data_nef_c17900_2lio save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 LYS middle . . 3 A 3 LYS middle . . 4 A 4 GLU middle . . 5 A 5 LYS middle . . 6 A 6 ILE middle . . 7 A 7 HIS middle . . 8 A 8 LEU middle . . 9 A 9 GLU middle . . 10 A 10 TYR middle . . 11 A 11 LEU middle . . 12 A 12 LEU middle . . 13 A 13 ASN middle . . 14 A 14 ALA middle . . 15 A 15 THR middle . . 16 A 16 SER middle . . 17 A 17 LYS middle . . 18 A 18 ASN middle . . 19 A 19 ILE middle . . 20 A 20 LEU middle . . 21 A 21 TRP middle . . 22 A 22 SER middle . . 23 A 23 ALA middle . . 24 A 24 ILE middle . . 25 A 25 SER middle . . 26 A 26 THR middle . . 27 A 27 PRO middle . false 28 A 28 THR middle . . 29 A 29 GLY middle . false 30 A 30 LEU middle . . 31 A 31 GLU middle . . 32 A 32 ASP middle . . 33 A 33 TRP middle . . 34 A 34 PHE middle . . 35 A 35 ALA middle . . 36 A 36 ASP middle . . 37 A 37 LYS middle . . 38 A 38 VAL middle . . 39 A 39 VAL middle . . 40 A 40 SER middle . . 41 A 41 ASP middle . . 42 A 42 ASP middle . . 43 A 43 LYS middle . . 44 A 44 THR middle . . 45 A 45 VAL middle . . 46 A 46 THR middle . . 47 A 47 PHE middle . . 48 A 48 CYS middle . . 49 A 49 TRP middle . . 50 A 50 GLY middle . false 51 A 51 LYS middle . . 52 A 52 THR middle . . 53 A 53 GLU middle . . 54 A 54 GLN middle . . 55 A 55 ARG middle . . 56 A 56 GLN middle . . 57 A 57 ALA middle . . 58 A 58 GLY middle . false 59 A 59 ILE middle . . 60 A 60 VAL middle . . 61 A 61 ALA middle . . 62 A 62 ILE middle . . 63 A 63 ARG middle . . 64 A 64 ALA middle . . 65 A 65 TYR middle . . 66 A 66 SER middle . . 67 A 67 PHE middle . . 68 A 68 ILE middle . . 69 A 69 ARG middle . . 70 A 70 PHE middle . . 71 A 71 HIS middle . . 72 A 72 TRP middle . . 73 A 73 LEU middle . . 74 A 74 ASP middle . . 75 A 75 ASP middle . . 76 A 76 GLU middle . . 77 A 77 ASN middle . . 78 A 78 GLU middle . . 79 A 79 ARG middle . . 80 A 80 ASP middle . . 81 A 81 TYR middle . . 82 A 82 PHE middle . . 83 A 83 GLU middle . . 84 A 84 ILE middle . . 85 A 85 LYS middle . . 86 A 86 MET middle . . 87 A 87 SER middle . . 88 A 88 TYR middle . . 89 A 89 ASN middle . . 90 A 90 GLU middle . . 91 A 91 LEU middle . . 92 A 92 THR middle . . 93 A 93 GLY middle . false 94 A 94 ASP middle . . 95 A 95 TYR middle . . 96 A 96 VAL middle . . 97 A 97 LEU middle . . 98 A 98 GLU middle . . 99 A 99 ILE middle . . 100 A 100 THR middle . . 101 A 101 ASP middle . . 102 A 102 PHE middle . . 103 A 103 SER middle . . 104 A 104 GLU middle . . 105 A 105 ALA middle . . 106 A 106 ASP middle . . 107 A 107 GLU middle . . 108 A 108 ALA middle . . 109 A 109 ASP middle . . 110 A 110 ASP middle . . 111 A 111 LEU middle . . 112 A 112 LYS middle . . 113 A 113 GLU middle . . 114 A 114 LEU middle . . 115 A 115 TRP middle . . 116 A 116 ASP middle . . 117 A 117 SER middle . . 118 A 118 GLN middle . . 119 A 119 VAL middle . . 120 A 120 SER middle . . 121 A 121 LYS middle . . 122 A 122 LEU middle . . 123 A 123 ARG middle . . 124 A 124 ARG middle . . 125 A 125 THR middle . . 126 A 126 CYS middle . . 127 A 127 GLY middle . false 128 A 128 PHE middle . . 129 A 129 LEU middle . . 130 A 130 GLU middle . . 131 A 131 HIS middle . . 132 A 132 HIS middle . . 133 A 133 HIS middle . . 134 A 134 HIS middle . . 135 A 135 HIS middle . . 136 A 136 HIS 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 MET HE% H 1 2.145 0.020 A 1 MET CE C 13 16.787 0.400 A 2 LYS HA H 1 4.376 0.020 A 2 LYS HBx H 1 1.851 0.020 A 2 LYS HBy H 1 1.851 0.020 A 2 LYS HDx H 1 1.733 0.020 A 2 LYS HDy H 1 1.733 0.020 A 2 LYS HEx H 1 3.046 0.020 A 2 LYS HEy H 1 3.046 0.020 A 2 LYS HGx H 1 1.460 0.020 A 2 LYS HGy H 1 1.460 0.020 A 2 LYS C C 13 175.908 0.400 A 2 LYS CA C 13 56.581 0.400 A 2 LYS CB C 13 32.958 0.400 A 2 LYS CD C 13 29.015 0.400 A 2 LYS CE C 13 42.145 0.400 A 2 LYS CG C 13 24.675 0.400 A 3 LYS H H 1 8.613 0.020 A 3 LYS HA H 1 4.383 0.020 A 3 LYS HBy H 1 1.922 0.020 A 3 LYS HBx H 1 1.727 0.020 A 3 LYS HDy H 1 1.935 0.020 A 3 LYS HDx H 1 1.757 0.020 A 3 LYS HEx H 1 2.973 0.020 A 3 LYS HEy H 1 2.973 0.020 A 3 LYS HGy H 1 1.633 0.020 A 3 LYS HGx H 1 1.208 0.020 A 3 LYS C C 13 175.908 0.400 A 3 LYS CA C 13 56.290 0.400 A 3 LYS CB C 13 34.978 0.400 A 3 LYS CD C 13 29.499 0.400 A 3 LYS CE C 13 42.421 0.400 A 3 LYS CG C 13 26.388 0.400 A 3 LYS N N 15 123.165 0.400 A 4 GLU H H 1 8.653 0.020 A 4 GLU HA H 1 4.591 0.020 A 4 GLU HBy H 1 2.042 0.020 A 4 GLU HBx H 1 1.901 0.020 A 4 GLU HGx H 1 2.276 0.020 A 4 GLU HGy H 1 2.276 0.020 A 4 GLU C C 13 174.912 0.400 A 4 GLU CA C 13 54.675 0.400 A 4 GLU CB C 13 31.764 0.400 A 4 GLU CG C 13 35.678 0.400 A 4 GLU N N 15 121.186 0.400 A 5 LYS H H 1 8.443 0.020 A 5 LYS HA H 1 3.785 0.020 A 5 LYS HBy H 1 1.528 0.020 A 5 LYS HBx H 1 1.390 0.020 A 5 LYS HDx H 1 1.564 0.020 A 5 LYS HDy H 1 1.564 0.020 A 5 LYS HEx H 1 2.876 0.020 A 5 LYS HEy H 1 2.876 0.020 A 5 LYS HGy H 1 0.769 0.020 A 5 LYS HGx H 1 0.520 0.020 A 5 LYS C C 13 176.377 0.400 A 5 LYS CA C 13 56.229 0.400 A 5 LYS CB C 13 32.991 0.400 A 5 LYS CD C 13 29.457 0.400 A 5 LYS CE C 13 41.895 0.400 A 5 LYS CG C 13 24.260 0.400 A 5 LYS N N 15 124.266 0.400 A 6 ILE H H 1 9.075 0.020 A 6 ILE HA H 1 4.365 0.020 A 6 ILE HB H 1 1.575 0.020 A 6 ILE HD1% H 1 0.806 0.020 A 6 ILE HG12 H 1 0.936 0.020 A 6 ILE HG13 H 1 1.296 0.020 A 6 ILE HG2% H 1 0.776 0.020 A 6 ILE C C 13 173.154 0.400 A 6 ILE CA C 13 59.295 0.400 A 6 ILE CB C 13 40.381 0.400 A 6 ILE CD1 C 13 13.827 0.400 A 6 ILE CG1 C 13 26.881 0.400 A 6 ILE CG2 C 13 17.220 0.400 A 6 ILE N N 15 126.795 0.400 A 7 HIS H H 1 8.253 0.020 A 7 HIS HA H 1 5.507 0.020 A 7 HIS HBy H 1 3.024 0.020 A 7 HIS HBx H 1 2.820 0.020 A 7 HIS HD2 H 1 7.024 0.020 A 7 HIS C C 13 173.681 0.400 A 7 HIS CA C 13 54.463 0.400 A 7 HIS CB C 13 31.717 0.400 A 7 HIS CD2 C 13 120.052 0.400 A 7 HIS N N 15 122.645 0.400 A 8 LEU H H 1 8.853 0.020 A 8 LEU HA H 1 4.517 0.020 A 8 LEU HB2 H 1 1.461 0.020 A 8 LEU HB3 H 1 1.388 0.020 A 8 LEU HDx% H 1 0.875 0.020 A 8 LEU HDy% H 1 0.875 0.020 A 8 LEU HG H 1 0.896 0.020 A 8 LEU C C 13 174.736 0.400 A 8 LEU CA C 13 53.120 0.400 A 8 LEU CB C 13 45.723 0.400 A 8 LEU CD1 C 13 23.350 0.400 A 8 LEU CG C 13 25.437 0.400 A 8 LEU N N 15 127.233 0.400 A 9 GLU H H 1 7.881 0.020 A 9 GLU HA H 1 5.220 0.020 A 9 GLU HBx H 1 1.697 0.020 A 9 GLU HBy H 1 1.697 0.020 A 9 GLU HGx H 1 1.910 0.020 A 9 GLU HGy H 1 1.910 0.020 A 9 GLU C C 13 174.795 0.400 A 9 GLU CA C 13 54.675 0.400 A 9 GLU CB C 13 33.315 0.400 A 9 GLU CG C 13 36.830 0.400 A 9 GLU N N 15 119.621 0.400 A 10 TYR H H 1 9.280 0.020 A 10 TYR HA H 1 4.666 0.020 A 10 TYR HBy H 1 2.832 0.020 A 10 TYR HBx H 1 2.638 0.020 A 10 TYR HD1 H 1 6.934 0.020 A 10 TYR HD2 H 1 6.934 0.020 A 10 TYR HE1 H 1 6.718 0.020 A 10 TYR HE2 H 1 6.718 0.020 A 10 TYR C C 13 174.033 0.400 A 10 TYR CA C 13 56.681 0.400 A 10 TYR CB C 13 42.437 0.400 A 10 TYR CD1 C 13 133.211 0.400 A 10 TYR CE1 C 13 117.587 0.400 A 10 TYR N N 15 122.148 0.400 A 11 LEU H H 1 8.730 0.020 A 11 LEU HA H 1 5.153 0.020 A 11 LEU HBy H 1 1.649 0.020 A 11 LEU HBx H 1 1.470 0.020 A 11 LEU HDx% H 1 0.861 0.020 A 11 LEU HDy% H 1 0.861 0.020 A 11 LEU HG H 1 1.607 0.020 A 11 LEU C C 13 176.963 0.400 A 11 LEU CA C 13 54.014 0.400 A 11 LEU CB C 13 42.680 0.400 A 11 LEU CD1 C 13 24.408 0.400 A 11 LEU CG C 13 27.312 0.400 A 11 LEU N N 15 123.138 0.400 A 12 LEU H H 1 9.397 0.020 A 12 LEU HA H 1 4.740 0.020 A 12 LEU HBy H 1 1.630 0.020 A 12 LEU HBx H 1 1.551 0.020 A 12 LEU HDx% H 1 0.855 0.020 A 12 LEU HDy% H 1 0.855 0.020 A 12 LEU CA C 13 54.208 0.400 A 12 LEU CB C 13 44.800 0.400 A 12 LEU CD1 C 13 24.273 0.400 A 12 LEU CG C 13 27.835 0.400 A 12 LEU N N 15 125.227 0.400 A 13 ASN H H 1 8.445 0.020 A 13 ASN HA H 1 5.276 0.020 A 13 ASN HBy H 1 2.787 0.020 A 13 ASN HBx H 1 2.638 0.020 A 13 ASN HD2y H 1 7.705 0.020 A 13 ASN HD2x H 1 7.013 0.020 A 13 ASN C C 13 174.033 0.400 A 13 ASN CA C 13 52.646 0.400 A 13 ASN CB C 13 40.007 0.400 A 13 ASN N N 15 119.541 0.400 A 13 ASN ND2 N 15 111.814 0.400 A 14 ALA H H 1 8.238 0.020 A 14 ALA HA H 1 4.618 0.020 A 14 ALA HB% H 1 1.105 0.020 A 14 ALA C C 13 177.080 0.400 A 14 ALA CA C 13 51.420 0.400 A 14 ALA CB C 13 20.352 0.400 A 14 ALA N N 15 121.641 0.400 A 15 THR H H 1 8.459 0.020 A 15 THR HA H 1 4.258 0.020 A 15 THR HB H 1 4.099 0.020 A 15 THR HG2% H 1 1.144 0.020 A 15 THR CA C 13 63.101 0.400 A 15 THR CB C 13 69.270 0.400 A 15 THR CG2 C 13 21.220 0.400 A 15 THR N N 15 112.877 0.400 A 18 ASN HA H 1 4.666 0.020 A 18 ASN HB2 H 1 2.754 0.020 A 18 ASN HB3 H 1 2.903 0.020 A 18 ASN C C 13 177.959 0.400 A 18 ASN CA C 13 56.666 0.400 A 18 ASN CB C 13 38.259 0.400 A 19 ILE H H 1 7.595 0.020 A 19 ILE HA H 1 3.838 0.020 A 19 ILE HB H 1 1.839 0.020 A 19 ILE HD1% H 1 0.832 0.020 A 19 ILE HG1y H 1 1.517 0.020 A 19 ILE HG1x H 1 1.255 0.020 A 19 ILE HG2% H 1 0.984 0.020 A 19 ILE C C 13 177.842 0.400 A 19 ILE CA C 13 63.552 0.400 A 19 ILE CB C 13 37.405 0.400 A 19 ILE CD1 C 13 12.352 0.400 A 19 ILE CG1 C 13 28.870 0.400 A 19 ILE CG2 C 13 17.292 0.400 A 19 ILE N N 15 121.118 0.400 A 20 LEU H H 1 7.235 0.020 A 20 LEU HA H 1 4.070 0.020 A 20 LEU HB2 H 1 1.495 0.020 A 20 LEU HB3 H 1 1.017 0.020 A 20 LEU HD1% H 1 0.531 0.020 A 20 LEU HD2% H 1 0.496 0.020 A 20 LEU HG H 1 1.615 0.020 A 20 LEU C C 13 177.256 0.400 A 20 LEU CA C 13 57.433 0.400 A 20 LEU CB C 13 41.245 0.400 A 20 LEU CD1 C 13 26.560 0.400 A 20 LEU CD2 C 13 22.839 0.400 A 20 LEU CG C 13 26.803 0.400 A 20 LEU N N 15 121.049 0.400 A 21 TRP H H 1 8.364 0.020 A 21 TRP HA H 1 4.831 0.020 A 21 TRP HB2 H 1 3.171 0.020 A 21 TRP HB3 H 1 3.330 0.020 A 21 TRP HD1 H 1 6.988 0.020 A 21 TRP HE1 H 1 11.706 0.020 A 21 TRP HH2 H 1 7.138 0.020 A 21 TRP HZ2 H 1 7.313 0.020 A 21 TRP C C 13 180.362 0.400 A 21 TRP CA C 13 58.687 0.400 A 21 TRP CB C 13 31.286 0.400 A 21 TRP CD1 C 13 125.733 0.400 A 21 TRP CH2 C 13 124.066 0.400 A 21 TRP CZ2 C 13 114.247 0.400 A 21 TRP CZ3 C 13 120.659 0.400 A 21 TRP N N 15 115.916 0.400 A 21 TRP NE1 N 15 130.378 0.400 A 22 SER H H 1 8.386 0.020 A 22 SER HA H 1 4.078 0.020 A 22 SER HBy H 1 3.954 0.020 A 22 SER HBx H 1 3.888 0.020 A 22 SER C C 13 176.260 0.400 A 22 SER CA C 13 62.348 0.400 A 22 SER CB C 13 62.348 0.400 A 22 SER N N 15 116.446 0.400 A 23 ALA H H 1 7.800 0.020 A 23 ALA HA H 1 4.041 0.020 A 23 ALA HB% H 1 1.382 0.020 A 23 ALA C C 13 178.545 0.400 A 23 ALA CA C 13 55.016 0.400 A 23 ALA CB C 13 18.569 0.400 A 23 ALA N N 15 123.101 0.400 A 24 ILE H H 1 7.229 0.020 A 24 ILE HA H 1 4.848 0.020 A 24 ILE HB H 1 2.287 0.020 A 24 ILE HD1% H 1 0.870 0.020 A 24 ILE HG1x H 1 1.045 0.020 A 24 ILE HG1y H 1 1.045 0.020 A 24 ILE HG2% H 1 0.900 0.020 A 24 ILE C C 13 173.916 0.400 A 24 ILE CA C 13 61.746 0.400 A 24 ILE CB C 13 38.954 0.400 A 24 ILE CD1 C 13 13.716 0.400 A 24 ILE CG1 C 13 25.476 0.400 A 24 ILE CG2 C 13 17.144 0.400 A 24 ILE N N 15 105.641 0.400 A 25 SER H H 1 6.965 0.020 A 25 SER HA H 1 4.509 0.020 A 25 SER HB2 H 1 1.537 0.020 A 25 SER HB3 H 1 3.146 0.020 A 25 SER C C 13 174.267 0.400 A 25 SER CA C 13 57.985 0.400 A 25 SER CB C 13 66.166 0.400 A 25 SER N N 15 106.608 0.400 A 26 THR H H 1 7.134 0.020 A 26 THR HA H 1 4.769 0.020 A 26 THR HB H 1 4.343 0.020 A 26 THR HG2% H 1 1.128 0.020 A 26 THR CA C 13 57.483 0.400 A 26 THR CB C 13 70.664 0.400 A 26 THR CG2 C 13 22.011 0.400 A 26 THR N N 15 109.824 0.400 A 27 PRO HA H 1 3.888 0.020 A 27 PRO HBx H 1 2.017 0.020 A 27 PRO HBy H 1 2.017 0.020 A 27 PRO HDy H 1 3.937 0.020 A 27 PRO HDx H 1 3.789 0.020 A 27 PRO HG2 H 1 1.707 0.020 A 27 PRO HG3 H 1 2.267 0.020 A 27 PRO C C 13 177.022 0.400 A 27 PRO CA C 13 66.295 0.400 A 27 PRO CB C 13 31.939 0.400 A 27 PRO CD C 13 50.369 0.400 A 27 PRO CG C 13 28.193 0.400 A 28 THR H H 1 7.602 0.020 A 28 THR HA H 1 3.962 0.020 A 28 THR HB H 1 4.008 0.020 A 28 THR HG2% H 1 1.236 0.020 A 28 THR C C 13 176.904 0.400 A 28 THR CA C 13 65.057 0.400 A 28 THR CB C 13 68.453 0.400 A 28 THR CG2 C 13 22.066 0.400 A 28 THR N N 15 107.273 0.400 A 29 GLY H H 1 7.760 0.020 A 29 GLY HA2 H 1 4.153 0.020 A 29 GLY HA3 H 1 3.896 0.020 A 29 GLY C C 13 176.963 0.400 A 29 GLY CA C 13 47.057 0.400 A 29 GLY N N 15 110.972 0.400 A 30 LEU H H 1 8.562 0.020 A 30 LEU HA H 1 4.207 0.020 A 30 LEU HB2 H 1 1.115 0.020 A 30 LEU HB3 H 1 1.942 0.020 A 30 LEU HDx% H 1 0.879 0.020 A 30 LEU HDy% H 1 0.773 0.020 A 30 LEU HG H 1 1.295 0.020 A 30 LEU C C 13 180.362 0.400 A 30 LEU CA C 13 57.953 0.400 A 30 LEU CB C 13 43.595 0.400 A 30 LEU CD1 C 13 17.655 0.400 A 30 LEU CD2 C 13 17.282 0.400 A 30 LEU CG C 13 26.928 0.400 A 30 LEU N N 15 122.183 0.400 A 31 GLU H H 1 7.847 0.020 A 31 GLU HA H 1 4.517 0.020 A 31 GLU HBy H 1 2.207 0.020 A 31 GLU HBx H 1 2.012 0.020 A 31 GLU HGy H 1 2.584 0.020 A 31 GLU HGx H 1 2.017 0.020 A 31 GLU C C 13 176.787 0.400 A 31 GLU CA C 13 57.383 0.400 A 31 GLU CB C 13 29.500 0.400 A 31 GLU CG C 13 38.159 0.400 A 31 GLU N N 15 119.539 0.400 A 32 ASP H H 1 7.851 0.020 A 32 ASP HA H 1 4.931 0.020 A 32 ASP HBx H 1 3.060 0.020 A 32 ASP HBy H 1 3.060 0.020 A 32 ASP C C 13 176.377 0.400 A 32 ASP CA C 13 55.577 0.400 A 32 ASP CB C 13 41.835 0.400 A 32 ASP N N 15 116.786 0.400 A 33 TRP H H 1 7.439 0.020 A 33 TRP HA H 1 4.831 0.020 A 33 TRP HBx H 1 3.044 0.020 A 33 TRP HBy H 1 3.044 0.020 A 33 TRP HD1 H 1 7.616 0.020 A 33 TRP HE1 H 1 10.514 0.020 A 33 TRP HH2 H 1 7.779 0.020 A 33 TRP HZ2 H 1 7.387 0.020 A 33 TRP C C 13 172.509 0.400 A 33 TRP CA C 13 57.935 0.400 A 33 TRP CB C 13 29.648 0.400 A 33 TRP CD1 C 13 127.921 0.400 A 33 TRP CH2 C 13 122.585 0.400 A 33 TRP CZ2 C 13 114.428 0.400 A 33 TRP N N 15 112.352 0.400 A 33 TRP NE1 N 15 131.955 0.400 A 34 PHE H H 1 7.488 0.020 A 34 PHE HA H 1 3.689 0.020 A 34 PHE HB2 H 1 2.106 0.020 A 34 PHE HB3 H 1 0.719 0.020 A 34 PHE HD1 H 1 6.222 0.020 A 34 PHE HD2 H 1 6.222 0.020 A 34 PHE HE1 H 1 6.084 0.020 A 34 PHE HE2 H 1 6.084 0.020 A 34 PHE C C 13 174.619 0.400 A 34 PHE CA C 13 60.091 0.400 A 34 PHE CB C 13 41.420 0.400 A 34 PHE CD2 C 13 131.362 0.400 A 34 PHE CE2 C 13 130.209 0.400 A 34 PHE N N 15 125.044 0.400 A 35 ALA H H 1 7.327 0.020 A 35 ALA HA H 1 4.162 0.020 A 35 ALA HB% H 1 0.572 0.020 A 35 ALA C C 13 174.326 0.400 A 35 ALA CA C 13 50.455 0.400 A 35 ALA CB C 13 21.617 0.400 A 35 ALA N N 15 116.462 0.400 A 36 ASP H H 1 7.251 0.020 A 36 ASP HA H 1 4.558 0.020 A 36 ASP HBx H 1 2.638 0.020 A 36 ASP HBy H 1 2.638 0.020 A 36 ASP C C 13 177.139 0.400 A 36 ASP CA C 13 56.480 0.400 A 36 ASP CB C 13 41.634 0.400 A 36 ASP N N 15 115.988 0.400 A 37 LYS H H 1 7.607 0.020 A 37 LYS HA H 1 4.691 0.020 A 37 LYS HB2 H 1 1.433 0.020 A 37 LYS HB3 H 1 1.524 0.020 A 37 LYS HDx H 1 1.617 0.020 A 37 LYS HDy H 1 1.617 0.020 A 37 LYS HEy H 1 2.876 0.020 A 37 LYS HEx H 1 2.810 0.020 A 37 LYS HGy H 1 1.340 0.020 A 37 LYS HGx H 1 1.153 0.020 A 37 LYS C C 13 174.091 0.400 A 37 LYS CA C 13 54.875 0.400 A 37 LYS CB C 13 35.634 0.400 A 37 LYS CD C 13 28.594 0.400 A 37 LYS CE C 13 42.059 0.400 A 37 LYS CG C 13 24.841 0.400 A 37 LYS N N 15 118.480 0.400 A 38 VAL H H 1 9.712 0.020 A 38 VAL HA H 1 4.633 0.020 A 38 VAL HB H 1 1.918 0.020 A 38 VAL HG1% H 1 0.786 0.020 A 38 VAL HG2% H 1 0.356 0.020 A 38 VAL C C 13 174.326 0.400 A 38 VAL CA C 13 60.994 0.400 A 38 VAL CB C 13 33.710 0.400 A 38 VAL CG1 C 13 21.978 0.400 A 38 VAL CG2 C 13 21.649 0.400 A 38 VAL N N 15 127.226 0.400 A 39 VAL H H 1 8.395 0.020 A 39 VAL HA H 1 4.326 0.020 A 39 VAL HB H 1 1.851 0.020 A 39 VAL HG1% H 1 0.766 0.020 A 39 VAL HG2% H 1 0.843 0.020 A 39 VAL C C 13 174.677 0.400 A 39 VAL CA C 13 60.342 0.400 A 39 VAL CB C 13 34.782 0.400 A 39 VAL CG1 C 13 19.891 0.400 A 39 VAL CG2 C 13 21.235 0.400 A 39 VAL N N 15 124.620 0.400 A 40 SER H H 1 8.818 0.020 A 40 SER HA H 1 5.196 0.020 A 40 SER HBx H 1 3.628 0.020 A 40 SER HBy H 1 3.628 0.020 A 40 SER C C 13 173.857 0.400 A 40 SER CA C 13 56.216 0.400 A 40 SER CB C 13 65.877 0.400 A 40 SER N N 15 119.023 0.400 A 41 ASP H H 1 8.320 0.020 A 41 ASP HA H 1 4.773 0.020 A 41 ASP HBy H 1 2.878 0.020 A 41 ASP HBx H 1 2.596 0.020 A 41 ASP C C 13 175.967 0.400 A 41 ASP CA C 13 53.170 0.400 A 41 ASP CB C 13 41.087 0.400 A 41 ASP N N 15 125.740 0.400 A 42 ASP H H 1 8.738 0.020 A 42 ASP HA H 1 4.139 0.020 A 42 ASP HBx H 1 2.932 0.020 A 42 ASP HBy H 1 2.932 0.020 A 42 ASP C C 13 175.381 0.400 A 42 ASP CA C 13 57.037 0.400 A 42 ASP CB C 13 39.554 0.400 A 42 ASP N N 15 116.995 0.400 A 43 LYS H H 1 8.456 0.020 A 43 LYS HA H 1 4.500 0.020 A 43 LYS HBy H 1 2.038 0.020 A 43 LYS HBx H 1 1.893 0.020 A 43 LYS HDx H 1 1.662 0.020 A 43 LYS HDy H 1 1.662 0.020 A 43 LYS HEx H 1 2.980 0.020 A 43 LYS HEy H 1 2.980 0.020 A 43 LYS HGy H 1 1.463 0.020 A 43 LYS HGx H 1 1.400 0.020 A 43 LYS C C 13 175.967 0.400 A 43 LYS CA C 13 57.433 0.400 A 43 LYS CB C 13 34.079 0.400 A 43 LYS CD C 13 28.667 0.400 A 43 LYS CE C 13 42.207 0.400 A 43 LYS CG C 13 24.685 0.400 A 43 LYS N N 15 119.563 0.400 A 44 THR H H 1 9.060 0.020 A 44 THR HA H 1 4.972 0.020 A 44 THR HB H 1 4.078 0.020 A 44 THR HG2% H 1 1.139 0.020 A 44 THR C C 13 173.271 0.400 A 44 THR CA C 13 61.696 0.400 A 44 THR CB C 13 71.025 0.400 A 44 THR CG2 C 13 22.235 0.400 A 44 THR N N 15 116.464 0.400 A 45 VAL H H 1 9.535 0.020 A 45 VAL HA H 1 4.542 0.020 A 45 VAL HB H 1 1.611 0.020 A 45 VAL HG1% H 1 0.720 0.020 A 45 VAL HG2% H 1 0.032 0.020 A 45 VAL C C 13 174.384 0.400 A 45 VAL CA C 13 60.643 0.400 A 45 VAL CB C 13 33.710 0.400 A 45 VAL CG1 C 13 21.394 0.400 A 45 VAL CG2 C 13 22.186 0.400 A 45 VAL N N 15 125.681 0.400 A 46 THR H H 1 9.126 0.020 A 46 THR HA H 1 4.542 0.020 A 46 THR HB H 1 3.840 0.020 A 46 THR HG2% H 1 0.974 0.020 A 46 THR C C 13 172.626 0.400 A 46 THR CA C 13 62.549 0.400 A 46 THR CB C 13 69.306 0.400 A 46 THR CG2 C 13 21.275 0.400 A 46 THR N N 15 122.682 0.400 A 47 PHE H H 1 8.928 0.020 A 47 PHE HA H 1 4.533 0.020 A 47 PHE HB2 H 1 2.787 0.020 A 47 PHE HB3 H 1 3.068 0.020 A 47 PHE HD1 H 1 7.214 0.020 A 47 PHE HD2 H 1 7.214 0.020 A 47 PHE HE1 H 1 6.640 0.020 A 47 PHE HE2 H 1 6.640 0.020 A 47 PHE C C 13 174.209 0.400 A 47 PHE CA C 13 56.932 0.400 A 47 PHE CB C 13 42.086 0.400 A 47 PHE CD1 C 13 131.862 0.400 A 47 PHE CE1 C 13 130.671 0.400 A 47 PHE CZ C 13 132.459 0.400 A 47 PHE N N 15 126.234 0.400 A 48 CYS H H 1 8.196 0.020 A 48 CYS CA C 13 56.530 0.400 A 48 CYS CB C 13 30.099 0.400 A 48 CYS N N 15 116.977 0.400 A 49 TRP HA H 1 4.335 0.020 A 49 TRP HBx H 1 2.820 0.020 A 49 TRP HBy H 1 2.820 0.020 A 49 TRP HD1 H 1 7.169 0.020 A 49 TRP HE1 H 1 9.722 0.020 A 49 TRP HH2 H 1 6.805 0.020 A 49 TRP HZ2 H 1 6.548 0.020 A 49 TRP C C 13 174.640 0.400 A 49 TRP CD1 C 13 126.412 0.400 A 49 TRP CH2 C 13 123.372 0.400 A 49 TRP CZ2 C 13 113.482 0.400 A 49 TRP NE1 N 15 129.423 0.400 A 50 GLY H H 1 7.723 0.020 A 50 GLY HAy H 1 4.102 0.020 A 50 GLY HAx H 1 3.896 0.020 A 50 GLY CA C 13 45.547 0.400 A 50 GLY N N 15 107.711 0.400 A 52 THR HA H 1 4.561 0.020 A 52 THR HB H 1 4.323 0.020 A 52 THR HG2% H 1 1.115 0.020 A 52 THR C C 13 174.677 0.400 A 52 THR CA C 13 62.133 0.400 A 52 THR CB C 13 70.381 0.400 A 52 THR CG2 C 13 21.824 0.400 A 53 GLU H H 1 7.844 0.020 A 53 GLU HA H 1 4.616 0.020 A 53 GLU HBx H 1 2.290 0.020 A 53 GLU HBy H 1 2.290 0.020 A 53 GLU HGx H 1 2.236 0.020 A 53 GLU HGy H 1 2.236 0.020 A 53 GLU C C 13 176.241 0.400 A 53 GLU CA C 13 56.831 0.400 A 53 GLU CB C 13 30.952 0.400 A 53 GLU CG C 13 35.952 0.400 A 53 GLU N N 15 122.687 0.400 A 54 GLN H H 1 8.623 0.020 A 54 GLN HA H 1 5.664 0.020 A 54 GLN HBx H 1 1.990 0.020 A 54 GLN HBy H 1 1.990 0.020 A 54 GLN HGx H 1 2.254 0.020 A 54 GLN HGy H 1 2.254 0.020 A 54 GLN C C 13 174.912 0.400 A 54 GLN CA C 13 54.596 0.400 A 54 GLN CB C 13 32.137 0.400 A 54 GLN CG C 13 33.450 0.400 A 54 GLN N N 15 124.017 0.400 A 55 ARG H H 1 9.360 0.020 A 55 ARG HA H 1 4.715 0.020 A 55 ARG HBy H 1 1.942 0.020 A 55 ARG HBx H 1 1.752 0.020 A 55 ARG HDx H 1 3.193 0.020 A 55 ARG HDy H 1 3.193 0.020 A 55 ARG HGx H 1 1.732 0.020 A 55 ARG HGy H 1 1.732 0.020 A 55 ARG C C 13 174.560 0.400 A 55 ARG CA C 13 56.781 0.400 A 55 ARG CB C 13 35.651 0.400 A 55 ARG CD C 13 43.072 0.400 A 55 ARG CG C 13 27.751 0.400 A 55 ARG N N 15 123.727 0.400 A 56 GLN H H 1 9.034 0.020 A 56 GLN HA H 1 5.760 0.020 A 56 GLN HB2 H 1 2.174 0.020 A 56 GLN HB3 H 1 1.944 0.020 A 56 GLN HE2y H 1 7.233 0.020 A 56 GLN HE2x H 1 6.806 0.020 A 56 GLN HGx H 1 2.473 0.020 A 56 GLN HGy H 1 2.473 0.020 A 56 GLN C C 13 175.615 0.400 A 56 GLN CA C 13 55.062 0.400 A 56 GLN CB C 13 32.630 0.400 A 56 GLN CG C 13 34.300 0.400 A 56 GLN N N 15 123.193 0.400 A 56 GLN NE2 N 15 111.299 0.400 A 57 ALA H H 1 9.985 0.020 A 57 ALA HA H 1 5.609 0.020 A 57 ALA HB% H 1 1.335 0.020 A 57 ALA C C 13 175.791 0.400 A 57 ALA CA C 13 50.512 0.400 A 57 ALA CB C 13 23.848 0.400 A 57 ALA N N 15 125.748 0.400 A 58 GLY H H 1 9.353 0.020 A 58 GLY HAy H 1 4.997 0.020 A 58 GLY HAx H 1 3.830 0.020 A 58 GLY C C 13 174.033 0.400 A 58 GLY CA C 13 43.769 0.400 A 58 GLY N N 15 107.615 0.400 A 59 ILE H H 1 8.661 0.020 A 59 ILE HA H 1 4.012 0.020 A 59 ILE HB H 1 1.653 0.020 A 59 ILE HD1% H 1 0.680 0.020 A 59 ILE HG1y H 1 1.517 0.020 A 59 ILE HG1x H 1 0.644 0.020 A 59 ILE HG2% H 1 0.575 0.020 A 59 ILE C C 13 176.670 0.400 A 59 ILE CA C 13 62.348 0.400 A 59 ILE CB C 13 38.074 0.400 A 59 ILE CD1 C 13 12.862 0.400 A 59 ILE CG1 C 13 28.499 0.400 A 59 ILE CG2 C 13 16.997 0.400 A 59 ILE N N 15 123.175 0.400 A 60 VAL H H 1 8.942 0.020 A 60 VAL HA H 1 4.037 0.020 A 60 VAL HB H 1 1.719 0.020 A 60 VAL HGx% H 1 0.812 0.020 A 60 VAL HGy% H 1 0.812 0.020 A 60 VAL C C 13 176.201 0.400 A 60 VAL CA C 13 62.950 0.400 A 60 VAL CB C 13 32.944 0.400 A 60 VAL CG1 C 13 20.697 0.400 A 60 VAL N N 15 127.803 0.400 A 61 ALA H H 1 7.566 0.020 A 61 ALA HA H 1 4.509 0.020 A 61 ALA HB% H 1 1.429 0.020 A 61 ALA C C 13 173.857 0.400 A 61 ALA CA C 13 52.217 0.400 A 61 ALA CB C 13 22.311 0.400 A 61 ALA N N 15 119.520 0.400 A 62 ILE H H 1 8.306 0.020 A 62 ILE HA H 1 4.394 0.020 A 62 ILE HB H 1 1.656 0.020 A 62 ILE HD1% H 1 0.915 0.020 A 62 ILE HG1x H 1 0.988 0.020 A 62 ILE HG1y H 1 0.988 0.020 A 62 ILE HG2% H 1 0.872 0.020 A 62 ILE C C 13 173.447 0.400 A 62 ILE CA C 13 60.215 0.400 A 62 ILE CB C 13 41.790 0.400 A 62 ILE CD1 C 13 14.564 0.400 A 62 ILE CG1 C 13 28.572 0.400 A 62 ILE CG2 C 13 15.522 0.400 A 62 ILE N N 15 118.538 0.400 A 63 ARG H H 1 8.218 0.020 A 63 ARG CA C 13 54.875 0.400 A 63 ARG CB C 13 32.155 0.400 A 63 ARG N N 15 126.777 0.400 A 64 ALA HA H 1 3.008 0.020 A 64 ALA HB% H 1 0.880 0.020 A 64 ALA C C 13 176.436 0.400 A 64 ALA CA C 13 53.355 0.400 A 64 ALA CB C 13 17.846 0.400 A 65 TYR H H 1 3.166 0.020 A 65 TYR HA H 1 3.000 0.020 A 65 TYR HBx H 1 2.941 0.020 A 65 TYR HBy H 1 2.941 0.020 A 65 TYR HD1 H 1 6.589 0.020 A 65 TYR HD2 H 1 6.589 0.020 A 65 TYR HE1 H 1 6.758 0.020 A 65 TYR HE2 H 1 6.758 0.020 A 65 TYR C C 13 172.275 0.400 A 65 TYR CA C 13 58.858 0.400 A 65 TYR CB C 13 35.236 0.400 A 65 TYR CD2 C 13 132.046 0.400 A 65 TYR CE2 C 13 117.917 0.400 A 65 TYR N N 15 108.835 0.400 A 66 SER H H 1 7.397 0.020 A 66 SER HA H 1 5.162 0.020 A 66 SER HB2 H 1 3.421 0.020 A 66 SER HB3 H 1 3.523 0.020 A 66 SER C C 13 172.861 0.400 A 66 SER CA C 13 58.888 0.400 A 66 SER CB C 13 64.289 0.400 A 66 SER N N 15 110.302 0.400 A 67 PHE H H 1 8.393 0.020 A 67 PHE HA H 1 6.121 0.020 A 67 PHE HB2 H 1 3.205 0.020 A 67 PHE HB3 H 1 2.960 0.020 A 67 PHE HD1 H 1 6.963 0.020 A 67 PHE HD2 H 1 6.963 0.020 A 67 PHE HE1 H 1 7.003 0.020 A 67 PHE HE2 H 1 7.003 0.020 A 67 PHE HZ H 1 7.217 0.020 A 67 PHE C C 13 171.689 0.400 A 67 PHE CA C 13 57.018 0.400 A 67 PHE CB C 13 42.038 0.400 A 67 PHE CD2 C 13 131.871 0.400 A 67 PHE CE2 C 13 130.886 0.400 A 67 PHE CZ C 13 131.478 0.400 A 67 PHE N N 15 112.362 0.400 A 68 ILE H H 1 8.910 0.020 A 68 ILE HA H 1 4.674 0.020 A 68 ILE HB H 1 1.495 0.020 A 68 ILE HD1% H 1 0.609 0.020 A 68 ILE HG12 H 1 0.061 0.020 A 68 ILE HG13 H 1 1.155 0.020 A 68 ILE HG2% H 1 1.059 0.020 A 68 ILE C C 13 171.278 0.400 A 68 ILE CA C 13 60.442 0.400 A 68 ILE CB C 13 43.057 0.400 A 68 ILE CD1 C 13 15.488 0.400 A 68 ILE CG1 C 13 27.909 0.400 A 68 ILE CG2 C 13 14.195 0.400 A 68 ILE N N 15 119.015 0.400 A 69 ARG H H 1 8.650 0.020 A 69 ARG HA H 1 5.254 0.020 A 69 ARG HBx H 1 1.702 0.020 A 69 ARG HBy H 1 1.702 0.020 A 69 ARG HDx H 1 3.188 0.020 A 69 ARG HDy H 1 3.188 0.020 A 69 ARG HGx H 1 1.429 0.020 A 69 ARG HGy H 1 1.429 0.020 A 69 ARG C C 13 173.623 0.400 A 69 ARG CA C 13 54.460 0.400 A 69 ARG CB C 13 34.832 0.400 A 69 ARG CD C 13 43.023 0.400 A 69 ARG CG C 13 26.690 0.400 A 69 ARG N N 15 127.233 0.400 A 70 PHE H H 1 9.305 0.020 A 70 PHE HA H 1 5.469 0.020 A 70 PHE HBx H 1 2.055 0.020 A 70 PHE HBy H 1 2.055 0.020 A 70 PHE HD1 H 1 6.506 0.020 A 70 PHE HD2 H 1 6.506 0.020 A 70 PHE HE1 H 1 6.934 0.020 A 70 PHE HE2 H 1 6.934 0.020 A 70 PHE C C 13 174.792 0.400 A 70 PHE CA C 13 55.728 0.400 A 70 PHE CB C 13 44.293 0.400 A 70 PHE CD1 C 13 132.495 0.400 A 70 PHE CE1 C 13 130.116 0.400 A 70 PHE N N 15 125.172 0.400 A 71 HIS H H 1 9.032 0.020 A 71 HIS HA H 1 5.229 0.020 A 71 HIS HBx H 1 3.168 0.020 A 71 HIS HBy H 1 3.168 0.020 A 71 HIS HD2 H 1 7.061 0.020 A 71 HIS C C 13 174.970 0.400 A 71 HIS CA C 13 53.922 0.400 A 71 HIS CB C 13 31.403 0.400 A 71 HIS CD2 C 13 121.300 0.400 A 71 HIS N N 15 116.448 0.400 A 72 TRP H H 1 9.498 0.020 A 72 TRP HA H 1 5.171 0.020 A 72 TRP HBy H 1 3.409 0.020 A 72 TRP HBx H 1 3.168 0.020 A 72 TRP HD1 H 1 7.490 0.020 A 72 TRP HE1 H 1 10.224 0.020 A 72 TRP HZ2 H 1 6.923 0.020 A 72 TRP C C 13 178.135 0.400 A 72 TRP CA C 13 57.534 0.400 A 72 TRP CB C 13 31.438 0.400 A 72 TRP CD1 C 13 128.736 0.400 A 72 TRP CH2 C 13 125.860 0.400 A 72 TRP CZ2 C 13 115.706 0.400 A 72 TRP N N 15 130.357 0.400 A 72 TRP NE1 N 15 131.989 0.400 A 73 LEU H H 1 9.104 0.020 A 73 LEU HA H 1 4.856 0.020 A 73 LEU HB2 H 1 1.711 0.020 A 73 LEU HB3 H 1 1.866 0.020 A 73 LEU HG H 1 0.987 0.020 A 73 LEU C C 13 178.135 0.400 A 73 LEU CA C 13 57.534 0.400 A 73 LEU CB C 13 40.486 0.400 A 73 LEU CG C 13 25.650 0.400 A 73 LEU N N 15 122.097 0.400 A 74 ASP H H 1 8.606 0.020 A 74 ASP HA H 1 4.566 0.020 A 74 ASP HBy H 1 2.957 0.020 A 74 ASP HBx H 1 2.588 0.020 A 74 ASP C C 13 175.732 0.400 A 74 ASP CA C 13 53.070 0.400 A 74 ASP CB C 13 40.166 0.400 A 74 ASP N N 15 114.889 0.400 A 75 ASP H H 1 7.469 0.020 A 75 ASP HA H 1 4.566 0.020 A 75 ASP HBy H 1 2.866 0.020 A 75 ASP HBx H 1 2.704 0.020 A 75 ASP C C 13 177.315 0.400 A 75 ASP CA C 13 54.324 0.400 A 75 ASP CB C 13 41.388 0.400 A 75 ASP N N 15 121.268 0.400 A 76 GLU H H 1 8.816 0.020 A 76 GLU HA H 1 4.177 0.020 A 76 GLU HBx H 1 2.075 0.020 A 76 GLU HBy H 1 2.075 0.020 A 76 GLU HGy H 1 2.343 0.020 A 76 GLU HGx H 1 2.331 0.020 A 76 GLU C C 13 176.553 0.400 A 76 GLU CA C 13 58.035 0.400 A 76 GLU CB C 13 29.848 0.400 A 76 GLU CG C 13 36.173 0.400 A 76 GLU N N 15 124.749 0.400 A 77 ASN H H 1 8.679 0.020 A 77 ASN HA H 1 4.807 0.020 A 77 ASN HBx H 1 2.845 0.020 A 77 ASN HBy H 1 2.845 0.020 A 77 ASN HD2y H 1 7.943 0.020 A 77 ASN HD2x H 1 6.990 0.020 A 77 ASN C C 13 175.967 0.400 A 77 ASN CA C 13 52.117 0.400 A 77 ASN CB C 13 38.023 0.400 A 77 ASN N N 15 118.581 0.400 A 77 ASN ND2 N 15 113.376 0.400 A 78 GLU H H 1 8.842 0.020 A 78 GLU HA H 1 3.846 0.020 A 78 GLU HBx H 1 2.004 0.020 A 78 GLU HBy H 1 2.004 0.020 A 78 GLU HGx H 1 2.325 0.020 A 78 GLU HGy H 1 2.325 0.020 A 78 GLU C C 13 176.318 0.400 A 78 GLU CA C 13 58.772 0.400 A 78 GLU CB C 13 29.698 0.400 A 78 GLU CG C 13 35.878 0.400 A 78 GLU N N 15 125.260 0.400 A 79 ARG H H 1 8.254 0.020 A 79 ARG HA H 1 4.227 0.020 A 79 ARG HBy H 1 1.951 0.020 A 79 ARG HBx H 1 1.752 0.020 A 79 ARG C C 13 177.139 0.400 A 79 ARG CA C 13 56.029 0.400 A 79 ARG CB C 13 29.992 0.400 A 79 ARG CD C 13 43.090 0.400 A 79 ARG CG C 13 27.416 0.400 A 79 ARG N N 15 114.882 0.400 A 80 ASP H H 1 7.163 0.020 A 80 ASP HA H 1 3.750 0.020 A 80 ASP HBy H 1 2.820 0.020 A 80 ASP HBx H 1 2.401 0.020 A 80 ASP C C 13 175.439 0.400 A 80 ASP CA C 13 54.843 0.400 A 80 ASP CB C 13 39.998 0.400 A 80 ASP N N 15 121.058 0.400 A 81 TYR H H 1 7.046 0.020 A 81 TYR HA H 1 5.618 0.020 A 81 TYR HBx H 1 3.217 0.020 A 81 TYR HBy H 1 3.217 0.020 A 81 TYR HD1 H 1 6.972 0.020 A 81 TYR HD2 H 1 6.972 0.020 A 81 TYR HE1 H 1 6.769 0.020 A 81 TYR HE2 H 1 6.769 0.020 A 81 TYR C C 13 174.150 0.400 A 81 TYR CA C 13 57.076 0.400 A 81 TYR CB C 13 39.227 0.400 A 81 TYR CD1 C 13 133.785 0.400 A 81 TYR CE1 C 13 117.471 0.400 A 81 TYR N N 15 117.474 0.400 A 82 PHE H H 1 9.338 0.020 A 82 PHE HA H 1 5.906 0.020 A 82 PHE HBy H 1 3.667 0.020 A 82 PHE HBx H 1 3.506 0.020 A 82 PHE HD1 H 1 6.991 0.020 A 82 PHE HD2 H 1 6.991 0.020 A 82 PHE C C 13 174.033 0.400 A 82 PHE CA C 13 56.475 0.400 A 82 PHE CB C 13 41.333 0.400 A 82 PHE N N 15 113.890 0.400 A 83 GLU H H 1 9.671 0.020 A 83 GLU HA H 1 5.659 0.020 A 83 GLU HBx H 1 2.207 0.020 A 83 GLU HBy H 1 2.207 0.020 A 83 GLU C C 13 173.388 0.400 A 83 GLU CA C 13 54.374 0.400 A 83 GLU CB C 13 37.371 0.400 A 83 GLU N N 15 124.201 0.400 A 84 ILE H H 1 8.642 0.020 A 84 ILE HA H 1 4.682 0.020 A 84 ILE HB H 1 2.108 0.020 A 84 ILE HD1% H 1 1.386 0.020 A 84 ILE HG12 H 1 1.368 0.020 A 84 ILE HG13 H 1 2.059 0.020 A 84 ILE HG2% H 1 1.086 0.020 A 84 ILE C C 13 173.798 0.400 A 84 ILE CA C 13 61.245 0.400 A 84 ILE CB C 13 39.596 0.400 A 84 ILE CD1 C 13 14.216 0.400 A 84 ILE CG1 C 13 27.245 0.400 A 84 ILE CG2 C 13 20.315 0.400 A 84 ILE N N 15 124.708 0.400 A 85 LYS H H 1 9.058 0.020 A 85 LYS HA H 1 5.717 0.020 A 85 LYS HBy H 1 2.108 0.020 A 85 LYS HBx H 1 1.797 0.020 A 85 LYS C C 13 174.267 0.400 A 85 LYS CA C 13 53.922 0.400 A 85 LYS CB C 13 36.972 0.400 A 85 LYS CD C 13 24.694 0.400 A 85 LYS N N 15 128.842 0.400 A 86 MET H H 1 9.844 0.020 A 86 MET HA H 1 5.932 0.020 A 86 MET HB2 H 1 2.091 0.020 A 86 MET HB3 H 1 1.793 0.020 A 86 MET HE% H 1 2.251 0.020 A 86 MET C C 13 174.970 0.400 A 86 MET CA C 13 53.571 0.400 A 86 MET CB C 13 38.372 0.400 A 86 MET CE C 13 17.460 0.400 A 86 MET CG C 13 30.065 0.400 A 86 MET N N 15 121.581 0.400 A 87 SER H H 1 8.870 0.020 A 87 SER HA H 1 4.881 0.020 A 87 SER HBy H 1 3.979 0.020 A 87 SER HBx H 1 3.821 0.020 A 87 SER C C 13 172.275 0.400 A 87 SER CA C 13 57.684 0.400 A 87 SER CB C 13 65.157 0.400 A 87 SER N N 15 115.365 0.400 A 88 TYR H H 1 8.953 0.020 A 88 TYR HA H 1 4.426 0.020 A 88 TYR HBx H 1 2.729 0.020 A 88 TYR HBy H 1 2.729 0.020 A 88 TYR HD1 H 1 6.126 0.020 A 88 TYR HD2 H 1 6.126 0.020 A 88 TYR HE1 H 1 6.478 0.020 A 88 TYR HE2 H 1 6.478 0.020 A 88 TYR C C 13 174.209 0.400 A 88 TYR CA C 13 56.731 0.400 A 88 TYR CB C 13 40.365 0.400 A 88 TYR CD1 C 13 132.455 0.400 A 88 TYR CE1 C 13 117.846 0.400 A 88 TYR N N 15 124.340 0.400 A 89 ASN H H 1 8.235 0.020 A 89 ASN HA H 1 4.566 0.020 A 89 ASN HBy H 1 2.911 0.020 A 89 ASN HBx H 1 2.337 0.020 A 89 ASN HD2y H 1 7.321 0.020 A 89 ASN HD2x H 1 6.724 0.020 A 89 ASN C C 13 173.916 0.400 A 89 ASN CA C 13 51.415 0.400 A 89 ASN CB C 13 38.239 0.400 A 89 ASN N N 15 127.271 0.400 A 89 ASN ND2 N 15 112.379 0.400 A 90 GLU H H 1 8.553 0.020 A 90 GLU HA H 1 3.590 0.020 A 90 GLU HBx H 1 1.984 0.020 A 90 GLU HBy H 1 1.984 0.020 A 90 GLU HGx H 1 2.336 0.020 A 90 GLU HGy H 1 2.336 0.020 A 90 GLU C C 13 177.783 0.400 A 90 GLU CA C 13 58.336 0.400 A 90 GLU CB C 13 29.447 0.400 A 90 GLU CG C 13 35.878 0.400 A 90 GLU N N 15 123.373 0.400 A 91 LEU H H 1 8.068 0.020 A 91 LEU HA H 1 4.169 0.020 A 91 LEU HBy H 1 1.777 0.020 A 91 LEU HBx H 1 1.553 0.020 A 91 LEU HD1% H 1 1.004 0.020 A 91 LEU HD2% H 1 0.880 0.020 A 91 LEU HG H 1 1.591 0.020 A 91 LEU C C 13 178.780 0.400 A 91 LEU CA C 13 56.982 0.400 A 91 LEU CB C 13 41.785 0.400 A 91 LEU CD1 C 13 24.326 0.400 A 91 LEU CD2 C 13 23.663 0.400 A 91 LEU CG C 13 26.936 0.400 A 91 LEU N N 15 117.251 0.400 A 92 THR H H 1 6.973 0.020 A 92 THR HA H 1 4.303 0.020 A 92 THR HB H 1 4.231 0.020 A 92 THR HG2% H 1 1.018 0.020 A 92 THR C C 13 176.260 0.400 A 92 THR CA C 13 61.052 0.400 A 92 THR CB C 13 69.678 0.400 A 92 THR CG2 C 13 21.750 0.400 A 92 THR N N 15 105.157 0.400 A 93 GLY H H 1 8.262 0.020 A 93 GLY HAy H 1 4.095 0.020 A 93 GLY HAx H 1 3.661 0.020 A 93 GLY C C 13 173.095 0.400 A 93 GLY CA C 13 45.303 0.400 A 93 GLY N N 15 111.346 0.400 A 94 ASP H H 1 7.383 0.020 A 94 ASP HA H 1 4.194 0.020 A 94 ASP HBy H 1 2.638 0.020 A 94 ASP HBx H 1 2.378 0.020 A 94 ASP C C 13 174.150 0.400 A 94 ASP CA C 13 53.371 0.400 A 94 ASP CB C 13 42.205 0.400 A 94 ASP N N 15 118.497 0.400 A 95 TYR H H 1 8.599 0.020 A 95 TYR HA H 1 5.113 0.020 A 95 TYR HB2 H 1 2.815 0.020 A 95 TYR HB3 H 1 2.621 0.020 A 95 TYR HD1 H 1 7.104 0.020 A 95 TYR HD2 H 1 7.104 0.020 A 95 TYR HE1 H 1 6.699 0.020 A 95 TYR HE2 H 1 6.699 0.020 A 95 TYR C C 13 175.029 0.400 A 95 TYR CA C 13 57.985 0.400 A 95 TYR CB C 13 40.782 0.400 A 95 TYR CD1 C 13 133.185 0.400 A 95 TYR CE1 C 13 117.690 0.400 A 95 TYR N N 15 115.393 0.400 A 96 VAL H H 1 9.015 0.020 A 96 VAL HA H 1 4.707 0.020 A 96 VAL HB H 1 2.017 0.020 A 96 VAL HGx% H 1 0.856 0.020 A 96 VAL HGy% H 1 0.856 0.020 A 96 VAL C C 13 175.439 0.400 A 96 VAL CA C 13 61.195 0.400 A 96 VAL CB C 13 33.309 0.400 A 96 VAL CG1 C 13 21.126 0.400 A 96 VAL N N 15 121.653 0.400 A 97 LEU H H 1 9.520 0.020 A 97 LEU HA H 1 5.523 0.020 A 97 LEU HB2 H 1 2.000 0.020 A 97 LEU HB3 H 1 1.264 0.020 A 97 LEU HD1% H 1 0.855 0.020 A 97 LEU HD2% H 1 0.724 0.020 A 97 LEU HG H 1 1.535 0.020 A 97 LEU C C 13 175.732 0.400 A 97 LEU CA C 13 52.332 0.400 A 97 LEU CB C 13 45.712 0.400 A 97 LEU CD1 C 13 24.245 0.400 A 97 LEU CD2 C 13 26.660 0.400 A 97 LEU CG C 13 27.254 0.400 A 97 LEU N N 15 131.415 0.400 A 98 GLU H H 1 9.734 0.020 A 98 GLU HA H 1 5.303 0.020 A 98 GLU HBy H 1 1.971 0.020 A 98 GLU HBx H 1 1.912 0.020 A 98 GLU HGx H 1 2.137 0.020 A 98 GLU HGy H 1 2.137 0.020 A 98 GLU C C 13 175.381 0.400 A 98 GLU CA C 13 54.374 0.400 A 98 GLU CB C 13 33.760 0.400 A 98 GLU CG C 13 37.350 0.400 A 98 GLU N N 15 125.278 0.400 A 99 ILE H H 1 9.148 0.020 A 99 ILE HA H 1 5.138 0.020 A 99 ILE HB H 1 1.438 0.020 A 99 ILE HD1% H 1 0.645 0.020 A 99 ILE HG1y H 1 1.169 0.020 A 99 ILE HG1x H 1 1.071 0.020 A 99 ILE HG2% H 1 -0.455 0.020 A 99 ILE C C 13 176.143 0.400 A 99 ILE CA C 13 57.634 0.400 A 99 ILE CB C 13 39.697 0.400 A 99 ILE CD1 C 13 12.876 0.400 A 99 ILE CG1 C 13 27.792 0.400 A 99 ILE CG2 C 13 15.154 0.400 A 99 ILE N N 15 127.155 0.400 A 100 THR H H 1 8.501 0.020 A 100 THR HA H 1 5.245 0.020 A 100 THR HB H 1 3.964 0.020 A 100 THR HG2% H 1 1.045 0.020 A 100 THR C C 13 172.275 0.400 A 100 THR CA C 13 61.295 0.400 A 100 THR CB C 13 70.925 0.400 A 100 THR CG2 C 13 21.235 0.400 A 100 THR N N 15 122.083 0.400 A 101 ASP H H 1 8.595 0.020 A 101 ASP HA H 1 5.361 0.020 A 101 ASP HBy H 1 2.760 0.020 A 101 ASP HBx H 1 2.510 0.020 A 101 ASP C C 13 173.564 0.400 A 101 ASP CA C 13 52.368 0.400 A 101 ASP CB C 13 44.752 0.400 A 101 ASP N N 15 125.979 0.400 A 102 PHE H H 1 10.504 0.020 A 102 PHE HA H 1 5.477 0.020 A 102 PHE HBy H 1 2.894 0.020 A 102 PHE HBx H 1 2.629 0.020 A 102 PHE HD1 H 1 7.381 0.020 A 102 PHE HD2 H 1 7.381 0.020 A 102 PHE C C 13 175.029 0.400 A 102 PHE CA C 13 56.932 0.400 A 102 PHE CB C 13 43.741 0.400 A 102 PHE CD1 C 13 131.644 0.400 A 102 PHE N N 15 119.081 0.400 A 103 SER H H 1 8.985 0.020 A 103 SER HA H 1 4.749 0.020 A 103 SER HBy H 1 3.901 0.020 A 103 SER HBx H 1 3.441 0.020 A 103 SER C C 13 175.146 0.400 A 103 SER CA C 13 57.067 0.400 A 103 SER CB C 13 67.120 0.400 A 103 SER N N 15 112.365 0.400 A 104 GLU H H 1 9.521 0.020 A 104 GLU HA H 1 4.616 0.020 A 104 GLU HBx H 1 2.307 0.020 A 104 GLU HBy H 1 2.307 0.020 A 104 GLU HGy H 1 2.422 0.020 A 104 GLU HGx H 1 2.336 0.020 A 104 GLU C C 13 179.952 0.400 A 104 GLU CA C 13 57.985 0.400 A 104 GLU CB C 13 29.572 0.400 A 104 GLU CG C 13 37.129 0.400 A 104 GLU N N 15 126.723 0.400 A 105 ALA H H 1 9.390 0.020 A 105 ALA HA H 1 4.037 0.020 A 105 ALA HB% H 1 1.512 0.020 A 105 ALA C C 13 179.952 0.400 A 105 ALA CA C 13 56.164 0.400 A 105 ALA CB C 13 18.448 0.400 A 105 ALA N N 15 129.298 0.400 A 106 ASP H H 1 8.848 0.020 A 106 ASP HA H 1 4.525 0.020 A 106 ASP HBx H 1 2.762 0.020 A 106 ASP HBy H 1 2.762 0.020 A 106 ASP C C 13 176.553 0.400 A 106 ASP CA C 13 55.929 0.400 A 106 ASP CB C 13 39.929 0.400 A 106 ASP N N 15 114.724 0.400 A 107 GLU H H 1 7.427 0.020 A 107 GLU HA H 1 4.699 0.020 A 107 GLU HBy H 1 2.356 0.020 A 107 GLU HBx H 1 1.769 0.020 A 107 GLU HGx H 1 2.237 0.020 A 107 GLU HGy H 1 2.237 0.020 A 107 GLU C C 13 176.436 0.400 A 107 GLU CA C 13 55.577 0.400 A 107 GLU CB C 13 31.202 0.400 A 107 GLU CG C 13 36.107 0.400 A 107 GLU N N 15 116.960 0.400 A 108 ALA H H 1 7.325 0.020 A 108 ALA HA H 1 4.070 0.020 A 108 ALA HB% H 1 1.416 0.020 A 108 ALA C C 13 179.366 0.400 A 108 ALA CA C 13 55.878 0.400 A 108 ALA CB C 13 18.625 0.400 A 108 ALA N N 15 123.736 0.400 A 109 ASP H H 1 8.603 0.020 A 109 ASP HA H 1 4.417 0.020 A 109 ASP HBx H 1 2.671 0.020 A 109 ASP HBy H 1 2.671 0.020 A 109 ASP C C 13 178.956 0.400 A 109 ASP CA C 13 57.784 0.400 A 109 ASP CB C 13 39.578 0.400 A 109 ASP N N 15 117.973 0.400 A 110 ASP H H 1 7.987 0.020 A 110 ASP HA H 1 4.326 0.020 A 110 ASP HBy H 1 2.704 0.020 A 110 ASP HBx H 1 2.563 0.020 A 110 ASP C C 13 178.721 0.400 A 110 ASP CA C 13 57.132 0.400 A 110 ASP CB C 13 40.030 0.400 A 110 ASP N N 15 121.058 0.400 A 111 LEU H H 1 7.859 0.020 A 111 LEU HA H 1 4.252 0.020 A 111 LEU HB2 H 1 1.661 0.020 A 111 LEU HB3 H 1 1.984 0.020 A 111 LEU HDx% H 1 1.018 0.020 A 111 LEU HDy% H 1 1.018 0.020 A 111 LEU HG H 1 1.013 0.020 A 111 LEU C C 13 178.663 0.400 A 111 LEU CA C 13 57.534 0.400 A 111 LEU CB C 13 41.735 0.400 A 111 LEU CD1 C 13 27.761 0.400 A 111 LEU CG C 13 26.165 0.400 A 111 LEU N N 15 123.156 0.400 A 112 LYS H H 1 8.339 0.020 A 112 LYS HA H 1 4.086 0.020 A 112 LYS HBy H 1 2.083 0.020 A 112 LYS HBx H 1 2.025 0.020 A 112 LYS HDy H 1 1.915 0.020 A 112 LYS HDx H 1 1.753 0.020 A 112 LYS HEx H 1 2.976 0.020 A 112 LYS HEy H 1 2.976 0.020 A 112 LYS HGy H 1 1.745 0.020 A 112 LYS HGx H 1 1.436 0.020 A 112 LYS C C 13 177.725 0.400 A 112 LYS CA C 13 60.543 0.400 A 112 LYS CB C 13 32.256 0.400 A 112 LYS CD C 13 29.256 0.400 A 112 LYS CE C 13 42.212 0.400 A 112 LYS CG C 13 25.724 0.400 A 112 LYS N N 15 119.047 0.400 A 113 GLU H H 1 7.895 0.020 A 113 GLU HA H 1 4.078 0.020 A 113 GLU HBx H 1 2.133 0.020 A 113 GLU HBy H 1 2.133 0.020 A 113 GLU HGx H 1 2.472 0.020 A 113 GLU HGy H 1 2.472 0.020 A 113 GLU C C 13 179.456 0.400 A 113 GLU CA C 13 59.540 0.400 A 113 GLU CB C 13 29.347 0.400 A 113 GLU CG C 13 36.320 0.400 A 113 GLU N N 15 117.433 0.400 A 114 LEU H H 1 7.811 0.020 A 114 LEU HA H 1 4.053 0.020 A 114 LEU HBy H 1 1.827 0.020 A 114 LEU HBx H 1 1.437 0.020 A 114 LEU HD1% H 1 0.354 0.020 A 114 LEU HD2% H 1 0.487 0.020 A 114 LEU HG H 1 1.124 0.020 A 114 LEU C C 13 179.717 0.400 A 114 LEU CA C 13 58.236 0.400 A 114 LEU CB C 13 40.982 0.400 A 114 LEU CD1 C 13 24.762 0.400 A 114 LEU CD2 C 13 22.786 0.400 A 114 LEU CG C 13 26.213 0.400 A 114 LEU N N 15 122.630 0.400 A 115 TRP H H 1 8.501 0.020 A 115 TRP HA H 1 4.798 0.020 A 115 TRP HBy H 1 3.490 0.020 A 115 TRP HBx H 1 3.242 0.020 A 115 TRP HD1 H 1 6.875 0.020 A 115 TRP HE1 H 1 9.800 0.020 A 115 TRP HZ2 H 1 7.195 0.020 A 115 TRP C C 13 179.307 0.400 A 115 TRP CA C 13 61.646 0.400 A 115 TRP CB C 13 29.497 0.400 A 115 TRP CD1 C 13 128.534 0.400 A 115 TRP CZ2 C 13 114.294 0.400 A 115 TRP N N 15 121.158 0.400 A 115 TRP NE1 N 15 129.578 0.400 A 116 ASP H H 1 9.258 0.020 A 116 ASP HA H 1 4.492 0.020 A 116 ASP HBy H 1 3.076 0.020 A 116 ASP HBx H 1 2.778 0.020 A 116 ASP C C 13 180.128 0.400 A 116 ASP CA C 13 57.985 0.400 A 116 ASP CB C 13 40.531 0.400 A 116 ASP N N 15 118.557 0.400 A 117 SER H H 1 8.174 0.020 A 117 SER HA H 1 4.351 0.020 A 117 SER HBx H 1 4.119 0.020 A 117 SER HBy H 1 4.119 0.020 A 117 SER C C 13 177.490 0.400 A 117 SER CA C 13 61.395 0.400 A 117 SER CB C 13 62.699 0.400 A 117 SER N N 15 116.645 0.400 A 118 GLN H H 1 8.520 0.020 A 118 GLN HA H 1 4.484 0.020 A 118 GLN HBy H 1 2.737 0.020 A 118 GLN HBx H 1 2.431 0.020 A 118 GLN HE2y H 1 6.132 0.020 A 118 GLN HE2x H 1 4.928 0.020 A 118 GLN HGx H 1 2.137 0.020 A 118 GLN HGy H 1 2.137 0.020 A 118 GLN C C 13 179.307 0.400 A 118 GLN CA C 13 59.289 0.400 A 118 GLN CB C 13 28.394 0.400 A 118 GLN CG C 13 33.704 0.400 A 118 GLN N N 15 124.510 0.400 A 118 GLN NE2 N 15 107.197 0.400 A 119 VAL H H 1 9.558 0.020 A 119 VAL HA H 1 3.492 0.020 A 119 VAL HB H 1 1.644 0.020 A 119 VAL HGx% H 1 0.672 0.020 A 119 VAL HGy% H 1 0.230 0.020 A 119 VAL C C 13 178.077 0.400 A 119 VAL CA C 13 66.699 0.400 A 119 VAL CB C 13 30.851 0.400 A 119 VAL CG1 C 13 23.338 0.400 A 119 VAL CG2 C 13 20.683 0.400 A 119 VAL N N 15 121.614 0.400 A 120 SER H H 1 8.130 0.020 A 120 SER HA H 1 4.095 0.020 A 120 SER HBx H 1 4.095 0.020 A 120 SER HBy H 1 4.095 0.020 A 120 SER C C 13 177.373 0.400 A 120 SER CA C 13 62.549 0.400 A 120 SER CB C 13 67.615 0.400 A 120 SER N N 15 115.559 0.400 A 121 LYS H H 1 7.419 0.020 A 121 LYS HA H 1 4.199 0.020 A 121 LYS HBy H 1 2.560 0.020 A 121 LYS HBx H 1 2.323 0.020 A 121 LYS C C 13 179.366 0.400 A 121 LYS CA C 13 59.905 0.400 A 121 LYS CB C 13 32.564 0.400 A 121 LYS N N 15 121.080 0.400 A 122 LEU H H 1 8.152 0.020 A 122 LEU HA H 1 3.714 0.020 A 122 LEU HBy H 1 1.726 0.020 A 122 LEU HBx H 1 0.619 0.020 A 122 LEU HD1% H 1 -0.227 0.020 A 122 LEU HD2% H 1 -0.316 0.020 A 122 LEU HG H 1 1.438 0.020 A 122 LEU C C 13 178.487 0.400 A 122 LEU CA C 13 57.583 0.400 A 122 LEU CB C 13 39.984 0.400 A 122 LEU CD1 C 13 25.598 0.400 A 122 LEU CD2 C 13 21.415 0.400 A 122 LEU CG C 13 25.992 0.400 A 122 LEU N N 15 125.251 0.400 A 123 ARG H H 1 8.592 0.020 A 123 ARG HA H 1 4.805 0.020 A 123 ARG HBx H 1 1.878 0.020 A 123 ARG HBy H 1 1.878 0.020 A 123 ARG C C 13 178.838 0.400 A 123 ARG CA C 13 60.026 0.400 A 123 ARG CB C 13 30.132 0.400 A 123 ARG CD C 13 41.618 0.400 A 123 ARG CG C 13 28.373 0.400 A 123 ARG N N 15 117.150 0.400 A 124 ARG H H 1 7.331 0.020 A 124 ARG HA H 1 4.215 0.020 A 124 ARG HBx H 1 2.057 0.020 A 124 ARG HBy H 1 2.057 0.020 A 124 ARG HDx H 1 3.280 0.020 A 124 ARG HDy H 1 3.280 0.020 A 124 ARG HGy H 1 1.841 0.020 A 124 ARG HGx H 1 1.696 0.020 A 124 ARG C C 13 178.604 0.400 A 124 ARG CA C 13 58.430 0.400 A 124 ARG CB C 13 29.952 0.400 A 124 ARG CD C 13 43.384 0.400 A 124 ARG CG C 13 27.416 0.400 A 124 ARG N N 15 117.003 0.400 A 125 THR H H 1 8.097 0.020 A 125 THR HA H 1 4.150 0.020 A 125 THR HB H 1 4.314 0.020 A 125 THR HG2% H 1 1.395 0.020 A 125 THR C C 13 176.213 0.400 A 125 THR CA C 13 65.507 0.400 A 125 THR CB C 13 69.319 0.400 A 125 THR CG2 C 13 21.712 0.400 A 125 THR N N 15 116.162 0.400 A 126 CYS H H 1 8.064 0.020 A 126 CYS HA H 1 4.815 0.020 A 126 CYS HBx H 1 2.845 0.020 A 126 CYS HBy H 1 2.845 0.020 A 126 CYS C C 13 175.850 0.400 A 126 CYS CA C 13 61.044 0.400 A 126 CYS CB C 13 27.430 0.400 A 126 CYS N N 15 115.989 0.400 A 127 GLY H H 1 9.514 0.020 A 127 GLY HAy H 1 4.037 0.020 A 127 GLY HAx H 1 3.807 0.020 A 127 GLY C C 13 174.033 0.400 A 127 GLY CA C 13 45.595 0.400 A 127 GLY N N 15 111.287 0.400 A 128 PHE H H 1 7.948 0.020 A 128 PHE HA H 1 4.633 0.020 A 128 PHE HBx H 1 3.101 0.020 A 128 PHE HBy H 1 3.101 0.020 A 128 PHE HD1 H 1 7.224 0.020 A 128 PHE HD2 H 1 7.224 0.020 A 128 PHE C C 13 175.850 0.400 A 128 PHE CA C 13 57.985 0.400 A 128 PHE CB C 13 39.578 0.400 A 128 PHE CD1 C 13 131.892 0.400 A 128 PHE N N 15 120.050 0.400 A 129 LEU H H 1 8.244 0.020 A 129 LEU HA H 1 4.277 0.020 A 129 LEU HBy H 1 1.545 0.020 A 129 LEU HBx H 1 1.479 0.020 A 129 LEU HDx% H 1 0.898 0.020 A 129 LEU HDy% H 1 0.850 0.020 A 129 LEU C C 13 177.139 0.400 A 129 LEU CA C 13 55.277 0.400 A 129 LEU CB C 13 42.688 0.400 A 129 LEU CD1 C 13 25.061 0.400 A 129 LEU CD2 C 13 23.369 0.400 A 129 LEU CG C 13 26.754 0.400 A 129 LEU N N 15 123.003 0.400 A 130 GLU H H 1 8.254 0.020 A 130 GLU HA H 1 4.142 0.020 A 130 GLU HBx H 1 1.889 0.020 A 130 GLU HBy H 1 1.889 0.020 A 130 GLU HGx H 1 2.160 0.020 A 130 GLU HGy H 1 2.160 0.020 A 130 GLU CA C 13 56.881 0.400 A 130 GLU CB C 13 30.350 0.400 A 130 GLU CG C 13 36.314 0.400 A 130 GLU N N 15 120.407 0.400 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 54 GLN H A 54 GLN HGx 1.0 0.0 3.40 2 1 A 54 GLN H A 54 GLN HGy 1.0 0.0 3.40 3 2 A 59 ILE H A 59 ILE HB 1.0 0.0 3.52 4 3 A 3 LYS H A 3 LYS HGx 1.0 0.0 4.73 5 4 A 4 GLU H A 104 GLU HA 1.0 0.0 4.67 6 5 A 4 GLU H A 3 LYS HA 1.0 0.0 3.28 7 6 A 4 GLU H A 4 GLU HGx 1.0 0.0 4.11 8 6 A 4 GLU H A 4 GLU HGy 1.0 0.0 4.11 9 7 A 4 GLU H A 3 LYS HBy 1.0 0.0 4.05 10 8 A 4 GLU H A 3 LYS HBx 1.0 0.0 4.05 11 9 A 4 GLU HA A 5 LYS H 1.0 0.0 3.04 12 10 A 5 LYS H A 4 GLU HGx 1.0 0.0 4.33 13 10 A 4 GLU HGy A 5 LYS H 1.0 0.0 4.33 14 11 A 5 LYS H A 4 GLU HBy 1.0 0.0 4.55 15 12 A 5 LYS H A 5 LYS HBy 1.0 0.0 3.60 16 13 A 5 LYS H A 5 LYS HBx 1.0 0.0 3.60 17 14 A 6 ILE H A 102 PHE HA 1.0 0.0 4.17 18 15 A 98 GLU HA A 99 ILE H 1.0 0.0 3.43 19 16 A 6 ILE H A 5 LYS HA 1.0 0.0 3.37 20 17 A 6 ILE H A 5 LYS HDx 1.0 0.0 4.59 21 17 A 6 ILE H A 5 LYS HDy 1.0 0.0 4.59 22 18 A 6 ILE H A 6 ILE HG12 1.0 0.0 4.37 23 19 A 6 ILE H A 5 LYS HGy 1.0 0.0 4.57 24 20 A 6 ILE HA A 7 HIS H 1.0 0.0 3.09 25 21 A 7 HIS H A 7 HIS HBy 1.0 0.0 4.02 26 22 A 7 HIS H A 7 HIS HBx 1.0 0.0 4.02 27 23 A 7 HIS H A 6 ILE HB 1.0 0.0 3.94 28 24 A 129 LEU H A 129 LEU HBy 1.0 0.0 4.27 29 25 A 7 HIS H A 6 ILE HG13 1.0 0.0 4.77 30 26 A 46 THR HA A 47 PHE H 1.0 0.0 3.39 31 27 A 8 LEU H A 8 LEU HB2 1.0 0.0 3.85 32 28 A 8 LEU H A 8 LEU HDx% 1.0 0.0 4.17 33 28 A 8 LEU H A 8 LEU HDy% 1.0 0.0 4.17 34 29 A 8 LEU HA A 9 GLU H 1.0 0.0 3.09 35 30 A 31 GLU H A 31 GLU HGy 1.0 0.0 3.96 36 31 A 31 GLU H A 31 GLU HBy 1.0 0.0 3.97 37 32 A 31 GLU H A 31 GLU HGx 1.0 0.0 3.96 38 33 A 9 GLU H A 9 GLU HBx 1.0 0.0 3.55 39 33 A 9 GLU H A 9 GLU HBy 1.0 0.0 3.55 40 34 A 9 GLU H A 8 LEU HB3 1.0 0.0 4.02 41 35 A 9 GLU H A 8 LEU HDx% 1.0 0.0 4.03 42 35 A 8 LEU HDy% A 9 GLU H 1.0 0.0 4.03 43 36 A 10 TYR H A 97 LEU H 1.0 0.0 4.14 44 37 A 10 TYR H A 10 TYR HD% 1.0 0.0 4.08 45 38 A 10 TYR H A 9 GLU HA 1.0 0.0 3.28 46 39 A 10 TYR H A 9 GLU HGx 1.0 0.0 4.27 47 39 A 10 TYR H A 9 GLU HGy 1.0 0.0 4.27 48 40 A 10 TYR H A 99 ILE HD1% 1.0 0.0 4.85 49 41 A 10 TYR HA A 11 LEU H 1.0 0.0 3.26 50 42 A 11 LEU H A 10 TYR HBy 1.0 0.0 4.65 51 43 A 11 LEU H A 10 TYR HBx 1.0 0.0 4.65 52 44 A 11 LEU H A 11 LEU HBy 1.0 0.0 3.96 53 45 A 11 LEU H A 11 LEU HG 1.0 0.0 4.00 54 46 A 11 LEU H A 11 LEU HBx 1.0 0.0 3.96 55 47 A 11 LEU H A 11 LEU HDx% 1.0 0.0 4.17 56 47 A 11 LEU H A 11 LEU HDy% 1.0 0.0 4.17 57 48 A 11 LEU HA A 12 LEU H 1.0 0.0 3.28 58 49 A 12 LEU H A 12 LEU HDx% 1.0 0.0 4.04 59 49 A 12 LEU H A 12 LEU HDy% 1.0 0.0 4.04 60 50 A 12 LEU H A 97 LEU HD2% 1.0 0.0 5.06 61 51 A 43 LYS H A 44 THR H 1.0 0.0 3.48 62 52 A 43 LYS H A 59 ILE HD1% 1.0 0.0 4.74 63 53 A 13 ASN HA A 14 ALA H 1.0 0.0 3.64 64 54 A 129 LEU H A 128 PHE HA 1.0 0.0 3.51 65 55 A 14 ALA H A 14 ALA HB% 1.0 0.0 3.85 66 56 A 14 ALA HB% A 15 THR H 1.0 0.0 4.03 67 57 A 15 THR H A 15 THR HG2% 1.0 0.0 4.59 68 58 A 19 ILE H A 20 LEU H 1.0 0.0 4.12 69 59 A 19 ILE H A 19 ILE HG1y 1.0 0.0 4.09 70 60 A 19 ILE H A 19 ILE HG1x 1.0 0.0 4.09 71 61 A 20 LEU H A 22 SER H 1.0 0.0 5.22 72 62 A 20 LEU H A 20 LEU HB2 1.0 0.0 4.26 73 63 A 20 LEU HB3 A 21 TRP HE1 1.0 0.0 4.77 74 64 A 20 LEU H A 21 TRP H 1.0 0.0 4.05 75 65 A 22 SER H A 22 SER HBx 1.0 0.0 4.06 76 66 A 21 TRP H A 21 TRP HB3 1.0 0.0 3.87 77 67 A 21 TRP H A 21 TRP HB2 1.0 0.0 3.79 78 68 A 20 LEU HB2 A 21 TRP H 1.0 0.0 4.12 79 69 A 20 LEU HB3 A 21 TRP H 1.0 0.0 4.40 80 70 A 22 SER H A 23 ALA HB% 1.0 0.0 4.73 81 71 A 22 SER H A 23 ALA H 1.0 0.0 3.78 82 72 A 23 ALA H A 24 ILE H 1.0 0.0 3.82 83 73 A 53 GLU H A 53 GLU HBx 1.0 0.0 3.16 84 73 A 53 GLU H A 53 GLU HBy 1.0 0.0 3.16 85 74 A 114 LEU H A 114 LEU HBy 1.0 0.0 3.72 86 75 A 24 ILE H A 25 SER H 1.0 0.0 3.91 87 76 A 23 ALA HB% A 24 ILE H 1.0 0.0 3.98 88 77 A 24 ILE H A 24 ILE HG2% 1.0 0.0 3.66 89 78 A 23 ALA H A 25 SER H 1.0 0.0 4.83 90 79 A 92 THR H A 92 THR HG2% 1.0 0.0 3.72 91 80 A 25 SER H A 24 ILE HG2% 1.0 0.0 4.61 92 81 A 25 SER H A 24 ILE HD1% 1.0 0.0 4.94 93 82 A 25 SER H A 26 THR H 1.0 0.0 3.61 94 83 A 26 THR H A 29 GLY HA3 1.0 0.0 4.65 95 84 A 26 THR H A 68 ILE HD1% 1.0 0.0 4.95 96 85 A 26 THR HA A 28 THR H 1.0 0.0 5.06 97 86 A 28 THR H A 26 THR HB 1.0 0.0 4.13 98 87 A 28 THR H A 28 THR HB 1.0 0.0 3.89 99 88 A 28 THR H A 27 PRO HBx 1.0 0.0 3.55 100 88 A 28 THR H A 27 PRO HBy 1.0 0.0 3.55 101 89 A 29 GLY H A 30 LEU H 1.0 0.0 3.83 102 90 A 28 THR H A 29 GLY H 1.0 0.0 3.97 103 91 A 26 THR HB A 29 GLY H 1.0 0.0 4.49 104 92 A 99 ILE HA A 100 THR H 1.0 0.0 3.43 105 93 A 90 GLU H A 90 GLU HBx 1.0 0.0 3.53 106 93 A 90 GLU H A 90 GLU HBy 1.0 0.0 3.53 107 94 A 30 LEU H A 30 LEU HB2 1.0 0.0 4.19 108 95 A 30 LEU H A 38 VAL HG1% 1.0 0.0 5.69 109 96 A 31 GLU H A 30 LEU H 1.0 0.0 3.90 110 97 A 31 GLU H A 28 THR HA 1.0 0.0 4.53 111 98 A 112 LYS H A 113 GLU H 1.0 0.0 3.68 112 99 A 32 ASP H A 33 TRP HD1 1.0 0.0 4.65 113 100 A 32 ASP H A 32 ASP HBx 1.0 0.0 3.37 114 100 A 32 ASP H A 32 ASP HBy 1.0 0.0 3.37 115 101 A 113 GLU H A 113 GLU HBx 1.0 0.0 3.14 116 101 A 113 GLU H A 113 GLU HBy 1.0 0.0 3.14 117 102 A 24 ILE HA A 33 TRP HE1 1.0 0.0 4.16 118 103 A 33 TRP HE1 A 30 LEU HA 1.0 0.0 3.86 119 104 A 23 ALA HB% A 33 TRP HE1 1.0 0.0 4.00 120 105 A 32 ASP H A 33 TRP H 1.0 0.0 3.59 121 106 A 30 LEU HA A 33 TRP H 1.0 0.0 4.58 122 107 A 33 TRP H A 34 PHE HB3 1.0 0.0 4.64 123 108 A 30 LEU HA A 34 PHE H 1.0 0.0 5.78 124 109 A 34 PHE H A 35 ALA HA 1.0 0.0 5.78 125 110 A 34 PHE H A 34 PHE HB2 1.0 0.0 4.03 126 111 A 34 PHE HB3 A 34 PHE H 1.0 0.0 3.96 127 112 A 123 ARG H A 124 ARG H 1.0 0.0 4.06 128 113 A 124 ARG H A 125 THR H 1.0 0.0 3.71 129 114 A 124 ARG H A 121 LYS HA 1.0 0.0 3.87 130 115 A 124 ARG H A 124 ARG HBx 1.0 0.0 3.27 131 115 A 124 ARG H A 124 ARG HBy 1.0 0.0 3.27 132 116 A 124 ARG H A 124 ARG HGy 1.0 0.0 4.19 133 117 A 34 PHE HB3 A 35 ALA H 1.0 0.0 4.44 134 118 A 35 ALA H A 35 ALA HB% 1.0 0.0 3.66 135 119 A 36 ASP H A 49 TRP HE1 1.0 0.0 4.67 136 120 A 36 ASP H A 37 LYS H 1.0 0.0 3.54 137 121 A 36 ASP H A 36 ASP HBx 1.0 0.0 3.63 138 121 A 36 ASP H A 36 ASP HBy 1.0 0.0 3.63 139 122 A 37 LYS H A 38 VAL H 1.0 0.0 4.83 140 123 A 37 LYS H A 47 PHE HB3 1.0 0.0 5.78 141 124 A 37 LYS H A 36 ASP HBx 1.0 0.0 3.62 142 124 A 37 LYS H A 36 ASP HBy 1.0 0.0 3.62 143 125 A 35 ALA HB% A 37 LYS H 1.0 0.0 4.01 144 126 A 38 VAL H A 37 LYS HA 1.0 0.0 3.23 145 127 A 38 VAL H A 31 GLU HGy 1.0 0.0 4.57 146 128 A 38 VAL H A 37 LYS HGy 1.0 0.0 4.69 147 129 A 38 VAL H A 38 VAL HG2% 1.0 0.0 4.86 148 130 A 39 VAL H A 46 THR H 1.0 0.0 4.11 149 131 A 39 VAL H A 38 VAL HA 1.0 0.0 3.32 150 132 A 39 VAL H A 46 THR HB 1.0 0.0 4.37 151 133 A 39 VAL HA A 40 SER H 1.0 0.0 3.55 152 134 A 40 SER H A 40 SER HBx 1.0 0.0 4.01 153 134 A 40 SER H A 40 SER HBy 1.0 0.0 4.01 154 135 A 44 THR H A 41 ASP H 1.0 0.0 4.20 155 136 A 41 ASP H A 42 ASP H 1.0 0.0 4.45 156 137 A 41 ASP H A 40 SER HA 1.0 0.0 3.24 157 138 A 41 ASP H A 40 SER HBx 1.0 0.0 4.02 158 138 A 40 SER HBy A 41 ASP H 1.0 0.0 4.02 159 139 A 42 ASP H A 41 ASP HBy 1.0 0.0 4.81 160 140 A 58 GLY H A 71 HIS H 1.0 0.0 4.17 161 141 A 71 HIS H A 70 PHE HA 1.0 0.0 3.54 162 142 A 71 HIS H A 71 HIS HBx 1.0 0.0 3.99 163 142 A 71 HIS H A 71 HIS HBy 1.0 0.0 3.99 164 143 A 71 HIS H A 70 PHE HBx 1.0 0.0 3.96 165 143 A 71 HIS H A 70 PHE HBy 1.0 0.0 3.96 166 144 A 71 HIS H A 60 VAL HGx% 1.0 0.0 3.93 167 144 A 71 HIS H A 60 VAL HGy% 1.0 0.0 3.93 168 145 A 45 VAL H A 57 ALA H 1.0 0.0 4.09 169 146 A 103 SER HA A 104 GLU H 1.0 0.0 3.30 170 147 A 45 VAL H A 45 VAL HG1% 1.0 0.0 4.58 171 148 A 72 TRP HA A 73 LEU H 1.0 0.0 3.73 172 149 A 46 THR H A 45 VAL HA 1.0 0.0 3.30 173 150 A 46 THR H A 46 THR HB 1.0 0.0 3.86 174 151 A 73 LEU H A 73 LEU HB3 1.0 0.0 4.01 175 152 A 73 LEU H A 73 LEU HB2 1.0 0.0 3.73 176 153 A 46 THR H A 45 VAL HG1% 1.0 0.0 4.58 177 154 A 47 PHE H A 55 ARG H 1.0 0.0 4.37 178 155 A 47 PHE H A 47 PHE HD% 1.0 0.0 4.16 179 156 A 47 PHE H A 56 GLN HA 1.0 0.0 4.46 180 157 A 47 PHE H A 47 PHE HB2 1.0 0.0 4.18 181 158 A 117 SER H A 118 GLN H 1.0 0.0 3.77 182 159 A 37 LYS H A 48 CYS H 1.0 0.0 4.25 183 160 A 47 PHE HD% A 48 CYS H 1.0 0.0 4.57 184 161 A 48 CYS H A 47 PHE HA 1.0 0.0 3.31 185 162 A 117 SER H A 117 SER HBx 1.0 0.0 3.32 186 162 A 117 SER H A 117 SER HBy 1.0 0.0 3.32 187 163 A 47 PHE HB3 A 48 CYS H 1.0 0.0 4.16 188 164 A 35 ALA HB% A 48 CYS H 1.0 0.0 4.00 189 165 A 35 ALA HA A 49 TRP HE1 1.0 0.0 3.43 190 166 A 35 ALA HB% A 49 TRP HE1 1.0 0.0 3.85 191 167 A 54 GLN H A 53 GLU H 1.0 0.0 4.05 192 168 A 114 LEU H A 115 TRP H 1.0 0.0 3.70 193 169 A 111 LEU H A 111 LEU HB2 1.0 0.0 3.66 194 170 A 114 LEU H A 114 LEU HG 1.0 0.0 4.71 195 171 A 83 GLU HA A 84 ILE H 1.0 0.0 3.55 196 172 A 54 GLN H A 53 GLU HA 1.0 0.0 3.06 197 173 A 84 ILE H A 84 ILE HB 1.0 0.0 3.79 198 174 A 84 ILE H A 84 ILE HG13 1.0 0.0 4.33 199 175 A 55 ARG H A 47 PHE HD% 1.0 0.0 4.65 200 176 A 55 ARG H A 47 PHE HE% 1.0 0.0 5.76 201 177 A 55 ARG H A 54 GLN HA 1.0 0.0 3.35 202 178 A 46 THR HA A 55 ARG H 1.0 0.0 4.67 203 179 A 55 ARG H A 54 GLN HGx 1.0 0.0 4.50 204 179 A 54 GLN HGy A 55 ARG H 1.0 0.0 4.50 205 180 A 55 ARG H A 55 ARG HBy 1.0 0.0 4.24 206 181 A 55 ARG H A 55 ARG HBx 1.0 0.0 4.24 207 182 A 55 ARG H A 46 THR HG2% 1.0 0.0 4.35 208 183 A 56 GLN HE2y A 56 GLN HGx 1.0 0.0 3.94 209 183 A 56 GLN HGy A 56 GLN HE2y 1.0 0.0 3.94 210 184 A 56 GLN HE2y A 44 THR HG2% 1.0 0.0 4.51 211 185 A 46 THR HG2% A 56 GLN HE2y 1.0 0.0 4.87 212 186 A 55 ARG HA A 56 GLN H 1.0 0.0 3.33 213 187 A 56 GLN H A 56 GLN HGx 1.0 0.0 3.90 214 187 A 56 GLN HGy A 56 GLN H 1.0 0.0 3.90 215 188 A 56 GLN H A 56 GLN HB2 1.0 0.0 3.90 216 189 A 56 GLN H A 55 ARG HBy 1.0 0.0 4.67 217 190 A 56 GLN H A 55 ARG HBx 1.0 0.0 4.67 218 191 A 46 THR HG2% A 56 GLN H 1.0 0.0 5.16 219 192 A 56 GLN HE2x A 56 GLN HGx 1.0 0.0 3.94 220 192 A 56 GLN HGy A 56 GLN HE2x 1.0 0.0 3.94 221 193 A 44 THR HG2% A 56 GLN HE2x 1.0 0.0 4.51 222 194 A 46 THR HG2% A 56 GLN HE2x 1.0 0.0 4.87 223 195 A 57 ALA H A 56 GLN HA 1.0 0.0 3.42 224 196 A 46 THR HA A 57 ALA H 1.0 0.0 4.45 225 197 A 57 ALA H A 56 GLN HB2 1.0 0.0 4.87 226 198 A 57 ALA H A 56 GLN HB3 1.0 0.0 4.24 227 199 A 58 GLY H A 57 ALA HA 1.0 0.0 3.74 228 200 A 58 GLY H A 73 LEU HB2 1.0 0.0 5.18 229 201 A 59 ILE H A 59 ILE HD1% 1.0 0.0 3.82 230 202 A 70 PHE HA A 60 VAL H 1.0 0.0 4.13 231 203 A 60 VAL H A 59 ILE HA 1.0 0.0 3.45 232 204 A 60 VAL H A 60 VAL HB 1.0 0.0 3.93 233 205 A 60 VAL H A 69 ARG HGx 1.0 0.0 5.78 234 205 A 60 VAL H A 69 ARG HGy 1.0 0.0 5.78 235 206 A 60 VAL H A 61 ALA H 1.0 0.0 3.48 236 207 A 61 ALA H A 69 ARG H 1.0 0.0 4.33 237 208 A 61 ALA H A 62 ILE H 1.0 0.0 4.60 238 209 A 61 ALA H A 69 ARG HGx 1.0 0.0 4.35 239 209 A 69 ARG HGy A 61 ALA H 1.0 0.0 4.35 240 210 A 61 ALA H A 60 VAL HGx% 1.0 0.0 3.83 241 210 A 60 VAL HGy% A 61 ALA H 1.0 0.0 3.83 242 211 A 112 LYS H A 111 LEU H 1.0 0.0 3.62 243 212 A 62 ILE H A 61 ALA HA 1.0 0.0 3.04 244 213 A 112 LYS H A 111 LEU HB3 1.0 0.0 3.33 245 214 A 62 ILE H A 61 ALA HB% 1.0 0.0 3.46 246 215 A 63 ARG H A 67 PHE HD% 1.0 0.0 4.66 247 216 A 63 ARG H A 67 PHE HE% 1.0 0.0 4.99 248 217 A 88 TYR HA A 89 ASN H 1.0 0.0 3.27 249 218 A 89 ASN H A 89 ASN HBy 1.0 0.0 3.99 250 219 A 63 ARG H A 62 ILE HB 1.0 0.0 4.16 251 220 A 63 ARG H A 68 ILE HG13 1.0 0.0 5.18 252 221 A 63 ARG H A 62 ILE HD1% 1.0 0.0 3.89 253 222 A 66 SER H A 66 SER HB2 1.0 0.0 3.99 254 223 A 66 SER H A 65 TYR H 1.0 0.0 3.86 255 224 A 66 SER H A 64 ALA HB% 1.0 0.0 4.50 256 225 A 66 SER H A 67 PHE H 1.0 0.0 3.56 257 226 A 67 PHE HD% A 67 PHE H 1.0 0.0 4.25 258 227 A 67 PHE H A 65 TYR HD% 1.0 0.0 5.44 259 228 A 66 SER HB2 A 67 PHE H 1.0 0.0 4.04 260 229 A 65 TYR H A 67 PHE H 1.0 0.0 4.79 261 230 A 67 PHE HD% A 68 ILE H 1.0 0.0 4.57 262 231 A 68 ILE H A 67 PHE HA 1.0 0.0 3.63 263 232 A 68 ILE H A 85 LYS HA 1.0 0.0 4.50 264 233 A 68 ILE H A 67 PHE HB2 1.0 0.0 4.59 265 234 A 68 ILE H A 69 ARG HDx 1.0 0.0 5.23 266 234 A 68 ILE H A 69 ARG HDy 1.0 0.0 5.23 267 235 A 68 ILE H A 67 PHE HB3 1.0 0.0 4.18 268 236 A 69 ARG H A 67 PHE HD% 1.0 0.0 5.47 269 237 A 69 ARG H A 68 ILE HA 1.0 0.0 3.61 270 238 A 69 ARG H A 62 ILE HA 1.0 0.0 4.61 271 239 A 69 ARG H A 69 ARG HBx 1.0 0.0 4.17 272 239 A 69 ARG H A 69 ARG HBy 1.0 0.0 4.17 273 240 A 69 ARG H A 69 ARG HGx 1.0 0.0 4.70 274 240 A 69 ARG HGy A 69 ARG H 1.0 0.0 4.70 275 241 A 69 ARG H A 68 ILE HG12 1.0 0.0 4.45 276 242 A 70 PHE H A 70 PHE HD% 1.0 0.0 4.34 277 243 A 83 GLU HA A 70 PHE H 1.0 0.0 5.78 278 244 A 70 PHE H A 69 ARG HA 1.0 0.0 3.75 279 245 A 70 PHE H A 60 VAL HGx% 1.0 0.0 4.56 280 245 A 60 VAL HGy% A 70 PHE H 1.0 0.0 4.56 281 246 A 71 HIS H A 70 PHE HD% 1.0 0.0 4.63 282 247 A 71 HIS HA A 72 TRP H 1.0 0.0 3.70 283 248 A 97 LEU H A 96 VAL HA 1.0 0.0 3.33 284 249 A 72 TRP H A 71 HIS HBx 1.0 0.0 4.49 285 249 A 71 HIS HBy A 72 TRP H 1.0 0.0 4.49 286 250 A 73 LEU H A 57 ALA HA 1.0 0.0 4.09 287 251 A 73 LEU H A 57 ALA HB% 1.0 0.0 4.87 288 252 A 12 LEU H A 95 TYR H 1.0 0.0 4.44 289 253 A 73 LEU H A 74 ASP H 1.0 0.0 3.92 290 254 A 74 ASP H A 75 ASP H 1.0 0.0 3.63 291 255 A 95 TYR H A 95 TYR HD% 1.0 0.0 4.04 292 256 A 74 ASP H A 74 ASP HBy 1.0 0.0 4.09 293 257 A 95 TYR H A 95 TYR HB2 1.0 0.0 3.98 294 258 A 74 ASP H A 74 ASP HBx 1.0 0.0 4.09 295 259 A 95 TYR H A 94 ASP HBx 1.0 0.0 4.25 296 260 A 73 LEU HB3 A 74 ASP H 1.0 0.0 4.41 297 261 A 73 LEU HB2 A 74 ASP H 1.0 0.0 4.20 298 262 A 120 SER H A 121 LYS H 1.0 0.0 3.70 299 263 A 75 ASP H A 75 ASP HBy 1.0 0.0 3.83 300 264 A 75 ASP H A 75 ASP HBx 1.0 0.0 3.83 301 265 A 75 ASP HA A 76 GLU H 1.0 0.0 3.43 302 266 A 76 GLU H A 76 GLU HGx 1.0 0.0 5.78 303 267 A 76 GLU H A 76 GLU HBx 1.0 0.0 3.61 304 267 A 76 GLU H A 76 GLU HBy 1.0 0.0 3.61 305 268 A 77 ASN HD2y A 77 ASN HBx 1.0 0.0 4.19 306 268 A 77 ASN HBy A 77 ASN HD2y 1.0 0.0 4.19 307 269 A 75 ASP HA A 77 ASN H 1.0 0.0 4.73 308 270 A 77 ASN H A 77 ASN HBx 1.0 0.0 3.35 309 270 A 77 ASN HBy A 77 ASN H 1.0 0.0 3.35 310 271 A 77 ASN H A 76 GLU HGy 1.0 0.0 5.78 311 272 A 77 ASN H A 76 GLU HGx 1.0 0.0 5.78 312 273 A 77 ASN H A 76 GLU HBx 1.0 0.0 4.45 313 273 A 76 GLU HBy A 77 ASN H 1.0 0.0 4.45 314 274 A 77 ASN HD2x A 77 ASN HBx 1.0 0.0 4.19 315 274 A 77 ASN HBy A 77 ASN HD2x 1.0 0.0 4.19 316 275 A 79 ARG H A 78 GLU HBx 1.0 0.0 4.47 317 275 A 78 GLU HBy A 79 ARG H 1.0 0.0 4.47 318 276 A 79 ARG H A 80 ASP H 1.0 0.0 4.07 319 277 A 80 ASP H A 80 ASP HBy 1.0 0.0 4.39 320 278 A 80 ASP H A 80 ASP HBx 1.0 0.0 4.39 321 279 A 81 TYR H A 102 PHE HD% 1.0 0.0 3.74 322 280 A 81 TYR H A 80 ASP HA 1.0 0.0 3.57 323 281 A 81 TYR H A 80 ASP HBy 1.0 0.0 4.68 324 282 A 81 TYR H A 80 ASP HBx 1.0 0.0 4.68 325 283 A 81 TYR HD% A 82 PHE H 1.0 0.0 4.45 326 284 A 82 PHE H A 82 PHE HD% 1.0 0.0 4.70 327 285 A 82 PHE H A 81 TYR HA 1.0 0.0 3.70 328 286 A 82 PHE H A 81 TYR HBx 1.0 0.0 4.23 329 286 A 82 PHE H A 81 TYR HBy 1.0 0.0 4.23 330 287 A 100 THR H A 83 GLU H 1.0 0.0 4.33 331 288 A 81 TYR HD% A 83 GLU H 1.0 0.0 4.92 332 289 A 82 PHE HD% A 83 GLU H 1.0 0.0 5.20 333 290 A 83 GLU H A 82 PHE HA 1.0 0.0 3.68 334 291 A 83 GLU H A 100 THR HB 1.0 0.0 4.54 335 292 A 83 GLU H A 82 PHE HBy 1.0 0.0 4.87 336 293 A 83 GLU H A 82 PHE HBx 1.0 0.0 4.87 337 294 A 83 GLU H A 83 GLU HBx 1.0 0.0 4.16 338 294 A 83 GLU H A 83 GLU HBy 1.0 0.0 4.16 339 295 A 83 GLU H A 100 THR HG2% 1.0 0.0 4.84 340 296 A 83 GLU H A 99 ILE HG2% 1.0 0.0 4.90 341 297 A 84 ILE H A 84 ILE HD1% 1.0 0.0 4.61 342 298 A 85 LYS H A 97 LEU HA 1.0 0.0 5.09 343 299 A 85 LYS H A 84 ILE HA 1.0 0.0 3.49 344 300 A 84 ILE HB A 85 LYS H 1.0 0.0 4.81 345 301 A 85 LYS H A 97 LEU HG 1.0 0.0 5.78 346 302 A 85 LYS H A 84 ILE HG2% 1.0 0.0 4.04 347 303 A 85 LYS H A 97 LEU HD1% 1.0 0.0 5.20 348 304 A 67 PHE HA A 86 MET H 1.0 0.0 5.21 349 305 A 86 MET HA A 87 SER H 1.0 0.0 3.45 350 306 A 106 ASP H A 106 ASP HBx 1.0 0.0 3.79 351 306 A 106 ASP H A 106 ASP HBy 1.0 0.0 3.79 352 307 A 87 SER H A 86 MET HB2 1.0 0.0 4.30 353 308 A 87 SER H A 86 MET HB3 1.0 0.0 4.73 354 309 A 97 LEU HD1% A 87 SER H 1.0 0.0 4.53 355 310 A 88 TYR H A 88 TYR HBx 1.0 0.0 4.22 356 310 A 88 TYR H A 88 TYR HBy 1.0 0.0 4.22 357 311 A 92 THR HG2% A 89 ASN HD2y 1.0 0.0 4.37 358 312 A 89 ASN HD2y A 96 VAL HGx% 1.0 0.0 4.19 359 312 A 89 ASN HD2y A 96 VAL HGy% 1.0 0.0 4.19 360 313 A 89 ASN H A 88 TYR HD% 1.0 0.0 4.16 361 314 A 89 ASN H A 95 TYR HA 1.0 0.0 4.30 362 315 A 89 ASN H A 89 ASN HBx 1.0 0.0 3.99 363 316 A 92 THR HG2% A 89 ASN HD2x 1.0 0.0 4.37 364 317 A 89 ASN HD2x A 96 VAL HGx% 1.0 0.0 4.19 365 317 A 96 VAL HGy% A 89 ASN HD2x 1.0 0.0 4.19 366 318 A 90 GLU H A 91 LEU H 1.0 0.0 4.03 367 319 A 91 LEU H A 89 ASN HA 1.0 0.0 4.67 368 320 A 91 LEU H A 90 GLU HBx 1.0 0.0 4.29 369 320 A 90 GLU HBy A 91 LEU H 1.0 0.0 4.29 370 321 A 91 LEU H A 91 LEU HBy 1.0 0.0 4.16 371 322 A 91 LEU H A 91 LEU HG 1.0 0.0 3.69 372 323 A 91 LEU H A 91 LEU HD2% 1.0 0.0 4.62 373 324 A 92 THR H A 91 LEU H 1.0 0.0 3.66 374 325 A 92 THR H A 90 GLU HA 1.0 0.0 5.58 375 326 A 92 THR H A 91 LEU HBy 1.0 0.0 4.11 376 327 A 92 THR H A 91 LEU HBx 1.0 0.0 4.11 377 328 A 92 THR H A 93 GLY H 1.0 0.0 3.42 378 329 A 92 THR HG2% A 93 GLY H 1.0 0.0 4.87 379 330 A 93 GLY H A 94 ASP H 1.0 0.0 3.51 380 331 A 94 ASP H A 94 ASP HBy 1.0 0.0 4.22 381 332 A 92 THR HG2% A 94 ASP H 1.0 0.0 4.85 382 333 A 95 TYR HA A 96 VAL H 1.0 0.0 3.37 383 334 A 88 TYR HA A 96 VAL H 1.0 0.0 4.67 384 335 A 95 TYR HB2 A 96 VAL H 1.0 0.0 4.79 385 336 A 96 VAL H A 95 TYR HB3 1.0 0.0 4.29 386 337 A 96 VAL H A 96 VAL HB 1.0 0.0 3.77 387 338 A 96 VAL H A 96 VAL HGx% 1.0 0.0 3.61 388 338 A 96 VAL HGy% A 96 VAL H 1.0 0.0 3.61 389 339 A 97 LEU H A 97 LEU HB2 1.0 0.0 4.11 390 340 A 97 LEU H A 97 LEU HG 1.0 0.0 5.23 391 341 A 85 LYS H A 98 GLU H 1.0 0.0 4.53 392 342 A 97 LEU HA A 98 GLU H 1.0 0.0 3.36 393 343 A 98 GLU H A 98 GLU HGx 1.0 0.0 4.17 394 343 A 98 GLU H A 98 GLU HGy 1.0 0.0 4.17 395 344 A 97 LEU HG A 98 GLU H 1.0 0.0 4.32 396 345 A 98 GLU H A 96 VAL HGx% 1.0 0.0 4.68 397 345 A 96 VAL HGy% A 98 GLU H 1.0 0.0 4.68 398 346 A 99 ILE H A 98 GLU HGx 1.0 0.0 4.58 399 346 A 99 ILE H A 98 GLU HGy 1.0 0.0 4.58 400 347 A 99 ILE H A 99 ILE HB 1.0 0.0 3.83 401 348 A 99 ILE H A 99 ILE HG1x 1.0 0.0 4.84 402 349 A 99 ILE H A 99 ILE HD1% 1.0 0.0 4.85 403 350 A 115 TRP H A 112 LYS HA 1.0 0.0 4.37 404 351 A 99 ILE HD1% A 100 THR H 1.0 0.0 5.17 405 352 A 6 ILE H A 101 ASP H 1.0 0.0 4.33 406 353 A 101 ASP H A 100 THR HA 1.0 0.0 3.40 407 354 A 101 ASP H A 5 LYS HDx 1.0 0.0 5.78 408 354 A 5 LYS HDy A 101 ASP H 1.0 0.0 5.78 409 355 A 6 ILE HB A 101 ASP H 1.0 0.0 5.78 410 356 A 100 THR HG2% A 101 ASP H 1.0 0.0 3.77 411 357 A 102 PHE HD% A 102 PHE H 1.0 0.0 4.06 412 358 A 102 PHE H A 101 ASP HBy 1.0 0.0 4.60 413 359 A 102 PHE H A 101 ASP HBx 1.0 0.0 4.60 414 360 A 100 THR HG2% A 102 PHE H 1.0 0.0 5.78 415 361 A 102 PHE H A 111 LEU HDx% 1.0 0.0 5.78 416 361 A 102 PHE H A 111 LEU HDy% 1.0 0.0 5.78 417 362 A 4 GLU H A 103 SER H 1.0 0.0 4.06 418 363 A 102 PHE HA A 103 SER H 1.0 0.0 3.35 419 364 A 103 SER H A 102 PHE HBx 1.0 0.0 5.16 420 365 A 104 GLU H A 104 GLU HBx 1.0 0.0 3.93 421 365 A 104 GLU H A 104 GLU HBy 1.0 0.0 3.93 422 366 A 106 ASP H A 107 GLU H 1.0 0.0 4.06 423 367 A 106 ASP H A 107 GLU HGx 1.0 0.0 4.69 424 367 A 106 ASP H A 107 GLU HGy 1.0 0.0 4.69 425 368 A 107 GLU H A 105 ALA HA 1.0 0.0 4.85 426 369 A 107 GLU H A 108 ALA HA 1.0 0.0 5.53 427 370 A 107 GLU H A 106 ASP HBx 1.0 0.0 4.54 428 370 A 106 ASP HBy A 107 GLU H 1.0 0.0 4.54 429 371 A 107 GLU H A 107 GLU HGx 1.0 0.0 3.81 430 371 A 107 GLU H A 107 GLU HGy 1.0 0.0 3.81 431 372 A 107 GLU H A 105 ALA HB% 1.0 0.0 4.85 432 373 A 107 GLU H A 108 ALA HB% 1.0 0.0 4.39 433 374 A 108 ALA H A 110 ASP H 1.0 0.0 4.73 434 375 A 108 ALA H A 106 ASP HA 1.0 0.0 4.82 435 376 A 105 ALA HA A 108 ALA H 1.0 0.0 4.05 436 377 A 108 ALA H A 107 GLU HGx 1.0 0.0 4.92 437 377 A 107 GLU HGy A 108 ALA H 1.0 0.0 4.92 438 378 A 110 ASP H A 109 ASP H 1.0 0.0 3.57 439 379 A 108 ALA H A 109 ASP H 1.0 0.0 3.73 440 380 A 109 ASP H A 109 ASP HBx 1.0 0.0 3.22 441 380 A 109 ASP H A 109 ASP HBy 1.0 0.0 3.22 442 381 A 123 ARG H A 123 ARG HBx 1.0 0.0 3.66 443 381 A 123 ARG H A 123 ARG HBy 1.0 0.0 3.66 444 382 A 123 ARG H A 122 LEU HBy 1.0 0.0 4.76 445 383 A 110 ASP H A 109 ASP HBx 1.0 0.0 3.74 446 383 A 110 ASP H A 109 ASP HBy 1.0 0.0 3.74 447 384 A 110 ASP H A 110 ASP HBy 1.0 0.0 4.05 448 385 A 111 LEU H A 110 ASP HBy 1.0 0.0 4.23 449 386 A 111 LEU H A 110 ASP HBx 1.0 0.0 4.23 450 387 A 111 LEU H A 111 LEU HB3 1.0 0.0 3.62 451 388 A 111 LEU H A 111 LEU HG 1.0 0.0 4.68 452 389 A 111 LEU H A 111 LEU HDx% 1.0 0.0 4.85 453 389 A 111 LEU H A 111 LEU HDy% 1.0 0.0 4.85 454 390 A 113 GLU H A 110 ASP HA 1.0 0.0 4.15 455 391 A 114 LEU H A 111 LEU HA 1.0 0.0 4.24 456 392 A 114 LEU H A 114 LEU HD2% 1.0 0.0 4.75 457 393 A 115 TRP H A 115 TRP HBy 1.0 0.0 4.21 458 394 A 115 TRP H A 115 TRP HBx 1.0 0.0 4.21 459 395 A 115 TRP H A 114 LEU HBy 1.0 0.0 4.11 460 396 A 115 TRP H A 114 LEU HBx 1.0 0.0 4.11 461 397 A 115 TRP H A 8 LEU HDx% 1.0 0.0 4.97 462 397 A 8 LEU HDy% A 115 TRP H 1.0 0.0 4.97 463 398 A 115 TRP H A 116 ASP H 1.0 0.0 3.82 464 399 A 117 SER H A 116 ASP H 1.0 0.0 3.89 465 400 A 116 ASP H A 113 GLU HA 1.0 0.0 3.89 466 401 A 116 ASP H A 115 TRP HBy 1.0 0.0 4.50 467 402 A 116 ASP H A 116 ASP HBy 1.0 0.0 3.92 468 403 A 116 ASP H A 116 ASP HBx 1.0 0.0 3.92 469 404 A 117 SER H A 116 ASP HBx 1.0 0.0 4.29 470 405 A 118 GLN H A 117 SER HBx 1.0 0.0 4.17 471 405 A 118 GLN H A 117 SER HBy 1.0 0.0 4.17 472 406 A 118 GLN H A 118 GLN HGx 1.0 0.0 4.07 473 406 A 118 GLN H A 118 GLN HGy 1.0 0.0 4.07 474 407 A 118 GLN H A 119 VAL H 1.0 0.0 3.96 475 408 A 119 VAL H A 116 ASP HA 1.0 0.0 4.74 476 409 A 119 VAL H A 118 GLN HBy 1.0 0.0 4.65 477 410 A 119 VAL H A 118 GLN HBx 1.0 0.0 4.65 478 411 A 119 VAL H A 119 VAL HB 1.0 0.0 3.72 479 412 A 120 SER H A 119 VAL H 1.0 0.0 3.85 480 413 A 120 SER H A 119 VAL HB 1.0 0.0 4.15 481 414 A 120 SER H A 119 VAL HGy% 1.0 0.0 4.53 482 415 A 121 LYS H A 119 VAL HA 1.0 0.0 5.04 483 416 A 121 LYS H A 121 LYS HBy 1.0 0.0 4.06 484 417 A 121 LYS H A 121 LYS HBx 1.0 0.0 4.06 485 418 A 123 ARG H A 122 LEU H 1.0 0.0 4.22 486 419 A 121 LYS H A 122 LEU H 1.0 0.0 3.86 487 420 A 119 VAL HA A 122 LEU H 1.0 0.0 4.07 488 421 A 122 LEU H A 122 LEU HBy 1.0 0.0 3.96 489 422 A 122 LEU H A 122 LEU HBx 1.0 0.0 3.96 490 423 A 123 ARG H A 122 LEU HBx 1.0 0.0 4.76 491 424 A 124 ARG H A 124 ARG HGx 1.0 0.0 4.19 492 425 A 125 THR H A 122 LEU HA 1.0 0.0 4.43 493 426 A 126 CYS H A 126 CYS HBx 1.0 0.0 4.03 494 426 A 126 CYS H A 126 CYS HBy 1.0 0.0 4.03 495 427 A 125 THR H A 124 ARG HBx 1.0 0.0 3.94 496 427 A 125 THR H A 124 ARG HBy 1.0 0.0 3.94 497 428 A 125 THR H A 125 THR HG2% 1.0 0.0 4.06 498 429 A 126 CYS HA A 127 GLY H 1.0 0.0 3.41 499 430 A 129 LEU H A 128 PHE H 1.0 0.0 4.82 500 431 A 128 PHE H A 128 PHE HBx 1.0 0.0 3.68 501 431 A 128 PHE H A 128 PHE HBy 1.0 0.0 3.68 502 432 A 130 GLU H A 130 GLU HGx 1.0 0.0 4.56 503 432 A 130 GLU H A 130 GLU HGy 1.0 0.0 4.56 504 433 A 130 GLU H A 130 GLU HBx 1.0 0.0 3.86 505 433 A 130 GLU H A 130 GLU HBy 1.0 0.0 3.86 506 434 A 130 GLU H A 129 LEU HBy 1.0 0.0 4.67 507 435 A 7 HIS H A 8 LEU H 1.0 0.0 4.95 508 436 A 6 ILE H A 7 HIS H 1.0 0.0 5.16 509 437 A 6 ILE HG13 A 8 LEU H 1.0 0.0 4.53 510 438 A 9 GLU H A 9 GLU HGx 1.0 0.0 4.41 511 438 A 9 GLU H A 9 GLU HGy 1.0 0.0 4.41 512 439 A 10 TYR H A 97 LEU HB2 1.0 0.0 4.78 513 440 A 12 LEU H A 95 TYR HB3 1.0 0.0 5.78 514 441 A 22 SER H A 21 TRP HB2 1.0 0.0 5.11 515 442 A 24 ILE H A 22 SER HA 1.0 0.0 5.40 516 443 A 22 SER H A 24 ILE H 1.0 0.0 5.29 517 444 A 25 SER H A 68 ILE HD1% 1.0 0.0 5.73 518 445 A 23 ALA HB% A 25 SER H 1.0 0.0 5.10 519 446 A 26 THR H A 29 GLY H 1.0 0.0 5.03 520 447 A 26 THR H A 30 LEU H 1.0 0.0 4.85 521 448 A 29 GLY H A 27 PRO HBx 1.0 0.0 5.24 522 448 A 27 PRO HBy A 29 GLY H 1.0 0.0 5.24 523 449 A 30 LEU H A 30 LEU HB3 1.0 0.0 3.84 524 450 A 30 LEU H A 32 ASP H 1.0 0.0 4.75 525 451 A 33 TRP HD1 A 33 TRP H 1.0 0.0 3.74 526 452 A 33 TRP H A 31 GLU HA 1.0 0.0 4.97 527 453 A 23 ALA H A 33 TRP HE1 1.0 0.0 5.78 528 454 A 34 PHE H A 35 ALA HB% 1.0 0.0 5.12 529 455 A 37 LYS H A 37 LYS HB3 1.0 0.0 4.17 530 456 A 37 LYS H A 37 LYS HB2 1.0 0.0 4.17 531 457 A 38 VAL H A 37 LYS HB3 1.0 0.0 4.64 532 458 A 38 VAL H A 38 VAL HB 1.0 0.0 4.18 533 459 A 38 VAL H A 31 GLU HGx 1.0 0.0 4.57 534 460 A 46 THR H A 45 VAL H 1.0 0.0 4.97 535 461 A 47 PHE HB2 A 48 CYS H 1.0 0.0 4.87 536 462 A 55 ARG H A 56 GLN HA 1.0 0.0 5.48 537 463 A 57 ALA H A 44 THR HB 1.0 0.0 5.61 538 464 A 57 ALA H A 56 GLN H 1.0 0.0 5.11 539 465 A 57 ALA H A 46 THR HG2% 1.0 0.0 5.78 540 466 A 57 ALA H A 73 LEU HG 1.0 0.0 5.78 541 467 A 59 ILE H A 58 GLY H 1.0 0.0 5.26 542 468 A 59 ILE HD1% A 60 VAL H 1.0 0.0 5.78 543 469 A 59 ILE HB A 61 ALA H 1.0 0.0 5.53 544 470 A 61 ALA H A 62 ILE HB 1.0 0.0 5.76 545 471 A 62 ILE H A 67 PHE HE% 1.0 0.0 5.66 546 472 A 62 ILE H A 62 ILE HB 1.0 0.0 3.98 547 473 A 63 ARG H A 66 SER H 1.0 0.0 5.26 548 474 A 63 ARG H A 65 TYR H 1.0 0.0 5.55 549 475 A 63 ARG H A 62 ILE HG1x 1.0 0.0 4.43 550 475 A 63 ARG H A 62 ILE HG1y 1.0 0.0 4.43 551 476 A 67 PHE HD% A 66 SER H 1.0 0.0 4.98 552 477 A 66 SER H A 65 TYR HD% 1.0 0.0 3.91 553 478 A 66 SER H A 66 SER HB3 1.0 0.0 4.20 554 479 A 66 SER H A 65 TYR HBx 1.0 0.0 4.58 555 479 A 66 SER H A 65 TYR HBy 1.0 0.0 4.58 556 480 A 67 PHE H A 68 ILE H 1.0 0.0 5.13 557 481 A 67 PHE H A 62 ILE HA 1.0 0.0 5.35 558 482 A 67 PHE H A 66 SER HB3 1.0 0.0 4.30 559 483 A 84 ILE HB A 68 ILE H 1.0 0.0 4.91 560 484 A 69 ARG H A 68 ILE HG2% 1.0 0.0 4.80 561 485 A 71 HIS H A 72 TRP H 1.0 0.0 4.92 562 486 A 72 TRP H A 71 HIS HD2 1.0 0.0 5.50 563 487 A 72 TRP H A 72 TRP HD1 1.0 0.0 5.11 564 488 A 74 ASP H A 73 LEU HG 1.0 0.0 5.50 565 489 A 79 ARG H A 78 GLU H 1.0 0.0 5.07 566 490 A 80 ASP H A 78 GLU HBx 1.0 0.0 5.31 567 490 A 78 GLU HBy A 80 ASP H 1.0 0.0 5.31 568 491 A 99 ILE HA A 85 LYS H 1.0 0.0 5.22 569 492 A 86 MET H A 86 MET HE% 1.0 0.0 5.53 570 493 A 86 MET H A 66 SER HA 1.0 0.0 5.57 571 494 A 95 TYR HD% A 87 SER H 1.0 0.0 4.88 572 495 A 89 ASN H A 88 TYR H 1.0 0.0 5.05 573 496 A 89 ASN H A 96 VAL HGx% 1.0 0.0 4.89 574 496 A 89 ASN H A 96 VAL HGy% 1.0 0.0 4.89 575 497 A 92 THR H A 90 GLU H 1.0 0.0 5.09 576 498 A 95 TYR H A 12 LEU HDx% 1.0 0.0 5.49 577 498 A 12 LEU HDy% A 95 TYR H 1.0 0.0 5.49 578 499 A 95 TYR H A 96 VAL HGx% 1.0 0.0 5.78 579 499 A 95 TYR H A 96 VAL HGy% 1.0 0.0 5.78 580 500 A 97 LEU H A 95 TYR HB3 1.0 0.0 5.78 581 501 A 86 MET HA A 98 GLU H 1.0 0.0 5.02 582 502 A 98 GLU H A 97 LEU HB3 1.0 0.0 5.02 583 503 A 99 ILE H A 99 ILE HG1y 1.0 0.0 4.84 584 504 A 101 ASP H A 7 HIS HA 1.0 0.0 4.79 585 505 A 99 ILE HG2% A 101 ASP H 1.0 0.0 5.35 586 506 A 102 PHE HD% A 103 SER H 1.0 0.0 5.23 587 507 A 103 SER H A 102 PHE HBy 1.0 0.0 5.16 588 508 A 105 ALA H A 104 GLU HBx 1.0 0.0 4.91 589 508 A 104 GLU HBy A 105 ALA H 1.0 0.0 4.91 590 509 A 113 GLU H A 112 LYS HBx 1.0 0.0 4.24 591 510 A 114 LEU H A 116 ASP H 1.0 0.0 4.95 592 511 A 116 ASP H A 115 TRP HBx 1.0 0.0 4.50 593 512 A 119 VAL H A 115 TRP HA 1.0 0.0 4.91 594 513 A 119 VAL H A 117 SER HBx 1.0 0.0 5.78 595 513 A 117 SER HBy A 119 VAL H 1.0 0.0 5.78 596 514 A 119 VAL H A 120 SER HBx 1.0 0.0 5.78 597 514 A 119 VAL H A 120 SER HBy 1.0 0.0 5.78 598 515 A 120 SER H A 116 ASP HA 1.0 0.0 5.05 599 516 A 120 SER H A 118 GLN HA 1.0 0.0 5.58 600 517 A 120 SER H A 117 SER HA 1.0 0.0 4.90 601 518 A 122 LEU H A 123 ARG HBx 1.0 0.0 5.31 602 518 A 123 ARG HBy A 122 LEU H 1.0 0.0 5.31 603 519 A 123 ARG H A 121 LYS HA 1.0 0.0 5.18 604 520 A 124 ARG H A 122 LEU HA 1.0 0.0 5.02 605 521 A 128 PHE H A 128 PHE HD% 1.0 0.0 4.94 606 522 A 129 LEU H A 128 PHE HBx 1.0 0.0 4.82 607 522 A 129 LEU H A 128 PHE HBy 1.0 0.0 4.82 608 523 A 129 LEU H A 129 LEU HDy% 1.0 0.0 5.78 609 524 A 21 TRP H A 19 ILE HA 1.0 0.0 4.98 610 525 A 21 TRP H A 20 LEU HD1% 1.0 0.0 5.78 611 526 A 21 TRP H A 20 LEU HD2% 1.0 0.0 5.78 612 527 A 21 TRP H A 84 ILE HG2% 1.0 0.0 5.78 613 528 A 21 TRP H A 97 LEU HD1% 1.0 0.0 5.78 614 529 A 97 LEU HD2% A 21 TRP H 1.0 0.0 5.49 615 530 A 21 TRP HE1 A 21 TRP H 1.0 0.0 5.78 616 531 A 97 LEU HD2% A 21 TRP HE1 1.0 0.0 5.57 617 532 A 24 ILE H A 30 LEU HB2 1.0 0.0 5.78 618 533 A 65 TYR H A 62 ILE HG1x 1.0 0.0 5.65 619 533 A 65 TYR H A 62 ILE HG1y 1.0 0.0 5.65 620 534 A 30 LEU H A 38 VAL HG2% 1.0 0.0 5.69 621 535 A 30 LEU H A 27 PRO HBx 1.0 0.0 5.78 622 535 A 27 PRO HBy A 30 LEU H 1.0 0.0 5.78 623 536 A 28 THR H A 30 LEU H 1.0 0.0 5.78 624 537 A 30 LEU H A 33 TRP HD1 1.0 0.0 5.78 625 538 A 84 ILE H A 83 GLU H 1.0 0.0 5.61 626 539 A 84 ILE H A 85 LYS H 1.0 0.0 5.44 627 540 A 84 ILE H A 69 ARG HA 1.0 0.0 5.07 628 541 A 99 ILE HA A 84 ILE H 1.0 0.0 5.78 629 542 A 84 ILE H A 83 GLU HBx 1.0 0.0 4.38 630 542 A 84 ILE H A 83 GLU HBy 1.0 0.0 4.38 631 543 A 86 MET H A 87 SER H 1.0 0.0 5.55 632 544 A 86 MET H A 65 TYR HBx 1.0 0.0 5.51 633 544 A 86 MET H A 65 TYR HBy 1.0 0.0 5.51 634 545 A 86 MET H A 65 TYR HA 1.0 0.0 5.78 635 546 A 97 LEU HD1% A 86 MET H 1.0 0.0 5.13 636 547 A 30 LEU H A 23 ALA HA 1.0 0.0 4.82 637 548 A 62 ILE HD1% A 68 ILE H 1.0 0.0 5.78 638 549 A 68 ILE HG13 A 68 ILE H 1.0 0.0 5.78 639 550 A 68 ILE HD1% A 68 ILE H 1.0 0.0 5.67 640 551 A 95 TYR H A 96 VAL H 1.0 0.0 5.02 641 552 A 95 TYR H A 94 ASP H 1.0 0.0 5.78 642 553 A 50 GLY H A 49 TRP HBx 1.0 0.0 5.53 643 553 A 49 TRP HBy A 50 GLY H 1.0 0.0 5.53 644 554 A 3 LYS H A 2 LYS HA 1.0 0.0 3.14 645 555 A 2 LYS HA A 2 LYS HBx 1.0 0.0 3.02 646 555 A 2 LYS HA A 2 LYS HBy 1.0 0.0 3.02 647 556 A 2 LYS HA A 2 LYS HGx 1.0 0.0 3.61 648 556 A 2 LYS HA A 2 LYS HGy 1.0 0.0 3.61 649 557 A 43 LYS HA A 43 LYS HGy 1.0 0.0 4.13 650 558 A 2 LYS HEx A 2 LYS HGx 1.0 0.0 3.73 651 558 A 2 LYS HEy A 2 LYS HGx 1.0 0.0 3.73 652 558 A 2 LYS HGy A 2 LYS HEx 1.0 0.0 3.73 653 558 A 2 LYS HGy A 2 LYS HEy 1.0 0.0 3.73 654 559 A 33 TRP HD1 A 32 ASP HBx 1.0 0.0 3.99 655 559 A 33 TRP HD1 A 32 ASP HBy 1.0 0.0 3.99 656 560 A 33 TRP H A 32 ASP HBx 1.0 0.0 4.07 657 560 A 32 ASP HBy A 33 TRP H 1.0 0.0 4.07 658 561 A 112 LYS HEx A 112 LYS HGy 1.0 0.0 3.46 659 561 A 112 LYS HEy A 112 LYS HGy 1.0 0.0 3.46 660 562 A 112 LYS HGx A 112 LYS HEx 1.0 0.0 3.46 661 562 A 112 LYS HEy A 112 LYS HGx 1.0 0.0 3.46 662 563 A 2 LYS HA A 2 LYS HDx 1.0 0.0 4.46 663 563 A 2 LYS HA A 2 LYS HDy 1.0 0.0 4.46 664 564 A 2 LYS HDy A 2 LYS HEx 1.0 0.0 3.10 665 564 A 2 LYS HEy A 2 LYS HDx 1.0 0.0 3.10 666 564 A 2 LYS HEy A 2 LYS HDy 1.0 0.0 3.10 667 564 A 2 LYS HDx A 2 LYS HEx 1.0 0.0 3.10 668 565 A 2 LYS HDy A 2 LYS HGx 1.0 0.0 2.64 669 565 A 2 LYS HGy A 2 LYS HDx 1.0 0.0 2.64 670 565 A 2 LYS HGy A 2 LYS HDy 1.0 0.0 2.64 671 565 A 2 LYS HDx A 2 LYS HGx 1.0 0.0 2.64 672 566 A 3 LYS HA A 3 LYS HGx 1.0 0.0 4.29 673 567 A 3 LYS H A 3 LYS HGy 1.0 0.0 4.73 674 568 A 3 LYS HEx A 3 LYS HGy 1.0 0.0 4.16 675 568 A 3 LYS HEy A 3 LYS HGy 1.0 0.0 4.16 676 569 A 8 LEU HDy% A 112 LYS HEx 1.0 0.0 3.72 677 569 A 112 LYS HEy A 8 LEU HDx% 1.0 0.0 3.72 678 569 A 8 LEU HDy% A 112 LYS HEy 1.0 0.0 3.72 679 569 A 8 LEU HDx% A 112 LYS HEx 1.0 0.0 3.72 680 570 A 3 LYS HEy A 3 LYS HGx 1.0 0.0 4.16 681 570 A 3 LYS HGx A 3 LYS HEx 1.0 0.0 4.16 682 571 A 4 GLU H A 4 GLU HBx 1.0 0.0 4.06 683 572 A 5 LYS H A 4 GLU HBx 1.0 0.0 4.55 684 573 A 107 GLU HA A 107 GLU HGx 1.0 0.0 3.61 685 573 A 107 GLU HGy A 107 GLU HA 1.0 0.0 3.61 686 574 A 4 GLU H A 4 GLU HBy 1.0 0.0 4.06 687 575 A 39 VAL HA A 27 PRO HBx 1.0 0.0 5.45 688 575 A 27 PRO HBy A 39 VAL HA 1.0 0.0 5.45 689 576 A 5 LYS HA A 6 ILE HG2% 1.0 0.0 4.89 690 577 A 5 LYS HA A 5 LYS HGx 1.0 0.0 4.43 691 578 A 7 HIS HD2 A 5 LYS HEx 1.0 0.0 4.33 692 578 A 5 LYS HEy A 7 HIS HD2 1.0 0.0 4.33 693 579 A 4 GLU HGy A 5 LYS HEx 1.0 0.0 5.25 694 579 A 4 GLU HGx A 5 LYS HEx 1.0 0.0 5.25 695 579 A 5 LYS HEy A 4 GLU HGx 1.0 0.0 5.25 696 579 A 4 GLU HGy A 5 LYS HEy 1.0 0.0 5.25 697 580 A 5 LYS HDy A 5 LYS HEx 1.0 0.0 2.81 698 580 A 5 LYS HEy A 5 LYS HDx 1.0 0.0 2.81 699 580 A 5 LYS HDy A 5 LYS HEy 1.0 0.0 2.81 700 580 A 5 LYS HDx A 5 LYS HEx 1.0 0.0 2.81 701 581 A 5 LYS HEx A 5 LYS HGy 1.0 0.0 3.82 702 581 A 5 LYS HEy A 5 LYS HGy 1.0 0.0 3.82 703 582 A 5 LYS HGx A 5 LYS HEx 1.0 0.0 3.82 704 582 A 5 LYS HEy A 5 LYS HGx 1.0 0.0 3.82 705 583 A 6 ILE H A 5 LYS HGx 1.0 0.0 4.57 706 584 A 5 LYS HEy A 5 LYS HBx 1.0 0.0 4.82 707 584 A 5 LYS HBx A 5 LYS HEx 1.0 0.0 4.82 708 585 A 7 HIS HD2 A 5 LYS HDx 1.0 0.0 4.87 709 585 A 5 LYS HDy A 7 HIS HD2 1.0 0.0 4.87 710 586 A 100 THR HG2% A 5 LYS HDx 1.0 0.0 3.73 711 586 A 5 LYS HDy A 100 THR HG2% 1.0 0.0 3.73 712 587 A 6 ILE H A 6 ILE HB 1.0 0.0 4.28 713 588 A 6 ILE HA A 6 ILE HD1% 1.0 0.0 4.51 714 589 A 108 ALA HA A 6 ILE HD1% 1.0 0.0 4.39 715 590 A 111 LEU HB3 A 6 ILE HD1% 1.0 0.0 4.20 716 591 A 6 ILE HB A 6 ILE HD1% 1.0 0.0 3.73 717 592 A 6 ILE H A 6 ILE HG2% 1.0 0.0 4.13 718 593 A 30 LEU H A 30 LEU HDy% 1.0 0.0 4.60 719 594 A 7 HIS H A 6 ILE HG2% 1.0 0.0 4.65 720 595 A 102 PHE HA A 6 ILE HG2% 1.0 0.0 4.64 721 596 A 6 ILE HA A 6 ILE HG2% 1.0 0.0 3.52 722 597 A 108 ALA HA A 6 ILE HG2% 1.0 0.0 4.96 723 598 A 6 ILE HG2% A 112 LYS HEx 1.0 0.0 4.74 724 598 A 112 LYS HEy A 6 ILE HG2% 1.0 0.0 4.74 725 599 A 6 ILE H A 6 ILE HG13 1.0 0.0 4.21 726 600 A 6 ILE HG13 A 101 ASP H 1.0 0.0 4.61 727 601 A 6 ILE HG13 A 8 LEU HA 1.0 0.0 5.39 728 602 A 8 LEU H A 7 HIS HA 1.0 0.0 3.38 729 603 A 100 THR HA A 7 HIS HA 1.0 0.0 3.84 730 604 A 8 LEU HA A 8 LEU HDx% 1.0 0.0 3.21 731 604 A 8 LEU HDy% A 8 LEU HA 1.0 0.0 3.21 732 605 A 10 TYR H A 9 GLU HBx 1.0 0.0 4.12 733 605 A 9 GLU HBy A 10 TYR H 1.0 0.0 4.12 734 606 A 60 VAL HB A 61 ALA HB% 1.0 0.0 4.19 735 607 A 60 VAL HB A 69 ARG HGx 1.0 0.0 4.59 736 607 A 60 VAL HB A 69 ARG HGy 1.0 0.0 4.59 737 608 A 9 GLU HA A 9 GLU HGx 1.0 0.0 4.08 738 608 A 9 GLU HA A 9 GLU HGy 1.0 0.0 4.08 739 609 A 95 TYR H A 94 ASP HBy 1.0 0.0 4.25 740 610 A 97 LEU HD1% A 98 GLU H 1.0 0.0 4.03 741 611 A 97 LEU H A 97 LEU HD1% 1.0 0.0 4.49 742 612 A 11 LEU HA A 11 LEU HDx% 1.0 0.0 3.41 743 612 A 11 LEU HDy% A 11 LEU HA 1.0 0.0 3.41 744 613 A 12 LEU HA A 12 LEU HDx% 1.0 0.0 3.51 745 613 A 12 LEU HDy% A 12 LEU HA 1.0 0.0 3.51 746 614 A 97 LEU HD1% A 95 TYR HB3 1.0 0.0 4.36 747 615 A 129 LEU H A 129 LEU HBx 1.0 0.0 4.27 748 616 A 130 GLU H A 129 LEU HBx 1.0 0.0 4.67 749 617 A 68 ILE HD1% A 68 ILE HB 1.0 0.0 3.79 750 618 A 62 ILE HB A 59 ILE HG2% 1.0 0.0 3.68 751 619 A 14 ALA H A 13 ASN HBx 1.0 0.0 4.48 752 620 A 14 ALA H A 13 ASN HBy 1.0 0.0 4.48 753 621 A 113 GLU HA A 116 ASP HBx 1.0 0.0 4.28 754 622 A 84 ILE HG2% A 21 TRP HZ2 1.0 0.0 4.80 755 623 A 84 ILE HG2% A 86 MET HE% 1.0 0.0 4.18 756 624 A 84 ILE HG2% A 84 ILE HG12 1.0 0.0 3.39 757 625 A 19 ILE H A 18 ASN HB2 1.0 0.0 4.59 758 626 A 92 THR H A 89 ASN HBy 1.0 0.0 4.79 759 627 A 18 ASN HB3 A 95 TYR HE% 1.0 0.0 4.83 760 628 A 19 ILE H A 19 ILE HB 1.0 0.0 3.48 761 629 A 20 LEU H A 19 ILE HB 1.0 0.0 4.06 762 630 A 19 ILE HA A 19 ILE HD1% 1.0 0.0 3.93 763 631 A 19 ILE H A 19 ILE HD1% 1.0 0.0 4.25 764 632 A 19 ILE HB A 19 ILE HD1% 1.0 0.0 3.81 765 633 A 22 SER H A 19 ILE HG2% 1.0 0.0 4.92 766 634 A 19 ILE H A 19 ILE HG2% 1.0 0.0 4.12 767 635 A 20 LEU H A 19 ILE HG2% 1.0 0.0 4.18 768 636 A 19 ILE HG2% A 20 LEU HA 1.0 0.0 4.22 769 637 A 19 ILE HA A 19 ILE HG2% 1.0 0.0 3.48 770 638 A 19 ILE HG2% A 19 ILE HG1y 1.0 0.0 3.73 771 639 A 19 ILE HG2% A 19 ILE HG1x 1.0 0.0 3.73 772 640 A 19 ILE HA A 19 ILE HG1x 1.0 0.0 3.97 773 641 A 19 ILE HA A 19 ILE HG1y 1.0 0.0 3.97 774 642 A 114 LEU HA A 114 LEU HD1% 1.0 0.0 3.99 775 643 A 20 LEU HA A 20 LEU HD1% 1.0 0.0 4.53 776 644 A 20 LEU H A 20 LEU HB3 1.0 0.0 4.30 777 645 A 115 TRP H A 114 LEU HD1% 1.0 0.0 5.22 778 646 A 114 LEU H A 114 LEU HD1% 1.0 0.0 4.75 779 647 A 111 LEU HA A 114 LEU HD1% 1.0 0.0 5.12 780 648 A 20 LEU HA A 20 LEU HD2% 1.0 0.0 4.53 781 649 A 114 LEU HBy A 114 LEU HD1% 1.0 0.0 4.00 782 650 A 114 LEU HBx A 114 LEU HD1% 1.0 0.0 4.00 783 651 A 11 LEU HG A 11 LEU HA 1.0 0.0 4.21 784 652 A 22 SER H A 21 TRP HB3 1.0 0.0 4.89 785 653 A 22 SER H A 22 SER HBy 1.0 0.0 4.06 786 654 A 108 ALA HB% A 109 ASP H 1.0 0.0 3.53 787 655 A 23 ALA HB% A 23 ALA H 1.0 0.0 3.19 788 656 A 23 ALA HB% A 24 ILE HG2% 1.0 0.0 3.57 789 657 A 23 ALA H A 24 ILE HD1% 1.0 0.0 5.16 790 658 A 24 ILE HD1% A 33 TRP HH2 1.0 0.0 5.45 791 659 A 24 ILE HD1% A 21 TRP HA 1.0 0.0 3.91 792 660 A 24 ILE HD1% A 24 ILE HB 1.0 0.0 3.68 793 661 A 24 ILE HD1% A 84 ILE HB 1.0 0.0 4.17 794 662 A 24 ILE HG2% A 33 TRP HZ2 1.0 0.0 3.70 795 663 A 64 ALA HB% A 65 TYR HD% 1.0 0.0 3.60 796 664 A 24 ILE HG2% A 24 ILE HA 1.0 0.0 3.53 797 665 A 24 ILE HG2% A 84 ILE HD1% 1.0 0.0 4.34 798 666 A 24 ILE H A 25 SER HB3 1.0 0.0 4.81 799 667 A 25 SER H A 25 SER HB3 1.0 0.0 4.38 800 668 A 25 SER HB3 A 24 ILE HG1x 1.0 0.0 4.61 801 668 A 25 SER HB3 A 24 ILE HG1y 1.0 0.0 4.61 802 669 A 26 THR H A 26 THR HB 1.0 0.0 3.97 803 670 A 57 ALA H A 44 THR HG2% 1.0 0.0 4.41 804 671 A 45 VAL H A 44 THR HG2% 1.0 0.0 3.61 805 672 A 44 THR H A 44 THR HG2% 1.0 0.0 4.33 806 673 A 44 THR HG2% A 44 THR HA 1.0 0.0 3.38 807 674 A 52 THR HA A 52 THR HG2% 1.0 0.0 3.07 808 675 A 44 THR HG2% A 56 GLN HGx 1.0 0.0 4.07 809 675 A 56 GLN HGy A 44 THR HG2% 1.0 0.0 4.07 810 676 A 44 THR HG2% A 56 GLN HB3 1.0 0.0 3.53 811 677 A 26 THR HG2% A 27 PRO HG2 1.0 0.0 4.42 812 678 A 73 LEU HB2 A 44 THR HG2% 1.0 0.0 4.79 813 679 A 53 GLU H A 54 GLN HBx 1.0 0.0 4.64 814 679 A 53 GLU H A 54 GLN HBy 1.0 0.0 4.64 815 680 A 28 THR H A 27 PRO HG3 1.0 0.0 4.46 816 681 A 26 THR HB A 27 PRO HG3 1.0 0.0 5.20 817 682 A 27 PRO HG3 A 40 SER HBx 1.0 0.0 4.04 818 682 A 40 SER HBy A 27 PRO HG3 1.0 0.0 4.04 819 683 A 28 THR HB A 29 GLY H 1.0 0.0 4.51 820 684 A 28 THR HA A 28 THR HG2% 1.0 0.0 3.59 821 685 A 29 GLY H A 28 THR HG2% 1.0 0.0 4.24 822 686 A 28 THR H A 28 THR HG2% 1.0 0.0 3.73 823 687 A 76 GLU HA A 76 GLU HBx 1.0 0.0 3.14 824 687 A 76 GLU HBy A 76 GLU HA 1.0 0.0 3.14 825 688 A 30 LEU H A 30 LEU HDx% 1.0 0.0 4.60 826 689 A 65 TYR H A 64 ALA HB% 1.0 0.0 3.56 827 690 A 30 LEU HB3 A 27 PRO HA 1.0 0.0 4.54 828 691 A 43 LYS HA A 43 LYS HGx 1.0 0.0 4.13 829 692 A 78 GLU H A 78 GLU HBx 1.0 0.0 3.90 830 692 A 78 GLU HBy A 78 GLU H 1.0 0.0 3.90 831 693 A 31 GLU H A 31 GLU HBx 1.0 0.0 3.97 832 694 A 33 TRP H A 34 PHE HB2 1.0 0.0 4.76 833 695 A 34 PHE HB2 A 35 ALA H 1.0 0.0 4.77 834 696 A 35 ALA HB% A 36 ASP H 1.0 0.0 3.18 835 697 A 35 ALA HB% A 36 ASP HA 1.0 0.0 4.85 836 698 A 35 ALA HB% A 47 PHE HA 1.0 0.0 5.08 837 699 A 35 ALA HB% A 47 PHE HB2 1.0 0.0 4.85 838 700 A 35 ALA HB% A 49 TRP HBx 1.0 0.0 5.48 839 700 A 35 ALA HB% A 49 TRP HBy 1.0 0.0 5.48 840 701 A 35 ALA HB% A 36 ASP HBx 1.0 0.0 4.56 841 701 A 35 ALA HB% A 36 ASP HBy 1.0 0.0 4.56 842 702 A 35 ALA HA A 36 ASP H 1.0 0.0 3.58 843 703 A 37 LYS HA A 37 LYS HGy 1.0 0.0 4.17 844 704 A 38 VAL H A 37 LYS HGx 1.0 0.0 4.69 845 705 A 37 LYS HA A 37 LYS HGx 1.0 0.0 4.17 846 706 A 37 LYS HB2 A 36 ASP HBx 1.0 0.0 4.14 847 706 A 36 ASP HBy A 37 LYS HB2 1.0 0.0 4.14 848 707 A 38 VAL H A 37 LYS HDx 1.0 0.0 4.46 849 707 A 38 VAL H A 37 LYS HDy 1.0 0.0 4.46 850 708 A 37 LYS HA A 37 LYS HDx 1.0 0.0 4.07 851 708 A 37 LYS HA A 37 LYS HDy 1.0 0.0 4.07 852 709 A 37 LYS HB3 A 36 ASP HBx 1.0 0.0 4.83 853 709 A 36 ASP HBy A 37 LYS HB3 1.0 0.0 4.83 854 710 A 38 VAL HA A 38 VAL HG2% 1.0 0.0 3.57 855 711 A 30 LEU HB3 A 38 VAL HG2% 1.0 0.0 3.69 856 712 A 38 VAL H A 38 VAL HG1% 1.0 0.0 4.86 857 713 A 38 VAL HA A 38 VAL HG1% 1.0 0.0 3.57 858 714 A 30 LEU HB3 A 38 VAL HG1% 1.0 0.0 3.69 859 715 A 38 VAL HB A 27 PRO HA 1.0 0.0 4.30 860 716 A 39 VAL HA A 39 VAL HG2% 1.0 0.0 3.66 861 717 A 97 LEU H A 96 VAL HGx% 1.0 0.0 3.56 862 717 A 97 LEU H A 96 VAL HGy% 1.0 0.0 3.56 863 718 A 9 GLU HA A 96 VAL HGx% 1.0 0.0 4.77 864 718 A 9 GLU HA A 96 VAL HGy% 1.0 0.0 4.77 865 719 A 96 VAL HA A 96 VAL HGx% 1.0 0.0 3.04 866 719 A 96 VAL HA A 96 VAL HGy% 1.0 0.0 3.04 867 720 A 9 GLU HGy A 96 VAL HGx% 1.0 0.0 3.68 868 720 A 9 GLU HGx A 96 VAL HGx% 1.0 0.0 3.68 869 720 A 96 VAL HGy% A 9 GLU HGx 1.0 0.0 3.68 870 720 A 9 GLU HGy A 96 VAL HGy% 1.0 0.0 3.68 871 721 A 46 THR H A 39 VAL HB 1.0 0.0 4.46 872 722 A 39 VAL H A 39 VAL HB 1.0 0.0 3.83 873 723 A 46 THR HB A 39 VAL HB 1.0 0.0 3.45 874 724 A 40 SER HA A 45 VAL HA 1.0 0.0 3.48 875 725 A 45 VAL HA A 40 SER HBx 1.0 0.0 4.36 876 725 A 40 SER HBy A 45 VAL HA 1.0 0.0 4.36 877 726 A 27 PRO HBx A 40 SER HBx 1.0 0.0 4.56 878 726 A 27 PRO HBy A 40 SER HBx 1.0 0.0 4.56 879 726 A 40 SER HBy A 27 PRO HBx 1.0 0.0 4.56 880 726 A 27 PRO HBy A 40 SER HBy 1.0 0.0 4.56 881 727 A 27 PRO HG2 A 40 SER HBx 1.0 0.0 4.83 882 727 A 40 SER HBy A 27 PRO HG2 1.0 0.0 4.83 883 728 A 40 SER HBy A 45 VAL HG1% 1.0 0.0 4.01 884 728 A 45 VAL HG1% A 40 SER HBx 1.0 0.0 4.01 885 729 A 42 ASP H A 41 ASP HBx 1.0 0.0 4.81 886 730 A 42 ASP HA A 42 ASP HBx 1.0 0.0 3.14 887 730 A 42 ASP HA A 42 ASP HBy 1.0 0.0 3.14 888 731 A 91 LEU HG A 91 LEU HA 1.0 0.0 3.86 889 732 A 91 LEU HD2% A 91 LEU HA 1.0 0.0 3.27 890 733 A 43 LYS H A 42 ASP HBx 1.0 0.0 4.09 891 733 A 43 LYS H A 42 ASP HBy 1.0 0.0 4.09 892 734 A 43 LYS HDy A 43 LYS HEx 1.0 0.0 3.08 893 734 A 43 LYS HDx A 43 LYS HEx 1.0 0.0 3.08 894 734 A 43 LYS HEy A 43 LYS HDx 1.0 0.0 3.08 895 734 A 43 LYS HDy A 43 LYS HEy 1.0 0.0 3.08 896 735 A 45 VAL H A 44 THR HB 1.0 0.0 4.12 897 736 A 44 THR H A 44 THR HB 1.0 0.0 3.72 898 737 A 45 VAL H A 44 THR HA 1.0 0.0 3.24 899 738 A 45 VAL H A 45 VAL HG2% 1.0 0.0 4.58 900 739 A 46 THR H A 45 VAL HG2% 1.0 0.0 4.58 901 740 A 70 PHE HE% A 45 VAL HG2% 1.0 0.0 4.45 902 741 A 45 VAL HA A 45 VAL HG2% 1.0 0.0 3.82 903 742 A 40 SER HBy A 45 VAL HG2% 1.0 0.0 4.01 904 742 A 40 SER HBx A 45 VAL HG2% 1.0 0.0 4.01 905 743 A 70 PHE HE% A 45 VAL HG1% 1.0 0.0 4.45 906 744 A 45 VAL HA A 45 VAL HG1% 1.0 0.0 3.82 907 745 A 57 ALA H A 45 VAL HB 1.0 0.0 4.57 908 746 A 45 VAL H A 45 VAL HB 1.0 0.0 3.84 909 747 A 70 PHE HE% A 45 VAL HB 1.0 0.0 4.64 910 748 A 47 PHE HE% A 45 VAL HB 1.0 0.0 4.56 911 749 A 46 THR H A 46 THR HG2% 1.0 0.0 4.27 912 750 A 47 PHE H A 46 THR HG2% 1.0 0.0 3.78 913 751 A 56 GLN HA A 46 THR HG2% 1.0 0.0 4.41 914 752 A 46 THR HA A 46 THR HG2% 1.0 0.0 3.35 915 753 A 46 THR HG2% A 56 GLN HGx 1.0 0.0 3.57 916 753 A 46 THR HG2% A 56 GLN HGy 1.0 0.0 3.57 917 754 A 46 THR HG2% A 54 GLN HGx 1.0 0.0 3.90 918 754 A 54 GLN HGy A 46 THR HG2% 1.0 0.0 3.90 919 755 A 46 THR HG2% A 56 GLN HB3 1.0 0.0 4.44 920 756 A 46 THR HA A 56 GLN HA 1.0 0.0 3.66 921 757 A 52 THR HA A 52 THR HB 1.0 0.0 3.15 922 758 A 53 GLU HA A 53 GLU HBx 1.0 0.0 3.15 923 758 A 53 GLU HBy A 53 GLU HA 1.0 0.0 3.15 924 759 A 54 GLN H A 53 GLU HBx 1.0 0.0 4.29 925 759 A 54 GLN H A 53 GLU HBy 1.0 0.0 4.29 926 760 A 53 GLU H A 53 GLU HGx 1.0 0.0 4.67 927 760 A 53 GLU H A 53 GLU HGy 1.0 0.0 4.67 928 761 A 54 GLN HA A 54 GLN HGx 1.0 0.0 3.68 929 761 A 54 GLN HGy A 54 GLN HA 1.0 0.0 3.68 930 762 A 55 ARG H A 55 ARG HGx 1.0 0.0 4.42 931 762 A 55 ARG H A 55 ARG HGy 1.0 0.0 4.42 932 763 A 56 GLN H A 55 ARG HGx 1.0 0.0 4.00 933 763 A 56 GLN H A 55 ARG HGy 1.0 0.0 4.00 934 764 A 121 LYS HA A 124 ARG HGx 1.0 0.0 4.44 935 765 A 67 PHE HD% A 69 ARG HDx 1.0 0.0 3.94 936 765 A 67 PHE HD% A 69 ARG HDy 1.0 0.0 3.94 937 766 A 69 ARG HBy A 69 ARG HDx 1.0 0.0 3.20 938 766 A 69 ARG HBx A 69 ARG HDx 1.0 0.0 3.20 939 766 A 69 ARG HDy A 69 ARG HBx 1.0 0.0 3.20 940 766 A 69 ARG HDy A 69 ARG HBy 1.0 0.0 3.20 941 767 A 57 ALA H A 56 GLN HGx 1.0 0.0 4.61 942 767 A 57 ALA H A 56 GLN HGy 1.0 0.0 4.61 943 768 A 56 GLN HA A 56 GLN HGx 1.0 0.0 3.87 944 768 A 56 GLN HA A 56 GLN HGy 1.0 0.0 3.87 945 769 A 55 ARG HA A 56 GLN HGx 1.0 0.0 4.59 946 769 A 56 GLN HGy A 55 ARG HA 1.0 0.0 4.59 947 770 A 46 THR HA A 56 GLN HGx 1.0 0.0 4.06 948 770 A 46 THR HA A 56 GLN HGy 1.0 0.0 4.06 949 771 A 57 ALA H A 57 ALA HB% 1.0 0.0 3.70 950 772 A 58 GLY H A 57 ALA HB% 1.0 0.0 3.62 951 773 A 71 HIS H A 57 ALA HB% 1.0 0.0 4.47 952 774 A 47 PHE HD% A 57 ALA HB% 1.0 0.0 4.84 953 775 A 47 PHE HE% A 57 ALA HB% 1.0 0.0 3.52 954 776 A 70 PHE HD% A 57 ALA HB% 1.0 0.0 3.78 955 777 A 72 TRP HA A 57 ALA HB% 1.0 0.0 3.83 956 778 A 57 ALA HB% A 70 PHE HBx 1.0 0.0 3.91 957 778 A 70 PHE HBy A 57 ALA HB% 1.0 0.0 3.91 958 779 A 57 ALA HB% A 45 VAL HG1% 1.0 0.0 4.51 959 780 A 57 ALA HB% A 45 VAL HG2% 1.0 0.0 4.51 960 781 A 72 TRP HA A 57 ALA HA 1.0 0.0 4.08 961 782 A 73 LEU HB2 A 57 ALA HA 1.0 0.0 4.23 962 783 A 10 TYR HD% A 99 ILE HD1% 1.0 0.0 3.79 963 784 A 99 ILE HD1% A 99 ILE HA 1.0 0.0 3.54 964 785 A 99 ILE HD1% A 84 ILE HA 1.0 0.0 3.63 965 786 A 59 ILE HD1% A 43 LYS HA 1.0 0.0 3.84 966 787 A 59 ILE HD1% A 59 ILE HA 1.0 0.0 4.04 967 788 A 59 ILE HB A 59 ILE HD1% 1.0 0.0 3.24 968 789 A 99 ILE HD1% A 84 ILE HG2% 1.0 0.0 3.37 969 790 A 99 ILE HD1% A 99 ILE HG2% 1.0 0.0 3.45 970 791 A 60 VAL H A 59 ILE HG2% 1.0 0.0 3.85 971 792 A 59 ILE H A 59 ILE HG2% 1.0 0.0 4.42 972 793 A 69 ARG H A 59 ILE HG2% 1.0 0.0 4.74 973 794 A 61 ALA H A 59 ILE HG2% 1.0 0.0 3.75 974 795 A 61 ALA HA A 59 ILE HG2% 1.0 0.0 4.41 975 796 A 59 ILE HA A 59 ILE HG2% 1.0 0.0 3.42 976 797 A 68 ILE HG12 A 59 ILE HG2% 1.0 0.0 4.80 977 798 A 59 ILE HA A 59 ILE HG1x 1.0 0.0 4.44 978 799 A 59 ILE HA A 59 ILE HG1y 1.0 0.0 4.44 979 800 A 60 VAL H A 60 VAL HGx% 1.0 0.0 3.29 980 800 A 60 VAL HGy% A 60 VAL H 1.0 0.0 3.29 981 801 A 70 PHE HA A 60 VAL HGx% 1.0 0.0 4.08 982 801 A 70 PHE HA A 60 VAL HGy% 1.0 0.0 4.08 983 802 A 60 VAL HA A 60 VAL HGx% 1.0 0.0 3.12 984 802 A 60 VAL HGy% A 60 VAL HA 1.0 0.0 3.12 985 803 A 60 VAL HGy% A 71 HIS HBx 1.0 0.0 3.20 986 803 A 60 VAL HGx% A 71 HIS HBx 1.0 0.0 3.20 987 803 A 71 HIS HBy A 60 VAL HGx% 1.0 0.0 3.20 988 803 A 71 HIS HBy A 60 VAL HGy% 1.0 0.0 3.20 989 804 A 60 VAL HB A 61 ALA H 1.0 0.0 4.06 990 805 A 61 ALA H A 61 ALA HB% 1.0 0.0 3.78 991 806 A 61 ALA HB% A 67 PHE HD% 1.0 0.0 4.22 992 807 A 61 ALA HB% A 60 VAL HGx% 1.0 0.0 3.30 993 807 A 60 VAL HGy% A 61 ALA HB% 1.0 0.0 3.30 994 808 A 112 LYS H A 111 LEU HB2 1.0 0.0 4.65 995 809 A 62 ILE HB A 70 PHE HE% 1.0 0.0 5.78 996 810 A 63 ARG H A 62 ILE HA 1.0 0.0 3.48 997 811 A 62 ILE HD1% A 62 ILE HA 1.0 0.0 3.95 998 812 A 25 SER H A 62 ILE HD1% 1.0 0.0 5.09 999 813 A 62 ILE HD1% A 25 SER HA 1.0 0.0 4.76 1000 814 A 62 ILE HD1% A 25 SER HB3 1.0 0.0 4.14 1001 815 A 62 ILE HB A 62 ILE HD1% 1.0 0.0 3.08 1002 816 A 68 ILE HD1% A 62 ILE HD1% 1.0 0.0 3.07 1003 817 A 62 ILE HD1% A 68 ILE HG12 1.0 0.0 4.30 1004 818 A 62 ILE H A 62 ILE HG2% 1.0 0.0 3.51 1005 819 A 62 ILE HA A 62 ILE HG2% 1.0 0.0 3.78 1006 820 A 59 ILE HG2% A 62 ILE HG2% 1.0 0.0 3.35 1007 821 A 62 ILE HB A 62 ILE HG1x 1.0 0.0 3.04 1008 821 A 62 ILE HB A 62 ILE HG1y 1.0 0.0 3.04 1009 822 A 68 ILE HD1% A 62 ILE HG1x 1.0 0.0 4.33 1010 822 A 68 ILE HD1% A 62 ILE HG1y 1.0 0.0 4.33 1011 823 A 67 PHE HD% A 66 SER HB3 1.0 0.0 4.76 1012 824 A 67 PHE HA A 85 LYS HA 1.0 0.0 4.04 1013 825 A 67 PHE HD% A 68 ILE HB 1.0 0.0 5.75 1014 826 A 68 ILE HB A 70 PHE HE% 1.0 0.0 5.78 1015 827 A 68 ILE HD1% A 69 ARG H 1.0 0.0 4.70 1016 828 A 68 ILE HD1% A 70 PHE HE% 1.0 0.0 3.49 1017 829 A 68 ILE HD1% A 68 ILE HA 1.0 0.0 4.25 1018 830 A 68 ILE HD1% A 25 SER HA 1.0 0.0 3.49 1019 831 A 68 ILE HD1% A 25 SER HB3 1.0 0.0 3.90 1020 832 A 68 ILE HD1% A 25 SER HB2 1.0 0.0 3.51 1021 833 A 68 ILE HD1% A 24 ILE HG1x 1.0 0.0 3.23 1022 833 A 68 ILE HD1% A 24 ILE HG1y 1.0 0.0 3.23 1023 834 A 68 ILE H A 68 ILE HG2% 1.0 0.0 3.62 1024 835 A 84 ILE H A 68 ILE HG2% 1.0 0.0 3.96 1025 836 A 68 ILE HG2% A 70 PHE HE% 1.0 0.0 4.39 1026 837 A 70 PHE HD% A 68 ILE HG2% 1.0 0.0 4.68 1027 838 A 68 ILE HA A 68 ILE HG2% 1.0 0.0 4.14 1028 839 A 68 ILE HG2% A 24 ILE HB 1.0 0.0 4.89 1029 840 A 84 ILE HB A 68 ILE HG2% 1.0 0.0 3.55 1030 841 A 68 ILE HD1% A 68 ILE HG2% 1.0 0.0 3.12 1031 842 A 68 ILE HG12 A 68 ILE HG2% 1.0 0.0 3.65 1032 843 A 68 ILE HG13 A 70 PHE HE% 1.0 0.0 5.38 1033 844 A 10 TYR HE% A 99 ILE HG1y 1.0 0.0 4.77 1034 845 A 68 ILE HG13 A 68 ILE HA 1.0 0.0 4.41 1035 846 A 99 ILE HG2% A 99 ILE HG1y 1.0 0.0 3.99 1036 847 A 70 PHE HA A 59 ILE HA 1.0 0.0 4.00 1037 848 A 73 LEU H A 73 LEU HG 1.0 0.0 4.14 1038 849 A 56 GLN HB2 A 73 LEU HG 1.0 0.0 4.11 1039 850 A 73 LEU HB2 A 73 LEU HG 1.0 0.0 3.02 1040 851 A 110 ASP H A 110 ASP HBx 1.0 0.0 4.05 1041 852 A 76 GLU H A 76 GLU HGy 1.0 0.0 5.78 1042 853 A 78 GLU H A 78 GLU HGx 1.0 0.0 5.67 1043 853 A 78 GLU H A 78 GLU HGy 1.0 0.0 5.67 1044 854 A 90 GLU H A 90 GLU HGx 1.0 0.0 4.18 1045 854 A 90 GLU H A 90 GLU HGy 1.0 0.0 4.18 1046 855 A 88 TYR HD% A 90 GLU HGx 1.0 0.0 4.06 1047 855 A 88 TYR HD% A 90 GLU HGy 1.0 0.0 4.06 1048 856 A 76 GLU HA A 76 GLU HGy 1.0 0.0 4.16 1049 857 A 76 GLU HA A 76 GLU HGx 1.0 0.0 4.16 1050 858 A 90 GLU HA A 90 GLU HGx 1.0 0.0 3.80 1051 858 A 90 GLU HA A 90 GLU HGy 1.0 0.0 3.80 1052 859 A 102 PHE HD% A 80 ASP HA 1.0 0.0 4.89 1053 860 A 81 TYR HD% A 82 PHE HA 1.0 0.0 5.22 1054 861 A 82 PHE HD% A 82 PHE HA 1.0 0.0 5.39 1055 862 A 98 GLU HA A 98 GLU HGx 1.0 0.0 3.87 1056 862 A 98 GLU HA A 98 GLU HGy 1.0 0.0 3.87 1057 863 A 84 ILE HB A 84 ILE HD1% 1.0 0.0 3.82 1058 864 A 84 ILE HD1% A 21 TRP HH2 1.0 0.0 4.57 1059 865 A 82 PHE HD% A 84 ILE HD1% 1.0 0.0 3.78 1060 866 A 84 ILE HD1% A 84 ILE HA 1.0 0.0 4.33 1061 867 A 84 ILE HD1% A 24 ILE HB 1.0 0.0 4.69 1062 868 A 84 ILE HD1% A 68 ILE HG2% 1.0 0.0 3.07 1063 869 A 84 ILE HD1% A 84 ILE HG2% 1.0 0.0 3.41 1064 870 A 24 ILE HD1% A 84 ILE HD1% 1.0 0.0 3.46 1065 871 A 84 ILE HA A 84 ILE HG2% 1.0 0.0 3.43 1066 872 A 96 VAL HGx% A 98 GLU HGx 1.0 0.0 3.83 1067 872 A 96 VAL HGy% A 98 GLU HGx 1.0 0.0 3.83 1068 872 A 98 GLU HGy A 96 VAL HGx% 1.0 0.0 3.83 1069 872 A 96 VAL HGy% A 98 GLU HGy 1.0 0.0 3.83 1070 873 A 97 LEU HD1% A 86 MET HA 1.0 0.0 4.22 1071 874 A 86 MET HB3 A 95 TYR HB3 1.0 0.0 4.75 1072 875 A 21 TRP H A 86 MET HE% 1.0 0.0 4.18 1073 876 A 95 TYR HD% A 86 MET HE% 1.0 0.0 4.02 1074 877 A 86 MET HE% A 95 TYR HE% 1.0 0.0 4.73 1075 878 A 21 TRP HB3 A 86 MET HE% 1.0 0.0 4.30 1076 879 A 86 MET HE% A 18 ASN HB2 1.0 0.0 3.99 1077 880 A 86 MET HB3 A 86 MET HE% 1.0 0.0 3.31 1078 881 A 20 LEU HB2 A 86 MET HE% 1.0 0.0 3.65 1079 882 A 97 LEU HD1% A 86 MET HE% 1.0 0.0 4.05 1080 883 A 97 LEU HD2% A 86 MET HE% 1.0 0.0 4.13 1081 884 A 92 THR H A 89 ASN HBx 1.0 0.0 4.79 1082 885 A 91 LEU H A 91 LEU HBx 1.0 0.0 4.16 1083 886 A 92 THR HG2% A 92 THR HA 1.0 0.0 3.37 1084 887 A 88 TYR HE% A 93 GLY HAx 1.0 0.0 4.30 1085 888 A 94 ASP H A 94 ASP HBx 1.0 0.0 4.22 1086 889 A 10 TYR H A 96 VAL HGx% 1.0 0.0 4.42 1087 889 A 10 TYR H A 96 VAL HGy% 1.0 0.0 4.42 1088 890 A 39 VAL HA A 39 VAL HG1% 1.0 0.0 3.66 1089 891 A 97 LEU HA A 86 MET HA 1.0 0.0 4.26 1090 892 A 97 LEU HA A 97 LEU HD1% 1.0 0.0 3.89 1091 893 A 97 LEU HD2% A 97 LEU HA 1.0 0.0 4.63 1092 894 A 97 LEU H A 97 LEU HB3 1.0 0.0 4.18 1093 895 A 97 LEU HD1% A 97 LEU HB3 1.0 0.0 3.99 1094 896 A 97 LEU HD2% A 97 LEU HB3 1.0 0.0 3.63 1095 897 A 97 LEU H A 97 LEU HD2% 1.0 0.0 4.49 1096 898 A 97 LEU HD2% A 10 TYR HBy 1.0 0.0 4.46 1097 899 A 97 LEU HD2% A 10 TYR HBx 1.0 0.0 4.46 1098 900 A 96 VAL HA A 97 LEU HB2 1.0 0.0 4.79 1099 901 A 97 LEU HD2% A 97 LEU HB2 1.0 0.0 3.63 1100 902 A 98 GLU HA A 9 GLU HGx 1.0 0.0 4.57 1101 902 A 98 GLU HA A 9 GLU HGy 1.0 0.0 4.57 1102 903 A 99 ILE HD1% A 85 LYS H 1.0 0.0 4.25 1103 904 A 99 ILE HD1% A 21 TRP HZ2 1.0 0.0 3.76 1104 905 A 99 ILE HD1% A 10 TYR HE% 1.0 0.0 4.02 1105 906 A 99 ILE HD1% A 84 ILE HG13 1.0 0.0 4.55 1106 907 A 99 ILE H A 99 ILE HG2% 1.0 0.0 4.57 1107 908 A 100 THR H A 99 ILE HG2% 1.0 0.0 3.85 1108 909 A 99 ILE HG2% A 21 TRP HZ2 1.0 0.0 5.16 1109 910 A 99 ILE HA A 99 ILE HG2% 1.0 0.0 3.65 1110 911 A 99 ILE HG2% A 101 ASP HBy 1.0 0.0 4.61 1111 912 A 99 ILE HG2% A 101 ASP HBx 1.0 0.0 4.61 1112 913 A 99 ILE HG2% A 99 ILE HG1x 1.0 0.0 3.99 1113 914 A 100 THR HB A 83 GLU HBx 1.0 0.0 4.19 1114 914 A 100 THR HB A 83 GLU HBy 1.0 0.0 4.19 1115 915 A 8 LEU H A 100 THR HA 1.0 0.0 4.22 1116 916 A 100 THR HG2% A 100 THR HA 1.0 0.0 3.66 1117 917 A 100 THR HG2% A 81 TYR HE% 1.0 0.0 3.86 1118 918 A 100 THR HG2% A 5 LYS HEx 1.0 0.0 3.80 1119 918 A 100 THR HG2% A 5 LYS HEy 1.0 0.0 3.80 1120 919 A 102 PHE HD% A 101 ASP HA 1.0 0.0 4.23 1121 920 A 82 PHE HA A 101 ASP HA 1.0 0.0 4.13 1122 921 A 6 ILE HD1% A 101 ASP HBy 1.0 0.0 4.92 1123 922 A 102 PHE HA A 5 LYS HA 1.0 0.0 4.05 1124 923 A 103 SER H A 103 SER HBx 1.0 0.0 4.37 1125 924 A 111 LEU HDy% A 103 SER HBx 1.0 0.0 5.03 1126 924 A 103 SER HBx A 111 LEU HDx% 1.0 0.0 5.03 1127 925 A 103 SER H A 103 SER HBy 1.0 0.0 4.37 1128 926 A 111 LEU HDy% A 103 SER HBy 1.0 0.0 5.03 1129 926 A 103 SER HBy A 111 LEU HDx% 1.0 0.0 5.03 1130 927 A 6 ILE HG2% A 103 SER HBy 1.0 0.0 5.67 1131 928 A 104 GLU H A 104 GLU HGy 1.0 0.0 4.26 1132 929 A 104 GLU H A 104 GLU HGx 1.0 0.0 4.26 1133 930 A 105 ALA HB% A 105 ALA H 1.0 0.0 3.84 1134 931 A 106 ASP H A 105 ALA HB% 1.0 0.0 3.85 1135 932 A 106 ASP HA A 106 ASP HBx 1.0 0.0 3.11 1136 932 A 106 ASP HBy A 106 ASP HA 1.0 0.0 3.11 1137 933 A 108 ALA HB% A 108 ALA H 1.0 0.0 3.03 1138 934 A 108 ALA HB% A 109 ASP HA 1.0 0.0 4.34 1139 935 A 111 LEU HB3 A 108 ALA HA 1.0 0.0 4.06 1140 936 A 111 LEU HB2 A 108 ALA HA 1.0 0.0 4.03 1141 937 A 108 ALA HA A 111 LEU HG 1.0 0.0 4.77 1142 938 A 108 ALA HA A 111 LEU HDx% 1.0 0.0 4.99 1143 938 A 111 LEU HDy% A 108 ALA HA 1.0 0.0 4.99 1144 939 A 111 LEU HA A 111 LEU HDx% 1.0 0.0 3.70 1145 939 A 111 LEU HDy% A 111 LEU HA 1.0 0.0 3.70 1146 940 A 111 LEU HB3 A 111 LEU HDx% 1.0 0.0 4.34 1147 940 A 111 LEU HB3 A 111 LEU HDy% 1.0 0.0 4.34 1148 941 A 111 LEU HG A 103 SER HBy 1.0 0.0 4.63 1149 942 A 111 LEU HG A 103 SER HBx 1.0 0.0 4.63 1150 943 A 56 GLN HB3 A 73 LEU HG 1.0 0.0 4.01 1151 944 A 113 GLU H A 112 LYS HBy 1.0 0.0 4.24 1152 945 A 110 ASP HA A 113 GLU HBx 1.0 0.0 3.87 1153 945 A 113 GLU HBy A 110 ASP HA 1.0 0.0 3.87 1154 946 A 113 GLU H A 113 GLU HGx 1.0 0.0 4.35 1155 946 A 113 GLU H A 113 GLU HGy 1.0 0.0 4.35 1156 947 A 110 ASP HA A 113 GLU HGx 1.0 0.0 4.48 1157 947 A 110 ASP HA A 113 GLU HGy 1.0 0.0 4.48 1158 948 A 113 GLU HA A 113 GLU HGx 1.0 0.0 3.77 1159 948 A 113 GLU HA A 113 GLU HGy 1.0 0.0 3.77 1160 949 A 113 GLU HBx A 113 GLU HGx 1.0 0.0 3.14 1161 949 A 113 GLU HBy A 113 GLU HGx 1.0 0.0 3.14 1162 949 A 113 GLU HGy A 113 GLU HBx 1.0 0.0 3.14 1163 949 A 113 GLU HBy A 113 GLU HGy 1.0 0.0 3.14 1164 950 A 114 LEU H A 114 LEU HBx 1.0 0.0 3.72 1165 951 A 111 LEU HA A 114 LEU HBx 1.0 0.0 4.77 1166 952 A 115 TRP H A 114 LEU HD2% 1.0 0.0 5.22 1167 953 A 114 LEU HA A 114 LEU HD2% 1.0 0.0 3.99 1168 954 A 114 LEU HD2% A 114 LEU HBy 1.0 0.0 4.00 1169 955 A 114 LEU HBx A 114 LEU HD2% 1.0 0.0 4.00 1170 956 A 111 LEU HA A 114 LEU HBy 1.0 0.0 4.77 1171 957 A 115 TRP H A 114 LEU HG 1.0 0.0 5.16 1172 958 A 114 LEU HG A 114 LEU HA 1.0 0.0 4.18 1173 959 A 117 SER H A 116 ASP HBy 1.0 0.0 4.29 1174 960 A 113 GLU HA A 116 ASP HBy 1.0 0.0 4.28 1175 961 A 117 SER HA A 117 SER HBx 1.0 0.0 3.15 1176 961 A 117 SER HBy A 117 SER HA 1.0 0.0 3.15 1177 962 A 119 VAL HA A 119 VAL HGy% 1.0 0.0 4.00 1178 963 A 119 VAL H A 119 VAL HGy% 1.0 0.0 4.15 1179 964 A 119 VAL H A 119 VAL HGx% 1.0 0.0 4.15 1180 965 A 120 SER H A 119 VAL HGx% 1.0 0.0 4.53 1181 966 A 119 VAL HA A 119 VAL HGx% 1.0 0.0 4.00 1182 967 A 116 ASP HA A 119 VAL HB 1.0 0.0 4.34 1183 968 A 121 LYS HA A 124 ARG HBx 1.0 0.0 4.23 1184 968 A 121 LYS HA A 124 ARG HBy 1.0 0.0 4.23 1185 969 A 122 LEU H A 121 LYS HBx 1.0 0.0 4.59 1186 970 A 122 LEU H A 121 LYS HBy 1.0 0.0 4.59 1187 971 A 122 LEU HA A 125 THR HG2% 1.0 0.0 4.19 1188 972 A 122 LEU HA A 122 LEU HD1% 1.0 0.0 4.76 1189 973 A 122 LEU HA A 122 LEU HD2% 1.0 0.0 4.76 1190 974 A 124 ARG H A 123 ARG HBx 1.0 0.0 4.39 1191 974 A 124 ARG H A 123 ARG HBy 1.0 0.0 4.39 1192 975 A 121 LYS HA A 124 ARG HGy 1.0 0.0 4.44 1193 976 A 124 ARG H A 124 ARG HDx 1.0 0.0 4.25 1194 976 A 124 ARG H A 124 ARG HDy 1.0 0.0 4.25 1195 977 A 121 LYS HA A 124 ARG HDx 1.0 0.0 3.68 1196 977 A 121 LYS HA A 124 ARG HDy 1.0 0.0 3.68 1197 978 A 124 ARG HBy A 124 ARG HDx 1.0 0.0 3.38 1198 978 A 124 ARG HBx A 124 ARG HDx 1.0 0.0 3.38 1199 978 A 124 ARG HDy A 124 ARG HBx 1.0 0.0 3.38 1200 978 A 124 ARG HBy A 124 ARG HDy 1.0 0.0 3.38 1201 979 A 125 THR H A 125 THR HB 1.0 0.0 3.48 1202 980 A 122 LEU HA A 125 THR HB 1.0 0.0 4.58 1203 981 A 126 CYS H A 125 THR HG2% 1.0 0.0 4.43 1204 982 A 125 THR HG2% A 125 THR HA 1.0 0.0 3.48 1205 983 A 129 LEU HA A 129 LEU HDy% 1.0 0.0 4.18 1206 984 A 129 LEU HA A 129 LEU HDx% 1.0 0.0 4.18 1207 985 A 7 HIS H A 8 LEU HDx% 1.0 0.0 5.02 1208 985 A 7 HIS H A 8 LEU HDy% 1.0 0.0 5.02 1209 986 A 130 GLU H A 129 LEU HDy% 1.0 0.0 5.78 1210 987 A 130 GLU HA A 130 GLU HGx 1.0 0.0 3.90 1211 987 A 130 GLU HGy A 130 GLU HA 1.0 0.0 3.90 1212 988 A 3 LYS HA A 104 GLU HBx 1.0 0.0 5.53 1213 988 A 3 LYS HA A 104 GLU HBy 1.0 0.0 5.53 1214 989 A 3 LYS HA A 103 SER H 1.0 0.0 5.78 1215 990 A 3 LYS HA A 3 LYS HGy 1.0 0.0 4.29 1216 991 A 6 ILE HG2% A 4 GLU HGx 1.0 0.0 4.49 1217 991 A 4 GLU HGy A 6 ILE HG2% 1.0 0.0 4.49 1218 992 A 108 ALA HB% A 4 GLU HGx 1.0 0.0 5.78 1219 992 A 4 GLU HGy A 108 ALA HB% 1.0 0.0 5.78 1220 993 A 4 GLU HGy A 4 GLU HBx 1.0 0.0 3.04 1221 993 A 4 GLU HBx A 4 GLU HGx 1.0 0.0 3.04 1222 994 A 4 GLU HGy A 4 GLU HBy 1.0 0.0 3.04 1223 994 A 4 GLU HBy A 4 GLU HGx 1.0 0.0 3.04 1224 995 A 6 ILE HA A 4 GLU HGx 1.0 0.0 4.77 1225 995 A 4 GLU HGy A 6 ILE HA 1.0 0.0 4.77 1226 996 A 4 GLU HA A 4 GLU HGx 1.0 0.0 3.60 1227 996 A 4 GLU HGy A 4 GLU HA 1.0 0.0 3.60 1228 997 A 5 LYS HA A 100 THR HG2% 1.0 0.0 4.79 1229 998 A 5 LYS HA A 102 PHE HD% 1.0 0.0 5.28 1230 999 A 5 LYS HEy A 5 LYS HBy 1.0 0.0 4.82 1231 999 A 5 LYS HBy A 5 LYS HEx 1.0 0.0 4.82 1232 1000 A 5 LYS HA A 5 LYS HDx 1.0 0.0 5.03 1233 1000 A 5 LYS HA A 5 LYS HDy 1.0 0.0 5.03 1234 1001 A 5 LYS HA A 5 LYS HEx 1.0 0.0 5.06 1235 1001 A 5 LYS HA A 5 LYS HEy 1.0 0.0 5.06 1236 1002 A 5 LYS HA A 5 LYS HGy 1.0 0.0 4.43 1237 1003 A 6 ILE HA A 7 HIS HA 1.0 0.0 4.82 1238 1004 A 6 ILE HD1% A 101 ASP HBx 1.0 0.0 4.92 1239 1005 A 102 PHE HA A 6 ILE HD1% 1.0 0.0 5.12 1240 1006 A 7 HIS H A 6 ILE HD1% 1.0 0.0 5.64 1241 1007 A 112 LYS H A 6 ILE HD1% 1.0 0.0 5.09 1242 1008 A 101 ASP H A 6 ILE HD1% 1.0 0.0 4.60 1243 1009 A 6 ILE H A 6 ILE HD1% 1.0 0.0 4.64 1244 1010 A 6 ILE HG13 A 7 HIS HA 1.0 0.0 4.92 1245 1011 A 6 ILE HG2% A 103 SER HBx 1.0 0.0 5.67 1246 1012 A 8 LEU HA A 9 GLU HA 1.0 0.0 4.77 1247 1013 A 8 LEU HA A 7 HIS HA 1.0 0.0 4.66 1248 1014 A 10 TYR HE% A 8 LEU HDx% 1.0 0.0 4.92 1249 1014 A 8 LEU HDy% A 10 TYR HE% 1.0 0.0 4.92 1250 1015 A 99 ILE HG2% A 8 LEU HDx% 1.0 0.0 4.29 1251 1015 A 8 LEU HDy% A 99 ILE HG2% 1.0 0.0 4.29 1252 1016 A 10 TYR HE% A 8 LEU HG 1.0 0.0 4.90 1253 1017 A 115 TRP H A 8 LEU HG 1.0 0.0 5.78 1254 1018 A 99 ILE HG2% A 8 LEU HG 1.0 0.0 5.78 1255 1019 A 9 GLU HA A 8 LEU HDx% 1.0 0.0 5.78 1256 1019 A 8 LEU HDy% A 9 GLU HA 1.0 0.0 5.78 1257 1020 A 9 GLU HA A 98 GLU HGx 1.0 0.0 5.78 1258 1020 A 9 GLU HA A 98 GLU HGy 1.0 0.0 5.78 1259 1021 A 10 TYR HD% A 9 GLU HA 1.0 0.0 4.87 1260 1022 A 8 LEU HA A 9 GLU HBx 1.0 0.0 5.66 1261 1022 A 8 LEU HA A 9 GLU HBy 1.0 0.0 5.66 1262 1023 A 9 GLU HBy A 9 GLU HGx 1.0 0.0 3.02 1263 1023 A 9 GLU HBx A 9 GLU HGx 1.0 0.0 3.02 1264 1023 A 9 GLU HGy A 9 GLU HBx 1.0 0.0 3.02 1265 1023 A 9 GLU HBy A 9 GLU HGy 1.0 0.0 3.02 1266 1024 A 8 LEU HB3 A 9 GLU HBx 1.0 0.0 5.78 1267 1024 A 9 GLU HBy A 8 LEU HB3 1.0 0.0 5.78 1268 1025 A 9 GLU HBy A 96 VAL HGx% 1.0 0.0 4.41 1269 1025 A 9 GLU HBx A 96 VAL HGx% 1.0 0.0 4.41 1270 1025 A 96 VAL HGy% A 9 GLU HBx 1.0 0.0 4.41 1271 1025 A 9 GLU HBy A 96 VAL HGy% 1.0 0.0 4.41 1272 1026 A 20 LEU HB2 A 18 ASN HA 1.0 0.0 4.24 1273 1027 A 10 TYR HA A 11 LEU HA 1.0 0.0 4.77 1274 1028 A 10 TYR HD% A 10 TYR HA 1.0 0.0 3.58 1275 1029 A 11 LEU H A 12 LEU HA 1.0 0.0 5.33 1276 1030 A 13 ASN HA A 12 LEU HDx% 1.0 0.0 4.85 1277 1030 A 12 LEU HDy% A 13 ASN HA 1.0 0.0 4.85 1278 1031 A 13 ASN HA A 14 ALA HA 1.0 0.0 5.19 1279 1032 A 15 THR HG2% A 15 THR HA 1.0 0.0 3.39 1280 1033 A 21 TRP H A 18 ASN HA 1.0 0.0 4.86 1281 1034 A 22 SER H A 18 ASN HA 1.0 0.0 5.40 1282 1035 A 20 LEU H A 18 ASN HA 1.0 0.0 5.10 1283 1036 A 95 TYR HE% A 18 ASN HA 1.0 0.0 4.23 1284 1037 A 86 MET HE% A 18 ASN HA 1.0 0.0 3.73 1285 1038 A 22 SER H A 19 ILE HA 1.0 0.0 4.78 1286 1039 A 20 LEU H A 19 ILE HD1% 1.0 0.0 4.71 1287 1040 A 18 ASN HB3 A 19 ILE HD1% 1.0 0.0 5.57 1288 1041 A 19 ILE HD1% A 19 ILE HG2% 1.0 0.0 3.21 1289 1042 A 20 LEU HA A 21 TRP HA 1.0 0.0 5.04 1290 1043 A 19 ILE HB A 20 LEU HA 1.0 0.0 4.49 1291 1044 A 18 ASN HA A 20 LEU HG 1.0 0.0 5.66 1292 1045 A 24 ILE H A 21 TRP HA 1.0 0.0 4.19 1293 1046 A 23 ALA HB% A 21 TRP HA 1.0 0.0 5.47 1294 1047 A 23 ALA HB% A 24 ILE HA 1.0 0.0 5.78 1295 1048 A 24 ILE HB A 30 LEU HG 1.0 0.0 5.74 1296 1049 A 24 ILE HB A 30 LEU HDy% 1.0 0.0 5.78 1297 1050 A 24 ILE HD1% A 68 ILE H 1.0 0.0 5.59 1298 1051 A 24 ILE HD1% A 70 PHE HE% 1.0 0.0 5.78 1299 1052 A 24 ILE H A 24 ILE HG1x 1.0 0.0 4.49 1300 1052 A 24 ILE H A 24 ILE HG1y 1.0 0.0 4.49 1301 1053 A 68 ILE HB A 24 ILE HG1x 1.0 0.0 4.71 1302 1053 A 68 ILE HB A 24 ILE HG1y 1.0 0.0 4.71 1303 1054 A 23 ALA H A 24 ILE HG2% 1.0 0.0 5.26 1304 1055 A 24 ILE HG2% A 33 TRP HE1 1.0 0.0 4.76 1305 1056 A 24 ILE HG2% A 22 SER HA 1.0 0.0 5.78 1306 1057 A 24 ILE HG2% A 23 ALA HA 1.0 0.0 5.78 1307 1058 A 26 THR HB A 27 PRO HDy 1.0 0.0 4.08 1308 1059 A 26 THR HB A 27 PRO HDx 1.0 0.0 4.08 1309 1060 A 30 LEU H A 27 PRO HA 1.0 0.0 4.67 1310 1061 A 28 THR HG2% A 27 PRO HDy 1.0 0.0 5.48 1311 1062 A 28 THR HG2% A 27 PRO HDx 1.0 0.0 5.48 1312 1063 A 27 PRO HG3 A 28 THR HG2% 1.0 0.0 4.95 1313 1064 A 28 THR HG2% A 27 PRO HBx 1.0 0.0 4.80 1314 1064 A 27 PRO HBy A 28 THR HG2% 1.0 0.0 4.80 1315 1065 A 30 LEU HA A 32 ASP HBx 1.0 0.0 5.78 1316 1065 A 32 ASP HBy A 30 LEU HA 1.0 0.0 5.78 1317 1066 A 30 LEU HA A 38 VAL HG2% 1.0 0.0 5.78 1318 1067 A 23 ALA HB% A 32 ASP HBx 1.0 0.0 4.01 1319 1067 A 23 ALA HB% A 32 ASP HBy 1.0 0.0 4.01 1320 1068 A 33 TRP HA A 34 PHE HA 1.0 0.0 4.79 1321 1069 A 30 LEU HA A 34 PHE HB3 1.0 0.0 5.18 1322 1070 A 34 PHE HB3 A 35 ALA HB% 1.0 0.0 4.14 1323 1071 A 38 VAL H A 37 LYS HB2 1.0 0.0 5.08 1324 1072 A 36 ASP HBx A 37 LYS HGy 1.0 0.0 5.78 1325 1072 A 36 ASP HBy A 37 LYS HGy 1.0 0.0 5.78 1326 1073 A 36 ASP HBy A 37 LYS HGx 1.0 0.0 5.78 1327 1073 A 37 LYS HGx A 36 ASP HBx 1.0 0.0 5.78 1328 1074 A 38 VAL HA A 37 LYS HB3 1.0 0.0 4.78 1329 1075 A 47 PHE HB3 A 38 VAL HA 1.0 0.0 5.06 1330 1076 A 37 LYS H A 38 VAL HA 1.0 0.0 5.09 1331 1077 A 30 LEU HA A 38 VAL HG1% 1.0 0.0 5.78 1332 1078 A 40 SER H A 39 VAL HB 1.0 0.0 4.96 1333 1079 A 40 SER HA A 45 VAL HG1% 1.0 0.0 4.59 1334 1080 A 40 SER HA A 45 VAL HG2% 1.0 0.0 4.59 1335 1081 A 46 THR H A 40 SER HA 1.0 0.0 4.39 1336 1082 A 41 ASP H A 42 ASP HA 1.0 0.0 5.01 1337 1083 A 43 LYS HA A 42 ASP HBx 1.0 0.0 5.78 1338 1083 A 43 LYS HA A 42 ASP HBy 1.0 0.0 5.78 1339 1084 A 41 ASP HA A 42 ASP HBx 1.0 0.0 4.46 1340 1084 A 42 ASP HBy A 41 ASP HA 1.0 0.0 4.46 1341 1085 A 43 LYS HA A 43 LYS HDx 1.0 0.0 4.71 1342 1085 A 43 LYS HA A 43 LYS HDy 1.0 0.0 4.71 1343 1086 A 59 ILE H A 44 THR HA 1.0 0.0 4.24 1344 1087 A 56 GLN HB3 A 44 THR HB 1.0 0.0 4.78 1345 1088 A 44 THR HG2% A 56 GLN HB2 1.0 0.0 4.56 1346 1089 A 44 THR HG2% A 45 VAL HG1% 1.0 0.0 5.18 1347 1090 A 44 THR HG2% A 45 VAL HG2% 1.0 0.0 5.18 1348 1091 A 56 GLN HA A 44 THR HG2% 1.0 0.0 4.71 1349 1092 A 44 THR H A 45 VAL HA 1.0 0.0 5.78 1350 1093 A 41 ASP H A 45 VAL HA 1.0 0.0 4.41 1351 1094 A 46 THR HB A 45 VAL HA 1.0 0.0 5.57 1352 1095 A 46 THR H A 45 VAL HB 1.0 0.0 4.92 1353 1096 A 30 LEU HB2 A 45 VAL HG2% 1.0 0.0 5.78 1354 1097 A 55 ARG H A 47 PHE HA 1.0 0.0 5.25 1355 1098 A 47 PHE HD% A 47 PHE HA 1.0 0.0 3.78 1356 1099 A 53 GLU H A 52 THR HB 1.0 0.0 4.98 1357 1100 A 129 LEU H A 129 LEU HDx% 1.0 0.0 5.78 1358 1101 A 130 GLU H A 129 LEU HDx% 1.0 0.0 5.78 1359 1102 A 129 LEU HA A 128 PHE HBx 1.0 0.0 4.58 1360 1102 A 128 PHE HBy A 129 LEU HA 1.0 0.0 4.58 1361 1103 A 126 CYS HA A 127 GLY HAx 1.0 0.0 5.05 1362 1104 A 126 CYS HA A 127 GLY HAy 1.0 0.0 5.05 1363 1105 A 124 ARG HA A 124 ARG HDx 1.0 0.0 4.67 1364 1105 A 124 ARG HDy A 124 ARG HA 1.0 0.0 4.67 1365 1106 A 124 ARG HA A 123 ARG HBx 1.0 0.0 5.78 1366 1106 A 123 ARG HBy A 124 ARG HA 1.0 0.0 5.78 1367 1107 A 122 LEU HA A 123 ARG HA 1.0 0.0 5.09 1368 1108 A 122 LEU HA A 11 LEU HDx% 1.0 0.0 5.78 1369 1108 A 11 LEU HDy% A 122 LEU HA 1.0 0.0 5.78 1370 1109 A 115 TRP HA A 118 GLN HGx 1.0 0.0 4.35 1371 1109 A 118 GLN HGy A 115 TRP HA 1.0 0.0 4.35 1372 1110 A 111 LEU HA A 114 LEU HD2% 1.0 0.0 5.12 1373 1111 A 115 TRP HA A 114 LEU HA 1.0 0.0 5.21 1374 1112 A 114 LEU H A 113 GLU HGx 1.0 0.0 5.55 1375 1112 A 114 LEU H A 113 GLU HGy 1.0 0.0 5.55 1376 1113 A 112 LYS H A 112 LYS HEx 1.0 0.0 4.82 1377 1113 A 112 LYS H A 112 LYS HEy 1.0 0.0 4.82 1378 1114 A 3 LYS HA A 3 LYS HEx 1.0 0.0 5.13 1379 1114 A 3 LYS HA A 3 LYS HEy 1.0 0.0 5.13 1380 1115 A 112 LYS HA A 112 LYS HEx 1.0 0.0 4.98 1381 1115 A 112 LYS HA A 112 LYS HEy 1.0 0.0 4.98 1382 1116 A 111 LEU HB3 A 112 LYS HA 1.0 0.0 4.27 1383 1117 A 54 GLN HA A 46 THR HG2% 1.0 0.0 5.13 1384 1118 A 83 GLU HA A 69 ARG HBx 1.0 0.0 4.75 1385 1118 A 83 GLU HA A 69 ARG HBy 1.0 0.0 4.75 1386 1119 A 47 PHE HD% A 54 GLN HA 1.0 0.0 5.44 1387 1120 A 55 ARG H A 54 GLN HBx 1.0 0.0 4.95 1388 1120 A 55 ARG H A 54 GLN HBy 1.0 0.0 4.95 1389 1121 A 46 THR HG2% A 54 GLN HBx 1.0 0.0 5.51 1390 1121 A 46 THR HG2% A 54 GLN HBy 1.0 0.0 5.51 1391 1122 A 55 ARG HA A 54 GLN HGx 1.0 0.0 5.35 1392 1122 A 54 GLN HGy A 55 ARG HA 1.0 0.0 5.35 1393 1123 A 55 ARG HA A 55 ARG HDx 1.0 0.0 3.46 1394 1123 A 55 ARG HA A 55 ARG HDy 1.0 0.0 3.46 1395 1124 A 54 GLN HA A 55 ARG HGx 1.0 0.0 5.78 1396 1124 A 54 GLN HA A 55 ARG HGy 1.0 0.0 5.78 1397 1125 A 56 GLN HA A 57 ALA HB% 1.0 0.0 4.92 1398 1126 A 73 LEU HB2 A 56 GLN HGx 1.0 0.0 4.84 1399 1126 A 73 LEU HB2 A 56 GLN HGy 1.0 0.0 4.84 1400 1127 A 57 ALA HB% A 34 PHE HE% 1.0 0.0 5.78 1401 1128 A 45 VAL H A 57 ALA HB% 1.0 0.0 5.08 1402 1129 A 59 ILE HA A 70 PHE HD% 1.0 0.0 4.89 1403 1130 A 59 ILE HA A 61 ALA H 1.0 0.0 5.39 1404 1131 A 59 ILE HD1% A 44 THR HA 1.0 0.0 4.85 1405 1132 A 59 ILE HD1% A 70 PHE HD% 1.0 0.0 4.67 1406 1133 A 59 ILE HG2% A 70 PHE HE% 1.0 0.0 5.06 1407 1134 A 61 ALA HB% A 59 ILE HG2% 1.0 0.0 4.98 1408 1135 A 59 ILE HG2% A 69 ARG HGx 1.0 0.0 5.42 1409 1135 A 69 ARG HGy A 59 ILE HG2% 1.0 0.0 5.42 1410 1136 A 59 ILE HG2% A 60 VAL HA 1.0 0.0 3.93 1411 1137 A 60 VAL HB A 59 ILE HG2% 1.0 0.0 5.34 1412 1138 A 61 ALA HA A 62 ILE HG2% 1.0 0.0 5.30 1413 1139 A 61 ALA HA A 62 ILE HB 1.0 0.0 5.00 1414 1140 A 60 VAL H A 61 ALA HA 1.0 0.0 5.06 1415 1141 A 60 VAL H A 61 ALA HB% 1.0 0.0 4.92 1416 1142 A 61 ALA HB% A 62 ILE HA 1.0 0.0 4.78 1417 1143 A 67 PHE HE% A 62 ILE HA 1.0 0.0 4.68 1418 1144 A 62 ILE HD1% A 68 ILE HA 1.0 0.0 5.00 1419 1145 A 67 PHE HE% A 62 ILE HG1x 1.0 0.0 5.15 1420 1145 A 67 PHE HE% A 62 ILE HG1y 1.0 0.0 5.15 1421 1146 A 67 PHE HB3 A 66 SER HA 1.0 0.0 5.78 1422 1147 A 67 PHE HB3 A 66 SER HB3 1.0 0.0 4.78 1423 1148 A 65 TYR H A 66 SER HB3 1.0 0.0 5.44 1424 1149 A 66 SER HB2 A 65 TYR H 1.0 0.0 4.85 1425 1150 A 67 PHE HD% A 67 PHE HA 1.0 0.0 4.84 1426 1151 A 67 PHE HA A 84 ILE HA 1.0 0.0 5.78 1427 1152 A 85 LYS HA A 67 PHE HB3 1.0 0.0 5.11 1428 1153 A 68 ILE HA A 68 ILE HG12 1.0 0.0 3.64 1429 1154 A 68 ILE HA A 69 ARG HDx 1.0 0.0 3.77 1430 1154 A 69 ARG HDy A 68 ILE HA 1.0 0.0 3.77 1431 1155 A 67 PHE HA A 68 ILE HA 1.0 0.0 4.89 1432 1156 A 69 ARG H A 68 ILE HB 1.0 0.0 5.65 1433 1157 A 84 ILE H A 68 ILE HB 1.0 0.0 5.78 1434 1158 A 68 ILE HD1% A 62 ILE HB 1.0 0.0 4.38 1435 1159 A 67 PHE HA A 68 ILE HG2% 1.0 0.0 4.66 1436 1160 A 68 ILE HG2% A 69 ARG HDx 1.0 0.0 5.08 1437 1160 A 69 ARG HDy A 68 ILE HG2% 1.0 0.0 5.08 1438 1161 A 68 ILE HG2% A 69 ARG HBx 1.0 0.0 5.13 1439 1161 A 69 ARG HBy A 68 ILE HG2% 1.0 0.0 5.13 1440 1162 A 83 GLU HA A 69 ARG HA 1.0 0.0 4.33 1441 1163 A 70 PHE HD% A 69 ARG HA 1.0 0.0 4.78 1442 1164 A 60 VAL HGx% A 69 ARG HBx 1.0 0.0 5.01 1443 1164 A 60 VAL HGy% A 69 ARG HBx 1.0 0.0 5.01 1444 1164 A 69 ARG HBy A 60 VAL HGx% 1.0 0.0 5.01 1445 1164 A 60 VAL HGy% A 69 ARG HBy 1.0 0.0 5.01 1446 1165 A 72 TRP HA A 73 LEU HB2 1.0 0.0 4.77 1447 1166 A 57 ALA HA A 73 LEU HG 1.0 0.0 5.19 1448 1167 A 58 GLY H A 73 LEU HG 1.0 0.0 4.80 1449 1168 A 75 ASP HA A 76 GLU HBx 1.0 0.0 5.27 1450 1168 A 75 ASP HA A 76 GLU HBy 1.0 0.0 5.27 1451 1169 A 76 GLU HA A 77 ASN HA 1.0 0.0 5.06 1452 1170 A 78 GLU H A 77 ASN HBx 1.0 0.0 5.21 1453 1170 A 77 ASN HBy A 78 GLU H 1.0 0.0 5.21 1454 1171 A 77 ASN HA A 78 GLU HA 1.0 0.0 5.02 1455 1172 A 77 ASN HA A 78 GLU HBx 1.0 0.0 4.81 1456 1172 A 78 GLU HBy A 77 ASN HA 1.0 0.0 4.81 1457 1173 A 77 ASN HA A 78 GLU HGx 1.0 0.0 5.78 1458 1173 A 78 GLU HGy A 77 ASN HA 1.0 0.0 5.78 1459 1174 A 99 ILE HA A 84 ILE HA 1.0 0.0 4.48 1460 1175 A 84 ILE HA A 98 GLU H 1.0 0.0 5.23 1461 1176 A 99 ILE HG2% A 84 ILE HA 1.0 0.0 4.63 1462 1177 A 83 GLU HA A 84 ILE HB 1.0 0.0 5.08 1463 1178 A 85 LYS HA A 84 ILE HA 1.0 0.0 4.99 1464 1179 A 85 LYS HA A 67 PHE HB2 1.0 0.0 5.78 1465 1180 A 84 ILE H A 85 LYS HA 1.0 0.0 5.71 1466 1181 A 86 MET HA A 95 TYR HB3 1.0 0.0 5.53 1467 1182 A 87 SER H A 86 MET HE% 1.0 0.0 5.31 1468 1183 A 20 LEU H A 86 MET HE% 1.0 0.0 4.79 1469 1184 A 21 TRP HB2 A 86 MET HE% 1.0 0.0 4.26 1470 1185 A 20 LEU HB3 A 86 MET HE% 1.0 0.0 4.21 1471 1186 A 86 MET HB2 A 87 SER HA 1.0 0.0 4.63 1472 1187 A 86 MET H A 87 SER HA 1.0 0.0 5.18 1473 1188 A 88 TYR H A 87 SER HBy 1.0 0.0 4.95 1474 1189 A 88 TYR H A 87 SER HBx 1.0 0.0 4.95 1475 1190 A 88 TYR HA A 88 TYR HD% 1.0 0.0 4.19 1476 1191 A 88 TYR HA A 88 TYR HE% 1.0 0.0 4.69 1477 1192 A 87 SER HA A 88 TYR HBx 1.0 0.0 4.86 1478 1192 A 88 TYR HBy A 87 SER HA 1.0 0.0 4.86 1479 1193 A 91 LEU HG A 90 GLU HA 1.0 0.0 5.44 1480 1194 A 88 TYR HD% A 90 GLU HA 1.0 0.0 4.90 1481 1195 A 91 LEU H A 90 GLU HGx 1.0 0.0 4.83 1482 1195 A 91 LEU H A 90 GLU HGy 1.0 0.0 4.83 1483 1196 A 92 THR H A 91 LEU HD1% 1.0 0.0 5.22 1484 1197 A 92 THR H A 91 LEU HG 1.0 0.0 5.02 1485 1198 A 91 LEU H A 92 THR HA 1.0 0.0 5.08 1486 1199 A 95 TYR HD% A 95 TYR HA 1.0 0.0 4.73 1487 1200 A 95 TYR HA A 96 VAL HB 1.0 0.0 5.18 1488 1201 A 96 VAL HA A 97 LEU HA 1.0 0.0 5.78 1489 1202 A 97 LEU HA A 86 MET H 1.0 0.0 5.78 1490 1203 A 97 LEU HD1% A 86 MET HB2 1.0 0.0 4.30 1491 1204 A 10 TYR HD% A 97 LEU HD2% 1.0 0.0 4.70 1492 1205 A 97 LEU HD2% A 86 MET HB3 1.0 0.0 5.21 1493 1206 A 98 GLU HA A 96 VAL HGx% 1.0 0.0 4.80 1494 1206 A 98 GLU HA A 96 VAL HGy% 1.0 0.0 4.80 1495 1207 A 98 GLU HA A 99 ILE HB 1.0 0.0 4.96 1496 1208 A 98 GLU HA A 10 TYR H 1.0 0.0 4.82 1497 1209 A 9 GLU HBy A 98 GLU HGx 1.0 0.0 4.24 1498 1209 A 9 GLU HBx A 98 GLU HGx 1.0 0.0 4.24 1499 1209 A 98 GLU HGy A 9 GLU HBx 1.0 0.0 4.24 1500 1209 A 9 GLU HBy A 98 GLU HGy 1.0 0.0 4.24 1501 1210 A 9 GLU HA A 99 ILE HB 1.0 0.0 5.78 1502 1211 A 99 ILE HB A 100 THR HA 1.0 0.0 5.78 1503 1212 A 10 TYR HD% A 99 ILE HB 1.0 0.0 5.03 1504 1213 A 99 ILE HB A 8 LEU HDx% 1.0 0.0 4.92 1505 1213 A 8 LEU HDy% A 99 ILE HB 1.0 0.0 4.92 1506 1214 A 99 ILE HD1% A 98 GLU H 1.0 0.0 4.92 1507 1215 A 98 GLU HA A 99 ILE HD1% 1.0 0.0 4.89 1508 1216 A 82 PHE HD% A 99 ILE HG2% 1.0 0.0 5.08 1509 1217 A 99 ILE HG2% A 100 THR HA 1.0 0.0 4.99 1510 1218 A 6 ILE H A 100 THR HA 1.0 0.0 5.04 1511 1219 A 100 THR HB A 101 ASP H 1.0 0.0 5.05 1512 1220 A 100 THR HG2% A 101 ASP HA 1.0 0.0 4.73 1513 1221 A 102 PHE HA A 6 ILE HG12 1.0 0.0 4.97 1514 1222 A 102 PHE HA A 102 PHE HD% 1.0 0.0 4.76 1515 1223 A 105 ALA HB% A 106 ASP HBx 1.0 0.0 4.65 1516 1223 A 106 ASP HBy A 105 ALA HB% 1.0 0.0 4.65 1517 1224 A 105 ALA HB% A 106 ASP HA 1.0 0.0 4.47 1518 1225 A 105 ALA HB% A 108 ALA H 1.0 0.0 4.67 1519 1226 A 104 GLU H A 107 GLU HGx 1.0 0.0 5.30 1520 1226 A 104 GLU H A 107 GLU HGy 1.0 0.0 5.30 1521 1227 A 108 ALA HA A 103 SER HBx 1.0 0.0 4.38 1522 1228 A 108 ALA HA A 103 SER HBy 1.0 0.0 4.38 1523 1229 A 111 LEU H A 108 ALA HA 1.0 0.0 4.79 1524 1230 A 108 ALA HA A 110 ASP H 1.0 0.0 5.08 1525 1231 A 108 ALA HB% A 112 LYS HEx 1.0 0.0 4.82 1526 1231 A 108 ALA HB% A 112 LYS HEy 1.0 0.0 4.82 1527 1232 A 112 LYS H A 109 ASP HA 1.0 0.0 5.09 1528 1233 A 111 LEU HB3 A 108 ALA HB% 1.0 0.0 5.01 1529 1234 A 21 TRP HB3 A 24 ILE HD1% 1.0 0.0 5.34 1530 1235 A 21 TRP HB2 A 23 ALA H 1.0 0.0 5.78 1531 1236 A 21 TRP HB2 A 33 TRP HH2 1.0 0.0 5.78 1532 1237 A 20 LEU HB3 A 21 TRP HB2 1.0 0.0 5.38 1533 1238 A 21 TRP HB2 A 24 ILE HG1x 1.0 0.0 5.78 1534 1238 A 21 TRP HB2 A 24 ILE HG1y 1.0 0.0 5.78 1535 1239 A 21 TRP HB2 A 24 ILE HD1% 1.0 0.0 4.82 1536 1240 A 97 LEU HD2% A 21 TRP HB2 1.0 0.0 5.45 1537 1241 A 24 ILE HD1% A 22 SER HA 1.0 0.0 4.44 1538 1242 A 24 ILE HA A 30 LEU HDy% 1.0 0.0 4.47 1539 1243 A 30 LEU HB2 A 24 ILE HA 1.0 0.0 3.81 1540 1244 A 24 ILE HA A 30 LEU HG 1.0 0.0 4.30 1541 1245 A 68 ILE HD1% A 24 ILE HB 1.0 0.0 5.32 1542 1246 A 21 TRP HB2 A 24 ILE HG2% 1.0 0.0 5.38 1543 1247 A 24 ILE HG2% A 34 PHE HB2 1.0 0.0 5.61 1544 1248 A 24 ILE HG2% A 84 ILE HB 1.0 0.0 5.78 1545 1249 A 24 ILE HD1% A 33 TRP HZ2 1.0 0.0 4.84 1546 1250 A 24 ILE H A 24 ILE HD1% 1.0 0.0 4.75 1547 1251 A 70 PHE HE% A 25 SER HA 1.0 0.0 5.78 1548 1252 A 25 SER HA A 24 ILE HG1x 1.0 0.0 4.65 1549 1252 A 24 ILE HG1y A 25 SER HA 1.0 0.0 4.65 1550 1253 A 24 ILE HD1% A 25 SER HA 1.0 0.0 5.44 1551 1254 A 26 THR HA A 25 SER HB2 1.0 0.0 5.78 1552 1255 A 68 ILE HG13 A 25 SER HB2 1.0 0.0 4.81 1553 1256 A 26 THR HB A 27 PRO HBx 1.0 0.0 5.03 1554 1256 A 26 THR HB A 27 PRO HBy 1.0 0.0 5.03 1555 1257 A 26 THR HA A 26 THR HG2% 1.0 0.0 3.65 1556 1258 A 28 THR H A 26 THR HG2% 1.0 0.0 4.92 1557 1259 A 31 GLU H A 27 PRO HA 1.0 0.0 5.46 1558 1260 A 32 ASP H A 30 LEU HA 1.0 0.0 5.78 1559 1261 A 30 LEU HB3 A 31 GLU HBy 1.0 0.0 5.78 1560 1262 A 34 PHE HB2 A 30 LEU HB3 1.0 0.0 5.40 1561 1263 A 30 LEU HB3 A 27 PRO HBx 1.0 0.0 5.78 1562 1263 A 27 PRO HBy A 30 LEU HB3 1.0 0.0 5.78 1563 1264 A 30 LEU HB3 A 31 GLU HBx 1.0 0.0 5.78 1564 1265 A 30 LEU HB2 A 27 PRO HA 1.0 0.0 5.24 1565 1266 A 31 GLU H A 30 LEU HB2 1.0 0.0 5.32 1566 1267 A 24 ILE HB A 30 LEU HDx% 1.0 0.0 5.78 1567 1268 A 33 TRP HD1 A 34 PHE HB2 1.0 0.0 5.78 1568 1269 A 33 TRP HE1 A 34 PHE HB2 1.0 0.0 5.20 1569 1270 A 64 ALA HB% A 65 TYR HA 1.0 0.0 4.96 1570 1271 A 67 PHE H A 65 TYR HBx 1.0 0.0 5.37 1571 1271 A 67 PHE H A 65 TYR HBy 1.0 0.0 5.37 1572 1272 A 66 SER HA A 65 TYR HBx 1.0 0.0 5.21 1573 1272 A 65 TYR HBy A 66 SER HA 1.0 0.0 5.21 1574 1273 A 67 PHE H A 68 ILE HA 1.0 0.0 5.37 1575 1274 A 68 ILE HA A 69 ARG HA 1.0 0.0 4.97 1576 1275 A 68 ILE HA A 69 ARG HGx 1.0 0.0 4.42 1577 1275 A 69 ARG HGy A 68 ILE HA 1.0 0.0 4.42 1578 1276 A 24 ILE HD1% A 68 ILE HB 1.0 0.0 4.36 1579 1277 A 70 PHE H A 68 ILE HG2% 1.0 0.0 5.69 1580 1278 A 83 GLU HA A 68 ILE HG2% 1.0 0.0 5.35 1581 1279 A 68 ILE HG13 A 68 ILE HG2% 1.0 0.0 3.35 1582 1280 A 97 LEU HG A 86 MET HE% 1.0 0.0 5.03 1583 1281 A 95 TYR HB3 A 86 MET HE% 1.0 0.0 4.84 1584 1282 A 9 GLU HA A 97 LEU HB2 1.0 0.0 5.78 1585 1283 A 97 LEU HB3 A 10 TYR HE% 1.0 0.0 5.43 1586 1284 A 121 LYS HA A 122 LEU HA 1.0 0.0 5.28 1587 1285 A 122 LEU HG A 11 LEU HDx% 1.0 0.0 5.01 1588 1285 A 11 LEU HDy% A 122 LEU HG 1.0 0.0 5.01 1589 1286 A 25 SER H A 24 ILE HB 1.0 0.0 5.78 1590 1287 A 24 ILE HB A 70 PHE HE% 1.0 0.0 5.78 1591 1288 A 24 ILE HG2% A 33 TRP HD1 1.0 0.0 5.39 1592 1289 A 24 ILE HD1% A 84 ILE HG2% 1.0 0.0 3.20 1593 1290 A 26 THR HA A 25 SER HB3 1.0 0.0 5.78 1594 1291 A 45 VAL HA A 44 THR HG2% 1.0 0.0 4.05 1595 1292 A 23 ALA HB% A 30 LEU HA 1.0 0.0 5.78 1596 1293 A 24 ILE HG2% A 30 LEU HA 1.0 0.0 5.78 1597 1294 A 111 LEU HB3 A 6 ILE HG2% 1.0 0.0 5.78 1598 1295 A 84 ILE HB A 68 ILE HB 1.0 0.0 5.78 1599 1296 A 100 THR H A 84 ILE HG13 1.0 0.0 5.24 1600 1297 A 84 ILE HG13 A 82 PHE HD% 1.0 0.0 5.51 1601 1298 A 83 GLU HA A 84 ILE HG13 1.0 0.0 5.51 1602 1299 A 83 GLU HA A 84 ILE HG12 1.0 0.0 5.78 1603 1300 A 99 ILE HG2% A 84 ILE HG12 1.0 0.0 5.52 1604 1301 A 24 ILE HD1% A 84 ILE HG12 1.0 0.0 4.22 1605 1302 A 84 ILE HG2% A 21 TRP HA 1.0 0.0 4.80 1606 1303 A 97 LEU HG A 84 ILE HG2% 1.0 0.0 4.60 1607 1304 A 99 ILE HG2% A 84 ILE HD1% 1.0 0.0 5.23 1608 1305 A 86 MET HA A 86 MET HE% 1.0 0.0 5.10 1609 1306 A 86 MET HB2 A 95 TYR HB3 1.0 0.0 5.11 1610 1307 A 23 ALA H A 86 MET HE% 1.0 0.0 5.78 1611 1308 A 86 MET HE% A 21 TRP HD1 1.0 0.0 5.78 1612 1309 A 86 MET HE% A 21 TRP HA 1.0 0.0 5.62 1613 1310 A 89 ASN H A 88 TYR HBx 1.0 0.0 5.26 1614 1310 A 89 ASN H A 88 TYR HBy 1.0 0.0 5.26 1615 1311 A 24 ILE HA A 30 LEU HA 1.0 0.0 5.07 1616 1312 A 34 PHE HB3 A 30 LEU HB3 1.0 0.0 4.42 1617 1313 A 30 LEU HB2 A 27 PRO HBx 1.0 0.0 5.78 1618 1313 A 27 PRO HBy A 30 LEU HB2 1.0 0.0 5.78 1619 1314 A 30 LEU HB2 A 34 PHE HB3 1.0 0.0 5.78 1620 1315 A 30 LEU HB2 A 45 VAL HG1% 1.0 0.0 5.78 1621 1316 A 24 ILE HA A 30 LEU HDx% 1.0 0.0 4.47 1622 1317 A 6 ILE HG13 A 6 ILE HG2% 1.0 0.0 3.45 1623 1318 A 108 ALA HB% A 6 ILE HG2% 1.0 0.0 4.82 1624 1319 A 63 ARG H A 65 TYR HA 1.0 0.0 5.78 1625 1320 A 62 ILE HD1% A 68 ILE HB 1.0 0.0 3.96 1626 1321 A 68 ILE HB A 62 ILE HG1x 1.0 0.0 4.02 1627 1321 A 62 ILE HG1y A 68 ILE HB 1.0 0.0 4.02 1628 1322 A 68 ILE HG2% A 83 GLU HBx 1.0 0.0 5.58 1629 1322 A 83 GLU HBy A 68 ILE HG2% 1.0 0.0 5.58 1630 1323 A 62 ILE HB A 68 ILE HG13 1.0 0.0 4.60 1631 1324 A 68 ILE HG13 A 62 ILE HG2% 1.0 0.0 4.66 1632 1325 A 68 ILE HG13 A 62 ILE HD1% 1.0 0.0 4.64 1633 1326 A 88 TYR HA A 95 TYR HA 1.0 0.0 4.77 1634 1327 A 97 LEU HD2% A 95 TYR HB2 1.0 0.0 5.78 1635 1328 A 95 TYR HB2 A 12 LEU HBx 1.0 0.0 5.68 1636 1329 A 95 TYR HB2 A 12 LEU HBy 1.0 0.0 5.68 1637 1330 A 26 THR HB A 27 PRO HG2 1.0 0.0 4.33 1638 1331 A 7 HIS HA A 7 HIS HD2 1.0 0.0 4.94 1639 1332 A 95 TYR HE% A 88 TYR HBx 1.0 0.0 3.79 1640 1332 A 88 TYR HBy A 95 TYR HE% 1.0 0.0 3.79 1641 1333 A 86 MET HB3 A 95 TYR HE% 1.0 0.0 4.73 1642 1334 A 10 TYR HE% A 99 ILE HG1x 1.0 0.0 4.77 1643 1335 A 64 ALA HB% A 65 TYR HE% 1.0 0.0 4.02 1644 1336 A 10 TYR HD% A 97 LEU HB3 1.0 0.0 4.59 1645 1337 A 20 LEU HB2 A 21 TRP HD1 1.0 0.0 4.38 1646 1338 A 20 LEU HB3 A 21 TRP HD1 1.0 0.0 3.48 1647 1339 A 24 ILE HB A 33 TRP HZ2 1.0 0.0 5.03 1648 1340 A 23 ALA HB% A 33 TRP HZ2 1.0 0.0 4.00 1649 1341 A 33 TRP HZ2 A 24 ILE HG1x 1.0 0.0 4.88 1650 1341 A 33 TRP HZ2 A 24 ILE HG1y 1.0 0.0 4.88 1651 1342 A 33 TRP HD1 A 30 LEU HA 1.0 0.0 4.32 1652 1343 A 23 ALA HB% A 33 TRP HD1 1.0 0.0 4.07 1653 1344 A 35 ALA H A 34 PHE HE% 1.0 0.0 5.34 1654 1345 A 34 PHE HE% A 49 TRP HH2 1.0 0.0 4.78 1655 1346 A 47 PHE HD% A 34 PHE HD% 1.0 0.0 4.45 1656 1347 A 47 PHE HE% A 34 PHE HD% 1.0 0.0 4.57 1657 1348 A 34 PHE HA A 34 PHE HD% 1.0 0.0 4.37 1658 1349 A 35 ALA HB% A 34 PHE HD% 1.0 0.0 3.68 1659 1350 A 47 PHE HE% A 34 PHE HE% 1.0 0.0 3.43 1660 1351 A 47 PHE HE% A 30 LEU HB3 1.0 0.0 5.13 1661 1352 A 47 PHE HE% A 38 VAL HB 1.0 0.0 5.78 1662 1353 A 47 PHE HE% A 38 VAL HG1% 1.0 0.0 4.62 1663 1354 A 47 PHE HE% A 38 VAL HG2% 1.0 0.0 4.62 1664 1355 A 38 VAL HA A 47 PHE HD% 1.0 0.0 4.36 1665 1356 A 128 PHE HA A 128 PHE HD% 1.0 0.0 4.62 1666 1357 A 35 ALA HB% A 47 PHE HD% 1.0 0.0 3.94 1667 1358 A 34 PHE HE% A 49 TRP HZ2 1.0 0.0 4.49 1668 1359 A 35 ALA HB% A 49 TRP HZ2 1.0 0.0 4.22 1669 1360 A 35 ALA HA A 49 TRP HD1 1.0 0.0 4.40 1670 1361 A 35 ALA HB% A 49 TRP HD1 1.0 0.0 4.35 1671 1362 A 65 TYR H A 65 TYR HE% 1.0 0.0 4.44 1672 1363 A 18 ASN HB3 A 65 TYR HE% 1.0 0.0 3.94 1673 1364 A 81 TYR HE% A 83 GLU HBx 1.0 0.0 3.89 1674 1364 A 83 GLU HBy A 81 TYR HE% 1.0 0.0 3.89 1675 1365 A 65 TYR HD% A 86 MET HE% 1.0 0.0 4.34 1676 1366 A 61 ALA HB% A 67 PHE HE% 1.0 0.0 3.70 1677 1367 A 67 PHE HD% A 62 ILE HB 1.0 0.0 5.51 1678 1368 A 57 ALA HB% A 70 PHE HE% 1.0 0.0 4.54 1679 1369 A 70 PHE HE% A 24 ILE HG1x 1.0 0.0 3.97 1680 1369 A 24 ILE HG1y A 70 PHE HE% 1.0 0.0 3.97 1681 1370 A 59 ILE HD1% A 70 PHE HE% 1.0 0.0 3.93 1682 1371 A 68 ILE HG12 A 70 PHE HE% 1.0 0.0 4.21 1683 1372 A 70 PHE HA A 70 PHE HD% 1.0 0.0 4.24 1684 1373 A 68 ILE HG13 A 70 PHE HD% 1.0 0.0 5.21 1685 1374 A 70 PHE HD% A 59 ILE HG2% 1.0 0.0 4.88 1686 1375 A 71 HIS HD2 A 71 HIS HBx 1.0 0.0 3.90 1687 1375 A 71 HIS HBy A 71 HIS HD2 1.0 0.0 3.90 1688 1376 A 71 HIS HD2 A 60 VAL HGx% 1.0 0.0 4.51 1689 1376 A 60 VAL HGy% A 71 HIS HD2 1.0 0.0 4.51 1690 1377 A 100 THR HB A 81 TYR HE% 1.0 0.0 4.60 1691 1378 A 81 TYR HD% A 83 GLU HBx 1.0 0.0 4.79 1692 1378 A 81 TYR HD% A 83 GLU HBy 1.0 0.0 4.79 1693 1379 A 89 ASN H A 88 TYR HE% 1.0 0.0 4.97 1694 1380 A 93 GLY H A 88 TYR HE% 1.0 0.0 5.23 1695 1381 A 88 TYR HE% A 93 GLY HAy 1.0 0.0 4.30 1696 1382 A 90 GLU HA A 88 TYR HE% 1.0 0.0 3.39 1697 1383 A 88 TYR HE% A 90 GLU HGx 1.0 0.0 3.99 1698 1383 A 90 GLU HGy A 88 TYR HE% 1.0 0.0 3.99 1699 1384 A 88 TYR HE% A 90 GLU HBx 1.0 0.0 4.36 1700 1384 A 90 GLU HBy A 88 TYR HE% 1.0 0.0 4.36 1701 1385 A 99 ILE HB A 10 TYR HE% 1.0 0.0 5.78 1702 1386 A 8 LEU HB3 A 10 TYR HE% 1.0 0.0 4.98 1703 1387 A 20 LEU HA A 21 TRP HD1 1.0 0.0 5.58 1704 1388 A 97 LEU HD1% A 21 TRP HD1 1.0 0.0 3.55 1705 1389 A 33 TRP HD1 A 34 PHE HB3 1.0 0.0 5.53 1706 1390 A 21 TRP HA A 33 TRP HZ2 1.0 0.0 3.79 1707 1391 A 35 ALA HB% A 47 PHE HE% 1.0 0.0 5.03 1708 1392 A 65 TYR HD% A 18 ASN HA 1.0 0.0 4.99 1709 1393 A 86 MET H A 65 TYR HE% 1.0 0.0 5.25 1710 1394 A 86 MET HE% A 65 TYR HE% 1.0 0.0 5.78 1711 1395 A 68 ILE HD1% A 70 PHE HD% 1.0 0.0 5.09 1712 1396 A 129 LEU H A 128 PHE HD% 1.0 0.0 5.45 1713 1397 A 21 TRP H A 21 TRP HD1 1.0 0.0 5.18 1714 1398 A 97 LEU HB2 A 21 TRP HD1 1.0 0.0 5.78 1715 1399 A 97 LEU HD1% A 21 TRP HZ2 1.0 0.0 5.78 1716 1400 A 97 LEU HD2% A 21 TRP HZ2 1.0 0.0 5.78 1717 1401 A 65 TYR HD% A 86 MET H 1.0 0.0 5.75 1718 1402 A 65 TYR H A 65 TYR HD% 1.0 0.0 4.11 1719 1403 A 95 TYR HD% A 88 TYR HD% 1.0 0.0 5.78 1720 1404 A 90 GLU H A 88 TYR HE% 1.0 0.0 5.22 1721 1405 A 95 TYR HD% A 88 TYR HE% 1.0 0.0 5.05 1722 1406 A 92 THR H A 88 TYR HE% 1.0 0.0 5.78 1723 1407 A 84 ILE HG13 A 21 TRP HH2 1.0 0.0 5.57 1724 1408 A 84 ILE HG12 A 21 TRP HH2 1.0 0.0 5.03 1725 1409 A 33 TRP HH2 A 21 TRP HA 1.0 0.0 4.11 1726 1410 A 24 ILE HG2% A 33 TRP HH2 1.0 0.0 4.40 1727 1411 A 47 PHE HD% A 34 PHE HE% 1.0 0.0 5.05 1728 1412 A 95 TYR HD% A 88 TYR HBx 1.0 0.0 4.86 1729 1412 A 95 TYR HD% A 88 TYR HBy 1.0 0.0 4.86 1730 1413 A 88 TYR HD% A 95 TYR HE% 1.0 0.0 5.51 1731 1414 A 88 TYR HA A 95 TYR HE% 1.0 0.0 5.05 1732 1415 A 3 LYS H A 3 LYS HBx 1.0 0.0 3.53 1733 1415 A 3 LYS H A 3 LYS HBy 1.0 0.0 3.53 1734 1416 A 3 LYS HA A 3 LYS HGy 1.0 0.0 3.59 1735 1416 A 3 LYS HA A 3 LYS HGx 1.0 0.0 3.59 1736 1417 A 3 LYS HA A 3 LYS HDy 1.0 0.0 3.91 1737 1417 A 3 LYS HA A 3 LYS HDx 1.0 0.0 3.91 1738 1418 A 3 LYS HA A 104 GLU HGx 1.0 0.0 4.70 1739 1418 A 3 LYS HA A 104 GLU HGy 1.0 0.0 4.70 1740 1419 A 4 GLU HA A 3 LYS HBx 1.0 0.0 4.59 1741 1419 A 4 GLU HA A 3 LYS HBy 1.0 0.0 4.59 1742 1420 A 3 LYS HBy A 4 GLU HBx 1.0 0.0 4.90 1743 1420 A 3 LYS HBx A 4 GLU HBx 1.0 0.0 4.90 1744 1420 A 4 GLU HBy A 3 LYS HBx 1.0 0.0 4.90 1745 1420 A 3 LYS HBy A 4 GLU HBy 1.0 0.0 4.90 1746 1421 A 3 LYS HBy A 4 GLU HGx 1.0 0.0 5.61 1747 1421 A 3 LYS HBx A 4 GLU HGx 1.0 0.0 5.61 1748 1421 A 4 GLU HGy A 3 LYS HBx 1.0 0.0 5.61 1749 1421 A 4 GLU HGy A 3 LYS HBy 1.0 0.0 5.61 1750 1422 A 103 SER H A 3 LYS HBx 1.0 0.0 4.39 1751 1422 A 103 SER H A 3 LYS HBy 1.0 0.0 4.39 1752 1423 A 3 LYS HEx A 3 LYS HGy 1.0 0.0 3.64 1753 1423 A 3 LYS HEy A 3 LYS HGy 1.0 0.0 3.64 1754 1423 A 3 LYS HGx A 3 LYS HEx 1.0 0.0 3.64 1755 1423 A 3 LYS HEy A 3 LYS HGx 1.0 0.0 3.64 1756 1424 A 4 GLU H A 3 LYS HGy 1.0 0.0 4.33 1757 1424 A 4 GLU H A 3 LYS HGx 1.0 0.0 4.33 1758 1425 A 104 GLU HA A 3 LYS HGy 1.0 0.0 4.43 1759 1425 A 104 GLU HA A 3 LYS HGx 1.0 0.0 4.43 1760 1426 A 3 LYS HGx A 104 GLU HGx 1.0 0.0 3.99 1761 1426 A 3 LYS HGy A 104 GLU HGx 1.0 0.0 3.99 1762 1426 A 104 GLU HGy A 3 LYS HGy 1.0 0.0 3.99 1763 1426 A 3 LYS HGx A 104 GLU HGy 1.0 0.0 3.99 1764 1427 A 103 SER H A 3 LYS HDy 1.0 0.0 5.61 1765 1427 A 103 SER H A 3 LYS HDx 1.0 0.0 5.61 1766 1428 A 104 GLU H A 3 LYS HDy 1.0 0.0 4.06 1767 1428 A 104 GLU H A 3 LYS HDx 1.0 0.0 4.06 1768 1429 A 104 GLU HA A 3 LYS HDy 1.0 0.0 4.71 1769 1429 A 104 GLU HA A 3 LYS HDx 1.0 0.0 4.71 1770 1430 A 3 LYS HDy A 104 GLU HBx 1.0 0.0 3.49 1771 1430 A 3 LYS HDx A 104 GLU HBx 1.0 0.0 3.49 1772 1430 A 104 GLU HBy A 3 LYS HDy 1.0 0.0 3.49 1773 1430 A 104 GLU HBy A 3 LYS HDx 1.0 0.0 3.49 1774 1431 A 3 LYS HDy A 104 GLU HGx 1.0 0.0 3.53 1775 1431 A 3 LYS HDx A 104 GLU HGx 1.0 0.0 3.53 1776 1431 A 104 GLU HGy A 3 LYS HDy 1.0 0.0 3.53 1777 1431 A 3 LYS HDx A 104 GLU HGy 1.0 0.0 3.53 1778 1432 A 4 GLU H A 4 GLU HBx 1.0 0.0 3.48 1779 1432 A 4 GLU H A 4 GLU HBy 1.0 0.0 3.48 1780 1433 A 4 GLU HBy A 4 GLU HGx 1.0 0.0 2.53 1781 1433 A 4 GLU HGy A 4 GLU HBx 1.0 0.0 2.53 1782 1433 A 4 GLU HGy A 4 GLU HBy 1.0 0.0 2.53 1783 1433 A 4 GLU HBx A 4 GLU HGx 1.0 0.0 2.53 1784 1434 A 6 ILE HG2% A 4 GLU HBx 1.0 0.0 4.56 1785 1434 A 6 ILE HG2% A 4 GLU HBy 1.0 0.0 4.56 1786 1435 A 4 GLU HGx A 5 LYS HBx 1.0 0.0 4.28 1787 1435 A 4 GLU HGy A 5 LYS HBx 1.0 0.0 4.28 1788 1435 A 5 LYS HBy A 4 GLU HGx 1.0 0.0 4.28 1789 1435 A 4 GLU HGy A 5 LYS HBy 1.0 0.0 4.28 1790 1436 A 5 LYS HA A 5 LYS HGy 1.0 0.0 3.81 1791 1436 A 5 LYS HA A 5 LYS HGx 1.0 0.0 3.81 1792 1437 A 5 LYS HA A 102 PHE HBx 1.0 0.0 5.44 1793 1437 A 5 LYS HA A 102 PHE HBy 1.0 0.0 5.44 1794 1438 A 100 THR HG2% A 5 LYS HBx 1.0 0.0 4.81 1795 1438 A 100 THR HG2% A 5 LYS HBy 1.0 0.0 4.81 1796 1439 A 5 LYS HEx A 5 LYS HGy 1.0 0.0 3.23 1797 1439 A 5 LYS HEy A 5 LYS HGy 1.0 0.0 3.23 1798 1439 A 5 LYS HGx A 5 LYS HEx 1.0 0.0 3.23 1799 1439 A 5 LYS HEy A 5 LYS HGx 1.0 0.0 3.23 1800 1440 A 6 ILE H A 5 LYS HGy 1.0 0.0 3.86 1801 1440 A 6 ILE H A 5 LYS HGx 1.0 0.0 3.86 1802 1441 A 101 ASP H A 5 LYS HGy 1.0 0.0 5.19 1803 1441 A 101 ASP H A 5 LYS HGx 1.0 0.0 5.19 1804 1442 A 5 LYS HDx A 7 HIS HBx 1.0 0.0 4.97 1805 1442 A 5 LYS HDy A 7 HIS HBx 1.0 0.0 4.97 1806 1442 A 7 HIS HBy A 5 LYS HDx 1.0 0.0 4.97 1807 1442 A 5 LYS HDy A 7 HIS HBy 1.0 0.0 4.97 1808 1443 A 6 ILE HA A 7 HIS HBx 1.0 0.0 5.08 1809 1443 A 6 ILE HA A 7 HIS HBy 1.0 0.0 5.08 1810 1444 A 6 ILE HG2% A 103 SER HBx 1.0 0.0 4.77 1811 1444 A 6 ILE HG2% A 103 SER HBy 1.0 0.0 4.77 1812 1445 A 6 ILE HG2% A 112 LYS HGy 1.0 0.0 5.08 1813 1445 A 6 ILE HG2% A 112 LYS HGx 1.0 0.0 5.08 1814 1446 A 6 ILE HG2% A 112 LYS HDy 1.0 0.0 5.61 1815 1446 A 6 ILE HG2% A 112 LYS HDx 1.0 0.0 5.61 1816 1447 A 6 ILE HG12 A 101 ASP HBx 1.0 0.0 4.82 1817 1447 A 6 ILE HG12 A 101 ASP HBy 1.0 0.0 4.82 1818 1448 A 6 ILE HD1% A 103 SER HBx 1.0 0.0 4.13 1819 1448 A 6 ILE HD1% A 103 SER HBy 1.0 0.0 4.13 1820 1449 A 6 ILE HD1% A 112 LYS HGy 1.0 0.0 4.32 1821 1449 A 6 ILE HD1% A 112 LYS HGx 1.0 0.0 4.32 1822 1450 A 6 ILE HD1% A 112 LYS HDy 1.0 0.0 4.95 1823 1450 A 6 ILE HD1% A 112 LYS HDx 1.0 0.0 4.95 1824 1451 A 8 LEU H A 7 HIS HBx 1.0 0.0 4.64 1825 1451 A 8 LEU H A 7 HIS HBy 1.0 0.0 4.64 1826 1452 A 8 LEU HG A 115 TRP HBy 1.0 0.0 4.25 1827 1452 A 8 LEU HG A 115 TRP HBx 1.0 0.0 4.25 1828 1453 A 8 LEU HDx% A 112 LYS HGy 1.0 0.0 4.54 1829 1453 A 8 LEU HDy% A 112 LYS HGy 1.0 0.0 4.54 1830 1453 A 112 LYS HGx A 8 LEU HDx% 1.0 0.0 4.54 1831 1453 A 8 LEU HDy% A 112 LYS HGx 1.0 0.0 4.54 1832 1454 A 8 LEU HDx% A 112 LYS HDy 1.0 0.0 4.23 1833 1454 A 8 LEU HDy% A 112 LYS HDy 1.0 0.0 4.23 1834 1454 A 112 LYS HDx A 8 LEU HDx% 1.0 0.0 4.23 1835 1454 A 8 LEU HDy% A 112 LYS HDx 1.0 0.0 4.23 1836 1455 A 10 TYR HA A 11 LEU HBy 1.0 0.0 5.61 1837 1455 A 10 TYR HA A 11 LEU HBx 1.0 0.0 5.61 1838 1456 A 11 LEU H A 10 TYR HBx 1.0 0.0 4.03 1839 1456 A 11 LEU H A 10 TYR HBy 1.0 0.0 4.03 1840 1457 A 10 TYR HBx A 12 LEU HDx% 1.0 0.0 4.02 1841 1457 A 10 TYR HBy A 12 LEU HDx% 1.0 0.0 4.02 1842 1457 A 12 LEU HDy% A 10 TYR HBx 1.0 0.0 4.02 1843 1457 A 12 LEU HDy% A 10 TYR HBy 1.0 0.0 4.02 1844 1458 A 97 LEU H A 10 TYR HBx 1.0 0.0 5.50 1845 1458 A 97 LEU H A 10 TYR HBy 1.0 0.0 5.50 1846 1459 A 97 LEU HB2 A 10 TYR HBx 1.0 0.0 4.11 1847 1459 A 97 LEU HB2 A 10 TYR HBy 1.0 0.0 4.11 1848 1460 A 97 LEU HB3 A 10 TYR HBx 1.0 0.0 4.99 1849 1460 A 97 LEU HB3 A 10 TYR HBy 1.0 0.0 4.99 1850 1461 A 97 LEU HD2% A 10 TYR HBx 1.0 0.0 3.86 1851 1461 A 97 LEU HD2% A 10 TYR HBy 1.0 0.0 3.86 1852 1462 A 99 ILE HD1% A 10 TYR HBx 1.0 0.0 5.61 1853 1462 A 99 ILE HD1% A 10 TYR HBy 1.0 0.0 5.61 1854 1463 A 10 TYR HD% A 99 ILE HG1x 1.0 0.0 5.08 1855 1463 A 10 TYR HD% A 99 ILE HG1y 1.0 0.0 5.08 1856 1464 A 10 TYR HD% A 122 LEU HD1% 1.0 0.0 5.71 1857 1464 A 10 TYR HD% A 122 LEU HD2% 1.0 0.0 5.71 1858 1465 A 10 TYR HE% A 99 ILE HG1x 1.0 0.0 4.15 1859 1465 A 10 TYR HE% A 99 ILE HG1y 1.0 0.0 4.15 1860 1466 A 11 LEU H A 11 LEU HBy 1.0 0.0 3.35 1861 1466 A 11 LEU H A 11 LEU HBx 1.0 0.0 3.35 1862 1467 A 12 LEU H A 11 LEU HBy 1.0 0.0 4.18 1863 1467 A 12 LEU H A 11 LEU HBx 1.0 0.0 4.18 1864 1468 A 12 LEU HA A 11 LEU HBy 1.0 0.0 5.55 1865 1468 A 12 LEU HA A 11 LEU HBx 1.0 0.0 5.55 1866 1469 A 11 LEU HBx A 122 LEU HD1% 1.0 0.0 4.46 1867 1469 A 11 LEU HBy A 122 LEU HD1% 1.0 0.0 4.46 1868 1469 A 122 LEU HD2% A 11 LEU HBy 1.0 0.0 4.46 1869 1469 A 11 LEU HBx A 122 LEU HD2% 1.0 0.0 4.46 1870 1470 A 11 LEU HDx% A 94 ASP HBx 1.0 0.0 5.09 1871 1470 A 11 LEU HDy% A 94 ASP HBx 1.0 0.0 5.09 1872 1470 A 94 ASP HBy A 11 LEU HDx% 1.0 0.0 5.09 1873 1470 A 11 LEU HDy% A 94 ASP HBy 1.0 0.0 5.09 1874 1471 A 11 LEU HDx% A 122 LEU HD1% 1.0 0.0 3.23 1875 1471 A 11 LEU HDy% A 122 LEU HD1% 1.0 0.0 3.23 1876 1471 A 122 LEU HD2% A 11 LEU HDx% 1.0 0.0 3.23 1877 1471 A 11 LEU HDy% A 122 LEU HD2% 1.0 0.0 3.23 1878 1472 A 12 LEU H A 12 LEU HBy 1.0 0.0 3.49 1879 1472 A 12 LEU H A 12 LEU HBx 1.0 0.0 3.49 1880 1473 A 12 LEU H A 94 ASP HBx 1.0 0.0 5.10 1881 1473 A 12 LEU H A 94 ASP HBy 1.0 0.0 5.10 1882 1474 A 12 LEU HA A 122 LEU HD1% 1.0 0.0 5.71 1883 1474 A 12 LEU HA A 122 LEU HD2% 1.0 0.0 5.71 1884 1475 A 13 ASN H A 12 LEU HBy 1.0 0.0 4.18 1885 1475 A 12 LEU HBx A 13 ASN H 1.0 0.0 4.18 1886 1476 A 95 TYR H A 12 LEU HBy 1.0 0.0 4.92 1887 1476 A 95 TYR H A 12 LEU HBx 1.0 0.0 4.92 1888 1477 A 95 TYR HB2 A 12 LEU HBy 1.0 0.0 4.88 1889 1477 A 95 TYR HB2 A 12 LEU HBx 1.0 0.0 4.88 1890 1478 A 95 TYR HB3 A 12 LEU HBy 1.0 0.0 5.05 1891 1478 A 95 TYR HB3 A 12 LEU HBx 1.0 0.0 5.05 1892 1479 A 97 LEU HD2% A 12 LEU HBy 1.0 0.0 4.12 1893 1479 A 97 LEU HD2% A 12 LEU HBx 1.0 0.0 4.12 1894 1480 A 13 ASN HA A 13 ASN HD2x 1.0 0.0 4.29 1895 1480 A 13 ASN HA A 13 ASN HD2y 1.0 0.0 4.29 1896 1481 A 14 ALA H A 13 ASN HBx 1.0 0.0 3.82 1897 1481 A 14 ALA H A 13 ASN HBy 1.0 0.0 3.82 1898 1482 A 19 ILE HB A 22 SER HBx 1.0 0.0 5.13 1899 1482 A 19 ILE HB A 22 SER HBy 1.0 0.0 5.13 1900 1483 A 19 ILE HG1y A 22 SER HBx 1.0 0.0 3.97 1901 1483 A 19 ILE HG1x A 22 SER HBx 1.0 0.0 3.97 1902 1483 A 22 SER HBy A 19 ILE HG1x 1.0 0.0 3.97 1903 1483 A 22 SER HBy A 19 ILE HG1y 1.0 0.0 3.97 1904 1484 A 20 LEU H A 20 LEU HD1% 1.0 0.0 4.65 1905 1484 A 20 LEU H A 20 LEU HD2% 1.0 0.0 4.65 1906 1485 A 20 LEU H A 22 SER HBx 1.0 0.0 5.11 1907 1485 A 20 LEU H A 22 SER HBy 1.0 0.0 5.11 1908 1486 A 20 LEU HA A 20 LEU HD1% 1.0 0.0 3.06 1909 1486 A 20 LEU HA A 20 LEU HD2% 1.0 0.0 3.06 1910 1487 A 86 MET HB2 A 20 LEU HD1% 1.0 0.0 5.42 1911 1487 A 86 MET HB2 A 20 LEU HD2% 1.0 0.0 5.42 1912 1488 A 86 MET HB3 A 20 LEU HD1% 1.0 0.0 4.83 1913 1488 A 86 MET HB3 A 20 LEU HD2% 1.0 0.0 4.83 1914 1489 A 86 MET HE% A 20 LEU HD1% 1.0 0.0 3.38 1915 1489 A 86 MET HE% A 20 LEU HD2% 1.0 0.0 3.38 1916 1490 A 95 TYR HB2 A 20 LEU HD1% 1.0 0.0 4.33 1917 1490 A 95 TYR HB2 A 20 LEU HD2% 1.0 0.0 4.33 1918 1491 A 95 TYR HB3 A 20 LEU HD1% 1.0 0.0 4.39 1919 1491 A 95 TYR HB3 A 20 LEU HD2% 1.0 0.0 4.39 1920 1492 A 95 TYR HD% A 20 LEU HD1% 1.0 0.0 4.39 1921 1492 A 95 TYR HD% A 20 LEU HD2% 1.0 0.0 4.39 1922 1493 A 22 SER H A 22 SER HBx 1.0 0.0 3.42 1923 1493 A 22 SER H A 22 SER HBy 1.0 0.0 3.42 1924 1494 A 23 ALA H A 22 SER HBx 1.0 0.0 3.93 1925 1494 A 23 ALA H A 22 SER HBy 1.0 0.0 3.93 1926 1495 A 23 ALA HB% A 30 LEU HDx% 1.0 0.0 4.64 1927 1495 A 23 ALA HB% A 30 LEU HDy% 1.0 0.0 4.64 1928 1496 A 24 ILE HA A 30 LEU HDx% 1.0 0.0 3.61 1929 1496 A 24 ILE HA A 30 LEU HDy% 1.0 0.0 3.61 1930 1497 A 24 ILE HB A 30 LEU HDx% 1.0 0.0 4.51 1931 1497 A 24 ILE HB A 30 LEU HDy% 1.0 0.0 4.51 1932 1498 A 26 THR H A 27 PRO HDy 1.0 0.0 5.06 1933 1498 A 26 THR H A 27 PRO HDx 1.0 0.0 5.06 1934 1499 A 26 THR HB A 27 PRO HDy 1.0 0.0 3.56 1935 1499 A 26 THR HB A 27 PRO HDx 1.0 0.0 3.56 1936 1500 A 27 PRO HA A 30 LEU HDx% 1.0 0.0 5.71 1937 1500 A 27 PRO HA A 30 LEU HDy% 1.0 0.0 5.71 1938 1501 A 27 PRO HA A 38 VAL HG2% 1.0 0.0 3.65 1939 1501 A 27 PRO HA A 38 VAL HG1% 1.0 0.0 3.65 1940 1502 A 27 PRO HA A 45 VAL HG2% 1.0 0.0 4.46 1941 1502 A 27 PRO HA A 45 VAL HG1% 1.0 0.0 4.46 1942 1503 A 27 PRO HBx A 30 LEU HDx% 1.0 0.0 5.24 1943 1503 A 27 PRO HBy A 30 LEU HDx% 1.0 0.0 5.24 1944 1503 A 30 LEU HDy% A 27 PRO HBx 1.0 0.0 5.24 1945 1503 A 27 PRO HBy A 30 LEU HDy% 1.0 0.0 5.24 1946 1504 A 27 PRO HBx A 38 VAL HG2% 1.0 0.0 3.77 1947 1504 A 27 PRO HBy A 38 VAL HG2% 1.0 0.0 3.77 1948 1504 A 38 VAL HG1% A 27 PRO HBx 1.0 0.0 3.77 1949 1504 A 27 PRO HBy A 38 VAL HG1% 1.0 0.0 3.77 1950 1505 A 27 PRO HG2 A 38 VAL HG2% 1.0 0.0 4.96 1951 1505 A 27 PRO HG2 A 38 VAL HG1% 1.0 0.0 4.96 1952 1506 A 27 PRO HG3 A 38 VAL HG2% 1.0 0.0 4.81 1953 1506 A 27 PRO HG3 A 38 VAL HG1% 1.0 0.0 4.81 1954 1507 A 28 THR H A 27 PRO HDy 1.0 0.0 4.47 1955 1507 A 28 THR H A 27 PRO HDx 1.0 0.0 4.47 1956 1508 A 28 THR HA A 31 GLU HGx 1.0 0.0 3.74 1957 1508 A 28 THR HA A 31 GLU HGy 1.0 0.0 3.74 1958 1509 A 30 LEU H A 30 LEU HDx% 1.0 0.0 4.03 1959 1509 A 30 LEU H A 30 LEU HDy% 1.0 0.0 4.03 1960 1510 A 30 LEU H A 31 GLU HGx 1.0 0.0 5.61 1961 1510 A 30 LEU H A 31 GLU HGy 1.0 0.0 5.61 1962 1511 A 30 LEU H A 38 VAL HG2% 1.0 0.0 4.87 1963 1511 A 30 LEU H A 38 VAL HG1% 1.0 0.0 4.87 1964 1512 A 30 LEU HA A 30 LEU HDx% 1.0 0.0 3.41 1965 1512 A 30 LEU HA A 30 LEU HDy% 1.0 0.0 3.41 1966 1513 A 30 LEU HA A 38 VAL HG2% 1.0 0.0 5.08 1967 1513 A 30 LEU HA A 38 VAL HG1% 1.0 0.0 5.08 1968 1514 A 30 LEU HB2 A 38 VAL HG2% 1.0 0.0 4.00 1969 1514 A 30 LEU HB2 A 38 VAL HG1% 1.0 0.0 4.00 1970 1515 A 30 LEU HB3 A 31 GLU HBx 1.0 0.0 4.95 1971 1515 A 30 LEU HB3 A 31 GLU HBy 1.0 0.0 4.95 1972 1516 A 30 LEU HB3 A 31 GLU HGx 1.0 0.0 5.61 1973 1516 A 30 LEU HB3 A 31 GLU HGy 1.0 0.0 5.61 1974 1517 A 30 LEU HB3 A 45 VAL HG2% 1.0 0.0 5.52 1975 1517 A 30 LEU HB3 A 45 VAL HG1% 1.0 0.0 5.52 1976 1518 A 31 GLU HA A 30 LEU HDx% 1.0 0.0 5.71 1977 1518 A 31 GLU HA A 30 LEU HDy% 1.0 0.0 5.71 1978 1519 A 33 TRP HD1 A 30 LEU HDx% 1.0 0.0 4.90 1979 1519 A 33 TRP HD1 A 30 LEU HDy% 1.0 0.0 4.90 1980 1520 A 33 TRP HE1 A 30 LEU HDx% 1.0 0.0 3.76 1981 1520 A 33 TRP HE1 A 30 LEU HDy% 1.0 0.0 3.76 1982 1521 A 34 PHE H A 30 LEU HDx% 1.0 0.0 5.71 1983 1521 A 34 PHE H A 30 LEU HDy% 1.0 0.0 5.71 1984 1522 A 34 PHE HA A 30 LEU HDx% 1.0 0.0 4.76 1985 1522 A 34 PHE HA A 30 LEU HDy% 1.0 0.0 4.76 1986 1523 A 34 PHE HB2 A 30 LEU HDx% 1.0 0.0 4.24 1987 1523 A 34 PHE HB2 A 30 LEU HDy% 1.0 0.0 4.24 1988 1524 A 34 PHE HE% A 30 LEU HDx% 1.0 0.0 5.18 1989 1524 A 34 PHE HE% A 30 LEU HDy% 1.0 0.0 5.18 1990 1525 A 30 LEU HDx% A 38 VAL HG2% 1.0 0.0 4.70 1991 1525 A 30 LEU HDy% A 38 VAL HG2% 1.0 0.0 4.70 1992 1525 A 38 VAL HG1% A 30 LEU HDx% 1.0 0.0 4.70 1993 1525 A 30 LEU HDy% A 38 VAL HG1% 1.0 0.0 4.70 1994 1526 A 30 LEU HDy% A 45 VAL HG2% 1.0 0.0 3.84 1995 1526 A 30 LEU HDx% A 45 VAL HG2% 1.0 0.0 3.84 1996 1526 A 45 VAL HG1% A 30 LEU HDx% 1.0 0.0 3.84 1997 1526 A 30 LEU HDy% A 45 VAL HG1% 1.0 0.0 3.84 1998 1527 A 47 PHE HD% A 30 LEU HDx% 1.0 0.0 5.71 1999 1527 A 47 PHE HD% A 30 LEU HDy% 1.0 0.0 5.71 2000 1528 A 47 PHE HE% A 30 LEU HDx% 1.0 0.0 4.27 2001 1528 A 47 PHE HE% A 30 LEU HDy% 1.0 0.0 4.27 2002 1529 A 31 GLU H A 31 GLU HBx 1.0 0.0 3.37 2003 1529 A 31 GLU H A 31 GLU HBy 1.0 0.0 3.37 2004 1530 A 31 GLU H A 31 GLU HGx 1.0 0.0 3.31 2005 1530 A 31 GLU H A 31 GLU HGy 1.0 0.0 3.31 2006 1531 A 31 GLU H A 38 VAL HG2% 1.0 0.0 5.19 2007 1531 A 31 GLU H A 38 VAL HG1% 1.0 0.0 5.19 2008 1532 A 31 GLU HA A 31 GLU HGx 1.0 0.0 3.84 2009 1532 A 31 GLU HA A 31 GLU HGy 1.0 0.0 3.84 2010 1533 A 34 PHE H A 31 GLU HBx 1.0 0.0 5.30 2011 1533 A 34 PHE H A 31 GLU HBy 1.0 0.0 5.30 2012 1534 A 37 LYS HA A 31 GLU HBx 1.0 0.0 4.77 2013 1534 A 37 LYS HA A 31 GLU HBy 1.0 0.0 4.77 2014 1535 A 38 VAL H A 31 GLU HBx 1.0 0.0 4.65 2015 1535 A 38 VAL H A 31 GLU HBy 1.0 0.0 4.65 2016 1536 A 31 GLU HBx A 38 VAL HG2% 1.0 0.0 3.85 2017 1536 A 31 GLU HBy A 38 VAL HG2% 1.0 0.0 3.85 2018 1536 A 38 VAL HG1% A 31 GLU HBx 1.0 0.0 3.85 2019 1536 A 38 VAL HG1% A 31 GLU HBy 1.0 0.0 3.85 2020 1537 A 37 LYS HA A 31 GLU HGx 1.0 0.0 4.09 2021 1537 A 37 LYS HA A 31 GLU HGy 1.0 0.0 4.09 2022 1538 A 38 VAL H A 31 GLU HGx 1.0 0.0 3.82 2023 1538 A 38 VAL H A 31 GLU HGy 1.0 0.0 3.82 2024 1539 A 31 GLU HGx A 38 VAL HG2% 1.0 0.0 3.90 2025 1539 A 31 GLU HGy A 38 VAL HG2% 1.0 0.0 3.90 2026 1539 A 38 VAL HG1% A 31 GLU HGx 1.0 0.0 3.90 2027 1539 A 38 VAL HG1% A 31 GLU HGy 1.0 0.0 3.90 2028 1540 A 34 PHE H A 38 VAL HG2% 1.0 0.0 5.71 2029 1540 A 34 PHE H A 38 VAL HG1% 1.0 0.0 5.71 2030 1541 A 34 PHE HE% A 38 VAL HG2% 1.0 0.0 5.70 2031 1541 A 34 PHE HE% A 38 VAL HG1% 1.0 0.0 5.70 2032 1542 A 35 ALA HB% A 38 VAL HG2% 1.0 0.0 3.72 2033 1542 A 35 ALA HB% A 38 VAL HG1% 1.0 0.0 3.72 2034 1543 A 36 ASP HBx A 37 LYS HGy 1.0 0.0 4.88 2035 1543 A 36 ASP HBy A 37 LYS HGy 1.0 0.0 4.88 2036 1543 A 37 LYS HGx A 36 ASP HBx 1.0 0.0 4.88 2037 1543 A 36 ASP HBy A 37 LYS HGx 1.0 0.0 4.88 2038 1544 A 37 LYS H A 37 LYS HGy 1.0 0.0 4.98 2039 1544 A 37 LYS H A 37 LYS HGx 1.0 0.0 4.98 2040 1545 A 37 LYS H A 38 VAL HG2% 1.0 0.0 4.98 2041 1545 A 37 LYS H A 38 VAL HG1% 1.0 0.0 4.98 2042 1546 A 37 LYS HA A 37 LYS HGy 1.0 0.0 3.53 2043 1546 A 37 LYS HA A 37 LYS HGx 1.0 0.0 3.53 2044 1547 A 37 LYS HA A 38 VAL HG2% 1.0 0.0 5.71 2045 1547 A 37 LYS HA A 38 VAL HG1% 1.0 0.0 5.71 2046 1548 A 37 LYS HB2 A 39 VAL HG2% 1.0 0.0 5.35 2047 1548 A 37 LYS HB2 A 39 VAL HG1% 1.0 0.0 5.35 2048 1549 A 37 LYS HB3 A 39 VAL HG2% 1.0 0.0 5.71 2049 1549 A 37 LYS HB3 A 39 VAL HG1% 1.0 0.0 5.71 2050 1550 A 37 LYS HEy A 37 LYS HGy 1.0 0.0 3.49 2051 1550 A 37 LYS HEx A 37 LYS HGy 1.0 0.0 3.49 2052 1550 A 37 LYS HGx A 37 LYS HEy 1.0 0.0 3.49 2053 1550 A 37 LYS HGx A 37 LYS HEx 1.0 0.0 3.49 2054 1551 A 38 VAL H A 37 LYS HGy 1.0 0.0 3.97 2055 1551 A 38 VAL H A 37 LYS HGx 1.0 0.0 3.97 2056 1552 A 37 LYS HGx A 39 VAL HG2% 1.0 0.0 4.23 2057 1552 A 37 LYS HGy A 39 VAL HG2% 1.0 0.0 4.23 2058 1552 A 39 VAL HG1% A 37 LYS HGy 1.0 0.0 4.23 2059 1552 A 37 LYS HGx A 39 VAL HG1% 1.0 0.0 4.23 2060 1553 A 37 LYS HDy A 39 VAL HG2% 1.0 0.0 4.34 2061 1553 A 39 VAL HG1% A 37 LYS HDx 1.0 0.0 4.34 2062 1553 A 37 LYS HDy A 39 VAL HG1% 1.0 0.0 4.34 2063 1553 A 37 LYS HDx A 39 VAL HG2% 1.0 0.0 4.34 2064 1554 A 37 LYS HEx A 39 VAL HG2% 1.0 0.0 3.84 2065 1554 A 37 LYS HEy A 39 VAL HG2% 1.0 0.0 3.84 2066 1554 A 39 VAL HG1% A 37 LYS HEy 1.0 0.0 3.84 2067 1554 A 39 VAL HG1% A 37 LYS HEx 1.0 0.0 3.84 2068 1555 A 38 VAL H A 38 VAL HG2% 1.0 0.0 3.70 2069 1555 A 38 VAL H A 38 VAL HG1% 1.0 0.0 3.70 2070 1556 A 38 VAL HA A 45 VAL HG2% 1.0 0.0 4.39 2071 1556 A 38 VAL HA A 45 VAL HG1% 1.0 0.0 4.39 2072 1557 A 38 VAL HB A 45 VAL HG2% 1.0 0.0 5.71 2073 1557 A 38 VAL HB A 45 VAL HG1% 1.0 0.0 5.71 2074 1558 A 39 VAL H A 38 VAL HG2% 1.0 0.0 4.36 2075 1558 A 39 VAL H A 38 VAL HG1% 1.0 0.0 4.36 2076 1559 A 39 VAL HA A 38 VAL HG2% 1.0 0.0 4.99 2077 1559 A 39 VAL HA A 38 VAL HG1% 1.0 0.0 4.99 2078 1560 A 38 VAL HG2% A 39 VAL HG2% 1.0 0.0 4.79 2079 1560 A 39 VAL HG1% A 38 VAL HG2% 1.0 0.0 4.79 2080 1560 A 38 VAL HG1% A 39 VAL HG1% 1.0 0.0 4.79 2081 1560 A 38 VAL HG1% A 39 VAL HG2% 1.0 0.0 4.79 2082 1561 A 38 VAL HG1% A 40 SER HBx 1.0 0.0 4.60 2083 1561 A 38 VAL HG2% A 40 SER HBx 1.0 0.0 4.60 2084 1561 A 40 SER HBy A 38 VAL HG2% 1.0 0.0 4.60 2085 1561 A 40 SER HBy A 38 VAL HG1% 1.0 0.0 4.60 2086 1562 A 38 VAL HG1% A 45 VAL HG2% 1.0 0.0 3.27 2087 1562 A 38 VAL HG2% A 45 VAL HG2% 1.0 0.0 3.27 2088 1562 A 45 VAL HG1% A 38 VAL HG2% 1.0 0.0 3.27 2089 1562 A 38 VAL HG1% A 45 VAL HG1% 1.0 0.0 3.27 2090 1563 A 47 PHE HA A 38 VAL HG2% 1.0 0.0 3.86 2091 1563 A 47 PHE HA A 38 VAL HG1% 1.0 0.0 3.86 2092 1564 A 47 PHE HD% A 38 VAL HG2% 1.0 0.0 3.44 2093 1564 A 47 PHE HD% A 38 VAL HG1% 1.0 0.0 3.44 2094 1565 A 47 PHE HE% A 38 VAL HG2% 1.0 0.0 3.56 2095 1565 A 47 PHE HE% A 38 VAL HG1% 1.0 0.0 3.56 2096 1566 A 48 CYS H A 38 VAL HG2% 1.0 0.0 4.67 2097 1566 A 48 CYS H A 38 VAL HG1% 1.0 0.0 4.67 2098 1567 A 39 VAL H A 39 VAL HG2% 1.0 0.0 3.53 2099 1567 A 39 VAL H A 39 VAL HG1% 1.0 0.0 3.53 2100 1568 A 39 VAL H A 45 VAL HG2% 1.0 0.0 4.83 2101 1568 A 39 VAL H A 45 VAL HG1% 1.0 0.0 4.83 2102 1569 A 39 VAL HA A 39 VAL HG2% 1.0 0.0 3.13 2103 1569 A 39 VAL HA A 39 VAL HG1% 1.0 0.0 3.13 2104 1570 A 40 SER H A 39 VAL HG2% 1.0 0.0 4.16 2105 1570 A 40 SER H A 39 VAL HG1% 1.0 0.0 4.16 2106 1571 A 40 SER HA A 39 VAL HG2% 1.0 0.0 5.01 2107 1571 A 40 SER HA A 39 VAL HG1% 1.0 0.0 5.01 2108 1572 A 46 THR H A 39 VAL HG2% 1.0 0.0 5.29 2109 1572 A 46 THR H A 39 VAL HG1% 1.0 0.0 5.29 2110 1573 A 46 THR HB A 39 VAL HG2% 1.0 0.0 4.05 2111 1573 A 46 THR HB A 39 VAL HG1% 1.0 0.0 4.05 2112 1574 A 40 SER HA A 41 ASP HBx 1.0 0.0 4.68 2113 1574 A 40 SER HA A 41 ASP HBy 1.0 0.0 4.68 2114 1575 A 40 SER HA A 45 VAL HG2% 1.0 0.0 3.94 2115 1575 A 40 SER HA A 45 VAL HG1% 1.0 0.0 3.94 2116 1576 A 40 SER HBy A 45 VAL HG2% 1.0 0.0 3.48 2117 1576 A 40 SER HBx A 45 VAL HG2% 1.0 0.0 3.48 2118 1576 A 45 VAL HG1% A 40 SER HBx 1.0 0.0 3.48 2119 1576 A 40 SER HBy A 45 VAL HG1% 1.0 0.0 3.48 2120 1577 A 41 ASP H A 45 VAL HG2% 1.0 0.0 4.91 2121 1577 A 41 ASP H A 45 VAL HG1% 1.0 0.0 4.91 2122 1578 A 43 LYS H A 43 LYS HBy 1.0 0.0 3.68 2123 1578 A 43 LYS H A 43 LYS HBx 1.0 0.0 3.68 2124 1579 A 43 LYS H A 43 LYS HGy 1.0 0.0 3.99 2125 1579 A 43 LYS H A 43 LYS HGx 1.0 0.0 3.99 2126 1580 A 43 LYS HA A 43 LYS HGy 1.0 0.0 3.62 2127 1580 A 43 LYS HA A 43 LYS HGx 1.0 0.0 3.62 2128 1581 A 44 THR H A 43 LYS HBy 1.0 0.0 4.23 2129 1581 A 44 THR H A 43 LYS HBx 1.0 0.0 4.23 2130 1582 A 43 LYS HEy A 43 LYS HGy 1.0 0.0 3.14 2131 1582 A 43 LYS HEx A 43 LYS HGy 1.0 0.0 3.14 2132 1582 A 43 LYS HGx A 43 LYS HEx 1.0 0.0 3.14 2133 1582 A 43 LYS HEy A 43 LYS HGx 1.0 0.0 3.14 2134 1583 A 44 THR HA A 45 VAL HG2% 1.0 0.0 4.58 2135 1583 A 44 THR HA A 45 VAL HG1% 1.0 0.0 4.58 2136 1584 A 44 THR HA A 58 GLY HAy 1.0 0.0 4.41 2137 1584 A 44 THR HA A 58 GLY HAx 1.0 0.0 4.41 2138 1585 A 44 THR HG2% A 45 VAL HG2% 1.0 0.0 4.21 2139 1585 A 44 THR HG2% A 45 VAL HG1% 1.0 0.0 4.21 2140 1586 A 56 GLN HE2y A 44 THR HG2% 1.0 0.0 3.97 2141 1586 A 44 THR HG2% A 56 GLN HE2x 1.0 0.0 3.97 2142 1587 A 45 VAL H A 45 VAL HG2% 1.0 0.0 3.73 2143 1587 A 45 VAL H A 45 VAL HG1% 1.0 0.0 3.73 2144 1588 A 45 VAL HA A 45 VAL HG2% 1.0 0.0 3.22 2145 1588 A 45 VAL HA A 45 VAL HG1% 1.0 0.0 3.22 2146 1589 A 46 THR H A 45 VAL HG2% 1.0 0.0 3.57 2147 1589 A 46 THR H A 45 VAL HG1% 1.0 0.0 3.57 2148 1590 A 47 PHE HE% A 45 VAL HG2% 1.0 0.0 4.14 2149 1590 A 47 PHE HE% A 45 VAL HG1% 1.0 0.0 4.14 2150 1591 A 57 ALA HB% A 45 VAL HG2% 1.0 0.0 3.84 2151 1591 A 57 ALA HB% A 45 VAL HG1% 1.0 0.0 3.84 2152 1592 A 46 THR HG2% A 56 GLN HE2y 1.0 0.0 4.09 2153 1592 A 46 THR HG2% A 56 GLN HE2x 1.0 0.0 4.09 2154 1593 A 47 PHE HE% A 55 ARG HBy 1.0 0.0 4.33 2155 1593 A 47 PHE HE% A 55 ARG HBx 1.0 0.0 4.33 2156 1594 A 55 ARG H A 55 ARG HBy 1.0 0.0 3.52 2157 1594 A 55 ARG H A 55 ARG HBx 1.0 0.0 3.52 2158 1595 A 55 ARG HBy A 55 ARG HDx 1.0 0.0 3.50 2159 1595 A 55 ARG HBx A 55 ARG HDx 1.0 0.0 3.50 2160 1595 A 55 ARG HDy A 55 ARG HBy 1.0 0.0 3.50 2161 1595 A 55 ARG HDy A 55 ARG HBx 1.0 0.0 3.50 2162 1596 A 56 GLN H A 55 ARG HBy 1.0 0.0 3.80 2163 1596 A 56 GLN H A 55 ARG HBx 1.0 0.0 3.80 2164 1597 A 56 GLN HGy A 56 GLN HE2y 1.0 0.0 3.37 2165 1597 A 56 GLN HGy A 56 GLN HE2x 1.0 0.0 3.37 2166 1597 A 56 GLN HE2x A 56 GLN HGx 1.0 0.0 3.37 2167 1597 A 56 GLN HE2y A 56 GLN HGx 1.0 0.0 3.37 2168 1598 A 59 ILE H A 58 GLY HAy 1.0 0.0 3.20 2169 1598 A 59 ILE H A 58 GLY HAx 1.0 0.0 3.20 2170 1599 A 59 ILE HB A 58 GLY HAy 1.0 0.0 5.09 2171 1599 A 59 ILE HB A 58 GLY HAx 1.0 0.0 5.09 2172 1600 A 73 LEU HG A 58 GLY HAy 1.0 0.0 5.15 2173 1600 A 73 LEU HG A 58 GLY HAx 1.0 0.0 5.15 2174 1601 A 59 ILE H A 59 ILE HG1x 1.0 0.0 3.79 2175 1601 A 59 ILE H A 59 ILE HG1y 1.0 0.0 3.79 2176 1602 A 59 ILE HA A 59 ILE HG1x 1.0 0.0 3.65 2177 1602 A 59 ILE HA A 59 ILE HG1y 1.0 0.0 3.65 2178 1603 A 60 VAL H A 59 ILE HG1x 1.0 0.0 5.31 2179 1603 A 60 VAL H A 59 ILE HG1y 1.0 0.0 5.31 2180 1604 A 70 PHE HE% A 59 ILE HG1x 1.0 0.0 3.70 2181 1604 A 70 PHE HE% A 59 ILE HG1y 1.0 0.0 3.70 2182 1605 A 67 PHE HA A 85 LYS HBy 1.0 0.0 5.03 2183 1605 A 67 PHE HA A 85 LYS HBx 1.0 0.0 5.03 2184 1606 A 72 TRP HD1 A 72 TRP HBy 1.0 0.0 3.57 2185 1606 A 72 TRP HD1 A 72 TRP HBx 1.0 0.0 3.57 2186 1607 A 74 ASP H A 72 TRP HBy 1.0 0.0 4.75 2187 1607 A 74 ASP H A 72 TRP HBx 1.0 0.0 4.75 2188 1608 A 73 LEU HB2 A 74 ASP HBx 1.0 0.0 5.28 2189 1608 A 73 LEU HB2 A 74 ASP HBy 1.0 0.0 5.28 2190 1609 A 74 ASP H A 74 ASP HBx 1.0 0.0 3.37 2191 1609 A 74 ASP H A 74 ASP HBy 1.0 0.0 3.37 2192 1610 A 75 ASP H A 75 ASP HBx 1.0 0.0 3.35 2193 1610 A 75 ASP H A 75 ASP HBy 1.0 0.0 3.35 2194 1611 A 76 GLU H A 75 ASP HBx 1.0 0.0 4.62 2195 1611 A 76 GLU H A 75 ASP HBy 1.0 0.0 4.62 2196 1612 A 77 ASN H A 75 ASP HBx 1.0 0.0 5.13 2197 1612 A 77 ASN H A 75 ASP HBy 1.0 0.0 5.13 2198 1613 A 76 GLU H A 76 GLU HGx 1.0 0.0 4.86 2199 1613 A 76 GLU H A 76 GLU HGy 1.0 0.0 4.86 2200 1614 A 76 GLU HA A 76 GLU HGx 1.0 0.0 3.57 2201 1614 A 76 GLU HA A 76 GLU HGy 1.0 0.0 3.57 2202 1615 A 77 ASN HA A 76 GLU HGx 1.0 0.0 5.61 2203 1615 A 77 ASN HA A 76 GLU HGy 1.0 0.0 5.61 2204 1616 A 79 ARG H A 79 ARG HBy 1.0 0.0 3.70 2205 1616 A 79 ARG H A 79 ARG HBx 1.0 0.0 3.70 2206 1617 A 79 ARG H A 80 ASP HBx 1.0 0.0 5.17 2207 1617 A 79 ARG H A 80 ASP HBy 1.0 0.0 5.17 2208 1618 A 80 ASP H A 80 ASP HBx 1.0 0.0 3.62 2209 1618 A 80 ASP H A 80 ASP HBy 1.0 0.0 3.62 2210 1619 A 81 TYR H A 80 ASP HBx 1.0 0.0 3.96 2211 1619 A 81 TYR H A 80 ASP HBy 1.0 0.0 3.96 2212 1620 A 83 GLU H A 82 PHE HBx 1.0 0.0 4.16 2213 1620 A 83 GLU H A 82 PHE HBy 1.0 0.0 4.16 2214 1621 A 82 PHE HD% A 99 ILE HG1x 1.0 0.0 5.51 2215 1621 A 82 PHE HD% A 99 ILE HG1y 1.0 0.0 5.51 2216 1622 A 84 ILE HG2% A 99 ILE HG1x 1.0 0.0 3.06 2217 1622 A 84 ILE HG2% A 99 ILE HG1y 1.0 0.0 3.06 2218 1623 A 84 ILE HG12 A 99 ILE HG1x 1.0 0.0 4.51 2219 1623 A 84 ILE HG12 A 99 ILE HG1y 1.0 0.0 4.51 2220 1624 A 84 ILE HG13 A 99 ILE HG1x 1.0 0.0 4.28 2221 1624 A 84 ILE HG13 A 99 ILE HG1y 1.0 0.0 4.28 2222 1625 A 85 LYS H A 85 LYS HBy 1.0 0.0 3.89 2223 1625 A 85 LYS H A 85 LYS HBx 1.0 0.0 3.89 2224 1626 A 85 LYS H A 98 GLU HBy 1.0 0.0 4.78 2225 1626 A 85 LYS H A 98 GLU HBx 1.0 0.0 4.78 2226 1627 A 86 MET H A 85 LYS HBy 1.0 0.0 4.60 2227 1627 A 86 MET H A 85 LYS HBx 1.0 0.0 4.60 2228 1628 A 86 MET HA A 87 SER HBx 1.0 0.0 5.61 2229 1628 A 86 MET HA A 87 SER HBy 1.0 0.0 5.61 2230 1629 A 88 TYR H A 87 SER HBx 1.0 0.0 4.35 2231 1629 A 88 TYR H A 87 SER HBy 1.0 0.0 4.35 2232 1630 A 88 TYR HA A 87 SER HBx 1.0 0.0 5.30 2233 1630 A 88 TYR HA A 87 SER HBy 1.0 0.0 5.30 2234 1631 A 88 TYR HA A 89 ASN HBx 1.0 0.0 5.61 2235 1631 A 88 TYR HA A 89 ASN HBy 1.0 0.0 5.61 2236 1632 A 88 TYR HA A 89 ASN HD2y 1.0 0.0 5.42 2237 1632 A 88 TYR HA A 89 ASN HD2x 1.0 0.0 5.42 2238 1633 A 89 ASN HD2y A 88 TYR HBx 1.0 0.0 5.61 2239 1633 A 89 ASN HD2x A 88 TYR HBx 1.0 0.0 5.61 2240 1633 A 88 TYR HBy A 89 ASN HD2y 1.0 0.0 5.61 2241 1633 A 88 TYR HBy A 89 ASN HD2x 1.0 0.0 5.61 2242 1634 A 89 ASN HD2y A 89 ASN HA 1.0 0.0 4.25 2243 1634 A 89 ASN HD2x A 89 ASN HA 1.0 0.0 4.25 2244 1635 A 89 ASN HD2y A 89 ASN HBy 1.0 0.0 3.37 2245 1635 A 89 ASN HD2y A 89 ASN HBx 1.0 0.0 3.37 2246 1635 A 89 ASN HD2x A 89 ASN HBx 1.0 0.0 3.37 2247 1635 A 89 ASN HD2x A 89 ASN HBy 1.0 0.0 3.37 2248 1636 A 90 GLU H A 89 ASN HBx 1.0 0.0 4.53 2249 1636 A 90 GLU H A 89 ASN HBy 1.0 0.0 4.53 2250 1637 A 91 LEU H A 89 ASN HBx 1.0 0.0 4.67 2251 1637 A 91 LEU H A 89 ASN HBy 1.0 0.0 4.67 2252 1638 A 92 THR H A 89 ASN HBx 1.0 0.0 4.21 2253 1638 A 92 THR H A 89 ASN HBy 1.0 0.0 4.21 2254 1639 A 93 GLY H A 89 ASN HBx 1.0 0.0 4.33 2255 1639 A 93 GLY H A 89 ASN HBy 1.0 0.0 4.33 2256 1640 A 94 ASP H A 89 ASN HBx 1.0 0.0 4.02 2257 1640 A 94 ASP H A 89 ASN HBy 1.0 0.0 4.02 2258 1641 A 89 ASN HBx A 96 VAL HGx% 1.0 0.0 4.82 2259 1641 A 89 ASN HBy A 96 VAL HGx% 1.0 0.0 4.82 2260 1641 A 96 VAL HGy% A 89 ASN HBx 1.0 0.0 4.82 2261 1641 A 96 VAL HGy% A 89 ASN HBy 1.0 0.0 4.82 2262 1642 A 92 THR HG2% A 89 ASN HD2y 1.0 0.0 3.81 2263 1642 A 92 THR HG2% A 89 ASN HD2x 1.0 0.0 3.81 2264 1643 A 89 ASN HD2y A 95 TYR HA 1.0 0.0 4.81 2265 1643 A 95 TYR HA A 89 ASN HD2x 1.0 0.0 4.81 2266 1644 A 91 LEU H A 91 LEU HBy 1.0 0.0 3.35 2267 1644 A 91 LEU H A 91 LEU HBx 1.0 0.0 3.35 2268 1645 A 91 LEU HD2% A 91 LEU HBy 1.0 0.0 3.43 2269 1645 A 91 LEU HD2% A 91 LEU HBx 1.0 0.0 3.43 2270 1646 A 92 THR HG2% A 91 LEU HBy 1.0 0.0 4.91 2271 1646 A 92 THR HG2% A 91 LEU HBx 1.0 0.0 4.91 2272 1647 A 92 THR H A 93 GLY HAx 1.0 0.0 4.61 2273 1647 A 92 THR H A 93 GLY HAy 1.0 0.0 4.61 2274 1648 A 92 THR HG2% A 93 GLY HAx 1.0 0.0 4.98 2275 1648 A 92 THR HG2% A 93 GLY HAy 1.0 0.0 4.98 2276 1649 A 93 GLY HAx A 94 ASP HBx 1.0 0.0 5.44 2277 1649 A 93 GLY HAy A 94 ASP HBx 1.0 0.0 5.44 2278 1649 A 94 ASP HBy A 93 GLY HAx 1.0 0.0 5.44 2279 1649 A 94 ASP HBy A 93 GLY HAy 1.0 0.0 5.44 2280 1650 A 97 LEU HG A 99 ILE HG1x 1.0 0.0 5.61 2281 1650 A 97 LEU HG A 99 ILE HG1y 1.0 0.0 5.61 2282 1651 A 98 GLU H A 98 GLU HBy 1.0 0.0 3.74 2283 1651 A 98 GLU H A 98 GLU HBx 1.0 0.0 3.74 2284 1652 A 99 ILE H A 98 GLU HBy 1.0 0.0 4.53 2285 1652 A 99 ILE H A 98 GLU HBx 1.0 0.0 4.53 2286 1653 A 99 ILE HG2% A 99 ILE HG1x 1.0 0.0 3.36 2287 1653 A 99 ILE HG2% A 99 ILE HG1y 1.0 0.0 3.36 2288 1654 A 99 ILE HG2% A 101 ASP HBx 1.0 0.0 3.91 2289 1654 A 99 ILE HG2% A 101 ASP HBy 1.0 0.0 3.91 2290 1655 A 102 PHE H A 101 ASP HBx 1.0 0.0 4.01 2291 1655 A 102 PHE H A 101 ASP HBy 1.0 0.0 4.01 2292 1656 A 101 ASP HBx A 111 LEU HDx% 1.0 0.0 4.14 2293 1656 A 101 ASP HBy A 111 LEU HDx% 1.0 0.0 4.14 2294 1656 A 111 LEU HDy% A 101 ASP HBx 1.0 0.0 4.14 2295 1656 A 111 LEU HDy% A 101 ASP HBy 1.0 0.0 4.14 2296 1657 A 102 PHE H A 102 PHE HBx 1.0 0.0 3.73 2297 1657 A 102 PHE H A 102 PHE HBy 1.0 0.0 3.73 2298 1658 A 103 SER H A 102 PHE HBx 1.0 0.0 4.32 2299 1658 A 103 SER H A 102 PHE HBy 1.0 0.0 4.32 2300 1659 A 103 SER HA A 104 GLU HGx 1.0 0.0 5.61 2301 1659 A 103 SER HA A 104 GLU HGy 1.0 0.0 5.61 2302 1660 A 104 GLU H A 103 SER HBx 1.0 0.0 4.22 2303 1660 A 104 GLU H A 103 SER HBy 1.0 0.0 4.22 2304 1661 A 107 GLU H A 103 SER HBx 1.0 0.0 5.31 2305 1661 A 107 GLU H A 103 SER HBy 1.0 0.0 5.31 2306 1662 A 108 ALA HA A 103 SER HBx 1.0 0.0 3.76 2307 1662 A 108 ALA HA A 103 SER HBy 1.0 0.0 3.76 2308 1663 A 108 ALA HB% A 103 SER HBx 1.0 0.0 4.36 2309 1663 A 108 ALA HB% A 103 SER HBy 1.0 0.0 4.36 2310 1664 A 111 LEU HG A 103 SER HBx 1.0 0.0 4.06 2311 1664 A 111 LEU HG A 103 SER HBy 1.0 0.0 4.06 2312 1665 A 104 GLU H A 107 GLU HBy 1.0 0.0 5.61 2313 1665 A 104 GLU H A 107 GLU HBx 1.0 0.0 5.61 2314 1666 A 104 GLU HA A 104 GLU HGx 1.0 0.0 3.78 2315 1666 A 104 GLU HA A 104 GLU HGy 1.0 0.0 3.78 2316 1667 A 107 GLU H A 107 GLU HBy 1.0 0.0 3.58 2317 1667 A 107 GLU H A 107 GLU HBx 1.0 0.0 3.58 2318 1668 A 109 ASP HA A 112 LYS HBx 1.0 0.0 4.17 2319 1668 A 109 ASP HA A 112 LYS HBy 1.0 0.0 4.17 2320 1669 A 109 ASP HA A 112 LYS HGy 1.0 0.0 5.61 2321 1669 A 109 ASP HA A 112 LYS HGx 1.0 0.0 5.61 2322 1670 A 110 ASP H A 110 ASP HBx 1.0 0.0 3.52 2323 1670 A 110 ASP H A 110 ASP HBy 1.0 0.0 3.52 2324 1671 A 111 LEU H A 110 ASP HBx 1.0 0.0 3.65 2325 1671 A 111 LEU H A 110 ASP HBy 1.0 0.0 3.65 2326 1672 A 111 LEU HA A 114 LEU HBy 1.0 0.0 4.00 2327 1672 A 111 LEU HA A 114 LEU HBx 1.0 0.0 4.00 2328 1673 A 111 LEU HA A 114 LEU HD1% 1.0 0.0 4.46 2329 1673 A 111 LEU HA A 114 LEU HD2% 1.0 0.0 4.46 2330 1674 A 111 LEU HB3 A 112 LYS HGy 1.0 0.0 4.56 2331 1674 A 111 LEU HB3 A 112 LYS HGx 1.0 0.0 4.56 2332 1675 A 111 LEU HDx% A 112 LYS HGy 1.0 0.0 5.07 2333 1675 A 111 LEU HDy% A 112 LYS HGy 1.0 0.0 5.07 2334 1675 A 112 LYS HGx A 111 LEU HDx% 1.0 0.0 5.07 2335 1675 A 111 LEU HDy% A 112 LYS HGx 1.0 0.0 5.07 2336 1676 A 112 LYS H A 112 LYS HBx 1.0 0.0 3.75 2337 1676 A 112 LYS H A 112 LYS HBy 1.0 0.0 3.75 2338 1677 A 112 LYS H A 112 LYS HGy 1.0 0.0 3.52 2339 1677 A 112 LYS H A 112 LYS HGx 1.0 0.0 3.52 2340 1678 A 112 LYS H A 112 LYS HDy 1.0 0.0 4.55 2341 1678 A 112 LYS H A 112 LYS HDx 1.0 0.0 4.55 2342 1679 A 112 LYS HA A 112 LYS HDy 1.0 0.0 4.35 2343 1679 A 112 LYS HA A 112 LYS HDx 1.0 0.0 4.35 2344 1680 A 112 LYS HA A 115 TRP HBy 1.0 0.0 4.45 2345 1680 A 112 LYS HA A 115 TRP HBx 1.0 0.0 4.45 2346 1681 A 113 GLU H A 112 LYS HBx 1.0 0.0 3.69 2347 1681 A 113 GLU H A 112 LYS HBy 1.0 0.0 3.69 2348 1682 A 112 LYS HEy A 112 LYS HGy 1.0 0.0 2.54 2349 1682 A 112 LYS HEx A 112 LYS HGy 1.0 0.0 2.54 2350 1682 A 112 LYS HGx A 112 LYS HEx 1.0 0.0 2.54 2351 1682 A 112 LYS HEy A 112 LYS HGx 1.0 0.0 2.54 2352 1683 A 113 GLU H A 112 LYS HGy 1.0 0.0 4.96 2353 1683 A 113 GLU H A 112 LYS HGx 1.0 0.0 4.96 2354 1684 A 113 GLU HA A 116 ASP HBx 1.0 0.0 3.55 2355 1684 A 113 GLU HA A 116 ASP HBy 1.0 0.0 3.55 2356 1685 A 114 LEU H A 114 LEU HBy 1.0 0.0 3.21 2357 1685 A 114 LEU H A 114 LEU HBx 1.0 0.0 3.21 2358 1686 A 114 LEU H A 114 LEU HD1% 1.0 0.0 4.09 2359 1686 A 114 LEU H A 114 LEU HD2% 1.0 0.0 4.09 2360 1687 A 114 LEU H A 115 TRP HBy 1.0 0.0 5.02 2361 1687 A 114 LEU H A 115 TRP HBx 1.0 0.0 5.02 2362 1688 A 114 LEU HBy A 114 LEU HD1% 1.0 0.0 2.90 2363 1688 A 114 LEU HBx A 114 LEU HD1% 1.0 0.0 2.90 2364 1688 A 114 LEU HD2% A 114 LEU HBy 1.0 0.0 2.90 2365 1688 A 114 LEU HBx A 114 LEU HD2% 1.0 0.0 2.90 2366 1689 A 115 TRP H A 114 LEU HBy 1.0 0.0 3.58 2367 1689 A 115 TRP H A 114 LEU HBx 1.0 0.0 3.58 2368 1690 A 115 TRP H A 114 LEU HD1% 1.0 0.0 4.36 2369 1690 A 115 TRP H A 114 LEU HD2% 1.0 0.0 4.36 2370 1691 A 115 TRP HA A 114 LEU HD1% 1.0 0.0 5.50 2371 1691 A 115 TRP HA A 114 LEU HD2% 1.0 0.0 5.50 2372 1692 A 114 LEU HD2% A 118 GLN HGx 1.0 0.0 4.16 2373 1692 A 114 LEU HD1% A 118 GLN HGx 1.0 0.0 4.16 2374 1692 A 118 GLN HGy A 114 LEU HD1% 1.0 0.0 4.16 2375 1692 A 118 GLN HGy A 114 LEU HD2% 1.0 0.0 4.16 2376 1693 A 115 TRP H A 115 TRP HBy 1.0 0.0 3.58 2377 1693 A 115 TRP H A 115 TRP HBx 1.0 0.0 3.58 2378 1694 A 115 TRP HA A 118 GLN HBx 1.0 0.0 3.31 2379 1694 A 115 TRP HA A 118 GLN HBy 1.0 0.0 3.31 2380 1695 A 116 ASP H A 115 TRP HBy 1.0 0.0 3.94 2381 1695 A 116 ASP H A 115 TRP HBx 1.0 0.0 3.94 2382 1696 A 116 ASP H A 116 ASP HBx 1.0 0.0 3.33 2383 1696 A 116 ASP H A 116 ASP HBy 1.0 0.0 3.33 2384 1697 A 116 ASP HA A 119 VAL HGy% 1.0 0.0 4.46 2385 1697 A 116 ASP HA A 119 VAL HGx% 1.0 0.0 4.46 2386 1698 A 117 SER H A 116 ASP HBx 1.0 0.0 3.77 2387 1698 A 117 SER H A 116 ASP HBy 1.0 0.0 3.77 2388 1699 A 118 GLN H A 118 GLN HBx 1.0 0.0 3.78 2389 1699 A 118 GLN H A 118 GLN HBy 1.0 0.0 3.78 2390 1700 A 118 GLN H A 119 VAL HGy% 1.0 0.0 4.75 2391 1700 A 118 GLN H A 119 VAL HGx% 1.0 0.0 4.75 2392 1701 A 119 VAL H A 118 GLN HBx 1.0 0.0 4.00 2393 1701 A 119 VAL H A 118 GLN HBy 1.0 0.0 4.00 2394 1702 A 118 GLN HBx A 119 VAL HGy% 1.0 0.0 4.66 2395 1702 A 118 GLN HBy A 119 VAL HGy% 1.0 0.0 4.66 2396 1702 A 119 VAL HGx% A 118 GLN HBx 1.0 0.0 4.66 2397 1702 A 118 GLN HBy A 119 VAL HGx% 1.0 0.0 4.66 2398 1703 A 118 GLN HE2x A 121 LYS HBx 1.0 0.0 4.29 2399 1703 A 118 GLN HE2y A 121 LYS HBx 1.0 0.0 4.29 2400 1703 A 121 LYS HBy A 118 GLN HE2y 1.0 0.0 4.29 2401 1703 A 118 GLN HE2x A 121 LYS HBy 1.0 0.0 4.29 2402 1704 A 119 VAL H A 119 VAL HGy% 1.0 0.0 3.37 2403 1704 A 119 VAL H A 119 VAL HGx% 1.0 0.0 3.37 2404 1705 A 119 VAL HA A 122 LEU HBy 1.0 0.0 3.82 2405 1705 A 119 VAL HA A 122 LEU HBx 1.0 0.0 3.82 2406 1706 A 119 VAL HA A 122 LEU HD1% 1.0 0.0 4.44 2407 1706 A 119 VAL HA A 122 LEU HD2% 1.0 0.0 4.44 2408 1707 A 120 SER H A 119 VAL HGy% 1.0 0.0 3.91 2409 1707 A 120 SER H A 119 VAL HGx% 1.0 0.0 3.91 2410 1708 A 119 VAL HGx% A 122 LEU HBy 1.0 0.0 4.98 2411 1708 A 119 VAL HGy% A 122 LEU HBy 1.0 0.0 4.98 2412 1708 A 122 LEU HBx A 119 VAL HGy% 1.0 0.0 4.98 2413 1708 A 119 VAL HGx% A 122 LEU HBx 1.0 0.0 4.98 2414 1709 A 119 VAL HGx% A 122 LEU HD1% 1.0 0.0 3.61 2415 1709 A 119 VAL HGy% A 122 LEU HD1% 1.0 0.0 3.61 2416 1709 A 122 LEU HD2% A 119 VAL HGy% 1.0 0.0 3.61 2417 1709 A 122 LEU HD2% A 119 VAL HGx% 1.0 0.0 3.61 2418 1710 A 121 LYS H A 122 LEU HBy 1.0 0.0 5.06 2419 1710 A 121 LYS H A 122 LEU HBx 1.0 0.0 5.06 2420 1711 A 121 LYS HA A 124 ARG HGx 1.0 0.0 3.66 2421 1711 A 121 LYS HA A 124 ARG HGy 1.0 0.0 3.66 2422 1712 A 121 LYS HBy A 124 ARG HGx 1.0 0.0 4.36 2423 1712 A 121 LYS HBx A 124 ARG HGx 1.0 0.0 4.36 2424 1712 A 124 ARG HGy A 121 LYS HBx 1.0 0.0 4.36 2425 1712 A 121 LYS HBy A 124 ARG HGy 1.0 0.0 4.36 2426 1713 A 122 LEU H A 122 LEU HD1% 1.0 0.0 4.65 2427 1713 A 122 LEU H A 122 LEU HD2% 1.0 0.0 4.65 2428 1714 A 122 LEU H A 124 ARG HGx 1.0 0.0 5.55 2429 1714 A 122 LEU H A 124 ARG HGy 1.0 0.0 5.55 2430 1715 A 122 LEU HA A 122 LEU HD1% 1.0 0.0 3.38 2431 1715 A 122 LEU HA A 122 LEU HD2% 1.0 0.0 3.38 2432 1716 A 122 LEU HA A 129 LEU HDx% 1.0 0.0 5.71 2433 1716 A 122 LEU HA A 129 LEU HDy% 1.0 0.0 5.71 2434 1717 A 123 ARG H A 122 LEU HBy 1.0 0.0 4.00 2435 1717 A 123 ARG H A 122 LEU HBx 1.0 0.0 4.00 2436 1718 A 125 THR HG2% A 122 LEU HBy 1.0 0.0 4.82 2437 1718 A 125 THR HG2% A 122 LEU HBx 1.0 0.0 4.82 2438 1719 A 123 ARG HA A 122 LEU HD1% 1.0 0.0 5.71 2439 1719 A 123 ARG HA A 122 LEU HD2% 1.0 0.0 5.71 2440 1720 A 125 THR H A 122 LEU HD1% 1.0 0.0 5.37 2441 1720 A 125 THR H A 122 LEU HD2% 1.0 0.0 5.37 2442 1721 A 125 THR HB A 122 LEU HD1% 1.0 0.0 4.99 2443 1721 A 125 THR HB A 122 LEU HD2% 1.0 0.0 4.99 2444 1722 A 125 THR HG2% A 122 LEU HD1% 1.0 0.0 3.03 2445 1722 A 125 THR HG2% A 122 LEU HD2% 1.0 0.0 3.03 2446 1723 A 126 CYS H A 122 LEU HD1% 1.0 0.0 5.71 2447 1723 A 126 CYS H A 122 LEU HD2% 1.0 0.0 5.71 2448 1724 A 123 ARG H A 124 ARG HGx 1.0 0.0 5.61 2449 1724 A 123 ARG H A 124 ARG HGy 1.0 0.0 5.61 2450 1725 A 124 ARG H A 124 ARG HGx 1.0 0.0 3.39 2451 1725 A 124 ARG H A 124 ARG HGy 1.0 0.0 3.39 2452 1726 A 125 THR H A 124 ARG HGx 1.0 0.0 5.61 2453 1726 A 125 THR H A 124 ARG HGy 1.0 0.0 5.61 2454 1727 A 126 CYS HA A 127 GLY HAx 1.0 0.0 4.36 2455 1727 A 126 CYS HA A 127 GLY HAy 1.0 0.0 4.36 2456 1728 A 128 PHE HA A 129 LEU HBy 1.0 0.0 5.61 2457 1728 A 128 PHE HA A 129 LEU HBx 1.0 0.0 5.61 2458 1729 A 129 LEU H A 129 LEU HBy 1.0 0.0 3.75 2459 1729 A 129 LEU H A 129 LEU HBx 1.0 0.0 3.75 2460 1730 A 129 LEU H A 129 LEU HDx% 1.0 0.0 4.76 2461 1730 A 129 LEU H A 129 LEU HDy% 1.0 0.0 4.76 2462 1731 A 129 LEU HA A 129 LEU HDx% 1.0 0.0 3.16 2463 1731 A 129 LEU HA A 129 LEU HDy% 1.0 0.0 3.16 2464 1732 A 129 LEU HBy A 129 LEU HDx% 1.0 0.0 2.68 2465 1732 A 129 LEU HBx A 129 LEU HDx% 1.0 0.0 2.68 2466 1732 A 129 LEU HDy% A 129 LEU HBy 1.0 0.0 2.68 2467 1732 A 129 LEU HDy% A 129 LEU HBx 1.0 0.0 2.68 2468 1733 A 130 GLU H A 129 LEU HDx% 1.0 0.0 4.95 2469 1733 A 130 GLU H A 129 LEU HDy% 1.0 0.0 4.95 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 4 GLU C A 5 LYS N A 5 LYS CA A 5 LYS C 1.0 -103.0 -63.0 PHI 2 2 A 5 LYS N A 5 LYS CA A 5 LYS C A 6 ILE N 1.0 105.0 153.0 PSI 3 3 A 5 LYS C A 6 ILE N A 6 ILE CA A 6 ILE C 1.0 -145.0 -101.0 PHI 4 4 A 6 ILE N A 6 ILE CA A 6 ILE C A 7 HIS N 1.0 112.0 168.0 PSI 5 5 A 6 ILE C A 7 HIS N A 7 HIS CA A 7 HIS C 1.0 -137.0 -77.0 PHI 6 6 A 7 HIS N A 7 HIS CA A 7 HIS C A 8 LEU N 1.0 103.0 143.0 PSI 7 7 A 7 HIS C A 8 LEU N A 8 LEU CA A 8 LEU C 1.0 -146.0 -102.0 PHI 8 8 A 8 LEU N A 8 LEU CA A 8 LEU C A 9 GLU N 1.0 118.0 174.0 PSI 9 9 A 8 LEU C A 9 GLU N A 9 GLU CA A 9 GLU C 1.0 -156.0 -92.0 PHI 10 10 A 9 GLU N A 9 GLU CA A 9 GLU C A 10 TYR N 1.0 114.0 166.0 PSI 11 11 A 9 GLU C A 10 TYR N A 10 TYR CA A 10 TYR C 1.0 -158.0 -102.0 PHI 12 12 A 10 TYR N A 10 TYR CA A 10 TYR C A 11 LEU N 1.0 122.0 174.0 PSI 13 13 A 10 TYR C A 11 LEU N A 11 LEU CA A 11 LEU C 1.0 -136.0 -72.0 PHI 14 14 A 11 LEU N A 11 LEU CA A 11 LEU C A 12 LEU N 1.0 105.0 145.0 PSI 15 15 A 11 LEU C A 12 LEU N A 12 LEU CA A 12 LEU C 1.0 -174.0 -62.0 PHI 16 16 A 12 LEU N A 12 LEU CA A 12 LEU C A 13 ASN N 1.0 117.0 177.0 PSI 17 17 A 12 LEU C A 13 ASN N A 13 ASN CA A 13 ASN C 1.0 -174.0 -46.0 PHI 18 18 A 13 ASN N A 13 ASN CA A 13 ASN C A 14 ALA N 1.0 85.0 197.0 PSI 19 19 A 17 LYS C A 18 ASN N A 18 ASN CA A 18 ASN C 1.0 -70.0 -50.0 PHI 20 20 A 18 ASN N A 18 ASN CA A 18 ASN C A 19 ILE N 1.0 -51.0 -31.0 PSI 21 21 A 18 ASN C A 19 ILE N A 19 ILE CA A 19 ILE C 1.0 -88.0 -52.0 PHI 22 22 A 19 ILE N A 19 ILE CA A 19 ILE C A 20 LEU N 1.0 -56.0 -20.0 PSI 23 23 A 19 ILE C A 20 LEU N A 20 LEU CA A 20 LEU C 1.0 -81.0 -45.0 PHI 24 24 A 20 LEU N A 20 LEU CA A 20 LEU C A 21 TRP N 1.0 -62.0 -22.0 PSI 25 25 A 20 LEU C A 21 TRP N A 21 TRP CA A 21 TRP C 1.0 -97.0 -57.0 PHI 26 26 A 21 TRP N A 21 TRP CA A 21 TRP C A 22 SER N 1.0 -60.0 -16.0 PSI 27 27 A 21 TRP C A 22 SER N A 22 SER CA A 22 SER C 1.0 -75.0 -55.0 PHI 28 28 A 22 SER N A 22 SER CA A 22 SER C A 23 ALA N 1.0 -55.0 -19.0 PSI 29 29 A 22 SER C A 23 ALA N A 23 ALA CA A 23 ALA C 1.0 -88.0 -52.0 PHI 30 30 A 23 ALA N A 23 ALA CA A 23 ALA C A 24 ILE N 1.0 -59.0 1.0 PSI 31 31 A 27 PRO C A 28 THR N A 28 THR CA A 28 THR C 1.0 -77.0 -49.0 PHI 32 32 A 28 THR N A 28 THR CA A 28 THR C A 29 GLY N 1.0 -50.0 -18.0 PSI 33 33 A 28 THR C A 29 GLY N A 29 GLY CA A 29 GLY C 1.0 -76.0 -56.0 PHI 34 34 A 29 GLY N A 29 GLY CA A 29 GLY C A 30 LEU N 1.0 -53.0 -33.0 PSI 35 35 A 29 GLY C A 30 LEU N A 30 LEU CA A 30 LEU C 1.0 -85.0 -45.0 PHI 36 36 A 30 LEU N A 30 LEU CA A 30 LEU C A 31 GLU N 1.0 -57.0 -17.0 PSI 37 37 A 30 LEU C A 31 GLU N A 31 GLU CA A 31 GLU C 1.0 -79.0 -55.0 PHI 38 38 A 31 GLU N A 31 GLU CA A 31 GLU C A 32 ASP N 1.0 -64.0 20.0 PSI 39 39 A 36 ASP C A 37 LYS N A 37 LYS CA A 37 LYS C 1.0 -167.0 -111.0 PHI 40 40 A 37 LYS N A 37 LYS CA A 37 LYS C A 38 VAL N 1.0 123.0 147.0 PSI 41 41 A 37 LYS C A 38 VAL N A 38 VAL CA A 38 VAL C 1.0 -139.0 -99.0 PHI 42 42 A 38 VAL N A 38 VAL CA A 38 VAL C A 39 VAL N 1.0 110.0 142.0 PSI 43 43 A 38 VAL C A 39 VAL N A 39 VAL CA A 39 VAL C 1.0 -164.0 -100.0 PHI 44 44 A 39 VAL N A 39 VAL CA A 39 VAL C A 40 SER N 1.0 119.0 179.0 PSI 45 45 A 39 VAL C A 40 SER N A 40 SER CA A 40 SER C 1.0 -172.0 -80.0 PHI 46 46 A 40 SER N A 40 SER CA A 40 SER C A 41 ASP N 1.0 103.0 187.0 PSI 47 47 A 43 LYS C A 44 THR N A 44 THR CA A 44 THR C 1.0 -160.0 -92.0 PHI 48 48 A 44 THR N A 44 THR CA A 44 THR C A 45 VAL N 1.0 106.0 166.0 PSI 49 49 A 44 THR C A 45 VAL N A 45 VAL CA A 45 VAL C 1.0 -131.0 -83.0 PHI 50 50 A 45 VAL N A 45 VAL CA A 45 VAL C A 46 THR N 1.0 98.0 146.0 PSI 51 51 A 45 VAL C A 46 THR N A 46 THR CA A 46 THR C 1.0 -134.0 -70.0 PHI 52 52 A 46 THR N A 46 THR CA A 46 THR C A 47 PHE N 1.0 112.0 144.0 PSI 53 53 A 46 THR C A 47 PHE N A 47 PHE CA A 47 PHE C 1.0 -160.0 -84.0 PHI 54 54 A 47 PHE N A 47 PHE CA A 47 PHE C A 48 CYS N 1.0 99.0 195.0 PSI 55 55 A 47 PHE C A 48 CYS N A 48 CYS CA A 48 CYS C 1.0 -141.0 -77.0 PHI 56 56 A 48 CYS N A 48 CYS CA A 48 CYS C A 49 TRP N 1.0 113.0 161.0 PSI 57 57 A 53 GLU C A 54 GLN N A 54 GLN CA A 54 GLN C 1.0 -156.0 -80.0 PHI 58 58 A 54 GLN N A 54 GLN CA A 54 GLN C A 55 ARG N 1.0 107.0 171.0 PSI 59 59 A 54 GLN C A 55 ARG N A 55 ARG CA A 55 ARG C 1.0 -178.0 -114.0 PHI 60 60 A 55 ARG N A 55 ARG CA A 55 ARG C A 56 GLN N 1.0 110.0 178.0 PSI 61 61 A 55 ARG C A 56 GLN N A 56 GLN CA A 56 GLN C 1.0 -147.0 -75.0 PHI 62 62 A 56 GLN N A 56 GLN CA A 56 GLN C A 57 ALA N 1.0 109.0 165.0 PSI 63 63 A 56 GLN C A 57 ALA N A 57 ALA CA A 57 ALA C 1.0 -166.0 -114.0 PHI 64 64 A 57 ALA N A 57 ALA CA A 57 ALA C A 58 GLY N 1.0 120.0 184.0 PSI 65 65 A 57 ALA C A 58 GLY N A 58 GLY CA A 58 GLY C 1.0 -172.0 -56.0 PHI 66 66 A 58 GLY N A 58 GLY CA A 58 GLY C A 59 ILE N 1.0 120.0 168.0 PSI 67 67 A 58 GLY C A 59 ILE N A 59 ILE CA A 59 ILE C 1.0 -92.0 -68.0 PHI 68 68 A 59 ILE N A 59 ILE CA A 59 ILE C A 60 VAL N 1.0 90.0 146.0 PSI 69 69 A 59 ILE C A 60 VAL N A 60 VAL CA A 60 VAL C 1.0 -120.0 -76.0 PHI 70 70 A 60 VAL N A 60 VAL CA A 60 VAL C A 61 ALA N 1.0 -55.0 -7.0 PSI 71 71 A 60 VAL C A 61 ALA N A 61 ALA CA A 61 ALA C 1.0 -191.0 -123.0 PHI 72 72 A 61 ALA N A 61 ALA CA A 61 ALA C A 62 ILE N 1.0 145.0 169.0 PSI 73 73 A 61 ALA C A 62 ILE N A 62 ILE CA A 62 ILE C 1.0 -174.0 -94.0 PHI 74 74 A 62 ILE N A 62 ILE CA A 62 ILE C A 63 ARG N 1.0 95.0 167.0 PSI 75 75 A 62 ILE C A 63 ARG N A 63 ARG CA A 63 ARG C 1.0 -156.0 -68.0 PHI 76 76 A 63 ARG N A 63 ARG CA A 63 ARG C A 64 ALA N 1.0 105.0 157.0 PSI 77 77 A 66 SER C A 67 PHE N A 67 PHE CA A 67 PHE C 1.0 -195.0 -95.0 PHI 78 78 A 67 PHE N A 67 PHE CA A 67 PHE C A 68 ILE N 1.0 116.0 200.0 PSI 79 79 A 67 PHE C A 68 ILE N A 68 ILE CA A 68 ILE C 1.0 -150.0 -102.0 PHI 80 80 A 68 ILE N A 68 ILE CA A 68 ILE C A 69 ARG N 1.0 103.0 179.0 PSI 81 81 A 68 ILE C A 69 ARG N A 69 ARG CA A 69 ARG C 1.0 -159.0 -99.0 PHI 82 82 A 69 ARG N A 69 ARG CA A 69 ARG C A 70 PHE N 1.0 110.0 154.0 PSI 83 83 A 69 ARG C A 70 PHE N A 70 PHE CA A 70 PHE C 1.0 -152.0 -96.0 PHI 84 84 A 70 PHE N A 70 PHE CA A 70 PHE C A 71 HIS N 1.0 123.0 171.0 PSI 85 85 A 70 PHE C A 71 HIS N A 71 HIS CA A 71 HIS C 1.0 -163.0 -67.0 PHI 86 86 A 71 HIS N A 71 HIS CA A 71 HIS C A 72 TRP N 1.0 96.0 144.0 PSI 87 87 A 71 HIS C A 72 TRP N A 72 TRP CA A 72 TRP C 1.0 -116.0 -48.0 PHI 88 88 A 72 TRP N A 72 TRP CA A 72 TRP C A 73 LEU N 1.0 91.0 215.0 PSI 89 89 A 81 TYR C A 82 PHE N A 82 PHE CA A 82 PHE C 1.0 -157.0 -85.0 PHI 90 90 A 82 PHE N A 82 PHE CA A 82 PHE C A 83 GLU N 1.0 113.0 165.0 PSI 91 91 A 82 PHE C A 83 GLU N A 83 GLU CA A 83 GLU C 1.0 -165.0 -105.0 PHI 92 92 A 83 GLU N A 83 GLU CA A 83 GLU C A 84 ILE N 1.0 112.0 156.0 PSI 93 93 A 83 GLU C A 84 ILE N A 84 ILE CA A 84 ILE C 1.0 -146.0 -78.0 PHI 94 94 A 84 ILE N A 84 ILE CA A 84 ILE C A 85 LYS N 1.0 112.0 136.0 PSI 95 95 A 84 ILE C A 85 LYS N A 85 LYS CA A 85 LYS C 1.0 -141.0 -97.0 PHI 96 96 A 85 LYS N A 85 LYS CA A 85 LYS C A 86 MET N 1.0 127.0 167.0 PSI 97 97 A 85 LYS C A 86 MET N A 86 MET CA A 86 MET C 1.0 -173.0 -101.0 PHI 98 98 A 86 MET N A 86 MET CA A 86 MET C A 87 SER N 1.0 127.0 175.0 PSI 99 99 A 86 MET C A 87 SER N A 87 SER CA A 87 SER C 1.0 -167.0 -71.0 PHI 100 100 A 87 SER N A 87 SER CA A 87 SER C A 88 TYR N 1.0 115.0 151.0 PSI 101 101 A 87 SER C A 88 TYR N A 88 TYR CA A 88 TYR C 1.0 -150.0 -74.0 PHI 102 102 A 88 TYR N A 88 TYR CA A 88 TYR C A 89 ASN N 1.0 108.0 152.0 PSI 103 103 A 94 ASP C A 95 TYR N A 95 TYR CA A 95 TYR C 1.0 -174.0 -46.0 PHI 104 104 A 95 TYR N A 95 TYR CA A 95 TYR C A 96 VAL N 1.0 132.0 164.0 PSI 105 105 A 95 TYR C A 96 VAL N A 96 VAL CA A 96 VAL C 1.0 -156.0 -76.0 PHI 106 106 A 96 VAL N A 96 VAL CA A 96 VAL C A 97 LEU N 1.0 100.0 152.0 PSI 107 107 A 96 VAL C A 97 LEU N A 97 LEU CA A 97 LEU C 1.0 -133.0 -97.0 PHI 108 108 A 97 LEU N A 97 LEU CA A 97 LEU C A 98 GLU N 1.0 110.0 162.0 PSI 109 109 A 97 LEU C A 98 GLU N A 98 GLU CA A 98 GLU C 1.0 -141.0 -93.0 PHI 110 110 A 98 GLU N A 98 GLU CA A 98 GLU C A 99 ILE N 1.0 109.0 141.0 PSI 111 111 A 98 GLU C A 99 ILE N A 99 ILE CA A 99 ILE C 1.0 -137.0 -97.0 PHI 112 112 A 99 ILE N A 99 ILE CA A 99 ILE C A 100 THR N 1.0 117.0 137.0 PSI 113 113 A 99 ILE C A 100 THR N A 100 THR CA A 100 THR C 1.0 -149.0 -93.0 PHI 114 114 A 100 THR N A 100 THR CA A 100 THR C A 101 ASP N 1.0 101.0 149.0 PSI 115 115 A 100 THR C A 101 ASP N A 101 ASP CA A 101 ASP C 1.0 -155.0 -95.0 PHI 116 116 A 101 ASP N A 101 ASP CA A 101 ASP C A 102 PHE N 1.0 103.0 175.0 PSI 117 117 A 101 ASP C A 102 PHE N A 102 PHE CA A 102 PHE C 1.0 -154.0 -106.0 PHI 118 118 A 102 PHE N A 102 PHE CA A 102 PHE C A 103 SER N 1.0 123.0 171.0 PSI 119 119 A 102 PHE C A 103 SER N A 103 SER CA A 103 SER C 1.0 -170.0 -90.0 PHI 120 120 A 103 SER N A 103 SER CA A 103 SER C A 104 GLU N 1.0 123.0 167.0 PSI 121 121 A 104 GLU C A 105 ALA N A 105 ALA CA A 105 ALA C 1.0 -85.0 -45.0 PHI 122 122 A 105 ALA N A 105 ALA CA A 105 ALA C A 106 ASP N 1.0 -50.0 -22.0 PSI 123 123 A 105 ALA C A 106 ASP N A 106 ASP CA A 106 ASP C 1.0 -88.0 -56.0 PHI 124 124 A 106 ASP N A 106 ASP CA A 106 ASP C A 107 GLU N 1.0 -42.0 10.0 PSI 125 125 A 106 ASP C A 107 GLU N A 107 GLU CA A 107 GLU C 1.0 -141.0 -73.0 PHI 126 126 A 107 GLU N A 107 GLU CA A 107 GLU C A 108 ALA N 1.0 -28.0 44.0 PSI 127 127 A 107 GLU C A 108 ALA N A 108 ALA CA A 108 ALA C 1.0 -74.0 -46.0 PHI 128 128 A 108 ALA N A 108 ALA CA A 108 ALA C A 109 ASP N 1.0 -55.0 -27.0 PSI 129 129 A 108 ALA C A 109 ASP N A 109 ASP CA A 109 ASP C 1.0 -81.0 -53.0 PHI 130 130 A 109 ASP N A 109 ASP CA A 109 ASP C A 110 ASP N 1.0 -49.0 -25.0 PSI 131 131 A 109 ASP C A 110 ASP N A 110 ASP CA A 110 ASP C 1.0 -77.0 -57.0 PHI 132 132 A 110 ASP N A 110 ASP CA A 110 ASP C A 111 LEU N 1.0 -55.0 -23.0 PSI 133 133 A 110 ASP C A 111 LEU N A 111 LEU CA A 111 LEU C 1.0 -76.0 -56.0 PHI 134 134 A 111 LEU N A 111 LEU CA A 111 LEU C A 112 LYS N 1.0 -53.0 -33.0 PSI 135 135 A 111 LEU C A 112 LYS N A 112 LYS CA A 112 LYS C 1.0 -72.0 -52.0 PHI 136 136 A 112 LYS N A 112 LYS CA A 112 LYS C A 113 GLU N 1.0 -56.0 -32.0 PSI 137 137 A 112 LYS C A 113 GLU N A 113 GLU CA A 113 GLU C 1.0 -74.0 -54.0 PHI 138 138 A 113 GLU N A 113 GLU CA A 113 GLU C A 114 LEU N 1.0 -54.0 -26.0 PSI 139 139 A 113 GLU C A 114 LEU N A 114 LEU CA A 114 LEU C 1.0 -76.0 -56.0 PHI 140 140 A 114 LEU N A 114 LEU CA A 114 LEU C A 115 TRP N 1.0 -54.0 -30.0 PSI 141 141 A 114 LEU C A 115 TRP N A 115 TRP CA A 115 TRP C 1.0 -76.0 -52.0 PHI 142 142 A 115 TRP N A 115 TRP CA A 115 TRP C A 116 ASP N 1.0 -64.0 -24.0 PSI 143 143 A 115 TRP C A 116 ASP N A 116 ASP CA A 116 ASP C 1.0 -74.0 -50.0 PHI 144 144 A 116 ASP N A 116 ASP CA A 116 ASP C A 117 SER N 1.0 -53.0 -29.0 PSI 145 145 A 116 ASP C A 117 SER N A 117 SER CA A 117 SER C 1.0 -76.0 -56.0 PHI 146 146 A 117 SER N A 117 SER CA A 117 SER C A 118 GLN N 1.0 -52.0 -28.0 PSI 147 147 A 117 SER C A 118 GLN N A 118 GLN CA A 118 GLN C 1.0 -77.0 -57.0 PHI 148 148 A 118 GLN N A 118 GLN CA A 118 GLN C A 119 VAL N 1.0 -51.0 -31.0 PSI 149 149 A 118 GLN C A 119 VAL N A 119 VAL CA A 119 VAL C 1.0 -74.0 -54.0 PHI 150 150 A 119 VAL N A 119 VAL CA A 119 VAL C A 120 SER N 1.0 -52.0 -32.0 PSI 151 151 A 119 VAL C A 120 SER N A 120 SER CA A 120 SER C 1.0 -71.0 -51.0 PHI 152 152 A 120 SER N A 120 SER CA A 120 SER C A 121 LYS N 1.0 -53.0 -33.0 PSI 153 153 A 120 SER C A 121 LYS N A 121 LYS CA A 121 LYS C 1.0 -73.0 -53.0 PHI 154 154 A 121 LYS N A 121 LYS CA A 121 LYS C A 122 LEU N 1.0 -54.0 -34.0 PSI 155 155 A 121 LYS C A 122 LEU N A 122 LEU CA A 122 LEU C 1.0 -79.0 -55.0 PHI 156 156 A 122 LEU N A 122 LEU CA A 122 LEU C A 123 ARG N 1.0 -52.0 -32.0 PSI 157 157 A 122 LEU C A 123 ARG N A 123 ARG CA A 123 ARG C 1.0 -81.0 -45.0 PHI 158 158 A 123 ARG N A 123 ARG CA A 123 ARG C A 124 ARG N 1.0 -64.0 -20.0 PSI 159 159 A 123 ARG C A 124 ARG N A 124 ARG CA A 124 ARG C 1.0 -80.0 -56.0 PHI 160 160 A 124 ARG N A 124 ARG CA A 124 ARG C A 125 THR N 1.0 -60.0 -20.0 PSI 161 161 A 124 ARG C A 125 THR N A 125 THR CA A 125 THR C 1.0 -88.0 -48.0 PHI 162 162 A 125 THR N A 125 THR CA A 125 THR C A 126 CYS N 1.0 -67.0 -19.0 PSI stop_ save_ save_CNS/XPLOR_dipolar_coupling_4 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode CNS/XPLOR_dipolar_coupling_4 _nef_rdc_restraint_list.potential_type parabolic _nef_rdc_restraint_list.restraint_origin . loop_ _nef_rdc_restraint.index _nef_rdc_restraint.restraint_id _nef_rdc_restraint.chain_code_1 _nef_rdc_restraint.sequence_code_1 _nef_rdc_restraint.residue_name_1 _nef_rdc_restraint.atom_name_1 _nef_rdc_restraint.chain_code_2 _nef_rdc_restraint.sequence_code_2 _nef_rdc_restraint.residue_name_2 _nef_rdc_restraint.atom_name_2 _nef_rdc_restraint.weight _nef_rdc_restraint.lower_limit _nef_rdc_restraint.upper_limit _nef_rdc_restraint.scale 1 1 A 6 ILE N A 6 ILE H 1.0 . . . 2 2 A 7 HIS N A 7 HIS H 1.0 . . . 3 3 A 8 LEU N A 8 LEU H 1.0 . . . 4 4 A 10 TYR N A 10 TYR H 1.0 . . . 5 5 A 11 LEU N A 11 LEU H 1.0 . . . 6 6 A 23 ALA N A 23 ALA H 1.0 . . . 7 7 A 28 THR N A 28 THR H 1.0 . . . 8 8 A 29 GLY N A 29 GLY H 1.0 . . . 9 9 A 37 LYS N A 37 LYS H 1.0 . . . 10 10 A 38 VAL N A 38 VAL H 1.0 . . . 11 11 A 39 VAL N A 39 VAL H 1.0 . . . 12 12 A 40 SER N A 40 SER H 1.0 . . . 13 13 A 45 VAL N A 45 VAL H 1.0 . . . 14 14 A 46 THR N A 46 THR H 1.0 . . . 15 15 A 47 PHE N A 47 PHE H 1.0 . . . 16 16 A 55 ARG N A 55 ARG H 1.0 . . . 17 17 A 56 GLN N A 56 GLN H 1.0 . . . 18 18 A 60 VAL N A 60 VAL H 1.0 . . . 19 19 A 62 ILE N A 62 ILE H 1.0 . . . 20 20 A 63 ARG N A 63 ARG H 1.0 . . . 21 21 A 67 PHE N A 67 PHE H 1.0 . . . 22 22 A 68 ILE N A 68 ILE H 1.0 . . . 23 23 A 69 ARG N A 69 ARG H 1.0 . . . 24 24 A 72 TRP N A 72 TRP H 1.0 . . . 25 25 A 83 GLU N A 83 GLU H 1.0 . . . 26 26 A 84 ILE N A 84 ILE H 1.0 . . . 27 27 A 85 LYS N A 85 LYS H 1.0 . . . 28 28 A 86 MET N A 86 MET H 1.0 . . . 29 29 A 88 TYR N A 88 TYR H 1.0 . . . 30 30 A 96 VAL N A 96 VAL H 1.0 . . . 31 31 A 97 LEU N A 97 LEU H 1.0 . . . 32 32 A 98 GLU N A 98 GLU H 1.0 . . . 33 33 A 101 ASP N A 101 ASP H 1.0 . . . 34 34 A 102 PHE N A 102 PHE H 1.0 . . . 35 35 A 103 SER N A 103 SER H 1.0 . . . 36 36 A 105 ALA N A 105 ALA H 1.0 . . . 37 37 A 106 ASP N A 106 ASP H 1.0 . . . 38 38 A 107 GLU N A 107 GLU H 1.0 . . . 39 39 A 108 ALA N A 108 ALA H 1.0 . . . 40 40 A 110 ASP N A 110 ASP H 1.0 . . . 41 41 A 112 LYS N A 112 LYS H 1.0 . . . 42 42 A 115 TRP N A 115 TRP H 1.0 . . . 43 43 A 116 ASP N A 116 ASP H 1.0 . . . 44 44 A 119 VAL N A 119 VAL H 1.0 . . . 45 45 A 120 SER N A 120 SER H 1.0 . . . 46 46 A 123 ARG N A 123 ARG H 1.0 . . . 47 47 A 124 ARG N A 124 ARG H 1.0 . . . stop_ save_