data_nef_c17382_2l7w save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 PRO middle . false 3 A 3 VAL middle . . 4 A 4 ASP middle . . 5 A 5 LEU middle . . 6 A 6 SER middle . . 7 A 7 LYS middle . . 8 A 8 TRP middle . . 9 A 9 SER middle . . 10 A 10 GLY middle . false 11 A 11 PRO middle . false 12 A 12 LEU middle . . 13 A 13 SER middle . . 14 A 14 LEU middle . . 15 A 15 GLN middle . . 16 A 16 GLU middle . . 17 A 17 VAL middle . . 18 A 18 ASP middle . . 19 A 19 GLU middle . . 20 A 20 GLN middle . . 21 A 21 PRO middle . false 22 A 22 GLN middle . . 23 A 23 HIS middle . . 24 A 24 PRO middle . false 25 A 25 LEU middle . . 26 A 26 HIS middle . . 27 A 27 VAL middle . . 28 A 28 THR middle . . 29 A 29 TYR middle . . 30 A 30 ALA middle . . 31 A 31 GLY middle . false 32 A 32 ALA middle . . 33 A 33 ALA middle . . 34 A 34 VAL middle . . 35 A 35 ASP middle . . 36 A 36 GLU middle . . 37 A 37 LEU middle . . 38 A 38 GLY middle . false 39 A 39 LYS middle . . 40 A 40 VAL middle . . 41 A 41 LEU middle . . 42 A 42 THR middle . . 43 A 43 PRO middle . false 44 A 44 THR middle . . 45 A 45 GLN middle . . 46 A 46 VAL middle . . 47 A 47 LYS middle . . 48 A 48 ASN middle . . 49 A 49 ARG middle . . 50 A 50 PRO middle . false 51 A 51 THR middle . . 52 A 52 SER middle . . 53 A 53 ILE middle . . 54 A 54 SER middle . . 55 A 55 TRP middle . . 56 A 56 ASP middle . . 57 A 57 GLY middle . false 58 A 58 LEU middle . . 59 A 59 ASP middle . . 60 A 60 SER middle . . 61 A 61 GLY middle . false 62 A 62 LYS middle . . 63 A 63 LEU middle . . 64 A 64 TYR middle . . 65 A 65 THR middle . . 66 A 66 LEU middle . . 67 A 67 VAL middle . . 68 A 68 LEU middle . . 69 A 69 THR middle . . 70 A 70 ASP middle . . 71 A 71 PRO middle . false 72 A 72 ASP middle . . 73 A 73 ALA middle . . 74 A 74 PRO middle . true 75 A 75 SER middle . . 76 A 76 ARG middle . . 77 A 77 LYS middle . . 78 A 78 ASP middle . . 79 A 79 PRO middle . false 80 A 80 LYS middle . . 81 A 81 TYR middle . . 82 A 82 ARG middle . . 83 A 83 GLU middle . true 84 A 84 TRP middle . . 85 A 85 HIS middle . . 86 A 86 HIS middle . . 87 A 87 PHE middle . . 88 A 88 LEU middle . . 89 A 89 VAL middle . . 90 A 90 VAL middle . . 91 A 91 ASN middle . . 92 A 92 MET middle . . 93 A 93 LYS middle . . 94 A 94 GLY middle . false 95 A 95 ASN middle . . 96 A 96 ASP middle . . 97 A 97 ILE middle . . 98 A 98 SER middle . . 99 A 99 SER middle . . 100 A 100 GLY middle . false 101 A 101 THR middle . . 102 A 102 VAL middle . . 103 A 103 LEU middle . . 104 A 104 SER middle . . 105 A 105 ASP middle . . 106 A 106 TYR middle . . 107 A 107 VAL middle . . 108 A 108 GLY middle . false 109 A 109 SER middle . . 110 A 110 GLY middle . false 111 A 111 PRO middle . false 112 A 112 PRO middle . false 113 A 113 LYS middle . . 114 A 114 GLY middle . false 115 A 115 THR middle . . 116 A 116 GLY middle . false 117 A 117 LEU middle . . 118 A 118 HIS middle . . 119 A 119 ARG middle . . 120 A 120 TYR middle . . 121 A 121 VAL middle . . 122 A 122 TRP middle . . 123 A 123 LEU middle . . 124 A 124 VAL middle . . 125 A 125 TYR middle . . 126 A 126 GLU middle . . 127 A 127 GLN middle . . 128 A 128 ASP middle . . 129 A 129 ARG middle . . 130 A 130 PRO middle . false 131 A 131 LEU middle . . 132 A 132 LYS middle . . 133 A 133 CYS middle . . 134 A 134 ASP middle . . 135 A 135 GLU middle . . 136 A 136 PRO middle . false 137 A 137 ILE middle . . 138 A 138 LEU middle . . 139 A 139 SER middle . . 140 A 140 ASN middle . . 141 A 141 ARG middle . . 142 A 142 SER middle . . 143 A 143 GLY middle . false 144 A 144 ASP middle . . 145 A 145 HIS middle . . 146 A 146 ARG middle . . 147 A 147 GLY middle . false 148 A 148 LYS middle . . 149 A 149 PHE middle . . 150 A 150 LYS middle . . 151 A 151 VAL middle . . 152 A 152 ALA middle . . 153 A 153 SER middle . . 154 A 154 PHE middle . . 155 A 155 ARG middle . . 156 A 156 LYS middle . . 157 A 157 LYS middle . . 158 A 158 TYR middle . . 159 A 159 GLU middle . . 160 A 160 LEU middle . . 161 A 161 ARG middle . . 162 A 162 ALA middle . . 163 A 163 PRO middle . false 164 A 164 VAL middle . . 165 A 165 ALA middle . . 166 A 166 GLY middle . false 167 A 167 THR middle . . 168 A 168 CYS middle . . 169 A 169 TYR middle . . 170 A 170 GLN middle . . 171 A 171 ALA middle . . 172 A 172 GLU middle . . 173 A 173 TRP middle . . 174 A 174 ASP middle . . 175 A 175 ASP middle . . 176 A 176 TYR middle . . 177 A 177 VAL middle . . 178 A 178 PRO middle . false 179 A 179 LYS middle . . 180 A 180 LEU middle . . 181 A 181 TYR middle . . 182 A 182 GLU middle . . 183 A 183 GLN middle . . 184 A 184 LEU middle . . 185 A 185 SER middle . . 186 A 186 GLY middle . false 187 A 187 LYS end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 MET H1 H 1 8.546 0.005 A 1 MET HA H 1 4.846 0.011 A 1 MET HBx H 1 2.007 0.020 A 1 MET HBy H 1 2.097 0.017 A 1 MET HGx H 1 2.581 0.012 A 1 MET HGy H 1 2.664 0.014 A 1 MET C C 13 175.296 0.007 A 1 MET CA C 13 54.311 0.060 A 1 MET CB C 13 33.562 0.077 A 1 MET CG C 13 33.298 0.087 A 1 MET N N 15 125.427 0.027 A 2 PRO HA H 1 4.523 0.011 A 2 PRO HBx H 1 1.997 0.019 A 2 PRO HBy H 1 2.344 0.012 A 2 PRO HDx H 1 3.753 0.018 A 2 PRO HDy H 1 3.862 0.010 A 2 PRO HGx H 1 2.061 0.013 A 2 PRO HGy H 1 2.061 0.013 A 2 PRO C C 13 178.055 0.043 A 2 PRO CA C 13 64.233 0.055 A 2 PRO CB C 13 33.252 0.049 A 2 PRO CD C 13 51.867 0.040 A 2 PRO CG C 13 28.571 0.047 A 3 VAL H H 1 8.317 0.003 A 3 VAL HA H 1 3.986 0.016 A 3 VAL HB H 1 2.040 0.015 A 3 VAL HGx% H 1 0.989 0.007 A 3 VAL HGy% H 1 1.010 0.015 A 3 VAL C C 13 176.321 0.023 A 3 VAL CA C 13 64.263 0.069 A 3 VAL CB C 13 33.438 0.066 A 3 VAL CGy C 13 22.544 0.019 A 3 VAL CGx C 13 21.919 0.028 A 3 VAL N N 15 121.987 0.020 A 4 ASP H H 1 8.399 0.008 A 4 ASP HA H 1 4.757 0.016 A 4 ASP HBx H 1 2.790 0.014 A 4 ASP HBy H 1 2.929 0.016 A 4 ASP C C 13 177.905 0.050 A 4 ASP CA C 13 54.397 0.104 A 4 ASP CB C 13 42.380 0.064 A 4 ASP N N 15 125.902 0.020 A 5 LEU H H 1 8.729 0.003 A 5 LEU HA H 1 4.395 0.018 A 5 LEU HBx H 1 1.598 0.013 A 5 LEU HBy H 1 1.744 0.008 A 5 LEU HDx% H 1 0.899 0.017 A 5 LEU HDy% H 1 0.618 0.013 A 5 LEU HG H 1 1.630 0.014 A 5 LEU C C 13 178.780 0.058 A 5 LEU CA C 13 56.730 0.059 A 5 LEU CB C 13 43.272 0.074 A 5 LEU CDx C 13 24.611 0.022 A 5 LEU CDy C 13 26.792 0.047 A 5 LEU CG C 13 28.056 0.071 A 5 LEU N N 15 123.690 0.038 A 6 SER H H 1 8.568 0.005 A 6 SER HA H 1 4.300 0.012 A 6 SER HBx H 1 4.030 0.008 A 6 SER HBy H 1 4.030 0.008 A 6 SER C C 13 177.532 0.022 A 6 SER CA C 13 62.801 0.054 A 6 SER CB C 13 63.537 0.092 A 6 SER N N 15 116.761 0.010 A 7 LYS H H 1 7.735 0.004 A 7 LYS HA H 1 4.487 0.020 A 7 LYS HBx H 1 1.889 0.016 A 7 LYS HBy H 1 2.064 0.012 A 7 LYS HDx H 1 1.701 0.008 A 7 LYS HDy H 1 1.701 0.008 A 7 LYS HEx H 1 3.064 0.005 A 7 LYS HEy H 1 3.064 0.005 A 7 LYS HGx H 1 1.439 0.021 A 7 LYS HGy H 1 1.592 0.010 A 7 LYS C C 13 178.312 0.037 A 7 LYS CA C 13 57.005 0.060 A 7 LYS CB C 13 32.791 0.080 A 7 LYS CD C 13 29.779 0.029 A 7 LYS CE C 13 43.565 0.000 A 7 LYS CG C 13 26.654 0.043 A 7 LYS N N 15 120.294 0.033 A 8 TRP H H 1 8.447 0.003 A 8 TRP HA H 1 3.847 0.013 A 8 TRP HBx H 1 3.384 0.015 A 8 TRP HBy H 1 3.791 0.019 A 8 TRP HD1 H 1 7.076 0.000 A 8 TRP C C 13 175.464 0.017 A 8 TRP CA C 13 63.419 0.066 A 8 TRP CB C 13 30.768 0.052 A 8 TRP N N 15 126.098 0.033 A 9 SER H H 1 7.763 0.004 A 9 SER HA H 1 5.293 0.015 A 9 SER HBx H 1 3.988 0.018 A 9 SER HBy H 1 4.042 0.018 A 9 SER C C 13 177.209 0.000 A 9 SER CA C 13 57.886 0.071 A 9 SER CB C 13 64.309 0.052 A 9 SER N N 15 106.454 0.017 A 10 GLY H H 1 7.318 0.005 A 10 GLY HAx H 1 3.919 0.013 A 10 GLY HAy H 1 4.360 0.018 A 10 GLY C C 13 174.137 0.000 A 10 GLY CA C 13 45.147 0.068 A 10 GLY N N 15 109.828 0.009 A 11 PRO HA H 1 4.236 0.014 A 11 PRO HBx H 1 1.836 0.014 A 11 PRO HBy H 1 2.350 0.015 A 11 PRO HDx H 1 3.640 0.014 A 11 PRO HDy H 1 3.912 0.016 A 11 PRO HGx H 1 2.025 0.019 A 11 PRO HGy H 1 2.025 0.019 A 11 PRO C C 13 179.794 0.073 A 11 PRO CA C 13 66.409 0.067 A 11 PRO CB C 13 33.132 0.045 A 11 PRO CD C 13 51.264 0.093 A 11 PRO CG C 13 28.558 0.060 A 12 LEU H H 1 9.139 0.005 A 12 LEU HA H 1 3.878 0.015 A 12 LEU HBx H 1 1.069 0.013 A 12 LEU HBy H 1 1.595 0.015 A 12 LEU HDx% H 1 0.619 0.009 A 12 LEU HDy% H 1 0.669 0.011 A 12 LEU HG H 1 1.589 0.010 A 12 LEU C C 13 177.109 0.028 A 12 LEU CA C 13 58.234 0.075 A 12 LEU CB C 13 43.475 0.071 A 12 LEU CDy C 13 27.203 0.046 A 12 LEU CDx C 13 23.712 0.094 A 12 LEU CG C 13 28.150 0.055 A 12 LEU N N 15 118.371 0.020 A 13 SER H H 1 8.583 0.008 A 13 SER HA H 1 4.386 0.016 A 13 SER HBx H 1 3.484 0.012 A 13 SER HBy H 1 3.841 0.014 A 13 SER C C 13 176.827 0.000 A 13 SER CA C 13 58.750 0.070 A 13 SER CB C 13 63.662 0.085 A 13 SER N N 15 112.100 0.019 A 14 LEU H H 1 8.132 0.008 A 14 LEU HA H 1 3.486 0.012 A 14 LEU HBx H 1 -0.281 0.024 A 14 LEU HBy H 1 -0.098 0.014 A 14 LEU HDx% H 1 -0.096 0.010 A 14 LEU HDy% H 1 0.473 0.012 A 14 LEU HG H 1 1.013 0.018 A 14 LEU C C 13 179.713 0.054 A 14 LEU CA C 13 58.042 0.074 A 14 LEU CB C 13 38.506 0.050 A 14 LEU CDy C 13 26.933 0.037 A 14 LEU CDx C 13 24.984 0.048 A 14 LEU CG C 13 26.611 0.103 A 14 LEU N N 15 117.252 0.061 A 15 GLN H H 1 9.554 0.005 A 15 GLN HA H 1 4.823 0.012 A 15 GLN HBx H 1 2.172 0.013 A 15 GLN HBy H 1 2.172 0.013 A 15 GLN HE2y H 1 7.384 0.005 A 15 GLN HE2x H 1 6.983 0.005 A 15 GLN HGx H 1 2.668 0.013 A 15 GLN HGy H 1 2.668 0.013 A 15 GLN C C 13 178.578 0.046 A 15 GLN CA C 13 58.398 0.074 A 15 GLN CB C 13 26.435 0.074 A 15 GLN CG C 13 33.781 0.065 A 15 GLN N N 15 122.877 0.018 A 15 GLN NE2 N 15 109.763 0.063 A 16 GLU H H 1 7.652 0.005 A 16 GLU HA H 1 4.093 0.013 A 16 GLU HBx H 1 2.002 0.023 A 16 GLU HBy H 1 2.002 0.023 A 16 GLU HGx H 1 2.290 0.013 A 16 GLU HGy H 1 2.478 0.018 A 16 GLU C C 13 177.599 0.039 A 16 GLU CA C 13 59.351 0.060 A 16 GLU CB C 13 31.682 0.070 A 16 GLU CG C 13 38.296 0.099 A 16 GLU N N 15 120.432 0.025 A 17 VAL H H 1 8.380 0.004 A 17 VAL HA H 1 3.969 0.012 A 17 VAL HB H 1 2.278 0.010 A 17 VAL HGx% H 1 0.998 0.011 A 17 VAL HGy% H 1 0.798 0.012 A 17 VAL C C 13 176.177 0.030 A 17 VAL CA C 13 66.159 0.054 A 17 VAL CB C 13 33.226 0.065 A 17 VAL CGy C 13 24.369 0.017 A 17 VAL CGx C 13 22.624 0.049 A 17 VAL N N 15 120.584 0.038 A 18 ASP H H 1 8.155 0.010 A 18 ASP HA H 1 4.770 0.017 A 18 ASP HBx H 1 2.618 0.016 A 18 ASP HBy H 1 3.004 0.018 A 18 ASP C C 13 174.918 0.023 A 18 ASP CA C 13 54.456 0.057 A 18 ASP CB C 13 44.106 0.048 A 18 ASP N N 15 111.947 0.014 A 19 GLU H H 1 8.960 0.003 A 19 GLU HA H 1 4.004 0.016 A 19 GLU HBx H 1 1.626 0.013 A 19 GLU HBy H 1 2.030 0.017 A 19 GLU HGx H 1 2.166 0.016 A 19 GLU HGy H 1 2.232 0.013 A 19 GLU C C 13 173.552 0.023 A 19 GLU CA C 13 56.914 0.077 A 19 GLU CB C 13 32.936 0.072 A 19 GLU CG C 13 38.284 0.051 A 19 GLU N N 15 118.762 0.040 A 20 GLN H H 1 7.729 0.005 A 20 GLN HA H 1 1.899 0.011 A 20 GLN HBx H 1 1.447 0.009 A 20 GLN HBy H 1 1.778 0.009 A 20 GLN HE2y H 1 7.406 0.006 A 20 GLN HE2x H 1 6.712 0.004 A 20 GLN HGx H 1 1.588 0.023 A 20 GLN HGy H 1 2.120 0.010 A 20 GLN C C 13 175.202 0.000 A 20 GLN CA C 13 54.320 0.069 A 20 GLN CB C 13 31.413 0.003 A 20 GLN CG C 13 33.631 0.000 A 20 GLN N N 15 117.950 0.016 A 20 GLN NE2 N 15 113.533 0.030 A 21 PRO HA H 1 4.331 0.014 A 21 PRO HBx H 1 1.211 0.018 A 21 PRO HBy H 1 1.350 0.017 A 21 PRO HDy H 1 1.663 0.007 A 21 PRO HGx H 1 0.852 0.008 A 21 PRO HGy H 1 0.934 0.014 A 21 PRO C C 13 176.060 0.020 A 21 PRO CA C 13 61.819 0.056 A 21 PRO CB C 13 33.507 0.062 A 21 PRO CD C 13 50.398 0.059 A 21 PRO CG C 13 28.482 0.072 A 22 GLN H H 1 6.736 0.002 A 22 GLN HA H 1 3.714 0.013 A 22 GLN HBx H 1 1.603 0.015 A 22 GLN HBy H 1 2.109 0.018 A 22 GLN HE2y H 1 7.508 0.011 A 22 GLN HE2x H 1 6.832 0.005 A 22 GLN HGx H 1 2.093 0.015 A 22 GLN HGy H 1 2.302 0.014 A 22 GLN C C 13 177.177 0.026 A 22 GLN CA C 13 59.434 0.057 A 22 GLN CB C 13 30.760 0.042 A 22 GLN CG C 13 35.340 0.049 A 22 GLN N N 15 116.547 0.016 A 22 GLN NE2 N 15 113.218 0.009 A 23 HIS H H 1 7.492 0.011 A 23 HIS HA H 1 5.271 0.016 A 23 HIS HBx H 1 3.021 0.017 A 23 HIS HBy H 1 3.762 0.019 A 23 HIS HD2 H 1 7.609 0.000 A 23 HIS HE1 H 1 6.722 0.000 A 23 HIS C C 13 173.594 0.000 A 23 HIS CA C 13 53.226 0.035 A 23 HIS CB C 13 32.023 0.097 A 23 HIS N N 15 113.153 0.026 A 24 PRO HA H 1 4.808 0.013 A 24 PRO HBx H 1 1.849 0.014 A 24 PRO HBy H 1 2.156 0.008 A 24 PRO HDx H 1 3.937 0.014 A 24 PRO HDy H 1 4.275 0.020 A 24 PRO HGx H 1 2.278 0.014 A 24 PRO HGy H 1 2.349 0.007 A 24 PRO C C 13 176.846 0.035 A 24 PRO CA C 13 63.583 0.075 A 24 PRO CB C 13 33.250 0.085 A 24 PRO CD C 13 51.664 0.069 A 24 PRO CG C 13 29.093 0.035 A 25 LEU H H 1 7.547 0.008 A 25 LEU HA H 1 4.587 0.017 A 25 LEU HBx H 1 0.812 0.015 A 25 LEU HBy H 1 1.407 0.017 A 25 LEU HDx% H 1 0.809 0.012 A 25 LEU HDy% H 1 0.441 0.014 A 25 LEU HG H 1 1.244 0.012 A 25 LEU C C 13 175.815 0.003 A 25 LEU CA C 13 54.408 0.074 A 25 LEU CB C 13 45.252 0.064 A 25 LEU CDx C 13 26.645 0.066 A 25 LEU CDy C 13 28.273 0.043 A 25 LEU CG C 13 27.527 0.013 A 25 LEU N N 15 124.614 0.019 A 26 HIS H H 1 9.273 0.004 A 26 HIS HA H 1 4.884 0.009 A 26 HIS HBx H 1 3.165 0.017 A 26 HIS HBy H 1 3.165 0.017 A 26 HIS C C 13 175.448 0.021 A 26 HIS CA C 13 56.387 0.090 A 26 HIS CB C 13 29.346 0.051 A 26 HIS N N 15 126.981 0.048 A 27 VAL H H 1 7.589 0.004 A 27 VAL HA H 1 4.351 0.012 A 27 VAL HB H 1 1.586 0.012 A 27 VAL HGx% H 1 0.211 0.017 A 27 VAL HGy% H 1 0.211 0.017 A 27 VAL C C 13 175.076 0.014 A 27 VAL CA C 13 62.692 0.051 A 27 VAL CB C 13 35.977 0.053 A 27 VAL CGx C 13 22.431 0.060 A 27 VAL CGy C 13 22.431 0.060 A 27 VAL N N 15 124.998 0.024 A 28 THR H H 1 8.448 0.012 A 28 THR HA H 1 4.576 0.016 A 28 THR HB H 1 3.953 0.013 A 28 THR HG2% H 1 1.132 0.019 A 28 THR C C 13 173.383 0.006 A 28 THR CA C 13 62.742 0.063 A 28 THR CB C 13 71.815 0.066 A 28 THR CG2 C 13 22.853 0.073 A 28 THR N N 15 122.727 0.030 A 29 TYR H H 1 9.010 0.012 A 29 TYR HA H 1 4.554 0.014 A 29 TYR HBx H 1 2.569 0.018 A 29 TYR HBy H 1 3.202 0.010 A 29 TYR C C 13 176.035 0.023 A 29 TYR CA C 13 57.875 0.073 A 29 TYR CB C 13 41.387 0.062 A 29 TYR N N 15 123.598 0.024 A 30 ALA H H 1 8.423 0.010 A 30 ALA HA H 1 4.119 0.011 A 30 ALA HB% H 1 1.369 0.015 A 30 ALA C C 13 179.051 0.046 A 30 ALA CA C 13 55.747 0.080 A 30 ALA CB C 13 18.851 0.058 A 30 ALA N N 15 124.342 0.022 A 31 GLY H H 1 8.631 0.003 A 31 GLY HAx H 1 3.696 0.011 A 31 GLY HAy H 1 4.292 0.017 A 31 GLY C C 13 175.001 0.005 A 31 GLY CA C 13 46.451 0.065 A 31 GLY N N 15 107.182 0.036 A 32 ALA H H 1 7.305 0.002 A 32 ALA HA H 1 4.652 0.017 A 32 ALA HB% H 1 1.234 0.011 A 32 ALA C C 13 175.728 0.012 A 32 ALA CA C 13 52.724 0.059 A 32 ALA CB C 13 23.562 0.023 A 32 ALA N N 15 120.889 0.015 A 33 ALA H H 1 8.663 0.010 A 33 ALA HA H 1 5.064 0.013 A 33 ALA HB% H 1 1.393 0.016 A 33 ALA C C 13 177.543 0.038 A 33 ALA CA C 13 52.507 0.085 A 33 ALA CB C 13 23.517 0.032 A 33 ALA N N 15 121.369 0.026 A 34 VAL H H 1 8.643 0.006 A 34 VAL HA H 1 4.210 0.013 A 34 VAL HB H 1 2.435 0.016 A 34 VAL HGx% H 1 1.363 0.011 A 34 VAL HGy% H 1 1.185 0.015 A 34 VAL C C 13 176.509 0.031 A 34 VAL CA C 13 63.571 0.064 A 34 VAL CB C 13 31.441 0.067 A 34 VAL CGy C 13 25.762 0.059 A 34 VAL CGx C 13 23.872 0.027 A 34 VAL N N 15 119.679 0.027 A 35 ASP H H 1 8.216 0.004 A 35 ASP HA H 1 4.740 0.016 A 35 ASP HBx H 1 2.497 0.020 A 35 ASP HBy H 1 3.045 0.019 A 35 ASP C C 13 175.287 0.054 A 35 ASP CA C 13 54.553 0.099 A 35 ASP CB C 13 41.551 0.068 A 35 ASP N N 15 126.387 0.021 A 36 GLU H H 1 7.470 0.003 A 36 GLU HA H 1 4.533 0.012 A 36 GLU HBx H 1 2.066 0.009 A 36 GLU HBy H 1 2.066 0.009 A 36 GLU HGx H 1 2.293 0.024 A 36 GLU HGy H 1 2.293 0.024 A 36 GLU C C 13 176.149 0.022 A 36 GLU CA C 13 56.340 0.056 A 36 GLU CB C 13 34.052 0.026 A 36 GLU CG C 13 36.183 0.000 A 36 GLU N N 15 116.290 0.060 A 37 LEU H H 1 9.079 0.004 A 37 LEU HA H 1 4.300 0.015 A 37 LEU HBx H 1 1.503 0.016 A 37 LEU HBy H 1 1.886 0.018 A 37 LEU HDx% H 1 0.993 0.013 A 37 LEU HDy% H 1 1.183 0.011 A 37 LEU HG H 1 1.448 0.015 A 37 LEU C C 13 178.943 0.018 A 37 LEU CA C 13 58.172 0.052 A 37 LEU CB C 13 42.645 0.071 A 37 LEU CDy C 13 27.057 0.042 A 37 LEU CDx C 13 26.247 0.054 A 37 LEU CG C 13 28.209 0.090 A 37 LEU N N 15 125.829 0.019 A 38 GLY H H 1 9.221 0.005 A 38 GLY HAx H 1 3.364 0.019 A 38 GLY HAy H 1 4.245 0.019 A 38 GLY C C 13 174.136 0.012 A 38 GLY CA C 13 46.886 0.066 A 38 GLY N N 15 115.635 0.024 A 39 LYS H H 1 7.589 0.014 A 39 LYS HA H 1 4.071 0.016 A 39 LYS HBx H 1 2.006 0.013 A 39 LYS HBy H 1 2.356 0.018 A 39 LYS HDx H 1 2.090 0.015 A 39 LYS HDy H 1 2.090 0.015 A 39 LYS HEx H 1 3.210 0.013 A 39 LYS HEy H 1 3.210 0.013 A 39 LYS HGx H 1 1.622 0.015 A 39 LYS HGy H 1 1.622 0.015 A 39 LYS C C 13 176.056 0.028 A 39 LYS CA C 13 58.248 0.056 A 39 LYS CB C 13 36.568 0.078 A 39 LYS CD C 13 32.001 0.080 A 39 LYS CE C 13 43.376 0.053 A 39 LYS CG C 13 26.077 0.060 A 39 LYS N N 15 122.465 0.047 A 40 VAL H H 1 8.713 0.004 A 40 VAL HA H 1 4.793 0.013 A 40 VAL HB H 1 2.056 0.016 A 40 VAL HGx% H 1 1.068 0.015 A 40 VAL HGy% H 1 0.960 0.023 A 40 VAL C C 13 177.238 0.034 A 40 VAL CA C 13 64.292 0.054 A 40 VAL CB C 13 32.848 0.084 A 40 VAL CGy C 13 23.169 0.063 A 40 VAL CGx C 13 23.019 0.057 A 40 VAL N N 15 128.651 0.016 A 41 LEU H H 1 9.178 0.005 A 41 LEU HA H 1 4.906 0.015 A 41 LEU HBx H 1 1.214 0.016 A 41 LEU HBy H 1 1.214 0.016 A 41 LEU HDx% H 1 0.747 0.013 A 41 LEU HDy% H 1 0.193 0.016 A 41 LEU HG H 1 1.551 0.015 A 41 LEU C C 13 177.452 0.031 A 41 LEU CA C 13 54.072 0.049 A 41 LEU CB C 13 47.105 0.066 A 41 LEU CDx C 13 25.219 0.041 A 41 LEU CDy C 13 27.049 0.042 A 41 LEU CG C 13 28.880 0.056 A 41 LEU N N 15 130.551 0.018 A 42 THR H H 1 8.583 0.003 A 42 THR HA H 1 4.971 0.015 A 42 THR HB H 1 4.776 0.017 A 42 THR HG2% H 1 1.206 0.014 A 42 THR C C 13 175.648 0.000 A 42 THR CA C 13 59.610 0.060 A 42 THR CB C 13 69.850 0.095 A 42 THR CG2 C 13 22.828 0.058 A 42 THR N N 15 110.765 0.041 A 43 PRO HA H 1 3.771 0.008 A 43 PRO HBx H 1 2.375 0.007 A 43 PRO HBy H 1 2.375 0.007 A 43 PRO HDx H 1 3.710 0.003 A 43 PRO HDy H 1 4.115 0.010 A 43 PRO C C 13 180.671 0.056 A 43 PRO CA C 13 66.441 0.055 A 43 PRO CB C 13 30.755 0.105 A 43 PRO CD C 13 52.799 0.079 A 44 THR H H 1 8.621 0.009 A 44 THR HA H 1 3.134 0.013 A 44 THR HB H 1 3.860 0.015 A 44 THR HG1 H 1 4.761 0.007 A 44 THR HG2% H 1 0.922 0.014 A 44 THR C C 13 177.465 0.000 A 44 THR CA C 13 69.533 0.076 A 44 THR CB C 13 69.429 0.092 A 44 THR CG2 C 13 21.682 0.055 A 44 THR N N 15 115.867 0.024 A 45 GLN H H 1 7.673 0.013 A 45 GLN HA H 1 3.750 0.015 A 45 GLN HBx H 1 1.353 0.018 A 45 GLN HBy H 1 2.355 0.023 A 45 GLN HE2y H 1 7.391 0.005 A 45 GLN HE2x H 1 6.708 0.006 A 45 GLN HGx H 1 2.230 0.023 A 45 GLN HGy H 1 2.387 0.022 A 45 GLN C C 13 179.438 0.056 A 45 GLN CA C 13 59.739 0.091 A 45 GLN CB C 13 30.378 0.067 A 45 GLN CG C 13 36.351 0.033 A 45 GLN N N 15 119.801 0.027 A 45 GLN NE2 N 15 111.019 0.094 A 46 VAL H H 1 6.860 0.010 A 46 VAL HA H 1 4.036 0.014 A 46 VAL HB H 1 2.036 0.013 A 46 VAL HGx% H 1 -0.785 0.008 A 46 VAL HGy% H 1 0.608 0.013 A 46 VAL C C 13 176.125 0.029 A 46 VAL CA C 13 60.351 0.063 A 46 VAL CB C 13 31.230 0.063 A 46 VAL CGy C 13 21.127 0.036 A 46 VAL CGx C 13 19.153 0.055 A 46 VAL N N 15 109.138 0.026 A 47 LYS H H 1 6.585 0.001 A 47 LYS HA H 1 4.149 0.013 A 47 LYS HBx H 1 0.953 0.013 A 47 LYS HBy H 1 1.364 0.013 A 47 LYS HDx H 1 1.098 0.018 A 47 LYS HDy H 1 1.098 0.018 A 47 LYS HEx H 1 2.530 0.013 A 47 LYS HEy H 1 2.699 0.013 A 47 LYS HGx H 1 0.954 0.022 A 47 LYS HGy H 1 1.192 0.003 A 47 LYS C C 13 176.918 0.031 A 47 LYS CA C 13 59.448 0.065 A 47 LYS CB C 13 32.590 0.051 A 47 LYS CD C 13 30.510 0.037 A 47 LYS CE C 13 42.515 0.067 A 47 LYS CG C 13 23.464 0.045 A 47 LYS N N 15 120.707 0.017 A 48 ASN H H 1 8.101 0.007 A 48 ASN HA H 1 5.059 0.014 A 48 ASN HBx H 1 2.473 0.013 A 48 ASN HBy H 1 2.776 0.015 A 48 ASN HD2y H 1 7.546 0.004 A 48 ASN HD2x H 1 6.919 0.006 A 48 ASN C C 13 173.451 0.028 A 48 ASN CA C 13 52.087 0.050 A 48 ASN CB C 13 42.742 0.062 A 48 ASN N N 15 119.278 0.019 A 48 ASN ND2 N 15 113.109 0.016 A 49 ARG H H 1 7.569 0.003 A 49 ARG HA H 1 2.639 0.019 A 49 ARG HBx H 1 1.045 0.016 A 49 ARG HBy H 1 1.150 0.020 A 49 ARG HDx H 1 2.886 0.012 A 49 ARG HDy H 1 3.029 0.017 A 49 ARG HGx H 1 0.749 0.015 A 49 ARG HGy H 1 1.316 0.015 A 49 ARG C C 13 175.167 0.000 A 49 ARG CA C 13 55.329 0.037 A 49 ARG CB C 13 30.747 0.058 A 49 ARG CD C 13 45.749 0.031 A 49 ARG CG C 13 28.162 0.051 A 49 ARG N N 15 114.582 0.018 A 50 PRO HA H 1 3.856 0.014 A 50 PRO HBx H 1 1.154 0.017 A 50 PRO HBy H 1 1.221 0.021 A 50 PRO HDx H 1 3.075 0.013 A 50 PRO HDy H 1 3.513 0.020 A 50 PRO HGx H 1 1.337 0.012 A 50 PRO HGy H 1 1.337 0.012 A 50 PRO C C 13 176.599 0.007 A 50 PRO CA C 13 64.561 0.060 A 50 PRO CB C 13 32.959 0.052 A 50 PRO CD C 13 51.153 0.068 A 50 PRO CG C 13 28.609 0.053 A 51 THR H H 1 8.688 0.005 A 51 THR HA H 1 3.948 0.015 A 51 THR HB H 1 4.080 0.015 A 51 THR HG2% H 1 1.102 0.013 A 51 THR C C 13 177.407 0.038 A 51 THR CA C 13 63.393 0.057 A 51 THR CB C 13 69.807 0.093 A 51 THR CG2 C 13 23.665 0.041 A 51 THR N N 15 113.106 0.014 A 52 SER H H 1 7.297 0.003 A 52 SER HA H 1 4.533 0.013 A 52 SER HBx H 1 3.630 0.014 A 52 SER HBy H 1 3.630 0.014 A 52 SER C C 13 173.471 0.008 A 52 SER CA C 13 59.331 0.073 A 52 SER CB C 13 66.088 0.083 A 52 SER N N 15 113.982 0.013 A 53 ILE H H 1 8.390 0.002 A 53 ILE HA H 1 5.299 0.015 A 53 ILE HB H 1 1.722 0.014 A 53 ILE HD1% H 1 0.729 0.019 A 53 ILE HG1x H 1 1.057 0.013 A 53 ILE HG1y H 1 1.641 0.021 A 53 ILE HG2% H 1 0.520 0.011 A 53 ILE C C 13 175.641 0.034 A 53 ILE CA C 13 60.358 0.080 A 53 ILE CB C 13 43.092 0.066 A 53 ILE CD1 C 13 15.977 0.039 A 53 ILE CG1 C 13 26.813 0.063 A 53 ILE CG2 C 13 19.224 0.040 A 53 ILE N N 15 117.329 0.016 A 54 SER H H 1 8.585 0.004 A 54 SER HA H 1 4.122 0.011 A 54 SER HBx H 1 3.613 0.014 A 54 SER HBy H 1 3.613 0.014 A 54 SER C C 13 172.627 0.021 A 54 SER CA C 13 60.250 0.055 A 54 SER CB C 13 65.090 0.060 A 54 SER N N 15 112.703 0.023 A 55 TRP H H 1 6.595 0.007 A 55 TRP HA H 1 4.898 0.016 A 55 TRP HBx H 1 2.762 0.012 A 55 TRP HBy H 1 3.368 0.020 A 55 TRP HD1 H 1 6.781 0.007 A 55 TRP C C 13 175.023 0.018 A 55 TRP CA C 13 57.923 0.044 A 55 TRP CB C 13 34.180 0.046 A 55 TRP N N 15 119.829 0.034 A 56 ASP H H 1 9.418 0.004 A 56 ASP HA H 1 4.193 0.015 A 56 ASP HBx H 1 2.224 0.014 A 56 ASP HBy H 1 2.422 0.014 A 56 ASP C C 13 176.160 0.026 A 56 ASP CA C 13 56.104 0.040 A 56 ASP CB C 13 41.496 0.060 A 56 ASP N N 15 124.524 0.017 A 57 GLY H H 1 8.254 0.005 A 57 GLY HAx H 1 3.443 0.013 A 57 GLY HAy H 1 3.956 0.013 A 57 GLY C C 13 176.355 0.044 A 57 GLY CA C 13 45.721 0.077 A 57 GLY N N 15 108.633 0.019 A 58 LEU H H 1 6.441 0.003 A 58 LEU HA H 1 3.308 0.013 A 58 LEU HBx H 1 -0.113 0.012 A 58 LEU HBy H 1 0.508 0.012 A 58 LEU HDx% H 1 0.188 0.014 A 58 LEU HDy% H 1 -0.121 0.011 A 58 LEU HG H 1 0.822 0.011 A 58 LEU C C 13 175.568 0.019 A 58 LEU CA C 13 57.841 0.078 A 58 LEU CB C 13 42.569 0.075 A 58 LEU CDy C 13 26.898 0.048 A 58 LEU CDx C 13 25.717 0.040 A 58 LEU CG C 13 26.980 0.056 A 58 LEU N N 15 124.023 0.012 A 59 ASP H H 1 7.932 0.004 A 59 ASP HA H 1 4.921 0.015 A 59 ASP HBx H 1 2.471 0.016 A 59 ASP HBy H 1 3.039 0.013 A 59 ASP C C 13 177.697 0.039 A 59 ASP CA C 13 53.247 0.050 A 59 ASP CB C 13 44.232 0.107 A 59 ASP N N 15 127.799 0.038 A 60 SER H H 1 8.838 0.005 A 60 SER HA H 1 4.076 0.015 A 60 SER HBx H 1 3.876 0.002 A 60 SER HBy H 1 3.950 0.002 A 60 SER C C 13 175.400 0.000 A 60 SER CA C 13 62.068 0.075 A 60 SER CB C 13 63.837 0.005 A 60 SER N N 15 122.488 0.030 A 61 GLY H H 1 9.128 0.003 A 61 GLY HAx H 1 3.624 0.013 A 61 GLY HAy H 1 4.312 0.017 A 61 GLY C C 13 175.439 0.005 A 61 GLY CA C 13 45.919 0.074 A 61 GLY N N 15 109.488 0.015 A 62 LYS H H 1 7.596 0.007 A 62 LYS HA H 1 4.416 0.015 A 62 LYS HBx H 1 1.555 0.018 A 62 LYS HBy H 1 2.066 0.019 A 62 LYS HDx H 1 1.636 0.019 A 62 LYS HDy H 1 1.702 0.005 A 62 LYS HEx H 1 2.990 0.023 A 62 LYS HEy H 1 2.990 0.023 A 62 LYS HGx H 1 1.317 0.004 A 62 LYS HGy H 1 1.370 0.014 A 62 LYS C C 13 175.116 0.018 A 62 LYS CA C 13 56.316 0.108 A 62 LYS CB C 13 36.504 0.053 A 62 LYS CD C 13 30.538 0.067 A 62 LYS CE C 13 43.248 0.039 A 62 LYS CG C 13 27.532 0.064 A 62 LYS N N 15 122.496 0.022 A 63 LEU H H 1 8.145 0.009 A 63 LEU HA H 1 5.399 0.015 A 63 LEU HBx H 1 0.891 0.017 A 63 LEU HBy H 1 1.473 0.024 A 63 LEU HDx% H 1 0.624 0.010 A 63 LEU HDy% H 1 0.575 0.011 A 63 LEU HG H 1 1.507 0.006 A 63 LEU C C 13 176.931 0.047 A 63 LEU CA C 13 53.413 0.049 A 63 LEU CB C 13 46.937 0.041 A 63 LEU CDy C 13 27.109 0.075 A 63 LEU CDx C 13 24.299 0.040 A 63 LEU CG C 13 27.781 0.034 A 63 LEU N N 15 119.873 0.040 A 64 TYR H H 1 9.485 0.005 A 64 TYR HA H 1 5.446 0.016 A 64 TYR HBx H 1 2.625 0.016 A 64 TYR HBy H 1 2.912 0.011 A 64 TYR HEy H 1 7.184 0.007 A 64 TYR HEx H 1 6.790 0.000 A 64 TYR C C 13 175.867 0.015 A 64 TYR CA C 13 58.459 0.066 A 64 TYR CB C 13 44.598 0.049 A 64 TYR N N 15 117.659 0.020 A 65 THR H H 1 9.376 0.008 A 65 THR HA H 1 5.380 0.018 A 65 THR HB H 1 4.095 0.012 A 65 THR HG1 H 1 4.973 0.004 A 65 THR HG2% H 1 1.273 0.009 A 65 THR C C 13 173.653 0.025 A 65 THR CA C 13 63.550 0.067 A 65 THR CB C 13 73.901 0.061 A 65 THR CG2 C 13 22.239 0.076 A 65 THR N N 15 118.765 0.015 A 66 LEU H H 1 9.569 0.005 A 66 LEU HA H 1 5.486 0.015 A 66 LEU HBx H 1 1.222 0.016 A 66 LEU HBy H 1 1.865 0.009 A 66 LEU HDx% H 1 1.061 0.011 A 66 LEU HDy% H 1 0.970 0.014 A 66 LEU HG H 1 1.766 0.020 A 66 LEU C C 13 175.481 0.006 A 66 LEU CA C 13 54.600 0.047 A 66 LEU CB C 13 48.788 0.052 A 66 LEU CDx C 13 25.749 0.036 A 66 LEU CDy C 13 28.442 0.053 A 66 LEU CG C 13 29.196 0.063 A 66 LEU N N 15 130.510 0.023 A 67 VAL H H 1 9.450 0.007 A 67 VAL HA H 1 5.250 0.015 A 67 VAL HB H 1 2.194 0.010 A 67 VAL HGx% H 1 1.244 0.011 A 67 VAL HGy% H 1 1.162 0.017 A 67 VAL C C 13 174.992 0.017 A 67 VAL CA C 13 61.370 0.071 A 67 VAL CB C 13 38.003 0.067 A 67 VAL CGy C 13 22.505 0.035 A 67 VAL CGx C 13 22.096 0.104 A 67 VAL N N 15 125.178 0.017 A 68 LEU H H 1 8.352 0.004 A 68 LEU HA H 1 5.354 0.017 A 68 LEU HBx H 1 -0.132 0.009 A 68 LEU HBy H 1 1.285 0.024 A 68 LEU HDx% H 1 0.454 0.014 A 68 LEU HDy% H 1 -0.245 0.014 A 68 LEU HG H 1 0.783 0.008 A 68 LEU C C 13 177.683 0.003 A 68 LEU CA C 13 54.880 0.046 A 68 LEU CB C 13 45.791 0.049 A 68 LEU CDy C 13 27.332 0.076 A 68 LEU CDx C 13 21.165 0.088 A 68 LEU CG C 13 28.545 0.051 A 68 LEU N N 15 125.908 0.042 A 69 THR H H 1 9.274 0.005 A 69 THR HA H 1 5.226 0.018 A 69 THR HB H 1 3.880 0.013 A 69 THR HG2% H 1 1.262 0.016 A 69 THR C C 13 170.640 0.067 A 69 THR CA C 13 61.467 0.074 A 69 THR CB C 13 73.432 0.040 A 69 THR CG2 C 13 21.853 0.041 A 69 THR N N 15 124.883 0.024 A 70 ASP H H 1 8.320 0.004 A 70 ASP HA H 1 5.919 0.020 A 70 ASP HBx H 1 2.787 0.015 A 70 ASP HBy H 1 3.841 0.015 A 70 ASP CA C 13 50.822 0.073 A 70 ASP CB C 13 44.028 0.077 A 70 ASP N N 15 126.639 0.023 A 71 PRO HA H 1 4.605 0.014 A 71 PRO HBx H 1 1.947 0.024 A 71 PRO HBy H 1 1.947 0.024 A 71 PRO HDx H 1 3.188 0.017 A 71 PRO HDy H 1 5.412 0.017 A 71 PRO HGx H 1 0.800 0.015 A 71 PRO HGy H 1 1.371 0.015 A 71 PRO C C 13 177.081 0.031 A 71 PRO CA C 13 64.418 0.033 A 71 PRO CB C 13 33.221 0.078 A 71 PRO CD C 13 51.128 0.090 A 71 PRO CG C 13 27.211 0.090 A 72 ASP H H 1 8.933 0.010 A 72 ASP HA H 1 4.499 0.017 A 72 ASP HBx H 1 2.251 0.008 A 72 ASP HBy H 1 2.251 0.008 A 72 ASP C C 13 181.175 0.000 A 72 ASP CA C 13 55.436 0.051 A 72 ASP CB C 13 41.923 0.062 A 72 ASP N N 15 129.746 0.083 A 73 ALA H H 1 5.682 0.014 A 73 ALA HA H 1 4.707 0.019 A 73 ALA HB% H 1 1.413 0.016 A 73 ALA CA C 13 48.464 0.061 A 73 ALA CB C 13 23.561 0.066 A 73 ALA N N 15 117.221 0.011 A 74 PRO HA H 1 4.899 0.017 A 74 PRO HBx H 1 2.253 0.014 A 74 PRO HBy H 1 2.440 0.013 A 74 PRO HDx H 1 3.052 0.023 A 74 PRO HDy H 1 4.194 0.018 A 74 PRO HGx H 1 1.858 0.013 A 74 PRO HGy H 1 2.058 0.017 A 74 PRO C C 13 175.568 0.026 A 74 PRO CA C 13 66.081 0.107 A 74 PRO CB C 13 35.506 0.065 A 74 PRO CD C 13 51.166 0.074 A 74 PRO CG C 13 25.646 0.045 A 75 SER H H 1 6.602 0.004 A 75 SER HA H 1 4.129 0.017 A 75 SER HBx H 1 3.607 0.014 A 75 SER HBy H 1 4.060 0.022 A 75 SER C C 13 174.299 0.002 A 75 SER CA C 13 57.849 0.068 A 75 SER CB C 13 67.971 0.090 A 75 SER N N 15 110.998 0.019 A 76 ARG H H 1 8.948 0.008 A 76 ARG HA H 1 3.832 0.014 A 76 ARG HBx H 1 1.372 0.015 A 76 ARG HBy H 1 1.759 0.015 A 76 ARG HDx H 1 2.961 0.010 A 76 ARG HDy H 1 3.101 0.017 A 76 ARG HGx H 1 1.803 0.006 A 76 ARG HGy H 1 1.803 0.006 A 76 ARG C C 13 178.600 0.058 A 76 ARG CA C 13 59.799 0.053 A 76 ARG CB C 13 31.669 0.080 A 76 ARG CD C 13 45.748 0.064 A 76 ARG CG C 13 28.219 0.037 A 76 ARG N N 15 121.308 0.065 A 77 LYS H H 1 7.469 0.003 A 77 LYS HA H 1 4.033 0.012 A 77 LYS HBx H 1 1.659 0.015 A 77 LYS HBy H 1 1.659 0.015 A 77 LYS HDx H 1 1.644 0.016 A 77 LYS HDy H 1 1.644 0.016 A 77 LYS HEx H 1 2.956 0.012 A 77 LYS HEy H 1 2.956 0.012 A 77 LYS HGx H 1 1.378 0.019 A 77 LYS HGy H 1 1.378 0.019 A 77 LYS C C 13 177.636 0.040 A 77 LYS CA C 13 58.507 0.061 A 77 LYS CB C 13 33.882 0.047 A 77 LYS CD C 13 30.057 0.026 A 77 LYS CE C 13 43.105 0.083 A 77 LYS CG C 13 26.032 0.040 A 77 LYS N N 15 115.973 0.053 A 78 ASP H H 1 7.291 0.003 A 78 ASP HA H 1 4.820 0.016 A 78 ASP HBx H 1 2.195 0.014 A 78 ASP HBy H 1 2.613 0.014 A 78 ASP C C 13 177.584 0.000 A 78 ASP CA C 13 52.477 0.069 A 78 ASP CB C 13 41.801 0.049 A 78 ASP N N 15 116.995 0.025 A 79 PRO HA H 1 4.706 0.013 A 79 PRO HBx H 1 2.051 0.022 A 79 PRO HBy H 1 2.571 0.019 A 79 PRO HDy H 1 3.453 0.016 A 79 PRO HDx H 1 3.279 0.018 A 79 PRO HGx H 1 1.788 0.009 A 79 PRO HGy H 1 1.918 0.006 A 79 PRO C C 13 179.776 0.000 A 79 PRO CA C 13 64.465 0.057 A 79 PRO CB C 13 29.836 0.066 A 79 PRO CD C 13 50.010 0.047 A 79 PRO CG C 13 27.685 0.055 A 80 LYS H H 1 8.391 0.005 A 80 LYS HA H 1 3.948 0.014 A 80 LYS HBx H 1 1.303 0.015 A 80 LYS HBy H 1 1.439 0.020 A 80 LYS HDx H 1 1.498 0.015 A 80 LYS HDy H 1 1.498 0.015 A 80 LYS HEx H 1 2.833 0.011 A 80 LYS HEy H 1 2.833 0.011 A 80 LYS HGx H 1 0.812 0.011 A 80 LYS HGy H 1 0.986 0.013 A 80 LYS C C 13 178.595 0.044 A 80 LYS CA C 13 60.087 0.078 A 80 LYS CB C 13 34.157 0.060 A 80 LYS CD C 13 30.444 0.057 A 80 LYS CE C 13 42.734 0.054 A 80 LYS CG C 13 25.476 0.062 A 80 LYS N N 15 124.423 0.027 A 81 TYR H H 1 8.930 0.006 A 81 TYR HA H 1 5.075 0.014 A 81 TYR HBx H 1 2.665 0.022 A 81 TYR HBy H 1 3.682 0.016 A 81 TYR C C 13 175.933 0.008 A 81 TYR CA C 13 55.210 0.075 A 81 TYR CB C 13 38.817 0.062 A 81 TYR N N 15 117.455 0.034 A 82 ARG H H 1 7.653 0.004 A 82 ARG HA H 1 4.212 0.012 A 82 ARG HBx H 1 2.006 0.011 A 82 ARG HBy H 1 2.603 0.018 A 82 ARG HDx H 1 3.241 0.021 A 82 ARG HDy H 1 3.653 0.022 A 82 ARG HGx H 1 1.697 0.017 A 82 ARG HGy H 1 1.958 0.002 A 82 ARG C C 13 178.760 0.057 A 82 ARG CA C 13 53.171 0.084 A 82 ARG CB C 13 33.048 0.068 A 82 ARG CD C 13 44.563 0.045 A 82 ARG CG C 13 28.256 0.021 A 82 ARG N N 15 121.940 0.031 A 83 GLU H H 1 9.645 0.007 A 83 GLU HA H 1 4.721 0.019 A 83 GLU HBx H 1 2.142 0.017 A 83 GLU HBy H 1 2.208 0.017 A 83 GLU HGx H 1 2.631 0.021 A 83 GLU HGy H 1 2.631 0.021 A 83 GLU C C 13 175.777 0.016 A 83 GLU CA C 13 59.408 0.050 A 83 GLU CB C 13 31.503 0.051 A 83 GLU CG C 13 36.412 0.042 A 83 GLU N N 15 128.720 0.017 A 84 TRP H H 1 8.994 0.005 A 84 TRP HA H 1 5.130 0.017 A 84 TRP HBx H 1 2.747 0.020 A 84 TRP HBy H 1 4.067 0.021 A 84 TRP HD1 H 1 6.892 0.011 A 84 TRP C C 13 178.060 0.064 A 84 TRP CA C 13 58.990 0.078 A 84 TRP CB C 13 33.350 0.052 A 84 TRP N N 15 125.538 0.020 A 85 HIS H H 1 8.033 0.005 A 85 HIS HA H 1 5.291 0.016 A 85 HIS HBx H 1 2.488 0.013 A 85 HIS HBy H 1 2.488 0.013 A 85 HIS C C 13 173.137 0.002 A 85 HIS CA C 13 56.797 0.112 A 85 HIS CB C 13 31.687 0.078 A 85 HIS N N 15 126.095 0.069 A 86 HIS H H 1 8.878 0.007 A 86 HIS HA H 1 3.828 0.015 A 86 HIS HBx H 1 2.452 0.017 A 86 HIS HBy H 1 3.612 0.016 A 86 HIS HD2 H 1 7.460 0.000 A 86 HIS C C 13 175.858 0.004 A 86 HIS CA C 13 60.181 0.098 A 86 HIS CB C 13 32.068 0.101 A 86 HIS N N 15 122.277 0.042 A 87 PHE H H 1 7.749 0.009 A 87 PHE HA H 1 5.240 0.020 A 87 PHE HBx H 1 3.078 0.018 A 87 PHE HBy H 1 3.276 0.015 A 87 PHE C C 13 174.101 0.027 A 87 PHE CA C 13 55.317 0.065 A 87 PHE CB C 13 44.285 0.053 A 87 PHE N N 15 119.772 0.065 A 88 LEU H H 1 8.401 0.012 A 88 LEU HA H 1 5.226 0.014 A 88 LEU HBx H 1 1.118 0.015 A 88 LEU HBy H 1 1.884 0.014 A 88 LEU HDx% H 1 0.432 0.011 A 88 LEU HDy% H 1 0.376 0.012 A 88 LEU HG H 1 1.215 0.013 A 88 LEU C C 13 174.590 0.019 A 88 LEU CA C 13 56.756 0.033 A 88 LEU CB C 13 46.871 0.064 A 88 LEU CDx C 13 24.756 0.048 A 88 LEU CDy C 13 26.402 0.049 A 88 LEU CG C 13 28.952 0.071 A 88 LEU N N 15 130.042 0.031 A 89 VAL H H 1 9.241 0.007 A 89 VAL HA H 1 4.816 0.013 A 89 VAL HB H 1 1.866 0.011 A 89 VAL HGx% H 1 0.875 0.013 A 89 VAL HGy% H 1 0.204 0.014 A 89 VAL C C 13 175.322 0.008 A 89 VAL CA C 13 61.819 0.062 A 89 VAL CB C 13 36.934 0.058 A 89 VAL CGy C 13 23.280 0.030 A 89 VAL CGx C 13 22.612 0.051 A 89 VAL N N 15 131.207 0.031 A 90 VAL H H 1 8.684 0.010 A 90 VAL HA H 1 5.373 0.016 A 90 VAL HB H 1 2.025 0.015 A 90 VAL HGx% H 1 1.081 0.013 A 90 VAL HGy% H 1 0.887 0.014 A 90 VAL C C 13 176.521 0.010 A 90 VAL CA C 13 59.823 0.068 A 90 VAL CB C 13 36.966 0.072 A 90 VAL CGy C 13 22.148 0.078 A 90 VAL CGx C 13 19.246 0.040 A 90 VAL N N 15 116.895 0.030 A 91 ASN H H 1 9.365 0.003 A 91 ASN HA H 1 4.004 0.016 A 91 ASN HBx H 1 3.142 0.016 A 91 ASN HBy H 1 3.457 0.017 A 91 ASN HD2y H 1 7.732 0.003 A 91 ASN HD2x H 1 7.664 0.001 A 91 ASN C C 13 174.531 0.000 A 91 ASN CA C 13 55.527 0.060 A 91 ASN CB C 13 37.288 0.039 A 91 ASN N N 15 116.196 0.010 A 91 ASN ND2 N 15 114.106 0.084 A 92 MET H H 1 9.316 0.005 A 92 MET HA H 1 3.880 0.012 A 92 MET HBx H 1 1.508 0.012 A 92 MET HBy H 1 2.410 0.021 A 92 MET HE% H 1 1.026 0.005 A 92 MET HGx H 1 2.148 0.017 A 92 MET HGy H 1 2.360 0.016 A 92 MET C C 13 176.127 0.021 A 92 MET CA C 13 57.577 0.065 A 92 MET CB C 13 35.333 0.062 A 92 MET CG C 13 30.542 0.051 A 92 MET N N 15 120.523 0.025 A 93 LYS H H 1 8.545 0.014 A 93 LYS HA H 1 4.655 0.015 A 93 LYS HBx H 1 1.865 0.024 A 93 LYS HBy H 1 1.909 0.010 A 93 LYS HDx H 1 1.700 0.019 A 93 LYS HDy H 1 1.741 0.008 A 93 LYS HEx H 1 3.041 0.017 A 93 LYS HEy H 1 3.041 0.017 A 93 LYS HGx H 1 1.381 0.008 A 93 LYS HGy H 1 1.416 0.005 A 93 LYS C C 13 178.764 0.046 A 93 LYS CA C 13 56.828 0.078 A 93 LYS CB C 13 32.723 0.054 A 93 LYS CD C 13 30.560 0.056 A 93 LYS CE C 13 43.200 0.072 A 93 LYS CG C 13 25.922 0.075 A 93 LYS N N 15 127.743 0.017 A 94 GLY H H 1 9.024 0.007 A 94 GLY HAx H 1 3.670 0.016 A 94 GLY HAy H 1 3.859 0.016 A 94 GLY C C 13 171.084 0.050 A 94 GLY CA C 13 49.216 0.059 A 94 GLY N N 15 118.887 0.060 A 95 ASN H H 1 7.737 0.005 A 95 ASN HA H 1 4.742 0.016 A 95 ASN HBx H 1 1.946 0.019 A 95 ASN HBy H 1 3.294 0.016 A 95 ASN HD2y H 1 8.038 0.001 A 95 ASN HD2x H 1 6.757 0.004 A 95 ASN C C 13 176.622 0.046 A 95 ASN CA C 13 51.719 0.065 A 95 ASN CB C 13 38.715 0.030 A 95 ASN N N 15 119.470 0.039 A 95 ASN ND2 N 15 111.851 0.050 A 96 ASP H H 1 7.893 0.006 A 96 ASP HA H 1 4.772 0.015 A 96 ASP HBx H 1 2.699 0.020 A 96 ASP HBy H 1 3.202 0.015 A 96 ASP C C 13 178.130 0.019 A 96 ASP CA C 13 53.415 0.061 A 96 ASP CB C 13 40.386 0.062 A 96 ASP N N 15 117.512 0.017 A 97 ILE H H 1 8.267 0.006 A 97 ILE HA H 1 3.727 0.012 A 97 ILE HB H 1 1.825 0.012 A 97 ILE HD1% H 1 0.777 0.013 A 97 ILE HG1x H 1 1.039 0.010 A 97 ILE HG1y H 1 1.782 0.018 A 97 ILE HG2% H 1 1.036 0.012 A 97 ILE C C 13 178.514 0.026 A 97 ILE CA C 13 66.944 0.073 A 97 ILE CB C 13 39.474 0.063 A 97 ILE CD1 C 13 14.270 0.052 A 97 ILE CG1 C 13 29.884 0.049 A 97 ILE CG2 C 13 18.786 0.036 A 97 ILE N N 15 130.353 0.008 A 98 SER H H 1 8.055 0.003 A 98 SER HA H 1 4.400 0.011 A 98 SER HBx H 1 3.981 0.006 A 98 SER HBy H 1 4.030 0.003 A 98 SER C C 13 175.695 0.019 A 98 SER CA C 13 61.744 0.058 A 98 SER CB C 13 64.506 0.091 A 98 SER N N 15 113.726 0.050 A 99 SER H H 1 7.840 0.003 A 99 SER HA H 1 4.484 0.014 A 99 SER HBx H 1 4.041 0.035 A 99 SER HBy H 1 4.141 0.016 A 99 SER C C 13 176.564 0.030 A 99 SER CA C 13 60.593 0.071 A 99 SER CB C 13 66.372 0.077 A 99 SER N N 15 117.789 0.018 A 100 GLY H H 1 7.694 0.006 A 100 GLY HAx H 1 3.352 0.013 A 100 GLY HAy H 1 4.309 0.016 A 100 GLY C C 13 173.971 0.001 A 100 GLY CA C 13 45.325 0.042 A 100 GLY N N 15 107.969 0.024 A 101 THR H H 1 9.323 0.005 A 101 THR HA H 1 4.399 0.011 A 101 THR HB H 1 4.018 0.016 A 101 THR HG2% H 1 1.088 0.010 A 101 THR C C 13 174.354 0.000 A 101 THR CA C 13 63.518 0.070 A 101 THR CB C 13 70.956 0.087 A 101 THR CG2 C 13 21.902 0.053 A 101 THR N N 15 118.669 0.028 A 102 VAL H H 1 8.989 0.004 A 102 VAL HA H 1 3.920 0.014 A 102 VAL HB H 1 2.140 0.012 A 102 VAL HGx% H 1 1.093 0.010 A 102 VAL HGy% H 1 0.954 0.017 A 102 VAL C C 13 176.712 0.044 A 102 VAL CA C 13 64.153 0.055 A 102 VAL CB C 13 32.034 0.065 A 102 VAL CGy C 13 22.965 0.019 A 102 VAL CGx C 13 22.488 0.033 A 102 VAL N N 15 130.269 0.022 A 103 LEU H H 1 8.389 0.005 A 103 LEU HA H 1 4.487 0.015 A 103 LEU HBx H 1 1.473 0.019 A 103 LEU HBy H 1 1.798 0.018 A 103 LEU HDx% H 1 0.943 0.012 A 103 LEU HDy% H 1 0.687 0.016 A 103 LEU HG H 1 1.585 0.004 A 103 LEU C C 13 177.449 0.046 A 103 LEU CA C 13 57.709 0.039 A 103 LEU CB C 13 42.690 0.096 A 103 LEU CDy C 13 27.526 0.051 A 103 LEU CDx C 13 23.892 0.077 A 103 LEU CG C 13 28.099 0.096 A 103 LEU N N 15 132.254 0.027 A 104 SER H H 1 7.703 0.007 A 104 SER HA H 1 5.193 0.020 A 104 SER HBx H 1 3.226 0.013 A 104 SER HBy H 1 3.508 0.020 A 104 SER C C 13 174.779 0.026 A 104 SER CA C 13 56.888 0.086 A 104 SER CB C 13 63.839 0.081 A 104 SER N N 15 111.568 0.042 A 105 ASP H H 1 8.101 0.005 A 105 ASP HA H 1 4.799 0.014 A 105 ASP HBx H 1 2.480 0.016 A 105 ASP HBy H 1 2.920 0.013 A 105 ASP C C 13 177.427 0.057 A 105 ASP CA C 13 55.196 0.063 A 105 ASP CB C 13 41.552 0.053 A 105 ASP N N 15 124.064 0.016 A 106 TYR H H 1 8.964 0.004 A 106 TYR HA H 1 3.998 0.016 A 106 TYR HBx H 1 1.779 0.022 A 106 TYR HBy H 1 2.775 0.016 A 106 TYR C C 13 175.367 0.005 A 106 TYR CA C 13 62.290 0.063 A 106 TYR CB C 13 39.900 0.040 A 106 TYR N N 15 123.533 0.022 A 107 VAL H H 1 7.662 0.005 A 107 VAL HA H 1 3.915 0.014 A 107 VAL HB H 1 1.849 0.023 A 107 VAL HGx% H 1 1.302 0.015 A 107 VAL HGy% H 1 0.981 0.014 A 107 VAL C C 13 176.918 0.033 A 107 VAL CA C 13 62.498 0.058 A 107 VAL CB C 13 37.003 0.084 A 107 VAL CGy C 13 23.408 0.087 A 107 VAL CGx C 13 23.213 0.044 A 107 VAL N N 15 130.884 0.043 A 108 GLY H H 1 8.085 0.006 A 108 GLY HAx H 1 3.643 0.024 A 108 GLY HAy H 1 3.887 0.020 A 108 GLY C C 13 174.244 0.045 A 108 GLY CA C 13 45.324 0.043 A 108 GLY N N 15 114.204 0.046 A 109 SER H H 1 6.673 0.019 A 109 SER HA H 1 3.396 0.030 A 109 SER HBx H 1 2.817 0.017 A 109 SER HBy H 1 3.119 0.018 A 109 SER C C 13 173.152 0.000 A 109 SER CA C 13 62.064 0.058 A 109 SER CB C 13 65.834 0.090 A 109 SER N N 15 112.574 0.080 A 110 GLY H H 1 9.159 0.084 A 110 GLY HAx H 1 3.194 0.029 A 110 GLY HAy H 1 4.564 0.016 A 110 GLY CA C 13 48.214 0.050 A 110 GLY N N 15 113.183 0.102 A 112 PRO HA H 1 4.642 0.034 A 112 PRO HBx H 1 1.951 0.011 A 112 PRO HBy H 1 2.453 0.023 A 112 PRO HDx H 1 4.009 0.021 A 112 PRO HDy H 1 4.393 0.005 A 112 PRO HGx H 1 2.114 0.003 A 112 PRO HGy H 1 2.188 0.008 A 112 PRO C C 13 179.779 0.060 A 112 PRO CA C 13 63.698 0.069 A 112 PRO CB C 13 33.219 0.076 A 112 PRO CD C 13 52.604 0.070 A 112 PRO CG C 13 29.241 0.067 A 113 LYS H H 1 9.094 0.009 A 113 LYS HA H 1 3.520 0.013 A 113 LYS HBx H 1 0.085 0.015 A 113 LYS HBy H 1 1.194 0.015 A 113 LYS HDx H 1 0.315 0.010 A 113 LYS HDy H 1 0.772 0.014 A 113 LYS HEx H 1 1.974 0.018 A 113 LYS HEy H 1 2.034 0.013 A 113 LYS HGx H 1 0.312 0.016 A 113 LYS HGy H 1 0.794 0.016 A 113 LYS C C 13 178.539 0.038 A 113 LYS CA C 13 59.878 0.076 A 113 LYS CB C 13 32.880 0.053 A 113 LYS CD C 13 29.809 0.036 A 113 LYS CE C 13 42.307 0.049 A 113 LYS CG C 13 25.859 0.038 A 113 LYS N N 15 130.937 0.033 A 114 GLY H H 1 9.059 0.004 A 114 GLY HAx H 1 3.818 0.013 A 114 GLY HAy H 1 4.221 0.015 A 114 GLY C C 13 176.735 0.043 A 114 GLY CA C 13 46.656 0.090 A 114 GLY N N 15 114.581 0.023 A 115 THR H H 1 7.537 0.004 A 115 THR HA H 1 4.553 0.014 A 115 THR HB H 1 4.835 0.019 A 115 THR HG1 H 1 4.766 0.004 A 115 THR HG2% H 1 1.250 0.014 A 115 THR C C 13 175.640 0.012 A 115 THR CA C 13 63.031 0.073 A 115 THR CB C 13 72.175 0.100 A 115 THR CG2 C 13 22.763 0.043 A 115 THR N N 15 107.409 0.015 A 116 GLY H H 1 8.518 0.006 A 116 GLY HAx H 1 3.950 0.013 A 116 GLY HAy H 1 4.147 0.014 A 116 GLY C C 13 174.969 0.020 A 116 GLY CA C 13 46.097 0.063 A 116 GLY N N 15 112.143 0.015 A 117 LEU H H 1 8.579 0.004 A 117 LEU HA H 1 4.313 0.015 A 117 LEU HBx H 1 1.081 0.012 A 117 LEU HBy H 1 1.746 0.026 A 117 LEU HDx% H 1 0.826 0.012 A 117 LEU HDy% H 1 0.817 0.014 A 117 LEU HG H 1 1.694 0.034 A 117 LEU C C 13 180.744 0.069 A 117 LEU CA C 13 56.461 0.048 A 117 LEU CB C 13 44.181 0.055 A 117 LEU CDy C 13 26.718 0.041 A 117 LEU CDx C 13 24.666 0.050 A 117 LEU CG C 13 27.855 0.100 A 117 LEU N N 15 119.423 0.017 A 118 HIS H H 1 9.177 0.006 A 118 HIS HA H 1 4.865 0.020 A 118 HIS HBx H 1 2.914 0.005 A 118 HIS HBy H 1 3.120 0.012 A 118 HIS C C 13 174.894 0.038 A 118 HIS CA C 13 54.626 0.058 A 118 HIS CB C 13 31.053 0.090 A 118 HIS N N 15 126.460 0.020 A 119 ARG H H 1 9.203 0.005 A 119 ARG HA H 1 3.798 0.015 A 119 ARG HBx H 1 1.071 0.016 A 119 ARG HBy H 1 1.782 0.015 A 119 ARG HDx H 1 2.768 0.018 A 119 ARG HDy H 1 3.231 0.015 A 119 ARG HGx H 1 1.988 0.000 A 119 ARG HGy H 1 1.988 0.000 A 119 ARG C C 13 172.781 0.020 A 119 ARG CA C 13 57.060 0.056 A 119 ARG CB C 13 31.874 0.075 A 119 ARG CD C 13 45.224 0.073 A 119 ARG CG C 13 26.191 0.067 A 119 ARG N N 15 122.709 0.015 A 120 TYR H H 1 8.514 0.007 A 120 TYR HA H 1 4.377 0.013 A 120 TYR HBx H 1 0.862 0.018 A 120 TYR HBy H 1 1.848 0.018 A 120 TYR C C 13 175.626 0.015 A 120 TYR CA C 13 58.495 0.094 A 120 TYR CB C 13 39.214 0.066 A 120 TYR N N 15 118.345 0.039 A 121 VAL H H 1 8.885 0.004 A 121 VAL HA H 1 4.536 0.017 A 121 VAL HB H 1 2.120 0.014 A 121 VAL HGx% H 1 0.764 0.014 A 121 VAL HGy% H 1 1.125 0.020 A 121 VAL C C 13 176.348 0.065 A 121 VAL CA C 13 63.424 0.056 A 121 VAL CB C 13 34.497 0.048 A 121 VAL CGy C 13 23.846 0.040 A 121 VAL CGx C 13 23.108 0.088 A 121 VAL N N 15 124.663 0.014 A 122 TRP H H 1 8.581 0.006 A 122 TRP HA H 1 5.876 0.022 A 122 TRP HBx H 1 2.955 0.023 A 122 TRP HBy H 1 3.070 0.017 A 122 TRP HD1 H 1 7.011 0.000 A 122 TRP C C 13 177.606 0.023 A 122 TRP CA C 13 56.591 0.061 A 122 TRP CB C 13 35.715 0.050 A 122 TRP N N 15 128.709 0.054 A 123 LEU H H 1 9.687 0.006 A 123 LEU HA H 1 5.098 0.014 A 123 LEU HBx H 1 1.344 0.015 A 123 LEU HBy H 1 1.753 0.017 A 123 LEU HDx% H 1 1.227 0.010 A 123 LEU HDy% H 1 1.136 0.019 A 123 LEU HG H 1 1.874 0.004 A 123 LEU C C 13 175.310 0.009 A 123 LEU CA C 13 55.510 0.056 A 123 LEU CB C 13 50.003 0.066 A 123 LEU CDy C 13 28.843 0.038 A 123 LEU CDx C 13 26.071 0.055 A 123 LEU CG C 13 28.272 0.101 A 123 LEU N N 15 122.445 0.037 A 124 VAL H H 1 8.158 0.016 A 124 VAL HA H 1 5.258 0.019 A 124 VAL HB H 1 0.892 0.018 A 124 VAL HGx% H 1 0.250 0.011 A 124 VAL HGy% H 1 0.083 0.013 A 124 VAL C C 13 176.143 0.022 A 124 VAL CA C 13 60.978 0.059 A 124 VAL CB C 13 35.392 0.063 A 124 VAL CGy C 13 23.810 0.039 A 124 VAL CGx C 13 23.057 0.048 A 124 VAL N N 15 119.187 0.026 A 125 TYR H H 1 9.608 0.005 A 125 TYR HA H 1 4.796 0.018 A 125 TYR HBx H 1 2.750 0.006 A 125 TYR HBy H 1 3.078 0.019 A 125 TYR C C 13 176.589 0.014 A 125 TYR CA C 13 58.119 0.040 A 125 TYR CB C 13 43.975 0.034 A 125 TYR N N 15 125.720 0.025 A 126 GLU H H 1 9.040 0.004 A 126 GLU HA H 1 4.541 0.021 A 126 GLU HBx H 1 2.123 0.019 A 126 GLU HBy H 1 2.123 0.019 A 126 GLU HGx H 1 2.205 0.030 A 126 GLU HGy H 1 2.205 0.030 A 126 GLU C C 13 176.049 0.023 A 126 GLU CA C 13 57.484 0.074 A 126 GLU CB C 13 33.047 0.077 A 126 GLU CG C 13 37.216 0.094 A 126 GLU N N 15 124.690 0.027 A 127 GLN H H 1 8.563 0.003 A 127 GLN HA H 1 4.592 0.019 A 127 GLN HBx H 1 1.706 0.016 A 127 GLN HBy H 1 2.339 0.029 A 127 GLN HE2x H 1 7.210 0.010 A 127 GLN HE2y H 1 7.545 0.000 A 127 GLN HGx H 1 2.261 0.009 A 127 GLN HGy H 1 2.261 0.009 A 127 GLN C C 13 177.491 0.030 A 127 GLN CA C 13 55.429 0.084 A 127 GLN CB C 13 31.638 0.110 A 127 GLN CG C 13 35.595 0.033 A 127 GLN N N 15 123.335 0.018 A 128 ASP H H 1 8.906 0.006 A 128 ASP HA H 1 4.752 0.012 A 128 ASP HBx H 1 2.589 0.027 A 128 ASP HBy H 1 2.780 0.018 A 128 ASP C C 13 176.139 0.008 A 128 ASP CA C 13 55.806 0.093 A 128 ASP CB C 13 42.913 0.113 A 128 ASP N N 15 120.960 0.031 A 129 ARG H H 1 7.852 0.003 A 129 ARG HA H 1 4.841 0.012 A 129 ARG HBx H 1 1.777 0.010 A 129 ARG HBy H 1 1.980 0.020 A 129 ARG HDx H 1 3.115 0.000 A 129 ARG HDy H 1 3.212 0.012 A 129 ARG HGx H 1 1.397 0.004 A 129 ARG HGy H 1 1.527 0.015 A 129 ARG C C 13 173.887 0.000 A 129 ARG CA C 13 54.755 0.083 A 129 ARG CB C 13 30.514 0.075 A 129 ARG CD C 13 44.267 0.022 A 129 ARG CG C 13 26.011 0.054 A 129 ARG N N 15 117.195 0.040 A 130 PRO HA H 1 4.043 0.013 A 130 PRO HBx H 1 1.707 0.023 A 130 PRO HBy H 1 2.127 0.015 A 130 PRO HDx H 1 3.559 0.018 A 130 PRO HDy H 1 3.715 0.020 A 130 PRO HGx H 1 1.829 0.012 A 130 PRO HGy H 1 2.043 0.019 A 130 PRO C C 13 177.192 0.005 A 130 PRO CA C 13 64.189 0.052 A 130 PRO CB C 13 32.593 0.059 A 130 PRO CD C 13 51.662 0.061 A 130 PRO CG C 13 28.862 0.054 A 131 LEU H H 1 9.532 0.003 A 131 LEU HA H 1 4.480 0.018 A 131 LEU HBx H 1 1.136 0.017 A 131 LEU HBy H 1 1.418 0.011 A 131 LEU HDx% H 1 0.839 0.012 A 131 LEU HDy% H 1 0.520 0.019 A 131 LEU HG H 1 1.717 0.011 A 131 LEU C C 13 178.435 0.054 A 131 LEU CA C 13 55.107 0.075 A 131 LEU CB C 13 45.481 0.060 A 131 LEU CDx C 13 23.954 0.028 A 131 LEU CDy C 13 25.733 0.048 A 131 LEU CG C 13 28.129 0.053 A 131 LEU N N 15 125.255 0.013 A 132 LYS H H 1 8.538 0.009 A 132 LYS HA H 1 4.494 0.013 A 132 LYS HBx H 1 1.622 0.014 A 132 LYS HBy H 1 1.818 0.012 A 132 LYS HDx H 1 1.669 0.022 A 132 LYS HDy H 1 1.669 0.022 A 132 LYS HEx H 1 2.963 0.014 A 132 LYS HEy H 1 2.963 0.014 A 132 LYS HGx H 1 1.274 0.022 A 132 LYS HGy H 1 1.331 0.014 A 132 LYS C C 13 176.456 0.051 A 132 LYS CA C 13 56.478 0.077 A 132 LYS CB C 13 33.621 0.036 A 132 LYS CD C 13 30.248 0.036 A 132 LYS CE C 13 43.087 0.001 A 132 LYS CG C 13 25.802 0.065 A 132 LYS N N 15 126.350 0.054 A 133 CYS H H 1 8.737 0.005 A 133 CYS HA H 1 4.864 0.016 A 133 CYS HBx H 1 2.403 0.017 A 133 CYS HBy H 1 3.796 0.018 A 133 CYS C C 13 177.118 0.030 A 133 CYS CA C 13 60.243 0.112 A 133 CYS CB C 13 30.725 0.060 A 133 CYS N N 15 125.614 0.029 A 134 ASP H H 1 8.199 0.004 A 134 ASP HA H 1 4.636 0.018 A 134 ASP HBx H 1 2.562 0.019 A 134 ASP HBy H 1 2.912 0.020 A 134 ASP C C 13 176.598 0.067 A 134 ASP CA C 13 54.129 0.051 A 134 ASP CB C 13 41.231 0.065 A 134 ASP N N 15 122.207 0.025 A 135 GLU H H 1 8.772 0.007 A 135 GLU HA H 1 4.127 0.012 A 135 GLU HBx H 1 2.039 0.015 A 135 GLU HBy H 1 2.039 0.015 A 135 GLU HGx H 1 2.559 0.015 A 135 GLU HGy H 1 2.729 0.020 A 135 GLU C C 13 173.907 0.000 A 135 GLU CA C 13 58.509 0.032 A 135 GLU CB C 13 29.666 0.070 A 135 GLU CG C 13 40.329 0.046 A 135 GLU N N 15 126.511 0.025 A 136 PRO HA H 1 4.298 0.013 A 136 PRO HBx H 1 1.603 0.012 A 136 PRO HBy H 1 2.016 0.014 A 136 PRO HDx H 1 3.509 0.021 A 136 PRO HDy H 1 3.620 0.015 A 136 PRO HGx H 1 1.648 0.013 A 136 PRO HGy H 1 1.795 0.013 A 136 PRO C C 13 175.351 0.017 A 136 PRO CA C 13 62.961 0.098 A 136 PRO CB C 13 32.865 0.052 A 136 PRO CD C 13 50.879 0.076 A 136 PRO CG C 13 27.779 0.066 A 137 ILE H H 1 7.939 0.008 A 137 ILE HA H 1 4.827 0.014 A 137 ILE HB H 1 1.907 0.014 A 137 ILE HD1% H 1 0.836 0.018 A 137 ILE HG1x H 1 1.480 0.012 A 137 ILE HG1y H 1 1.480 0.012 A 137 ILE HG2% H 1 0.867 0.013 A 137 ILE C C 13 178.680 0.050 A 137 ILE CA C 13 60.130 0.066 A 137 ILE CB C 13 37.037 0.077 A 137 ILE CD1 C 13 12.259 0.042 A 137 ILE CG1 C 13 28.341 0.042 A 137 ILE CG2 C 13 18.812 0.040 A 137 ILE N N 15 119.631 0.007 A 138 LEU H H 1 9.421 0.004 A 138 LEU HA H 1 4.840 0.014 A 138 LEU HBx H 1 1.741 0.006 A 138 LEU HBy H 1 1.827 0.000 A 138 LEU HDx% H 1 0.818 0.019 A 138 LEU HDy% H 1 0.732 0.015 A 138 LEU HG H 1 1.793 0.014 A 138 LEU C C 13 178.795 0.047 A 138 LEU CA C 13 54.690 0.059 A 138 LEU CB C 13 43.115 0.055 A 138 LEU CDy C 13 26.867 0.087 A 138 LEU CDx C 13 23.306 0.039 A 138 LEU CG C 13 27.487 0.109 A 138 LEU N N 15 130.049 0.033 A 139 SER H H 1 8.826 0.003 A 139 SER HA H 1 4.777 0.016 A 139 SER HBx H 1 4.007 0.014 A 139 SER HBy H 1 4.226 0.017 A 139 SER C C 13 175.419 0.011 A 139 SER CA C 13 58.085 0.078 A 139 SER CB C 13 66.159 0.094 A 139 SER N N 15 122.919 0.028 A 140 ASN H H 1 8.620 0.004 A 140 ASN HA H 1 4.481 0.019 A 140 ASN HBx H 1 2.152 0.014 A 140 ASN HBy H 1 3.189 0.015 A 140 ASN HD2y H 1 7.724 0.004 A 140 ASN HD2x H 1 6.791 0.004 A 140 ASN C C 13 175.420 0.012 A 140 ASN CA C 13 52.064 0.078 A 140 ASN CB C 13 38.731 0.041 A 140 ASN N N 15 117.081 0.030 A 140 ASN ND2 N 15 108.715 0.041 A 141 ARG H H 1 7.968 0.004 A 141 ARG HA H 1 4.715 0.017 A 141 ARG HBx H 1 1.541 0.013 A 141 ARG HBy H 1 2.263 0.016 A 141 ARG HDx H 1 3.231 0.012 A 141 ARG HDy H 1 3.231 0.012 A 141 ARG HGx H 1 1.534 0.011 A 141 ARG HGy H 1 1.773 0.013 A 141 ARG C C 13 175.310 0.034 A 141 ARG CA C 13 55.753 0.089 A 141 ARG CB C 13 31.424 0.046 A 141 ARG CD C 13 44.204 0.038 A 141 ARG CG C 13 28.286 0.039 A 141 ARG N N 15 115.403 0.013 A 142 SER H H 1 6.945 0.003 A 142 SER HA H 1 4.930 0.013 A 142 SER HBx H 1 3.481 0.012 A 142 SER HBy H 1 3.897 0.013 A 142 SER C C 13 176.249 0.023 A 142 SER CA C 13 57.756 0.056 A 142 SER CB C 13 66.174 0.085 A 142 SER N N 15 110.063 0.012 A 143 GLY H H 1 8.901 0.006 A 143 GLY HAx H 1 3.954 0.017 A 143 GLY HAy H 1 4.359 0.014 A 143 GLY C C 13 175.287 0.020 A 143 GLY CA C 13 45.922 0.046 A 143 GLY N N 15 115.311 0.027 A 144 ASP H H 1 8.307 0.004 A 144 ASP HA H 1 4.195 0.016 A 144 ASP HBx H 1 2.171 0.018 A 144 ASP HBy H 1 2.497 0.017 A 144 ASP C C 13 177.518 0.032 A 144 ASP CA C 13 56.675 0.064 A 144 ASP CB C 13 41.609 0.068 A 144 ASP N N 15 122.475 0.036 A 145 HIS H H 1 8.771 0.005 A 145 HIS HA H 1 4.283 0.016 A 145 HIS HBy H 1 3.574 0.014 A 145 HIS HBx H 1 3.483 0.016 A 145 HIS HD1 H 1 7.257 0.006 A 145 HIS C C 13 175.587 0.029 A 145 HIS CA C 13 57.921 0.068 A 145 HIS CB C 13 27.689 0.051 A 145 HIS N N 15 113.319 0.012 A 146 ARG H H 1 7.172 0.003 A 146 ARG HA H 1 3.688 0.012 A 146 ARG HBx H 1 -0.857 0.010 A 146 ARG HBy H 1 0.533 0.018 A 146 ARG HDx H 1 1.736 0.010 A 146 ARG HDy H 1 2.129 0.016 A 146 ARG HGx H 1 0.728 0.021 A 146 ARG HGy H 1 0.877 0.011 A 146 ARG C C 13 179.927 0.062 A 146 ARG CA C 13 57.556 0.075 A 146 ARG CB C 13 31.223 0.053 A 146 ARG CD C 13 43.700 0.050 A 146 ARG CG C 13 27.421 0.049 A 146 ARG N N 15 118.290 0.015 A 147 GLY H H 1 8.286 0.003 A 147 GLY HAx H 1 3.825 0.021 A 147 GLY HAy H 1 4.842 0.014 A 147 GLY C C 13 174.739 0.017 A 147 GLY CA C 13 45.422 0.080 A 147 GLY N N 15 107.982 0.034 A 148 LYS H H 1 8.159 0.003 A 148 LYS HA H 1 4.042 0.011 A 148 LYS HBx H 1 2.014 0.039 A 148 LYS HBy H 1 2.014 0.039 A 148 LYS HDx H 1 1.827 0.012 A 148 LYS HDy H 1 1.827 0.012 A 148 LYS HEx H 1 3.114 0.013 A 148 LYS HEy H 1 3.114 0.013 A 148 LYS HGx H 1 1.442 0.032 A 148 LYS HGy H 1 1.555 0.025 A 148 LYS HZ1 H 1 6.917 0.006 A 148 LYS HZ2 H 1 6.917 0.006 A 148 LYS HZ3 H 1 6.917 0.006 A 148 LYS C C 13 176.868 0.038 A 148 LYS CA C 13 58.585 0.024 A 148 LYS CB C 13 29.911 0.096 A 148 LYS CD C 13 32.795 0.033 A 148 LYS CE C 13 43.300 0.045 A 148 LYS CG C 13 26.848 0.051 A 148 LYS N N 15 114.986 0.029 A 149 PHE H H 1 9.807 0.003 A 149 PHE HA H 1 4.360 0.013 A 149 PHE HBx H 1 2.740 0.010 A 149 PHE HBy H 1 3.016 0.014 A 149 PHE HDx H 1 7.083 0.000 A 149 PHE HDy H 1 7.083 0.000 A 149 PHE C C 13 175.410 0.013 A 149 PHE CA C 13 58.400 0.048 A 149 PHE CB C 13 42.302 0.053 A 149 PHE N N 15 123.872 0.023 A 150 LYS H H 1 7.285 0.005 A 150 LYS HA H 1 4.662 0.014 A 150 LYS HBx H 1 1.620 0.013 A 150 LYS HBy H 1 1.620 0.013 A 150 LYS HDx H 1 1.751 0.023 A 150 LYS HDy H 1 1.804 0.020 A 150 LYS HEx H 1 3.031 0.016 A 150 LYS HEy H 1 3.031 0.016 A 150 LYS HGx H 1 1.431 0.020 A 150 LYS HGy H 1 1.431 0.020 A 150 LYS HZ1 H 1 7.025 0.000 A 150 LYS HZ2 H 1 7.025 0.000 A 150 LYS HZ3 H 1 7.025 0.000 A 150 LYS C C 13 177.527 0.025 A 150 LYS CA C 13 54.812 0.067 A 150 LYS CB C 13 35.443 0.043 A 150 LYS CD C 13 29.803 0.034 A 150 LYS CE C 13 43.426 0.106 A 150 LYS CG C 13 25.888 0.016 A 150 LYS N N 15 124.610 0.021 A 151 VAL H H 1 10.072 0.004 A 151 VAL HA H 1 3.829 0.019 A 151 VAL HB H 1 2.442 0.011 A 151 VAL HGx% H 1 1.479 0.013 A 151 VAL HGy% H 1 1.329 0.011 A 151 VAL C C 13 176.604 0.024 A 151 VAL CA C 13 67.013 0.064 A 151 VAL CB C 13 32.206 0.064 A 151 VAL CGy C 13 25.819 0.054 A 151 VAL CGx C 13 22.791 0.024 A 151 VAL N N 15 132.158 0.056 A 152 ALA H H 1 9.744 0.006 A 152 ALA HA H 1 4.203 0.014 A 152 ALA HB% H 1 1.482 0.015 A 152 ALA C C 13 181.233 0.066 A 152 ALA CA C 13 56.087 0.054 A 152 ALA CB C 13 19.500 0.044 A 152 ALA N N 15 124.841 0.024 A 153 SER H H 1 6.756 0.012 A 153 SER HA H 1 4.186 0.013 A 153 SER HBx H 1 3.859 0.017 A 153 SER HBy H 1 3.859 0.017 A 153 SER C C 13 177.548 0.049 A 153 SER CA C 13 62.201 0.072 A 153 SER CB C 13 63.470 0.082 A 153 SER N N 15 111.434 0.088 A 154 PHE H H 1 8.089 0.009 A 154 PHE HA H 1 3.943 0.012 A 154 PHE HBx H 1 2.903 0.021 A 154 PHE HBy H 1 2.903 0.021 A 154 PHE C C 13 177.133 0.037 A 154 PHE CA C 13 62.965 0.058 A 154 PHE CB C 13 40.547 0.051 A 154 PHE N N 15 126.327 0.027 A 155 ARG H H 1 9.031 0.004 A 155 ARG HA H 1 3.671 0.010 A 155 ARG HBx H 1 1.087 0.015 A 155 ARG HBy H 1 1.185 0.011 A 155 ARG HDx H 1 2.719 0.024 A 155 ARG HDy H 1 2.978 0.000 A 155 ARG HGx H 1 2.284 0.018 A 155 ARG HGy H 1 2.284 0.018 A 155 ARG C C 13 179.399 0.032 A 155 ARG CA C 13 59.652 0.031 A 155 ARG CB C 13 28.012 0.078 A 155 ARG CD C 13 45.953 0.035 A 155 ARG CG C 13 25.830 0.008 A 155 ARG N N 15 118.523 0.026 A 156 LYS H H 1 7.555 0.007 A 156 LYS HA H 1 4.054 0.017 A 156 LYS HBx H 1 1.794 0.012 A 156 LYS HBy H 1 1.794 0.012 A 156 LYS HDx H 1 1.568 0.022 A 156 LYS HDy H 1 1.568 0.022 A 156 LYS HEx H 1 2.772 0.015 A 156 LYS HEy H 1 2.850 0.009 A 156 LYS HGy H 1 1.628 0.020 A 156 LYS HGx H 1 1.372 0.019 A 156 LYS C C 13 181.311 0.077 A 156 LYS CA C 13 61.413 0.034 A 156 LYS CB C 13 33.614 0.074 A 156 LYS CD C 13 30.510 0.018 A 156 LYS CE C 13 43.160 0.032 A 156 LYS CG C 13 28.403 0.025 A 156 LYS N N 15 121.228 0.041 A 157 LYS H H 1 7.956 0.005 A 157 LYS HA H 1 3.707 0.013 A 157 LYS HBx H 1 1.621 0.019 A 157 LYS HBy H 1 1.842 0.019 A 157 LYS HDx H 1 1.172 0.006 A 157 LYS HDy H 1 1.460 0.013 A 157 LYS HEx H 1 2.599 0.002 A 157 LYS HEy H 1 2.651 0.005 A 157 LYS HGx H 1 -0.289 0.012 A 157 LYS HGy H 1 0.882 0.016 A 157 LYS HZ1 H 1 6.758 0.000 A 157 LYS HZ2 H 1 6.758 0.000 A 157 LYS HZ3 H 1 6.758 0.000 A 157 LYS C C 13 178.511 0.050 A 157 LYS CA C 13 60.297 0.044 A 157 LYS CB C 13 32.634 0.068 A 157 LYS CD C 13 31.684 0.038 A 157 LYS CE C 13 42.628 0.063 A 157 LYS CG C 13 25.402 0.040 A 157 LYS N N 15 126.295 0.019 A 158 TYR H H 1 6.480 0.002 A 158 TYR HA H 1 4.311 0.013 A 158 TYR HBx H 1 1.858 0.022 A 158 TYR HBy H 1 3.398 0.013 A 158 TYR C C 13 173.941 0.003 A 158 TYR CA C 13 60.284 0.063 A 158 TYR CB C 13 38.813 0.062 A 158 TYR N N 15 115.057 0.013 A 159 GLU H H 1 7.731 0.006 A 159 GLU HA H 1 3.781 0.019 A 159 GLU HBx H 1 2.202 0.016 A 159 GLU HBy H 1 2.202 0.016 A 159 GLU HGx H 1 1.637 0.000 A 159 GLU HGy H 1 1.637 0.000 A 159 GLU C C 13 176.192 0.036 A 159 GLU CA C 13 58.072 0.071 A 159 GLU CB C 13 27.365 0.051 A 159 GLU CG C 13 35.923 0.000 A 159 GLU N N 15 113.425 0.026 A 160 LEU H H 1 8.407 0.003 A 160 LEU HA H 1 4.640 0.016 A 160 LEU HBx H 1 1.438 0.009 A 160 LEU HBy H 1 1.668 0.017 A 160 LEU HDx% H 1 0.978 0.011 A 160 LEU HDy% H 1 0.706 0.012 A 160 LEU HG H 1 1.640 0.003 A 160 LEU C C 13 179.356 0.054 A 160 LEU CA C 13 54.901 0.067 A 160 LEU CB C 13 42.219 0.054 A 160 LEU CDx C 13 24.399 0.076 A 160 LEU CDy C 13 24.696 0.034 A 160 LEU CG C 13 27.874 0.071 A 160 LEU N N 15 118.959 0.025 A 161 ARG H H 1 9.072 0.005 A 161 ARG HA H 1 4.155 0.014 A 161 ARG HBx H 1 1.881 0.016 A 161 ARG HBy H 1 2.142 0.013 A 161 ARG HDx H 1 3.190 0.018 A 161 ARG HDy H 1 3.346 0.016 A 161 ARG HGx H 1 1.654 0.015 A 161 ARG HGy H 1 1.833 0.010 A 161 ARG C C 13 174.183 0.013 A 161 ARG CA C 13 56.732 0.070 A 161 ARG CB C 13 32.155 0.068 A 161 ARG CD C 13 44.188 0.048 A 161 ARG CG C 13 29.760 0.072 A 161 ARG N N 15 124.501 0.036 A 162 ALA H H 1 7.570 0.003 A 162 ALA HA H 1 4.141 0.013 A 162 ALA HB% H 1 1.258 0.011 A 162 ALA C C 13 176.152 0.000 A 162 ALA CA C 13 52.598 0.052 A 162 ALA CB C 13 17.935 0.042 A 162 ALA N N 15 118.335 0.009 A 163 PRO HA H 1 3.882 0.012 A 163 PRO HBx H 1 1.242 0.017 A 163 PRO HBy H 1 1.437 0.012 A 163 PRO HDx H 1 3.251 0.014 A 163 PRO HDy H 1 3.667 0.016 A 163 PRO HGx H 1 1.796 0.024 A 163 PRO HGy H 1 1.890 0.010 A 163 PRO C C 13 178.544 0.056 A 163 PRO CA C 13 65.429 0.054 A 163 PRO CB C 13 32.067 0.055 A 163 PRO CD C 13 51.248 0.098 A 163 PRO CG C 13 29.143 0.056 A 164 VAL H H 1 8.447 0.006 A 164 VAL HA H 1 4.218 0.016 A 164 VAL HB H 1 2.339 0.012 A 164 VAL HGx% H 1 1.065 0.011 A 164 VAL HGy% H 1 0.946 0.022 A 164 VAL C C 13 176.025 0.028 A 164 VAL CA C 13 63.776 0.069 A 164 VAL CB C 13 33.386 0.073 A 164 VAL CGy C 13 22.894 0.042 A 164 VAL CGx C 13 22.714 0.081 A 164 VAL N N 15 121.605 0.029 A 165 ALA H H 1 7.393 0.004 A 165 ALA HA H 1 5.758 0.020 A 165 ALA HB% H 1 0.433 0.015 A 165 ALA C C 13 176.644 0.015 A 165 ALA CA C 13 51.157 0.070 A 165 ALA CB C 13 22.911 0.058 A 165 ALA N N 15 119.899 0.024 A 166 GLY H H 1 7.414 0.013 A 166 GLY HAx H 1 4.207 0.020 A 166 GLY HAy H 1 4.607 0.017 A 166 GLY C C 13 173.342 0.022 A 166 GLY CA C 13 48.150 0.034 A 166 GLY N N 15 104.604 0.014 A 167 THR H H 1 9.763 0.007 A 167 THR HA H 1 4.793 0.014 A 167 THR HB H 1 4.894 0.014 A 167 THR HG2% H 1 1.362 0.018 A 167 THR C C 13 172.644 0.011 A 167 THR CA C 13 62.349 0.051 A 167 THR CB C 13 68.719 0.108 A 167 THR CG2 C 13 21.881 0.033 A 167 THR N N 15 113.826 0.049 A 168 CYS H H 1 8.935 0.011 A 168 CYS HA H 1 5.990 0.027 A 168 CYS HBx H 1 2.129 0.016 A 168 CYS HBy H 1 2.992 0.016 A 168 CYS C C 13 174.881 0.018 A 168 CYS CA C 13 57.212 0.043 A 168 CYS CB C 13 32.132 0.055 A 168 CYS N N 15 121.990 0.024 A 169 TYR H H 1 9.237 0.008 A 169 TYR HA H 1 5.657 0.014 A 169 TYR HBx H 1 3.028 0.016 A 169 TYR HBy H 1 3.862 0.018 A 169 TYR C C 13 173.498 0.014 A 169 TYR CA C 13 56.834 0.075 A 169 TYR CB C 13 42.960 0.042 A 169 TYR N N 15 127.531 0.016 A 170 GLN H H 1 9.358 0.013 A 170 GLN HA H 1 5.971 0.018 A 170 GLN HBx H 1 1.710 0.039 A 170 GLN HBy H 1 2.112 0.015 A 170 GLN HE2x H 1 6.794 0.001 A 170 GLN HGx H 1 1.769 0.010 A 170 GLN HGy H 1 1.769 0.010 A 170 GLN C C 13 175.677 0.012 A 170 GLN CA C 13 54.738 0.080 A 170 GLN CB C 13 37.750 0.094 A 170 GLN CG C 13 44.891 0.000 A 170 GLN N N 15 120.400 0.039 A 171 ALA H H 1 8.464 0.012 A 171 ALA HA H 1 5.218 0.016 A 171 ALA HB% H 1 1.303 0.012 A 171 ALA C C 13 176.442 0.016 A 171 ALA CA C 13 53.630 0.043 A 171 ALA CB C 13 23.570 0.062 A 171 ALA N N 15 118.709 0.025 A 172 GLU H H 1 8.985 0.012 A 172 GLU HA H 1 4.982 0.013 A 172 GLU HBx H 1 1.740 0.022 A 172 GLU HBy H 1 1.740 0.022 A 172 GLU HGx H 1 2.227 0.025 A 172 GLU HGy H 1 2.227 0.025 A 172 GLU C C 13 175.130 0.004 A 172 GLU CA C 13 54.382 0.088 A 172 GLU CB C 13 34.370 0.037 A 172 GLU CG C 13 35.308 0.036 A 172 GLU N N 15 120.020 0.025 A 173 TRP H H 1 8.240 0.006 A 173 TRP HA H 1 3.730 0.013 A 173 TRP HBx H 1 3.190 0.020 A 173 TRP HBy H 1 3.190 0.020 A 173 TRP HD1 H 1 7.751 0.001 A 173 TRP C C 13 177.556 0.032 A 173 TRP CA C 13 63.009 0.093 A 173 TRP CB C 13 31.442 0.083 A 173 TRP N N 15 118.793 0.023 A 174 ASP H H 1 6.439 0.003 A 174 ASP HA H 1 4.002 0.031 A 174 ASP HBx H 1 2.993 0.021 A 174 ASP HBy H 1 2.993 0.021 A 174 ASP C C 13 175.299 0.037 A 174 ASP CA C 13 54.022 0.060 A 174 ASP CB C 13 43.244 0.070 A 174 ASP N N 15 125.002 0.033 A 175 ASP H H 1 7.456 0.004 A 175 ASP HA H 1 3.499 0.020 A 175 ASP HBx H 1 2.510 0.024 A 175 ASP HBy H 1 2.645 0.022 A 175 ASP C C 13 178.151 0.019 A 175 ASP CA C 13 56.765 0.043 A 175 ASP CB C 13 41.161 0.063 A 175 ASP N N 15 111.166 0.015 A 176 TYR H H 1 8.287 0.006 A 176 TYR HA H 1 4.271 0.021 A 176 TYR HBx H 1 2.822 0.017 A 176 TYR HBy H 1 3.138 0.014 A 176 TYR C C 13 177.744 0.056 A 176 TYR CA C 13 60.563 0.081 A 176 TYR CB C 13 40.285 0.065 A 176 TYR N N 15 122.311 0.037 A 177 VAL H H 1 7.348 0.003 A 177 VAL HA H 1 3.003 0.011 A 177 VAL HB H 1 1.846 0.014 A 177 VAL HGx% H 1 0.562 0.009 A 177 VAL HGy% H 1 0.964 0.012 A 177 VAL C C 13 174.979 0.000 A 177 VAL CA C 13 69.899 0.061 A 177 VAL CB C 13 29.373 0.073 A 177 VAL CGx C 13 22.729 0.026 A 177 VAL CGy C 13 26.421 0.041 A 177 VAL N N 15 119.733 0.055 A 178 PRO HA H 1 4.207 0.037 A 178 PRO HBx H 1 1.708 0.019 A 178 PRO HBy H 1 2.439 0.013 A 178 PRO HDx H 1 3.338 0.014 A 178 PRO HDy H 1 3.515 0.016 A 178 PRO HGx H 1 2.284 0.018 A 178 PRO HGy H 1 2.284 0.018 A 178 PRO C C 13 180.953 0.000 A 178 PRO CA C 13 67.355 0.042 A 178 PRO CB C 13 32.680 0.073 A 178 PRO CD C 13 50.188 0.041 A 178 PRO CG C 13 29.959 0.061 A 179 LYS H H 1 7.086 0.004 A 179 LYS HA H 1 3.978 0.021 A 179 LYS HBx H 1 1.690 0.021 A 179 LYS HBy H 1 1.690 0.021 A 179 LYS HDx H 1 1.676 0.022 A 179 LYS HDy H 1 1.676 0.022 A 179 LYS HEx H 1 2.960 0.027 A 179 LYS HEy H 1 2.960 0.027 A 179 LYS HGx H 1 1.389 0.024 A 179 LYS HGy H 1 1.389 0.024 A 179 LYS C C 13 180.606 0.041 A 179 LYS CA C 13 58.985 0.122 A 179 LYS CB C 13 31.790 0.078 A 179 LYS CD C 13 29.652 0.025 A 179 LYS CE C 13 43.041 0.084 A 179 LYS CG C 13 26.000 0.049 A 179 LYS N N 15 117.099 0.012 A 180 LEU H H 1 7.188 0.008 A 180 LEU HA H 1 3.875 0.017 A 180 LEU HBx H 1 1.075 0.014 A 180 LEU HBy H 1 1.602 0.016 A 180 LEU HDx% H 1 0.810 0.012 A 180 LEU HDy% H 1 0.443 0.021 A 180 LEU HG H 1 1.211 0.015 A 180 LEU C C 13 180.123 0.089 A 180 LEU CA C 13 58.711 0.121 A 180 LEU CB C 13 41.957 0.056 A 180 LEU CDx C 13 24.533 0.050 A 180 LEU CDy C 13 27.121 0.068 A 180 LEU CG C 13 27.884 0.066 A 180 LEU N N 15 125.108 0.017 A 181 TYR H H 1 8.066 0.010 A 181 TYR HA H 1 4.030 0.010 A 181 TYR HBx H 1 2.896 0.010 A 181 TYR HBy H 1 3.049 0.016 A 181 TYR HDx H 1 7.074 0.000 A 181 TYR HDy H 1 7.130 0.000 A 181 TYR C C 13 180.631 0.000 A 181 TYR CA C 13 62.749 0.062 A 181 TYR CB C 13 37.483 0.099 A 181 TYR N N 15 117.299 0.030 A 182 GLU H H 1 7.690 0.004 A 182 GLU HA H 1 4.067 0.016 A 182 GLU HBx H 1 2.084 0.017 A 182 GLU HBy H 1 2.233 0.012 A 182 GLU HGx H 1 2.488 0.012 A 182 GLU HGy H 1 2.488 0.012 A 182 GLU C C 13 180.306 0.078 A 182 GLU CA C 13 60.799 0.080 A 182 GLU CB C 13 30.013 0.192 A 182 GLU CG C 13 36.399 0.000 A 182 GLU N N 15 121.476 0.034 A 183 GLN H H 1 7.778 0.002 A 183 GLN HA H 1 4.147 0.013 A 183 GLN HBx H 1 2.301 0.004 A 183 GLN HBy H 1 2.401 0.010 A 183 GLN HE2y H 1 7.723 0.006 A 183 GLN HE2x H 1 7.437 0.007 A 183 GLN HGx H 1 2.385 0.015 A 183 GLN HGy H 1 2.385 0.015 A 183 GLN C C 13 179.719 0.071 A 183 GLN CA C 13 60.081 0.044 A 183 GLN CB C 13 30.029 0.044 A 183 GLN CG C 13 34.905 0.037 A 183 GLN N N 15 123.315 0.012 A 183 GLN NE2 N 15 112.703 0.060 A 184 LEU H H 1 7.905 0.004 A 184 LEU HA H 1 3.931 0.014 A 184 LEU HBx H 1 1.502 0.020 A 184 LEU HBy H 1 1.718 0.019 A 184 LEU HDx% H 1 0.660 0.011 A 184 LEU HDy% H 1 0.654 0.013 A 184 LEU HG H 1 1.715 0.013 A 184 LEU C C 13 177.490 0.034 A 184 LEU CA C 13 56.805 0.047 A 184 LEU CB C 13 43.212 0.045 A 184 LEU CDy C 13 27.068 0.104 A 184 LEU CDx C 13 23.481 0.054 A 184 LEU CG C 13 27.384 0.037 A 184 LEU N N 15 117.513 0.065 A 185 SER H H 1 7.563 0.003 A 185 SER HA H 1 4.571 0.013 A 185 SER HBx H 1 4.046 0.013 A 185 SER HBy H 1 4.046 0.013 A 185 SER C C 13 176.163 0.033 A 185 SER CA C 13 59.838 0.082 A 185 SER CB C 13 65.117 0.068 A 185 SER N N 15 113.902 0.017 A 186 GLY H H 1 7.963 0.010 A 186 GLY HAx H 1 3.980 0.013 A 186 GLY HAy H 1 4.149 0.014 A 186 GLY C C 13 174.851 0.007 A 186 GLY CA C 13 47.168 0.051 A 186 GLY N N 15 111.217 0.012 A 187 LYS H H 1 7.675 0.008 A 187 LYS HA H 1 4.187 0.013 A 187 LYS HBx H 1 1.615 0.015 A 187 LYS HBy H 1 1.843 0.012 A 187 LYS HDx H 1 1.648 0.010 A 187 LYS HDy H 1 1.648 0.010 A 187 LYS HEx H 1 2.976 0.015 A 187 LYS HEy H 1 2.976 0.015 A 187 LYS HGx H 1 1.365 0.014 A 187 LYS HGy H 1 1.365 0.014 A 187 LYS C C 13 181.968 0.000 A 187 LYS CA C 13 58.371 0.056 A 187 LYS CB C 13 34.790 0.052 A 187 LYS CD C 13 30.013 0.076 A 187 LYS CE C 13 43.191 0.021 A 187 LYS CG C 13 26.158 0.011 A 187 LYS N N 15 125.801 0.007 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 66 LEU HDx% A 124 VAL HGx% 1.0 1.429 2.297 2 2 A 122 TRP HBy A 68 LEU HDy% 1.0 1.829 3.831 3 3 A 74 PRO HDy A 80 LYS HBy 1.0 1.813 3.741 4 4 A 74 PRO HDy A 80 LYS HBx 1.0 1.827 3.821 5 5 A 165 ALA HB% A 124 VAL HGy% 1.0 1.546 2.644 6 6 A 85 HIS HBy A 67 VAL HGx% 1.0 1.517 2.553 7 6 A 85 HIS HBx A 67 VAL HGx% 1.0 1.517 2.553 8 7 A 8 TRP HBx A 5 LEU HDx% 1.0 1.823 3.795 9 8 A 180 LEU HDy% A 107 VAL HGx% 1.0 1.506 2.516 10 9 A 145 HIS HBy A 138 LEU HDx% 1.0 1.612 2.864 11 10 A 138 LEU HDx% A 145 HIS HBx 1.0 1.661 3.045 12 11 A 167 THR HG2% A 34 VAL HB 1.0 1.706 3.228 13 12 A 121 VAL HGx% A 123 LEU HDy% 1.0 1.548 2.648 14 13 A 41 LEU HDx% A 32 ALA HB% 1.0 1.431 2.303 15 14 A 168 CYS HBy A 37 LEU HDy% 1.0 1.676 3.106 16 15 A 8 TRP HA A 14 LEU HDx% 1.0 1.645 2.983 17 16 A 55 TRP HA A 25 LEU HDx% 1.0 1.624 2.906 18 17 A 66 LEU HDx% A 66 LEU HG 1.0 1.525 2.577 19 18 A 47 LYS HA A 47 LYS HBx 1.0 1.544 2.636 20 19 A 125 TYR HBx A 160 LEU HDy% 1.0 1.634 2.944 21 20 A 29 TYR HA A 51 THR HG2% 1.0 1.612 2.864 22 21 A 1 MET HA A 2 PRO HDy 1.0 1.427 2.291 23 22 A 1 MET HA A 1 MET HBy 1.0 1.620 2.892 24 23 A 1 MET HA A 1 MET HBx 1.0 1.637 2.955 25 24 A 1 MET HA A 1 MET HGy 1.0 1.708 3.236 26 25 A 1 MET HBy A 1 MET HGy 1.0 1.429 2.297 27 26 A 2 PRO HDy A 1 MET HGy 1.0 1.797 3.655 28 27 A 1 MET HA A 1 MET HGx 1.0 1.723 3.299 29 28 A 1 MET HBx A 1 MET HGx 1.0 1.439 2.323 30 29 A 2 PRO HA A 2 PRO HBy 1.0 1.422 2.276 31 30 A 2 PRO HA A 3 VAL HGy% 1.0 1.704 3.216 32 30 A 2 PRO HA A 3 VAL HGx% 1.0 1.704 3.216 33 31 A 2 PRO HBy A 2 PRO HBx 1.0 1.257 1.865 34 32 A 2 PRO HBx A 2 PRO HDx 1.0 1.619 2.891 35 33 A 2 PRO HDx A 2 PRO HGx 1.0 1.416 2.260 36 34 A 3 VAL HGx% A 3 VAL HA 1.0 1.345 2.077 37 34 A 3 VAL HGy% A 3 VAL HA 1.0 1.345 2.077 38 35 A 3 VAL HGy% A 36 GLU HA 1.0 1.532 2.596 39 36 A 4 ASP HA A 4 ASP HBx 1.0 1.481 2.445 40 37 A 4 ASP HA A 4 ASP HBy 1.0 1.646 2.988 41 38 A 5 LEU HA A 5 LEU HDy% 1.0 1.693 3.175 42 39 A 5 LEU HDx% A 5 LEU HA 1.0 1.457 2.373 43 40 A 5 LEU HDx% A 5 LEU HDy% 1.0 1.364 2.124 44 41 A 5 LEU HDx% A 24 PRO HA 1.0 1.572 2.728 45 42 A 5 LEU HDx% A 24 PRO HBy 1.0 1.578 2.748 46 43 A 5 LEU HDy% A 23 HIS HA 1.0 1.755 3.445 47 44 A 5 LEU HDy% A 24 PRO HA 1.0 1.635 2.947 48 45 A 7 LYS HBy A 7 LYS HA 1.0 1.684 3.136 49 46 A 7 LYS HA A 7 LYS HBx 1.0 1.682 3.128 50 47 A 7 LYS HA A 7 LYS HGy 1.0 1.627 2.917 51 48 A 7 LYS HGy A 7 LYS HEx 1.0 1.659 3.039 52 49 A 7 LYS HGy A 7 LYS HGx 1.0 1.385 2.179 53 50 A 7 LYS HEx A 7 LYS HGx 1.0 1.614 2.872 54 51 A 8 TRP HBx A 8 TRP HBy 1.0 1.689 3.157 55 52 A 8 TRP HBx A 20 GLN HBy 1.0 1.861 4.031 56 53 A 8 TRP HBx A 20 GLN HGx 1.0 1.807 3.709 57 54 A 9 SER HA A 9 SER HBx 1.0 1.513 2.541 58 55 A 9 SER HA A 13 SER HA 1.0 1.669 3.075 59 56 A 9 SER HA A 14 LEU HG 1.0 1.865 4.051 60 57 A 9 SER HA A 15 GLN HBx 1.0 1.834 3.864 61 58 A 9 SER HA A 9 SER HBy 1.0 1.516 2.548 62 59 A 10 GLY HAy A 10 GLY HAx 1.0 1.471 2.415 63 60 A 10 GLY HAy A 11 PRO HGx 1.0 1.756 3.450 64 61 A 11 PRO HA A 11 PRO HBy 1.0 1.482 2.446 65 62 A 11 PRO HA A 11 PRO HBx 1.0 1.524 2.572 66 63 A 11 PRO HBy A 11 PRO HDy 1.0 1.589 2.785 67 64 A 11 PRO HBy A 11 PRO HBx 1.0 1.402 2.222 68 65 A 10 GLY HAy A 11 PRO HDy 1.0 1.680 3.120 69 66 A 11 PRO HBx A 11 PRO HDy 1.0 1.776 3.550 70 67 A 11 PRO HGx A 11 PRO HDy 1.0 1.631 2.933 71 68 A 10 GLY HAy A 11 PRO HDx 1.0 1.658 3.034 72 69 A 11 PRO HDy A 11 PRO HDx 1.0 1.543 2.635 73 70 A 11 PRO HGx A 11 PRO HDx 1.0 1.599 2.819 74 71 A 12 LEU HA A 12 LEU HBy 1.0 1.570 2.720 75 72 A 12 LEU HA A 12 LEU HBx 1.0 1.610 2.856 76 73 A 12 LEU HA A 12 LEU HDx% 1.0 1.494 2.484 77 73 A 12 LEU HA A 12 LEU HDy% 1.0 1.494 2.484 78 74 A 12 LEU HA A 119 ARG HDy 1.0 1.814 3.746 79 75 A 12 LEU HBy A 12 LEU HBx 1.0 1.642 2.972 80 76 A 12 LEU HBy A 12 LEU HDx% 1.0 1.570 2.718 81 76 A 12 LEU HBy A 12 LEU HDy% 1.0 1.570 2.718 82 77 A 12 LEU HBx A 12 LEU HDy% 1.0 1.680 3.120 83 77 A 12 LEU HBx A 12 LEU HDx% 1.0 1.680 3.120 84 78 A 14 LEU HDx% A 12 LEU HBx 1.0 1.849 3.951 85 79 A 12 LEU HDx% A 38 GLY HAy 1.0 1.625 2.909 86 80 A 12 LEU HDx% A 38 GLY HAx 1.0 1.684 3.138 87 81 A 12 LEU HDy% A 38 GLY HAy 1.0 1.623 2.905 88 82 A 12 LEU HDy% A 38 GLY HAx 1.0 1.670 3.082 89 83 A 12 LEU HDy% A 119 ARG HDy 1.0 1.653 3.017 90 84 A 12 LEU HDy% A 119 ARG HDx 1.0 1.728 3.324 91 85 A 13 SER HA A 14 LEU H 1.0 1.698 3.190 92 86 A 9 SER HA A 13 SER HBy 1.0 1.877 4.141 93 87 A 13 SER HA A 13 SER HBy 1.0 1.560 2.688 94 88 A 13 SER HBy A 13 SER HBx 1.0 1.356 2.104 95 89 A 13 SER HBy A 13 SER H 1.0 1.711 3.251 96 90 A 13 SER HBy A 16 GLU HGy 1.0 1.781 3.575 97 91 A 13 SER HBy A 16 GLU HGx 1.0 1.783 3.585 98 92 A 13 SER HA A 13 SER HBx 1.0 1.607 2.849 99 93 A 13 SER HBx A 13 SER H 1.0 1.721 3.291 100 94 A 13 SER HBx A 16 GLU HGy 1.0 1.818 3.768 101 95 A 13 SER HBx A 16 GLU HGx 1.0 1.848 3.950 102 96 A 14 LEU HA A 14 LEU HBy 1.0 1.638 2.960 103 97 A 14 LEU HG A 14 LEU HA 1.0 1.754 3.436 104 98 A 14 LEU HBy A 14 LEU HDy% 1.0 1.854 3.988 105 99 A 14 LEU HG A 14 LEU HBy 1.0 1.878 4.144 106 100 A 14 LEU HA A 14 LEU HBx 1.0 1.875 4.127 107 101 A 14 LEU HBy A 14 LEU HBx 1.0 1.730 3.332 108 102 A 14 LEU HG A 14 LEU HBx 1.0 1.878 4.148 109 103 A 14 LEU HDx% A 12 LEU HBy 1.0 1.686 3.142 110 104 A 14 LEU HDx% A 12 LEU HDy% 1.0 1.577 2.743 111 104 A 14 LEU HDx% A 12 LEU HDx% 1.0 1.577 2.743 112 105 A 14 LEU HDx% A 14 LEU HG 1.0 1.514 2.540 113 106 A 14 LEU HDx% A 121 VAL HGy% 1.0 1.573 2.733 114 107 A 14 LEU HDx% A 168 CYS HBx 1.0 1.721 3.289 115 108 A 14 LEU HDx% A 14 LEU HDy% 1.0 1.485 2.453 116 109 A 119 ARG HDy A 14 LEU HDy% 1.0 1.727 3.317 117 110 A 119 ARG HDx A 14 LEU HDy% 1.0 1.716 3.270 118 111 A 14 LEU HDy% A 168 CYS HBx 1.0 1.692 3.172 119 112 A 15 GLN HA A 15 GLN HGx 1.0 1.718 3.276 120 113 A 15 GLN HA A 18 ASP H 1.0 1.724 3.308 121 114 A 15 GLN HBx A 15 GLN HA 1.0 1.737 3.363 122 115 A 15 GLN HBx A 15 GLN HGx 1.0 1.435 2.313 123 116 A 16 GLU HGx A 16 GLU HA 1.0 1.566 2.708 124 117 A 16 GLU HA A 16 GLU HBx 1.0 1.673 3.091 125 118 A 16 GLU HGy A 16 GLU HA 1.0 1.761 3.475 126 119 A 16 GLU HGy A 16 GLU HBx 1.0 1.671 3.083 127 120 A 16 GLU HGy A 16 GLU HGx 1.0 1.543 2.631 128 121 A 17 VAL HA A 17 VAL HB 1.0 1.709 3.239 129 122 A 18 ASP H A 17 VAL HA 1.0 1.827 3.821 130 123 A 17 VAL HA A 151 VAL HGy% 1.0 1.740 3.378 131 124 A 17 VAL HB A 17 VAL HGx% 1.0 1.471 2.413 132 125 A 17 VAL HGx% A 18 ASP HBy 1.0 1.706 3.228 133 126 A 18 ASP H A 17 VAL HGx% 1.0 1.667 3.071 134 127 A 17 VAL HB A 17 VAL HGy% 1.0 1.513 2.537 135 128 A 17 VAL HGy% A 71 PRO HDy 1.0 1.774 3.536 136 129 A 17 VAL HGy% A 83 GLU HGx 1.0 1.783 3.579 137 130 A 18 ASP H A 18 ASP HA 1.0 1.672 3.086 138 131 A 18 ASP HBy A 18 ASP HA 1.0 1.735 3.353 139 132 A 18 ASP HA A 18 ASP HBx 1.0 1.766 3.494 140 133 A 18 ASP HBy A 18 ASP HBx 1.0 1.620 2.894 141 134 A 19 GLU HA A 19 GLU HBy 1.0 1.550 2.656 142 135 A 19 GLU HA A 19 GLU HGx 1.0 1.521 2.565 143 136 A 19 GLU HBy A 19 GLU HBx 1.0 1.356 2.106 144 137 A 19 GLU HA A 19 GLU HBx 1.0 1.646 2.988 145 138 A 18 ASP HA A 19 GLU HGy 1.0 1.819 3.771 146 139 A 19 GLU HBx A 19 GLU HGy 1.0 1.509 2.527 147 140 A 20 GLN HA A 21 PRO HDx 1.0 1.631 2.933 148 141 A 21 PRO HA A 21 PRO HBx 1.0 1.594 2.802 149 142 A 21 PRO HA A 163 PRO HGx 1.0 1.671 3.085 150 143 A 21 PRO HA A 21 PRO HBy 1.0 1.802 3.676 151 144 A 21 PRO HBy A 21 PRO HGx 1.0 1.721 3.289 152 145 A 21 PRO HBy A 166 GLY H 1.0 1.830 3.842 153 146 A 21 PRO HBx A 21 PRO HGx 1.0 1.749 3.417 154 147 A 21 PRO HBx A 166 GLY H 1.0 1.831 3.845 155 148 A 21 PRO HDx A 21 PRO HGy 1.0 1.760 3.468 156 149 A 22 GLN HA A 22 GLN HBy 1.0 1.455 2.367 157 150 A 22 GLN HA A 22 GLN HBx 1.0 1.510 2.532 158 151 A 22 GLN HBy A 164 VAL HA 1.0 1.695 3.181 159 152 A 22 GLN HBy A 22 GLN HBx 1.0 1.410 2.244 160 153 A 22 GLN HBx A 22 GLN HGy 1.0 1.521 2.565 161 154 A 22 GLN HGy A 22 GLN HGx 1.0 1.259 1.871 162 155 A 22 GLN HGy A 23 HIS H 1.0 1.776 3.546 163 156 A 164 VAL HA A 22 GLN HGy 1.0 1.628 2.922 164 157 A 22 GLN HGx A 23 HIS H 1.0 1.751 3.429 165 158 A 22 GLN HGx A 164 VAL HGx% 1.0 1.745 3.399 166 159 A 23 HIS HA A 23 HIS HBy 1.0 1.709 3.241 167 160 A 23 HIS HA A 23 HIS HBx 1.0 1.772 3.528 168 161 A 23 HIS HA A 23 HIS H 1.0 1.803 3.687 169 162 A 23 HIS HA A 24 PRO HDy 1.0 1.657 3.031 170 163 A 23 HIS HA A 24 PRO HDx 1.0 1.641 2.967 171 164 A 23 HIS H A 23 HIS HBy 1.0 1.817 3.767 172 165 A 23 HIS HBy A 23 HIS HBx 1.0 1.707 3.233 173 166 A 23 HIS H A 23 HIS HBx 1.0 1.800 3.668 174 167 A 24 PRO HA A 24 PRO HBy 1.0 1.649 3.001 175 168 A 24 PRO HBy A 25 LEU H 1.0 1.825 3.805 176 169 A 3 VAL HGx% A 24 PRO HBx 1.0 1.615 2.877 177 169 A 3 VAL HGy% A 24 PRO HBx 1.0 1.615 2.877 178 170 A 24 PRO HA A 24 PRO HBx 1.0 1.688 3.150 179 171 A 5 LEU HDy% A 24 PRO HDy 1.0 1.843 3.915 180 172 A 24 PRO HDy A 24 PRO HDx 1.0 1.638 2.960 181 173 A 24 PRO HDy A 24 PRO HGx 1.0 1.672 3.088 182 174 A 23 HIS HBx A 24 PRO HDx 1.0 1.863 4.045 183 175 A 23 HIS HA A 24 PRO HGy 1.0 1.812 3.736 184 176 A 24 PRO HA A 24 PRO HGy 1.0 1.766 3.500 185 177 A 24 PRO HBx A 24 PRO HGy 1.0 1.641 2.969 186 178 A 24 PRO HDy A 24 PRO HGy 1.0 1.688 3.150 187 179 A 24 PRO HDx A 24 PRO HGy 1.0 1.678 3.112 188 180 A 24 PRO HBx A 24 PRO HGx 1.0 1.639 2.961 189 181 A 24 PRO HDx A 24 PRO HGx 1.0 1.666 3.062 190 182 A 25 LEU HA A 25 LEU HBx 1.0 1.615 2.875 191 183 A 25 LEU H A 25 LEU HA 1.0 1.864 4.050 192 184 A 25 LEU HA A 55 TRP HBy 1.0 1.837 3.879 193 185 A 25 LEU HBy A 167 THR HB 1.0 1.852 3.970 194 186 A 25 LEU HBx A 25 LEU HBy 1.0 1.756 3.448 195 187 A 25 LEU HBx A 25 LEU HDy% 1.0 1.783 3.583 196 188 A 25 LEU HDx% A 55 TRP HBx 1.0 1.771 3.523 197 189 A 25 LEU HDx% A 25 LEU HDy% 1.0 1.522 2.566 198 190 A 122 TRP HBy A 25 LEU HDy% 1.0 1.695 3.177 199 191 A 124 VAL HGx% A 25 LEU HDy% 1.0 1.508 2.522 200 192 A 25 LEU HDy% A 166 GLY HAx 1.0 1.823 3.801 201 193 A 26 HIS HA A 27 VAL HGx% 1.0 1.746 3.402 202 193 A 26 HIS HA A 27 VAL HGy% 1.0 1.746 3.402 203 194 A 27 VAL HGy% A 27 VAL HA 1.0 1.534 2.604 204 194 A 27 VAL HGx% A 27 VAL HA 1.0 1.534 2.604 205 195 A 27 VAL HA A 53 ILE HA 1.0 1.734 3.352 206 196 A 27 VAL HA A 53 ILE HG2% 1.0 1.671 3.087 207 197 A 27 VAL HGx% A 27 VAL HB 1.0 1.432 2.304 208 197 A 27 VAL HGy% A 27 VAL HB 1.0 1.432 2.304 209 198 A 34 VAL HB A 27 VAL HGx% 1.0 1.663 3.053 210 198 A 34 VAL HB A 27 VAL HGy% 1.0 1.663 3.053 211 199 A 27 VAL HGx% A 53 ILE HA 1.0 1.631 2.935 212 199 A 27 VAL HGy% A 53 ILE HA 1.0 1.631 2.935 213 200 A 28 THR HA A 28 THR H 1.0 1.745 3.397 214 201 A 28 THR HA A 28 THR HB 1.0 1.584 2.766 215 202 A 28 THR HB A 28 THR HG2% 1.0 1.422 2.278 216 203 A 28 THR HB A 29 TYR H 1.0 1.757 3.451 217 204 A 28 THR HB A 52 SER HBx 1.0 1.598 2.814 218 205 A 28 THR HA A 28 THR HG2% 1.0 1.398 2.214 219 206 A 29 TYR HA A 29 TYR HBy 1.0 1.689 3.157 220 207 A 29 TYR HA A 29 TYR HBx 1.0 1.721 3.291 221 208 A 29 TYR H A 29 TYR HBx 1.0 1.851 3.963 222 209 A 32 ALA HB% A 29 TYR HBx 1.0 1.785 3.589 223 210 A 31 GLY HAy A 30 ALA HB% 1.0 1.811 3.733 224 211 A 31 GLY HAy A 31 GLY HAx 1.0 1.389 2.189 225 212 A 29 TYR HBy A 32 ALA HA 1.0 1.897 4.287 226 213 A 32 ALA HB% A 29 TYR HBy 1.0 1.614 2.872 227 214 A 28 THR HA A 33 ALA HA 1.0 1.574 2.732 228 215 A 28 THR HB A 33 ALA HA 1.0 1.839 3.891 229 216 A 28 THR HG2% A 33 ALA HA 1.0 1.634 2.944 230 217 A 29 TYR H A 33 ALA HA 1.0 1.770 3.518 231 218 A 33 ALA HA A 33 ALA HB% 1.0 1.464 2.394 232 219 A 28 THR HA A 33 ALA HB% 1.0 1.482 2.444 233 220 A 28 THR HG2% A 33 ALA HB% 1.0 1.370 2.142 234 221 A 33 ALA HB% A 35 ASP HBx 1.0 1.570 2.720 235 222 A 34 VAL HA A 34 VAL HGx% 1.0 1.526 2.578 236 223 A 34 VAL HA A 39 LYS HDx 1.0 1.526 2.580 237 224 A 34 VAL HA A 39 LYS HEx 1.0 1.787 3.601 238 225 A 41 LEU HDx% A 34 VAL HA 1.0 1.818 3.766 239 226 A 34 VAL HB A 27 VAL HB 1.0 1.673 3.093 240 227 A 34 VAL HB A 34 VAL HA 1.0 1.816 3.758 241 228 A 34 VAL HB A 34 VAL HGx% 1.0 1.587 2.777 242 229 A 34 VAL HB A 34 VAL HGy% 1.0 1.616 2.878 243 230 A 34 VAL HGx% A 169 TYR HA 1.0 1.741 3.381 244 231 A 34 VAL HGy% A 41 LEU HDy% 1.0 1.433 2.309 245 232 A 34 VAL HGy% A 169 TYR HBx 1.0 1.674 3.098 246 233 A 3 VAL HGx% A 35 ASP HA 1.0 1.568 2.714 247 233 A 3 VAL HGy% A 35 ASP HA 1.0 1.568 2.714 248 234 A 35 ASP HBx A 35 ASP HA 1.0 1.472 2.420 249 235 A 33 ALA HB% A 35 ASP HBy 1.0 1.803 3.685 250 236 A 35 ASP HBx A 35 ASP HBy 1.0 1.417 2.265 251 237 A 3 VAL HGx% A 36 GLU HA 1.0 1.540 2.626 252 237 A 3 VAL HGy% A 36 GLU HA 1.0 1.540 2.626 253 238 A 36 GLU HA A 36 GLU HGx 1.0 1.554 2.670 254 239 A 37 LEU HA A 37 LEU HBy 1.0 1.673 3.095 255 240 A 37 LEU HA A 37 LEU HG 1.0 1.623 2.905 256 241 A 37 LEU HA A 168 CYS H 1.0 1.737 3.365 257 242 A 37 LEU HBy A 37 LEU HBx 1.0 1.534 2.606 258 243 A 37 LEU HBy A 37 LEU HDx% 1.0 1.582 2.762 259 244 A 37 LEU HDy% A 37 LEU HBy 1.0 1.681 3.125 260 245 A 37 LEU HA A 37 LEU HBx 1.0 1.764 3.484 261 246 A 37 LEU HBx A 37 LEU HDx% 1.0 1.580 2.754 262 247 A 5 LEU HA A 37 LEU HDx% 1.0 1.634 2.942 263 248 A 37 LEU HG A 37 LEU HDx% 1.0 1.465 2.397 264 249 A 37 LEU HDy% A 37 LEU HA 1.0 1.522 2.566 265 250 A 37 LEU HDy% A 38 GLY HAx 1.0 1.802 3.684 266 251 A 37 LEU HDy% A 167 THR HA 1.0 1.572 2.728 267 252 A 168 CYS HBy A 37 LEU HDy% 1.0 1.653 3.013 268 253 A 37 LEU HDy% A 168 CYS H 1.0 1.488 2.464 269 254 A 12 LEU HDx% A 38 GLY HAy 1.0 1.636 2.952 270 254 A 12 LEU HDy% A 38 GLY HAy 1.0 1.636 2.952 271 255 A 38 GLY HAy A 38 GLY HAx 1.0 1.590 2.788 272 256 A 12 LEU HDx% A 38 GLY HAx 1.0 1.678 3.110 273 256 A 12 LEU HDy% A 38 GLY HAx 1.0 1.678 3.110 274 257 A 39 LYS HA A 39 LYS HBy 1.0 1.623 2.903 275 258 A 39 LYS HA A 39 LYS H 1.0 1.679 3.115 276 259 A 39 LYS HBy A 39 LYS HGx 1.0 1.742 3.386 277 260 A 39 LYS HA A 39 LYS HBx 1.0 1.756 3.452 278 261 A 39 LYS HDx A 39 LYS HGx 1.0 1.542 2.628 279 262 A 39 LYS HEx A 39 LYS HGx 1.0 1.420 2.274 280 263 A 39 LYS HEx A 39 LYS H 1.0 1.870 4.086 281 264 A 39 LYS HEx A 41 LEU HBx 1.0 1.702 3.212 282 265 A 41 LEU HDx% A 39 LYS HEx 1.0 1.503 2.511 283 266 A 39 LYS HEx A 41 LEU HDy% 1.0 1.735 3.349 284 267 A 40 VAL HA A 40 VAL HB 1.0 1.666 3.066 285 268 A 40 VAL HA A 40 VAL HGy% 1.0 1.583 2.763 286 269 A 40 VAL HB A 40 VAL HGy% 1.0 1.470 2.410 287 270 A 41 LEU HBx A 41 LEU HA 1.0 1.600 2.824 288 271 A 41 LEU HDx% A 39 LYS HDx 1.0 1.592 2.796 289 272 A 41 LEU HDx% A 41 LEU HA 1.0 1.503 2.511 290 273 A 41 LEU HDy% A 41 LEU HBx 1.0 1.412 2.250 291 274 A 41 LEU HDy% A 169 TYR HBy 1.0 1.660 3.040 292 275 A 41 LEU HDy% A 169 TYR HBx 1.0 1.724 3.306 293 276 A 41 LEU HA A 41 LEU HG 1.0 1.814 3.748 294 277 A 41 LEU HBx A 41 LEU HG 1.0 1.632 2.934 295 278 A 41 LEU HDx% A 41 LEU HG 1.0 1.621 2.897 296 279 A 41 LEU HDy% A 41 LEU HG 1.0 1.719 3.281 297 280 A 42 THR HA A 43 PRO HDy 1.0 1.712 3.250 298 281 A 42 THR HA A 43 PRO HDx 1.0 1.737 3.361 299 282 A 42 THR HA A 42 THR HB 1.0 1.699 3.199 300 283 A 43 PRO HDy A 42 THR HB 1.0 1.802 3.680 301 284 A 43 PRO HDx A 42 THR HB 1.0 1.765 3.493 302 285 A 42 THR HB A 174 ASP HBx 1.0 1.844 3.924 303 286 A 42 THR HA A 42 THR HG2% 1.0 1.451 2.357 304 287 A 42 THR HB A 42 THR HG2% 1.0 1.388 2.188 305 288 A 43 PRO HDx A 42 THR HG2% 1.0 1.589 2.783 306 289 A 174 ASP HBx A 42 THR HG2% 1.0 1.694 3.178 307 290 A 43 PRO HA A 43 PRO HBx 1.0 1.752 3.430 308 291 A 43 PRO HA A 109 SER HBx 1.0 1.759 3.463 309 292 A 44 THR HA A 44 THR HB 1.0 1.563 2.695 310 293 A 44 THR HB A 44 THR HG1 1.0 1.895 4.269 311 294 A 44 THR HB A 44 THR HG2% 1.0 1.497 2.489 312 295 A 44 THR HB A 45 GLN HGy 1.0 1.865 4.057 313 296 A 44 THR HA A 44 THR HG2% 1.0 1.443 2.335 314 297 A 45 GLN HA A 45 GLN HBx 1.0 1.613 2.867 315 298 A 45 GLN HA A 45 GLN H 1.0 1.712 3.254 316 299 A 45 GLN HBx A 45 GLN HBy 1.0 1.726 3.312 317 300 A 45 GLN HGy A 45 GLN HBx 1.0 1.690 3.160 318 301 A 45 GLN HBx A 46 VAL HGx% 1.0 1.881 4.169 319 302 A 45 GLN HGy A 45 GLN HA 1.0 1.722 3.294 320 303 A 45 GLN HA A 45 GLN HGx 1.0 1.744 3.394 321 304 A 45 GLN HBx A 45 GLN HGx 1.0 1.732 3.342 322 305 A 45 GLN H A 45 GLN HGx 1.0 1.833 3.853 323 306 A 46 VAL HA A 46 VAL HB 1.0 1.612 2.866 324 307 A 46 VAL HA A 46 VAL H 1.0 1.745 3.397 325 308 A 46 VAL HB A 46 VAL HGy% 1.0 1.669 3.077 326 309 A 41 LEU HG A 46 VAL HGx% 1.0 1.761 3.471 327 310 A 45 GLN HBy A 46 VAL HGx% 1.0 1.736 3.356 328 311 A 46 VAL HGx% A 46 VAL HA 1.0 1.572 2.728 329 312 A 46 VAL HGx% A 46 VAL HB 1.0 1.537 2.611 330 313 A 46 VAL HGx% A 46 VAL H 1.0 1.607 2.845 331 314 A 43 PRO HA A 46 VAL HGy% 1.0 1.550 2.654 332 315 A 46 VAL H A 46 VAL HGy% 1.0 1.525 2.577 333 316 A 46 VAL HGy% A 109 SER HBy 1.0 1.689 3.155 334 317 A 109 SER HBx A 46 VAL HGy% 1.0 1.655 3.021 335 318 A 47 LYS HA A 47 LYS HBy 1.0 1.606 2.844 336 319 A 47 LYS HA A 108 GLY HAx 1.0 1.754 3.442 337 320 A 47 LYS HBx A 47 LYS HBy 1.0 1.570 2.720 338 321 A 47 LYS HBx A 44 THR HA 1.0 1.882 4.178 339 322 A 44 THR HA A 47 LYS HDx 1.0 1.821 3.785 340 323 A 47 LYS HA A 47 LYS HDx 1.0 1.766 3.496 341 324 A 47 LYS HA A 47 LYS HEy 1.0 1.825 3.811 342 325 A 47 LYS HDx A 47 LYS HEy 1.0 1.472 2.416 343 326 A 47 LYS HEy A 47 LYS HEx 1.0 1.231 1.807 344 327 A 109 SER HBy A 47 LYS HEy 1.0 1.691 3.163 345 328 A 47 LYS HA A 47 LYS HEx 1.0 1.807 3.707 346 329 A 47 LYS HBx A 47 LYS HEx 1.0 1.487 2.461 347 330 A 47 LYS HDx A 47 LYS HEx 1.0 1.468 2.406 348 331 A 109 SER HBy A 47 LYS HEx 1.0 1.715 3.267 349 332 A 48 ASN HA A 48 ASN HBy 1.0 1.582 2.758 350 333 A 48 ASN HA A 48 ASN HBx 1.0 1.607 2.849 351 334 A 48 ASN HBy A 48 ASN HBx 1.0 1.468 2.408 352 335 A 49 ARG HA A 49 ARG HBy 1.0 1.700 3.200 353 336 A 49 ARG HA A 49 ARG HGy 1.0 1.674 3.094 354 337 A 49 ARG HA A 49 ARG HGx 1.0 1.740 3.376 355 338 A 49 ARG HA A 50 PRO HDy 1.0 1.717 3.273 356 339 A 49 ARG HA A 50 PRO HDx 1.0 1.685 3.141 357 340 A 49 ARG HDy A 49 ARG HBx 1.0 1.623 2.905 358 341 A 49 ARG HGy A 49 ARG HDy 1.0 1.647 2.993 359 342 A 49 ARG HGx A 49 ARG HDy 1.0 1.684 3.136 360 343 A 49 ARG HGy A 49 ARG HDx 1.0 1.677 3.109 361 344 A 49 ARG HGx A 49 ARG HDx 1.0 1.714 3.260 362 345 A 49 ARG HGy A 49 ARG HGx 1.0 1.586 2.776 363 346 A 29 TYR HA A 50 PRO HA 1.0 1.606 2.844 364 347 A 29 TYR HBx A 50 PRO HA 1.0 1.817 3.763 365 348 A 50 PRO HA A 50 PRO HBy 1.0 1.574 2.736 366 349 A 29 TYR HA A 50 PRO HBy 1.0 1.835 3.863 367 350 A 29 TYR HA A 50 PRO HBx 1.0 1.815 3.751 368 351 A 50 PRO HA A 50 PRO HBx 1.0 1.687 3.145 369 352 A 50 PRO HDy A 50 PRO HDx 1.0 1.723 3.301 370 353 A 50 PRO HDx A 50 PRO HGx 1.0 1.636 2.952 371 354 A 50 PRO HDx A 97 ILE HD1% 1.0 1.745 3.401 372 355 A 50 PRO HDx A 97 ILE HG2% 1.0 1.725 3.309 373 356 A 27 VAL HGx% A 50 PRO HGx 1.0 1.600 2.824 374 356 A 27 VAL HGy% A 50 PRO HGx 1.0 1.600 2.824 375 357 A 50 PRO HDy A 50 PRO HGx 1.0 1.698 3.196 376 358 A 29 TYR HA A 51 THR HB 1.0 1.850 3.956 377 359 A 51 THR HG2% A 51 THR HB 1.0 1.413 2.251 378 360 A 29 TYR HA A 51 THR HG2% 1.0 1.609 2.853 379 361 A 51 THR HG2% A 52 SER HBx 1.0 1.768 3.508 380 362 A 97 ILE HD1% A 52 SER HA 1.0 1.773 3.533 381 363 A 53 ILE HA A 53 ILE HB 1.0 1.675 3.097 382 364 A 53 ILE HA A 53 ILE HD1% 1.0 1.765 3.493 383 365 A 53 ILE HA A 53 ILE HG1x 1.0 1.808 3.712 384 366 A 53 ILE HA A 54 SER H 1.0 1.597 2.811 385 367 A 27 VAL HGy% A 53 ILE HB 1.0 1.701 3.207 386 367 A 27 VAL HGx% A 53 ILE HB 1.0 1.701 3.207 387 368 A 53 ILE HD1% A 53 ILE HG1x 1.0 1.377 2.159 388 369 A 53 ILE HD1% A 95 ASN HA 1.0 1.736 3.358 389 370 A 53 ILE HD1% A 95 ASN HBy 1.0 1.757 3.453 390 371 A 53 ILE HG2% A 53 ILE HG1y 1.0 1.830 3.834 391 372 A 53 ILE HG1x A 53 ILE HG1y 1.0 1.592 2.794 392 373 A 27 VAL HGx% A 53 ILE HG2% 1.0 1.383 2.175 393 373 A 27 VAL HGy% A 53 ILE HG2% 1.0 1.383 2.175 394 374 A 53 ILE HG2% A 50 PRO HGx 1.0 1.552 2.660 395 375 A 53 ILE HG2% A 52 SER HA 1.0 1.775 3.543 396 376 A 53 ILE HA A 53 ILE HG2% 1.0 1.545 2.641 397 377 A 54 SER HA A 58 LEU HDy% 1.0 1.772 3.526 398 378 A 54 SER HA A 54 SER HBx 1.0 1.471 2.415 399 379 A 54 SER HBx A 58 LEU HBy 1.0 1.850 3.960 400 380 A 54 SER HBx A 58 LEU HDx% 1.0 1.614 2.870 401 381 A 58 LEU HDy% A 54 SER HBx 1.0 1.821 3.785 402 382 A 54 SER HBx A 95 ASN HBx 1.0 1.895 4.273 403 383 A 55 TRP HA A 25 LEU HDx% 1.0 1.711 3.249 404 384 A 55 TRP HA A 55 TRP HBx 1.0 1.626 2.916 405 385 A 25 LEU HDx% A 55 TRP HBy 1.0 1.843 3.917 406 386 A 55 TRP HA A 55 TRP HBy 1.0 1.769 3.509 407 387 A 55 TRP HBy A 55 TRP HD1 1.0 1.887 4.213 408 388 A 55 TRP HBy A 55 TRP HBx 1.0 1.758 3.460 409 389 A 55 TRP HBx A 55 TRP HD1 1.0 1.849 3.955 410 390 A 56 ASP HA A 56 ASP HBx 1.0 1.491 2.473 411 391 A 56 ASP HBx A 56 ASP HBy 1.0 1.360 2.114 412 392 A 57 GLY HAy A 57 GLY HAx 1.0 1.415 2.257 413 393 A 58 LEU HBy A 58 LEU HA 1.0 1.600 2.824 414 394 A 58 LEU HA A 58 LEU HBx 1.0 1.465 2.397 415 395 A 58 LEU HA A 58 LEU HG 1.0 1.717 3.275 416 396 A 58 LEU HA A 64 TYR HEx 1.0 1.864 4.050 417 397 A 58 LEU HBy A 58 LEU HBx 1.0 1.402 2.224 418 398 A 58 LEU HBy A 58 LEU HG 1.0 1.669 3.077 419 399 A 58 LEU HDx% A 58 LEU HBx 1.0 1.608 2.852 420 400 A 58 LEU HBx A 58 LEU HG 1.0 1.720 3.286 421 401 A 54 SER HA A 58 LEU HDx% 1.0 1.584 2.768 422 402 A 58 LEU HDy% A 58 LEU HDx% 1.0 1.364 2.124 423 403 A 95 ASN HA A 58 LEU HDx% 1.0 1.708 3.236 424 404 A 95 ASN HBy A 58 LEU HDx% 1.0 1.580 2.754 425 405 A 58 LEU HDy% A 60 SER HA 1.0 1.617 2.881 426 406 A 95 ASN HA A 58 LEU HDy% 1.0 1.681 3.123 427 407 A 95 ASN HBy A 58 LEU HDy% 1.0 1.487 2.461 428 408 A 59 ASP HA A 59 ASP HBy 1.0 1.588 2.780 429 409 A 59 ASP HA A 59 ASP HBx 1.0 1.542 2.628 430 410 A 59 ASP HBy A 59 ASP HBx 1.0 1.551 2.659 431 411 A 59 ASP HBx A 62 LYS HGx 1.0 1.727 3.319 432 412 A 60 SER HA A 94 GLY HAx 1.0 1.672 3.088 433 413 A 59 ASP HBy A 61 GLY HAy 1.0 1.827 3.817 434 414 A 61 GLY HAy A 61 GLY HAx 1.0 1.426 2.286 435 415 A 62 LYS HA A 62 LYS HBy 1.0 1.637 2.953 436 416 A 62 LYS HBy A 62 LYS HBx 1.0 1.607 2.845 437 417 A 62 LYS HGx A 62 LYS HBy 1.0 1.626 2.912 438 418 A 62 LYS HA A 62 LYS HBx 1.0 1.764 3.486 439 419 A 62 LYS HBx A 62 LYS HEx 1.0 1.771 3.523 440 420 A 62 LYS HGx A 62 LYS HBx 1.0 1.644 2.982 441 421 A 62 LYS HBy A 62 LYS HEx 1.0 1.529 2.591 442 422 A 62 LYS HGy A 62 LYS HDx 1.0 1.504 2.512 443 423 A 62 LYS HGx A 62 LYS HA 1.0 1.696 3.184 444 424 A 62 LYS HGx A 62 LYS HEx 1.0 1.619 2.889 445 425 A 63 LEU HA A 63 LEU HBy 1.0 1.722 3.294 446 426 A 63 LEU HA A 63 LEU HBx 1.0 1.744 3.392 447 427 A 63 LEU HA A 63 LEU HDx% 1.0 1.624 2.904 448 427 A 63 LEU HA A 63 LEU HDy% 1.0 1.624 2.904 449 428 A 63 LEU HBy A 63 LEU HDx% 1.0 1.745 3.399 450 428 A 63 LEU HBy A 63 LEU HDy% 1.0 1.745 3.399 451 429 A 63 LEU HBy A 130 PRO HA 1.0 1.895 4.269 452 430 A 63 LEU HBy A 63 LEU HBx 1.0 1.697 3.187 453 431 A 63 LEU HBx A 63 LEU HDy% 1.0 1.713 3.259 454 431 A 63 LEU HBx A 63 LEU HDx% 1.0 1.713 3.259 455 432 A 63 LEU HBx A 130 PRO HA 1.0 1.877 4.139 456 433 A 63 LEU HDx% A 130 PRO HA 1.0 1.549 2.655 457 434 A 63 LEU HDx% A 130 PRO HBy 1.0 1.556 2.674 458 435 A 63 LEU HA A 63 LEU HDy% 1.0 1.526 2.578 459 436 A 63 LEU HBy A 63 LEU HDy% 1.0 1.408 2.240 460 437 A 63 LEU HDy% A 91 ASN HA 1.0 1.612 2.866 461 438 A 63 LEU HDy% A 91 ASN HBy 1.0 1.752 3.432 462 439 A 63 LEU HDy% A 93 LYS HEx 1.0 1.660 3.042 463 440 A 64 TYR HA A 64 TYR HBy 1.0 1.815 3.753 464 441 A 64 TYR HA A 64 TYR HBx 1.0 1.829 3.829 465 442 A 64 TYR HA A 65 THR H 1.0 1.676 3.106 466 443 A 65 THR HA A 90 VAL HB 1.0 1.803 3.685 467 444 A 65 THR HA A 90 VAL HGx% 1.0 1.657 3.029 468 445 A 65 THR HA A 65 THR HB 1.0 1.851 3.961 469 446 A 65 THR HB A 65 THR HG2% 1.0 1.644 2.982 470 447 A 65 THR H A 65 THR HB 1.0 1.735 3.355 471 448 A 65 THR HA A 65 THR HG2% 1.0 1.543 2.631 472 449 A 65 THR HG2% A 88 LEU HDy% 1.0 1.501 2.503 473 449 A 65 THR HG2% A 88 LEU HDx% 1.0 1.501 2.503 474 450 A 66 LEU HA A 66 LEU HBy 1.0 1.782 3.576 475 451 A 66 LEU HA A 67 VAL H 1.0 1.587 2.779 476 452 A 66 LEU HA A 124 VAL HA 1.0 1.788 3.608 477 453 A 124 VAL HGx% A 66 LEU HA 1.0 1.819 3.771 478 454 A 66 LEU HA A 66 LEU HBx 1.0 1.895 4.271 479 455 A 66 LEU HBy A 66 LEU HBx 1.0 1.772 3.528 480 456 A 66 LEU HDx% A 25 LEU HDy% 1.0 1.627 2.917 481 457 A 66 LEU HDx% A 66 LEU HA 1.0 1.652 3.010 482 458 A 66 LEU HDx% A 124 VAL HA 1.0 1.732 3.338 483 459 A 66 LEU HDx% A 124 VAL HGx% 1.0 1.505 2.513 484 460 A 66 LEU HG A 66 LEU HDy% 1.0 1.540 2.622 485 461 A 88 LEU HDx% A 67 VAL HA 1.0 1.705 3.223 486 461 A 88 LEU HDy% A 67 VAL HA 1.0 1.705 3.223 487 462 A 67 VAL HA A 67 VAL HB 1.0 1.803 3.687 488 463 A 67 VAL HGx% A 67 VAL HA 1.0 1.494 2.480 489 464 A 67 VAL HGx% A 87 PHE H 1.0 1.741 3.379 490 465 A 67 VAL HA A 67 VAL HGy% 1.0 1.536 2.610 491 466 A 88 LEU HDx% A 67 VAL HGy% 1.0 1.393 2.199 492 466 A 88 LEU HDy% A 67 VAL HGy% 1.0 1.393 2.199 493 467 A 68 LEU HA A 68 LEU HBy 1.0 1.726 3.310 494 468 A 68 LEU HA A 69 THR H 1.0 1.708 3.236 495 469 A 68 LEU HBx A 68 LEU HDx% 1.0 1.836 3.872 496 470 A 68 LEU HBy A 68 LEU HDx% 1.0 1.454 2.364 497 471 A 68 LEU HDx% A 86 HIS HBy 1.0 1.657 3.031 498 472 A 68 LEU HDx% A 86 HIS HBx 1.0 1.671 3.083 499 473 A 68 LEU HDx% A 120 TYR HBy 1.0 1.657 3.031 500 474 A 68 LEU HDy% A 68 LEU HA 1.0 1.669 3.077 501 475 A 68 LEU HDy% A 68 LEU HBy 1.0 1.607 2.849 502 476 A 68 LEU HDy% A 68 LEU HDx% 1.0 1.488 2.464 503 477 A 68 LEU HDy% A 86 HIS HBy 1.0 1.817 3.763 504 478 A 68 LEU HDy% A 86 HIS HBx 1.0 1.827 3.823 505 479 A 68 LEU HDy% A 120 TYR HA 1.0 1.812 3.736 506 480 A 68 LEU HDy% A 120 TYR HBy 1.0 1.661 3.045 507 481 A 68 LEU HDy% A 120 TYR HBx 1.0 1.545 2.641 508 482 A 69 THR HA A 69 THR HB 1.0 1.764 3.488 509 483 A 69 THR H A 69 THR HA 1.0 1.740 3.378 510 484 A 85 HIS HBx A 69 THR HA 1.0 1.798 3.662 511 485 A 69 THR H A 69 THR HB 1.0 1.816 3.758 512 486 A 69 THR HB A 85 HIS HA 1.0 1.723 3.301 513 487 A 85 HIS HBx A 69 THR HB 1.0 1.857 4.003 514 488 A 69 THR HG2% A 70 ASP HA 1.0 1.826 3.816 515 489 A 69 THR HG2% A 71 PRO HDx 1.0 1.770 3.516 516 490 A 69 THR HG2% A 121 VAL HB 1.0 1.550 2.654 517 491 A 70 ASP HA A 70 ASP HBx 1.0 1.864 4.054 518 492 A 71 PRO HDy A 70 ASP HA 1.0 1.795 3.643 519 493 A 70 ASP HA A 71 PRO HGx 1.0 1.782 3.576 520 494 A 70 ASP HA A 70 ASP HBy 1.0 1.878 4.142 521 495 A 70 ASP HBx A 70 ASP HBy 1.0 1.784 3.586 522 496 A 71 PRO HDx A 71 PRO HA 1.0 1.889 4.227 523 497 A 71 PRO HA A 71 PRO HGy 1.0 1.814 3.744 524 498 A 71 PRO HGx A 71 PRO HA 1.0 1.804 3.690 525 499 A 71 PRO HA A 82 ARG HGx 1.0 1.820 3.782 526 500 A 83 GLU HGx A 71 PRO HA 1.0 1.795 3.647 527 501 A 71 PRO HDy A 71 PRO HBx 1.0 1.835 3.867 528 502 A 71 PRO HDy A 71 PRO HGy 1.0 1.867 4.075 529 503 A 71 PRO HDy A 71 PRO HGx 1.0 1.789 3.615 530 504 A 70 ASP HA A 71 PRO HDx 1.0 1.818 3.768 531 505 A 71 PRO HDy A 71 PRO HDx 1.0 1.807 3.709 532 506 A 71 PRO HDx A 71 PRO HGx 1.0 1.757 3.459 533 507 A 71 PRO HGx A 71 PRO HGy 1.0 1.744 3.396 534 508 A 72 ASP HA A 72 ASP HBx 1.0 1.702 3.212 535 509 A 72 ASP HA A 73 ALA H 1.0 1.753 3.437 536 510 A 72 ASP HA A 76 ARG HA 1.0 1.785 3.595 537 511 A 72 ASP HA A 79 PRO HBy 1.0 1.772 3.526 538 512 A 72 ASP HA A 79 PRO HBx 1.0 1.715 3.265 539 513 A 73 ALA HA A 73 ALA HB% 1.0 1.502 2.504 540 514 A 73 ALA HB% A 81 TYR HBy 1.0 1.658 3.034 541 515 A 73 ALA HB% A 81 TYR HBx 1.0 1.568 2.712 542 516 A 73 ALA HA A 74 PRO HA 1.0 1.623 2.901 543 517 A 73 ALA HB% A 74 PRO HA 1.0 1.716 3.270 544 518 A 74 PRO HA A 74 PRO HBy 1.0 1.705 3.221 545 519 A 74 PRO HA A 74 PRO HBx 1.0 1.718 3.278 546 520 A 74 PRO HA A 74 PRO HGy 1.0 1.831 3.845 547 521 A 74 PRO HDy A 74 PRO HDx 1.0 1.653 3.015 548 522 A 74 PRO HDy A 74 PRO HGy 1.0 1.712 3.250 549 523 A 74 PRO HDy A 79 PRO HA 1.0 1.825 3.809 550 524 A 74 PRO HDy A 80 LYS HGx 1.0 1.857 4.007 551 525 A 74 PRO HGy A 74 PRO HDx 1.0 1.730 3.332 552 526 A 74 PRO HDx A 74 PRO HGx 1.0 1.726 3.312 553 527 A 74 PRO HBy A 74 PRO HGy 1.0 1.733 3.343 554 528 A 74 PRO HBx A 74 PRO HGy 1.0 1.702 3.212 555 529 A 74 PRO HBy A 74 PRO HGx 1.0 1.732 3.340 556 530 A 74 PRO HBx A 74 PRO HGx 1.0 1.709 3.239 557 531 A 74 PRO HDy A 74 PRO HGx 1.0 1.749 3.417 558 532 A 74 PRO HGy A 74 PRO HGx 1.0 1.568 2.714 559 533 A 75 SER HA A 75 SER HBx 1.0 1.620 2.890 560 534 A 75 SER HA A 115 THR HB 1.0 1.660 3.040 561 535 A 75 SER HA A 115 THR HG2% 1.0 1.699 3.199 562 536 A 74 PRO HBx A 75 SER HBy 1.0 1.890 4.228 563 537 A 75 SER HBy A 77 LYS HDx 1.0 1.853 3.977 564 538 A 75 SER HBy A 115 THR HA 1.0 1.736 3.358 565 539 A 115 THR HB A 75 SER HBy 1.0 1.644 2.980 566 540 A 75 SER HBx A 75 SER HBy 1.0 1.505 2.515 567 541 A 75 SER HBx A 77 LYS HDx 1.0 1.881 4.169 568 542 A 75 SER HBx A 115 THR HB 1.0 1.649 2.997 569 543 A 76 ARG HA A 76 ARG HGx 1.0 1.624 2.906 570 544 A 76 ARG HGx A 76 ARG HDy 1.0 1.675 3.101 571 545 A 76 ARG HGx A 76 ARG HDx 1.0 1.694 3.176 572 546 A 77 LYS HA A 77 LYS HEx 1.0 1.813 3.739 573 547 A 77 LYS HA A 77 LYS HBx 1.0 1.450 2.356 574 548 A 77 LYS HEx A 77 LYS HBx 1.0 1.752 3.428 575 549 A 78 ASP HA A 78 ASP HBx 1.0 1.610 2.858 576 550 A 78 ASP HA A 79 PRO HDx 1.0 1.637 2.953 577 551 A 78 ASP HA A 79 PRO HDy 1.0 1.632 2.938 578 552 A 78 ASP HBy A 77 LYS HGx 1.0 1.788 3.610 579 553 A 78 ASP HA A 78 ASP HBy 1.0 1.638 2.956 580 554 A 78 ASP HBx A 78 ASP HBy 1.0 1.403 2.227 581 555 A 78 ASP HBx A 77 LYS HGx 1.0 1.782 3.576 582 556 A 74 PRO HDx A 79 PRO HA 1.0 1.791 3.625 583 557 A 79 PRO HBy A 79 PRO HA 1.0 1.658 3.036 584 558 A 79 PRO HBx A 79 PRO HA 1.0 1.603 2.833 585 559 A 79 PRO HA A 79 PRO HDx 1.0 1.829 3.829 586 560 A 79 PRO HBy A 79 PRO HBx 1.0 1.754 3.440 587 561 A 79 PRO HDx A 79 PRO HDy 1.0 1.659 3.041 588 562 A 79 PRO HDx A 79 PRO HGy 1.0 1.768 3.510 589 563 A 79 PRO HDy A 79 PRO HGy 1.0 1.746 3.400 590 564 A 79 PRO HA A 80 LYS HA 1.0 1.894 4.258 591 565 A 80 LYS HBy A 80 LYS HA 1.0 1.464 2.396 592 566 A 80 LYS HGx A 80 LYS HA 1.0 1.694 3.178 593 567 A 80 LYS HA A 148 LYS HEx 1.0 1.848 3.946 594 568 A 80 LYS HBy A 80 LYS HGy 1.0 1.660 3.042 595 569 A 80 LYS HBy A 148 LYS HZ% 1.0 1.868 4.078 596 570 A 80 LYS HBx A 74 PRO HDx 1.0 1.830 3.834 597 571 A 80 LYS HBx A 80 LYS HA 1.0 1.591 2.793 598 572 A 80 LYS HBy A 80 LYS HBx 1.0 1.383 2.173 599 573 A 80 LYS HBx A 80 LYS HEx 1.0 1.831 3.839 600 574 A 80 LYS HBx A 80 LYS HGy 1.0 1.662 3.052 601 575 A 80 LYS HBx A 80 LYS HGx 1.0 1.687 3.147 602 576 A 80 LYS HBx A 148 LYS HZ% 1.0 1.858 4.010 603 577 A 80 LYS HEx A 80 LYS HDx 1.0 1.482 2.444 604 578 A 80 LYS HGx A 80 LYS HDx 1.0 1.613 2.869 605 579 A 148 LYS HZ% A 80 LYS HDx 1.0 1.789 3.615 606 580 A 74 PRO HDy A 80 LYS HEx 1.0 1.778 3.556 607 581 A 74 PRO HGy A 80 LYS HEx 1.0 1.676 3.102 608 582 A 74 PRO HGx A 80 LYS HEx 1.0 1.653 3.015 609 583 A 80 LYS HGy A 80 LYS HEx 1.0 1.460 2.384 610 584 A 74 PRO HDy A 80 LYS HGy 1.0 1.762 3.478 611 585 A 74 PRO HDx A 80 LYS HGy 1.0 1.777 3.551 612 586 A 80 LYS HA A 80 LYS HGy 1.0 1.705 3.219 613 587 A 74 PRO HDx A 80 LYS HGx 1.0 1.799 3.669 614 588 A 80 LYS HBy A 80 LYS HGx 1.0 1.508 2.524 615 589 A 80 LYS HGx A 80 LYS HGy 1.0 1.362 2.122 616 590 A 81 TYR HBy A 81 TYR HA 1.0 1.703 3.217 617 591 A 81 TYR HBx A 81 TYR HA 1.0 1.724 3.306 618 592 A 81 TYR HA A 148 LYS HBx 1.0 1.805 3.695 619 593 A 81 TYR HA A 148 LYS HDx 1.0 1.736 3.354 620 594 A 148 LYS HEx A 81 TYR HA 1.0 1.779 3.565 621 595 A 81 TYR HBy A 81 TYR HBx 1.0 1.675 3.101 622 596 A 82 ARG HA A 82 ARG HBy 1.0 1.827 3.821 623 597 A 82 ARG HA A 82 ARG HBx 1.0 1.772 3.524 624 598 A 82 ARG HBy A 82 ARG HDy 1.0 1.811 3.731 625 599 A 82 ARG HDy A 82 ARG HGy 1.0 1.720 3.284 626 600 A 82 ARG HGx A 82 ARG HDy 1.0 1.812 3.736 627 601 A 84 TRP HA A 84 TRP HBy 1.0 1.823 3.799 628 602 A 84 TRP HA A 84 TRP HBx 1.0 1.826 3.816 629 603 A 84 TRP HA A 84 TRP HD1 1.0 1.843 3.917 630 604 A 84 TRP HBy A 84 TRP HBx 1.0 1.797 3.659 631 605 A 84 TRP HBx A 84 TRP HD1 1.0 1.882 4.174 632 606 A 85 HIS HBx A 85 HIS HA 1.0 1.757 3.451 633 607 A 87 PHE H A 86 HIS HA 1.0 1.831 3.843 634 608 A 86 HIS HBy A 86 HIS HBx 1.0 1.826 3.816 635 609 A 86 HIS HBx A 86 HIS HA 1.0 1.740 3.372 636 610 A 87 PHE HA A 87 PHE HBy 1.0 1.820 3.780 637 611 A 87 PHE HA A 87 PHE HBx 1.0 1.846 3.938 638 612 A 87 PHE HA A 88 LEU H 1.0 1.743 3.393 639 613 A 67 VAL HGy% A 88 LEU HA 1.0 1.659 3.039 640 614 A 88 LEU HDy% A 88 LEU HA 1.0 1.670 3.080 641 614 A 88 LEU HDx% A 88 LEU HA 1.0 1.670 3.080 642 615 A 88 LEU HA A 88 LEU HBy 1.0 1.868 4.076 643 616 A 88 LEU HDy% A 88 LEU HBy 1.0 1.749 3.415 644 616 A 88 LEU HDx% A 88 LEU HBy 1.0 1.749 3.415 645 617 A 88 LEU HBy A 103 LEU HDx% 1.0 1.851 3.961 646 618 A 88 LEU HA A 88 LEU HBx 1.0 1.859 4.019 647 619 A 88 LEU HBy A 88 LEU HBx 1.0 1.796 3.646 648 620 A 88 LEU HDy% A 88 LEU HBx 1.0 1.731 3.337 649 620 A 88 LEU HDx% A 88 LEU HBx 1.0 1.731 3.337 650 621 A 88 LEU HDx% A 67 VAL HGy% 1.0 1.364 2.124 651 622 A 88 LEU HDx% A 88 LEU HA 1.0 1.558 2.682 652 623 A 88 LEU HDy% A 88 LEU HBy 1.0 1.592 2.794 653 624 A 88 LEU HDy% A 88 LEU HG 1.0 1.484 2.450 654 625 A 88 LEU HDy% A 103 LEU HBx 1.0 1.640 2.966 655 626 A 88 LEU HDy% A 103 LEU HDx% 1.0 1.499 2.497 656 627 A 88 LEU HDy% A 104 SER HBy 1.0 1.805 3.699 657 628 A 88 LEU HDy% A 104 SER HBx 1.0 1.842 3.908 658 629 A 88 LEU HDy% A 135 GLU HGy 1.0 1.851 3.967 659 630 A 88 LEU HBy A 88 LEU HG 1.0 1.528 2.586 660 631 A 88 LEU HDx% A 88 LEU HG 1.0 1.602 2.830 661 631 A 88 LEU HDy% A 88 LEU HG 1.0 1.602 2.830 662 632 A 89 VAL HA A 89 VAL HB 1.0 1.794 3.636 663 633 A 89 VAL HB A 89 VAL HGy% 1.0 1.699 3.195 664 634 A 89 VAL HA A 89 VAL HGx% 1.0 1.570 2.722 665 635 A 89 VAL HGy% A 89 VAL HGx% 1.0 1.409 2.241 666 636 A 89 VAL HGx% A 90 VAL H 1.0 1.537 2.613 667 637 A 89 VAL HGx% A 92 MET HBy 1.0 1.666 3.064 668 638 A 89 VAL HGx% A 100 GLY HAy 1.0 1.604 2.834 669 639 A 89 VAL HGx% A 100 GLY HAx 1.0 1.565 2.703 670 640 A 89 VAL HA A 89 VAL HGy% 1.0 1.561 2.689 671 641 A 89 VAL HGy% A 102 VAL HA 1.0 1.563 2.695 672 642 A 90 VAL H A 90 VAL HA 1.0 1.830 3.836 673 643 A 90 VAL HA A 131 LEU HDy% 1.0 1.850 3.960 674 644 A 90 VAL HB A 90 VAL HA 1.0 1.733 3.345 675 645 A 90 VAL HGx% A 90 VAL HA 1.0 1.543 2.631 676 646 A 90 VAL HB A 90 VAL HGx% 1.0 1.488 2.462 677 647 A 90 VAL HB A 90 VAL HGy% 1.0 1.537 2.615 678 648 A 91 ASN HBy A 90 VAL HGy% 1.0 1.771 3.521 679 649 A 90 VAL HGy% A 91 ASN HBx 1.0 1.820 3.778 680 650 A 90 VAL HGy% A 101 THR HB 1.0 1.509 2.527 681 651 A 63 LEU HA A 91 ASN HA 1.0 1.854 3.980 682 652 A 63 LEU HBx A 91 ASN HA 1.0 1.758 3.458 683 653 A 63 LEU HDx% A 91 ASN HA 1.0 1.709 3.243 684 653 A 63 LEU HDy% A 91 ASN HA 1.0 1.709 3.243 685 654 A 91 ASN HA A 91 ASN HBx 1.0 1.817 3.759 686 655 A 63 LEU HDx% A 91 ASN HBy 1.0 1.813 3.737 687 655 A 63 LEU HDy% A 91 ASN HBy 1.0 1.813 3.737 688 656 A 91 ASN HA A 91 ASN HBy 1.0 1.782 3.580 689 657 A 63 LEU HDy% A 91 ASN HBx 1.0 1.794 3.638 690 657 A 63 LEU HDx% A 91 ASN HBx 1.0 1.794 3.638 691 658 A 91 ASN HBy A 91 ASN HBx 1.0 1.635 2.947 692 659 A 92 MET HBy A 92 MET HA 1.0 1.746 3.406 693 660 A 92 MET HA A 92 MET HBx 1.0 1.742 3.382 694 661 A 92 MET HA A 92 MET HE% 1.0 1.698 3.194 695 662 A 92 MET HA A 92 MET HGx 1.0 1.752 3.432 696 663 A 100 GLY HAx A 92 MET HA 1.0 1.767 3.501 697 664 A 92 MET HBy A 92 MET HE% 1.0 1.700 3.202 698 665 A 89 VAL HGx% A 92 MET HBx 1.0 1.742 3.384 699 666 A 92 MET HBy A 92 MET HBx 1.0 1.664 3.056 700 667 A 92 MET HBx A 92 MET HE% 1.0 1.712 3.248 701 668 A 92 MET HBx A 92 MET HGx 1.0 1.697 3.193 702 669 A 92 MET HGx A 92 MET HGy 1.0 1.525 2.577 703 670 A 63 LEU HA A 93 LYS HA 1.0 1.773 3.531 704 671 A 63 LEU HDx% A 93 LYS HA 1.0 1.613 2.869 705 671 A 63 LEU HDy% A 93 LYS HA 1.0 1.613 2.869 706 672 A 93 LYS HA A 93 LYS HBy 1.0 1.621 2.897 707 673 A 93 LYS HA A 93 LYS H 1.0 1.790 3.616 708 674 A 93 LYS HEx A 93 LYS HBy 1.0 1.755 3.445 709 675 A 93 LYS HEx A 93 LYS HBx 1.0 1.771 3.519 710 676 A 63 LEU HDx% A 93 LYS HEx 1.0 1.576 2.742 711 676 A 63 LEU HDy% A 93 LYS HEx 1.0 1.576 2.742 712 677 A 63 LEU HDx% A 93 LYS HGy 1.0 1.542 2.632 713 677 A 63 LEU HDy% A 93 LYS HGy 1.0 1.542 2.632 714 678 A 58 LEU HDy% A 94 GLY HAy 1.0 1.746 3.406 715 679 A 60 SER HA A 94 GLY HAy 1.0 1.721 3.289 716 680 A 94 GLY HAx A 94 GLY HAy 1.0 1.666 3.064 717 681 A 58 LEU HDy% A 94 GLY HAx 1.0 1.782 3.576 718 682 A 95 ASN HA A 53 ILE HG1y 1.0 1.800 3.672 719 683 A 53 ILE HG1x A 95 ASN HA 1.0 1.766 3.500 720 684 A 95 ASN HA A 95 ASN HBy 1.0 1.651 3.007 721 685 A 95 ASN HA A 95 ASN HBx 1.0 1.668 3.072 722 686 A 95 ASN HA A 96 ASP H 1.0 1.848 3.952 723 687 A 53 ILE HG1x A 95 ASN HBy 1.0 1.803 3.687 724 688 A 53 ILE HD1% A 95 ASN HBx 1.0 1.816 3.752 725 689 A 53 ILE HG1x A 95 ASN HBx 1.0 1.818 3.770 726 690 A 58 LEU HDx% A 95 ASN HBx 1.0 1.762 3.478 727 691 A 58 LEU HDy% A 95 ASN HBx 1.0 1.790 3.616 728 692 A 95 ASN HBy A 95 ASN HBx 1.0 1.689 3.153 729 693 A 96 ASP HA A 96 ASP HBy 1.0 1.621 2.895 730 694 A 96 ASP HA A 96 ASP HBx 1.0 1.585 2.771 731 695 A 96 ASP HA A 97 ILE HG1x 1.0 1.794 3.640 732 696 A 96 ASP HBy A 96 ASP HBx 1.0 1.601 2.825 733 697 A 97 ILE HA A 97 ILE HB 1.0 1.608 2.850 734 698 A 97 ILE HD1% A 97 ILE HA 1.0 1.663 3.053 735 699 A 97 ILE HG2% A 97 ILE HA 1.0 1.508 2.522 736 700 A 50 PRO HGx A 97 ILE HD1% 1.0 1.627 2.919 737 701 A 97 ILE HD1% A 97 ILE HG2% 1.0 1.312 1.996 738 702 A 97 ILE HD1% A 97 ILE HG1y 1.0 1.610 2.858 739 703 A 97 ILE HG1x A 97 ILE HG1y 1.0 1.538 2.616 740 704 A 97 ILE HG1x A 97 ILE HA 1.0 1.806 3.702 741 705 A 97 ILE HD1% A 97 ILE HG1x 1.0 1.674 3.096 742 706 A 49 ARG HDy A 97 ILE HG2% 1.0 1.764 3.488 743 707 A 50 PRO HGx A 97 ILE HG2% 1.0 1.649 2.999 744 708 A 97 ILE HG2% A 97 ILE HG1y 1.0 1.627 2.919 745 709 A 99 SER HA A 99 SER HBy 1.0 1.480 2.440 746 710 A 99 SER HA A 99 SER HBx 1.0 1.624 2.906 747 711 A 89 VAL HGy% A 100 GLY HAy 1.0 1.848 3.952 748 712 A 92 MET HBy A 100 GLY HAy 1.0 1.872 4.104 749 713 A 100 GLY HAy A 92 MET HBx 1.0 1.878 4.148 750 714 A 100 GLY HAy A 92 MET HE% 1.0 1.643 2.975 751 715 A 100 GLY HAy A 100 GLY HAx 1.0 1.594 2.802 752 716 A 89 VAL HGy% A 100 GLY HAx 1.0 1.826 3.814 753 717 A 92 MET HBy A 100 GLY HAx 1.0 1.891 4.245 754 718 A 100 GLY HAx A 92 MET HBx 1.0 1.854 3.982 755 719 A 100 GLY HAx A 92 MET HE% 1.0 1.646 2.990 756 720 A 91 ASN HBy A 101 THR HB 1.0 1.862 4.034 757 721 A 91 ASN HBx A 101 THR HB 1.0 1.898 4.298 758 722 A 101 THR HB A 101 THR HA 1.0 1.713 3.259 759 723 A 101 THR HB A 101 THR HG2% 1.0 1.483 2.451 760 724 A 89 VAL HA A 102 VAL HA 1.0 1.719 3.281 761 725 A 102 VAL HA A 102 VAL HB 1.0 1.749 3.415 762 726 A 102 VAL HB A 102 VAL HGx% 1.0 1.480 2.440 763 727 A 102 VAL HB A 102 VAL HGy% 1.0 1.501 2.505 764 728 A 102 VAL HGy% A 105 ASP HA 1.0 1.428 2.292 765 729 A 103 LEU HA A 103 LEU HBy 1.0 1.708 3.234 766 730 A 103 LEU HBx A 103 LEU HA 1.0 1.688 3.154 767 731 A 88 LEU HDx% A 103 LEU HBx 1.0 1.822 3.790 768 731 A 88 LEU HDy% A 103 LEU HBx 1.0 1.822 3.790 769 732 A 88 LEU HDx% A 103 LEU HDx% 1.0 1.559 2.685 770 732 A 88 LEU HDy% A 103 LEU HDx% 1.0 1.559 2.685 771 733 A 103 LEU HDx% A 103 LEU HBy 1.0 1.592 2.796 772 734 A 103 LEU HDx% A 103 LEU HBx 1.0 1.604 2.836 773 735 A 103 LEU HDx% A 103 LEU HDy% 1.0 1.464 2.396 774 736 A 103 LEU HDx% A 133 CYS HBy 1.0 1.711 3.245 775 737 A 103 LEU HDx% A 135 GLU HBx 1.0 1.628 2.922 776 738 A 103 LEU HDy% A 133 CYS HBx 1.0 1.641 2.971 777 739 A 103 LEU HDy% A 135 GLU HBx 1.0 1.600 2.824 778 740 A 104 SER HBy A 104 SER HA 1.0 1.804 3.696 779 741 A 104 SER HBx A 104 SER HA 1.0 1.760 3.468 780 742 A 104 SER HA A 138 LEU HBx 1.0 1.646 2.990 781 743 A 104 SER HBy A 104 SER HBx 1.0 1.731 3.335 782 744 A 88 LEU HBy A 104 SER HBx 1.0 1.806 3.704 783 745 A 88 LEU HBx A 104 SER HBx 1.0 1.869 4.083 784 746 A 88 LEU HDx% A 104 SER HBx 1.0 1.892 4.246 785 746 A 88 LEU HDy% A 104 SER HBx 1.0 1.892 4.246 786 747 A 138 LEU HDx% A 104 SER HBx 1.0 1.849 3.951 787 748 A 105 ASP HA A 105 ASP HBx 1.0 1.719 3.283 788 749 A 105 ASP HA A 105 ASP HBy 1.0 1.657 3.029 789 750 A 105 ASP HBx A 105 ASP HBy 1.0 1.549 2.653 790 751 A 105 ASP HBy A 140 ASN HBx 1.0 1.783 3.583 791 752 A 87 PHE HA A 106 TYR HA 1.0 1.855 3.991 792 753 A 87 PHE HBy A 106 TYR HA 1.0 1.826 3.818 793 754 A 87 PHE HBx A 106 TYR HA 1.0 1.847 3.943 794 755 A 106 TYR HA A 106 TYR HBy 1.0 1.813 3.737 795 756 A 106 TYR HA A 106 TYR HBx 1.0 1.732 3.342 796 757 A 49 ARG HGy A 106 TYR HBy 1.0 1.855 3.991 797 758 A 49 ARG HGx A 106 TYR HBy 1.0 1.851 3.963 798 759 A 106 TYR HBy A 106 TYR HBx 1.0 1.732 3.342 799 760 A 107 VAL HA A 140 ASN HD2y 1.0 1.783 3.583 800 761 A 107 VAL HA A 107 VAL HB 1.0 1.710 3.240 801 762 A 107 VAL HGx% A 107 VAL HB 1.0 1.582 2.762 802 763 A 107 VAL HGx% A 107 VAL HA 1.0 1.484 2.454 803 764 A 107 VAL HGx% A 140 ASN HD2y 1.0 1.727 3.317 804 765 A 107 VAL HGx% A 184 LEU HDx% 1.0 1.370 2.138 805 765 A 107 VAL HGx% A 184 LEU HDy% 1.0 1.370 2.138 806 766 A 107 VAL HA A 107 VAL HGy% 1.0 1.493 2.479 807 767 A 107 VAL HGy% A 140 ASN HA 1.0 1.537 2.613 808 768 A 107 VAL HGy% A 140 ASN HBy 1.0 1.574 2.734 809 769 A 140 ASN HD2y A 107 VAL HGy% 1.0 1.678 3.112 810 770 A 108 GLY HAx A 108 GLY HAy 1.0 1.528 2.588 811 771 A 109 SER HBy A 109 SER HA 1.0 1.721 3.295 812 772 A 109 SER HBx A 109 SER HA 1.0 1.738 3.370 813 773 A 109 SER HBx A 109 SER HBy 1.0 1.761 3.477 814 774 A 110 GLY HAy A 110 GLY HAx 1.0 1.714 3.260 815 775 A 180 LEU HDy% A 110 GLY HAx 1.0 1.740 3.374 816 776 A 112 PRO HA A 112 PRO HBy 1.0 1.639 2.963 817 777 A 112 PRO HA A 112 PRO HBx 1.0 1.652 3.014 818 778 A 112 PRO HA A 112 PRO HGy 1.0 1.676 3.104 819 779 A 112 PRO HBy A 112 PRO HDy 1.0 1.858 4.010 820 780 A 112 PRO HDy A 112 PRO HDx 1.0 1.681 3.125 821 781 A 112 PRO HGy A 112 PRO HDy 1.0 1.761 3.475 822 782 A 112 PRO HBy A 112 PRO HDx 1.0 1.850 3.964 823 783 A 112 PRO HGy A 112 PRO HDx 1.0 1.742 3.384 824 784 A 113 LYS HA A 113 LYS HBx 1.0 1.689 3.155 825 785 A 113 LYS HA A 113 LYS HGx 1.0 1.653 3.013 826 786 A 113 LYS HA A 173 TRP HBx 1.0 1.657 3.031 827 787 A 113 LYS HA A 173 TRP HD1 1.0 1.851 3.969 828 788 A 113 LYS HA A 113 LYS HBy 1.0 1.700 3.200 829 789 A 113 LYS HBx A 113 LYS HBy 1.0 1.536 2.610 830 790 A 113 LYS HBy A 113 LYS HGy 1.0 1.573 2.731 831 791 A 113 LYS HGx A 113 LYS HBy 1.0 1.584 2.768 832 792 A 113 LYS HBx A 113 LYS HEy 1.0 1.850 3.954 833 793 A 113 LYS HBx A 113 LYS HGy 1.0 1.633 2.943 834 794 A 113 LYS HBx A 113 LYS HGx 1.0 1.623 2.905 835 795 A 113 LYS HBx A 173 TRP HBx 1.0 1.881 4.167 836 796 A 113 LYS HA A 113 LYS HDy 1.0 1.789 3.613 837 797 A 113 LYS HA A 113 LYS HDx 1.0 1.771 3.523 838 798 A 113 LYS HBy A 113 LYS HDx 1.0 1.647 2.989 839 799 A 113 LYS HDy A 113 LYS HDx 1.0 1.343 2.073 840 800 A 113 LYS HA A 113 LYS HEy 1.0 1.837 3.879 841 801 A 113 LYS HBy A 113 LYS HEy 1.0 1.723 3.301 842 802 A 113 LYS HEy A 113 LYS HDx 1.0 1.485 2.457 843 803 A 113 LYS HBy A 113 LYS HEx 1.0 1.721 3.291 844 804 A 113 LYS HBx A 113 LYS HEx 1.0 1.735 3.353 845 805 A 113 LYS HDy A 113 LYS HEx 1.0 1.496 2.488 846 806 A 113 LYS HA A 113 LYS HGy 1.0 1.744 3.396 847 807 A 113 LYS HGy A 113 LYS HEx 1.0 1.672 3.088 848 808 A 113 LYS HGx A 113 LYS HGy 1.0 1.437 2.321 849 809 A 113 LYS HGx A 113 LYS HEx 1.0 1.705 3.221 850 810 A 113 LYS HGx A 173 TRP HBx 1.0 1.834 3.864 851 811 A 114 GLY HAy A 114 GLY HAx 1.0 1.495 2.487 852 812 A 75 SER HBx A 115 THR HA 1.0 1.714 3.258 853 813 A 115 THR HB A 115 THR HA 1.0 1.545 2.637 854 814 A 115 THR HG2% A 75 SER HBy 1.0 1.505 2.517 855 815 A 75 SER HBx A 115 THR HG2% 1.0 1.595 2.803 856 816 A 115 THR HG2% A 112 PRO HBx 1.0 1.543 2.631 857 817 A 115 THR HG2% A 115 THR HA 1.0 1.460 2.382 858 818 A 115 THR HB A 115 THR HG2% 1.0 1.413 2.251 859 819 A 116 GLY HAy A 116 GLY HAx 1.0 1.405 2.231 860 820 A 116 GLY HAy A 117 LEU HDy% 1.0 1.858 4.006 861 820 A 116 GLY HAy A 117 LEU HDx% 1.0 1.858 4.006 862 821 A 117 LEU HA A 117 LEU HBx 1.0 1.746 3.404 863 822 A 117 LEU HA A 117 LEU HBy 1.0 1.844 3.924 864 823 A 117 LEU HDy% A 117 LEU HBy 1.0 1.582 2.760 865 823 A 117 LEU HDx% A 117 LEU HBy 1.0 1.582 2.760 866 824 A 117 LEU HBx A 117 LEU HBy 1.0 1.664 3.056 867 825 A 117 LEU HDy% A 117 LEU HBx 1.0 1.612 2.866 868 825 A 117 LEU HDx% A 117 LEU HBx 1.0 1.612 2.866 869 826 A 117 LEU HDx% A 117 LEU HA 1.0 1.662 3.050 870 827 A 117 LEU HDx% A 117 LEU HBy 1.0 1.342 2.070 871 828 A 117 LEU HDx% A 171 ALA HA 1.0 1.722 3.296 872 829 A 117 LEU HDy% A 117 LEU HA 1.0 1.521 2.565 873 830 A 117 LEU HDy% A 117 LEU HG 1.0 1.498 2.494 874 830 A 117 LEU HDx% A 117 LEU HG 1.0 1.498 2.494 875 831 A 119 ARG HA A 119 ARG HBy 1.0 1.773 3.529 876 832 A 119 ARG HA A 119 ARG HBx 1.0 1.758 3.458 877 833 A 119 ARG HA A 170 GLN HBy 1.0 1.804 3.690 878 834 A 12 LEU HDx% A 119 ARG HDy 1.0 1.796 3.652 879 834 A 12 LEU HDy% A 119 ARG HDy 1.0 1.796 3.652 880 835 A 119 ARG HDy A 119 ARG HDx 1.0 1.743 3.387 881 836 A 12 LEU HDx% A 119 ARG HDx 1.0 1.824 3.802 882 836 A 12 LEU HDy% A 119 ARG HDx 1.0 1.824 3.802 883 837 A 119 ARG HDx A 119 ARG HBx 1.0 1.768 3.506 884 838 A 120 TYR HA A 70 ASP HA 1.0 1.827 3.821 885 839 A 120 TYR HBy A 120 TYR HA 1.0 1.849 3.951 886 840 A 120 TYR HA A 120 TYR HBx 1.0 1.870 4.092 887 841 A 120 TYR HBy A 120 TYR HBx 1.0 1.789 3.613 888 842 A 121 VAL HGx% A 121 VAL HA 1.0 1.737 3.365 889 843 A 168 CYS HBy A 121 VAL HA 1.0 1.830 3.838 890 844 A 121 VAL HGx% A 121 VAL HB 1.0 1.665 3.063 891 845 A 121 VAL HGy% A 121 VAL HB 1.0 1.648 2.998 892 846 A 121 VAL HGx% A 168 CYS HA 1.0 1.738 3.368 893 847 A 121 VAL HGx% A 168 CYS HBy 1.0 1.718 3.278 894 848 A 14 LEU HDy% A 121 VAL HGy% 1.0 1.508 2.522 895 849 A 121 VAL HGy% A 168 CYS HA 1.0 1.748 3.412 896 850 A 168 CYS HBy A 121 VAL HGy% 1.0 1.655 3.023 897 851 A 68 LEU HA A 122 TRP HA 1.0 1.811 3.727 898 852 A 68 LEU HDy% A 122 TRP HA 1.0 1.809 3.717 899 853 A 122 TRP HBy A 122 TRP HA 1.0 1.816 3.762 900 854 A 122 TRP HA A 122 TRP H 1.0 1.830 3.834 901 855 A 122 TRP HA A 123 LEU H 1.0 1.636 2.950 902 856 A 122 TRP HBy A 122 TRP H 1.0 1.883 4.183 903 857 A 122 TRP H A 122 TRP HBx 1.0 1.887 4.211 904 858 A 123 LEU HA A 166 GLY HAy 1.0 1.819 3.773 905 859 A 166 GLY HAx A 123 LEU HA 1.0 1.850 3.956 906 860 A 123 LEU HBy A 123 LEU HBx 1.0 1.710 3.246 907 861 A 18 ASP HBy A 123 LEU HDx% 1.0 1.751 3.425 908 862 A 67 VAL HB A 123 LEU HDx% 1.0 1.714 3.262 909 863 A 123 LEU HDy% A 123 LEU HA 1.0 1.639 2.963 910 864 A 123 LEU HDy% A 123 LEU HG 1.0 1.428 2.294 911 865 A 123 LEU HDy% A 166 GLY HAy 1.0 1.705 3.223 912 866 A 123 LEU HDy% A 166 GLY HAx 1.0 1.635 2.947 913 867 A 124 VAL HA A 124 VAL H 1.0 1.843 3.911 914 868 A 124 VAL HA A 124 VAL HB 1.0 1.884 4.188 915 869 A 124 VAL HGx% A 124 VAL HB 1.0 1.670 3.080 916 870 A 124 VAL H A 124 VAL HB 1.0 1.791 3.627 917 871 A 124 VAL HGx% A 124 VAL HA 1.0 1.638 2.960 918 872 A 124 VAL HGx% A 124 VAL H 1.0 1.646 2.986 919 873 A 124 VAL HGy% A 64 TYR HBy 1.0 1.639 2.961 920 874 A 124 VAL HGy% A 64 TYR HBx 1.0 1.683 3.135 921 875 A 124 VAL HGy% A 124 VAL HB 1.0 1.426 2.286 922 876 A 124 VAL HGy% A 125 TYR HA 1.0 1.782 3.576 923 877 A 124 VAL HGy% A 164 VAL HB 1.0 1.764 3.488 924 878 A 125 TYR HA A 125 TYR H 1.0 1.717 3.273 925 879 A 125 TYR HA A 164 VAL HGy% 1.0 1.673 3.091 926 880 A 125 TYR HA A 164 VAL H 1.0 1.723 3.301 927 881 A 64 TYR HA A 126 GLU HA 1.0 1.789 3.611 928 882 A 126 GLU HA A 126 GLU HBx 1.0 1.564 2.698 929 883 A 127 GLN HA A 127 GLN HBx 1.0 1.665 3.061 930 884 A 127 GLN HA A 127 GLN HBy 1.0 1.823 3.799 931 885 A 127 GLN HBy A 127 GLN HE2x 1.0 1.875 4.127 932 886 A 127 GLN HBx A 127 GLN HE2x 1.0 1.866 4.064 933 887 A 127 GLN HBx A 127 GLN HGx 1.0 1.647 2.993 934 888 A 128 ASP HBy A 128 ASP HA 1.0 1.559 2.685 935 889 A 128 ASP HBy A 128 ASP HBx 1.0 1.355 2.101 936 890 A 128 ASP HA A 128 ASP HBx 1.0 1.592 2.794 937 891 A 129 ARG HBy A 129 ARG HA 1.0 1.705 3.225 938 892 A 129 ARG HBy A 129 ARG HDy 1.0 1.753 3.439 939 893 A 129 ARG HBy A 130 PRO HDy 1.0 1.762 3.478 940 894 A 129 ARG HA A 129 ARG HBx 1.0 1.709 3.239 941 895 A 130 PRO HDy A 129 ARG HBx 1.0 1.744 3.396 942 896 A 129 ARG HBx A 130 PRO HDx 1.0 1.760 3.466 943 897 A 63 LEU HDy% A 130 PRO HA 1.0 1.636 2.952 944 897 A 63 LEU HDx% A 130 PRO HA 1.0 1.636 2.952 945 898 A 130 PRO HA A 130 PRO HBy 1.0 1.571 2.725 946 899 A 130 PRO HA A 130 PRO HBx 1.0 1.636 2.950 947 900 A 130 PRO HBy A 130 PRO HBx 1.0 1.475 2.427 948 901 A 63 LEU HDy% A 130 PRO HBx 1.0 1.709 3.237 949 901 A 63 LEU HDx% A 130 PRO HBx 1.0 1.709 3.237 950 902 A 130 PRO HDx A 130 PRO HBx 1.0 1.714 3.262 951 903 A 63 LEU HDy% A 130 PRO HDy 1.0 1.818 3.770 952 903 A 63 LEU HDx% A 130 PRO HDy 1.0 1.818 3.770 953 904 A 130 PRO HDy A 130 PRO HGx 1.0 1.634 2.946 954 905 A 63 LEU HDx% A 130 PRO HDx 1.0 1.842 3.912 955 905 A 63 LEU HDy% A 130 PRO HDx 1.0 1.842 3.912 956 906 A 129 ARG HA A 130 PRO HDx 1.0 1.668 3.076 957 907 A 129 ARG HBy A 130 PRO HDx 1.0 1.635 2.945 958 908 A 130 PRO HDx A 130 PRO HGx 1.0 1.621 2.899 959 909 A 63 LEU HDx% A 130 PRO HGy 1.0 1.701 3.203 960 909 A 63 LEU HDy% A 130 PRO HGy 1.0 1.701 3.203 961 910 A 63 LEU HDx% A 130 PRO HGx 1.0 1.674 3.094 962 910 A 63 LEU HDy% A 130 PRO HGx 1.0 1.674 3.094 963 911 A 130 PRO HGx A 130 PRO HGy 1.0 1.487 2.461 964 912 A 131 LEU HA A 131 LEU HBy 1.0 1.642 2.974 965 913 A 131 LEU HA A 131 LEU HBx 1.0 1.611 2.861 966 914 A 131 LEU HDy% A 131 LEU HA 1.0 1.699 3.199 967 915 A 131 LEU HBy A 131 LEU HBx 1.0 1.649 2.999 968 916 A 131 LEU HBy A 131 LEU HG 1.0 1.745 3.401 969 917 A 131 LEU HBx A 131 LEU HG 1.0 1.783 3.581 970 918 A 131 LEU HA A 131 LEU HDx% 1.0 1.439 2.323 971 919 A 131 LEU HBy A 131 LEU HDx% 1.0 1.498 2.494 972 920 A 131 LEU HDx% A 158 TYR HBy 1.0 1.637 2.953 973 921 A 90 VAL HB A 131 LEU HDy% 1.0 1.632 2.940 974 922 A 131 LEU HDy% A 127 GLN HGx 1.0 1.703 3.217 975 923 A 130 PRO HA A 131 LEU HDy% 1.0 1.776 3.542 976 924 A 131 LEU HDy% A 131 LEU HBx 1.0 1.441 2.331 977 925 A 131 LEU HDy% A 131 LEU HG 1.0 1.505 2.515 978 926 A 132 LYS HA A 132 LYS HBx 1.0 1.428 2.294 979 927 A 132 LYS HBx A 132 LYS HBy 1.0 1.299 1.965 980 928 A 132 LYS HBy A 132 LYS HGy 1.0 1.474 2.422 981 929 A 133 CYS HBy A 133 CYS HA 1.0 1.615 2.877 982 930 A 133 CYS HBx A 133 CYS HA 1.0 1.626 2.912 983 931 A 103 LEU HDy% A 133 CYS HBy 1.0 1.783 3.585 984 932 A 103 LEU HDx% A 133 CYS HBx 1.0 1.653 3.017 985 933 A 133 CYS HBy A 133 CYS HBx 1.0 1.533 2.601 986 934 A 134 ASP HA A 134 ASP HBy 1.0 1.533 2.603 987 935 A 134 ASP HA A 134 ASP HBx 1.0 1.593 2.797 988 936 A 134 ASP HBy A 134 ASP HBx 1.0 1.533 2.603 989 937 A 135 GLU HA A 136 PRO HDy 1.0 1.598 2.816 990 938 A 135 GLU HA A 136 PRO HDx 1.0 1.609 2.853 991 939 A 135 GLU HGy A 135 GLU HBx 1.0 1.695 3.183 992 940 A 135 GLU HA A 135 GLU HGx 1.0 1.798 3.658 993 941 A 135 GLU HBx A 135 GLU HGx 1.0 1.723 3.301 994 942 A 136 PRO HA A 136 PRO HBy 1.0 1.501 2.503 995 943 A 136 PRO HDy A 136 PRO HA 1.0 1.745 3.401 996 944 A 136 PRO HA A 136 PRO HGy 1.0 1.627 2.917 997 945 A 136 PRO HA A 136 PRO HBx 1.0 1.582 2.760 998 946 A 136 PRO HDx A 136 PRO HGx 1.0 1.704 3.220 999 947 A 136 PRO HDx A 136 PRO HGy 1.0 1.662 3.052 1000 948 A 136 PRO HDy A 136 PRO HGx 1.0 1.662 3.048 1001 949 A 137 ILE HA A 137 ILE HB 1.0 1.693 3.171 1002 950 A 137 ILE HA A 137 ILE HG1x 1.0 1.667 3.067 1003 951 A 137 ILE HB A 137 ILE HG1x 1.0 1.542 2.628 1004 952 A 137 ILE HA A 137 ILE HD1% 1.0 1.439 2.325 1005 953 A 137 ILE HG1x A 137 ILE HD1% 1.0 1.401 2.221 1006 954 A 103 LEU HA A 137 ILE HG2% 1.0 1.680 3.118 1007 955 A 137 ILE HA A 137 ILE HG2% 1.0 1.470 2.414 1008 956 A 138 LEU HA A 138 LEU HDy% 1.0 1.481 2.443 1009 957 A 138 LEU HDy% A 138 LEU HG 1.0 1.418 2.268 1010 958 A 138 LEU HA A 138 LEU HG 1.0 1.763 3.485 1011 959 A 105 ASP HBy A 139 SER HA 1.0 1.688 3.154 1012 960 A 105 ASP HBx A 139 SER HA 1.0 1.684 3.138 1013 961 A 139 SER HA A 139 SER HBy 1.0 1.486 2.460 1014 962 A 139 SER HBy A 139 SER HBx 1.0 1.361 2.117 1015 963 A 139 SER HBy A 141 ARG HDx 1.0 1.846 3.932 1016 964 A 139 SER HBx A 141 ARG HDx 1.0 1.810 3.728 1017 965 A 105 ASP HBx A 140 ASN HA 1.0 1.813 3.743 1018 966 A 107 VAL HA A 140 ASN HA 1.0 1.771 3.521 1019 967 A 107 VAL HGx% A 140 ASN HA 1.0 1.819 3.773 1020 968 A 140 ASN HA A 140 ASN HBy 1.0 1.589 2.783 1021 969 A 140 ASN HBx A 140 ASN HA 1.0 1.583 2.763 1022 970 A 105 ASP HBx A 140 ASN HBy 1.0 1.840 3.898 1023 971 A 107 VAL HA A 140 ASN HBy 1.0 1.862 4.034 1024 972 A 140 ASN HBx A 107 VAL HGy% 1.0 1.684 3.138 1025 973 A 140 ASN HBx A 140 ASN HBy 1.0 1.615 2.873 1026 974 A 141 ARG HA A 141 ARG HBy 1.0 1.577 2.743 1027 975 A 141 ARG HA A 141 ARG HGy 1.0 1.635 2.949 1028 976 A 141 ARG HA A 184 LEU HA 1.0 1.686 3.142 1029 977 A 184 LEU HDy% A 141 ARG HA 1.0 1.714 3.258 1030 977 A 184 LEU HDx% A 141 ARG HA 1.0 1.714 3.258 1031 978 A 141 ARG HBy A 141 ARG HBx 1.0 1.467 2.403 1032 979 A 141 ARG HDx A 141 ARG HBy 1.0 1.697 3.189 1033 980 A 141 ARG HA A 141 ARG HBx 1.0 1.674 3.096 1034 981 A 141 ARG HDx A 141 ARG HBx 1.0 1.677 3.107 1035 982 A 141 ARG HDx A 186 GLY HAx 1.0 1.696 3.188 1036 983 A 141 ARG HDx A 141 ARG HGy 1.0 1.526 2.578 1037 984 A 141 ARG HA A 141 ARG HGx 1.0 1.630 2.930 1038 985 A 141 ARG HBy A 141 ARG HGx 1.0 1.543 2.635 1039 986 A 142 SER HA A 142 SER HBy 1.0 1.458 2.380 1040 987 A 142 SER HA A 184 LEU HBy 1.0 1.762 3.478 1041 988 A 142 SER HA A 184 LEU HBx 1.0 1.762 3.480 1042 989 A 184 LEU HDx% A 142 SER HA 1.0 1.649 3.001 1043 989 A 184 LEU HDy% A 142 SER HA 1.0 1.649 3.001 1044 990 A 142 SER HBy A 142 SER HBx 1.0 1.354 2.100 1045 991 A 184 LEU HDx% A 142 SER HBx 1.0 1.896 4.286 1046 991 A 184 LEU HDy% A 142 SER HBx 1.0 1.896 4.286 1047 992 A 143 GLY HAy A 143 GLY HAx 1.0 1.486 2.460 1048 993 A 184 LEU HBy A 143 GLY HAy 1.0 1.847 3.937 1049 994 A 184 LEU HDx% A 143 GLY HAy 1.0 1.715 3.263 1050 994 A 184 LEU HDy% A 143 GLY HAy 1.0 1.715 3.263 1051 995 A 143 GLY HAx A 146 ARG HGy 1.0 1.723 3.297 1052 996 A 184 LEU HDx% A 143 GLY HAx 1.0 1.696 3.182 1053 996 A 184 LEU HDy% A 143 GLY HAx 1.0 1.696 3.182 1054 997 A 144 ASP HA A 144 ASP HBx 1.0 1.431 2.301 1055 998 A 144 ASP HA A 145 HIS HD1 1.0 1.861 4.027 1056 999 A 144 ASP HBx A 144 ASP HBy 1.0 1.293 1.949 1057 1000 A 144 ASP HBx A 145 HIS HD1 1.0 1.689 3.157 1058 1001 A 145 HIS HD1 A 145 HIS HA 1.0 1.898 4.296 1059 1002 A 145 HIS HBy A 145 HIS HD1 1.0 1.798 3.660 1060 1003 A 145 HIS HBx A 145 HIS HA 1.0 1.623 2.901 1061 1004 A 145 HIS HBx A 145 HIS HD1 1.0 1.820 3.778 1062 1005 A 146 ARG HA A 146 ARG HBy 1.0 1.764 3.488 1063 1006 A 146 ARG HBy A 146 ARG HBx 1.0 1.779 3.563 1064 1007 A 146 ARG HBx A 146 ARG HDy 1.0 1.892 4.248 1065 1008 A 146 ARG HGy A 146 ARG HBx 1.0 1.845 3.927 1066 1009 A 146 ARG HBy A 146 ARG HDy 1.0 1.813 3.745 1067 1010 A 146 ARG HDy A 146 ARG HDx 1.0 1.619 2.889 1068 1011 A 146 ARG HGy A 146 ARG HDy 1.0 1.696 3.188 1069 1012 A 146 ARG HA A 146 ARG HGx 1.0 1.836 3.870 1070 1013 A 146 ARG HBx A 146 ARG HGx 1.0 1.811 3.729 1071 1014 A 84 TRP HBx A 147 GLY HAy 1.0 1.891 4.245 1072 1015 A 84 TRP HD1 A 147 GLY HAy 1.0 1.860 4.024 1073 1016 A 84 TRP HA A 147 GLY HAx 1.0 1.714 3.264 1074 1017 A 84 TRP HD1 A 147 GLY HAx 1.0 1.802 3.684 1075 1018 A 147 GLY HAy A 147 GLY HAx 1.0 1.682 3.128 1076 1019 A 81 TYR HA A 148 LYS HGy 1.0 1.755 3.447 1077 1020 A 148 LYS HGy A 148 LYS HA 1.0 1.688 3.150 1078 1021 A 148 LYS HBx A 148 LYS HGy 1.0 1.539 2.621 1079 1022 A 81 TYR HA A 148 LYS HGx 1.0 1.735 3.353 1080 1023 A 148 LYS HA A 148 LYS HGx 1.0 1.666 3.066 1081 1024 A 149 PHE HA A 149 PHE HBy 1.0 1.665 3.059 1082 1025 A 149 PHE HA A 149 PHE HBx 1.0 1.832 3.850 1083 1026 A 150 LYS HA A 150 LYS HZ% 1.0 1.870 4.090 1084 1027 A 150 LYS HA A 150 LYS HBx 1.0 1.623 2.905 1085 1028 A 150 LYS HA A 150 LYS HDx 1.0 1.629 2.925 1086 1029 A 150 LYS HA A 150 LYS HEx 1.0 1.715 3.263 1087 1030 A 150 LYS HA A 150 LYS HGx 1.0 1.584 2.766 1088 1031 A 151 VAL HA A 151 VAL HB 1.0 1.728 3.324 1089 1032 A 151 VAL HA A 154 PHE HBx 1.0 1.742 3.384 1090 1033 A 151 VAL HA A 151 VAL HGx% 1.0 1.545 2.641 1091 1034 A 151 VAL HB A 151 VAL HGx% 1.0 1.538 2.618 1092 1035 A 151 VAL HGy% A 17 VAL HGx% 1.0 1.427 2.291 1093 1036 A 151 VAL HGy% A 18 ASP HBy 1.0 1.686 3.144 1094 1037 A 151 VAL HGy% A 151 VAL HB 1.0 1.547 2.645 1095 1038 A 152 ALA HA A 155 ARG HDx 1.0 1.755 3.445 1096 1039 A 152 ALA HA A 156 LYS H 1.0 1.851 3.963 1097 1040 A 150 LYS HEx A 152 ALA HB% 1.0 1.657 3.031 1098 1041 A 152 ALA HB% A 156 LYS HEx 1.0 1.629 2.925 1099 1042 A 153 SER HA A 156 LYS HBx 1.0 1.656 3.028 1100 1043 A 150 LYS HBx A 153 SER HBx 1.0 1.536 2.612 1101 1044 A 154 PHE HBx A 154 PHE HA 1.0 1.688 3.150 1102 1045 A 154 PHE HA A 157 LYS HBy 1.0 1.776 3.548 1103 1046 A 154 PHE HBx A 151 VAL HGx% 1.0 1.874 4.122 1104 1047 A 154 PHE HBx A 155 ARG HBy 1.0 1.897 4.287 1105 1048 A 156 LYS HBx A 156 LYS HA 1.0 1.602 2.830 1106 1049 A 156 LYS HA A 156 LYS HGx 1.0 1.663 3.053 1107 1050 A 156 LYS HA A 156 LYS HGy 1.0 1.595 2.805 1108 1051 A 156 LYS H A 156 LYS HA 1.0 1.778 3.558 1109 1052 A 156 LYS HA A 159 GLU H 1.0 1.818 3.764 1110 1053 A 156 LYS H A 156 LYS HEy 1.0 1.859 4.021 1111 1054 A 156 LYS HEx A 156 LYS HGy 1.0 1.753 3.435 1112 1055 A 157 LYS HBy A 157 LYS HA 1.0 1.663 3.053 1113 1056 A 157 LYS HA A 157 LYS HBx 1.0 1.618 2.886 1114 1057 A 157 LYS HA A 157 LYS HGy 1.0 1.701 3.205 1115 1058 A 157 LYS HDy A 157 LYS HEx 1.0 1.745 3.399 1116 1059 A 157 LYS HEx A 157 LYS HDx 1.0 1.771 3.521 1117 1060 A 157 LYS HGy A 157 LYS HEx 1.0 1.754 3.438 1118 1061 A 157 LYS HA A 157 LYS HGx 1.0 1.853 3.979 1119 1062 A 157 LYS HBy A 157 LYS HGx 1.0 1.840 3.896 1120 1063 A 157 LYS HBx A 157 LYS HGx 1.0 1.835 3.865 1121 1064 A 157 LYS HDy A 157 LYS HGx 1.0 1.787 3.605 1122 1065 A 157 LYS HDx A 157 LYS HGx 1.0 1.825 3.809 1123 1066 A 157 LYS HEx A 157 LYS HGx 1.0 1.771 3.523 1124 1067 A 157 LYS HGy A 157 LYS HGx 1.0 1.725 3.309 1125 1068 A 157 LYS HDx A 158 TYR HA 1.0 1.840 3.902 1126 1069 A 157 LYS HGy A 158 TYR HA 1.0 1.746 3.404 1127 1070 A 158 TYR HBy A 158 TYR HA 1.0 1.706 3.224 1128 1071 A 158 TYR HBy A 158 TYR HBx 1.0 1.777 3.553 1129 1072 A 158 TYR HA A 158 TYR HBx 1.0 1.824 3.800 1130 1073 A 159 GLU HA A 159 GLU HGx 1.0 1.795 3.647 1131 1074 A 159 GLU HA A 159 GLU HBx 1.0 1.675 3.099 1132 1075 A 159 GLU H A 159 GLU HBx 1.0 1.814 3.748 1133 1076 A 160 LEU HA A 160 LEU HDx% 1.0 1.432 2.306 1134 1077 A 160 LEU HDy% A 65 THR HB 1.0 1.664 3.056 1135 1078 A 160 LEU HDy% A 155 ARG HA 1.0 1.623 2.903 1136 1079 A 160 LEU HDy% A 158 TYR HBy 1.0 1.771 3.521 1137 1080 A 161 ARG HA A 161 ARG HBx 1.0 1.522 2.566 1138 1081 A 161 ARG HA A 161 ARG HDx 1.0 1.783 3.583 1139 1082 A 161 ARG HA A 161 ARG HBy 1.0 1.621 2.895 1140 1083 A 161 ARG HA A 161 ARG HDy 1.0 1.721 3.291 1141 1084 A 161 ARG HBx A 161 ARG HDy 1.0 1.484 2.452 1142 1085 A 161 ARG HDx A 161 ARG HDy 1.0 1.242 1.834 1143 1086 A 161 ARG HDy A 161 ARG HGx 1.0 1.514 2.542 1144 1087 A 161 ARG HA A 161 ARG HGy 1.0 1.657 3.029 1145 1088 A 161 ARG HDy A 161 ARG HGy 1.0 1.651 3.007 1146 1089 A 162 ALA HA A 163 PRO HDy 1.0 1.631 2.935 1147 1090 A 162 ALA HA A 163 PRO HDx 1.0 1.652 3.010 1148 1091 A 19 GLU HBx A 162 ALA HB% 1.0 1.536 2.612 1149 1092 A 162 ALA HA A 162 ALA HB% 1.0 1.431 2.303 1150 1093 A 163 PRO HDy A 162 ALA HB% 1.0 1.560 2.686 1151 1094 A 163 PRO HDx A 162 ALA HB% 1.0 1.520 2.560 1152 1095 A 125 TYR HA A 163 PRO HA 1.0 1.745 3.399 1153 1096 A 163 PRO HA A 163 PRO HBy 1.0 1.702 3.208 1154 1097 A 163 PRO HA A 163 PRO HBx 1.0 1.664 3.058 1155 1098 A 163 PRO HGx A 163 PRO HA 1.0 1.816 3.754 1156 1099 A 164 VAL HGy% A 163 PRO HA 1.0 1.753 3.437 1157 1100 A 163 PRO HBy A 163 PRO HBx 1.0 1.581 2.757 1158 1101 A 21 PRO HA A 163 PRO HBx 1.0 1.818 3.766 1159 1102 A 163 PRO HDx A 163 PRO HBx 1.0 1.614 2.872 1160 1103 A 163 PRO HDy A 163 PRO HDx 1.0 1.730 3.328 1161 1104 A 163 PRO HDx A 163 PRO HGy 1.0 1.750 3.420 1162 1105 A 163 PRO HBx A 163 PRO HGy 1.0 1.611 2.861 1163 1106 A 163 PRO HGx A 163 PRO HDx 1.0 1.726 3.310 1164 1107 A 164 VAL HA A 164 VAL HGy% 1.0 1.603 2.835 1165 1108 A 164 VAL HGx% A 164 VAL HB 1.0 1.496 2.488 1166 1109 A 164 VAL HB A 164 VAL HGy% 1.0 1.509 2.525 1167 1110 A 164 VAL HB A 164 VAL H 1.0 1.686 3.144 1168 1111 A 164 VAL HA A 164 VAL HGx% 1.0 1.498 2.494 1169 1112 A 164 VAL HGy% A 164 VAL H 1.0 1.440 2.328 1170 1113 A 21 PRO HBy A 165 ALA HA 1.0 1.782 3.576 1171 1114 A 21 PRO HBx A 165 ALA HA 1.0 1.773 3.531 1172 1115 A 21 PRO HGx A 165 ALA HA 1.0 1.788 3.608 1173 1116 A 23 HIS HBx A 165 ALA HA 1.0 1.880 4.164 1174 1117 A 164 VAL HA A 165 ALA HA 1.0 1.893 4.261 1175 1118 A 165 ALA HB% A 23 HIS HBy 1.0 1.734 3.348 1176 1119 A 165 ALA HB% A 23 HIS HBx 1.0 1.697 3.189 1177 1120 A 165 ALA HB% A 25 LEU HA 1.0 1.660 3.040 1178 1121 A 165 ALA HB% A 55 TRP HA 1.0 1.680 3.118 1179 1122 A 165 ALA HB% A 55 TRP HBy 1.0 1.680 3.118 1180 1123 A 165 ALA HB% A 55 TRP HBx 1.0 1.680 3.118 1181 1124 A 165 ALA HB% A 164 VAL HB 1.0 1.796 3.646 1182 1125 A 165 ALA HB% A 165 ALA HA 1.0 1.600 2.822 1183 1126 A 21 PRO HGx A 166 GLY HAy 1.0 1.726 3.314 1184 1127 A 21 PRO HGx A 166 GLY HAx 1.0 1.812 3.732 1185 1128 A 25 LEU HBy A 166 GLY HAx 1.0 1.764 3.488 1186 1129 A 166 GLY HAx A 166 GLY HAy 1.0 1.775 3.537 1187 1130 A 168 CYS H A 167 THR HA 1.0 1.697 3.187 1188 1131 A 25 LEU HBx A 167 THR HB 1.0 1.812 3.732 1189 1132 A 167 THR HB A 27 VAL HGx% 1.0 1.847 3.945 1190 1132 A 167 THR HB A 27 VAL HGy% 1.0 1.847 3.945 1191 1133 A 167 THR HG2% A 122 TRP HBx 1.0 1.608 2.852 1192 1134 A 167 THR HG2% A 167 THR HB 1.0 1.527 2.581 1193 1135 A 121 VAL HA A 168 CYS HA 1.0 1.754 3.438 1194 1136 A 168 CYS HBy A 168 CYS HA 1.0 1.755 3.445 1195 1137 A 168 CYS HBx A 168 CYS HA 1.0 1.771 3.523 1196 1138 A 168 CYS H A 168 CYS HA 1.0 1.770 3.518 1197 1139 A 168 CYS HBy A 14 LEU HDx% 1.0 1.723 3.301 1198 1140 A 168 CYS HBy A 14 LEU HDy% 1.0 1.751 3.429 1199 1141 A 168 CYS HBy A 168 CYS HBx 1.0 1.606 2.844 1200 1142 A 34 VAL HGy% A 169 TYR HA 1.0 1.777 3.555 1201 1143 A 169 TYR HA A 169 TYR HBy 1.0 1.776 3.546 1202 1144 A 169 TYR HA A 169 TYR HBx 1.0 1.762 3.476 1203 1145 A 169 TYR HA A 170 GLN H 1.0 1.698 3.192 1204 1146 A 119 ARG HA A 170 GLN HA 1.0 1.837 3.875 1205 1147 A 170 GLN HBy A 170 GLN HA 1.0 1.753 3.437 1206 1148 A 170 GLN HA A 170 GLN HGx 1.0 1.748 3.412 1207 1149 A 170 GLN H A 170 GLN HA 1.0 1.739 3.373 1208 1150 A 170 GLN HBy A 170 GLN HBx 1.0 1.628 2.922 1209 1151 A 170 GLN HA A 170 GLN HBx 1.0 1.881 4.167 1210 1152 A 117 LEU HDy% A 171 ALA HA 1.0 1.674 3.096 1211 1152 A 117 LEU HDx% A 171 ALA HA 1.0 1.674 3.096 1212 1153 A 171 ALA HA A 171 ALA H 1.0 1.852 3.970 1213 1154 A 171 ALA HA A 172 GLU H 1.0 1.658 3.034 1214 1155 A 42 THR HA A 171 ALA HB% 1.0 1.601 2.827 1215 1156 A 109 SER HBx A 171 ALA HB% 1.0 1.653 3.015 1216 1157 A 171 ALA HA A 171 ALA HB% 1.0 1.522 2.568 1217 1158 A 172 GLU HA A 172 GLU HBx 1.0 1.638 2.960 1218 1159 A 172 GLU HA A 173 TRP H 1.0 1.887 4.207 1219 1160 A 173 TRP HBx A 173 TRP HA 1.0 1.737 3.363 1220 1161 A 173 TRP HA A 177 VAL HB 1.0 1.767 3.503 1221 1162 A 174 ASP HBx A 174 ASP HA 1.0 1.552 2.662 1222 1163 A 175 ASP HA A 175 ASP HBy 1.0 1.582 2.762 1223 1164 A 175 ASP HA A 175 ASP HBx 1.0 1.572 2.726 1224 1165 A 175 ASP HA A 178 PRO HGx 1.0 1.748 3.408 1225 1166 A 176 TYR HA A 176 TYR HBy 1.0 1.612 2.864 1226 1167 A 176 TYR HA A 176 TYR HBx 1.0 1.644 2.980 1227 1168 A 176 TYR HA A 179 LYS HBx 1.0 1.611 2.863 1228 1169 A 176 TYR HA A 179 LYS HGx 1.0 1.714 3.264 1229 1170 A 177 VAL HB A 177 VAL HA 1.0 1.803 3.689 1230 1171 A 177 VAL HA A 177 VAL H 1.0 1.890 4.234 1231 1172 A 173 TRP HA A 177 VAL HGx% 1.0 1.808 3.714 1232 1173 A 177 VAL HB A 177 VAL HGx% 1.0 1.588 2.784 1233 1174 A 177 VAL HGx% A 178 PRO HDy 1.0 1.742 3.384 1234 1175 A 110 GLY HAx A 177 VAL HGy% 1.0 1.657 3.027 1235 1176 A 173 TRP HA A 177 VAL HGy% 1.0 1.681 3.125 1236 1177 A 177 VAL HA A 177 VAL HGy% 1.0 1.625 2.913 1237 1178 A 177 VAL HB A 177 VAL HGy% 1.0 1.568 2.716 1238 1179 A 177 VAL HGx% A 177 VAL HGy% 1.0 1.535 2.609 1239 1180 A 178 PRO HA A 178 PRO HBy 1.0 1.612 2.866 1240 1181 A 178 PRO HA A 178 PRO HBx 1.0 1.640 2.964 1241 1182 A 178 PRO HDy A 178 PRO HA 1.0 1.827 3.821 1242 1183 A 178 PRO HA A 178 PRO HDx 1.0 1.841 3.905 1243 1184 A 178 PRO HA A 181 TYR HBy 1.0 1.666 3.064 1244 1185 A 178 PRO HBy A 178 PRO HBx 1.0 1.571 2.725 1245 1186 A 177 VAL HB A 178 PRO HDx 1.0 1.718 3.282 1246 1187 A 178 PRO HDy A 178 PRO HDx 1.0 1.607 2.847 1247 1188 A 178 PRO HGx A 178 PRO HDx 1.0 1.674 3.098 1248 1189 A 178 PRO HGx A 178 PRO HDy 1.0 1.679 3.115 1249 1190 A 179 LYS HA A 179 LYS HDx 1.0 1.467 2.403 1250 1191 A 179 LYS HGx A 179 LYS HA 1.0 1.579 2.749 1251 1192 A 179 LYS HA A 182 GLU HBy 1.0 1.602 2.830 1252 1193 A 179 LYS HA A 182 GLU HBx 1.0 1.680 3.120 1253 1194 A 179 LYS HA A 182 GLU HGx 1.0 1.690 3.158 1254 1195 A 179 LYS HBx A 179 LYS HA 1.0 1.594 2.804 1255 1196 A 179 LYS HDx A 182 GLU HGx 1.0 1.802 3.680 1256 1197 A 180 LEU HA A 183 GLN HBy 1.0 1.634 2.944 1257 1198 A 177 VAL HA A 180 LEU HBy 1.0 1.805 3.701 1258 1199 A 180 LEU HA A 180 LEU HBy 1.0 1.775 3.545 1259 1200 A 180 LEU HBy A 180 LEU HBx 1.0 1.670 3.082 1260 1201 A 180 LEU HBy A 180 LEU HG 1.0 1.702 3.212 1261 1202 A 177 VAL HA A 180 LEU HBx 1.0 1.843 3.917 1262 1203 A 180 LEU HA A 180 LEU HBx 1.0 1.764 3.488 1263 1204 A 180 LEU HDy% A 180 LEU HBx 1.0 1.742 3.386 1264 1205 A 180 LEU HA A 180 LEU HDx% 1.0 1.420 2.272 1265 1206 A 180 LEU HDy% A 180 LEU HBy 1.0 1.553 2.663 1266 1207 A 180 LEU HA A 180 LEU HG 1.0 1.784 3.586 1267 1208 A 180 LEU HDy% A 180 LEU HG 1.0 1.651 3.007 1268 1209 A 182 GLU HGx A 182 GLU HA 1.0 1.639 2.961 1269 1210 A 182 GLU HBy A 182 GLU HA 1.0 1.558 2.682 1270 1211 A 182 GLU HBx A 182 GLU HA 1.0 1.546 2.640 1271 1212 A 182 GLU HBx A 182 GLU HGx 1.0 1.547 2.645 1272 1213 A 141 ARG HA A 183 GLN HGx 1.0 1.721 3.289 1273 1214 A 184 LEU HA A 183 GLN HGx 1.0 1.692 3.168 1274 1215 A 184 LEU HDx% A 183 GLN HGx 1.0 1.767 3.505 1275 1215 A 184 LEU HDy% A 183 GLN HGx 1.0 1.767 3.505 1276 1216 A 184 LEU HA A 184 LEU HBy 1.0 1.598 2.814 1277 1217 A 184 LEU HA A 184 LEU HBx 1.0 1.630 2.930 1278 1218 A 184 LEU HDx% A 184 LEU HA 1.0 1.488 2.464 1279 1218 A 184 LEU HDy% A 184 LEU HA 1.0 1.488 2.464 1280 1219 A 184 LEU HDy% A 184 LEU HBx 1.0 1.602 2.832 1281 1219 A 184 LEU HDx% A 184 LEU HBx 1.0 1.602 2.832 1282 1220 A 184 LEU HDx% A 184 LEU HBy 1.0 1.389 2.191 1283 1221 A 184 LEU HDy% A 141 ARG HA 1.0 1.651 3.009 1284 1222 A 184 LEU HDy% A 184 LEU HA 1.0 1.375 2.153 1285 1223 A 184 LEU HDy% A 184 LEU HG 1.0 1.525 2.577 1286 1223 A 184 LEU HDx% A 184 LEU HG 1.0 1.525 2.577 1287 1224 A 185 SER HBx A 187 LYS HDx 1.0 1.763 3.485 1288 1225 A 185 SER HBx A 187 LYS HEx 1.0 1.838 3.888 1289 1226 A 185 SER HBx A 187 LYS HGx 1.0 1.762 3.480 1290 1227 A 141 ARG HBy A 186 GLY HAy 1.0 1.786 3.596 1291 1228 A 141 ARG HBx A 186 GLY HAy 1.0 1.801 3.673 1292 1229 A 186 GLY HAx A 186 GLY HAy 1.0 1.272 1.902 1293 1230 A 141 ARG HBy A 186 GLY HAx 1.0 1.801 3.675 1294 1231 A 141 ARG HBx A 186 GLY HAx 1.0 1.794 3.640 1295 1232 A 187 LYS HBy A 187 LYS HA 1.0 1.531 2.595 1296 1233 A 187 LYS HBy A 187 LYS HBx 1.0 1.261 1.877 1297 1234 A 187 LYS HA A 187 LYS HBx 1.0 1.598 2.816 1298 1235 A 187 LYS HGx A 187 LYS HBx 1.0 1.424 2.284 1299 1236 A 187 LYS HDx A 187 LYS HA 1.0 1.557 2.679 1300 1237 A 184 LEU HA A 142 SER H 1.0 1.685 3.143 1301 1238 A 37 LEU HDx% A 4 ASP H 1.0 1.675 3.103 1302 1239 A 1 MET HA A 1 MET H1 1.0 1.826 3.814 1303 1240 A 1 MET HBx A 1 MET H1 1.0 1.637 2.957 1304 1241 A 2 PRO HA A 3 VAL H 1.0 1.468 2.406 1305 1242 A 2 PRO HBy A 3 VAL H 1.0 1.840 3.894 1306 1243 A 3 VAL HA A 3 VAL H 1.0 1.758 3.460 1307 1244 A 3 VAL HGx% A 3 VAL H 1.0 1.615 2.873 1308 1244 A 3 VAL HGy% A 3 VAL H 1.0 1.615 2.873 1309 1245 A 3 VAL HA A 4 ASP H 1.0 1.475 2.427 1310 1246 A 4 ASP H A 3 VAL HB 1.0 1.869 4.085 1311 1247 A 4 ASP HA A 4 ASP H 1.0 1.768 3.508 1312 1248 A 4 ASP HA A 5 LEU H 1.0 1.580 2.756 1313 1249 A 4 ASP HBx A 5 LEU H 1.0 1.871 4.101 1314 1250 A 5 LEU HA A 5 LEU H 1.0 1.809 3.719 1315 1251 A 5 LEU HDx% A 5 LEU H 1.0 1.905 4.355 1316 1252 A 5 LEU H A 6 SER H 1.0 1.621 2.897 1317 1253 A 6 SER H A 6 SER HA 1.0 1.675 3.099 1318 1254 A 6 SER H A 6 SER HBx 1.0 1.589 2.783 1319 1255 A 6 SER H A 7 LYS H 1.0 1.623 2.901 1320 1256 A 6 SER HA A 7 LYS H 1.0 1.817 3.761 1321 1257 A 6 SER HBx A 7 LYS H 1.0 1.878 4.152 1322 1258 A 7 LYS HA A 7 LYS H 1.0 1.714 3.262 1323 1259 A 7 LYS HBx A 7 LYS H 1.0 1.694 3.176 1324 1260 A 8 TRP H A 5 LEU HBy 1.0 1.878 4.148 1325 1261 A 7 LYS HA A 8 TRP H 1.0 1.801 3.673 1326 1262 A 7 LYS H A 8 TRP H 1.0 1.633 2.941 1327 1263 A 8 TRP HA A 8 TRP H 1.0 1.664 3.058 1328 1264 A 8 TRP H A 10 GLY H 1.0 1.869 4.087 1329 1265 A 7 LYS HA A 9 SER H 1.0 1.946 4.738 1330 1266 A 8 TRP H A 9 SER H 1.0 1.777 3.549 1331 1267 A 9 SER HA A 9 SER H 1.0 1.804 3.690 1332 1268 A 10 GLY H A 9 SER H 1.0 1.657 3.031 1333 1269 A 9 SER HA A 10 GLY H 1.0 1.840 3.902 1334 1270 A 10 GLY HAy A 10 GLY H 1.0 1.649 2.999 1335 1271 A 10 GLY HAx A 10 GLY H 1.0 1.598 2.816 1336 1272 A 11 PRO HA A 12 LEU H 1.0 1.943 4.713 1337 1273 A 11 PRO HGx A 12 LEU H 1.0 1.897 4.287 1338 1274 A 12 LEU HA A 12 LEU H 1.0 1.723 3.299 1339 1275 A 12 LEU HBx A 12 LEU H 1.0 1.816 3.752 1340 1276 A 12 LEU HDy% A 12 LEU H 1.0 1.791 3.621 1341 1276 A 12 LEU HDx% A 12 LEU H 1.0 1.791 3.621 1342 1277 A 12 LEU HA A 13 SER H 1.0 1.737 3.363 1343 1278 A 12 LEU HBy A 13 SER H 1.0 1.911 4.399 1344 1279 A 13 SER HA A 13 SER H 1.0 1.583 2.763 1345 1280 A 14 LEU HG A 13 SER H 1.0 1.959 4.889 1346 1281 A 14 LEU H A 13 SER H 1.0 1.787 3.601 1347 1282 A 9 SER HA A 14 LEU H 1.0 1.966 4.992 1348 1283 A 14 LEU H A 13 SER HBy 1.0 1.918 4.464 1349 1284 A 14 LEU H A 14 LEU HA 1.0 1.817 3.763 1350 1285 A 14 LEU H A 14 LEU HBx 1.0 1.850 3.960 1351 1286 A 14 LEU H A 14 LEU HDy% 1.0 1.905 4.349 1352 1287 A 14 LEU HG A 14 LEU H 1.0 1.740 3.376 1353 1288 A 15 GLN HE2y A 15 GLN HE2x 1.0 1.494 2.482 1354 1289 A 9 SER HA A 15 GLN H 1.0 1.929 4.561 1355 1290 A 9 SER HBx A 15 GLN H 1.0 1.929 4.569 1356 1291 A 13 SER HA A 15 GLN H 1.0 1.920 4.482 1357 1292 A 14 LEU HA A 15 GLN H 1.0 1.915 4.431 1358 1293 A 14 LEU H A 15 GLN H 1.0 1.742 3.386 1359 1294 A 15 GLN HA A 15 GLN H 1.0 1.797 3.653 1360 1295 A 15 GLN HBx A 15 GLN H 1.0 1.677 3.105 1361 1296 A 15 GLN HGx A 15 GLN H 1.0 1.954 4.834 1362 1297 A 15 GLN H A 16 GLU H 1.0 1.711 3.247 1363 1298 A 14 LEU HA A 16 GLU H 1.0 1.894 4.262 1364 1299 A 16 GLU HA A 16 GLU H 1.0 1.809 3.717 1365 1300 A 16 GLU HBx A 16 GLU H 1.0 1.694 3.174 1366 1301 A 16 GLU HGy A 16 GLU H 1.0 1.771 3.521 1367 1302 A 16 GLU HGx A 16 GLU H 1.0 1.750 3.422 1368 1303 A 16 GLU HBx A 17 VAL H 1.0 1.891 4.241 1369 1304 A 16 GLU H A 17 VAL H 1.0 1.746 3.404 1370 1305 A 17 VAL HA A 17 VAL H 1.0 1.797 3.653 1371 1306 A 17 VAL HB A 17 VAL H 1.0 1.718 3.278 1372 1307 A 17 VAL HGy% A 17 VAL H 1.0 1.786 3.598 1373 1308 A 18 ASP H A 17 VAL H 1.0 1.602 2.830 1374 1309 A 18 ASP H A 17 VAL HB 1.0 1.678 3.112 1375 1310 A 18 ASP HA A 19 GLU H 1.0 1.626 2.916 1376 1311 A 18 ASP HBy A 19 GLU H 1.0 1.964 4.964 1377 1312 A 18 ASP HBx A 19 GLU H 1.0 1.917 4.455 1378 1313 A 19 GLU HA A 19 GLU H 1.0 1.792 3.630 1379 1314 A 19 GLU HBx A 19 GLU H 1.0 1.732 3.340 1380 1315 A 19 GLU HGx A 19 GLU H 1.0 1.651 3.005 1381 1316 A 19 GLU H A 20 GLN H 1.0 1.954 4.832 1382 1317 A 20 GLN HE2y A 20 GLN HE2x 1.0 1.423 2.281 1383 1318 A 20 GLN HE2y A 20 GLN HGy 1.0 1.896 4.278 1384 1319 A 20 GLN HGx A 20 GLN HE2y 1.0 1.818 3.770 1385 1320 A 20 GLN HE2x A 20 GLN HGy 1.0 1.872 4.102 1386 1321 A 20 GLN HGx A 20 GLN HE2x 1.0 1.833 3.853 1387 1322 A 19 GLU HA A 20 GLN H 1.0 1.598 2.818 1388 1323 A 22 GLN HE2y A 22 GLN HE2x 1.0 1.191 1.721 1389 1324 A 21 PRO HA A 22 GLN H 1.0 1.662 3.050 1390 1325 A 21 PRO HBy A 22 GLN H 1.0 1.863 4.043 1391 1326 A 21 PRO HBx A 22 GLN H 1.0 1.818 3.770 1392 1327 A 22 GLN HA A 22 GLN H 1.0 1.755 3.445 1393 1328 A 22 GLN HBx A 22 GLN H 1.0 1.811 3.729 1394 1329 A 22 GLN HGy A 22 GLN H 1.0 1.737 3.361 1395 1330 A 22 GLN HGx A 22 GLN H 1.0 1.700 3.198 1396 1331 A 23 HIS H A 22 GLN H 1.0 1.738 3.368 1397 1332 A 22 GLN HA A 23 HIS H 1.0 1.893 4.261 1398 1333 A 23 HIS H A 165 ALA HA 1.0 1.855 3.985 1399 1334 A 24 PRO HA A 25 LEU H 1.0 1.644 2.980 1400 1335 A 25 LEU H A 25 LEU HBy 1.0 1.788 3.604 1401 1336 A 25 LEU H A 25 LEU HBx 1.0 1.787 3.601 1402 1337 A 25 LEU H A 25 LEU HDy% 1.0 1.945 4.729 1403 1338 A 25 LEU H A 166 GLY HAy 1.0 1.878 4.148 1404 1339 A 25 LEU HA A 26 HIS H 1.0 1.701 3.205 1405 1340 A 25 LEU HDx% A 26 HIS H 1.0 1.745 3.395 1406 1341 A 26 HIS H A 25 LEU HG 1.0 1.902 4.330 1407 1342 A 25 LEU H A 26 HIS H 1.0 1.951 4.793 1408 1343 A 26 HIS HA A 26 HIS H 1.0 1.877 4.141 1409 1344 A 26 HIS H A 26 HIS HBx 1.0 1.786 3.598 1410 1345 A 54 SER H A 26 HIS H 1.0 1.824 3.806 1411 1346 A 26 HIS HA A 27 VAL H 1.0 1.623 2.903 1412 1347 A 27 VAL HA A 27 VAL H 1.0 1.878 4.146 1413 1348 A 27 VAL HB A 27 VAL H 1.0 1.812 3.736 1414 1349 A 27 VAL HGx% A 27 VAL H 1.0 1.788 3.606 1415 1349 A 27 VAL HGy% A 27 VAL H 1.0 1.788 3.606 1416 1350 A 34 VAL HB A 27 VAL H 1.0 1.952 4.810 1417 1351 A 27 VAL H A 34 VAL H 1.0 1.918 4.464 1418 1352 A 27 VAL HA A 28 THR H 1.0 1.605 2.839 1419 1353 A 27 VAL HGx% A 28 THR H 1.0 1.751 3.423 1420 1353 A 27 VAL HGy% A 28 THR H 1.0 1.751 3.423 1421 1354 A 28 THR H A 50 PRO HBx 1.0 1.803 3.683 1422 1355 A 53 ILE HG2% A 28 THR H 1.0 1.906 4.356 1423 1356 A 28 THR HA A 29 TYR H 1.0 1.593 2.801 1424 1357 A 28 THR HG2% A 29 TYR H 1.0 1.772 3.526 1425 1358 A 28 THR H A 29 TYR H 1.0 1.885 4.197 1426 1359 A 29 TYR H A 29 TYR HBy 1.0 1.927 4.545 1427 1360 A 29 TYR H A 32 ALA H 1.0 1.840 3.898 1428 1361 A 29 TYR H A 33 ALA H 1.0 1.824 3.798 1429 1362 A 29 TYR HA A 30 ALA H 1.0 1.709 3.237 1430 1363 A 29 TYR HBy A 30 ALA H 1.0 1.768 3.504 1431 1364 A 29 TYR HBx A 30 ALA H 1.0 1.827 3.819 1432 1365 A 30 ALA H A 30 ALA HA 1.0 1.654 3.020 1433 1366 A 30 ALA HB% A 30 ALA H 1.0 1.610 2.856 1434 1367 A 51 THR HG2% A 30 ALA H 1.0 1.815 3.749 1435 1368 A 30 ALA HB% A 31 GLY H 1.0 1.664 3.058 1436 1369 A 30 ALA H A 31 GLY H 1.0 1.626 2.916 1437 1370 A 31 GLY HAy A 31 GLY H 1.0 1.650 3.004 1438 1371 A 31 GLY HAx A 31 GLY H 1.0 1.658 3.032 1439 1372 A 29 TYR HBy A 32 ALA H 1.0 1.857 4.007 1440 1373 A 29 TYR HBx A 32 ALA H 1.0 1.782 3.578 1441 1374 A 31 GLY HAy A 32 ALA H 1.0 1.813 3.743 1442 1375 A 31 GLY HAx A 32 ALA H 1.0 1.871 4.099 1443 1376 A 32 ALA H A 31 GLY H 1.0 1.534 2.606 1444 1377 A 32 ALA HA A 32 ALA H 1.0 1.719 3.285 1445 1378 A 32 ALA HB% A 32 ALA H 1.0 1.643 2.979 1446 1379 A 32 ALA HA A 33 ALA H 1.0 1.541 2.627 1447 1380 A 32 ALA HB% A 33 ALA H 1.0 1.563 2.699 1448 1381 A 32 ALA H A 33 ALA H 1.0 1.932 4.594 1449 1382 A 33 ALA HA A 33 ALA H 1.0 1.839 3.893 1450 1383 A 28 THR HA A 34 VAL H 1.0 1.887 4.213 1451 1384 A 33 ALA HA A 34 VAL H 1.0 1.653 3.013 1452 1385 A 34 VAL HA A 34 VAL H 1.0 1.858 4.014 1453 1386 A 34 VAL HB A 34 VAL H 1.0 1.847 3.939 1454 1387 A 34 VAL H A 35 ASP H 1.0 1.941 4.683 1455 1388 A 34 VAL HA A 35 ASP H 1.0 1.620 2.894 1456 1389 A 35 ASP HA A 35 ASP H 1.0 1.741 3.381 1457 1390 A 35 ASP HBy A 35 ASP H 1.0 1.909 4.387 1458 1391 A 35 ASP HBx A 35 ASP H 1.0 1.865 4.061 1459 1392 A 39 LYS HDx A 35 ASP H 1.0 1.726 3.312 1460 1393 A 34 VAL HA A 36 GLU H 1.0 1.797 3.655 1461 1394 A 34 VAL HGx% A 36 GLU H 1.0 1.694 3.174 1462 1395 A 35 ASP HA A 36 GLU H 1.0 1.771 3.521 1463 1396 A 35 ASP H A 36 GLU H 1.0 1.649 3.003 1464 1397 A 36 GLU HA A 36 GLU H 1.0 1.734 3.350 1465 1398 A 36 GLU H A 36 GLU HBx 1.0 1.619 2.887 1466 1399 A 39 LYS HBy A 36 GLU H 1.0 1.717 3.273 1467 1400 A 36 GLU HA A 37 LEU H 1.0 1.617 2.881 1468 1401 A 36 GLU HGx A 37 LEU H 1.0 1.881 4.169 1469 1402 A 37 LEU HA A 37 LEU H 1.0 1.799 3.667 1470 1403 A 37 LEU HBy A 37 LEU H 1.0 1.731 3.337 1471 1404 A 37 LEU HBx A 37 LEU H 1.0 1.720 3.286 1472 1405 A 37 LEU HA A 38 GLY H 1.0 1.655 3.023 1473 1406 A 37 LEU HDy% A 38 GLY H 1.0 1.892 4.246 1474 1407 A 38 GLY HAx A 38 GLY H 1.0 1.845 3.927 1475 1408 A 39 LYS H A 38 GLY H 1.0 1.774 3.536 1476 1409 A 168 CYS H A 38 GLY H 1.0 1.893 4.253 1477 1410 A 39 LYS HBy A 39 LYS H 1.0 1.685 3.139 1478 1411 A 39 LYS HA A 40 VAL H 1.0 1.577 2.745 1479 1412 A 39 LYS HGx A 40 VAL H 1.0 1.786 3.600 1480 1413 A 40 VAL HA A 40 VAL H 1.0 1.896 4.282 1481 1414 A 40 VAL HB A 40 VAL H 1.0 1.637 2.957 1482 1415 A 40 VAL H A 40 VAL HGx% 1.0 1.708 3.236 1483 1416 A 40 VAL HA A 41 LEU H 1.0 1.652 3.010 1484 1417 A 40 VAL HB A 41 LEU H 1.0 1.944 4.710 1485 1418 A 40 VAL HGy% A 41 LEU H 1.0 1.766 3.500 1486 1419 A 40 VAL H A 41 LEU H 1.0 1.941 4.685 1487 1420 A 41 LEU HBx A 41 LEU H 1.0 1.769 3.513 1488 1421 A 41 LEU HG A 41 LEU H 1.0 1.934 4.618 1489 1422 A 41 LEU HA A 42 THR H 1.0 1.675 3.101 1490 1423 A 41 LEU HDx% A 42 THR H 1.0 1.889 4.221 1491 1424 A 45 GLN HBy A 42 THR H 1.0 1.829 3.831 1492 1425 A 43 PRO HBx A 44 THR H 1.0 1.864 4.048 1493 1426 A 44 THR HA A 44 THR H 1.0 1.816 3.758 1494 1427 A 44 THR HB A 44 THR H 1.0 1.804 3.692 1495 1428 A 44 THR HG1 A 44 THR H 1.0 1.703 3.215 1496 1429 A 45 GLN HBy A 45 GLN HE2y 1.0 1.878 4.146 1497 1430 A 45 GLN HGx A 45 GLN HE2y 1.0 1.871 4.097 1498 1431 A 45 GLN HE2y A 45 GLN HE2x 1.0 1.524 2.572 1499 1432 A 45 GLN HGx A 45 GLN HE2x 1.0 1.884 4.190 1500 1433 A 44 THR HG1 A 45 GLN H 1.0 1.823 3.795 1501 1434 A 45 GLN H A 44 THR H 1.0 1.792 3.626 1502 1435 A 45 GLN HBx A 45 GLN H 1.0 1.769 3.509 1503 1436 A 45 GLN H A 46 VAL H 1.0 1.750 3.420 1504 1437 A 45 GLN HA A 46 VAL H 1.0 1.820 3.778 1505 1438 A 45 GLN HBy A 46 VAL H 1.0 1.851 3.965 1506 1439 A 47 LYS HBx A 46 VAL H 1.0 1.931 4.579 1507 1440 A 46 VAL H A 47 LYS H 1.0 1.641 2.971 1508 1441 A 47 LYS HA A 47 LYS H 1.0 1.761 3.475 1509 1442 A 47 LYS HBx A 47 LYS H 1.0 1.659 3.039 1510 1443 A 47 LYS H A 48 ASN H 1.0 1.710 3.242 1511 1444 A 48 ASN HBy A 48 ASN H 1.0 1.789 3.609 1512 1445 A 48 ASN HBx A 48 ASN H 1.0 1.725 3.307 1513 1446 A 48 ASN HA A 49 ARG H 1.0 1.657 3.031 1514 1447 A 48 ASN HBy A 49 ARG H 1.0 1.699 3.197 1515 1448 A 48 ASN HBx A 49 ARG H 1.0 1.796 3.648 1516 1449 A 49 ARG HA A 49 ARG H 1.0 1.776 3.548 1517 1450 A 49 ARG HGx A 49 ARG H 1.0 1.903 4.335 1518 1451 A 29 TYR HA A 51 THR H 1.0 1.726 3.310 1519 1452 A 30 ALA H A 51 THR H 1.0 1.848 3.948 1520 1453 A 50 PRO HA A 51 THR H 1.0 1.650 3.000 1521 1454 A 50 PRO HBx A 51 THR H 1.0 1.732 3.338 1522 1455 A 28 THR H A 52 SER H 1.0 1.727 3.315 1523 1456 A 50 PRO HBx A 52 SER H 1.0 1.668 3.070 1524 1457 A 51 THR H A 52 SER H 1.0 1.575 2.735 1525 1458 A 52 SER HA A 52 SER H 1.0 1.691 3.161 1526 1459 A 52 SER HBx A 52 SER H 1.0 1.725 3.309 1527 1460 A 52 SER HA A 53 ILE H 1.0 1.552 2.662 1528 1461 A 53 ILE HA A 53 ILE H 1.0 1.893 4.261 1529 1462 A 53 ILE HG1y A 53 ILE H 1.0 1.867 4.069 1530 1463 A 53 ILE HG1x A 53 ILE H 1.0 1.766 3.496 1531 1464 A 53 ILE HG2% A 53 ILE H 1.0 1.895 4.277 1532 1465 A 97 ILE HD1% A 53 ILE H 1.0 1.873 4.111 1533 1466 A 25 LEU HDx% A 54 SER H 1.0 1.814 3.746 1534 1467 A 54 SER H A 26 HIS HBx 1.0 1.819 3.773 1535 1468 A 53 ILE HB A 54 SER H 1.0 1.767 3.503 1536 1469 A 54 SER H A 54 SER HA 1.0 1.851 3.965 1537 1470 A 54 SER H A 54 SER HBx 1.0 1.784 3.588 1538 1471 A 54 SER H A 55 TRP H 1.0 1.955 4.843 1539 1472 A 54 SER HA A 55 TRP H 1.0 1.567 2.711 1540 1473 A 55 TRP HA A 55 TRP H 1.0 1.900 4.308 1541 1474 A 58 LEU HA A 55 TRP H 1.0 1.929 4.565 1542 1475 A 58 LEU HBy A 55 TRP H 1.0 1.917 4.457 1543 1476 A 58 LEU HBx A 55 TRP H 1.0 1.866 4.060 1544 1477 A 58 LEU HDx% A 55 TRP H 1.0 1.760 3.470 1545 1478 A 55 TRP HA A 56 ASP H 1.0 1.687 3.147 1546 1479 A 55 TRP HBy A 56 ASP H 1.0 1.866 4.062 1547 1480 A 55 TRP HBx A 56 ASP H 1.0 1.816 3.756 1548 1481 A 56 ASP HA A 56 ASP H 1.0 1.796 3.648 1549 1482 A 56 ASP HBy A 56 ASP H 1.0 1.766 3.500 1550 1483 A 56 ASP HBx A 56 ASP H 1.0 1.727 3.315 1551 1484 A 56 ASP HA A 57 GLY H 1.0 1.568 2.714 1552 1485 A 57 GLY HAy A 57 GLY H 1.0 1.709 3.239 1553 1486 A 57 GLY HAx A 57 GLY H 1.0 1.693 3.171 1554 1487 A 57 GLY HAy A 58 LEU H 1.0 1.845 3.931 1555 1488 A 57 GLY H A 58 LEU H 1.0 1.591 2.793 1556 1489 A 58 LEU HA A 58 LEU H 1.0 1.658 3.034 1557 1490 A 58 LEU HBy A 58 LEU H 1.0 1.586 2.772 1558 1491 A 58 LEU HBx A 58 LEU H 1.0 1.593 2.797 1559 1492 A 58 LEU HG A 58 LEU H 1.0 1.912 4.408 1560 1493 A 58 LEU H A 59 ASP H 1.0 1.926 4.544 1561 1494 A 58 LEU HA A 59 ASP H 1.0 1.606 2.844 1562 1495 A 59 ASP HA A 59 ASP H 1.0 1.863 4.045 1563 1496 A 59 ASP HBy A 59 ASP H 1.0 1.790 3.616 1564 1497 A 59 ASP HBx A 59 ASP H 1.0 1.807 3.705 1565 1498 A 59 ASP HBx A 60 SER H 1.0 1.906 4.358 1566 1499 A 59 ASP H A 60 SER H 1.0 1.943 4.709 1567 1500 A 60 SER H A 62 LYS H 1.0 1.944 4.724 1568 1501 A 60 SER HA A 61 GLY H 1.0 1.880 4.162 1569 1502 A 60 SER H A 61 GLY H 1.0 1.649 3.001 1570 1503 A 61 GLY HAy A 61 GLY H 1.0 1.676 3.104 1571 1504 A 61 GLY HAx A 61 GLY H 1.0 1.647 2.989 1572 1505 A 61 GLY HAy A 62 LYS H 1.0 1.720 3.288 1573 1506 A 61 GLY HAx A 62 LYS H 1.0 1.852 3.970 1574 1507 A 62 LYS H A 61 GLY H 1.0 1.573 2.733 1575 1508 A 62 LYS HBx A 62 LYS H 1.0 1.724 3.304 1576 1509 A 62 LYS HGx A 62 LYS H 1.0 1.749 3.417 1577 1510 A 62 LYS H A 64 TYR HEy 1.0 1.869 4.087 1578 1511 A 62 LYS HA A 63 LEU H 1.0 1.630 2.932 1579 1512 A 62 LYS HBy A 63 LEU H 1.0 1.819 3.775 1580 1513 A 62 LYS H A 63 LEU H 1.0 1.918 4.458 1581 1514 A 63 LEU HA A 63 LEU H 1.0 1.897 4.285 1582 1515 A 63 LEU HBx A 63 LEU H 1.0 1.930 4.572 1583 1516 A 63 LEU HDx% A 63 LEU H 1.0 1.821 3.789 1584 1516 A 63 LEU HDy% A 63 LEU H 1.0 1.821 3.789 1585 1517 A 63 LEU H A 63 LEU HG 1.0 1.624 2.906 1586 1518 A 63 LEU HA A 64 TYR H 1.0 1.624 2.908 1587 1519 A 63 LEU HBy A 64 TYR H 1.0 1.837 3.875 1588 1520 A 63 LEU HBx A 64 TYR H 1.0 1.885 4.197 1589 1521 A 63 LEU HDy% A 64 TYR H 1.0 1.824 3.806 1590 1521 A 63 LEU HDx% A 64 TYR H 1.0 1.824 3.806 1591 1522 A 64 TYR HBy A 64 TYR H 1.0 1.942 4.702 1592 1523 A 64 TYR HBx A 64 TYR H 1.0 1.897 4.291 1593 1524 A 92 MET HBy A 64 TYR H 1.0 1.943 4.707 1594 1525 A 92 MET HGx A 64 TYR H 1.0 1.918 4.458 1595 1526 A 64 TYR H A 92 MET H 1.0 1.696 3.184 1596 1527 A 64 TYR H A 94 GLY H 1.0 1.918 4.458 1597 1528 A 64 TYR H A 127 GLN HE2y 1.0 1.906 4.356 1598 1529 A 64 TYR HBy A 65 THR H 1.0 1.875 4.123 1599 1530 A 64 TYR HBx A 65 THR H 1.0 1.916 4.444 1600 1531 A 65 THR H A 65 THR HG1 1.0 1.881 4.165 1601 1532 A 65 THR H A 66 LEU H 1.0 1.912 4.412 1602 1533 A 65 THR HA A 66 LEU H 1.0 1.637 2.955 1603 1534 A 65 THR HG1 A 66 LEU H 1.0 1.948 4.764 1604 1535 A 66 LEU HBy A 66 LEU H 1.0 1.774 3.536 1605 1536 A 66 LEU HBx A 66 LEU H 1.0 1.731 3.337 1606 1537 A 66 LEU H A 89 VAL H 1.0 1.819 3.773 1607 1538 A 66 LEU HG A 67 VAL H 1.0 1.851 3.965 1608 1539 A 67 VAL H A 67 VAL HA 1.0 1.776 3.548 1609 1540 A 67 VAL H A 67 VAL HB 1.0 1.893 4.255 1610 1541 A 67 VAL HA A 68 LEU H 1.0 1.644 2.980 1611 1542 A 68 LEU HBy A 68 LEU H 1.0 1.726 3.310 1612 1543 A 68 LEU HDy% A 69 THR H 1.0 1.834 3.860 1613 1544 A 69 THR H A 69 THR HG2% 1.0 1.740 3.378 1614 1545 A 69 THR H A 121 VAL H 1.0 1.815 3.753 1615 1546 A 69 THR HA A 70 ASP H 1.0 1.793 3.633 1616 1547 A 69 THR HB A 70 ASP H 1.0 1.855 3.995 1617 1548 A 70 ASP HBx A 70 ASP H 1.0 1.952 4.816 1618 1549 A 70 ASP H A 86 HIS H 1.0 1.963 4.943 1619 1550 A 71 PRO HBx A 72 ASP H 1.0 1.877 4.139 1620 1551 A 71 PRO HGy A 72 ASP H 1.0 1.940 4.674 1621 1552 A 72 ASP HA A 72 ASP H 1.0 1.855 3.989 1622 1553 A 72 ASP HBx A 72 ASP H 1.0 1.751 3.423 1623 1554 A 72 ASP HBx A 73 ALA H 1.0 1.966 4.992 1624 1555 A 73 ALA H A 72 ASP H 1.0 1.810 3.722 1625 1556 A 73 ALA H A 73 ALA HA 1.0 1.799 3.665 1626 1557 A 74 PRO HDx A 75 SER H 1.0 1.882 4.182 1627 1558 A 74 PRO HGy A 75 SER H 1.0 1.814 3.748 1628 1559 A 75 SER HA A 75 SER H 1.0 1.668 3.074 1629 1560 A 75 SER HBx A 75 SER H 1.0 1.921 4.489 1630 1561 A 75 SER H A 76 ARG H 1.0 1.952 4.804 1631 1562 A 79 PRO HA A 75 SER H 1.0 1.741 3.379 1632 1563 A 75 SER H A 80 LYS H 1.0 1.931 4.579 1633 1564 A 75 SER HA A 76 ARG H 1.0 1.712 3.254 1634 1565 A 75 SER HBx A 76 ARG H 1.0 1.914 4.428 1635 1566 A 76 ARG HA A 76 ARG H 1.0 1.868 4.080 1636 1567 A 76 ARG H A 76 ARG HBy 1.0 1.825 3.811 1637 1568 A 76 ARG H A 76 ARG HBx 1.0 1.866 4.066 1638 1569 A 75 SER HBx A 77 LYS H 1.0 1.953 4.829 1639 1570 A 76 ARG H A 77 LYS H 1.0 1.799 3.665 1640 1571 A 77 LYS HA A 77 LYS H 1.0 1.611 2.859 1641 1572 A 77 LYS H A 78 ASP H 1.0 1.553 2.667 1642 1573 A 75 SER H A 78 ASP H 1.0 1.912 4.408 1643 1574 A 78 ASP HA A 78 ASP H 1.0 1.724 3.304 1644 1575 A 78 ASP HBy A 78 ASP H 1.0 1.733 3.345 1645 1576 A 78 ASP HBx A 78 ASP H 1.0 1.752 3.428 1646 1577 A 79 PRO HDx A 78 ASP H 1.0 1.861 4.031 1647 1578 A 79 PRO HDy A 78 ASP H 1.0 1.893 4.255 1648 1579 A 79 PRO HA A 80 LYS H 1.0 1.740 3.376 1649 1580 A 79 PRO HBx A 80 LYS H 1.0 1.918 4.460 1650 1581 A 80 LYS HA A 80 LYS H 1.0 1.706 3.228 1651 1582 A 73 ALA HB% A 81 TYR H 1.0 1.795 3.645 1652 1583 A 74 PRO HDy A 81 TYR H 1.0 1.814 3.744 1653 1584 A 74 PRO HDx A 81 TYR H 1.0 1.799 3.667 1654 1585 A 79 PRO HA A 81 TYR H 1.0 1.944 4.718 1655 1586 A 80 LYS HA A 81 TYR H 1.0 1.899 4.303 1656 1587 A 80 LYS H A 81 TYR H 1.0 1.756 3.446 1657 1588 A 81 TYR HA A 81 TYR H 1.0 1.799 3.665 1658 1589 A 81 TYR HBy A 81 TYR H 1.0 1.878 4.144 1659 1590 A 81 TYR HBx A 81 TYR H 1.0 1.798 3.662 1660 1591 A 82 ARG HBx A 81 TYR H 1.0 1.942 4.690 1661 1592 A 79 PRO HA A 82 ARG H 1.0 1.899 4.301 1662 1593 A 81 TYR HA A 82 ARG H 1.0 1.896 4.282 1663 1594 A 81 TYR H A 82 ARG H 1.0 1.656 3.024 1664 1595 A 82 ARG HBy A 82 ARG H 1.0 1.750 3.424 1665 1596 A 82 ARG HBx A 82 ARG H 1.0 1.723 3.297 1666 1597 A 83 GLU H A 83 GLU HA 1.0 1.919 4.465 1667 1598 A 83 GLU H A 83 GLU HBx 1.0 1.765 3.491 1668 1599 A 83 GLU HGx A 83 GLU H 1.0 1.851 3.967 1669 1600 A 148 LYS HA A 83 GLU H 1.0 1.888 4.222 1670 1601 A 83 GLU H A 149 PHE H 1.0 1.856 4.000 1671 1602 A 83 GLU HA A 84 TRP H 1.0 1.793 3.635 1672 1603 A 83 GLU HBx A 84 TRP H 1.0 1.880 4.160 1673 1604 A 84 TRP HA A 84 TRP H 1.0 1.952 4.816 1674 1605 A 84 TRP HBx A 84 TRP H 1.0 1.817 3.761 1675 1606 A 84 TRP HA A 85 HIS H 1.0 1.770 3.518 1676 1607 A 85 HIS HBx A 85 HIS H 1.0 1.938 4.648 1677 1608 A 69 THR HA A 86 HIS H 1.0 1.786 3.596 1678 1609 A 86 HIS HBx A 86 HIS H 1.0 1.880 4.162 1679 1610 A 87 PHE H A 68 LEU H 1.0 1.760 3.470 1680 1611 A 87 PHE H A 86 HIS HBx 1.0 1.869 4.089 1681 1612 A 87 PHE H A 86 HIS H 1.0 1.736 3.358 1682 1613 A 87 PHE H A 87 PHE HA 1.0 1.717 3.277 1683 1614 A 87 PHE H A 87 PHE HBy 1.0 1.856 4.000 1684 1615 A 87 PHE H A 87 PHE HBx 1.0 1.905 4.349 1685 1616 A 88 LEU H A 88 LEU HA 1.0 1.682 3.126 1686 1617 A 88 LEU H A 88 LEU HBy 1.0 1.879 4.151 1687 1618 A 88 LEU H A 88 LEU HBx 1.0 1.867 4.073 1688 1619 A 88 LEU H A 104 SER HBy 1.0 1.903 4.337 1689 1620 A 88 LEU H A 104 SER HBx 1.0 1.884 4.190 1690 1621 A 88 LEU H A 104 SER H 1.0 1.778 3.560 1691 1622 A 67 VAL HGy% A 89 VAL H 1.0 1.786 3.596 1692 1623 A 88 LEU HA A 89 VAL H 1.0 1.615 2.877 1693 1624 A 88 LEU HDx% A 89 VAL H 1.0 1.781 3.571 1694 1624 A 88 LEU HDy% A 89 VAL H 1.0 1.781 3.571 1695 1625 A 89 VAL HA A 89 VAL H 1.0 1.944 4.710 1696 1626 A 89 VAL HB A 89 VAL H 1.0 1.751 3.427 1697 1627 A 89 VAL HA A 90 VAL H 1.0 1.646 2.988 1698 1628 A 90 VAL H A 101 THR HB 1.0 1.822 3.790 1699 1629 A 63 LEU HDx% A 91 ASN H 1.0 1.945 4.729 1700 1629 A 63 LEU HDy% A 91 ASN H 1.0 1.945 4.729 1701 1630 A 65 THR HG1 A 91 ASN H 1.0 1.897 4.287 1702 1631 A 90 VAL HA A 91 ASN H 1.0 1.708 3.236 1703 1632 A 90 VAL HB A 91 ASN H 1.0 1.784 3.588 1704 1633 A 90 VAL HGy% A 91 ASN H 1.0 1.817 3.761 1705 1634 A 91 ASN HA A 91 ASN H 1.0 1.735 3.355 1706 1635 A 63 LEU HA A 92 MET H 1.0 1.825 3.805 1707 1636 A 92 MET HA A 92 MET H 1.0 1.767 3.501 1708 1637 A 92 MET HBy A 92 MET H 1.0 1.713 3.257 1709 1638 A 92 MET HBx A 92 MET H 1.0 1.718 3.278 1710 1639 A 93 LYS H A 92 MET H 1.0 1.902 4.330 1711 1640 A 92 MET HA A 93 LYS H 1.0 1.649 2.997 1712 1641 A 93 LYS H A 93 LYS HBx 1.0 1.698 3.196 1713 1642 A 63 LEU HDx% A 94 GLY H 1.0 1.958 4.886 1714 1642 A 63 LEU HDy% A 94 GLY H 1.0 1.958 4.886 1715 1643 A 64 TYR HEy A 94 GLY H 1.0 1.898 4.298 1716 1644 A 93 LYS HA A 94 GLY H 1.0 1.716 3.270 1717 1645 A 93 LYS HBx A 94 GLY H 1.0 1.918 4.458 1718 1646 A 94 GLY HAy A 94 GLY H 1.0 1.789 3.611 1719 1647 A 94 GLY HAx A 94 GLY H 1.0 1.762 3.482 1720 1648 A 94 GLY H A 95 ASN H 1.0 1.926 4.534 1721 1649 A 58 LEU HDy% A 95 ASN H 1.0 1.812 3.738 1722 1650 A 94 GLY HAy A 95 ASN H 1.0 1.633 2.939 1723 1651 A 94 GLY HAx A 95 ASN H 1.0 1.682 3.128 1724 1652 A 95 ASN HA A 95 ASN H 1.0 1.827 3.817 1725 1653 A 95 ASN HBx A 95 ASN H 1.0 1.936 4.636 1726 1654 A 96 ASP H A 95 ASN H 1.0 1.494 2.480 1727 1655 A 96 ASP H A 96 ASP HA 1.0 1.654 3.018 1728 1656 A 96 ASP H A 96 ASP HBy 1.0 1.685 3.139 1729 1657 A 96 ASP H A 96 ASP HBx 1.0 1.710 3.244 1730 1658 A 96 ASP HA A 97 ILE H 1.0 1.632 2.938 1731 1659 A 96 ASP H A 97 ILE H 1.0 1.870 4.094 1732 1660 A 97 ILE HA A 97 ILE H 1.0 1.775 3.537 1733 1661 A 97 ILE HD1% A 97 ILE H 1.0 1.841 3.901 1734 1662 A 97 ILE HG1x A 97 ILE H 1.0 1.702 3.210 1735 1663 A 97 ILE H A 98 SER H 1.0 1.743 3.389 1736 1664 A 96 ASP HA A 98 SER H 1.0 1.766 3.498 1737 1665 A 97 ILE HA A 98 SER H 1.0 1.843 3.919 1738 1666 A 97 ILE HB A 98 SER H 1.0 1.697 3.189 1739 1667 A 97 ILE HG1x A 98 SER H 1.0 1.824 3.798 1740 1668 A 98 SER H A 98 SER HA 1.0 1.642 2.972 1741 1669 A 98 SER H A 98 SER HBx 1.0 1.543 2.633 1742 1670 A 98 SER H A 99 SER H 1.0 1.584 2.768 1743 1671 A 98 SER HBx A 99 SER H 1.0 1.683 3.133 1744 1672 A 99 SER HA A 99 SER H 1.0 1.719 3.285 1745 1673 A 99 SER H A 100 GLY H 1.0 1.603 2.835 1746 1674 A 92 MET HA A 100 GLY H 1.0 1.861 4.031 1747 1675 A 99 SER HBx A 100 GLY H 1.0 1.826 3.816 1748 1676 A 100 GLY HAy A 100 GLY H 1.0 1.703 3.215 1749 1677 A 100 GLY HAx A 100 GLY H 1.0 1.699 3.197 1750 1678 A 100 GLY H A 101 THR H 1.0 1.880 4.156 1751 1679 A 89 VAL HGx% A 101 THR H 1.0 1.747 3.411 1752 1680 A 90 VAL H A 101 THR H 1.0 1.834 3.866 1753 1681 A 100 GLY HAy A 101 THR H 1.0 1.720 3.286 1754 1682 A 100 GLY HAx A 101 THR H 1.0 1.744 3.392 1755 1683 A 101 THR HB A 101 THR H 1.0 1.670 3.084 1756 1684 A 101 THR H A 102 VAL H 1.0 1.886 4.200 1757 1685 A 101 THR HA A 102 VAL H 1.0 1.549 2.653 1758 1686 A 102 VAL HA A 102 VAL H 1.0 1.864 4.050 1759 1687 A 102 VAL HB A 102 VAL H 1.0 1.705 3.221 1760 1688 A 102 VAL HGx% A 102 VAL H 1.0 1.610 2.858 1761 1689 A 89 VAL HA A 103 LEU H 1.0 1.866 4.064 1762 1690 A 102 VAL HA A 103 LEU H 1.0 1.724 3.306 1763 1691 A 102 VAL HGy% A 103 LEU H 1.0 1.786 3.598 1764 1692 A 103 LEU HA A 103 LEU H 1.0 1.912 4.408 1765 1693 A 103 LEU HBy A 103 LEU H 1.0 1.902 4.328 1766 1694 A 88 LEU HBy A 104 SER H 1.0 1.785 3.593 1767 1695 A 88 LEU HBx A 104 SER H 1.0 1.798 3.664 1768 1696 A 88 LEU HDx% A 104 SER H 1.0 1.964 4.968 1769 1696 A 88 LEU HDy% A 104 SER H 1.0 1.964 4.968 1770 1697 A 102 VAL HA A 104 SER H 1.0 1.891 4.245 1771 1698 A 102 VAL HGy% A 104 SER H 1.0 1.768 3.510 1772 1699 A 103 LEU HBx A 104 SER H 1.0 1.865 4.059 1773 1700 A 104 SER H A 103 LEU H 1.0 1.619 2.887 1774 1701 A 104 SER HA A 104 SER H 1.0 1.869 4.083 1775 1702 A 104 SER HBy A 104 SER H 1.0 1.971 5.067 1776 1703 A 105 ASP HA A 104 SER H 1.0 1.913 4.417 1777 1704 A 102 VAL HGy% A 105 ASP H 1.0 1.863 4.041 1778 1705 A 104 SER HA A 105 ASP H 1.0 1.716 3.270 1779 1706 A 104 SER H A 105 ASP H 1.0 1.854 3.982 1780 1707 A 105 ASP HA A 105 ASP H 1.0 1.748 3.412 1781 1708 A 105 ASP HBy A 105 ASP H 1.0 1.764 3.486 1782 1709 A 105 ASP HBx A 105 ASP H 1.0 1.809 3.721 1783 1710 A 138 LEU HBx A 105 ASP H 1.0 1.878 4.146 1784 1711 A 102 VAL HGy% A 106 TYR H 1.0 1.886 4.204 1785 1712 A 105 ASP HA A 106 TYR H 1.0 1.762 3.480 1786 1713 A 106 TYR HA A 106 TYR H 1.0 1.858 4.014 1787 1714 A 106 TYR HBy A 106 TYR H 1.0 1.804 3.690 1788 1715 A 106 TYR HBx A 106 TYR H 1.0 1.839 3.893 1789 1716 A 106 TYR HA A 107 VAL H 1.0 1.651 3.009 1790 1717 A 107 VAL HB A 107 VAL H 1.0 1.795 3.643 1791 1718 A 107 VAL HGy% A 107 VAL H 1.0 1.866 4.060 1792 1719 A 108 GLY HAx A 108 GLY H 1.0 1.797 3.651 1793 1720 A 108 GLY H A 109 SER H 1.0 1.920 4.480 1794 1721 A 46 VAL HGy% A 109 SER H 1.0 1.871 4.097 1795 1722 A 108 GLY HAy A 109 SER H 1.0 1.852 3.974 1796 1723 A 108 GLY HAx A 109 SER H 1.0 1.846 3.930 1797 1724 A 109 SER HBy A 109 SER H 1.0 1.945 4.727 1798 1725 A 109 SER HBx A 109 SER H 1.0 1.894 4.264 1799 1726 A 109 SER HA A 110 GLY H 1.0 1.819 3.773 1800 1727 A 110 GLY HAy A 110 GLY H 1.0 1.967 4.995 1801 1728 A 112 PRO HA A 113 LYS H 1.0 1.722 3.296 1802 1729 A 112 PRO HBx A 113 LYS H 1.0 1.919 4.469 1803 1730 A 113 LYS HA A 113 LYS H 1.0 1.871 4.091 1804 1731 A 113 LYS HBy A 113 LYS H 1.0 1.805 3.693 1805 1732 A 113 LYS HBx A 113 LYS H 1.0 1.817 3.761 1806 1733 A 113 LYS HA A 114 GLY H 1.0 1.674 3.098 1807 1734 A 113 LYS HBy A 114 GLY H 1.0 1.950 4.782 1808 1735 A 113 LYS HDy A 114 GLY H 1.0 1.880 4.158 1809 1736 A 113 LYS HDx A 114 GLY H 1.0 1.901 4.323 1810 1737 A 114 GLY HAy A 114 GLY H 1.0 1.758 3.460 1811 1738 A 114 GLY HAx A 114 GLY H 1.0 1.727 3.319 1812 1739 A 114 GLY H A 115 THR H 1.0 1.776 3.542 1813 1740 A 114 GLY H A 116 GLY H 1.0 1.952 4.808 1814 1741 A 173 TRP HBx A 114 GLY H 1.0 1.903 4.339 1815 1742 A 113 LYS HA A 115 THR H 1.0 1.952 4.804 1816 1743 A 114 GLY HAx A 115 THR H 1.0 1.858 4.014 1817 1744 A 115 THR HA A 115 THR H 1.0 1.808 3.716 1818 1745 A 115 THR H A 115 THR HG1 1.0 1.829 3.831 1819 1746 A 115 THR HG2% A 115 THR H 1.0 1.752 3.430 1820 1747 A 115 THR HA A 116 GLY H 1.0 1.882 4.174 1821 1748 A 116 GLY H A 115 THR HG1 1.0 1.889 4.227 1822 1749 A 115 THR H A 116 GLY H 1.0 1.648 2.996 1823 1750 A 116 GLY HAy A 116 GLY H 1.0 1.629 2.929 1824 1751 A 116 GLY HAx A 116 GLY H 1.0 1.617 2.883 1825 1752 A 116 GLY HAy A 117 LEU H 1.0 1.647 2.995 1826 1753 A 116 GLY HAx A 117 LEU H 1.0 1.673 3.093 1827 1754 A 117 LEU HBx A 117 LEU H 1.0 1.785 3.589 1828 1755 A 117 LEU HDy% A 117 LEU H 1.0 1.729 3.327 1829 1755 A 117 LEU HDx% A 117 LEU H 1.0 1.729 3.327 1830 1756 A 117 LEU HA A 118 HIS H 1.0 1.715 3.267 1831 1757 A 117 LEU HBy A 118 HIS H 1.0 1.811 3.733 1832 1758 A 117 LEU HBx A 118 HIS H 1.0 1.920 4.476 1833 1759 A 117 LEU HDy% A 118 HIS H 1.0 1.845 3.931 1834 1759 A 117 LEU HDx% A 118 HIS H 1.0 1.845 3.931 1835 1760 A 118 HIS H A 118 HIS HBy 1.0 1.944 4.718 1836 1761 A 70 ASP HBx A 119 ARG H 1.0 1.943 4.705 1837 1762 A 72 ASP HBx A 119 ARG H 1.0 1.885 4.197 1838 1763 A 119 ARG H A 118 HIS HA 1.0 1.805 3.697 1839 1764 A 119 ARG HA A 119 ARG H 1.0 1.956 4.860 1840 1765 A 119 ARG HBy A 119 ARG H 1.0 1.853 3.973 1841 1766 A 119 ARG HBx A 119 ARG H 1.0 1.881 4.167 1842 1767 A 119 ARG HA A 120 TYR H 1.0 1.731 3.335 1843 1768 A 119 ARG HBx A 120 TYR H 1.0 1.891 4.241 1844 1769 A 119 ARG H A 120 TYR H 1.0 1.852 3.976 1845 1770 A 120 TYR HA A 120 TYR H 1.0 1.950 4.778 1846 1771 A 120 TYR HBx A 120 TYR H 1.0 1.859 4.019 1847 1772 A 170 GLN HA A 120 TYR H 1.0 1.841 3.903 1848 1773 A 69 THR HG2% A 121 VAL H 1.0 1.854 3.986 1849 1774 A 120 TYR HA A 121 VAL H 1.0 1.682 3.126 1850 1775 A 120 TYR HBy A 121 VAL H 1.0 1.921 4.493 1851 1776 A 121 VAL HB A 121 VAL H 1.0 1.810 3.728 1852 1777 A 121 VAL HA A 122 TRP H 1.0 1.693 3.173 1853 1778 A 67 VAL H A 123 LEU H 1.0 1.788 3.606 1854 1779 A 68 LEU HA A 123 LEU H 1.0 1.917 4.455 1855 1780 A 122 TRP HBy A 123 LEU H 1.0 1.949 4.771 1856 1781 A 123 LEU H A 123 LEU HA 1.0 1.937 4.637 1857 1782 A 123 LEU H A 123 LEU HBy 1.0 1.844 3.920 1858 1783 A 123 LEU HA A 124 VAL H 1.0 1.683 3.135 1859 1784 A 123 LEU HBy A 124 VAL H 1.0 1.906 4.354 1860 1785 A 124 VAL H A 165 ALA H 1.0 1.825 3.813 1861 1786 A 65 THR HB A 125 TYR H 1.0 1.937 4.649 1862 1787 A 65 THR H A 125 TYR H 1.0 1.788 3.610 1863 1788 A 124 VAL HA A 125 TYR H 1.0 1.687 3.145 1864 1789 A 124 VAL HB A 125 TYR H 1.0 1.932 4.592 1865 1790 A 124 VAL HGy% A 125 TYR H 1.0 1.825 3.805 1866 1791 A 125 TYR H A 125 TYR HBy 1.0 1.961 4.919 1867 1792 A 125 TYR HBx A 125 TYR H 1.0 1.901 4.313 1868 1793 A 125 TYR HA A 126 GLU H 1.0 1.655 3.023 1869 1794 A 125 TYR HBy A 126 GLU H 1.0 1.949 4.773 1870 1795 A 164 VAL HGy% A 126 GLU H 1.0 1.793 3.635 1871 1796 A 164 VAL H A 126 GLU H 1.0 1.878 4.146 1872 1797 A 64 TYR HA A 127 GLN H 1.0 1.859 4.015 1873 1798 A 126 GLU HA A 127 GLN H 1.0 1.655 3.021 1874 1799 A 127 GLN HBx A 127 GLN H 1.0 1.874 4.122 1875 1800 A 127 GLN HA A 128 ASP H 1.0 1.634 2.944 1876 1801 A 127 GLN HBy A 128 ASP H 1.0 1.811 3.727 1877 1802 A 127 GLN HBx A 128 ASP H 1.0 1.878 4.148 1878 1803 A 128 ASP HA A 128 ASP H 1.0 1.729 3.327 1879 1804 A 128 ASP HBy A 128 ASP H 1.0 1.787 3.601 1880 1805 A 128 ASP HBx A 128 ASP H 1.0 1.741 3.377 1881 1806 A 128 ASP H A 129 ARG H 1.0 1.578 2.748 1882 1807 A 160 LEU HDx% A 128 ASP H 1.0 1.864 4.052 1883 1808 A 127 GLN HA A 129 ARG H 1.0 1.823 3.797 1884 1809 A 127 GLN HBy A 129 ARG H 1.0 1.748 3.414 1885 1810 A 127 GLN HBx A 129 ARG H 1.0 1.727 3.321 1886 1811 A 127 GLN HE2x A 129 ARG H 1.0 1.877 4.141 1887 1812 A 128 ASP HA A 129 ARG H 1.0 1.735 3.353 1888 1813 A 128 ASP HBx A 129 ARG H 1.0 1.843 3.913 1889 1814 A 129 ARG H A 129 ARG HGy 1.0 1.732 3.340 1890 1815 A 127 GLN HE2x A 131 LEU H 1.0 1.877 4.141 1891 1816 A 130 PRO HA A 131 LEU H 1.0 1.702 3.214 1892 1817 A 130 PRO HBx A 131 LEU H 1.0 1.794 3.638 1893 1818 A 131 LEU HA A 131 LEU H 1.0 1.940 4.676 1894 1819 A 131 LEU HBx A 131 LEU H 1.0 1.880 4.162 1895 1820 A 131 LEU HDx% A 131 LEU H 1.0 1.895 4.269 1896 1821 A 131 LEU HDy% A 131 LEU H 1.0 1.902 4.322 1897 1822 A 131 LEU HA A 132 LYS H 1.0 1.488 2.464 1898 1823 A 131 LEU HBx A 132 LYS H 1.0 1.852 3.974 1899 1824 A 131 LEU HDx% A 132 LYS H 1.0 1.818 3.770 1900 1825 A 132 LYS HA A 133 CYS H 1.0 1.466 2.400 1901 1826 A 133 CYS H A 132 LYS HDx 1.0 1.830 3.834 1902 1827 A 132 LYS HGy A 133 CYS H 1.0 1.916 4.448 1903 1828 A 133 CYS HA A 133 CYS H 1.0 1.865 4.059 1904 1829 A 133 CYS HBy A 133 CYS H 1.0 1.831 3.841 1905 1830 A 133 CYS HBy A 134 ASP H 1.0 1.894 4.258 1906 1831 A 134 ASP HBy A 134 ASP H 1.0 1.869 4.083 1907 1832 A 134 ASP HBx A 134 ASP H 1.0 1.815 3.749 1908 1833 A 103 LEU HDx% A 135 GLU H 1.0 1.975 5.121 1909 1834 A 103 LEU HDy% A 135 GLU H 1.0 1.931 4.583 1910 1835 A 133 CYS HBy A 135 GLU H 1.0 1.835 3.869 1911 1836 A 134 ASP H A 135 GLU H 1.0 1.677 3.105 1912 1837 A 135 GLU HA A 135 GLU H 1.0 1.798 3.660 1913 1838 A 135 GLU HBx A 135 GLU H 1.0 1.690 3.160 1914 1839 A 135 GLU HGx A 135 GLU H 1.0 1.806 3.700 1915 1840 A 136 PRO HA A 137 ILE H 1.0 1.511 2.531 1916 1841 A 137 ILE HA A 137 ILE H 1.0 1.773 3.531 1917 1842 A 137 ILE HB A 137 ILE H 1.0 1.576 2.740 1918 1843 A 137 ILE HD1% A 137 ILE H 1.0 1.682 3.128 1919 1844 A 137 ILE HG1x A 137 ILE H 1.0 1.572 2.726 1920 1845 A 104 SER HA A 138 LEU H 1.0 1.914 4.432 1921 1846 A 137 ILE HA A 138 LEU H 1.0 1.623 2.905 1922 1847 A 137 ILE HG2% A 138 LEU H 1.0 1.729 3.329 1923 1848 A 137 ILE H A 138 LEU H 1.0 1.955 4.839 1924 1849 A 138 LEU HBx A 138 LEU H 1.0 1.763 3.485 1925 1850 A 138 LEU HBx A 139 SER H 1.0 1.777 3.551 1926 1851 A 139 SER HBy A 139 SER H 1.0 1.789 3.611 1927 1852 A 105 ASP HBy A 140 ASN H 1.0 1.929 4.567 1928 1853 A 105 ASP HBx A 140 ASN H 1.0 1.910 4.394 1929 1854 A 140 ASN HA A 140 ASN H 1.0 1.838 3.884 1930 1855 A 140 ASN HBy A 140 ASN H 1.0 1.960 4.920 1931 1856 A 140 ASN HBx A 140 ASN H 1.0 1.915 4.443 1932 1857 A 140 ASN H A 141 ARG H 1.0 1.671 3.083 1933 1858 A 139 SER HBy A 141 ARG H 1.0 1.823 3.799 1934 1859 A 139 SER HBx A 141 ARG H 1.0 1.855 3.993 1935 1860 A 140 ASN HA A 141 ARG H 1.0 1.885 4.197 1936 1861 A 141 ARG HA A 141 ARG H 1.0 1.739 3.369 1937 1862 A 141 ARG HBy A 141 ARG H 1.0 1.838 3.882 1938 1863 A 141 ARG HBx A 141 ARG H 1.0 1.720 3.284 1939 1864 A 141 ARG HDx A 141 ARG H 1.0 1.960 4.908 1940 1865 A 141 ARG HA A 142 SER H 1.0 1.733 3.343 1941 1866 A 142 SER HA A 142 SER H 1.0 1.758 3.460 1942 1867 A 184 LEU HBx A 142 SER H 1.0 1.885 4.193 1943 1868 A 184 LEU HDy% A 142 SER H 1.0 1.805 3.697 1944 1868 A 184 LEU HDx% A 142 SER H 1.0 1.805 3.697 1945 1869 A 142 SER HA A 143 GLY H 1.0 1.626 2.914 1946 1870 A 142 SER HBx A 143 GLY H 1.0 1.962 4.934 1947 1871 A 142 SER H A 143 GLY H 1.0 1.962 4.940 1948 1872 A 143 GLY HAy A 143 GLY H 1.0 1.759 3.463 1949 1873 A 143 GLY HAx A 143 GLY H 1.0 1.632 2.936 1950 1874 A 184 LEU HDx% A 143 GLY H 1.0 1.919 4.473 1951 1874 A 184 LEU HDy% A 143 GLY H 1.0 1.919 4.473 1952 1875 A 143 GLY HAx A 144 ASP H 1.0 1.761 3.477 1953 1876 A 143 GLY H A 144 ASP H 1.0 1.655 3.023 1954 1877 A 144 ASP HA A 144 ASP H 1.0 1.634 2.944 1955 1878 A 144 ASP HBy A 144 ASP H 1.0 1.613 2.871 1956 1879 A 144 ASP HBy A 145 HIS H 1.0 1.927 4.553 1957 1880 A 144 ASP HBx A 145 HIS H 1.0 1.837 3.881 1958 1881 A 144 ASP H A 145 HIS H 1.0 1.837 3.879 1959 1882 A 145 HIS HBy A 145 HIS H 1.0 1.840 3.896 1960 1883 A 145 HIS HA A 146 ARG H 1.0 1.750 3.422 1961 1884 A 145 HIS H A 146 ARG H 1.0 1.745 3.401 1962 1885 A 146 ARG HA A 146 ARG H 1.0 1.808 3.712 1963 1886 A 146 ARG HBy A 146 ARG H 1.0 1.768 3.508 1964 1887 A 146 ARG HBx A 146 ARG H 1.0 1.872 4.108 1965 1888 A 146 ARG H A 147 GLY H 1.0 1.646 2.988 1966 1889 A 84 TRP HD1 A 147 GLY H 1.0 1.919 4.469 1967 1890 A 146 ARG HBy A 147 GLY H 1.0 1.920 4.480 1968 1891 A 147 GLY HAy A 147 GLY H 1.0 1.804 3.692 1969 1892 A 147 GLY HAx A 147 GLY H 1.0 1.725 3.309 1970 1893 A 84 TRP HA A 148 LYS H 1.0 1.895 4.269 1971 1894 A 147 GLY HAy A 148 LYS H 1.0 1.869 4.083 1972 1895 A 147 GLY HAx A 148 LYS H 1.0 1.796 3.648 1973 1896 A 148 LYS HA A 148 LYS H 1.0 1.670 3.082 1974 1897 A 148 LYS HBx A 148 LYS H 1.0 1.846 3.934 1975 1898 A 148 LYS HGx A 148 LYS H 1.0 1.889 4.227 1976 1899 A 148 LYS HA A 149 PHE H 1.0 1.806 3.704 1977 1900 A 148 LYS HBx A 149 PHE H 1.0 1.913 4.417 1978 1901 A 149 PHE H A 148 LYS H 1.0 1.770 3.520 1979 1902 A 149 PHE HA A 149 PHE H 1.0 1.842 3.912 1980 1903 A 149 PHE HBy A 149 PHE H 1.0 1.779 3.563 1981 1904 A 149 PHE HBx A 149 PHE H 1.0 1.765 3.491 1982 1905 A 149 PHE HA A 150 LYS H 1.0 1.517 2.553 1983 1906 A 149 PHE HBy A 150 LYS H 1.0 1.897 4.293 1984 1907 A 150 LYS HA A 150 LYS H 1.0 1.844 3.922 1985 1908 A 150 LYS HBx A 150 LYS H 1.0 1.690 3.160 1986 1909 A 153 SER HBx A 150 LYS H 1.0 1.928 4.546 1987 1910 A 150 LYS HA A 151 VAL H 1.0 1.767 3.503 1988 1911 A 151 VAL HA A 151 VAL H 1.0 1.887 4.211 1989 1912 A 151 VAL HB A 151 VAL H 1.0 1.869 4.087 1990 1913 A 151 VAL HGy% A 151 VAL H 1.0 1.757 3.455 1991 1914 A 151 VAL H A 152 ALA H 1.0 1.889 4.225 1992 1915 A 151 VAL H A 153 SER H 1.0 1.891 4.243 1993 1916 A 151 VAL HA A 152 ALA H 1.0 1.937 4.643 1994 1917 A 152 ALA HA A 152 ALA H 1.0 1.905 4.345 1995 1918 A 152 ALA HB% A 152 ALA H 1.0 1.674 3.094 1996 1919 A 152 ALA H A 153 SER H 1.0 1.774 3.540 1997 1920 A 150 LYS HBx A 153 SER H 1.0 1.657 3.029 1998 1921 A 152 ALA HB% A 153 SER H 1.0 1.679 3.115 1999 1922 A 153 SER HA A 153 SER H 1.0 1.731 3.335 2000 1923 A 153 SER HBx A 153 SER H 1.0 1.594 2.804 2001 1924 A 154 PHE HBx A 153 SER H 1.0 1.962 4.932 2002 1925 A 153 SER HA A 154 PHE H 1.0 1.859 4.015 2003 1926 A 153 SER HBx A 154 PHE H 1.0 1.631 2.931 2004 1927 A 153 SER H A 154 PHE H 1.0 1.631 2.933 2005 1928 A 154 PHE HBx A 154 PHE H 1.0 1.648 2.998 2006 1929 A 154 PHE H A 155 ARG H 1.0 1.816 3.756 2007 1930 A 153 SER HA A 155 ARG H 1.0 1.935 4.629 2008 1931 A 154 PHE HBx A 155 ARG H 1.0 1.802 3.680 2009 1932 A 155 ARG HBy A 155 ARG H 1.0 1.849 3.951 2010 1933 A 155 ARG H A 155 ARG HGx 1.0 1.927 4.547 2011 1934 A 153 SER H A 155 ARG H 1.0 1.925 4.529 2012 1935 A 156 LYS H A 153 SER HA 1.0 1.852 3.974 2013 1936 A 156 LYS H A 155 ARG HGx 1.0 1.914 4.422 2014 1937 A 156 LYS H A 155 ARG H 1.0 1.863 4.041 2015 1938 A 156 LYS H A 156 LYS HBx 1.0 1.679 3.117 2016 1939 A 156 LYS H A 156 LYS HEx 1.0 1.911 4.399 2017 1940 A 154 PHE HA A 157 LYS H 1.0 1.871 4.093 2018 1941 A 156 LYS H A 157 LYS H 1.0 1.711 3.249 2019 1942 A 157 LYS HA A 157 LYS H 1.0 1.733 3.343 2020 1943 A 157 LYS HBy A 157 LYS H 1.0 1.645 2.983 2021 1944 A 157 LYS HBx A 157 LYS H 1.0 1.661 3.043 2022 1945 A 157 LYS H A 158 TYR H 1.0 1.714 3.260 2023 1946 A 157 LYS HA A 158 TYR H 1.0 1.807 3.705 2024 1947 A 157 LYS HGy A 158 TYR H 1.0 1.956 4.868 2025 1948 A 158 TYR HA A 158 TYR H 1.0 1.795 3.643 2026 1949 A 158 TYR HBy A 158 TYR H 1.0 1.830 3.836 2027 1950 A 158 TYR HBx A 158 TYR H 1.0 1.657 3.033 2028 1951 A 157 LYS HBy A 159 GLU H 1.0 1.921 4.489 2029 1952 A 159 GLU H A 158 TYR HA 1.0 1.870 4.086 2030 1953 A 159 GLU H A 158 TYR H 1.0 1.692 3.168 2031 1954 A 159 GLU H A 159 GLU HA 1.0 1.574 2.732 2032 1955 A 156 LYS HA A 160 LEU H 1.0 1.907 4.365 2033 1956 A 158 TYR H A 160 LEU H 1.0 1.899 4.303 2034 1957 A 159 GLU HA A 160 LEU H 1.0 1.750 3.424 2035 1958 A 159 GLU HBx A 160 LEU H 1.0 1.882 4.170 2036 1959 A 159 GLU H A 160 LEU H 1.0 1.688 3.154 2037 1960 A 160 LEU HA A 160 LEU H 1.0 1.888 4.226 2038 1961 A 160 LEU HDx% A 160 LEU H 1.0 1.850 3.960 2039 1962 A 160 LEU HDy% A 160 LEU H 1.0 1.909 4.383 2040 1963 A 160 LEU HA A 161 ARG H 1.0 1.709 3.241 2041 1964 A 161 ARG HA A 161 ARG H 1.0 1.876 4.134 2042 1965 A 161 ARG HBy A 162 ALA H 1.0 1.643 2.979 2043 1966 A 161 ARG HDx A 162 ALA H 1.0 1.935 4.621 2044 1967 A 161 ARG H A 162 ALA H 1.0 1.954 4.838 2045 1968 A 162 ALA HA A 162 ALA H 1.0 1.607 2.847 2046 1969 A 164 VAL H A 163 PRO HA 1.0 1.702 3.208 2047 1970 A 164 VAL HA A 164 VAL H 1.0 1.890 4.232 2048 1971 A 163 PRO HA A 165 ALA H 1.0 1.883 4.177 2049 1972 A 164 VAL HA A 165 ALA H 1.0 1.924 4.516 2050 1973 A 164 VAL H A 165 ALA H 1.0 1.682 3.128 2051 1974 A 165 ALA HA A 165 ALA H 1.0 1.951 4.789 2052 1975 A 165 ALA HB% A 165 ALA H 1.0 1.856 3.998 2053 1976 A 21 PRO HGx A 166 GLY H 1.0 1.817 3.767 2054 1977 A 24 PRO HA A 166 GLY H 1.0 1.863 4.043 2055 1978 A 166 GLY H A 25 LEU HBy 1.0 1.840 3.894 2056 1979 A 166 GLY H A 165 ALA HA 1.0 1.779 3.563 2057 1980 A 165 ALA HB% A 166 GLY H 1.0 1.829 3.835 2058 1981 A 166 GLY H A 166 GLY HAy 1.0 1.915 4.437 2059 1982 A 166 GLY H A 166 GLY HAx 1.0 1.902 4.326 2060 1983 A 25 LEU HDy% A 167 THR H 1.0 1.960 4.916 2061 1984 A 122 TRP H A 167 THR H 1.0 1.875 4.127 2062 1985 A 166 GLY HAy A 167 THR H 1.0 1.796 3.648 2063 1986 A 166 GLY HAx A 167 THR H 1.0 1.838 3.882 2064 1987 A 167 THR HA A 167 THR H 1.0 1.822 3.794 2065 1988 A 167 THR HG2% A 167 THR H 1.0 1.809 3.721 2066 1989 A 168 CYS HBx A 168 CYS H 1.0 1.913 4.417 2067 1990 A 168 CYS H A 169 TYR H 1.0 1.927 4.547 2068 1991 A 120 TYR H A 169 TYR H 1.0 1.829 3.831 2069 1992 A 168 CYS HA A 169 TYR H 1.0 1.660 3.040 2070 1993 A 168 CYS HBy A 169 TYR H 1.0 1.892 4.252 2071 1994 A 169 TYR HA A 169 TYR H 1.0 1.880 4.166 2072 1995 A 169 TYR H A 170 GLN HE2x 1.0 1.957 4.875 2073 1996 A 40 VAL HA A 170 GLN H 1.0 1.870 4.096 2074 1997 A 119 ARG HBy A 170 GLN H 1.0 1.901 4.313 2075 1998 A 169 TYR HBx A 170 GLN H 1.0 1.917 4.453 2076 1999 A 170 GLN HBy A 170 GLN H 1.0 1.825 3.805 2077 2000 A 170 GLN H A 170 GLN HBx 1.0 1.902 4.328 2078 2001 A 170 GLN H A 170 GLN HE2x 1.0 1.922 4.498 2079 2002 A 117 LEU HDx% A 171 ALA H 1.0 1.902 4.334 2080 2002 A 117 LEU HDy% A 171 ALA H 1.0 1.902 4.334 2081 2003 A 171 ALA H A 118 HIS H 1.0 1.834 3.860 2082 2004 A 170 GLN HA A 171 ALA H 1.0 1.756 3.452 2083 2005 A 170 GLN HBy A 171 ALA H 1.0 1.868 4.078 2084 2006 A 171 ALA H A 171 ALA HB% 1.0 1.878 4.150 2085 2007 A 117 LEU HDy% A 172 GLU H 1.0 1.865 4.059 2086 2007 A 117 LEU HDx% A 172 GLU H 1.0 1.865 4.059 2087 2008 A 172 GLU H A 171 ALA HB% 1.0 1.797 3.657 2088 2009 A 172 GLU H A 172 GLU HA 1.0 1.873 4.111 2089 2010 A 172 GLU H A 172 GLU HGx 1.0 1.777 3.549 2090 2011 A 172 GLU HBx A 173 TRP H 1.0 1.884 4.192 2091 2012 A 173 TRP H A 172 GLU HGx 1.0 1.870 4.086 2092 2013 A 173 TRP H A 173 TRP HA 1.0 1.897 4.289 2093 2014 A 173 TRP HBx A 173 TRP H 1.0 1.778 3.554 2094 2015 A 173 TRP HA A 174 ASP H 1.0 1.690 3.162 2095 2016 A 174 ASP HA A 174 ASP H 1.0 1.850 3.958 2096 2017 A 175 ASP HA A 175 ASP H 1.0 1.740 3.376 2097 2018 A 175 ASP HBy A 175 ASP H 1.0 1.732 3.342 2098 2019 A 175 ASP HBx A 175 ASP H 1.0 1.746 3.404 2099 2020 A 175 ASP H A 176 TYR H 1.0 1.885 4.197 2100 2021 A 175 ASP HA A 176 TYR H 1.0 1.859 4.015 2101 2022 A 176 TYR HBx A 176 TYR H 1.0 1.722 3.296 2102 2023 A 177 VAL H A 176 TYR H 1.0 1.645 2.987 2103 2024 A 176 TYR HA A 177 VAL H 1.0 1.955 4.845 2104 2025 A 177 VAL H A 178 PRO HDy 1.0 1.817 3.761 2105 2026 A 177 VAL H A 178 PRO HDx 1.0 1.864 4.052 2106 2027 A 178 PRO HGx A 177 VAL H 1.0 1.954 4.826 2107 2028 A 178 PRO HA A 179 LYS H 1.0 1.863 4.043 2108 2029 A 178 PRO HDx A 179 LYS H 1.0 1.937 4.641 2109 2030 A 178 PRO HGx A 179 LYS H 1.0 1.906 4.364 2110 2031 A 179 LYS HA A 179 LYS H 1.0 1.763 3.481 2111 2032 A 179 LYS HBx A 179 LYS H 1.0 1.609 2.851 2112 2033 A 179 LYS HGx A 179 LYS H 1.0 1.759 3.463 2113 2034 A 180 LEU HA A 180 LEU H 1.0 1.759 3.467 2114 2035 A 180 LEU HBy A 180 LEU H 1.0 1.668 3.072 2115 2036 A 180 LEU HBx A 180 LEU H 1.0 1.701 3.207 2116 2037 A 180 LEU HA A 181 TYR H 1.0 1.853 3.977 2117 2038 A 180 LEU HBy A 181 TYR H 1.0 1.804 3.694 2118 2039 A 180 LEU HBx A 181 TYR H 1.0 1.798 3.658 2119 2040 A 180 LEU H A 181 TYR H 1.0 1.730 3.332 2120 2041 A 181 TYR H A 181 TYR HA 1.0 1.741 3.377 2121 2042 A 181 TYR HBy A 181 TYR H 1.0 1.720 3.284 2122 2043 A 181 TYR H A 181 TYR HBx 1.0 1.722 3.298 2123 2044 A 181 TYR H A 182 GLU H 1.0 1.706 3.226 2124 2045 A 181 TYR HBy A 182 GLU H 1.0 1.872 4.102 2125 2046 A 181 TYR HBx A 182 GLU H 1.0 1.905 4.353 2126 2047 A 182 GLU HA A 182 GLU H 1.0 1.624 2.906 2127 2048 A 183 GLN HE2y A 183 GLN HE2x 1.0 1.524 2.574 2128 2049 A 183 GLN HGx A 183 GLN HE2y 1.0 1.769 3.513 2129 2050 A 180 LEU HA A 183 GLN H 1.0 1.786 3.600 2130 2051 A 183 GLN H A 183 GLN HA 1.0 1.654 3.020 2131 2052 A 181 TYR HA A 184 LEU H 1.0 1.718 3.280 2132 2053 A 183 GLN HGx A 184 LEU H 1.0 1.719 3.283 2133 2054 A 184 LEU HA A 184 LEU H 1.0 1.715 3.263 2134 2055 A 184 LEU H A 185 SER H 1.0 1.647 2.991 2135 2056 A 185 SER H A 185 SER HA 1.0 1.647 2.995 2136 2057 A 185 SER HBx A 185 SER H 1.0 1.507 2.523 2137 2058 A 185 SER H A 186 GLY H 1.0 1.536 2.612 2138 2059 A 185 SER HA A 186 GLY H 1.0 1.820 3.780 2139 2060 A 186 GLY HAx A 186 GLY H 1.0 1.499 2.499 2140 2061 A 186 GLY H A 187 LYS H 1.0 1.559 2.683 2141 2062 A 187 LYS HBx A 187 LYS H 1.0 1.601 2.827 stop_ save_ save_spectral_peak_list_1 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_1 _nef_nmr_spectrum.num_dimensions 3 save_