data_nef_c18210_2loe 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 6 CYS SG 1 38 CYS SG 1 52 CYS SG 1 113 CYS SG 1 63 CYS SG 1 111 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 1 GLU start . . 2 A 2 LYS middle . . 3 A 3 VAL middle . . 4 A 4 LYS middle . . 5 A 5 GLY middle . false 6 A 6 CYS middle -HG . 7 A 7 ASP middle . . 8 A 8 PHE middle . . 9 A 9 THR middle . . 10 A 10 THR middle . . 11 A 11 SER middle . . 12 A 12 GLU middle . . 13 A 13 SER middle . . 14 A 14 THR middle . . 15 A 15 ILE middle . . 16 A 16 PHE middle . . 17 A 17 SER middle . . 18 A 18 LYS middle . . 19 A 19 GLY middle . false 20 A 20 TYR middle . . 21 A 21 SER middle . . 22 A 22 ILE middle . . 23 A 23 ASN middle . . 24 A 24 GLU middle . . 25 A 25 ILE middle . . 26 A 26 SER middle . . 27 A 27 ASN middle . . 28 A 28 LYS middle . . 29 A 29 SER middle . . 30 A 30 SER middle . . 31 A 31 ASN middle . . 32 A 32 ASN middle . . 33 A 33 GLN middle . . 34 A 34 GLN middle . . 35 A 35 ASP middle . . 36 A 36 ILE middle . . 37 A 37 VAL middle . . 38 A 38 CYS middle -HG . 39 A 39 THR middle . . 40 A 40 VAL middle . . 41 A 41 LYS middle . . 42 A 42 ALA middle . . 43 A 43 HIS middle . . 44 A 44 ALA middle . . 45 A 45 ASN middle . . 46 A 46 ASP middle . . 47 A 47 LEU middle . . 48 A 48 ILE middle . . 49 A 49 GLY middle . false 50 A 50 PHE middle . . 51 A 51 LYS middle . . 52 A 52 CYS middle -HG . 53 A 53 PRO middle . false 54 A 54 SER middle . . 55 A 55 ASN middle . . 56 A 56 TYR middle . . 57 A 57 SER middle . . 58 A 58 VAL middle . . 59 A 59 GLU middle . . 60 A 60 PRO middle . false 61 A 61 HIS middle . . 62 A 62 ASP middle . . 63 A 63 CYS middle -HG . 64 A 64 PHE middle . . 65 A 65 VAL middle . . 66 A 66 SER middle . . 67 A 67 ALA middle . . 68 A 68 PHE middle . . 69 A 69 ASN middle . . 70 A 70 LEU middle . . 71 A 71 SER middle . . 72 A 72 GLY middle . false 73 A 73 LYS middle . . 74 A 74 ASN middle . . 75 A 75 GLU middle . . 76 A 76 ASN middle . . 77 A 77 LEU middle . . 78 A 78 GLU middle . . 79 A 79 ASN middle . . 80 A 80 LYS middle . . 81 A 81 LEU middle . . 82 A 82 LYS middle . . 83 A 83 LEU middle . . 84 A 84 THR middle . . 85 A 85 ASN middle . . 86 A 86 ILE middle . . 87 A 87 ILE middle . . 88 A 88 MET middle . . 89 A 89 ASP middle . . 90 A 90 HIS middle . . 91 A 91 TYR middle . . 92 A 92 ASN middle . . 93 A 93 ASN middle . . 94 A 94 THR middle . . 95 A 95 PHE middle . . 96 A 96 TYR middle . . 97 A 97 SER middle . . 98 A 98 ARG middle . . 99 A 99 LEU middle . . 100 A 100 PRO middle . false 101 A 101 SER middle . . 102 A 102 LEU middle . . 103 A 103 ILE middle . . 104 A 104 SER middle . . 105 A 105 ASP middle . . 106 A 106 ASN middle . . 107 A 107 TRP middle . . 108 A 108 LYS middle . . 109 A 109 PHE middle . . 110 A 110 PHE middle . . 111 A 111 CYS middle -HG . 112 A 112 VAL middle . . 113 A 113 CYS middle -HG . 114 A 114 SER middle . . 115 A 115 LYS middle . . 116 A 116 ASP middle . . 117 A 117 ASN middle . . 118 A 118 GLU middle . . 119 A 119 LYS middle . . 120 A 120 LYS middle . . 121 A 121 LEU middle . . 122 A 122 VAL middle . . 123 A 123 PHE middle . . 124 A 124 THR middle . . 125 A 125 VAL middle . . 126 A 126 GLU middle . . 127 A 127 ALA end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 GLU H1 H 1 8.473 0.03 A 1 GLU HA H 1 4.318 0.03 A 1 GLU HB2 H 1 1.900 0.03 A 1 GLU HB3 H 1 2.023 0.03 A 1 GLU HG2 H 1 1.649 0.03 A 1 GLU HG3 H 1 2.286 0.03 A 1 GLU C C 13 176.164 0.1 A 1 GLU CA C 13 56.364 0.1 A 1 GLU CB C 13 30.442 0.1 A 1 GLU CG C 13 35.873 0.1 A 1 GLU N N 15 123.040 0.1 A 2 LYS HA H 1 4.169 0.03 A 2 LYS HB2 H 1 1.379 0.03 A 2 LYS HB3 H 1 1.518 0.03 A 2 LYS HD2 H 1 1.320 0.03 A 2 LYS HD3 H 1 1.140 0.03 A 2 LYS HE3 H 1 2.880 0.03 A 2 LYS HG2 H 1 1.440 0.03 A 2 LYS HG3 H 1 1.320 0.03 A 2 LYS C C 13 176.160 0.1 A 2 LYS CA C 13 55.965 0.1 A 2 LYS CB C 13 33.265 0.1 A 2 LYS CD C 13 29.045 0.1 A 2 LYS CE C 13 42.447 0.1 A 2 LYS CG C 13 25.318 0.1 A 3 VAL HA H 1 3.913 0.03 A 3 VAL HB H 1 1.785 0.03 A 3 VAL HG1% H 1 1.037 0.03 A 3 VAL HG2% H 1 0.840 0.03 A 3 VAL C C 13 175.820 0.1 A 3 VAL CA C 13 62.488 0.1 A 3 VAL CB C 13 32.780 0.1 A 3 VAL CG1 C 13 22.078 0.1 A 3 VAL CG2 C 13 22.440 0.1 A 4 LYS H H 1 8.507 0.03 A 4 LYS HA H 1 4.507 0.03 A 4 LYS HB2 H 1 2.026 0.03 A 4 LYS HB3 H 1 2.163 0.03 A 4 LYS HD2 H 1 1.727 0.03 A 4 LYS HD3 H 1 1.576 0.03 A 4 LYS HE3 H 1 3.088 0.03 A 4 LYS HG2 H 1 1.675 0.03 A 4 LYS HG3 H 1 1.763 0.03 A 4 LYS C C 13 174.923 0.1 A 4 LYS CA C 13 57.303 0.1 A 4 LYS CB C 13 32.251 0.1 A 4 LYS CD C 13 29.405 0.1 A 4 LYS CE C 13 42.262 0.1 A 4 LYS CG C 13 25.324 0.1 A 4 LYS N N 15 129.029 0.1 A 5 GLY H H 1 8.138 0.03 A 5 GLY HA2 H 1 4.033 0.03 A 5 GLY HA3 H 1 5.626 0.03 A 5 GLY C C 13 173.333 0.1 A 5 GLY CA C 13 46.264 0.1 A 5 GLY N N 15 110.242 0.1 A 6 CYS H H 1 6.750 0.03 A 6 CYS HA H 1 5.251 0.03 A 6 CYS HB2 H 1 2.030 0.03 A 6 CYS HB3 H 1 2.750 0.03 A 6 CYS C C 13 170.891 0.1 A 6 CYS CA C 13 54.850 0.1 A 6 CYS CB C 13 51.150 0.1 A 6 CYS N N 15 114.306 0.1 A 7 ASP HA H 1 4.748 0.03 A 7 ASP HB2 H 1 2.695 0.03 A 7 ASP HB3 H 1 3.731 0.03 A 7 ASP C C 13 175.607 0.1 A 7 ASP CA C 13 52.238 0.1 A 7 ASP CB C 13 41.617 0.1 A 8 PHE HA H 1 4.877 0.03 A 8 PHE HB2 H 1 2.947 0.03 A 8 PHE HB3 H 1 3.549 0.03 A 8 PHE HDx H 1 7.072 0.03 A 8 PHE HDy H 1 7.072 0.03 A 8 PHE HEx H 1 7.040 0.03 A 8 PHE HEy H 1 7.040 0.03 A 8 PHE HZ H 1 6.086 0.03 A 8 PHE C C 13 173.972 0.1 A 8 PHE CA C 13 59.455 0.1 A 8 PHE CB C 13 39.219 0.1 A 8 PHE CDx C 13 132.950 0.1 A 8 PHE CDy C 13 132.950 0.1 A 8 PHE CEx C 13 130.464 0.1 A 8 PHE CEy C 13 130.464 0.1 A 8 PHE CZ C 13 128.856 0.1 A 9 THR H H 1 8.996 0.03 A 9 THR HA H 1 4.611 0.03 A 9 THR HB H 1 4.378 0.03 A 9 THR HG2% H 1 0.846 0.03 A 9 THR C C 13 174.505 0.1 A 9 THR CA C 13 61.988 0.1 A 9 THR CB C 13 70.385 0.1 A 9 THR CG2 C 13 22.574 0.1 A 9 THR N N 15 105.421 0.1 A 10 THR H H 1 7.199 0.03 A 10 THR HA H 1 4.526 0.03 A 10 THR HB H 1 4.471 0.03 A 10 THR HG2% H 1 0.997 0.03 A 10 THR C C 13 171.202 0.1 A 10 THR CA C 13 60.774 0.1 A 10 THR CB C 13 68.040 0.1 A 10 THR CG2 C 13 18.790 0.1 A 10 THR N N 15 118.757 0.1 A 11 SER H H 1 7.997 0.03 A 11 SER HA H 1 3.907 0.03 A 11 SER HB2 H 1 3.985 0.03 A 11 SER HB3 H 1 3.644 0.03 A 11 SER C C 13 174.988 0.1 A 11 SER CA C 13 59.563 0.1 A 11 SER CB C 13 63.599 0.1 A 11 SER N N 15 117.117 0.1 A 12 GLU H H 1 8.375 0.03 A 12 GLU HA H 1 4.565 0.03 A 12 GLU HB2 H 1 1.755 0.03 A 12 GLU HB3 H 1 2.000 0.03 A 12 GLU HG3 H 1 2.153 0.03 A 12 GLU C C 13 175.108 0.1 A 12 GLU CA C 13 54.259 0.1 A 12 GLU CB C 13 28.928 0.1 A 12 GLU CG C 13 35.529 0.1 A 12 GLU N N 15 125.013 0.1 A 13 SER H H 1 7.879 0.03 A 13 SER HA H 1 4.130 0.03 A 13 SER HB3 H 1 3.845 0.03 A 13 SER C C 13 176.833 0.1 A 13 SER CA C 13 58.707 0.1 A 13 SER CB C 13 63.598 0.1 A 13 SER N N 15 114.959 0.1 A 14 THR H H 1 8.978 0.03 A 14 THR HA H 1 4.348 0.03 A 14 THR HB H 1 4.332 0.03 A 14 THR HG2% H 1 1.257 0.03 A 14 THR C C 13 174.550 0.1 A 14 THR CA C 13 62.435 0.1 A 14 THR CB C 13 69.114 0.1 A 14 THR CG2 C 13 21.949 0.1 A 14 THR N N 15 117.688 0.1 A 15 ILE H H 1 7.947 0.03 A 15 ILE HA H 1 4.038 0.03 A 15 ILE HB H 1 1.144 0.03 A 15 ILE HD1% H 1 0.693 0.03 A 15 ILE HG12 H 1 1.311 0.03 A 15 ILE HG13 H 1 0.778 0.03 A 15 ILE HG2% H 1 0.098 0.03 A 15 ILE C C 13 175.389 0.1 A 15 ILE CA C 13 62.700 0.1 A 15 ILE CB C 13 41.447 0.1 A 15 ILE CD1 C 13 13.810 0.1 A 15 ILE CG1 C 13 26.890 0.1 A 15 ILE CG2 C 13 17.290 0.1 A 15 ILE N N 15 118.851 0.1 A 16 PHE H H 1 7.792 0.03 A 16 PHE HA H 1 5.518 0.03 A 16 PHE HB2 H 1 2.623 0.03 A 16 PHE HB3 H 1 3.089 0.03 A 16 PHE HDx H 1 6.959 0.03 A 16 PHE HDy H 1 6.959 0.03 A 16 PHE HEx H 1 6.805 0.03 A 16 PHE HEy H 1 6.805 0.03 A 16 PHE HZ H 1 6.444 0.03 A 16 PHE C C 13 176.700 0.1 A 16 PHE CA C 13 57.462 0.1 A 16 PHE CB C 13 42.712 0.1 A 16 PHE CDx C 13 131.180 0.1 A 16 PHE CDy C 13 131.180 0.1 A 16 PHE CEx C 13 131.100 0.1 A 16 PHE CEy C 13 131.100 0.1 A 16 PHE CZ C 13 130.250 0.1 A 16 PHE N N 15 116.409 0.1 A 17 SER H H 1 8.666 0.03 A 17 SER HA H 1 3.984 0.03 A 17 SER HB2 H 1 3.864 0.03 A 17 SER HB3 H 1 4.176 0.03 A 17 SER C C 13 174.203 0.1 A 17 SER CA C 13 61.176 0.1 A 17 SER CB C 13 63.438 0.1 A 17 SER N N 15 114.126 0.1 A 18 LYS H H 1 8.031 0.03 A 18 LYS HA H 1 4.758 0.03 A 18 LYS HB2 H 1 1.953 0.03 A 18 LYS HB3 H 1 1.882 0.03 A 18 LYS HD2 H 1 1.287 0.03 A 18 LYS HD3 H 1 1.425 0.03 A 18 LYS HE2 H 1 2.786 0.03 A 18 LYS HE3 H 1 2.935 0.03 A 18 LYS HG3 H 1 1.717 0.03 A 18 LYS C C 13 174.029 0.1 A 18 LYS CA C 13 55.661 0.1 A 18 LYS CB C 13 35.049 0.1 A 18 LYS CD C 13 29.170 0.1 A 18 LYS CE C 13 42.389 0.1 A 18 LYS CG C 13 25.240 0.1 A 18 LYS N N 15 122.828 0.1 A 19 GLY H H 1 8.092 0.03 A 19 GLY HA2 H 1 4.165 0.03 A 19 GLY HA3 H 1 5.281 0.03 A 19 GLY C C 13 172.307 0.1 A 19 GLY CA C 13 44.946 0.1 A 19 GLY N N 15 112.051 0.1 A 20 TYR H H 1 7.968 0.03 A 20 TYR HA H 1 4.570 0.03 A 20 TYR HB2 H 1 2.615 0.03 A 20 TYR HB3 H 1 2.862 0.03 A 20 TYR HDx H 1 6.838 0.03 A 20 TYR HDy H 1 6.838 0.03 A 20 TYR HEx H 1 6.714 0.03 A 20 TYR HEy H 1 6.714 0.03 A 20 TYR C C 13 173.557 0.1 A 20 TYR CA C 13 57.512 0.1 A 20 TYR CB C 13 43.091 0.1 A 20 TYR CDx C 13 133.050 0.1 A 20 TYR CDy C 13 133.050 0.1 A 20 TYR CEx C 13 118.160 0.1 A 20 TYR CEy C 13 118.160 0.1 A 20 TYR N N 15 120.060 0.1 A 21 SER H H 1 8.761 0.03 A 21 SER HA H 1 4.562 0.03 A 21 SER HB2 H 1 4.011 0.03 A 21 SER HB3 H 1 4.188 0.03 A 21 SER C C 13 176.172 0.1 A 21 SER CA C 13 56.537 0.1 A 21 SER CB C 13 65.257 0.1 A 21 SER N N 15 115.201 0.1 A 22 ILE H H 1 8.646 0.03 A 22 ILE HA H 1 4.159 0.03 A 22 ILE HB H 1 2.013 0.03 A 22 ILE HD1% H 1 0.974 0.03 A 22 ILE HG12 H 1 1.505 0.03 A 22 ILE HG13 H 1 1.428 0.03 A 22 ILE HG2% H 1 1.012 0.03 A 22 ILE C C 13 177.561 0.1 A 22 ILE CA C 13 62.713 0.1 A 22 ILE CB C 13 37.855 0.1 A 22 ILE CD1 C 13 13.389 0.1 A 22 ILE CG1 C 13 28.297 0.1 A 22 ILE CG2 C 13 17.742 0.1 A 22 ILE N N 15 122.867 0.1 A 23 ASN HA H 1 4.545 0.03 A 23 ASN HB2 H 1 2.752 0.03 A 23 ASN HB3 H 1 2.816 0.03 A 23 ASN HD21 H 1 7.634 0.03 A 23 ASN HD22 H 1 6.991 0.03 A 23 ASN C C 13 176.647 0.1 A 23 ASN CA C 13 55.506 0.1 A 23 ASN CB C 13 38.453 0.1 A 23 ASN ND2 N 15 113.041 0.1 A 24 GLU H H 1 7.837 0.03 A 24 GLU HA H 1 4.286 0.03 A 24 GLU HB2 H 1 2.232 0.03 A 24 GLU HB3 H 1 2.402 0.03 A 24 GLU HG3 H 1 2.400 0.03 A 24 GLU C C 13 177.998 0.1 A 24 GLU CA C 13 58.306 0.1 A 24 GLU CB C 13 30.658 0.1 A 24 GLU CG C 13 37.119 0.1 A 24 GLU N N 15 118.601 0.1 A 25 ILE HA H 1 4.173 0.03 A 25 ILE HB H 1 2.114 0.03 A 25 ILE HD1% H 1 0.895 0.03 A 25 ILE HG13 H 1 1.493 0.03 A 25 ILE HG2% H 1 0.959 0.03 A 25 ILE C C 13 176.641 0.1 A 25 ILE CA C 13 62.612 0.1 A 25 ILE CB C 13 38.360 0.1 A 25 ILE CD1 C 13 14.007 0.1 A 25 ILE CG1 C 13 26.989 0.1 A 25 ILE CG2 C 13 17.968 0.1 A 26 SER H H 1 7.813 0.03 A 26 SER HA H 1 4.663 0.03 A 26 SER HB3 H 1 3.996 0.03 A 26 SER C C 13 174.462 0.1 A 26 SER CA C 13 58.392 0.1 A 26 SER CB C 13 64.380 0.1 A 26 SER N N 15 116.293 0.1 A 27 ASN H H 1 8.521 0.03 A 27 ASN HA H 1 4.721 0.03 A 27 ASN HB3 H 1 2.946 0.03 A 27 ASN HD21 H 1 7.540 0.03 A 27 ASN HD22 H 1 6.907 0.03 A 27 ASN C C 13 175.869 0.1 A 27 ASN CA C 13 54.010 0.1 A 27 ASN CB C 13 38.640 0.1 A 27 ASN N N 15 121.919 0.1 A 27 ASN ND2 N 15 112.280 0.1 A 28 LYS H H 1 8.367 0.03 A 28 LYS HA H 1 4.360 0.03 A 28 LYS HB2 H 1 1.792 0.03 A 28 LYS HB3 H 1 1.937 0.03 A 28 LYS HD3 H 1 1.482 0.03 A 28 LYS HE3 H 1 3.016 0.03 A 28 LYS HG3 H 1 1.688 0.03 A 28 LYS C C 13 176.952 0.1 A 28 LYS CA C 13 56.967 0.1 A 28 LYS CB C 13 32.730 0.1 A 28 LYS CD C 13 28.908 0.1 A 28 LYS CE C 13 42.224 0.1 A 28 LYS CG C 13 24.859 0.1 A 28 LYS N N 15 121.697 0.1 A 29 SER HA H 1 4.498 0.03 A 29 SER HB3 H 1 3.950 0.03 A 29 SER C C 13 174.741 0.1 A 29 SER CA C 13 58.557 0.1 A 29 SER CB C 13 63.945 0.1 A 30 SER H H 1 8.140 0.03 A 30 SER HA H 1 4.429 0.03 A 30 SER HB3 H 1 3.920 0.03 A 30 SER C C 13 174.467 0.1 A 30 SER CA C 13 58.616 0.1 A 30 SER CB C 13 63.834 0.1 A 30 SER N N 15 116.470 0.1 A 31 ASN H H 1 8.354 0.03 A 31 ASN HA H 1 4.697 0.03 A 31 ASN HB2 H 1 2.814 0.03 A 31 ASN HB3 H 1 2.906 0.03 A 31 ASN HD21 H 1 7.544 0.03 A 31 ASN HD22 H 1 6.890 0.03 A 31 ASN C C 13 174.930 0.1 A 31 ASN CA C 13 53.583 0.1 A 31 ASN CB C 13 38.733 0.1 A 31 ASN N N 15 119.457 0.1 A 31 ASN ND2 N 15 111.691 0.1 A 32 ASN H H 1 8.218 0.03 A 32 ASN HA H 1 4.698 0.03 A 32 ASN HB2 H 1 2.758 0.03 A 32 ASN HB3 H 1 2.865 0.03 A 32 ASN HD21 H 1 7.507 0.03 A 32 ASN HD22 H 1 6.890 0.03 A 32 ASN C C 13 174.979 0.1 A 32 ASN CA C 13 53.580 0.1 A 32 ASN CB C 13 38.810 0.1 A 32 ASN N N 15 118.038 0.1 A 32 ASN ND2 N 15 112.501 0.1 A 33 GLN H H 1 8.337 0.03 A 33 GLN HA H 1 4.353 0.03 A 33 GLN HB2 H 1 1.942 0.03 A 33 GLN HB3 H 1 2.211 0.03 A 33 GLN HE21 H 1 7.419 0.03 A 33 GLN HE22 H 1 6.779 0.03 A 33 GLN HG3 H 1 2.331 0.03 A 33 GLN C C 13 175.735 0.1 A 33 GLN CA C 13 55.883 0.1 A 33 GLN CB C 13 29.131 0.1 A 33 GLN CG C 13 34.015 0.1 A 33 GLN N N 15 119.603 0.1 A 33 GLN NE2 N 15 112.062 0.1 A 34 GLN H H 1 8.087 0.03 A 34 GLN HA H 1 4.278 0.03 A 34 GLN HB2 H 1 1.973 0.03 A 34 GLN HB3 H 1 2.119 0.03 A 34 GLN HE21 H 1 6.804 0.03 A 34 GLN HE22 H 1 7.464 0.03 A 34 GLN HG3 H 1 2.384 0.03 A 34 GLN C C 13 175.170 0.1 A 34 GLN CA C 13 56.102 0.1 A 34 GLN CB C 13 29.870 0.1 A 34 GLN CG C 13 33.975 0.1 A 34 GLN NE2 N 15 112.140 0.1 A 35 ASP H H 1 8.033 0.03 A 35 ASP HA H 1 4.720 0.03 A 35 ASP HB2 H 1 2.231 0.03 A 35 ASP HB3 H 1 2.411 0.03 A 35 ASP C C 13 175.810 0.1 A 35 ASP CA C 13 54.292 0.1 A 35 ASP CB C 13 41.462 0.1 A 36 ILE H H 1 8.421 0.03 A 36 ILE HA H 1 4.064 0.03 A 36 ILE HB H 1 1.820 0.03 A 36 ILE HD1% H 1 0.748 0.03 A 36 ILE HG12 H 1 1.160 0.03 A 36 ILE HG13 H 1 1.340 0.03 A 36 ILE HG2% H 1 0.484 0.03 A 36 ILE C C 13 173.823 0.1 A 36 ILE CA C 13 60.506 0.1 A 36 ILE CB C 13 37.712 0.1 A 36 ILE CD1 C 13 12.363 0.1 A 36 ILE CG1 C 13 27.253 0.1 A 36 ILE CG2 C 13 17.509 0.1 A 36 ILE N N 15 122.378 0.1 A 37 VAL HA H 1 4.507 0.03 A 37 VAL HB H 1 1.862 0.03 A 37 VAL HG1% H 1 0.626 0.03 A 37 VAL HG2% H 1 0.645 0.03 A 37 VAL C C 13 174.956 0.1 A 37 VAL CA C 13 61.535 0.1 A 37 VAL CB C 13 32.932 0.1 A 37 VAL CG1 C 13 20.995 0.1 A 37 VAL CG2 C 13 20.247 0.1 A 38 CYS HA H 1 4.781 0.03 A 38 CYS HB3 H 1 3.434 0.03 A 38 CYS C C 13 172.106 0.1 A 38 CYS CA C 13 55.218 0.1 A 38 CYS CB C 13 49.957 0.1 A 39 THR H H 1 8.229 0.03 A 39 THR HA H 1 4.998 0.03 A 39 THR HB H 1 3.768 0.03 A 39 THR HG2% H 1 0.861 0.03 A 39 THR C C 13 174.687 0.1 A 39 THR CA C 13 61.514 0.1 A 39 THR CB C 13 69.880 0.1 A 39 THR CG2 C 13 21.284 0.1 A 39 THR N N 15 123.385 0.1 A 40 VAL H H 1 8.892 0.03 A 40 VAL HA H 1 4.280 0.03 A 40 VAL HB H 1 1.864 0.03 A 40 VAL HG1% H 1 0.860 0.03 A 40 VAL HG2% H 1 0.921 0.03 A 40 VAL C C 13 173.622 0.1 A 40 VAL CA C 13 60.407 0.1 A 40 VAL CB C 13 34.800 0.1 A 40 VAL CG1 C 13 21.250 0.1 A 40 VAL CG2 C 13 21.540 0.1 A 40 VAL N N 15 125.782 0.1 A 41 LYS HA H 1 4.905 0.03 A 41 LYS HB3 H 1 1.751 0.03 A 41 LYS HD3 H 1 1.301 0.03 A 41 LYS HE3 H 1 2.906 0.03 A 41 LYS HG3 H 1 1.601 0.03 A 41 LYS C C 13 175.624 0.1 A 41 LYS CA C 13 54.247 0.1 A 41 LYS CB C 13 31.902 0.1 A 41 LYS CD C 13 28.734 0.1 A 41 LYS CE C 13 42.146 0.1 A 41 LYS CG C 13 24.622 0.1 A 42 ALA HA H 1 4.307 0.03 A 42 ALA HB% H 1 1.275 0.03 A 42 ALA C C 13 175.028 0.1 A 42 ALA CA C 13 51.544 0.1 A 42 ALA CB C 13 22.233 0.1 A 43 HIS H H 1 8.722 0.03 A 43 HIS HA H 1 4.779 0.03 A 43 HIS HB2 H 1 3.377 0.03 A 43 HIS HB3 H 1 3.377 0.03 A 43 HIS HD2 H 1 7.357 0.03 A 43 HIS HE1 H 1 8.552 0.03 A 43 HIS C C 13 172.767 0.1 A 43 HIS CA C 13 53.601 0.1 A 43 HIS CB C 13 31.299 0.1 A 43 HIS CD2 C 13 119.900 0.1 A 43 HIS CE1 C 13 136.220 0.1 A 44 ALA H H 1 8.468 0.03 A 44 ALA HA H 1 4.040 0.03 A 44 ALA HB% H 1 1.310 0.03 A 44 ALA C C 13 178.087 0.1 A 44 ALA CA C 13 53.862 0.1 A 44 ALA CB C 13 19.024 0.1 A 45 ASN H H 1 7.356 0.03 A 45 ASN HA H 1 4.342 0.03 A 45 ASN HB3 H 1 3.049 0.03 A 45 ASN HD21 H 1 7.414 0.03 A 45 ASN HD22 H 1 7.779 0.03 A 45 ASN C C 13 174.441 0.1 A 45 ASN CA C 13 55.328 0.1 A 45 ASN CB C 13 38.679 0.1 A 45 ASN N N 15 113.483 0.1 A 45 ASN ND2 N 15 113.632 0.1 A 46 ASP H H 1 7.959 0.03 A 46 ASP HA H 1 4.591 0.03 A 46 ASP HB2 H 1 2.500 0.03 A 46 ASP HB3 H 1 2.990 0.03 A 46 ASP C C 13 175.724 0.1 A 46 ASP CA C 13 56.169 0.1 A 46 ASP CB C 13 41.519 0.1 A 46 ASP N N 15 120.941 0.1 A 47 LEU H H 1 8.156 0.03 A 47 LEU HA H 1 4.976 0.03 A 47 LEU HB2 H 1 1.404 0.03 A 47 LEU HB3 H 1 1.897 0.03 A 47 LEU HD1% H 1 0.904 0.03 A 47 LEU HD2% H 1 0.818 0.03 A 47 LEU HG H 1 1.640 0.03 A 47 LEU C C 13 175.735 0.1 A 47 LEU CA C 13 54.691 0.1 A 47 LEU CB C 13 43.566 0.1 A 47 LEU CD1 C 13 23.787 0.1 A 47 LEU CD2 C 13 25.997 0.1 A 47 LEU CG C 13 27.378 0.1 A 47 LEU N N 15 123.735 0.1 A 48 ILE HA H 1 6.271 0.03 A 48 ILE HB H 1 2.110 0.03 A 48 ILE HD1% H 1 0.950 0.03 A 48 ILE HG12 H 1 1.358 0.03 A 48 ILE HG13 H 1 1.071 0.03 A 48 ILE HG2% H 1 1.024 0.03 A 48 ILE C C 13 175.979 0.1 A 48 ILE CA C 13 58.953 0.1 A 48 ILE CB C 13 44.138 0.1 A 48 ILE CD1 C 13 16.087 0.1 A 48 ILE CG1 C 13 25.702 0.1 A 48 ILE CG2 C 13 18.376 0.1 A 49 GLY H H 1 7.900 0.03 A 49 GLY HA2 H 1 4.873 0.03 A 49 GLY HA3 H 1 4.123 0.03 A 49 GLY C C 13 169.506 0.1 A 49 GLY CA C 13 48.190 0.1 A 49 GLY N N 15 102.726 0.1 A 50 PHE H H 1 8.248 0.03 A 50 PHE HA H 1 3.913 0.03 A 50 PHE HB2 H 1 2.383 0.03 A 50 PHE HB3 H 1 2.677 0.03 A 50 PHE HDx H 1 6.193 0.03 A 50 PHE HDy H 1 6.193 0.03 A 50 PHE HEx H 1 6.476 0.03 A 50 PHE HEy H 1 6.476 0.03 A 50 PHE HZ H 1 6.086 0.03 A 50 PHE C C 13 171.823 0.1 A 50 PHE CA C 13 55.727 0.1 A 50 PHE CB C 13 41.029 0.1 A 50 PHE CDx C 13 131.790 0.1 A 50 PHE CDy C 13 131.790 0.1 A 50 PHE CEx C 13 130.558 0.1 A 50 PHE CEy C 13 130.558 0.1 A 50 PHE CZ C 13 128.876 0.1 A 50 PHE N N 15 111.884 0.1 A 51 LYS H H 1 7.857 0.03 A 51 LYS HA H 1 5.384 0.03 A 51 LYS HB3 H 1 1.693 0.03 A 51 LYS HD2 H 1 1.508 0.03 A 51 LYS HD3 H 1 1.078 0.03 A 51 LYS HE3 H 1 2.997 0.03 A 51 LYS HG3 H 1 1.835 0.03 A 51 LYS C C 13 176.140 0.1 A 51 LYS CA C 13 54.421 0.1 A 51 LYS CB C 13 37.920 0.1 A 51 LYS CD C 13 30.335 0.1 A 51 LYS CE C 13 42.562 0.1 A 51 LYS CG C 13 24.872 0.1 A 51 LYS N N 15 117.924 0.1 A 52 CYS HA H 1 5.021 0.03 A 52 CYS HB2 H 1 3.078 0.03 A 52 CYS HB3 H 1 2.756 0.03 A 52 CYS CA C 13 52.191 0.1 A 52 CYS CB C 13 41.187 0.1 A 53 PRO HA H 1 4.377 0.03 A 53 PRO HB2 H 1 1.833 0.03 A 53 PRO HB3 H 1 2.438 0.03 A 53 PRO HD2 H 1 3.164 0.03 A 53 PRO HD3 H 1 2.310 0.03 A 53 PRO HG2 H 1 1.566 0.03 A 53 PRO HG3 H 1 1.067 0.03 A 53 PRO C C 13 177.624 0.1 A 53 PRO CA C 13 62.570 0.1 A 53 PRO CB C 13 31.256 0.1 A 53 PRO CD C 13 50.413 0.1 A 53 PRO CG C 13 27.648 0.1 A 54 SER HA H 1 4.106 0.03 A 54 SER HB2 H 1 3.966 0.03 A 54 SER C C 13 174.271 0.1 A 54 SER CA C 13 61.221 0.1 A 54 SER CB C 13 63.243 0.1 A 55 ASN H H 1 8.712 0.03 A 55 ASN HA H 1 4.673 0.03 A 55 ASN HB3 H 1 3.171 0.03 A 55 ASN HD21 H 1 7.574 0.03 A 55 ASN HD22 H 1 6.943 0.03 A 55 ASN C C 13 174.556 0.1 A 55 ASN CA C 13 53.864 0.1 A 55 ASN CB C 13 36.924 0.1 A 55 ASN N N 15 115.116 0.1 A 55 ASN ND2 N 15 111.332 0.1 A 56 TYR H H 1 7.637 0.03 A 56 TYR HA H 1 4.692 0.03 A 56 TYR HB2 H 1 2.627 0.03 A 56 TYR HB3 H 1 3.096 0.03 A 56 TYR HDx H 1 6.835 0.03 A 56 TYR HDy H 1 6.835 0.03 A 56 TYR HEx H 1 6.655 0.03 A 56 TYR HEy H 1 6.655 0.03 A 56 TYR C C 13 176.019 0.1 A 56 TYR CA C 13 57.469 0.1 A 56 TYR CB C 13 38.698 0.1 A 56 TYR CDx C 13 132.090 0.1 A 56 TYR CDy C 13 132.090 0.1 A 56 TYR CEx C 13 118.160 0.1 A 56 TYR CEy C 13 118.160 0.1 A 56 TYR N N 15 120.489 0.1 A 57 SER H H 1 9.323 0.03 A 57 SER HA H 1 4.915 0.03 A 57 SER HB2 H 1 3.865 0.03 A 57 SER HB3 H 1 3.897 0.03 A 57 SER C C 13 173.649 0.1 A 57 SER CA C 13 57.586 0.1 A 57 SER CB C 13 64.766 0.1 A 57 SER N N 15 117.381 0.1 A 58 VAL H H 1 8.474 0.03 A 58 VAL HA H 1 4.812 0.03 A 58 VAL HB H 1 1.850 0.03 A 58 VAL HG1% H 1 0.923 0.03 A 58 VAL HG2% H 1 0.575 0.03 A 58 VAL C C 13 174.911 0.1 A 58 VAL CA C 13 61.889 0.1 A 58 VAL CB C 13 33.185 0.1 A 58 VAL CG1 C 13 21.939 0.1 A 58 VAL CG2 C 13 20.114 0.1 A 58 VAL N N 15 125.696 0.1 A 59 GLU HA H 1 4.660 0.03 A 59 GLU HB2 H 1 2.134 0.03 A 59 GLU HB3 H 1 1.972 0.03 A 59 GLU HG3 H 1 2.236 0.03 A 59 GLU CA C 13 52.599 0.1 A 59 GLU CB C 13 32.910 0.1 A 59 GLU CG C 13 35.260 0.1 A 60 PRO HA H 1 4.700 0.03 A 60 PRO HB2 H 1 1.792 0.03 A 60 PRO HB3 H 1 2.099 0.03 A 60 PRO HD2 H 1 3.616 0.03 A 60 PRO HD3 H 1 2.673 0.03 A 60 PRO HG2 H 1 0.890 0.03 A 60 PRO HG3 H 1 1.099 0.03 A 60 PRO C C 13 176.708 0.1 A 60 PRO CA C 13 62.731 0.1 A 60 PRO CB C 13 34.006 0.1 A 60 PRO CD C 13 49.568 0.1 A 60 PRO CG C 13 25.456 0.1 A 61 HIS HA H 1 4.363 0.03 A 61 HIS HB2 H 1 3.378 0.03 A 61 HIS HB3 H 1 3.378 0.03 A 61 HIS HD2 H 1 7.376 0.03 A 61 HIS HE1 H 1 8.314 0.03 A 61 HIS C C 13 174.320 0.1 A 61 HIS CA C 13 58.473 0.1 A 61 HIS CB C 13 28.515 0.1 A 61 HIS CD2 C 13 120.370 0.1 A 61 HIS CE1 C 13 136.400 0.1 A 62 ASP HA H 1 5.043 0.03 A 62 ASP HB2 H 1 2.298 0.03 A 62 ASP HB3 H 1 2.810 0.03 A 62 ASP CA C 13 51.338 0.1 A 62 ASP CB C 13 38.510 0.1 A 63 CYS H H 1 6.446 0.03 A 63 CYS HA H 1 4.223 0.03 A 63 CYS HB2 H 1 2.197 0.03 A 63 CYS HB3 H 1 2.608 0.03 A 63 CYS C C 13 171.976 0.1 A 63 CYS CA C 13 59.504 0.1 A 63 CYS CB C 13 41.081 0.1 A 63 CYS N N 15 120.346 0.1 A 64 PHE H H 1 7.697 0.03 A 64 PHE HA H 1 4.220 0.03 A 64 PHE HB2 H 1 2.606 0.03 A 64 PHE HB3 H 1 2.197 0.03 A 64 PHE HDx H 1 6.558 0.03 A 64 PHE HDy H 1 6.558 0.03 A 64 PHE HEx H 1 7.280 0.03 A 64 PHE HEy H 1 7.280 0.03 A 64 PHE HZ H 1 7.050 0.03 A 64 PHE C C 13 177.110 0.1 A 64 PHE CA C 13 59.591 0.1 A 64 PHE CB C 13 41.149 0.1 A 64 PHE CDx C 13 132.150 0.1 A 64 PHE CDy C 13 132.150 0.1 A 64 PHE CEx C 13 130.600 0.1 A 64 PHE CEy C 13 130.600 0.1 A 64 PHE CZ C 13 128.800 0.1 A 64 PHE N N 15 116.155 0.1 A 65 VAL H H 1 8.449 0.03 A 65 VAL HA H 1 3.965 0.03 A 65 VAL HB H 1 2.483 0.03 A 65 VAL HG1% H 1 1.087 0.03 A 65 VAL HG2% H 1 0.999 0.03 A 65 VAL C C 13 176.948 0.1 A 65 VAL CA C 13 66.963 0.1 A 65 VAL CB C 13 31.084 0.1 A 65 VAL CG1 C 13 22.675 0.1 A 65 VAL CG2 C 13 21.600 0.1 A 65 VAL N N 15 119.794 0.1 A 66 SER H H 1 7.706 0.03 A 66 SER HA H 1 5.041 0.03 A 66 SER HB2 H 1 3.698 0.03 A 66 SER HB3 H 1 3.532 0.03 A 66 SER C C 13 173.905 0.1 A 66 SER CA C 13 56.701 0.1 A 66 SER CB C 13 65.738 0.1 A 66 SER N N 15 113.648 0.1 A 67 ALA H H 1 9.280 0.03 A 67 ALA HA H 1 4.044 0.03 A 67 ALA HB% H 1 1.321 0.03 A 67 ALA C C 13 175.316 0.1 A 67 ALA CA C 13 52.122 0.1 A 67 ALA CB C 13 23.827 0.1 A 67 ALA N N 15 115.370 0.1 A 68 PHE H H 1 8.520 0.03 A 68 PHE HA H 1 4.999 0.03 A 68 PHE HB2 H 1 1.187 0.03 A 68 PHE HB3 H 1 2.241 0.03 A 68 PHE HDx H 1 6.744 0.03 A 68 PHE HDy H 1 6.744 0.03 A 68 PHE HEx H 1 7.133 0.03 A 68 PHE HEy H 1 7.133 0.03 A 68 PHE HZ H 1 7.185 0.03 A 68 PHE C C 13 176.533 0.1 A 68 PHE CA C 13 57.538 0.1 A 68 PHE CB C 13 38.964 0.1 A 68 PHE CDx C 13 131.710 0.1 A 68 PHE CDy C 13 131.710 0.1 A 68 PHE CEx C 13 131.230 0.1 A 68 PHE CEy C 13 131.230 0.1 A 68 PHE CZ C 13 129.210 0.1 A 68 PHE N N 15 116.820 0.1 A 69 ASN H H 1 8.498 0.03 A 69 ASN HA H 1 5.042 0.03 A 69 ASN HB2 H 1 3.630 0.03 A 69 ASN HB3 H 1 3.036 0.03 A 69 ASN HD21 H 1 7.893 0.03 A 69 ASN HD22 H 1 6.870 0.03 A 69 ASN C C 13 176.820 0.1 A 69 ASN CA C 13 51.036 0.1 A 69 ASN CB C 13 39.494 0.1 A 69 ASN N N 15 118.203 0.1 A 69 ASN ND2 N 15 112.250 0.1 A 70 LEU H H 1 8.514 0.03 A 70 LEU HA H 1 4.279 0.03 A 70 LEU HB3 H 1 1.765 0.03 A 70 LEU HD1% H 1 0.945 0.03 A 70 LEU HD2% H 1 0.909 0.03 A 70 LEU HG H 1 1.812 0.03 A 70 LEU C C 13 178.484 0.1 A 70 LEU CA C 13 57.764 0.1 A 70 LEU CB C 13 41.638 0.1 A 70 LEU CD1 C 13 25.003 0.1 A 70 LEU CD2 C 13 23.842 0.1 A 70 LEU CG C 13 27.450 0.1 A 70 LEU N N 15 118.189 0.1 A 71 SER H H 1 8.049 0.03 A 71 SER HA H 1 4.572 0.03 A 71 SER HB3 H 1 4.001 0.03 A 71 SER C C 13 174.682 0.1 A 71 SER CA C 13 58.758 0.1 A 71 SER CB C 13 63.762 0.1 A 71 SER N N 15 113.939 0.1 A 72 GLY H H 1 8.641 0.03 A 72 GLY HA2 H 1 3.570 0.03 A 72 GLY HA3 H 1 4.200 0.03 A 72 GLY C C 13 173.549 0.1 A 72 GLY CA C 13 45.638 0.1 A 72 GLY N N 15 109.936 0.1 A 73 LYS H H 1 7.738 0.03 A 73 LYS HA H 1 4.553 0.03 A 73 LYS HB2 H 1 1.717 0.03 A 73 LYS HB3 H 1 1.868 0.03 A 73 LYS HD2 H 1 1.355 0.03 A 73 LYS HD3 H 1 1.449 0.03 A 73 LYS HE3 H 1 3.017 0.03 A 73 LYS HG3 H 1 1.672 0.03 A 73 LYS C C 13 175.750 0.1 A 73 LYS CA C 13 54.658 0.1 A 73 LYS CB C 13 33.741 0.1 A 73 LYS CD C 13 28.680 0.1 A 73 LYS CE C 13 42.447 0.1 A 73 LYS CG C 13 24.852 0.1 A 73 LYS N N 15 119.884 0.1 A 74 ASN HA H 1 4.520 0.03 A 74 ASN HB2 H 1 2.491 0.03 A 74 ASN HB3 H 1 2.629 0.03 A 74 ASN HD21 H 1 7.007 0.03 A 74 ASN HD22 H 1 6.738 0.03 A 74 ASN C C 13 174.680 0.1 A 74 ASN CA C 13 54.232 0.1 A 74 ASN CB C 13 39.327 0.1 A 74 ASN ND2 N 15 109.880 0.1 A 75 GLU H H 1 8.835 0.03 A 75 GLU HA H 1 4.598 0.03 A 75 GLU HB3 H 1 1.901 0.03 A 75 GLU HG3 H 1 2.202 0.03 A 75 GLU C C 13 174.547 0.1 A 75 GLU CA C 13 54.887 0.1 A 75 GLU CB C 13 32.908 0.1 A 75 GLU CG C 13 35.318 0.1 A 75 GLU N N 15 124.834 0.1 A 76 ASN H H 1 8.580 0.03 A 76 ASN HA H 1 4.675 0.03 A 76 ASN HB3 H 1 2.755 0.03 A 76 ASN HD21 H 1 7.033 0.03 A 76 ASN HD22 H 1 7.550 0.03 A 76 ASN C C 13 175.670 0.1 A 76 ASN CA C 13 54.120 0.1 A 76 ASN CB C 13 39.042 0.1 A 76 ASN N N 15 121.549 0.1 A 76 ASN ND2 N 15 112.411 0.1 A 77 LEU H H 1 8.610 0.03 A 77 LEU HA H 1 4.107 0.03 A 77 LEU HB2 H 1 1.321 0.03 A 77 LEU HB3 H 1 1.398 0.03 A 77 LEU HD1% H 1 0.172 0.03 A 77 LEU HD2% H 1 0.136 0.03 A 77 LEU HG H 1 1.164 0.03 A 77 LEU C C 13 178.104 0.1 A 77 LEU CA C 13 55.991 0.1 A 77 LEU CB C 13 42.384 0.1 A 77 LEU CD1 C 13 22.675 0.1 A 77 LEU CD2 C 13 24.212 0.1 A 77 LEU CG C 13 26.263 0.1 A 77 LEU N N 15 125.808 0.1 A 78 GLU HA H 1 4.016 0.03 A 78 GLU HB2 H 1 2.097 0.03 A 78 GLU HB3 H 1 2.184 0.03 A 78 GLU HG3 H 1 2.281 0.03 A 78 GLU C C 13 176.833 0.1 A 78 GLU CA C 13 59.650 0.1 A 78 GLU CB C 13 29.684 0.1 A 78 GLU CG C 13 35.603 0.1 A 79 ASN H H 1 8.257 0.03 A 79 ASN HA H 1 4.564 0.03 A 79 ASN HB3 H 1 2.785 0.03 A 79 ASN C C 13 175.510 0.1 A 79 ASN CA C 13 54.392 0.1 A 79 ASN CB C 13 38.718 0.1 A 79 ASN N N 15 114.719 0.1 A 80 LYS H H 1 7.818 0.03 A 80 LYS HA H 1 4.293 0.03 A 80 LYS HB3 H 1 1.655 0.03 A 80 LYS HD2 H 1 1.380 0.03 A 80 LYS HD3 H 1 1.290 0.03 A 80 LYS HE3 H 1 2.960 0.03 A 80 LYS HG3 H 1 1.630 0.03 A 80 LYS C C 13 175.748 0.1 A 80 LYS CA C 13 57.765 0.1 A 80 LYS CB C 13 34.345 0.1 A 80 LYS CD C 13 28.927 0.1 A 80 LYS CE C 13 42.086 0.1 A 80 LYS CG C 13 24.761 0.1 A 80 LYS N N 15 118.906 0.1 A 81 LEU HA H 1 4.150 0.03 A 81 LEU HB2 H 1 0.826 0.03 A 81 LEU HB3 H 1 1.199 0.03 A 81 LEU HD1% H 1 0.224 0.03 A 81 LEU HD2% H 1 0.189 0.03 A 81 LEU C C 13 174.688 0.1 A 81 LEU CA C 13 54.522 0.1 A 81 LEU CB C 13 43.063 0.1 A 81 LEU CD1 C 13 24.000 0.1 A 81 LEU CD2 C 13 24.300 0.1 A 82 LYS HA H 1 4.169 0.03 A 82 LYS HB3 H 1 1.837 0.03 A 82 LYS HD3 H 1 1.320 0.03 A 82 LYS HE3 H 1 3.005 0.03 A 82 LYS HG3 H 1 1.682 0.03 A 82 LYS C C 13 175.701 0.1 A 82 LYS CA C 13 56.168 0.1 A 82 LYS CB C 13 30.017 0.1 A 82 LYS CD C 13 28.879 0.1 A 82 LYS CE C 13 42.515 0.1 A 82 LYS CG C 13 24.766 0.1 A 83 LEU H H 1 7.485 0.03 A 83 LEU HA H 1 4.420 0.03 A 83 LEU HB2 H 1 1.296 0.03 A 83 LEU HB3 H 1 1.667 0.03 A 83 LEU HD1% H 1 0.785 0.03 A 83 LEU HD2% H 1 0.870 0.03 A 83 LEU HG H 1 1.486 0.03 A 83 LEU C C 13 177.184 0.1 A 83 LEU CA C 13 55.219 0.1 A 83 LEU CB C 13 42.311 0.1 A 83 LEU CD1 C 13 24.060 0.1 A 83 LEU CD2 C 13 25.480 0.1 A 83 LEU CG C 13 27.280 0.1 A 83 LEU N N 15 120.762 0.1 A 84 THR H H 1 8.519 0.03 A 84 THR HA H 1 4.712 0.03 A 84 THR HB H 1 4.251 0.03 A 84 THR HG2% H 1 1.136 0.03 A 84 THR C C 13 173.001 0.1 A 84 THR CA C 13 59.883 0.1 A 84 THR CB C 13 71.825 0.1 A 84 THR CG2 C 13 21.093 0.1 A 84 THR N N 15 110.955 0.1 A 85 ASN H H 1 8.850 0.03 A 85 ASN HA H 1 4.146 0.03 A 85 ASN HB2 H 1 2.456 0.03 A 85 ASN HB3 H 1 2.984 0.03 A 85 ASN HD21 H 1 7.400 0.03 A 85 ASN HD22 H 1 6.919 0.03 A 85 ASN C C 13 173.572 0.1 A 85 ASN CA C 13 54.319 0.1 A 85 ASN CB C 13 38.908 0.1 A 85 ASN N N 15 117.589 0.1 A 85 ASN ND2 N 15 111.340 0.1 A 86 ILE HA H 1 4.292 0.03 A 86 ILE HB H 1 1.680 0.03 A 86 ILE HD1% H 1 0.754 0.03 A 86 ILE HG12 H 1 0.693 0.03 A 86 ILE HG13 H 1 1.325 0.03 A 86 ILE HG2% H 1 1.032 0.03 A 86 ILE C C 13 177.346 0.1 A 86 ILE CA C 13 62.807 0.1 A 86 ILE CB C 13 38.699 0.1 A 86 ILE CD1 C 13 14.160 0.1 A 86 ILE CG1 C 13 28.520 0.1 A 86 ILE CG2 C 13 18.316 0.1 A 87 ILE H H 1 9.166 0.03 A 87 ILE HA H 1 4.255 0.03 A 87 ILE HB H 1 1.907 0.03 A 87 ILE HD1% H 1 0.684 0.03 A 87 ILE HG12 H 1 1.065 0.03 A 87 ILE HG13 H 1 1.450 0.03 A 87 ILE HG2% H 1 0.886 0.03 A 87 ILE C C 13 174.493 0.1 A 87 ILE CA C 13 60.152 0.1 A 87 ILE CB C 13 41.110 0.1 A 87 ILE CD1 C 13 12.244 0.1 A 87 ILE CG1 C 13 26.613 0.1 A 87 ILE CG2 C 13 16.634 0.1 A 87 ILE N N 15 131.807 0.1 A 88 MET HA H 1 4.017 0.03 A 88 MET HB2 H 1 1.231 0.03 A 88 MET HB3 H 1 1.998 0.03 A 88 MET HE% H 1 2.082 0.03 A 88 MET HG2 H 1 2.358 0.03 A 88 MET HG3 H 1 2.692 0.03 A 88 MET C C 13 173.613 0.1 A 88 MET CA C 13 53.287 0.1 A 88 MET CB C 13 33.478 0.1 A 88 MET CE C 13 17.362 0.1 A 88 MET CG C 13 30.968 0.1 A 89 ASP HA H 1 4.697 0.03 A 89 ASP HB2 H 1 2.335 0.03 A 89 ASP HB3 H 1 2.335 0.03 A 89 ASP C C 13 176.750 0.1 A 89 ASP CA C 13 52.101 0.1 A 89 ASP CB C 13 40.191 0.1 A 90 HIS HA H 1 4.441 0.03 A 90 HIS HB2 H 1 3.094 0.03 A 90 HIS HB3 H 1 3.094 0.03 A 90 HIS HD2 H 1 7.421 0.03 A 90 HIS HE1 H 1 8.655 0.03 A 90 HIS C C 13 175.625 0.1 A 90 HIS CA C 13 58.254 0.1 A 90 HIS CB C 13 28.579 0.1 A 90 HIS CD2 C 13 120.160 0.1 A 90 HIS CE1 C 13 137.230 0.1 A 91 TYR HA H 1 4.440 0.03 A 91 TYR HB2 H 1 3.169 0.03 A 91 TYR HB3 H 1 3.119 0.03 A 91 TYR HDx H 1 7.202 0.03 A 91 TYR HDy H 1 7.202 0.03 A 91 TYR HEx H 1 6.892 0.03 A 91 TYR HEy H 1 6.892 0.03 A 91 TYR C C 13 177.915 0.1 A 91 TYR CA C 13 60.760 0.1 A 91 TYR CB C 13 38.067 0.1 A 91 TYR CDx C 13 133.180 0.1 A 91 TYR CDy C 13 133.180 0.1 A 91 TYR CEx C 13 118.410 0.1 A 91 TYR CEy C 13 118.410 0.1 A 92 ASN H H 1 7.713 0.03 A 92 ASN HA H 1 4.773 0.03 A 92 ASN HB2 H 1 2.459 0.03 A 92 ASN HB3 H 1 2.774 0.03 A 92 ASN HD21 H 1 8.810 0.03 A 92 ASN HD22 H 1 7.022 0.03 A 92 ASN C C 13 174.762 0.1 A 92 ASN CA C 13 52.615 0.1 A 92 ASN CB C 13 39.282 0.1 A 92 ASN N N 15 113.661 0.1 A 92 ASN ND2 N 15 117.422 0.1 A 93 ASN H H 1 7.804 0.03 A 93 ASN HA H 1 4.709 0.03 A 93 ASN HB2 H 1 2.482 0.03 A 93 ASN HB3 H 1 3.376 0.03 A 93 ASN HD21 H 1 6.772 0.03 A 93 ASN C C 13 172.729 0.1 A 93 ASN CA C 13 52.735 0.1 A 93 ASN CB C 13 37.961 0.1 A 93 ASN N N 15 125.176 0.1 A 93 ASN ND2 N 15 107.620 0.1 A 94 THR H H 1 7.654 0.03 A 94 THR HA H 1 4.852 0.03 A 94 THR HB H 1 3.639 0.03 A 94 THR HG2% H 1 1.008 0.03 A 94 THR C C 13 170.824 0.1 A 94 THR CA C 13 61.817 0.1 A 94 THR CB C 13 71.074 0.1 A 94 THR CG2 C 13 20.902 0.1 A 94 THR N N 15 109.900 0.1 A 95 PHE H H 1 8.166 0.03 A 95 PHE HA H 1 5.108 0.03 A 95 PHE HB2 H 1 1.571 0.03 A 95 PHE HB3 H 1 2.526 0.03 A 95 PHE HDx H 1 6.563 0.03 A 95 PHE HDy H 1 6.563 0.03 A 95 PHE HEx H 1 6.738 0.03 A 95 PHE HEy H 1 6.738 0.03 A 95 PHE HZ H 1 6.883 0.03 A 95 PHE C C 13 174.143 0.1 A 95 PHE CA C 13 55.569 0.1 A 95 PHE CB C 13 42.793 0.1 A 95 PHE CDx C 13 132.250 0.1 A 95 PHE CDy C 13 132.250 0.1 A 95 PHE CEx C 13 130.100 0.1 A 95 PHE CEy C 13 130.100 0.1 A 95 PHE CZ C 13 128.540 0.1 A 95 PHE N N 15 126.721 0.1 A 96 TYR H H 1 9.149 0.03 A 96 TYR HA H 1 6.067 0.03 A 96 TYR HB2 H 1 2.721 0.03 A 96 TYR HB3 H 1 3.193 0.03 A 96 TYR HDx H 1 6.970 0.03 A 96 TYR HDy H 1 6.970 0.03 A 96 TYR HEx H 1 6.543 0.03 A 96 TYR HEy H 1 6.543 0.03 A 96 TYR C C 13 175.734 0.1 A 96 TYR CA C 13 56.432 0.1 A 96 TYR CB C 13 44.167 0.1 A 96 TYR CDx C 13 132.830 0.1 A 96 TYR CDy C 13 132.830 0.1 A 96 TYR CEx C 13 118.340 0.1 A 96 TYR CEy C 13 118.340 0.1 A 96 TYR N N 15 115.709 0.1 A 97 SER H H 1 8.921 0.03 A 97 SER HA H 1 4.430 0.03 A 97 SER HB2 H 1 3.350 0.03 A 97 SER HB3 H 1 3.280 0.03 A 97 SER C C 13 170.684 0.1 A 97 SER CA C 13 59.324 0.1 A 97 SER CB C 13 66.341 0.1 A 97 SER N N 15 109.503 0.1 A 98 ARG HA H 1 5.394 0.03 A 98 ARG HB2 H 1 1.406 0.03 A 98 ARG HB3 H 1 1.706 0.03 A 98 ARG HD2 H 1 3.196 0.03 A 98 ARG HD3 H 1 2.913 0.03 A 98 ARG HE H 1 7.099 0.03 A 98 ARG HG2 H 1 1.627 0.03 A 98 ARG HG3 H 1 1.348 0.03 A 98 ARG C C 13 175.850 0.1 A 98 ARG CA C 13 54.176 0.1 A 98 ARG CB C 13 33.127 0.1 A 98 ARG CD C 13 43.547 0.1 A 98 ARG CG C 13 27.425 0.1 A 98 ARG NE N 15 83.380 0.1 A 99 LEU HA H 1 4.330 0.03 A 99 LEU HB2 H 1 1.642 0.03 A 99 LEU HB3 H 1 2.107 0.03 A 99 LEU HD1% H 1 0.968 0.03 A 99 LEU HD2% H 1 0.785 0.03 A 99 LEU HG H 1 1.890 0.03 A 99 LEU CA C 13 53.806 0.1 A 99 LEU CB C 13 40.903 0.1 A 99 LEU CD1 C 13 24.860 0.1 A 99 LEU CD2 C 13 24.090 0.1 A 99 LEU CG C 13 29.450 0.1 A 100 PRO HA H 1 4.676 0.03 A 100 PRO HB2 H 1 2.230 0.03 A 100 PRO HB3 H 1 2.497 0.03 A 100 PRO HD2 H 1 3.515 0.03 A 100 PRO HD3 H 1 3.371 0.03 A 100 PRO HG2 H 1 1.906 0.03 A 100 PRO HG3 H 1 2.190 0.03 A 100 PRO C C 13 175.744 0.1 A 100 PRO CA C 13 62.289 0.1 A 100 PRO CB C 13 32.786 0.1 A 100 PRO CD C 13 49.984 0.1 A 100 PRO CG C 13 26.956 0.1 A 101 SER HA H 1 4.126 0.03 A 101 SER HB3 H 1 3.967 0.03 A 101 SER C C 13 173.214 0.1 A 101 SER CA C 13 60.265 0.1 A 101 SER CB C 13 63.660 0.1 A 102 LEU H H 1 7.179 0.03 A 102 LEU HA H 1 4.532 0.03 A 102 LEU HB2 H 1 1.564 0.03 A 102 LEU HB3 H 1 1.510 0.03 A 102 LEU HD1% H 1 0.901 0.03 A 102 LEU HD2% H 1 0.864 0.03 A 102 LEU HG H 1 1.446 0.03 A 102 LEU C C 13 175.187 0.1 A 102 LEU CA C 13 54.686 0.1 A 102 LEU CB C 13 44.380 0.1 A 102 LEU CD1 C 13 24.130 0.1 A 102 LEU CD2 C 13 24.620 0.1 A 102 LEU CG C 13 27.156 0.1 A 102 LEU N N 15 121.389 0.1 A 103 ILE HA H 1 4.443 0.03 A 103 ILE HB H 1 1.990 0.03 A 103 ILE HD1% H 1 0.843 0.03 A 103 ILE HG12 H 1 1.456 0.03 A 103 ILE HG13 H 1 1.103 0.03 A 103 ILE HG2% H 1 0.999 0.03 A 103 ILE C C 13 175.490 0.1 A 103 ILE CA C 13 59.909 0.1 A 103 ILE CB C 13 39.678 0.1 A 103 ILE CD1 C 13 13.400 0.1 A 103 ILE CG1 C 13 26.780 0.1 A 103 ILE CG2 C 13 18.260 0.1 A 104 SER H H 1 8.471 0.03 A 104 SER HA H 1 4.581 0.03 A 104 SER HB2 H 1 3.945 0.03 A 104 SER HB3 H 1 3.876 0.03 A 104 SER C C 13 173.234 0.1 A 104 SER CA C 13 58.166 0.1 A 104 SER CB C 13 64.341 0.1 A 104 SER N N 15 120.807 0.1 A 105 ASP H H 1 8.060 0.03 A 105 ASP HA H 1 4.649 0.03 A 105 ASP HB3 H 1 2.612 0.03 A 105 ASP C C 13 174.991 0.1 A 105 ASP CA C 13 53.734 0.1 A 105 ASP CB C 13 42.477 0.1 A 105 ASP N N 15 119.103 0.1 A 106 ASN H H 1 8.389 0.03 A 106 ASN HA H 1 4.735 0.03 A 106 ASN HB2 H 1 2.643 0.03 A 106 ASN HB3 H 1 2.884 0.03 A 106 ASN HD21 H 1 7.779 0.03 A 106 ASN HD22 H 1 6.811 0.03 A 106 ASN C C 13 174.308 0.1 A 106 ASN CA C 13 53.780 0.1 A 106 ASN CB C 13 39.022 0.1 A 106 ASN N N 15 116.036 0.1 A 106 ASN ND2 N 15 112.711 0.1 A 107 TRP H H 1 7.846 0.03 A 107 TRP HA H 1 4.829 0.03 A 107 TRP HB2 H 1 3.195 0.03 A 107 TRP HB3 H 1 3.321 0.03 A 107 TRP HD1 H 1 7.045 0.03 A 107 TRP HE1 H 1 9.843 0.03 A 107 TRP HE3 H 1 7.451 0.03 A 107 TRP HH2 H 1 6.946 0.03 A 107 TRP HZ2 H 1 7.285 0.03 A 107 TRP HZ3 H 1 6.903 0.03 A 107 TRP C C 13 174.949 0.1 A 107 TRP CA C 13 56.192 0.1 A 107 TRP CB C 13 32.213 0.1 A 107 TRP CD1 C 13 127.970 0.1 A 107 TRP CE3 C 13 121.100 0.1 A 107 TRP CH2 C 13 123.730 0.1 A 107 TRP CZ2 C 13 114.300 0.1 A 107 TRP CZ3 C 13 121.400 0.1 A 107 TRP N N 15 119.645 0.1 A 107 TRP NE1 N 15 129.109 0.1 A 108 LYS HA H 1 5.462 0.03 A 108 LYS HB2 H 1 1.812 0.03 A 108 LYS HB3 H 1 1.743 0.03 A 108 LYS HD2 H 1 1.390 0.03 A 108 LYS HD3 H 1 1.231 0.03 A 108 LYS HG3 H 1 1.620 0.03 A 108 LYS C C 13 174.986 0.1 A 108 LYS CA C 13 56.196 0.1 A 108 LYS CB C 13 36.215 0.1 A 108 LYS CD C 13 30.081 0.1 A 108 LYS CE C 13 42.241 0.1 A 108 LYS CG C 13 25.306 0.1 A 109 PHE HA H 1 5.545 0.03 A 109 PHE HB3 H 1 3.049 0.03 A 109 PHE HDx H 1 6.922 0.03 A 109 PHE HDy H 1 6.922 0.03 A 109 PHE HEx H 1 7.040 0.03 A 109 PHE HEy H 1 7.040 0.03 A 109 PHE HZ H 1 7.140 0.03 A 109 PHE C C 13 172.950 0.1 A 109 PHE CA C 13 56.420 0.1 A 109 PHE CB C 13 41.891 0.1 A 109 PHE CDx C 13 132.900 0.1 A 109 PHE CDy C 13 132.900 0.1 A 109 PHE CEx C 13 130.496 0.1 A 109 PHE CEy C 13 130.496 0.1 A 109 PHE CZ C 13 128.210 0.1 A 110 PHE H H 1 9.267 0.03 A 110 PHE HA H 1 6.032 0.03 A 110 PHE HB2 H 1 2.936 0.03 A 110 PHE HB3 H 1 3.113 0.03 A 110 PHE HDx H 1 6.829 0.03 A 110 PHE HDy H 1 6.829 0.03 A 110 PHE HEx H 1 7.056 0.03 A 110 PHE HEy H 1 7.056 0.03 A 110 PHE HZ H 1 6.966 0.03 A 110 PHE C C 13 173.892 0.1 A 110 PHE CA C 13 56.232 0.1 A 110 PHE CB C 13 43.366 0.1 A 110 PHE CDx C 13 132.130 0.1 A 110 PHE CDy C 13 132.130 0.1 A 110 PHE CEx C 13 132.200 0.1 A 110 PHE CEy C 13 132.200 0.1 A 110 PHE CZ C 13 129.550 0.1 A 110 PHE N N 15 115.390 0.1 A 111 CYS H H 1 9.274 0.03 A 111 CYS HA H 1 5.061 0.03 A 111 CYS HB2 H 1 2.597 0.03 A 111 CYS HB3 H 1 3.364 0.03 A 111 CYS C C 13 171.900 0.1 A 111 CYS CA C 13 53.852 0.1 A 111 CYS CB C 13 47.830 0.1 A 111 CYS N N 15 116.463 0.1 A 112 VAL H H 1 9.605 0.03 A 112 VAL HA H 1 5.202 0.03 A 112 VAL HB H 1 2.046 0.03 A 112 VAL HG1% H 1 1.053 0.03 A 112 VAL HG2% H 1 0.925 0.03 A 112 VAL C C 13 175.041 0.1 A 112 VAL CA C 13 60.443 0.1 A 112 VAL CB C 13 36.577 0.1 A 112 VAL CG1 C 13 21.952 0.1 A 112 VAL CG2 C 13 22.020 0.1 A 113 CYS HA H 1 5.760 0.03 A 113 CYS HB2 H 1 3.050 0.03 A 113 CYS HB3 H 1 3.331 0.03 A 113 CYS C C 13 173.601 0.1 A 113 CYS CA C 13 52.821 0.1 A 113 CYS CB C 13 43.946 0.1 A 114 SER H H 1 9.250 0.03 A 114 SER HA H 1 5.093 0.03 A 114 SER HB2 H 1 3.588 0.03 A 114 SER HB3 H 1 3.658 0.03 A 114 SER C C 13 172.267 0.1 A 114 SER CA C 13 56.677 0.1 A 114 SER CB C 13 66.795 0.1 A 114 SER N N 15 117.968 0.1 A 115 LYS H H 1 8.705 0.03 A 115 LYS HA H 1 4.106 0.03 A 115 LYS HB2 H 1 0.439 0.03 A 115 LYS HB3 H 1 0.502 0.03 A 115 LYS HD3 H 1 1.066 0.03 A 115 LYS HE3 H 1 2.930 0.03 A 115 LYS HG2 H 1 1.239 0.03 A 115 LYS HG3 H 1 1.320 0.03 A 115 LYS C C 13 174.527 0.1 A 115 LYS CA C 13 55.922 0.1 A 115 LYS CB C 13 34.009 0.1 A 115 LYS CD C 13 29.635 0.1 A 115 LYS CE C 13 42.457 0.1 A 115 LYS CG C 13 24.527 0.1 A 116 ASP HA H 1 4.191 0.03 A 116 ASP HB3 H 1 2.554 0.03 A 116 ASP C C 13 176.002 0.1 A 116 ASP CA C 13 56.314 0.1 A 116 ASP CB C 13 40.447 0.1 A 117 ASN H H 1 8.752 0.03 A 117 ASN HA H 1 4.439 0.03 A 117 ASN HB2 H 1 2.983 0.03 A 117 ASN HB3 H 1 2.879 0.03 A 117 ASN HD21 H 1 7.492 0.03 A 117 ASN HD22 H 1 6.841 0.03 A 117 ASN C C 13 174.246 0.1 A 117 ASN CA C 13 54.433 0.1 A 117 ASN CB C 13 38.182 0.1 A 117 ASN N N 15 116.913 0.1 A 117 ASN ND2 N 15 113.200 0.1 A 118 GLU H H 1 7.819 0.03 A 118 GLU HA H 1 4.760 0.03 A 118 GLU HB2 H 1 1.625 0.03 A 118 GLU HB3 H 1 2.447 0.03 A 118 GLU HG3 H 1 2.141 0.03 A 118 GLU C C 13 177.397 0.1 A 118 GLU CA C 13 54.309 0.1 A 118 GLU CB C 13 31.091 0.1 A 118 GLU CG C 13 34.531 0.1 A 118 GLU N N 15 116.615 0.1 A 119 LYS HA H 1 4.165 0.03 A 119 LYS HB2 H 1 1.656 0.03 A 119 LYS HB3 H 1 1.778 0.03 A 119 LYS HD3 H 1 1.495 0.03 A 119 LYS HE3 H 1 2.988 0.03 A 119 LYS HG3 H 1 1.687 0.03 A 119 LYS C C 13 177.626 0.1 A 119 LYS CA C 13 57.540 0.1 A 119 LYS CB C 13 32.845 0.1 A 119 LYS CD C 13 29.522 0.1 A 119 LYS CE C 13 42.471 0.1 A 119 LYS CG C 13 25.073 0.1 A 120 LYS HA H 1 4.305 0.03 A 120 LYS HB2 H 1 1.613 0.03 A 120 LYS HB3 H 1 1.434 0.03 A 120 LYS HD3 H 1 1.300 0.03 A 120 LYS HE3 H 1 2.893 0.03 A 120 LYS HG3 H 1 1.606 0.03 A 120 LYS C C 13 174.312 0.1 A 120 LYS CA C 13 57.106 0.1 A 120 LYS CB C 13 33.188 0.1 A 120 LYS CD C 13 25.546 0.1 A 120 LYS CE C 13 41.992 0.1 A 120 LYS CG C 13 25.548 0.1 A 121 LEU HA H 1 4.559 0.03 A 121 LEU HB3 H 1 1.197 0.03 A 121 LEU HD1% H 1 0.513 0.03 A 121 LEU HD2% H 1 0.251 0.03 A 121 LEU HG H 1 1.600 0.03 A 121 LEU C C 13 174.893 0.1 A 121 LEU CA C 13 52.604 0.1 A 121 LEU CB C 13 39.606 0.1 A 121 LEU CD1 C 13 23.109 0.1 A 121 LEU CD2 C 13 26.175 0.1 A 121 LEU CG C 13 25.900 0.1 A 122 VAL HA H 1 4.361 0.03 A 122 VAL HB H 1 1.979 0.03 A 122 VAL HG1% H 1 0.638 0.03 A 122 VAL HG2% H 1 0.628 0.03 A 122 VAL C C 13 173.909 0.1 A 122 VAL CA C 13 62.028 0.1 A 122 VAL CB C 13 33.594 0.1 A 122 VAL CG1 C 13 20.353 0.1 A 122 VAL CG2 C 13 21.240 0.1 A 123 PHE HA H 1 5.175 0.03 A 123 PHE HB3 H 1 2.172 0.03 A 123 PHE HDx H 1 6.966 0.03 A 123 PHE HDy H 1 6.966 0.03 A 123 PHE HEx H 1 6.728 0.03 A 123 PHE HEy H 1 6.728 0.03 A 123 PHE HZ H 1 7.280 0.03 A 123 PHE C C 13 173.230 0.1 A 123 PHE CA C 13 56.314 0.1 A 123 PHE CB C 13 40.832 0.1 A 123 PHE CDx C 13 132.490 0.1 A 123 PHE CDy C 13 132.490 0.1 A 123 PHE CEx C 13 130.579 0.1 A 123 PHE CEy C 13 130.579 0.1 A 123 PHE CZ C 13 130.530 0.1 A 124 THR H H 1 8.493 0.03 A 124 THR HA H 1 4.885 0.03 A 124 THR HB H 1 3.752 0.03 A 124 THR HG2% H 1 0.917 0.03 A 124 THR C C 13 170.874 0.1 A 124 THR CA C 13 60.087 0.1 A 124 THR CB C 13 70.942 0.1 A 124 THR CG2 C 13 21.004 0.1 A 124 THR N N 15 121.688 0.1 A 125 VAL H H 1 8.275 0.03 A 125 VAL HA H 1 4.516 0.03 A 125 VAL HB H 1 0.644 0.03 A 125 VAL HG1% H 1 0.706 0.03 A 125 VAL HG2% H 1 0.424 0.03 A 125 VAL C C 13 173.796 0.1 A 125 VAL CA C 13 59.792 0.1 A 125 VAL CB C 13 33.234 0.1 A 125 VAL CG1 C 13 21.244 0.1 A 125 VAL CG2 C 13 23.903 0.1 A 125 VAL N N 15 125.781 0.1 A 126 GLU H H 1 8.262 0.03 A 126 GLU HA H 1 4.889 0.03 A 126 GLU HB3 H 1 1.830 0.03 A 126 GLU HG3 H 1 2.016 0.03 A 126 GLU C C 13 173.519 0.1 A 126 GLU CA C 13 53.966 0.1 A 126 GLU CB C 13 32.962 0.1 A 126 GLU CG C 13 35.406 0.1 A 127 ALA H H 1 7.987 0.03 A 127 ALA HA H 1 4.291 0.03 A 127 ALA HB% H 1 0.855 0.03 A 127 ALA CA C 13 52.568 0.1 A 127 ALA CB C 13 20.963 0.1 A 127 ALA N N 15 129.764 0.1 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 2 LYS HA A 2 LYS HD2 1.0 1.8 5.0 2 1 A 2 LYS HA A 2 LYS HD3 1.0 1.8 5.0 3 2 A 14 THR HB A 2 LYS HEx 1.0 1.8 6.0 4 2 A 2 LYS HE3 A 14 THR HB 1.0 1.8 6.0 5 3 A 16 PHE HA A 2 LYS HB2 1.0 1.8 6.0 6 3 A 2 LYS HB3 A 16 PHE HA 1.0 1.8 6.0 7 4 A 17 SER HA A 2 LYS HG2 1.0 1.8 6.0 8 4 A 2 LYS HG3 A 17 SER HA 1.0 1.8 6.0 9 5 A 2 LYS HB2 A 17 SER HB2 1.0 1.8 6.0 10 5 A 17 SER HB3 A 2 LYS HB2 1.0 1.8 6.0 11 5 A 2 LYS HB3 A 17 SER HB3 1.0 1.8 6.0 12 5 A 2 LYS HB3 A 17 SER HB2 1.0 1.8 6.0 13 6 A 17 SER HA A 2 LYS HEx 1.0 1.8 6.0 14 6 A 2 LYS HE3 A 17 SER HA 1.0 1.8 6.0 15 7 A 17 SER HA A 2 LYS HB2 1.0 1.8 6.0 16 7 A 2 LYS HB3 A 17 SER HA 1.0 1.8 6.0 17 8 A 3 VAL HG2% A 3 VAL HB 1.0 1.8 3.8 18 9 A 3 VAL HG2% A 3 VAL HA 1.0 1.8 3.8 19 10 A 3 VAL HB A 3 VAL HA 1.0 1.8 6.0 20 11 A 3 VAL HA A 4 LYS HB2 1.0 1.8 6.0 21 11 A 3 VAL HA A 4 LYS HB3 1.0 1.8 6.0 22 12 A 3 VAL HG2% A 15 ILE HG2% 1.0 1.8 4.3 23 13 A 15 ILE HG2% A 3 VAL HG1% 1.0 1.8 7.0 24 14 A 3 VAL H A 15 ILE HA 1.0 1.8 6.0 25 15 A 3 VAL HB A 15 ILE HG2% 1.0 1.8 6.5 26 16 A 3 VAL HG2% A 16 PHE HD% 1.0 1.8 6.5 27 17 A 3 VAL HB A 16 PHE HD% 1.0 1.8 6.0 28 18 A 3 VAL HG1% A 16 PHE HD% 1.0 1.8 5.5 29 19 A 3 VAL HG1% A 16 PHE HE% 1.0 1.8 6.5 30 20 A 3 VAL HG1% A 16 PHE HZ 1.0 1.8 6.5 31 21 A 3 VAL HG2% A 16 PHE HE% 1.0 1.8 6.5 32 22 A 16 PHE HA A 3 VAL HB 1.0 1.8 6.0 33 23 A 16 PHE HA A 3 VAL HG2% 1.0 1.8 6.5 34 24 A 16 PHE HA A 3 VAL HG1% 1.0 1.8 6.5 35 25 A 3 VAL HG1% A 47 LEU HG 1.0 1.8 6.5 36 26 A 3 VAL HA A 47 LEU HD1% 1.0 1.8 6.5 37 26 A 3 VAL HA A 47 LEU HD2% 1.0 1.8 6.5 38 27 A 3 VAL HG1% A 47 LEU HB2 1.0 1.8 6.5 39 27 A 3 VAL HG1% A 47 LEU HB3 1.0 1.8 6.5 40 28 A 3 VAL HG1% A 47 LEU HA 1.0 1.8 6.5 41 29 A 3 VAL HG1% A 48 ILE HA 1.0 1.8 6.5 42 30 A 3 VAL HG1% A 49 GLY HA2 1.0 1.8 6.5 43 30 A 3 VAL HG1% A 49 GLY HA3 1.0 1.8 6.5 44 31 A 3 VAL HG2% A 96 TYR HE% 1.0 1.8 5.5 45 32 A 3 VAL HG1% A 96 TYR HE% 1.0 1.8 3.8 46 33 A 3 VAL HB A 96 TYR HE% 1.0 1.8 6.0 47 34 A 4 LYS HB3 A 4 LYS HEx 1.0 1.8 6.0 48 34 A 4 LYS HE3 A 4 LYS HB2 1.0 1.8 6.0 49 34 A 4 LYS HB3 A 4 LYS HE3 1.0 1.8 6.0 50 34 A 4 LYS HB2 A 4 LYS HEx 1.0 1.8 6.0 51 35 A 4 LYS H A 4 LYS HG2 1.0 1.8 6.0 52 35 A 4 LYS HG3 A 4 LYS H 1.0 1.8 6.0 53 36 A 4 LYS H A 4 LYS HD2 1.0 1.8 6.0 54 36 A 4 LYS H A 4 LYS HD3 1.0 1.8 6.0 55 37 A 4 LYS HA A 5 GLY H 1.0 1.8 3.5 56 38 A 4 LYS HA A 17 SER HB2 1.0 1.8 6.0 57 38 A 17 SER HB3 A 4 LYS HA 1.0 1.8 6.0 58 39 A 4 LYS HB3 A 40 VAL HG1% 1.0 1.8 6.5 59 39 A 4 LYS HB2 A 40 VAL HG1% 1.0 1.8 6.5 60 39 A 40 VAL HG2% A 4 LYS HB2 1.0 1.8 6.5 61 39 A 4 LYS HB3 A 40 VAL HG2% 1.0 1.8 6.5 62 40 A 42 ALA HA A 4 LYS HEx 1.0 1.8 6.0 63 40 A 4 LYS HE3 A 42 ALA HA 1.0 1.8 6.0 64 41 A 48 ILE HA A 4 LYS HB2 1.0 1.8 6.0 65 41 A 4 LYS HB3 A 48 ILE HA 1.0 1.8 6.0 66 42 A 48 ILE HG2% A 4 LYS HB2 1.0 1.8 6.5 67 42 A 4 LYS HB3 A 48 ILE HG2% 1.0 1.8 6.5 68 43 A 48 ILE HA A 4 LYS H 1.0 1.8 6.0 69 44 A 16 PHE HD% A 5 GLY HA2 1.0 1.8 6.0 70 44 A 16 PHE HD% A 5 GLY HA3 1.0 1.8 6.0 71 45 A 17 SER HA A 5 GLY H 1.0 1.8 6.0 72 46 A 5 GLY HA2 A 40 VAL HG1% 1.0 1.8 5.5 73 46 A 5 GLY HA3 A 40 VAL HG1% 1.0 1.8 5.5 74 46 A 40 VAL HG2% A 5 GLY HA2 1.0 1.8 5.5 75 46 A 40 VAL HG2% A 5 GLY HA3 1.0 1.8 5.5 76 47 A 123 PHE HZ A 5 GLY HA2 1.0 1.8 5.0 77 47 A 5 GLY HA3 A 123 PHE HZ 1.0 1.8 5.0 78 48 A 6 CYS HA A 18 LYS HB2 1.0 1.8 6.0 79 48 A 6 CYS HA A 18 LYS HB3 1.0 1.8 6.0 80 49 A 20 TYR HE% A 6 CYS HB2 1.0 1.8 6.0 81 49 A 6 CYS HB3 A 20 TYR HE% 1.0 1.8 6.0 82 50 A 6 CYS HB3 A 38 CYS HBx 1.0 1.8 6.0 83 50 A 38 CYS HB3 A 6 CYS HB2 1.0 1.8 6.0 84 50 A 6 CYS HB3 A 38 CYS HB3 1.0 1.8 6.0 85 50 A 6 CYS HB2 A 38 CYS HBx 1.0 1.8 6.0 86 51 A 123 PHE HD% A 6 CYS HB2 1.0 1.8 6.0 87 51 A 6 CYS HB3 A 123 PHE HD% 1.0 1.8 6.0 88 52 A 123 PHE HE% A 6 CYS HB2 1.0 1.8 6.0 89 52 A 6 CYS HB3 A 123 PHE HE% 1.0 1.8 6.0 90 53 A 7 ASP HB3 A 13 SER HBx 1.0 1.8 6.0 91 53 A 7 ASP HB2 A 13 SER HBx 1.0 1.8 6.0 92 53 A 13 SER HB3 A 7 ASP HB2 1.0 1.8 6.0 93 53 A 7 ASP HB3 A 13 SER HB3 1.0 1.8 6.0 94 54 A 13 SER HA A 7 ASP HB2 1.0 1.8 6.0 95 54 A 7 ASP HB3 A 13 SER HA 1.0 1.8 6.0 96 55 A 7 ASP H A 16 PHE HB2 1.0 1.8 6.0 97 55 A 7 ASP H A 16 PHE HB3 1.0 1.8 6.0 98 56 A 16 PHE HD% A 7 ASP HB2 1.0 1.8 6.0 99 56 A 16 PHE HD% A 7 ASP HB3 1.0 1.8 6.0 100 57 A 7 ASP H A 19 GLY HA2 1.0 1.8 6.0 101 57 A 7 ASP H A 19 GLY HA3 1.0 1.8 6.0 102 58 A 7 ASP HB3 A 19 GLY HA2 1.0 1.8 6.0 103 58 A 7 ASP HB2 A 19 GLY HA2 1.0 1.8 6.0 104 58 A 19 GLY HA3 A 7 ASP HB2 1.0 1.8 6.0 105 58 A 7 ASP HB3 A 19 GLY HA3 1.0 1.8 6.0 106 59 A 7 ASP HA A 51 LYS HBx 1.0 1.8 6.0 107 59 A 7 ASP HA A 51 LYS HB3 1.0 1.8 6.0 108 60 A 8 PHE HD% A 8 PHE HA 1.0 1.8 6.0 109 61 A 8 PHE HD% A 8 PHE HB2 1.0 1.8 6.0 110 61 A 8 PHE HD% A 8 PHE HB3 1.0 1.8 6.0 111 62 A 8 PHE H A 9 THR HG2% 1.0 1.8 6.5 112 63 A 8 PHE HA A 9 THR H 1.0 1.8 6.0 113 64 A 8 PHE HA A 20 TYR HD% 1.0 1.8 6.0 114 65 A 8 PHE HD% A 20 TYR HD% 1.0 1.8 5.0 115 66 A 8 PHE HA A 20 TYR HB2 1.0 1.8 5.0 116 66 A 8 PHE HA A 20 TYR HB3 1.0 1.8 5.0 117 67 A 8 PHE HA A 20 TYR H 1.0 1.8 6.0 118 68 A 8 PHE HD% A 25 ILE HG2% 1.0 1.8 6.5 119 69 A 25 ILE HD1% A 8 PHE HB2 1.0 1.8 6.5 120 69 A 8 PHE HB3 A 25 ILE HD1% 1.0 1.8 6.5 121 70 A 25 ILE HG2% A 8 PHE HB2 1.0 1.8 6.5 122 70 A 8 PHE HB3 A 25 ILE HG2% 1.0 1.8 6.5 123 71 A 8 PHE HD% A 25 ILE HD1% 1.0 1.8 6.5 124 72 A 8 PHE HD% A 36 ILE HG2% 1.0 1.8 6.5 125 73 A 52 CYS HA A 8 PHE HB2 1.0 1.8 6.0 126 73 A 8 PHE HB3 A 52 CYS HA 1.0 1.8 6.0 127 74 A 8 PHE HD% A 52 CYS HA 1.0 1.8 6.0 128 75 A 8 PHE HB2 A 53 PRO HD2 1.0 1.8 6.0 129 75 A 8 PHE HB3 A 53 PRO HD2 1.0 1.8 6.0 130 75 A 53 PRO HD3 A 8 PHE HB2 1.0 1.8 6.0 131 75 A 8 PHE HB3 A 53 PRO HD3 1.0 1.8 6.0 132 76 A 8 PHE HD% A 53 PRO HD2 1.0 1.8 6.0 133 76 A 8 PHE HD% A 53 PRO HD3 1.0 1.8 6.0 134 77 A 8 PHE HD% A 121 LEU HD1% 1.0 1.8 6.5 135 77 A 8 PHE HD% A 121 LEU HD2% 1.0 1.8 6.5 136 78 A 8 PHE HB2 A 121 LEU HD1% 1.0 1.8 6.5 137 78 A 8 PHE HB3 A 121 LEU HD1% 1.0 1.8 6.5 138 78 A 121 LEU HD2% A 8 PHE HB2 1.0 1.8 6.5 139 78 A 8 PHE HB3 A 121 LEU HD2% 1.0 1.8 6.5 140 79 A 8 PHE HE% A 121 LEU HBx 1.0 1.8 6.0 141 79 A 8 PHE HE% A 121 LEU HB3 1.0 1.8 6.0 142 80 A 9 THR HG2% A 9 THR HB 1.0 1.8 3.2 143 81 A 9 THR HG2% A 9 THR HA 1.0 1.8 5.5 144 82 A 9 THR HG2% A 9 THR H 1.0 1.8 6.5 145 83 A 9 THR HB A 10 THR H 1.0 1.8 6.0 146 84 A 9 THR HG2% A 51 LYS HGx 1.0 1.8 6.5 147 84 A 9 THR HG2% A 51 LYS HG3 1.0 1.8 6.5 148 85 A 9 THR HG2% A 51 LYS HBx 1.0 1.8 6.5 149 85 A 51 LYS HB3 A 9 THR HG2% 1.0 1.8 6.5 150 86 A 9 THR HG2% A 52 CYS HA 1.0 1.8 6.5 151 87 A 9 THR HG2% A 53 PRO HB2 1.0 1.8 6.5 152 87 A 9 THR HG2% A 53 PRO HB3 1.0 1.8 6.5 153 88 A 9 THR HG2% A 53 PRO HD2 1.0 1.8 6.5 154 88 A 9 THR HG2% A 53 PRO HD3 1.0 1.8 6.5 155 89 A 10 THR H A 10 THR HG2% 1.0 1.8 6.5 156 90 A 10 THR HB A 11 SER H 1.0 1.8 6.0 157 91 A 11 SER H A 10 THR HA 1.0 1.8 3.5 158 92 A 10 THR HG2% A 11 SER HA 1.0 1.8 6.5 159 93 A 10 THR HB A 12 GLU H 1.0 1.8 6.0 160 94 A 10 THR HA A 12 GLU H 1.0 1.8 6.0 161 95 A 10 THR HG2% A 13 SER HBx 1.0 1.8 6.5 162 95 A 13 SER HB3 A 10 THR HG2% 1.0 1.8 6.5 163 96 A 13 SER HA A 10 THR HG2% 1.0 1.8 3.8 164 97 A 11 SER H A 11 SER HB2 1.0 1.8 6.0 165 97 A 11 SER H A 11 SER HB3 1.0 1.8 6.0 166 98 A 11 SER H A 11 SER HA 1.0 1.8 5.0 167 99 A 11 SER HA A 19 GLY HA2 1.0 1.8 5.0 168 99 A 19 GLY HA3 A 11 SER HA 1.0 1.8 5.0 169 100 A 11 SER HA A 20 TYR HA 1.0 1.8 6.0 170 101 A 11 SER HB2 A 21 SER HB2 1.0 1.8 6.0 171 101 A 21 SER HB3 A 11 SER HB2 1.0 1.8 6.0 172 101 A 11 SER HB3 A 21 SER HB3 1.0 1.8 6.0 173 101 A 11 SER HB3 A 21 SER HB2 1.0 1.8 6.0 174 102 A 11 SER H A 21 SER HB2 1.0 1.8 6.0 175 102 A 11 SER H A 21 SER HB3 1.0 1.8 6.0 176 103 A 11 SER HA A 21 SER H 1.0 1.8 6.0 177 104 A 12 GLU H A 12 GLU HB2 1.0 1.8 6.0 178 104 A 12 GLU H A 12 GLU HB3 1.0 1.8 6.0 179 105 A 12 GLU HA A 12 GLU HB2 1.0 1.8 6.0 180 105 A 12 GLU HB3 A 12 GLU HA 1.0 1.8 6.0 181 106 A 12 GLU HA A 12 GLU HGx 1.0 1.8 6.0 182 106 A 12 GLU HA A 12 GLU HG3 1.0 1.8 6.0 183 107 A 12 GLU H A 12 GLU HGx 1.0 1.8 6.0 184 107 A 12 GLU H A 12 GLU HG3 1.0 1.8 6.0 185 108 A 12 GLU H A 12 GLU HA 1.0 1.8 6.0 186 109 A 12 GLU HA A 13 SER H 1.0 1.8 5.0 187 110 A 13 SER H A 13 SER HBx 1.0 1.8 6.0 188 110 A 13 SER HB3 A 13 SER H 1.0 1.8 6.0 189 111 A 13 SER HA A 13 SER H 1.0 1.8 6.0 190 112 A 13 SER HA A 14 THR HG2% 1.0 1.8 6.5 191 113 A 14 THR HB A 14 THR H 1.0 1.8 6.0 192 114 A 14 THR HB A 14 THR HG2% 1.0 1.8 3.2 193 115 A 14 THR HG2% A 14 THR H 1.0 1.8 6.5 194 116 A 14 THR H A 14 THR HA 1.0 1.8 6.0 195 117 A 14 THR HB A 15 ILE H 1.0 1.8 6.0 196 118 A 14 THR H A 15 ILE HG12 1.0 1.8 6.0 197 118 A 14 THR H A 15 ILE HG13 1.0 1.8 6.0 198 119 A 14 THR HG2% A 15 ILE H 1.0 1.8 6.5 199 120 A 15 ILE HG2% A 15 ILE HG12 1.0 1.8 6.5 200 120 A 15 ILE HG2% A 15 ILE HG13 1.0 1.8 6.5 201 121 A 15 ILE HA A 15 ILE HB 1.0 1.8 6.0 202 122 A 15 ILE HA A 15 ILE H 1.0 1.8 6.0 203 123 A 15 ILE HG2% A 15 ILE HA 1.0 1.8 5.5 204 124 A 15 ILE HA A 15 ILE HG12 1.0 1.8 6.0 205 124 A 15 ILE HA A 15 ILE HG13 1.0 1.8 6.0 206 125 A 15 ILE HB A 15 ILE HG12 1.0 1.8 6.0 207 125 A 15 ILE HG13 A 15 ILE HB 1.0 1.8 6.0 208 126 A 15 ILE HG2% A 15 ILE HB 1.0 1.8 3.8 209 127 A 15 ILE H A 15 ILE HB 1.0 1.8 6.0 210 128 A 15 ILE HB A 15 ILE HD1% 1.0 1.8 6.5 211 129 A 15 ILE HG2% A 15 ILE H 1.0 1.8 6.5 212 130 A 15 ILE HA A 15 ILE HD1% 1.0 1.8 6.5 213 131 A 15 ILE HG2% A 15 ILE HD1% 1.0 1.8 4.3 214 132 A 15 ILE H A 15 ILE HD1% 1.0 1.8 6.5 215 133 A 16 PHE HD% A 15 ILE H 1.0 1.8 6.0 216 134 A 15 ILE HG2% A 16 PHE HD% 1.0 1.8 6.5 217 135 A 15 ILE HG2% A 16 PHE HE% 1.0 1.8 6.5 218 136 A 16 PHE HD% A 15 ILE HG12 1.0 1.8 6.0 219 136 A 16 PHE HD% A 15 ILE HG13 1.0 1.8 6.0 220 137 A 16 PHE HE% A 15 ILE HB 1.0 1.8 6.0 221 138 A 16 PHE HD% A 15 ILE HB 1.0 1.8 6.0 222 139 A 16 PHE HE% A 15 ILE HD1% 1.0 1.8 6.5 223 140 A 15 ILE HD1% A 16 PHE H 1.0 1.8 6.5 224 141 A 16 PHE HD% A 15 ILE HD1% 1.0 1.8 6.5 225 142 A 15 ILE HD1% A 51 LYS HGx 1.0 1.8 6.5 226 142 A 51 LYS HG3 A 15 ILE HD1% 1.0 1.8 6.5 227 143 A 15 ILE HG2% A 96 TYR HE% 1.0 1.8 6.5 228 144 A 96 TYR HE% A 15 ILE HD1% 1.0 1.8 6.5 229 145 A 16 PHE HD% A 16 PHE HB2 1.0 1.8 6.0 230 145 A 16 PHE HD% A 16 PHE HB3 1.0 1.8 6.0 231 146 A 16 PHE HA A 16 PHE HD% 1.0 1.8 6.0 232 147 A 16 PHE HD% A 16 PHE H 1.0 1.8 6.0 233 148 A 16 PHE HE% A 16 PHE HZ 1.0 1.8 6.0 234 149 A 16 PHE H A 16 PHE HB2 1.0 1.8 6.0 235 149 A 16 PHE HB3 A 16 PHE H 1.0 1.8 6.0 236 150 A 16 PHE HA A 16 PHE H 1.0 1.8 6.0 237 151 A 16 PHE HB3 A 19 GLY HA2 1.0 1.8 6.0 238 151 A 19 GLY HA3 A 16 PHE HB2 1.0 1.8 6.0 239 151 A 16 PHE HB3 A 19 GLY HA3 1.0 1.8 6.0 240 151 A 16 PHE HB2 A 19 GLY HA2 1.0 1.8 6.0 241 152 A 16 PHE HD% A 47 LEU HD1% 1.0 1.8 6.5 242 152 A 16 PHE HD% A 47 LEU HD2% 1.0 1.8 6.5 243 153 A 16 PHE HE% A 49 GLY HA2 1.0 1.8 6.0 244 153 A 16 PHE HE% A 49 GLY HA3 1.0 1.8 6.0 245 154 A 16 PHE HD% A 50 PHE HA 1.0 1.8 6.0 246 155 A 16 PHE HE% A 51 LYS HBx 1.0 1.8 6.0 247 155 A 16 PHE HE% A 51 LYS HB3 1.0 1.8 6.0 248 156 A 16 PHE HE% A 51 LYS HGx 1.0 1.8 6.0 249 156 A 16 PHE HE% A 51 LYS HG3 1.0 1.8 6.0 250 157 A 16 PHE HD% A 51 LYS HBx 1.0 1.8 6.0 251 157 A 16 PHE HD% A 51 LYS HB3 1.0 1.8 6.0 252 158 A 16 PHE HE% A 94 THR HG2% 1.0 1.8 6.5 253 159 A 17 SER H A 17 SER HB2 1.0 1.8 6.0 254 159 A 17 SER HB3 A 17 SER H 1.0 1.8 6.0 255 160 A 17 SER HA A 17 SER H 1.0 1.8 6.0 256 161 A 18 LYS H A 18 LYS HB2 1.0 1.8 6.0 257 161 A 18 LYS HB3 A 18 LYS H 1.0 1.8 6.0 258 162 A 18 LYS HG3 A 19 GLY HA2 1.0 1.8 6.0 259 162 A 18 LYS HGx A 19 GLY HA2 1.0 1.8 6.0 260 162 A 19 GLY HA3 A 18 LYS HGx 1.0 1.8 6.0 261 162 A 19 GLY HA3 A 18 LYS HG3 1.0 1.8 6.0 262 163 A 20 TYR HE% A 18 LYS HD2 1.0 1.8 6.0 263 163 A 20 TYR HE% A 18 LYS HD3 1.0 1.8 6.0 264 164 A 18 LYS HE2 A 40 VAL HG1% 1.0 1.8 6.5 265 164 A 18 LYS HE3 A 40 VAL HG1% 1.0 1.8 6.5 266 164 A 40 VAL HG2% A 18 LYS HE2 1.0 1.8 6.5 267 164 A 40 VAL HG2% A 18 LYS HE3 1.0 1.8 6.5 268 165 A 20 TYR HD% A 19 GLY HA2 1.0 1.8 6.0 269 165 A 19 GLY HA3 A 20 TYR HD% 1.0 1.8 6.0 270 166 A 20 TYR HD% A 20 TYR H 1.0 1.8 6.0 271 167 A 20 TYR HD% A 20 TYR HB2 1.0 1.8 5.0 272 167 A 20 TYR HD% A 20 TYR HB3 1.0 1.8 5.0 273 168 A 20 TYR H A 20 TYR HB2 1.0 1.8 6.0 274 168 A 20 TYR HB3 A 20 TYR H 1.0 1.8 6.0 275 169 A 20 TYR HA A 20 TYR HB2 1.0 1.8 6.0 276 169 A 20 TYR HB3 A 20 TYR HA 1.0 1.8 6.0 277 170 A 20 TYR HE% A 20 TYR HB2 1.0 1.8 6.0 278 170 A 20 TYR HE% A 20 TYR HB3 1.0 1.8 6.0 279 171 A 20 TYR HD% A 21 SER H 1.0 1.8 6.0 280 172 A 20 TYR HD% A 24 GLU HB2 1.0 1.8 6.0 281 172 A 20 TYR HD% A 24 GLU HB3 1.0 1.8 6.0 282 173 A 20 TYR HB3 A 24 GLU HB2 1.0 1.8 6.0 283 173 A 20 TYR HB2 A 24 GLU HB2 1.0 1.8 6.0 284 173 A 24 GLU HB3 A 20 TYR HB2 1.0 1.8 6.0 285 173 A 20 TYR HB3 A 24 GLU HB3 1.0 1.8 6.0 286 174 A 20 TYR HD% A 24 GLU HGx 1.0 1.8 6.0 287 174 A 20 TYR HD% A 24 GLU HG3 1.0 1.8 6.0 288 175 A 25 ILE HG2% A 20 TYR HB2 1.0 1.8 6.5 289 175 A 20 TYR HB3 A 25 ILE HG2% 1.0 1.8 6.5 290 176 A 25 ILE HG2% A 56 TYR HE% 1.0 1.8 6.5 291 176 A 20 TYR HE% A 25 ILE HG2% 1.0 1.8 6.5 292 177 A 25 ILE HG2% A 56 TYR HD% 1.0 1.8 6.5 293 177 A 20 TYR HD% A 25 ILE HG2% 1.0 1.8 6.5 294 178 A 25 ILE HD1% A 20 TYR HB2 1.0 1.8 6.5 295 178 A 20 TYR HB3 A 25 ILE HD1% 1.0 1.8 6.5 296 179 A 25 ILE HD1% A 56 TYR HD% 1.0 1.8 6.5 297 179 A 20 TYR HD% A 25 ILE HD1% 1.0 1.8 6.5 298 180 A 25 ILE HD1% A 56 TYR HE% 1.0 1.8 6.5 299 180 A 20 TYR HE% A 25 ILE HD1% 1.0 1.8 6.5 300 181 A 20 TYR HD% A 36 ILE HD1% 1.0 1.8 6.5 301 182 A 20 TYR HD% A 36 ILE HG2% 1.0 1.8 6.5 302 183 A 36 ILE HG2% A 20 TYR HB2 1.0 1.8 6.5 303 183 A 20 TYR HB3 A 36 ILE HG2% 1.0 1.8 6.5 304 184 A 20 TYR HE% A 36 ILE HG2% 1.0 1.8 3.8 305 185 A 20 TYR HE% A 36 ILE HD1% 1.0 1.8 6.5 306 186 A 20 TYR HE% A 38 CYS HBx 1.0 1.8 6.0 307 186 A 20 TYR HE% A 38 CYS HB3 1.0 1.8 6.0 308 187 A 22 ILE H A 21 SER HB2 1.0 1.8 6.0 309 187 A 21 SER HB3 A 22 ILE H 1.0 1.8 6.0 310 188 A 21 SER HA A 22 ILE HG2% 1.0 1.8 6.5 311 189 A 21 SER HB3 A 24 GLU HGx 1.0 1.8 6.0 312 189 A 21 SER HB2 A 24 GLU HGx 1.0 1.8 6.0 313 189 A 24 GLU HG3 A 21 SER HB2 1.0 1.8 6.0 314 189 A 21 SER HB3 A 24 GLU HG3 1.0 1.8 6.0 315 190 A 21 SER HB3 A 24 GLU HB2 1.0 1.8 6.0 316 190 A 21 SER HB2 A 24 GLU HB2 1.0 1.8 6.0 317 190 A 24 GLU HB3 A 21 SER HB2 1.0 1.8 6.0 318 190 A 21 SER HB3 A 24 GLU HB3 1.0 1.8 6.0 319 191 A 21 SER H A 24 GLU HGx 1.0 1.8 6.0 320 191 A 21 SER H A 24 GLU HG3 1.0 1.8 6.0 321 192 A 22 ILE HA A 22 ILE HG12 1.0 1.8 6.0 322 192 A 22 ILE HG13 A 22 ILE HA 1.0 1.8 6.0 323 193 A 22 ILE H A 22 ILE HG12 1.0 1.8 6.0 324 193 A 22 ILE H A 22 ILE HG13 1.0 1.8 6.0 325 194 A 22 ILE H A 22 ILE HA 1.0 1.8 5.0 326 195 A 22 ILE HA A 22 ILE HB 1.0 1.8 3.3 327 196 A 22 ILE H A 22 ILE HG2% 1.0 1.8 5.5 328 197 A 22 ILE HG2% A 22 ILE HA 1.0 1.8 5.5 329 198 A 22 ILE H A 22 ILE HB 1.0 1.8 5.0 330 199 A 22 ILE H A 22 ILE HD1% 1.0 1.8 6.5 331 200 A 22 ILE HD1% A 23 ASN H 1.0 1.8 6.5 332 201 A 22 ILE HA A 25 ILE HB 1.0 1.8 5.0 333 202 A 22 ILE HD1% A 26 SER HBx 1.0 1.8 6.5 334 202 A 22 ILE HD1% A 26 SER HB3 1.0 1.8 6.5 335 203 A 22 ILE HD1% A 26 SER HBx 1.0 1.8 5.5 336 203 A 22 ILE HD1% A 26 SER HB3 1.0 1.8 5.5 337 204 A 23 ASN HA A 26 SER HBx 1.0 1.8 5.0 338 204 A 26 SER HB3 A 23 ASN HA 1.0 1.8 5.0 339 205 A 24 GLU HA A 24 GLU H 1.0 1.8 5.0 340 206 A 24 GLU H A 24 GLU HGx 1.0 1.8 5.0 341 206 A 24 GLU HG3 A 24 GLU H 1.0 1.8 5.0 342 207 A 25 ILE H A 24 GLU HGx 1.0 1.8 6.0 343 207 A 24 GLU HG3 A 25 ILE H 1.0 1.8 6.0 344 208 A 36 ILE HD1% A 24 GLU HB2 1.0 1.8 6.5 345 208 A 24 GLU HB3 A 36 ILE HD1% 1.0 1.8 6.5 346 209 A 36 ILE HD1% A 24 GLU HA 1.0 1.8 6.5 347 210 A 25 ILE H A 25 ILE HG1x 1.0 1.8 6.0 348 210 A 25 ILE H A 25 ILE HG13 1.0 1.8 6.0 349 211 A 25 ILE HB A 25 ILE HG1x 1.0 1.8 6.0 350 211 A 25 ILE HB A 25 ILE HG13 1.0 1.8 6.0 351 212 A 25 ILE HB A 25 ILE HA 1.0 1.8 3.3 352 213 A 25 ILE H A 25 ILE HA 1.0 1.8 5.0 353 214 A 25 ILE HG2% A 25 ILE HA 1.0 1.8 3.8 354 215 A 25 ILE HB A 25 ILE H 1.0 1.8 6.0 355 216 A 25 ILE HD1% A 25 ILE H 1.0 1.8 6.5 356 217 A 25 ILE HG13 A 26 SER HBx 1.0 1.8 6.0 357 217 A 25 ILE HG1x A 26 SER HBx 1.0 1.8 6.0 358 217 A 26 SER HB3 A 25 ILE HG1x 1.0 1.8 6.0 359 217 A 26 SER HB3 A 25 ILE HG13 1.0 1.8 6.0 360 218 A 25 ILE H A 26 SER HBx 1.0 1.8 6.0 361 218 A 26 SER HB3 A 25 ILE H 1.0 1.8 6.0 362 219 A 25 ILE HA A 26 SER H 1.0 1.8 6.0 363 220 A 25 ILE HB A 26 SER H 1.0 1.8 6.0 364 221 A 25 ILE HD1% A 26 SER H 1.0 1.8 6.5 365 222 A 36 ILE HD1% A 25 ILE HA 1.0 1.8 5.5 366 223 A 36 ILE HG2% A 25 ILE HA 1.0 1.8 6.5 367 224 A 25 ILE HG2% A 36 ILE HD1% 1.0 1.8 4.3 368 225 A 25 ILE HG2% A 36 ILE HG2% 1.0 1.8 6.0 369 226 A 25 ILE HD1% A 36 ILE HG2% 1.0 1.8 6.0 370 227 A 25 ILE HD1% A 56 TYR HE% 1.0 1.8 6.5 371 228 A 25 ILE HD1% A 118 GLU HB2 1.0 1.8 6.5 372 228 A 25 ILE HD1% A 118 GLU HB3 1.0 1.8 6.5 373 229 A 25 ILE HD1% A 121 LEU HD1% 1.0 1.8 6.0 374 229 A 25 ILE HD1% A 121 LEU HD2% 1.0 1.8 6.0 375 230 A 25 ILE HG2% A 121 LEU HD1% 1.0 1.8 4.3 376 230 A 25 ILE HG2% A 121 LEU HD2% 1.0 1.8 4.3 377 231 A 25 ILE HB A 121 LEU HD1% 1.0 1.8 6.5 378 231 A 121 LEU HD2% A 25 ILE HB 1.0 1.8 6.5 379 232 A 28 LYS HA A 28 LYS HB2 1.0 1.8 6.0 380 232 A 28 LYS HB3 A 28 LYS HA 1.0 1.8 6.0 381 233 A 30 SER HA A 30 SER H 1.0 1.8 6.0 382 234 A 36 ILE HA A 32 ASN HD22 1.0 1.8 6.0 383 234 A 32 ASN HD21 A 36 ILE HA 1.0 1.8 6.0 384 235 A 34 GLN H A 33 GLN HB2 1.0 1.8 6.0 385 235 A 33 GLN HB3 A 34 GLN H 1.0 1.8 6.0 386 236 A 34 GLN H A 33 GLN HA 1.0 1.8 5.0 387 237 A 36 ILE H A 35 ASP HB2 1.0 1.8 6.0 388 237 A 35 ASP HB3 A 36 ILE H 1.0 1.8 6.0 389 238 A 35 ASP HB2 A 120 LYS HB2 1.0 1.8 6.0 390 238 A 35 ASP HB3 A 120 LYS HB2 1.0 1.8 6.0 391 238 A 120 LYS HB3 A 35 ASP HB2 1.0 1.8 6.0 392 238 A 35 ASP HB3 A 120 LYS HB3 1.0 1.8 6.0 393 239 A 122 VAL HG1% A 35 ASP HB2 1.0 1.8 5.5 394 239 A 35 ASP HB3 A 122 VAL HG1% 1.0 1.8 5.5 395 240 A 122 VAL HG1% A 35 ASP HA 1.0 1.8 6.5 396 241 A 36 ILE HA A 36 ILE HG12 1.0 1.8 6.0 397 241 A 36 ILE HA A 36 ILE HG13 1.0 1.8 6.0 398 242 A 36 ILE HD1% A 36 ILE HA 1.0 1.8 6.5 399 243 A 36 ILE HA A 36 ILE H 1.0 1.8 6.0 400 244 A 36 ILE HG2% A 36 ILE HA 1.0 1.8 5.5 401 245 A 36 ILE HA A 36 ILE HB 1.0 1.8 6.0 402 246 A 36 ILE HG2% A 36 ILE H 1.0 1.8 6.5 403 247 A 36 ILE H A 36 ILE HB 1.0 1.8 5.0 404 248 A 36 ILE HD1% A 36 ILE H 1.0 1.8 6.5 405 249 A 36 ILE HA A 37 VAL HG2% 1.0 1.8 6.5 406 250 A 36 ILE HB A 37 VAL H 1.0 1.8 6.0 407 251 A 36 ILE HD1% A 37 VAL H 1.0 1.8 6.5 408 252 A 36 ILE HA A 37 VAL HB 1.0 1.8 6.0 409 253 A 36 ILE HG2% A 38 CYS HBx 1.0 1.8 6.5 410 253 A 38 CYS HB3 A 36 ILE HG2% 1.0 1.8 6.5 411 254 A 36 ILE HG2% A 38 CYS H 1.0 1.8 6.5 412 255 A 36 ILE HD1% A 119 LYS HGx 1.0 1.8 5.5 413 255 A 36 ILE HD1% A 119 LYS HG3 1.0 1.8 5.5 414 256 A 36 ILE HD1% A 119 LYS HDx 1.0 1.8 6.5 415 256 A 36 ILE HD1% A 119 LYS HD3 1.0 1.8 6.5 416 257 A 36 ILE HD1% A 119 LYS HEx 1.0 1.8 6.5 417 257 A 36 ILE HD1% A 119 LYS HE3 1.0 1.8 6.5 418 258 A 36 ILE HB A 121 LEU HA 1.0 1.8 6.0 419 259 A 36 ILE H A 121 LEU HD1% 1.0 1.8 6.5 420 259 A 121 LEU HD2% A 36 ILE H 1.0 1.8 6.5 421 260 A 36 ILE HG13 A 121 LEU HD1% 1.0 1.8 6.5 422 260 A 36 ILE HG12 A 121 LEU HD1% 1.0 1.8 6.5 423 260 A 121 LEU HD2% A 36 ILE HG12 1.0 1.8 6.5 424 260 A 121 LEU HD2% A 36 ILE HG13 1.0 1.8 6.5 425 261 A 36 ILE HB A 121 LEU HD1% 1.0 1.8 3.8 426 261 A 121 LEU HD2% A 36 ILE HB 1.0 1.8 3.8 427 262 A 36 ILE HG2% A 122 VAL H 1.0 1.8 6.5 428 263 A 36 ILE HB A 122 VAL H 1.0 1.8 6.0 429 264 A 37 VAL HG1% A 37 VAL HA 1.0 1.8 3.8 430 265 A 37 VAL HB A 37 VAL HG1% 1.0 1.8 3.2 431 266 A 37 VAL HG2% A 37 VAL HA 1.0 1.8 3.8 432 267 A 37 VAL HG2% A 37 VAL HB 1.0 1.8 3.2 433 268 A 37 VAL H A 37 VAL HA 1.0 1.8 6.0 434 269 A 38 CYS H A 37 VAL HA 1.0 1.8 3.5 435 270 A 37 VAL HG1% A 39 THR HA 1.0 1.8 6.5 436 271 A 37 VAL HG1% A 110 PHE HB2 1.0 1.8 6.5 437 271 A 37 VAL HG1% A 110 PHE HB3 1.0 1.8 6.5 438 272 A 37 VAL HG1% A 110 PHE HA 1.0 1.8 6.5 439 273 A 37 VAL HA A 122 VAL HB 1.0 1.8 5.0 440 274 A 122 VAL H A 37 VAL HA 1.0 1.8 6.0 441 275 A 37 VAL HG1% A 123 PHE HA 1.0 1.8 6.5 442 276 A 37 VAL HG1% A 124 THR HB 1.0 1.8 6.5 443 277 A 37 VAL HG1% A 124 THR H 1.0 1.8 6.5 444 278 A 37 VAL HG1% A 124 THR HA 1.0 1.8 6.5 445 279 A 38 CYS HA A 38 CYS HBx 1.0 1.8 6.0 446 279 A 38 CYS HB3 A 38 CYS HA 1.0 1.8 6.0 447 280 A 38 CYS H A 38 CYS HBx 1.0 1.8 6.0 448 280 A 38 CYS HB3 A 38 CYS H 1.0 1.8 6.0 449 281 A 38 CYS H A 38 CYS HA 1.0 1.8 6.0 450 282 A 38 CYS HA A 39 THR HB 1.0 1.8 6.0 451 283 A 123 PHE HE% A 38 CYS HBx 1.0 1.8 6.0 452 283 A 38 CYS HB3 A 123 PHE HE% 1.0 1.8 6.0 453 284 A 123 PHE HD% A 38 CYS HBx 1.0 1.8 6.0 454 284 A 38 CYS HB3 A 123 PHE HD% 1.0 1.8 6.0 455 285 A 123 PHE HA A 38 CYS HBx 1.0 1.8 6.0 456 285 A 38 CYS HB3 A 123 PHE HA 1.0 1.8 6.0 457 286 A 123 PHE HZ A 38 CYS HBx 1.0 1.8 6.0 458 286 A 123 PHE HZ A 38 CYS HB3 1.0 1.8 6.0 459 287 A 38 CYS H A 124 THR HG2% 1.0 1.8 6.5 460 288 A 39 THR HB A 39 THR H 1.0 1.8 5.0 461 289 A 39 THR HA A 39 THR HG2% 1.0 1.8 5.5 462 290 A 39 THR HB A 39 THR HG2% 1.0 1.8 3.2 463 291 A 39 THR HA A 39 THR H 1.0 1.8 6.0 464 292 A 39 THR HA A 124 THR HB 1.0 1.8 5.0 465 293 A 40 VAL H A 40 VAL HG1% 1.0 1.8 5.5 466 293 A 40 VAL HG2% A 40 VAL H 1.0 1.8 5.5 467 294 A 40 VAL H A 40 VAL HA 1.0 1.8 6.0 468 295 A 40 VAL H A 40 VAL HB 1.0 1.8 6.0 469 296 A 40 VAL HA A 40 VAL HB 1.0 1.8 6.0 470 297 A 40 VAL HA A 41 LYS HA 1.0 1.8 6.0 471 298 A 40 VAL HA A 41 LYS HBx 1.0 1.8 6.0 472 298 A 40 VAL HA A 41 LYS HB3 1.0 1.8 6.0 473 299 A 40 VAL HB A 41 LYS H 1.0 1.8 6.0 474 300 A 123 PHE HZ A 40 VAL HG1% 1.0 1.8 5.5 475 300 A 40 VAL HG2% A 123 PHE HZ 1.0 1.8 5.5 476 301 A 123 PHE HD% A 40 VAL HG1% 1.0 1.8 6.5 477 301 A 40 VAL HG2% A 123 PHE HD% 1.0 1.8 6.5 478 302 A 40 VAL HB A 125 VAL HG1% 1.0 1.8 6.5 479 302 A 40 VAL HB A 125 VAL HG2% 1.0 1.8 6.5 480 303 A 40 VAL HG2% A 125 VAL HG1% 1.0 1.8 4.3 481 303 A 125 VAL HG2% A 40 VAL HG1% 1.0 1.8 4.3 482 303 A 40 VAL HG2% A 125 VAL HG2% 1.0 1.8 4.3 483 303 A 40 VAL HG1% A 125 VAL HG1% 1.0 1.8 4.3 484 304 A 40 VAL HB A 125 VAL HA 1.0 1.8 6.0 485 305 A 41 LYS H A 41 LYS HBx 1.0 1.8 5.0 486 305 A 41 LYS HB3 A 41 LYS H 1.0 1.8 5.0 487 306 A 41 LYS H A 41 LYS HA 1.0 1.8 5.0 488 307 A 41 LYS H A 41 LYS HA 1.0 1.8 5.0 489 308 A 42 ALA H A 41 LYS HDx 1.0 1.8 6.0 490 308 A 41 LYS HD3 A 42 ALA H 1.0 1.8 6.0 491 309 A 41 LYS HA A 42 ALA HB% 1.0 1.8 6.5 492 310 A 42 ALA H A 42 ALA HB% 1.0 1.8 4.0 493 311 A 42 ALA HB% A 46 ASP HB2 1.0 1.8 6.5 494 311 A 42 ALA HB% A 46 ASP HB3 1.0 1.8 6.5 495 312 A 42 ALA HA A 48 ILE HG2% 1.0 1.8 6.5 496 313 A 42 ALA HB% A 107 TRP HZ2 1.0 1.8 6.5 497 314 A 42 ALA HB% A 107 TRP HH2 1.0 1.8 6.5 498 315 A 42 ALA HA A 125 VAL HG1% 1.0 1.8 6.5 499 315 A 42 ALA HA A 125 VAL HG2% 1.0 1.8 6.5 500 316 A 42 ALA HB% A 125 VAL HG1% 1.0 1.8 6.0 501 316 A 125 VAL HG2% A 42 ALA HB% 1.0 1.8 6.0 502 317 A 42 ALA HB% A 125 VAL HB 1.0 1.8 3.8 503 318 A 42 ALA HB% A 126 GLU H 1.0 1.8 6.5 504 319 A 42 ALA H A 127 ALA HA 1.0 1.8 6.0 505 320 A 42 ALA HB% A 127 ALA HA 1.0 1.8 6.5 506 321 A 42 ALA H A 127 ALA HB% 1.0 1.8 6.5 507 322 A 43 HIS HD2 A 43 HIS H 1.0 1.8 6.0 508 323 A 43 HIS HD2 A 43 HIS HA 1.0 1.8 6.0 509 324 A 43 HIS HD2 A 43 HIS HA 1.0 1.8 6.0 510 325 A 44 ALA HB% A 43 HIS HB2 1.0 1.8 6.5 511 325 A 43 HIS HB3 A 44 ALA HB% 1.0 1.8 6.5 512 326 A 43 HIS HA A 44 ALA HB% 1.0 1.8 6.5 513 327 A 43 HIS HA A 44 ALA HB% 1.0 1.8 6.5 514 328 A 43 HIS HA A 103 ILE HD1% 1.0 1.8 6.5 515 329 A 43 HIS H A 103 ILE HD1% 1.0 1.8 6.5 516 330 A 44 ALA HB% A 45 ASN HBx 1.0 1.8 6.5 517 330 A 44 ALA HB% A 45 ASN HB3 1.0 1.8 6.5 518 331 A 44 ALA HB% A 45 ASN HA 1.0 1.8 6.5 519 332 A 44 ALA HA A 99 LEU HB2 1.0 1.8 6.0 520 332 A 44 ALA HA A 99 LEU HB3 1.0 1.8 6.0 521 333 A 44 ALA HB% A 101 SER HA 1.0 1.8 3.8 522 334 A 44 ALA HB% A 102 LEU HA 1.0 1.8 6.5 523 335 A 44 ALA HB% A 103 ILE H 1.0 1.8 6.5 524 336 A 44 ALA HB% A 103 ILE HD1% 1.0 1.8 6.0 525 337 A 103 ILE HD1% A 44 ALA HA 1.0 1.8 6.5 526 338 A 44 ALA HA A 103 ILE HG12 1.0 1.8 6.0 527 338 A 44 ALA HA A 103 ILE HG13 1.0 1.8 6.0 528 339 A 44 ALA HA A 103 ILE HG2% 1.0 1.8 6.5 529 340 A 46 ASP H A 45 ASN HBx 1.0 1.8 6.0 530 340 A 45 ASN HB3 A 46 ASP H 1.0 1.8 6.0 531 341 A 45 ASN HA A 46 ASP H 1.0 1.8 6.0 532 342 A 101 SER HA A 45 ASN H 1.0 1.8 6.0 533 343 A 46 ASP HA A 47 LEU HB2 1.0 1.8 6.0 534 343 A 47 LEU HB3 A 46 ASP HA 1.0 1.8 6.0 535 344 A 48 ILE HG2% A 46 ASP HB2 1.0 1.8 5.5 536 344 A 48 ILE HG2% A 46 ASP HB3 1.0 1.8 5.5 537 345 A 46 ASP H A 99 LEU HG 1.0 1.8 6.0 538 346 A 46 ASP H A 99 LEU HD1% 1.0 1.8 6.5 539 346 A 46 ASP H A 99 LEU HD2% 1.0 1.8 6.5 540 347 A 46 ASP HB3 A 99 LEU HD1% 1.0 1.8 6.5 541 347 A 46 ASP HB2 A 99 LEU HD1% 1.0 1.8 6.5 542 347 A 99 LEU HD2% A 46 ASP HB2 1.0 1.8 6.5 543 347 A 46 ASP HB3 A 99 LEU HD2% 1.0 1.8 6.5 544 348 A 47 LEU H A 47 LEU HD1% 1.0 1.8 6.5 545 348 A 47 LEU HD2% A 47 LEU H 1.0 1.8 6.5 546 349 A 47 LEU HA A 47 LEU H 1.0 1.8 6.0 547 350 A 47 LEU HG A 48 ILE H 1.0 1.8 6.0 548 351 A 48 ILE H A 47 LEU HD1% 1.0 1.8 6.5 549 351 A 47 LEU HD2% A 48 ILE H 1.0 1.8 6.5 550 352 A 48 ILE H A 47 LEU HB2 1.0 1.8 6.0 551 352 A 47 LEU HB3 A 48 ILE H 1.0 1.8 6.0 552 353 A 96 TYR HE% A 47 LEU HD1% 1.0 1.8 6.5 553 353 A 47 LEU HD2% A 96 TYR HE% 1.0 1.8 6.5 554 354 A 47 LEU HD2% A 96 TYR HB2 1.0 1.8 6.5 555 354 A 47 LEU HD1% A 96 TYR HB2 1.0 1.8 6.5 556 354 A 96 TYR HB3 A 47 LEU HD1% 1.0 1.8 6.5 557 354 A 47 LEU HD2% A 96 TYR HB3 1.0 1.8 6.5 558 355 A 97 SER H A 47 LEU HD1% 1.0 1.8 6.5 559 355 A 47 LEU HD2% A 97 SER H 1.0 1.8 6.5 560 356 A 47 LEU HA A 98 ARG HG2 1.0 1.8 6.0 561 356 A 47 LEU HA A 98 ARG HG3 1.0 1.8 6.0 562 357 A 47 LEU HD1% A 98 ARG HD2 1.0 1.8 5.5 563 357 A 47 LEU HD2% A 98 ARG HD2 1.0 1.8 5.5 564 357 A 98 ARG HD3 A 47 LEU HD1% 1.0 1.8 5.5 565 357 A 47 LEU HD2% A 98 ARG HD3 1.0 1.8 5.5 566 358 A 98 ARG H A 47 LEU HD1% 1.0 1.8 6.5 567 358 A 47 LEU HD2% A 98 ARG H 1.0 1.8 6.5 568 359 A 47 LEU HA A 98 ARG HA 1.0 1.8 5.0 569 360 A 98 ARG HA A 47 LEU HD1% 1.0 1.8 6.5 570 360 A 47 LEU HD2% A 98 ARG HA 1.0 1.8 6.5 571 361 A 48 ILE H A 48 ILE HG12 1.0 1.8 6.0 572 361 A 48 ILE H A 48 ILE HG13 1.0 1.8 6.0 573 362 A 48 ILE HA A 48 ILE HB 1.0 1.8 5.0 574 363 A 48 ILE HA A 48 ILE HG2% 1.0 1.8 5.5 575 364 A 48 ILE HG2% A 48 ILE H 1.0 1.8 6.5 576 365 A 48 ILE HA A 48 ILE H 1.0 1.8 6.0 577 366 A 48 ILE H A 48 ILE HD1% 1.0 1.8 6.5 578 367 A 48 ILE HA A 48 ILE HD1% 1.0 1.8 6.5 579 368 A 48 ILE HD1% A 49 GLY H 1.0 1.8 6.5 580 369 A 48 ILE HD1% A 81 LEU HD1% 1.0 1.8 7.0 581 369 A 48 ILE HD1% A 81 LEU HD2% 1.0 1.8 7.0 582 370 A 97 SER H A 48 ILE HG12 1.0 1.8 6.0 583 370 A 97 SER H A 48 ILE HG13 1.0 1.8 6.0 584 371 A 97 SER H A 48 ILE HD1% 1.0 1.8 6.5 585 372 A 48 ILE H A 98 ARG HA 1.0 1.8 6.0 586 373 A 99 LEU HG A 48 ILE HD1% 1.0 1.8 6.5 587 374 A 48 ILE HG2% A 107 TRP HZ2 1.0 1.8 6.5 588 375 A 107 TRP HH2 A 48 ILE HD1% 1.0 1.8 6.5 589 376 A 107 TRP HZ2 A 48 ILE HD1% 1.0 1.8 5.5 590 377 A 48 ILE HD1% A 109 PHE HE% 1.0 1.8 6.5 591 378 A 109 PHE HZ A 48 ILE HG12 1.0 1.8 6.0 592 378 A 48 ILE HG13 A 109 PHE HZ 1.0 1.8 6.0 593 379 A 48 ILE HD1% A 109 PHE HZ 1.0 1.8 5.5 594 380 A 48 ILE HB A 109 PHE HZ 1.0 1.8 6.0 595 381 A 48 ILE HA A 109 PHE HZ 1.0 1.8 6.0 596 382 A 123 PHE HZ A 48 ILE HG12 1.0 1.8 6.0 597 382 A 123 PHE HZ A 48 ILE HG13 1.0 1.8 6.0 598 383 A 123 PHE HZ A 48 ILE HB 1.0 1.8 6.0 599 384 A 48 ILE HB A 125 VAL HG1% 1.0 1.8 6.5 600 384 A 125 VAL HG2% A 48 ILE HB 1.0 1.8 6.5 601 385 A 48 ILE HD1% A 125 VAL HG1% 1.0 1.8 4.3 602 385 A 125 VAL HG2% A 48 ILE HD1% 1.0 1.8 4.3 603 386 A 96 TYR HA A 49 GLY HA2 1.0 1.8 6.0 604 386 A 49 GLY HA3 A 96 TYR HA 1.0 1.8 6.0 605 387 A 96 TYR HD% A 49 GLY HA2 1.0 1.8 6.0 606 387 A 49 GLY HA3 A 96 TYR HD% 1.0 1.8 6.0 607 388 A 49 GLY H A 109 PHE HZ 1.0 1.8 6.0 608 389 A 50 PHE HD% A 50 PHE H 1.0 1.8 6.0 609 390 A 50 PHE HE% A 50 PHE HZ 1.0 1.8 6.0 610 391 A 50 PHE HD% A 50 PHE HB2 1.0 1.8 6.0 611 391 A 50 PHE HD% A 50 PHE HB3 1.0 1.8 6.0 612 392 A 50 PHE HA A 50 PHE HD% 1.0 1.8 6.0 613 393 A 50 PHE HD% A 51 LYS H 1.0 1.8 6.0 614 394 A 50 PHE HE% A 58 VAL HG2% 1.0 1.8 6.5 615 395 A 50 PHE HE% A 58 VAL HG1% 1.0 1.8 6.5 616 396 A 50 PHE HZ A 58 VAL HG2% 1.0 1.8 6.5 617 397 A 50 PHE HZ A 58 VAL HG1% 1.0 1.8 6.5 618 398 A 50 PHE HZ A 63 CYS HB2 1.0 1.8 6.0 619 398 A 50 PHE HZ A 63 CYS HB3 1.0 1.8 6.0 620 399 A 50 PHE HE% A 95 PHE HD% 1.0 1.8 6.0 621 400 A 50 PHE HE% A 95 PHE HB2 1.0 1.8 6.0 622 400 A 50 PHE HE% A 95 PHE HB3 1.0 1.8 6.0 623 401 A 50 PHE HZ A 95 PHE HB2 1.0 1.8 6.0 624 401 A 50 PHE HZ A 95 PHE HB3 1.0 1.8 6.0 625 402 A 109 PHE HZ A 50 PHE HD% 1.0 1.8 6.0 626 403 A 50 PHE HZ A 111 CYS HB2 1.0 1.8 6.0 627 403 A 50 PHE HZ A 111 CYS HB3 1.0 1.8 6.0 628 404 A 50 PHE HE% A 111 CYS HB2 1.0 1.8 6.0 629 404 A 50 PHE HE% A 111 CYS HB3 1.0 1.8 6.0 630 405 A 50 PHE HZ A 112 VAL HG1% 1.0 1.8 6.5 631 405 A 50 PHE HZ A 112 VAL HG2% 1.0 1.8 6.5 632 406 A 50 PHE HE% A 112 VAL HG1% 1.0 1.8 6.5 633 406 A 50 PHE HE% A 112 VAL HG2% 1.0 1.8 6.5 634 407 A 123 PHE HD% A 50 PHE HD% 1.0 1.8 6.0 635 408 A 123 PHE HZ A 50 PHE HD% 1.0 1.8 6.0 636 409 A 123 PHE HE% A 50 PHE HD% 1.0 1.8 6.0 637 410 A 123 PHE HZ A 50 PHE HE% 1.0 1.8 6.0 638 411 A 123 PHE HD% A 50 PHE HE% 1.0 1.8 6.0 639 412 A 123 PHE HD% A 50 PHE HB2 1.0 1.8 6.0 640 412 A 123 PHE HD% A 50 PHE HB3 1.0 1.8 6.0 641 413 A 51 LYS H A 51 LYS HA 1.0 1.8 6.0 642 414 A 94 THR HG2% A 51 LYS HBx 1.0 1.8 6.5 643 414 A 51 LYS HB3 A 94 THR HG2% 1.0 1.8 6.5 644 415 A 94 THR HG2% A 51 LYS HD2 1.0 1.8 6.5 645 415 A 94 THR HG2% A 51 LYS HD3 1.0 1.8 6.5 646 416 A 51 LYS HA A 94 THR HA 1.0 1.8 6.0 647 417 A 94 THR HA A 51 LYS HBx 1.0 1.8 6.0 648 417 A 51 LYS HB3 A 94 THR HA 1.0 1.8 6.0 649 418 A 51 LYS HA A 95 PHE H 1.0 1.8 6.0 650 419 A 52 CYS H A 52 CYS HB3 1.0 1.8 6.0 651 419 A 52 CYS HB2 A 52 CYS H 1.0 1.8 6.0 652 420 A 52 CYS HB2 A 52 CYS H 1.0 1.8 6.0 653 421 A 52 CYS HA A 53 PRO HG2 1.0 1.8 6.0 654 421 A 52 CYS HA A 53 PRO HG3 1.0 1.8 6.0 655 422 A 52 CYS HA A 53 PRO HD2 1.0 1.8 5.0 656 422 A 52 CYS HA A 53 PRO HD3 1.0 1.8 5.0 657 423 A 52 CYS HB3 A 53 PRO HD2 1.0 1.8 6.0 658 423 A 52 CYS HB2 A 53 PRO HD2 1.0 1.8 6.0 659 423 A 53 PRO HD3 A 52 CYS HB3 1.0 1.8 6.0 660 423 A 53 PRO HD3 A 52 CYS HB2 1.0 1.8 6.0 661 424 A 53 PRO HD3 A 52 CYS HB2 1.0 1.8 6.0 662 424 A 52 CYS HB2 A 53 PRO HD2 1.0 1.8 6.0 663 425 A 58 VAL HG1% A 52 CYS HB3 1.0 1.8 6.5 664 425 A 58 VAL HG1% A 52 CYS HB2 1.0 1.8 6.5 665 426 A 58 VAL HG1% A 52 CYS HB2 1.0 1.8 6.5 666 427 A 52 CYS HB2 A 93 ASN HD21 1.0 1.8 6.0 667 427 A 52 CYS HB2 A 93 ASN HD2y 1.0 1.8 6.0 668 428 A 52 CYS HB3 A 93 ASN HD2y 1.0 1.8 6.0 669 428 A 52 CYS HB2 A 93 ASN HD2y 1.0 1.8 6.0 670 428 A 93 ASN HD21 A 52 CYS HB3 1.0 1.8 6.0 671 428 A 52 CYS HB2 A 93 ASN HD21 1.0 1.8 6.0 672 429 A 52 CYS HB2 A 113 CYS HB3 1.0 1.8 6.0 673 429 A 52 CYS HB2 A 113 CYS HB2 1.0 1.8 6.0 674 430 A 52 CYS HB2 A 113 CYS HB2 1.0 1.8 6.0 675 430 A 52 CYS HB3 A 113 CYS HB2 1.0 1.8 6.0 676 430 A 113 CYS HB3 A 52 CYS HB3 1.0 1.8 6.0 677 430 A 52 CYS HB2 A 113 CYS HB3 1.0 1.8 6.0 678 431 A 52 CYS HA A 121 LEU HD1% 1.0 1.8 6.5 679 431 A 52 CYS HA A 121 LEU HD2% 1.0 1.8 6.5 680 432 A 121 LEU HD2% A 52 CYS HB2 1.0 1.8 6.5 681 432 A 52 CYS HB2 A 121 LEU HD1% 1.0 1.8 6.5 682 433 A 56 TYR HE% A 53 PRO HB2 1.0 1.8 6.0 683 433 A 53 PRO HB3 A 56 TYR HE% 1.0 1.8 6.0 684 434 A 56 TYR HD% A 53 PRO HB2 1.0 1.8 6.0 685 434 A 53 PRO HB3 A 56 TYR HD% 1.0 1.8 6.0 686 435 A 56 TYR HD% A 53 PRO HD2 1.0 1.8 6.0 687 435 A 53 PRO HD3 A 56 TYR HD% 1.0 1.8 6.0 688 436 A 56 TYR HD% A 53 PRO HG2 1.0 1.8 6.0 689 436 A 56 TYR HD% A 53 PRO HG3 1.0 1.8 6.0 690 437 A 56 TYR HE% A 53 PRO HG2 1.0 1.8 6.0 691 437 A 56 TYR HE% A 53 PRO HG3 1.0 1.8 6.0 692 438 A 53 PRO HD3 A 56 TYR HB2 1.0 1.8 6.0 693 438 A 53 PRO HD2 A 56 TYR HB2 1.0 1.8 6.0 694 438 A 56 TYR HB3 A 53 PRO HD2 1.0 1.8 6.0 695 438 A 53 PRO HD3 A 56 TYR HB3 1.0 1.8 6.0 696 439 A 53 PRO HD2 A 121 LEU HD1% 1.0 1.8 6.5 697 439 A 53 PRO HD3 A 121 LEU HD1% 1.0 1.8 6.5 698 439 A 121 LEU HD2% A 53 PRO HD2 1.0 1.8 6.5 699 439 A 53 PRO HD3 A 121 LEU HD2% 1.0 1.8 6.5 700 440 A 53 PRO HG3 A 121 LEU HD1% 1.0 1.8 6.5 701 440 A 53 PRO HG2 A 121 LEU HD1% 1.0 1.8 6.5 702 440 A 121 LEU HD2% A 53 PRO HG2 1.0 1.8 6.5 703 440 A 121 LEU HD2% A 53 PRO HG3 1.0 1.8 6.5 704 441 A 54 SER H A 54 SER HB2 1.0 1.8 5.0 705 441 A 54 SER HBy A 54 SER H 1.0 1.8 5.0 706 442 A 55 ASN H A 54 SER HB2 1.0 1.8 6.0 707 442 A 54 SER HBy A 55 ASN H 1.0 1.8 6.0 708 443 A 54 SER HA A 93 ASN HD2y 1.0 1.8 6.0 709 443 A 93 ASN HD21 A 54 SER HA 1.0 1.8 6.0 710 444 A 54 SER HA A 93 ASN HB2 1.0 1.8 6.0 711 444 A 54 SER HA A 93 ASN HB3 1.0 1.8 6.0 712 445 A 56 TYR HD% A 55 ASN H 1.0 1.8 6.0 713 446 A 56 TYR HE% A 55 ASN H 1.0 1.8 6.0 714 447 A 55 ASN HD21 A 115 LYS HEx 1.0 1.8 6.0 715 447 A 55 ASN HD22 A 115 LYS HEx 1.0 1.8 6.0 716 447 A 115 LYS HE3 A 55 ASN HD22 1.0 1.8 6.0 717 447 A 55 ASN HD21 A 115 LYS HE3 1.0 1.8 6.0 718 448 A 56 TYR HD% A 56 TYR HB2 1.0 1.8 5.0 719 448 A 56 TYR HD% A 56 TYR HB3 1.0 1.8 5.0 720 449 A 56 TYR HD% A 56 TYR H 1.0 1.8 6.0 721 450 A 56 TYR HD% A 56 TYR HA 1.0 1.8 6.0 722 451 A 56 TYR HE% A 56 TYR HB2 1.0 1.8 6.0 723 451 A 56 TYR HE% A 56 TYR HB3 1.0 1.8 6.0 724 452 A 56 TYR HE% A 56 TYR H 1.0 1.8 6.0 725 453 A 56 TYR HD% A 113 CYS HA 1.0 1.8 6.0 726 454 A 113 CYS HA A 56 TYR HB2 1.0 1.8 6.0 727 454 A 56 TYR HB3 A 113 CYS HA 1.0 1.8 6.0 728 455 A 56 TYR HD% A 113 CYS HB2 1.0 1.8 6.0 729 455 A 56 TYR HD% A 113 CYS HB3 1.0 1.8 6.0 730 456 A 56 TYR HB2 A 113 CYS HB2 1.0 1.8 6.0 731 456 A 113 CYS HB3 A 56 TYR HB2 1.0 1.8 6.0 732 456 A 113 CYS HB3 A 56 TYR HB3 1.0 1.8 6.0 733 456 A 56 TYR HB3 A 113 CYS HB2 1.0 1.8 6.0 734 457 A 56 TYR HE% A 113 CYS HB2 1.0 1.8 6.0 735 457 A 56 TYR HE% A 113 CYS HB3 1.0 1.8 6.0 736 458 A 56 TYR HD% A 114 SER HA 1.0 1.8 6.0 737 459 A 56 TYR HE% A 114 SER HA 1.0 1.8 6.0 738 460 A 56 TYR HE% A 114 SER H 1.0 1.8 6.0 739 461 A 56 TYR HA A 115 LYS HG2 1.0 1.8 6.0 740 461 A 56 TYR HA A 115 LYS HG3 1.0 1.8 6.0 741 462 A 56 TYR HD% A 115 LYS HG2 1.0 1.8 6.0 742 462 A 56 TYR HD% A 115 LYS HG3 1.0 1.8 6.0 743 463 A 56 TYR HE% A 115 LYS HG2 1.0 1.8 6.0 744 463 A 56 TYR HE% A 115 LYS HG3 1.0 1.8 6.0 745 464 A 56 TYR HD% A 115 LYS HDx 1.0 1.8 6.0 746 464 A 56 TYR HD% A 115 LYS HD3 1.0 1.8 6.0 747 465 A 56 TYR HA A 115 LYS HDx 1.0 1.8 6.0 748 465 A 56 TYR HA A 115 LYS HD3 1.0 1.8 6.0 749 466 A 56 TYR HE% A 115 LYS HB2 1.0 1.8 6.0 750 466 A 56 TYR HE% A 115 LYS HB3 1.0 1.8 6.0 751 467 A 56 TYR HA A 115 LYS HB2 1.0 1.8 6.0 752 467 A 56 TYR HA A 115 LYS HB3 1.0 1.8 6.0 753 468 A 56 TYR HD% A 121 LEU HD1% 1.0 1.8 6.5 754 468 A 121 LEU HD2% A 56 TYR HD% 1.0 1.8 6.5 755 469 A 56 TYR HE% A 121 LEU HD1% 1.0 1.8 6.5 756 469 A 121 LEU HD2% A 56 TYR HE% 1.0 1.8 6.5 757 470 A 56 TYR HA A 121 LEU HD1% 1.0 1.8 6.5 758 470 A 121 LEU HD2% A 56 TYR HA 1.0 1.8 6.5 759 471 A 56 TYR HE% A 121 LEU H 1.0 1.8 6.0 760 472 A 57 SER H A 57 SER HB2 1.0 1.8 5.0 761 472 A 57 SER HB3 A 57 SER H 1.0 1.8 5.0 762 473 A 58 VAL H A 57 SER HB2 1.0 1.8 5.0 763 473 A 57 SER HB3 A 58 VAL H 1.0 1.8 5.0 764 474 A 58 VAL HG1% A 57 SER HA 1.0 1.8 6.5 765 475 A 57 SER H A 115 LYS HDx 1.0 1.8 6.0 766 475 A 115 LYS HD3 A 57 SER H 1.0 1.8 6.0 767 476 A 58 VAL HG1% A 58 VAL HA 1.0 1.8 5.5 768 477 A 58 VAL HG1% A 58 VAL H 1.0 1.8 5.5 769 478 A 58 VAL H A 58 VAL HA 1.0 1.8 6.0 770 479 A 58 VAL HG2% A 58 VAL H 1.0 1.8 6.5 771 480 A 58 VAL H A 58 VAL HB 1.0 1.8 5.0 772 481 A 58 VAL HA A 59 GLU H 1.0 1.8 3.5 773 482 A 58 VAL HG2% A 59 GLU H 1.0 1.8 6.5 774 483 A 58 VAL HG2% A 63 CYS HB2 1.0 1.8 6.5 775 483 A 58 VAL HG2% A 63 CYS HB3 1.0 1.8 6.5 776 484 A 58 VAL HG2% A 90 HIS HE1 1.0 1.8 6.5 777 485 A 58 VAL HG1% A 93 ASN HB2 1.0 1.8 6.5 778 485 A 58 VAL HG1% A 93 ASN HB3 1.0 1.8 6.5 779 486 A 58 VAL HG2% A 95 PHE HD% 1.0 1.8 6.5 780 487 A 58 VAL HG1% A 95 PHE HE% 1.0 1.8 5.5 781 488 A 58 VAL HG2% A 95 PHE HE% 1.0 1.8 6.5 782 489 A 58 VAL HG2% A 95 PHE HZ 1.0 1.8 6.5 783 490 A 58 VAL HB A 95 PHE HZ 1.0 1.8 6.0 784 491 A 58 VAL HG1% A 95 PHE HZ 1.0 1.8 6.5 785 492 A 58 VAL HB A 95 PHE HE% 1.0 1.8 6.0 786 493 A 58 VAL HG2% A 111 CYS HB2 1.0 1.8 6.5 787 493 A 58 VAL HG2% A 111 CYS HB3 1.0 1.8 6.5 788 494 A 58 VAL HG2% A 112 VAL H 1.0 1.8 6.5 789 495 A 113 CYS HA A 58 VAL HA 1.0 1.8 6.0 790 496 A 58 VAL HG2% A 113 CYS HA 1.0 1.8 6.5 791 497 A 58 VAL HG1% A 113 CYS HA 1.0 1.8 6.5 792 498 A 58 VAL HG1% A 113 CYS HB2 1.0 1.8 6.5 793 498 A 58 VAL HG1% A 113 CYS HB3 1.0 1.8 6.5 794 499 A 59 GLU H A 59 GLU HGx 1.0 1.8 6.0 795 499 A 59 GLU H A 59 GLU HG3 1.0 1.8 6.0 796 500 A 59 GLU H A 59 GLU HB2 1.0 1.8 6.0 797 500 A 59 GLU H A 59 GLU HB3 1.0 1.8 6.0 798 501 A 68 PHE HE% A 59 GLU HB2 1.0 1.8 6.0 799 501 A 59 GLU HB3 A 68 PHE HE% 1.0 1.8 6.0 800 502 A 68 PHE HZ A 59 GLU HB2 1.0 1.8 6.0 801 502 A 59 GLU HB3 A 68 PHE HZ 1.0 1.8 6.0 802 503 A 68 PHE HZ A 59 GLU HGx 1.0 1.8 6.0 803 503 A 59 GLU HG3 A 68 PHE HZ 1.0 1.8 6.0 804 504 A 59 GLU H A 112 VAL HG1% 1.0 1.8 6.5 805 504 A 112 VAL HG2% A 59 GLU H 1.0 1.8 6.5 806 505 A 59 GLU H A 112 VAL HB 1.0 1.8 6.0 807 506 A 113 CYS HA A 59 GLU H 1.0 1.8 6.0 808 507 A 60 PRO HB3 A 60 PRO HD2 1.0 1.8 6.0 809 507 A 60 PRO HB2 A 60 PRO HD2 1.0 1.8 6.0 810 507 A 60 PRO HD3 A 60 PRO HB2 1.0 1.8 6.0 811 507 A 60 PRO HB3 A 60 PRO HD3 1.0 1.8 6.0 812 508 A 61 HIS HA A 60 PRO HB2 1.0 1.8 6.0 813 508 A 60 PRO HB3 A 61 HIS HA 1.0 1.8 6.0 814 509 A 61 HIS H A 60 PRO HB2 1.0 1.8 6.0 815 509 A 60 PRO HB3 A 61 HIS H 1.0 1.8 6.0 816 510 A 60 PRO HG2 A 66 SER HB2 1.0 1.8 6.0 817 510 A 66 SER HB3 A 60 PRO HG2 1.0 1.8 6.0 818 510 A 60 PRO HG3 A 66 SER HB3 1.0 1.8 6.0 819 510 A 60 PRO HG3 A 66 SER HB2 1.0 1.8 6.0 820 511 A 68 PHE HE% A 60 PRO HD2 1.0 1.8 6.0 821 511 A 68 PHE HE% A 60 PRO HD3 1.0 1.8 6.0 822 512 A 68 PHE HZ A 60 PRO HB2 1.0 1.8 6.0 823 512 A 68 PHE HZ A 60 PRO HB3 1.0 1.8 6.0 824 513 A 95 PHE HE% A 60 PRO HD2 1.0 1.8 6.0 825 513 A 95 PHE HE% A 60 PRO HD3 1.0 1.8 6.0 826 514 A 95 PHE HE% A 60 PRO HB2 1.0 1.8 6.0 827 514 A 95 PHE HE% A 60 PRO HB3 1.0 1.8 6.0 828 515 A 111 CYS HA A 60 PRO HD2 1.0 1.8 6.0 829 515 A 60 PRO HD3 A 111 CYS HA 1.0 1.8 6.0 830 516 A 61 HIS HD2 A 61 HIS HB2 1.0 1.8 6.0 831 516 A 61 HIS HB3 A 61 HIS HD2 1.0 1.8 6.0 832 517 A 61 HIS HA A 61 HIS H 1.0 1.8 6.0 833 518 A 61 HIS HA A 63 CYS H 1.0 1.8 6.0 834 519 A 62 ASP HA A 62 ASP HB2 1.0 1.8 6.0 835 520 A 62 ASP HA A 62 ASP HB3 1.0 1.8 6.0 836 520 A 62 ASP HA A 62 ASP HB2 1.0 1.8 6.0 837 521 A 62 ASP HA A 109 PHE HA 1.0 1.8 6.0 838 522 A 63 CYS H A 63 CYS HB2 1.0 1.8 6.0 839 522 A 63 CYS HB3 A 63 CYS H 1.0 1.8 6.0 840 523 A 63 CYS H A 63 CYS HA 1.0 1.8 6.0 841 524 A 63 CYS HA A 64 PHE H 1.0 1.8 3.5 842 525 A 63 CYS HA A 65 VAL H 1.0 1.8 6.0 843 526 A 68 PHE HD% A 63 CYS HB2 1.0 1.8 6.0 844 526 A 63 CYS HB3 A 68 PHE HD% 1.0 1.8 6.0 845 527 A 64 PHE HD% A 64 PHE HE% 1.0 1.8 6.0 846 528 A 64 PHE HD% A 64 PHE HB2 1.0 1.8 6.0 847 528 A 64 PHE HD% A 64 PHE HB3 1.0 1.8 6.0 848 529 A 64 PHE H A 64 PHE HB2 1.0 1.8 6.0 849 529 A 64 PHE H A 64 PHE HB3 1.0 1.8 6.0 850 530 A 64 PHE HE% A 83 LEU HD1% 1.0 1.8 5.5 851 530 A 64 PHE HE% A 83 LEU HD2% 1.0 1.8 5.5 852 531 A 64 PHE HE% A 86 ILE HA 1.0 1.8 6.0 853 532 A 64 PHE HE% A 86 ILE HG2% 1.0 1.8 6.5 854 533 A 64 PHE HZ A 86 ILE HD1% 1.0 1.8 6.5 855 534 A 64 PHE HE% A 86 ILE HD1% 1.0 1.8 6.5 856 535 A 64 PHE HE% A 95 PHE HB2 1.0 1.8 6.0 857 535 A 95 PHE HB3 A 64 PHE HE% 1.0 1.8 6.0 858 536 A 96 TYR HA A 64 PHE HE% 1.0 1.8 6.0 859 537 A 64 PHE HE% A 97 SER HB2 1.0 1.8 6.0 860 537 A 64 PHE HE% A 97 SER HB3 1.0 1.8 6.0 861 538 A 65 VAL H A 65 VAL HB 1.0 1.8 6.0 862 539 A 65 VAL HG1% A 65 VAL HA 1.0 1.8 3.8 863 540 A 65 VAL H A 65 VAL HG1% 1.0 1.8 6.5 864 541 A 65 VAL HA A 65 VAL HG2% 1.0 1.8 3.8 865 542 A 65 VAL HB A 66 SER H 1.0 1.8 6.0 866 543 A 65 VAL H A 66 SER HB2 1.0 1.8 6.0 867 543 A 66 SER HB3 A 65 VAL H 1.0 1.8 6.0 868 544 A 65 VAL HG1% A 66 SER H 1.0 1.8 6.5 869 545 A 65 VAL HG2% A 66 SER H 1.0 1.8 6.5 870 546 A 65 VAL HG2% A 76 ASN HD22 1.0 1.8 6.5 871 546 A 65 VAL HG2% A 76 ASN HD21 1.0 1.8 6.5 872 547 A 65 VAL HG2% A 78 GLU HB2 1.0 1.8 6.5 873 547 A 65 VAL HG2% A 78 GLU HB3 1.0 1.8 6.5 874 548 A 65 VAL HA A 78 GLU H 1.0 1.8 6.0 875 549 A 65 VAL HA A 78 GLU HB2 1.0 1.8 6.0 876 549 A 65 VAL HA A 78 GLU HB3 1.0 1.8 6.0 877 550 A 65 VAL HG2% A 78 GLU HGx 1.0 1.8 6.5 878 550 A 65 VAL HG2% A 78 GLU HG3 1.0 1.8 6.5 879 551 A 86 ILE HD1% A 65 VAL HA 1.0 1.8 6.5 880 552 A 65 VAL HG1% A 88 MET HE% 1.0 1.8 3.8 881 553 A 65 VAL H A 88 MET HE% 1.0 1.8 6.5 882 554 A 66 SER H A 66 SER HB2 1.0 1.8 6.0 883 554 A 66 SER HB3 A 66 SER H 1.0 1.8 6.0 884 555 A 66 SER H A 67 ALA HA 1.0 1.8 6.0 885 556 A 66 SER HB3 A 74 ASN HD22 1.0 1.8 6.0 886 556 A 66 SER HB2 A 74 ASN HD22 1.0 1.8 6.0 887 556 A 74 ASN HD21 A 66 SER HB2 1.0 1.8 6.0 888 556 A 66 SER HB3 A 74 ASN HD21 1.0 1.8 6.0 889 557 A 76 ASN HA A 66 SER HB2 1.0 1.8 6.0 890 557 A 66 SER HB3 A 76 ASN HA 1.0 1.8 6.0 891 558 A 76 ASN HA A 66 SER HA 1.0 1.8 6.0 892 559 A 88 MET HE% A 66 SER HA 1.0 1.8 6.5 893 560 A 67 ALA HB% A 67 ALA H 1.0 1.8 6.5 894 561 A 67 ALA HB% A 77 LEU HD1% 1.0 1.8 7.0 895 561 A 67 ALA HB% A 77 LEU HD2% 1.0 1.8 7.0 896 562 A 67 ALA HB% A 109 PHE HD% 1.0 1.8 5.5 897 563 A 109 PHE HE% A 67 ALA HB% 1.0 1.8 6.5 898 564 A 67 ALA HB% A 109 PHE HBx 1.0 1.8 6.5 899 564 A 67 ALA HB% A 109 PHE HB3 1.0 1.8 6.5 900 565 A 68 PHE HD% A 68 PHE HA 1.0 1.8 6.0 901 566 A 68 PHE HD% A 68 PHE HB2 1.0 1.8 6.0 902 566 A 68 PHE HD% A 68 PHE HB3 1.0 1.8 6.0 903 567 A 68 PHE HD% A 69 ASN H 1.0 1.8 6.0 904 568 A 68 PHE HA A 69 ASN H 1.0 1.8 5.0 905 569 A 68 PHE HD% A 74 ASN HA 1.0 1.8 6.0 906 570 A 68 PHE HE% A 74 ASN HB2 1.0 1.8 6.0 907 570 A 68 PHE HE% A 74 ASN HB3 1.0 1.8 6.0 908 571 A 69 ASN HB2 A 69 ASN HD22 1.0 1.8 6.0 909 571 A 69 ASN HB3 A 69 ASN HD22 1.0 1.8 6.0 910 571 A 69 ASN HD21 A 69 ASN HB2 1.0 1.8 6.0 911 571 A 69 ASN HB3 A 69 ASN HD21 1.0 1.8 6.0 912 572 A 69 ASN HA A 70 LEU H 1.0 1.8 5.0 913 573 A 69 ASN HD22 A 73 LYS HB2 1.0 1.8 6.0 914 573 A 69 ASN HD21 A 73 LYS HB2 1.0 1.8 6.0 915 573 A 73 LYS HB3 A 69 ASN HD22 1.0 1.8 6.0 916 573 A 69 ASN HD21 A 73 LYS HB3 1.0 1.8 6.0 917 574 A 69 ASN H A 74 ASN HA 1.0 1.8 6.0 918 575 A 70 LEU H A 70 LEU HD1% 1.0 1.8 6.5 919 575 A 70 LEU H A 70 LEU HD2% 1.0 1.8 6.5 920 576 A 70 LEU HA A 70 LEU HD1% 1.0 1.8 5.5 921 576 A 70 LEU HD2% A 70 LEU HA 1.0 1.8 5.5 922 577 A 70 LEU H A 70 LEU HBx 1.0 1.8 5.0 923 577 A 70 LEU H A 70 LEU HB3 1.0 1.8 5.0 924 578 A 70 LEU HA A 70 LEU HBx 1.0 1.8 5.0 925 578 A 70 LEU HA A 70 LEU HB3 1.0 1.8 5.0 926 579 A 70 LEU H A 70 LEU HA 1.0 1.8 5.0 927 580 A 71 SER H A 70 LEU HBx 1.0 1.8 6.0 928 580 A 70 LEU HB3 A 71 SER H 1.0 1.8 6.0 929 581 A 70 LEU HD2% A 108 LYS HB2 1.0 1.8 4.0 930 581 A 70 LEU HD1% A 108 LYS HB2 1.0 1.8 4.0 931 581 A 108 LYS HB3 A 70 LEU HD1% 1.0 1.8 4.0 932 581 A 70 LEU HD2% A 108 LYS HB3 1.0 1.8 4.0 933 582 A 70 LEU HD2% A 108 LYS HGx 1.0 1.8 4.0 934 582 A 70 LEU HD1% A 108 LYS HGx 1.0 1.8 4.0 935 582 A 108 LYS HG3 A 70 LEU HD1% 1.0 1.8 4.0 936 582 A 70 LEU HD2% A 108 LYS HG3 1.0 1.8 4.0 937 583 A 110 PHE HD% A 70 LEU HD1% 1.0 1.8 6.5 938 583 A 70 LEU HD2% A 110 PHE HD% 1.0 1.8 6.5 939 584 A 110 PHE HE% A 70 LEU HD1% 1.0 1.8 6.5 940 584 A 70 LEU HD2% A 110 PHE HE% 1.0 1.8 6.5 941 585 A 110 PHE HZ A 70 LEU HD1% 1.0 1.8 4.0 942 585 A 70 LEU HD2% A 110 PHE HZ 1.0 1.8 4.0 943 586 A 110 PHE HE% A 70 LEU HBx 1.0 1.8 6.0 944 586 A 70 LEU HB3 A 110 PHE HE% 1.0 1.8 6.0 945 587 A 71 SER HBx A 73 LYS HGx 1.0 1.8 6.0 946 587 A 71 SER HB3 A 73 LYS HGx 1.0 1.8 6.0 947 587 A 73 LYS HG3 A 71 SER HBx 1.0 1.8 6.0 948 587 A 71 SER HB3 A 73 LYS HG3 1.0 1.8 6.0 949 588 A 72 GLY H A 72 GLY HA2 1.0 1.8 6.0 950 588 A 72 GLY HA3 A 72 GLY H 1.0 1.8 6.0 951 589 A 110 PHE HZ A 72 GLY HA2 1.0 1.8 6.0 952 589 A 110 PHE HZ A 72 GLY HA3 1.0 1.8 6.0 953 590 A 110 PHE HE% A 72 GLY HA2 1.0 1.8 6.0 954 590 A 110 PHE HE% A 72 GLY HA3 1.0 1.8 6.0 955 591 A 73 LYS HA A 73 LYS H 1.0 1.8 6.0 956 592 A 73 LYS H A 73 LYS HB2 1.0 1.8 6.0 957 592 A 73 LYS HB3 A 73 LYS H 1.0 1.8 6.0 958 593 A 74 ASN H A 73 LYS HGx 1.0 1.8 6.0 959 593 A 73 LYS HG3 A 74 ASN H 1.0 1.8 6.0 960 594 A 74 ASN HB2 A 74 ASN HD22 1.0 1.8 6.0 961 594 A 74 ASN HB3 A 74 ASN HD22 1.0 1.8 6.0 962 594 A 74 ASN HD21 A 74 ASN HB2 1.0 1.8 6.0 963 594 A 74 ASN HD21 A 74 ASN HB3 1.0 1.8 6.0 964 595 A 74 ASN H A 74 ASN HB2 1.0 1.8 6.0 965 595 A 74 ASN HB3 A 74 ASN H 1.0 1.8 6.0 966 596 A 75 GLU H A 74 ASN HB2 1.0 1.8 6.0 967 596 A 74 ASN HB3 A 75 GLU H 1.0 1.8 6.0 968 597 A 75 GLU H A 75 GLU HGx 1.0 1.8 6.0 969 597 A 75 GLU H A 75 GLU HG3 1.0 1.8 6.0 970 598 A 75 GLU H A 75 GLU HBx 1.0 1.8 6.0 971 598 A 75 GLU H A 75 GLU HB3 1.0 1.8 6.0 972 599 A 76 ASN H A 76 ASN HBx 1.0 1.8 5.0 973 599 A 76 ASN HB3 A 76 ASN H 1.0 1.8 5.0 974 600 A 76 ASN HB3 A 76 ASN HD22 1.0 1.8 5.0 975 600 A 76 ASN HBx A 76 ASN HD22 1.0 1.8 5.0 976 600 A 76 ASN HD21 A 76 ASN HBx 1.0 1.8 5.0 977 600 A 76 ASN HD21 A 76 ASN HB3 1.0 1.8 5.0 978 601 A 77 LEU HA A 77 LEU HD1% 1.0 1.8 6.5 979 601 A 77 LEU HD2% A 77 LEU HA 1.0 1.8 6.5 980 602 A 77 LEU H A 77 LEU HB2 1.0 1.8 6.0 981 602 A 77 LEU HB3 A 77 LEU H 1.0 1.8 6.0 982 603 A 77 LEU HA A 77 LEU H 1.0 1.8 6.0 983 604 A 78 GLU H A 77 LEU HG 1.0 1.8 6.0 984 605 A 78 GLU H A 77 LEU HB2 1.0 1.8 6.0 985 605 A 78 GLU H A 77 LEU HB3 1.0 1.8 6.0 986 606 A 77 LEU HD1% A 80 LYS HGx 1.0 1.8 6.5 987 606 A 77 LEU HD2% A 80 LYS HGx 1.0 1.8 6.5 988 606 A 80 LYS HG3 A 77 LEU HD1% 1.0 1.8 6.5 989 606 A 77 LEU HD2% A 80 LYS HG3 1.0 1.8 6.5 990 607 A 77 LEU HA A 80 LYS HGx 1.0 1.8 6.0 991 607 A 77 LEU HA A 80 LYS HG3 1.0 1.8 6.0 992 608 A 77 LEU HA A 80 LYS HBx 1.0 1.8 5.0 993 608 A 77 LEU HA A 80 LYS HB3 1.0 1.8 5.0 994 609 A 77 LEU HD1% A 80 LYS HBx 1.0 1.8 6.5 995 609 A 77 LEU HD2% A 80 LYS HBx 1.0 1.8 6.5 996 609 A 80 LYS HB3 A 77 LEU HD1% 1.0 1.8 6.5 997 609 A 77 LEU HD2% A 80 LYS HB3 1.0 1.8 6.5 998 610 A 81 LEU H A 77 LEU HD1% 1.0 1.8 6.5 999 610 A 77 LEU HD2% A 81 LEU H 1.0 1.8 6.5 1000 611 A 77 LEU HA A 81 LEU H 1.0 1.8 6.0 1001 612 A 77 LEU HD1% A 83 LEU HD1% 1.0 1.8 6.0 1002 612 A 77 LEU HD2% A 83 LEU HD1% 1.0 1.8 6.0 1003 612 A 83 LEU HD2% A 77 LEU HD1% 1.0 1.8 6.0 1004 612 A 83 LEU HD2% A 77 LEU HD2% 1.0 1.8 6.0 1005 613 A 77 LEU HD1% A 107 TRP HB2 1.0 1.8 6.5 1006 613 A 77 LEU HD2% A 107 TRP HB2 1.0 1.8 6.5 1007 613 A 107 TRP HB3 A 77 LEU HD1% 1.0 1.8 6.5 1008 613 A 77 LEU HD2% A 107 TRP HB3 1.0 1.8 6.5 1009 614 A 109 PHE HD% A 77 LEU HD1% 1.0 1.8 6.5 1010 614 A 77 LEU HD2% A 109 PHE HD% 1.0 1.8 6.5 1011 615 A 109 PHE HE% A 77 LEU HD1% 1.0 1.8 6.5 1012 615 A 109 PHE HE% A 77 LEU HD2% 1.0 1.8 6.5 1013 616 A 109 PHE HZ A 77 LEU HD1% 1.0 1.8 6.5 1014 616 A 109 PHE HZ A 77 LEU HD2% 1.0 1.8 6.5 1015 617 A 78 GLU H A 78 GLU HA 1.0 1.8 6.0 1016 618 A 78 GLU HA A 80 LYS H 1.0 1.8 6.0 1017 619 A 78 GLU HB3 A 83 LEU HD1% 1.0 1.8 6.5 1018 619 A 78 GLU HB2 A 83 LEU HD1% 1.0 1.8 6.5 1019 619 A 83 LEU HD2% A 78 GLU HB2 1.0 1.8 6.5 1020 619 A 83 LEU HD2% A 78 GLU HB3 1.0 1.8 6.5 1021 620 A 78 GLU HA A 83 LEU HD1% 1.0 1.8 6.5 1022 620 A 83 LEU HD2% A 78 GLU HA 1.0 1.8 6.5 1023 621 A 78 GLU HA A 83 LEU HB2 1.0 1.8 6.0 1024 621 A 78 GLU HA A 83 LEU HB3 1.0 1.8 6.0 1025 622 A 78 GLU HA A 83 LEU H 1.0 1.8 6.0 1026 623 A 78 GLU HGx A 83 LEU HD1% 1.0 1.8 6.5 1027 623 A 78 GLU HG3 A 83 LEU HD1% 1.0 1.8 6.5 1028 623 A 83 LEU HD2% A 78 GLU HGx 1.0 1.8 6.5 1029 623 A 83 LEU HD2% A 78 GLU HG3 1.0 1.8 6.5 1030 624 A 79 ASN HA A 79 ASN H 1.0 1.8 6.0 1031 625 A 79 ASN HBx A 80 LYS HBx 1.0 1.8 6.0 1032 625 A 79 ASN HB3 A 80 LYS HBx 1.0 1.8 6.0 1033 625 A 80 LYS HB3 A 79 ASN HBx 1.0 1.8 6.0 1034 625 A 80 LYS HB3 A 79 ASN HB3 1.0 1.8 6.0 1035 626 A 80 LYS H A 80 LYS HBx 1.0 1.8 5.0 1036 626 A 80 LYS HB3 A 80 LYS H 1.0 1.8 5.0 1037 627 A 81 LEU H A 80 LYS HBx 1.0 1.8 6.0 1038 627 A 80 LYS HB3 A 81 LEU H 1.0 1.8 6.0 1039 628 A 81 LEU HA A 80 LYS HBx 1.0 1.8 6.0 1040 628 A 80 LYS HB3 A 81 LEU HA 1.0 1.8 6.0 1041 629 A 107 TRP HD1 A 80 LYS HGx 1.0 1.8 6.0 1042 629 A 80 LYS HG3 A 107 TRP HD1 1.0 1.8 6.0 1043 630 A 107 TRP HH2 A 80 LYS HGx 1.0 1.8 6.0 1044 630 A 107 TRP HH2 A 80 LYS HG3 1.0 1.8 6.0 1045 631 A 81 LEU HA A 81 LEU HB2 1.0 1.8 6.0 1046 631 A 81 LEU HA A 81 LEU HB3 1.0 1.8 6.0 1047 632 A 81 LEU HA A 81 LEU HD1% 1.0 1.8 5.5 1048 632 A 81 LEU HD2% A 81 LEU HA 1.0 1.8 5.5 1049 633 A 81 LEU HA A 82 LYS H 1.0 1.8 3.5 1050 634 A 83 LEU HG A 81 LEU HD1% 1.0 1.8 6.5 1051 634 A 81 LEU HD2% A 83 LEU HG 1.0 1.8 6.5 1052 635 A 81 LEU HD2% A 83 LEU HD1% 1.0 1.8 6.0 1053 635 A 81 LEU HD1% A 83 LEU HD1% 1.0 1.8 6.0 1054 635 A 83 LEU HD2% A 81 LEU HD1% 1.0 1.8 6.0 1055 635 A 81 LEU HD2% A 83 LEU HD2% 1.0 1.8 6.0 1056 636 A 81 LEU HB3 A 83 LEU HD1% 1.0 1.8 6.5 1057 636 A 81 LEU HB2 A 83 LEU HD1% 1.0 1.8 6.5 1058 636 A 83 LEU HD2% A 81 LEU HB2 1.0 1.8 6.5 1059 636 A 83 LEU HD2% A 81 LEU HB3 1.0 1.8 6.5 1060 637 A 81 LEU HD2% A 99 LEU HD1% 1.0 1.8 7.0 1061 637 A 81 LEU HD1% A 99 LEU HD1% 1.0 1.8 7.0 1062 637 A 99 LEU HD2% A 81 LEU HD1% 1.0 1.8 7.0 1063 637 A 99 LEU HD2% A 81 LEU HD2% 1.0 1.8 7.0 1064 638 A 81 LEU HD2% A 100 PRO HD2 1.0 1.8 6.5 1065 638 A 100 PRO HD3 A 81 LEU HD1% 1.0 1.8 6.5 1066 638 A 81 LEU HD2% A 100 PRO HD3 1.0 1.8 6.5 1067 638 A 81 LEU HD1% A 100 PRO HD2 1.0 1.8 6.5 1068 639 A 81 LEU HD1% A 100 PRO HG2 1.0 1.8 6.5 1069 639 A 81 LEU HD2% A 100 PRO HG2 1.0 1.8 6.5 1070 639 A 100 PRO HG3 A 81 LEU HD1% 1.0 1.8 6.5 1071 639 A 81 LEU HD2% A 100 PRO HG3 1.0 1.8 6.5 1072 640 A 103 ILE HG2% A 81 LEU HD1% 1.0 1.8 6.0 1073 640 A 103 ILE HG2% A 81 LEU HD2% 1.0 1.8 6.0 1074 641 A 103 ILE HD1% A 81 LEU HD1% 1.0 1.8 7.0 1075 641 A 103 ILE HD1% A 81 LEU HD2% 1.0 1.8 7.0 1076 642 A 103 ILE HG2% A 81 LEU HA 1.0 1.8 6.5 1077 643 A 107 TRP HZ2 A 81 LEU HD1% 1.0 1.8 6.5 1078 643 A 107 TRP HZ2 A 81 LEU HD2% 1.0 1.8 6.5 1079 644 A 107 TRP HD1 A 81 LEU HD1% 1.0 1.8 6.5 1080 644 A 81 LEU HD2% A 107 TRP HD1 1.0 1.8 6.5 1081 645 A 107 TRP HH2 A 81 LEU HD1% 1.0 1.8 6.5 1082 645 A 107 TRP HH2 A 81 LEU HD2% 1.0 1.8 6.5 1083 646 A 107 TRP HE1 A 81 LEU HD1% 1.0 1.8 6.5 1084 646 A 81 LEU HD2% A 107 TRP HE1 1.0 1.8 6.5 1085 647 A 107 TRP HH2 A 81 LEU HB2 1.0 1.8 6.0 1086 647 A 107 TRP HH2 A 81 LEU HB3 1.0 1.8 6.0 1087 648 A 107 TRP HE3 A 81 LEU HD1% 1.0 1.8 6.5 1088 648 A 81 LEU HD2% A 107 TRP HE3 1.0 1.8 6.5 1089 649 A 127 ALA HB% A 81 LEU HD1% 1.0 1.8 7.0 1090 649 A 127 ALA HB% A 81 LEU HD2% 1.0 1.8 7.0 1091 650 A 82 LYS H A 82 LYS HBx 1.0 1.8 5.0 1092 650 A 82 LYS H A 82 LYS HB3 1.0 1.8 5.0 1093 651 A 82 LYS H A 82 LYS HDx 1.0 1.8 6.0 1094 651 A 82 LYS H A 82 LYS HD3 1.0 1.8 6.0 1095 652 A 82 LYS H A 82 LYS HA 1.0 1.8 3.5 1096 653 A 82 LYS HA A 82 LYS HBx 1.0 1.8 3.3 1097 653 A 82 LYS HB3 A 82 LYS HA 1.0 1.8 3.3 1098 654 A 83 LEU H A 82 LYS HBx 1.0 1.8 6.0 1099 654 A 83 LEU H A 82 LYS HB3 1.0 1.8 6.0 1100 655 A 82 LYS HB3 A 100 PRO HB2 1.0 1.8 6.0 1101 655 A 82 LYS HBx A 100 PRO HB2 1.0 1.8 6.0 1102 655 A 100 PRO HB3 A 82 LYS HBx 1.0 1.8 6.0 1103 655 A 82 LYS HB3 A 100 PRO HB3 1.0 1.8 6.0 1104 656 A 83 LEU H A 83 LEU HG 1.0 1.8 6.0 1105 657 A 83 LEU H A 83 LEU HD1% 1.0 1.8 6.5 1106 657 A 83 LEU HD2% A 83 LEU H 1.0 1.8 6.5 1107 658 A 83 LEU HA A 83 LEU HD1% 1.0 1.8 3.8 1108 658 A 83 LEU HD2% A 83 LEU HA 1.0 1.8 3.8 1109 659 A 83 LEU HB2 A 83 LEU HD1% 1.0 1.8 5.5 1110 659 A 83 LEU HB3 A 83 LEU HD1% 1.0 1.8 5.5 1111 659 A 83 LEU HD2% A 83 LEU HB2 1.0 1.8 5.5 1112 659 A 83 LEU HD2% A 83 LEU HB3 1.0 1.8 5.5 1113 660 A 83 LEU H A 83 LEU HB2 1.0 1.8 6.0 1114 660 A 83 LEU HB3 A 83 LEU H 1.0 1.8 6.0 1115 661 A 83 LEU H A 83 LEU HA 1.0 1.8 6.0 1116 662 A 83 LEU HD2% A 97 SER HB2 1.0 1.8 6.5 1117 662 A 83 LEU HD1% A 97 SER HB2 1.0 1.8 6.5 1118 662 A 97 SER HB3 A 83 LEU HD1% 1.0 1.8 6.5 1119 662 A 83 LEU HD2% A 97 SER HB3 1.0 1.8 6.5 1120 663 A 83 LEU HB3 A 97 SER HB2 1.0 1.8 6.0 1121 663 A 83 LEU HB2 A 97 SER HB2 1.0 1.8 6.0 1122 663 A 97 SER HB3 A 83 LEU HB2 1.0 1.8 6.0 1123 663 A 97 SER HB3 A 83 LEU HB3 1.0 1.8 6.0 1124 664 A 98 ARG H A 83 LEU HD1% 1.0 1.8 6.5 1125 664 A 98 ARG H A 83 LEU HD2% 1.0 1.8 6.5 1126 665 A 99 LEU HA A 83 LEU HD1% 1.0 1.8 6.5 1127 665 A 83 LEU HD2% A 99 LEU HA 1.0 1.8 6.5 1128 666 A 99 LEU HG A 83 LEU HD1% 1.0 1.8 6.5 1129 666 A 99 LEU HG A 83 LEU HD2% 1.0 1.8 6.5 1130 667 A 83 LEU HD2% A 100 PRO HD2 1.0 1.8 5.5 1131 667 A 83 LEU HD1% A 100 PRO HD2 1.0 1.8 5.5 1132 667 A 100 PRO HD3 A 83 LEU HD1% 1.0 1.8 5.5 1133 667 A 83 LEU HD2% A 100 PRO HD3 1.0 1.8 5.5 1134 668 A 83 LEU HA A 100 PRO HD2 1.0 1.8 6.0 1135 668 A 100 PRO HD3 A 83 LEU HA 1.0 1.8 6.0 1136 669 A 84 THR HA A 86 ILE HG12 1.0 1.8 6.0 1137 669 A 84 THR HA A 86 ILE HG13 1.0 1.8 6.0 1138 670 A 86 ILE HD1% A 84 THR H 1.0 1.8 6.5 1139 671 A 98 ARG H A 84 THR HG2% 1.0 1.8 6.5 1140 672 A 84 THR HG2% A 100 PRO HB2 1.0 1.8 6.5 1141 672 A 100 PRO HB3 A 84 THR HG2% 1.0 1.8 6.5 1142 673 A 85 ASN HA A 85 ASN HD22 1.0 1.8 6.0 1143 673 A 85 ASN HA A 85 ASN HD21 1.0 1.8 6.0 1144 674 A 85 ASN HA A 85 ASN H 1.0 1.8 5.0 1145 675 A 85 ASN HA A 85 ASN HB2 1.0 1.8 6.0 1146 675 A 85 ASN HA A 85 ASN HB3 1.0 1.8 6.0 1147 676 A 85 ASN HB2 A 86 ILE HG12 1.0 1.8 6.0 1148 676 A 85 ASN HB3 A 86 ILE HG12 1.0 1.8 6.0 1149 676 A 86 ILE HG13 A 85 ASN HB2 1.0 1.8 6.0 1150 676 A 86 ILE HG13 A 85 ASN HB3 1.0 1.8 6.0 1151 677 A 87 ILE HD1% A 85 ASN HD22 1.0 1.8 6.5 1152 677 A 85 ASN HD21 A 87 ILE HD1% 1.0 1.8 6.5 1153 678 A 85 ASN HB3 A 98 ARG HB2 1.0 1.8 6.0 1154 678 A 85 ASN HB2 A 98 ARG HB2 1.0 1.8 6.0 1155 678 A 98 ARG HB3 A 85 ASN HB2 1.0 1.8 6.0 1156 678 A 85 ASN HB3 A 98 ARG HB3 1.0 1.8 6.0 1157 679 A 86 ILE HA A 86 ILE HG12 1.0 1.8 6.0 1158 679 A 86 ILE HA A 86 ILE HG13 1.0 1.8 6.0 1159 680 A 86 ILE H A 86 ILE HG12 1.0 1.8 6.0 1160 680 A 86 ILE HG13 A 86 ILE H 1.0 1.8 6.0 1161 681 A 86 ILE HA A 86 ILE H 1.0 1.8 6.0 1162 682 A 86 ILE H A 86 ILE HB 1.0 1.8 5.0 1163 683 A 86 ILE HD1% A 86 ILE H 1.0 1.8 6.5 1164 684 A 87 ILE H A 86 ILE HG12 1.0 1.8 6.0 1165 684 A 86 ILE HG13 A 87 ILE H 1.0 1.8 6.0 1166 685 A 86 ILE HA A 87 ILE HB 1.0 1.8 6.0 1167 686 A 86 ILE HB A 87 ILE H 1.0 1.8 6.0 1168 687 A 86 ILE HG2% A 88 MET HG2 1.0 1.8 6.5 1169 687 A 86 ILE HG2% A 88 MET HG3 1.0 1.8 6.5 1170 688 A 88 MET HE% A 86 ILE HG12 1.0 1.8 6.5 1171 688 A 88 MET HE% A 86 ILE HG13 1.0 1.8 6.5 1172 689 A 86 ILE HD1% A 88 MET HE% 1.0 1.8 7.0 1173 690 A 86 ILE HG2% A 96 TYR HB2 1.0 1.8 6.5 1174 690 A 96 TYR HB3 A 86 ILE HG2% 1.0 1.8 6.5 1175 691 A 97 SER HA A 86 ILE HG12 1.0 1.8 6.0 1176 691 A 86 ILE HG13 A 97 SER HA 1.0 1.8 6.0 1177 692 A 86 ILE HG13 A 97 SER HB2 1.0 1.8 6.0 1178 692 A 86 ILE HG12 A 97 SER HB2 1.0 1.8 6.0 1179 692 A 97 SER HB3 A 86 ILE HG12 1.0 1.8 6.0 1180 692 A 97 SER HB3 A 86 ILE HG13 1.0 1.8 6.0 1181 693 A 86 ILE HD1% A 97 SER HB2 1.0 1.8 6.5 1182 693 A 86 ILE HD1% A 97 SER HB3 1.0 1.8 6.5 1183 694 A 86 ILE HA A 97 SER HB2 1.0 1.8 6.0 1184 694 A 86 ILE HA A 97 SER HB3 1.0 1.8 6.0 1185 695 A 86 ILE HG2% A 97 SER HB2 1.0 1.8 6.5 1186 695 A 86 ILE HG2% A 97 SER HB3 1.0 1.8 6.5 1187 696 A 98 ARG H A 86 ILE HA 1.0 1.8 6.0 1188 697 A 87 ILE H A 87 ILE HG12 1.0 1.8 6.0 1189 697 A 87 ILE H A 87 ILE HG13 1.0 1.8 6.0 1190 698 A 87 ILE H A 87 ILE HB 1.0 1.8 6.0 1191 699 A 87 ILE H A 87 ILE HA 1.0 1.8 6.0 1192 700 A 87 ILE HD1% A 87 ILE H 1.0 1.8 6.5 1193 701 A 88 MET HE% A 87 ILE HA 1.0 1.8 6.5 1194 702 A 87 ILE HG2% A 88 MET HG2 1.0 1.8 6.5 1195 702 A 88 MET HG3 A 87 ILE HG2% 1.0 1.8 6.5 1196 703 A 87 ILE HG2% A 89 ASP HB2 1.0 1.8 6.5 1197 703 A 87 ILE HG2% A 89 ASP HB3 1.0 1.8 6.5 1198 704 A 96 TYR HD% A 87 ILE HG2% 1.0 1.8 5.5 1199 705 A 96 TYR HD% A 87 ILE HB 1.0 1.8 5.0 1200 706 A 96 TYR HD% A 87 ILE HG12 1.0 1.8 6.0 1201 706 A 96 TYR HD% A 87 ILE HG13 1.0 1.8 6.0 1202 707 A 87 ILE HG12 A 96 TYR HB2 1.0 1.8 6.0 1203 707 A 96 TYR HB3 A 87 ILE HG12 1.0 1.8 6.0 1204 707 A 96 TYR HB3 A 87 ILE HG13 1.0 1.8 6.0 1205 707 A 87 ILE HG13 A 96 TYR HB2 1.0 1.8 6.0 1206 708 A 87 ILE HD1% A 96 TYR HB2 1.0 1.8 6.5 1207 708 A 96 TYR HB3 A 87 ILE HD1% 1.0 1.8 6.5 1208 709 A 87 ILE HB A 96 TYR HB2 1.0 1.8 6.0 1209 709 A 96 TYR HB3 A 87 ILE HB 1.0 1.8 6.0 1210 710 A 87 ILE HG2% A 96 TYR HB2 1.0 1.8 6.5 1211 710 A 96 TYR HB3 A 87 ILE HG2% 1.0 1.8 6.5 1212 711 A 96 TYR HE% A 87 ILE HB 1.0 1.8 6.0 1213 712 A 96 TYR HE% A 87 ILE HG2% 1.0 1.8 6.5 1214 713 A 96 TYR HE% A 87 ILE HD1% 1.0 1.8 6.5 1215 714 A 96 TYR HD% A 87 ILE HD1% 1.0 1.8 6.5 1216 715 A 87 ILE H A 97 SER HA 1.0 1.8 6.0 1217 716 A 88 MET H A 88 MET HG2 1.0 1.8 6.0 1218 716 A 88 MET HG3 A 88 MET H 1.0 1.8 6.0 1219 717 A 88 MET HA A 88 MET HG2 1.0 1.8 6.0 1220 717 A 88 MET HG3 A 88 MET HA 1.0 1.8 6.0 1221 718 A 88 MET HE% A 88 MET HA 1.0 1.8 6.5 1222 719 A 88 MET HE% A 88 MET H 1.0 1.8 6.5 1223 720 A 88 MET H A 88 MET HB2 1.0 1.8 6.0 1224 720 A 88 MET H A 88 MET HB3 1.0 1.8 6.0 1225 721 A 95 PHE HD% A 88 MET HA 1.0 1.8 6.0 1226 721 A 64 PHE HD% A 88 MET HA 1.0 1.8 6.0 1227 722 A 88 MET HA A 95 PHE HA 1.0 1.8 6.0 1228 722 A 88 MET HA A 64 PHE HA 1.0 1.8 6.0 1229 723 A 64 PHE HE% A 88 MET HG2 1.0 1.8 6.0 1230 723 A 95 PHE HE% A 88 MET HG2 1.0 1.8 6.0 1231 723 A 95 PHE HE% A 88 MET HG3 1.0 1.8 6.0 1232 723 A 64 PHE HE% A 88 MET HG3 1.0 1.8 6.0 1233 724 A 95 PHE HD% A 88 MET HG2 1.0 1.8 6.0 1234 724 A 64 PHE HD% A 88 MET HG2 1.0 1.8 6.0 1235 724 A 95 PHE HD% A 88 MET HG3 1.0 1.8 6.0 1236 724 A 64 PHE HD% A 88 MET HG3 1.0 1.8 6.0 1237 725 A 95 PHE HE% A 88 MET HB2 1.0 1.8 6.0 1238 725 A 64 PHE HE% A 88 MET HB2 1.0 1.8 6.0 1239 725 A 95 PHE HE% A 88 MET HB3 1.0 1.8 6.0 1240 725 A 64 PHE HE% A 88 MET HB3 1.0 1.8 6.0 1241 726 A 95 PHE HE% A 88 MET HE% 1.0 1.8 6.5 1242 726 A 64 PHE HE% A 88 MET HE% 1.0 1.8 6.5 1243 727 A 95 PHE HD% A 88 MET HE% 1.0 1.8 6.5 1244 727 A 64 PHE HD% A 88 MET HE% 1.0 1.8 6.5 1245 728 A 89 ASP H A 89 ASP HB2 1.0 1.8 6.0 1246 728 A 89 ASP HB3 A 89 ASP H 1.0 1.8 6.0 1247 729 A 89 ASP HA A 89 ASP HB2 1.0 1.8 6.0 1248 729 A 89 ASP HB3 A 89 ASP HA 1.0 1.8 6.0 1249 730 A 94 THR HB A 89 ASP HB2 1.0 1.8 6.0 1250 730 A 89 ASP HB3 A 94 THR HB 1.0 1.8 6.0 1251 731 A 94 THR HG2% A 89 ASP HB2 1.0 1.8 6.5 1252 731 A 94 THR HG2% A 89 ASP HB3 1.0 1.8 6.5 1253 732 A 95 PHE HD% A 89 ASP H 1.0 1.8 6.0 1254 733 A 90 HIS HA A 90 HIS HB2 1.0 1.8 6.0 1255 733 A 90 HIS HB3 A 90 HIS HA 1.0 1.8 6.0 1256 734 A 90 HIS HD2 A 90 HIS HB2 1.0 1.8 6.0 1257 734 A 90 HIS HB3 A 90 HIS HD2 1.0 1.8 6.0 1258 735 A 90 HIS HA A 90 HIS H 1.0 1.8 6.0 1259 736 A 90 HIS HE1 A 90 HIS HD2 1.0 1.8 6.0 1260 737 A 90 HIS HD2 A 90 HIS H 1.0 1.8 6.0 1261 738 A 95 PHE HE% A 90 HIS HA 1.0 1.8 6.0 1262 739 A 95 PHE HZ A 90 HIS HA 1.0 1.8 6.0 1263 740 A 95 PHE HZ A 90 HIS HD2 1.0 1.8 6.0 1264 741 A 91 TYR HD% A 91 TYR HA 1.0 1.8 6.0 1265 742 A 91 TYR HD% A 91 TYR H 1.0 1.8 6.0 1266 743 A 91 TYR H A 91 TYR HB2 1.0 1.8 6.0 1267 743 A 91 TYR H A 91 TYR HB3 1.0 1.8 6.0 1268 744 A 91 TYR HD% A 91 TYR HB2 1.0 1.8 6.0 1269 744 A 91 TYR HD% A 91 TYR HB3 1.0 1.8 6.0 1270 745 A 91 TYR HD% A 92 ASN HD22 1.0 1.8 6.0 1271 745 A 91 TYR HD% A 92 ASN HD21 1.0 1.8 6.0 1272 746 A 91 TYR HA A 92 ASN H 1.0 1.8 6.0 1273 747 A 92 ASN H A 91 TYR HB2 1.0 1.8 6.0 1274 747 A 91 TYR HB3 A 92 ASN H 1.0 1.8 6.0 1275 748 A 92 ASN H A 92 ASN HA 1.0 1.8 6.0 1276 749 A 92 ASN HB2 A 92 ASN HD22 1.0 1.8 6.0 1277 749 A 92 ASN HB3 A 92 ASN HD22 1.0 1.8 6.0 1278 749 A 92 ASN HD21 A 92 ASN HB2 1.0 1.8 6.0 1279 749 A 92 ASN HD21 A 92 ASN HB3 1.0 1.8 6.0 1280 750 A 94 THR HB A 92 ASN HB2 1.0 1.8 6.0 1281 750 A 94 THR HB A 92 ASN HB3 1.0 1.8 6.0 1282 751 A 93 ASN H A 93 ASN HB2 1.0 1.8 6.0 1283 751 A 93 ASN HB3 A 93 ASN H 1.0 1.8 6.0 1284 752 A 95 PHE HE% A 93 ASN HA 1.0 1.8 6.0 1285 753 A 94 THR HB A 94 THR H 1.0 1.8 6.0 1286 754 A 94 THR HG2% A 94 THR HA 1.0 1.8 6.5 1287 755 A 94 THR HA A 94 THR HB 1.0 1.8 6.0 1288 756 A 94 THR HA A 94 THR H 1.0 1.8 6.0 1289 757 A 95 PHE H A 94 THR HB 1.0 1.8 6.0 1290 758 A 95 PHE HD% A 94 THR HA 1.0 1.8 6.0 1291 759 A 94 THR HG2% A 95 PHE HD% 1.0 1.8 6.5 1292 760 A 94 THR HG2% A 95 PHE H 1.0 1.8 6.5 1293 761 A 94 THR HA A 95 PHE H 1.0 1.8 5.0 1294 762 A 96 TYR HE% A 94 THR HB 1.0 1.8 6.0 1295 763 A 94 THR HG2% A 96 TYR HD% 1.0 1.8 5.5 1296 764 A 96 TYR HE% A 94 THR HG2% 1.0 1.8 5.5 1297 765 A 95 PHE HD% A 95 PHE HA 1.0 1.8 6.0 1298 766 A 95 PHE HD% A 95 PHE HZ 1.0 1.8 6.0 1299 767 A 95 PHE HD% A 95 PHE HE% 1.0 1.8 3.3 1300 768 A 95 PHE HD% A 95 PHE HB2 1.0 1.8 6.0 1301 768 A 95 PHE HD% A 95 PHE HB3 1.0 1.8 6.0 1302 769 A 95 PHE H A 95 PHE HB2 1.0 1.8 6.0 1303 769 A 95 PHE HB3 A 95 PHE H 1.0 1.8 6.0 1304 770 A 95 PHE HA A 95 PHE HB2 1.0 1.8 6.0 1305 770 A 95 PHE HB3 A 95 PHE HA 1.0 1.8 6.0 1306 771 A 96 TYR H A 95 PHE HB2 1.0 1.8 6.0 1307 771 A 95 PHE HB3 A 96 TYR H 1.0 1.8 6.0 1308 772 A 95 PHE HA A 96 TYR H 1.0 1.8 3.5 1309 773 A 96 TYR HD% A 96 TYR HB2 1.0 1.8 5.0 1310 773 A 96 TYR HB3 A 96 TYR HD% 1.0 1.8 5.0 1311 774 A 96 TYR HD% A 96 TYR H 1.0 1.8 6.0 1312 775 A 96 TYR HE% A 96 TYR HD% 1.0 1.8 2.7 1313 776 A 96 TYR HA A 96 TYR HD% 1.0 1.8 6.0 1314 777 A 96 TYR HA A 96 TYR HB2 1.0 1.8 6.0 1315 777 A 96 TYR HB3 A 96 TYR HA 1.0 1.8 6.0 1316 778 A 96 TYR H A 96 TYR HB2 1.0 1.8 6.0 1317 778 A 96 TYR HB3 A 96 TYR H 1.0 1.8 6.0 1318 779 A 96 TYR HA A 96 TYR H 1.0 1.8 6.0 1319 780 A 96 TYR HE% A 96 TYR H 1.0 1.8 6.0 1320 781 A 97 SER H A 96 TYR HD% 1.0 1.8 6.0 1321 782 A 98 ARG HA A 98 ARG HG2 1.0 1.8 6.0 1322 782 A 98 ARG HG3 A 98 ARG HA 1.0 1.8 6.0 1323 783 A 98 ARG HA A 98 ARG HD2 1.0 1.8 6.0 1324 783 A 98 ARG HD3 A 98 ARG HA 1.0 1.8 6.0 1325 784 A 98 ARG HA A 98 ARG HB2 1.0 1.8 6.0 1326 784 A 98 ARG HA A 98 ARG HB3 1.0 1.8 6.0 1327 785 A 98 ARG HA A 99 LEU HB2 1.0 1.8 6.0 1328 785 A 99 LEU HB3 A 98 ARG HA 1.0 1.8 6.0 1329 786 A 99 LEU HG A 99 LEU H 1.0 1.8 6.0 1330 787 A 99 LEU HA A 99 LEU HD1% 1.0 1.8 3.8 1331 787 A 99 LEU HD2% A 99 LEU HA 1.0 1.8 3.8 1332 788 A 99 LEU H A 99 LEU HD1% 1.0 1.8 6.5 1333 788 A 99 LEU HD2% A 99 LEU H 1.0 1.8 6.5 1334 789 A 99 LEU H A 99 LEU HB2 1.0 1.8 6.0 1335 789 A 99 LEU HB3 A 99 LEU H 1.0 1.8 6.0 1336 790 A 99 LEU HG A 99 LEU HB2 1.0 1.8 5.0 1337 790 A 99 LEU HB3 A 99 LEU HG 1.0 1.8 5.0 1338 791 A 99 LEU HA A 100 PRO HD2 1.0 1.8 5.0 1339 791 A 100 PRO HD3 A 99 LEU HA 1.0 1.8 5.0 1340 792 A 99 LEU HD1% A 100 PRO HD2 1.0 1.8 6.5 1341 792 A 99 LEU HD2% A 100 PRO HD2 1.0 1.8 6.5 1342 792 A 100 PRO HD3 A 99 LEU HD1% 1.0 1.8 6.5 1343 792 A 99 LEU HD2% A 100 PRO HD3 1.0 1.8 6.5 1344 793 A 99 LEU HB3 A 100 PRO HD2 1.0 1.8 6.0 1345 793 A 99 LEU HB2 A 100 PRO HD2 1.0 1.8 6.0 1346 793 A 100 PRO HD3 A 99 LEU HB2 1.0 1.8 6.0 1347 793 A 99 LEU HB3 A 100 PRO HD3 1.0 1.8 6.0 1348 794 A 103 ILE HD1% A 99 LEU HG 1.0 1.8 6.5 1349 795 A 103 ILE HD1% A 99 LEU HB2 1.0 1.8 6.5 1350 795 A 103 ILE HD1% A 99 LEU HB3 1.0 1.8 6.5 1351 796 A 107 TRP HD1 A 99 LEU HD1% 1.0 1.8 6.5 1352 796 A 99 LEU HD2% A 107 TRP HD1 1.0 1.8 6.5 1353 797 A 107 TRP HZ2 A 99 LEU HD1% 1.0 1.8 6.5 1354 797 A 107 TRP HZ2 A 99 LEU HD2% 1.0 1.8 6.5 1355 798 A 107 TRP HH2 A 99 LEU HD1% 1.0 1.8 6.5 1356 798 A 107 TRP HH2 A 99 LEU HD2% 1.0 1.8 6.5 1357 799 A 103 ILE HD1% A 100 PRO HD2 1.0 1.8 6.5 1358 799 A 103 ILE HD1% A 100 PRO HD3 1.0 1.8 6.5 1359 800 A 101 SER HA A 101 SER H 1.0 1.8 5.0 1360 801 A 102 LEU HA A 102 LEU HD1% 1.0 1.8 5.5 1361 801 A 102 LEU HA A 102 LEU HD2% 1.0 1.8 5.5 1362 802 A 102 LEU H A 102 LEU HB2 1.0 1.8 6.0 1363 802 A 102 LEU HB3 A 102 LEU H 1.0 1.8 6.0 1364 803 A 102 LEU HA A 102 LEU H 1.0 1.8 6.0 1365 804 A 102 LEU HD1% A 104 SER HB2 1.0 1.8 6.5 1366 804 A 102 LEU HD2% A 104 SER HB2 1.0 1.8 6.5 1367 804 A 104 SER HB3 A 102 LEU HD1% 1.0 1.8 6.5 1368 804 A 102 LEU HD2% A 104 SER HB3 1.0 1.8 6.5 1369 805 A 103 ILE H A 103 ILE HG12 1.0 1.8 6.0 1370 805 A 103 ILE H A 103 ILE HG13 1.0 1.8 6.0 1371 806 A 103 ILE H A 103 ILE HB 1.0 1.8 6.0 1372 807 A 103 ILE H A 103 ILE HA 1.0 1.8 6.0 1373 808 A 103 ILE HD1% A 103 ILE H 1.0 1.8 6.5 1374 809 A 104 SER H A 103 ILE HG12 1.0 1.8 6.0 1375 809 A 103 ILE HG13 A 104 SER H 1.0 1.8 6.0 1376 810 A 103 ILE HA A 104 SER H 1.0 1.8 5.0 1377 811 A 103 ILE HD1% A 104 SER H 1.0 1.8 6.5 1378 812 A 107 TRP HZ2 A 103 ILE HD1% 1.0 1.8 6.5 1379 813 A 107 TRP HZ2 A 103 ILE HG2% 1.0 1.8 6.5 1380 814 A 107 TRP HZ2 A 103 ILE HB 1.0 1.8 6.0 1381 815 A 103 ILE HG2% A 107 TRP HD1 1.0 1.8 6.5 1382 816 A 107 TRP HE1 A 103 ILE HB 1.0 1.8 6.0 1383 817 A 103 ILE HG2% A 107 TRP HE1 1.0 1.8 6.5 1384 818 A 103 ILE HG2% A 107 TRP HZ3 1.0 1.8 6.5 1385 819 A 103 ILE HD1% A 107 TRP HE1 1.0 1.8 6.5 1386 820 A 127 ALA HA A 103 ILE HG2% 1.0 1.8 6.5 1387 821 A 127 ALA HA A 103 ILE HD1% 1.0 1.8 6.5 1388 822 A 104 SER HA A 105 ASP H 1.0 1.8 5.0 1389 823 A 105 ASP H A 105 ASP HBx 1.0 1.8 6.0 1390 823 A 105 ASP H A 105 ASP HB3 1.0 1.8 6.0 1391 824 A 106 ASN H A 105 ASP HBx 1.0 1.8 5.0 1392 824 A 105 ASP HB3 A 106 ASN H 1.0 1.8 5.0 1393 825 A 107 TRP HD1 A 105 ASP HBx 1.0 1.8 6.0 1394 825 A 107 TRP HD1 A 105 ASP HB3 1.0 1.8 6.0 1395 826 A 107 TRP HE1 A 105 ASP HBx 1.0 1.8 6.0 1396 826 A 107 TRP HE1 A 105 ASP HB3 1.0 1.8 6.0 1397 827 A 127 ALA HB% A 105 ASP HA 1.0 1.8 6.5 1398 828 A 106 ASN H A 106 ASN HB2 1.0 1.8 6.0 1399 828 A 106 ASN H A 106 ASN HB3 1.0 1.8 6.0 1400 829 A 106 ASN HB3 A 106 ASN HD22 1.0 1.8 6.0 1401 829 A 106 ASN HD21 A 106 ASN HB2 1.0 1.8 6.0 1402 829 A 106 ASN HB3 A 106 ASN HD21 1.0 1.8 6.0 1403 829 A 106 ASN HB2 A 106 ASN HD22 1.0 1.8 6.0 1404 830 A 107 TRP HD1 A 106 ASN H 1.0 1.8 6.0 1405 831 A 107 TRP HE3 A 107 TRP HB2 1.0 1.8 6.0 1406 831 A 107 TRP HB3 A 107 TRP HE3 1.0 1.8 6.0 1407 832 A 107 TRP HD1 A 107 TRP HB2 1.0 1.8 6.0 1408 832 A 107 TRP HB3 A 107 TRP HD1 1.0 1.8 6.0 1409 833 A 107 TRP H A 107 TRP HB2 1.0 1.8 6.0 1410 833 A 107 TRP HB3 A 107 TRP H 1.0 1.8 6.0 1411 834 A 107 TRP HZ2 A 107 TRP HE1 1.0 1.8 6.0 1412 835 A 107 TRP HD1 A 107 TRP H 1.0 1.8 6.0 1413 836 A 107 TRP HD1 A 107 TRP HA 1.0 1.8 6.0 1414 837 A 107 TRP H A 107 TRP HA 1.0 1.8 6.0 1415 838 A 107 TRP HE3 A 107 TRP HA 1.0 1.8 6.0 1416 839 A 108 LYS H A 107 TRP HB2 1.0 1.8 6.0 1417 839 A 107 TRP HB3 A 108 LYS H 1.0 1.8 6.0 1418 840 A 107 TRP HD1 A 108 LYS H 1.0 1.8 6.0 1419 841 A 107 TRP HE3 A 108 LYS H 1.0 1.8 6.0 1420 842 A 107 TRP HE3 A 108 LYS HA 1.0 1.8 6.0 1421 843 A 107 TRP HA A 108 LYS H 1.0 1.8 3.5 1422 844 A 107 TRP HZ3 A 108 LYS HA 1.0 1.8 6.0 1423 845 A 109 PHE HD% A 107 TRP HB2 1.0 1.8 6.0 1424 845 A 109 PHE HD% A 107 TRP HB3 1.0 1.8 6.0 1425 846 A 109 PHE HD% A 107 TRP HE3 1.0 1.8 6.0 1426 847 A 107 TRP HZ2 A 109 PHE HE% 1.0 1.8 6.0 1427 848 A 109 PHE HE% A 107 TRP HE3 1.0 1.8 6.0 1428 849 A 107 TRP HE3 A 109 PHE H 1.0 1.8 6.0 1429 850 A 107 TRP HH2 A 125 VAL HG1% 1.0 1.8 6.5 1430 850 A 125 VAL HG2% A 107 TRP HH2 1.0 1.8 6.5 1431 851 A 107 TRP HZ3 A 125 VAL HG1% 1.0 1.8 6.5 1432 851 A 125 VAL HG2% A 107 TRP HZ3 1.0 1.8 6.5 1433 852 A 107 TRP HE3 A 125 VAL HG1% 1.0 1.8 6.5 1434 852 A 125 VAL HG2% A 107 TRP HE3 1.0 1.8 6.5 1435 853 A 107 TRP HE3 A 126 GLU HA 1.0 1.8 6.0 1436 854 A 127 ALA HB% A 107 TRP HB2 1.0 1.8 6.5 1437 854 A 127 ALA HB% A 107 TRP HB3 1.0 1.8 6.5 1438 855 A 127 ALA HB% A 107 TRP HD1 1.0 1.8 6.5 1439 856 A 107 TRP HH2 A 127 ALA HB% 1.0 1.8 6.5 1440 857 A 107 TRP HZ2 A 127 ALA HB% 1.0 1.8 6.5 1441 858 A 127 ALA HB% A 107 TRP HE1 1.0 1.8 6.5 1442 859 A 127 ALA HB% A 107 TRP H 1.0 1.8 6.5 1443 860 A 108 LYS H A 108 LYS HB2 1.0 1.8 6.0 1444 860 A 108 LYS HB3 A 108 LYS H 1.0 1.8 6.0 1445 861 A 108 LYS H A 108 LYS HA 1.0 1.8 6.0 1446 862 A 109 PHE H A 108 LYS HB2 1.0 1.8 6.0 1447 862 A 108 LYS HB3 A 109 PHE H 1.0 1.8 6.0 1448 863 A 108 LYS HA A 125 VAL H 1.0 1.8 6.0 1449 864 A 126 GLU HA A 108 LYS HB2 1.0 1.8 6.0 1450 864 A 108 LYS HB3 A 126 GLU HA 1.0 1.8 6.0 1451 865 A 108 LYS HA A 126 GLU HA 1.0 1.8 5.0 1452 866 A 109 PHE HD% A 109 PHE H 1.0 1.8 6.0 1453 867 A 109 PHE HA A 109 PHE HD% 1.0 1.8 6.0 1454 868 A 109 PHE HE% A 109 PHE HD% 1.0 1.8 2.7 1455 869 A 109 PHE HE% A 109 PHE HZ 1.0 1.8 5.0 1456 870 A 109 PHE HD% A 109 PHE HBx 1.0 1.8 5.0 1457 870 A 109 PHE HD% A 109 PHE HB3 1.0 1.8 5.0 1458 871 A 109 PHE HA A 109 PHE HBx 1.0 1.8 6.0 1459 871 A 109 PHE HA A 109 PHE HB3 1.0 1.8 6.0 1460 872 A 109 PHE HD% A 110 PHE H 1.0 1.8 6.0 1461 873 A 110 PHE H A 109 PHE HBx 1.0 1.8 6.0 1462 873 A 109 PHE HB3 A 110 PHE H 1.0 1.8 6.0 1463 874 A 109 PHE HE% A 125 VAL HG1% 1.0 1.8 5.5 1464 874 A 125 VAL HG2% A 109 PHE HE% 1.0 1.8 5.5 1465 875 A 109 PHE HZ A 125 VAL HG1% 1.0 1.8 6.5 1466 875 A 125 VAL HG2% A 109 PHE HZ 1.0 1.8 6.5 1467 876 A 109 PHE HD% A 125 VAL HG1% 1.0 1.8 5.5 1468 876 A 125 VAL HG2% A 109 PHE HD% 1.0 1.8 5.5 1469 877 A 127 ALA HB% A 109 PHE HE% 1.0 1.8 6.5 1470 878 A 110 PHE HD% A 110 PHE H 1.0 1.8 6.0 1471 879 A 110 PHE HE% A 110 PHE H 1.0 1.8 6.0 1472 880 A 110 PHE HE% A 110 PHE HB2 1.0 1.8 6.0 1473 880 A 110 PHE HB3 A 110 PHE HE% 1.0 1.8 6.0 1474 881 A 110 PHE HA A 110 PHE HD% 1.0 1.8 6.0 1475 882 A 110 PHE HA A 110 PHE HB2 1.0 1.8 6.0 1476 882 A 110 PHE HB3 A 110 PHE HA 1.0 1.8 6.0 1477 883 A 110 PHE HD% A 112 VAL HG1% 1.0 1.8 3.8 1478 883 A 112 VAL HG2% A 110 PHE HD% 1.0 1.8 3.8 1479 884 A 110 PHE HE% A 112 VAL HG1% 1.0 1.8 6.5 1480 884 A 112 VAL HG2% A 110 PHE HE% 1.0 1.8 6.5 1481 885 A 112 VAL HB A 110 PHE HD% 1.0 1.8 6.0 1482 886 A 110 PHE HD% A 122 VAL HG2% 1.0 1.8 5.5 1483 887 A 122 VAL HG1% A 110 PHE HE% 1.0 1.8 6.5 1484 888 A 122 VAL HG2% A 110 PHE HB2 1.0 1.8 5.5 1485 888 A 110 PHE HB3 A 122 VAL HG2% 1.0 1.8 5.5 1486 889 A 110 PHE HE% A 122 VAL HG2% 1.0 1.8 6.5 1487 890 A 110 PHE HZ A 122 VAL HG2% 1.0 1.8 6.5 1488 891 A 124 THR HB A 110 PHE HB2 1.0 1.8 6.0 1489 891 A 110 PHE HB3 A 124 THR HB 1.0 1.8 6.0 1490 892 A 124 THR HG2% A 110 PHE HB2 1.0 1.8 6.5 1491 892 A 110 PHE HB3 A 124 THR HG2% 1.0 1.8 6.5 1492 893 A 124 THR HA A 110 PHE HB2 1.0 1.8 6.0 1493 893 A 110 PHE HB3 A 124 THR HA 1.0 1.8 6.0 1494 894 A 110 PHE HA A 124 THR HA 1.0 1.8 6.0 1495 895 A 111 CYS HA A 111 CYS HB2 1.0 1.8 6.0 1496 895 A 111 CYS HB3 A 111 CYS HA 1.0 1.8 6.0 1497 896 A 111 CYS H A 111 CYS HB2 1.0 1.8 6.0 1498 896 A 111 CYS HB3 A 111 CYS H 1.0 1.8 6.0 1499 897 A 112 VAL H A 111 CYS HB2 1.0 1.8 6.0 1500 897 A 111 CYS HB3 A 112 VAL H 1.0 1.8 6.0 1501 898 A 111 CYS HB3 A 112 VAL HG1% 1.0 1.8 6.5 1502 898 A 111 CYS HB2 A 112 VAL HG1% 1.0 1.8 6.5 1503 898 A 112 VAL HG2% A 111 CYS HB2 1.0 1.8 6.5 1504 898 A 111 CYS HB3 A 112 VAL HG2% 1.0 1.8 6.5 1505 899 A 111 CYS HA A 112 VAL HG1% 1.0 1.8 6.5 1506 899 A 112 VAL HG2% A 111 CYS HA 1.0 1.8 6.5 1507 900 A 122 VAL HG2% A 111 CYS H 1.0 1.8 6.5 1508 901 A 111 CYS HB2 A 123 PHE HBx 1.0 1.8 6.0 1509 901 A 111 CYS HB3 A 123 PHE HBx 1.0 1.8 6.0 1510 901 A 123 PHE HB3 A 111 CYS HB2 1.0 1.8 6.0 1511 901 A 111 CYS HB3 A 123 PHE HB3 1.0 1.8 6.0 1512 902 A 123 PHE HD% A 111 CYS HB2 1.0 1.8 6.0 1513 902 A 123 PHE HD% A 111 CYS HB3 1.0 1.8 6.0 1514 903 A 112 VAL H A 112 VAL HG1% 1.0 1.8 6.5 1515 903 A 112 VAL HG2% A 112 VAL H 1.0 1.8 6.5 1516 904 A 112 VAL HA A 112 VAL HG1% 1.0 1.8 6.5 1517 904 A 112 VAL HG2% A 112 VAL HA 1.0 1.8 6.5 1518 905 A 112 VAL HG2% A 114 SER HB2 1.0 1.8 6.5 1519 905 A 112 VAL HG1% A 114 SER HB2 1.0 1.8 6.5 1520 905 A 114 SER HB3 A 112 VAL HG1% 1.0 1.8 6.5 1521 905 A 112 VAL HG2% A 114 SER HB3 1.0 1.8 6.5 1522 906 A 122 VAL HG2% A 112 VAL HG1% 1.0 1.8 4.3 1523 906 A 112 VAL HG2% A 122 VAL HG2% 1.0 1.8 4.3 1524 907 A 122 VAL HA A 112 VAL HG1% 1.0 1.8 6.5 1525 907 A 112 VAL HG2% A 122 VAL HA 1.0 1.8 6.5 1526 908 A 122 VAL HG2% A 112 VAL HA 1.0 1.8 6.5 1527 909 A 112 VAL HA A 122 VAL HA 1.0 1.8 5.0 1528 910 A 122 VAL HG1% A 112 VAL HA 1.0 1.8 6.5 1529 911 A 112 VAL HB A 122 VAL HG2% 1.0 1.8 6.5 1530 912 A 112 VAL HA A 123 PHE H 1.0 1.8 6.0 1531 913 A 113 CYS HA A 113 CYS H 1.0 1.8 6.0 1532 914 A 113 CYS H A 113 CYS HB2 1.0 1.8 6.0 1533 914 A 113 CYS HB3 A 113 CYS H 1.0 1.8 6.0 1534 915 A 113 CYS H A 121 LEU HD1% 1.0 1.8 6.5 1535 915 A 121 LEU HD2% A 113 CYS H 1.0 1.8 6.5 1536 916 A 113 CYS HB3 A 121 LEU HD1% 1.0 1.8 5.5 1537 916 A 113 CYS HB2 A 121 LEU HD1% 1.0 1.8 5.5 1538 916 A 121 LEU HD2% A 113 CYS HB2 1.0 1.8 5.5 1539 916 A 121 LEU HD2% A 113 CYS HB3 1.0 1.8 5.5 1540 917 A 121 LEU HG A 113 CYS HB2 1.0 1.8 6.0 1541 917 A 113 CYS HB3 A 121 LEU HG 1.0 1.8 6.0 1542 918 A 113 CYS HB3 A 121 LEU HBx 1.0 1.8 6.0 1543 918 A 113 CYS HB2 A 121 LEU HBx 1.0 1.8 6.0 1544 918 A 121 LEU HB3 A 113 CYS HB2 1.0 1.8 6.0 1545 918 A 121 LEU HB3 A 113 CYS HB3 1.0 1.8 6.0 1546 919 A 114 SER H A 114 SER HB2 1.0 1.8 6.0 1547 919 A 114 SER H A 114 SER HB3 1.0 1.8 6.0 1548 920 A 114 SER HA A 114 SER H 1.0 1.8 6.0 1549 921 A 114 SER HA A 121 LEU H 1.0 1.8 6.0 1550 922 A 115 LYS HA A 115 LYS HDx 1.0 1.8 5.0 1551 922 A 115 LYS HD3 A 115 LYS HA 1.0 1.8 5.0 1552 923 A 115 LYS HA A 115 LYS HB2 1.0 1.8 5.0 1553 923 A 115 LYS HB3 A 115 LYS HA 1.0 1.8 5.0 1554 924 A 115 LYS HA A 115 LYS H 1.0 1.8 6.0 1555 925 A 115 LYS HD3 A 116 ASP HBx 1.0 1.8 6.0 1556 925 A 115 LYS HDx A 116 ASP HBx 1.0 1.8 6.0 1557 925 A 116 ASP HB3 A 115 LYS HDx 1.0 1.8 6.0 1558 925 A 115 LYS HD3 A 116 ASP HB3 1.0 1.8 6.0 1559 926 A 116 ASP H A 115 LYS HB2 1.0 1.8 6.0 1560 926 A 115 LYS HB3 A 116 ASP H 1.0 1.8 6.0 1561 927 A 115 LYS HB2 A 118 GLU HB2 1.0 1.8 6.0 1562 927 A 118 GLU HB3 A 115 LYS HB2 1.0 1.8 6.0 1563 927 A 118 GLU HB3 A 115 LYS HB3 1.0 1.8 6.0 1564 927 A 115 LYS HB3 A 118 GLU HB2 1.0 1.8 6.0 1565 928 A 115 LYS H A 118 GLU HB2 1.0 1.8 6.0 1566 928 A 118 GLU HB3 A 115 LYS H 1.0 1.8 6.0 1567 929 A 115 LYS H A 118 GLU HGx 1.0 1.8 6.0 1568 929 A 115 LYS H A 118 GLU HG3 1.0 1.8 6.0 1569 930 A 115 LYS HB2 A 118 GLU HGx 1.0 1.8 6.0 1570 930 A 118 GLU HG3 A 115 LYS HB2 1.0 1.8 6.0 1571 930 A 115 LYS HB3 A 118 GLU HG3 1.0 1.8 6.0 1572 930 A 115 LYS HB3 A 118 GLU HGx 1.0 1.8 6.0 1573 931 A 115 LYS HD3 A 118 GLU HGx 1.0 1.8 6.0 1574 931 A 115 LYS HDx A 118 GLU HGx 1.0 1.8 6.0 1575 931 A 118 GLU HG3 A 115 LYS HDx 1.0 1.8 6.0 1576 931 A 115 LYS HD3 A 118 GLU HG3 1.0 1.8 6.0 1577 932 A 116 ASP H A 116 ASP HA 1.0 1.8 5.0 1578 933 A 116 ASP HBx A 117 ASN HD22 1.0 1.8 6.0 1579 933 A 116 ASP HB3 A 117 ASN HD22 1.0 1.8 6.0 1580 933 A 117 ASN HD21 A 116 ASP HBx 1.0 1.8 6.0 1581 933 A 116 ASP HB3 A 117 ASN HD21 1.0 1.8 6.0 1582 934 A 118 GLU H A 116 ASP HBx 1.0 1.8 6.0 1583 934 A 116 ASP HB3 A 118 GLU H 1.0 1.8 6.0 1584 935 A 117 ASN H A 117 ASN HB2 1.0 1.8 6.0 1585 935 A 117 ASN HB3 A 117 ASN H 1.0 1.8 6.0 1586 936 A 118 GLU H A 118 GLU HB2 1.0 1.8 6.0 1587 936 A 118 GLU HB3 A 118 GLU H 1.0 1.8 6.0 1588 937 A 118 GLU H A 118 GLU HGx 1.0 1.8 6.0 1589 937 A 118 GLU HG3 A 118 GLU H 1.0 1.8 6.0 1590 938 A 119 LYS H A 119 LYS HDx 1.0 1.8 6.0 1591 938 A 119 LYS HD3 A 119 LYS H 1.0 1.8 6.0 1592 939 A 119 LYS H A 119 LYS HA 1.0 1.8 6.0 1593 940 A 120 LYS HA A 120 LYS H 1.0 1.8 6.0 1594 941 A 120 LYS HA A 121 LEU HD1% 1.0 1.8 6.5 1595 941 A 121 LEU HD2% A 120 LYS HA 1.0 1.8 6.5 1596 942 A 121 LEU H A 120 LYS HB2 1.0 1.8 6.0 1597 942 A 120 LYS HB3 A 121 LEU H 1.0 1.8 6.0 1598 943 A 122 VAL HG1% A 120 LYS HDx 1.0 1.8 6.5 1599 943 A 122 VAL HG1% A 120 LYS HD3 1.0 1.8 6.5 1600 944 A 122 VAL HG1% A 120 LYS HB2 1.0 1.8 6.5 1601 944 A 120 LYS HB3 A 122 VAL HG1% 1.0 1.8 6.5 1602 945 A 121 LEU HA A 121 LEU H 1.0 1.8 6.0 1603 946 A 121 LEU H A 121 LEU HD1% 1.0 1.8 6.5 1604 946 A 121 LEU HD2% A 121 LEU H 1.0 1.8 6.5 1605 947 A 121 LEU H A 121 LEU HG 1.0 1.8 6.0 1606 948 A 121 LEU HBx A 121 LEU HD1% 1.0 1.8 5.5 1607 948 A 121 LEU HB3 A 121 LEU HD1% 1.0 1.8 5.5 1608 948 A 121 LEU HD2% A 121 LEU HBx 1.0 1.8 5.5 1609 948 A 121 LEU HD2% A 121 LEU HB3 1.0 1.8 5.5 1610 949 A 121 LEU HA A 121 LEU HD1% 1.0 1.8 5.5 1611 949 A 121 LEU HD2% A 121 LEU HA 1.0 1.8 5.5 1612 950 A 121 LEU H A 121 LEU HBx 1.0 1.8 6.0 1613 950 A 121 LEU HB3 A 121 LEU H 1.0 1.8 6.0 1614 951 A 121 LEU HA A 121 LEU HBx 1.0 1.8 6.0 1615 951 A 121 LEU HB3 A 121 LEU HA 1.0 1.8 6.0 1616 952 A 121 LEU HA A 122 VAL HG2% 1.0 1.8 6.5 1617 953 A 122 VAL HG2% A 122 VAL HA 1.0 1.8 5.5 1618 954 A 122 VAL HB A 122 VAL HG2% 1.0 1.8 3.8 1619 955 A 122 VAL HB A 122 VAL HA 1.0 1.8 6.0 1620 956 A 122 VAL HG1% A 122 VAL HB 1.0 1.8 3.2 1621 957 A 122 VAL HG1% A 122 VAL HA 1.0 1.8 5.5 1622 958 A 122 VAL HG1% A 122 VAL H 1.0 1.8 5.5 1623 959 A 122 VAL H A 122 VAL HB 1.0 1.8 6.0 1624 960 A 122 VAL HG2% A 123 PHE H 1.0 1.8 5.5 1625 961 A 123 PHE HD% A 123 PHE HBx 1.0 1.8 5.0 1626 961 A 123 PHE HD% A 123 PHE HB3 1.0 1.8 5.0 1627 962 A 123 PHE HD% A 123 PHE HA 1.0 1.8 6.0 1628 963 A 123 PHE HD% A 123 PHE H 1.0 1.8 6.0 1629 964 A 123 PHE HZ A 123 PHE HBx 1.0 1.8 6.0 1630 964 A 123 PHE HZ A 123 PHE HB3 1.0 1.8 6.0 1631 965 A 123 PHE HE% A 123 PHE HBx 1.0 1.8 6.0 1632 965 A 123 PHE HE% A 123 PHE HB3 1.0 1.8 6.0 1633 966 A 123 PHE H A 123 PHE HBx 1.0 1.8 6.0 1634 966 A 123 PHE HB3 A 123 PHE H 1.0 1.8 6.0 1635 967 A 123 PHE HE% A 123 PHE HA 1.0 1.8 6.0 1636 968 A 123 PHE HD% A 124 THR H 1.0 1.8 6.0 1637 969 A 123 PHE HZ A 125 VAL HG1% 1.0 1.8 5.5 1638 969 A 123 PHE HZ A 125 VAL HG2% 1.0 1.8 5.5 1639 970 A 124 THR HB A 124 THR H 1.0 1.8 6.0 1640 971 A 124 THR H A 124 THR HG2% 1.0 1.8 6.5 1641 972 A 124 THR HB A 124 THR HG2% 1.0 1.8 3.8 1642 973 A 124 THR HA A 125 VAL HG1% 1.0 1.8 6.5 1643 973 A 124 THR HA A 125 VAL HG2% 1.0 1.8 6.5 1644 974 A 125 VAL HA A 125 VAL HG1% 1.0 1.8 5.5 1645 974 A 125 VAL HG2% A 125 VAL HA 1.0 1.8 5.5 1646 975 A 125 VAL H A 125 VAL HG1% 1.0 1.8 5.5 1647 975 A 125 VAL HG2% A 125 VAL H 1.0 1.8 5.5 1648 976 A 125 VAL HB A 125 VAL H 1.0 1.8 6.0 1649 977 A 127 ALA HB% A 126 GLU HA 1.0 1.8 6.5 1650 978 A 127 ALA HA A 127 ALA H 1.0 1.8 6.0 1651 979 A 127 ALA HA A 127 ALA HB% 1.0 1.8 3.8 1652 980 A 127 ALA HB% A 127 ALA H 1.0 1.8 5.5 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 2 LYS H A 1 GLU HB2 1.0 1.8 5.0 2 1 A 1 GLU HB3 A 2 LYS H 1.0 1.8 5.0 3 2 A 2 LYS H A 1 GLU HG2 1.0 1.8 5.0 4 2 A 2 LYS H A 1 GLU HG3 1.0 1.8 5.0 5 3 A 2 LYS H A 2 LYS HEx 1.0 1.8 6.0 6 3 A 2 LYS HE3 A 2 LYS H 1.0 1.8 6.0 7 4 A 2 LYS HA A 3 VAL H 1.0 1.8 2.9 8 5 A 17 SER H A 2 LYS HB2 1.0 1.8 6.0 9 5 A 2 LYS HB3 A 17 SER H 1.0 1.8 6.0 10 6 A 3 VAL HG2% A 4 LYS H 1.0 1.8 5.5 11 7 A 3 VAL HG1% A 4 LYS H 1.0 1.8 4.0 12 8 A 3 VAL HA A 4 LYS H 1.0 1.8 2.9 13 9 A 15 ILE HG2% A 3 VAL H 1.0 1.8 5.5 14 10 A 16 PHE HA A 3 VAL H 1.0 1.8 5.0 15 11 A 3 VAL H A 17 SER H 1.0 1.8 5.0 16 12 A 3 VAL HB A 17 SER H 1.0 1.8 6.0 17 13 A 4 LYS H A 5 GLY H 1.0 1.8 6.0 18 14 A 5 GLY H A 4 LYS HB2 1.0 1.8 5.0 19 14 A 4 LYS HB3 A 5 GLY H 1.0 1.8 5.0 20 15 A 5 GLY H A 4 LYS HD2 1.0 1.8 5.0 21 15 A 4 LYS HD3 A 5 GLY H 1.0 1.8 5.0 22 16 A 5 GLY H A 4 LYS HEx 1.0 1.8 6.0 23 16 A 4 LYS HE3 A 5 GLY H 1.0 1.8 6.0 24 17 A 4 LYS HA A 17 SER H 1.0 1.8 5.0 25 18 A 48 ILE HA A 4 LYS H 1.0 1.8 5.0 26 19 A 5 GLY H A 6 CYS H 1.0 1.8 6.0 27 20 A 6 CYS H A 5 GLY HA2 1.0 1.8 5.0 28 20 A 5 GLY HA3 A 6 CYS H 1.0 1.8 5.0 29 21 A 5 GLY H A 17 SER H 1.0 1.8 5.0 30 22 A 5 GLY H A 17 SER HB2 1.0 1.8 6.0 31 22 A 17 SER HB3 A 5 GLY H 1.0 1.8 6.0 32 23 A 5 GLY H A 40 VAL HG1% 1.0 1.8 5.5 33 23 A 5 GLY H A 40 VAL HG2% 1.0 1.8 5.5 34 24 A 49 GLY H A 5 GLY HA2 1.0 1.8 5.0 35 24 A 5 GLY HA3 A 49 GLY H 1.0 1.8 5.0 36 25 A 6 CYS HA A 7 ASP H 1.0 1.8 3.5 37 26 A 7 ASP H A 6 CYS HB2 1.0 1.8 6.0 38 26 A 6 CYS HB3 A 7 ASP H 1.0 1.8 6.0 39 27 A 6 CYS HA A 18 LYS H 1.0 1.8 5.0 40 28 A 6 CYS H A 40 VAL HG1% 1.0 1.8 5.5 41 28 A 40 VAL HG2% A 6 CYS H 1.0 1.8 5.5 42 29 A 49 GLY H A 6 CYS H 1.0 1.8 6.0 43 30 A 50 PHE HA A 6 CYS H 1.0 1.8 5.0 44 31 A 6 CYS H A 50 PHE HB2 1.0 1.8 5.0 45 31 A 50 PHE HB3 A 6 CYS H 1.0 1.8 5.0 46 32 A 51 LYS H A 6 CYS H 1.0 1.8 6.0 47 33 A 8 PHE H A 7 ASP HB2 1.0 1.8 6.0 48 33 A 7 ASP HB3 A 8 PHE H 1.0 1.8 6.0 49 34 A 10 THR H A 7 ASP HB2 1.0 1.8 5.0 50 34 A 7 ASP HB3 A 10 THR H 1.0 1.8 5.0 51 35 A 7 ASP H A 18 LYS H 1.0 1.8 6.0 52 36 A 7 ASP H A 20 TYR H 1.0 1.8 6.0 53 37 A 8 PHE H A 9 THR H 1.0 1.8 5.0 54 38 A 9 THR H A 8 PHE HB2 1.0 1.8 6.0 55 38 A 8 PHE HB3 A 9 THR H 1.0 1.8 6.0 56 39 A 8 PHE H A 10 THR H 1.0 1.8 5.0 57 40 A 8 PHE HA A 10 THR H 1.0 1.8 6.0 58 41 A 8 PHE H A 51 LYS HBx 1.0 1.8 5.0 59 41 A 51 LYS HB3 A 8 PHE H 1.0 1.8 5.0 60 42 A 8 PHE H A 51 LYS H 1.0 1.8 5.0 61 43 A 9 THR H A 9 THR HB 1.0 1.8 5.0 62 44 A 9 THR H A 10 THR H 1.0 1.8 2.9 63 45 A 9 THR H A 20 TYR H 1.0 1.8 6.0 64 46 A 9 THR H A 51 LYS HBx 1.0 1.8 6.0 65 46 A 51 LYS HB3 A 9 THR H 1.0 1.8 6.0 66 47 A 9 THR HG2% A 54 SER H 1.0 1.8 6.5 67 48 A 10 THR H A 11 SER H 1.0 1.8 5.0 68 49 A 11 SER H A 10 THR HA 1.0 1.8 2.9 69 50 A 10 THR HG2% A 11 SER H 1.0 1.8 5.5 70 51 A 10 THR HG2% A 12 GLU H 1.0 1.8 5.5 71 52 A 10 THR HG2% A 13 SER H 1.0 1.8 5.5 72 53 A 10 THR HG2% A 14 THR H 1.0 1.8 6.5 73 54 A 10 THR H A 19 GLY HA2 1.0 1.8 7.0 74 54 A 19 GLY HA3 A 10 THR H 1.0 1.8 7.0 75 55 A 20 TYR H A 10 THR H 1.0 1.8 5.0 76 56 A 11 SER H A 12 GLU H 1.0 1.8 2.9 77 57 A 11 SER HA A 12 GLU H 1.0 1.8 5.0 78 58 A 12 GLU H A 11 SER HB2 1.0 1.8 5.0 79 58 A 12 GLU H A 11 SER HB3 1.0 1.8 5.0 80 59 A 11 SER HA A 19 GLY H 1.0 1.8 6.0 81 60 A 20 TYR H A 11 SER HA 1.0 1.8 5.0 82 61 A 11 SER H A 21 SER HB2 1.0 1.8 6.0 83 61 A 11 SER H A 21 SER HB3 1.0 1.8 6.0 84 62 A 21 SER H A 11 SER HB2 1.0 1.8 5.0 85 62 A 11 SER HB3 A 21 SER H 1.0 1.8 5.0 86 63 A 12 GLU H A 13 SER H 1.0 1.8 5.0 87 64 A 13 SER H A 12 GLU HB2 1.0 1.8 5.0 88 64 A 12 GLU HB3 A 13 SER H 1.0 1.8 5.0 89 65 A 12 GLU HA A 13 SER H 1.0 1.8 2.9 90 66 A 13 SER H A 12 GLU HGx 1.0 1.8 5.0 91 66 A 12 GLU HG3 A 13 SER H 1.0 1.8 5.0 92 67 A 14 THR H A 13 SER HBx 1.0 1.8 6.0 93 67 A 13 SER HB3 A 14 THR H 1.0 1.8 6.0 94 68 A 13 SER HA A 14 THR H 1.0 1.8 3.5 95 69 A 13 SER H A 14 THR H 1.0 1.8 6.0 96 70 A 13 SER H A 16 PHE HB2 1.0 1.8 6.0 97 70 A 16 PHE HB3 A 13 SER H 1.0 1.8 6.0 98 71 A 14 THR H A 15 ILE H 1.0 1.8 3.5 99 72 A 14 THR H A 15 ILE HG12 1.0 1.8 6.0 100 72 A 14 THR H A 15 ILE HG13 1.0 1.8 6.0 101 73 A 14 THR H A 16 PHE H 1.0 1.8 6.0 102 74 A 15 ILE H A 16 PHE HB2 1.0 1.8 6.0 103 74 A 16 PHE HB3 A 15 ILE H 1.0 1.8 6.0 104 75 A 15 ILE H A 16 PHE H 1.0 1.8 3.5 105 76 A 15 ILE HG2% A 16 PHE H 1.0 1.8 5.5 106 77 A 16 PHE H A 15 ILE HG12 1.0 1.8 5.0 107 77 A 15 ILE HG13 A 16 PHE H 1.0 1.8 5.0 108 78 A 15 ILE HB A 16 PHE H 1.0 1.8 5.0 109 79 A 16 PHE HD% A 16 PHE H 1.0 1.8 6.0 110 80 A 16 PHE HA A 17 SER H 1.0 1.8 3.5 111 81 A 17 SER H A 16 PHE HB2 1.0 1.8 5.0 112 81 A 16 PHE HB3 A 17 SER H 1.0 1.8 5.0 113 82 A 18 LYS H A 16 PHE HB2 1.0 1.8 5.0 114 82 A 16 PHE HB3 A 18 LYS H 1.0 1.8 5.0 115 83 A 16 PHE HA A 18 LYS H 1.0 1.8 6.0 116 84 A 17 SER H A 18 LYS H 1.0 1.8 5.0 117 85 A 18 LYS H A 17 SER HB2 1.0 1.8 5.0 118 85 A 17 SER HB3 A 18 LYS H 1.0 1.8 5.0 119 86 A 17 SER HA A 18 LYS H 1.0 1.8 5.0 120 87 A 18 LYS H A 18 LYS HD2 1.0 1.8 5.0 121 87 A 18 LYS H A 18 LYS HD3 1.0 1.8 5.0 122 88 A 19 GLY H A 18 LYS HA 1.0 1.8 2.9 123 89 A 19 GLY H A 18 LYS HB2 1.0 1.8 5.0 124 89 A 18 LYS HB3 A 19 GLY H 1.0 1.8 5.0 125 90 A 19 GLY H A 18 LYS HD2 1.0 1.8 5.0 126 90 A 18 LYS HD3 A 19 GLY H 1.0 1.8 5.0 127 91 A 19 GLY H A 18 LYS HGx 1.0 1.8 5.0 128 91 A 18 LYS HG3 A 19 GLY H 1.0 1.8 5.0 129 92 A 19 GLY H A 19 GLY HA2 1.0 1.8 5.0 130 92 A 19 GLY HA3 A 19 GLY H 1.0 1.8 5.0 131 93 A 20 TYR H A 19 GLY HA2 1.0 1.8 3.5 132 93 A 19 GLY HA3 A 20 TYR H 1.0 1.8 3.5 133 94 A 20 TYR HE% A 20 TYR H 1.0 1.8 5.0 134 95 A 20 TYR HD% A 20 TYR H 1.0 1.8 5.0 135 96 A 20 TYR H A 21 SER H 1.0 1.8 5.0 136 97 A 21 SER H A 20 TYR HB2 1.0 1.8 5.0 137 97 A 20 TYR HB3 A 21 SER H 1.0 1.8 5.0 138 98 A 20 TYR HA A 21 SER H 1.0 1.8 2.9 139 99 A 20 TYR H A 25 ILE HG2% 1.0 1.8 6.5 140 100 A 22 ILE H A 21 SER HA 1.0 1.8 2.9 141 101 A 23 ASN H A 21 SER HB2 1.0 1.8 5.0 142 101 A 21 SER HB3 A 23 ASN H 1.0 1.8 5.0 143 102 A 21 SER HA A 24 GLU H 1.0 1.8 5.0 144 103 A 24 GLU H A 21 SER HB2 1.0 1.8 5.0 145 103 A 21 SER HB3 A 24 GLU H 1.0 1.8 5.0 146 104 A 21 SER H A 24 GLU H 1.0 1.8 6.0 147 105 A 21 SER H A 24 GLU HB2 1.0 1.8 6.0 148 105 A 21 SER H A 24 GLU HB3 1.0 1.8 6.0 149 106 A 25 ILE HG2% A 21 SER H 1.0 1.8 6.5 150 107 A 22 ILE H A 23 ASN H 1.0 1.8 3.5 151 108 A 22 ILE HA A 23 ASN H 1.0 1.8 5.0 152 109 A 22 ILE HG2% A 23 ASN H 1.0 1.8 5.5 153 110 A 22 ILE HB A 23 ASN H 1.0 1.8 5.0 154 111 A 23 ASN H A 22 ILE HG12 1.0 1.8 5.0 155 111 A 22 ILE HG13 A 23 ASN H 1.0 1.8 5.0 156 112 A 22 ILE H A 24 GLU H 1.0 1.8 5.0 157 113 A 22 ILE HA A 25 ILE H 1.0 1.8 5.0 158 114 A 23 ASN H A 24 GLU H 1.0 1.8 3.5 159 115 A 23 ASN H A 24 GLU HB2 1.0 1.8 5.0 160 115 A 24 GLU HB3 A 23 ASN H 1.0 1.8 5.0 161 116 A 24 GLU H A 23 ASN HB2 1.0 1.8 5.0 162 116 A 24 GLU H A 23 ASN HB3 1.0 1.8 5.0 163 117 A 23 ASN H A 25 ILE H 1.0 1.8 5.0 164 118 A 23 ASN HA A 26 SER H 1.0 1.8 3.5 165 119 A 25 ILE HG2% A 24 GLU H 1.0 1.8 5.5 166 120 A 24 GLU H A 25 ILE H 1.0 1.8 3.5 167 121 A 24 GLU HA A 25 ILE H 1.0 1.8 5.0 168 122 A 25 ILE H A 24 GLU HB2 1.0 1.8 5.0 169 122 A 24 GLU HB3 A 25 ILE H 1.0 1.8 5.0 170 123 A 25 ILE HG2% A 25 ILE H 1.0 1.8 4.0 171 124 A 25 ILE HA A 26 SER H 1.0 1.8 3.5 172 125 A 25 ILE H A 26 SER H 1.0 1.8 3.5 173 126 A 26 SER H A 25 ILE HG1x 1.0 1.8 5.0 174 126 A 25 ILE HG13 A 26 SER H 1.0 1.8 5.0 175 127 A 25 ILE HG2% A 26 SER H 1.0 1.8 5.5 176 128 A 26 SER H A 27 ASN H 1.0 1.8 5.0 177 129 A 27 ASN H A 26 SER HBx 1.0 1.8 5.0 178 129 A 26 SER HB3 A 27 ASN H 1.0 1.8 5.0 179 130 A 28 LYS H A 26 SER HBx 1.0 1.8 6.0 180 130 A 26 SER HB3 A 28 LYS H 1.0 1.8 6.0 181 131 A 28 LYS H A 27 ASN HA 1.0 1.8 3.5 182 132 A 28 LYS H A 27 ASN HBx 1.0 1.8 5.0 183 132 A 28 LYS H A 27 ASN HB3 1.0 1.8 5.0 184 133 A 28 LYS H A 29 SER H 1.0 1.8 5.0 185 134 A 29 SER H A 28 LYS HDx 1.0 1.8 6.0 186 134 A 29 SER H A 28 LYS HD3 1.0 1.8 6.0 187 135 A 29 SER H A 28 LYS HB2 1.0 1.8 5.0 188 135 A 28 LYS HB3 A 29 SER H 1.0 1.8 5.0 189 136 A 28 LYS HA A 29 SER H 1.0 1.8 3.5 190 137 A 30 SER H A 29 SER HA 1.0 1.8 3.5 191 138 A 30 SER HA A 31 ASN H 1.0 1.8 3.5 192 139 A 30 SER HA A 32 ASN H 1.0 1.8 6.0 193 140 A 34 GLN H A 33 GLN H 1.0 1.8 5.0 194 141 A 35 ASP H A 34 GLN HB2 1.0 1.8 5.0 195 141 A 34 GLN HB3 A 35 ASP H 1.0 1.8 5.0 196 142 A 35 ASP H A 34 GLN HA 1.0 1.8 4.0 197 143 A 34 GLN H A 119 LYS HEx 1.0 1.8 6.0 198 143 A 34 GLN H A 119 LYS HE3 1.0 1.8 6.0 199 144 A 34 GLN H A 119 LYS HDx 1.0 1.8 6.0 200 144 A 34 GLN H A 119 LYS HD3 1.0 1.8 6.0 201 145 A 34 GLN H A 120 LYS HEx 1.0 1.8 6.0 202 145 A 34 GLN H A 120 LYS HE3 1.0 1.8 6.0 203 146 A 36 ILE H A 35 ASP HA 1.0 1.8 2.9 204 147 A 36 ILE H A 35 ASP H 1.0 1.8 5.0 205 148 A 36 ILE HG2% A 37 VAL H 1.0 1.8 5.5 206 149 A 36 ILE HA A 37 VAL H 1.0 1.8 2.9 207 150 A 37 VAL H A 36 ILE HG12 1.0 1.8 6.0 208 150 A 36 ILE HG13 A 37 VAL H 1.0 1.8 6.0 209 151 A 36 ILE H A 37 VAL HG2% 1.0 1.8 5.5 210 152 A 36 ILE H A 121 LEU HA 1.0 1.8 5.0 211 153 A 36 ILE H A 122 VAL H 1.0 1.8 5.0 212 154 A 37 VAL HG2% A 37 VAL H 1.0 1.8 4.0 213 155 A 37 VAL H A 38 CYS H 1.0 1.8 5.0 214 156 A 38 CYS H A 37 VAL HG1% 1.0 1.8 4.0 215 157 A 37 VAL HB A 38 CYS H 1.0 1.8 5.0 216 158 A 38 CYS H A 39 THR H 1.0 1.8 6.0 217 159 A 38 CYS HA A 39 THR H 1.0 1.8 2.9 218 160 A 39 THR H A 38 CYS HBx 1.0 1.8 5.0 219 160 A 38 CYS HB3 A 39 THR H 1.0 1.8 5.0 220 161 A 38 CYS H A 122 VAL H 1.0 1.8 5.0 221 162 A 38 CYS H A 122 VAL HB 1.0 1.8 5.0 222 163 A 38 CYS H A 8 PHE HZ 1.0 1.8 6.0 223 164 A 38 CYS H A 123 PHE HA 1.0 1.8 5.0 224 165 A 38 CYS H A 124 THR H 1.0 1.8 5.0 225 166 A 124 THR H A 38 CYS HBx 1.0 1.8 6.0 226 166 A 38 CYS HB3 A 124 THR H 1.0 1.8 6.0 227 167 A 39 THR HB A 40 VAL H 1.0 1.8 5.0 228 168 A 39 THR HA A 40 VAL H 1.0 1.8 2.9 229 169 A 39 THR H A 40 VAL H 1.0 1.8 5.0 230 170 A 39 THR HA A 124 THR H 1.0 1.8 5.0 231 171 A 40 VAL HA A 41 LYS H 1.0 1.8 2.9 232 172 A 41 LYS H A 40 VAL HG1% 1.0 1.8 4.0 233 172 A 40 VAL HG2% A 41 LYS H 1.0 1.8 4.0 234 173 A 40 VAL H A 41 LYS H 1.0 1.8 5.0 235 174 A 124 THR H A 40 VAL H 1.0 1.8 5.0 236 175 A 40 VAL H A 125 VAL HA 1.0 1.8 5.0 237 176 A 40 VAL H A 125 VAL HB 1.0 1.8 6.0 238 177 A 40 VAL H A 125 VAL HG1% 1.0 1.8 6.5 239 177 A 40 VAL H A 125 VAL HG2% 1.0 1.8 6.5 240 178 A 40 VAL H A 126 GLU H 1.0 1.8 5.0 241 179 A 41 LYS HA A 42 ALA H 1.0 1.8 2.9 242 180 A 41 LYS H A 42 ALA H 1.0 1.8 5.0 243 181 A 42 ALA HB% A 43 HIS H 1.0 1.8 4.0 244 182 A 42 ALA HA A 43 HIS H 1.0 1.8 2.9 245 183 A 42 ALA H A 125 VAL HG1% 1.0 1.8 5.5 246 183 A 125 VAL HG2% A 42 ALA H 1.0 1.8 5.5 247 184 A 42 ALA H A 126 GLU H 1.0 1.8 5.0 248 185 A 42 ALA HB% A 127 ALA H 1.0 1.8 6.5 249 186 A 43 HIS H A 43 HIS HA 1.0 1.8 5.0 250 187 A 43 HIS HA A 44 ALA H 1.0 1.8 2.9 251 188 A 43 HIS HA A 44 ALA H 1.0 1.8 5.0 252 189 A 44 ALA H A 43 HIS HB2 1.0 1.8 3.5 253 189 A 43 HIS HB3 A 44 ALA H 1.0 1.8 3.5 254 190 A 43 HIS HD2 A 44 ALA H 1.0 1.8 5.0 255 191 A 46 ASP H A 43 HIS HB2 1.0 1.8 6.0 256 191 A 43 HIS HB3 A 46 ASP H 1.0 1.8 6.0 257 192 A 43 HIS H A 46 ASP HB2 1.0 1.8 5.0 258 192 A 46 ASP HB3 A 43 HIS H 1.0 1.8 5.0 259 193 A 44 ALA HA A 45 ASN H 1.0 1.8 4.0 260 194 A 44 ALA HB% A 45 ASN H 1.0 1.8 4.0 261 195 A 45 ASN H A 44 ALA H 1.0 1.8 5.0 262 196 A 44 ALA HA A 46 ASP H 1.0 1.8 5.0 263 197 A 44 ALA HB% A 101 SER H 1.0 1.8 6.5 264 198 A 44 ALA HB% A 102 LEU H 1.0 1.8 5.5 265 199 A 103 ILE HD1% A 44 ALA H 1.0 1.8 5.5 266 200 A 45 ASN HA A 46 ASP H 1.0 1.8 5.0 267 201 A 46 ASP H A 45 ASN H 1.0 1.8 5.0 268 202 A 45 ASN H A 99 LEU HB2 1.0 1.8 5.0 269 202 A 99 LEU HB3 A 45 ASN H 1.0 1.8 5.0 270 203 A 103 ILE HG2% A 45 ASN H 1.0 1.8 7.5 271 204 A 103 ILE HD1% A 45 ASN H 1.0 1.8 6.5 272 205 A 47 LEU H A 46 ASP HB2 1.0 1.8 5.0 273 205 A 46 ASP HB3 A 47 LEU H 1.0 1.8 5.0 274 206 A 46 ASP H A 99 LEU H 1.0 1.8 6.0 275 207 A 46 ASP H A 99 LEU HB2 1.0 1.8 5.0 276 207 A 99 LEU HB3 A 46 ASP H 1.0 1.8 5.0 277 208 A 47 LEU H A 48 ILE H 1.0 1.8 5.0 278 209 A 48 ILE HG2% A 47 LEU H 1.0 1.8 5.5 279 210 A 47 LEU HA A 48 ILE H 1.0 1.8 2.9 280 211 A 47 LEU HA A 97 SER H 1.0 1.8 6.0 281 212 A 47 LEU H A 98 ARG HA 1.0 1.8 7.0 282 213 A 98 ARG HE A 47 LEU HD1% 1.0 1.8 6.5 283 213 A 47 LEU HD2% A 98 ARG HE 1.0 1.8 6.5 284 214 A 47 LEU HA A 99 LEU H 1.0 1.8 5.0 285 215 A 49 GLY H A 48 ILE HG12 1.0 1.8 6.0 286 215 A 48 ILE HG13 A 49 GLY H 1.0 1.8 6.0 287 216 A 48 ILE HG2% A 49 GLY H 1.0 1.8 5.5 288 217 A 48 ILE HA A 49 GLY H 1.0 1.8 3.5 289 218 A 48 ILE HB A 49 GLY H 1.0 1.8 3.5 290 219 A 48 ILE H A 49 GLY H 1.0 1.8 6.0 291 220 A 48 ILE H A 97 SER H 1.0 1.8 5.0 292 221 A 48 ILE H A 98 ARG HA 1.0 1.8 5.0 293 222 A 48 ILE H A 99 LEU H 1.0 1.8 6.0 294 223 A 99 LEU HG A 48 ILE H 1.0 1.8 5.0 295 224 A 50 PHE H A 49 GLY HA2 1.0 1.8 3.5 296 224 A 49 GLY HA3 A 50 PHE H 1.0 1.8 3.5 297 225 A 49 GLY H A 50 PHE H 1.0 1.8 5.0 298 226 A 97 SER H A 49 GLY HA2 1.0 1.8 6.0 299 226 A 49 GLY HA3 A 97 SER H 1.0 1.8 6.0 300 227 A 50 PHE HD% A 50 PHE H 1.0 1.8 6.0 301 228 A 50 PHE HA A 51 LYS H 1.0 1.8 3.5 302 229 A 51 LYS H A 50 PHE HB2 1.0 1.8 5.0 303 229 A 50 PHE HB3 A 51 LYS H 1.0 1.8 5.0 304 230 A 50 PHE HE% A 95 PHE H 1.0 1.8 5.0 305 231 A 50 PHE H A 95 PHE HB2 1.0 1.8 5.0 306 231 A 50 PHE H A 95 PHE HB3 1.0 1.8 5.0 307 232 A 96 TYR HA A 50 PHE H 1.0 1.8 5.0 308 233 A 52 CYS H A 51 LYS HD2 1.0 1.8 5.0 309 233 A 51 LYS HD3 A 52 CYS H 1.0 1.8 5.0 310 234 A 52 CYS H A 51 LYS HBx 1.0 1.8 5.0 311 234 A 51 LYS HB3 A 52 CYS H 1.0 1.8 5.0 312 235 A 51 LYS HA A 52 CYS H 1.0 1.8 2.9 313 236 A 52 CYS H A 93 ASN HD2y 1.0 1.8 6.0 314 236 A 52 CYS H A 93 ASN HD21 1.0 1.8 6.0 315 237 A 52 CYS H A 93 ASN HB2 1.0 1.8 5.0 316 237 A 52 CYS H A 93 ASN HB3 1.0 1.8 5.0 317 238 A 52 CYS HB3 A 93 ASN HD2y 1.0 1.8 6.0 318 238 A 52 CYS HB2 A 93 ASN HD2y 1.0 1.8 6.0 319 238 A 93 ASN HD21 A 52 CYS HB3 1.0 1.8 6.0 320 238 A 52 CYS HB2 A 93 ASN HD21 1.0 1.8 6.0 321 239 A 52 CYS HB2 A 93 ASN HD21 1.0 1.8 5.0 322 239 A 52 CYS HB2 A 93 ASN HD2y 1.0 1.8 5.0 323 240 A 94 THR HA A 52 CYS H 1.0 1.8 5.0 324 241 A 54 SER H A 53 PRO HB2 1.0 1.8 5.0 325 241 A 53 PRO HB3 A 54 SER H 1.0 1.8 5.0 326 242 A 54 SER H A 53 PRO HA 1.0 1.8 2.9 327 243 A 55 ASN H A 53 PRO HB2 1.0 1.8 6.0 328 243 A 53 PRO HB3 A 55 ASN H 1.0 1.8 6.0 329 244 A 56 TYR H A 53 PRO HB2 1.0 1.8 6.0 330 244 A 53 PRO HB3 A 56 TYR H 1.0 1.8 6.0 331 245 A 55 ASN H A 54 SER HB2 1.0 1.8 5.0 332 245 A 54 SER HBy A 55 ASN H 1.0 1.8 5.0 333 246 A 55 ASN H A 54 SER HA 1.0 1.8 5.0 334 247 A 56 TYR H A 54 SER HB2 1.0 1.8 6.0 335 247 A 54 SER HBy A 56 TYR H 1.0 1.8 6.0 336 248 A 54 SER HA A 56 TYR H 1.0 1.8 5.0 337 249 A 54 SER H A 93 ASN HD2y 1.0 1.8 6.0 338 249 A 93 ASN HD21 A 54 SER H 1.0 1.8 6.0 339 250 A 54 SER HA A 93 ASN HD2y 1.0 1.8 5.0 340 250 A 93 ASN HD21 A 54 SER HA 1.0 1.8 5.0 341 251 A 55 ASN H A 56 TYR H 1.0 1.8 3.5 342 252 A 56 TYR H A 55 ASN HD22 1.0 1.8 5.0 343 252 A 55 ASN HD21 A 56 TYR H 1.0 1.8 5.0 344 253 A 55 ASN H A 93 ASN HD2y 1.0 1.8 6.0 345 253 A 93 ASN HD21 A 55 ASN H 1.0 1.8 6.0 346 254 A 56 TYR H A 57 SER H 1.0 1.8 5.0 347 255 A 57 SER H A 56 TYR HB2 1.0 1.8 5.0 348 255 A 56 TYR HB3 A 57 SER H 1.0 1.8 5.0 349 256 A 56 TYR HA A 57 SER H 1.0 1.8 2.9 350 257 A 56 TYR H A 93 ASN HD2y 1.0 1.8 3.5 351 257 A 93 ASN HD21 A 56 TYR H 1.0 1.8 3.5 352 258 A 56 TYR HB3 A 93 ASN HD2y 1.0 1.8 6.0 353 258 A 56 TYR HB2 A 93 ASN HD2y 1.0 1.8 6.0 354 258 A 93 ASN HD21 A 56 TYR HB2 1.0 1.8 6.0 355 258 A 93 ASN HD21 A 56 TYR HB3 1.0 1.8 6.0 356 259 A 114 SER H A 56 TYR HB2 1.0 1.8 5.0 357 259 A 56 TYR HB3 A 114 SER H 1.0 1.8 5.0 358 260 A 58 VAL H A 57 SER HA 1.0 1.8 2.9 359 261 A 58 VAL H A 57 SER HB2 1.0 1.8 5.0 360 261 A 57 SER HB3 A 58 VAL H 1.0 1.8 5.0 361 262 A 57 SER H A 58 VAL H 1.0 1.8 5.0 362 263 A 57 SER H A 113 CYS HB2 1.0 1.8 6.0 363 263 A 113 CYS HB3 A 57 SER H 1.0 1.8 6.0 364 264 A 113 CYS HA A 57 SER H 1.0 1.8 6.0 365 265 A 114 SER H A 57 SER HB2 1.0 1.8 5.0 366 265 A 114 SER H A 57 SER HB3 1.0 1.8 5.0 367 266 A 57 SER H A 115 LYS HA 1.0 1.8 6.0 368 267 A 57 SER H A 115 LYS HB2 1.0 1.8 5.0 369 267 A 115 LYS HB3 A 57 SER H 1.0 1.8 5.0 370 268 A 58 VAL HG1% A 59 GLU H 1.0 1.8 5.5 371 269 A 58 VAL HB A 59 GLU H 1.0 1.8 6.0 372 270 A 58 VAL H A 59 GLU H 1.0 1.8 6.0 373 271 A 58 VAL HG2% A 59 GLU H 1.0 1.8 5.5 374 272 A 58 VAL HA A 59 GLU H 1.0 1.8 2.9 375 273 A 58 VAL H A 93 ASN HD2y 1.0 1.8 6.0 376 273 A 93 ASN HD21 A 58 VAL H 1.0 1.8 6.0 377 274 A 58 VAL HG1% A 93 ASN HD2y 1.0 1.8 5.5 378 274 A 58 VAL HG1% A 93 ASN HD21 1.0 1.8 5.5 379 275 A 58 VAL HG1% A 114 SER H 1.0 1.8 5.5 380 276 A 114 SER H A 58 VAL HA 1.0 1.8 5.0 381 277 A 59 GLU H A 111 CYS HB2 1.0 1.8 6.0 382 277 A 111 CYS HB3 A 59 GLU H 1.0 1.8 6.0 383 278 A 59 GLU H A 112 VAL H 1.0 1.8 5.0 384 279 A 113 CYS HA A 59 GLU H 1.0 1.8 5.0 385 280 A 61 HIS H A 60 PRO HB2 1.0 1.8 5.0 386 280 A 60 PRO HB3 A 61 HIS H 1.0 1.8 5.0 387 281 A 60 PRO HA A 62 ASP H 1.0 1.8 6.0 388 282 A 62 ASP H A 60 PRO HB2 1.0 1.8 5.0 389 282 A 60 PRO HB3 A 62 ASP H 1.0 1.8 5.0 390 283 A 61 HIS H A 62 ASP H 1.0 1.8 5.0 391 284 A 61 HIS HA A 62 ASP H 1.0 1.8 5.0 392 285 A 62 ASP H A 61 HIS HB2 1.0 1.8 5.0 393 285 A 61 HIS HB3 A 62 ASP H 1.0 1.8 5.0 394 286 A 63 CYS H A 62 ASP HA 1.0 1.8 6.0 395 287 A 63 CYS H A 62 ASP H 1.0 1.8 6.0 396 288 A 63 CYS H A 64 PHE H 1.0 1.8 6.0 397 289 A 64 PHE H A 64 PHE HB2 1.0 1.8 6.0 398 289 A 64 PHE H A 64 PHE HB3 1.0 1.8 6.0 399 290 A 64 PHE H A 65 VAL H 1.0 1.8 5.0 400 291 A 64 PHE H A 77 LEU HD1% 1.0 1.8 6.5 401 291 A 64 PHE H A 77 LEU HD2% 1.0 1.8 6.5 402 292 A 64 PHE H A 83 LEU HD1% 1.0 1.8 6.5 403 292 A 64 PHE H A 83 LEU HD2% 1.0 1.8 6.5 404 293 A 65 VAL HA A 66 SER H 1.0 1.8 5.0 405 294 A 65 VAL HG2% A 76 ASN HD22 1.0 1.8 5.5 406 294 A 65 VAL HG2% A 76 ASN HD21 1.0 1.8 5.5 407 295 A 66 SER H A 66 SER HA 1.0 1.8 5.0 408 296 A 66 SER H A 66 SER HB2 1.0 1.8 5.0 409 296 A 66 SER HB3 A 66 SER H 1.0 1.8 5.0 410 297 A 66 SER HA A 77 LEU H 1.0 1.8 5.0 411 298 A 78 GLU H A 66 SER HA 1.0 1.8 6.0 412 299 A 67 ALA H A 68 PHE H 1.0 1.8 6.0 413 300 A 67 ALA HB% A 68 PHE H 1.0 1.8 5.5 414 301 A 67 ALA HA A 68 PHE H 1.0 1.8 5.0 415 302 A 69 ASN H A 69 ASN HD22 1.0 1.8 6.0 416 302 A 69 ASN H A 69 ASN HD21 1.0 1.8 6.0 417 303 A 69 ASN HA A 71 SER H 1.0 1.8 6.0 418 304 A 71 SER H A 69 ASN HD22 1.0 1.8 6.0 419 304 A 69 ASN HD21 A 71 SER H 1.0 1.8 6.0 420 305 A 71 SER H A 69 ASN HB2 1.0 1.8 6.0 421 305 A 69 ASN HB3 A 71 SER H 1.0 1.8 6.0 422 306 A 69 ASN H A 73 LYS H 1.0 1.8 5.0 423 307 A 69 ASN HD22 A 73 LYS HB2 1.0 1.8 4.0 424 307 A 69 ASN HD21 A 73 LYS HB2 1.0 1.8 4.0 425 307 A 73 LYS HB3 A 69 ASN HD22 1.0 1.8 4.0 426 307 A 69 ASN HD21 A 73 LYS HB3 1.0 1.8 4.0 427 308 A 70 LEU H A 70 LEU HA 1.0 1.8 5.0 428 309 A 70 LEU H A 71 SER H 1.0 1.8 5.0 429 310 A 70 LEU HA A 71 SER H 1.0 1.8 5.0 430 311 A 71 SER H A 72 GLY H 1.0 1.8 3.5 431 312 A 71 SER H A 72 GLY HA2 1.0 1.8 6.0 432 312 A 71 SER H A 72 GLY HA3 1.0 1.8 6.0 433 313 A 72 GLY H A 71 SER HBx 1.0 1.8 6.0 434 313 A 71 SER HB3 A 72 GLY H 1.0 1.8 6.0 435 314 A 72 GLY H A 71 SER HA 1.0 1.8 5.0 436 315 A 71 SER H A 73 LYS H 1.0 1.8 6.0 437 316 A 72 GLY H A 73 LYS H 1.0 1.8 5.0 438 317 A 73 LYS H A 72 GLY HA2 1.0 1.8 5.0 439 317 A 72 GLY HA3 A 73 LYS H 1.0 1.8 5.0 440 318 A 74 ASN H A 73 LYS HB2 1.0 1.8 5.0 441 318 A 73 LYS HB3 A 74 ASN H 1.0 1.8 5.0 442 319 A 74 ASN H A 73 LYS HD2 1.0 1.8 6.0 443 319 A 74 ASN H A 73 LYS HD3 1.0 1.8 6.0 444 320 A 73 LYS H A 74 ASN H 1.0 1.8 6.0 445 321 A 74 ASN HA A 75 GLU H 1.0 1.8 5.0 446 322 A 76 ASN H A 76 ASN HD22 1.0 1.8 6.0 447 322 A 76 ASN HD21 A 76 ASN H 1.0 1.8 6.0 448 323 A 78 GLU H A 76 ASN HBx 1.0 1.8 5.0 449 323 A 78 GLU H A 76 ASN HB3 1.0 1.8 5.0 450 324 A 79 ASN H A 76 ASN HD22 1.0 1.8 6.0 451 324 A 76 ASN HD21 A 79 ASN H 1.0 1.8 6.0 452 325 A 78 GLU H A 77 LEU H 1.0 1.8 5.0 453 326 A 78 GLU H A 77 LEU HA 1.0 1.8 5.0 454 327 A 78 GLU H A 77 LEU HD1% 1.0 1.8 6.5 455 327 A 78 GLU H A 77 LEU HD2% 1.0 1.8 6.5 456 328 A 78 GLU HA A 79 ASN H 1.0 1.8 5.0 457 329 A 80 LYS H A 79 ASN H 1.0 1.8 3.5 458 330 A 81 LEU H A 80 LYS H 1.0 1.8 3.5 459 331 A 82 LYS H A 81 LEU HD1% 1.0 1.8 5.5 460 331 A 81 LEU HD2% A 82 LYS H 1.0 1.8 5.5 461 332 A 107 TRP HE1 A 81 LEU HD1% 1.0 1.8 5.5 462 332 A 81 LEU HD2% A 107 TRP HE1 1.0 1.8 5.5 463 333 A 83 LEU H A 82 LYS H 1.0 1.8 5.0 464 334 A 83 LEU H A 82 LYS HA 1.0 1.8 5.0 465 335 A 83 LEU HA A 84 THR H 1.0 1.8 3.5 466 336 A 84 THR H A 83 LEU HD1% 1.0 1.8 5.5 467 336 A 83 LEU HD2% A 84 THR H 1.0 1.8 5.5 468 337 A 84 THR H A 83 LEU HB2 1.0 1.8 5.0 469 337 A 83 LEU HB3 A 84 THR H 1.0 1.8 5.0 470 338 A 84 THR HA A 84 THR H 1.0 1.8 5.0 471 339 A 84 THR HG2% A 85 ASN H 1.0 1.8 5.5 472 340 A 84 THR HA A 85 ASN H 1.0 1.8 3.5 473 341 A 85 ASN H A 84 THR HB 1.0 1.8 3.5 474 342 A 84 THR H A 85 ASN H 1.0 1.8 6.0 475 343 A 85 ASN H A 85 ASN HB2 1.0 1.8 5.0 476 343 A 85 ASN H A 85 ASN HB3 1.0 1.8 5.0 477 344 A 85 ASN H A 86 ILE H 1.0 1.8 5.0 478 345 A 86 ILE H A 85 ASN HB2 1.0 1.8 6.0 479 345 A 85 ASN HB3 A 86 ILE H 1.0 1.8 6.0 480 346 A 85 ASN HA A 86 ILE H 1.0 1.8 3.5 481 347 A 86 ILE HA A 87 ILE H 1.0 1.8 5.0 482 348 A 86 ILE H A 87 ILE H 1.0 1.8 6.0 483 349 A 86 ILE HG2% A 96 TYR H 1.0 1.8 6.5 484 350 A 88 MET H A 87 ILE HG12 1.0 1.8 5.0 485 350 A 87 ILE HG13 A 88 MET H 1.0 1.8 5.0 486 351 A 87 ILE HA A 88 MET H 1.0 1.8 2.9 487 352 A 87 ILE HG2% A 88 MET H 1.0 1.8 5.5 488 353 A 87 ILE H A 88 MET H 1.0 1.8 6.0 489 354 A 87 ILE HD1% A 88 MET H 1.0 1.8 6.5 490 355 A 87 ILE HG2% A 89 ASP H 1.0 1.8 5.5 491 356 A 87 ILE H A 96 TYR HB2 1.0 1.8 6.0 492 356 A 96 TYR HB3 A 87 ILE H 1.0 1.8 6.0 493 357 A 87 ILE HB A 96 TYR H 1.0 1.8 5.0 494 358 A 87 ILE HG2% A 96 TYR H 1.0 1.8 5.5 495 359 A 88 MET H A 88 MET HB2 1.0 1.8 5.0 496 359 A 88 MET H A 88 MET HB3 1.0 1.8 5.0 497 360 A 88 MET H A 89 ASP H 1.0 1.8 6.0 498 361 A 89 ASP H A 88 MET HB2 1.0 1.8 6.0 499 361 A 88 MET HB3 A 89 ASP H 1.0 1.8 6.0 500 362 A 88 MET HA A 89 ASP H 1.0 1.8 5.0 501 363 A 89 ASP H A 88 MET HG2 1.0 1.8 5.0 502 363 A 88 MET HG3 A 89 ASP H 1.0 1.8 5.0 503 364 A 89 ASP HA A 90 HIS H 1.0 1.8 2.9 504 365 A 89 ASP H A 90 HIS H 1.0 1.8 6.0 505 366 A 94 THR H A 89 ASP HB2 1.0 1.8 5.0 506 366 A 89 ASP HB3 A 94 THR H 1.0 1.8 5.0 507 367 A 95 PHE HA A 89 ASP H 1.0 1.8 5.0 508 368 A 90 HIS HD2 A 90 HIS H 1.0 1.8 6.0 509 369 A 90 HIS HA A 91 TYR H 1.0 1.8 3.5 510 370 A 91 TYR H A 90 HIS HB2 1.0 1.8 6.0 511 370 A 90 HIS HB3 A 91 TYR H 1.0 1.8 6.0 512 371 A 90 HIS HA A 93 ASN H 1.0 1.8 5.0 513 372 A 91 TYR H A 92 ASN H 1.0 1.8 3.5 514 373 A 91 TYR H A 93 ASN H 1.0 1.8 5.0 515 374 A 92 ASN H A 92 ASN HD22 1.0 1.8 5.0 516 374 A 92 ASN HD21 A 92 ASN H 1.0 1.8 5.0 517 375 A 93 ASN HB2 A 93 ASN HD2y 1.0 1.8 5.0 518 375 A 93 ASN HB3 A 93 ASN HD2y 1.0 1.8 5.0 519 375 A 93 ASN HD21 A 93 ASN HB2 1.0 1.8 5.0 520 375 A 93 ASN HD21 A 93 ASN HB3 1.0 1.8 5.0 521 376 A 93 ASN H A 94 THR H 1.0 1.8 5.0 522 377 A 95 PHE HD% A 95 PHE H 1.0 1.8 5.0 523 378 A 95 PHE HA A 96 TYR H 1.0 1.8 3.5 524 379 A 95 PHE H A 96 TYR H 1.0 1.8 6.0 525 380 A 96 TYR HA A 96 TYR H 1.0 1.8 5.0 526 381 A 97 SER H A 96 TYR HB2 1.0 1.8 5.0 527 381 A 96 TYR HB3 A 97 SER H 1.0 1.8 5.0 528 382 A 97 SER H A 96 TYR HA 1.0 1.8 2.9 529 383 A 98 ARG H A 97 SER HA 1.0 1.8 3.5 530 384 A 98 ARG H A 97 SER HB2 1.0 1.8 5.0 531 384 A 98 ARG H A 97 SER HB3 1.0 1.8 5.0 532 385 A 98 ARG H A 98 ARG HB2 1.0 1.8 5.0 533 385 A 98 ARG H A 98 ARG HB3 1.0 1.8 5.0 534 386 A 98 ARG HA A 99 LEU H 1.0 1.8 2.9 535 387 A 99 LEU H A 98 ARG HG2 1.0 1.8 5.0 536 387 A 98 ARG HG3 A 99 LEU H 1.0 1.8 5.0 537 388 A 99 LEU H A 98 ARG HD2 1.0 1.8 6.0 538 388 A 98 ARG HD3 A 99 LEU H 1.0 1.8 6.0 539 389 A 99 LEU H A 100 PRO HD2 1.0 1.8 6.0 540 389 A 100 PRO HD3 A 99 LEU H 1.0 1.8 6.0 541 390 A 101 SER H A 100 PRO HG2 1.0 1.8 6.0 542 390 A 100 PRO HG3 A 101 SER H 1.0 1.8 6.0 543 391 A 101 SER H A 100 PRO HB2 1.0 1.8 5.0 544 391 A 100 PRO HB3 A 101 SER H 1.0 1.8 5.0 545 392 A 101 SER H A 100 PRO HA 1.0 1.8 2.9 546 393 A 102 LEU H A 100 PRO HB2 1.0 1.8 3.5 547 393 A 100 PRO HB3 A 102 LEU H 1.0 1.8 3.5 548 394 A 102 LEU H A 100 PRO HG2 1.0 1.8 5.0 549 394 A 100 PRO HG3 A 102 LEU H 1.0 1.8 5.0 550 395 A 102 LEU H A 100 PRO HA 1.0 1.8 5.0 551 396 A 101 SER H A 102 LEU H 1.0 1.8 3.5 552 397 A 101 SER HA A 102 LEU H 1.0 1.8 5.0 553 398 A 102 LEU H A 101 SER HBx 1.0 1.8 5.0 554 398 A 102 LEU H A 101 SER HB3 1.0 1.8 5.0 555 399 A 102 LEU H A 102 LEU HD1% 1.0 1.8 5.5 556 399 A 102 LEU HD2% A 102 LEU H 1.0 1.8 5.5 557 400 A 103 ILE H A 102 LEU HB2 1.0 1.8 5.0 558 400 A 103 ILE H A 102 LEU HB3 1.0 1.8 5.0 559 401 A 103 ILE H A 102 LEU HD1% 1.0 1.8 5.5 560 401 A 103 ILE H A 102 LEU HD2% 1.0 1.8 5.5 561 402 A 102 LEU HA A 103 ILE H 1.0 1.8 2.9 562 403 A 103 ILE H A 102 LEU H 1.0 1.8 6.0 563 404 A 105 ASP H A 102 LEU HD1% 1.0 1.8 6.5 564 404 A 102 LEU HD2% A 105 ASP H 1.0 1.8 6.5 565 405 A 103 ILE HG2% A 104 SER H 1.0 1.8 6.5 566 406 A 103 ILE HB A 104 SER H 1.0 1.8 6.0 567 407 A 103 ILE HG2% A 105 ASP H 1.0 1.8 5.5 568 408 A 107 TRP HE1 A 103 ILE HA 1.0 1.8 6.0 569 409 A 103 ILE HD1% A 107 TRP HE1 1.0 1.8 5.5 570 410 A 103 ILE HG2% A 107 TRP HE1 1.0 1.8 5.5 571 411 A 107 TRP HE1 A 103 ILE HB 1.0 1.8 5.0 572 412 A 104 SER H A 105 ASP H 1.0 1.8 5.0 573 413 A 105 ASP H A 104 SER HB2 1.0 1.8 5.0 574 413 A 104 SER HB3 A 105 ASP H 1.0 1.8 5.0 575 414 A 107 TRP HE1 A 104 SER H 1.0 1.8 6.0 576 415 A 105 ASP H A 106 ASN H 1.0 1.8 5.0 577 416 A 107 TRP HE1 A 105 ASP H 1.0 1.8 6.0 578 417 A 107 TRP HE1 A 105 ASP HBx 1.0 1.8 5.0 579 417 A 107 TRP HE1 A 105 ASP HB3 1.0 1.8 5.0 580 418 A 106 ASN H A 107 TRP H 1.0 1.8 5.0 581 419 A 107 TRP H A 106 ASN HA 1.0 1.8 3.5 582 420 A 107 TRP HE1 A 107 TRP H 1.0 1.8 6.0 583 421 A 107 TRP HD1 A 107 TRP H 1.0 1.8 6.0 584 422 A 127 ALA H A 107 TRP HB2 1.0 1.8 6.0 585 422 A 107 TRP HB3 A 127 ALA H 1.0 1.8 6.0 586 423 A 127 ALA HB% A 107 TRP H 1.0 1.8 5.5 587 424 A 109 PHE H A 108 LYS HD2 1.0 1.8 6.0 588 424 A 109 PHE H A 108 LYS HD3 1.0 1.8 6.0 589 425 A 108 LYS HA A 109 PHE H 1.0 1.8 3.5 590 426 A 108 LYS H A 109 PHE H 1.0 1.8 6.0 591 427 A 108 LYS HA A 127 ALA H 1.0 1.8 5.0 592 428 A 109 PHE HA A 110 PHE H 1.0 1.8 6.0 593 429 A 109 PHE HE% A 111 CYS H 1.0 1.8 6.0 594 430 A 109 PHE H A 125 VAL H 1.0 1.8 5.0 595 431 A 109 PHE H A 125 VAL HG1% 1.0 1.8 6.5 596 431 A 125 VAL HG2% A 109 PHE H 1.0 1.8 6.5 597 432 A 109 PHE H A 126 GLU HA 1.0 1.8 5.0 598 433 A 111 CYS H A 110 PHE HB2 1.0 1.8 5.0 599 433 A 110 PHE HB3 A 111 CYS H 1.0 1.8 5.0 600 434 A 110 PHE HA A 111 CYS H 1.0 1.8 3.5 601 435 A 125 VAL H A 110 PHE HB2 1.0 1.8 6.0 602 435 A 110 PHE HB3 A 125 VAL H 1.0 1.8 6.0 603 436 A 110 PHE HA A 125 VAL H 1.0 1.8 6.0 604 437 A 112 VAL H A 111 CYS HA 1.0 1.8 5.0 605 438 A 112 VAL H A 111 CYS HB2 1.0 1.8 6.0 606 438 A 111 CYS HB3 A 112 VAL H 1.0 1.8 6.0 607 439 A 111 CYS H A 112 VAL HG1% 1.0 1.8 6.5 608 439 A 112 VAL HG2% A 111 CYS H 1.0 1.8 6.5 609 440 A 111 CYS H A 122 VAL HA 1.0 1.8 6.0 610 441 A 122 VAL HG1% A 111 CYS H 1.0 1.8 5.5 611 442 A 111 CYS H A 123 PHE H 1.0 1.8 5.0 612 443 A 111 CYS H A 123 PHE HBx 1.0 1.8 5.0 613 443 A 111 CYS H A 123 PHE HB3 1.0 1.8 5.0 614 444 A 124 THR HA A 111 CYS H 1.0 1.8 5.0 615 445 A 113 CYS H A 112 VAL HG1% 1.0 1.8 5.5 616 445 A 112 VAL HG2% A 113 CYS H 1.0 1.8 5.5 617 446 A 112 VAL HA A 113 CYS H 1.0 1.8 2.9 618 447 A 112 VAL HB A 113 CYS H 1.0 1.8 5.0 619 448 A 121 LEU H A 112 VAL HG1% 1.0 1.8 5.5 620 448 A 112 VAL HG2% A 121 LEU H 1.0 1.8 5.5 621 449 A 123 PHE H A 112 VAL HG1% 1.0 1.8 6.5 622 449 A 112 VAL HG2% A 123 PHE H 1.0 1.8 6.5 623 450 A 114 SER H A 113 CYS H 1.0 1.8 6.0 624 451 A 113 CYS HA A 114 SER H 1.0 1.8 2.9 625 452 A 114 SER H A 113 CYS HB2 1.0 1.8 5.0 626 452 A 113 CYS HB3 A 114 SER H 1.0 1.8 5.0 627 453 A 121 LEU H A 113 CYS H 1.0 1.8 5.0 628 454 A 113 CYS H A 121 LEU HBx 1.0 1.8 5.0 629 454 A 121 LEU HB3 A 113 CYS H 1.0 1.8 5.0 630 455 A 122 VAL HG2% A 113 CYS H 1.0 1.8 6.5 631 456 A 122 VAL HA A 113 CYS H 1.0 1.8 5.0 632 457 A 123 PHE H A 113 CYS H 1.0 1.8 6.0 633 458 A 114 SER HA A 115 LYS H 1.0 1.8 2.9 634 459 A 115 LYS H A 114 SER HB2 1.0 1.8 5.0 635 459 A 114 SER HB3 A 115 LYS H 1.0 1.8 5.0 636 460 A 114 SER H A 115 LYS H 1.0 1.8 6.0 637 461 A 116 ASP H A 115 LYS HDx 1.0 1.8 5.0 638 461 A 115 LYS HD3 A 116 ASP H 1.0 1.8 5.0 639 462 A 115 LYS HA A 116 ASP H 1.0 1.8 2.9 640 463 A 115 LYS H A 118 GLU H 1.0 1.8 6.0 641 464 A 116 ASP H A 116 ASP HBx 1.0 1.8 4.0 642 464 A 116 ASP HB3 A 116 ASP H 1.0 1.8 4.0 643 465 A 116 ASP H A 117 ASN H 1.0 1.8 5.0 644 466 A 116 ASP HA A 117 ASN H 1.0 1.8 2.9 645 467 A 117 ASN H A 116 ASP HBx 1.0 1.8 2.9 646 467 A 116 ASP HB3 A 117 ASN H 1.0 1.8 2.9 647 468 A 117 ASN H A 117 ASN HA 1.0 1.8 2.9 648 469 A 118 GLU H A 117 ASN H 1.0 1.8 3.5 649 470 A 117 ASN H A 118 GLU HGx 1.0 1.8 6.0 650 470 A 118 GLU HG3 A 117 ASN H 1.0 1.8 6.0 651 471 A 118 GLU H A 119 LYS H 1.0 1.8 5.0 652 472 A 119 LYS H A 118 GLU HB2 1.0 1.8 5.0 653 472 A 118 GLU HB3 A 119 LYS H 1.0 1.8 5.0 654 473 A 119 LYS H A 118 GLU HGx 1.0 1.8 5.0 655 473 A 118 GLU HG3 A 119 LYS H 1.0 1.8 5.0 656 474 A 119 LYS H A 118 GLU HA 1.0 1.8 3.5 657 475 A 119 LYS H A 119 LYS HEx 1.0 1.8 5.0 658 475 A 119 LYS HE3 A 119 LYS H 1.0 1.8 5.0 659 476 A 119 LYS HA A 120 LYS H 1.0 1.8 2.9 660 477 A 121 LEU H A 120 LYS H 1.0 1.8 6.0 661 478 A 121 LEU H A 120 LYS HA 1.0 1.8 2.9 662 479 A 122 VAL H A 121 LEU H 1.0 1.8 6.0 663 480 A 122 VAL H A 121 LEU HD1% 1.0 1.8 5.5 664 480 A 121 LEU HD2% A 122 VAL H 1.0 1.8 5.5 665 481 A 121 LEU HA A 122 VAL H 1.0 1.8 2.9 666 482 A 122 VAL H A 121 LEU HBx 1.0 1.8 5.0 667 482 A 121 LEU HB3 A 122 VAL H 1.0 1.8 5.0 668 483 A 121 LEU H A 122 VAL HG2% 1.0 1.8 6.5 669 484 A 122 VAL HA A 123 PHE H 1.0 1.8 2.9 670 485 A 122 VAL HG1% A 123 PHE H 1.0 1.8 5.5 671 486 A 122 VAL HB A 123 PHE H 1.0 1.8 6.0 672 487 A 122 VAL HG1% A 124 THR H 1.0 1.8 5.5 673 488 A 123 PHE HA A 124 THR H 1.0 1.8 2.9 674 489 A 124 THR H A 123 PHE HBx 1.0 1.8 5.0 675 489 A 124 THR H A 123 PHE HB3 1.0 1.8 5.0 676 490 A 124 THR H A 123 PHE H 1.0 1.8 6.0 677 491 A 124 THR HG2% A 125 VAL H 1.0 1.8 5.5 678 492 A 124 THR HA A 125 VAL H 1.0 1.8 3.5 679 493 A 126 GLU H A 125 VAL HG1% 1.0 1.8 5.5 680 493 A 125 VAL HG2% A 126 GLU H 1.0 1.8 5.5 681 494 A 125 VAL HA A 126 GLU H 1.0 1.8 2.9 682 495 A 126 GLU HA A 127 ALA H 1.0 1.8 2.9 683 496 A 127 ALA H A 126 GLU HBx 1.0 1.8 5.0 684 496 A 127 ALA H A 126 GLU HB3 1.0 1.8 5.0 685 497 A 127 ALA H A 126 GLU HGx 1.0 1.8 5.0 686 497 A 127 ALA H A 126 GLU HG3 1.0 1.8 5.0 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 3 VAL H A 15 ILE O 1.0 1.3 2.5 2 2 A 15 ILE O A 3 VAL N 1.0 2.3 3.5 3 3 A 17 SER H A 3 VAL O 1.0 1.3 2.5 4 4 A 3 VAL O A 17 SER N 1.0 2.3 3.5 5 5 A 4 LYS H A 47 LEU O 1.0 1.3 2.5 6 6 A 47 LEU O A 4 LYS N 1.0 2.3 3.5 7 7 A 49 GLY H A 4 LYS O 1.0 1.3 2.5 8 8 A 4 LYS O A 49 GLY N 1.0 2.3 3.5 9 9 A 51 LYS H A 6 CYS O 1.0 1.3 2.5 10 10 A 6 CYS O A 51 LYS N 1.0 2.3 3.5 11 11 A 8 PHE H A 51 LYS O 1.0 1.3 2.5 12 12 A 51 LYS O A 8 PHE N 1.0 2.3 3.5 13 13 A 36 ILE H A 120 LYS O 1.0 1.3 2.5 14 14 A 120 LYS O A 36 ILE N 1.0 2.3 3.5 15 15 A 122 VAL H A 36 ILE O 1.0 1.3 2.5 16 16 A 36 ILE O A 122 VAL N 1.0 2.3 3.5 17 17 A 38 CYS H A 122 VAL O 1.0 1.3 2.5 18 18 A 122 VAL O A 38 CYS N 1.0 2.3 3.5 19 19 A 124 THR H A 38 CYS O 1.0 1.3 2.5 20 20 A 38 CYS O A 124 THR N 1.0 2.3 3.5 21 21 A 40 VAL H A 124 THR O 1.0 1.3 2.5 22 22 A 124 THR O A 40 VAL N 1.0 2.3 3.5 23 23 A 126 GLU H A 40 VAL O 1.0 1.3 2.5 24 24 A 40 VAL O A 126 GLU N 1.0 2.3 3.5 25 25 A 42 ALA H A 126 GLU O 1.0 1.3 2.5 26 26 A 126 GLU O A 42 ALA N 1.0 2.3 3.5 27 27 A 107 TRP H A 127 ALA OXT 1.0 1.3 2.5 28 27 A 107 TRP H A 127 ALA O 1.0 1.3 2.5 29 28 A 127 ALA OXT A 107 TRP N 1.0 2.3 3.5 30 28 A 127 ALA O A 107 TRP N 1.0 2.3 3.5 31 29 A 127 ALA H A 107 TRP O 1.0 1.3 2.5 32 30 A 107 TRP O A 127 ALA N 1.0 2.3 3.5 33 31 A 109 PHE H A 125 VAL O 1.0 1.3 2.5 34 32 A 125 VAL O A 109 PHE N 1.0 2.3 3.5 35 33 A 125 VAL H A 109 PHE O 1.0 1.3 2.5 36 34 A 109 PHE O A 125 VAL N 1.0 2.3 3.5 37 35 A 111 CYS H A 123 PHE O 1.0 1.3 2.5 38 36 A 123 PHE O A 111 CYS N 1.0 2.3 3.5 39 37 A 123 PHE H A 111 CYS O 1.0 1.3 2.5 40 38 A 111 CYS O A 123 PHE N 1.0 2.3 3.5 41 39 A 113 CYS H A 121 LEU O 1.0 1.3 2.5 42 40 A 121 LEU O A 113 CYS N 1.0 2.3 3.5 43 41 A 121 LEU H A 113 CYS O 1.0 1.3 2.5 44 42 A 113 CYS O A 121 LEU N 1.0 2.3 3.5 45 43 A 112 VAL H A 59 GLU O 1.0 1.3 2.5 46 44 A 59 GLU O A 112 VAL N 1.0 2.3 3.5 47 45 A 59 GLU H A 112 VAL O 1.0 1.3 2.5 48 46 A 112 VAL O A 59 GLU N 1.0 2.3 3.5 49 47 A 114 SER H A 57 SER O 1.0 1.3 2.5 50 48 A 57 SER O A 114 SER N 1.0 2.3 3.5 51 49 A 57 SER H A 114 SER O 1.0 1.3 2.5 52 50 A 114 SER O A 57 SER N 1.0 2.3 3.5 53 51 A 48 ILE H A 97 SER O 1.0 1.3 2.5 54 52 A 97 SER O A 48 ILE N 1.0 2.3 3.5 55 53 A 97 SER H A 48 ILE O 1.0 1.3 2.5 56 54 A 48 ILE O A 97 SER N 1.0 2.3 3.5 57 55 A 50 PHE H A 95 PHE O 1.0 1.3 2.5 58 56 A 95 PHE O A 50 PHE N 1.0 2.3 3.5 59 57 A 95 PHE H A 50 PHE O 1.0 1.3 2.5 60 58 A 50 PHE O A 95 PHE N 1.0 2.3 3.5 61 59 A 87 ILE H A 96 TYR O 1.0 1.3 2.5 62 60 A 96 TYR O A 87 ILE N 1.0 2.3 3.5 63 61 A 96 TYR H A 87 ILE O 1.0 1.3 2.5 64 62 A 87 ILE O A 96 TYR N 1.0 2.3 3.5 65 63 A 89 ASP H A 94 THR O 1.0 1.3 2.5 66 64 A 94 THR O A 89 ASP N 1.0 2.3 3.5 67 65 A 94 THR H A 89 ASP O 1.0 1.3 2.5 68 66 A 89 ASP O A 94 THR N 1.0 2.3 3.5 stop_ save_ save_CNS/XPLOR_dihedral_5 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_5 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 1 GLU C A 2 LYS N A 2 LYS CA A 2 LYS C 1.0 -155.0 -65.0 PHI 2 2 A 2 LYS N A 2 LYS CA A 2 LYS C A 3 VAL N 1.0 125.0 175.0 PSI 3 3 A 2 LYS C A 3 VAL N A 3 VAL CA A 3 VAL C 1.0 -145.0 -75.0 PHI 4 4 A 3 VAL N A 3 VAL CA A 3 VAL C A 4 LYS N 1.0 90.0 170.0 PSI 5 5 A 3 VAL C A 4 LYS N A 4 LYS CA A 4 LYS C 1.0 -102.0 -22.0 PHI 6 6 A 4 LYS N A 4 LYS CA A 4 LYS C A 5 GLY N 1.0 115.0 175.0 PSI 7 7 A 5 GLY C A 6 CYS N A 6 CYS CA A 6 CYS C 1.0 -145.0 -95.0 PHI 8 8 A 6 CYS N A 6 CYS CA A 6 CYS C A 7 ASP N 1.0 130.0 170.0 PSI 9 9 A 6 CYS C A 7 ASP N A 7 ASP CA A 7 ASP C 1.0 -161.0 -71.0 PHI 10 10 A 7 ASP N A 7 ASP CA A 7 ASP C A 8 PHE N 1.0 110.0 180.0 PSI 11 11 A 7 ASP C A 8 PHE N A 8 PHE CA A 8 PHE C 1.0 -105.0 -45.0 PHI 12 12 A 8 PHE N A 8 PHE CA A 8 PHE C A 9 THR N 1.0 -50.0 10.0 PSI 13 13 A 8 PHE C A 9 THR N A 9 THR CA A 9 THR C 1.0 -145.0 -85.0 PHI 14 14 A 9 THR N A 9 THR CA A 9 THR C A 10 THR N 1.0 -25.0 15.0 PSI 15 15 A 9 THR C A 10 THR N A 10 THR CA A 10 THR C 1.0 -166.0 -66.0 PHI 16 16 A 10 THR N A 10 THR CA A 10 THR C A 11 SER N 1.0 92.0 172.0 PSI 17 17 A 10 THR C A 11 SER N A 11 SER CA A 11 SER C 1.0 -138.0 -58.0 PHI 18 18 A 11 SER C A 12 GLU N A 12 GLU CA A 12 GLU C 1.0 -115.0 -55.0 PHI 19 19 A 12 GLU N A 12 GLU CA A 12 GLU C A 13 SER N 1.0 75.0 175.0 PSI 20 20 A 12 GLU C A 13 SER N A 13 SER CA A 13 SER C 1.0 -145.0 -65.0 PHI 21 21 A 13 SER N A 13 SER CA A 13 SER C A 14 THR N 1.0 75.0 175.0 PSI 22 22 A 13 SER C A 14 THR N A 14 THR CA A 14 THR C 1.0 -100.0 -50.0 PHI 23 23 A 14 THR N A 14 THR CA A 14 THR C A 15 ILE N 1.0 -50.0 0.0 PSI 24 24 A 14 THR C A 15 ILE N A 15 ILE CA A 15 ILE C 1.0 -121.0 -81.0 PHI 25 25 A 15 ILE N A 15 ILE CA A 15 ILE C A 16 PHE N 1.0 -55.0 5.0 PSI 26 26 A 15 ILE C A 16 PHE N A 16 PHE CA A 16 PHE C 1.0 -160.0 -60.0 PHI 27 27 A 16 PHE N A 16 PHE CA A 16 PHE C A 17 SER N 1.0 130.0 170.0 PSI 28 28 A 16 PHE C A 17 SER N A 17 SER CA A 17 SER C 1.0 -110.0 -60.0 PHI 29 29 A 17 SER N A 17 SER CA A 17 SER C A 18 LYS N 1.0 -69.0 11.0 PSI 30 30 A 17 SER C A 18 LYS N A 18 LYS CA A 18 LYS C 1.0 -156.0 -76.0 PHI 31 31 A 18 LYS N A 18 LYS CA A 18 LYS C A 19 GLY N 1.0 125.0 165.0 PSI 32 32 A 18 LYS C A 19 GLY N A 19 GLY CA A 19 GLY C 1.0 -330.0 30.0 PHI 33 33 A 19 GLY N A 19 GLY CA A 19 GLY C A 20 TYR N 1.0 -35.0 325.0 PSI 34 34 A 19 GLY C A 20 TYR N A 20 TYR CA A 20 TYR C 1.0 -170.0 -100.0 PHI 35 35 A 20 TYR N A 20 TYR CA A 20 TYR C A 21 SER N 1.0 129.0 169.0 PSI 36 36 A 20 TYR C A 21 SER N A 21 SER CA A 21 SER C 1.0 -138.0 -68.0 PHI 37 37 A 21 SER N A 21 SER CA A 21 SER C A 22 ILE N 1.0 105.0 185.0 PSI 38 38 A 21 SER C A 22 ILE N A 22 ILE CA A 22 ILE C 1.0 -76.0 -36.0 PHI 39 39 A 22 ILE N A 22 ILE CA A 22 ILE C A 23 ASN N 1.0 -57.0 -17.0 PSI 40 40 A 22 ILE C A 23 ASN N A 23 ASN CA A 23 ASN C 1.0 -86.0 -46.0 PHI 41 41 A 23 ASN N A 23 ASN CA A 23 ASN C A 24 GLU N 1.0 -57.0 -17.0 PSI 42 42 A 23 ASN C A 24 GLU N A 24 GLU CA A 24 GLU C 1.0 -87.0 -47.0 PHI 43 43 A 24 GLU N A 24 GLU CA A 24 GLU C A 25 ILE N 1.0 -61.0 -21.0 PSI 44 44 A 24 GLU C A 25 ILE N A 25 ILE CA A 25 ILE C 1.0 -122.0 -52.0 PHI 45 45 A 25 ILE N A 25 ILE CA A 25 ILE C A 26 SER N 1.0 -60.0 0.0 PSI 46 46 A 25 ILE C A 26 SER N A 26 SER CA A 26 SER C 1.0 -176.0 -36.0 PHI 47 47 A 26 SER C A 27 ASN N A 27 ASN CA A 27 ASN C 1.0 -163.0 -3.0 PHI 48 48 A 27 ASN N A 27 ASN CA A 27 ASN C A 28 LYS N 1.0 -270.0 90.0 PSI 49 49 A 27 ASN C A 28 LYS N A 28 LYS CA A 28 LYS C 1.0 -157.0 -17.0 PHI 50 50 A 28 LYS N A 28 LYS CA A 28 LYS C A 29 SER N 1.0 -195.0 165.0 PSI 51 51 A 28 LYS C A 29 SER N A 29 SER CA A 29 SER C 1.0 -157.0 -37.0 PHI 52 52 A 29 SER C A 30 SER N A 30 SER CA A 30 SER C 1.0 -136.0 -16.0 PHI 53 53 A 30 SER N A 30 SER CA A 30 SER C A 31 ASN N 1.0 -207.0 153.0 PSI 54 54 A 30 SER C A 31 ASN N A 31 ASN CA A 31 ASN C 1.0 -152.0 -52.0 PHI 55 55 A 31 ASN N A 31 ASN CA A 31 ASN C A 32 ASN N 1.0 -59.0 41.0 PSI 56 56 A 31 ASN C A 32 ASN N A 32 ASN CA A 32 ASN C 1.0 -166.0 -6.0 PHI 57 57 A 32 ASN N A 32 ASN CA A 32 ASN C A 33 GLN N 1.0 -182.0 118.0 PSI 58 58 A 32 ASN C A 33 GLN N A 33 GLN CA A 33 GLN C 1.0 -136.0 -36.0 PHI 59 59 A 33 GLN C A 34 GLN N A 34 GLN CA A 34 GLN C 1.0 -166.0 -6.0 PHI 60 60 A 34 GLN C A 35 ASP N A 35 ASP CA A 35 ASP C 1.0 -170.0 30.0 PHI 61 61 A 35 ASP N A 35 ASP CA A 35 ASP C A 36 ILE N 1.0 102.0 182.0 PSI 62 62 A 35 ASP C A 36 ILE N A 36 ILE CA A 36 ILE C 1.0 -135.0 -55.0 PHI 63 63 A 36 ILE N A 36 ILE CA A 36 ILE C A 37 VAL N 1.0 66.0 146.0 PSI 64 64 A 36 ILE C A 37 VAL N A 37 VAL CA A 37 VAL C 1.0 -133.0 -83.0 PHI 65 65 A 37 VAL N A 37 VAL CA A 37 VAL C A 38 CYS N 1.0 106.0 156.0 PSI 66 66 A 37 VAL C A 38 CYS N A 38 CYS CA A 38 CYS C 1.0 -157.0 -87.0 PHI 67 67 A 38 CYS N A 38 CYS CA A 38 CYS C A 39 THR N 1.0 104.0 154.0 PSI 68 68 A 38 CYS C A 39 THR N A 39 THR CA A 39 THR C 1.0 -134.0 -94.0 PHI 69 69 A 39 THR N A 39 THR CA A 39 THR C A 40 VAL N 1.0 107.0 147.0 PSI 70 70 A 39 THR C A 40 VAL N A 40 VAL CA A 40 VAL C 1.0 -141.0 -101.0 PHI 71 71 A 40 VAL N A 40 VAL CA A 40 VAL C A 41 LYS N 1.0 119.0 159.0 PSI 72 72 A 40 VAL C A 41 LYS N A 41 LYS CA A 41 LYS C 1.0 -140.0 -80.0 PHI 73 73 A 41 LYS N A 41 LYS CA A 41 LYS C A 42 ALA N 1.0 103.0 143.0 PSI 74 74 A 41 LYS C A 42 ALA N A 42 ALA CA A 42 ALA C 1.0 -139.0 -79.0 PHI 75 75 A 42 ALA N A 42 ALA CA A 42 ALA C A 43 HIS N 1.0 106.0 166.0 PSI 76 76 A 42 ALA C A 43 HIS N A 43 HIS CA A 43 HIS C 1.0 -160.0 -80.0 PHI 77 77 A 43 HIS N A 43 HIS CA A 43 HIS C A 44 ALA N 1.0 106.0 186.0 PSI 78 78 A 43 HIS C A 44 ALA N A 44 ALA CA A 44 ALA C 1.0 -78.0 -28.0 PHI 79 79 A 44 ALA N A 44 ALA CA A 44 ALA C A 45 ASN N 1.0 -62.0 -2.0 PSI 80 80 A 44 ALA C A 45 ASN N A 45 ASN CA A 45 ASN C 1.0 -111.0 -51.0 PHI 81 81 A 45 ASN N A 45 ASN CA A 45 ASN C A 46 ASP N 1.0 -63.0 7.0 PSI 82 82 A 45 ASN C A 46 ASP N A 46 ASP CA A 46 ASP C 1.0 -130.0 -50.0 PHI 83 83 A 46 ASP N A 46 ASP CA A 46 ASP C A 47 LEU N 1.0 -180.0 180.0 PSI 84 84 A 46 ASP C A 47 LEU N A 47 LEU CA A 47 LEU C 1.0 -180.0 -20.0 PHI 85 85 A 47 LEU N A 47 LEU CA A 47 LEU C A 48 ILE N 1.0 10.0 180.0 PSI 86 86 A 47 LEU C A 48 ILE N A 48 ILE CA A 48 ILE C 1.0 -147.0 -107.0 PHI 87 87 A 48 ILE N A 48 ILE CA A 48 ILE C A 49 GLY N 1.0 132.0 192.0 PSI 88 88 A 49 GLY C A 50 PHE N A 50 PHE CA A 50 PHE C 1.0 -178.0 -118.0 PHI 89 89 A 50 PHE N A 50 PHE CA A 50 PHE C A 51 LYS N 1.0 124.0 194.0 PSI 90 90 A 50 PHE C A 51 LYS N A 51 LYS CA A 51 LYS C 1.0 -150.0 -90.0 PHI 91 91 A 51 LYS N A 51 LYS CA A 51 LYS C A 52 CYS N 1.0 107.0 167.0 PSI 92 92 A 51 LYS C A 52 CYS N A 52 CYS CA A 52 CYS C 1.0 -150.0 -80.0 PHI 93 93 A 52 CYS N A 52 CYS CA A 52 CYS C A 53 PRO N 1.0 80.0 160.0 PSI 94 94 A 52 CYS C A 53 PRO N A 53 PRO CA A 53 PRO C 1.0 -85.0 -45.0 PHI 95 95 A 53 PRO N A 53 PRO CA A 53 PRO C A 54 SER N 1.0 122.0 162.0 PSI 96 96 A 53 PRO C A 54 SER N A 54 SER CA A 54 SER C 1.0 -79.0 -39.0 PHI 97 97 A 54 SER N A 54 SER CA A 54 SER C A 55 ASN N 1.0 -48.0 -8.0 PSI 98 98 A 54 SER C A 55 ASN N A 55 ASN CA A 55 ASN C 1.0 -114.0 -74.0 PHI 99 99 A 55 ASN N A 55 ASN CA A 55 ASN C A 56 TYR N 1.0 -22.0 18.0 PSI 100 100 A 55 ASN C A 56 TYR N A 56 TYR CA A 56 TYR C 1.0 -117.0 -57.0 PHI 101 101 A 56 TYR N A 56 TYR CA A 56 TYR C A 57 SER N 1.0 100.0 180.0 PSI 102 102 A 56 TYR C A 57 SER N A 57 SER CA A 57 SER C 1.0 -143.0 -83.0 PHI 103 103 A 57 SER N A 57 SER CA A 57 SER C A 58 VAL N 1.0 110.0 170.0 PSI 104 104 A 57 SER C A 58 VAL N A 58 VAL CA A 58 VAL C 1.0 -129.0 -89.0 PHI 105 105 A 58 VAL N A 58 VAL CA A 58 VAL C A 59 GLU N 1.0 105.0 145.0 PSI 106 106 A 58 VAL C A 59 GLU N A 59 GLU CA A 59 GLU C 1.0 -143.0 -83.0 PHI 107 107 A 59 GLU N A 59 GLU CA A 59 GLU C A 60 PRO N 1.0 100.0 160.0 PSI 108 108 A 59 GLU C A 60 PRO N A 60 PRO CA A 60 PRO C 1.0 -80.0 -40.0 PHI 109 109 A 60 PRO N A 60 PRO CA A 60 PRO C A 61 HIS N 1.0 115.0 175.0 PSI 110 110 A 60 PRO C A 61 HIS N A 61 HIS CA A 61 HIS C 1.0 -93.0 -33.0 PHI 111 111 A 61 HIS N A 61 HIS CA A 61 HIS C A 62 ASP N 1.0 -52.0 8.0 PSI 112 112 A 61 HIS C A 62 ASP N A 62 ASP CA A 62 ASP C 1.0 -177.4 -17.4 PHI 113 113 A 62 ASP N A 62 ASP CA A 62 ASP C A 63 CYS N 1.0 -183.5 177.7 PSI 114 114 A 62 ASP C A 63 CYS N A 63 CYS CA A 63 CYS C 1.0 -83.0 -43.0 PHI 115 115 A 63 CYS C A 64 PHE N A 64 PHE CA A 64 PHE C 1.0 -111.0 -31.0 PHI 116 116 A 64 PHE N A 64 PHE CA A 64 PHE C A 65 VAL N 1.0 -64.0 -4.0 PSI 117 117 A 64 PHE C A 65 VAL N A 65 VAL CA A 65 VAL C 1.0 -92.0 -32.0 PHI 118 118 A 65 VAL N A 65 VAL CA A 65 VAL C A 66 SER N 1.0 -75.0 -15.0 PSI 119 119 A 65 VAL C A 66 SER N A 66 SER CA A 66 SER C 1.0 -180.0 -100.0 PHI 120 120 A 66 SER C A 67 ALA N A 67 ALA CA A 67 ALA C 1.0 -177.0 -57.0 PHI 121 121 A 67 ALA N A 67 ALA CA A 67 ALA C A 68 PHE N 1.0 101.0 181.0 PSI 122 122 A 67 ALA C A 68 PHE N A 68 PHE CA A 68 PHE C 1.0 -155.0 -95.0 PHI 123 123 A 68 PHE N A 68 PHE CA A 68 PHE C A 69 ASN N 1.0 112.0 172.0 PSI 124 124 A 68 PHE C A 69 ASN N A 69 ASN CA A 69 ASN C 1.0 -130.0 -70.0 PHI 125 125 A 69 ASN N A 69 ASN CA A 69 ASN C A 70 LEU N 1.0 110.0 190.0 PSI 126 126 A 69 ASN C A 70 LEU N A 70 LEU CA A 70 LEU C 1.0 -70.0 -30.0 PHI 127 127 A 70 LEU N A 70 LEU CA A 70 LEU C A 71 SER N 1.0 -53.0 -3.0 PSI 128 128 A 70 LEU C A 71 SER N A 71 SER CA A 71 SER C 1.0 -114.0 -74.0 PHI 129 129 A 71 SER N A 71 SER CA A 71 SER C A 72 GLY N 1.0 -32.3 17.7 PSI 130 130 A 71 SER C A 72 GLY N A 72 GLY CA A 72 GLY C 1.0 55.0 105.0 PHI 131 131 A 72 GLY N A 72 GLY CA A 72 GLY C A 73 LYS N 1.0 -13.0 47.0 PSI 132 132 A 72 GLY C A 73 LYS N A 73 LYS CA A 73 LYS C 1.0 -128.0 -68.0 PHI 133 133 A 73 LYS N A 73 LYS CA A 73 LYS C A 74 ASN N 1.0 115.0 175.0 PSI 134 134 A 73 LYS C A 74 ASN N A 74 ASN CA A 74 ASN C 1.0 -103.0 -63.0 PHI 135 135 A 74 ASN N A 74 ASN CA A 74 ASN C A 75 GLU N 1.0 109.0 149.0 PSI 136 136 A 74 ASN C A 75 GLU N A 75 GLU CA A 75 GLU C 1.0 -155.0 -85.0 PHI 137 137 A 75 GLU N A 75 GLU CA A 75 GLU C A 76 ASN N 1.0 123.0 163.0 PSI 138 138 A 75 GLU C A 76 ASN N A 76 ASN CA A 76 ASN C 1.0 -107.0 -57.0 PHI 139 139 A 76 ASN N A 76 ASN CA A 76 ASN C A 77 LEU N 1.0 96.0 156.0 PSI 140 140 A 76 ASN C A 77 LEU N A 77 LEU CA A 77 LEU C 1.0 -97.0 -37.0 PHI 141 141 A 77 LEU N A 77 LEU CA A 77 LEU C A 78 GLU N 1.0 -55.0 5.0 PSI 142 142 A 77 LEU C A 78 GLU N A 78 GLU CA A 78 GLU C 1.0 -93.0 -53.0 PHI 143 143 A 78 GLU N A 78 GLU CA A 78 GLU C A 79 ASN N 1.0 -53.0 -3.0 PSI 144 144 A 78 GLU C A 79 ASN N A 79 ASN CA A 79 ASN C 1.0 -91.0 -51.0 PHI 145 145 A 79 ASN N A 79 ASN CA A 79 ASN C A 80 LYS N 1.0 -56.0 14.0 PSI 146 146 A 79 ASN C A 80 LYS N A 80 LYS CA A 80 LYS C 1.0 -120.0 -60.0 PHI 147 147 A 80 LYS N A 80 LYS CA A 80 LYS C A 81 LEU N 1.0 -60.0 0.0 PSI 148 148 A 80 LYS C A 81 LEU N A 81 LEU CA A 81 LEU C 1.0 -172.0 -62.0 PHI 149 149 A 81 LEU N A 81 LEU CA A 81 LEU C A 82 LYS N 1.0 122.0 182.0 PSI 150 150 A 81 LEU C A 82 LYS N A 82 LYS CA A 82 LYS C 1.0 -144.0 -4.0 PHI 151 151 A 82 LYS N A 82 LYS CA A 82 LYS C A 83 LEU N 1.0 85.0 165.0 PSI 152 152 A 82 LYS C A 83 LEU N A 83 LEU CA A 83 LEU C 1.0 -130.0 -50.0 PHI 153 153 A 83 LEU N A 83 LEU CA A 83 LEU C A 84 THR N 1.0 120.0 180.0 PSI 154 154 A 83 LEU C A 84 THR N A 84 THR CA A 84 THR C 1.0 -160.0 -90.0 PHI 155 155 A 84 THR N A 84 THR CA A 84 THR C A 85 ASN N 1.0 135.0 185.0 PSI 156 156 A 84 THR C A 85 ASN N A 85 ASN CA A 85 ASN C 1.0 15.0 85.0 PHI 157 157 A 85 ASN N A 85 ASN CA A 85 ASN C A 86 ILE N 1.0 15.0 65.0 PSI 158 158 A 85 ASN C A 86 ILE N A 86 ILE CA A 86 ILE C 1.0 -108.0 -58.0 PHI 159 159 A 86 ILE N A 86 ILE CA A 86 ILE C A 87 ILE N 1.0 108.0 148.0 PSI 160 160 A 86 ILE C A 87 ILE N A 87 ILE CA A 87 ILE C 1.0 -138.0 -98.0 PHI 161 161 A 87 ILE N A 87 ILE CA A 87 ILE C A 88 MET N 1.0 104.0 164.0 PSI 162 162 A 87 ILE C A 88 MET N A 88 MET CA A 88 MET C 1.0 -161.0 -81.0 PHI 163 163 A 88 MET N A 88 MET CA A 88 MET C A 89 ASP N 1.0 98.0 168.0 PSI 164 164 A 88 MET C A 89 ASP N A 89 ASP CA A 89 ASP C 1.0 -135.0 -65.0 PHI 165 165 A 89 ASP N A 89 ASP CA A 89 ASP C A 90 HIS N 1.0 78.0 168.0 PSI 166 166 A 89 ASP C A 90 HIS N A 90 HIS CA A 90 HIS C 1.0 -80.0 -40.0 PHI 167 167 A 90 HIS N A 90 HIS CA A 90 HIS C A 91 TYR N 1.0 -52.0 -12.0 PSI 168 168 A 90 HIS C A 91 TYR N A 91 TYR CA A 91 TYR C 1.0 -89.0 -49.0 PHI 169 169 A 91 TYR N A 91 TYR CA A 91 TYR C A 92 ASN N 1.0 -51.0 -11.0 PSI 170 170 A 91 TYR C A 92 ASN N A 92 ASN CA A 92 ASN C 1.0 -127.0 -67.0 PHI 171 171 A 92 ASN N A 92 ASN CA A 92 ASN C A 93 ASN N 1.0 -36.7 33.3 PSI 172 172 A 92 ASN C A 93 ASN N A 93 ASN CA A 93 ASN C 1.0 30.0 90.0 PHI 173 173 A 93 ASN N A 93 ASN CA A 93 ASN C A 94 THR N 1.0 10.7 80.7 PSI 174 174 A 93 ASN C A 94 THR N A 94 THR CA A 94 THR C 1.0 -160.0 -110.0 PHI 175 175 A 94 THR N A 94 THR CA A 94 THR C A 95 PHE N 1.0 109.0 169.0 PSI 176 176 A 94 THR C A 95 PHE N A 95 PHE CA A 95 PHE C 1.0 -130.0 -90.0 PHI 177 177 A 95 PHE N A 95 PHE CA A 95 PHE C A 96 TYR N 1.0 133.0 173.0 PSI 178 178 A 95 PHE C A 96 TYR N A 96 TYR CA A 96 TYR C 1.0 -162.0 -82.0 PHI 179 179 A 96 TYR N A 96 TYR CA A 96 TYR C A 97 SER N 1.0 147.0 187.0 PSI 180 180 A 96 TYR C A 97 SER N A 97 SER CA A 97 SER C 1.0 -165.0 -65.0 PHI 181 181 A 97 SER N A 97 SER CA A 97 SER C A 98 ARG N 1.0 136.0 176.0 PSI 182 182 A 97 SER C A 98 ARG N A 98 ARG CA A 98 ARG C 1.0 -158.0 -98.0 PHI 183 183 A 98 ARG N A 98 ARG CA A 98 ARG C A 99 LEU N 1.0 105.0 165.0 PSI 184 184 A 98 ARG C A 99 LEU N A 99 LEU CA A 99 LEU C 1.0 -150.0 -70.0 PHI 185 185 A 99 LEU N A 99 LEU CA A 99 LEU C A 100 PRO N 1.0 115.0 165.0 PSI 186 186 A 99 LEU C A 100 PRO N A 100 PRO CA A 100 PRO C 1.0 -95.0 -35.0 PHI 187 187 A 100 PRO N A 100 PRO CA A 100 PRO C A 101 SER N 1.0 80.9 210.9 PSI 188 188 A 100 PRO C A 101 SER N A 101 SER CA A 101 SER C 1.0 -115.0 -55.0 PHI 189 189 A 101 SER N A 101 SER CA A 101 SER C A 102 LEU N 1.0 -45.0 -5.0 PSI 190 190 A 101 SER C A 102 LEU N A 102 LEU CA A 102 LEU C 1.0 -186.0 -86.0 PHI 191 191 A 102 LEU N A 102 LEU CA A 102 LEU C A 103 ILE N 1.0 73.0 173.0 PSI 192 192 A 102 LEU C A 103 ILE N A 103 ILE CA A 103 ILE C 1.0 -156.0 -76.0 PHI 193 193 A 103 ILE N A 103 ILE CA A 103 ILE C A 104 SER N 1.0 103.0 163.0 PSI 194 194 A 104 SER C A 105 ASP N A 105 ASP CA A 105 ASP C 1.0 -145.0 -65.0 PHI 195 195 A 105 ASP N A 105 ASP CA A 105 ASP C A 106 ASN N 1.0 110.0 190.0 PSI 196 196 A 103 ILE C A 104 SER N A 104 SER CA A 104 SER C 1.0 -195.0 -15.0 PHI 197 197 A 105 ASP C A 106 ASN N A 106 ASN CA A 106 ASN C 1.0 -126.0 -66.0 PHI 198 198 A 106 ASN N A 106 ASN CA A 106 ASN C A 107 TRP N 1.0 -49.0 31.0 PSI 199 199 A 106 ASN C A 107 TRP N A 107 TRP CA A 107 TRP C 1.0 -177.0 -67.0 PHI 200 200 A 107 TRP N A 107 TRP CA A 107 TRP C A 108 LYS N 1.0 132.0 182.0 PSI 201 201 A 107 TRP C A 108 LYS N A 108 LYS CA A 108 LYS C 1.0 -157.0 -97.0 PHI 202 202 A 108 LYS N A 108 LYS CA A 108 LYS C A 109 PHE N 1.0 120.0 180.0 PSI 203 203 A 108 LYS C A 109 PHE N A 109 PHE CA A 109 PHE C 1.0 -165.0 -105.0 PHI 204 204 A 109 PHE N A 109 PHE CA A 109 PHE C A 110 PHE N 1.0 121.0 181.0 PSI 205 205 A 109 PHE C A 110 PHE N A 110 PHE CA A 110 PHE C 1.0 -155.0 -95.0 PHI 206 206 A 110 PHE N A 110 PHE CA A 110 PHE C A 111 CYS N 1.0 113.0 173.0 PSI 207 207 A 110 PHE C A 111 CYS N A 111 CYS CA A 111 CYS C 1.0 -162.6 -101.8 PHI 208 208 A 111 CYS N A 111 CYS CA A 111 CYS C A 112 VAL N 1.0 127.9 167.9 PSI 209 209 A 111 CYS C A 112 VAL N A 112 VAL CA A 112 VAL C 1.0 -153.0 -113.0 PHI 210 210 A 112 VAL N A 112 VAL CA A 112 VAL C A 113 CYS N 1.0 117.0 177.0 PSI 211 211 A 112 VAL C A 113 CYS N A 113 CYS CA A 113 CYS C 1.0 -143.0 -93.0 PHI 212 212 A 113 CYS N A 113 CYS CA A 113 CYS C A 114 SER N 1.0 106.0 166.0 PSI 213 213 A 113 CYS C A 114 SER N A 114 SER CA A 114 SER C 1.0 -173.0 -93.0 PHI 214 214 A 114 SER N A 114 SER CA A 114 SER C A 115 LYS N 1.0 118.0 178.0 PSI 215 215 A 114 SER C A 115 LYS N A 115 LYS CA A 115 LYS C 1.0 -171.0 -71.0 PHI 216 216 A 115 LYS N A 115 LYS CA A 115 LYS C A 116 ASP N 1.0 87.0 167.0 PSI 217 217 A 116 ASP C A 117 ASN N A 117 ASN CA A 117 ASN C 1.0 32.0 92.0 PHI 218 218 A 117 ASN N A 117 ASN CA A 117 ASN C A 118 GLU N 1.0 30.0 90.0 PSI 219 219 A 117 ASN C A 118 GLU N A 118 GLU CA A 118 GLU C 1.0 -190.0 -70.0 PHI 220 220 A 118 GLU N A 118 GLU CA A 118 GLU C A 119 LYS N 1.0 110.0 170.0 PSI 221 221 A 118 GLU C A 119 LYS N A 119 LYS CA A 119 LYS C 1.0 -145.0 -55.0 PHI 222 222 A 119 LYS N A 119 LYS CA A 119 LYS C A 120 LYS N 1.0 109.0 169.0 PSI 223 223 A 119 LYS C A 120 LYS N A 120 LYS CA A 120 LYS C 1.0 -127.5 -7.5 PHI 224 224 A 120 LYS N A 120 LYS CA A 120 LYS C A 121 LEU N 1.0 90.7 210.7 PSI 225 225 A 120 LYS C A 121 LEU N A 121 LEU CA A 121 LEU C 1.0 -142.0 -82.0 PHI 226 226 A 121 LEU N A 121 LEU CA A 121 LEU C A 122 VAL N 1.0 84.0 154.0 PSI 227 227 A 121 LEU C A 122 VAL N A 122 VAL CA A 122 VAL C 1.0 -137.0 -77.0 PHI 228 228 A 122 VAL N A 122 VAL CA A 122 VAL C A 123 PHE N 1.0 109.0 149.0 PSI 229 229 A 122 VAL C A 123 PHE N A 123 PHE CA A 123 PHE C 1.0 -137.0 -77.0 PHI 230 230 A 123 PHE N A 123 PHE CA A 123 PHE C A 124 THR N 1.0 100.0 150.0 PSI 231 231 A 123 PHE C A 124 THR N A 124 THR CA A 124 THR C 1.0 -136.0 -96.0 PHI 232 232 A 124 THR N A 124 THR CA A 124 THR C A 125 VAL N 1.0 105.0 145.0 PSI 233 233 A 124 THR C A 125 VAL N A 125 VAL CA A 125 VAL C 1.0 -141.0 -81.0 PHI 234 234 A 125 VAL N A 125 VAL CA A 125 VAL C A 126 GLU N 1.0 102.0 162.0 PSI 235 235 A 125 VAL C A 126 GLU N A 126 GLU CA A 126 GLU C 1.0 -164.0 -94.0 PHI 236 236 A 126 GLU N A 126 GLU CA A 126 GLU C A 127 ALA N 1.0 105.0 165.0 PSI 237 237 A 2 LYS N A 2 LYS CA A 2 LYS CB A 2 LYS CG 1.0 -80.0 -40.0 CHI1 238 238 A 1 GLU CB A 1 GLU CG A 1 GLU CD A 1 GLU OE1 1.0 -60.0 60.0 CHI3 239 239 A 3 VAL N A 3 VAL CA A 3 VAL CB A 3 VAL CG1 1.0 160.0 200.0 CHI1 240 240 A 4 LYS N A 4 LYS CA A 4 LYS CB A 4 LYS CG 1.0 -80.0 -40.0 CHI1 241 241 A 6 CYS N A 6 CYS CA A 6 CYS CB A 6 CYS SG 1.0 160.0 200.0 CHI1 242 242 A 7 ASP N A 7 ASP CA A 7 ASP CB A 7 ASP CG 1.0 160.0 200.0 CHI1 243 243 A 7 ASP CA A 7 ASP CB A 7 ASP CG A 7 ASP OD1 1.0 -60.0 60.0 CHI2 244 244 A 8 PHE N A 8 PHE CA A 8 PHE CB A 8 PHE CG 1.0 -80.0 -40.0 CHI1 245 245 A 8 PHE CA A 8 PHE CB A 8 PHE CG A 8 PHE CD1 1.0 70.0 110.0 CHI2 246 246 A 9 THR N A 9 THR CA A 9 THR CB A 9 THR OG1 1.0 -80.0 -40.0 CHI1 247 247 A 10 THR N A 10 THR CA A 10 THR CB A 10 THR OG1 1.0 -80.0 -40.0 CHI1 248 248 A 12 GLU N A 12 GLU CA A 12 GLU CB A 12 GLU CG 1.0 -80.0 -40.0 CHI1 249 249 A 12 GLU CB A 12 GLU CG A 12 GLU CD A 12 GLU OE1 1.0 -60.0 60.0 CHI3 250 250 A 14 THR N A 14 THR CA A 14 THR CB A 14 THR OG1 1.0 -200.0 -160.0 CHI1 251 251 A 15 ILE N A 15 ILE CA A 15 ILE CB A 15 ILE CG1 1.0 40.0 80.0 CHI1 252 252 A 15 ILE CA A 15 ILE CB A 15 ILE CG1 A 15 ILE CD1 1.0 160.0 200.0 CHI2 253 253 A 16 PHE N A 16 PHE CA A 16 PHE CB A 16 PHE CG 1.0 -80.0 -40.0 CHI1 254 254 A 16 PHE CA A 16 PHE CB A 16 PHE CG A 16 PHE CD1 1.0 70.0 110.0 CHI2 255 255 A 20 TYR N A 20 TYR CA A 20 TYR CB A 20 TYR CG 1.0 -80.0 -40.0 CHI1 256 256 A 20 TYR CA A 20 TYR CB A 20 TYR CG A 20 TYR CD1 1.0 70.0 110.0 CHI2 257 257 A 21 SER N A 21 SER CA A 21 SER CB A 21 SER OG 1.0 160.0 200.0 CHI1 258 258 A 22 ILE N A 22 ILE CA A 22 ILE CB A 22 ILE CG1 1.0 40.0 80.0 CHI1 259 259 A 22 ILE CA A 22 ILE CB A 22 ILE CG1 A 22 ILE CD1 1.0 160.0 200.0 CHI2 260 260 A 23 ASN N A 23 ASN CA A 23 ASN CB A 23 ASN CG 1.0 160.0 200.0 CHI1 261 261 A 23 ASN CA A 23 ASN CB A 23 ASN CG A 23 ASN OD1 1.0 -60.0 60.0 CHI2 262 262 A 24 GLU N A 24 GLU CA A 24 GLU CB A 24 GLU CG 1.0 -80.0 -40.0 CHI1 263 263 A 24 GLU CB A 24 GLU CG A 24 GLU CD A 24 GLU OE1 1.0 -60.0 60.0 CHI3 264 264 A 25 ILE N A 25 ILE CA A 25 ILE CB A 25 ILE CG1 1.0 40.0 80.0 CHI1 265 265 A 25 ILE CA A 25 ILE CB A 25 ILE CG1 A 25 ILE CD1 1.0 160.0 200.0 CHI2 266 266 A 27 ASN CA A 27 ASN CB A 27 ASN CG A 27 ASN OD1 1.0 -60.0 60.0 CHI2 267 267 A 28 LYS N A 28 LYS CA A 28 LYS CB A 28 LYS CG 1.0 -120.0 240.0 CHI1 268 268 A 31 ASN CA A 31 ASN CB A 31 ASN CG A 31 ASN OD1 1.0 -60.0 60.0 CHI2 269 269 A 32 ASN CA A 32 ASN CB A 32 ASN CG A 32 ASN OD1 1.0 -60.0 60.0 CHI2 270 270 A 33 GLN N A 33 GLN CA A 33 GLN CB A 33 GLN CG 1.0 40.0 80.0 CHI1 271 271 A 34 GLN N A 34 GLN CA A 34 GLN CB A 34 GLN CG 1.0 40.0 80.0 CHI1 272 272 A 35 ASP N A 35 ASP CA A 35 ASP CB A 35 ASP CG 1.0 -80.0 -40.0 CHI1 273 273 A 35 ASP CA A 35 ASP CB A 35 ASP CG A 35 ASP OD1 1.0 -60.0 60.0 CHI2 274 274 A 36 ILE N A 36 ILE CA A 36 ILE CB A 36 ILE CG1 1.0 -80.0 -40.0 CHI1 275 275 A 36 ILE CA A 36 ILE CB A 36 ILE CG1 A 36 ILE CD1 1.0 -80.0 -40.0 CHI2 276 276 A 37 VAL N A 37 VAL CA A 37 VAL CB A 37 VAL CG1 1.0 160.0 200.0 CHI1 277 277 A 38 CYS N A 38 CYS CA A 38 CYS CB A 38 CYS SG 1.0 -80.0 -40.0 CHI1 278 278 A 39 THR N A 39 THR CA A 39 THR CB A 39 THR OG1 1.0 -80.0 -40.0 CHI1 279 279 A 40 VAL N A 40 VAL CA A 40 VAL CB A 40 VAL CG1 1.0 -80.0 -40.0 CHI1 280 280 A 43 HIS N A 43 HIS CA A 43 HIS CB A 43 HIS CG 1.0 160.0 200.0 CHI1 281 281 A 45 ASN CA A 45 ASN CB A 45 ASN CG A 45 ASN OD1 1.0 -60.0 60.0 CHI2 282 282 A 46 ASP N A 46 ASP CA A 46 ASP CB A 46 ASP CG 1.0 -80.0 -40.0 CHI1 283 283 A 46 ASP CA A 46 ASP CB A 46 ASP CG A 46 ASP OD1 1.0 -60.0 60.0 CHI2 284 284 A 47 LEU N A 47 LEU CA A 47 LEU CB A 47 LEU CG 1.0 -80.0 -40.0 CHI1 285 285 A 47 LEU CA A 47 LEU CB A 47 LEU CG A 47 LEU CD1 1.0 160.0 200.0 CHI2 286 286 A 48 ILE N A 48 ILE CA A 48 ILE CB A 48 ILE CG1 1.0 40.0 80.0 CHI1 287 287 A 48 ILE CA A 48 ILE CB A 48 ILE CG1 A 48 ILE CD1 1.0 160.0 200.0 CHI2 288 288 A 50 PHE N A 50 PHE CA A 50 PHE CB A 50 PHE CG 1.0 40.0 80.0 CHI1 289 289 A 50 PHE CA A 50 PHE CB A 50 PHE CG A 50 PHE CD1 1.0 70.0 110.0 CHI2 290 290 A 52 CYS N A 52 CYS CA A 52 CYS CB A 52 CYS SG 1.0 -80.0 -40.0 CHI1 291 291 A 55 ASN N A 55 ASN CA A 55 ASN CB A 55 ASN CG 1.0 -80.0 -40.0 CHI1 292 292 A 55 ASN CA A 55 ASN CB A 55 ASN CG A 55 ASN OD1 1.0 -60.0 60.0 CHI2 293 293 A 56 TYR N A 56 TYR CA A 56 TYR CB A 56 TYR CG 1.0 -80.0 -40.0 CHI1 294 294 A 56 TYR CA A 56 TYR CB A 56 TYR CG A 56 TYR CD1 1.0 70.0 110.0 CHI2 295 295 A 58 VAL N A 58 VAL CA A 58 VAL CB A 58 VAL CG1 1.0 -80.0 -40.0 CHI1 296 296 A 59 GLU N A 59 GLU CA A 59 GLU CB A 59 GLU CG 1.0 -80.0 -40.0 CHI1 297 297 A 59 GLU CB A 59 GLU CG A 59 GLU CD A 59 GLU OE1 1.0 -60.0 60.0 CHI3 298 298 A 61 HIS N A 61 HIS CA A 61 HIS CB A 61 HIS CG 1.0 160.0 200.0 CHI1 299 299 A 62 ASP N A 62 ASP CA A 62 ASP CB A 62 ASP CG 1.0 160.0 200.0 CHI1 300 300 A 62 ASP CA A 62 ASP CB A 62 ASP CG A 62 ASP OD1 1.0 -60.0 60.0 CHI2 301 301 A 63 CYS N A 63 CYS CA A 63 CYS CB A 63 CYS SG 1.0 -80.0 -40.0 CHI1 302 302 A 64 PHE N A 64 PHE CA A 64 PHE CB A 64 PHE CG 1.0 40.0 80.0 CHI1 303 303 A 64 PHE CA A 64 PHE CB A 64 PHE CG A 64 PHE CD1 1.0 70.0 110.0 CHI2 304 304 A 65 VAL N A 65 VAL CA A 65 VAL CB A 65 VAL CG1 1.0 160.0 200.0 CHI1 305 305 A 66 SER N A 66 SER CA A 66 SER CB A 66 SER OG 1.0 160.0 200.0 CHI1 306 306 A 68 PHE N A 68 PHE CA A 68 PHE CB A 68 PHE CG 1.0 -80.0 -40.0 CHI1 307 307 A 68 PHE CA A 68 PHE CB A 68 PHE CG A 68 PHE CD1 1.0 70.0 110.0 CHI2 308 308 A 69 ASN N A 69 ASN CA A 69 ASN CB A 69 ASN CG 1.0 -80.0 -40.0 CHI1 309 309 A 69 ASN CA A 69 ASN CB A 69 ASN CG A 69 ASN OD1 1.0 -60.0 60.0 CHI2 310 310 A 73 LYS N A 73 LYS CA A 73 LYS CB A 73 LYS CG 1.0 -80.0 -40.0 CHI1 311 311 A 74 ASN N A 74 ASN CA A 74 ASN CB A 74 ASN CG 1.0 160.0 200.0 CHI1 312 312 A 74 ASN CA A 74 ASN CB A 74 ASN CG A 74 ASN OD1 1.0 -60.0 60.0 CHI2 313 313 A 75 GLU CB A 75 GLU CG A 75 GLU CD A 75 GLU OE1 1.0 -60.0 60.0 CHI3 314 314 A 76 ASN CA A 76 ASN CB A 76 ASN CG A 76 ASN OD1 1.0 -60.0 60.0 CHI2 315 315 A 77 LEU N A 77 LEU CA A 77 LEU CB A 77 LEU CG 1.0 160.0 200.0 CHI1 316 316 A 77 LEU CA A 77 LEU CB A 77 LEU CG A 77 LEU CD1 1.0 40.0 80.0 CHI2 317 317 A 78 GLU N A 78 GLU CA A 78 GLU CB A 78 GLU CG 1.0 40.0 80.0 CHI1 318 318 A 78 GLU CB A 78 GLU CG A 78 GLU CD A 78 GLU OE1 1.0 -60.0 60.0 CHI3 319 319 A 79 ASN CA A 79 ASN CB A 79 ASN CG A 79 ASN OD1 1.0 -60.0 60.0 CHI2 320 320 A 81 LEU N A 81 LEU CA A 81 LEU CB A 81 LEU CG 1.0 160.0 200.0 CHI1 321 321 A 81 LEU CA A 81 LEU CB A 81 LEU CG A 81 LEU CD1 1.0 40.0 80.0 CHI2 322 322 A 83 LEU N A 83 LEU CA A 83 LEU CB A 83 LEU CG 1.0 -80.0 -40.0 CHI1 323 323 A 83 LEU CA A 83 LEU CB A 83 LEU CG A 83 LEU CD1 1.0 160.0 200.0 CHI2 324 324 A 84 THR N A 84 THR CA A 84 THR CB A 84 THR OG1 1.0 40.0 80.0 CHI1 325 325 A 85 ASN N A 85 ASN CA A 85 ASN CB A 85 ASN CG 1.0 -80.0 -40.0 CHI1 326 326 A 85 ASN CA A 85 ASN CB A 85 ASN CG A 85 ASN OD1 1.0 -60.0 60.0 CHI2 327 327 A 86 ILE N A 86 ILE CA A 86 ILE CB A 86 ILE CG1 1.0 -80.0 -40.0 CHI1 328 328 A 86 ILE CA A 86 ILE CB A 86 ILE CG1 A 86 ILE CD1 1.0 160.0 200.0 CHI2 329 329 A 87 ILE N A 87 ILE CA A 87 ILE CB A 87 ILE CG1 1.0 -80.0 -40.0 CHI1 330 330 A 87 ILE CA A 87 ILE CB A 87 ILE CG1 A 87 ILE CD1 1.0 -80.0 -40.0 CHI2 331 331 A 88 MET N A 88 MET CA A 88 MET CB A 88 MET CG 1.0 -80.0 -40.0 CHI1 332 332 A 88 MET CA A 88 MET CB A 88 MET CG A 88 MET SD 1.0 160.0 200.0 CHI2 333 333 A 89 ASP CA A 89 ASP CB A 89 ASP CG A 89 ASP OD1 1.0 -60.0 60.0 CHI2 334 334 A 90 HIS N A 90 HIS CA A 90 HIS CB A 90 HIS CG 1.0 -80.0 -40.0 CHI1 335 335 A 91 TYR N A 91 TYR CA A 91 TYR CB A 91 TYR CG 1.0 160.0 200.0 CHI1 336 336 A 91 TYR CA A 91 TYR CB A 91 TYR CG A 91 TYR CD1 1.0 70.0 110.0 CHI2 337 337 A 92 ASN N A 92 ASN CA A 92 ASN CB A 92 ASN CG 1.0 -80.0 -40.0 CHI1 338 338 A 92 ASN CA A 92 ASN CB A 92 ASN CG A 92 ASN OD1 1.0 -60.0 60.0 CHI2 339 339 A 93 ASN N A 93 ASN CA A 93 ASN CB A 93 ASN CG 1.0 -80.0 -40.0 CHI1 340 340 A 93 ASN CA A 93 ASN CB A 93 ASN CG A 93 ASN OD1 1.0 -60.0 60.0 CHI2 341 341 A 94 THR N A 94 THR CA A 94 THR CB A 94 THR OG1 1.0 160.0 200.0 CHI1 342 342 A 95 PHE N A 95 PHE CA A 95 PHE CB A 95 PHE CG 1.0 -80.0 -40.0 CHI1 343 343 A 95 PHE CA A 95 PHE CB A 95 PHE CG A 95 PHE CD1 1.0 70.0 110.0 CHI2 344 344 A 96 TYR N A 96 TYR CA A 96 TYR CB A 96 TYR CG 1.0 -80.0 -40.0 CHI1 345 345 A 96 TYR CA A 96 TYR CB A 96 TYR CG A 96 TYR CD1 1.0 70.0 110.0 CHI2 346 346 A 98 ARG N A 98 ARG CA A 98 ARG CB A 98 ARG CG 1.0 -80.0 -40.0 CHI1 347 347 A 99 LEU N A 99 LEU CA A 99 LEU CB A 99 LEU CG 1.0 -80.0 -40.0 CHI1 348 348 A 99 LEU CA A 99 LEU CB A 99 LEU CG A 99 LEU CD1 1.0 160.0 200.0 CHI2 349 349 A 102 LEU N A 102 LEU CA A 102 LEU CB A 102 LEU CG 1.0 160.0 200.0 CHI1 350 350 A 102 LEU CA A 102 LEU CB A 102 LEU CG A 102 LEU CD1 1.0 40.0 80.0 CHI2 351 351 A 103 ILE N A 103 ILE CA A 103 ILE CB A 103 ILE CG1 1.0 -80.0 -40.0 CHI1 352 352 A 103 ILE CA A 103 ILE CB A 103 ILE CG1 A 103 ILE CD1 1.0 160.0 200.0 CHI2 353 353 A 105 ASP CA A 105 ASP CB A 105 ASP CG A 105 ASP OD1 1.0 -60.0 60.0 CHI2 354 354 A 106 ASN N A 106 ASN CA A 106 ASN CB A 106 ASN CG 1.0 -80.0 -40.0 CHI1 355 355 A 106 ASN CA A 106 ASN CB A 106 ASN CG A 106 ASN OD1 1.0 -60.0 60.0 CHI2 356 356 A 107 TRP N A 107 TRP CA A 107 TRP CB A 107 TRP CG 1.0 40.0 80.0 CHI1 357 357 A 109 PHE N A 109 PHE CA A 109 PHE CB A 109 PHE CG 1.0 40.0 80.0 CHI1 358 358 A 109 PHE CA A 109 PHE CB A 109 PHE CG A 109 PHE CD1 1.0 70.0 110.0 CHI2 359 359 A 110 PHE N A 110 PHE CA A 110 PHE CB A 110 PHE CG 1.0 40.0 80.0 CHI1 360 360 A 110 PHE CA A 110 PHE CB A 110 PHE CG A 110 PHE CD1 1.0 70.0 110.0 CHI2 361 361 A 111 CYS N A 111 CYS CA A 111 CYS CB A 111 CYS SG 1.0 -80.0 -40.0 CHI1 362 362 A 112 VAL N A 112 VAL CA A 112 VAL CB A 112 VAL CG1 1.0 160.0 200.0 CHI1 363 363 A 113 CYS N A 113 CYS CA A 113 CYS CB A 113 CYS SG 1.0 -80.0 -40.0 CHI1 364 364 A 114 SER N A 114 SER CA A 114 SER CB A 114 SER OG 1.0 40.0 80.0 CHI1 365 365 A 115 LYS N A 115 LYS CA A 115 LYS CB A 115 LYS CG 1.0 -80.0 -40.0 CHI1 366 366 A 116 ASP CA A 116 ASP CB A 116 ASP CG A 116 ASP OD1 1.0 -60.0 60.0 CHI2 367 367 A 117 ASN CA A 117 ASN CB A 117 ASN CG A 117 ASN OD1 1.0 -60.0 60.0 CHI2 368 368 A 117 ASN N A 117 ASN CA A 117 ASN CB A 117 ASN CG 1.0 160.0 200.0 CHI1 369 369 A 118 GLU N A 118 GLU CA A 118 GLU CB A 118 GLU CG 1.0 -80.0 -40.0 CHI1 370 370 A 118 GLU CB A 118 GLU CG A 118 GLU CD A 118 GLU OE1 1.0 -60.0 60.0 CHI3 371 371 A 119 LYS N A 119 LYS CA A 119 LYS CB A 119 LYS CG 1.0 -80.0 -40.0 CHI1 372 372 A 120 LYS N A 120 LYS CA A 120 LYS CB A 120 LYS CG 1.0 40.0 80.0 CHI1 373 373 A 121 LEU N A 121 LEU CA A 121 LEU CB A 121 LEU CG 1.0 -80.0 -40.0 CHI1 374 374 A 121 LEU CA A 121 LEU CB A 121 LEU CG A 121 LEU CD1 1.0 160.0 200.0 CHI2 375 375 A 122 VAL N A 122 VAL CA A 122 VAL CB A 122 VAL CG1 1.0 160.0 200.0 CHI1 376 376 A 123 PHE N A 123 PHE CA A 123 PHE CB A 123 PHE CG 1.0 160.0 200.0 CHI1 377 377 A 123 PHE CA A 123 PHE CB A 123 PHE CG A 123 PHE CD1 1.0 70.0 110.0 CHI2 378 378 A 124 THR N A 124 THR CA A 124 THR CB A 124 THR OG1 1.0 160.0 200.0 CHI1 379 379 A 125 VAL N A 125 VAL CA A 125 VAL CB A 125 VAL CG1 1.0 -80.0 -40.0 CHI1 380 380 A 126 GLU CB A 126 GLU CG A 126 GLU CD A 126 GLU OE1 1.0 -60.0 60.0 CHI3 stop_ save_