data_nef_c19489_2mdk 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 ALA middle . . 3 A 3 LYS middle . . 4 A 4 VAL middle . . 5 A 5 GLU middle . . 6 A 6 GLN middle . . 7 A 7 VAL middle . . 8 A 8 LEU middle . . 9 A 9 SER middle . . 10 A 10 LEU middle . . 11 A 11 GLU middle . . 12 A 12 PRO middle . false 13 A 13 GLN middle . . 14 A 14 HIS middle . . 15 A 15 GLU middle . . 16 A 16 LEU middle . . 17 A 17 LYS middle . . 18 A 18 PHE middle . . 19 A 19 ARG middle . . 20 A 20 GLY middle . false 21 A 21 PRO middle . false 22 A 22 PHE middle . . 23 A 23 THR middle . . 24 A 24 ASP middle . . 25 A 25 VAL middle . . 26 A 26 VAL middle . . 27 A 27 THR middle . . 28 A 28 THR middle . . 29 A 29 ASN middle . . 30 A 30 LEU middle . . 31 A 31 LYS middle . . 32 A 32 LEU middle . . 33 A 33 GLY middle . false 34 A 34 ASN middle . . 35 A 35 PRO middle . false 36 A 36 THR middle . . 37 A 37 ASP middle . . 38 A 38 ARG middle . . 39 A 39 ASN middle . . 40 A 40 VAL middle . . 41 A 41 CYS middle . . 42 A 42 PHE middle . . 43 A 43 LYS middle . . 44 A 44 VAL middle . . 45 A 45 LYS middle . . 46 A 46 THR middle . . 47 A 47 THR middle . . 48 A 48 ALA middle . . 49 A 49 PRO middle . false 50 A 50 ARG middle . . 51 A 51 ARG middle . . 52 A 52 TYR middle . . 53 A 53 CYS middle . . 54 A 54 VAL middle . . 55 A 55 ARG middle . . 56 A 56 SER middle . . 57 A 57 ASN middle . . 58 A 58 SER middle . . 59 A 59 GLY middle . false 60 A 60 ILE middle . . 61 A 61 ILE middle . . 62 A 62 ASP middle . . 63 A 63 ALA middle . . 64 A 64 GLY middle . false 65 A 65 ALA middle . . 66 A 66 SER middle . . 67 A 67 ILE middle . . 68 A 68 ASN middle . . 69 A 69 VAL middle . . 70 A 70 SER middle . . 71 A 71 VAL middle . . 72 A 72 MET middle . . 73 A 73 LEU middle . . 74 A 74 GLN middle . . 75 A 75 PRO middle . false 76 A 76 PHE middle . . 77 A 77 ASP middle . . 78 A 78 TYR middle . . 79 A 79 ASP middle . . 80 A 80 PRO middle . false 81 A 81 ASN middle . . 82 A 82 GLU middle . . 83 A 83 LYS middle . . 84 A 84 SER middle . . 85 A 85 LYS middle . . 86 A 86 HIS middle . . 87 A 87 LYS middle . . 88 A 88 PHE middle . . 89 A 89 MET middle . . 90 A 90 VAL middle . . 91 A 91 GLN middle . . 92 A 92 SER middle . . 93 A 93 MET middle . . 94 A 94 PHE middle . . 95 A 95 ALA middle . . 96 A 96 PRO middle . false 97 A 97 THR middle . . 98 A 98 ASP middle . . 99 A 99 THR middle . . 100 A 100 SER middle . . 101 A 101 ASP middle . . 102 A 102 MET middle . . 103 A 103 GLU middle . . 104 A 104 ALA middle . . 105 A 105 VAL middle . . 106 A 106 TRP middle . . 107 A 107 LYS middle . . 108 A 108 GLU middle . . 109 A 109 ALA middle . . 110 A 110 LYS middle . . 111 A 111 PRO middle . false 112 A 112 GLU middle . . 113 A 113 ASP middle . . 114 A 114 LEU middle . . 115 A 115 MET middle . . 116 A 116 ASP middle . . 117 A 117 SER middle . . 118 A 118 LYS middle . . 119 A 119 LEU middle . . 120 A 120 ARG middle . . 121 A 121 CYS middle . . 122 A 122 VAL middle . . 123 A 123 PHE middle . . 124 A 124 GLU middle . . 125 A 125 LEU 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 CA C 13 54.500 . A 1 MET CB C 13 32.650 . A 2 ALA H H 1 8.793 . A 2 ALA HA H 1 4.491 . A 2 ALA HB% H 1 1.543 . A 2 ALA CA C 13 52.320 . A 2 ALA CB C 13 18.810 . A 2 ALA N N 15 127.968 . A 3 LYS H H 1 8.623 . A 3 LYS HA H 1 4.395 . A 3 LYS HBx H 1 1.964 . A 3 LYS HDx H 1 1.638 . A 3 LYS HGx H 1 1.554 . A 3 LYS CA C 13 56.913 . A 3 LYS CB C 13 32.120 . A 3 LYS N N 15 120.234 . A 4 VAL H H 1 8.468 . A 4 VAL HA H 1 3.893 . A 4 VAL HB H 1 2.217 . A 4 VAL HGx% H 1 1.046 . A 4 VAL HGy% H 1 1.125 . A 4 VAL CA C 13 64.480 . A 4 VAL CB C 13 31.270 . A 4 VAL N N 15 119.633 . A 5 GLU H H 1 8.314 . A 5 GLU HA H 1 4.425 . A 5 GLU HBy H 1 2.183 . A 5 GLU HBx H 1 2.084 . A 5 GLU HGx H 1 2.454 . A 5 GLU HGy H 1 2.472 . A 5 GLU CA C 13 57.770 . A 5 GLU CB C 13 27.920 . A 5 GLU N N 15 119.289 . A 6 GLN H H 1 8.097 . A 6 GLN HA H 1 4.292 . A 6 GLN HBx H 1 2.486 . A 6 GLN HE2x H 1 6.864 . A 6 GLN HE2y H 1 7.533 . A 6 GLN HGx H 1 2.237 . A 6 GLN CA C 13 57.435 . A 6 GLN CB C 13 28.374 . A 6 GLN N N 15 119.030 . A 6 GLN NE2 N 15 111.276 . A 7 VAL H H 1 7.974 . A 7 VAL HA H 1 3.986 . A 7 VAL HB H 1 2.280 . A 7 VAL HGx% H 1 1.048 . A 7 VAL HGy% H 1 1.111 . A 7 VAL CA C 13 63.619 . A 7 VAL CB C 13 31.678 . A 7 VAL N N 15 118.687 . A 8 LEU H H 1 8.039 . A 8 LEU HA H 1 4.352 . A 8 LEU HBx H 1 1.810 . A 8 LEU HDx% H 1 0.940 . A 8 LEU HDy% H 1 1.000 . A 8 LEU HG H 1 1.692 . A 8 LEU CA C 13 55.480 . A 8 LEU CB C 13 41.400 . A 8 LEU N N 15 120.406 . A 9 SER H H 1 7.974 . A 9 SER HA H 1 4.501 . A 9 SER HBx H 1 4.000 . A 9 SER CA C 13 58.510 . A 9 SER CB C 13 63.210 . A 9 SER N N 15 114.418 . A 10 LEU H H 1 7.946 . A 10 LEU HA H 1 4.444 . A 10 LEU HBx H 1 1.846 . A 10 LEU HDx% H 1 1.029 . A 10 LEU HG H 1 1.694 . A 10 LEU CA C 13 54.650 . A 10 LEU CB C 13 42.170 . A 10 LEU N N 15 122.211 . A 11 GLU H H 1 8.077 . A 11 GLU HA H 1 4.055 . A 11 GLU HBy H 1 1.097 . A 11 GLU HBx H 1 0.962 . A 11 GLU HGx H 1 2.255 . A 11 GLU CA C 13 54.010 . A 11 GLU CB C 13 27.950 . A 11 GLU N N 15 119.398 . A 12 PRO HA H 1 4.485 . A 12 PRO HBx H 1 2.377 . A 12 PRO HDy H 1 3.911 . A 12 PRO HDx H 1 3.802 . A 12 PRO HGy H 1 2.063 . A 12 PRO HGx H 1 1.999 . A 12 PRO CA C 13 63.535 . A 12 PRO CB C 13 31.332 . A 13 GLN H H 1 8.675 . A 13 GLN HA H 1 4.280 . A 13 GLN HBy H 1 2.141 . A 13 GLN HBx H 1 2.051 . A 13 GLN HE2x H 1 6.881 . A 13 GLN HE2y H 1 7.591 . A 13 GLN HGy H 1 2.455 . A 13 GLN HGx H 1 2.375 . A 13 GLN CA C 13 56.209 . A 13 GLN CB C 13 28.230 . A 13 GLN N N 15 118.344 . A 13 GLN NE2 N 15 111.897 . A 14 HIS H H 1 8.284 . A 14 HIS HA H 1 4.785 . A 14 HIS HBy H 1 3.408 . A 14 HIS HBx H 1 3.303 . A 14 HIS CA C 13 54.993 . A 14 HIS CB C 13 28.608 . A 14 HIS N N 15 117.141 . A 15 GLU H H 1 8.344 . A 15 GLU HA H 1 4.421 . A 15 GLU HBy H 1 2.169 . A 15 GLU HBx H 1 2.068 . A 15 GLU HGx H 1 2.455 . A 15 GLU CA C 13 55.900 . A 15 GLU CB C 13 28.797 . A 15 GLU N N 15 119.547 . A 16 LEU H H 1 8.258 . A 16 LEU HA H 1 4.421 . A 16 LEU HBx H 1 1.734 . A 16 LEU HDx% H 1 1.030 . A 16 LEU HDy% H 1 0.971 . A 16 LEU HG H 1 1.596 . A 16 LEU CA C 13 54.720 . A 16 LEU CB C 13 41.845 . A 16 LEU N N 15 122.211 . A 17 LYS H H 1 8.092 . A 17 LYS HA H 1 4.409 . A 17 LYS HBx H 1 1.798 . A 17 LYS HGx H 1 1.379 . A 17 LYS CA C 13 55.570 . A 17 LYS CB C 13 32.525 . A 17 LYS N N 15 121.008 . A 18 PHE H H 1 8.183 . A 18 PHE HA H 1 4.737 . A 18 PHE HBy H 1 3.257 . A 18 PHE HBx H 1 3.138 . A 18 PHE CA C 13 57.265 . A 18 PHE CB C 13 39.388 . A 18 PHE N N 15 119.805 . A 19 ARG H H 1 8.283 . A 19 ARG HA H 1 4.456 . A 19 ARG HBy H 1 1.986 . A 19 ARG HBx H 1 1.870 . A 19 ARG HDx H 1 3.320 . A 19 ARG HGx H 1 1.713 . A 19 ARG CA C 13 55.810 . A 19 ARG CB C 13 30.613 . A 19 ARG N N 15 121.010 . A 20 GLY H H 1 8.204 . A 20 GLY HAy H 1 4.184 . A 20 GLY HAx H 1 4.101 . A 20 GLY CA C 13 44.890 . A 20 GLY N N 15 109.321 . A 21 PRO HA H 1 4.544 . A 21 PRO HBy H 1 2.337 . A 21 PRO HBx H 1 1.981 . A 21 PRO HDx H 1 3.721 . A 21 PRO HGx H 1 1.887 . A 21 PRO CA C 13 63.530 . A 21 PRO CB C 13 31.254 . A 22 PHE H H 1 8.505 . A 22 PHE HA H 1 4.538 . A 22 PHE HBx H 1 3.260 . A 22 PHE CA C 13 58.960 . A 22 PHE CB C 13 38.618 . A 22 PHE N N 15 118.773 . A 23 THR H H 1 8.150 . A 23 THR HA H 1 4.338 . A 23 THR HB H 1 4.054 . A 23 THR HG2% H 1 1.322 . A 23 THR CA C 13 63.953 . A 23 THR CB C 13 68.510 . A 23 THR N N 15 112.672 . A 24 ASP H H 1 8.238 . A 24 ASP HA H 1 4.668 . A 24 ASP HBx H 1 2.892 . A 24 ASP CA C 13 54.893 . A 24 ASP CB C 13 38.880 . A 24 ASP N N 15 121.093 . A 25 VAL H H 1 7.900 . A 25 VAL HA H 1 4.044 . A 25 VAL HB H 1 2.245 . A 25 VAL HGx% H 1 1.010 . A 25 VAL HGy% H 1 1.089 . A 25 VAL CA C 13 63.830 . A 25 VAL CB C 13 31.640 . A 25 VAL N N 15 119.289 . A 26 VAL H H 1 7.903 . A 26 VAL HA H 1 4.016 . A 26 VAL HB H 1 2.219 . A 26 VAL HGx% H 1 0.970 . A 26 VAL HGy% H 1 1.088 . A 26 VAL CA C 13 63.230 . A 26 VAL CB C 13 31.030 . A 26 VAL N N 15 119.547 . A 27 THR H H 1 8.012 . A 27 THR HA H 1 4.409 . A 27 THR HB H 1 4.292 . A 27 THR HG2% H 1 1.304 . A 27 THR CA C 13 63.564 . A 27 THR CB C 13 68.770 . A 27 THR N N 15 115.078 . A 28 THR H H 1 8.191 . A 28 THR HA H 1 4.409 . A 28 THR HB H 1 4.291 . A 28 THR HG2% H 1 1.333 . A 28 THR CA C 13 63.564 . A 28 THR CB C 13 68.770 . A 28 THR N N 15 113.016 . A 29 ASN H H 1 8.335 . A 29 ASN HA H 1 4.421 . A 29 ASN HBx H 1 2.980 . A 29 ASN CA C 13 57.770 . A 29 ASN CB C 13 27.858 . A 29 ASN N N 15 117.740 . A 30 LEU H H 1 8.140 . A 30 LEU HA H 1 4.669 . A 30 LEU HBx H 1 1.691 . A 30 LEU HDx% H 1 1.363 . A 30 LEU HG H 1 1.454 . A 30 LEU CA C 13 54.469 . A 30 LEU CB C 13 38.620 . A 30 LEU N N 15 118.687 . A 31 LYS H H 1 8.011 . A 31 LYS HA H 1 4.411 . A 31 LYS HBy H 1 1.886 . A 31 LYS HBx H 1 1.792 . A 31 LYS HGx H 1 1.693 . A 31 LYS CA C 13 55.655 . A 31 LYS CB C 13 31.670 . A 31 LYS N N 15 119.719 . A 32 LEU H H 1 8.147 . A 32 LEU HA H 1 4.414 . A 32 LEU HBx H 1 1.933 . A 32 LEU HDx% H 1 1.674 . A 32 LEU HG H 1 1.766 . A 32 LEU CA C 13 54.505 . A 32 LEU CB C 13 42.180 . A 32 LEU N N 15 121.093 . A 33 GLY H H 1 8.313 . A 33 GLY HAx H 1 4.013 . A 33 GLY CA C 13 44.550 . A 33 GLY N N 15 107.946 . A 34 ASN H H 1 8.354 . A 34 ASN HA H 1 5.051 . A 34 ASN HBy H 1 2.963 . A 34 ASN HBx H 1 2.807 . A 34 ASN HD2x H 1 7.012 . A 34 ASN HD2y H 1 7.813 . A 34 ASN CA C 13 50.780 . A 34 ASN CB C 13 38.530 . A 34 ASN N N 15 119.031 . A 34 ASN ND2 N 15 113.871 . A 35 PRO HA H 1 4.546 . A 35 PRO HBy H 1 2.386 . A 35 PRO HBx H 1 2.099 . A 35 PRO HDy H 1 3.958 . A 35 PRO HDx H 1 3.862 . A 35 PRO HGx H 1 1.306 . A 35 PRO CA C 13 63.530 . A 35 PRO CB C 13 31.417 . A 36 THR H H 1 8.135 . A 36 THR HA H 1 4.362 . A 36 THR HG2% H 1 1.304 . A 36 THR CA C 13 62.010 . A 36 THR CB C 13 69.040 . A 36 THR N N 15 111.899 . A 37 ASP H H 1 8.170 . A 37 ASP HA H 1 4.738 . A 37 ASP HBy H 1 2.903 . A 37 ASP HBx H 1 2.845 . A 37 ASP CA C 13 53.530 . A 37 ASP CB C 13 39.380 . A 37 ASP N N 15 121.265 . A 38 ARG H H 1 8.190 . A 38 ARG HA H 1 4.350 . A 38 ARG HBx H 1 1.965 . A 38 ARG HDx H 1 1.730 . A 38 ARG HGx H 1 1.869 . A 38 ARG CA C 13 55.994 . A 38 ARG CB C 13 30.060 . A 38 ARG N N 15 120.320 . A 39 ASN H H 1 8.417 . A 39 ASN HA H 1 4.785 . A 39 ASN HBy H 1 2.922 . A 39 ASN HBx H 1 2.864 . A 39 ASN CA C 13 53.114 . A 39 ASN CB C 13 38.370 . A 39 ASN N N 15 118.859 . A 40 VAL H H 1 8.037 . A 40 VAL HA H 1 4.177 . A 40 VAL HB H 1 2.183 . A 40 VAL HGy% H 1 1.009 . A 40 VAL CA C 13 62.433 . A 40 VAL CB C 13 32.100 . A 40 VAL N N 15 119.416 . A 41 CYS H H 1 8.275 . A 41 CYS HA H 1 4.500 . A 41 CYS HBx H 1 2.945 . A 41 CYS CA C 13 58.621 . A 41 CYS CB C 13 27.181 . A 41 CYS N N 15 121.046 . A 42 PHE H H 1 8.255 . A 42 PHE HA H 1 4.716 . A 42 PHE HBy H 1 3.257 . A 42 PHE HBx H 1 3.127 . A 42 PHE CA C 13 57.689 . A 42 PHE CB C 13 39.134 . A 42 PHE N N 15 121.523 . A 43 LYS H H 1 8.177 . A 43 LYS HA H 1 4.424 . A 43 LYS HBy H 1 1.850 . A 43 LYS HBx H 1 1.754 . A 43 LYS HDx H 1 1.780 . A 43 LYS HGx H 1 1.479 . A 43 LYS CA C 13 55.994 . A 43 LYS CB C 13 32.779 . A 43 LYS N N 15 121.953 . A 44 VAL H H 1 8.118 . A 44 VAL HA H 1 4.177 . A 44 VAL HB H 1 2.175 . A 44 VAL HGy% H 1 1.046 . A 44 VAL CA C 13 62.264 . A 44 VAL CB C 13 32.186 . A 44 VAL N N 15 120.578 . A 45 LYS H H 1 8.404 . A 45 LYS HA H 1 4.476 . A 45 LYS HBy H 1 1.957 . A 45 LYS HBx H 1 1.872 . A 45 LYS HDx H 1 1.501 . A 45 LYS HGx H 1 1.575 . A 45 LYS CA C 13 56.164 . A 45 LYS CB C 13 32.520 . A 45 LYS N N 15 124.187 . A 46 THR H H 1 8.135 . A 46 THR HA H 1 4.491 . A 46 THR HB H 1 4.300 . A 46 THR HG2% H 1 1.265 . A 46 THR CA C 13 61.247 . A 46 THR CB C 13 69.381 . A 46 THR N N 15 114.649 . A 47 THR H H 1 8.110 . A 47 THR HA H 1 4.436 . A 47 THR HB H 1 4.300 . A 47 THR HG2% H 1 1.292 . A 47 THR CA C 13 61.240 . A 47 THR CB C 13 69.384 . A 47 THR N N 15 116.109 . A 48 ALA H H 1 8.303 . A 48 ALA HA H 1 4.668 . A 48 ALA HB% H 1 1.469 . A 48 ALA CA C 13 50.400 . A 48 ALA CB C 13 17.610 . A 48 ALA N N 15 127.109 . A 49 PRO HDy H 1 3.884 . A 49 PRO HDx H 1 3.718 . A 52 TYR HA H 1 4.678 . A 52 TYR HBy H 1 3.138 . A 52 TYR HBx H 1 2.982 . A 52 TYR CA C 13 58.343 . A 52 TYR CB C 13 38.710 . A 53 CYS H H 1 8.229 . A 53 CYS HA H 1 4.641 . A 53 CYS HBx H 1 2.990 . A 53 CYS CA C 13 57.858 . A 53 CYS CB C 13 27.696 . A 53 CYS N N 15 119.633 . A 54 VAL H H 1 8.225 . A 54 VAL HA H 1 4.231 . A 54 VAL HB H 1 2.208 . A 54 VAL HGy% H 1 1.033 . A 54 VAL CA C 13 62.179 . A 54 VAL CB C 13 32.186 . A 54 VAL N N 15 121.265 . A 55 ARG H H 1 8.430 . A 55 ARG HA H 1 4.491 . A 55 ARG HBy H 1 1.985 . A 55 ARG HBx H 1 1.886 . A 55 ARG HE H 1 2.201 . A 55 ARG HGx H 1 1.733 . A 55 ARG CA C 13 55.486 . A 55 ARG CB C 13 30.492 . A 55 ARG N N 15 123.330 . A 56 SER H H 1 8.357 . A 56 SER HA H 1 4.518 . A 56 SER HBy H 1 3.999 . A 56 SER HBx H 1 3.919 . A 56 SER CA C 13 57.943 . A 56 SER CB C 13 63.619 . A 56 SER N N 15 116.367 . A 57 ASN H H 1 8.547 . A 57 ASN HA H 1 4.846 . A 57 ASN HBy H 1 2.963 . A 57 ASN HBx H 1 2.904 . A 57 ASN HD2x H 1 6.950 . A 57 ASN HD2y H 1 7.659 . A 57 ASN CA C 13 52.760 . A 57 ASN CB C 13 38.534 . A 57 ASN N N 15 120.578 . A 57 ASN ND2 N 15 112.543 . A 58 SER H H 1 8.326 . A 58 SER HA H 1 4.505 . A 58 SER HBy H 1 4.001 . A 58 SER HBx H 1 3.978 . A 58 SER CA C 13 58.620 . A 58 SER CB C 13 63.365 . A 58 SER N N 15 115.508 . A 59 GLY H H 1 8.469 . A 59 GLY HAx H 1 4.095 . A 59 GLY CA C 13 45.230 . A 59 GLY N N 15 110.610 . A 60 ILE H H 1 8.198 . A 60 ILE HA H 1 4.186 . A 60 ILE HB H 1 1.962 . A 60 ILE HD1% H 1 0.992 . A 60 ILE HG1y H 1 1.607 . A 60 ILE HG1x H 1 1.279 . A 60 ILE CA C 13 62.010 . A 60 ILE CB C 13 38.200 . A 60 ILE N N 15 120.062 . A 61 ILE H H 1 8.046 . A 61 ILE HA H 1 4.177 . A 61 ILE HB H 1 1.990 . A 61 ILE HG1y H 1 1.607 . A 61 ILE HG1x H 1 1.292 . A 61 ILE HG2% H 1 0.978 . A 61 ILE CA C 13 61.162 . A 61 ILE CB C 13 38.117 . A 61 ILE N N 15 120.836 . A 62 ASP H H 1 8.351 . A 62 ASP HA H 1 4.709 . A 62 ASP HBy H 1 2.919 . A 62 ASP HBx H 1 2.810 . A 62 ASP CA C 13 61.247 . A 62 ASP CB C 13 39.049 . A 62 ASP N N 15 121.867 . A 63 ALA H H 1 8.255 . A 63 ALA HA H 1 4.341 . A 63 ALA HB% H 1 1.511 . A 63 ALA CA C 13 52.944 . A 63 ALA CB C 13 18.460 . A 63 ALA N N 15 123.757 . A 64 GLY H H 1 8.445 . A 64 GLY HAx H 1 3.972 . A 64 GLY CA C 13 45.400 . A 64 GLY N N 15 128.656 . A 65 ALA H H 1 8.028 . A 65 ALA HA H 1 4.436 . A 65 ALA HB% H 1 1.525 . A 65 ALA CA C 13 52.350 . A 65 ALA CB C 13 18.880 . A 65 ALA N N 15 122.297 . A 66 SER H H 1 8.182 . A 66 SER HA H 1 4.573 . A 66 SER HBx H 1 3.972 . A 66 SER CA C 13 58.234 . A 66 SER CB C 13 63.590 . A 66 SER N N 15 113.618 . A 67 ILE H H 1 7.965 . A 67 ILE HA H 1 4.272 . A 67 ILE HB H 1 1.976 . A 67 ILE HD1% H 1 0.964 . A 67 ILE HG1y H 1 1.621 . A 67 ILE HG1x H 1 1.279 . A 67 ILE CA C 13 60.560 . A 67 ILE CB C 13 38.370 . A 67 ILE N N 15 120.836 . A 68 ASN H H 1 8.361 . A 68 ASN HA H 1 4.942 . A 68 ASN HBy H 1 3.056 . A 68 ASN HBx H 1 2.864 . A 68 ASN HD2x H 1 6.955 . A 68 ASN HD2y H 1 7.703 . A 68 ASN CA C 13 52.260 . A 68 ASN CB C 13 38.200 . A 68 ASN N N 15 122.812 . A 68 ASN ND2 N 15 112.336 . A 69 VAL H H 1 8.522 . A 69 VAL HA H 1 4.013 . A 69 VAL HB H 1 2.249 . A 69 VAL HGy% H 1 1.087 . A 69 VAL CA C 13 63.780 . A 69 VAL CB C 13 31.586 . A 69 VAL N N 15 120.922 . A 70 SER H H 1 8.426 . A 70 SER HA H 1 4.300 . A 70 SER HBx H 1 4.026 . A 70 SER N N 15 116.281 . A 71 VAL H H 1 7.721 . A 71 VAL HA H 1 4.091 . A 71 VAL HB H 1 2.223 . A 71 VAL HGy% H 1 1.078 . A 71 VAL N N 15 119.763 . A 74 GLN H H 1 8.172 . A 74 GLN HA H 1 4.723 . A 74 GLN N N 15 121.437 . A 75 PRO HA H 1 4.395 . A 75 PRO HBx H 1 2.212 . A 75 PRO HGx H 1 3.612 . A 75 PRO CA C 13 63.530 . A 75 PRO CB C 13 31.593 . A 76 PHE H H 1 7.845 . A 76 PHE HA H 1 4.655 . A 76 PHE HBy H 1 3.316 . A 76 PHE HBx H 1 3.069 . A 76 PHE CA C 13 57.000 . A 76 PHE CB C 13 38.788 . A 76 PHE N N 15 115.508 . A 77 ASP H H 1 8.127 . A 77 ASP HA H 1 4.746 . A 77 ASP HBy H 1 2.941 . A 77 ASP HBx H 1 2.785 . A 77 ASP CA C 13 52.690 . A 77 ASP CB C 13 38.449 . A 77 ASP N N 15 118.687 . A 78 TYR H H 1 7.882 . A 78 TYR HA H 1 4.600 . A 78 TYR HBx H 1 3.028 . A 78 TYR CA C 13 57.260 . A 78 TYR CB C 13 38.710 . A 78 TYR N N 15 120.320 . A 79 ASP H H 1 8.211 . A 79 ASP HA H 1 4.956 . A 79 ASP HBy H 1 2.905 . A 79 ASP HBx H 1 2.646 . A 79 ASP CA C 13 50.390 . A 79 ASP CB C 13 40.250 . A 79 ASP N N 15 122.898 . A 80 PRO HA H 1 4.397 . A 80 PRO HBy H 1 2.468 . A 80 PRO HBx H 1 2.386 . A 80 PRO HDy H 1 3.876 . A 80 PRO HDx H 1 3.671 . A 80 PRO HGx H 1 2.058 . A 80 PRO CA C 13 63.443 . A 80 PRO CB C 13 31.500 . A 81 ASN H H 1 8.413 . A 81 ASN HA H 1 4.751 . A 81 ASN HBy H 1 2.933 . A 81 ASN HBx H 1 2.864 . A 81 ASN HD2x H 1 7.011 . A 81 ASN HD2y H 1 7.810 . A 81 ASN CA C 13 53.198 . A 81 ASN CB C 13 38.280 . A 81 ASN N N 15 116.711 . A 81 ASN ND2 N 15 113.870 . A 82 GLU H H 1 7.957 . A 82 GLU HA H 1 4.313 . A 82 GLU HBx H 1 2.468 . A 82 GLU HGy H 1 2.202 . A 82 GLU HGx H 1 2.104 . A 82 GLU CA C 13 56.326 . A 82 GLU CB C 13 28.450 . A 82 GLU N N 15 120.234 . A 83 LYS H H 1 8.251 . A 83 LYS HA H 1 4.371 . A 83 LYS HBy H 1 1.862 . A 83 LYS HBx H 1 1.788 . A 83 LYS HGx H 1 1.701 . A 83 LYS CA C 13 56.450 . A 83 LYS CB C 13 32.010 . A 83 LYS N N 15 120.836 . A 84 SER H H 1 8.143 . A 84 SER HA H 1 4.477 . A 84 SER HBx H 1 3.958 . A 84 SER CA C 13 58.256 . A 84 SER CB C 13 63.230 . A 84 SER N N 15 115.078 . A 85 LYS H H 1 8.155 . A 85 LYS HA H 1 4.341 . A 85 LYS HBy H 1 1.853 . A 85 LYS HBx H 1 1.785 . A 85 LYS HGy H 1 1.511 . A 85 LYS HGx H 1 1.429 . A 85 LYS CA C 13 56.164 . A 85 LYS CB C 13 32.270 . A 85 LYS N N 15 122.125 . A 86 HIS H H 1 8.341 . A 86 HIS HA H 1 4.737 . A 86 HIS HBy H 1 3.257 . A 86 HIS HBx H 1 3.196 . A 86 HIS CA C 13 54.970 . A 86 HIS CB C 13 28.530 . A 86 HIS N N 15 118.172 . A 87 LYS H H 1 8.334 . A 87 LYS HA H 1 4.338 . A 87 LYS HBx H 1 1.812 . A 87 LYS CA C 13 56.503 . A 87 LYS CB C 13 32.690 . A 87 LYS N N 15 122.125 . A 88 PHE H H 1 8.411 . A 88 PHE HA H 1 4.696 . A 88 PHE HBy H 1 3.236 . A 88 PHE HBx H 1 3.177 . A 88 PHE CA C 13 57.682 . A 88 PHE CB C 13 39.040 . A 88 PHE N N 15 120.578 . A 89 MET H H 1 8.343 . A 89 MET HA H 1 4.527 . A 89 MET HBx H 1 2.140 . A 89 MET HGy H 1 2.640 . A 89 MET HGx H 1 2.564 . A 89 MET CA C 13 55.394 . A 89 MET CB C 13 32.600 . A 89 MET N N 15 121.867 . A 90 VAL H H 1 8.245 . A 90 VAL HA H 1 4.026 . A 90 VAL HB H 1 2.236 . A 90 VAL HGy% H 1 1.087 . A 90 VAL CA C 13 63.535 . A 90 VAL CB C 13 31.840 . A 90 VAL N N 15 120.148 . A 91 GLN H H 1 8.598 . A 91 GLN HA H 1 4.272 . A 91 GLN HBy H 1 2.240 . A 91 GLN HBx H 1 2.181 . A 91 GLN HE2x H 1 6.905 . A 91 GLN HE2y H 1 7.636 . A 91 GLN HGx H 1 2.492 . A 91 GLN CA C 13 57.000 . A 91 GLN CB C 13 28.450 . A 91 GLN N N 15 120.234 . A 91 GLN NE2 N 15 111.559 . A 92 SER H H 1 8.051 . A 92 SER HA H 1 4.465 . A 92 SER HBy H 1 3.997 . A 92 SER HBx H 1 3.939 . A 92 SER CA C 13 58.960 . A 92 SER CB C 13 63.196 . A 92 SER N N 15 114.305 . A 93 MET H H 1 8.031 . A 93 MET HA H 1 4.341 . A 93 MET HBy H 1 1.976 . A 93 MET HBx H 1 1.880 . A 93 MET HGx H 1 2.441 . A 93 MET CA C 13 56.157 . A 93 MET CB C 13 32.680 . A 93 MET N N 15 120.148 . A 94 PHE H H 1 7.758 . A 94 PHE HA H 1 4.778 . A 94 PHE HBy H 1 3.316 . A 94 PHE HBx H 1 2.998 . A 94 PHE HEx H 1 7.374 . A 94 PHE CA C 13 56.418 . A 94 PHE CB C 13 39.550 . A 94 PHE N N 15 116.281 . A 95 ALA H H 1 8.110 . A 95 ALA HA H 1 4.715 . A 95 ALA HB% H 1 1.493 . A 95 ALA CA C 13 50.063 . A 95 ALA CB C 13 18.030 . A 95 ALA N N 15 124.703 . A 96 PRO HA H 1 4.600 . A 96 PRO HBy H 1 2.416 . A 96 PRO HBx H 1 2.178 . A 96 PRO HDx H 1 3.782 . A 96 PRO HDy H 1 3.837 . A 96 PRO HGx H 1 2.102 . A 96 PRO CA C 13 63.443 . A 96 PRO CB C 13 31.330 . A 97 THR H H 1 8.033 . A 97 THR HA H 1 4.385 . A 97 THR HG2% H 1 1.328 . A 97 THR CA C 13 62.010 . A 97 THR CB C 13 68.957 . A 97 THR N N 15 111.126 . A 98 ASP H H 1 8.306 . A 98 ASP HA H 1 4.821 . A 98 ASP HBx H 1 2.980 . A 98 ASP CA C 13 53.790 . A 98 ASP CB C 13 38.710 . A 98 ASP N N 15 120.836 . A 99 THR H H 1 8.224 . A 99 THR HA H 1 4.259 . A 99 THR HG2% H 1 1.316 . A 99 THR CA C 13 63.450 . A 99 THR CB C 13 68.450 . A 99 THR N N 15 113.703 . A 100 SER H H 1 8.345 . A 100 SER HA H 1 4.444 . A 100 SER HBy H 1 4.075 . A 100 SER HBx H 1 4.032 . A 100 SER CA C 13 59.960 . A 100 SER CB C 13 62.680 . A 100 SER N N 15 117.828 . A 101 ASP H H 1 8.395 . A 101 ASP HA H 1 4.715 . A 101 ASP HBy H 1 3.001 . A 101 ASP HBx H 1 2.878 . A 101 ASP CA C 13 54.880 . A 101 ASP CB C 13 38.195 . A 101 ASP N N 15 121.609 . A 102 MET H H 1 8.248 . A 102 MET HA H 1 4.313 . A 102 MET HBx H 1 2.245 . A 102 MET HE% H 1 2.140 . A 102 MET HGy H 1 2.739 . A 102 MET HGx H 1 2.610 . A 102 MET CA C 13 57.680 . A 102 MET CB C 13 32.020 . A 102 MET N N 15 118.859 . A 103 GLU H H 1 8.282 . A 103 GLU HA H 1 4.150 . A 103 GLU HBx H 1 2.261 . A 103 GLU CA C 13 58.359 . A 103 GLU CB C 13 27.519 . A 103 GLU N N 15 118.086 . A 104 ALA H H 1 7.903 . A 104 ALA HA H 1 4.231 . A 104 ALA HB% H 1 1.593 . A 104 ALA CA C 13 54.215 . A 104 ALA CB C 13 17.868 . A 104 ALA N N 15 121.093 . A 105 VAL H H 1 7.760 . A 105 VAL HA H 1 3.880 . A 105 VAL HB H 1 2.292 . A 105 VAL HGx% H 1 0.990 . A 105 VAL HGy% H 1 1.146 . A 105 VAL CA C 13 64.970 . A 105 VAL CB C 13 31.085 . A 105 VAL N N 15 116.969 . A 106 TRP H H 1 7.970 . A 106 TRP HA H 1 4.546 . A 106 TRP HBy H 1 3.507 . A 106 TRP HBx H 1 3.384 . A 106 TRP CA C 13 58.960 . A 106 TRP CB C 13 29.306 . A 106 TRP N N 15 119.633 . A 107 LYS H H 1 7.954 . A 107 LYS HA H 1 4.044 . A 107 LYS HBx H 1 1.988 . A 107 LYS HDx H 1 1.555 . A 107 LYS HGx H 1 1.674 . A 107 LYS CA C 13 58.020 . A 107 LYS CB C 13 32.179 . A 107 LYS N N 15 115.938 . A 108 GLU H H 1 7.739 . A 108 GLU HA H 1 4.397 . A 108 GLU HBy H 1 2.257 . A 108 GLU HBx H 1 2.181 . A 108 GLU HGx H 1 2.591 . A 108 GLU CA C 13 55.570 . A 108 GLU CB C 13 28.459 . A 108 GLU N N 15 116.195 . A 109 ALA H H 1 7.820 . A 109 ALA HA H 1 4.300 . A 109 ALA HB% H 1 1.402 . A 109 ALA CA C 13 52.259 . A 109 ALA CB C 13 18.751 . A 109 ALA N N 15 122.554 . A 110 LYS H H 1 7.953 . A 110 LYS HA H 1 4.559 . A 110 LYS HBx H 1 1.839 . A 110 LYS HDx H 1 1.716 . A 110 LYS HGx H 1 1.470 . A 110 LYS CA C 13 53.876 . A 110 LYS CB C 13 31.678 . A 110 LYS N N 15 118.430 . A 111 PRO HA H 1 4.292 . A 111 PRO HBy H 1 2.507 . A 111 PRO HBx H 1 2.258 . A 111 PRO HDy H 1 3.835 . A 111 PRO HDx H 1 3.746 . A 111 PRO CA C 13 64.121 . A 111 PRO CB C 13 31.332 . A 112 GLU H H 1 8.883 . A 112 GLU HA H 1 4.177 . A 112 GLU HBx H 1 2.004 . A 112 GLU HGy H 1 2.157 . A 112 GLU HGx H 1 2.113 . A 112 GLU CA C 13 57.597 . A 112 GLU CB C 13 27.950 . A 112 GLU N N 15 117.313 . A 113 ASP H H 1 8.136 . A 113 ASP HA H 1 4.668 . A 113 ASP HBx H 1 2.951 . A 113 ASP CA C 13 53.950 . A 113 ASP CB C 13 38.957 . A 113 ASP N N 15 118.516 . A 114 LEU H H 1 8.006 . A 114 LEU HA H 1 4.288 . A 114 LEU HBy H 1 1.867 . A 114 LEU HBx H 1 1.792 . A 114 LEU HDy% H 1 0.971 . A 114 LEU HG H 1 1.687 . A 114 LEU CA C 13 56.079 . A 114 LEU CB C 13 41.591 . A 114 LEU N N 15 119.719 . A 115 MET H H 1 8.063 . A 115 MET HA H 1 4.385 . A 115 MET HBx H 1 2.195 . A 115 MET HGy H 1 2.728 . A 115 MET HGx H 1 2.591 . A 115 MET CA C 13 56.410 . A 115 MET CB C 13 31.848 . A 115 MET N N 15 116.625 . A 116 ASP H H 1 8.063 . A 116 ASP HA H 1 4.762 . A 116 ASP HBx H 1 2.974 . A 116 ASP CA C 13 58.450 . A 116 ASP CB C 13 38.880 . A 116 ASP N N 15 118.258 . A 117 SER H H 1 8.225 . A 117 SER HA H 1 4.218 . A 117 SER HBx H 1 4.095 . A 117 SER CA C 13 63.110 . A 117 SER CB C 13 68.788 . A 117 SER N N 15 112.500 . A 118 LYS H H 1 8.738 . A 118 LYS HA H 1 4.350 . A 118 LYS HBy H 1 2.044 . A 118 LYS HBx H 1 1.946 . A 118 LYS HDx H 1 1.716 . A 118 LYS HGx H 1 1.830 . A 118 LYS CA C 13 58.197 . A 118 LYS CB C 13 31.840 . A 118 LYS N N 15 122.382 . A 119 LEU H H 1 8.223 . A 119 LEU HA H 1 4.186 . A 119 LEU HBy H 1 1.901 . A 119 LEU HBx H 1 1.848 . A 119 LEU HDx% H 1 1.045 . A 119 LEU HDy% H 1 0.971 . A 119 LEU HG H 1 1.670 . A 119 LEU CA C 13 56.834 . A 119 LEU CB C 13 41.070 . A 119 LEU N N 15 117.828 . A 120 ARG H H 1 8.099 . A 120 ARG HA H 1 4.091 . A 120 ARG CA C 13 59.546 . A 120 ARG CB C 13 29.120 . A 120 ARG N N 15 119.031 . A 121 CYS H H 1 7.970 . A 121 CYS HA H 1 4.395 . A 121 CYS HBx H 1 3.206 . A 121 CYS CA C 13 61.417 . A 121 CYS CB C 13 26.250 . A 121 CYS N N 15 116.539 . A 122 VAL H H 1 7.809 . A 122 VAL HA H 1 3.762 . A 122 VAL HB H 1 2.318 . A 122 VAL HGx% H 1 0.989 . A 122 VAL HGy% H 1 1.147 . A 122 VAL CA C 13 65.900 . A 122 VAL CB C 13 30.910 . A 122 VAL N N 15 119.891 . A 123 PHE H H 1 8.104 . A 123 PHE HA H 1 4.293 . A 123 PHE HBy H 1 3.369 . A 123 PHE HBx H 1 3.240 . A 123 PHE CA C 13 60.993 . A 123 PHE CB C 13 38.202 . A 123 PHE N N 15 119.203 . A 124 GLU H H 1 8.394 . A 124 GLU HA H 1 4.054 . A 124 GLU HBx H 1 2.304 . A 124 GLU HGx H 1 2.195 . A 124 GLU CA C 13 58.620 . A 124 GLU CB C 13 27.950 . A 124 GLU N N 15 117.570 . A 125 LEU H H 1 7.872 . A 125 LEU HA H 1 4.233 . A 125 LEU HBx H 1 2.072 . A 125 LEU HDx% H 1 1.046 . A 125 LEU HDy% H 1 0.971 . A 125 LEU HG H 1 1.798 . A 125 LEU CA C 13 57.604 . A 125 LEU CB C 13 41.500 . A 125 LEU N N 15 120.062 . stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 3 LYS H A 2 ALA HA 1.0 2.0 3.6 2 2 A 4 VAL H A 3 LYS HA 1.0 2.0 3.6 3 3 A 4 VAL H A 3 LYS HBx 1.0 2.4 4.4 4 4 A 4 VAL H A 3 LYS HGx 1.0 2.6 5.8 5 5 A 3 LYS H A 4 VAL H 1.0 2.4 4.4 6 6 A 5 GLU H A 4 VAL HGx% 1.0 2.6 5.8 7 7 A 5 GLU H A 4 VAL HGy% 1.0 2.6 5.8 8 8 A 4 VAL H A 5 GLU H 1.0 2.4 4.4 9 9 A 5 GLU H A 4 VAL HA 1.0 2.6 5.8 10 10 A 3 LYS HA A 5 GLU H 1.0 2.6 5.8 11 11 A 6 GLN H A 5 GLU HGx 1.0 2.6 5.8 12 11 A 6 GLN H A 5 GLU HGy 1.0 2.6 5.8 13 12 A 6 GLN H A 5 GLU HA 1.0 2.0 3.6 14 13 A 3 LYS HA A 6 GLN H 1.0 2.4 4.4 15 14 A 6 GLN H A 7 VAL H 1.0 2.0 3.6 16 15 A 9 SER H A 8 LEU HA 1.0 2.4 4.4 17 16 A 9 SER H A 7 VAL HA 1.0 2.6 5.8 18 17 A 9 SER H A 8 LEU HBx 1.0 2.6 5.8 19 18 A 9 SER H A 8 LEU HDx% 1.0 2.6 5.8 20 19 A 9 SER H A 8 LEU HG 1.0 2.6 5.8 21 20 A 10 LEU H A 8 LEU HDy% 1.0 2.6 5.8 22 21 A 10 LEU H A 9 SER HA 1.0 2.4 4.4 23 22 A 10 LEU H A 9 SER HBx 1.0 2.6 5.8 24 23 A 11 GLU H A 10 LEU HA 1.0 2.4 4.4 25 24 A 13 GLN H A 12 PRO HA 1.0 2.0 3.6 26 25 A 13 GLN H A 12 PRO HBx 1.0 2.4 4.4 27 26 A 13 GLN H A 12 PRO HDx 1.0 2.6 5.8 28 26 A 13 GLN H A 12 PRO HDy 1.0 2.6 5.8 29 27 A 13 GLN H A 12 PRO HDy 1.0 2.6 5.8 30 28 A 13 GLN H A 12 PRO HGy 1.0 2.6 5.8 31 28 A 13 GLN H A 12 PRO HGx 1.0 2.6 5.8 32 29 A 12 PRO HA A 14 HIS H 1.0 2.6 5.8 33 30 A 14 HIS H A 13 GLN HA 1.0 2.0 3.6 34 31 A 14 HIS H A 13 GLN HBy 1.0 2.6 5.8 35 32 A 14 HIS H A 13 GLN HGx 1.0 2.6 5.8 36 32 A 14 HIS H A 13 GLN HGy 1.0 2.6 5.8 37 33 A 14 HIS H A 13 GLN HGy 1.0 2.6 5.8 38 34 A 13 GLN H A 14 HIS H 1.0 2.4 4.4 39 35 A 15 GLU H A 14 HIS HA 1.0 2.0 3.6 40 36 A 15 GLU H A 14 HIS HBy 1.0 2.4 4.4 41 37 A 14 HIS HA A 16 LEU H 1.0 2.6 5.8 42 38 A 16 LEU H A 15 GLU HA 1.0 2.0 3.6 43 39 A 16 LEU H A 15 GLU HBy 1.0 2.6 5.8 44 40 A 16 LEU H A 15 GLU HGx 1.0 2.6 5.8 45 41 A 17 LYS H A 16 LEU HDx% 1.0 2.6 5.8 46 42 A 17 LYS H A 16 LEU HDy% 1.0 2.6 5.8 47 43 A 17 LYS H A 16 LEU HG 1.0 2.6 5.8 48 44 A 16 LEU H A 17 LYS H 1.0 2.0 3.6 49 45 A 15 GLU HA A 17 LYS H 1.0 2.6 5.8 50 46 A 18 PHE H A 16 LEU HBx 1.0 2.6 5.8 51 47 A 18 PHE H A 16 LEU HA 1.0 2.6 5.8 52 48 A 18 PHE H A 17 LYS HA 1.0 2.0 3.6 53 49 A 18 PHE H A 17 LYS HBx 1.0 2.4 4.4 54 50 A 18 PHE H A 17 LYS HGx 1.0 2.6 5.8 55 51 A 19 ARG H A 18 PHE HA 1.0 2.6 5.8 56 52 A 22 PHE H A 21 PRO HA 1.0 2.0 3.6 57 53 A 22 PHE H A 21 PRO HBy 1.0 2.6 5.8 58 54 A 22 PHE H A 21 PRO HDx 1.0 2.6 5.8 59 55 A 22 PHE H A 21 PRO HGx 1.0 2.6 5.8 60 56 A 23 THR H A 22 PHE HA 1.0 2.0 3.6 61 57 A 23 THR H A 22 PHE HBx 1.0 2.4 4.4 62 58 A 22 PHE H A 23 THR H 1.0 2.0 3.6 63 59 A 24 ASP H A 23 THR HA 1.0 2.4 4.4 64 60 A 24 ASP H A 23 THR HB 1.0 2.4 4.4 65 61 A 24 ASP H A 23 THR HG2% 1.0 2.6 5.8 66 62 A 23 THR H A 24 ASP H 1.0 2.6 5.8 67 63 A 25 VAL H A 20 GLY HAx 1.0 1.8 5.0 68 64 A 22 PHE HA A 25 VAL H 1.0 2.6 5.8 69 65 A 23 THR HA A 25 VAL H 1.0 2.6 5.8 70 66 A 23 THR HG2% A 25 VAL H 1.0 2.6 5.8 71 67 A 25 VAL H A 24 ASP HA 1.0 2.4 4.4 72 68 A 25 VAL H A 24 ASP HBx 1.0 2.4 4.4 73 69 A 24 ASP H A 25 VAL H 1.0 2.0 3.6 74 70 A 22 PHE HA A 26 VAL H 1.0 2.6 5.8 75 71 A 23 THR HA A 26 VAL H 1.0 2.6 5.8 76 72 A 24 ASP HBx A 26 VAL H 1.0 2.6 5.8 77 73 A 26 VAL H A 25 VAL HGy% 1.0 2.6 5.8 78 74 A 24 ASP HA A 27 THR H 1.0 2.6 5.8 79 75 A 27 THR H A 25 VAL HA 1.0 2.6 5.8 80 76 A 27 THR H A 26 VAL HA 1.0 2.6 5.8 81 77 A 27 THR H A 26 VAL HGx% 1.0 2.6 5.8 82 78 A 24 ASP HA A 28 THR H 1.0 2.6 5.8 83 79 A 25 VAL H A 28 THR H 1.0 2.6 5.8 84 80 A 26 VAL HA A 28 THR H 1.0 2.4 4.4 85 81 A 28 THR H A 26 VAL HB 1.0 2.6 5.8 86 82 A 26 VAL HGx% A 28 THR H 1.0 2.6 5.8 87 83 A 27 THR H A 28 THR H 1.0 2.0 3.6 88 84 A 26 VAL HB A 29 ASN H 1.0 2.6 5.8 89 85 A 31 LYS H A 30 LEU HDx% 1.0 2.6 5.8 90 86 A 31 LYS H A 32 LEU H 1.0 2.0 3.6 91 87 A 30 LEU HDx% A 33 GLY H 1.0 2.6 5.8 92 88 A 33 GLY H A 32 LEU HA 1.0 2.0 3.6 93 89 A 33 GLY H A 32 LEU HDx% 1.0 2.6 5.8 94 90 A 33 GLY H A 32 LEU HG 1.0 2.6 5.8 95 91 A 32 LEU H A 33 GLY H 1.0 2.6 5.8 96 92 A 34 ASN H A 33 GLY HAx 1.0 2.0 3.6 97 93 A 36 THR H A 34 ASN HA 1.0 2.6 5.8 98 94 A 36 THR H A 34 ASN HBy 1.0 2.6 5.8 99 95 A 36 THR H A 35 PRO HA 1.0 2.0 3.6 100 96 A 36 THR H A 35 PRO HBy 1.0 2.4 4.4 101 97 A 36 THR H A 35 PRO HDx 1.0 2.6 5.8 102 97 A 36 THR H A 35 PRO HDy 1.0 2.6 5.8 103 98 A 36 THR H A 35 PRO HDy 1.0 2.6 5.8 104 99 A 37 ASP H A 36 THR HA 1.0 2.0 3.6 105 100 A 38 ARG H A 36 THR HG2% 1.0 2.6 5.8 106 101 A 38 ARG H A 37 ASP HA 1.0 2.0 3.6 107 102 A 39 ASN H A 38 ARG HA 1.0 2.0 3.6 108 103 A 39 ASN H A 38 ARG HBx 1.0 2.4 4.4 109 104 A 39 ASN H A 38 ARG HDx 1.0 2.6 5.8 110 105 A 39 ASN H A 38 ARG HGx 1.0 2.6 5.8 111 106 A 38 ARG H A 39 ASN H 1.0 2.6 5.8 112 107 A 40 VAL H A 39 ASN HA 1.0 2.0 3.6 113 108 A 40 VAL H A 39 ASN HBy 1.0 2.6 5.8 114 109 A 39 ASN H A 40 VAL H 1.0 2.4 4.4 115 110 A 42 PHE H A 41 CYS HA 1.0 2.0 3.6 116 111 A 42 PHE H A 41 CYS HBx 1.0 2.4 4.4 117 112 A 43 LYS H A 42 PHE HA 1.0 2.4 4.4 118 113 A 43 LYS H A 42 PHE HBy 1.0 2.6 5.8 119 114 A 42 PHE H A 44 VAL HGy% 1.0 2.6 5.8 120 115 A 43 LYS H A 44 VAL HGy% 1.0 2.6 5.8 121 116 A 44 VAL H A 43 LYS HA 1.0 2.0 3.6 122 117 A 44 VAL H A 43 LYS HBy 1.0 2.6 5.8 123 118 A 43 LYS HBy A 45 LYS H 1.0 2.4 4.4 124 119 A 45 LYS H A 44 VAL HA 1.0 2.0 3.6 125 120 A 45 LYS H A 44 VAL HB 1.0 2.6 5.8 126 121 A 44 VAL HGy% A 45 LYS H 1.0 2.6 5.8 127 122 A 44 VAL H A 45 LYS H 1.0 2.6 5.8 128 123 A 44 VAL HGy% A 46 THR H 1.0 2.6 5.8 129 124 A 46 THR H A 45 LYS HBy 1.0 2.6 5.8 130 125 A 45 LYS H A 46 THR H 1.0 2.6 5.8 131 126 A 47 THR H A 46 THR HA 1.0 2.0 3.6 132 127 A 47 THR H A 48 ALA HA 1.0 2.6 5.8 133 128 A 48 ALA H A 47 THR HA 1.0 2.0 3.6 134 129 A 48 ALA H A 47 THR HB 1.0 2.4 4.4 135 130 A 48 ALA H A 47 THR HG2% 1.0 2.6 5.8 136 131 A 47 THR H A 48 ALA H 1.0 2.6 5.8 137 132 A 48 ALA H A 49 PRO HDx 1.0 2.6 5.8 138 132 A 48 ALA H A 49 PRO HDy 1.0 2.6 5.8 139 133 A 48 ALA H A 49 PRO HDy 1.0 2.6 5.8 140 134 A 53 CYS H A 52 TYR HA 1.0 2.0 3.6 141 135 A 53 CYS H A 52 TYR HBy 1.0 2.6 5.8 142 136 A 54 VAL H A 53 CYS HA 1.0 2.0 3.6 143 137 A 54 VAL H A 53 CYS HBx 1.0 2.4 4.4 144 138 A 55 ARG H A 54 VAL HA 1.0 2.0 3.6 145 139 A 55 ARG H A 54 VAL HB 1.0 2.4 4.4 146 140 A 55 ARG H A 54 VAL HGy% 1.0 2.6 5.8 147 141 A 54 VAL H A 55 ARG H 1.0 2.6 5.8 148 142 A 54 VAL HGy% A 56 SER H 1.0 2.6 5.8 149 143 A 56 SER H A 55 ARG HBy 1.0 2.4 4.4 150 144 A 56 SER H A 55 ARG HGx 1.0 2.6 5.8 151 145 A 57 ASN H A 56 SER HA 1.0 2.0 3.6 152 146 A 57 ASN H A 56 SER HG 1.0 2.4 4.4 153 147 A 57 ASN H A 56 SER HBy 1.0 2.4 4.4 154 148 A 56 SER H A 57 ASN H 1.0 2.4 4.4 155 149 A 58 SER H A 57 ASN HA 1.0 2.4 4.4 156 150 A 57 ASN H A 58 SER H 1.0 2.0 3.6 157 151 A 57 ASN HA A 59 GLY H 1.0 2.6 5.8 158 152 A 59 GLY H A 58 SER HA 1.0 2.0 3.6 159 153 A 59 GLY H A 58 SER HG 1.0 2.4 4.4 160 154 A 59 GLY H A 58 SER HBy 1.0 2.4 4.4 161 155 A 58 SER H A 59 GLY H 1.0 2.6 5.8 162 156 A 59 GLY H A 60 ILE HA 1.0 2.6 5.8 163 157 A 60 ILE H A 59 GLY HAx 1.0 2.4 4.4 164 158 A 59 GLY H A 60 ILE H 1.0 2.0 3.6 165 159 A 59 GLY H A 61 ILE HB 1.0 2.6 5.8 166 160 A 59 GLY H A 61 ILE HG2% 1.0 2.6 5.8 167 161 A 59 GLY HAx A 61 ILE H 1.0 2.6 5.8 168 162 A 60 ILE H A 61 ILE H 1.0 2.0 3.6 169 163 A 60 ILE HA A 61 ILE H 1.0 2.4 4.4 170 164 A 62 ASP H A 61 ILE HA 1.0 2.4 4.4 171 165 A 60 ILE HA A 62 ASP H 1.0 2.6 5.8 172 166 A 59 GLY HAx A 62 ASP H 1.0 2.6 5.8 173 167 A 61 ILE HB A 62 ASP H 1.0 2.4 4.4 174 168 A 61 ILE HG2% A 62 ASP H 1.0 2.6 5.8 175 169 A 58 SER HG A 63 ALA H 1.0 2.6 5.8 176 170 A 61 ILE HA A 63 ALA H 1.0 2.4 4.4 177 171 A 60 ILE HA A 63 ALA H 1.0 2.6 5.8 178 172 A 59 GLY HAx A 63 ALA H 1.0 2.6 5.8 179 173 A 61 ILE HG2% A 63 ALA H 1.0 2.6 5.8 180 174 A 63 ALA H A 62 ASP HA 1.0 2.4 4.4 181 175 A 63 ALA H A 62 ASP HBy 1.0 2.4 4.4 182 176 A 62 ASP HA A 64 GLY H 1.0 2.6 5.8 183 177 A 60 ILE HA A 64 GLY H 1.0 2.6 5.8 184 178 A 61 ILE HA A 64 GLY H 1.0 2.6 5.8 185 179 A 62 ASP HBy A 64 GLY H 1.0 2.6 5.8 186 180 A 64 GLY H A 63 ALA HA 1.0 2.0 3.6 187 181 A 63 ALA H A 64 GLY H 1.0 2.0 3.6 188 182 A 63 ALA HA A 65 ALA H 1.0 2.4 4.4 189 183 A 61 ILE HA A 65 ALA H 1.0 2.6 5.8 190 184 A 65 ALA H A 64 GLY HAx 1.0 2.0 3.6 191 185 A 64 GLY H A 65 ALA H 1.0 2.0 3.6 192 186 A 63 ALA HA A 66 SER H 1.0 2.6 5.8 193 187 A 64 GLY HAx A 66 SER H 1.0 2.4 4.4 194 188 A 66 SER H A 65 ALA HA 1.0 2.4 4.4 195 189 A 65 ALA H A 66 SER H 1.0 2.0 3.6 196 190 A 65 ALA HA A 67 ILE H 1.0 2.6 5.8 197 191 A 64 GLY HAx A 67 ILE H 1.0 2.4 4.4 198 192 A 66 SER H A 67 ILE HA 1.0 2.6 5.8 199 193 A 67 ILE H A 66 SER HA 1.0 2.6 5.8 200 194 A 67 ILE H A 66 SER HBx 1.0 2.4 4.4 201 195 A 66 SER H A 67 ILE H 1.0 2.4 4.4 202 196 A 67 ILE HA A 68 ASN H 1.0 2.0 3.6 203 197 A 68 ASN H A 67 ILE HB 1.0 2.4 4.4 204 198 A 68 ASN H A 67 ILE HD1% 1.0 2.6 5.8 205 199 A 67 ILE H A 68 ASN H 1.0 2.4 4.4 206 200 A 68 ASN H A 69 VAL HGy% 1.0 2.6 5.8 207 201 A 68 ASN HA A 69 VAL H 1.0 2.4 4.4 208 202 A 67 ILE HD1% A 70 SER H 1.0 2.6 5.8 209 203 A 68 ASN HA A 70 SER H 1.0 2.6 5.8 210 204 A 70 SER H A 69 VAL HB 1.0 2.4 4.4 211 205 A 70 SER H A 69 VAL HA 1.0 2.4 4.4 212 206 A 69 VAL HGy% A 70 SER H 1.0 2.6 5.8 213 207 A 69 VAL H A 70 SER H 1.0 2.4 4.4 214 208 A 69 VAL HA A 71 VAL H 1.0 2.6 5.8 215 209 A 76 PHE H A 75 PRO HA 1.0 2.4 4.4 216 210 A 76 PHE H A 75 PRO HBx 1.0 2.6 5.8 217 211 A 76 PHE H A 75 PRO HGx 1.0 2.6 5.8 218 212 A 75 PRO HA A 77 ASP H 1.0 2.6 5.8 219 213 A 77 ASP H A 76 PHE HA 1.0 2.0 3.6 220 214 A 77 ASP H A 76 PHE HBy 1.0 2.6 5.8 221 215 A 76 PHE H A 77 ASP H 1.0 2.4 4.4 222 216 A 76 PHE HBy A 78 TYR H 1.0 2.6 5.8 223 217 A 78 TYR H A 77 ASP HA 1.0 2.4 4.4 224 218 A 78 TYR H A 77 ASP HBy 1.0 2.4 4.4 225 219 A 77 ASP H A 78 TYR H 1.0 2.0 3.6 226 220 A 79 ASP H A 78 TYR HA 1.0 2.4 4.4 227 221 A 79 ASP H A 78 TYR HBx 1.0 2.4 4.4 228 222 A 78 TYR H A 79 ASP H 1.0 2.4 4.4 229 223 A 79 ASP H A 80 PRO HDx 1.0 2.6 5.8 230 223 A 79 ASP H A 80 PRO HDy 1.0 2.6 5.8 231 224 A 79 ASP H A 80 PRO HDy 1.0 2.6 5.8 232 225 A 81 ASN H A 79 ASP HA 1.0 2.4 4.4 233 226 A 81 ASN H A 80 PRO HA 1.0 2.0 3.6 234 227 A 81 ASN H A 80 PRO HDx 1.0 2.4 4.4 235 227 A 80 PRO HDy A 81 ASN H 1.0 2.4 4.4 236 228 A 80 PRO HDy A 81 ASN H 1.0 2.6 5.8 237 229 A 81 ASN H A 80 PRO HGx 1.0 2.6 5.8 238 230 A 82 GLU H A 81 ASN HA 1.0 2.4 4.4 239 231 A 82 GLU H A 81 ASN HBy 1.0 2.4 4.4 240 232 A 81 ASN H A 82 GLU H 1.0 2.0 3.6 241 233 A 82 GLU H A 83 LYS H 1.0 2.0 3.6 242 234 A 83 LYS H A 82 GLU HA 1.0 2.4 4.4 243 235 A 81 ASN HA A 83 LYS H 1.0 2.4 4.4 244 236 A 82 GLU HA A 84 SER H 1.0 2.4 4.4 245 237 A 81 ASN HA A 84 SER H 1.0 2.6 5.8 246 238 A 84 SER H A 83 LYS HA 1.0 2.4 4.4 247 239 A 84 SER H A 83 LYS HBy 1.0 2.4 4.4 248 240 A 83 LYS H A 84 SER H 1.0 2.0 3.6 249 241 A 85 LYS H A 84 SER HA 1.0 2.0 3.6 250 242 A 81 ASN HA A 85 LYS H 1.0 2.6 5.8 251 243 A 82 GLU HA A 85 LYS H 1.0 2.6 5.8 252 244 A 85 LYS H A 84 SER HBx 1.0 2.4 4.4 253 245 A 85 LYS H A 84 SER HA 1.0 2.4 4.4 254 246 A 84 SER HA A 86 HIS H 1.0 2.6 5.8 255 247 A 86 HIS H A 85 LYS HA 1.0 2.4 4.4 256 248 A 82 GLU HA A 86 HIS H 1.0 2.4 4.4 257 249 A 86 HIS H A 85 LYS HBy 1.0 2.4 4.4 258 250 A 85 LYS H A 86 HIS H 1.0 2.0 3.6 259 251 A 87 LYS H A 85 LYS HGy 1.0 2.6 5.8 260 251 A 87 LYS H A 85 LYS HGx 1.0 2.6 5.8 261 252 A 87 LYS H A 86 HIS HA 1.0 2.0 3.6 262 253 A 87 LYS H A 86 HIS HBy 1.0 2.4 4.4 263 254 A 88 PHE H A 87 LYS HA 1.0 2.4 4.4 264 255 A 88 PHE H A 87 LYS HBx 1.0 2.4 4.4 265 256 A 87 LYS HBx A 89 MET H 1.0 2.6 5.8 266 257 A 87 LYS HA A 89 MET H 1.0 2.6 5.8 267 258 A 89 MET H A 88 PHE HBy 1.0 2.6 5.8 268 259 A 89 MET H A 88 PHE HA 1.0 2.4 4.4 269 260 A 90 VAL H A 89 MET HA 1.0 2.4 4.4 270 261 A 87 LYS HA A 90 VAL H 1.0 2.6 5.8 271 262 A 87 LYS HA A 91 GLN H 1.0 2.6 5.8 272 263 A 91 GLN H A 90 VAL HA 1.0 2.4 4.4 273 264 A 91 GLN H A 90 VAL HB 1.0 2.4 4.4 274 265 A 91 GLN H A 90 VAL HGy% 1.0 2.6 5.8 275 266 A 90 VAL H A 91 GLN H 1.0 2.0 3.6 276 267 A 90 VAL HGy% A 92 SER H 1.0 2.6 5.8 277 268 A 90 VAL HA A 92 SER H 1.0 2.6 5.8 278 269 A 92 SER H A 91 GLN HA 1.0 2.0 3.6 279 270 A 92 SER H A 91 GLN HGx 1.0 2.6 5.8 280 271 A 91 GLN H A 92 SER H 1.0 2.0 3.6 281 272 A 93 MET H A 92 SER HA 1.0 2.0 3.6 282 273 A 90 VAL HA A 93 MET H 1.0 2.6 5.8 283 274 A 91 GLN HA A 93 MET H 1.0 2.6 5.8 284 275 A 93 MET H A 92 SER HA 1.0 2.4 4.4 285 276 A 93 MET H A 92 SER HG 1.0 2.4 4.4 286 277 A 93 MET H A 92 SER HBy 1.0 2.4 4.4 287 278 A 92 SER HA A 94 PHE H 1.0 2.6 5.8 288 279 A 90 VAL HA A 94 PHE H 1.0 2.9 6.1 289 280 A 94 PHE H A 93 MET HA 1.0 2.4 4.4 290 281 A 94 PHE H A 93 MET HBy 1.0 2.6 5.8 291 282 A 94 PHE H A 93 MET HGx 1.0 2.6 5.8 292 283 A 93 MET H A 94 PHE H 1.0 2.0 3.6 293 284 A 92 SER HA A 95 ALA H 1.0 2.6 5.8 294 285 A 91 GLN HA A 95 ALA H 1.0 2.6 5.8 295 286 A 93 MET HA A 95 ALA H 1.0 2.6 5.8 296 287 A 95 ALA H A 94 PHE HA 1.0 2.4 4.4 297 288 A 95 ALA H A 94 PHE HBy 1.0 2.6 5.8 298 289 A 95 ALA H A 94 PHE HEx 1.0 2.6 5.8 299 290 A 94 PHE H A 95 ALA H 1.0 2.6 5.8 300 291 A 95 ALA H A 96 PRO HDy 1.0 2.6 5.8 301 291 A 95 ALA H A 96 PRO HDx 1.0 2.6 5.8 302 292 A 95 ALA H A 96 PRO HDx 1.0 2.6 5.8 303 293 A 97 THR H A 96 PRO HA 1.0 2.4 4.4 304 294 A 97 THR H A 96 PRO HBy 1.0 2.6 5.8 305 295 A 96 PRO HDx A 97 THR H 1.0 2.6 5.8 306 296 A 97 THR H A 96 PRO HGx 1.0 2.6 5.8 307 297 A 96 PRO HA A 98 ASP H 1.0 2.4 4.4 308 298 A 98 ASP H A 97 THR HA 1.0 2.0 3.6 309 299 A 97 THR HA A 99 THR H 1.0 2.4 4.4 310 300 A 98 ASP H A 97 THR HG2% 1.0 2.6 5.8 311 301 A 97 THR H A 98 ASP H 1.0 2.0 3.6 312 302 A 99 THR H A 98 ASP HA 1.0 2.4 4.4 313 303 A 99 THR H A 98 ASP HBx 1.0 2.4 4.4 314 304 A 98 ASP HA A 100 SER H 1.0 2.4 4.4 315 305 A 98 ASP HBx A 100 SER H 1.0 2.6 5.8 316 306 A 100 SER H A 99 THR HA 1.0 2.0 3.6 317 307 A 100 SER H A 99 THR HG2% 1.0 2.6 5.8 318 308 A 100 SER H A 99 THR HA 1.0 2.4 4.4 319 309 A 99 THR H A 100 SER H 1.0 2.0 3.6 320 310 A 98 ASP HA A 101 ASP H 1.0 2.6 5.8 321 311 A 99 THR HA A 101 ASP H 1.0 2.6 5.8 322 312 A 101 ASP H A 100 SER HA 1.0 2.4 4.4 323 313 A 101 ASP H A 100 SER HG 1.0 2.4 4.4 324 314 A 98 ASP HA A 102 MET H 1.0 2.6 5.8 325 315 A 99 THR HA A 102 MET H 1.0 2.6 5.8 326 316 A 100 SER HA A 102 MET H 1.0 2.4 4.4 327 317 A 102 MET H A 101 ASP HA 1.0 2.6 5.8 328 318 A 102 MET H A 101 ASP HBy 1.0 2.4 4.4 329 319 A 101 ASP H A 102 MET H 1.0 2.0 3.6 330 320 A 100 SER HA A 103 GLU H 1.0 2.6 5.8 331 321 A 103 GLU H A 102 MET HA 1.0 2.4 4.4 332 322 A 100 SER HA A 104 ALA H 1.0 2.6 5.8 333 323 A 102 MET HA A 104 ALA H 1.0 2.6 5.8 334 324 A 104 ALA H A 103 GLU HA 1.0 2.4 4.4 335 325 A 104 ALA H A 103 GLU HBx 1.0 2.4 4.4 336 326 A 103 GLU H A 104 ALA H 1.0 2.0 3.6 337 327 A 102 MET HA A 105 VAL H 1.0 2.4 4.4 338 328 A 103 GLU HA A 105 VAL H 1.0 2.6 5.8 339 329 A 104 ALA H A 105 VAL HA 1.0 2.6 5.8 340 330 A 105 VAL H A 104 ALA HA 1.0 2.4 4.4 341 331 A 104 ALA H A 105 VAL H 1.0 2.0 3.6 342 332 A 103 GLU HA A 106 TRP H 1.0 2.4 4.4 343 333 A 105 VAL H A 106 TRP HA 1.0 2.6 5.8 344 334 A 105 VAL H A 106 TRP HBy 1.0 2.6 5.8 345 335 A 105 VAL HA A 106 TRP H 1.0 2.4 4.4 346 336 A 102 MET HA A 106 TRP H 1.0 2.6 5.8 347 337 A 104 ALA HA A 106 TRP H 1.0 2.6 5.8 348 338 A 106 TRP H A 105 VAL HB 1.0 2.4 4.4 349 339 A 105 VAL HA A 106 TRP H 1.0 2.4 4.4 350 340 A 106 TRP H A 105 VAL HGx% 1.0 2.6 5.8 351 341 A 106 TRP H A 105 VAL HGy% 1.0 2.6 5.8 352 342 A 105 VAL H A 106 TRP H 1.0 2.0 3.6 353 343 A 104 ALA HA A 107 LYS H 1.0 2.4 4.4 354 344 A 103 GLU HA A 107 LYS H 1.0 2.6 5.8 355 345 A 105 VAL HA A 107 LYS H 1.0 2.6 5.8 356 346 A 106 TRP HA A 107 LYS H 1.0 2.4 4.4 357 347 A 106 TRP HBy A 107 LYS H 1.0 2.4 4.4 358 348 A 104 ALA HA A 108 GLU H 1.0 2.6 5.8 359 349 A 105 VAL HA A 108 GLU H 1.0 2.4 4.4 360 350 A 106 TRP HA A 108 GLU H 1.0 2.6 5.8 361 351 A 108 GLU H A 107 LYS HA 1.0 2.4 4.4 362 352 A 108 GLU H A 107 LYS HBx 1.0 2.4 4.4 363 353 A 108 GLU H A 107 LYS HDx 1.0 2.6 5.8 364 354 A 108 GLU H A 107 LYS HGx 1.0 2.6 5.8 365 355 A 107 LYS H A 108 GLU H 1.0 2.0 3.6 366 356 A 105 VAL HA A 109 ALA H 1.0 2.6 5.8 367 357 A 105 VAL HGx% A 109 ALA H 1.0 2.6 5.8 368 358 A 105 VAL HGy% A 109 ALA H 1.0 2.6 5.8 369 359 A 106 TRP HA A 109 ALA H 1.0 2.4 4.4 370 360 A 107 LYS HA A 109 ALA H 1.0 2.6 5.8 371 361 A 107 LYS HBx A 109 ALA H 1.0 2.6 5.8 372 362 A 109 ALA H A 108 GLU HA 1.0 2.4 4.4 373 363 A 109 ALA H A 108 GLU HBy 1.0 2.6 5.8 374 364 A 109 ALA H A 108 GLU HGx 1.0 2.6 5.8 375 365 A 108 GLU H A 109 ALA H 1.0 2.0 3.6 376 366 A 110 LYS H A 109 ALA HA 1.0 2.4 4.4 377 367 A 109 ALA H A 110 LYS H 1.0 2.6 5.8 378 368 A 106 TRP HA A 110 LYS H 1.0 2.6 5.8 379 369 A 110 LYS H A 111 PRO HDx 1.0 2.4 5.6 380 369 A 110 LYS H A 111 PRO HDy 1.0 2.4 5.6 381 370 A 110 LYS H A 111 PRO HDy 1.0 2.6 5.8 382 371 A 112 GLU H A 110 LYS HA 1.0 2.6 5.8 383 372 A 112 GLU H A 110 LYS HDx 1.0 2.6 5.8 384 373 A 112 GLU H A 110 LYS HGx 1.0 2.6 5.8 385 374 A 112 GLU H A 111 PRO HA 1.0 2.4 4.4 386 375 A 112 GLU H A 111 PRO HBy 1.0 2.6 5.8 387 376 A 112 GLU H A 111 PRO HDx 1.0 2.6 5.8 388 376 A 111 PRO HDy A 112 GLU H 1.0 2.6 5.8 389 377 A 111 PRO HDy A 112 GLU H 1.0 2.6 5.8 390 378 A 109 ALA HA A 113 ASP H 1.0 2.6 5.8 391 379 A 113 ASP H A 110 LYS HBx 1.0 2.6 5.8 392 380 A 110 LYS HDx A 113 ASP H 1.0 2.6 5.8 393 381 A 110 LYS HGx A 113 ASP H 1.0 2.6 5.8 394 382 A 111 PRO HBy A 113 ASP H 1.0 2.6 5.8 395 383 A 113 ASP H A 112 GLU HA 1.0 2.4 4.4 396 384 A 113 ASP H A 112 GLU HGy 1.0 2.6 5.8 397 384 A 113 ASP H A 112 GLU HGx 1.0 2.6 5.8 398 385 A 112 GLU H A 113 ASP H 1.0 2.4 4.4 399 386 A 112 GLU HA A 114 LEU H 1.0 2.6 5.8 400 387 A 114 LEU H A 113 ASP HA 1.0 2.4 4.4 401 388 A 114 LEU H A 113 ASP HBx 1.0 2.4 4.4 402 389 A 113 ASP H A 114 LEU H 1.0 2.4 4.4 403 390 A 112 GLU HA A 115 MET H 1.0 2.6 5.8 404 391 A 113 ASP HBx A 115 MET H 1.0 2.6 5.8 405 392 A 113 ASP HA A 115 MET H 1.0 2.6 5.8 406 393 A 115 MET H A 114 LEU HA 1.0 2.4 4.4 407 394 A 115 MET H A 114 LEU HG 1.0 2.6 5.8 408 395 A 115 MET H A 114 LEU HBy 1.0 2.6 5.8 409 396 A 115 MET H A 114 LEU HDy% 1.0 2.6 5.8 410 397 A 115 MET H A 114 LEU HG 1.0 2.6 5.8 411 398 A 112 GLU HA A 116 ASP H 1.0 2.6 5.8 412 399 A 113 ASP HA A 116 ASP H 1.0 2.4 4.4 413 400 A 114 LEU HA A 116 ASP H 1.0 2.6 5.8 414 401 A 114 LEU HBy A 116 ASP H 1.0 2.9 6.1 415 402 A 114 LEU HG A 116 ASP H 1.0 2.6 5.8 416 403 A 116 ASP H A 115 MET HA 1.0 2.4 4.4 417 404 A 116 ASP H A 115 MET HBx 1.0 2.4 4.4 418 405 A 116 ASP H A 115 MET HGx 1.0 2.6 5.8 419 405 A 116 ASP H A 115 MET HGy 1.0 2.6 5.8 420 406 A 116 ASP H A 115 MET HGy 1.0 2.6 5.8 421 407 A 114 LEU HA A 117 SER H 1.0 2.6 5.8 422 408 A 117 SER H A 116 ASP HA 1.0 2.4 4.4 423 409 A 118 LYS H A 117 SER HA 1.0 2.4 4.4 424 410 A 118 LYS H A 117 SER HBx 1.0 2.4 4.4 425 411 A 115 MET HA A 118 LYS H 1.0 2.6 5.8 426 412 A 116 ASP HA A 118 LYS H 1.0 2.6 5.8 427 413 A 115 MET HA A 119 LEU H 1.0 2.6 5.8 428 414 A 117 SER HBx A 119 LEU H 1.0 2.4 4.4 429 415 A 116 ASP HA A 119 LEU H 1.0 2.4 4.4 430 416 A 119 LEU H A 118 LYS HA 1.0 2.4 4.4 431 417 A 119 LEU H A 118 LYS HBy 1.0 2.4 4.4 432 418 A 118 LYS H A 119 LEU H 1.0 2.4 4.4 433 419 A 120 ARG H A 119 LEU HA 1.0 2.4 4.4 434 420 A 120 ARG H A 119 LEU HBy 1.0 2.4 4.4 435 421 A 120 ARG H A 119 LEU HDx% 1.0 2.6 5.8 436 422 A 120 ARG H A 119 LEU HDy% 1.0 2.6 5.8 437 423 A 120 ARG H A 119 LEU HG 1.0 2.6 5.8 438 424 A 119 LEU H A 120 ARG H 1.0 2.4 4.4 439 425 A 118 LYS HA A 121 CYS H 1.0 2.4 4.4 440 426 A 119 LEU HA A 121 CYS H 1.0 2.6 5.8 441 427 A 119 LEU HBy A 121 CYS H 1.0 2.6 5.8 442 428 A 119 LEU HDy% A 121 CYS H 1.0 2.6 5.8 443 429 A 119 LEU HG A 121 CYS H 1.0 2.6 5.8 444 430 A 121 CYS H A 120 ARG HA 1.0 2.4 4.4 445 431 A 120 ARG H A 121 CYS H 1.0 2.4 4.4 446 432 A 119 LEU HA A 122 VAL H 1.0 2.4 4.4 447 433 A 120 ARG HA A 122 VAL H 1.0 2.6 5.8 448 434 A 122 VAL H A 121 CYS HA 1.0 2.4 4.4 449 435 A 122 VAL H A 121 CYS HBx 1.0 2.4 4.4 450 436 A 121 CYS H A 122 VAL H 1.0 2.4 4.4 451 437 A 123 PHE H A 122 VAL HA 1.0 2.4 4.4 452 438 A 119 LEU HA A 123 PHE H 1.0 2.6 5.8 453 439 A 120 ARG HA A 123 PHE H 1.0 2.4 4.4 454 440 A 121 CYS HA A 123 PHE H 1.0 2.6 5.8 455 441 A 123 PHE H A 122 VAL HGy% 1.0 2.6 5.8 456 442 A 122 VAL H A 123 PHE H 1.0 2.4 4.4 457 443 A 121 CYS HA A 124 GLU H 1.0 2.4 4.4 458 444 A 120 ARG HA A 124 GLU H 1.0 2.6 5.8 459 445 A 122 VAL HA A 124 GLU H 1.0 2.6 5.8 460 446 A 124 GLU H A 122 VAL HGx% 1.0 2.6 5.8 461 447 A 124 GLU H A 123 PHE HA 1.0 2.4 4.4 462 448 A 124 GLU H A 123 PHE HBy 1.0 2.4 4.4 463 449 A 123 PHE H A 124 GLU H 1.0 2.0 3.6 464 450 A 122 VAL HA A 125 LEU H 1.0 2.4 4.4 465 451 A 121 CYS HA A 125 LEU H 1.0 2.6 5.8 466 452 A 123 PHE HA A 125 LEU H 1.0 2.6 5.8 467 453 A 125 LEU H A 124 GLU HA 1.0 2.4 4.4 468 454 A 125 LEU H A 124 GLU HBx 1.0 2.4 4.4 469 455 A 125 LEU H A 124 GLU HGx 1.0 2.6 5.8 470 456 A 124 GLU H A 125 LEU H 1.0 2.0 3.6 471 457 A 8 LEU HA A 32 LEU HG 1.0 2.6 5.8 472 458 A 32 LEU HG A 9 SER HG 1.0 2.6 5.8 473 459 A 60 ILE HD1% A 36 THR HB 1.0 2.6 5.8 474 460 A 60 ILE HD1% A 37 ASP HBy 1.0 2.6 5.8 475 460 A 60 ILE HD1% A 37 ASP HBx 1.0 2.6 5.8 476 461 A 60 ILE HD1% A 39 ASN HBx 1.0 2.6 5.8 477 461 A 60 ILE HD1% A 39 ASN HBy 1.0 2.6 5.8 478 462 A 13 GLN HA A 10 LEU HBx 1.0 2.6 5.8 479 462 A 13 GLN HA A 10 LEU HBy 1.0 2.6 5.8 480 463 A 13 GLN HA A 10 LEU HG 1.0 2.6 5.8 481 464 A 106 TRP HA A 109 ALA HB% 1.0 2.6 5.8 482 465 A 120 ARG HA A 123 PHE HBx 1.0 2.6 5.8 483 465 A 120 ARG HA A 123 PHE HBy 1.0 2.6 5.8 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin pre _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 2 ALA H A 6 GLN HE2y 1.0 9.70964471 19.70964471 2 1 A 6 GLN HE2x A 2 ALA H 1.0 9.70964471 19.70964471 3 2 A 13 GLN H A 6 GLN HE2y 1.0 15.88980491 25.88980491 4 2 A 13 GLN H A 6 GLN HE2x 1.0 15.88980491 25.88980491 5 3 A 15 GLU H A 6 GLN HE2y 1.0 15.77276161 25.77276161 6 3 A 15 GLU H A 6 GLN HE2x 1.0 15.77276161 25.77276161 7 4 A 16 LEU H A 6 GLN HE2y 1.0 14.39144260 24.39144260 8 4 A 16 LEU H A 6 GLN HE2x 1.0 14.39144260 24.39144260 9 5 A 17 LYS H A 6 GLN HE2y 1.0 15.25399962 25.25399962 10 5 A 17 LYS H A 6 GLN HE2x 1.0 15.25399962 25.25399962 11 6 A 20 GLY H A 6 GLN HE2y 1.0 15.81365275 25.81365275 12 6 A 6 GLN HE2x A 20 GLY H 1.0 15.81365275 25.81365275 13 7 A 22 PHE H A 6 GLN HE2y 1.0 14.50934913 24.50934913 14 7 A 22 PHE H A 6 GLN HE2x 1.0 14.50934913 24.50934913 15 8 A 23 THR H A 6 GLN HE2y 1.0 13.98400777 23.98400777 16 8 A 23 THR H A 6 GLN HE2x 1.0 13.98400777 23.98400777 17 9 A 26 VAL H A 6 GLN HE2y 1.0 15.45287671 25.45287671 18 9 A 26 VAL H A 6 GLN HE2x 1.0 15.45287671 25.45287671 19 10 A 32 LEU H A 6 GLN HE2y 1.0 16.02153821 26.02153821 20 10 A 32 LEU H A 6 GLN HE2x 1.0 16.02153821 26.02153821 21 11 A 33 GLY H A 6 GLN HE2y 1.0 14.44068198 24.44068198 22 11 A 33 GLY H A 6 GLN HE2x 1.0 14.44068198 24.44068198 23 12 A 34 ASN H A 6 GLN HE2y 1.0 18.05004603 28.05004603 24 12 A 34 ASN H A 6 GLN HE2x 1.0 18.05004603 28.05004603 25 13 A 36 THR H A 6 GLN HE2y 1.0 18.59990691 28.59990691 26 13 A 36 THR H A 6 GLN HE2x 1.0 18.59990691 28.59990691 27 14 A 38 ARG H A 6 GLN HE2y 1.0 19.09039466 29.09039466 28 14 A 38 ARG H A 6 GLN HE2x 1.0 19.09039466 29.09039466 29 15 A 43 LYS H A 6 GLN HE2y 1.0 19.52117797 29.52117797 30 15 A 43 LYS H A 6 GLN HE2x 1.0 19.52117797 29.52117797 31 16 A 48 ALA H A 6 GLN HE2y 1.0 19.22651066 29.22651066 32 16 A 48 ALA H A 6 GLN HE2x 1.0 19.22651066 29.22651066 33 17 A 53 CYS H A 6 GLN HE2y 1.0 17.67110374 27.67110374 34 17 A 53 CYS H A 6 GLN HE2x 1.0 17.67110374 27.67110374 35 18 A 55 ARG H A 6 GLN HE2y 1.0 15.95383377 25.95383377 36 18 A 55 ARG H A 6 GLN HE2x 1.0 15.95383377 25.95383377 37 19 A 56 SER H A 6 GLN HE2y 1.0 18.92602507 28.92602507 38 19 A 56 SER H A 6 GLN HE2x 1.0 18.92602507 28.92602507 39 20 A 57 ASN H A 6 GLN HE2y 1.0 16.50947578 26.50947578 40 20 A 57 ASN H A 6 GLN HE2x 1.0 16.50947578 26.50947578 41 21 A 58 SER H A 6 GLN HE2y 1.0 21.07725164 31.07725164 42 21 A 58 SER H A 6 GLN HE2x 1.0 21.07725164 31.07725164 43 22 A 59 GLY H A 6 GLN HE2y 1.0 20.74986698 30.74986698 44 22 A 59 GLY H A 6 GLN HE2x 1.0 20.74986698 30.74986698 45 23 A 60 ILE H A 6 GLN HE2y 1.0 17.26314464 27.26314464 46 23 A 60 ILE H A 6 GLN HE2x 1.0 17.26314464 27.26314464 47 24 A 62 ASP H A 6 GLN HE2y 1.0 19.75568431 29.75568431 48 24 A 62 ASP H A 6 GLN HE2x 1.0 19.75568431 29.75568431 49 25 A 63 ALA H A 6 GLN HE2y 1.0 18.02328621 28.02328621 50 25 A 63 ALA H A 6 GLN HE2x 1.0 18.02328621 28.02328621 51 26 A 64 GLY H A 6 GLN HE2y 1.0 18.15838461 28.15838461 52 26 A 64 GLY H A 6 GLN HE2x 1.0 18.15838461 28.15838461 53 27 A 65 ALA H A 6 GLN HE2y 1.0 18.21619256 28.21619256 54 27 A 65 ALA H A 6 GLN HE2x 1.0 18.21619256 28.21619256 55 28 A 66 SER H A 6 GLN HE2y 1.0 19.63505194 29.63505194 56 28 A 66 SER H A 6 GLN HE2x 1.0 19.63505194 29.63505194 57 29 A 68 ASN H A 6 GLN HE2y 1.0 16.15717493 26.15717493 58 29 A 68 ASN H A 6 GLN HE2x 1.0 16.15717493 26.15717493 59 30 A 74 GLN H A 6 GLN HE2y 1.0 16.22868466 26.22868466 60 30 A 6 GLN HE2x A 74 GLN H 1.0 16.22868466 26.22868466 61 31 A 76 PHE H A 6 GLN HE2y 1.0 13.52375337 23.52375337 62 31 A 76 PHE H A 6 GLN HE2x 1.0 13.52375337 23.52375337 63 32 A 78 TYR H A 6 GLN HE2y 1.0 17.55793873 27.55793873 64 32 A 78 TYR H A 6 GLN HE2x 1.0 17.55793873 27.55793873 65 33 A 79 ASP H A 6 GLN HE2y 1.0 18.60094610 28.60094610 66 33 A 79 ASP H A 6 GLN HE2x 1.0 18.60094610 28.60094610 67 34 A 84 SER H A 6 GLN HE2y 1.0 20.45493831 30.45493831 68 34 A 84 SER H A 6 GLN HE2x 1.0 20.45493831 30.45493831 69 35 A 86 HIS H A 6 GLN HE2y 1.0 18.76923581 28.76923581 70 35 A 86 HIS H A 6 GLN HE2x 1.0 18.76923581 28.76923581 71 36 A 87 LYS H A 6 GLN HE2y 1.0 15.29417266 25.29417266 72 36 A 87 LYS H A 6 GLN HE2x 1.0 15.29417266 25.29417266 73 37 A 88 PHE H A 6 GLN HE2y 1.0 15.55675264 25.55675264 74 37 A 88 PHE H A 6 GLN HE2x 1.0 15.55675264 25.55675264 75 38 A 89 MET H A 6 GLN HE2y 1.0 15.28842817 25.28842817 76 38 A 89 MET H A 6 GLN HE2x 1.0 15.28842817 25.28842817 77 39 A 90 VAL H A 6 GLN HE2y 1.0 15.09508058 25.09508058 78 39 A 90 VAL H A 6 GLN HE2x 1.0 15.09508058 25.09508058 79 40 A 91 GLN H A 6 GLN HE2y 1.0 16.84751497 26.84751497 80 40 A 91 GLN H A 6 GLN HE2x 1.0 16.84751497 26.84751497 81 41 A 92 SER H A 6 GLN HE2y 1.0 17.52630967 27.52630967 82 41 A 92 SER H A 6 GLN HE2x 1.0 17.52630967 27.52630967 83 42 A 93 MET H A 6 GLN HE2y 1.0 13.73073427 23.73073427 84 42 A 93 MET H A 6 GLN HE2x 1.0 13.73073427 23.73073427 85 43 A 95 ALA H A 6 GLN HE2y 1.0 14.78924033 24.78924033 86 43 A 95 ALA H A 6 GLN HE2x 1.0 14.78924033 24.78924033 87 44 A 97 THR H A 6 GLN HE2y 1.0 13.58637707 23.58637707 88 44 A 97 THR H A 6 GLN HE2x 1.0 13.58637707 23.58637707 89 45 A 98 ASP H A 6 GLN HE2y 1.0 15.46815955 25.46815955 90 45 A 98 ASP H A 6 GLN HE2x 1.0 15.46815955 25.46815955 91 46 A 99 THR H A 6 GLN HE2y 1.0 15.04093587 25.04093587 92 46 A 99 THR H A 6 GLN HE2x 1.0 15.04093587 25.04093587 93 47 A 100 SER H A 6 GLN HE2y 1.0 16.22210941 26.22210941 94 47 A 100 SER H A 6 GLN HE2x 1.0 16.22210941 26.22210941 95 48 A 101 ASP H A 6 GLN HE2y 1.0 13.86112007 23.86112007 96 48 A 101 ASP H A 6 GLN HE2x 1.0 13.86112007 23.86112007 97 49 A 102 MET H A 6 GLN HE2y 1.0 13.24416697 23.24416697 98 49 A 102 MET H A 6 GLN HE2x 1.0 13.24416697 23.24416697 99 50 A 103 GLU H A 6 GLN HE2y 1.0 14.86184987 24.86184987 100 50 A 103 GLU H A 6 GLN HE2x 1.0 14.86184987 24.86184987 101 51 A 104 ALA H A 6 GLN HE2y 1.0 13.88926287 23.88926287 102 51 A 104 ALA H A 6 GLN HE2x 1.0 13.88926287 23.88926287 103 52 A 105 VAL H A 6 GLN HE2y 1.0 12.83674214 22.83674214 104 52 A 105 VAL H A 6 GLN HE2x 1.0 12.83674214 22.83674214 105 53 A 106 TRP H A 6 GLN HE2y 1.0 14.33225688 24.33225688 106 53 A 106 TRP H A 6 GLN HE2x 1.0 14.33225688 24.33225688 107 54 A 107 LYS H A 6 GLN HE2y 1.0 14.63797041 24.63797041 108 54 A 107 LYS H A 6 GLN HE2x 1.0 14.63797041 24.63797041 109 55 A 108 GLU H A 6 GLN HE2y 1.0 15.33397702 25.33397702 110 55 A 108 GLU H A 6 GLN HE2x 1.0 15.33397702 25.33397702 111 56 A 109 ALA H A 6 GLN HE2y 1.0 14.94621897 24.94621897 112 56 A 109 ALA H A 6 GLN HE2x 1.0 14.94621897 24.94621897 113 57 A 112 GLU H A 6 GLN HE2y 1.0 15.62955635 25.62955635 114 57 A 112 GLU H A 6 GLN HE2x 1.0 15.62955635 25.62955635 115 58 A 113 ASP H A 6 GLN HE2y 1.0 13.68845793 23.68845793 116 58 A 113 ASP H A 6 GLN HE2x 1.0 13.68845793 23.68845793 117 59 A 114 LEU H A 6 GLN HE2y 1.0 17.87600378 27.87600378 118 59 A 114 LEU H A 6 GLN HE2x 1.0 17.87600378 27.87600378 119 60 A 115 MET H A 6 GLN HE2y 1.0 13.79638936 23.79638936 120 60 A 115 MET H A 6 GLN HE2x 1.0 13.79638936 23.79638936 121 61 A 117 SER H A 6 GLN HE2y 1.0 16.05443405 26.05443405 122 61 A 117 SER H A 6 GLN HE2x 1.0 16.05443405 26.05443405 123 62 A 118 LYS H A 6 GLN HE2y 1.0 14.07497643 24.07497643 124 62 A 118 LYS H A 6 GLN HE2x 1.0 14.07497643 24.07497643 125 63 A 124 GLU H A 6 GLN HE2y 1.0 16.69684111 26.69684111 126 63 A 124 GLU H A 6 GLN HE2x 1.0 16.69684111 26.69684111 127 64 A 2 ALA H A 24 ASP OD2 1.0 10.39382626 20.39382626 128 64 A 2 ALA H A 24 ASP OD1 1.0 10.39382626 20.39382626 129 65 A 3 LYS H A 24 ASP OD2 1.0 13.71324895 23.71324895 130 65 A 3 LYS H A 24 ASP OD1 1.0 13.71324895 23.71324895 131 66 A 4 VAL H A 24 ASP OD2 1.0 10.68297781 20.68297781 132 66 A 4 VAL H A 24 ASP OD1 1.0 10.68297781 20.68297781 133 67 A 5 GLU H A 24 ASP OD2 1.0 11.72752940 21.72752940 134 67 A 5 GLU H A 24 ASP OD1 1.0 11.72752940 21.72752940 135 68 A 9 SER H A 24 ASP OD2 1.0 10.81033242 20.81033242 136 68 A 9 SER H A 24 ASP OD1 1.0 10.81033242 20.81033242 137 69 A 10 LEU H A 24 ASP OD2 1.0 11.55343295 21.55343295 138 69 A 10 LEU H A 24 ASP OD1 1.0 11.55343295 21.55343295 139 70 A 11 GLU H A 24 ASP OD2 1.0 11.02736832 21.02736832 140 70 A 11 GLU H A 24 ASP OD1 1.0 11.02736832 21.02736832 141 71 A 14 HIS H A 24 ASP OD2 1.0 13.57811246 23.57811246 142 71 A 14 HIS H A 24 ASP OD1 1.0 13.57811246 23.57811246 143 72 A 15 GLU H A 24 ASP OD2 1.0 11.63796701 21.63796701 144 72 A 15 GLU H A 24 ASP OD1 1.0 11.63796701 21.63796701 145 73 A 16 LEU H A 24 ASP OD2 1.0 9.90329351 19.90329351 146 73 A 16 LEU H A 24 ASP OD1 1.0 9.90329351 19.90329351 147 74 A 17 LYS H A 24 ASP OD2 1.0 10.05647798 20.05647798 148 74 A 17 LYS H A 24 ASP OD1 1.0 10.05647798 20.05647798 149 75 A 32 LEU H A 24 ASP OD2 1.0 12.28257438 22.28257438 150 75 A 32 LEU H A 24 ASP OD1 1.0 12.28257438 22.28257438 151 76 A 34 ASN H A 24 ASP OD2 1.0 12.41619123 22.41619123 152 76 A 34 ASN H A 24 ASP OD1 1.0 12.41619123 22.41619123 153 77 A 36 THR H A 24 ASP OD2 1.0 11.64316843 21.64316843 154 77 A 36 THR H A 24 ASP OD1 1.0 11.64316843 21.64316843 155 78 A 38 ARG H A 24 ASP OD2 1.0 12.70735987 22.70735987 156 78 A 38 ARG H A 24 ASP OD1 1.0 12.70735987 22.70735987 157 79 A 39 ASN H A 24 ASP OD2 1.0 13.11486311 23.11486311 158 79 A 39 ASN H A 24 ASP OD1 1.0 13.11486311 23.11486311 159 80 A 43 LYS H A 24 ASP OD2 1.0 10.51787367 20.51787367 160 80 A 43 LYS H A 24 ASP OD1 1.0 10.51787367 20.51787367 161 81 A 45 LYS H A 24 ASP OD2 1.0 10.76112781 20.76112781 162 81 A 45 LYS H A 24 ASP OD1 1.0 10.76112781 20.76112781 163 82 A 46 THR H A 24 ASP OD2 1.0 15.76365597 25.76365597 164 82 A 46 THR H A 24 ASP OD1 1.0 15.76365597 25.76365597 165 83 A 47 THR H A 24 ASP OD2 1.0 12.12158474 22.12158474 166 83 A 47 THR H A 24 ASP OD1 1.0 12.12158474 22.12158474 167 84 A 48 ALA H A 24 ASP OD2 1.0 11.04683643 21.04683643 168 84 A 48 ALA H A 24 ASP OD1 1.0 11.04683643 21.04683643 169 85 A 53 CYS H A 24 ASP OD2 1.0 12.56397004 22.56397004 170 85 A 53 CYS H A 24 ASP OD1 1.0 12.56397004 22.56397004 171 86 A 54 VAL H A 24 ASP OD2 1.0 11.24720225 21.24720225 172 86 A 54 VAL H A 24 ASP OD1 1.0 11.24720225 21.24720225 173 87 A 55 ARG H A 24 ASP OD2 1.0 11.18350586 21.18350586 174 87 A 55 ARG H A 24 ASP OD1 1.0 11.18350586 21.18350586 175 88 A 56 SER H A 24 ASP OD2 1.0 12.53253981 22.53253981 176 88 A 56 SER H A 24 ASP OD1 1.0 12.53253981 22.53253981 177 89 A 57 ASN H A 24 ASP OD2 1.0 12.80245251 22.80245251 178 89 A 57 ASN H A 24 ASP OD1 1.0 12.80245251 22.80245251 179 90 A 58 SER H A 24 ASP OD2 1.0 14.37471388 24.37471388 180 90 A 58 SER H A 24 ASP OD1 1.0 14.37471388 24.37471388 181 91 A 59 GLY H A 24 ASP OD2 1.0 13.72959330 23.72959330 182 91 A 59 GLY H A 24 ASP OD1 1.0 13.72959330 23.72959330 183 92 A 60 ILE H A 24 ASP OD2 1.0 11.06125870 21.06125870 184 92 A 60 ILE H A 24 ASP OD1 1.0 11.06125870 21.06125870 185 93 A 62 ASP H A 24 ASP OD2 1.0 14.44174498 24.44174498 186 93 A 62 ASP H A 24 ASP OD1 1.0 14.44174498 24.44174498 187 94 A 63 ALA H A 24 ASP OD2 1.0 12.78356804 22.78356804 188 94 A 63 ALA H A 24 ASP OD1 1.0 12.78356804 22.78356804 189 95 A 64 GLY H A 24 ASP OD2 1.0 12.65569882 22.65569882 190 95 A 64 GLY H A 24 ASP OD1 1.0 12.65569882 22.65569882 191 96 A 65 ALA H A 24 ASP OD2 1.0 12.05455995 22.05455995 192 96 A 65 ALA H A 24 ASP OD1 1.0 12.05455995 22.05455995 193 97 A 66 SER H A 24 ASP OD2 1.0 12.60931096 22.60931096 194 97 A 66 SER H A 24 ASP OD1 1.0 12.60931096 22.60931096 195 98 A 67 ILE H A 24 ASP OD2 1.0 12.67541075 22.67541075 196 98 A 67 ILE H A 24 ASP OD1 1.0 12.67541075 22.67541075 197 99 A 68 ASN H A 24 ASP OD2 1.0 11.11045164 21.11045164 198 99 A 68 ASN H A 24 ASP OD1 1.0 11.11045164 21.11045164 199 100 A 69 VAL H A 24 ASP OD2 1.0 12.62146836 22.62146836 200 100 A 69 VAL H A 24 ASP OD1 1.0 12.62146836 22.62146836 201 101 A 76 PHE H A 24 ASP OD2 1.0 9.46337597 19.46337597 202 101 A 76 PHE H A 24 ASP OD1 1.0 9.46337597 19.46337597 203 102 A 78 TYR H A 24 ASP OD2 1.0 13.51357901 23.51357901 204 102 A 78 TYR H A 24 ASP OD1 1.0 13.51357901 23.51357901 205 103 A 79 ASP H A 24 ASP OD2 1.0 14.11925256 24.11925256 206 103 A 79 ASP H A 24 ASP OD1 1.0 14.11925256 24.11925256 207 104 A 81 ASN H A 24 ASP OD2 1.0 14.84546893 24.84546893 208 104 A 81 ASN H A 24 ASP OD1 1.0 14.84546893 24.84546893 209 105 A 82 GLU H A 24 ASP OD2 1.0 14.90354766 24.90354766 210 105 A 82 GLU H A 24 ASP OD1 1.0 14.90354766 24.90354766 211 106 A 84 SER H A 24 ASP OD2 1.0 13.08205513 23.08205513 212 106 A 84 SER H A 24 ASP OD1 1.0 13.08205513 23.08205513 213 107 A 85 LYS H A 24 ASP OD2 1.0 14.39802971 24.39802971 214 107 A 85 LYS H A 24 ASP OD1 1.0 14.39802971 24.39802971 215 108 A 86 HIS H A 24 ASP OD2 1.0 14.40317996 24.40317996 216 108 A 86 HIS H A 24 ASP OD1 1.0 14.40317996 24.40317996 217 109 A 87 LYS H A 24 ASP OD2 1.0 13.64671540 23.64671540 218 109 A 87 LYS H A 24 ASP OD1 1.0 13.64671540 23.64671540 219 110 A 88 PHE H A 24 ASP OD2 1.0 12.24203175 22.24203175 220 110 A 88 PHE H A 24 ASP OD1 1.0 12.24203175 22.24203175 221 111 A 89 MET H A 24 ASP OD2 1.0 11.96519447 21.96519447 222 111 A 89 MET H A 24 ASP OD1 1.0 11.96519447 21.96519447 223 112 A 90 VAL H A 24 ASP OD2 1.0 11.82594541 21.82594541 224 112 A 90 VAL H A 24 ASP OD1 1.0 11.82594541 21.82594541 225 113 A 91 GLN H A 24 ASP OD2 1.0 12.93025244 22.93025244 226 113 A 91 GLN H A 24 ASP OD1 1.0 12.93025244 22.93025244 227 114 A 92 SER H A 24 ASP OD2 1.0 13.39440597 23.39440597 228 114 A 92 SER H A 24 ASP OD1 1.0 13.39440597 23.39440597 229 115 A 93 MET H A 24 ASP OD2 1.0 10.10276111 20.10276111 230 115 A 93 MET H A 24 ASP OD1 1.0 10.10276111 20.10276111 231 116 A 95 ALA H A 24 ASP OD2 1.0 12.93186743 22.93186743 232 116 A 95 ALA H A 24 ASP OD1 1.0 12.93186743 22.93186743 233 117 A 97 THR H A 24 ASP OD2 1.0 11.93939278 21.93939278 234 117 A 97 THR H A 24 ASP OD1 1.0 11.93939278 21.93939278 235 118 A 99 THR H A 24 ASP OD2 1.0 12.85475700 22.85475700 236 118 A 99 THR H A 24 ASP OD1 1.0 12.85475700 22.85475700 237 119 A 100 SER H A 24 ASP OD2 1.0 12.92690595 22.92690595 238 119 A 100 SER H A 24 ASP OD1 1.0 12.92690595 22.92690595 239 120 A 101 ASP H A 24 ASP OD2 1.0 12.18518035 22.18518035 240 120 A 101 ASP H A 24 ASP OD1 1.0 12.18518035 22.18518035 241 121 A 102 MET H A 24 ASP OD2 1.0 12.19708660 22.19708660 242 121 A 102 MET H A 24 ASP OD1 1.0 12.19708660 22.19708660 243 122 A 103 GLU H A 24 ASP OD2 1.0 12.55388148 22.55388148 244 122 A 103 GLU H A 24 ASP OD1 1.0 12.55388148 22.55388148 245 123 A 104 ALA H A 24 ASP OD2 1.0 12.79038913 22.79038913 246 123 A 104 ALA H A 24 ASP OD1 1.0 12.79038913 22.79038913 247 124 A 105 VAL H A 24 ASP OD2 1.0 11.65264263 21.65264263 248 124 A 105 VAL H A 24 ASP OD1 1.0 11.65264263 21.65264263 249 125 A 106 TRP H A 24 ASP OD2 1.0 12.41860222 22.41860222 250 125 A 106 TRP H A 24 ASP OD1 1.0 12.41860222 22.41860222 251 126 A 107 LYS H A 24 ASP OD2 1.0 12.45951835 22.45951835 252 126 A 107 LYS H A 24 ASP OD1 1.0 12.45951835 22.45951835 253 127 A 108 GLU H A 24 ASP OD2 1.0 13.06165905 23.06165905 254 127 A 108 GLU H A 24 ASP OD1 1.0 13.06165905 23.06165905 255 128 A 109 ALA H A 24 ASP OD2 1.0 12.29166405 22.29166405 256 128 A 109 ALA H A 24 ASP OD1 1.0 12.29166405 22.29166405 257 129 A 110 LYS H A 24 ASP OD2 1.0 10.49463140 20.49463140 258 129 A 110 LYS H A 24 ASP OD1 1.0 10.49463140 20.49463140 259 130 A 112 GLU H A 24 ASP OD2 1.0 11.78305020 21.78305020 260 130 A 112 GLU H A 24 ASP OD1 1.0 11.78305020 21.78305020 261 131 A 113 ASP H A 24 ASP OD2 1.0 12.49076272 22.49076272 262 131 A 113 ASP H A 24 ASP OD1 1.0 12.49076272 22.49076272 263 132 A 114 LEU H A 24 ASP OD2 1.0 11.98844216 21.98844216 264 132 A 114 LEU H A 24 ASP OD1 1.0 11.98844216 21.98844216 265 133 A 115 MET H A 24 ASP OD2 1.0 12.07188610 22.07188610 266 133 A 115 MET H A 24 ASP OD1 1.0 12.07188610 22.07188610 267 134 A 116 ASP H A 24 ASP OD2 1.0 11.57749091 21.57749091 268 134 A 116 ASP H A 24 ASP OD1 1.0 11.57749091 21.57749091 269 135 A 118 LYS H A 24 ASP OD2 1.0 11.94493874 21.94493874 270 135 A 118 LYS H A 24 ASP OD1 1.0 11.94493874 21.94493874 271 136 A 119 LEU H A 24 ASP OD2 1.0 11.86342832 21.86342832 272 136 A 119 LEU H A 24 ASP OD1 1.0 11.86342832 21.86342832 273 137 A 120 ARG H A 24 ASP OD2 1.0 11.97619973 21.97619973 274 137 A 120 ARG H A 24 ASP OD1 1.0 11.97619973 21.97619973 275 138 A 123 PHE H A 24 ASP OD2 1.0 12.42008074 22.42008074 276 138 A 123 PHE H A 24 ASP OD1 1.0 12.42008074 22.42008074 277 139 A 124 GLU H A 24 ASP OD2 1.0 12.28747785 22.28747785 278 139 A 124 GLU H A 24 ASP OD1 1.0 12.28747785 22.28747785 279 140 A 13 GLN H A 24 ASP OD2 1.0 5.00000000 15.00000000 280 140 A 13 GLN H A 24 ASP OD1 1.0 5.00000000 15.00000000 281 141 A 33 GLY H A 24 ASP OD2 1.0 5.00000000 15.00000000 282 141 A 33 GLY H A 24 ASP OD1 1.0 5.00000000 15.00000000 283 142 A 44 VAL H A 24 ASP OD2 1.0 7.80000000 17.80000000 284 142 A 44 VAL H A 24 ASP OD1 1.0 7.80000000 17.80000000 285 143 A 2 ALA H A 53 CYS HG 1.0 14.61384068 24.61384068 286 144 A 5 GLU H A 53 CYS HG 1.0 15.41176585 25.41176585 287 145 A 9 SER H A 53 CYS HG 1.0 18.07229101 28.07229101 288 146 A 11 GLU H A 53 CYS HG 1.0 16.12549760 26.12549760 289 147 A 13 GLN H A 53 CYS HG 1.0 12.94096228 22.94096228 290 148 A 15 GLU H A 53 CYS HG 1.0 16.07735498 26.07735498 291 149 A 16 LEU H A 53 CYS HG 1.0 11.56135392 21.56135392 292 150 A 20 GLY H A 53 CYS HG 1.0 15.09803107 25.09803107 293 151 A 23 THR H A 53 CYS HG 1.0 12.08475168 22.08475168 294 152 A 32 LEU H A 53 CYS HG 1.0 16.44778427 26.44778427 295 153 A 34 ASN H A 53 CYS HG 1.0 14.70102831 24.70102831 296 154 A 36 THR H A 53 CYS HG 1.0 13.79408756 23.79408756 297 155 A 38 ARG H A 53 CYS HG 1.0 14.71437911 24.71437911 298 156 A 39 ASN H A 53 CYS HG 1.0 11.50835452 21.50835452 299 157 A 43 LYS H A 53 CYS HG 1.0 17.43851088 27.43851088 300 158 A 46 THR H A 53 CYS HG 1.0 16.74055596 26.74055596 301 159 A 60 ILE H A 53 CYS HG 1.0 12.13786412 22.13786412 302 160 A 62 ASP H A 53 CYS HG 1.0 16.07767127 26.07767127 303 161 A 67 ILE H A 53 CYS HG 1.0 7.95747820 17.95747820 304 162 A 68 ASN H A 53 CYS HG 1.0 8.97121877 18.97121877 305 163 A 74 GLN H A 53 CYS HG 1.0 12.07924223 22.07924223 306 164 A 78 TYR H A 53 CYS HG 1.0 12.39218208 22.39218208 307 165 A 79 ASP H A 53 CYS HG 1.0 14.48012397 24.48012397 308 166 A 81 ASN H A 53 CYS HG 1.0 19.19922511 29.19922511 309 167 A 82 GLU H A 53 CYS HG 1.0 18.27393041 28.27393041 310 168 A 84 SER H A 53 CYS HG 1.0 16.25982976 26.25982976 311 169 A 86 HIS H A 53 CYS HG 1.0 16.15075011 26.15075011 312 170 A 90 VAL H A 53 CYS HG 1.0 12.34413961 22.34413961 313 171 A 91 GLN H A 53 CYS HG 1.0 13.58631081 23.58631081 314 172 A 92 SER H A 53 CYS HG 1.0 14.00279610 24.00279610 315 173 A 93 MET H A 53 CYS HG 1.0 10.50558697 20.50558697 316 174 A 95 ALA H A 53 CYS HG 1.0 11.42725833 21.42725833 317 175 A 97 THR H A 53 CYS HG 1.0 13.15283355 23.15283355 318 176 A 99 THR H A 53 CYS HG 1.0 14.01244727 24.01244727 319 177 A 100 SER H A 53 CYS HG 1.0 16.42095766 26.42095766 320 178 A 101 ASP H A 53 CYS HG 1.0 13.94362585 23.94362585 321 179 A 102 MET H A 53 CYS HG 1.0 12.23354984 22.23354984 322 180 A 103 GLU H A 53 CYS HG 1.0 14.34923972 24.34923972 323 181 A 104 ALA H A 53 CYS HG 1.0 15.66239404 25.66239404 324 182 A 105 VAL H A 53 CYS HG 1.0 11.73488863 21.73488863 325 183 A 106 TRP H A 53 CYS HG 1.0 14.27378613 24.27378613 326 184 A 107 LYS H A 53 CYS HG 1.0 15.57684698 25.57684698 327 185 A 108 GLU H A 53 CYS HG 1.0 16.03405463 26.03405463 328 186 A 109 ALA H A 53 CYS HG 1.0 14.54564773 24.54564773 329 187 A 110 LYS H A 53 CYS HG 1.0 12.60126695 22.60126695 330 188 A 112 GLU H A 53 CYS HG 1.0 13.92526467 23.92526467 331 189 A 113 ASP H A 53 CYS HG 1.0 13.15107154 23.15107154 332 190 A 114 LEU H A 53 CYS HG 1.0 11.32570830 21.32570830 333 191 A 115 MET H A 53 CYS HG 1.0 13.38497796 23.38497796 334 192 A 117 SER H A 53 CYS HG 1.0 13.75275704 23.75275704 335 193 A 118 LYS H A 53 CYS HG 1.0 13.76062221 23.76062221 336 194 A 17 LYS H A 53 CYS HG 1.0 5.00000000 15.00000000 337 195 A 53 CYS HG A 30 LEU H 1.0 5.00000000 15.00000000 338 196 A 33 GLY H A 53 CYS HG 1.0 5.00000000 15.00000000 339 197 A 37 ASP H A 53 CYS HG 1.0 5.00000000 15.00000000 340 198 A 44 VAL H A 53 CYS HG 1.0 5.00000000 15.00000000 341 199 A 45 LYS H A 53 CYS HG 1.0 5.00000000 15.00000000 342 200 A 47 THR H A 53 CYS HG 1.0 5.00000000 15.00000000 343 201 A 48 ALA H A 53 CYS HG 1.0 5.00000000 15.00000000 344 202 A 58 SER H A 53 CYS HG 1.0 5.00000000 15.00000000 345 203 A 59 GLY H A 53 CYS HG 1.0 5.00000000 15.00000000 346 204 A 63 ALA H A 53 CYS HG 1.0 5.00000000 15.00000000 347 205 A 64 GLY H A 53 CYS HG 1.0 5.00000000 15.00000000 348 206 A 65 ALA H A 53 CYS HG 1.0 5.00000000 15.00000000 349 207 A 66 SER H A 53 CYS HG 1.0 5.00000000 15.00000000 350 208 A 69 VAL H A 53 CYS HG 1.0 5.00000000 15.00000000 351 209 A 70 SER H A 53 CYS HG 1.0 5.00000000 15.00000000 352 210 A 71 VAL H A 53 CYS HG 1.0 5.00000000 15.00000000 353 211 A 76 PHE H A 53 CYS HG 1.0 5.00000000 15.00000000 354 212 A 87 LYS H A 53 CYS HG 1.0 5.00000000 15.00000000 355 213 A 88 PHE H A 53 CYS HG 1.0 5.00000000 15.00000000 356 214 A 89 MET H A 53 CYS HG 1.0 7.00000000 17.00000000 357 215 A 98 ASP H A 53 CYS HG 1.0 7.80000000 17.80000000 358 216 A 116 ASP H A 53 CYS HG 1.0 7.50000000 17.50000000 359 217 A 9 SER H A 68 ASN HD2y 1.0 10.93040667 20.93040667 360 217 A 9 SER H A 68 ASN HD2x 1.0 10.93040667 20.93040667 361 218 A 10 LEU H A 68 ASN HD2y 1.0 10.29717610 20.29717610 362 218 A 10 LEU H A 68 ASN HD2x 1.0 10.29717610 20.29717610 363 219 A 13 GLN H A 68 ASN HD2y 1.0 10.62789825 20.62789825 364 219 A 13 GLN H A 68 ASN HD2x 1.0 10.62789825 20.62789825 365 220 A 14 HIS H A 68 ASN HD2y 1.0 11.88467420 21.88467420 366 220 A 14 HIS H A 68 ASN HD2x 1.0 11.88467420 21.88467420 367 221 A 15 GLU H A 68 ASN HD2y 1.0 9.63167091 19.63167091 368 221 A 15 GLU H A 68 ASN HD2x 1.0 9.63167091 19.63167091 369 222 A 18 PHE H A 68 ASN HD2y 1.0 11.29755550 21.29755550 370 222 A 18 PHE H A 68 ASN HD2x 1.0 11.29755550 21.29755550 371 223 A 20 GLY H A 68 ASN HD2y 1.0 15.51009270 25.51009270 372 223 A 20 GLY H A 68 ASN HD2x 1.0 15.51009270 25.51009270 373 224 A 26 VAL H A 68 ASN HD2y 1.0 11.57183620 21.57183620 374 224 A 26 VAL H A 68 ASN HD2x 1.0 11.57183620 21.57183620 375 225 A 27 THR H A 68 ASN HD2y 1.0 11.95346814 21.95346814 376 225 A 27 THR H A 68 ASN HD2x 1.0 11.95346814 21.95346814 377 226 A 28 THR H A 68 ASN HD2y 1.0 10.60831925 20.60831925 378 226 A 28 THR H A 68 ASN HD2x 1.0 10.60831925 20.60831925 379 227 A 32 LEU H A 68 ASN HD2y 1.0 11.46666177 21.46666177 380 227 A 32 LEU H A 68 ASN HD2x 1.0 11.46666177 21.46666177 381 228 A 34 ASN H A 68 ASN HD2y 1.0 13.57552053 23.57552053 382 228 A 34 ASN H A 68 ASN HD2x 1.0 13.57552053 23.57552053 383 229 A 36 THR H A 68 ASN HD2y 1.0 13.04372903 23.04372903 384 229 A 36 THR H A 68 ASN HD2x 1.0 13.04372903 23.04372903 385 230 A 37 ASP H A 68 ASN HD2y 1.0 11.45255231 21.45255231 386 230 A 37 ASP H A 68 ASN HD2x 1.0 11.45255231 21.45255231 387 231 A 38 ARG H A 68 ASN HD2y 1.0 13.74328002 23.74328002 388 231 A 38 ARG H A 68 ASN HD2x 1.0 13.74328002 23.74328002 389 232 A 39 ASN H A 68 ASN HD2y 1.0 13.69824913 23.69824913 390 232 A 39 ASN H A 68 ASN HD2x 1.0 13.69824913 23.69824913 391 233 A 42 PHE H A 68 ASN HD2y 1.0 12.24031622 22.24031622 392 233 A 42 PHE H A 68 ASN HD2x 1.0 12.24031622 22.24031622 393 234 A 43 LYS H A 68 ASN HD2y 1.0 12.03383736 22.03383736 394 234 A 43 LYS H A 68 ASN HD2x 1.0 12.03383736 22.03383736 395 235 A 44 VAL H A 68 ASN HD2y 1.0 9.36301203 19.36301203 396 235 A 44 VAL H A 68 ASN HD2x 1.0 9.36301203 19.36301203 397 236 A 46 THR H A 68 ASN HD2y 1.0 12.87896496 22.87896496 398 236 A 46 THR H A 68 ASN HD2x 1.0 12.87896496 22.87896496 399 237 A 48 ALA H A 68 ASN HD2y 1.0 10.46737206 20.46737206 400 237 A 48 ALA H A 68 ASN HD2x 1.0 10.46737206 20.46737206 401 238 A 53 CYS H A 68 ASN HD2y 1.0 13.08482304 23.08482304 402 238 A 53 CYS H A 68 ASN HD2x 1.0 13.08482304 23.08482304 403 239 A 58 SER H A 68 ASN HD2y 1.0 10.57827395 20.57827395 404 239 A 58 SER H A 68 ASN HD2x 1.0 10.57827395 20.57827395 405 240 A 59 GLY H A 68 ASN HD2y 1.0 16.44397935 26.44397935 406 240 A 59 GLY H A 68 ASN HD2x 1.0 16.44397935 26.44397935 407 241 A 60 ILE H A 68 ASN HD2y 1.0 14.18408807 24.18408807 408 241 A 60 ILE H A 68 ASN HD2x 1.0 14.18408807 24.18408807 409 242 A 62 ASP H A 68 ASN HD2y 1.0 10.33916671 20.33916671 410 242 A 62 ASP H A 68 ASN HD2x 1.0 10.33916671 20.33916671 411 243 A 63 ALA H A 68 ASN HD2y 1.0 15.06747714 25.06747714 412 243 A 63 ALA H A 68 ASN HD2x 1.0 15.06747714 25.06747714 413 244 A 81 ASN H A 68 ASN HD2y 1.0 12.72788993 22.72788993 414 244 A 81 ASN H A 68 ASN HD2x 1.0 12.72788993 22.72788993 415 245 A 82 GLU H A 68 ASN HD2y 1.0 12.97278238 22.97278238 416 245 A 82 GLU H A 68 ASN HD2x 1.0 12.97278238 22.97278238 417 246 A 84 SER H A 68 ASN HD2y 1.0 12.97655412 22.97655412 418 246 A 84 SER H A 68 ASN HD2x 1.0 12.97655412 22.97655412 419 247 A 85 LYS H A 68 ASN HD2y 1.0 12.57360310 22.57360310 420 247 A 85 LYS H A 68 ASN HD2x 1.0 12.57360310 22.57360310 421 248 A 86 HIS H A 68 ASN HD2y 1.0 11.45524477 21.45524477 422 248 A 86 HIS H A 68 ASN HD2x 1.0 11.45524477 21.45524477 423 249 A 92 SER H A 68 ASN HD2y 1.0 9.24138021 19.24138021 424 249 A 92 SER H A 68 ASN HD2x 1.0 9.24138021 19.24138021 425 250 A 97 THR H A 68 ASN HD2y 1.0 8.80365470 18.80365470 426 250 A 97 THR H A 68 ASN HD2x 1.0 8.80365470 18.80365470 427 251 A 99 THR H A 68 ASN HD2y 1.0 11.59666683 21.59666683 428 251 A 99 THR H A 68 ASN HD2x 1.0 11.59666683 21.59666683 429 252 A 100 SER H A 68 ASN HD2y 1.0 11.08265193 21.08265193 430 252 A 100 SER H A 68 ASN HD2x 1.0 11.08265193 21.08265193 431 253 A 101 ASP H A 68 ASN HD2y 1.0 10.27835201 20.27835201 432 253 A 101 ASP H A 68 ASN HD2x 1.0 10.27835201 20.27835201 433 254 A 102 MET H A 68 ASN HD2y 1.0 9.70029461 19.70029461 434 254 A 102 MET H A 68 ASN HD2x 1.0 9.70029461 19.70029461 435 255 A 103 GLU H A 68 ASN HD2y 1.0 10.74156107 20.74156107 436 255 A 103 GLU H A 68 ASN HD2x 1.0 10.74156107 20.74156107 437 256 A 104 ALA H A 68 ASN HD2y 1.0 12.00168614 22.00168614 438 256 A 104 ALA H A 68 ASN HD2x 1.0 12.00168614 22.00168614 439 257 A 105 VAL H A 68 ASN HD2y 1.0 9.16007708 19.16007708 440 257 A 105 VAL H A 68 ASN HD2x 1.0 9.16007708 19.16007708 441 258 A 106 TRP H A 68 ASN HD2y 1.0 11.77274713 21.77274713 442 258 A 106 TRP H A 68 ASN HD2x 1.0 11.77274713 21.77274713 443 259 A 107 LYS H A 68 ASN HD2y 1.0 11.53489246 21.53489246 444 259 A 107 LYS H A 68 ASN HD2x 1.0 11.53489246 21.53489246 445 260 A 108 GLU H A 68 ASN HD2y 1.0 11.14960671 21.14960671 446 260 A 108 GLU H A 68 ASN HD2x 1.0 11.14960671 21.14960671 447 261 A 109 ALA H A 68 ASN HD2y 1.0 10.83486261 20.83486261 448 261 A 109 ALA H A 68 ASN HD2x 1.0 10.83486261 20.83486261 449 262 A 110 LYS H A 68 ASN HD2y 1.0 11.92789495 21.92789495 450 262 A 110 LYS H A 68 ASN HD2x 1.0 11.92789495 21.92789495 451 263 A 112 GLU H A 68 ASN HD2y 1.0 10.34384520 20.34384520 452 263 A 112 GLU H A 68 ASN HD2x 1.0 10.34384520 20.34384520 453 264 A 113 ASP H A 68 ASN HD2y 1.0 11.45425436 21.45425436 454 264 A 113 ASP H A 68 ASN HD2x 1.0 11.45425436 21.45425436 455 265 A 114 LEU H A 68 ASN HD2y 1.0 10.66013351 20.66013351 456 265 A 114 LEU H A 68 ASN HD2x 1.0 10.66013351 20.66013351 457 266 A 115 MET H A 68 ASN HD2y 1.0 10.20952378 20.20952378 458 266 A 115 MET H A 68 ASN HD2x 1.0 10.20952378 20.20952378 459 267 A 118 LYS H A 68 ASN HD2y 1.0 10.43743718 20.43743718 460 267 A 118 LYS H A 68 ASN HD2x 1.0 10.43743718 20.43743718 461 268 A 119 LEU H A 68 ASN HD2y 1.0 11.79780031 21.79780031 462 268 A 119 LEU H A 68 ASN HD2x 1.0 11.79780031 21.79780031 463 269 A 120 ARG H A 68 ASN HD2y 1.0 12.51667786 22.51667786 464 269 A 120 ARG H A 68 ASN HD2x 1.0 12.51667786 22.51667786 465 270 A 124 GLU H A 68 ASN HD2y 1.0 12.92084526 22.92084526 466 270 A 124 GLU H A 68 ASN HD2x 1.0 12.92084526 22.92084526 467 271 A 2 ALA H A 68 ASN HD2y 1.0 5.00000000 15.00000000 468 271 A 2 ALA H A 68 ASN HD2x 1.0 5.00000000 15.00000000 469 272 A 5 GLU H A 68 ASN HD2y 1.0 5.00000000 15.00000000 470 272 A 5 GLU H A 68 ASN HD2x 1.0 5.00000000 15.00000000 471 273 A 11 GLU H A 68 ASN HD2y 1.0 7.00000000 17.00000000 472 273 A 11 GLU H A 68 ASN HD2x 1.0 7.00000000 17.00000000 473 274 A 16 LEU H A 68 ASN HD2y 1.0 5.00000000 15.00000000 474 274 A 16 LEU H A 68 ASN HD2x 1.0 5.00000000 15.00000000 475 275 A 17 LYS H A 68 ASN HD2y 1.0 5.00000000 15.00000000 476 275 A 17 LYS H A 68 ASN HD2x 1.0 5.00000000 15.00000000 477 276 A 22 PHE H A 68 ASN HD2y 1.0 5.00000000 15.00000000 478 276 A 22 PHE H A 68 ASN HD2x 1.0 5.00000000 15.00000000 479 277 A 23 THR H A 68 ASN HD2y 1.0 5.00000000 15.00000000 480 277 A 23 THR H A 68 ASN HD2x 1.0 5.00000000 15.00000000 481 278 A 33 GLY H A 68 ASN HD2y 1.0 5.00000000 15.00000000 482 278 A 33 GLY H A 68 ASN HD2x 1.0 5.00000000 15.00000000 483 279 A 45 LYS H A 68 ASN HD2y 1.0 5.00000000 15.00000000 484 279 A 45 LYS H A 68 ASN HD2x 1.0 5.00000000 15.00000000 485 280 A 47 THR H A 68 ASN HD2y 1.0 5.00000000 15.00000000 486 280 A 47 THR H A 68 ASN HD2x 1.0 5.00000000 15.00000000 487 281 A 55 ARG H A 68 ASN HD2y 1.0 5.00000000 15.00000000 488 281 A 55 ARG H A 68 ASN HD2x 1.0 5.00000000 15.00000000 489 282 A 56 SER H A 68 ASN HD2y 1.0 5.00000000 15.00000000 490 282 A 56 SER H A 68 ASN HD2x 1.0 5.00000000 15.00000000 491 283 A 57 ASN H A 68 ASN HD2y 1.0 6.00000000 16.00000000 492 283 A 57 ASN H A 68 ASN HD2x 1.0 6.00000000 16.00000000 493 284 A 74 GLN H A 68 ASN HD2y 1.0 5.00000000 15.00000000 494 284 A 74 GLN H A 68 ASN HD2x 1.0 5.00000000 15.00000000 495 285 A 78 TYR H A 68 ASN HD2y 1.0 5.00000000 15.00000000 496 285 A 78 TYR H A 68 ASN HD2x 1.0 5.00000000 15.00000000 497 286 A 79 ASP H A 68 ASN HD2y 1.0 5.00000000 15.00000000 498 286 A 79 ASP H A 68 ASN HD2x 1.0 5.00000000 15.00000000 499 287 A 87 LYS H A 68 ASN HD2y 1.0 5.00000000 15.00000000 500 287 A 87 LYS H A 68 ASN HD2x 1.0 5.00000000 15.00000000 501 288 A 88 PHE H A 68 ASN HD2y 1.0 5.00000000 15.00000000 502 288 A 88 PHE H A 68 ASN HD2x 1.0 5.00000000 15.00000000 503 289 A 89 MET H A 68 ASN HD2y 1.0 5.00000000 15.00000000 504 289 A 89 MET H A 68 ASN HD2x 1.0 5.00000000 15.00000000 505 290 A 90 VAL H A 68 ASN HD2y 1.0 5.00000000 15.00000000 506 290 A 90 VAL H A 68 ASN HD2x 1.0 5.00000000 15.00000000 507 291 A 91 GLN H A 68 ASN HD2y 1.0 5.00000000 15.00000000 508 291 A 91 GLN H A 68 ASN HD2x 1.0 5.00000000 15.00000000 509 292 A 93 MET H A 68 ASN HD2y 1.0 5.00000000 15.00000000 510 292 A 93 MET H A 68 ASN HD2x 1.0 5.00000000 15.00000000 511 293 A 94 PHE H A 68 ASN HD2y 1.0 5.00000000 15.00000000 512 293 A 94 PHE H A 68 ASN HD2x 1.0 5.00000000 15.00000000 513 294 A 95 ALA H A 68 ASN HD2y 1.0 5.00000000 15.00000000 514 294 A 95 ALA H A 68 ASN HD2x 1.0 5.00000000 15.00000000 515 295 A 116 ASP H A 68 ASN HD2y 1.0 5.00000000 15.00000000 516 295 A 116 ASP H A 68 ASN HD2x 1.0 5.00000000 15.00000000 517 296 A 117 SER H A 68 ASN HD2y 1.0 5.00000000 15.00000000 518 296 A 117 SER H A 68 ASN HD2x 1.0 5.00000000 15.00000000 519 297 A 121 CYS H A 68 ASN HD2y 1.0 5.00000000 15.00000000 520 297 A 121 CYS H A 68 ASN HD2x 1.0 5.00000000 15.00000000 521 298 A 125 LEU H A 68 ASN HD2y 1.0 5.00000000 15.00000000 522 298 A 125 LEU H A 68 ASN HD2x 1.0 5.00000000 15.00000000 523 299 A 2 ALA H A 89 MET HE1 1.0 16.28725807 26.28725807 524 300 A 5 GLU H A 89 MET HE1 1.0 18.04958734 28.04958734 525 301 A 10 LEU H A 89 MET HE1 1.0 15.84177371 25.84177371 526 302 A 11 GLU H A 89 MET HE1 1.0 19.26564040 29.26564040 527 303 A 13 GLN H A 89 MET HE1 1.0 15.49047152 25.49047152 528 304 A 14 HIS H A 89 MET HE1 1.0 19.44837180 29.44837180 529 305 A 15 GLU H A 89 MET HE1 1.0 18.89305647 28.89305647 530 306 A 16 LEU H A 89 MET HE1 1.0 11.90249793 21.90249793 531 307 A 17 LYS H A 89 MET HE1 1.0 12.32299510 22.32299510 532 308 A 20 GLY H A 89 MET HE1 1.0 19.13290012 29.13290012 533 309 A 22 PHE H A 89 MET HE1 1.0 13.97019715 23.97019715 534 310 A 23 THR H A 89 MET HE1 1.0 16.09327621 26.09327621 535 311 A 26 VAL H A 89 MET HE1 1.0 18.56618512 28.56618512 536 312 A 27 THR H A 89 MET HE1 1.0 19.50343268 29.50343268 537 313 A 32 LEU H A 89 MET HE1 1.0 17.20128141 27.20128141 538 314 A 33 GLY H A 89 MET HE1 1.0 13.71263857 23.71263857 539 315 A 34 ASN H A 89 MET HE1 1.0 20.62786841 30.62786841 540 316 A 36 THR H A 89 MET HE1 1.0 20.68464413 30.68464413 541 317 A 37 ASP H A 89 MET HE1 1.0 14.44331612 24.44331612 542 318 A 38 ARG H A 89 MET HE1 1.0 20.23574884 30.23574884 543 319 A 39 ASN H A 89 MET HE1 1.0 22.07662124 32.07662124 544 320 A 42 PHE H A 89 MET HE1 1.0 14.92161951 24.92161951 545 321 A 43 LYS H A 89 MET HE1 1.0 15.97231167 25.97231167 546 322 A 44 VAL H A 89 MET HE1 1.0 16.34920862 26.34920862 547 323 A 45 LYS H A 89 MET HE1 1.0 14.48156874 24.48156874 548 324 A 46 THR H A 89 MET HE1 1.0 11.31373057 21.31373057 549 325 A 47 THR H A 89 MET HE1 1.0 18.52264857 28.52264857 550 326 A 48 ALA H A 89 MET HE1 1.0 18.10128493 28.10128493 551 327 A 53 CYS H A 89 MET HE1 1.0 19.49841750 29.49841750 552 328 A 55 ARG H A 89 MET HE1 1.0 13.75565236 23.75565236 553 329 A 56 SER H A 89 MET HE1 1.0 16.10774512 26.10774512 554 330 A 57 ASN H A 89 MET HE1 1.0 16.47021351 26.47021351 555 331 A 58 SER H A 89 MET HE1 1.0 19.23174400 29.23174400 556 332 A 59 GLY H A 89 MET HE1 1.0 16.80233171 26.80233171 557 333 A 60 ILE H A 89 MET HE1 1.0 13.29029622 23.29029622 558 334 A 62 ASP H A 89 MET HE1 1.0 11.44082423 21.44082423 559 335 A 63 ALA H A 89 MET HE1 1.0 14.98339541 24.98339541 560 336 A 64 GLY H A 89 MET HE1 1.0 14.92544176 24.92544176 561 337 A 65 ALA H A 89 MET HE1 1.0 14.16969243 24.16969243 562 338 A 66 SER H A 89 MET HE1 1.0 13.90772616 23.90772616 563 339 A 67 ILE H A 89 MET HE1 1.0 11.17323361 21.17323361 564 340 A 69 VAL H A 89 MET HE1 1.0 9.18329561 19.18329561 565 341 A 70 SER H A 89 MET HE1 1.0 8.68480616 18.68480616 566 342 A 71 VAL H A 89 MET HE1 1.0 11.92382570 21.92382570 567 343 A 81 ASN H A 89 MET HE1 1.0 11.07739044 21.07739044 568 344 A 82 GLU H A 89 MET HE1 1.0 11.99833936 21.99833936 569 345 A 84 SER H A 89 MET HE1 1.0 18.91824631 28.91824631 570 346 A 85 LYS H A 89 MET HE1 1.0 16.96883320 26.96883320 571 347 A 93 MET H A 89 MET HE1 1.0 11.00684617 21.00684617 572 348 A 94 PHE H A 89 MET HE1 1.0 12.22238626 22.22238626 573 349 A 95 ALA H A 89 MET HE1 1.0 12.71158030 22.71158030 574 350 A 98 ASP H A 89 MET HE1 1.0 11.22572377 21.22572377 575 351 A 99 THR H A 89 MET HE1 1.0 10.02428818 20.02428818 576 352 A 100 SER H A 89 MET HE1 1.0 10.09967771 20.09967771 577 353 A 101 ASP H A 89 MET HE1 1.0 8.98436511 18.98436511 578 354 A 102 MET H A 89 MET HE1 1.0 9.13301507 19.13301507 579 355 A 103 GLU H A 89 MET HE1 1.0 9.95526218 19.95526218 580 356 A 104 ALA H A 89 MET HE1 1.0 11.76246400 21.76246400 581 357 A 105 VAL H A 89 MET HE1 1.0 8.92229836 18.92229836 582 358 A 106 TRP H A 89 MET HE1 1.0 12.41051267 22.41051267 583 359 A 107 LYS H A 89 MET HE1 1.0 12.07396943 22.07396943 584 360 A 109 ALA H A 89 MET HE1 1.0 12.06265330 22.06265330 585 361 A 110 LYS H A 89 MET HE1 1.0 15.65955207 25.65955207 586 362 A 112 GLU H A 89 MET HE1 1.0 11.90123394 21.90123394 587 363 A 113 ASP H A 89 MET HE1 1.0 12.43015203 22.43015203 588 364 A 114 LEU H A 89 MET HE1 1.0 14.90671642 24.90671642 589 365 A 115 MET H A 89 MET HE1 1.0 10.77695787 20.77695787 590 366 A 116 ASP H A 89 MET HE1 1.0 13.44917980 23.44917980 591 367 A 117 SER H A 89 MET HE1 1.0 11.94734767 21.94734767 592 368 A 118 LYS H A 89 MET HE1 1.0 12.06136438 22.06136438 593 369 A 124 GLU H A 89 MET HE1 1.0 18.01665327 28.01665327 594 370 A 3 LYS H A 89 MET HE1 1.0 5.00000000 15.00000000 595 371 A 18 PHE H A 89 MET HE1 1.0 10.00000000 20.00000000 596 372 A 54 VAL H A 89 MET HE1 1.0 9.00000000 19.00000000 597 373 A 68 ASN H A 89 MET HE1 1.0 5.00000000 15.00000000 598 374 A 78 TYR H A 89 MET HE1 1.0 5.00000000 15.00000000 599 375 A 79 ASP H A 89 MET HE1 1.0 5.00000000 15.00000000 600 376 A 97 THR H A 89 MET HE1 1.0 5.00000000 15.00000000 601 377 A 108 GLU H A 89 MET HE1 1.0 6.00000000 16.00000000 602 378 A 5 GLU H A 102 MET HE% 1.0 13.37829328 23.37829328 603 379 A 11 GLU H A 102 MET HE% 1.0 14.60989261 24.60989261 604 380 A 13 GLN H A 102 MET HE% 1.0 12.86112033 22.86112033 605 381 A 16 LEU H A 102 MET HE% 1.0 10.28543807 20.28543807 606 382 A 17 LYS H A 102 MET HE% 1.0 10.84400022 20.84400022 607 383 A 20 GLY H A 102 MET HE% 1.0 15.45083461 25.45083461 608 384 A 22 PHE H A 102 MET HE% 1.0 13.38167618 23.38167618 609 385 A 23 THR H A 102 MET HE% 1.0 13.47223291 23.47223291 610 386 A 26 VAL H A 102 MET HE% 1.0 14.09232918 24.09232918 611 387 A 27 THR H A 102 MET HE% 1.0 11.24241523 21.24241523 612 388 A 30 LEU H A 102 MET HE% 1.0 10.13213140 20.13213140 613 389 A 32 LEU H A 102 MET HE% 1.0 12.09507077 22.09507077 614 390 A 33 GLY H A 102 MET HE% 1.0 12.23692951 22.23692951 615 391 A 34 ASN H A 102 MET HE% 1.0 16.78627664 26.78627664 616 392 A 36 THR H A 102 MET HE% 1.0 15.78442770 25.78442770 617 393 A 37 ASP H A 102 MET HE% 1.0 13.22649326 23.22649326 618 394 A 38 ARG H A 102 MET HE% 1.0 17.37537511 27.37537511 619 395 A 39 ASN H A 102 MET HE% 1.0 16.95469914 26.95469914 620 396 A 42 PHE H A 102 MET HE% 1.0 14.61765421 24.61765421 621 397 A 43 LYS H A 102 MET HE% 1.0 15.98147881 25.98147881 622 398 A 44 VAL H A 102 MET HE% 1.0 13.84080583 23.84080583 623 399 A 45 LYS H A 102 MET HE% 1.0 11.46002295 21.46002295 624 400 A 46 THR H A 102 MET HE% 1.0 14.91913732 24.91913732 625 401 A 47 THR H A 102 MET HE% 1.0 14.90906421 24.90906421 626 402 A 48 ALA H A 102 MET HE% 1.0 15.07510436 25.07510436 627 403 A 53 CYS H A 102 MET HE% 1.0 13.02204678 23.02204678 628 404 A 55 ARG H A 102 MET HE% 1.0 11.23924444 21.23924444 629 405 A 56 SER H A 102 MET HE% 1.0 14.06020931 24.06020931 630 406 A 57 ASN H A 102 MET HE% 1.0 14.35330061 24.35330061 631 407 A 58 SER H A 102 MET HE% 1.0 15.78828733 25.78828733 632 408 A 59 GLY H A 102 MET HE% 1.0 14.37747460 24.37747460 633 409 A 60 ILE H A 102 MET HE% 1.0 13.84382043 23.84382043 634 410 A 62 ASP H A 102 MET HE% 1.0 11.33288961 21.33288961 635 411 A 63 ALA H A 102 MET HE% 1.0 12.63258661 22.63258661 636 412 A 64 GLY H A 102 MET HE% 1.0 12.50978285 22.50978285 637 413 A 65 ALA H A 102 MET HE% 1.0 11.96209516 21.96209516 638 414 A 66 SER H A 102 MET HE% 1.0 11.65869203 21.65869203 639 415 A 67 ILE H A 102 MET HE% 1.0 9.62937083 19.62937083 640 416 A 70 SER H A 102 MET HE% 1.0 8.08554082 18.08554082 641 417 A 71 VAL H A 102 MET HE% 1.0 11.72867920 21.72867920 642 418 A 78 TYR H A 102 MET HE% 1.0 10.81498494 20.81498494 643 419 A 79 ASP H A 102 MET HE% 1.0 12.20431557 22.20431557 644 420 A 81 ASN H A 102 MET HE% 1.0 14.49544984 24.49544984 645 421 A 82 GLU H A 102 MET HE% 1.0 15.44155246 25.44155246 646 422 A 84 SER H A 102 MET HE% 1.0 11.58872622 21.58872622 647 423 A 85 LYS H A 102 MET HE% 1.0 14.19304130 24.19304130 648 424 A 86 HIS H A 102 MET HE% 1.0 13.40813257 23.40813257 649 425 A 95 ALA H A 102 MET HE% 1.0 10.64329807 20.64329807 650 426 A 108 GLU H A 102 MET HE% 1.0 9.86645611 19.86645611 651 427 A 110 LYS H A 102 MET HE% 1.0 14.41539461 24.41539461 652 428 A 113 ASP H A 102 MET HE% 1.0 11.22202580 21.22202580 653 429 A 114 LEU H A 102 MET HE% 1.0 13.06353565 23.06353565 654 430 A 116 ASP H A 102 MET HE% 1.0 11.71458692 21.71458692 655 431 A 117 SER H A 102 MET HE% 1.0 11.86049887 21.86049887 656 432 A 119 LEU H A 102 MET HE% 1.0 11.38017383 21.38017383 657 433 A 120 ARG H A 102 MET HE% 1.0 11.90180521 21.90180521 658 434 A 124 GLU H A 102 MET HE% 1.0 12.95236893 22.95236893 659 435 A 14 HIS H A 102 MET HE% 1.0 5.00000000 15.00000000 660 436 A 15 GLU H A 102 MET HE% 1.0 5.00000000 15.00000000 661 437 A 68 ASN H A 102 MET HE% 1.0 5.00000000 15.00000000 662 438 A 69 VAL H A 102 MET HE% 1.0 5.00000000 15.00000000 663 439 A 76 PHE H A 102 MET HE% 1.0 5.00000000 15.00000000 664 440 A 88 PHE H A 102 MET HE% 1.0 5.00000000 15.00000000 665 441 A 89 MET H A 102 MET HE% 1.0 5.00000000 15.00000000 666 442 A 90 VAL H A 102 MET HE% 1.0 5.00000000 15.00000000 667 443 A 91 GLN H A 102 MET HE% 1.0 5.00000000 15.00000000 668 444 A 92 SER H A 102 MET HE% 1.0 5.00000000 15.00000000 669 445 A 93 MET H A 102 MET HE% 1.0 5.00000000 15.00000000 670 446 A 94 PHE H A 102 MET HE% 1.0 5.00000000 15.00000000 671 447 A 97 THR H A 102 MET HE% 1.0 5.00000000 15.00000000 672 448 A 109 ALA H A 102 MET HE% 1.0 5.00000000 15.00000000 673 449 A 112 GLU H A 102 MET HE% 1.0 5.00000000 15.00000000 674 450 A 118 LYS H A 102 MET HE% 1.0 5.00000000 15.00000000 675 451 A 122 VAL H A 102 MET HE% 1.0 5.00000000 15.00000000 676 452 A 123 PHE H A 102 MET HE% 1.0 5.00000000 15.00000000 677 453 A 2 ALA H A 121 CYS HG 1.0 17.12155222 27.12155222 678 454 A 4 VAL H A 121 CYS HG 1.0 16.64768490 26.64768490 679 455 A 30 LEU H A 121 CYS HG 1.0 18.56047139 28.56047139 680 456 A 60 ILE H A 121 CYS HG 1.0 16.57104275 26.57104275 681 457 A 63 ALA H A 121 CYS HG 1.0 17.73079201 27.73079201 682 458 A 64 GLY H A 121 CYS HG 1.0 18.97187055 28.97187055 683 459 A 65 ALA H A 121 CYS HG 1.0 18.46964963 28.46964963 684 460 A 66 SER H A 121 CYS HG 1.0 17.90672763 27.90672763 685 461 A 67 ILE H A 121 CYS HG 1.0 16.15448676 26.15448676 686 462 A 68 ASN H A 121 CYS HG 1.0 13.93654806 23.93654806 687 463 A 69 VAL H A 121 CYS HG 1.0 16.62527403 26.62527403 688 464 A 70 SER H A 121 CYS HG 1.0 15.67880978 25.67880978 stop_ save_ save_CNS/XPLOR_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_2 _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 3 LYS C A 4 VAL N A 4 VAL CA A 4 VAL C 1.0 -93.00 -53.00 PHI 2 2 A 4 VAL N A 4 VAL CA A 4 VAL C A 5 GLU N 1.0 -43.00 -13.00 PSI 3 3 A 4 VAL C A 5 GLU N A 5 GLU CA A 5 GLU C 1.0 -82.92 -57.40 PHI 4 4 A 5 GLU N A 5 GLU CA A 5 GLU C A 6 GLN N 1.0 -48.96 -18.54 PSI 5 5 A 5 GLU C A 6 GLN N A 6 GLN CA A 6 GLN C 1.0 -69.45 -55.87 PHI 6 6 A 6 GLN N A 6 GLN CA A 6 GLN C A 7 VAL N 1.0 -48.96 -18.54 PSI 7 7 A 6 GLN C A 7 VAL N A 7 VAL CA A 7 VAL C 1.0 -82.92 -57.40 PHI 8 8 A 7 VAL N A 7 VAL CA A 7 VAL C A 8 LEU N 1.0 -48.96 -18.54 PSI 9 9 A 7 VAL C A 8 LEU N A 8 LEU CA A 8 LEU C 1.0 -82.92 -57.40 PHI 10 10 A 8 LEU N A 8 LEU CA A 8 LEU C A 9 SER N 1.0 -48.96 -18.54 PSI 11 11 A 9 SER C A 10 LEU N A 10 LEU CA A 10 LEU C 1.0 -82.92 -57.40 PHI 12 12 A 10 LEU N A 10 LEU CA A 10 LEU C A 11 GLU N 1.0 -48.96 -18.54 PSI 13 13 A 10 LEU C A 11 GLU N A 11 GLU CA A 11 GLU C 1.0 -97.61 -66.39 PHI 14 14 A 11 GLU N A 11 GLU CA A 11 GLU C A 12 PRO N 1.0 -48.96 -18.54 PSI 15 15 A 12 PRO C A 13 GLN N A 13 GLN CA A 13 GLN C 1.0 -94.61 -63.39 PHI 16 16 A 13 GLN N A 13 GLN CA A 13 GLN C A 14 HIS N 1.0 -48.96 -18.54 PSI 17 17 A 21 PRO C A 22 PHE N A 22 PHE CA A 22 PHE C 1.0 -69.10 -57.90 PHI 18 18 A 22 PHE N A 22 PHE CA A 22 PHE C A 23 THR N 1.0 -56.00 -22.00 PSI 19 19 A 22 PHE C A 23 THR N A 23 THR CA A 23 THR C 1.0 -69.10 -57.90 PHI 20 20 A 23 THR N A 23 THR CA A 23 THR C A 24 ASP N 1.0 -50.30 -33.68 PSI 21 21 A 23 THR C A 24 ASP N A 24 ASP CA A 24 ASP C 1.0 -69.10 -57.90 PHI 22 22 A 24 ASP N A 24 ASP CA A 24 ASP C A 25 VAL N 1.0 -50.30 -33.68 PSI 23 23 A 24 ASP C A 25 VAL N A 25 VAL CA A 25 VAL C 1.0 -69.10 -57.90 PHI 24 24 A 25 VAL N A 25 VAL CA A 25 VAL C A 26 VAL N 1.0 -50.30 -33.68 PSI 25 25 A 25 VAL C A 26 VAL N A 26 VAL CA A 26 VAL C 1.0 -69.10 -57.90 PHI 26 26 A 26 VAL N A 26 VAL CA A 26 VAL C A 27 THR N 1.0 -50.30 -33.68 PSI 27 27 A 26 VAL C A 27 THR N A 27 THR CA A 27 THR C 1.0 -69.10 -57.90 PHI 28 28 A 27 THR N A 27 THR CA A 27 THR C A 28 THR N 1.0 -50.30 -33.68 PSI 29 29 A 27 THR C A 28 THR N A 28 THR CA A 28 THR C 1.0 -69.10 -57.90 PHI 30 30 A 28 THR N A 28 THR CA A 28 THR C A 29 ASN N 1.0 -50.30 -33.68 PSI 31 31 A 28 THR C A 29 ASN N A 29 ASN CA A 29 ASN C 1.0 -69.10 -57.90 PHI 32 32 A 29 ASN N A 29 ASN CA A 29 ASN C A 30 LEU N 1.0 -50.30 -33.68 PSI 33 33 A 29 ASN C A 30 LEU N A 30 LEU CA A 30 LEU C 1.0 -69.10 -57.90 PHI 34 34 A 30 LEU N A 30 LEU CA A 30 LEU C A 31 LYS N 1.0 -50.30 -33.68 PSI 35 35 A 30 LEU C A 31 LYS N A 31 LYS CA A 31 LYS C 1.0 -94.00 -74.00 PHI 36 36 A 56 SER C A 57 ASN N A 57 ASN CA A 57 ASN C 1.0 -85.00 -65.00 PHI 37 37 A 57 ASN N A 57 ASN CA A 57 ASN C A 58 SER N 1.0 -33.00 -15.00 PSI 38 38 A 57 ASN C A 58 SER N A 58 SER CA A 58 SER C 1.0 -85.00 -65.00 PHI 39 39 A 58 SER N A 58 SER CA A 58 SER C A 59 GLY N 1.0 -33.00 -15.00 PSI 40 40 A 60 ILE C A 61 ILE N A 61 ILE CA A 61 ILE C 1.0 -85.00 -65.00 PHI 41 41 A 61 ILE N A 61 ILE CA A 61 ILE C A 62 ASP N 1.0 -33.00 -15.00 PSI 42 42 A 61 ILE C A 62 ASP N A 62 ASP CA A 62 ASP C 1.0 -85.00 -65.00 PHI 43 43 A 62 ASP N A 62 ASP CA A 62 ASP C A 63 ALA N 1.0 -33.00 -15.00 PSI 44 44 A 62 ASP C A 63 ALA N A 63 ALA CA A 63 ALA C 1.0 -85.00 -65.00 PHI 45 45 A 63 ALA N A 63 ALA CA A 63 ALA C A 64 GLY N 1.0 -33.00 -15.00 PSI 46 46 A 66 SER C A 67 ILE N A 67 ILE CA A 67 ILE C 1.0 -85.00 -65.00 PHI 47 47 A 67 ILE N A 67 ILE CA A 67 ILE C A 68 ASN N 1.0 -33.00 -15.00 PSI 48 48 A 68 ASN C A 69 VAL N A 69 VAL CA A 69 VAL C 1.0 -85.00 -65.00 PHI 49 49 A 69 VAL N A 69 VAL CA A 69 VAL C A 70 SER N 1.0 -33.00 -15.00 PSI 50 50 A 69 VAL C A 70 SER N A 70 SER CA A 70 SER C 1.0 -87.00 -55.00 PHI 51 51 A 70 SER N A 70 SER CA A 70 SER C A 71 VAL N 1.0 -46.00 -14.00 PSI 52 52 A 81 ASN C A 82 GLU N A 82 GLU CA A 82 GLU C 1.0 -74.00 -62.00 PHI 53 53 A 82 GLU N A 82 GLU CA A 82 GLU C A 83 LYS N 1.0 -48.00 -18.00 PSI 54 54 A 82 GLU C A 83 LYS N A 83 LYS CA A 83 LYS C 1.0 -74.00 -62.00 PHI 55 55 A 83 LYS N A 83 LYS CA A 83 LYS C A 84 SER N 1.0 -48.00 -18.00 PSI 56 56 A 83 LYS C A 84 SER N A 84 SER CA A 84 SER C 1.0 -74.00 -62.00 PHI 57 57 A 84 SER N A 84 SER CA A 84 SER C A 85 LYS N 1.0 -48.00 -18.00 PSI 58 58 A 87 LYS C A 88 PHE N A 88 PHE CA A 88 PHE C 1.0 -74.00 -62.00 PHI 59 59 A 88 PHE N A 88 PHE CA A 88 PHE C A 89 MET N 1.0 -48.00 -18.00 PSI 60 60 A 88 PHE C A 89 MET N A 89 MET CA A 89 MET C 1.0 -74.00 -62.00 PHI 61 61 A 89 MET N A 89 MET CA A 89 MET C A 90 VAL N 1.0 -48.00 -18.00 PSI 62 62 A 89 MET C A 90 VAL N A 90 VAL CA A 90 VAL C 1.0 -74.00 -62.00 PHI 63 63 A 90 VAL N A 90 VAL CA A 90 VAL C A 91 GLN N 1.0 -48.00 -18.00 PSI 64 64 A 90 VAL C A 91 GLN N A 91 GLN CA A 91 GLN C 1.0 -74.00 -62.00 PHI 65 65 A 91 GLN N A 91 GLN CA A 91 GLN C A 92 SER N 1.0 -48.00 -18.00 PSI 66 66 A 91 GLN C A 92 SER N A 92 SER CA A 92 SER C 1.0 -74.00 -62.00 PHI 67 67 A 92 SER N A 92 SER CA A 92 SER C A 93 MET N 1.0 -48.00 -18.00 PSI 68 68 A 92 SER C A 93 MET N A 93 MET CA A 93 MET C 1.0 -74.00 -62.00 PHI 69 69 A 93 MET N A 93 MET CA A 93 MET C A 94 PHE N 1.0 -48.00 -18.00 PSI 70 70 A 96 PRO C A 97 THR N A 97 THR CA A 97 THR C 1.0 -69.10 -57.90 PHI 71 71 A 97 THR N A 97 THR CA A 97 THR C A 98 ASP N 1.0 -53.96 -23.54 PSI 72 72 A 97 THR C A 98 ASP N A 98 ASP CA A 98 ASP C 1.0 -69.10 -57.90 PHI 73 73 A 98 ASP N A 98 ASP CA A 98 ASP C A 99 THR N 1.0 -53.96 -23.54 PSI 74 74 A 98 ASP C A 99 THR N A 99 THR CA A 99 THR C 1.0 -69.10 -57.90 PHI 75 75 A 99 THR N A 99 THR CA A 99 THR C A 100 SER N 1.0 -53.96 -23.54 PSI 76 76 A 99 THR C A 100 SER N A 100 SER CA A 100 SER C 1.0 -69.10 -57.90 PHI 77 77 A 100 SER N A 100 SER CA A 100 SER C A 101 ASP N 1.0 -53.96 -23.54 PSI 78 78 A 100 SER C A 101 ASP N A 101 ASP CA A 101 ASP C 1.0 -69.10 -57.90 PHI 79 79 A 101 ASP N A 101 ASP CA A 101 ASP C A 102 MET N 1.0 -53.96 -23.54 PSI 80 80 A 101 ASP C A 102 MET N A 102 MET CA A 102 MET C 1.0 -69.10 -57.90 PHI 81 81 A 102 MET N A 102 MET CA A 102 MET C A 103 GLU N 1.0 -53.96 -23.54 PSI 82 82 A 102 MET C A 103 GLU N A 103 GLU CA A 103 GLU C 1.0 -69.10 -57.90 PHI 83 83 A 103 GLU N A 103 GLU CA A 103 GLU C A 104 ALA N 1.0 -53.96 -23.54 PSI 84 84 A 103 GLU C A 104 ALA N A 104 ALA CA A 104 ALA C 1.0 -69.10 -57.90 PHI 85 85 A 104 ALA N A 104 ALA CA A 104 ALA C A 105 VAL N 1.0 -53.96 -23.54 PSI 86 86 A 104 ALA C A 105 VAL N A 105 VAL CA A 105 VAL C 1.0 -69.10 -57.90 PHI 87 87 A 105 VAL N A 105 VAL CA A 105 VAL C A 106 TRP N 1.0 -53.96 -23.54 PSI 88 88 A 105 VAL C A 106 TRP N A 106 TRP CA A 106 TRP C 1.0 -82.92 -57.40 PHI 89 89 A 106 TRP N A 106 TRP CA A 106 TRP C A 107 LYS N 1.0 -48.96 -18.54 PSI 90 90 A 109 ALA C A 110 LYS N A 110 LYS CA A 110 LYS C 1.0 -94.00 -54.00 PHI 91 91 A 110 LYS N A 110 LYS CA A 110 LYS C A 111 PRO N 1.0 -48.96 -18.54 PSI 92 92 A 111 PRO C A 112 GLU N A 112 GLU CA A 112 GLU C 1.0 -74.00 -56.00 PHI 93 93 A 112 GLU N A 112 GLU CA A 112 GLU C A 113 ASP N 1.0 -50.30 -33.68 PSI 94 94 A 112 GLU C A 113 ASP N A 113 ASP CA A 113 ASP C 1.0 -101.00 -65.00 PHI 95 95 A 113 ASP N A 113 ASP CA A 113 ASP C A 114 LEU N 1.0 -50.30 -33.68 PSI 96 96 A 113 ASP C A 114 LEU N A 114 LEU CA A 114 LEU C 1.0 -90.00 -54.00 PHI 97 97 A 114 LEU N A 114 LEU CA A 114 LEU C A 115 MET N 1.0 -50.30 -33.68 PSI 98 98 A 114 LEU C A 115 MET N A 115 MET CA A 115 MET C 1.0 -73.58 -58.00 PHI 99 99 A 115 MET N A 115 MET CA A 115 MET C A 116 ASP N 1.0 -50.30 -33.68 PSI 100 100 A 115 MET C A 116 ASP N A 116 ASP CA A 116 ASP C 1.0 -72.22 -59.16 PHI 101 101 A 116 ASP N A 116 ASP CA A 116 ASP C A 117 SER N 1.0 -47.03 -31.71 PSI 102 102 A 116 ASP C A 117 SER N A 117 SER CA A 117 SER C 1.0 -69.31 -56.89 PHI 103 103 A 117 SER N A 117 SER CA A 117 SER C A 118 LYS N 1.0 -49.40 -36.26 PSI 104 104 A 117 SER C A 118 LYS N A 118 LYS CA A 118 LYS C 1.0 -64.49 -56.95 PHI 105 105 A 118 LYS N A 118 LYS CA A 118 LYS C A 119 LEU N 1.0 -47.83 -30.33 PSI 106 106 A 118 LYS C A 119 LEU N A 119 LEU CA A 119 LEU C 1.0 -71.00 -59.00 PHI 107 107 A 119 LEU N A 119 LEU CA A 119 LEU C A 120 ARG N 1.0 -50.30 -33.68 PSI 108 108 A 119 LEU C A 120 ARG N A 120 ARG CA A 120 ARG C 1.0 -71.51 -56.95 PHI 109 109 A 120 ARG N A 120 ARG CA A 120 ARG C A 121 CYS N 1.0 -50.30 -33.68 PSI 110 110 A 120 ARG C A 121 CYS N A 121 CYS CA A 121 CYS C 1.0 -69.10 -57.90 PHI 111 111 A 121 CYS N A 121 CYS CA A 121 CYS C A 122 VAL N 1.0 -50.30 -33.68 PSI 112 112 A 121 CYS C A 122 VAL N A 122 VAL CA A 122 VAL C 1.0 -74.82 -61.28 PHI 113 113 A 122 VAL N A 122 VAL CA A 122 VAL C A 123 PHE N 1.0 -47.16 -36.88 PSI 114 114 A 122 VAL C A 123 PHE N A 123 PHE CA A 123 PHE C 1.0 -69.87 -59.07 PHI 115 115 A 123 PHE N A 123 PHE CA A 123 PHE C A 124 GLU N 1.0 -50.30 -33.68 PSI 116 116 A 123 PHE C A 124 GLU N A 124 GLU CA A 124 GLU C 1.0 -68.00 -60.00 PHI 117 117 A 124 GLU N A 124 GLU CA A 124 GLU C A 125 LEU N 1.0 -53.00 -37.00 PSI stop_ save_