data_nef_c15793_2k4b 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 SER middle . . 3 A 3 TYR middle . . 4 A 4 TYR middle . . 5 A 5 HIS middle . . 6 A 6 HIS middle . . 7 A 7 HIS middle . . 8 A 8 HIS middle . . 9 A 9 HIS middle . . 10 A 10 HIS middle . . 11 A 11 ASP middle . . 12 A 12 TYR middle . . 13 A 13 ASP middle . . 14 A 14 ILE middle . . 15 A 15 PRO middle . false 16 A 16 THR middle . . 17 A 17 THR middle . . 18 A 18 GLU middle . . 19 A 19 ASN middle . . 20 A 20 LEU middle . . 21 A 21 TYR middle . . 22 A 22 PHE middle . . 23 A 23 GLN middle . . 24 A 24 GLY middle . false 25 A 25 ALA middle . . 26 A 26 MET middle . . 27 A 27 ASN middle . . 28 A 28 GLU middle . . 29 A 29 VAL middle . . 30 A 30 GLU middle . . 31 A 31 PHE middle . . 32 A 32 ASN middle . . 33 A 33 VAL middle . . 34 A 34 SER middle . . 35 A 35 ASN middle . . 36 A 36 ALA middle . . 37 A 37 GLU middle . . 38 A 38 LEU middle . . 39 A 39 ILE middle . . 40 A 40 VAL middle . . 41 A 41 MET middle . . 42 A 42 ARG middle . . 43 A 43 VAL middle . . 44 A 44 ILE middle . . 45 A 45 TRP middle . . 46 A 46 SER middle . . 47 A 47 LEU middle . . 48 A 48 GLY middle . false 49 A 49 GLU middle . . 50 A 50 ALA middle . . 51 A 51 ARG middle . . 52 A 52 VAL middle . . 53 A 53 ASP middle . . 54 A 54 GLU middle . . 55 A 55 ILE middle . . 56 A 56 TYR middle . . 57 A 57 ALA middle . . 58 A 58 GLN middle . . 59 A 59 ILE middle . . 60 A 60 PRO middle . false 61 A 61 GLN middle . . 62 A 62 GLU middle . . 63 A 63 LEU middle . . 64 A 64 GLU middle . . 65 A 65 TRP middle . . 66 A 66 SER middle . . 67 A 67 LEU middle . . 68 A 68 ALA middle . . 69 A 69 THR middle . . 70 A 70 VAL middle . . 71 A 71 LYS middle . . 72 A 72 THR middle . . 73 A 73 LEU middle . . 74 A 74 LEU middle . . 75 A 75 GLY middle . false 76 A 76 ARG middle . . 77 A 77 LEU middle . . 78 A 78 VAL middle . . 79 A 79 LYS middle . . 80 A 80 LYS middle . . 81 A 81 GLU middle . . 82 A 82 MET middle . . 83 A 83 LEU middle . . 84 A 84 SER middle . . 85 A 85 THR middle . . 86 A 86 GLU middle . . 87 A 87 LYS middle . . 88 A 88 GLU middle . . 89 A 89 GLY middle . false 90 A 90 ARG middle . . 91 A 91 LYS middle . . 92 A 92 PHE middle . . 93 A 93 VAL middle . . 94 A 94 TYR middle . . 95 A 95 ARG middle . . 96 A 96 PRO middle . false 97 A 97 LEU middle . . 98 A 98 MET middle . . 99 A 99 GLU 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 36 ALA HA H 1 4.250 0.020 A 36 ALA HB% H 1 1.301 0.020 A 36 ALA CA C 13 55.550 0.3 A 36 ALA CB C 13 19.203 0.3 A 39 ILE HA H 1 4.250 0.020 A 39 ILE HB H 1 1.692 0.020 A 39 ILE HD1% H 1 0.696 0.020 A 39 ILE HG1y H 1 1.331 0.020 A 39 ILE HG1x H 1 0.985 0.020 A 39 ILE HG2% H 1 0.754 0.020 A 39 ILE CA C 13 58.724 0.3 A 39 ILE CB C 13 38.496 0.3 A 39 ILE CD1 C 13 12.822 0.3 A 39 ILE CG1 C 13 26.847 0.3 A 39 ILE CG2 C 13 16.914 0.3 A 40 VAL HA H 1 3.198 0.020 A 40 VAL HB H 1 1.939 0.020 A 40 VAL HG1% H 1 1.016 0.020 A 40 VAL HG2% H 1 0.492 0.020 A 40 VAL CA C 13 67.086 0.3 A 40 VAL CB C 13 30.969 0.3 A 40 VAL CG1 C 13 24.301 0.3 A 40 VAL CG2 C 13 22.240 0.3 A 42 ARG HA H 1 3.770 0.020 A 42 ARG CA C 13 55.107 0.3 A 43 VAL H H 1 7.364 0.020 A 43 VAL HA H 1 3.506 0.020 A 43 VAL HB H 1 2.120 0.020 A 43 VAL HG1% H 1 0.904 0.020 A 43 VAL HG2% H 1 0.846 0.020 A 43 VAL C C 13 178.600 0.3 A 43 VAL CA C 13 66.598 0.3 A 43 VAL CB C 13 31.203 0.3 A 43 VAL CG1 C 13 22.526 0.3 A 43 VAL CG2 C 13 20.426 0.3 A 43 VAL N N 15 119.765 0.3 A 44 ILE H H 1 7.829 0.020 A 44 ILE HA H 1 3.242 0.020 A 44 ILE HB H 1 1.529 0.020 A 44 ILE HD1% H 1 0.456 0.020 A 44 ILE HG12 H 1 0.562 0.020 A 44 ILE HG13 H 1 0.562 0.020 A 44 ILE HG2% H 1 0.484 0.020 A 44 ILE C C 13 178.289 0.3 A 44 ILE CA C 13 66.146 0.3 A 44 ILE CB C 13 36.869 0.3 A 44 ILE CD1 C 13 14.927 0.3 A 44 ILE CG1 C 13 29.521 0.3 A 44 ILE CG2 C 13 16.747 0.3 A 44 ILE N N 15 120.991 0.3 A 45 TRP H H 1 9.154 0.020 A 45 TRP HA H 1 4.377 0.020 A 45 TRP HBy H 1 3.231 0.020 A 45 TRP HBx H 1 3.067 0.020 A 45 TRP HD1 H 1 7.140 0.020 A 45 TRP HE1 H 1 10.299 0.020 A 45 TRP HE3 H 1 7.640 0.020 A 45 TRP HZ2 H 1 7.070 0.020 A 45 TRP C C 13 179.154 0.3 A 45 TRP CA C 13 60.749 0.3 A 45 TRP CB C 13 28.620 0.3 A 45 TRP N N 15 119.877 0.3 A 45 TRP NE1 N 15 129.365 0.3 A 46 SER H H 1 7.556 0.020 A 46 SER HA H 1 4.247 0.020 A 46 SER HB2 H 1 3.973 0.020 A 46 SER HB3 H 1 3.973 0.020 A 46 SER C C 13 175.737 0.3 A 46 SER CA C 13 61.315 0.3 A 46 SER CB C 13 63.510 0.3 A 46 SER N N 15 113.170 0.3 A 47 LEU H H 1 7.667 0.020 A 47 LEU HA H 1 4.274 0.020 A 47 LEU HBy H 1 1.551 0.020 A 47 LEU HBx H 1 1.459 0.020 A 47 LEU HD1% H 1 0.544 0.020 A 47 LEU HD2% H 1 0.749 0.020 A 47 LEU HG H 1 1.680 0.020 A 47 LEU C C 13 178.987 0.3 A 47 LEU CA C 13 55.835 0.3 A 47 LEU CB C 13 43.548 0.3 A 47 LEU CD1 C 13 25.689 0.3 A 47 LEU CD2 C 13 22.309 0.3 A 47 LEU CG C 13 26.888 0.3 A 47 LEU N N 15 120.838 0.3 A 48 GLY H H 1 8.656 0.020 A 48 GLY HAy H 1 4.373 0.020 A 48 GLY HAx H 1 3.296 0.020 A 48 GLY C C 13 173.625 0.3 A 48 GLY CA C 13 46.944 0.3 A 48 GLY N N 15 113.217 0.3 A 49 GLU H H 1 7.347 0.020 A 49 GLU HA H 1 4.830 0.020 A 49 GLU HBy H 1 1.947 0.020 A 49 GLU HBx H 1 1.667 0.020 A 49 GLU HG2 H 1 1.650 0.020 A 49 GLU HG3 H 1 1.650 0.020 A 49 GLU C C 13 174.973 0.3 A 49 GLU CA C 13 55.026 0.3 A 49 GLU CB C 13 31.947 0.3 A 49 GLU CG C 13 31.32 0.3 A 49 GLU N N 15 116.219 0.3 A 50 ALA H H 1 8.598 0.020 A 50 ALA HA H 1 4.817 0.020 A 50 ALA HB% H 1 1.256 0.020 A 50 ALA C C 13 176.042 0.3 A 50 ALA CA C 13 52.189 0.3 A 50 ALA CB C 13 24.738 0.3 A 50 ALA N N 15 122.121 0.3 A 51 ARG H H 1 8.935 0.020 A 51 ARG HA H 1 5.098 0.020 A 51 ARG HBx H 1 1.650 0.020 A 51 ARG HBy H 1 2.293 0.020 A 51 ARG HDy H 1 3.177 0.020 A 51 ARG HDx H 1 3.083 0.020 A 51 ARG HG2 H 1 1.593 0.020 A 51 ARG HG3 H 1 1.593 0.020 A 51 ARG C C 13 178.696 0.3 A 51 ARG CA C 13 54.995 0.3 A 51 ARG CB C 13 32.605 0.3 A 51 ARG CD C 13 43.264 0.3 A 51 ARG CG C 13 29.108 0.3 A 51 ARG N N 15 121.019 0.3 A 52 VAL H H 1 9.767 0.020 A 52 VAL HA H 1 3.494 0.020 A 52 VAL HB H 1 2.139 0.020 A 52 VAL HG1% H 1 0.926 0.020 A 52 VAL HG2% H 1 0.889 0.020 A 52 VAL C C 13 176.292 0.3 A 52 VAL CA C 13 67.295 0.3 A 52 VAL CB C 13 31.427 0.3 A 52 VAL CG1 C 13 22.879 0.3 A 52 VAL CG2 C 13 20.447 0.3 A 52 VAL N N 15 121.483 0.3 A 53 ASP H H 1 8.640 0.020 A 53 ASP HA H 1 4.199 0.020 A 53 ASP HBx H 1 2.496 0.020 A 53 ASP HBy H 1 2.644 0.020 A 53 ASP C C 13 178.904 0.3 A 53 ASP CA C 13 56.797 0.3 A 53 ASP CB C 13 39.068 0.3 A 53 ASP N N 15 116.987 0.3 A 54 GLU H H 1 7.028 0.020 A 54 GLU HA H 1 4.017 0.020 A 54 GLU HBx H 1 1.928 0.020 A 54 GLU HBy H 1 2.370 0.020 A 54 GLU HG2 H 1 2.211 0.020 A 54 GLU C C 13 178.696 0.3 A 54 GLU CA C 13 58.261 0.3 A 54 GLU CB C 13 30.742 0.3 A 54 GLU CG C 13 36.998 0.3 A 54 GLU N N 15 119.862 0.3 A 55 ILE H H 1 7.639 0.020 A 55 ILE HA H 1 3.345 0.020 A 55 ILE HB H 1 1.687 0.020 A 55 ILE HD1% H 1 0.406 0.020 A 55 ILE HG12 H 1 1.258 0.020 A 55 ILE HG13 H 1 1.258 0.020 A 55 ILE HG2% H 1 0.639 0.020 A 55 ILE C C 13 177.945 0.3 A 55 ILE CA C 13 64.533 0.3 A 55 ILE CB C 13 38.824 0.3 A 55 ILE CD1 C 13 14.980 0.3 A 55 ILE CG1 C 13 24.774 0.3 A 55 ILE CG2 C 13 16.734 0.3 A 55 ILE N N 15 118.743 0.3 A 56 TYR H H 1 8.548 0.020 A 56 TYR HA H 1 4.028 0.020 A 56 TYR HBy H 1 2.908 0.020 A 56 TYR HBx H 1 2.874 0.020 A 56 TYR HD1 H 1 6.960 0.020 A 56 TYR HD2 H 1 6.960 0.020 A 56 TYR HE1 H 1 6.630 0.020 A 56 TYR HE2 H 1 6.630 0.020 A 56 TYR C C 13 177.279 0.3 A 56 TYR CA C 13 61.046 0.3 A 56 TYR CB C 13 38.746 0.3 A 56 TYR N N 15 117.394 0.3 A 57 ALA H H 1 7.305 0.020 A 57 ALA HA H 1 3.891 0.020 A 57 ALA HB% H 1 1.387 0.020 A 57 ALA C C 13 178.515 0.3 A 57 ALA CA C 13 53.867 0.3 A 57 ALA CB C 13 18.567 0.3 A 57 ALA N N 15 116.845 0.3 A 58 GLN H H 1 7.182 0.020 A 58 GLN HA H 1 4.182 0.020 A 58 GLN HBx H 1 1.770 0.020 A 58 GLN HBy H 1 2.261 0.020 A 58 GLN HE21 H 1 7.519 0.020 A 58 GLN HE22 H 1 6.671 0.020 A 58 GLN HG2 H 1 2.373 0.020 A 58 GLN HG3 H 1 2.373 0.020 A 58 GLN C C 13 176.015 0.3 A 58 GLN CA C 13 54.679 0.3 A 58 GLN CB C 13 29.584 0.3 A 58 GLN CG C 13 32.830 0.3 A 58 GLN N N 15 113.228 0.3 A 58 GLN NE2 N 15 112.312 0.3 A 59 ILE H H 1 7.051 0.020 A 59 ILE HA H 1 3.829 0.020 A 59 ILE HB H 1 1.762 0.020 A 59 ILE HD1% H 1 0.602 0.020 A 59 ILE HG1x H 1 1.274 0.020 A 59 ILE HG1y H 1 1.748 0.020 A 59 ILE HG2% H 1 0.479 0.020 A 59 ILE CA C 13 57.557 0.3 A 59 ILE CB C 13 36.090 0.3 A 59 ILE CD1 C 13 10.969 0.3 A 59 ILE CG1 C 13 26.669 0.3 A 59 ILE CG2 C 13 17.298 0.3 A 59 ILE N N 15 121.926 0.3 A 60 PRO HA H 1 4.049 0.020 A 60 PRO HBy H 1 2.139 0.020 A 60 PRO HBx H 1 1.758 0.020 A 60 PRO HDy H 1 3.697 0.020 A 60 PRO HDx H 1 3.487 0.020 A 60 PRO HGy H 1 1.875 0.020 A 60 PRO HGx H 1 1.811 0.020 A 60 PRO CA C 13 63.775 0.3 A 60 PRO CB C 13 32.050 0.3 A 60 PRO CD C 13 51.114 0.3 A 60 PRO CG C 13 27.238 0.3 A 61 GLN H H 1 8.772 0.020 A 61 GLN HA H 1 3.772 0.020 A 61 GLN HB2 H 1 1.902 0.020 A 61 GLN HB3 H 1 1.902 0.020 A 61 GLN HE21 H 1 7.423 0.020 A 61 GLN HE22 H 1 6.687 0.020 A 61 GLN HG2 H 1 2.277 0.020 A 61 GLN HG3 H 1 2.277 0.020 A 61 GLN C C 13 178.654 0.3 A 61 GLN CA C 13 58.761 0.3 A 61 GLN CB C 13 28.318 0.3 A 61 GLN CG C 13 33.929 0.3 A 61 GLN N N 15 126.284 0.3 A 61 GLN NE2 N 15 112.666 0.3 A 62 GLU H H 1 9.471 0.020 A 62 GLU HA H 1 3.971 0.020 A 62 GLU HB2 H 1 1.821 0.020 A 62 GLU HB3 H 1 1.821 0.020 A 62 GLU HGy H 1 1.895 0.020 A 62 GLU HGx H 1 1.737 0.020 A 62 GLU C C 13 177.376 0.3 A 62 GLU CA C 13 58.072 0.3 A 62 GLU CB C 13 28.164 0.3 A 62 GLU CG C 13 31.139 0.3 A 62 GLU N N 15 118.102 0.3 A 63 LEU H H 1 6.792 0.020 A 63 LEU HA H 1 3.717 0.020 A 63 LEU HBy H 1 0.722 0.020 A 63 LEU HBx H 1 0.030 0.020 A 63 LEU HD1% H 1 -0.259 0.020 A 63 LEU HD2% H 1 0.356 0.020 A 63 LEU HG H 1 0.933 0.020 A 63 LEU C C 13 176.570 0.3 A 63 LEU CA C 13 56.173 0.3 A 63 LEU CB C 13 39.610 0.3 A 63 LEU CD1 C 13 24.302 0.3 A 63 LEU CD2 C 13 21.543 0.3 A 63 LEU CG C 13 26.622 0.3 A 63 LEU N N 15 118.573 0.3 A 64 GLU H H 1 7.589 0.020 A 64 GLU HA H 1 3.782 0.020 A 64 GLU HB2 H 1 2.055 0.020 A 64 GLU HB3 H 1 2.055 0.020 A 64 GLU HGx H 1 2.013 0.020 A 64 GLU HGy H 1 2.055 0.020 A 64 GLU C C 13 176.723 0.3 A 64 GLU CA C 13 57.031 0.3 A 64 GLU CB C 13 26.951 0.3 A 64 GLU CG C 13 36.460 0.3 A 64 GLU N N 15 112.960 0.3 A 65 TRP H H 1 8.340 0.020 A 65 TRP HA H 1 5.097 0.020 A 65 TRP HB2 H 1 3.061 0.020 A 65 TRP HB3 H 1 3.061 0.020 A 65 TRP HD1 H 1 6.863 0.020 A 65 TRP HE1 H 1 9.896 0.020 A 65 TRP HZ2 H 1 7.190 0.020 A 65 TRP CA C 13 54.697 0.3 A 65 TRP CB C 13 30.450 0.3 A 65 TRP N N 15 119.866 0.3 A 65 TRP NE1 N 15 126.441 0.3 A 66 SER HA H 1 4.700 0.020 A 66 SER HBy H 1 4.246 0.020 A 66 SER HBx H 1 3.959 0.020 A 66 SER CA C 13 56.340 0.3 A 66 SER CB C 13 66.184 0.3 A 67 LEU H H 1 8.622 0.020 A 67 LEU HA H 1 3.357 0.020 A 67 LEU HBy H 1 1.335 0.020 A 67 LEU HBx H 1 0.846 0.020 A 67 LEU HD1% H 1 0.551 0.020 A 67 LEU HD2% H 1 0.455 0.020 A 67 LEU HG H 1 1.021 0.020 A 67 LEU C C 13 178.779 0.3 A 67 LEU CA C 13 58.385 0.3 A 67 LEU CB C 13 41.218 0.3 A 67 LEU CD1 C 13 25.065 0.3 A 67 LEU CD2 C 13 23.353 0.3 A 67 LEU CG C 13 26.539 0.3 A 67 LEU N N 15 123.216 0.3 A 68 ALA H H 1 7.987 0.020 A 68 ALA HA H 1 3.766 0.020 A 68 ALA HB% H 1 1.214 0.020 A 68 ALA C C 13 180.626 0.3 A 68 ALA CA C 13 55.431 0.3 A 68 ALA CB C 13 17.780 0.3 A 68 ALA N N 15 119.912 0.3 A 69 THR H H 1 7.781 0.020 A 69 THR HA H 1 3.477 0.020 A 69 THR HB H 1 4.098 0.020 A 69 THR HG2% H 1 0.146 0.020 A 69 THR C C 13 176.154 0.3 A 69 THR CA C 13 66.975 0.3 A 69 THR CB C 13 68.525 0.3 A 69 THR CG2 C 13 20.413 0.3 A 69 THR N N 15 118.256 0.3 A 70 VAL H H 1 7.373 0.020 A 70 VAL HA H 1 3.201 0.020 A 70 VAL HB H 1 2.177 0.020 A 70 VAL HG1% H 1 1.264 0.020 A 70 VAL HG2% H 1 0.764 0.020 A 70 VAL C C 13 177.265 0.3 A 70 VAL CA C 13 67.795 0.3 A 70 VAL CB C 13 31.342 0.3 A 70 VAL CG1 C 13 24.741 0.3 A 70 VAL CG2 C 13 21.234 0.3 A 70 VAL N N 15 120.502 0.3 A 71 LYS H H 1 8.521 0.020 A 71 LYS HA H 1 3.659 0.020 A 71 LYS HB2 H 1 1.724 0.020 A 71 LYS HB3 H 1 1.724 0.020 A 71 LYS HD2 H 1 1.495 0.020 A 71 LYS HD3 H 1 1.495 0.020 A 71 LYS HEx H 1 2.638 0.020 A 71 LYS HEy H 1 2.822 0.020 A 71 LYS HGy H 1 1.414 0.020 A 71 LYS HGx H 1 1.240 0.020 A 71 LYS C C 13 180.154 0.3 A 71 LYS CA C 13 61.155 0.3 A 71 LYS CB C 13 32.114 0.3 A 71 LYS CD C 13 29.519 0.3 A 71 LYS CE C 13 41.548 0.3 A 71 LYS CG C 13 25.886 0.3 A 71 LYS N N 15 118.966 0.3 A 72 THR H H 1 8.160 0.020 A 72 THR HA H 1 3.747 0.020 A 72 THR HB H 1 4.104 0.020 A 72 THR HG2% H 1 0.962 0.020 A 72 THR C C 13 177.209 0.3 A 72 THR CA C 13 66.978 0.3 A 72 THR CB C 13 68.268 0.3 A 72 THR CG2 C 13 21.242 0.3 A 72 THR N N 15 119.017 0.3 A 73 LEU H H 1 7.753 0.020 A 73 LEU HA H 1 3.682 0.020 A 73 LEU HB2 H 1 1.779 0.020 A 73 LEU HB3 H 1 1.779 0.020 A 73 LEU HD1% H 1 -0.056 0.020 A 73 LEU HD2% H 1 0.442 0.020 A 73 LEU HG H 1 0.025 0.020 A 73 LEU C C 13 178.821 0.3 A 73 LEU CA C 13 58.671 0.3 A 73 LEU CB C 13 42.182 0.3 A 73 LEU CD1 C 13 27.044 0.3 A 73 LEU CD2 C 13 23.157 0.3 A 73 LEU CG C 13 27.004 0.3 A 73 LEU N N 15 123.340 0.3 A 74 LEU H H 1 8.341 0.020 A 74 LEU HA H 1 3.551 0.020 A 74 LEU HBy H 1 1.560 0.020 A 74 LEU HBx H 1 1.500 0.020 A 74 LEU HD1% H 1 0.158 0.020 A 74 LEU HD2% H 1 -0.140 0.020 A 74 LEU HG H 1 1.360 0.020 A 74 LEU C C 13 178.832 0.3 A 74 LEU CA C 13 58.293 0.3 A 74 LEU CB C 13 40.530 0.3 A 74 LEU CD1 C 13 26.057 0.3 A 74 LEU CD2 C 13 22.961 0.3 A 74 LEU CG C 13 25.998 0.3 A 74 LEU N N 15 118.538 0.3 A 75 GLY H H 1 7.780 0.020 A 75 GLY HAx H 1 3.648 0.020 A 75 GLY HAy H 1 3.767 0.020 A 75 GLY C C 13 177.626 0.3 A 75 GLY CA C 13 47.290 0.3 A 75 GLY N N 15 103.878 0.3 A 76 ARG H H 1 7.637 0.020 A 76 ARG HA H 1 3.908 0.020 A 76 ARG HBy H 1 1.926 0.020 A 76 ARG HBx H 1 1.885 0.020 A 76 ARG HDx H 1 2.972 0.020 A 76 ARG HDy H 1 3.004 0.020 A 76 ARG HGx H 1 1.566 0.020 A 76 ARG HGy H 1 1.708 0.020 A 76 ARG C C 13 179.001 0.3 A 76 ARG CA C 13 59.378 0.3 A 76 ARG CB C 13 30.767 0.3 A 76 ARG CD C 13 43.956 0.3 A 76 ARG CG C 13 27.029 0.3 A 76 ARG N N 15 122.469 0.3 A 77 LEU H H 1 7.922 0.020 A 77 LEU HA H 1 3.812 0.020 A 77 LEU HBy H 1 1.476 0.020 A 77 LEU HBx H 1 1.240 0.020 A 77 LEU HD1% H 1 0.643 0.020 A 77 LEU HD2% H 1 0.784 0.020 A 77 LEU HG H 1 1.336 0.020 A 77 LEU C C 13 179.835 0.3 A 77 LEU CA C 13 58.306 0.3 A 77 LEU CB C 13 42.365 0.3 A 77 LEU CD1 C 13 24.566 0.3 A 77 LEU CD2 C 13 23.424 0.3 A 77 LEU CG C 13 26.768 0.3 A 77 LEU N N 15 120.640 0.3 A 78 VAL H H 1 8.287 0.020 A 78 VAL HA H 1 3.950 0.020 A 78 VAL HB H 1 2.073 0.020 A 78 VAL HG1% H 1 0.936 0.020 A 78 VAL HG2% H 1 0.839 0.020 A 78 VAL C C 13 181.099 0.3 A 78 VAL CA C 13 66.044 0.3 A 78 VAL CB C 13 32.287 0.3 A 78 VAL CG1 C 13 23.222 0.3 A 78 VAL CG2 C 13 20.823 0.3 A 78 VAL N N 15 121.179 0.3 A 79 LYS H H 1 7.836 0.020 A 79 LYS HA H 1 4.004 0.020 A 79 LYS HB2 H 1 1.577 0.020 A 79 LYS HB3 H 1 1.577 0.020 A 79 LYS HD2 H 1 1.889 0.020 A 79 LYS HD3 H 1 1.889 0.020 A 79 LYS HE2 H 1 2.844 0.020 A 79 LYS HE3 H 1 2.844 0.020 A 79 LYS HGy H 1 1.434 0.020 A 79 LYS HGx H 1 1.393 0.020 A 79 LYS CA C 13 59.189 0.3 A 79 LYS CB C 13 29.238 0.3 A 79 LYS CD C 13 31.736 0.3 A 79 LYS CE C 13 42.022 0.3 A 79 LYS CG C 13 24.957 0.3 A 79 LYS N N 15 123.239 0.3 A 80 LYS HA H 1 4.179 0.020 A 80 LYS HB2 H 1 1.891 0.020 A 80 LYS HB3 H 1 1.891 0.020 A 80 LYS CA C 13 57.269 0.3 A 80 LYS CB C 13 31.067 0.3 A 81 GLU H H 1 7.801 0.020 A 81 GLU HA H 1 4.513 0.020 A 81 GLU HB2 H 1 1.749 0.020 A 81 GLU HB3 H 1 1.749 0.020 A 81 GLU CA C 13 57.915 0.3 A 81 GLU CB C 13 26.150 0.3 A 81 GLU N N 15 126.946 0.3 A 82 MET H H 1 7.978 0.020 A 82 MET HA H 1 3.781 0.020 A 82 MET HB2 H 1 1.644 0.020 A 82 MET HB3 H 1 1.644 0.020 A 82 MET HG2 H 1 2.067 0.020 A 82 MET HG3 H 1 2.067 0.020 A 82 MET C C 13 176.695 0.3 A 82 MET CA C 13 57.599 0.3 A 82 MET CB C 13 33.067 0.3 A 82 MET CG C 13 36.619 0.3 A 82 MET N N 15 112.370 0.3 A 83 LEU H H 1 6.928 0.020 A 83 LEU HA H 1 5.042 0.020 A 83 LEU HBx H 1 1.254 0.020 A 83 LEU HBy H 1 1.332 0.020 A 83 LEU HD2% H 1 0.624 0.020 A 83 LEU C C 13 175.376 0.3 A 83 LEU CA C 13 52.193 0.3 A 83 LEU CB C 13 48.040 0.3 A 83 LEU CD1 C 13 24.746 0.3 A 83 LEU CD2 C 13 28.069 0.3 A 83 LEU N N 15 116.646 0.3 A 84 SER H H 1 9.089 0.020 A 84 SER HA H 1 4.711 0.020 A 84 SER HBy H 1 3.816 0.020 A 84 SER HBx H 1 3.560 0.020 A 84 SER C C 13 173.496 0.3 A 84 SER CA C 13 56.311 0.3 A 84 SER CB C 13 65.943 0.3 A 84 SER N N 15 115.366 0.3 A 85 THR H H 1 8.091 0.020 A 85 THR HA H 1 5.036 0.020 A 85 THR HB H 1 3.383 0.020 A 85 THR HG2% H 1 0.522 0.020 A 85 THR C C 13 173.844 0.3 A 85 THR CA C 13 58.919 0.3 A 85 THR CB C 13 71.518 0.3 A 85 THR CG2 C 13 21.386 0.3 A 85 THR N N 15 110.842 0.3 A 86 GLU H H 1 8.128 0.020 A 86 GLU HA H 1 4.413 0.020 A 86 GLU HB2 H 1 2.004 0.020 A 86 GLU HG2 H 1 1.701 0.020 A 86 GLU HG3 H 1 1.701 0.020 A 86 GLU C C 13 174.693 0.3 A 86 GLU CA C 13 54.405 0.3 A 86 GLU CB C 13 33.099 0.3 A 86 GLU CG C 13 29.617 0.3 A 86 GLU N N 15 122.318 0.3 A 87 LYS H H 1 8.622 0.020 A 87 LYS HA H 1 4.153 0.020 A 87 LYS HBx H 1 1.330 0.020 A 87 LYS HBy H 1 1.526 0.020 A 87 LYS HDy H 1 1.544 0.020 A 87 LYS HDx H 1 1.289 0.020 A 87 LYS HE2 H 1 2.550 0.020 A 87 LYS HE3 H 1 2.550 0.020 A 87 LYS HGy H 1 0.893 0.020 A 87 LYS HGx H 1 0.809 0.020 A 87 LYS C C 13 175.909 0.3 A 87 LYS CA C 13 56.403 0.3 A 87 LYS CB C 13 32.960 0.3 A 87 LYS CD C 13 29.207 0.3 A 87 LYS CE C 13 41.704 0.3 A 87 LYS CG C 13 24.603 0.3 A 87 LYS N N 15 124.854 0.3 A 88 GLU HA H 1 4.276 0.020 A 88 GLU HB2 H 1 1.701 0.020 A 88 GLU HGy H 1 1.729 0.020 A 88 GLU HGx H 1 1.586 0.020 A 88 GLU C C 13 175.998 0.3 A 88 GLU CA C 13 55.362 0.3 A 88 GLU CB C 13 30.945 0.3 A 88 GLU CG C 13 30.259 0.3 A 91 LYS H H 1 7.651 0.020 A 91 LYS HA H 1 4.456 0.020 A 91 LYS HB2 H 1 1.781 0.020 A 91 LYS HB3 H 1 1.781 0.020 A 91 LYS HD2 H 1 1.606 0.020 A 91 LYS HD3 H 1 1.606 0.020 A 91 LYS HG2 H 1 1.312 0.020 A 91 LYS HG3 H 1 1.312 0.020 A 91 LYS C C 13 174.960 0.3 A 91 LYS CA C 13 54.992 0.3 A 91 LYS CB C 13 34.855 0.3 A 91 LYS CD C 13 29.404 0.3 A 91 LYS CE C 13 42.111 0.3 A 91 LYS CG C 13 25.145 0.3 A 91 LYS N N 15 119.096 0.3 A 92 PHE H H 1 7.904 0.020 A 92 PHE HA H 1 4.772 0.020 A 92 PHE HBy H 1 2.626 0.020 A 92 PHE HBx H 1 2.316 0.020 A 92 PHE HD1 H 1 6.988 0.020 A 92 PHE HD2 H 1 6.988 0.020 A 92 PHE HE1 H 1 7.131 0.020 A 92 PHE HE2 H 1 7.131 0.020 A 92 PHE C C 13 175.183 0.3 A 92 PHE CA C 13 57.762 0.3 A 92 PHE CB C 13 40.747 0.3 A 92 PHE N N 15 118.936 0.3 A 93 VAL H H 1 8.626 0.020 A 93 VAL HA H 1 4.090 0.020 A 93 VAL HB H 1 1.645 0.020 A 93 VAL HG1% H 1 0.629 0.020 A 93 VAL HG2% H 1 0.629 0.020 A 93 VAL C C 13 174.856 0.3 A 93 VAL CA C 13 61.228 0.3 A 93 VAL CB C 13 33.595 0.3 A 93 VAL CG1 C 13 20.775 0.3 A 93 VAL N N 15 120.649 0.3 A 94 TYR H H 1 8.950 0.020 A 94 TYR HA H 1 5.029 0.020 A 94 TYR HBx H 1 2.489 0.020 A 94 TYR HBy H 1 2.768 0.020 A 94 TYR HD1 H 1 6.849 0.020 A 94 TYR HD2 H 1 6.849 0.020 A 94 TYR HE1 H 1 6.460 0.020 A 94 TYR HE2 H 1 6.460 0.020 A 94 TYR C C 13 175.242 0.3 A 94 TYR CA C 13 57.619 0.3 A 94 TYR CB C 13 41.447 0.3 A 94 TYR N N 15 125.589 0.3 A 95 ARG H H 1 8.275 0.020 A 95 ARG HA H 1 5.001 0.020 A 95 ARG HB2 H 1 1.635 0.020 A 95 ARG HB3 H 1 1.635 0.020 A 95 ARG CA C 13 53.055 0.3 A 95 ARG N N 15 118.094 0.3 A 96 PRO HB2 H 1 1.760 0.020 A 96 PRO HDy H 1 2.940 0.020 A 96 PRO HDx H 1 2.900 0.020 A 96 PRO CA C 13 63.815 0.3 A 96 PRO CB C 13 33.778 0.3 A 96 PRO CD C 13 50.367 0.3 A 97 LEU H H 1 7.862 0.020 A 97 LEU HA H 1 4.054 0.020 A 97 LEU HBx H 1 1.161 0.020 A 97 LEU HBy H 1 1.304 0.020 A 97 LEU HD1% H 1 0.605 0.020 A 97 LEU HD2% H 1 0.716 0.020 A 97 LEU HG H 1 1.302 0.020 A 97 LEU CA C 13 55.208 0.3 A 97 LEU CB C 13 42.072 0.3 A 97 LEU CD1 C 13 23.008 0.3 A 97 LEU CD2 C 13 24.632 0.3 A 97 LEU CG C 13 26.514 0.3 A 97 LEU N N 15 119.401 0.3 stop_ save_ save_AMBER_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode AMBER_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 36 ALA HB% A 65 TRP HH2 1.0 1.8 4.53 2 2 A 36 ALA HB% A 73 LEU HG 1.0 1.8 4.70 3 3 A 36 ALA HB% A 73 LEU HD1% 1.0 1.8 4.94 4 4 A 36 ALA HB% A 73 LEU HD2% 1.0 1.8 4.23 5 5 A 39 ILE HA A 39 ILE HD1% 1.0 1.8 5.00 6 6 A 39 ILE HA A 39 ILE HG2% 1.0 1.8 4.32 7 7 A 39 ILE HD1% A 39 ILE HB 1.0 1.8 4.45 8 8 A 39 ILE HD1% A 63 LEU HD1% 1.0 1.8 4.68 9 9 A 39 ILE HG2% A 39 ILE HG1y 1.0 1.8 4.33 10 10 A 39 ILE HG2% A 39 ILE HG1x 1.0 1.8 4.59 11 11 A 39 ILE HD1% A 39 ILE HG2% 1.0 1.8 3.78 12 12 A 40 VAL HA A 43 VAL H 1.0 1.8 4.66 13 13 A 40 VAL HA A 44 ILE H 1.0 1.8 4.68 14 14 A 40 VAL HA A 59 ILE HD1% 1.0 1.8 6.08 15 15 A 59 ILE HD1% A 40 VAL HG1% 1.0 1.8 4.99 16 16 A 40 VAL HG1% A 65 TRP HE3 1.0 1.8 6.48 17 17 A 65 TRP HH2 A 40 VAL HG1% 1.0 1.8 5.68 18 18 A 40 VAL HG1% A 65 TRP HZ3 1.0 1.8 4.94 19 19 A 73 LEU HD1% A 40 VAL HG1% 1.0 1.8 4.70 20 20 A 40 VAL HG2% A 77 LEU HD1% 1.0 1.8 4.30 21 21 A 40 VAL HG2% A 77 LEU HD2% 1.0 1.8 4.32 22 22 A 43 VAL H A 43 VAL HG1% 1.0 1.8 5.20 23 23 A 43 VAL H A 43 VAL HG2% 1.0 1.8 5.43 24 24 A 43 VAL H A 44 ILE H 1.0 1.8 5.44 25 25 A 43 VAL H A 45 TRP H 1.0 1.8 5.50 26 26 A 43 VAL HA A 46 SER H 1.0 1.8 5.71 27 27 A 43 VAL HA A 47 LEU H 1.0 1.8 6.67 28 28 A 44 ILE H A 43 VAL HB 1.0 1.8 5.49 29 29 A 44 ILE H A 43 VAL HG1% 1.0 1.8 5.52 30 30 A 44 ILE H A 43 VAL HG2% 1.0 1.8 4.83 31 31 A 43 VAL HG2% A 44 ILE HG13 1.0 1.8 4.02 32 31 A 43 VAL HG2% A 44 ILE HG12 1.0 1.8 4.02 33 32 A 43 VAL HG2% A 45 TRP H 1.0 1.8 5.87 34 33 A 43 VAL HG2% A 58 GLN H 1.0 1.8 5.34 35 34 A 43 VAL HG2% A 58 GLN HE21 1.0 1.8 6.75 36 35 A 43 VAL HG2% A 58 GLN HE22 1.0 1.8 5.58 37 36 A 43 VAL HG2% A 58 GLN HG3 1.0 1.8 5.00 38 36 A 43 VAL HG2% A 58 GLN HG2 1.0 1.8 5.00 39 37 A 43 VAL HG2% A 59 ILE H 1.0 1.8 6.63 40 38 A 44 ILE H A 44 ILE HB 1.0 1.8 4.55 41 39 A 44 ILE H A 44 ILE HD1% 1.0 1.8 4.44 42 40 A 44 ILE H A 44 ILE HG13 1.0 1.8 4.55 43 40 A 44 ILE H A 44 ILE HG12 1.0 1.8 4.55 44 41 A 44 ILE H A 44 ILE HG2% 1.0 1.8 5.13 45 42 A 44 ILE H A 45 TRP H 1.0 1.8 5.65 46 43 A 44 ILE H A 46 SER H 1.0 1.8 5.78 47 44 A 44 ILE HD1% A 44 ILE HA 1.0 1.8 5.37 48 45 A 44 ILE HG13 A 44 ILE HA 1.0 1.8 4.37 49 45 A 44 ILE HG12 A 44 ILE HA 1.0 1.8 4.37 50 46 A 44 ILE HG2% A 44 ILE HA 1.0 1.8 4.56 51 47 A 47 LEU H A 44 ILE HA 1.0 1.8 5.04 52 48 A 44 ILE HA A 47 LEU HBy 1.0 1.8 6.44 53 49 A 44 ILE HB A 44 ILE HD1% 1.0 1.8 4.44 54 50 A 45 TRP H A 44 ILE HB 1.0 1.8 5.18 55 51 A 46 SER H A 44 ILE HB 1.0 1.8 6.40 56 52 A 45 TRP H A 44 ILE HD1% 1.0 1.8 6.69 57 53 A 45 TRP H A 44 ILE HG13 1.0 1.8 5.49 58 53 A 45 TRP H A 44 ILE HG12 1.0 1.8 5.49 59 54 A 46 SER H A 44 ILE HG13 1.0 1.8 6.45 60 54 A 46 SER H A 44 ILE HG12 1.0 1.8 6.45 61 55 A 44 ILE HG13 A 58 GLN HG2 1.0 1.8 6.75 62 55 A 44 ILE HG13 A 58 GLN HG3 1.0 1.8 6.75 63 55 A 44 ILE HG12 A 58 GLN HG3 1.0 1.8 6.75 64 55 A 44 ILE HG12 A 58 GLN HG2 1.0 1.8 6.75 65 56 A 44 ILE HD1% A 44 ILE HG2% 1.0 1.8 3.99 66 57 A 44 ILE HG13 A 44 ILE HG2% 1.0 1.8 4.42 67 57 A 44 ILE HG12 A 44 ILE HG2% 1.0 1.8 4.42 68 58 A 45 TRP H A 44 ILE HG2% 1.0 1.8 5.72 69 59 A 46 SER H A 44 ILE HG2% 1.0 1.8 5.95 70 60 A 44 ILE HG2% A 50 ALA H 1.0 1.8 5.86 71 61 A 45 TRP H A 45 TRP HD1 1.0 1.8 6.54 72 62 A 45 TRP H A 46 SER H 1.0 1.8 5.32 73 63 A 45 TRP H A 46 SER HB3 1.0 1.8 5.67 74 63 A 45 TRP H A 46 SER HB2 1.0 1.8 5.67 75 64 A 45 TRP HD1 A 45 TRP HA 1.0 1.8 5.41 76 65 A 46 SER H A 45 TRP HBy 1.0 1.8 5.24 77 66 A 46 SER H A 45 TRP HBx 1.0 1.8 5.17 78 67 A 46 SER H A 45 TRP HD1 1.0 1.8 6.22 79 68 A 46 SER HB3 A 45 TRP HE1 1.0 1.8 6.58 80 68 A 46 SER HB2 A 45 TRP HE1 1.0 1.8 6.58 81 69 A 46 SER H A 46 SER HB3 1.0 1.8 4.22 82 69 A 46 SER H A 46 SER HB2 1.0 1.8 4.22 83 70 A 46 SER H A 47 LEU H 1.0 1.8 4.19 84 71 A 46 SER H A 48 GLY H 1.0 1.8 6.61 85 72 A 47 LEU H A 46 SER HB3 1.0 1.8 4.59 86 72 A 47 LEU H A 46 SER HB2 1.0 1.8 4.59 87 73 A 46 SER HB2 A 47 LEU HD1% 1.0 1.8 6.21 88 73 A 46 SER HB3 A 47 LEU HD1% 1.0 1.8 6.21 89 74 A 47 LEU H A 47 LEU HG 1.0 1.8 5.37 90 75 A 47 LEU H A 47 LEU HD1% 1.0 1.8 4.82 91 76 A 47 LEU H A 47 LEU HD2% 1.0 1.8 5.23 92 77 A 47 LEU H A 48 GLY H 1.0 1.8 4.86 93 78 A 47 LEU H A 49 GLU H 1.0 1.8 6.26 94 79 A 47 LEU HD1% A 47 LEU HA 1.0 1.8 5.07 95 80 A 47 LEU HD2% A 47 LEU HA 1.0 1.8 4.79 96 81 A 47 LEU HBy A 47 LEU HD1% 1.0 1.8 4.72 97 82 A 47 LEU HBy A 47 LEU HD2% 1.0 1.8 4.43 98 83 A 47 LEU HD1% A 47 LEU HBx 1.0 1.8 4.53 99 84 A 47 LEU HD2% A 47 LEU HBx 1.0 1.8 4.13 100 85 A 48 GLY H A 47 LEU HBx 1.0 1.8 5.06 101 86 A 49 GLU H A 47 LEU HBx 1.0 1.8 5.64 102 87 A 48 GLY H A 47 LEU HG 1.0 1.8 5.50 103 88 A 48 GLY H A 47 LEU HD1% 1.0 1.8 5.95 104 89 A 47 LEU HD1% A 49 GLU H 1.0 1.8 6.69 105 90 A 58 GLN HE21 A 47 LEU HD1% 1.0 1.8 6.05 106 91 A 58 GLN HE22 A 47 LEU HD1% 1.0 1.8 5.68 107 92 A 48 GLY H A 47 LEU HD2% 1.0 1.8 5.02 108 93 A 47 LEU HD2% A 49 GLU H 1.0 1.8 5.13 109 94 A 48 GLY H A 49 GLU H 1.0 1.8 4.85 110 95 A 49 GLU H A 48 GLY HAy 1.0 1.8 4.05 111 96 A 49 GLU H A 49 GLU HBy 1.0 1.8 4.36 112 97 A 49 GLU H A 49 GLU HBx 1.0 1.8 4.69 113 98 A 49 GLU H A 49 GLU HG3 1.0 1.8 4.86 114 98 A 49 GLU H A 49 GLU HG2 1.0 1.8 4.86 115 99 A 50 ALA H A 49 GLU H 1.0 1.8 5.16 116 100 A 49 GLU H A 50 ALA HB% 1.0 1.8 6.03 117 101 A 49 GLU HA A 93 VAL HG2% 1.0 1.8 6.53 118 101 A 49 GLU HA A 93 VAL HG1% 1.0 1.8 6.53 119 102 A 49 GLU HA A 94 TYR H 1.0 1.8 6.13 120 103 A 49 GLU HA A 95 ARG HA 1.0 1.8 4.93 121 104 A 50 ALA H A 49 GLU HBy 1.0 1.8 4.88 122 105 A 49 GLU HBy A 94 TYR H 1.0 1.8 6.75 123 106 A 49 GLU HBx A 93 VAL HG1% 1.0 1.8 5.78 124 106 A 49 GLU HBx A 93 VAL HG2% 1.0 1.8 5.78 125 107 A 50 ALA H A 49 GLU HG3 1.0 1.8 5.24 126 107 A 50 ALA H A 49 GLU HG2 1.0 1.8 5.24 127 108 A 49 GLU HG2 A 93 VAL HG2% 1.0 1.8 4.33 128 108 A 49 GLU HG3 A 93 VAL HG2% 1.0 1.8 4.33 129 108 A 49 GLU HG2 A 93 VAL HG1% 1.0 1.8 4.33 130 108 A 49 GLU HG3 A 93 VAL HG1% 1.0 1.8 4.33 131 109 A 50 ALA H A 50 ALA HB% 1.0 1.8 4.59 132 110 A 50 ALA H A 51 ARG H 1.0 1.8 5.40 133 111 A 50 ALA H A 93 VAL HA 1.0 1.8 5.66 134 112 A 50 ALA H A 93 VAL HG1% 1.0 1.8 4.89 135 112 A 50 ALA H A 93 VAL HG2% 1.0 1.8 4.89 136 113 A 50 ALA H A 94 TYR H 1.0 1.8 5.40 137 114 A 50 ALA H A 94 TYR HBx 1.0 1.8 6.15 138 115 A 50 ALA H A 94 TYR HBy 1.0 1.8 5.96 139 116 A 50 ALA H A 94 TYR O 1.0 1.8 2.50 140 117 A 50 ALA H A 94 TYR HD2 1.0 1.8 6.75 141 117 A 50 ALA H A 94 TYR HD1 1.0 1.8 6.75 142 118 A 94 TYR O A 50 ALA N 1.0 1.8 3.50 143 119 A 50 ALA HB% A 51 ARG H 1.0 1.8 4.57 144 120 A 50 ALA HB% A 54 GLU H 1.0 1.8 5.88 145 121 A 50 ALA HB% A 94 TYR H 1.0 1.8 6.16 146 122 A 51 ARG H A 51 ARG HBx 1.0 1.8 4.69 147 123 A 51 ARG H A 51 ARG HDy 1.0 1.8 5.69 148 124 A 51 ARG H A 51 ARG HDx 1.0 1.8 5.71 149 125 A 51 ARG H A 51 ARG HG3 1.0 1.8 4.69 150 125 A 51 ARG H A 51 ARG HG2 1.0 1.8 4.69 151 126 A 51 ARG H A 52 VAL H 1.0 1.8 6.18 152 127 A 51 ARG H A 53 ASP H 1.0 1.8 6.75 153 128 A 51 ARG H A 54 GLU H 1.0 1.8 5.57 154 129 A 51 ARG H A 54 GLU HBx 1.0 1.8 5.18 155 130 A 51 ARG H A 54 GLU HBy 1.0 1.8 5.01 156 131 A 51 ARG H A 54 GLU HG2 1.0 1.8 5.19 157 132 A 51 ARG H A 55 ILE HD1% 1.0 1.8 6.75 158 133 A 51 ARG H A 55 ILE HG2% 1.0 1.8 5.81 159 134 A 51 ARG H A 93 VAL HA 1.0 1.8 5.65 160 135 A 93 VAL HG1% A 51 ARG H 1.0 1.8 6.39 161 135 A 93 VAL HG2% A 51 ARG H 1.0 1.8 6.39 162 136 A 51 ARG HDy A 51 ARG HA 1.0 1.8 5.58 163 137 A 51 ARG HDx A 51 ARG HA 1.0 1.8 5.46 164 138 A 53 ASP H A 51 ARG HA 1.0 1.8 5.44 165 139 A 51 ARG HA A 92 PHE H 1.0 1.8 6.41 166 140 A 93 VAL HA A 51 ARG HA 1.0 1.8 5.76 167 141 A 93 VAL HG2% A 51 ARG HA 1.0 1.8 4.68 168 141 A 93 VAL HG1% A 51 ARG HA 1.0 1.8 4.68 169 142 A 94 TYR H A 51 ARG HA 1.0 1.8 6.10 170 143 A 94 TYR HD2 A 51 ARG HA 1.0 1.8 5.94 171 143 A 94 TYR HD1 A 51 ARG HA 1.0 1.8 5.94 172 144 A 51 ARG HBx A 51 ARG HDy 1.0 1.8 4.68 173 145 A 51 ARG HBx A 51 ARG HDx 1.0 1.8 4.67 174 146 A 51 ARG HBx A 51 ARG HG3 1.0 1.8 3.20 175 146 A 51 ARG HBx A 51 ARG HG2 1.0 1.8 3.20 176 147 A 51 ARG HBx A 52 VAL H 1.0 1.8 5.33 177 148 A 51 ARG HBx A 53 ASP H 1.0 1.8 4.83 178 149 A 54 GLU H A 51 ARG HBx 1.0 1.8 4.55 179 150 A 52 VAL H A 51 ARG HBy 1.0 1.8 5.54 180 151 A 53 ASP H A 51 ARG HBy 1.0 1.8 4.70 181 152 A 54 GLU H A 51 ARG HBy 1.0 1.8 5.24 182 153 A 51 ARG HDy A 52 VAL H 1.0 1.8 6.24 183 154 A 93 VAL HG1% A 51 ARG HDy 1.0 1.8 5.17 184 154 A 93 VAL HG2% A 51 ARG HDy 1.0 1.8 5.17 185 155 A 51 ARG HDx A 52 VAL H 1.0 1.8 6.40 186 156 A 51 ARG HG3 A 52 VAL H 1.0 1.8 5.33 187 156 A 51 ARG HG2 A 52 VAL H 1.0 1.8 5.33 188 157 A 52 VAL H A 52 VAL HG1% 1.0 1.8 5.00 189 158 A 52 VAL H A 52 VAL HG2% 1.0 1.8 4.69 190 159 A 52 VAL H A 53 ASP H 1.0 1.8 5.20 191 160 A 52 VAL H A 55 ILE HD1% 1.0 1.8 5.71 192 161 A 52 VAL H A 55 ILE HG2% 1.0 1.8 6.33 193 162 A 52 VAL H A 92 PHE HD2 1.0 1.8 6.43 194 162 A 52 VAL H A 92 PHE HD1 1.0 1.8 6.43 195 163 A 93 VAL HA A 52 VAL H 1.0 1.8 6.00 196 164 A 94 TYR HD2 A 52 VAL H 1.0 1.8 6.19 197 164 A 94 TYR HD1 A 52 VAL H 1.0 1.8 6.19 198 165 A 52 VAL H A 94 TYR HE2 1.0 1.8 5.83 199 165 A 52 VAL H A 94 TYR HE1 1.0 1.8 5.83 200 166 A 52 VAL HG1% A 52 VAL HA 1.0 1.8 4.33 201 167 A 52 VAL HG2% A 52 VAL HA 1.0 1.8 4.53 202 168 A 54 GLU H A 52 VAL HA 1.0 1.8 5.59 203 169 A 52 VAL HA A 55 ILE H 1.0 1.8 5.41 204 170 A 52 VAL HA A 55 ILE HB 1.0 1.8 5.36 205 171 A 55 ILE HD1% A 52 VAL HA 1.0 1.8 4.61 206 172 A 52 VAL HA A 55 ILE HG13 1.0 1.8 5.75 207 172 A 52 VAL HA A 55 ILE HG12 1.0 1.8 5.75 208 173 A 55 ILE HG2% A 52 VAL HA 1.0 1.8 5.29 209 174 A 52 VAL HA A 56 TYR H 1.0 1.8 5.94 210 175 A 53 ASP H A 52 VAL HB 1.0 1.8 4.71 211 176 A 55 ILE HD1% A 52 VAL HB 1.0 1.8 5.52 212 177 A 56 TYR H A 52 VAL HB 1.0 1.8 6.14 213 178 A 53 ASP H A 52 VAL HG1% 1.0 1.8 4.82 214 179 A 54 GLU H A 52 VAL HG1% 1.0 1.8 6.62 215 180 A 52 VAL HG1% A 55 ILE H 1.0 1.8 6.85 216 181 A 52 VAL HG1% A 91 LYS HG3 1.0 1.8 4.20 217 181 A 52 VAL HG1% A 91 LYS HG2 1.0 1.8 4.20 218 182 A 92 PHE H A 52 VAL HG1% 1.0 1.8 6.18 219 183 A 52 VAL HG1% A 92 PHE HD2 1.0 1.8 5.65 220 183 A 52 VAL HG1% A 92 PHE HD1 1.0 1.8 5.65 221 184 A 94 TYR HD1 A 52 VAL HG1% 1.0 1.8 4.99 222 184 A 94 TYR HD2 A 52 VAL HG1% 1.0 1.8 4.99 223 185 A 53 ASP H A 52 VAL HG2% 1.0 1.8 4.35 224 186 A 52 VAL HG2% A 53 ASP HA 1.0 1.8 4.92 225 187 A 52 VAL HG2% A 53 ASP HBx 1.0 1.8 5.53 226 188 A 52 VAL HG2% A 53 ASP HBy 1.0 1.8 4.93 227 189 A 54 GLU H A 52 VAL HG2% 1.0 1.8 5.72 228 190 A 52 VAL HG2% A 55 ILE H 1.0 1.8 6.75 229 191 A 55 ILE HD1% A 52 VAL HG2% 1.0 1.8 5.06 230 192 A 52 VAL HG2% A 56 TYR H 1.0 1.8 6.57 231 193 A 52 VAL HG2% A 71 LYS HEx 1.0 1.8 4.53 232 194 A 52 VAL HG2% A 71 LYS HEy 1.0 1.8 4.37 233 195 A 92 PHE H A 52 VAL HG2% 1.0 1.8 6.75 234 196 A 52 VAL HG2% A 94 TYR HE2 1.0 1.8 5.57 235 196 A 52 VAL HG2% A 94 TYR HE1 1.0 1.8 5.57 236 197 A 53 ASP H A 53 ASP HBx 1.0 1.8 4.27 237 198 A 53 ASP H A 53 ASP HBy 1.0 1.8 4.22 238 199 A 54 GLU H A 53 ASP H 1.0 1.8 4.45 239 200 A 53 ASP H A 55 ILE H 1.0 1.8 5.42 240 201 A 53 ASP H A 55 ILE HG13 1.0 1.8 5.82 241 201 A 53 ASP H A 55 ILE HG12 1.0 1.8 5.82 242 202 A 53 ASP H A 91 LYS HD3 1.0 1.8 4.89 243 202 A 53 ASP H A 91 LYS HD2 1.0 1.8 4.89 244 203 A 53 ASP H A 91 LYS HG3 1.0 1.8 6.03 245 203 A 53 ASP H A 91 LYS HG2 1.0 1.8 6.03 246 204 A 56 TYR H A 53 ASP HA 1.0 1.8 4.91 247 205 A 53 ASP HA A 56 TYR HBy 1.0 1.8 4.86 248 206 A 53 ASP HA A 57 ALA H 1.0 1.8 5.40 249 207 A 53 ASP HA A 57 ALA HB% 1.0 1.8 5.92 250 208 A 54 GLU H A 53 ASP HBx 1.0 1.8 5.24 251 209 A 54 GLU H A 53 ASP HBy 1.0 1.8 5.22 252 210 A 54 GLU H A 54 GLU HBx 1.0 1.8 4.55 253 211 A 54 GLU H A 54 GLU HBy 1.0 1.8 4.56 254 212 A 54 GLU H A 54 GLU HG2 1.0 1.8 4.72 255 213 A 54 GLU H A 55 ILE H 1.0 1.8 4.73 256 214 A 54 GLU H A 55 ILE HA 1.0 1.8 6.27 257 215 A 54 GLU H A 55 ILE HD1% 1.0 1.8 5.75 258 216 A 54 GLU H A 55 ILE HG2% 1.0 1.8 5.79 259 217 A 54 GLU H A 57 ALA HB% 1.0 1.8 6.07 260 218 A 54 GLU HG2 A 54 GLU HA 1.0 1.8 4.30 261 219 A 56 TYR H A 54 GLU HA 1.0 1.8 6.08 262 220 A 57 ALA H A 54 GLU HA 1.0 1.8 5.14 263 221 A 54 GLU HBx A 55 ILE H 1.0 1.8 4.77 264 222 A 54 GLU HBx A 57 ALA H 1.0 1.8 6.75 265 223 A 54 GLU HBy A 55 ILE H 1.0 1.8 5.30 266 224 A 54 GLU HBy A 55 ILE HG13 1.0 1.8 5.07 267 224 A 54 GLU HBy A 55 ILE HG12 1.0 1.8 5.07 268 225 A 54 GLU HBy A 57 ALA H 1.0 1.8 6.17 269 226 A 54 GLU HG2 A 55 ILE H 1.0 1.8 5.51 270 227 A 54 GLU HG2 A 57 ALA H 1.0 1.8 6.39 271 228 A 55 ILE H A 55 ILE HB 1.0 1.8 4.34 272 229 A 55 ILE HD1% A 55 ILE H 1.0 1.8 4.67 273 230 A 55 ILE H A 55 ILE HG13 1.0 1.8 4.56 274 230 A 55 ILE H A 55 ILE HG12 1.0 1.8 4.56 275 231 A 55 ILE HG2% A 55 ILE H 1.0 1.8 4.77 276 232 A 55 ILE H A 56 TYR H 1.0 1.8 5.19 277 233 A 55 ILE H A 56 TYR HBx 1.0 1.8 6.38 278 234 A 55 ILE H A 57 ALA H 1.0 1.8 5.35 279 235 A 55 ILE HD1% A 55 ILE HA 1.0 1.8 5.47 280 236 A 55 ILE HG2% A 55 ILE HA 1.0 1.8 4.65 281 237 A 57 ALA H A 55 ILE HA 1.0 1.8 5.40 282 238 A 58 GLN H A 55 ILE HA 1.0 1.8 5.46 283 239 A 59 ILE H A 55 ILE HA 1.0 1.8 6.34 284 240 A 55 ILE HD1% A 55 ILE HB 1.0 1.8 4.16 285 241 A 55 ILE HB A 56 TYR H 1.0 1.8 4.49 286 242 A 55 ILE HD1% A 56 TYR H 1.0 1.8 4.98 287 243 A 55 ILE HD1% A 74 LEU HD1% 1.0 1.8 4.48 288 244 A 55 ILE HD1% A 74 LEU HD2% 1.0 1.8 3.88 289 245 A 94 TYR HBy A 55 ILE HD1% 1.0 1.8 5.46 290 246 A 94 TYR HD1 A 55 ILE HD1% 1.0 1.8 5.02 291 246 A 94 TYR HD2 A 55 ILE HD1% 1.0 1.8 5.02 292 247 A 55 ILE HD1% A 94 TYR HE2 1.0 1.8 5.99 293 247 A 55 ILE HD1% A 94 TYR HE1 1.0 1.8 5.99 294 248 A 55 ILE HG13 A 56 TYR H 1.0 1.8 3.42 295 248 A 55 ILE HG12 A 56 TYR H 1.0 1.8 3.42 296 249 A 55 ILE HD1% A 55 ILE HG2% 1.0 1.8 3.77 297 250 A 55 ILE HG2% A 55 ILE HG12 1.0 1.8 3.69 298 250 A 55 ILE HG2% A 55 ILE HG13 1.0 1.8 3.69 299 251 A 55 ILE HG2% A 56 TYR H 1.0 1.8 5.31 300 252 A 55 ILE HG2% A 57 ALA H 1.0 1.8 6.75 301 253 A 55 ILE HG2% A 74 LEU HD1% 1.0 1.8 5.40 302 254 A 55 ILE HG2% A 74 LEU HD2% 1.0 1.8 4.96 303 255 A 56 TYR H A 56 TYR HBy 1.0 1.8 4.69 304 256 A 56 TYR H A 56 TYR HBx 1.0 1.8 4.69 305 257 A 56 TYR H A 56 TYR HD2 1.0 1.8 4.91 306 257 A 56 TYR H A 56 TYR HD1 1.0 1.8 4.91 307 258 A 56 TYR H A 57 ALA H 1.0 1.8 4.63 308 259 A 56 TYR H A 57 ALA HB% 1.0 1.8 6.25 309 260 A 58 GLN H A 56 TYR H 1.0 1.8 5.92 310 261 A 58 GLN HE22 A 56 TYR H 1.0 1.8 6.75 311 262 A 59 ILE H A 56 TYR H 1.0 1.8 6.75 312 263 A 56 TYR H A 67 LEU HD2% 1.0 1.8 5.49 313 264 A 56 TYR H A 70 VAL HB 1.0 1.8 6.75 314 265 A 56 TYR H A 70 VAL HG2% 1.0 1.8 5.19 315 266 A 56 TYR HD2 A 56 TYR HA 1.0 1.8 4.78 316 266 A 56 TYR HD1 A 56 TYR HA 1.0 1.8 4.78 317 267 A 56 TYR HA A 56 TYR HE2 1.0 1.8 6.05 318 267 A 56 TYR HA A 56 TYR HE1 1.0 1.8 6.05 319 268 A 59 ILE H A 56 TYR HA 1.0 1.8 5.07 320 269 A 56 TYR HA A 59 ILE HG1x 1.0 1.8 4.93 321 270 A 67 LEU HD2% A 56 TYR HA 1.0 1.8 6.31 322 271 A 56 TYR HBy A 57 ALA H 1.0 1.8 4.97 323 272 A 58 GLN H A 56 TYR HBy 1.0 1.8 5.93 324 273 A 59 ILE H A 56 TYR HBy 1.0 1.8 6.68 325 274 A 57 ALA H A 56 TYR HBx 1.0 1.8 4.95 326 275 A 58 GLN H A 56 TYR HBx 1.0 1.8 6.10 327 276 A 56 TYR HBx A 67 LEU HD2% 1.0 1.8 4.31 328 277 A 57 ALA H A 56 TYR HD2 1.0 1.8 4.83 329 277 A 57 ALA H A 56 TYR HD1 1.0 1.8 4.83 330 278 A 56 TYR HD1 A 67 LEU HD1% 1.0 1.8 5.30 331 278 A 56 TYR HD2 A 67 LEU HD1% 1.0 1.8 5.30 332 279 A 56 TYR HD2 A 67 LEU HD2% 1.0 1.8 4.64 333 279 A 56 TYR HD1 A 67 LEU HD2% 1.0 1.8 4.64 334 280 A 56 TYR HD2 A 70 VAL H 1.0 1.8 6.53 335 280 A 56 TYR HD1 A 70 VAL H 1.0 1.8 6.53 336 281 A 71 LYS HEx A 56 TYR HD2 1.0 1.8 6.38 337 281 A 71 LYS HEx A 56 TYR HD1 1.0 1.8 6.38 338 282 A 56 TYR HE1 A 67 LEU HD1% 1.0 1.8 5.56 339 282 A 56 TYR HE2 A 67 LEU HD1% 1.0 1.8 5.56 340 283 A 67 LEU HD2% A 56 TYR HE1 1.0 1.8 5.98 341 283 A 67 LEU HD2% A 56 TYR HE2 1.0 1.8 5.98 342 284 A 56 TYR HE2 A 70 VAL H 1.0 1.8 6.70 343 284 A 56 TYR HE1 A 70 VAL H 1.0 1.8 6.70 344 285 A 57 ALA H A 57 ALA HB% 1.0 1.8 3.70 345 286 A 58 GLN HE21 A 57 ALA H 1.0 1.8 6.75 346 287 A 57 ALA H A 59 ILE HG1y 1.0 1.8 5.53 347 288 A 57 ALA H A 67 LEU HD2% 1.0 1.8 6.75 348 289 A 58 GLN H A 57 ALA HB% 1.0 1.8 4.40 349 290 A 57 ALA HB% A 58 GLN HA 1.0 1.8 5.23 350 291 A 58 GLN HE21 A 57 ALA HB% 1.0 1.8 4.37 351 292 A 58 GLN HE22 A 57 ALA HB% 1.0 1.8 5.36 352 293 A 59 ILE H A 57 ALA HB% 1.0 1.8 5.81 353 294 A 58 GLN H A 58 GLN HBx 1.0 1.8 4.05 354 295 A 58 GLN H A 58 GLN HBy 1.0 1.8 4.16 355 296 A 58 GLN H A 58 GLN HE21 1.0 1.8 5.57 356 297 A 58 GLN H A 58 GLN HE22 1.0 1.8 5.15 357 298 A 58 GLN H A 58 GLN HG3 1.0 1.8 4.62 358 298 A 58 GLN H A 58 GLN HG2 1.0 1.8 4.62 359 299 A 58 GLN H A 59 ILE H 1.0 1.8 4.22 360 300 A 58 GLN H A 59 ILE HG1x 1.0 1.8 6.75 361 301 A 58 GLN HE21 A 58 GLN HA 1.0 1.8 6.57 362 302 A 58 GLN HE22 A 58 GLN HA 1.0 1.8 5.99 363 303 A 58 GLN HE21 A 58 GLN HBx 1.0 1.8 5.70 364 304 A 58 GLN HE22 A 58 GLN HBx 1.0 1.8 6.48 365 305 A 58 GLN HE21 A 58 GLN HBy 1.0 1.8 5.41 366 306 A 58 GLN HE22 A 58 GLN HBy 1.0 1.8 6.74 367 307 A 59 ILE H A 58 GLN HBy 1.0 1.8 5.01 368 308 A 58 GLN HE21 A 58 GLN HG3 1.0 1.8 4.50 369 308 A 58 GLN HE21 A 58 GLN HG2 1.0 1.8 4.50 370 309 A 58 GLN HG3 A 59 ILE H 1.0 1.8 5.82 371 309 A 58 GLN HG2 A 59 ILE H 1.0 1.8 5.82 372 310 A 59 ILE H A 59 ILE HB 1.0 1.8 4.25 373 311 A 59 ILE H A 59 ILE HG1x 1.0 1.8 4.49 374 312 A 59 ILE H A 59 ILE HG1y 1.0 1.8 4.25 375 313 A 59 ILE HD1% A 59 ILE H 1.0 1.8 4.79 376 314 A 59 ILE H A 59 ILE HG2% 1.0 1.8 4.91 377 315 A 59 ILE H A 60 PRO HDy 1.0 1.8 5.82 378 316 A 59 ILE HD1% A 59 ILE HA 1.0 1.8 4.93 379 317 A 59 ILE HG2% A 59 ILE HA 1.0 1.8 4.55 380 318 A 59 ILE HD1% A 59 ILE HB 1.0 1.8 4.65 381 319 A 59 ILE HD1% A 65 TRP HE3 1.0 1.8 5.44 382 320 A 59 ILE HD1% A 70 VAL H 1.0 1.8 5.78 383 321 A 59 ILE HD1% A 70 VAL HA 1.0 1.8 5.70 384 322 A 59 ILE HD1% A 70 VAL HB 1.0 1.8 4.75 385 323 A 59 ILE HG1x A 59 ILE HG2% 1.0 1.8 4.25 386 324 A 59 ILE HG1y A 59 ILE HG2% 1.0 1.8 4.42 387 325 A 59 ILE HD1% A 59 ILE HG2% 1.0 1.8 3.79 388 326 A 59 ILE HG2% A 60 PRO HDy 1.0 1.8 4.90 389 327 A 59 ILE HG2% A 60 PRO HDx 1.0 1.8 5.77 390 328 A 65 TRP HE3 A 59 ILE HG2% 1.0 1.8 6.35 391 329 A 70 VAL HB A 59 ILE HG2% 1.0 1.8 4.99 392 330 A 61 GLN H A 61 GLN HB3 1.0 1.8 4.65 393 330 A 61 GLN H A 61 GLN HB2 1.0 1.8 4.65 394 331 A 61 GLN H A 61 GLN HG3 1.0 1.8 4.88 395 331 A 61 GLN H A 61 GLN HG2 1.0 1.8 4.88 396 332 A 61 GLN HA A 61 GLN HE21 1.0 1.8 5.49 397 333 A 61 GLN HA A 61 GLN HE22 1.0 1.8 5.52 398 334 A 61 GLN HG3 A 61 GLN HA 1.0 1.8 4.09 399 334 A 61 GLN HG2 A 61 GLN HA 1.0 1.8 4.09 400 335 A 61 GLN HB3 A 61 GLN HE21 1.0 1.8 5.83 401 335 A 61 GLN HB2 A 61 GLN HE21 1.0 1.8 5.83 402 336 A 61 GLN HB3 A 61 GLN HE22 1.0 1.8 5.72 403 336 A 61 GLN HB2 A 61 GLN HE22 1.0 1.8 5.72 404 337 A 61 GLN HB3 A 61 GLN HG2 1.0 1.8 3.42 405 337 A 61 GLN HB2 A 61 GLN HG3 1.0 1.8 3.42 406 337 A 61 GLN HB2 A 61 GLN HG2 1.0 1.8 3.42 407 337 A 61 GLN HB3 A 61 GLN HG3 1.0 1.8 3.42 408 338 A 61 GLN HG3 A 61 GLN HE21 1.0 1.8 4.49 409 338 A 61 GLN HG2 A 61 GLN HE21 1.0 1.8 4.49 410 339 A 61 GLN HG3 A 62 GLU H 1.0 1.8 5.80 411 339 A 61 GLN HG2 A 62 GLU H 1.0 1.8 5.80 412 340 A 62 GLU H A 62 GLU HGy 1.0 1.8 5.54 413 341 A 62 GLU H A 62 GLU HGx 1.0 1.8 5.64 414 342 A 62 GLU HGy A 62 GLU HA 1.0 1.8 3.91 415 343 A 62 GLU HGx A 62 GLU HA 1.0 1.8 3.96 416 344 A 62 GLU HGy A 63 LEU H 1.0 1.8 5.57 417 345 A 62 GLU HGx A 63 LEU H 1.0 1.8 5.27 418 346 A 62 GLU HGy A 62 GLU HB3 1.0 1.8 3.26 419 346 A 62 GLU HGy A 62 GLU HB2 1.0 1.8 3.26 420 347 A 63 LEU H A 62 GLU HB3 1.0 1.8 5.58 421 347 A 63 LEU H A 62 GLU HB2 1.0 1.8 5.58 422 348 A 63 LEU H A 63 LEU HG 1.0 1.8 4.67 423 349 A 63 LEU HD1% A 63 LEU H 1.0 1.8 4.94 424 350 A 63 LEU H A 63 LEU HD2% 1.0 1.8 4.61 425 351 A 63 LEU H A 64 GLU H 1.0 1.8 4.37 426 352 A 63 LEU H A 64 GLU HGx 1.0 1.8 5.87 427 353 A 63 LEU H A 64 GLU HGy 1.0 1.8 5.68 428 354 A 63 LEU H A 65 TRP H 1.0 1.8 6.17 429 355 A 63 LEU HD1% A 63 LEU HA 1.0 1.8 5.12 430 356 A 63 LEU HD2% A 63 LEU HA 1.0 1.8 3.99 431 357 A 64 GLU H A 63 LEU HA 1.0 1.8 4.07 432 358 A 63 LEU HD2% A 63 LEU HBy 1.0 1.8 4.28 433 359 A 64 GLU H A 63 LEU HBy 1.0 1.8 5.20 434 360 A 65 TRP H A 63 LEU HBy 1.0 1.8 5.17 435 361 A 63 LEU HD2% A 63 LEU HBx 1.0 1.8 4.39 436 362 A 64 GLU H A 63 LEU HBx 1.0 1.8 5.90 437 363 A 65 TRP H A 63 LEU HBx 1.0 1.8 5.53 438 364 A 63 LEU HG A 64 GLU H 1.0 1.8 6.12 439 365 A 63 LEU HD1% A 64 GLU H 1.0 1.8 5.88 440 366 A 63 LEU HD1% A 65 TRP H 1.0 1.8 5.84 441 367 A 63 LEU HD1% A 65 TRP HZ2 1.0 1.8 6.27 442 368 A 63 LEU HD1% A 65 TRP HZ3 1.0 1.8 6.47 443 369 A 63 LEU HD2% A 64 GLU H 1.0 1.8 5.79 444 370 A 64 GLU H A 64 GLU HGx 1.0 1.8 4.90 445 371 A 64 GLU H A 64 GLU HGy 1.0 1.8 4.91 446 372 A 64 GLU H A 64 GLU HB3 1.0 1.8 4.36 447 372 A 64 GLU H A 64 GLU HB2 1.0 1.8 4.36 448 373 A 64 GLU H A 65 TRP H 1.0 1.8 4.67 449 374 A 64 GLU HGx A 64 GLU HA 1.0 1.8 4.39 450 375 A 64 GLU HGy A 64 GLU HA 1.0 1.8 4.41 451 376 A 64 GLU HGx A 65 TRP H 1.0 1.8 5.75 452 377 A 64 GLU HGy A 65 TRP H 1.0 1.8 5.77 453 378 A 65 TRP H A 64 GLU HB3 1.0 1.8 5.42 454 378 A 65 TRP H A 64 GLU HB2 1.0 1.8 5.42 455 379 A 65 TRP H A 65 TRP HD1 1.0 1.8 4.84 456 380 A 65 TRP H A 65 TRP HE1 1.0 1.8 6.32 457 381 A 65 TRP H A 65 TRP HB3 1.0 1.8 4.28 458 381 A 65 TRP H A 65 TRP HB2 1.0 1.8 4.28 459 382 A 65 TRP HD1 A 65 TRP HA 1.0 1.8 4.59 460 383 A 65 TRP HE1 A 65 TRP HA 1.0 1.8 6.34 461 384 A 65 TRP HD1 A 69 THR HG2% 1.0 1.8 6.18 462 385 A 65 TRP HZ3 A 69 THR HG2% 1.0 1.8 5.21 463 386 A 65 TRP HB3 A 69 THR H 1.0 1.8 5.64 464 386 A 65 TRP HB2 A 69 THR H 1.0 1.8 5.64 465 387 A 66 SER HA A 68 ALA H 1.0 1.8 6.33 466 388 A 69 THR H A 66 SER HA 1.0 1.8 5.32 467 389 A 66 SER HBy A 67 LEU H 1.0 1.8 5.82 468 390 A 69 THR H A 66 SER HBy 1.0 1.8 5.49 469 391 A 67 LEU H A 66 SER HBx 1.0 1.8 5.64 470 392 A 69 THR H A 66 SER HBx 1.0 1.8 5.61 471 393 A 67 LEU H A 67 LEU HG 1.0 1.8 6.20 472 394 A 67 LEU HD1% A 67 LEU H 1.0 1.8 5.43 473 395 A 67 LEU HD2% A 67 LEU H 1.0 1.8 5.16 474 396 A 67 LEU HD1% A 67 LEU HA 1.0 1.8 4.85 475 397 A 67 LEU HD2% A 67 LEU HA 1.0 1.8 4.18 476 398 A 70 VAL H A 67 LEU HA 1.0 1.8 5.41 477 399 A 70 VAL HB A 67 LEU HA 1.0 1.8 5.66 478 400 A 67 LEU HA A 71 LYS H 1.0 1.8 5.99 479 401 A 67 LEU HD1% A 67 LEU HBy 1.0 1.8 4.48 480 402 A 67 LEU HD2% A 67 LEU HBy 1.0 1.8 4.25 481 403 A 67 LEU HD1% A 67 LEU HBx 1.0 1.8 4.09 482 404 A 67 LEU HD2% A 67 LEU HBx 1.0 1.8 4.48 483 405 A 67 LEU HD1% A 68 ALA H 1.0 1.8 6.54 484 406 A 67 LEU HD1% A 68 ALA HA 1.0 1.8 6.48 485 407 A 71 LYS HEx A 67 LEU HD1% 1.0 1.8 4.48 486 408 A 71 LYS HEy A 67 LEU HD1% 1.0 1.8 5.05 487 409 A 67 LEU HD2% A 70 VAL H 1.0 1.8 5.94 488 410 A 67 LEU HD2% A 70 VAL HB 1.0 1.8 5.66 489 411 A 67 LEU HD2% A 71 LYS H 1.0 1.8 6.74 490 412 A 71 LYS HEx A 67 LEU HD2% 1.0 1.8 6.75 491 413 A 69 THR H A 68 ALA H 1.0 1.8 5.65 492 414 A 70 VAL H A 68 ALA HA 1.0 1.8 5.79 493 415 A 71 LYS H A 68 ALA HA 1.0 1.8 4.79 494 416 A 68 ALA HA A 71 LYS HB3 1.0 1.8 4.80 495 416 A 68 ALA HA A 71 LYS HB2 1.0 1.8 4.80 496 417 A 68 ALA HA A 71 LYS HD3 1.0 1.8 4.88 497 417 A 68 ALA HA A 71 LYS HD2 1.0 1.8 4.88 498 418 A 69 THR H A 68 ALA HB% 1.0 1.8 4.18 499 419 A 69 THR H A 69 THR HB 1.0 1.8 4.17 500 420 A 69 THR HG2% A 69 THR H 1.0 1.8 5.31 501 421 A 70 VAL H A 69 THR H 1.0 1.8 4.73 502 422 A 69 THR H A 71 LYS H 1.0 1.8 5.28 503 423 A 69 THR H A 72 THR HG2% 1.0 1.8 5.51 504 424 A 69 THR HG2% A 69 THR HA 1.0 1.8 4.42 505 425 A 71 LYS H A 69 THR HA 1.0 1.8 6.11 506 426 A 69 THR HA A 72 THR H 1.0 1.8 4.97 507 427 A 69 THR HA A 73 LEU H 1.0 1.8 5.29 508 428 A 70 VAL H A 69 THR HB 1.0 1.8 4.63 509 429 A 71 LYS H A 69 THR HB 1.0 1.8 5.65 510 430 A 70 VAL H A 69 THR HG2% 1.0 1.8 4.88 511 431 A 69 THR HG2% A 71 LYS H 1.0 1.8 6.66 512 432 A 69 THR HG2% A 72 THR H 1.0 1.8 6.17 513 433 A 69 THR HG2% A 72 THR HG2% 1.0 1.8 6.47 514 434 A 69 THR HG2% A 73 LEU H 1.0 1.8 5.46 515 435 A 69 THR HG2% A 73 LEU HB3 1.0 1.8 5.64 516 435 A 69 THR HG2% A 73 LEU HB2 1.0 1.8 5.64 517 436 A 73 LEU HD1% A 69 THR HG2% 1.0 1.8 4.62 518 437 A 70 VAL HB A 70 VAL H 1.0 1.8 4.64 519 438 A 70 VAL H A 70 VAL HG1% 1.0 1.8 4.32 520 439 A 70 VAL HG2% A 70 VAL H 1.0 1.8 4.89 521 440 A 70 VAL H A 71 LYS H 1.0 1.8 4.88 522 441 A 70 VAL H A 71 LYS HB3 1.0 1.8 6.34 523 441 A 70 VAL H A 71 LYS HB2 1.0 1.8 6.34 524 442 A 70 VAL H A 72 THR H 1.0 1.8 5.77 525 443 A 70 VAL H A 72 THR HG2% 1.0 1.8 6.14 526 444 A 73 LEU HD1% A 70 VAL H 1.0 1.8 6.35 527 445 A 70 VAL HA A 70 VAL HG1% 1.0 1.8 4.41 528 446 A 70 VAL HG2% A 70 VAL HA 1.0 1.8 4.74 529 447 A 70 VAL HA A 72 THR HG2% 1.0 1.8 5.78 530 448 A 70 VAL HA A 73 LEU H 1.0 1.8 5.62 531 449 A 70 VAL HA A 74 LEU H 1.0 1.8 5.93 532 450 A 70 VAL HB A 71 LYS H 1.0 1.8 4.76 533 451 A 71 LYS H A 70 VAL HG1% 1.0 1.8 5.04 534 452 A 72 THR H A 70 VAL HG1% 1.0 1.8 6.08 535 453 A 73 LEU H A 70 VAL HG1% 1.0 1.8 6.64 536 454 A 74 LEU HD1% A 70 VAL HG1% 1.0 1.8 5.30 537 455 A 70 VAL HG2% A 71 LYS H 1.0 1.8 4.72 538 456 A 70 VAL HG2% A 72 THR H 1.0 1.8 6.95 539 457 A 70 VAL HG2% A 73 LEU H 1.0 1.8 5.79 540 458 A 70 VAL HG2% A 74 LEU H 1.0 1.8 5.52 541 459 A 74 LEU HD1% A 70 VAL HG2% 1.0 1.8 4.62 542 460 A 71 LYS HEx A 71 LYS H 1.0 1.8 5.71 543 461 A 71 LYS HEy A 71 LYS H 1.0 1.8 6.75 544 462 A 71 LYS H A 71 LYS HGy 1.0 1.8 4.59 545 463 A 71 LYS H A 71 LYS HGx 1.0 1.8 5.25 546 464 A 71 LYS H A 71 LYS HB3 1.0 1.8 4.13 547 464 A 71 LYS H A 71 LYS HB2 1.0 1.8 4.13 548 465 A 71 LYS H A 71 LYS HD3 1.0 1.8 4.88 549 465 A 71 LYS H A 71 LYS HD2 1.0 1.8 4.88 550 466 A 71 LYS H A 72 THR H 1.0 1.8 4.88 551 467 A 71 LYS H A 72 THR HG2% 1.0 1.8 5.70 552 468 A 71 LYS HEx A 71 LYS HA 1.0 1.8 6.75 553 469 A 71 LYS HEy A 71 LYS HA 1.0 1.8 6.49 554 470 A 71 LYS HD3 A 71 LYS HA 1.0 1.8 5.15 555 470 A 71 LYS HD2 A 71 LYS HA 1.0 1.8 5.15 556 471 A 74 LEU H A 71 LYS HA 1.0 1.8 5.90 557 472 A 74 LEU HD1% A 71 LYS HA 1.0 1.8 5.21 558 473 A 71 LYS HA A 75 GLY H 1.0 1.8 5.23 559 474 A 72 THR H A 71 LYS HGy 1.0 1.8 5.30 560 475 A 71 LYS HEx A 71 LYS HGx 1.0 1.8 4.05 561 476 A 71 LYS HEy A 71 LYS HGx 1.0 1.8 4.22 562 477 A 72 THR H A 71 LYS HGx 1.0 1.8 5.54 563 478 A 71 LYS HEx A 71 LYS HB3 1.0 1.8 4.93 564 478 A 71 LYS HEx A 71 LYS HB2 1.0 1.8 4.93 565 479 A 71 LYS HEy A 71 LYS HB3 1.0 1.8 4.97 566 479 A 71 LYS HEy A 71 LYS HB2 1.0 1.8 4.97 567 480 A 71 LYS HB3 A 71 LYS HD2 1.0 1.8 3.89 568 480 A 71 LYS HB3 A 71 LYS HD3 1.0 1.8 3.89 569 480 A 71 LYS HB2 A 71 LYS HD3 1.0 1.8 3.89 570 480 A 71 LYS HB2 A 71 LYS HD2 1.0 1.8 3.89 571 481 A 71 LYS HB3 A 72 THR H 1.0 1.8 4.38 572 481 A 71 LYS HB2 A 72 THR H 1.0 1.8 4.38 573 482 A 71 LYS HD3 A 72 THR H 1.0 1.8 5.64 574 482 A 71 LYS HD2 A 72 THR H 1.0 1.8 5.64 575 483 A 72 THR H A 72 THR HB 1.0 1.8 4.20 576 484 A 72 THR HG2% A 72 THR H 1.0 1.8 4.59 577 485 A 72 THR H A 73 LEU H 1.0 1.8 4.96 578 486 A 72 THR H A 74 LEU H 1.0 1.8 5.87 579 487 A 72 THR H A 75 GLY H 1.0 1.8 6.75 580 488 A 72 THR HG2% A 72 THR HA 1.0 1.8 4.32 581 489 A 74 LEU H A 72 THR HA 1.0 1.8 5.63 582 490 A 75 GLY H A 72 THR HA 1.0 1.8 4.26 583 491 A 72 THR HA A 76 ARG H 1.0 1.8 5.59 584 492 A 73 LEU H A 72 THR HB 1.0 1.8 5.58 585 493 A 72 THR HG2% A 73 LEU H 1.0 1.8 4.70 586 494 A 72 THR HG2% A 73 LEU HB3 1.0 1.8 5.56 587 494 A 72 THR HG2% A 73 LEU HB2 1.0 1.8 5.56 588 495 A 72 THR HG2% A 74 LEU H 1.0 1.8 6.11 589 496 A 73 LEU HG A 73 LEU H 1.0 1.8 5.92 590 497 A 73 LEU H A 73 LEU HB3 1.0 1.8 4.69 591 497 A 73 LEU H A 73 LEU HB2 1.0 1.8 4.69 592 498 A 73 LEU HD1% A 73 LEU H 1.0 1.8 5.21 593 499 A 73 LEU HD2% A 73 LEU H 1.0 1.8 5.24 594 500 A 73 LEU H A 74 LEU H 1.0 1.8 5.14 595 501 A 73 LEU HD1% A 73 LEU HA 1.0 1.8 6.12 596 502 A 73 LEU HD2% A 73 LEU HA 1.0 1.8 4.66 597 503 A 76 ARG H A 73 LEU HA 1.0 1.8 6.75 598 504 A 73 LEU O A 77 LEU H 1.0 1.8 2.50 599 505 A 73 LEU O A 77 LEU N 1.0 1.8 3.50 600 506 A 73 LEU HD2% A 73 LEU HB3 1.0 1.8 4.58 601 506 A 73 LEU HD2% A 73 LEU HB2 1.0 1.8 4.58 602 507 A 73 LEU HB3 A 74 LEU H 1.0 1.8 4.91 603 507 A 73 LEU HB2 A 74 LEU H 1.0 1.8 4.91 604 508 A 73 LEU HD2% A 74 LEU H 1.0 1.8 4.88 605 509 A 73 LEU HD2% A 75 GLY H 1.0 1.8 6.32 606 510 A 73 LEU HD2% A 76 ARG H 1.0 1.8 6.02 607 511 A 74 LEU H A 74 LEU HG 1.0 1.8 5.00 608 512 A 74 LEU HD1% A 74 LEU H 1.0 1.8 5.29 609 513 A 74 LEU HD2% A 74 LEU H 1.0 1.8 5.00 610 514 A 74 LEU H A 75 GLY H 1.0 1.8 4.84 611 515 A 74 LEU HD1% A 74 LEU HA 1.0 1.8 5.59 612 516 A 74 LEU HD2% A 74 LEU HA 1.0 1.8 4.63 613 517 A 77 LEU H A 74 LEU HA 1.0 1.8 5.24 614 518 A 77 LEU HD1% A 74 LEU HA 1.0 1.8 4.67 615 519 A 77 LEU HD2% A 74 LEU HA 1.0 1.8 5.30 616 520 A 75 GLY H A 74 LEU HBy 1.0 1.8 4.84 617 521 A 75 GLY H A 74 LEU HG 1.0 1.8 5.04 618 522 A 76 ARG H A 74 LEU HG 1.0 1.8 6.30 619 523 A 74 LEU HD1% A 75 GLY H 1.0 1.8 5.38 620 524 A 74 LEU HD1% A 78 VAL HG1% 1.0 1.8 6.19 621 525 A 74 LEU HD2% A 75 GLY H 1.0 1.8 5.55 622 526 A 74 LEU HD2% A 77 LEU H 1.0 1.8 5.99 623 527 A 74 LEU HD2% A 78 VAL HG1% 1.0 1.8 6.05 624 528 A 75 GLY H A 75 GLY HAx 1.0 1.8 3.38 625 529 A 75 GLY H A 75 GLY HAy 1.0 1.8 3.33 626 530 A 75 GLY H A 76 ARG H 1.0 1.8 4.49 627 531 A 75 GLY H A 76 ARG HBy 1.0 1.8 6.20 628 532 A 75 GLY H A 76 ARG HGy 1.0 1.8 6.20 629 533 A 75 GLY H A 78 VAL HG2% 1.0 1.8 6.69 630 534 A 75 GLY HAx A 78 VAL H 1.0 1.8 5.58 631 535 A 78 VAL HG1% A 75 GLY HAx 1.0 1.8 4.94 632 536 A 75 GLY HAx A 78 VAL HG2% 1.0 1.8 6.27 633 537 A 75 GLY HAy A 78 VAL H 1.0 1.8 6.10 634 538 A 75 GLY HAy A 78 VAL HG2% 1.0 1.8 6.55 635 539 A 76 ARG H A 76 ARG HDx 1.0 1.8 5.87 636 540 A 76 ARG H A 76 ARG HDy 1.0 1.8 5.81 637 541 A 76 ARG H A 76 ARG HGx 1.0 1.8 4.77 638 542 A 76 ARG H A 76 ARG HGy 1.0 1.8 4.40 639 543 A 76 ARG H A 77 LEU H 1.0 1.8 4.72 640 544 A 77 LEU HD2% A 76 ARG H 1.0 1.8 5.48 641 545 A 76 ARG H A 78 VAL H 1.0 1.8 5.55 642 546 A 76 ARG H A 78 VAL HG1% 1.0 1.8 5.51 643 547 A 76 ARG H A 79 LYS H 1.0 1.8 6.34 644 548 A 76 ARG HDx A 76 ARG HA 1.0 1.8 6.75 645 549 A 76 ARG HDy A 76 ARG HA 1.0 1.8 5.51 646 550 A 77 LEU H A 76 ARG HBy 1.0 1.8 4.52 647 551 A 76 ARG HBy A 78 VAL H 1.0 1.8 5.52 648 552 A 76 ARG HDy A 76 ARG HBx 1.0 1.8 4.42 649 553 A 78 VAL H A 76 ARG HBx 1.0 1.8 6.36 650 554 A 77 LEU H A 76 ARG HGx 1.0 1.8 5.67 651 555 A 77 LEU H A 76 ARG HGy 1.0 1.8 5.33 652 556 A 77 LEU H A 77 LEU HG 1.0 1.8 5.83 653 557 A 77 LEU HD1% A 77 LEU H 1.0 1.8 4.72 654 558 A 77 LEU HD2% A 77 LEU H 1.0 1.8 4.67 655 559 A 77 LEU H A 78 VAL H 1.0 1.8 5.05 656 560 A 77 LEU HD1% A 77 LEU HA 1.0 1.8 5.65 657 561 A 77 LEU HD2% A 77 LEU HA 1.0 1.8 4.41 658 562 A 79 LYS H A 77 LEU HA 1.0 1.8 5.69 659 563 A 77 LEU HA A 80 LYS H 1.0 1.8 5.87 660 564 A 77 LEU HA A 82 MET H 1.0 1.8 5.48 661 565 A 77 LEU HD1% A 77 LEU HBy 1.0 1.8 4.13 662 566 A 77 LEU HD2% A 77 LEU HBy 1.0 1.8 4.29 663 567 A 78 VAL H A 77 LEU HBy 1.0 1.8 5.68 664 568 A 78 VAL HG2% A 77 LEU HBy 1.0 1.8 6.36 665 569 A 82 MET H A 77 LEU HBy 1.0 1.8 5.90 666 570 A 77 LEU HBy A 83 LEU H 1.0 1.8 4.90 667 571 A 77 LEU HD1% A 77 LEU HBx 1.0 1.8 4.28 668 572 A 77 LEU HD2% A 77 LEU HBx 1.0 1.8 4.64 669 573 A 82 MET H A 77 LEU HBx 1.0 1.8 5.93 670 574 A 78 VAL H A 77 LEU HG 1.0 1.8 5.09 671 575 A 77 LEU HD1% A 78 VAL H 1.0 1.8 5.09 672 576 A 77 LEU HD2% A 78 VAL H 1.0 1.8 5.47 673 577 A 77 LEU HD2% A 82 MET H 1.0 1.8 6.69 674 578 A 78 VAL H A 78 VAL HB 1.0 1.8 4.61 675 579 A 78 VAL HG1% A 78 VAL H 1.0 1.8 4.49 676 580 A 78 VAL HG2% A 78 VAL H 1.0 1.8 4.77 677 581 A 78 VAL H A 79 LYS H 1.0 1.8 4.70 678 582 A 78 VAL H A 82 MET HB3 1.0 1.8 6.23 679 582 A 78 VAL H A 82 MET HB2 1.0 1.8 6.23 680 583 A 78 VAL HG1% A 78 VAL HA 1.0 1.8 4.67 681 584 A 78 VAL HA A 81 GLU H 1.0 1.8 6.20 682 585 A 82 MET H A 78 VAL HA 1.0 1.8 5.62 683 586 A 83 LEU H A 78 VAL HA 1.0 1.8 4.78 684 587 A 79 LYS H A 78 VAL HB 1.0 1.8 5.23 685 588 A 78 VAL HG1% A 79 LYS H 1.0 1.8 5.10 686 589 A 78 VAL HG1% A 85 THR HG2% 1.0 1.8 3.87 687 590 A 94 TYR HE1 A 78 VAL HG1% 1.0 1.8 5.14 688 590 A 94 TYR HE2 A 78 VAL HG1% 1.0 1.8 5.14 689 591 A 78 VAL HG2% A 79 LYS H 1.0 1.8 4.64 690 592 A 78 VAL HG2% A 79 LYS HA 1.0 1.8 4.82 691 593 A 78 VAL HG2% A 79 LYS HGx 1.0 1.8 6.33 692 594 A 78 VAL HG2% A 79 LYS HD3 1.0 1.8 4.61 693 594 A 78 VAL HG2% A 79 LYS HD2 1.0 1.8 4.61 694 595 A 78 VAL HG2% A 85 THR H 1.0 1.8 5.30 695 596 A 79 LYS H A 79 LYS HGy 1.0 1.8 4.89 696 597 A 79 LYS H A 79 LYS HGx 1.0 1.8 5.01 697 598 A 79 LYS H A 79 LYS HB3 1.0 1.8 4.64 698 598 A 79 LYS H A 79 LYS HB2 1.0 1.8 4.64 699 599 A 79 LYS H A 79 LYS HD3 1.0 1.8 4.46 700 599 A 79 LYS H A 79 LYS HD2 1.0 1.8 4.46 701 600 A 79 LYS H A 79 LYS HE3 1.0 1.8 5.39 702 600 A 79 LYS H A 79 LYS HE2 1.0 1.8 5.39 703 601 A 79 LYS H A 80 LYS H 1.0 1.8 4.41 704 602 A 79 LYS HA A 79 LYS HGy 1.0 1.8 4.70 705 603 A 79 LYS HA A 79 LYS HGx 1.0 1.8 4.61 706 604 A 79 LYS HA A 79 LYS HD3 1.0 1.8 4.09 707 604 A 79 LYS HA A 79 LYS HD2 1.0 1.8 4.09 708 605 A 79 LYS HA A 79 LYS HE3 1.0 1.8 4.98 709 605 A 79 LYS HA A 79 LYS HE2 1.0 1.8 4.98 710 606 A 79 LYS HGy A 79 LYS HE3 1.0 1.8 4.14 711 606 A 79 LYS HGy A 79 LYS HE2 1.0 1.8 4.14 712 607 A 80 LYS H A 79 LYS HGy 1.0 1.8 5.76 713 608 A 79 LYS HGx A 79 LYS HE3 1.0 1.8 4.17 714 608 A 79 LYS HGx A 79 LYS HE2 1.0 1.8 4.17 715 609 A 80 LYS H A 79 LYS HGx 1.0 1.8 6.64 716 610 A 79 LYS HGx A 79 LYS HB3 1.0 1.8 2.90 717 610 A 79 LYS HGx A 79 LYS HB2 1.0 1.8 2.90 718 611 A 79 LYS HD2 A 79 LYS HB3 1.0 1.8 4.50 719 611 A 79 LYS HD3 A 79 LYS HB2 1.0 1.8 4.50 720 611 A 79 LYS HD2 A 79 LYS HB2 1.0 1.8 4.50 721 611 A 79 LYS HD3 A 79 LYS HB3 1.0 1.8 4.50 722 612 A 79 LYS HB3 A 79 LYS HE2 1.0 1.8 3.32 723 612 A 79 LYS HB3 A 79 LYS HE3 1.0 1.8 3.32 724 612 A 79 LYS HB2 A 79 LYS HE3 1.0 1.8 3.32 725 612 A 79 LYS HB2 A 79 LYS HE2 1.0 1.8 3.32 726 613 A 80 LYS H A 79 LYS HB3 1.0 1.8 4.89 727 613 A 80 LYS H A 79 LYS HB2 1.0 1.8 4.89 728 614 A 80 LYS H A 79 LYS HD3 1.0 1.8 5.79 729 614 A 80 LYS H A 79 LYS HD2 1.0 1.8 5.79 730 615 A 82 MET H A 80 LYS HA 1.0 1.8 5.85 731 616 A 81 GLU H A 80 LYS HB3 1.0 1.8 4.76 732 616 A 81 GLU H A 80 LYS HB2 1.0 1.8 4.76 733 617 A 82 MET H A 80 LYS HB3 1.0 1.8 4.63 734 617 A 82 MET H A 80 LYS HB2 1.0 1.8 4.63 735 618 A 82 MET H A 81 GLU H 1.0 1.8 4.40 736 619 A 83 LEU H A 81 GLU HA 1.0 1.8 5.69 737 620 A 82 MET H A 82 MET HB3 1.0 1.8 4.67 738 620 A 82 MET H A 82 MET HB2 1.0 1.8 4.67 739 621 A 82 MET H A 82 MET HG3 1.0 1.8 4.24 740 621 A 82 MET H A 82 MET HG2 1.0 1.8 4.24 741 622 A 82 MET H A 83 LEU H 1.0 1.8 4.18 742 623 A 82 MET H A 83 LEU HD2% 1.0 1.8 6.05 743 624 A 82 MET HG3 A 82 MET HA 1.0 1.8 4.14 744 624 A 82 MET HG2 A 82 MET HA 1.0 1.8 4.14 745 625 A 83 LEU H A 82 MET HB3 1.0 1.8 4.84 746 625 A 83 LEU H A 82 MET HB2 1.0 1.8 4.84 747 626 A 83 LEU H A 82 MET HG3 1.0 1.8 4.72 748 626 A 83 LEU H A 82 MET HG2 1.0 1.8 4.72 749 627 A 83 LEU H A 83 LEU HD2% 1.0 1.8 4.45 750 628 A 83 LEU H A 84 SER H 1.0 1.8 5.68 751 629 A 83 LEU HD2% A 83 LEU HA 1.0 1.8 5.27 752 630 A 84 SER H A 83 LEU HBx 1.0 1.8 4.83 753 631 A 84 SER H A 83 LEU HBy 1.0 1.8 4.79 754 632 A 83 LEU HD2% A 84 SER H 1.0 1.8 4.79 755 633 A 85 THR H A 84 SER H 1.0 1.8 5.53 756 634 A 84 SER H A 95 ARG H 1.0 1.8 5.13 757 635 A 84 SER H A 95 ARG O 1.0 1.8 2.50 758 636 A 84 SER H A 95 ARG HB3 1.0 1.8 6.48 759 636 A 84 SER H A 95 ARG HB2 1.0 1.8 6.48 760 637 A 85 THR H A 84 SER HA 1.0 1.8 3.78 761 638 A 85 THR HG2% A 84 SER HA 1.0 1.8 4.34 762 639 A 85 THR H A 84 SER HBy 1.0 1.8 4.35 763 640 A 84 SER HBy A 86 GLU H 1.0 1.8 6.75 764 641 A 84 SER HBy A 97 LEU HD2% 1.0 1.8 4.67 765 642 A 85 THR H A 84 SER HBx 1.0 1.8 4.38 766 643 A 85 THR HG2% A 84 SER HBx 1.0 1.8 5.32 767 644 A 97 LEU HD2% A 84 SER HBx 1.0 1.8 4.66 768 645 A 95 ARG O A 84 SER N 1.0 1.8 3.50 769 646 A 85 THR HG2% A 85 THR H 1.0 1.8 4.45 770 647 A 85 THR HG2% A 85 THR HA 1.0 1.8 4.44 771 648 A 85 THR HA A 93 VAL H 1.0 1.8 5.67 772 649 A 85 THR HA A 94 TYR HA 1.0 1.8 4.78 773 650 A 94 TYR HD2 A 85 THR HA 1.0 1.8 5.81 774 650 A 94 TYR HD1 A 85 THR HA 1.0 1.8 5.81 775 651 A 95 ARG H A 85 THR HA 1.0 1.8 3.36 776 652 A 86 GLU H A 85 THR HB 1.0 1.8 4.58 777 653 A 85 THR HG2% A 86 GLU H 1.0 1.8 5.18 778 654 A 92 PHE HD1 A 85 THR HG2% 1.0 1.8 5.35 779 654 A 92 PHE HD2 A 85 THR HG2% 1.0 1.8 5.35 780 655 A 85 THR HG2% A 92 PHE HE1 1.0 1.8 5.51 781 655 A 85 THR HG2% A 92 PHE HE2 1.0 1.8 5.51 782 656 A 94 TYR HD1 A 85 THR HG2% 1.0 1.8 5.34 783 656 A 94 TYR HD2 A 85 THR HG2% 1.0 1.8 5.34 784 657 A 94 TYR HE2 A 85 THR HG2% 1.0 1.8 5.49 785 657 A 94 TYR HE1 A 85 THR HG2% 1.0 1.8 5.49 786 658 A 85 THR HG2% A 95 ARG H 1.0 1.8 6.50 787 659 A 86 GLU H A 86 GLU HG3 1.0 1.8 4.47 788 659 A 86 GLU H A 86 GLU HG2 1.0 1.8 4.47 789 660 A 86 GLU H A 92 PHE HA 1.0 1.8 5.77 790 661 A 92 PHE HD2 A 86 GLU H 1.0 1.8 6.75 791 661 A 92 PHE HD1 A 86 GLU H 1.0 1.8 6.75 792 662 A 86 GLU H A 93 VAL H 1.0 1.8 4.82 793 663 A 93 VAL HA A 86 GLU H 1.0 1.8 6.73 794 664 A 86 GLU H A 93 VAL O 1.0 1.8 2.50 795 665 A 93 VAL HG1% A 86 GLU H 1.0 1.8 5.37 796 665 A 93 VAL HG2% A 86 GLU H 1.0 1.8 5.37 797 666 A 86 GLU H A 94 TYR HA 1.0 1.8 4.42 798 667 A 94 TYR HD2 A 86 GLU H 1.0 1.8 6.75 799 667 A 94 TYR HD1 A 86 GLU H 1.0 1.8 6.75 800 668 A 86 GLU HG3 A 86 GLU HA 1.0 1.8 4.47 801 668 A 86 GLU HG2 A 86 GLU HA 1.0 1.8 4.47 802 669 A 93 VAL H A 86 GLU HA 1.0 1.8 5.64 803 670 A 86 GLU HB2 A 87 LYS H 1.0 1.8 5.65 804 671 A 86 GLU HB2 A 88 GLU H 1.0 1.8 6.52 805 672 A 93 VAL O A 86 GLU N 1.0 1.8 3.50 806 673 A 93 VAL H A 86 GLU O 1.0 1.8 2.50 807 674 A 86 GLU O A 93 VAL N 1.0 1.8 3.50 808 675 A 86 GLU HG3 A 87 LYS H 1.0 1.8 5.59 809 675 A 86 GLU HG2 A 87 LYS H 1.0 1.8 5.59 810 676 A 87 LYS H A 87 LYS HDx 1.0 1.8 5.91 811 677 A 87 LYS H A 87 LYS HGy 1.0 1.8 6.75 812 678 A 87 LYS H A 87 LYS HGx 1.0 1.8 5.87 813 679 A 87 LYS H A 87 LYS HE3 1.0 1.8 6.76 814 679 A 87 LYS H A 87 LYS HE2 1.0 1.8 6.76 815 680 A 87 LYS HA A 87 LYS HDy 1.0 1.8 4.89 816 681 A 87 LYS HDx A 87 LYS HA 1.0 1.8 5.18 817 682 A 87 LYS HE3 A 87 LYS HA 1.0 1.8 5.89 818 682 A 87 LYS HE2 A 87 LYS HA 1.0 1.8 5.89 819 683 A 92 PHE H A 87 LYS HA 1.0 1.8 5.74 820 684 A 92 PHE HA A 87 LYS HA 1.0 1.8 4.74 821 685 A 93 VAL H A 87 LYS HA 1.0 1.8 5.53 822 686 A 87 LYS HDx A 87 LYS HBx 1.0 1.8 3.90 823 687 A 87 LYS HE3 A 87 LYS HBx 1.0 1.8 4.61 824 687 A 87 LYS HE2 A 87 LYS HBx 1.0 1.8 4.61 825 688 A 88 GLU H A 87 LYS HBx 1.0 1.8 5.52 826 689 A 87 LYS HDy A 87 LYS HBy 1.0 1.8 4.32 827 690 A 87 LYS HE3 A 87 LYS HBy 1.0 1.8 6.71 828 690 A 87 LYS HE2 A 87 LYS HBy 1.0 1.8 6.71 829 691 A 88 GLU H A 87 LYS HBy 1.0 1.8 4.98 830 692 A 88 GLU H A 87 LYS HDx 1.0 1.8 5.71 831 693 A 88 GLU H A 87 LYS HGy 1.0 1.8 5.48 832 694 A 88 GLU H A 87 LYS HGx 1.0 1.8 5.75 833 695 A 88 GLU H A 87 LYS HE3 1.0 1.8 5.93 834 695 A 88 GLU H A 87 LYS HE2 1.0 1.8 5.93 835 696 A 88 GLU H A 88 GLU HGy 1.0 1.8 4.86 836 697 A 88 GLU H A 88 GLU HGx 1.0 1.8 5.24 837 698 A 88 GLU H A 91 LYS O 1.0 1.8 2.50 838 699 A 92 PHE HA A 88 GLU H 1.0 1.8 5.05 839 700 A 92 PHE HD2 A 88 GLU H 1.0 1.8 6.11 840 700 A 92 PHE HD1 A 88 GLU H 1.0 1.8 6.11 841 701 A 93 VAL H A 88 GLU H 1.0 1.8 5.02 842 702 A 93 VAL HG1% A 88 GLU H 1.0 1.8 5.40 843 702 A 93 VAL HG2% A 88 GLU H 1.0 1.8 5.40 844 703 A 88 GLU HGy A 88 GLU HA 1.0 1.8 4.07 845 704 A 88 GLU HGx A 88 GLU HA 1.0 1.8 4.49 846 705 A 88 GLU HGy A 88 GLU HB2 1.0 1.8 3.20 847 706 A 91 LYS O A 88 GLU N 1.0 1.8 3.50 848 707 A 91 LYS H A 90 ARG HBy 1.0 1.8 4.95 849 707 A 90 ARG HBx A 91 LYS H 1.0 1.8 4.95 850 708 A 91 LYS H A 91 LYS HB3 1.0 1.8 4.31 851 708 A 91 LYS H A 91 LYS HB2 1.0 1.8 4.31 852 709 A 91 LYS HD3 A 91 LYS H 1.0 1.8 4.99 853 709 A 91 LYS HD2 A 91 LYS H 1.0 1.8 4.99 854 710 A 91 LYS HG3 A 91 LYS H 1.0 1.8 4.69 855 710 A 91 LYS HG2 A 91 LYS H 1.0 1.8 4.69 856 711 A 91 LYS HD3 A 91 LYS HA 1.0 1.8 4.96 857 711 A 91 LYS HD2 A 91 LYS HA 1.0 1.8 4.96 858 712 A 91 LYS HG3 A 91 LYS HA 1.0 1.8 4.23 859 712 A 91 LYS HG2 A 91 LYS HA 1.0 1.8 4.23 860 713 A 91 LYS HD3 A 91 LYS HB3 1.0 1.8 4.56 861 713 A 91 LYS HD2 A 91 LYS HB3 1.0 1.8 4.56 862 713 A 91 LYS HD3 A 91 LYS HB2 1.0 1.8 4.56 863 713 A 91 LYS HD2 A 91 LYS HB2 1.0 1.8 4.56 864 714 A 92 PHE H A 91 LYS HB3 1.0 1.8 4.45 865 714 A 92 PHE H A 91 LYS HB2 1.0 1.8 4.45 866 715 A 92 PHE H A 91 LYS HD3 1.0 1.8 5.12 867 715 A 92 PHE H A 91 LYS HD2 1.0 1.8 5.12 868 716 A 92 PHE H A 91 LYS HG3 1.0 1.8 4.80 869 716 A 92 PHE H A 91 LYS HG2 1.0 1.8 4.80 870 717 A 92 PHE H A 92 PHE HD2 1.0 1.8 5.07 871 717 A 92 PHE H A 92 PHE HD1 1.0 1.8 5.07 872 718 A 92 PHE H A 93 VAL H 1.0 1.8 5.71 873 719 A 93 VAL HA A 92 PHE H 1.0 1.8 5.71 874 720 A 92 PHE HE2 A 92 PHE HA 1.0 1.8 5.30 875 720 A 92 PHE HE1 A 92 PHE HA 1.0 1.8 5.30 876 721 A 93 VAL H A 92 PHE HBy 1.0 1.8 5.26 877 722 A 93 VAL H A 92 PHE HBx 1.0 1.8 5.40 878 723 A 92 PHE HD2 A 93 VAL H 1.0 1.8 5.82 879 723 A 92 PHE HD1 A 93 VAL H 1.0 1.8 5.82 880 724 A 93 VAL HG1% A 93 VAL H 1.0 1.8 4.61 881 724 A 93 VAL HG2% A 93 VAL H 1.0 1.8 4.61 882 725 A 94 TYR H A 93 VAL H 1.0 1.8 5.45 883 726 A 93 VAL HG1% A 93 VAL HA 1.0 1.8 4.26 884 726 A 93 VAL HG2% A 93 VAL HA 1.0 1.8 4.26 885 727 A 94 TYR H A 93 VAL HB 1.0 1.8 4.94 886 728 A 93 VAL HG1% A 94 TYR H 1.0 1.8 4.49 887 728 A 93 VAL HG2% A 94 TYR H 1.0 1.8 4.49 888 729 A 93 VAL HG1% A 95 ARG H 1.0 1.8 5.61 889 729 A 93 VAL HG2% A 95 ARG H 1.0 1.8 5.61 890 730 A 94 TYR H A 94 TYR HD2 1.0 1.8 4.76 891 730 A 94 TYR H A 94 TYR HD1 1.0 1.8 4.76 892 731 A 94 TYR H A 94 TYR HE2 1.0 1.8 5.90 893 731 A 94 TYR H A 94 TYR HE1 1.0 1.8 5.90 894 732 A 94 TYR HD2 A 94 TYR HA 1.0 1.8 5.29 895 732 A 94 TYR HD1 A 94 TYR HA 1.0 1.8 5.29 896 733 A 95 ARG H A 94 TYR HA 1.0 1.8 3.02 897 734 A 94 TYR HBx A 95 ARG H 1.0 1.8 6.24 898 735 A 94 TYR HD2 A 95 ARG H 1.0 1.8 6.49 899 735 A 94 TYR HD1 A 95 ARG H 1.0 1.8 6.49 900 736 A 97 LEU H A 97 LEU HG 1.0 1.8 5.60 901 737 A 97 LEU H A 97 LEU HD1% 1.0 1.8 5.54 902 738 A 97 LEU HD2% A 97 LEU H 1.0 1.8 4.82 903 739 A 97 LEU HA A 97 LEU HBy 1.0 1.8 3.42 904 740 A 97 LEU HD1% A 97 LEU HA 1.0 1.8 4.50 905 741 A 97 LEU HD2% A 97 LEU HA 1.0 1.8 4.75 906 742 A 97 LEU HD1% A 97 LEU HBx 1.0 1.8 4.34 907 743 A 97 LEU HD2% A 97 LEU HBx 1.0 1.8 4.34 908 744 A 97 LEU HG A 97 LEU HBy 1.0 1.8 2.90 909 745 A 97 LEU HD2% A 97 LEU HBy 1.0 1.8 4.27 stop_ save_ save_AMBER_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode AMBER_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 35 ASN C A 36 ALA N A 36 ALA CA A 36 ALA C 1.0 -70.0 -30.0 PHI 2 2 A 36 ALA N A 36 ALA CA A 36 ALA C A 37 GLU N 1.0 -90.0 -10.0 PSI 3 3 A 38 LEU C A 39 ILE N A 39 ILE CA A 39 ILE C 1.0 -70.0 -30.0 PHI 4 4 A 39 ILE N A 39 ILE CA A 39 ILE C A 40 VAL N 1.0 -90.0 -10.0 PSI 5 5 A 39 ILE C A 40 VAL N A 40 VAL CA A 40 VAL C 1.0 -70.0 -30.0 PHI 6 6 A 40 VAL N A 40 VAL CA A 40 VAL C A 41 MET N 1.0 -90.0 -10.0 PSI 7 7 A 42 ARG C A 43 VAL N A 43 VAL CA A 43 VAL C 1.0 -77.3 -48.8 PHI 8 8 A 43 VAL N A 43 VAL CA A 43 VAL C A 44 ILE N 1.0 -58.5 -31.8 PSI 9 9 A 43 VAL C A 44 ILE N A 44 ILE CA A 44 ILE C 1.0 -76.9 -56.9 PHI 10 10 A 44 ILE N A 44 ILE CA A 44 ILE C A 45 TRP N 1.0 -53.8 -32.5 PSI 11 11 A 44 ILE C A 45 TRP N A 45 TRP CA A 45 TRP C 1.0 -73.8 -46.6 PHI 12 12 A 45 TRP N A 45 TRP CA A 45 TRP C A 46 SER N 1.0 -57.3 -26.5 PSI 13 13 A 45 TRP C A 46 SER N A 46 SER CA A 46 SER C 1.0 -75.8 -48.7 PHI 14 14 A 46 SER N A 46 SER CA A 46 SER C A 47 LEU N 1.0 -60.0 -12.2 PSI 15 15 A 46 SER C A 47 LEU N A 47 LEU CA A 47 LEU C 1.0 -70.0 -30.0 PHI 16 16 A 47 LEU N A 47 LEU CA A 47 LEU C A 48 GLY N 1.0 -90.0 -10.0 PSI 17 17 A 48 GLY C A 49 GLU N A 49 GLU CA A 49 GLU C 1.0 -191.0 -52.0 PHI 18 18 A 49 GLU N A 49 GLU CA A 49 GLU C A 50 ALA N 1.0 119.8 182.7 PSI 19 19 A 49 GLU C A 50 ALA N A 50 ALA CA A 50 ALA C 1.0 -155.0 -80.0 PHI 20 20 A 50 ALA N A 50 ALA CA A 50 ALA C A 51 ARG N 1.0 60.0 175.0 PSI 21 21 A 50 ALA C A 51 ARG N A 51 ARG CA A 51 ARG C 1.0 -104.6 -53.7 PHI 22 22 A 51 ARG N A 51 ARG CA A 51 ARG C A 52 VAL N 1.0 127.1 179.5 PSI 23 23 A 51 ARG C A 52 VAL N A 52 VAL CA A 52 VAL C 1.0 -78.3 -42.1 PHI 24 24 A 52 VAL N A 52 VAL CA A 52 VAL C A 53 ASP N 1.0 -90.0 -10.0 PSI 25 25 A 52 VAL C A 53 ASP N A 53 ASP CA A 53 ASP C 1.0 -70.0 -30.0 PHI 26 26 A 53 ASP N A 53 ASP CA A 53 ASP C A 54 GLU N 1.0 -51.9 -24.8 PSI 27 27 A 53 ASP C A 54 GLU N A 54 GLU CA A 54 GLU C 1.0 -70.0 -30.0 PHI 28 28 A 54 GLU N A 54 GLU CA A 54 GLU C A 55 ILE N 1.0 -56.6 -22.5 PSI 29 29 A 54 GLU C A 55 ILE N A 55 ILE CA A 55 ILE C 1.0 -76.0 -30.0 PHI 30 30 A 55 ILE N A 55 ILE CA A 55 ILE C A 56 TYR N 1.0 -52.3 -32.3 PSI 31 31 A 55 ILE C A 56 TYR N A 56 TYR CA A 56 TYR C 1.0 -75.8 -44.0 PHI 32 32 A 56 TYR N A 56 TYR CA A 56 TYR C A 57 ALA N 1.0 -55.9 -26.4 PSI 33 33 A 56 TYR C A 57 ALA N A 57 ALA CA A 57 ALA C 1.0 -80.7 -46.6 PHI 34 34 A 57 ALA N A 57 ALA CA A 57 ALA C A 58 GLN N 1.0 -57.1 -5.6 PSI 35 35 A 57 ALA C A 58 GLN N A 58 GLN CA A 58 GLN C 1.0 -126.4 -67.8 PHI 36 36 A 58 GLN N A 58 GLN CA A 58 GLN C A 59 ILE N 1.0 -41.0 27.7 PSI 37 37 A 58 GLN C A 59 ILE N A 59 ILE CA A 59 ILE C 1.0 -119.9 -42.8 PHI 38 38 A 59 ILE N A 59 ILE CA A 59 ILE C A 60 PRO N 1.0 92.6 182.9 PSI 39 39 A 61 GLN C A 62 GLU N A 62 GLU CA A 62 GLU C 1.0 -73.9 -53.9 PHI 40 40 A 62 GLU N A 62 GLU CA A 62 GLU C A 63 LEU N 1.0 -52.7 -18.3 PSI 41 41 A 62 GLU C A 63 LEU N A 63 LEU CA A 63 LEU C 1.0 -93.6 -45.7 PHI 42 42 A 63 LEU N A 63 LEU CA A 63 LEU C A 64 GLU N 1.0 -70.1 29.7 PSI 43 43 A 64 GLU C A 65 TRP N A 65 TRP CA A 65 TRP C 1.0 -144.6 -71.4 PHI 44 44 A 65 TRP N A 65 TRP CA A 65 TRP C A 66 SER N 1.0 86.7 182.5 PSI 45 45 A 65 TRP C A 66 SER N A 66 SER CA A 66 SER C 1.0 -134.4 -63.7 PHI 46 46 A 66 SER N A 66 SER CA A 66 SER C A 67 LEU N 1.0 143.4 189.6 PSI 47 47 A 66 SER C A 67 LEU N A 67 LEU CA A 67 LEU C 1.0 -78.5 -45.7 PHI 48 48 A 67 LEU N A 67 LEU CA A 67 LEU C A 68 ALA N 1.0 -58.1 -16.8 PSI 49 49 A 67 LEU C A 68 ALA N A 68 ALA CA A 68 ALA C 1.0 -81.1 -55.4 PHI 50 50 A 68 ALA N A 68 ALA CA A 68 ALA C A 69 THR N 1.0 -53.4 -10.8 PSI 51 51 A 68 ALA C A 69 THR N A 69 THR CA A 69 THR C 1.0 -87.5 -50.2 PHI 52 52 A 69 THR N A 69 THR CA A 69 THR C A 70 VAL N 1.0 -56.7 -28.0 PSI 53 53 A 69 THR C A 70 VAL N A 70 VAL CA A 70 VAL C 1.0 -74.4 -54.4 PHI 54 54 A 70 VAL N A 70 VAL CA A 70 VAL C A 71 LYS N 1.0 -55.0 -35.0 PSI 55 55 A 70 VAL C A 71 LYS N A 71 LYS CA A 71 LYS C 1.0 -76.9 -47.0 PHI 56 56 A 71 LYS N A 71 LYS CA A 71 LYS C A 72 THR N 1.0 -54.9 -20.7 PSI 57 57 A 71 LYS C A 72 THR N A 72 THR CA A 72 THR C 1.0 -87.4 -50.8 PHI 58 58 A 72 THR N A 72 THR CA A 72 THR C A 73 LEU N 1.0 -59.1 -23.1 PSI 59 59 A 72 THR C A 73 LEU N A 73 LEU CA A 73 LEU C 1.0 -76.8 -49.0 PHI 60 60 A 73 LEU N A 73 LEU CA A 73 LEU C A 74 LEU N 1.0 -53.7 -29.0 PSI 61 61 A 73 LEU C A 74 LEU N A 74 LEU CA A 74 LEU C 1.0 -72.7 -52.7 PHI 62 62 A 74 LEU N A 74 LEU CA A 74 LEU C A 75 GLY N 1.0 -55.9 -29.1 PSI 63 63 A 74 LEU C A 75 GLY N A 75 GLY CA A 75 GLY C 1.0 -74.7 -54.7 PHI 64 64 A 75 GLY N A 75 GLY CA A 75 GLY C A 76 ARG N 1.0 -48.9 -27.2 PSI 65 65 A 75 GLY C A 76 ARG N A 76 ARG CA A 76 ARG C 1.0 -74.7 -54.7 PHI 66 66 A 76 ARG N A 76 ARG CA A 76 ARG C A 77 LEU N 1.0 -53.3 -30.9 PSI 67 67 A 76 ARG C A 77 LEU N A 77 LEU CA A 77 LEU C 1.0 -74.7 -54.7 PHI 68 68 A 77 LEU N A 77 LEU CA A 77 LEU C A 78 VAL N 1.0 -51.2 -27.8 PSI 69 69 A 77 LEU C A 78 VAL N A 78 VAL CA A 78 VAL C 1.0 -76.3 -56.3 PHI 70 70 A 78 VAL N A 78 VAL CA A 78 VAL C A 79 LYS N 1.0 -52.3 -32.3 PSI 71 71 A 78 VAL C A 79 LYS N A 79 LYS CA A 79 LYS C 1.0 -79.2 -57.3 PHI 72 72 A 79 LYS N A 79 LYS CA A 79 LYS C A 80 LYS N 1.0 -46.6 -20.3 PSI 73 73 A 82 MET C A 83 LEU N A 83 LEU CA A 83 LEU C 1.0 -155.0 -80.0 PHI 74 74 A 83 LEU N A 83 LEU CA A 83 LEU C A 84 SER N 1.0 60.0 175.0 PSI 75 75 A 83 LEU C A 84 SER N A 84 SER CA A 84 SER C 1.0 -147.8 -83.9 PHI 76 76 A 84 SER N A 84 SER CA A 84 SER C A 85 THR N 1.0 100.1 170.5 PSI 77 77 A 84 SER C A 85 THR N A 85 THR CA A 85 THR C 1.0 -164.5 -71.4 PHI 78 78 A 85 THR N A 85 THR CA A 85 THR C A 86 GLU N 1.0 123.0 171.4 PSI 79 79 A 85 THR C A 86 GLU N A 86 GLU CA A 86 GLU C 1.0 -176.7 -98.8 PHI 80 80 A 86 GLU N A 86 GLU CA A 86 GLU C A 87 LYS N 1.0 111.4 179.3 PSI 81 81 A 86 GLU C A 87 LYS N A 87 LYS CA A 87 LYS C 1.0 -132.5 -50.4 PHI 82 82 A 87 LYS N A 87 LYS CA A 87 LYS C A 88 GLU N 1.0 90.6 155.4 PSI 83 83 A 87 LYS C A 88 GLU N A 88 GLU CA A 88 GLU C 1.0 -155.0 -80.0 PHI 84 84 A 88 GLU N A 88 GLU CA A 88 GLU C A 89 GLY N 1.0 60.0 175.0 PSI 85 85 A 90 ARG C A 91 LYS N A 91 LYS CA A 91 LYS C 1.0 -155.0 -80.0 PHI 86 86 A 91 LYS N A 91 LYS CA A 91 LYS C A 92 PHE N 1.0 60.0 175.0 PSI 87 87 A 91 LYS C A 92 PHE N A 92 PHE CA A 92 PHE C 1.0 -155.0 -80.0 PHI 88 88 A 92 PHE N A 92 PHE CA A 92 PHE C A 93 VAL N 1.0 60.0 175.0 PSI 89 89 A 92 PHE C A 93 VAL N A 93 VAL CA A 93 VAL C 1.0 -155.0 -80.0 PHI 90 90 A 93 VAL N A 93 VAL CA A 93 VAL C A 94 TYR N 1.0 60.0 175.0 PSI 91 91 A 93 VAL C A 94 TYR N A 94 TYR CA A 94 TYR C 1.0 -134.9 -71.8 PHI 92 92 A 94 TYR N A 94 TYR CA A 94 TYR C A 95 ARG N 1.0 109.9 168.0 PSI 93 93 A 94 TYR C A 95 ARG N A 95 ARG CA A 95 ARG C 1.0 -156.0 -80.3 PHI 94 94 A 95 ARG N A 95 ARG CA A 95 ARG C A 96 PRO N 1.0 69.9 193.1 PSI stop_ save_ save_AMBER_dihedral_5 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode AMBER_dihedral_5 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 32 ASN CA A 32 ASN N A 31 PHE C A 31 PHE CA 1.0 170.0 190.0 OMEGA stop_ save_