data_nef_c36064_5x9x 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 _nef_nmr_meta_data.program_name . _nef_nmr_meta_data.program_version . _nef_nmr_meta_data.creation_date . _nef_nmr_meta_data.uuid . _nef_nmr_meta_data.coordinate_file_name . loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 5X9X stop_ 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 ASP middle . . 3 A 3 SER middle . . 4 A 4 LYS middle . . 5 A 5 GLU middle . . 6 A 6 ASP middle . . 7 A 7 GLU middle . . 8 A 8 GLU middle . . 9 A 9 ARG middle . . 10 A 10 TYR middle . . 11 A 11 GLN middle . . 12 A 12 LYS middle . . 13 A 13 LEU middle . . 14 A 14 VAL middle . . 15 A 15 THR middle . . 16 A 16 GLU middle . . 17 A 17 ASN middle . . 18 A 18 GLU middle . . 19 A 19 GLN middle . . 20 A 20 LEU middle . . 21 A 21 GLN middle . . 22 A 22 ARG middle . . 23 A 23 LEU middle . . 24 A 24 ILE middle . . 25 A 25 THR middle . . 26 A 26 GLN middle . . 27 A 27 LYS middle . . 28 A 28 GLU middle . . 29 A 29 GLU middle . . 30 A 30 LYS middle . . 31 A 31 ILE middle . . 32 A 32 ARG middle . . 33 A 33 VAL middle . . 34 A 34 LEU middle . . 35 A 35 ARG middle . . 36 A 36 GLN middle . . 37 A 37 ARG middle . . 38 A 38 LEU middle . . 39 A 39 VAL middle . . 40 A 40 GLU middle . . 41 A 41 ARG middle . . 42 A 42 GLY middle . false 43 A 43 ASP middle . . 44 A 44 ALA end . . 45 B 95 GLY start . false 46 B 96 PRO middle . false 47 B 97 LEU middle . . 48 B 98 GLY middle . false 49 B 99 SER middle . . 50 B 100 SER middle . . 51 B 101 VAL middle . . 52 B 102 SER middle . . 53 B 103 GLU middle . . 54 B 104 LEU middle . . 55 B 105 GLU middle . . 56 B 106 GLN middle . . 57 B 107 ARG middle . . 58 B 108 LEU middle . . 59 B 109 ARG middle . . 60 B 110 ASP middle . . 61 B 111 VAL middle . . 62 B 112 LYS middle . . 63 B 113 ASN middle . . 64 B 114 THR middle . . 65 B 115 ASN middle . . 66 B 116 SER middle . . 67 B 117 ARG middle . . 68 B 118 PHE middle . . 69 B 119 ARG middle . . 70 B 120 LYS middle . . 71 B 121 ALA middle . . 72 B 122 LEU middle . . 73 B 123 MET middle . . 74 B 124 GLU middle . . 75 B 125 LYS middle . . 76 B 126 GLU middle . . 77 B 127 ASN middle . . 78 B 128 GLU middle . . 79 B 129 LEU middle . . 80 B 130 GLN middle . . 81 B 131 ALA middle . . 82 B 132 LEU middle . . 83 B 133 ILE middle . . 84 B 134 ARG middle . . 85 B 135 LYS middle . . 86 B 136 LEU middle . . 87 B 137 GLY middle . false 88 B 138 PRO middle . false 89 B 139 GLU end . . stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_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 2 ASP HA H 1 4.728 0.002 A 2 ASP HBx H 1 2.658 0.004 A 2 ASP HBy H 1 2.739 0.005 A 2 ASP C C 13 175.890 . A 2 ASP CA C 13 54.344 0.007 A 2 ASP CB C 13 41.739 0.041 A 3 SER H H 1 8.747 0.003 A 3 SER HA H 1 4.517 0.006 A 3 SER HBx H 1 3.922 0.007 A 3 SER HBy H 1 4.055 0.007 A 3 SER C C 13 175.267 . A 3 SER CA C 13 58.502 0.026 A 3 SER CB C 13 63.935 0.092 A 3 SER N N 15 117.837 0.039 A 4 LYS H H 1 8.586 0.001 A 4 LYS HA H 1 4.190 0.004 A 4 LYS HB2 H 1 1.883 0.005 A 4 LYS HD2 H 1 1.706 0.003 A 4 LYS HE2 H 1 3.003 0.004 A 4 LYS HGx H 1 1.442 0.006 A 4 LYS HGy H 1 1.495 0.011 A 4 LYS C C 13 178.404 . A 4 LYS CA C 13 58.589 0.072 A 4 LYS CB C 13 32.379 0.046 A 4 LYS CD C 13 29.184 0.042 A 4 LYS CE C 13 42.153 0.01 A 4 LYS CG C 13 24.797 0.073 A 4 LYS N N 15 124.243 0.057 A 5 GLU H H 1 8.520 0.002 A 5 GLU HA H 1 4.143 . A 5 GLU HB2 H 1 2.032 0.004 A 5 GLU HG2 H 1 2.321 0.001 A 5 GLU CA C 13 58.883 . A 5 GLU CB C 13 29.322 0.027 A 5 GLU CG C 13 36.748 0.037 A 5 GLU N N 15 119.919 0.032 A 6 ASP H H 1 8.089 0.005 A 6 ASP HA H 1 4.558 0.001 A 6 ASP HBy H 1 2.803 0.005 A 6 ASP HBx H 1 2.575 0.004 A 6 ASP CA C 13 56.951 0.004 A 6 ASP CB C 13 40.774 0.085 A 6 ASP N N 15 121.182 0.038 A 7 GLU H H 1 8.193 0.004 A 7 GLU HA H 1 4.217 0.004 A 7 GLU HBx H 1 2.157 0.005 A 7 GLU HBy H 1 2.352 0.009 A 7 GLU N N 15 121.194 0.045 A 8 GLU H H 1 8.178 0.001 A 8 GLU HA H 1 4.126 0.003 A 8 GLU HB2 H 1 2.174 0.0 A 8 GLU HG2 H 1 2.454 0.0 A 8 GLU C C 13 178.200 . A 8 GLU N N 15 119.882 0.119 A 9 ARG H H 1 8.178 0.004 A 9 ARG HA H 1 4.015 0.003 A 9 ARG HBx H 1 1.993 0.008 A 9 ARG HBy H 1 2.085 0.007 A 9 ARG HD2 H 1 3.263 . A 9 ARG HGx H 1 1.678 0.007 A 9 ARG HGy H 1 1.829 0.005 A 9 ARG C C 13 178.650 . A 9 ARG CA C 13 59.668 0.072 A 9 ARG CB C 13 30.150 0.036 A 9 ARG CD C 13 43.503 . A 9 ARG CG C 13 27.781 0.048 A 9 ARG N N 15 120.841 0.036 A 10 TYR H H 1 8.285 0.004 A 10 TYR HA H 1 3.994 0.008 A 10 TYR HBy H 1 3.363 0.002 A 10 TYR HBx H 1 3.045 0.003 A 10 TYR HD1 H 1 6.979 0.005 A 10 TYR HD2 H 1 6.979 0.005 A 10 TYR HE1 H 1 6.779 0.003 A 10 TYR HE2 H 1 6.779 0.003 A 10 TYR C C 13 175.986 . A 10 TYR CA C 13 62.089 0.048 A 10 TYR CB C 13 37.974 0.054 A 10 TYR N N 15 119.651 0.036 A 11 GLN H H 1 8.277 0.003 A 11 GLN HA H 1 3.758 0.005 A 11 GLN HB2 H 1 2.200 0.005 A 11 GLN HE21 H 1 6.955 0.004 A 11 GLN HE22 H 1 7.745 0.004 A 11 GLN HG2 H 1 2.642 0.005 A 11 GLN C C 13 178.972 . A 11 GLN CA C 13 58.448 0.056 A 11 GLN CB C 13 27.901 0.063 A 11 GLN CG C 13 33.470 0.026 A 11 GLN N N 15 117.440 0.042 A 11 GLN NE2 N 15 112.224 0.024 A 12 LYS H H 1 8.184 0.006 A 12 LYS HA H 1 4.028 0.009 A 12 LYS HB2 H 1 1.944 0.005 A 12 LYS HD2 H 1 1.680 0.001 A 12 LYS HE2 H 1 2.984 0.008 A 12 LYS HGy H 1 1.627 . A 12 LYS HGx H 1 1.433 0.005 A 12 LYS CA C 13 59.527 0.066 A 12 LYS CB C 13 32.500 0.036 A 12 LYS CD C 13 29.409 . A 12 LYS CE C 13 42.246 . A 12 LYS CG C 13 25.573 0.006 A 12 LYS N N 15 119.663 0.027 A 13 LEU H H 1 7.825 0.004 A 13 LEU HA H 1 4.003 0.007 A 13 LEU HBx H 1 1.104 0.01 A 13 LEU HBy H 1 1.968 0.008 A 13 LEU HDx% H 1 0.823 0.005 A 13 LEU HDy% H 1 0.801 0.005 A 13 LEU HG H 1 1.683 0.006 A 13 LEU C C 13 178.500 . A 13 LEU CA C 13 58.172 0.039 A 13 LEU CB C 13 42.537 0.088 A 13 LEU CDy C 13 26.792 0.046 A 13 LEU CDx C 13 23.441 0.059 A 13 LEU CG C 13 27.892 . A 13 LEU N N 15 121.567 0.047 A 14 VAL H H 1 8.173 0.003 A 14 VAL HA H 1 3.472 0.004 A 14 VAL HB H 1 1.945 0.003 A 14 VAL HGx% H 1 0.532 0.003 A 14 VAL HGy% H 1 0.860 0.004 A 14 VAL C C 13 179.606 . A 14 VAL CA C 13 67.264 0.065 A 14 VAL CB C 13 31.604 0.039 A 14 VAL CGy C 13 22.935 0.033 A 14 VAL CGx C 13 21.272 0.022 A 14 VAL N N 15 120.827 0.043 A 15 THR H H 1 8.003 0.003 A 15 THR HA H 1 3.983 0.005 A 15 THR HB H 1 4.220 0.004 A 15 THR HG2% H 1 1.280 0.005 A 15 THR C C 13 176.901 . A 15 THR CA C 13 66.672 0.043 A 15 THR CB C 13 68.821 0.081 A 15 THR CG2 C 13 21.944 0.096 A 15 THR N N 15 116.796 0.03 A 16 GLU H H 1 8.325 0.005 A 16 GLU HA H 1 4.048 0.007 A 16 GLU HBy H 1 2.177 0.009 A 16 GLU HBx H 1 2.029 0.007 A 16 GLU HGy H 1 2.426 0.002 A 16 GLU HGx H 1 2.088 0.006 A 16 GLU C C 13 178.601 . A 16 GLU CA C 13 59.805 0.091 A 16 GLU CB C 13 30.006 0.092 A 16 GLU CG C 13 37.352 0.059 A 16 GLU N N 15 123.686 0.04 A 17 ASN H H 1 8.996 0.003 A 17 ASN HA H 1 4.596 0.003 A 17 ASN HBx H 1 2.859 0.003 A 17 ASN HBy H 1 3.206 0.0 A 17 ASN C C 13 177.870 . A 17 ASN CA C 13 56.094 0.055 A 17 ASN CB C 13 36.944 0.037 A 17 ASN N N 15 120.373 0.042 A 18 GLU H H 1 7.911 0.006 A 18 GLU HA H 1 4.088 0.01 A 18 GLU HBx H 1 2.132 0.011 A 18 GLU HBy H 1 2.290 0.005 A 18 GLU HGy H 1 2.531 0.005 A 18 GLU HGx H 1 2.284 0.003 A 18 GLU CA C 13 59.718 0.053 A 18 GLU CB C 13 29.404 0.07 A 18 GLU CG C 13 36.411 0.031 A 18 GLU N N 15 120.666 0.037 A 19 GLN H H 1 7.813 0.004 A 19 GLN HA H 1 4.086 0.011 A 19 GLN HBx H 1 2.202 0.007 A 19 GLN HBy H 1 2.329 0.007 A 19 GLN HE21 H 1 7.409 0.005 A 19 GLN HE22 H 1 6.888 0.003 A 19 GLN HGx H 1 2.439 0.008 A 19 GLN HGy H 1 2.505 0.016 A 19 GLN C C 13 179.135 . A 19 GLN CA C 13 58.658 0.13 A 19 GLN CB C 13 27.823 0.055 A 19 GLN CG C 13 33.437 0.058 A 19 GLN N N 15 120.015 0.039 A 19 GLN NE2 N 15 111.507 0.036 A 20 LEU H H 1 9.015 0.004 A 20 LEU HA H 1 4.010 0.002 A 20 LEU HBx H 1 1.211 0.007 A 20 LEU HBy H 1 2.217 0.0 A 20 LEU HDx% H 1 1.094 0.003 A 20 LEU HDy% H 1 0.890 0.005 A 20 LEU HG H 1 2.012 0.006 A 20 LEU CA C 13 58.342 0.077 A 20 LEU CB C 13 42.608 0.063 A 20 LEU CDy C 13 27.597 0.047 A 20 LEU CDx C 13 23.548 0.021 A 20 LEU CG C 13 27.252 0.049 A 20 LEU N N 15 120.953 0.039 A 21 GLN H H 1 8.107 0.005 A 21 GLN HA H 1 3.522 0.006 A 21 GLN HBy H 1 2.023 0.003 A 21 GLN HBx H 1 1.938 0.002 A 21 GLN HE21 H 1 7.077 0.002 A 21 GLN HE22 H 1 6.867 0.001 A 21 GLN HGx H 1 2.009 0.007 A 21 GLN HGy H 1 2.098 0.007 A 21 GLN CA C 13 59.242 0.044 A 21 GLN CB C 13 28.561 0.056 A 21 GLN CG C 13 34.418 0.047 A 21 GLN N N 15 117.559 0.035 A 21 GLN NE2 N 15 112.211 0.033 A 22 ARG H H 1 7.580 0.004 A 22 ARG HA H 1 4.072 0.002 A 22 ARG HBy H 1 1.970 0.008 A 22 ARG HBx H 1 1.908 0.006 A 22 ARG HD2 H 1 3.274 0.003 A 22 ARG HGy H 1 1.846 0.005 A 22 ARG HGx H 1 1.609 0.006 A 22 ARG CA C 13 59.548 0.076 A 22 ARG CB C 13 29.955 0.063 A 22 ARG CD C 13 43.498 0.007 A 22 ARG CG C 13 27.965 0.118 A 22 ARG N N 15 119.473 0.08 A 23 LEU H H 1 8.016 0.003 A 23 LEU HA H 1 4.104 0.006 A 23 LEU HBy H 1 2.007 0.003 A 23 LEU HBx H 1 1.531 0.005 A 23 LEU HDx% H 1 0.937 0.014 A 23 LEU HDy% H 1 0.905 0.009 A 23 LEU HG H 1 1.774 0.006 A 23 LEU CA C 13 57.968 0.134 A 23 LEU CB C 13 42.373 0.052 A 23 LEU CDy C 13 24.910 0.088 A 23 LEU CDx C 13 23.376 0.046 A 23 LEU CG C 13 26.967 0.067 A 23 LEU N N 15 121.095 0.074 A 24 ILE H H 1 8.668 0.005 A 24 ILE HA H 1 3.334 0.005 A 24 ILE HB H 1 1.808 0.008 A 24 ILE HD1% H 1 0.802 0.004 A 24 ILE HG1y H 1 1.881 0.01 A 24 ILE HG1x H 1 0.546 0.009 A 24 ILE HG2% H 1 0.820 0.006 A 24 ILE C C 13 177.669 . A 24 ILE CA C 13 66.892 0.058 A 24 ILE CB C 13 38.218 0.048 A 24 ILE CD1 C 13 13.969 0.066 A 24 ILE CG1 C 13 31.535 0.054 A 24 ILE CG2 C 13 17.505 0.038 A 24 ILE N N 15 121.295 0.057 A 25 THR H H 1 8.081 0.004 A 25 THR HA H 1 3.989 0.008 A 25 THR HB H 1 4.258 0.009 A 25 THR HG2% H 1 1.284 0.004 A 25 THR C C 13 176.796 . A 25 THR CA C 13 66.657 0.042 A 25 THR CB C 13 68.775 0.071 A 25 THR CG2 C 13 21.986 0.03 A 25 THR N N 15 116.228 0.031 A 26 GLN H H 1 8.050 0.003 A 26 GLN HA H 1 4.115 0.005 A 26 GLN HBy H 1 2.308 0.006 A 26 GLN HBx H 1 2.165 0.007 A 26 GLN HE21 H 1 6.805 0.001 A 26 GLN HE22 H 1 7.507 0.002 A 26 GLN HGy H 1 2.626 0.005 A 26 GLN HGx H 1 2.336 0.005 A 26 GLN C C 13 179.539 . A 26 GLN CA C 13 59.295 0.085 A 26 GLN CB C 13 28.755 0.068 A 26 GLN CG C 13 34.270 0.069 A 26 GLN N N 15 121.018 0.034 A 26 GLN NE2 N 15 110.953 0.028 A 27 LYS H H 1 8.415 0.004 A 27 LYS HA H 1 4.046 0.007 A 27 LYS HBy H 1 2.102 0.007 A 27 LYS HBx H 1 1.652 0.007 A 27 LYS HDx H 1 1.466 0.005 A 27 LYS HDy H 1 1.640 0.006 A 27 LYS HE2 H 1 2.837 0.002 A 27 LYS HGy H 1 1.656 0.006 A 27 LYS HGx H 1 1.579 0.005 A 27 LYS C C 13 178.657 . A 27 LYS CA C 13 59.360 0.055 A 27 LYS CB C 13 31.890 0.055 A 27 LYS CD C 13 28.615 0.064 A 27 LYS CE C 13 42.475 0.067 A 27 LYS CG C 13 25.766 0.108 A 27 LYS N N 15 120.398 0.031 A 28 GLU H H 1 8.792 0.004 A 28 GLU HA H 1 4.048 0.007 A 28 GLU HBy H 1 2.301 0.01 A 28 GLU HBx H 1 2.043 0.01 A 28 GLU HGy H 1 2.468 0.002 A 28 GLU HGx H 1 2.196 0.009 A 28 GLU CA C 13 59.650 0.12 A 28 GLU CB C 13 29.536 0.08 A 28 GLU CG C 13 36.765 0.062 A 28 GLU N N 15 118.872 0.035 A 29 GLU H H 1 8.030 0.005 A 29 GLU HA H 1 4.195 0.005 A 29 GLU HBy H 1 2.193 0.01 A 29 GLU HBx H 1 2.075 0.011 A 29 GLU HGy H 1 2.402 0.004 A 29 GLU HGx H 1 2.347 0.007 A 29 GLU CA C 13 59.187 0.084 A 29 GLU CB C 13 29.099 0.145 A 29 GLU CG C 13 35.805 0.049 A 29 GLU N N 15 119.942 0.04 A 30 LYS H H 1 7.590 0.003 A 30 LYS HA H 1 4.074 0.01 A 30 LYS HBx H 1 1.945 0.006 A 30 LYS HBy H 1 1.979 0.018 A 30 LYS HGx H 1 1.452 0.008 A 30 LYS HGy H 1 1.568 0.002 A 30 LYS CA C 13 59.509 0.04 A 30 LYS CB C 13 32.509 0.061 A 30 LYS CG C 13 25.144 0.051 A 30 LYS N N 15 119.804 0.064 A 31 ILE H H 1 8.614 0.002 A 31 ILE HA H 1 3.431 0.005 A 31 ILE HB H 1 1.953 0.006 A 31 ILE HD1% H 1 1.001 0.006 A 31 ILE HG1y H 1 1.933 0.007 A 31 ILE HG1x H 1 0.657 0.008 A 31 ILE HG2% H 1 0.857 0.008 A 31 ILE C C 13 177.010 . A 31 ILE CA C 13 65.907 0.074 A 31 ILE CB C 13 38.468 0.054 A 31 ILE CD1 C 13 14.439 0.051 A 31 ILE CG1 C 13 31.814 0.098 A 31 ILE CG2 C 13 17.019 0.041 A 31 ILE N N 15 120.338 0.051 A 32 ARG H H 1 8.062 0.004 A 32 ARG HA H 1 3.894 0.006 A 32 ARG HB2 H 1 2.008 0.006 A 32 ARG HDx H 1 3.196 0.004 A 32 ARG HDy H 1 3.269 0.005 A 32 ARG HGy H 1 1.830 0.014 A 32 ARG HGx H 1 1.569 0.01 A 32 ARG C C 13 179.750 . A 32 ARG CA C 13 60.288 0.028 A 32 ARG CB C 13 30.082 0.039 A 32 ARG CD C 13 43.447 0.063 A 32 ARG CG C 13 27.761 0.057 A 32 ARG N N 15 119.132 0.037 A 33 VAL H H 1 7.707 0.003 A 33 VAL HA H 1 3.709 0.004 A 33 VAL HB H 1 2.210 0.008 A 33 VAL HGx% H 1 0.959 0.005 A 33 VAL HGy% H 1 1.117 0.003 A 33 VAL CA C 13 66.354 0.053 A 33 VAL CB C 13 32.069 0.067 A 33 VAL CGx C 13 21.141 0.06 A 33 VAL CGy C 13 22.688 0.042 A 33 VAL N N 15 119.355 0.067 A 34 LEU H H 1 8.208 0.006 A 34 LEU HA H 1 3.996 0.006 A 34 LEU HBx H 1 1.348 0.008 A 34 LEU HBy H 1 1.971 0.008 A 34 LEU HDx% H 1 0.806 0.003 A 34 LEU HDy% H 1 0.847 0.008 A 34 LEU HG H 1 1.863 0.004 A 34 LEU C C 13 179.146 . A 34 LEU CA C 13 58.235 0.091 A 34 LEU CB C 13 41.738 0.071 A 34 LEU CDx C 13 22.984 0.036 A 34 LEU CDy C 13 26.988 0.086 A 34 LEU CG C 13 27.238 0.073 A 34 LEU N N 15 121.324 0.069 A 35 ARG H H 1 9.035 0.004 A 35 ARG HA H 1 3.904 0.006 A 35 ARG HB2 H 1 1.909 0.003 A 35 ARG HD2 H 1 3.145 0.008 A 35 ARG HGx H 1 1.618 0.007 A 35 ARG HGy H 1 1.897 0.007 A 35 ARG C C 13 179.069 . A 35 ARG CA C 13 60.323 0.064 A 35 ARG CB C 13 29.834 0.09 A 35 ARG CD C 13 43.573 0.095 A 35 ARG CG C 13 28.802 0.085 A 35 ARG N N 15 118.421 0.043 A 36 GLN H H 1 7.687 0.004 A 36 GLN HA H 1 4.100 0.006 A 36 GLN HB2 H 1 2.217 0.005 A 36 GLN HE21 H 1 7.774 0.001 A 36 GLN HE22 H 1 6.865 0.002 A 36 GLN HGy H 1 2.492 0.011 A 36 GLN HGx H 1 2.437 0.012 A 36 GLN C C 13 178.257 . A 36 GLN CA C 13 58.449 0.066 A 36 GLN CB C 13 27.745 0.048 A 36 GLN CG C 13 33.443 0.028 A 36 GLN N N 15 118.527 0.044 A 36 GLN NE2 N 15 112.251 0.024 A 37 ARG H H 1 7.932 0.002 A 37 ARG HBx H 1 1.969 0.009 A 37 ARG HBy H 1 2.093 0.0 A 37 ARG HDx H 1 3.156 . A 37 ARG HDy H 1 3.247 0.002 A 37 ARG HG2 H 1 1.671 0.0 A 37 ARG C C 13 179.119 . A 37 ARG CA C 13 59.525 0.009 A 37 ARG CB C 13 30.105 0.069 A 37 ARG N N 15 119.626 0.058 A 38 LEU H H 1 8.013 0.004 A 38 LEU HA H 1 4.046 0.01 A 38 LEU HBx H 1 1.689 0.01 A 38 LEU HBy H 1 1.816 0.008 A 38 LEU HDx% H 1 0.914 0.01 A 38 LEU HDy% H 1 0.849 0.009 A 38 LEU HG H 1 1.668 0.004 A 38 LEU C C 13 179.119 . A 38 LEU CA C 13 57.915 0.07 A 38 LEU CB C 13 41.983 0.06 A 38 LEU CDy C 13 25.728 0.139 A 38 LEU CDx C 13 24.563 0.188 A 38 LEU CG C 13 27.204 0.097 A 38 LEU N N 15 120.091 0.084 A 39 VAL H H 1 8.009 0.004 A 39 VAL HA H 1 3.791 0.003 A 39 VAL HB H 1 2.236 0.006 A 39 VAL HGx% H 1 1.069 0.003 A 39 VAL HGy% H 1 0.959 0.005 A 39 VAL C C 13 179.289 . A 39 VAL CA C 13 65.663 0.066 A 39 VAL CB C 13 31.894 0.074 A 39 VAL CGy C 13 22.498 0.022 A 39 VAL CGx C 13 21.117 0.017 A 39 VAL N N 15 120.640 0.069 A 40 GLU H H 1 8.135 0.005 A 40 GLU HA H 1 4.078 0.005 A 40 GLU HB2 H 1 2.112 0.002 A 40 GLU HGy H 1 2.496 0.006 A 40 GLU HGx H 1 2.313 0.002 A 40 GLU C C 13 177.780 . A 40 GLU CA C 13 58.374 0.03 A 40 GLU CB C 13 29.631 0.079 A 40 GLU CG C 13 36.611 0.023 A 40 GLU N N 15 120.530 0.052 A 41 ARG H H 1 7.823 0.003 A 41 ARG HA H 1 4.288 0.002 A 41 ARG HBy H 1 2.067 0.006 A 41 ARG HBx H 1 1.939 0.005 A 41 ARG HDy H 1 3.209 0.002 A 41 ARG HDx H 1 3.145 0.008 A 41 ARG HG2 H 1 1.827 0.004 A 41 ARG C C 13 177.236 . A 41 ARG CA C 13 57.210 0.042 A 41 ARG CB C 13 31.180 0.048 A 41 ARG CD C 13 44.166 0.011 A 41 ARG CG C 13 26.951 0.008 A 41 ARG N N 15 118.603 0.04 A 42 GLY H H 1 7.937 0.003 A 42 GLY HAy H 1 4.134 0.002 A 42 GLY HAx H 1 3.910 0.007 A 42 GLY C C 13 174.026 . A 42 GLY CA C 13 45.399 0.044 A 42 GLY N N 15 107.280 0.034 A 43 ASP H H 1 8.243 0.003 A 43 ASP HA H 1 4.690 0.003 A 43 ASP HBy H 1 2.722 0.002 A 43 ASP HBx H 1 2.524 0.002 A 43 ASP C C 13 174.801 0.028 A 43 ASP CA C 13 54.198 0.026 A 43 ASP CB C 13 41.574 0.044 A 43 ASP N N 15 120.970 0.03 A 44 ALA H H 1 7.823 0.001 A 44 ALA HA H 1 4.093 . A 44 ALA HB% H 1 1.321 0.002 A 44 ALA CA C 13 53.914 0.024 A 44 ALA CB C 13 20.372 0.091 A 44 ALA N N 15 128.916 0.022 B 96 PRO HA H 1 4.474 0.006 B 96 PRO HBx H 1 1.944 0.004 B 96 PRO HBy H 1 2.311 0.008 B 96 PRO HD2 H 1 3.574 0.004 B 96 PRO HG2 H 1 2.009 0.001 B 96 PRO C C 13 177.060 . B 96 PRO CA C 13 63.097 0.011 B 96 PRO CB C 13 32.338 0.02 B 96 PRO CD C 13 49.725 0.067 B 96 PRO CG C 13 27.090 0.039 B 97 LEU H H 1 8.588 0.003 B 97 LEU HA H 1 4.351 0.006 B 97 LEU HBx H 1 1.605 0.007 B 97 LEU HBy H 1 1.671 0.005 B 97 LEU HDx% H 1 0.884 0.001 B 97 LEU HDy% H 1 0.936 0.008 B 97 LEU HG H 1 1.663 0.004 B 97 LEU C C 13 177.972 . B 97 LEU CA C 13 55.424 0.013 B 97 LEU CB C 13 42.237 0.089 B 97 LEU CDx C 13 23.472 0.013 B 97 LEU CDy C 13 24.827 . B 97 LEU CG C 13 27.012 . B 97 LEU N N 15 122.611 0.041 B 98 GLY H H 1 8.462 0.003 B 98 GLY HA2 H 1 3.987 . B 98 GLY C C 13 174.207 . B 98 GLY CA C 13 45.317 0.016 B 98 GLY N N 15 110.190 0.074 B 99 SER H H 1 8.249 0.002 B 99 SER HA H 1 4.511 . B 99 SER HB2 H 1 3.875 . B 99 SER C C 13 174.673 . B 99 SER CA C 13 58.225 0.029 B 99 SER CB C 13 64.009 0.031 B 99 SER N N 15 115.645 0.054 B 100 SER H H 1 8.484 0.003 B 100 SER HA H 1 4.517 0.002 B 100 SER HB2 H 1 3.901 . B 100 SER C C 13 174.603 . B 100 SER CA C 13 58.571 . B 100 SER CB C 13 63.894 0.002 B 100 SER N N 15 118.319 0.062 B 101 VAL H H 1 8.226 0.002 B 101 VAL HA H 1 4.134 0.007 B 101 VAL HB H 1 2.084 0.003 B 101 VAL HG1% H 1 0.939 0.003 B 101 VAL C C 13 176.549 . B 101 VAL CA C 13 62.666 0.038 B 101 VAL CB C 13 32.710 0.073 B 101 VAL CG1 C 13 21.114 0.052 B 101 VAL N N 15 121.772 0.072 B 102 SER H H 1 8.551 0.003 B 102 SER HA H 1 4.425 0.001 B 102 SER HBy H 1 4.113 0.006 B 102 SER HBx H 1 3.937 0.007 B 102 SER C C 13 175.287 . B 102 SER CA C 13 58.666 0.015 B 102 SER CB C 13 63.952 0.041 B 102 SER N N 15 120.099 0.035 B 103 GLU H H 1 8.611 0.003 B 103 GLU HA H 1 4.093 0.01 B 103 GLU HB2 H 1 2.079 0.002 B 103 GLU HGy H 1 2.374 0.007 B 103 GLU HGx H 1 2.269 0.006 B 103 GLU CA C 13 58.841 . B 103 GLU CB C 13 29.234 0.023 B 103 GLU CG C 13 36.297 0.027 B 103 GLU N N 15 123.432 0.059 B 104 LEU H H 1 8.223 0.006 B 104 LEU HA H 1 3.884 0.003 B 104 LEU HBy H 1 1.678 0.005 B 104 LEU HBx H 1 1.543 0.012 B 104 LEU HDx% H 1 0.708 0.005 B 104 LEU HDy% H 1 0.863 0.006 B 104 LEU HG H 1 1.508 0.009 B 104 LEU C C 13 178.013 . B 104 LEU CA C 13 57.898 0.096 B 104 LEU CB C 13 41.200 0.02 B 104 LEU CDx C 13 22.788 0.027 B 104 LEU CDy C 13 25.810 0.056 B 104 LEU CG C 13 27.220 0.178 B 104 LEU N N 15 121.613 0.049 B 105 GLU H H 1 8.126 0.004 B 105 GLU HA H 1 3.914 0.005 B 105 GLU HBy H 1 2.158 0.004 B 105 GLU HBx H 1 1.997 0.003 B 105 GLU HGy H 1 2.328 0.007 B 105 GLU HGx H 1 2.217 0.009 B 105 GLU CA C 13 59.643 0.094 B 105 GLU CB C 13 29.291 0.081 B 105 GLU CG C 13 36.481 0.061 B 105 GLU N N 15 118.901 0.049 B 106 GLN H H 1 8.022 0.007 B 106 GLN HA H 1 3.911 0.006 B 106 GLN HB2 H 1 2.168 0.004 B 106 GLN HE21 H 1 7.656 0.001 B 106 GLN HE22 H 1 6.907 0.002 B 106 GLN HG2 H 1 2.387 0.005 B 106 GLN CA C 13 58.734 0.078 B 106 GLN CB C 13 28.539 0.115 B 106 GLN CG C 13 33.716 0.03 B 106 GLN N N 15 119.207 0.062 B 106 GLN NE2 N 15 114.532 0.024 B 107 ARG H H 1 8.169 0.007 B 107 ARG HA H 1 4.238 0.009 B 107 ARG HB2 H 1 1.781 0.008 B 107 ARG HDy H 1 3.006 0.009 B 107 ARG HDx H 1 2.650 . B 107 ARG HG2 H 1 1.658 0.005 B 107 ARG C C 13 179.328 . B 107 ARG CA C 13 59.562 0.078 B 107 ARG CB C 13 30.081 0.017 B 107 ARG CD C 13 43.477 0.021 B 107 ARG CG C 13 28.288 0.042 B 107 ARG N N 15 120.005 0.077 B 108 LEU H H 1 8.587 0.004 B 108 LEU HA H 1 4.277 0.005 B 108 LEU HBx H 1 1.676 0.006 B 108 LEU HBy H 1 1.813 0.005 B 108 LEU HDx% H 1 0.939 0.01 B 108 LEU HDy% H 1 0.953 0.007 B 108 LEU HG H 1 1.647 0.008 B 108 LEU CA C 13 57.895 0.127 B 108 LEU CB C 13 42.042 0.064 B 108 LEU CDy C 13 24.686 0.109 B 108 LEU CDx C 13 24.612 0.033 B 108 LEU CG C 13 27.902 0.051 B 108 LEU N N 15 120.709 0.049 B 109 ARG H H 1 7.933 0.003 B 109 ARG HA H 1 3.942 0.006 B 109 ARG HB2 H 1 1.976 0.007 B 109 ARG HGx H 1 1.620 0.008 B 109 ARG HGy H 1 1.862 0.004 B 109 ARG C C 13 179.129 . B 109 ARG CA C 13 59.730 0.022 B 109 ARG CB C 13 30.105 0.042 B 109 ARG CG C 13 27.537 0.07 B 109 ARG N N 15 119.694 0.037 B 110 ASP H H 1 8.263 0.003 B 110 ASP HA H 1 4.527 0.002 B 110 ASP HBy H 1 2.925 0.006 B 110 ASP HBx H 1 2.815 0.004 B 110 ASP C C 13 179.458 . B 110 ASP CA C 13 57.900 0.085 B 110 ASP CB C 13 40.637 0.053 B 110 ASP N N 15 119.274 0.03 B 111 VAL H H 1 8.488 0.003 B 111 VAL HA H 1 4.106 0.004 B 111 VAL HB H 1 2.186 0.007 B 111 VAL HG1% H 1 1.202 0.003 B 111 VAL C C 13 179.256 . B 111 VAL CA C 13 65.618 0.056 B 111 VAL CB C 13 31.647 0.034 B 111 VAL CG1 C 13 22.924 0.028 B 111 VAL N N 15 117.815 0.028 B 112 LYS H H 1 8.395 0.003 B 112 LYS HA H 1 4.079 0.009 B 112 LYS HBy H 1 1.995 0.008 B 112 LYS HBx H 1 1.947 0.012 B 112 LYS HDy H 1 1.695 0.005 B 112 LYS HDx H 1 1.626 0.009 B 112 LYS HEx H 1 2.843 0.003 B 112 LYS HEy H 1 2.944 0.002 B 112 LYS HGy H 1 1.625 0.006 B 112 LYS HGx H 1 1.468 0.01 B 112 LYS C C 13 178.794 . B 112 LYS CA C 13 59.915 0.034 B 112 LYS CB C 13 32.365 0.081 B 112 LYS CD C 13 29.503 0.138 B 112 LYS CE C 13 42.004 0.035 B 112 LYS CG C 13 26.283 0.124 B 112 LYS N N 15 124.870 0.033 B 113 ASN H H 1 8.257 0.004 B 113 ASN HA H 1 4.534 0.005 B 113 ASN HBx H 1 2.912 0.006 B 113 ASN HBy H 1 3.058 0.003 B 113 ASN HD21 H 1 6.944 0.001 B 113 ASN HD22 H 1 7.938 0.003 B 113 ASN C C 13 178.690 . B 113 ASN CA C 13 56.308 0.053 B 113 ASN CB C 13 37.715 0.041 B 113 ASN N N 15 120.456 0.061 B 113 ASN ND2 N 15 113.029 0.028 B 114 THR H H 1 8.427 0.006 B 114 THR HA H 1 3.539 0.003 B 114 THR HB H 1 3.948 0.003 B 114 THR HG2% H 1 0.583 0.003 B 114 THR C C 13 174.362 . B 114 THR CA C 13 66.588 0.056 B 114 THR CB C 13 68.382 . B 114 THR CG2 C 13 22.444 0.051 B 114 THR N N 15 119.357 0.069 B 115 ASN H H 1 8.158 0.007 B 115 ASN HA H 1 4.333 0.008 B 115 ASN HBy H 1 3.383 0.001 B 115 ASN HBx H 1 2.871 0.004 B 115 ASN HD21 H 1 6.244 0.004 B 115 ASN HD22 H 1 7.890 0.01 B 115 ASN C C 13 177.222 . B 115 ASN CA C 13 58.914 0.036 B 115 ASN CB C 13 41.135 . B 115 ASN N N 15 121.552 0.048 B 115 ASN ND2 N 15 105.414 0.047 B 116 SER H H 1 8.296 0.004 B 116 SER HA H 1 4.182 0.001 B 116 SER HBx H 1 4.056 0.009 B 116 SER HBy H 1 4.093 0.011 B 116 SER C C 13 177.185 . B 116 SER CA C 13 61.807 0.102 B 116 SER CB C 13 62.727 0.024 B 116 SER N N 15 113.631 0.039 B 117 ARG H H 1 7.984 0.003 B 117 ARG HA H 1 4.104 0.002 B 117 ARG HB2 H 1 1.918 0.003 B 117 ARG HD2 H 1 3.193 0.001 B 117 ARG HGx H 1 1.581 0.005 B 117 ARG HGy H 1 1.800 0.003 B 117 ARG C C 13 180.119 . B 117 ARG CA C 13 59.832 0.027 B 117 ARG CB C 13 30.018 0.036 B 117 ARG CG C 13 27.793 0.015 B 117 ARG N N 15 122.895 0.031 B 118 PHE H H 1 8.981 0.003 B 118 PHE HA H 1 4.720 0.005 B 118 PHE HBy H 1 3.341 0.002 B 118 PHE HBx H 1 3.111 0.001 B 118 PHE HD1 H 1 7.078 0.006 B 118 PHE HD2 H 1 7.078 0.006 B 118 PHE HE1 H 1 7.310 0.005 B 118 PHE HE2 H 1 7.310 0.005 B 118 PHE HZ H 1 7.200 0.003 B 118 PHE C C 13 178.376 . B 118 PHE CA C 13 58.016 . B 118 PHE CB C 13 38.433 0.131 B 118 PHE N N 15 120.713 0.075 B 119 ARG H H 1 8.766 0.003 B 119 ARG HA H 1 3.990 0.004 B 119 ARG HB2 H 1 1.954 0.008 B 119 ARG HG2 H 1 1.615 . B 119 ARG C C 13 179.494 . B 119 ARG CA C 13 60.785 0.069 B 119 ARG CB C 13 29.921 0.083 B 119 ARG CD C 13 43.557 . B 119 ARG N N 15 120.303 0.031 B 120 LYS H H 1 7.822 0.003 B 120 LYS HA H 1 4.165 0.002 B 120 LYS HB2 H 1 1.978 0.004 B 120 LYS HD2 H 1 1.720 0.006 B 120 LYS HE2 H 1 2.978 0.001 B 120 LYS HGx H 1 1.441 0.001 B 120 LYS HGy H 1 1.565 . B 120 LYS C C 13 178.427 . B 120 LYS CA C 13 59.591 0.056 B 120 LYS CB C 13 32.584 0.041 B 120 LYS CD C 13 29.800 . B 120 LYS CE C 13 42.200 0.003 B 120 LYS N N 15 120.290 0.074 B 121 ALA H H 1 8.275 0.003 B 121 ALA HA H 1 4.289 0.002 B 121 ALA HB% H 1 1.619 0.004 B 121 ALA C C 13 180.288 . B 121 ALA CA C 13 55.037 0.046 B 121 ALA CB C 13 18.291 0.041 B 121 ALA N N 15 122.508 0.038 B 122 LEU H H 1 8.670 0.004 B 122 LEU HA H 1 3.970 0.01 B 122 LEU HBy H 1 1.985 0.004 B 122 LEU HBx H 1 1.578 0.014 B 122 LEU HDx% H 1 0.917 0.012 B 122 LEU HDy% H 1 0.945 0.008 B 122 LEU HG H 1 1.662 0.003 B 122 LEU C C 13 178.305 . B 122 LEU CA C 13 58.565 0.059 B 122 LEU CB C 13 41.465 0.083 B 122 LEU CDx C 13 24.160 0.025 B 122 LEU CDy C 13 26.436 0.059 B 122 LEU N N 15 118.869 0.034 B 123 MET H H 1 7.595 0.004 B 123 MET HA H 1 4.210 0.01 B 123 MET HB2 H 1 2.285 0.002 B 123 MET HGx H 1 2.608 0.003 B 123 MET HGy H 1 2.762 0.005 B 123 MET CA C 13 58.684 0.073 B 123 MET CB C 13 32.393 0.055 B 123 MET CG C 13 31.852 0.065 B 123 MET N N 15 118.202 0.04 B 124 GLU H H 1 8.175 0.004 B 124 GLU HA H 1 4.117 0.008 B 124 GLU HBx H 1 2.137 0.013 B 124 GLU HBy H 1 2.300 0.004 B 124 GLU HGy H 1 2.542 0.008 B 124 GLU HGx H 1 2.287 0.006 B 124 GLU C C 13 180.572 . B 124 GLU CA C 13 59.445 0.044 B 124 GLU CB C 13 29.361 0.066 B 124 GLU CG C 13 36.476 0.058 B 124 GLU N N 15 119.657 0.028 B 125 LYS H H 1 8.615 0.002 B 125 LYS HA H 1 4.267 0.006 B 125 LYS HBx H 1 1.686 0.009 B 125 LYS HBy H 1 2.125 0.011 B 125 LYS HDx H 1 1.526 0.005 B 125 LYS HDy H 1 1.723 0.006 B 125 LYS HEx H 1 2.903 0.015 B 125 LYS HEy H 1 2.989 0.006 B 125 LYS HGy H 1 1.822 0.006 B 125 LYS HGx H 1 1.567 0.008 B 125 LYS CA C 13 57.925 0.041 B 125 LYS CB C 13 31.782 0.102 B 125 LYS CD C 13 28.003 0.102 B 125 LYS CE C 13 42.363 0.037 B 125 LYS CG C 13 25.212 0.056 B 125 LYS N N 15 119.993 0.039 B 126 GLU H H 1 8.668 0.003 B 126 GLU HA H 1 4.295 0.002 B 126 GLU HB2 H 1 2.134 0.001 B 126 GLU HGy H 1 2.342 0.005 B 126 GLU HGx H 1 2.308 0.005 B 126 GLU CA C 13 59.191 0.075 B 126 GLU CB C 13 29.092 0.067 B 126 GLU CG C 13 35.079 0.03 B 126 GLU N N 15 120.958 0.05 B 127 ASN H H 1 8.102 0.002 B 127 ASN HA H 1 4.472 0.004 B 127 ASN HBx H 1 2.858 0.004 B 127 ASN HBy H 1 2.983 0.002 B 127 ASN HD21 H 1 7.720 0.004 B 127 ASN HD22 H 1 6.909 0.001 B 127 ASN C C 13 178.418 . B 127 ASN CA C 13 56.218 0.093 B 127 ASN CB C 13 37.806 0.058 B 127 ASN N N 15 117.921 0.053 B 127 ASN ND2 N 15 112.249 0.027 B 128 GLU H H 1 8.088 0.003 B 128 GLU HA H 1 4.078 0.004 B 128 GLU HBx H 1 2.176 0.006 B 128 GLU HBy H 1 2.406 0.003 B 128 GLU HG2 H 1 2.133 0.005 B 128 GLU C C 13 178.451 . B 128 GLU CA C 13 59.561 0.015 B 128 GLU CB C 13 29.886 0.042 B 128 GLU CG C 13 36.005 0.041 B 128 GLU N N 15 123.328 0.038 B 129 LEU H H 1 8.659 0.005 B 129 LEU HA H 1 3.988 0.004 B 129 LEU HBy H 1 2.111 0.003 B 129 LEU HBx H 1 1.574 0.013 B 129 LEU HDx% H 1 0.923 0.005 B 129 LEU HDy% H 1 0.965 0.011 B 129 LEU C C 13 178.368 . B 129 LEU CA C 13 58.796 0.111 B 129 LEU CB C 13 41.863 0.115 B 129 LEU CDx C 13 24.473 0.022 B 129 LEU CDy C 13 26.583 0.048 B 129 LEU N N 15 120.966 0.054 B 130 GLN H H 1 8.581 0.002 B 130 GLN HA H 1 3.969 0.007 B 130 GLN HBy H 1 2.169 0.02 B 130 GLN HBx H 1 2.130 0.01 B 130 GLN HE21 H 1 6.800 0.003 B 130 GLN HE22 H 1 7.778 0.001 B 130 GLN HG2 H 1 2.615 0.004 B 130 GLN C C 13 179.146 . B 130 GLN CA C 13 58.572 . B 130 GLN CB C 13 27.668 0.041 B 130 GLN CG C 13 33.462 0.004 B 130 GLN N N 15 116.012 0.025 B 130 GLN NE2 N 15 113.100 0.053 B 131 ALA H H 1 7.834 0.003 B 131 ALA HA H 1 4.108 0.003 B 131 ALA HB% H 1 1.542 0.004 B 131 ALA C C 13 180.847 . B 131 ALA CA C 13 55.172 0.062 B 131 ALA CB C 13 17.904 0.049 B 131 ALA N N 15 121.636 0.03 B 132 LEU H H 1 7.904 0.005 B 132 LEU HA H 1 4.060 0.005 B 132 LEU HBx H 1 1.361 0.007 B 132 LEU HBy H 1 2.152 0.011 B 132 LEU HDx% H 1 1.011 0.006 B 132 LEU HDy% H 1 0.846 0.007 B 132 LEU HG H 1 1.914 0.006 B 132 LEU C C 13 178.714 . B 132 LEU CA C 13 58.179 0.081 B 132 LEU CB C 13 42.773 0.066 B 132 LEU CDy C 13 28.091 0.029 B 132 LEU CDx C 13 23.962 0.029 B 132 LEU CG C 13 27.277 0.07 B 132 LEU N N 15 120.725 0.057 B 133 ILE H H 1 8.434 0.005 B 133 ILE HA H 1 3.612 0.007 B 133 ILE HB H 1 1.880 0.018 B 133 ILE HD1% H 1 0.793 0.007 B 133 ILE HG1y H 1 1.728 0.006 B 133 ILE HG1x H 1 1.038 0.008 B 133 ILE HG2% H 1 0.862 0.006 B 133 ILE C C 13 179.803 . B 133 ILE CA C 13 65.371 0.089 B 133 ILE CB C 13 38.043 0.056 B 133 ILE CD1 C 13 13.507 0.058 B 133 ILE CG1 C 13 29.896 0.038 B 133 ILE CG2 C 13 16.957 0.03 B 133 ILE N N 15 120.482 0.04 B 134 ARG H H 1 7.923 0.004 B 134 ARG HA H 1 4.065 0.008 B 134 ARG HB2 H 1 1.917 0.014 B 134 ARG HD2 H 1 3.216 0.004 B 134 ARG HGy H 1 1.842 0.006 B 134 ARG HGx H 1 1.616 0.008 B 134 ARG C C 13 178.552 . B 134 ARG CA C 13 59.227 0.029 B 134 ARG CB C 13 30.134 0.124 B 134 ARG CD C 13 43.648 0.087 B 134 ARG CG C 13 27.885 0.065 B 134 ARG N N 15 119.258 0.049 B 135 LYS H H 1 7.657 0.006 B 135 LYS HA H 1 4.099 0.006 B 135 LYS HB2 H 1 1.964 0.005 B 135 LYS HD2 H 1 1.692 0.002 B 135 LYS HE2 H 1 2.969 0.002 B 135 LYS HGx H 1 1.476 0.007 B 135 LYS HGy H 1 1.602 0.008 B 135 LYS CA C 13 58.536 0.068 B 135 LYS CB C 13 33.246 0.052 B 135 LYS CD C 13 29.426 0.069 B 135 LYS CE C 13 42.115 0.015 B 135 LYS CG C 13 25.458 0.064 B 135 LYS N N 15 118.968 0.043 B 136 LEU H H 1 8.157 0.003 B 136 LEU HA H 1 4.129 0.009 B 136 LEU HBy H 1 1.784 0.007 B 136 LEU HBx H 1 1.676 0.006 B 136 LEU HDx% H 1 0.842 0.009 B 136 LEU HDy% H 1 0.905 0.008 B 136 LEU HG H 1 1.668 0.003 B 136 LEU C C 13 178.289 0.001 B 136 LEU CA C 13 56.553 0.072 B 136 LEU CB C 13 43.058 0.027 B 136 LEU CDx C 13 24.062 0.077 B 136 LEU CDy C 13 26.037 0.09 B 136 LEU CG C 13 27.376 0.01 B 136 LEU N N 15 119.460 0.035 B 137 GLY H H 1 7.794 0.004 B 137 GLY HAy H 1 4.240 0.007 B 137 GLY HAx H 1 4.011 0.006 B 137 GLY CA C 13 44.552 0.089 B 137 GLY N N 15 107.027 0.04 B 138 PRO HA H 1 4.428 0.001 B 138 PRO HBy H 1 2.230 0.002 B 138 PRO HBx H 1 2.008 0.007 B 138 PRO HDy H 1 3.675 0.006 B 138 PRO HDx H 1 3.599 0.014 B 138 PRO HG2 H 1 2.010 0.001 B 138 PRO C C 13 176.614 . B 138 PRO CA C 13 63.274 0.06 B 138 PRO CB C 13 32.087 0.076 B 138 PRO CD C 13 49.754 0.058 B 138 PRO CG C 13 27.143 0.032 B 139 GLU H H 1 8.137 0.004 B 139 GLU HA H 1 4.070 0.004 B 139 GLU HBx H 1 1.888 0.006 B 139 GLU HBy H 1 2.033 0.008 B 139 GLU HG2 H 1 2.211 0.006 B 139 GLU CA C 13 58.375 0.013 B 139 GLU CB C 13 31.228 0.046 B 139 GLU CG C 13 36.973 0.043 B 139 GLU N N 15 126.574 0.066 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 B 113 ASN H B 111 VAL HG1% 1.0 1.757 6.000 2 1 B 111 VAL HG1% B 110 ASP H 1.0 1.757 6.000 3 2 A 25 THR HA A 25 THR HG2% 1.0 1.573 2.731 4 2 A 15 THR HA A 15 THR HG2% 1.0 1.573 2.731 5 3 A 25 THR HA A 28 GLU HBy 1.0 1.687 3.145 6 3 A 15 THR HA A 18 GLU HGx 1.0 1.687 3.145 7 4 A 13 LEU HBx A 13 LEU HDx% 1.0 1.725 3.311 8 4 A 13 LEU HBx A 13 LEU HDy% 1.0 1.725 3.311 9 5 A 38 LEU HG A 38 LEU HDy% 1.0 1.479 2.437 10 5 B 136 LEU HG B 136 LEU HDx% 1.0 1.479 2.437 11 6 A 23 LEU HG A 23 LEU HDx% 1.0 1.572 2.728 12 6 A 23 LEU HG A 23 LEU HDy% 1.0 1.572 2.728 13 7 A 38 LEU HA A 39 VAL H 1.0 1.693 3.175 14 7 A 38 LEU H A 38 LEU HA 1.0 1.693 3.175 15 8 A 36 GLN H A 36 GLN HA 1.0 1.604 2.836 16 8 B 135 LYS H B 135 LYS HA 1.0 1.604 2.836 17 9 A 40 GLU H A 40 GLU HA 1.0 1.536 2.610 18 9 B 139 GLU H B 139 GLU HA 1.0 1.536 2.610 19 10 A 30 LYS HBy A 30 LYS HA 1.0 1.698 3.196 20 10 B 112 LYS HBy B 112 LYS HA 1.0 1.698 3.196 21 11 A 27 LYS HA A 27 LYS HBy 1.0 1.575 2.737 22 11 A 27 LYS HA A 27 LYS HGy 1.0 1.575 2.737 23 12 B 124 GLU HA B 124 GLU HBx 1.0 1.538 2.616 24 12 A 26 GLN HA A 26 GLN HBy 1.0 1.538 2.616 25 13 A 11 GLN HA A 12 LYS H 1.0 1.767 3.503 26 13 A 14 VAL H A 11 GLN HA 1.0 1.767 3.503 27 14 B 124 GLU HBx B 124 GLU HGx 1.0 1.555 2.671 28 14 A 18 GLU HBy A 18 GLU HGy 1.0 1.555 2.671 29 15 A 18 GLU HGy A 18 GLU HBx 1.0 1.532 2.598 30 15 B 124 GLU HGx B 124 GLU HBy 1.0 1.532 2.598 31 16 A 33 VAL H A 32 ARG HA 1.0 1.782 3.576 32 16 A 36 GLN H A 35 ARG HA 1.0 1.782 3.576 33 17 A 35 ARG HDy A 31 ILE HG2% 1.0 1.628 2.920 34 17 A 35 ARG HDy B 132 LEU HDy% 1.0 1.628 2.920 35 18 B 124 GLU HBx B 124 GLU HBy 1.0 1.268 1.892 36 18 A 18 GLU HBy A 18 GLU HBx 1.0 1.268 1.892 37 19 B 112 LYS HBx B 112 LYS HGx 1.0 1.586 2.774 38 19 A 30 LYS HGy A 30 LYS HBx 1.0 1.586 2.774 39 19 A 30 LYS HBy A 30 LYS HGy 1.0 1.586 2.774 40 20 B 112 LYS HBy B 112 LYS HDx 1.0 1.546 2.642 41 20 B 112 LYS HBy B 112 LYS HGy 1.0 1.546 2.642 42 21 A 22 ARG HGx A 22 ARG HA 1.0 1.795 3.643 43 21 B 134 ARG HGx B 134 ARG HA 1.0 1.795 3.643 44 22 B 134 ARG HGx B 134 ARG HGy 1.0 1.330 2.038 45 22 A 22 ARG HGx A 22 ARG HGy 1.0 1.330 2.038 46 23 A 19 GLN HGx A 19 GLN HA 1.0 1.751 3.425 47 23 A 36 GLN HA A 36 GLN HGy 1.0 1.751 3.425 48 24 A 19 GLN HGx A 19 GLN HGy 1.0 1.180 1.696 49 24 A 36 GLN HGy A 36 GLN HGx 1.0 1.180 1.696 50 25 A 31 ILE HG2% A 28 GLU HA 1.0 1.782 3.578 51 25 B 134 ARG HA B 133 ILE HG2% 1.0 1.782 3.578 52 26 B 126 GLU HA B 126 GLU H 1.0 1.784 3.588 53 26 B 126 GLU HA B 129 LEU H 1.0 1.784 3.588 54 27 B 108 LEU HBx B 108 LEU HBy 1.0 1.389 2.191 55 27 A 38 LEU HBy A 38 LEU HBx 1.0 1.389 2.191 56 28 A 34 LEU HA A 34 LEU HBy 1.0 1.628 2.920 57 28 A 13 LEU HA A 13 LEU HBy 1.0 1.628 2.920 58 29 A 39 VAL HB A 39 VAL HGy% 1.0 1.494 2.484 59 29 A 33 VAL HB A 33 VAL HGx% 1.0 1.494 2.484 60 30 B 124 GLU HA B 124 GLU HBx 1.0 1.760 3.470 61 30 A 18 GLU HBy A 18 GLU HA 1.0 1.760 3.470 62 31 B 121 ALA HB% B 122 LEU HDx% 1.0 1.849 3.949 63 31 B 121 ALA HB% B 122 LEU HDy% 1.0 1.849 3.949 64 32 B 108 LEU HBx B 108 LEU HDx% 1.0 1.563 2.699 65 32 B 108 LEU HBx B 108 LEU HDy% 1.0 1.563 2.699 66 33 B 108 LEU HDy% B 108 LEU HG 1.0 1.424 2.282 67 33 B 108 LEU HDx% B 108 LEU HG 1.0 1.424 2.282 68 34 A 38 LEU HG A 38 LEU HDy% 1.0 1.445 2.341 69 34 A 38 LEU HDy% A 38 LEU HBx 1.0 1.445 2.341 70 35 B 104 LEU HDy% B 104 LEU HG 1.0 1.576 2.740 71 35 B 104 LEU HDy% B 104 LEU HBy 1.0 1.576 2.740 72 36 A 18 GLU HGx A 18 GLU HGy 1.0 1.294 1.952 73 36 B 124 GLU HGx B 124 GLU HGy 1.0 1.294 1.952 74 37 A 10 TYR HBy A 10 TYR H 1.0 1.776 3.548 75 37 A 11 GLN H A 10 TYR HBy 1.0 1.776 3.548 76 38 B 108 LEU HBy B 108 LEU HDy% 1.0 1.586 2.776 77 38 B 97 LEU HBy B 97 LEU HDy% 1.0 1.586 2.776 78 39 B 122 LEU HDy% B 122 LEU HBy 1.0 1.621 2.897 79 39 B 129 LEU HBx B 129 LEU HDy% 1.0 1.621 2.897 80 40 A 31 ILE HA A 31 ILE HB 1.0 1.783 3.579 81 40 A 34 LEU HBy A 31 ILE HA 1.0 1.783 3.579 82 41 B 97 LEU H B 97 LEU HG 1.0 1.964 4.958 83 41 B 97 LEU HBy B 97 LEU H 1.0 1.964 4.958 84 42 A 14 VAL H A 13 LEU H 1.0 1.706 3.224 85 42 A 12 LYS H A 13 LEU H 1.0 1.706 3.224 86 43 A 18 GLU HGx A 18 GLU H 1.0 1.632 2.938 87 43 A 18 GLU HBy A 18 GLU H 1.0 1.632 2.938 88 44 B 113 ASN H B 114 THR H 1.0 1.695 3.181 89 44 B 113 ASN H B 112 LYS H 1.0 1.695 3.181 90 45 A 18 GLU HA A 19 GLN H 1.0 1.624 2.910 91 45 A 19 GLN HA A 19 GLN H 1.0 1.624 2.910 92 46 B 108 LEU HDx% B 108 LEU H 1.0 1.800 3.666 93 46 B 108 LEU HDy% B 108 LEU H 1.0 1.800 3.666 94 47 B 131 ALA H B 130 GLN HBx 1.0 1.723 3.299 95 47 B 131 ALA H B 130 GLN HBy 1.0 1.723 3.299 96 48 B 106 GLN H B 107 ARG H 1.0 1.697 3.189 97 48 B 106 GLN H B 105 GLU H 1.0 1.697 3.189 98 49 A 9 ARG H A 9 ARG HA 1.0 1.656 3.024 99 49 A 14 VAL H A 13 LEU HA 1.0 1.656 3.024 100 50 B 134 ARG H B 134 ARG HB2 1.0 1.602 2.830 101 50 B 134 ARG H B 133 ILE HB 1.0 1.602 2.830 102 51 B 136 LEU HDx% B 137 GLY H 1.0 1.818 3.770 103 51 B 133 ILE HG2% B 137 GLY H 1.0 1.818 3.770 104 52 B 128 GLU H B 131 ALA HB% 1.0 1.891 4.239 105 52 B 129 LEU HBx B 128 GLU H 1.0 1.891 4.239 106 53 A 14 VAL HB A 14 VAL HGy% 1.0 1.547 2.647 107 54 B 111 VAL HG1% B 108 LEU HA 1.0 1.754 3.442 108 55 B 111 VAL HG1% B 111 VAL HA 1.0 1.755 3.443 109 56 B 111 VAL HG1% A 10 TYR HA 1.0 1.804 3.690 110 57 B 111 VAL HG1% B 111 VAL HB 1.0 1.518 2.552 111 58 A 14 VAL H A 14 VAL HA 1.0 1.716 3.270 112 59 A 39 VAL H A 39 VAL HGx% 1.0 1.488 2.466 113 60 A 40 GLU H A 39 VAL HGx% 1.0 1.722 6.000 114 61 A 33 VAL H A 33 VAL HGx% 1.0 1.724 6.000 115 62 B 101 VAL HA B 101 VAL HB 1.0 1.712 3.252 116 63 A 36 GLN HA A 39 VAL HGy% 1.0 1.701 3.207 117 64 B 111 VAL HG1% B 108 LEU HDy% 1.0 1.888 6.000 118 65 B 111 VAL HG1% A 13 LEU HBy 1.0 1.656 3.026 119 66 B 111 VAL HG1% A 13 LEU HDx% 1.0 1.535 2.609 120 67 B 111 VAL HG1% A 10 TYR HE1 1.0 1.570 2.720 121 67 B 111 VAL HG1% A 10 TYR HE2 1.0 1.570 2.720 122 68 B 111 VAL HG1% B 111 VAL H 1.0 1.550 2.656 123 69 B 111 VAL HG1% B 112 LYS H 1.0 1.641 2.971 124 70 B 111 VAL HG1% A 14 VAL H 1.0 1.751 3.425 125 71 B 111 VAL HG1% B 115 ASN HD21 1.0 1.723 3.299 126 72 B 111 VAL HG1% A 10 TYR HD2 1.0 1.592 2.792 127 72 B 111 VAL HG1% A 10 TYR HD1 1.0 1.592 2.792 128 73 B 111 VAL HG1% B 115 ASN HD22 1.0 1.787 3.601 129 74 A 25 THR H A 25 THR HB 1.0 1.672 3.088 130 75 A 25 THR HG2% A 26 GLN H 1.0 1.653 3.017 131 76 A 25 THR HG2% A 25 THR HB 1.0 1.589 2.783 132 77 A 15 THR HG2% A 15 THR HB 1.0 1.681 3.125 133 78 A 25 THR HA A 25 THR H 1.0 1.682 3.130 134 79 A 15 THR HA A 15 THR HB 1.0 1.751 3.423 135 80 A 15 THR HG2% A 18 GLU HGy 1.0 1.759 3.465 136 81 B 104 LEU HA B 104 LEU HBx 1.0 1.758 3.460 137 82 B 104 LEU HBy B 104 LEU HA 1.0 1.789 3.613 138 83 B 104 LEU HA B 104 LEU H 1.0 1.747 3.405 139 84 B 104 LEU HG B 104 LEU HDx% 1.0 1.526 2.580 140 85 B 104 LEU HDy% B 104 LEU HDx% 1.0 1.372 2.146 141 86 B 104 LEU HBx B 104 LEU HDx% 1.0 1.612 2.862 142 87 B 104 LEU HDx% A 7 GLU HBx 1.0 1.819 3.777 143 88 B 108 LEU HBy B 108 LEU HA 1.0 1.764 3.486 144 89 B 108 LEU HG B 108 LEU H 1.0 2.000 5.890 145 90 B 136 LEU HA B 136 LEU H 1.0 1.732 3.340 146 91 A 23 LEU HBx A 23 LEU HBy 1.0 1.613 2.867 147 92 A 23 LEU HBy A 23 LEU H 1.0 1.794 3.638 148 93 A 23 LEU HG A 23 LEU HDy% 1.0 1.527 2.581 149 94 A 23 LEU HDy% A 23 LEU HBy 1.0 1.596 6.000 150 95 A 23 LEU HDx% A 23 LEU HBy 1.0 1.586 2.776 151 96 B 122 LEU HBy B 122 LEU H 1.0 1.695 3.183 152 97 B 132 LEU HDy% B 132 LEU HA 1.0 1.642 2.972 153 98 A 38 LEU HG A 38 LEU H 1.0 1.723 3.297 154 99 B 108 LEU HDy% A 10 TYR HA 1.0 1.738 3.366 155 100 B 129 LEU HA B 129 LEU HDx% 1.0 1.663 3.055 156 101 B 122 LEU HDy% B 122 LEU HBx 1.0 1.603 2.833 157 102 A 34 LEU HG A 34 LEU HDy% 1.0 1.445 2.341 158 103 A 13 LEU HBy A 13 LEU H 1.0 1.821 3.789 159 104 A 34 LEU HA A 34 LEU H 1.0 1.748 3.416 160 105 B 111 VAL HG1% A 13 LEU HBx 1.0 1.765 3.497 161 106 A 13 LEU HDy% A 13 LEU HA 1.0 1.650 3.006 162 107 A 34 LEU HA A 34 LEU HDy% 1.0 1.819 3.771 163 108 B 111 VAL HG1% A 13 LEU HDy% 1.0 1.636 6.000 164 109 A 20 LEU H A 20 LEU HDx% 1.0 1.768 3.506 165 110 A 20 LEU H A 20 LEU HA 1.0 1.782 3.576 166 111 A 17 ASN H A 16 GLU HBy 1.0 1.829 3.835 167 112 A 20 LEU HDx% A 20 LEU HG 1.0 1.611 2.861 168 113 A 20 LEU HA A 20 LEU HDy% 1.0 1.709 3.241 169 114 A 20 LEU HG A 20 LEU HDy% 1.0 1.499 2.497 170 115 B 132 LEU H B 132 LEU HG 1.0 1.655 3.025 171 116 B 125 LYS H B 125 LYS HA 1.0 1.730 3.330 172 117 B 125 LYS H B 125 LYS HGx 1.0 1.784 3.590 173 118 B 125 LYS HDx B 125 LYS HEx 1.0 1.819 3.771 174 119 B 125 LYS HGy B 125 LYS HBy 1.0 1.730 3.334 175 120 A 27 LYS HGy A 27 LYS H 1.0 1.810 3.724 176 121 A 27 LYS H A 27 LYS HGx 1.0 1.805 3.701 177 122 B 112 LYS HBy B 112 LYS H 1.0 1.697 3.193 178 123 B 135 LYS H B 135 LYS HBy 1.0 1.612 2.862 179 124 A 30 LYS HBx A 30 LYS H 1.0 1.688 3.154 180 125 A 19 GLN HGx A 16 GLU HA 1.0 1.722 3.294 181 126 A 19 GLN H A 16 GLU HA 1.0 1.756 3.454 182 127 A 14 VAL HGy% A 14 VAL HGx% 1.0 1.388 2.186 183 128 B 111 VAL HG1% A 14 VAL HA 1.0 1.840 3.896 184 129 A 12 LYS H A 12 LYS HGy 1.0 1.826 3.818 185 130 A 12 LYS H A 12 LYS HGx 1.0 1.850 6.000 186 131 B 112 LYS HA B 112 LYS HDx 1.0 1.876 4.136 187 132 B 135 LYS HBy B 135 LYS HE2 1.0 1.717 3.275 188 133 A 4 LYS HB2 A 4 LYS HA 1.0 1.688 3.152 189 134 A 28 GLU HA A 31 ILE HB 1.0 1.500 2.502 190 135 A 30 LYS HA A 30 LYS HGx 1.0 1.636 2.952 191 136 A 26 GLN HA A 26 GLN HBx 1.0 1.510 2.530 192 137 A 11 GLN HA A 11 GLN H 1.0 1.754 3.438 193 138 A 11 GLN H A 11 GLN HGy 1.0 1.623 2.903 194 139 A 11 GLN HGy A 11 GLN HE21 1.0 1.707 6.000 195 140 A 12 LYS H A 11 GLN HGy 1.0 1.804 3.694 196 141 A 11 GLN HGy A 11 GLN HE22 1.0 1.625 2.909 197 142 A 21 GLN H A 21 GLN HA 1.0 1.722 3.296 198 143 A 21 GLN HBy A 22 ARG H 1.0 1.824 3.802 199 144 A 21 GLN HA A 21 GLN HBy 1.0 1.842 3.908 200 145 A 21 GLN HGx B 118 PHE HD1 1.0 1.723 3.301 201 145 A 21 GLN HGx B 118 PHE HD2 1.0 1.723 3.301 202 146 B 118 PHE HD1 A 21 GLN HGy 1.0 1.713 3.259 203 146 B 118 PHE HD2 A 21 GLN HGy 1.0 1.713 3.259 204 147 A 21 GLN H A 21 GLN HGy 1.0 1.788 3.608 205 148 A 21 GLN H A 21 GLN HGx 1.0 1.793 3.631 206 149 A 21 GLN HGy B 118 PHE HE1 1.0 1.843 3.911 207 149 A 21 GLN HGy B 118 PHE HE2 1.0 1.843 3.911 208 150 A 21 GLN HGx B 118 PHE HE1 1.0 1.842 3.910 209 150 A 21 GLN HGx B 118 PHE HE2 1.0 1.842 3.910 210 151 A 21 GLN HGy A 21 GLN HE21 1.0 1.880 4.164 211 152 A 21 GLN HA A 21 GLN HGy 1.0 1.880 4.158 212 153 A 21 GLN HA A 21 GLN HGx 1.0 1.907 4.367 213 154 A 21 GLN HBy A 21 GLN HGy 1.0 1.531 2.593 214 155 A 21 GLN HGx A 21 GLN HGy 1.0 1.284 1.930 215 156 A 19 GLN HA A 19 GLN H 1.0 1.662 3.048 216 157 A 20 LEU H A 19 GLN HBy 1.0 1.815 3.755 217 158 A 19 GLN HGx A 19 GLN HE22 1.0 1.866 4.058 218 159 A 19 GLN HGy A 19 GLN H 1.0 1.707 3.229 219 160 A 26 GLN HA A 26 GLN H 1.0 1.585 2.771 220 161 A 26 GLN HBy A 26 GLN HGx 1.0 1.773 3.531 221 162 A 26 GLN HBx A 26 GLN HGx 1.0 1.716 3.270 222 163 A 26 GLN HA A 26 GLN HGx 1.0 1.850 3.958 223 164 A 26 GLN HA A 26 GLN HGy 1.0 1.875 4.127 224 165 A 26 GLN HGx A 26 GLN HGy 1.0 1.416 2.262 225 166 A 26 GLN HBx A 26 GLN HGy 1.0 1.637 2.953 226 167 A 26 GLN H A 26 GLN HGx 1.0 1.693 3.175 227 168 A 26 GLN H A 26 GLN HGy 1.0 1.747 3.409 228 169 A 26 GLN HGx A 26 GLN HE22 1.0 1.856 3.994 229 170 B 130 GLN H B 130 GLN HGy 1.0 1.652 3.012 230 171 B 130 GLN HGy B 130 GLN HE21 1.0 1.790 3.620 231 172 B 106 GLN HE21 B 106 GLN HG2 1.0 1.628 2.920 232 173 B 106 GLN H B 106 GLN HG2 1.0 1.717 3.273 233 174 B 106 GLN HG2 B 106 GLN HE22 1.0 1.781 3.573 234 175 A 36 GLN H A 36 GLN HGx 1.0 1.798 3.660 235 176 A 36 GLN H A 36 GLN HGy 1.0 1.726 3.314 236 177 A 19 GLN HGx A 19 GLN HE21 1.0 1.865 4.057 237 178 A 19 GLN HGx A 20 LEU H 1.0 1.881 4.165 238 179 A 4 LYS HB2 A 4 LYS HEy 1.0 1.888 4.218 239 180 B 96 PRO HBx B 96 PRO HBy 1.0 1.336 2.054 240 181 B 123 MET H B 123 MET HGx 1.0 1.795 3.641 241 182 B 123 MET H B 123 MET HGy 1.0 1.769 3.513 242 183 B 121 ALA HB% B 121 ALA HA 1.0 1.709 3.237 243 184 B 121 ALA HB% B 121 ALA H 1.0 1.510 2.530 244 185 B 121 ALA HB% B 122 LEU H 1.0 1.652 3.010 245 186 B 131 ALA H B 131 ALA HB% 1.0 1.443 2.333 246 187 B 121 ALA HB% B 118 PHE HD2 1.0 1.799 3.661 247 187 B 121 ALA HB% B 118 PHE HD1 1.0 1.799 3.661 248 188 B 132 LEU HDy% B 131 ALA HB% 1.0 1.836 3.874 249 189 B 123 MET HGx B 123 MET HBy 1.0 1.572 6.000 250 190 B 123 MET HGx B 123 MET HGy 1.0 1.334 2.050 251 191 B 107 ARG H B 107 ARG HA 1.0 1.690 3.162 252 192 A 16 GLU H A 16 GLU HGy 1.0 1.827 3.821 253 193 A 16 GLU H A 16 GLU HGx 1.0 1.832 3.852 254 194 A 16 GLU HBy A 16 GLU HGx 1.0 1.609 6.000 255 195 A 16 GLU HGy A 16 GLU HGx 1.0 1.488 2.462 256 196 A 16 GLU HBy A 16 GLU HGy 1.0 1.669 3.075 257 197 A 18 GLU HGy A 18 GLU H 1.0 1.703 3.213 258 198 A 18 GLU HGx A 18 GLU H 1.0 1.733 3.343 259 199 A 18 GLU HBy A 19 GLN H 1.0 1.799 3.665 260 200 A 18 GLU HBx A 19 GLN H 1.0 1.731 3.333 261 201 A 28 GLU H A 28 GLU HGx 1.0 1.767 3.503 262 202 A 28 GLU HGy A 24 ILE HG2% 1.0 1.864 4.050 263 203 B 125 LYS HDx A 28 GLU HGx 1.0 1.846 3.934 264 204 A 28 GLU HBy A 28 GLU HBx 1.0 1.556 2.676 265 205 A 18 GLU HGy A 18 GLU HBx 1.0 1.517 2.549 266 206 A 29 GLU H A 29 GLU HA 1.0 1.713 3.259 267 207 A 29 GLU HA A 29 GLU HGx 1.0 1.773 3.533 268 208 B 124 GLU HBy B 124 GLU H 1.0 1.473 2.421 269 209 B 105 GLU H B 105 GLU HBy 1.0 1.680 3.118 270 210 A 26 GLN HA A 29 GLU HBy 1.0 1.576 2.740 271 211 B 105 GLU HGx B 105 GLU HA 1.0 1.822 3.796 272 212 B 124 GLU HA B 124 GLU H 1.0 1.883 4.187 273 213 B 124 GLU HGx B 124 GLU H 1.0 1.682 3.128 274 214 B 124 GLU HA B 124 GLU HGy 1.0 1.649 3.001 275 215 B 139 GLU HA B 139 GLU HBx 1.0 1.815 3.749 276 216 B 139 GLU HA B 139 GLU HBy 1.0 1.811 3.727 277 217 B 139 GLU HBy B 139 GLU HGy 1.0 1.431 2.301 278 218 B 139 GLU HBx B 139 GLU HBy 1.0 1.245 1.841 279 219 A 28 GLU HA A 28 GLU HGy 1.0 1.776 3.550 280 220 B 129 LEU H B 128 GLU HBy 1.0 1.767 3.503 281 221 B 128 GLU H B 128 GLU HBy 1.0 1.629 2.925 282 222 B 126 GLU H B 126 GLU HGx 1.0 1.853 3.979 283 223 A 29 GLU H A 29 GLU HBy 1.0 1.635 2.945 284 224 A 37 ARG HBx A 37 ARG H 1.0 1.550 2.656 285 225 B 109 ARG HGx B 109 ARG H 1.0 1.695 3.181 286 226 B 109 ARG H B 109 ARG HGy 1.0 1.762 3.478 287 227 A 22 ARG H A 22 ARG HBx 1.0 1.707 3.231 288 228 A 22 ARG H A 22 ARG HBy 1.0 1.717 3.273 289 229 A 35 ARG HA A 35 ARG H 1.0 1.736 3.356 290 230 A 38 LEU HDy% A 35 ARG HA 1.0 1.741 3.379 291 231 A 35 ARG HA A 35 ARG HGx 1.0 1.614 2.874 292 232 A 32 ARG HA A 32 ARG HGx 1.0 1.611 2.861 293 233 A 38 LEU HG A 35 ARG HA 1.0 1.752 3.432 294 234 A 35 ARG H A 35 ARG HGx 1.0 1.883 4.185 295 235 B 117 ARG HGx B 117 ARG HD2 1.0 1.610 2.856 296 236 A 32 ARG HGy A 32 ARG HDx 1.0 1.562 2.694 297 237 A 9 ARG H A 9 ARG HGx 1.0 1.759 3.467 298 238 A 33 VAL HGx% A 32 ARG HDy 1.0 1.715 3.265 299 239 B 109 ARG HGx B 109 ARG HA 1.0 1.847 3.941 300 240 B 111 VAL HG1% A 14 VAL HGx% 1.0 1.506 2.518 301 241 A 14 VAL HA A 14 VAL HGx% 1.0 1.625 2.911 302 242 B 111 VAL HB A 14 VAL HGx% 1.0 1.840 3.900 303 243 A 14 VAL HB A 14 VAL HGx% 1.0 1.544 2.636 304 244 A 13 LEU HBx A 14 VAL HGx% 1.0 1.766 6.000 305 245 A 14 VAL H A 14 VAL HGx% 1.0 1.544 2.634 306 246 A 14 VAL HGx% A 15 THR H 1.0 1.770 3.520 307 247 A 10 TYR HE1 A 14 VAL HGx% 1.0 1.670 3.080 308 247 A 10 TYR HE2 A 14 VAL HGx% 1.0 1.670 3.080 309 248 A 10 TYR HD2 A 14 VAL HGx% 1.0 1.799 3.667 310 248 A 10 TYR HD1 A 14 VAL HGx% 1.0 1.799 3.667 311 249 A 24 ILE HG1y A 24 ILE HG1x 1.0 1.788 3.606 312 250 B 114 THR HG2% B 114 THR HB 1.0 1.701 3.205 313 251 B 111 VAL HG1% B 114 THR HG2% 1.0 1.687 6.000 314 252 B 114 THR HG2% B 115 ASN H 1.0 1.786 3.594 315 253 B 115 ASN HD21 B 114 THR HG2% 1.0 1.804 3.688 316 254 B 118 PHE HE1 B 114 THR HG2% 1.0 1.627 2.917 317 254 B 118 PHE HE2 B 114 THR HG2% 1.0 1.627 2.917 318 255 B 114 THR HG2% B 118 PHE HZ 1.0 1.741 3.377 319 256 B 118 PHE HD1 B 114 THR HG2% 1.0 1.714 3.264 320 256 B 118 PHE HD2 B 114 THR HG2% 1.0 1.714 3.264 321 257 B 115 ASN HD22 B 114 THR HG2% 1.0 1.815 3.753 322 258 A 31 ILE HG2% A 31 ILE HG1x 1.0 1.786 3.596 323 259 B 104 LEU HDx% A 7 GLU HBy 1.0 1.832 3.852 324 260 B 108 LEU HBx B 104 LEU HDx% 1.0 1.779 3.561 325 261 A 24 ILE HG1x A 24 ILE HD1% 1.0 1.582 2.760 326 262 A 24 ILE HD1% A 24 ILE HB 1.0 1.585 2.769 327 263 B 121 ALA HB% A 24 ILE HD1% 1.0 1.547 2.645 328 264 B 133 ILE HD1% B 130 GLN HA 1.0 1.756 3.448 329 265 B 133 ILE HD1% B 133 ILE HA 1.0 1.814 3.744 330 266 B 133 ILE HD1% B 133 ILE HG1y 1.0 1.520 2.560 331 267 B 133 ILE HD1% B 133 ILE HG1x 1.0 1.512 2.534 332 268 B 133 ILE HD1% B 133 ILE H 1.0 1.745 3.399 333 269 A 13 LEU HDy% A 13 LEU HG 1.0 1.501 2.501 334 270 A 13 LEU HDy% B 112 LYS HGx 1.0 1.830 3.836 335 271 A 13 LEU HDy% A 13 LEU HBy 1.0 1.642 6.000 336 272 A 13 LEU HBx A 13 LEU HDy% 1.0 1.606 2.842 337 273 A 34 LEU HG A 34 LEU HDx% 1.0 1.521 2.563 338 274 A 34 LEU HDx% A 34 LEU HBx 1.0 1.664 6.000 339 275 B 108 LEU HDx% A 9 ARG HBy 1.0 1.738 3.364 340 276 A 23 LEU HDy% A 22 ARG HBx 1.0 1.758 3.460 341 277 A 13 LEU HDy% A 9 ARG HBy 1.0 1.790 6.000 342 278 A 37 ARG HBx A 37 ARG HDy 1.0 1.622 2.898 343 279 A 16 GLU HBy A 16 GLU HBx 1.0 1.442 2.332 344 280 A 17 ASN H A 16 GLU HBx 1.0 1.782 3.578 345 281 A 31 ILE HG1x A 31 ILE HD1% 1.0 1.656 3.026 346 282 A 28 GLU HA A 31 ILE HD1% 1.0 1.786 3.596 347 283 A 31 ILE HD1% B 128 GLU HBx 1.0 1.829 3.835 348 284 B 125 LYS HBy A 31 ILE HD1% 1.0 1.589 2.783 349 285 A 31 ILE HB A 31 ILE HD1% 1.0 1.573 2.729 350 286 A 31 ILE HD1% B 125 LYS HBx 1.0 1.650 6.000 351 287 B 125 LYS HGy A 31 ILE HD1% 1.0 1.611 6.000 352 288 A 31 ILE HA A 31 ILE HD1% 1.0 1.867 4.071 353 289 B 104 LEU HBy B 104 LEU HBx 1.0 1.574 2.734 354 290 B 112 LYS HGy B 108 LEU HDx% 1.0 1.730 3.330 355 291 B 125 LYS HEx B 125 LYS HBy 1.0 1.795 6.000 356 292 B 125 LYS HGx B 125 LYS HEx 1.0 1.776 3.550 357 293 B 132 LEU HDy% B 135 LYS HE2 1.0 1.630 2.928 358 294 B 120 LYS HEy B 116 SER HBy 1.0 1.768 3.506 359 295 B 108 LEU HDx% A 9 ARG HBx 1.0 1.803 3.689 360 296 A 13 LEU HDy% A 9 ARG HBx 1.0 1.796 6.000 361 297 B 125 LYS HGx B 125 LYS HEy 1.0 1.829 3.833 362 298 B 108 LEU HDx% B 112 LYS HEx 1.0 1.700 3.202 363 299 A 15 THR HG2% A 16 GLU HA 1.0 1.772 3.528 364 300 A 12 LYS HGx A 12 LYS HA 1.0 1.789 3.613 365 301 A 18 GLU HA A 19 GLN H 1.0 1.747 6.000 366 302 B 107 ARG HDy B 107 ARG HDx 1.0 1.525 2.577 367 303 B 107 ARG HDy B 107 ARG HB2 1.0 1.777 3.551 368 304 B 107 ARG HDy B 107 ARG HGy 1.0 1.716 3.270 369 305 B 113 ASN HBy B 113 ASN HBx 1.0 1.482 2.446 370 306 B 114 THR H B 113 ASN HBy 1.0 1.742 3.384 371 307 B 113 ASN H B 113 ASN HBy 1.0 1.623 2.905 372 308 B 135 LYS HA B 135 LYS HBy 1.0 1.593 6.000 373 309 B 135 LYS HA B 135 LYS HGy 1.0 1.753 3.435 374 310 A 30 LYS HBx A 31 ILE H 1.0 1.819 3.771 375 311 B 113 ASN H B 112 LYS HBy 1.0 1.633 2.941 376 312 B 134 ARG HGx B 134 ARG HGy 1.0 1.369 2.137 377 313 B 134 ARG HGy B 130 GLN HBx 1.0 1.730 3.330 378 314 B 108 LEU HG B 105 GLU HGx 1.0 1.806 3.706 379 315 B 117 ARG HGx B 117 ARG HGy 1.0 1.345 2.075 380 316 A 9 ARG HGx A 9 ARG HGy 1.0 1.371 2.141 381 317 B 108 LEU HBy B 105 GLU HGy 1.0 1.812 3.734 382 318 B 108 LEU HDy% B 105 GLU HGy 1.0 1.739 3.371 383 319 B 124 GLU HGy B 123 MET HGy 1.0 1.782 3.580 384 320 A 40 GLU HGy A 40 GLU HGx 1.0 1.328 2.034 385 321 A 22 ARG HGx A 22 ARG HBy 1.0 1.472 2.418 386 322 A 19 GLN HA A 22 ARG HBy 1.0 1.614 2.872 387 323 B 133 ILE HG1y B 136 LEU HDy% 1.0 1.669 3.077 388 324 B 132 LEU HDy% B 135 LYS HD2 1.0 1.575 2.737 389 325 B 108 LEU HDx% B 112 LYS HDy 1.0 1.620 2.894 390 326 B 112 LYS HDy B 112 LYS HEy 1.0 1.775 3.545 391 327 A 33 VAL HA A 33 VAL HGy% 1.0 1.624 2.906 392 328 A 33 VAL HGx% A 33 VAL HA 1.0 1.687 3.149 393 329 A 33 VAL HB A 33 VAL HA 1.0 1.703 3.213 394 330 A 34 LEU H A 33 VAL HA 1.0 1.837 3.881 395 331 A 33 VAL H A 33 VAL HA 1.0 1.671 3.083 396 332 A 19 GLN HGy A 19 GLN HBx 1.0 1.455 2.369 397 333 A 19 GLN HGx A 19 GLN HBy 1.0 1.533 2.601 398 334 A 19 GLN HA A 19 GLN HGy 1.0 1.770 3.518 399 335 A 19 GLN HGx A 19 GLN H 1.0 1.667 3.067 400 336 B 112 LYS HBx B 112 LYS HDx 1.0 1.465 2.397 401 337 B 128 GLU HBy A 31 ILE HD1% 1.0 1.763 3.483 402 338 B 135 LYS HGy B 135 LYS HGx 1.0 1.305 1.979 403 339 A 30 LYS HGx A 34 LEU HBx 1.0 1.825 3.809 404 340 A 27 LYS HGx A 27 LYS HBx 1.0 1.724 3.302 405 341 B 125 LYS HGx B 125 LYS HGy 1.0 1.581 2.757 406 342 A 24 ILE HG2% A 28 GLU HBx 1.0 1.746 3.404 407 343 B 133 ILE HG2% B 130 GLN HA 1.0 1.807 3.709 408 344 B 133 ILE HG2% B 133 ILE HB 1.0 1.456 2.370 409 345 B 133 ILE HG2% B 133 ILE HG1y 1.0 1.634 2.946 410 346 A 31 ILE HG2% A 35 ARG HGy 1.0 1.680 3.120 411 347 A 31 ILE HG2% A 31 ILE HD1% 1.0 1.313 1.999 412 348 A 31 ILE HG2% A 32 ARG H 1.0 1.746 3.404 413 349 B 133 ILE HG2% B 134 ARG H 1.0 1.724 3.306 414 350 B 138 PRO HBy B 138 PRO HBx 1.0 1.269 1.893 415 351 B 139 GLU HBy B 138 PRO HBx 1.0 1.806 3.704 416 352 A 36 GLN HA A 39 VAL HB 1.0 1.765 6.000 417 353 B 139 GLU H B 138 PRO HBx 1.0 1.644 2.978 418 354 B 104 LEU HDy% B 104 LEU HA 1.0 1.710 3.242 419 355 A 38 LEU HDy% A 38 LEU HBy 1.0 1.645 2.987 420 356 B 132 LEU HA B 135 LYS HGx 1.0 1.849 3.957 421 357 A 38 LEU HA A 38 LEU HBy 1.0 1.756 3.446 422 358 A 38 LEU HA A 38 LEU HBx 1.0 1.675 3.099 423 359 A 38 LEU HDy% A 38 LEU HA 1.0 1.543 6.000 424 360 B 132 LEU HA B 132 LEU H 1.0 1.776 3.546 425 361 B 138 PRO HBy B 138 PRO HDy 1.0 1.628 2.922 426 362 B 138 PRO HDy B 137 GLY HAy 1.0 1.829 3.829 427 363 B 137 GLY H B 138 PRO HDy 1.0 1.874 4.120 428 364 A 14 VAL HGy% A 15 THR HB 1.0 1.832 3.850 429 365 A 15 THR HB A 16 GLU H 1.0 1.750 3.422 430 366 A 23 LEU HG A 23 LEU HBx 1.0 1.527 2.583 431 367 B 125 LYS HDx B 125 LYS HDy 1.0 1.519 2.555 432 368 A 28 GLU HGy B 125 LYS HDy 1.0 1.752 3.432 433 369 B 129 LEU HDx% B 129 LEU HBy 1.0 1.656 3.026 434 370 B 125 LYS HGx B 125 LYS HDy 1.0 1.717 3.273 435 371 B 125 LYS HGx B 125 LYS HBy 1.0 1.801 3.673 436 372 A 36 GLN HGx A 33 VAL HGx% 1.0 1.794 3.640 437 373 A 33 VAL HB A 33 VAL HGx% 1.0 1.371 2.141 438 374 A 39 VAL HB A 40 GLU HGx 1.0 1.818 3.772 439 375 A 39 VAL H A 39 VAL HB 1.0 1.585 6.000 440 376 B 111 VAL HB B 111 VAL H 1.0 1.770 3.520 441 377 A 24 ILE HG2% A 24 ILE HG1y 1.0 1.702 3.212 442 378 A 25 THR HA A 24 ILE HG2% 1.0 1.833 3.851 443 379 B 125 LYS HEx A 24 ILE HG2% 1.0 1.809 3.719 444 380 A 28 GLU HGx A 24 ILE HG2% 1.0 1.724 3.304 445 381 A 28 GLU HBy A 24 ILE HG2% 1.0 1.994 6.412 446 382 A 24 ILE HG2% A 24 ILE HB 1.0 1.541 2.629 447 383 A 25 THR H A 24 ILE HG2% 1.0 1.739 3.369 448 384 B 125 LYS HDx A 31 ILE HD1% 1.0 1.754 3.440 449 385 B 125 LYS HDx A 24 ILE HG2% 1.0 1.808 3.712 450 386 B 125 LYS HDx A 28 GLU HGy 1.0 1.788 3.606 451 387 B 116 SER HBy B 116 SER HBx 1.0 1.524 2.572 452 388 B 122 LEU HBy B 122 LEU HA 1.0 1.689 3.157 453 389 A 34 LEU HA A 34 LEU HBx 1.0 1.822 3.788 454 390 B 129 LEU HBx B 129 LEU HBy 1.0 1.650 3.000 455 391 B 129 LEU H B 129 LEU HBy 1.0 1.740 3.376 456 392 B 112 LYS HDx B 108 LEU HDx% 1.0 1.823 3.793 457 393 A 13 LEU HDx% B 112 LYS HDx 1.0 1.766 3.498 458 394 A 30 LYS HGy A 30 LYS HGx 1.0 1.297 1.961 459 395 B 132 LEU HA B 132 LEU HBx 1.0 1.852 3.968 460 396 A 40 GLU HA A 39 VAL HGy% 1.0 1.734 3.350 461 397 A 23 LEU HDy% A 23 LEU HA 1.0 1.647 2.993 462 398 A 23 LEU H A 23 LEU HA 1.0 1.694 3.176 463 399 A 3 SER HBy A 3 SER HBx 1.0 1.361 2.117 464 400 A 3 SER HBy A 3 SER HA 1.0 1.770 3.518 465 401 A 34 LEU HBy A 34 LEU HBx 1.0 1.729 3.325 466 402 A 25 THR HA A 28 GLU HBy 1.0 1.793 3.631 467 403 B 137 GLY HAy B 137 GLY HAx 1.0 1.713 3.259 468 404 A 23 LEU HDx% A 26 GLN HBx 1.0 1.814 3.744 469 405 A 27 LYS H A 26 GLN HBx 1.0 1.832 3.852 470 406 B 106 GLN H B 106 GLN HBy 1.0 1.566 2.706 471 407 B 139 GLU H B 139 GLU HBx 1.0 1.787 3.605 472 408 A 33 VAL HGx% A 33 VAL HGy% 1.0 1.343 2.073 473 409 A 39 VAL HGy% A 39 VAL HGx% 1.0 1.284 1.930 474 410 A 38 LEU HDy% A 39 VAL HGx% 1.0 1.712 3.254 475 411 A 29 GLU HGx A 33 VAL HGy% 1.0 1.717 3.277 476 412 A 33 VAL HGy% A 32 ARG HB2 1.0 1.710 3.244 477 413 A 32 ARG HGy A 33 VAL HGy% 1.0 1.794 6.000 478 414 A 30 LYS HGy A 33 VAL HGy% 1.0 1.797 6.000 479 415 A 33 VAL HB A 33 VAL HGy% 1.0 1.487 2.463 480 416 A 36 GLN HA A 39 VAL HGx% 1.0 1.745 3.399 481 417 A 39 VAL HB A 39 VAL HGx% 1.0 1.475 2.425 482 418 A 34 LEU H A 33 VAL HGy% 1.0 1.777 3.555 483 419 A 33 VAL H A 33 VAL HGy% 1.0 1.506 2.518 484 420 A 33 VAL HGy% A 32 ARG H 1.0 1.803 3.685 485 421 A 23 LEU HBy A 27 LYS HDy 1.0 1.645 2.981 486 422 A 35 ARG HGy B 132 LEU HDx% 1.0 1.777 3.549 487 423 A 35 ARG HGx A 35 ARG HGy 1.0 1.548 2.648 488 424 A 35 ARG HA A 35 ARG HGy 1.0 1.727 3.319 489 425 B 109 ARG HGy B 109 ARG HA 1.0 1.726 3.316 490 426 B 105 GLU HA B 105 GLU HGy 1.0 1.821 3.781 491 427 B 105 GLU HA B 105 GLU HBx 1.0 1.714 3.262 492 428 B 112 LYS HBy B 109 ARG HA 1.0 1.596 2.808 493 429 B 108 LEU HBy B 105 GLU HA 1.0 1.731 3.333 494 430 B 124 GLU HBy B 121 ALA HB% 1.0 1.818 3.772 495 431 A 19 GLN HGx A 18 GLU H 1.0 1.829 3.831 496 432 A 21 GLN HA A 24 ILE HB 1.0 1.747 3.407 497 433 A 21 GLN HA A 24 ILE HD1% 1.0 1.733 3.345 498 434 A 21 GLN HA A 24 ILE H 1.0 1.882 4.172 499 435 A 11 GLN HGy A 11 GLN HB2 1.0 1.443 6.000 500 436 A 11 GLN HA A 11 GLN HGy 1.0 1.799 3.667 501 437 B 108 LEU HG B 108 LEU HA 1.0 1.796 3.650 502 438 A 41 ARG HA A 41 ARG HBx 1.0 1.765 3.495 503 439 B 108 LEU HDy% A 9 ARG HBx 1.0 1.712 3.248 504 440 B 108 LEU HDy% B 112 LYS HEy 1.0 1.751 3.429 505 441 B 135 LYS HA B 135 LYS HGx 1.0 1.794 3.642 506 442 B 132 LEU HDy% B 132 LEU HDx% 1.0 1.415 2.257 507 443 B 132 LEU HDx% B 132 LEU HBy 1.0 1.665 3.061 508 444 B 132 LEU HG B 132 LEU HDx% 1.0 1.598 2.816 509 445 B 132 LEU HBx B 132 LEU HDx% 1.0 1.695 3.183 510 446 A 14 VAL HB A 14 VAL HA 1.0 1.772 3.526 511 447 B 105 GLU HBy B 105 GLU HBx 1.0 1.398 2.212 512 448 A 42 GLY HAx A 42 GLY HAy 1.0 1.619 2.889 513 449 A 31 ILE HG2% A 35 ARG HGx 1.0 1.820 3.780 514 450 A 4 LYS HGy A 4 LYS HGx 1.0 1.219 1.781 515 451 B 133 ILE HA B 133 ILE HG1x 1.0 1.785 3.593 516 452 B 133 ILE HA B 133 ILE HG1y 1.0 1.730 3.330 517 453 B 133 ILE HG2% B 133 ILE HA 1.0 1.669 3.077 518 454 B 133 ILE HA B 133 ILE H 1.0 1.748 3.414 519 455 B 136 LEU HA B 136 LEU HBx 1.0 1.793 3.637 520 456 B 136 LEU HA B 136 LEU HBy 1.0 1.755 3.447 521 457 A 19 GLN HA A 19 GLN HBx 1.0 1.555 2.671 522 458 B 116 SER HBy B 116 SER H 1.0 1.798 3.658 523 459 A 24 ILE HG1y A 24 ILE HD1% 1.0 1.573 2.733 524 460 A 24 ILE HD1% A 24 ILE HA 1.0 1.803 6.000 525 461 A 24 ILE HD1% A 24 ILE H 1.0 1.664 3.054 526 462 B 118 PHE HD1 A 24 ILE HD1% 1.0 1.721 3.293 527 462 B 118 PHE HD2 A 24 ILE HD1% 1.0 1.721 3.293 528 463 B 106 GLN HG2 B 106 GLN HBy 1.0 1.362 6.000 529 464 B 107 ARG H B 106 GLN HG2 1.0 1.828 3.826 530 465 B 108 LEU HBx B 104 LEU HDy% 1.0 1.814 3.744 531 466 B 104 LEU HDy% B 104 LEU HBx 1.0 1.598 6.000 532 467 A 23 LEU HDy% A 23 LEU HBx 1.0 1.616 2.878 533 468 A 13 LEU HDx% A 13 LEU HBy 1.0 1.786 3.596 534 469 A 39 VAL HB A 39 VAL HA 1.0 1.769 3.515 535 470 A 39 VAL HGx% A 39 VAL HA 1.0 1.544 2.636 536 471 A 39 VAL HGy% A 39 VAL HA 1.0 1.677 3.107 537 472 A 42 GLY HAy A 39 VAL HA 1.0 1.827 3.819 538 473 A 39 VAL H A 39 VAL HA 1.0 1.662 3.052 539 474 A 40 GLU H A 39 VAL HA 1.0 1.800 3.672 540 475 A 43 ASP HBx A 43 ASP HBy 1.0 1.281 1.923 541 476 B 132 LEU HDy% B 132 LEU HBy 1.0 1.663 6.000 542 477 B 132 LEU HDy% B 132 LEU HBx 1.0 1.633 2.937 543 478 A 16 GLU HBy A 20 LEU HDy% 1.0 1.744 3.396 544 479 A 23 LEU HDy% A 22 ARG HBy 1.0 1.741 3.377 545 480 B 108 LEU HG B 112 LYS HEy 1.0 1.612 2.862 546 481 B 112 LYS HEx B 112 LYS HEy 1.0 1.189 1.717 547 482 B 129 LEU HDy% B 129 LEU HBy 1.0 1.662 3.050 548 483 B 129 LEU HBx B 129 LEU HDy% 1.0 1.469 2.409 549 484 A 23 LEU HG B 122 LEU HDy% 1.0 1.744 3.390 550 485 B 136 LEU HDy% B 132 LEU HBx 1.0 1.675 3.099 551 486 A 34 LEU HBy A 34 LEU HDy% 1.0 1.701 3.207 552 487 B 122 LEU HBx B 122 LEU HG 1.0 1.691 3.165 553 488 B 122 LEU HBy B 122 LEU HBx 1.0 1.640 2.966 554 489 A 27 LYS HBy A 27 LYS HBx 1.0 1.586 2.774 555 490 A 6 ASP HBy A 6 ASP HBx 1.0 1.722 3.296 556 491 B 110 ASP HBy B 110 ASP HBx 1.0 1.513 2.541 557 492 B 111 VAL H B 110 ASP HBx 1.0 1.790 3.616 558 493 B 110 ASP H B 110 ASP HBx 1.0 1.712 3.254 559 494 A 31 ILE HD1% A 31 ILE HG1y 1.0 1.744 3.394 560 495 A 31 ILE HG1x A 31 ILE HG1y 1.0 1.785 3.593 561 496 A 34 LEU HDy% A 34 LEU HBx 1.0 1.650 3.002 562 497 A 13 LEU HDx% A 13 LEU HG 1.0 1.598 2.812 563 498 A 30 LYS HGy A 34 LEU HDy% 1.0 1.775 3.543 564 499 A 38 LEU HG A 38 LEU HDx% 1.0 1.542 2.632 565 500 A 18 GLU HGy A 18 GLU HA 1.0 1.791 3.621 566 501 B 124 GLU HGx B 123 MET HGy 1.0 1.812 3.732 567 502 A 23 LEU HDx% A 27 LYS HDx 1.0 1.703 3.217 568 503 A 27 LYS HDy A 27 LYS HDx 1.0 1.460 2.384 569 504 A 19 GLN HBy A 19 GLN HBx 1.0 1.522 2.568 570 505 B 103 GLU HGy B 103 GLU HGx 1.0 1.253 1.857 571 506 B 103 GLU HGy B 103 GLU HA 1.0 1.800 3.670 572 507 A 38 LEU HA A 38 LEU HDx% 1.0 1.790 3.622 573 508 B 104 LEU HDy% B 105 GLU HA 1.0 1.842 3.906 574 509 A 20 LEU HDx% A 20 LEU HDy% 1.0 1.540 2.624 575 510 A 32 ARG HGx A 32 ARG HDy 1.0 1.484 2.454 576 511 B 125 LYS HA B 125 LYS HBy 1.0 1.801 3.679 577 512 B 108 LEU HA A 10 TYR HD2 1.0 1.790 3.616 578 512 B 108 LEU HA A 10 TYR HD1 1.0 1.790 3.616 579 513 A 13 LEU HBx A 13 LEU HBy 1.0 1.731 3.337 580 514 A 13 LEU HBx A 13 LEU HG 1.0 1.794 3.640 581 515 A 24 ILE HB A 24 ILE H 1.0 1.728 3.322 582 516 A 25 THR H A 24 ILE HB 1.0 1.774 3.536 583 517 B 132 LEU HG B 132 LEU HBy 1.0 1.744 3.394 584 518 B 111 VAL HB A 10 TYR HE1 1.0 1.827 3.825 585 518 B 111 VAL HB A 10 TYR HE2 1.0 1.827 3.825 586 519 B 133 ILE HG1x B 136 LEU HDy% 1.0 1.679 3.115 587 520 B 133 ILE HB B 133 ILE HG1x 1.0 1.776 3.548 588 521 B 133 ILE HG1y B 133 ILE HG1x 1.0 1.606 2.844 589 522 B 108 LEU HBy B 105 GLU HGx 1.0 1.820 3.778 590 523 B 108 LEU HDy% B 105 GLU HGx 1.0 1.757 3.455 591 524 B 127 ASN HD22 B 127 ASN HBy 1.0 1.792 3.628 592 525 A 10 TYR HA A 10 TYR HD2 1.0 1.812 3.734 593 525 A 10 TYR HA A 10 TYR HD1 1.0 1.812 3.734 594 526 B 137 GLY HAy B 138 PRO HDx 1.0 1.798 3.658 595 527 B 138 PRO HDy B 138 PRO HDx 1.0 1.323 2.023 596 528 A 28 GLU HGx A 28 GLU HGy 1.0 1.447 2.345 597 529 B 127 ASN HBy B 127 ASN HBx 1.0 1.513 2.539 598 530 B 127 ASN HBx B 127 ASN H 1.0 1.672 3.086 599 531 B 127 ASN HD22 B 127 ASN HBx 1.0 1.821 3.783 600 532 B 114 THR H B 113 ASN HBx 1.0 1.770 3.516 601 533 A 38 LEU HDy% A 38 LEU HBx 1.0 1.641 2.971 602 534 A 31 ILE HG2% A 31 ILE HB 1.0 1.721 3.291 603 535 A 2 ASP HBx A 2 ASP HBy 1.0 1.245 1.839 604 536 B 125 LYS HEx B 125 LYS HGy 1.0 1.707 3.231 605 537 B 116 SER HBy B 116 SER HA 1.0 1.861 4.029 606 538 B 132 LEU HBx B 132 LEU HBy 1.0 1.763 3.481 607 539 B 136 LEU HDx% B 136 LEU HA 1.0 1.687 3.147 608 540 B 136 LEU HDx% B 136 LEU HBy 1.0 1.571 2.723 609 541 B 136 LEU HG B 136 LEU HDx% 1.0 1.392 2.196 610 542 A 27 LYS HBy A 28 GLU HGy 1.0 1.846 3.940 611 543 B 125 LYS HGx B 125 LYS HBx 1.0 1.715 3.265 612 544 B 127 ASN HBx B 127 ASN HA 1.0 1.770 3.520 613 545 B 123 MET HGy B 123 MET HBy 1.0 1.593 2.797 614 546 B 132 LEU HG B 132 LEU HBx 1.0 1.796 3.646 615 547 A 27 LYS HGx A 24 ILE HA 1.0 1.829 3.835 616 548 B 122 LEU HDx% A 24 ILE HA 1.0 1.803 3.687 617 549 A 24 ILE HG2% A 24 ILE HA 1.0 1.714 3.264 618 550 A 24 ILE H A 24 ILE HA 1.0 1.818 3.764 619 551 A 23 LEU HG A 23 LEU HBy 1.0 1.664 3.058 620 552 B 122 LEU HDx% B 122 LEU HBy 1.0 1.626 2.914 621 553 B 104 LEU HBy B 104 LEU HDx% 1.0 1.773 3.533 622 554 A 38 LEU HDy% B 135 LYS HBy 1.0 1.763 3.483 623 555 B 136 LEU H B 135 LYS HBy 1.0 1.762 3.474 624 556 B 119 ARG HA B 119 ARG HB2 1.0 1.740 3.378 625 557 B 122 LEU HDy% B 119 ARG HA 1.0 1.815 3.751 626 558 A 13 LEU HDx% B 112 LYS HGx 1.0 1.765 3.493 627 559 B 102 SER HBx B 102 SER HBy 1.0 1.678 3.112 628 560 A 14 VAL HGy% A 14 VAL HA 1.0 1.693 3.171 629 561 A 18 GLU HGy A 14 VAL HGy% 1.0 1.770 3.518 630 562 A 18 GLU HGx A 14 VAL HGy% 1.0 1.807 3.711 631 563 A 14 VAL HGy% A 15 THR H 1.0 1.773 3.535 632 564 B 114 THR HG2% B 114 THR HA 1.0 1.724 3.304 633 565 B 133 ILE HB B 133 ILE HG1y 1.0 1.775 3.539 634 566 B 133 ILE HB B 133 ILE H 1.0 1.689 3.159 635 567 A 31 ILE HD1% B 128 GLU HG2 1.0 1.777 3.551 636 568 B 128 GLU HBx B 128 GLU HG2 1.0 1.508 2.524 637 569 A 11 GLN HA A 14 VAL HGx% 1.0 1.738 3.368 638 570 B 136 LEU HBx B 136 LEU HBy 1.0 1.495 2.487 639 571 A 15 THR HG2% A 16 GLU HGx 1.0 1.779 3.563 640 572 A 15 THR HG2% A 16 GLU H 1.0 1.822 3.794 641 573 B 104 LEU HDy% B 104 LEU HG 1.0 1.819 3.773 642 574 A 31 ILE HG2% A 31 ILE HA 1.0 1.723 3.299 643 575 A 31 ILE HA B 132 LEU HDx% 1.0 1.771 3.523 644 576 B 131 ALA HB% B 131 ALA HA 1.0 1.555 2.671 645 577 A 27 LYS HDx A 27 LYS HEy 1.0 1.767 3.499 646 578 B 129 LEU HDx% A 27 LYS HEy 1.0 1.697 3.189 647 579 B 108 LEU HDy% A 10 TYR H 1.0 1.749 3.415 648 580 B 108 LEU HDy% A 10 TYR HD2 1.0 1.754 3.444 649 580 B 108 LEU HDy% A 10 TYR HD1 1.0 1.754 3.444 650 581 A 32 ARG HA A 32 ARG HB2 1.0 1.691 3.165 651 582 B 122 LEU HDx% B 122 LEU H 1.0 1.702 6.000 652 583 B 128 GLU H A 31 ILE HD1% 1.0 1.855 3.991 653 584 B 134 ARG H B 133 ILE HB 1.0 1.776 3.548 654 585 B 118 PHE HD1 A 20 LEU HBx 1.0 1.907 4.371 655 585 B 118 PHE HD2 A 20 LEU HBx 1.0 1.907 4.371 656 586 A 30 LYS HBx B 129 LEU HDx% 1.0 1.749 3.419 657 587 A 34 LEU HDy% B 133 ILE HG1x 1.0 1.598 2.814 658 588 A 21 GLN HGx B 118 PHE HZ 1.0 1.888 4.220 659 589 A 21 GLN HGy B 118 PHE HZ 1.0 1.868 4.076 660 590 B 111 VAL HG1% A 14 VAL HGy% 1.0 1.703 6.000 661 591 B 125 LYS HGy A 24 ILE HG2% 1.0 1.631 2.935 662 592 A 21 GLN HA A 24 ILE HG2% 1.0 1.848 3.946 663 593 A 39 VAL H A 40 GLU H 1.0 1.721 3.291 664 594 B 129 LEU H B 129 LEU HA 1.0 1.765 3.495 665 595 B 129 LEU H B 129 LEU HBx 1.0 1.688 3.152 666 596 B 129 LEU H A 31 ILE HD1% 1.0 1.755 3.445 667 597 B 105 GLU H B 105 GLU HA 1.0 1.705 3.221 668 598 B 105 GLU H B 105 GLU HBx 1.0 1.709 3.239 669 599 B 105 GLU H B 104 LEU HBx 1.0 1.821 3.789 670 600 B 104 LEU HBy B 105 GLU H 1.0 1.857 4.003 671 601 B 105 GLU H B 101 VAL HG1% 1.0 1.903 4.337 672 602 B 105 GLU H B 104 LEU HDx% 1.0 1.949 4.771 673 603 B 97 LEU H B 97 LEU HA 1.0 1.968 5.024 674 604 B 97 LEU H B 96 PRO HA 1.0 1.953 4.813 675 605 A 29 GLU H A 29 GLU HGy 1.0 2.000 6.106 676 606 A 28 GLU HBy A 29 GLU H 1.0 1.752 3.432 677 607 A 29 GLU H A 29 GLU HBx 1.0 1.666 3.066 678 608 A 30 LYS H A 29 GLU HA 1.0 1.887 4.213 679 609 A 30 LYS H A 33 VAL HGy% 1.0 1.971 5.061 680 610 A 30 LYS HA A 30 LYS H 1.0 1.658 3.034 681 611 A 30 LYS H A 29 GLU HBx 1.0 1.799 3.667 682 612 A 30 LYS HBy A 30 LYS H 1.0 1.658 3.034 683 613 A 30 LYS H A 29 GLU H 1.0 1.738 3.364 684 614 B 127 ASN H B 127 ASN HA 1.0 1.731 3.335 685 615 B 125 LYS HA B 127 ASN H 1.0 1.862 4.038 686 616 B 127 ASN HBy B 127 ASN H 1.0 1.728 6.000 687 617 B 127 ASN H B 126 GLU HB2 1.0 1.722 3.294 688 618 B 124 GLU HA B 127 ASN H 1.0 1.821 3.789 689 619 B 127 ASN HD22 B 127 ASN H 1.0 1.958 4.886 690 620 B 127 ASN H B 127 ASN HD21 1.0 1.986 5.352 691 621 B 109 ARG H B 109 ARG HA 1.0 1.652 3.012 692 622 A 37 ARG H A 33 VAL HA 1.0 1.985 5.323 693 623 A 37 ARG H A 37 ARG HDy 1.0 1.914 4.426 694 624 A 37 ARG H A 37 ARG HDx 1.0 1.888 4.222 695 625 A 37 ARG H A 36 GLN HB2 1.0 1.727 3.321 696 626 A 37 ARG H A 37 ARG HBy 1.0 1.706 6.000 697 627 A 37 ARG H A 37 ARG HG2 1.0 1.703 3.217 698 628 B 111 VAL HG1% B 109 ARG H 1.0 1.961 4.929 699 629 A 36 GLN HA A 37 ARG H 1.0 1.647 6.000 700 630 A 37 ARG H A 35 ARG H 1.0 1.954 4.834 701 631 B 108 LEU H B 109 ARG H 1.0 1.800 3.674 702 632 B 104 LEU HBx B 104 LEU H 1.0 1.725 3.307 703 633 B 104 LEU HBy B 104 LEU H 1.0 1.715 3.267 704 634 B 104 LEU H B 104 LEU HDx% 1.0 1.867 4.069 705 635 B 105 GLU H B 104 LEU H 1.0 1.714 3.258 706 636 B 104 LEU H B 103 GLU H 1.0 1.861 4.027 707 637 B 112 LYS H B 110 ASP HA 1.0 1.923 4.511 708 638 B 112 LYS HA B 112 LYS H 1.0 1.771 3.519 709 639 B 112 LYS H B 109 ARG HA 1.0 1.863 4.043 710 640 B 112 LYS H B 111 VAL HB 1.0 1.944 4.716 711 641 B 112 LYS HBx B 112 LYS H 1.0 1.716 6.000 712 642 B 112 LYS HGy B 112 LYS H 1.0 1.779 3.561 713 643 B 112 LYS HGx B 112 LYS H 1.0 1.909 4.383 714 644 B 108 LEU HDx% B 112 LYS H 1.0 1.954 4.834 715 645 A 13 LEU HDx% B 112 LYS H 1.0 1.895 4.269 716 646 B 113 ASN H B 112 LYS H 1.0 1.750 3.422 717 647 A 41 ARG HA A 41 ARG H 1.0 1.662 3.050 718 648 A 40 GLU HA A 41 ARG H 1.0 1.731 3.337 719 649 A 39 VAL HA A 41 ARG H 1.0 1.945 4.719 720 650 A 41 ARG H A 41 ARG HDx 1.0 1.969 5.045 721 651 A 40 GLU HGx A 41 ARG H 1.0 1.937 4.635 722 652 A 41 ARG H A 41 ARG HBy 1.0 1.667 3.071 723 653 A 41 ARG HBx A 41 ARG H 1.0 1.691 6.000 724 654 A 41 ARG H A 41 ARG HG2 1.0 1.747 3.409 725 655 A 41 ARG H A 43 ASP H 1.0 1.946 4.738 726 656 A 40 GLU H A 41 ARG H 1.0 1.748 3.416 727 657 B 136 LEU H B 133 ILE HA 1.0 1.898 4.290 728 658 B 136 LEU H B 136 LEU HBy 1.0 1.728 3.322 729 659 B 136 LEU H B 132 LEU HBx 1.0 1.974 5.118 730 660 A 38 LEU HDy% B 136 LEU H 1.0 1.788 3.612 731 661 B 134 ARG H B 136 LEU H 1.0 1.947 4.743 732 662 B 135 LYS H B 136 LEU H 1.0 1.768 3.506 733 663 A 27 LYS H A 26 GLN HGx 1.0 1.937 4.639 734 664 B 133 ILE HG1y B 133 ILE H 1.0 1.760 3.472 735 665 B 133 ILE H B 132 LEU HBx 1.0 1.897 4.287 736 666 B 133 ILE HG2% B 133 ILE H 1.0 1.722 6.000 737 667 A 6 ASP HBx A 6 ASP H 1.0 1.757 3.453 738 668 A 6 ASP HBy A 6 ASP H 1.0 1.781 3.569 739 669 A 6 ASP H A 5 GLU HBy 1.0 1.744 3.394 740 670 B 116 SER H B 113 ASN HA 1.0 1.850 3.960 741 671 B 116 SER H B 115 ASN HA 1.0 1.880 4.158 742 672 B 116 SER H B 116 SER HA 1.0 1.727 3.319 743 673 B 116 SER HBx B 116 SER H 1.0 1.642 2.976 744 674 B 116 SER H B 115 ASN HBy 1.0 1.846 3.932 745 675 B 116 SER H B 115 ASN HBx 1.0 1.789 3.617 746 676 B 116 SER H B 118 PHE H 1.0 1.957 4.871 747 677 B 115 ASN HA B 118 PHE H 1.0 1.912 4.414 748 678 B 118 PHE H B 117 ARG HA 1.0 1.840 3.892 749 679 B 114 THR HA B 118 PHE H 1.0 1.926 4.530 750 680 B 118 PHE H B 118 PHE HBx 1.0 1.814 3.744 751 681 B 118 PHE H B 118 PHE HBy 1.0 1.834 3.864 752 682 B 118 PHE H B 117 ARG H 1.0 1.794 3.642 753 683 B 118 PHE HD1 B 118 PHE H 1.0 1.871 4.099 754 683 B 118 PHE HD2 B 118 PHE H 1.0 1.871 4.099 755 684 A 13 LEU HA A 13 LEU H 1.0 1.658 3.034 756 685 A 13 LEU H A 12 LYS HE2 1.0 1.984 5.280 757 686 A 13 LEU H A 12 LYS HB2 1.0 1.641 2.967 758 687 A 13 LEU H A 13 LEU HG 1.0 1.725 3.309 759 688 A 13 LEU HBx A 13 LEU H 1.0 1.824 3.804 760 689 A 13 LEU HDx% A 13 LEU H 1.0 1.727 3.319 761 690 A 13 LEU H A 14 VAL HGx% 1.0 1.946 4.742 762 691 A 11 GLN HA A 13 LEU H 1.0 1.977 5.177 763 692 B 102 SER HBx B 103 GLU H 1.0 1.717 3.273 764 693 B 102 SER HBy B 103 GLU H 1.0 1.865 4.055 765 694 B 103 GLU HGy B 103 GLU H 1.0 1.874 4.114 766 695 B 103 GLU HGx B 103 GLU H 1.0 1.903 4.329 767 696 B 103 GLU H B 103 GLU HB2 1.0 1.708 3.234 768 697 A 18 GLU HA A 18 GLU H 1.0 1.611 2.859 769 698 A 15 THR HA A 18 GLU H 1.0 1.746 3.406 770 699 A 18 GLU H A 14 VAL HA 1.0 1.913 4.423 771 700 A 18 GLU H A 17 ASN HBx 1.0 1.860 4.018 772 701 A 18 GLU H A 17 ASN HBy 1.0 1.879 4.149 773 702 A 18 GLU HBx A 18 GLU H 1.0 1.641 2.971 774 703 B 131 ALA H B 132 LEU H 1.0 1.652 3.010 775 704 A 18 GLU H A 17 ASN H 1.0 1.790 3.622 776 705 A 18 GLU H A 16 GLU H 1.0 1.954 4.826 777 706 B 113 ASN H B 112 LYS HA 1.0 1.840 3.894 778 707 B 113 ASN H B 113 ASN HBx 1.0 1.724 6.000 779 708 B 113 ASN H B 112 LYS HGy 1.0 1.903 4.333 780 709 B 113 ASN H B 112 LYS HGx 1.0 1.955 4.835 781 710 A 19 GLN H A 17 ASN HA 1.0 1.978 5.182 782 711 A 18 GLU HGy A 19 GLN H 1.0 1.774 3.538 783 712 A 19 GLN H A 19 GLN HBy 1.0 1.677 3.109 784 713 A 19 GLN H A 19 GLN HBx 1.0 1.709 6.000 785 714 A 19 GLN H A 20 LEU H 1.0 1.775 3.541 786 715 A 18 GLU H A 19 GLN H 1.0 1.701 3.207 787 716 A 19 GLN H A 21 GLN H 1.0 1.944 4.716 788 717 A 25 THR H A 23 LEU HA 1.0 1.853 3.979 789 718 A 25 THR H A 21 GLN HA 1.0 1.919 4.467 790 719 A 25 THR H A 24 ILE HA 1.0 1.929 4.563 791 720 A 25 THR HG2% A 25 THR H 1.0 1.807 3.709 792 721 A 25 THR H A 24 ILE HG1y 1.0 1.979 5.195 793 722 A 25 THR H A 24 ILE H 1.0 1.834 3.858 794 723 A 25 THR H A 27 LYS H 1.0 1.977 5.157 795 724 A 28 GLU HA A 28 GLU H 1.0 1.741 3.381 796 725 A 28 GLU H A 24 ILE HA 1.0 1.959 4.905 797 726 A 28 GLU HBy A 28 GLU H 1.0 1.758 3.460 798 727 A 28 GLU H A 28 GLU HGy 1.0 1.803 3.683 799 728 A 28 GLU H A 28 GLU HBx 1.0 1.737 3.365 800 729 A 27 LYS HBy A 28 GLU H 1.0 1.830 3.838 801 730 A 28 GLU H A 24 ILE HG2% 1.0 1.899 4.303 802 731 A 28 GLU H A 29 GLU H 1.0 1.786 3.598 803 732 A 30 LYS H A 28 GLU H 1.0 1.956 4.858 804 733 A 31 ILE HG1x A 31 ILE H 1.0 1.890 4.232 805 734 A 30 LYS HA A 31 ILE H 1.0 1.793 3.635 806 735 A 31 ILE HA A 31 ILE H 1.0 1.836 3.872 807 736 A 31 ILE HB A 31 ILE H 1.0 1.668 3.072 808 737 A 31 ILE HD1% A 31 ILE H 1.0 1.769 3.511 809 738 A 31 ILE HG2% A 31 ILE H 1.0 1.793 6.000 810 739 A 31 ILE H A 32 ARG H 1.0 1.838 3.882 811 740 A 33 VAL H A 31 ILE H 1.0 1.979 5.197 812 741 A 30 LYS H A 31 ILE H 1.0 1.838 3.884 813 742 A 33 VAL H A 29 GLU HA 1.0 1.934 4.610 814 743 A 33 VAL H A 32 ARG HA 1.0 1.894 4.264 815 744 A 33 VAL H A 33 VAL HB 1.0 1.676 3.106 816 745 A 33 VAL H A 32 ARG HB2 1.0 1.696 3.186 817 746 A 33 VAL H A 32 ARG HGy 1.0 1.933 4.607 818 747 A 33 VAL H A 34 LEU HBx 1.0 1.973 5.103 819 748 A 30 LYS HA A 33 VAL H 1.0 1.775 3.541 820 749 A 33 VAL H A 35 ARG H 1.0 1.983 5.267 821 750 A 33 VAL H A 34 LEU H 1.0 1.811 3.731 822 751 A 33 VAL H A 32 ARG H 1.0 1.778 3.558 823 752 A 12 LYS H A 12 LYS HA 1.0 1.641 2.969 824 753 A 11 GLN HA A 12 LYS H 1.0 1.916 4.440 825 754 B 123 MET HGy B 124 GLU H 1.0 1.944 4.720 826 755 A 12 LYS H A 12 LYS HB2 1.0 1.603 2.831 827 756 A 12 LYS H A 14 VAL HGx% 1.0 1.984 5.310 828 757 A 12 LYS H A 13 LEU H 1.0 1.764 3.490 829 758 B 123 MET H B 124 GLU H 1.0 1.778 3.556 830 759 B 125 LYS H B 124 GLU H 1.0 1.779 3.563 831 760 B 102 SER HBy B 102 SER H 1.0 1.752 3.432 832 761 B 101 VAL HG1% B 102 SER H 1.0 1.772 3.528 833 762 B 101 VAL HA B 102 SER H 1.0 1.597 2.813 834 763 B 101 VAL HB B 102 SER H 1.0 1.996 5.646 835 764 B 122 LEU H B 118 PHE HA 1.0 1.973 5.093 836 765 B 122 LEU H B 121 ALA HA 1.0 1.907 4.365 837 766 B 122 LEU H B 122 LEU HA 1.0 1.754 3.442 838 767 B 122 LEU H B 122 LEU HBx 1.0 1.743 3.387 839 768 B 122 LEU H A 24 ILE HD1% 1.0 1.875 4.125 840 769 B 122 LEU H A 24 ILE HG1y 1.0 1.968 5.018 841 770 B 97 LEU HA B 98 GLY H 1.0 1.982 5.276 842 771 B 115 ASN HA B 119 ARG H 1.0 1.958 4.886 843 772 B 116 SER HA B 119 ARG H 1.0 1.841 3.907 844 773 B 119 ARG HA B 119 ARG H 1.0 1.801 3.679 845 774 B 118 PHE HBx B 119 ARG H 1.0 1.896 4.276 846 775 B 118 PHE HBy B 119 ARG H 1.0 1.863 4.043 847 776 B 119 ARG HB2 B 119 ARG H 1.0 1.681 3.123 848 777 B 119 ARG H B 119 ARG HG2 1.0 1.813 3.743 849 778 A 20 LEU HDy% B 119 ARG H 1.0 1.927 4.547 850 779 B 121 ALA H B 119 ARG H 1.0 1.946 4.748 851 780 B 118 PHE HD1 B 119 ARG H 1.0 1.974 5.122 852 780 B 118 PHE HD2 B 119 ARG H 1.0 1.974 5.122 853 781 A 34 LEU HBy A 34 LEU H 1.0 1.738 3.368 854 782 A 34 LEU HG A 34 LEU H 1.0 1.989 5.421 855 783 A 34 LEU H A 34 LEU HBx 1.0 1.849 3.957 856 784 A 34 LEU HDy% A 34 LEU H 1.0 1.989 5.409 857 785 A 7 GLU H A 7 GLU HA 1.0 1.720 3.288 858 786 A 6 ASP HBx A 7 GLU H 1.0 1.830 3.838 859 787 A 6 ASP HBy A 7 GLU H 1.0 1.857 4.003 860 788 A 7 GLU HBx A 7 GLU H 1.0 1.616 2.880 861 789 A 6 ASP H A 7 GLU H 1.0 1.696 3.186 862 790 A 11 GLN H A 7 GLU HA 1.0 1.903 4.333 863 791 A 11 GLN H A 10 TYR HA 1.0 1.847 3.941 864 792 A 11 GLN H A 10 TYR HBy 1.0 1.832 3.850 865 793 A 11 GLN H A 10 TYR HBx 1.0 1.861 4.029 866 794 A 11 GLN H A 11 GLN HB2 1.0 1.669 3.077 867 795 A 12 LYS H A 11 GLN H 1.0 1.735 3.355 868 796 A 11 GLN H A 10 TYR HD2 1.0 1.838 3.882 869 796 A 11 GLN H A 10 TYR HD1 1.0 1.838 3.882 870 797 A 14 VAL HA A 17 ASN H 1.0 1.866 4.066 871 798 A 17 ASN H A 17 ASN HBx 1.0 1.805 3.693 872 799 A 17 ASN H A 17 ASN HBy 1.0 1.808 3.712 873 800 A 17 ASN H A 16 GLU HA 1.0 1.841 3.903 874 801 A 17 ASN H A 16 GLU HGy 1.0 1.927 7.609 875 802 B 108 LEU H B 108 LEU HA 1.0 1.765 3.491 876 803 B 108 LEU H B 105 GLU HA 1.0 1.792 3.628 877 804 B 108 LEU H A 10 TYR HBx 1.0 1.985 5.331 878 805 B 108 LEU HBx B 108 LEU H 1.0 1.688 3.152 879 806 B 108 LEU HBy B 108 LEU H 1.0 1.666 3.064 880 807 B 108 LEU H B 107 ARG H 1.0 1.782 3.576 881 808 B 108 LEU H A 10 TYR HD2 1.0 1.956 4.860 882 808 B 108 LEU H A 10 TYR HD1 1.0 1.956 4.860 883 809 B 107 ARG H B 106 GLN HA 1.0 1.771 3.523 884 810 A 8 GLU H A 8 GLU HGy 1.0 1.797 3.651 885 811 B 107 ARG H B 107 ARG HB2 1.0 1.708 3.236 886 812 B 107 ARG H B 107 ARG HGy 1.0 1.701 3.207 887 813 B 104 LEU HDy% B 107 ARG H 1.0 1.947 4.747 888 814 B 107 ARG H B 104 LEU HDx% 1.0 1.951 4.797 889 815 A 8 GLU H A 6 ASP HA 1.0 1.942 4.702 890 816 A 8 GLU H A 8 GLU HBy 1.0 1.562 2.692 891 817 B 106 GLN H B 107 ARG H 1.0 1.760 3.468 892 818 A 27 LYS HA A 27 LYS H 1.0 1.718 3.278 893 819 A 27 LYS H A 24 ILE HA 1.0 1.903 4.337 894 820 A 27 LYS H A 27 LYS HEy 1.0 1.989 5.415 895 821 A 26 GLN HBy A 27 LYS H 1.0 1.782 3.576 896 822 A 27 LYS H A 27 LYS HBx 1.0 1.733 6.000 897 823 A 27 LYS HBy A 27 LYS H 1.0 1.679 3.117 898 824 A 26 GLN H A 27 LYS H 1.0 1.758 3.458 899 825 A 27 LYS H A 28 GLU H 1.0 1.821 3.787 900 826 A 15 THR HB A 15 THR H 1.0 1.699 3.197 901 827 A 15 THR HA A 15 THR H 1.0 1.697 3.187 902 828 A 11 GLN HA A 15 THR H 1.0 1.899 4.303 903 829 A 14 VAL HA A 15 THR H 1.0 1.921 4.495 904 830 A 14 VAL HB A 15 THR H 1.0 1.734 6.000 905 831 A 15 THR HG2% A 15 THR H 1.0 1.790 6.000 906 832 A 17 ASN H A 15 THR H 1.0 1.984 5.296 907 833 A 14 VAL H A 15 THR H 1.0 1.772 3.528 908 834 B 123 MET H B 123 MET HA 1.0 1.730 3.328 909 835 B 123 MET H B 122 LEU HA 1.0 1.880 4.160 910 836 B 123 MET H B 123 MET HBy 1.0 1.626 2.914 911 837 B 122 LEU HBx B 123 MET H 1.0 1.799 3.665 912 838 B 122 LEU HBy B 123 MET H 1.0 1.840 3.900 913 839 B 122 LEU HDx% B 123 MET H 1.0 1.971 6.993 914 840 B 122 LEU H B 123 MET H 1.0 1.790 3.616 915 841 B 114 THR H B 111 VAL HA 1.0 1.778 3.560 916 842 B 114 THR H B 114 THR HB 1.0 1.730 3.330 917 843 B 114 THR H B 114 THR HA 1.0 1.741 3.379 918 844 B 111 VAL HG1% B 114 THR H 1.0 1.938 7.478 919 845 B 114 THR H B 114 THR HG2% 1.0 1.805 3.701 920 846 B 113 ASN H B 114 THR H 1.0 1.736 3.358 921 847 B 114 THR H B 115 ASN H 1.0 1.796 3.646 922 848 B 114 THR H B 113 ASN HD21 1.0 1.916 4.440 923 849 B 114 THR H B 115 ASN HD22 1.0 1.965 4.975 924 850 B 101 VAL H B 100 SER HA 1.0 1.651 3.009 925 851 B 101 VAL HG1% B 101 VAL H 1.0 1.655 3.023 926 852 B 101 VAL HA B 101 VAL H 1.0 1.707 3.233 927 853 B 101 VAL H B 100 SER HBy 1.0 1.707 3.231 928 854 B 101 VAL HB B 101 VAL H 1.0 1.670 3.080 929 855 A 34 LEU HA A 35 ARG H 1.0 1.900 4.312 930 856 A 31 ILE HA A 35 ARG H 1.0 1.955 4.839 931 857 A 35 ARG HDy A 35 ARG H 1.0 1.924 4.520 932 858 A 35 ARG H A 35 ARG HBy 1.0 1.670 3.082 933 859 A 35 ARG H A 35 ARG HGy 1.0 1.868 4.072 934 860 A 35 ARG H A 34 LEU HBx 1.0 1.901 4.317 935 861 B 132 LEU HDy% A 35 ARG H 1.0 1.790 3.616 936 862 A 34 LEU H A 35 ARG H 1.0 1.843 3.917 937 863 A 36 GLN H A 35 ARG H 1.0 1.790 3.616 938 864 B 131 ALA H B 127 ASN HA 1.0 1.923 4.507 939 865 B 131 ALA H B 131 ALA HA 1.0 1.656 3.026 940 866 B 131 ALA H B 130 GLN HGy 1.0 1.872 4.100 941 867 B 131 ALA H B 130 GLN H 1.0 1.779 3.561 942 868 A 21 GLN HA A 22 ARG H 1.0 1.926 4.538 943 869 A 21 GLN H A 22 ARG H 1.0 1.794 3.638 944 870 A 40 GLU H A 40 GLU HA 1.0 1.647 2.995 945 871 A 40 GLU H A 40 GLU HGx 1.0 1.760 3.472 946 872 A 40 GLU H A 39 VAL HB 1.0 1.713 3.255 947 873 A 40 GLU H A 40 GLU HB2 1.0 1.619 2.891 948 874 A 40 GLU H A 39 VAL HGy% 1.0 1.805 3.699 949 875 A 10 TYR H A 7 GLU HA 1.0 1.814 3.748 950 876 A 10 TYR H A 10 TYR HA 1.0 1.727 3.317 951 877 A 10 TYR HBy A 10 TYR H 1.0 1.770 3.516 952 878 A 10 TYR H A 10 TYR HBx 1.0 1.766 3.494 953 879 A 10 TYR H A 9 ARG HBx 1.0 1.823 3.799 954 880 A 10 TYR H A 9 ARG H 1.0 1.670 3.078 955 881 A 10 TYR H A 10 TYR HD2 1.0 1.997 6.359 956 881 A 10 TYR H A 10 TYR HD1 1.0 1.997 6.359 957 882 B 111 VAL H B 110 ASP HA 1.0 1.880 4.160 958 883 B 108 LEU HA B 111 VAL H 1.0 1.876 4.130 959 884 B 111 VAL HA B 111 VAL H 1.0 1.770 3.518 960 885 B 111 VAL H B 110 ASP HBy 1.0 1.826 3.814 961 886 B 112 LYS H B 111 VAL H 1.0 1.772 3.524 962 887 B 110 ASP H B 111 VAL H 1.0 1.775 3.539 963 888 B 111 VAL H A 10 TYR HD2 1.0 1.982 5.264 964 888 B 111 VAL H A 10 TYR HD1 1.0 1.982 5.264 965 889 B 126 GLU HA B 126 GLU H 1.0 1.688 3.152 966 890 B 126 GLU H B 126 GLU HGy 1.0 1.759 3.465 967 891 B 126 GLU H B 126 GLU HB2 1.0 1.574 2.734 968 892 B 126 GLU H B 125 LYS HBx 1.0 1.784 3.584 969 893 B 126 GLU H B 127 ASN H 1.0 1.697 3.187 970 894 A 25 THR HB A 26 GLN H 1.0 1.779 3.563 971 895 A 26 GLN HBy A 26 GLN H 1.0 1.687 3.149 972 896 A 26 GLN H A 26 GLN HBx 1.0 1.762 3.476 973 897 A 26 GLN H A 28 GLU H 1.0 1.956 4.866 974 898 A 36 GLN H A 35 ARG HA 1.0 1.829 3.833 975 899 A 36 GLN H A 35 ARG HBy 1.0 1.745 3.397 976 900 A 36 GLN H A 36 GLN HA 1.0 1.692 3.166 977 901 A 36 GLN H A 33 VAL HA 1.0 1.877 4.143 978 902 A 36 GLN H A 36 GLN HB2 1.0 1.624 2.910 979 903 A 36 GLN H A 37 ARG H 1.0 1.736 3.356 980 904 A 36 GLN H A 34 LEU H 1.0 1.969 5.027 981 905 A 3 SER H A 2 ASP HA 1.0 1.832 3.848 982 906 A 3 SER HA A 3 SER H 1.0 1.925 4.525 983 907 A 3 SER HBy A 3 SER H 1.0 1.959 4.893 984 908 A 21 GLN H A 17 ASN HA 1.0 1.951 4.797 985 909 A 21 GLN H A 21 GLN HBx 1.0 1.678 3.112 986 910 A 21 GLN H A 20 LEU HBy 1.0 1.919 4.471 987 911 A 20 LEU HDx% A 21 GLN H 1.0 1.941 4.683 988 912 A 20 LEU HDy% A 21 GLN H 1.0 1.926 4.540 989 913 A 21 GLN H A 21 GLN HE22 1.0 1.943 4.703 990 914 A 20 LEU H A 21 GLN H 1.0 1.852 3.968 991 915 B 128 GLU H B 127 ASN HA 1.0 1.901 4.319 992 916 B 128 GLU H B 125 LYS HA 1.0 1.847 3.935 993 917 B 128 GLU H B 128 GLU HA 1.0 1.725 3.311 994 918 B 128 GLU H B 127 ASN HBy 1.0 1.846 3.936 995 919 B 128 GLU H B 127 ASN HBx 1.0 1.850 3.958 996 920 B 128 GLU H B 128 GLU HBx 1.0 1.860 4.018 997 921 B 129 LEU H B 128 GLU H 1.0 1.792 3.632 998 922 A 23 LEU H A 21 GLN HA 1.0 1.987 5.385 999 923 A 23 LEU HBx A 23 LEU H 1.0 1.693 3.175 1000 924 A 23 LEU H A 22 ARG HBy 1.0 1.810 3.722 1001 925 A 23 LEU HG A 23 LEU H 1.0 1.743 6.000 1002 926 A 23 LEU HDy% A 23 LEU H 1.0 1.735 3.351 1003 927 B 106 GLN H B 103 GLU HA 1.0 1.840 3.898 1004 928 B 106 GLN H B 106 GLN HA 1.0 1.667 3.071 1005 929 B 106 GLN H B 105 GLU HBy 1.0 1.764 3.490 1006 930 B 108 LEU H B 106 GLN H 1.0 1.920 4.480 1007 931 B 125 LYS H B 122 LEU HA 1.0 1.899 4.305 1008 932 B 125 LYS H B 125 LYS HEx 1.0 1.965 4.985 1009 933 B 125 LYS H B 125 LYS HEy 1.0 1.979 5.197 1010 934 B 124 GLU HGx B 125 LYS H 1.0 1.941 4.689 1011 935 B 124 GLU HBx B 125 LYS H 1.0 1.754 3.440 1012 936 B 124 GLU HBy B 125 LYS H 1.0 1.696 3.182 1013 937 B 125 LYS H B 125 LYS HBx 1.0 1.769 3.513 1014 938 B 125 LYS H B 125 LYS HGy 1.0 1.791 3.619 1015 939 B 120 LYS H B 120 LYS HA 1.0 1.683 3.135 1016 940 B 118 PHE HBy B 120 LYS H 1.0 1.971 5.053 1017 941 B 120 LYS H B 120 LYS HB2 1.0 1.582 2.760 1018 942 B 120 LYS H B 120 LYS HD2 1.0 1.901 4.323 1019 943 B 119 ARG H B 120 LYS H 1.0 1.817 3.765 1020 944 B 122 LEU H B 120 LYS H 1.0 1.969 5.043 1021 945 B 121 ALA H B 120 LYS H 1.0 1.751 3.425 1022 946 A 20 LEU H A 17 ASN HA 1.0 1.907 4.369 1023 947 A 20 LEU H A 19 GLN HBx 1.0 1.761 3.471 1024 948 A 20 LEU H A 20 LEU HG 1.0 1.731 3.331 1025 949 A 20 LEU H A 20 LEU HBy 1.0 1.867 4.071 1026 950 A 20 LEU H A 20 LEU HDy% 1.0 1.813 3.741 1027 951 A 23 LEU HBx A 24 ILE H 1.0 1.801 3.679 1028 952 A 24 ILE HG1x A 24 ILE H 1.0 1.789 3.615 1029 953 A 24 ILE HG2% A 24 ILE H 1.0 1.733 6.000 1030 954 A 24 ILE HG1y A 24 ILE H 1.0 1.861 4.027 1031 955 A 9 ARG H A 7 GLU HA 1.0 1.849 3.955 1032 956 A 9 ARG H A 8 GLU HA 1.0 1.773 3.531 1033 957 A 14 VAL H A 11 GLN HA 1.0 1.840 3.898 1034 958 A 9 ARG H A 9 ARG HBx 1.0 1.646 2.986 1035 959 A 14 VAL H A 13 LEU HBy 1.0 1.618 2.888 1036 960 A 9 ARG H A 9 ARG HGy 1.0 1.791 3.627 1037 961 A 13 LEU HBx A 14 VAL H 1.0 1.899 4.299 1038 962 A 14 VAL H A 14 VAL HGy% 1.0 1.759 3.463 1039 963 A 14 VAL H A 13 LEU H 1.0 1.808 3.712 1040 964 A 14 VAL H A 10 TYR HD2 1.0 1.969 5.027 1041 964 A 14 VAL H A 10 TYR HD1 1.0 1.969 5.027 1042 965 A 3 SER HA A 5 GLU H 1.0 1.906 4.362 1043 966 A 5 GLU H A 5 GLU HA 1.0 1.640 2.968 1044 967 A 5 GLU H A 5 GLU HGy 1.0 1.735 3.355 1045 968 A 5 GLU HBy A 5 GLU H 1.0 1.631 2.931 1046 969 A 4 LYS HB2 A 5 GLU H 1.0 1.732 3.342 1047 970 A 7 GLU H A 5 GLU H 1.0 1.862 4.036 1048 971 A 6 ASP H A 5 GLU H 1.0 1.772 3.526 1049 972 A 42 GLY HAx A 43 ASP H 1.0 1.745 3.399 1050 973 A 42 GLY HAy A 43 ASP H 1.0 1.757 3.457 1051 974 A 39 VAL HA A 43 ASP H 1.0 1.892 4.252 1052 975 A 43 ASP HBx A 43 ASP H 1.0 1.803 3.687 1053 976 A 43 ASP HBy A 43 ASP H 1.0 1.704 3.222 1054 977 A 43 ASP H A 42 GLY H 1.0 1.715 3.267 1055 978 A 38 LEU H A 35 ARG HA 1.0 1.853 3.983 1056 979 A 38 LEU H A 38 LEU HBy 1.0 1.714 6.000 1057 980 A 38 LEU H A 38 LEU HA 1.0 1.693 3.173 1058 981 A 38 LEU H A 37 ARG HBx 1.0 1.758 3.458 1059 982 A 38 LEU H A 38 LEU HBx 1.0 1.680 3.120 1060 983 A 38 LEU H A 36 GLN H 1.0 1.936 4.638 1061 984 B 134 ARG HA B 134 ARG H 1.0 1.661 3.047 1062 985 B 134 ARG H B 133 ILE HA 1.0 1.901 4.323 1063 986 A 3 SER HA A 4 LYS H 1.0 1.780 3.568 1064 987 A 4 LYS HA A 4 LYS H 1.0 1.833 3.859 1065 988 A 3 SER HBx A 4 LYS H 1.0 1.943 4.707 1066 989 A 4 LYS HB2 A 4 LYS H 1.0 1.735 3.355 1067 990 A 4 LYS HGy A 4 LYS H 1.0 1.940 4.680 1068 991 B 121 ALA HA B 121 ALA H 1.0 1.715 3.263 1069 992 B 121 ALA H B 120 LYS HA 1.0 1.829 3.831 1070 993 B 121 ALA H B 120 LYS HB2 1.0 1.712 3.250 1071 994 B 121 ALA H A 24 ILE HD1% 1.0 1.940 4.666 1072 995 B 118 PHE HD1 B 121 ALA H 1.0 1.989 5.425 1073 995 B 118 PHE HD2 B 121 ALA H 1.0 1.989 5.425 1074 996 B 123 MET H B 121 ALA H 1.0 1.987 5.387 1075 997 B 122 LEU H B 121 ALA H 1.0 1.811 3.735 1076 998 B 132 LEU H B 132 LEU HDx% 1.0 1.825 3.809 1077 999 B 131 ALA HB% B 132 LEU H 1.0 1.742 3.384 1078 1000 B 132 LEU H B 132 LEU HBx 1.0 1.811 3.727 1079 1001 B 132 LEU HDy% B 132 LEU H 1.0 1.724 3.306 1080 1002 B 132 LEU H B 133 ILE H 1.0 1.831 3.847 1081 1003 A 16 GLU HA A 16 GLU H 1.0 1.688 3.150 1082 1004 A 14 VAL HA A 16 GLU H 1.0 1.983 5.287 1083 1005 A 16 GLU HBy A 16 GLU H 1.0 1.726 6.000 1084 1006 A 16 GLU H A 16 GLU HBx 1.0 1.746 3.402 1085 1007 A 16 GLU H A 15 THR H 1.0 1.786 3.596 1086 1008 A 17 ASN H A 16 GLU H 1.0 1.809 3.723 1087 1009 B 135 LYS H B 135 LYS HA 1.0 1.638 2.960 1088 1010 B 135 LYS H B 133 ILE HA 1.0 1.971 5.061 1089 1011 B 135 LYS H B 135 LYS HGx 1.0 1.893 4.253 1090 1012 B 135 LYS H B 134 ARG H 1.0 1.767 3.501 1091 1013 A 29 GLU HA A 32 ARG H 1.0 1.845 3.929 1092 1014 A 30 LYS HA A 32 ARG H 1.0 1.864 4.052 1093 1015 A 32 ARG HA A 32 ARG H 1.0 1.729 3.325 1094 1016 A 31 ILE HA A 32 ARG H 1.0 1.926 4.534 1095 1017 A 32 ARG HDx A 32 ARG H 1.0 1.959 4.889 1096 1018 A 32 ARG H A 32 ARG HB2 1.0 1.622 2.902 1097 1019 A 30 LYS H A 32 ARG H 1.0 1.953 4.817 1098 1020 B 115 ASN HA B 117 ARG H 1.0 1.952 4.806 1099 1021 B 117 ARG HA B 117 ARG H 1.0 1.637 2.955 1100 1022 B 114 THR HA B 117 ARG H 1.0 1.871 4.095 1101 1023 B 117 ARG H B 117 ARG HB2 1.0 1.621 2.895 1102 1024 B 117 ARG HGx B 117 ARG H 1.0 1.812 3.736 1103 1025 B 117 ARG HGy B 117 ARG H 1.0 1.871 4.097 1104 1026 B 113 ASN HA B 117 ARG H 1.0 1.943 4.705 1105 1027 B 117 ARG HD2 B 117 ARG H 1.0 1.941 4.689 1106 1028 B 117 ARG H B 119 ARG H 1.0 1.963 4.957 1107 1029 B 116 SER H B 117 ARG H 1.0 1.774 3.538 1108 1030 B 115 ASN H B 117 ARG H 1.0 1.929 4.561 1109 1031 A 39 VAL H A 39 VAL HGy% 1.0 1.747 3.411 1110 1032 B 130 GLN H B 127 ASN HA 1.0 1.887 4.209 1111 1033 B 126 GLU HA B 130 GLN H 1.0 1.932 4.596 1112 1034 B 130 GLN H B 130 GLN HA 1.0 1.766 3.500 1113 1035 B 130 GLN HBy B 130 GLN H 1.0 1.680 3.118 1114 1036 B 129 LEU HBx B 130 GLN H 1.0 1.797 3.653 1115 1037 B 128 GLU H B 130 GLN H 1.0 1.957 4.873 1116 1038 B 110 ASP H B 110 ASP HA 1.0 1.704 3.220 1117 1039 B 110 ASP H B 107 ARG HA 1.0 1.837 3.875 1118 1040 B 110 ASP H B 109 ARG HA 1.0 1.809 3.719 1119 1041 B 110 ASP H B 110 ASP HBy 1.0 1.714 3.264 1120 1042 B 110 ASP H B 109 ARG HB2 1.0 1.707 3.229 1121 1043 B 110 ASP H B 109 ARG HGx 1.0 1.887 4.207 1122 1044 B 111 VAL HG1% B 110 ASP H 1.0 1.905 4.357 1123 1045 B 110 ASP H B 108 LEU H 1.0 1.945 4.737 1124 1046 B 118 PHE H B 119 ARG H 1.0 1.841 3.901 1125 1047 B 106 GLN HE21 B 106 GLN HA 1.0 1.971 5.061 1126 1048 B 106 GLN HE21 B 106 GLN HBy 1.0 1.950 4.778 1127 1049 B 110 ASP HA B 113 ASN HD21 1.0 1.933 4.607 1128 1050 B 113 ASN HBy B 113 ASN HD21 1.0 1.887 4.215 1129 1051 B 113 ASN HBx B 113 ASN HD21 1.0 1.898 4.292 1130 1052 B 130 GLN HA B 130 GLN HE22 1.0 1.983 5.277 1131 1053 B 130 GLN HGy B 130 GLN HE22 1.0 1.787 3.605 1132 1054 B 127 ASN HD22 B 127 ASN HA 1.0 1.984 5.308 1133 1055 B 124 GLU HA B 127 ASN HD22 1.0 1.919 4.467 1134 1056 A 36 GLN HA A 36 GLN HE21 1.0 1.949 4.779 1135 1057 A 36 GLN HGx A 36 GLN HE21 1.0 1.764 3.492 1136 1058 A 36 GLN HB2 A 36 GLN HE21 1.0 1.963 4.943 1137 1059 A 11 GLN HE22 A 11 GLN HB2 1.0 1.939 4.659 1138 1060 A 21 GLN HGx A 21 GLN HE22 1.0 1.811 3.727 1139 1061 B 113 ASN HA B 113 ASN HD22 1.0 1.958 4.886 1140 1062 B 113 ASN HBx B 113 ASN HD22 1.0 1.926 4.538 1141 1063 B 109 ARG HB2 B 113 ASN HD22 1.0 1.977 5.161 1142 1064 B 113 ASN HBy B 113 ASN HD22 1.0 1.948 4.754 1143 1065 B 130 GLN HE21 B 130 GLN HA 1.0 1.999 5.803 1144 1066 B 130 GLN HE21 B 126 GLU HGy 1.0 1.998 5.768 1145 1067 B 130 GLN HBy B 130 GLN HE21 1.0 1.968 5.022 1146 1068 B 129 LEU HDy% B 130 GLN HE21 1.0 1.971 5.061 1147 1069 A 18 GLU HA A 21 GLN HE21 1.0 1.952 4.802 1148 1070 A 36 GLN HGx A 36 GLN HE22 1.0 1.843 3.913 1149 1071 A 39 VAL HGy% A 36 GLN HE22 1.0 1.947 4.741 1150 1072 A 21 GLN HGx A 21 GLN HE21 1.0 1.876 4.136 1151 1073 B 127 ASN HA B 127 ASN HD21 1.0 1.988 5.394 1152 1074 B 127 ASN HBy B 127 ASN HD21 1.0 1.873 4.111 1153 1075 B 127 ASN HBx B 127 ASN HD21 1.0 1.886 4.200 1154 1076 B 124 GLU HBx B 127 ASN HD21 1.0 1.957 4.863 1155 1077 B 124 GLU HA B 127 ASN HD21 1.0 1.934 4.612 1156 1078 A 11 GLN HE21 A 11 GLN HB2 1.0 1.969 5.041 1157 1079 A 14 VAL HGy% A 11 GLN HE21 1.0 1.955 4.841 1158 1080 A 18 GLU HGy A 19 GLN HE21 1.0 1.966 4.982 1159 1081 A 19 GLN HGy A 19 GLN HE21 1.0 1.960 4.906 1160 1082 A 26 GLN HGx A 26 GLN HE21 1.0 1.934 4.618 1161 1083 A 26 GLN HGy A 26 GLN HE21 1.0 1.927 4.537 1162 1084 A 23 LEU HDy% A 26 GLN HE21 1.0 1.981 5.243 1163 1085 B 106 GLN HE22 B 106 GLN HBy 1.0 1.987 5.363 1164 1086 A 41 ARG HA A 42 GLY H 1.0 1.787 3.601 1165 1087 A 42 GLY HAx A 42 GLY H 1.0 1.643 2.979 1166 1088 A 42 GLY HAy A 42 GLY H 1.0 1.624 2.908 1167 1089 A 39 VAL HA A 42 GLY H 1.0 1.847 3.943 1168 1090 A 41 ARG HBy A 42 GLY H 1.0 1.842 3.906 1169 1091 A 41 ARG HBx A 42 GLY H 1.0 1.874 4.118 1170 1092 A 41 ARG HG2 A 42 GLY H 1.0 1.909 4.381 1171 1093 A 39 VAL HGx% A 42 GLY H 1.0 1.976 5.156 1172 1094 B 137 GLY H B 137 GLY HAy 1.0 1.649 2.999 1173 1095 B 137 GLY H B 136 LEU HA 1.0 1.995 5.593 1174 1096 B 137 GLY H B 137 GLY HAx 1.0 1.617 2.885 1175 1097 B 137 GLY H B 138 PRO HDx 1.0 1.804 3.694 1176 1098 B 137 GLY H B 136 LEU HBy 1.0 1.809 3.719 1177 1099 B 137 GLY H B 136 LEU HBx 1.0 1.760 3.470 1178 1100 B 139 GLU H B 139 GLU HA 1.0 1.720 3.288 1179 1101 B 139 GLU H B 139 GLU HGy 1.0 1.717 3.273 1180 1102 B 139 GLU H B 138 PRO HBy 1.0 1.677 3.107 1181 1103 B 139 GLU H B 139 GLU HBy 1.0 1.705 3.223 1182 1104 A 44 ALA H A 44 ALA HB% 1.0 1.668 3.074 1183 1105 A 43 ASP HBx A 44 ALA H 1.0 1.958 7.198 1184 1106 A 43 ASP HBy A 44 ALA H 1.0 1.920 4.482 1185 1107 A 44 ALA H A 43 ASP HA 1.0 1.712 3.252 1186 1108 A 41 ARG H A 42 GLY H 1.0 1.708 3.234 1187 1109 A 40 GLU H A 42 GLY H 1.0 1.911 4.403 1188 1110 B 137 GLY H B 136 LEU H 1.0 1.703 3.215 1189 1111 B 135 LYS H B 137 GLY H 1.0 1.879 4.149 1190 1112 B 110 ASP H B 109 ARG H 1.0 1.750 3.418 1191 1113 B 106 GLN H B 105 GLU H 1.0 1.766 3.494 1192 1114 B 129 LEU H B 128 GLU HA 1.0 1.839 3.897 1193 1115 B 124 GLU HA B 125 LYS H 1.0 1.842 3.912 1194 1116 B 105 GLU H B 105 GLU HGy 1.0 1.840 3.896 1195 1117 A 27 LYS H A 29 GLU H 1.0 1.956 4.864 1196 1118 A 23 LEU HA A 24 ILE H 1.0 1.830 3.836 1197 1119 A 23 LEU H A 24 ILE H 1.0 1.871 4.091 1198 1120 A 23 LEU H A 22 ARG H 1.0 1.740 3.376 1199 1121 A 22 ARG H A 24 ILE H 1.0 1.945 4.731 1200 1122 A 8 GLU H A 8 GLU HA 1.0 1.606 2.844 1201 1123 B 113 ASN H B 109 ARG HA 1.0 1.864 4.046 1202 1124 A 26 GLN HGy A 26 GLN HE22 1.0 1.944 4.712 1203 1125 A 21 GLN HE21 A 21 GLN HE22 1.0 1.440 2.328 1204 1126 B 127 ASN HD22 B 127 ASN HD21 1.0 1.477 2.433 1205 1127 A 36 GLN HE21 A 36 GLN HE22 1.0 1.400 2.220 1206 1128 A 11 GLN HE21 A 11 GLN HE22 1.0 1.400 2.220 1207 1129 B 113 ASN HD21 B 113 ASN HD22 1.0 1.572 2.728 1208 1130 B 130 GLN HE21 B 130 GLN HE22 1.0 1.463 2.393 1209 1131 B 106 GLN HE21 B 106 GLN HE22 1.0 1.416 2.262 1210 1132 A 19 GLN HE22 A 19 GLN HE21 1.0 1.427 2.289 1211 1133 A 26 GLN HE22 A 26 GLN HE21 1.0 1.520 2.562 1212 1134 A 22 ARG HA A 22 ARG H 1.0 1.638 2.958 1213 1135 B 115 ASN HD22 B 115 ASN HBx 1.0 1.949 4.777 1214 1136 B 120 LYS H B 120 LYS HGy 1.0 1.900 4.308 1215 1137 A 18 GLU H A 17 ASN HA 1.0 1.919 4.471 1216 1138 A 43 ASP H A 43 ASP HA 1.0 1.712 3.252 1217 1139 A 17 ASN H A 17 ASN HA 1.0 1.799 3.663 1218 1140 B 108 LEU HA B 109 ARG H 1.0 1.885 4.197 1219 1141 B 114 THR H B 113 ASN HA 1.0 1.820 3.778 1220 1142 B 113 ASN H B 113 ASN HA 1.0 1.669 3.075 1221 1143 B 102 SER H B 102 SER HA 1.0 1.794 3.636 1222 1144 B 103 GLU H B 102 SER HA 1.0 1.735 6.000 1223 1145 A 3 SER HBx A 3 SER H 1.0 1.958 4.892 1224 1146 B 109 ARG H B 109 ARG HB2 1.0 1.556 2.674 1225 1147 A 6 ASP H A 6 ASP HA 1.0 1.746 3.402 1226 1148 B 104 LEU HDy% A 6 ASP H 1.0 1.923 4.509 1227 1149 A 3 SER HBy A 4 LYS H 1.0 1.964 4.954 1228 1150 B 115 ASN HD22 B 114 THR HB 1.0 1.982 5.254 1229 1151 B 115 ASN HD21 B 115 ASN HBx 1.0 1.935 4.627 1230 1152 B 111 VAL HB B 115 ASN HD21 1.0 1.959 4.903 1231 1153 B 130 GLN HA B 133 ILE H 1.0 1.818 3.766 1232 1154 B 108 LEU H A 10 TYR HE1 1.0 1.975 5.139 1233 1154 B 108 LEU H A 10 TYR HE2 1.0 1.975 5.139 1234 1155 B 107 ARG H A 10 TYR HE1 1.0 1.981 5.253 1235 1155 B 107 ARG H A 10 TYR HE2 1.0 1.981 5.253 1236 1156 A 10 TYR HE1 B 111 VAL H 1.0 1.948 4.762 1237 1156 A 10 TYR HE2 B 111 VAL H 1.0 1.948 4.762 1238 1157 A 11 GLN H A 8 GLU HA 1.0 1.879 4.151 1239 1158 B 136 LEU HDx% A 38 LEU H 1.0 1.768 3.506 1240 1159 A 38 LEU H B 136 LEU HDy% 1.0 1.801 3.677 1241 1160 B 134 ARG H B 133 ILE H 1.0 1.760 3.470 1242 1161 B 133 ILE HG1x B 133 ILE H 1.0 1.811 3.729 1243 1162 A 20 LEU HDx% B 119 ARG H 1.0 1.890 4.234 1244 1163 B 108 LEU HDy% A 9 ARG H 1.0 1.876 4.132 1245 1164 B 108 LEU HDx% A 11 GLN H 1.0 1.972 5.080 1246 1165 A 35 ARG H B 132 LEU HDx% 1.0 1.863 4.047 1247 1166 B 110 ASP H A 10 TYR HE1 1.0 1.999 5.865 1248 1166 B 110 ASP H A 10 TYR HE2 1.0 1.999 5.865 1249 1167 B 129 LEU H A 31 ILE HG1x 1.0 1.954 4.836 1250 1168 B 115 ASN H B 115 ASN HA 1.0 1.804 3.690 1251 1169 B 112 LYS HA B 115 ASN H 1.0 1.785 3.593 1252 1170 B 114 THR HB B 115 ASN H 1.0 1.852 3.970 1253 1171 B 115 ASN H B 114 THR HA 1.0 1.926 4.530 1254 1172 B 115 ASN HD22 B 115 ASN H 1.0 1.918 4.462 1255 1173 B 115 ASN H B 116 SER H 1.0 1.804 3.688 1256 1174 B 115 ASN HD21 B 115 ASN H 1.0 1.961 4.911 1257 1175 B 118 PHE HD1 B 115 ASN H 1.0 1.988 5.410 1258 1175 B 118 PHE HD2 B 115 ASN H 1.0 1.988 5.410 1259 1176 B 115 ASN H B 115 ASN HBy 1.0 1.803 3.689 1260 1177 B 115 ASN H B 115 ASN HBx 1.0 1.790 3.622 1261 1178 B 111 VAL HG1% B 115 ASN H 1.0 1.931 4.581 1262 1179 B 118 PHE H B 117 ARG HB2 1.0 1.725 3.311 1263 1180 B 118 PHE H B 118 PHE HA 1.0 1.803 3.687 1264 1181 B 123 MET HGx B 127 ASN HD21 1.0 1.961 4.919 1265 1182 B 130 GLN H B 133 ILE HD1% 1.0 1.948 4.764 1266 1183 B 131 ALA H B 133 ILE H 1.0 1.929 4.563 1267 1184 B 135 LYS H B 133 ILE H 1.0 1.985 5.311 1268 1185 B 136 LEU H B 136 LEU HBx 1.0 1.654 3.016 1269 1186 A 43 ASP H A 44 ALA H 1.0 1.731 3.333 1270 1187 B 124 GLU HBx B 124 GLU H 1.0 1.591 6.000 1271 1188 B 122 LEU HDy% A 24 ILE H 1.0 1.757 3.457 1272 1189 B 111 VAL HB B 115 ASN HD22 1.0 1.972 5.082 1273 1190 A 7 GLU HBy A 7 GLU H 1.0 1.756 3.452 1274 1191 B 118 PHE HE1 B 118 PHE H 1.0 1.986 5.346 1275 1191 B 118 PHE HE2 B 118 PHE H 1.0 1.986 5.346 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 8 GLU H A 4 LYS O 1.0 1.73 2.7 2 2 A 9 ARG H A 5 GLU O 1.0 1.73 2.7 3 3 A 10 TYR H A 6 ASP O 1.0 1.73 2.7 4 4 A 11 GLN H A 7 GLU O 1.0 1.73 2.7 5 5 A 12 LYS H A 8 GLU O 1.0 1.73 2.7 6 6 A 13 LEU H A 9 ARG O 1.0 1.73 2.7 7 7 A 14 VAL H A 10 TYR O 1.0 1.73 2.7 8 8 A 15 THR H A 11 GLN O 1.0 1.73 2.7 9 9 A 16 GLU H A 12 LYS O 1.0 1.73 2.7 10 10 A 17 ASN H A 13 LEU O 1.0 1.73 2.7 11 11 A 18 GLU H A 14 VAL O 1.0 1.73 2.7 12 12 A 19 GLN H A 15 THR O 1.0 1.73 2.7 13 13 A 20 LEU H A 16 GLU O 1.0 1.73 2.7 14 14 A 21 GLN H A 17 ASN O 1.0 1.73 2.7 15 15 A 22 ARG H A 18 GLU O 1.0 1.73 2.7 16 16 A 23 LEU H A 19 GLN O 1.0 1.73 2.7 17 17 A 24 ILE H A 20 LEU O 1.0 1.73 2.7 18 18 A 25 THR H A 21 GLN O 1.0 1.73 2.7 19 19 A 26 GLN H A 22 ARG O 1.0 1.73 2.7 20 20 A 27 LYS H A 23 LEU O 1.0 1.73 2.7 21 21 A 28 GLU H A 24 ILE O 1.0 1.73 2.7 22 22 A 29 GLU H A 25 THR O 1.0 1.73 2.7 23 23 A 30 LYS H A 26 GLN O 1.0 1.73 2.7 24 24 A 31 ILE H A 27 LYS O 1.0 1.73 2.7 25 25 A 32 ARG H A 28 GLU O 1.0 1.73 2.7 26 26 A 33 VAL H A 29 GLU O 1.0 1.73 2.7 27 27 A 34 LEU H A 30 LYS O 1.0 1.73 2.7 28 28 A 35 ARG H A 31 ILE O 1.0 1.73 2.7 29 29 A 36 GLN H A 32 ARG O 1.0 1.73 2.7 30 30 A 37 ARG H A 33 VAL O 1.0 1.73 2.7 31 31 A 38 LEU H A 34 LEU O 1.0 1.73 2.7 32 32 A 39 VAL H A 35 ARG O 1.0 1.73 2.7 33 33 A 40 GLU H A 36 GLN O 1.0 1.73 2.7 34 34 B 106 GLN H B 102 SER O 1.0 1.73 2.7 35 35 B 107 ARG H B 103 GLU O 1.0 1.73 2.7 36 36 B 108 LEU H B 104 LEU O 1.0 1.73 2.7 37 37 B 109 ARG H B 105 GLU O 1.0 1.73 2.7 38 38 B 110 ASP H B 106 GLN O 1.0 1.73 2.7 39 39 B 111 VAL H B 107 ARG O 1.0 1.73 2.7 40 40 B 112 LYS H B 108 LEU O 1.0 1.73 2.7 41 41 B 113 ASN H B 109 ARG O 1.0 1.73 2.7 42 42 B 114 THR H B 110 ASP O 1.0 1.73 2.7 43 43 B 115 ASN H B 111 VAL O 1.0 1.73 2.7 44 44 B 116 SER H B 112 LYS O 1.0 1.73 2.7 45 45 B 117 ARG H B 113 ASN O 1.0 1.73 2.7 46 46 B 118 PHE H B 114 THR O 1.0 1.73 2.7 47 47 B 119 ARG H B 115 ASN O 1.0 1.73 2.7 48 48 B 120 LYS H B 116 SER O 1.0 1.73 2.7 49 49 B 121 ALA H B 117 ARG O 1.0 1.73 2.7 50 50 B 122 LEU H B 118 PHE O 1.0 1.73 2.7 51 51 B 123 MET H B 119 ARG O 1.0 1.73 2.7 52 52 B 124 GLU H B 120 LYS O 1.0 1.73 2.7 53 53 B 125 LYS H B 121 ALA O 1.0 1.73 2.7 54 54 B 126 GLU H B 122 LEU O 1.0 1.73 2.7 55 55 B 127 ASN H B 123 MET O 1.0 1.73 2.7 56 56 B 128 GLU H B 124 GLU O 1.0 1.73 2.7 57 57 B 129 LEU H B 125 LYS O 1.0 1.73 2.7 58 58 B 130 GLN H B 126 GLU O 1.0 1.73 2.7 59 59 B 131 ALA H B 127 ASN O 1.0 1.73 2.7 60 60 B 132 LEU H B 128 GLU O 1.0 1.73 2.7 61 61 B 133 ILE H B 129 LEU O 1.0 1.73 2.7 62 62 B 134 ARG H B 130 GLN O 1.0 1.73 2.7 63 63 B 135 LYS H B 131 ALA O 1.0 1.73 2.7 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 3 SER N A 3 SER CA A 3 SER C A 4 LYS N 1.0 -70.0 0.94 PSI 2 2 A 3 SER C A 4 LYS N A 4 LYS CA A 4 LYS C 1.0 -90.0 -31.90 PHI 3 3 A 4 LYS N A 4 LYS CA A 4 LYS C A 5 GLU N 1.0 -70.0 -7.12 PSI 4 4 A 4 LYS C A 5 GLU N A 5 GLU CA A 5 GLU C 1.0 -90.0 -20.80 PHI 5 5 A 5 GLU N A 5 GLU CA A 5 GLU C A 6 ASP N 1.0 -70.0 -17.44 PSI 6 6 A 5 GLU C A 6 ASP N A 6 ASP CA A 6 ASP C 1.0 -90.0 -38.88 PHI 7 7 A 6 ASP N A 6 ASP CA A 6 ASP C A 7 GLU N 1.0 -70.0 -15.62 PSI 8 8 A 6 ASP C A 7 GLU N A 7 GLU CA A 7 GLU C 1.0 -90.0 -37.46 PHI 9 9 A 7 GLU N A 7 GLU CA A 7 GLU C A 8 GLU N 1.0 -70.0 -19.48 PSI 10 10 A 7 GLU C A 8 GLU N A 8 GLU CA A 8 GLU C 1.0 -80.0 -48.42 PHI 11 11 A 8 GLU N A 8 GLU CA A 8 GLU C A 9 ARG N 1.0 -70.0 -15.20 PSI 12 12 A 8 GLU C A 9 ARG N A 9 ARG CA A 9 ARG C 1.0 -90.0 -39.42 PHI 13 13 A 9 ARG N A 9 ARG CA A 9 ARG C A 10 TYR N 1.0 -70.0 -13.76 PSI 14 14 A 9 ARG C A 10 TYR N A 10 TYR CA A 10 TYR C 1.0 -90.0 -39.94 PHI 15 15 A 10 TYR N A 10 TYR CA A 10 TYR C A 11 GLN N 1.0 -70.0 -19.12 PSI 16 16 A 10 TYR C A 11 GLN N A 11 GLN CA A 11 GLN C 1.0 -90.0 -32.72 PHI 17 17 A 11 GLN N A 11 GLN CA A 11 GLN C A 12 LYS N 1.0 -70.0 -11.04 PSI 18 18 A 11 GLN C A 12 LYS N A 12 LYS CA A 12 LYS C 1.0 -90.0 -34.38 PHI 19 19 A 12 LYS N A 12 LYS CA A 12 LYS C A 13 LEU N 1.0 -70.0 -17.14 PSI 20 20 A 12 LYS C A 13 LEU N A 13 LEU CA A 13 LEU C 1.0 -80.0 -49.04 PHI 21 21 A 13 LEU N A 13 LEU CA A 13 LEU C A 14 VAL N 1.0 -70.0 -17.98 PSI 22 22 A 13 LEU C A 14 VAL N A 14 VAL CA A 14 VAL C 1.0 -80.0 -48.84 PHI 23 23 A 14 VAL N A 14 VAL CA A 14 VAL C A 15 THR N 1.0 -70.0 -16.22 PSI 24 24 A 14 VAL C A 15 THR N A 15 THR CA A 15 THR C 1.0 -90.0 -39.86 PHI 25 25 A 15 THR N A 15 THR CA A 15 THR C A 16 GLU N 1.0 -60.0 -24.22 PSI 26 26 A 15 THR C A 16 GLU N A 16 GLU CA A 16 GLU C 1.0 -90.0 -39.86 PHI 27 27 A 16 GLU N A 16 GLU CA A 16 GLU C A 17 ASN N 1.0 -70.0 -18.60 PSI 28 28 A 16 GLU C A 17 ASN N A 17 ASN CA A 17 ASN C 1.0 -90.0 -39.70 PHI 29 29 A 17 ASN N A 17 ASN CA A 17 ASN C A 18 GLU N 1.0 -70.0 -10.86 PSI 30 30 A 17 ASN C A 18 GLU N A 18 GLU CA A 18 GLU C 1.0 -80.0 -48.90 PHI 31 31 A 18 GLU N A 18 GLU CA A 18 GLU C A 19 GLN N 1.0 -70.0 -18.62 PSI 32 32 A 18 GLU C A 19 GLN N A 19 GLN CA A 19 GLN C 1.0 -90.0 -39.98 PHI 33 33 A 19 GLN N A 19 GLN CA A 19 GLN C A 20 LEU N 1.0 -70.0 -19.68 PSI 34 34 A 19 GLN C A 20 LEU N A 20 LEU CA A 20 LEU C 1.0 -80.0 -39.30 PHI 35 35 A 20 LEU N A 20 LEU CA A 20 LEU C A 21 GLN N 1.0 -70.0 -18.06 PSI 36 36 A 20 LEU C A 21 GLN N A 21 GLN CA A 21 GLN C 1.0 -90.0 -35.44 PHI 37 37 A 21 GLN N A 21 GLN CA A 21 GLN C A 22 ARG N 1.0 -70.0 -13.20 PSI 38 38 A 21 GLN C A 22 ARG N A 22 ARG CA A 22 ARG C 1.0 -90.0 -37.08 PHI 39 39 A 22 ARG N A 22 ARG CA A 22 ARG C A 23 LEU N 1.0 -60.0 -15.22 PSI 40 40 A 22 ARG C A 23 LEU N A 23 LEU CA A 23 LEU C 1.0 -90.0 -39.72 PHI 41 41 A 23 LEU N A 23 LEU CA A 23 LEU C A 24 ILE N 1.0 -70.0 -11.88 PSI 42 42 A 23 LEU C A 24 ILE N A 24 ILE CA A 24 ILE C 1.0 -90.0 -39.14 PHI 43 43 A 24 ILE N A 24 ILE CA A 24 ILE C A 25 THR N 1.0 -70.0 -19.48 PSI 44 44 A 24 ILE C A 25 THR N A 25 THR CA A 25 THR C 1.0 -80.0 -45.34 PHI 45 45 A 25 THR N A 25 THR CA A 25 THR C A 26 GLN N 1.0 -70.0 -19.06 PSI 46 46 A 25 THR C A 26 GLN N A 26 GLN CA A 26 GLN C 1.0 -90.0 -39.06 PHI 47 47 A 26 GLN N A 26 GLN CA A 26 GLN C A 27 LYS N 1.0 -70.0 -16.74 PSI 48 48 A 26 GLN C A 27 LYS N A 27 LYS CA A 27 LYS C 1.0 -90.0 -39.84 PHI 49 49 A 27 LYS N A 27 LYS CA A 27 LYS C A 28 GLU N 1.0 -70.0 -16.56 PSI 50 50 A 27 LYS C A 28 GLU N A 28 GLU CA A 28 GLU C 1.0 -90.0 -37.04 PHI 51 51 A 28 GLU N A 28 GLU CA A 28 GLU C A 29 GLU N 1.0 -70.0 -12.36 PSI 52 52 A 28 GLU C A 29 GLU N A 29 GLU CA A 29 GLU C 1.0 -90.0 -39.76 PHI 53 53 A 29 GLU N A 29 GLU CA A 29 GLU C A 30 LYS N 1.0 -70.0 -17.56 PSI 54 54 A 29 GLU C A 30 LYS N A 30 LYS CA A 30 LYS C 1.0 -90.0 -39.54 PHI 55 55 A 30 LYS N A 30 LYS CA A 30 LYS C A 31 ILE N 1.0 -70.0 -19.30 PSI 56 56 A 30 LYS C A 31 ILE N A 31 ILE CA A 31 ILE C 1.0 -90.0 -39.34 PHI 57 57 A 31 ILE N A 31 ILE CA A 31 ILE C A 32 ARG N 1.0 -70.0 -19.72 PSI 58 58 A 31 ILE C A 32 ARG N A 32 ARG CA A 32 ARG C 1.0 -80.0 -48.96 PHI 59 59 A 32 ARG N A 32 ARG CA A 32 ARG C A 33 VAL N 1.0 -70.0 -7.96 PSI 60 60 A 32 ARG C A 33 VAL N A 33 VAL CA A 33 VAL C 1.0 -90.0 -39.90 PHI 61 61 A 33 VAL N A 33 VAL CA A 33 VAL C A 34 LEU N 1.0 -70.0 -19.76 PSI 62 62 A 33 VAL C A 34 LEU N A 34 LEU CA A 34 LEU C 1.0 -90.0 -33.28 PHI 63 63 A 34 LEU N A 34 LEU CA A 34 LEU C A 35 ARG N 1.0 -70.0 -18.28 PSI 64 64 A 34 LEU C A 35 ARG N A 35 ARG CA A 35 ARG C 1.0 -80.0 -35.42 PHI 65 65 A 35 ARG N A 35 ARG CA A 35 ARG C A 36 GLN N 1.0 -70.0 -20.02 PSI 66 66 A 35 ARG C A 36 GLN N A 36 GLN CA A 36 GLN C 1.0 -90.0 -30.82 PHI 67 67 A 36 GLN N A 36 GLN CA A 36 GLN C A 37 ARG N 1.0 -70.0 -17.04 PSI 68 68 A 36 GLN C A 37 ARG N A 37 ARG CA A 37 ARG C 1.0 -90.0 -32.88 PHI 69 69 A 37 ARG N A 37 ARG CA A 37 ARG C A 38 LEU N 1.0 -70.0 -16.24 PSI 70 70 A 37 ARG C A 38 LEU N A 38 LEU CA A 38 LEU C 1.0 -90.0 -30.08 PHI 71 71 A 38 LEU N A 38 LEU CA A 38 LEU C A 39 VAL N 1.0 -70.0 -17.38 PSI 72 72 A 38 LEU C A 39 VAL N A 39 VAL CA A 39 VAL C 1.0 -90.0 -40.04 PHI 73 73 A 39 VAL N A 39 VAL CA A 39 VAL C A 40 GLU N 1.0 -60.0 -28.40 PSI 74 74 A 39 VAL C A 40 GLU N A 40 GLU CA A 40 GLU C 1.0 -90.0 -30.92 PHI 75 75 A 40 GLU N A 40 GLU CA A 40 GLU C A 41 ARG N 1.0 -70.0 2.94 PSI 76 76 A 40 GLU C A 41 ARG N A 41 ARG CA A 41 ARG C 1.0 -120.0 -51.04 PHI 77 77 B 101 VAL C B 102 SER N B 102 SER CA B 102 SER C 1.0 -90.0 -23.40 PHI 78 78 B 102 SER N B 102 SER CA B 102 SER C B 103 GLU N 1.0 -60.0 -8.94 PSI 79 79 B 102 SER C B 103 GLU N B 103 GLU CA B 103 GLU C 1.0 -80.0 -33.94 PHI 80 80 B 103 GLU N B 103 GLU CA B 103 GLU C B 104 LEU N 1.0 -70.0 -18.52 PSI 81 81 B 103 GLU C B 104 LEU N B 104 LEU CA B 104 LEU C 1.0 -80.0 -46.82 PHI 82 82 B 104 LEU N B 104 LEU CA B 104 LEU C B 105 GLU N 1.0 -70.0 -18.76 PSI 83 83 B 104 LEU C B 105 GLU N B 105 GLU CA B 105 GLU C 1.0 -90.0 -39.68 PHI 84 84 B 105 GLU N B 105 GLU CA B 105 GLU C B 106 GLN N 1.0 -70.0 -19.06 PSI 85 85 B 105 GLU C B 106 GLN N B 106 GLN CA B 106 GLN C 1.0 -90.0 -39.58 PHI 86 86 B 106 GLN N B 106 GLN CA B 106 GLN C B 107 ARG N 1.0 -70.0 -19.20 PSI 87 87 B 106 GLN C B 107 ARG N B 107 ARG CA B 107 ARG C 1.0 -90.0 -28.84 PHI 88 88 B 107 ARG N B 107 ARG CA B 107 ARG C B 108 LEU N 1.0 -70.0 -18.54 PSI 89 89 B 107 ARG C B 108 LEU N B 108 LEU CA B 108 LEU C 1.0 -80.0 -41.98 PHI 90 90 B 108 LEU N B 108 LEU CA B 108 LEU C B 109 ARG N 1.0 -70.0 -19.06 PSI 91 91 B 108 LEU C B 109 ARG N B 109 ARG CA B 109 ARG C 1.0 -80.0 -49.76 PHI 92 92 B 109 ARG N B 109 ARG CA B 109 ARG C B 110 ASP N 1.0 -70.0 -18.42 PSI 93 93 B 109 ARG C B 110 ASP N B 110 ASP CA B 110 ASP C 1.0 -90.0 -38.36 PHI 94 94 B 110 ASP N B 110 ASP CA B 110 ASP C B 111 VAL N 1.0 -70.0 -15.02 PSI 95 95 B 110 ASP C B 111 VAL N B 111 VAL CA B 111 VAL C 1.0 -90.0 -38.72 PHI 96 96 B 111 VAL N B 111 VAL CA B 111 VAL C B 112 LYS N 1.0 -70.0 -5.06 PSI 97 97 B 111 VAL C B 112 LYS N B 112 LYS CA B 112 LYS C 1.0 -90.0 -29.52 PHI 98 98 B 112 LYS N B 112 LYS CA B 112 LYS C B 113 ASN N 1.0 -70.0 -16.18 PSI 99 99 B 112 LYS C B 113 ASN N B 113 ASN CA B 113 ASN C 1.0 -90.0 -38.98 PHI 100 100 B 113 ASN N B 113 ASN CA B 113 ASN C B 114 THR N 1.0 -70.0 -6.00 PSI 101 101 B 113 ASN C B 114 THR N B 114 THR CA B 114 THR C 1.0 -90.0 -39.88 PHI 102 102 B 114 THR N B 114 THR CA B 114 THR C B 115 ASN N 1.0 -70.0 -18.94 PSI 103 103 B 114 THR C B 115 ASN N B 115 ASN CA B 115 ASN C 1.0 -80.0 -47.94 PHI 104 104 B 115 ASN N B 115 ASN CA B 115 ASN C B 116 SER N 1.0 -70.0 -18.88 PSI 105 105 B 115 ASN C B 116 SER N B 116 SER CA B 116 SER C 1.0 -90.0 -39.34 PHI 106 106 B 116 SER N B 116 SER CA B 116 SER C B 117 ARG N 1.0 -70.0 -16.88 PSI 107 107 B 116 SER C B 117 ARG N B 117 ARG CA B 117 ARG C 1.0 -80.0 -49.76 PHI 108 108 B 117 ARG N B 117 ARG CA B 117 ARG C B 118 PHE N 1.0 -70.0 -19.68 PSI 109 109 B 117 ARG C B 118 PHE N B 118 PHE CA B 118 PHE C 1.0 -90.0 -39.76 PHI 110 110 B 118 PHE N B 118 PHE CA B 118 PHE C B 119 ARG N 1.0 -70.0 -18.30 PSI 111 111 B 118 PHE C B 119 ARG N B 119 ARG CA B 119 ARG C 1.0 -80.0 -33.20 PHI 112 112 B 119 ARG N B 119 ARG CA B 119 ARG C B 120 LYS N 1.0 -70.0 -19.26 PSI 113 113 B 119 ARG C B 120 LYS N B 120 LYS CA B 120 LYS C 1.0 -90.0 -39.46 PHI 114 114 B 120 LYS N B 120 LYS CA B 120 LYS C B 121 ALA N 1.0 -70.0 -18.68 PSI 115 115 B 120 LYS C B 121 ALA N B 121 ALA CA B 121 ALA C 1.0 -80.0 -35.76 PHI 116 116 B 121 ALA N B 121 ALA CA B 121 ALA C B 122 LEU N 1.0 -70.0 -17.36 PSI 117 117 B 121 ALA C B 122 LEU N B 122 LEU CA B 122 LEU C 1.0 -90.0 -38.16 PHI 118 118 B 122 LEU N B 122 LEU CA B 122 LEU C B 123 MET N 1.0 -70.0 -18.90 PSI 119 119 B 122 LEU C B 123 MET N B 123 MET CA B 123 MET C 1.0 -90.0 -39.62 PHI 120 120 B 123 MET N B 123 MET CA B 123 MET C B 124 GLU N 1.0 -70.0 -8.98 PSI 121 121 B 123 MET C B 124 GLU N B 124 GLU CA B 124 GLU C 1.0 -90.0 -39.92 PHI 122 122 B 124 GLU N B 124 GLU CA B 124 GLU C B 125 LYS N 1.0 -70.0 -19.16 PSI 123 123 B 124 GLU C B 125 LYS N B 125 LYS CA B 125 LYS C 1.0 -90.0 -39.82 PHI 124 124 B 125 LYS N B 125 LYS CA B 125 LYS C B 126 GLU N 1.0 -60.0 -19.56 PSI 125 125 B 125 LYS C B 126 GLU N B 126 GLU CA B 126 GLU C 1.0 -80.0 -37.00 PHI 126 126 B 126 GLU N B 126 GLU CA B 126 GLU C B 127 ASN N 1.0 -70.0 -19.32 PSI 127 127 B 126 GLU C B 127 ASN N B 127 ASN CA B 127 ASN C 1.0 -90.0 -39.92 PHI 128 128 B 127 ASN N B 127 ASN CA B 127 ASN C B 128 GLU N 1.0 -70.0 -5.60 PSI 129 129 B 127 ASN C B 128 GLU N B 128 GLU CA B 128 GLU C 1.0 -90.0 -39.90 PHI 130 130 B 128 GLU N B 128 GLU CA B 128 GLU C B 129 LEU N 1.0 -70.0 -19.36 PSI 131 131 B 128 GLU C B 129 LEU N B 129 LEU CA B 129 LEU C 1.0 -80.0 -49.20 PHI 132 132 B 129 LEU N B 129 LEU CA B 129 LEU C B 130 GLN N 1.0 -70.0 -17.94 PSI 133 133 B 129 LEU C B 130 GLN N B 130 GLN CA B 130 GLN C 1.0 -80.0 -49.80 PHI 134 134 B 130 GLN N B 130 GLN CA B 130 GLN C B 131 ALA N 1.0 -60.0 -26.84 PSI 135 135 B 130 GLN C B 131 ALA N B 131 ALA CA B 131 ALA C 1.0 -90.0 -39.36 PHI 136 136 B 131 ALA N B 131 ALA CA B 131 ALA C B 132 LEU N 1.0 -60.0 -18.00 PSI 137 137 B 131 ALA C B 132 LEU N B 132 LEU CA B 132 LEU C 1.0 -90.0 -39.60 PHI 138 138 B 132 LEU N B 132 LEU CA B 132 LEU C B 133 ILE N 1.0 -70.0 -19.74 PSI 139 139 B 132 LEU C B 133 ILE N B 133 ILE CA B 133 ILE C 1.0 -80.0 -48.14 PHI 140 140 B 133 ILE N B 133 ILE CA B 133 ILE C B 134 ARG N 1.0 -70.0 -19.66 PSI 141 141 B 133 ILE C B 134 ARG N B 134 ARG CA B 134 ARG C 1.0 -80.0 -48.50 PHI 142 142 B 134 ARG N B 134 ARG CA B 134 ARG C B 135 LYS N 1.0 -70.0 -13.44 PSI 143 143 B 134 ARG C B 135 LYS N B 135 LYS CA B 135 LYS C 1.0 -90.0 -37.42 PHI 144 144 B 135 LYS N B 135 LYS CA B 135 LYS C B 136 LEU N 1.0 -70.0 -10.66 PSI 145 145 B 135 LYS C B 136 LEU N B 136 LEU CA B 136 LEU C 1.0 -110.0 -25.52 PHI stop_ save_