data_nef_c16373_2kkv save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 GLU middle . . 3 A 3 ASN middle . . 4 A 4 SER middle . . 5 A 5 GLY middle . false 6 A 6 ALA middle . . 7 A 7 TYR middle . . 8 A 8 THR middle . . 9 A 9 PHE middle . . 10 A 10 GLU middle . . 11 A 11 THR middle . . 12 A 12 ILE middle . . 13 A 13 ALA middle . . 14 A 14 ARG middle . . 15 A 15 GLU middle . . 16 A 16 TRP middle . . 17 A 17 HIS middle . . 18 A 18 GLU middle . . 19 A 19 SER middle . . 20 A 20 ASN middle . . 21 A 21 LYS middle . . 22 A 22 ARG middle . . 23 A 23 TRP middle . . 24 A 24 SER middle . . 25 A 25 GLU middle . . 26 A 26 ASP middle . . 27 A 27 HIS middle . . 28 A 28 ARG middle . . 29 A 29 SER middle . . 30 A 30 ARG middle . . 31 A 31 VAL middle . . 32 A 32 LEU middle . . 33 A 33 ARG middle . . 34 A 34 TYR middle . . 35 A 35 LEU middle . . 36 A 36 GLU middle . . 37 A 37 LEU middle . . 38 A 38 TYR middle . . 39 A 39 ILE middle . . 40 A 40 PHE middle . . 41 A 41 PRO middle . false 42 A 42 HIS middle . . 43 A 43 ILE middle . . 44 A 44 GLY middle . false 45 A 45 SER middle . . 46 A 46 SER middle . . 47 A 47 ASP middle . . 48 A 48 ILE middle . . 49 A 49 ARG middle . . 50 A 50 GLN middle . . 51 A 51 LEU middle . . 52 A 52 LYS middle . . 53 A 53 THR middle . . 54 A 54 SER middle . . 55 A 55 HIS middle . . 56 A 56 LEU middle . . 57 A 57 LEU middle . . 58 A 58 ALA middle . . 59 A 59 PRO middle . false 60 A 60 ILE middle . . 61 A 61 LYS middle . . 62 A 62 GLU middle . . 63 A 63 VAL middle . . 64 A 64 ASP middle . . 65 A 65 THR middle . . 66 A 66 SER middle . . 67 A 67 GLY middle . false 68 A 68 LYS middle . . 69 A 69 HIS middle . . 70 A 70 ASP middle . . 71 A 71 VAL middle . . 72 A 72 ALA middle . . 73 A 73 GLN middle . . 74 A 74 ARG middle . . 75 A 75 LEU middle . . 76 A 76 GLN middle . . 77 A 77 GLN middle . . 78 A 78 ARG middle . . 79 A 79 VAL middle . . 80 A 80 THR middle . . 81 A 81 ALA middle . . 82 A 82 ILE middle . . 83 A 83 MET middle . . 84 A 84 ARG middle . . 85 A 85 TYR middle . . 86 A 86 ALA middle . . 87 A 87 VAL middle . . 88 A 88 GLN middle . . 89 A 89 ASN middle . . 90 A 90 ASP middle . . 91 A 91 TYR middle . . 92 A 92 ILE middle . . 93 A 93 ASP middle . . 94 A 94 SER middle . . 95 A 95 ASN middle . . 96 A 96 PRO middle . false 97 A 97 ALA middle . . 98 A 98 SER middle . . 99 A 99 ASP middle . . 100 A 100 MET middle . . 101 A 101 ALA middle . . 102 A 102 GLY middle . false 103 A 103 ALA middle . . 104 A 104 LEU middle . . 105 A 105 SER middle . . 106 A 106 THR middle . . 107 A 107 THR middle . . 108 A 108 LYS middle . . 109 A 109 ALA middle . . 110 A 110 ARG middle . . 111 A 111 HIS middle . . 112 A 112 TYR middle . . 113 A 113 PRO middle . false 114 A 114 LEU middle . . 115 A 115 GLU middle . . 116 A 116 HIS middle . . 117 A 117 HIS middle . . 118 A 118 HIS middle . . 119 A 119 HIS middle . . 120 A 120 HIS middle . . 121 A 121 HIS end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 MET HE% H 1 2.087 0.020 A 1 MET CE C 13 16.725 0.400 A 2 GLU HA H 1 4.399 0.020 A 2 GLU HBy H 1 2.080 0.020 A 2 GLU HBx H 1 1.964 0.020 A 2 GLU HGy H 1 2.295 0.020 A 2 GLU HGx H 1 2.294 0.020 A 2 GLU CA C 13 56.358 0.400 A 2 GLU CB C 13 30.249 0.400 A 2 GLU CG C 13 36.010 0.400 A 3 ASN H H 1 8.699 0.020 A 3 ASN HA H 1 4.753 0.020 A 3 ASN HBy H 1 2.896 0.020 A 3 ASN HBx H 1 2.803 0.020 A 3 ASN HD2y H 1 7.648 0.020 A 3 ASN HD2x H 1 6.915 0.020 A 3 ASN CA C 13 53.211 0.400 A 3 ASN CB C 13 38.733 0.400 A 3 ASN N N 15 120.234 0.400 A 3 ASN ND2 N 15 112.800 0.400 A 4 SER H H 1 8.428 0.020 A 4 SER HA H 1 4.395 0.020 A 4 SER HBy H 1 3.944 0.020 A 4 SER HBx H 1 3.888 0.020 A 4 SER CA C 13 59.048 0.400 A 4 SER CB C 13 63.485 0.400 A 4 SER N N 15 116.413 0.400 A 5 GLY H H 1 8.525 0.020 A 5 GLY HAy H 1 3.970 0.020 A 5 GLY HAx H 1 3.969 0.020 A 5 GLY CA C 13 45.717 0.400 A 5 GLY N N 15 111.196 0.400 A 6 ALA H H 1 7.941 0.020 A 6 ALA HA H 1 4.206 0.020 A 6 ALA HB% H 1 1.283 0.020 A 6 ALA CA C 13 52.988 0.400 A 6 ALA CB C 13 19.429 0.400 A 6 ALA N N 15 123.277 0.400 A 7 TYR H H 1 8.351 0.020 A 7 TYR HA H 1 4.509 0.020 A 7 TYR HBy H 1 3.265 0.020 A 7 TYR HBx H 1 2.774 0.020 A 7 TYR HD1 H 1 7.085 0.020 A 7 TYR HD2 H 1 7.085 0.020 A 7 TYR HE1 H 1 6.771 0.020 A 7 TYR HE2 H 1 6.771 0.020 A 7 TYR CA C 13 57.528 0.400 A 7 TYR CB C 13 39.356 0.400 A 7 TYR CD1 C 13 133.148 0.400 A 7 TYR CE1 C 13 117.810 0.400 A 7 TYR N N 15 114.900 0.400 A 8 THR H H 1 7.735 0.020 A 8 THR HA H 1 4.922 0.020 A 8 THR HB H 1 4.745 0.020 A 8 THR HG2% H 1 1.203 0.020 A 8 THR CA C 13 60.827 0.400 A 8 THR CB C 13 70.109 0.400 A 8 THR CG2 C 13 22.160 0.400 A 8 THR N N 15 110.856 0.400 A 9 PHE H H 1 8.816 0.020 A 9 PHE HA H 1 3.825 0.020 A 9 PHE HBy H 1 2.899 0.020 A 9 PHE HBx H 1 2.898 0.020 A 9 PHE HD1 H 1 7.000 0.020 A 9 PHE HD2 H 1 7.000 0.020 A 9 PHE HE1 H 1 7.236 0.020 A 9 PHE HE2 H 1 7.236 0.020 A 9 PHE HZ H 1 7.029 0.020 A 9 PHE CA C 13 62.935 0.400 A 9 PHE CB C 13 39.373 0.400 A 9 PHE CD1 C 13 131.336 0.400 A 9 PHE CE1 C 13 130.480 0.400 A 9 PHE CZ C 13 129.110 0.400 A 9 PHE N N 15 121.282 0.400 A 10 GLU H H 1 9.741 0.020 A 10 GLU HA H 1 3.295 0.020 A 10 GLU HBy H 1 1.473 0.020 A 10 GLU HBx H 1 1.329 0.020 A 10 GLU HGy H 1 1.612 0.020 A 10 GLU HGx H 1 0.699 0.020 A 10 GLU CA C 13 59.586 0.400 A 10 GLU CB C 13 28.453 0.400 A 10 GLU CG C 13 34.856 0.400 A 10 GLU N N 15 117.454 0.400 A 11 THR H H 1 7.542 0.020 A 11 THR HA H 1 3.667 0.020 A 11 THR HB H 1 3.686 0.020 A 11 THR HG2% H 1 1.179 0.020 A 11 THR CA C 13 66.550 0.400 A 11 THR CB C 13 66.557 0.400 A 11 THR CG2 C 13 22.171 0.400 A 11 THR N N 15 115.970 0.400 A 12 ILE H H 1 7.724 0.020 A 12 ILE HA H 1 3.561 0.020 A 12 ILE HB H 1 1.569 0.020 A 12 ILE HD1% H 1 0.175 0.020 A 12 ILE HG1y H 1 1.077 0.020 A 12 ILE HG1x H 1 0.882 0.020 A 12 ILE HG2% H 1 0.795 0.020 A 12 ILE CA C 13 63.395 0.400 A 12 ILE CB C 13 36.233 0.400 A 12 ILE CD1 C 13 11.758 0.400 A 12 ILE CG1 C 13 28.955 0.400 A 12 ILE CG2 C 13 17.197 0.400 A 12 ILE N N 15 122.235 0.400 A 13 ALA H H 1 9.099 0.020 A 13 ALA HA H 1 3.975 0.020 A 13 ALA HB% H 1 1.433 0.020 A 13 ALA CA C 13 55.666 0.400 A 13 ALA CB C 13 20.126 0.400 A 13 ALA N N 15 122.259 0.400 A 14 ARG H H 1 8.600 0.020 A 14 ARG HA H 1 4.097 0.020 A 14 ARG HBy H 1 1.837 0.020 A 14 ARG HBx H 1 1.834 0.020 A 14 ARG HDy H 1 3.236 0.020 A 14 ARG HDx H 1 3.233 0.020 A 14 ARG HGy H 1 1.588 0.020 A 14 ARG HGx H 1 1.584 0.020 A 14 ARG CA C 13 60.889 0.400 A 14 ARG CB C 13 29.000 0.400 A 14 ARG CD C 13 43.102 0.400 A 14 ARG CG C 13 27.310 0.400 A 14 ARG N N 15 116.993 0.400 A 15 GLU H H 1 7.924 0.020 A 15 GLU HA H 1 4.085 0.020 A 15 GLU HBy H 1 2.350 0.020 A 15 GLU HBx H 1 2.331 0.020 A 15 GLU HGy H 1 2.439 0.020 A 15 GLU HGx H 1 2.366 0.020 A 15 GLU CA C 13 59.312 0.400 A 15 GLU CB C 13 29.866 0.400 A 15 GLU CG C 13 36.221 0.400 A 15 GLU N N 15 122.758 0.400 A 16 TRP H H 1 8.864 0.020 A 16 TRP HA H 1 4.740 0.020 A 16 TRP HBy H 1 3.552 0.020 A 16 TRP HBx H 1 3.008 0.020 A 16 TRP HD1 H 1 6.884 0.020 A 16 TRP HE1 H 1 10.250 0.020 A 16 TRP HE3 H 1 6.689 0.020 A 16 TRP HH2 H 1 7.212 0.020 A 16 TRP HZ2 H 1 7.744 0.020 A 16 TRP CA C 13 60.839 0.400 A 16 TRP CB C 13 26.693 0.400 A 16 TRP CD1 C 13 126.812 0.400 A 16 TRP CH2 C 13 123.202 0.400 A 16 TRP CZ2 C 13 114.590 0.400 A 16 TRP N N 15 122.323 0.400 A 16 TRP NE1 N 15 130.097 0.400 A 17 HIS H H 1 8.803 0.020 A 17 HIS HA H 1 3.076 0.020 A 17 HIS HBy H 1 3.235 0.020 A 17 HIS HBx H 1 3.231 0.020 A 17 HIS HD2 H 1 7.080 0.020 A 17 HIS CA C 13 60.683 0.400 A 17 HIS CB C 13 30.772 0.400 A 17 HIS CD2 C 13 119.840 0.400 A 17 HIS N N 15 121.293 0.400 A 18 GLU H H 1 7.897 0.020 A 18 GLU HA H 1 3.837 0.020 A 18 GLU HBy H 1 2.156 0.020 A 18 GLU HBx H 1 2.063 0.020 A 18 GLU HGy H 1 2.368 0.020 A 18 GLU HGx H 1 2.361 0.020 A 18 GLU CA C 13 57.506 0.400 A 18 GLU CB C 13 29.421 0.400 A 18 GLU CG C 13 35.758 0.400 A 18 GLU N N 15 118.162 0.400 A 19 SER H H 1 7.461 0.020 A 19 SER HA H 1 4.150 0.020 A 19 SER HBy H 1 3.939 0.020 A 19 SER HBx H 1 3.918 0.020 A 19 SER CA C 13 60.000 0.400 A 19 SER CB C 13 63.329 0.400 A 19 SER N N 15 112.802 0.400 A 20 ASN H H 1 6.638 0.020 A 20 ASN HA H 1 4.226 0.020 A 20 ASN HBy H 1 1.197 0.020 A 20 ASN HBx H 1 0.959 0.020 A 20 ASN CA C 13 53.211 0.400 A 20 ASN CB C 13 37.021 0.400 A 20 ASN N N 15 121.098 0.400 A 21 LYS H H 1 8.010 0.020 A 21 LYS HA H 1 4.077 0.020 A 21 LYS HBy H 1 1.857 0.020 A 21 LYS HBx H 1 1.633 0.020 A 21 LYS HDy H 1 1.654 0.020 A 21 LYS HDx H 1 1.648 0.020 A 21 LYS HEy H 1 2.939 0.020 A 21 LYS HEx H 1 2.928 0.020 A 21 LYS HGy H 1 1.376 0.020 A 21 LYS HGx H 1 1.299 0.020 A 21 LYS CA C 13 56.558 0.400 A 21 LYS CB C 13 32.435 0.400 A 21 LYS CD C 13 28.780 0.400 A 21 LYS CE C 13 42.098 0.400 A 21 LYS CG C 13 24.187 0.400 A 21 LYS N N 15 122.666 0.400 A 22 ARG H H 1 8.007 0.020 A 22 ARG HA H 1 4.257 0.020 A 22 ARG HBy H 1 1.809 0.020 A 22 ARG HBx H 1 1.660 0.020 A 22 ARG HDx H 1 3.127 0.020 A 22 ARG HDy H 1 3.129 0.020 A 22 ARG HGy H 1 1.501 0.020 A 22 ARG HGx H 1 1.445 0.020 A 22 ARG CA C 13 56.480 0.400 A 22 ARG CB C 13 30.000 0.400 A 22 ARG CD C 13 43.100 0.400 A 22 ARG CG C 13 27.142 0.400 A 22 ARG N N 15 117.459 0.400 A 23 TRP H H 1 7.211 0.020 A 23 TRP HA H 1 4.938 0.020 A 23 TRP HBy H 1 3.220 0.020 A 23 TRP HBx H 1 3.180 0.020 A 23 TRP HD1 H 1 7.098 0.020 A 23 TRP HE1 H 1 10.081 0.020 A 23 TRP HE3 H 1 7.078 0.020 A 23 TRP HH2 H 1 6.704 0.020 A 23 TRP HZ2 H 1 7.359 0.020 A 23 TRP HZ3 H 1 6.637 0.020 A 23 TRP CA C 13 55.206 0.400 A 23 TRP CB C 13 30.772 0.400 A 23 TRP CD1 C 13 124.549 0.400 A 23 TRP CE3 C 13 120.380 0.400 A 23 TRP CH2 C 13 124.109 0.400 A 23 TRP CZ2 C 13 114.587 0.400 A 23 TRP CZ3 C 13 121.390 0.400 A 23 TRP N N 15 118.844 0.400 A 23 TRP NE1 N 15 129.050 0.400 A 24 SER H H 1 8.764 0.020 A 24 SER HA H 1 4.520 0.020 A 24 SER HBy H 1 4.301 0.020 A 24 SER HBx H 1 4.288 0.020 A 24 SER CA C 13 57.647 0.400 A 24 SER CB C 13 64.419 0.400 A 24 SER N N 15 117.454 0.400 A 25 GLU H H 1 8.976 0.020 A 25 GLU HA H 1 4.076 0.020 A 25 GLU HBy H 1 2.080 0.020 A 25 GLU HBx H 1 2.077 0.020 A 25 GLU HGy H 1 2.375 0.020 A 25 GLU HGx H 1 2.374 0.020 A 25 GLU CA C 13 59.360 0.400 A 25 GLU CB C 13 28.960 0.400 A 25 GLU CG C 13 35.762 0.400 A 25 GLU N N 15 122.323 0.400 A 26 ASP H H 1 8.608 0.020 A 26 ASP HA H 1 4.400 0.020 A 26 ASP HBy H 1 2.636 0.020 A 26 ASP HBx H 1 2.630 0.020 A 26 ASP CA C 13 56.327 0.400 A 26 ASP CB C 13 40.700 0.400 A 26 ASP N N 15 118.165 0.400 A 27 HIS H H 1 7.891 0.020 A 27 HIS HA H 1 4.247 0.020 A 27 HIS HBy H 1 3.077 0.020 A 27 HIS HBx H 1 3.073 0.020 A 27 HIS HD2 H 1 7.046 0.020 A 27 HIS CA C 13 58.271 0.400 A 27 HIS CB C 13 30.483 0.400 A 27 HIS CD2 C 13 119.573 0.400 A 27 HIS N N 15 120.183 0.400 A 28 ARG H H 1 8.676 0.020 A 28 ARG HA H 1 3.720 0.020 A 28 ARG HBy H 1 1.928 0.020 A 28 ARG HBx H 1 1.920 0.020 A 28 ARG HDx H 1 3.130 0.020 A 28 ARG HDy H 1 3.130 0.020 A 28 ARG HGy H 1 1.691 0.020 A 28 ARG HGx H 1 1.683 0.020 A 28 ARG CA C 13 59.444 0.400 A 28 ARG CB C 13 30.315 0.400 A 28 ARG CD C 13 43.100 0.400 A 28 ARG CG C 13 28.060 0.400 A 28 ARG N N 15 118.156 0.400 A 29 SER H H 1 8.359 0.020 A 29 SER HA H 1 4.295 0.020 A 29 SER HBy H 1 4.014 0.020 A 29 SER HBx H 1 3.966 0.020 A 29 SER CA C 13 60.916 0.400 A 29 SER CB C 13 62.629 0.400 A 29 SER N N 15 115.374 0.400 A 30 ARG H H 1 7.860 0.020 A 30 ARG HA H 1 3.850 0.020 A 30 ARG HBy H 1 1.790 0.020 A 30 ARG HBx H 1 1.780 0.020 A 30 ARG HDx H 1 3.130 0.020 A 30 ARG HDy H 1 3.130 0.020 A 30 ARG HGy H 1 1.444 0.020 A 30 ARG HGx H 1 1.296 0.020 A 30 ARG CA C 13 59.162 0.400 A 30 ARG CB C 13 30.171 0.400 A 30 ARG CD C 13 43.100 0.400 A 30 ARG CG C 13 27.310 0.400 A 30 ARG N N 15 124.066 0.400 A 31 VAL H H 1 7.928 0.020 A 31 VAL HA H 1 4.728 0.020 A 31 VAL HB H 1 1.928 0.020 A 31 VAL HGx% H 1 1.191 0.020 A 31 VAL HGy% H 1 0.674 0.020 A 31 VAL CA C 13 66.054 0.400 A 31 VAL CB C 13 31.961 0.400 A 31 VAL CG1 C 13 21.380 0.400 A 31 VAL CG2 C 13 22.610 0.400 A 31 VAL N N 15 116.760 0.400 A 32 LEU H H 1 7.314 0.020 A 32 LEU HA H 1 3.867 0.020 A 32 LEU HB2 H 1 1.688 0.020 A 32 LEU HB3 H 1 0.815 0.020 A 32 LEU HDx% H 1 0.722 0.020 A 32 LEU HDy% H 1 0.674 0.020 A 32 LEU HG H 1 1.382 0.020 A 32 LEU CA C 13 57.406 0.400 A 32 LEU CB C 13 40.912 0.400 A 32 LEU CD1 C 13 24.879 0.400 A 32 LEU CD2 C 13 22.159 0.400 A 32 LEU CG C 13 26.224 0.400 A 32 LEU N N 15 117.541 0.400 A 33 ARG H H 1 7.914 0.020 A 33 ARG HA H 1 4.070 0.020 A 33 ARG HBy H 1 1.839 0.020 A 33 ARG HBx H 1 1.811 0.020 A 33 ARG HDx H 1 3.130 0.020 A 33 ARG HDy H 1 3.130 0.020 A 33 ARG HGx H 1 1.580 0.020 A 33 ARG HGy H 1 1.580 0.020 A 33 ARG CA C 13 58.815 0.400 A 33 ARG CB C 13 29.393 0.400 A 33 ARG CD C 13 43.100 0.400 A 33 ARG CG C 13 27.310 0.400 A 33 ARG N N 15 118.510 0.400 A 34 TYR H H 1 8.211 0.020 A 34 TYR HA H 1 4.533 0.020 A 34 TYR HB2 H 1 3.366 0.020 A 34 TYR HB3 H 1 3.120 0.020 A 34 TYR HD1 H 1 7.173 0.020 A 34 TYR HD2 H 1 7.173 0.020 A 34 TYR HE1 H 1 6.921 0.020 A 34 TYR HE2 H 1 6.921 0.020 A 34 TYR CA C 13 59.593 0.400 A 34 TYR CB C 13 37.021 0.400 A 34 TYR CD1 C 13 131.344 0.400 A 34 TYR CE1 C 13 118.216 0.400 A 34 TYR N N 15 116.416 0.400 A 35 LEU H H 1 7.904 0.020 A 35 LEU HA H 1 3.670 0.020 A 35 LEU HBy H 1 1.703 0.020 A 35 LEU HBx H 1 1.699 0.020 A 35 LEU HDx% H 1 0.998 0.020 A 35 LEU HDy% H 1 0.704 0.020 A 35 LEU HG H 1 1.719 0.020 A 35 LEU CA C 13 57.967 0.400 A 35 LEU CB C 13 40.740 0.400 A 35 LEU CD1 C 13 26.231 0.400 A 35 LEU CD2 C 13 22.157 0.400 A 35 LEU CG C 13 26.711 0.400 A 35 LEU N N 15 118.885 0.400 A 36 GLU H H 1 8.662 0.020 A 36 GLU HA H 1 3.993 0.020 A 36 GLU HBy H 1 2.249 0.020 A 36 GLU HBx H 1 1.896 0.020 A 36 GLU HGy H 1 2.517 0.020 A 36 GLU HGx H 1 2.334 0.020 A 36 GLU CA C 13 59.749 0.400 A 36 GLU CB C 13 29.887 0.400 A 36 GLU CG C 13 37.106 0.400 A 36 GLU N N 15 120.936 0.400 A 37 LEU H H 1 8.195 0.020 A 37 LEU HA H 1 3.979 0.020 A 37 LEU HBy H 1 1.142 0.020 A 37 LEU HBx H 1 0.429 0.020 A 37 LEU HDx% H 1 1.259 0.020 A 37 LEU HDy% H 1 0.646 0.020 A 37 LEU HG H 1 1.540 0.020 A 37 LEU CA C 13 56.947 0.400 A 37 LEU CB C 13 42.936 0.400 A 37 LEU CD1 C 13 26.253 0.400 A 37 LEU CD2 C 13 24.425 0.400 A 37 LEU CG C 13 26.770 0.400 A 37 LEU N N 15 116.413 0.400 A 38 TYR H H 1 7.663 0.020 A 38 TYR HA H 1 4.951 0.020 A 38 TYR HBy H 1 3.048 0.020 A 38 TYR HBx H 1 2.767 0.020 A 38 TYR HD1 H 1 7.178 0.020 A 38 TYR HD2 H 1 7.178 0.020 A 38 TYR HE1 H 1 6.721 0.020 A 38 TYR HE2 H 1 6.721 0.020 A 38 TYR CA C 13 58.581 0.400 A 38 TYR CB C 13 41.068 0.400 A 38 TYR CD1 C 13 132.540 0.400 A 38 TYR CE1 C 13 117.753 0.400 A 38 TYR N N 15 110.509 0.400 A 39 ILE H H 1 7.833 0.020 A 39 ILE HA H 1 4.642 0.020 A 39 ILE HB H 1 2.271 0.020 A 39 ILE HD1% H 1 0.712 0.020 A 39 ILE HG1y H 1 1.708 0.020 A 39 ILE HG1x H 1 1.226 0.020 A 39 ILE HG2% H 1 0.895 0.020 A 39 ILE CA C 13 60.000 0.400 A 39 ILE CB C 13 37.111 0.400 A 39 ILE CD1 C 13 8.363 0.400 A 39 ILE CG1 C 13 26.693 0.400 A 39 ILE CG2 C 13 18.997 0.400 A 39 ILE N N 15 116.068 0.400 A 40 PHE H H 1 9.117 0.020 A 40 PHE HA H 1 4.634 0.020 A 40 PHE HBy H 1 3.654 0.020 A 40 PHE HBx H 1 3.495 0.020 A 40 PHE HD1 H 1 7.239 0.020 A 40 PHE HD2 H 1 7.239 0.020 A 40 PHE HE1 H 1 7.015 0.020 A 40 PHE HE2 H 1 7.015 0.020 A 40 PHE HZ H 1 7.029 0.020 A 40 PHE CA C 13 57.492 0.400 A 40 PHE CB C 13 34.374 0.400 A 40 PHE CD1 C 13 129.105 0.400 A 40 PHE CE1 C 13 129.193 0.400 A 40 PHE CZ C 13 129.109 0.400 A 40 PHE N N 15 121.241 0.400 A 41 PRO HA H 1 4.388 0.020 A 41 PRO HBy H 1 2.302 0.020 A 41 PRO HBx H 1 1.040 0.020 A 41 PRO HD2 H 1 3.982 0.020 A 41 PRO HD3 H 1 2.977 0.020 A 41 PRO HGy H 1 1.931 0.020 A 41 PRO HGx H 1 1.920 0.020 A 41 PRO CA C 13 66.132 0.400 A 41 PRO CB C 13 31.261 0.400 A 41 PRO CD C 13 51.998 0.400 A 41 PRO CG C 13 28.592 0.400 A 42 HIS H H 1 7.153 0.020 A 42 HIS HA H 1 4.678 0.020 A 42 HIS HB2 H 1 3.410 0.020 A 42 HIS HB3 H 1 2.941 0.020 A 42 HIS HD2 H 1 7.080 0.020 A 42 HIS CA C 13 57.336 0.400 A 42 HIS CB C 13 32.895 0.400 A 42 HIS CD2 C 13 119.840 0.400 A 42 HIS N N 15 111.205 0.400 A 43 ILE H H 1 7.327 0.020 A 43 ILE HA H 1 4.938 0.020 A 43 ILE HB H 1 2.144 0.020 A 43 ILE HD1% H 1 -0.005 0.020 A 43 ILE HG1y H 1 0.797 0.020 A 43 ILE HG1x H 1 0.591 0.020 A 43 ILE HG2% H 1 0.794 0.020 A 43 ILE CA C 13 60.527 0.400 A 43 ILE CB C 13 40.445 0.400 A 43 ILE CD1 C 13 13.117 0.400 A 43 ILE CG1 C 13 26.744 0.400 A 43 ILE CG2 C 13 17.631 0.400 A 43 ILE N N 15 105.996 0.400 A 44 GLY H H 1 8.958 0.020 A 44 GLY HAy H 1 4.340 0.020 A 44 GLY HAx H 1 3.855 0.020 A 44 GLY CA C 13 48.385 0.400 A 44 GLY N N 15 110.704 0.400 A 45 SER H H 1 8.294 0.020 A 45 SER HA H 1 4.517 0.020 A 45 SER HBy H 1 4.090 0.020 A 45 SER HBx H 1 3.904 0.020 A 45 SER CA C 13 58.270 0.400 A 45 SER CB C 13 63.563 0.400 A 45 SER N N 15 110.505 0.400 A 46 SER H H 1 7.689 0.020 A 46 SER HA H 1 4.322 0.020 A 46 SER HBy H 1 3.883 0.020 A 46 SER HBx H 1 3.758 0.020 A 46 SER CA C 13 59.282 0.400 A 46 SER CB C 13 63.719 0.400 A 46 SER N N 15 119.190 0.400 A 47 ASP H H 1 8.646 0.020 A 47 ASP HA H 1 4.446 0.020 A 47 ASP HBy H 1 2.685 0.020 A 47 ASP HBx H 1 2.593 0.020 A 47 ASP CA C 13 54.145 0.400 A 47 ASP CB C 13 41.652 0.400 A 47 ASP N N 15 124.868 0.400 A 48 ILE H H 1 9.406 0.020 A 48 ILE HA H 1 4.091 0.020 A 48 ILE HB H 1 1.754 0.020 A 48 ILE HD1% H 1 0.995 0.020 A 48 ILE HG1y H 1 1.763 0.020 A 48 ILE HG1x H 1 1.533 0.020 A 48 ILE HG2% H 1 1.135 0.020 A 48 ILE CA C 13 63.844 0.400 A 48 ILE CB C 13 39.845 0.400 A 48 ILE CD1 C 13 15.807 0.400 A 48 ILE CG1 C 13 29.423 0.400 A 48 ILE CG2 C 13 17.192 0.400 A 48 ILE N N 15 129.573 0.400 A 49 ARG H H 1 9.004 0.020 A 49 ARG HA H 1 4.166 0.020 A 49 ARG HBy H 1 2.082 0.020 A 49 ARG HBx H 1 2.078 0.020 A 49 ARG HDy H 1 3.149 0.020 A 49 ARG HDx H 1 3.136 0.020 A 49 ARG HGy H 1 1.947 0.020 A 49 ARG HGx H 1 1.927 0.020 A 49 ARG CA C 13 57.534 0.400 A 49 ARG CB C 13 29.870 0.400 A 49 ARG N N 15 119.541 0.400 A 50 GLN H H 1 7.868 0.020 A 50 GLN HA H 1 4.498 0.020 A 50 GLN HBy H 1 2.415 0.020 A 50 GLN HBx H 1 1.997 0.020 A 50 GLN HE2y H 1 7.592 0.020 A 50 GLN HE2x H 1 6.828 0.020 A 50 GLN HGx H 1 2.320 0.020 A 50 GLN HGy H 1 2.320 0.020 A 50 GLN CA C 13 54.633 0.400 A 50 GLN CB C 13 29.548 0.400 A 50 GLN CG C 13 33.493 0.400 A 50 GLN N N 15 114.374 0.400 A 50 GLN NE2 N 15 112.274 0.400 A 51 LEU H H 1 6.799 0.020 A 51 LEU HA H 1 4.516 0.020 A 51 LEU HB2 H 1 1.862 0.020 A 51 LEU HB3 H 1 1.283 0.020 A 51 LEU HDx% H 1 0.996 0.020 A 51 LEU HDy% H 1 0.812 0.020 A 51 LEU HG H 1 1.540 0.020 A 51 LEU CA C 13 54.519 0.400 A 51 LEU CB C 13 43.014 0.400 A 51 LEU CD1 C 13 27.585 0.400 A 51 LEU CD2 C 13 24.100 0.400 A 51 LEU CG C 13 26.770 0.400 A 51 LEU N N 15 119.548 0.400 A 52 LYS H H 1 10.373 0.020 A 52 LYS HA H 1 4.725 0.020 A 52 LYS HB2 H 1 2.152 0.020 A 52 LYS HB3 H 1 1.529 0.020 A 52 LYS HDy H 1 1.610 0.020 A 52 LYS HDx H 1 1.472 0.020 A 52 LYS HEy H 1 3.043 0.020 A 52 LYS HEx H 1 3.041 0.020 A 52 LYS HGy H 1 1.637 0.020 A 52 LYS HGx H 1 1.507 0.020 A 52 LYS CA C 13 53.806 0.400 A 52 LYS CB C 13 34.394 0.400 A 52 LYS CD C 13 29.409 0.400 A 52 LYS CE C 13 42.105 0.400 A 52 LYS CG C 13 25.114 0.400 A 52 LYS N N 15 125.943 0.400 A 53 THR H H 1 8.724 0.020 A 53 THR HA H 1 4.727 0.020 A 53 THR HB H 1 4.021 0.020 A 53 THR HG2% H 1 1.196 0.020 A 53 THR CA C 13 57.570 0.400 A 53 THR CB C 13 68.467 0.400 A 53 THR CG2 C 13 22.163 0.400 A 53 THR N N 15 117.533 0.400 A 54 SER H H 1 8.416 0.020 A 54 SER HA H 1 4.743 0.020 A 54 SER HBy H 1 3.926 0.020 A 54 SER HBx H 1 3.753 0.020 A 54 SER CA C 13 61.306 0.400 A 54 SER CB C 13 61.132 0.400 A 54 SER N N 15 112.941 0.400 A 55 HIS H H 1 7.077 0.020 A 55 HIS HA H 1 4.425 0.020 A 55 HIS HBy H 1 3.338 0.020 A 55 HIS HBx H 1 3.132 0.020 A 55 HIS HD2 H 1 7.091 0.020 A 55 HIS CA C 13 58.659 0.400 A 55 HIS CB C 13 33.051 0.400 A 55 HIS CD2 C 13 116.849 0.400 A 55 HIS N N 15 120.680 0.400 A 56 LEU H H 1 7.410 0.020 A 56 LEU HA H 1 3.916 0.020 A 56 LEU HBy H 1 1.989 0.020 A 56 LEU HBx H 1 1.304 0.020 A 56 LEU HDx% H 1 0.812 0.020 A 56 LEU HDy% H 1 0.686 0.020 A 56 LEU HG H 1 1.754 0.020 A 56 LEU CA C 13 56.558 0.400 A 56 LEU CB C 13 42.547 0.400 A 56 LEU CD1 C 13 24.730 0.400 A 56 LEU CD2 C 13 23.523 0.400 A 56 LEU CG C 13 26.770 0.400 A 56 LEU N N 15 115.029 0.400 A 57 LEU H H 1 7.906 0.020 A 57 LEU HA H 1 4.073 0.020 A 57 LEU HB2 H 1 1.622 0.020 A 57 LEU HB3 H 1 1.493 0.020 A 57 LEU HDx% H 1 0.803 0.020 A 57 LEU HDy% H 1 0.804 0.020 A 57 LEU HG H 1 1.537 0.020 A 57 LEU CA C 13 56.047 0.400 A 57 LEU CB C 13 42.575 0.400 A 57 LEU CD1 C 13 24.870 0.400 A 57 LEU CD2 C 13 23.974 0.400 A 57 LEU CG C 13 26.770 0.400 A 57 LEU N N 15 113.214 0.400 A 58 ALA H H 1 7.367 0.020 A 58 ALA HA H 1 4.176 0.020 A 58 ALA HB% H 1 1.522 0.020 A 58 ALA CA C 13 57.049 0.400 A 58 ALA CB C 13 15.362 0.400 A 58 ALA N N 15 120.662 0.400 A 59 PRO HA H 1 4.133 0.020 A 59 PRO HB2 H 1 2.187 0.020 A 59 PRO HB3 H 1 1.813 0.020 A 59 PRO HDy H 1 3.968 0.020 A 59 PRO HDx H 1 3.467 0.020 A 59 PRO HGy H 1 1.990 0.020 A 59 PRO HGx H 1 1.989 0.020 A 59 PRO CA C 13 65.120 0.400 A 59 PRO CB C 13 31.183 0.400 A 59 PRO CD C 13 50.280 0.400 A 59 PRO CG C 13 27.140 0.400 A 60 ILE H H 1 6.643 0.020 A 60 ILE HA H 1 3.383 0.020 A 60 ILE HB H 1 1.995 0.020 A 60 ILE HD1% H 1 0.714 0.020 A 60 ILE HG1y H 1 1.721 0.020 A 60 ILE HG1x H 1 0.939 0.020 A 60 ILE HG2% H 1 0.928 0.020 A 60 ILE CA C 13 64.886 0.400 A 60 ILE CB C 13 37.799 0.400 A 60 ILE CD1 C 13 8.292 0.400 A 60 ILE CG1 C 13 29.406 0.400 A 60 ILE CG2 C 13 18.084 0.400 A 60 ILE N N 15 117.809 0.400 A 61 LYS H H 1 8.635 0.020 A 61 LYS HA H 1 3.992 0.020 A 61 LYS HBy H 1 1.948 0.020 A 61 LYS HBx H 1 1.780 0.020 A 61 LYS HDy H 1 1.675 0.020 A 61 LYS HDx H 1 1.610 0.020 A 61 LYS HEy H 1 2.918 0.020 A 61 LYS HEx H 1 2.910 0.020 A 61 LYS HGy H 1 1.509 0.020 A 61 LYS HGx H 1 1.423 0.020 A 61 LYS CA C 13 59.048 0.400 A 61 LYS CB C 13 31.678 0.400 A 61 LYS CD C 13 28.962 0.400 A 61 LYS CE C 13 41.780 0.400 A 61 LYS CG C 13 24.884 0.400 A 61 LYS N N 15 120.585 0.400 A 62 GLU H H 1 7.664 0.020 A 62 GLU HA H 1 3.992 0.020 A 62 GLU HBx H 1 2.040 0.020 A 62 GLU HBy H 1 2.040 0.020 A 62 GLU HGy H 1 2.312 0.020 A 62 GLU HGx H 1 2.265 0.020 A 62 GLU CA C 13 59.593 0.400 A 62 GLU CB C 13 28.975 0.400 A 62 GLU CG C 13 35.763 0.400 A 62 GLU N N 15 118.505 0.400 A 63 VAL H H 1 7.227 0.020 A 63 VAL HA H 1 3.545 0.020 A 63 VAL HB H 1 1.973 0.020 A 63 VAL HGx% H 1 0.660 0.020 A 63 VAL HGy% H 1 0.564 0.020 A 63 VAL CA C 13 65.663 0.400 A 63 VAL CB C 13 31.650 0.400 A 63 VAL CG1 C 13 23.066 0.400 A 63 VAL CG2 C 13 21.705 0.400 A 63 VAL N N 15 119.540 0.400 A 64 ASP H H 1 8.281 0.020 A 64 ASP HA H 1 3.984 0.020 A 64 ASP HB2 H 1 2.824 0.020 A 64 ASP HB3 H 1 2.530 0.020 A 64 ASP CA C 13 58.860 0.400 A 64 ASP CB C 13 42.561 0.400 A 64 ASP N N 15 122.316 0.400 A 65 THR H H 1 8.818 0.020 A 65 THR HA H 1 4.310 0.020 A 65 THR HB H 1 4.040 0.020 A 65 THR HG2% H 1 1.302 0.020 A 65 THR CA C 13 68.825 0.400 A 65 THR CB C 13 65.195 0.400 A 65 THR CG2 C 13 21.709 0.400 A 65 THR N N 15 112.808 0.400 A 66 SER H H 1 7.596 0.020 A 66 SER HA H 1 4.469 0.020 A 66 SER HBy H 1 4.103 0.020 A 66 SER HBx H 1 4.050 0.020 A 66 SER CA C 13 59.827 0.400 A 66 SER CB C 13 63.641 0.400 A 66 SER N N 15 116.412 0.400 A 67 GLY H H 1 7.781 0.020 A 67 GLY HAy H 1 4.467 0.020 A 67 GLY HAx H 1 3.355 0.020 A 67 GLY CA C 13 44.337 0.400 A 67 GLY N N 15 108.565 0.400 A 68 LYS H H 1 6.932 0.020 A 68 LYS HA H 1 4.706 0.020 A 68 LYS HBy H 1 1.528 0.020 A 68 LYS HBx H 1 1.521 0.020 A 68 LYS HDx H 1 1.611 0.020 A 68 LYS HDy H 1 1.611 0.020 A 68 LYS HEx H 1 3.030 0.020 A 68 LYS HEy H 1 3.030 0.020 A 68 LYS HGy H 1 1.286 0.020 A 68 LYS HGx H 1 1.280 0.020 A 68 LYS CA C 13 54.145 0.400 A 68 LYS CB C 13 30.325 0.400 A 68 LYS CD C 13 28.780 0.400 A 68 LYS CE C 13 42.099 0.400 A 68 LYS CG C 13 23.970 0.400 A 68 LYS N N 15 121.979 0.400 A 69 HIS H H 1 7.630 0.020 A 69 HIS HA H 1 4.544 0.020 A 69 HIS HBy H 1 3.279 0.020 A 69 HIS HBx H 1 3.278 0.020 A 69 HIS CA C 13 58.270 0.400 A 69 HIS CB C 13 28.303 0.400 A 69 HIS N N 15 119.617 0.400 A 70 ASP H H 1 8.779 0.020 A 70 ASP HA H 1 4.330 0.020 A 70 ASP HBy H 1 2.740 0.020 A 70 ASP HBx H 1 2.700 0.020 A 70 ASP CA C 13 56.869 0.400 A 70 ASP CB C 13 39.433 0.400 A 70 ASP N N 15 118.586 0.400 A 71 VAL H H 1 7.575 0.020 A 71 VAL HA H 1 3.232 0.020 A 71 VAL HB H 1 1.661 0.020 A 71 VAL HGx% H 1 0.855 0.020 A 71 VAL HGy% H 1 0.267 0.020 A 71 VAL CA C 13 66.131 0.400 A 71 VAL CB C 13 31.105 0.400 A 71 VAL CG1 C 13 22.604 0.400 A 71 VAL CG2 C 13 20.801 0.400 A 71 VAL N N 15 121.186 0.400 A 72 ALA H H 1 8.022 0.020 A 72 ALA HA H 1 3.682 0.020 A 72 ALA HB% H 1 1.403 0.020 A 72 ALA CA C 13 55.702 0.400 A 72 ALA CB C 13 18.028 0.400 A 72 ALA N N 15 120.675 0.400 A 73 GLN H H 1 7.793 0.020 A 73 GLN HA H 1 3.971 0.020 A 73 GLN HBy H 1 2.141 0.020 A 73 GLN HBx H 1 2.137 0.020 A 73 GLN HE2y H 1 7.173 0.020 A 73 GLN HE2x H 1 6.662 0.020 A 73 GLN HGy H 1 2.309 0.020 A 73 GLN HGx H 1 2.302 0.020 A 73 GLN CA C 13 58.872 0.400 A 73 GLN CB C 13 28.073 0.400 A 73 GLN CG C 13 33.491 0.400 A 73 GLN N N 15 115.949 0.400 A 73 GLN NE2 N 15 109.129 0.400 A 74 ARG H H 1 7.795 0.020 A 74 ARG HA H 1 4.108 0.020 A 74 ARG HBy H 1 2.117 0.020 A 74 ARG HBx H 1 1.904 0.020 A 74 ARG HDy H 1 3.205 0.020 A 74 ARG HDx H 1 3.200 0.020 A 74 ARG HGy H 1 1.717 0.020 A 74 ARG HGx H 1 1.712 0.020 A 74 ARG CA C 13 59.282 0.400 A 74 ARG CB C 13 29.857 0.400 A 74 ARG CD C 13 43.100 0.400 A 74 ARG CG C 13 28.043 0.400 A 74 ARG N N 15 119.896 0.400 A 75 LEU H H 1 8.850 0.020 A 75 LEU HA H 1 3.935 0.020 A 75 LEU HB2 H 1 2.115 0.020 A 75 LEU HB3 H 1 1.126 0.020 A 75 LEU HDx% H 1 0.846 0.020 A 75 LEU HDy% H 1 0.678 0.020 A 75 LEU HG H 1 1.878 0.020 A 75 LEU CA C 13 57.803 0.400 A 75 LEU CB C 13 42.858 0.400 A 75 LEU CD1 C 13 22.609 0.400 A 75 LEU CD2 C 13 23.521 0.400 A 75 LEU CG C 13 26.770 0.400 A 75 LEU N N 15 118.044 0.400 A 76 GLN H H 1 8.412 0.020 A 76 GLN HA H 1 3.790 0.020 A 76 GLN HB2 H 1 2.317 0.020 A 76 GLN HB3 H 1 2.180 0.020 A 76 GLN HGy H 1 2.311 0.020 A 76 GLN HGx H 1 2.281 0.020 A 76 GLN CA C 13 60.294 0.400 A 76 GLN CB C 13 27.995 0.400 A 76 GLN CG C 13 33.493 0.400 A 76 GLN N N 15 119.109 0.400 A 77 GLN H H 1 7.788 0.020 A 77 GLN HA H 1 4.090 0.020 A 77 GLN HBy H 1 2.390 0.020 A 77 GLN HBx H 1 2.312 0.020 A 77 GLN HE2y H 1 7.496 0.020 A 77 GLN HE2x H 1 6.890 0.020 A 77 GLN HGy H 1 2.668 0.020 A 77 GLN HGx H 1 2.515 0.020 A 77 GLN CA C 13 59.318 0.400 A 77 GLN CB C 13 28.054 0.400 A 77 GLN CG C 13 33.496 0.400 A 77 GLN N N 15 119.616 0.400 A 77 GLN NE2 N 15 111.750 0.400 A 78 ARG H H 1 8.552 0.020 A 78 ARG HA H 1 4.171 0.020 A 78 ARG HBy H 1 2.082 0.020 A 78 ARG HBx H 1 2.079 0.020 A 78 ARG HDy H 1 3.193 0.020 A 78 ARG HDx H 1 3.130 0.020 A 78 ARG HGy H 1 1.895 0.020 A 78 ARG HGx H 1 1.886 0.020 A 78 ARG CA C 13 57.946 0.400 A 78 ARG CB C 13 28.958 0.400 A 78 ARG CD C 13 43.100 0.400 A 78 ARG CG C 13 29.891 0.400 A 78 ARG N N 15 118.044 0.400 A 79 VAL H H 1 8.958 0.020 A 79 VAL HA H 1 3.603 0.020 A 79 VAL HB H 1 2.157 0.020 A 79 VAL HGx% H 1 1.069 0.020 A 79 VAL HGy% H 1 0.965 0.020 A 79 VAL CA C 13 67.284 0.400 A 79 VAL CB C 13 31.228 0.400 A 79 VAL CG1 C 13 23.054 0.400 A 79 VAL CG2 C 13 22.167 0.400 A 79 VAL N N 15 116.998 0.400 A 80 THR H H 1 7.938 0.020 A 80 THR HA H 1 4.301 0.020 A 80 THR HB H 1 3.716 0.020 A 80 THR HG2% H 1 1.243 0.020 A 80 THR CA C 13 67.976 0.400 A 80 THR CB C 13 67.466 0.400 A 80 THR CG2 C 13 21.255 0.400 A 80 THR N N 15 115.701 0.400 A 81 ALA H H 1 7.656 0.020 A 81 ALA HA H 1 4.070 0.020 A 81 ALA HB% H 1 1.604 0.020 A 81 ALA CA C 13 55.232 0.400 A 81 ALA CB C 13 18.087 0.400 A 81 ALA N N 15 124.407 0.400 A 82 ILE H H 1 7.901 0.020 A 82 ILE HA H 1 2.733 0.020 A 82 ILE HB H 1 1.568 0.020 A 82 ILE HD1% H 1 0.614 0.020 A 82 ILE HG1y H 1 0.343 0.020 A 82 ILE HG1x H 1 0.075 0.020 A 82 ILE HG2% H 1 0.356 0.020 A 82 ILE CA C 13 65.450 0.400 A 82 ILE CB C 13 37.569 0.400 A 82 ILE CD1 C 13 15.032 0.400 A 82 ILE CG1 C 13 30.771 0.400 A 82 ILE CG2 C 13 17.212 0.400 A 82 ILE N N 15 121.196 0.400 A 83 MET H H 1 8.258 0.020 A 83 MET HA H 1 4.556 0.020 A 83 MET HBy H 1 2.030 0.020 A 83 MET HBx H 1 2.008 0.020 A 83 MET HE% H 1 2.117 0.020 A 83 MET HGy H 1 2.440 0.020 A 83 MET HGx H 1 2.410 0.020 A 83 MET CA C 13 56.403 0.400 A 83 MET CB C 13 29.782 0.400 A 83 MET CE C 13 16.725 0.400 A 83 MET CG C 13 32.070 0.400 A 83 MET N N 15 120.154 0.400 A 84 ARG H H 1 7.915 0.020 A 84 ARG HA H 1 4.039 0.020 A 84 ARG HBy H 1 1.958 0.020 A 84 ARG HBx H 1 1.948 0.020 A 84 ARG HDy H 1 3.259 0.020 A 84 ARG HDx H 1 3.126 0.020 A 84 ARG HGy H 1 1.605 0.020 A 84 ARG HGx H 1 1.601 0.020 A 84 ARG CA C 13 59.749 0.400 A 84 ARG CB C 13 30.000 0.400 A 84 ARG CD C 13 43.100 0.400 A 84 ARG CG C 13 27.627 0.400 A 84 ARG N N 15 116.534 0.400 A 85 TYR H H 1 8.221 0.020 A 85 TYR HA H 1 4.255 0.020 A 85 TYR HBy H 1 3.567 0.020 A 85 TYR HBx H 1 3.301 0.020 A 85 TYR HD1 H 1 7.172 0.020 A 85 TYR HD2 H 1 7.172 0.020 A 85 TYR HE1 H 1 6.727 0.020 A 85 TYR HE2 H 1 6.727 0.020 A 85 TYR CA C 13 61.382 0.400 A 85 TYR CB C 13 38.499 0.400 A 85 TYR CD1 C 13 133.162 0.400 A 85 TYR CE1 C 13 117.810 0.400 A 85 TYR N N 15 122.313 0.400 A 86 ALA H H 1 8.804 0.020 A 86 ALA HA H 1 4.223 0.020 A 86 ALA HB% H 1 1.753 0.020 A 86 ALA CA C 13 55.043 0.400 A 86 ALA CB C 13 18.087 0.400 A 86 ALA N N 15 123.291 0.400 A 87 VAL H H 1 8.113 0.020 A 87 VAL HA H 1 4.170 0.020 A 87 VAL HB H 1 2.214 0.020 A 87 VAL HGx% H 1 0.959 0.020 A 87 VAL HGy% H 1 0.999 0.020 A 87 VAL CA C 13 65.146 0.400 A 87 VAL CB C 13 31.897 0.400 A 87 VAL CG1 C 13 22.634 0.400 A 87 VAL CG2 C 13 21.310 0.400 A 87 VAL N N 15 120.144 0.400 A 88 GLN H H 1 8.458 0.020 A 88 GLN HA H 1 3.983 0.020 A 88 GLN HBy H 1 2.137 0.020 A 88 GLN HBx H 1 2.004 0.020 A 88 GLN HE2y H 1 7.477 0.020 A 88 GLN HE2x H 1 6.862 0.020 A 88 GLN HGy H 1 2.531 0.020 A 88 GLN HGx H 1 2.407 0.020 A 88 GLN CA C 13 58.270 0.400 A 88 GLN CB C 13 28.075 0.400 A 88 GLN CG C 13 33.944 0.400 A 88 GLN N N 15 120.751 0.400 A 88 GLN NE2 N 15 111.226 0.400 A 89 ASN H H 1 7.359 0.020 A 89 ASN HA H 1 4.486 0.020 A 89 ASN HB2 H 1 2.342 0.020 A 89 ASN HB3 H 1 1.778 0.020 A 89 ASN HD2y H 1 6.375 0.020 A 89 ASN HD2x H 1 6.282 0.020 A 89 ASN CA C 13 53.444 0.400 A 89 ASN CB C 13 38.932 0.400 A 89 ASN N N 15 113.850 0.400 A 89 ASN ND2 N 15 115.419 0.400 A 90 ASP H H 1 7.849 0.020 A 90 ASP HA H 1 4.387 0.020 A 90 ASP HBy H 1 2.931 0.020 A 90 ASP HBx H 1 2.610 0.020 A 90 ASP CA C 13 55.935 0.400 A 90 ASP CB C 13 38.811 0.400 A 90 ASP N N 15 113.293 0.400 A 91 TYR H H 1 8.489 0.020 A 91 TYR HA H 1 4.589 0.020 A 91 TYR HBy H 1 3.087 0.020 A 91 TYR HBx H 1 2.853 0.020 A 91 TYR HD1 H 1 6.872 0.020 A 91 TYR HD2 H 1 6.872 0.020 A 91 TYR HE1 H 1 6.577 0.020 A 91 TYR HE2 H 1 6.577 0.020 A 91 TYR CA C 13 60.000 0.400 A 91 TYR CB C 13 38.811 0.400 A 91 TYR CD1 C 13 131.799 0.400 A 91 TYR CE1 C 13 118.660 0.400 A 91 TYR N N 15 116.072 0.400 A 92 ILE H H 1 7.131 0.020 A 92 ILE HA H 1 4.684 0.020 A 92 ILE HB H 1 2.174 0.020 A 92 ILE HD1% H 1 0.770 0.020 A 92 ILE HG1y H 1 1.300 0.020 A 92 ILE HG1x H 1 1.243 0.020 A 92 ILE HG2% H 1 1.004 0.020 A 92 ILE CA C 13 59.126 0.400 A 92 ILE CB C 13 41.846 0.400 A 92 ILE CD1 C 13 14.110 0.400 A 92 ILE CG1 C 13 27.650 0.400 A 92 ILE CG2 C 13 20.805 0.400 A 92 ILE N N 15 107.409 0.400 A 93 ASP H H 1 8.731 0.020 A 93 ASP HA H 1 4.707 0.020 A 93 ASP HBy H 1 2.730 0.020 A 93 ASP HBx H 1 2.728 0.020 A 93 ASP CA C 13 54.689 0.400 A 93 ASP CB C 13 41.924 0.400 A 93 ASP N N 15 118.847 0.400 A 94 SER H H 1 7.638 0.020 A 94 SER HA H 1 4.491 0.020 A 94 SER HBy H 1 3.776 0.020 A 94 SER HBx H 1 3.774 0.020 A 94 SER CA C 13 57.102 0.400 A 94 SER CB C 13 64.186 0.400 A 94 SER N N 15 112.240 0.400 A 95 ASN H H 1 8.801 0.020 A 95 ASN HA H 1 4.942 0.020 A 95 ASN HBy H 1 3.245 0.020 A 95 ASN HBx H 1 2.609 0.020 A 95 ASN HD2y H 1 7.776 0.020 A 95 ASN HD2x H 1 6.465 0.020 A 95 ASN CA C 13 49.941 0.400 A 95 ASN CB C 13 39.356 0.400 A 95 ASN N N 15 119.551 0.400 A 95 ASN ND2 N 15 108.596 0.400 A 96 PRO HA H 1 4.632 0.020 A 96 PRO HB2 H 1 2.458 0.020 A 96 PRO HB3 H 1 1.813 0.020 A 96 PRO HDy H 1 4.143 0.020 A 96 PRO HDx H 1 3.775 0.020 A 96 PRO HGy H 1 2.182 0.020 A 96 PRO HGx H 1 1.828 0.020 A 96 PRO CA C 13 63.564 0.400 A 96 PRO CB C 13 32.058 0.400 A 96 PRO CD C 13 50.842 0.400 A 96 PRO CG C 13 26.694 0.400 A 97 ALA H H 1 8.335 0.020 A 97 ALA HA H 1 4.436 0.020 A 97 ALA HB% H 1 1.459 0.020 A 97 ALA CA C 13 52.055 0.400 A 97 ALA CB C 13 18.998 0.400 A 97 ALA N N 15 121.226 0.400 A 98 SER H H 1 7.600 0.020 A 98 SER HA H 1 4.168 0.020 A 98 SER HBy H 1 3.943 0.020 A 98 SER HBx H 1 3.923 0.020 A 98 SER CA C 13 60.372 0.400 A 98 SER CB C 13 63.018 0.400 A 98 SER N N 15 114.935 0.400 A 99 ASP H H 1 8.098 0.020 A 99 ASP HA H 1 4.760 0.020 A 99 ASP HBy H 1 2.787 0.020 A 99 ASP HBx H 1 2.584 0.020 A 99 ASP CA C 13 54.300 0.400 A 99 ASP CB C 13 40.835 0.400 A 99 ASP N N 15 119.889 0.400 A 100 MET H H 1 7.885 0.020 A 100 MET HA H 1 4.205 0.020 A 100 MET HBy H 1 2.079 0.020 A 100 MET HBx H 1 2.051 0.020 A 100 MET HE% H 1 1.984 0.020 A 100 MET HGy H 1 2.563 0.020 A 100 MET HGx H 1 2.437 0.020 A 100 MET CA C 13 57.025 0.400 A 100 MET CB C 13 33.038 0.400 A 100 MET CE C 13 16.725 0.400 A 100 MET CG C 13 32.070 0.400 A 100 MET N N 15 119.185 0.400 A 101 ALA H H 1 8.041 0.020 A 101 ALA HA H 1 4.137 0.020 A 101 ALA HB% H 1 1.402 0.020 A 101 ALA CA C 13 53.655 0.400 A 101 ALA CB C 13 18.537 0.400 A 101 ALA N N 15 122.264 0.400 A 102 GLY H H 1 8.293 0.020 A 102 GLY HAx H 1 3.910 0.020 A 102 GLY HAy H 1 3.913 0.020 A 102 GLY CA C 13 45.664 0.400 A 102 GLY N N 15 107.557 0.400 A 103 ALA H H 1 7.955 0.020 A 103 ALA HA H 1 4.235 0.020 A 103 ALA HB% H 1 1.404 0.020 A 103 ALA CA C 13 53.423 0.400 A 103 ALA CB C 13 19.219 0.400 A 103 ALA N N 15 123.285 0.400 A 104 LEU H H 1 8.145 0.020 A 104 LEU HA H 1 4.301 0.020 A 104 LEU HBy H 1 1.689 0.020 A 104 LEU HBx H 1 1.605 0.020 A 104 LEU HDx% H 1 0.811 0.020 A 104 LEU HDy% H 1 0.786 0.020 A 104 LEU HG H 1 1.416 0.020 A 104 LEU CA C 13 55.312 0.400 A 104 LEU CB C 13 41.644 0.400 A 104 LEU CD1 C 13 24.730 0.400 A 104 LEU CD2 C 13 23.073 0.400 A 104 LEU CG C 13 26.770 0.400 A 104 LEU N N 15 118.570 0.400 A 105 SER H H 1 8.040 0.020 A 105 SER HA H 1 4.390 0.020 A 105 SER HBy H 1 3.903 0.020 A 105 SER HBx H 1 3.872 0.020 A 105 SER CA C 13 58.893 0.400 A 105 SER CB C 13 63.424 0.400 A 105 SER N N 15 115.022 0.400 A 106 THR H H 1 8.032 0.020 A 106 THR HA H 1 4.293 0.020 A 106 THR HB H 1 4.247 0.020 A 106 THR HG2% H 1 1.168 0.020 A 106 THR CA C 13 62.037 0.400 A 106 THR CB C 13 69.401 0.400 A 106 THR CG2 C 13 21.553 0.400 A 106 THR N N 15 115.371 0.400 A 107 THR H H 1 7.940 0.020 A 107 THR HA H 1 4.296 0.020 A 107 THR HB H 1 4.080 0.020 A 107 THR HG2% H 1 0.815 0.020 A 107 THR CA C 13 61.539 0.400 A 107 THR CB C 13 61.610 0.400 A 107 THR CG2 C 13 17.240 0.400 A 107 THR N N 15 122.759 0.400 A 108 LYS H H 1 8.240 0.020 A 108 LYS HA H 1 4.241 0.020 A 108 LYS HBy H 1 1.800 0.020 A 108 LYS HBx H 1 1.723 0.020 A 108 LYS HDy H 1 1.653 0.020 A 108 LYS HDx H 1 1.652 0.020 A 108 LYS HEx H 1 2.930 0.020 A 108 LYS HEy H 1 2.930 0.020 A 108 LYS HGy H 1 1.436 0.020 A 108 LYS HGx H 1 1.432 0.020 A 108 LYS CA C 13 56.324 0.400 A 108 LYS CB C 13 32.817 0.400 A 108 LYS CD C 13 28.780 0.400 A 108 LYS CE C 13 41.780 0.400 A 108 LYS CG C 13 24.875 0.400 A 108 LYS N N 15 124.773 0.400 A 109 ALA H H 1 8.131 0.020 A 109 ALA HA H 1 4.224 0.020 A 109 ALA HB% H 1 1.329 0.020 A 109 ALA CA C 13 52.432 0.400 A 109 ALA CB C 13 19.017 0.400 A 109 ALA N N 15 124.331 0.400 A 110 ARG H H 1 8.114 0.020 A 110 ARG HA H 1 4.191 0.020 A 110 ARG HBy H 1 1.655 0.020 A 110 ARG HBx H 1 1.644 0.020 A 110 ARG HDy H 1 3.116 0.020 A 110 ARG HDx H 1 3.115 0.020 A 110 ARG HGy H 1 1.473 0.020 A 110 ARG HGx H 1 1.462 0.020 A 110 ARG CA C 13 56.013 0.400 A 110 ARG CB C 13 30.871 0.400 A 110 ARG CD C 13 43.100 0.400 A 110 ARG CG C 13 27.146 0.400 A 110 ARG N N 15 119.544 0.400 A 111 HIS H H 1 8.283 0.020 A 111 HIS HA H 1 4.604 0.020 A 111 HIS HBy H 1 3.037 0.020 A 111 HIS HBx H 1 3.016 0.020 A 111 HIS HD2 H 1 7.046 0.020 A 111 HIS CA C 13 55.448 0.400 A 111 HIS CB C 13 29.866 0.400 A 111 HIS CD2 C 13 119.578 0.400 A 111 HIS N N 15 119.886 0.400 A 112 TYR H H 1 8.179 0.020 A 112 TYR HA H 1 4.766 0.020 A 112 TYR HBy H 1 3.023 0.020 A 112 TYR HBx H 1 2.781 0.020 A 112 TYR HD1 H 1 7.078 0.020 A 112 TYR HD2 H 1 7.078 0.020 A 112 TYR HE1 H 1 6.764 0.020 A 112 TYR HE2 H 1 6.764 0.020 A 112 TYR CA C 13 55.701 0.400 A 112 TYR CB C 13 38.110 0.400 A 112 TYR CD1 C 13 133.158 0.400 A 112 TYR CE1 C 13 117.810 0.400 A 112 TYR N N 15 122.673 0.400 A 113 PRO HA H 1 4.399 0.020 A 113 PRO HBy H 1 2.283 0.020 A 113 PRO HBx H 1 1.901 0.020 A 113 PRO HDy H 1 3.698 0.020 A 113 PRO HDx H 1 3.571 0.020 A 113 PRO HGy H 1 2.003 0.020 A 113 PRO HGx H 1 1.994 0.020 A 113 PRO CA C 13 63.097 0.400 A 113 PRO CB C 13 31.684 0.400 A 113 PRO CD C 13 50.414 0.400 A 113 PRO CG C 13 27.150 0.400 A 114 LEU H H 1 8.225 0.020 A 114 LEU HA H 1 4.265 0.020 A 114 LEU HBy H 1 1.610 0.020 A 114 LEU HBx H 1 1.526 0.020 A 114 LEU HDx% H 1 0.908 0.020 A 114 LEU HDy% H 1 0.893 0.020 A 114 LEU HG H 1 1.540 0.020 A 114 LEU CA C 13 55.069 0.400 A 114 LEU CB C 13 42.104 0.400 A 114 LEU CD1 C 13 24.730 0.400 A 114 LEU CD2 C 13 24.880 0.400 A 114 LEU CG C 13 26.770 0.400 A 114 LEU N N 15 121.625 0.400 A 115 GLU H H 1 8.273 0.020 A 115 GLU HA H 1 4.202 0.020 A 115 GLU HBy H 1 1.919 0.020 A 115 GLU HBx H 1 1.903 0.020 A 115 GLU HGy H 1 2.188 0.020 A 115 GLU HGx H 1 2.147 0.020 A 115 GLU CA C 13 56.402 0.400 A 115 GLU CB C 13 30.249 0.400 A 115 GLU CG C 13 35.767 0.400 A 115 GLU N N 15 120.585 0.400 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 3 ASN HA A 4 SER H 1.0 0.0 3.02 2 2 A 5 GLY H A 4 SER HBy 1.0 0.0 5.22 3 3 A 5 GLY H A 4 SER HBx 1.0 0.0 5.22 4 4 A 5 GLY H A 6 ALA H 1.0 0.0 4.88 5 5 A 8 THR HB A 9 PHE H 1.0 0.0 5.41 6 6 A 10 GLU H A 9 PHE HBy 1.0 0.0 5.16 7 7 A 10 GLU H A 9 PHE HBx 1.0 0.0 5.16 8 8 A 10 GLU H A 11 THR H 1.0 0.0 4.45 9 9 A 11 THR H A 10 GLU HBy 1.0 0.0 5.50 10 10 A 11 THR H A 10 GLU HBx 1.0 0.0 5.50 11 11 A 11 THR HB A 12 ILE H 1.0 0.0 4.97 12 12 A 12 ILE HB A 13 ALA H 1.0 0.0 4.11 13 13 A 13 ALA H A 14 ARG H 1.0 0.0 4.23 14 14 A 15 GLU H A 14 ARG HBy 1.0 0.0 3.89 15 15 A 15 GLU H A 14 ARG HBx 1.0 0.0 3.89 16 16 A 15 GLU H A 16 TRP H 1.0 0.0 4.04 17 17 A 16 TRP H A 15 GLU HBy 1.0 0.0 4.01 18 18 A 16 TRP H A 15 GLU HBx 1.0 0.0 4.01 19 19 A 16 TRP H A 17 HIS H 1.0 0.0 3.79 20 20 A 17 HIS H A 16 TRP HBx 1.0 0.0 5.50 21 21 A 18 GLU H A 19 SER H 1.0 0.0 4.01 22 22 A 19 SER H A 18 GLU HBy 1.0 0.0 4.82 23 23 A 19 SER H A 18 GLU HBx 1.0 0.0 4.82 24 24 A 22 ARG H A 21 LYS HBx 1.0 0.0 5.04 25 25 A 22 ARG HBx A 23 TRP H 1.0 0.0 5.07 26 26 A 24 SER HBy A 25 GLU H 1.0 0.0 5.16 27 27 A 25 GLU H A 24 SER HBx 1.0 0.0 5.16 28 28 A 25 GLU H A 26 ASP H 1.0 0.0 5.47 29 29 A 26 ASP H A 27 HIS H 1.0 0.0 5.07 30 30 A 27 HIS HBy A 28 ARG H 1.0 0.0 4.42 31 31 A 28 ARG H A 27 HIS HBx 1.0 0.0 4.42 32 32 A 28 ARG H A 29 SER H 1.0 0.0 4.54 33 33 A 29 SER H A 28 ARG HBy 1.0 0.0 4.35 34 34 A 29 SER H A 28 ARG HBx 1.0 0.0 4.35 35 35 A 30 ARG H A 31 VAL H 1.0 0.0 4.20 36 36 A 31 VAL H A 30 ARG HBy 1.0 0.0 4.54 37 37 A 31 VAL H A 30 ARG HBx 1.0 0.0 4.54 38 38 A 31 VAL H A 32 LEU H 1.0 0.0 4.32 39 39 A 32 LEU HB2 A 33 ARG H 1.0 0.0 4.26 40 40 A 33 ARG H A 32 LEU HB3 1.0 0.0 5.07 41 41 A 33 ARG H A 34 TYR H 1.0 0.0 3.83 42 42 A 34 TYR H A 33 ARG HBy 1.0 0.0 4.11 43 43 A 34 TYR H A 33 ARG HBx 1.0 0.0 4.11 44 44 A 34 TYR HB2 A 35 LEU H 1.0 0.0 4.76 45 45 A 35 LEU HBy A 36 GLU H 1.0 0.0 4.82 46 46 A 36 GLU H A 35 LEU HBx 1.0 0.0 4.82 47 47 A 38 TYR H A 39 ILE H 1.0 0.0 4.14 48 48 A 39 ILE H A 38 TYR HBy 1.0 0.0 5.28 49 49 A 39 ILE H A 40 PHE H 1.0 0.0 3.86 50 50 A 40 PHE H A 39 ILE HB 1.0 0.0 4.35 51 51 A 42 HIS HB2 A 43 ILE H 1.0 0.0 4.91 52 52 A 43 ILE H A 42 HIS HB3 1.0 0.0 4.51 53 53 A 43 ILE H A 44 GLY H 1.0 0.0 3.92 54 54 A 44 GLY H A 43 ILE HB 1.0 0.0 5.50 55 55 A 44 GLY H A 45 SER H 1.0 0.0 4.66 56 56 A 45 SER H A 46 SER H 1.0 0.0 4.07 57 57 A 46 SER H A 45 SER HBy 1.0 0.0 5.38 58 58 A 46 SER H A 45 SER HBx 1.0 0.0 5.38 59 59 A 47 ASP H A 46 SER HBx 1.0 0.0 5.50 60 60 A 48 ILE HB A 49 ARG H 1.0 0.0 4.94 61 61 A 49 ARG H A 50 GLN H 1.0 0.0 4.11 62 62 A 50 GLN H A 49 ARG HBy 1.0 0.0 5.19 63 63 A 50 GLN H A 49 ARG HBx 1.0 0.0 5.19 64 64 A 50 GLN HBx A 51 LEU H 1.0 0.0 5.50 65 65 A 52 LYS H A 53 THR H 1.0 0.0 5.50 66 66 A 53 THR H A 52 LYS HA 1.0 0.0 3.36 67 67 A 53 THR H A 52 LYS HB2 1.0 0.0 4.01 68 68 A 53 THR H A 52 LYS HB3 1.0 0.0 4.29 69 69 A 53 THR H A 54 SER H 1.0 0.0 4.76 70 70 A 54 SER H A 53 THR HB 1.0 0.0 4.01 71 71 A 54 SER H A 55 HIS H 1.0 0.0 4.35 72 72 A 55 HIS H A 54 SER HBy 1.0 0.0 4.97 73 73 A 55 HIS H A 54 SER HBx 1.0 0.0 4.97 74 74 A 55 HIS HBy A 56 LEU H 1.0 0.0 5.38 75 75 A 56 LEU H A 55 HIS HBx 1.0 0.0 5.38 76 76 A 57 LEU H A 56 LEU HBy 1.0 0.0 4.72 77 77 A 57 LEU H A 56 LEU HBx 1.0 0.0 4.72 78 78 A 57 LEU HB2 A 58 ALA H 1.0 0.0 4.20 79 79 A 58 ALA H A 57 LEU HB3 1.0 0.0 3.45 80 80 A 59 PRO HB3 A 60 ILE H 1.0 0.0 4.63 81 81 A 60 ILE H A 61 LYS H 1.0 0.0 3.79 82 82 A 61 LYS H A 60 ILE HB 1.0 0.0 3.89 83 83 A 61 LYS H A 62 GLU H 1.0 0.0 3.92 84 84 A 62 GLU H A 61 LYS HBy 1.0 0.0 4.32 85 85 A 62 GLU H A 61 LYS HBx 1.0 0.0 4.32 86 86 A 63 VAL H A 62 GLU HBx 1.0 0.0 4.11 87 87 A 63 VAL H A 62 GLU HBy 1.0 0.0 4.11 88 88 A 63 VAL H A 64 ASP H 1.0 0.0 4.04 89 89 A 64 ASP H A 63 VAL HB 1.0 0.0 4.17 90 90 A 64 ASP HB2 A 65 THR H 1.0 0.0 4.32 91 91 A 65 THR H A 66 SER H 1.0 0.0 4.17 92 92 A 66 SER H A 65 THR HB 1.0 0.0 3.89 93 93 A 66 SER HBx A 67 GLY H 1.0 0.0 5.50 94 94 A 68 LYS H A 69 HIS H 1.0 0.0 5.19 95 95 A 69 HIS H A 68 LYS HA 1.0 0.0 3.45 96 96 A 69 HIS H A 68 LYS HBy 1.0 0.0 5.13 97 97 A 69 HIS H A 68 LYS HBx 1.0 0.0 5.13 98 98 A 69 HIS H A 70 ASP H 1.0 0.0 4.91 99 99 A 70 ASP H A 69 HIS HBy 1.0 0.0 5.00 100 100 A 70 ASP H A 69 HIS HBx 1.0 0.0 5.00 101 101 A 71 VAL H A 70 ASP HBy 1.0 0.0 4.48 102 102 A 71 VAL H A 70 ASP HBx 1.0 0.0 4.48 103 103 A 71 VAL HB A 72 ALA H 1.0 0.0 4.04 104 104 A 74 ARG H A 75 LEU H 1.0 0.0 4.01 105 105 A 75 LEU H A 74 ARG HBy 1.0 0.0 3.95 106 106 A 75 LEU H A 74 ARG HBx 1.0 0.0 3.95 107 107 A 75 LEU H A 76 GLN H 1.0 0.0 4.23 108 108 A 76 GLN H A 75 LEU HB2 1.0 0.0 4.07 109 109 A 76 GLN H A 75 LEU HB3 1.0 0.0 4.82 110 110 A 76 GLN H A 77 GLN H 1.0 0.0 4.01 111 111 A 77 GLN H A 76 GLN HB2 1.0 0.0 3.58 112 112 A 77 GLN H A 76 GLN HB3 1.0 0.0 3.95 113 113 A 78 ARG H A 77 GLN HBy 1.0 0.0 4.42 114 114 A 79 VAL H A 80 THR H 1.0 0.0 4.04 115 115 A 80 THR H A 79 VAL HB 1.0 0.0 4.38 116 116 A 80 THR H A 81 ALA H 1.0 0.0 4.14 117 117 A 81 ALA H A 80 THR HB 1.0 0.0 5.16 118 118 A 82 ILE H A 83 MET H 1.0 0.0 4.14 119 119 A 83 MET H A 82 ILE HB 1.0 0.0 4.97 120 120 A 84 ARG H A 83 MET HBy 1.0 0.0 4.72 121 121 A 84 ARG H A 83 MET HBx 1.0 0.0 4.72 122 122 A 86 ALA H A 85 TYR HBy 1.0 0.0 4.88 123 123 A 86 ALA H A 85 TYR HBx 1.0 0.0 4.88 124 124 A 87 VAL HB A 88 GLN H 1.0 0.0 3.79 125 125 A 88 GLN H A 89 ASN H 1.0 0.0 3.95 126 126 A 89 ASN H A 88 GLN HBy 1.0 0.0 4.60 127 127 A 89 ASN H A 90 ASP H 1.0 0.0 3.95 128 128 A 90 ASP H A 89 ASN HB2 1.0 0.0 5.50 129 129 A 90 ASP H A 89 ASN HB3 1.0 0.0 5.19 130 130 A 90 ASP HBy A 91 TYR H 1.0 0.0 5.50 131 131 A 91 TYR H A 90 ASP HBx 1.0 0.0 5.50 132 132 A 92 ILE H A 91 TYR HBy 1.0 0.0 5.04 133 133 A 92 ILE H A 91 TYR HBx 1.0 0.0 5.04 134 134 A 93 ASP H A 94 SER H 1.0 0.0 4.01 135 135 A 94 SER H A 93 ASP HBy 1.0 0.0 4.51 136 136 A 94 SER H A 93 ASP HBx 1.0 0.0 4.51 137 137 A 95 ASN H A 94 SER HBy 1.0 0.0 4.26 138 138 A 95 ASN H A 94 SER HBx 1.0 0.0 4.26 139 139 A 97 ALA H A 98 SER H 1.0 0.0 3.83 140 140 A 99 ASP H A 98 SER HBy 1.0 0.0 4.88 141 141 A 99 ASP H A 98 SER HBx 1.0 0.0 4.88 142 142 A 99 ASP H A 100 MET H 1.0 0.0 4.20 143 143 A 100 MET H A 99 ASP HBx 1.0 0.0 5.00 144 144 A 101 ALA H A 100 MET HBy 1.0 0.0 4.63 145 145 A 101 ALA H A 100 MET HBx 1.0 0.0 4.63 146 146 A 102 GLY H A 103 ALA H 1.0 0.0 4.42 147 147 A 104 LEU H A 105 SER H 1.0 0.0 3.79 148 148 A 105 SER H A 104 LEU HBy 1.0 0.0 4.60 149 149 A 105 SER H A 104 LEU HBx 1.0 0.0 4.60 150 150 A 105 SER HBy A 106 THR H 1.0 0.0 4.82 151 151 A 106 THR H A 105 SER HBx 1.0 0.0 4.82 152 152 A 106 THR H A 107 THR H 1.0 0.0 4.14 153 153 A 107 THR H A 106 THR HB 1.0 0.0 4.01 154 154 A 107 THR H A 108 LYS H 1.0 0.0 5.31 155 155 A 108 LYS H A 107 THR HB 1.0 0.0 3.42 156 156 A 108 LYS H A 109 ALA H 1.0 0.0 4.23 157 157 A 109 ALA H A 108 LYS HA 1.0 0.0 3.42 158 158 A 109 ALA H A 108 LYS HBy 1.0 0.0 5.31 159 159 A 109 ALA H A 108 LYS HBx 1.0 0.0 5.31 160 160 A 111 HIS HBy A 112 TYR H 1.0 0.0 4.94 161 161 A 114 LEU H A 115 GLU H 1.0 0.0 2.55 162 162 A 8 THR HB A 8 THR H 1.0 0.0 4.20 163 163 A 12 ILE H A 12 ILE HB 1.0 0.0 3.89 164 164 A 14 ARG H A 14 ARG HBy 1.0 0.0 4.14 165 165 A 14 ARG H A 14 ARG HBx 1.0 0.0 4.14 166 166 A 15 GLU H A 15 GLU HBx 1.0 0.0 3.98 167 167 A 19 SER H A 19 SER HBy 1.0 0.0 3.98 168 168 A 19 SER H A 19 SER HBx 1.0 0.0 3.98 169 169 A 28 ARG H A 28 ARG HBy 1.0 0.0 4.11 170 170 A 28 ARG H A 28 ARG HBx 1.0 0.0 4.11 171 171 A 29 SER H A 29 SER HBy 1.0 0.0 4.11 172 172 A 29 SER H A 29 SER HBx 1.0 0.0 4.11 173 173 A 33 ARG H A 33 ARG HBy 1.0 0.0 3.67 174 174 A 33 ARG H A 33 ARG HBx 1.0 0.0 3.67 175 175 A 34 TYR H A 34 TYR HB2 1.0 0.0 4.07 176 176 A 42 HIS HB3 A 42 HIS H 1.0 0.0 3.92 177 177 A 47 ASP H A 47 ASP HBy 1.0 0.0 3.92 178 178 A 47 ASP H A 47 ASP HBx 1.0 0.0 3.92 179 179 A 51 LEU H A 51 LEU HB2 1.0 0.0 3.83 180 180 A 53 THR H A 53 THR HB 1.0 0.0 3.98 181 181 A 57 LEU H A 57 LEU HB2 1.0 0.0 3.79 182 182 A 57 LEU H A 57 LEU HB3 1.0 0.0 3.95 183 183 A 60 ILE H A 60 ILE HB 1.0 0.0 3.86 184 184 A 61 LYS H A 61 LYS HBy 1.0 0.0 3.83 185 185 A 62 GLU H A 62 GLU HBx 1.0 0.0 3.45 186 186 A 62 GLU H A 62 GLU HBy 1.0 0.0 3.45 187 187 A 64 ASP H A 64 ASP HB2 1.0 0.0 4.07 188 188 A 64 ASP H A 64 ASP HB3 1.0 0.0 3.92 189 189 A 68 LYS H A 68 LYS HBy 1.0 0.0 4.01 190 190 A 68 LYS H A 68 LYS HBx 1.0 0.0 4.01 191 191 A 69 HIS H A 69 HIS HBy 1.0 0.0 3.92 192 192 A 69 HIS H A 69 HIS HBx 1.0 0.0 3.92 193 193 A 71 VAL H A 71 VAL HB 1.0 0.0 3.86 194 194 A 74 ARG H A 74 ARG HBy 1.0 0.0 3.92 195 195 A 74 ARG H A 74 ARG HBx 1.0 0.0 3.92 196 196 A 75 LEU H A 75 LEU HB2 1.0 0.0 3.95 197 197 A 76 GLN H A 76 GLN HB2 1.0 0.0 3.61 198 198 A 76 GLN H A 76 GLN HB3 1.0 0.0 3.79 199 199 A 77 GLN H A 77 GLN HBy 1.0 0.0 3.83 200 200 A 77 GLN H A 77 GLN HBx 1.0 0.0 3.83 201 201 A 78 ARG H A 78 ARG HBy 1.0 0.0 4.20 202 202 A 78 ARG H A 78 ARG HBx 1.0 0.0 4.20 203 203 A 79 VAL H A 79 VAL HB 1.0 0.0 3.76 204 204 A 83 MET H A 83 MET HBy 1.0 0.0 4.07 205 205 A 83 MET H A 83 MET HBx 1.0 0.0 4.07 206 206 A 85 TYR H A 85 TYR HBy 1.0 0.0 4.17 207 207 A 85 TYR H A 85 TYR HBx 1.0 0.0 4.17 208 208 A 87 VAL HB A 87 VAL H 1.0 0.0 3.67 209 209 A 88 GLN H A 88 GLN HBy 1.0 0.0 3.98 210 210 A 89 ASN H A 89 ASN HB3 1.0 0.0 4.01 211 211 A 94 SER H A 94 SER HBy 1.0 0.0 4.14 212 212 A 94 SER H A 94 SER HBx 1.0 0.0 4.14 213 213 A 98 SER H A 98 SER HBy 1.0 0.0 4.11 214 214 A 98 SER H A 98 SER HBx 1.0 0.0 4.11 215 215 A 100 MET H A 100 MET HBy 1.0 0.0 3.70 216 216 A 100 MET H A 100 MET HBx 1.0 0.0 3.70 217 217 A 104 LEU H A 104 LEU HBy 1.0 0.0 3.70 218 218 A 104 LEU H A 104 LEU HBx 1.0 0.0 3.70 219 219 A 105 SER H A 105 SER HBy 1.0 0.0 3.76 220 220 A 105 SER H A 105 SER HBx 1.0 0.0 3.76 221 221 A 108 LYS H A 108 LYS HBy 1.0 0.0 4.11 222 222 A 108 LYS H A 108 LYS HBx 1.0 0.0 4.11 223 223 A 110 ARG H A 110 ARG HBy 1.0 0.0 3.86 224 224 A 110 ARG H A 110 ARG HBx 1.0 0.0 3.86 225 225 A 115 GLU H A 115 GLU HBy 1.0 0.0 4.11 226 226 A 115 GLU H A 115 GLU HBx 1.0 0.0 4.11 227 227 A 4 SER H A 5 GLY H 1.0 0.0 5.28 228 228 A 6 ALA H A 7 TYR H 1.0 0.0 4.26 229 229 A 8 THR H A 7 TYR H 1.0 0.0 4.07 230 230 A 9 PHE H A 8 THR H 1.0 0.0 5.50 231 231 A 9 PHE H A 10 GLU H 1.0 0.0 4.82 232 232 A 11 THR H A 12 ILE H 1.0 0.0 4.14 233 233 A 12 ILE H A 13 ALA H 1.0 0.0 4.17 234 234 A 14 ARG H A 15 GLU H 1.0 0.0 4.11 235 235 A 17 HIS H A 18 GLU H 1.0 0.0 4.32 236 236 A 19 SER H A 20 ASN H 1.0 0.0 4.26 237 237 A 20 ASN H A 21 LYS H 1.0 0.0 5.50 238 238 A 22 ARG H A 23 TRP H 1.0 0.0 4.35 239 239 A 27 HIS H A 28 ARG H 1.0 0.0 4.85 240 240 A 29 SER H A 30 ARG H 1.0 0.0 4.51 241 241 A 32 LEU H A 33 ARG H 1.0 0.0 4.32 242 242 A 34 TYR H A 35 LEU H 1.0 0.0 3.83 243 243 A 35 LEU H A 36 GLU H 1.0 0.0 4.32 244 244 A 36 GLU H A 37 LEU H 1.0 0.0 4.35 245 245 A 38 TYR H A 37 LEU H 1.0 0.0 4.48 246 246 A 43 ILE H A 42 HIS H 1.0 0.0 3.70 247 247 A 46 SER H A 47 ASP H 1.0 0.0 5.41 248 248 A 47 ASP H A 48 ILE H 1.0 0.0 5.50 249 249 A 49 ARG H A 48 ILE H 1.0 0.0 5.28 250 250 A 50 GLN H A 51 LEU H 1.0 0.0 3.61 251 251 A 55 HIS H A 56 LEU H 1.0 0.0 3.86 252 252 A 56 LEU H A 57 LEU H 1.0 0.0 3.89 253 253 A 57 LEU H A 58 ALA H 1.0 0.0 3.89 254 254 A 62 GLU H A 63 VAL H 1.0 0.0 3.95 255 255 A 64 ASP H A 65 THR H 1.0 0.0 4.35 256 256 A 66 SER H A 67 GLY H 1.0 0.0 4.20 257 257 A 67 GLY H A 68 LYS H 1.0 0.0 3.92 258 258 A 70 ASP H A 71 VAL H 1.0 0.0 4.26 259 259 A 71 VAL H A 72 ALA H 1.0 0.0 3.95 260 260 A 72 ALA H A 73 GLN H 1.0 0.0 4.07 261 261 A 77 GLN H A 78 ARG H 1.0 0.0 3.95 262 262 A 78 ARG H A 79 VAL H 1.0 0.0 4.20 263 263 A 81 ALA H A 82 ILE H 1.0 0.0 4.01 264 264 A 83 MET H A 84 ARG H 1.0 0.0 4.17 265 265 A 84 ARG H A 85 TYR H 1.0 0.0 4.26 266 266 A 86 ALA H A 85 TYR H 1.0 0.0 4.11 267 267 A 86 ALA H A 87 VAL H 1.0 0.0 4.20 268 268 A 88 GLN H A 87 VAL H 1.0 0.0 3.79 269 269 A 90 ASP H A 91 TYR H 1.0 0.0 4.04 270 270 A 91 TYR H A 92 ILE H 1.0 0.0 3.67 271 271 A 92 ILE H A 93 ASP H 1.0 0.0 5.22 272 272 A 94 SER H A 95 ASN H 1.0 0.0 5.50 273 273 A 98 SER H A 99 ASP H 1.0 0.0 4.45 274 274 A 100 MET H A 101 ALA H 1.0 0.0 3.95 275 275 A 101 ALA H A 102 GLY H 1.0 0.0 4.35 276 276 A 103 ALA H A 104 LEU H 1.0 0.0 3.98 277 277 A 105 SER H A 106 THR H 1.0 0.0 2.55 278 278 A 109 ALA H A 110 ARG H 1.0 0.0 2.55 279 279 A 110 ARG H A 111 HIS H 1.0 0.0 4.72 280 280 A 112 TYR H A 111 HIS H 1.0 0.0 5.50 281 281 A 9 PHE H A 48 ILE H 1.0 0.0 5.34 282 282 A 13 ALA H A 15 GLU H 1.0 0.0 5.38 283 283 A 44 GLY H A 42 HIS H 1.0 0.0 4.63 284 284 A 49 ARG H A 51 LEU H 1.0 0.0 5.50 285 285 A 55 HIS H A 57 LEU H 1.0 0.0 5.13 286 286 A 77 GLN H A 79 VAL H 1.0 0.0 5.28 287 287 A 86 ALA H A 88 GLN H 1.0 0.0 5.25 288 288 A 89 ASN H A 91 TYR H 1.0 0.0 5.13 289 289 A 12 ILE H A 9 PHE HA 1.0 0.0 5.34 290 290 A 13 ALA H A 10 GLU HA 1.0 0.0 5.19 291 291 A 14 ARG H A 10 GLU HA 1.0 0.0 5.22 292 292 A 14 ARG H A 11 THR HA 1.0 0.0 5.28 293 293 A 16 TRP H A 13 ALA HA 1.0 0.0 4.97 294 294 A 17 HIS H A 14 ARG HA 1.0 0.0 5.10 295 295 A 18 GLU H A 14 ARG HA 1.0 0.0 4.91 296 296 A 44 GLY H A 42 HIS HA 1.0 0.0 4.23 297 297 A 50 GLN H A 51 LEU HB2 1.0 0.0 4.51 298 298 A 52 LYS HB2 A 55 HIS H 1.0 0.0 5.38 299 299 A 52 LYS HB3 A 55 HIS H 1.0 0.0 4.48 300 300 A 52 LYS HB3 A 56 LEU H 1.0 0.0 5.07 301 301 A 62 GLU H A 59 PRO HA 1.0 0.0 4.42 302 302 A 62 GLU H A 60 ILE HA 1.0 0.0 5.31 303 303 A 63 VAL H A 60 ILE HA 1.0 0.0 5.13 304 304 A 68 LYS H A 64 ASP HA 1.0 0.0 5.00 305 305 A 72 ALA H A 69 HIS HA 1.0 0.0 5.04 306 306 A 75 LEU H A 72 ALA HA 1.0 0.0 4.91 307 307 A 79 VAL H A 76 GLN HA 1.0 0.0 5.00 308 308 A 80 THR H A 77 GLN HA 1.0 0.0 5.07 309 309 A 86 ALA H A 83 MET HA 1.0 0.0 4.69 310 310 A 86 ALA H A 84 ARG HA 1.0 0.0 5.38 311 311 A 88 GLN H A 85 TYR HA 1.0 0.0 5.16 312 312 A 89 ASN H A 86 ALA HA 1.0 0.0 4.91 313 313 A 89 ASN H A 90 ASP HA 1.0 0.0 5.00 314 314 A 90 ASP H A 87 VAL HA 1.0 0.0 4.94 315 315 A 94 SER H A 92 ILE HB 1.0 0.0 4.26 316 316 A 100 MET H A 97 ALA HA 1.0 0.0 4.91 317 317 A 61 LYS H A 59 PRO HA 1.0 0.0 5.50 318 318 A 72 ALA H A 75 LEU HB2 1.0 0.0 5.50 319 319 A 35 LEU H A 32 LEU HA 1.0 0.0 5.28 320 320 A 2 GLU HGy A 3 ASN H 1.0 0.0 5.50 321 321 A 3 ASN H A 2 GLU HGx 1.0 0.0 5.50 322 322 A 10 GLU H A 9 PHE HD% 1.0 0.0 7.63 323 323 A 11 THR H A 10 GLU HGy 1.0 0.0 5.50 324 324 A 11 THR H A 10 GLU HGx 1.0 0.0 5.50 325 325 A 15 GLU H A 14 ARG HGy 1.0 0.0 5.50 326 326 A 15 GLU H A 14 ARG HGx 1.0 0.0 5.50 327 327 A 15 GLU H A 14 ARG HDy 1.0 0.0 5.50 328 328 A 15 GLU H A 14 ARG HDx 1.0 0.0 5.50 329 329 A 16 TRP H A 15 GLU HGy 1.0 0.0 4.66 330 330 A 16 TRP H A 15 GLU HGx 1.0 0.0 4.66 331 331 A 17 HIS H A 16 TRP HD1 1.0 0.0 5.50 332 332 A 17 HIS H A 16 TRP HE3 1.0 0.0 5.50 333 333 A 17 HIS H A 16 TRP HE1 1.0 0.0 5.50 334 334 A 17 HIS H A 16 TRP HZ2 1.0 0.0 5.50 335 335 A 17 HIS H A 16 TRP HH2 1.0 0.0 5.50 336 336 A 22 ARG H A 21 LYS HDy 1.0 0.0 4.66 337 337 A 22 ARG H A 21 LYS HDx 1.0 0.0 4.66 338 338 A 28 ARG H A 27 HIS HD2 1.0 0.0 5.50 339 339 A 29 SER H A 28 ARG HGy 1.0 0.0 5.50 340 340 A 29 SER H A 28 ARG HGx 1.0 0.0 5.50 341 341 A 31 VAL H A 30 ARG HGx 1.0 0.0 5.50 342 342 A 34 TYR H A 33 ARG HGx 1.0 0.0 5.50 343 343 A 34 TYR H A 33 ARG HGy 1.0 0.0 5.50 344 344 A 34 TYR H A 33 ARG HDx 1.0 0.0 5.38 345 345 A 34 TYR H A 33 ARG HDy 1.0 0.0 5.38 346 346 A 37 LEU H A 36 GLU HGy 1.0 0.0 5.50 347 347 A 37 LEU H A 36 GLU HGx 1.0 0.0 5.50 348 348 A 38 TYR H A 37 LEU HG 1.0 0.0 5.50 349 349 A 42 HIS H A 41 PRO HD3 1.0 0.0 5.07 350 350 A 52 LYS H A 51 LEU HG 1.0 0.0 5.50 351 351 A 53 THR H A 52 LYS HGx 1.0 0.0 5.50 352 352 A 56 LEU H A 55 HIS HD2 1.0 0.0 4.38 353 353 A 58 ALA H A 57 LEU HG 1.0 0.0 4.20 354 354 A 61 LYS H A 60 ILE HG1y 1.0 0.0 5.50 355 355 A 62 GLU H A 61 LYS HDy 1.0 0.0 5.50 356 356 A 62 GLU H A 61 LYS HDx 1.0 0.0 5.50 357 357 A 74 ARG H A 73 GLN HGy 1.0 0.0 4.54 358 358 A 74 ARG H A 73 GLN HGx 1.0 0.0 4.54 359 359 A 75 LEU H A 74 ARG HGy 1.0 0.0 5.50 360 360 A 75 LEU H A 74 ARG HGx 1.0 0.0 5.50 361 361 A 77 GLN H A 76 GLN HGy 1.0 0.0 4.07 362 362 A 77 GLN H A 76 GLN HGx 1.0 0.0 4.07 363 363 A 86 ALA H A 85 TYR HD% 1.0 0.0 7.63 364 364 A 93 ASP H A 92 ILE HG1y 1.0 0.0 5.50 365 365 A 93 ASP H A 92 ILE HG1x 1.0 0.0 5.50 366 366 A 97 ALA H A 96 PRO HDx 1.0 0.0 5.50 367 367 A 10 GLU H A 10 GLU HGy 1.0 0.0 5.50 368 368 A 10 GLU H A 10 GLU HGx 1.0 0.0 5.50 369 369 A 12 ILE H A 12 ILE HG1y 1.0 0.0 5.25 370 370 A 12 ILE H A 12 ILE HG1x 1.0 0.0 5.25 371 371 A 14 ARG H A 14 ARG HGy 1.0 0.0 5.47 372 372 A 14 ARG H A 14 ARG HGx 1.0 0.0 5.47 373 373 A 15 GLU H A 15 GLU HGx 1.0 0.0 5.50 374 374 A 17 HIS H A 17 HIS HD2 1.0 0.0 5.50 375 375 A 18 GLU H A 18 GLU HGy 1.0 0.0 4.85 376 376 A 18 GLU H A 18 GLU HGx 1.0 0.0 4.85 377 377 A 21 LYS H A 21 LYS HDy 1.0 0.0 5.50 378 378 A 21 LYS H A 21 LYS HDx 1.0 0.0 5.50 379 379 A 22 ARG H A 22 ARG HGy 1.0 0.0 5.50 380 380 A 28 ARG H A 28 ARG HGy 1.0 0.0 5.50 381 381 A 28 ARG H A 28 ARG HGx 1.0 0.0 5.50 382 382 A 33 ARG H A 33 ARG HGx 1.0 0.0 5.50 383 383 A 33 ARG H A 33 ARG HGy 1.0 0.0 5.50 384 384 A 35 LEU H A 35 LEU HG 1.0 0.0 5.00 385 385 A 36 GLU H A 36 GLU HGy 1.0 0.0 5.50 386 386 A 43 ILE H A 43 ILE HG1y 1.0 0.0 5.50 387 387 A 48 ILE H A 48 ILE HG1y 1.0 0.0 5.50 388 388 A 49 ARG H A 49 ARG HGy 1.0 0.0 5.50 389 389 A 49 ARG H A 49 ARG HGx 1.0 0.0 5.50 390 390 A 50 GLN H A 50 GLN HGx 1.0 0.0 4.97 391 391 A 50 GLN H A 50 GLN HGy 1.0 0.0 4.97 392 392 A 52 LYS H A 52 LYS HGx 1.0 0.0 5.50 393 393 A 55 HIS H A 55 HIS HD2 1.0 0.0 2.99 394 394 A 56 LEU H A 56 LEU HG 1.0 0.0 4.57 395 395 A 60 ILE H A 60 ILE HG1y 1.0 0.0 5.25 396 396 A 60 ILE H A 60 ILE HG1x 1.0 0.0 5.25 397 397 A 61 LYS H A 61 LYS HGy 1.0 0.0 5.50 398 398 A 61 LYS H A 61 LYS HDy 1.0 0.0 5.50 399 399 A 61 LYS H A 61 LYS HDx 1.0 0.0 5.50 400 400 A 62 GLU H A 62 GLU HGy 1.0 0.0 5.16 401 401 A 62 GLU H A 62 GLU HGx 1.0 0.0 5.16 402 402 A 68 LYS H A 68 LYS HGy 1.0 0.0 4.88 403 403 A 68 LYS H A 68 LYS HGx 1.0 0.0 4.88 404 404 A 73 GLN H A 73 GLN HGy 1.0 0.0 5.04 405 405 A 73 GLN H A 73 GLN HGx 1.0 0.0 5.04 406 406 A 75 LEU H A 75 LEU HG 1.0 0.0 4.26 407 407 A 76 GLN H A 76 GLN HGy 1.0 0.0 4.17 408 408 A 76 GLN H A 76 GLN HGx 1.0 0.0 4.17 409 409 A 77 GLN H A 77 GLN HGy 1.0 0.0 5.22 410 410 A 77 GLN H A 77 GLN HGx 1.0 0.0 5.22 411 411 A 82 ILE H A 82 ILE HG1y 1.0 0.0 5.50 412 412 A 84 ARG H A 84 ARG HGx 1.0 0.0 5.50 413 413 A 88 GLN H A 88 GLN HGy 1.0 0.0 5.47 414 414 A 88 GLN H A 88 GLN HGx 1.0 0.0 5.47 415 415 A 89 ASN H A 89 ASN HD2y 1.0 0.0 5.50 416 416 A 89 ASN H A 89 ASN HD2x 1.0 0.0 5.50 417 417 A 92 ILE H A 92 ILE HG1y 1.0 0.0 5.50 418 418 A 92 ILE H A 92 ILE HG1x 1.0 0.0 5.50 419 419 A 95 ASN H A 95 ASN HD2y 1.0 0.0 5.50 420 420 A 95 ASN H A 95 ASN HD2x 1.0 0.0 5.50 421 421 A 100 MET H A 100 MET HGy 1.0 0.0 5.44 422 422 A 100 MET H A 100 MET HGx 1.0 0.0 5.44 423 423 A 104 LEU H A 104 LEU HG 1.0 0.0 5.04 424 424 A 108 LYS H A 108 LYS HGy 1.0 0.0 5.44 425 425 A 108 LYS H A 108 LYS HGx 1.0 0.0 5.44 426 426 A 3 ASN HA A 3 ASN HD2y 1.0 0.0 4.35 427 427 A 3 ASN HA A 3 ASN HD2x 1.0 0.0 4.35 428 428 A 16 TRP H A 16 TRP HD1 1.0 0.0 5.50 429 429 A 86 ALA H A 91 TYR HD% 1.0 0.0 7.63 430 430 A 53 THR H A 96 PRO HB2 1.0 0.0 5.50 431 431 A 73 GLN HE2y A 73 GLN HBy 1.0 0.0 5.50 432 432 A 73 GLN HE2x A 73 GLN HBy 1.0 0.0 5.50 433 433 A 94 SER H A 92 ILE HG1y 1.0 0.0 5.50 434 434 A 84 ARG HA A 95 ASN HD2x 1.0 0.0 5.50 435 435 A 16 TRP HE1 A 85 TYR HD% 1.0 0.0 7.63 436 436 A 73 GLN HE2y A 73 GLN HBx 1.0 0.0 5.50 437 437 A 104 LEU HG A 73 GLN HE2y 1.0 0.0 5.50 438 438 A 73 GLN HE2x A 73 GLN HBx 1.0 0.0 5.50 439 439 A 104 LEU HG A 73 GLN HE2x 1.0 0.0 5.50 440 440 A 74 ARG H A 74 ARG HDy 1.0 0.0 5.50 441 441 A 74 ARG H A 74 ARG HDx 1.0 0.0 5.50 442 442 A 94 SER H A 92 ILE HG1x 1.0 0.0 5.50 443 443 A 58 ALA H A 59 PRO HDx 1.0 0.0 4.85 444 444 A 58 ALA H A 59 PRO HDy 1.0 0.0 4.85 445 445 A 12 ILE H A 11 THR HG2% 1.0 0.0 6.39 446 446 A 38 TYR H A 37 LEU HDx% 1.0 0.0 6.52 447 447 A 38 TYR H A 37 LEU HDy% 1.0 0.0 6.52 448 448 A 44 GLY H A 43 ILE HD1% 1.0 0.0 6.52 449 449 A 57 LEU H A 56 LEU HDx% 1.0 0.0 6.52 450 450 A 61 LYS H A 60 ILE HG2% 1.0 0.0 6.49 451 451 A 72 ALA H A 71 VAL HGx% 1.0 0.0 6.46 452 452 A 72 ALA H A 71 VAL HGy% 1.0 0.0 6.46 453 453 A 88 GLN H A 87 VAL HGx% 1.0 0.0 5.87 454 454 A 88 GLN H A 87 VAL HGy% 1.0 0.0 5.87 455 455 A 93 ASP H A 92 ILE HD1% 1.0 0.0 6.52 456 456 A 107 THR H A 106 THR HG2% 1.0 0.0 6.46 457 457 A 8 THR H A 8 THR HG2% 1.0 0.0 4.91 458 458 A 37 LEU H A 37 LEU HDx% 1.0 0.0 6.52 459 459 A 56 LEU H A 56 LEU HDx% 1.0 0.0 6.52 460 460 A 57 LEU H A 57 LEU HDx% 1.0 0.0 5.74 461 461 A 57 LEU H A 57 LEU HDy% 1.0 0.0 5.74 462 462 A 82 ILE H A 82 ILE HD1% 1.0 0.0 6.40 463 463 A 92 ILE H A 92 ILE HD1% 1.0 0.0 5.84 464 464 A 104 LEU H A 104 LEU HDx% 1.0 0.0 6.43 465 465 A 104 LEU H A 104 LEU HDy% 1.0 0.0 6.43 466 466 A 9 PHE H A 48 ILE HD1% 1.0 0.0 6.52 467 467 A 13 ALA H A 82 ILE HG2% 1.0 0.0 6.52 468 468 A 16 TRP HE1 A 81 ALA HB% 1.0 0.0 5.46 469 469 A 46 SER H A 43 ILE HG2% 1.0 0.0 6.52 470 470 A 50 GLN H A 92 ILE HG2% 1.0 0.0 6.52 471 471 A 55 HIS H A 100 MET HE% 1.0 0.0 6.52 472 472 A 64 ASP H A 60 ILE HG2% 1.0 0.0 6.52 473 473 A 73 GLN HE2y A 104 LEU HDx% 1.0 0.0 6.52 474 474 A 73 GLN HE2x A 104 LEU HDx% 1.0 0.0 6.52 475 475 A 75 LEU H A 60 ILE HG2% 1.0 0.0 6.52 476 476 A 76 GLN H A 60 ILE HG2% 1.0 0.0 6.27 477 477 A 86 ALA H A 48 ILE HD1% 1.0 0.0 6.52 478 478 A 86 ALA H A 12 ILE HG2% 1.0 0.0 6.52 479 479 A 87 VAL H A 83 MET HE% 1.0 0.0 6.52 480 480 A 90 ASP H A 87 VAL HGx% 1.0 0.0 6.52 481 481 A 91 TYR H A 87 VAL HGx% 1.0 0.0 6.52 482 482 A 94 SER H A 92 ILE HD1% 1.0 0.0 6.52 483 483 A 73 GLN HE2y A 104 LEU HDy% 1.0 0.0 6.52 484 484 A 73 GLN HE2x A 104 LEU HDy% 1.0 0.0 6.52 485 485 A 86 ALA H A 92 ILE HD1% 1.0 0.0 6.52 486 486 A 90 ASP H A 87 VAL HGy% 1.0 0.0 6.52 487 487 A 91 TYR H A 87 VAL HGy% 1.0 0.0 6.52 488 488 A 15 GLU H A 15 GLU HBy 1.0 0.0 3.98 489 489 A 18 GLU H A 18 GLU HBy 1.0 0.0 3.76 490 490 A 18 GLU H A 18 GLU HBx 1.0 0.0 3.76 491 491 A 25 GLU H A 25 GLU HBy 1.0 0.0 3.79 492 492 A 25 GLU H A 25 GLU HBx 1.0 0.0 3.79 493 493 A 26 ASP H A 26 ASP HBy 1.0 0.0 4.04 494 494 A 26 ASP H A 26 ASP HBx 1.0 0.0 4.04 495 495 A 31 VAL H A 31 VAL HB 1.0 0.0 4.04 496 496 A 61 LYS H A 61 LYS HBx 1.0 0.0 3.83 497 497 A 63 VAL H A 63 VAL HB 1.0 0.0 3.73 498 498 A 73 GLN H A 73 GLN HBy 1.0 0.0 3.36 499 499 A 73 GLN H A 73 GLN HBx 1.0 0.0 3.36 500 500 A 82 ILE H A 82 ILE HB 1.0 0.0 3.79 501 501 A 88 GLN H A 88 GLN HBx 1.0 0.0 3.98 502 502 A 3 ASN H A 2 GLU HBy 1.0 0.0 5.50 503 503 A 3 ASN H A 2 GLU HBx 1.0 0.0 5.50 504 504 A 8 THR H A 7 TYR HBy 1.0 0.0 5.50 505 505 A 8 THR H A 7 TYR HBx 1.0 0.0 5.50 506 506 A 17 HIS H A 16 TRP HBy 1.0 0.0 5.50 507 507 A 18 GLU H A 17 HIS HBy 1.0 0.0 4.76 508 508 A 18 GLU H A 17 HIS HBx 1.0 0.0 4.76 509 509 A 19 SER HBy A 20 ASN H 1.0 0.0 5.50 510 510 A 19 SER HBx A 20 ASN H 1.0 0.0 5.50 511 511 A 21 LYS H A 20 ASN HBy 1.0 0.0 5.50 512 512 A 21 LYS H A 20 ASN HBx 1.0 0.0 5.50 513 513 A 22 ARG H A 21 LYS HBy 1.0 0.0 5.04 514 514 A 23 TRP H A 22 ARG HBy 1.0 0.0 5.07 515 515 A 23 TRP HBy A 24 SER H 1.0 0.0 5.38 516 516 A 24 SER H A 23 TRP HBx 1.0 0.0 5.38 517 517 A 26 ASP H A 25 GLU HBy 1.0 0.0 4.32 518 518 A 26 ASP H A 25 GLU HBx 1.0 0.0 4.32 519 519 A 27 HIS H A 26 ASP HBy 1.0 0.0 4.66 520 520 A 27 HIS H A 26 ASP HBx 1.0 0.0 4.66 521 521 A 30 ARG H A 29 SER HBy 1.0 0.0 5.50 522 522 A 30 ARG H A 29 SER HBx 1.0 0.0 5.50 523 523 A 32 LEU H A 31 VAL HB 1.0 0.0 4.97 524 524 A 35 LEU H A 34 TYR HB3 1.0 0.0 4.94 525 525 A 37 LEU H A 36 GLU HBy 1.0 0.0 4.66 526 526 A 37 LEU H A 36 GLU HBx 1.0 0.0 4.66 527 527 A 38 TYR H A 37 LEU HBy 1.0 0.0 4.69 528 528 A 38 TYR H A 37 LEU HBx 1.0 0.0 4.69 529 529 A 39 ILE H A 38 TYR HBx 1.0 0.0 5.28 530 530 A 47 ASP H A 46 SER HBy 1.0 0.0 5.50 531 531 A 47 ASP HBy A 48 ILE H 1.0 0.0 5.50 532 532 A 47 ASP HBx A 48 ILE H 1.0 0.0 5.50 533 533 A 51 LEU H A 50 GLN HBy 1.0 0.0 5.50 534 534 A 65 THR H A 64 ASP HB3 1.0 0.0 4.76 535 535 A 67 GLY H A 66 SER HBy 1.0 0.0 5.50 536 536 A 74 ARG H A 73 GLN HBy 1.0 0.0 3.36 537 537 A 74 ARG H A 73 GLN HBx 1.0 0.0 3.36 538 538 A 78 ARG H A 77 GLN HBx 1.0 0.0 4.42 539 539 A 79 VAL H A 78 ARG HBy 1.0 0.0 3.86 540 540 A 79 VAL H A 78 ARG HBx 1.0 0.0 3.86 541 541 A 85 TYR H A 84 ARG HBy 1.0 0.0 4.29 542 542 A 85 TYR H A 84 ARG HBx 1.0 0.0 4.29 543 543 A 93 ASP H A 92 ILE HB 1.0 0.0 4.11 544 544 A 100 MET H A 99 ASP HBy 1.0 0.0 5.00 545 545 A 110 ARG HBy A 111 HIS H 1.0 0.0 5.50 546 546 A 110 ARG HBx A 111 HIS H 1.0 0.0 5.50 547 547 A 112 TYR H A 111 HIS HBx 1.0 0.0 4.94 548 548 A 115 GLU H A 114 LEU HA 1.0 0.0 3.55 549 549 A 115 GLU H A 114 LEU HBy 1.0 0.0 4.69 550 550 A 115 GLU H A 114 LEU HBx 1.0 0.0 4.69 551 551 A 15 GLU H A 12 ILE HA 1.0 0.0 4.42 552 552 A 15 GLU H A 13 ALA HA 1.0 0.0 5.16 553 553 A 51 LEU H A 48 ILE HA 1.0 0.0 5.07 554 554 A 60 ILE H A 57 LEU HA 1.0 0.0 4.69 555 555 A 61 LYS H A 58 ALA HA 1.0 0.0 4.88 556 556 A 92 ILE H A 87 VAL HA 1.0 0.0 4.26 557 557 A 59 PRO HB3 A 61 LYS H 1.0 0.0 5.41 558 558 A 76 GLN H A 73 GLN HA 1.0 0.0 4.45 559 559 A 73 GLN H A 70 ASP HA 1.0 0.0 4.72 560 560 A 74 ARG H A 71 VAL HA 1.0 0.0 4.48 561 561 A 78 ARG H A 75 LEU HA 1.0 0.0 4.91 562 562 A 82 ILE H A 78 ARG HA 1.0 0.0 4.79 563 563 A 87 VAL H A 84 ARG HA 1.0 0.0 4.57 564 564 A 88 GLN H A 86 ALA HA 1.0 0.0 4.76 565 565 A 89 ASN H A 88 GLN HBx 1.0 0.0 4.60 566 566 A 12 ILE HB A 9 PHE HA 1.0 0.0 4.69 567 567 A 11 THR HA A 14 ARG HBy 1.0 0.0 5.50 568 568 A 15 GLU HBy A 12 ILE HA 1.0 0.0 4.51 569 569 A 15 GLU HBx A 12 ILE HA 1.0 0.0 4.51 570 570 A 14 ARG HA A 17 HIS HBy 1.0 0.0 5.50 571 571 A 39 ILE HB A 35 LEU HA 1.0 0.0 4.23 572 572 A 87 VAL HB A 84 ARG HA 1.0 0.0 4.11 573 573 A 60 ILE HB A 57 LEU HA 1.0 0.0 3.89 574 574 A 58 ALA HA A 61 LYS HBy 1.0 0.0 4.51 575 575 A 63 VAL HB A 60 ILE HA 1.0 0.0 4.54 576 576 A 58 ALA HA A 61 LYS HBx 1.0 0.0 4.51 577 577 A 71 VAL HA A 74 ARG HBy 1.0 0.0 4.48 578 578 A 71 VAL HA A 74 ARG HBx 1.0 0.0 4.48 579 579 A 75 LEU HB2 A 72 ALA HA 1.0 0.0 4.32 580 580 A 70 ASP HA A 73 GLN HBy 1.0 0.0 4.91 581 581 A 76 GLN HB2 A 73 GLN HA 1.0 0.0 4.54 582 582 A 85 TYR HA A 88 GLN HBy 1.0 0.0 4.35 583 583 A 85 TYR HA A 88 GLN HBx 1.0 0.0 4.35 584 584 A 74 ARG H A 70 ASP HA 1.0 0.0 5.50 585 585 A 91 TYR H A 86 ALA HA 1.0 0.0 5.34 586 586 A 11 THR HA A 14 ARG HBx 1.0 0.0 5.50 587 587 A 14 ARG HA A 17 HIS HBx 1.0 0.0 5.50 588 588 A 70 ASP HA A 73 GLN HBx 1.0 0.0 4.91 589 589 A 82 ILE HB A 79 VAL HA 1.0 0.0 4.85 590 590 A 87 VAL HB A 88 GLN HA 1.0 0.0 5.13 591 591 A 14 ARG HA A 14 ARG HDy 1.0 0.0 5.50 592 592 A 14 ARG HA A 14 ARG HDx 1.0 0.0 5.50 593 593 A 15 GLU H A 15 GLU HGy 1.0 0.0 5.50 594 594 A 16 TRP HD1 A 16 TRP HA 1.0 0.0 5.50 595 595 A 17 HIS HD2 A 17 HIS HA 1.0 0.0 5.50 596 596 A 21 LYS HA A 21 LYS HDy 1.0 0.0 5.50 597 597 A 21 LYS HA A 21 LYS HDx 1.0 0.0 5.50 598 598 A 21 LYS H A 21 LYS HGy 1.0 0.0 5.50 599 599 A 21 LYS H A 21 LYS HGx 1.0 0.0 5.50 600 600 A 21 LYS HDy A 21 LYS HBx 1.0 0.0 4.16 601 601 A 21 LYS HBx A 21 LYS HDx 1.0 0.0 4.16 602 602 A 21 LYS HA A 21 LYS HEy 1.0 0.0 5.50 603 603 A 21 LYS HEy A 21 LYS HBy 1.0 0.0 5.50 604 604 A 21 LYS HEy A 21 LYS HBx 1.0 0.0 5.50 605 605 A 21 LYS HA A 21 LYS HEx 1.0 0.0 5.50 606 606 A 21 LYS HEx A 21 LYS HBy 1.0 0.0 5.50 607 607 A 21 LYS HEx A 21 LYS HBx 1.0 0.0 5.50 608 608 A 22 ARG H A 22 ARG HGx 1.0 0.0 5.50 609 609 A 22 ARG HA A 22 ARG HDx 1.0 0.0 5.50 610 610 A 22 ARG HA A 22 ARG HDy 1.0 0.0 5.50 611 611 A 23 TRP H A 23 TRP HD1 1.0 0.0 5.50 612 612 A 23 TRP HD1 A 23 TRP HA 1.0 0.0 5.50 613 613 A 23 TRP H A 23 TRP HZ2 1.0 0.0 5.50 614 614 A 23 TRP H A 23 TRP HH2 1.0 0.0 5.50 615 615 A 25 GLU H A 25 GLU HGy 1.0 0.0 5.50 616 616 A 25 GLU H A 25 GLU HGx 1.0 0.0 5.50 617 617 A 28 ARG HA A 28 ARG HDx 1.0 0.0 5.50 618 618 A 28 ARG HA A 28 ARG HDy 1.0 0.0 5.50 619 619 A 30 ARG H A 30 ARG HDx 1.0 0.0 5.50 620 620 A 30 ARG HDx A 30 ARG HA 1.0 0.0 5.50 621 621 A 30 ARG H A 30 ARG HDy 1.0 0.0 5.50 622 622 A 30 ARG HA A 30 ARG HDy 1.0 0.0 5.50 623 623 A 32 LEU H A 32 LEU HG 1.0 0.0 5.50 624 624 A 33 ARG H A 33 ARG HDx 1.0 0.0 5.50 625 625 A 33 ARG HDx A 33 ARG HA 1.0 0.0 5.50 626 626 A 33 ARG H A 33 ARG HDy 1.0 0.0 5.50 627 627 A 33 ARG HDy A 33 ARG HA 1.0 0.0 5.50 628 628 A 34 TYR H A 34 TYR HE% 1.0 0.0 7.63 629 629 A 36 GLU H A 36 GLU HGx 1.0 0.0 5.50 630 630 A 37 LEU H A 37 LEU HG 1.0 0.0 5.50 631 631 A 39 ILE H A 39 ILE HG1y 1.0 0.0 5.50 632 632 A 39 ILE H A 39 ILE HG1x 1.0 0.0 5.50 633 633 A 42 HIS H A 42 HIS HD2 1.0 0.0 5.22 634 634 A 42 HIS HA A 42 HIS HD2 1.0 0.0 5.50 635 635 A 43 ILE H A 43 ILE HG1x 1.0 0.0 5.50 636 636 A 48 ILE H A 48 ILE HG1x 1.0 0.0 5.50 637 637 A 49 ARG HA A 49 ARG HDy 1.0 0.0 5.50 638 638 A 49 ARG HA A 49 ARG HDx 1.0 0.0 5.50 639 639 A 50 GLN HA A 50 GLN HE2y 1.0 0.0 5.50 640 640 A 50 GLN HA A 50 GLN HE2x 1.0 0.0 5.50 641 641 A 50 GLN HBy A 50 GLN HE2y 1.0 0.0 5.50 642 642 A 50 GLN HBy A 50 GLN HE2x 1.0 0.0 5.50 643 643 A 50 GLN HBx A 50 GLN HE2y 1.0 0.0 5.50 644 644 A 50 GLN HBx A 50 GLN HE2x 1.0 0.0 5.50 645 645 A 51 LEU H A 51 LEU HG 1.0 0.0 5.50 646 646 A 52 LYS H A 52 LYS HGy 1.0 0.0 5.50 647 647 A 52 LYS H A 52 LYS HDy 1.0 0.0 5.50 648 648 A 52 LYS HA A 52 LYS HDy 1.0 0.0 5.50 649 649 A 52 LYS H A 52 LYS HDx 1.0 0.0 5.50 650 650 A 52 LYS HA A 52 LYS HDx 1.0 0.0 5.50 651 651 A 52 LYS HA A 52 LYS HEy 1.0 0.0 5.47 652 652 A 52 LYS HB2 A 52 LYS HEy 1.0 0.0 5.50 653 653 A 52 LYS HB3 A 52 LYS HEy 1.0 0.0 5.50 654 654 A 52 LYS HA A 52 LYS HEx 1.0 0.0 5.47 655 655 A 52 LYS HB2 A 52 LYS HEx 1.0 0.0 5.50 656 656 A 52 LYS HB3 A 52 LYS HEx 1.0 0.0 5.50 657 657 A 55 HIS HD2 A 55 HIS HA 1.0 0.0 5.50 658 658 A 57 LEU H A 57 LEU HG 1.0 0.0 5.50 659 659 A 61 LYS H A 61 LYS HGx 1.0 0.0 5.50 660 660 A 61 LYS HA A 61 LYS HDy 1.0 0.0 5.50 661 661 A 61 LYS HA A 61 LYS HDx 1.0 0.0 5.50 662 662 A 61 LYS HA A 61 LYS HEy 1.0 0.0 5.50 663 663 A 61 LYS HBy A 61 LYS HEy 1.0 0.0 5.50 664 664 A 61 LYS HEy A 61 LYS HBx 1.0 0.0 5.50 665 665 A 61 LYS HA A 61 LYS HEx 1.0 0.0 5.50 666 666 A 61 LYS HBy A 61 LYS HEx 1.0 0.0 5.50 667 667 A 61 LYS HBx A 61 LYS HEx 1.0 0.0 5.50 668 668 A 68 LYS H A 68 LYS HDx 1.0 0.0 5.50 669 669 A 68 LYS HA A 68 LYS HDx 1.0 0.0 5.50 670 670 A 68 LYS H A 68 LYS HDy 1.0 0.0 5.50 671 671 A 68 LYS HA A 68 LYS HDy 1.0 0.0 5.50 672 672 A 68 LYS H A 68 LYS HEx 1.0 0.0 5.50 673 673 A 68 LYS HA A 68 LYS HEx 1.0 0.0 5.50 674 674 A 68 LYS HBy A 68 LYS HEx 1.0 0.0 5.50 675 675 A 68 LYS HEx A 68 LYS HBx 1.0 0.0 5.50 676 676 A 68 LYS H A 68 LYS HEy 1.0 0.0 5.50 677 677 A 68 LYS HA A 68 LYS HEy 1.0 0.0 5.50 678 678 A 68 LYS HBy A 68 LYS HEy 1.0 0.0 5.50 679 679 A 68 LYS HBx A 68 LYS HEy 1.0 0.0 5.50 680 680 A 74 ARG H A 74 ARG HGy 1.0 0.0 5.50 681 681 A 74 ARG H A 74 ARG HGx 1.0 0.0 5.50 682 682 A 74 ARG HDy A 74 ARG HA 1.0 0.0 5.50 683 683 A 74 ARG HDx A 74 ARG HA 1.0 0.0 5.50 684 684 A 76 GLN HB2 A 76 GLN HGy 1.0 0.0 2.99 685 685 A 76 GLN HB2 A 76 GLN HGx 1.0 0.0 2.99 686 686 A 78 ARG H A 78 ARG HGy 1.0 0.0 5.50 687 687 A 78 ARG H A 78 ARG HGx 1.0 0.0 5.50 688 688 A 78 ARG HA A 78 ARG HDy 1.0 0.0 5.50 689 689 A 78 ARG HA A 78 ARG HDx 1.0 0.0 5.50 690 690 A 82 ILE H A 82 ILE HG1x 1.0 0.0 5.50 691 691 A 83 MET H A 83 MET HGy 1.0 0.0 5.50 692 692 A 83 MET H A 83 MET HGx 1.0 0.0 5.50 693 693 A 84 ARG H A 84 ARG HGy 1.0 0.0 5.50 694 694 A 84 ARG HA A 84 ARG HDy 1.0 0.0 5.50 695 695 A 84 ARG HA A 84 ARG HDx 1.0 0.0 5.50 696 696 A 85 TYR H A 85 TYR HE% 1.0 0.0 7.63 697 697 A 89 ASN HD2y A 89 ASN HA 1.0 0.0 5.50 698 698 A 89 ASN HD2x A 89 ASN HA 1.0 0.0 5.50 699 699 A 108 LYS H A 108 LYS HDy 1.0 0.0 5.50 700 700 A 108 LYS HA A 108 LYS HDy 1.0 0.0 5.50 701 701 A 108 LYS H A 108 LYS HDx 1.0 0.0 5.50 702 702 A 108 LYS HA A 108 LYS HDx 1.0 0.0 5.50 703 703 A 108 LYS H A 108 LYS HEx 1.0 0.0 5.50 704 704 A 108 LYS HA A 108 LYS HEx 1.0 0.0 5.50 705 705 A 108 LYS HEx A 108 LYS HBy 1.0 0.0 5.50 706 706 A 108 LYS HEx A 108 LYS HBx 1.0 0.0 5.50 707 707 A 108 LYS H A 108 LYS HEy 1.0 0.0 5.50 708 708 A 108 LYS HA A 108 LYS HEy 1.0 0.0 5.50 709 709 A 108 LYS HEy A 108 LYS HBy 1.0 0.0 5.50 710 710 A 108 LYS HEy A 108 LYS HBx 1.0 0.0 5.50 711 711 A 110 ARG H A 110 ARG HGy 1.0 0.0 5.50 712 712 A 110 ARG H A 110 ARG HGx 1.0 0.0 5.50 713 713 A 110 ARG H A 110 ARG HDy 1.0 0.0 5.50 714 714 A 110 ARG HDy A 110 ARG HA 1.0 0.0 5.50 715 715 A 110 ARG H A 110 ARG HDx 1.0 0.0 5.50 716 716 A 110 ARG HA A 110 ARG HDx 1.0 0.0 5.50 717 717 A 111 HIS H A 111 HIS HD2 1.0 0.0 5.50 718 718 A 111 HIS HD2 A 111 HIS HA 1.0 0.0 5.50 719 719 A 112 TYR H A 112 TYR HE% 1.0 0.0 7.63 720 720 A 114 LEU H A 114 LEU HG 1.0 0.0 5.50 721 721 A 115 GLU H A 115 GLU HGy 1.0 0.0 5.50 722 722 A 115 GLU H A 115 GLU HGx 1.0 0.0 5.50 723 723 A 13 ALA H A 12 ILE HG1y 1.0 0.0 5.50 724 724 A 13 ALA H A 12 ILE HG1x 1.0 0.0 5.50 725 725 A 19 SER H A 18 GLU HGy 1.0 0.0 5.50 726 726 A 19 SER H A 18 GLU HGx 1.0 0.0 5.50 727 727 A 22 ARG H A 21 LYS HGy 1.0 0.0 5.50 728 728 A 22 ARG H A 21 LYS HGx 1.0 0.0 5.50 729 729 A 23 TRP H A 22 ARG HGy 1.0 0.0 5.50 730 730 A 23 TRP H A 22 ARG HGx 1.0 0.0 5.50 731 731 A 23 TRP H A 22 ARG HDx 1.0 0.0 5.50 732 732 A 23 TRP H A 22 ARG HDy 1.0 0.0 5.50 733 733 A 26 ASP H A 25 GLU HGy 1.0 0.0 5.50 734 734 A 26 ASP H A 25 GLU HGx 1.0 0.0 5.50 735 735 A 31 VAL H A 30 ARG HGy 1.0 0.0 5.50 736 736 A 31 VAL H A 30 ARG HDx 1.0 0.0 5.50 737 737 A 31 VAL H A 30 ARG HDy 1.0 0.0 5.50 738 738 A 33 ARG H A 32 LEU HG 1.0 0.0 5.50 739 739 A 35 LEU H A 34 TYR HD% 1.0 0.0 7.63 740 740 A 35 LEU H A 34 TYR HE% 1.0 0.0 7.63 741 741 A 36 GLU H A 35 LEU HG 1.0 0.0 5.50 742 742 A 39 ILE H A 38 TYR HD% 1.0 0.0 7.63 743 743 A 40 PHE H A 39 ILE HG1y 1.0 0.0 5.50 744 744 A 40 PHE H A 39 ILE HG1x 1.0 0.0 5.50 745 745 A 42 HIS H A 41 PRO HD2 1.0 0.0 5.50 746 746 A 42 HIS H A 41 PRO HGy 1.0 0.0 5.50 747 747 A 42 HIS H A 41 PRO HGx 1.0 0.0 5.50 748 748 A 44 GLY H A 43 ILE HG1y 1.0 0.0 5.50 749 749 A 44 GLY H A 43 ILE HG1x 1.0 0.0 5.50 750 750 A 49 ARG H A 48 ILE HG1y 1.0 0.0 5.50 751 751 A 49 ARG H A 48 ILE HG1x 1.0 0.0 5.50 752 752 A 51 LEU H A 50 GLN HGx 1.0 0.0 5.50 753 753 A 51 LEU H A 50 GLN HGy 1.0 0.0 5.50 754 754 A 53 THR H A 52 LYS HGy 1.0 0.0 5.50 755 755 A 53 THR H A 52 LYS HDy 1.0 0.0 5.50 756 756 A 53 THR H A 52 LYS HDx 1.0 0.0 5.50 757 757 A 57 LEU H A 56 LEU HG 1.0 0.0 5.50 758 758 A 61 LYS H A 60 ILE HG1x 1.0 0.0 5.50 759 759 A 62 GLU H A 61 LYS HGy 1.0 0.0 5.50 760 760 A 62 GLU H A 61 LYS HGx 1.0 0.0 5.50 761 761 A 63 VAL H A 62 GLU HGy 1.0 0.0 5.50 762 762 A 63 VAL H A 62 GLU HGx 1.0 0.0 5.50 763 763 A 69 HIS H A 68 LYS HGy 1.0 0.0 5.50 764 764 A 69 HIS H A 68 LYS HGx 1.0 0.0 5.50 765 765 A 69 HIS H A 68 LYS HEx 1.0 0.0 5.50 766 766 A 69 HIS H A 68 LYS HEy 1.0 0.0 5.50 767 767 A 76 GLN H A 75 LEU HG 1.0 0.0 5.50 768 768 A 78 ARG H A 77 GLN HGy 1.0 0.0 5.50 769 769 A 78 ARG H A 77 GLN HGx 1.0 0.0 5.50 770 770 A 79 VAL H A 78 ARG HGy 1.0 0.0 5.50 771 771 A 79 VAL H A 78 ARG HGx 1.0 0.0 5.50 772 772 A 84 ARG H A 83 MET HGy 1.0 0.0 5.50 773 773 A 84 ARG H A 83 MET HGx 1.0 0.0 5.50 774 774 A 85 TYR H A 84 ARG HGy 1.0 0.0 5.50 775 775 A 85 TYR H A 84 ARG HGx 1.0 0.0 5.50 776 776 A 89 ASN H A 88 GLN HGy 1.0 0.0 5.50 777 777 A 89 ASN H A 88 GLN HGx 1.0 0.0 5.50 778 778 A 92 ILE H A 91 TYR HD% 1.0 0.0 7.63 779 779 A 97 ALA H A 96 PRO HDy 1.0 0.0 5.50 780 780 A 97 ALA H A 96 PRO HGy 1.0 0.0 5.50 781 781 A 97 ALA H A 96 PRO HGx 1.0 0.0 5.50 782 782 A 101 ALA H A 100 MET HGy 1.0 0.0 5.50 783 783 A 101 ALA H A 100 MET HGx 1.0 0.0 5.50 784 784 A 105 SER H A 104 LEU HG 1.0 0.0 5.50 785 785 A 109 ALA H A 108 LYS HGy 1.0 0.0 5.50 786 786 A 109 ALA H A 108 LYS HGx 1.0 0.0 5.50 787 787 A 109 ALA H A 108 LYS HDy 1.0 0.0 5.50 788 788 A 109 ALA H A 108 LYS HDx 1.0 0.0 5.50 789 789 A 109 ALA H A 108 LYS HEx 1.0 0.0 5.50 790 790 A 109 ALA H A 108 LYS HEy 1.0 0.0 5.50 791 791 A 111 HIS H A 110 ARG HGy 1.0 0.0 5.50 792 792 A 111 HIS H A 110 ARG HGx 1.0 0.0 5.50 793 793 A 111 HIS H A 110 ARG HDy 1.0 0.0 5.50 794 794 A 111 HIS H A 110 ARG HDx 1.0 0.0 5.50 795 795 A 112 TYR H A 111 HIS HD2 1.0 0.0 5.50 796 796 A 114 LEU H A 113 PRO HDy 1.0 0.0 5.50 797 797 A 114 LEU H A 113 PRO HDx 1.0 0.0 5.50 798 798 A 114 LEU H A 113 PRO HGy 1.0 0.0 5.50 799 799 A 114 LEU H A 113 PRO HGx 1.0 0.0 5.50 800 800 A 115 GLU H A 114 LEU HG 1.0 0.0 5.50 801 801 A 9 PHE HE% A 10 GLU HGy 1.0 0.0 7.63 802 802 A 85 TYR H A 16 TRP HD1 1.0 0.0 5.50 803 803 A 40 PHE HD% A 36 GLU HGy 1.0 0.0 7.63 804 804 A 34 TYR HD% A 37 LEU HBy 1.0 0.0 7.63 805 805 A 34 TYR HD% A 37 LEU HBx 1.0 0.0 7.63 806 806 A 40 PHE H A 41 PRO HD2 1.0 0.0 5.50 807 807 A 40 PHE H A 41 PRO HD3 1.0 0.0 5.50 808 808 A 38 TYR HE% A 37 LEU HBy 1.0 0.0 7.63 809 809 A 84 ARG HA A 95 ASN HD2y 1.0 0.0 5.50 810 810 A 16 TRP HD1 A 85 TYR HBy 1.0 0.0 5.50 811 811 A 89 ASN HD2y A 88 GLN HBx 1.0 0.0 7.23 812 812 A 89 ASN HD2x A 88 GLN HBy 1.0 0.0 7.23 813 813 A 73 GLN HE2y A 101 ALA HA 1.0 0.0 5.50 814 814 A 73 GLN HE2x A 101 ALA HA 1.0 0.0 5.50 815 815 A 48 ILE HB A 9 PHE HA 1.0 0.0 5.50 816 816 A 48 ILE HB A 9 PHE HD% 1.0 0.0 7.63 817 817 A 9 PHE HE% A 10 GLU HGx 1.0 0.0 7.63 818 818 A 16 TRP HD1 A 85 TYR HBx 1.0 0.0 5.50 819 819 A 35 LEU HA A 34 TYR HD% 1.0 0.0 7.63 820 820 A 75 LEU HG A 34 TYR HE% 1.0 0.0 7.63 821 821 A 38 TYR HD% A 34 TYR HA 1.0 0.0 7.63 822 822 A 34 TYR HB3 A 38 TYR HD% 1.0 0.0 7.63 823 823 A 38 TYR HE% A 37 LEU HBx 1.0 0.0 7.63 824 824 A 40 PHE HD% A 36 GLU HGx 1.0 0.0 7.63 825 825 A 43 ILE HG1y A 56 LEU HBy 1.0 0.0 7.26 826 826 A 56 LEU HBx A 43 ILE HG1y 1.0 0.0 7.26 827 827 A 42 HIS HB2 A 59 PRO HB3 1.0 0.0 5.50 828 828 A 42 HIS HB2 A 59 PRO HB2 1.0 0.0 5.50 829 829 A 79 VAL HB A 82 ILE HB 1.0 0.0 5.50 830 830 A 97 ALA HA A 100 MET HGx 1.0 0.0 5.50 831 831 A 86 ALA HA A 91 TYR HD% 1.0 0.0 7.63 832 832 A 89 ASN HB2 A 91 TYR HD% 1.0 0.0 7.63 833 833 A 86 ALA HA A 91 TYR HE% 1.0 0.0 7.63 834 834 A 89 ASN HB2 A 91 TYR HE% 1.0 0.0 7.63 835 835 A 89 ASN HB3 A 91 TYR HE% 1.0 0.0 7.63 836 836 A 93 ASP HBy A 94 SER HBy 1.0 0.0 7.26 837 837 A 97 ALA HA A 100 MET HGy 1.0 0.0 5.50 838 838 A 9 PHE HA A 48 ILE HG1y 1.0 0.0 5.50 839 839 A 9 PHE HA A 48 ILE HG1x 1.0 0.0 5.50 840 840 A 39 ILE HB A 40 PHE HD% 1.0 0.0 7.63 841 841 A 43 ILE HB A 56 LEU HA 1.0 0.0 5.50 842 842 A 89 ASN HB3 A 91 TYR HD% 1.0 0.0 7.63 843 843 A 93 ASP HBx A 94 SER HBy 1.0 0.0 7.26 844 844 A 94 SER HBx A 93 ASP HBx 1.0 0.0 7.26 845 845 A 10 GLU HA A 40 PHE HZ 1.0 0.0 5.50 846 846 A 53 THR H A 96 PRO HB3 1.0 0.0 5.50 847 847 A 12 ILE H A 12 ILE HD1% 1.0 0.0 6.52 848 848 A 32 LEU H A 32 LEU HDx% 1.0 0.0 6.52 849 849 A 32 LEU HA A 32 LEU HDx% 1.0 0.0 6.52 850 850 A 32 LEU H A 32 LEU HDy% 1.0 0.0 6.52 851 851 A 32 LEU HA A 32 LEU HDy% 1.0 0.0 6.52 852 852 A 35 LEU H A 35 LEU HDx% 1.0 0.0 6.52 853 853 A 35 LEU HA A 35 LEU HDx% 1.0 0.0 6.52 854 854 A 35 LEU H A 35 LEU HDy% 1.0 0.0 6.52 855 855 A 35 LEU HA A 35 LEU HDy% 1.0 0.0 6.52 856 856 A 37 LEU HA A 37 LEU HDx% 1.0 0.0 6.52 857 857 A 37 LEU H A 37 LEU HDy% 1.0 0.0 6.52 858 858 A 37 LEU HA A 37 LEU HDy% 1.0 0.0 6.52 859 859 A 39 ILE H A 39 ILE HD1% 1.0 0.0 6.52 860 860 A 43 ILE H A 43 ILE HD1% 1.0 0.0 6.52 861 861 A 48 ILE H A 48 ILE HD1% 1.0 0.0 6.52 862 862 A 51 LEU H A 51 LEU HDx% 1.0 0.0 6.52 863 863 A 51 LEU HA A 51 LEU HDx% 1.0 0.0 6.52 864 864 A 51 LEU H A 51 LEU HDy% 1.0 0.0 6.52 865 865 A 51 LEU HA A 51 LEU HDy% 1.0 0.0 6.52 866 866 A 56 LEU HA A 56 LEU HDx% 1.0 0.0 6.52 867 867 A 56 LEU H A 56 LEU HDy% 1.0 0.0 6.52 868 868 A 56 LEU HA A 56 LEU HDy% 1.0 0.0 6.52 869 869 A 57 LEU HA A 57 LEU HDx% 1.0 0.0 6.52 870 870 A 57 LEU HA A 57 LEU HDy% 1.0 0.0 6.52 871 871 A 60 ILE H A 60 ILE HD1% 1.0 0.0 6.52 872 872 A 75 LEU H A 75 LEU HDx% 1.0 0.0 6.52 873 873 A 75 LEU HA A 75 LEU HDx% 1.0 0.0 6.52 874 874 A 75 LEU H A 75 LEU HDy% 1.0 0.0 6.52 875 875 A 75 LEU HA A 75 LEU HDy% 1.0 0.0 6.52 876 876 A 104 LEU HA A 104 LEU HDx% 1.0 0.0 4.85 877 877 A 104 LEU HA A 104 LEU HDy% 1.0 0.0 4.85 878 878 A 114 LEU H A 114 LEU HDx% 1.0 0.0 6.52 879 879 A 114 LEU HA A 114 LEU HDx% 1.0 0.0 6.52 880 880 A 114 LEU H A 114 LEU HDy% 1.0 0.0 6.52 881 881 A 114 LEU HA A 114 LEU HDy% 1.0 0.0 6.52 882 882 A 9 PHE H A 8 THR HG2% 1.0 0.0 6.52 883 883 A 13 ALA H A 12 ILE HG2% 1.0 0.0 6.52 884 884 A 13 ALA H A 12 ILE HD1% 1.0 0.0 6.52 885 885 A 32 LEU H A 31 VAL HGx% 1.0 0.0 6.52 886 886 A 32 LEU H A 31 VAL HGy% 1.0 0.0 6.52 887 887 A 33 ARG H A 32 LEU HDx% 1.0 0.0 6.52 888 888 A 33 ARG H A 32 LEU HDy% 1.0 0.0 6.52 889 889 A 36 GLU H A 35 LEU HDx% 1.0 0.0 6.52 890 890 A 36 GLU H A 35 LEU HDy% 1.0 0.0 6.52 891 891 A 40 PHE H A 39 ILE HG2% 1.0 0.0 6.52 892 892 A 40 PHE H A 39 ILE HD1% 1.0 0.0 6.52 893 893 A 44 GLY H A 43 ILE HG2% 1.0 0.0 6.52 894 894 A 49 ARG H A 48 ILE HG2% 1.0 0.0 6.52 895 895 A 49 ARG H A 48 ILE HD1% 1.0 0.0 6.52 896 896 A 54 SER H A 53 THR HG2% 1.0 0.0 6.52 897 897 A 57 LEU H A 56 LEU HDy% 1.0 0.0 6.52 898 898 A 58 ALA H A 57 LEU HDx% 1.0 0.0 6.52 899 899 A 58 ALA H A 57 LEU HDy% 1.0 0.0 6.52 900 900 A 61 LYS H A 60 ILE HD1% 1.0 0.0 6.52 901 901 A 64 ASP H A 63 VAL HGx% 1.0 0.0 6.52 902 902 A 64 ASP H A 63 VAL HGy% 1.0 0.0 6.52 903 903 A 66 SER H A 65 THR HG2% 1.0 0.0 6.52 904 904 A 76 GLN H A 75 LEU HDx% 1.0 0.0 6.52 905 905 A 76 GLN H A 75 LEU HDy% 1.0 0.0 6.52 906 906 A 80 THR H A 79 VAL HGx% 1.0 0.0 6.52 907 907 A 80 THR H A 79 VAL HGy% 1.0 0.0 6.52 908 908 A 81 ALA H A 80 THR HG2% 1.0 0.0 6.52 909 909 A 93 ASP H A 92 ILE HG2% 1.0 0.0 6.52 910 910 A 105 SER H A 104 LEU HDx% 1.0 0.0 6.52 911 911 A 105 SER H A 104 LEU HDy% 1.0 0.0 6.52 912 912 A 108 LYS H A 107 THR HG2% 1.0 0.0 6.52 913 913 A 115 GLU H A 114 LEU HDx% 1.0 0.0 6.52 914 914 A 115 GLU H A 114 LEU HDy% 1.0 0.0 6.52 915 915 A 97 ALA H A 53 THR HG2% 1.0 0.0 6.52 916 916 A 100 MET H A 53 THR HG2% 1.0 0.0 6.52 917 917 A 42 HIS H A 43 ILE HG2% 1.0 0.0 6.52 918 918 A 12 ILE HD1% A 7 TYR HD% 1.0 0.0 8.65 919 919 A 9 PHE HE% A 13 ALA HB% 1.0 0.0 8.19 920 920 A 9 PHE HD% A 13 ALA HB% 1.0 0.0 8.65 921 921 A 40 PHE HD% A 35 LEU HDy% 1.0 0.0 8.65 922 922 A 40 PHE HE% A 35 LEU HDy% 1.0 0.0 8.65 923 923 A 40 PHE HD% A 35 LEU HDx% 1.0 0.0 8.65 924 924 A 40 PHE HE% A 35 LEU HDx% 1.0 0.0 8.65 925 925 A 40 PHE HD% A 39 ILE HG2% 1.0 0.0 7.90 926 926 A 39 ILE HG2% A 40 PHE HE% 1.0 0.0 8.65 927 927 A 38 TYR HD% A 39 ILE HD1% 1.0 0.0 8.65 928 928 A 9 PHE HD% A 43 ILE HD1% 1.0 0.0 8.65 929 929 A 48 ILE HG2% A 7 TYR HD% 1.0 0.0 8.65 930 930 A 9 PHE HD% A 48 ILE HG2% 1.0 0.0 8.65 931 931 A 48 ILE HD1% A 9 PHE HE% 1.0 0.0 8.65 932 932 A 38 TYR HE% A 71 VAL HGx% 1.0 0.0 8.65 933 933 A 38 TYR HD% A 71 VAL HGy% 1.0 0.0 8.65 934 934 A 64 ASP H A 72 ALA HB% 1.0 0.0 5.62 935 935 A 9 PHE HE% A 79 VAL HGx% 1.0 0.0 8.65 936 936 A 9 PHE HZ A 79 VAL HGx% 1.0 0.0 6.52 937 937 A 9 PHE HE% A 79 VAL HGy% 1.0 0.0 8.65 938 938 A 82 ILE HG2% A 9 PHE HE% 1.0 0.0 8.65 939 939 A 9 PHE HD% A 82 ILE HG2% 1.0 0.0 8.65 940 940 A 86 ALA H A 82 ILE HG2% 1.0 0.0 6.52 941 941 A 82 ILE HD1% A 9 PHE HE% 1.0 0.0 8.65 942 942 A 9 PHE HD% A 82 ILE HD1% 1.0 0.0 8.65 943 943 A 83 MET HE% A 95 ASN HA 1.0 0.0 6.52 944 944 A 88 GLN H A 86 ALA HB% 1.0 0.0 6.52 945 945 A 92 ILE H A 86 ALA HB% 1.0 0.0 6.52 946 946 A 91 TYR H A 92 ILE HG2% 1.0 0.0 6.52 947 947 A 94 SER H A 92 ILE HG2% 1.0 0.0 6.52 948 948 A 80 THR H A 97 ALA HB% 1.0 0.0 6.52 949 949 A 57 LEU H A 100 MET HE% 1.0 0.0 6.21 950 950 A 73 GLN HE2y A 101 ALA HB% 1.0 0.0 6.52 951 951 A 73 GLN HE2x A 101 ALA HB% 1.0 0.0 6.52 952 952 A 97 ALA HA A 53 THR HG2% 1.0 0.0 6.02 953 953 A 53 THR HG2% A 99 ASP HBx 1.0 0.0 6.52 954 954 A 96 PRO HB2 A 53 THR HG2% 1.0 0.0 6.52 955 955 A 9 PHE HA A 48 ILE HD1% 1.0 0.0 5.75 956 956 A 9 PHE HD% A 48 ILE HD1% 1.0 0.0 8.65 957 957 A 13 ALA HB% A 9 PHE HZ 1.0 0.0 6.21 958 958 A 43 ILE HD1% A 9 PHE HE% 1.0 0.0 8.65 959 959 A 12 ILE HG2% A 86 ALA HB% 1.0 0.0 7.35 960 960 A 15 GLU HBy A 12 ILE HG2% 1.0 0.0 6.52 961 961 A 13 ALA HA A 12 ILE HG2% 1.0 0.0 6.52 962 962 A 86 ALA HA A 12 ILE HG2% 1.0 0.0 6.52 963 963 A 86 ALA HA A 12 ILE HD1% 1.0 0.0 6.52 964 964 A 12 ILE HD1% A 7 TYR HA 1.0 0.0 5.56 965 965 A 7 TYR HBy A 12 ILE HD1% 1.0 0.0 6.52 966 966 A 7 TYR HBx A 12 ILE HD1% 1.0 0.0 6.52 967 967 A 10 GLU HA A 13 ALA HB% 1.0 0.0 6.43 968 968 A 48 ILE HD1% A 13 ALA HB% 1.0 0.0 7.54 969 969 A 16 TRP HZ2 A 81 ALA HB% 1.0 0.0 6.08 970 970 A 34 TYR HB2 A 31 VAL HGx% 1.0 0.0 6.52 971 971 A 34 TYR HB2 A 31 VAL HGy% 1.0 0.0 6.52 972 972 A 36 GLU HGy A 32 LEU HDy% 1.0 0.0 9.61 973 973 A 32 LEU HDy% A 36 GLU HGx 1.0 0.0 9.61 974 974 A 34 TYR HE% A 71 VAL HGx% 1.0 0.0 8.65 975 975 A 34 TYR HE% A 71 VAL HGy% 1.0 0.0 8.65 976 976 A 75 LEU HDy% A 38 TYR HBx 1.0 0.0 8.28 977 977 A 38 TYR HD% A 71 VAL HGx% 1.0 0.0 8.65 978 978 A 38 TYR HE% A 71 VAL HGy% 1.0 0.0 8.65 979 979 A 35 LEU HA A 39 ILE HG2% 1.0 0.0 6.52 980 980 A 75 LEU HA A 39 ILE HD1% 1.0 0.0 6.52 981 981 A 35 LEU HA A 39 ILE HD1% 1.0 0.0 6.52 982 982 A 39 ILE HD1% A 38 TYR HBy 1.0 0.0 6.52 983 983 A 39 ILE HD1% A 38 TYR HBx 1.0 0.0 6.52 984 984 A 60 ILE HD1% A 59 PRO HGy 1.0 0.0 6.52 985 985 A 59 PRO HB3 A 60 ILE HD1% 1.0 0.0 5.44 986 986 A 43 ILE HG2% A 56 LEU HA 1.0 0.0 6.52 987 987 A 42 HIS HB2 A 43 ILE HG2% 1.0 0.0 5.90 988 988 A 42 HIS HB3 A 43 ILE HG2% 1.0 0.0 6.52 989 989 A 56 LEU HG A 43 ILE HG2% 1.0 0.0 5.71 990 990 A 56 LEU HG A 43 ILE HD1% 1.0 0.0 6.52 991 991 A 51 LEU HDy% A 46 SER HBx 1.0 0.0 6.52 992 992 A 48 ILE HB A 12 ILE HD1% 1.0 0.0 6.52 993 993 A 12 ILE HG2% A 48 ILE HG2% 1.0 0.0 7.54 994 994 A 12 ILE HD1% A 48 ILE HG2% 1.0 0.0 7.54 995 995 A 83 MET HE% A 48 ILE HG2% 1.0 0.0 7.54 996 996 A 7 TYR HBx A 48 ILE HG2% 1.0 0.0 6.52 997 997 A 7 TYR HBy A 48 ILE HG2% 1.0 0.0 6.52 998 998 A 9 PHE HA A 48 ILE HG2% 1.0 0.0 6.52 999 999 A 48 ILE HG2% A 7 TYR HA 1.0 0.0 6.52 1000 1000 A 48 ILE HD1% A 9 PHE HBy 1.0 0.0 6.52 1001 1001 A 48 ILE HD1% A 83 MET HE% 1.0 0.0 7.54 1002 1002 A 48 ILE HD1% A 12 ILE HG2% 1.0 0.0 7.54 1003 1003 A 48 ILE HD1% A 12 ILE HD1% 1.0 0.0 7.54 1004 1004 A 83 MET HA A 48 ILE HD1% 1.0 0.0 6.52 1005 1005 A 49 ARG HBy A 92 ILE HG2% 1.0 0.0 6.52 1006 1006 A 46 SER HBx A 51 LEU HDx% 1.0 0.0 6.52 1007 1007 A 83 MET HE% A 51 LEU HDx% 1.0 0.0 7.54 1008 1008 A 43 ILE HD1% A 51 LEU HDx% 1.0 0.0 7.54 1009 1009 A 43 ILE HD1% A 51 LEU HDy% 1.0 0.0 7.54 1010 1010 A 51 LEU HDy% A 46 SER HBy 1.0 0.0 6.52 1011 1011 A 51 LEU HDy% A 52 LYS HDx 1.0 0.0 9.61 1012 1012 A 51 LEU HDy% A 52 LYS HDy 1.0 0.0 9.61 1013 1013 A 43 ILE HD1% A 56 LEU HA 1.0 0.0 6.30 1014 1014 A 43 ILE HG2% A 58 ALA HB% 1.0 0.0 7.54 1015 1015 A 59 PRO HB2 A 60 ILE HD1% 1.0 0.0 6.18 1016 1016 A 57 LEU HB2 A 60 ILE HG2% 1.0 0.0 6.52 1017 1017 A 76 GLN HB3 A 60 ILE HG2% 1.0 0.0 6.15 1018 1018 A 76 GLN HB2 A 60 ILE HG2% 1.0 0.0 6.52 1019 1019 A 72 ALA HA A 60 ILE HG2% 1.0 0.0 6.33 1020 1020 A 60 ILE HG2% A 61 LYS HA 1.0 0.0 6.52 1021 1021 A 57 LEU HDx% A 61 LYS HBx 1.0 0.0 8.28 1022 1022 A 60 ILE HA A 63 VAL HGx% 1.0 0.0 6.52 1023 1023 A 72 ALA HA A 63 VAL HGy% 1.0 0.0 6.52 1024 1024 A 64 ASP HA A 63 VAL HGy% 1.0 0.0 6.52 1025 1025 A 60 ILE HA A 63 VAL HGy% 1.0 0.0 6.52 1026 1026 A 68 LYS HEx A 63 VAL HGy% 1.0 0.0 9.62 1027 1027 A 68 LYS HDx A 63 VAL HGy% 1.0 0.0 9.62 1028 1028 A 68 LYS HBy A 63 VAL HGy% 1.0 0.0 9.22 1029 1029 A 72 ALA HB% A 63 VAL HGy% 1.0 0.0 7.54 1030 1030 A 68 LYS HGy A 63 VAL HGy% 1.0 0.0 9.62 1031 1031 A 61 LYS HDy A 57 LEU HDx% 1.0 0.0 8.29 1032 1032 A 57 LEU HDx% A 61 LYS HDx 1.0 0.0 8.29 1033 1033 A 71 VAL HGx% A 68 LYS HBy 1.0 0.0 6.52 1034 1034 A 38 TYR HBx A 75 LEU HDx% 1.0 0.0 8.28 1035 1035 A 72 ALA HA A 71 VAL HGx% 1.0 0.0 6.52 1036 1036 A 68 LYS HBy A 71 VAL HGy% 1.0 0.0 6.52 1037 1037 A 63 VAL HGx% A 71 VAL HGy% 1.0 0.0 10.64 1038 1038 A 63 VAL HGy% A 71 VAL HGy% 1.0 0.0 10.64 1039 1039 A 72 ALA HA A 63 VAL HGx% 1.0 0.0 6.52 1040 1040 A 72 ALA HA A 71 VAL HGy% 1.0 0.0 6.52 1041 1041 A 64 ASP HA A 72 ALA HB% 1.0 0.0 5.31 1042 1042 A 69 HIS HA A 72 ALA HB% 1.0 0.0 5.90 1043 1043 A 60 ILE HA A 72 ALA HB% 1.0 0.0 6.52 1044 1044 A 64 ASP HB2 A 72 ALA HB% 1.0 0.0 6.18 1045 1045 A 64 ASP HB3 A 72 ALA HB% 1.0 0.0 5.31 1046 1046 A 60 ILE HB A 72 ALA HB% 1.0 0.0 6.52 1047 1047 A 60 ILE HG2% A 72 ALA HB% 1.0 0.0 7.29 1048 1048 A 72 ALA HB% A 63 VAL HGx% 1.0 0.0 7.54 1049 1049 A 57 LEU HDx% A 76 GLN HGy 1.0 0.0 8.28 1050 1050 A 73 GLN HBy A 104 LEU HDx% 1.0 0.0 8.28 1051 1051 A 76 GLN HA A 60 ILE HG2% 1.0 0.0 6.52 1052 1052 A 63 VAL HGx% A 62 GLU HBx 1.0 0.0 9.62 1053 1053 A 81 ALA HB% A 82 ILE HA 1.0 0.0 6.52 1054 1054 A 82 ILE HD1% A 79 VAL HA 1.0 0.0 6.09 1055 1055 A 79 VAL HGx% A 56 LEU HBy 1.0 0.0 8.28 1056 1056 A 56 LEU HG A 79 VAL HGx% 1.0 0.0 6.52 1057 1057 A 56 LEU HDy% A 79 VAL HGx% 1.0 0.0 10.13 1058 1058 A 82 ILE HD1% A 79 VAL HGx% 1.0 0.0 7.54 1059 1059 A 43 ILE HD1% A 79 VAL HGx% 1.0 0.0 7.54 1060 1060 A 56 LEU HG A 79 VAL HGy% 1.0 0.0 6.52 1061 1061 A 56 LEU HDy% A 79 VAL HGy% 1.0 0.0 10.13 1062 1062 A 77 GLN HA A 80 THR HG2% 1.0 0.0 6.36 1063 1063 A 81 ALA HB% A 78 ARG HA 1.0 0.0 5.84 1064 1064 A 82 ILE HD1% A 81 ALA HB% 1.0 0.0 7.54 1065 1065 A 13 ALA HA A 82 ILE HG2% 1.0 0.0 5.68 1066 1066 A 82 ILE HG2% A 13 ALA HB% 1.0 0.0 7.54 1067 1067 A 48 ILE HB A 82 ILE HG2% 1.0 0.0 6.52 1068 1068 A 48 ILE HD1% A 82 ILE HG2% 1.0 0.0 7.54 1069 1069 A 82 ILE HG2% A 12 ILE HG2% 1.0 0.0 7.54 1070 1070 A 13 ALA HA A 82 ILE HD1% 1.0 0.0 6.46 1071 1071 A 82 ILE HD1% A 78 ARG HBy 1.0 0.0 6.52 1072 1072 A 82 ILE HD1% A 13 ALA HB% 1.0 0.0 7.26 1073 1073 A 82 ILE HD1% A 79 VAL HGy% 1.0 0.0 7.54 1074 1074 A 97 ALA HB% A 100 MET HGx 1.0 0.0 6.52 1075 1075 A 56 LEU HDx% A 100 MET HGx 1.0 0.0 9.61 1076 1076 A 83 MET HE% A 96 PRO HDx 1.0 0.0 6.39 1077 1077 A 83 MET HE% A 96 PRO HDy 1.0 0.0 6.39 1078 1078 A 83 MET HA A 83 MET HE% 1.0 0.0 6.52 1079 1079 A 85 TYR HD% A 12 ILE HG2% 1.0 0.0 8.65 1080 1080 A 83 MET HA A 86 ALA HB% 1.0 0.0 5.50 1081 1081 A 86 ALA HB% A 91 TYR HBx 1.0 0.0 6.52 1082 1082 A 83 MET HE% A 86 ALA HB% 1.0 0.0 7.54 1083 1083 A 48 ILE HD1% A 86 ALA HB% 1.0 0.0 7.54 1084 1084 A 12 ILE HD1% A 86 ALA HB% 1.0 0.0 7.54 1085 1085 A 84 ARG HA A 87 VAL HGx% 1.0 0.0 6.52 1086 1086 A 87 VAL HGx% A 94 SER HBy 1.0 0.0 9.62 1087 1087 A 87 VAL HGx% A 95 ASN HBy 1.0 0.0 9.40 1088 1088 A 87 VAL HGx% A 95 ASN HBx 1.0 0.0 9.40 1089 1089 A 86 ALA HB% A 87 VAL HGy% 1.0 0.0 7.54 1090 1090 A 86 ALA HB% A 91 TYR HBy 1.0 0.0 6.52 1091 1091 A 91 TYR HD% A 86 ALA HB% 1.0 0.0 8.65 1092 1092 A 91 TYR HD% A 48 ILE HD1% 1.0 0.0 8.65 1093 1093 A 91 TYR HD% A 12 ILE HG2% 1.0 0.0 8.65 1094 1094 A 91 TYR HD% A 12 ILE HD1% 1.0 0.0 8.65 1095 1095 A 12 ILE HG2% A 91 TYR HE% 1.0 0.0 8.65 1096 1096 A 91 TYR HE% A 12 ILE HD1% 1.0 0.0 8.65 1097 1097 A 92 ILE HG2% A 91 TYR HBx 1.0 0.0 6.52 1098 1098 A 92 ILE HG2% A 91 TYR HBy 1.0 0.0 6.52 1099 1099 A 92 ILE HG2% A 49 ARG HA 1.0 0.0 4.78 1100 1100 A 87 VAL HA A 92 ILE HD1% 1.0 0.0 6.52 1101 1101 A 97 ALA HB% A 96 PRO HGy 1.0 0.0 6.52 1102 1102 A 92 ILE HG2% A 96 PRO HGy 1.0 0.0 6.52 1103 1103 A 92 ILE HD1% A 96 PRO HGy 1.0 0.0 6.52 1104 1104 A 97 ALA HB% A 96 PRO HGx 1.0 0.0 6.52 1105 1105 A 92 ILE HG2% A 96 PRO HGx 1.0 0.0 6.52 1106 1106 A 92 ILE HD1% A 96 PRO HGx 1.0 0.0 6.52 1107 1107 A 92 ILE HG2% A 96 PRO HDy 1.0 0.0 6.52 1108 1108 A 92 ILE HG2% A 96 PRO HDx 1.0 0.0 6.52 1109 1109 A 97 ALA HB% A 56 LEU HDx% 1.0 0.0 7.54 1110 1110 A 97 ALA HB% A 100 MET HGy 1.0 0.0 6.52 1111 1111 A 80 THR HB A 97 ALA HB% 1.0 0.0 5.62 1112 1112 A 53 THR HG2% A 99 ASP HBy 1.0 0.0 6.52 1113 1113 A 53 THR HG2% A 100 MET HA 1.0 0.0 6.52 1114 1114 A 53 THR HG2% A 100 MET HGy 1.0 0.0 6.52 1115 1115 A 100 MET HGy A 56 LEU HDx% 1.0 0.0 9.61 1116 1116 A 100 MET HE% A 79 VAL HGy% 1.0 0.0 7.54 1117 1117 A 57 LEU HB3 A 100 MET HE% 1.0 0.0 6.18 1118 1118 A 100 MET HE% A 54 SER HBx 1.0 0.0 6.52 1119 1119 A 100 MET HE% A 54 SER HBy 1.0 0.0 6.52 1120 1120 A 100 MET HE% A 57 LEU HA 1.0 0.0 6.12 1121 1121 A 100 MET HE% A 100 MET HA 1.0 0.0 6.52 1122 1122 A 97 ALA HA A 100 MET HE% 1.0 0.0 6.36 1123 1123 A 101 ALA HB% A 102 GLY HAx 1.0 0.0 6.52 1124 1124 A 40 PHE HZ A 39 ILE HG2% 1.0 0.0 6.52 1125 1125 A 43 ILE HD1% A 9 PHE HZ 1.0 0.0 6.52 1126 1126 A 82 ILE HG2% A 9 PHE HZ 1.0 0.0 6.52 1127 1127 A 82 ILE HD1% A 9 PHE HZ 1.0 0.0 6.43 1128 1128 A 91 TYR H A 86 ALA HB% 1.0 0.0 6.52 1129 1129 A 100 MET H A 97 ALA HB% 1.0 0.0 6.52 1130 1130 A 53 THR HG2% A 100 MET HGx 1.0 0.0 6.52 1131 1131 A 40 PHE HZ A 35 LEU HDx% 1.0 0.0 6.52 1132 1132 A 9 PHE HZ A 79 VAL HGy% 1.0 0.0 6.52 1133 1133 A 40 PHE HZ A 35 LEU HDy% 1.0 0.0 6.52 1134 1134 A 15 GLU HBx A 12 ILE HG2% 1.0 0.0 6.52 1135 1135 A 84 ARG HA A 87 VAL HGy% 1.0 0.0 6.52 1136 1136 A 75 LEU HDy% A 38 TYR HBy 1.0 0.0 8.28 1137 1137 A 60 ILE HD1% A 59 PRO HGx 1.0 0.0 6.52 1138 1138 A 43 ILE HG2% A 59 PRO HGy 1.0 0.0 6.52 1139 1139 A 43 ILE HG2% A 59 PRO HGx 1.0 0.0 6.52 1140 1140 A 43 ILE HD1% A 79 VAL HGy% 1.0 0.0 7.54 1141 1141 A 92 ILE HG2% A 48 ILE HA 1.0 0.0 6.52 1142 1142 A 48 ILE HD1% A 9 PHE HBx 1.0 0.0 6.52 1143 1143 A 49 ARG HBx A 92 ILE HG2% 1.0 0.0 6.52 1144 1144 A 83 MET HE% A 51 LEU HDy% 1.0 0.0 7.54 1145 1145 A 71 VAL HGx% A 68 LYS HEx 1.0 0.0 9.62 1146 1146 A 71 VAL HGx% A 68 LYS HEy 1.0 0.0 9.62 1147 1147 A 52 LYS HDx A 56 LEU HDx% 1.0 0.0 9.61 1148 1148 A 52 LYS HDy A 56 LEU HDx% 1.0 0.0 9.61 1149 1149 A 97 ALA HB% A 56 LEU HDy% 1.0 0.0 7.54 1150 1150 A 60 ILE HG2% A 76 GLN HGy 1.0 0.0 6.52 1151 1151 A 60 ILE HG2% A 76 GLN HGx 1.0 0.0 6.52 1152 1152 A 57 LEU HDy% A 61 LYS HBx 1.0 0.0 8.28 1153 1153 A 64 ASP HA A 63 VAL HGx% 1.0 0.0 6.52 1154 1154 A 63 VAL HGy% A 68 LYS HEy 1.0 0.0 9.62 1155 1155 A 63 VAL HGy% A 68 LYS HDy 1.0 0.0 9.62 1156 1156 A 63 VAL HGy% A 68 LYS HBx 1.0 0.0 9.22 1157 1157 A 63 VAL HGy% A 68 LYS HGx 1.0 0.0 9.62 1158 1158 A 57 LEU HDy% A 61 LYS HDx 1.0 0.0 8.29 1159 1159 A 71 VAL HGx% A 68 LYS HBx 1.0 0.0 6.52 1160 1160 A 72 ALA HA A 75 LEU HDx% 1.0 0.0 6.52 1161 1161 A 68 LYS HBx A 71 VAL HGy% 1.0 0.0 6.52 1162 1162 A 72 ALA HA A 75 LEU HDy% 1.0 0.0 6.52 1163 1163 A 75 LEU HB2 A 72 ALA HB% 1.0 0.0 6.52 1164 1164 A 63 VAL HB A 72 ALA HB% 1.0 0.0 6.33 1165 1165 A 57 LEU HDy% A 76 GLN HGy 1.0 0.0 8.28 1166 1166 A 73 GLN HGy A 104 LEU HDx% 1.0 0.0 6.52 1167 1167 A 73 GLN HGx A 104 LEU HDx% 1.0 0.0 6.52 1168 1168 A 104 LEU HDy% A 73 GLN HGy 1.0 0.0 6.52 1169 1169 A 104 LEU HDy% A 73 GLN HGx 1.0 0.0 6.52 1170 1170 A 104 LEU HDy% A 73 GLN HBy 1.0 0.0 8.28 1171 1171 A 104 LEU HDy% A 73 GLN HBx 1.0 0.0 8.28 1172 1172 A 63 VAL HGx% A 62 GLU HBy 1.0 0.0 9.62 1173 1173 A 100 MET HE% A 79 VAL HGx% 1.0 0.0 7.54 1174 1174 A 56 LEU HBx A 79 VAL HGy% 1.0 0.0 8.28 1175 1175 A 82 ILE HG2% A 86 ALA HB% 1.0 0.0 7.54 1176 1176 A 82 ILE HD1% A 78 ARG HBx 1.0 0.0 6.52 1177 1177 A 86 ALA HB% A 87 VAL HGx% 1.0 0.0 7.54 1178 1178 A 92 ILE HG2% A 86 ALA HB% 1.0 0.0 7.54 1179 1179 A 92 ILE HD1% A 86 ALA HB% 1.0 0.0 7.54 1180 1180 A 87 VAL HGx% A 94 SER HBx 1.0 0.0 9.62 1181 1181 A 91 TYR HD% A 92 ILE HG2% 1.0 0.0 8.65 1182 1182 A 100 MET HE% A 97 ALA HB% 1.0 0.0 7.54 1183 1183 A 76 GLN HA A 100 MET HE% 1.0 0.0 6.52 1184 1184 A 101 ALA HB% A 102 GLY HAy 1.0 0.0 6.52 1185 1185 A 102 GLY HAx A 103 ALA HB% 1.0 0.0 6.52 1186 1186 A 102 GLY HAy A 103 ALA HB% 1.0 0.0 6.52 1187 1187 A 46 SER HBy A 51 LEU HDx% 1.0 0.0 6.52 1188 1188 A 3 ASN HA A 3 ASN HD2y 1.0 0.0 3.93 1189 1188 A 3 ASN HA A 3 ASN HD2x 1.0 0.0 3.93 1190 1189 A 5 GLY H A 4 SER HBy 1.0 0.0 4.45 1191 1189 A 5 GLY H A 4 SER HBx 1.0 0.0 4.45 1192 1190 A 9 PHE HBy A 51 LEU HDx% 1.0 0.0 8.92 1193 1190 A 9 PHE HBx A 51 LEU HDx% 1.0 0.0 8.92 1194 1190 A 51 LEU HDy% A 9 PHE HBx 1.0 0.0 8.92 1195 1190 A 9 PHE HBy A 51 LEU HDy% 1.0 0.0 8.92 1196 1191 A 9 PHE HD% A 48 ILE HG1y 1.0 0.0 8.51 1197 1191 A 9 PHE HD% A 48 ILE HG1x 1.0 0.0 8.51 1198 1192 A 9 PHE HD% A 51 LEU HDx% 1.0 0.0 10.20 1199 1192 A 9 PHE HD% A 51 LEU HDy% 1.0 0.0 10.20 1200 1193 A 9 PHE HD% A 56 LEU HDx% 1.0 0.0 10.20 1201 1193 A 9 PHE HD% A 56 LEU HDy% 1.0 0.0 10.20 1202 1194 A 9 PHE HE% A 56 LEU HDx% 1.0 0.0 10.20 1203 1194 A 9 PHE HE% A 56 LEU HDy% 1.0 0.0 10.20 1204 1195 A 9 PHE HZ A 51 LEU HDx% 1.0 0.0 8.07 1205 1195 A 9 PHE HZ A 51 LEU HDy% 1.0 0.0 8.07 1206 1196 A 9 PHE HZ A 56 LEU HDx% 1.0 0.0 8.07 1207 1196 A 9 PHE HZ A 56 LEU HDy% 1.0 0.0 8.07 1208 1197 A 9 PHE HZ A 79 VAL HGy% 1.0 0.0 6.10 1209 1197 A 9 PHE HZ A 79 VAL HGx% 1.0 0.0 6.10 1210 1198 A 40 PHE HD% A 10 GLU HGx 1.0 0.0 8.51 1211 1198 A 40 PHE HD% A 10 GLU HGy 1.0 0.0 8.51 1212 1199 A 40 PHE HZ A 10 GLU HGx 1.0 0.0 6.38 1213 1199 A 40 PHE HZ A 10 GLU HGy 1.0 0.0 6.38 1214 1200 A 11 THR HA A 14 ARG HBy 1.0 0.0 5.33 1215 1200 A 11 THR HA A 14 ARG HBx 1.0 0.0 5.33 1216 1201 A 12 ILE HD1% A 91 TYR HBx 1.0 0.0 7.40 1217 1201 A 12 ILE HD1% A 91 TYR HBy 1.0 0.0 7.40 1218 1202 A 13 ALA HA A 82 ILE HG1y 1.0 0.0 6.38 1219 1202 A 13 ALA HA A 82 ILE HG1x 1.0 0.0 6.38 1220 1203 A 13 ALA HA A 85 TYR HBx 1.0 0.0 6.38 1221 1203 A 13 ALA HA A 85 TYR HBy 1.0 0.0 6.38 1222 1204 A 13 ALA HB% A 82 ILE HG1y 1.0 0.0 7.40 1223 1204 A 13 ALA HB% A 82 ILE HG1x 1.0 0.0 7.40 1224 1205 A 15 GLU H A 15 GLU HGx 1.0 0.0 5.03 1225 1205 A 15 GLU H A 15 GLU HGy 1.0 0.0 5.03 1226 1206 A 16 TRP H A 15 GLU HGx 1.0 0.0 4.47 1227 1206 A 16 TRP H A 15 GLU HGy 1.0 0.0 4.47 1228 1207 A 85 TYR HD% A 16 TRP HBx 1.0 0.0 8.51 1229 1207 A 85 TYR HD% A 16 TRP HBy 1.0 0.0 8.51 1230 1208 A 16 TRP HE1 A 85 TYR HBx 1.0 0.0 6.38 1231 1208 A 16 TRP HE1 A 85 TYR HBy 1.0 0.0 6.38 1232 1209 A 21 LYS HBy A 21 LYS HDx 1.0 0.0 3.16 1233 1209 A 21 LYS HBx A 21 LYS HDx 1.0 0.0 3.16 1234 1209 A 21 LYS HDy A 21 LYS HBx 1.0 0.0 3.16 1235 1209 A 21 LYS HBy A 21 LYS HDy 1.0 0.0 3.16 1236 1210 A 21 LYS HBy A 21 LYS HDy 1.0 0.0 4.16 1237 1211 A 21 LYS HBy A 21 LYS HDx 1.0 0.0 4.16 1238 1212 A 30 ARG H A 30 ARG HGx 1.0 0.0 6.38 1239 1212 A 30 ARG H A 30 ARG HGy 1.0 0.0 6.38 1240 1213 A 31 VAL H A 30 ARG HBy 1.0 0.0 4.37 1241 1213 A 31 VAL H A 30 ARG HBx 1.0 0.0 4.37 1242 1214 A 32 LEU HA A 31 VAL HGy% 1.0 0.0 8.07 1243 1214 A 32 LEU HA A 31 VAL HGx% 1.0 0.0 8.07 1244 1215 A 34 TYR HD% A 31 VAL HGy% 1.0 0.0 9.86 1245 1215 A 34 TYR HD% A 31 VAL HGx% 1.0 0.0 9.86 1246 1216 A 34 TYR HE% A 31 VAL HGy% 1.0 0.0 10.20 1247 1216 A 34 TYR HE% A 31 VAL HGx% 1.0 0.0 10.20 1248 1217 A 35 LEU HA A 31 VAL HGy% 1.0 0.0 8.07 1249 1217 A 35 LEU HA A 31 VAL HGx% 1.0 0.0 8.07 1250 1218 A 32 LEU HA A 35 LEU HDx% 1.0 0.0 7.76 1251 1218 A 32 LEU HA A 35 LEU HDy% 1.0 0.0 7.76 1252 1219 A 32 LEU HG A 36 GLU HGx 1.0 0.0 6.38 1253 1219 A 32 LEU HG A 36 GLU HGy 1.0 0.0 6.38 1254 1220 A 33 ARG HA A 32 LEU HDx% 1.0 0.0 8.07 1255 1220 A 33 ARG HA A 32 LEU HDy% 1.0 0.0 8.07 1256 1221 A 32 LEU HDy% A 36 GLU HBy 1.0 0.0 8.76 1257 1221 A 32 LEU HDx% A 36 GLU HBy 1.0 0.0 8.76 1258 1221 A 36 GLU HBx A 32 LEU HDx% 1.0 0.0 8.76 1259 1221 A 32 LEU HDy% A 36 GLU HBx 1.0 0.0 8.76 1260 1222 A 32 LEU HDx% A 36 GLU HGx 1.0 0.0 8.02 1261 1222 A 32 LEU HDy% A 36 GLU HGx 1.0 0.0 8.02 1262 1222 A 36 GLU HGy A 32 LEU HDx% 1.0 0.0 8.02 1263 1222 A 36 GLU HGy A 32 LEU HDy% 1.0 0.0 8.02 1264 1223 A 36 GLU HGy A 32 LEU HDx% 1.0 0.0 9.61 1265 1224 A 32 LEU HDx% A 36 GLU HGx 1.0 0.0 9.61 1266 1225 A 34 TYR H A 37 LEU HDx% 1.0 0.0 8.07 1267 1225 A 34 TYR H A 37 LEU HDy% 1.0 0.0 8.07 1268 1226 A 34 TYR HA A 37 LEU HBy 1.0 0.0 5.51 1269 1226 A 34 TYR HA A 37 LEU HBx 1.0 0.0 5.51 1270 1227 A 34 TYR HA A 37 LEU HDx% 1.0 0.0 7.94 1271 1227 A 34 TYR HA A 37 LEU HDy% 1.0 0.0 7.94 1272 1228 A 34 TYR HD% A 37 LEU HDx% 1.0 0.0 10.20 1273 1228 A 34 TYR HD% A 37 LEU HDy% 1.0 0.0 10.20 1274 1229 A 34 TYR HE% A 75 LEU HDx% 1.0 0.0 10.20 1275 1229 A 34 TYR HE% A 75 LEU HDy% 1.0 0.0 10.20 1276 1230 A 35 LEU HA A 39 ILE HG1y 1.0 0.0 6.38 1277 1230 A 35 LEU HA A 39 ILE HG1x 1.0 0.0 6.38 1278 1231 A 35 LEU HDy% A 36 GLU HBy 1.0 0.0 8.95 1279 1231 A 35 LEU HDx% A 36 GLU HBy 1.0 0.0 8.95 1280 1231 A 36 GLU HBx A 35 LEU HDx% 1.0 0.0 8.95 1281 1231 A 35 LEU HDy% A 36 GLU HBx 1.0 0.0 8.95 1282 1232 A 36 GLU H A 36 GLU HGx 1.0 0.0 5.30 1283 1232 A 36 GLU H A 36 GLU HGy 1.0 0.0 5.30 1284 1233 A 37 LEU H A 36 GLU HBy 1.0 0.0 4.30 1285 1233 A 37 LEU H A 36 GLU HBx 1.0 0.0 4.30 1286 1234 A 40 PHE HD% A 36 GLU HBy 1.0 0.0 8.51 1287 1234 A 40 PHE HD% A 36 GLU HBx 1.0 0.0 8.51 1288 1235 A 37 LEU H A 37 LEU HDx% 1.0 0.0 6.08 1289 1235 A 37 LEU H A 37 LEU HDy% 1.0 0.0 6.08 1290 1236 A 38 TYR HD% A 37 LEU HDx% 1.0 0.0 10.20 1291 1236 A 38 TYR HD% A 37 LEU HDy% 1.0 0.0 10.20 1292 1237 A 38 TYR HE% A 37 LEU HDx% 1.0 0.0 10.20 1293 1237 A 38 TYR HE% A 37 LEU HDy% 1.0 0.0 10.20 1294 1238 A 38 TYR HBx A 39 ILE HG1y 1.0 0.0 7.26 1295 1238 A 38 TYR HBy A 39 ILE HG1y 1.0 0.0 7.26 1296 1238 A 39 ILE HG1x A 38 TYR HBx 1.0 0.0 7.26 1297 1238 A 39 ILE HG1x A 38 TYR HBy 1.0 0.0 7.26 1298 1239 A 38 TYR HBx A 63 VAL HGy% 1.0 0.0 8.95 1299 1239 A 38 TYR HBy A 63 VAL HGy% 1.0 0.0 8.95 1300 1239 A 63 VAL HGx% A 38 TYR HBx 1.0 0.0 8.95 1301 1239 A 38 TYR HBy A 63 VAL HGx% 1.0 0.0 8.95 1302 1240 A 38 TYR HBx A 71 VAL HGy% 1.0 0.0 8.95 1303 1240 A 38 TYR HBy A 71 VAL HGy% 1.0 0.0 8.95 1304 1240 A 71 VAL HGx% A 38 TYR HBx 1.0 0.0 8.95 1305 1240 A 38 TYR HBy A 71 VAL HGx% 1.0 0.0 8.95 1306 1241 A 38 TYR HBx A 75 LEU HDx% 1.0 0.0 6.77 1307 1241 A 38 TYR HBy A 75 LEU HDx% 1.0 0.0 6.77 1308 1241 A 75 LEU HDy% A 38 TYR HBx 1.0 0.0 6.77 1309 1241 A 75 LEU HDy% A 38 TYR HBy 1.0 0.0 6.77 1310 1242 A 38 TYR HBy A 75 LEU HDx% 1.0 0.0 8.28 1311 1243 A 38 TYR HD% A 75 LEU HDx% 1.0 0.0 10.20 1312 1243 A 38 TYR HD% A 75 LEU HDy% 1.0 0.0 10.20 1313 1244 A 38 TYR HE% A 63 VAL HGy% 1.0 0.0 10.20 1314 1244 A 38 TYR HE% A 63 VAL HGx% 1.0 0.0 10.20 1315 1245 A 39 ILE HG2% A 40 PHE HBy 1.0 0.0 7.40 1316 1245 A 39 ILE HG2% A 40 PHE HBx 1.0 0.0 7.40 1317 1246 A 41 PRO HD2 A 40 PHE HBy 1.0 0.0 6.38 1318 1246 A 41 PRO HD2 A 40 PHE HBx 1.0 0.0 6.38 1319 1247 A 40 PHE HE% A 44 GLY HAy 1.0 0.0 8.51 1320 1247 A 40 PHE HE% A 44 GLY HAx 1.0 0.0 8.51 1321 1248 A 60 ILE HD1% A 41 PRO HBy 1.0 0.0 6.63 1322 1248 A 60 ILE HD1% A 41 PRO HBx 1.0 0.0 6.63 1323 1249 A 43 ILE H A 43 ILE HG1y 1.0 0.0 5.03 1324 1249 A 43 ILE H A 43 ILE HG1x 1.0 0.0 5.03 1325 1250 A 43 ILE HB A 46 SER HBy 1.0 0.0 6.38 1326 1250 A 43 ILE HB A 46 SER HBx 1.0 0.0 6.38 1327 1251 A 43 ILE HB A 51 LEU HDx% 1.0 0.0 8.07 1328 1251 A 43 ILE HB A 51 LEU HDy% 1.0 0.0 8.07 1329 1252 A 43 ILE HG2% A 56 LEU HBy 1.0 0.0 7.40 1330 1252 A 43 ILE HG2% A 56 LEU HBx 1.0 0.0 7.40 1331 1253 A 43 ILE HG2% A 59 PRO HDx 1.0 0.0 7.41 1332 1253 A 43 ILE HG2% A 59 PRO HDy 1.0 0.0 7.41 1333 1254 A 43 ILE HG1x A 56 LEU HBy 1.0 0.0 6.32 1334 1254 A 56 LEU HBx A 43 ILE HG1y 1.0 0.0 6.32 1335 1254 A 43 ILE HG1x A 56 LEU HBx 1.0 0.0 6.32 1336 1254 A 43 ILE HG1y A 56 LEU HBy 1.0 0.0 6.32 1337 1255 A 43 ILE HG1x A 56 LEU HBy 1.0 0.0 7.26 1338 1256 A 43 ILE HG1x A 56 LEU HBx 1.0 0.0 7.26 1339 1257 A 56 LEU HG A 43 ILE HG1y 1.0 0.0 6.38 1340 1257 A 56 LEU HG A 43 ILE HG1x 1.0 0.0 6.38 1341 1258 A 43 ILE HG1x A 59 PRO HDx 1.0 0.0 7.27 1342 1258 A 43 ILE HG1y A 59 PRO HDx 1.0 0.0 7.27 1343 1258 A 59 PRO HDy A 43 ILE HG1y 1.0 0.0 7.27 1344 1258 A 43 ILE HG1x A 59 PRO HDy 1.0 0.0 7.27 1345 1259 A 43 ILE HD1% A 46 SER HBy 1.0 0.0 6.66 1346 1259 A 43 ILE HD1% A 46 SER HBx 1.0 0.0 6.66 1347 1260 A 43 ILE HD1% A 56 LEU HDx% 1.0 0.0 8.59 1348 1260 A 43 ILE HD1% A 56 LEU HDy% 1.0 0.0 8.59 1349 1261 A 46 SER H A 51 LEU HDx% 1.0 0.0 8.07 1350 1261 A 46 SER H A 51 LEU HDy% 1.0 0.0 8.07 1351 1262 A 51 LEU HA A 46 SER HBy 1.0 0.0 6.38 1352 1262 A 51 LEU HA A 46 SER HBx 1.0 0.0 6.38 1353 1263 A 46 SER HBx A 51 LEU HDx% 1.0 0.0 6.07 1354 1263 A 46 SER HBy A 51 LEU HDx% 1.0 0.0 6.07 1355 1263 A 51 LEU HDy% A 46 SER HBy 1.0 0.0 6.07 1356 1263 A 51 LEU HDy% A 46 SER HBx 1.0 0.0 6.07 1357 1264 A 48 ILE H A 48 ILE HG1y 1.0 0.0 5.26 1358 1264 A 48 ILE H A 48 ILE HG1x 1.0 0.0 5.26 1359 1265 A 48 ILE HA A 51 LEU HDx% 1.0 0.0 7.11 1360 1265 A 48 ILE HA A 51 LEU HDy% 1.0 0.0 7.11 1361 1266 A 48 ILE HG2% A 51 LEU HDx% 1.0 0.0 9.09 1362 1266 A 48 ILE HG2% A 51 LEU HDy% 1.0 0.0 9.09 1363 1267 A 48 ILE HG2% A 91 TYR HBx 1.0 0.0 7.40 1364 1267 A 48 ILE HG2% A 91 TYR HBy 1.0 0.0 7.40 1365 1268 A 82 ILE HG2% A 48 ILE HG1y 1.0 0.0 7.40 1366 1268 A 82 ILE HG2% A 48 ILE HG1x 1.0 0.0 7.40 1367 1269 A 48 ILE HD1% A 91 TYR HBx 1.0 0.0 7.40 1368 1269 A 48 ILE HD1% A 91 TYR HBy 1.0 0.0 7.40 1369 1270 A 50 GLN H A 50 GLN HE2y 1.0 0.0 5.49 1370 1270 A 50 GLN H A 50 GLN HE2x 1.0 0.0 5.49 1371 1271 A 50 GLN H A 51 LEU HDx% 1.0 0.0 8.07 1372 1271 A 50 GLN H A 51 LEU HDy% 1.0 0.0 8.07 1373 1272 A 51 LEU H A 50 GLN HE2y 1.0 0.0 4.00 1374 1272 A 51 LEU H A 50 GLN HE2x 1.0 0.0 4.00 1375 1273 A 51 LEU HB3 A 79 VAL HGy% 1.0 0.0 8.01 1376 1273 A 79 VAL HGx% A 51 LEU HB3 1.0 0.0 8.01 1377 1274 A 52 LYS H A 51 LEU HDx% 1.0 0.0 8.07 1378 1274 A 52 LYS H A 51 LEU HDy% 1.0 0.0 8.07 1379 1275 A 51 LEU HDy% A 52 LYS HDx 1.0 0.0 8.02 1380 1275 A 51 LEU HDx% A 52 LYS HDx 1.0 0.0 8.02 1381 1275 A 52 LYS HDy A 51 LEU HDx% 1.0 0.0 8.02 1382 1275 A 51 LEU HDy% A 52 LYS HDy 1.0 0.0 8.02 1383 1276 A 52 LYS HDy A 51 LEU HDx% 1.0 0.0 9.61 1384 1277 A 51 LEU HDx% A 52 LYS HDx 1.0 0.0 9.61 1385 1278 A 51 LEU HDx% A 52 LYS HEx 1.0 0.0 8.95 1386 1278 A 51 LEU HDy% A 52 LYS HEx 1.0 0.0 8.95 1387 1278 A 52 LYS HEy A 51 LEU HDx% 1.0 0.0 8.95 1388 1278 A 51 LEU HDy% A 52 LYS HEy 1.0 0.0 8.95 1389 1279 A 51 LEU HDy% A 56 LEU HDx% 1.0 0.0 10.63 1390 1279 A 51 LEU HDx% A 56 LEU HDx% 1.0 0.0 10.63 1391 1279 A 56 LEU HDy% A 51 LEU HDx% 1.0 0.0 10.63 1392 1279 A 51 LEU HDy% A 56 LEU HDy% 1.0 0.0 10.63 1393 1280 A 82 ILE HG2% A 51 LEU HDx% 1.0 0.0 9.09 1394 1280 A 82 ILE HG2% A 51 LEU HDy% 1.0 0.0 9.09 1395 1281 A 52 LYS H A 52 LYS HGx 1.0 0.0 5.37 1396 1281 A 52 LYS H A 52 LYS HGy 1.0 0.0 5.37 1397 1282 A 53 THR H A 52 LYS HGx 1.0 0.0 5.26 1398 1282 A 53 THR H A 52 LYS HGy 1.0 0.0 5.26 1399 1283 A 52 LYS HDx A 56 LEU HDx% 1.0 0.0 8.02 1400 1283 A 52 LYS HDy A 56 LEU HDx% 1.0 0.0 8.02 1401 1283 A 56 LEU HDy% A 52 LYS HDx 1.0 0.0 8.02 1402 1283 A 56 LEU HDy% A 52 LYS HDy 1.0 0.0 8.02 1403 1284 A 56 LEU HDy% A 52 LYS HDy 1.0 0.0 9.61 1404 1285 A 56 LEU HDy% A 52 LYS HDx 1.0 0.0 9.61 1405 1286 A 53 THR H A 96 PRO HGx 1.0 0.0 6.39 1406 1286 A 53 THR H A 96 PRO HGy 1.0 0.0 6.39 1407 1287 A 53 THR HG2% A 99 ASP HBx 1.0 0.0 6.16 1408 1287 A 53 THR HG2% A 99 ASP HBy 1.0 0.0 6.16 1409 1288 A 53 THR HG2% A 100 MET HBx 1.0 0.0 7.40 1410 1288 A 53 THR HG2% A 100 MET HBy 1.0 0.0 7.40 1411 1289 A 57 LEU HB3 A 54 SER HBy 1.0 0.0 6.38 1412 1289 A 57 LEU HB3 A 54 SER HBx 1.0 0.0 6.38 1413 1290 A 57 LEU HG A 54 SER HBy 1.0 0.0 6.38 1414 1290 A 57 LEU HG A 54 SER HBx 1.0 0.0 6.38 1415 1291 A 54 SER HBx A 57 LEU HDx% 1.0 0.0 8.95 1416 1291 A 57 LEU HDy% A 54 SER HBy 1.0 0.0 8.95 1417 1291 A 54 SER HBx A 57 LEU HDy% 1.0 0.0 8.95 1418 1291 A 54 SER HBy A 57 LEU HDx% 1.0 0.0 8.95 1419 1292 A 55 HIS H A 56 LEU HDx% 1.0 0.0 8.07 1420 1292 A 55 HIS H A 56 LEU HDy% 1.0 0.0 8.07 1421 1293 A 55 HIS HA A 56 LEU HDx% 1.0 0.0 8.07 1422 1293 A 55 HIS HA A 56 LEU HDy% 1.0 0.0 8.07 1423 1294 A 56 LEU H A 56 LEU HDx% 1.0 0.0 6.02 1424 1294 A 56 LEU H A 56 LEU HDy% 1.0 0.0 6.02 1425 1295 A 57 LEU H A 56 LEU HBy 1.0 0.0 4.42 1426 1295 A 57 LEU H A 56 LEU HBx 1.0 0.0 4.42 1427 1296 A 56 LEU HBx A 79 VAL HGy% 1.0 0.0 7.08 1428 1296 A 56 LEU HBy A 79 VAL HGy% 1.0 0.0 7.08 1429 1296 A 79 VAL HGx% A 56 LEU HBy 1.0 0.0 7.08 1430 1296 A 79 VAL HGx% A 56 LEU HBx 1.0 0.0 7.08 1431 1297 A 56 LEU HBy A 79 VAL HGy% 1.0 0.0 8.28 1432 1298 A 79 VAL HGx% A 56 LEU HBx 1.0 0.0 8.28 1433 1299 A 100 MET HE% A 56 LEU HBy 1.0 0.0 6.59 1434 1299 A 100 MET HE% A 56 LEU HBx 1.0 0.0 6.59 1435 1300 A 57 LEU H A 56 LEU HDx% 1.0 0.0 5.94 1436 1300 A 57 LEU H A 56 LEU HDy% 1.0 0.0 5.94 1437 1301 A 56 LEU HDy% A 79 VAL HGy% 1.0 0.0 8.38 1438 1301 A 56 LEU HDx% A 79 VAL HGy% 1.0 0.0 8.38 1439 1301 A 79 VAL HGx% A 56 LEU HDx% 1.0 0.0 8.38 1440 1301 A 56 LEU HDy% A 79 VAL HGx% 1.0 0.0 8.38 1441 1302 A 79 VAL HGx% A 56 LEU HDx% 1.0 0.0 10.13 1442 1303 A 56 LEU HDx% A 79 VAL HGy% 1.0 0.0 10.13 1443 1304 A 56 LEU HDx% A 100 MET HGx 1.0 0.0 8.02 1444 1304 A 56 LEU HDy% A 100 MET HGx 1.0 0.0 8.02 1445 1304 A 100 MET HGy A 56 LEU HDx% 1.0 0.0 8.02 1446 1304 A 56 LEU HDy% A 100 MET HGy 1.0 0.0 8.02 1447 1305 A 56 LEU HDy% A 100 MET HGy 1.0 0.0 9.61 1448 1306 A 56 LEU HDy% A 100 MET HGx 1.0 0.0 9.61 1449 1307 A 100 MET HE% A 56 LEU HDx% 1.0 0.0 8.93 1450 1307 A 100 MET HE% A 56 LEU HDy% 1.0 0.0 8.93 1451 1308 A 60 ILE HB A 57 LEU HDx% 1.0 0.0 8.07 1452 1308 A 60 ILE HB A 57 LEU HDy% 1.0 0.0 8.07 1453 1309 A 57 LEU HDx% A 61 LYS HBx 1.0 0.0 7.24 1454 1309 A 57 LEU HDy% A 61 LYS HBx 1.0 0.0 7.24 1455 1309 A 61 LYS HBy A 57 LEU HDx% 1.0 0.0 7.24 1456 1309 A 57 LEU HDy% A 61 LYS HBy 1.0 0.0 7.24 1457 1310 A 61 LYS HBy A 57 LEU HDx% 1.0 0.0 8.28 1458 1311 A 57 LEU HDy% A 61 LYS HBy 1.0 0.0 8.28 1459 1312 A 57 LEU HDy% A 61 LYS HGx 1.0 0.0 8.95 1460 1312 A 57 LEU HDx% A 61 LYS HGx 1.0 0.0 8.95 1461 1312 A 61 LYS HGy A 57 LEU HDx% 1.0 0.0 8.95 1462 1312 A 57 LEU HDy% A 61 LYS HGy 1.0 0.0 8.95 1463 1313 A 57 LEU HDx% A 61 LYS HDx 1.0 0.0 6.77 1464 1313 A 57 LEU HDy% A 61 LYS HDx 1.0 0.0 6.77 1465 1313 A 61 LYS HDy A 57 LEU HDx% 1.0 0.0 6.77 1466 1313 A 57 LEU HDy% A 61 LYS HDy 1.0 0.0 6.77 1467 1314 A 57 LEU HDy% A 61 LYS HDy 1.0 0.0 8.29 1468 1315 A 57 LEU HDx% A 61 LYS HEx 1.0 0.0 8.30 1469 1315 A 57 LEU HDy% A 61 LYS HEx 1.0 0.0 8.30 1470 1315 A 61 LYS HEy A 57 LEU HDx% 1.0 0.0 8.30 1471 1315 A 57 LEU HDy% A 61 LYS HEy 1.0 0.0 8.30 1472 1316 A 76 GLN HB2 A 57 LEU HDx% 1.0 0.0 8.07 1473 1316 A 76 GLN HB2 A 57 LEU HDy% 1.0 0.0 8.07 1474 1317 A 57 LEU HDy% A 76 GLN HGy 1.0 0.0 7.24 1475 1317 A 57 LEU HDx% A 76 GLN HGy 1.0 0.0 7.24 1476 1317 A 76 GLN HGx A 57 LEU HDx% 1.0 0.0 7.24 1477 1317 A 57 LEU HDy% A 76 GLN HGx 1.0 0.0 7.24 1478 1318 A 76 GLN HGx A 57 LEU HDx% 1.0 0.0 8.28 1479 1319 A 57 LEU HDy% A 76 GLN HGx 1.0 0.0 8.28 1480 1320 A 100 MET HA A 57 LEU HDx% 1.0 0.0 8.07 1481 1320 A 100 MET HA A 57 LEU HDy% 1.0 0.0 8.07 1482 1321 A 57 LEU HDy% A 100 MET HBx 1.0 0.0 8.95 1483 1321 A 57 LEU HDx% A 100 MET HBx 1.0 0.0 8.95 1484 1321 A 100 MET HBy A 57 LEU HDx% 1.0 0.0 8.95 1485 1321 A 100 MET HBy A 57 LEU HDy% 1.0 0.0 8.95 1486 1322 A 57 LEU HDx% A 100 MET HGx 1.0 0.0 8.95 1487 1322 A 57 LEU HDy% A 100 MET HGx 1.0 0.0 8.95 1488 1322 A 100 MET HGy A 57 LEU HDx% 1.0 0.0 8.95 1489 1322 A 57 LEU HDy% A 100 MET HGy 1.0 0.0 8.95 1490 1323 A 100 MET HE% A 57 LEU HDx% 1.0 0.0 8.56 1491 1323 A 100 MET HE% A 57 LEU HDy% 1.0 0.0 8.56 1492 1324 A 58 ALA H A 59 PRO HDx 1.0 0.0 4.49 1493 1324 A 58 ALA H A 59 PRO HDy 1.0 0.0 4.49 1494 1325 A 58 ALA HA A 61 LYS HBx 1.0 0.0 4.27 1495 1325 A 58 ALA HA A 61 LYS HBy 1.0 0.0 4.27 1496 1326 A 60 ILE H A 59 PRO HDx 1.0 0.0 5.50 1497 1326 A 60 ILE H A 59 PRO HDy 1.0 0.0 5.50 1498 1327 A 60 ILE H A 60 ILE HG1y 1.0 0.0 5.01 1499 1327 A 60 ILE H A 60 ILE HG1x 1.0 0.0 5.01 1500 1328 A 61 LYS H A 60 ILE HG1y 1.0 0.0 5.22 1501 1328 A 61 LYS H A 60 ILE HG1x 1.0 0.0 5.22 1502 1329 A 76 GLN HA A 60 ILE HG1y 1.0 0.0 6.38 1503 1329 A 76 GLN HA A 60 ILE HG1x 1.0 0.0 6.38 1504 1330 A 61 LYS H A 61 LYS HGx 1.0 0.0 5.33 1505 1330 A 61 LYS H A 61 LYS HGy 1.0 0.0 5.33 1506 1331 A 61 LYS HA A 63 VAL HGy% 1.0 0.0 8.07 1507 1331 A 61 LYS HA A 63 VAL HGx% 1.0 0.0 8.07 1508 1332 A 62 GLU H A 61 LYS HBx 1.0 0.0 4.10 1509 1332 A 62 GLU H A 61 LYS HBy 1.0 0.0 4.10 1510 1333 A 62 GLU H A 62 GLU HGx 1.0 0.0 4.87 1511 1333 A 62 GLU H A 62 GLU HGy 1.0 0.0 4.87 1512 1334 A 62 GLU H A 63 VAL HGy% 1.0 0.0 8.07 1513 1334 A 62 GLU H A 63 VAL HGx% 1.0 0.0 8.07 1514 1335 A 62 GLU HA A 63 VAL HGy% 1.0 0.0 8.07 1515 1335 A 63 VAL HGx% A 62 GLU HA 1.0 0.0 8.07 1516 1336 A 62 GLU HBx A 63 VAL HGy% 1.0 0.0 8.02 1517 1336 A 62 GLU HBy A 63 VAL HGy% 1.0 0.0 8.02 1518 1336 A 63 VAL HGx% A 62 GLU HBx 1.0 0.0 8.02 1519 1336 A 63 VAL HGx% A 62 GLU HBy 1.0 0.0 8.02 1520 1337 A 62 GLU HBx A 63 VAL HGy% 1.0 0.0 9.62 1521 1338 A 62 GLU HBy A 63 VAL HGy% 1.0 0.0 9.62 1522 1339 A 66 SER H A 63 VAL HGy% 1.0 0.0 8.07 1523 1339 A 66 SER H A 63 VAL HGx% 1.0 0.0 8.07 1524 1340 A 68 LYS H A 63 VAL HGy% 1.0 0.0 8.07 1525 1340 A 68 LYS H A 63 VAL HGx% 1.0 0.0 8.07 1526 1341 A 63 VAL HGy% A 68 LYS HBx 1.0 0.0 7.28 1527 1341 A 63 VAL HGx% A 68 LYS HBx 1.0 0.0 7.28 1528 1341 A 68 LYS HBy A 63 VAL HGy% 1.0 0.0 7.28 1529 1341 A 63 VAL HGx% A 68 LYS HBy 1.0 0.0 7.28 1530 1342 A 63 VAL HGx% A 68 LYS HBy 1.0 0.0 9.22 1531 1343 A 63 VAL HGx% A 68 LYS HBx 1.0 0.0 9.22 1532 1344 A 63 VAL HGx% A 68 LYS HGx 1.0 0.0 8.02 1533 1344 A 63 VAL HGy% A 68 LYS HGx 1.0 0.0 8.02 1534 1344 A 68 LYS HGy A 63 VAL HGy% 1.0 0.0 8.02 1535 1344 A 63 VAL HGx% A 68 LYS HGy 1.0 0.0 8.02 1536 1345 A 63 VAL HGx% A 68 LYS HGy 1.0 0.0 9.62 1537 1346 A 63 VAL HGx% A 68 LYS HGx 1.0 0.0 9.62 1538 1347 A 63 VAL HGx% A 68 LYS HDy 1.0 0.0 8.02 1539 1347 A 63 VAL HGy% A 68 LYS HDy 1.0 0.0 8.02 1540 1347 A 68 LYS HDx A 63 VAL HGy% 1.0 0.0 8.02 1541 1347 A 63 VAL HGx% A 68 LYS HDx 1.0 0.0 8.02 1542 1348 A 63 VAL HGx% A 68 LYS HDx 1.0 0.0 9.62 1543 1349 A 63 VAL HGx% A 68 LYS HDy 1.0 0.0 9.62 1544 1350 A 63 VAL HGx% A 68 LYS HEy 1.0 0.0 8.02 1545 1350 A 63 VAL HGy% A 68 LYS HEy 1.0 0.0 8.02 1546 1350 A 68 LYS HEx A 63 VAL HGy% 1.0 0.0 8.02 1547 1350 A 63 VAL HGx% A 68 LYS HEx 1.0 0.0 8.02 1548 1351 A 63 VAL HGx% A 68 LYS HEx 1.0 0.0 9.62 1549 1352 A 63 VAL HGx% A 68 LYS HEy 1.0 0.0 9.62 1550 1353 A 71 VAL H A 63 VAL HGy% 1.0 0.0 8.07 1551 1353 A 71 VAL H A 63 VAL HGx% 1.0 0.0 8.07 1552 1354 A 71 VAL HB A 63 VAL HGy% 1.0 0.0 7.76 1553 1354 A 71 VAL HB A 63 VAL HGx% 1.0 0.0 7.76 1554 1355 A 63 VAL HGy% A 71 VAL HGy% 1.0 0.0 8.91 1555 1355 A 63 VAL HGx% A 71 VAL HGy% 1.0 0.0 8.91 1556 1355 A 71 VAL HGx% A 63 VAL HGy% 1.0 0.0 8.91 1557 1355 A 63 VAL HGx% A 71 VAL HGx% 1.0 0.0 8.91 1558 1356 A 63 VAL HGx% A 71 VAL HGx% 1.0 0.0 10.64 1559 1357 A 71 VAL HGx% A 63 VAL HGy% 1.0 0.0 10.64 1560 1358 A 72 ALA H A 63 VAL HGy% 1.0 0.0 7.17 1561 1358 A 72 ALA H A 63 VAL HGx% 1.0 0.0 7.17 1562 1359 A 64 ASP HA A 104 LEU HDx% 1.0 0.0 8.07 1563 1359 A 64 ASP HA A 104 LEU HDy% 1.0 0.0 8.07 1564 1360 A 64 ASP HB2 A 104 LEU HDx% 1.0 0.0 8.07 1565 1360 A 64 ASP HB2 A 104 LEU HDy% 1.0 0.0 8.07 1566 1361 A 64 ASP HB3 A 104 LEU HDx% 1.0 0.0 8.07 1567 1361 A 64 ASP HB3 A 104 LEU HDy% 1.0 0.0 8.07 1568 1362 A 68 LYS HGy A 71 VAL HGy% 1.0 0.0 8.55 1569 1362 A 68 LYS HGx A 71 VAL HGy% 1.0 0.0 8.55 1570 1362 A 71 VAL HGx% A 68 LYS HGx 1.0 0.0 8.55 1571 1362 A 71 VAL HGx% A 68 LYS HGy 1.0 0.0 8.55 1572 1363 A 68 LYS HEx A 71 VAL HGy% 1.0 0.0 8.02 1573 1363 A 68 LYS HEy A 71 VAL HGy% 1.0 0.0 8.02 1574 1363 A 71 VAL HGx% A 68 LYS HEy 1.0 0.0 8.02 1575 1363 A 71 VAL HGx% A 68 LYS HEx 1.0 0.0 8.02 1576 1364 A 68 LYS HEx A 71 VAL HGy% 1.0 0.0 9.62 1577 1365 A 68 LYS HEy A 71 VAL HGy% 1.0 0.0 9.62 1578 1366 A 70 ASP H A 71 VAL HGy% 1.0 0.0 8.07 1579 1366 A 70 ASP H A 71 VAL HGx% 1.0 0.0 8.07 1580 1367 A 70 ASP HA A 73 GLN HBx 1.0 0.0 4.63 1581 1367 A 70 ASP HA A 73 GLN HBy 1.0 0.0 4.63 1582 1368 A 70 ASP HBy A 71 VAL HGy% 1.0 0.0 8.95 1583 1368 A 70 ASP HBx A 71 VAL HGy% 1.0 0.0 8.95 1584 1368 A 71 VAL HGx% A 70 ASP HBx 1.0 0.0 8.95 1585 1368 A 71 VAL HGx% A 70 ASP HBy 1.0 0.0 8.95 1586 1369 A 71 VAL HA A 74 ARG HBy 1.0 0.0 4.17 1587 1369 A 71 VAL HA A 74 ARG HBx 1.0 0.0 4.17 1588 1370 A 72 ALA H A 71 VAL HGy% 1.0 0.0 6.21 1589 1370 A 72 ALA H A 71 VAL HGx% 1.0 0.0 6.21 1590 1371 A 72 ALA HB% A 71 VAL HGy% 1.0 0.0 9.09 1591 1371 A 72 ALA HB% A 71 VAL HGx% 1.0 0.0 9.09 1592 1372 A 71 VAL HGy% A 74 ARG HBy 1.0 0.0 8.95 1593 1372 A 74 ARG HBx A 71 VAL HGy% 1.0 0.0 8.95 1594 1372 A 71 VAL HGx% A 74 ARG HBx 1.0 0.0 8.95 1595 1372 A 71 VAL HGx% A 74 ARG HBy 1.0 0.0 8.95 1596 1373 A 75 LEU HG A 71 VAL HGy% 1.0 0.0 8.07 1597 1373 A 75 LEU HG A 71 VAL HGx% 1.0 0.0 8.07 1598 1374 A 71 VAL HGy% A 75 LEU HDx% 1.0 0.0 10.63 1599 1374 A 71 VAL HGx% A 75 LEU HDx% 1.0 0.0 10.63 1600 1374 A 75 LEU HDy% A 71 VAL HGy% 1.0 0.0 10.63 1601 1374 A 75 LEU HDy% A 71 VAL HGx% 1.0 0.0 10.63 1602 1375 A 72 ALA H A 73 GLN HBx 1.0 0.0 6.38 1603 1375 A 72 ALA H A 73 GLN HBy 1.0 0.0 6.38 1604 1376 A 72 ALA HB% A 73 GLN HBx 1.0 0.0 7.40 1605 1376 A 72 ALA HB% A 73 GLN HBy 1.0 0.0 7.40 1606 1377 A 72 ALA HB% A 75 LEU HDx% 1.0 0.0 9.09 1607 1377 A 72 ALA HB% A 75 LEU HDy% 1.0 0.0 9.09 1608 1378 A 72 ALA HB% A 104 LEU HDx% 1.0 0.0 9.09 1609 1378 A 72 ALA HB% A 104 LEU HDy% 1.0 0.0 9.09 1610 1379 A 73 GLN HBy A 104 LEU HDx% 1.0 0.0 6.77 1611 1379 A 73 GLN HBx A 104 LEU HDx% 1.0 0.0 6.77 1612 1379 A 104 LEU HDy% A 73 GLN HBx 1.0 0.0 6.77 1613 1379 A 104 LEU HDy% A 73 GLN HBy 1.0 0.0 6.77 1614 1380 A 73 GLN HBx A 104 LEU HDx% 1.0 0.0 8.28 1615 1381 A 101 ALA HB% A 73 GLN HGy 1.0 0.0 7.40 1616 1381 A 101 ALA HB% A 73 GLN HGx 1.0 0.0 7.40 1617 1382 A 73 GLN HE2y A 104 LEU HBy 1.0 0.0 7.24 1618 1382 A 73 GLN HE2y A 104 LEU HBx 1.0 0.0 7.24 1619 1382 A 73 GLN HE2x A 104 LEU HBx 1.0 0.0 7.24 1620 1382 A 73 GLN HE2x A 104 LEU HBy 1.0 0.0 7.24 1621 1383 A 75 LEU H A 74 ARG HBy 1.0 0.0 3.79 1622 1383 A 75 LEU H A 74 ARG HBx 1.0 0.0 3.79 1623 1384 A 76 GLN H A 76 GLN HGy 1.0 0.0 3.92 1624 1384 A 76 GLN H A 76 GLN HGx 1.0 0.0 3.92 1625 1385 A 76 GLN HA A 78 ARG HBy 1.0 0.0 5.95 1626 1385 A 76 GLN HA A 78 ARG HBx 1.0 0.0 5.95 1627 1386 A 76 GLN HA A 79 VAL HGy% 1.0 0.0 7.70 1628 1386 A 76 GLN HA A 79 VAL HGx% 1.0 0.0 7.70 1629 1387 A 76 GLN HB2 A 76 GLN HGy 1.0 0.0 2.62 1630 1387 A 76 GLN HB2 A 76 GLN HGx 1.0 0.0 2.62 1631 1388 A 77 GLN H A 76 GLN HGy 1.0 0.0 3.82 1632 1388 A 77 GLN H A 76 GLN HGx 1.0 0.0 3.82 1633 1389 A 77 GLN H A 77 GLN HBx 1.0 0.0 3.60 1634 1389 A 77 GLN H A 77 GLN HBy 1.0 0.0 3.60 1635 1390 A 77 GLN H A 77 GLN HGy 1.0 0.0 4.98 1636 1390 A 77 GLN H A 77 GLN HGx 1.0 0.0 4.98 1637 1391 A 78 ARG H A 77 GLN HBx 1.0 0.0 4.11 1638 1391 A 78 ARG H A 77 GLN HBy 1.0 0.0 4.11 1639 1392 A 82 ILE HG2% A 79 VAL HGy% 1.0 0.0 9.09 1640 1392 A 82 ILE HG2% A 79 VAL HGx% 1.0 0.0 9.09 1641 1393 A 97 ALA HB% A 79 VAL HGy% 1.0 0.0 9.09 1642 1393 A 97 ALA HB% A 79 VAL HGx% 1.0 0.0 9.09 1643 1394 A 79 VAL HGy% A 100 MET HGx 1.0 0.0 8.95 1644 1394 A 79 VAL HGx% A 100 MET HGx 1.0 0.0 8.95 1645 1394 A 100 MET HGy A 79 VAL HGy% 1.0 0.0 8.95 1646 1394 A 79 VAL HGx% A 100 MET HGy 1.0 0.0 8.95 1647 1395 A 100 MET HE% A 79 VAL HGy% 1.0 0.0 7.04 1648 1395 A 100 MET HE% A 79 VAL HGx% 1.0 0.0 7.04 1649 1396 A 81 ALA HA A 84 ARG HBy 1.0 0.0 5.08 1650 1396 A 81 ALA HA A 84 ARG HBx 1.0 0.0 5.08 1651 1397 A 81 ALA HA A 84 ARG HDx 1.0 0.0 6.38 1652 1397 A 81 ALA HA A 84 ARG HDy 1.0 0.0 6.38 1653 1398 A 81 ALA HB% A 82 ILE HG1y 1.0 0.0 7.40 1654 1398 A 81 ALA HB% A 82 ILE HG1x 1.0 0.0 7.40 1655 1399 A 82 ILE H A 82 ILE HG1y 1.0 0.0 4.92 1656 1399 A 82 ILE H A 82 ILE HG1x 1.0 0.0 4.92 1657 1400 A 82 ILE HG2% A 85 TYR HBx 1.0 0.0 7.40 1658 1400 A 82 ILE HG2% A 85 TYR HBy 1.0 0.0 7.40 1659 1401 A 83 MET HBx A 87 VAL HGy% 1.0 0.0 8.79 1660 1401 A 83 MET HBy A 87 VAL HGy% 1.0 0.0 8.79 1661 1401 A 87 VAL HGx% A 83 MET HBx 1.0 0.0 8.79 1662 1401 A 83 MET HBy A 87 VAL HGx% 1.0 0.0 8.79 1663 1402 A 83 MET HE% A 96 PRO HDx 1.0 0.0 6.16 1664 1402 A 83 MET HE% A 96 PRO HDy 1.0 0.0 6.16 1665 1403 A 84 ARG H A 84 ARG HGx 1.0 0.0 5.32 1666 1403 A 84 ARG H A 84 ARG HGy 1.0 0.0 5.32 1667 1404 A 84 ARG H A 87 VAL HGy% 1.0 0.0 8.07 1668 1404 A 84 ARG H A 87 VAL HGx% 1.0 0.0 8.07 1669 1405 A 84 ARG HA A 87 VAL HGy% 1.0 0.0 6.18 1670 1405 A 84 ARG HA A 87 VAL HGx% 1.0 0.0 6.18 1671 1406 A 86 ALA H A 87 VAL HGy% 1.0 0.0 8.07 1672 1406 A 86 ALA H A 87 VAL HGx% 1.0 0.0 8.07 1673 1407 A 86 ALA HA A 91 TYR HBx 1.0 0.0 6.38 1674 1407 A 86 ALA HA A 91 TYR HBy 1.0 0.0 6.38 1675 1408 A 86 ALA HB% A 91 TYR HBx 1.0 0.0 6.35 1676 1408 A 86 ALA HB% A 91 TYR HBy 1.0 0.0 6.35 1677 1409 A 86 ALA HB% A 92 ILE HG1y 1.0 0.0 7.40 1678 1409 A 86 ALA HB% A 92 ILE HG1x 1.0 0.0 7.40 1679 1410 A 87 VAL H A 92 ILE HG1y 1.0 0.0 6.38 1680 1410 A 87 VAL H A 92 ILE HG1x 1.0 0.0 6.38 1681 1411 A 87 VAL HA A 91 TYR HBx 1.0 0.0 6.38 1682 1411 A 87 VAL HA A 91 TYR HBy 1.0 0.0 6.38 1683 1412 A 87 VAL HA A 92 ILE HG1y 1.0 0.0 6.38 1684 1412 A 87 VAL HA A 92 ILE HG1x 1.0 0.0 6.38 1685 1413 A 88 GLN H A 87 VAL HGy% 1.0 0.0 5.47 1686 1413 A 88 GLN H A 87 VAL HGx% 1.0 0.0 5.47 1687 1414 A 88 GLN HA A 87 VAL HGy% 1.0 0.0 7.51 1688 1414 A 88 GLN HA A 87 VAL HGx% 1.0 0.0 7.51 1689 1415 A 87 VAL HGy% A 88 GLN HBx 1.0 0.0 8.95 1690 1415 A 88 GLN HBy A 87 VAL HGy% 1.0 0.0 8.95 1691 1415 A 87 VAL HGx% A 88 GLN HBy 1.0 0.0 8.95 1692 1415 A 87 VAL HGx% A 88 GLN HBx 1.0 0.0 8.95 1693 1416 A 87 VAL HGy% A 88 GLN HGy 1.0 0.0 8.95 1694 1416 A 87 VAL HGx% A 88 GLN HGy 1.0 0.0 8.95 1695 1416 A 88 GLN HGx A 87 VAL HGy% 1.0 0.0 8.95 1696 1416 A 87 VAL HGx% A 88 GLN HGx 1.0 0.0 8.95 1697 1417 A 89 ASN H A 87 VAL HGy% 1.0 0.0 8.07 1698 1417 A 89 ASN H A 87 VAL HGx% 1.0 0.0 8.07 1699 1418 A 92 ILE H A 87 VAL HGy% 1.0 0.0 8.07 1700 1418 A 92 ILE H A 87 VAL HGx% 1.0 0.0 8.07 1701 1419 A 87 VAL HGx% A 92 ILE HG1y 1.0 0.0 7.52 1702 1419 A 87 VAL HGy% A 92 ILE HG1y 1.0 0.0 7.52 1703 1419 A 92 ILE HG1x A 87 VAL HGy% 1.0 0.0 7.52 1704 1419 A 87 VAL HGx% A 92 ILE HG1x 1.0 0.0 7.52 1705 1420 A 94 SER H A 87 VAL HGy% 1.0 0.0 8.07 1706 1420 A 94 SER H A 87 VAL HGx% 1.0 0.0 8.07 1707 1421 A 94 SER HA A 87 VAL HGy% 1.0 0.0 7.91 1708 1421 A 87 VAL HGx% A 94 SER HA 1.0 0.0 7.91 1709 1422 A 87 VAL HGx% A 94 SER HBy 1.0 0.0 8.02 1710 1422 A 87 VAL HGy% A 94 SER HBy 1.0 0.0 8.02 1711 1422 A 94 SER HBx A 87 VAL HGy% 1.0 0.0 8.02 1712 1422 A 87 VAL HGx% A 94 SER HBx 1.0 0.0 8.02 1713 1423 A 87 VAL HGy% A 94 SER HBy 1.0 0.0 9.62 1714 1424 A 94 SER HBx A 87 VAL HGy% 1.0 0.0 9.62 1715 1425 A 95 ASN H A 87 VAL HGy% 1.0 0.0 8.07 1716 1425 A 95 ASN H A 87 VAL HGx% 1.0 0.0 8.07 1717 1426 A 95 ASN HA A 87 VAL HGy% 1.0 0.0 8.07 1718 1426 A 95 ASN HA A 87 VAL HGx% 1.0 0.0 8.07 1719 1427 A 87 VAL HGx% A 95 ASN HBy 1.0 0.0 7.46 1720 1427 A 87 VAL HGy% A 95 ASN HBy 1.0 0.0 7.46 1721 1427 A 95 ASN HBx A 87 VAL HGy% 1.0 0.0 7.46 1722 1427 A 87 VAL HGx% A 95 ASN HBx 1.0 0.0 7.46 1723 1428 A 87 VAL HGy% A 95 ASN HBy 1.0 0.0 9.40 1724 1429 A 95 ASN HBx A 87 VAL HGy% 1.0 0.0 9.40 1725 1430 A 95 ASN HD2y A 87 VAL HGy% 1.0 0.0 8.93 1726 1430 A 95 ASN HD2x A 87 VAL HGx% 1.0 0.0 8.93 1727 1430 A 95 ASN HD2x A 87 VAL HGy% 1.0 0.0 8.93 1728 1430 A 95 ASN HD2y A 87 VAL HGx% 1.0 0.0 8.93 1729 1431 A 87 VAL HGy% A 96 PRO HDx 1.0 0.0 8.96 1730 1431 A 87 VAL HGx% A 96 PRO HDx 1.0 0.0 8.96 1731 1431 A 96 PRO HDy A 87 VAL HGy% 1.0 0.0 8.96 1732 1431 A 87 VAL HGx% A 96 PRO HDy 1.0 0.0 8.96 1733 1432 A 88 GLN H A 88 GLN HBx 1.0 0.0 3.74 1734 1432 A 88 GLN H A 88 GLN HBy 1.0 0.0 3.74 1735 1433 A 88 GLN H A 88 GLN HGy 1.0 0.0 4.96 1736 1433 A 88 GLN H A 88 GLN HGx 1.0 0.0 4.96 1737 1434 A 89 ASN HD2x A 88 GLN HBx 1.0 0.0 6.30 1738 1434 A 89 ASN HD2y A 88 GLN HBy 1.0 0.0 6.30 1739 1434 A 89 ASN HD2x A 88 GLN HBy 1.0 0.0 6.30 1740 1434 A 89 ASN HD2y A 88 GLN HBx 1.0 0.0 6.30 1741 1435 A 89 ASN HD2y A 88 GLN HBy 1.0 0.0 7.23 1742 1436 A 89 ASN HD2x A 88 GLN HBx 1.0 0.0 7.23 1743 1437 A 92 ILE HB A 96 PRO HDx 1.0 0.0 6.39 1744 1437 A 92 ILE HB A 96 PRO HDy 1.0 0.0 6.39 1745 1438 A 92 ILE HD1% A 96 PRO HGx 1.0 0.0 6.14 1746 1438 A 92 ILE HD1% A 96 PRO HGy 1.0 0.0 6.14 1747 1439 A 92 ILE HD1% A 96 PRO HDx 1.0 0.0 7.41 1748 1439 A 92 ILE HD1% A 96 PRO HDy 1.0 0.0 7.41 1749 1440 A 94 SER H A 93 ASP HBx 1.0 0.0 4.34 1750 1440 A 94 SER H A 93 ASP HBy 1.0 0.0 4.34 1751 1441 A 93 ASP HBy A 94 SER HBy 1.0 0.0 5.86 1752 1441 A 93 ASP HBx A 94 SER HBy 1.0 0.0 5.86 1753 1441 A 94 SER HBx A 93 ASP HBx 1.0 0.0 5.86 1754 1441 A 94 SER HBx A 93 ASP HBy 1.0 0.0 5.86 1755 1442 A 94 SER HBx A 93 ASP HBy 1.0 0.0 7.26 1756 1443 A 95 ASN H A 96 PRO HDx 1.0 0.0 6.39 1757 1443 A 95 ASN H A 96 PRO HDy 1.0 0.0 6.39 1758 1444 A 95 ASN HBx A 96 PRO HDx 1.0 0.0 7.27 1759 1444 A 95 ASN HBy A 96 PRO HDx 1.0 0.0 7.27 1760 1444 A 96 PRO HDy A 95 ASN HBy 1.0 0.0 7.27 1761 1444 A 96 PRO HDy A 95 ASN HBx 1.0 0.0 7.27 1762 1445 A 97 ALA H A 96 PRO HDx 1.0 0.0 5.26 1763 1445 A 97 ALA H A 96 PRO HDy 1.0 0.0 5.26 1764 1446 A 97 ALA HB% A 100 MET HGx 1.0 0.0 6.31 1765 1446 A 97 ALA HB% A 100 MET HGy 1.0 0.0 6.31 1766 1447 A 98 SER H A 98 SER HBy 1.0 0.0 3.85 1767 1447 A 98 SER H A 98 SER HBx 1.0 0.0 3.85 1768 1448 A 98 SER HBy A 99 ASP HBx 1.0 0.0 7.26 1769 1448 A 98 SER HBx A 99 ASP HBx 1.0 0.0 7.26 1770 1448 A 99 ASP HBy A 98 SER HBy 1.0 0.0 7.26 1771 1448 A 99 ASP HBy A 98 SER HBx 1.0 0.0 7.26 1772 1449 A 100 MET H A 100 MET HGx 1.0 0.0 5.02 1773 1449 A 100 MET H A 100 MET HGy 1.0 0.0 5.02 1774 1450 A 101 ALA H A 100 MET HBx 1.0 0.0 4.46 1775 1450 A 101 ALA H A 100 MET HBy 1.0 0.0 4.46 1776 1451 A 101 ALA HA A 104 LEU HDx% 1.0 0.0 8.07 1777 1451 A 101 ALA HA A 104 LEU HDy% 1.0 0.0 8.07 1778 1452 A 104 LEU H A 104 LEU HDx% 1.0 0.0 6.05 1779 1452 A 104 LEU H A 104 LEU HDy% 1.0 0.0 6.05 1780 1453 A 108 LYS H A 108 LYS HBx 1.0 0.0 3.90 1781 1453 A 108 LYS H A 108 LYS HBy 1.0 0.0 3.90 1782 1454 A 108 LYS HBx A 108 LYS HDx 1.0 0.0 3.53 1783 1454 A 108 LYS HBy A 108 LYS HDx 1.0 0.0 3.53 1784 1454 A 108 LYS HDy A 108 LYS HBx 1.0 0.0 3.53 1785 1454 A 108 LYS HBy A 108 LYS HDy 1.0 0.0 3.53 1786 1455 A 112 TYR HBy A 113 PRO HDx 1.0 0.0 7.27 1787 1455 A 112 TYR HBx A 113 PRO HDx 1.0 0.0 7.27 1788 1455 A 113 PRO HDy A 112 TYR HBy 1.0 0.0 7.27 1789 1455 A 112 TYR HBx A 113 PRO HDy 1.0 0.0 7.27 1790 1456 A 115 GLU H A 114 LEU HBy 1.0 0.0 4.45 1791 1456 A 115 GLU H A 114 LEU HBx 1.0 0.0 4.45 1792 1457 A 115 GLU H A 115 GLU HBy 1.0 0.0 3.87 1793 1457 A 115 GLU H A 115 GLU HBx 1.0 0.0 3.87 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type undefined _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 8 THR C A 9 PHE N A 9 PHE CA A 9 PHE C 1.0 -71.0 -49.0 PHI 2 2 A 9 PHE N A 9 PHE CA A 9 PHE C A 10 GLU N 1.0 -49.0 -27.0 PSI 3 3 A 9 PHE C A 10 GLU N A 10 GLU CA A 10 GLU C 1.0 -81.0 -49.0 PHI 4 4 A 10 GLU N A 10 GLU CA A 10 GLU C A 11 THR N 1.0 -53.0 -33.0 PSI 5 5 A 10 GLU C A 11 THR N A 11 THR CA A 11 THR C 1.0 -73.0 -53.0 PHI 6 6 A 11 THR N A 11 THR CA A 11 THR C A 12 ILE N 1.0 -51.0 -31.0 PSI 7 7 A 11 THR C A 12 ILE N A 12 ILE CA A 12 ILE C 1.0 -75.0 -55.0 PHI 8 8 A 12 ILE N A 12 ILE CA A 12 ILE C A 13 ALA N 1.0 -53.0 -29.0 PSI 9 9 A 12 ILE C A 13 ALA N A 13 ALA CA A 13 ALA C 1.0 -75.0 -53.0 PHI 10 10 A 13 ALA N A 13 ALA CA A 13 ALA C A 14 ARG N 1.0 -51.0 -29.0 PSI 11 11 A 13 ALA C A 14 ARG N A 14 ARG CA A 14 ARG C 1.0 -77.0 -53.0 PHI 12 12 A 14 ARG N A 14 ARG CA A 14 ARG C A 15 GLU N 1.0 -53.0 -29.0 PSI 13 13 A 14 ARG C A 15 GLU N A 15 GLU CA A 15 GLU C 1.0 -81.0 -57.0 PHI 14 14 A 15 GLU N A 15 GLU CA A 15 GLU C A 16 TRP N 1.0 -57.0 -25.0 PSI 15 15 A 15 GLU C A 16 TRP N A 16 TRP CA A 16 TRP C 1.0 -79.0 -55.0 PHI 16 16 A 16 TRP N A 16 TRP CA A 16 TRP C A 17 HIS N 1.0 -45.0 -25.0 PSI 17 17 A 16 TRP C A 17 HIS N A 17 HIS CA A 17 HIS C 1.0 -75.0 -51.0 PHI 18 18 A 17 HIS N A 17 HIS CA A 17 HIS C A 18 GLU N 1.0 -53.0 -29.0 PSI 19 19 A 17 HIS C A 18 GLU N A 18 GLU CA A 18 GLU C 1.0 -79.0 -55.0 PHI 20 20 A 18 GLU N A 18 GLU CA A 18 GLU C A 19 SER N 1.0 -53.0 5.0 PSI 21 21 A 18 GLU C A 19 SER N A 19 SER CA A 19 SER C 1.0 -129.0 -49.0 PHI 22 22 A 19 SER N A 19 SER CA A 19 SER C A 20 ASN N 1.0 -57.0 21.0 PSI 23 23 A 24 SER C A 25 GLU N A 25 GLU CA A 25 GLU C 1.0 -69.0 -45.0 PHI 24 24 A 25 GLU N A 25 GLU CA A 25 GLU C A 26 ASP N 1.0 -53.0 -27.0 PSI 25 25 A 25 GLU C A 26 ASP N A 26 ASP CA A 26 ASP C 1.0 -77.0 -53.0 PHI 26 26 A 26 ASP N A 26 ASP CA A 26 ASP C A 27 HIS N 1.0 -51.0 -31.0 PSI 27 27 A 26 ASP C A 27 HIS N A 27 HIS CA A 27 HIS C 1.0 -75.0 -51.0 PHI 28 28 A 27 HIS N A 27 HIS CA A 27 HIS C A 28 ARG N 1.0 -55.0 -29.0 PSI 29 29 A 27 HIS C A 28 ARG N A 28 ARG CA A 28 ARG C 1.0 -85.0 -47.0 PHI 30 30 A 28 ARG N A 28 ARG CA A 28 ARG C A 29 SER N 1.0 -47.0 -25.0 PSI 31 31 A 28 ARG C A 29 SER N A 29 SER CA A 29 SER C 1.0 -77.0 -55.0 PHI 32 32 A 29 SER N A 29 SER CA A 29 SER C A 30 ARG N 1.0 -51.0 -27.0 PSI 33 33 A 29 SER C A 30 ARG N A 30 ARG CA A 30 ARG C 1.0 -81.0 -47.0 PHI 34 34 A 30 ARG N A 30 ARG CA A 30 ARG C A 31 VAL N 1.0 -55.0 -35.0 PSI 35 35 A 30 ARG C A 31 VAL N A 31 VAL CA A 31 VAL C 1.0 -87.0 -45.0 PHI 36 36 A 31 VAL N A 31 VAL CA A 31 VAL C A 32 LEU N 1.0 -75.0 -17.0 PSI 37 37 A 31 VAL C A 32 LEU N A 32 LEU CA A 32 LEU C 1.0 -71.0 -51.0 PHI 38 38 A 32 LEU N A 32 LEU CA A 32 LEU C A 33 ARG N 1.0 -55.0 -25.0 PSI 39 39 A 32 LEU C A 33 ARG N A 33 ARG CA A 33 ARG C 1.0 -71.0 -51.0 PHI 40 40 A 33 ARG N A 33 ARG CA A 33 ARG C A 34 TYR N 1.0 -59.0 -31.0 PSI 41 41 A 33 ARG C A 34 TYR N A 34 TYR CA A 34 TYR C 1.0 -83.0 -53.0 PHI 42 42 A 34 TYR N A 34 TYR CA A 34 TYR C A 35 LEU N 1.0 -53.0 -21.0 PSI 43 43 A 34 TYR C A 35 LEU N A 35 LEU CA A 35 LEU C 1.0 -73.0 -47.0 PHI 44 44 A 35 LEU N A 35 LEU CA A 35 LEU C A 36 GLU N 1.0 -63.0 -21.0 PSI 45 45 A 35 LEU C A 36 GLU N A 36 GLU CA A 36 GLU C 1.0 -75.0 -53.0 PHI 46 46 A 36 GLU N A 36 GLU CA A 36 GLU C A 37 LEU N 1.0 -55.0 -31.0 PSI 47 47 A 36 GLU C A 37 LEU N A 37 LEU CA A 37 LEU C 1.0 -103.0 -57.0 PHI 48 48 A 37 LEU N A 37 LEU CA A 37 LEU C A 38 TYR N 1.0 -65.0 -3.0 PSI 49 49 A 37 LEU C A 38 TYR N A 38 TYR CA A 38 TYR C 1.0 -131.0 -47.0 PHI 50 50 A 38 TYR N A 38 TYR CA A 38 TYR C A 39 ILE N 1.0 -75.0 25.0 PSI 51 51 A 41 PRO C A 42 HIS N A 42 HIS CA A 42 HIS C 1.0 -103.0 -71.0 PHI 52 52 A 42 HIS N A 42 HIS CA A 42 HIS C A 43 ILE N 1.0 -69.0 -3.0 PSI 53 53 A 42 HIS C A 43 ILE N A 43 ILE CA A 43 ILE C 1.0 -133.0 -79.0 PHI 54 54 A 43 ILE N A 43 ILE CA A 43 ILE C A 44 GLY N 1.0 -35.0 13.0 PSI 55 55 A 44 GLY C A 45 SER N A 45 SER CA A 45 SER C 1.0 -107.0 -79.0 PHI 56 56 A 45 SER N A 45 SER CA A 45 SER C A 46 SER N 1.0 -31.0 15.0 PSI 57 57 A 46 SER C A 47 ASP N A 47 ASP CA A 47 ASP C 1.0 -107.0 -45.0 PHI 58 58 A 47 ASP N A 47 ASP CA A 47 ASP C A 48 ILE N 1.0 97.0 165.0 PSI 59 59 A 47 ASP C A 48 ILE N A 48 ILE CA A 48 ILE C 1.0 -91.0 -45.0 PHI 60 60 A 48 ILE N A 48 ILE CA A 48 ILE C A 49 ARG N 1.0 -61.0 -5.0 PSI 61 61 A 48 ILE C A 49 ARG N A 49 ARG CA A 49 ARG C 1.0 -91.0 -45.0 PHI 62 62 A 49 ARG N A 49 ARG CA A 49 ARG C A 50 GLN N 1.0 -65.0 7.0 PSI 63 63 A 50 GLN C A 51 LEU N A 51 LEU CA A 51 LEU C 1.0 -147.0 -45.0 PHI 64 64 A 51 LEU N A 51 LEU CA A 51 LEU C A 52 LYS N 1.0 95.0 161.0 PSI 65 65 A 51 LEU C A 52 LYS N A 52 LYS CA A 52 LYS C 1.0 -151.0 -73.0 PHI 66 66 A 52 LYS N A 52 LYS CA A 52 LYS C A 53 THR N 1.0 107.0 175.0 PSI 67 67 A 52 LYS C A 53 THR N A 53 THR CA A 53 THR C 1.0 -119.0 -67.0 PHI 68 68 A 53 THR N A 53 THR CA A 53 THR C A 54 SER N 1.0 161.0 195.0 PSI 69 69 A 53 THR C A 54 SER N A 54 SER CA A 54 SER C 1.0 -93.0 -45.0 PHI 70 70 A 54 SER N A 54 SER CA A 54 SER C A 55 HIS N 1.0 -71.0 17.0 PSI 71 71 A 54 SER C A 55 HIS N A 55 HIS CA A 55 HIS C 1.0 -75.0 -55.0 PHI 72 72 A 55 HIS N A 55 HIS CA A 55 HIS C A 56 LEU N 1.0 -55.0 -29.0 PSI 73 73 A 55 HIS C A 56 LEU N A 56 LEU CA A 56 LEU C 1.0 -81.0 -49.0 PHI 74 74 A 56 LEU N A 56 LEU CA A 56 LEU C A 57 LEU N 1.0 -53.0 -17.0 PSI 75 75 A 56 LEU C A 57 LEU N A 57 LEU CA A 57 LEU C 1.0 -99.0 -53.0 PHI 76 76 A 57 LEU N A 57 LEU CA A 57 LEU C A 58 ALA N 1.0 -61.0 -5.0 PSI 77 77 A 57 LEU C A 58 ALA N A 58 ALA CA A 58 ALA C 1.0 -78.0 -34.0 PHI 78 78 A 58 ALA N A 58 ALA CA A 58 ALA C A 59 PRO N 1.0 -61.0 -29.0 PSI 79 79 A 59 PRO C A 60 ILE N A 60 ILE CA A 60 ILE C 1.0 -79.0 -47.0 PHI 80 80 A 60 ILE N A 60 ILE CA A 60 ILE C A 61 LYS N 1.0 -59.0 -25.0 PSI 81 81 A 60 ILE C A 61 LYS N A 61 LYS CA A 61 LYS C 1.0 -69.0 -49.0 PHI 82 82 A 61 LYS N A 61 LYS CA A 61 LYS C A 62 GLU N 1.0 -57.0 -27.0 PSI 83 83 A 61 LYS C A 62 GLU N A 62 GLU CA A 62 GLU C 1.0 -77.0 -55.0 PHI 84 84 A 62 GLU N A 62 GLU CA A 62 GLU C A 63 VAL N 1.0 -49.0 -29.0 PSI 85 85 A 62 GLU C A 63 VAL N A 63 VAL CA A 63 VAL C 1.0 -77.0 -57.0 PHI 86 86 A 63 VAL N A 63 VAL CA A 63 VAL C A 64 ASP N 1.0 -49.0 -29.0 PSI 87 87 A 63 VAL C A 64 ASP N A 64 ASP CA A 64 ASP C 1.0 -75.0 -53.0 PHI 88 88 A 64 ASP N A 64 ASP CA A 64 ASP C A 65 THR N 1.0 -57.0 -37.0 PSI 89 89 A 64 ASP C A 65 THR N A 65 THR CA A 65 THR C 1.0 -81.0 -45.0 PHI 90 90 A 65 THR N A 65 THR CA A 65 THR C A 66 SER N 1.0 -57.0 -13.0 PSI 91 91 A 65 THR C A 66 SER N A 66 SER CA A 66 SER C 1.0 -107.0 -45.0 PHI 92 92 A 66 SER N A 66 SER CA A 66 SER C A 67 GLY N 1.0 -51.0 15.0 PSI 93 93 A 68 LYS C A 69 HIS N A 69 HIS CA A 69 HIS C 1.0 -71.0 -49.0 PHI 94 94 A 69 HIS N A 69 HIS CA A 69 HIS C A 70 ASP N 1.0 -53.0 -15.0 PSI 95 95 A 69 HIS C A 70 ASP N A 70 ASP CA A 70 ASP C 1.0 -81.0 -57.0 PHI 96 96 A 70 ASP N A 70 ASP CA A 70 ASP C A 71 VAL N 1.0 -53.0 -23.0 PSI 97 97 A 70 ASP C A 71 VAL N A 71 VAL CA A 71 VAL C 1.0 -73.0 -53.0 PHI 98 98 A 71 VAL N A 71 VAL CA A 71 VAL C A 72 ALA N 1.0 -55.0 -35.0 PSI 99 99 A 71 VAL C A 72 ALA N A 72 ALA CA A 72 ALA C 1.0 -71.0 -49.0 PHI 100 100 A 72 ALA N A 72 ALA CA A 72 ALA C A 73 GLN N 1.0 -57.0 -27.0 PSI 101 101 A 72 ALA C A 73 GLN N A 73 GLN CA A 73 GLN C 1.0 -75.0 -51.0 PHI 102 102 A 73 GLN N A 73 GLN CA A 73 GLN C A 74 ARG N 1.0 -53.0 -45.0 PSI 103 103 A 73 GLN C A 74 ARG N A 74 ARG CA A 74 ARG C 1.0 -75.0 -47.0 PHI 104 104 A 74 ARG N A 74 ARG CA A 74 ARG C A 75 LEU N 1.0 -55.0 -33.0 PSI 105 105 A 74 ARG C A 75 LEU N A 75 LEU CA A 75 LEU C 1.0 -73.0 -53.0 PHI 106 106 A 75 LEU N A 75 LEU CA A 75 LEU C A 76 GLN N 1.0 -55.0 -29.0 PSI 107 107 A 75 LEU C A 76 GLN N A 76 GLN CA A 76 GLN C 1.0 -73.0 -53.0 PHI 108 108 A 76 GLN N A 76 GLN CA A 76 GLN C A 77 GLN N 1.0 -55.0 -35.0 PSI 109 109 A 76 GLN C A 77 GLN N A 77 GLN CA A 77 GLN C 1.0 -73.0 -53.0 PHI 110 110 A 77 GLN N A 77 GLN CA A 77 GLN C A 78 ARG N 1.0 -61.0 -21.0 PSI 111 111 A 77 GLN C A 78 ARG N A 78 ARG CA A 78 ARG C 1.0 -83.0 -51.0 PHI 112 112 A 78 ARG N A 78 ARG CA A 78 ARG C A 79 VAL N 1.0 -53.0 -17.0 PSI 113 113 A 78 ARG C A 79 VAL N A 79 VAL CA A 79 VAL C 1.0 -79.0 -53.0 PHI 114 114 A 79 VAL N A 79 VAL CA A 79 VAL C A 80 THR N 1.0 -53.0 -33.0 PSI 115 115 A 79 VAL C A 80 THR N A 80 THR CA A 80 THR C 1.0 -73.0 -53.0 PHI 116 116 A 80 THR N A 80 THR CA A 80 THR C A 81 ALA N 1.0 -51.0 -31.0 PSI 117 117 A 80 THR C A 81 ALA N A 81 ALA CA A 81 ALA C 1.0 -79.0 -53.0 PHI 118 118 A 81 ALA N A 81 ALA CA A 81 ALA C A 82 ILE N 1.0 -59.0 -15.0 PSI 119 119 A 81 ALA C A 82 ILE N A 82 ILE CA A 82 ILE C 1.0 -75.0 -49.0 PHI 120 120 A 82 ILE N A 82 ILE CA A 82 ILE C A 83 MET N 1.0 -55.0 -33.0 PSI 121 121 A 82 ILE C A 83 MET N A 83 MET CA A 83 MET C 1.0 -77.0 -51.0 PHI 122 122 A 83 MET N A 83 MET CA A 83 MET C A 84 ARG N 1.0 -51.0 -27.0 PSI 123 123 A 83 MET C A 84 ARG N A 84 ARG CA A 84 ARG C 1.0 -79.0 -51.0 PHI 124 124 A 84 ARG N A 84 ARG CA A 84 ARG C A 85 TYR N 1.0 -61.0 -23.0 PSI 125 125 A 84 ARG C A 85 TYR N A 85 TYR CA A 85 TYR C 1.0 -77.0 -55.0 PHI 126 126 A 85 TYR N A 85 TYR CA A 85 TYR C A 86 ALA N 1.0 -53.0 -31.0 PSI 127 127 A 85 TYR C A 86 ALA N A 86 ALA CA A 86 ALA C 1.0 -79.0 -57.0 PHI 128 128 A 86 ALA N A 86 ALA CA A 86 ALA C A 87 VAL N 1.0 -57.0 -17.0 PSI 129 129 A 86 ALA C A 87 VAL N A 87 VAL CA A 87 VAL C 1.0 -87.0 -51.0 PHI 130 130 A 87 VAL N A 87 VAL CA A 87 VAL C A 88 GLN N 1.0 -57.0 -15.0 PSI 131 131 A 87 VAL C A 88 GLN N A 88 GLN CA A 88 GLN C 1.0 -77.0 -51.0 PHI 132 132 A 88 GLN N A 88 GLN CA A 88 GLN C A 89 ASN N 1.0 -43.0 -21.0 PSI 133 133 A 88 GLN C A 89 ASN N A 89 ASN CA A 89 ASN C 1.0 -113.0 -75.0 PHI 134 134 A 89 ASN N A 89 ASN CA A 89 ASN C A 90 ASP N 1.0 -15.0 35.0 PSI 135 135 A 90 ASP C A 91 TYR N A 91 TYR CA A 91 TYR C 1.0 -109.0 -45.0 PHI 136 136 A 91 TYR N A 91 TYR CA A 91 TYR C A 92 ILE N 1.0 -63.0 17.0 PSI 137 137 A 4 SER C A 5 GLY N A 5 GLY CA A 5 GLY C 1.0 45.0 315.0 PHI 138 138 A 5 GLY C A 6 ALA N A 6 ALA CA A 6 ALA C 1.0 45.0 315.0 PHI 139 139 A 5 GLY C A 6 ALA N A 6 ALA CA A 6 ALA C 1.0 -185.0 75.0 PHI 140 140 A 6 ALA N A 6 ALA CA A 6 ALA C A 7 TYR N 1.0 -85.0 205.0 PSI 141 141 A 6 ALA C A 7 TYR N A 7 TYR CA A 7 TYR C 1.0 45.0 315.0 PHI 142 142 A 6 ALA C A 7 TYR N A 7 TYR CA A 7 TYR C 1.0 -185.0 75.0 PHI 143 143 A 7 TYR N A 7 TYR CA A 7 TYR CB A 7 TYR CG 1.0 25.0 335.0 CHI1 144 144 A 7 TYR N A 7 TYR CA A 7 TYR CB A 7 TYR CG 1.0 -205.0 95.0 CHI1 145 145 A 7 TYR CA A 7 TYR CB A 7 TYR CG A 7 TYR CD1 1.0 25.0 335.0 CHI2 146 146 A 7 TYR CA A 7 TYR CB A 7 TYR CG A 7 TYR CD1 1.0 -155.0 155.0 CHI2 147 147 A 7 TYR N A 7 TYR CA A 7 TYR C A 8 THR N 1.0 -85.0 155.0 PSI 148 148 A 7 TYR C A 8 THR N A 8 THR CA A 8 THR C 1.0 45.0 315.0 PHI 149 149 A 7 TYR C A 8 THR N A 8 THR CA A 8 THR C 1.0 -185.0 75.0 PHI 150 150 A 8 THR N A 8 THR CA A 8 THR CB A 8 THR OG1 1.0 -215.0 95.0 CHI1 151 151 A 8 THR N A 8 THR CA A 8 THR CB A 8 THR OG1 1.0 -75.0 205.0 CHI1 152 152 A 8 THR N A 8 THR CA A 8 THR C A 9 PHE N 1.0 -85.0 195.0 PSI 153 153 A 9 PHE N A 9 PHE CA A 9 PHE CB A 9 PHE CG 1.0 35.0 325.0 CHI1 154 154 A 9 PHE N A 9 PHE CA A 9 PHE CB A 9 PHE CG 1.0 -205.0 95.0 CHI1 155 155 A 9 PHE CA A 9 PHE CB A 9 PHE CG A 9 PHE CD1 1.0 25.0 335.0 CHI2 156 156 A 9 PHE CA A 9 PHE CB A 9 PHE CG A 9 PHE CD1 1.0 -155.0 155.0 CHI2 157 157 A 10 GLU N A 10 GLU CA A 10 GLU CB A 10 GLU CG 1.0 -325.0 -25.0 CHI1 158 158 A 10 GLU N A 10 GLU CA A 10 GLU CB A 10 GLU CG 1.0 -205.0 95.0 CHI1 159 159 A 10 GLU CA A 10 GLU CB A 10 GLU CG A 10 GLU CD 1.0 15.0 345.0 CHI2 160 160 A 11 THR N A 11 THR CA A 11 THR CB A 11 THR OG1 1.0 -205.0 85.0 CHI1 161 161 A 11 THR N A 11 THR CA A 11 THR CB A 11 THR OG1 1.0 -75.0 205.0 CHI1 162 162 A 12 ILE N A 12 ILE CA A 12 ILE CB A 12 ILE CG1 1.0 -315.0 -35.0 CHI1 163 163 A 12 ILE N A 12 ILE CA A 12 ILE CB A 12 ILE CG1 1.0 -195.0 75.0 CHI1 164 164 A 12 ILE N A 12 ILE CA A 12 ILE CB A 12 ILE CG1 1.0 -75.0 205.0 CHI1 165 165 A 12 ILE CA A 12 ILE CB A 12 ILE CG1 A 12 ILE CD1 1.0 45.0 315.0 CHI2 166 166 A 12 ILE CA A 12 ILE CB A 12 ILE CG1 A 12 ILE CD1 1.0 -85.0 195.0 CHI2 167 167 A 14 ARG N A 14 ARG CA A 14 ARG CB A 14 ARG CG 1.0 -315.0 -35.0 CHI1 168 168 A 14 ARG N A 14 ARG CA A 14 ARG CB A 14 ARG CG 1.0 -205.0 85.0 CHI1 169 169 A 14 ARG CA A 14 ARG CB A 14 ARG CG A 14 ARG CD 1.0 35.0 325.0 CHI2 170 170 A 15 GLU N A 15 GLU CA A 15 GLU CB A 15 GLU CG 1.0 -305.0 -25.0 CHI1 171 171 A 15 GLU N A 15 GLU CA A 15 GLU CB A 15 GLU CG 1.0 -205.0 85.0 CHI1 172 172 A 15 GLU N A 15 GLU CA A 15 GLU CB A 15 GLU CG 1.0 -75.0 225.0 CHI1 173 173 A 15 GLU CA A 15 GLU CB A 15 GLU CG A 15 GLU CD 1.0 35.0 325.0 CHI2 174 174 A 15 GLU CA A 15 GLU CB A 15 GLU CG A 15 GLU CD 1.0 -105.0 105.0 CHI2 175 175 A 16 TRP N A 16 TRP CA A 16 TRP CB A 16 TRP CG 1.0 45.0 95.0 CHI1 176 176 A 16 TRP N A 16 TRP CA A 16 TRP CB A 16 TRP CG 1.0 -275.0 65.0 CHI1 177 177 A 16 TRP CA A 16 TRP CB A 16 TRP CG A 16 TRP CD1 1.0 -265.0 -85.0 CHI2 178 178 A 16 TRP CA A 16 TRP CB A 16 TRP CG A 16 TRP CD1 1.0 -105.0 105.0 CHI2 179 179 A 17 HIS N A 17 HIS CA A 17 HIS CB A 17 HIS CG 1.0 35.0 325.0 CHI1 180 180 A 17 HIS N A 17 HIS CA A 17 HIS CB A 17 HIS CG 1.0 -205.0 95.0 CHI1 181 181 A 18 GLU N A 18 GLU CA A 18 GLU CB A 18 GLU CG 1.0 -325.0 -25.0 CHI1 182 182 A 18 GLU N A 18 GLU CA A 18 GLU CB A 18 GLU CG 1.0 -205.0 95.0 CHI1 183 183 A 18 GLU CA A 18 GLU CB A 18 GLU CG A 18 GLU CD 1.0 15.0 345.0 CHI2 184 184 A 19 SER C A 20 ASN N A 20 ASN CA A 20 ASN C 1.0 45.0 315.0 PHI 185 185 A 19 SER C A 20 ASN N A 20 ASN CA A 20 ASN C 1.0 -185.0 75.0 PHI 186 186 A 20 ASN N A 20 ASN CA A 20 ASN CB A 20 ASN CG 1.0 -225.0 115.0 CHI1 187 187 A 20 ASN CA A 20 ASN CB A 20 ASN CG A 20 ASN OD1 1.0 -145.0 145.0 CHI2 188 188 A 20 ASN N A 20 ASN CA A 20 ASN C A 21 LYS N 1.0 -85.0 205.0 PSI 189 189 A 20 ASN C A 21 LYS N A 21 LYS CA A 21 LYS C 1.0 45.0 315.0 PHI 190 190 A 20 ASN C A 21 LYS N A 21 LYS CA A 21 LYS C 1.0 -185.0 75.0 PHI 191 191 A 21 LYS N A 21 LYS CA A 21 LYS CB A 21 LYS CG 1.0 25.0 335.0 CHI1 192 192 A 21 LYS N A 21 LYS CA A 21 LYS CB A 21 LYS CG 1.0 -205.0 95.0 CHI1 193 193 A 21 LYS CA A 21 LYS CB A 21 LYS CG A 21 LYS CD 1.0 35.0 325.0 CHI2 194 194 A 21 LYS N A 21 LYS CA A 21 LYS C A 22 ARG N 1.0 -85.0 205.0 PSI 195 195 A 21 LYS C A 22 ARG N A 22 ARG CA A 22 ARG C 1.0 45.0 315.0 PHI 196 196 A 21 LYS C A 22 ARG N A 22 ARG CA A 22 ARG C 1.0 -185.0 75.0 PHI 197 197 A 22 ARG N A 22 ARG CA A 22 ARG CB A 22 ARG CG 1.0 25.0 335.0 CHI1 198 198 A 22 ARG N A 22 ARG CA A 22 ARG CB A 22 ARG CG 1.0 -205.0 95.0 CHI1 199 199 A 22 ARG CA A 22 ARG CB A 22 ARG CG A 22 ARG CD 1.0 35.0 325.0 CHI2 200 200 A 22 ARG N A 22 ARG CA A 22 ARG C A 23 TRP N 1.0 -85.0 195.0 PSI 201 201 A 22 ARG C A 23 TRP N A 23 TRP CA A 23 TRP C 1.0 45.0 315.0 PHI 202 202 A 22 ARG C A 23 TRP N A 23 TRP CA A 23 TRP C 1.0 -145.0 55.0 PHI 203 203 A 23 TRP N A 23 TRP CA A 23 TRP CB A 23 TRP CG 1.0 25.0 335.0 CHI1 204 204 A 23 TRP N A 23 TRP CA A 23 TRP CB A 23 TRP CG 1.0 -65.0 75.0 CHI1 205 205 A 23 TRP CA A 23 TRP CB A 23 TRP CG A 23 TRP CD1 1.0 75.0 285.0 CHI2 206 206 A 23 TRP CA A 23 TRP CB A 23 TRP CG A 23 TRP CD1 1.0 -235.0 105.0 CHI2 207 207 A 23 TRP CA A 23 TRP CB A 23 TRP CG A 23 TRP CD1 1.0 -95.0 145.0 CHI2 208 208 A 23 TRP N A 23 TRP CA A 23 TRP C A 24 SER N 1.0 -85.0 195.0 PSI 209 209 A 23 TRP C A 24 SER N A 24 SER CA A 24 SER C 1.0 45.0 315.0 PHI 210 210 A 23 TRP C A 24 SER N A 24 SER CA A 24 SER C 1.0 -185.0 75.0 PHI 211 211 A 24 SER N A 24 SER CA A 24 SER C A 25 GLU N 1.0 -85.0 205.0 PSI 212 212 A 25 GLU N A 25 GLU CA A 25 GLU CB A 25 GLU CG 1.0 35.0 325.0 CHI1 213 213 A 25 GLU N A 25 GLU CA A 25 GLU CB A 25 GLU CG 1.0 -205.0 95.0 CHI1 214 214 A 25 GLU CA A 25 GLU CB A 25 GLU CG A 25 GLU CD 1.0 15.0 345.0 CHI2 215 215 A 26 ASP N A 26 ASP CA A 26 ASP CB A 26 ASP CG 1.0 25.0 335.0 CHI1 216 216 A 26 ASP N A 26 ASP CA A 26 ASP CB A 26 ASP CG 1.0 -225.0 115.0 CHI1 217 217 A 27 HIS N A 27 HIS CA A 27 HIS CB A 27 HIS CG 1.0 35.0 325.0 CHI1 218 218 A 27 HIS N A 27 HIS CA A 27 HIS CB A 27 HIS CG 1.0 -205.0 95.0 CHI1 219 219 A 28 ARG N A 28 ARG CA A 28 ARG CB A 28 ARG CG 1.0 -325.0 -25.0 CHI1 220 220 A 28 ARG N A 28 ARG CA A 28 ARG CB A 28 ARG CG 1.0 -205.0 95.0 CHI1 221 221 A 28 ARG CA A 28 ARG CB A 28 ARG CG A 28 ARG CD 1.0 35.0 325.0 CHI2 222 222 A 30 ARG N A 30 ARG CA A 30 ARG CB A 30 ARG CG 1.0 -325.0 -25.0 CHI1 223 223 A 30 ARG N A 30 ARG CA A 30 ARG CB A 30 ARG CG 1.0 -205.0 85.0 CHI1 224 224 A 30 ARG CA A 30 ARG CB A 30 ARG CG A 30 ARG CD 1.0 35.0 325.0 CHI2 225 225 A 31 VAL N A 31 VAL CA A 31 VAL CB A 31 VAL CG1 1.0 45.0 315.0 CHI1 226 226 A 31 VAL N A 31 VAL CA A 31 VAL CB A 31 VAL CG1 1.0 -195.0 85.0 CHI1 227 227 A 31 VAL N A 31 VAL CA A 31 VAL CB A 31 VAL CG1 1.0 -85.0 205.0 CHI1 228 228 A 32 LEU N A 32 LEU CA A 32 LEU CB A 32 LEU CG 1.0 -325.0 -25.0 CHI1 229 229 A 32 LEU N A 32 LEU CA A 32 LEU CB A 32 LEU CG 1.0 -215.0 95.0 CHI1 230 230 A 32 LEU CA A 32 LEU CB A 32 LEU CG A 32 LEU CD1 1.0 35.0 325.0 CHI2 231 231 A 32 LEU CA A 32 LEU CB A 32 LEU CG A 32 LEU CD1 1.0 -95.0 205.0 CHI2 232 232 A 33 ARG N A 33 ARG CA A 33 ARG CB A 33 ARG CG 1.0 35.0 325.0 CHI1 233 233 A 33 ARG N A 33 ARG CA A 33 ARG CB A 33 ARG CG 1.0 -205.0 95.0 CHI1 234 234 A 33 ARG CA A 33 ARG CB A 33 ARG CG A 33 ARG CD 1.0 35.0 325.0 CHI2 235 235 A 34 TYR N A 34 TYR CA A 34 TYR CB A 34 TYR CG 1.0 -325.0 -25.0 CHI1 236 236 A 34 TYR N A 34 TYR CA A 34 TYR CB A 34 TYR CG 1.0 -205.0 95.0 CHI1 237 237 A 34 TYR CA A 34 TYR CB A 34 TYR CG A 34 TYR CD1 1.0 25.0 335.0 CHI2 238 238 A 34 TYR CA A 34 TYR CB A 34 TYR CG A 34 TYR CD1 1.0 -155.0 155.0 CHI2 239 239 A 35 LEU N A 35 LEU CA A 35 LEU CB A 35 LEU CG 1.0 -325.0 -25.0 CHI1 240 240 A 35 LEU N A 35 LEU CA A 35 LEU CB A 35 LEU CG 1.0 -215.0 105.0 CHI1 241 241 A 35 LEU CA A 35 LEU CB A 35 LEU CG A 35 LEU CD1 1.0 35.0 325.0 CHI2 242 242 A 35 LEU CA A 35 LEU CB A 35 LEU CG A 35 LEU CD1 1.0 -95.0 205.0 CHI2 243 243 A 36 GLU N A 36 GLU CA A 36 GLU CB A 36 GLU CG 1.0 35.0 325.0 CHI1 244 244 A 36 GLU N A 36 GLU CA A 36 GLU CB A 36 GLU CG 1.0 -205.0 95.0 CHI1 245 245 A 36 GLU CA A 36 GLU CB A 36 GLU CG A 36 GLU CD 1.0 15.0 345.0 CHI2 246 246 A 37 LEU N A 37 LEU CA A 37 LEU CB A 37 LEU CG 1.0 -335.0 -15.0 CHI1 247 247 A 37 LEU N A 37 LEU CA A 37 LEU CB A 37 LEU CG 1.0 -215.0 105.0 CHI1 248 248 A 37 LEU CA A 37 LEU CB A 37 LEU CG A 37 LEU CD1 1.0 35.0 325.0 CHI2 249 249 A 37 LEU CA A 37 LEU CB A 37 LEU CG A 37 LEU CD1 1.0 -95.0 205.0 CHI2 250 250 A 38 TYR N A 38 TYR CA A 38 TYR CB A 38 TYR CG 1.0 25.0 335.0 CHI1 251 251 A 38 TYR N A 38 TYR CA A 38 TYR CB A 38 TYR CG 1.0 -205.0 95.0 CHI1 252 252 A 38 TYR CA A 38 TYR CB A 38 TYR CG A 38 TYR CD1 1.0 25.0 335.0 CHI2 253 253 A 38 TYR CA A 38 TYR CB A 38 TYR CG A 38 TYR CD1 1.0 -155.0 155.0 CHI2 254 254 A 38 TYR C A 39 ILE N A 39 ILE CA A 39 ILE C 1.0 45.0 315.0 PHI 255 255 A 38 TYR C A 39 ILE N A 39 ILE CA A 39 ILE C 1.0 -185.0 75.0 PHI 256 256 A 39 ILE N A 39 ILE CA A 39 ILE CB A 39 ILE CG1 1.0 25.0 335.0 CHI1 257 257 A 39 ILE N A 39 ILE CA A 39 ILE CB A 39 ILE CG1 1.0 -195.0 85.0 CHI1 258 258 A 39 ILE N A 39 ILE CA A 39 ILE CB A 39 ILE CG1 1.0 -75.0 205.0 CHI1 259 259 A 39 ILE CA A 39 ILE CB A 39 ILE CG1 A 39 ILE CD1 1.0 45.0 315.0 CHI2 260 260 A 39 ILE CA A 39 ILE CB A 39 ILE CG1 A 39 ILE CD1 1.0 -85.0 195.0 CHI2 261 261 A 39 ILE N A 39 ILE CA A 39 ILE C A 40 PHE N 1.0 -85.0 135.0 PSI 262 262 A 39 ILE C A 40 PHE N A 40 PHE CA A 40 PHE C 1.0 45.0 315.0 PHI 263 263 A 39 ILE C A 40 PHE N A 40 PHE CA A 40 PHE C 1.0 -185.0 75.0 PHI 264 264 A 40 PHE N A 40 PHE CA A 40 PHE CB A 40 PHE CG 1.0 25.0 335.0 CHI1 265 265 A 40 PHE N A 40 PHE CA A 40 PHE CB A 40 PHE CG 1.0 -195.0 75.0 CHI1 266 266 A 40 PHE CA A 40 PHE CB A 40 PHE CG A 40 PHE CD1 1.0 25.0 335.0 CHI2 267 267 A 40 PHE CA A 40 PHE CB A 40 PHE CG A 40 PHE CD1 1.0 -155.0 155.0 CHI2 268 268 A 40 PHE N A 40 PHE CA A 40 PHE C A 41 PRO N 1.0 55.0 165.0 PSI 269 269 A 40 PHE N A 40 PHE CA A 40 PHE C A 41 PRO N 1.0 -215.0 85.0 PSI 270 270 A 41 PRO N A 41 PRO CA A 41 PRO C A 42 HIS N 1.0 -55.0 5.0 PSI 271 271 A 42 HIS N A 42 HIS CA A 42 HIS CB A 42 HIS CG 1.0 -325.0 -25.0 CHI1 272 272 A 42 HIS N A 42 HIS CA A 42 HIS CB A 42 HIS CG 1.0 -205.0 95.0 CHI1 273 273 A 43 ILE N A 43 ILE CA A 43 ILE CB A 43 ILE CG1 1.0 25.0 335.0 CHI1 274 274 A 43 ILE N A 43 ILE CA A 43 ILE CB A 43 ILE CG1 1.0 -195.0 85.0 CHI1 275 275 A 43 ILE N A 43 ILE CA A 43 ILE CB A 43 ILE CG1 1.0 -75.0 205.0 CHI1 276 276 A 43 ILE CA A 43 ILE CB A 43 ILE CG1 A 43 ILE CD1 1.0 45.0 315.0 CHI2 277 277 A 43 ILE CA A 43 ILE CB A 43 ILE CG1 A 43 ILE CD1 1.0 -85.0 195.0 CHI2 278 278 A 43 ILE C A 44 GLY N A 44 GLY CA A 44 GLY C 1.0 45.0 315.0 PHI 279 279 A 45 SER C A 46 SER N A 46 SER CA A 46 SER C 1.0 45.0 315.0 PHI 280 280 A 45 SER C A 46 SER N A 46 SER CA A 46 SER C 1.0 -185.0 75.0 PHI 281 281 A 46 SER N A 46 SER CA A 46 SER C A 47 ASP N 1.0 -85.0 205.0 PSI 282 282 A 47 ASP N A 47 ASP CA A 47 ASP CB A 47 ASP CG 1.0 -345.0 -5.0 CHI1 283 283 A 47 ASP N A 47 ASP CA A 47 ASP CB A 47 ASP CG 1.0 -225.0 115.0 CHI1 284 284 A 48 ILE N A 48 ILE CA A 48 ILE CB A 48 ILE CG1 1.0 35.0 325.0 CHI1 285 285 A 48 ILE N A 48 ILE CA A 48 ILE CB A 48 ILE CG1 1.0 -195.0 85.0 CHI1 286 286 A 48 ILE N A 48 ILE CA A 48 ILE CB A 48 ILE CG1 1.0 -75.0 205.0 CHI1 287 287 A 48 ILE CA A 48 ILE CB A 48 ILE CG1 A 48 ILE CD1 1.0 45.0 315.0 CHI2 288 288 A 48 ILE CA A 48 ILE CB A 48 ILE CG1 A 48 ILE CD1 1.0 -85.0 195.0 CHI2 289 289 A 49 ARG N A 49 ARG CA A 49 ARG CB A 49 ARG CG 1.0 -325.0 -25.0 CHI1 290 290 A 49 ARG N A 49 ARG CA A 49 ARG CB A 49 ARG CG 1.0 -205.0 95.0 CHI1 291 291 A 49 ARG CA A 49 ARG CB A 49 ARG CG A 49 ARG CD 1.0 35.0 325.0 CHI2 292 292 A 49 ARG C A 50 GLN N A 50 GLN CA A 50 GLN C 1.0 45.0 315.0 PHI 293 293 A 49 ARG C A 50 GLN N A 50 GLN CA A 50 GLN C 1.0 -185.0 75.0 PHI 294 294 A 50 GLN N A 50 GLN CA A 50 GLN CB A 50 GLN CG 1.0 25.0 335.0 CHI1 295 295 A 50 GLN N A 50 GLN CA A 50 GLN CB A 50 GLN CG 1.0 -205.0 95.0 CHI1 296 296 A 50 GLN CA A 50 GLN CB A 50 GLN CG A 50 GLN CD 1.0 15.0 345.0 CHI2 297 297 A 50 GLN N A 50 GLN CA A 50 GLN C A 51 LEU N 1.0 -85.0 115.0 PSI 298 298 A 51 LEU N A 51 LEU CA A 51 LEU CB A 51 LEU CG 1.0 5.0 355.0 CHI1 299 299 A 51 LEU N A 51 LEU CA A 51 LEU CB A 51 LEU CG 1.0 -215.0 105.0 CHI1 300 300 A 51 LEU CA A 51 LEU CB A 51 LEU CG A 51 LEU CD1 1.0 35.0 325.0 CHI2 301 301 A 51 LEU CA A 51 LEU CB A 51 LEU CG A 51 LEU CD1 1.0 -95.0 205.0 CHI2 302 302 A 52 LYS N A 52 LYS CA A 52 LYS CB A 52 LYS CG 1.0 25.0 335.0 CHI1 303 303 A 52 LYS N A 52 LYS CA A 52 LYS CB A 52 LYS CG 1.0 -205.0 95.0 CHI1 304 304 A 52 LYS CA A 52 LYS CB A 52 LYS CG A 52 LYS CD 1.0 35.0 325.0 CHI2 305 305 A 53 THR N A 53 THR CA A 53 THR CB A 53 THR OG1 1.0 -205.0 95.0 CHI1 306 306 A 53 THR N A 53 THR CA A 53 THR CB A 53 THR OG1 1.0 -55.0 205.0 CHI1 307 307 A 55 HIS N A 55 HIS CA A 55 HIS CB A 55 HIS CG 1.0 -315.0 -35.0 CHI1 308 308 A 55 HIS N A 55 HIS CA A 55 HIS CB A 55 HIS CG 1.0 -65.0 95.0 CHI1 309 309 A 55 HIS CA A 55 HIS CB A 55 HIS CG A 55 HIS ND1 1.0 65.0 295.0 CHI2 310 310 A 55 HIS CA A 55 HIS CB A 55 HIS CG A 55 HIS ND1 1.0 -145.0 145.0 CHI2 311 311 A 56 LEU N A 56 LEU CA A 56 LEU CB A 56 LEU CG 1.0 -325.0 -25.0 CHI1 312 312 A 56 LEU N A 56 LEU CA A 56 LEU CB A 56 LEU CG 1.0 -215.0 105.0 CHI1 313 313 A 56 LEU CA A 56 LEU CB A 56 LEU CG A 56 LEU CD1 1.0 35.0 325.0 CHI2 314 314 A 56 LEU CA A 56 LEU CB A 56 LEU CG A 56 LEU CD1 1.0 -95.0 205.0 CHI2 315 315 A 57 LEU N A 57 LEU CA A 57 LEU CB A 57 LEU CG 1.0 -215.0 -25.0 CHI1 316 316 A 57 LEU N A 57 LEU CA A 57 LEU CB A 57 LEU CG 1.0 -75.0 225.0 CHI1 317 317 A 57 LEU CA A 57 LEU CB A 57 LEU CG A 57 LEU CD1 1.0 35.0 205.0 CHI2 318 318 A 59 PRO N A 59 PRO CA A 59 PRO C A 60 ILE N 1.0 -295.0 5.0 PSI 319 319 A 59 PRO N A 59 PRO CA A 59 PRO C A 60 ILE N 1.0 -55.0 195.0 PSI 320 320 A 60 ILE N A 60 ILE CA A 60 ILE CB A 60 ILE CG1 1.0 35.0 325.0 CHI1 321 321 A 60 ILE N A 60 ILE CA A 60 ILE CB A 60 ILE CG1 1.0 -195.0 75.0 CHI1 322 322 A 60 ILE N A 60 ILE CA A 60 ILE CB A 60 ILE CG1 1.0 -75.0 205.0 CHI1 323 323 A 60 ILE CA A 60 ILE CB A 60 ILE CG1 A 60 ILE CD1 1.0 45.0 315.0 CHI2 324 324 A 60 ILE CA A 60 ILE CB A 60 ILE CG1 A 60 ILE CD1 1.0 -85.0 195.0 CHI2 325 325 A 61 LYS N A 61 LYS CA A 61 LYS CB A 61 LYS CG 1.0 35.0 325.0 CHI1 326 326 A 61 LYS N A 61 LYS CA A 61 LYS CB A 61 LYS CG 1.0 -205.0 95.0 CHI1 327 327 A 61 LYS CA A 61 LYS CB A 61 LYS CG A 61 LYS CD 1.0 35.0 325.0 CHI2 328 328 A 62 GLU N A 62 GLU CA A 62 GLU CB A 62 GLU CG 1.0 35.0 325.0 CHI1 329 329 A 62 GLU N A 62 GLU CA A 62 GLU CB A 62 GLU CG 1.0 -205.0 95.0 CHI1 330 330 A 62 GLU CA A 62 GLU CB A 62 GLU CG A 62 GLU CD 1.0 25.0 335.0 CHI2 331 331 A 63 VAL N A 63 VAL CA A 63 VAL CB A 63 VAL CG1 1.0 45.0 315.0 CHI1 332 332 A 63 VAL N A 63 VAL CA A 63 VAL CB A 63 VAL CG1 1.0 -195.0 85.0 CHI1 333 333 A 63 VAL N A 63 VAL CA A 63 VAL CB A 63 VAL CG1 1.0 -85.0 205.0 CHI1 334 334 A 64 ASP N A 64 ASP CA A 64 ASP CB A 64 ASP CG 1.0 -325.0 -25.0 CHI1 335 335 A 64 ASP N A 64 ASP CA A 64 ASP CB A 64 ASP CG 1.0 -225.0 105.0 CHI1 336 336 A 65 THR N A 65 THR CA A 65 THR CB A 65 THR OG1 1.0 -205.0 85.0 CHI1 337 337 A 65 THR N A 65 THR CA A 65 THR CB A 65 THR OG1 1.0 -75.0 205.0 CHI1 338 338 A 66 SER C A 67 GLY N A 67 GLY CA A 67 GLY C 1.0 45.0 315.0 PHI 339 339 A 67 GLY N A 67 GLY CA A 67 GLY C A 68 LYS N 1.0 -145.0 145.0 PSI 340 340 A 67 GLY C A 68 LYS N A 68 LYS CA A 68 LYS C 1.0 45.0 315.0 PHI 341 341 A 67 GLY C A 68 LYS N A 68 LYS CA A 68 LYS C 1.0 -185.0 75.0 PHI 342 342 A 68 LYS N A 68 LYS CA A 68 LYS CB A 68 LYS CG 1.0 25.0 335.0 CHI1 343 343 A 68 LYS N A 68 LYS CA A 68 LYS CB A 68 LYS CG 1.0 -205.0 95.0 CHI1 344 344 A 68 LYS CA A 68 LYS CB A 68 LYS CG A 68 LYS CD 1.0 35.0 325.0 CHI2 345 345 A 68 LYS N A 68 LYS CA A 68 LYS C A 69 HIS N 1.0 -85.0 205.0 PSI 346 346 A 69 HIS N A 69 HIS CA A 69 HIS CB A 69 HIS CG 1.0 35.0 325.0 CHI1 347 347 A 69 HIS N A 69 HIS CA A 69 HIS CB A 69 HIS CG 1.0 -205.0 95.0 CHI1 348 348 A 70 ASP N A 70 ASP CA A 70 ASP CB A 70 ASP CG 1.0 -325.0 -15.0 CHI1 349 349 A 70 ASP N A 70 ASP CA A 70 ASP CB A 70 ASP CG 1.0 -225.0 115.0 CHI1 350 350 A 71 VAL N A 71 VAL CA A 71 VAL CB A 71 VAL CG1 1.0 45.0 315.0 CHI1 351 351 A 71 VAL N A 71 VAL CA A 71 VAL CB A 71 VAL CG1 1.0 -195.0 75.0 CHI1 352 352 A 71 VAL N A 71 VAL CA A 71 VAL CB A 71 VAL CG1 1.0 -85.0 205.0 CHI1 353 353 A 73 GLN N A 73 GLN CA A 73 GLN CB A 73 GLN CG 1.0 -155.0 -65.0 CHI1 354 354 A 73 GLN N A 73 GLN CA A 73 GLN CB A 73 GLN CG 1.0 -75.0 225.0 CHI1 355 355 A 73 GLN CA A 73 GLN CB A 73 GLN CG A 73 GLN CD 1.0 65.0 255.0 CHI2 356 356 A 73 GLN CA A 73 GLN CB A 73 GLN CG A 73 GLN CD 1.0 -115.0 155.0 CHI2 357 357 A 74 ARG N A 74 ARG CA A 74 ARG CB A 74 ARG CG 1.0 35.0 325.0 CHI1 358 358 A 74 ARG N A 74 ARG CA A 74 ARG CB A 74 ARG CG 1.0 -205.0 85.0 CHI1 359 359 A 74 ARG CA A 74 ARG CB A 74 ARG CG A 74 ARG CD 1.0 35.0 325.0 CHI2 360 360 A 75 LEU N A 75 LEU CA A 75 LEU CB A 75 LEU CG 1.0 -325.0 -25.0 CHI1 361 361 A 75 LEU N A 75 LEU CA A 75 LEU CB A 75 LEU CG 1.0 -215.0 95.0 CHI1 362 362 A 75 LEU CA A 75 LEU CB A 75 LEU CG A 75 LEU CD1 1.0 35.0 325.0 CHI2 363 363 A 75 LEU CA A 75 LEU CB A 75 LEU CG A 75 LEU CD1 1.0 -95.0 205.0 CHI2 364 364 A 76 GLN N A 76 GLN CA A 76 GLN CB A 76 GLN CG 1.0 35.0 325.0 CHI1 365 365 A 76 GLN N A 76 GLN CA A 76 GLN CB A 76 GLN CG 1.0 -45.0 65.0 CHI1 366 366 A 76 GLN CA A 76 GLN CB A 76 GLN CG A 76 GLN CD 1.0 85.0 265.0 CHI2 367 367 A 76 GLN CA A 76 GLN CB A 76 GLN CG A 76 GLN CD 1.0 -205.0 95.0 CHI2 368 368 A 77 GLN N A 77 GLN CA A 77 GLN CB A 77 GLN CG 1.0 35.0 325.0 CHI1 369 369 A 77 GLN N A 77 GLN CA A 77 GLN CB A 77 GLN CG 1.0 -205.0 95.0 CHI1 370 370 A 77 GLN CA A 77 GLN CB A 77 GLN CG A 77 GLN CD 1.0 15.0 345.0 CHI2 371 371 A 78 ARG N A 78 ARG CA A 78 ARG CB A 78 ARG CG 1.0 -315.0 -25.0 CHI1 372 372 A 78 ARG N A 78 ARG CA A 78 ARG CB A 78 ARG CG 1.0 -205.0 75.0 CHI1 373 373 A 78 ARG CA A 78 ARG CB A 78 ARG CG A 78 ARG CD 1.0 35.0 325.0 CHI2 374 374 A 79 VAL N A 79 VAL CA A 79 VAL CB A 79 VAL CG1 1.0 45.0 315.0 CHI1 375 375 A 79 VAL N A 79 VAL CA A 79 VAL CB A 79 VAL CG1 1.0 -195.0 75.0 CHI1 376 376 A 79 VAL N A 79 VAL CA A 79 VAL CB A 79 VAL CG1 1.0 -85.0 205.0 CHI1 377 377 A 80 THR N A 80 THR CA A 80 THR CB A 80 THR OG1 1.0 -205.0 85.0 CHI1 378 378 A 80 THR N A 80 THR CA A 80 THR CB A 80 THR OG1 1.0 -75.0 205.0 CHI1 379 379 A 82 ILE N A 82 ILE CA A 82 ILE CB A 82 ILE CG1 1.0 35.0 325.0 CHI1 380 380 A 82 ILE N A 82 ILE CA A 82 ILE CB A 82 ILE CG1 1.0 -195.0 75.0 CHI1 381 381 A 82 ILE N A 82 ILE CA A 82 ILE CB A 82 ILE CG1 1.0 -75.0 195.0 CHI1 382 382 A 82 ILE CA A 82 ILE CB A 82 ILE CG1 A 82 ILE CD1 1.0 45.0 315.0 CHI2 383 383 A 82 ILE CA A 82 ILE CB A 82 ILE CG1 A 82 ILE CD1 1.0 -85.0 195.0 CHI2 384 384 A 83 MET N A 83 MET CA A 83 MET CB A 83 MET CG 1.0 35.0 325.0 CHI1 385 385 A 83 MET N A 83 MET CA A 83 MET CB A 83 MET CG 1.0 -205.0 95.0 CHI1 386 386 A 83 MET CA A 83 MET CB A 83 MET CG A 83 MET SD 1.0 45.0 315.0 CHI2 387 387 A 84 ARG N A 84 ARG CA A 84 ARG CB A 84 ARG CG 1.0 -325.0 -25.0 CHI1 388 388 A 84 ARG N A 84 ARG CA A 84 ARG CB A 84 ARG CG 1.0 -205.0 95.0 CHI1 389 389 A 84 ARG CA A 84 ARG CB A 84 ARG CG A 84 ARG CD 1.0 35.0 325.0 CHI2 390 390 A 85 TYR N A 85 TYR CA A 85 TYR CB A 85 TYR CG 1.0 35.0 325.0 CHI1 391 391 A 85 TYR N A 85 TYR CA A 85 TYR CB A 85 TYR CG 1.0 -205.0 95.0 CHI1 392 392 A 85 TYR CA A 85 TYR CB A 85 TYR CG A 85 TYR CD1 1.0 25.0 335.0 CHI2 393 393 A 85 TYR CA A 85 TYR CB A 85 TYR CG A 85 TYR CD1 1.0 -155.0 155.0 CHI2 394 394 A 87 VAL N A 87 VAL CA A 87 VAL CB A 87 VAL CG1 1.0 45.0 305.0 CHI1 395 395 A 87 VAL N A 87 VAL CA A 87 VAL CB A 87 VAL CG1 1.0 -195.0 85.0 CHI1 396 396 A 87 VAL N A 87 VAL CA A 87 VAL CB A 87 VAL CG1 1.0 -85.0 205.0 CHI1 397 397 A 88 GLN N A 88 GLN CA A 88 GLN CB A 88 GLN CG 1.0 35.0 325.0 CHI1 398 398 A 88 GLN N A 88 GLN CA A 88 GLN CB A 88 GLN CG 1.0 -205.0 95.0 CHI1 399 399 A 88 GLN CA A 88 GLN CB A 88 GLN CG A 88 GLN CD 1.0 15.0 345.0 CHI2 400 400 A 89 ASN N A 89 ASN CA A 89 ASN CB A 89 ASN CG 1.0 -205.0 105.0 CHI1 401 401 A 89 ASN CA A 89 ASN CB A 89 ASN CG A 89 ASN OD1 1.0 -145.0 145.0 CHI2 402 402 A 89 ASN C A 90 ASP N A 90 ASP CA A 90 ASP C 1.0 45.0 315.0 PHI 403 403 A 89 ASN C A 90 ASP N A 90 ASP CA A 90 ASP C 1.0 -185.0 75.0 PHI 404 404 A 90 ASP N A 90 ASP CA A 90 ASP CB A 90 ASP CG 1.0 -225.0 115.0 CHI1 405 405 A 90 ASP N A 90 ASP CA A 90 ASP C A 91 TYR N 1.0 -85.0 155.0 PSI 406 406 A 91 TYR N A 91 TYR CA A 91 TYR CB A 91 TYR CG 1.0 25.0 335.0 CHI1 407 407 A 91 TYR N A 91 TYR CA A 91 TYR CB A 91 TYR CG 1.0 -205.0 95.0 CHI1 408 408 A 91 TYR CA A 91 TYR CB A 91 TYR CG A 91 TYR CD1 1.0 25.0 335.0 CHI2 409 409 A 91 TYR CA A 91 TYR CB A 91 TYR CG A 91 TYR CD1 1.0 -155.0 155.0 CHI2 410 410 A 91 TYR C A 92 ILE N A 92 ILE CA A 92 ILE C 1.0 45.0 315.0 PHI 411 411 A 91 TYR C A 92 ILE N A 92 ILE CA A 92 ILE C 1.0 -185.0 75.0 PHI 412 412 A 92 ILE N A 92 ILE CA A 92 ILE CB A 92 ILE CG1 1.0 25.0 335.0 CHI1 413 413 A 92 ILE N A 92 ILE CA A 92 ILE CB A 92 ILE CG1 1.0 -195.0 85.0 CHI1 414 414 A 92 ILE N A 92 ILE CA A 92 ILE CB A 92 ILE CG1 1.0 -75.0 205.0 CHI1 415 415 A 92 ILE CA A 92 ILE CB A 92 ILE CG1 A 92 ILE CD1 1.0 45.0 315.0 CHI2 416 416 A 92 ILE CA A 92 ILE CB A 92 ILE CG1 A 92 ILE CD1 1.0 -85.0 195.0 CHI2 417 417 A 92 ILE N A 92 ILE CA A 92 ILE C A 93 ASP N 1.0 -305.0 45.0 PSI 418 418 A 92 ILE N A 92 ILE CA A 92 ILE C A 93 ASP N 1.0 -85.0 195.0 PSI 419 419 A 92 ILE C A 93 ASP N A 93 ASP CA A 93 ASP C 1.0 45.0 315.0 PHI 420 420 A 92 ILE C A 93 ASP N A 93 ASP CA A 93 ASP C 1.0 -185.0 75.0 PHI 421 421 A 93 ASP N A 93 ASP CA A 93 ASP CB A 93 ASP CG 1.0 -225.0 115.0 CHI1 422 422 A 93 ASP N A 93 ASP CA A 93 ASP C A 94 SER N 1.0 -85.0 155.0 PSI 423 423 A 93 ASP C A 94 SER N A 94 SER CA A 94 SER C 1.0 45.0 315.0 PHI 424 424 A 93 ASP C A 94 SER N A 94 SER CA A 94 SER C 1.0 -185.0 75.0 PHI 425 425 A 94 SER N A 94 SER CA A 94 SER C A 95 ASN N 1.0 -85.0 205.0 PSI 426 426 A 94 SER C A 95 ASN N A 95 ASN CA A 95 ASN C 1.0 45.0 315.0 PHI 427 427 A 94 SER C A 95 ASN N A 95 ASN CA A 95 ASN C 1.0 -185.0 75.0 PHI 428 428 A 95 ASN N A 95 ASN CA A 95 ASN CB A 95 ASN CG 1.0 -195.0 105.0 CHI1 429 429 A 95 ASN CA A 95 ASN CB A 95 ASN CG A 95 ASN OD1 1.0 -145.0 145.0 CHI2 430 430 A 95 ASN N A 95 ASN CA A 95 ASN C A 96 PRO N 1.0 55.0 165.0 PSI 431 431 A 95 ASN N A 95 ASN CA A 95 ASN C A 96 PRO N 1.0 -215.0 85.0 PSI 432 432 A 96 PRO N A 96 PRO CA A 96 PRO C A 97 ALA N 1.0 -175.0 5.0 PSI 433 433 A 96 PRO N A 96 PRO CA A 96 PRO C A 97 ALA N 1.0 -55.0 195.0 PSI 434 434 A 96 PRO C A 97 ALA N A 97 ALA CA A 97 ALA C 1.0 45.0 315.0 PHI 435 435 A 96 PRO C A 97 ALA N A 97 ALA CA A 97 ALA C 1.0 -185.0 75.0 PHI 436 436 A 97 ALA N A 97 ALA CA A 97 ALA C A 98 SER N 1.0 -85.0 135.0 PSI 437 437 A 97 ALA C A 98 SER N A 98 SER CA A 98 SER C 1.0 45.0 315.0 PHI 438 438 A 97 ALA C A 98 SER N A 98 SER CA A 98 SER C 1.0 -185.0 75.0 PHI 439 439 A 98 SER N A 98 SER CA A 98 SER C A 99 ASP N 1.0 -85.0 205.0 PSI 440 440 A 98 SER C A 99 ASP N A 99 ASP CA A 99 ASP C 1.0 45.0 315.0 PHI 441 441 A 98 SER C A 99 ASP N A 99 ASP CA A 99 ASP C 1.0 -185.0 75.0 PHI 442 442 A 99 ASP N A 99 ASP CA A 99 ASP CB A 99 ASP CG 1.0 -225.0 115.0 CHI1 443 443 A 99 ASP N A 99 ASP CA A 99 ASP C A 100 MET N 1.0 -85.0 205.0 PSI 444 444 A 99 ASP C A 100 MET N A 100 MET CA A 100 MET C 1.0 45.0 315.0 PHI 445 445 A 99 ASP C A 100 MET N A 100 MET CA A 100 MET C 1.0 -185.0 75.0 PHI 446 446 A 100 MET N A 100 MET CA A 100 MET CB A 100 MET CG 1.0 25.0 335.0 CHI1 447 447 A 100 MET N A 100 MET CA A 100 MET CB A 100 MET CG 1.0 -205.0 95.0 CHI1 448 448 A 100 MET CA A 100 MET CB A 100 MET CG A 100 MET SD 1.0 45.0 315.0 CHI2 449 449 A 100 MET N A 100 MET CA A 100 MET C A 101 ALA N 1.0 -85.0 145.0 PSI stop_ save_ save_CnoesyPeaklist _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode CnoesyPeaklist _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 13C 29 2 1H 16 3 1H 16 stop_ save_ save_NnoesyPeaklist _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode NnoesyPeaklist _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 15N 33 2 1H 16 3 1H 16 stop_ save_