data_nef_c19163_2m6y 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 GLY middle . false 3 A 3 HIS middle . . 4 A 4 HIS middle . . 5 A 5 HIS middle . . 6 A 6 HIS middle . . 7 A 7 HIS middle . . 8 A 8 HIS middle . . 9 A 9 SER middle . . 10 A 10 HIS middle . . 11 A 11 MET middle . . 12 A 12 VAL middle . . 13 A 13 LYS middle . . 14 A 14 GLU middle . . 15 A 15 THR middle . . 16 A 16 THR middle . . 17 A 17 TYR middle . . 18 A 18 TYR middle . . 19 A 19 ASP middle . . 20 A 20 VAL middle . . 21 A 21 LEU middle . . 22 A 22 GLY middle . false 23 A 23 VAL middle . . 24 A 24 LYS middle . . 25 A 25 PRO middle . false 26 A 26 ASN middle . . 27 A 27 ALA middle . . 28 A 28 THR middle . . 29 A 29 GLN middle . . 30 A 30 GLU middle . . 31 A 31 GLU middle . . 32 A 32 LEU middle . . 33 A 33 LYS middle . . 34 A 34 LYS middle . . 35 A 35 ALA middle . . 36 A 36 TYR middle . . 37 A 37 ARG middle . . 38 A 38 LYS middle . . 39 A 39 LEU middle . . 40 A 40 ALA middle . . 41 A 41 LEU middle . . 42 A 42 LYS middle . . 43 A 43 TYR middle . . 44 A 44 HIS middle . . 45 A 45 PRO middle . false 46 A 46 ASP middle . . 47 A 47 LYS middle . . 48 A 48 ASN middle . . 49 A 49 PRO middle . false 50 A 50 ASN middle . . 51 A 51 GLU middle . . 52 A 52 GLY middle . false 53 A 53 GLU middle . . 54 A 54 LYS middle . . 55 A 55 PHE middle . . 56 A 56 LYS middle . . 57 A 57 GLN middle . . 58 A 58 ILE middle . . 59 A 59 SER middle . . 60 A 60 GLN middle . . 61 A 61 ALA middle . . 62 A 62 TYR middle . . 63 A 63 GLU middle . . 64 A 64 VAL middle . . 65 A 65 LEU middle . . 66 A 66 SER middle . . 67 A 67 ASP middle . . 68 A 68 ALA middle . . 69 A 69 LYS middle . . 70 A 70 LYS middle . . 71 A 71 ARG middle . . 72 A 72 GLU middle . . 73 A 73 LEU middle . . 74 A 74 TYR middle . . 75 A 75 ASP middle . . 76 A 76 LYS middle . . 77 A 77 GLY end . false 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 11 MET HA H 1 4.346 0.013 A 11 MET HBy H 1 1.920 0.015 A 11 MET HBx H 1 1.830 0.000 A 11 MET HGx H 1 2.342 0.021 A 11 MET HGy H 1 2.369 0.005 A 11 MET C C 13 175.801 0.000 A 11 MET CA C 13 55.614 0.044 A 11 MET CB C 13 32.925 0.019 A 11 MET CG C 13 31.965 0.000 A 12 VAL H H 1 7.988 0.006 A 12 VAL HA H 1 4.026 0.014 A 12 VAL HB H 1 1.964 0.013 A 12 VAL HG1% H 1 0.812 0.010 A 12 VAL HG2% H 1 0.812 0.009 A 12 VAL C C 13 175.701 0.009 A 12 VAL CA C 13 62.188 0.039 A 12 VAL CB C 13 32.882 0.031 A 12 VAL CG1 C 13 21.096 0.000 A 12 VAL CG2 C 13 21.096 0.000 A 12 VAL N N 15 121.226 0.027 A 13 LYS H H 1 8.281 0.014 A 13 LYS HA H 1 4.211 0.012 A 13 LYS HBx H 1 1.666 0.014 A 13 LYS HBy H 1 1.680 0.011 A 13 LYS HE2 H 1 2.896 0.001 A 13 LYS HE3 H 1 2.896 0.001 A 13 LYS HG2 H 1 1.341 0.010 A 13 LYS HG3 H 1 1.342 0.011 A 13 LYS C C 13 176.121 0.011 A 13 LYS CA C 13 56.355 0.076 A 13 LYS CB C 13 33.019 0.081 A 13 LYS CD C 13 29.218 0.000 A 13 LYS CE C 13 42.145 0.000 A 13 LYS CG C 13 24.680 0.109 A 13 LYS N N 15 125.255 0.032 A 14 GLU H H 1 8.424 0.014 A 14 GLU HA H 1 4.305 0.009 A 14 GLU HBx H 1 1.860 0.016 A 14 GLU HBy H 1 1.922 0.015 A 14 GLU HG2 H 1 2.156 0.012 A 14 GLU HG3 H 1 2.156 0.012 A 14 GLU C C 13 176.107 0.004 A 14 GLU CA C 13 56.343 0.042 A 14 GLU CB C 13 30.534 0.078 A 14 GLU CG C 13 36.124 0.049 A 14 GLU N N 15 123.004 0.036 A 15 THR H H 1 8.335 0.019 A 15 THR HA H 1 4.538 0.019 A 15 THR HB H 1 4.263 0.015 A 15 THR HG2% H 1 1.156 0.004 A 15 THR C C 13 175.233 0.006 A 15 THR CA C 13 61.981 0.051 A 15 THR CB C 13 69.865 0.052 A 15 THR CG2 C 13 21.750 0.066 A 15 THR N N 15 115.895 0.040 A 16 THR H H 1 8.798 0.016 A 16 THR HA H 1 4.366 0.016 A 16 THR HB H 1 4.637 0.011 A 16 THR HG2% H 1 1.314 0.007 A 16 THR C C 13 176.090 0.033 A 16 THR CA C 13 62.172 0.059 A 16 THR CB C 13 71.997 0.075 A 16 THR CG2 C 13 21.517 0.071 A 16 THR N N 15 116.992 0.032 A 17 TYR H H 1 8.292 0.010 A 17 TYR HA H 1 4.329 0.011 A 17 TYR HBx H 1 1.985 0.010 A 17 TYR HBy H 1 2.625 0.012 A 17 TYR C C 13 177.105 0.005 A 17 TYR CA C 13 57.577 0.050 A 17 TYR CB C 13 37.113 0.064 A 17 TYR N N 15 117.617 0.026 A 18 TYR H H 1 7.047 0.026 A 18 TYR HA H 1 3.775 0.008 A 18 TYR HBy H 1 3.031 0.018 A 18 TYR HBx H 1 2.700 0.018 A 18 TYR HDx H 1 6.140 0.003 A 18 TYR HDy H 1 6.140 0.003 A 18 TYR C C 13 177.771 0.003 A 18 TYR CA C 13 61.430 0.051 A 18 TYR CB C 13 36.495 0.071 A 18 TYR N N 15 115.048 0.022 A 19 ASP H H 1 7.685 0.011 A 19 ASP HA H 1 4.406 0.014 A 19 ASP HBx H 1 2.716 0.014 A 19 ASP HBy H 1 3.024 0.014 A 19 ASP C C 13 180.128 0.009 A 19 ASP CA C 13 57.475 0.075 A 19 ASP CB C 13 40.659 0.048 A 19 ASP N N 15 119.520 0.024 A 20 VAL H H 1 8.004 0.018 A 20 VAL HA H 1 3.608 0.008 A 20 VAL HB H 1 2.142 0.009 A 20 VAL HGx% H 1 0.805 0.012 A 20 VAL HGy% H 1 1.026 0.006 A 20 VAL C C 13 177.026 0.007 A 20 VAL CA C 13 65.840 0.060 A 20 VAL CB C 13 31.530 0.052 A 20 VAL CG1 C 13 22.648 0.038 A 20 VAL CG2 C 13 22.648 0.038 A 20 VAL N N 15 119.772 0.034 A 21 LEU H H 1 6.847 0.007 A 21 LEU HA H 1 4.281 0.012 A 21 LEU HBx H 1 1.586 0.012 A 21 LEU HBy H 1 1.707 0.015 A 21 LEU HDx% H 1 0.799 0.010 A 21 LEU HDy% H 1 0.940 0.017 A 21 LEU HG H 1 1.725 0.026 A 21 LEU C C 13 175.757 0.016 A 21 LEU CA C 13 54.554 0.053 A 21 LEU CB C 13 42.869 0.066 A 21 LEU CD1 C 13 23.626 0.073 A 21 LEU CD2 C 13 23.626 0.073 A 21 LEU CG C 13 26.921 0.000 A 21 LEU N N 15 115.252 0.021 A 22 GLY H H 1 7.874 0.004 A 22 GLY HA2 H 1 3.910 0.009 A 22 GLY HA3 H 1 3.910 0.008 A 22 GLY C C 13 175.361 0.003 A 22 GLY CA C 13 46.574 0.056 A 22 GLY N N 15 108.227 0.021 A 23 VAL H H 1 7.815 0.011 A 23 VAL HA H 1 4.767 0.019 A 23 VAL HB H 1 2.411 0.009 A 23 VAL HGx% H 1 0.747 0.005 A 23 VAL HGy% H 1 0.905 0.013 A 23 VAL C C 13 174.674 0.004 A 23 VAL CA C 13 58.349 0.067 A 23 VAL CB C 13 34.938 0.083 A 23 VAL CGy C 13 21.544 0.059 A 23 VAL CGx C 13 19.315 0.065 A 23 VAL N N 15 110.675 0.040 A 24 LYS H H 1 8.329 0.013 A 24 LYS HA H 1 4.488 0.013 A 24 LYS HBx H 1 1.616 0.013 A 24 LYS HBy H 1 1.761 0.009 A 24 LYS HG2 H 1 1.750 0.005 A 24 LYS HG3 H 1 1.750 0.005 A 24 LYS C C 13 175.442 0.000 A 24 LYS CA C 13 54.001 0.109 A 24 LYS CB C 13 32.197 0.065 A 24 LYS N N 15 119.948 0.023 A 25 PRO HA H 1 2.421 0.009 A 25 PRO HBx H 1 1.470 0.020 A 25 PRO HBy H 1 1.739 0.032 A 25 PRO HDx H 1 3.407 0.015 A 25 PRO HDy H 1 3.607 0.022 A 25 PRO C C 13 175.635 0.000 A 25 PRO CA C 13 63.362 0.064 A 25 PRO CB C 13 31.839 0.045 A 25 PRO CD C 13 50.181 0.033 A 25 PRO CG C 13 27.984 0.000 A 26 ASN H H 1 7.138 0.007 A 26 ASN HA H 1 4.518 0.009 A 26 ASN HBy H 1 2.975 0.011 A 26 ASN HBx H 1 2.525 0.009 A 26 ASN HD21 H 1 7.216 0.000 A 26 ASN HD22 H 1 7.062 0.000 A 26 ASN C C 13 175.820 0.000 A 26 ASN CA C 13 51.525 0.069 A 26 ASN CB C 13 36.829 0.108 A 26 ASN N N 15 111.739 0.024 A 27 ALA H H 1 7.637 0.008 A 27 ALA HA H 1 4.325 0.011 A 27 ALA HB% H 1 1.480 0.010 A 27 ALA C C 13 178.726 0.006 A 27 ALA CA C 13 52.961 0.065 A 27 ALA CB C 13 19.159 0.062 A 27 ALA N N 15 122.829 0.018 A 28 THR H H 1 8.829 0.014 A 28 THR HA H 1 4.493 0.014 A 28 THR HB H 1 4.778 0.040 A 28 THR HG2% H 1 1.365 0.008 A 28 THR C C 13 175.641 0.007 A 28 THR CA C 13 60.592 0.049 A 28 THR CB C 13 71.304 0.050 A 28 THR CG2 C 13 21.890 0.056 A 28 THR N N 15 113.468 0.021 A 29 GLN H H 1 9.015 0.012 A 29 GLN HA H 1 4.035 0.020 A 29 GLN HB2 H 1 2.111 0.019 A 29 GLN HB3 H 1 2.111 0.019 A 29 GLN HG2 H 1 2.453 0.014 A 29 GLN HG3 H 1 2.453 0.014 A 29 GLN C C 13 179.117 0.011 A 29 GLN CA C 13 59.435 0.054 A 29 GLN CB C 13 27.851 0.078 A 29 GLN CG C 13 33.360 0.078 A 29 GLN N N 15 119.445 0.025 A 30 GLU H H 1 8.549 0.013 A 30 GLU HA H 1 4.059 0.013 A 30 GLU HBy H 1 2.062 0.008 A 30 GLU HBx H 1 1.934 0.012 A 30 GLU HG2 H 1 2.301 0.008 A 30 GLU HG3 H 1 2.301 0.008 A 30 GLU C C 13 179.097 0.002 A 30 GLU CA C 13 59.847 0.040 A 30 GLU CB C 13 29.356 0.034 A 30 GLU CG C 13 36.371 0.074 A 30 GLU N N 15 119.343 0.019 A 31 GLU H H 1 7.768 0.012 A 31 GLU HA H 1 3.906 0.009 A 31 GLU HBy H 1 2.402 0.014 A 31 GLU HBx H 1 1.958 0.014 A 31 GLU HG2 H 1 2.240 0.019 A 31 GLU HG3 H 1 2.240 0.019 A 31 GLU C C 13 180.405 0.009 A 31 GLU CA C 13 59.592 0.035 A 31 GLU CB C 13 29.989 0.080 A 31 GLU CG C 13 37.592 0.038 A 31 GLU N N 15 120.562 0.038 A 32 LEU H H 1 8.475 0.011 A 32 LEU HA H 1 3.963 0.028 A 32 LEU HBx H 1 1.258 0.012 A 32 LEU HBy H 1 2.188 0.015 A 32 LEU HDx% H 1 1.782 0.015 A 32 LEU HDy% H 1 0.759 0.012 A 32 LEU HG H 1 0.635 0.010 A 32 LEU C C 13 177.873 0.006 A 32 LEU CA C 13 58.593 0.068 A 32 LEU CB C 13 42.556 0.066 A 32 LEU CG C 13 26.758 0.043 A 32 LEU N N 15 120.518 0.018 A 33 LYS H H 1 8.077 0.006 A 33 LYS HA H 1 4.000 0.014 A 33 LYS HB2 H 1 1.988 0.010 A 33 LYS HB3 H 1 1.988 0.010 A 33 LYS HE2 H 1 2.922 0.008 A 33 LYS HE3 H 1 2.922 0.008 A 33 LYS C C 13 178.701 0.007 A 33 LYS CA C 13 60.274 0.038 A 33 LYS CB C 13 32.656 0.060 A 33 LYS CD C 13 29.895 0.000 A 33 LYS CE C 13 42.097 0.035 A 33 LYS CG C 13 25.208 0.000 A 33 LYS N N 15 119.091 0.024 A 34 LYS H H 1 7.986 0.002 A 34 LYS HA H 1 3.890 0.010 A 34 LYS HB2 H 1 1.815 0.021 A 34 LYS HB3 H 1 1.815 0.021 A 34 LYS C C 13 179.172 0.003 A 34 LYS CA C 13 59.927 0.039 A 34 LYS CB C 13 32.869 0.067 A 34 LYS CD C 13 29.722 0.000 A 34 LYS CE C 13 42.123 0.000 A 34 LYS CG C 13 25.857 0.000 A 34 LYS N N 15 118.527 0.029 A 35 ALA H H 1 7.917 0.005 A 35 ALA HA H 1 4.116 0.016 A 35 ALA HB% H 1 1.601 0.011 A 35 ALA C C 13 179.982 0.007 A 35 ALA CA C 13 55.157 0.074 A 35 ALA CB C 13 18.773 0.063 A 35 ALA N N 15 122.190 0.025 A 36 TYR H H 1 8.402 0.010 A 36 TYR HA H 1 3.818 0.008 A 36 TYR HBx H 1 2.397 0.008 A 36 TYR HBy H 1 2.508 0.012 A 36 TYR C C 13 176.344 0.003 A 36 TYR CA C 13 61.468 0.051 A 36 TYR CB C 13 38.890 0.083 A 36 TYR N N 15 117.701 0.028 A 37 ARG H H 1 8.264 0.006 A 37 ARG HA H 1 3.481 0.009 A 37 ARG HBy H 1 1.813 0.018 A 37 ARG HBx H 1 1.765 0.015 A 37 ARG HD2 H 1 3.088 0.022 A 37 ARG HD3 H 1 3.088 0.022 A 37 ARG HG2 H 1 1.583 0.020 A 37 ARG HG3 H 1 1.583 0.020 A 37 ARG C C 13 178.825 0.006 A 37 ARG CA C 13 59.397 0.070 A 37 ARG CB C 13 29.710 0.022 A 37 ARG CD C 13 43.465 0.000 A 37 ARG N N 15 117.423 0.027 A 38 LYS H H 1 7.444 0.007 A 38 LYS HA H 1 3.905 0.015 A 38 LYS HB2 H 1 1.854 0.011 A 38 LYS HB3 H 1 1.854 0.010 A 38 LYS C C 13 179.444 0.004 A 38 LYS CA C 13 59.450 0.017 A 38 LYS CB C 13 32.609 0.037 A 38 LYS CD C 13 29.646 0.000 A 38 LYS CE C 13 42.050 0.000 A 38 LYS CG C 13 25.200 0.000 A 38 LYS N N 15 117.247 0.038 A 39 LEU H H 1 7.707 0.009 A 39 LEU HA H 1 4.020 0.009 A 39 LEU HBy H 1 1.858 0.009 A 39 LEU HBx H 1 1.491 0.015 A 39 LEU HD1% H 1 0.954 0.014 A 39 LEU HD2% H 1 0.954 0.014 A 39 LEU HG H 1 0.998 0.014 A 39 LEU C C 13 178.801 0.009 A 39 LEU CA C 13 57.409 0.035 A 39 LEU CB C 13 42.388 0.055 A 39 LEU CD1 C 13 22.943 0.089 A 39 LEU CD2 C 13 22.943 0.089 A 39 LEU CG C 13 26.958 0.075 A 39 LEU N N 15 119.901 0.024 A 40 ALA H H 1 8.931 0.012 A 40 ALA HA H 1 3.849 0.009 A 40 ALA HB% H 1 0.971 0.012 A 40 ALA C C 13 179.446 0.004 A 40 ALA CA C 13 55.109 0.034 A 40 ALA CB C 13 17.116 0.053 A 40 ALA N N 15 122.772 0.020 A 41 LEU H H 1 7.133 0.009 A 41 LEU HA H 1 3.977 0.011 A 41 LEU HBy H 1 1.677 0.012 A 41 LEU HBx H 1 1.454 0.010 A 41 LEU HD11 H 1 0.764 0.024 A 41 LEU HD12 H 1 0.802 0.008 A 41 LEU HD13 H 1 0.764 0.024 A 41 LEU HDy% H 1 0.767 0.018 A 41 LEU HG H 1 1.677 0.013 A 41 LEU C C 13 178.216 0.007 A 41 LEU CA C 13 57.088 0.027 A 41 LEU CB C 13 42.162 0.055 A 41 LEU CDy C 13 24.867 0.080 A 41 LEU CDx C 13 23.425 0.056 A 41 LEU CG C 13 26.753 0.057 A 41 LEU N N 15 115.299 0.018 A 42 LYS H H 1 7.038 0.010 A 42 LYS HA H 1 3.925 0.011 A 42 LYS HBx H 1 1.293 0.024 A 42 LYS HBy H 1 1.377 0.026 A 42 LYS HD2 H 1 1.398 0.008 A 42 LYS HD3 H 1 1.398 0.008 A 42 LYS HE2 H 1 2.785 0.008 A 42 LYS HE3 H 1 2.785 0.008 A 42 LYS HGx H 1 0.669 0.015 A 42 LYS HGy H 1 1.065 0.014 A 42 LYS C C 13 177.560 0.002 A 42 LYS CA C 13 57.885 0.038 A 42 LYS CB C 13 33.427 0.074 A 42 LYS CD C 13 29.530 0.000 A 42 LYS CE C 13 41.977 0.076 A 42 LYS CG C 13 24.653 0.072 A 42 LYS N N 15 116.812 0.019 A 43 TYR H H 1 7.683 0.012 A 43 TYR HA H 1 4.665 0.023 A 43 TYR HBx H 1 2.493 0.009 A 43 TYR HBy H 1 3.337 0.012 A 43 TYR C C 13 173.741 0.007 A 43 TYR CA C 13 56.928 0.044 A 43 TYR CB C 13 39.579 0.091 A 43 TYR N N 15 114.022 0.043 A 44 HIS H H 1 7.814 0.012 A 44 HIS HA H 1 3.697 0.006 A 44 HIS HBx H 1 2.655 0.008 A 44 HIS HBy H 1 3.180 0.012 A 44 HIS C C 13 174.925 0.000 A 44 HIS CA C 13 56.229 0.066 A 44 HIS CB C 13 30.852 0.042 A 44 HIS N N 15 120.947 0.047 A 45 PRO HA H 1 4.131 0.010 A 45 PRO HBx H 1 1.737 0.010 A 45 PRO HBy H 1 2.055 0.012 A 45 PRO HD2 H 1 2.505 0.022 A 45 PRO HD3 H 1 2.505 0.022 A 45 PRO HGx H 1 1.508 0.013 A 45 PRO HGy H 1 1.512 0.006 A 45 PRO C C 13 177.269 0.006 A 45 PRO CA C 13 64.723 0.047 A 45 PRO CB C 13 32.070 0.065 A 45 PRO CD C 13 50.188 0.040 A 46 ASP H H 1 10.040 0.020 A 46 ASP HA H 1 4.375 0.023 A 46 ASP HB2 H 1 2.586 0.015 A 46 ASP HB3 H 1 2.586 0.015 A 46 ASP C C 13 177.284 0.005 A 46 ASP CA C 13 56.020 0.059 A 46 ASP CB C 13 40.221 0.083 A 46 ASP N N 15 119.127 0.050 A 47 LYS H H 1 7.826 0.010 A 47 LYS HA H 1 4.315 0.012 A 47 LYS HBx H 1 1.694 0.012 A 47 LYS HBy H 1 1.771 0.039 A 47 LYS HG2 H 1 1.344 0.000 A 47 LYS HG3 H 1 1.344 0.000 A 47 LYS C C 13 176.355 0.004 A 47 LYS CA C 13 55.880 0.021 A 47 LYS CB C 13 33.778 0.076 A 47 LYS CD C 13 28.436 0.000 A 47 LYS CE C 13 42.175 0.000 A 47 LYS CG C 13 24.610 0.000 A 47 LYS N N 15 117.416 0.050 A 48 ASN H H 1 7.956 0.009 A 48 ASN HA H 1 5.021 0.010 A 48 ASN HBx H 1 2.592 0.012 A 48 ASN HBy H 1 2.788 0.009 A 48 ASN HD21 H 1 7.998 0.024 A 48 ASN HD22 H 1 7.947 0.051 A 48 ASN C C 13 172.992 0.000 A 48 ASN CA C 13 50.467 0.064 A 48 ASN CB C 13 39.284 0.060 A 48 ASN N N 15 116.573 0.034 A 49 PRO HA H 1 4.448 0.014 A 49 PRO HBy H 1 2.339 0.008 A 49 PRO HBx H 1 1.955 0.018 A 49 PRO HDy H 1 3.748 0.010 A 49 PRO HDx H 1 3.491 0.010 A 49 PRO HGy H 1 1.981 0.016 A 49 PRO HGx H 1 1.916 0.023 A 49 PRO C C 13 178.030 0.003 A 49 PRO CA C 13 64.468 0.070 A 49 PRO CB C 13 32.173 0.085 A 49 PRO CD C 13 50.675 0.045 A 49 PRO CG C 13 26.856 0.067 A 50 ASN H H 1 8.398 0.009 A 50 ASN HA H 1 4.748 0.038 A 50 ASN HBx H 1 2.810 0.006 A 50 ASN HBy H 1 2.913 0.013 A 50 ASN C C 13 176.443 0.010 A 50 ASN CA C 13 54.677 0.043 A 50 ASN CB C 13 39.014 0.048 A 50 ASN N N 15 115.567 0.041 A 51 GLU H H 1 7.485 0.017 A 51 GLU HA H 1 4.797 0.031 A 51 GLU HBx H 1 1.785 0.011 A 51 GLU HBy H 1 2.456 0.018 A 51 GLU HGx H 1 2.122 0.011 A 51 GLU HGy H 1 2.367 0.011 A 51 GLU C C 13 176.922 0.006 A 51 GLU CA C 13 55.916 0.055 A 51 GLU CB C 13 29.200 0.068 A 51 GLU CG C 13 35.411 0.087 A 51 GLU N N 15 119.270 0.021 A 52 GLY H H 1 8.092 0.007 A 52 GLY HAy H 1 3.972 0.011 A 52 GLY HAx H 1 3.813 0.016 A 52 GLY C C 13 176.755 0.003 A 52 GLY CA C 13 47.914 0.050 A 52 GLY N N 15 107.541 0.023 A 53 GLU H H 1 8.496 0.005 A 53 GLU HA H 1 4.065 0.013 A 53 GLU HB2 H 1 1.971 0.010 A 53 GLU HB3 H 1 1.969 0.010 A 53 GLU HG2 H 1 2.218 0.015 A 53 GLU HG3 H 1 2.218 0.015 A 53 GLU C C 13 179.052 0.005 A 53 GLU CA C 13 59.280 0.040 A 53 GLU CB C 13 28.968 0.083 A 53 GLU CG C 13 36.256 0.077 A 53 GLU N N 15 121.603 0.027 A 54 LYS H H 1 7.857 0.009 A 54 LYS HA H 1 3.923 0.015 A 54 LYS HBy H 1 1.526 0.010 A 54 LYS HBx H 1 1.245 0.010 A 54 LYS HD2 H 1 1.293 0.004 A 54 LYS HD3 H 1 1.293 0.004 A 54 LYS HE2 H 1 2.740 0.012 A 54 LYS HE3 H 1 2.740 0.012 A 54 LYS HGx H 1 0.977 0.007 A 54 LYS HGy H 1 1.166 0.010 A 54 LYS C C 13 179.058 0.004 A 54 LYS CA C 13 58.800 0.054 A 54 LYS CB C 13 31.551 0.068 A 54 LYS CD C 13 28.686 0.083 A 54 LYS CE C 13 41.998 0.058 A 54 LYS CG C 13 24.805 0.083 A 54 LYS N N 15 120.837 0.035 A 55 PHE H H 1 8.382 0.009 A 55 PHE HA H 1 4.021 0.013 A 55 PHE HBx H 1 2.939 0.010 A 55 PHE HBy H 1 3.296 0.015 A 55 PHE C C 13 178.001 0.006 A 55 PHE CA C 13 61.911 0.049 A 55 PHE CB C 13 38.553 0.065 A 55 PHE N N 15 118.608 0.029 A 56 LYS H H 1 8.111 0.011 A 56 LYS HA H 1 3.828 0.015 A 56 LYS HB2 H 1 1.879 0.010 A 56 LYS HB3 H 1 1.879 0.010 A 56 LYS HD2 H 1 1.579 0.000 A 56 LYS HD3 H 1 1.579 0.000 A 56 LYS HE2 H 1 2.881 0.000 A 56 LYS HE3 H 1 2.881 0.000 A 56 LYS HG2 H 1 1.354 0.004 A 56 LYS HG3 H 1 1.354 0.004 A 56 LYS C C 13 178.817 0.027 A 56 LYS CA C 13 59.877 0.083 A 56 LYS CB C 13 32.133 0.084 A 56 LYS CE C 13 42.066 0.000 A 56 LYS CG C 13 25.291 0.025 A 56 LYS N N 15 120.898 0.024 A 57 GLN H H 1 7.613 0.007 A 57 GLN HA H 1 4.009 0.016 A 57 GLN HBx H 1 2.089 0.015 A 57 GLN HBy H 1 2.140 0.022 A 57 GLN HGx H 1 2.281 0.008 A 57 GLN HGy H 1 2.512 0.017 A 57 GLN C C 13 179.333 0.015 A 57 GLN CA C 13 59.109 0.087 A 57 GLN CB C 13 28.595 0.099 A 57 GLN CG C 13 33.967 0.067 A 57 GLN N N 15 118.600 0.030 A 58 ILE H H 1 8.011 0.015 A 58 ILE HA H 1 3.559 0.014 A 58 ILE HB H 1 1.664 0.014 A 58 ILE HD1% H 1 0.730 0.016 A 58 ILE HG1y H 1 1.613 0.011 A 58 ILE HG1x H 1 1.144 0.014 A 58 ILE HG2% H 1 0.880 0.020 A 58 ILE C C 13 177.152 0.006 A 58 ILE CA C 13 65.068 0.055 A 58 ILE CB C 13 38.381 0.058 A 58 ILE CD1 C 13 15.790 0.057 A 58 ILE CG1 C 13 28.756 0.067 A 58 ILE CG2 C 13 18.275 0.066 A 58 ILE N N 15 118.709 0.039 A 59 SER H H 1 8.030 0.004 A 59 SER HA H 1 3.948 0.017 A 59 SER HBx H 1 3.597 0.017 A 59 SER HBy H 1 3.656 0.015 A 59 SER HG H 1 6.346 0.000 A 59 SER C C 13 175.949 0.011 A 59 SER CA C 13 62.315 0.094 A 59 SER N N 15 116.112 0.026 A 60 GLN H H 1 7.933 0.010 A 60 GLN HA H 1 3.801 0.009 A 60 GLN HBx H 1 1.818 0.017 A 60 GLN HBy H 1 1.976 0.011 A 60 GLN HGx H 1 2.060 0.004 A 60 GLN HGy H 1 2.209 0.011 A 60 GLN C C 13 176.942 0.007 A 60 GLN CA C 13 58.762 0.122 A 60 GLN CB C 13 28.498 0.041 A 60 GLN CG C 13 33.765 0.051 A 60 GLN N N 15 122.099 0.021 A 61 ALA H H 1 7.354 0.012 A 61 ALA HA H 1 2.636 0.016 A 61 ALA HB% H 1 1.179 0.010 A 61 ALA C C 13 178.507 0.009 A 61 ALA CA C 13 54.126 0.075 A 61 ALA CB C 13 18.462 0.061 A 61 ALA N N 15 119.367 0.026 A 62 TYR H H 1 7.994 0.009 A 62 TYR HA H 1 3.633 0.010 A 62 TYR HBx H 1 2.315 0.008 A 62 TYR HBy H 1 2.632 0.015 A 62 TYR C C 13 177.421 0.004 A 62 TYR CA C 13 61.676 0.066 A 62 TYR CB C 13 39.162 0.064 A 62 TYR N N 15 115.613 0.037 A 63 GLU H H 1 8.151 0.006 A 63 GLU HA H 1 3.347 0.009 A 63 GLU HBy H 1 1.883 0.014 A 63 GLU HBx H 1 1.852 0.010 A 63 GLU HGx H 1 2.012 0.005 A 63 GLU HGy H 1 2.157 0.016 A 63 GLU C C 13 177.687 0.009 A 63 GLU CA C 13 59.562 0.048 A 63 GLU CB C 13 29.115 0.068 A 63 GLU CG C 13 36.237 0.043 A 63 GLU N N 15 121.396 0.025 A 64 VAL H H 1 6.814 0.009 A 64 VAL HA H 1 3.377 0.010 A 64 VAL HB H 1 1.347 0.010 A 64 VAL HGx% H 1 0.529 0.012 A 64 VAL HGy% H 1 0.800 0.009 A 64 VAL C C 13 175.925 0.006 A 64 VAL CA C 13 65.806 0.044 A 64 VAL CB C 13 31.786 0.074 A 64 VAL CGx C 13 20.731 0.068 A 64 VAL CGy C 13 22.813 0.056 A 64 VAL N N 15 115.850 0.039 A 65 LEU H H 1 7.398 0.006 A 65 LEU HA H 1 3.569 0.010 A 65 LEU HBx H 1 1.067 0.019 A 65 LEU HBy H 1 1.275 0.008 A 65 LEU HDx% H 1 0.037 0.013 A 65 LEU HDy% H 1 0.279 0.018 A 65 LEU HG H 1 1.393 0.018 A 65 LEU C C 13 177.124 0.006 A 65 LEU CA C 13 56.645 0.032 A 65 LEU CB C 13 42.589 0.026 A 65 LEU CD1 C 13 22.562 0.000 A 65 LEU CD2 C 13 22.562 0.000 A 65 LEU CG C 13 25.805 0.000 A 65 LEU N N 15 111.438 0.042 A 66 SER H H 1 7.700 0.014 A 66 SER HA H 1 4.028 0.014 A 66 SER HBx H 1 2.556 0.021 A 66 SER HBy H 1 3.410 0.017 A 66 SER C C 13 173.286 0.000 A 66 SER CA C 13 59.232 0.025 A 66 SER CB C 13 63.066 0.035 A 66 SER N N 15 108.642 0.042 A 67 ASP H H 1 6.879 0.007 A 67 ASP HA H 1 4.668 0.012 A 67 ASP HBx H 1 2.403 0.016 A 67 ASP HBy H 1 2.825 0.016 A 67 ASP C C 13 174.913 0.005 A 67 ASP CA C 13 52.487 0.038 A 67 ASP CB C 13 43.218 0.068 A 67 ASP N N 15 124.276 0.021 A 68 ALA H H 1 8.693 0.012 A 68 ALA HA H 1 3.853 0.007 A 68 ALA HB% H 1 1.396 0.011 A 68 ALA C C 13 180.336 0.007 A 68 ALA CA C 13 55.912 0.048 A 68 ALA CB C 13 18.645 0.077 A 68 ALA N N 15 127.326 0.040 A 69 LYS H H 1 7.950 0.009 A 69 LYS HA H 1 4.162 0.009 A 69 LYS HBx H 1 1.841 0.021 A 69 LYS HBy H 1 1.874 0.015 A 69 LYS HD2 H 1 1.657 0.007 A 69 LYS HD3 H 1 1.657 0.007 A 69 LYS HE2 H 1 2.929 0.005 A 69 LYS HE3 H 1 2.929 0.005 A 69 LYS HGx H 1 1.401 0.016 A 69 LYS HGy H 1 1.432 0.021 A 69 LYS C C 13 179.515 0.006 A 69 LYS CA C 13 58.562 0.102 A 69 LYS CB C 13 31.840 0.060 A 69 LYS CD C 13 28.539 0.027 A 69 LYS CE C 13 42.045 0.021 A 69 LYS CG C 13 25.058 0.082 A 69 LYS N N 15 116.929 0.032 A 70 LYS H H 1 8.184 0.011 A 70 LYS HA H 1 3.960 0.012 A 70 LYS HBy H 1 2.354 0.018 A 70 LYS HBx H 1 1.791 0.016 A 70 LYS HD2 H 1 1.585 0.019 A 70 LYS HD3 H 1 1.585 0.019 A 70 LYS HE2 H 1 2.859 0.009 A 70 LYS HE3 H 1 2.861 0.008 A 70 LYS HGx H 1 1.299 0.007 A 70 LYS HGy H 1 1.498 0.016 A 70 LYS C C 13 179.938 0.006 A 70 LYS CA C 13 60.066 0.044 A 70 LYS CB C 13 32.695 0.077 A 70 LYS CD C 13 30.010 0.128 A 70 LYS CE C 13 42.252 0.004 A 70 LYS CG C 13 26.528 0.080 A 70 LYS N N 15 121.286 0.022 A 71 ARG H H 1 9.290 0.016 A 71 ARG HA H 1 3.668 0.023 A 71 ARG HBy H 1 2.135 0.013 A 71 ARG HBx H 1 1.714 0.009 A 71 ARG HDx H 1 3.122 0.020 A 71 ARG HDy H 1 3.524 0.016 A 71 ARG HGx H 1 1.713 0.010 A 71 ARG HGy H 1 1.847 0.009 A 71 ARG C C 13 177.356 0.004 A 71 ARG CA C 13 60.127 0.049 A 71 ARG CB C 13 29.668 0.098 A 71 ARG CD C 13 43.826 0.053 A 71 ARG N N 15 122.794 0.044 A 72 GLU H H 1 7.607 0.009 A 72 GLU HA H 1 4.096 0.011 A 72 GLU HB2 H 1 2.129 0.012 A 72 GLU HB3 H 1 2.136 0.015 A 72 GLU HG2 H 1 2.363 0.016 A 72 GLU HG3 H 1 2.363 0.016 A 72 GLU C C 13 179.073 0.006 A 72 GLU CA C 13 59.456 0.032 A 72 GLU CB C 13 29.615 0.080 A 72 GLU CG C 13 36.206 0.034 A 72 GLU N N 15 118.390 0.020 A 73 LEU H H 1 7.398 0.009 A 73 LEU HA H 1 4.032 0.016 A 73 LEU HBy H 1 1.793 0.014 A 73 LEU HBx H 1 1.584 0.010 A 73 LEU HDx% H 1 0.848 0.012 A 73 LEU HDy% H 1 0.863 0.014 A 73 LEU HG H 1 1.741 0.011 A 73 LEU C C 13 179.696 0.006 A 73 LEU CA C 13 57.597 0.047 A 73 LEU CB C 13 41.815 0.095 A 73 LEU CDx C 13 23.368 0.067 A 73 LEU CDy C 13 24.953 0.041 A 73 LEU CG C 13 26.901 0.068 A 73 LEU N N 15 117.921 0.030 A 74 TYR H H 1 8.316 0.009 A 74 TYR HA H 1 4.092 0.012 A 74 TYR HBy H 1 3.068 0.029 A 74 TYR HBx H 1 3.027 0.017 A 74 TYR C C 13 178.166 0.008 A 74 TYR CA C 13 61.458 0.060 A 74 TYR CB C 13 38.778 0.051 A 74 TYR N N 15 122.662 0.026 A 75 ASP H H 1 8.770 0.011 A 75 ASP HA H 1 4.423 0.011 A 75 ASP HBy H 1 2.718 0.010 A 75 ASP HBx H 1 2.705 0.020 A 75 ASP C C 13 177.726 0.004 A 75 ASP CA C 13 56.177 0.039 A 75 ASP CB C 13 40.800 0.009 A 75 ASP N N 15 118.842 0.041 A 76 LYS H H 1 7.610 0.005 A 76 LYS HA H 1 4.130 0.020 A 76 LYS HB2 H 1 1.862 0.009 A 76 LYS HB3 H 1 1.862 0.009 A 76 LYS HD2 H 1 1.645 0.006 A 76 LYS HD3 H 1 1.645 0.006 A 76 LYS C C 13 177.006 0.007 A 76 LYS CA C 13 57.537 0.046 A 76 LYS CB C 13 33.136 0.049 A 76 LYS CD C 13 29.444 0.079 A 76 LYS CE C 13 42.226 0.000 A 76 LYS CG C 13 25.248 0.000 A 76 LYS N N 15 118.955 0.040 A 77 GLY H H 1 7.466 0.007 A 77 GLY HA2 H 1 3.627 0.006 A 77 GLY HA3 H 1 3.627 0.006 A 77 GLY C C 13 179.086 0.000 A 77 GLY CA C 13 46.454 0.038 A 77 GLY N N 15 113.315 0.030 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 11 MET HA A 11 MET HBx 1.0 1.720 3.286 2 2 A 11 MET HA A 11 MET HGx 1.0 1.720 3.727 3 2 A 11 MET HA A 11 MET HGy 1.0 1.720 3.727 4 3 A 11 MET HA A 12 VAL H 1.0 1.720 3.060 5 4 A 12 VAL H A 12 VAL HB 1.0 2.732 6.557 6 5 A 12 VAL HA A 13 LYS HG2 1.0 1.720 3.755 7 5 A 12 VAL HA A 13 LYS HG3 1.0 1.720 3.755 8 6 A 12 VAL HA A 15 THR HG2% 1.0 1.720 4.719 9 7 A 12 VAL HB A 13 LYS H 1.0 3.017 8.241 10 8 A 12 VAL HA A 13 LYS H 1.0 2.229 5.350 11 9 A 13 LYS HA A 13 LYS HG2 1.0 1.720 3.498 12 9 A 13 LYS HG3 A 13 LYS HA 1.0 1.720 3.498 13 10 A 13 LYS HA A 13 LYS HG2 1.0 1.720 3.317 14 11 A 13 LYS HE3 A 13 LYS HG2 1.0 1.720 3.631 15 11 A 13 LYS HE2 A 13 LYS HG2 1.0 1.720 3.631 16 11 A 13 LYS HG3 A 13 LYS HE2 1.0 1.720 3.631 17 11 A 13 LYS HG3 A 13 LYS HE3 1.0 1.720 3.631 18 12 A 13 LYS HA A 13 LYS HBy 1.0 1.720 2.831 19 13 A 13 LYS H A 13 LYS HBx 1.0 1.720 3.493 20 14 A 13 LYS HA A 13 LYS HBx 1.0 1.720 3.376 21 15 A 13 LYS H A 13 LYS HBy 1.0 2.479 5.948 22 15 A 13 LYS H A 13 LYS HBx 1.0 2.479 5.948 23 16 A 13 LYS H A 13 LYS HG2 1.0 3.069 8.367 24 16 A 13 LYS HG3 A 13 LYS H 1.0 3.069 8.367 25 17 A 13 LYS H A 13 LYS HA 1.0 1.720 3.353 26 18 A 15 THR H A 14 GLU HA 1.0 1.720 2.612 27 19 A 15 THR H A 14 GLU HBx 1.0 3.238 7.771 28 20 A 15 THR HA A 15 THR HB 1.0 1.720 2.630 29 21 A 15 THR HG2% A 15 THR HA 1.0 1.720 2.711 30 22 A 15 THR H A 15 THR HA 1.0 1.720 3.425 31 23 A 15 THR HG2% A 15 THR HB 1.0 1.720 2.514 32 24 A 15 THR H A 15 THR HB 1.0 1.720 3.547 33 25 A 15 THR HG2% A 15 THR H 1.0 2.951 7.082 34 26 A 16 THR HG2% A 14 GLU HG2 1.0 1.720 3.761 35 26 A 16 THR HG2% A 14 GLU HG3 1.0 1.720 3.761 36 27 A 15 THR HG2% A 16 THR H 1.0 1.720 3.600 37 28 A 15 THR HB A 16 THR H 1.0 1.720 3.886 38 29 A 15 THR H A 16 THR H 1.0 3.277 7.866 39 30 A 15 THR HA A 16 THR H 1.0 1.720 2.875 40 31 A 16 THR HG2% A 16 THR HA 1.0 1.720 3.621 41 32 A 16 THR HG2% A 16 THR H 1.0 1.720 2.953 42 33 A 16 THR HA A 16 THR HB 1.0 1.720 3.014 43 34 A 16 THR HG2% A 16 THR HB 1.0 1.720 2.599 44 35 A 16 THR H A 16 THR HA 1.0 1.720 3.660 45 36 A 16 THR HG2% A 18 TYR H 1.0 1.720 3.684 46 37 A 16 THR H A 19 ASP HBx 1.0 1.720 3.186 47 38 A 16 THR HG2% A 19 ASP H 1.0 1.722 4.134 48 39 A 16 THR H A 19 ASP HBy 1.0 1.720 3.973 49 40 A 16 THR HG2% A 19 ASP HBx 1.0 1.720 3.919 50 41 A 16 THR HA A 17 TYR H 1.0 1.720 3.112 51 42 A 16 THR HG2% A 17 TYR H 1.0 1.720 3.360 52 43 A 16 THR HB A 17 TYR H 1.0 1.720 3.356 53 44 A 16 THR H A 17 TYR H 1.0 3.439 8.000 54 45 A 17 TYR HBy A 17 TYR HBx 1.0 1.720 2.894 55 46 A 17 TYR H A 17 TYR HA 1.0 1.720 3.583 56 47 A 17 TYR HBx A 17 TYR HA 1.0 1.720 3.474 57 48 A 17 TYR HBy A 17 TYR HA 1.0 1.720 3.264 58 49 A 17 TYR H A 17 TYR HBy 1.0 1.720 3.912 59 50 A 17 TYR H A 17 TYR HBx 1.0 1.720 3.754 60 51 A 17 TYR HBy A 18 TYR HD% 1.0 1.720 3.547 61 52 A 17 TYR HBx A 18 TYR HD% 1.0 1.720 3.553 62 53 A 18 TYR H A 17 TYR H 1.0 2.611 6.266 63 54 A 18 TYR H A 17 TYR HBx 1.0 2.895 6.948 64 55 A 19 ASP H A 17 TYR H 1.0 3.247 7.794 65 56 A 17 TYR HA A 20 VAL HGy% 1.0 1.720 2.717 66 57 A 17 TYR HA A 20 VAL HGx% 1.0 1.720 3.698 67 58 A 17 TYR HA A 20 VAL HB 1.0 1.720 3.269 68 59 A 17 TYR HA A 61 ALA HB% 1.0 1.720 3.022 69 60 A 17 TYR HBx A 61 ALA HB% 1.0 1.720 3.254 70 61 A 17 TYR HBy A 61 ALA HB% 1.0 1.720 3.496 71 62 A 17 TYR HBy A 65 LEU HDy% 1.0 1.720 3.443 72 63 A 17 TYR HBx A 65 LEU HDy% 1.0 1.720 3.641 73 64 A 17 TYR HA A 65 LEU HDy% 1.0 1.730 4.153 74 65 A 17 TYR HBx A 65 LEU HDx% 1.0 1.720 3.896 75 66 A 16 THR HA A 18 TYR H 1.0 1.777 4.266 76 67 A 16 THR HB A 18 TYR H 1.0 2.661 6.385 77 68 A 18 TYR HBy A 18 TYR HA 1.0 1.720 3.325 78 69 A 18 TYR HBy A 18 TYR HBx 1.0 1.720 2.748 79 70 A 18 TYR HA A 18 TYR HBx 1.0 1.720 3.091 80 71 A 18 TYR H A 18 TYR HBy 1.0 1.720 3.252 81 72 A 18 TYR H A 18 TYR HBx 1.0 1.720 3.134 82 73 A 18 TYR H A 18 TYR HA 1.0 1.720 3.026 83 74 A 18 TYR H A 19 ASP H 1.0 2.372 5.693 84 75 A 18 TYR HA A 23 VAL HGx% 1.0 1.720 2.732 85 76 A 18 TYR HBx A 23 VAL HGx% 1.0 1.720 2.940 86 77 A 18 TYR H A 23 VAL HGx% 1.0 3.249 7.796 87 78 A 18 TYR H A 25 PRO HA 1.0 3.284 7.882 88 79 A 65 LEU HDy% A 18 TYR HA 1.0 1.720 3.395 89 80 A 18 TYR H A 65 LEU HDy% 1.0 2.965 7.116 90 81 A 18 TYR H A 65 LEU HDx% 1.0 3.547 8.000 91 82 A 15 THR HA A 19 ASP HBy 1.0 1.720 3.776 92 83 A 15 THR HG2% A 19 ASP HBx 1.0 1.720 3.121 93 84 A 15 THR HA A 19 ASP HBx 1.0 1.720 3.973 94 85 A 15 THR HG2% A 19 ASP HBy 1.0 1.720 3.074 95 86 A 15 THR HG2% A 19 ASP H 1.0 1.720 4.045 96 87 A 19 ASP H A 18 TYR HBx 1.0 1.720 3.863 97 88 A 19 ASP H A 18 TYR HBy 1.0 1.720 3.850 98 89 A 19 ASP HBy A 19 ASP HA 1.0 1.720 3.104 99 90 A 19 ASP H A 19 ASP HBy 1.0 1.720 3.462 100 91 A 19 ASP HBx A 19 ASP HBy 1.0 1.720 2.532 101 92 A 19 ASP HBx A 19 ASP HA 1.0 1.720 2.790 102 93 A 19 ASP H A 19 ASP HA 1.0 1.720 3.317 103 94 A 19 ASP HBy A 20 VAL HGy% 1.0 1.720 3.626 104 95 A 15 THR HG2% A 20 VAL HGy% 1.0 1.720 2.390 105 96 A 15 THR HG2% A 20 VAL H 1.0 1.720 3.766 106 97 A 15 THR HG2% A 20 VAL HA 1.0 1.720 4.039 107 98 A 17 TYR HA A 20 VAL H 1.0 2.799 6.718 108 99 A 18 TYR H A 20 VAL H 1.0 3.419 8.000 109 100 A 19 ASP HA A 20 VAL H 1.0 1.720 3.769 110 101 A 19 ASP H A 20 VAL H 1.0 2.685 6.444 111 102 A 19 ASP HBx A 20 VAL H 1.0 1.720 3.779 112 103 A 19 ASP HBy A 20 VAL H 1.0 1.720 3.508 113 104 A 20 VAL HGy% A 20 VAL HB 1.0 1.720 2.442 114 105 A 20 VAL HB A 20 VAL HA 1.0 1.720 3.128 115 106 A 20 VAL HGx% A 20 VAL HA 1.0 1.720 2.876 116 107 A 20 VAL H A 20 VAL HA 1.0 1.720 3.078 117 108 A 20 VAL HGx% A 20 VAL HB 1.0 1.720 2.554 118 109 A 20 VAL HGy% A 20 VAL HA 1.0 1.720 2.566 119 110 A 20 VAL HGy% A 20 VAL HGx% 1.0 1.720 2.192 120 111 A 20 VAL HB A 20 VAL H 1.0 1.720 3.149 121 112 A 20 VAL HGx% A 20 VAL H 1.0 2.677 6.424 122 113 A 20 VAL HGy% A 20 VAL H 1.0 1.720 2.525 123 114 A 20 VAL HA A 22 GLY H 1.0 3.063 7.351 124 115 A 20 VAL HGy% A 57 GLN HA 1.0 1.720 4.508 125 116 A 20 VAL HB A 61 ALA HB% 1.0 1.720 3.155 126 117 A 20 VAL HGy% A 21 LEU H 1.0 1.720 3.317 127 118 A 20 VAL HA A 21 LEU H 1.0 1.720 3.740 128 119 A 20 VAL H A 21 LEU H 1.0 2.531 6.076 129 120 A 20 VAL HB A 21 LEU H 1.0 1.720 3.522 130 121 A 21 LEU H A 21 LEU HBx 1.0 1.720 3.486 131 122 A 21 LEU HBy A 21 LEU HDy% 1.0 1.720 3.182 132 123 A 21 LEU HBx A 21 LEU HDx% 1.0 1.720 3.166 133 124 A 21 LEU HBy A 21 LEU HA 1.0 1.720 3.056 134 125 A 21 LEU HBy A 21 LEU HDx% 1.0 1.720 3.142 135 126 A 21 LEU HBx A 21 LEU HA 1.0 1.720 3.056 136 127 A 21 LEU H A 21 LEU HA 1.0 1.720 3.388 137 128 A 21 LEU HDx% A 21 LEU HA 1.0 1.720 2.533 138 129 A 21 LEU HBx A 21 LEU HDy% 1.0 1.720 3.010 139 130 A 21 LEU H A 21 LEU HG 1.0 2.137 5.128 140 131 A 21 LEU H A 21 LEU HDx% 1.0 2.565 6.156 141 132 A 21 LEU H A 21 LEU HBy 1.0 1.720 3.540 142 133 A 21 LEU H A 22 GLY HA3 1.0 1.720 4.106 143 133 A 21 LEU H A 22 GLY HA2 1.0 1.720 4.106 144 134 A 22 GLY H A 21 LEU H 1.0 2.279 5.470 145 135 A 21 LEU H A 23 VAL H 1.0 3.160 7.583 146 136 A 21 LEU HDx% A 36 TYR HBy 1.0 1.720 3.685 147 137 A 21 LEU HDx% A 36 TYR HA 1.0 1.720 2.854 148 138 A 61 ALA HB% A 21 LEU HG 1.0 1.720 4.036 149 139 A 61 ALA HB% A 21 LEU H 1.0 3.049 7.318 150 140 A 21 LEU HDy% A 62 TYR HA 1.0 1.720 3.181 151 141 A 18 TYR H A 22 GLY H 1.0 3.207 7.696 152 142 A 19 ASP HA A 22 GLY HA3 1.0 1.720 3.712 153 142 A 19 ASP HA A 22 GLY HA2 1.0 1.720 3.712 154 143 A 19 ASP HA A 22 GLY H 1.0 1.720 3.252 155 144 A 22 GLY H A 21 LEU HA 1.0 1.720 3.709 156 145 A 22 GLY HA2 A 22 GLY HA3 1.0 1.720 2.064 157 146 A 22 GLY H A 22 GLY HA3 1.0 1.720 2.593 158 146 A 22 GLY H A 22 GLY HA2 1.0 1.720 2.593 159 147 A 23 VAL HA A 22 GLY HA3 1.0 1.827 4.385 160 147 A 22 GLY HA2 A 23 VAL HA 1.0 1.827 4.385 161 148 A 22 GLY HA2 A 39 LEU HD1% 1.0 1.720 3.926 162 148 A 22 GLY HA3 A 39 LEU HD1% 1.0 1.720 3.926 163 149 A 18 TYR HBx A 23 VAL H 1.0 3.218 7.723 164 150 A 18 TYR HBy A 23 VAL H 1.0 3.409 8.000 165 151 A 19 ASP HA A 23 VAL H 1.0 3.057 7.336 166 152 A 23 VAL H A 22 GLY HA3 1.0 2.591 6.220 167 152 A 22 GLY HA2 A 23 VAL H 1.0 2.591 6.220 168 153 A 23 VAL HGx% A 23 VAL HGy% 1.0 1.720 2.305 169 154 A 23 VAL H A 23 VAL HB 1.0 1.721 4.130 170 155 A 23 VAL HGx% A 23 VAL H 1.0 1.720 2.488 171 156 A 23 VAL HGy% A 23 VAL HB 1.0 1.720 2.418 172 157 A 23 VAL HGx% A 23 VAL HB 1.0 1.720 2.506 173 158 A 23 VAL HGx% A 23 VAL HA 1.0 1.720 3.074 174 159 A 23 VAL HA A 23 VAL HB 1.0 1.720 2.658 175 160 A 23 VAL HA A 23 VAL HGy% 1.0 1.720 2.526 176 161 A 23 VAL H A 23 VAL HA 1.0 2.650 6.360 177 162 A 23 VAL HGx% A 31 GLU HG2 1.0 1.720 3.758 178 162 A 23 VAL HGx% A 31 GLU HG3 1.0 1.720 3.758 179 163 A 23 VAL HGy% A 32 LEU HA 1.0 1.720 2.974 180 164 A 65 LEU HDy% A 23 VAL HGx% 1.0 1.720 3.270 181 165 A 23 VAL HGx% A 24 LYS H 1.0 1.720 3.092 182 166 A 23 VAL HA A 24 LYS H 1.0 1.720 2.561 183 167 A 23 VAL HGy% A 24 LYS H 1.0 1.720 3.059 184 168 A 24 LYS H A 24 LYS HBx 1.0 1.720 3.389 185 169 A 24 LYS H A 24 LYS HA 1.0 1.720 3.496 186 170 A 24 LYS HA A 24 LYS HBy 1.0 1.720 3.067 187 171 A 24 LYS HBx A 24 LYS HA 1.0 1.720 3.019 188 172 A 24 LYS H A 24 LYS HBy 1.0 1.720 3.488 189 173 A 24 LYS HBy A 25 PRO HDy 1.0 1.720 3.499 190 174 A 24 LYS HBx A 25 PRO HDx 1.0 1.720 3.726 191 175 A 24 LYS HBy A 25 PRO HDx 1.0 1.720 3.294 192 176 A 24 LYS HBx A 25 PRO HDy 1.0 1.720 4.000 193 177 A 24 LYS HA A 25 PRO HDy 1.0 1.720 2.658 194 178 A 24 LYS HA A 25 PRO HDx 1.0 1.720 2.830 195 179 A 24 LYS H A 26 ASN H 1.0 3.493 8.000 196 180 A 24 LYS H A 27 ALA HB% 1.0 1.720 3.114 197 181 A 25 PRO HBy A 25 PRO HBx 1.0 1.720 2.190 198 182 A 25 PRO HA A 25 PRO HBx 1.0 1.720 2.845 199 183 A 25 PRO HA A 25 PRO HBy 1.0 1.720 2.747 200 184 A 25 PRO HDy A 25 PRO HDx 1.0 1.720 2.450 201 185 A 25 PRO HDx A 25 PRO HBx 1.0 1.720 2.975 202 186 A 24 LYS HBy A 26 ASN H 1.0 1.720 3.682 203 187 A 24 LYS HBx A 26 ASN H 1.0 1.720 3.983 204 188 A 25 PRO HDx A 26 ASN H 1.0 1.720 3.678 205 189 A 25 PRO HA A 26 ASN H 1.0 1.720 3.599 206 190 A 26 ASN H A 26 ASN HA 1.0 1.720 3.145 207 191 A 26 ASN HA A 26 ASN HBx 1.0 1.720 2.755 208 192 A 26 ASN H A 26 ASN HBy 1.0 1.720 3.620 209 193 A 26 ASN HBx A 26 ASN HBy 1.0 1.720 2.465 210 194 A 26 ASN HA A 26 ASN HBy 1.0 1.720 2.770 211 195 A 26 ASN H A 26 ASN HBx 1.0 1.720 3.920 212 196 A 26 ASN H A 27 ALA HB% 1.0 1.720 3.449 213 197 A 23 VAL HGx% A 27 ALA HB% 1.0 1.720 2.590 214 198 A 23 VAL HA A 27 ALA HB% 1.0 1.720 4.390 215 199 A 23 VAL HGx% A 27 ALA H 1.0 3.103 7.446 216 200 A 24 LYS HBx A 27 ALA H 1.0 2.944 7.064 217 201 A 24 LYS H A 27 ALA H 1.0 3.351 8.000 218 202 A 26 ASN HA A 27 ALA H 1.0 1.720 3.358 219 203 A 26 ASN H A 27 ALA HA 1.0 1.747 4.192 220 204 A 26 ASN HBx A 27 ALA H 1.0 3.162 7.589 221 205 A 26 ASN H A 27 ALA H 1.0 2.151 5.164 222 206 A 27 ALA HB% A 27 ALA HA 1.0 1.720 2.400 223 207 A 27 ALA HB% A 27 ALA H 1.0 1.720 2.378 224 208 A 27 ALA H A 27 ALA HA 1.0 1.720 2.983 225 209 A 27 ALA HA A 28 THR HG2% 1.0 1.720 2.998 226 210 A 27 ALA H A 29 GLN HA 1.0 3.329 7.990 227 211 A 27 ALA HA A 31 GLU HBy 1.0 1.720 3.751 228 212 A 27 ALA HB% A 31 GLU HG2 1.0 1.720 3.265 229 212 A 31 GLU HG3 A 27 ALA HB% 1.0 1.720 3.265 230 213 A 32 LEU HA A 27 ALA HB% 1.0 1.720 3.505 231 214 A 27 ALA HB% A 28 THR H 1.0 1.720 2.826 232 215 A 27 ALA HA A 28 THR H 1.0 1.720 2.459 233 216 A 27 ALA H A 28 THR H 1.0 3.040 7.296 234 217 A 28 THR HG2% A 28 THR HB 1.0 1.720 2.430 235 218 A 28 THR HB A 28 THR HA 1.0 1.720 2.665 236 219 A 28 THR H A 28 THR HA 1.0 1.720 3.277 237 220 A 28 THR HG2% A 28 THR HA 1.0 1.720 2.554 238 221 A 28 THR HG2% A 28 THR H 1.0 1.720 2.503 239 222 A 28 THR H A 28 THR HB 1.0 3.070 7.368 240 223 A 28 THR HB A 29 GLN HB2 1.0 1.720 3.898 241 223 A 28 THR HB A 29 GLN HB3 1.0 1.720 3.898 242 224 A 28 THR HA A 29 GLN HB2 1.0 1.720 3.900 243 224 A 28 THR HA A 29 GLN HB3 1.0 1.720 3.900 244 225 A 28 THR H A 29 GLN H 1.0 3.278 7.867 245 226 A 28 THR HG2% A 29 GLN H 1.0 1.720 3.418 246 227 A 28 THR HB A 30 GLU HBx 1.0 1.721 4.132 247 228 A 28 THR HB A 30 GLU HBy 1.0 1.720 4.003 248 229 A 28 THR H A 30 GLU H 1.0 2.909 6.983 249 230 A 28 THR H A 31 GLU HBx 1.0 1.720 3.396 250 231 A 28 THR HG2% A 31 GLU HBx 1.0 1.720 3.276 251 232 A 28 THR H A 31 GLU HG2 1.0 1.720 4.049 252 232 A 31 GLU HG3 A 28 THR H 1.0 1.720 4.049 253 233 A 31 GLU HBy A 28 THR H 1.0 1.720 3.630 254 234 A 28 THR HA A 29 GLN H 1.0 1.720 2.946 255 235 A 28 THR HB A 29 GLN H 1.0 1.956 4.693 256 236 A 29 GLN H A 29 GLN HG3 1.0 1.720 3.955 257 236 A 29 GLN H A 29 GLN HG2 1.0 1.720 3.955 258 237 A 29 GLN HB2 A 29 GLN HG3 1.0 1.720 2.533 259 237 A 29 GLN HB3 A 29 GLN HG3 1.0 1.720 2.533 260 237 A 29 GLN HG2 A 29 GLN HB2 1.0 1.720 2.533 261 237 A 29 GLN HB3 A 29 GLN HG2 1.0 1.720 2.533 262 238 A 29 GLN HA A 29 GLN HB2 1.0 1.720 2.810 263 238 A 29 GLN HA A 29 GLN HB3 1.0 1.720 2.810 264 239 A 29 GLN HG2 A 29 GLN HG3 1.0 1.720 2.064 265 240 A 29 GLN H A 29 GLN HB2 1.0 1.720 3.344 266 240 A 29 GLN HB3 A 29 GLN H 1.0 1.720 3.344 267 241 A 29 GLN HA A 29 GLN HG3 1.0 1.720 3.599 268 241 A 29 GLN HA A 29 GLN HG2 1.0 1.720 3.599 269 242 A 29 GLN HB3 A 29 GLN HB2 1.0 1.720 2.064 270 243 A 29 GLN HA A 29 GLN H 1.0 1.720 3.484 271 244 A 28 THR HG2% A 30 GLU H 1.0 1.720 3.694 272 245 A 28 THR HB A 30 GLU H 1.0 1.998 4.795 273 246 A 28 THR HA A 30 GLU H 1.0 2.812 6.749 274 247 A 29 GLN HA A 30 GLU H 1.0 1.720 3.241 275 248 A 30 GLU H A 29 GLN HB2 1.0 1.720 3.688 276 248 A 29 GLN HB3 A 30 GLU H 1.0 1.720 3.688 277 249 A 30 GLU H A 29 GLN HG3 1.0 3.307 7.937 278 249 A 30 GLU H A 29 GLN HG2 1.0 3.307 7.937 279 250 A 29 GLN H A 30 GLU H 1.0 2.903 6.968 280 251 A 30 GLU HG3 A 30 GLU HG2 1.0 1.720 2.064 281 252 A 30 GLU HA A 30 GLU HG2 1.0 1.720 2.935 282 252 A 30 GLU HA A 30 GLU HG3 1.0 1.720 2.935 283 253 A 30 GLU HBx A 30 GLU H 1.0 1.720 3.360 284 254 A 30 GLU H A 30 GLU HG2 1.0 1.720 4.401 285 254 A 30 GLU H A 30 GLU HG3 1.0 1.720 4.401 286 255 A 23 VAL HGy% A 31 GLU HBy 1.0 1.720 4.556 287 256 A 27 ALA HB% A 31 GLU HBx 1.0 1.720 3.530 288 257 A 27 ALA HA A 31 GLU H 1.0 3.322 7.973 289 258 A 28 THR HA A 31 GLU HBx 1.0 1.720 3.950 290 259 A 28 THR HA A 31 GLU H 1.0 3.453 8.000 291 260 A 28 THR HB A 31 GLU H 1.0 2.722 6.533 292 261 A 28 THR H A 31 GLU H 1.0 3.194 7.664 293 262 A 28 THR HG2% A 31 GLU H 1.0 1.720 3.694 294 263 A 30 GLU HBx A 31 GLU H 1.0 1.720 3.587 295 264 A 31 GLU H A 30 GLU HG2 1.0 1.720 3.844 296 264 A 30 GLU HG3 A 31 GLU H 1.0 1.720 3.844 297 265 A 30 GLU H A 31 GLU H 1.0 2.547 6.114 298 266 A 31 GLU HBy A 31 GLU HG2 1.0 1.720 2.959 299 266 A 31 GLU HG3 A 31 GLU HBy 1.0 1.720 2.959 300 267 A 31 GLU HBx A 31 GLU HG2 1.0 1.720 2.334 301 267 A 31 GLU HG3 A 31 GLU HBx 1.0 1.720 2.334 302 268 A 31 GLU HBx A 31 GLU HA 1.0 1.720 2.855 303 269 A 31 GLU HBy A 31 GLU HBx 1.0 1.720 2.540 304 270 A 31 GLU HA A 31 GLU HG2 1.0 1.720 3.251 305 270 A 31 GLU HG3 A 31 GLU HA 1.0 1.720 3.251 306 271 A 31 GLU HBy A 31 GLU HA 1.0 1.720 3.120 307 272 A 31 GLU H A 31 GLU HG2 1.0 1.720 3.572 308 272 A 31 GLU HG3 A 31 GLU H 1.0 1.720 3.572 309 273 A 31 GLU HBx A 31 GLU H 1.0 1.720 3.346 310 274 A 31 GLU H A 32 LEU H 1.0 2.323 5.575 311 275 A 31 GLU HA A 34 LYS HB2 1.0 1.720 2.308 312 275 A 31 GLU HA A 34 LYS HB3 1.0 1.720 2.308 313 276 A 23 VAL HGy% A 32 LEU HDy% 1.0 1.720 4.270 314 277 A 27 ALA HB% A 32 LEU HDy% 1.0 1.720 3.837 315 278 A 27 ALA HB% A 32 LEU HDx% 1.0 1.720 2.575 316 279 A 27 ALA HB% A 32 LEU H 1.0 1.720 3.464 317 280 A 28 THR HB A 32 LEU H 1.0 3.432 8.000 318 281 A 31 GLU HBx A 32 LEU H 1.0 2.451 5.882 319 282 A 32 LEU HA A 32 LEU HDx% 1.0 1.720 2.682 320 283 A 32 LEU HDy% A 32 LEU HG 1.0 1.720 2.624 321 284 A 32 LEU HA A 32 LEU HG 1.0 1.720 2.676 322 285 A 32 LEU HA A 32 LEU HBx 1.0 1.720 2.689 323 286 A 32 LEU HG A 32 LEU HBy 1.0 1.720 2.794 324 287 A 32 LEU HG A 32 LEU HBx 1.0 1.720 2.734 325 288 A 32 LEU HA A 32 LEU H 1.0 1.720 3.203 326 289 A 32 LEU HA A 32 LEU HBy 1.0 1.720 3.238 327 290 A 32 LEU HDy% A 32 LEU HBy 1.0 1.720 3.492 328 291 A 32 LEU HBx A 32 LEU HBy 1.0 1.720 2.696 329 292 A 32 LEU H A 32 LEU HBy 1.0 1.720 3.278 330 293 A 32 LEU H A 32 LEU HBx 1.0 2.545 6.108 331 294 A 32 LEU H A 33 LYS HB3 1.0 2.477 5.946 332 294 A 32 LEU H A 33 LYS HB2 1.0 2.477 5.946 333 295 A 65 LEU HDx% A 32 LEU HG 1.0 1.720 4.349 334 296 A 65 LEU HDy% A 32 LEU HG 1.0 1.720 4.324 335 297 A 32 LEU HG A 71 ARG HDx 1.0 1.720 3.988 336 298 A 31 GLU H A 33 LYS H 1.0 2.701 6.481 337 299 A 32 LEU H A 33 LYS H 1.0 2.297 5.514 338 300 A 32 LEU HG A 33 LYS H 1.0 3.124 7.498 339 301 A 32 LEU HDy% A 33 LYS H 1.0 2.688 6.450 340 302 A 32 LEU HBx A 33 LYS H 1.0 2.624 6.299 341 303 A 32 LEU HBy A 33 LYS H 1.0 1.720 3.426 342 304 A 33 LYS HB2 A 33 LYS HB3 1.0 1.720 2.064 343 305 A 33 LYS HB3 A 33 LYS HE2 1.0 1.720 3.818 344 305 A 33 LYS HB2 A 33 LYS HE2 1.0 1.720 3.818 345 305 A 33 LYS HE3 A 33 LYS HB3 1.0 1.720 3.818 346 305 A 33 LYS HB2 A 33 LYS HE3 1.0 1.720 3.818 347 306 A 33 LYS HA A 33 LYS HB3 1.0 1.720 2.662 348 306 A 33 LYS HB2 A 33 LYS HA 1.0 1.720 2.662 349 307 A 33 LYS HB2 A 33 LYS H 1.0 1.720 2.666 350 307 A 33 LYS H A 33 LYS HB3 1.0 1.720 2.666 351 308 A 33 LYS HA A 33 LYS H 1.0 2.186 5.245 352 309 A 34 LYS HB3 A 33 LYS H 1.0 2.701 6.481 353 309 A 33 LYS H A 34 LYS HB2 1.0 2.701 6.481 354 310 A 33 LYS H A 37 ARG H 1.0 2.527 6.065 355 311 A 34 LYS H A 33 LYS HB3 1.0 2.234 5.360 356 311 A 33 LYS HB2 A 34 LYS H 1.0 2.234 5.360 357 312 A 34 LYS HB3 A 34 LYS H 1.0 1.983 4.759 358 312 A 34 LYS H A 34 LYS HB2 1.0 1.983 4.759 359 313 A 21 LEU HA A 35 ALA HB% 1.0 1.720 3.373 360 314 A 23 VAL HB A 35 ALA HB% 1.0 1.720 3.481 361 315 A 23 VAL HGy% A 35 ALA HA 1.0 1.720 4.037 362 316 A 23 VAL HGy% A 35 ALA HB% 1.0 1.720 2.420 363 317 A 32 LEU HA A 35 ALA HB% 1.0 1.720 2.836 364 318 A 35 ALA HB% A 35 ALA HA 1.0 1.720 2.399 365 319 A 35 ALA HA A 35 ALA H 1.0 1.720 3.016 366 320 A 35 ALA HB% A 35 ALA H 1.0 1.720 2.474 367 321 A 35 ALA H A 36 TYR H 1.0 2.323 5.575 368 322 A 35 ALA HA A 38 LYS HB3 1.0 1.720 2.972 369 323 A 21 LEU HDx% A 36 TYR H 1.0 1.720 3.736 370 324 A 21 LEU HDy% A 36 TYR H 1.0 3.033 7.279 371 325 A 36 TYR HBy A 33 LYS HA 1.0 1.720 3.628 372 326 A 33 LYS HA A 36 TYR H 1.0 2.805 6.732 373 327 A 35 ALA HA A 36 TYR H 1.0 1.720 3.718 374 328 A 35 ALA HB% A 36 TYR H 1.0 1.720 2.842 375 329 A 36 TYR HBx A 36 TYR H 1.0 1.720 3.348 376 330 A 36 TYR HBy A 36 TYR HA 1.0 1.720 3.010 377 331 A 36 TYR HA A 36 TYR HBx 1.0 1.720 3.491 378 332 A 36 TYR HA A 36 TYR H 1.0 1.720 3.268 379 333 A 36 TYR HBy A 36 TYR H 1.0 1.720 3.223 380 334 A 36 TYR HBx A 61 ALA H 1.0 3.363 8.000 381 335 A 35 ALA H A 37 ARG H 1.0 2.812 6.749 382 336 A 36 TYR HBx A 37 ARG H 1.0 2.454 5.891 383 337 A 36 TYR H A 37 ARG H 1.0 2.242 5.381 384 338 A 37 ARG H A 37 ARG HBy 1.0 1.720 3.322 385 339 A 37 ARG HA A 37 ARG H 1.0 1.720 3.048 386 340 A 37 ARG HA A 37 ARG HBy 1.0 1.720 2.702 387 340 A 37 ARG HA A 37 ARG HBx 1.0 1.720 2.702 388 341 A 37 ARG HA A 37 ARG HG2 1.0 1.720 3.223 389 341 A 37 ARG HA A 37 ARG HG3 1.0 1.720 3.223 390 342 A 37 ARG HA A 37 ARG HBy 1.0 1.720 3.410 391 343 A 37 ARG HBx A 37 ARG H 1.0 1.720 3.119 392 344 A 37 ARG HA A 37 ARG HD2 1.0 1.720 4.628 393 344 A 37 ARG HA A 37 ARG HD3 1.0 1.720 4.628 394 345 A 37 ARG HA A 37 ARG HBx 1.0 1.720 3.149 395 346 A 37 ARG HBx A 37 ARG H 1.0 1.938 4.652 396 346 A 37 ARG H A 37 ARG HBy 1.0 1.938 4.652 397 347 A 37 ARG HD3 A 37 ARG H 1.0 3.269 7.847 398 347 A 37 ARG H A 37 ARG HD2 1.0 3.269 7.847 399 348 A 37 ARG H A 38 LYS H 1.0 2.344 5.626 400 349 A 37 ARG H A 39 LEU H 1.0 2.950 7.081 401 350 A 41 LEU HDy% A 37 ARG H 1.0 3.298 7.915 402 350 A 37 ARG H A 41 LEU HD11 1.0 3.298 7.915 403 351 A 35 ALA HA A 38 LYS H 1.0 1.720 3.500 404 352 A 36 TYR H A 38 LYS H 1.0 3.106 7.453 405 353 A 37 ARG HA A 38 LYS H 1.0 1.720 3.798 406 354 A 38 LYS HB2 A 38 LYS HB3 1.0 1.720 2.064 407 355 A 38 LYS HA A 38 LYS HB3 1.0 1.720 2.406 408 355 A 38 LYS HA A 38 LYS HB2 1.0 1.720 2.406 409 356 A 38 LYS HB2 A 38 LYS H 1.0 1.720 2.676 410 356 A 38 LYS H A 38 LYS HB3 1.0 1.720 2.676 411 357 A 38 LYS HA A 38 LYS H 1.0 1.720 2.976 412 358 A 38 LYS H A 39 LEU H 1.0 2.267 5.440 413 359 A 38 LYS H A 41 LEU H 1.0 2.603 6.247 414 360 A 36 TYR HA A 39 LEU HG 1.0 1.720 3.330 415 361 A 36 TYR HA A 39 LEU HBy 1.0 1.720 3.805 416 362 A 36 TYR HA A 39 LEU H 1.0 1.720 3.616 417 363 A 36 TYR H A 39 LEU H 1.0 3.127 7.505 418 364 A 39 LEU HBy A 39 LEU H 1.0 1.720 3.286 419 365 A 39 LEU HBy A 39 LEU HA 1.0 1.720 2.633 420 366 A 39 LEU HA A 39 LEU HBx 1.0 1.720 3.198 421 367 A 39 LEU HA A 39 LEU H 1.0 1.720 3.156 422 368 A 39 LEU HD2% A 39 LEU HD1% 1.0 1.720 2.064 423 369 A 39 LEU HG A 39 LEU HBy 1.0 1.720 2.335 424 370 A 39 LEU HG A 39 LEU HBx 1.0 1.720 2.834 425 371 A 39 LEU HG A 39 LEU HA 1.0 1.720 3.390 426 372 A 39 LEU HBy A 39 LEU HBx 1.0 1.720 2.677 427 373 A 39 LEU HG A 39 LEU H 1.0 1.720 3.223 428 374 A 39 LEU HBx A 39 LEU H 1.0 1.720 3.548 429 375 A 39 LEU HBy A 58 ILE HG2% 1.0 1.720 2.926 430 376 A 37 ARG HA A 40 ALA HB% 1.0 1.720 2.882 431 377 A 37 ARG HA A 40 ALA H 1.0 1.720 3.673 432 378 A 38 LYS H A 40 ALA H 1.0 3.559 8.000 433 379 A 40 ALA HB% A 39 LEU H 1.0 1.720 4.528 434 380 A 39 LEU HG A 40 ALA H 1.0 1.720 3.576 435 381 A 39 LEU HBx A 40 ALA H 1.0 1.720 4.106 436 382 A 39 LEU HA A 40 ALA H 1.0 1.720 3.797 437 383 A 39 LEU HBy A 40 ALA H 1.0 1.720 3.695 438 384 A 39 LEU H A 40 ALA H 1.0 2.283 5.479 439 385 A 40 ALA HB% A 40 ALA HA 1.0 1.720 2.406 440 386 A 40 ALA HA A 40 ALA H 1.0 1.720 3.106 441 387 A 40 ALA HB% A 40 ALA H 1.0 1.720 2.458 442 388 A 40 ALA HB% A 41 LEU H 1.0 1.720 2.708 443 389 A 41 LEU HDy% A 40 ALA H 1.0 2.775 6.660 444 389 A 40 ALA H A 41 LEU HD11 1.0 2.775 6.660 445 390 A 40 ALA H A 41 LEU H 1.0 2.305 5.532 446 391 A 37 ARG HA A 41 LEU H 1.0 3.247 7.793 447 392 A 40 ALA HA A 41 LEU H 1.0 1.720 3.208 448 393 A 41 LEU HBy A 41 LEU H 1.0 1.720 2.952 449 394 A 41 LEU HBy A 41 LEU HA 1.0 1.720 3.204 450 395 A 41 LEU HA A 41 LEU HG 1.0 1.720 3.448 451 396 A 41 LEU H A 41 LEU HD11 1.0 1.720 3.468 452 397 A 41 LEU HG A 41 LEU HD11 1.0 1.720 2.867 453 397 A 41 LEU HDy% A 41 LEU HG 1.0 1.720 2.867 454 398 A 41 LEU HBx A 41 LEU HD11 1.0 1.720 2.882 455 398 A 41 LEU HDy% A 41 LEU HBx 1.0 1.720 2.882 456 399 A 41 LEU HG A 41 LEU H 1.0 1.720 3.149 457 400 A 41 LEU HBx A 41 LEU HD11 1.0 1.720 2.722 458 400 A 41 LEU HDy% A 41 LEU HBx 1.0 1.720 2.722 459 401 A 41 LEU HBy A 41 LEU HBx 1.0 1.720 2.378 460 402 A 41 LEU HDy% A 41 LEU H 1.0 1.720 3.344 461 403 A 41 LEU HA A 41 LEU HBx 1.0 1.720 3.091 462 404 A 41 LEU HDy% A 41 LEU HA 1.0 1.720 2.431 463 405 A 41 LEU HBy A 41 LEU HD11 1.0 1.720 2.842 464 406 A 41 LEU HDy% A 41 LEU H 1.0 2.624 6.298 465 406 A 41 LEU H A 41 LEU HD11 1.0 2.624 6.298 466 407 A 41 LEU HA A 41 LEU H 1.0 2.258 5.420 467 408 A 41 LEU HBx A 41 LEU H 1.0 1.720 3.245 468 409 A 42 LYS HBx A 42 LYS HGx 1.0 1.720 3.703 469 410 A 42 LYS HGx A 42 LYS HA 1.0 1.720 4.052 470 411 A 42 LYS HA A 42 LYS HGy 1.0 1.720 3.203 471 412 A 42 LYS HGy A 42 LYS H 1.0 1.720 3.880 472 413 A 42 LYS HBx A 42 LYS HGy 1.0 1.720 3.138 473 414 A 42 LYS HGy A 42 LYS HE2 1.0 1.720 3.340 474 414 A 42 LYS HGy A 42 LYS HE3 1.0 1.720 3.340 475 415 A 42 LYS HA A 42 LYS HD2 1.0 1.720 2.840 476 415 A 42 LYS HA A 42 LYS HD3 1.0 1.720 2.840 477 416 A 42 LYS HGx A 42 LYS HGy 1.0 1.720 2.894 478 417 A 42 LYS HBx A 42 LYS HBy 1.0 1.720 2.454 479 418 A 42 LYS HA A 42 LYS HBy 1.0 1.720 3.312 480 419 A 42 LYS HBx A 42 LYS HA 1.0 1.720 3.180 481 420 A 42 LYS HGx A 42 LYS HE2 1.0 1.720 3.401 482 420 A 42 LYS HGx A 42 LYS HE3 1.0 1.720 3.401 483 421 A 42 LYS HGx A 42 LYS HBy 1.0 1.720 3.272 484 422 A 42 LYS HGy A 42 LYS HBy 1.0 1.720 2.800 485 423 A 42 LYS HGx A 42 LYS H 1.0 1.720 4.115 486 424 A 42 LYS HA A 42 LYS H 1.0 1.720 3.040 487 425 A 42 LYS HBy A 42 LYS H 1.0 1.720 3.236 488 426 A 42 LYS HBx A 42 LYS H 1.0 1.720 3.155 489 427 A 42 LYS HBx A 43 TYR H 1.0 1.720 3.728 490 428 A 42 LYS H A 43 TYR H 1.0 2.167 5.201 491 429 A 42 LYS HBy A 43 TYR H 1.0 1.720 3.809 492 430 A 43 TYR HBy A 42 LYS H 1.0 3.520 8.000 493 431 A 42 LYS HGx A 43 TYR H 1.0 3.209 7.702 494 432 A 42 LYS HA A 43 TYR H 1.0 1.720 3.575 495 433 A 43 TYR HBy A 43 TYR H 1.0 2.466 5.917 496 434 A 43 TYR HA A 43 TYR H 1.0 2.703 6.486 497 435 A 43 TYR HBx A 43 TYR H 1.0 2.799 6.719 498 436 A 43 TYR HA A 48 ASN HBx 1.0 1.720 3.656 499 437 A 43 TYR HBx A 54 LYS H 1.0 3.440 8.000 500 438 A 43 TYR HA A 55 PHE H 1.0 2.991 7.178 501 439 A 43 TYR HA A 44 HIS H 1.0 2.995 7.188 502 440 A 44 HIS HBx A 44 HIS HA 1.0 1.720 3.540 503 441 A 44 HIS H A 44 HIS HBy 1.0 1.720 3.224 504 442 A 44 HIS HBx A 44 HIS HBy 1.0 1.720 2.605 505 443 A 44 HIS HA A 44 HIS HBy 1.0 1.720 3.367 506 444 A 44 HIS H A 44 HIS HBx 1.0 1.720 3.310 507 445 A 44 HIS H A 44 HIS HA 1.0 1.720 3.667 508 446 A 44 HIS HA A 45 PRO HD2 1.0 1.720 2.918 509 446 A 44 HIS HA A 45 PRO HD3 1.0 1.720 2.918 510 447 A 44 HIS HBx A 47 LYS HBy 1.0 1.720 3.919 511 448 A 44 HIS HBx A 47 LYS HBx 1.0 1.720 3.836 512 449 A 44 HIS HA A 45 PRO HGx 1.0 1.720 3.901 513 449 A 44 HIS HA A 45 PRO HGy 1.0 1.720 3.901 514 450 A 45 PRO HBx A 45 PRO HGx 1.0 1.720 2.825 515 450 A 45 PRO HGy A 45 PRO HBx 1.0 1.720 2.825 516 451 A 45 PRO HBx A 45 PRO HBy 1.0 1.720 2.400 517 452 A 45 PRO HA A 45 PRO HGx 1.0 1.720 3.090 518 452 A 45 PRO HGy A 45 PRO HA 1.0 1.720 3.090 519 453 A 45 PRO HD3 A 45 PRO HD2 1.0 1.720 2.345 520 454 A 45 PRO HBx A 45 PRO HA 1.0 1.720 2.672 521 455 A 45 PRO HD2 A 45 PRO HGx 1.0 1.720 2.914 522 455 A 45 PRO HD3 A 45 PRO HGx 1.0 1.720 2.914 523 455 A 45 PRO HGy A 45 PRO HD2 1.0 1.720 2.914 524 455 A 45 PRO HD3 A 45 PRO HGy 1.0 1.720 2.914 525 456 A 45 PRO HBy A 45 PRO HA 1.0 1.720 2.905 526 457 A 45 PRO HA A 49 PRO HA 1.0 1.720 3.204 527 458 A 46 ASP HA A 46 ASP HB2 1.0 1.720 2.519 528 458 A 46 ASP HB3 A 46 ASP HA 1.0 1.720 2.519 529 459 A 47 LYS H A 46 ASP HB2 1.0 1.720 3.383 530 459 A 46 ASP HB3 A 47 LYS H 1.0 1.720 3.383 531 460 A 47 LYS HBy A 47 LYS HG2 1.0 1.720 2.880 532 460 A 47 LYS HBx A 47 LYS HG2 1.0 1.720 2.880 533 460 A 47 LYS HG3 A 47 LYS HBy 1.0 1.720 2.880 534 460 A 47 LYS HBx A 47 LYS HG3 1.0 1.720 2.880 535 461 A 47 LYS HA A 47 LYS HBy 1.0 1.720 3.223 536 462 A 47 LYS HBx A 47 LYS HA 1.0 1.720 2.801 537 463 A 47 LYS H A 47 LYS HBx 1.0 1.720 3.451 538 464 A 47 LYS H A 47 LYS HBy 1.0 1.720 3.452 539 465 A 47 LYS HBx A 47 LYS HG3 1.0 1.720 3.036 540 465 A 47 LYS HBx A 47 LYS HG2 1.0 1.720 3.036 541 466 A 47 LYS H A 47 LYS HA 1.0 2.491 5.980 542 467 A 47 LYS H A 47 LYS HBy 1.0 2.466 5.920 543 467 A 47 LYS H A 47 LYS HBx 1.0 2.466 5.920 544 468 A 47 LYS H A 48 ASN H 1.0 1.982 4.758 545 469 A 45 PRO HA A 48 ASN H 1.0 1.720 3.516 546 470 A 48 ASN H A 48 ASN HA 1.0 1.720 3.457 547 471 A 48 ASN HBx A 48 ASN HBy 1.0 1.720 2.303 548 472 A 48 ASN HBx A 48 ASN HA 1.0 1.720 3.017 549 473 A 48 ASN HBx A 48 ASN HD22 1.0 1.720 3.292 550 473 A 48 ASN HBx A 48 ASN HD21 1.0 1.720 3.292 551 474 A 48 ASN HBy A 48 ASN HD22 1.0 1.720 3.608 552 474 A 48 ASN HBy A 48 ASN HD21 1.0 1.720 3.608 553 475 A 48 ASN HA A 48 ASN HBy 1.0 1.720 3.054 554 476 A 48 ASN H A 48 ASN HBy 1.0 2.577 6.184 555 477 A 48 ASN HA A 49 PRO HGy 1.0 1.720 3.802 556 478 A 48 ASN H A 49 PRO HDx 1.0 1.802 4.326 557 479 A 48 ASN HA A 49 PRO HDx 1.0 1.720 2.642 558 480 A 48 ASN HA A 49 PRO HDy 1.0 1.720 2.820 559 481 A 48 ASN H A 49 PRO HDy 1.0 1.720 4.128 560 482 A 48 ASN HBy A 51 GLU HGx 1.0 1.720 3.510 561 483 A 48 ASN HBy A 49 PRO HDy 1.0 1.727 4.144 562 484 A 48 ASN HBx A 49 PRO HDy 1.0 1.771 4.249 563 485 A 49 PRO HA A 49 PRO HGx 1.0 1.720 3.988 564 486 A 49 PRO HDy A 49 PRO HGx 1.0 1.720 3.208 565 487 A 49 PRO HDx A 49 PRO HGx 1.0 1.720 3.217 566 488 A 49 PRO HDx A 49 PRO HBy 1.0 1.720 3.623 567 489 A 49 PRO HDy A 49 PRO HGy 1.0 1.720 3.115 568 490 A 49 PRO HA A 49 PRO HGy 1.0 1.720 3.476 569 491 A 49 PRO HA A 49 PRO HBx 1.0 1.720 3.192 570 492 A 49 PRO HA A 49 PRO HDx 1.0 1.720 3.683 571 493 A 49 PRO HA A 49 PRO HBy 1.0 1.720 2.622 572 494 A 49 PRO HBy A 49 PRO HGy 1.0 1.720 2.786 573 495 A 49 PRO HDx A 49 PRO HBx 1.0 1.720 3.577 574 496 A 49 PRO HDx A 49 PRO HGy 1.0 1.720 3.152 575 497 A 49 PRO HDy A 49 PRO HBy 1.0 1.720 3.524 576 498 A 49 PRO HDx A 49 PRO HDy 1.0 1.720 2.284 577 499 A 49 PRO HBy A 49 PRO HGx 1.0 1.720 2.969 578 500 A 49 PRO HA A 49 PRO HDy 1.0 1.720 3.710 579 501 A 48 ASN HA A 50 ASN H 1.0 3.209 7.703 580 502 A 49 PRO HA A 50 ASN H 1.0 1.720 3.650 581 503 A 49 PRO HDx A 50 ASN H 1.0 1.720 3.895 582 504 A 49 PRO HDy A 50 ASN H 1.0 1.806 4.336 583 505 A 50 ASN HA A 50 ASN HBx 1.0 1.720 3.034 584 506 A 50 ASN HBx A 50 ASN HBy 1.0 1.720 2.111 585 507 A 50 ASN HA A 50 ASN HBy 1.0 1.720 3.034 586 508 A 50 ASN H A 50 ASN HBy 1.0 1.720 3.522 587 509 A 50 ASN H A 50 ASN HA 1.0 1.946 4.670 588 510 A 50 ASN H A 50 ASN HBx 1.0 2.669 6.406 589 511 A 48 ASN HBy A 51 GLU H 1.0 1.720 3.422 590 512 A 48 ASN HA A 51 GLU H 1.0 1.736 4.168 591 513 A 48 ASN HBx A 51 GLU H 1.0 1.720 3.360 592 514 A 49 PRO HA A 51 GLU H 1.0 3.517 8.000 593 515 A 50 ASN H A 51 GLU H 1.0 2.480 5.952 594 516 A 51 GLU HA A 51 GLU HBx 1.0 1.720 3.745 595 517 A 51 GLU HA A 51 GLU HBy 1.0 1.720 3.586 596 518 A 51 GLU HBy A 51 GLU HGy 1.0 1.720 3.152 597 519 A 51 GLU HBx A 51 GLU HBy 1.0 1.720 2.696 598 520 A 51 GLU HA A 51 GLU HGy 1.0 1.720 3.553 599 521 A 51 GLU HGx A 51 GLU HGy 1.0 1.720 2.443 600 522 A 51 GLU H A 51 GLU HBy 1.0 2.836 6.806 601 523 A 51 GLU HGx A 51 GLU H 1.0 2.823 6.775 602 524 A 51 GLU H A 51 GLU HGy 1.0 2.926 7.022 603 525 A 51 GLU H A 51 GLU HBx 1.0 2.547 6.112 604 526 A 51 GLU H A 52 GLY H 1.0 2.532 6.078 605 527 A 54 LYS H A 51 GLU H 1.0 3.058 7.340 606 528 A 45 PRO HBx A 52 GLY HAx 1.0 1.754 4.208 607 529 A 49 PRO HA A 52 GLY H 1.0 3.128 7.507 608 530 A 52 GLY HAx A 52 GLY HAy 1.0 1.720 2.416 609 531 A 52 GLY H A 52 GLY HAy 1.0 1.720 3.004 610 532 A 52 GLY H A 52 GLY HAx 1.0 1.720 3.055 611 533 A 52 GLY HAy A 53 GLU H 1.0 1.720 3.887 612 534 A 52 GLY HAx A 53 GLU H 1.0 1.720 3.960 613 535 A 52 GLY H A 53 GLU H 1.0 2.644 6.347 614 536 A 53 GLU HA A 53 GLU HB2 1.0 1.720 2.732 615 536 A 53 GLU HB3 A 53 GLU HA 1.0 1.720 2.732 616 537 A 53 GLU HA A 53 GLU HG2 1.0 1.720 3.295 617 537 A 53 GLU HA A 53 GLU HG3 1.0 1.720 3.295 618 538 A 53 GLU H A 53 GLU HA 1.0 2.513 6.031 619 539 A 53 GLU H A 53 GLU HG2 1.0 2.607 6.256 620 539 A 53 GLU H A 53 GLU HG3 1.0 2.607 6.256 621 540 A 53 GLU H A 53 GLU HB2 1.0 2.148 5.155 622 540 A 53 GLU H A 53 GLU HB3 1.0 2.148 5.155 623 541 A 54 LYS H A 53 GLU H 1.0 2.521 6.052 624 542 A 54 LYS H A 53 GLU HG2 1.0 3.187 7.650 625 542 A 54 LYS H A 53 GLU HG3 1.0 3.187 7.650 626 543 A 54 LYS H A 53 GLU HA 1.0 2.949 7.078 627 544 A 54 LYS H A 53 GLU HB2 1.0 2.370 5.688 628 544 A 54 LYS H A 53 GLU HB3 1.0 2.370 5.688 629 545 A 54 LYS HGx A 54 LYS HA 1.0 1.720 3.752 630 546 A 54 LYS HGy A 54 LYS HE2 1.0 1.720 3.356 631 546 A 54 LYS HGy A 54 LYS HE3 1.0 1.720 3.356 632 547 A 54 LYS H A 54 LYS HBy 1.0 1.720 3.571 633 548 A 54 LYS H A 54 LYS HA 1.0 1.720 3.053 634 549 A 54 LYS HA A 54 LYS HD2 1.0 1.720 3.509 635 549 A 54 LYS HA A 54 LYS HD3 1.0 1.720 3.509 636 550 A 54 LYS HA A 54 LYS HBy 1.0 1.720 3.413 637 551 A 54 LYS HGy A 54 LYS HBy 1.0 1.720 3.140 638 552 A 54 LYS HBy A 54 LYS HBx 1.0 1.720 2.545 639 553 A 54 LYS HA A 54 LYS HBx 1.0 1.720 3.356 640 554 A 54 LYS HGy A 54 LYS HD2 1.0 1.720 2.730 641 554 A 54 LYS HGy A 54 LYS HD3 1.0 1.720 2.730 642 555 A 54 LYS HGy A 54 LYS HBx 1.0 1.720 3.539 643 556 A 54 LYS HA A 54 LYS HGy 1.0 1.720 3.250 644 557 A 54 LYS HD2 A 54 LYS HE2 1.0 1.720 2.728 645 557 A 54 LYS HE3 A 54 LYS HD2 1.0 1.720 2.728 646 557 A 54 LYS HE3 A 54 LYS HD3 1.0 1.720 2.728 647 557 A 54 LYS HD3 A 54 LYS HE2 1.0 1.720 2.728 648 558 A 54 LYS HGx A 54 LYS HE2 1.0 1.720 3.965 649 558 A 54 LYS HGx A 54 LYS HE3 1.0 1.720 3.965 650 559 A 54 LYS H A 54 LYS HGx 1.0 1.720 3.787 651 560 A 54 LYS HGx A 54 LYS HGy 1.0 1.720 2.538 652 561 A 54 LYS H A 54 LYS HBx 1.0 1.720 3.221 653 562 A 54 LYS H A 54 LYS HGy 1.0 2.806 6.733 654 563 A 55 PHE H A 54 LYS HBx 1.0 1.720 3.781 655 564 A 55 PHE H A 54 LYS HBy 1.0 1.720 3.944 656 565 A 54 LYS H A 55 PHE H 1.0 2.337 5.608 657 566 A 54 LYS H A 57 GLN H 1.0 2.954 7.090 658 567 A 52 GLY HAx A 55 PHE HBx 1.0 1.720 4.003 659 568 A 52 GLY HAx A 55 PHE HBy 1.0 1.720 3.841 660 569 A 52 GLY HAy A 55 PHE HBy 1.0 1.720 3.829 661 570 A 55 PHE HBx A 55 PHE HBy 1.0 1.720 2.680 662 571 A 55 PHE H A 55 PHE HBx 1.0 1.720 3.206 663 572 A 55 PHE H A 55 PHE HBy 1.0 1.720 3.046 664 573 A 55 PHE HBx A 55 PHE HA 1.0 1.720 3.054 665 574 A 55 PHE HBy A 55 PHE HA 1.0 1.720 3.197 666 575 A 55 PHE H A 55 PHE HA 1.0 2.477 5.945 667 576 A 55 PHE H A 56 LYS HA 1.0 2.896 6.952 668 577 A 55 PHE H A 57 GLN H 1.0 2.952 7.085 669 578 A 55 PHE H A 58 ILE HD1% 1.0 3.652 8.000 670 579 A 54 LYS H A 56 LYS H 1.0 2.566 6.158 671 580 A 55 PHE HBx A 56 LYS H 1.0 1.720 4.040 672 581 A 55 PHE HBy A 56 LYS H 1.0 1.720 3.484 673 582 A 55 PHE H A 56 LYS H 1.0 2.289 5.494 674 583 A 56 LYS HA A 56 LYS HB2 1.0 1.720 2.702 675 583 A 56 LYS HA A 56 LYS HB3 1.0 1.720 2.702 676 584 A 56 LYS HA A 56 LYS HG2 1.0 1.720 3.372 677 584 A 56 LYS HA A 56 LYS HG3 1.0 1.720 3.372 678 585 A 56 LYS HB3 A 56 LYS H 1.0 1.720 2.742 679 585 A 56 LYS H A 56 LYS HB2 1.0 1.720 2.742 680 586 A 56 LYS HB3 A 56 LYS HG2 1.0 1.720 2.831 681 586 A 56 LYS HB2 A 56 LYS HG2 1.0 1.720 2.831 682 586 A 56 LYS HG3 A 56 LYS HB2 1.0 1.720 2.831 683 586 A 56 LYS HB3 A 56 LYS HG3 1.0 1.720 2.831 684 587 A 56 LYS HA A 56 LYS HD2 1.0 1.720 4.317 685 587 A 56 LYS HA A 56 LYS HD3 1.0 1.720 4.317 686 588 A 56 LYS HA A 56 LYS H 1.0 1.720 3.002 687 589 A 57 GLN H A 56 LYS H 1.0 2.211 5.308 688 590 A 57 GLN HA A 56 LYS H 1.0 2.489 5.975 689 591 A 57 GLN HBy A 56 LYS H 1.0 3.038 7.290 690 592 A 57 GLN HGy A 56 LYS H 1.0 3.500 8.000 691 593 A 58 ILE HG1x A 56 LYS H 1.0 3.553 8.000 692 594 A 20 VAL HGx% A 57 GLN HBy 1.0 1.720 3.953 693 595 A 20 VAL HGy% A 57 GLN HGx 1.0 1.720 3.724 694 596 A 20 VAL HGx% A 57 GLN HGy 1.0 1.720 3.983 695 597 A 53 GLU H A 57 GLN H 1.0 3.495 8.000 696 598 A 55 PHE HA A 57 GLN HBx 1.0 1.720 4.109 697 599 A 57 GLN H A 56 LYS HA 1.0 1.720 3.655 698 600 A 57 GLN H A 57 GLN HBy 1.0 1.720 3.157 699 601 A 57 GLN HA A 57 GLN HGx 1.0 1.720 3.275 700 602 A 57 GLN HA A 57 GLN HGy 1.0 1.720 3.498 701 603 A 57 GLN H A 57 GLN HGy 1.0 1.720 3.560 702 604 A 57 GLN HGy A 57 GLN HGx 1.0 1.720 2.443 703 605 A 57 GLN HA A 57 GLN HBx 1.0 1.720 2.492 704 605 A 57 GLN HA A 57 GLN HBy 1.0 1.720 2.492 705 606 A 57 GLN HA A 57 GLN H 1.0 1.720 3.017 706 607 A 57 GLN H A 57 GLN HGx 1.0 1.720 3.228 707 608 A 21 LEU HA A 58 ILE HG2% 1.0 1.720 3.668 708 609 A 36 TYR HA A 58 ILE HG2% 1.0 1.720 3.152 709 610 A 55 PHE HA A 58 ILE HB 1.0 1.720 2.977 710 611 A 55 PHE HA A 58 ILE HG1x 1.0 1.720 3.325 711 612 A 58 ILE H A 57 GLN HBx 1.0 1.720 3.599 712 613 A 57 GLN H A 58 ILE H 1.0 2.522 6.053 713 614 A 57 GLN HBy A 58 ILE H 1.0 1.720 3.610 714 615 A 58 ILE HG1x A 58 ILE HG1y 1.0 1.720 2.786 715 616 A 58 ILE HD1% A 58 ILE HB 1.0 1.720 3.151 716 617 A 58 ILE HG2% A 58 ILE HG1y 1.0 1.720 3.257 717 618 A 58 ILE HA A 58 ILE H 1.0 1.720 3.028 718 619 A 58 ILE HG1x A 58 ILE HB 1.0 1.720 3.467 719 620 A 58 ILE HD1% A 58 ILE HG1y 1.0 1.720 3.029 720 621 A 58 ILE HG2% A 58 ILE HA 1.0 1.720 2.652 721 622 A 58 ILE HG1y A 58 ILE HA 1.0 1.720 3.452 722 623 A 58 ILE HG2% A 58 ILE HG1x 1.0 1.720 2.706 723 624 A 58 ILE HG2% A 58 ILE HB 1.0 1.720 2.452 724 625 A 58 ILE HB A 58 ILE HA 1.0 1.720 2.944 725 626 A 58 ILE HG1x A 58 ILE HA 1.0 1.720 2.942 726 627 A 58 ILE HB A 58 ILE H 1.0 1.720 2.992 727 628 A 58 ILE HD1% A 58 ILE HG1x 1.0 1.720 3.074 728 629 A 58 ILE HD1% A 58 ILE H 1.0 2.827 6.785 729 630 A 58 ILE HG1x A 58 ILE H 1.0 1.720 3.494 730 631 A 58 ILE HG2% A 59 SER HA 1.0 1.720 3.076 731 632 A 59 SER HA A 58 ILE H 1.0 2.564 6.154 732 633 A 61 ALA HB% A 58 ILE HA 1.0 1.720 3.028 733 634 A 58 ILE H A 61 ALA H 1.0 3.112 7.469 734 635 A 58 ILE HG2% A 59 SER H 1.0 2.722 6.532 735 636 A 58 ILE HB A 59 SER H 1.0 2.302 5.525 736 637 A 58 ILE HG1x A 59 SER H 1.0 2.785 6.684 737 638 A 59 SER HA A 59 SER HG 1.0 1.720 3.031 738 639 A 59 SER HA A 59 SER HBx 1.0 1.720 2.818 739 639 A 59 SER HA A 59 SER HBy 1.0 1.720 2.818 740 640 A 59 SER H A 59 SER HBx 1.0 2.268 5.444 741 641 A 59 SER HA A 59 SER H 1.0 1.720 3.215 742 642 A 59 SER HBy A 59 SER H 1.0 2.352 5.645 743 643 A 59 SER H A 61 ALA H 1.0 3.104 7.451 744 644 A 59 SER HA A 62 TYR HBx 1.0 1.720 3.808 745 645 A 60 GLN H A 59 SER HBx 1.0 2.439 5.854 746 646 A 60 GLN HBy A 60 GLN HA 1.0 1.720 2.726 747 647 A 60 GLN HA A 60 GLN HGx 1.0 1.720 3.198 748 648 A 60 GLN HBx A 60 GLN H 1.0 1.720 2.951 749 649 A 60 GLN HBy A 60 GLN HGx 1.0 1.720 2.912 750 650 A 60 GLN HA A 60 GLN HBx 1.0 1.720 2.698 751 651 A 60 GLN HGy A 60 GLN H 1.0 1.720 3.648 752 652 A 60 GLN HGx A 60 GLN HGy 1.0 1.720 2.212 753 653 A 60 GLN HA A 60 GLN H 1.0 1.720 2.974 754 654 A 60 GLN HGx A 60 GLN H 1.0 1.720 3.596 755 655 A 60 GLN HA A 60 GLN HGy 1.0 1.720 3.498 756 656 A 60 GLN HBy A 60 GLN H 1.0 1.720 3.084 757 657 A 60 GLN HGy A 61 ALA H 1.0 1.720 3.984 758 658 A 61 ALA HB% A 57 GLN HA 1.0 1.720 4.892 759 659 A 58 ILE HA A 61 ALA H 1.0 1.720 3.826 760 660 A 60 GLN HBx A 61 ALA H 1.0 1.720 3.665 761 661 A 60 GLN HBy A 61 ALA H 1.0 1.720 3.379 762 662 A 60 GLN H A 61 ALA H 1.0 2.243 5.383 763 663 A 60 GLN HA A 61 ALA H 1.0 1.720 3.602 764 664 A 61 ALA HB% A 61 ALA HA 1.0 1.720 2.466 765 665 A 61 ALA HB% A 61 ALA H 1.0 1.720 2.642 766 666 A 61 ALA HA A 61 ALA H 1.0 1.720 3.154 767 667 A 21 LEU HDx% A 62 TYR H 1.0 1.720 3.233 768 668 A 21 LEU HBy A 62 TYR H 1.0 3.439 8.000 769 669 A 59 SER HA A 62 TYR H 1.0 2.947 7.072 770 670 A 60 GLN HGy A 62 TYR H 1.0 3.172 7.612 771 671 A 61 ALA HA A 62 TYR H 1.0 1.720 3.781 772 672 A 61 ALA H A 62 TYR H 1.0 2.361 5.668 773 673 A 61 ALA HB% A 62 TYR H 1.0 1.720 2.863 774 674 A 62 TYR HBx A 62 TYR H 1.0 1.720 3.204 775 675 A 62 TYR HA A 62 TYR H 1.0 1.720 3.218 776 676 A 62 TYR HA A 62 TYR HBy 1.0 1.720 3.046 777 677 A 62 TYR HBx A 62 TYR HBy 1.0 1.720 2.748 778 678 A 62 TYR HBy A 62 TYR H 1.0 1.720 3.130 779 679 A 62 TYR HA A 62 TYR HBx 1.0 1.720 3.288 780 680 A 62 TYR H A 63 GLU H 1.0 2.088 5.011 781 681 A 62 TYR H A 63 GLU HBx 1.0 3.248 7.794 782 682 A 60 GLN HA A 63 GLU H 1.0 1.720 3.392 783 683 A 61 ALA H A 63 GLU H 1.0 2.806 6.736 784 684 A 62 TYR HBx A 63 GLU H 1.0 2.485 5.963 785 685 A 62 TYR HBy A 63 GLU H 1.0 2.697 6.473 786 686 A 63 GLU HA A 63 GLU HBx 1.0 1.720 2.812 787 687 A 63 GLU HA A 63 GLU HBy 1.0 1.720 3.260 788 688 A 63 GLU HA A 63 GLU HGx 1.0 1.720 3.608 789 689 A 63 GLU HBy A 63 GLU H 1.0 1.720 3.066 790 690 A 63 GLU HA A 63 GLU HGy 1.0 1.720 3.524 791 691 A 63 GLU H A 63 GLU HBx 1.0 1.977 4.744 792 692 A 63 GLU HA A 63 GLU H 1.0 1.720 3.061 793 693 A 66 SER H A 63 GLU H 1.0 2.880 6.911 794 694 A 60 GLN HA A 64 VAL H 1.0 1.825 4.379 795 695 A 61 ALA HA A 64 VAL HGy% 1.0 1.720 3.706 796 696 A 61 ALA HA A 64 VAL HGx% 1.0 1.720 3.620 797 697 A 61 ALA HA A 64 VAL H 1.0 1.720 4.001 798 698 A 61 ALA HB% A 64 VAL HGy% 1.0 1.720 4.938 799 699 A 63 GLU HA A 64 VAL H 1.0 1.720 3.674 800 700 A 63 GLU HA A 64 VAL HGx% 1.0 1.720 4.070 801 701 A 63 GLU HGy A 64 VAL H 1.0 3.337 8.000 802 702 A 63 GLU H A 64 VAL H 1.0 2.296 5.510 803 703 A 63 GLU HBy A 64 VAL H 1.0 2.456 5.894 804 703 A 64 VAL H A 63 GLU HBx 1.0 2.456 5.894 805 704 A 64 VAL HB A 64 VAL H 1.0 1.720 3.007 806 705 A 64 VAL HGy% A 64 VAL H 1.0 1.720 3.160 807 706 A 64 VAL HGx% A 64 VAL HB 1.0 1.720 2.401 808 707 A 64 VAL HA A 64 VAL H 1.0 1.720 3.244 809 708 A 64 VAL HGy% A 64 VAL HA 1.0 1.720 2.676 810 709 A 64 VAL HGy% A 64 VAL HB 1.0 1.720 2.468 811 710 A 64 VAL HB A 64 VAL HA 1.0 1.720 3.258 812 711 A 64 VAL HGx% A 64 VAL HA 1.0 1.720 3.549 813 712 A 64 VAL HGy% A 64 VAL HGx% 1.0 1.720 2.234 814 713 A 64 VAL HGx% A 64 VAL H 1.0 1.720 2.480 815 714 A 65 LEU HDx% A 64 VAL HGy% 1.0 1.720 2.677 816 715 A 65 LEU HBy A 64 VAL H 1.0 3.126 7.502 817 716 A 65 LEU HA A 64 VAL H 1.0 3.282 7.878 818 717 A 64 VAL H A 65 LEU H 1.0 2.421 5.812 819 718 A 64 VAL HA A 70 LYS HD2 1.0 1.720 3.175 820 718 A 64 VAL HA A 70 LYS HD3 1.0 1.720 3.175 821 719 A 64 VAL HGy% A 70 LYS HE2 1.0 1.720 3.659 822 719 A 64 VAL HGy% A 70 LYS HE3 1.0 1.720 3.659 823 720 A 64 VAL HGx% A 70 LYS HE2 1.0 1.720 3.595 824 720 A 64 VAL HGx% A 70 LYS HE3 1.0 1.720 3.595 825 721 A 64 VAL HGy% A 70 LYS HBx 1.0 1.720 3.184 826 722 A 64 VAL HA A 70 LYS HE2 1.0 1.720 3.605 827 723 A 64 VAL HGy% A 70 LYS HBy 1.0 1.720 2.867 828 724 A 70 LYS HD3 A 64 VAL H 1.0 3.353 8.000 829 724 A 64 VAL H A 70 LYS HD2 1.0 3.353 8.000 830 725 A 64 VAL HGy% A 71 ARG HA 1.0 1.720 3.071 831 726 A 64 VAL HGy% A 74 TYR HBx 1.0 1.720 2.837 832 727 A 64 VAL HGy% A 74 TYR HBy 1.0 1.720 3.562 833 728 A 32 LEU HG A 65 LEU HA 1.0 1.720 3.468 834 729 A 32 LEU HG A 65 LEU HBy 1.0 1.720 3.233 835 730 A 60 GLN HA A 65 LEU H 1.0 3.482 8.000 836 731 A 61 ALA HB% A 65 LEU HDy% 1.0 1.720 3.362 837 732 A 61 ALA HB% A 65 LEU HDx% 1.0 1.720 3.950 838 733 A 61 ALA HA A 65 LEU H 1.0 3.272 7.853 839 734 A 62 TYR HA A 65 LEU HBx 1.0 1.720 3.546 840 735 A 64 VAL HA A 65 LEU H 1.0 1.720 4.057 841 736 A 64 VAL HGx% A 65 LEU H 1.0 2.792 6.701 842 737 A 64 VAL HGy% A 65 LEU H 1.0 1.720 3.149 843 738 A 65 LEU HA A 65 LEU H 1.0 2.497 5.993 844 739 A 65 LEU HBy A 65 LEU H 1.0 2.624 6.299 845 740 A 65 LEU HG A 65 LEU H 1.0 2.166 5.198 846 741 A 65 LEU HDx% A 65 LEU H 1.0 2.693 6.462 847 742 A 65 LEU HDy% A 65 LEU H 1.0 2.752 6.605 848 743 A 65 LEU HBx A 65 LEU H 1.0 2.272 5.454 849 744 A 66 SER HA A 65 LEU H 1.0 3.515 8.000 850 745 A 66 SER H A 65 LEU H 1.0 2.401 5.762 851 746 A 65 LEU HDx% A 71 ARG HDx 1.0 1.720 4.002 852 747 A 63 GLU HA A 66 SER H 1.0 1.789 4.294 853 748 A 65 LEU HDx% A 66 SER H 1.0 3.407 8.000 854 749 A 66 SER H A 65 LEU HBy 1.0 3.034 7.280 855 750 A 66 SER H A 65 LEU HBx 1.0 2.753 6.608 856 751 A 65 LEU HDy% A 66 SER H 1.0 3.647 8.000 857 752 A 66 SER HA A 66 SER HBx 1.0 1.720 2.899 858 753 A 66 SER HBx A 66 SER HBy 1.0 1.720 2.549 859 754 A 66 SER H A 66 SER HBx 1.0 1.720 3.535 860 755 A 66 SER H A 66 SER HBy 1.0 2.523 6.055 861 756 A 66 SER H A 66 SER HA 1.0 2.582 6.197 862 757 A 66 SER H A 67 ASP HBy 1.0 3.115 7.476 863 758 A 66 SER HBy A 67 ASP H 1.0 3.227 7.744 864 759 A 66 SER HBx A 67 ASP H 1.0 2.902 6.966 865 760 A 66 SER H A 67 ASP HA 1.0 2.570 6.168 866 761 A 66 SER H A 67 ASP H 1.0 2.417 5.802 867 762 A 66 SER HA A 67 ASP H 1.0 2.929 7.028 868 763 A 67 ASP HBy A 67 ASP HA 1.0 1.720 3.538 869 764 A 67 ASP HA A 67 ASP HBx 1.0 1.720 3.196 870 765 A 67 ASP HBy A 67 ASP H 1.0 1.720 3.298 871 766 A 67 ASP HBy A 67 ASP HBx 1.0 1.720 2.563 872 767 A 67 ASP H A 67 ASP HBx 1.0 1.720 3.352 873 768 A 67 ASP H A 67 ASP HA 1.0 2.587 6.209 874 769 A 67 ASP H A 68 ALA H 1.0 3.412 8.000 875 770 A 67 ASP H A 68 ALA HB% 1.0 3.425 8.000 876 771 A 67 ASP HBx A 70 LYS HD2 1.0 1.720 3.762 877 771 A 70 LYS HD3 A 67 ASP HBx 1.0 1.720 3.762 878 772 A 67 ASP H A 70 LYS HD2 1.0 3.140 7.537 879 772 A 70 LYS HD3 A 67 ASP H 1.0 3.140 7.537 880 773 A 67 ASP HA A 68 ALA HB% 1.0 1.720 4.331 881 774 A 67 ASP HA A 68 ALA H 1.0 1.857 4.457 882 775 A 67 ASP HBx A 68 ALA H 1.0 3.059 7.342 883 776 A 68 ALA H A 68 ALA HB% 1.0 1.720 2.614 884 777 A 68 ALA HB% A 68 ALA HA 1.0 1.720 2.360 885 778 A 68 ALA H A 68 ALA HA 1.0 1.720 3.263 886 779 A 64 VAL HGx% A 69 LYS H 1.0 3.347 8.000 887 780 A 65 LEU HA A 69 LYS H 1.0 3.302 7.924 888 781 A 68 ALA HB% A 69 LYS H 1.0 1.720 2.897 889 782 A 68 ALA HA A 69 LYS H 1.0 1.720 3.726 890 783 A 68 ALA H A 69 LYS HBy 1.0 3.323 7.975 891 784 A 68 ALA H A 69 LYS H 1.0 2.588 6.211 892 785 A 69 LYS HD2 A 69 LYS HE2 1.0 1.720 2.081 893 785 A 69 LYS HD3 A 69 LYS HE2 1.0 1.720 2.081 894 785 A 69 LYS HE3 A 69 LYS HD2 1.0 1.720 2.081 895 785 A 69 LYS HE3 A 69 LYS HD3 1.0 1.720 2.081 896 786 A 69 LYS HA A 69 LYS HBy 1.0 1.720 2.737 897 786 A 69 LYS HBx A 69 LYS HA 1.0 1.720 2.737 898 787 A 69 LYS HA A 69 LYS HGx 1.0 1.720 3.156 899 787 A 69 LYS HA A 69 LYS HGy 1.0 1.720 3.156 900 788 A 69 LYS HA A 69 LYS HD2 1.0 1.720 4.269 901 788 A 69 LYS HD3 A 69 LYS HA 1.0 1.720 4.269 902 789 A 69 LYS H A 69 LYS HBy 1.0 1.720 2.972 903 790 A 69 LYS H A 69 LYS HBy 1.0 2.043 4.903 904 790 A 69 LYS H A 69 LYS HBx 1.0 2.043 4.903 905 791 A 69 LYS H A 69 LYS HA 1.0 1.720 3.085 906 792 A 69 LYS H A 71 ARG H 1.0 2.986 7.166 907 793 A 64 VAL HA A 70 LYS HBy 1.0 1.720 3.312 908 794 A 64 VAL HA A 70 LYS H 1.0 1.777 4.265 909 795 A 64 VAL HA A 70 LYS HBx 1.0 1.720 3.328 910 796 A 67 ASP HBy A 70 LYS H 1.0 1.720 3.842 911 797 A 68 ALA H A 70 LYS H 1.0 3.147 7.553 912 798 A 69 LYS HA A 70 LYS H 1.0 1.720 3.732 913 799 A 69 LYS HBx A 70 LYS H 1.0 2.184 5.242 914 800 A 69 LYS H A 70 LYS H 1.0 2.111 5.065 915 801 A 70 LYS HGy A 70 LYS HGx 1.0 1.720 2.662 916 802 A 70 LYS HGx A 70 LYS HE2 1.0 1.720 3.400 917 802 A 70 LYS HE3 A 70 LYS HGx 1.0 1.720 3.400 918 803 A 70 LYS HBx A 70 LYS HGx 1.0 1.720 3.737 919 804 A 70 LYS H A 70 LYS HD2 1.0 1.720 3.986 920 804 A 70 LYS HD3 A 70 LYS H 1.0 1.720 3.986 921 805 A 70 LYS HGy A 70 LYS HE2 1.0 1.720 3.476 922 805 A 70 LYS HE3 A 70 LYS HGy 1.0 1.720 3.476 923 806 A 70 LYS HBx A 70 LYS H 1.0 1.720 3.610 924 807 A 70 LYS HGx A 70 LYS HA 1.0 1.720 3.469 925 808 A 70 LYS HBx A 70 LYS HD2 1.0 1.720 3.300 926 808 A 70 LYS HD3 A 70 LYS HBx 1.0 1.720 3.300 927 809 A 70 LYS H A 70 LYS HGy 1.0 1.720 3.637 928 810 A 70 LYS H A 70 LYS HA 1.0 1.720 3.268 929 811 A 70 LYS H A 70 LYS HGx 1.0 1.720 3.853 930 812 A 71 ARG H A 70 LYS H 1.0 2.354 5.651 931 813 A 64 VAL HGy% A 71 ARG H 1.0 1.720 3.756 932 814 A 65 LEU HDx% A 71 ARG HA 1.0 1.720 3.481 933 815 A 68 ALA HA A 71 ARG HBx 1.0 1.720 3.485 934 816 A 68 ALA HA A 71 ARG H 1.0 1.720 3.638 935 817 A 70 LYS HBy A 71 ARG H 1.0 1.755 4.212 936 818 A 70 LYS HBx A 71 ARG H 1.0 1.720 3.935 937 819 A 71 ARG H A 70 LYS HGx 1.0 3.286 7.886 938 820 A 71 ARG HBy A 71 ARG HDy 1.0 1.720 3.396 939 821 A 71 ARG HDx A 71 ARG HBx 1.0 1.720 3.578 940 822 A 71 ARG HA A 71 ARG HBx 1.0 1.720 3.222 941 823 A 71 ARG HBx A 71 ARG HBy 1.0 1.720 2.970 942 824 A 71 ARG HBx A 71 ARG HDy 1.0 1.720 3.454 943 825 A 71 ARG HA A 71 ARG HGy 1.0 1.720 3.400 944 826 A 71 ARG HDx A 71 ARG HDy 1.0 1.720 2.566 945 827 A 71 ARG H A 71 ARG HBy 1.0 2.296 5.512 946 828 A 71 ARG HA A 71 ARG H 1.0 1.720 3.296 947 829 A 71 ARG H A 71 ARG HBx 1.0 1.720 3.385 948 830 A 71 ARG H A 72 GLU H 1.0 2.452 5.885 949 831 A 71 ARG H A 73 LEU H 1.0 3.039 7.294 950 832 A 71 ARG HA A 74 TYR HBy 1.0 1.720 3.578 951 833 A 71 ARG HA A 74 TYR HBx 1.0 1.720 3.047 952 833 A 71 ARG HA A 74 TYR HBy 1.0 1.720 3.047 953 834 A 71 ARG H A 75 ASP H 1.0 3.340 8.000 954 835 A 64 VAL HGy% A 72 GLU H 1.0 1.720 4.042 955 836 A 69 LYS HA A 72 GLU HB3 1.0 1.720 2.984 956 836 A 69 LYS HA A 72 GLU HB2 1.0 1.720 2.984 957 837 A 71 ARG HA A 72 GLU H 1.0 1.720 3.704 958 838 A 72 GLU HG3 A 72 GLU H 1.0 1.720 3.431 959 838 A 72 GLU H A 72 GLU HG2 1.0 1.720 3.431 960 839 A 72 GLU HA A 72 GLU H 1.0 1.720 2.906 961 840 A 72 GLU HA A 72 GLU HB3 1.0 1.720 2.485 962 840 A 72 GLU HB2 A 72 GLU HA 1.0 1.720 2.485 963 841 A 72 GLU H A 72 GLU HB3 1.0 1.720 2.754 964 842 A 72 GLU HG3 A 72 GLU HB3 1.0 1.720 2.506 965 842 A 72 GLU HB3 A 72 GLU HG2 1.0 1.720 2.506 966 843 A 72 GLU HA A 72 GLU HG2 1.0 1.720 2.934 967 843 A 72 GLU HG3 A 72 GLU HA 1.0 1.720 2.934 968 844 A 73 LEU HDy% A 72 GLU H 1.0 1.720 3.992 969 845 A 73 LEU H A 72 GLU HB3 1.0 1.720 3.202 970 846 A 69 LYS HE2 A 73 LEU HDx% 1.0 1.720 3.128 971 846 A 69 LYS HE3 A 73 LEU HDx% 1.0 1.720 3.128 972 846 A 73 LEU HDy% A 69 LYS HE2 1.0 1.720 3.128 973 846 A 69 LYS HE3 A 73 LEU HDy% 1.0 1.720 3.128 974 847 A 71 ARG HA A 73 LEU H 1.0 3.424 8.000 975 848 A 72 GLU HB2 A 73 LEU H 1.0 2.207 5.297 976 848 A 73 LEU H A 72 GLU HB3 1.0 2.207 5.297 977 849 A 73 LEU H A 72 GLU HG2 1.0 3.085 7.405 978 849 A 72 GLU HG3 A 73 LEU H 1.0 3.085 7.405 979 850 A 72 GLU H A 73 LEU H 1.0 2.427 5.826 980 851 A 73 LEU HA A 73 LEU HG 1.0 1.720 3.458 981 852 A 73 LEU HBy A 73 LEU H 1.0 1.720 3.067 982 853 A 73 LEU HA A 73 LEU HBx 1.0 1.720 2.761 983 854 A 73 LEU H A 73 LEU HDx% 1.0 1.720 3.485 984 855 A 73 LEU HBy A 73 LEU HBx 1.0 1.720 2.347 985 856 A 73 LEU HBy A 73 LEU HDx% 1.0 1.720 2.618 986 857 A 73 LEU HDy% A 73 LEU HA 1.0 1.720 2.486 987 858 A 73 LEU HBx A 73 LEU H 1.0 1.720 3.289 988 859 A 73 LEU HBy A 73 LEU HDx% 1.0 1.720 3.035 989 859 A 73 LEU HDy% A 73 LEU HBy 1.0 1.720 3.035 990 860 A 73 LEU HDy% A 73 LEU H 1.0 1.720 3.306 991 861 A 73 LEU HA A 73 LEU HBy 1.0 1.720 3.082 992 862 A 73 LEU HA A 73 LEU HDx% 1.0 1.720 2.650 993 862 A 73 LEU HDy% A 73 LEU HA 1.0 1.720 2.650 994 863 A 73 LEU HG A 73 LEU HDx% 1.0 1.720 2.677 995 863 A 73 LEU HDy% A 73 LEU HG 1.0 1.720 2.677 996 864 A 73 LEU HBx A 73 LEU HDx% 1.0 1.720 2.920 997 864 A 73 LEU HDy% A 73 LEU HBx 1.0 1.720 2.920 998 865 A 73 LEU HG A 73 LEU H 1.0 1.720 3.245 999 866 A 73 LEU HDy% A 73 LEU H 1.0 2.675 6.420 1000 866 A 73 LEU H A 73 LEU HDx% 1.0 2.675 6.420 1001 867 A 73 LEU HA A 73 LEU H 1.0 1.720 3.028 1002 868 A 74 TYR HBy A 73 LEU H 1.0 3.391 8.000 1003 868 A 73 LEU H A 74 TYR HBx 1.0 3.391 8.000 1004 869 A 73 LEU HBx A 76 LYS H 1.0 2.526 6.062 1005 870 A 64 VAL HGy% A 74 TYR H 1.0 3.124 7.498 1006 871 A 71 ARG HA A 74 TYR H 1.0 1.720 3.718 1007 872 A 73 LEU HA A 74 TYR H 1.0 1.720 3.754 1008 873 A 73 LEU HBx A 74 TYR H 1.0 1.720 3.790 1009 874 A 73 LEU H A 74 TYR H 1.0 2.284 5.482 1010 875 A 73 LEU HBy A 74 TYR H 1.0 1.720 3.641 1011 876 A 73 LEU HDy% A 74 TYR H 1.0 3.275 7.859 1012 877 A 74 TYR H A 74 TYR HBx 1.0 1.720 3.090 1013 878 A 74 TYR HBy A 74 TYR H 1.0 1.720 3.174 1014 879 A 74 TYR HA A 74 TYR HBx 1.0 1.720 2.797 1015 879 A 74 TYR HBy A 74 TYR HA 1.0 1.720 2.797 1016 880 A 74 TYR HA A 74 TYR H 1.0 1.720 3.091 1017 881 A 74 TYR HBy A 74 TYR HA 1.0 1.720 3.262 1018 882 A 74 TYR HA A 74 TYR HBx 1.0 1.720 3.156 1019 883 A 74 TYR HBy A 74 TYR H 1.0 2.072 4.972 1020 883 A 74 TYR H A 74 TYR HBx 1.0 2.072 4.972 1021 884 A 71 ARG HA A 75 ASP H 1.0 3.072 7.372 1022 885 A 72 GLU HA A 75 ASP H 1.0 1.720 3.641 1023 886 A 72 GLU HA A 75 ASP HBy 1.0 1.720 3.054 1024 886 A 72 GLU HA A 75 ASP HBx 1.0 1.720 3.054 1025 887 A 73 LEU HBx A 75 ASP H 1.0 3.333 7.999 1026 888 A 73 LEU H A 75 ASP H 1.0 2.929 7.031 1027 889 A 75 ASP H A 74 TYR HBx 1.0 1.720 3.445 1028 890 A 74 TYR HBy A 75 ASP H 1.0 1.720 3.492 1029 891 A 74 TYR HBy A 75 ASP H 1.0 2.292 5.501 1030 891 A 75 ASP H A 74 TYR HBx 1.0 2.292 5.501 1031 892 A 74 TYR HA A 75 ASP H 1.0 1.720 3.756 1032 893 A 74 TYR H A 75 ASP H 1.0 2.364 5.674 1033 894 A 75 ASP HA A 75 ASP HBy 1.0 1.720 2.737 1034 894 A 75 ASP HBx A 75 ASP HA 1.0 1.720 2.737 1035 895 A 75 ASP HA A 75 ASP H 1.0 1.720 3.114 1036 896 A 75 ASP HBx A 75 ASP H 1.0 2.108 5.059 1037 896 A 75 ASP H A 75 ASP HBy 1.0 2.108 5.059 1038 897 A 75 ASP H A 76 LYS H 1.0 2.330 5.592 1039 898 A 74 TYR HA A 76 LYS H 1.0 1.720 4.074 1040 899 A 75 ASP HA A 76 LYS H 1.0 1.720 3.608 1041 900 A 75 ASP HBx A 76 LYS H 1.0 2.570 6.168 1042 900 A 76 LYS H A 75 ASP HBy 1.0 2.570 6.168 1043 901 A 76 LYS HA A 76 LYS HB2 1.0 1.720 2.688 1044 901 A 76 LYS HB3 A 76 LYS HA 1.0 1.720 2.688 1045 902 A 76 LYS HB2 A 76 LYS HD2 1.0 1.720 2.244 1046 902 A 76 LYS HB3 A 76 LYS HD2 1.0 1.720 2.244 1047 902 A 76 LYS HD3 A 76 LYS HB2 1.0 1.720 2.244 1048 902 A 76 LYS HB3 A 76 LYS HD3 1.0 1.720 2.244 1049 903 A 76 LYS HA A 76 LYS H 1.0 1.720 2.920 1050 904 A 76 LYS HA A 76 LYS HD2 1.0 1.720 4.245 1051 904 A 76 LYS HA A 76 LYS HD3 1.0 1.720 4.245 1052 905 A 76 LYS HB3 A 76 LYS H 1.0 1.975 4.739 1053 905 A 76 LYS H A 76 LYS HB2 1.0 1.975 4.739 1054 906 A 76 LYS HB3 A 77 GLY HA3 1.0 1.768 4.243 1055 906 A 76 LYS HB2 A 77 GLY HA3 1.0 1.768 4.243 1056 906 A 77 GLY HA2 A 76 LYS HB2 1.0 1.768 4.243 1057 906 A 76 LYS HB3 A 77 GLY HA2 1.0 1.768 4.243 1058 907 A 77 GLY H A 76 LYS HB2 1.0 2.535 6.084 1059 907 A 76 LYS HB3 A 77 GLY H 1.0 2.535 6.084 1060 908 A 74 TYR HA A 77 GLY H 1.0 1.720 3.823 1061 909 A 75 ASP HA A 77 GLY H 1.0 3.159 7.582 1062 910 A 76 LYS HD2 A 77 GLY HA3 1.0 1.728 5.147 1063 910 A 76 LYS HD3 A 77 GLY HA3 1.0 1.728 5.147 1064 910 A 77 GLY HA2 A 76 LYS HD2 1.0 1.728 5.147 1065 910 A 76 LYS HD3 A 77 GLY HA2 1.0 1.728 5.147 1066 911 A 76 LYS HA A 77 GLY H 1.0 1.720 3.446 1067 912 A 77 GLY HA2 A 77 GLY HA3 1.0 1.720 2.064 1068 913 A 77 GLY H A 77 GLY HA3 1.0 1.720 2.634 1069 913 A 77 GLY HA2 A 77 GLY H 1.0 1.720 2.634 1070 914 A 12 VAL HB A 12 VAL HG1% 1.0 1.720 2.677 1071 914 A 12 VAL HB A 12 VAL HG2% 1.0 1.720 2.677 1072 915 A 13 LYS HA A 12 VAL HG1% 1.0 1.770 4.248 1073 915 A 13 LYS HA A 12 VAL HG2% 1.0 1.770 4.248 1074 916 A 14 GLU H A 12 VAL HG1% 1.0 3.135 7.525 1075 916 A 12 VAL HG2% A 14 GLU H 1.0 3.135 7.525 1076 917 A 13 LYS H A 12 VAL HG1% 1.0 2.940 7.055 1077 917 A 13 LYS H A 12 VAL HG2% 1.0 2.940 7.055 1078 918 A 14 GLU H A 14 GLU HBy 1.0 2.575 6.181 1079 919 A 15 THR H A 14 GLU HA 1.0 2.221 5.329 1080 920 A 15 THR HG2% A 15 THR H 1.0 1.720 3.326 1081 921 A 16 THR H A 17 TYR HA 1.0 2.983 7.158 1082 922 A 16 THR H A 18 TYR HBx 1.0 3.237 7.769 1083 923 A 16 THR HG2% A 19 ASP HBy 1.0 1.720 3.767 1084 924 A 16 THR HA A 17 TYR H 1.0 2.159 5.180 1085 925 A 15 THR H A 16 THR H 1.0 3.288 7.890 1086 926 A 16 THR HA A 18 TYR H 1.0 2.840 6.815 1087 927 A 18 TYR H A 19 ASP HBy 1.0 2.639 6.335 1088 928 A 18 TYR HBx A 23 VAL HGx% 1.0 1.720 3.406 1089 929 A 18 TYR HBy A 23 VAL HGx% 1.0 1.720 3.916 1090 930 A 18 TYR H A 25 PRO HBy 1.0 3.275 7.861 1091 931 A 15 THR HG2% A 19 ASP HBx 1.0 1.720 3.786 1092 932 A 16 THR HA A 19 ASP HBy 1.0 1.720 3.871 1093 933 A 19 ASP H A 18 TYR HBy 1.0 2.573 6.175 1094 934 A 19 ASP H A 18 TYR HBx 1.0 2.507 6.016 1095 935 A 19 ASP HBx A 20 VAL HGy% 1.0 1.720 4.566 1096 936 A 15 THR HG2% A 19 ASP HBy 1.0 1.720 3.619 1097 937 A 15 THR HG2% A 20 VAL HGx% 1.0 1.720 3.790 1098 938 A 18 TYR HBx A 21 LEU H 1.0 3.574 8.000 1099 939 A 21 LEU H A 21 LEU HDy% 1.0 2.579 6.190 1100 940 A 22 GLY H A 21 LEU HDx% 1.0 2.860 6.863 1101 941 A 61 ALA HB% A 21 LEU HDy% 1.0 1.720 2.564 1102 942 A 21 LEU HDx% A 62 TYR HBy 1.0 1.720 4.169 1103 943 A 18 TYR HBx A 22 GLY H 1.0 3.300 7.920 1104 944 A 22 GLY H A 21 LEU HG 1.0 2.850 6.840 1105 945 A 35 ALA HB% A 22 GLY HA3 1.0 1.720 4.087 1106 945 A 22 GLY HA2 A 35 ALA HB% 1.0 1.720 4.087 1107 946 A 24 LYS H A 24 LYS HG2 1.0 2.625 6.300 1108 946 A 24 LYS H A 24 LYS HG3 1.0 2.625 6.300 1109 947 A 24 LYS HA A 26 ASN H 1.0 2.441 5.858 1110 948 A 26 ASN H A 24 LYS HG2 1.0 2.524 6.056 1111 948 A 26 ASN H A 24 LYS HG3 1.0 2.524 6.056 1112 949 A 26 ASN H A 25 PRO HBx 1.0 2.491 5.978 1113 950 A 23 VAL HA A 27 ALA H 1.0 2.951 7.081 1114 951 A 27 ALA HA A 31 GLU HBx 1.0 1.720 3.236 1115 952 A 23 VAL HB A 27 ALA H 1.0 2.664 6.394 1116 953 A 24 LYS HA A 27 ALA H 1.0 2.477 5.946 1117 954 A 29 GLN HA A 30 GLU H 1.0 2.417 5.802 1118 955 A 30 GLU H A 29 GLN HB2 1.0 2.159 5.182 1119 955 A 29 GLN HB3 A 30 GLU H 1.0 2.159 5.182 1120 956 A 31 GLU HBy A 30 GLU H 1.0 2.404 5.770 1121 957 A 23 VAL HGy% A 31 GLU H 1.0 3.497 8.000 1122 958 A 29 GLN HA A 31 GLU H 1.0 3.121 7.490 1123 959 A 30 GLU HBy A 31 GLU H 1.0 2.293 5.504 1124 960 A 31 GLU H A 31 GLU HG2 1.0 2.655 6.372 1125 960 A 31 GLU HG3 A 31 GLU H 1.0 2.655 6.372 1126 961 A 31 GLU H A 31 GLU HA 1.0 2.492 5.981 1127 962 A 31 GLU H A 32 LEU H 1.0 2.273 5.455 1128 963 A 31 GLU HA A 34 LYS H 1.0 2.153 5.168 1129 964 A 23 VAL HGy% A 32 LEU H 1.0 2.778 6.666 1130 965 A 27 ALA H A 32 LEU HDy% 1.0 3.040 7.295 1131 966 A 31 GLU HBy A 32 LEU HDx% 1.0 1.720 3.869 1132 967 A 32 LEU H A 32 LEU HDy% 1.0 2.174 5.218 1133 968 A 32 LEU HDx% A 35 ALA H 1.0 2.840 6.816 1134 969 A 32 LEU HDy% A 67 ASP H 1.0 3.110 7.463 1135 970 A 35 ALA HB% A 33 LYS H 1.0 2.610 6.264 1136 971 A 36 TYR HBx A 33 LYS H 1.0 3.302 7.926 1137 972 A 30 GLU HA A 34 LYS H 1.0 2.844 6.826 1138 973 A 23 VAL HGy% A 35 ALA HB% 1.0 1.720 2.329 1139 974 A 31 GLU HA A 35 ALA H 1.0 2.321 5.570 1140 975 A 31 GLU HBx A 35 ALA H 1.0 3.138 7.531 1141 976 A 35 ALA HB% A 34 LYS H 1.0 2.100 5.041 1142 977 A 35 ALA HA A 39 LEU HD1% 1.0 1.720 3.886 1143 977 A 35 ALA HA A 39 LEU HD2% 1.0 1.720 3.886 1144 978 A 35 ALA HB% A 39 LEU HD1% 1.0 1.720 2.845 1145 978 A 35 ALA HB% A 39 LEU HD2% 1.0 1.720 2.845 1146 979 A 21 LEU HDx% A 36 TYR H 1.0 2.877 6.904 1147 980 A 34 LYS HB3 A 36 TYR H 1.0 2.753 6.608 1148 980 A 36 TYR H A 34 LYS HB2 1.0 2.753 6.608 1149 981 A 35 ALA HB% A 37 ARG H 1.0 2.444 5.867 1150 982 A 38 LYS HA A 37 ARG H 1.0 2.575 6.179 1151 983 A 39 LEU HD2% A 37 ARG H 1.0 3.103 7.447 1152 983 A 37 ARG H A 39 LEU HD1% 1.0 3.103 7.447 1153 984 A 38 LYS H A 37 ARG HBy 1.0 1.863 4.472 1154 985 A 39 LEU HD2% A 38 LYS H 1.0 3.079 7.391 1155 985 A 38 LYS H A 39 LEU HD1% 1.0 3.079 7.391 1156 986 A 39 LEU H A 38 LYS HB3 1.0 1.857 4.457 1157 986 A 38 LYS HB2 A 39 LEU H 1.0 1.857 4.457 1158 987 A 39 LEU HG A 39 LEU HD1% 1.0 1.720 2.064 1159 987 A 39 LEU HG A 39 LEU HD2% 1.0 1.720 2.064 1160 988 A 39 LEU HA A 39 LEU HD1% 1.0 1.720 2.342 1161 988 A 39 LEU HA A 39 LEU HD2% 1.0 1.720 2.342 1162 989 A 39 LEU HBy A 39 LEU HD1% 1.0 1.720 2.322 1163 989 A 39 LEU HBy A 39 LEU HD2% 1.0 1.720 2.322 1164 990 A 39 LEU HD2% A 39 LEU H 1.0 1.720 3.084 1165 990 A 39 LEU H A 39 LEU HD1% 1.0 1.720 3.084 1166 991 A 39 LEU HBx A 39 LEU HD1% 1.0 1.720 2.614 1167 991 A 39 LEU HBx A 39 LEU HD2% 1.0 1.720 2.614 1168 992 A 39 LEU HD2% A 39 LEU H 1.0 2.423 5.814 1169 992 A 39 LEU H A 39 LEU HD1% 1.0 2.423 5.814 1170 993 A 39 LEU HBx A 39 LEU HD1% 1.0 1.720 2.930 1171 993 A 39 LEU HBx A 39 LEU HD2% 1.0 1.720 2.930 1172 994 A 39 LEU HBy A 39 LEU HD1% 1.0 1.720 2.987 1173 994 A 39 LEU HBy A 39 LEU HD2% 1.0 1.720 2.987 1174 995 A 39 LEU H A 41 LEU H 1.0 3.265 7.835 1175 996 A 38 LYS HB2 A 40 ALA H 1.0 2.421 5.812 1176 996 A 40 ALA H A 38 LYS HB3 1.0 2.421 5.812 1177 997 A 39 LEU HD2% A 40 ALA H 1.0 1.720 4.256 1178 997 A 40 ALA H A 39 LEU HD1% 1.0 1.720 4.256 1179 998 A 39 LEU HA A 40 ALA H 1.0 2.880 6.912 1180 999 A 41 LEU HBx A 40 ALA H 1.0 2.778 6.666 1181 1000 A 41 LEU HBy A 40 ALA H 1.0 3.028 7.267 1182 1001 A 41 LEU H A 38 LYS HB3 1.0 3.127 7.504 1183 1001 A 38 LYS HB2 A 41 LEU H 1.0 3.127 7.504 1184 1002 A 41 LEU HBy A 41 LEU HBx 1.0 1.720 2.260 1185 1003 A 41 LEU HG A 41 LEU HD11 1.0 1.720 2.513 1186 1004 A 41 LEU HG A 41 LEU H 1.0 1.954 4.691 1187 1005 A 41 LEU HDy% A 41 LEU HG 1.0 1.720 2.455 1188 1006 A 41 LEU HDy% A 42 LYS H 1.0 3.071 7.370 1189 1006 A 42 LYS H A 41 LEU HD11 1.0 3.071 7.370 1190 1007 A 41 LEU HG A 42 LYS H 1.0 2.579 6.190 1191 1008 A 42 LYS HGy A 42 LYS H 1.0 2.735 6.565 1192 1009 A 42 LYS HBx A 42 LYS HBy 1.0 1.720 2.460 1193 1010 A 43 TYR HA A 48 ASN H 1.0 2.629 6.308 1194 1011 A 44 HIS H A 46 ASP H 1.0 3.425 8.000 1195 1012 A 48 ASN H A 45 PRO HD2 1.0 2.515 6.036 1196 1012 A 45 PRO HD3 A 48 ASN H 1.0 2.515 6.036 1197 1013 A 46 ASP HA A 48 ASN H 1.0 2.743 6.583 1198 1014 A 48 ASN H A 52 GLY HAx 1.0 3.105 7.452 1199 1015 A 49 PRO HDy A 49 PRO HGx 1.0 1.720 2.838 1200 1015 A 49 PRO HDy A 49 PRO HGy 1.0 1.720 2.838 1201 1016 A 49 PRO HA A 49 PRO HBx 1.0 1.720 2.690 1202 1017 A 49 PRO HDx A 49 PRO HGx 1.0 1.720 2.765 1203 1017 A 49 PRO HDx A 49 PRO HGy 1.0 1.720 2.765 1204 1018 A 50 ASN H A 49 PRO HGx 1.0 2.706 6.496 1205 1019 A 51 GLU HGx A 50 ASN H 1.0 3.194 7.664 1206 1020 A 50 ASN HA A 52 GLY H 1.0 2.385 5.724 1207 1021 A 50 ASN HBy A 51 GLU H 1.0 3.056 7.334 1208 1022 A 50 ASN HA A 51 GLU H 1.0 2.463 5.911 1209 1023 A 45 PRO HBy A 52 GLY H 1.0 3.156 7.574 1210 1024 A 49 PRO HBx A 52 GLY H 1.0 3.126 7.502 1211 1025 A 50 ASN HA A 53 GLU H 1.0 2.010 4.824 1212 1026 A 52 GLY H A 54 LYS HBx 1.0 3.293 7.902 1213 1027 A 55 PHE H A 51 GLU HGy 1.0 3.631 8.000 1214 1028 A 43 TYR HBy A 56 LYS H 1.0 3.230 7.753 1215 1029 A 54 LYS H A 52 GLY H 1.0 3.254 7.810 1216 1030 A 20 VAL HGx% A 58 ILE H 1.0 2.525 6.060 1217 1031 A 43 TYR HBy A 58 ILE H 1.0 3.663 8.000 1218 1032 A 55 PHE HA A 58 ILE H 1.0 1.720 3.301 1219 1033 A 20 VAL HGx% A 61 ALA H 1.0 2.871 6.889 1220 1034 A 61 ALA H A 62 TYR H 1.0 2.112 5.069 1221 1035 A 61 ALA HA A 62 TYR H 1.0 2.173 5.216 1222 1036 A 62 TYR HBy A 64 VAL H 1.0 3.086 7.405 1223 1037 A 63 GLU HA A 64 VAL H 1.0 2.452 5.885 1224 1038 A 62 TYR HBx A 66 SER H 1.0 3.206 7.696 1225 1039 A 63 GLU HGy A 67 ASP H 1.0 3.251 7.802 1226 1040 A 68 ALA HB% A 69 LYS H 1.0 2.145 5.149 1227 1041 A 69 LYS H A 72 GLU HB3 1.0 3.108 7.459 1228 1042 A 70 LYS H A 72 GLU HB3 1.0 3.045 7.307 1229 1043 A 68 ALA HA A 71 ARG HBy 1.0 1.720 3.154 1230 1044 A 69 LYS HBx A 71 ARG H 1.0 2.872 6.893 1231 1045 A 71 ARG HA A 71 ARG HBx 1.0 1.720 3.389 1232 1046 A 71 ARG HDx A 71 ARG HBy 1.0 1.720 3.174 1233 1047 A 71 ARG HBx A 71 ARG HBy 1.0 1.720 2.717 1234 1048 A 71 ARG HA A 71 ARG HBy 1.0 1.720 3.002 1235 1049 A 71 ARG HBx A 72 GLU H 1.0 1.804 4.330 1236 1050 A 68 ALA HB% A 73 LEU H 1.0 3.032 7.277 1237 1051 A 68 ALA HB% A 74 TYR H 1.0 3.421 8.000 1238 1052 A 72 GLU HG3 A 74 TYR H 1.0 3.421 8.000 1239 1052 A 74 TYR H A 72 GLU HG2 1.0 3.421 8.000 1240 1053 A 73 LEU HA A 74 TYR H 1.0 2.311 5.546 1241 1054 A 74 TYR H A 76 LYS H 1.0 2.801 6.721 1242 1055 A 71 ARG HBx A 75 ASP H 1.0 3.426 8.000 1243 1056 A 71 ARG HGy A 75 ASP H 1.0 3.088 7.411 1244 1057 A 76 LYS HA A 77 GLY H 1.0 2.550 6.120 stop_ save_ save_CNS/XPLOR_distance_constraints_6 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_6 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 33 LYS H A 29 GLN O 1.0 1.5 2.3 2 2 A 29 GLN O A 33 LYS N 1.0 2.4 3.3 3 3 A 34 LYS H A 30 GLU O 1.0 1.5 2.3 4 4 A 30 GLU O A 34 LYS N 1.0 2.4 3.3 5 5 A 35 ALA H A 31 GLU O 1.0 1.5 2.3 6 6 A 31 GLU O A 35 ALA N 1.0 2.4 3.3 7 7 A 36 TYR H A 32 LEU O 1.0 1.5 2.3 8 8 A 32 LEU O A 36 TYR N 1.0 2.4 3.3 9 9 A 37 ARG H A 33 LYS O 1.0 1.5 2.3 10 10 A 33 LYS O A 37 ARG N 1.0 2.4 3.3 11 11 A 38 LYS H A 34 LYS O 1.0 1.5 2.3 12 12 A 34 LYS O A 38 LYS N 1.0 2.4 3.3 13 13 A 39 LEU H A 35 ALA O 1.0 1.5 2.3 14 14 A 35 ALA O A 39 LEU N 1.0 2.4 3.3 15 15 A 40 ALA H A 36 TYR O 1.0 1.5 2.3 16 16 A 36 TYR O A 40 ALA N 1.0 2.4 3.3 17 17 A 41 LEU H A 37 ARG O 1.0 1.5 2.3 18 18 A 37 ARG O A 41 LEU N 1.0 2.4 3.3 19 19 A 42 LYS H A 38 LYS O 1.0 1.5 2.3 20 20 A 38 LYS O A 42 LYS N 1.0 2.4 3.3 21 21 A 43 TYR H A 39 LEU O 1.0 1.5 2.3 22 22 A 39 LEU O A 43 TYR N 1.0 2.4 3.3 23 23 A 56 LYS H A 52 GLY O 1.0 1.5 2.3 24 24 A 52 GLY O A 56 LYS N 1.0 2.4 3.3 25 25 A 58 ILE H A 54 LYS O 1.0 1.5 2.3 26 26 A 54 LYS O A 58 ILE N 1.0 2.4 3.3 27 27 A 59 SER H A 55 PHE O 1.0 1.5 2.3 28 28 A 55 PHE O A 59 SER N 1.0 2.4 3.3 29 29 A 60 GLN H A 56 LYS O 1.0 1.5 2.3 30 30 A 56 LYS O A 60 GLN N 1.0 2.4 3.3 31 31 A 61 ALA H A 57 GLN O 1.0 1.5 2.3 32 32 A 57 GLN O A 61 ALA N 1.0 2.4 3.3 33 33 A 62 TYR H A 58 ILE O 1.0 1.5 2.3 34 34 A 58 ILE O A 62 TYR N 1.0 2.4 3.3 35 35 A 63 GLU H A 59 SER O 1.0 1.5 2.3 36 36 A 59 SER O A 63 GLU N 1.0 2.4 3.3 37 37 A 64 VAL H A 60 GLN O 1.0 1.5 2.3 38 38 A 60 GLN O A 64 VAL N 1.0 2.4 3.3 39 39 A 65 LEU H A 61 ALA O 1.0 1.5 2.3 40 40 A 61 ALA O A 65 LEU N 1.0 2.4 3.3 41 41 A 72 GLU H A 68 ALA O 1.0 1.5 2.3 42 42 A 68 ALA O A 72 GLU N 1.0 2.4 3.3 43 43 A 73 LEU H A 69 LYS O 1.0 1.5 2.3 44 44 A 69 LYS O A 73 LEU N 1.0 2.4 3.3 45 45 A 74 TYR H A 70 LYS O 1.0 1.5 2.3 46 46 A 70 LYS O A 74 TYR N 1.0 2.4 3.3 47 47 A 75 ASP H A 71 ARG O 1.0 1.5 2.3 48 48 A 71 ARG O A 75 ASP N 1.0 2.4 3.3 49 49 A 76 LYS H A 72 GLU O 1.0 1.5 2.3 50 50 A 72 GLU O A 76 LYS N 1.0 2.4 3.3 stop_ save_ save_CNS/XPLOR_dihedral_5 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_5 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 15 THR C A 16 THR N A 16 THR CA A 16 THR C 1.0 -164.5 -51.9 PHI 2 2 A 16 THR N A 16 THR CA A 16 THR C A 17 TYR N 1.0 119.8 198.6 PSI 3 3 A 16 THR C A 17 TYR N A 17 TYR CA A 17 TYR C 1.0 -84.4 -44.4 PHI 4 4 A 17 TYR N A 17 TYR CA A 17 TYR C A 18 TYR N 1.0 -57.8 7.8 PSI 5 5 A 17 TYR C A 18 TYR N A 18 TYR CA A 18 TYR C 1.0 -83.3 -43.3 PHI 6 6 A 18 TYR N A 18 TYR CA A 18 TYR C A 19 ASP N 1.0 -55.2 -15.2 PSI 7 7 A 18 TYR C A 19 ASP N A 19 ASP CA A 19 ASP C 1.0 -83.8 -43.8 PHI 8 8 A 19 ASP N A 19 ASP CA A 19 ASP C A 20 VAL N 1.0 -61.6 -21.6 PSI 9 9 A 19 ASP C A 20 VAL N A 20 VAL CA A 20 VAL C 1.0 -83.8 -43.8 PHI 10 10 A 20 VAL N A 20 VAL CA A 20 VAL C A 21 LEU N 1.0 -56.6 -15.0 PSI 11 11 A 20 VAL C A 21 LEU N A 21 LEU CA A 21 LEU C 1.0 -109.8 -69.8 PHI 12 12 A 21 LEU N A 21 LEU CA A 21 LEU C A 22 GLY N 1.0 -23.8 27.4 PSI 13 13 A 21 LEU C A 22 GLY N A 22 GLY CA A 22 GLY C 1.0 44.1 94.5 PHI 14 14 A 22 GLY N A 22 GLY CA A 22 GLY C A 23 VAL N 1.0 8.6 68.8 PSI 15 15 A 22 GLY C A 23 VAL N A 23 VAL CA A 23 VAL C 1.0 -156.4 -110.2 PHI 16 16 A 23 VAL N A 23 VAL CA A 23 VAL C A 24 LYS N 1.0 138.7 178.7 PSI 17 17 A 23 VAL C A 24 LYS N A 24 LYS CA A 24 LYS C 1.0 -146.9 -36.1 PHI 18 18 A 24 LYS N A 24 LYS CA A 24 LYS C A 25 PRO N 1.0 77.1 170.3 PSI 19 19 A 24 LYS C A 25 PRO N A 25 PRO CA A 25 PRO C 1.0 -82.1 -42.1 PHI 20 20 A 26 ASN N A 26 ASN CA A 26 ASN C A 27 ALA N 1.0 5.8 64.2 PSI 21 21 A 27 ALA C A 28 THR N A 28 THR CA A 28 THR C 1.0 -133.9 -53.7 PHI 22 22 A 28 THR N A 28 THR CA A 28 THR C A 29 GLN N 1.0 146.4 186.4 PSI 23 23 A 28 THR C A 29 GLN N A 29 GLN CA A 29 GLN C 1.0 -81.9 -41.9 PHI 24 24 A 29 GLN N A 29 GLN CA A 29 GLN C A 30 GLU N 1.0 -58.1 -18.1 PSI 25 25 A 29 GLN C A 30 GLU N A 30 GLU CA A 30 GLU C 1.0 -85.1 -45.1 PHI 26 26 A 30 GLU N A 30 GLU CA A 30 GLU C A 31 GLU N 1.0 -60.5 -20.5 PSI 27 27 A 30 GLU C A 31 GLU N A 31 GLU CA A 31 GLU C 1.0 -86.1 -46.1 PHI 28 28 A 31 GLU N A 31 GLU CA A 31 GLU C A 32 LEU N 1.0 -61.9 -21.9 PSI 29 29 A 31 GLU C A 32 LEU N A 32 LEU CA A 32 LEU C 1.0 -84.4 -44.4 PHI 30 30 A 32 LEU N A 32 LEU CA A 32 LEU C A 33 LYS N 1.0 -62.0 -22.0 PSI 31 31 A 32 LEU C A 33 LYS N A 33 LYS CA A 33 LYS C 1.0 -80.1 -40.1 PHI 32 32 A 33 LYS N A 33 LYS CA A 33 LYS C A 34 LYS N 1.0 -61.9 -21.9 PSI 33 33 A 33 LYS C A 34 LYS N A 34 LYS CA A 34 LYS C 1.0 -84.4 -44.4 PHI 34 34 A 34 LYS N A 34 LYS CA A 34 LYS C A 35 ALA N 1.0 -60.4 -20.4 PSI 35 35 A 34 LYS C A 35 ALA N A 35 ALA CA A 35 ALA C 1.0 -85.3 -45.3 PHI 36 36 A 35 ALA N A 35 ALA CA A 35 ALA C A 36 TYR N 1.0 -63.4 -23.4 PSI 37 37 A 35 ALA C A 36 TYR N A 36 TYR CA A 36 TYR C 1.0 -87.1 -47.1 PHI 38 38 A 36 TYR N A 36 TYR CA A 36 TYR C A 37 ARG N 1.0 -62.6 -22.6 PSI 39 39 A 36 TYR C A 37 ARG N A 37 ARG CA A 37 ARG C 1.0 -78.3 -38.3 PHI 40 40 A 37 ARG N A 37 ARG CA A 37 ARG C A 38 LYS N 1.0 -64.5 -24.5 PSI 41 41 A 37 ARG C A 38 LYS N A 38 LYS CA A 38 LYS C 1.0 -82.0 -42.0 PHI 42 42 A 38 LYS N A 38 LYS CA A 38 LYS C A 39 LEU N 1.0 -61.9 -21.9 PSI 43 43 A 38 LYS C A 39 LEU N A 39 LEU CA A 39 LEU C 1.0 -86.7 -46.7 PHI 44 44 A 39 LEU N A 39 LEU CA A 39 LEU C A 40 ALA N 1.0 -60.0 -20.0 PSI 45 45 A 39 LEU C A 40 ALA N A 40 ALA CA A 40 ALA C 1.0 -83.4 -43.4 PHI 46 46 A 40 ALA N A 40 ALA CA A 40 ALA C A 41 LEU N 1.0 -60.1 -17.3 PSI 47 47 A 40 ALA C A 41 LEU N A 41 LEU CA A 41 LEU C 1.0 -88.2 -48.2 PHI 48 48 A 41 LEU N A 41 LEU CA A 41 LEU C A 42 LYS N 1.0 -56.4 -7.6 PSI 49 49 A 41 LEU C A 42 LYS N A 42 LYS CA A 42 LYS C 1.0 -92.7 -50.5 PHI 50 50 A 42 LYS N A 42 LYS CA A 42 LYS C A 43 TYR N 1.0 -55.3 -15.3 PSI 51 51 A 43 TYR C A 44 HIS N A 44 HIS CA A 44 HIS C 1.0 -118.1 -39.1 PHI 52 52 A 44 HIS N A 44 HIS CA A 44 HIS C A 45 PRO N 1.0 106.3 164.9 PSI 53 53 A 44 HIS C A 45 PRO N A 45 PRO CA A 45 PRO C 1.0 -77.2 -37.2 PHI 54 54 A 45 PRO N A 45 PRO CA A 45 PRO C A 46 ASP N 1.0 -52.3 -12.3 PSI 55 55 A 45 PRO C A 46 ASP N A 46 ASP CA A 46 ASP C 1.0 -86.3 -46.3 PHI 56 56 A 46 ASP N A 46 ASP CA A 46 ASP C A 47 LYS N 1.0 -48.0 9.4 PSI 57 57 A 46 ASP C A 47 LYS N A 47 LYS CA A 47 LYS C 1.0 -107.1 -67.1 PHI 58 58 A 47 LYS N A 47 LYS CA A 47 LYS C A 48 ASN N 1.0 -51.8 19.0 PSI 59 59 A 47 LYS C A 48 ASN N A 48 ASN CA A 48 ASN C 1.0 -156.4 -59.4 PHI 60 60 A 48 ASN N A 48 ASN CA A 48 ASN C A 49 PRO N 1.0 39.7 161.9 PSI 61 61 A 48 ASN C A 49 PRO N A 49 PRO CA A 49 PRO C 1.0 -77.1 -37.1 PHI 62 62 A 49 PRO N A 49 PRO CA A 49 PRO C A 50 ASN N 1.0 -46.7 -6.7 PSI 63 63 A 49 PRO C A 50 ASN N A 50 ASN CA A 50 ASN C 1.0 -91.0 -51.0 PHI 64 64 A 50 ASN N A 50 ASN CA A 50 ASN C A 51 GLU N 1.0 -38.9 3.1 PSI 65 65 A 50 ASN C A 51 GLU N A 51 GLU CA A 51 GLU C 1.0 -109.6 -32.0 PHI 66 66 A 51 GLU N A 51 GLU CA A 51 GLU C A 52 GLY N 1.0 -87.7 21.7 PSI 67 67 A 51 GLU C A 52 GLY N A 52 GLY CA A 52 GLY C 1.0 -81.2 -41.2 PHI 68 68 A 52 GLY N A 52 GLY CA A 52 GLY C A 53 GLU N 1.0 -60.7 -20.7 PSI 69 69 A 52 GLY C A 53 GLU N A 53 GLU CA A 53 GLU C 1.0 -87.6 -47.6 PHI 70 70 A 53 GLU N A 53 GLU CA A 53 GLU C A 54 LYS N 1.0 -61.5 -21.5 PSI 71 71 A 53 GLU C A 54 LYS N A 54 LYS CA A 54 LYS C 1.0 -86.8 -46.8 PHI 72 72 A 54 LYS N A 54 LYS CA A 54 LYS C A 55 PHE N 1.0 -58.8 -18.8 PSI 73 73 A 54 LYS C A 55 PHE N A 55 PHE CA A 55 PHE C 1.0 -85.5 -45.5 PHI 74 74 A 55 PHE N A 55 PHE CA A 55 PHE C A 56 LYS N 1.0 -58.3 -18.3 PSI 75 75 A 55 PHE C A 56 LYS N A 56 LYS CA A 56 LYS C 1.0 -83.8 -43.8 PHI 76 76 A 56 LYS N A 56 LYS CA A 56 LYS C A 57 GLN N 1.0 -64.0 -24.0 PSI 77 77 A 56 LYS C A 57 GLN N A 57 GLN CA A 57 GLN C 1.0 -84.7 -44.7 PHI 78 78 A 57 GLN N A 57 GLN CA A 57 GLN C A 58 ILE N 1.0 -61.8 -21.8 PSI 79 79 A 57 GLN C A 58 ILE N A 58 ILE CA A 58 ILE C 1.0 -85.7 -45.7 PHI 80 80 A 58 ILE N A 58 ILE CA A 58 ILE C A 59 SER N 1.0 -57.5 -17.5 PSI 81 81 A 58 ILE C A 59 SER N A 59 SER CA A 59 SER C 1.0 -82.7 -42.7 PHI 82 82 A 59 SER N A 59 SER CA A 59 SER C A 60 GLN N 1.0 -62.9 -22.9 PSI 83 83 A 59 SER C A 60 GLN N A 60 GLN CA A 60 GLN C 1.0 -83.2 -43.2 PHI 84 84 A 60 GLN N A 60 GLN CA A 60 GLN C A 61 ALA N 1.0 -60.5 -20.5 PSI 85 85 A 60 GLN C A 61 ALA N A 61 ALA CA A 61 ALA C 1.0 -86.0 -46.0 PHI 86 86 A 61 ALA N A 61 ALA CA A 61 ALA C A 62 TYR N 1.0 -52.7 -12.7 PSI 87 87 A 61 ALA C A 62 TYR N A 62 TYR CA A 62 TYR C 1.0 -84.4 -44.4 PHI 88 88 A 62 TYR N A 62 TYR CA A 62 TYR C A 63 GLU N 1.0 -58.1 -18.1 PSI 89 89 A 62 TYR C A 63 GLU N A 63 GLU CA A 63 GLU C 1.0 -81.9 -41.9 PHI 90 90 A 63 GLU N A 63 GLU CA A 63 GLU C A 64 VAL N 1.0 -61.6 -17.8 PSI 91 91 A 63 GLU C A 64 VAL N A 64 VAL CA A 64 VAL C 1.0 -102.2 -39.2 PHI 92 92 A 64 VAL N A 64 VAL CA A 64 VAL C A 65 LEU N 1.0 -60.9 -20.9 PSI 93 93 A 64 VAL C A 65 LEU N A 65 LEU CA A 65 LEU C 1.0 -92.9 -36.1 PHI 94 94 A 65 LEU N A 65 LEU CA A 65 LEU C A 66 SER N 1.0 -52.7 -8.7 PSI 95 95 A 65 LEU C A 66 SER N A 66 SER CA A 66 SER C 1.0 -121.8 -59.6 PHI 96 96 A 66 SER N A 66 SER CA A 66 SER C A 67 ASP N 1.0 -40.8 27.2 PSI 97 97 A 66 SER C A 67 ASP N A 67 ASP CA A 67 ASP C 1.0 -156.1 -57.3 PHI 98 98 A 67 ASP N A 67 ASP CA A 67 ASP C A 68 ALA N 1.0 68.9 147.3 PSI 99 99 A 67 ASP C A 68 ALA N A 68 ALA CA A 68 ALA C 1.0 -78.7 -38.7 PHI 100 100 A 68 ALA N A 68 ALA CA A 68 ALA C A 69 LYS N 1.0 -54.4 -11.0 PSI 101 101 A 68 ALA C A 69 LYS N A 69 LYS CA A 69 LYS C 1.0 -80.1 -40.1 PHI 102 102 A 69 LYS N A 69 LYS CA A 69 LYS C A 70 LYS N 1.0 -62.0 -22.0 PSI 103 103 A 69 LYS C A 70 LYS N A 70 LYS CA A 70 LYS C 1.0 -83.3 -43.3 PHI 104 104 A 70 LYS N A 70 LYS CA A 70 LYS C A 71 ARG N 1.0 -61.1 -21.1 PSI 105 105 A 70 LYS C A 71 ARG N A 71 ARG CA A 71 ARG C 1.0 -81.9 -41.9 PHI 106 106 A 71 ARG N A 71 ARG CA A 71 ARG C A 72 GLU N 1.0 -64.4 -24.4 PSI 107 107 A 71 ARG C A 72 GLU N A 72 GLU CA A 72 GLU C 1.0 -80.5 -40.5 PHI 108 108 A 72 GLU N A 72 GLU CA A 72 GLU C A 73 LEU N 1.0 -64.5 -24.5 PSI 109 109 A 72 GLU C A 73 LEU N A 73 LEU CA A 73 LEU C 1.0 -85.8 -45.8 PHI 110 110 A 73 LEU N A 73 LEU CA A 73 LEU C A 74 TYR N 1.0 -60.6 -20.6 PSI 111 111 A 73 LEU C A 74 TYR N A 74 TYR CA A 74 TYR C 1.0 -86.2 -46.2 PHI 112 112 A 74 TYR N A 74 TYR CA A 74 TYR C A 75 ASP N 1.0 -64.1 -24.1 PSI 113 113 A 74 TYR C A 75 ASP N A 75 ASP CA A 75 ASP C 1.0 -91.4 -51.4 PHI 114 114 A 75 ASP N A 75 ASP CA A 75 ASP C A 76 LYS N 1.0 -53.3 13.1 PSI 115 115 A 75 ASP C A 76 LYS N A 76 LYS CA A 76 LYS C 1.0 -124.0 -47.0 PHI 116 116 A 76 LYS N A 76 LYS CA A 76 LYS C A 77 GLY N 1.0 -71.0 38.6 PSI stop_ save_