69 49 41 A 139 LYS H A 138 THR HA 1.0 . 3.52 50 42 A 139 LYS H A 138 THR HB 1.0 . 3.92 51 43 A 26 ARG HBy A 27 CYS H 1.0 . 4.34 52 44 A 27 CYS H A 26 ARG HA 1.0 . 3.23 53 45 A 99 ASP H A 99 ASP HBy 1.0 . 3.43 54 46 A 99 ASP H A 99 ASP HBx 1.0 . 3.55 55 47 A 99 ASP H A 98 GLU HGy 1.0 . 4.55 56 48 A 99 ASP H A 98 GLU HBx 1.0 . 3.44 57 48 A 99 ASP H A 98 GLU HBy 1.0 . 3.44 58 49 A 99 ASP H A 98 GLU HA 1.0 . 2.93 59 50 A 99 ASP H A 94 LYS HDx 1.0 . 5.10 60 50 A 99 ASP H A 94 LYS HDy 1.0 . 5.10 61 51 A 27 CYS H A 48 SER HA 1.0 . 5.01 62 52 A 27 CYS H A 26 ARG HDx 1.0 . 4.68 63 52 A 27 CYS H A 26 ARG HDy 1.0 . 4.68 64 53 A 27 CYS H A 27 CYS HBx 1.0 . 3.64 65 54 A 27 CYS H A 26 ARG HGx 1.0 . 4.39 66 54 A 27 CYS H A 26 ARG HGy 1.0 . 4.39 67 55 A 27 CYS H A 26 ARG H 1.0 . 4.62 68 56 A 27 CYS H A 27 CYS HBy 1.0 . 4.20 69 57 A 99 ASP H A 98 GLU H 1.0 . 4.65 70 58 A 92 CYS HA A 102 TYR H 1.0 . 4.92 71 59 A 102 TYR H A 102 TYR HD% 1.0 . 3.95 72 60 A 102 TYR H A 101 VAL HA 1.0 . 3.57 73 61 A 102 TYR H A 102 TYR HBx 1.0 . 4.06 74 62 A 102 TYR H A 101 VAL HGx% 1.0 . 4.08 75 63 A 102 TYR H A 101 VAL HGy% 1.0 . 4.76 76 64 A 102 TYR H A 102 TYR HBy 1.0 . 4.01 77 65 A 102 TYR H A 101 VAL HB 1.0 . 4.88 78 66 A 24 ARG H A 23 ARG HA 1.0 . 3.25 79 67 A 24 ARG H A 23 ARG HBy 1.0 . 2.95 80 68 A 109 CYS HBy A 110 ARG H 1.0 . 4.34 81 69 A 110 ARG H A 110 ARG HBy 1.0 . 3.76 82 70 A 110 ARG H A 110 ARG HBx 1.0 . 4.08 83 71 A 110 ARG H A 113 MET HE% 1.0 . 5.24 84 72 A 93 GLU H A 101 VAL HA 1.0 . 4.21 85 73 A 93 GLU H A 93 GLU HBx 1.0 . 4.03 86 74 A 100 MET H A 93 GLU H 1.0 . 3.82 87 75 A 93 GLU H A 92 CYS HA 1.0 . 3.07 88 76 A 93 GLU H A 92 CYS HBy 1.0 . 4.58 89 77 A 117 ARG H A 117 ARG HBx 1.0 . 3.63 90 78 A 117 ARG H A 118 ILE H 1.0 . 3.85 91 79 A 117 ARG H A 117 ARG HBy 1.0 . 3.22 92 80 A 117 ARG H A 118 ILE HD1% 1.0 . 5.08 93 81 A 132 ASN H A 133 GLU H 1.0 . 4.48 94 82 A 133 GLU H A 135 LEU HG 1.0 . 4.36 95 83 A 133 GLU H A 133 GLU HGx 1.0 . 4.91 96 83 A 133 GLU H A 133 GLU HGy 1.0 . 4.91 97 84 A 15 VAL H A 15 VAL HB 1.0 . 3.66 98 85 A 15 VAL H A 14 LEU HA 1.0 . 3.05 99 86 A 15 VAL H A 16 PRO HDx 1.0 . 4.80 100 86 A 15 VAL H A 16 PRO HDy 1.0 . 4.80 101 87 A 102 TYR HBx A 103 LEU H 1.0 . 4.76 102 88 A 103 LEU H A 103 LEU HDx% 1.0 . 3.71 103 89 A 103 LEU H A 22 VAL HA 1.0 . 4.05 104 90 A 103 LEU H A 22 VAL HG2% 1.0 . 4.24 105 91 A 103 LEU H A 103 LEU HBx 1.0 . 3.30 106 91 A 103 LEU H A 103 LEU HBy 1.0 . 3.30 107 92 A 17 ARG H A 16 PRO HGx 1.0 . 5.50 108 92 A 16 PRO HGy A 17 ARG H 1.0 . 5.50 109 93 A 93 GLU HA A 94 LYS H 1.0 . 3.03 110 94 A 94 LYS H A 94 LYS HBy 1.0 . 3.57 111 95 A 94 LYS H A 94 LYS HEy 1.0 . 4.61 112 96 A 106 TYR H A 106 TYR HBx 1.0 . 3.91 113 97 A 106 TYR H A 108 MET H 1.0 . 4.89 114 98 A 106 TYR H A 106 TYR HD% 1.0 . 4.94 115 99 A 35 ASN H A 35 ASN HBy 1.0 . 4.07 116 100 A 35 ASN H A 35 ASN HBx 1.0 . 3.76 117 101 A 81 GLN H A 83 PHE H 1.0 . 4.45 118 102 A 81 GLN H A 81 GLN HBx 1.0 . 3.81 119 102 A 81 GLN H A 81 GLN HBy 1.0 . 3.81 120 103 A 81 GLN H A 80 ILE HG2% 1.0 . 4.24 121 104 A 91 LYS H A 91 LYS HBx 1.0 . 3.67 122 105 A 92 CYS H A 91 LYS H 1.0 . 4.24 123 106 A 91 LYS H A 90 PRO HA 1.0 . 3.45 124 107 A 94 LYS H A 93 GLU HBy 1.0 . 3.86 125 108 A 138 THR HA A 106 TYR H 1.0 . 4.39 126 109 A 106 TYR H A 138 THR HG2% 1.0 . 5.38 127 110 A 17 ARG H A 16 PRO HDx 1.0 . 4.95 128 110 A 16 PRO HDy A 17 ARG H 1.0 . 4.95 129 111 A 17 ARG H A 16 PRO HBx 1.0 . 4.20 130 111 A 17 ARG H A 16 PRO HBy 1.0 . 4.20 131 112 A 35 ASN H A 31 SER H 1.0 . 4.83 132 113 A 35 ASN H A 30 THR HG2% 1.0 . 4.87 133 114 A 81 GLN H A 80 ILE HB 1.0 . 4.36 134 115 A 81 GLN H A 78 ALA HB% 1.0 . 4.38 135 116 A 100 MET H A 100 MET HGy 1.0 . 4.74 136 117 A 102 TYR HBx A 91 LYS H 1.0 . 4.03 137 118 A 91 LYS H A 91 LYS HGx 1.0 . 4.53 138 118 A 91 LYS HGy A 91 LYS H 1.0 . 4.53 139 119 A 119 LEU HBy A 120 TYR H 1.0 . 4.92 140 120 A 120 TYR H A 121 ASN H 1.0 . 4.85 141 121 A 120 TYR H A 120 TYR HD% 1.0 . 4.45 142 122 A 57 GLU H A 59 GLU H 1.0 . 4.29 143 123 A 57 GLU H A 56 THR HA 1.0 . 3.24 144 124 A 99 ASP HA A 100 MET H 1.0 . 3.04 145 125 A 57 GLU H A 57 GLU HBy 1.0 . 3.36 146 126 A 57 GLU H A 56 THR HG2% 1.0 . 4.64 147 127 A 57 GLU H A 49 LEU HDx% 1.0 . 4.73 148 128 A 57 GLU H A 57 GLU HGx 1.0 . 3.59 149 129 A 120 TYR H A 120 TYR HBy 1.0 . 3.44 150 130 A 57 GLU H A 58 LYS H 1.0 . 3.74 151 131 A 100 MET H A 95 ILE HD1% 1.0 . 4.98 152 132 A 70 LEU HA A 73 VAL H 1.0 . 4.23 153 133 A 73 VAL H A 73 VAL HGx% 1.0 . 4.77 154 134 A 73 VAL H A 72 HIS HBy 1.0 . 4.96 155 135 A 86 ALA H A 88 PHE H 1.0 . 4.69 156 136 A 86 ALA H A 83 PHE HD% 1.0 . 4.80 157 137 A 86 ALA H A 85 CYS HBx 1.0 . 4.27 158 138 A 86 ALA H A 85 CYS H 1.0 . 3.94 159 139 A 86 ALA H A 87 VAL H 1.0 . 3.83 160 140 A 86 ALA H A 83 PHE HA 1.0 . 4.50 161 141 A 86 ALA H A 84 LEU HA 1.0 . 4.56 162 142 A 86 ALA H A 85 CYS HBy 1.0 . 4.54 163 143 A 86 ALA H A 108 MET HE% 1.0 . 5.20 164 144 A 86 ALA H A 86 ALA HB% 1.0 . 3.33 165 145 A 86 ALA H A 87 VAL HGy% 1.0 . 5.48 166 146 A 73 VAL H A 71 LYS HA 1.0 . 4.17 167 147 A 73 VAL H A 73 VAL HB 1.0 . 3.70 168 148 A 73 VAL H A 72 HIS H 1.0 . 4.12 169 149 A 73 VAL H A 73 VAL HGy% 1.0 . 3.83 170 150 A 135 LEU H A 135 LEU HBx 1.0 . 3.89 171 151 A 133 GLU H A 135 LEU H 1.0 . 4.59 172 152 A 59 GLU H A 62 ASP H 1.0 . 4.65 173 153 A 59 GLU H A 58 LYS H 1.0 . 3.65 174 154 A 58 LYS H A 58 LYS HBx 1.0 . 3.29 175 154 A 58 LYS H A 58 LYS HBy 1.0 . 3.29 176 155 A 58 LYS H A 58 LYS HDx 1.0 . 3.27 177 155 A 58 LYS H A 58 LYS HDy 1.0 . 3.27 178 156 A 14 LEU H A 14 LEU HBy 1.0 . 3.28 179 157 A 15 VAL H A 14 LEU H 1.0 . 4.77 180 158 A 14 LEU H A 13 GLY HAx 1.0 . 3.45 181 158 A 14 LEU H A 13 GLY HAy 1.0 . 3.45 182 159 A 135 LEU H A 133 GLU HA 1.0 . 4.36 183 160 A 62 ASP H A 63 LYS H 1.0 . 3.37 184 161 A 62 ASP H A 58 LYS HA 1.0 . 4.11 185 162 A 62 ASP H A 62 ASP HBy 1.0 . 3.07 186 163 A 69 ALA H A 71 LYS H 1.0 . 4.67 187 164 A 66 ASP H A 66 ASP HBx 1.0 . 3.38 188 165 A 66 ASP H A 66 ASP HBy 1.0 . 3.00 189 166 A 66 ASP H A 63 LYS HA 1.0 . 4.00 190 167 A 69 ALA H A 68 TYR HBx 1.0 . 3.73 191 167 A 69 ALA H A 68 TYR HBy 1.0 . 3.73 192 168 A 69 ALA H A 70 LEU H 1.0 . 3.58 193 169 A 69 ALA H A 69 ALA HB% 1.0 . 3.03 194 170 A 69 ALA H A 66 ASP HA 1.0 . 4.70 195 171 A 27 CYS HBx A 28 TYR H 1.0 . 4.29 196 172 A 28 TYR H A 27 CYS HA 1.0 . 3.34 197 173 A 48 SER HA A 28 TYR H 1.0 . 4.56 198 174 A 28 TYR H A 28 TYR HB2 1.0 . 3.90 199 175 A 21 MET H A 21 MET HGx 1.0 . 4.36 200 176 A 21 MET H A 103 LEU HDy% 1.0 . 5.43 201 177 A 78 ALA HB% A 77 TRP H 1.0 . 4.68 202 178 A 64 LEU H A 64 LEU HBx 1.0 . 3.85 203 179 A 28 TYR HD% A 28 TYR H 1.0 . 3.94 204 180 A 28 TYR H A 46 LEU HBx 1.0 . 4.22 205 181 A 73 VAL HGx% A 77 TRP H 1.0 . 4.38 206 182 A 77 TRP H A 79 ALA H 1.0 . 4.94 207 183 A 73 VAL HB A 77 TRP H 1.0 . 4.88 208 184 A 77 TRP H A 78 ALA H 1.0 . 4.22 209 185 A 77 TRP H A 76 CYS H 1.0 . 3.52 210 186 A 77 TRP H A 77 TRP HBx 1.0 . 3.37 211 187 A 64 LEU H A 64 LEU HDy% 1.0 . 4.59 212 188 A 64 LEU H A 64 LEU HBy 1.0 . 3.75 213 189 A 132 ASN H A 131 CYS HBy 1.0 . 4.06 214 190 A 95 ILE H A 98 GLU H 1.0 . 3.65 215 191 A 98 GLU H A 98 GLU HBx 1.0 . 3.20 216 191 A 98 GLU HBy A 98 GLU H 1.0 . 3.20 217 192 A 100 MET HA A 101 VAL H 1.0 . 3.32 218 193 A 101 VAL H A 100 MET HBx 1.0 . 3.96 219 194 A 101 VAL H A 101 VAL HGy% 1.0 . 3.82 220 195 A 101 VAL H A 23 ARG H 1.0 . 4.15 221 196 A 101 VAL H A 100 MET HGy 1.0 . 4.99 222 197 A 101 VAL H A 22 VAL HA 1.0 . 4.45 223 198 A 101 VAL H A 23 ARG HBx 1.0 . 5.03 224 199 A 27 CYS H A 28 TYR H 1.0 . 4.61 225 200 A 77 TRP H A 77 TRP HBy 1.0 . 3.46 226 201 A 44 TYR HD% A 46 LEU H 1.0 . 4.68 227 202 A 46 LEU H A 46 LEU HBy 1.0 . 3.88 228 203 A 98 GLU H A 97 GLY H 1.0 . 3.44 229 204 A 98 GLU HGy A 98 GLU H 1.0 . 3.96 230 205 A 127 LYS HA A 129 LEU H 1.0 . 4.77 231 206 A 129 LEU H A 125 PHE HBx 1.0 . 5.07 232 207 A 46 LEU H A 45 GLU H 1.0 . 4.01 233 208 A 46 LEU H A 46 LEU HDx% 1.0 . 4.94 234 209 A 46 LEU H A 44 TYR HA 1.0 . 4.23 235 210 A 63 LYS H A 62 ASP HBy 1.0 . 4.47 236 211 A 63 LYS H A 63 LYS HBx 1.0 . 3.21 237 211 A 63 LYS H A 63 LYS HBy 1.0 . 3.21 238 212 A 129 LEU H A 127 LYS H 1.0 . 4.67 239 213 A 129 LEU H A 129 LEU HBy 1.0 . 3.99 240 214 A 129 LEU H A 129 LEU HDx% 1.0 . 4.46 241 215 A 129 LEU H A 128 PHE H 1.0 . 3.94 242 216 A 129 LEU H A 128 PHE HBx 1.0 . 4.35 243 217 A 129 LEU H A 129 LEU HBx 1.0 . 3.96 244 218 A 110 ARG HA A 113 MET H 1.0 . 4.66 245 219 A 113 MET H A 114 GLU H 1.0 . 3.85 246 220 A 113 MET H A 112 THR HG2% 1.0 . 4.78 247 221 A 113 MET H A 112 THR H 1.0 . 4.08 248 222 A 113 MET H A 113 MET HGx 1.0 . 3.67 249 222 A 113 MET H A 113 MET HGy 1.0 . 3.67 250 223 A 113 MET HE% A 113 MET H 1.0 . 3.65 251 224 A 113 MET H A 112 THR HB 1.0 . 4.64 252 225 A 63 LYS H A 63 LYS HGx 1.0 . 4.90 253 225 A 63 LYS H A 63 LYS HGy 1.0 . 4.90 254 226 A 83 PHE H A 86 ALA HB% 1.0 . 5.23 255 227 A 83 PHE H A 83 PHE HBx 1.0 . 3.93 256 228 A 83 PHE H A 80 ILE HG1x 1.0 . 4.02 257 229 A 83 PHE H A 83 PHE HBy 1.0 . 3.91 258 230 A 31 SER HBy A 32 ASN H 1.0 . 4.40 259 231 A 32 ASN H A 32 ASN HBx 1.0 . 3.99 260 231 A 32 ASN H A 32 ASN HBy 1.0 . 3.99 261 232 A 37 CYS H A 42 LEU HDy% 1.0 . 4.91 262 232 A 42 LEU HDx% A 37 CYS H 1.0 . 4.91 263 233 A 36 THR HA A 37 CYS H 1.0 . 3.41 264 234 A 37 CYS H A 36 THR HB 1.0 . 3.60 265 235 A 37 CYS H A 37 CYS HBx 1.0 . 4.15 266 236 A 37 CYS H A 40 SER HBx 1.0 . 4.74 267 236 A 40 SER HBy A 37 CYS H 1.0 . 4.74 268 237 A 37 CYS H A 37 CYS HBy 1.0 . 4.05 269 238 A 127 LYS H A 126 PRO HA 1.0 . 3.57 270 239 A 67 TYR H A 68 TYR H 1.0 . 3.52 271 240 A 68 TYR H A 68 TYR HD% 1.0 . 4.44 272 241 A 68 TYR H A 68 TYR HBx 1.0 . 3.05 273 241 A 68 TYR HBy A 68 TYR H 1.0 . 3.05 274 242 A 57 GLU HA A 60 LEU H 1.0 . 4.49 275 243 A 60 LEU H A 60 LEU HBy 1.0 . 3.99 276 244 A 71 LYS H A 68 TYR HA 1.0 . 4.48 277 245 A 71 LYS H A 71 LYS HBx 1.0 . 3.57 278 246 A 71 LYS H A 70 LEU HBy 1.0 . 4.41 279 247 A 83 PHE H A 82 PRO HGx 1.0 . 4.71 280 248 A 38 PHE H A 37 CYS H 1.0 . 4.51 281 249 A 36 THR HG2% A 37 CYS H 1.0 . 4.44 282 250 A 127 LYS H A 128 PHE H 1.0 . 3.86 283 251 A 127 LYS H A 126 PRO HBy 1.0 . 3.93 284 252 A 127 LYS H A 127 LYS HBx 1.0 . 3.02 285 252 A 127 LYS H A 127 LYS HBy 1.0 . 3.02 286 253 A 33 ALA H A 34 THR H 1.0 . 3.64 287 254 A 33 ALA H A 33 ALA HB% 1.0 . 3.50 288 255 A 66 ASP HA A 68 TYR H 1.0 . 4.33 289 256 A 69 ALA HB% A 68 TYR H 1.0 . 5.09 290 257 A 60 LEU H A 61 ASN H 1.0 . 3.70 291 258 A 60 LEU H A 59 GLU HBx 1.0 . 3.68 292 258 A 60 LEU H A 59 GLU HBy 1.0 . 3.68 293 259 A 60 LEU H A 61 ASN HBy 1.0 . 4.66 294 260 A 60 LEU H A 60 LEU HBx 1.0 . 3.67 295 261 A 71 LYS H A 70 LEU H 1.0 . 3.38 296 262 A 71 LYS H A 70 LEU HG 1.0 . 4.86 297 263 A 71 LYS H A 69 ALA HA 1.0 . 4.58 298 264 A 71 LYS H A 69 ALA HB% 1.0 . 5.41 299 265 A 51 LEU H A 52 THR HG2% 1.0 . 4.98 300 266 A 51 LEU H A 51 LEU HBx 1.0 . 3.72 301 267 A 51 LEU H A 52 THR H 1.0 . 3.54 302 268 A 51 LEU H A 51 LEU HDx% 1.0 . 4.62 303 268 A 51 LEU H A 51 LEU HDy% 1.0 . 4.62 304 269 A 105 SER HB3 A 107 GLU H 1.0 . 4.14 305 270 A 110 ARG H A 107 GLU H 1.0 . 4.60 306 271 A 107 GLU H A 107 GLU HBy 1.0 . 3.73 307 272 A 107 GLU H A 107 GLU HBx 1.0 . 4.04 308 273 A 107 GLU H A 105 SER HB2 1.0 . 4.56 309 274 A 106 TYR HBx A 107 GLU H 1.0 . 4.38 310 275 A 33 ALA H A 32 ASN HBx 1.0 . 3.87 311 275 A 32 ASN HBy A 33 ALA H 1.0 . 3.87 312 276 A 125 PHE H A 125 PHE HBy 1.0 . 3.85 313 277 A 51 LEU H A 50 ASP HBy 1.0 . 4.76 314 278 A 51 LEU H A 51 LEU HG 1.0 . 4.82 315 279 A 45 GLU H A 44 TYR HA 1.0 . 3.20 316 280 A 45 GLU H A 44 TYR HBy 1.0 . 3.89 317 281 A 45 GLU H A 44 TYR HBx 1.0 . 4.47 318 282 A 45 GLU H A 45 GLU HGx 1.0 . 4.21 319 282 A 45 GLU H A 45 GLU HGy 1.0 . 4.21 320 283 A 45 GLU H A 46 LEU HDy% 1.0 . 4.83 321 284 A 107 GLU H A 106 TYR HBy 1.0 . 4.63 322 285 A 124 PHE H A 124 PHE HBx 1.0 . 3.75 323 285 A 124 PHE H A 124 PHE HBy 1.0 . 3.75 324 286 A 124 PHE H A 119 LEU HDy% 1.0 . 4.88 325 287 A 23 ARG H A 100 MET HE% 1.0 . 4.93 326 288 A 23 ARG H A 101 VAL HGy% 1.0 . 4.58 327 289 A 23 ARG H A 22 VAL HB 1.0 . 3.48 328 290 A 124 PHE H A 119 LEU HDx% 1.0 . 4.97 329 291 A 124 PHE H A 124 PHE HD% 1.0 . 4.49 330 292 A 54 PHE H A 54 PHE HBy 1.0 . 4.07 331 293 A 54 PHE H A 54 PHE HBx 1.0 . 3.84 332 294 A 54 PHE H A 53 ASP HA 1.0 . 3.34 333 295 A 135 LEU HBx A 136 PHE H 1.0 . 4.28 334 296 A 59 GLU H A 59 GLU HBx 1.0 . 3.22 335 296 A 59 GLU H A 59 GLU HBy 1.0 . 3.22 336 297 A 59 GLU H A 56 THR HG2% 1.0 . 4.60 337 298 A 59 GLU H A 58 LYS HA 1.0 . 3.55 338 299 A 59 GLU H A 58 LYS HDx 1.0 . 4.19 339 299 A 59 GLU H A 58 LYS HDy 1.0 . 4.19 340 300 A 59 GLU H A 60 LEU H 1.0 . 4.07 341 301 A 59 GLU H A 56 THR HB 1.0 . 4.69 342 302 A 100 MET HA A 23 ARG H 1.0 . 4.89 343 303 A 23 ARG H A 22 VAL HG1% 1.0 . 4.64 344 304 A 130 ARG H A 131 CYS H 1.0 . 4.77 345 305 A 54 PHE H A 49 LEU HDy% 1.0 . 5.09 346 306 A 59 GLU H A 59 GLU HGy 1.0 . 3.83 347 307 A 114 GLU H A 115 PRO HDx 1.0 . 3.81 348 308 A 58 LYS HA A 61 ASN H 1.0 . 4.69 349 309 A 131 CYS H A 129 LEU HA 1.0 . 4.84 350 310 A 131 CYS H A 130 ARG HA 1.0 . 3.38 351 311 A 131 CYS H A 131 CYS HBy 1.0 . 4.20 352 312 A 131 CYS H A 130 ARG HBx 1.0 . 4.33 353 312 A 131 CYS H A 130 ARG HBy 1.0 . 4.33 354 313 A 131 CYS H A 130 ARG HGx 1.0 . 5.08 355 313 A 131 CYS H A 130 ARG HGy 1.0 . 5.08 356 314 A 70 LEU H A 70 LEU HDy% 1.0 . 4.39 357 315 A 24 ARG H A 24 ARG HE 1.0 . 5.14 358 316 A 114 GLU H A 114 GLU HBy 1.0 . 3.16 359 317 A 61 ASN H A 60 LEU HDx% 1.0 . 4.58 360 317 A 61 ASN H A 60 LEU HDy% 1.0 . 4.58 361 318 A 57 GLU HA A 61 ASN H 1.0 . 4.23 362 319 A 61 ASN H A 61 ASN HBx 1.0 . 3.71 363 320 A 60 LEU HBy A 61 ASN H 1.0 . 3.61 364 321 A 70 LEU H A 69 ALA HB% 1.0 . 4.37 365 322 A 70 LEU H A 70 LEU HDx% 1.0 . 4.24 366 323 A 70 LEU H A 67 TYR HA 1.0 . 4.15 367 324 A 76 CYS H A 75 LYS H 1.0 . 4.23 368 325 A 75 LYS H A 74 PRO HGx 1.0 . 4.50 369 325 A 75 LYS H A 74 PRO HGy 1.0 . 4.50 370 326 A 31 SER H A 30 THR HB 1.0 . 3.50 371 327 A 59 GLU H A 61 ASN H 1.0 . 4.19 372 328 A 61 ASN H A 60 LEU HBx 1.0 . 4.55 373 329 A 26 ARG H A 25 ALA HA 1.0 . 3.32 374 330 A 25 ALA HB% A 26 ARG H 1.0 . 3.28 375 331 A 130 ARG H A 130 ARG HBx 1.0 . 3.37 376 331 A 130 ARG H A 130 ARG HBy 1.0 . 3.37 377 332 A 130 ARG H A 129 LEU HDx% 1.0 . 5.07 378 333 A 127 LYS HA A 130 ARG H 1.0 . 4.65 379 334 A 44 TYR H A 42 LEU HDy% 1.0 . 4.65 380 334 A 42 LEU HDx% A 44 TYR H 1.0 . 4.65 381 335 A 45 GLU H A 44 TYR H 1.0 . 4.74 382 336 A 44 TYR HD% A 44 TYR H 1.0 . 3.99 383 337 A 44 TYR H A 43 PRO HDy 1.0 . 4.35 384 338 A 44 TYR HBx A 44 TYR H 1.0 . 3.75 385 339 A 42 LEU HBx A 44 TYR H 1.0 . 3.63 386 340 A 46 LEU H A 44 TYR H 1.0 . 5.31 387 341 A 84 LEU H A 84 LEU HDx% 1.0 . 4.50 388 342 A 83 PHE H A 84 LEU H 1.0 . 3.47 389 343 A 84 LEU H A 84 LEU HDy% 1.0 . 4.43 390 344 A 83 PHE HBx A 84 LEU H 1.0 . 4.15 391 345 A 31 SER H A 30 THR HG2% 1.0 . 4.21 392 346 A 67 TYR H A 67 TYR HBx 1.0 . 4.13 393 347 A 117 ARG HBx A 118 ILE H 1.0 . 3.90 394 348 A 118 ILE H A 118 ILE HB 1.0 . 3.22 395 349 A 38 PHE HBx A 40 SER H 1.0 . 4.80 396 350 A 44 TYR H A 45 GLU HA 1.0 . 5.15 397 351 A 44 TYR H A 42 LEU HBy 1.0 . 3.76 398 352 A 84 LEU H A 81 GLN HA 1.0 . 4.25 399 353 A 67 TYR H A 67 TYR HBy 1.0 . 3.93 400 354 A 66 ASP HBx A 67 TYR H 1.0 . 4.25 401 355 A 66 ASP H A 67 TYR H 1.0 . 3.62 402 356 A 118 ILE H A 118 ILE HG2% 1.0 . 3.77 403 357 A 41 LYS H A 40 SER H 1.0 . 4.37 404 358 A 76 CYS H A 76 CYS HBx 1.0 . 3.94 405 359 A 73 VAL HGx% A 76 CYS H 1.0 . 3.88 406 360 A 73 VAL HGy% A 76 CYS H 1.0 . 5.04 407 361 A 78 ALA H A 76 CYS H 1.0 . 4.63 408 362 A 76 CYS H A 76 CYS HBy 1.0 . 3.83 409 363 A 76 CYS H A 75 LYS HBx 1.0 . 4.86 410 363 A 76 CYS H A 75 LYS HBy 1.0 . 4.86 411 364 A 79 ALA H A 80 ILE H 1.0 . 3.20 412 365 A 79 ALA H A 79 ALA HB% 1.0 . 2.98 413 366 A 80 ILE HG2% A 79 ALA H 1.0 . 5.15 414 367 A 80 ILE HG2% A 78 ALA H 1.0 . 5.04 415 368 A 78 ALA H A 77 TRP HD1 1.0 . 4.20 416 369 A 79 ALA H A 78 ALA H 1.0 . 3.42 417 370 A 78 ALA H A 74 PRO HA 1.0 . 3.95 418 371 A 78 ALA H A 77 TRP HBy 1.0 . 4.03 419 372 A 78 ALA H A 77 TRP HBx 1.0 . 3.54 420 373 A 78 ALA HB% A 78 ALA H 1.0 . 3.11 421 374 A 39 GLY H A 40 SER H 1.0 . 3.50 422 375 A 40 SER H A 40 SER HBx 1.0 . 3.08 423 375 A 40 SER HBy A 40 SER H 1.0 . 3.08 424 376 A 73 VAL HB A 76 CYS H 1.0 . 4.65 425 377 A 108 MET H A 107 GLU H 1.0 . 3.85 426 378 A 108 MET H A 108 MET HBx 1.0 . 3.49 427 378 A 108 MET H A 108 MET HBy 1.0 . 3.49 428 379 A 108 MET H A 107 GLU HBy 1.0 . 3.46 429 380 A 108 MET H A 111 ILE HD1% 1.0 . 4.84 430 381 A 108 MET H A 109 CYS H 1.0 . 3.48 431 382 A 108 MET H A 107 GLU HBx 1.0 . 4.14 432 383 A 80 ILE HB A 79 ALA H 1.0 . 4.97 433 384 A 121 ASN H A 122 THR H 1.0 . 3.87 434 385 A 87 VAL H A 88 PHE HBy 1.0 . 4.95 435 386 A 89 LYS H A 88 PHE HBx 1.0 . 4.43 436 387 A 89 LYS H A 88 PHE HD% 1.0 . 5.16 437 388 A 83 PHE HD% A 87 VAL H 1.0 . 4.98 438 389 A 87 VAL H A 87 VAL HB 1.0 . 3.97 439 390 A 87 VAL H A 87 VAL HGy% 1.0 . 3.92 440 391 A 54 PHE HBy A 55 HIS H 1.0 . 3.48 441 392 A 55 HIS H A 54 PHE HA 1.0 . 3.33 442 393 A 55 HIS H A 54 PHE HD% 1.0 . 4.60 443 394 A 54 PHE HBx A 55 HIS H 1.0 . 4.84 444 395 A 55 HIS H A 59 GLU HBx 1.0 . 4.46 445 395 A 59 GLU HBy A 55 HIS H 1.0 . 4.46 446 396 A 88 PHE H A 87 VAL H 1.0 . 3.41 447 397 A 88 PHE H A 88 PHE HBy 1.0 . 3.75 448 398 A 88 PHE H A 87 VAL HB 1.0 . 3.84 449 399 A 80 ILE H A 78 ALA HA 1.0 . 4.78 450 400 A 78 ALA H A 80 ILE H 1.0 . 4.51 451 401 A 30 THR H A 47 SER HBx 1.0 . 4.28 452 402 A 84 LEU HA A 89 LYS H 1.0 . 5.67 453 403 A 88 PHE H A 89 LYS H 1.0 . 3.61 454 404 A 89 LYS H A 85 CYS HA 1.0 . 4.01 455 405 A 89 LYS H A 88 PHE HBy 1.0 . 3.97 456 406 A 89 LYS H A 89 LYS HBx 1.0 . 3.77 457 406 A 89 LYS H A 89 LYS HBy 1.0 . 3.77 458 407 A 89 LYS H A 90 PRO HDy 1.0 . 4.98 459 408 A 89 LYS H A 89 LYS HGx 1.0 . 4.34 460 408 A 89 LYS H A 89 LYS HGy 1.0 . 4.34 461 409 A 87 VAL H A 89 LYS H 1.0 . 4.35 462 410 A 87 VAL H A 87 VAL HGx% 1.0 . 4.85 463 411 A 88 PHE H A 87 VAL HGx% 1.0 . 5.14 464 412 A 88 PHE H A 87 VAL HGy% 1.0 . 4.55 465 413 A 88 PHE H A 89 LYS HGx 1.0 . 5.10 466 413 A 88 PHE H A 89 LYS HGy 1.0 . 5.10 467 414 A 81 GLN H A 80 ILE H 1.0 . 3.60 468 415 A 80 ILE HB A 80 ILE H 1.0 . 3.42 469 416 A 80 ILE H A 79 ALA HB% 1.0 . 3.91 470 417 A 80 ILE HG2% A 80 ILE H 1.0 . 3.85 471 418 A 80 ILE H A 80 ILE HD1% 1.0 . 5.34 472 419 A 50 ASP H A 51 LEU HDx% 1.0 . 5.44 473 419 A 51 LEU HDy% A 50 ASP H 1.0 . 5.44 474 420 A 50 ASP HBy A 50 ASP H 1.0 . 4.14 475 421 A 52 THR H A 50 ASP H 1.0 . 4.61 476 422 A 51 LEU H A 50 ASP H 1.0 . 4.62 477 423 A 50 ASP H A 50 ASP HBx 1.0 . 3.53 478 424 A 85 CYS H A 83 PHE HA 1.0 . 4.52 479 425 A 83 PHE H A 85 CYS H 1.0 . 4.21 480 426 A 85 CYS H A 84 LEU H 1.0 . 3.79 481 427 A 85 CYS H A 85 CYS HBy 1.0 . 3.82 482 428 A 85 CYS HBx A 85 CYS H 1.0 . 3.70 483 429 A 85 CYS H A 84 LEU HDy% 1.0 . 4.99 484 430 A 85 CYS H A 84 LEU HBy 1.0 . 3.64 485 431 A 30 THR H A 46 LEU HA 1.0 . 4.01 486 432 A 30 THR H A 29 PRO HA 1.0 . 3.28 487 433 A 30 THR HG2% A 30 THR H 1.0 . 3.77 488 434 A 30 THR H A 46 LEU HDy% 1.0 . 4.10 489 435 A 50 ASP H A 49 LEU HBx 1.0 . 4.20 490 435 A 49 LEU HBy A 50 ASP H 1.0 . 4.20 491 436 A 25 ALA HB% A 50 ASP H 1.0 . 4.86 492 437 A 49 LEU H A 50 ASP H 1.0 . 3.65 493 438 A 48 SER HA A 50 ASP H 1.0 . 3.60 494 439 A 50 ASP H A 48 SER HBx 1.0 . 4.56 495 439 A 50 ASP H A 48 SER HBy 1.0 . 4.56 496 440 A 50 ASP H A 49 LEU HDx% 1.0 . 4.99 497 441 A 85 CYS H A 84 LEU HG 1.0 . 5.40 498 442 A 138 THR H A 137 PRO HDx 1.0 . 5.38 499 443 A 138 THR H A 137 PRO HBx 1.0 . 3.84 500 444 A 138 THR H A 138 THR HB 1.0 . 4.05 501 445 A 138 THR H A 137 PRO HBy 1.0 . 4.24 502 446 A 138 THR H A 138 THR HG2% 1.0 . 4.05 503 447 A 105 SER H A 104 PRO HBy 1.0 . 4.44 504 448 A 110 ARG H A 109 CYS H 1.0 . 3.77 505 449 A 105 SER H A 108 MET HGy 1.0 . 5.20 506 449 A 105 SER H A 108 MET HGx 1.0 . 5.20 507 450 A 105 SER H A 104 PRO HA 1.0 . 3.25 508 451 A 105 SER HB3 A 105 SER H 1.0 . 3.96 509 452 A 132 ASN H A 132 ASN HD2y 1.0 . 4.14 510 453 A 132 ASN HD2x A 135 LEU HDx% 1.0 . 4.93 511 454 A 65 ASN HBy A 65 ASN HD2x 1.0 . 3.99 512 455 A 121 ASN HBy A 134 THR H 1.0 . 4.73 513 456 A 65 ASN HBy A 65 ASN HD2y 1.0 . 3.58 514 457 A 62 ASP HA A 65 ASN H 1.0 . 4.79 515 458 A 65 ASN HD2y A 65 ASN H 1.0 . 3.44 516 459 A 65 ASN HBy A 65 ASN H 1.0 . 2.97 517 460 A 64 LEU HBy A 65 ASN H 1.0 . 4.25 518 461 A 65 ASN H A 64 LEU HG 1.0 . 4.91 519 462 A 65 ASN H A 64 LEU HDx% 1.0 . 4.88 520 463 A 65 ASN H A 64 LEU HDy% 1.0 . 4.89 521 464 A 63 LYS HA A 65 ASN H 1.0 . 4.60 522 465 A 110 ARG H A 111 ILE H 1.0 . 4.20 523 466 A 135 LEU H A 134 THR H 1.0 . 3.41 524 467 A 133 GLU H A 134 THR H 1.0 . 3.93 525 468 A 134 THR H A 133 GLU HBx 1.0 . 4.24 526 468 A 134 THR H A 133 GLU HBy 1.0 . 4.24 527 469 A 134 THR H A 134 THR HG2% 1.0 . 3.96 528 470 A 65 ASN HD2y A 62 ASP HA 1.0 . 4.45 529 471 A 111 ILE H A 111 ILE HB 1.0 . 3.60 530 472 A 110 ARG HBx A 111 ILE H 1.0 . 3.38 531 473 A 111 ILE H A 111 ILE HG1y 1.0 . 4.39 532 474 A 70 LEU HA A 72 HIS H 1.0 . 4.62 533 475 A 72 HIS H A 71 LYS HBx 1.0 . 4.48 534 476 A 134 THR H A 121 ASN HA 1.0 . 4.84 535 477 A 22 VAL H A 22 VAL HG2% 1.0 . 4.84 536 478 A 23 ARG H A 22 VAL H 1.0 . 4.34 537 479 A 96 ASN HBx A 96 ASN HD2y 1.0 . 3.50 538 480 A 31 SER HA A 32 ASN HD2y 1.0 . 5.00 539 481 A 32 ASN HD2y A 32 ASN HBx 1.0 . 3.45 540 481 A 32 ASN HBy A 32 ASN HD2y 1.0 . 3.45 541 482 A 61 ASN HD2x A 89 LYS HEx 1.0 . 4.33 542 483 A 21 MET H A 22 VAL H 1.0 . 4.83 543 484 A 98 GLU HGy A 96 ASN HD2y 1.0 . 5.07 544 485 A 96 ASN HD2y A 95 ILE HG2% 1.0 . 4.96 545 486 A 97 GLY H A 96 ASN HD2y 1.0 . 5.12 546 487 A 64 LEU HG A 61 ASN HD2y 1.0 . 5.16 547 488 A 32 ASN HD2x A 32 ASN HBx 1.0 . 3.94 548 488 A 32 ASN HBy A 32 ASN HD2x 1.0 . 3.94 549 489 A 61 ASN HD2y A 64 LEU HDy% 1.0 . 4.88 550 490 A 122 THR HB A 123 THR H 1.0 . 4.62 551 491 A 124 PHE H A 123 THR H 1.0 . 4.71 552 492 A 123 THR H A 123 THR HG2% 1.0 . 4.67 553 493 A 121 ASN H A 121 ASN HD2y 1.0 . 4.75 554 494 A 122 THR HB A 121 ASN HD2y 1.0 . 4.43 555 495 A 121 ASN HD2x A 122 THR HG2% 1.0 . 5.10 556 496 A 121 ASN H A 121 ASN HD2x 1.0 . 4.07 557 497 A 123 THR H A 122 THR HG2% 1.0 . 5.50 558 498 A 121 ASN HD2y A 122 THR HA 1.0 . 4.73 559 499 A 117 ARG H A 116 CYS H 1.0 . 4.47 560 500 A 116 CYS H A 116 CYS HBy 1.0 . 3.64 561 501 A 116 CYS H A 115 PRO HGy 1.0 . 3.63 562 502 A 116 CYS H A 115 PRO HBx 1.0 . 4.86 563 503 A 134 THR HG2% A 121 ASN HD2x 1.0 . 5.06 564 504 A 48 SER H A 47 SER HBx 1.0 . 4.49 565 505 A 28 TYR H A 47 SER H 1.0 . 3.76 566 506 A 46 LEU HA A 47 SER H 1.0 . 3.10 567 507 A 47 SER H A 46 LEU HDy% 1.0 . 4.59 568 508 A 47 SER H A 92 CYS HBx 1.0 . 4.84 569 509 A 47 SER H A 46 LEU HG 1.0 . 5.50 570 510 A 46 LEU HBx A 47 SER H 1.0 . 3.95 571 511 A 90 PRO HDy A 48 SER H 1.0 . 4.81 572 512 A 48 SER H A 90 PRO HGx 1.0 . 4.55 573 512 A 48 SER H A 90 PRO HGy 1.0 . 4.55 574 513 A 48 SER H A 47 SER HBy 1.0 . 4.11 575 514 A 48 SER H A 90 PRO HBx 1.0 . 4.51 576 514 A 48 SER H A 90 PRO HBy 1.0 . 4.51 577 515 A 48 SER H A 28 TYR HE% 1.0 . 4.93 578 516 A 46 LEU HBy A 47 SER H 1.0 . 3.93 579 517 A 28 TYR HD% A 47 SER H 1.0 . 4.30 580 518 A 48 SER H A 47 SER H 1.0 . 4.34 581 519 A 128 PHE H A 128 PHE HBy 1.0 . 3.95 582 520 A 128 PHE H A 128 PHE HBx 1.0 . 4.00 583 521 A 128 PHE H A 127 LYS HBx 1.0 . 3.82 584 521 A 128 PHE H A 127 LYS HBy 1.0 . 3.82 585 522 A 128 PHE H A 127 LYS HGy 1.0 . 4.27 586 523 A 81 GLN HE2y A 78 ALA H 1.0 . 4.64 587 524 A 112 THR H A 113 MET HGx 1.0 . 4.43 588 524 A 112 THR H A 113 MET HGy 1.0 . 4.43 589 525 A 112 THR HG2% A 112 THR H 1.0 . 3.67 590 526 A 112 THR H A 111 ILE HG2% 1.0 . 4.95 591 527 A 81 GLN HE2y A 78 ALA HB% 1.0 . 4.75 592 528 A 78 ALA HB% A 81 GLN HE2x 1.0 . 5.47 593 529 A 122 THR H A 122 THR HG2% 1.0 . 3.93 594 530 A 112 THR H A 111 ILE HB 1.0 . 4.40 595 531 A 122 THR H A 121 ASN HBy 1.0 . 4.13 596 532 A 122 THR H A 120 TYR HA 1.0 . 5.47 597 533 A 37 CYS H A 36 THR H 1.0 . 4.46 598 534 A 36 THR HG2% A 36 THR H 1.0 . 4.09 599 535 A 42 LEU H A 36 THR H 1.0 . 4.59 600 536 A 36 THR H A 35 ASN HBy 1.0 . 4.68 601 537 A 36 THR H A 42 LEU HDy% 1.0 . 4.60 602 537 A 42 LEU HDx% A 36 THR H 1.0 . 4.60 603 538 A 35 ASN H A 36 THR H 1.0 . 4.71 604 539 A 55 HIS H A 56 THR H 1.0 . 3.28 605 540 A 54 PHE HBy A 56 THR H 1.0 . 3.56 606 541 A 56 THR HG2% A 56 THR H 1.0 . 3.92 607 542 A 56 THR H A 49 LEU HDx% 1.0 . 4.70 608 543 A 56 THR H A 59 GLU HBx 1.0 . 3.49 609 543 A 59 GLU HBy A 56 THR H 1.0 . 3.49 610 544 A 35 ASN HD2y A 89 LYS HDx 1.0 . 4.97 611 545 A 36 THR H A 35 ASN HD2x 1.0 . 4.95 612 546 A 52 THR H A 51 LEU HA 1.0 . 3.46 613 547 A 52 THR HG2% A 52 THR H 1.0 . 4.05 614 548 A 52 THR H A 51 LEU HBy 1.0 . 4.54 615 549 A 52 THR H A 51 LEU HDx% 1.0 . 4.81 616 549 A 52 THR H A 51 LEU HDy% 1.0 . 4.81 617 550 A 31 SER H A 34 THR H 1.0 . 4.60 618 551 A 34 THR H A 33 ALA HB% 1.0 . 4.08 619 552 A 34 THR H A 34 THR HG2% 1.0 . 4.29 620 553 A 39 GLY H A 36 THR HG2% 1.0 . 4.73 621 554 A 39 GLY H A 38 PHE HBx 1.0 . 4.55 622 555 A 38 PHE HD% A 39 GLY H 1.0 . 4.38 623 556 A 39 GLY H A 38 PHE HA 1.0 . 3.46 624 557 A 97 GLY H A 96 ASN H 1.0 . 4.17 625 558 A 97 GLY H A 94 LYS HDx 1.0 . 4.42 626 558 A 94 LYS HDy A 97 GLY H 1.0 . 4.42 627 559 A 97 GLY H A 94 LYS HGy 1.0 . 4.64 628 560 A 97 GLY H A 95 ILE HG2% 1.0 . 4.85 629 561 A 56 THR HB A 49 LEU HDx% 1.0 . 5.15 630 562 A 41 LYS HA A 36 THR HB 1.0 . 4.22 631 563 A 54 PHE HD% A 52 THR HB 1.0 . 4.44 632 564 A 77 TRP HBx A 74 PRO HA 1.0 . 3.45 633 565 A 78 ALA HB% A 74 PRO HA 1.0 . 5.04 634 566 A 101 VAL HB A 48 SER HBx 1.0 . 4.33 635 566 A 101 VAL HB A 48 SER HBy 1.0 . 4.33 636 567 A 77 TRP HBy A 74 PRO HA 1.0 . 4.29 637 568 A 27 CYS HA A 48 SER HBx 1.0 . 4.41 638 568 A 27 CYS HA A 48 SER HBy 1.0 . 4.41 639 569 A 31 SER HBy A 32 ASN HBx 1.0 . 5.37 640 569 A 31 SER HBy A 32 ASN HBy 1.0 . 5.37 641 570 A 33 ALA HB% A 31 SER HBx 1.0 . 4.79 642 571 A 105 SER HB3 A 107 GLU HBy 1.0 . 4.25 643 572 A 138 THR HG2% A 105 SER HB3 1.0 . 5.06 644 573 A 30 THR HG2% A 47 SER HBy 1.0 . 4.60 645 574 A 28 TYR HE% A 47 SER HBx 1.0 . 4.94 646 575 A 30 THR HG2% A 47 SER HBx 1.0 . 4.32 647 576 A 134 THR HG2% A 134 THR HA 1.0 . 3.35 648 577 A 111 ILE HG1y A 111 ILE HA 1.0 . 4.23 649 578 A 88 PHE HD% A 87 VAL HA 1.0 . 4.87 650 579 A 118 ILE HA A 118 ILE HG1x 1.0 . 3.67 651 580 A 111 ILE HA A 111 ILE HG1x 1.0 . 3.99 652 581 A 40 SER HBy A 41 LYS HGx 1.0 . 5.37 653 581 A 40 SER HBx A 41 LYS HGx 1.0 . 5.37 654 581 A 41 LYS HGy A 40 SER HBx 1.0 . 5.37 655 581 A 40 SER HBy A 41 LYS HGy 1.0 . 5.37 656 582 A 19 SER HA A 19 SER HBx 1.0 . 2.71 657 582 A 19 SER HA A 19 SER HBy 1.0 . 2.71 658 583 A 91 LYS HBx A 90 PRO HA 1.0 . 4.64 659 584 A 122 THR HA A 123 THR HA 1.0 . 4.53 660 585 A 123 THR HG2% A 123 THR HA 1.0 . 3.27 661 586 A 118 ILE HD1% A 118 ILE HA 1.0 . 3.42 662 587 A 79 ALA HB% A 112 THR HA 1.0 . 3.47 663 588 A 112 THR HG2% A 112 THR HA 1.0 . 3.41 664 589 A 79 ALA HB% A 80 ILE HA 1.0 . 5.21 665 590 A 67 TYR HA A 67 TYR HD% 1.0 . 4.09 666 591 A 46 LEU HA A 29 PRO HA 1.0 . 3.47 667 592 A 29 PRO HA A 46 LEU HG 1.0 . 4.89 668 593 A 138 THR HA A 139 LYS HGx 1.0 . 4.44 669 593 A 138 THR HA A 139 LYS HGy 1.0 . 4.44 670 594 A 138 THR HA A 138 THR HB 1.0 . 2.82 671 595 A 138 THR HA A 106 TYR HBx 1.0 . 3.56 672 596 A 138 THR HA A 138 THR HG2% 1.0 . 3.27 673 597 A 83 PHE HD% A 80 ILE HA 1.0 . 4.17 674 598 A 83 PHE HBy A 80 ILE HA 1.0 . 4.44 675 599 A 83 PHE HBx A 80 ILE HA 1.0 . 4.45 676 600 A 67 TYR HA A 70 LEU HBx 1.0 . 4.60 677 601 A 81 GLN HA A 38 PHE HE% 1.0 . 3.95 678 602 A 81 GLN HA A 77 TRP HZ3 1.0 . 4.53 679 603 A 81 GLN HA A 84 LEU HBy 1.0 . 4.49 680 604 A 81 GLN HA A 81 GLN HGx 1.0 . 3.44 681 605 A 28 TYR HE% A 30 THR HA 1.0 . 3.77 682 606 A 30 THR HB A 30 THR HA 1.0 . 2.89 683 607 A 68 TYR HA A 68 TYR HE% 1.0 . 4.46 684 608 A 68 TYR HA A 71 LYS HGy 1.0 . 4.57 685 609 A 34 THR HG2% A 34 THR HA 1.0 . 3.09 686 610 A 33 ALA HB% A 34 THR HA 1.0 . 4.74 687 611 A 88 PHE HD% A 88 PHE HA 1.0 . 4.32 688 612 A 95 ILE HA A 95 ILE HG1x 1.0 . 3.64 689 613 A 114 GLU HA A 114 GLU HBx 1.0 . 2.96 690 614 A 127 LYS HA A 127 LYS HBx 1.0 . 2.78 691 614 A 127 LYS HA A 127 LYS HBy 1.0 . 2.78 692 615 A 127 LYS HA A 127 LYS HGy 1.0 . 3.91 693 616 A 120 TYR HD% A 120 TYR HA 1.0 . 3.68 694 617 A 57 GLU HBy A 57 GLU HA 1.0 . 2.96 695 618 A 57 GLU HA A 49 LEU HDy% 1.0 . 3.52 696 619 A 110 ARG HA A 110 ARG HDx 1.0 . 4.94 697 619 A 110 ARG HA A 110 ARG HDy 1.0 . 4.94 698 620 A 110 ARG HA A 113 MET HBx 1.0 . 4.30 699 620 A 110 ARG HA A 113 MET HBy 1.0 . 4.30 700 621 A 110 ARG HA A 110 ARG HGx 1.0 . 3.21 701 621 A 110 ARG HA A 110 ARG HGy 1.0 . 3.21 702 622 A 110 ARG HA A 111 ILE HA 1.0 . 4.92 703 623 A 120 TYR HD% A 117 ARG HA 1.0 . 4.87 704 624 A 36 THR HA A 35 ASN HA 1.0 . 4.75 705 625 A 36 THR HA A 41 LYS HA 1.0 . 3.21 706 626 A 36 THR HA A 41 LYS HBx 1.0 . 4.52 707 626 A 36 THR HA A 41 LYS HBy 1.0 . 4.52 708 627 A 36 THR HA A 41 LYS HGx 1.0 . 3.83 709 627 A 36 THR HA A 41 LYS HGy 1.0 . 3.83 710 628 A 36 THR HA A 42 LEU HDy% 1.0 . 4.52 711 629 A 56 THR HA A 57 GLU HA 1.0 . 4.70 712 630 A 56 THR HA A 56 THR HG2% 1.0 . 3.36 713 631 A 70 LEU HG A 77 TRP HA 1.0 . 4.66 714 632 A 77 TRP HZ3 A 77 TRP HA 1.0 . 4.59 715 633 A 15 VAL HA A 16 PRO HBx 1.0 . 4.69 716 633 A 16 PRO HBy A 15 VAL HA 1.0 . 4.69 717 634 A 75 LYS HA A 75 LYS HDx 1.0 . 3.29 718 634 A 75 LYS HA A 75 LYS HDy 1.0 . 3.29 719 635 A 75 LYS HA A 75 LYS HGx 1.0 . 3.30 720 635 A 75 LYS HA A 75 LYS HGy 1.0 . 3.30 721 636 A 54 PHE HD% A 59 GLU HA 1.0 . 4.58 722 637 A 62 ASP HBy A 59 GLU HA 1.0 . 3.87 723 638 A 59 GLU HA A 59 GLU HBx 1.0 . 2.89 724 638 A 59 GLU HBy A 59 GLU HA 1.0 . 2.89 725 639 A 107 GLU HA A 107 GLU HGx 1.0 . 3.59 726 639 A 107 GLU HA A 107 GLU HGy 1.0 . 3.59 727 640 A 110 ARG HBy A 107 GLU HA 1.0 . 3.51 728 641 A 54 PHE HD% A 60 LEU HA 1.0 . 4.93 729 642 A 71 LYS HA A 77 TRP HD1 1.0 . 4.96 730 643 A 101 VAL HA A 92 CYS HBy 1.0 . 4.75 731 644 A 56 THR HA A 56 THR HB 1.0 . 2.88 732 645 A 115 PRO HBx A 76 CYS HA 1.0 . 3.57 733 646 A 76 CYS HA A 70 LEU HDy% 1.0 . 4.04 734 647 A 38 PHE HD% A 38 PHE HA 1.0 . 3.33 735 648 A 111 ILE HD1% A 107 GLU HA 1.0 . 5.12 736 649 A 108 MET HA A 108 MET HGy 1.0 . 3.73 737 649 A 108 MET HGx A 108 MET HA 1.0 . 3.73 738 650 A 111 ILE HD1% A 108 MET HA 1.0 . 4.15 739 651 A 71 LYS HA A 77 TRP HA 1.0 . 4.80 740 652 A 71 LYS HA A 77 TRP HBy 1.0 . 3.68 741 653 A 52 THR HA A 54 PHE HE% 1.0 . 4.96 742 654 A 52 THR HG2% A 52 THR HA 1.0 . 3.86 743 655 A 22 VAL HA A 101 VAL HGy% 1.0 . 4.48 744 656 A 92 CYS HA A 101 VAL HA 1.0 . 3.27 745 657 A 101 VAL HA A 100 MET HBx 1.0 . 4.87 746 658 A 24 ARG HA A 24 ARG HDx 1.0 . 4.28 747 658 A 24 ARG HA A 24 ARG HDy 1.0 . 4.28 748 659 A 24 ARG HA A 24 ARG HGx 1.0 . 3.34 749 659 A 24 ARG HA A 24 ARG HGy 1.0 . 3.34 750 660 A 76 CYS HA A 115 PRO HBy 1.0 . 3.12 751 661 A 139 LYS HA A 139 LYS HBy 1.0 . 2.92 752 662 A 139 LYS HA A 139 LYS HGx 1.0 . 4.04 753 662 A 139 LYS HGy A 139 LYS HA 1.0 . 4.04 754 663 A 67 TYR HD% A 64 LEU HA 1.0 . 3.52 755 664 A 64 LEU HA A 64 LEU HDx% 1.0 . 4.28 756 665 A 84 LEU HA A 88 PHE HD% 1.0 . 4.48 757 666 A 91 LYS HA A 91 LYS HGx 1.0 . 3.97 758 666 A 91 LYS HGy A 91 LYS HA 1.0 . 3.97 759 667 A 91 LYS HA A 91 LYS HEx 1.0 . 5.31 760 668 A 91 LYS HA A 44 TYR HD% 1.0 . 4.67 761 669 A 40 SER HA A 40 SER HBx 1.0 . 2.84 762 669 A 40 SER HA A 40 SER HBy 1.0 . 2.84 763 670 A 54 PHE HA A 54 PHE HD% 1.0 . 3.45 764 671 A 102 TYR HA A 103 LEU HBx 1.0 . 4.42 765 671 A 103 LEU HBy A 102 TYR HA 1.0 . 4.42 766 672 A 102 TYR HD% A 102 TYR HA 1.0 . 3.99 767 673 A 22 VAL HA A 102 TYR HA 1.0 . 3.61 768 674 A 102 TYR HA A 101 VAL HGy% 1.0 . 4.63 769 675 A 85 CYS HA A 89 LYS HBx 1.0 . 3.28 770 675 A 85 CYS HA A 89 LYS HBy 1.0 . 3.28 771 676 A 137 PRO HBx A 105 SER HA 1.0 . 4.75 772 677 A 69 ALA HB% A 66 ASP HA 1.0 . 5.22 773 678 A 72 HIS HA A 72 HIS HD2 1.0 . 4.88 774 679 A 70 LEU HA A 70 LEU HDx% 1.0 . 4.12 775 680 A 70 LEU HA A 70 LEU HDy% 1.0 . 3.95 776 681 A 70 LEU HA A 69 ALA HB% 1.0 . 4.99 777 682 A 106 TYR HD% A 105 SER HA 1.0 . 4.19 778 683 A 55 HIS HA A 49 LEU HDx% 1.0 . 3.79 779 684 A 125 PHE HA A 126 PRO HDx 1.0 . 3.24 780 685 A 94 LYS HA A 94 LYS HGy 1.0 . 3.78 781 686 A 65 ASN HA A 65 ASN HBx 1.0 . 2.82 782 687 A 49 LEU HG A 49 LEU HA 1.0 . 3.63 783 688 A 99 ASP HA A 94 LYS HA 1.0 . 2.97 784 689 A 17 ARG HA A 17 ARG HGx 1.0 . 2.84 785 689 A 17 ARG HA A 17 ARG HGy 1.0 . 2.84 786 690 A 135 LEU HBx A 135 LEU HA 1.0 . 2.92 787 691 A 28 TYR HA A 29 PRO HG3 1.0 . 4.50 788 692 A 28 TYR HD% A 28 TYR HA 1.0 . 4.38 789 693 A 28 TYR HA A 29 PRO HDy 1.0 . 3.89 790 694 A 26 ARG HA A 99 ASP HBx 1.0 . 4.14 791 695 A 26 ARG HA A 26 ARG HGx 1.0 . 3.39 792 695 A 26 ARG HA A 26 ARG HGy 1.0 . 3.39 793 696 A 99 ASP HA A 94 LYS HGy 1.0 . 3.94 794 697 A 37 CYS HA A 42 LEU HDy% 1.0 . 4.43 795 698 A 28 TYR HA A 29 PRO HDx 1.0 . 3.74 796 699 A 93 GLU HA A 93 GLU HGy 1.0 . 3.86 797 700 A 14 LEU HA A 23 ARG HDx 1.0 . 4.50 798 700 A 14 LEU HA A 23 ARG HDy 1.0 . 4.50 799 701 A 14 LEU HA A 14 LEU HDx% 1.0 . 3.29 800 701 A 14 LEU HA A 14 LEU HDy% 1.0 . 3.29 801 702 A 92 CYS HA A 101 VAL HB 1.0 . 4.23 802 703 A 92 CYS HA A 101 VAL HGx% 1.0 . 4.43 803 704 A 92 CYS HA A 101 VAL HGy% 1.0 . 5.13 804 705 A 132 ASN HD2y A 131 CYS HA 1.0 . 4.97 805 706 A 131 CYS HA A 83 PHE HZ 1.0 . 3.54 806 707 A 98 GLU HA A 98 GLU HGx 1.0 . 3.32 807 708 A 98 GLU HA A 98 GLU HBx 1.0 . 2.77 808 708 A 98 GLU HBy A 98 GLU HA 1.0 . 2.77 809 709 A 23 ARG HA A 22 VAL HG1% 1.0 . 4.96 810 710 A 69 ALA HA A 68 TYR HBx 1.0 . 4.66 811 710 A 68 TYR HBy A 69 ALA HA 1.0 . 4.66 812 711 A 92 CYS HA A 102 TYR HD% 1.0 . 4.37 813 712 A 91 LYS HA A 92 CYS HA 1.0 . 4.62 814 713 A 136 PHE HA A 136 PHE HD% 1.0 . 3.99 815 714 A 136 PHE HA A 137 PRO HDy 1.0 . 3.90 816 715 A 46 LEU HA A 46 LEU HG 1.0 . 4.10 817 716 A 100 MET HA A 100 MET HGy 1.0 . 3.89 818 717 A 100 MET HA A 24 ARG HA 1.0 . 3.39 819 718 A 89 LYS HA A 90 PRO HDx 1.0 . 4.06 820 719 A 111 ILE HG2% A 79 ALA HA 1.0 . 4.48 821 720 A 47 SER HA A 92 CYS HBx 1.0 . 4.06 822 721 A 47 SER HA A 92 CYS HBy 1.0 . 4.07 823 722 A 47 SER HA A 90 PRO HGx 1.0 . 4.64 824 722 A 47 SER HA A 90 PRO HGy 1.0 . 4.64 825 723 A 47 SER HA A 46 LEU HBx 1.0 . 4.18 826 724 A 89 LYS HA A 88 PHE HBy 1.0 . 4.34 827 725 A 129 LEU HA A 129 LEU HDy% 1.0 . 3.54 828 725 A 129 LEU HA A 129 LEU HDx% 1.0 . 3.54 829 726 A 129 LEU HA A 87 VAL HGy% 1.0 . 5.05 830 727 A 30 THR HG2% A 35 ASN HA 1.0 . 3.50 831 728 A 33 ALA HA A 32 ASN HBx 1.0 . 4.20 832 728 A 32 ASN HBy A 33 ALA HA 1.0 . 4.20 833 729 A 112 THR HA A 79 ALA HA 1.0 . 4.59 834 730 A 121 ASN HBy A 121 ASN HA 1.0 . 2.85 835 731 A 103 LEU HA A 104 PRO HDy 1.0 . 4.07 836 732 A 28 TYR HD% A 27 CYS HA 1.0 . 4.98 837 733 A 48 SER HA A 27 CYS HA 1.0 . 3.80 838 734 A 27 CYS HA A 46 LEU HBx 1.0 . 4.28 839 735 A 25 ALA HA A 101 VAL HGy% 1.0 . 4.60 840 736 A 42 LEU HA A 43 PRO HDx 1.0 . 3.79 841 737 A 42 LEU HA A 43 PRO HDy 1.0 . 3.66 842 738 A 42 LEU HDx% A 42 LEU HA 1.0 . 3.57 843 739 A 27 CYS HA A 26 ARG HBx 1.0 . 4.72 844 740 A 27 CYS HA A 26 ARG HGx 1.0 . 4.65 845 740 A 26 ARG HGy A 27 CYS HA 1.0 . 4.65 846 741 A 74 PRO HDy A 75 LYS HGx 1.0 . 4.94 847 741 A 75 LYS HGy A 74 PRO HDy 1.0 . 4.94 848 742 A 15 VAL HA A 16 PRO HDx 1.0 . 4.82 849 742 A 16 PRO HDy A 15 VAL HA 1.0 . 4.82 850 743 A 28 TYR HB2 A 29 PRO HDy 1.0 . 4.64 851 744 A 28 TYR HD% A 29 PRO HDy 1.0 . 4.90 852 745 A 28 TYR HB3 A 29 PRO HDy 1.0 . 4.95 853 746 A 51 LEU HG A 104 PRO HDy 1.0 . 5.03 854 747 A 83 PHE HZ A 104 PRO HDx 1.0 . 4.83 855 748 A 15 VAL HGy% A 16 PRO HDx 1.0 . 4.47 856 748 A 16 PRO HDy A 15 VAL HGy% 1.0 . 4.47 857 749 A 42 LEU HBx A 43 PRO HDy 1.0 . 4.65 858 750 A 44 TYR HE% A 43 PRO HDy 1.0 . 4.85 859 751 A 137 PRO HDx A 136 PHE HA 1.0 . 3.73 860 752 A 90 PRO HDy A 89 LYS HA 1.0 . 3.70 861 753 A 42 LEU HDx% A 43 PRO HDy 1.0 . 5.18 862 754 A 44 TYR HD% A 43 PRO HDy 1.0 . 4.96 863 755 A 111 ILE HG2% A 82 PRO HDy 1.0 . 4.75 864 756 A 82 PRO HDx A 81 GLN HGy 1.0 . 4.95 865 757 A 111 ILE HG2% A 82 PRO HDx 1.0 . 4.43 866 758 A 37 CYS HBy A 42 LEU HG 1.0 . 4.82 867 759 A 36 THR HA A 37 CYS HBx 1.0 . 4.67 868 760 A 97 GLY HAy A 94 LYS HDx 1.0 . 4.51 869 760 A 94 LYS HDy A 97 GLY HAy 1.0 . 4.51 870 761 A 14 LEU HBy A 13 GLY HAx 1.0 . 4.36 871 761 A 14 LEU HBy A 13 GLY HAy 1.0 . 4.36 872 762 A 36 THR HG2% A 39 GLY HAx 1.0 . 4.63 873 763 A 97 GLY HAx A 94 LYS HDx 1.0 . 3.97 874 763 A 94 LYS HDy A 97 GLY HAx 1.0 . 3.97 875 764 A 129 LEU HBy A 129 LEU HDy% 1.0 . 3.87 876 764 A 129 LEU HBy A 129 LEU HDx% 1.0 . 3.87 877 765 A 129 LEU HBx A 129 LEU HDy% 1.0 . 3.97 878 765 A 129 LEU HBx A 129 LEU HDx% 1.0 . 3.97 879 766 A 27 CYS HBy A 46 LEU HBx 1.0 . 4.61 880 767 A 26 ARG HDx A 26 ARG HGx 1.0 . 2.49 881 767 A 26 ARG HDy A 26 ARG HGx 1.0 . 2.49 882 767 A 26 ARG HGy A 26 ARG HDx 1.0 . 2.49 883 767 A 26 ARG HDy A 26 ARG HGy 1.0 . 2.49 884 768 A 17 ARG HA A 17 ARG HDx 1.0 . 3.51 885 768 A 17 ARG HA A 17 ARG HDy 1.0 . 3.51 886 769 A 17 ARG HDy A 17 ARG HGx 1.0 . 2.64 887 769 A 17 ARG HDx A 17 ARG HGx 1.0 . 2.64 888 769 A 17 ARG HGy A 17 ARG HDx 1.0 . 2.64 889 769 A 17 ARG HGy A 17 ARG HDy 1.0 . 2.64 890 770 A 117 ARG HBy A 117 ARG HDx 1.0 . 3.28 891 770 A 117 ARG HBy A 117 ARG HDy 1.0 . 3.28 892 771 A 46 LEU HBx A 29 PRO HA 1.0 . 4.98 893 772 A 127 LYS HA A 127 LYS HEx 1.0 . 4.55 894 772 A 127 LYS HA A 127 LYS HEy 1.0 . 4.55 895 773 A 89 LYS HEy A 60 LEU HDx% 1.0 . 4.39 896 773 A 60 LEU HDy% A 89 LYS HEy 1.0 . 4.39 897 774 A 61 ASN HD2y A 89 LYS HEy 1.0 . 4.20 898 775 A 89 LYS HEy A 64 LEU HDx% 1.0 . 3.98 899 776 A 127 LYS HA A 130 ARG HDx 1.0 . 3.82 900 776 A 127 LYS HA A 130 ARG HDy 1.0 . 3.82 901 777 A 130 ARG HBy A 130 ARG HDx 1.0 . 3.31 902 777 A 130 ARG HBx A 130 ARG HDx 1.0 . 3.31 903 777 A 130 ARG HDy A 130 ARG HBx 1.0 . 3.31 904 777 A 130 ARG HBy A 130 ARG HDy 1.0 . 3.31 905 778 A 130 ARG HA A 130 ARG HDx 1.0 . 4.01 906 778 A 130 ARG HA A 130 ARG HDy 1.0 . 4.01 907 779 A 89 LYS HEx A 89 LYS HGx 1.0 . 3.75 908 779 A 89 LYS HGy A 89 LYS HEx 1.0 . 3.75 909 780 A 89 LYS HEx A 60 LEU HDx% 1.0 . 4.24 910 780 A 60 LEU HDy% A 89 LYS HEx 1.0 . 4.24 911 781 A 89 LYS HEx A 64 LEU HDx% 1.0 . 3.97 912 782 A 60 LEU HBy A 54 PHE HD% 1.0 . 4.74 913 783 A 60 LEU HBx A 54 PHE HD% 1.0 . 4.90 914 784 A 57 GLU HA A 60 LEU HBx 1.0 . 4.57 915 785 A 14 LEU HBx A 14 LEU HDx% 1.0 . 3.52 916 785 A 14 LEU HDy% A 14 LEU HBx 1.0 . 3.52 917 786 A 67 TYR HE% A 63 LYS HEx 1.0 . 4.86 918 786 A 63 LYS HEy A 67 TYR HE% 1.0 . 4.86 919 787 A 75 LYS HDy A 75 LYS HEx 1.0 . 2.83 920 787 A 75 LYS HDx A 75 LYS HEx 1.0 . 2.83 921 787 A 75 LYS HEy A 75 LYS HDx 1.0 . 2.83 922 787 A 75 LYS HDy A 75 LYS HEy 1.0 . 2.83 923 788 A 63 LYS HEy A 63 LYS HGx 1.0 . 3.39 924 788 A 63 LYS HGy A 63 LYS HEx 1.0 . 3.39 925 788 A 63 LYS HGy A 63 LYS HEy 1.0 . 3.39 926 788 A 63 LYS HEx A 63 LYS HGx 1.0 . 3.39 927 789 A 75 LYS HA A 75 LYS HEx 1.0 . 3.79 928 789 A 75 LYS HA A 75 LYS HEy 1.0 . 3.79 929 790 A 74 PRO HBy A 75 LYS HEx 1.0 . 4.22 930 790 A 75 LYS HEy A 74 PRO HBy 1.0 . 4.22 931 791 A 34 THR HB A 41 LYS HEx 1.0 . 4.41 932 791 A 34 THR HB A 41 LYS HEy 1.0 . 4.41 933 792 A 36 THR HG2% A 41 LYS HEx 1.0 . 4.42 934 792 A 36 THR HG2% A 41 LYS HEy 1.0 . 4.42 935 793 A 57 GLU HA A 60 LEU HBy 1.0 . 4.40 936 794 A 136 PHE HD% A 135 LEU HBy 1.0 . 4.83 937 795 A 58 LYS HDy A 58 LYS HEx 1.0 . 2.53 938 795 A 58 LYS HDx A 58 LYS HEx 1.0 . 2.53 939 795 A 58 LYS HEy A 58 LYS HDx 1.0 . 2.53 940 795 A 58 LYS HDy A 58 LYS HEy 1.0 . 2.53 941 796 A 26 ARG HA A 99 ASP HBy 1.0 . 4.11 942 797 A 41 LYS HEy A 41 LYS HGx 1.0 . 2.98 943 797 A 41 LYS HEx A 41 LYS HGx 1.0 . 2.98 944 797 A 41 LYS HGy A 41 LYS HEx 1.0 . 2.98 945 797 A 41 LYS HGy A 41 LYS HEy 1.0 . 2.98 946 798 A 94 LYS HEy A 94 LYS HDx 1.0 . 2.72 947 798 A 94 LYS HDy A 94 LYS HEy 1.0 . 2.72 948 799 A 71 LYS HGy A 71 LYS HEy 1.0 . 3.75 949 800 A 68 TYR HD% A 71 LYS HEx 1.0 . 4.43 950 801 A 71 LYS HBy A 71 LYS HEx 1.0 . 4.33 951 802 A 71 LYS HGy A 71 LYS HEx 1.0 . 3.76 952 803 A 68 TYR HE% A 71 LYS HEx 1.0 . 4.88 953 804 A 50 ASP HBx A 51 LEU HDx% 1.0 . 4.78 954 804 A 51 LEU HDy% A 50 ASP HBx 1.0 . 4.78 955 805 A 50 ASP HBx A 101 VAL HGy% 1.0 . 4.65 956 806 A 92 CYS HBy A 101 VAL HGx% 1.0 . 4.78 957 807 A 101 VAL HA A 92 CYS HBx 1.0 . 4.81 958 808 A 64 LEU HBy A 64 LEU HDx% 1.0 . 3.98 959 809 A 64 LEU HBy A 61 ASN HA 1.0 . 4.17 960 810 A 64 LEU HBx A 67 TYR HD% 1.0 . 4.52 961 811 A 38 PHE HE% A 84 LEU HBx 1.0 . 5.00 962 812 A 84 LEU HBx A 84 LEU HDx% 1.0 . 3.96 963 813 A 68 TYR HE% A 71 LYS HEy 1.0 . 4.57 964 814 A 91 LYS HA A 91 LYS HEy 1.0 . 5.48 965 815 A 44 TYR HD% A 91 LYS HEy 1.0 . 4.69 966 816 A 102 TYR HE% A 91 LYS HEy 1.0 . 4.38 967 817 A 91 LYS HGy A 91 LYS HEy 1.0 . 3.46 968 817 A 91 LYS HEy A 91 LYS HGx 1.0 . 3.46 969 818 A 102 TYR HE% A 91 LYS HEx 1.0 . 4.86 970 819 A 91 LYS HGy A 91 LYS HEx 1.0 . 3.61 971 819 A 91 LYS HEx A 91 LYS HGx 1.0 . 3.61 972 820 A 91 LYS HBx A 91 LYS HEx 1.0 . 4.71 973 821 A 128 PHE HE% A 70 LEU HBy 1.0 . 4.01 974 822 A 92 CYS HBx A 48 SER HBx 1.0 . 4.64 975 822 A 48 SER HBy A 92 CYS HBx 1.0 . 4.64 976 823 A 42 LEU HBy A 42 LEU HDy% 1.0 . 3.84 977 824 A 84 LEU HA A 88 PHE HBy 1.0 . 5.41 978 825 A 89 LYS HGy A 88 PHE HBy 1.0 . 4.58 979 825 A 88 PHE HBy A 89 LYS HGx 1.0 . 4.58 980 826 A 88 PHE HBy A 60 LEU HDx% 1.0 . 4.67 981 826 A 60 LEU HDy% A 88 PHE HBy 1.0 . 4.67 982 827 A 88 PHE HBy A 64 LEU HDy% 1.0 . 5.03 983 828 A 89 LYS HGy A 88 PHE HBx 1.0 . 4.02 984 828 A 88 PHE HBx A 89 LYS HGx 1.0 . 4.02 985 829 A 54 PHE HD% A 53 ASP HB3 1.0 . 4.99 986 830 A 42 LEU HBx A 42 LEU HDy% 1.0 . 3.94 987 831 A 49 LEU HG A 54 PHE HBy 1.0 . 4.53 988 832 A 54 PHE HBy A 59 GLU HBx 1.0 . 4.79 989 832 A 59 GLU HBy A 54 PHE HBy 1.0 . 4.79 990 833 A 66 ASP HBy A 63 LYS HGx 1.0 . 4.28 991 833 A 66 ASP HBy A 63 LYS HGy 1.0 . 4.28 992 834 A 135 LEU HDx% A 132 ASN HBy 1.0 . 4.94 993 835 A 135 LEU HBx A 132 ASN HBy 1.0 . 4.19 994 836 A 95 ILE HB A 100 MET HGx 1.0 . 4.59 995 837 A 86 ALA HB% A 83 PHE HBy 1.0 . 5.07 996 838 A 83 PHE HBy A 80 ILE HD1% 1.0 . 5.23 997 839 A 28 TYR HB2 A 29 PRO HDx 1.0 . 4.69 998 840 A 66 ASP HBy A 63 LYS HBx 1.0 . 4.48 999 840 A 66 ASP HBy A 63 LYS HBy 1.0 . 4.48 1000 841 A 21 MET HE% A 136 PHE HBx 1.0 . 5.23 1001 842 A 58 LYS HA A 61 ASN HBy 1.0 . 3.70 1002 843 A 61 ASN HBy A 60 LEU HDx% 1.0 . 4.86 1003 843 A 61 ASN HBy A 60 LEU HDy% 1.0 . 4.86 1004 844 A 125 PHE HBx A 128 PHE HD% 1.0 . 4.50 1005 845 A 58 LYS HA A 61 ASN HBx 1.0 . 4.23 1006 846 A 50 ASP HBx A 51 LEU HBy 1.0 . 4.51 1007 847 A 80 ILE HB A 80 ILE HD1% 1.0 . 3.79 1008 848 A 44 TYR HBy A 45 GLU HGx 1.0 . 4.87 1009 848 A 44 TYR HBy A 45 GLU HGy 1.0 . 4.87 1010 849 A 73 VAL HB A 76 CYS HBx 1.0 . 4.21 1011 850 A 65 ASN HBy A 62 ASP HA 1.0 . 4.38 1012 851 A 125 PHE HBy A 129 LEU HDy% 1.0 . 5.22 1013 851 A 125 PHE HBy A 129 LEU HDx% 1.0 . 5.22 1014 852 A 125 PHE HBx A 129 LEU HDy% 1.0 . 5.09 1015 852 A 125 PHE HBx A 129 LEU HDx% 1.0 . 5.09 1016 853 A 125 PHE HBx A 128 PHE HE% 1.0 . 4.36 1017 854 A 67 TYR HBy A 70 LEU HDx% 1.0 . 5.21 1018 855 A 67 TYR HBx A 88 PHE HZ 1.0 . 4.90 1019 856 A 32 ASN HA A 32 ASN HBx 1.0 . 2.65 1020 856 A 32 ASN HBy A 32 ASN HA 1.0 . 2.65 1021 857 A 124 PHE HD% A 118 ILE HB 1.0 . 4.75 1022 858 A 118 ILE HB A 119 LEU HA 1.0 . 4.55 1023 859 A 68 TYR HBy A 71 LYS HDx 1.0 . 4.64 1024 859 A 68 TYR HBx A 71 LYS HDx 1.0 . 4.64 1025 859 A 71 LYS HDy A 68 TYR HBx 1.0 . 4.64 1026 859 A 68 TYR HBy A 71 LYS HDy 1.0 . 4.64 1027 860 A 96 ASN HBx A 95 ILE HG2% 1.0 . 3.91 1028 861 A 54 PHE HD% A 59 GLU HGy 1.0 . 4.65 1029 862 A 54 PHE HD% A 59 GLU HGx 1.0 . 4.88 1030 863 A 56 THR HG2% A 59 GLU HGx 1.0 . 5.04 1031 864 A 59 GLU HA A 59 GLU HGx 1.0 . 3.81 1032 865 A 45 GLU HGy A 46 LEU HDy% 1.0 . 4.07 1033 865 A 45 GLU HGx A 46 LEU HDy% 1.0 . 4.07 1034 866 A 59 GLU HA A 59 GLU HGy 1.0 . 3.79 1035 867 A 56 THR HG2% A 59 GLU HGy 1.0 . 4.90 1036 868 A 133 GLU HA A 133 GLU HGx 1.0 . 3.40 1037 868 A 133 GLU HGy A 133 GLU HA 1.0 . 3.40 1038 869 A 134 THR HG2% A 133 GLU HGx 1.0 . 4.18 1039 869 A 133 GLU HGy A 134 THR HG2% 1.0 . 4.18 1040 870 A 57 GLU HA A 57 GLU HGy 1.0 . 3.90 1041 871 A 28 TYR HE% A 57 GLU HGy 1.0 . 4.84 1042 872 A 57 GLU HGx A 49 LEU HDy% 1.0 . 4.73 1043 873 A 57 GLU HGx A 57 GLU HA 1.0 . 4.15 1044 874 A 98 GLU HGy A 98 GLU HA 1.0 . 3.51 1045 875 A 114 GLU HA A 114 GLU HGx 1.0 . 3.38 1046 875 A 114 GLU HA A 114 GLU HGy 1.0 . 3.38 1047 876 A 91 LYS HGx A 93 GLU HGy 1.0 . 4.63 1048 876 A 91 LYS HGy A 93 GLU HGy 1.0 . 4.63 1049 877 A 102 TYR HE% A 93 GLU HGx 1.0 . 4.23 1050 878 A 98 GLU HGx A 97 GLY HAy 1.0 . 4.71 1051 879 A 98 GLU HGx A 98 GLU HBx 1.0 . 2.88 1052 879 A 98 GLU HBy A 98 GLU HGx 1.0 . 2.88 1053 880 A 100 MET HBx A 22 VAL HB 1.0 . 4.15 1054 881 A 110 ARG HA A 109 CYS HBx 1.0 . 4.41 1055 882 A 115 PRO HDx A 114 GLU HGx 1.0 . 4.57 1056 882 A 115 PRO HDx A 114 GLU HGy 1.0 . 4.57 1057 883 A 102 TYR HE% A 93 GLU HGy 1.0 . 3.85 1058 884 A 100 MET HBy A 95 ILE HD1% 1.0 . 4.80 1059 885 A 95 ILE HD1% A 100 MET HBx 1.0 . 4.78 1060 886 A 83 PHE HZ A 131 CYS HBx 1.0 . 4.82 1061 887 A 102 TYR HE% A 93 GLU HBx 1.0 . 4.19 1062 888 A 23 ARG HBy A 23 ARG HDx 1.0 . 3.84 1063 888 A 23 ARG HBy A 23 ARG HDy 1.0 . 3.84 1064 889 A 23 ARG HBx A 23 ARG HDx 1.0 . 3.80 1065 889 A 23 ARG HBx A 23 ARG HDy 1.0 . 3.80 1066 890 A 100 MET HBx A 101 VAL HGy% 1.0 . 4.93 1067 891 A 102 TYR HE% A 93 GLU HBy 1.0 . 4.93 1068 892 A 15 VAL HB A 22 VAL HG1% 1.0 . 3.90 1069 893 A 24 ARG HDy A 98 GLU HBx 1.0 . 4.71 1070 893 A 24 ARG HDx A 98 GLU HBx 1.0 . 4.71 1071 893 A 98 GLU HBy A 24 ARG HDx 1.0 . 4.71 1072 893 A 98 GLU HBy A 24 ARG HDy 1.0 . 4.71 1073 894 A 138 THR HA A 139 LYS HBx 1.0 . 4.56 1074 895 A 38 PHE HE% A 81 GLN HGy 1.0 . 3.91 1075 896 A 81 GLN HA A 81 GLN HGy 1.0 . 3.71 1076 897 A 38 PHE HE% A 81 GLN HGx 1.0 . 4.27 1077 898 A 24 ARG HA A 100 MET HGy 1.0 . 4.21 1078 899 A 100 MET HGy A 95 ILE HD1% 1.0 . 4.79 1079 900 A 95 ILE HA A 100 MET HGx 1.0 . 4.88 1080 901 A 83 PHE HD% A 108 MET HBx 1.0 . 4.81 1081 901 A 83 PHE HD% A 108 MET HBy 1.0 . 4.81 1082 902 A 83 PHE HBx A 108 MET HBx 1.0 . 4.80 1083 902 A 83 PHE HBx A 108 MET HBy 1.0 . 4.80 1084 903 A 88 PHE HD% A 87 VAL HB 1.0 . 4.98 1085 904 A 83 PHE HA A 108 MET HGy 1.0 . 4.69 1086 904 A 83 PHE HA A 108 MET HGx 1.0 . 4.69 1087 905 A 83 PHE HD% A 108 MET HGy 1.0 . 4.45 1088 905 A 83 PHE HD% A 108 MET HGx 1.0 . 4.45 1089 906 A 24 ARG HA A 100 MET HGx 1.0 . 4.29 1090 907 A 83 PHE HD% A 104 PRO HBy 1.0 . 4.27 1091 908 A 83 PHE HZ A 104 PRO HBy 1.0 . 4.91 1092 909 A 41 LYS HBx A 41 LYS HEx 1.0 . 3.64 1093 909 A 41 LYS HBy A 41 LYS HEx 1.0 . 3.64 1094 909 A 41 LYS HEy A 41 LYS HBx 1.0 . 3.64 1095 909 A 41 LYS HBy A 41 LYS HEy 1.0 . 3.64 1096 910 A 44 TYR HA A 45 GLU HBx 1.0 . 4.13 1097 910 A 44 TYR HA A 45 GLU HBy 1.0 . 4.13 1098 911 A 75 LYS HBx A 75 LYS HEx 1.0 . 4.26 1099 911 A 75 LYS HEy A 75 LYS HBx 1.0 . 4.26 1100 911 A 75 LYS HBy A 75 LYS HEy 1.0 . 4.26 1101 911 A 75 LYS HBy A 75 LYS HEx 1.0 . 4.26 1102 912 A 58 LYS HBy A 58 LYS HDx 1.0 . 2.64 1103 912 A 58 LYS HBx A 58 LYS HDx 1.0 . 2.64 1104 912 A 58 LYS HDy A 58 LYS HBx 1.0 . 2.64 1105 912 A 58 LYS HBy A 58 LYS HDy 1.0 . 2.64 1106 913 A 99 ASP HA A 94 LYS HBy 1.0 . 4.17 1107 914 A 99 ASP HA A 94 LYS HBx 1.0 . 5.50 1108 915 A 94 LYS HBx A 94 LYS HEy 1.0 . 4.21 1109 916 A 94 LYS HBx A 97 GLY HAx 1.0 . 4.64 1110 917 A 54 PHE HD% A 59 GLU HBx 1.0 . 4.35 1111 917 A 59 GLU HBy A 54 PHE HD% 1.0 . 4.35 1112 918 A 45 GLU HBy A 46 LEU HDy% 1.0 . 4.68 1113 918 A 45 GLU HBx A 46 LEU HDy% 1.0 . 4.68 1114 919 A 26 ARG HBy A 26 ARG HDx 1.0 . 3.59 1115 919 A 26 ARG HBy A 26 ARG HDy 1.0 . 3.59 1116 920 A 26 ARG HBx A 26 ARG HDx 1.0 . 3.94 1117 920 A 26 ARG HDy A 26 ARG HBx 1.0 . 3.94 1118 921 A 83 PHE HD% A 80 ILE HG1x 1.0 . 4.85 1119 922 A 80 ILE HG1x A 80 ILE HA 1.0 . 3.26 1120 923 A 17 ARG HBx A 17 ARG HDx 1.0 . 3.54 1121 923 A 17 ARG HDy A 17 ARG HBx 1.0 . 3.54 1122 923 A 17 ARG HDy A 17 ARG HBy 1.0 . 3.54 1123 923 A 17 ARG HBy A 17 ARG HDx 1.0 . 3.54 1124 924 A 17 ARG HBy A 22 VAL HG2% 1.0 . 4.69 1125 924 A 17 ARG HBx A 22 VAL HG2% 1.0 . 4.69 1126 925 A 17 ARG HBx A 17 ARG HGx 1.0 . 2.53 1127 925 A 17 ARG HBy A 17 ARG HGx 1.0 . 2.53 1128 925 A 17 ARG HGy A 17 ARG HBx 1.0 . 2.53 1129 925 A 17 ARG HGy A 17 ARG HBy 1.0 . 2.53 1130 926 A 77 TRP HBy A 71 LYS HBy 1.0 . 4.57 1131 927 A 71 LYS HBx A 71 LYS HEy 1.0 . 4.64 1132 928 A 91 LYS HBy A 102 TYR HD% 1.0 . 4.59 1133 929 A 77 TRP HBx A 74 PRO HBy 1.0 . 4.60 1134 930 A 77 TRP HBx A 70 LEU HDy% 1.0 . 4.41 1135 931 A 111 ILE HG1x A 82 PRO HBx 1.0 . 4.89 1136 931 A 111 ILE HG1x A 82 PRO HBy 1.0 . 4.89 1137 932 A 56 THR HG2% A 59 GLU HBx 1.0 . 5.08 1138 932 A 56 THR HG2% A 59 GLU HBy 1.0 . 5.08 1139 933 A 52 THR HG2% A 130 ARG HBx 1.0 . 4.90 1140 933 A 52 THR HG2% A 130 ARG HBy 1.0 . 4.90 1141 934 A 16 PRO HDy A 17 ARG HGx 1.0 . 5.06 1142 934 A 16 PRO HDx A 17 ARG HGx 1.0 . 5.06 1143 934 A 17 ARG HGy A 16 PRO HDx 1.0 . 5.06 1144 934 A 16 PRO HDy A 17 ARG HGy 1.0 . 5.06 1145 935 A 17 ARG HGx A 22 VAL HG2% 1.0 . 4.88 1146 935 A 17 ARG HGy A 22 VAL HG2% 1.0 . 4.88 1147 936 A 72 HIS HBy A 73 VAL HGy% 1.0 . 5.00 1148 937 A 117 ARG HBx A 117 ARG HDx 1.0 . 4.06 1149 937 A 117 ARG HBx A 117 ARG HDy 1.0 . 4.06 1150 938 A 28 TYR HE% A 57 GLU HBx 1.0 . 4.21 1151 939 A 57 GLU HBy A 57 GLU HGx 1.0 . 2.85 1152 940 A 24 ARG HBx A 24 ARG HDx 1.0 . 4.10 1153 940 A 24 ARG HBy A 24 ARG HDx 1.0 . 4.10 1154 940 A 24 ARG HDy A 24 ARG HBx 1.0 . 4.10 1155 940 A 24 ARG HBy A 24 ARG HDy 1.0 . 4.10 1156 941 A 117 ARG HBx A 116 CYS HA 1.0 . 4.45 1157 942 A 117 ARG HBx A 118 ILE HD1% 1.0 . 5.02 1158 943 A 89 LYS HDx A 64 LEU HDx% 1.0 . 5.20 1159 944 A 89 LYS HDx A 89 LYS HA 1.0 . 4.64 1160 945 A 110 ARG HBx A 107 GLU HA 1.0 . 4.36 1161 946 A 106 TYR HD% A 107 GLU HBy 1.0 . 4.86 1162 947 A 128 PHE HBy A 127 LYS HDx 1.0 . 4.38 1163 947 A 128 PHE HBy A 127 LYS HDy 1.0 . 4.38 1164 948 A 128 PHE HA A 127 LYS HDx 1.0 . 4.59 1165 948 A 127 LYS HDy A 128 PHE HA 1.0 . 4.59 1166 949 A 99 ASP HA A 94 LYS HDx 1.0 . 4.59 1167 949 A 99 ASP HA A 94 LYS HDy 1.0 . 4.59 1168 950 A 72 HIS HA A 71 LYS HDx 1.0 . 4.59 1169 950 A 72 HIS HA A 71 LYS HDy 1.0 . 4.59 1170 951 A 91 LYS HA A 91 LYS HDy 1.0 . 5.50 1171 952 A 112 THR HA A 115 PRO HGx 1.0 . 3.91 1172 953 A 82 PRO HGx A 111 ILE HD1% 1.0 . 4.37 1173 954 A 58 LYS HA A 58 LYS HDx 1.0 . 4.25 1174 954 A 58 LYS HDy A 58 LYS HA 1.0 . 4.25 1175 955 A 56 THR HG2% A 58 LYS HDx 1.0 . 3.97 1176 955 A 56 THR HG2% A 58 LYS HDy 1.0 . 3.97 1177 956 A 94 LYS HA A 94 LYS HDx 1.0 . 4.42 1178 956 A 94 LYS HA A 94 LYS HDy 1.0 . 4.42 1179 957 A 102 TYR HE% A 91 LYS HDx 1.0 . 4.95 1180 958 A 91 LYS HA A 91 LYS HDx 1.0 . 4.45 1181 959 A 83 PHE HZ A 104 PRO HGy 1.0 . 5.17 1182 960 A 118 ILE HA A 118 ILE HG1y 1.0 . 3.56 1183 961 A 28 TYR HA A 29 PRO HG2 1.0 . 4.86 1184 962 A 28 TYR HB2 A 29 PRO HG3 1.0 . 4.70 1185 963 A 29 PRO HG3 A 46 LEU HDy% 1.0 . 4.35 1186 964 A 136 PHE HA A 137 PRO HGy 1.0 . 4.68 1187 965 A 15 VAL HA A 16 PRO HGx 1.0 . 4.60 1188 965 A 16 PRO HGy A 15 VAL HA 1.0 . 4.60 1189 966 A 15 VAL HGy% A 16 PRO HGx 1.0 . 4.70 1190 966 A 16 PRO HGy A 15 VAL HGy% 1.0 . 4.70 1191 967 A 52 THR HG2% A 130 ARG HGx 1.0 . 5.04 1192 967 A 52 THR HG2% A 130 ARG HGy 1.0 . 5.04 1193 968 A 127 LYS HA A 130 ARG HGx 1.0 . 4.39 1194 968 A 127 LYS HA A 130 ARG HGy 1.0 . 4.39 1195 969 A 119 LEU HA A 119 LEU HG 1.0 . 4.04 1196 970 A 95 ILE HA A 95 ILE HG1y 1.0 . 3.65 1197 971 A 49 LEU HG A 57 GLU HA 1.0 . 4.48 1198 972 A 54 PHE HE% A 60 LEU HG 1.0 . 3.81 1199 973 A 60 LEU HA A 60 LEU HG 1.0 . 3.64 1200 974 A 135 LEU HG A 135 LEU HA 1.0 . 3.87 1201 975 A 111 ILE HG2% A 111 ILE HG1x 1.0 . 3.36 1202 976 A 38 PHE HZ A 84 LEU HDx% 1.0 . 4.61 1203 977 A 38 PHE HE% A 84 LEU HDx% 1.0 . 3.84 1204 978 A 84 LEU HA A 84 LEU HDx% 1.0 . 4.79 1205 979 A 84 LEU HBy A 84 LEU HDx% 1.0 . 4.00 1206 980 A 84 LEU HDx% A 88 PHE HBy 1.0 . 4.52 1207 981 A 44 TYR HE% A 43 PRO HGy 1.0 . 4.96 1208 982 A 44 TYR HD% A 43 PRO HGx 1.0 . 5.01 1209 983 A 28 TYR HD% A 26 ARG HGx 1.0 . 5.04 1210 983 A 28 TYR HD% A 26 ARG HGy 1.0 . 5.04 1211 984 A 81 GLN HE2y A 81 GLN HBx 1.0 . 4.60 1212 984 A 81 GLN HE2y A 81 GLN HBy 1.0 . 4.60 1213 985 A 135 LEU HG A 132 ASN HBy 1.0 . 4.57 1214 986 A 111 ILE HG1x A 82 PRO HDy 1.0 . 4.96 1215 987 A 51 LEU HG A 103 LEU HA 1.0 . 4.50 1216 988 A 38 PHE HE% A 81 GLN HBx 1.0 . 4.97 1217 988 A 81 GLN HBy A 38 PHE HE% 1.0 . 4.97 1218 989 A 82 PRO HDx A 81 GLN HBx 1.0 . 4.50 1219 989 A 81 GLN HBy A 82 PRO HDx 1.0 . 4.50 1220 990 A 107 GLU HA A 110 ARG HGx 1.0 . 4.34 1221 990 A 110 ARG HGy A 107 GLU HA 1.0 . 4.34 1222 991 A 107 GLU HGy A 110 ARG HGx 1.0 . 4.19 1223 991 A 107 GLU HGx A 110 ARG HGx 1.0 . 4.19 1224 991 A 110 ARG HGy A 107 GLU HGx 1.0 . 4.19 1225 991 A 110 ARG HGy A 107 GLU HGy 1.0 . 4.19 1226 992 A 67 TYR HA A 70 LEU HDx% 1.0 . 4.19 1227 993 A 67 TYR HD% A 70 LEU HDx% 1.0 . 3.92 1228 994 A 70 LEU HBy A 70 LEU HDx% 1.0 . 4.12 1229 995 A 57 GLU HA A 60 LEU HDx% 1.0 . 4.22 1230 995 A 57 GLU HA A 60 LEU HDy% 1.0 . 4.22 1231 996 A 128 PHE HZ A 129 LEU HDy% 1.0 . 4.34 1232 996 A 129 LEU HDx% A 128 PHE HZ 1.0 . 4.34 1233 997 A 93 GLU HA A 46 LEU HDx% 1.0 . 3.37 1234 998 A 27 CYS HBy A 46 LEU HDx% 1.0 . 3.98 1235 999 A 27 CYS HBx A 46 LEU HDx% 1.0 . 4.26 1236 1000 A 27 CYS HA A 46 LEU HDx% 1.0 . 4.56 1237 1001 A 46 LEU HBy A 46 LEU HDx% 1.0 . 3.64 1238 1002 A 46 LEU HBx A 46 LEU HDx% 1.0 . 3.39 1239 1003 A 42 LEU HDx% A 44 TYR HD% 1.0 . 4.77 1240 1004 A 42 LEU HDx% A 44 TYR HE% 1.0 . 4.43 1241 1005 A 42 LEU HDx% A 42 LEU HBx 1.0 . 4.22 1242 1006 A 64 LEU HDx% A 88 PHE HBy 1.0 . 4.57 1243 1007 A 88 PHE HD% A 64 LEU HDx% 1.0 . 4.92 1244 1008 A 61 ASN HA A 64 LEU HDx% 1.0 . 3.91 1245 1009 A 64 LEU HDx% A 88 PHE HBx 1.0 . 3.44 1246 1010 A 64 LEU HBx A 64 LEU HDx% 1.0 . 3.51 1247 1011 A 88 PHE HZ A 64 LEU HDx% 1.0 . 4.54 1248 1012 A 89 LYS HA A 89 LYS HGx 1.0 . 3.97 1249 1012 A 89 LYS HGy A 89 LYS HA 1.0 . 3.97 1250 1013 A 54 PHE HE% A 60 LEU HDx% 1.0 . 3.55 1251 1013 A 60 LEU HDy% A 54 PHE HE% 1.0 . 3.55 1252 1014 A 61 ASN HA A 60 LEU HDx% 1.0 . 3.61 1253 1014 A 60 LEU HDy% A 61 ASN HA 1.0 . 3.61 1254 1015 A 60 LEU HA A 60 LEU HDx% 1.0 . 3.70 1255 1015 A 60 LEU HDy% A 60 LEU HA 1.0 . 3.70 1256 1016 A 60 LEU HDy% A 88 PHE HBx 1.0 . 3.82 1257 1016 A 60 LEU HDx% A 88 PHE HBx 1.0 . 3.82 1258 1017 A 54 PHE HD% A 60 LEU HDx% 1.0 . 4.67 1259 1017 A 60 LEU HDy% A 54 PHE HD% 1.0 . 4.67 1260 1018 A 103 LEU HDx% A 22 VAL HA 1.0 . 4.45 1261 1019 A 103 LEU HDx% A 103 LEU HBx 1.0 . 2.84 1262 1019 A 103 LEU HDx% A 103 LEU HBy 1.0 . 2.84 1263 1020 A 135 LEU HDx% A 135 LEU HA 1.0 . 4.55 1264 1021 A 135 LEU HDx% A 132 ASN HBx 1.0 . 4.29 1265 1022 A 103 LEU HDy% A 103 LEU HBx 1.0 . 2.77 1266 1022 A 103 LEU HBy A 103 LEU HDy% 1.0 . 2.77 1267 1023 A 42 LEU HDx% A 37 CYS HBx 1.0 . 4.06 1268 1024 A 42 LEU HDx% A 89 LYS HBy 1.0 . 3.87 1269 1024 A 42 LEU HDx% A 89 LYS HBx 1.0 . 3.87 1270 1025 A 54 PHE HE% A 49 LEU HDx% 1.0 . 5.30 1271 1026 A 57 GLU HA A 49 LEU HDx% 1.0 . 4.60 1272 1027 A 56 THR HA A 49 LEU HDx% 1.0 . 3.53 1273 1028 A 49 LEU HBy A 49 LEU HDx% 1.0 . 2.80 1274 1028 A 49 LEU HDx% A 49 LEU HBx 1.0 . 2.80 1275 1029 A 28 TYR HE% A 49 LEU HDx% 1.0 . 4.67 1276 1030 A 54 PHE HBy A 49 LEU HDx% 1.0 . 4.65 1277 1031 A 125 PHE HBx A 129 LEU HG 1.0 . 4.74 1278 1032 A 58 LYS HA A 58 LYS HGy 1.0 . 4.02 1279 1033 A 58 LYS HGy A 58 LYS HDx 1.0 . 3.01 1280 1033 A 58 LYS HDy A 58 LYS HGy 1.0 . 3.01 1281 1034 A 58 LYS HGy A 58 LYS HEx 1.0 . 3.29 1282 1034 A 58 LYS HEy A 58 LYS HGy 1.0 . 3.29 1283 1035 A 59 GLU HA A 58 LYS HGx 1.0 . 4.29 1284 1036 A 58 LYS HGx A 58 LYS HEx 1.0 . 3.29 1285 1036 A 58 LYS HEy A 58 LYS HGx 1.0 . 3.29 1286 1037 A 40 SER HA A 41 LYS HGx 1.0 . 4.22 1287 1037 A 40 SER HA A 41 LYS HGy 1.0 . 4.22 1288 1038 A 58 LYS HGx A 59 GLU HGy 1.0 . 4.60 1289 1039 A 41 LYS HA A 41 LYS HGx 1.0 . 3.46 1290 1039 A 41 LYS HA A 41 LYS HGy 1.0 . 3.46 1291 1040 A 41 LYS HBy A 41 LYS HGx 1.0 . 2.73 1292 1040 A 41 LYS HBx A 41 LYS HGx 1.0 . 2.73 1293 1040 A 41 LYS HGy A 41 LYS HBx 1.0 . 2.73 1294 1040 A 41 LYS HBy A 41 LYS HGy 1.0 . 2.73 1295 1041 A 94 LYS HEy A 94 LYS HGy 1.0 . 4.14 1296 1042 A 94 LYS HGx A 94 LYS HA 1.0 . 3.88 1297 1043 A 102 TYR HD% A 103 LEU HDx% 1.0 . 4.65 1298 1044 A 103 LEU HDx% A 21 MET HA 1.0 . 3.91 1299 1045 A 103 LEU HDx% A 102 TYR HA 1.0 . 4.41 1300 1046 A 103 LEU HDy% A 20 HIS HBy 1.0 . 4.36 1301 1047 A 101 VAL HA A 101 VAL HGx% 1.0 . 3.48 1302 1048 A 101 VAL HGx% A 48 SER HBx 1.0 . 4.31 1303 1048 A 48 SER HBy A 101 VAL HGx% 1.0 . 4.31 1304 1049 A 103 LEU HDx% A 21 MET HGy 1.0 . 4.57 1305 1050 A 128 PHE HZ A 70 LEU HDy% 1.0 . 4.54 1306 1051 A 128 PHE HE% A 70 LEU HDy% 1.0 . 4.56 1307 1052 A 70 LEU HBy A 70 LEU HDy% 1.0 . 4.16 1308 1053 A 14 LEU HBy A 14 LEU HDx% 1.0 . 3.11 1309 1053 A 14 LEU HBy A 14 LEU HDy% 1.0 . 3.11 1310 1054 A 54 PHE HD% A 49 LEU HDy% 1.0 . 5.21 1311 1055 A 28 TYR HD% A 49 LEU HDy% 1.0 . 4.62 1312 1056 A 49 LEU HA A 49 LEU HDy% 1.0 . 3.34 1313 1057 A 54 PHE HBx A 49 LEU HDy% 1.0 . 4.62 1314 1058 A 49 LEU HBx A 49 LEU HDy% 1.0 . 3.14 1315 1058 A 49 LEU HBy A 49 LEU HDy% 1.0 . 3.14 1316 1059 A 83 PHE HZ A 87 VAL HGy% 1.0 . 4.17 1317 1060 A 87 VAL HA A 87 VAL HGy% 1.0 . 3.37 1318 1061 A 130 ARG HBy A 87 VAL HGy% 1.0 . 4.30 1319 1061 A 87 VAL HGy% A 130 ARG HBx 1.0 . 4.30 1320 1062 A 100 MET HA A 25 ALA HB% 1.0 . 3.95 1321 1063 A 25 ALA HB% A 101 VAL HGy% 1.0 . 3.21 1322 1064 A 25 ALA HB% A 50 ASP HBy 1.0 . 3.72 1323 1065 A 14 LEU HDy% A 23 ARG HDx 1.0 . 4.70 1324 1065 A 14 LEU HDx% A 23 ARG HDx 1.0 . 4.70 1325 1065 A 23 ARG HDy A 14 LEU HDx% 1.0 . 4.70 1326 1065 A 23 ARG HDy A 14 LEU HDy% 1.0 . 4.70 1327 1066 A 135 LEU HA A 135 LEU HDy% 1.0 . 4.23 1328 1067 A 27 CYS HBx A 46 LEU HDy% 1.0 . 4.97 1329 1068 A 46 LEU HA A 46 LEU HDy% 1.0 . 3.09 1330 1069 A 29 PRO HA A 46 LEU HDy% 1.0 . 2.97 1331 1070 A 29 PRO HBx A 46 LEU HDy% 1.0 . 3.87 1332 1071 A 83 PHE HD% A 87 VAL HGy% 1.0 . 4.31 1333 1072 A 71 LYS HA A 71 LYS HGy 1.0 . 4.24 1334 1073 A 25 ALA HB% A 50 ASP HBx 1.0 . 3.61 1335 1074 A 73 VAL HGx% A 74 PRO HA 1.0 . 4.74 1336 1075 A 73 VAL HGx% A 76 CYS HBy 1.0 . 3.53 1337 1076 A 124 PHE HD% A 119 LEU HDy% 1.0 . 4.69 1338 1077 A 119 LEU HA A 119 LEU HDy% 1.0 . 3.28 1339 1078 A 135 LEU HDy% A 132 ASN HA 1.0 . 4.62 1340 1079 A 64 LEU HDy% A 84 LEU HDy% 1.0 . 4.66 1341 1080 A 38 PHE HZ A 84 LEU HDy% 1.0 . 3.69 1342 1081 A 38 PHE HE% A 84 LEU HDy% 1.0 . 4.60 1343 1082 A 80 ILE HA A 84 LEU HDy% 1.0 . 4.94 1344 1083 A 84 LEU HA A 84 LEU HDy% 1.0 . 3.17 1345 1084 A 67 TYR HD% A 64 LEU HDy% 1.0 . 3.78 1346 1085 A 88 PHE HE% A 64 LEU HDy% 1.0 . 4.83 1347 1086 A 61 ASN HA A 64 LEU HDy% 1.0 . 4.76 1348 1087 A 64 LEU HA A 64 LEU HDy% 1.0 . 4.28 1349 1088 A 89 LYS HEx A 64 LEU HDy% 1.0 . 4.28 1350 1089 A 84 LEU HDx% A 64 LEU HDy% 1.0 . 4.13 1351 1090 A 83 PHE HD% A 112 THR HG2% 1.0 . 3.89 1352 1091 A 112 THR HG2% A 83 PHE HBy 1.0 . 3.85 1353 1092 A 73 VAL HGx% A 76 CYS HBx 1.0 . 3.42 1354 1093 A 44 TYR HD% A 42 LEU HDy% 1.0 . 4.98 1355 1094 A 42 LEU HA A 42 LEU HDy% 1.0 . 3.42 1356 1095 A 37 CYS HBy A 42 LEU HDy% 1.0 . 3.72 1357 1096 A 44 TYR HE% A 42 LEU HDy% 1.0 . 3.94 1358 1097 A 42 LEU HDy% A 43 PRO HDy 1.0 . 5.46 1359 1098 A 56 THR HG2% A 54 PHE HBx 1.0 . 4.87 1360 1099 A 56 THR HG2% A 55 HIS HBy 1.0 . 3.85 1361 1100 A 56 THR HG2% A 55 HIS HBx 1.0 . 3.84 1362 1101 A 106 TYR HBx A 138 THR HG2% 1.0 . 3.89 1363 1102 A 134 THR HG2% A 133 GLU HBx 1.0 . 4.05 1364 1102 A 133 GLU HBy A 134 THR HG2% 1.0 . 4.05 1365 1103 A 103 LEU HA A 51 LEU HDx% 1.0 . 4.42 1366 1103 A 51 LEU HDy% A 103 LEU HA 1.0 . 4.42 1367 1104 A 51 LEU HA A 51 LEU HDx% 1.0 . 3.17 1368 1104 A 51 LEU HDy% A 51 LEU HA 1.0 . 3.17 1369 1105 A 51 LEU HBy A 51 LEU HDx% 1.0 . 3.71 1370 1105 A 51 LEU HDy% A 51 LEU HBy 1.0 . 3.71 1371 1106 A 51 LEU HBx A 51 LEU HDx% 1.0 . 3.43 1372 1106 A 51 LEU HBx A 51 LEU HDy% 1.0 . 3.43 1373 1107 A 37 CYS HBx A 42 LEU HDy% 1.0 . 4.09 1374 1108 A 83 PHE HE% A 87 VAL HGx% 1.0 . 4.17 1375 1109 A 87 VAL HA A 87 VAL HGx% 1.0 . 3.79 1376 1110 A 122 THR HG2% A 123 THR HA 1.0 . 4.45 1377 1111 A 122 THR HG2% A 122 THR HA 1.0 . 3.32 1378 1112 A 122 THR HG2% A 124 PHE HBx 1.0 . 4.19 1379 1112 A 124 PHE HBy A 122 THR HG2% 1.0 . 4.19 1380 1113 A 138 THR HG2% A 106 TYR HA 1.0 . 4.92 1381 1114 A 121 ASN HBy A 134 THR HG2% 1.0 . 4.51 1382 1115 A 34 THR HG2% A 41 LYS HEx 1.0 . 4.11 1383 1115 A 34 THR HG2% A 41 LYS HEy 1.0 . 4.11 1384 1116 A 28 TYR HD% A 30 THR HG2% 1.0 . 4.42 1385 1117 A 30 THR HG2% A 30 THR HA 1.0 . 3.15 1386 1118 A 36 THR HA A 36 THR HG2% 1.0 . 3.08 1387 1119 A 36 THR HG2% A 39 GLY HAy 1.0 . 3.76 1388 1120 A 100 MET HA A 101 VAL HGy% 1.0 . 4.43 1389 1121 A 51 LEU HA A 101 VAL HGy% 1.0 . 4.07 1390 1122 A 36 THR HG2% A 41 LYS HBx 1.0 . 3.78 1391 1122 A 41 LYS HBy A 36 THR HG2% 1.0 . 3.78 1392 1123 A 41 LYS HA A 36 THR HG2% 1.0 . 2.86 1393 1124 A 73 VAL HGy% A 74 PRO HDy 1.0 . 4.50 1394 1125 A 15 VAL HA A 15 VAL HGx% 1.0 . 3.11 1395 1126 A 15 VAL HGx% A 22 VAL HG1% 1.0 . 3.86 1396 1127 A 15 VAL HGx% A 16 PRO HDx 1.0 . 4.05 1397 1127 A 16 PRO HDy A 15 VAL HGx% 1.0 . 4.05 1398 1128 A 101 VAL HA A 101 VAL HGy% 1.0 . 4.21 1399 1129 A 52 THR HG2% A 51 LEU HBy 1.0 . 4.74 1400 1130 A 52 THR HG2% A 88 PHE HA 1.0 . 3.52 1401 1131 A 52 THR HG2% A 60 LEU HG 1.0 . 3.54 1402 1132 A 52 THR HG2% A 51 LEU HDx% 1.0 . 4.11 1403 1132 A 52 THR HG2% A 51 LEU HDy% 1.0 . 4.11 1404 1133 A 17 ARG HDx A 22 VAL HG2% 1.0 . 4.90 1405 1133 A 17 ARG HDy A 22 VAL HG2% 1.0 . 4.90 1406 1134 A 102 TYR HD% A 22 VAL HG2% 1.0 . 4.64 1407 1135 A 21 MET HA A 22 VAL HG2% 1.0 . 4.83 1408 1136 A 79 ALA HB% A 111 ILE HG2% 1.0 . 3.89 1409 1137 A 73 VAL HGy% A 73 VAL HA 1.0 . 3.61 1410 1138 A 73 VAL HGy% A 74 PRO HDx 1.0 . 4.70 1411 1139 A 73 VAL HGy% A 72 HIS HBx 1.0 . 3.99 1412 1140 A 15 VAL HA A 15 VAL HGy% 1.0 . 3.63 1413 1141 A 15 VAL HGy% A 22 VAL HG1% 1.0 . 4.43 1414 1142 A 22 VAL HB A 15 VAL HGy% 1.0 . 4.33 1415 1143 A 52 THR HG2% A 54 PHE HD% 1.0 . 3.96 1416 1144 A 52 THR HG2% A 60 LEU HDx% 1.0 . 4.71 1417 1144 A 52 THR HG2% A 60 LEU HDy% 1.0 . 4.71 1418 1145 A 52 THR HG2% A 49 LEU HA 1.0 . 4.69 1419 1146 A 22 VAL HA A 22 VAL HG2% 1.0 . 3.39 1420 1147 A 102 TYR HA A 22 VAL HG2% 1.0 . 3.35 1421 1148 A 100 MET HBx A 22 VAL HG2% 1.0 . 4.39 1422 1149 A 22 VAL HG2% A 101 VAL HGy% 1.0 . 4.85 1423 1150 A 33 ALA HB% A 32 ASN HBx 1.0 . 3.98 1424 1150 A 32 ASN HBy A 33 ALA HB% 1.0 . 3.98 1425 1151 A 33 ALA HB% A 34 THR HG2% 1.0 . 3.62 1426 1152 A 83 PHE HA A 86 ALA HB% 1.0 . 3.38 1427 1153 A 22 VAL HA A 100 MET HE% 1.0 . 4.72 1428 1154 A 100 MET HE% A 24 ARG HDx 1.0 . 4.25 1429 1154 A 100 MET HE% A 24 ARG HDy 1.0 . 4.25 1430 1155 A 100 MET HGy A 100 MET HE% 1.0 . 3.50 1431 1156 A 15 VAL HB A 100 MET HE% 1.0 . 3.21 1432 1157 A 95 ILE HB A 100 MET HE% 1.0 . 2.72 1433 1158 A 100 MET HBx A 100 MET HE% 1.0 . 3.17 1434 1159 A 100 MET HE% A 15 VAL HGy% 1.0 . 3.21 1435 1160 A 100 MET HE% A 22 VAL HG1% 1.0 . 3.00 1436 1161 A 100 MET HE% A 22 VAL HG2% 1.0 . 4.18 1437 1162 A 69 ALA HB% A 68 TYR HBx 1.0 . 4.40 1438 1162 A 68 TYR HBy A 69 ALA HB% 1.0 . 4.40 1439 1163 A 86 ALA HB% A 108 MET HGy 1.0 . 4.91 1440 1163 A 86 ALA HB% A 108 MET HGx 1.0 . 4.91 1441 1164 A 86 ALA HB% A 83 PHE HE% 1.0 . 3.27 1442 1165 A 78 ALA HB% A 77 TRP HBx 1.0 . 4.91 1443 1166 A 78 ALA HB% A 81 GLN HBx 1.0 . 3.67 1444 1166 A 81 GLN HBy A 78 ALA HB% 1.0 . 3.67 1445 1167 A 102 TYR HD% A 22 VAL HG1% 1.0 . 4.86 1446 1168 A 22 VAL HA A 22 VAL HG1% 1.0 . 3.73 1447 1169 A 22 VAL HG1% A 17 ARG HDx 1.0 . 4.85 1448 1169 A 17 ARG HDy A 22 VAL HG1% 1.0 . 4.85 1449 1170 A 100 MET HE% A 95 ILE HA 1.0 . 4.83 1450 1171 A 80 ILE HG2% A 88 PHE HE% 1.0 . 4.76 1451 1172 A 80 ILE HG2% A 77 TRP HA 1.0 . 3.25 1452 1173 A 80 ILE HG2% A 80 ILE HA 1.0 . 3.93 1453 1174 A 80 ILE HG2% A 78 ALA HA 1.0 . 4.43 1454 1175 A 80 ILE HG2% A 81 GLN HA 1.0 . 4.33 1455 1176 A 80 ILE HG2% A 84 LEU HDy% 1.0 . 5.04 1456 1177 A 111 ILE HG2% A 111 ILE HA 1.0 . 2.93 1457 1178 A 80 ILE HG2% A 77 TRP HZ3 1.0 . 4.75 1458 1179 A 118 ILE HG2% A 118 ILE HA 1.0 . 3.37 1459 1180 A 120 TYR HD% A 118 ILE HG2% 1.0 . 5.08 1460 1181 A 111 ILE HG2% A 80 ILE HA 1.0 . 4.88 1461 1182 A 83 PHE HD% A 108 MET HE% 1.0 . 3.64 1462 1183 A 83 PHE HA A 108 MET HE% 1.0 . 3.19 1463 1184 A 108 MET HE% A 86 ALA HA 1.0 . 3.96 1464 1185 A 85 CYS HBy A 108 MET HE% 1.0 . 4.63 1465 1186 A 108 MET HE% A 108 MET HGy 1.0 . 3.06 1466 1186 A 108 MET HE% A 108 MET HGx 1.0 . 3.06 1467 1187 A 108 MET HE% A 86 ALA HB% 1.0 . 3.06 1468 1188 A 113 MET HE% A 110 ARG HDx 1.0 . 4.64 1469 1188 A 113 MET HE% A 110 ARG HDy 1.0 . 4.64 1470 1189 A 19 SER HA A 21 MET HE% 1.0 . 4.04 1471 1190 A 21 MET HE% A 19 SER HBx 1.0 . 4.40 1472 1190 A 19 SER HBy A 21 MET HE% 1.0 . 4.40 1473 1191 A 21 MET HE% A 21 MET HGy 1.0 . 3.31 1474 1192 A 124 PHE HD% A 118 ILE HG2% 1.0 . 5.13 1475 1193 A 95 ILE HG2% A 95 ILE HA 1.0 . 3.23 1476 1194 A 113 MET HE% A 110 ARG HA 1.0 . 4.53 1477 1195 A 113 MET HE% A 113 MET HGx 1.0 . 3.73 1478 1195 A 113 MET HE% A 113 MET HGy 1.0 . 3.73 1479 1196 A 113 MET HE% A 113 MET HBx 1.0 . 2.82 1480 1196 A 113 MET HE% A 113 MET HBy 1.0 . 2.82 1481 1197 A 113 MET HE% A 110 ARG HGx 1.0 . 3.66 1482 1197 A 113 MET HE% A 110 ARG HGy 1.0 . 3.66 1483 1198 A 100 MET HE% A 95 ILE HG2% 1.0 . 4.92 1484 1199 A 95 ILE HG2% A 96 ASN HBy 1.0 . 4.51 1485 1200 A 95 ILE HG2% A 96 ASN HA 1.0 . 4.48 1486 1201 A 83 PHE HBx A 80 ILE HD1% 1.0 . 4.73 1487 1202 A 80 ILE HD1% A 88 PHE HE% 1.0 . 3.36 1488 1203 A 83 PHE HD% A 80 ILE HD1% 1.0 . 4.24 1489 1204 A 80 ILE HG2% A 80 ILE HD1% 1.0 . 3.48 1490 1205 A 80 ILE HD1% A 84 LEU HDy% 1.0 . 4.34 1491 1206 A 118 ILE HD1% A 120 TYR HE% 1.0 . 4.72 1492 1207 A 118 ILE HD1% A 117 ARG HDx 1.0 . 4.77 1493 1207 A 118 ILE HD1% A 117 ARG HDy 1.0 . 4.77 1494 1208 A 118 ILE HD1% A 118 ILE HB 1.0 . 3.38 1495 1209 A 94 LYS HA A 95 ILE HD1% 1.0 . 4.72 1496 1210 A 95 ILE HD1% A 100 MET HGx 1.0 . 4.49 1497 1211 A 101 VAL HA A 95 ILE HD1% 1.0 . 5.05 1498 1212 A 95 ILE HD1% A 95 ILE HA 1.0 . 3.88 1499 1213 A 44 TYR HD% A 43 PRO HGy 1.0 . 3.92 1500 1214 A 44 TYR HD% A 43 PRO HBy 1.0 . 3.67 1501 1215 A 44 TYR HD% A 42 LEU HDy% 1.0 . 4.24 1502 1215 A 42 LEU HDx% A 44 TYR HD% 1.0 . 4.24 1503 1216 A 44 TYR HD% A 44 TYR HA 1.0 . 3.64 1504 1217 A 28 TYR HD% A 49 LEU HBx 1.0 . 3.72 1505 1217 A 28 TYR HD% A 49 LEU HBy 1.0 . 3.72 1506 1218 A 28 TYR HD% A 48 SER HA 1.0 . 3.48 1507 1219 A 68 TYR HD% A 71 LYS HDx 1.0 . 3.89 1508 1219 A 68 TYR HD% A 71 LYS HDy 1.0 . 3.89 1509 1220 A 106 TYR HD% A 138 THR HG2% 1.0 . 3.83 1510 1221 A 68 TYR HD% A 68 TYR HA 1.0 . 3.32 1511 1222 A 106 TYR HD% A 106 TYR HA 1.0 . 3.83 1512 1223 A 52 THR HG2% A 54 PHE HE% 1.0 . 3.67 1513 1224 A 125 PHE HBy A 128 PHE HD% 1.0 . 3.76 1514 1225 A 125 PHE HBy A 128 PHE HE% 1.0 . 3.92 1515 1226 A 83 PHE HD% A 83 PHE HA 1.0 . 3.37 1516 1227 A 124 PHE HD% A 124 PHE HA 1.0 . 3.84 1517 1228 A 128 PHE HZ A 129 LEU HDy% 1.0 . 3.92 1518 1229 A 124 PHE HD% A 119 LEU HDx% 1.0 . 3.91 1519 1230 A 54 PHE HD% A 60 LEU HG 1.0 . 3.95 1520 1231 A 84 LEU HBy A 38 PHE HE% 1.0 . 3.92 1521 1232 A 88 PHE HZ A 64 LEU HDy% 1.0 . 3.85 1522 1233 A 77 TRP HBy A 77 TRP HD1 1.0 . 3.60 1523 1234 A 77 TRP HBx A 77 TRP HD1 1.0 . 3.58 1524 1235 A 77 TRP HD1 A 74 PRO HA 1.0 . 3.96 1525 1236 A 67 TYR HE% A 64 LEU HDy% 1.0 . 3.90 1526 1237 A 67 TYR HE% A 70 LEU HDy% 1.0 . 3.80 1527 1238 A 91 LYS HBx A 44 TYR HE% 1.0 . 3.75 1528 1239 A 91 LYS HA A 44 TYR HE% 1.0 . 3.39 1529 1240 A 64 LEU HA A 67 TYR HE% 1.0 . 3.86 1530 1241 A 105 SER HB3 A 106 TYR HE% 1.0 . 3.92 1531 1242 A 44 TYR HE% A 42 LEU HDy% 1.0 . 3.43 1532 1242 A 42 LEU HDx% A 44 TYR HE% 1.0 . 3.43 1533 1243 A 102 TYR HE% A 22 VAL HG2% 1.0 . 3.56 1534 1244 A 28 TYR HE% A 49 LEU HDy% 1.0 . 3.40 1535 1245 A 28 TYR HE% A 49 LEU HBx 1.0 . 3.26 1536 1245 A 49 LEU HBy A 28 TYR HE% 1.0 . 3.26 1537 1246 A 30 THR HG2% A 28 TYR HE% 1.0 . 3.60 1538 1247 A 48 SER HA A 28 TYR HE% 1.0 . 3.72 1539 1248 A 95 ILE HD1% A 102 TYR HE% 1.0 . 3.83 1540 1249 A 42 LEU HDx% A 44 TYR HE% 1.0 . 3.54 1541 1250 A 83 PHE HZ A 87 VAL HGy% 1.0 . 4.26 1542 1251 A 88 PHE HD% A 87 VAL HGy% 1.0 . 4.44 1543 1252 A 83 PHE HD% A 87 VAL HGy% 1.0 . 3.37 1544 1253 A 44 TYR HE% A 42 LEU HDy% 1.0 . 3.54 1545 1254 A 83 PHE HD% A 112 THR HG2% 1.0 . 3.36 1546 1255 A 83 PHE HD% A 104 PRO HBx 1.0 . 4.10 1547 1256 A 128 PHE HD% A 70 LEU HDy% 1.0 . 3.77 1548 1257 A 128 PHE HZ A 70 LEU HDy% 1.0 . 3.67 1549 1258 A 128 PHE HE% A 70 LEU HDy% 1.0 . 3.58 1550 1259 A 64 LEU HG A 68 TYR HE% 1.0 . 4.45 1551 1260 A 54 PHE HD% A 60 LEU HDx% 1.0 . 3.88 1552 1260 A 60 LEU HDy% A 54 PHE HD% 1.0 . 3.88 1553 1261 A 54 PHE HE% A 60 LEU HDx% 1.0 . 3.03 1554 1261 A 60 LEU HDy% A 54 PHE HE% 1.0 . 3.03 1555 1262 A 102 TYR HE% A 93 GLU HBy 1.0 . 4.37 1556 1263 A 106 TYR HD% A 138 THR HG2% 1.0 . 3.84 1557 1264 A 38 PHE HD% A 81 GLN HGx 1.0 . 4.02 1558 1265 A 102 TYR HE% A 91 LYS HEx 1.0 . 4.03 1559 1266 A 38 PHE HD% A 81 GLN HA 1.0 . 4.05 1560 1267 A 80 ILE HG2% A 88 PHE HE% 1.0 . 4.43 1561 1268 A 80 ILE HG2% A 88 PHE HZ 1.0 . 4.99 1562 1269 A 80 ILE HG2% A 77 TRP HZ3 1.0 . 3.94 1563 1270 A 48 SER HA A 28 TYR HE% 1.0 . 3.77 1564 1271 A 28 TYR HD% A 48 SER HA 1.0 . 3.37 1565 1272 A 83 PHE HE% A 86 ALA HA 1.0 . 4.45 1566 1273 A 88 PHE HZ A 64 LEU HDy% 1.0 . 3.76 1567 1274 A 88 PHE HD% A 64 LEU HDy% 1.0 . 3.74 1568 1275 A 102 TYR HE% A 93 GLU HBx 1.0 . 4.37 1569 1276 A 118 ILE HD1% A 120 TYR HE% 1.0 . 4.27 1570 1277 A 102 TYR HE% A 91 LYS HGx 1.0 . 4.16 1571 1277 A 91 LYS HGy A 102 TYR HE% 1.0 . 4.16 1572 1278 A 83 PHE HZ A 87 VAL HGx% 1.0 . 4.64 1573 1279 A 88 PHE HD% A 87 VAL HGx% 1.0 . 3.88 1574 1280 A 83 PHE HD% A 87 VAL HGx% 1.0 . 4.27 1575 1281 A 128 PHE HD% A 70 LEU HDx% 1.0 . 3.77 1576 1282 A 128 PHE HZ A 70 LEU HDx% 1.0 . 3.67 1577 1283 A 128 PHE HE% A 70 LEU HDx% 1.0 . 3.58 1578 1284 A 88 PHE HZ A 64 LEU HDx% 1.0 . 4.16 1579 1285 A 88 PHE HD% A 64 LEU HDx% 1.0 . 3.74 1580 1286 A 102 TYR HE% A 93 GLU HGx 1.0 . 4.12 1581 1287 A 91 LYS HA A 44 TYR HE% 1.0 . 3.96 1582 1288 A 91 LYS HA A 44 TYR HD% 1.0 . 4.04 1583 1289 A 52 THR HG2% A 54 PHE HD% 1.0 . 3.32 1584 1290 A 52 THR HG2% A 54 PHE HZ 1.0 . 3.45 1585 1291 A 52 THR HG2% A 54 PHE HE% 1.0 . 3.42 1586 1292 A 102 TYR HE% A 93 GLU HGy 1.0 . 4.12 1587 1293 A 88 PHE HD% A 63 LYS HEx 1.0 . 3.67 1588 1293 A 88 PHE HD% A 63 LYS HEy 1.0 . 3.67 1589 1294 A 38 PHE HD% A 81 GLN HBx 1.0 . 4.18 1590 1294 A 38 PHE HD% A 81 GLN HBy 1.0 . 4.18 1591 1295 A 67 TYR HD% A 84 LEU HDy% 1.0 . 3.63 1592 1296 A 88 PHE HZ A 84 LEU HDy% 1.0 . 3.54 1593 1297 A 83 PHE HD% A 108 MET HGy 1.0 . 3.91 1594 1297 A 83 PHE HD% A 108 MET HGx 1.0 . 3.91 1595 1298 A 67 TYR HD% A 84 LEU HDx% 1.0 . 4.60 1596 1299 A 88 PHE HZ A 84 LEU HDx% 1.0 . 4.13 1597 1300 A 102 TYR HE% A 91 LYS HEy 1.0 . 4.03 1598 1301 A 54 PHE HD% A 60 LEU HG 1.0 . 3.53 1599 1302 A 54 PHE HE% A 60 LEU HG 1.0 . 3.40 1600 1303 A 28 TYR HE% A 30 THR HA 1.0 . 3.53 1601 1304 A 83 PHE HD% A 108 MET HE% 1.0 . 3.17 1602 1305 A 83 PHE HD% A 104 PRO HBy 1.0 . 4.10 1603 1306 A 54 PHE HD% A 52 THR HB 1.0 . 3.89 1604 1307 A 68 TYR HD% A 71 LYS HDx 1.0 . 4.05 1605 1307 A 68 TYR HD% A 71 LYS HDy 1.0 . 4.05 1606 1308 A 84 LEU HA A 88 PHE HD% 1.0 . 4.79 1607 1309 A 80 ILE HD1% A 88 PHE HZ 1.0 . 3.56 1608 1310 A 54 PHE HD% A 60 LEU HA 1.0 . 4.19 1609 1311 A 60 LEU HA A 54 PHE HE% 1.0 . 4.17 1610 1312 A 38 PHE HD% A 81 GLN HGy 1.0 . 4.02 1611 1313 A 131 CYS HA A 83 PHE HZ 1.0 . 3.37 1612 1314 A 30 THR HG2% A 28 TYR HE% 1.0 . 3.28 1613 1315 A 28 TYR HD% A 30 THR HG2% 1.0 . 4.10 1614 1316 A 102 TYR HD% A 22 VAL HG2% 1.0 . 3.69 1615 1316 A 102 TYR HD% A 22 VAL HG1% 1.0 . 3.69 1616 1317 A 102 TYR HE% A 22 VAL HG2% 1.0 . 3.79 1617 1317 A 102 TYR HE% A 22 VAL HG1% 1.0 . 3.79 1618 1318 A 28 TYR HE% A 49 LEU HDy% 1.0 . 3.20 1619 1318 A 28 TYR HE% A 49 LEU HDx% 1.0 . 3.20 1620 1319 A 38 PHE HD% A 81 GLN HGy 1.0 . 3.35 1621 1319 A 38 PHE HD% A 81 GLN HGx 1.0 . 3.35 1622 1320 A 44 TYR HD% A 43 PRO HGx 1.0 . 4.00 1623 1320 A 44 TYR HD% A 43 PRO HGy 1.0 . 4.00 1624 1321 A 44 TYR HD% A 91 LYS HEx 1.0 . 4.07 1625 1321 A 44 TYR HD% A 91 LYS HEy 1.0 . 4.07 1626 1322 A 54 PHE HD% A 59 GLU HGy 1.0 . 3.91 1627 1322 A 54 PHE HD% A 59 GLU HGx 1.0 . 3.91 1628 1323 A 88 PHE HD% A 64 LEU HDy% 1.0 . 3.17 1629 1323 A 88 PHE HD% A 64 LEU HDx% 1.0 . 3.17 1630 1324 A 88 PHE HZ A 64 LEU HDy% 1.0 . 3.56 1631 1324 A 88 PHE HZ A 64 LEU HDx% 1.0 . 3.56 1632 1325 A 67 TYR HD% A 84 LEU HDy% 1.0 . 3.51 1633 1325 A 67 TYR HD% A 84 LEU HDx% 1.0 . 3.51 1634 1326 A 67 TYR HE% A 84 LEU HDy% 1.0 . 4.03 1635 1326 A 67 TYR HE% A 84 LEU HDx% 1.0 . 4.03 1636 1327 A 68 TYR HE% A 71 LYS HEx 1.0 . 4.35 1637 1327 A 68 TYR HE% A 71 LYS HEy 1.0 . 4.35 1638 1328 A 128 PHE HE% A 70 LEU HBx 1.0 . 3.58 1639 1328 A 128 PHE HE% A 70 LEU HBy 1.0 . 3.58 1640 1329 A 128 PHE HD% A 70 LEU HDy% 1.0 . 3.27 1641 1329 A 128 PHE HD% A 70 LEU HDx% 1.0 . 3.27 1642 1330 A 128 PHE HE% A 70 LEU HDy% 1.0 . 3.10 1643 1330 A 128 PHE HE% A 70 LEU HDx% 1.0 . 3.10 1644 1331 A 128 PHE HZ A 70 LEU HDy% 1.0 . 3.02 1645 1331 A 128 PHE HZ A 70 LEU HDx% 1.0 . 3.02 1646 1332 A 77 TRP HZ3 A 84 LEU HDy% 1.0 . 4.04 1647 1332 A 77 TRP HZ3 A 84 LEU HDx% 1.0 . 4.04 1648 1333 A 83 PHE HE% A 87 VAL HGy% 1.0 . 3.06 1649 1333 A 83 PHE HE% A 87 VAL HGx% 1.0 . 3.06 1650 1334 A 83 PHE HZ A 87 VAL HGy% 1.0 . 3.20 1651 1334 A 83 PHE HZ A 87 VAL HGx% 1.0 . 3.20 1652 1335 A 83 PHE HZ A 104 PRO HBx 1.0 . 4.31 1653 1335 A 83 PHE HZ A 104 PRO HBy 1.0 . 4.31 1654 1336 A 83 PHE HZ A 104 PRO HGx 1.0 . 4.03 1655 1336 A 83 PHE HZ A 104 PRO HGy 1.0 . 4.03 1656 1337 A 83 PHE HZ A 104 PRO HDy 1.0 . 4.40 1657 1337 A 83 PHE HZ A 104 PRO HDx 1.0 . 4.40 1658 1338 A 88 PHE HZ A 84 LEU HDy% 1.0 . 3.01 1659 1338 A 88 PHE HZ A 84 LEU HDx% 1.0 . 3.01 1660 1339 A 88 PHE HZ A 87 VAL HGy% 1.0 . 3.70 1661 1339 A 88 PHE HZ A 87 VAL HGx% 1.0 . 3.70 1662 1340 A 102 TYR HE% A 93 GLU HBy 1.0 . 3.83 1663 1340 A 102 TYR HE% A 93 GLU HBx 1.0 . 3.83 1664 1341 A 102 TYR HE% A 93 GLU HGy 1.0 . 3.61 1665 1341 A 102 TYR HE% A 93 GLU HGx 1.0 . 3.61 1666 1342 A 124 PHE HD% A 119 LEU HDy% 1.0 . 3.60 1667 1342 A 124 PHE HD% A 119 LEU HDx% 1.0 . 3.60 1668 1343 A 128 PHE HD% A 129 LEU HDy% 1.0 . 3.43 1669 1343 A 129 LEU HDx% A 128 PHE HD% 1.0 . 3.43 1670 1344 A 128 PHE HE% A 129 LEU HDy% 1.0 . 3.37 1671 1344 A 129 LEU HDx% A 128 PHE HE% 1.0 . 3.37 1672 1345 A 128 PHE HZ A 129 LEU HDy% 1.0 . 3.27 1673 1345 A 129 LEU HDx% A 128 PHE HZ 1.0 . 3.27 1674 1346 A 88 PHE HZ A 87 VAL HGx% 1.0 . 4.78 1675 1347 A 89 LYS HA A 44 TYR HE% 1.0 . 3.95 1676 1348 A 38 PHE HZ A 84 LEU HDx% 1.0 . 3.63 1677 1349 A 80 ILE HD1% A 88 PHE HE% 1.0 . 3.23 1678 1350 A 88 PHE HD% A 80 ILE HD1% 1.0 . 4.78 1679 1351 A 38 PHE HZ A 84 LEU HDy% 1.0 . 3.63 1680 1352 A 88 PHE HZ A 87 VAL HGy% 1.0 . 4.78 1681 1353 A 84 LEU HA A 88 PHE HZ 1.0 . 4.95 1682 1354 A 86 ALA HB% A 83 PHE HE% 1.0 . 2.83 1683 1355 A 38 PHE HE% A 84 LEU HDy% 1.0 . 4.31 1684 1355 A 38 PHE HE% A 84 LEU HDx% 1.0 . 4.31 1685 1356 A 38 PHE HZ A 84 LEU HDy% 1.0 . 3.02 1686 1356 A 38 PHE HZ A 84 LEU HDx% 1.0 . 3.02 1687 1357 A 83 PHE HD% A 87 VAL HGy% 1.0 . 3.03 1688 1357 A 83 PHE HD% A 87 VAL HGx% 1.0 . 3.03 1689 1358 A 83 PHE HE% A 131 CYS HBx 1.0 . 4.48 1690 1358 A 83 PHE HE% A 131 CYS HBy 1.0 . 4.48 1691 1359 A 88 PHE HD% A 87 VAL HGy% 1.0 . 3.61 1692 1359 A 88 PHE HD% A 87 VAL HGx% 1.0 . 3.61 1693 1360 A 30 THR HG2% A 47 SER HBx 1.0 . 3.59 1694 1361 A 30 THR HG2% A 35 ASN HBx 1.0 . 3.59 1695 1362 A 30 THR HG2% A 47 SER HBy 1.0 . 3.59 1696 1363 A 30 THR HG2% A 35 ASN HBy 1.0 . 3.59 1697 1364 A 30 THR HG2% A 35 ASN HA 1.0 . 3.51 1698 1365 A 33 ALA HA A 32 ASN HBx 1.0 . 3.78 1699 1365 A 32 ASN HBy A 33 ALA HA 1.0 . 3.78 1700 1366 A 47 SER HA A 92 CYS HBy 1.0 . 3.82 1701 1367 A 68 TYR HE% A 71 LYS HEx 1.0 . 4.45 1702 1368 A 41 LYS HA A 36 THR HG2% 1.0 . 2.62 1703 1369 A 42 LEU HA A 43 PRO HDx 1.0 . 3.63 1704 1370 A 56 THR HG2% A 55 HIS HBy 1.0 . 3.45 1705 1371 A 60 LEU HDy% A 88 PHE HBx 1.0 . 3.18 1706 1371 A 60 LEU HDx% A 88 PHE HBx 1.0 . 3.18 1707 1372 A 36 THR HG2% A 41 LYS HGx 1.0 . 2.94 1708 1372 A 36 THR HG2% A 41 LYS HGy 1.0 . 2.94 1709 1373 A 42 LEU HA A 43 PRO HDy 1.0 . 3.63 1710 1374 A 37 CYS HBy A 42 LEU HDy% 1.0 . 2.49 1711 1375 A 33 ALA HB% A 34 THR HG2% 1.0 . 2.63 1712 1376 A 33 ALA HB% A 32 ASN HBx 1.0 . 4.12 1713 1376 A 32 ASN HBy A 33 ALA HB% 1.0 . 4.12 1714 1377 A 33 ALA HB% A 34 THR HA 1.0 . 4.11 1715 1378 A 42 LEU HDx% A 37 CYS HBy 1.0 . 2.49 1716 1379 A 54 PHE HD% A 59 GLU HBx 1.0 . 4.06 1717 1379 A 59 GLU HBy A 54 PHE HD% 1.0 . 4.06 1718 1380 A 36 THR HA A 41 LYS HBx 1.0 . 4.07 1719 1380 A 36 THR HA A 41 LYS HBy 1.0 . 4.07 1720 1381 A 92 CYS HA A 101 VAL HB 1.0 . 4.07 1721 1382 A 28 TYR HA A 29 PRO HDx 1.0 . 3.71 1722 1383 A 30 THR HB A 35 ASN HA 1.0 . 3.63 1723 1384 A 30 THR HB A 35 ASN HBx 1.0 . 3.72 1724 1385 A 30 THR HB A 35 ASN HBy 1.0 . 3.72 1725 1386 A 47 SER HA A 92 CYS HBx 1.0 . 3.82 1726 1387 A 42 LEU HDx% A 37 CYS HBx 1.0 . 2.49 1727 1388 A 37 CYS HBx A 42 LEU HDy% 1.0 . 2.49 1728 1389 A 28 TYR HA A 29 PRO HDy 1.0 . 3.71 1729 1390 A 41 LYS HA A 36 THR HB 1.0 . 4.07 1730 1391 A 92 CYS HA A 101 VAL HA 1.0 . 3.21 1731 1392 A 92 CYS HA A 101 VAL HGx% 1.0 . 4.29 1732 1393 A 36 THR HG2% A 41 LYS HBx 1.0 . 3.04 1733 1393 A 41 LYS HBy A 36 THR HG2% 1.0 . 3.04 1734 1394 A 36 THR HA A 41 LYS HA 1.0 . 3.14 1735 1395 A 36 THR HA A 41 LYS HGx 1.0 . 3.53 1736 1395 A 36 THR HA A 41 LYS HGy 1.0 . 3.53 1737 1396 A 46 LEU HA A 29 PRO HA 1.0 . 3.17 1738 1397 A 57 GLU HA A 60 LEU HDx% 1.0 . 3.86 1739 1397 A 57 GLU HA A 60 LEU HDy% 1.0 . 3.86 1740 1398 A 128 PHE HE% A 70 LEU HBy 1.0 . 4.22 1741 1399 A 56 THR HG2% A 55 HIS HBx 1.0 . 3.45 1742 1400 A 128 PHE HE% A 70 LEU HBx 1.0 . 4.22 1743 1401 A 88 PHE HBy A 60 LEU HDx% 1.0 . 3.18 1744 1401 A 60 LEU HDy% A 88 PHE HBy 1.0 . 3.18 1745 1402 A 68 TYR HE% A 71 LYS HEy 1.0 . 4.45 1746 1403 A 28 TYR HA A 29 PRO HDy 1.0 . 3.24 1747 1403 A 28 TYR HA A 29 PRO HDx 1.0 . 3.24 1748 1404 A 29 PRO HA A 46 LEU HDy% 1.0 . 2.72 1749 1404 A 29 PRO HA A 46 LEU HDx% 1.0 . 2.72 1750 1405 A 29 PRO HBy A 46 LEU HDy% 1.0 . 3.46 1751 1405 A 29 PRO HBx A 46 LEU HDy% 1.0 . 3.46 1752 1405 A 46 LEU HDx% A 29 PRO HBx 1.0 . 3.46 1753 1405 A 46 LEU HDx% A 29 PRO HBy 1.0 . 3.46 1754 1406 A 29 PRO HG3 A 46 LEU HDy% 1.0 . 3.57 1755 1406 A 29 PRO HG2 A 46 LEU HDy% 1.0 . 3.57 1756 1406 A 46 LEU HDx% A 29 PRO HG3 1.0 . 3.57 1757 1406 A 46 LEU HDx% A 29 PRO HG2 1.0 . 3.57 1758 1407 A 30 THR HG2% A 47 SER HBx 1.0 . 3.12 1759 1407 A 30 THR HG2% A 47 SER HBy 1.0 . 3.12 1760 1408 A 35 ASN HA A 42 LEU HDy% 1.0 . 3.82 1761 1408 A 42 LEU HDx% A 35 ASN HA 1.0 . 3.82 1762 1409 A 35 ASN HBy A 42 LEU HDy% 1.0 . 4.03 1763 1409 A 35 ASN HBx A 42 LEU HDy% 1.0 . 4.03 1764 1409 A 42 LEU HDx% A 35 ASN HBy 1.0 . 4.03 1765 1409 A 42 LEU HDx% A 35 ASN HBx 1.0 . 4.03 1766 1410 A 36 THR HA A 42 LEU HDy% 1.0 . 3.76 1767 1410 A 36 THR HA A 42 LEU HDx% 1.0 . 3.76 1768 1411 A 36 THR HG2% A 39 GLY HAy 1.0 . 3.07 1769 1411 A 36 THR HG2% A 39 GLY HAx 1.0 . 3.07 1770 1412 A 37 CYS HA A 42 LEU HDy% 1.0 . 3.17 1771 1412 A 37 CYS HA A 42 LEU HDx% 1.0 . 3.17 1772 1413 A 42 LEU HA A 43 PRO HDy 1.0 . 3.13 1773 1413 A 42 LEU HA A 43 PRO HDx 1.0 . 3.13 1774 1414 A 56 THR HG2% A 55 HIS HBy 1.0 . 3.00 1775 1414 A 56 THR HG2% A 55 HIS HBx 1.0 . 3.00 1776 1415 A 60 LEU HDy% A 88 PHE HBx 1.0 . 2.73 1777 1415 A 60 LEU HDx% A 88 PHE HBx 1.0 . 2.73 1778 1415 A 88 PHE HBy A 60 LEU HDx% 1.0 . 2.73 1779 1415 A 60 LEU HDy% A 88 PHE HBy 1.0 . 2.73 1780 1416 A 68 TYR HD% A 71 LYS HEx 1.0 . 3.97 1781 1416 A 68 TYR HD% A 71 LYS HEy 1.0 . 3.97 1782 1417 A 92 CYS HA A 101 VAL HGy% 1.0 . 3.68 1783 1417 A 92 CYS HA A 101 VAL HGx% 1.0 . 3.68 1784 1418 A 83 PHE HD% A 80 ILE HA 1.0 . 3.97 1785 1419 A 83 PHE HD% A 80 ILE HD1% 1.0 . 3.36 stop_ save_ save_DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.potential_type 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 13 GLY C A 14 LEU N A 14 LEU CA A 14 LEU C 1.0 -162.4 -18.7 PHI 2 2 A 14 LEU N A 14 LEU CA A 14 LEU C A 15 VAL N 1.0 89.2 174.7 PSI 3 3 A 14 LEU C A 15 VAL N A 15 VAL CA A 15 VAL C 1.0 -145.5 -47.7 PHI 4 4 A 15 VAL N A 15 VAL CA A 15 VAL C A 16 PRO N 1.0 75.5 174.3 PSI 5 5 A 21 MET C A 22 VAL N A 22 VAL CA A 22 VAL C 1.0 -144.8 -112.3 PHI 6 6 A 22 VAL N A 22 VAL CA A 22 VAL C A 23 ARG N 1.0 128.6 182.8 PSI 7 7 A 22 VAL C A 23 ARG N A 23 ARG CA A 23 ARG C 1.0 -166.6 -102.5 PHI 8 8 A 23 ARG N A 23 ARG CA A 23 ARG C A 24 ARG N 1.0 102.3 174.7 PSI 9 9 A 24 ARG C A 25 ALA N A 25 ALA CA A 25 ALA C 1.0 -168.8 -80.3 PHI 10 10 A 25 ALA N A 25 ALA CA A 25 ALA C A 26 ARG N 1.0 140.5 192.6 PSI 11 11 A 26 ARG C A 27 CYS N A 27 CYS CA A 27 CYS C 1.0 -164.3 -100.6 PHI 12 12 A 27 CYS N A 27 CYS CA A 27 CYS C A 28 TYR N 1.0 117.5 198.0 PSI 13 13 A 27 CYS C A 28 TYR N A 28 TYR CA A 28 TYR C 1.0 -180.4 -87.9 PHI 14 14 A 28 TYR N A 28 TYR CA A 28 TYR C A 29 PRO N 1.0 106.0 188.1 PSI 15 15 A 30 THR C A 31 SER N A 31 SER CA A 31 SER C 1.0 -108.6 -66.5 PHI 16 16 A 31 SER N A 31 SER CA A 31 SER C A 32 ASN N 1.0 141.7 184.5 PSI 17 17 A 31 SER C A 32 ASN N A 32 ASN CA A 32 ASN C 1.0 -67.4 -45.9 PHI 18 18 A 32 ASN N A 32 ASN CA A 32 ASN C A 33 ALA N 1.0 -57.0 -16.0 PSI 19 19 A 32 ASN C A 33 ALA N A 33 ALA CA A 33 ALA C 1.0 -99.0 -43.8 PHI 20 20 A 33 ALA N A 33 ALA CA A 33 ALA C A 34 THR N 1.0 -55.3 -0.2 PSI 21 21 A 35 ASN C A 36 THR N A 36 THR CA A 36 THR C 1.0 -169.1 -73.5 PHI 22 22 A 36 THR N A 36 THR CA A 36 THR C A 37 CYS N 1.0 121.3 187.4 PSI 23 23 A 36 THR C A 37 CYS N A 37 CYS CA A 37 CYS C 1.0 -163.6 -87.7 PHI 24 24 A 37 CYS N A 37 CYS CA A 37 CYS C A 38 PHE N 1.0 95.8 181.5 PSI 25 25 A 39 GLY C A 40 SER N A 40 SER CA A 40 SER C 1.0 -142.8 -55.8 PHI 26 26 A 40 SER N A 40 SER CA A 40 SER C A 41 LYS N 1.0 90.0 159.1 PSI 27 27 A 40 SER C A 41 LYS N A 41 LYS CA A 41 LYS C 1.0 -144.8 -38.6 PHI 28 28 A 41 LYS N A 41 LYS CA A 41 LYS C A 42 LEU N 1.0 91.8 167.2 PSI 29 29 A 41 LYS C A 42 LEU N A 42 LEU CA A 42 LEU C 1.0 -115.1 -49.6 PHI 30 30 A 42 LEU N A 42 LEU CA A 42 LEU C A 43 PRO N 1.0 97.9 186.2 PSI 31 31 A 45 GLU C A 46 LEU N A 46 LEU CA A 46 LEU C 1.0 -160.4 -66.2 PHI 32 32 A 46 LEU N A 46 LEU CA A 46 LEU C A 47 SER N 1.0 134.0 171.5 PSI 33 33 A 46 LEU C A 47 SER N A 47 SER CA A 47 SER C 1.0 -159.2 -99.2 PHI 34 34 A 47 SER N A 47 SER CA A 47 SER C A 48 SER N 1.0 122.1 179.1 PSI 35 35 A 47 SER C A 48 SER N A 48 SER CA A 48 SER C 1.0 -147.6 -37.1 PHI 36 36 A 48 SER N A 48 SER CA A 48 SER C A 49 LEU N 1.0 102.8 183.4 PSI 37 37 A 48 SER C A 49 LEU N A 49 LEU CA A 49 LEU C 1.0 -71.7 -51.7 PHI 38 38 A 49 LEU N A 49 LEU CA A 49 LEU C A 50 ASP N 1.0 -56.4 -10.4 PSI 39 39 A 49 LEU C A 50 ASP N A 50 ASP CA A 50 ASP C 1.0 -80.1 -40.2 PHI 40 40 A 50 ASP N A 50 ASP CA A 50 ASP C A 51 LEU N 1.0 -51.8 -10.3 PSI 41 41 A 56 THR C A 57 GLU N A 57 GLU CA A 57 GLU C 1.0 -85.6 -42.8 PHI 42 42 A 57 GLU N A 57 GLU CA A 57 GLU C A 58 LYS N 1.0 -59.2 -14.1 PSI 43 43 A 57 GLU C A 58 LYS N A 58 LYS CA A 58 LYS C 1.0 -74.2 -54.2 PHI 44 44 A 58 LYS N A 58 LYS CA A 58 LYS C A 59 GLU N 1.0 -49.9 -29.3 PSI 45 45 A 58 LYS C A 59 GLU N A 59 GLU CA A 59 GLU C 1.0 -74.5 -54.5 PHI 46 46 A 59 GLU N A 59 GLU CA A 59 GLU C A 60 LEU N 1.0 -49.8 -27.1 PSI 47 47 A 59 GLU C A 60 LEU N A 60 LEU CA A 60 LEU C 1.0 -71.9 -51.9 PHI 48 48 A 60 LEU N A 60 LEU CA A 60 LEU C A 61 ASN N 1.0 -55.7 -35.7 PSI 49 49 A 60 LEU C A 61 ASN N A 61 ASN CA A 61 ASN C 1.0 -70.2 -50.2 PHI 50 50 A 61 ASN N A 61 ASN CA A 61 ASN C A 62 ASP N 1.0 -59.7 -22.3 PSI 51 51 A 61 ASN C A 62 ASP N A 62 ASP CA A 62 ASP C 1.0 -77.0 -46.9 PHI 52 52 A 62 ASP N A 62 ASP CA A 62 ASP C A 63 LYS N 1.0 -56.4 -31.5 PSI 53 53 A 62 ASP C A 63 LYS N A 63 LYS CA A 63 LYS C 1.0 -78.0 -57.3 PHI 54 54 A 63 LYS N A 63 LYS CA A 63 LYS C A 64 LEU N 1.0 -53.7 -30.9 PSI 55 55 A 63 LYS C A 64 LEU N A 64 LEU CA A 64 LEU C 1.0 -72.1 -52.1 PHI 56 56 A 64 LEU N A 64 LEU CA A 64 LEU C A 65 ASN N 1.0 -51.9 -26.4 PSI 57 57 A 64 LEU C A 65 ASN N A 65 ASN CA A 65 ASN C 1.0 -74.8 -54.8 PHI 58 58 A 65 ASN N A 65 ASN CA A 65 ASN C A 66 ASP N 1.0 -58.1 -18.0 PSI 59 59 A 65 ASN C A 66 ASP N A 66 ASP CA A 66 ASP C 1.0 -60.0 -55.1 PHI 60 60 A 66 ASP N A 66 ASP CA A 66 ASP C A 67 TYR N 1.0 -52.3 -29.3 PSI 61 61 A 66 ASP C A 67 TYR N A 67 TYR CA A 67 TYR C 1.0 -74.1 -54.1 PHI 62 62 A 67 TYR N A 67 TYR CA A 67 TYR C A 68 TYR N 1.0 -53.7 -33.7 PSI 63 63 A 67 TYR C A 68 TYR N A 68 TYR CA A 68 TYR C 1.0 -76.7 -51.1 PHI 64 64 A 68 TYR N A 68 TYR CA A 68 TYR C A 69 ALA N 1.0 -53.2 -33.2 PSI 65 65 A 69 ALA C A 70 LEU N A 70 LEU CA A 70 LEU C 1.0 -60.1 -55.1 PHI 66 66 A 70 LEU C A 71 LYS N A 71 LYS CA A 71 LYS C 1.0 -89.8 -43.2 PHI 67 67 A 71 LYS N A 71 LYS CA A 71 LYS C A 72 HIS N 1.0 -59.7 -34.0 PSI 68 68 A 71 LYS C A 72 HIS N A 72 HIS CA A 72 HIS C 1.0 -121.4 -52.3 PHI 69 69 A 74 PRO C A 75 LYS N A 75 LYS CA A 75 LYS C 1.0 -73.3 -53.3 PHI 70 70 A 75 LYS N A 75 LYS CA A 75 LYS C A 76 CYS N 1.0 -58.5 -15.6 PSI 71 71 A 76 CYS C A 77 TRP N A 77 TRP CA A 77 TRP C 1.0 -88.5 -54.8 PHI 72 72 A 77 TRP N A 77 TRP CA A 77 TRP C A 78 ALA N 1.0 -57.2 -1.2 PSI 73 73 A 77 TRP C A 78 ALA N A 78 ALA CA A 78 ALA C 1.0 -74.3 -53.8 PHI 74 74 A 78 ALA N A 78 ALA CA A 78 ALA C A 79 ALA N 1.0 -51.6 -12.5 PSI 75 75 A 78 ALA C A 79 ALA N A 79 ALA CA A 79 ALA C 1.0 -93.7 -49.6 PHI 76 76 A 79 ALA N A 79 ALA CA A 79 ALA C A 80 ILE N 1.0 -59.4 2.4 PSI 77 77 A 79 ALA C A 80 ILE N A 80 ILE CA A 80 ILE C 1.0 -124.0 -59.5 PHI 78 78 A 80 ILE N A 80 ILE CA A 80 ILE C A 81 GLN N 1.0 -43.3 20.7 PSI 79 79 A 80 ILE C A 81 GLN N A 81 GLN CA A 81 GLN C 1.0 -72.2 -35.4 PHI 80 80 A 82 PRO C A 83 PHE N A 83 PHE CA A 83 PHE C 1.0 -82.8 -51.0 PHI 81 81 A 83 PHE N A 83 PHE CA A 83 PHE C A 84 LEU N 1.0 -64.6 -14.9 PSI 82 82 A 83 PHE C A 84 LEU N A 84 LEU CA A 84 LEU C 1.0 -88.2 -47.7 PHI 83 83 A 84 LEU N A 84 LEU CA A 84 LEU C A 85 CYS N 1.0 -59.7 -7.0 PSI 84 84 A 84 LEU C A 85 CYS N A 85 CYS CA A 85 CYS C 1.0 -125.7 -35.8 PHI 85 85 A 86 ALA N A 86 ALA CA A 86 ALA C A 87 VAL N 1.0 -61.8 7.5 PSI 86 86 A 86 ALA C A 87 VAL N A 87 VAL CA A 87 VAL C 1.0 -105.8 -48.3 PHI 87 87 A 87 VAL N A 87 VAL CA A 87 VAL C A 88 PHE N 1.0 -60.7 -10.4 PSI 88 88 A 87 VAL C A 88 PHE N A 88 PHE CA A 88 PHE C 1.0 -107.2 -47.0 PHI 89 89 A 88 PHE N A 88 PHE CA A 88 PHE C A 89 LYS N 1.0 -70.8 4.7 PSI 90 90 A 91 LYS C A 92 CYS N A 92 CYS CA A 92 CYS C 1.0 -154.3 -83.3 PHI 91 91 A 92 CYS N A 92 CYS CA A 92 CYS C A 93 GLU N 1.0 102.5 179.4 PSI 92 92 A 92 CYS C A 93 GLU N A 93 GLU CA A 93 GLU C 1.0 -182.6 -83.1 PHI 93 93 A 93 GLU N A 93 GLU CA A 93 GLU C A 94 LYS N 1.0 106.5 178.6 PSI 94 94 A 93 GLU C A 94 LYS N A 94 LYS CA A 94 LYS C 1.0 -104.7 -67.6 PHI 95 95 A 94 LYS N A 94 LYS CA A 94 LYS C A 95 ILE N 1.0 103.5 156.8 PSI 96 96 A 94 LYS C A 95 ILE N A 95 ILE CA A 95 ILE C 1.0 -135.0 -54.8 PHI 97 97 A 95 ILE N A 95 ILE CA A 95 ILE C A 96 ASN N 1.0 96.0 144.6 PSI 98 98 A 97 GLY C A 98 GLU N A 98 GLU CA A 98 GLU C 1.0 -141.0 -70.9 PHI 99 99 A 98 GLU N A 98 GLU CA A 98 GLU C A 99 ASP N 1.0 102.8 160.4 PSI 100 100 A 98 GLU C A 99 ASP N A 99 ASP CA A 99 ASP C 1.0 -118.0 -59.0 PHI 101 101 A 99 ASP N A 99 ASP CA A 99 ASP C A 100 MET N 1.0 100.1 161.9 PSI 102 102 A 99 ASP C A 100 MET N A 100 MET CA A 100 MET C 1.0 -148.6 -84.5 PHI 103 103 A 100 MET N A 100 MET CA A 100 MET C A 101 VAL N 1.0 102.0 186.2 PSI 104 104 A 100 MET C A 101 VAL N A 101 VAL CA A 101 VAL C 1.0 -148.9 -92.3 PHI 105 105 A 101 VAL N A 101 VAL CA A 101 VAL C A 102 TYR N 1.0 97.8 180.2 PSI 106 106 A 101 VAL C A 102 TYR N A 102 TYR CA A 102 TYR C 1.0 -115.3 -44.8 PHI 107 107 A 102 TYR N A 102 TYR CA A 102 TYR C A 103 LEU N 1.0 99.7 167.5 PSI 108 108 A 102 TYR C A 103 LEU N A 103 LEU CA A 103 LEU C 1.0 -118.5 -50.6 PHI 109 109 A 103 LEU N A 103 LEU CA A 103 LEU C A 104 PRO N 1.0 114.5 176.6 PSI 110 110 A 104 PRO C A 105 SER N A 105 SER CA A 105 SER C 1.0 -112.2 -69.3 PHI 111 111 A 105 SER N A 105 SER CA A 105 SER C A 106 TYR N 1.0 152.3 181.1 PSI 112 112 A 105 SER C A 106 TYR N A 106 TYR CA A 106 TYR C 1.0 -69.6 -49.6 PHI 113 113 A 106 TYR N A 106 TYR CA A 106 TYR C A 107 GLU N 1.0 -47.4 -23.9 PSI 114 114 A 106 TYR C A 107 GLU N A 107 GLU CA A 107 GLU C 1.0 -70.8 -50.8 PHI 115 115 A 107 GLU N A 107 GLU CA A 107 GLU C A 108 MET N 1.0 -55.3 -27.7 PSI 116 116 A 107 GLU C A 108 MET N A 108 MET CA A 108 MET C 1.0 -80.9 -53.2 PHI 117 117 A 108 MET N A 108 MET CA A 108 MET C A 109 CYS N 1.0 -51.6 -17.2 PSI 118 118 A 109 CYS C A 110 ARG N A 110 ARG CA A 110 ARG C 1.0 -72.2 -52.1 PHI 119 119 A 110 ARG N A 110 ARG CA A 110 ARG C A 111 ILE N 1.0 -60.5 -15.8 PSI 120 120 A 110 ARG C A 111 ILE N A 111 ILE CA A 111 ILE C 1.0 -87.2 -47.0 PHI 121 121 A 111 ILE N A 111 ILE CA A 111 ILE C A 112 THR N 1.0 -63.8 -11.6 PSI 122 122 A 111 ILE C A 112 THR N A 112 THR CA A 112 THR C 1.0 -91.4 -60.5 PHI 123 123 A 112 THR C A 113 MET N A 113 MET CA A 113 MET C 1.0 -78.3 -44.5 PHI 124 124 A 113 MET N A 113 MET CA A 113 MET C A 114 GLU N 1.0 -56.4 -34.3 PSI 125 125 A 116 CYS C A 117 ARG N A 117 ARG CA A 117 ARG C 1.0 -82.0 -43.0 PHI 126 126 A 117 ARG N A 117 ARG CA A 117 ARG C A 118 ILE N 1.0 -62.4 -8.6 PSI 127 127 A 117 ARG C A 118 ILE N A 118 ILE CA A 118 ILE C 1.0 -93.1 -48.8 PHI 128 128 A 118 ILE N A 118 ILE CA A 118 ILE C A 119 LEU N 1.0 -55.1 -10.2 PSI 129 129 A 118 ILE C A 119 LEU N A 119 LEU CA A 119 LEU C 1.0 -112.2 -67.8 PHI 130 130 A 119 LEU N A 119 LEU CA A 119 LEU C A 120 TYR N 1.0 -59.6 29.0 PSI 131 131 A 119 LEU C A 120 TYR N A 120 TYR CA A 120 TYR C 1.0 -79.6 -47.0 PHI 132 132 A 120 TYR N A 120 TYR CA A 120 TYR C A 121 ASN N 1.0 -54.8 -2.5 PSI 133 133 A 123 THR C A 124 PHE N A 124 PHE CA A 124 PHE C 1.0 -116.3 -40.1 PHI 134 134 A 124 PHE N A 124 PHE CA A 124 PHE C A 125 PHE N 1.0 -57.4 -2.8 PSI 135 135 A 126 PRO C A 127 LYS N A 127 LYS CA A 127 LYS C 1.0 -69.2 -49.2 PHI 136 136 A 130 ARG C A 131 CYS N A 131 CYS CA A 131 CYS C 1.0 -166.3 -104.6 PHI 137 137 A 131 CYS N A 131 CYS CA A 131 CYS C A 132 ASN N 1.0 132.7 175.2 PSI 138 138 A 131 CYS C A 132 ASN N A 132 ASN CA A 132 ASN C 1.0 -118.6 -52.4 PHI 139 139 A 132 ASN N A 132 ASN CA A 132 ASN C A 133 GLU N 1.0 115.4 145.8 PSI stop_ save_