data_nef_c16271_2kie 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_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 87 CYS SG 1 109 CYS SG stop_ 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 GLY . . . 2 A 2 PRO . . . 3 A 3 LEU . . . 4 A 4 GLY . . . 5 A 5 SER . . . 6 A 6 MET . . . 7 A 7 GLU . . . 8 A 8 PRO . . . 9 A 9 PRO . . . 10 A 10 LEU . . . 11 A 11 PRO . . . 12 A 12 VAL . . . 13 A 13 GLY . . . 14 A 14 ALA . . . 15 A 15 GLN . . . 16 A 16 PRO . . . 17 A 17 LEU . . . 18 A 18 ALA . . . 19 A 19 THR . . . 20 A 20 VAL . . . 21 A 21 GLU . . . 22 A 22 GLY . . . 23 A 23 MET . . . 24 A 24 GLU . . . 25 A 25 MET . . . 26 A 26 LYS . . . 27 A 27 GLY . . . 28 A 28 PRO . . . 29 A 29 LEU . . . 30 A 30 ARG . . . 31 A 31 GLU . . . 32 A 32 PRO . . . 33 A 33 CYS . . . 34 A 34 ALA . . . 35 A 35 LEU . . . 36 A 36 THR . . . 37 A 37 LEU . . . 38 A 38 ALA . . . 39 A 39 GLN . . . 40 A 40 ARG . . . 41 A 41 ASN . . . 42 A 42 GLY . . . 43 A 43 GLN . . . 44 A 44 TYR . . . 45 A 45 GLU . . . 46 A 46 LEU . . . 47 A 47 ILE . . . 48 A 48 ILE . . . 49 A 49 GLN . . . 50 A 50 LEU . . . 51 A 51 HIS . . . 52 A 52 GLU . . . 53 A 53 LYS . . . 54 A 54 GLU . . . 55 A 55 GLN . . . 56 A 56 HIS . . . 57 A 57 VAL . . . 58 A 58 GLN . . . 59 A 59 ASP . . . 60 A 60 ILE . . . 61 A 61 ILE . . . 62 A 62 PRO . . . 63 A 63 ILE . . . 64 A 64 ASN . . . 65 A 65 SER . . . 66 A 66 HIS . . . 67 A 67 PHE . . . 68 A 68 ARG . . . 69 A 69 CYS . . . 70 A 70 VAL . . . 71 A 71 GLN . . . 72 A 72 GLU . . . 73 A 73 ALA . . . 74 A 74 GLU . . . 75 A 75 GLU . . . 76 A 76 THR . . . 77 A 77 LEU . . . 78 A 78 LEU . . . 79 A 79 ILE . . . 80 A 80 ASP . . . 81 A 81 ILE . . . 82 A 82 ALA . . . 83 A 83 SER . . . 84 A 84 ASN . . . 85 A 85 SER . . . 86 A 86 GLY . . . 87 A 87 CYS . -HG . 88 A 88 LYS . . . 89 A 89 ILE . . . 90 A 90 ARG . . . 91 A 91 VAL . . . 92 A 92 GLN . . . 93 A 93 GLY . . . 94 A 94 ASP . . . 95 A 95 TRP . . . 96 A 96 ILE . . . 97 A 97 ARG . . . 98 A 98 GLU . . . 99 A 99 ARG . . . 100 A 100 ARG . . . 101 A 101 PHE . . . 102 A 102 GLU . . . 103 A 103 ILE . . . 104 A 104 PRO . . . 105 A 105 ASP . . . 106 A 106 GLU . . . 107 A 107 GLU . . . 108 A 108 HIS . . . 109 A 109 CYS . -HG . 110 A 110 LEU . . . 111 A 111 LYS . . . 112 A 112 PHE . . . 113 A 113 LEU . . . 114 A 114 SER . . . 115 A 115 ALA . . . 116 A 116 VAL . . . 117 A 117 LEU . . . 118 A 118 ALA . . . 119 A 119 ALA . . . 120 A 120 GLN . . . 121 A 121 LYS . . . 122 A 122 ALA . . . 123 A 123 GLN . . . 124 A 124 SER . . . 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 GLY HA2 H 1 3.866 0.002 A 1 GLY HA3 H 1 3.519 0.003 A 1 GLY CA C 13 43.128 0.035 A 2 PRO HA H 1 4.417 0.005 A 2 PRO HB2 H 1 2.262 0.006 A 2 PRO HB3 H 1 1.901 0.003 A 2 PRO HD2 H 1 3.521 0.003 A 2 PRO HD3 H 1 3.521 0.003 A 2 PRO HG2 H 1 1.960 0.009 A 2 PRO HG3 H 1 1.960 0.009 A 2 PRO CA C 13 63.168 0.085 A 2 PRO CB C 13 32.290 0.038 A 2 PRO CD C 13 49.651 0.044 A 2 PRO CG C 13 27.042 0.040 A 3 LEU H H 1 8.514 0.001 A 3 LEU HA H 1 4.268 0.001 A 3 LEU HB2 H 1 1.585 0.003 A 3 LEU HB3 H 1 1.585 0.003 A 3 LEU HD11 H 1 0.824 0.000 A 3 LEU HD12 H 1 0.824 0.000 A 3 LEU HD13 H 1 0.824 0.000 A 3 LEU HD21 H 1 0.861 0.000 A 3 LEU HD22 H 1 0.861 0.000 A 3 LEU HD23 H 1 0.861 0.000 A 3 LEU HG H 1 1.597 0.000 A 3 LEU CA C 13 55.432 0.022 A 3 LEU CB C 13 42.121 0.031 A 3 LEU CD1 C 13 23.422 0.035 A 3 LEU CD2 C 13 24.812 0.004 A 3 LEU CG C 13 27.095 0.017 A 3 LEU N N 15 122.136 0.016 A 4 GLY H H 1 8.379 0.003 A 4 GLY HA2 H 1 3.979 0.003 A 4 GLY HA3 H 1 3.877 0.010 A 4 GLY CA C 13 45.339 0.005 A 4 GLY N N 15 109.871 0.017 A 5 SER H H 1 8.142 0.001 A 5 SER HA H 1 4.385 0.006 A 5 SER HB2 H 1 3.824 0.006 A 5 SER HB3 H 1 3.824 0.006 A 5 SER CA C 13 58.423 0.050 A 5 SER CB C 13 63.868 0.053 A 5 SER N N 15 115.654 0.011 A 6 MET H H 1 8.370 0.002 A 6 MET HA H 1 4.446 0.004 A 6 MET HB2 H 1 2.042 0.007 A 6 MET HB3 H 1 1.921 0.004 A 6 MET HG2 H 1 2.455 0.001 A 6 MET HG3 H 1 2.532 0.004 A 6 MET CA C 13 55.177 0.016 A 6 MET CB C 13 32.910 0.004 A 6 MET CG C 13 31.966 0.022 A 6 MET N N 15 121.793 0.035 A 7 GLU H H 1 8.211 0.003 A 7 GLU HA H 1 4.369 0.001 A 7 GLU HB2 H 1 1.747 0.004 A 7 GLU HB3 H 1 1.897 0.006 A 7 GLU HG2 H 1 2.172 0.011 A 7 GLU HG3 H 1 2.172 0.011 A 7 GLU CA C 13 54.378 0.056 A 7 GLU CB C 13 29.434 0.056 A 7 GLU CG C 13 36.006 0.036 A 7 GLU N N 15 123.061 0.025 A 8 PRO HA H 1 4.556 0.004 A 8 PRO HB2 H 1 2.178 0.004 A 8 PRO HB3 H 1 1.788 0.001 A 8 PRO HD2 H 1 3.680 0.008 A 8 PRO HD3 H 1 3.542 0.004 A 8 PRO HG2 H 1 1.914 0.005 A 8 PRO HG3 H 1 1.856 0.002 A 8 PRO CA C 13 61.397 0.019 A 8 PRO CB C 13 30.808 0.033 A 8 PRO CD C 13 50.455 0.060 A 8 PRO CG C 13 27.350 0.000 A 9 PRO HA H 1 4.394 0.005 A 9 PRO HB2 H 1 2.171 0.004 A 9 PRO HB3 H 1 1.895 0.008 A 9 PRO HD2 H 1 3.544 0.008 A 9 PRO HD3 H 1 3.694 0.013 A 9 PRO HG2 H 1 1.870 0.001 A 9 PRO HG3 H 1 1.870 0.001 A 9 PRO CA C 13 62.542 0.060 A 9 PRO CB C 13 31.874 0.069 A 9 PRO CD C 13 50.296 0.046 A 9 PRO CG C 13 27.025 0.036 A 10 LEU H H 1 8.122 0.008 A 10 LEU HA H 1 4.426 0.004 A 10 LEU HB2 H 1 1.235 0.004 A 10 LEU HB3 H 1 1.587 0.005 A 10 LEU HD11 H 1 0.769 0.006 A 10 LEU HD12 H 1 0.769 0.006 A 10 LEU HD13 H 1 0.769 0.006 A 10 LEU HD21 H 1 0.794 0.003 A 10 LEU HD22 H 1 0.794 0.003 A 10 LEU HD23 H 1 0.794 0.003 A 10 LEU HG H 1 1.705 0.008 A 10 LEU CA C 13 52.939 0.001 A 10 LEU CB C 13 41.823 0.103 A 10 LEU CD1 C 13 23.145 0.064 A 10 LEU CD2 C 13 25.727 0.044 A 10 LEU CG C 13 26.943 0.064 A 10 LEU N N 15 121.191 0.022 A 11 PRO HA H 1 4.325 0.004 A 11 PRO HB2 H 1 1.572 0.004 A 11 PRO HB3 H 1 2.226 0.006 A 11 PRO HD2 H 1 3.221 0.007 A 11 PRO HD3 H 1 3.651 0.022 A 11 PRO HG2 H 1 1.888 0.005 A 11 PRO HG3 H 1 1.780 0.003 A 11 PRO CA C 13 62.707 0.033 A 11 PRO CB C 13 31.882 0.042 A 11 PRO CD C 13 50.159 0.046 A 11 PRO CG C 13 27.698 0.053 A 12 VAL H H 1 8.209 0.003 A 12 VAL HA H 1 3.749 0.006 A 12 VAL HB H 1 1.920 0.004 A 12 VAL HG11 H 1 0.898 0.004 A 12 VAL HG12 H 1 0.898 0.004 A 12 VAL HG13 H 1 0.898 0.004 A 12 VAL HG21 H 1 1.008 0.007 A 12 VAL HG22 H 1 1.008 0.007 A 12 VAL HG23 H 1 1.008 0.007 A 12 VAL CA C 13 64.129 0.049 A 12 VAL CB C 13 31.763 0.058 A 12 VAL CG1 C 13 20.696 0.055 A 12 VAL CG2 C 13 21.490 0.077 A 12 VAL N N 15 122.313 0.024 A 13 GLY H H 1 8.737 0.004 A 13 GLY HA2 H 1 3.668 0.005 A 13 GLY HA3 H 1 4.156 0.006 A 13 GLY CA C 13 44.781 0.025 A 13 GLY N N 15 114.166 0.025 A 14 ALA H H 1 7.916 0.003 A 14 ALA HA H 1 4.426 0.003 A 14 ALA HB1 H 1 1.110 0.003 A 14 ALA HB2 H 1 1.110 0.003 A 14 ALA HB3 H 1 1.110 0.003 A 14 ALA CA C 13 51.578 0.013 A 14 ALA CB C 13 19.559 0.043 A 14 ALA N N 15 122.190 0.017 A 15 GLN H H 1 8.843 0.004 A 15 GLN HA H 1 4.872 0.004 A 15 GLN HB2 H 1 1.997 0.004 A 15 GLN HB3 H 1 2.085 0.005 A 15 GLN HE21 H 1 6.792 0.001 A 15 GLN HE22 H 1 7.334 0.002 A 15 GLN HG2 H 1 2.268 0.005 A 15 GLN HG3 H 1 2.268 0.005 A 15 GLN CA C 13 52.002 0.081 A 15 GLN CB C 13 29.938 0.051 A 15 GLN CG C 13 33.162 0.022 A 15 GLN N N 15 123.058 0.029 A 15 GLN NE2 N 15 111.789 0.138 A 16 PRO HA H 1 4.306 0.003 A 16 PRO HB2 H 1 1.913 0.003 A 16 PRO HB3 H 1 1.913 0.003 A 16 PRO HD2 H 1 3.828 0.002 A 16 PRO HD3 H 1 3.729 0.003 A 16 PRO HG2 H 1 2.207 0.007 A 16 PRO HG3 H 1 2.207 0.007 A 16 PRO CA C 13 62.914 0.051 A 16 PRO CB C 13 32.080 0.046 A 16 PRO CD C 13 50.780 0.000 A 16 PRO CG C 13 27.221 0.025 A 17 LEU H H 1 9.476 0.005 A 17 LEU HA H 1 4.495 0.006 A 17 LEU HB2 H 1 1.536 0.040 A 17 LEU HB3 H 1 1.396 0.005 A 17 LEU HD11 H 1 0.837 0.003 A 17 LEU HD12 H 1 0.837 0.003 A 17 LEU HD13 H 1 0.837 0.003 A 17 LEU HD21 H 1 0.924 0.006 A 17 LEU HD22 H 1 0.924 0.006 A 17 LEU HD23 H 1 0.924 0.006 A 17 LEU HG H 1 1.724 0.004 A 17 LEU CA C 13 55.775 0.059 A 17 LEU CB C 13 43.308 0.024 A 17 LEU CD1 C 13 23.314 0.028 A 17 LEU CD2 C 13 25.608 0.061 A 17 LEU CG C 13 27.785 0.050 A 17 LEU N N 15 124.151 0.027 A 18 ALA H H 1 7.583 0.003 A 18 ALA HA H 1 4.611 0.004 A 18 ALA HB1 H 1 1.393 0.002 A 18 ALA HB2 H 1 1.393 0.002 A 18 ALA HB3 H 1 1.393 0.002 A 18 ALA CA C 13 52.631 0.019 A 18 ALA CB C 13 21.565 0.032 A 18 ALA N N 15 118.780 0.032 A 19 THR H H 1 8.671 0.002 A 19 THR HA H 1 5.679 0.009 A 19 THR HB H 1 3.829 0.005 A 19 THR HG21 H 1 1.041 0.004 A 19 THR HG22 H 1 1.041 0.004 A 19 THR HG23 H 1 1.041 0.004 A 19 THR CA C 13 61.081 0.090 A 19 THR CB C 13 71.721 0.059 A 19 THR CG2 C 13 20.487 0.172 A 19 THR N N 15 118.330 0.028 A 20 VAL H H 1 8.770 0.003 A 20 VAL HA H 1 4.495 0.003 A 20 VAL HB H 1 1.747 0.004 A 20 VAL HG11 H 1 0.356 0.004 A 20 VAL HG12 H 1 0.356 0.004 A 20 VAL HG13 H 1 0.356 0.004 A 20 VAL HG21 H 1 0.306 0.002 A 20 VAL HG22 H 1 0.306 0.002 A 20 VAL HG23 H 1 0.306 0.002 A 20 VAL CA C 13 59.598 0.154 A 20 VAL CB C 13 35.448 0.050 A 20 VAL CG1 C 13 20.313 0.060 A 20 VAL CG2 C 13 21.812 0.062 A 20 VAL N N 15 121.390 0.034 A 21 GLU H H 1 8.147 0.009 A 21 GLU HA H 1 4.858 0.002 A 21 GLU HB2 H 1 2.167 0.001 A 21 GLU HB3 H 1 1.888 0.003 A 21 GLU HG2 H 1 2.295 0.006 A 21 GLU HG3 H 1 2.183 0.011 A 21 GLU CA C 13 55.115 0.092 A 21 GLU CB C 13 31.577 0.131 A 21 GLU CG C 13 36.109 0.144 A 21 GLU N N 15 122.494 0.054 A 22 GLY H H 1 8.585 0.002 A 22 GLY HA2 H 1 3.937 0.006 A 22 GLY HA3 H 1 4.495 0.004 A 22 GLY CA C 13 46.180 0.040 A 22 GLY N N 15 107.556 0.033 A 23 MET H H 1 9.129 0.004 A 23 MET HA H 1 5.351 0.007 A 23 MET HB2 H 1 1.588 0.006 A 23 MET HB3 H 1 1.942 0.006 A 23 MET HE1 H 1 2.000 0.000 A 23 MET HE2 H 1 2.000 0.000 A 23 MET HE3 H 1 2.000 0.000 A 23 MET HG2 H 1 2.554 0.027 A 23 MET HG3 H 1 2.453 0.005 A 23 MET CA C 13 53.678 0.034 A 23 MET CB C 13 36.556 0.064 A 23 MET CE C 13 18.270 0.000 A 23 MET CG C 13 32.435 0.051 A 23 MET N N 15 121.032 0.042 A 24 GLU H H 1 9.942 0.012 A 24 GLU HA H 1 4.489 0.006 A 24 GLU HB2 H 1 1.757 0.004 A 24 GLU HB3 H 1 2.072 0.003 A 24 GLU HG2 H 1 1.847 0.004 A 24 GLU HG3 H 1 1.758 0.002 A 24 GLU CA C 13 56.277 0.012 A 24 GLU CB C 13 29.181 0.020 A 24 GLU CG C 13 36.313 0.023 A 24 GLU N N 15 125.797 0.027 A 25 MET H H 1 8.485 0.006 A 25 MET HA H 1 4.655 0.010 A 25 MET HB2 H 1 2.009 0.022 A 25 MET HB3 H 1 1.812 0.000 A 25 MET HE1 H 1 1.856 0.001 A 25 MET HE2 H 1 1.856 0.001 A 25 MET HE3 H 1 1.856 0.001 A 25 MET HG2 H 1 2.052 0.004 A 25 MET HG3 H 1 2.265 0.005 A 25 MET CA C 13 55.004 0.085 A 25 MET CB C 13 33.381 0.056 A 25 MET CE C 13 17.080 0.045 A 25 MET CG C 13 31.518 0.045 A 25 MET N N 15 125.891 0.028 A 26 LYS H H 1 8.231 0.005 A 26 LYS HA H 1 4.589 0.005 A 26 LYS HB2 H 1 1.689 0.006 A 26 LYS HB3 H 1 1.516 0.003 A 26 LYS HD2 H 1 1.543 0.005 A 26 LYS HD3 H 1 1.543 0.005 A 26 LYS HE2 H 1 2.792 0.025 A 26 LYS HE3 H 1 2.729 0.006 A 26 LYS HG2 H 1 1.196 0.003 A 26 LYS HG3 H 1 1.196 0.003 A 26 LYS CA C 13 54.318 0.072 A 26 LYS CB C 13 32.857 0.032 A 26 LYS CD C 13 29.331 0.036 A 26 LYS CE C 13 41.875 0.014 A 26 LYS CG C 13 24.643 0.049 A 26 LYS N N 15 128.274 0.083 A 27 GLY H H 1 8.774 0.005 A 27 GLY HA2 H 1 4.202 0.003 A 27 GLY HA3 H 1 3.535 0.006 A 27 GLY CA C 13 45.058 0.014 A 27 GLY N N 15 118.123 0.078 A 28 PRO HA H 1 4.540 0.007 A 28 PRO HB2 H 1 2.206 0.007 A 28 PRO HB3 H 1 2.033 0.006 A 28 PRO HD2 H 1 3.713 0.006 A 28 PRO HD3 H 1 3.960 0.009 A 28 PRO HG2 H 1 1.875 0.005 A 28 PRO HG3 H 1 2.047 0.006 A 28 PRO CA C 13 63.532 0.033 A 28 PRO CB C 13 32.334 0.087 A 28 PRO CD C 13 50.382 0.089 A 28 PRO CG C 13 26.190 0.039 A 29 LEU H H 1 7.613 0.004 A 29 LEU HA H 1 4.420 0.005 A 29 LEU HB2 H 1 1.903 0.003 A 29 LEU HB3 H 1 1.568 0.003 A 29 LEU HD11 H 1 0.928 0.002 A 29 LEU HD12 H 1 0.928 0.002 A 29 LEU HD13 H 1 0.928 0.002 A 29 LEU HD21 H 1 0.847 0.003 A 29 LEU HD22 H 1 0.847 0.003 A 29 LEU HD23 H 1 0.847 0.003 A 29 LEU HG H 1 1.600 0.004 A 29 LEU CA C 13 54.558 0.049 A 29 LEU CB C 13 42.787 0.071 A 29 LEU CD1 C 13 25.017 0.030 A 29 LEU CD2 C 13 22.757 0.017 A 29 LEU CG C 13 27.300 0.000 A 29 LEU N N 15 120.716 0.028 A 30 ARG H H 1 8.487 0.004 A 30 ARG HA H 1 5.127 0.007 A 30 ARG HB2 H 1 1.558 0.005 A 30 ARG HB3 H 1 1.743 0.004 A 30 ARG HD2 H 1 3.016 0.008 A 30 ARG HD3 H 1 3.100 0.009 A 30 ARG HG2 H 1 1.415 0.003 A 30 ARG HG3 H 1 1.619 0.009 A 30 ARG CA C 13 53.833 0.025 A 30 ARG CB C 13 32.494 0.036 A 30 ARG CD C 13 43.306 0.026 A 30 ARG CG C 13 27.001 0.057 A 30 ARG N N 15 123.346 0.028 A 31 GLU H H 1 8.743 0.006 A 31 GLU HA H 1 5.112 0.004 A 31 GLU HB2 H 1 1.815 0.007 A 31 GLU HB3 H 1 2.053 0.005 A 31 GLU HG2 H 1 2.154 0.001 A 31 GLU HG3 H 1 2.154 0.001 A 31 GLU CA C 13 52.706 0.012 A 31 GLU CB C 13 32.428 0.027 A 31 GLU CG C 13 35.672 0.028 A 31 GLU N N 15 123.481 0.028 A 32 PRO HA H 1 5.049 0.006 A 32 PRO HB2 H 1 2.488 0.007 A 32 PRO HB3 H 1 2.041 0.003 A 32 PRO HD2 H 1 3.954 0.005 A 32 PRO HD3 H 1 3.954 0.005 A 32 PRO HG2 H 1 2.260 0.004 A 32 PRO HG3 H 1 2.014 0.007 A 32 PRO CA C 13 63.888 0.040 A 32 PRO CB C 13 32.810 0.106 A 32 PRO CD C 13 51.339 0.029 A 32 PRO CG C 13 28.011 0.045 A 33 CYS H H 1 8.962 0.012 A 33 CYS HA H 1 5.142 0.008 A 33 CYS HB2 H 1 2.703 0.011 A 33 CYS HB3 H 1 2.910 0.003 A 33 CYS CA C 13 56.019 0.081 A 33 CYS CB C 13 32.292 0.058 A 33 CYS N N 15 118.464 0.055 A 34 ALA H H 1 8.485 0.007 A 34 ALA HA H 1 5.030 0.006 A 34 ALA HB1 H 1 1.260 0.003 A 34 ALA HB2 H 1 1.260 0.003 A 34 ALA HB3 H 1 1.260 0.003 A 34 ALA CA C 13 50.837 0.043 A 34 ALA CB C 13 21.705 0.063 A 34 ALA N N 15 121.415 0.027 A 35 LEU H H 1 8.734 0.004 A 35 LEU HA H 1 4.945 0.009 A 35 LEU HB2 H 1 1.063 0.007 A 35 LEU HB3 H 1 0.902 0.005 A 35 LEU HD11 H 1 0.019 0.005 A 35 LEU HD12 H 1 0.019 0.005 A 35 LEU HD13 H 1 0.019 0.005 A 35 LEU HD21 H 1 -0.177 0.008 A 35 LEU HD22 H 1 -0.177 0.008 A 35 LEU HD23 H 1 -0.177 0.008 A 35 LEU HG H 1 0.931 0.005 A 35 LEU CA C 13 54.210 0.033 A 35 LEU CB C 13 43.796 0.075 A 35 LEU CD1 C 13 24.736 0.041 A 35 LEU CD2 C 13 25.185 0.038 A 35 LEU CG C 13 27.951 0.055 A 35 LEU N N 15 122.352 0.043 A 36 THR H H 1 9.087 0.006 A 36 THR HA H 1 5.372 0.006 A 36 THR HB H 1 3.817 0.004 A 36 THR HG21 H 1 1.106 0.009 A 36 THR HG22 H 1 1.106 0.009 A 36 THR HG23 H 1 1.106 0.009 A 36 THR CA C 13 61.501 0.099 A 36 THR CB C 13 72.170 0.035 A 36 THR CG2 C 13 21.167 0.068 A 36 THR N N 15 117.822 0.023 A 37 LEU H H 1 9.230 0.009 A 37 LEU HA H 1 4.993 0.008 A 37 LEU HB2 H 1 1.775 0.007 A 37 LEU HB3 H 1 1.025 0.004 A 37 LEU HD11 H 1 0.655 0.005 A 37 LEU HD12 H 1 0.655 0.005 A 37 LEU HD13 H 1 0.655 0.005 A 37 LEU HD21 H 1 0.501 0.004 A 37 LEU HD22 H 1 0.501 0.004 A 37 LEU HD23 H 1 0.501 0.004 A 37 LEU HG H 1 1.374 0.005 A 37 LEU CA C 13 53.638 0.045 A 37 LEU CB C 13 43.354 0.061 A 37 LEU CD1 C 13 23.621 0.017 A 37 LEU CD2 C 13 26.503 0.030 A 37 LEU CG C 13 27.607 0.035 A 37 LEU N N 15 129.377 0.028 A 38 ALA H H 1 9.570 0.006 A 38 ALA HA H 1 5.310 0.006 A 38 ALA HB1 H 1 1.092 0.003 A 38 ALA HB2 H 1 1.092 0.003 A 38 ALA HB3 H 1 1.092 0.003 A 38 ALA CA C 13 50.209 0.017 A 38 ALA CB C 13 24.067 0.031 A 38 ALA N N 15 131.095 0.034 A 39 GLN H H 1 8.319 0.006 A 39 GLN HA H 1 4.962 0.004 A 39 GLN HB2 H 1 1.531 0.005 A 39 GLN HB3 H 1 1.825 0.007 A 39 GLN HE21 H 1 6.276 0.003 A 39 GLN HE22 H 1 6.569 0.044 A 39 GLN HG2 H 1 1.531 0.006 A 39 GLN HG3 H 1 1.698 0.006 A 39 GLN CA C 13 54.036 0.024 A 39 GLN CB C 13 31.835 0.043 A 39 GLN CG C 13 33.840 0.040 A 39 GLN N N 15 118.695 0.020 A 39 GLN NE2 N 15 109.456 0.052 A 40 ARG H H 1 8.951 0.007 A 40 ARG HA H 1 4.388 0.006 A 40 ARG HB2 H 1 1.636 0.006 A 40 ARG HB3 H 1 1.229 0.008 A 40 ARG HD2 H 1 3.250 0.004 A 40 ARG HD3 H 1 2.638 0.006 A 40 ARG HE H 1 9.581 0.003 A 40 ARG HG2 H 1 1.219 0.008 A 40 ARG HG3 H 1 1.113 0.010 A 40 ARG CA C 13 56.180 0.003 A 40 ARG CB C 13 33.826 0.029 A 40 ARG CD C 13 43.483 0.045 A 40 ARG CG C 13 27.534 0.065 A 40 ARG N N 15 126.821 0.037 A 40 ARG NE N 15 119.278 0.000 A 41 ASN H H 1 9.638 0.007 A 41 ASN HA H 1 4.299 0.005 A 41 ASN HB2 H 1 2.719 0.003 A 41 ASN HB3 H 1 2.976 0.002 A 41 ASN HD21 H 1 6.813 0.006 A 41 ASN HD22 H 1 7.703 0.003 A 41 ASN CA C 13 54.361 0.058 A 41 ASN CB C 13 37.194 0.040 A 41 ASN N N 15 126.842 0.034 A 41 ASN ND2 N 15 113.060 0.248 A 42 GLY H H 1 8.726 0.009 A 42 GLY HA2 H 1 4.028 0.008 A 42 GLY HA3 H 1 3.391 0.004 A 42 GLY CA C 13 45.397 0.036 A 42 GLY N N 15 103.853 0.038 A 43 GLN H H 1 7.547 0.008 A 43 GLN HA H 1 4.545 0.004 A 43 GLN HB2 H 1 1.917 0.006 A 43 GLN HB3 H 1 2.213 0.016 A 43 GLN HE21 H 1 7.601 0.000 A 43 GLN HE22 H 1 6.805 0.009 A 43 GLN HG2 H 1 2.283 0.010 A 43 GLN HG3 H 1 2.283 0.010 A 43 GLN CA C 13 53.601 0.022 A 43 GLN CB C 13 31.480 0.027 A 43 GLN CG C 13 33.521 0.043 A 43 GLN N N 15 119.239 0.025 A 43 GLN NE2 N 15 112.481 0.033 A 44 TYR H H 1 9.093 0.016 A 44 TYR HA H 1 5.310 0.006 A 44 TYR HB2 H 1 2.623 0.008 A 44 TYR HB3 H 1 2.623 0.008 A 44 TYR HD1 H 1 6.921 0.005 A 44 TYR HD2 H 1 6.921 0.005 A 44 TYR HE1 H 1 6.632 0.007 A 44 TYR HE2 H 1 6.632 0.007 A 44 TYR CA C 13 57.839 0.055 A 44 TYR CB C 13 40.598 0.037 A 44 TYR CD1 C 13 132.983 0.072 A 44 TYR CE1 C 13 118.176 0.007 A 44 TYR N N 15 121.010 0.061 A 45 GLU H H 1 9.155 0.003 A 45 GLU HA H 1 4.678 0.008 A 45 GLU HB2 H 1 1.556 0.006 A 45 GLU HB3 H 1 1.822 0.009 A 45 GLU HG2 H 1 1.839 0.005 A 45 GLU HG3 H 1 1.839 0.005 A 45 GLU CA C 13 54.569 0.025 A 45 GLU CB C 13 33.570 0.032 A 45 GLU CG C 13 34.578 0.027 A 45 GLU N N 15 119.701 0.035 A 46 LEU H H 1 9.019 0.009 A 46 LEU HA H 1 5.142 0.004 A 46 LEU HB2 H 1 1.094 0.005 A 46 LEU HB3 H 1 1.915 0.004 A 46 LEU HD11 H 1 0.915 0.004 A 46 LEU HD12 H 1 0.915 0.004 A 46 LEU HD13 H 1 0.915 0.004 A 46 LEU HD21 H 1 0.929 0.004 A 46 LEU HD22 H 1 0.929 0.004 A 46 LEU HD23 H 1 0.929 0.004 A 46 LEU HG H 1 1.431 0.004 A 46 LEU CA C 13 53.002 0.090 A 46 LEU CB C 13 44.752 0.066 A 46 LEU CD1 C 13 24.272 0.031 A 46 LEU CD2 C 13 26.612 0.042 A 46 LEU CG C 13 27.570 0.094 A 46 LEU N N 15 122.715 0.024 A 47 ILE H H 1 9.563 0.006 A 47 ILE HA H 1 4.765 0.007 A 47 ILE HB H 1 1.660 0.006 A 47 ILE HD11 H 1 0.685 0.006 A 47 ILE HD12 H 1 0.685 0.006 A 47 ILE HD13 H 1 0.685 0.006 A 47 ILE HG12 H 1 0.897 0.001 A 47 ILE HG13 H 1 1.446 0.003 A 47 ILE HG21 H 1 0.674 0.004 A 47 ILE HG22 H 1 0.674 0.004 A 47 ILE HG23 H 1 0.674 0.004 A 47 ILE CA C 13 60.557 0.099 A 47 ILE CB C 13 39.671 0.092 A 47 ILE CD1 C 13 14.456 0.085 A 47 ILE CG1 C 13 28.209 0.060 A 47 ILE CG2 C 13 17.787 0.048 A 47 ILE N N 15 126.751 0.035 A 48 ILE H H 1 9.148 0.008 A 48 ILE HA H 1 4.598 0.004 A 48 ILE HB H 1 1.868 0.003 A 48 ILE HD11 H 1 0.679 0.002 A 48 ILE HD12 H 1 0.679 0.002 A 48 ILE HD13 H 1 0.679 0.002 A 48 ILE HG12 H 1 0.844 0.003 A 48 ILE HG13 H 1 1.377 0.002 A 48 ILE HG21 H 1 0.791 0.003 A 48 ILE HG22 H 1 0.791 0.003 A 48 ILE HG23 H 1 0.791 0.003 A 48 ILE CA C 13 60.445 0.058 A 48 ILE CB C 13 39.440 0.052 A 48 ILE CD1 C 13 13.948 0.044 A 48 ILE CG1 C 13 27.161 0.047 A 48 ILE CG2 C 13 18.058 0.040 A 48 ILE N N 15 128.456 0.053 A 49 GLN H H 1 8.873 0.004 A 49 GLN HA H 1 4.974 0.008 A 49 GLN HB2 H 1 1.896 0.002 A 49 GLN HB3 H 1 1.896 0.002 A 49 GLN HE21 H 1 7.638 0.006 A 49 GLN HE22 H 1 6.742 0.006 A 49 GLN HG2 H 1 2.005 0.006 A 49 GLN HG3 H 1 2.210 0.004 A 49 GLN CA C 13 54.098 0.046 A 49 GLN CB C 13 31.882 0.005 A 49 GLN CG C 13 34.046 0.034 A 49 GLN N N 15 127.024 0.037 A 49 GLN NE2 N 15 112.576 0.052 A 50 LEU H H 1 8.794 0.005 A 50 LEU HA H 1 4.546 0.011 A 50 LEU HB2 H 1 1.725 0.003 A 50 LEU HB3 H 1 1.599 0.008 A 50 LEU HD11 H 1 0.874 0.003 A 50 LEU HD12 H 1 0.874 0.003 A 50 LEU HD13 H 1 0.874 0.003 A 50 LEU HD21 H 1 0.882 0.006 A 50 LEU HD22 H 1 0.882 0.006 A 50 LEU HD23 H 1 0.882 0.006 A 50 LEU HG H 1 1.600 0.006 A 50 LEU CA C 13 55.034 0.034 A 50 LEU CB C 13 43.069 0.036 A 50 LEU CD1 C 13 24.176 0.051 A 50 LEU CD2 C 13 25.150 0.038 A 50 LEU CG C 13 28.065 0.058 A 50 LEU N N 15 127.206 0.024 A 51 HIS H H 1 8.312 0.005 A 51 HIS HA H 1 4.947 0.004 A 51 HIS HB2 H 1 2.959 0.009 A 51 HIS HB3 H 1 3.180 0.010 A 51 HIS HD2 H 1 6.847 0.005 A 51 HIS HE1 H 1 8.213 0.005 A 51 HIS CA C 13 55.280 0.056 A 51 HIS CB C 13 30.241 0.046 A 51 HIS CD2 C 13 119.318 0.020 A 51 HIS CE1 C 13 137.479 0.028 A 51 HIS N N 15 121.293 0.032 A 52 GLU H H 1 8.540 0.004 A 52 GLU HA H 1 4.313 0.005 A 52 GLU HB2 H 1 1.981 0.000 A 52 GLU HB3 H 1 1.981 0.000 A 52 GLU HG2 H 1 2.161 0.000 A 52 GLU HG3 H 1 2.161 0.000 A 52 GLU CA C 13 56.302 0.009 A 52 GLU CB C 13 30.175 0.034 A 52 GLU CG C 13 36.436 0.000 A 52 GLU N N 15 120.311 0.049 A 53 LYS H H 1 8.234 0.004 A 53 LYS HA H 1 4.147 0.002 A 53 LYS HB2 H 1 1.829 0.005 A 53 LYS HB3 H 1 1.829 0.005 A 53 LYS HD2 H 1 1.662 0.005 A 53 LYS HD3 H 1 1.662 0.005 A 53 LYS HE2 H 1 2.972 0.001 A 53 LYS HE3 H 1 2.972 0.001 A 53 LYS HG2 H 1 1.415 0.001 A 53 LYS HG3 H 1 1.415 0.001 A 53 LYS CA C 13 56.877 0.023 A 53 LYS CB C 13 32.725 0.039 A 53 LYS CD C 13 28.920 0.080 A 53 LYS CE C 13 42.249 0.000 A 53 LYS CG C 13 25.010 0.057 A 53 LYS N N 15 120.916 0.021 A 54 GLU H H 1 8.465 0.002 A 54 GLU HA H 1 4.127 0.006 A 54 GLU HB2 H 1 2.082 0.003 A 54 GLU HB3 H 1 1.944 0.004 A 54 GLU HG2 H 1 2.177 0.005 A 54 GLU HG3 H 1 2.222 0.004 A 54 GLU CA C 13 57.184 0.025 A 54 GLU CB C 13 29.614 0.031 A 54 GLU CG C 13 36.490 0.062 A 54 GLU N N 15 117.859 0.052 A 55 GLN H H 1 7.997 0.005 A 55 GLN HA H 1 4.330 0.011 A 55 GLN HB2 H 1 2.051 0.001 A 55 GLN HB3 H 1 1.927 0.005 A 55 GLN HE21 H 1 6.775 0.002 A 55 GLN HE22 H 1 7.508 0.007 A 55 GLN HG2 H 1 2.259 0.004 A 55 GLN HG3 H 1 2.259 0.004 A 55 GLN CA C 13 55.520 0.045 A 55 GLN CB C 13 30.068 0.068 A 55 GLN CG C 13 33.681 0.021 A 55 GLN N N 15 118.109 0.025 A 55 GLN NE2 N 15 112.151 0.039 A 56 HIS H H 1 8.491 0.007 A 56 HIS HA H 1 4.797 0.001 A 56 HIS HB2 H 1 3.039 0.004 A 56 HIS HB3 H 1 3.109 0.004 A 56 HIS HD2 H 1 7.010 0.005 A 56 HIS CA C 13 55.959 0.078 A 56 HIS CB C 13 30.374 0.082 A 56 HIS CD2 C 13 119.651 0.089 A 56 HIS N N 15 120.426 0.099 A 57 VAL H H 1 8.258 0.008 A 57 VAL HA H 1 4.129 0.008 A 57 VAL HB H 1 2.002 0.006 A 57 VAL HG11 H 1 0.844 0.003 A 57 VAL HG12 H 1 0.844 0.003 A 57 VAL HG13 H 1 0.844 0.003 A 57 VAL HG21 H 1 0.877 0.004 A 57 VAL HG22 H 1 0.877 0.004 A 57 VAL HG23 H 1 0.877 0.004 A 57 VAL CA C 13 62.239 0.053 A 57 VAL CB C 13 33.765 0.058 A 57 VAL CG1 C 13 20.579 0.091 A 57 VAL CG2 C 13 21.304 0.085 A 57 VAL N N 15 122.212 0.028 A 58 GLN H H 1 8.513 0.005 A 58 GLN HA H 1 4.908 0.005 A 58 GLN HB2 H 1 1.893 0.010 A 58 GLN HB3 H 1 1.893 0.010 A 58 GLN HE21 H 1 6.651 0.006 A 58 GLN HE22 H 1 7.429 0.001 A 58 GLN HG2 H 1 2.082 0.004 A 58 GLN HG3 H 1 1.948 0.010 A 58 GLN CA C 13 54.994 0.067 A 58 GLN CB C 13 31.467 0.123 A 58 GLN CG C 13 34.833 0.013 A 58 GLN N N 15 124.879 0.050 A 58 GLN NE2 N 15 109.952 0.057 A 59 ASP H H 1 8.683 0.008 A 59 ASP HA H 1 4.971 0.006 A 59 ASP HB2 H 1 2.433 0.006 A 59 ASP HB3 H 1 2.680 0.011 A 59 ASP CA C 13 53.644 0.056 A 59 ASP CB C 13 43.734 0.029 A 59 ASP N N 15 124.794 0.030 A 60 ILE H H 1 8.297 0.006 A 60 ILE HA H 1 4.636 0.004 A 60 ILE HB H 1 1.659 0.005 A 60 ILE HD11 H 1 0.737 0.006 A 60 ILE HD12 H 1 0.737 0.006 A 60 ILE HD13 H 1 0.737 0.006 A 60 ILE HG12 H 1 0.825 0.007 A 60 ILE HG13 H 1 1.461 0.004 A 60 ILE HG21 H 1 0.583 0.004 A 60 ILE HG22 H 1 0.583 0.004 A 60 ILE HG23 H 1 0.583 0.004 A 60 ILE CA C 13 61.006 0.092 A 60 ILE CB C 13 39.718 0.065 A 60 ILE CD1 C 13 13.710 0.038 A 60 ILE CG1 C 13 27.721 0.043 A 60 ILE CG2 C 13 17.967 0.040 A 60 ILE N N 15 121.515 0.032 A 61 ILE H H 1 9.531 0.003 A 61 ILE HA H 1 4.796 0.001 A 61 ILE HB H 1 1.978 0.003 A 61 ILE HD11 H 1 0.745 0.004 A 61 ILE HD12 H 1 0.745 0.004 A 61 ILE HD13 H 1 0.745 0.004 A 61 ILE HG12 H 1 1.444 0.008 A 61 ILE HG13 H 1 1.135 0.003 A 61 ILE HG21 H 1 1.079 0.006 A 61 ILE HG22 H 1 1.079 0.006 A 61 ILE HG23 H 1 1.079 0.006 A 61 ILE CA C 13 57.783 0.062 A 61 ILE CB C 13 40.942 0.066 A 61 ILE CD1 C 13 14.370 0.029 A 61 ILE CG2 C 13 17.690 0.016 A 61 ILE N N 15 129.728 0.050 A 62 PRO HA H 1 4.373 0.011 A 62 PRO HB2 H 1 1.841 0.007 A 62 PRO HB3 H 1 2.380 0.009 A 62 PRO HD2 H 1 3.947 0.004 A 62 PRO HD3 H 1 3.947 0.004 A 62 PRO HG2 H 1 2.103 0.005 A 62 PRO HG3 H 1 2.258 0.011 A 62 PRO CA C 13 63.023 0.037 A 62 PRO CB C 13 32.271 0.065 A 62 PRO CD C 13 51.254 0.061 A 62 PRO CG C 13 27.454 0.165 A 63 ILE H H 1 8.010 0.005 A 63 ILE HA H 1 3.422 0.009 A 63 ILE HB H 1 1.413 0.005 A 63 ILE HD11 H 1 0.059 0.005 A 63 ILE HD12 H 1 0.059 0.005 A 63 ILE HD13 H 1 0.059 0.005 A 63 ILE HG12 H 1 0.800 0.007 A 63 ILE HG13 H 1 -0.881 0.009 A 63 ILE HG21 H 1 0.373 0.004 A 63 ILE HG22 H 1 0.373 0.004 A 63 ILE HG23 H 1 0.373 0.004 A 63 ILE CA C 13 61.447 0.087 A 63 ILE CB C 13 35.064 0.095 A 63 ILE CD1 C 13 13.246 0.017 A 63 ILE CG1 C 13 26.214 0.081 A 63 ILE CG2 C 13 16.078 0.048 A 63 ILE N N 15 122.639 0.049 A 64 ASN H H 1 6.821 0.003 A 64 ASN HA H 1 4.954 0.004 A 64 ASN HB2 H 1 3.013 0.005 A 64 ASN HB3 H 1 3.448 0.006 A 64 ASN HD21 H 1 7.664 0.010 A 64 ASN HD22 H 1 7.989 0.007 A 64 ASN CA C 13 51.257 0.043 A 64 ASN CB C 13 38.979 0.009 A 64 ASN N N 15 124.816 0.037 A 64 ASN ND2 N 15 115.035 0.053 A 65 SER HA H 1 4.282 0.005 A 65 SER HB2 H 1 3.920 0.004 A 65 SER HB3 H 1 3.920 0.004 A 65 SER CA C 13 61.429 0.036 A 65 SER CB C 13 62.840 0.002 A 66 HIS H H 1 7.866 0.004 A 66 HIS HA H 1 4.769 0.002 A 66 HIS HB2 H 1 3.236 0.006 A 66 HIS HB3 H 1 3.010 0.003 A 66 HIS HD2 H 1 7.003 0.003 A 66 HIS HE1 H 1 8.093 0.006 A 66 HIS CA C 13 54.237 0.040 A 66 HIS CB C 13 29.577 0.092 A 66 HIS CD2 C 13 119.053 0.031 A 66 HIS CE1 C 13 138.137 0.062 A 66 HIS N N 15 118.374 0.044 A 67 PHE H H 1 7.686 0.003 A 67 PHE HA H 1 5.023 0.007 A 67 PHE HB2 H 1 3.325 0.005 A 67 PHE HB3 H 1 3.449 0.003 A 67 PHE HD1 H 1 7.115 0.005 A 67 PHE HD2 H 1 7.115 0.005 A 67 PHE HE1 H 1 6.918 0.003 A 67 PHE HE2 H 1 6.918 0.003 A 67 PHE HZ H 1 6.829 0.003 A 67 PHE CA C 13 58.010 0.062 A 67 PHE CB C 13 41.013 0.042 A 67 PHE CD1 C 13 133.071 0.028 A 67 PHE CE1 C 13 130.810 0.073 A 67 PHE CZ C 13 128.018 0.024 A 67 PHE N N 15 121.803 0.027 A 68 ARG H H 1 8.206 0.004 A 68 ARG HA H 1 4.331 0.009 A 68 ARG HB2 H 1 1.490 0.005 A 68 ARG HB3 H 1 1.490 0.005 A 68 ARG HD2 H 1 3.148 0.006 A 68 ARG HD3 H 1 2.999 0.008 A 68 ARG HG2 H 1 1.414 0.004 A 68 ARG HG3 H 1 1.414 0.004 A 68 ARG CA C 13 54.592 0.012 A 68 ARG CB C 13 34.246 0.029 A 68 ARG CD C 13 43.264 0.043 A 68 ARG CG C 13 26.854 0.084 A 68 ARG N N 15 127.396 0.030 A 69 CYS H H 1 8.413 0.006 A 69 CYS HA H 1 5.110 0.004 A 69 CYS HB2 H 1 2.471 0.013 A 69 CYS HB3 H 1 2.676 0.006 A 69 CYS CA C 13 57.849 0.112 A 69 CYS CB C 13 28.023 0.028 A 69 CYS N N 15 123.291 0.032 A 70 VAL H H 1 8.667 0.004 A 70 VAL HA H 1 4.586 0.003 A 70 VAL HB H 1 2.006 0.005 A 70 VAL HG11 H 1 0.789 0.001 A 70 VAL HG12 H 1 0.789 0.001 A 70 VAL HG13 H 1 0.789 0.001 A 70 VAL HG21 H 1 0.854 0.007 A 70 VAL HG22 H 1 0.854 0.007 A 70 VAL HG23 H 1 0.854 0.007 A 70 VAL CA C 13 59.611 0.089 A 70 VAL CB C 13 36.020 0.050 A 70 VAL CG1 C 13 19.609 0.034 A 70 VAL CG2 C 13 21.197 0.048 A 70 VAL N N 15 123.316 0.028 A 71 GLN H H 1 8.816 0.010 A 71 GLN HA H 1 4.812 0.005 A 71 GLN HB2 H 1 1.869 0.005 A 71 GLN HB3 H 1 2.016 0.008 A 71 GLN HE21 H 1 6.741 0.003 A 71 GLN HE22 H 1 7.433 0.003 A 71 GLN HG2 H 1 2.392 0.005 A 71 GLN HG3 H 1 2.392 0.005 A 71 GLN CA C 13 55.446 0.014 A 71 GLN CB C 13 29.154 0.013 A 71 GLN CG C 13 33.955 0.032 A 71 GLN N N 15 124.256 0.040 A 71 GLN NE2 N 15 109.574 0.038 A 72 GLU H H 1 8.721 0.005 A 72 GLU HA H 1 4.216 0.002 A 72 GLU HB2 H 1 1.773 0.005 A 72 GLU HB3 H 1 1.929 0.002 A 72 GLU HG2 H 1 2.066 0.004 A 72 GLU HG3 H 1 2.066 0.004 A 72 GLU CA C 13 56.615 0.080 A 72 GLU CB C 13 30.839 0.028 A 72 GLU CG C 13 36.617 0.005 A 72 GLU N N 15 127.195 0.035 A 73 ALA H H 1 8.463 0.003 A 73 ALA HA H 1 4.386 0.004 A 73 ALA HB1 H 1 1.332 0.004 A 73 ALA HB2 H 1 1.332 0.004 A 73 ALA HB3 H 1 1.332 0.004 A 73 ALA CA C 13 51.936 0.067 A 73 ALA CB C 13 19.603 0.038 A 73 ALA N N 15 126.878 0.038 A 74 GLU H H 1 8.482 0.004 A 74 GLU HA H 1 4.239 0.001 A 74 GLU HB2 H 1 2.016 0.006 A 74 GLU HB3 H 1 1.887 0.003 A 74 GLU HG2 H 1 2.220 0.004 A 74 GLU HG3 H 1 2.220 0.004 A 74 GLU C C 13 176.580 0.000 A 74 GLU CA C 13 56.487 0.043 A 74 GLU CB C 13 30.428 0.148 A 74 GLU CG C 13 36.264 0.057 A 74 GLU N N 15 121.327 0.019 A 75 GLU H H 1 8.624 0.003 A 75 GLU HA H 1 4.254 0.007 A 75 GLU HB2 H 1 2.021 0.006 A 75 GLU HB3 H 1 1.904 0.002 A 75 GLU HG2 H 1 2.225 0.009 A 75 GLU HG3 H 1 2.225 0.009 A 75 GLU C C 13 176.582 0.000 A 75 GLU CA C 13 56.817 0.046 A 75 GLU CB C 13 30.283 0.019 A 75 GLU CG C 13 36.321 0.017 A 75 GLU N N 15 122.708 0.016 A 76 THR H H 1 8.106 0.003 A 76 THR HA H 1 4.239 0.003 A 76 THR HB H 1 4.134 0.001 A 76 THR HG21 H 1 1.142 0.005 A 76 THR HG22 H 1 1.142 0.005 A 76 THR HG23 H 1 1.142 0.005 A 76 THR C C 13 174.224 0.000 A 76 THR CA C 13 62.157 0.082 A 76 THR CB C 13 69.603 0.024 A 76 THR CG2 C 13 21.550 0.105 A 76 THR N N 15 115.188 0.015 A 77 LEU H H 1 8.211 0.005 A 77 LEU HA H 1 4.275 0.002 A 77 LEU HB2 H 1 1.542 0.004 A 77 LEU HB3 H 1 1.622 0.000 A 77 LEU HD11 H 1 0.812 0.000 A 77 LEU HD12 H 1 0.812 0.000 A 77 LEU HD13 H 1 0.812 0.000 A 77 LEU HD21 H 1 0.868 0.000 A 77 LEU HD22 H 1 0.868 0.000 A 77 LEU HD23 H 1 0.868 0.000 A 77 LEU HG H 1 1.568 0.000 A 77 LEU CA C 13 55.328 0.011 A 77 LEU CB C 13 42.372 0.014 A 77 LEU CD1 C 13 23.504 0.000 A 77 LEU CD2 C 13 24.864 0.000 A 77 LEU CG C 13 27.112 0.000 A 77 LEU N N 15 124.182 0.027 A 78 LEU H H 1 8.113 0.003 A 78 LEU HA H 1 4.317 0.000 A 78 LEU HB2 H 1 1.613 0.001 A 78 LEU HB3 H 1 1.535 0.003 A 78 LEU HD11 H 1 0.822 0.000 A 78 LEU HD12 H 1 0.822 0.000 A 78 LEU HD13 H 1 0.822 0.000 A 78 LEU HD21 H 1 0.873 0.000 A 78 LEU HD22 H 1 0.873 0.000 A 78 LEU HD23 H 1 0.873 0.000 A 78 LEU HG H 1 1.531 0.000 A 78 LEU CA C 13 55.104 0.019 A 78 LEU CB C 13 42.016 0.013 A 78 LEU CD1 C 13 23.355 0.000 A 78 LEU CD2 C 13 24.994 0.000 A 78 LEU CG C 13 27.098 0.000 A 78 LEU N N 15 122.186 0.022 A 79 ILE H H 1 7.809 0.011 A 79 ILE HA H 1 4.097 0.006 A 79 ILE HB H 1 1.814 0.004 A 79 ILE HD11 H 1 0.809 0.003 A 79 ILE HD12 H 1 0.809 0.003 A 79 ILE HD13 H 1 0.809 0.003 A 79 ILE HG12 H 1 1.112 0.007 A 79 ILE HG13 H 1 1.383 0.004 A 79 ILE HG21 H 1 0.841 0.004 A 79 ILE HG22 H 1 0.841 0.004 A 79 ILE HG23 H 1 0.841 0.004 A 79 ILE CA C 13 61.402 0.060 A 79 ILE CB C 13 38.868 0.131 A 79 ILE CD1 C 13 13.070 0.033 A 79 ILE CG1 C 13 27.198 0.030 A 79 ILE CG2 C 13 17.499 0.025 A 79 ILE N N 15 119.634 0.018 A 80 ASP H H 1 8.231 0.003 A 80 ASP HA H 1 4.572 0.004 A 80 ASP HB2 H 1 2.568 0.007 A 80 ASP HB3 H 1 2.694 0.005 A 80 ASP CA C 13 54.276 0.067 A 80 ASP CB C 13 41.100 0.060 A 80 ASP N N 15 122.552 0.037 A 81 ILE H H 1 7.894 0.005 A 81 ILE HA H 1 4.101 0.003 A 81 ILE HB H 1 1.874 0.004 A 81 ILE HD11 H 1 0.831 0.007 A 81 ILE HD12 H 1 0.831 0.007 A 81 ILE HD13 H 1 0.831 0.007 A 81 ILE HG12 H 1 1.155 0.010 A 81 ILE HG13 H 1 1.392 0.006 A 81 ILE HG21 H 1 0.879 0.004 A 81 ILE HG22 H 1 0.879 0.004 A 81 ILE HG23 H 1 0.879 0.004 A 81 ILE CA C 13 61.656 0.085 A 81 ILE CB C 13 38.849 0.064 A 81 ILE CD1 C 13 13.248 0.023 A 81 ILE CG1 C 13 27.215 0.023 A 81 ILE CG2 C 13 17.558 0.061 A 81 ILE N N 15 120.163 0.025 A 82 ALA H H 1 8.268 0.007 A 82 ALA HA H 1 4.309 0.003 A 82 ALA HB1 H 1 1.368 0.003 A 82 ALA HB2 H 1 1.368 0.003 A 82 ALA HB3 H 1 1.368 0.003 A 82 ALA CA C 13 52.658 0.045 A 82 ALA CB C 13 19.150 0.051 A 82 ALA N N 15 126.176 0.027 A 83 SER H H 1 8.060 0.003 A 83 SER HA H 1 4.396 0.002 A 83 SER HB2 H 1 3.832 0.003 A 83 SER HB3 H 1 3.832 0.003 A 83 SER CA C 13 58.361 0.039 A 83 SER CB C 13 63.839 0.024 A 83 SER N N 15 114.321 0.019 A 84 ASN H H 1 8.376 0.002 A 84 ASN HA H 1 4.775 0.003 A 84 ASN HB2 H 1 2.734 0.004 A 84 ASN HB3 H 1 2.850 0.005 A 84 ASN HD21 H 1 6.907 0.005 A 84 ASN HD22 H 1 7.634 0.003 A 84 ASN CA C 13 53.308 0.058 A 84 ASN CB C 13 39.221 0.025 A 84 ASN N N 15 120.773 0.031 A 84 ASN ND2 N 15 113.051 0.239 A 85 SER H H 1 8.289 0.003 A 85 SER HA H 1 4.501 0.001 A 85 SER HB2 H 1 3.886 0.004 A 85 SER HB3 H 1 3.830 0.001 A 85 SER CA C 13 58.431 0.076 A 85 SER CB C 13 64.271 0.044 A 85 SER N N 15 116.250 0.017 A 86 GLY H H 1 8.450 0.004 A 86 GLY HA2 H 1 4.251 0.006 A 86 GLY HA3 H 1 3.714 0.004 A 86 GLY CA C 13 45.250 0.030 A 86 GLY N N 15 110.181 0.027 A 87 CYS H H 1 8.695 0.004 A 87 CYS HA H 1 4.909 0.003 A 87 CYS HB2 H 1 3.364 0.005 A 87 CYS HB3 H 1 3.168 0.002 A 87 CYS CA C 13 54.731 0.135 A 87 CYS CB C 13 45.521 0.004 A 87 CYS N N 15 118.094 0.025 A 88 LYS H H 1 8.870 0.006 A 88 LYS HA H 1 5.396 0.008 A 88 LYS HB2 H 1 1.704 0.004 A 88 LYS HB3 H 1 1.704 0.004 A 88 LYS HD2 H 1 1.551 0.002 A 88 LYS HD3 H 1 1.551 0.002 A 88 LYS HE2 H 1 2.895 0.018 A 88 LYS HE3 H 1 2.842 0.001 A 88 LYS HG2 H 1 1.475 0.004 A 88 LYS HG3 H 1 1.312 0.007 A 88 LYS CA C 13 55.629 0.091 A 88 LYS CB C 13 34.906 0.042 A 88 LYS CD C 13 29.528 0.072 A 88 LYS CE C 13 42.090 0.000 A 88 LYS CG C 13 25.817 0.121 A 88 LYS N N 15 124.133 0.037 A 89 ILE H H 1 9.132 0.005 A 89 ILE HA H 1 5.353 0.004 A 89 ILE HB H 1 1.722 0.005 A 89 ILE HD11 H 1 0.648 0.003 A 89 ILE HD12 H 1 0.648 0.003 A 89 ILE HD13 H 1 0.648 0.003 A 89 ILE HG12 H 1 1.590 0.004 A 89 ILE HG13 H 1 0.998 0.005 A 89 ILE HG21 H 1 0.802 0.004 A 89 ILE HG22 H 1 0.802 0.004 A 89 ILE HG23 H 1 0.802 0.004 A 89 ILE CA C 13 58.774 0.039 A 89 ILE CB C 13 42.647 0.036 A 89 ILE CD1 C 13 13.011 0.068 A 89 ILE CG1 C 13 26.716 0.040 A 89 ILE CG2 C 13 18.117 0.025 A 89 ILE N N 15 116.289 0.026 A 90 ARG H H 1 9.099 0.006 A 90 ARG HA H 1 5.299 0.005 A 90 ARG HB2 H 1 1.673 0.006 A 90 ARG HB3 H 1 1.673 0.006 A 90 ARG HD2 H 1 3.039 0.006 A 90 ARG HD3 H 1 3.039 0.006 A 90 ARG HE H 1 7.746 0.006 A 90 ARG HG2 H 1 1.465 0.000 A 90 ARG HG3 H 1 1.465 0.000 A 90 ARG CA C 13 54.479 0.028 A 90 ARG CB C 13 33.439 0.084 A 90 ARG CD C 13 43.624 0.005 A 90 ARG CG C 13 27.614 0.016 A 90 ARG N N 15 122.978 0.037 A 90 ARG NE N 15 119.245 0.045 A 91 VAL H H 1 9.316 0.004 A 91 VAL HA H 1 4.857 0.009 A 91 VAL HB H 1 1.888 0.005 A 91 VAL HG11 H 1 0.802 0.002 A 91 VAL HG12 H 1 0.802 0.002 A 91 VAL HG13 H 1 0.802 0.002 A 91 VAL HG21 H 1 0.913 0.002 A 91 VAL HG22 H 1 0.913 0.002 A 91 VAL HG23 H 1 0.913 0.002 A 91 VAL CA C 13 60.581 0.074 A 91 VAL CB C 13 35.419 0.063 A 91 VAL CG1 C 13 21.752 0.014 A 91 VAL CG2 C 13 21.872 0.142 A 91 VAL N N 15 124.286 0.026 A 92 GLN H H 1 8.492 0.007 A 92 GLN HA H 1 4.325 0.004 A 92 GLN HB2 H 1 1.751 0.001 A 92 GLN HB3 H 1 1.909 0.003 A 92 GLN HE21 H 1 6.692 0.002 A 92 GLN HE22 H 1 7.590 0.002 A 92 GLN HG2 H 1 2.231 0.008 A 92 GLN HG3 H 1 2.407 0.003 A 92 GLN CA C 13 54.805 0.034 A 92 GLN CB C 13 33.035 0.013 A 92 GLN CG C 13 33.877 0.032 A 92 GLN N N 15 123.420 0.042 A 92 GLN NE2 N 15 110.815 0.276 A 93 GLY H H 1 7.060 0.003 A 93 GLY HA2 H 1 3.836 0.004 A 93 GLY HA3 H 1 4.009 0.001 A 93 GLY CA C 13 45.079 0.024 A 93 GLY N N 15 105.562 0.029 A 94 ASP H H 1 9.458 0.003 A 94 ASP HA H 1 3.884 0.004 A 94 ASP HB2 H 1 1.982 0.006 A 94 ASP HB3 H 1 0.409 0.005 A 94 ASP CA C 13 48.958 0.049 A 94 ASP CB C 13 38.698 0.035 A 94 ASP N N 15 124.400 0.046 A 95 TRP H H 1 7.911 0.004 A 95 TRP HA H 1 5.178 0.007 A 95 TRP HB2 H 1 3.352 0.005 A 95 TRP HB3 H 1 3.022 0.008 A 95 TRP HD1 H 1 7.267 0.004 A 95 TRP HE1 H 1 10.131 0.003 A 95 TRP HE3 H 1 7.650 0.002 A 95 TRP HH2 H 1 7.199 0.002 A 95 TRP HZ2 H 1 7.454 0.008 A 95 TRP HZ3 H 1 7.088 0.005 A 95 TRP CA C 13 59.743 0.103 A 95 TRP CB C 13 29.066 0.057 A 95 TRP CD1 C 13 127.371 0.057 A 95 TRP CE3 C 13 120.757 0.000 A 95 TRP CH2 C 13 124.713 0.016 A 95 TRP CZ2 C 13 114.605 0.007 A 95 TRP CZ3 C 13 122.511 0.010 A 95 TRP N N 15 128.757 0.029 A 95 TRP NE1 N 15 128.182 0.034 A 96 ILE H H 1 8.626 0.005 A 96 ILE HA H 1 4.753 0.004 A 96 ILE HB H 1 2.175 0.004 A 96 ILE HD11 H 1 0.773 0.003 A 96 ILE HD12 H 1 0.773 0.003 A 96 ILE HD13 H 1 0.773 0.003 A 96 ILE HG12 H 1 1.474 0.001 A 96 ILE HG21 H 1 0.927 0.002 A 96 ILE HG22 H 1 0.927 0.002 A 96 ILE HG23 H 1 0.927 0.002 A 96 ILE CA C 13 59.903 0.036 A 96 ILE CB C 13 41.608 0.022 A 96 ILE CD1 C 13 14.033 0.033 A 96 ILE CG2 C 13 18.585 0.030 A 96 ILE N N 15 115.405 0.039 A 97 ARG H H 1 8.185 0.005 A 97 ARG HA H 1 4.453 0.002 A 97 ARG HB2 H 1 1.752 0.003 A 97 ARG HB3 H 1 1.880 0.003 A 97 ARG HD2 H 1 3.203 0.005 A 97 ARG HD3 H 1 3.203 0.005 A 97 ARG HG2 H 1 1.641 0.012 A 97 ARG HG3 H 1 1.641 0.012 A 97 ARG CA C 13 55.700 0.031 A 97 ARG CB C 13 30.778 0.121 A 97 ARG CD C 13 43.314 0.023 A 97 ARG CG C 13 27.216 0.063 A 97 ARG N N 15 121.228 0.062 A 98 GLU H H 1 8.013 0.004 A 98 GLU HA H 1 4.587 0.001 A 98 GLU HB2 H 1 1.933 0.007 A 98 GLU HB3 H 1 1.933 0.007 A 98 GLU HG2 H 1 2.099 0.014 A 98 GLU HG3 H 1 1.995 0.001 A 98 GLU CA C 13 57.339 0.156 A 98 GLU CB C 13 30.817 0.017 A 98 GLU CG C 13 37.056 0.022 A 98 GLU N N 15 117.732 0.027 A 99 ARG H H 1 8.757 0.003 A 99 ARG HA H 1 4.633 0.006 A 99 ARG HB2 H 1 1.255 0.008 A 99 ARG HB3 H 1 1.846 0.008 A 99 ARG HD2 H 1 3.253 0.011 A 99 ARG HD3 H 1 2.694 0.007 A 99 ARG HE H 1 8.823 0.001 A 99 ARG HG2 H 1 1.869 0.001 A 99 ARG HG3 H 1 1.869 0.001 A 99 ARG CA C 13 54.439 0.024 A 99 ARG CB C 13 36.077 0.086 A 99 ARG CD C 13 44.123 0.000 A 99 ARG CG C 13 26.332 0.042 A 99 ARG N N 15 125.138 0.062 A 99 ARG NE N 15 119.413 0.000 A 100 ARG H H 1 8.567 0.008 A 100 ARG HA H 1 5.279 0.008 A 100 ARG HB2 H 1 1.514 0.009 A 100 ARG HB3 H 1 1.827 0.005 A 100 ARG HD2 H 1 3.050 0.006 A 100 ARG HD3 H 1 3.050 0.006 A 100 ARG HE H 1 8.432 0.002 A 100 ARG HG2 H 1 1.395 0.005 A 100 ARG HG3 H 1 1.500 0.010 A 100 ARG CA C 13 54.588 0.052 A 100 ARG CB C 13 34.788 0.088 A 100 ARG CD C 13 43.582 0.041 A 100 ARG CG C 13 28.140 0.113 A 100 ARG N N 15 122.002 0.023 A 100 ARG NE N 15 120.700 0.000 A 101 PHE H H 1 8.903 0.005 A 101 PHE HA H 1 5.359 0.008 A 101 PHE HB2 H 1 2.438 0.008 A 101 PHE HB3 H 1 2.661 0.008 A 101 PHE HD1 H 1 6.855 0.003 A 101 PHE HD2 H 1 6.855 0.003 A 101 PHE HE1 H 1 7.003 0.008 A 101 PHE HE2 H 1 7.003 0.008 A 101 PHE HZ H 1 6.812 0.003 A 101 PHE CA C 13 56.032 0.063 A 101 PHE CB C 13 42.963 0.056 A 101 PHE CD1 C 13 132.091 0.025 A 101 PHE CE1 C 13 130.735 0.049 A 101 PHE CZ C 13 129.162 0.108 A 101 PHE N N 15 118.420 0.042 A 102 GLU H H 1 9.461 0.004 A 102 GLU HA H 1 5.111 0.007 A 102 GLU HB2 H 1 2.040 0.002 A 102 GLU HB3 H 1 2.040 0.002 A 102 GLU HG2 H 1 1.909 0.009 A 102 GLU HG3 H 1 2.122 0.005 A 102 GLU CA C 13 54.734 0.039 A 102 GLU CB C 13 32.858 0.015 A 102 GLU CG C 13 36.733 0.024 A 102 GLU N N 15 122.522 0.035 A 103 ILE H H 1 8.880 0.005 A 103 ILE HA H 1 4.804 0.004 A 103 ILE HB H 1 2.326 0.004 A 103 ILE HD11 H 1 0.538 0.003 A 103 ILE HD12 H 1 0.538 0.003 A 103 ILE HD13 H 1 0.538 0.003 A 103 ILE HG12 H 1 1.205 0.005 A 103 ILE HG13 H 1 1.004 0.006 A 103 ILE HG21 H 1 0.951 0.006 A 103 ILE HG22 H 1 0.951 0.006 A 103 ILE HG23 H 1 0.951 0.006 A 103 ILE CA C 13 57.520 0.099 A 103 ILE CB C 13 39.126 0.099 A 103 ILE CD1 C 13 12.751 0.014 A 103 ILE CG1 C 13 27.318 0.035 A 103 ILE CG2 C 13 17.882 0.055 A 103 ILE N N 15 127.547 0.052 A 104 PRO HA H 1 4.429 0.011 A 104 PRO HB2 H 1 2.270 0.006 A 104 PRO HB3 H 1 2.035 0.003 A 104 PRO HD2 H 1 3.821 0.009 A 104 PRO HD3 H 1 4.142 0.004 A 104 PRO HG2 H 1 2.046 0.004 A 104 PRO HG3 H 1 1.973 0.006 A 104 PRO CA C 13 65.033 0.042 A 104 PRO CB C 13 32.389 0.051 A 104 PRO CD C 13 51.618 0.062 A 104 PRO CG C 13 27.100 0.000 A 105 ASP H H 1 7.355 0.003 A 105 ASP HA H 1 4.690 0.004 A 105 ASP HB2 H 1 2.416 0.005 A 105 ASP HB3 H 1 2.824 0.008 A 105 ASP CA C 13 53.382 0.036 A 105 ASP CB C 13 42.467 0.020 A 105 ASP N N 15 116.276 0.038 A 106 GLU H H 1 8.994 0.005 A 106 GLU HA H 1 3.823 0.004 A 106 GLU HB2 H 1 2.121 0.008 A 106 GLU HB3 H 1 2.070 0.007 A 106 GLU HG2 H 1 2.272 0.004 A 106 GLU HG3 H 1 2.272 0.004 A 106 GLU CA C 13 60.336 0.093 A 106 GLU CB C 13 30.023 0.054 A 106 GLU CG C 13 36.260 0.027 A 106 GLU N N 15 127.878 0.029 A 107 GLU H H 1 8.416 0.009 A 107 GLU HA H 1 4.026 0.007 A 107 GLU HB2 H 1 2.121 0.005 A 107 GLU HB3 H 1 2.055 0.010 A 107 GLU HG2 H 1 2.306 0.002 A 107 GLU HG3 H 1 2.069 0.007 A 107 GLU CA C 13 59.870 0.097 A 107 GLU CB C 13 29.100 0.001 A 107 GLU CG C 13 36.266 0.008 A 107 GLU N N 15 119.656 0.043 A 108 HIS H H 1 8.337 0.009 A 108 HIS HA H 1 4.397 0.005 A 108 HIS HB2 H 1 3.226 0.005 A 108 HIS HB3 H 1 3.147 0.009 A 108 HIS HD2 H 1 7.114 0.010 A 108 HIS HE1 H 1 7.955 0.004 A 108 HIS CA C 13 58.781 0.124 A 108 HIS CB C 13 29.727 0.021 A 108 HIS CD2 C 13 118.583 0.034 A 108 HIS CE1 C 13 137.681 0.028 A 108 HIS N N 15 118.201 0.033 A 109 CYS H H 1 8.604 0.004 A 109 CYS HA H 1 3.962 0.005 A 109 CYS HB2 H 1 3.311 0.006 A 109 CYS HB3 H 1 3.675 0.008 A 109 CYS CA C 13 60.309 0.078 A 109 CYS CB C 13 43.994 0.026 A 109 CYS N N 15 119.487 0.027 A 110 LEU H H 1 8.428 0.004 A 110 LEU HA H 1 4.053 0.007 A 110 LEU HB2 H 1 1.576 0.002 A 110 LEU HB3 H 1 1.891 0.003 A 110 LEU HD11 H 1 0.883 0.004 A 110 LEU HD12 H 1 0.883 0.004 A 110 LEU HD13 H 1 0.883 0.004 A 110 LEU HD21 H 1 0.918 0.001 A 110 LEU HD22 H 1 0.918 0.001 A 110 LEU HD23 H 1 0.918 0.001 A 110 LEU HG H 1 1.895 0.002 A 110 LEU CA C 13 58.408 0.059 A 110 LEU CB C 13 41.149 0.021 A 110 LEU CD1 C 13 22.754 0.053 A 110 LEU CD2 C 13 24.959 0.061 A 110 LEU CG C 13 27.125 0.041 A 110 LEU N N 15 118.646 0.038 A 111 LYS H H 1 7.939 0.011 A 111 LYS HA H 1 4.055 0.005 A 111 LYS HB2 H 1 1.921 0.007 A 111 LYS HB3 H 1 1.921 0.007 A 111 LYS HD2 H 1 1.682 0.004 A 111 LYS HD3 H 1 1.682 0.004 A 111 LYS HE2 H 1 2.950 0.008 A 111 LYS HE3 H 1 2.950 0.008 A 111 LYS HG2 H 1 1.625 0.005 A 111 LYS HG3 H 1 1.452 0.005 A 111 LYS CA C 13 59.578 0.094 A 111 LYS CB C 13 32.647 0.022 A 111 LYS CD C 13 29.157 0.007 A 111 LYS CE C 13 42.091 0.000 A 111 LYS CG C 13 25.462 0.046 A 111 LYS N N 15 120.116 0.028 A 112 PHE H H 1 8.202 0.004 A 112 PHE HA H 1 3.972 0.009 A 112 PHE HB2 H 1 3.049 0.004 A 112 PHE HB3 H 1 3.135 0.004 A 112 PHE HD1 H 1 6.801 0.007 A 112 PHE HD2 H 1 6.801 0.007 A 112 PHE HE1 H 1 6.840 0.009 A 112 PHE HE2 H 1 6.840 0.009 A 112 PHE HZ H 1 6.665 0.004 A 112 PHE CA C 13 62.090 0.037 A 112 PHE CB C 13 39.900 0.005 A 112 PHE CD1 C 13 131.158 0.083 A 112 PHE CE1 C 13 130.925 0.000 A 112 PHE CZ C 13 129.117 0.043 A 112 PHE N N 15 121.897 0.021 A 113 LEU H H 1 8.771 0.004 A 113 LEU HA H 1 3.744 0.005 A 113 LEU HB2 H 1 1.551 0.011 A 113 LEU HB3 H 1 1.858 0.003 A 113 LEU HD11 H 1 0.836 0.004 A 113 LEU HD12 H 1 0.836 0.004 A 113 LEU HD13 H 1 0.836 0.004 A 113 LEU HD21 H 1 0.859 0.005 A 113 LEU HD22 H 1 0.859 0.005 A 113 LEU HD23 H 1 0.859 0.005 A 113 LEU HG H 1 1.916 0.011 A 113 LEU CA C 13 58.089 0.076 A 113 LEU CB C 13 41.403 0.018 A 113 LEU CD1 C 13 23.520 0.059 A 113 LEU CD2 C 13 25.914 0.043 A 113 LEU CG C 13 27.300 0.010 A 113 LEU N N 15 118.482 0.030 A 114 SER H H 1 8.021 0.005 A 114 SER HA H 1 4.109 0.013 A 114 SER HB2 H 1 3.898 0.002 A 114 SER HB3 H 1 3.960 0.004 A 114 SER CA C 13 61.913 0.104 A 114 SER CB C 13 62.671 0.142 A 114 SER N N 15 113.421 0.046 A 115 ALA H H 1 7.436 0.003 A 115 ALA HA H 1 4.027 0.005 A 115 ALA HB1 H 1 1.211 0.001 A 115 ALA HB2 H 1 1.211 0.001 A 115 ALA HB3 H 1 1.211 0.001 A 115 ALA CA C 13 54.820 0.040 A 115 ALA CB C 13 17.569 0.049 A 115 ALA N N 15 125.386 0.019 A 116 VAL H H 1 8.083 0.010 A 116 VAL HA H 1 3.126 0.004 A 116 VAL HB H 1 1.884 0.008 A 116 VAL HG11 H 1 0.914 0.003 A 116 VAL HG12 H 1 0.914 0.003 A 116 VAL HG13 H 1 0.914 0.003 A 116 VAL HG21 H 1 0.316 0.003 A 116 VAL HG22 H 1 0.316 0.003 A 116 VAL HG23 H 1 0.316 0.003 A 116 VAL CA C 13 66.641 0.033 A 116 VAL CB C 13 31.598 0.054 A 116 VAL CG1 C 13 22.173 0.045 A 116 VAL CG2 C 13 23.291 0.028 A 116 VAL N N 15 120.046 0.027 A 117 LEU H H 1 8.243 0.006 A 117 LEU HA H 1 4.132 0.009 A 117 LEU HB2 H 1 1.602 0.002 A 117 LEU HB3 H 1 1.735 0.005 A 117 LEU HD11 H 1 0.909 0.004 A 117 LEU HD12 H 1 0.909 0.004 A 117 LEU HD13 H 1 0.909 0.004 A 117 LEU HD21 H 1 0.911 0.005 A 117 LEU HD22 H 1 0.911 0.005 A 117 LEU HD23 H 1 0.911 0.005 A 117 LEU HG H 1 1.687 0.001 A 117 LEU CA C 13 57.814 0.038 A 117 LEU CB C 13 41.205 0.015 A 117 LEU CD1 C 13 24.052 0.031 A 117 LEU CD2 C 13 24.082 0.035 A 117 LEU CG C 13 27.255 0.060 A 117 LEU N N 15 120.006 0.017 A 118 ALA H H 1 7.617 0.005 A 118 ALA HA H 1 3.951 0.007 A 118 ALA HB1 H 1 1.344 0.003 A 118 ALA HB2 H 1 1.344 0.003 A 118 ALA HB3 H 1 1.344 0.003 A 118 ALA CA C 13 54.836 0.074 A 118 ALA CB C 13 17.598 0.046 A 118 ALA N N 15 120.681 0.031 A 119 ALA H H 1 7.461 0.004 A 119 ALA HA H 1 3.315 0.007 A 119 ALA HB1 H 1 0.667 0.005 A 119 ALA HB2 H 1 0.667 0.005 A 119 ALA HB3 H 1 0.667 0.005 A 119 ALA CA C 13 54.534 0.054 A 119 ALA CB C 13 17.560 0.060 A 119 ALA N N 15 121.774 0.027 A 120 GLN H H 1 8.024 0.004 A 120 GLN HA H 1 3.699 0.005 A 120 GLN HB2 H 1 2.083 0.007 A 120 GLN HB3 H 1 2.188 0.006 A 120 GLN HE21 H 1 6.924 0.005 A 120 GLN HE22 H 1 7.369 0.006 A 120 GLN HG2 H 1 2.221 0.006 A 120 GLN HG3 H 1 2.396 0.004 A 120 GLN CA C 13 58.985 0.073 A 120 GLN CB C 13 29.628 0.041 A 120 GLN CG C 13 35.087 0.030 A 120 GLN N N 15 116.427 0.027 A 120 GLN NE2 N 15 110.149 0.067 A 121 LYS H H 1 7.901 0.005 A 121 LYS HA H 1 4.066 0.006 A 121 LYS HB2 H 1 1.869 0.009 A 121 LYS HB3 H 1 1.785 0.003 A 121 LYS HD2 H 1 1.618 0.005 A 121 LYS HD3 H 1 1.618 0.005 A 121 LYS HE2 H 1 2.916 0.007 A 121 LYS HE3 H 1 2.916 0.007 A 121 LYS HG2 H 1 1.518 0.008 A 121 LYS HG3 H 1 1.418 0.004 A 121 LYS CA C 13 57.857 0.117 A 121 LYS CB C 13 32.435 0.036 A 121 LYS CD C 13 29.072 0.054 A 121 LYS CE C 13 42.100 0.008 A 121 LYS CG C 13 25.046 0.045 A 121 LYS N N 15 118.637 0.032 A 122 ALA H H 1 7.519 0.004 A 122 ALA HA H 1 4.230 0.005 A 122 ALA HB1 H 1 1.485 0.004 A 122 ALA HB2 H 1 1.485 0.004 A 122 ALA HB3 H 1 1.485 0.004 A 122 ALA CA C 13 53.349 0.066 A 122 ALA CB C 13 18.771 0.037 A 122 ALA N N 15 121.618 0.020 A 123 GLN H H 1 7.702 0.005 A 123 GLN HA H 1 4.453 0.008 A 123 GLN HB2 H 1 2.042 0.004 A 123 GLN HB3 H 1 2.225 0.006 A 123 GLN HE21 H 1 6.942 0.004 A 123 GLN HE22 H 1 7.608 0.003 A 123 GLN HG2 H 1 2.411 0.008 A 123 GLN HG3 H 1 2.502 0.004 A 123 GLN CA C 13 55.458 0.035 A 123 GLN CB C 13 29.622 0.026 A 123 GLN CG C 13 33.950 0.048 A 123 GLN N N 15 117.433 0.022 A 123 GLN NE2 N 15 112.446 0.044 A 124 SER H H 1 7.788 0.002 A 124 SER HA H 1 4.255 0.005 A 124 SER HB2 H 1 3.860 0.003 A 124 SER HB3 H 1 3.860 0.003 A 124 SER CA C 13 60.278 0.031 A 124 SER CB C 13 64.977 0.024 A 124 SER N N 15 122.251 0.018 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 19 THR HA A 19 THR HG21 1.0 0.0 4.12 2 2 A 19 THR HA A 20 VAL HG11 1.0 0.0 5.71 3 2 A 19 THR HA A 20 VAL HG21 1.0 0.0 5.71 4 3 A 19 THR HA A 20 VAL HG11 1.0 0.0 5.71 5 3 A 19 THR HA A 20 VAL HG21 1.0 0.0 5.71 6 4 A 36 THR HB A 47 ILE HB 1.0 0.0 3.80 7 5 A 36 THR HB A 47 ILE HG21 1.0 0.0 4.60 8 6 A 36 THR HB A 47 ILE HD11 1.0 0.0 4.64 9 7 A 19 THR HB A 36 THR HG21 1.0 0.0 3.99 10 8 A 47 ILE HD11 A 11 PRO HD2 1.0 0.0 4.21 11 8 A 47 ILE HD11 A 11 PRO HD3 1.0 0.0 4.21 12 9 A 47 ILE HD11 A 38 ALA H 1.0 0.0 4.99 13 10 A 36 THR HG21 A 17 LEU H 1.0 0.0 5.13 14 11 A 19 THR HA A 36 THR HG21 1.0 0.0 4.99 15 12 A 36 THR HG21 A 16 PRO HG2 1.0 0.0 4.94 16 12 A 36 THR HG21 A 16 PRO HG3 1.0 0.0 4.94 17 13 A 36 THR HG21 A 16 PRO HB2 1.0 0.0 3.49 18 13 A 36 THR HG21 A 16 PRO HB3 1.0 0.0 3.49 19 14 A 36 THR HG21 A 10 LEU HG 1.0 0.0 4.46 20 15 A 47 ILE HD11 A 36 THR HG21 1.0 0.0 4.52 21 16 A 119 ALA HA A 122 ALA HB1 1.0 0.0 3.68 22 17 A 122 ALA HB1 A 121 LYS H 1.0 0.0 4.87 23 18 A 122 ALA HB1 A 119 ALA HB1 1.0 0.0 5.20 24 19 A 122 ALA HB1 A 121 LYS HD2 1.0 0.0 4.93 25 19 A 122 ALA HB1 A 121 LYS HD3 1.0 0.0 4.93 26 20 A 121 LYS HA A 121 LYS HG2 1.0 0.0 4.01 27 20 A 121 LYS HA A 121 LYS HG3 1.0 0.0 4.01 28 21 A 121 LYS HA A 121 LYS HG2 1.0 0.0 4.01 29 21 A 121 LYS HA A 121 LYS HG3 1.0 0.0 4.01 30 22 A 121 LYS HA A 121 LYS HD2 1.0 0.0 4.12 31 22 A 121 LYS HD3 A 121 LYS HA 1.0 0.0 4.12 32 23 A 118 ALA HA A 121 LYS HD2 1.0 0.0 4.34 33 23 A 121 LYS HD3 A 118 ALA HA 1.0 0.0 4.34 34 24 A 121 LYS HD2 A 121 LYS HE2 1.0 0.0 2.96 35 24 A 121 LYS HE3 A 121 LYS HD2 1.0 0.0 2.96 36 24 A 121 LYS HD3 A 121 LYS HE3 1.0 0.0 2.96 37 24 A 121 LYS HD3 A 121 LYS HE2 1.0 0.0 2.96 38 25 A 121 LYS H A 121 LYS HG2 1.0 0.0 4.72 39 25 A 121 LYS H A 121 LYS HG3 1.0 0.0 4.72 40 26 A 121 LYS HE3 A 121 LYS HG2 1.0 0.0 3.97 41 26 A 121 LYS HG3 A 121 LYS HE2 1.0 0.0 3.97 42 26 A 121 LYS HG3 A 121 LYS HE3 1.0 0.0 3.97 43 26 A 121 LYS HE2 A 121 LYS HG2 1.0 0.0 3.97 44 27 A 121 LYS HE2 A 121 LYS HG2 1.0 0.0 3.97 45 27 A 121 LYS HE3 A 121 LYS HG2 1.0 0.0 3.97 46 27 A 121 LYS HG3 A 121 LYS HE2 1.0 0.0 3.97 47 27 A 121 LYS HG3 A 121 LYS HE3 1.0 0.0 3.97 48 28 A 120 GLN HA A 120 GLN HG2 1.0 0.0 3.85 49 28 A 120 GLN HA A 120 GLN HG3 1.0 0.0 3.85 50 29 A 120 GLN HA A 123 GLN HG2 1.0 0.0 4.76 51 29 A 120 GLN HA A 123 GLN HG3 1.0 0.0 4.76 52 30 A 120 GLN HA A 63 ILE HG21 1.0 0.0 3.82 53 31 A 120 GLN H A 120 GLN HB2 1.0 0.0 3.93 54 31 A 120 GLN H A 120 GLN HB3 1.0 0.0 3.93 55 32 A 67 PHE HE% A 120 GLN HG2 1.0 0.0 4.49 56 32 A 120 GLN HG3 A 67 PHE HE% 1.0 0.0 4.49 57 33 A 67 PHE HE% A 120 GLN HG2 1.0 0.0 4.73 58 33 A 120 GLN HG3 A 67 PHE HE% 1.0 0.0 4.73 59 34 A 120 GLN HA A 120 GLN HG2 1.0 0.0 3.85 60 34 A 120 GLN HA A 120 GLN HG3 1.0 0.0 3.85 61 35 A 63 ILE HG21 A 120 GLN HG2 1.0 0.0 4.34 62 35 A 120 GLN HG3 A 63 ILE HG21 1.0 0.0 4.34 63 36 A 119 ALA HB1 A 120 GLN HG2 1.0 0.0 5.21 64 36 A 119 ALA HB1 A 120 GLN HG3 1.0 0.0 5.21 65 37 A 119 ALA HB1 A 120 GLN HG2 1.0 0.0 5.23 66 37 A 119 ALA HB1 A 120 GLN HG3 1.0 0.0 5.23 67 38 A 116 VAL HG11 A 120 GLN HG2 1.0 0.0 4.93 68 38 A 116 VAL HG21 A 120 GLN HG2 1.0 0.0 4.93 69 38 A 120 GLN HG3 A 116 VAL HG11 1.0 0.0 4.93 70 38 A 120 GLN HG3 A 116 VAL HG21 1.0 0.0 4.93 71 39 A 116 VAL HG11 A 120 GLN HG2 1.0 0.0 4.76 72 39 A 116 VAL HG21 A 120 GLN HG2 1.0 0.0 4.76 73 39 A 120 GLN HG3 A 116 VAL HG11 1.0 0.0 4.76 74 39 A 120 GLN HG3 A 116 VAL HG21 1.0 0.0 4.76 75 40 A 47 ILE HG21 A 61 ILE H 1.0 0.0 5.50 76 41 A 119 ALA HB1 A 44 TYR HD% 1.0 0.0 4.12 77 42 A 47 ILE HG21 A 58 GLN HE21 1.0 0.0 5.01 78 43 A 119 ALA HB1 A 44 TYR HB2 1.0 0.0 4.19 79 43 A 119 ALA HB1 A 44 TYR HB3 1.0 0.0 4.19 80 44 A 47 ILE HG21 A 47 ILE HG12 1.0 0.0 3.87 81 44 A 47 ILE HG21 A 47 ILE HG13 1.0 0.0 3.87 82 45 A 47 ILE HG21 A 47 ILE HG12 1.0 0.0 3.87 83 45 A 47 ILE HG21 A 47 ILE HG13 1.0 0.0 3.87 84 46 A 119 ALA HB1 A 63 ILE HG21 1.0 0.0 4.28 85 47 A 119 ALA HB1 A 37 LEU HG 1.0 0.0 5.03 86 48 A 47 ILE HG21 A 49 GLN HG2 1.0 0.0 4.63 87 48 A 47 ILE HG21 A 49 GLN HG3 1.0 0.0 4.63 88 49 A 47 ILE HG21 A 36 THR HG21 1.0 0.0 5.82 89 50 A 47 ILE HG21 A 38 ALA HB1 1.0 0.0 6.41 90 51 A 121 LYS H A 118 ALA HA 1.0 0.0 4.21 91 52 A 118 ALA HA A 121 LYS HB2 1.0 0.0 3.75 92 52 A 118 ALA HA A 121 LYS HB3 1.0 0.0 3.75 93 53 A 122 ALA HB1 A 118 ALA HA 1.0 0.0 4.89 94 54 A 118 ALA HA A 121 LYS HB2 1.0 0.0 4.44 95 54 A 118 ALA HA A 121 LYS HB3 1.0 0.0 4.44 96 55 A 119 ALA HA A 118 ALA HB1 1.0 0.0 4.83 97 56 A 120 GLN H A 118 ALA HB1 1.0 0.0 5.21 98 57 A 121 LYS H A 118 ALA HB1 1.0 0.0 5.32 99 58 A 118 ALA HB1 A 121 LYS HB2 1.0 0.0 4.94 100 58 A 121 LYS HB3 A 118 ALA HB1 1.0 0.0 4.94 101 59 A 118 ALA HB1 A 121 LYS HD2 1.0 0.0 4.41 102 59 A 121 LYS HD3 A 118 ALA HB1 1.0 0.0 4.41 103 60 A 119 ALA HB1 A 118 ALA HB1 1.0 0.0 5.02 104 61 A 117 LEU HA A 120 GLN HB2 1.0 0.0 5.11 105 61 A 120 GLN HB3 A 117 LEU HA 1.0 0.0 5.11 106 62 A 116 VAL H A 117 LEU HB2 1.0 0.0 4.89 107 62 A 116 VAL H A 117 LEU HB3 1.0 0.0 4.89 108 63 A 114 SER HA A 117 LEU HB2 1.0 0.0 4.18 109 63 A 117 LEU HB3 A 114 SER HA 1.0 0.0 4.18 110 64 A 118 ALA H A 117 LEU HB2 1.0 0.0 3.99 111 64 A 117 LEU HB3 A 118 ALA H 1.0 0.0 3.99 112 65 A 118 ALA HB1 A 117 LEU HB2 1.0 0.0 4.64 113 65 A 118 ALA HB1 A 117 LEU HB3 1.0 0.0 4.64 114 66 A 117 LEU HA A 117 LEU HD11 1.0 0.0 4.51 115 66 A 117 LEU HA A 117 LEU HD21 1.0 0.0 4.51 116 67 A 117 LEU HA A 117 LEU HD11 1.0 0.0 4.51 117 67 A 117 LEU HA A 117 LEU HD21 1.0 0.0 4.51 118 68 A 117 LEU H A 117 LEU HD11 1.0 0.0 5.41 119 68 A 117 LEU HD21 A 117 LEU H 1.0 0.0 5.41 120 69 A 117 LEU H A 117 LEU HD11 1.0 0.0 5.41 121 69 A 117 LEU HD21 A 117 LEU H 1.0 0.0 5.41 122 70 A 120 GLN H A 117 LEU HD11 1.0 0.0 6.00 123 70 A 120 GLN H A 117 LEU HD21 1.0 0.0 6.00 124 71 A 120 GLN H A 117 LEU HD11 1.0 0.0 6.00 125 71 A 120 GLN H A 117 LEU HD21 1.0 0.0 6.00 126 72 A 118 ALA H A 116 VAL HA 1.0 0.0 4.67 127 73 A 116 VAL HA A 37 LEU HD11 1.0 0.0 4.72 128 73 A 116 VAL HA A 37 LEU HD21 1.0 0.0 4.72 129 74 A 116 VAL HA A 116 VAL HG11 1.0 0.0 3.69 130 74 A 116 VAL HG21 A 116 VAL HA 1.0 0.0 3.69 131 75 A 116 VAL HA A 37 LEU HD11 1.0 0.0 4.72 132 75 A 116 VAL HA A 37 LEU HD21 1.0 0.0 4.72 133 76 A 119 ALA HB1 A 116 VAL HA 1.0 0.0 3.72 134 77 A 116 VAL HA A 116 VAL HG11 1.0 0.0 3.63 135 77 A 116 VAL HG21 A 116 VAL HA 1.0 0.0 3.63 136 78 A 113 LEU HA A 116 VAL HG11 1.0 0.0 5.38 137 78 A 116 VAL HG21 A 113 LEU HA 1.0 0.0 5.38 138 79 A 37 LEU HD11 A 116 VAL HG11 1.0 0.0 5.08 139 79 A 37 LEU HD21 A 116 VAL HG11 1.0 0.0 5.08 140 79 A 116 VAL HG21 A 37 LEU HD11 1.0 0.0 5.08 141 79 A 116 VAL HG21 A 37 LEU HD21 1.0 0.0 5.08 142 80 A 37 LEU HD11 A 116 VAL HG11 1.0 0.0 5.08 143 80 A 37 LEU HD21 A 116 VAL HG11 1.0 0.0 5.08 144 80 A 116 VAL HG21 A 37 LEU HD11 1.0 0.0 5.08 145 80 A 116 VAL HG21 A 37 LEU HD21 1.0 0.0 5.08 146 81 A 119 ALA HB1 A 116 VAL HG11 1.0 0.0 5.18 147 81 A 119 ALA HB1 A 116 VAL HG21 1.0 0.0 5.18 148 82 A 112 PHE HD% A 116 VAL HG11 1.0 0.0 3.88 149 82 A 116 VAL HG21 A 112 PHE HD% 1.0 0.0 3.88 150 83 A 67 PHE HZ A 116 VAL HG11 1.0 0.0 3.62 151 83 A 116 VAL HG21 A 67 PHE HZ 1.0 0.0 3.62 152 84 A 116 VAL H A 116 VAL HG11 1.0 0.0 4.32 153 84 A 116 VAL HG21 A 116 VAL H 1.0 0.0 4.32 154 85 A 119 ALA HB1 A 116 VAL HG11 1.0 0.0 4.56 155 85 A 119 ALA HB1 A 116 VAL HG21 1.0 0.0 4.56 156 86 A 37 LEU HB3 A 116 VAL HG11 1.0 0.0 4.87 157 86 A 37 LEU HB2 A 116 VAL HG11 1.0 0.0 4.87 158 86 A 116 VAL HG21 A 37 LEU HB2 1.0 0.0 4.87 159 86 A 116 VAL HG21 A 37 LEU HB3 1.0 0.0 4.87 160 87 A 69 CYS HB3 A 91 VAL HG11 1.0 0.0 6.25 161 87 A 69 CYS HB2 A 91 VAL HG11 1.0 0.0 6.25 162 87 A 91 VAL HG21 A 69 CYS HB2 1.0 0.0 6.25 163 87 A 69 CYS HB3 A 91 VAL HG21 1.0 0.0 6.25 164 88 A 69 CYS HB2 A 116 VAL HG11 1.0 0.0 4.66 165 88 A 69 CYS HB3 A 116 VAL HG11 1.0 0.0 4.66 166 88 A 116 VAL HG21 A 69 CYS HB2 1.0 0.0 4.66 167 88 A 116 VAL HG21 A 69 CYS HB3 1.0 0.0 4.66 168 89 A 69 CYS HB2 A 116 VAL HG11 1.0 0.0 4.66 169 89 A 69 CYS HB3 A 116 VAL HG11 1.0 0.0 4.66 170 89 A 116 VAL HG21 A 69 CYS HB2 1.0 0.0 4.66 171 89 A 116 VAL HG21 A 69 CYS HB3 1.0 0.0 4.66 172 90 A 118 ALA HB1 A 115 ALA HA 1.0 0.0 3.85 173 91 A 115 ALA HB1 A 116 VAL HG11 1.0 0.0 4.51 174 91 A 116 VAL HG21 A 115 ALA HB1 1.0 0.0 4.51 175 92 A 115 ALA HB1 A 37 LEU HD11 1.0 0.0 5.32 176 92 A 37 LEU HD21 A 115 ALA HB1 1.0 0.0 5.32 177 93 A 119 ALA HB1 A 115 ALA HB1 1.0 0.0 6.02 178 94 A 115 ALA HB1 A 18 ALA HB1 1.0 0.0 3.81 179 95 A 115 ALA HB1 A 116 VAL HB 1.0 0.0 4.94 180 96 A 116 VAL HA A 115 ALA HB1 1.0 0.0 4.73 181 97 A 112 PHE HD% A 115 ALA HB1 1.0 0.0 5.28 182 98 A 115 ALA HB1 A 18 ALA H 1.0 0.0 4.87 183 99 A 115 ALA HB1 A 112 PHE H 1.0 0.0 5.51 184 100 A 117 LEU H A 115 ALA HB1 1.0 0.0 5.87 185 101 A 116 VAL H A 113 LEU HA 1.0 0.0 4.15 186 102 A 113 LEU HA A 112 PHE HD% 1.0 0.0 4.79 187 103 A 113 LEU HA A 112 PHE HE% 1.0 0.0 5.13 188 104 A 113 LEU HA A 112 PHE HB2 1.0 0.0 5.50 189 104 A 113 LEU HA A 112 PHE HB3 1.0 0.0 5.50 190 105 A 113 LEU HA A 116 VAL HG11 1.0 0.0 4.38 191 105 A 116 VAL HG21 A 113 LEU HA 1.0 0.0 4.38 192 106 A 113 LEU HA A 113 LEU HD11 1.0 0.0 4.59 193 106 A 113 LEU HA A 113 LEU HD21 1.0 0.0 4.59 194 107 A 113 LEU HA A 113 LEU HG 1.0 0.0 3.32 195 108 A 18 ALA HB1 A 116 VAL HG11 1.0 0.0 5.44 196 108 A 116 VAL HG21 A 18 ALA HB1 1.0 0.0 5.44 197 109 A 18 ALA HB1 A 112 PHE HA 1.0 0.0 4.39 198 110 A 18 ALA HB1 A 112 PHE HB2 1.0 0.0 4.71 199 110 A 18 ALA HB1 A 112 PHE HB3 1.0 0.0 4.71 200 111 A 113 LEU H A 113 LEU HB2 1.0 0.0 3.96 201 111 A 113 LEU H A 113 LEU HB3 1.0 0.0 3.96 202 112 A 112 PHE HD% A 113 LEU HG 1.0 0.0 4.33 203 113 A 10 LEU H A 8 PRO HG2 1.0 0.0 4.41 204 113 A 8 PRO HG3 A 10 LEU H 1.0 0.0 4.41 205 114 A 113 LEU HG A 113 LEU H 1.0 0.0 3.75 206 115 A 107 GLU HA A 110 LEU HG 1.0 0.0 4.06 207 116 A 113 LEU H A 113 LEU HD11 1.0 0.0 4.87 208 116 A 113 LEU HD21 A 113 LEU H 1.0 0.0 4.87 209 117 A 114 SER H A 113 LEU HD11 1.0 0.0 5.86 210 117 A 113 LEU HD21 A 114 SER H 1.0 0.0 5.86 211 118 A 20 VAL H A 112 PHE HB2 1.0 0.0 5.02 212 118 A 112 PHE HB3 A 20 VAL H 1.0 0.0 5.02 213 119 A 112 PHE HB3 A 116 VAL HG11 1.0 0.0 5.56 214 119 A 112 PHE HB2 A 116 VAL HG11 1.0 0.0 5.56 215 119 A 116 VAL HG21 A 112 PHE HB2 1.0 0.0 5.56 216 119 A 116 VAL HG21 A 112 PHE HB3 1.0 0.0 5.56 217 120 A 113 LEU H A 113 LEU HD11 1.0 0.0 4.87 218 120 A 113 LEU HD21 A 113 LEU H 1.0 0.0 4.87 219 121 A 112 PHE HD% A 113 LEU HD11 1.0 0.0 5.50 220 121 A 112 PHE HD% A 113 LEU HD21 1.0 0.0 5.50 221 122 A 113 LEU HA A 113 LEU HD11 1.0 0.0 4.59 222 122 A 113 LEU HA A 113 LEU HD21 1.0 0.0 4.59 223 123 A 112 PHE HD% A 112 PHE HA 1.0 0.0 3.78 224 124 A 115 ALA HB1 A 112 PHE HA 1.0 0.0 3.67 225 125 A 111 LYS HA A 111 LYS HG2 1.0 0.0 4.02 226 125 A 111 LYS HA A 111 LYS HG3 1.0 0.0 4.02 227 126 A 111 LYS HA A 111 LYS HG2 1.0 0.0 4.02 228 126 A 111 LYS HA A 111 LYS HG3 1.0 0.0 4.02 229 127 A 111 LYS HE3 A 111 LYS HG2 1.0 0.0 3.86 230 127 A 111 LYS HE2 A 111 LYS HG2 1.0 0.0 3.86 231 127 A 111 LYS HG3 A 111 LYS HE2 1.0 0.0 3.86 232 127 A 111 LYS HG3 A 111 LYS HE3 1.0 0.0 3.86 233 128 A 111 LYS HE3 A 111 LYS HG2 1.0 0.0 3.86 234 128 A 111 LYS HE2 A 111 LYS HG2 1.0 0.0 3.86 235 128 A 111 LYS HG3 A 111 LYS HE2 1.0 0.0 3.86 236 128 A 111 LYS HG3 A 111 LYS HE3 1.0 0.0 3.86 237 129 A 111 LYS HA A 111 LYS HD2 1.0 0.0 4.46 238 129 A 111 LYS HA A 111 LYS HD3 1.0 0.0 4.46 239 130 A 111 LYS H A 111 LYS HD2 1.0 0.0 4.47 240 130 A 111 LYS HD3 A 111 LYS H 1.0 0.0 4.47 241 131 A 110 LEU HD11 A 111 LYS HE2 1.0 0.0 4.90 242 131 A 110 LEU HD21 A 111 LYS HE2 1.0 0.0 4.90 243 131 A 111 LYS HE3 A 110 LEU HD11 1.0 0.0 4.90 244 131 A 111 LYS HE3 A 110 LEU HD21 1.0 0.0 4.90 245 132 A 110 LEU HA A 110 LEU HD11 1.0 0.0 4.69 246 132 A 110 LEU HD21 A 110 LEU HA 1.0 0.0 4.69 247 133 A 110 LEU HA A 110 LEU HD11 1.0 0.0 5.10 248 133 A 110 LEU HD21 A 110 LEU HA 1.0 0.0 5.10 249 134 A 110 LEU HA A 113 LEU HB2 1.0 0.0 4.13 250 134 A 113 LEU HB3 A 110 LEU HA 1.0 0.0 4.13 251 135 A 110 LEU H A 110 LEU HB2 1.0 0.0 3.80 252 135 A 110 LEU H A 110 LEU HB3 1.0 0.0 3.80 253 136 A 111 LYS H A 110 LEU HB2 1.0 0.0 4.21 254 136 A 111 LYS H A 110 LEU HB3 1.0 0.0 4.21 255 137 A 110 LEU H A 110 LEU HD11 1.0 0.0 4.14 256 137 A 110 LEU HD21 A 110 LEU H 1.0 0.0 4.14 257 138 A 107 GLU HA A 110 LEU HD11 1.0 0.0 3.84 258 138 A 107 GLU HA A 110 LEU HD21 1.0 0.0 3.84 259 139 A 111 LYS HA A 110 LEU HD11 1.0 0.0 4.62 260 139 A 111 LYS HA A 110 LEU HD21 1.0 0.0 4.62 261 140 A 106 GLU HG3 A 110 LEU HD11 1.0 0.0 4.90 262 140 A 106 GLU HG2 A 110 LEU HD11 1.0 0.0 4.90 263 140 A 110 LEU HD21 A 106 GLU HG2 1.0 0.0 4.90 264 140 A 110 LEU HD21 A 106 GLU HG3 1.0 0.0 4.90 265 141 A 110 LEU HB2 A 110 LEU HD11 1.0 0.0 3.66 266 141 A 110 LEU HB3 A 110 LEU HD11 1.0 0.0 3.66 267 141 A 110 LEU HD21 A 110 LEU HB2 1.0 0.0 3.66 268 141 A 110 LEU HD21 A 110 LEU HB3 1.0 0.0 3.66 269 142 A 110 LEU HB2 A 110 LEU HD11 1.0 0.0 3.66 270 142 A 110 LEU HB3 A 110 LEU HD11 1.0 0.0 3.66 271 142 A 110 LEU HD21 A 110 LEU HB2 1.0 0.0 3.66 272 142 A 110 LEU HD21 A 110 LEU HB3 1.0 0.0 3.66 273 143 A 107 GLU HA A 110 LEU HD11 1.0 0.0 4.44 274 143 A 107 GLU HA A 110 LEU HD21 1.0 0.0 4.44 275 144 A 109 CYS HA A 112 PHE HB2 1.0 0.0 4.61 276 144 A 112 PHE HB3 A 109 CYS HA 1.0 0.0 4.61 277 145 A 103 ILE HB A 109 CYS HB2 1.0 0.0 4.74 278 145 A 103 ILE HB A 109 CYS HB3 1.0 0.0 4.74 279 146 A 110 LEU HG A 109 CYS HB2 1.0 0.0 5.50 280 146 A 110 LEU HG A 109 CYS HB3 1.0 0.0 5.50 281 147 A 110 LEU HG A 109 CYS HB2 1.0 0.0 5.50 282 147 A 110 LEU HG A 109 CYS HB3 1.0 0.0 5.50 283 148 A 20 VAL HG11 A 108 HIS HB2 1.0 0.0 4.82 284 148 A 20 VAL HG21 A 108 HIS HB2 1.0 0.0 4.82 285 148 A 108 HIS HB3 A 20 VAL HG11 1.0 0.0 4.82 286 148 A 20 VAL HG21 A 108 HIS HB3 1.0 0.0 4.82 287 149 A 20 VAL HG11 A 108 HIS HB2 1.0 0.0 4.82 288 149 A 20 VAL HG21 A 108 HIS HB2 1.0 0.0 4.82 289 149 A 108 HIS HB3 A 20 VAL HG11 1.0 0.0 4.82 290 149 A 20 VAL HG21 A 108 HIS HB3 1.0 0.0 4.82 291 150 A 20 VAL HG11 A 108 HIS HB2 1.0 0.0 5.25 292 150 A 20 VAL HG21 A 108 HIS HB2 1.0 0.0 5.25 293 150 A 108 HIS HB3 A 20 VAL HG11 1.0 0.0 5.25 294 150 A 20 VAL HG21 A 108 HIS HB3 1.0 0.0 5.25 295 151 A 20 VAL HG11 A 108 HIS HB2 1.0 0.0 5.25 296 151 A 20 VAL HG21 A 108 HIS HB2 1.0 0.0 5.25 297 151 A 108 HIS HB3 A 20 VAL HG11 1.0 0.0 5.25 298 151 A 20 VAL HG21 A 108 HIS HB3 1.0 0.0 5.25 299 152 A 107 GLU HA A 106 GLU HG2 1.0 0.0 4.11 300 152 A 107 GLU HA A 106 GLU HG3 1.0 0.0 4.11 301 153 A 107 GLU H A 107 GLU HB2 1.0 0.0 3.65 302 153 A 107 GLU H A 107 GLU HB3 1.0 0.0 3.65 303 154 A 107 GLU H A 107 GLU HB2 1.0 0.0 3.65 304 154 A 107 GLU H A 107 GLU HB3 1.0 0.0 3.65 305 155 A 107 GLU HB2 A 110 LEU HD11 1.0 0.0 5.07 306 155 A 107 GLU HB3 A 110 LEU HD11 1.0 0.0 5.07 307 155 A 110 LEU HD21 A 107 GLU HB2 1.0 0.0 5.07 308 155 A 110 LEU HD21 A 107 GLU HB3 1.0 0.0 5.07 309 156 A 107 GLU HB2 A 110 LEU HD11 1.0 0.0 5.61 310 156 A 107 GLU HB3 A 110 LEU HD11 1.0 0.0 5.61 311 156 A 110 LEU HD21 A 107 GLU HB2 1.0 0.0 5.61 312 156 A 110 LEU HD21 A 107 GLU HB3 1.0 0.0 5.61 313 157 A 107 GLU HB2 A 110 LEU HD11 1.0 0.0 5.61 314 157 A 107 GLU HB3 A 110 LEU HD11 1.0 0.0 5.61 315 157 A 110 LEU HD21 A 107 GLU HB2 1.0 0.0 5.61 316 157 A 110 LEU HD21 A 107 GLU HB3 1.0 0.0 5.61 317 158 A 107 GLU HB2 A 110 LEU HD11 1.0 0.0 5.07 318 158 A 107 GLU HB3 A 110 LEU HD11 1.0 0.0 5.07 319 158 A 110 LEU HD21 A 107 GLU HB2 1.0 0.0 5.07 320 158 A 110 LEU HD21 A 107 GLU HB3 1.0 0.0 5.07 321 159 A 107 GLU HA A 107 GLU HG2 1.0 0.0 4.25 322 159 A 107 GLU HA A 107 GLU HG3 1.0 0.0 4.25 323 160 A 107 GLU HA A 107 GLU HG2 1.0 0.0 4.25 324 160 A 107 GLU HA A 107 GLU HG3 1.0 0.0 4.25 325 161 A 107 GLU H A 107 GLU HG2 1.0 0.0 3.82 326 161 A 107 GLU H A 107 GLU HG3 1.0 0.0 3.82 327 162 A 106 GLU HA A 109 CYS HB2 1.0 0.0 4.48 328 162 A 109 CYS HB3 A 106 GLU HA 1.0 0.0 4.48 329 163 A 106 GLU HA A 109 CYS HB2 1.0 0.0 4.48 330 163 A 109 CYS HB3 A 106 GLU HA 1.0 0.0 4.48 331 164 A 106 GLU HA A 106 GLU HG2 1.0 0.0 3.68 332 164 A 106 GLU HG3 A 106 GLU HA 1.0 0.0 3.68 333 165 A 106 GLU HB3 A 110 LEU HD11 1.0 0.0 4.98 334 165 A 106 GLU HB2 A 110 LEU HD11 1.0 0.0 4.98 335 165 A 110 LEU HD21 A 106 GLU HB2 1.0 0.0 4.98 336 165 A 110 LEU HD21 A 106 GLU HB3 1.0 0.0 4.98 337 166 A 106 GLU HB3 A 110 LEU HD11 1.0 0.0 5.16 338 166 A 106 GLU HB2 A 110 LEU HD11 1.0 0.0 5.16 339 166 A 110 LEU HD21 A 106 GLU HB2 1.0 0.0 5.16 340 166 A 110 LEU HD21 A 106 GLU HB3 1.0 0.0 5.16 341 167 A 107 GLU H A 106 GLU HG2 1.0 0.0 3.66 342 167 A 106 GLU HG3 A 107 GLU H 1.0 0.0 3.66 343 168 A 106 GLU HG3 A 110 LEU HD11 1.0 0.0 3.69 344 168 A 106 GLU HG2 A 110 LEU HD11 1.0 0.0 3.69 345 168 A 110 LEU HD21 A 106 GLU HG2 1.0 0.0 3.69 346 168 A 110 LEU HD21 A 106 GLU HG3 1.0 0.0 3.69 347 169 A 103 ILE HG21 A 105 ASP HB2 1.0 0.0 5.04 348 169 A 103 ILE HG21 A 105 ASP HB3 1.0 0.0 5.04 349 170 A 105 ASP HB3 A 108 HIS HB2 1.0 0.0 4.39 350 170 A 108 HIS HB3 A 105 ASP HB2 1.0 0.0 4.39 351 170 A 108 HIS HB3 A 105 ASP HB3 1.0 0.0 4.39 352 170 A 105 ASP HB2 A 108 HIS HB2 1.0 0.0 4.39 353 171 A 105 ASP HB3 A 108 HIS HB2 1.0 0.0 4.14 354 171 A 108 HIS HB3 A 105 ASP HB2 1.0 0.0 4.14 355 171 A 108 HIS HB3 A 105 ASP HB3 1.0 0.0 4.14 356 171 A 105 ASP HB2 A 108 HIS HB2 1.0 0.0 4.14 357 172 A 103 ILE HG21 A 105 ASP HB2 1.0 0.0 5.14 358 172 A 103 ILE HG21 A 105 ASP HB3 1.0 0.0 5.14 359 173 A 105 ASP HB3 A 108 HIS HB2 1.0 0.0 4.48 360 173 A 108 HIS HB3 A 105 ASP HB2 1.0 0.0 4.48 361 173 A 108 HIS HB3 A 105 ASP HB3 1.0 0.0 4.48 362 173 A 105 ASP HB2 A 108 HIS HB2 1.0 0.0 4.48 363 174 A 105 ASP HB3 A 108 HIS HB2 1.0 0.0 4.19 364 174 A 108 HIS HB3 A 105 ASP HB2 1.0 0.0 4.19 365 174 A 108 HIS HB3 A 105 ASP HB3 1.0 0.0 4.19 366 174 A 105 ASP HB2 A 108 HIS HB2 1.0 0.0 4.19 367 175 A 105 ASP H A 104 PRO HB2 1.0 0.0 4.60 368 175 A 104 PRO HB3 A 105 ASP H 1.0 0.0 4.60 369 176 A 103 ILE HG21 A 104 PRO HD2 1.0 0.0 5.21 370 176 A 103 ILE HG21 A 104 PRO HD3 1.0 0.0 5.21 371 177 A 105 ASP H A 104 PRO HG2 1.0 0.0 4.31 372 177 A 105 ASP H A 104 PRO HG3 1.0 0.0 4.31 373 178 A 103 ILE HB A 109 CYS HB2 1.0 0.0 4.74 374 178 A 103 ILE HB A 109 CYS HB3 1.0 0.0 4.74 375 179 A 112 PHE HE% A 103 ILE HD11 1.0 0.0 5.03 376 180 A 103 ILE HB A 103 ILE HD11 1.0 0.0 4.09 377 181 A 103 ILE HD11 A 112 PHE HB2 1.0 0.0 5.45 378 181 A 112 PHE HB3 A 103 ILE HD11 1.0 0.0 5.45 379 182 A 103 ILE HD11 A 20 VAL HB 1.0 0.0 5.02 380 183 A 103 ILE HG21 A 103 ILE HD11 1.0 0.0 3.78 381 184 A 103 ILE HD11 A 20 VAL HG11 1.0 0.0 5.15 382 184 A 20 VAL HG21 A 103 ILE HD11 1.0 0.0 5.15 383 185 A 103 ILE HD11 A 35 LEU HD11 1.0 0.0 5.30 384 185 A 103 ILE HD11 A 35 LEU HD21 1.0 0.0 5.30 385 186 A 103 ILE HG21 A 20 VAL HG11 1.0 0.0 4.60 386 186 A 20 VAL HG21 A 103 ILE HG21 1.0 0.0 4.60 387 187 A 103 ILE HG21 A 108 HIS HB2 1.0 0.0 4.30 388 187 A 108 HIS HB3 A 103 ILE HG21 1.0 0.0 4.30 389 188 A 103 ILE HG21 A 109 CYS HB2 1.0 0.0 4.63 390 188 A 109 CYS HB3 A 103 ILE HG21 1.0 0.0 4.63 391 189 A 103 ILE HG21 A 109 CYS HB2 1.0 0.0 4.63 392 189 A 109 CYS HB3 A 103 ILE HG21 1.0 0.0 4.63 393 190 A 103 ILE HG21 A 104 PRO HD2 1.0 0.0 5.21 394 190 A 103 ILE HG21 A 104 PRO HD3 1.0 0.0 5.21 395 191 A 106 GLU HA A 103 ILE HG21 1.0 0.0 5.36 396 192 A 109 CYS HA A 103 ILE HG21 1.0 0.0 4.55 397 193 A 110 LEU H A 103 ILE HG21 1.0 0.0 5.30 398 194 A 113 LEU H A 103 ILE HG21 1.0 0.0 5.97 399 195 A 103 ILE HG21 A 108 HIS HB2 1.0 0.0 4.21 400 195 A 108 HIS HB3 A 103 ILE HG21 1.0 0.0 4.21 401 196 A 103 ILE HG21 A 103 ILE HG12 1.0 0.0 3.70 402 196 A 103 ILE HG21 A 103 ILE HG13 1.0 0.0 3.70 403 197 A 31 GLU HB2 A 32 PRO HD2 1.0 0.0 4.32 404 197 A 31 GLU HB3 A 32 PRO HD2 1.0 0.0 4.32 405 197 A 32 PRO HD3 A 31 GLU HB2 1.0 0.0 4.32 406 197 A 31 GLU HB3 A 32 PRO HD3 1.0 0.0 4.32 407 198 A 102 GLU H A 102 GLU HG2 1.0 0.0 4.79 408 198 A 102 GLU H A 102 GLU HG3 1.0 0.0 4.79 409 199 A 89 ILE HG12 A 101 PHE HB2 1.0 0.0 4.62 410 199 A 89 ILE HG13 A 101 PHE HB2 1.0 0.0 4.62 411 199 A 101 PHE HB3 A 89 ILE HG12 1.0 0.0 4.62 412 199 A 89 ILE HG13 A 101 PHE HB3 1.0 0.0 4.62 413 200 A 101 PHE HB2 A 103 ILE HG12 1.0 0.0 5.30 414 200 A 101 PHE HB3 A 103 ILE HG12 1.0 0.0 5.30 415 200 A 103 ILE HG13 A 101 PHE HB2 1.0 0.0 5.30 416 200 A 103 ILE HG13 A 101 PHE HB3 1.0 0.0 5.30 417 201 A 89 ILE HG12 A 101 PHE HB2 1.0 0.0 4.26 418 201 A 89 ILE HG13 A 101 PHE HB2 1.0 0.0 4.26 419 201 A 101 PHE HB3 A 89 ILE HG12 1.0 0.0 4.26 420 201 A 89 ILE HG13 A 101 PHE HB3 1.0 0.0 4.26 421 202 A 89 ILE HG12 A 101 PHE HB2 1.0 0.0 4.62 422 202 A 89 ILE HG13 A 101 PHE HB2 1.0 0.0 4.62 423 202 A 101 PHE HB3 A 89 ILE HG12 1.0 0.0 4.62 424 202 A 89 ILE HG13 A 101 PHE HB3 1.0 0.0 4.62 425 203 A 68 ARG HB2 A 68 ARG HD2 1.0 0.0 4.14 426 203 A 68 ARG HB3 A 68 ARG HD2 1.0 0.0 4.14 427 203 A 68 ARG HD3 A 68 ARG HB2 1.0 0.0 4.14 428 203 A 68 ARG HB3 A 68 ARG HD3 1.0 0.0 4.14 429 204 A 8 PRO HB2 A 9 PRO HD2 1.0 0.0 4.49 430 204 A 8 PRO HB3 A 9 PRO HD2 1.0 0.0 4.49 431 204 A 9 PRO HD3 A 8 PRO HB2 1.0 0.0 4.49 432 204 A 8 PRO HB3 A 9 PRO HD3 1.0 0.0 4.49 433 205 A 8 PRO HB3 A 9 PRO HD2 1.0 0.0 4.63 434 205 A 8 PRO HB2 A 9 PRO HD2 1.0 0.0 4.63 435 205 A 9 PRO HD3 A 8 PRO HB2 1.0 0.0 4.63 436 205 A 8 PRO HB3 A 9 PRO HD3 1.0 0.0 4.63 437 206 A 8 PRO HB3 A 9 PRO HD2 1.0 0.0 3.87 438 206 A 8 PRO HB2 A 9 PRO HD2 1.0 0.0 3.87 439 206 A 9 PRO HD3 A 8 PRO HB2 1.0 0.0 3.87 440 206 A 8 PRO HB3 A 9 PRO HD3 1.0 0.0 3.87 441 207 A 8 PRO HB3 A 9 PRO HD2 1.0 0.0 3.66 442 207 A 8 PRO HB2 A 9 PRO HD2 1.0 0.0 3.66 443 207 A 9 PRO HD3 A 8 PRO HB2 1.0 0.0 3.66 444 207 A 8 PRO HB3 A 9 PRO HD3 1.0 0.0 3.66 445 208 A 98 GLU H A 97 ARG HB2 1.0 0.0 4.42 446 208 A 97 ARG HB3 A 98 GLU H 1.0 0.0 4.42 447 209 A 98 GLU H A 97 ARG HB2 1.0 0.0 4.42 448 209 A 97 ARG HB3 A 98 GLU H 1.0 0.0 4.42 449 210 A 44 TYR HD% A 39 GLN HG2 1.0 0.0 4.94 450 210 A 44 TYR HD% A 39 GLN HG3 1.0 0.0 4.94 451 211 A 50 LEU H A 57 VAL HB 1.0 0.0 5.50 452 212 A 67 PHE HE% A 91 VAL HB 1.0 0.0 5.00 453 213 A 91 VAL HB A 101 PHE HD% 1.0 0.0 5.25 454 214 A 69 CYS HB2 A 91 VAL HG11 1.0 0.0 6.25 455 214 A 69 CYS HB3 A 91 VAL HG11 1.0 0.0 6.25 456 214 A 91 VAL HG21 A 69 CYS HB2 1.0 0.0 6.25 457 214 A 69 CYS HB3 A 91 VAL HG21 1.0 0.0 6.25 458 215 A 69 CYS HB2 A 91 VAL HG11 1.0 0.0 6.25 459 215 A 69 CYS HB3 A 91 VAL HG11 1.0 0.0 6.25 460 215 A 91 VAL HG21 A 69 CYS HB2 1.0 0.0 6.25 461 215 A 69 CYS HB3 A 91 VAL HG21 1.0 0.0 6.25 462 216 A 101 PHE HE% A 91 VAL HG11 1.0 0.0 4.59 463 216 A 91 VAL HG21 A 101 PHE HE% 1.0 0.0 4.59 464 217 A 29 LEU H A 29 LEU HB2 1.0 0.0 3.95 465 217 A 29 LEU H A 29 LEU HB3 1.0 0.0 3.95 466 218 A 89 ILE HD11 A 35 LEU HD11 1.0 0.0 4.88 467 218 A 35 LEU HD21 A 89 ILE HD11 1.0 0.0 4.88 468 219 A 89 ILE HD11 A 89 ILE HG21 1.0 0.0 3.77 469 220 A 89 ILE HD11 A 103 ILE HG12 1.0 0.0 4.93 470 220 A 103 ILE HG13 A 89 ILE HD11 1.0 0.0 4.93 471 221 A 89 ILE HD11 A 89 ILE HB 1.0 0.0 3.91 472 222 A 89 ILE HD11 A 101 PHE HB2 1.0 0.0 4.61 473 222 A 101 PHE HB3 A 89 ILE HD11 1.0 0.0 4.61 474 223 A 89 ILE HD11 A 101 PHE HB2 1.0 0.0 5.12 475 223 A 101 PHE HB3 A 89 ILE HD11 1.0 0.0 5.12 476 224 A 101 PHE HD% A 89 ILE HD11 1.0 0.0 3.95 477 225 A 112 PHE HE% A 89 ILE HD11 1.0 0.0 4.46 478 226 A 89 ILE HG21 A 89 ILE HA 1.0 0.0 4.61 479 227 A 103 ILE HD11 A 89 ILE HG21 1.0 0.0 5.00 480 228 A 89 ILE HG21 A 71 GLN HG2 1.0 0.0 3.93 481 228 A 89 ILE HG21 A 71 GLN HG3 1.0 0.0 3.93 482 229 A 89 ILE HG21 A 89 ILE H 1.0 0.0 4.04 483 230 A 48 ILE HG21 A 101 PHE HZ 1.0 0.0 4.05 484 231 A 112 PHE HE% A 89 ILE HG21 1.0 0.0 4.38 485 232 A 89 ILE HG21 A 72 GLU H 1.0 0.0 4.37 486 233 A 101 PHE HD% A 89 ILE HG12 1.0 0.0 4.42 487 233 A 89 ILE HG13 A 101 PHE HD% 1.0 0.0 4.42 488 234 A 101 PHE HD% A 89 ILE HG12 1.0 0.0 4.42 489 234 A 89 ILE HG13 A 101 PHE HD% 1.0 0.0 4.42 490 235 A 89 ILE HG12 A 101 PHE HB2 1.0 0.0 4.26 491 235 A 89 ILE HG13 A 101 PHE HB2 1.0 0.0 4.26 492 235 A 101 PHE HB3 A 89 ILE HG12 1.0 0.0 4.26 493 235 A 89 ILE HG13 A 101 PHE HB3 1.0 0.0 4.26 494 236 A 88 LYS HB2 A 88 LYS HD2 1.0 0.0 3.29 495 236 A 88 LYS HB3 A 88 LYS HD2 1.0 0.0 3.29 496 236 A 88 LYS HD3 A 88 LYS HB2 1.0 0.0 3.29 497 236 A 88 LYS HB3 A 88 LYS HD3 1.0 0.0 3.29 498 237 A 39 GLN H A 17 LEU HD11 1.0 0.0 4.44 499 237 A 17 LEU HD21 A 39 GLN H 1.0 0.0 4.44 500 238 A 103 ILE HB A 87 CYS HB2 1.0 0.0 5.10 501 238 A 103 ILE HB A 87 CYS HB3 1.0 0.0 5.10 502 239 A 71 GLN HG3 A 87 CYS HB2 1.0 0.0 4.49 503 239 A 71 GLN HG2 A 87 CYS HB2 1.0 0.0 4.49 504 239 A 87 CYS HB3 A 71 GLN HG2 1.0 0.0 4.49 505 239 A 71 GLN HG3 A 87 CYS HB3 1.0 0.0 4.49 506 240 A 103 ILE HB A 87 CYS HB2 1.0 0.0 5.50 507 240 A 103 ILE HB A 87 CYS HB3 1.0 0.0 5.50 508 241 A 71 GLN HG2 A 87 CYS HB2 1.0 0.0 4.39 509 241 A 71 GLN HG3 A 87 CYS HB2 1.0 0.0 4.39 510 241 A 87 CYS HB3 A 71 GLN HG2 1.0 0.0 4.39 511 241 A 71 GLN HG3 A 87 CYS HB3 1.0 0.0 4.39 512 242 A 80 ASP H A 83 SER HB2 1.0 0.0 5.50 513 242 A 80 ASP H A 83 SER HB3 1.0 0.0 5.50 514 243 A 82 ALA H A 83 SER HB2 1.0 0.0 5.50 515 243 A 83 SER HB3 A 82 ALA H 1.0 0.0 5.50 516 244 A 79 ILE HG21 A 83 SER HB2 1.0 0.0 5.13 517 244 A 83 SER HB3 A 79 ILE HG21 1.0 0.0 5.13 518 245 A 81 ILE H A 82 ALA HB1 1.0 0.0 5.08 519 246 A 82 ALA HB1 A 83 SER HB2 1.0 0.0 5.02 520 246 A 83 SER HB3 A 82 ALA HB1 1.0 0.0 5.02 521 247 A 79 ILE HG21 A 82 ALA HB1 1.0 0.0 4.48 522 248 A 81 ILE HB A 81 ILE HD11 1.0 0.0 3.86 523 249 A 79 ILE HA A 79 ILE HD11 1.0 0.0 4.98 524 250 A 81 ILE HD11 A 81 ILE HA 1.0 0.0 5.16 525 251 A 80 ASP H A 79 ILE HD11 1.0 0.0 6.00 526 252 A 82 ALA H A 81 ILE HD11 1.0 0.0 6.00 527 253 A 63 ILE HG21 A 63 ILE HD11 1.0 0.0 3.98 528 254 A 63 ILE HD11 A 37 LEU HD11 1.0 0.0 5.36 529 254 A 37 LEU HD21 A 63 ILE HD11 1.0 0.0 5.36 530 255 A 119 ALA HB1 A 63 ILE HD11 1.0 0.0 4.29 531 256 A 63 ILE HD11 A 116 VAL HG11 1.0 0.0 4.18 532 256 A 116 VAL HG21 A 63 ILE HD11 1.0 0.0 4.18 533 257 A 63 ILE HD11 A 46 LEU HB2 1.0 0.0 4.24 534 257 A 63 ILE HD11 A 46 LEU HB3 1.0 0.0 4.24 535 258 A 63 ILE HD11 A 63 ILE HB 1.0 0.0 4.02 536 259 A 63 ILE HD11 A 46 LEU HB2 1.0 0.0 4.73 537 259 A 63 ILE HD11 A 46 LEU HB3 1.0 0.0 4.73 538 260 A 63 ILE HD11 A 44 TYR HB2 1.0 0.0 3.93 539 260 A 44 TYR HB3 A 63 ILE HD11 1.0 0.0 3.93 540 261 A 63 ILE HD11 A 63 ILE HA 1.0 0.0 4.84 541 262 A 67 PHE HZ A 63 ILE HD11 1.0 0.0 5.47 542 263 A 44 TYR HD% A 63 ILE HD11 1.0 0.0 4.78 543 264 A 67 PHE HE% A 63 ILE HD11 1.0 0.0 5.17 544 265 A 63 ILE HD11 A 67 PHE HD% 1.0 0.0 4.97 545 266 A 82 ALA H A 81 ILE HG21 1.0 0.0 4.72 546 267 A 81 ILE H A 81 ILE HG21 1.0 0.0 4.55 547 268 A 79 ILE HG21 A 79 ILE H 1.0 0.0 4.57 548 269 A 81 ILE HA A 81 ILE HG21 1.0 0.0 4.18 549 270 A 79 ILE HG21 A 79 ILE HA 1.0 0.0 4.15 550 271 A 81 ILE HG21 A 81 ILE HG12 1.0 0.0 3.91 551 271 A 81 ILE HG21 A 81 ILE HG13 1.0 0.0 3.91 552 272 A 81 ILE HG21 A 81 ILE HG12 1.0 0.0 3.91 553 272 A 81 ILE HG21 A 81 ILE HG13 1.0 0.0 3.91 554 273 A 80 ASP H A 80 ASP HB2 1.0 0.0 3.75 555 273 A 80 ASP H A 80 ASP HB3 1.0 0.0 3.75 556 274 A 79 ILE HG21 A 80 ASP HB2 1.0 0.0 5.65 557 274 A 79 ILE HG21 A 80 ASP HB3 1.0 0.0 5.65 558 275 A 79 ILE HG21 A 80 ASP HB2 1.0 0.0 5.65 559 275 A 79 ILE HG21 A 80 ASP HB3 1.0 0.0 5.65 560 276 A 79 ILE HD11 A 79 ILE HB 1.0 0.0 3.83 561 277 A 78 LEU H A 78 LEU HB2 1.0 0.0 4.17 562 277 A 78 LEU H A 78 LEU HB3 1.0 0.0 4.17 563 278 A 78 LEU H A 78 LEU HB2 1.0 0.0 4.17 564 278 A 78 LEU H A 78 LEU HB3 1.0 0.0 4.17 565 279 A 76 THR HA A 76 THR HG21 1.0 0.0 4.52 566 280 A 57 VAL HA A 57 VAL HG11 1.0 0.0 4.34 567 280 A 57 VAL HA A 57 VAL HG21 1.0 0.0 4.34 568 281 A 112 PHE HD% A 20 VAL HG11 1.0 0.0 4.74 569 281 A 20 VAL HG21 A 112 PHE HD% 1.0 0.0 4.74 570 282 A 20 VAL HG11 A 112 PHE HB2 1.0 0.0 4.52 571 282 A 20 VAL HG21 A 112 PHE HB2 1.0 0.0 4.52 572 282 A 112 PHE HB3 A 20 VAL HG11 1.0 0.0 4.52 573 282 A 20 VAL HG21 A 112 PHE HB3 1.0 0.0 4.52 574 283 A 103 ILE HD11 A 20 VAL HG11 1.0 0.0 5.15 575 283 A 20 VAL HG21 A 103 ILE HD11 1.0 0.0 5.15 576 284 A 103 ILE HG21 A 20 VAL HG11 1.0 0.0 4.60 577 284 A 20 VAL HG21 A 103 ILE HG21 1.0 0.0 4.60 578 285 A 14 ALA HB1 A 40 ARG HD2 1.0 0.0 4.22 579 285 A 14 ALA HB1 A 40 ARG HD3 1.0 0.0 4.22 580 286 A 14 ALA HB1 A 11 PRO HD2 1.0 0.0 5.05 581 286 A 11 PRO HD3 A 14 ALA HB1 1.0 0.0 5.05 582 287 A 14 ALA HB1 A 40 ARG HD2 1.0 0.0 4.22 583 287 A 14 ALA HB1 A 40 ARG HD3 1.0 0.0 4.22 584 288 A 14 ALA HB1 A 11 PRO HB2 1.0 0.0 3.88 585 288 A 14 ALA HB1 A 11 PRO HB3 1.0 0.0 3.88 586 289 A 14 ALA HB1 A 11 PRO HG2 1.0 0.0 4.15 587 289 A 14 ALA HB1 A 11 PRO HG3 1.0 0.0 4.15 588 290 A 14 ALA HB1 A 11 PRO HG2 1.0 0.0 4.37 589 290 A 14 ALA HB1 A 11 PRO HG3 1.0 0.0 4.37 590 291 A 47 ILE HD11 A 14 ALA HB1 1.0 0.0 4.73 591 292 A 71 GLN HB2 A 113 LEU HD11 1.0 0.0 5.95 592 292 A 71 GLN HB3 A 113 LEU HD11 1.0 0.0 5.95 593 292 A 113 LEU HD21 A 71 GLN HB2 1.0 0.0 5.95 594 292 A 113 LEU HD21 A 71 GLN HB3 1.0 0.0 5.95 595 293 A 71 GLN HB3 A 113 LEU HD11 1.0 0.0 5.95 596 293 A 71 GLN HB2 A 113 LEU HD11 1.0 0.0 5.95 597 293 A 113 LEU HD21 A 71 GLN HB2 1.0 0.0 5.95 598 293 A 113 LEU HD21 A 71 GLN HB3 1.0 0.0 5.95 599 294 A 71 GLN HB2 A 113 LEU HD11 1.0 0.0 5.95 600 294 A 71 GLN HB3 A 113 LEU HD11 1.0 0.0 5.95 601 294 A 113 LEU HD21 A 71 GLN HB2 1.0 0.0 5.95 602 294 A 113 LEU HD21 A 71 GLN HB3 1.0 0.0 5.95 603 295 A 71 GLN HB2 A 113 LEU HD11 1.0 0.0 5.95 604 295 A 71 GLN HB3 A 113 LEU HD11 1.0 0.0 5.95 605 295 A 113 LEU HD21 A 71 GLN HB2 1.0 0.0 5.95 606 295 A 113 LEU HD21 A 71 GLN HB3 1.0 0.0 5.95 607 296 A 71 GLN H A 70 VAL HG11 1.0 0.0 4.74 608 296 A 70 VAL HG21 A 71 GLN H 1.0 0.0 4.74 609 297 A 70 VAL HG11 A 90 ARG HB2 1.0 0.0 4.27 610 297 A 70 VAL HG21 A 90 ARG HB2 1.0 0.0 4.27 611 297 A 90 ARG HB3 A 70 VAL HG11 1.0 0.0 4.27 612 297 A 70 VAL HG21 A 90 ARG HB3 1.0 0.0 4.27 613 298 A 70 VAL HG11 A 90 ARG HB2 1.0 0.0 4.27 614 298 A 70 VAL HG21 A 90 ARG HB2 1.0 0.0 4.27 615 298 A 90 ARG HB3 A 70 VAL HG11 1.0 0.0 4.27 616 298 A 70 VAL HG21 A 90 ARG HB3 1.0 0.0 4.27 617 299 A 67 PHE HD% A 69 CYS HB2 1.0 0.0 5.50 618 299 A 69 CYS HB3 A 67 PHE HD% 1.0 0.0 5.50 619 300 A 67 PHE HD% A 69 CYS HB2 1.0 0.0 5.50 620 300 A 69 CYS HB3 A 67 PHE HD% 1.0 0.0 5.50 621 301 A 68 ARG HB2 A 68 ARG HD2 1.0 0.0 4.14 622 301 A 68 ARG HB3 A 68 ARG HD2 1.0 0.0 4.14 623 301 A 68 ARG HD3 A 68 ARG HB2 1.0 0.0 4.14 624 301 A 68 ARG HB3 A 68 ARG HD3 1.0 0.0 4.14 625 302 A 67 PHE HE% A 63 ILE HA 1.0 0.0 4.73 626 303 A 63 ILE HB A 44 TYR HB2 1.0 0.0 3.94 627 303 A 44 TYR HB3 A 63 ILE HB 1.0 0.0 3.94 628 304 A 63 ILE HG21 A 63 ILE HG12 1.0 0.0 4.08 629 304 A 63 ILE HG21 A 63 ILE HG13 1.0 0.0 4.08 630 305 A 63 ILE HG21 A 63 ILE HG12 1.0 0.0 4.33 631 305 A 63 ILE HG21 A 63 ILE HG13 1.0 0.0 4.33 632 306 A 63 ILE HG21 A 120 GLN HB2 1.0 0.0 4.78 633 306 A 63 ILE HG21 A 120 GLN HB3 1.0 0.0 4.78 634 307 A 63 ILE HG21 A 120 GLN HB2 1.0 0.0 4.28 635 307 A 63 ILE HG21 A 120 GLN HB3 1.0 0.0 4.28 636 308 A 63 ILE HG21 A 120 GLN HG2 1.0 0.0 4.10 637 308 A 120 GLN HG3 A 63 ILE HG21 1.0 0.0 4.10 638 309 A 63 ILE HG21 A 44 TYR HB2 1.0 0.0 4.42 639 309 A 63 ILE HG21 A 44 TYR HB3 1.0 0.0 4.42 640 310 A 63 ILE HG21 A 63 ILE HA 1.0 0.0 3.80 641 311 A 63 ILE HG21 A 67 PHE HD% 1.0 0.0 4.02 642 312 A 61 ILE HB A 61 ILE HD11 1.0 0.0 4.39 643 313 A 61 ILE HD11 A 61 ILE HG21 1.0 0.0 3.98 644 314 A 47 ILE HB A 47 ILE HD11 1.0 0.0 4.04 645 315 A 60 ILE HB A 60 ILE HD11 1.0 0.0 3.76 646 316 A 47 ILE HB A 36 THR HG21 1.0 0.0 4.74 647 317 A 61 ILE H A 60 ILE HD11 1.0 0.0 5.90 648 318 A 60 ILE HD11 A 11 PRO HD2 1.0 0.0 5.31 649 318 A 11 PRO HD3 A 60 ILE HD11 1.0 0.0 5.31 650 319 A 60 ILE HD11 A 11 PRO HB2 1.0 0.0 4.73 651 319 A 11 PRO HB3 A 60 ILE HD11 1.0 0.0 4.73 652 320 A 48 ILE HB A 48 ILE HD11 1.0 0.0 3.75 653 321 A 101 PHE HZ A 48 ILE HD11 1.0 0.0 3.93 654 322 A 101 PHE HE% A 48 ILE HD11 1.0 0.0 4.27 655 323 A 48 ILE HD11 A 48 ILE H 1.0 0.0 4.85 656 324 A 101 PHE HE% A 48 ILE HG21 1.0 0.0 4.09 657 325 A 48 ILE HG21 A 33 CYS HB2 1.0 0.0 4.48 658 325 A 48 ILE HG21 A 33 CYS HB3 1.0 0.0 4.48 659 326 A 48 ILE HG21 A 33 CYS HB2 1.0 0.0 4.89 660 326 A 48 ILE HG21 A 33 CYS HB3 1.0 0.0 4.89 661 327 A 35 LEU HB3 A 116 VAL HG11 1.0 0.0 5.35 662 327 A 35 LEU HB2 A 116 VAL HG11 1.0 0.0 5.35 663 327 A 116 VAL HG21 A 35 LEU HB2 1.0 0.0 5.35 664 327 A 116 VAL HG21 A 35 LEU HB3 1.0 0.0 5.35 665 328 A 112 PHE HZ A 35 LEU HB2 1.0 0.0 5.50 666 328 A 35 LEU HB3 A 112 PHE HZ 1.0 0.0 5.50 667 329 A 112 PHE HE% A 35 LEU HB2 1.0 0.0 5.50 668 329 A 112 PHE HE% A 35 LEU HB3 1.0 0.0 5.50 669 330 A 112 PHE HZ A 35 LEU HB2 1.0 0.0 5.50 670 330 A 35 LEU HB3 A 112 PHE HZ 1.0 0.0 5.50 671 331 A 112 PHE HD% A 35 LEU HB2 1.0 0.0 4.82 672 331 A 112 PHE HD% A 35 LEU HB3 1.0 0.0 4.82 673 332 A 112 PHE HE% A 35 LEU HB2 1.0 0.0 5.41 674 332 A 112 PHE HE% A 35 LEU HB3 1.0 0.0 5.41 675 333 A 14 ALA HB1 A 11 PRO HB2 1.0 0.0 4.86 676 333 A 14 ALA HB1 A 11 PRO HB3 1.0 0.0 4.86 677 334 A 58 GLN H A 57 VAL HG11 1.0 0.0 4.89 678 334 A 57 VAL HG21 A 58 GLN H 1.0 0.0 4.89 679 335 A 12 VAL HA A 12 VAL HG11 1.0 0.0 3.84 680 335 A 12 VAL HA A 12 VAL HG21 1.0 0.0 3.84 681 336 A 19 THR HG21 A 19 THR H 1.0 0.0 3.94 682 337 A 19 THR HG21 A 20 VAL H 1.0 0.0 4.78 683 338 A 19 THR HG21 A 16 PRO HG2 1.0 0.0 5.70 684 338 A 19 THR HG21 A 16 PRO HG3 1.0 0.0 5.70 685 339 A 19 THR HG21 A 16 PRO HB2 1.0 0.0 4.92 686 339 A 19 THR HG21 A 16 PRO HB3 1.0 0.0 4.92 687 340 A 112 PHE HD% A 20 VAL HG11 1.0 0.0 4.74 688 340 A 20 VAL HG21 A 112 PHE HD% 1.0 0.0 4.74 689 341 A 20 VAL HG11 A 112 PHE HB2 1.0 0.0 4.52 690 341 A 20 VAL HG21 A 112 PHE HB2 1.0 0.0 4.52 691 341 A 112 PHE HB3 A 20 VAL HG11 1.0 0.0 4.52 692 341 A 20 VAL HG21 A 112 PHE HB3 1.0 0.0 4.52 693 342 A 57 VAL HA A 57 VAL HG11 1.0 0.0 4.34 694 342 A 57 VAL HA A 57 VAL HG21 1.0 0.0 4.34 695 343 A 57 VAL H A 57 VAL HG11 1.0 0.0 4.86 696 343 A 57 VAL HG21 A 57 VAL H 1.0 0.0 4.86 697 344 A 15 GLN H A 15 GLN HB2 1.0 0.0 3.82 698 344 A 15 GLN H A 15 GLN HB3 1.0 0.0 3.82 699 345 A 7 GLU HB2 A 8 PRO HD2 1.0 0.0 4.97 700 345 A 8 PRO HD3 A 7 GLU HB2 1.0 0.0 4.97 701 345 A 7 GLU HB3 A 8 PRO HD3 1.0 0.0 4.97 702 345 A 7 GLU HB3 A 8 PRO HD2 1.0 0.0 4.97 703 346 A 7 GLU HB2 A 8 PRO HD2 1.0 0.0 4.97 704 346 A 8 PRO HD3 A 7 GLU HB2 1.0 0.0 4.97 705 346 A 7 GLU HB3 A 8 PRO HD3 1.0 0.0 4.97 706 346 A 7 GLU HB3 A 8 PRO HD2 1.0 0.0 4.97 707 347 A 7 GLU HB2 A 8 PRO HD2 1.0 0.0 4.97 708 347 A 8 PRO HD3 A 7 GLU HB2 1.0 0.0 4.97 709 347 A 7 GLU HB3 A 8 PRO HD3 1.0 0.0 4.97 710 347 A 7 GLU HB3 A 8 PRO HD2 1.0 0.0 4.97 711 348 A 55 GLN H A 55 GLN HG2 1.0 0.0 4.27 712 348 A 55 GLN H A 55 GLN HG3 1.0 0.0 4.27 713 349 A 54 GLU HA A 54 GLU HG2 1.0 0.0 4.20 714 349 A 54 GLU HA A 54 GLU HG3 1.0 0.0 4.20 715 350 A 54 GLU HA A 54 GLU HG2 1.0 0.0 4.20 716 350 A 54 GLU HA A 54 GLU HG3 1.0 0.0 4.20 717 351 A 28 PRO HB2 A 29 LEU HD11 1.0 0.0 4.46 718 351 A 28 PRO HB3 A 29 LEU HD11 1.0 0.0 4.46 719 351 A 29 LEU HD21 A 28 PRO HB2 1.0 0.0 4.46 720 351 A 28 PRO HB3 A 29 LEU HD21 1.0 0.0 4.46 721 352 A 113 LEU HA A 116 VAL HB 1.0 0.0 3.58 722 353 A 47 ILE HG21 A 58 GLN HB2 1.0 0.0 4.62 723 353 A 47 ILE HG21 A 58 GLN HB3 1.0 0.0 4.62 724 354 A 32 PRO HB3 A 51 HIS HB2 1.0 0.0 4.25 725 354 A 32 PRO HB2 A 51 HIS HB2 1.0 0.0 4.25 726 354 A 51 HIS HB3 A 32 PRO HB2 1.0 0.0 4.25 727 354 A 32 PRO HB3 A 51 HIS HB3 1.0 0.0 4.25 728 355 A 32 PRO HB3 A 51 HIS HB2 1.0 0.0 4.25 729 355 A 32 PRO HB2 A 51 HIS HB2 1.0 0.0 4.25 730 355 A 51 HIS HB3 A 32 PRO HB2 1.0 0.0 4.25 731 355 A 32 PRO HB3 A 51 HIS HB3 1.0 0.0 4.25 732 356 A 9 PRO HB3 A 56 HIS HB2 1.0 0.0 4.75 733 356 A 9 PRO HB2 A 56 HIS HB2 1.0 0.0 4.75 734 356 A 56 HIS HB3 A 9 PRO HB2 1.0 0.0 4.75 735 356 A 9 PRO HB3 A 56 HIS HB3 1.0 0.0 4.75 736 357 A 9 PRO HB3 A 56 HIS HB2 1.0 0.0 4.75 737 357 A 9 PRO HB2 A 56 HIS HB2 1.0 0.0 4.75 738 357 A 56 HIS HB3 A 9 PRO HB2 1.0 0.0 4.75 739 357 A 9 PRO HB3 A 56 HIS HB3 1.0 0.0 4.75 740 358 A 9 PRO HB2 A 56 HIS HB2 1.0 0.0 5.50 741 358 A 56 HIS HB3 A 9 PRO HB2 1.0 0.0 5.50 742 358 A 9 PRO HB3 A 56 HIS HB3 1.0 0.0 5.50 743 358 A 9 PRO HB3 A 56 HIS HB2 1.0 0.0 5.50 744 359 A 9 PRO HB3 A 56 HIS HB2 1.0 0.0 5.50 745 359 A 9 PRO HB2 A 56 HIS HB2 1.0 0.0 5.50 746 359 A 56 HIS HB3 A 9 PRO HB2 1.0 0.0 5.50 747 359 A 9 PRO HB3 A 56 HIS HB3 1.0 0.0 5.50 748 360 A 61 ILE H A 46 LEU HB2 1.0 0.0 5.50 749 360 A 61 ILE H A 46 LEU HB3 1.0 0.0 5.50 750 361 A 46 LEU HB2 A 46 LEU HD11 1.0 0.0 3.93 751 361 A 46 LEU HB3 A 46 LEU HD11 1.0 0.0 3.93 752 361 A 46 LEU HD21 A 46 LEU HB2 1.0 0.0 3.93 753 361 A 46 LEU HB3 A 46 LEU HD21 1.0 0.0 3.93 754 362 A 47 ILE HG21 A 59 ASP HB2 1.0 0.0 6.00 755 362 A 47 ILE HG21 A 59 ASP HB3 1.0 0.0 6.00 756 363 A 47 ILE HG21 A 59 ASP HB2 1.0 0.0 6.00 757 363 A 47 ILE HG21 A 59 ASP HB3 1.0 0.0 6.00 758 364 A 122 ALA H A 121 LYS HB2 1.0 0.0 4.29 759 364 A 121 LYS HB3 A 122 ALA H 1.0 0.0 4.29 760 365 A 51 HIS HD2 A 32 PRO HB2 1.0 0.0 4.31 761 365 A 32 PRO HB3 A 51 HIS HD2 1.0 0.0 4.31 762 366 A 26 LYS HB2 A 29 LEU HD11 1.0 0.0 6.00 763 366 A 26 LYS HB3 A 29 LEU HD11 1.0 0.0 6.00 764 366 A 29 LEU HD21 A 26 LYS HB2 1.0 0.0 6.00 765 366 A 29 LEU HD21 A 26 LYS HB3 1.0 0.0 6.00 766 367 A 26 LYS HD3 A 29 LEU HD11 1.0 0.0 4.74 767 367 A 26 LYS HD2 A 29 LEU HD11 1.0 0.0 4.74 768 367 A 29 LEU HD21 A 26 LYS HD2 1.0 0.0 4.74 769 367 A 29 LEU HD21 A 26 LYS HD3 1.0 0.0 4.74 770 368 A 18 ALA H A 17 LEU HB2 1.0 0.0 4.40 771 368 A 18 ALA H A 17 LEU HB3 1.0 0.0 4.40 772 369 A 17 LEU HB2 A 37 LEU HD11 1.0 0.0 5.87 773 369 A 17 LEU HB3 A 37 LEU HD11 1.0 0.0 5.87 774 369 A 37 LEU HD21 A 17 LEU HB2 1.0 0.0 5.87 775 369 A 37 LEU HD21 A 17 LEU HB3 1.0 0.0 5.87 776 370 A 17 LEU HB2 A 37 LEU HD11 1.0 0.0 5.87 777 370 A 17 LEU HB3 A 37 LEU HD11 1.0 0.0 5.87 778 370 A 37 LEU HD21 A 17 LEU HB2 1.0 0.0 5.87 779 370 A 37 LEU HD21 A 17 LEU HB3 1.0 0.0 5.87 780 371 A 17 LEU HB2 A 17 LEU HD11 1.0 0.0 4.16 781 371 A 17 LEU HB3 A 17 LEU HD11 1.0 0.0 4.16 782 371 A 17 LEU HD21 A 17 LEU HB2 1.0 0.0 4.16 783 371 A 17 LEU HD21 A 17 LEU HB3 1.0 0.0 4.16 784 372 A 17 LEU HB2 A 37 LEU HD11 1.0 0.0 5.18 785 372 A 17 LEU HB3 A 37 LEU HD11 1.0 0.0 5.18 786 372 A 37 LEU HD21 A 17 LEU HB2 1.0 0.0 5.18 787 372 A 37 LEU HD21 A 17 LEU HB3 1.0 0.0 5.18 788 373 A 17 LEU HB2 A 17 LEU HD11 1.0 0.0 4.06 789 373 A 17 LEU HB3 A 17 LEU HD11 1.0 0.0 4.06 790 373 A 17 LEU HD21 A 17 LEU HB2 1.0 0.0 4.06 791 373 A 17 LEU HD21 A 17 LEU HB3 1.0 0.0 4.06 792 374 A 17 LEU HB2 A 17 LEU HD11 1.0 0.0 4.06 793 374 A 17 LEU HB3 A 17 LEU HD11 1.0 0.0 4.06 794 374 A 17 LEU HD21 A 17 LEU HB2 1.0 0.0 4.06 795 374 A 17 LEU HD21 A 17 LEU HB3 1.0 0.0 4.06 796 375 A 23 MET HE1 A 23 MET HG2 1.0 0.0 3.61 797 375 A 23 MET HG3 A 23 MET HE1 1.0 0.0 3.61 798 376 A 23 MET HE1 A 23 MET HG2 1.0 0.0 3.61 799 376 A 23 MET HG3 A 23 MET HE1 1.0 0.0 3.61 800 377 A 23 MET HE1 A 23 MET H 1.0 0.0 4.80 801 378 A 21 GLU H A 21 GLU HG2 1.0 0.0 4.34 802 378 A 21 GLU H A 21 GLU HG3 1.0 0.0 4.34 803 379 A 25 MET H A 25 MET HE1 1.0 0.0 5.26 804 380 A 25 MET HE1 A 100 ARG HD2 1.0 0.0 4.17 805 380 A 25 MET HE1 A 100 ARG HD3 1.0 0.0 4.17 806 381 A 25 MET HE1 A 25 MET HG2 1.0 0.0 3.85 807 381 A 25 MET HE1 A 25 MET HG3 1.0 0.0 3.85 808 382 A 102 GLU H A 25 MET HE1 1.0 0.0 5.48 809 383 A 29 LEU HG A 28 PRO HD2 1.0 0.0 4.66 810 383 A 28 PRO HD3 A 29 LEU HG 1.0 0.0 4.66 811 384 A 9 PRO HD2 A 10 LEU HB2 1.0 0.0 4.37 812 384 A 10 LEU HB3 A 9 PRO HD2 1.0 0.0 4.37 813 384 A 9 PRO HD3 A 10 LEU HB3 1.0 0.0 4.37 814 384 A 9 PRO HD3 A 10 LEU HB2 1.0 0.0 4.37 815 385 A 10 LEU HD11 A 11 PRO HD2 1.0 0.0 5.03 816 385 A 10 LEU HD21 A 11 PRO HD2 1.0 0.0 5.03 817 385 A 11 PRO HD3 A 10 LEU HD11 1.0 0.0 5.03 818 385 A 11 PRO HD3 A 10 LEU HD21 1.0 0.0 5.03 819 386 A 60 ILE HD11 A 11 PRO HD2 1.0 0.0 5.31 820 386 A 11 PRO HD3 A 60 ILE HD11 1.0 0.0 5.31 821 387 A 14 ALA HB1 A 11 PRO HD2 1.0 0.0 5.05 822 387 A 11 PRO HD3 A 14 ALA HB1 1.0 0.0 5.05 823 388 A 10 LEU HB3 A 11 PRO HD2 1.0 0.0 4.38 824 388 A 10 LEU HB2 A 11 PRO HD2 1.0 0.0 4.38 825 388 A 11 PRO HD3 A 10 LEU HB2 1.0 0.0 4.38 826 388 A 11 PRO HD3 A 10 LEU HB3 1.0 0.0 4.38 827 389 A 10 LEU HB3 A 11 PRO HD2 1.0 0.0 4.44 828 389 A 10 LEU HB2 A 11 PRO HD2 1.0 0.0 4.44 829 389 A 11 PRO HD3 A 10 LEU HB2 1.0 0.0 4.44 830 389 A 11 PRO HD3 A 10 LEU HB3 1.0 0.0 4.44 831 390 A 47 ILE HD11 A 11 PRO HD2 1.0 0.0 4.21 832 390 A 47 ILE HD11 A 11 PRO HD3 1.0 0.0 4.21 833 391 A 10 LEU HD11 A 11 PRO HD2 1.0 0.0 5.03 834 391 A 10 LEU HD21 A 11 PRO HD2 1.0 0.0 5.03 835 391 A 11 PRO HD3 A 10 LEU HD11 1.0 0.0 5.03 836 391 A 11 PRO HD3 A 10 LEU HD21 1.0 0.0 5.03 837 392 A 10 LEU HB3 A 11 PRO HD2 1.0 0.0 4.38 838 392 A 10 LEU HB2 A 11 PRO HD2 1.0 0.0 4.38 839 392 A 11 PRO HD3 A 10 LEU HB2 1.0 0.0 4.38 840 392 A 11 PRO HD3 A 10 LEU HB3 1.0 0.0 4.38 841 393 A 7 GLU HB2 A 8 PRO HD2 1.0 0.0 4.97 842 393 A 8 PRO HD3 A 7 GLU HB2 1.0 0.0 4.97 843 393 A 7 GLU HB3 A 8 PRO HD3 1.0 0.0 4.97 844 393 A 7 GLU HB3 A 8 PRO HD2 1.0 0.0 4.97 845 394 A 14 ALA HB1 A 10 LEU HB2 1.0 0.0 5.76 846 394 A 14 ALA HB1 A 10 LEU HB3 1.0 0.0 5.76 847 395 A 36 THR HG21 A 10 LEU HB2 1.0 0.0 6.00 848 395 A 36 THR HG21 A 10 LEU HB3 1.0 0.0 6.00 849 396 A 10 LEU HD11 A 11 PRO HD2 1.0 0.0 5.03 850 396 A 10 LEU HD21 A 11 PRO HD2 1.0 0.0 5.03 851 396 A 11 PRO HD3 A 10 LEU HD11 1.0 0.0 5.03 852 396 A 11 PRO HD3 A 10 LEU HD21 1.0 0.0 5.03 853 397 A 10 LEU HD11 A 11 PRO HD2 1.0 0.0 5.03 854 397 A 10 LEU HD21 A 11 PRO HD2 1.0 0.0 5.03 855 397 A 11 PRO HD3 A 10 LEU HD11 1.0 0.0 5.03 856 397 A 11 PRO HD3 A 10 LEU HD21 1.0 0.0 5.03 857 398 A 36 THR HB A 10 LEU HD11 1.0 0.0 4.65 858 398 A 36 THR HB A 10 LEU HD21 1.0 0.0 4.65 859 399 A 49 GLN HE21 A 10 LEU HD11 1.0 0.0 6.00 860 399 A 10 LEU HD21 A 49 GLN HE21 1.0 0.0 6.00 861 400 A 10 LEU HB2 A 10 LEU HD11 1.0 0.0 3.73 862 400 A 10 LEU HB3 A 10 LEU HD11 1.0 0.0 3.73 863 400 A 10 LEU HD21 A 10 LEU HB2 1.0 0.0 3.73 864 400 A 10 LEU HB3 A 10 LEU HD21 1.0 0.0 3.73 865 401 A 10 LEU HB2 A 10 LEU HD11 1.0 0.0 3.87 866 401 A 10 LEU HB3 A 10 LEU HD11 1.0 0.0 3.87 867 401 A 10 LEU HD21 A 10 LEU HB2 1.0 0.0 3.87 868 401 A 10 LEU HB3 A 10 LEU HD21 1.0 0.0 3.87 869 402 A 36 THR HG21 A 10 LEU HD11 1.0 0.0 4.19 870 402 A 36 THR HG21 A 10 LEU HD21 1.0 0.0 4.19 871 403 A 10 LEU H A 10 LEU HD11 1.0 0.0 4.95 872 403 A 10 LEU H A 10 LEU HD21 1.0 0.0 4.95 873 404 A 36 THR HB A 10 LEU HD11 1.0 0.0 4.65 874 404 A 36 THR HB A 10 LEU HD21 1.0 0.0 4.65 875 405 A 10 LEU HB2 A 10 LEU HD11 1.0 0.0 3.73 876 405 A 10 LEU HB3 A 10 LEU HD11 1.0 0.0 3.73 877 405 A 10 LEU HD21 A 10 LEU HB2 1.0 0.0 3.73 878 405 A 10 LEU HB3 A 10 LEU HD21 1.0 0.0 3.73 879 406 A 10 LEU HB2 A 10 LEU HD11 1.0 0.0 3.87 880 406 A 10 LEU HB3 A 10 LEU HD11 1.0 0.0 3.87 881 406 A 10 LEU HD21 A 10 LEU HB2 1.0 0.0 3.87 882 406 A 10 LEU HB3 A 10 LEU HD21 1.0 0.0 3.87 883 407 A 36 THR HG21 A 10 LEU HD11 1.0 0.0 4.19 884 407 A 36 THR HG21 A 10 LEU HD21 1.0 0.0 4.19 885 408 A 10 LEU HG A 10 LEU H 1.0 0.0 4.19 886 409 A 47 ILE HD11 A 11 PRO HG2 1.0 0.0 4.46 887 409 A 47 ILE HD11 A 11 PRO HG3 1.0 0.0 4.46 888 410 A 47 ILE HD11 A 11 PRO HG2 1.0 0.0 4.15 889 410 A 47 ILE HD11 A 11 PRO HG3 1.0 0.0 4.15 890 411 A 60 ILE HD11 A 11 PRO HG2 1.0 0.0 4.18 891 411 A 11 PRO HG3 A 60 ILE HD11 1.0 0.0 4.18 892 412 A 12 VAL H A 12 VAL HB 1.0 0.0 3.81 893 413 A 10 LEU H A 9 PRO HB2 1.0 0.0 4.34 894 413 A 10 LEU H A 9 PRO HB3 1.0 0.0 4.34 895 414 A 40 ARG H A 39 GLN HB2 1.0 0.0 5.00 896 414 A 39 GLN HB3 A 40 ARG H 1.0 0.0 5.00 897 415 A 44 TYR HD% A 39 GLN HB2 1.0 0.0 4.94 898 415 A 44 TYR HD% A 39 GLN HB3 1.0 0.0 4.94 899 416 A 44 TYR HE% A 39 GLN HB2 1.0 0.0 4.90 900 416 A 39 GLN HB3 A 44 TYR HE% 1.0 0.0 4.90 901 417 A 44 TYR HD% A 39 GLN HB2 1.0 0.0 4.80 902 417 A 44 TYR HD% A 39 GLN HB3 1.0 0.0 4.80 903 418 A 44 TYR HE% A 39 GLN HB2 1.0 0.0 5.50 904 418 A 39 GLN HB3 A 44 TYR HE% 1.0 0.0 5.50 905 419 A 38 ALA HB1 A 39 GLN HB2 1.0 0.0 5.44 906 419 A 38 ALA HB1 A 39 GLN HB3 1.0 0.0 5.44 907 420 A 44 TYR H A 43 GLN HB2 1.0 0.0 4.26 908 420 A 43 GLN HB3 A 44 TYR H 1.0 0.0 4.26 909 421 A 13 GLY H A 12 VAL HG11 1.0 0.0 4.86 910 421 A 12 VAL HG21 A 13 GLY H 1.0 0.0 4.86 911 422 A 12 VAL HA A 12 VAL HG11 1.0 0.0 3.79 912 422 A 12 VAL HA A 12 VAL HG21 1.0 0.0 3.79 913 423 A 12 VAL HG11 A 13 GLY HA2 1.0 0.0 5.23 914 423 A 12 VAL HG21 A 13 GLY HA2 1.0 0.0 5.23 915 423 A 13 GLY HA3 A 12 VAL HG11 1.0 0.0 5.23 916 423 A 12 VAL HG21 A 13 GLY HA3 1.0 0.0 5.23 917 424 A 12 VAL HG11 A 13 GLY HA2 1.0 0.0 5.23 918 424 A 12 VAL HG21 A 13 GLY HA2 1.0 0.0 5.23 919 424 A 13 GLY HA3 A 12 VAL HG11 1.0 0.0 5.23 920 424 A 12 VAL HG21 A 13 GLY HA3 1.0 0.0 5.23 921 425 A 73 ALA HB1 A 75 GLU HB2 1.0 0.0 6.00 922 425 A 73 ALA HB1 A 75 GLU HB3 1.0 0.0 6.00 923 426 A 73 ALA HB1 A 72 GLU HG2 1.0 0.0 6.00 924 426 A 73 ALA HB1 A 72 GLU HG3 1.0 0.0 6.00 925 427 A 73 ALA HB1 A 75 GLU HB2 1.0 0.0 6.00 926 427 A 73 ALA HB1 A 75 GLU HB3 1.0 0.0 6.00 927 428 A 73 ALA HB1 A 74 GLU HG2 1.0 0.0 5.60 928 428 A 73 ALA HB1 A 74 GLU HG3 1.0 0.0 5.60 929 429 A 73 ALA HB1 A 75 GLU HG2 1.0 0.0 6.00 930 429 A 73 ALA HB1 A 75 GLU HG3 1.0 0.0 6.00 931 430 A 73 ALA HB1 A 72 GLU HA 1.0 0.0 6.00 932 431 A 73 ALA HB1 A 74 GLU HA 1.0 0.0 6.00 933 432 A 76 THR HA A 73 ALA HB1 1.0 0.0 6.00 934 433 A 39 GLN H A 14 ALA HB1 1.0 0.0 5.14 935 434 A 14 ALA HB1 A 15 GLN HB2 1.0 0.0 5.67 936 434 A 14 ALA HB1 A 15 GLN HB3 1.0 0.0 5.67 937 435 A 14 ALA HB1 A 15 GLN HB2 1.0 0.0 6.00 938 435 A 14 ALA HB1 A 15 GLN HB3 1.0 0.0 6.00 939 436 A 15 GLN HG3 A 16 PRO HD2 1.0 0.0 4.80 940 436 A 15 GLN HG2 A 16 PRO HD2 1.0 0.0 4.80 941 436 A 16 PRO HD3 A 15 GLN HG2 1.0 0.0 4.80 942 436 A 15 GLN HG3 A 16 PRO HD3 1.0 0.0 4.80 943 437 A 15 GLN HG3 A 16 PRO HD2 1.0 0.0 4.80 944 437 A 15 GLN HG2 A 16 PRO HD2 1.0 0.0 4.80 945 437 A 16 PRO HD3 A 15 GLN HG2 1.0 0.0 4.80 946 437 A 15 GLN HG3 A 16 PRO HD3 1.0 0.0 4.80 947 438 A 14 ALA HB1 A 15 GLN HG2 1.0 0.0 4.96 948 438 A 14 ALA HB1 A 15 GLN HG3 1.0 0.0 4.96 949 439 A 15 GLN HG3 A 39 GLN HB2 1.0 0.0 4.42 950 439 A 15 GLN HG2 A 39 GLN HB2 1.0 0.0 4.42 951 439 A 39 GLN HB3 A 15 GLN HG2 1.0 0.0 4.42 952 439 A 39 GLN HB3 A 15 GLN HG3 1.0 0.0 4.42 953 440 A 43 GLN HG3 A 45 GLU HB2 1.0 0.0 4.56 954 440 A 43 GLN HG2 A 45 GLU HB2 1.0 0.0 4.56 955 440 A 45 GLU HB3 A 43 GLN HG2 1.0 0.0 4.56 956 440 A 43 GLN HG3 A 45 GLU HB3 1.0 0.0 4.56 957 441 A 90 ARG HB2 A 90 ARG HD2 1.0 0.0 3.55 958 441 A 90 ARG HB3 A 90 ARG HD2 1.0 0.0 3.55 959 441 A 90 ARG HD3 A 90 ARG HB2 1.0 0.0 3.55 960 441 A 90 ARG HB3 A 90 ARG HD3 1.0 0.0 3.55 961 442 A 14 ALA HB1 A 40 ARG HB2 1.0 0.0 4.26 962 442 A 14 ALA HB1 A 40 ARG HB3 1.0 0.0 4.26 963 443 A 44 TYR HD% A 39 GLN HG2 1.0 0.0 5.11 964 443 A 44 TYR HD% A 39 GLN HG3 1.0 0.0 5.11 965 444 A 39 GLN H A 39 GLN HG2 1.0 0.0 4.91 966 444 A 39 GLN HG3 A 39 GLN H 1.0 0.0 4.91 967 445 A 39 GLN H A 39 GLN HG2 1.0 0.0 5.10 968 445 A 39 GLN HG3 A 39 GLN H 1.0 0.0 5.10 969 446 A 38 ALA HB1 A 16 PRO HG2 1.0 0.0 5.73 970 446 A 16 PRO HG3 A 38 ALA HB1 1.0 0.0 5.73 971 447 A 38 ALA HB1 A 16 PRO HD2 1.0 0.0 6.00 972 447 A 38 ALA HB1 A 16 PRO HD3 1.0 0.0 6.00 973 448 A 17 LEU HB2 A 17 LEU HD11 1.0 0.0 4.16 974 448 A 17 LEU HB3 A 17 LEU HD11 1.0 0.0 4.16 975 448 A 17 LEU HD21 A 17 LEU HB2 1.0 0.0 4.16 976 448 A 17 LEU HD21 A 17 LEU HB3 1.0 0.0 4.16 977 449 A 76 THR HG21 A 77 LEU HA 1.0 0.0 5.47 978 450 A 18 ALA HB1 A 37 LEU HD11 1.0 0.0 5.09 979 450 A 37 LEU HD21 A 18 ALA HB1 1.0 0.0 5.09 980 451 A 18 ALA HB1 A 37 LEU HB2 1.0 0.0 4.06 981 451 A 37 LEU HB3 A 18 ALA HB1 1.0 0.0 4.06 982 452 A 18 ALA HB1 A 37 LEU HB2 1.0 0.0 4.06 983 452 A 37 LEU HB3 A 18 ALA HB1 1.0 0.0 4.06 984 453 A 18 ALA HB1 A 111 LYS HB2 1.0 0.0 4.82 985 453 A 18 ALA HB1 A 111 LYS HB3 1.0 0.0 4.82 986 454 A 17 LEU H A 18 ALA HB1 1.0 0.0 5.31 987 455 A 17 LEU HG A 37 LEU HD11 1.0 0.0 5.30 988 455 A 37 LEU HD21 A 17 LEU HG 1.0 0.0 5.30 989 456 A 17 LEU HG A 37 LEU HD11 1.0 0.0 5.30 990 456 A 37 LEU HD21 A 17 LEU HG 1.0 0.0 5.30 991 457 A 33 CYS H A 32 PRO HG2 1.0 0.0 5.50 992 457 A 32 PRO HG3 A 33 CYS H 1.0 0.0 5.50 993 458 A 32 PRO HG2 A 51 HIS HB2 1.0 0.0 4.61 994 458 A 32 PRO HG3 A 51 HIS HB2 1.0 0.0 4.61 995 458 A 51 HIS HB3 A 32 PRO HG2 1.0 0.0 4.61 996 458 A 51 HIS HB3 A 32 PRO HG3 1.0 0.0 4.61 997 459 A 32 PRO HG2 A 51 HIS HB2 1.0 0.0 4.61 998 459 A 51 HIS HB3 A 32 PRO HG2 1.0 0.0 4.61 999 459 A 51 HIS HB3 A 32 PRO HG3 1.0 0.0 4.61 1000 459 A 32 PRO HG3 A 51 HIS HB2 1.0 0.0 4.61 1001 460 A 47 ILE H A 47 ILE HG12 1.0 0.0 4.53 1002 460 A 47 ILE HG13 A 47 ILE H 1.0 0.0 4.53 1003 461 A 34 ALA HB1 A 49 GLN HB2 1.0 0.0 3.90 1004 461 A 34 ALA HB1 A 49 GLN HB3 1.0 0.0 3.90 1005 462 A 20 VAL HB A 21 GLU H 1.0 0.0 4.27 1006 463 A 20 VAL HB A 108 HIS HB2 1.0 0.0 4.60 1007 463 A 108 HIS HB3 A 20 VAL HB 1.0 0.0 4.60 1008 464 A 31 GLU HG3 A 32 PRO HD2 1.0 0.0 4.51 1009 464 A 32 PRO HD3 A 31 GLU HG2 1.0 0.0 4.51 1010 464 A 32 PRO HD3 A 31 GLU HG3 1.0 0.0 4.51 1011 464 A 31 GLU HG2 A 32 PRO HD2 1.0 0.0 4.51 1012 465 A 103 ILE HG21 A 20 VAL HB 1.0 0.0 4.70 1013 466 A 112 PHE HD% A 20 VAL HB 1.0 0.0 4.97 1014 467 A 33 CYS HB2 A 50 LEU HD11 1.0 0.0 5.20 1015 467 A 50 LEU HD21 A 33 CYS HB2 1.0 0.0 5.20 1016 467 A 33 CYS HB3 A 50 LEU HD21 1.0 0.0 5.20 1017 467 A 33 CYS HB3 A 50 LEU HD11 1.0 0.0 5.20 1018 468 A 50 LEU HG A 33 CYS HB2 1.0 0.0 4.50 1019 468 A 33 CYS HB3 A 50 LEU HG 1.0 0.0 4.50 1020 469 A 60 ILE HG21 A 45 GLU HB2 1.0 0.0 5.08 1021 469 A 45 GLU HB3 A 60 ILE HG21 1.0 0.0 5.08 1022 470 A 38 ALA HB1 A 45 GLU HB2 1.0 0.0 5.91 1023 470 A 38 ALA HB1 A 45 GLU HB3 1.0 0.0 5.91 1024 471 A 38 ALA HB1 A 45 GLU HB2 1.0 0.0 5.77 1025 471 A 38 ALA HB1 A 45 GLU HB3 1.0 0.0 5.77 1026 472 A 25 MET HG3 A 100 ARG HD2 1.0 0.0 4.92 1027 472 A 25 MET HG2 A 100 ARG HD2 1.0 0.0 4.92 1028 472 A 100 ARG HD3 A 25 MET HG2 1.0 0.0 4.92 1029 472 A 100 ARG HD3 A 25 MET HG3 1.0 0.0 4.92 1030 473 A 26 LYS HB2 A 26 LYS HE2 1.0 0.0 4.97 1031 473 A 26 LYS HB3 A 26 LYS HE2 1.0 0.0 4.97 1032 473 A 26 LYS HE3 A 26 LYS HB2 1.0 0.0 4.97 1033 473 A 26 LYS HB3 A 26 LYS HE3 1.0 0.0 4.97 1034 474 A 26 LYS HB2 A 26 LYS HE2 1.0 0.0 4.97 1035 474 A 26 LYS HB3 A 26 LYS HE2 1.0 0.0 4.97 1036 474 A 26 LYS HE3 A 26 LYS HB2 1.0 0.0 4.97 1037 474 A 26 LYS HB3 A 26 LYS HE3 1.0 0.0 4.97 1038 475 A 26 LYS HB2 A 29 LEU HD11 1.0 0.0 6.00 1039 475 A 26 LYS HB3 A 29 LEU HD11 1.0 0.0 6.00 1040 475 A 29 LEU HD21 A 26 LYS HB2 1.0 0.0 6.00 1041 475 A 29 LEU HD21 A 26 LYS HB3 1.0 0.0 6.00 1042 476 A 38 ALA HB1 A 16 PRO HD2 1.0 0.0 6.00 1043 476 A 38 ALA HB1 A 16 PRO HD3 1.0 0.0 6.00 1044 477 A 36 THR HB A 38 ALA HB1 1.0 0.0 6.00 1045 478 A 47 ILE HD11 A 38 ALA HB1 1.0 0.0 3.85 1046 479 A 38 ALA HB1 A 16 PRO HB2 1.0 0.0 4.08 1047 479 A 16 PRO HB3 A 38 ALA HB1 1.0 0.0 4.08 1048 480 A 17 LEU H A 38 ALA HB1 1.0 0.0 4.53 1049 481 A 26 LYS HE2 A 26 LYS HG2 1.0 0.0 3.60 1050 481 A 26 LYS HE3 A 26 LYS HG2 1.0 0.0 3.60 1051 481 A 26 LYS HG3 A 26 LYS HE2 1.0 0.0 3.60 1052 481 A 26 LYS HE3 A 26 LYS HG3 1.0 0.0 3.60 1053 482 A 26 LYS HE2 A 26 LYS HG2 1.0 0.0 3.60 1054 482 A 26 LYS HE3 A 26 LYS HG2 1.0 0.0 3.60 1055 482 A 26 LYS HG3 A 26 LYS HE2 1.0 0.0 3.60 1056 482 A 26 LYS HE3 A 26 LYS HG3 1.0 0.0 3.60 1057 483 A 26 LYS HB2 A 26 LYS HE2 1.0 0.0 4.97 1058 483 A 26 LYS HB3 A 26 LYS HE2 1.0 0.0 4.97 1059 483 A 26 LYS HE3 A 26 LYS HB2 1.0 0.0 4.97 1060 483 A 26 LYS HB3 A 26 LYS HE3 1.0 0.0 4.97 1061 484 A 26 LYS HB2 A 26 LYS HE2 1.0 0.0 4.97 1062 484 A 26 LYS HB3 A 26 LYS HE2 1.0 0.0 4.97 1063 484 A 26 LYS HE3 A 26 LYS HB2 1.0 0.0 4.97 1064 484 A 26 LYS HB3 A 26 LYS HE3 1.0 0.0 4.97 1065 485 A 29 LEU H A 28 PRO HG2 1.0 0.0 4.31 1066 485 A 29 LEU H A 28 PRO HG3 1.0 0.0 4.31 1067 486 A 29 LEU H A 29 LEU HD11 1.0 0.0 4.26 1068 486 A 29 LEU H A 29 LEU HD21 1.0 0.0 4.26 1069 487 A 30 ARG H A 29 LEU HD11 1.0 0.0 5.18 1070 487 A 29 LEU HD21 A 30 ARG H 1.0 0.0 5.18 1071 488 A 50 LEU H A 50 LEU HD11 1.0 0.0 4.94 1072 488 A 50 LEU H A 50 LEU HD21 1.0 0.0 4.94 1073 489 A 33 CYS HB2 A 50 LEU HD11 1.0 0.0 5.20 1074 489 A 50 LEU HD21 A 33 CYS HB2 1.0 0.0 5.20 1075 489 A 33 CYS HB3 A 50 LEU HD21 1.0 0.0 5.20 1076 489 A 33 CYS HB3 A 50 LEU HD11 1.0 0.0 5.20 1077 490 A 29 LEU H A 29 LEU HD11 1.0 0.0 4.74 1078 490 A 29 LEU H A 29 LEU HD21 1.0 0.0 4.74 1079 491 A 3 LEU H A 3 LEU HG 1.0 0.0 4.47 1080 492 A 18 ALA H A 37 LEU HB2 1.0 0.0 4.94 1081 492 A 37 LEU HB3 A 18 ALA H 1.0 0.0 4.94 1082 493 A 18 ALA H A 37 LEU HB2 1.0 0.0 4.94 1083 493 A 37 LEU HB3 A 18 ALA H 1.0 0.0 4.94 1084 494 A 112 PHE HD% A 37 LEU HB2 1.0 0.0 5.50 1085 494 A 112 PHE HD% A 37 LEU HB3 1.0 0.0 5.50 1086 495 A 112 PHE HD% A 37 LEU HB2 1.0 0.0 5.50 1087 495 A 112 PHE HD% A 37 LEU HB3 1.0 0.0 5.50 1088 496 A 37 LEU HB3 A 116 VAL HG11 1.0 0.0 4.87 1089 496 A 37 LEU HB2 A 116 VAL HG11 1.0 0.0 4.87 1090 496 A 116 VAL HG21 A 37 LEU HB2 1.0 0.0 4.87 1091 496 A 116 VAL HG21 A 37 LEU HB3 1.0 0.0 4.87 1092 497 A 50 LEU HG A 31 GLU HG2 1.0 0.0 3.87 1093 497 A 31 GLU HG3 A 50 LEU HG 1.0 0.0 3.87 1094 498 A 31 GLU HB2 A 32 PRO HD2 1.0 0.0 4.32 1095 498 A 31 GLU HB3 A 32 PRO HD2 1.0 0.0 4.32 1096 498 A 32 PRO HD3 A 31 GLU HB2 1.0 0.0 4.32 1097 498 A 31 GLU HB3 A 32 PRO HD3 1.0 0.0 4.32 1098 499 A 35 LEU H A 35 LEU HD11 1.0 0.0 4.86 1099 499 A 35 LEU HD21 A 35 LEU H 1.0 0.0 4.86 1100 500 A 112 PHE HZ A 35 LEU HD11 1.0 0.0 5.90 1101 500 A 35 LEU HD21 A 112 PHE HZ 1.0 0.0 5.90 1102 501 A 101 PHE HE% A 35 LEU HD11 1.0 0.0 4.93 1103 501 A 35 LEU HD21 A 101 PHE HE% 1.0 0.0 4.93 1104 502 A 103 ILE HD11 A 35 LEU HD11 1.0 0.0 5.30 1105 502 A 103 ILE HD11 A 35 LEU HD21 1.0 0.0 5.30 1106 503 A 89 ILE HD11 A 35 LEU HD11 1.0 0.0 4.88 1107 503 A 35 LEU HD21 A 89 ILE HD11 1.0 0.0 4.88 1108 504 A 35 LEU HB3 A 35 LEU HD11 1.0 0.0 3.94 1109 504 A 35 LEU HB2 A 35 LEU HD11 1.0 0.0 3.94 1110 504 A 35 LEU HD21 A 35 LEU HB2 1.0 0.0 3.94 1111 504 A 35 LEU HD21 A 35 LEU HB3 1.0 0.0 3.94 1112 505 A 35 LEU HB3 A 35 LEU HD11 1.0 0.0 3.94 1113 505 A 35 LEU HB2 A 35 LEU HD11 1.0 0.0 3.94 1114 505 A 35 LEU HD21 A 35 LEU HB2 1.0 0.0 3.94 1115 505 A 35 LEU HD21 A 35 LEU HB3 1.0 0.0 3.94 1116 506 A 112 PHE HZ A 35 LEU HD11 1.0 0.0 5.90 1117 506 A 35 LEU HD21 A 112 PHE HZ 1.0 0.0 5.90 1118 507 A 101 PHE HE% A 35 LEU HD11 1.0 0.0 4.93 1119 507 A 35 LEU HD21 A 101 PHE HE% 1.0 0.0 4.93 1120 508 A 36 THR HG21 A 10 LEU HB2 1.0 0.0 5.41 1121 508 A 36 THR HG21 A 10 LEU HB3 1.0 0.0 5.41 1122 509 A 44 TYR HE% A 37 LEU HD11 1.0 0.0 5.01 1123 509 A 37 LEU HD21 A 44 TYR HE% 1.0 0.0 5.01 1124 510 A 17 LEU H A 37 LEU HD11 1.0 0.0 5.50 1125 510 A 17 LEU H A 37 LEU HD21 1.0 0.0 5.50 1126 511 A 37 LEU HB2 A 37 LEU HD11 1.0 0.0 4.14 1127 511 A 37 LEU HB3 A 37 LEU HD11 1.0 0.0 4.14 1128 511 A 37 LEU HD21 A 37 LEU HB2 1.0 0.0 4.14 1129 511 A 37 LEU HD21 A 37 LEU HB3 1.0 0.0 4.14 1130 512 A 37 LEU HB2 A 37 LEU HD11 1.0 0.0 4.14 1131 512 A 37 LEU HB3 A 37 LEU HD11 1.0 0.0 4.14 1132 512 A 37 LEU HD21 A 37 LEU HB2 1.0 0.0 4.14 1133 512 A 37 LEU HD21 A 37 LEU HB3 1.0 0.0 4.14 1134 513 A 115 ALA HB1 A 37 LEU HD11 1.0 0.0 5.32 1135 513 A 37 LEU HD21 A 115 ALA HB1 1.0 0.0 5.32 1136 514 A 44 TYR HD% A 37 LEU HD11 1.0 0.0 4.98 1137 514 A 44 TYR HD% A 37 LEU HD21 1.0 0.0 4.98 1138 515 A 44 TYR HE% A 37 LEU HD11 1.0 0.0 5.01 1139 515 A 37 LEU HD21 A 44 TYR HE% 1.0 0.0 5.01 1140 516 A 37 LEU HB2 A 37 LEU HD11 1.0 0.0 4.14 1141 516 A 37 LEU HB3 A 37 LEU HD11 1.0 0.0 4.14 1142 516 A 37 LEU HD21 A 37 LEU HB2 1.0 0.0 4.14 1143 516 A 37 LEU HD21 A 37 LEU HB3 1.0 0.0 4.14 1144 517 A 17 LEU HB2 A 37 LEU HD11 1.0 0.0 5.18 1145 517 A 17 LEU HB3 A 37 LEU HD11 1.0 0.0 5.18 1146 517 A 37 LEU HD21 A 17 LEU HB2 1.0 0.0 5.18 1147 517 A 37 LEU HD21 A 17 LEU HB3 1.0 0.0 5.18 1148 518 A 37 LEU HB2 A 37 LEU HD11 1.0 0.0 4.14 1149 518 A 37 LEU HB3 A 37 LEU HD11 1.0 0.0 4.14 1150 518 A 37 LEU HD21 A 37 LEU HB2 1.0 0.0 4.14 1151 518 A 37 LEU HD21 A 37 LEU HB3 1.0 0.0 4.14 1152 519 A 18 ALA HB1 A 37 LEU HD11 1.0 0.0 5.09 1153 519 A 37 LEU HD21 A 18 ALA HB1 1.0 0.0 5.09 1154 520 A 63 ILE HD11 A 37 LEU HD11 1.0 0.0 5.36 1155 520 A 37 LEU HD21 A 63 ILE HD11 1.0 0.0 5.36 1156 521 A 37 LEU HG A 38 ALA HA 1.0 0.0 5.50 1157 522 A 40 ARG HB2 A 40 ARG HD2 1.0 0.0 4.06 1158 522 A 40 ARG HB3 A 40 ARG HD2 1.0 0.0 4.06 1159 522 A 40 ARG HD3 A 40 ARG HB2 1.0 0.0 4.06 1160 522 A 40 ARG HD3 A 40 ARG HB3 1.0 0.0 4.06 1161 523 A 40 ARG HB2 A 40 ARG HD2 1.0 0.0 4.06 1162 523 A 40 ARG HB3 A 40 ARG HD2 1.0 0.0 4.06 1163 523 A 40 ARG HD3 A 40 ARG HB2 1.0 0.0 4.06 1164 523 A 40 ARG HD3 A 40 ARG HB3 1.0 0.0 4.06 1165 524 A 38 ALA HA A 39 GLN HB2 1.0 0.0 5.50 1166 524 A 39 GLN HB3 A 38 ALA HA 1.0 0.0 5.50 1167 525 A 120 GLN HA A 123 GLN HG2 1.0 0.0 4.76 1168 525 A 120 GLN HA A 123 GLN HG3 1.0 0.0 4.76 1169 526 A 63 ILE HG21 A 123 GLN HG2 1.0 0.0 5.37 1170 526 A 123 GLN HG3 A 63 ILE HG21 1.0 0.0 5.37 1171 527 A 63 ILE HG21 A 123 GLN HG2 1.0 0.0 5.37 1172 527 A 123 GLN HG3 A 63 ILE HG21 1.0 0.0 5.37 1173 528 A 47 ILE HG21 A 49 GLN HG2 1.0 0.0 4.63 1174 528 A 47 ILE HG21 A 49 GLN HG3 1.0 0.0 4.63 1175 529 A 47 ILE HD11 A 45 GLU HG2 1.0 0.0 5.83 1176 529 A 47 ILE HD11 A 45 GLU HG3 1.0 0.0 5.83 1177 530 A 40 ARG H A 45 GLU HG2 1.0 0.0 5.24 1178 530 A 40 ARG H A 45 GLU HG3 1.0 0.0 5.24 1179 531 A 35 LEU HD21 A 46 LEU HD11 1.0 0.0 5.17 1180 531 A 35 LEU HD11 A 46 LEU HD11 1.0 0.0 5.17 1181 531 A 46 LEU HD21 A 35 LEU HD11 1.0 0.0 5.17 1182 531 A 35 LEU HD21 A 46 LEU HD21 1.0 0.0 5.17 1183 532 A 35 LEU HD21 A 46 LEU HD11 1.0 0.0 5.17 1184 532 A 35 LEU HD11 A 46 LEU HD11 1.0 0.0 5.17 1185 532 A 46 LEU HD21 A 35 LEU HD11 1.0 0.0 5.17 1186 532 A 35 LEU HD21 A 46 LEU HD21 1.0 0.0 5.17 1187 533 A 46 LEU HB2 A 46 LEU HD11 1.0 0.0 3.93 1188 533 A 46 LEU HB3 A 46 LEU HD11 1.0 0.0 3.93 1189 533 A 46 LEU HD21 A 46 LEU HB2 1.0 0.0 3.93 1190 533 A 46 LEU HB3 A 46 LEU HD21 1.0 0.0 3.93 1191 534 A 67 PHE HZ A 46 LEU HD11 1.0 0.0 4.07 1192 534 A 67 PHE HZ A 46 LEU HD21 1.0 0.0 4.07 1193 535 A 35 LEU HD21 A 46 LEU HD11 1.0 0.0 5.17 1194 535 A 35 LEU HD11 A 46 LEU HD11 1.0 0.0 5.17 1195 535 A 46 LEU HD21 A 35 LEU HD11 1.0 0.0 5.17 1196 535 A 35 LEU HD21 A 46 LEU HD21 1.0 0.0 5.17 1197 536 A 35 LEU HD21 A 46 LEU HD11 1.0 0.0 5.17 1198 536 A 35 LEU HD11 A 46 LEU HD11 1.0 0.0 5.17 1199 536 A 46 LEU HD21 A 35 LEU HD11 1.0 0.0 5.17 1200 536 A 35 LEU HD21 A 46 LEU HD21 1.0 0.0 5.17 1201 537 A 36 THR H A 46 LEU HG 1.0 0.0 5.20 1202 538 A 47 ILE H A 47 ILE HG12 1.0 0.0 4.53 1203 538 A 47 ILE HG13 A 47 ILE H 1.0 0.0 4.53 1204 539 A 36 THR H A 35 LEU HG 1.0 0.0 5.50 1205 540 A 101 PHE HD% A 35 LEU HG 1.0 0.0 5.50 1206 541 A 112 PHE HE% A 35 LEU HG 1.0 0.0 5.50 1207 542 A 112 PHE HZ A 35 LEU HG 1.0 0.0 5.50 1208 543 A 50 LEU H A 50 LEU HG 1.0 0.0 4.75 1209 544 A 48 ILE HD11 A 59 ASP HB2 1.0 0.0 5.15 1210 544 A 48 ILE HD11 A 59 ASP HB3 1.0 0.0 5.15 1211 545 A 48 ILE HD11 A 59 ASP HB2 1.0 0.0 5.15 1212 545 A 48 ILE HD11 A 59 ASP HB3 1.0 0.0 5.15 1213 546 A 50 LEU H A 50 LEU HD11 1.0 0.0 4.94 1214 546 A 50 LEU H A 50 LEU HD21 1.0 0.0 4.94 1215 547 A 31 GLU HG2 A 50 LEU HD11 1.0 0.0 4.48 1216 547 A 31 GLU HG3 A 50 LEU HD11 1.0 0.0 4.48 1217 547 A 50 LEU HD21 A 31 GLU HG2 1.0 0.0 4.48 1218 547 A 31 GLU HG3 A 50 LEU HD21 1.0 0.0 4.48 1219 548 A 51 HIS H A 50 LEU HD11 1.0 0.0 5.29 1220 548 A 50 LEU HD21 A 51 HIS H 1.0 0.0 5.29 1221 549 A 31 GLU HG2 A 50 LEU HD11 1.0 0.0 4.48 1222 549 A 31 GLU HG3 A 50 LEU HD11 1.0 0.0 4.48 1223 549 A 50 LEU HD21 A 31 GLU HG2 1.0 0.0 4.48 1224 549 A 31 GLU HG3 A 50 LEU HD21 1.0 0.0 4.48 1225 550 A 48 ILE H A 60 ILE HG21 1.0 0.0 6.00 1226 551 A 60 ILE HG21 A 46 LEU H 1.0 0.0 5.46 1227 552 A 60 ILE HG21 A 45 GLU HB2 1.0 0.0 4.06 1228 552 A 45 GLU HB3 A 60 ILE HG21 1.0 0.0 4.06 1229 553 A 60 ILE HG21 A 45 GLU HG2 1.0 0.0 4.34 1230 553 A 60 ILE HG21 A 45 GLU HG3 1.0 0.0 4.34 1231 554 A 60 ILE HG21 A 60 ILE HG12 1.0 0.0 3.84 1232 554 A 60 ILE HG21 A 60 ILE HG13 1.0 0.0 3.84 1233 555 A 60 ILE HG21 A 60 ILE HG12 1.0 0.0 3.84 1234 555 A 60 ILE HG21 A 60 ILE HG13 1.0 0.0 3.84 1235 556 A 67 PHE HD% A 120 GLN HG2 1.0 0.0 5.03 1236 556 A 120 GLN HG3 A 67 PHE HD% 1.0 0.0 5.03 1237 557 A 67 PHE HD% A 120 GLN HG2 1.0 0.0 4.87 1238 557 A 120 GLN HG3 A 67 PHE HD% 1.0 0.0 4.87 1239 558 A 44 TYR HD% A 63 ILE HB 1.0 0.0 5.26 1240 559 A 119 ALA HB1 A 63 ILE HB 1.0 0.0 6.00 1241 560 A 25 MET HB3 A 100 ARG HB2 1.0 0.0 4.86 1242 560 A 25 MET HB2 A 100 ARG HB2 1.0 0.0 4.86 1243 560 A 100 ARG HB3 A 25 MET HB2 1.0 0.0 4.86 1244 560 A 25 MET HB3 A 100 ARG HB3 1.0 0.0 4.86 1245 561 A 25 MET HB3 A 100 ARG HB2 1.0 0.0 4.86 1246 561 A 25 MET HB2 A 100 ARG HB2 1.0 0.0 4.86 1247 561 A 100 ARG HB3 A 25 MET HB2 1.0 0.0 4.86 1248 561 A 25 MET HB3 A 100 ARG HB3 1.0 0.0 4.86 1249 562 A 67 PHE HZ A 63 ILE HG12 1.0 0.0 5.50 1250 562 A 67 PHE HZ A 63 ILE HG13 1.0 0.0 5.50 1251 563 A 67 PHE HE% A 63 ILE HG12 1.0 0.0 5.48 1252 563 A 67 PHE HE% A 63 ILE HG13 1.0 0.0 5.48 1253 564 A 64 ASN H A 67 PHE HB2 1.0 0.0 4.12 1254 564 A 64 ASN H A 67 PHE HB3 1.0 0.0 4.12 1255 565 A 20 VAL HB A 112 PHE HB2 1.0 0.0 4.81 1256 565 A 112 PHE HB3 A 20 VAL HB 1.0 0.0 4.81 1257 566 A 20 VAL HB A 112 PHE HB2 1.0 0.0 5.45 1258 566 A 112 PHE HB3 A 20 VAL HB 1.0 0.0 5.45 1259 567 A 111 LYS HB2 A 112 PHE HB2 1.0 0.0 5.12 1260 567 A 111 LYS HB3 A 112 PHE HB2 1.0 0.0 5.12 1261 567 A 112 PHE HB3 A 111 LYS HB2 1.0 0.0 5.12 1262 567 A 112 PHE HB3 A 111 LYS HB3 1.0 0.0 5.12 1263 568 A 111 LYS HB2 A 112 PHE HB2 1.0 0.0 4.89 1264 568 A 111 LYS HB3 A 112 PHE HB2 1.0 0.0 4.89 1265 568 A 112 PHE HB3 A 111 LYS HB2 1.0 0.0 4.89 1266 568 A 112 PHE HB3 A 111 LYS HB3 1.0 0.0 4.89 1267 569 A 101 PHE HD% A 24 GLU HB2 1.0 0.0 4.79 1268 569 A 101 PHE HD% A 24 GLU HB3 1.0 0.0 4.79 1269 570 A 101 PHE HD% A 24 GLU HB2 1.0 0.0 4.50 1270 570 A 101 PHE HD% A 24 GLU HB3 1.0 0.0 4.50 1271 571 A 108 HIS HD2 A 107 GLU HB2 1.0 0.0 5.31 1272 571 A 107 GLU HB3 A 108 HIS HD2 1.0 0.0 5.31 1273 572 A 108 HIS HD2 A 107 GLU HB2 1.0 0.0 5.31 1274 572 A 107 GLU HB3 A 108 HIS HD2 1.0 0.0 5.31 1275 573 A 101 PHE HE% A 24 GLU HG2 1.0 0.0 4.79 1276 573 A 101 PHE HE% A 24 GLU HG3 1.0 0.0 4.79 1277 574 A 101 PHE HE% A 24 GLU HG2 1.0 0.0 4.68 1278 574 A 101 PHE HE% A 24 GLU HG3 1.0 0.0 4.68 1279 575 A 101 PHE HD% A 24 GLU HG2 1.0 0.0 4.66 1280 575 A 101 PHE HD% A 24 GLU HG3 1.0 0.0 4.66 1281 576 A 101 PHE HD% A 24 GLU HG2 1.0 0.0 4.90 1282 576 A 101 PHE HD% A 24 GLU HG3 1.0 0.0 4.90 1283 577 A 24 GLU H A 24 GLU HG2 1.0 0.0 4.92 1284 577 A 24 GLU HG3 A 24 GLU H 1.0 0.0 4.92 1285 578 A 24 GLU H A 24 GLU HG2 1.0 0.0 5.50 1286 578 A 24 GLU HG3 A 24 GLU H 1.0 0.0 5.50 1287 579 A 24 GLU HG3 A 26 LYS HG2 1.0 0.0 4.34 1288 579 A 24 GLU HG2 A 26 LYS HG2 1.0 0.0 4.34 1289 579 A 26 LYS HG3 A 24 GLU HG2 1.0 0.0 4.34 1290 579 A 26 LYS HG3 A 24 GLU HG3 1.0 0.0 4.34 1291 580 A 24 GLU HG3 A 26 LYS HG2 1.0 0.0 4.16 1292 580 A 24 GLU HG2 A 26 LYS HG2 1.0 0.0 4.16 1293 580 A 26 LYS HG3 A 24 GLU HG2 1.0 0.0 4.16 1294 580 A 26 LYS HG3 A 24 GLU HG3 1.0 0.0 4.16 1295 581 A 81 ILE HA A 84 ASN HD21 1.0 0.0 5.18 1296 582 A 81 ILE HA A 84 ASN HD22 1.0 0.0 5.18 1297 583 A 41 ASN HA A 41 ASN HD22 1.0 0.0 5.16 1298 584 A 41 ASN HA A 41 ASN HD21 1.0 0.0 5.16 1299 585 A 41 ASN HD21 A 40 ARG HG2 1.0 0.0 4.56 1300 585 A 41 ASN HD21 A 40 ARG HG3 1.0 0.0 4.56 1301 586 A 41 ASN HD21 A 40 ARG HG2 1.0 0.0 4.56 1302 586 A 41 ASN HD21 A 40 ARG HG3 1.0 0.0 4.56 1303 587 A 41 ASN HD22 A 40 ARG HG2 1.0 0.0 4.56 1304 587 A 41 ASN HD22 A 40 ARG HG3 1.0 0.0 4.56 1305 588 A 41 ASN HD22 A 40 ARG HG2 1.0 0.0 4.56 1306 588 A 41 ASN HD22 A 40 ARG HG3 1.0 0.0 4.56 1307 589 A 114 SER H A 116 VAL HG11 1.0 0.0 6.00 1308 589 A 116 VAL HG21 A 114 SER H 1.0 0.0 6.00 1309 590 A 114 SER H A 113 LEU HD11 1.0 0.0 5.86 1310 590 A 113 LEU HD21 A 114 SER H 1.0 0.0 5.86 1311 591 A 115 ALA HB1 A 114 SER H 1.0 0.0 4.88 1312 592 A 114 SER H A 113 LEU HB2 1.0 0.0 3.62 1313 592 A 113 LEU HB3 A 114 SER H 1.0 0.0 3.62 1314 593 A 114 SER H A 113 LEU HB2 1.0 0.0 3.33 1315 593 A 113 LEU HB3 A 114 SER H 1.0 0.0 3.33 1316 594 A 114 SER H A 114 SER HB2 1.0 0.0 3.14 1317 594 A 114 SER H A 114 SER HB3 1.0 0.0 3.14 1318 595 A 114 SER H A 114 SER HB2 1.0 0.0 3.14 1319 595 A 114 SER H A 114 SER HB3 1.0 0.0 3.14 1320 596 A 114 SER H A 117 LEU HB2 1.0 0.0 5.01 1321 596 A 117 LEU HB3 A 114 SER H 1.0 0.0 5.01 1322 597 A 123 GLN H A 124 SER H 1.0 0.0 2.86 1323 598 A 124 SER H A 123 GLN HA 1.0 0.0 3.56 1324 599 A 122 ALA HB1 A 124 SER H 1.0 0.0 4.84 1325 600 A 124 SER H A 121 LYS HB2 1.0 0.0 5.50 1326 600 A 121 LYS HB3 A 124 SER H 1.0 0.0 5.50 1327 601 A 124 SER H A 121 LYS HB2 1.0 0.0 5.50 1328 601 A 121 LYS HB3 A 124 SER H 1.0 0.0 5.50 1329 602 A 124 SER H A 123 GLN HB2 1.0 0.0 4.18 1330 602 A 124 SER H A 123 GLN HB3 1.0 0.0 4.18 1331 603 A 124 SER H A 123 GLN HB2 1.0 0.0 4.18 1332 603 A 124 SER H A 123 GLN HB3 1.0 0.0 4.18 1333 604 A 124 SER H A 123 GLN HG2 1.0 0.0 4.98 1334 604 A 123 GLN HG3 A 124 SER H 1.0 0.0 4.98 1335 605 A 124 SER H A 123 GLN HG2 1.0 0.0 4.98 1336 605 A 123 GLN HG3 A 124 SER H 1.0 0.0 4.98 1337 606 A 120 GLN HA A 124 SER H 1.0 0.0 4.26 1338 607 A 124 SER H A 124 SER HB2 1.0 0.0 2.94 1339 607 A 124 SER H A 124 SER HB3 1.0 0.0 2.94 1340 608 A 121 LYS HA A 124 SER H 1.0 0.0 3.72 1341 609 A 122 ALA H A 123 GLN H 1.0 0.0 2.99 1342 610 A 123 GLN H A 123 GLN HA 1.0 0.0 2.92 1343 611 A 63 ILE HG21 A 123 GLN H 1.0 0.0 5.85 1344 612 A 119 ALA HB1 A 123 GLN H 1.0 0.0 5.32 1345 613 A 122 ALA HB1 A 123 GLN H 1.0 0.0 3.45 1346 614 A 123 GLN H A 123 GLN HB2 1.0 0.0 3.67 1347 614 A 123 GLN H A 123 GLN HB3 1.0 0.0 3.67 1348 615 A 123 GLN H A 123 GLN HB2 1.0 0.0 3.67 1349 615 A 123 GLN H A 123 GLN HB3 1.0 0.0 3.67 1350 616 A 123 GLN H A 123 GLN HG2 1.0 0.0 3.62 1351 616 A 123 GLN HG3 A 123 GLN H 1.0 0.0 3.62 1352 617 A 123 GLN H A 123 GLN HG2 1.0 0.0 3.62 1353 617 A 123 GLN HG3 A 123 GLN H 1.0 0.0 3.62 1354 618 A 119 ALA HA A 123 GLN H 1.0 0.0 4.63 1355 619 A 120 GLN HA A 123 GLN H 1.0 0.0 4.00 1356 620 A 123 GLN H A 124 SER HB2 1.0 0.0 4.63 1357 620 A 123 GLN H A 124 SER HB3 1.0 0.0 4.63 1358 621 A 121 LYS HA A 123 GLN H 1.0 0.0 4.65 1359 622 A 122 ALA HB1 A 122 ALA H 1.0 0.0 2.90 1360 623 A 122 ALA H A 121 LYS HB2 1.0 0.0 3.11 1361 623 A 121 LYS HB3 A 122 ALA H 1.0 0.0 3.11 1362 624 A 122 ALA H A 121 LYS HD2 1.0 0.0 4.14 1363 624 A 121 LYS HD3 A 122 ALA H 1.0 0.0 4.14 1364 625 A 119 ALA HA A 122 ALA H 1.0 0.0 3.70 1365 626 A 121 LYS H A 122 ALA H 1.0 0.0 2.84 1366 627 A 120 GLN H A 122 ALA H 1.0 0.0 4.19 1367 628 A 122 ALA H A 120 GLN HB2 1.0 0.0 4.88 1368 628 A 120 GLN HB3 A 122 ALA H 1.0 0.0 4.88 1369 629 A 122 ALA H A 121 LYS HE2 1.0 0.0 5.83 1370 629 A 121 LYS HE3 A 122 ALA H 1.0 0.0 5.83 1371 630 A 120 GLN HA A 122 ALA H 1.0 0.0 4.40 1372 631 A 118 ALA HA A 122 ALA H 1.0 0.0 4.01 1373 632 A 121 LYS HA A 122 ALA H 1.0 0.0 3.56 1374 633 A 122 ALA H A 123 GLN HA 1.0 0.0 5.47 1375 634 A 118 ALA HB1 A 122 ALA H 1.0 0.0 5.11 1376 635 A 121 LYS H A 120 GLN H 1.0 0.0 3.18 1377 636 A 66 HIS H A 65 SER HB2 1.0 0.0 3.93 1378 636 A 65 SER HB3 A 66 HIS H 1.0 0.0 3.93 1379 637 A 119 ALA HA A 121 LYS H 1.0 0.0 5.05 1380 638 A 121 LYS H A 120 GLN HG2 1.0 0.0 5.10 1381 638 A 121 LYS H A 120 GLN HG3 1.0 0.0 5.10 1382 639 A 66 HIS H A 64 ASN HB2 1.0 0.0 4.00 1383 639 A 66 HIS H A 64 ASN HB3 1.0 0.0 4.00 1384 640 A 66 HIS H A 64 ASN HB2 1.0 0.0 4.00 1385 640 A 66 HIS H A 64 ASN HB3 1.0 0.0 4.00 1386 641 A 121 LYS H A 63 ILE HG21 1.0 0.0 6.00 1387 642 A 121 LYS H A 119 ALA HB1 1.0 0.0 5.48 1388 643 A 121 LYS H A 121 LYS HD2 1.0 0.0 4.30 1389 643 A 121 LYS H A 121 LYS HD3 1.0 0.0 4.30 1390 644 A 121 LYS H A 121 LYS HB2 1.0 0.0 2.98 1391 644 A 121 LYS H A 121 LYS HB3 1.0 0.0 2.98 1392 645 A 121 LYS H A 121 LYS HB2 1.0 0.0 3.26 1393 645 A 121 LYS H A 121 LYS HB3 1.0 0.0 3.26 1394 646 A 121 LYS H A 121 LYS HG2 1.0 0.0 4.72 1395 646 A 121 LYS H A 121 LYS HG3 1.0 0.0 4.72 1396 647 A 121 LYS H A 121 LYS HE2 1.0 0.0 5.81 1397 647 A 121 LYS H A 121 LYS HE3 1.0 0.0 5.81 1398 648 A 121 LYS H A 120 GLN HB2 1.0 0.0 3.58 1399 648 A 121 LYS H A 120 GLN HB3 1.0 0.0 3.58 1400 649 A 120 GLN H A 118 ALA H 1.0 0.0 4.37 1401 650 A 120 GLN H A 63 ILE HD11 1.0 0.0 5.38 1402 651 A 63 ILE HG21 A 120 GLN H 1.0 0.0 4.50 1403 652 A 119 ALA HB1 A 120 GLN H 1.0 0.0 3.62 1404 653 A 120 GLN H A 116 VAL HG11 1.0 0.0 4.48 1405 653 A 120 GLN H A 116 VAL HG21 1.0 0.0 4.48 1406 654 A 122 ALA HB1 A 120 GLN H 1.0 0.0 5.18 1407 655 A 120 GLN H A 117 LEU HG 1.0 0.0 5.50 1408 656 A 120 GLN H A 121 LYS HB2 1.0 0.0 4.84 1409 656 A 120 GLN H A 121 LYS HB3 1.0 0.0 4.84 1410 657 A 120 GLN H A 120 GLN HB2 1.0 0.0 3.18 1411 657 A 120 GLN H A 120 GLN HB3 1.0 0.0 3.18 1412 658 A 120 GLN H A 120 GLN HG2 1.0 0.0 3.37 1413 658 A 120 GLN HG3 A 120 GLN H 1.0 0.0 3.37 1414 659 A 120 GLN H A 116 VAL HA 1.0 0.0 4.46 1415 660 A 118 ALA HA A 120 GLN H 1.0 0.0 4.61 1416 661 A 120 GLN H A 117 LEU HA 1.0 0.0 3.77 1417 662 A 68 ARG HA A 120 GLN HE21 1.0 0.0 4.79 1418 663 A 68 ARG HA A 120 GLN HE22 1.0 0.0 4.79 1419 664 A 120 GLN HE21 A 120 GLN HB2 1.0 0.0 4.83 1420 664 A 120 GLN HB3 A 120 GLN HE21 1.0 0.0 4.83 1421 665 A 120 GLN HE21 A 120 GLN HB2 1.0 0.0 4.28 1422 665 A 120 GLN HB3 A 120 GLN HE21 1.0 0.0 4.28 1423 666 A 120 GLN HE22 A 120 GLN HB2 1.0 0.0 4.83 1424 666 A 120 GLN HB3 A 120 GLN HE22 1.0 0.0 4.83 1425 667 A 120 GLN HE22 A 120 GLN HB2 1.0 0.0 4.28 1426 667 A 120 GLN HB3 A 120 GLN HE22 1.0 0.0 4.28 1427 668 A 120 GLN HE21 A 116 VAL HG11 1.0 0.0 5.37 1428 668 A 116 VAL HG21 A 120 GLN HE21 1.0 0.0 5.37 1429 669 A 120 GLN HE22 A 116 VAL HG11 1.0 0.0 5.37 1430 669 A 116 VAL HG21 A 120 GLN HE22 1.0 0.0 5.37 1431 670 A 118 ALA H A 119 ALA H 1.0 0.0 3.07 1432 671 A 120 GLN H A 119 ALA H 1.0 0.0 3.10 1433 672 A 117 LEU H A 119 ALA H 1.0 0.0 4.38 1434 673 A 118 ALA HA A 119 ALA H 1.0 0.0 3.55 1435 674 A 116 VAL HA A 119 ALA H 1.0 0.0 3.73 1436 675 A 120 GLN HA A 119 ALA H 1.0 0.0 5.35 1437 676 A 119 ALA H A 120 GLN HG2 1.0 0.0 5.45 1438 676 A 120 GLN HG3 A 119 ALA H 1.0 0.0 5.45 1439 677 A 119 ALA H A 120 GLN HG2 1.0 0.0 4.82 1440 677 A 120 GLN HG3 A 119 ALA H 1.0 0.0 4.82 1441 678 A 119 ALA H A 120 GLN HB2 1.0 0.0 5.09 1442 678 A 120 GLN HB3 A 119 ALA H 1.0 0.0 5.09 1443 679 A 116 VAL HB A 119 ALA H 1.0 0.0 5.47 1444 680 A 122 ALA HB1 A 119 ALA H 1.0 0.0 4.99 1445 681 A 118 ALA HB1 A 119 ALA H 1.0 0.0 3.39 1446 682 A 119 ALA H A 116 VAL HG11 1.0 0.0 5.54 1447 682 A 116 VAL HG21 A 119 ALA H 1.0 0.0 5.54 1448 683 A 119 ALA HB1 A 119 ALA H 1.0 0.0 3.12 1449 684 A 63 ILE HD11 A 119 ALA H 1.0 0.0 5.64 1450 685 A 121 LYS H A 118 ALA H 1.0 0.0 5.14 1451 686 A 118 ALA H A 117 LEU H 1.0 0.0 3.09 1452 687 A 29 LEU H A 30 ARG H 1.0 0.0 4.49 1453 688 A 118 ALA H A 116 VAL HG11 1.0 0.0 6.00 1454 688 A 116 VAL HG21 A 118 ALA H 1.0 0.0 6.00 1455 689 A 119 ALA HB1 A 118 ALA H 1.0 0.0 4.92 1456 690 A 29 LEU H A 26 LYS HG2 1.0 0.0 4.86 1457 690 A 29 LEU H A 26 LYS HG3 1.0 0.0 4.86 1458 691 A 118 ALA HB1 A 118 ALA H 1.0 0.0 3.14 1459 692 A 29 LEU H A 29 LEU HG 1.0 0.0 2.92 1460 693 A 118 ALA H A 117 LEU HB2 1.0 0.0 3.02 1461 693 A 117 LEU HB3 A 118 ALA H 1.0 0.0 3.02 1462 694 A 29 LEU H A 28 PRO HB2 1.0 0.0 3.47 1463 694 A 29 LEU H A 28 PRO HB3 1.0 0.0 3.47 1464 695 A 29 LEU H A 28 PRO HB2 1.0 0.0 4.39 1465 695 A 29 LEU H A 28 PRO HB3 1.0 0.0 4.39 1466 696 A 119 ALA HA A 118 ALA H 1.0 0.0 5.33 1467 697 A 29 LEU H A 27 GLY HA2 1.0 0.0 4.60 1468 697 A 29 LEU H A 27 GLY HA3 1.0 0.0 4.60 1469 698 A 29 LEU H A 28 PRO HD2 1.0 0.0 3.95 1470 698 A 29 LEU H A 28 PRO HD3 1.0 0.0 3.95 1471 699 A 114 SER HA A 118 ALA H 1.0 0.0 4.02 1472 700 A 29 LEU H A 27 GLY HA2 1.0 0.0 4.60 1473 700 A 29 LEU H A 27 GLY HA3 1.0 0.0 4.60 1474 701 A 29 LEU H A 30 ARG HA 1.0 0.0 5.18 1475 702 A 116 VAL H A 117 LEU H 1.0 0.0 3.32 1476 703 A 116 VAL H A 118 ALA H 1.0 0.0 4.40 1477 704 A 117 LEU H A 113 LEU HA 1.0 0.0 4.33 1478 705 A 116 VAL H A 116 VAL HG11 1.0 0.0 3.43 1479 705 A 116 VAL HG21 A 116 VAL H 1.0 0.0 3.43 1480 706 A 117 LEU H A 116 VAL HG11 1.0 0.0 4.34 1481 706 A 116 VAL HG21 A 117 LEU H 1.0 0.0 4.34 1482 707 A 119 ALA HB1 A 116 VAL H 1.0 0.0 5.21 1483 708 A 119 ALA HB1 A 117 LEU H 1.0 0.0 5.24 1484 709 A 117 LEU H A 116 VAL HG11 1.0 0.0 3.88 1485 709 A 116 VAL HG21 A 117 LEU H 1.0 0.0 3.88 1486 710 A 116 VAL H A 115 ALA HB1 1.0 0.0 3.64 1487 711 A 118 ALA HB1 A 117 LEU H 1.0 0.0 5.27 1488 712 A 116 VAL H A 18 ALA HB1 1.0 0.0 4.60 1489 713 A 117 LEU H A 117 LEU HB2 1.0 0.0 3.31 1490 713 A 117 LEU HB3 A 117 LEU H 1.0 0.0 3.31 1491 714 A 116 VAL H A 116 VAL HB 1.0 0.0 3.05 1492 715 A 117 LEU H A 117 LEU HB2 1.0 0.0 3.07 1493 715 A 117 LEU HB3 A 117 LEU H 1.0 0.0 3.07 1494 716 A 117 LEU H A 116 VAL HB 1.0 0.0 3.37 1495 717 A 114 SER H A 115 ALA H 1.0 0.0 3.01 1496 718 A 116 VAL H A 115 ALA H 1.0 0.0 3.03 1497 719 A 117 LEU H A 115 ALA H 1.0 0.0 4.38 1498 720 A 113 LEU H A 115 ALA H 1.0 0.0 4.31 1499 721 A 118 ALA H A 115 ALA H 1.0 0.0 4.86 1500 722 A 113 LEU H A 114 SER H 1.0 0.0 3.37 1501 723 A 112 PHE H A 113 LEU H 1.0 0.0 3.45 1502 724 A 114 SER HA A 115 ALA H 1.0 0.0 3.55 1503 725 A 112 PHE HA A 115 ALA H 1.0 0.0 3.85 1504 726 A 113 LEU HA A 115 ALA H 1.0 0.0 4.79 1505 727 A 115 ALA H A 116 VAL HG11 1.0 0.0 5.16 1506 727 A 116 VAL HG21 A 115 ALA H 1.0 0.0 5.16 1507 728 A 115 ALA HB1 A 115 ALA H 1.0 0.0 3.17 1508 729 A 18 ALA HB1 A 115 ALA H 1.0 0.0 4.70 1509 730 A 115 ALA H A 113 LEU HB2 1.0 0.0 5.50 1510 730 A 113 LEU HB3 A 115 ALA H 1.0 0.0 5.50 1511 731 A 115 ALA H A 117 LEU HB2 1.0 0.0 5.40 1512 731 A 117 LEU HB3 A 115 ALA H 1.0 0.0 5.40 1513 732 A 113 LEU H A 116 VAL HG11 1.0 0.0 5.87 1514 732 A 116 VAL HG21 A 113 LEU H 1.0 0.0 5.87 1515 733 A 113 LEU H A 103 ILE HD11 1.0 0.0 6.00 1516 734 A 27 GLY H A 26 LYS HG2 1.0 0.0 4.50 1517 734 A 26 LYS HG3 A 27 GLY H 1.0 0.0 4.50 1518 735 A 27 GLY H A 26 LYS HB2 1.0 0.0 4.20 1519 735 A 26 LYS HB3 A 27 GLY H 1.0 0.0 4.20 1520 736 A 27 GLY H A 26 LYS HB2 1.0 0.0 4.20 1521 736 A 26 LYS HB3 A 27 GLY H 1.0 0.0 4.20 1522 737 A 113 LEU H A 113 LEU HB2 1.0 0.0 2.92 1523 737 A 113 LEU H A 113 LEU HB3 1.0 0.0 2.92 1524 738 A 113 LEU H A 112 PHE HB2 1.0 0.0 4.22 1525 738 A 112 PHE HB3 A 113 LEU H 1.0 0.0 4.22 1526 739 A 113 LEU H A 112 PHE HB2 1.0 0.0 3.79 1527 739 A 112 PHE HB3 A 113 LEU H 1.0 0.0 3.79 1528 740 A 27 GLY H A 28 PRO HD2 1.0 0.0 3.90 1529 740 A 28 PRO HD3 A 27 GLY H 1.0 0.0 3.90 1530 741 A 27 GLY H A 28 PRO HD2 1.0 0.0 3.58 1531 741 A 28 PRO HD3 A 27 GLY H 1.0 0.0 3.58 1532 742 A 113 LEU H A 110 LEU HA 1.0 0.0 3.58 1533 743 A 12 VAL H A 13 GLY H 1.0 0.0 3.70 1534 744 A 112 PHE H A 103 ILE HD11 1.0 0.0 6.00 1535 745 A 18 ALA HB1 A 112 PHE H 1.0 0.0 5.01 1536 746 A 112 PHE H A 112 PHE HB2 1.0 0.0 3.60 1537 746 A 112 PHE H A 112 PHE HB3 1.0 0.0 3.60 1538 747 A 112 PHE H A 112 PHE HB2 1.0 0.0 3.36 1539 747 A 112 PHE H A 112 PHE HB3 1.0 0.0 3.36 1540 748 A 93 GLY H A 96 ILE HD11 1.0 0.0 4.46 1541 749 A 93 GLY H A 96 ILE HG21 1.0 0.0 5.69 1542 750 A 93 GLY H A 92 GLN HB2 1.0 0.0 4.62 1543 750 A 93 GLY H A 92 GLN HB3 1.0 0.0 4.62 1544 751 A 93 GLY H A 92 GLN HB2 1.0 0.0 4.62 1545 751 A 93 GLY H A 92 GLN HB3 1.0 0.0 4.62 1546 752 A 93 GLY H A 92 GLN HG2 1.0 0.0 4.74 1547 752 A 93 GLY H A 92 GLN HG3 1.0 0.0 4.74 1548 753 A 93 GLY H A 92 GLN HG2 1.0 0.0 4.74 1549 753 A 93 GLY H A 92 GLN HG3 1.0 0.0 4.74 1550 754 A 112 PHE H A 111 LYS H 1.0 0.0 3.52 1551 755 A 111 LYS H A 110 LEU H 1.0 0.0 3.54 1552 756 A 111 LYS H A 109 CYS H 1.0 0.0 4.44 1553 757 A 113 LEU H A 111 LYS H 1.0 0.0 4.45 1554 758 A 111 LYS H A 108 HIS HA 1.0 0.0 4.01 1555 759 A 111 LYS H A 112 PHE HB2 1.0 0.0 5.06 1556 759 A 112 PHE HB3 A 111 LYS H 1.0 0.0 5.06 1557 760 A 111 LYS H A 110 LEU HB2 1.0 0.0 4.21 1558 760 A 111 LYS H A 110 LEU HB3 1.0 0.0 4.21 1559 761 A 111 LYS H A 111 LYS HB2 1.0 0.0 3.29 1560 761 A 111 LYS H A 111 LYS HB3 1.0 0.0 3.29 1561 762 A 111 LYS H A 110 LEU HD11 1.0 0.0 4.26 1562 762 A 111 LYS H A 110 LEU HD21 1.0 0.0 4.26 1563 763 A 110 LEU H A 110 LEU HD11 1.0 0.0 3.80 1564 763 A 110 LEU HD21 A 110 LEU H 1.0 0.0 3.80 1565 764 A 110 LEU H A 110 LEU HB2 1.0 0.0 3.80 1566 764 A 110 LEU H A 110 LEU HB3 1.0 0.0 3.80 1567 765 A 110 LEU HG A 110 LEU H 1.0 0.0 2.90 1568 766 A 110 LEU H A 106 GLU HG2 1.0 0.0 4.45 1569 766 A 110 LEU H A 106 GLU HG3 1.0 0.0 4.45 1570 767 A 110 LEU H A 108 HIS HB2 1.0 0.0 5.50 1571 767 A 110 LEU H A 108 HIS HB3 1.0 0.0 5.50 1572 768 A 110 LEU H A 109 CYS HB2 1.0 0.0 4.10 1573 768 A 110 LEU H A 109 CYS HB3 1.0 0.0 4.10 1574 769 A 110 LEU H A 109 CYS HB2 1.0 0.0 4.10 1575 769 A 110 LEU H A 109 CYS HB3 1.0 0.0 4.10 1576 770 A 110 LEU H A 106 GLU HA 1.0 0.0 4.16 1577 771 A 110 LEU H A 109 CYS H 1.0 0.0 3.43 1578 772 A 103 ILE HD11 A 109 CYS H 1.0 0.0 5.88 1579 773 A 103 ILE HG21 A 109 CYS H 1.0 0.0 4.12 1580 774 A 110 LEU HG A 109 CYS H 1.0 0.0 4.19 1581 775 A 109 CYS H A 106 GLU HG2 1.0 0.0 5.35 1582 775 A 106 GLU HG3 A 109 CYS H 1.0 0.0 5.35 1583 776 A 109 CYS H A 105 ASP HB2 1.0 0.0 4.37 1584 776 A 105 ASP HB3 A 109 CYS H 1.0 0.0 4.37 1585 777 A 109 CYS H A 108 HIS HB2 1.0 0.0 3.61 1586 777 A 108 HIS HB3 A 109 CYS H 1.0 0.0 3.61 1587 778 A 109 CYS H A 108 HIS HB2 1.0 0.0 3.49 1588 778 A 108 HIS HB3 A 109 CYS H 1.0 0.0 3.49 1589 779 A 109 CYS H A 109 CYS HB2 1.0 0.0 3.60 1590 779 A 109 CYS HB3 A 109 CYS H 1.0 0.0 3.60 1591 780 A 109 CYS H A 109 CYS HB2 1.0 0.0 3.60 1592 780 A 109 CYS HB3 A 109 CYS H 1.0 0.0 3.60 1593 781 A 106 GLU HA A 109 CYS H 1.0 0.0 3.76 1594 782 A 107 GLU H A 108 HIS H 1.0 0.0 3.07 1595 783 A 109 CYS H A 108 HIS H 1.0 0.0 3.34 1596 784 A 108 HIS H A 106 GLU H 1.0 0.0 4.63 1597 785 A 106 GLU HA A 108 HIS H 1.0 0.0 4.66 1598 786 A 108 HIS H A 108 HIS HB2 1.0 0.0 3.31 1599 786 A 108 HIS HB3 A 108 HIS H 1.0 0.0 3.31 1600 787 A 108 HIS H A 108 HIS HB2 1.0 0.0 3.70 1601 787 A 108 HIS HB3 A 108 HIS H 1.0 0.0 3.70 1602 788 A 108 HIS H A 105 ASP HB2 1.0 0.0 4.04 1603 788 A 105 ASP HB3 A 108 HIS H 1.0 0.0 4.04 1604 789 A 108 HIS H A 105 ASP HB2 1.0 0.0 4.16 1605 789 A 105 ASP HB3 A 108 HIS H 1.0 0.0 4.16 1606 790 A 107 GLU H A 109 CYS H 1.0 0.0 4.69 1607 791 A 107 GLU H A 108 HIS HA 1.0 0.0 5.50 1608 792 A 107 GLU H A 108 HIS HB2 1.0 0.0 5.29 1609 792 A 108 HIS HB3 A 107 GLU H 1.0 0.0 5.29 1610 793 A 107 GLU H A 106 GLU HB2 1.0 0.0 2.88 1611 793 A 107 GLU H A 106 GLU HB3 1.0 0.0 2.88 1612 794 A 107 GLU H A 107 GLU HG2 1.0 0.0 3.82 1613 794 A 107 GLU H A 107 GLU HG3 1.0 0.0 3.82 1614 795 A 107 GLU H A 110 LEU HD11 1.0 0.0 4.70 1615 795 A 110 LEU HD21 A 107 GLU H 1.0 0.0 4.70 1616 796 A 110 LEU HG A 107 GLU H 1.0 0.0 4.75 1617 797 A 105 ASP H A 106 GLU H 1.0 0.0 4.52 1618 798 A 107 GLU H A 106 GLU H 1.0 0.0 3.58 1619 799 A 106 GLU H A 105 ASP HA 1.0 0.0 3.00 1620 800 A 106 GLU H A 86 GLY HA2 1.0 0.0 4.96 1621 800 A 106 GLU H A 86 GLY HA3 1.0 0.0 4.96 1622 801 A 106 GLU H A 108 HIS HB2 1.0 0.0 5.00 1623 801 A 108 HIS HB3 A 106 GLU H 1.0 0.0 5.00 1624 802 A 106 GLU H A 105 ASP HB2 1.0 0.0 4.44 1625 802 A 105 ASP HB3 A 106 GLU H 1.0 0.0 4.44 1626 803 A 106 GLU H A 105 ASP HB2 1.0 0.0 3.98 1627 803 A 105 ASP HB3 A 106 GLU H 1.0 0.0 3.98 1628 804 A 106 GLU H A 106 GLU HG2 1.0 0.0 4.12 1629 804 A 106 GLU HG3 A 106 GLU H 1.0 0.0 4.12 1630 805 A 106 GLU H A 106 GLU HB2 1.0 0.0 3.11 1631 805 A 106 GLU HB3 A 106 GLU H 1.0 0.0 3.11 1632 806 A 106 GLU H A 106 GLU HB2 1.0 0.0 3.12 1633 806 A 106 GLU HB3 A 106 GLU H 1.0 0.0 3.12 1634 807 A 105 ASP H A 87 CYS H 1.0 0.0 5.43 1635 808 A 105 ASP H A 86 GLY H 1.0 0.0 5.50 1636 809 A 105 ASP H A 108 HIS H 1.0 0.0 5.50 1637 810 A 105 ASP H A 86 GLY HA2 1.0 0.0 4.52 1638 810 A 105 ASP H A 86 GLY HA3 1.0 0.0 4.52 1639 811 A 105 ASP H A 104 PRO HD2 1.0 0.0 4.24 1640 811 A 105 ASP H A 104 PRO HD3 1.0 0.0 4.24 1641 812 A 105 ASP H A 22 GLY HA2 1.0 0.0 5.50 1642 812 A 105 ASP H A 22 GLY HA3 1.0 0.0 5.50 1643 813 A 105 ASP H A 104 PRO HD2 1.0 0.0 4.24 1644 813 A 105 ASP H A 104 PRO HD3 1.0 0.0 4.24 1645 814 A 105 ASP H A 108 HIS HB2 1.0 0.0 5.08 1646 814 A 108 HIS HB3 A 105 ASP H 1.0 0.0 5.08 1647 815 A 105 ASP H A 108 HIS HB2 1.0 0.0 4.44 1648 815 A 108 HIS HB3 A 105 ASP H 1.0 0.0 4.44 1649 816 A 105 ASP H A 104 PRO HB2 1.0 0.0 4.60 1650 816 A 104 PRO HB3 A 105 ASP H 1.0 0.0 4.60 1651 817 A 105 ASP H A 104 PRO HG2 1.0 0.0 4.31 1652 817 A 105 ASP H A 104 PRO HG3 1.0 0.0 4.31 1653 818 A 105 ASP H A 105 ASP HB2 1.0 0.0 3.71 1654 818 A 105 ASP HB3 A 105 ASP H 1.0 0.0 3.71 1655 819 A 105 ASP H A 105 ASP HB2 1.0 0.0 3.48 1656 819 A 105 ASP HB3 A 105 ASP H 1.0 0.0 3.48 1657 820 A 103 ILE HG21 A 105 ASP H 1.0 0.0 3.84 1658 821 A 105 ASP H A 103 ILE HD11 1.0 0.0 5.49 1659 822 A 102 GLU H A 103 ILE H 1.0 0.0 4.65 1660 823 A 103 ILE H A 88 LYS HA 1.0 0.0 3.92 1661 824 A 103 ILE H A 102 GLU HA 1.0 0.0 3.09 1662 825 A 103 ILE H A 104 PRO HD2 1.0 0.0 4.83 1663 825 A 104 PRO HD3 A 103 ILE H 1.0 0.0 4.83 1664 826 A 103 ILE H A 104 PRO HD2 1.0 0.0 4.83 1665 826 A 104 PRO HD3 A 103 ILE H 1.0 0.0 4.83 1666 827 A 103 ILE H A 86 GLY HA2 1.0 0.0 5.11 1667 827 A 86 GLY HA3 A 103 ILE H 1.0 0.0 5.11 1668 828 A 103 ILE H A 87 CYS HB2 1.0 0.0 5.32 1669 828 A 87 CYS HB3 A 103 ILE H 1.0 0.0 5.32 1670 829 A 103 ILE H A 87 CYS HB2 1.0 0.0 5.50 1671 829 A 87 CYS HB3 A 103 ILE H 1.0 0.0 5.50 1672 830 A 103 ILE HB A 103 ILE H 1.0 0.0 3.56 1673 831 A 103 ILE H A 102 GLU HG2 1.0 0.0 3.77 1674 831 A 102 GLU HG3 A 103 ILE H 1.0 0.0 3.77 1675 832 A 103 ILE H A 102 GLU HG2 1.0 0.0 3.77 1676 832 A 102 GLU HG3 A 103 ILE H 1.0 0.0 3.77 1677 833 A 103 ILE H A 102 GLU HB2 1.0 0.0 3.88 1678 833 A 103 ILE H A 102 GLU HB3 1.0 0.0 3.88 1679 834 A 103 ILE H A 103 ILE HG12 1.0 0.0 3.95 1680 834 A 103 ILE HG13 A 103 ILE H 1.0 0.0 3.95 1681 835 A 103 ILE HD11 A 103 ILE H 1.0 0.0 4.56 1682 836 A 103 ILE HG21 A 103 ILE H 1.0 0.0 4.52 1683 837 A 89 ILE HG21 A 103 ILE H 1.0 0.0 5.47 1684 838 A 102 GLU H A 23 MET H 1.0 0.0 3.80 1685 839 A 102 GLU H A 101 PHE HA 1.0 0.0 3.32 1686 840 A 102 GLU H A 25 MET H 1.0 0.0 4.67 1687 841 A 102 GLU H A 24 GLU HA 1.0 0.0 4.03 1688 842 A 102 GLU H A 101 PHE HB2 1.0 0.0 3.92 1689 842 A 102 GLU H A 101 PHE HB3 1.0 0.0 3.92 1690 843 A 102 GLU H A 101 PHE HB2 1.0 0.0 3.96 1691 843 A 102 GLU H A 101 PHE HB3 1.0 0.0 3.96 1692 844 A 102 GLU H A 25 MET HG2 1.0 0.0 4.72 1693 844 A 102 GLU H A 25 MET HG3 1.0 0.0 4.72 1694 845 A 102 GLU H A 102 GLU HG2 1.0 0.0 4.79 1695 845 A 102 GLU H A 102 GLU HG3 1.0 0.0 4.79 1696 846 A 102 GLU H A 102 GLU HB2 1.0 0.0 3.47 1697 846 A 102 GLU H A 102 GLU HB3 1.0 0.0 3.47 1698 847 A 102 GLU H A 23 MET HB2 1.0 0.0 4.22 1699 847 A 102 GLU H A 23 MET HB3 1.0 0.0 4.22 1700 848 A 102 GLU H A 23 MET HB2 1.0 0.0 5.46 1701 848 A 102 GLU H A 23 MET HB3 1.0 0.0 5.46 1702 849 A 102 GLU H A 103 ILE HG12 1.0 0.0 4.70 1703 849 A 103 ILE HG13 A 102 GLU H 1.0 0.0 4.70 1704 850 A 102 GLU H A 89 ILE HD11 1.0 0.0 6.00 1705 851 A 103 ILE HD11 A 102 GLU H 1.0 0.0 5.28 1706 852 A 102 GLU H A 101 PHE H 1.0 0.0 4.64 1707 853 A 101 PHE H A 100 ARG HA 1.0 0.0 3.23 1708 854 A 101 PHE H A 101 PHE HB2 1.0 0.0 3.84 1709 854 A 101 PHE HB3 A 101 PHE H 1.0 0.0 3.84 1710 855 A 101 PHE H A 101 PHE HB2 1.0 0.0 4.17 1711 855 A 101 PHE HB3 A 101 PHE H 1.0 0.0 4.17 1712 856 A 101 PHE H A 90 ARG HD2 1.0 0.0 5.50 1713 856 A 90 ARG HD3 A 101 PHE H 1.0 0.0 5.50 1714 857 A 101 PHE H A 100 ARG HD2 1.0 0.0 5.50 1715 857 A 100 ARG HD3 A 101 PHE H 1.0 0.0 5.50 1716 858 A 101 PHE H A 25 MET HG2 1.0 0.0 5.50 1717 858 A 25 MET HG3 A 101 PHE H 1.0 0.0 5.50 1718 859 A 101 PHE H A 102 GLU HB2 1.0 0.0 4.70 1719 859 A 102 GLU HB3 A 101 PHE H 1.0 0.0 4.70 1720 860 A 101 PHE H A 100 ARG HB2 1.0 0.0 4.35 1721 860 A 100 ARG HB3 A 101 PHE H 1.0 0.0 4.35 1722 861 A 101 PHE H A 88 LYS HB2 1.0 0.0 4.25 1723 861 A 88 LYS HB3 A 101 PHE H 1.0 0.0 4.25 1724 862 A 25 MET HE1 A 101 PHE H 1.0 0.0 4.60 1725 863 A 101 PHE H A 100 ARG HB2 1.0 0.0 4.35 1726 863 A 100 ARG HB3 A 101 PHE H 1.0 0.0 4.35 1727 864 A 101 PHE H A 100 ARG HG2 1.0 0.0 4.48 1728 864 A 101 PHE H A 100 ARG HG3 1.0 0.0 4.48 1729 865 A 89 ILE HG21 A 101 PHE H 1.0 0.0 5.71 1730 866 A 89 ILE HD11 A 101 PHE H 1.0 0.0 5.04 1731 867 A 33 CYS H A 23 MET HA 1.0 0.0 3.55 1732 868 A 23 MET H A 33 CYS H 1.0 0.0 4.66 1733 869 A 33 CYS H A 32 PRO HA 1.0 0.0 3.05 1734 870 A 33 CYS H A 50 LEU HA 1.0 0.0 5.50 1735 871 A 33 CYS H A 32 PRO HB2 1.0 0.0 4.17 1736 871 A 32 PRO HB3 A 33 CYS H 1.0 0.0 4.17 1737 872 A 33 CYS H A 32 PRO HB2 1.0 0.0 3.76 1738 872 A 32 PRO HB3 A 33 CYS H 1.0 0.0 3.76 1739 873 A 23 MET HE1 A 33 CYS H 1.0 0.0 4.65 1740 874 A 33 CYS H A 23 MET HB2 1.0 0.0 4.81 1741 874 A 33 CYS H A 23 MET HB3 1.0 0.0 4.81 1742 875 A 24 GLU H A 23 MET HA 1.0 0.0 3.36 1743 876 A 24 GLU H A 33 CYS HB2 1.0 0.0 4.84 1744 876 A 33 CYS HB3 A 24 GLU H 1.0 0.0 4.84 1745 877 A 33 CYS H A 24 GLU H 1.0 0.0 4.44 1746 878 A 24 GLU H A 31 GLU H 1.0 0.0 4.03 1747 879 A 25 MET H A 24 GLU H 1.0 0.0 4.61 1748 880 A 24 GLU H A 23 MET HG2 1.0 0.0 5.50 1749 880 A 23 MET HG3 A 24 GLU H 1.0 0.0 5.50 1750 881 A 24 GLU H A 23 MET HG2 1.0 0.0 5.50 1751 881 A 23 MET HG3 A 24 GLU H 1.0 0.0 5.50 1752 882 A 24 GLU H A 32 PRO HB2 1.0 0.0 5.50 1753 882 A 32 PRO HB3 A 24 GLU H 1.0 0.0 5.50 1754 883 A 24 GLU H A 23 MET HB2 1.0 0.0 3.94 1755 883 A 24 GLU H A 23 MET HB3 1.0 0.0 3.94 1756 884 A 79 ILE H A 79 ILE HB 1.0 0.0 3.04 1757 885 A 79 ILE HD11 A 79 ILE H 1.0 0.0 4.84 1758 886 A 79 ILE H A 79 ILE HG12 1.0 0.0 4.10 1759 886 A 79 ILE H A 79 ILE HG13 1.0 0.0 4.10 1760 887 A 79 ILE H A 79 ILE HG12 1.0 0.0 4.10 1761 887 A 79 ILE H A 79 ILE HG13 1.0 0.0 4.10 1762 888 A 79 ILE H A 78 LEU H 1.0 0.0 3.17 1763 889 A 78 LEU H A 77 LEU H 1.0 0.0 3.12 1764 890 A 77 LEU H A 76 THR H 1.0 0.0 3.20 1765 891 A 76 THR HA A 77 LEU H 1.0 0.0 3.38 1766 892 A 77 LEU H A 77 LEU HD11 1.0 0.0 4.58 1767 892 A 77 LEU H A 77 LEU HD21 1.0 0.0 4.58 1768 893 A 77 LEU H A 77 LEU HD11 1.0 0.0 4.58 1769 893 A 77 LEU H A 77 LEU HD21 1.0 0.0 4.58 1770 894 A 76 THR HG21 A 77 LEU H 1.0 0.0 4.26 1771 895 A 77 LEU H A 77 LEU HG 1.0 0.0 2.83 1772 896 A 77 LEU H A 75 GLU HG2 1.0 0.0 5.11 1773 896 A 75 GLU HG3 A 77 LEU H 1.0 0.0 5.11 1774 897 A 79 ILE H A 78 LEU HB2 1.0 0.0 3.81 1775 897 A 79 ILE H A 78 LEU HB3 1.0 0.0 3.81 1776 898 A 79 ILE HA A 78 LEU H 1.0 0.0 5.07 1777 899 A 78 LEU H A 76 THR HG21 1.0 0.0 5.65 1778 900 A 76 THR H A 75 GLU H 1.0 0.0 3.56 1779 901 A 76 THR H A 75 GLU HA 1.0 0.0 3.22 1780 902 A 76 THR H A 76 THR HB 1.0 0.0 3.40 1781 903 A 76 THR H A 75 GLU HB2 1.0 0.0 4.77 1782 903 A 75 GLU HB3 A 76 THR H 1.0 0.0 4.77 1783 904 A 76 THR H A 75 GLU HB2 1.0 0.0 4.77 1784 904 A 75 GLU HB3 A 76 THR H 1.0 0.0 4.77 1785 905 A 76 THR H A 75 GLU HG2 1.0 0.0 3.73 1786 905 A 75 GLU HG3 A 76 THR H 1.0 0.0 3.73 1787 906 A 76 THR HG21 A 76 THR H 1.0 0.0 3.89 1788 907 A 73 ALA HB1 A 76 THR H 1.0 0.0 5.01 1789 908 A 76 THR H A 77 LEU HG 1.0 0.0 4.56 1790 909 A 75 GLU H A 73 ALA HA 1.0 0.0 4.46 1791 910 A 73 ALA HA A 74 GLU H 1.0 0.0 2.81 1792 911 A 75 GLU H A 74 GLU H 1.0 0.0 3.44 1793 912 A 76 THR H A 74 GLU H 1.0 0.0 5.01 1794 913 A 34 ALA H A 49 GLN H 1.0 0.0 3.95 1795 914 A 34 ALA H A 33 CYS HA 1.0 0.0 3.48 1796 915 A 74 GLU H A 74 GLU HG2 1.0 0.0 3.17 1797 915 A 74 GLU HG3 A 74 GLU H 1.0 0.0 3.17 1798 916 A 75 GLU H A 74 GLU HG2 1.0 0.0 4.39 1799 916 A 74 GLU HG3 A 75 GLU H 1.0 0.0 4.39 1800 917 A 75 GLU H A 75 GLU HG2 1.0 0.0 4.69 1801 917 A 75 GLU HG3 A 75 GLU H 1.0 0.0 4.69 1802 918 A 74 GLU H A 74 GLU HB2 1.0 0.0 3.87 1803 918 A 74 GLU H A 74 GLU HB3 1.0 0.0 3.87 1804 919 A 34 ALA H A 49 GLN HB2 1.0 0.0 3.21 1805 919 A 49 GLN HB3 A 34 ALA H 1.0 0.0 3.21 1806 920 A 74 GLU H A 74 GLU HB2 1.0 0.0 3.87 1807 920 A 74 GLU H A 74 GLU HB3 1.0 0.0 3.87 1808 921 A 75 GLU H A 74 GLU HB2 1.0 0.0 4.53 1809 921 A 75 GLU H A 74 GLU HB3 1.0 0.0 4.53 1810 922 A 75 GLU H A 74 GLU HB2 1.0 0.0 4.53 1811 922 A 75 GLU H A 74 GLU HB3 1.0 0.0 4.53 1812 923 A 73 ALA HB1 A 74 GLU H 1.0 0.0 3.57 1813 924 A 34 ALA H A 33 CYS HB2 1.0 0.0 3.72 1814 924 A 33 CYS HB3 A 34 ALA H 1.0 0.0 3.72 1815 925 A 34 ALA H A 33 CYS HB2 1.0 0.0 3.62 1816 925 A 33 CYS HB3 A 34 ALA H 1.0 0.0 3.62 1817 926 A 72 GLU H A 73 ALA H 1.0 0.0 4.74 1818 927 A 72 GLU HA A 73 ALA H 1.0 0.0 3.14 1819 928 A 73 ALA HB1 A 73 ALA H 1.0 0.0 3.52 1820 929 A 73 ALA H A 72 GLU HB2 1.0 0.0 4.58 1821 929 A 73 ALA H A 72 GLU HB3 1.0 0.0 4.58 1822 930 A 73 ALA H A 72 GLU HB2 1.0 0.0 4.58 1823 930 A 73 ALA H A 72 GLU HB3 1.0 0.0 4.58 1824 931 A 73 ALA H A 72 GLU HG2 1.0 0.0 4.01 1825 931 A 72 GLU HG3 A 73 ALA H 1.0 0.0 4.01 1826 932 A 73 ALA H A 71 GLN HG2 1.0 0.0 5.38 1827 932 A 71 GLN HG3 A 73 ALA H 1.0 0.0 5.38 1828 933 A 89 ILE H A 72 GLU H 1.0 0.0 5.44 1829 934 A 72 GLU H A 90 ARG H 1.0 0.0 5.50 1830 935 A 72 GLU H A 71 GLN H 1.0 0.0 4.63 1831 936 A 89 ILE HA A 72 GLU H 1.0 0.0 3.78 1832 937 A 72 GLU H A 71 GLN HA 1.0 0.0 3.24 1833 938 A 72 GLU H A 71 GLN HG2 1.0 0.0 3.53 1834 938 A 71 GLN HG3 A 72 GLU H 1.0 0.0 3.53 1835 939 A 72 GLU H A 72 GLU HG2 1.0 0.0 4.31 1836 939 A 72 GLU H A 72 GLU HG3 1.0 0.0 4.31 1837 940 A 72 GLU H A 71 GLN HB2 1.0 0.0 4.27 1838 940 A 72 GLU H A 71 GLN HB3 1.0 0.0 4.27 1839 941 A 72 GLU H A 72 GLU HB2 1.0 0.0 3.58 1840 941 A 72 GLU H A 72 GLU HB3 1.0 0.0 3.58 1841 942 A 72 GLU H A 72 GLU HB2 1.0 0.0 3.58 1842 942 A 72 GLU H A 72 GLU HB3 1.0 0.0 3.58 1843 943 A 72 GLU H A 71 GLN HB2 1.0 0.0 4.27 1844 943 A 72 GLU H A 71 GLN HB3 1.0 0.0 4.27 1845 944 A 71 GLN H A 70 VAL HA 1.0 0.0 2.98 1846 945 A 71 GLN H A 71 GLN HG2 1.0 0.0 4.13 1847 945 A 71 GLN HG3 A 71 GLN H 1.0 0.0 4.13 1848 946 A 71 GLN H A 70 VAL HB 1.0 0.0 3.45 1849 947 A 71 GLN H A 71 GLN HB2 1.0 0.0 3.59 1850 947 A 71 GLN HB3 A 71 GLN H 1.0 0.0 3.59 1851 948 A 71 GLN H A 71 GLN HB2 1.0 0.0 3.59 1852 948 A 71 GLN HB3 A 71 GLN H 1.0 0.0 3.59 1853 949 A 89 ILE HG21 A 71 GLN H 1.0 0.0 5.24 1854 950 A 71 GLN H A 70 VAL HG11 1.0 0.0 4.74 1855 950 A 70 VAL HG21 A 71 GLN H 1.0 0.0 4.74 1856 951 A 89 ILE HA A 70 VAL H 1.0 0.0 5.47 1857 952 A 70 VAL H A 90 ARG HA 1.0 0.0 5.50 1858 953 A 70 VAL H A 69 CYS HA 1.0 0.0 2.88 1859 954 A 70 VAL HB A 70 VAL H 1.0 0.0 3.90 1860 955 A 70 VAL H A 70 VAL HG11 1.0 0.0 4.26 1861 955 A 70 VAL HG21 A 70 VAL H 1.0 0.0 4.26 1862 956 A 70 VAL H A 70 VAL HG11 1.0 0.0 4.26 1863 956 A 70 VAL HG21 A 70 VAL H 1.0 0.0 4.26 1864 957 A 89 ILE HB A 70 VAL H 1.0 0.0 3.90 1865 958 A 70 VAL H A 90 ARG HB2 1.0 0.0 4.36 1866 958 A 90 ARG HB3 A 70 VAL H 1.0 0.0 4.36 1867 959 A 70 VAL H A 69 CYS HB2 1.0 0.0 4.56 1868 959 A 69 CYS HB3 A 70 VAL H 1.0 0.0 4.56 1869 960 A 70 VAL H A 69 CYS HB2 1.0 0.0 4.56 1870 960 A 69 CYS HB3 A 70 VAL H 1.0 0.0 4.56 1871 961 A 70 VAL H A 90 ARG HD2 1.0 0.0 5.06 1872 961 A 90 ARG HD3 A 70 VAL H 1.0 0.0 5.06 1873 962 A 70 VAL H A 91 VAL HA 1.0 0.0 4.26 1874 963 A 71 GLN H A 70 VAL H 1.0 0.0 4.63 1875 964 A 68 ARG HA A 69 CYS H 1.0 0.0 3.10 1876 965 A 69 CYS H A 68 ARG HD2 1.0 0.0 4.88 1877 965 A 68 ARG HD3 A 69 CYS H 1.0 0.0 4.88 1878 966 A 69 CYS H A 69 CYS HB2 1.0 0.0 4.05 1879 966 A 69 CYS HB3 A 69 CYS H 1.0 0.0 4.05 1880 967 A 69 CYS H A 69 CYS HB2 1.0 0.0 4.05 1881 967 A 69 CYS HB3 A 69 CYS H 1.0 0.0 4.05 1882 968 A 69 CYS H A 68 ARG HD2 1.0 0.0 4.88 1883 968 A 68 ARG HD3 A 69 CYS H 1.0 0.0 4.88 1884 969 A 69 CYS H A 68 ARG HG2 1.0 0.0 4.24 1885 969 A 69 CYS H A 68 ARG HG3 1.0 0.0 4.24 1886 970 A 69 CYS H A 68 ARG HB2 1.0 0.0 3.63 1887 970 A 68 ARG HB3 A 69 CYS H 1.0 0.0 3.63 1888 971 A 69 CYS H A 91 VAL HG11 1.0 0.0 5.70 1889 971 A 91 VAL HG21 A 69 CYS H 1.0 0.0 5.70 1890 972 A 69 CYS H A 91 VAL HG11 1.0 0.0 5.70 1891 972 A 91 VAL HG21 A 69 CYS H 1.0 0.0 5.70 1892 973 A 69 CYS H A 116 VAL HG11 1.0 0.0 5.92 1893 973 A 116 VAL HG21 A 69 CYS H 1.0 0.0 5.92 1894 974 A 68 ARG H A 92 GLN H 1.0 0.0 3.64 1895 975 A 68 ARG H A 67 PHE HA 1.0 0.0 3.18 1896 976 A 91 VAL HA A 68 ARG H 1.0 0.0 4.11 1897 977 A 68 ARG H A 67 PHE HB2 1.0 0.0 4.51 1898 977 A 67 PHE HB3 A 68 ARG H 1.0 0.0 4.51 1899 978 A 68 ARG H A 67 PHE HB2 1.0 0.0 4.51 1900 978 A 67 PHE HB3 A 68 ARG H 1.0 0.0 4.51 1901 979 A 68 ARG H A 68 ARG HG2 1.0 0.0 3.94 1902 979 A 68 ARG HG3 A 68 ARG H 1.0 0.0 3.94 1903 980 A 68 ARG H A 68 ARG HB2 1.0 0.0 3.51 1904 980 A 68 ARG HB3 A 68 ARG H 1.0 0.0 3.51 1905 981 A 68 ARG H A 68 ARG HD2 1.0 0.0 5.50 1906 981 A 68 ARG HD3 A 68 ARG H 1.0 0.0 5.50 1907 982 A 68 ARG H A 68 ARG HD2 1.0 0.0 5.50 1908 982 A 68 ARG HD3 A 68 ARG H 1.0 0.0 5.50 1909 983 A 68 ARG H A 92 GLN HB2 1.0 0.0 5.28 1910 983 A 92 GLN HB3 A 68 ARG H 1.0 0.0 5.28 1911 984 A 68 ARG H A 67 PHE H 1.0 0.0 4.68 1912 985 A 67 PHE H A 67 PHE HB2 1.0 0.0 3.34 1913 985 A 67 PHE HB3 A 67 PHE H 1.0 0.0 3.34 1914 986 A 67 PHE H A 67 PHE HB2 1.0 0.0 3.34 1915 986 A 67 PHE HB3 A 67 PHE H 1.0 0.0 3.34 1916 987 A 67 PHE H A 65 SER HB2 1.0 0.0 5.37 1917 987 A 65 SER HB3 A 67 PHE H 1.0 0.0 5.37 1918 988 A 63 ILE HG21 A 67 PHE H 1.0 0.0 5.70 1919 989 A 61 ILE HG21 A 67 PHE H 1.0 0.0 5.75 1920 990 A 67 PHE H A 68 ARG HG2 1.0 0.0 5.40 1921 990 A 68 ARG HG3 A 67 PHE H 1.0 0.0 5.40 1922 991 A 67 PHE H A 68 ARG HB2 1.0 0.0 5.50 1923 991 A 68 ARG HB3 A 67 PHE H 1.0 0.0 5.50 1924 992 A 66 HIS H A 67 PHE H 1.0 0.0 3.15 1925 993 A 64 ASN H A 63 ILE HG12 1.0 0.0 4.50 1926 993 A 63 ILE HG13 A 64 ASN H 1.0 0.0 4.50 1927 994 A 63 ILE HD11 A 64 ASN H 1.0 0.0 5.85 1928 995 A 63 ILE HG21 A 64 ASN H 1.0 0.0 4.11 1929 996 A 64 ASN H A 63 ILE HG12 1.0 0.0 5.06 1930 996 A 63 ILE HG13 A 64 ASN H 1.0 0.0 5.06 1931 997 A 61 ILE HG21 A 64 ASN H 1.0 0.0 5.48 1932 998 A 63 ILE HB A 64 ASN H 1.0 0.0 4.53 1933 999 A 64 ASN H A 62 PRO HB2 1.0 0.0 5.30 1934 999 A 64 ASN H A 62 PRO HB3 1.0 0.0 5.30 1935 1000 A 64 ASN H A 120 GLN HG2 1.0 0.0 5.50 1936 1000 A 120 GLN HG3 A 64 ASN H 1.0 0.0 5.50 1937 1001 A 63 ILE HA A 64 ASN H 1.0 0.0 3.01 1938 1002 A 64 ASN H A 67 PHE HB2 1.0 0.0 4.12 1939 1002 A 64 ASN H A 67 PHE HB3 1.0 0.0 4.12 1940 1003 A 64 ASN H A 67 PHE HA 1.0 0.0 4.93 1941 1004 A 67 PHE HD% A 64 ASN H 1.0 0.0 4.16 1942 1005 A 64 ASN H A 66 HIS H 1.0 0.0 4.52 1943 1006 A 64 ASN H A 63 ILE H 1.0 0.0 4.58 1944 1007 A 63 ILE H A 63 ILE HG12 1.0 0.0 4.37 1945 1007 A 63 ILE HG13 A 63 ILE H 1.0 0.0 4.37 1946 1008 A 63 ILE HD11 A 63 ILE H 1.0 0.0 4.67 1947 1009 A 46 LEU H A 63 ILE HG12 1.0 0.0 4.80 1948 1009 A 63 ILE HG13 A 46 LEU H 1.0 0.0 4.80 1949 1010 A 63 ILE HD11 A 46 LEU H 1.0 0.0 4.66 1950 1011 A 45 GLU H A 63 ILE HG12 1.0 0.0 5.50 1951 1011 A 63 ILE HG13 A 45 GLU H 1.0 0.0 5.50 1952 1012 A 63 ILE HD11 A 45 GLU H 1.0 0.0 4.64 1953 1013 A 63 ILE H A 45 GLU HA 1.0 0.0 3.74 1954 1014 A 38 ALA H A 45 GLU H 1.0 0.0 3.67 1955 1015 A 46 LEU H A 63 ILE H 1.0 0.0 4.41 1956 1016 A 44 TYR H A 63 ILE H 1.0 0.0 5.42 1957 1017 A 63 ILE H A 62 PRO HA 1.0 0.0 3.36 1958 1018 A 63 ILE H A 44 TYR HB2 1.0 0.0 4.55 1959 1018 A 44 TYR HB3 A 63 ILE H 1.0 0.0 4.55 1960 1019 A 63 ILE H A 62 PRO HB2 1.0 0.0 4.29 1961 1019 A 62 PRO HB3 A 63 ILE H 1.0 0.0 4.29 1962 1020 A 63 ILE H A 45 GLU HB2 1.0 0.0 3.86 1963 1020 A 45 GLU HB3 A 63 ILE H 1.0 0.0 3.86 1964 1021 A 63 ILE H A 62 PRO HB2 1.0 0.0 4.19 1965 1021 A 62 PRO HB3 A 63 ILE H 1.0 0.0 4.19 1966 1022 A 63 ILE H A 43 GLN HG2 1.0 0.0 4.75 1967 1022 A 43 GLN HG3 A 63 ILE H 1.0 0.0 4.75 1968 1023 A 63 ILE H A 62 PRO HG2 1.0 0.0 5.01 1969 1023 A 63 ILE H A 62 PRO HG3 1.0 0.0 5.01 1970 1024 A 63 ILE H A 45 GLU HB2 1.0 0.0 4.54 1971 1024 A 45 GLU HB3 A 63 ILE H 1.0 0.0 4.54 1972 1025 A 63 ILE HB A 63 ILE H 1.0 0.0 3.67 1973 1026 A 63 ILE H A 63 ILE HG12 1.0 0.0 3.85 1974 1026 A 63 ILE HG13 A 63 ILE H 1.0 0.0 3.85 1975 1027 A 63 ILE HG21 A 63 ILE H 1.0 0.0 4.45 1976 1028 A 61 ILE H A 48 ILE H 1.0 0.0 4.38 1977 1029 A 61 ILE H A 60 ILE HA 1.0 0.0 3.46 1978 1030 A 61 ILE H A 62 PRO HD2 1.0 0.0 4.89 1979 1030 A 61 ILE H A 62 PRO HD3 1.0 0.0 4.89 1980 1031 A 61 ILE H A 60 ILE HG21 1.0 0.0 4.13 1981 1032 A 61 ILE H A 61 ILE HD11 1.0 0.0 4.41 1982 1033 A 61 ILE H A 61 ILE HG21 1.0 0.0 4.49 1983 1034 A 61 ILE H A 61 ILE HG12 1.0 0.0 4.33 1984 1034 A 61 ILE H A 61 ILE HG13 1.0 0.0 4.33 1985 1035 A 61 ILE H A 61 ILE HG12 1.0 0.0 4.33 1986 1035 A 61 ILE H A 61 ILE HG13 1.0 0.0 4.33 1987 1036 A 61 ILE H A 61 ILE HB 1.0 0.0 3.80 1988 1037 A 61 ILE H A 60 ILE HB 1.0 0.0 4.39 1989 1038 A 61 ILE H A 45 GLU HB2 1.0 0.0 4.71 1990 1038 A 61 ILE H A 45 GLU HB3 1.0 0.0 4.71 1991 1039 A 61 ILE H A 45 GLU HG2 1.0 0.0 5.27 1992 1039 A 61 ILE H A 45 GLU HG3 1.0 0.0 5.27 1993 1040 A 61 ILE H A 60 ILE H 1.0 0.0 4.93 1994 1041 A 60 ILE H A 59 ASP HA 1.0 0.0 3.29 1995 1042 A 60 ILE HG21 A 60 ILE H 1.0 0.0 4.65 1996 1043 A 60 ILE HD11 A 60 ILE H 1.0 0.0 4.34 1997 1044 A 60 ILE HB A 60 ILE H 1.0 0.0 3.52 1998 1045 A 60 ILE H A 59 ASP HB2 1.0 0.0 4.47 1999 1045 A 59 ASP HB3 A 60 ILE H 1.0 0.0 4.47 2000 1046 A 60 ILE H A 59 ASP HB2 1.0 0.0 4.47 2001 1046 A 59 ASP HB3 A 60 ILE H 1.0 0.0 4.47 2002 1047 A 51 HIS H A 51 HIS HB2 1.0 0.0 4.09 2003 1047 A 51 HIS HB3 A 51 HIS H 1.0 0.0 4.09 2004 1048 A 51 HIS H A 51 HIS HB2 1.0 0.0 4.09 2005 1048 A 51 HIS HB3 A 51 HIS H 1.0 0.0 4.09 2006 1049 A 51 HIS H A 50 LEU HA 1.0 0.0 3.54 2007 1050 A 51 HIS H A 33 CYS HA 1.0 0.0 3.98 2008 1051 A 47 ILE HG21 A 59 ASP H 1.0 0.0 4.75 2009 1052 A 58 GLN H A 59 ASP H 1.0 0.0 4.41 2010 1053 A 57 VAL HA A 58 GLN H 1.0 0.0 3.08 2011 1054 A 59 ASP H A 58 GLN HA 1.0 0.0 3.51 2012 1055 A 48 ILE HB A 59 ASP H 1.0 0.0 4.18 2013 1056 A 59 ASP H A 58 GLN HB2 1.0 0.0 4.49 2014 1056 A 58 GLN HB3 A 59 ASP H 1.0 0.0 4.49 2015 1057 A 58 GLN H A 58 GLN HB2 1.0 0.0 3.49 2016 1057 A 58 GLN H A 58 GLN HB3 1.0 0.0 3.49 2017 1058 A 58 GLN H A 58 GLN HG2 1.0 0.0 5.00 2018 1058 A 58 GLN H A 58 GLN HG3 1.0 0.0 5.00 2019 1059 A 58 GLN H A 58 GLN HG2 1.0 0.0 5.00 2020 1059 A 58 GLN H A 58 GLN HG3 1.0 0.0 5.00 2021 1060 A 57 VAL HB A 58 GLN H 1.0 0.0 3.84 2022 1061 A 58 GLN H A 57 VAL HG11 1.0 0.0 4.89 2023 1061 A 57 VAL HG21 A 58 GLN H 1.0 0.0 4.89 2024 1062 A 47 ILE HG21 A 58 GLN H 1.0 0.0 6.00 2025 1063 A 58 GLN H A 57 VAL H 1.0 0.0 4.82 2026 1064 A 80 ASP H A 79 ILE HB 1.0 0.0 4.04 2027 1065 A 57 VAL H A 52 GLU HB2 1.0 0.0 4.35 2028 1065 A 57 VAL H A 52 GLU HB3 1.0 0.0 4.35 2029 1066 A 57 VAL H A 52 GLU HG2 1.0 0.0 4.71 2030 1066 A 57 VAL H A 52 GLU HG3 1.0 0.0 4.71 2031 1067 A 57 VAL H A 56 HIS HB2 1.0 0.0 4.41 2032 1067 A 57 VAL H A 56 HIS HB3 1.0 0.0 4.41 2033 1068 A 57 VAL H A 56 HIS HB2 1.0 0.0 4.41 2034 1068 A 57 VAL H A 56 HIS HB3 1.0 0.0 4.41 2035 1069 A 57 VAL H A 52 GLU H 1.0 0.0 4.10 2036 1070 A 100 ARG HE A 100 ARG HB2 1.0 0.0 5.19 2037 1070 A 100 ARG HB3 A 100 ARG HE 1.0 0.0 5.19 2038 1071 A 25 MET HE1 A 100 ARG HE 1.0 0.0 5.41 2039 1072 A 100 ARG HE A 100 ARG HB2 1.0 0.0 5.19 2040 1072 A 100 ARG HB3 A 100 ARG HE 1.0 0.0 5.19 2041 1073 A 84 ASN H A 84 ASN HB2 1.0 0.0 3.81 2042 1073 A 84 ASN H A 84 ASN HB3 1.0 0.0 3.81 2043 1074 A 84 ASN H A 84 ASN HB2 1.0 0.0 3.81 2044 1074 A 84 ASN H A 84 ASN HB3 1.0 0.0 3.81 2045 1075 A 84 ASN H A 83 SER HB2 1.0 0.0 3.99 2046 1075 A 83 SER HB3 A 84 ASN H 1.0 0.0 3.99 2047 1076 A 84 ASN H A 83 SER HA 1.0 0.0 3.04 2048 1077 A 84 ASN H A 83 SER H 1.0 0.0 4.33 2049 1078 A 84 ASN H A 85 SER H 1.0 0.0 4.44 2050 1079 A 82 ALA HB1 A 83 SER H 1.0 0.0 3.82 2051 1080 A 79 ILE HG21 A 83 SER H 1.0 0.0 4.80 2052 1081 A 81 ILE HG21 A 83 SER H 1.0 0.0 5.56 2053 1082 A 83 SER H A 83 SER HB2 1.0 0.0 3.10 2054 1082 A 83 SER HB3 A 83 SER H 1.0 0.0 3.10 2055 1083 A 82 ALA H A 83 SER H 1.0 0.0 3.41 2056 1084 A 82 ALA H A 81 ILE H 1.0 0.0 3.20 2057 1085 A 82 ALA H A 80 ASP HB2 1.0 0.0 5.50 2058 1085 A 82 ALA H A 80 ASP HB3 1.0 0.0 5.50 2059 1086 A 82 ALA H A 80 ASP HB2 1.0 0.0 5.50 2060 1086 A 82 ALA H A 80 ASP HB3 1.0 0.0 5.50 2061 1087 A 82 ALA H A 81 ILE HB 1.0 0.0 3.59 2062 1088 A 82 ALA H A 79 ILE HG21 1.0 0.0 3.93 2063 1089 A 82 ALA H A 82 ALA HB1 1.0 0.0 3.16 2064 1090 A 81 ILE H A 80 ASP HB2 1.0 0.0 4.07 2065 1090 A 81 ILE H A 80 ASP HB3 1.0 0.0 4.07 2066 1091 A 81 ILE H A 80 ASP HB2 1.0 0.0 4.07 2067 1091 A 81 ILE H A 80 ASP HB3 1.0 0.0 4.07 2068 1092 A 80 ASP H A 81 ILE H 1.0 0.0 3.08 2069 1093 A 81 ILE H A 83 SER H 1.0 0.0 4.38 2070 1094 A 81 ILE H A 81 ILE HB 1.0 0.0 2.97 2071 1095 A 81 ILE H A 81 ILE HD11 1.0 0.0 4.46 2072 1096 A 79 ILE HG21 A 81 ILE H 1.0 0.0 3.98 2073 1097 A 80 ASP H A 79 ILE HA 1.0 0.0 2.68 2074 1098 A 80 ASP H A 80 ASP HB2 1.0 0.0 3.75 2075 1098 A 80 ASP H A 80 ASP HB3 1.0 0.0 3.75 2076 1099 A 12 VAL H A 11 PRO HG2 1.0 0.0 4.49 2077 1099 A 11 PRO HG3 A 12 VAL H 1.0 0.0 4.49 2078 1100 A 80 ASP H A 82 ALA HB1 1.0 0.0 5.06 2079 1101 A 80 ASP H A 79 ILE HG21 1.0 0.0 3.86 2080 1102 A 57 VAL H A 57 VAL HG11 1.0 0.0 4.86 2081 1102 A 57 VAL HG21 A 57 VAL H 1.0 0.0 4.86 2082 1103 A 64 ASN HD21 A 62 PRO HG2 1.0 0.0 5.13 2083 1103 A 62 PRO HG3 A 64 ASN HD21 1.0 0.0 5.13 2084 1104 A 64 ASN HD22 A 62 PRO HG2 1.0 0.0 5.13 2085 1104 A 62 PRO HG3 A 64 ASN HD22 1.0 0.0 5.13 2086 1105 A 86 GLY H A 85 SER H 1.0 0.0 4.47 2087 1106 A 85 SER H A 84 ASN HA 1.0 0.0 2.66 2088 1107 A 85 SER H A 84 ASN HB2 1.0 0.0 4.62 2089 1107 A 84 ASN HB3 A 85 SER H 1.0 0.0 4.62 2090 1108 A 85 SER H A 84 ASN HB2 1.0 0.0 4.62 2091 1108 A 84 ASN HB3 A 85 SER H 1.0 0.0 4.62 2092 1109 A 85 SER H A 106 GLU HG2 1.0 0.0 4.81 2093 1109 A 106 GLU HG3 A 85 SER H 1.0 0.0 4.81 2094 1110 A 85 SER H A 106 GLU HB2 1.0 0.0 5.07 2095 1110 A 106 GLU HB3 A 85 SER H 1.0 0.0 5.07 2096 1111 A 87 CYS H A 86 GLY H 1.0 0.0 3.84 2097 1112 A 106 GLU H A 86 GLY H 1.0 0.0 4.18 2098 1113 A 86 GLY H A 85 SER HA 1.0 0.0 2.78 2099 1114 A 106 GLU HA A 86 GLY H 1.0 0.0 3.34 2100 1115 A 86 GLY H A 106 GLU HG2 1.0 0.0 3.83 2101 1115 A 106 GLU HG3 A 86 GLY H 1.0 0.0 3.83 2102 1116 A 86 GLY H A 106 GLU HB2 1.0 0.0 3.62 2103 1116 A 106 GLU HB3 A 86 GLY H 1.0 0.0 3.62 2104 1117 A 86 GLY H A 110 LEU HD11 1.0 0.0 6.00 2105 1117 A 110 LEU HD21 A 86 GLY H 1.0 0.0 6.00 2106 1118 A 87 CYS H A 103 ILE H 1.0 0.0 3.72 2107 1119 A 87 CYS H A 102 GLU HA 1.0 0.0 5.45 2108 1120 A 87 CYS H A 104 PRO HA 1.0 0.0 4.23 2109 1121 A 87 CYS H A 86 GLY HA2 1.0 0.0 3.19 2110 1121 A 86 GLY HA3 A 87 CYS H 1.0 0.0 3.19 2111 1122 A 87 CYS H A 86 GLY HA2 1.0 0.0 3.47 2112 1122 A 86 GLY HA3 A 87 CYS H 1.0 0.0 3.47 2113 1123 A 87 CYS H A 87 CYS HB2 1.0 0.0 3.68 2114 1123 A 87 CYS HB3 A 87 CYS H 1.0 0.0 3.68 2115 1124 A 87 CYS H A 87 CYS HB2 1.0 0.0 3.89 2116 1124 A 87 CYS HB3 A 87 CYS H 1.0 0.0 3.89 2117 1125 A 103 ILE HB A 87 CYS H 1.0 0.0 3.93 2118 1126 A 19 THR H A 111 LYS HB2 1.0 0.0 4.63 2119 1126 A 19 THR H A 111 LYS HB3 1.0 0.0 4.63 2120 1127 A 103 ILE HG21 A 87 CYS H 1.0 0.0 5.33 2121 1128 A 87 CYS H A 103 ILE HG12 1.0 0.0 5.38 2122 1128 A 103 ILE HG13 A 87 CYS H 1.0 0.0 5.38 2123 1129 A 103 ILE HD11 A 87 CYS H 1.0 0.0 6.00 2124 1130 A 95 TRP H A 96 ILE H 1.0 0.0 4.26 2125 1131 A 95 TRP H A 95 TRP HB2 1.0 0.0 4.10 2126 1131 A 95 TRP H A 95 TRP HB3 1.0 0.0 4.10 2127 1132 A 95 TRP H A 95 TRP HB2 1.0 0.0 4.10 2128 1132 A 95 TRP H A 95 TRP HB3 1.0 0.0 4.10 2129 1133 A 96 ILE HG21 A 95 TRP H 1.0 0.0 4.63 2130 1134 A 96 ILE H A 97 ARG H 1.0 0.0 4.97 2131 1135 A 93 GLY H A 96 ILE H 1.0 0.0 4.42 2132 1136 A 96 ILE H A 94 ASP HA 1.0 0.0 4.21 2133 1137 A 96 ILE H A 95 TRP HB2 1.0 0.0 5.24 2134 1137 A 96 ILE H A 95 TRP HB3 1.0 0.0 5.24 2135 1138 A 96 ILE H A 95 TRP HB2 1.0 0.0 5.24 2136 1138 A 96 ILE H A 95 TRP HB3 1.0 0.0 5.24 2137 1139 A 96 ILE HD11 A 96 ILE H 1.0 0.0 4.53 2138 1140 A 96 ILE HG21 A 96 ILE H 1.0 0.0 4.29 2139 1141 A 17 LEU H A 37 LEU H 1.0 0.0 5.06 2140 1142 A 17 LEU H A 38 ALA HA 1.0 0.0 3.61 2141 1143 A 96 ILE HD11 A 97 ARG H 1.0 0.0 5.21 2142 1144 A 96 ILE HG21 A 97 ARG H 1.0 0.0 4.29 2143 1145 A 97 ARG H A 97 ARG HB2 1.0 0.0 3.73 2144 1145 A 97 ARG HB3 A 97 ARG H 1.0 0.0 3.73 2145 1146 A 97 ARG H A 97 ARG HB2 1.0 0.0 3.73 2146 1146 A 97 ARG HB3 A 97 ARG H 1.0 0.0 3.73 2147 1147 A 97 ARG H A 97 ARG HG2 1.0 0.0 3.84 2148 1147 A 97 ARG H A 97 ARG HG3 1.0 0.0 3.84 2149 1148 A 97 ARG H A 96 ILE HB 1.0 0.0 3.54 2150 1149 A 97 ARG H A 97 ARG HD2 1.0 0.0 4.63 2151 1149 A 97 ARG H A 97 ARG HD3 1.0 0.0 4.63 2152 1150 A 97 ARG H A 96 ILE HA 1.0 0.0 3.40 2153 1151 A 4 GLY H A 3 LEU HB2 1.0 0.0 4.79 2154 1151 A 3 LEU HB3 A 4 GLY H 1.0 0.0 4.79 2155 1152 A 3 LEU H A 2 PRO HA 1.0 0.0 3.55 2156 1153 A 3 LEU H A 3 LEU HB2 1.0 0.0 3.37 2157 1153 A 3 LEU H A 3 LEU HB3 1.0 0.0 3.37 2158 1154 A 5 SER HA A 6 MET H 1.0 0.0 3.35 2159 1155 A 6 MET H A 5 SER HB2 1.0 0.0 4.54 2160 1155 A 6 MET H A 5 SER HB3 1.0 0.0 4.54 2161 1156 A 6 MET H A 6 MET HB2 1.0 0.0 4.09 2162 1156 A 6 MET H A 6 MET HB3 1.0 0.0 4.09 2163 1157 A 6 MET H A 6 MET HB2 1.0 0.0 4.09 2164 1157 A 6 MET H A 6 MET HB3 1.0 0.0 4.09 2165 1158 A 6 MET HA A 7 GLU H 1.0 0.0 3.47 2166 1159 A 7 GLU H A 7 GLU HB2 1.0 0.0 3.71 2167 1159 A 7 GLU HB3 A 7 GLU H 1.0 0.0 3.71 2168 1160 A 7 GLU H A 7 GLU HB2 1.0 0.0 3.71 2169 1160 A 7 GLU HB3 A 7 GLU H 1.0 0.0 3.71 2170 1161 A 7 GLU H A 7 GLU HG2 1.0 0.0 3.50 2171 1161 A 7 GLU H A 7 GLU HG3 1.0 0.0 3.50 2172 1162 A 7 GLU H A 6 MET HB2 1.0 0.0 4.41 2173 1162 A 6 MET HB3 A 7 GLU H 1.0 0.0 4.41 2174 1163 A 7 GLU H A 6 MET HB2 1.0 0.0 4.41 2175 1163 A 6 MET HB3 A 7 GLU H 1.0 0.0 4.41 2176 1164 A 10 LEU H A 10 LEU HA 1.0 0.0 2.85 2177 1165 A 10 LEU H A 9 PRO HD2 1.0 0.0 4.54 2178 1165 A 10 LEU H A 9 PRO HD3 1.0 0.0 4.54 2179 1166 A 10 LEU H A 9 PRO HD2 1.0 0.0 4.04 2180 1166 A 10 LEU H A 9 PRO HD3 1.0 0.0 4.04 2181 1167 A 10 LEU H A 8 PRO HB2 1.0 0.0 3.36 2182 1167 A 10 LEU H A 8 PRO HB3 1.0 0.0 3.36 2183 1168 A 10 LEU H A 9 PRO HG2 1.0 0.0 3.09 2184 1168 A 10 LEU H A 9 PRO HG3 1.0 0.0 3.09 2185 1169 A 10 LEU H A 10 LEU HB2 1.0 0.0 2.99 2186 1169 A 10 LEU H A 10 LEU HB3 1.0 0.0 2.99 2187 1170 A 10 LEU H A 10 LEU HB2 1.0 0.0 3.54 2188 1170 A 10 LEU H A 10 LEU HB3 1.0 0.0 3.54 2189 1171 A 10 LEU H A 9 PRO HB2 1.0 0.0 3.11 2190 1171 A 10 LEU H A 9 PRO HB3 1.0 0.0 3.11 2191 1172 A 10 LEU H A 10 LEU HD11 1.0 0.0 4.95 2192 1172 A 10 LEU H A 10 LEU HD21 1.0 0.0 4.95 2193 1173 A 12 VAL H A 12 VAL HG11 1.0 0.0 4.43 2194 1173 A 12 VAL HG21 A 12 VAL H 1.0 0.0 4.43 2195 1174 A 12 VAL H A 12 VAL HG11 1.0 0.0 3.52 2196 1174 A 12 VAL HG21 A 12 VAL H 1.0 0.0 3.52 2197 1175 A 112 PHE H A 111 LYS HB2 1.0 0.0 2.65 2198 1175 A 112 PHE H A 111 LYS HB3 1.0 0.0 2.65 2199 1176 A 12 VAL H A 11 PRO HA 1.0 0.0 2.79 2200 1177 A 12 VAL H A 11 PRO HB2 1.0 0.0 3.31 2201 1177 A 11 PRO HB3 A 12 VAL H 1.0 0.0 3.31 2202 1178 A 12 VAL H A 11 PRO HB2 1.0 0.0 3.34 2203 1178 A 11 PRO HB3 A 12 VAL H 1.0 0.0 3.34 2204 1179 A 12 VAL HB A 13 GLY H 1.0 0.0 4.49 2205 1180 A 13 GLY H A 12 VAL HG11 1.0 0.0 4.18 2206 1180 A 12 VAL HG21 A 13 GLY H 1.0 0.0 4.18 2207 1181 A 13 GLY H A 11 PRO HB2 1.0 0.0 5.11 2208 1181 A 11 PRO HB3 A 13 GLY H 1.0 0.0 5.11 2209 1182 A 13 GLY H A 14 ALA H 1.0 0.0 3.38 2210 1183 A 15 GLN H A 14 ALA H 1.0 0.0 4.69 2211 1184 A 12 VAL H A 14 ALA H 1.0 0.0 4.28 2212 1185 A 12 VAL HA A 14 ALA H 1.0 0.0 4.09 2213 1186 A 14 ALA H A 40 ARG HD2 1.0 0.0 4.42 2214 1186 A 40 ARG HD3 A 14 ALA H 1.0 0.0 4.42 2215 1187 A 14 ALA H A 40 ARG HD2 1.0 0.0 4.42 2216 1187 A 40 ARG HD3 A 14 ALA H 1.0 0.0 4.42 2217 1188 A 14 ALA H A 11 PRO HB2 1.0 0.0 5.33 2218 1188 A 11 PRO HB3 A 14 ALA H 1.0 0.0 5.33 2219 1189 A 14 ALA H A 15 GLN HG2 1.0 0.0 5.39 2220 1189 A 15 GLN HG3 A 14 ALA H 1.0 0.0 5.39 2221 1190 A 14 ALA HB1 A 14 ALA H 1.0 0.0 3.15 2222 1191 A 14 ALA H A 11 PRO HB2 1.0 0.0 3.94 2223 1191 A 11 PRO HB3 A 14 ALA H 1.0 0.0 3.94 2224 1192 A 14 ALA H A 11 PRO HG2 1.0 0.0 4.18 2225 1192 A 11 PRO HG3 A 14 ALA H 1.0 0.0 4.18 2226 1193 A 14 ALA H A 11 PRO HG2 1.0 0.0 4.58 2227 1193 A 11 PRO HG3 A 14 ALA H 1.0 0.0 4.58 2228 1194 A 15 GLN H A 38 ALA HA 1.0 0.0 4.47 2229 1195 A 15 GLN H A 14 ALA HA 1.0 0.0 2.81 2230 1196 A 15 GLN H A 16 PRO HD2 1.0 0.0 4.72 2231 1196 A 15 GLN H A 16 PRO HD3 1.0 0.0 4.72 2232 1197 A 15 GLN H A 16 PRO HD2 1.0 0.0 4.72 2233 1197 A 15 GLN H A 16 PRO HD3 1.0 0.0 4.72 2234 1198 A 15 GLN H A 40 ARG HD2 1.0 0.0 5.50 2235 1198 A 40 ARG HD3 A 15 GLN H 1.0 0.0 5.50 2236 1199 A 15 GLN H A 40 ARG HD2 1.0 0.0 5.50 2237 1199 A 40 ARG HD3 A 15 GLN H 1.0 0.0 5.50 2238 1200 A 15 GLN H A 15 GLN HG2 1.0 0.0 3.39 2239 1200 A 15 GLN H A 15 GLN HG3 1.0 0.0 3.39 2240 1201 A 15 GLN H A 15 GLN HB2 1.0 0.0 3.26 2241 1201 A 15 GLN H A 15 GLN HB3 1.0 0.0 3.26 2242 1202 A 14 ALA HB1 A 15 GLN H 1.0 0.0 3.55 2243 1203 A 38 ALA HB1 A 15 GLN H 1.0 0.0 3.95 2244 1204 A 15 GLN H A 40 ARG HB2 1.0 0.0 4.71 2245 1204 A 15 GLN H A 40 ARG HB3 1.0 0.0 4.71 2246 1205 A 15 GLN H A 39 GLN HB2 1.0 0.0 4.28 2247 1205 A 15 GLN H A 39 GLN HB3 1.0 0.0 4.28 2248 1206 A 17 LEU H A 16 PRO HA 1.0 0.0 3.23 2249 1207 A 17 LEU H A 17 LEU HB2 1.0 0.0 3.69 2250 1207 A 17 LEU H A 17 LEU HB3 1.0 0.0 3.69 2251 1208 A 17 LEU H A 17 LEU HB2 1.0 0.0 3.89 2252 1208 A 17 LEU H A 17 LEU HB3 1.0 0.0 3.89 2253 1209 A 17 LEU H A 37 LEU HG 1.0 0.0 4.25 2254 1210 A 17 LEU H A 17 LEU HG 1.0 0.0 3.58 2255 1211 A 17 LEU H A 16 PRO HB2 1.0 0.0 3.83 2256 1211 A 17 LEU H A 16 PRO HB3 1.0 0.0 3.83 2257 1212 A 17 LEU H A 16 PRO HG2 1.0 0.0 4.88 2258 1212 A 17 LEU H A 16 PRO HG3 1.0 0.0 4.88 2259 1213 A 17 LEU H A 17 LEU HD11 1.0 0.0 4.49 2260 1213 A 17 LEU H A 17 LEU HD21 1.0 0.0 4.49 2261 1214 A 17 LEU H A 17 LEU HD11 1.0 0.0 4.49 2262 1214 A 17 LEU H A 17 LEU HD21 1.0 0.0 4.49 2263 1215 A 17 LEU H A 37 LEU HD11 1.0 0.0 5.50 2264 1215 A 17 LEU H A 37 LEU HD21 1.0 0.0 5.50 2265 1216 A 17 LEU H A 18 ALA H 1.0 0.0 2.96 2266 1217 A 18 ALA H A 37 LEU H 1.0 0.0 3.69 2267 1218 A 18 ALA H A 19 THR H 1.0 0.0 4.50 2268 1219 A 18 ALA H A 38 ALA HA 1.0 0.0 4.21 2269 1220 A 18 ALA H A 37 LEU HA 1.0 0.0 4.79 2270 1221 A 18 ALA H A 16 PRO HA 1.0 0.0 3.66 2271 1222 A 19 THR HB A 18 ALA H 1.0 0.0 5.23 2272 1223 A 18 ALA H A 16 PRO HG2 1.0 0.0 5.50 2273 1223 A 16 PRO HG3 A 18 ALA H 1.0 0.0 5.50 2274 1224 A 18 ALA H A 116 VAL HG11 1.0 0.0 6.00 2275 1224 A 116 VAL HG21 A 18 ALA H 1.0 0.0 6.00 2276 1225 A 18 ALA H A 37 LEU HD11 1.0 0.0 4.97 2277 1225 A 37 LEU HD21 A 18 ALA H 1.0 0.0 4.97 2278 1226 A 18 ALA H A 37 LEU HD11 1.0 0.0 4.97 2279 1226 A 37 LEU HD21 A 18 ALA H 1.0 0.0 4.97 2280 1227 A 18 ALA H A 17 LEU HD11 1.0 0.0 5.25 2281 1227 A 18 ALA H A 17 LEU HD21 1.0 0.0 5.25 2282 1228 A 18 ALA H A 17 LEU HD11 1.0 0.0 5.25 2283 1228 A 18 ALA H A 17 LEU HD21 1.0 0.0 5.25 2284 1229 A 18 ALA HB1 A 18 ALA H 1.0 0.0 3.33 2285 1230 A 36 THR HG21 A 18 ALA H 1.0 0.0 4.58 2286 1231 A 18 ALA H A 17 LEU HG 1.0 0.0 4.00 2287 1232 A 18 ALA H A 16 PRO HB2 1.0 0.0 4.23 2288 1232 A 16 PRO HB3 A 18 ALA H 1.0 0.0 4.23 2289 1233 A 18 ALA H A 17 LEU HB2 1.0 0.0 3.41 2290 1233 A 18 ALA H A 17 LEU HB3 1.0 0.0 3.41 2291 1234 A 37 LEU H A 36 THR HA 1.0 0.0 3.38 2292 1235 A 19 THR HA A 37 LEU H 1.0 0.0 4.15 2293 1236 A 19 THR HB A 37 LEU H 1.0 0.0 4.89 2294 1237 A 36 THR HB A 37 LEU H 1.0 0.0 5.14 2295 1238 A 37 LEU H A 116 VAL HG11 1.0 0.0 5.16 2296 1238 A 116 VAL HG21 A 37 LEU H 1.0 0.0 5.16 2297 1239 A 37 LEU H A 37 LEU HD11 1.0 0.0 4.99 2298 1239 A 37 LEU HD21 A 37 LEU H 1.0 0.0 4.99 2299 1240 A 37 LEU H A 37 LEU HD11 1.0 0.0 4.99 2300 1240 A 37 LEU HD21 A 37 LEU H 1.0 0.0 4.99 2301 1241 A 36 THR HG21 A 37 LEU H 1.0 0.0 3.84 2302 1242 A 37 LEU H A 37 LEU HB2 1.0 0.0 3.74 2303 1242 A 37 LEU HB3 A 37 LEU H 1.0 0.0 3.74 2304 1243 A 18 ALA HB1 A 37 LEU H 1.0 0.0 4.27 2305 1244 A 37 LEU H A 37 LEU HB2 1.0 0.0 3.74 2306 1244 A 37 LEU HB3 A 37 LEU H 1.0 0.0 3.74 2307 1245 A 38 ALA H A 37 LEU H 1.0 0.0 4.80 2308 1246 A 47 ILE H A 37 LEU H 1.0 0.0 5.21 2309 1247 A 20 VAL H A 37 LEU H 1.0 0.0 5.06 2310 1248 A 18 ALA HB1 A 19 THR H 1.0 0.0 3.68 2311 1249 A 19 THR HB A 19 THR H 1.0 0.0 3.71 2312 1250 A 19 THR H A 18 ALA HA 1.0 0.0 2.98 2313 1251 A 20 VAL H A 21 GLU H 1.0 0.0 4.43 2314 1252 A 19 THR HA A 20 VAL H 1.0 0.0 3.14 2315 1253 A 20 VAL H A 36 THR HA 1.0 0.0 3.91 2316 1254 A 20 VAL H A 34 ALA HA 1.0 0.0 5.04 2317 1255 A 20 VAL H A 35 LEU HA 1.0 0.0 4.87 2318 1256 A 19 THR HB A 20 VAL H 1.0 0.0 4.36 2319 1257 A 20 VAL H A 112 PHE HB2 1.0 0.0 5.03 2320 1257 A 112 PHE HB3 A 20 VAL H 1.0 0.0 5.03 2321 1258 A 20 VAL H A 20 VAL HB 1.0 0.0 4.19 2322 1259 A 18 ALA HB1 A 20 VAL H 1.0 0.0 5.26 2323 1260 A 20 VAL H A 20 VAL HG11 1.0 0.0 4.16 2324 1260 A 20 VAL HG21 A 20 VAL H 1.0 0.0 4.16 2325 1261 A 20 VAL H A 20 VAL HG11 1.0 0.0 4.16 2326 1261 A 20 VAL HG21 A 20 VAL H 1.0 0.0 4.16 2327 1262 A 20 VAL H A 35 LEU HB2 1.0 0.0 4.09 2328 1262 A 20 VAL H A 35 LEU HB3 1.0 0.0 4.09 2329 1263 A 20 VAL H A 34 ALA HB1 1.0 0.0 4.86 2330 1264 A 20 VAL H A 35 LEU HD11 1.0 0.0 6.00 2331 1264 A 20 VAL H A 35 LEU HD21 1.0 0.0 6.00 2332 1265 A 20 VAL H A 35 LEU HD11 1.0 0.0 6.00 2333 1265 A 20 VAL H A 35 LEU HD21 1.0 0.0 6.00 2334 1266 A 21 GLU H A 34 ALA HA 1.0 0.0 4.94 2335 1267 A 21 GLU H A 20 VAL HA 1.0 0.0 2.98 2336 1268 A 21 GLU H A 21 GLU HB2 1.0 0.0 3.93 2337 1268 A 21 GLU H A 21 GLU HB3 1.0 0.0 3.93 2338 1269 A 21 GLU H A 21 GLU HG2 1.0 0.0 4.34 2339 1269 A 21 GLU H A 21 GLU HG3 1.0 0.0 4.34 2340 1270 A 21 GLU H A 21 GLU HB2 1.0 0.0 3.93 2341 1270 A 21 GLU H A 21 GLU HB3 1.0 0.0 3.93 2342 1271 A 21 GLU H A 20 VAL HG11 1.0 0.0 4.68 2343 1271 A 20 VAL HG21 A 21 GLU H 1.0 0.0 4.68 2344 1272 A 21 GLU H A 20 VAL HG11 1.0 0.0 4.68 2345 1272 A 20 VAL HG21 A 21 GLU H 1.0 0.0 4.68 2346 1273 A 23 MET H A 22 GLY H 1.0 0.0 4.46 2347 1274 A 34 ALA HA A 22 GLY H 1.0 0.0 3.71 2348 1275 A 22 GLY H A 21 GLU HA 1.0 0.0 3.29 2349 1276 A 33 CYS H A 22 GLY H 1.0 0.0 4.22 2350 1277 A 21 GLU H A 22 GLY H 1.0 0.0 4.51 2351 1278 A 44 TYR H A 43 GLN H 1.0 0.0 4.61 2352 1279 A 22 GLY H A 21 GLU HG2 1.0 0.0 5.11 2353 1279 A 21 GLU HG3 A 22 GLY H 1.0 0.0 5.11 2354 1280 A 22 GLY H A 21 GLU HB2 1.0 0.0 4.66 2355 1280 A 21 GLU HB3 A 22 GLY H 1.0 0.0 4.66 2356 1281 A 22 GLY H A 21 GLU HG2 1.0 0.0 5.11 2357 1281 A 21 GLU HG3 A 22 GLY H 1.0 0.0 5.11 2358 1282 A 22 GLY H A 21 GLU HB2 1.0 0.0 4.66 2359 1282 A 21 GLU HB3 A 22 GLY H 1.0 0.0 4.66 2360 1283 A 103 ILE HD11 A 22 GLY H 1.0 0.0 5.81 2361 1284 A 35 LEU HG A 22 GLY H 1.0 0.0 5.50 2362 1285 A 103 ILE HG21 A 22 GLY H 1.0 0.0 6.00 2363 1286 A 34 ALA HB1 A 22 GLY H 1.0 0.0 4.81 2364 1287 A 23 MET HA A 22 GLY H 1.0 0.0 5.08 2365 1288 A 23 MET H A 24 GLU H 1.0 0.0 4.55 2366 1289 A 23 MET H A 22 GLY HA2 1.0 0.0 3.37 2367 1289 A 23 MET H A 22 GLY HA3 1.0 0.0 3.37 2368 1290 A 23 MET H A 103 ILE HA 1.0 0.0 4.38 2369 1291 A 23 MET H A 102 GLU HA 1.0 0.0 4.55 2370 1292 A 23 MET H A 104 PRO HD2 1.0 0.0 4.59 2371 1292 A 104 PRO HD3 A 23 MET H 1.0 0.0 4.59 2372 1293 A 23 MET H A 22 GLY HA2 1.0 0.0 3.37 2373 1293 A 23 MET H A 22 GLY HA3 1.0 0.0 3.37 2374 1294 A 23 MET H A 104 PRO HD2 1.0 0.0 4.59 2375 1294 A 104 PRO HD3 A 23 MET H 1.0 0.0 4.59 2376 1295 A 23 MET H A 23 MET HB2 1.0 0.0 3.37 2377 1295 A 23 MET H A 23 MET HB3 1.0 0.0 3.37 2378 1296 A 23 MET H A 23 MET HB2 1.0 0.0 4.00 2379 1296 A 23 MET H A 23 MET HB3 1.0 0.0 4.00 2380 1297 A 103 ILE HD11 A 23 MET H 1.0 0.0 4.73 2381 1298 A 23 MET H A 102 GLU HB2 1.0 0.0 4.00 2382 1298 A 23 MET H A 102 GLU HB3 1.0 0.0 4.00 2383 1299 A 24 GLU H A 32 PRO HA 1.0 0.0 4.22 2384 1300 A 24 GLU H A 33 CYS HA 1.0 0.0 4.98 2385 1301 A 25 MET H A 101 PHE HA 1.0 0.0 3.93 2386 1302 A 25 MET H A 100 ARG H 1.0 0.0 4.12 2387 1303 A 25 MET H A 100 ARG HA 1.0 0.0 4.72 2388 1304 A 25 MET H A 24 GLU HA 1.0 0.0 3.56 2389 1305 A 25 MET H A 100 ARG HD2 1.0 0.0 5.18 2390 1305 A 25 MET H A 100 ARG HD3 1.0 0.0 5.18 2391 1306 A 25 MET H A 101 PHE HB2 1.0 0.0 5.50 2392 1306 A 101 PHE HB3 A 25 MET H 1.0 0.0 5.50 2393 1307 A 25 MET H A 26 LYS HG2 1.0 0.0 5.40 2394 1307 A 25 MET H A 26 LYS HG3 1.0 0.0 5.40 2395 1308 A 25 MET H A 100 ARG HB2 1.0 0.0 4.23 2396 1308 A 25 MET H A 100 ARG HB3 1.0 0.0 4.23 2397 1309 A 25 MET H A 24 GLU HG2 1.0 0.0 3.73 2398 1309 A 25 MET H A 24 GLU HG3 1.0 0.0 3.73 2399 1310 A 25 MET H A 100 ARG HB2 1.0 0.0 4.23 2400 1310 A 25 MET H A 100 ARG HB3 1.0 0.0 4.23 2401 1311 A 25 MET H A 25 MET HB2 1.0 0.0 3.75 2402 1311 A 25 MET H A 25 MET HB3 1.0 0.0 3.75 2403 1312 A 25 MET H A 25 MET HG2 1.0 0.0 3.31 2404 1312 A 25 MET H A 25 MET HG3 1.0 0.0 3.31 2405 1313 A 25 MET H A 25 MET HG2 1.0 0.0 3.79 2406 1313 A 25 MET H A 25 MET HG3 1.0 0.0 3.79 2407 1314 A 24 GLU H A 23 MET HB2 1.0 0.0 4.37 2408 1314 A 24 GLU H A 23 MET HB3 1.0 0.0 4.37 2409 1315 A 24 GLU H A 24 GLU HB2 1.0 0.0 3.59 2410 1315 A 24 GLU HB3 A 24 GLU H 1.0 0.0 3.59 2411 1316 A 24 GLU H A 24 GLU HB2 1.0 0.0 3.76 2412 1316 A 24 GLU HB3 A 24 GLU H 1.0 0.0 3.76 2413 1317 A 25 MET H A 24 GLU HG2 1.0 0.0 3.18 2414 1317 A 25 MET H A 24 GLU HG3 1.0 0.0 3.18 2415 1318 A 25 MET H A 31 GLU H 1.0 0.0 5.23 2416 1319 A 29 LEU H A 26 LYS H 1.0 0.0 4.03 2417 1320 A 30 ARG HA A 26 LYS H 1.0 0.0 4.16 2418 1321 A 26 LYS H A 25 MET HA 1.0 0.0 3.05 2419 1322 A 26 LYS H A 29 LEU HD11 1.0 0.0 5.78 2420 1322 A 29 LEU HD21 A 26 LYS H 1.0 0.0 5.78 2421 1323 A 26 LYS H A 26 LYS HG2 1.0 0.0 4.04 2422 1323 A 26 LYS HG3 A 26 LYS H 1.0 0.0 4.04 2423 1324 A 26 LYS H A 26 LYS HB2 1.0 0.0 3.91 2424 1324 A 26 LYS HB3 A 26 LYS H 1.0 0.0 3.91 2425 1325 A 26 LYS H A 26 LYS HB2 1.0 0.0 3.91 2426 1325 A 26 LYS HB3 A 26 LYS H 1.0 0.0 3.91 2427 1326 A 26 LYS H A 24 GLU HG2 1.0 0.0 4.54 2428 1326 A 24 GLU HG3 A 26 LYS H 1.0 0.0 4.54 2429 1327 A 26 LYS H A 25 MET HB2 1.0 0.0 4.03 2430 1327 A 25 MET HB3 A 26 LYS H 1.0 0.0 4.03 2431 1328 A 26 LYS H A 25 MET HG2 1.0 0.0 5.14 2432 1328 A 25 MET HG3 A 26 LYS H 1.0 0.0 5.14 2433 1329 A 26 LYS H A 100 ARG HD2 1.0 0.0 5.34 2434 1329 A 100 ARG HD3 A 26 LYS H 1.0 0.0 5.34 2435 1330 A 25 MET H A 26 LYS H 1.0 0.0 4.77 2436 1331 A 30 ARG H A 26 LYS H 1.0 0.0 5.10 2437 1332 A 27 GLY H A 26 LYS H 1.0 0.0 4.88 2438 1333 A 31 GLU H A 26 LYS H 1.0 0.0 5.25 2439 1334 A 29 LEU H A 28 PRO HG2 1.0 0.0 2.74 2440 1334 A 29 LEU H A 28 PRO HG3 1.0 0.0 2.74 2441 1335 A 29 LEU H A 28 PRO HD2 1.0 0.0 3.01 2442 1335 A 29 LEU H A 28 PRO HD3 1.0 0.0 3.01 2443 1336 A 118 ALA H A 115 ALA HA 1.0 0.0 4.07 2444 1337 A 38 ALA H A 46 LEU HA 1.0 0.0 3.87 2445 1338 A 38 ALA H A 37 LEU HA 1.0 0.0 3.09 2446 1339 A 38 ALA H A 39 GLN H 1.0 0.0 4.61 2447 1340 A 17 LEU H A 39 GLN H 1.0 0.0 4.07 2448 1341 A 39 GLN H A 15 GLN H 1.0 0.0 3.51 2449 1342 A 39 GLN H A 38 ALA HA 1.0 0.0 2.98 2450 1343 A 38 ALA H A 18 ALA H 1.0 0.0 5.29 2451 1344 A 38 ALA H A 44 TYR HD% 1.0 0.0 5.46 2452 1345 A 45 GLU H A 44 TYR HA 1.0 0.0 2.98 2453 1346 A 45 GLU H A 39 GLN HA 1.0 0.0 3.56 2454 1347 A 39 GLN H A 14 ALA HA 1.0 0.0 4.87 2455 1348 A 39 GLN H A 16 PRO HA 1.0 0.0 4.38 2456 1349 A 39 GLN H A 15 GLN HG2 1.0 0.0 4.48 2457 1349 A 39 GLN H A 15 GLN HG3 1.0 0.0 4.48 2458 1350 A 39 GLN H A 15 GLN HB2 1.0 0.0 3.76 2459 1350 A 39 GLN H A 15 GLN HB3 1.0 0.0 3.76 2460 1351 A 39 GLN H A 39 GLN HB2 1.0 0.0 3.42 2461 1351 A 39 GLN H A 39 GLN HB3 1.0 0.0 3.42 2462 1352 A 39 GLN H A 39 GLN HB2 1.0 0.0 3.31 2463 1352 A 39 GLN H A 39 GLN HB3 1.0 0.0 3.31 2464 1353 A 39 GLN H A 17 LEU HG 1.0 0.0 3.52 2465 1354 A 39 GLN H A 40 ARG HB2 1.0 0.0 4.83 2466 1354 A 39 GLN H A 40 ARG HB3 1.0 0.0 4.83 2467 1355 A 38 ALA HB1 A 39 GLN H 1.0 0.0 3.37 2468 1356 A 39 GLN H A 17 LEU HD11 1.0 0.0 4.44 2469 1356 A 17 LEU HD21 A 39 GLN H 1.0 0.0 4.44 2470 1357 A 38 ALA H A 44 TYR HB2 1.0 0.0 5.50 2471 1357 A 38 ALA H A 44 TYR HB3 1.0 0.0 5.50 2472 1358 A 38 ALA H A 16 PRO HA 1.0 0.0 4.90 2473 1359 A 38 ALA H A 38 ALA HB1 1.0 0.0 3.61 2474 1360 A 38 ALA H A 63 ILE HD11 1.0 0.0 5.27 2475 1361 A 38 ALA H A 116 VAL HG11 1.0 0.0 6.00 2476 1361 A 38 ALA H A 116 VAL HG21 1.0 0.0 6.00 2477 1362 A 38 ALA H A 37 LEU HG 1.0 0.0 3.86 2478 1363 A 38 ALA H A 17 LEU HB2 1.0 0.0 5.50 2479 1363 A 38 ALA H A 17 LEU HB3 1.0 0.0 5.50 2480 1364 A 38 ALA H A 45 GLU HB2 1.0 0.0 5.50 2481 1364 A 38 ALA H A 45 GLU HB3 1.0 0.0 5.50 2482 1365 A 38 ALA H A 45 GLU HG2 1.0 0.0 4.08 2483 1365 A 38 ALA H A 45 GLU HG3 1.0 0.0 4.08 2484 1366 A 39 GLN HE21 A 42 GLY HA2 1.0 0.0 5.02 2485 1366 A 39 GLN HE21 A 42 GLY HA3 1.0 0.0 5.02 2486 1367 A 39 GLN HE22 A 42 GLY HA2 1.0 0.0 5.04 2487 1367 A 42 GLY HA3 A 39 GLN HE22 1.0 0.0 5.04 2488 1368 A 39 GLN HE21 A 15 GLN HG2 1.0 0.0 5.23 2489 1368 A 15 GLN HG3 A 39 GLN HE21 1.0 0.0 5.23 2490 1369 A 39 GLN HE21 A 15 GLN HB2 1.0 0.0 5.07 2491 1369 A 15 GLN HB3 A 39 GLN HE21 1.0 0.0 5.07 2492 1370 A 39 GLN HE22 A 15 GLN HG2 1.0 0.0 5.03 2493 1370 A 15 GLN HG3 A 39 GLN HE22 1.0 0.0 5.03 2494 1371 A 39 GLN HE22 A 15 GLN HB2 1.0 0.0 5.10 2495 1371 A 15 GLN HB3 A 39 GLN HE22 1.0 0.0 5.10 2496 1372 A 39 GLN HE21 A 17 LEU HD11 1.0 0.0 5.58 2497 1372 A 17 LEU HD21 A 39 GLN HE21 1.0 0.0 5.58 2498 1373 A 39 GLN HE21 A 17 LEU HD11 1.0 0.0 5.58 2499 1373 A 17 LEU HD21 A 39 GLN HE21 1.0 0.0 5.58 2500 1374 A 39 GLN HE22 A 17 LEU HD11 1.0 0.0 5.92 2501 1374 A 17 LEU HD21 A 39 GLN HE22 1.0 0.0 5.92 2502 1375 A 39 GLN HE22 A 17 LEU HD11 1.0 0.0 5.92 2503 1375 A 17 LEU HD21 A 39 GLN HE22 1.0 0.0 5.92 2504 1376 A 39 GLN HE21 A 39 GLN HB2 1.0 0.0 3.52 2505 1376 A 39 GLN HB3 A 39 GLN HE21 1.0 0.0 3.52 2506 1377 A 39 GLN HE21 A 39 GLN HB2 1.0 0.0 4.54 2507 1377 A 39 GLN HB3 A 39 GLN HE21 1.0 0.0 4.54 2508 1378 A 39 GLN HE22 A 39 GLN HB2 1.0 0.0 4.89 2509 1378 A 39 GLN HB3 A 39 GLN HE22 1.0 0.0 4.89 2510 1379 A 39 GLN HE22 A 39 GLN HB2 1.0 0.0 3.76 2511 1379 A 39 GLN HB3 A 39 GLN HE22 1.0 0.0 3.76 2512 1380 A 15 GLN HE22 A 15 GLN HG2 1.0 0.0 3.79 2513 1380 A 15 GLN HG3 A 15 GLN HE22 1.0 0.0 3.79 2514 1381 A 47 ILE H A 36 THR H 1.0 0.0 3.94 2515 1382 A 20 VAL H A 36 THR H 1.0 0.0 5.13 2516 1383 A 36 THR H A 37 LEU H 1.0 0.0 4.34 2517 1384 A 36 THR H A 49 GLN H 1.0 0.0 4.69 2518 1385 A 36 THR H A 35 LEU HA 1.0 0.0 3.34 2519 1386 A 19 THR HA A 36 THR H 1.0 0.0 5.05 2520 1387 A 36 THR HB A 36 THR H 1.0 0.0 3.60 2521 1388 A 36 THR H A 48 ILE HA 1.0 0.0 4.54 2522 1389 A 47 ILE HB A 36 THR H 1.0 0.0 3.93 2523 1390 A 34 ALA HB1 A 36 THR H 1.0 0.0 5.33 2524 1391 A 36 THR HG21 A 36 THR H 1.0 0.0 4.57 2525 1392 A 36 THR H A 35 LEU HD11 1.0 0.0 5.91 2526 1392 A 35 LEU HD21 A 36 THR H 1.0 0.0 5.91 2527 1393 A 36 THR H A 35 LEU HD11 1.0 0.0 5.91 2528 1393 A 35 LEU HD21 A 36 THR H 1.0 0.0 5.91 2529 1394 A 47 ILE HG21 A 36 THR H 1.0 0.0 5.01 2530 1395 A 36 THR H A 46 LEU HD11 1.0 0.0 4.57 2531 1395 A 46 LEU HD21 A 36 THR H 1.0 0.0 4.57 2532 1396 A 36 THR H A 46 LEU HD11 1.0 0.0 4.57 2533 1396 A 46 LEU HD21 A 36 THR H 1.0 0.0 4.57 2534 1397 A 36 THR H A 35 LEU HB2 1.0 0.0 3.77 2535 1397 A 35 LEU HB3 A 36 THR H 1.0 0.0 3.77 2536 1398 A 35 LEU H A 36 THR H 1.0 0.0 4.49 2537 1399 A 20 VAL H A 35 LEU H 1.0 0.0 3.69 2538 1400 A 35 LEU H A 34 ALA H 1.0 0.0 4.65 2539 1401 A 19 THR HA A 35 LEU H 1.0 0.0 5.50 2540 1402 A 35 LEU H A 36 THR HA 1.0 0.0 5.40 2541 1403 A 35 LEU H A 34 ALA HA 1.0 0.0 3.14 2542 1404 A 35 LEU H A 48 ILE HA 1.0 0.0 5.50 2543 1405 A 35 LEU H A 49 GLN HB2 1.0 0.0 5.50 2544 1405 A 49 GLN HB3 A 35 LEU H 1.0 0.0 5.50 2545 1406 A 20 VAL HB A 35 LEU H 1.0 0.0 5.13 2546 1407 A 34 ALA HB1 A 35 LEU H 1.0 0.0 3.82 2547 1408 A 35 LEU H A 35 LEU HD11 1.0 0.0 4.86 2548 1408 A 35 LEU HD21 A 35 LEU H 1.0 0.0 4.86 2549 1409 A 35 LEU H A 20 VAL HG11 1.0 0.0 5.57 2550 1409 A 20 VAL HG21 A 35 LEU H 1.0 0.0 5.57 2551 1410 A 35 LEU H A 20 VAL HG11 1.0 0.0 5.57 2552 1410 A 20 VAL HG21 A 35 LEU H 1.0 0.0 5.57 2553 1411 A 48 ILE HG21 A 35 LEU H 1.0 0.0 6.00 2554 1412 A 35 LEU H A 35 LEU HB2 1.0 0.0 3.77 2555 1412 A 35 LEU HB3 A 35 LEU H 1.0 0.0 3.77 2556 1413 A 35 LEU H A 35 LEU HG 1.0 0.0 4.04 2557 1414 A 35 LEU H A 35 LEU HB2 1.0 0.0 3.72 2558 1414 A 35 LEU HB3 A 35 LEU H 1.0 0.0 3.72 2559 1415 A 34 ALA HB1 A 34 ALA H 1.0 0.0 3.67 2560 1416 A 48 ILE HG21 A 34 ALA H 1.0 0.0 4.56 2561 1417 A 33 CYS H A 34 ALA HB1 1.0 0.0 5.55 2562 1418 A 33 CYS H A 34 ALA H 1.0 0.0 4.63 2563 1419 A 23 MET HA A 31 GLU H 1.0 0.0 5.07 2564 1420 A 30 ARG HA A 31 GLU H 1.0 0.0 3.24 2565 1421 A 31 GLU H A 25 MET HA 1.0 0.0 4.36 2566 1422 A 31 GLU H A 32 PRO HD2 1.0 0.0 4.42 2567 1422 A 32 PRO HD3 A 31 GLU H 1.0 0.0 4.42 2568 1423 A 31 GLU H A 30 ARG HD2 1.0 0.0 4.56 2569 1423 A 31 GLU H A 30 ARG HD3 1.0 0.0 4.56 2570 1424 A 31 GLU H A 30 ARG HD2 1.0 0.0 4.56 2571 1424 A 31 GLU H A 30 ARG HD3 1.0 0.0 4.56 2572 1425 A 31 GLU H A 31 GLU HG2 1.0 0.0 3.70 2573 1425 A 31 GLU HG3 A 31 GLU H 1.0 0.0 3.70 2574 1426 A 31 GLU H A 24 GLU HB2 1.0 0.0 3.81 2575 1426 A 24 GLU HB3 A 31 GLU H 1.0 0.0 3.81 2576 1427 A 31 GLU H A 24 GLU HG2 1.0 0.0 4.04 2577 1427 A 24 GLU HG3 A 31 GLU H 1.0 0.0 4.04 2578 1428 A 31 GLU H A 30 ARG HB2 1.0 0.0 3.92 2579 1428 A 31 GLU H A 30 ARG HB3 1.0 0.0 3.92 2580 1429 A 31 GLU H A 30 ARG HB2 1.0 0.0 3.92 2581 1429 A 31 GLU H A 30 ARG HB3 1.0 0.0 3.92 2582 1430 A 31 GLU H A 23 MET HB2 1.0 0.0 4.96 2583 1430 A 23 MET HB3 A 31 GLU H 1.0 0.0 4.96 2584 1431 A 30 ARG H A 31 GLU H 1.0 0.0 4.59 2585 1432 A 30 ARG H A 29 LEU HA 1.0 0.0 2.75 2586 1433 A 91 VAL HA A 92 GLN H 1.0 0.0 3.40 2587 1434 A 30 ARG H A 30 ARG HD2 1.0 0.0 4.81 2588 1434 A 30 ARG H A 30 ARG HD3 1.0 0.0 4.81 2589 1435 A 30 ARG H A 30 ARG HD2 1.0 0.0 4.81 2590 1435 A 30 ARG H A 30 ARG HD3 1.0 0.0 4.81 2591 1436 A 30 ARG H A 29 LEU HB2 1.0 0.0 2.85 2592 1436 A 29 LEU HB3 A 30 ARG H 1.0 0.0 2.85 2593 1437 A 30 ARG H A 30 ARG HG2 1.0 0.0 3.68 2594 1437 A 30 ARG H A 30 ARG HG3 1.0 0.0 3.68 2595 1438 A 30 ARG H A 30 ARG HG2 1.0 0.0 3.68 2596 1438 A 30 ARG H A 30 ARG HG3 1.0 0.0 3.68 2597 1439 A 30 ARG H A 29 LEU HD11 1.0 0.0 3.65 2598 1439 A 29 LEU HD21 A 30 ARG H 1.0 0.0 3.65 2599 1440 A 92 GLN H A 91 VAL HG11 1.0 0.0 4.62 2600 1440 A 91 VAL HG21 A 92 GLN H 1.0 0.0 4.62 2601 1441 A 92 GLN H A 91 VAL HG11 1.0 0.0 4.62 2602 1441 A 91 VAL HG21 A 92 GLN H 1.0 0.0 4.62 2603 1442 A 30 ARG H A 29 LEU HB2 1.0 0.0 3.73 2604 1442 A 29 LEU HB3 A 30 ARG H 1.0 0.0 3.73 2605 1443 A 91 VAL HB A 92 GLN H 1.0 0.0 4.08 2606 1444 A 50 LEU H A 51 HIS H 1.0 0.0 4.58 2607 1445 A 51 HIS H A 50 LEU HD11 1.0 0.0 5.29 2608 1445 A 50 LEU HD21 A 51 HIS H 1.0 0.0 5.29 2609 1446 A 51 HIS H A 50 LEU HB2 1.0 0.0 4.86 2610 1446 A 51 HIS H A 50 LEU HB3 1.0 0.0 4.86 2611 1447 A 50 LEU HG A 51 HIS H 1.0 0.0 5.20 2612 1448 A 51 HIS H A 50 LEU HB2 1.0 0.0 4.86 2613 1448 A 51 HIS H A 50 LEU HB3 1.0 0.0 4.86 2614 1449 A 50 LEU H A 33 CYS HA 1.0 0.0 5.06 2615 1450 A 50 LEU H A 49 GLN HA 1.0 0.0 3.08 2616 1451 A 50 LEU H A 50 LEU HB2 1.0 0.0 3.61 2617 1451 A 50 LEU H A 50 LEU HB3 1.0 0.0 3.61 2618 1452 A 50 LEU H A 50 LEU HB2 1.0 0.0 3.61 2619 1452 A 50 LEU H A 50 LEU HB3 1.0 0.0 3.61 2620 1453 A 50 LEU H A 49 GLN HE21 1.0 0.0 5.50 2621 1454 A 50 LEU H A 49 GLN HB2 1.0 0.0 3.60 2622 1454 A 50 LEU H A 49 GLN HB3 1.0 0.0 3.60 2623 1455 A 49 GLN H A 49 GLN HG2 1.0 0.0 4.20 2624 1455 A 49 GLN HG3 A 49 GLN H 1.0 0.0 4.20 2625 1456 A 49 GLN H A 49 GLN HB2 1.0 0.0 3.53 2626 1456 A 49 GLN HB3 A 49 GLN H 1.0 0.0 3.53 2627 1457 A 49 GLN H A 49 GLN HG2 1.0 0.0 4.20 2628 1457 A 49 GLN HG3 A 49 GLN H 1.0 0.0 4.20 2629 1458 A 49 GLN H A 33 CYS HB2 1.0 0.0 4.63 2630 1458 A 33 CYS HB3 A 49 GLN H 1.0 0.0 4.63 2631 1459 A 49 GLN H A 48 ILE HA 1.0 0.0 3.44 2632 1460 A 48 ILE H A 49 GLN H 1.0 0.0 4.52 2633 1461 A 34 ALA HB1 A 49 GLN H 1.0 0.0 4.53 2634 1462 A 47 ILE HG21 A 49 GLN H 1.0 0.0 4.69 2635 1463 A 48 ILE HG21 A 49 GLN H 1.0 0.0 4.07 2636 1464 A 40 ARG H A 43 GLN H 1.0 0.0 3.23 2637 1465 A 43 GLN H A 42 GLY H 1.0 0.0 3.33 2638 1466 A 42 GLY H A 41 ASN H 1.0 0.0 4.76 2639 1467 A 40 ARG H A 42 GLY H 1.0 0.0 4.34 2640 1468 A 39 GLN H A 40 ARG H 1.0 0.0 4.63 2641 1469 A 40 ARG H A 41 ASN H 1.0 0.0 5.04 2642 1470 A 40 ARG H A 44 TYR HA 1.0 0.0 3.93 2643 1471 A 40 ARG H A 39 GLN HA 1.0 0.0 2.92 2644 1472 A 40 ARG H A 43 GLN HA 1.0 0.0 4.94 2645 1473 A 40 ARG H A 43 GLN HG2 1.0 0.0 4.05 2646 1473 A 40 ARG H A 43 GLN HG3 1.0 0.0 4.05 2647 1474 A 14 ALA HB1 A 40 ARG H 1.0 0.0 5.71 2648 1475 A 40 ARG H A 40 ARG HB2 1.0 0.0 3.65 2649 1475 A 40 ARG H A 40 ARG HB3 1.0 0.0 3.65 2650 1476 A 40 ARG H A 39 GLN HG2 1.0 0.0 3.33 2651 1476 A 39 GLN HG3 A 40 ARG H 1.0 0.0 3.33 2652 1477 A 40 ARG H A 40 ARG HB2 1.0 0.0 3.61 2653 1477 A 40 ARG H A 40 ARG HB3 1.0 0.0 3.61 2654 1478 A 40 ARG H A 39 GLN HG2 1.0 0.0 4.14 2655 1478 A 39 GLN HG3 A 40 ARG H 1.0 0.0 4.14 2656 1479 A 40 ARG H A 39 GLN HB2 1.0 0.0 4.12 2657 1479 A 39 GLN HB3 A 40 ARG H 1.0 0.0 4.12 2658 1480 A 89 ILE H A 101 PHE H 1.0 0.0 3.73 2659 1481 A 39 GLN HE21 A 42 GLY H 1.0 0.0 5.23 2660 1482 A 41 ASN HA A 42 GLY H 1.0 0.0 3.47 2661 1483 A 42 GLY H A 41 ASN HB2 1.0 0.0 4.48 2662 1483 A 42 GLY H A 41 ASN HB3 1.0 0.0 4.48 2663 1484 A 42 GLY H A 41 ASN HB2 1.0 0.0 4.48 2664 1484 A 42 GLY H A 41 ASN HB3 1.0 0.0 4.48 2665 1485 A 42 GLY H A 15 GLN HG2 1.0 0.0 5.05 2666 1485 A 15 GLN HG3 A 42 GLY H 1.0 0.0 5.05 2667 1486 A 42 GLY H A 43 GLN HB2 1.0 0.0 5.02 2668 1486 A 43 GLN HB3 A 42 GLY H 1.0 0.0 5.02 2669 1487 A 42 GLY H A 39 GLN HG2 1.0 0.0 4.82 2670 1487 A 39 GLN HG3 A 42 GLY H 1.0 0.0 4.82 2671 1488 A 42 GLY H A 39 GLN HG2 1.0 0.0 4.20 2672 1488 A 39 GLN HG3 A 42 GLY H 1.0 0.0 4.20 2673 1489 A 42 GLY H A 40 ARG HB2 1.0 0.0 5.50 2674 1489 A 40 ARG HB3 A 42 GLY H 1.0 0.0 5.50 2675 1490 A 42 GLY H A 40 ARG HG2 1.0 0.0 5.50 2676 1490 A 40 ARG HG3 A 42 GLY H 1.0 0.0 5.50 2677 1491 A 42 GLY H A 40 ARG HG2 1.0 0.0 5.50 2678 1491 A 40 ARG HG3 A 42 GLY H 1.0 0.0 5.50 2679 1492 A 43 GLN H A 44 TYR HA 1.0 0.0 5.15 2680 1493 A 43 GLN H A 39 GLN HA 1.0 0.0 4.73 2681 1494 A 43 GLN H A 40 ARG HA 1.0 0.0 4.33 2682 1495 A 43 GLN H A 42 GLY HA2 1.0 0.0 3.50 2683 1495 A 43 GLN H A 42 GLY HA3 1.0 0.0 3.50 2684 1496 A 43 GLN H A 42 GLY HA2 1.0 0.0 3.49 2685 1496 A 43 GLN H A 42 GLY HA3 1.0 0.0 3.49 2686 1497 A 43 GLN H A 41 ASN HB2 1.0 0.0 4.64 2687 1497 A 43 GLN H A 41 ASN HB3 1.0 0.0 4.64 2688 1498 A 43 GLN H A 41 ASN HB2 1.0 0.0 4.64 2689 1498 A 43 GLN H A 41 ASN HB3 1.0 0.0 4.64 2690 1499 A 43 GLN H A 43 GLN HG2 1.0 0.0 3.86 2691 1499 A 43 GLN HG3 A 43 GLN H 1.0 0.0 3.86 2692 1500 A 43 GLN H A 43 GLN HB2 1.0 0.0 3.02 2693 1500 A 43 GLN HB3 A 43 GLN H 1.0 0.0 3.02 2694 1501 A 43 GLN H A 43 GLN HB2 1.0 0.0 3.84 2695 1501 A 43 GLN HB3 A 43 GLN H 1.0 0.0 3.84 2696 1502 A 43 GLN H A 39 GLN HG2 1.0 0.0 4.55 2697 1502 A 39 GLN HG3 A 43 GLN H 1.0 0.0 4.55 2698 1503 A 43 GLN H A 39 GLN HG2 1.0 0.0 3.84 2699 1503 A 39 GLN HG3 A 43 GLN H 1.0 0.0 3.84 2700 1504 A 43 GLN H A 40 ARG HB2 1.0 0.0 5.44 2701 1504 A 40 ARG HB3 A 43 GLN H 1.0 0.0 5.44 2702 1505 A 44 TYR H A 39 GLN HA 1.0 0.0 5.11 2703 1506 A 44 TYR H A 43 GLN HA 1.0 0.0 2.89 2704 1507 A 44 TYR H A 44 TYR HB2 1.0 0.0 3.19 2705 1507 A 44 TYR HB3 A 44 TYR H 1.0 0.0 3.19 2706 1508 A 44 TYR H A 43 GLN HG2 1.0 0.0 3.20 2707 1508 A 44 TYR H A 43 GLN HG3 1.0 0.0 3.20 2708 1509 A 44 TYR H A 43 GLN HB2 1.0 0.0 4.32 2709 1509 A 43 GLN HB3 A 44 TYR H 1.0 0.0 4.32 2710 1510 A 44 TYR H A 39 GLN HG2 1.0 0.0 5.50 2711 1510 A 39 GLN HG3 A 44 TYR H 1.0 0.0 5.50 2712 1511 A 44 TYR H A 45 GLU HB2 1.0 0.0 5.50 2713 1511 A 44 TYR H A 45 GLU HB3 1.0 0.0 5.50 2714 1512 A 63 ILE HB A 44 TYR H 1.0 0.0 4.25 2715 1513 A 63 ILE HD11 A 44 TYR H 1.0 0.0 5.11 2716 1514 A 63 ILE HG21 A 44 TYR H 1.0 0.0 5.49 2717 1515 A 119 ALA HB1 A 44 TYR H 1.0 0.0 5.28 2718 1516 A 63 ILE HG21 A 45 GLU H 1.0 0.0 6.00 2719 1517 A 45 GLU H A 37 LEU HD11 1.0 0.0 5.39 2720 1517 A 37 LEU HD21 A 45 GLU H 1.0 0.0 5.39 2721 1518 A 45 GLU H A 37 LEU HD11 1.0 0.0 5.39 2722 1518 A 37 LEU HD21 A 45 GLU H 1.0 0.0 5.39 2723 1519 A 45 GLU H A 63 ILE HG12 1.0 0.0 4.36 2724 1519 A 63 ILE HG13 A 45 GLU H 1.0 0.0 4.36 2725 1520 A 38 ALA HB1 A 45 GLU H 1.0 0.0 4.84 2726 1521 A 37 LEU HG A 45 GLU H 1.0 0.0 5.03 2727 1522 A 63 ILE HB A 45 GLU H 1.0 0.0 5.30 2728 1523 A 45 GLU H A 45 GLU HG2 1.0 0.0 3.25 2729 1523 A 45 GLU HG3 A 45 GLU H 1.0 0.0 3.25 2730 1524 A 45 GLU H A 45 GLU HB2 1.0 0.0 3.69 2731 1524 A 45 GLU HB3 A 45 GLU H 1.0 0.0 3.69 2732 1525 A 45 GLU H A 44 TYR HB2 1.0 0.0 3.43 2733 1525 A 44 TYR HB3 A 45 GLU H 1.0 0.0 3.43 2734 1526 A 45 GLU H A 43 GLN HG2 1.0 0.0 4.70 2735 1526 A 43 GLN HG3 A 45 GLU H 1.0 0.0 4.70 2736 1527 A 45 GLU H A 62 PRO HA 1.0 0.0 5.50 2737 1528 A 46 LEU H A 45 GLU H 1.0 0.0 4.31 2738 1529 A 46 LEU H A 45 GLU HA 1.0 0.0 3.36 2739 1530 A 46 LEU H A 62 PRO HA 1.0 0.0 4.19 2740 1531 A 63 ILE HG21 A 46 LEU H 1.0 0.0 5.61 2741 1532 A 46 LEU H A 46 LEU HD11 1.0 0.0 5.36 2742 1532 A 46 LEU HD21 A 46 LEU H 1.0 0.0 5.36 2743 1533 A 46 LEU H A 46 LEU HD11 1.0 0.0 5.36 2744 1533 A 46 LEU HD21 A 46 LEU H 1.0 0.0 5.36 2745 1534 A 46 LEU H A 63 ILE HG12 1.0 0.0 4.06 2746 1534 A 63 ILE HG13 A 46 LEU H 1.0 0.0 4.06 2747 1535 A 46 LEU H A 46 LEU HB2 1.0 0.0 3.53 2748 1535 A 46 LEU HB3 A 46 LEU H 1.0 0.0 3.53 2749 1536 A 46 LEU HG A 46 LEU H 1.0 0.0 5.00 2750 1537 A 63 ILE HB A 46 LEU H 1.0 0.0 5.32 2751 1538 A 46 LEU H A 45 GLU HB2 1.0 0.0 4.16 2752 1538 A 45 GLU HB3 A 46 LEU H 1.0 0.0 4.16 2753 1539 A 46 LEU H A 45 GLU HB2 1.0 0.0 3.50 2754 1539 A 45 GLU HB3 A 46 LEU H 1.0 0.0 3.50 2755 1540 A 46 LEU H A 46 LEU HB2 1.0 0.0 3.61 2756 1540 A 46 LEU HB3 A 46 LEU H 1.0 0.0 3.61 2757 1541 A 47 ILE H A 46 LEU HA 1.0 0.0 3.25 2758 1542 A 36 THR HB A 47 ILE H 1.0 0.0 4.20 2759 1543 A 47 ILE H A 46 LEU H 1.0 0.0 4.60 2760 1544 A 48 ILE H A 47 ILE H 1.0 0.0 4.66 2761 1545 A 63 ILE HD11 A 47 ILE H 1.0 0.0 6.00 2762 1546 A 47 ILE HG21 A 47 ILE H 1.0 0.0 4.73 2763 1547 A 47 ILE HD11 A 47 ILE H 1.0 0.0 4.97 2764 1548 A 47 ILE H A 46 LEU HD11 1.0 0.0 4.53 2765 1548 A 46 LEU HD21 A 47 ILE H 1.0 0.0 4.53 2766 1549 A 47 ILE H A 46 LEU HD11 1.0 0.0 4.53 2767 1549 A 46 LEU HD21 A 47 ILE H 1.0 0.0 4.53 2768 1550 A 36 THR HG21 A 47 ILE H 1.0 0.0 5.24 2769 1551 A 38 ALA HB1 A 47 ILE H 1.0 0.0 5.93 2770 1552 A 47 ILE H A 46 LEU HB2 1.0 0.0 5.30 2771 1552 A 46 LEU HB3 A 47 ILE H 1.0 0.0 5.30 2772 1553 A 47 ILE H A 46 LEU HG 1.0 0.0 4.02 2773 1554 A 47 ILE HB A 47 ILE H 1.0 0.0 3.65 2774 1555 A 47 ILE H A 46 LEU HB2 1.0 0.0 4.42 2775 1555 A 46 LEU HB3 A 47 ILE H 1.0 0.0 4.42 2776 1556 A 47 ILE H A 45 GLU HG2 1.0 0.0 4.70 2777 1556 A 47 ILE H A 45 GLU HG3 1.0 0.0 4.70 2778 1557 A 50 LEU H A 49 GLN H 1.0 0.0 4.70 2779 1558 A 48 ILE H A 59 ASP H 1.0 0.0 4.21 2780 1559 A 61 ILE H A 46 LEU H 1.0 0.0 4.19 2781 1560 A 61 ILE H A 47 ILE HA 1.0 0.0 3.95 2782 1561 A 48 ILE H A 47 ILE HA 1.0 0.0 3.24 2783 1562 A 48 ILE H A 59 ASP HB2 1.0 0.0 4.86 2784 1562 A 48 ILE H A 59 ASP HB3 1.0 0.0 4.86 2785 1563 A 48 ILE H A 59 ASP HA 1.0 0.0 4.93 2786 1564 A 48 ILE H A 59 ASP HB2 1.0 0.0 4.86 2787 1564 A 48 ILE H A 59 ASP HB3 1.0 0.0 4.86 2788 1565 A 61 ILE HB A 48 ILE H 1.0 0.0 4.81 2789 1566 A 48 ILE HB A 48 ILE H 1.0 0.0 3.51 2790 1567 A 47 ILE HB A 48 ILE H 1.0 0.0 4.48 2791 1568 A 48 ILE H A 48 ILE HG12 1.0 0.0 3.87 2792 1568 A 48 ILE H A 48 ILE HG13 1.0 0.0 3.87 2793 1569 A 47 ILE HG21 A 48 ILE H 1.0 0.0 3.68 2794 1570 A 48 ILE H A 48 ILE HG12 1.0 0.0 3.87 2795 1570 A 48 ILE H A 48 ILE HG13 1.0 0.0 3.87 2796 1571 A 51 HIS H A 52 GLU H 1.0 0.0 4.32 2797 1572 A 52 GLU H A 51 HIS HB2 1.0 0.0 4.68 2798 1572 A 51 HIS HB3 A 52 GLU H 1.0 0.0 4.68 2799 1573 A 52 GLU H A 51 HIS HB2 1.0 0.0 4.68 2800 1573 A 51 HIS HB3 A 52 GLU H 1.0 0.0 4.68 2801 1574 A 53 LYS H A 53 LYS HE2 1.0 0.0 5.10 2802 1574 A 53 LYS H A 53 LYS HE3 1.0 0.0 5.10 2803 1575 A 53 LYS H A 53 LYS HG2 1.0 0.0 4.34 2804 1575 A 53 LYS H A 53 LYS HG3 1.0 0.0 4.34 2805 1576 A 52 GLU H A 52 GLU HB2 1.0 0.0 3.99 2806 1576 A 52 GLU HB3 A 52 GLU H 1.0 0.0 3.99 2807 1577 A 52 GLU H A 52 GLU HG2 1.0 0.0 3.99 2808 1577 A 52 GLU HG3 A 52 GLU H 1.0 0.0 3.99 2809 1578 A 53 LYS H A 53 LYS HD2 1.0 0.0 4.23 2810 1578 A 53 LYS H A 53 LYS HD3 1.0 0.0 4.23 2811 1579 A 53 LYS H A 53 LYS HB2 1.0 0.0 3.81 2812 1579 A 53 LYS H A 53 LYS HB3 1.0 0.0 3.81 2813 1580 A 54 GLU H A 53 LYS HG2 1.0 0.0 4.02 2814 1580 A 53 LYS HG3 A 54 GLU H 1.0 0.0 4.02 2815 1581 A 54 GLU H A 53 LYS HD2 1.0 0.0 4.76 2816 1581 A 53 LYS HD3 A 54 GLU H 1.0 0.0 4.76 2817 1582 A 54 GLU H A 52 GLU HB2 1.0 0.0 3.44 2818 1582 A 52 GLU HB3 A 54 GLU H 1.0 0.0 3.44 2819 1583 A 54 GLU H A 54 GLU HG2 1.0 0.0 3.57 2820 1583 A 54 GLU HG3 A 54 GLU H 1.0 0.0 3.57 2821 1584 A 54 GLU H A 54 GLU HG2 1.0 0.0 3.57 2822 1584 A 54 GLU HG3 A 54 GLU H 1.0 0.0 3.57 2823 1585 A 54 GLU H A 53 LYS HB2 1.0 0.0 3.71 2824 1585 A 53 LYS HB3 A 54 GLU H 1.0 0.0 3.71 2825 1586 A 53 LYS H A 54 GLU H 1.0 0.0 4.41 2826 1587 A 52 GLU H A 53 LYS H 1.0 0.0 4.70 2827 1588 A 55 GLN H A 54 GLU H 1.0 0.0 3.84 2828 1589 A 55 GLN H A 52 GLU HB2 1.0 0.0 3.51 2829 1589 A 55 GLN H A 52 GLU HB3 1.0 0.0 3.51 2830 1590 A 98 GLU H A 98 GLU HB2 1.0 0.0 3.32 2831 1590 A 98 GLU H A 98 GLU HB3 1.0 0.0 3.32 2832 1591 A 68 ARG H A 91 VAL HG11 1.0 0.0 5.30 2833 1591 A 91 VAL HG21 A 68 ARG H 1.0 0.0 5.30 2834 1592 A 68 ARG H A 91 VAL HG11 1.0 0.0 5.30 2835 1592 A 91 VAL HG21 A 68 ARG H 1.0 0.0 5.30 2836 1593 A 88 LYS H A 87 CYS HB2 1.0 0.0 3.83 2837 1593 A 87 CYS HB3 A 88 LYS H 1.0 0.0 3.83 2838 1594 A 88 LYS H A 87 CYS HB2 1.0 0.0 3.65 2839 1594 A 87 CYS HB3 A 88 LYS H 1.0 0.0 3.65 2840 1595 A 89 ILE HG21 A 88 LYS H 1.0 0.0 4.98 2841 1596 A 88 LYS H A 88 LYS HG2 1.0 0.0 4.49 2842 1596 A 88 LYS H A 88 LYS HG3 1.0 0.0 4.49 2843 1597 A 88 LYS H A 88 LYS HG2 1.0 0.0 4.49 2844 1597 A 88 LYS H A 88 LYS HG3 1.0 0.0 4.49 2845 1598 A 88 LYS H A 88 LYS HD2 1.0 0.0 3.99 2846 1598 A 88 LYS HD3 A 88 LYS H 1.0 0.0 3.99 2847 1599 A 88 LYS H A 88 LYS HB2 1.0 0.0 3.46 2848 1599 A 88 LYS HB3 A 88 LYS H 1.0 0.0 3.46 2849 1600 A 88 LYS H A 71 GLN HG2 1.0 0.0 4.59 2850 1600 A 71 GLN HG3 A 88 LYS H 1.0 0.0 4.59 2851 1601 A 88 LYS H A 87 CYS HA 1.0 0.0 3.15 2852 1602 A 72 GLU H A 88 LYS H 1.0 0.0 4.45 2853 1603 A 87 CYS H A 88 LYS H 1.0 0.0 4.99 2854 1604 A 89 ILE H A 88 LYS H 1.0 0.0 4.53 2855 1605 A 89 ILE H A 88 LYS HA 1.0 0.0 3.24 2856 1606 A 89 ILE H A 102 GLU HA 1.0 0.0 4.06 2857 1607 A 89 ILE H A 103 ILE H 1.0 0.0 5.28 2858 1608 A 89 ILE H A 90 ARG HA 1.0 0.0 5.35 2859 1609 A 89 ILE H A 100 ARG HA 1.0 0.0 5.50 2860 1610 A 89 ILE HD11 A 89 ILE H 1.0 0.0 4.66 2861 1611 A 89 ILE H A 89 ILE HG12 1.0 0.0 3.80 2862 1611 A 89 ILE HG13 A 89 ILE H 1.0 0.0 3.80 2863 1612 A 89 ILE H A 88 LYS HG2 1.0 0.0 5.08 2864 1612 A 89 ILE H A 88 LYS HG3 1.0 0.0 5.08 2865 1613 A 89 ILE H A 88 LYS HG2 1.0 0.0 5.08 2866 1613 A 89 ILE H A 88 LYS HG3 1.0 0.0 5.08 2867 1614 A 89 ILE H A 90 ARG HG2 1.0 0.0 5.50 2868 1614 A 89 ILE H A 90 ARG HG3 1.0 0.0 5.50 2869 1615 A 89 ILE H A 89 ILE HG12 1.0 0.0 3.80 2870 1615 A 89 ILE HG13 A 89 ILE H 1.0 0.0 3.80 2871 1616 A 89 ILE H A 88 LYS HB2 1.0 0.0 3.51 2872 1616 A 89 ILE H A 88 LYS HB3 1.0 0.0 3.51 2873 1617 A 89 ILE H A 25 MET HE1 1.0 0.0 4.91 2874 1618 A 89 ILE H A 102 GLU HB2 1.0 0.0 5.50 2875 1618 A 89 ILE H A 102 GLU HB3 1.0 0.0 5.50 2876 1619 A 89 ILE H A 102 GLU HB2 1.0 0.0 5.50 2877 1619 A 89 ILE H A 102 GLU HB3 1.0 0.0 5.50 2878 1620 A 89 ILE H A 101 PHE HB2 1.0 0.0 4.44 2879 1620 A 101 PHE HB3 A 89 ILE H 1.0 0.0 4.44 2880 1621 A 89 ILE H A 101 PHE HB2 1.0 0.0 4.98 2881 1621 A 101 PHE HB3 A 89 ILE H 1.0 0.0 4.98 2882 1622 A 89 ILE HA A 90 ARG H 1.0 0.0 3.39 2883 1623 A 90 ARG H A 69 CYS HA 1.0 0.0 4.61 2884 1624 A 90 ARG H A 71 GLN HA 1.0 0.0 4.17 2885 1625 A 90 ARG H A 70 VAL H 1.0 0.0 3.81 2886 1626 A 90 ARG H A 90 ARG HD2 1.0 0.0 4.85 2887 1626 A 90 ARG HD3 A 90 ARG H 1.0 0.0 4.85 2888 1627 A 90 ARG H A 90 ARG HB2 1.0 0.0 3.36 2889 1627 A 90 ARG HB3 A 90 ARG H 1.0 0.0 3.36 2890 1628 A 89 ILE HB A 90 ARG H 1.0 0.0 3.46 2891 1629 A 90 ARG H A 70 VAL HB 1.0 0.0 4.93 2892 1630 A 89 ILE HG21 A 90 ARG H 1.0 0.0 4.20 2893 1631 A 89 ILE HD11 A 90 ARG H 1.0 0.0 4.83 2894 1632 A 90 ARG H A 101 PHE HB2 1.0 0.0 5.50 2895 1632 A 101 PHE HB3 A 90 ARG H 1.0 0.0 5.50 2896 1633 A 91 VAL H A 90 ARG HD2 1.0 0.0 5.34 2897 1633 A 90 ARG HD3 A 91 VAL H 1.0 0.0 5.34 2898 1634 A 91 VAL H A 91 VAL HG11 1.0 0.0 4.53 2899 1634 A 91 VAL HG21 A 91 VAL H 1.0 0.0 4.53 2900 1635 A 91 VAL H A 91 VAL HG11 1.0 0.0 4.53 2901 1635 A 91 VAL HG21 A 91 VAL H 1.0 0.0 4.53 2902 1636 A 92 GLN H A 91 VAL H 1.0 0.0 4.82 2903 1637 A 91 VAL H A 99 ARG H 1.0 0.0 4.28 2904 1638 A 101 PHE H A 91 VAL H 1.0 0.0 4.98 2905 1639 A 90 ARG H A 91 VAL H 1.0 0.0 4.82 2906 1640 A 90 ARG HA A 91 VAL H 1.0 0.0 3.32 2907 1641 A 91 VAL H A 98 GLU HA 1.0 0.0 5.50 2908 1642 A 91 VAL H A 99 ARG HA 1.0 0.0 5.50 2909 1643 A 91 VAL H A 100 ARG HG2 1.0 0.0 4.71 2910 1643 A 100 ARG HG3 A 91 VAL H 1.0 0.0 4.71 2911 1644 A 91 VAL H A 90 ARG HG2 1.0 0.0 5.37 2912 1644 A 90 ARG HG3 A 91 VAL H 1.0 0.0 5.37 2913 1645 A 91 VAL H A 100 ARG HG2 1.0 0.0 5.50 2914 1645 A 100 ARG HG3 A 91 VAL H 1.0 0.0 5.50 2915 1646 A 91 VAL H A 90 ARG HB2 1.0 0.0 3.86 2916 1646 A 90 ARG HB3 A 91 VAL H 1.0 0.0 3.86 2917 1647 A 91 VAL HB A 91 VAL H 1.0 0.0 3.65 2918 1648 A 99 ARG H A 99 ARG HD2 1.0 0.0 5.33 2919 1648 A 99 ARG H A 99 ARG HD3 1.0 0.0 5.33 2920 1649 A 99 ARG H A 99 ARG HD2 1.0 0.0 5.33 2921 1649 A 99 ARG H A 99 ARG HD3 1.0 0.0 5.33 2922 1650 A 96 ILE HD11 A 99 ARG H 1.0 0.0 5.52 2923 1651 A 99 ARG H A 100 ARG HG2 1.0 0.0 4.93 2924 1651 A 100 ARG HG3 A 99 ARG H 1.0 0.0 4.93 2925 1652 A 99 ARG H A 99 ARG HG2 1.0 0.0 4.34 2926 1652 A 99 ARG H A 99 ARG HG3 1.0 0.0 4.34 2927 1653 A 99 ARG H A 98 GLU HB2 1.0 0.0 3.88 2928 1653 A 98 GLU HB3 A 99 ARG H 1.0 0.0 3.88 2929 1654 A 99 ARG H A 98 GLU HA 1.0 0.0 3.41 2930 1655 A 100 ARG H A 99 ARG H 1.0 0.0 4.57 2931 1656 A 101 PHE H A 100 ARG H 1.0 0.0 4.64 2932 1657 A 100 ARG H A 100 ARG HD2 1.0 0.0 4.17 2933 1657 A 100 ARG HD3 A 100 ARG H 1.0 0.0 4.17 2934 1658 A 100 ARG H A 99 ARG HA 1.0 0.0 3.32 2935 1659 A 100 ARG H A 100 ARG HG2 1.0 0.0 4.38 2936 1659 A 100 ARG HG3 A 100 ARG H 1.0 0.0 4.38 2937 1660 A 100 ARG H A 100 ARG HG2 1.0 0.0 3.33 2938 1660 A 100 ARG HG3 A 100 ARG H 1.0 0.0 3.33 2939 1661 A 100 ARG H A 25 MET HB2 1.0 0.0 4.64 2940 1661 A 25 MET HB3 A 100 ARG H 1.0 0.0 4.64 2941 1662 A 87 CYS HA A 71 GLN HE22 1.0 0.0 5.50 2942 1663 A 71 GLN HE22 A 87 CYS HB2 1.0 0.0 5.17 2943 1663 A 87 CYS HB3 A 71 GLN HE22 1.0 0.0 5.17 2944 1664 A 71 GLN HE22 A 87 CYS HB2 1.0 0.0 5.10 2945 1664 A 87 CYS HB3 A 71 GLN HE22 1.0 0.0 5.10 2946 1665 A 71 GLN HE22 A 71 GLN HG2 1.0 0.0 3.69 2947 1665 A 71 GLN HG3 A 71 GLN HE22 1.0 0.0 3.69 2948 1666 A 87 CYS HA A 71 GLN HE21 1.0 0.0 5.50 2949 1667 A 71 GLN HE21 A 87 CYS HB2 1.0 0.0 5.10 2950 1667 A 87 CYS HB3 A 71 GLN HE21 1.0 0.0 5.10 2951 1668 A 71 GLN HE21 A 87 CYS HB2 1.0 0.0 5.17 2952 1668 A 87 CYS HB3 A 71 GLN HE21 1.0 0.0 5.17 2953 1669 A 71 GLN HE21 A 71 GLN HG2 1.0 0.0 3.69 2954 1669 A 71 GLN HG3 A 71 GLN HE21 1.0 0.0 3.69 2955 1670 A 58 GLN HE21 A 60 ILE HD11 1.0 0.0 5.86 2956 1671 A 47 ILE HG21 A 58 GLN HE22 1.0 0.0 5.01 2957 1672 A 60 ILE HD11 A 58 GLN HE22 1.0 0.0 5.86 2958 1673 A 10 LEU HA A 58 GLN HE22 1.0 0.0 4.42 2959 1674 A 58 GLN HE21 A 10 LEU HA 1.0 0.0 4.42 2960 1675 A 15 GLN HE21 A 15 GLN HG2 1.0 0.0 3.79 2961 1675 A 15 GLN HG3 A 15 GLN HE21 1.0 0.0 3.79 2962 1676 A 49 GLN HE21 A 9 PRO HB2 1.0 0.0 3.93 2963 1676 A 9 PRO HB3 A 49 GLN HE21 1.0 0.0 3.93 2964 1677 A 49 GLN HE21 A 49 GLN HA 1.0 0.0 4.59 2965 1678 A 49 GLN HA A 49 GLN HE22 1.0 0.0 5.50 2966 1679 A 49 GLN HE21 A 9 PRO HA 1.0 0.0 5.50 2967 1680 A 49 GLN HE21 A 10 LEU HA 1.0 0.0 5.50 2968 1681 A 49 GLN HE22 A 9 PRO HA 1.0 0.0 5.50 2969 1682 A 10 LEU HA A 49 GLN HE22 1.0 0.0 5.50 2970 1683 A 49 GLN HE21 A 9 PRO HD2 1.0 0.0 5.49 2971 1683 A 9 PRO HD3 A 49 GLN HE21 1.0 0.0 5.49 2972 1684 A 49 GLN HE22 A 9 PRO HD2 1.0 0.0 5.26 2973 1684 A 9 PRO HD3 A 49 GLN HE22 1.0 0.0 5.26 2974 1685 A 49 GLN HE22 A 9 PRO HB2 1.0 0.0 4.31 2975 1685 A 9 PRO HB3 A 49 GLN HE22 1.0 0.0 4.31 2976 1686 A 49 GLN HE22 A 9 PRO HG2 1.0 0.0 4.13 2977 1686 A 9 PRO HG3 A 49 GLN HE22 1.0 0.0 4.13 2978 1687 A 49 GLN HE21 A 9 PRO HB2 1.0 0.0 4.34 2979 1687 A 9 PRO HB3 A 49 GLN HE21 1.0 0.0 4.34 2980 1688 A 49 GLN HE21 A 49 GLN HB2 1.0 0.0 4.91 2981 1688 A 49 GLN HE21 A 49 GLN HB3 1.0 0.0 4.91 2982 1689 A 10 LEU HG A 49 GLN HE21 1.0 0.0 5.50 2983 1690 A 10 LEU HG A 49 GLN HE22 1.0 0.0 5.08 2984 1691 A 49 GLN HE21 A 10 LEU HD11 1.0 0.0 6.00 2985 1691 A 10 LEU HD21 A 49 GLN HE21 1.0 0.0 6.00 2986 1692 A 47 ILE HG21 A 49 GLN HE21 1.0 0.0 5.46 2987 1693 A 47 ILE HG21 A 49 GLN HE22 1.0 0.0 5.92 2988 1694 A 43 GLN HE22 A 43 GLN HG2 1.0 0.0 3.76 2989 1694 A 43 GLN HG3 A 43 GLN HE22 1.0 0.0 3.76 2990 1695 A 90 ARG HA A 90 ARG HE 1.0 0.0 5.29 2991 1696 A 61 ILE HD11 A 95 TRP HE1 1.0 0.0 5.44 2992 1697 A 61 ILE HG21 A 95 TRP HE1 1.0 0.0 5.85 2993 1698 A 95 TRP HE1 A 62 PRO HD2 1.0 0.0 5.50 2994 1698 A 62 PRO HD3 A 95 TRP HE1 1.0 0.0 5.50 2995 1699 A 120 GLN H A 120 GLN HG2 1.0 0.0 3.19 2996 1699 A 120 GLN HG3 A 120 GLN H 1.0 0.0 3.19 2997 1700 A 121 LYS H A 120 GLN HB2 1.0 0.0 3.64 2998 1700 A 121 LYS H A 120 GLN HB3 1.0 0.0 3.64 2999 1701 A 102 GLU H A 101 PHE HD% 1.0 0.0 4.61 3000 1702 A 25 MET H A 101 PHE H 1.0 0.0 4.51 3001 1703 A 112 PHE HD% A 112 PHE H 1.0 0.0 4.16 3002 1704 A 93 GLY H A 94 ASP H 1.0 0.0 5.34 3003 1705 A 79 ILE H A 78 LEU HB2 1.0 0.0 3.81 3004 1705 A 79 ILE H A 78 LEU HB3 1.0 0.0 3.81 3005 1706 A 64 ASN H A 67 PHE H 1.0 0.0 3.46 3006 1707 A 67 PHE HD% A 67 PHE H 1.0 0.0 4.16 3007 1708 A 44 TYR HE% A 44 TYR H 1.0 0.0 5.07 3008 1709 A 44 TYR H A 123 GLN HE21 1.0 0.0 4.90 3009 1710 A 44 TYR H A 43 GLN HE21 1.0 0.0 4.81 3010 1711 A 44 TYR H A 123 GLN HE22 1.0 0.0 4.90 3011 1712 A 101 PHE HD% A 101 PHE H 1.0 0.0 4.06 3012 1713 A 101 PHE HE% A 101 PHE H 1.0 0.0 5.50 3013 1714 A 112 PHE HD% A 113 LEU H 1.0 0.0 4.16 3014 1715 A 112 PHE HD% A 20 VAL H 1.0 0.0 5.50 3015 1716 A 44 TYR HD% A 44 TYR H 1.0 0.0 3.61 3016 1717 A 119 ALA HA A 44 TYR HD% 1.0 0.0 4.28 3017 1718 A 119 ALA HA A 44 TYR HE% 1.0 0.0 3.99 3018 1719 A 119 ALA HB1 A 44 TYR HE% 1.0 0.0 3.78 3019 1720 A 44 TYR HD% A 37 LEU HD11 1.0 0.0 4.98 3020 1720 A 44 TYR HD% A 37 LEU HD21 1.0 0.0 4.98 3021 1721 A 122 ALA HB1 A 44 TYR HE% 1.0 0.0 3.68 3022 1722 A 122 ALA HB1 A 44 TYR HD% 1.0 0.0 4.70 3023 1723 A 44 TYR HE% A 39 GLN HG2 1.0 0.0 3.99 3024 1723 A 39 GLN HG3 A 44 TYR HE% 1.0 0.0 3.99 3025 1724 A 61 ILE HD11 A 95 TRP HZ2 1.0 0.0 5.58 3026 1725 A 108 HIS HD2 A 108 HIS H 1.0 0.0 3.43 3027 1726 A 108 HIS HD2 A 111 LYS HB2 1.0 0.0 4.88 3028 1726 A 111 LYS HB3 A 108 HIS HD2 1.0 0.0 4.88 3029 1727 A 108 HIS HD2 A 105 ASP HB2 1.0 0.0 4.71 3030 1727 A 105 ASP HB3 A 108 HIS HD2 1.0 0.0 4.71 3031 1728 A 108 HIS HD2 A 108 HIS HB2 1.0 0.0 3.83 3032 1728 A 108 HIS HB3 A 108 HIS HD2 1.0 0.0 3.83 3033 1729 A 51 HIS HD2 A 32 PRO HB2 1.0 0.0 5.11 3034 1729 A 32 PRO HB3 A 51 HIS HD2 1.0 0.0 5.11 3035 1730 A 51 HIS HD2 A 32 PRO HG2 1.0 0.0 4.21 3036 1730 A 51 HIS HD2 A 32 PRO HG3 1.0 0.0 4.21 3037 1731 A 51 HIS HD2 A 32 PRO HG2 1.0 0.0 4.56 3038 1731 A 51 HIS HD2 A 32 PRO HG3 1.0 0.0 4.56 3039 1732 A 67 PHE H A 66 HIS HD2 1.0 0.0 5.03 3040 1733 A 66 HIS H A 66 HIS HD2 1.0 0.0 3.81 3041 1734 A 67 PHE HZ A 116 VAL HG11 1.0 0.0 4.85 3042 1734 A 116 VAL HG21 A 67 PHE HZ 1.0 0.0 4.85 3043 1735 A 67 PHE HE% A 69 CYS HB2 1.0 0.0 4.24 3044 1735 A 67 PHE HE% A 69 CYS HB3 1.0 0.0 4.24 3045 1736 A 67 PHE HE% A 69 CYS HB2 1.0 0.0 4.24 3046 1736 A 67 PHE HE% A 69 CYS HB3 1.0 0.0 4.24 3047 1737 A 67 PHE HE% A 46 LEU HB2 1.0 0.0 4.31 3048 1737 A 67 PHE HE% A 46 LEU HB3 1.0 0.0 4.31 3049 1738 A 112 PHE HD% A 109 CYS HA 1.0 0.0 4.46 3050 1739 A 63 ILE HA A 67 PHE HD% 1.0 0.0 4.09 3051 1740 A 67 PHE HD% A 116 VAL HG11 1.0 0.0 5.35 3052 1740 A 116 VAL HG21 A 67 PHE HD% 1.0 0.0 5.35 3053 1741 A 67 PHE HD% A 61 ILE HG21 1.0 0.0 4.27 3054 1742 A 112 PHE HD% A 103 ILE HD11 1.0 0.0 4.84 3055 1743 A 112 PHE HD% A 35 LEU HB2 1.0 0.0 4.24 3056 1743 A 112 PHE HD% A 35 LEU HB3 1.0 0.0 4.24 3057 1744 A 112 PHE HD% A 113 LEU HD11 1.0 0.0 5.50 3058 1744 A 112 PHE HD% A 113 LEU HD21 1.0 0.0 5.50 3059 1745 A 112 PHE HD% A 116 VAL HB 1.0 0.0 4.96 3060 1746 A 112 PHE HZ A 116 VAL HG11 1.0 0.0 6.00 3061 1746 A 116 VAL HG21 A 112 PHE HZ 1.0 0.0 6.00 3062 1747 A 63 ILE HG21 A 67 PHE HE% 1.0 0.0 5.13 3063 1748 A 67 PHE HE% A 116 VAL HG11 1.0 0.0 5.57 3064 1748 A 67 PHE HE% A 116 VAL HG21 1.0 0.0 5.57 3065 1749 A 67 PHE HZ A 67 PHE HD% 1.0 0.0 3.88 3066 1750 A 112 PHE HD% A 18 ALA HB1 1.0 0.0 4.71 3067 1751 A 112 PHE HE% A 116 VAL HG11 1.0 0.0 5.51 3068 1751 A 116 VAL HG21 A 112 PHE HE% 1.0 0.0 5.51 3069 1752 A 67 PHE HE% A 46 LEU HB2 1.0 0.0 3.89 3070 1752 A 67 PHE HE% A 46 LEU HB3 1.0 0.0 3.89 3071 1753 A 67 PHE HE% A 61 ILE HG21 1.0 0.0 4.74 3072 1754 A 67 PHE HE% A 116 VAL HG11 1.0 0.0 3.64 3073 1754 A 67 PHE HE% A 116 VAL HG21 1.0 0.0 3.64 3074 1755 A 67 PHE HE% A 63 ILE HG12 1.0 0.0 4.24 3075 1755 A 67 PHE HE% A 63 ILE HG13 1.0 0.0 4.24 3076 1756 A 67 PHE HZ A 46 LEU HD11 1.0 0.0 4.07 3077 1756 A 67 PHE HZ A 46 LEU HD21 1.0 0.0 4.07 3078 1757 A 67 PHE HZ A 46 LEU HB2 1.0 0.0 4.33 3079 1757 A 67 PHE HZ A 46 LEU HB3 1.0 0.0 4.33 3080 1758 A 101 PHE HE% A 91 VAL HG11 1.0 0.0 4.59 3081 1758 A 91 VAL HG21 A 101 PHE HE% 1.0 0.0 4.59 3082 1759 A 101 PHE HE% A 24 GLU HB2 1.0 0.0 3.96 3083 1759 A 101 PHE HE% A 24 GLU HB3 1.0 0.0 3.96 3084 1760 A 91 VAL HB A 101 PHE HE% 1.0 0.0 3.99 3085 1761 A 101 PHE HE% A 24 GLU HB2 1.0 0.0 4.53 3086 1761 A 101 PHE HE% A 24 GLU HB3 1.0 0.0 4.53 3087 1762 A 101 PHE HZ A 48 ILE HB 1.0 0.0 5.11 3088 1763 A 91 VAL HB A 101 PHE HZ 1.0 0.0 5.40 3089 1764 A 3 LEU H A 2 PRO HB2 1.0 0.0 3.71 3090 1764 A 3 LEU H A 2 PRO HB3 1.0 0.0 3.71 3091 1765 A 6 MET H A 6 MET HB2 1.0 0.0 3.47 3092 1765 A 6 MET H A 6 MET HB3 1.0 0.0 3.47 3093 1766 A 6 MET H A 6 MET HG2 1.0 0.0 4.23 3094 1766 A 6 MET H A 6 MET HG3 1.0 0.0 4.23 3095 1767 A 7 GLU H A 6 MET HB2 1.0 0.0 3.85 3096 1767 A 6 MET HB3 A 7 GLU H 1.0 0.0 3.85 3097 1768 A 7 GLU H A 7 GLU HB2 1.0 0.0 2.90 3098 1768 A 7 GLU HB3 A 7 GLU H 1.0 0.0 2.90 3099 1769 A 7 GLU HB2 A 8 PRO HD2 1.0 0.0 3.56 3100 1769 A 8 PRO HD3 A 7 GLU HB2 1.0 0.0 3.56 3101 1769 A 7 GLU HB3 A 8 PRO HD3 1.0 0.0 3.56 3102 1769 A 7 GLU HB3 A 8 PRO HD2 1.0 0.0 3.56 3103 1770 A 7 GLU HG3 A 8 PRO HD2 1.0 0.0 3.61 3104 1770 A 7 GLU HG2 A 8 PRO HD2 1.0 0.0 3.61 3105 1770 A 8 PRO HD3 A 7 GLU HG2 1.0 0.0 3.61 3106 1770 A 8 PRO HD3 A 7 GLU HG3 1.0 0.0 3.61 3107 1771 A 9 PRO HB3 A 10 LEU HD11 1.0 0.0 4.70 3108 1771 A 10 LEU HD21 A 9 PRO HB2 1.0 0.0 4.70 3109 1771 A 9 PRO HB3 A 10 LEU HD21 1.0 0.0 4.70 3110 1771 A 9 PRO HB2 A 10 LEU HD11 1.0 0.0 4.70 3111 1772 A 9 PRO HB3 A 56 HIS HB2 1.0 0.0 4.15 3112 1772 A 9 PRO HB2 A 56 HIS HB2 1.0 0.0 4.15 3113 1772 A 56 HIS HB3 A 9 PRO HB2 1.0 0.0 4.15 3114 1772 A 9 PRO HB3 A 56 HIS HB3 1.0 0.0 4.15 3115 1773 A 9 PRO HG3 A 10 LEU HD11 1.0 0.0 4.19 3116 1773 A 9 PRO HG2 A 10 LEU HD11 1.0 0.0 4.19 3117 1773 A 10 LEU HD21 A 9 PRO HG2 1.0 0.0 4.19 3118 1773 A 10 LEU HD21 A 9 PRO HG3 1.0 0.0 4.19 3119 1774 A 10 LEU H A 10 LEU HD11 1.0 0.0 3.60 3120 1774 A 10 LEU H A 10 LEU HD21 1.0 0.0 3.60 3121 1775 A 10 LEU H A 11 PRO HD2 1.0 0.0 5.16 3122 1775 A 11 PRO HD3 A 10 LEU H 1.0 0.0 5.16 3123 1776 A 10 LEU HB3 A 11 PRO HD2 1.0 0.0 3.69 3124 1776 A 10 LEU HB2 A 11 PRO HD2 1.0 0.0 3.69 3125 1776 A 11 PRO HD3 A 10 LEU HB2 1.0 0.0 3.69 3126 1776 A 11 PRO HD3 A 10 LEU HB3 1.0 0.0 3.69 3127 1777 A 10 LEU HD11 A 11 PRO HG2 1.0 0.0 4.37 3128 1777 A 10 LEU HD21 A 11 PRO HG2 1.0 0.0 4.37 3129 1777 A 11 PRO HG3 A 10 LEU HD11 1.0 0.0 4.37 3130 1777 A 11 PRO HG3 A 10 LEU HD21 1.0 0.0 4.37 3131 1778 A 10 LEU HD11 A 11 PRO HD2 1.0 0.0 3.75 3132 1778 A 10 LEU HD21 A 11 PRO HD2 1.0 0.0 3.75 3133 1778 A 11 PRO HD3 A 10 LEU HD11 1.0 0.0 3.75 3134 1778 A 11 PRO HD3 A 10 LEU HD21 1.0 0.0 3.75 3135 1779 A 14 ALA HB1 A 10 LEU HD11 1.0 0.0 4.81 3136 1779 A 14 ALA HB1 A 10 LEU HD21 1.0 0.0 4.81 3137 1780 A 10 LEU HD21 A 16 PRO HB2 1.0 0.0 3.60 3138 1780 A 10 LEU HD11 A 16 PRO HB2 1.0 0.0 3.60 3139 1780 A 16 PRO HB3 A 10 LEU HD11 1.0 0.0 3.60 3140 1780 A 16 PRO HB3 A 10 LEU HD21 1.0 0.0 3.60 3141 1781 A 10 LEU HD21 A 16 PRO HG2 1.0 0.0 4.39 3142 1781 A 16 PRO HG3 A 10 LEU HD11 1.0 0.0 4.39 3143 1781 A 16 PRO HG3 A 10 LEU HD21 1.0 0.0 4.39 3144 1781 A 10 LEU HD11 A 16 PRO HG2 1.0 0.0 4.39 3145 1782 A 10 LEU HD21 A 16 PRO HD2 1.0 0.0 4.68 3146 1782 A 10 LEU HD11 A 16 PRO HD2 1.0 0.0 4.68 3147 1782 A 16 PRO HD3 A 10 LEU HD11 1.0 0.0 4.68 3148 1782 A 10 LEU HD21 A 16 PRO HD3 1.0 0.0 4.68 3149 1783 A 36 THR HB A 10 LEU HD11 1.0 0.0 4.14 3150 1783 A 36 THR HB A 10 LEU HD21 1.0 0.0 4.14 3151 1784 A 36 THR HG21 A 10 LEU HD11 1.0 0.0 3.77 3152 1784 A 36 THR HG21 A 10 LEU HD21 1.0 0.0 3.77 3153 1785 A 47 ILE H A 10 LEU HD11 1.0 0.0 5.94 3154 1785 A 10 LEU HD21 A 47 ILE H 1.0 0.0 5.94 3155 1786 A 49 GLN HE21 A 10 LEU HD11 1.0 0.0 4.90 3156 1786 A 10 LEU HD21 A 49 GLN HE21 1.0 0.0 4.90 3157 1787 A 49 GLN HE22 A 10 LEU HD11 1.0 0.0 4.82 3158 1787 A 10 LEU HD21 A 49 GLN HE22 1.0 0.0 4.82 3159 1788 A 58 GLN HE22 A 10 LEU HD11 1.0 0.0 4.82 3160 1788 A 10 LEU HD21 A 58 GLN HE22 1.0 0.0 4.82 3161 1788 A 58 GLN HE21 A 10 LEU HD21 1.0 0.0 4.82 3162 1788 A 58 GLN HE21 A 10 LEU HD11 1.0 0.0 4.82 3163 1789 A 11 PRO HB2 A 13 GLY HA2 1.0 0.0 5.24 3164 1789 A 11 PRO HB3 A 13 GLY HA2 1.0 0.0 5.24 3165 1789 A 13 GLY HA3 A 11 PRO HB2 1.0 0.0 5.24 3166 1789 A 11 PRO HB3 A 13 GLY HA3 1.0 0.0 5.24 3167 1790 A 58 GLN HE21 A 11 PRO HG2 1.0 0.0 4.61 3168 1790 A 58 GLN HE21 A 11 PRO HG3 1.0 0.0 4.61 3169 1790 A 11 PRO HG3 A 58 GLN HE22 1.0 0.0 4.61 3170 1790 A 58 GLN HE22 A 11 PRO HG2 1.0 0.0 4.61 3171 1791 A 14 ALA HB1 A 11 PRO HD2 1.0 0.0 4.47 3172 1791 A 11 PRO HD3 A 14 ALA HB1 1.0 0.0 4.47 3173 1792 A 47 ILE HG21 A 11 PRO HD2 1.0 0.0 5.05 3174 1792 A 47 ILE HG21 A 11 PRO HD3 1.0 0.0 5.05 3175 1793 A 47 ILE HD11 A 11 PRO HD2 1.0 0.0 3.74 3176 1793 A 47 ILE HD11 A 11 PRO HD3 1.0 0.0 3.74 3177 1794 A 11 PRO HD3 A 58 GLN HE22 1.0 0.0 4.15 3178 1794 A 58 GLN HE21 A 11 PRO HD2 1.0 0.0 4.15 3179 1794 A 11 PRO HD3 A 58 GLN HE21 1.0 0.0 4.15 3180 1794 A 58 GLN HE22 A 11 PRO HD2 1.0 0.0 4.15 3181 1795 A 60 ILE HD11 A 11 PRO HD2 1.0 0.0 4.70 3182 1795 A 11 PRO HD3 A 60 ILE HD11 1.0 0.0 4.70 3183 1796 A 12 VAL H A 13 GLY HA2 1.0 0.0 4.61 3184 1796 A 12 VAL H A 13 GLY HA3 1.0 0.0 4.61 3185 1797 A 12 VAL HG11 A 13 GLY HA2 1.0 0.0 4.61 3186 1797 A 12 VAL HG21 A 13 GLY HA2 1.0 0.0 4.61 3187 1797 A 13 GLY HA3 A 12 VAL HG11 1.0 0.0 4.61 3188 1797 A 12 VAL HG21 A 13 GLY HA3 1.0 0.0 4.61 3189 1798 A 14 ALA H A 13 GLY HA2 1.0 0.0 3.08 3190 1798 A 13 GLY HA3 A 14 ALA H 1.0 0.0 3.08 3191 1799 A 14 ALA HB1 A 13 GLY HA2 1.0 0.0 5.54 3192 1799 A 14 ALA HB1 A 13 GLY HA3 1.0 0.0 5.54 3193 1800 A 14 ALA H A 40 ARG HD2 1.0 0.0 3.80 3194 1800 A 40 ARG HD3 A 14 ALA H 1.0 0.0 3.80 3195 1801 A 14 ALA HB1 A 16 PRO HD2 1.0 0.0 5.61 3196 1801 A 14 ALA HB1 A 16 PRO HD3 1.0 0.0 5.61 3197 1802 A 14 ALA HB1 A 40 ARG HD2 1.0 0.0 3.67 3198 1802 A 14 ALA HB1 A 40 ARG HD3 1.0 0.0 3.67 3199 1803 A 15 GLN H A 16 PRO HD2 1.0 0.0 4.13 3200 1803 A 15 GLN H A 16 PRO HD3 1.0 0.0 4.13 3201 1804 A 15 GLN H A 17 LEU HD11 1.0 0.0 5.28 3202 1804 A 17 LEU HD21 A 15 GLN H 1.0 0.0 5.28 3203 1805 A 15 GLN H A 40 ARG HD2 1.0 0.0 4.66 3204 1805 A 40 ARG HD3 A 15 GLN H 1.0 0.0 4.66 3205 1806 A 15 GLN HB2 A 17 LEU HD11 1.0 0.0 4.58 3206 1806 A 15 GLN HB3 A 17 LEU HD11 1.0 0.0 4.58 3207 1806 A 17 LEU HD21 A 15 GLN HB2 1.0 0.0 4.58 3208 1806 A 17 LEU HD21 A 15 GLN HB3 1.0 0.0 4.58 3209 1807 A 15 GLN HE21 A 15 GLN HB2 1.0 0.0 4.59 3210 1807 A 15 GLN HB3 A 15 GLN HE21 1.0 0.0 4.59 3211 1807 A 15 GLN HE22 A 15 GLN HB2 1.0 0.0 4.59 3212 1807 A 15 GLN HB3 A 15 GLN HE22 1.0 0.0 4.59 3213 1808 A 15 GLN HB3 A 16 PRO HD2 1.0 0.0 4.20 3214 1808 A 15 GLN HB2 A 16 PRO HD2 1.0 0.0 4.20 3215 1808 A 16 PRO HD3 A 15 GLN HB2 1.0 0.0 4.20 3216 1808 A 15 GLN HB3 A 16 PRO HD3 1.0 0.0 4.20 3217 1809 A 15 GLN HB2 A 17 LEU HD11 1.0 0.0 4.55 3218 1809 A 15 GLN HB3 A 17 LEU HD11 1.0 0.0 4.55 3219 1809 A 17 LEU HD21 A 15 GLN HB2 1.0 0.0 4.55 3220 1809 A 17 LEU HD21 A 15 GLN HB3 1.0 0.0 4.55 3221 1810 A 15 GLN HG3 A 16 PRO HD2 1.0 0.0 4.08 3222 1810 A 15 GLN HG2 A 16 PRO HD2 1.0 0.0 4.08 3223 1810 A 16 PRO HD3 A 15 GLN HG2 1.0 0.0 4.08 3224 1810 A 15 GLN HG3 A 16 PRO HD3 1.0 0.0 4.08 3225 1811 A 15 GLN HG2 A 17 LEU HD11 1.0 0.0 4.84 3226 1811 A 15 GLN HG3 A 17 LEU HD11 1.0 0.0 4.84 3227 1811 A 17 LEU HD21 A 15 GLN HG2 1.0 0.0 4.84 3228 1811 A 17 LEU HD21 A 15 GLN HG3 1.0 0.0 4.84 3229 1812 A 17 LEU HD21 A 15 GLN HE21 1.0 0.0 4.83 3230 1812 A 15 GLN HE21 A 17 LEU HD11 1.0 0.0 4.83 3231 1812 A 17 LEU HD21 A 15 GLN HE22 1.0 0.0 4.83 3232 1812 A 15 GLN HE22 A 17 LEU HD11 1.0 0.0 4.83 3233 1813 A 38 ALA HB1 A 16 PRO HD2 1.0 0.0 5.33 3234 1813 A 38 ALA HB1 A 16 PRO HD3 1.0 0.0 5.33 3235 1814 A 17 LEU H A 17 LEU HD11 1.0 0.0 3.97 3236 1814 A 17 LEU H A 17 LEU HD21 1.0 0.0 3.97 3237 1815 A 17 LEU H A 37 LEU HD11 1.0 0.0 4.54 3238 1815 A 17 LEU H A 37 LEU HD21 1.0 0.0 4.54 3239 1816 A 17 LEU HB2 A 17 LEU HD11 1.0 0.0 3.61 3240 1816 A 17 LEU HB3 A 17 LEU HD11 1.0 0.0 3.61 3241 1816 A 17 LEU HD21 A 17 LEU HB2 1.0 0.0 3.61 3242 1816 A 17 LEU HD21 A 17 LEU HB3 1.0 0.0 3.61 3243 1817 A 17 LEU HB2 A 37 LEU HD11 1.0 0.0 4.26 3244 1817 A 17 LEU HB3 A 37 LEU HD11 1.0 0.0 4.26 3245 1817 A 37 LEU HD21 A 17 LEU HB2 1.0 0.0 4.26 3246 1817 A 37 LEU HD21 A 17 LEU HB3 1.0 0.0 4.26 3247 1818 A 17 LEU HB2 A 17 LEU HD11 1.0 0.0 3.54 3248 1818 A 17 LEU HB3 A 17 LEU HD11 1.0 0.0 3.54 3249 1818 A 17 LEU HD21 A 17 LEU HB2 1.0 0.0 3.54 3250 1818 A 17 LEU HD21 A 17 LEU HB3 1.0 0.0 3.54 3251 1819 A 17 LEU HB2 A 37 LEU HD11 1.0 0.0 4.65 3252 1819 A 17 LEU HB3 A 37 LEU HD11 1.0 0.0 4.65 3253 1819 A 37 LEU HD21 A 17 LEU HB2 1.0 0.0 4.65 3254 1819 A 37 LEU HD21 A 17 LEU HB3 1.0 0.0 4.65 3255 1820 A 17 LEU HG A 37 LEU HD11 1.0 0.0 4.57 3256 1820 A 37 LEU HD21 A 17 LEU HG 1.0 0.0 4.57 3257 1821 A 18 ALA H A 17 LEU HD11 1.0 0.0 4.63 3258 1821 A 18 ALA H A 17 LEU HD21 1.0 0.0 4.63 3259 1822 A 17 LEU HD11 A 37 LEU HD11 1.0 0.0 3.72 3260 1822 A 17 LEU HD21 A 37 LEU HD11 1.0 0.0 3.72 3261 1822 A 37 LEU HD21 A 17 LEU HD11 1.0 0.0 3.72 3262 1822 A 37 LEU HD21 A 17 LEU HD21 1.0 0.0 3.72 3263 1823 A 17 LEU HD21 A 39 GLN HB2 1.0 0.0 4.38 3264 1823 A 17 LEU HD11 A 39 GLN HB2 1.0 0.0 4.38 3265 1823 A 39 GLN HB3 A 17 LEU HD11 1.0 0.0 4.38 3266 1823 A 17 LEU HD21 A 39 GLN HB3 1.0 0.0 4.38 3267 1824 A 17 LEU HD11 A 39 GLN HG2 1.0 0.0 5.07 3268 1824 A 17 LEU HD21 A 39 GLN HG2 1.0 0.0 5.07 3269 1824 A 39 GLN HG3 A 17 LEU HD11 1.0 0.0 5.07 3270 1824 A 39 GLN HG3 A 17 LEU HD21 1.0 0.0 5.07 3271 1825 A 17 LEU HD11 A 39 GLN HG2 1.0 0.0 4.68 3272 1825 A 17 LEU HD21 A 39 GLN HG2 1.0 0.0 4.68 3273 1825 A 39 GLN HG3 A 17 LEU HD11 1.0 0.0 4.68 3274 1825 A 39 GLN HG3 A 17 LEU HD21 1.0 0.0 4.68 3275 1826 A 39 GLN HE22 A 17 LEU HD11 1.0 0.0 4.97 3276 1826 A 17 LEU HD21 A 39 GLN HE22 1.0 0.0 4.97 3277 1827 A 40 ARG H A 17 LEU HD11 1.0 0.0 5.94 3278 1827 A 17 LEU HD21 A 40 ARG H 1.0 0.0 5.94 3279 1828 A 44 TYR HD% A 17 LEU HD11 1.0 0.0 3.59 3280 1828 A 44 TYR HD% A 17 LEU HD21 1.0 0.0 3.59 3281 1829 A 44 TYR HE% A 17 LEU HD11 1.0 0.0 3.31 3282 1829 A 17 LEU HD21 A 44 TYR HE% 1.0 0.0 3.31 3283 1830 A 45 GLU H A 17 LEU HD11 1.0 0.0 5.31 3284 1830 A 17 LEU HD21 A 45 GLU H 1.0 0.0 5.31 3285 1831 A 115 ALA HB1 A 17 LEU HD11 1.0 0.0 5.03 3286 1831 A 115 ALA HB1 A 17 LEU HD21 1.0 0.0 5.03 3287 1832 A 18 ALA H A 37 LEU HD11 1.0 0.0 4.38 3288 1832 A 37 LEU HD21 A 18 ALA H 1.0 0.0 4.38 3289 1833 A 18 ALA HB1 A 20 VAL HG11 1.0 0.0 5.24 3290 1833 A 20 VAL HG21 A 18 ALA HB1 1.0 0.0 5.24 3291 1834 A 18 ALA HB1 A 37 LEU HB2 1.0 0.0 3.52 3292 1834 A 37 LEU HB3 A 18 ALA HB1 1.0 0.0 3.52 3293 1835 A 18 ALA HB1 A 37 LEU HD11 1.0 0.0 4.23 3294 1835 A 37 LEU HD21 A 18 ALA HB1 1.0 0.0 4.23 3295 1836 A 19 THR HA A 20 VAL HG11 1.0 0.0 5.04 3296 1836 A 19 THR HA A 20 VAL HG21 1.0 0.0 5.04 3297 1837 A 19 THR HG21 A 20 VAL HG11 1.0 0.0 5.29 3298 1837 A 19 THR HG21 A 20 VAL HG21 1.0 0.0 5.29 3299 1838 A 21 GLU H A 20 VAL HG11 1.0 0.0 3.99 3300 1838 A 20 VAL HG21 A 21 GLU H 1.0 0.0 3.99 3301 1839 A 22 GLY H A 20 VAL HG11 1.0 0.0 5.47 3302 1839 A 20 VAL HG21 A 22 GLY H 1.0 0.0 5.47 3303 1840 A 35 LEU H A 20 VAL HG11 1.0 0.0 4.39 3304 1840 A 20 VAL HG21 A 35 LEU H 1.0 0.0 4.39 3305 1841 A 20 VAL HG11 A 35 LEU HB2 1.0 0.0 3.98 3306 1841 A 20 VAL HG21 A 35 LEU HB2 1.0 0.0 3.98 3307 1841 A 35 LEU HB3 A 20 VAL HG11 1.0 0.0 3.98 3308 1841 A 20 VAL HG21 A 35 LEU HB3 1.0 0.0 3.98 3309 1842 A 20 VAL HG11 A 35 LEU HB2 1.0 0.0 4.79 3310 1842 A 20 VAL HG21 A 35 LEU HB2 1.0 0.0 4.79 3311 1842 A 35 LEU HB3 A 20 VAL HG11 1.0 0.0 4.79 3312 1842 A 20 VAL HG21 A 35 LEU HB3 1.0 0.0 4.79 3313 1843 A 20 VAL HG11 A 35 LEU HD11 1.0 0.0 4.15 3314 1843 A 20 VAL HG21 A 35 LEU HD11 1.0 0.0 4.15 3315 1843 A 35 LEU HD21 A 20 VAL HG11 1.0 0.0 4.15 3316 1843 A 20 VAL HG21 A 35 LEU HD21 1.0 0.0 4.15 3317 1844 A 36 THR H A 20 VAL HG11 1.0 0.0 5.94 3318 1844 A 20 VAL HG21 A 36 THR H 1.0 0.0 5.94 3319 1845 A 103 ILE HG21 A 20 VAL HG11 1.0 0.0 3.95 3320 1845 A 20 VAL HG21 A 103 ILE HG21 1.0 0.0 3.95 3321 1846 A 103 ILE HD11 A 20 VAL HG11 1.0 0.0 3.95 3322 1846 A 20 VAL HG21 A 103 ILE HD11 1.0 0.0 3.95 3323 1847 A 108 HIS H A 20 VAL HG11 1.0 0.0 5.26 3324 1847 A 20 VAL HG21 A 108 HIS H 1.0 0.0 5.26 3325 1848 A 20 VAL HG11 A 108 HIS HB2 1.0 0.0 4.57 3326 1848 A 20 VAL HG21 A 108 HIS HB2 1.0 0.0 4.57 3327 1848 A 108 HIS HB3 A 20 VAL HG11 1.0 0.0 4.57 3328 1848 A 20 VAL HG21 A 108 HIS HB3 1.0 0.0 4.57 3329 1849 A 108 HIS HD2 A 20 VAL HG11 1.0 0.0 4.75 3330 1849 A 20 VAL HG21 A 108 HIS HD2 1.0 0.0 4.75 3331 1850 A 109 CYS H A 20 VAL HG11 1.0 0.0 4.93 3332 1850 A 20 VAL HG21 A 109 CYS H 1.0 0.0 4.93 3333 1851 A 109 CYS HA A 20 VAL HG11 1.0 0.0 4.75 3334 1851 A 20 VAL HG21 A 109 CYS HA 1.0 0.0 4.75 3335 1852 A 112 PHE H A 20 VAL HG11 1.0 0.0 4.65 3336 1852 A 20 VAL HG21 A 112 PHE H 1.0 0.0 4.65 3337 1853 A 112 PHE HA A 20 VAL HG11 1.0 0.0 5.46 3338 1853 A 20 VAL HG21 A 112 PHE HA 1.0 0.0 5.46 3339 1854 A 20 VAL HG11 A 112 PHE HB2 1.0 0.0 4.08 3340 1854 A 20 VAL HG21 A 112 PHE HB2 1.0 0.0 4.08 3341 1854 A 112 PHE HB3 A 20 VAL HG11 1.0 0.0 4.08 3342 1854 A 20 VAL HG21 A 112 PHE HB3 1.0 0.0 4.08 3343 1855 A 20 VAL HG11 A 112 PHE HB2 1.0 0.0 3.84 3344 1855 A 20 VAL HG21 A 112 PHE HB2 1.0 0.0 3.84 3345 1855 A 112 PHE HB3 A 20 VAL HG11 1.0 0.0 3.84 3346 1855 A 20 VAL HG21 A 112 PHE HB3 1.0 0.0 3.84 3347 1856 A 112 PHE HD% A 20 VAL HG11 1.0 0.0 4.01 3348 1856 A 20 VAL HG21 A 112 PHE HD% 1.0 0.0 4.01 3349 1857 A 112 PHE HZ A 20 VAL HG11 1.0 0.0 5.94 3350 1857 A 20 VAL HG21 A 112 PHE HZ 1.0 0.0 5.94 3351 1858 A 113 LEU H A 20 VAL HG11 1.0 0.0 5.34 3352 1858 A 20 VAL HG21 A 113 LEU H 1.0 0.0 5.34 3353 1859 A 21 GLU H A 21 GLU HB2 1.0 0.0 3.18 3354 1859 A 21 GLU H A 21 GLU HB3 1.0 0.0 3.18 3355 1860 A 22 GLY H A 21 GLU HB2 1.0 0.0 3.99 3356 1860 A 21 GLU HB3 A 22 GLY H 1.0 0.0 3.99 3357 1861 A 22 GLY H A 21 GLU HG2 1.0 0.0 4.31 3358 1861 A 21 GLU HG3 A 22 GLY H 1.0 0.0 4.31 3359 1862 A 22 GLY H A 35 LEU HD11 1.0 0.0 5.94 3360 1862 A 35 LEU HD21 A 22 GLY H 1.0 0.0 5.94 3361 1863 A 23 MET H A 22 GLY HA2 1.0 0.0 2.93 3362 1863 A 23 MET H A 22 GLY HA3 1.0 0.0 2.93 3363 1864 A 23 MET HE1 A 22 GLY HA2 1.0 0.0 5.35 3364 1864 A 23 MET HE1 A 22 GLY HA3 1.0 0.0 5.35 3365 1865 A 24 GLU H A 22 GLY HA2 1.0 0.0 5.34 3366 1865 A 24 GLU H A 22 GLY HA3 1.0 0.0 5.34 3367 1866 A 33 CYS H A 22 GLY HA2 1.0 0.0 4.52 3368 1866 A 33 CYS H A 22 GLY HA3 1.0 0.0 4.52 3369 1867 A 102 GLU H A 22 GLY HA2 1.0 0.0 4.82 3370 1867 A 102 GLU H A 22 GLY HA3 1.0 0.0 4.82 3371 1868 A 103 ILE H A 22 GLY HA2 1.0 0.0 5.33 3372 1868 A 22 GLY HA3 A 103 ILE H 1.0 0.0 5.33 3373 1869 A 103 ILE HD11 A 22 GLY HA2 1.0 0.0 4.76 3374 1869 A 103 ILE HD11 A 22 GLY HA3 1.0 0.0 4.76 3375 1870 A 23 MET H A 23 MET HG2 1.0 0.0 3.69 3376 1870 A 23 MET HG3 A 23 MET H 1.0 0.0 3.69 3377 1871 A 23 MET H A 104 PRO HD2 1.0 0.0 3.80 3378 1871 A 104 PRO HD3 A 23 MET H 1.0 0.0 3.80 3379 1872 A 24 GLU H A 23 MET HG2 1.0 0.0 4.80 3380 1872 A 23 MET HG3 A 24 GLU H 1.0 0.0 4.80 3381 1873 A 23 MET HE1 A 104 PRO HD2 1.0 0.0 4.89 3382 1873 A 104 PRO HD3 A 23 MET HE1 1.0 0.0 4.89 3383 1874 A 24 GLU H A 50 LEU HD11 1.0 0.0 5.39 3384 1874 A 50 LEU HD21 A 24 GLU H 1.0 0.0 5.39 3385 1875 A 24 GLU HB3 A 50 LEU HD11 1.0 0.0 4.03 3386 1875 A 24 GLU HB2 A 50 LEU HD11 1.0 0.0 4.03 3387 1875 A 50 LEU HD21 A 24 GLU HB2 1.0 0.0 4.03 3388 1875 A 50 LEU HD21 A 24 GLU HB3 1.0 0.0 4.03 3389 1876 A 24 GLU HG2 A 50 LEU HD11 1.0 0.0 5.94 3390 1876 A 50 LEU HD21 A 24 GLU HG2 1.0 0.0 5.94 3391 1876 A 50 LEU HD21 A 24 GLU HG3 1.0 0.0 5.94 3392 1876 A 24 GLU HG3 A 50 LEU HD11 1.0 0.0 5.94 3393 1877 A 24 GLU HG2 A 50 LEU HD11 1.0 0.0 5.75 3394 1877 A 50 LEU HD21 A 24 GLU HG2 1.0 0.0 5.75 3395 1877 A 50 LEU HD21 A 24 GLU HG3 1.0 0.0 5.75 3396 1877 A 24 GLU HG3 A 50 LEU HD11 1.0 0.0 5.75 3397 1878 A 25 MET H A 26 LYS HE2 1.0 0.0 5.34 3398 1878 A 25 MET H A 26 LYS HE3 1.0 0.0 5.34 3399 1879 A 25 MET H A 100 ARG HB2 1.0 0.0 3.61 3400 1879 A 25 MET H A 100 ARG HB3 1.0 0.0 3.61 3401 1880 A 25 MET HB3 A 100 ARG HB2 1.0 0.0 4.22 3402 1880 A 25 MET HB2 A 100 ARG HB2 1.0 0.0 4.22 3403 1880 A 100 ARG HB3 A 25 MET HB2 1.0 0.0 4.22 3404 1880 A 25 MET HB3 A 100 ARG HB3 1.0 0.0 4.22 3405 1881 A 25 MET HG3 A 100 ARG HB2 1.0 0.0 5.19 3406 1881 A 25 MET HG2 A 100 ARG HB2 1.0 0.0 5.19 3407 1881 A 100 ARG HB3 A 25 MET HG2 1.0 0.0 5.19 3408 1881 A 25 MET HG3 A 100 ARG HB3 1.0 0.0 5.19 3409 1882 A 25 MET HE1 A 88 LYS HG2 1.0 0.0 3.71 3410 1882 A 25 MET HE1 A 88 LYS HG3 1.0 0.0 3.71 3411 1883 A 26 LYS H A 26 LYS HB2 1.0 0.0 3.19 3412 1883 A 26 LYS HB3 A 26 LYS H 1.0 0.0 3.19 3413 1884 A 26 LYS H A 26 LYS HE2 1.0 0.0 5.34 3414 1884 A 26 LYS HE3 A 26 LYS H 1.0 0.0 5.34 3415 1885 A 26 LYS H A 30 ARG HB2 1.0 0.0 4.47 3416 1885 A 26 LYS H A 30 ARG HB3 1.0 0.0 4.47 3417 1886 A 26 LYS HB2 A 26 LYS HE2 1.0 0.0 3.69 3418 1886 A 26 LYS HB3 A 26 LYS HE2 1.0 0.0 3.69 3419 1886 A 26 LYS HE3 A 26 LYS HB2 1.0 0.0 3.69 3420 1886 A 26 LYS HB3 A 26 LYS HE3 1.0 0.0 3.69 3421 1887 A 27 GLY H A 26 LYS HB2 1.0 0.0 3.60 3422 1887 A 26 LYS HB3 A 27 GLY H 1.0 0.0 3.60 3423 1888 A 29 LEU H A 26 LYS HB2 1.0 0.0 3.28 3424 1888 A 29 LEU H A 26 LYS HB3 1.0 0.0 3.28 3425 1889 A 26 LYS HB2 A 29 LEU HD11 1.0 0.0 5.15 3426 1889 A 26 LYS HB3 A 29 LEU HD11 1.0 0.0 5.15 3427 1889 A 29 LEU HD21 A 26 LYS HB2 1.0 0.0 5.15 3428 1889 A 29 LEU HD21 A 26 LYS HB3 1.0 0.0 5.15 3429 1890 A 26 LYS HE2 A 50 LEU HD11 1.0 0.0 4.77 3430 1890 A 26 LYS HE3 A 50 LEU HD11 1.0 0.0 4.77 3431 1890 A 50 LEU HD21 A 26 LYS HE2 1.0 0.0 4.77 3432 1890 A 50 LEU HD21 A 26 LYS HE3 1.0 0.0 4.77 3433 1891 A 29 LEU HD21 A 31 GLU HB2 1.0 0.0 5.13 3434 1891 A 29 LEU HD11 A 31 GLU HB2 1.0 0.0 5.13 3435 1891 A 31 GLU HB3 A 29 LEU HD11 1.0 0.0 5.13 3436 1891 A 31 GLU HB3 A 29 LEU HD21 1.0 0.0 5.13 3437 1892 A 30 ARG H A 30 ARG HB2 1.0 0.0 3.45 3438 1892 A 30 ARG H A 30 ARG HB3 1.0 0.0 3.45 3439 1893 A 30 ARG H A 30 ARG HG2 1.0 0.0 3.12 3440 1893 A 30 ARG H A 30 ARG HG3 1.0 0.0 3.12 3441 1894 A 30 ARG H A 30 ARG HD2 1.0 0.0 3.96 3442 1894 A 30 ARG H A 30 ARG HD3 1.0 0.0 3.96 3443 1895 A 31 GLU H A 30 ARG HB2 1.0 0.0 3.36 3444 1895 A 31 GLU H A 30 ARG HB3 1.0 0.0 3.36 3445 1896 A 31 GLU H A 30 ARG HG2 1.0 0.0 4.16 3446 1896 A 31 GLU H A 30 ARG HG3 1.0 0.0 4.16 3447 1897 A 31 GLU H A 30 ARG HD2 1.0 0.0 4.00 3448 1897 A 31 GLU H A 30 ARG HD3 1.0 0.0 4.00 3449 1898 A 31 GLU HB2 A 50 LEU HD11 1.0 0.0 5.78 3450 1898 A 50 LEU HD21 A 31 GLU HB2 1.0 0.0 5.78 3451 1898 A 31 GLU HB3 A 50 LEU HD21 1.0 0.0 5.78 3452 1898 A 31 GLU HB3 A 50 LEU HD11 1.0 0.0 5.78 3453 1899 A 31 GLU HG2 A 50 LEU HD11 1.0 0.0 3.99 3454 1899 A 31 GLU HG3 A 50 LEU HD11 1.0 0.0 3.99 3455 1899 A 50 LEU HD21 A 31 GLU HG2 1.0 0.0 3.99 3456 1899 A 31 GLU HG3 A 50 LEU HD21 1.0 0.0 3.99 3457 1900 A 32 PRO HB3 A 51 HIS HB2 1.0 0.0 3.71 3458 1900 A 32 PRO HB2 A 51 HIS HB2 1.0 0.0 3.71 3459 1900 A 51 HIS HB3 A 32 PRO HB2 1.0 0.0 3.71 3460 1900 A 32 PRO HB3 A 51 HIS HB3 1.0 0.0 3.71 3461 1901 A 32 PRO HB3 A 51 HIS HB2 1.0 0.0 4.48 3462 1901 A 32 PRO HB2 A 51 HIS HB2 1.0 0.0 4.48 3463 1901 A 51 HIS HB3 A 32 PRO HB2 1.0 0.0 4.48 3464 1901 A 32 PRO HB3 A 51 HIS HB3 1.0 0.0 4.48 3465 1902 A 32 PRO HG2 A 51 HIS HB2 1.0 0.0 3.91 3466 1902 A 51 HIS HB3 A 32 PRO HG2 1.0 0.0 3.91 3467 1902 A 51 HIS HB3 A 32 PRO HG3 1.0 0.0 3.91 3468 1902 A 32 PRO HG3 A 51 HIS HB2 1.0 0.0 3.91 3469 1903 A 32 PRO HG2 A 51 HIS HB2 1.0 0.0 4.38 3470 1903 A 51 HIS HB3 A 32 PRO HG2 1.0 0.0 4.38 3471 1903 A 51 HIS HB3 A 32 PRO HG3 1.0 0.0 4.38 3472 1903 A 32 PRO HG3 A 51 HIS HB2 1.0 0.0 4.38 3473 1904 A 33 CYS H A 50 LEU HD11 1.0 0.0 5.44 3474 1904 A 33 CYS H A 50 LEU HD21 1.0 0.0 5.44 3475 1905 A 33 CYS HB2 A 50 LEU HD11 1.0 0.0 4.12 3476 1905 A 50 LEU HD21 A 33 CYS HB2 1.0 0.0 4.12 3477 1905 A 33 CYS HB3 A 50 LEU HD21 1.0 0.0 4.12 3478 1905 A 33 CYS HB3 A 50 LEU HD11 1.0 0.0 4.12 3479 1906 A 33 CYS HB2 A 50 LEU HD11 1.0 0.0 3.85 3480 1906 A 50 LEU HD21 A 33 CYS HB2 1.0 0.0 3.85 3481 1906 A 33 CYS HB3 A 50 LEU HD21 1.0 0.0 3.85 3482 1906 A 33 CYS HB3 A 50 LEU HD11 1.0 0.0 3.85 3483 1907 A 34 ALA H A 50 LEU HD11 1.0 0.0 4.52 3484 1907 A 50 LEU HD21 A 34 ALA H 1.0 0.0 4.52 3485 1908 A 34 ALA HB1 A 49 GLN HG2 1.0 0.0 3.88 3486 1908 A 49 GLN HG3 A 34 ALA HB1 1.0 0.0 3.88 3487 1909 A 35 LEU H A 35 LEU HD11 1.0 0.0 4.13 3488 1909 A 35 LEU HD21 A 35 LEU H 1.0 0.0 4.13 3489 1910 A 35 LEU HB3 A 35 LEU HD11 1.0 0.0 3.51 3490 1910 A 35 LEU HB2 A 35 LEU HD11 1.0 0.0 3.51 3491 1910 A 35 LEU HD21 A 35 LEU HB2 1.0 0.0 3.51 3492 1910 A 35 LEU HD21 A 35 LEU HB3 1.0 0.0 3.51 3493 1911 A 35 LEU HB3 A 35 LEU HD11 1.0 0.0 3.36 3494 1911 A 35 LEU HB2 A 35 LEU HD11 1.0 0.0 3.36 3495 1911 A 35 LEU HD21 A 35 LEU HB2 1.0 0.0 3.36 3496 1911 A 35 LEU HD21 A 35 LEU HB3 1.0 0.0 3.36 3497 1912 A 36 THR H A 35 LEU HD11 1.0 0.0 4.56 3498 1912 A 35 LEU HD21 A 36 THR H 1.0 0.0 4.56 3499 1913 A 35 LEU HD21 A 46 LEU HD11 1.0 0.0 4.09 3500 1913 A 35 LEU HD11 A 46 LEU HD11 1.0 0.0 4.09 3501 1913 A 46 LEU HD21 A 35 LEU HD11 1.0 0.0 4.09 3502 1913 A 35 LEU HD21 A 46 LEU HD21 1.0 0.0 4.09 3503 1914 A 48 ILE H A 35 LEU HD11 1.0 0.0 5.94 3504 1914 A 35 LEU HD21 A 48 ILE H 1.0 0.0 5.94 3505 1915 A 48 ILE HB A 35 LEU HD11 1.0 0.0 5.89 3506 1915 A 35 LEU HD21 A 48 ILE HB 1.0 0.0 5.89 3507 1916 A 48 ILE HG21 A 35 LEU HD11 1.0 0.0 4.35 3508 1916 A 35 LEU HD21 A 48 ILE HG21 1.0 0.0 4.35 3509 1917 A 35 LEU HD11 A 48 ILE HG12 1.0 0.0 4.31 3510 1917 A 35 LEU HD21 A 48 ILE HG12 1.0 0.0 4.31 3511 1917 A 48 ILE HG13 A 35 LEU HD11 1.0 0.0 4.31 3512 1917 A 35 LEU HD21 A 48 ILE HG13 1.0 0.0 4.31 3513 1918 A 48 ILE HD11 A 35 LEU HD11 1.0 0.0 5.09 3514 1918 A 35 LEU HD21 A 48 ILE HD11 1.0 0.0 5.09 3515 1919 A 49 GLN H A 35 LEU HD11 1.0 0.0 5.04 3516 1919 A 35 LEU HD21 A 49 GLN H 1.0 0.0 5.04 3517 1920 A 35 LEU HD21 A 49 GLN HB2 1.0 0.0 5.94 3518 1920 A 35 LEU HD11 A 49 GLN HB2 1.0 0.0 5.94 3519 1920 A 49 GLN HB3 A 35 LEU HD11 1.0 0.0 5.94 3520 1920 A 35 LEU HD21 A 49 GLN HB3 1.0 0.0 5.94 3521 1921 A 67 PHE HZ A 35 LEU HD11 1.0 0.0 5.69 3522 1921 A 67 PHE HZ A 35 LEU HD21 1.0 0.0 5.69 3523 1922 A 89 ILE H A 35 LEU HD11 1.0 0.0 5.94 3524 1922 A 35 LEU HD21 A 89 ILE H 1.0 0.0 5.94 3525 1923 A 89 ILE HD11 A 35 LEU HD11 1.0 0.0 4.27 3526 1923 A 35 LEU HD21 A 89 ILE HD11 1.0 0.0 4.27 3527 1924 A 101 PHE H A 35 LEU HD11 1.0 0.0 5.94 3528 1924 A 35 LEU HD21 A 101 PHE H 1.0 0.0 5.94 3529 1925 A 35 LEU HD21 A 101 PHE HB2 1.0 0.0 4.86 3530 1925 A 35 LEU HD11 A 101 PHE HB2 1.0 0.0 4.86 3531 1925 A 101 PHE HB3 A 35 LEU HD11 1.0 0.0 4.86 3532 1925 A 35 LEU HD21 A 101 PHE HB3 1.0 0.0 4.86 3533 1926 A 35 LEU HD21 A 101 PHE HB2 1.0 0.0 4.55 3534 1926 A 35 LEU HD11 A 101 PHE HB2 1.0 0.0 4.55 3535 1926 A 101 PHE HB3 A 35 LEU HD11 1.0 0.0 4.55 3536 1926 A 35 LEU HD21 A 101 PHE HB3 1.0 0.0 4.55 3537 1927 A 101 PHE HD% A 35 LEU HD11 1.0 0.0 4.04 3538 1927 A 35 LEU HD21 A 101 PHE HD% 1.0 0.0 4.04 3539 1928 A 101 PHE HE% A 35 LEU HD11 1.0 0.0 4.27 3540 1928 A 35 LEU HD21 A 101 PHE HE% 1.0 0.0 4.27 3541 1929 A 102 GLU H A 35 LEU HD11 1.0 0.0 5.78 3542 1929 A 35 LEU HD21 A 102 GLU H 1.0 0.0 5.78 3543 1930 A 35 LEU HD11 A 103 ILE HG12 1.0 0.0 4.60 3544 1930 A 35 LEU HD21 A 103 ILE HG12 1.0 0.0 4.60 3545 1930 A 103 ILE HG13 A 35 LEU HD11 1.0 0.0 4.60 3546 1930 A 35 LEU HD21 A 103 ILE HG13 1.0 0.0 4.60 3547 1931 A 103 ILE HD11 A 35 LEU HD11 1.0 0.0 4.17 3548 1931 A 103 ILE HD11 A 35 LEU HD21 1.0 0.0 4.17 3549 1932 A 112 PHE HE% A 35 LEU HD11 1.0 0.0 3.99 3550 1932 A 112 PHE HE% A 35 LEU HD21 1.0 0.0 3.99 3551 1933 A 112 PHE HZ A 35 LEU HD11 1.0 0.0 4.51 3552 1933 A 35 LEU HD21 A 112 PHE HZ 1.0 0.0 4.51 3553 1934 A 36 THR H A 46 LEU HD11 1.0 0.0 4.00 3554 1934 A 46 LEU HD21 A 36 THR H 1.0 0.0 4.00 3555 1935 A 36 THR HB A 46 LEU HD11 1.0 0.0 4.73 3556 1935 A 36 THR HB A 46 LEU HD21 1.0 0.0 4.73 3557 1936 A 36 THR HB A 47 ILE HG12 1.0 0.0 4.95 3558 1936 A 36 THR HB A 47 ILE HG13 1.0 0.0 4.95 3559 1937 A 36 THR HG21 A 47 ILE HG12 1.0 0.0 5.36 3560 1937 A 36 THR HG21 A 47 ILE HG13 1.0 0.0 5.36 3561 1938 A 37 LEU H A 37 LEU HD11 1.0 0.0 4.44 3562 1938 A 37 LEU HD21 A 37 LEU H 1.0 0.0 4.44 3563 1939 A 37 LEU HB2 A 37 LEU HD11 1.0 0.0 3.29 3564 1939 A 37 LEU HB3 A 37 LEU HD11 1.0 0.0 3.29 3565 1939 A 37 LEU HD21 A 37 LEU HB2 1.0 0.0 3.29 3566 1939 A 37 LEU HD21 A 37 LEU HB3 1.0 0.0 3.29 3567 1940 A 38 ALA H A 37 LEU HB2 1.0 0.0 4.19 3568 1940 A 38 ALA H A 37 LEU HB3 1.0 0.0 4.19 3569 1941 A 38 ALA HA A 37 LEU HB2 1.0 0.0 5.34 3570 1941 A 37 LEU HB3 A 38 ALA HA 1.0 0.0 5.34 3571 1942 A 44 TYR HD% A 37 LEU HB2 1.0 0.0 5.34 3572 1942 A 44 TYR HD% A 37 LEU HB3 1.0 0.0 5.34 3573 1943 A 112 PHE HD% A 37 LEU HB2 1.0 0.0 4.70 3574 1943 A 112 PHE HD% A 37 LEU HB3 1.0 0.0 4.70 3575 1944 A 37 LEU HB3 A 116 VAL HG11 1.0 0.0 4.28 3576 1944 A 37 LEU HB2 A 116 VAL HG11 1.0 0.0 4.28 3577 1944 A 116 VAL HG21 A 37 LEU HB2 1.0 0.0 4.28 3578 1944 A 116 VAL HG21 A 37 LEU HB3 1.0 0.0 4.28 3579 1945 A 38 ALA H A 37 LEU HD11 1.0 0.0 3.66 3580 1945 A 38 ALA H A 37 LEU HD21 1.0 0.0 3.66 3581 1946 A 39 GLN H A 37 LEU HD11 1.0 0.0 4.79 3582 1946 A 37 LEU HD21 A 39 GLN H 1.0 0.0 4.79 3583 1947 A 37 LEU HD21 A 39 GLN HB2 1.0 0.0 4.76 3584 1947 A 37 LEU HD11 A 39 GLN HB2 1.0 0.0 4.76 3585 1947 A 39 GLN HB3 A 37 LEU HD11 1.0 0.0 4.76 3586 1947 A 37 LEU HD21 A 39 GLN HB3 1.0 0.0 4.76 3587 1948 A 40 ARG H A 37 LEU HD11 1.0 0.0 5.94 3588 1948 A 37 LEU HD21 A 40 ARG H 1.0 0.0 5.94 3589 1949 A 37 LEU HD21 A 44 TYR HB2 1.0 0.0 3.99 3590 1949 A 37 LEU HD11 A 44 TYR HB2 1.0 0.0 3.99 3591 1949 A 44 TYR HB3 A 37 LEU HD11 1.0 0.0 3.99 3592 1949 A 44 TYR HB3 A 37 LEU HD21 1.0 0.0 3.99 3593 1950 A 44 TYR HD% A 37 LEU HD11 1.0 0.0 3.79 3594 1950 A 44 TYR HD% A 37 LEU HD21 1.0 0.0 3.79 3595 1951 A 44 TYR HE% A 37 LEU HD11 1.0 0.0 4.31 3596 1951 A 37 LEU HD21 A 44 TYR HE% 1.0 0.0 4.31 3597 1952 A 45 GLU H A 37 LEU HD11 1.0 0.0 3.86 3598 1952 A 37 LEU HD21 A 45 GLU H 1.0 0.0 3.86 3599 1953 A 37 LEU HD21 A 45 GLU HG2 1.0 0.0 5.14 3600 1953 A 37 LEU HD11 A 45 GLU HG2 1.0 0.0 5.14 3601 1953 A 45 GLU HG3 A 37 LEU HD11 1.0 0.0 5.14 3602 1953 A 37 LEU HD21 A 45 GLU HG3 1.0 0.0 5.14 3603 1954 A 37 LEU HD11 A 46 LEU HB2 1.0 0.0 5.24 3604 1954 A 37 LEU HD21 A 46 LEU HB2 1.0 0.0 5.24 3605 1954 A 46 LEU HB3 A 37 LEU HD11 1.0 0.0 5.24 3606 1954 A 37 LEU HD21 A 46 LEU HB3 1.0 0.0 5.24 3607 1955 A 37 LEU HD11 A 46 LEU HD11 1.0 0.0 5.22 3608 1955 A 37 LEU HD21 A 46 LEU HD11 1.0 0.0 5.22 3609 1955 A 46 LEU HD21 A 37 LEU HD11 1.0 0.0 5.22 3610 1955 A 37 LEU HD21 A 46 LEU HD21 1.0 0.0 5.22 3611 1956 A 63 ILE HB A 37 LEU HD11 1.0 0.0 5.89 3612 1956 A 37 LEU HD21 A 63 ILE HB 1.0 0.0 5.89 3613 1957 A 63 ILE HD11 A 37 LEU HD11 1.0 0.0 4.00 3614 1957 A 37 LEU HD21 A 63 ILE HD11 1.0 0.0 4.00 3615 1958 A 112 PHE HD% A 37 LEU HD11 1.0 0.0 5.62 3616 1958 A 37 LEU HD21 A 112 PHE HD% 1.0 0.0 5.62 3617 1959 A 115 ALA H A 37 LEU HD11 1.0 0.0 5.00 3618 1959 A 37 LEU HD21 A 115 ALA H 1.0 0.0 5.00 3619 1960 A 115 ALA HB1 A 37 LEU HD11 1.0 0.0 3.88 3620 1960 A 37 LEU HD21 A 115 ALA HB1 1.0 0.0 3.88 3621 1961 A 116 VAL H A 37 LEU HD11 1.0 0.0 4.24 3622 1961 A 116 VAL H A 37 LEU HD21 1.0 0.0 4.24 3623 1962 A 116 VAL HA A 37 LEU HD11 1.0 0.0 3.77 3624 1962 A 116 VAL HA A 37 LEU HD21 1.0 0.0 3.77 3625 1963 A 37 LEU HD11 A 116 VAL HG11 1.0 0.0 4.88 3626 1963 A 37 LEU HD21 A 116 VAL HG11 1.0 0.0 4.88 3627 1963 A 116 VAL HG21 A 37 LEU HD11 1.0 0.0 4.88 3628 1963 A 116 VAL HG21 A 37 LEU HD21 1.0 0.0 4.88 3629 1964 A 37 LEU HD11 A 116 VAL HG11 1.0 0.0 3.95 3630 1964 A 37 LEU HD21 A 116 VAL HG11 1.0 0.0 3.95 3631 1964 A 116 VAL HG21 A 37 LEU HD11 1.0 0.0 3.95 3632 1964 A 116 VAL HG21 A 37 LEU HD21 1.0 0.0 3.95 3633 1965 A 117 LEU H A 37 LEU HD11 1.0 0.0 5.13 3634 1965 A 117 LEU H A 37 LEU HD21 1.0 0.0 5.13 3635 1966 A 118 ALA HB1 A 37 LEU HD11 1.0 0.0 5.76 3636 1966 A 118 ALA HB1 A 37 LEU HD21 1.0 0.0 5.76 3637 1967 A 119 ALA H A 37 LEU HD11 1.0 0.0 4.41 3638 1967 A 37 LEU HD21 A 119 ALA H 1.0 0.0 4.41 3639 1968 A 119 ALA HB1 A 37 LEU HD11 1.0 0.0 4.26 3640 1968 A 119 ALA HB1 A 37 LEU HD21 1.0 0.0 4.26 3641 1969 A 120 GLN H A 37 LEU HD11 1.0 0.0 5.79 3642 1969 A 120 GLN H A 37 LEU HD21 1.0 0.0 5.79 3643 1970 A 40 ARG H A 40 ARG HG2 1.0 0.0 5.33 3644 1970 A 40 ARG H A 40 ARG HG3 1.0 0.0 5.33 3645 1971 A 40 ARG HB2 A 40 ARG HD2 1.0 0.0 3.50 3646 1971 A 40 ARG HB3 A 40 ARG HD2 1.0 0.0 3.50 3647 1971 A 40 ARG HD3 A 40 ARG HB2 1.0 0.0 3.50 3648 1971 A 40 ARG HD3 A 40 ARG HB3 1.0 0.0 3.50 3649 1972 A 40 ARG HG2 A 41 ASN HB2 1.0 0.0 4.35 3650 1972 A 40 ARG HG3 A 41 ASN HB2 1.0 0.0 4.35 3651 1972 A 41 ASN HB3 A 40 ARG HG2 1.0 0.0 4.35 3652 1972 A 40 ARG HG3 A 41 ASN HB3 1.0 0.0 4.35 3653 1973 A 41 ASN HD21 A 40 ARG HG2 1.0 0.0 3.56 3654 1973 A 41 ASN HD21 A 40 ARG HG3 1.0 0.0 3.56 3655 1973 A 41 ASN HD22 A 40 ARG HG2 1.0 0.0 3.56 3656 1973 A 41 ASN HD22 A 40 ARG HG3 1.0 0.0 3.56 3657 1974 A 42 GLY H A 40 ARG HG2 1.0 0.0 4.77 3658 1974 A 40 ARG HG3 A 42 GLY H 1.0 0.0 4.77 3659 1975 A 41 ASN HA A 41 ASN HD21 1.0 0.0 4.39 3660 1975 A 41 ASN HA A 41 ASN HD22 1.0 0.0 4.39 3661 1976 A 41 ASN HD22 A 41 ASN HB3 1.0 0.0 2.85 3662 1976 A 41 ASN HD21 A 41 ASN HB3 1.0 0.0 2.85 3663 1976 A 41 ASN HD22 A 41 ASN HB2 1.0 0.0 2.85 3664 1976 A 41 ASN HD21 A 41 ASN HB2 1.0 0.0 2.85 3665 1977 A 43 GLN H A 41 ASN HB2 1.0 0.0 3.89 3666 1977 A 43 GLN H A 41 ASN HB3 1.0 0.0 3.89 3667 1978 A 44 TYR H A 123 GLN HE21 1.0 0.0 4.04 3668 1978 A 44 TYR H A 123 GLN HE22 1.0 0.0 4.04 3669 1979 A 46 LEU H A 46 LEU HD11 1.0 0.0 4.71 3670 1979 A 46 LEU HD21 A 46 LEU H 1.0 0.0 4.71 3671 1980 A 47 ILE H A 46 LEU HD11 1.0 0.0 3.97 3672 1980 A 46 LEU HD21 A 47 ILE H 1.0 0.0 3.97 3673 1981 A 48 ILE HD11 A 46 LEU HD11 1.0 0.0 4.20 3674 1981 A 48 ILE HD11 A 46 LEU HD21 1.0 0.0 4.20 3675 1982 A 49 GLN H A 46 LEU HD11 1.0 0.0 5.54 3676 1982 A 46 LEU HD21 A 49 GLN H 1.0 0.0 5.54 3677 1983 A 61 ILE H A 46 LEU HD11 1.0 0.0 4.88 3678 1983 A 61 ILE H A 46 LEU HD21 1.0 0.0 4.88 3679 1984 A 67 PHE HD% A 46 LEU HD11 1.0 0.0 5.11 3680 1984 A 67 PHE HD% A 46 LEU HD21 1.0 0.0 5.11 3681 1985 A 67 PHE HE% A 46 LEU HD11 1.0 0.0 4.97 3682 1985 A 67 PHE HE% A 46 LEU HD21 1.0 0.0 4.97 3683 1986 A 67 PHE HZ A 46 LEU HD11 1.0 0.0 3.60 3684 1986 A 67 PHE HZ A 46 LEU HD21 1.0 0.0 3.60 3685 1987 A 112 PHE HD% A 46 LEU HD11 1.0 0.0 4.85 3686 1987 A 112 PHE HD% A 46 LEU HD21 1.0 0.0 4.85 3687 1988 A 112 PHE HE% A 46 LEU HD11 1.0 0.0 5.16 3688 1988 A 112 PHE HE% A 46 LEU HD21 1.0 0.0 5.16 3689 1989 A 116 VAL H A 46 LEU HD11 1.0 0.0 5.94 3690 1989 A 116 VAL H A 46 LEU HD21 1.0 0.0 5.94 3691 1990 A 46 LEU HD21 A 116 VAL HG11 1.0 0.0 3.87 3692 1990 A 46 LEU HD11 A 116 VAL HG11 1.0 0.0 3.87 3693 1990 A 116 VAL HG21 A 46 LEU HD11 1.0 0.0 3.87 3694 1990 A 116 VAL HG21 A 46 LEU HD21 1.0 0.0 3.87 3695 1991 A 47 ILE H A 47 ILE HG12 1.0 0.0 3.84 3696 1991 A 47 ILE HG13 A 47 ILE H 1.0 0.0 3.84 3697 1992 A 47 ILE HG21 A 47 ILE HG12 1.0 0.0 3.40 3698 1992 A 47 ILE HG21 A 47 ILE HG13 1.0 0.0 3.40 3699 1993 A 47 ILE HG21 A 58 GLN HG2 1.0 0.0 3.58 3700 1993 A 47 ILE HG21 A 58 GLN HG3 1.0 0.0 3.58 3701 1994 A 61 ILE H A 47 ILE HG12 1.0 0.0 4.51 3702 1994 A 61 ILE H A 47 ILE HG13 1.0 0.0 4.51 3703 1995 A 47 ILE HD11 A 58 GLN HE21 1.0 0.0 5.46 3704 1995 A 47 ILE HD11 A 58 GLN HE22 1.0 0.0 5.46 3705 1996 A 48 ILE H A 48 ILE HG12 1.0 0.0 3.30 3706 1996 A 48 ILE H A 48 ILE HG13 1.0 0.0 3.30 3707 1997 A 48 ILE H A 49 GLN HG2 1.0 0.0 5.20 3708 1997 A 49 GLN HG3 A 48 ILE H 1.0 0.0 5.20 3709 1998 A 48 ILE H A 59 ASP HB2 1.0 0.0 4.10 3710 1998 A 48 ILE H A 59 ASP HB3 1.0 0.0 4.10 3711 1999 A 48 ILE H A 61 ILE HG12 1.0 0.0 3.72 3712 1999 A 48 ILE H A 61 ILE HG13 1.0 0.0 3.72 3713 2000 A 48 ILE HB A 59 ASP HB2 1.0 0.0 4.00 3714 2000 A 48 ILE HB A 59 ASP HB3 1.0 0.0 4.00 3715 2001 A 48 ILE HG21 A 59 ASP HB2 1.0 0.0 5.07 3716 2001 A 48 ILE HG21 A 59 ASP HB3 1.0 0.0 5.07 3717 2002 A 48 ILE HG13 A 59 ASP HB2 1.0 0.0 4.76 3718 2002 A 48 ILE HG12 A 59 ASP HB2 1.0 0.0 4.76 3719 2002 A 59 ASP HB3 A 48 ILE HG12 1.0 0.0 4.76 3720 2002 A 59 ASP HB3 A 48 ILE HG13 1.0 0.0 4.76 3721 2003 A 49 GLN H A 49 GLN HG2 1.0 0.0 3.38 3722 2003 A 49 GLN HG3 A 49 GLN H 1.0 0.0 3.38 3723 2004 A 49 GLN HE22 A 49 GLN HG2 1.0 0.0 3.56 3724 2004 A 49 GLN HG3 A 49 GLN HE22 1.0 0.0 3.56 3725 2005 A 50 LEU H A 49 GLN HG2 1.0 0.0 5.34 3726 2005 A 49 GLN HG3 A 50 LEU H 1.0 0.0 5.34 3727 2006 A 50 LEU H A 50 LEU HB2 1.0 0.0 3.16 3728 2006 A 50 LEU H A 50 LEU HB3 1.0 0.0 3.16 3729 2007 A 50 LEU H A 50 LEU HD11 1.0 0.0 4.31 3730 2007 A 50 LEU H A 50 LEU HD21 1.0 0.0 4.31 3731 2008 A 50 LEU H A 57 VAL HG11 1.0 0.0 4.52 3732 2008 A 50 LEU H A 57 VAL HG21 1.0 0.0 4.52 3733 2009 A 51 HIS H A 50 LEU HB2 1.0 0.0 4.16 3734 2009 A 51 HIS H A 50 LEU HB3 1.0 0.0 4.16 3735 2010 A 50 LEU HB3 A 57 VAL HG11 1.0 0.0 4.23 3736 2010 A 50 LEU HB2 A 57 VAL HG11 1.0 0.0 4.23 3737 2010 A 57 VAL HG21 A 50 LEU HB2 1.0 0.0 4.23 3738 2010 A 57 VAL HG21 A 50 LEU HB3 1.0 0.0 4.23 3739 2011 A 51 HIS H A 50 LEU HD11 1.0 0.0 4.42 3740 2011 A 50 LEU HD21 A 51 HIS H 1.0 0.0 4.42 3741 2012 A 101 PHE HD% A 50 LEU HD11 1.0 0.0 5.86 3742 2012 A 101 PHE HD% A 50 LEU HD21 1.0 0.0 5.86 3743 2013 A 101 PHE HE% A 50 LEU HD11 1.0 0.0 4.88 3744 2013 A 101 PHE HE% A 50 LEU HD21 1.0 0.0 4.88 3745 2014 A 51 HIS H A 51 HIS HB2 1.0 0.0 3.48 3746 2014 A 51 HIS HB3 A 51 HIS H 1.0 0.0 3.48 3747 2015 A 52 GLU H A 57 VAL HG11 1.0 0.0 4.44 3748 2015 A 57 VAL HG21 A 52 GLU H 1.0 0.0 4.44 3749 2016 A 52 GLU HB2 A 57 VAL HG11 1.0 0.0 3.62 3750 2016 A 52 GLU HB3 A 57 VAL HG11 1.0 0.0 3.62 3751 2016 A 57 VAL HG21 A 52 GLU HB2 1.0 0.0 3.62 3752 2016 A 57 VAL HG21 A 52 GLU HB3 1.0 0.0 3.62 3753 2017 A 52 GLU HG3 A 57 VAL HG11 1.0 0.0 4.21 3754 2017 A 52 GLU HG2 A 57 VAL HG11 1.0 0.0 4.21 3755 2017 A 57 VAL HG21 A 52 GLU HG2 1.0 0.0 4.21 3756 2017 A 57 VAL HG21 A 52 GLU HG3 1.0 0.0 4.21 3757 2018 A 54 GLU H A 54 GLU HB2 1.0 0.0 3.39 3758 2018 A 54 GLU H A 54 GLU HB3 1.0 0.0 3.39 3759 2019 A 54 GLU H A 57 VAL HG11 1.0 0.0 5.94 3760 2019 A 57 VAL HG21 A 54 GLU H 1.0 0.0 5.94 3761 2020 A 54 GLU HA A 54 GLU HG2 1.0 0.0 3.65 3762 2020 A 54 GLU HA A 54 GLU HG3 1.0 0.0 3.65 3763 2021 A 55 GLN H A 54 GLU HB2 1.0 0.0 4.38 3764 2021 A 55 GLN H A 54 GLU HB3 1.0 0.0 4.38 3765 2022 A 55 GLN H A 54 GLU HG2 1.0 0.0 3.67 3766 2022 A 55 GLN H A 54 GLU HG3 1.0 0.0 3.67 3767 2023 A 55 GLN H A 55 GLN HB2 1.0 0.0 3.55 3768 2023 A 55 GLN H A 55 GLN HB3 1.0 0.0 3.55 3769 2024 A 55 GLN H A 57 VAL HG11 1.0 0.0 5.24 3770 2024 A 57 VAL HG21 A 55 GLN H 1.0 0.0 5.24 3771 2025 A 55 GLN HB3 A 55 GLN HE21 1.0 0.0 3.52 3772 2025 A 55 GLN HB2 A 55 GLN HE21 1.0 0.0 3.52 3773 2025 A 55 GLN HE22 A 55 GLN HB2 1.0 0.0 3.52 3774 2025 A 55 GLN HB3 A 55 GLN HE22 1.0 0.0 3.52 3775 2026 A 55 GLN HB3 A 57 VAL HG11 1.0 0.0 4.96 3776 2026 A 55 GLN HB2 A 57 VAL HG11 1.0 0.0 4.96 3777 2026 A 57 VAL HG21 A 55 GLN HB2 1.0 0.0 4.96 3778 2026 A 57 VAL HG21 A 55 GLN HB3 1.0 0.0 4.96 3779 2027 A 55 GLN HE21 A 55 GLN HG2 1.0 0.0 3.09 3780 2027 A 55 GLN HE22 A 55 GLN HG2 1.0 0.0 3.09 3781 2027 A 55 GLN HG3 A 55 GLN HE21 1.0 0.0 3.09 3782 2027 A 55 GLN HG3 A 55 GLN HE22 1.0 0.0 3.09 3783 2028 A 55 GLN HG3 A 57 VAL HG11 1.0 0.0 5.46 3784 2028 A 57 VAL HG21 A 55 GLN HG2 1.0 0.0 5.46 3785 2028 A 57 VAL HG21 A 55 GLN HG3 1.0 0.0 5.46 3786 2028 A 55 GLN HG2 A 57 VAL HG11 1.0 0.0 5.46 3787 2029 A 55 GLN HE21 A 57 VAL HG11 1.0 0.0 5.05 3788 2029 A 55 GLN HE22 A 57 VAL HG11 1.0 0.0 5.05 3789 2029 A 57 VAL HG21 A 55 GLN HE21 1.0 0.0 5.05 3790 2029 A 57 VAL HG21 A 55 GLN HE22 1.0 0.0 5.05 3791 2030 A 56 HIS HD2 A 56 HIS HB2 1.0 0.0 3.33 3792 2030 A 56 HIS HB3 A 56 HIS HD2 1.0 0.0 3.33 3793 2031 A 57 VAL H A 57 VAL HG11 1.0 0.0 3.87 3794 2031 A 57 VAL HG21 A 57 VAL H 1.0 0.0 3.87 3795 2032 A 58 GLN H A 57 VAL HG11 1.0 0.0 3.86 3796 2032 A 57 VAL HG21 A 58 GLN H 1.0 0.0 3.86 3797 2033 A 59 ASP H A 57 VAL HG11 1.0 0.0 5.11 3798 2033 A 57 VAL HG21 A 59 ASP H 1.0 0.0 5.11 3799 2034 A 58 GLN H A 58 GLN HG2 1.0 0.0 4.27 3800 2034 A 58 GLN H A 58 GLN HG3 1.0 0.0 4.27 3801 2035 A 58 GLN HE21 A 58 GLN HA 1.0 0.0 5.34 3802 2035 A 58 GLN HA A 58 GLN HE22 1.0 0.0 5.34 3803 2036 A 58 GLN HE22 A 58 GLN HB2 1.0 0.0 3.80 3804 2036 A 58 GLN HE21 A 58 GLN HB3 1.0 0.0 3.80 3805 2036 A 58 GLN HB3 A 58 GLN HE22 1.0 0.0 3.80 3806 2036 A 58 GLN HE21 A 58 GLN HB2 1.0 0.0 3.80 3807 2037 A 58 GLN HE22 A 58 GLN HG2 1.0 0.0 3.13 3808 2037 A 58 GLN HE21 A 58 GLN HG3 1.0 0.0 3.13 3809 2037 A 58 GLN HG3 A 58 GLN HE22 1.0 0.0 3.13 3810 2037 A 58 GLN HE21 A 58 GLN HG2 1.0 0.0 3.13 3811 2038 A 59 ASP H A 58 GLN HG2 1.0 0.0 3.81 3812 2038 A 59 ASP H A 58 GLN HG3 1.0 0.0 3.81 3813 2039 A 58 GLN HE21 A 60 ILE HD11 1.0 0.0 5.12 3814 2039 A 60 ILE HD11 A 58 GLN HE22 1.0 0.0 5.12 3815 2040 A 59 ASP H A 59 ASP HB2 1.0 0.0 3.68 3816 2040 A 59 ASP HB3 A 59 ASP H 1.0 0.0 3.68 3817 2041 A 60 ILE H A 59 ASP HB2 1.0 0.0 3.84 3818 2041 A 59 ASP HB3 A 60 ILE H 1.0 0.0 3.84 3819 2042 A 60 ILE H A 60 ILE HG12 1.0 0.0 3.73 3820 2042 A 60 ILE HG13 A 60 ILE H 1.0 0.0 3.73 3821 2043 A 60 ILE HG21 A 60 ILE HG12 1.0 0.0 3.36 3822 2043 A 60 ILE HG21 A 60 ILE HG13 1.0 0.0 3.36 3823 2044 A 61 ILE H A 61 ILE HG12 1.0 0.0 3.59 3824 2044 A 61 ILE H A 61 ILE HG13 1.0 0.0 3.59 3825 2045 A 64 ASN HD22 A 62 PRO HB2 1.0 0.0 3.98 3826 2045 A 62 PRO HB3 A 64 ASN HD22 1.0 0.0 3.98 3827 2045 A 62 PRO HB3 A 64 ASN HD21 1.0 0.0 3.98 3828 2045 A 64 ASN HD21 A 62 PRO HB2 1.0 0.0 3.98 3829 2046 A 64 ASN HD22 A 62 PRO HB2 1.0 0.0 4.98 3830 2046 A 62 PRO HB3 A 64 ASN HD22 1.0 0.0 4.98 3831 2046 A 64 ASN HD21 A 62 PRO HB2 1.0 0.0 4.98 3832 2046 A 62 PRO HB3 A 64 ASN HD21 1.0 0.0 4.98 3833 2047 A 62 PRO HG3 A 64 ASN HD22 1.0 0.0 4.50 3834 2047 A 64 ASN HD21 A 62 PRO HG2 1.0 0.0 4.50 3835 2047 A 64 ASN HD22 A 62 PRO HG2 1.0 0.0 4.50 3836 2047 A 62 PRO HG3 A 64 ASN HD21 1.0 0.0 4.50 3837 2048 A 62 PRO HG3 A 64 ASN HD22 1.0 0.0 4.27 3838 2048 A 64 ASN HD21 A 62 PRO HG2 1.0 0.0 4.27 3839 2048 A 64 ASN HD22 A 62 PRO HG2 1.0 0.0 4.27 3840 2048 A 62 PRO HG3 A 64 ASN HD21 1.0 0.0 4.27 3841 2049 A 63 ILE HA A 120 GLN HE21 1.0 0.0 5.04 3842 2049 A 63 ILE HA A 120 GLN HE22 1.0 0.0 5.04 3843 2050 A 63 ILE HG21 A 67 PHE HB2 1.0 0.0 5.02 3844 2050 A 63 ILE HG21 A 67 PHE HB3 1.0 0.0 5.02 3845 2051 A 63 ILE HG21 A 120 GLN HE21 1.0 0.0 4.26 3846 2051 A 63 ILE HG21 A 120 GLN HE22 1.0 0.0 4.26 3847 2052 A 63 ILE HG21 A 123 GLN HG2 1.0 0.0 4.78 3848 2052 A 123 GLN HG3 A 63 ILE HG21 1.0 0.0 4.78 3849 2053 A 63 ILE HG21 A 123 GLN HE21 1.0 0.0 4.15 3850 2053 A 63 ILE HG21 A 123 GLN HE22 1.0 0.0 4.15 3851 2054 A 64 ASN H A 67 PHE HB2 1.0 0.0 3.26 3852 2054 A 64 ASN H A 67 PHE HB3 1.0 0.0 3.26 3853 2055 A 64 ASN H A 120 GLN HE21 1.0 0.0 4.12 3854 2055 A 64 ASN H A 120 GLN HE22 1.0 0.0 4.12 3855 2056 A 64 ASN HD21 A 64 ASN HA 1.0 0.0 4.43 3856 2056 A 64 ASN HD22 A 64 ASN HA 1.0 0.0 4.43 3857 2057 A 67 PHE H A 64 ASN HB2 1.0 0.0 4.52 3858 2057 A 64 ASN HB3 A 67 PHE H 1.0 0.0 4.52 3859 2058 A 66 HIS H A 66 HIS HB2 1.0 0.0 3.34 3860 2058 A 66 HIS H A 66 HIS HB3 1.0 0.0 3.34 3861 2059 A 67 PHE H A 66 HIS HB2 1.0 0.0 3.77 3862 2059 A 67 PHE H A 66 HIS HB3 1.0 0.0 3.77 3863 2060 A 67 PHE H A 91 VAL HG11 1.0 0.0 5.94 3864 2060 A 91 VAL HG21 A 67 PHE H 1.0 0.0 5.94 3865 2061 A 120 GLN HE21 A 67 PHE H 1.0 0.0 4.92 3866 2061 A 120 GLN HE22 A 67 PHE H 1.0 0.0 4.92 3867 2062 A 68 ARG H A 67 PHE HB2 1.0 0.0 3.93 3868 2062 A 67 PHE HB3 A 68 ARG H 1.0 0.0 3.93 3869 2063 A 67 PHE HB3 A 120 GLN HE22 1.0 0.0 4.47 3870 2063 A 67 PHE HB3 A 120 GLN HE21 1.0 0.0 4.47 3871 2063 A 120 GLN HE21 A 67 PHE HB2 1.0 0.0 4.47 3872 2063 A 120 GLN HE22 A 67 PHE HB2 1.0 0.0 4.47 3873 2064 A 67 PHE HD% A 69 CYS HB2 1.0 0.0 4.66 3874 2064 A 69 CYS HB3 A 67 PHE HD% 1.0 0.0 4.66 3875 2065 A 67 PHE HD% A 120 GLN HE21 1.0 0.0 3.79 3876 2065 A 67 PHE HD% A 120 GLN HE22 1.0 0.0 3.79 3877 2066 A 67 PHE HE% A 69 CYS HB2 1.0 0.0 3.65 3878 2066 A 67 PHE HE% A 69 CYS HB3 1.0 0.0 3.65 3879 2067 A 67 PHE HE% A 91 VAL HG11 1.0 0.0 3.96 3880 2067 A 67 PHE HE% A 91 VAL HG21 1.0 0.0 3.96 3881 2068 A 67 PHE HZ A 69 CYS HB2 1.0 0.0 3.91 3882 2068 A 67 PHE HZ A 69 CYS HB3 1.0 0.0 3.91 3883 2069 A 67 PHE HZ A 91 VAL HG11 1.0 0.0 4.95 3884 2069 A 67 PHE HZ A 91 VAL HG21 1.0 0.0 4.95 3885 2070 A 68 ARG H A 91 VAL HG11 1.0 0.0 4.45 3886 2070 A 91 VAL HG21 A 68 ARG H 1.0 0.0 4.45 3887 2071 A 68 ARG HB2 A 68 ARG HD2 1.0 0.0 3.54 3888 2071 A 68 ARG HB3 A 68 ARG HD2 1.0 0.0 3.54 3889 2071 A 68 ARG HD3 A 68 ARG HB2 1.0 0.0 3.54 3890 2071 A 68 ARG HB3 A 68 ARG HD3 1.0 0.0 3.54 3891 2072 A 68 ARG HB3 A 70 VAL HG11 1.0 0.0 3.88 3892 2072 A 68 ARG HB2 A 70 VAL HG11 1.0 0.0 3.88 3893 2072 A 70 VAL HG21 A 68 ARG HB2 1.0 0.0 3.88 3894 2072 A 68 ARG HB3 A 70 VAL HG21 1.0 0.0 3.88 3895 2073 A 69 CYS H A 68 ARG HD2 1.0 0.0 4.68 3896 2073 A 68 ARG HD3 A 69 CYS H 1.0 0.0 4.68 3897 2074 A 68 ARG HD2 A 70 VAL HG11 1.0 0.0 4.09 3898 2074 A 68 ARG HD3 A 70 VAL HG11 1.0 0.0 4.09 3899 2074 A 70 VAL HG21 A 68 ARG HD2 1.0 0.0 4.09 3900 2074 A 68 ARG HD3 A 70 VAL HG21 1.0 0.0 4.09 3901 2075 A 69 CYS H A 69 CYS HB2 1.0 0.0 3.54 3902 2075 A 69 CYS HB3 A 69 CYS H 1.0 0.0 3.54 3903 2076 A 69 CYS H A 70 VAL HG11 1.0 0.0 4.79 3904 2076 A 70 VAL HG21 A 69 CYS H 1.0 0.0 4.79 3905 2077 A 69 CYS H A 91 VAL HG11 1.0 0.0 4.94 3906 2077 A 91 VAL HG21 A 69 CYS H 1.0 0.0 4.94 3907 2078 A 69 CYS HB2 A 70 VAL HG11 1.0 0.0 5.78 3908 2078 A 69 CYS HB3 A 70 VAL HG11 1.0 0.0 5.78 3909 2078 A 70 VAL HG21 A 69 CYS HB2 1.0 0.0 5.78 3910 2078 A 69 CYS HB3 A 70 VAL HG21 1.0 0.0 5.78 3911 2079 A 69 CYS HB2 A 91 VAL HG11 1.0 0.0 4.09 3912 2079 A 69 CYS HB3 A 91 VAL HG11 1.0 0.0 4.09 3913 2079 A 91 VAL HG21 A 69 CYS HB2 1.0 0.0 4.09 3914 2079 A 69 CYS HB3 A 91 VAL HG21 1.0 0.0 4.09 3915 2080 A 69 CYS HB2 A 91 VAL HG11 1.0 0.0 6.25 3916 2080 A 69 CYS HB3 A 91 VAL HG11 1.0 0.0 6.25 3917 2080 A 91 VAL HG21 A 69 CYS HB2 1.0 0.0 6.25 3918 2080 A 69 CYS HB3 A 91 VAL HG21 1.0 0.0 6.25 3919 2081 A 69 CYS HB2 A 116 VAL HG11 1.0 0.0 3.80 3920 2081 A 69 CYS HB3 A 116 VAL HG11 1.0 0.0 3.80 3921 2081 A 116 VAL HG21 A 69 CYS HB2 1.0 0.0 3.80 3922 2081 A 116 VAL HG21 A 69 CYS HB3 1.0 0.0 3.80 3923 2082 A 70 VAL H A 70 VAL HG11 1.0 0.0 3.48 3924 2082 A 70 VAL HG21 A 70 VAL H 1.0 0.0 3.48 3925 2083 A 70 VAL H A 91 VAL HG11 1.0 0.0 4.18 3926 2083 A 91 VAL HG21 A 70 VAL H 1.0 0.0 4.18 3927 2084 A 71 GLN H A 70 VAL HG11 1.0 0.0 4.10 3928 2084 A 70 VAL HG21 A 71 GLN H 1.0 0.0 4.10 3929 2085 A 72 GLU H A 70 VAL HG11 1.0 0.0 5.23 3930 2085 A 72 GLU H A 70 VAL HG21 1.0 0.0 5.23 3931 2086 A 90 ARG H A 70 VAL HG11 1.0 0.0 5.01 3932 2086 A 70 VAL HG21 A 90 ARG H 1.0 0.0 5.01 3933 2087 A 70 VAL HG21 A 90 ARG HG2 1.0 0.0 4.10 3934 2087 A 70 VAL HG11 A 90 ARG HG2 1.0 0.0 4.10 3935 2087 A 90 ARG HG3 A 70 VAL HG11 1.0 0.0 4.10 3936 2087 A 70 VAL HG21 A 90 ARG HG3 1.0 0.0 4.10 3937 2088 A 70 VAL HG11 A 90 ARG HD2 1.0 0.0 4.78 3938 2088 A 70 VAL HG21 A 90 ARG HD2 1.0 0.0 4.78 3939 2088 A 90 ARG HD3 A 70 VAL HG11 1.0 0.0 4.78 3940 2088 A 70 VAL HG21 A 90 ARG HD3 1.0 0.0 4.78 3941 2089 A 71 GLN H A 71 GLN HB2 1.0 0.0 3.10 3942 2089 A 71 GLN HB3 A 71 GLN H 1.0 0.0 3.10 3943 2090 A 71 GLN HE22 A 71 GLN HB2 1.0 0.0 4.06 3944 2090 A 71 GLN HE21 A 71 GLN HB2 1.0 0.0 4.06 3945 2090 A 71 GLN HB3 A 71 GLN HE22 1.0 0.0 4.06 3946 2090 A 71 GLN HB3 A 71 GLN HE21 1.0 0.0 4.06 3947 2091 A 89 ILE HG21 A 71 GLN HB2 1.0 0.0 5.22 3948 2091 A 89 ILE HG21 A 71 GLN HB3 1.0 0.0 5.22 3949 2092 A 71 GLN HB3 A 113 LEU HD11 1.0 0.0 4.23 3950 2092 A 71 GLN HB2 A 113 LEU HD11 1.0 0.0 4.23 3951 2092 A 113 LEU HD21 A 71 GLN HB2 1.0 0.0 4.23 3952 2092 A 113 LEU HD21 A 71 GLN HB3 1.0 0.0 4.23 3953 2093 A 71 GLN HG3 A 71 GLN HE21 1.0 0.0 3.21 3954 2093 A 71 GLN HE22 A 71 GLN HG2 1.0 0.0 3.21 3955 2093 A 71 GLN HG3 A 71 GLN HE22 1.0 0.0 3.21 3956 2093 A 71 GLN HE21 A 71 GLN HG2 1.0 0.0 3.21 3957 2094 A 84 ASN HD21 A 71 GLN HG2 1.0 0.0 5.11 3958 2094 A 71 GLN HG3 A 84 ASN HD22 1.0 0.0 5.11 3959 2094 A 84 ASN HD22 A 71 GLN HG2 1.0 0.0 5.11 3960 2094 A 71 GLN HG3 A 84 ASN HD21 1.0 0.0 5.11 3961 2095 A 71 GLN HG3 A 113 LEU HD11 1.0 0.0 4.24 3962 2095 A 71 GLN HG2 A 113 LEU HD11 1.0 0.0 4.24 3963 2095 A 113 LEU HD21 A 71 GLN HG2 1.0 0.0 4.24 3964 2095 A 113 LEU HD21 A 71 GLN HG3 1.0 0.0 4.24 3965 2096 A 71 GLN HE22 A 87 CYS HB2 1.0 0.0 4.55 3966 2096 A 87 CYS HB3 A 71 GLN HE21 1.0 0.0 4.55 3967 2096 A 87 CYS HB3 A 71 GLN HE22 1.0 0.0 4.55 3968 2096 A 71 GLN HE21 A 87 CYS HB2 1.0 0.0 4.55 3969 2097 A 88 LYS H A 71 GLN HE21 1.0 0.0 4.47 3970 2097 A 88 LYS H A 71 GLN HE22 1.0 0.0 4.47 3971 2098 A 113 LEU HG A 71 GLN HE21 1.0 0.0 5.34 3972 2098 A 113 LEU HG A 71 GLN HE22 1.0 0.0 5.34 3973 2099 A 113 LEU HD21 A 71 GLN HE21 1.0 0.0 4.14 3974 2099 A 71 GLN HE21 A 113 LEU HD11 1.0 0.0 4.14 3975 2099 A 113 LEU HD21 A 71 GLN HE22 1.0 0.0 4.14 3976 2099 A 71 GLN HE22 A 113 LEU HD11 1.0 0.0 4.14 3977 2100 A 73 ALA H A 72 GLU HB2 1.0 0.0 3.90 3978 2100 A 73 ALA H A 72 GLU HB3 1.0 0.0 3.90 3979 2101 A 73 ALA HB1 A 72 GLU HB2 1.0 0.0 5.84 3980 2101 A 73 ALA HB1 A 72 GLU HB3 1.0 0.0 5.84 3981 2102 A 73 ALA HB1 A 74 GLU HB2 1.0 0.0 5.84 3982 2102 A 73 ALA HB1 A 74 GLU HB3 1.0 0.0 5.84 3983 2103 A 74 GLU H A 74 GLU HB2 1.0 0.0 3.17 3984 2103 A 74 GLU H A 74 GLU HB3 1.0 0.0 3.17 3985 2104 A 75 GLU H A 74 GLU HB2 1.0 0.0 3.82 3986 2104 A 75 GLU H A 74 GLU HB3 1.0 0.0 3.82 3987 2105 A 76 THR H A 75 GLU HB2 1.0 0.0 4.13 3988 2105 A 75 GLU HB3 A 76 THR H 1.0 0.0 4.13 3989 2106 A 75 GLU HG2 A 77 LEU HD11 1.0 0.0 5.49 3990 2106 A 75 GLU HG3 A 77 LEU HD11 1.0 0.0 5.49 3991 2106 A 77 LEU HD21 A 75 GLU HG2 1.0 0.0 5.49 3992 2106 A 75 GLU HG3 A 77 LEU HD21 1.0 0.0 5.49 3993 2107 A 76 THR H A 77 LEU HD11 1.0 0.0 5.31 3994 2107 A 76 THR H A 77 LEU HD21 1.0 0.0 5.31 3995 2108 A 76 THR HB A 77 LEU HD11 1.0 0.0 5.86 3996 2108 A 77 LEU HD21 A 76 THR HB 1.0 0.0 5.86 3997 2109 A 76 THR HG21 A 77 LEU HD11 1.0 0.0 4.57 3998 2109 A 76 THR HG21 A 77 LEU HD21 1.0 0.0 4.57 3999 2110 A 77 LEU H A 77 LEU HB2 1.0 0.0 2.91 4000 2110 A 77 LEU H A 77 LEU HB3 1.0 0.0 2.91 4001 2111 A 77 LEU H A 77 LEU HD11 1.0 0.0 3.91 4002 2111 A 77 LEU H A 77 LEU HD21 1.0 0.0 3.91 4003 2112 A 78 LEU H A 78 LEU HB2 1.0 0.0 3.53 4004 2112 A 78 LEU H A 78 LEU HB3 1.0 0.0 3.53 4005 2113 A 79 ILE H A 78 LEU HB2 1.0 0.0 3.14 4006 2113 A 79 ILE H A 78 LEU HB3 1.0 0.0 3.14 4007 2114 A 78 LEU HB2 A 79 ILE HG12 1.0 0.0 3.00 4008 2114 A 78 LEU HB3 A 79 ILE HG12 1.0 0.0 3.00 4009 2114 A 79 ILE HG13 A 78 LEU HB2 1.0 0.0 3.00 4010 2114 A 78 LEU HB3 A 79 ILE HG13 1.0 0.0 3.00 4011 2115 A 79 ILE H A 78 LEU HD11 1.0 0.0 5.09 4012 2115 A 79 ILE H A 78 LEU HD21 1.0 0.0 5.09 4013 2116 A 79 ILE H A 79 ILE HG12 1.0 0.0 3.34 4014 2116 A 79 ILE H A 79 ILE HG13 1.0 0.0 3.34 4015 2117 A 79 ILE HG21 A 79 ILE HG12 1.0 0.0 3.64 4016 2117 A 79 ILE HG21 A 79 ILE HG13 1.0 0.0 3.64 4017 2118 A 79 ILE HG21 A 80 ASP HB2 1.0 0.0 5.03 4018 2118 A 79 ILE HG21 A 80 ASP HB3 1.0 0.0 5.03 4019 2119 A 80 ASP H A 80 ASP HB2 1.0 0.0 3.06 4020 2119 A 80 ASP H A 80 ASP HB3 1.0 0.0 3.06 4021 2120 A 80 ASP H A 81 ILE HG12 1.0 0.0 4.86 4022 2120 A 80 ASP H A 81 ILE HG13 1.0 0.0 4.86 4023 2121 A 81 ILE H A 80 ASP HB2 1.0 0.0 3.52 4024 2121 A 81 ILE H A 80 ASP HB3 1.0 0.0 3.52 4025 2122 A 81 ILE HD11 A 80 ASP HB2 1.0 0.0 5.25 4026 2122 A 81 ILE HD11 A 80 ASP HB3 1.0 0.0 5.25 4027 2123 A 82 ALA H A 80 ASP HB2 1.0 0.0 4.83 4028 2123 A 82 ALA H A 80 ASP HB3 1.0 0.0 4.83 4029 2124 A 81 ILE H A 81 ILE HG12 1.0 0.0 3.07 4030 2124 A 81 ILE H A 81 ILE HG13 1.0 0.0 3.07 4031 2125 A 82 ALA H A 81 ILE HG12 1.0 0.0 4.46 4032 2125 A 82 ALA H A 81 ILE HG13 1.0 0.0 4.46 4033 2126 A 81 ILE HD11 A 84 ASN HD21 1.0 0.0 5.84 4034 2126 A 81 ILE HD11 A 84 ASN HD22 1.0 0.0 5.84 4035 2127 A 83 SER H A 84 ASN HB2 1.0 0.0 5.12 4036 2127 A 84 ASN HB3 A 83 SER H 1.0 0.0 5.12 4037 2128 A 84 ASN H A 84 ASN HB2 1.0 0.0 3.31 4038 2128 A 84 ASN H A 84 ASN HB3 1.0 0.0 3.31 4039 2129 A 84 ASN HD22 A 84 ASN HB2 1.0 0.0 3.07 4040 2129 A 84 ASN HD21 A 84 ASN HB2 1.0 0.0 3.07 4041 2129 A 84 ASN HD22 A 84 ASN HB3 1.0 0.0 3.07 4042 2129 A 84 ASN HD21 A 84 ASN HB3 1.0 0.0 3.07 4043 2130 A 85 SER H A 84 ASN HB2 1.0 0.0 3.84 4044 2130 A 84 ASN HB3 A 85 SER H 1.0 0.0 3.84 4045 2131 A 86 GLY H A 84 ASN HB2 1.0 0.0 5.09 4046 2131 A 86 GLY H A 84 ASN HB3 1.0 0.0 5.09 4047 2132 A 84 ASN HB3 A 113 LEU HD11 1.0 0.0 5.35 4048 2132 A 84 ASN HB2 A 113 LEU HD11 1.0 0.0 5.35 4049 2132 A 113 LEU HD21 A 84 ASN HB2 1.0 0.0 5.35 4050 2132 A 113 LEU HD21 A 84 ASN HB3 1.0 0.0 5.35 4051 2133 A 84 ASN HD21 A 113 LEU HD11 1.0 0.0 5.09 4052 2133 A 113 LEU HD21 A 84 ASN HD21 1.0 0.0 5.09 4053 2133 A 113 LEU HD21 A 84 ASN HD22 1.0 0.0 5.09 4054 2133 A 84 ASN HD22 A 113 LEU HD11 1.0 0.0 5.09 4055 2134 A 85 SER H A 85 SER HB2 1.0 0.0 3.39 4056 2134 A 85 SER H A 85 SER HB3 1.0 0.0 3.39 4057 2135 A 86 GLY H A 85 SER HB2 1.0 0.0 4.18 4058 2135 A 86 GLY H A 85 SER HB3 1.0 0.0 4.18 4059 2136 A 86 GLY H A 109 CYS HB2 1.0 0.0 4.28 4060 2136 A 109 CYS HB3 A 86 GLY H 1.0 0.0 4.28 4061 2137 A 87 CYS H A 102 GLU HG2 1.0 0.0 5.15 4062 2137 A 102 GLU HG3 A 87 CYS H 1.0 0.0 5.15 4063 2138 A 87 CYS HB3 A 113 LEU HD11 1.0 0.0 5.76 4064 2138 A 87 CYS HB2 A 113 LEU HD11 1.0 0.0 5.76 4065 2138 A 113 LEU HD21 A 87 CYS HB2 1.0 0.0 5.76 4066 2138 A 113 LEU HD21 A 87 CYS HB3 1.0 0.0 5.76 4067 2139 A 87 CYS HB3 A 113 LEU HD11 1.0 0.0 5.71 4068 2139 A 87 CYS HB2 A 113 LEU HD11 1.0 0.0 5.71 4069 2139 A 113 LEU HD21 A 87 CYS HB2 1.0 0.0 5.71 4070 2139 A 113 LEU HD21 A 87 CYS HB3 1.0 0.0 5.71 4071 2140 A 88 LYS H A 88 LYS HG2 1.0 0.0 3.68 4072 2140 A 88 LYS H A 88 LYS HG3 1.0 0.0 3.68 4073 2141 A 88 LYS HB3 A 88 LYS HE2 1.0 0.0 4.51 4074 2141 A 88 LYS HB2 A 88 LYS HE2 1.0 0.0 4.51 4075 2141 A 88 LYS HE3 A 88 LYS HB2 1.0 0.0 4.51 4076 2141 A 88 LYS HB3 A 88 LYS HE3 1.0 0.0 4.51 4077 2142 A 88 LYS HE2 A 88 LYS HG2 1.0 0.0 3.32 4078 2142 A 88 LYS HE3 A 88 LYS HG2 1.0 0.0 3.32 4079 2142 A 88 LYS HG3 A 88 LYS HE2 1.0 0.0 3.32 4080 2142 A 88 LYS HG3 A 88 LYS HE3 1.0 0.0 3.32 4081 2143 A 89 ILE H A 88 LYS HG2 1.0 0.0 4.47 4082 2143 A 89 ILE H A 88 LYS HG3 1.0 0.0 4.47 4083 2144 A 89 ILE H A 102 GLU HG2 1.0 0.0 5.34 4084 2144 A 102 GLU HG3 A 89 ILE H 1.0 0.0 5.34 4085 2145 A 89 ILE HB A 91 VAL HG11 1.0 0.0 4.38 4086 2145 A 91 VAL HG21 A 89 ILE HB 1.0 0.0 4.38 4087 2146 A 89 ILE HG21 A 89 ILE HG12 1.0 0.0 3.76 4088 2146 A 89 ILE HG13 A 89 ILE HG21 1.0 0.0 3.76 4089 2147 A 101 PHE HD% A 89 ILE HG12 1.0 0.0 3.75 4090 2147 A 89 ILE HG13 A 101 PHE HD% 1.0 0.0 3.75 4091 2148 A 102 GLU H A 89 ILE HG12 1.0 0.0 5.34 4092 2148 A 102 GLU H A 89 ILE HG13 1.0 0.0 5.34 4093 2149 A 112 PHE HE% A 89 ILE HG12 1.0 0.0 4.71 4094 2149 A 112 PHE HE% A 89 ILE HG13 1.0 0.0 4.71 4095 2150 A 112 PHE HZ A 89 ILE HG12 1.0 0.0 4.12 4096 2150 A 89 ILE HG13 A 112 PHE HZ 1.0 0.0 4.12 4097 2151 A 89 ILE HD11 A 91 VAL HG11 1.0 0.0 3.98 4098 2151 A 91 VAL HG21 A 89 ILE HD11 1.0 0.0 3.98 4099 2152 A 90 ARG H A 91 VAL HG11 1.0 0.0 4.75 4100 2152 A 91 VAL HG21 A 90 ARG H 1.0 0.0 4.75 4101 2153 A 91 VAL H A 91 VAL HG11 1.0 0.0 3.96 4102 2153 A 91 VAL HG21 A 91 VAL H 1.0 0.0 3.96 4103 2154 A 92 GLN H A 91 VAL HG11 1.0 0.0 3.67 4104 2154 A 91 VAL HG21 A 92 GLN H 1.0 0.0 3.67 4105 2155 A 99 ARG H A 91 VAL HG11 1.0 0.0 5.93 4106 2155 A 91 VAL HG21 A 99 ARG H 1.0 0.0 5.93 4107 2156 A 91 VAL HG11 A 99 ARG HB2 1.0 0.0 5.78 4108 2156 A 91 VAL HG21 A 99 ARG HB2 1.0 0.0 5.78 4109 2156 A 99 ARG HB3 A 91 VAL HG11 1.0 0.0 5.78 4110 2156 A 91 VAL HG21 A 99 ARG HB3 1.0 0.0 5.78 4111 2157 A 101 PHE H A 91 VAL HG11 1.0 0.0 5.02 4112 2157 A 91 VAL HG21 A 101 PHE H 1.0 0.0 5.02 4113 2158 A 101 PHE HD% A 91 VAL HG11 1.0 0.0 4.83 4114 2158 A 91 VAL HG21 A 101 PHE HD% 1.0 0.0 4.83 4115 2159 A 92 GLN H A 92 GLN HB2 1.0 0.0 3.63 4116 2159 A 92 GLN HB3 A 92 GLN H 1.0 0.0 3.63 4117 2160 A 93 GLY H A 92 GLN HB2 1.0 0.0 4.00 4118 2160 A 93 GLY H A 92 GLN HB3 1.0 0.0 4.00 4119 2161 A 93 GLY H A 92 GLN HG2 1.0 0.0 4.07 4120 2161 A 93 GLY H A 92 GLN HG3 1.0 0.0 4.07 4121 2162 A 93 GLY H A 96 ILE HG12 1.0 0.0 4.14 4122 2162 A 93 GLY H A 96 ILE HG1y 1.0 0.0 4.14 4123 2163 A 94 ASP H A 94 ASP HB2 1.0 0.0 3.64 4124 2163 A 94 ASP H A 94 ASP HB3 1.0 0.0 3.64 4125 2164 A 95 TRP H A 95 TRP HB2 1.0 0.0 3.57 4126 2164 A 95 TRP H A 95 TRP HB3 1.0 0.0 3.57 4127 2165 A 95 TRP H A 96 ILE HG12 1.0 0.0 5.09 4128 2165 A 95 TRP H A 96 ILE HG1y 1.0 0.0 5.09 4129 2166 A 96 ILE H A 96 ILE HG12 1.0 0.0 4.03 4130 2166 A 96 ILE H A 96 ILE HG1y 1.0 0.0 4.03 4131 2167 A 96 ILE HD11 A 99 ARG HB2 1.0 0.0 4.84 4132 2167 A 96 ILE HD11 A 99 ARG HB3 1.0 0.0 4.84 4133 2168 A 96 ILE HD11 A 99 ARG HD2 1.0 0.0 5.84 4134 2168 A 96 ILE HD11 A 99 ARG HD3 1.0 0.0 5.84 4135 2169 A 98 GLU H A 97 ARG HB2 1.0 0.0 3.58 4136 2169 A 97 ARG HB3 A 98 GLU H 1.0 0.0 3.58 4137 2170 A 99 ARG H A 98 GLU HG2 1.0 0.0 3.73 4138 2170 A 99 ARG H A 98 GLU HG3 1.0 0.0 3.73 4139 2171 A 99 ARG H A 99 ARG HB2 1.0 0.0 3.65 4140 2171 A 99 ARG H A 99 ARG HB3 1.0 0.0 3.65 4141 2172 A 99 ARG H A 99 ARG HD2 1.0 0.0 4.68 4142 2172 A 99 ARG H A 99 ARG HD3 1.0 0.0 4.68 4143 2173 A 100 ARG H A 99 ARG HB2 1.0 0.0 3.58 4144 2173 A 100 ARG H A 99 ARG HB3 1.0 0.0 3.58 4145 2174 A 100 ARG H A 100 ARG HB2 1.0 0.0 3.16 4146 2174 A 100 ARG HB3 A 100 ARG H 1.0 0.0 3.16 4147 2175 A 100 ARG HB3 A 100 ARG HG2 1.0 0.0 2.62 4148 2175 A 100 ARG HB2 A 100 ARG HG2 1.0 0.0 2.62 4149 2175 A 100 ARG HG3 A 100 ARG HB2 1.0 0.0 2.62 4150 2175 A 100 ARG HB3 A 100 ARG HG3 1.0 0.0 2.62 4151 2176 A 100 ARG HB3 A 100 ARG HD2 1.0 0.0 3.53 4152 2176 A 100 ARG HB2 A 100 ARG HD2 1.0 0.0 3.53 4153 2176 A 100 ARG HD3 A 100 ARG HB2 1.0 0.0 3.53 4154 2176 A 100 ARG HD3 A 100 ARG HB3 1.0 0.0 3.53 4155 2177 A 100 ARG HE A 100 ARG HB2 1.0 0.0 4.48 4156 2177 A 100 ARG HB3 A 100 ARG HE 1.0 0.0 4.48 4157 2178 A 101 PHE H A 100 ARG HB2 1.0 0.0 3.55 4158 2178 A 100 ARG HB3 A 101 PHE H 1.0 0.0 3.55 4159 2179 A 102 GLU H A 102 GLU HG2 1.0 0.0 4.21 4160 2179 A 102 GLU H A 102 GLU HG3 1.0 0.0 4.21 4161 2180 A 103 ILE H A 102 GLU HG2 1.0 0.0 3.28 4162 2180 A 102 GLU HG3 A 103 ILE H 1.0 0.0 3.28 4163 2181 A 103 ILE H A 104 PRO HD2 1.0 0.0 4.12 4164 2181 A 104 PRO HD3 A 103 ILE H 1.0 0.0 4.12 4165 2182 A 103 ILE H A 109 CYS HB2 1.0 0.0 5.32 4166 2182 A 109 CYS HB3 A 103 ILE H 1.0 0.0 5.32 4167 2183 A 103 ILE HB A 109 CYS HB2 1.0 0.0 4.02 4168 2183 A 103 ILE HB A 109 CYS HB3 1.0 0.0 4.02 4169 2184 A 103 ILE HG21 A 104 PRO HD2 1.0 0.0 4.56 4170 2184 A 103 ILE HG21 A 104 PRO HD3 1.0 0.0 4.56 4171 2185 A 103 ILE HG21 A 109 CYS HB2 1.0 0.0 3.91 4172 2185 A 109 CYS HB3 A 103 ILE HG21 1.0 0.0 3.91 4173 2186 A 105 ASP H A 104 PRO HB2 1.0 0.0 3.76 4174 2186 A 104 PRO HB3 A 105 ASP H 1.0 0.0 3.76 4175 2187 A 105 ASP H A 104 PRO HG2 1.0 0.0 3.57 4176 2187 A 105 ASP H A 104 PRO HG3 1.0 0.0 3.57 4177 2188 A 105 ASP H A 104 PRO HD2 1.0 0.0 3.73 4178 2188 A 105 ASP H A 104 PRO HD3 1.0 0.0 3.73 4179 2189 A 105 ASP H A 109 CYS HB2 1.0 0.0 4.29 4180 2189 A 109 CYS HB3 A 105 ASP H 1.0 0.0 4.29 4181 2190 A 105 ASP HB2 A 107 GLU HG2 1.0 0.0 4.88 4182 2190 A 105 ASP HB3 A 107 GLU HG2 1.0 0.0 4.88 4183 2190 A 107 GLU HG3 A 105 ASP HB2 1.0 0.0 4.88 4184 2190 A 107 GLU HG3 A 105 ASP HB3 1.0 0.0 4.88 4185 2191 A 105 ASP HB2 A 107 GLU HG2 1.0 0.0 4.49 4186 2191 A 105 ASP HB3 A 107 GLU HG2 1.0 0.0 4.49 4187 2191 A 107 GLU HG3 A 105 ASP HB2 1.0 0.0 4.49 4188 2191 A 107 GLU HG3 A 105 ASP HB3 1.0 0.0 4.49 4189 2192 A 106 GLU H A 109 CYS HB2 1.0 0.0 5.34 4190 2192 A 109 CYS HB3 A 106 GLU H 1.0 0.0 5.34 4191 2193 A 106 GLU HA A 109 CYS HB2 1.0 0.0 3.78 4192 2193 A 109 CYS HB3 A 106 GLU HA 1.0 0.0 3.78 4193 2194 A 107 GLU H A 107 GLU HG2 1.0 0.0 3.13 4194 2194 A 107 GLU H A 107 GLU HG3 1.0 0.0 3.13 4195 2195 A 107 GLU HA A 107 GLU HG2 1.0 0.0 3.67 4196 2195 A 107 GLU HA A 107 GLU HG3 1.0 0.0 3.67 4197 2196 A 108 HIS H A 107 GLU HB2 1.0 0.0 4.03 4198 2196 A 107 GLU HB3 A 108 HIS H 1.0 0.0 4.03 4199 2197 A 108 HIS HD2 A 107 GLU HB2 1.0 0.0 4.48 4200 2197 A 107 GLU HB3 A 108 HIS HD2 1.0 0.0 4.48 4201 2198 A 107 GLU HB2 A 110 LEU HD11 1.0 0.0 4.95 4202 2198 A 107 GLU HB3 A 110 LEU HD11 1.0 0.0 4.95 4203 2198 A 110 LEU HD21 A 107 GLU HB2 1.0 0.0 4.95 4204 2198 A 110 LEU HD21 A 107 GLU HB3 1.0 0.0 4.95 4205 2199 A 108 HIS H A 107 GLU HG2 1.0 0.0 3.02 4206 2199 A 107 GLU HG3 A 108 HIS H 1.0 0.0 3.02 4207 2200 A 108 HIS HD2 A 107 GLU HG2 1.0 0.0 3.90 4208 2200 A 107 GLU HG3 A 108 HIS HD2 1.0 0.0 3.90 4209 2201 A 109 CYS H A 107 GLU HG2 1.0 0.0 4.44 4210 2201 A 107 GLU HG3 A 109 CYS H 1.0 0.0 4.44 4211 2202 A 108 HIS H A 109 CYS HB2 1.0 0.0 5.23 4212 2202 A 109 CYS HB3 A 108 HIS H 1.0 0.0 5.23 4213 2203 A 109 CYS H A 109 CYS HB2 1.0 0.0 3.11 4214 2203 A 109 CYS HB3 A 109 CYS H 1.0 0.0 3.11 4215 2204 A 110 LEU H A 109 CYS HB2 1.0 0.0 3.59 4216 2204 A 110 LEU H A 109 CYS HB3 1.0 0.0 3.59 4217 2205 A 110 LEU H A 110 LEU HB2 1.0 0.0 3.19 4218 2205 A 110 LEU H A 110 LEU HB3 1.0 0.0 3.19 4219 2206 A 110 LEU HA A 113 LEU HD11 1.0 0.0 4.29 4220 2206 A 113 LEU HD21 A 110 LEU HA 1.0 0.0 4.29 4221 2207 A 110 LEU HB2 A 110 LEU HD11 1.0 0.0 3.11 4222 2207 A 110 LEU HB3 A 110 LEU HD11 1.0 0.0 3.11 4223 2207 A 110 LEU HD21 A 110 LEU HB2 1.0 0.0 3.11 4224 2207 A 110 LEU HD21 A 110 LEU HB3 1.0 0.0 3.11 4225 2208 A 111 LYS H A 110 LEU HB2 1.0 0.0 3.64 4226 2208 A 111 LYS H A 110 LEU HB3 1.0 0.0 3.64 4227 2209 A 111 LYS H A 111 LYS HG2 1.0 0.0 3.22 4228 2209 A 111 LYS HG3 A 111 LYS H 1.0 0.0 3.22 4229 2210 A 111 LYS HA A 111 LYS HG2 1.0 0.0 3.51 4230 2210 A 111 LYS HA A 111 LYS HG3 1.0 0.0 3.51 4231 2211 A 111 LYS HE3 A 111 LYS HG2 1.0 0.0 3.35 4232 2211 A 111 LYS HE2 A 111 LYS HG2 1.0 0.0 3.35 4233 2211 A 111 LYS HG3 A 111 LYS HE2 1.0 0.0 3.35 4234 2211 A 111 LYS HG3 A 111 LYS HE3 1.0 0.0 3.35 4235 2212 A 112 PHE HD% A 113 LEU HD11 1.0 0.0 4.74 4236 2212 A 112 PHE HD% A 113 LEU HD21 1.0 0.0 4.74 4237 2213 A 112 PHE HE% A 113 LEU HD11 1.0 0.0 3.93 4238 2213 A 112 PHE HE% A 113 LEU HD21 1.0 0.0 3.93 4239 2214 A 112 PHE HZ A 113 LEU HD11 1.0 0.0 4.17 4240 2214 A 113 LEU HD21 A 112 PHE HZ 1.0 0.0 4.17 4241 2215 A 113 LEU H A 113 LEU HD11 1.0 0.0 4.25 4242 2215 A 113 LEU HD21 A 113 LEU H 1.0 0.0 4.25 4243 2216 A 113 LEU HA A 113 LEU HD11 1.0 0.0 3.61 4244 2216 A 113 LEU HA A 113 LEU HD21 1.0 0.0 3.61 4245 2217 A 114 SER H A 113 LEU HD11 1.0 0.0 4.93 4246 2217 A 113 LEU HD21 A 114 SER H 1.0 0.0 4.93 4247 2218 A 115 ALA H A 114 SER HB2 1.0 0.0 3.18 4248 2218 A 114 SER HB3 A 115 ALA H 1.0 0.0 3.18 4249 2219 A 117 LEU H A 117 LEU HD11 1.0 0.0 4.70 4250 2219 A 117 LEU HD21 A 117 LEU H 1.0 0.0 4.70 4251 2220 A 117 LEU HA A 117 LEU HD11 1.0 0.0 3.94 4252 2220 A 117 LEU HA A 117 LEU HD21 1.0 0.0 3.94 4253 2221 A 118 ALA H A 117 LEU HD11 1.0 0.0 3.57 4254 2221 A 118 ALA H A 117 LEU HD21 1.0 0.0 3.57 4255 2222 A 118 ALA HA A 117 LEU HD11 1.0 0.0 4.90 4256 2222 A 118 ALA HA A 117 LEU HD21 1.0 0.0 4.90 4257 2223 A 118 ALA HB1 A 117 LEU HD11 1.0 0.0 4.30 4258 2223 A 118 ALA HB1 A 117 LEU HD21 1.0 0.0 4.30 4259 2224 A 119 ALA H A 117 LEU HD11 1.0 0.0 5.93 4260 2224 A 117 LEU HD21 A 119 ALA H 1.0 0.0 5.93 4261 2225 A 121 LYS H A 117 LEU HD11 1.0 0.0 4.95 4262 2225 A 121 LYS H A 117 LEU HD21 1.0 0.0 4.95 4263 2226 A 117 LEU HD21 A 121 LYS HD2 1.0 0.0 4.70 4264 2226 A 117 LEU HD11 A 121 LYS HD2 1.0 0.0 4.70 4265 2226 A 121 LYS HD3 A 117 LEU HD11 1.0 0.0 4.70 4266 2226 A 121 LYS HD3 A 117 LEU HD21 1.0 0.0 4.70 4267 2227 A 117 LEU HD11 A 121 LYS HE2 1.0 0.0 4.39 4268 2227 A 117 LEU HD21 A 121 LYS HE2 1.0 0.0 4.39 4269 2227 A 121 LYS HE3 A 117 LEU HD11 1.0 0.0 4.39 4270 2227 A 121 LYS HE3 A 117 LEU HD21 1.0 0.0 4.39 4271 2228 A 119 ALA HB1 A 123 GLN HE21 1.0 0.0 5.84 4272 2228 A 119 ALA HB1 A 123 GLN HE22 1.0 0.0 5.84 4273 2229 A 120 GLN HA A 123 GLN HG2 1.0 0.0 3.89 4274 2229 A 120 GLN HA A 123 GLN HG3 1.0 0.0 3.89 4275 2230 A 120 GLN HB3 A 120 GLN HE21 1.0 0.0 4.03 4276 2230 A 120 GLN HB3 A 120 GLN HE22 1.0 0.0 4.03 4277 2230 A 120 GLN HE21 A 120 GLN HB2 1.0 0.0 4.03 4278 2230 A 120 GLN HE22 A 120 GLN HB2 1.0 0.0 4.03 4279 2231 A 120 GLN HB3 A 120 GLN HE21 1.0 0.0 3.68 4280 2231 A 120 GLN HB3 A 120 GLN HE22 1.0 0.0 3.68 4281 2231 A 120 GLN HE21 A 120 GLN HB2 1.0 0.0 3.68 4282 2231 A 120 GLN HE22 A 120 GLN HB2 1.0 0.0 3.68 4283 2232 A 121 LYS H A 121 LYS HG2 1.0 0.0 4.06 4284 2232 A 121 LYS H A 121 LYS HG3 1.0 0.0 4.06 4285 2233 A 121 LYS H A 123 GLN HG2 1.0 0.0 5.34 4286 2233 A 121 LYS H A 123 GLN HG3 1.0 0.0 5.34 4287 2234 A 121 LYS HA A 121 LYS HG2 1.0 0.0 3.52 4288 2234 A 121 LYS HA A 121 LYS HG3 1.0 0.0 3.52 4289 2235 A 121 LYS HE3 A 121 LYS HG2 1.0 0.0 3.45 4290 2235 A 121 LYS HG3 A 121 LYS HE2 1.0 0.0 3.45 4291 2235 A 121 LYS HG3 A 121 LYS HE3 1.0 0.0 3.45 4292 2235 A 121 LYS HE2 A 121 LYS HG2 1.0 0.0 3.45 4293 2236 A 122 ALA H A 121 LYS HG2 1.0 0.0 4.07 4294 2236 A 121 LYS HG3 A 122 ALA H 1.0 0.0 4.07 4295 2237 A 122 ALA H A 123 GLN HB2 1.0 0.0 4.97 4296 2237 A 122 ALA H A 123 GLN HB3 1.0 0.0 4.97 4297 2238 A 122 ALA H A 123 GLN HG2 1.0 0.0 4.71 4298 2238 A 123 GLN HG3 A 122 ALA H 1.0 0.0 4.71 4299 2239 A 123 GLN H A 123 GLN HB2 1.0 0.0 2.92 4300 2239 A 123 GLN H A 123 GLN HB3 1.0 0.0 2.92 4301 2240 A 123 GLN H A 123 GLN HG2 1.0 0.0 3.12 4302 2240 A 123 GLN HG3 A 123 GLN H 1.0 0.0 3.12 4303 2241 A 123 GLN HB3 A 123 GLN HE21 1.0 0.0 4.27 4304 2241 A 123 GLN HB3 A 123 GLN HE22 1.0 0.0 4.27 4305 2241 A 123 GLN HE22 A 123 GLN HB2 1.0 0.0 4.27 4306 2241 A 123 GLN HE21 A 123 GLN HB2 1.0 0.0 4.27 4307 2242 A 124 SER H A 123 GLN HG2 1.0 0.0 4.29 4308 2242 A 123 GLN HG3 A 124 SER H 1.0 0.0 4.29 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin undefined _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 87 CYS SG A 109 CYS SG 1.0 0.0 2.1 2 2 A 87 CYS SG A 109 CYS CB 1.0 0.0 3.1 3 3 A 109 CYS SG A 87 CYS CB 1.0 0.0 3.1 stop_ save_ save_CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 6 MET C A 7 GLU N A 7 GLU CA A 7 GLU C 1.0 -139.6 -42.4 PHI 2 2 A 7 GLU N A 7 GLU CA A 7 GLU C A 8 PRO N 1.0 75.8 192.4 PSI 3 3 A 9 PRO C A 10 LEU N A 10 LEU CA A 10 LEU C 1.0 -113.6 -54.0 PHI 4 4 A 10 LEU N A 10 LEU CA A 10 LEU C A 11 PRO N 1.0 88.5 191.7 PSI 5 5 A 13 GLY C A 14 ALA N A 14 ALA CA A 14 ALA C 1.0 -128.8 -40.8 PHI 6 6 A 14 ALA N A 14 ALA CA A 14 ALA C A 15 GLN N 1.0 74.5 169.9 PSI 7 7 A 14 ALA C A 15 GLN N A 15 GLN CA A 15 GLN C 1.0 -143.3 -50.5 PHI 8 8 A 15 GLN N A 15 GLN CA A 15 GLN C A 16 PRO N 1.0 81.9 190.7 PSI 9 9 A 17 LEU C A 18 ALA N A 18 ALA CA A 18 ALA C 1.0 -191.1 -103.9 PHI 10 10 A 18 ALA N A 18 ALA CA A 18 ALA C A 19 THR N 1.0 118.7 158.3 PSI 11 11 A 18 ALA C A 19 THR N A 19 THR CA A 19 THR C 1.0 -161.5 -88.7 PHI 12 12 A 19 THR N A 19 THR CA A 19 THR C A 20 VAL N 1.0 107.5 167.9 PSI 13 13 A 19 THR C A 20 VAL N A 20 VAL CA A 20 VAL C 1.0 -160.5 -105.9 PHI 14 14 A 20 VAL N A 20 VAL CA A 20 VAL C A 21 GLU N 1.0 127.0 173.0 PSI 15 15 A 20 VAL C A 21 GLU N A 21 GLU CA A 21 GLU C 1.0 -151.0 -90.8 PHI 16 16 A 21 GLU N A 21 GLU CA A 21 GLU C A 22 GLY N 1.0 123.3 181.7 PSI 17 17 A 22 GLY C A 23 MET N A 23 MET CA A 23 MET C 1.0 -163.6 -77.2 PHI 18 18 A 23 MET N A 23 MET CA A 23 MET C A 24 GLU N 1.0 94.1 184.3 PSI 19 19 A 23 MET C A 24 GLU N A 24 GLU CA A 24 GLU C 1.0 -126.2 -53.2 PHI 20 20 A 24 GLU N A 24 GLU CA A 24 GLU C A 25 MET N 1.0 102.5 152.9 PSI 21 21 A 25 MET C A 26 LYS N A 26 LYS CA A 26 LYS C 1.0 -151.0 -72.2 PHI 22 22 A 26 LYS N A 26 LYS CA A 26 LYS C A 27 GLY N 1.0 65.8 161.2 PSI 23 23 A 29 LEU C A 30 ARG N A 30 ARG CA A 30 ARG C 1.0 -151.4 -79.0 PHI 24 24 A 30 ARG N A 30 ARG CA A 30 ARG C A 31 GLU N 1.0 94.2 168.4 PSI 25 25 A 30 ARG C A 31 GLU N A 31 GLU CA A 31 GLU C 1.0 -176.3 -75.9 PHI 26 26 A 31 GLU N A 31 GLU CA A 31 GLU C A 32 PRO N 1.0 99.0 174.4 PSI 27 27 A 32 PRO C A 33 CYS N A 33 CYS CA A 33 CYS C 1.0 -163.6 -110.4 PHI 28 28 A 33 CYS N A 33 CYS CA A 33 CYS C A 34 ALA N 1.0 136.4 190.0 PSI 29 29 A 33 CYS C A 34 ALA N A 34 ALA CA A 34 ALA C 1.0 -156.7 -96.9 PHI 30 30 A 34 ALA N A 34 ALA CA A 34 ALA C A 35 LEU N 1.0 105.1 164.3 PSI 31 31 A 34 ALA C A 35 LEU N A 35 LEU CA A 35 LEU C 1.0 -153.4 -89.8 PHI 32 32 A 35 LEU N A 35 LEU CA A 35 LEU C A 36 THR N 1.0 109.8 153.0 PSI 33 33 A 35 LEU C A 36 THR N A 36 THR CA A 36 THR C 1.0 -143.1 -97.3 PHI 34 34 A 36 THR N A 36 THR CA A 36 THR C A 37 LEU N 1.0 106.0 140.4 PSI 35 35 A 36 THR C A 37 LEU N A 37 LEU CA A 37 LEU C 1.0 -144.8 -77.2 PHI 36 36 A 37 LEU N A 37 LEU CA A 37 LEU C A 38 ALA N 1.0 103.5 140.9 PSI 37 37 A 37 LEU C A 38 ALA N A 38 ALA CA A 38 ALA C 1.0 -148.1 -93.9 PHI 38 38 A 38 ALA N A 38 ALA CA A 38 ALA C A 39 GLN N 1.0 125.7 166.1 PSI 39 39 A 38 ALA C A 39 GLN N A 39 GLN CA A 39 GLN C 1.0 -145.2 -91.4 PHI 40 40 A 39 GLN N A 39 GLN CA A 39 GLN C A 40 ARG N 1.0 107.3 151.1 PSI 41 41 A 39 GLN C A 40 ARG N A 40 ARG CA A 40 ARG C 1.0 -167.9 -57.3 PHI 42 42 A 40 ARG N A 40 ARG CA A 40 ARG C A 41 ASN N 1.0 105.3 144.9 PSI 43 43 A 42 GLY C A 43 GLN N A 43 GLN CA A 43 GLN C 1.0 -144.2 -78.4 PHI 44 44 A 43 GLN N A 43 GLN CA A 43 GLN C A 44 TYR N 1.0 121.7 166.5 PSI 45 45 A 43 GLN C A 44 TYR N A 44 TYR CA A 44 TYR C 1.0 -144.7 -66.9 PHI 46 46 A 44 TYR N A 44 TYR CA A 44 TYR C A 45 GLU N 1.0 110.3 158.1 PSI 47 47 A 44 TYR C A 45 GLU N A 45 GLU CA A 45 GLU C 1.0 -172.8 -106.8 PHI 48 48 A 45 GLU N A 45 GLU CA A 45 GLU C A 46 LEU N 1.0 139.6 172.2 PSI 49 49 A 45 GLU C A 46 LEU N A 46 LEU CA A 46 LEU C 1.0 -156.9 -104.7 PHI 50 50 A 46 LEU N A 46 LEU CA A 46 LEU C A 47 ILE N 1.0 114.6 156.4 PSI 51 51 A 46 LEU C A 47 ILE N A 47 ILE CA A 47 ILE C 1.0 -134.2 -96.6 PHI 52 52 A 47 ILE N A 47 ILE CA A 47 ILE C A 48 ILE N 1.0 108.8 143.2 PSI 53 53 A 47 ILE C A 48 ILE N A 48 ILE CA A 48 ILE C 1.0 -126.8 -95.2 PHI 54 54 A 48 ILE N A 48 ILE CA A 48 ILE C A 49 GLN N 1.0 107.5 135.5 PSI 55 55 A 48 ILE C A 49 GLN N A 49 GLN CA A 49 GLN C 1.0 -130.5 -81.5 PHI 56 56 A 49 GLN N A 49 GLN CA A 49 GLN C A 50 LEU N 1.0 112.8 132.8 PSI 57 57 A 49 GLN C A 50 LEU N A 50 LEU CA A 50 LEU C 1.0 -119.9 -79.1 PHI 58 58 A 50 LEU N A 50 LEU CA A 50 LEU C A 51 HIS N 1.0 91.8 154.8 PSI 59 59 A 57 VAL C A 58 GLN N A 58 GLN CA A 58 GLN C 1.0 -158.4 -58.4 PHI 60 60 A 58 GLN N A 58 GLN CA A 58 GLN C A 59 ASP N 1.0 108.7 147.9 PSI 61 61 A 58 GLN C A 59 ASP N A 59 ASP CA A 59 ASP C 1.0 -139.1 -72.9 PHI 62 62 A 59 ASP N A 59 ASP CA A 59 ASP C A 60 ILE N 1.0 105.6 160.8 PSI 63 63 A 59 ASP C A 60 ILE N A 60 ILE CA A 60 ILE C 1.0 -138.1 -93.5 PHI 64 64 A 60 ILE N A 60 ILE CA A 60 ILE C A 61 ILE N 1.0 98.5 144.5 PSI 65 65 A 60 ILE C A 61 ILE N A 61 ILE CA A 61 ILE C 1.0 -149.1 -93.5 PHI 66 66 A 61 ILE N A 61 ILE CA A 61 ILE C A 62 PRO N 1.0 73.5 178.1 PSI 67 67 A 62 PRO C A 63 ILE N A 63 ILE CA A 63 ILE C 1.0 -120.5 -44.1 PHI 68 68 A 63 ILE N A 63 ILE CA A 63 ILE C A 64 ASN N 1.0 105.3 154.1 PSI 69 69 A 66 HIS C A 67 PHE N A 67 PHE CA A 67 PHE C 1.0 -144.9 -47.5 PHI 70 70 A 67 PHE N A 67 PHE CA A 67 PHE C A 68 ARG N 1.0 106.6 155.8 PSI 71 71 A 67 PHE C A 68 ARG N A 68 ARG CA A 68 ARG C 1.0 -161.3 -81.5 PHI 72 72 A 68 ARG N A 68 ARG CA A 68 ARG C A 69 CYS N 1.0 108.7 155.3 PSI 73 73 A 68 ARG C A 69 CYS N A 69 CYS CA A 69 CYS C 1.0 -143.0 -62.8 PHI 74 74 A 69 CYS N A 69 CYS CA A 69 CYS C A 70 VAL N 1.0 100.3 148.9 PSI 75 75 A 69 CYS C A 70 VAL N A 70 VAL CA A 70 VAL C 1.0 -145.4 -103.0 PHI 76 76 A 70 VAL N A 70 VAL CA A 70 VAL C A 71 GLN N 1.0 111.8 161.6 PSI 77 77 A 70 VAL C A 71 GLN N A 71 GLN CA A 71 GLN C 1.0 -111.7 -68.3 PHI 78 78 A 71 GLN N A 71 GLN CA A 71 GLN C A 72 GLU N 1.0 96.5 153.3 PSI 79 79 A 76 THR C A 77 LEU N A 77 LEU CA A 77 LEU C 1.0 -108.3 -40.9 PHI 80 80 A 77 LEU N A 77 LEU CA A 77 LEU C A 78 LEU N 1.0 -73.4 22.2 PSI 81 81 A 86 GLY C A 87 CYS N A 87 CYS CA A 87 CYS C 1.0 -162.2 -93.6 PHI 82 82 A 87 CYS N A 87 CYS CA A 87 CYS C A 88 LYS N 1.0 126.3 185.7 PSI 83 83 A 87 CYS C A 88 LYS N A 88 LYS CA A 88 LYS C 1.0 -153.2 -82.8 PHI 84 84 A 88 LYS N A 88 LYS CA A 88 LYS C A 89 ILE N 1.0 106.3 162.1 PSI 85 85 A 88 LYS C A 89 ILE N A 89 ILE CA A 89 ILE C 1.0 -141.4 -117.8 PHI 86 86 A 89 ILE N A 89 ILE CA A 89 ILE C A 90 ARG N 1.0 121.9 182.1 PSI 87 87 A 89 ILE C A 90 ARG N A 90 ARG CA A 90 ARG C 1.0 -157.2 -97.0 PHI 88 88 A 90 ARG N A 90 ARG CA A 90 ARG C A 91 VAL N 1.0 112.7 151.1 PSI 89 89 A 90 ARG C A 91 VAL N A 91 VAL CA A 91 VAL C 1.0 -160.0 -85.0 PHI 90 90 A 91 VAL N A 91 VAL CA A 91 VAL C A 92 GLN N 1.0 112.3 171.5 PSI 91 91 A 91 VAL C A 92 GLN N A 92 GLN CA A 92 GLN C 1.0 -164.3 -78.3 PHI 92 92 A 92 GLN N A 92 GLN CA A 92 GLN C A 93 GLY N 1.0 136.0 186.2 PSI 93 93 A 95 TRP C A 96 ILE N A 96 ILE CA A 96 ILE C 1.0 -180.6 -69.4 PHI 94 94 A 96 ILE N A 96 ILE CA A 96 ILE C A 97 ARG N 1.0 134.1 191.7 PSI 95 95 A 98 GLU C A 99 ARG N A 99 ARG CA A 99 ARG C 1.0 -155.0 -103.6 PHI 96 96 A 99 ARG N A 99 ARG CA A 99 ARG C A 100 ARG N 1.0 123.1 165.9 PSI 97 97 A 99 ARG C A 100 ARG N A 100 ARG CA A 100 ARG C 1.0 -150.2 -80.0 PHI 98 98 A 100 ARG N A 100 ARG CA A 100 ARG C A 101 PHE N 1.0 126.3 159.5 PSI 99 99 A 100 ARG C A 101 PHE N A 101 PHE CA A 101 PHE C 1.0 -157.9 -103.5 PHI 100 100 A 101 PHE N A 101 PHE CA A 101 PHE C A 102 GLU N 1.0 114.8 167.6 PSI 101 101 A 101 PHE C A 102 GLU N A 102 GLU CA A 102 GLU C 1.0 -157.6 -93.4 PHI 102 102 A 102 GLU N A 102 GLU CA A 102 GLU C A 103 ILE N 1.0 108.5 152.3 PSI 103 103 A 102 GLU C A 103 ILE N A 103 ILE CA A 103 ILE C 1.0 -153.0 -74.8 PHI 104 104 A 103 ILE N A 103 ILE CA A 103 ILE C A 104 PRO N 1.0 73.5 181.1 PSI 105 105 A 105 ASP C A 106 GLU N A 106 GLU CA A 106 GLU C 1.0 -65.4 -45.4 PHI 106 106 A 106 GLU N A 106 GLU CA A 106 GLU C A 107 GLU N 1.0 -64.0 -21.6 PSI 107 107 A 106 GLU C A 107 GLU N A 107 GLU CA A 107 GLU C 1.0 -74.5 -47.7 PHI 108 108 A 107 GLU N A 107 GLU CA A 107 GLU C A 108 HIS N 1.0 -54.2 -27.6 PSI 109 109 A 107 GLU C A 108 HIS N A 108 HIS CA A 108 HIS C 1.0 -78.3 -58.3 PHI 110 110 A 108 HIS N A 108 HIS CA A 108 HIS C A 109 CYS N 1.0 -51.3 -22.5 PSI 111 111 A 108 HIS C A 109 CYS N A 109 CYS CA A 109 CYS C 1.0 -103.5 -39.5 PHI 112 112 A 109 CYS N A 109 CYS CA A 109 CYS C A 110 LEU N 1.0 -56.8 -28.2 PSI 113 113 A 109 CYS C A 110 LEU N A 110 LEU CA A 110 LEU C 1.0 -79.5 -50.1 PHI 114 114 A 110 LEU N A 110 LEU CA A 110 LEU C A 111 LYS N 1.0 -57.2 -23.0 PSI 115 115 A 110 LEU C A 111 LYS N A 111 LYS CA A 111 LYS C 1.0 -74.1 -54.1 PHI 116 116 A 111 LYS N A 111 LYS CA A 111 LYS C A 112 PHE N 1.0 -50.0 -29.6 PSI 117 117 A 111 LYS C A 112 PHE N A 112 PHE CA A 112 PHE C 1.0 -74.0 -54.0 PHI 118 118 A 112 PHE N A 112 PHE CA A 112 PHE C A 113 LEU N 1.0 -52.7 -32.7 PSI 119 119 A 112 PHE C A 113 LEU N A 113 LEU CA A 113 LEU C 1.0 -71.4 -51.4 PHI 120 120 A 113 LEU N A 113 LEU CA A 113 LEU C A 114 SER N 1.0 -56.0 -30.6 PSI 121 121 A 113 LEU C A 114 SER N A 114 SER CA A 114 SER C 1.0 -73.9 -51.9 PHI 122 122 A 114 SER N A 114 SER CA A 114 SER C A 115 ALA N 1.0 -53.6 -33.6 PSI 123 123 A 114 SER C A 115 ALA N A 115 ALA CA A 115 ALA C 1.0 -74.7 -54.7 PHI 124 124 A 115 ALA N A 115 ALA CA A 115 ALA C A 116 VAL N 1.0 -55.0 -25.2 PSI 125 125 A 115 ALA C A 116 VAL N A 116 VAL CA A 116 VAL C 1.0 -75.6 -51.2 PHI 126 126 A 116 VAL N A 116 VAL CA A 116 VAL C A 117 LEU N 1.0 -53.1 -33.1 PSI 127 127 A 116 VAL C A 117 LEU N A 117 LEU CA A 117 LEU C 1.0 -69.8 -49.8 PHI 128 128 A 117 LEU N A 117 LEU CA A 117 LEU C A 118 ALA N 1.0 -60.6 -15.0 PSI 129 129 A 117 LEU C A 118 ALA N A 118 ALA CA A 118 ALA C 1.0 -85.3 -52.5 PHI 130 130 A 118 ALA N A 118 ALA CA A 118 ALA C A 119 ALA N 1.0 -51.0 -24.8 PSI 131 131 A 118 ALA C A 119 ALA N A 119 ALA CA A 119 ALA C 1.0 -79.5 -59.5 PHI 132 132 A 119 ALA N A 119 ALA CA A 119 ALA C A 120 GLN N 1.0 -56.7 -25.3 PSI 133 133 A 119 ALA C A 120 GLN N A 120 GLN CA A 120 GLN C 1.0 -72.9 -52.9 PHI 134 134 A 120 GLN N A 120 GLN CA A 120 GLN C A 121 LYS N 1.0 -52.4 -32.4 PSI 135 135 A 120 GLN C A 121 LYS N A 121 LYS CA A 121 LYS C 1.0 -87.6 -53.0 PHI 136 136 A 121 LYS N A 121 LYS CA A 121 LYS C A 122 ALA N 1.0 -60.4 -3.4 PSI 137 137 A 121 LYS C A 122 ALA N A 122 ALA CA A 122 ALA C 1.0 -91.1 -49.5 PHI 138 138 A 122 ALA N A 122 ALA CA A 122 ALA C A 123 GLN N 1.0 -54.7 -2.5 PSI stop_ save_