data_nef_c34139_5o1q 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 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 5O1Q stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLU start . . 2 A 2 THR middle . . 3 A 3 PRO middle . false 4 A 4 ALA middle . . 5 A 5 THR middle . . 6 A 6 ARG middle . . 7 A 7 PRO middle . false 8 A 8 VAL middle . . 9 A 9 THR middle . . 10 A 10 GLY middle . false 11 A 11 SER middle . . 12 A 12 TRP middle . . 13 A 13 LYS middle . . 14 A 14 LYS middle . . 15 A 15 ASN middle . . 16 A 16 GLN middle . . 17 A 17 TYR middle . . 18 A 18 GLY middle . false 19 A 19 THR middle . . 20 A 20 TRP middle . . 21 A 21 TYR middle . . 22 A 22 LYS middle . . 23 A 23 PRO middle . false 24 A 24 GLU middle . . 25 A 25 ASN middle . . 26 A 26 ALA middle . . 27 A 27 THR middle . . 28 A 28 PHE middle . . 29 A 29 VAL middle . . 30 A 30 ASN middle . . 31 A 31 GLY middle . false 32 A 32 ASN middle . . 33 A 33 GLN middle . . 34 A 34 PRO middle . false 35 A 35 ILE middle . . 36 A 36 VAL middle . . 37 A 37 THR middle . . 38 A 38 ARG middle . . 39 A 39 ILE middle . . 40 A 40 GLY middle . false 41 A 41 SER middle . . 42 A 42 PRO middle . false 43 A 43 PHE middle . . 44 A 44 LEU middle . . 45 A 45 ASN middle . . 46 A 46 ALA middle . . 47 A 47 PRO middle . false 48 A 48 VAL middle . . 49 A 49 GLY middle . false 50 A 50 GLY middle . false 51 A 51 ASN middle . . 52 A 52 LEU middle . . 53 A 53 PRO middle . false 54 A 54 ALA middle . . 55 A 55 GLY middle . false 56 A 56 ALA middle . . 57 A 57 THR middle . . 58 A 58 ILE middle . . 59 A 59 VAL middle . . 60 A 60 TYR middle . . 61 A 61 ASP middle . . 62 A 62 GLU middle . . 63 A 63 VAL middle . . 64 A 64 CYS middle . . 65 A 65 ILE middle . . 66 A 66 GLN middle . . 67 A 67 ALA middle . . 68 A 68 GLY middle . false 69 A 69 HIS middle . . 70 A 70 ILE middle . . 71 A 71 TRP middle . . 72 A 72 ILE middle . . 73 A 73 GLY middle . false 74 A 74 TYR middle . . 75 A 75 ASN middle . . 76 A 76 ALA middle . . 77 A 77 TYR middle . . 78 A 78 ASN middle . . 79 A 79 GLY middle . false 80 A 80 ASN middle . . 81 A 81 ARG middle . . 82 A 82 VAL middle . . 83 A 83 TYR middle . . 84 A 84 CYS middle . . 85 A 85 PRO middle . false 86 A 86 VAL middle . . 87 A 87 ARG middle . . 88 A 88 THR middle . . 89 A 89 CYS middle . . 90 A 90 GLN middle . . 91 A 91 GLY middle . false 92 A 92 VAL middle . . 93 A 93 PRO middle . false 94 A 94 PRO middle . true 95 A 95 ASN middle . . 96 A 96 GLN middle . . 97 A 97 ILE middle . . 98 A 98 PRO middle . false 99 A 99 GLY middle . false 100 A 100 VAL middle . . 101 A 101 ALA middle . . 102 A 102 TRP middle . . 103 A 103 GLY middle . false 104 A 104 VAL middle . . 105 A 105 PHE middle . . 106 A 106 LYS end . . stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 GLU HA H 1 4.416 0.006 A 1 GLU HBy H 1 2.033 0.001 A 1 GLU HBx H 1 1.933 0.002 A 1 GLU HGx H 1 2.263 0.002 A 1 GLU HGy H 1 2.263 0.002 A 1 GLU C C 13 176.077 0.000 A 1 GLU CA C 13 56.306 0.044 A 1 GLU CB C 13 30.552 0.023 A 1 GLU CG C 13 36.190 0.013 A 2 THR H H 1 8.465 0.002 A 2 THR HA H 1 4.600 0.000 A 2 THR HB H 1 4.160 0.002 A 2 THR HG2% H 1 1.245 0.001 A 2 THR C C 13 172.816 0.000 A 2 THR CA C 13 59.867 0.047 A 2 THR CB C 13 69.742 0.047 A 2 THR CG2 C 13 21.384 0.053 A 2 THR N N 15 118.977 0.016 A 3 PRO HA H 1 4.398 0.004 A 3 PRO HBy H 1 2.315 0.004 A 3 PRO HBx H 1 1.914 0.002 A 3 PRO HDy H 1 3.875 0.002 A 3 PRO HDx H 1 3.716 0.001 A 3 PRO HGy H 1 2.049 0.004 A 3 PRO HGx H 1 1.991 0.005 A 3 PRO C C 13 176.692 0.006 A 3 PRO CA C 13 63.340 0.038 A 3 PRO CB C 13 32.143 0.036 A 3 PRO CD C 13 51.112 0.075 A 3 PRO CG C 13 27.461 0.052 A 4 ALA H H 1 8.413 0.002 A 4 ALA HA H 1 4.326 0.006 A 4 ALA HB% H 1 1.410 0.002 A 4 ALA C C 13 178.038 0.004 A 4 ALA CA C 13 52.689 0.042 A 4 ALA CB C 13 19.235 0.033 A 4 ALA N N 15 124.116 0.019 A 5 THR H H 1 8.072 0.003 A 5 THR HA H 1 4.266 0.003 A 5 THR HB H 1 4.162 0.002 A 5 THR HG2% H 1 1.171 0.001 A 5 THR C C 13 174.300 0.003 A 5 THR CA C 13 61.636 0.059 A 5 THR CB C 13 69.811 0.025 A 5 THR CG2 C 13 21.771 0.010 A 5 THR N N 15 113.124 0.021 A 6 ARG H H 1 8.280 0.002 A 6 ARG HA H 1 4.647 0.000 A 6 ARG HBy H 1 1.847 0.002 A 6 ARG HBx H 1 1.742 0.003 A 6 ARG HDx H 1 3.210 0.001 A 6 ARG HDy H 1 3.210 0.001 A 6 ARG HGx H 1 1.679 0.003 A 6 ARG HGy H 1 1.679 0.003 A 6 ARG C C 13 174.095 0.000 A 6 ARG CA C 13 53.967 0.014 A 6 ARG CB C 13 30.327 0.040 A 6 ARG CD C 13 43.399 0.012 A 6 ARG CG C 13 26.816 0.045 A 6 ARG N N 15 124.599 0.012 A 7 PRO HA H 1 4.496 0.005 A 7 PRO HBy H 1 2.298 0.003 A 7 PRO HBx H 1 1.915 0.002 A 7 PRO HDy H 1 3.839 0.003 A 7 PRO HDx H 1 3.636 0.002 A 7 PRO HGx H 1 2.034 0.002 A 7 PRO HGy H 1 2.034 0.002 A 7 PRO C C 13 177.056 0.000 A 7 PRO CA C 13 63.022 0.035 A 7 PRO CB C 13 32.123 0.048 A 7 PRO CD C 13 50.677 0.031 A 7 PRO CG C 13 27.511 0.025 A 8 VAL H H 1 8.437 0.004 A 8 VAL HA H 1 4.199 0.001 A 8 VAL HB H 1 2.138 0.001 A 8 VAL HGx% H 1 0.981 0.003 A 8 VAL HGy% H 1 0.981 0.003 A 8 VAL C C 13 176.636 0.001 A 8 VAL CA C 13 62.551 0.067 A 8 VAL CB C 13 32.761 0.043 A 8 VAL CGx C 13 21.026 0.157 A 8 VAL CGy C 13 21.026 0.157 A 8 VAL N N 15 120.904 0.019 A 9 THR H H 1 8.204 0.002 A 9 THR HA H 1 4.368 0.001 A 9 THR HB H 1 4.284 0.001 A 9 THR HG2% H 1 1.158 0.000 A 9 THR C C 13 174.821 0.000 A 9 THR CA C 13 61.695 0.041 A 9 THR CB C 13 69.620 0.000 A 9 THR CG2 C 13 21.439 0.003 A 9 THR N N 15 116.591 0.030 A 10 GLY H H 1 8.354 0.000 A 10 GLY N N 15 111.147 0.000 A 11 SER HA H 1 4.505 0.007 A 11 SER HBy H 1 3.884 0.018 A 11 SER HBx H 1 3.765 0.008 A 11 SER C C 13 173.844 0.000 A 11 SER CA C 13 58.000 0.064 A 11 SER CB C 13 64.211 0.031 A 12 TRP H H 1 8.178 0.003 A 12 TRP HA H 1 4.555 0.008 A 12 TRP HBy H 1 3.395 0.003 A 12 TRP HBx H 1 3.184 0.008 A 12 TRP HD1 H 1 7.375 0.002 A 12 TRP HE1 H 1 10.104 0.000 A 12 TRP HE3 H 1 7.474 0.003 A 12 TRP HH2 H 1 6.854 0.001 A 12 TRP HZ2 H 1 7.280 0.002 A 12 TRP HZ3 H 1 6.955 0.002 A 12 TRP C C 13 176.505 0.004 A 12 TRP CA C 13 58.068 0.065 A 12 TRP CB C 13 30.942 0.050 A 12 TRP CD1 C 13 127.851 0.053 A 12 TRP CE3 C 13 119.763 0.101 A 12 TRP CH2 C 13 124.601 0.042 A 12 TRP CZ2 C 13 114.090 0.049 A 12 TRP CZ3 C 13 121.914 0.076 A 12 TRP N N 15 121.726 0.014 A 12 TRP NE1 N 15 128.710 0.000 A 13 LYS H H 1 8.754 0.005 A 13 LYS HA H 1 4.627 0.008 A 13 LYS HBy H 1 1.593 0.017 A 13 LYS HBx H 1 0.996 0.008 A 13 LYS HDx H 1 1.672 0.012 A 13 LYS HDy H 1 1.672 0.012 A 13 LYS HEx H 1 2.986 0.001 A 13 LYS HEy H 1 2.986 0.001 A 13 LYS HGx H 1 1.335 0.005 A 13 LYS HGy H 1 1.335 0.005 A 13 LYS C C 13 172.856 0.004 A 13 LYS CA C 13 55.151 0.049 A 13 LYS CB C 13 36.764 0.036 A 13 LYS CD C 13 29.303 0.023 A 13 LYS CE C 13 42.318 0.022 A 13 LYS CG C 13 25.472 0.068 A 13 LYS N N 15 123.186 0.013 A 14 LYS H H 1 8.112 0.003 A 14 LYS HA H 1 4.755 0.010 A 14 LYS HBy H 1 0.826 0.009 A 14 LYS HBx H 1 -0.544 0.007 A 14 LYS HDy H 1 1.271 0.002 A 14 LYS HDx H 1 1.100 0.003 A 14 LYS HEy H 1 2.739 0.003 A 14 LYS HEx H 1 2.639 0.002 A 14 LYS HGy H 1 0.887 0.006 A 14 LYS HGx H 1 -0.054 0.003 A 14 LYS C C 13 177.536 0.000 A 14 LYS CA C 13 54.318 0.051 A 14 LYS CB C 13 33.413 0.035 A 14 LYS CD C 13 28.983 0.043 A 14 LYS CE C 13 41.473 0.026 A 14 LYS CG C 13 23.326 0.055 A 14 LYS N N 15 121.341 0.019 A 15 ASN H H 1 8.576 0.002 A 15 ASN HA H 1 5.060 0.006 A 15 ASN HBy H 1 3.565 0.010 A 15 ASN HBx H 1 2.939 0.007 A 15 ASN HD2x H 1 7.538 0.000 A 15 ASN HD2y H 1 7.863 0.000 A 15 ASN C C 13 177.539 0.000 A 15 ASN CA C 13 50.793 0.033 A 15 ASN CB C 13 39.141 0.054 A 15 ASN N N 15 123.951 0.023 A 15 ASN ND2 N 15 112.268 0.001 A 16 GLN HA H 1 4.064 0.006 A 16 GLN HBy H 1 1.880 0.004 A 16 GLN HBx H 1 1.754 0.003 A 16 GLN HE2y H 1 7.275 0.003 A 16 GLN HE2x H 1 6.835 0.002 A 16 GLN HGx H 1 1.506 0.004 A 16 GLN HGy H 1 1.506 0.004 A 16 GLN C C 13 175.859 0.000 A 16 GLN CA C 13 57.786 0.035 A 16 GLN CB C 13 27.883 0.077 A 16 GLN CG C 13 32.335 0.013 A 16 GLN NE2 N 15 112.654 0.028 A 17 TYR H H 1 7.598 0.003 A 17 TYR HA H 1 4.655 0.005 A 17 TYR HBy H 1 3.487 0.010 A 17 TYR HBx H 1 2.830 0.008 A 17 TYR HDx H 1 6.995 0.002 A 17 TYR HEx H 1 6.744 0.002 A 17 TYR C C 13 175.822 0.005 A 17 TYR CA C 13 57.113 0.030 A 17 TYR CB C 13 37.972 0.034 A 17 TYR CDx C 13 132.833 0.119 A 17 TYR CEx C 13 118.530 0.042 A 17 TYR N N 15 119.281 0.019 A 18 GLY H H 1 7.993 0.003 A 18 GLY HAy H 1 4.375 0.006 A 18 GLY HAx H 1 3.346 0.004 A 18 GLY C C 13 173.323 0.000 A 18 GLY CA C 13 45.133 0.018 A 18 GLY N N 15 106.365 0.010 A 19 THR H H 1 7.790 0.004 A 19 THR HA H 1 4.189 0.010 A 19 THR HB H 1 4.097 0.006 A 19 THR HG2% H 1 1.082 0.007 A 19 THR C C 13 173.969 0.009 A 19 THR CA C 13 62.132 0.067 A 19 THR CB C 13 69.062 0.025 A 19 THR CG2 C 13 23.717 0.024 A 19 THR N N 15 120.043 0.023 A 20 TRP H H 1 8.058 0.003 A 20 TRP HA H 1 5.712 0.007 A 20 TRP HBy H 1 3.172 0.014 A 20 TRP HBx H 1 3.025 0.012 A 20 TRP HD1 H 1 7.482 0.004 A 20 TRP HE1 H 1 10.271 0.006 A 20 TRP HE3 H 1 7.340 0.004 A 20 TRP HH2 H 1 7.135 0.004 A 20 TRP HZ2 H 1 7.429 0.002 A 20 TRP HZ3 H 1 6.880 0.002 A 20 TRP C C 13 176.008 0.006 A 20 TRP CA C 13 56.565 0.048 A 20 TRP CB C 13 30.619 0.052 A 20 TRP CD1 C 13 127.047 0.134 A 20 TRP CE3 C 13 119.672 0.055 A 20 TRP CH2 C 13 124.783 0.144 A 20 TRP CZ2 C 13 114.964 0.051 A 20 TRP CZ3 C 13 121.370 0.065 A 20 TRP N N 15 129.726 0.027 A 20 TRP NE1 N 15 129.146 0.018 A 21 TYR H H 1 10.349 0.002 A 21 TYR HA H 1 6.351 0.007 A 21 TYR HBy H 1 3.256 0.009 A 21 TYR HBx H 1 2.889 0.011 A 21 TYR HDx H 1 7.047 0.004 A 21 TYR HEx H 1 6.562 0.003 A 21 TYR C C 13 173.622 0.004 A 21 TYR CA C 13 56.336 0.085 A 21 TYR CB C 13 44.046 0.041 A 21 TYR CDx C 13 133.902 0.054 A 21 TYR CEx C 13 117.649 0.043 A 21 TYR N N 15 123.162 0.017 A 22 LYS H H 1 8.916 0.005 A 22 LYS HA H 1 4.764 0.002 A 22 LYS HBy H 1 0.839 0.004 A 22 LYS HBx H 1 0.733 0.003 A 22 LYS HDy H 1 0.676 0.002 A 22 LYS HDx H 1 0.000 0.002 A 22 LYS HEx H 1 2.168 0.005 A 22 LYS HEy H 1 2.168 0.005 A 22 LYS HGy H 1 0.560 0.005 A 22 LYS HGx H 1 0.368 0.004 A 22 LYS C C 13 172.546 0.000 A 22 LYS CA C 13 53.741 0.055 A 22 LYS CB C 13 34.008 0.020 A 22 LYS CD C 13 28.698 0.021 A 22 LYS CE C 13 41.507 0.009 A 22 LYS CG C 13 22.360 0.035 A 22 LYS N N 15 119.223 0.046 A 23 PRO HA H 1 4.789 0.005 A 23 PRO HBy H 1 2.401 0.003 A 23 PRO HBx H 1 1.959 0.005 A 23 PRO HDy H 1 3.832 0.005 A 23 PRO HDx H 1 3.602 0.003 A 23 PRO HGx H 1 2.135 0.003 A 23 PRO HGy H 1 2.135 0.003 A 23 PRO C C 13 176.823 0.000 A 23 PRO CA C 13 62.716 0.060 A 23 PRO CB C 13 32.038 0.048 A 23 PRO CD C 13 51.003 0.056 A 23 PRO CG C 13 27.629 0.072 A 24 GLU H H 1 7.783 0.002 A 24 GLU HA H 1 3.980 0.006 A 24 GLU HBx H 1 1.953 0.007 A 24 GLU HBy H 1 1.953 0.007 A 24 GLU HGy H 1 2.044 0.004 A 24 GLU HGx H 1 1.815 0.007 A 24 GLU C C 13 170.882 0.001 A 24 GLU CA C 13 58.037 0.051 A 24 GLU CB C 13 33.285 0.074 A 24 GLU CG C 13 37.485 0.018 A 24 GLU N N 15 125.443 0.014 A 25 ASN H H 1 8.122 0.005 A 25 ASN HA H 1 5.397 0.009 A 25 ASN HBx H 1 2.627 0.005 A 25 ASN HBy H 1 2.627 0.005 A 25 ASN HD2x H 1 6.863 0.000 A 25 ASN HD2y H 1 7.643 0.000 A 25 ASN C C 13 173.665 0.005 A 25 ASN CA C 13 51.755 0.031 A 25 ASN CB C 13 39.528 0.028 A 25 ASN N N 15 122.345 0.033 A 25 ASN ND2 N 15 112.513 0.002 A 26 ALA H H 1 7.078 0.005 A 26 ALA HA H 1 4.440 0.008 A 26 ALA HB% H 1 1.431 0.007 A 26 ALA C C 13 172.875 0.007 A 26 ALA CA C 13 51.590 0.032 A 26 ALA CB C 13 19.669 0.034 A 26 ALA N N 15 126.524 0.013 A 27 THR H H 1 8.025 0.002 A 27 THR HA H 1 5.168 0.012 A 27 THR HB H 1 3.822 0.004 A 27 THR HG2% H 1 1.008 0.006 A 27 THR C C 13 172.863 0.007 A 27 THR CA C 13 62.265 0.076 A 27 THR CB C 13 71.088 0.050 A 27 THR CG2 C 13 21.987 0.053 A 27 THR N N 15 112.816 0.014 A 28 PHE H H 1 9.700 0.003 A 28 PHE HA H 1 5.327 0.006 A 28 PHE HBy H 1 2.973 0.021 A 28 PHE HBx H 1 2.783 0.006 A 28 PHE C C 13 172.943 0.013 A 28 PHE CA C 13 55.358 0.061 A 28 PHE CB C 13 43.189 0.037 A 28 PHE N N 15 127.876 0.017 A 29 VAL H H 1 8.562 0.003 A 29 VAL HA H 1 4.314 0.005 A 29 VAL HB H 1 1.626 0.003 A 29 VAL HGx% H 1 0.693 0.001 A 29 VAL HGy% H 1 0.586 0.005 A 29 VAL C C 13 175.834 0.002 A 29 VAL CA C 13 60.157 0.055 A 29 VAL CB C 13 31.868 0.077 A 29 VAL CGx C 13 19.987 0.047 A 29 VAL CGy C 13 20.192 0.008 A 29 VAL N N 15 127.283 0.021 A 30 ASN H H 1 8.963 0.004 A 30 ASN HA H 1 4.149 0.005 A 30 ASN HBy H 1 2.873 0.004 A 30 ASN HBx H 1 2.619 0.010 A 30 ASN HD2x H 1 6.647 0.000 A 30 ASN HD2y H 1 6.738 0.000 A 30 ASN C C 13 176.364 0.002 A 30 ASN CA C 13 53.557 0.039 A 30 ASN CB C 13 38.572 0.027 A 30 ASN N N 15 125.721 0.022 A 30 ASN ND2 N 15 108.398 0.002 A 31 GLY H H 1 8.350 0.002 A 31 GLY HAy H 1 4.187 0.011 A 31 GLY HAx H 1 3.777 0.007 A 31 GLY C C 13 173.933 0.000 A 31 GLY CA C 13 44.684 0.078 A 31 GLY N N 15 114.386 0.006 A 32 ASN H H 1 8.138 0.002 A 32 ASN HA H 1 4.511 0.009 A 32 ASN HBx H 1 2.828 0.002 A 32 ASN HBy H 1 2.828 0.002 A 32 ASN HD2y H 1 7.543 0.001 A 32 ASN HD2x H 1 6.852 0.001 A 32 ASN C C 13 174.782 0.001 A 32 ASN CA C 13 54.227 0.055 A 32 ASN CB C 13 38.534 0.035 A 32 ASN N N 15 115.517 0.018 A 32 ASN ND2 N 15 111.852 0.009 A 33 GLN H H 1 7.692 0.005 A 33 GLN HA H 1 4.964 0.003 A 33 GLN HBy H 1 1.994 0.000 A 33 GLN HBx H 1 1.817 0.002 A 33 GLN HE2y H 1 7.351 0.000 A 33 GLN HE2x H 1 6.819 0.002 A 33 GLN HGx H 1 2.227 0.006 A 33 GLN HGy H 1 2.227 0.006 A 33 GLN C C 13 172.670 0.000 A 33 GLN CA C 13 52.470 0.101 A 33 GLN CB C 13 30.377 0.018 A 33 GLN CG C 13 33.185 0.028 A 33 GLN N N 15 118.106 0.024 A 33 GLN NE2 N 15 112.646 0.019 A 34 PRO HA H 1 4.950 0.034 A 34 PRO HBy H 1 2.211 0.005 A 34 PRO HBx H 1 1.713 0.006 A 34 PRO HDy H 1 3.776 0.005 A 34 PRO HDx H 1 3.723 0.011 A 34 PRO HGy H 1 2.037 0.004 A 34 PRO HGx H 1 1.998 0.005 A 34 PRO C C 13 176.515 0.000 A 34 PRO CA C 13 62.343 0.052 A 34 PRO CB C 13 32.590 0.063 A 34 PRO CD C 13 50.698 0.021 A 34 PRO CG C 13 27.238 0.000 A 35 ILE H H 1 8.122 0.002 A 35 ILE HA H 1 4.269 0.006 A 35 ILE HB H 1 1.586 0.006 A 35 ILE HD1% H 1 1.226 0.001 A 35 ILE HG1y H 1 1.864 0.004 A 35 ILE HG1x H 1 0.965 0.005 A 35 ILE HG2% H 1 1.212 0.003 A 35 ILE C C 13 175.160 0.003 A 35 ILE CA C 13 60.759 0.008 A 35 ILE CB C 13 42.765 0.068 A 35 ILE CD1 C 13 14.696 0.017 A 35 ILE CG1 C 13 27.894 0.051 A 35 ILE CG2 C 13 19.878 0.006 A 35 ILE N N 15 121.076 0.012 A 36 VAL H H 1 8.412 0.002 A 36 VAL HA H 1 4.108 0.005 A 36 VAL HB H 1 2.021 0.004 A 36 VAL HGx% H 1 1.107 0.001 A 36 VAL HGy% H 1 1.026 0.001 A 36 VAL C C 13 176.059 0.003 A 36 VAL CA C 13 64.353 0.045 A 36 VAL CB C 13 31.887 0.064 A 36 VAL CGy C 13 22.051 0.009 A 36 VAL CGx C 13 21.502 0.041 A 36 VAL N N 15 128.244 0.015 A 37 THR H H 1 7.986 0.005 A 37 THR HA H 1 5.020 0.006 A 37 THR HB H 1 4.284 0.006 A 37 THR HG2% H 1 1.376 0.003 A 37 THR C C 13 174.919 0.002 A 37 THR CA C 13 61.276 0.040 A 37 THR CB C 13 70.997 0.019 A 37 THR CG2 C 13 22.196 0.031 A 37 THR N N 15 118.482 0.016 A 38 ARG H H 1 9.326 0.002 A 38 ARG HA H 1 5.431 0.006 A 38 ARG HBx H 1 2.072 0.011 A 38 ARG HBy H 1 2.072 0.011 A 38 ARG HDy H 1 3.279 0.008 A 38 ARG HDx H 1 3.187 0.004 A 38 ARG HGy H 1 2.386 0.006 A 38 ARG HGx H 1 1.813 0.006 A 38 ARG C C 13 175.636 0.008 A 38 ARG CA C 13 52.574 0.068 A 38 ARG CB C 13 33.442 0.068 A 38 ARG CD C 13 43.314 0.052 A 38 ARG CG C 13 26.373 0.000 A 38 ARG N N 15 118.253 0.045 A 39 ILE H H 1 8.729 0.002 A 39 ILE HA H 1 4.464 0.010 A 39 ILE HB H 1 1.702 0.003 A 39 ILE HD1% H 1 0.787 0.003 A 39 ILE HG1y H 1 1.427 0.004 A 39 ILE HG1x H 1 1.024 0.005 A 39 ILE HG2% H 1 0.863 0.006 A 39 ILE C C 13 179.251 0.000 A 39 ILE CA C 13 60.196 0.042 A 39 ILE CB C 13 38.258 0.017 A 39 ILE CD1 C 13 12.209 0.013 A 39 ILE CG1 C 13 27.170 0.036 A 39 ILE CG2 C 13 17.231 0.062 A 39 ILE N N 15 119.759 0.015 A 40 GLY H H 1 9.304 0.005 A 40 GLY HAy H 1 4.360 0.007 A 40 GLY HAx H 1 3.590 0.006 A 40 GLY C C 13 174.226 0.000 A 40 GLY CA C 13 47.717 0.024 A 40 GLY N N 15 116.055 0.037 A 41 SER H H 1 7.405 0.004 A 41 SER HA H 1 4.167 0.001 A 41 SER HBy H 1 3.575 0.002 A 41 SER HBx H 1 3.403 0.000 A 41 SER C C 13 170.326 0.000 A 41 SER CA C 13 56.302 0.043 A 41 SER CB C 13 63.889 0.012 A 41 SER N N 15 114.860 0.019 A 42 PRO HA H 1 2.620 0.007 A 42 PRO HBx H 1 -0.344 0.003 A 42 PRO HBy H 1 -0.344 0.003 A 42 PRO HDy H 1 1.526 0.006 A 42 PRO HDx H 1 1.478 0.000 A 42 PRO HGy H 1 0.991 0.003 A 42 PRO HGx H 1 0.656 0.010 A 42 PRO C C 13 170.012 0.000 A 42 PRO CA C 13 59.666 0.079 A 42 PRO CB C 13 25.762 0.093 A 42 PRO CD C 13 51.299 0.000 A 42 PRO CG C 13 26.907 0.076 A 43 PHE H H 1 6.602 0.004 A 43 PHE HA H 1 4.491 0.005 A 43 PHE HBy H 1 3.128 0.009 A 43 PHE HBx H 1 2.363 0.006 A 43 PHE HDx H 1 6.998 0.001 A 43 PHE HEx H 1 7.032 0.000 A 43 PHE C C 13 177.053 0.009 A 43 PHE CA C 13 55.559 0.049 A 43 PHE CB C 13 43.433 0.039 A 43 PHE CDx C 13 131.645 0.043 A 43 PHE CEx C 13 130.518 0.000 A 43 PHE N N 15 111.756 0.012 A 44 LEU H H 1 8.373 0.002 A 44 LEU HA H 1 4.309 0.008 A 44 LEU HBy H 1 1.873 0.008 A 44 LEU HBx H 1 1.793 0.005 A 44 LEU HDx% H 1 1.179 0.002 A 44 LEU HDy% H 1 0.874 0.003 A 44 LEU HG H 1 1.893 0.007 A 44 LEU C C 13 176.274 0.003 A 44 LEU CA C 13 56.229 0.050 A 44 LEU CB C 13 40.822 0.067 A 44 LEU CDy C 13 25.784 0.027 A 44 LEU CDx C 13 22.371 0.022 A 44 LEU CG C 13 27.708 0.033 A 44 LEU N N 15 119.353 0.019 A 45 ASN H H 1 7.664 0.004 A 45 ASN HA H 1 4.838 0.009 A 45 ASN HBy H 1 3.099 0.013 A 45 ASN HBx H 1 2.700 0.014 A 45 ASN HD2y H 1 7.502 0.002 A 45 ASN HD2x H 1 6.643 0.002 A 45 ASN C C 13 175.668 0.009 A 45 ASN CA C 13 51.613 0.081 A 45 ASN CB C 13 37.499 0.049 A 45 ASN N N 15 112.193 0.031 A 45 ASN ND2 N 15 111.081 0.034 A 46 ALA H H 1 7.137 0.004 A 46 ALA HA H 1 4.555 0.004 A 46 ALA HB% H 1 1.633 0.005 A 46 ALA C C 13 174.329 0.000 A 46 ALA CA C 13 51.432 0.020 A 46 ALA CB C 13 17.777 0.019 A 46 ALA N N 15 123.942 0.017 A 47 PRO HA H 1 4.391 0.007 A 47 PRO HBy H 1 2.396 0.004 A 47 PRO HBx H 1 1.749 0.011 A 47 PRO HDx H 1 3.890 0.012 A 47 PRO HDy H 1 3.890 0.012 A 47 PRO HGx H 1 2.128 0.005 A 47 PRO HGy H 1 2.128 0.005 A 47 PRO C C 13 176.347 0.000 A 47 PRO CA C 13 63.120 0.049 A 47 PRO CB C 13 32.189 0.072 A 47 PRO CD C 13 50.356 0.013 A 47 PRO CG C 13 28.131 0.001 A 48 VAL H H 1 8.323 0.003 A 48 VAL HA H 1 4.286 0.004 A 48 VAL HB H 1 2.136 0.003 A 48 VAL HGx% H 1 1.081 0.005 A 48 VAL HGy% H 1 1.081 0.005 A 48 VAL C C 13 177.885 0.003 A 48 VAL CA C 13 63.346 0.058 A 48 VAL CB C 13 32.734 0.045 A 48 VAL CGx C 13 21.687 0.022 A 48 VAL CGy C 13 21.687 0.022 A 48 VAL N N 15 121.050 0.022 A 49 GLY H H 1 8.787 0.002 A 49 GLY HAy H 1 4.326 0.005 A 49 GLY HAx H 1 3.399 0.006 A 49 GLY C C 13 173.947 0.000 A 49 GLY CA C 13 44.844 0.024 A 49 GLY N N 15 114.146 0.016 A 50 GLY H H 1 7.247 0.005 A 50 GLY HAy H 1 4.303 0.001 A 50 GLY HAx H 1 3.888 0.007 A 50 GLY CA C 13 43.798 0.013 A 50 GLY N N 15 107.327 0.019 A 51 ASN H H 1 8.785 0.000 A 51 ASN HA H 1 5.422 0.005 A 51 ASN HBy H 1 2.587 0.011 A 51 ASN HBx H 1 2.250 0.009 A 51 ASN HD2y H 1 7.335 0.003 A 51 ASN HD2x H 1 6.733 0.001 A 51 ASN C C 13 175.742 0.000 A 51 ASN CA C 13 52.312 0.022 A 51 ASN CB C 13 39.264 0.034 A 51 ASN N N 15 119.667 0.000 A 51 ASN ND2 N 15 111.131 0.029 A 52 LEU H H 1 10.070 0.005 A 52 LEU HA H 1 4.880 0.001 A 52 LEU HBy H 1 2.071 0.011 A 52 LEU HBx H 1 1.388 0.005 A 52 LEU HDx% H 1 1.136 0.001 A 52 LEU HDy% H 1 0.999 0.003 A 52 LEU HG H 1 1.644 0.008 A 52 LEU C C 13 174.435 0.000 A 52 LEU CA C 13 52.194 0.036 A 52 LEU CB C 13 42.983 0.065 A 52 LEU CDy C 13 26.864 0.051 A 52 LEU CDx C 13 24.779 0.025 A 52 LEU CG C 13 27.302 0.081 A 52 LEU N N 15 129.577 0.019 A 53 PRO HA H 1 4.307 0.005 A 53 PRO HBy H 1 2.374 0.003 A 53 PRO HBx H 1 1.851 0.006 A 53 PRO HDy H 1 4.317 0.004 A 53 PRO HDx H 1 3.538 0.005 A 53 PRO HGy H 1 2.055 0.002 A 53 PRO HGx H 1 1.973 0.005 A 53 PRO C C 13 177.584 0.000 A 53 PRO CA C 13 62.527 0.021 A 53 PRO CB C 13 32.761 0.053 A 53 PRO CD C 13 51.338 0.026 A 53 PRO CG C 13 27.437 0.000 A 54 ALA H H 1 8.567 0.002 A 54 ALA HA H 1 4.239 0.006 A 54 ALA HB% H 1 1.149 0.006 A 54 ALA C C 13 179.990 0.013 A 54 ALA CA C 13 53.233 0.036 A 54 ALA CB C 13 18.281 0.025 A 54 ALA N N 15 125.224 0.013 A 55 GLY H H 1 7.995 0.002 A 55 GLY HAx H 1 3.869 0.008 A 55 GLY HAy H 1 3.869 0.008 A 55 GLY C C 13 173.502 0.000 A 55 GLY CA C 13 45.915 0.038 A 55 GLY N N 15 110.960 0.006 A 56 ALA H H 1 7.347 0.003 A 56 ALA HA H 1 4.232 0.007 A 56 ALA HB% H 1 1.438 0.007 A 56 ALA C C 13 175.704 0.002 A 56 ALA CA C 13 52.826 0.030 A 56 ALA CB C 13 20.796 0.040 A 56 ALA N N 15 122.229 0.007 A 57 THR H H 1 8.170 0.003 A 57 THR HA H 1 5.164 0.008 A 57 THR HB H 1 3.907 0.002 A 57 THR HG2% H 1 1.043 0.008 A 57 THR C C 13 174.638 0.007 A 57 THR CA C 13 62.116 0.068 A 57 THR CB C 13 70.570 0.037 A 57 THR CG2 C 13 21.542 0.055 A 57 THR N N 15 114.968 0.015 A 58 ILE H H 1 9.617 0.002 A 58 ILE HA H 1 4.397 0.005 A 58 ILE HB H 1 1.682 0.006 A 58 ILE HD1% H 1 0.611 0.002 A 58 ILE HG1y H 1 1.096 0.003 A 58 ILE HG1x H 1 0.818 0.002 A 58 ILE HG2% H 1 0.416 0.001 A 58 ILE C C 13 173.897 0.001 A 58 ILE CA C 13 58.350 0.048 A 58 ILE CB C 13 42.232 0.039 A 58 ILE CD1 C 13 12.365 0.009 A 58 ILE CG1 C 13 27.076 0.034 A 58 ILE CG2 C 13 18.165 0.028 A 58 ILE N N 15 127.509 0.022 A 59 VAL H H 1 8.039 0.002 A 59 VAL HA H 1 4.662 0.009 A 59 VAL HB H 1 1.944 0.005 A 59 VAL HGx% H 1 0.945 0.002 A 59 VAL HGy% H 1 0.846 0.007 A 59 VAL C C 13 175.522 0.002 A 59 VAL CA C 13 62.182 0.054 A 59 VAL CB C 13 31.604 0.041 A 59 VAL CGx C 13 20.886 0.010 A 59 VAL CGy C 13 21.095 0.012 A 59 VAL N N 15 128.263 0.018 A 60 TYR H H 1 8.838 0.003 A 60 TYR HA H 1 5.420 0.005 A 60 TYR HBy H 1 3.961 0.008 A 60 TYR HBx H 1 2.618 0.017 A 60 TYR HDx H 1 7.374 0.003 A 60 TYR HEx H 1 7.025 0.001 A 60 TYR C C 13 174.284 0.009 A 60 TYR CA C 13 55.846 0.025 A 60 TYR CB C 13 42.380 0.107 A 60 TYR CDx C 13 135.734 0.077 A 60 TYR CEx C 13 135.197 0.007 A 60 TYR N N 15 126.920 0.019 A 61 ASP H H 1 8.832 0.003 A 61 ASP HA H 1 5.455 0.003 A 61 ASP HBy H 1 3.072 0.010 A 61 ASP HBx H 1 2.439 0.003 A 61 ASP C C 13 177.988 0.006 A 61 ASP CA C 13 54.242 0.082 A 61 ASP CB C 13 43.479 0.021 A 61 ASP N N 15 115.085 0.011 A 62 GLU H H 1 8.115 0.003 A 62 GLU HA H 1 5.109 0.009 A 62 GLU HBy H 1 2.106 0.005 A 62 GLU HBx H 1 1.835 0.006 A 62 GLU HGx H 1 2.291 0.004 A 62 GLU HGy H 1 2.367 0.004 A 62 GLU C C 13 173.620 0.000 A 62 GLU CA C 13 55.794 0.037 A 62 GLU CB C 13 35.471 0.092 A 62 GLU CG C 13 37.257 0.077 A 62 GLU N N 15 124.281 0.013 A 63 VAL H H 1 8.824 0.002 A 63 VAL HA H 1 5.739 0.003 A 63 VAL HB H 1 1.920 0.005 A 63 VAL HGx% H 1 1.008 0.001 A 63 VAL HGy% H 1 0.929 0.000 A 63 VAL C C 13 175.470 0.005 A 63 VAL CA C 13 59.792 0.052 A 63 VAL CB C 13 35.621 0.060 A 63 VAL CGy C 13 22.523 0.024 A 63 VAL CGx C 13 22.079 0.050 A 63 VAL N N 15 121.730 0.042 A 64 CYS H H 1 9.396 0.005 A 64 CYS HA H 1 6.337 0.008 A 64 CYS HBy H 1 2.943 0.008 A 64 CYS HBx H 1 2.455 0.002 A 64 CYS C C 13 174.248 0.005 A 64 CYS CA C 13 56.100 0.128 A 64 CYS CB C 13 33.067 0.024 A 64 CYS N N 15 118.152 0.027 A 65 ILE H H 1 9.804 0.002 A 65 ILE HA H 1 5.269 0.005 A 65 ILE HB H 1 1.534 0.002 A 65 ILE HD1% H 1 -0.150 0.001 A 65 ILE HG1y H 1 1.505 0.004 A 65 ILE HG1x H 1 0.966 0.012 A 65 ILE HG2% H 1 0.862 0.001 A 65 ILE C C 13 176.206 0.001 A 65 ILE CA C 13 61.631 0.059 A 65 ILE CB C 13 41.417 0.071 A 65 ILE CD1 C 13 14.014 0.038 A 65 ILE CG1 C 13 28.076 0.047 A 65 ILE CG2 C 13 17.269 0.036 A 65 ILE N N 15 121.988 0.022 A 66 GLN H H 1 8.930 0.003 A 66 GLN HA H 1 4.622 0.000 A 66 GLN HBy H 1 2.338 0.000 A 66 GLN HBx H 1 1.725 0.001 A 66 GLN HE2x H 1 6.529 0.000 A 66 GLN HE2y H 1 7.770 0.000 A 66 GLN HGy H 1 1.596 0.000 A 66 GLN HGx H 1 1.076 0.000 A 66 GLN C C 13 176.041 0.013 A 66 GLN CA C 13 55.349 0.091 A 66 GLN CB C 13 31.215 0.012 A 66 GLN CG C 13 34.728 0.001 A 66 GLN N N 15 125.982 0.020 A 66 GLN NE2 N 15 116.113 0.001 A 67 ALA H H 1 9.922 0.002 A 67 ALA HA H 1 4.517 0.007 A 67 ALA HB% H 1 1.893 0.002 A 67 ALA C C 13 178.506 0.007 A 67 ALA CA C 13 53.498 0.104 A 67 ALA CB C 13 18.316 0.017 A 67 ALA N N 15 131.319 0.038 A 68 GLY H H 1 9.699 0.005 A 68 GLY HAy H 1 4.072 0.012 A 68 GLY HAx H 1 3.795 0.007 A 68 GLY C C 13 174.824 0.000 A 68 GLY CA C 13 46.399 0.043 A 68 GLY N N 15 107.673 0.036 A 69 HIS H H 1 8.340 0.004 A 69 HIS HA H 1 4.807 0.007 A 69 HIS HBy H 1 2.526 0.007 A 69 HIS HBx H 1 2.232 0.000 A 69 HIS HD2 H 1 6.326 0.002 A 69 HIS HE1 H 1 7.791 0.001 A 69 HIS C C 13 173.657 0.003 A 69 HIS CA C 13 56.185 0.116 A 69 HIS CB C 13 31.843 0.021 A 69 HIS CD2 C 13 127.754 0.000 A 69 HIS CE1 C 13 139.255 0.113 A 69 HIS N N 15 118.303 0.012 A 70 ILE H H 1 8.086 0.006 A 70 ILE HA H 1 5.234 0.006 A 70 ILE HB H 1 1.246 0.002 A 70 ILE HD1% H 1 0.781 0.002 A 70 ILE HG1y H 1 1.379 0.005 A 70 ILE HG1x H 1 1.024 0.008 A 70 ILE HG2% H 1 0.891 0.006 A 70 ILE C C 13 174.597 0.000 A 70 ILE CA C 13 60.879 0.030 A 70 ILE CB C 13 39.035 0.064 A 70 ILE CD1 C 13 13.678 0.023 A 70 ILE CG1 C 13 30.639 0.071 A 70 ILE CG2 C 13 17.473 0.026 A 70 ILE N N 15 119.029 0.020 A 71 TRP H H 1 9.823 0.006 A 71 TRP HA H 1 5.490 0.006 A 71 TRP HBy H 1 3.191 0.011 A 71 TRP HBx H 1 2.773 0.008 A 71 TRP HD1 H 1 7.147 0.004 A 71 TRP HE1 H 1 10.326 0.003 A 71 TRP HE3 H 1 7.047 0.003 A 71 TRP HH2 H 1 6.586 0.004 A 71 TRP HZ2 H 1 6.730 0.005 A 71 TRP HZ3 H 1 6.813 0.002 A 71 TRP C C 13 176.213 0.000 A 71 TRP CA C 13 54.309 0.047 A 71 TRP CB C 13 31.870 0.039 A 71 TRP CD1 C 13 127.395 0.055 A 71 TRP CE3 C 13 120.075 0.069 A 71 TRP CH2 C 13 123.386 0.063 A 71 TRP CZ2 C 13 113.722 0.044 A 71 TRP CZ3 C 13 121.290 0.087 A 71 TRP N N 15 127.016 0.024 A 71 TRP NE1 N 15 133.310 0.027 A 72 ILE H H 1 8.885 0.003 A 72 ILE HA H 1 5.478 0.006 A 72 ILE HB H 1 1.504 0.003 A 72 ILE HD1% H 1 0.461 0.001 A 72 ILE HG1y H 1 1.615 0.002 A 72 ILE HG1x H 1 1.117 0.004 A 72 ILE HG2% H 1 0.113 0.004 A 72 ILE C C 13 175.282 0.010 A 72 ILE CA C 13 59.182 0.052 A 72 ILE CB C 13 39.649 0.118 A 72 ILE CD1 C 13 14.346 0.018 A 72 ILE CG1 C 13 25.373 0.011 A 72 ILE CG2 C 13 15.876 0.015 A 72 ILE N N 15 113.302 0.017 A 73 GLY H H 1 9.041 0.003 A 73 GLY HAy H 1 5.080 0.016 A 73 GLY HAx H 1 3.060 0.004 A 73 GLY C C 13 172.030 0.000 A 73 GLY CA C 13 45.024 0.019 A 73 GLY N N 15 109.696 0.018 A 74 TYR H H 1 8.413 0.003 A 74 TYR HA H 1 4.900 0.007 A 74 TYR HBy H 1 3.296 0.002 A 74 TYR HBx H 1 3.078 0.009 A 74 TYR HDx H 1 6.616 0.003 A 74 TYR HEx H 1 6.483 0.002 A 74 TYR C C 13 172.628 0.003 A 74 TYR CA C 13 56.320 0.076 A 74 TYR CB C 13 40.033 0.028 A 74 TYR CDx C 13 133.971 0.086 A 74 TYR CEx C 13 117.326 0.046 A 74 TYR N N 15 117.780 0.021 A 75 ASN H H 1 8.841 0.003 A 75 ASN HA H 1 5.279 0.006 A 75 ASN HBy H 1 2.753 0.010 A 75 ASN HBx H 1 2.576 0.007 A 75 ASN HD2y H 1 7.501 0.001 A 75 ASN HD2x H 1 7.086 0.002 A 75 ASN C C 13 175.346 0.003 A 75 ASN CA C 13 51.938 0.023 A 75 ASN CB C 13 39.338 0.018 A 75 ASN N N 15 117.171 0.021 A 75 ASN ND2 N 15 114.997 0.026 A 76 ALA H H 1 8.856 0.002 A 76 ALA HA H 1 4.622 0.001 A 76 ALA HB% H 1 1.492 0.007 A 76 ALA C C 13 179.057 0.000 A 76 ALA CA C 13 51.279 0.028 A 76 ALA CB C 13 20.467 0.016 A 76 ALA N N 15 126.160 0.013 A 77 TYR H H 1 8.665 0.000 A 77 TYR HA H 1 4.347 0.005 A 77 TYR HBy H 1 3.191 0.001 A 77 TYR HBx H 1 3.123 0.002 A 77 TYR HDx H 1 7.179 0.001 A 77 TYR HEx H 1 6.884 0.002 A 77 TYR C C 13 175.981 0.000 A 77 TYR CA C 13 60.079 0.047 A 77 TYR CB C 13 37.579 0.021 A 77 TYR CDx C 13 133.338 0.090 A 77 TYR CEx C 13 118.376 0.016 A 77 TYR N N 15 121.126 0.000 A 78 ASN H H 1 7.497 0.002 A 78 ASN HA H 1 4.414 0.009 A 78 ASN HBy H 1 3.048 0.003 A 78 ASN HBx H 1 2.517 0.003 A 78 ASN HD2y H 1 7.421 0.001 A 78 ASN HD2x H 1 6.576 0.004 A 78 ASN C C 13 175.985 0.006 A 78 ASN CA C 13 52.288 0.059 A 78 ASN CB C 13 37.270 0.027 A 78 ASN N N 15 115.361 0.016 A 78 ASN ND2 N 15 109.272 0.003 A 79 GLY H H 1 8.010 0.002 A 79 GLY HAy H 1 4.264 0.003 A 79 GLY HAx H 1 3.602 0.006 A 79 GLY C C 13 174.620 0.000 A 79 GLY CA C 13 45.071 0.030 A 79 GLY N N 15 107.173 0.013 A 80 ASN H H 1 7.667 0.002 A 80 ASN HA H 1 4.579 0.009 A 80 ASN HBy H 1 2.648 0.007 A 80 ASN HBx H 1 2.437 0.006 A 80 ASN HD2y H 1 7.287 0.001 A 80 ASN HD2x H 1 7.104 0.003 A 80 ASN C C 13 173.770 0.004 A 80 ASN CA C 13 52.957 0.038 A 80 ASN CB C 13 38.993 0.033 A 80 ASN N N 15 118.491 0.008 A 80 ASN ND2 N 15 111.548 0.020 A 81 ARG H H 1 8.623 0.003 A 81 ARG HA H 1 4.557 0.007 A 81 ARG HBy H 1 1.862 0.003 A 81 ARG HBx H 1 1.637 0.020 A 81 ARG HDy H 1 3.089 0.006 A 81 ARG HDx H 1 2.963 0.000 A 81 ARG HGy H 1 1.740 0.005 A 81 ARG HGx H 1 1.249 0.008 A 81 ARG C C 13 174.432 0.005 A 81 ARG CA C 13 54.706 0.038 A 81 ARG CB C 13 30.521 0.054 A 81 ARG CD C 13 42.218 0.010 A 81 ARG CG C 13 25.917 0.004 A 81 ARG N N 15 123.156 0.013 A 82 VAL H H 1 8.658 0.003 A 82 VAL HA H 1 4.546 0.008 A 82 VAL HB H 1 0.775 0.003 A 82 VAL HGx% H 1 0.777 0.006 A 82 VAL HGy% H 1 0.543 0.006 A 82 VAL C C 13 172.305 0.000 A 82 VAL CA C 13 60.717 0.057 A 82 VAL CB C 13 34.383 0.043 A 82 VAL CGy C 13 22.657 0.012 A 82 VAL CGx C 13 21.888 0.012 A 82 VAL N N 15 128.403 0.016 A 83 TYR H H 1 8.933 0.004 A 83 TYR HA H 1 5.493 0.007 A 83 TYR HBy H 1 2.712 0.002 A 83 TYR HBx H 1 2.128 0.019 A 83 TYR C C 13 175.234 0.010 A 83 TYR CA C 13 56.495 0.057 A 83 TYR CB C 13 42.435 0.054 A 83 TYR N N 15 119.071 0.021 A 84 CYS H H 1 9.672 0.004 A 84 CYS HA H 1 5.444 0.003 A 84 CYS HBy H 1 3.119 0.002 A 84 CYS HBx H 1 2.597 0.002 A 84 CYS C C 13 171.933 0.000 A 84 CYS CA C 13 54.175 0.012 A 84 CYS CB C 13 29.784 0.028 A 84 CYS N N 15 124.390 0.039 A 85 PRO HA H 1 4.191 0.033 A 85 PRO C C 13 175.489 0.000 A 85 PRO CA C 13 62.601 0.035 A 85 PRO CB C 13 29.365 0.000 A 86 VAL H H 1 8.360 0.003 A 86 VAL HA H 1 4.407 0.005 A 86 VAL HB H 1 1.924 0.004 A 86 VAL HGx% H 1 0.483 0.005 A 86 VAL HGy% H 1 -0.081 0.000 A 86 VAL C C 13 173.601 0.008 A 86 VAL CA C 13 61.031 0.023 A 86 VAL CB C 13 33.475 0.049 A 86 VAL CGx C 13 18.451 0.015 A 86 VAL CGy C 13 21.668 0.021 A 86 VAL N N 15 109.309 0.028 A 87 ARG H H 1 6.712 0.008 A 87 ARG HA H 1 3.124 0.008 A 87 ARG HBy H 1 2.163 0.010 A 87 ARG HBx H 1 1.401 0.011 A 87 ARG HDx H 1 2.692 0.004 A 87 ARG HDy H 1 2.692 0.004 A 87 ARG HGy H 1 1.507 0.000 A 87 ARG HGx H 1 1.379 0.000 A 87 ARG C C 13 175.430 0.001 A 87 ARG CA C 13 54.373 0.066 A 87 ARG CB C 13 32.034 0.057 A 87 ARG CD C 13 44.735 0.025 A 87 ARG CG C 13 22.606 0.000 A 87 ARG N N 15 110.884 0.037 A 88 THR H H 1 8.870 0.003 A 88 THR HA H 1 4.209 0.008 A 88 THR HB H 1 4.110 0.005 A 88 THR HG2% H 1 1.271 0.003 A 88 THR C C 13 174.233 0.008 A 88 THR CA C 13 62.364 0.065 A 88 THR CB C 13 70.520 0.011 A 88 THR CG2 C 13 22.109 0.011 A 88 THR N N 15 111.102 0.017 A 89 CYS H H 1 7.953 0.004 A 89 CYS HA H 1 4.450 0.006 A 89 CYS HBy H 1 2.334 0.010 A 89 CYS HBx H 1 2.260 0.002 A 89 CYS C C 13 172.749 0.002 A 89 CYS CA C 13 59.678 0.039 A 89 CYS CB C 13 29.431 0.046 A 89 CYS N N 15 119.587 0.010 A 90 GLN H H 1 7.986 0.003 A 90 GLN HA H 1 4.589 0.006 A 90 GLN HBy H 1 2.059 0.003 A 90 GLN HBx H 1 1.912 0.003 A 90 GLN HE2x H 1 6.838 0.000 A 90 GLN HE2y H 1 7.536 0.000 A 90 GLN HGy H 1 2.335 0.003 A 90 GLN HGx H 1 2.296 0.005 A 90 GLN C C 13 175.402 0.002 A 90 GLN CA C 13 54.291 0.046 A 90 GLN CB C 13 31.022 0.055 A 90 GLN CG C 13 33.773 0.012 A 90 GLN N N 15 129.741 0.028 A 90 GLN NE2 N 15 112.172 0.004 A 91 GLY H H 1 8.524 0.004 A 91 GLY HAy H 1 4.051 0.012 A 91 GLY HAx H 1 3.670 0.006 A 91 GLY C C 13 171.689 0.000 A 91 GLY CA C 13 44.174 0.031 A 91 GLY N N 15 112.117 0.013 A 92 VAL H H 1 7.649 0.002 A 92 VAL HA H 1 4.134 0.001 A 92 VAL HB H 1 1.298 0.006 A 92 VAL HGx% H 1 0.801 0.004 A 92 VAL HGy% H 1 0.594 0.007 A 92 VAL C C 13 171.736 0.000 A 92 VAL CA C 13 57.775 0.022 A 92 VAL CB C 13 32.166 0.021 A 92 VAL CGy C 13 21.626 0.039 A 92 VAL CGx C 13 17.270 0.021 A 92 VAL N N 15 108.947 0.027 A 94 PRO HA H 1 4.368 0.009 A 94 PRO HBy H 1 2.329 0.010 A 94 PRO HBx H 1 2.000 0.006 A 94 PRO HDx H 1 3.248 0.006 A 94 PRO HDy H 1 3.248 0.006 A 94 PRO HGy H 1 1.887 0.003 A 94 PRO HGx H 1 1.516 0.008 A 94 PRO C C 13 175.831 0.000 A 94 PRO CA C 13 64.387 0.038 A 94 PRO CB C 13 33.467 0.035 A 94 PRO CD C 13 48.966 0.033 A 94 PRO CG C 13 24.206 0.075 A 95 ASN H H 1 8.452 0.002 A 95 ASN HA H 1 4.896 0.005 A 95 ASN HBy H 1 2.935 0.008 A 95 ASN HBx H 1 2.446 0.009 A 95 ASN HD2y H 1 7.702 0.002 A 95 ASN HD2x H 1 6.981 0.002 A 95 ASN C C 13 173.180 0.002 A 95 ASN CA C 13 52.991 0.021 A 95 ASN CB C 13 39.726 0.036 A 95 ASN N N 15 124.398 0.014 A 95 ASN ND2 N 15 114.655 0.034 A 96 GLN H H 1 8.831 0.002 A 96 GLN HA H 1 4.119 0.005 A 96 GLN HBy H 1 1.173 0.000 A 96 GLN HBx H 1 0.763 0.018 A 96 GLN HE2x H 1 6.176 0.000 A 96 GLN HE2y H 1 7.138 0.000 A 96 GLN HGy H 1 1.934 0.002 A 96 GLN HGx H 1 1.839 0.000 A 96 GLN C C 13 174.773 0.003 A 96 GLN CA C 13 55.291 0.036 A 96 GLN CB C 13 27.175 0.042 A 96 GLN CG C 13 31.522 0.025 A 96 GLN N N 15 123.482 0.009 A 96 GLN NE2 N 15 107.517 0.001 A 97 ILE H H 1 8.926 0.003 A 97 ILE HA H 1 4.450 0.003 A 97 ILE HB H 1 1.776 0.007 A 97 ILE HD1% H 1 0.740 0.003 A 97 ILE HG1y H 1 1.448 0.007 A 97 ILE HG1x H 1 0.909 0.003 A 97 ILE HG2% H 1 0.741 0.001 A 97 ILE C C 13 174.402 0.000 A 97 ILE CA C 13 58.267 0.044 A 97 ILE CB C 13 39.501 0.013 A 97 ILE CD1 C 13 13.044 0.021 A 97 ILE CG1 C 13 26.245 0.033 A 97 ILE CG2 C 13 17.464 0.033 A 97 ILE N N 15 122.554 0.023 A 98 PRO HA H 1 4.458 0.006 A 98 PRO HBy H 1 2.027 0.007 A 98 PRO HBx H 1 1.924 0.018 A 98 PRO HDy H 1 3.690 0.005 A 98 PRO HDx H 1 3.581 0.000 A 98 PRO HGy H 1 1.883 0.000 A 98 PRO HGx H 1 1.669 0.001 A 98 PRO C C 13 177.190 0.000 A 98 PRO CA C 13 62.519 0.011 A 98 PRO CB C 13 32.419 0.058 A 98 PRO CD C 13 51.660 0.175 A 98 PRO CG C 13 27.446 0.000 A 99 GLY H H 1 8.506 0.002 A 99 GLY HAy H 1 4.247 0.010 A 99 GLY HAx H 1 3.736 0.004 A 99 GLY C C 13 173.929 0.000 A 99 GLY CA C 13 43.022 0.043 A 99 GLY N N 15 110.804 0.012 A 100 VAL H H 1 8.481 0.004 A 100 VAL HA H 1 3.907 0.005 A 100 VAL HB H 1 2.087 0.003 A 100 VAL HGx% H 1 1.117 0.003 A 100 VAL HGy% H 1 1.117 0.003 A 100 VAL C C 13 176.120 0.000 A 100 VAL CA C 13 63.684 0.061 A 100 VAL CB C 13 31.965 0.046 A 100 VAL CGx C 13 21.116 0.002 A 100 VAL CGy C 13 21.116 0.002 A 100 VAL N N 15 121.851 0.012 A 101 ALA H H 1 8.811 0.003 A 101 ALA HA H 1 4.469 0.009 A 101 ALA HB% H 1 1.724 0.004 A 101 ALA C C 13 179.438 0.001 A 101 ALA CA C 13 52.658 0.046 A 101 ALA CB C 13 20.490 0.031 A 101 ALA N N 15 127.733 0.009 A 102 TRP H H 1 8.533 0.002 A 102 TRP HA H 1 5.113 0.007 A 102 TRP HBy H 1 3.727 0.005 A 102 TRP HBx H 1 3.248 0.009 A 102 TRP HD1 H 1 7.112 0.003 A 102 TRP HE1 H 1 9.963 0.003 A 102 TRP HE3 H 1 7.573 0.002 A 102 TRP HH2 H 1 7.225 0.003 A 102 TRP HZ2 H 1 7.439 0.003 A 102 TRP HZ3 H 1 6.775 0.003 A 102 TRP C C 13 174.745 0.003 A 102 TRP CA C 13 55.591 0.037 A 102 TRP CB C 13 28.084 0.052 A 102 TRP CD1 C 13 125.600 0.147 A 102 TRP CE3 C 13 121.173 0.080 A 102 TRP CH2 C 13 124.128 0.047 A 102 TRP CZ2 C 13 113.847 0.120 A 102 TRP CZ3 C 13 121.257 0.084 A 102 TRP N N 15 121.890 0.013 A 102 TRP NE1 N 15 128.181 0.010 A 103 GLY H H 1 7.263 0.005 A 103 GLY HAx H 1 3.966 0.027 A 103 GLY HAy H 1 3.966 0.027 A 103 GLY C C 13 171.688 0.000 A 103 GLY CA C 13 45.709 0.011 A 103 GLY N N 15 103.951 0.024 A 104 VAL H H 1 8.259 0.005 A 104 VAL HA H 1 4.334 0.005 A 104 VAL HB H 1 1.838 0.001 A 104 VAL HGx% H 1 0.860 0.003 A 104 VAL HGy% H 1 0.809 0.004 A 104 VAL C C 13 173.267 0.002 A 104 VAL CA C 13 60.709 0.035 A 104 VAL CB C 13 35.432 0.041 A 104 VAL CGy C 13 21.127 0.027 A 104 VAL CGx C 13 20.821 0.042 A 104 VAL N N 15 119.068 0.012 A 105 PHE H H 1 8.438 0.003 A 105 PHE HA H 1 5.538 0.004 A 105 PHE HBy H 1 3.409 0.005 A 105 PHE HBx H 1 2.936 0.012 A 105 PHE HDx H 1 7.672 0.003 A 105 PHE HEx H 1 7.071 0.002 A 105 PHE HZ H 1 6.838 0.005 A 105 PHE C C 13 175.760 0.002 A 105 PHE CA C 13 57.159 0.032 A 105 PHE CB C 13 40.629 0.017 A 105 PHE CDx C 13 133.332 0.094 A 105 PHE CEx C 13 130.498 0.044 A 105 PHE CZ C 13 128.289 0.097 A 105 PHE N N 15 122.568 0.016 A 106 LYS H H 1 9.357 0.004 A 106 LYS HA H 1 4.443 0.004 A 106 LYS HBy H 1 1.793 0.003 A 106 LYS HBx H 1 1.664 0.003 A 106 LYS HDx H 1 1.575 0.001 A 106 LYS HDy H 1 1.575 0.001 A 106 LYS HEx H 1 2.841 0.002 A 106 LYS HEy H 1 2.841 0.002 A 106 LYS HGx H 1 1.236 0.001 A 106 LYS HGy H 1 1.236 0.001 A 106 LYS C C 13 180.521 0.000 A 106 LYS CA C 13 57.151 0.010 A 106 LYS CB C 13 34.883 0.052 A 106 LYS CD C 13 29.376 0.080 A 106 LYS CE C 13 41.960 0.021 A 106 LYS CG C 13 24.495 0.027 A 106 LYS N N 15 128.841 0.023 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 14 LYS HBx A 14 LYS HEy 1.0 0.0 4.57 2 2 A 14 LYS HBx A 14 LYS HEx 1.0 0.0 4.57 3 3 A 14 LYS HBx A 14 LYS HDy 1.0 0.0 4.14 4 4 A 93 PRO HBy A 12 TRP HBx 1.0 0.0 5.29 5 5 A 85 PRO HBy A 86 VAL H 1.0 0.0 4.37 6 6 A 85 PRO HBy A 71 TRP HZ3 1.0 0.0 4.40 7 7 A 85 PRO HBy A 102 TRP HZ3 1.0 0.0 4.75 8 8 A 85 PRO HBy A 69 HIS HD2 1.0 0.0 4.93 9 9 A 85 PRO HBy A 69 HIS HBy 1.0 0.0 4.95 10 10 A 12 TRP HE3 A 93 PRO HGx 1.0 0.0 4.68 11 11 A 93 PRO HGx A 20 TRP HD1 1.0 0.0 5.21 12 12 A 93 PRO HGx A 20 TRP HE3 1.0 0.0 4.57 13 13 A 93 PRO HGx A 94 PRO HA 1.0 0.0 4.94 14 14 A 93 PRO HGx A 20 TRP HBx 1.0 0.0 4.11 15 15 A 93 PRO HGx A 65 ILE HB 1.0 0.0 4.87 16 16 A 93 PRO HGx A 92 VAL HGy% 1.0 0.0 5.10 17 17 A 12 TRP HE3 A 93 PRO HGy 1.0 0.0 4.78 18 18 A 71 TRP HD1 A 42 PRO HBx 1.0 0.0 4.70 19 18 A 42 PRO HBy A 71 TRP HD1 1.0 0.0 4.70 20 19 A 71 TRP HE3 A 42 PRO HBx 1.0 0.0 4.84 21 19 A 42 PRO HBy A 71 TRP HE3 1.0 0.0 4.84 22 20 A 83 TYR HD% A 42 PRO HBx 1.0 0.0 4.62 23 20 A 42 PRO HBy A 83 TYR HD% 1.0 0.0 4.62 24 21 A 42 PRO HBy A 83 TYR HBy 1.0 0.0 4.43 25 21 A 83 TYR HBy A 42 PRO HBx 1.0 0.0 4.43 26 22 A 14 LYS H A 14 LYS HGx 1.0 0.0 5.02 27 23 A 72 ILE H A 86 VAL HGy% 1.0 0.0 4.84 28 24 A 86 VAL H A 86 VAL HGy% 1.0 0.0 3.68 29 25 A 105 PHE HE% A 86 VAL HGy% 1.0 0.0 3.89 30 26 A 105 PHE HZ A 86 VAL HGy% 1.0 0.0 3.80 31 27 A 71 TRP HA A 86 VAL HGy% 1.0 0.0 4.40 32 28 A 85 PRO HA A 86 VAL HGy% 1.0 0.0 4.15 33 29 A 64 CYS H A 72 ILE HG2% 1.0 0.0 4.66 34 30 A 72 ILE HG2% A 73 GLY H 1.0 0.0 4.16 35 31 A 72 ILE H A 72 ILE HG2% 1.0 0.0 3.64 36 32 A 86 VAL H A 72 ILE HG2% 1.0 0.0 4.96 37 33 A 72 ILE HG2% A 105 PHE HD% 1.0 0.0 4.71 38 34 A 72 ILE HG2% A 60 TYR HD% 1.0 0.0 4.32 39 35 A 105 PHE HE% A 72 ILE HG2% 1.0 0.0 3.42 40 36 A 72 ILE HG2% A 63 VAL HA 1.0 0.0 3.80 41 37 A 72 ILE HG2% A 72 ILE HA 1.0 0.0 3.08 42 38 A 72 ILE HG2% A 60 TYR HBy 1.0 0.0 4.38 43 39 A 72 ILE HG2% A 28 PHE HBy 1.0 0.0 4.39 44 40 A 72 ILE HG2% A 28 PHE HBx 1.0 0.0 4.48 45 41 A 72 ILE HG2% A 60 TYR HBx 1.0 0.0 4.29 46 42 A 72 ILE HG2% A 86 VAL HB 1.0 0.0 5.50 47 43 A 72 ILE HG2% A 72 ILE HG1x 1.0 0.0 3.61 48 44 A 72 ILE HG2% A 72 ILE HG1y 1.0 0.0 3.35 49 45 A 72 ILE HG2% A 63 VAL HGy% 1.0 0.0 3.59 50 46 A 72 ILE HG2% A 86 VAL HGy% 1.0 0.0 3.04 51 47 A 65 ILE HD1% A 66 GLN H 1.0 0.0 5.50 52 48 A 65 ILE HD1% A 97 ILE H 1.0 0.0 5.50 53 49 A 65 ILE HD1% A 96 GLN H 1.0 0.0 5.23 54 50 A 65 ILE HD1% A 20 TRP H 1.0 0.0 5.09 55 51 A 12 TRP HE3 A 65 ILE HD1% 1.0 0.0 4.29 56 52 A 65 ILE HD1% A 12 TRP HZ3 1.0 0.0 4.11 57 53 A 65 ILE HD1% A 12 TRP HH2 1.0 0.0 3.84 58 54 A 65 ILE HD1% A 21 TYR HA 1.0 0.0 5.50 59 55 A 65 ILE HD1% A 64 CYS HA 1.0 0.0 5.50 60 56 A 65 ILE HD1% A 65 ILE HA 1.0 0.0 4.01 61 57 A 65 ILE HD1% A 92 VAL HA 1.0 0.0 3.78 62 58 A 20 TRP HBx A 65 ILE HD1% 1.0 0.0 4.18 63 59 A 65 ILE HD1% A 20 TRP HBy 1.0 0.0 4.14 64 60 A 65 ILE HD1% A 98 PRO HBx 1.0 0.0 5.26 65 61 A 65 ILE HB A 65 ILE HD1% 1.0 0.0 3.26 66 62 A 65 ILE HD1% A 70 ILE HG1y 1.0 0.0 4.10 67 63 A 65 ILE HD1% A 93 PRO HDx 1.0 0.0 3.76 68 64 A 65 ILE HD1% A 96 GLN HBy 1.0 0.0 3.90 69 65 A 93 PRO HGx A 65 ILE HD1% 1.0 0.0 4.46 70 66 A 28 PHE H A 72 ILE HD1% 1.0 0.0 4.72 71 67 A 73 GLY H A 72 ILE HD1% 1.0 0.0 5.16 72 68 A 105 PHE HD% A 72 ILE HD1% 1.0 0.0 5.50 73 69 A 60 TYR HD% A 72 ILE HD1% 1.0 0.0 3.94 74 70 A 72 ILE HD1% A 60 TYR HE% 1.0 0.0 3.89 75 71 A 105 PHE HZ A 72 ILE HD1% 1.0 0.0 5.50 76 72 A 72 ILE HD1% A 74 TYR HD% 1.0 0.0 3.68 77 73 A 60 TYR HBy A 72 ILE HD1% 1.0 0.0 3.96 78 74 A 72 ILE HD1% A 84 CYS HBx 1.0 0.0 3.69 79 75 A 28 PHE HBy A 72 ILE HD1% 1.0 0.0 3.40 80 76 A 28 PHE HBx A 72 ILE HD1% 1.0 0.0 3.40 81 77 A 60 TYR HBx A 72 ILE HD1% 1.0 0.0 3.41 82 78 A 72 ILE HD1% A 72 ILE HB 1.0 0.0 3.29 83 79 A 72 ILE HD1% A 58 ILE HG1x 1.0 0.0 4.45 84 80 A 72 ILE HG2% A 72 ILE HD1% 1.0 0.0 2.77 85 81 A 70 ILE HD1% A 88 THR H 1.0 0.0 5.01 86 82 A 12 TRP HH2 A 70 ILE HD1% 1.0 0.0 4.69 87 83 A 70 ILE HD1% A 70 ILE HA 1.0 0.0 4.01 88 84 A 70 ILE HD1% A 98 PRO HA 1.0 0.0 3.51 89 85 A 70 ILE HD1% A 98 PRO HDx 1.0 0.0 4.79 90 86 A 70 ILE HD1% A 87 ARG HDx 1.0 0.0 3.91 91 86 A 70 ILE HD1% A 87 ARG HDy 1.0 0.0 3.91 92 87 A 70 ILE HD1% A 89 CYS HBy 1.0 0.0 3.74 93 88 A 70 ILE HD1% A 98 PRO HBy 1.0 0.0 3.22 94 89 A 98 PRO HBx A 70 ILE HD1% 1.0 0.0 3.56 95 90 A 70 ILE HD1% A 98 PRO HGx 1.0 0.0 3.77 96 91 A 70 ILE HD1% A 87 ARG HGx 1.0 0.0 3.37 97 92 A 70 ILE HD1% A 70 ILE HB 1.0 0.0 3.19 98 93 A 70 ILE HD1% A 70 ILE HG2% 1.0 0.0 2.68 99 94 A 65 ILE HD1% A 70 ILE HD1% 1.0 0.0 3.53 100 95 A 97 ILE H A 97 ILE HD1% 1.0 0.0 4.07 101 96 A 97 ILE HD1% A 90 GLN H 1.0 0.0 4.85 102 97 A 97 ILE HD1% A 90 GLN HE2y 1.0 0.0 4.99 103 98 A 97 ILE HD1% A 90 GLN HE2x 1.0 0.0 4.99 104 99 A 97 ILE HD1% A 95 ASN HA 1.0 0.0 5.50 105 100 A 97 ILE HD1% A 97 ILE HA 1.0 0.0 4.10 106 101 A 97 ILE HD1% A 90 GLN HBy 1.0 0.0 3.88 107 102 A 97 ILE HD1% A 97 ILE HB 1.0 0.0 3.08 108 103 A 58 ILE HD1% A 59 VAL H 1.0 0.0 3.65 109 104 A 74 TYR HD% A 58 ILE HD1% 1.0 0.0 3.87 110 105 A 58 ILE HD1% A 74 TYR HE% 1.0 0.0 3.77 111 106 A 58 ILE HD1% A 60 TYR HA 1.0 0.0 5.50 112 107 A 58 ILE HD1% A 58 ILE HA 1.0 0.0 3.05 113 108 A 58 ILE HD1% A 74 TYR HBy 1.0 0.0 5.01 114 109 A 84 CYS HBx A 58 ILE HD1% 1.0 0.0 5.50 115 110 A 58 ILE HD1% A 84 CYS HBy 1.0 0.0 4.48 116 111 A 58 ILE HD1% A 58 ILE HB 1.0 0.0 3.51 117 112 A 58 ILE HD1% A 37 THR HG2% 1.0 0.0 4.65 118 113 A 72 ILE HD1% A 58 ILE HD1% 1.0 0.0 3.57 119 114 A 58 ILE HD1% A 58 ILE HG2% 1.0 0.0 2.76 120 115 A 39 ILE HD1% A 40 GLY H 1.0 0.0 5.22 121 116 A 39 ILE HD1% A 83 TYR H 1.0 0.0 5.50 122 117 A 39 ILE HD1% A 49 GLY H 1.0 0.0 4.12 123 118 A 39 ILE HD1% A 80 ASN HD2y 1.0 0.0 5.50 124 119 A 39 ILE HD1% A 80 ASN HD2x 1.0 0.0 5.50 125 120 A 39 ILE HD1% A 39 ILE HA 1.0 0.0 3.96 126 121 A 39 ILE HD1% A 49 GLY HAy 1.0 0.0 3.50 127 122 A 39 ILE HD1% A 49 GLY HAx 1.0 0.0 3.50 128 123 A 39 ILE HD1% A 80 ASN HBx 1.0 0.0 3.92 129 124 A 39 ILE HD1% A 47 PRO HGx 1.0 0.0 4.86 130 124 A 39 ILE HD1% A 47 PRO HGy 1.0 0.0 4.86 131 125 A 39 ILE HD1% A 39 ILE HB 1.0 0.0 3.20 132 126 A 31 GLY H A 35 ILE HD1% 1.0 0.0 4.30 133 127 A 35 ILE HD1% A 35 ILE H 1.0 0.0 4.57 134 128 A 35 ILE HD1% A 102 TRP HE3 1.0 0.0 3.24 135 129 A 35 ILE HD1% A 33 GLN HE2y 1.0 0.0 4.92 136 130 A 35 ILE HD1% A 28 PHE HZ 1.0 0.0 3.64 137 131 A 35 ILE HD1% A 30 ASN HD2y 1.0 0.0 3.81 138 132 A 102 TRP HZ3 A 35 ILE HD1% 1.0 0.0 4.16 139 133 A 35 ILE HD1% A 30 ASN HD2x 1.0 0.0 4.89 140 134 A 35 ILE HD1% A 35 ILE HA 1.0 0.0 3.72 141 135 A 35 ILE HD1% A 30 ASN HA 1.0 0.0 4.35 142 136 A 35 ILE HD1% A 102 TRP HBx 1.0 0.0 3.74 143 137 A 35 ILE HD1% A 102 TRP HBy 1.0 0.0 3.73 144 138 A 35 ILE HD1% A 30 ASN HBy 1.0 0.0 4.91 145 139 A 35 ILE HD1% A 85 PRO HGx 1.0 0.0 4.04 146 140 A 35 ILE HD1% A 35 ILE HB 1.0 0.0 3.08 147 141 A 86 VAL H A 70 ILE HG2% 1.0 0.0 5.11 148 142 A 71 TRP HD1 A 70 ILE HG2% 1.0 0.0 4.45 149 143 A 12 TRP HH2 A 70 ILE HG2% 1.0 0.0 3.94 150 144 A 63 VAL HA A 70 ILE HG2% 1.0 0.0 4.83 151 145 A 71 TRP HA A 70 ILE HG2% 1.0 0.0 4.26 152 146 A 70 ILE HG2% A 63 VAL HB 1.0 0.0 4.16 153 147 A 70 ILE HG1y A 70 ILE HG2% 1.0 0.0 3.47 154 148 A 72 ILE HG2% A 70 ILE HG2% 1.0 0.0 3.86 155 149 A 97 ILE H A 97 ILE HG2% 1.0 0.0 4.09 156 150 A 97 ILE HG2% A 99 GLY H 1.0 0.0 5.50 157 151 A 97 ILE HA A 97 ILE HG2% 1.0 0.0 2.95 158 152 A 98 PRO HDx A 97 ILE HG2% 1.0 0.0 4.51 159 153 A 97 ILE HG2% A 90 GLN HGx 1.0 0.0 5.50 160 154 A 97 ILE HG2% A 90 GLN HBx 1.0 0.0 3.99 161 155 A 97 ILE HG2% A 97 ILE HG1x 1.0 0.0 3.21 162 156 A 40 GLY H A 39 ILE HG2% 1.0 0.0 3.25 163 157 A 39 ILE HG2% A 39 ILE H 1.0 0.0 4.13 164 158 A 20 TRP H A 65 ILE HG2% 1.0 0.0 4.46 165 159 A 65 ILE HG2% A 92 VAL H 1.0 0.0 4.98 166 160 A 20 TRP HD1 A 65 ILE HG2% 1.0 0.0 4.01 167 161 A 71 TRP HD1 A 65 ILE HG2% 1.0 0.0 4.92 168 162 A 65 ILE HA A 65 ILE HG2% 1.0 0.0 3.16 169 163 A 39 ILE HA A 39 ILE HG2% 1.0 0.0 3.07 170 164 A 39 ILE HG2% A 40 GLY HAx 1.0 0.0 3.54 171 165 A 92 VAL HA A 65 ILE HG2% 1.0 0.0 3.56 172 166 A 39 ILE HG2% A 40 GLY HAy 1.0 0.0 4.20 173 167 A 20 TRP HBy A 65 ILE HG2% 1.0 0.0 4.20 174 168 A 80 ASN HBx A 39 ILE HG2% 1.0 0.0 3.45 175 169 A 65 ILE HG2% A 93 PRO HDy 1.0 0.0 3.71 176 170 A 39 ILE HG2% A 39 ILE HG1y 1.0 0.0 3.07 177 171 A 93 PRO HDx A 65 ILE HG2% 1.0 0.0 3.82 178 172 A 65 ILE HG2% A 65 ILE HG1y 1.0 0.0 2.71 179 173 A 93 PRO HGx A 65 ILE HG2% 1.0 0.0 5.05 180 174 A 65 ILE HD1% A 65 ILE HG2% 1.0 0.0 2.80 181 175 A 92 VAL HGy% A 95 ASN H 1.0 0.0 5.04 182 176 A 92 VAL HGy% A 92 VAL H 1.0 0.0 2.88 183 177 A 92 VAL HGy% A 20 TRP HZ2 1.0 0.0 3.66 184 178 A 92 VAL HGy% A 20 TRP HH2 1.0 0.0 5.50 185 179 A 92 VAL HGy% A 94 PRO HDx 1.0 0.0 4.99 186 179 A 92 VAL HGy% A 94 PRO HDy 1.0 0.0 4.99 187 180 A 92 VAL HGy% A 93 PRO HDy 1.0 0.0 4.61 188 181 A 92 VAL HGy% A 93 PRO HDx 1.0 0.0 3.72 189 182 A 72 ILE H A 86 VAL HGx% 1.0 0.0 4.84 190 183 A 102 TRP H A 86 VAL HGx% 1.0 0.0 4.61 191 184 A 86 VAL H A 86 VAL HGx% 1.0 0.0 3.68 192 185 A 105 PHE HE% A 86 VAL HGx% 1.0 0.0 3.89 193 186 A 105 PHE HZ A 86 VAL HGx% 1.0 0.0 3.80 194 187 A 86 VAL HA A 86 VAL HGx% 1.0 0.0 3.47 195 188 A 101 ALA HB% A 86 VAL HGx% 1.0 0.0 5.07 196 189 A 72 ILE HG1y A 86 VAL HGx% 1.0 0.0 4.15 197 190 A 72 ILE HG2% A 86 VAL HGx% 1.0 0.0 3.04 198 191 A 58 ILE HG2% A 58 ILE H 1.0 0.0 3.79 199 192 A 60 TYR HD% A 58 ILE HG2% 1.0 0.0 4.33 200 193 A 60 TYR HE% A 58 ILE HG2% 1.0 0.0 4.60 201 194 A 74 TYR HD% A 58 ILE HG2% 1.0 0.0 3.57 202 195 A 74 TYR HE% A 58 ILE HG2% 1.0 0.0 3.93 203 196 A 58 ILE HG2% A 27 THR HA 1.0 0.0 4.22 204 197 A 58 ILE HG2% A 59 VAL HA 1.0 0.0 4.79 205 198 A 60 TYR HBy A 58 ILE HG2% 1.0 0.0 4.47 206 199 A 58 ILE HG2% A 74 TYR HBx 1.0 0.0 4.18 207 200 A 74 TYR HBy A 58 ILE HG2% 1.0 0.0 4.28 208 201 A 28 PHE HBy A 58 ILE HG2% 1.0 0.0 4.45 209 202 A 28 PHE HBx A 58 ILE HG2% 1.0 0.0 3.98 210 203 A 60 TYR HBx A 58 ILE HG2% 1.0 0.0 3.60 211 204 A 72 ILE HB A 58 ILE HG2% 1.0 0.0 4.77 212 205 A 58 ILE HG2% A 58 ILE HG1y 1.0 0.0 3.28 213 206 A 58 ILE HG1x A 58 ILE HG2% 1.0 0.0 3.42 214 207 A 72 ILE HG2% A 58 ILE HG2% 1.0 0.0 4.56 215 208 A 58 ILE H A 29 VAL HGy% 1.0 0.0 5.50 216 209 A 104 VAL H A 29 VAL HGy% 1.0 0.0 4.38 217 210 A 28 PHE HA A 29 VAL HGy% 1.0 0.0 5.50 218 211 A 29 VAL HA A 29 VAL HGy% 1.0 0.0 2.95 219 212 A 106 LYS HEy A 29 VAL HGy% 1.0 0.0 4.88 220 212 A 29 VAL HGy% A 106 LYS HEx 1.0 0.0 4.88 221 213 A 30 ASN H A 29 VAL HGx% 1.0 0.0 4.28 222 214 A 29 VAL H A 29 VAL HGx% 1.0 0.0 3.86 223 215 A 104 VAL H A 29 VAL HGx% 1.0 0.0 4.38 224 216 A 28 PHE HA A 29 VAL HGx% 1.0 0.0 5.50 225 217 A 57 THR HA A 29 VAL HGx% 1.0 0.0 4.05 226 218 A 29 VAL HA A 29 VAL HGx% 1.0 0.0 2.95 227 219 A 106 LYS HEy A 29 VAL HGx% 1.0 0.0 4.88 228 219 A 29 VAL HGx% A 106 LYS HEx 1.0 0.0 4.88 229 220 A 104 VAL HB A 29 VAL HGx% 1.0 0.0 4.86 230 221 A 82 VAL H A 82 VAL HGy% 1.0 0.0 4.05 231 222 A 74 TYR HD% A 82 VAL HGy% 1.0 0.0 4.29 232 223 A 74 TYR HE% A 82 VAL HGy% 1.0 0.0 3.74 233 224 A 38 ARG HA A 82 VAL HGy% 1.0 0.0 5.50 234 225 A 83 TYR HA A 82 VAL HGy% 1.0 0.0 5.50 235 226 A 82 VAL HA A 82 VAL HGy% 1.0 0.0 3.27 236 227 A 49 GLY HAy A 82 VAL HGy% 1.0 0.0 6.23 237 228 A 49 GLY HAx A 82 VAL HGy% 1.0 0.0 6.23 238 229 A 12 TRP HZ3 A 22 LYS HGy 1.0 0.0 5.00 239 230 A 22 LYS HGy A 23 PRO HDy 1.0 0.0 4.77 240 231 A 22 LYS HGy A 24 GLU HBx 1.0 0.0 4.50 241 231 A 22 LYS HGy A 24 GLU HBy 1.0 0.0 4.50 242 232 A 63 VAL HB A 22 LYS HGy 1.0 0.0 4.89 243 233 A 54 ALA HB% A 55 GLY H 1.0 0.0 3.53 244 234 A 54 ALA HB% A 56 ALA H 1.0 0.0 5.01 245 235 A 30 ASN HD2y A 54 ALA HB% 1.0 0.0 4.26 246 236 A 30 ASN HD2x A 54 ALA HB% 1.0 0.0 4.29 247 237 A 54 ALA HB% A 33 GLN HA 1.0 0.0 3.66 248 238 A 54 ALA HB% A 32 ASN HBx 1.0 0.0 4.37 249 238 A 54 ALA HB% A 32 ASN HBy 1.0 0.0 4.37 250 239 A 54 ALA HB% A 33 GLN HGx 1.0 0.0 5.49 251 239 A 54 ALA HB% A 33 GLN HGy 1.0 0.0 5.49 252 240 A 54 ALA HB% A 34 PRO HBx 1.0 0.0 5.50 253 241 A 54 ALA HB% A 33 GLN HBx 1.0 0.0 5.00 254 242 A 54 ALA HB% A 53 PRO HBy 1.0 0.0 5.41 255 243 A 102 TRP HE3 A 35 ILE HG2% 1.0 0.0 4.01 256 244 A 102 TRP HZ3 A 35 ILE HG2% 1.0 0.0 3.66 257 245 A 35 ILE HG2% A 84 CYS HA 1.0 0.0 4.43 258 246 A 35 ILE HG2% A 37 THR HA 1.0 0.0 4.79 259 247 A 86 VAL HA A 35 ILE HG2% 1.0 0.0 4.58 260 248 A 35 ILE HG2% A 85 PRO HDy 1.0 0.0 4.16 261 249 A 85 PRO HGx A 35 ILE HG2% 1.0 0.0 3.15 262 250 A 35 ILE HG2% A 35 ILE HG1x 1.0 0.0 3.45 263 251 A 35 ILE HG2% A 85 PRO HBx 1.0 0.0 3.90 264 252 A 35 ILE HG2% A 35 ILE HG1y 1.0 0.0 3.13 265 253 A 72 ILE HD1% A 35 ILE HG2% 1.0 0.0 5.50 266 254 A 35 ILE HG2% A 86 VAL HGx% 1.0 0.0 5.50 267 255 A 35 ILE HG2% A 86 VAL HGy% 1.0 0.0 5.50 268 256 A 85 PRO HBy A 35 ILE HG2% 1.0 0.0 5.00 269 257 A 64 CYS H A 63 VAL HGx% 1.0 0.0 4.26 270 258 A 63 VAL H A 63 VAL HGx% 1.0 0.0 4.01 271 259 A 12 TRP HH2 A 63 VAL HGx% 1.0 0.0 3.93 272 260 A 63 VAL HA A 63 VAL HGx% 1.0 0.0 3.49 273 261 A 72 ILE HA A 63 VAL HGx% 1.0 0.0 4.95 274 262 A 63 VAL HGx% A 22 LYS HEx 1.0 0.0 4.15 275 262 A 22 LYS HEy A 63 VAL HGx% 1.0 0.0 4.15 276 263 A 72 ILE HG2% A 63 VAL HGx% 1.0 0.0 3.59 277 264 A 44 LEU H A 44 LEU HDy% 1.0 0.0 4.13 278 265 A 71 TRP HZ2 A 44 LEU HDy% 1.0 0.0 4.50 279 266 A 43 PHE HA A 44 LEU HDy% 1.0 0.0 5.50 280 267 A 44 LEU HA A 44 LEU HDy% 1.0 0.0 3.81 281 268 A 71 TRP H A 63 VAL HGy% 1.0 0.0 5.50 282 269 A 64 CYS H A 63 VAL HGy% 1.0 0.0 4.26 283 270 A 63 VAL H A 63 VAL HGy% 1.0 0.0 4.01 284 271 A 12 TRP HZ2 A 63 VAL HGy% 1.0 0.0 4.81 285 272 A 12 TRP HH2 A 63 VAL HGy% 1.0 0.0 3.93 286 273 A 64 CYS HA A 63 VAL HGy% 1.0 0.0 5.50 287 274 A 63 VAL HA A 63 VAL HGy% 1.0 0.0 3.49 288 275 A 22 LYS HEx A 63 VAL HGy% 1.0 0.0 4.15 289 275 A 22 LYS HEy A 63 VAL HGy% 1.0 0.0 4.15 290 276 A 51 ASN HD2y A 48 VAL HGx% 1.0 0.0 4.63 291 276 A 48 VAL HGy% A 51 ASN HD2y 1.0 0.0 4.63 292 277 A 48 VAL HGy% A 50 GLY HAx 1.0 0.0 4.37 293 277 A 48 VAL HGx% A 50 GLY HAx 1.0 0.0 4.37 294 278 A 48 VAL HGy% A 49 GLY HAx 1.0 0.0 4.83 295 278 A 48 VAL HGx% A 49 GLY HAx 1.0 0.0 4.83 296 279 A 58 ILE H A 57 THR HG2% 1.0 0.0 3.98 297 280 A 30 ASN H A 57 THR HG2% 1.0 0.0 4.94 298 281 A 57 THR HG2% A 57 THR H 1.0 0.0 3.65 299 282 A 29 VAL HA A 57 THR HG2% 1.0 0.0 3.70 300 283 A 57 THR HG2% A 106 LYS HDx 1.0 0.0 5.50 301 283 A 57 THR HG2% A 106 LYS HDy 1.0 0.0 5.50 302 284 A 57 THR HG2% A 29 VAL HGx% 1.0 0.0 3.21 303 285 A 57 THR HG2% A 29 VAL HGy% 1.0 0.0 3.21 304 286 A 36 VAL H A 36 VAL HGy% 1.0 0.0 3.86 305 287 A 37 THR H A 36 VAL HGy% 1.0 0.0 4.16 306 288 A 51 ASN HA A 36 VAL HGy% 1.0 0.0 4.09 307 289 A 57 THR HG2% A 56 ALA HA 1.0 0.0 4.94 308 290 A 36 VAL HA A 36 VAL HGy% 1.0 0.0 2.92 309 291 A 8 VAL HGx% A 94 PRO HDx 1.0 0.0 5.08 310 291 A 8 VAL HGy% A 94 PRO HDx 1.0 0.0 5.08 311 291 A 94 PRO HDy A 8 VAL HGx% 1.0 0.0 5.08 312 291 A 94 PRO HDy A 8 VAL HGy% 1.0 0.0 5.08 313 292 A 106 LYS H A 104 VAL HGx% 1.0 0.0 5.50 314 293 A 60 TYR H A 59 VAL HGy% 1.0 0.0 4.48 315 294 A 29 VAL H A 104 VAL HGx% 1.0 0.0 4.59 316 295 A 105 PHE H A 104 VAL HGx% 1.0 0.0 4.12 317 296 A 104 VAL H A 104 VAL HGx% 1.0 0.0 3.93 318 297 A 59 VAL H A 59 VAL HGy% 1.0 0.0 3.94 319 298 A 105 PHE HA A 104 VAL HGx% 1.0 0.0 5.50 320 299 A 59 VAL HA A 59 VAL HGy% 1.0 0.0 3.22 321 300 A 103 GLY HAy A 104 VAL HGx% 1.0 0.0 5.50 322 301 A 106 LYS HEy A 104 VAL HGx% 1.0 0.0 4.49 323 301 A 104 VAL HGx% A 106 LYS HEx 1.0 0.0 4.49 324 302 A 29 VAL HB A 104 VAL HGx% 1.0 0.0 3.93 325 303 A 59 VAL H A 59 VAL HGx% 1.0 0.0 3.94 326 304 A 60 TYR HA A 59 VAL HGx% 1.0 0.0 5.50 327 305 A 59 VAL HA A 59 VAL HGx% 1.0 0.0 3.22 328 306 A 102 TRP HA A 100 VAL HGx% 1.0 0.0 4.58 329 306 A 100 VAL HGy% A 102 TRP HA 1.0 0.0 4.58 330 307 A 101 ALA HA A 100 VAL HGx% 1.0 0.0 4.62 331 307 A 100 VAL HGy% A 101 ALA HA 1.0 0.0 4.62 332 308 A 8 VAL H A 8 VAL HGx% 1.0 0.0 4.43 333 308 A 8 VAL HGy% A 8 VAL H 1.0 0.0 4.43 334 309 A 20 TRP HH2 A 8 VAL HGx% 1.0 0.0 4.75 335 309 A 20 TRP HH2 A 8 VAL HGy% 1.0 0.0 4.75 336 310 A 7 PRO HA A 8 VAL HGx% 1.0 0.0 4.24 337 310 A 8 VAL HGy% A 7 PRO HA 1.0 0.0 4.24 338 311 A 92 VAL H A 92 VAL HGx% 1.0 0.0 3.42 339 312 A 20 TRP HD1 A 92 VAL HGx% 1.0 0.0 3.24 340 313 A 65 ILE HA A 92 VAL HGx% 1.0 0.0 5.50 341 314 A 93 PRO HDy A 92 VAL HGx% 1.0 0.0 3.60 342 315 A 93 PRO HGx A 92 VAL HGx% 1.0 0.0 4.71 343 316 A 65 ILE HD1% A 92 VAL HGx% 1.0 0.0 4.25 344 317 A 106 LYS H A 104 VAL HGy% 1.0 0.0 5.50 345 318 A 29 VAL H A 104 VAL HGy% 1.0 0.0 4.59 346 319 A 105 PHE H A 104 VAL HGy% 1.0 0.0 4.12 347 320 A 104 VAL H A 104 VAL HGy% 1.0 0.0 3.93 348 321 A 105 PHE HA A 104 VAL HGy% 1.0 0.0 5.50 349 322 A 104 VAL HA A 104 VAL HGy% 1.0 0.0 2.95 350 323 A 106 LYS HEy A 104 VAL HGy% 1.0 0.0 4.49 351 323 A 104 VAL HGy% A 106 LYS HEx 1.0 0.0 4.49 352 324 A 29 VAL HB A 104 VAL HGy% 1.0 0.0 3.93 353 325 A 82 VAL H A 82 VAL HGx% 1.0 0.0 4.05 354 326 A 74 TYR H A 82 VAL HGx% 1.0 0.0 4.85 355 327 A 74 TYR HD% A 82 VAL HGx% 1.0 0.0 4.29 356 328 A 83 TYR HA A 82 VAL HGx% 1.0 0.0 5.50 357 329 A 82 VAL HA A 82 VAL HGx% 1.0 0.0 3.27 358 330 A 82 VAL HGx% A 49 GLY HAx 1.0 0.0 6.23 359 331 A 76 ALA HB% A 82 VAL HGx% 1.0 0.0 3.81 360 332 A 2 THR HA A 2 THR HG2% 1.0 0.0 3.78 361 333 A 9 THR H A 9 THR HG2% 1.0 0.0 4.73 362 334 A 20 TRP HZ2 A 9 THR HG2% 1.0 0.0 4.76 363 335 A 20 TRP HH2 A 9 THR HG2% 1.0 0.0 3.91 364 336 A 9 THR HG2% A 20 TRP HZ3 1.0 0.0 4.12 365 337 A 5 THR HA A 5 THR HG2% 1.0 0.0 3.11 366 338 A 9 THR HG2% A 94 PRO HDx 1.0 0.0 3.89 367 338 A 94 PRO HDy A 9 THR HG2% 1.0 0.0 3.89 368 339 A 9 THR HG2% A 94 PRO HGx 1.0 0.0 4.46 369 340 A 88 THR HG2% A 89 CYS H 1.0 0.0 3.76 370 341 A 88 THR HG2% A 69 HIS HE1 1.0 0.0 4.55 371 342 A 88 THR HG2% A 102 TRP HZ2 1.0 0.0 3.27 372 343 A 88 THR HG2% A 102 TRP HH2 1.0 0.0 3.86 373 344 A 88 THR HG2% A 87 ARG H 1.0 0.0 5.38 374 345 A 102 TRP HZ3 A 88 THR HG2% 1.0 0.0 5.50 375 346 A 88 THR HG2% A 69 HIS HA 1.0 0.0 4.56 376 347 A 37 THR HG2% A 38 ARG H 1.0 0.0 3.98 377 348 A 37 THR HG2% A 51 ASN H 1.0 0.0 5.50 378 349 A 37 THR HG2% A 36 VAL H 1.0 0.0 5.15 379 350 A 37 THR HG2% A 35 ILE H 1.0 0.0 4.96 380 351 A 70 ILE H A 87 ARG HGy 1.0 0.0 5.16 381 352 A 37 THR HG2% A 37 THR H 1.0 0.0 3.12 382 353 A 37 THR HG2% A 50 GLY H 1.0 0.0 4.86 383 354 A 74 TYR HE% A 37 THR HG2% 1.0 0.0 4.29 384 355 A 37 THR HG2% A 51 ASN HA 1.0 0.0 3.30 385 356 A 37 THR HG2% A 37 THR HA 1.0 0.0 3.06 386 357 A 37 THR HG2% A 36 VAL HA 1.0 0.0 3.87 387 358 A 37 THR HG2% A 85 PRO HDy 1.0 0.0 5.50 388 359 A 84 CYS HBx A 37 THR HG2% 1.0 0.0 4.06 389 360 A 84 CYS HBy A 37 THR HG2% 1.0 0.0 3.27 390 361 A 37 THR HG2% A 52 LEU HBx 1.0 0.0 3.47 391 362 A 70 ILE HB A 87 ARG HGy 1.0 0.0 2.88 392 363 A 87 ARG HGy A 70 ILE HG1x 1.0 0.0 4.21 393 364 A 70 ILE HD1% A 87 ARG HGy 1.0 0.0 3.04 394 365 A 88 THR H A 87 ARG HGx 1.0 0.0 4.73 395 366 A 98 PRO HA A 87 ARG HGx 1.0 0.0 4.83 396 367 A 87 ARG HGx A 101 ALA HA 1.0 0.0 5.45 397 368 A 87 ARG HGx A 101 ALA HB% 1.0 0.0 5.09 398 369 A 87 ARG HGx A 70 ILE HB 1.0 0.0 3.74 399 370 A 58 ILE H A 56 ALA HB% 1.0 0.0 4.80 400 371 A 30 ASN H A 56 ALA HB% 1.0 0.0 4.12 401 372 A 56 ALA HB% A 54 ALA H 1.0 0.0 5.10 402 373 A 55 GLY H A 56 ALA HB% 1.0 0.0 4.51 403 374 A 30 ASN HD2x A 56 ALA HB% 1.0 0.0 4.50 404 375 A 57 THR HA A 56 ALA HB% 1.0 0.0 4.34 405 376 A 56 ALA HB% A 52 LEU HA 1.0 0.0 4.44 406 377 A 56 ALA HB% A 55 GLY HAx 1.0 0.0 4.47 407 377 A 56 ALA HB% A 55 GLY HAy 1.0 0.0 4.47 408 378 A 56 ALA HB% A 53 PRO HDy 1.0 0.0 2.98 409 379 A 30 ASN HBy A 56 ALA HB% 1.0 0.0 3.83 410 380 A 56 ALA HB% A 53 PRO HBx 1.0 0.0 4.54 411 381 A 56 ALA HB% A 53 PRO HGy 1.0 0.0 3.16 412 382 A 53 PRO HBy A 56 ALA HB% 1.0 0.0 3.61 413 383 A 56 ALA HB% A 52 LEU HG 1.0 0.0 3.50 414 384 A 56 ALA HB% A 52 LEU HDx% 1.0 0.0 3.08 415 385 A 56 ALA HB% A 52 LEU HDy% 1.0 0.0 3.08 416 386 A 58 ILE HD1% A 56 ALA HB% 1.0 0.0 4.21 417 387 A 58 ILE HG2% A 56 ALA HB% 1.0 0.0 5.50 418 388 A 76 ALA HB% A 77 TYR H 1.0 0.0 4.69 419 389 A 76 ALA HB% A 77 TYR HD% 1.0 0.0 5.10 420 390 A 74 TYR HD% A 76 ALA HB% 1.0 0.0 4.44 421 391 A 74 TYR HE% A 76 ALA HB% 1.0 0.0 4.35 422 392 A 76 ALA HB% A 75 ASN HA 1.0 0.0 3.98 423 393 A 76 ALA HB% A 77 TYR HA 1.0 0.0 4.42 424 394 A 76 ALA HB% A 77 TYR HBx 1.0 0.0 4.99 425 395 A 76 ALA HB% A 80 ASN HBy 1.0 0.0 3.36 426 396 A 39 ILE HD1% A 76 ALA HB% 1.0 0.0 4.17 427 397 A 76 ALA HB% A 82 VAL HGy% 1.0 0.0 3.81 428 398 A 106 LYS H A 26 ALA HB% 1.0 0.0 4.19 429 399 A 60 TYR H A 26 ALA HB% 1.0 0.0 5.37 430 400 A 26 ALA HB% A 27 THR H 1.0 0.0 2.67 431 401 A 105 PHE HD% A 26 ALA HB% 1.0 0.0 4.34 432 402 A 26 ALA HB% A 26 ALA H 1.0 0.0 3.35 433 403 A 105 PHE HA A 26 ALA HB% 1.0 0.0 4.65 434 404 A 26 ALA HB% A 25 ASN HA 1.0 0.0 4.17 435 405 A 27 THR HA A 26 ALA HB% 1.0 0.0 4.20 436 406 A 26 ALA HB% A 27 THR HB 1.0 0.0 4.43 437 407 A 26 ALA HB% A 105 PHE HBx 1.0 0.0 4.58 438 408 A 26 ALA HB% A 24 GLU HGy 1.0 0.0 3.86 439 409 A 26 ALA HB% A 24 GLU HGx 1.0 0.0 3.86 440 410 A 39 ILE H A 46 ALA HB% 1.0 0.0 3.86 441 411 A 44 LEU H A 46 ALA HB% 1.0 0.0 4.97 442 412 A 46 ALA HB% A 41 SER H 1.0 0.0 3.75 443 413 A 46 ALA HB% A 43 PHE HD% 1.0 0.0 4.33 444 414 A 71 TRP HZ3 A 46 ALA HB% 1.0 0.0 5.50 445 415 A 38 ARG HA A 46 ALA HB% 1.0 0.0 4.50 446 416 A 40 GLY HAx A 46 ALA HB% 1.0 0.0 4.79 447 417 A 46 ALA HB% A 47 PRO HA 1.0 0.0 5.15 448 418 A 44 LEU HA A 46 ALA HB% 1.0 0.0 5.27 449 419 A 46 ALA HB% A 48 VAL HA 1.0 0.0 5.50 450 420 A 46 ALA HB% A 47 PRO HDx 1.0 0.0 2.82 451 420 A 46 ALA HB% A 47 PRO HDy 1.0 0.0 2.82 452 421 A 46 ALA HB% A 38 ARG HDy 1.0 0.0 3.52 453 422 A 46 ALA HB% A 43 PHE HBy 1.0 0.0 3.13 454 423 A 46 ALA HB% A 38 ARG HBx 1.0 0.0 2.96 455 423 A 46 ALA HB% A 38 ARG HBy 1.0 0.0 2.96 456 424 A 46 ALA HB% A 48 VAL HGx% 1.0 0.0 5.12 457 424 A 48 VAL HGy% A 46 ALA HB% 1.0 0.0 5.12 458 425 A 66 GLN H A 67 ALA HB% 1.0 0.0 4.91 459 426 A 44 LEU H A 67 ALA HB% 1.0 0.0 3.92 460 427 A 67 ALA HB% A 69 HIS H 1.0 0.0 4.20 461 428 A 69 HIS HE1 A 67 ALA HB% 1.0 0.0 5.32 462 429 A 71 TRP HD1 A 67 ALA HB% 1.0 0.0 5.34 463 430 A 43 PHE HD% A 67 ALA HB% 1.0 0.0 4.07 464 431 A 71 TRP HZ2 A 67 ALA HB% 1.0 0.0 3.31 465 432 A 67 ALA HB% A 43 PHE H 1.0 0.0 5.50 466 433 A 67 ALA HB% A 66 GLN HBy 1.0 0.0 5.50 467 434 A 67 ALA HB% A 66 GLN HGx 1.0 0.0 3.59 468 435 A 67 ALA HB% A 42 PRO HBx 1.0 0.0 4.87 469 435 A 42 PRO HBy A 67 ALA HB% 1.0 0.0 4.87 470 436 A 101 ALA HB% A 101 ALA H 1.0 0.0 2.82 471 437 A 105 PHE HD% A 101 ALA HB% 1.0 0.0 4.01 472 438 A 101 ALA HB% A 103 GLY H 1.0 0.0 3.03 473 439 A 105 PHE HE% A 101 ALA HB% 1.0 0.0 3.13 474 440 A 105 PHE HZ A 101 ALA HB% 1.0 0.0 4.21 475 441 A 101 ALA HB% A 102 TRP HA 1.0 0.0 4.53 476 442 A 101 ALA HB% A 104 VAL HA 1.0 0.0 4.75 477 443 A 102 TRP HBx A 101 ALA HB% 1.0 0.0 5.50 478 444 A 102 TRP HBy A 101 ALA HB% 1.0 0.0 4.84 479 445 A 101 ALA HB% A 87 ARG HA 1.0 0.0 5.33 480 446 A 101 ALA HB% A 87 ARG HDx 1.0 0.0 4.12 481 446 A 87 ARG HDy A 101 ALA HB% 1.0 0.0 4.12 482 447 A 101 ALA HB% A 87 ARG HBx 1.0 0.0 3.63 483 448 A 101 ALA HB% A 100 VAL HGx% 1.0 0.0 3.70 484 448 A 101 ALA HB% A 100 VAL HGy% 1.0 0.0 3.70 485 449 A 101 ALA HB% A 86 VAL HGy% 1.0 0.0 5.07 486 450 A 41 SER HA A 42 PRO HGy 1.0 0.0 4.60 487 451 A 58 ILE HG1x A 74 TYR HE% 1.0 0.0 4.77 488 452 A 58 ILE HG1x A 52 LEU HBy 1.0 0.0 5.00 489 453 A 58 ILE HG1x A 56 ALA HB% 1.0 0.0 5.37 490 454 A 97 ILE H A 96 GLN HBx 1.0 0.0 4.34 491 455 A 65 ILE HD1% A 96 GLN HBx 1.0 0.0 4.22 492 456 A 9 THR HG2% A 10 GLY H 1.0 0.0 4.47 493 457 A 38 ARG H A 48 VAL HGx% 1.0 0.0 5.50 494 457 A 48 VAL HGy% A 38 ARG H 1.0 0.0 5.50 495 458 A 36 VAL H A 36 VAL HGx% 1.0 0.0 3.86 496 459 A 37 THR HA A 48 VAL HGx% 1.0 0.0 5.29 497 459 A 37 THR HA A 48 VAL HGy% 1.0 0.0 5.29 498 460 A 36 VAL HA A 36 VAL HGx% 1.0 0.0 2.92 499 461 A 57 THR H A 27 THR HG2% 1.0 0.0 5.50 500 462 A 27 THR H A 27 THR HG2% 1.0 0.0 3.76 501 463 A 28 PHE HA A 27 THR HG2% 1.0 0.0 4.18 502 464 A 27 THR HA A 27 THR HG2% 1.0 0.0 3.02 503 465 A 59 VAL HA A 27 THR HG2% 1.0 0.0 4.35 504 466 A 58 ILE HA A 27 THR HG2% 1.0 0.0 5.15 505 467 A 27 THR HG2% A 106 LYS HA 1.0 0.0 5.50 506 468 A 27 THR HG2% A 106 LYS HEx 1.0 0.0 3.72 507 468 A 106 LYS HEy A 27 THR HG2% 1.0 0.0 3.72 508 469 A 29 VAL HB A 27 THR HG2% 1.0 0.0 4.75 509 470 A 27 THR HG2% A 106 LYS HDx 1.0 0.0 3.73 510 470 A 106 LYS HDy A 27 THR HG2% 1.0 0.0 3.73 511 471 A 27 THR HG2% A 106 LYS HGx 1.0 0.0 3.16 512 471 A 27 THR HG2% A 106 LYS HGy 1.0 0.0 3.16 513 472 A 65 ILE HG1y A 71 TRP H 1.0 0.0 5.21 514 473 A 66 GLN H A 65 ILE HG1y 1.0 0.0 4.75 515 474 A 35 ILE HG1y A 36 VAL H 1.0 0.0 4.82 516 475 A 102 TRP HE3 A 35 ILE HG1y 1.0 0.0 4.92 517 476 A 12 TRP HH2 A 65 ILE HG1y 1.0 0.0 4.48 518 477 A 30 ASN HD2y A 35 ILE HG1y 1.0 0.0 4.24 519 478 A 35 ILE HG1y A 34 PRO HA 1.0 0.0 4.75 520 479 A 35 ILE HG1y A 30 ASN HBx 1.0 0.0 5.50 521 480 A 89 CYS HBy A 65 ILE HG1y 1.0 0.0 5.50 522 481 A 35 ILE HG1y A 52 LEU HBx 1.0 0.0 5.12 523 482 A 35 ILE HG1y A 34 PRO HBy 1.0 0.0 5.38 524 483 A 70 ILE HG1y A 65 ILE HG1y 1.0 0.0 3.93 525 484 A 38 ARG H A 39 ILE HG1x 1.0 0.0 5.45 526 485 A 39 ILE HA A 39 ILE HG1x 1.0 0.0 3.76 527 486 A 39 ILE HG1x A 47 PRO HBy 1.0 0.0 5.15 528 487 A 59 VAL H A 58 ILE HG1y 1.0 0.0 4.85 529 488 A 58 ILE HG1y A 57 THR HA 1.0 0.0 5.02 530 489 A 28 PHE HBx A 58 ILE HG1y 1.0 0.0 4.99 531 490 A 30 ASN HD2x A 52 LEU HDx% 1.0 0.0 4.92 532 491 A 52 LEU HA A 52 LEU HDx% 1.0 0.0 4.39 533 492 A 30 ASN HBy A 52 LEU HDx% 1.0 0.0 4.15 534 493 A 52 LEU HBx A 52 LEU HDx% 1.0 0.0 3.40 535 494 A 52 LEU HBy A 52 LEU HDx% 1.0 0.0 3.19 536 495 A 42 PRO HGx A 64 CYS HBy 1.0 0.0 4.45 537 496 A 42 PRO HGx A 66 GLN HBx 1.0 0.0 4.72 538 497 A 90 GLN HBy A 97 ILE HG1y 1.0 0.0 5.50 539 498 A 97 ILE HG2% A 97 ILE HG1y 1.0 0.0 2.94 540 499 A 30 ASN HD2x A 52 LEU HDy% 1.0 0.0 4.92 541 500 A 52 LEU HA A 52 LEU HDy% 1.0 0.0 4.39 542 501 A 53 PRO HDy A 52 LEU HDy% 1.0 0.0 4.31 543 502 A 30 ASN HBy A 52 LEU HDy% 1.0 0.0 4.15 544 503 A 52 LEU HBx A 52 LEU HDy% 1.0 0.0 3.40 545 504 A 52 LEU HBy A 52 LEU HDy% 1.0 0.0 3.19 546 505 A 19 THR HG2% A 21 TYR H 1.0 0.0 4.96 547 506 A 20 TRP H A 19 THR HG2% 1.0 0.0 3.28 548 507 A 19 THR HG2% A 66 GLN HE2y 1.0 0.0 4.54 549 508 A 19 THR HG2% A 66 GLN HE2x 1.0 0.0 4.54 550 509 A 64 CYS HA A 19 THR HG2% 1.0 0.0 3.71 551 510 A 19 THR HG2% A 66 GLN HA 1.0 0.0 4.79 552 511 A 19 THR HG2% A 19 THR HA 1.0 0.0 3.07 553 512 A 19 THR HG2% A 21 TYR HBx 1.0 0.0 3.95 554 513 A 66 GLN HBy A 19 THR HG2% 1.0 0.0 3.36 555 514 A 66 GLN HBx A 19 THR HG2% 1.0 0.0 3.70 556 515 A 65 ILE HB A 19 THR HG2% 1.0 0.0 5.07 557 516 A 42 PRO HGy A 19 THR HG2% 1.0 0.0 3.44 558 517 A 14 LYS H A 14 LYS HGy 1.0 0.0 5.02 559 518 A 39 ILE HG1y A 38 ARG H 1.0 0.0 5.29 560 519 A 39 ILE HG1y A 38 ARG HA 1.0 0.0 4.92 561 520 A 39 ILE HA A 39 ILE HG1y 1.0 0.0 3.95 562 521 A 80 ASN HBx A 39 ILE HG1y 1.0 0.0 4.95 563 522 A 97 ILE HA A 97 ILE HG1x 1.0 0.0 3.79 564 523 A 81 ARG HA A 81 ARG HGx 1.0 0.0 4.00 565 524 A 14 LYS H A 13 LYS HGx 1.0 0.0 4.05 566 524 A 14 LYS H A 13 LYS HGy 1.0 0.0 4.05 567 525 A 21 TYR HE% A 13 LYS HGx 1.0 0.0 5.50 568 525 A 13 LYS HGy A 21 TYR HE% 1.0 0.0 5.50 569 526 A 71 TRP HH2 A 85 PRO HGy 1.0 0.0 5.50 570 527 A 13 LYS HA A 13 LYS HGx 1.0 0.0 3.29 571 527 A 13 LYS HGy A 13 LYS HA 1.0 0.0 3.29 572 528 A 84 CYS HA A 85 PRO HGy 1.0 0.0 4.45 573 529 A 72 ILE HG1y A 86 VAL HGy% 1.0 0.0 4.15 574 530 A 71 TRP H A 70 ILE HG1x 1.0 0.0 5.09 575 531 A 70 ILE HA A 70 ILE HG1x 1.0 0.0 3.76 576 532 A 70 ILE HG2% A 70 ILE HG1x 1.0 0.0 3.30 577 533 A 65 ILE HD1% A 70 ILE HG1x 1.0 0.0 4.61 578 534 A 96 GLN H A 93 PRO HBx 1.0 0.0 4.78 579 535 A 14 LYS HBx A 14 LYS HDx 1.0 0.0 4.14 580 536 A 70 ILE HG1y A 89 CYS HA 1.0 0.0 5.41 581 537 A 70 ILE HG1y A 98 PRO HA 1.0 0.0 5.50 582 538 A 70 ILE HG1y A 65 ILE HG1x 1.0 0.0 3.95 583 539 A 38 ARG HGx A 46 ALA H 1.0 0.0 5.19 584 540 A 71 TRP HZ3 A 38 ARG HGx 1.0 0.0 3.90 585 541 A 43 PHE H A 38 ARG HGx 1.0 0.0 4.52 586 542 A 44 LEU HA A 38 ARG HGx 1.0 0.0 4.72 587 543 A 46 ALA HB% A 38 ARG HGx 1.0 0.0 4.69 588 544 A 40 GLY H A 81 ARG HGy 1.0 0.0 4.88 589 545 A 81 ARG HGy A 81 ARG H 1.0 0.0 5.10 590 546 A 82 VAL H A 81 ARG HGy 1.0 0.0 5.45 591 547 A 40 GLY HAy A 81 ARG HGy 1.0 0.0 5.01 592 548 A 102 TRP HE3 A 85 PRO HGx 1.0 0.0 4.81 593 549 A 85 PRO HGx A 102 TRP HH2 1.0 0.0 5.42 594 550 A 102 TRP HZ3 A 85 PRO HGx 1.0 0.0 3.80 595 551 A 85 PRO HGx A 84 CYS HA 1.0 0.0 4.41 596 552 A 95 ASN H A 94 PRO HGx 1.0 0.0 4.77 597 553 A 94 PRO HGx A 9 THR HA 1.0 0.0 4.77 598 554 A 71 TRP HE3 A 72 ILE HG1x 1.0 0.0 5.50 599 555 A 72 ILE HG1x A 83 TYR HA 1.0 0.0 4.85 600 556 A 60 TYR HBx A 72 ILE HG1x 1.0 0.0 4.61 601 557 A 72 ILE HG1x A 58 ILE HD1% 1.0 0.0 5.50 602 558 A 6 ARG HA A 6 ARG HGx 1.0 0.0 3.96 603 558 A 6 ARG HA A 6 ARG HGy 1.0 0.0 3.96 604 559 A 30 ASN HD2y A 52 LEU HG 1.0 0.0 4.76 605 560 A 52 LEU HG A 53 PRO HA 1.0 0.0 5.50 606 561 A 52 LEU HG A 53 PRO HDx 1.0 0.0 5.50 607 562 A 52 LEU HBx A 52 LEU HG 1.0 0.0 2.88 608 563 A 65 ILE HA A 65 ILE HG1x 1.0 0.0 3.88 609 564 A 65 ILE HG2% A 65 ILE HG1x 1.0 0.0 3.72 610 565 A 70 ILE HG2% A 65 ILE HG1x 1.0 0.0 4.07 611 566 A 30 ASN HD2y A 35 ILE HG1x 1.0 0.0 3.78 612 567 A 35 ILE HG1x A 34 PRO HA 1.0 0.0 4.49 613 568 A 71 TRP HH2 A 44 LEU HG 1.0 0.0 4.69 614 569 A 43 PHE HA A 44 LEU HG 1.0 0.0 4.91 615 570 A 56 ALA HB% A 53 PRO HGx 1.0 0.0 3.71 616 571 A 56 ALA H A 53 PRO HGy 1.0 0.0 5.01 617 572 A 22 LYS HA A 23 PRO HGx 1.0 0.0 4.48 618 572 A 22 LYS HA A 23 PRO HGy 1.0 0.0 4.48 619 573 A 22 LYS HBy A 23 PRO HGx 1.0 0.0 4.57 620 573 A 23 PRO HGy A 22 LYS HBy 1.0 0.0 4.57 621 574 A 40 GLY H A 47 PRO HGx 1.0 0.0 5.50 622 574 A 40 GLY H A 47 PRO HGy 1.0 0.0 5.50 623 575 A 48 VAL H A 47 PRO HGx 1.0 0.0 4.70 624 575 A 47 PRO HGy A 48 VAL H 1.0 0.0 4.70 625 576 A 46 ALA HA A 47 PRO HGx 1.0 0.0 4.19 626 576 A 47 PRO HGy A 46 ALA HA 1.0 0.0 4.19 627 577 A 39 ILE HB A 47 PRO HGx 1.0 0.0 3.55 628 577 A 47 PRO HGy A 39 ILE HB 1.0 0.0 3.55 629 578 A 39 ILE HG1y A 47 PRO HGx 1.0 0.0 5.42 630 578 A 47 PRO HGy A 39 ILE HG1y 1.0 0.0 5.42 631 579 A 39 ILE HG2% A 47 PRO HGx 1.0 0.0 4.30 632 579 A 47 PRO HGy A 39 ILE HG2% 1.0 0.0 4.30 633 580 A 70 ILE H A 89 CYS HBx 1.0 0.0 4.67 634 581 A 70 ILE HG1y A 89 CYS HBx 1.0 0.0 3.75 635 582 A 70 ILE HG1x A 89 CYS HBx 1.0 0.0 4.33 636 583 A 65 ILE HG2% A 89 CYS HBx 1.0 0.0 4.00 637 584 A 89 CYS HBy A 99 GLY H 1.0 0.0 5.32 638 585 A 89 CYS HBy A 70 ILE H 1.0 0.0 4.66 639 586 A 89 CYS HBy A 90 GLN H 1.0 0.0 4.75 640 587 A 70 ILE HG1y A 89 CYS HBy 1.0 0.0 3.68 641 588 A 89 CYS HBy A 70 ILE HG1x 1.0 0.0 4.14 642 589 A 89 CYS HBy A 65 ILE HG2% 1.0 0.0 4.07 643 590 A 43 PHE H A 38 ARG HGy 1.0 0.0 5.48 644 591 A 46 ALA HB% A 38 ARG HGy 1.0 0.0 4.70 645 592 A 38 ARG HGy A 48 VAL HGx% 1.0 0.0 5.41 646 592 A 48 VAL HGy% A 38 ARG HGy 1.0 0.0 5.41 647 593 A 106 LYS HA A 106 LYS HDx 1.0 0.0 4.45 648 593 A 106 LYS HDy A 106 LYS HA 1.0 0.0 4.45 649 594 A 27 THR HB A 106 LYS HDx 1.0 0.0 4.69 650 594 A 106 LYS HDy A 27 THR HB 1.0 0.0 4.69 651 595 A 106 LYS HBx A 106 LYS HDx 1.0 0.0 3.41 652 595 A 106 LYS HDy A 106 LYS HBx 1.0 0.0 3.41 653 596 A 13 LYS HA A 13 LYS HDx 1.0 0.0 4.57 654 596 A 13 LYS HA A 13 LYS HDy 1.0 0.0 4.57 655 597 A 81 ARG HBx A 81 ARG HDx 1.0 0.0 4.20 656 598 A 6 ARG HDy A 6 ARG HBx 1.0 0.0 4.01 657 598 A 6 ARG HBx A 6 ARG HDx 1.0 0.0 4.01 658 599 A 33 GLN HBx A 34 PRO HDy 1.0 0.0 3.52 659 600 A 33 GLN H A 33 GLN HBy 1.0 0.0 3.70 660 601 A 35 ILE HD1% A 33 GLN HBy 1.0 0.0 5.50 661 602 A 54 ALA HB% A 33 GLN HBy 1.0 0.0 4.78 662 603 A 44 LEU H A 44 LEU HDx% 1.0 0.0 4.13 663 604 A 43 PHE HA A 44 LEU HDx% 1.0 0.0 5.50 664 605 A 44 LEU HDx% A 44 LEU HBy 1.0 0.0 3.26 665 606 A 38 ARG H A 82 VAL HB 1.0 0.0 5.50 666 607 A 83 TYR H A 82 VAL HB 1.0 0.0 4.37 667 608 A 82 VAL H A 82 VAL HB 1.0 0.0 3.54 668 609 A 74 TYR HE% A 82 VAL HB 1.0 0.0 4.32 669 610 A 82 VAL HB A 37 THR HB 1.0 0.0 5.40 670 611 A 76 ALA HB% A 82 VAL HB 1.0 0.0 4.42 671 612 A 37 THR HG2% A 82 VAL HB 1.0 0.0 5.50 672 613 A 12 TRP HA A 22 LYS HBx 1.0 0.0 3.90 673 614 A 22 LYS HBx A 22 LYS HEx 1.0 0.0 4.25 674 614 A 22 LYS HEy A 22 LYS HBx 1.0 0.0 4.25 675 615 A 22 LYS HBx A 24 GLU HBx 1.0 0.0 5.50 676 615 A 24 GLU HBy A 22 LYS HBx 1.0 0.0 5.50 677 616 A 63 VAL HB A 22 LYS HBx 1.0 0.0 5.50 678 617 A 22 LYS HBy A 22 LYS HEx 1.0 0.0 4.54 679 617 A 22 LYS HEy A 22 LYS HBy 1.0 0.0 4.54 680 618 A 43 PHE HE% A 66 GLN HGy 1.0 0.0 4.21 681 619 A 66 GLN HGy A 67 ALA HA 1.0 0.0 5.50 682 620 A 19 THR HA A 66 GLN HGy 1.0 0.0 4.87 683 621 A 67 ALA HB% A 66 GLN HGy 1.0 0.0 4.74 684 622 A 42 PRO HGy A 66 GLN HGy 1.0 0.0 4.42 685 623 A 66 GLN HGy A 42 PRO HBx 1.0 0.0 5.50 686 623 A 42 PRO HBy A 66 GLN HGy 1.0 0.0 5.50 687 624 A 19 THR H A 16 GLN HGx 1.0 0.0 5.50 688 624 A 16 GLN HGy A 19 THR H 1.0 0.0 5.50 689 625 A 17 TYR HA A 16 GLN HGx 1.0 0.0 4.85 690 625 A 16 GLN HGy A 17 TYR HA 1.0 0.0 4.85 691 626 A 16 GLN HGy A 16 GLN HBy 1.0 0.0 2.88 692 626 A 16 GLN HBy A 16 GLN HGx 1.0 0.0 2.88 693 627 A 16 GLN HGy A 16 GLN HBx 1.0 0.0 2.88 694 627 A 16 GLN HBx A 16 GLN HGx 1.0 0.0 2.88 695 628 A 93 PRO HDy A 92 VAL HB 1.0 0.0 3.47 696 629 A 93 PRO HDx A 92 VAL HB 1.0 0.0 3.17 697 630 A 93 PRO HGx A 92 VAL HB 1.0 0.0 4.31 698 631 A 65 ILE HD1% A 92 VAL HB 1.0 0.0 5.20 699 632 A 93 PRO HGy A 92 VAL HB 1.0 0.0 5.50 700 633 A 101 ALA HA A 87 ARG HBy 1.0 0.0 3.97 701 634 A 101 ALA HB% A 87 ARG HBy 1.0 0.0 4.77 702 635 A 70 ILE HD1% A 87 ARG HBy 1.0 0.0 4.53 703 636 A 27 THR H A 106 LYS HBy 1.0 0.0 5.30 704 637 A 106 LYS HBy A 106 LYS HEx 1.0 0.0 4.41 705 637 A 106 LYS HEy A 106 LYS HBy 1.0 0.0 4.41 706 638 A 27 THR HG2% A 106 LYS HBy 1.0 0.0 4.74 707 639 A 66 GLN H A 66 GLN HGx 1.0 0.0 4.82 708 640 A 66 GLN HGx A 43 PHE HE% 1.0 0.0 4.35 709 641 A 66 GLN HGx A 67 ALA HA 1.0 0.0 4.25 710 642 A 66 GLN HGx A 42 PRO HGy 1.0 0.0 5.50 711 643 A 13 LYS HEy A 13 LYS HBy 1.0 0.0 4.51 712 643 A 13 LYS HBy A 13 LYS HEx 1.0 0.0 4.51 713 644 A 63 VAL HB A 63 VAL H 1.0 0.0 3.86 714 645 A 12 TRP HZ3 A 63 VAL HB 1.0 0.0 5.50 715 646 A 63 VAL HB A 62 GLU HA 1.0 0.0 4.98 716 647 A 63 VAL HB A 22 LYS HGx 1.0 0.0 4.80 717 648 A 72 ILE HG2% A 63 VAL HB 1.0 0.0 4.76 718 649 A 73 GLY H A 62 GLU HBy 1.0 0.0 5.18 719 650 A 62 GLU HBy A 61 ASP H 1.0 0.0 4.74 720 651 A 63 VAL H A 62 GLU HBy 1.0 0.0 5.01 721 652 A 104 VAL H A 104 VAL HB 1.0 0.0 4.05 722 653 A 104 VAL HB A 105 PHE HBy 1.0 0.0 5.50 723 654 A 104 VAL HB A 29 VAL HGy% 1.0 0.0 4.86 724 655 A 27 THR HG2% A 106 LYS HBx 1.0 0.0 5.10 725 656 A 53 PRO HBy A 52 LEU HA 1.0 0.0 5.50 726 657 A 53 PRO HBy A 52 LEU HDx% 1.0 0.0 5.42 727 658 A 53 PRO HBy A 52 LEU HDy% 1.0 0.0 5.42 728 659 A 34 PRO HBy A 52 LEU H 1.0 0.0 4.89 729 660 A 30 ASN HD2y A 34 PRO HBy 1.0 0.0 4.90 730 661 A 35 ILE HA A 34 PRO HBy 1.0 0.0 4.59 731 662 A 54 ALA HB% A 34 PRO HBy 1.0 0.0 5.21 732 663 A 48 VAL H A 47 PRO HBx 1.0 0.0 4.27 733 664 A 30 ASN H A 29 VAL HB 1.0 0.0 4.62 734 665 A 29 VAL HB A 106 LYS HEx 1.0 0.0 4.95 735 665 A 106 LYS HEy A 29 VAL HB 1.0 0.0 4.95 736 666 A 104 VAL HB A 29 VAL HB 1.0 0.0 3.86 737 667 A 57 THR HG2% A 29 VAL HB 1.0 0.0 5.35 738 668 A 97 ILE H A 96 GLN HGx 1.0 0.0 4.86 739 669 A 12 TRP HZ2 A 96 GLN HGx 1.0 0.0 5.32 740 670 A 97 ILE HA A 96 GLN HGx 1.0 0.0 4.95 741 671 A 96 GLN HGx A 96 GLN HA 1.0 0.0 4.15 742 672 A 96 GLN HGx A 98 PRO HDy 1.0 0.0 4.25 743 673 A 98 PRO HGx A 96 GLN HGx 1.0 0.0 4.09 744 674 A 65 ILE HD1% A 96 GLN HGx 1.0 0.0 3.66 745 675 A 42 PRO HGy A 66 GLN HBx 1.0 0.0 4.32 746 676 A 66 GLN HBx A 42 PRO HBx 1.0 0.0 4.24 747 676 A 42 PRO HBy A 66 GLN HBx 1.0 0.0 4.24 748 677 A 97 ILE H A 90 GLN HBy 1.0 0.0 4.94 749 678 A 90 GLN HBy A 89 CYS HA 1.0 0.0 4.56 750 679 A 96 GLN H A 96 GLN HGy 1.0 0.0 4.04 751 680 A 59 VAL H A 59 VAL HB 1.0 0.0 3.34 752 681 A 58 ILE HA A 59 VAL HB 1.0 0.0 4.90 753 682 A 98 PRO HGx A 96 GLN HGy 1.0 0.0 4.18 754 683 A 65 ILE HD1% A 96 GLN HGy 1.0 0.0 4.77 755 684 A 98 PRO HDy A 96 GLN HGy 1.0 0.0 4.52 756 685 A 58 ILE HG2% A 59 VAL HB 1.0 0.0 4.75 757 686 A 98 PRO HBy A 87 ARG HGx 1.0 0.0 4.29 758 687 A 98 PRO HBy A 87 ARG HBy 1.0 0.0 5.13 759 688 A 98 PRO HBy A 87 ARG HGy 1.0 0.0 5.50 760 689 A 89 CYS HBy A 98 PRO HBy 1.0 0.0 5.21 761 690 A 35 ILE HG2% A 36 VAL HB 1.0 0.0 4.80 762 691 A 100 VAL HB A 99 GLY HAy 1.0 0.0 5.21 763 692 A 86 VAL HB A 87 ARG HBx 1.0 0.0 4.37 764 693 A 34 PRO HDy A 33 GLN HGx 1.0 0.0 4.74 765 693 A 33 GLN HGy A 34 PRO HDy 1.0 0.0 4.74 766 694 A 102 TRP HBx A 33 GLN HGx 1.0 0.0 5.29 767 694 A 102 TRP HBx A 33 GLN HGy 1.0 0.0 5.29 768 695 A 32 ASN HBy A 33 GLN HGx 1.0 0.0 4.20 769 695 A 33 GLN HGy A 32 ASN HBx 1.0 0.0 4.20 770 695 A 32 ASN HBy A 33 GLN HGy 1.0 0.0 4.20 771 695 A 32 ASN HBx A 33 GLN HGx 1.0 0.0 4.20 772 696 A 33 GLN HBx A 33 GLN HGx 1.0 0.0 2.85 773 696 A 33 GLN HGy A 33 GLN HBx 1.0 0.0 2.85 774 697 A 33 GLN HBy A 33 GLN HGx 1.0 0.0 2.88 775 697 A 33 GLN HGy A 33 GLN HBy 1.0 0.0 2.88 776 698 A 35 ILE HD1% A 33 GLN HGx 1.0 0.0 4.32 777 698 A 35 ILE HD1% A 33 GLN HGy 1.0 0.0 4.32 778 699 A 35 ILE HG1y A 33 GLN HGx 1.0 0.0 4.34 779 699 A 33 GLN HGy A 35 ILE HG1y 1.0 0.0 4.34 780 700 A 30 ASN HD2y A 34 PRO HBx 1.0 0.0 4.65 781 701 A 69 HIS HBy A 70 ILE H 1.0 0.0 4.21 782 702 A 69 HIS HBy A 71 TRP HZ2 1.0 0.0 4.73 783 703 A 69 HIS HBy A 88 THR HA 1.0 0.0 4.80 784 704 A 66 GLN HBy A 71 TRP HE1 1.0 0.0 5.32 785 705 A 20 TRP H A 66 GLN HBy 1.0 0.0 4.80 786 706 A 66 GLN HBy A 42 PRO HGy 1.0 0.0 4.55 787 707 A 66 GLN HBy A 42 PRO HBx 1.0 0.0 4.73 788 707 A 42 PRO HBy A 66 GLN HBy 1.0 0.0 4.73 789 708 A 52 LEU HA A 53 PRO HBx 1.0 0.0 5.01 790 709 A 39 ILE H A 47 PRO HBy 1.0 0.0 4.85 791 710 A 47 PRO HBy A 48 VAL H 1.0 0.0 3.78 792 711 A 39 ILE HD1% A 47 PRO HBy 1.0 0.0 4.80 793 712 A 91 GLY H A 90 GLN HGy 1.0 0.0 4.91 794 713 A 90 GLN H A 90 GLN HGy 1.0 0.0 4.67 795 714 A 90 GLN HA A 90 GLN HGy 1.0 0.0 3.91 796 715 A 97 ILE HG2% A 90 GLN HGy 1.0 0.0 5.50 797 716 A 90 GLN H A 90 GLN HGx 1.0 0.0 4.67 798 717 A 90 GLN HA A 90 GLN HGx 1.0 0.0 3.91 799 718 A 61 ASP H A 62 GLU HBx 1.0 0.0 4.56 800 719 A 62 GLU HBx A 24 GLU H 1.0 0.0 5.48 801 720 A 62 GLU HBx A 23 PRO HA 1.0 0.0 5.50 802 721 A 62 GLU HBx A 73 GLY HAx 1.0 0.0 4.49 803 722 A 86 VAL HB A 102 TRP HE3 1.0 0.0 5.50 804 723 A 105 PHE HE% A 86 VAL HB 1.0 0.0 4.22 805 724 A 86 VAL HB A 28 PHE HZ 1.0 0.0 5.08 806 725 A 105 PHE HZ A 86 VAL HB 1.0 0.0 3.72 807 726 A 26 ALA HB% A 24 GLU HBx 1.0 0.0 4.67 808 726 A 24 GLU HBy A 26 ALA HB% 1.0 0.0 4.67 809 727 A 86 VAL HB A 35 ILE HD1% 1.0 0.0 5.50 810 728 A 86 VAL HB A 70 ILE HB 1.0 0.0 5.50 811 729 A 93 PRO HA A 94 PRO HBx 1.0 0.0 4.87 812 730 A 9 THR HG2% A 94 PRO HBx 1.0 0.0 5.27 813 731 A 62 GLU H A 24 GLU HBx 1.0 0.0 5.17 814 731 A 24 GLU HBy A 62 GLU H 1.0 0.0 5.17 815 732 A 86 VAL HB A 87 ARG H 1.0 0.0 4.16 816 733 A 71 TRP HD1 A 64 CYS HBy 1.0 0.0 4.74 817 734 A 42 PRO HBy A 64 CYS HBy 1.0 0.0 4.66 818 734 A 64 CYS HBy A 42 PRO HBx 1.0 0.0 4.66 819 735 A 64 CYS H A 71 TRP HBy 1.0 0.0 4.93 820 736 A 83 TYR HD% A 71 TRP HBy 1.0 0.0 4.98 821 737 A 71 TRP HBy A 42 PRO HBx 1.0 0.0 4.87 822 737 A 42 PRO HBy A 71 TRP HBy 1.0 0.0 4.87 823 738 A 20 TRP HE3 A 20 TRP HBx 1.0 0.0 4.05 824 739 A 20 TRP HBx A 65 ILE HB 1.0 0.0 4.20 825 740 A 12 TRP HBx A 93 PRO HBx 1.0 0.0 5.29 826 741 A 20 TRP HBy A 65 ILE H 1.0 0.0 4.66 827 742 A 20 TRP HBy A 93 PRO HDx 1.0 0.0 4.79 828 743 A 93 PRO HGx A 20 TRP HBy 1.0 0.0 4.72 829 744 A 93 PRO HGy A 20 TRP HBy 1.0 0.0 5.07 830 745 A 72 ILE H A 84 CYS HBx 1.0 0.0 4.40 831 746 A 74 TYR HD% A 84 CYS HBx 1.0 0.0 4.73 832 747 A 72 ILE HG1x A 84 CYS HBx 1.0 0.0 3.75 833 748 A 84 CYS HBx A 72 ILE HB 1.0 0.0 5.37 834 749 A 72 ILE HG1y A 84 CYS HBx 1.0 0.0 3.69 835 750 A 72 ILE HG2% A 84 CYS HBx 1.0 0.0 5.13 836 751 A 64 CYS H A 71 TRP HBx 1.0 0.0 4.93 837 752 A 83 TYR HD% A 71 TRP HBx 1.0 0.0 4.98 838 753 A 42 PRO HBy A 71 TRP HBx 1.0 0.0 4.87 839 753 A 42 PRO HBx A 71 TRP HBx 1.0 0.0 4.87 840 754 A 102 TRP HH2 A 69 HIS HBx 1.0 0.0 5.50 841 755 A 88 THR HA A 69 HIS HBx 1.0 0.0 4.68 842 756 A 88 THR HG2% A 69 HIS HBx 1.0 0.0 4.77 843 757 A 70 ILE HB A 69 HIS HBx 1.0 0.0 5.17 844 758 A 85 PRO HBx A 69 HIS HBx 1.0 0.0 4.73 845 759 A 85 PRO HBy A 69 HIS HBx 1.0 0.0 4.66 846 760 A 84 CYS HBy A 85 PRO HDy 1.0 0.0 4.89 847 761 A 72 ILE HG1x A 84 CYS HBy 1.0 0.0 4.35 848 762 A 72 ILE HD1% A 84 CYS HBy 1.0 0.0 4.27 849 763 A 71 TRP HD1 A 64 CYS HBx 1.0 0.0 4.74 850 764 A 42 PRO HGx A 64 CYS HBx 1.0 0.0 4.45 851 765 A 42 PRO HBy A 64 CYS HBx 1.0 0.0 4.66 852 765 A 42 PRO HBx A 64 CYS HBx 1.0 0.0 4.66 853 766 A 102 TRP HZ3 A 102 TRP HBx 1.0 0.0 5.50 854 767 A 102 TRP HBx A 86 VAL HA 1.0 0.0 4.64 855 768 A 102 TRP HE3 A 102 TRP HBy 1.0 0.0 4.13 856 769 A 102 TRP HBy A 86 VAL HA 1.0 0.0 4.51 857 770 A 27 THR HB A 106 LYS HGx 1.0 0.0 3.52 858 770 A 27 THR HB A 106 LYS HGy 1.0 0.0 3.52 859 771 A 106 LYS HEx A 106 LYS HGx 1.0 0.0 3.42 860 771 A 106 LYS HEy A 106 LYS HGx 1.0 0.0 3.42 861 771 A 106 LYS HGy A 106 LYS HEx 1.0 0.0 3.42 862 771 A 106 LYS HEy A 106 LYS HGy 1.0 0.0 3.42 863 772 A 52 LEU HBy A 52 LEU H 1.0 0.0 3.60 864 773 A 35 ILE H A 52 LEU HBy 1.0 0.0 4.51 865 774 A 51 ASN HA A 52 LEU HBy 1.0 0.0 4.91 866 775 A 52 LEU HBy A 37 THR HB 1.0 0.0 5.32 867 776 A 52 LEU HBy A 53 PRO HDx 1.0 0.0 5.50 868 777 A 53 PRO HDy A 52 LEU HBy 1.0 0.0 4.81 869 778 A 58 ILE HD1% A 52 LEU HBy 1.0 0.0 4.72 870 779 A 35 ILE HB A 36 VAL H 1.0 0.0 4.42 871 780 A 30 ASN HD2y A 35 ILE HB 1.0 0.0 4.69 872 781 A 35 ILE HB A 34 PRO HA 1.0 0.0 4.91 873 782 A 37 THR HG2% A 35 ILE HB 1.0 0.0 4.36 874 783 A 35 ILE HB A 52 LEU HBy 1.0 0.0 4.75 875 784 A 59 VAL H A 58 ILE HB 1.0 0.0 4.28 876 785 A 60 TYR HE% A 58 ILE HB 1.0 0.0 5.50 877 786 A 58 ILE HB A 57 THR HA 1.0 0.0 4.63 878 787 A 28 PHE HBx A 58 ILE HB 1.0 0.0 3.94 879 788 A 12 TRP HE3 A 65 ILE HB 1.0 0.0 5.07 880 789 A 65 ILE HB A 12 TRP HZ3 1.0 0.0 4.77 881 790 A 65 ILE HB A 92 VAL HA 1.0 0.0 4.89 882 791 A 65 ILE HB A 20 TRP HBy 1.0 0.0 3.53 883 792 A 60 TYR HD% A 72 ILE HB 1.0 0.0 4.75 884 793 A 60 TYR HE% A 72 ILE HB 1.0 0.0 4.54 885 794 A 63 VAL HA A 72 ILE HB 1.0 0.0 4.81 886 795 A 60 TYR HBy A 72 ILE HB 1.0 0.0 3.80 887 796 A 60 TYR HBx A 72 ILE HB 1.0 0.0 3.97 888 797 A 97 ILE HB A 90 GLN HA 1.0 0.0 4.71 889 798 A 90 GLN HBy A 97 ILE HB 1.0 0.0 3.38 890 799 A 70 ILE HB A 87 ARG HBx 1.0 0.0 5.16 891 800 A 40 GLY H A 39 ILE HB 1.0 0.0 4.39 892 801 A 39 ILE HB A 38 ARG HA 1.0 0.0 4.74 893 802 A 39 ILE HB A 47 PRO HDx 1.0 0.0 4.65 894 802 A 39 ILE HB A 47 PRO HDy 1.0 0.0 4.65 895 803 A 39 ILE HB A 47 PRO HBy 1.0 0.0 3.95 896 804 A 24 GLU HBy A 24 GLU HGx 1.0 0.0 2.89 897 804 A 24 GLU HGx A 24 GLU HBx 1.0 0.0 2.89 898 805 A 44 LEU H A 44 LEU HBy 1.0 0.0 3.69 899 806 A 26 ALA H A 24 GLU HGy 1.0 0.0 5.50 900 807 A 30 ASN HD2x A 52 LEU HBx 1.0 0.0 4.73 901 808 A 51 ASN HA A 52 LEU HBx 1.0 0.0 4.81 902 809 A 35 ILE HA A 52 LEU HBx 1.0 0.0 5.22 903 810 A 52 LEU HBx A 53 PRO HDx 1.0 0.0 5.50 904 811 A 52 LEU HBx A 53 PRO HDy 1.0 0.0 4.91 905 812 A 35 ILE HG1x A 52 LEU HBx 1.0 0.0 4.48 906 813 A 35 ILE HB A 52 LEU HBx 1.0 0.0 3.29 907 814 A 84 CYS H A 83 TYR HBx 1.0 0.0 4.53 908 815 A 83 TYR H A 83 TYR HBx 1.0 0.0 4.19 909 816 A 82 VAL HA A 83 TYR HBx 1.0 0.0 5.50 910 817 A 42 PRO HBy A 83 TYR HBx 1.0 0.0 4.43 911 817 A 42 PRO HBx A 83 TYR HBx 1.0 0.0 4.43 912 818 A 22 LYS HEx A 24 GLU HBx 1.0 0.0 4.29 913 818 A 22 LYS HEy A 24 GLU HBx 1.0 0.0 4.29 914 818 A 24 GLU HBy A 22 LYS HEx 1.0 0.0 4.29 915 818 A 24 GLU HBy A 22 LYS HEy 1.0 0.0 4.29 916 819 A 22 LYS HGy A 22 LYS HEx 1.0 0.0 3.66 917 819 A 22 LYS HGy A 22 LYS HEy 1.0 0.0 3.66 918 820 A 22 LYS H A 22 LYS HEx 1.0 0.0 4.88 919 820 A 22 LYS HEy A 22 LYS H 1.0 0.0 4.88 920 821 A 12 TRP HE3 A 22 LYS HEx 1.0 0.0 5.50 921 821 A 12 TRP HE3 A 22 LYS HEy 1.0 0.0 5.50 922 822 A 22 LYS HGx A 22 LYS HEx 1.0 0.0 3.67 923 822 A 22 LYS HEy A 22 LYS HGx 1.0 0.0 3.67 924 823 A 63 VAL H A 62 GLU HGy 1.0 0.0 3.63 925 824 A 24 GLU H A 62 GLU HGy 1.0 0.0 4.71 926 825 A 62 GLU HGy A 21 TYR HD% 1.0 0.0 4.42 927 826 A 21 TYR HA A 62 GLU HGy 1.0 0.0 4.84 928 827 A 22 LYS HA A 62 GLU HGy 1.0 0.0 5.34 929 828 A 23 PRO HA A 62 GLU HGy 1.0 0.0 5.50 930 829 A 21 TYR HBx A 62 GLU HGy 1.0 0.0 5.00 931 830 A 62 GLU HGy A 21 TYR HBy 1.0 0.0 4.46 932 831 A 105 PHE H A 105 PHE HBx 1.0 0.0 3.92 933 832 A 74 TYR HBx A 60 TYR H 1.0 0.0 4.43 934 833 A 60 TYR HBy A 74 TYR HBx 1.0 0.0 4.50 935 834 A 60 TYR HBy A 74 TYR HBy 1.0 0.0 4.99 936 835 A 60 TYR HBx A 74 TYR HBy 1.0 0.0 4.74 937 836 A 76 ALA HB% A 77 TYR HBy 1.0 0.0 4.99 938 837 A 76 ALA HA A 77 TYR HBx 1.0 0.0 5.31 939 838 A 33 GLN HA A 32 ASN HBx 1.0 0.0 4.49 940 838 A 33 GLN HA A 32 ASN HBy 1.0 0.0 4.49 941 839 A 32 ASN HA A 32 ASN HBx 1.0 0.0 2.75 942 839 A 32 ASN HBy A 32 ASN HA 1.0 0.0 2.75 943 840 A 31 GLY HAy A 32 ASN HBx 1.0 0.0 4.98 944 840 A 32 ASN HBy A 31 GLY HAy 1.0 0.0 4.98 945 841 A 31 GLY HAx A 32 ASN HBx 1.0 0.0 4.26 946 841 A 32 ASN HBy A 31 GLY HAx 1.0 0.0 4.26 947 842 A 31 GLY H A 30 ASN HBx 1.0 0.0 4.62 948 843 A 30 ASN HD2y A 30 ASN HBx 1.0 0.0 3.92 949 844 A 30 ASN HBx A 55 GLY HAx 1.0 0.0 4.37 950 844 A 55 GLY HAy A 30 ASN HBx 1.0 0.0 4.37 951 845 A 52 LEU HG A 30 ASN HBx 1.0 0.0 5.02 952 846 A 63 VAL H A 62 GLU HGx 1.0 0.0 3.61 953 847 A 24 GLU H A 62 GLU HGx 1.0 0.0 5.30 954 848 A 21 TYR HD% A 62 GLU HGx 1.0 0.0 4.47 955 849 A 21 TYR HA A 62 GLU HGx 1.0 0.0 4.91 956 850 A 64 CYS HA A 62 GLU HGx 1.0 0.0 5.50 957 851 A 22 LYS HA A 62 GLU HGx 1.0 0.0 5.50 958 852 A 23 PRO HA A 62 GLU HGx 1.0 0.0 5.50 959 853 A 21 TYR HBx A 62 GLU HGx 1.0 0.0 4.24 960 854 A 73 GLY HAx A 62 GLU HGx 1.0 0.0 5.48 961 855 A 21 TYR HBy A 62 GLU HGx 1.0 0.0 4.66 962 856 A 62 GLU HGx A 24 GLU HBx 1.0 0.0 5.50 963 856 A 24 GLU HBy A 62 GLU HGx 1.0 0.0 5.50 964 857 A 63 VAL HB A 62 GLU HGx 1.0 0.0 5.50 965 858 A 40 GLY H A 80 ASN HBx 1.0 0.0 5.50 966 859 A 80 ASN HBx A 76 ALA H 1.0 0.0 5.50 967 860 A 80 ASN HBx A 76 ALA HB% 1.0 0.0 4.01 968 861 A 26 ALA H A 25 ASN HBx 1.0 0.0 4.10 969 861 A 26 ALA H A 25 ASN HBy 1.0 0.0 4.10 970 862 A 26 ALA HA A 25 ASN HBx 1.0 0.0 4.86 971 862 A 25 ASN HBy A 26 ALA HA 1.0 0.0 4.86 972 863 A 52 LEU H A 51 ASN HBy 1.0 0.0 4.39 973 864 A 39 ILE HG2% A 80 ASN HBy 1.0 0.0 4.05 974 865 A 28 PHE HZ A 30 ASN HBy 1.0 0.0 4.94 975 866 A 30 ASN HBy A 54 ALA HA 1.0 0.0 4.31 976 867 A 30 ASN HBy A 55 GLY HAx 1.0 0.0 5.17 977 867 A 30 ASN HBy A 55 GLY HAy 1.0 0.0 5.17 978 868 A 30 ASN HBy A 52 LEU HG 1.0 0.0 4.33 979 869 A 106 LYS H A 105 PHE HBy 1.0 0.0 4.81 980 870 A 104 VAL HA A 105 PHE HBy 1.0 0.0 4.37 981 871 A 75 ASN HA A 81 ARG HDy 1.0 0.0 5.27 982 872 A 81 ARG HA A 81 ARG HDy 1.0 0.0 3.44 983 873 A 81 ARG HBy A 81 ARG HDy 1.0 0.0 4.09 984 874 A 13 LYS H A 13 LYS HEx 1.0 0.0 5.40 985 874 A 13 LYS HEy A 13 LYS H 1.0 0.0 5.40 986 875 A 21 TYR HE% A 13 LYS HEx 1.0 0.0 4.66 987 875 A 21 TYR HE% A 13 LYS HEy 1.0 0.0 4.66 988 876 A 13 LYS HDx A 13 LYS HEx 1.0 0.0 2.84 989 876 A 13 LYS HDy A 13 LYS HEx 1.0 0.0 2.84 990 876 A 13 LYS HEy A 13 LYS HDx 1.0 0.0 2.84 991 876 A 13 LYS HDy A 13 LYS HEy 1.0 0.0 2.84 992 877 A 13 LYS HEy A 13 LYS HGx 1.0 0.0 2.96 993 877 A 13 LYS HEx A 13 LYS HGx 1.0 0.0 2.96 994 877 A 13 LYS HGy A 13 LYS HEx 1.0 0.0 2.96 995 877 A 13 LYS HGy A 13 LYS HEy 1.0 0.0 2.96 996 878 A 13 LYS HEy A 13 LYS HBx 1.0 0.0 4.51 997 878 A 13 LYS HBx A 13 LYS HEx 1.0 0.0 4.51 998 879 A 60 TYR HBx A 60 TYR H 1.0 0.0 3.98 999 880 A 60 TYR HBx A 74 TYR HBx 1.0 0.0 4.65 1000 881 A 60 TYR HBx A 72 ILE HG1y 1.0 0.0 4.98 1001 882 A 106 LYS HBx A 106 LYS HEx 1.0 0.0 4.38 1002 882 A 106 LYS HEy A 106 LYS HBx 1.0 0.0 4.38 1003 883 A 20 TRP HE1 A 14 LYS HEy 1.0 0.0 4.90 1004 884 A 20 TRP HZ2 A 14 LYS HEy 1.0 0.0 5.01 1005 885 A 18 GLY HAy A 14 LYS HEy 1.0 0.0 4.39 1006 886 A 14 LYS HBy A 14 LYS HEy 1.0 0.0 4.76 1007 887 A 14 LYS HGx A 14 LYS HEy 1.0 0.0 4.14 1008 888 A 20 TRP HZ2 A 14 LYS HEx 1.0 0.0 5.01 1009 889 A 18 GLY HAy A 14 LYS HEx 1.0 0.0 4.39 1010 890 A 14 LYS HBy A 14 LYS HEx 1.0 0.0 4.76 1011 891 A 14 LYS HGx A 14 LYS HEx 1.0 0.0 4.14 1012 892 A 21 TYR HE% A 15 ASN HBy 1.0 0.0 4.16 1013 893 A 19 THR HB A 17 TYR HBy 1.0 0.0 5.20 1014 894 A 97 ILE H A 91 GLY HAx 1.0 0.0 4.90 1015 895 A 90 GLN HA A 91 GLY HAy 1.0 0.0 4.51 1016 896 A 92 VAL HGx% A 91 GLY HAy 1.0 0.0 4.01 1017 897 A 92 VAL HGy% A 91 GLY HAy 1.0 0.0 4.09 1018 898 A 98 PRO HA A 99 GLY HAy 1.0 0.0 4.58 1019 899 A 100 VAL HGy% A 99 GLY HAy 1.0 0.0 4.73 1020 899 A 99 GLY HAy A 100 VAL HGx% 1.0 0.0 4.73 1021 900 A 98 PRO HA A 99 GLY HAx 1.0 0.0 4.58 1022 901 A 100 VAL HB A 99 GLY HAx 1.0 0.0 5.21 1023 902 A 100 VAL HGy% A 99 GLY HAx 1.0 0.0 4.73 1024 902 A 99 GLY HAx A 100 VAL HGx% 1.0 0.0 4.73 1025 903 A 60 TYR HBy A 73 GLY HAx 1.0 0.0 5.09 1026 904 A 60 TYR HBy A 72 ILE HG1x 1.0 0.0 4.98 1027 905 A 39 ILE HG1y A 49 GLY HAy 1.0 0.0 4.04 1028 906 A 39 ILE HG1x A 49 GLY HAy 1.0 0.0 3.82 1029 907 A 32 ASN HA A 31 GLY HAx 1.0 0.0 4.61 1030 908 A 31 GLY HAx A 103 GLY HAx 1.0 0.0 3.99 1031 909 A 54 ALA HB% A 31 GLY HAx 1.0 0.0 5.50 1032 910 A 54 ALA HB% A 55 GLY HAx 1.0 0.0 3.87 1033 910 A 54 ALA HB% A 55 GLY HAy 1.0 0.0 3.87 1034 911 A 104 VAL H A 103 GLY HAx 1.0 0.0 3.34 1035 912 A 31 GLY HAy A 103 GLY HAx 1.0 0.0 4.55 1036 913 A 53 PRO HBy A 55 GLY HAx 1.0 0.0 5.50 1037 913 A 53 PRO HBy A 55 GLY HAy 1.0 0.0 5.50 1038 914 A 104 VAL HB A 103 GLY HAx 1.0 0.0 5.50 1039 915 A 40 GLY HAx A 81 ARG HBx 1.0 0.0 5.33 1040 916 A 40 GLY HAy A 81 ARG H 1.0 0.0 5.49 1041 917 A 40 GLY HAy A 81 ARG HBy 1.0 0.0 4.44 1042 918 A 40 GLY HAy A 81 ARG HBx 1.0 0.0 4.13 1043 919 A 40 GLY HAy A 81 ARG HGx 1.0 0.0 5.33 1044 920 A 71 TRP HE3 A 85 PRO HDx 1.0 0.0 4.45 1045 921 A 71 TRP HZ3 A 85 PRO HDx 1.0 0.0 4.27 1046 922 A 35 ILE HG2% A 85 PRO HDx 1.0 0.0 3.17 1047 923 A 53 PRO HDx A 52 LEU H 1.0 0.0 4.99 1048 924 A 52 LEU HA A 53 PRO HDx 1.0 0.0 3.08 1049 925 A 56 ALA HB% A 53 PRO HDx 1.0 0.0 4.14 1050 926 A 46 ALA HA A 47 PRO HDx 1.0 0.0 2.81 1051 926 A 47 PRO HDy A 46 ALA HA 1.0 0.0 2.81 1052 927 A 98 PRO HDx A 96 GLN HGy 1.0 0.0 3.84 1053 928 A 98 PRO HDx A 97 ILE HG1x 1.0 0.0 5.27 1054 929 A 98 PRO HDx A 97 ILE HG1y 1.0 0.0 5.50 1055 930 A 98 PRO HDx A 96 GLN HBx 1.0 0.0 4.68 1056 931 A 97 ILE HA A 98 PRO HDy 1.0 0.0 2.91 1057 932 A 97 ILE HG1x A 98 PRO HDy 1.0 0.0 5.03 1058 933 A 56 ALA H A 53 PRO HDy 1.0 0.0 5.17 1059 934 A 52 LEU HA A 53 PRO HDy 1.0 0.0 3.30 1060 935 A 53 PRO HDy A 52 LEU HG 1.0 0.0 4.18 1061 936 A 53 PRO HDy A 52 LEU HDx% 1.0 0.0 4.31 1062 937 A 58 ILE HD1% A 53 PRO HDy 1.0 0.0 5.10 1063 938 A 2 THR HA A 3 PRO HDy 1.0 0.0 3.38 1064 939 A 2 THR HA A 3 PRO HDx 1.0 0.0 3.38 1065 940 A 33 GLN HA A 34 PRO HDx 1.0 0.0 2.81 1066 941 A 54 ALA HA A 34 PRO HDx 1.0 0.0 4.99 1067 942 A 33 GLN HBy A 34 PRO HDx 1.0 0.0 3.98 1068 943 A 54 ALA HB% A 34 PRO HDx 1.0 0.0 3.67 1069 944 A 6 ARG HA A 7 PRO HDx 1.0 0.0 2.93 1070 945 A 6 ARG HGx A 7 PRO HDx 1.0 0.0 3.70 1071 945 A 6 ARG HGy A 7 PRO HDx 1.0 0.0 3.70 1072 946 A 40 GLY HAx A 47 PRO HDx 1.0 0.0 4.99 1073 946 A 40 GLY HAx A 47 PRO HDy 1.0 0.0 4.99 1074 947 A 39 ILE HG2% A 47 PRO HDx 1.0 0.0 5.18 1075 947 A 39 ILE HG2% A 47 PRO HDy 1.0 0.0 5.18 1076 948 A 34 PRO HDy A 33 GLN H 1.0 0.0 5.11 1077 949 A 33 GLN HA A 34 PRO HDy 1.0 0.0 2.81 1078 950 A 34 PRO HDy A 33 GLN HBy 1.0 0.0 3.56 1079 951 A 54 ALA HB% A 34 PRO HDy 1.0 0.0 3.81 1080 952 A 6 ARG HA A 7 PRO HDy 1.0 0.0 2.93 1081 953 A 83 TYR HA A 73 GLY HAy 1.0 0.0 3.74 1082 954 A 21 TYR HE% A 15 ASN HA 1.0 0.0 3.99 1083 955 A 82 VAL H A 75 ASN HA 1.0 0.0 4.70 1084 956 A 75 ASN HA A 81 ARG HA 1.0 0.0 4.13 1085 957 A 74 TYR HBy A 75 ASN HA 1.0 0.0 5.33 1086 958 A 60 TYR HD% A 25 ASN HA 1.0 0.0 5.39 1087 959 A 25 ASN HA A 61 ASP HBy 1.0 0.0 4.75 1088 960 A 25 ASN HA A 25 ASN HBx 1.0 0.0 3.00 1089 960 A 25 ASN HA A 25 ASN HBy 1.0 0.0 3.00 1090 961 A 25 ASN HA A 61 ASP HBx 1.0 0.0 4.75 1091 962 A 18 GLY HAy A 14 LYS HDy 1.0 0.0 4.37 1092 963 A 18 GLY HAy A 14 LYS HGy 1.0 0.0 4.24 1093 964 A 39 ILE HG1y A 49 GLY HAx 1.0 0.0 4.04 1094 965 A 39 ILE HG1x A 49 GLY HAx 1.0 0.0 3.82 1095 966 A 74 TYR HD% A 73 GLY HAx 1.0 0.0 5.09 1096 967 A 105 PHE HE% A 87 ARG HDx 1.0 0.0 4.31 1097 967 A 105 PHE HE% A 87 ARG HDy 1.0 0.0 4.31 1098 968 A 105 PHE HZ A 87 ARG HDx 1.0 0.0 4.72 1099 968 A 105 PHE HZ A 87 ARG HDy 1.0 0.0 4.72 1100 969 A 101 ALA HA A 87 ARG HDx 1.0 0.0 4.31 1101 969 A 87 ARG HDy A 101 ALA HA 1.0 0.0 4.31 1102 970 A 87 ARG HA A 87 ARG HDx 1.0 0.0 4.98 1103 970 A 87 ARG HDy A 87 ARG HA 1.0 0.0 4.98 1104 971 A 87 ARG HBx A 87 ARG HDx 1.0 0.0 4.06 1105 971 A 87 ARG HDy A 87 ARG HBx 1.0 0.0 4.06 1106 972 A 98 PRO HBy A 87 ARG HDx 1.0 0.0 4.81 1107 972 A 87 ARG HDy A 98 PRO HBy 1.0 0.0 4.81 1108 973 A 86 VAL HB A 87 ARG HDx 1.0 0.0 4.83 1109 973 A 86 VAL HB A 87 ARG HDy 1.0 0.0 4.83 1110 974 A 70 ILE HB A 87 ARG HDx 1.0 0.0 4.34 1111 974 A 87 ARG HDy A 70 ILE HB 1.0 0.0 4.34 1112 975 A 70 ILE HG2% A 87 ARG HDx 1.0 0.0 4.37 1113 975 A 87 ARG HDy A 70 ILE HG2% 1.0 0.0 4.37 1114 976 A 72 ILE HG2% A 87 ARG HDx 1.0 0.0 5.30 1115 976 A 72 ILE HG2% A 87 ARG HDy 1.0 0.0 5.30 1116 977 A 95 ASN HD2x A 94 PRO HDx 1.0 0.0 5.12 1117 977 A 94 PRO HDy A 95 ASN HD2x 1.0 0.0 5.12 1118 978 A 93 PRO HA A 94 PRO HDx 1.0 0.0 4.69 1119 978 A 94 PRO HDy A 93 PRO HA 1.0 0.0 4.69 1120 979 A 93 PRO HDy A 20 TRP HE1 1.0 0.0 5.50 1121 980 A 92 VAL H A 93 PRO HDy 1.0 0.0 5.27 1122 981 A 20 TRP HD1 A 93 PRO HDy 1.0 0.0 4.65 1123 982 A 20 TRP HBx A 93 PRO HDy 1.0 0.0 4.86 1124 983 A 65 ILE HB A 93 PRO HDy 1.0 0.0 4.70 1125 984 A 93 PRO HDy A 96 GLN HBx 1.0 0.0 3.63 1126 985 A 65 ILE HD1% A 93 PRO HDy 1.0 0.0 3.28 1127 986 A 20 TRP HBx A 93 PRO HDx 1.0 0.0 4.62 1128 987 A 93 PRO HDx A 92 VAL HGx% 1.0 0.0 3.64 1129 988 A 61 ASP H A 61 ASP HBx 1.0 0.0 4.16 1130 989 A 43 PHE HBy A 67 ALA HB% 1.0 0.0 5.15 1131 990 A 102 TRP H A 87 ARG HA 1.0 0.0 4.61 1132 991 A 102 TRP HZ2 A 87 ARG HA 1.0 0.0 4.91 1133 992 A 87 ARG HA A 102 TRP HD1 1.0 0.0 5.08 1134 993 A 101 ALA HA A 87 ARG HA 1.0 0.0 4.49 1135 994 A 88 THR HG2% A 87 ARG HA 1.0 0.0 4.28 1136 995 A 97 ILE H A 96 GLN HA 1.0 0.0 2.89 1137 996 A 92 VAL H A 96 GLN HA 1.0 0.0 4.56 1138 997 A 97 ILE HA A 96 GLN HA 1.0 0.0 4.57 1139 998 A 98 PRO HDx A 96 GLN HA 1.0 0.0 4.61 1140 999 A 96 GLN HA A 96 GLN HGy 1.0 0.0 3.99 1141 1000 A 97 ILE HB A 96 GLN HA 1.0 0.0 4.74 1142 1001 A 97 ILE HG1x A 96 GLN HA 1.0 0.0 3.98 1143 1002 A 65 ILE HG2% A 96 GLN HA 1.0 0.0 4.93 1144 1003 A 43 PHE HD% A 41 SER HA 1.0 0.0 5.06 1145 1004 A 41 SER HA A 43 PHE HE% 1.0 0.0 5.50 1146 1005 A 83 TYR HD% A 41 SER HA 1.0 0.0 5.03 1147 1006 A 41 SER HA A 42 PRO HDy 1.0 0.0 3.64 1148 1007 A 41 SER HA A 42 PRO HDx 1.0 0.0 3.64 1149 1008 A 41 SER HA A 42 PRO HGx 1.0 0.0 4.52 1150 1009 A 41 SER HA A 42 PRO HBx 1.0 0.0 4.83 1151 1009 A 42 PRO HBy A 41 SER HA 1.0 0.0 4.83 1152 1010 A 44 LEU HA A 71 TRP HH2 1.0 0.0 3.94 1153 1011 A 44 LEU HA A 38 ARG HDy 1.0 0.0 4.97 1154 1012 A 44 LEU HA A 44 LEU HDx% 1.0 0.0 3.81 1155 1013 A 106 LYS HA A 106 LYS HBx 1.0 0.0 2.98 1156 1014 A 106 LYS HA A 106 LYS HGx 1.0 0.0 3.47 1157 1014 A 106 LYS HA A 106 LYS HGy 1.0 0.0 3.47 1158 1015 A 81 ARG HA A 76 ALA H 1.0 0.0 4.56 1159 1016 A 81 ARG HA A 81 ARG HGy 1.0 0.0 3.85 1160 1017 A 54 ALA HB% A 32 ASN HA 1.0 0.0 2.85 1161 1018 A 101 ALA HA A 87 ARG HBx 1.0 0.0 3.17 1162 1019 A 57 THR H A 56 ALA HA 1.0 0.0 2.64 1163 1020 A 55 GLY H A 54 ALA HA 1.0 0.0 2.83 1164 1021 A 30 ASN HD2y A 54 ALA HA 1.0 0.0 3.69 1165 1022 A 30 ASN HD2x A 54 ALA HA 1.0 0.0 3.42 1166 1023 A 34 PRO HA A 54 ALA HA 1.0 0.0 4.13 1167 1024 A 32 ASN HA A 54 ALA HA 1.0 0.0 4.80 1168 1025 A 54 ALA HA A 55 GLY HAx 1.0 0.0 4.21 1169 1025 A 55 GLY HAy A 54 ALA HA 1.0 0.0 4.21 1170 1026 A 56 ALA HA A 55 GLY HAx 1.0 0.0 4.59 1171 1026 A 56 ALA HA A 55 GLY HAy 1.0 0.0 4.59 1172 1027 A 28 PHE HZ A 30 ASN HA 1.0 0.0 3.74 1173 1028 A 30 ASN HD2x A 30 ASN HA 1.0 0.0 4.43 1174 1029 A 30 ASN HA A 103 GLY HAy 1.0 0.0 3.64 1175 1030 A 30 ASN HA A 103 GLY HAx 1.0 0.0 4.16 1176 1031 A 63 VAL H A 62 GLU HA 1.0 0.0 3.05 1177 1032 A 63 VAL HA A 62 GLU HA 1.0 0.0 4.48 1178 1033 A 62 GLU HA A 23 PRO HA 1.0 0.0 3.53 1179 1034 A 102 TRP HA A 101 ALA HA 1.0 0.0 4.58 1180 1035 A 62 GLU HA A 62 GLU HGy 1.0 0.0 3.59 1181 1036 A 62 GLU HA A 24 GLU HBx 1.0 0.0 4.01 1182 1036 A 24 GLU HBy A 62 GLU HA 1.0 0.0 4.01 1183 1037 A 35 ILE HD1% A 102 TRP HA 1.0 0.0 4.43 1184 1038 A 28 PHE HA A 29 VAL H 1.0 0.0 3.09 1185 1039 A 28 PHE HA A 105 PHE HA 1.0 0.0 3.58 1186 1040 A 28 PHE HA A 29 VAL HB 1.0 0.0 5.01 1187 1041 A 72 ILE HD1% A 28 PHE HA 1.0 0.0 4.74 1188 1042 A 84 CYS HA A 38 ARG H 1.0 0.0 4.58 1189 1043 A 60 TYR HD% A 61 ASP HA 1.0 0.0 4.70 1190 1044 A 26 ALA H A 61 ASP HA 1.0 0.0 4.17 1191 1045 A 71 TRP HE3 A 84 CYS HA 1.0 0.0 4.48 1192 1046 A 71 TRP HZ3 A 84 CYS HA 1.0 0.0 4.39 1193 1047 A 84 CYS HA A 37 THR HA 1.0 0.0 3.92 1194 1048 A 84 CYS HA A 85 PRO HDx 1.0 0.0 3.25 1195 1049 A 37 THR HG2% A 84 CYS HA 1.0 0.0 3.50 1196 1050 A 71 TRP HD1 A 71 TRP HA 1.0 0.0 4.94 1197 1051 A 71 TRP HA A 87 ARG H 1.0 0.0 5.18 1198 1052 A 71 TRP HA A 85 PRO HDy 1.0 0.0 5.09 1199 1053 A 71 TRP HA A 72 ILE HG1y 1.0 0.0 4.24 1200 1054 A 71 TRP HA A 86 VAL HGx% 1.0 0.0 4.40 1201 1055 A 71 TRP HA A 72 ILE HG2% 1.0 0.0 4.91 1202 1056 A 85 PRO HBy A 71 TRP HA 1.0 0.0 4.75 1203 1057 A 106 LYS H A 105 PHE HA 1.0 0.0 3.19 1204 1058 A 29 VAL H A 105 PHE HA 1.0 0.0 4.38 1205 1059 A 105 PHE HA A 106 LYS HA 1.0 0.0 4.51 1206 1060 A 104 VAL HB A 105 PHE HA 1.0 0.0 5.12 1207 1061 A 105 PHE HA A 106 LYS HBy 1.0 0.0 4.85 1208 1062 A 105 PHE HA A 106 LYS HGx 1.0 0.0 4.66 1209 1062 A 105 PHE HA A 106 LYS HGy 1.0 0.0 4.66 1210 1063 A 13 LYS H A 20 TRP HA 1.0 0.0 4.78 1211 1064 A 20 TRP HA A 15 ASN H 1.0 0.0 4.44 1212 1065 A 12 TRP HE3 A 20 TRP HA 1.0 0.0 4.78 1213 1066 A 20 TRP HD1 A 20 TRP HA 1.0 0.0 5.29 1214 1067 A 20 TRP HE3 A 20 TRP HA 1.0 0.0 4.37 1215 1068 A 21 TYR HD% A 20 TRP HA 1.0 0.0 4.29 1216 1069 A 20 TRP HA A 14 LYS HA 1.0 0.0 3.63 1217 1070 A 65 ILE HB A 20 TRP HA 1.0 0.0 5.50 1218 1071 A 19 THR HG2% A 20 TRP HA 1.0 0.0 4.91 1219 1072 A 14 LYS HBy A 20 TRP HA 1.0 0.0 4.47 1220 1073 A 14 LYS HBx A 20 TRP HA 1.0 0.0 5.23 1221 1074 A 71 TRP HE3 A 83 TYR HA 1.0 0.0 4.93 1222 1075 A 83 TYR HD% A 83 TYR HA 1.0 0.0 4.03 1223 1076 A 83 TYR HA A 73 GLY HAx 1.0 0.0 4.67 1224 1077 A 73 GLY H A 60 TYR HA 1.0 0.0 5.50 1225 1078 A 60 TYR HA A 62 GLU H 1.0 0.0 4.11 1226 1079 A 60 TYR HD% A 60 TYR HA 1.0 0.0 4.54 1227 1080 A 74 TYR HD% A 60 TYR HA 1.0 0.0 4.18 1228 1081 A 60 TYR HA A 74 TYR HA 1.0 0.0 4.54 1229 1082 A 60 TYR HA A 74 TYR HBx 1.0 0.0 3.41 1230 1083 A 60 TYR HA A 74 TYR HBy 1.0 0.0 3.64 1231 1084 A 72 ILE HB A 60 TYR HA 1.0 0.0 4.79 1232 1085 A 60 TYR HA A 59 VAL HGy% 1.0 0.0 5.50 1233 1086 A 60 TYR HA A 58 ILE HG2% 1.0 0.0 3.95 1234 1087 A 21 TYR HA A 20 TRP HA 1.0 0.0 5.40 1235 1088 A 64 CYS HA A 63 VAL HGx% 1.0 0.0 5.50 1236 1089 A 64 CYS HA A 70 ILE HG2% 1.0 0.0 5.26 1237 1090 A 71 TRP HE3 A 42 PRO HA 1.0 0.0 4.33 1238 1091 A 71 TRP HZ3 A 42 PRO HA 1.0 0.0 4.70 1239 1092 A 83 TYR HD% A 42 PRO HA 1.0 0.0 4.88 1240 1093 A 42 PRO HA A 38 ARG HBx 1.0 0.0 4.11 1241 1093 A 38 ARG HBy A 42 PRO HA 1.0 0.0 4.11 1242 1094 A 46 ALA HB% A 42 PRO HA 1.0 0.0 4.56 1243 1095 A 46 ALA HB% A 41 SER HBy 1.0 0.0 4.77 1244 1096 A 43 PHE HD% A 41 SER HBx 1.0 0.0 4.03 1245 1097 A 46 ALA HB% A 41 SER HBx 1.0 0.0 4.77 1246 1098 A 101 ALA HB% A 100 VAL HA 1.0 0.0 4.11 1247 1099 A 100 VAL HA A 100 VAL HGx% 1.0 0.0 2.78 1248 1099 A 100 VAL HGy% A 100 VAL HA 1.0 0.0 2.78 1249 1100 A 37 THR HA A 36 VAL HA 1.0 0.0 4.63 1250 1101 A 36 VAL HA A 51 ASN HBy 1.0 0.0 4.71 1251 1102 A 36 VAL HA A 51 ASN HBx 1.0 0.0 4.71 1252 1103 A 35 ILE HG2% A 36 VAL HA 1.0 0.0 4.61 1253 1104 A 94 PRO HA A 96 GLN H 1.0 0.0 4.29 1254 1105 A 94 PRO HA A 93 PRO HA 1.0 0.0 2.92 1255 1106 A 94 PRO HA A 93 PRO HBx 1.0 0.0 3.60 1256 1107 A 94 PRO HA A 93 PRO HBy 1.0 0.0 3.60 1257 1108 A 94 PRO HA A 93 PRO HGy 1.0 0.0 4.61 1258 1109 A 8 VAL HA A 8 VAL HGx% 1.0 0.0 2.83 1259 1109 A 8 VAL HGy% A 8 VAL HA 1.0 0.0 2.83 1260 1110 A 72 ILE H A 85 PRO HA 1.0 0.0 4.79 1261 1111 A 86 VAL H A 85 PRO HA 1.0 0.0 3.16 1262 1112 A 71 TRP HA A 85 PRO HA 1.0 0.0 3.17 1263 1113 A 85 PRO HA A 86 VAL HGx% 1.0 0.0 4.15 1264 1114 A 66 GLN HE2y A 19 THR HA 1.0 0.0 4.01 1265 1115 A 66 GLN HE2x A 19 THR HA 1.0 0.0 4.01 1266 1116 A 19 THR HA A 20 TRP HA 1.0 0.0 4.43 1267 1117 A 96 GLN HGy A 93 PRO HA 1.0 0.0 4.54 1268 1118 A 96 GLN HBx A 93 PRO HA 1.0 0.0 4.36 1269 1119 A 37 THR HG2% A 35 ILE HA 1.0 0.0 5.45 1270 1120 A 35 ILE HA A 35 ILE HG2% 1.0 0.0 2.91 1271 1121 A 35 ILE HA A 35 ILE HG1y 1.0 0.0 3.43 1272 1122 A 58 ILE H A 29 VAL HA 1.0 0.0 3.80 1273 1123 A 29 VAL HA A 57 THR HA 1.0 0.0 3.09 1274 1124 A 29 VAL HA A 30 ASN HBx 1.0 0.0 5.48 1275 1125 A 29 VAL HA A 106 LYS HEx 1.0 0.0 5.50 1276 1125 A 29 VAL HA A 106 LYS HEy 1.0 0.0 5.50 1277 1126 A 30 ASN HBy A 29 VAL HA 1.0 0.0 4.62 1278 1127 A 29 VAL HA A 27 THR HG2% 1.0 0.0 4.13 1279 1128 A 77 TYR HD% A 77 TYR HA 1.0 0.0 3.63 1280 1129 A 25 ASN HA A 24 GLU HA 1.0 0.0 4.83 1281 1130 A 24 GLU HA A 25 ASN HBx 1.0 0.0 4.23 1282 1130 A 25 ASN HBy A 24 GLU HA 1.0 0.0 4.23 1283 1131 A 24 GLU HA A 24 GLU HGx 1.0 0.0 3.63 1284 1132 A 20 TRP HD1 A 92 VAL HA 1.0 0.0 4.60 1285 1133 A 92 VAL HA A 93 PRO HDy 1.0 0.0 2.94 1286 1134 A 92 VAL HA A 93 PRO HDx 1.0 0.0 3.10 1287 1135 A 92 VAL HA A 92 VAL HGx% 1.0 0.0 2.81 1288 1136 A 92 VAL HGy% A 92 VAL HA 1.0 0.0 3.31 1289 1137 A 93 PRO HGx A 92 VAL HA 1.0 0.0 4.68 1290 1138 A 15 ASN HA A 16 GLN HA 1.0 0.0 4.66 1291 1139 A 17 TYR HA A 16 GLN HA 1.0 0.0 4.96 1292 1140 A 16 GLN HA A 16 GLN HBy 1.0 0.0 2.99 1293 1141 A 16 GLN HA A 16 GLN HBx 1.0 0.0 2.99 1294 1142 A 16 GLN HA A 16 GLN HGx 1.0 0.0 3.64 1295 1142 A 16 GLN HGy A 16 GLN HA 1.0 0.0 3.64 1296 1143 A 59 VAL H A 58 ILE HA 1.0 0.0 2.70 1297 1144 A 58 ILE HA A 59 VAL HA 1.0 0.0 4.61 1298 1145 A 58 ILE HA A 58 ILE HG1y 1.0 0.0 3.59 1299 1146 A 58 ILE HG1x A 58 ILE HA 1.0 0.0 3.81 1300 1147 A 58 ILE HA A 58 ILE HG2% 1.0 0.0 3.26 1301 1148 A 98 PRO HDx A 97 ILE HA 1.0 0.0 2.93 1302 1149 A 97 ILE HA A 97 ILE HG1y 1.0 0.0 3.24 1303 1150 A 102 TRP HE3 A 86 VAL HA 1.0 0.0 3.36 1304 1151 A 35 ILE HD1% A 86 VAL HA 1.0 0.0 3.58 1305 1152 A 86 VAL HA A 86 VAL HGy% 1.0 0.0 3.47 1306 1153 A 9 THR HG2% A 9 THR HA 1.0 0.0 3.21 1307 1154 A 38 ARG HA A 48 VAL HA 1.0 0.0 3.38 1308 1155 A 48 VAL HA A 38 ARG HDx 1.0 0.0 3.60 1309 1156 A 48 VAL HA A 38 ARG HGy 1.0 0.0 5.19 1310 1157 A 48 VAL HA A 47 PRO HBy 1.0 0.0 5.50 1311 1158 A 48 VAL HA A 48 VAL HGx% 1.0 0.0 2.68 1312 1158 A 48 VAL HGy% A 48 VAL HA 1.0 0.0 2.68 1313 1159 A 54 ALA H A 53 PRO HA 1.0 0.0 2.75 1314 1160 A 34 PRO HA A 53 PRO HA 1.0 0.0 3.75 1315 1161 A 34 PRO HBx A 53 PRO HA 1.0 0.0 3.47 1316 1162 A 34 PRO HBy A 53 PRO HA 1.0 0.0 4.01 1317 1163 A 54 ALA HB% A 53 PRO HA 1.0 0.0 4.89 1318 1164 A 37 THR HA A 85 PRO HDx 1.0 0.0 3.64 1319 1165 A 30 ASN HD2y A 34 PRO HA 1.0 0.0 4.30 1320 1166 A 65 ILE HA A 71 TRP H 1.0 0.0 4.61 1321 1167 A 71 TRP HD1 A 65 ILE HA 1.0 0.0 3.83 1322 1168 A 65 ILE HA A 65 ILE HG1y 1.0 0.0 3.34 1323 1169 A 71 TRP HD1 A 70 ILE HA 1.0 0.0 3.96 1324 1170 A 70 ILE HA A 65 ILE HG1x 1.0 0.0 4.27 1325 1171 A 70 ILE HG1y A 70 ILE HA 1.0 0.0 3.76 1326 1172 A 70 ILE HA A 65 ILE HG1y 1.0 0.0 3.15 1327 1173 A 70 ILE HA A 70 ILE HG2% 1.0 0.0 3.01 1328 1174 A 28 PHE H A 27 THR HA 1.0 0.0 2.84 1329 1175 A 58 ILE H A 57 THR HA 1.0 0.0 2.80 1330 1176 A 27 THR HA A 59 VAL HA 1.0 0.0 3.44 1331 1177 A 28 PHE HBx A 27 THR HA 1.0 0.0 4.66 1332 1178 A 58 ILE HB A 27 THR HA 1.0 0.0 5.25 1333 1179 A 57 THR HA A 57 THR HG2% 1.0 0.0 2.79 1334 1180 A 57 THR HA A 29 VAL HGy% 1.0 0.0 4.05 1335 1181 A 72 ILE HA A 74 TYR HD% 1.0 0.0 4.97 1336 1182 A 63 VAL HA A 72 ILE HA 1.0 0.0 3.34 1337 1183 A 72 ILE HA A 60 TYR HBy 1.0 0.0 4.32 1338 1184 A 72 ILE HA A 73 GLY HAx 1.0 0.0 4.52 1339 1185 A 72 ILE HA A 60 TYR HBx 1.0 0.0 4.76 1340 1186 A 72 ILE HA A 63 VAL HB 1.0 0.0 5.50 1341 1187 A 72 ILE HA A 72 ILE HD1% 1.0 0.0 4.17 1342 1188 A 63 VAL HA A 71 TRP H 1.0 0.0 4.76 1343 1189 A 63 VAL HA A 64 CYS HA 1.0 0.0 4.59 1344 1190 A 63 VAL HA A 62 GLU HGy 1.0 0.0 5.49 1345 1191 A 28 PHE H A 27 THR HB 1.0 0.0 4.58 1346 1192 A 27 THR HB A 26 ALA HA 1.0 0.0 4.89 1347 1193 A 27 THR HB A 106 LYS HA 1.0 0.0 5.45 1348 1194 A 27 THR HB A 106 LYS HBx 1.0 0.0 4.78 1349 1195 A 27 THR HB A 106 LYS HBy 1.0 0.0 3.76 1350 1196 A 56 ALA HB% A 57 THR HB 1.0 0.0 5.50 1351 1197 A 21 TYR HA A 21 TYR HD% 1.0 0.0 4.02 1352 1198 A 64 CYS HA A 65 ILE HG1x 1.0 0.0 4.27 1353 1199 A 64 CYS H A 63 VAL HA 1.0 0.0 2.95 1354 1200 A 72 ILE HA A 62 GLU HGx 1.0 0.0 5.50 1355 1201 A 72 ILE HA A 63 VAL HGy% 1.0 0.0 4.95 1356 1202 A 72 ILE HA A 70 ILE HG2% 1.0 0.0 5.44 1357 1203 A 25 ASN HA A 61 ASP H 1.0 0.0 5.50 1358 1204 A 51 ASN HA A 52 LEU H 1.0 0.0 2.92 1359 1205 A 51 ASN HA A 36 VAL HA 1.0 0.0 3.21 1360 1206 A 38 ARG HA A 38 ARG HDx 1.0 0.0 3.49 1361 1207 A 51 ASN HA A 36 VAL HGx% 1.0 0.0 4.09 1362 1208 A 38 ARG HA A 48 VAL HGx% 1.0 0.0 4.10 1363 1208 A 38 ARG HA A 48 VAL HGy% 1.0 0.0 4.10 1364 1209 A 39 ILE HD1% A 38 ARG HA 1.0 0.0 5.42 1365 1210 A 38 ARG HA A 82 VAL HGx% 1.0 0.0 5.50 1366 1211 A 38 ARG HA A 39 ILE HG1x 1.0 0.0 4.34 1367 1212 A 70 ILE HA A 71 TRP H 1.0 0.0 3.10 1368 1213 A 62 GLU HA A 62 GLU HGx 1.0 0.0 3.62 1369 1214 A 74 TYR HE% A 73 GLY HAy 1.0 0.0 5.08 1370 1215 A 27 THR H A 26 ALA HA 1.0 0.0 3.09 1371 1216 A 105 PHE H A 104 VAL HA 1.0 0.0 2.69 1372 1217 A 105 PHE HD% A 104 VAL HA 1.0 0.0 4.63 1373 1218 A 104 VAL HA A 104 VAL HGx% 1.0 0.0 2.95 1374 1219 A 50 GLY HAy A 48 VAL HGx% 1.0 0.0 4.37 1375 1219 A 48 VAL HGy% A 50 GLY HAy 1.0 0.0 4.37 1376 1220 A 30 ASN HBx A 54 ALA HA 1.0 0.0 3.93 1377 1221 A 57 THR HA A 56 ALA HA 1.0 0.0 4.69 1378 1222 A 85 PRO HA A 87 ARG H 1.0 0.0 4.12 1379 1223 A 69 HIS HD2 A 88 THR HA 1.0 0.0 3.97 1380 1224 A 69 HIS HA A 88 THR HA 1.0 0.0 3.32 1381 1225 A 66 GLN HBy A 19 THR HA 1.0 0.0 4.11 1382 1226 A 88 THR HG2% A 88 THR HA 1.0 0.0 3.01 1383 1227 A 32 ASN HA A 31 GLY HAy 1.0 0.0 4.63 1384 1228 A 35 ILE HB A 85 PRO HDx 1.0 0.0 4.55 1385 1229 A 71 TRP HE3 A 85 PRO HA 1.0 0.0 4.41 1386 1230 A 30 ASN HA A 29 VAL HA 1.0 0.0 4.70 1387 1231 A 69 HIS HA A 88 THR HB 1.0 0.0 4.53 1388 1232 A 90 GLN HA A 91 GLY HAx 1.0 0.0 4.54 1389 1233 A 92 VAL HGy% A 91 GLY HAx 1.0 0.0 4.17 1390 1234 A 103 GLY HAy A 28 PHE HD% 1.0 0.0 3.94 1391 1235 A 28 PHE HZ A 103 GLY HAy 1.0 0.0 4.34 1392 1236 A 103 GLY HAy A 104 VAL HGy% 1.0 0.0 5.50 1393 1237 A 24 GLU HA A 24 GLU HGy 1.0 0.0 3.63 1394 1238 A 71 TRP HE3 A 85 PRO HDy 1.0 0.0 4.12 1395 1239 A 71 TRP HZ3 A 85 PRO HDy 1.0 0.0 3.84 1396 1240 A 84 CYS HA A 85 PRO HDy 1.0 0.0 3.35 1397 1241 A 85 PRO HDy A 38 ARG HGy 1.0 0.0 4.81 1398 1242 A 6 ARG HGy A 7 PRO HDy 1.0 0.0 3.70 1399 1242 A 7 PRO HDy A 6 ARG HGx 1.0 0.0 3.70 1400 1243 A 22 LYS HGx A 23 PRO HDx 1.0 0.0 5.03 1401 1244 A 22 LYS HBy A 23 PRO HDx 1.0 0.0 3.84 1402 1245 A 22 LYS HBx A 23 PRO HDx 1.0 0.0 4.58 1403 1246 A 37 THR HA A 85 PRO HDy 1.0 0.0 4.23 1404 1247 A 22 LYS HA A 23 PRO HDx 1.0 0.0 3.13 1405 1248 A 33 GLN H A 31 GLY HAy 1.0 0.0 5.11 1406 1249 A 54 ALA H A 34 PRO HDy 1.0 0.0 5.50 1407 1250 A 33 GLN H A 34 PRO HDx 1.0 0.0 5.05 1408 1251 A 28 PHE HZ A 102 TRP HBx 1.0 0.0 4.92 1409 1252 A 28 PHE HZ A 102 TRP HBy 1.0 0.0 5.09 1410 1253 A 102 TRP HBy A 103 GLY H 1.0 0.0 5.15 1411 1254 A 102 TRP HBx A 103 GLY H 1.0 0.0 4.92 1412 1255 A 23 PRO HDy A 22 LYS HBx 1.0 0.0 3.97 1413 1256 A 97 ILE HG1y A 98 PRO HDy 1.0 0.0 4.70 1414 1257 A 23 PRO HDy A 22 LYS HBy 1.0 0.0 3.41 1415 1258 A 23 PRO HDy A 22 LYS HA 1.0 0.0 3.21 1416 1259 A 23 PRO HDy A 22 LYS H 1.0 0.0 4.86 1417 1260 A 97 ILE H A 98 PRO HDy 1.0 0.0 4.57 1418 1261 A 23 PRO HDy A 22 LYS HGx 1.0 0.0 4.07 1419 1262 A 18 GLY H A 17 TYR HBy 1.0 0.0 4.49 1420 1263 A 18 GLY HAy A 14 LYS HDx 1.0 0.0 4.37 1421 1264 A 18 GLY HAy A 14 LYS HGx 1.0 0.0 4.24 1422 1265 A 95 ASN HD2y A 94 PRO HDx 1.0 0.0 5.12 1423 1265 A 94 PRO HDy A 95 ASN HD2y 1.0 0.0 5.12 1424 1266 A 39 ILE H A 38 ARG HDy 1.0 0.0 4.49 1425 1267 A 46 ALA H A 38 ARG HDx 1.0 0.0 5.27 1426 1268 A 38 ARG HA A 38 ARG HDy 1.0 0.0 3.75 1427 1269 A 48 VAL HA A 38 ARG HDy 1.0 0.0 4.01 1428 1270 A 38 ARG HDx A 38 ARG HBx 1.0 0.0 3.88 1429 1270 A 38 ARG HBy A 38 ARG HDx 1.0 0.0 3.88 1430 1271 A 38 ARG HDy A 38 ARG HBx 1.0 0.0 3.82 1431 1271 A 38 ARG HDy A 38 ARG HBy 1.0 0.0 3.82 1432 1272 A 46 ALA HB% A 38 ARG HDx 1.0 0.0 4.05 1433 1273 A 38 ARG HDy A 48 VAL HGx% 1.0 0.0 4.03 1434 1273 A 48 VAL HGy% A 38 ARG HDy 1.0 0.0 4.03 1435 1274 A 38 ARG HDx A 48 VAL HGx% 1.0 0.0 3.67 1436 1274 A 48 VAL HGy% A 38 ARG HDx 1.0 0.0 3.67 1437 1275 A 37 THR HA A 38 ARG HDx 1.0 0.0 5.50 1438 1276 A 6 ARG HA A 6 ARG HDx 1.0 0.0 4.08 1439 1276 A 6 ARG HA A 6 ARG HDy 1.0 0.0 4.08 1440 1277 A 6 ARG HDy A 6 ARG HGx 1.0 0.0 3.00 1441 1277 A 6 ARG HDx A 6 ARG HGx 1.0 0.0 3.00 1442 1277 A 6 ARG HGy A 6 ARG HDx 1.0 0.0 3.00 1443 1277 A 6 ARG HGy A 6 ARG HDy 1.0 0.0 3.00 1444 1278 A 6 ARG HDy A 6 ARG HBy 1.0 0.0 4.01 1445 1278 A 6 ARG HBy A 6 ARG HDx 1.0 0.0 4.01 1446 1279 A 78 ASN H A 77 TYR HBy 1.0 0.0 5.30 1447 1280 A 76 ALA HA A 77 TYR HBy 1.0 0.0 5.31 1448 1281 A 20 TRP HBx A 93 PRO HGy 1.0 0.0 4.27 1449 1282 A 46 ALA H A 43 PHE HBx 1.0 0.0 4.39 1450 1283 A 67 ALA HB% A 43 PHE HBx 1.0 0.0 4.34 1451 1284 A 46 ALA HB% A 43 PHE HBx 1.0 0.0 4.44 1452 1285 A 74 TYR H A 81 ARG HDy 1.0 0.0 5.50 1453 1286 A 81 ARG HBx A 81 ARG HDy 1.0 0.0 4.20 1454 1287 A 83 TYR HD% A 73 GLY HAx 1.0 0.0 5.34 1455 1288 A 28 PHE HBy A 29 VAL H 1.0 0.0 4.92 1456 1289 A 28 PHE HBy A 60 TYR HE% 1.0 0.0 4.38 1457 1290 A 28 PHE HBy A 58 ILE HB 1.0 0.0 4.31 1458 1291 A 74 TYR H A 81 ARG HDx 1.0 0.0 5.50 1459 1292 A 75 ASN HA A 81 ARG HDx 1.0 0.0 5.27 1460 1293 A 81 ARG HA A 81 ARG HDx 1.0 0.0 3.44 1461 1294 A 81 ARG HBy A 81 ARG HDx 1.0 0.0 4.09 1462 1295 A 56 ALA HB% A 30 ASN HBx 1.0 0.0 4.32 1463 1296 A 19 THR HB A 17 TYR HBx 1.0 0.0 5.20 1464 1297 A 28 PHE HBx A 60 TYR HE% 1.0 0.0 4.64 1465 1298 A 28 PHE HBx A 27 THR HG2% 1.0 0.0 4.75 1466 1299 A 14 LYS HEx A 14 LYS HGy 1.0 0.0 4.14 1467 1300 A 14 LYS HEy A 14 LYS HGy 1.0 0.0 4.14 1468 1301 A 82 VAL HA A 83 TYR HBy 1.0 0.0 5.50 1469 1302 A 99 GLY H A 87 ARG HDx 1.0 0.0 5.50 1470 1302 A 87 ARG HDy A 99 GLY H 1.0 0.0 5.50 1471 1303 A 102 TRP H A 87 ARG HDx 1.0 0.0 5.50 1472 1303 A 87 ARG HDy A 102 TRP H 1.0 0.0 5.50 1473 1304 A 39 ILE HD1% A 80 ASN HBy 1.0 0.0 4.17 1474 1305 A 43 PHE HA A 42 PRO HA 1.0 0.0 4.99 1475 1306 A 67 ALA HB% A 69 HIS HBx 1.0 0.0 4.79 1476 1307 A 71 TRP HZ2 A 69 HIS HBx 1.0 0.0 4.62 1477 1308 A 62 GLU H A 61 ASP HBx 1.0 0.0 4.76 1478 1309 A 47 PRO HBy A 48 VAL HGx% 1.0 0.0 5.50 1479 1309 A 48 VAL HGy% A 47 PRO HBy 1.0 0.0 5.50 1480 1310 A 49 GLY H A 38 ARG HGy 1.0 0.0 5.50 1481 1311 A 71 TRP HZ3 A 38 ARG HGy 1.0 0.0 3.92 1482 1312 A 93 PRO HA A 94 PRO HBy 1.0 0.0 4.87 1483 1313 A 9 THR HG2% A 94 PRO HBy 1.0 0.0 5.27 1484 1314 A 33 GLN HA A 33 GLN HGx 1.0 0.0 3.39 1485 1314 A 33 GLN HA A 33 GLN HGy 1.0 0.0 3.39 1486 1315 A 24 GLU HA A 23 PRO HGx 1.0 0.0 4.91 1487 1315 A 23 PRO HGy A 24 GLU HA 1.0 0.0 4.91 1488 1316 A 105 PHE HE% A 87 ARG HBx 1.0 0.0 5.10 1489 1317 A 102 TRP HBy A 87 ARG HBx 1.0 0.0 5.50 1490 1318 A 38 ARG HA A 48 VAL HB 1.0 0.0 5.50 1491 1319 A 36 VAL H A 52 LEU HBx 1.0 0.0 5.50 1492 1320 A 24 GLU HBy A 24 GLU HGy 1.0 0.0 2.89 1493 1320 A 24 GLU HBx A 24 GLU HGy 1.0 0.0 2.89 1494 1321 A 97 ILE HB A 90 GLN HBx 1.0 0.0 3.41 1495 1322 A 90 GLN HBx A 97 ILE HG1x 1.0 0.0 4.54 1496 1323 A 97 ILE HD1% A 90 GLN HBx 1.0 0.0 3.77 1497 1324 A 90 GLN HBx A 91 GLY HAy 1.0 0.0 5.50 1498 1325 A 90 GLN HBx A 91 GLY HAx 1.0 0.0 4.89 1499 1326 A 26 ALA H A 24 GLU HBx 1.0 0.0 5.50 1500 1326 A 24 GLU HBy A 26 ALA H 1.0 0.0 5.50 1501 1327 A 24 GLU H A 23 PRO HBx 1.0 0.0 4.63 1502 1328 A 63 VAL HB A 71 TRP H 1.0 0.0 5.50 1503 1329 A 90 GLN HBy A 97 ILE HG2% 1.0 0.0 3.75 1504 1330 A 35 ILE HA A 35 ILE HG1x 1.0 0.0 3.68 1505 1331 A 40 GLY HAx A 81 ARG HBy 1.0 0.0 5.50 1506 1332 A 38 ARG HGx A 48 VAL HGx% 1.0 0.0 5.50 1507 1332 A 48 VAL HGy% A 38 ARG HGx 1.0 0.0 5.50 1508 1333 A 58 ILE HB A 27 THR HG2% 1.0 0.0 4.91 1509 1334 A 30 ASN HD2x A 52 LEU HG 1.0 0.0 4.57 1510 1335 A 40 GLY H A 81 ARG HBx 1.0 0.0 4.90 1511 1336 A 87 ARG HGx A 70 ILE HG1x 1.0 0.0 3.89 1512 1337 A 105 PHE HE% A 87 ARG HGx 1.0 0.0 5.50 1513 1338 A 72 ILE HB A 73 GLY HAx 1.0 0.0 5.47 1514 1339 A 105 PHE H A 26 ALA HB% 1.0 0.0 5.50 1515 1340 A 35 ILE HG2% A 85 PRO HGy 1.0 0.0 3.49 1516 1341 A 71 TRP HZ3 A 85 PRO HGy 1.0 0.0 4.08 1517 1342 A 102 TRP HZ3 A 85 PRO HGy 1.0 0.0 4.54 1518 1343 A 13 LYS HDx A 13 LYS HGx 1.0 0.0 3.00 1519 1343 A 13 LYS HDy A 13 LYS HGx 1.0 0.0 3.00 1520 1343 A 13 LYS HGy A 13 LYS HDx 1.0 0.0 3.00 1521 1343 A 13 LYS HGy A 13 LYS HDy 1.0 0.0 3.00 1522 1344 A 14 LYS HBy A 14 LYS HDy 1.0 0.0 3.74 1523 1345 A 44 LEU HDx% A 44 LEU HBx 1.0 0.0 3.26 1524 1346 A 12 TRP HBy A 93 PRO HBx 1.0 0.0 5.29 1525 1347 A 96 GLN HBy A 90 GLN H 1.0 0.0 5.50 1526 1348 A 72 ILE HG1y A 84 CYS HBy 1.0 0.0 5.50 1527 1349 A 58 ILE HG1y A 30 ASN H 1.0 0.0 5.46 1528 1350 A 102 TRP HZ3 A 85 PRO HBx 1.0 0.0 3.85 1529 1351 A 14 LYS HBy A 14 LYS HDx 1.0 0.0 3.74 1530 1352 A 85 PRO HBx A 102 TRP HH2 1.0 0.0 4.38 1531 1353 A 71 TRP HA A 85 PRO HBx 1.0 0.0 5.50 1532 1354 A 51 ASN HD2x A 48 VAL HGx% 1.0 0.0 4.63 1533 1354 A 48 VAL HGy% A 51 ASN HD2x 1.0 0.0 4.63 1534 1355 A 47 PRO HA A 48 VAL HGx% 1.0 0.0 3.97 1535 1355 A 48 VAL HGy% A 47 PRO HA 1.0 0.0 3.97 1536 1356 A 49 GLY HAy A 48 VAL HGx% 1.0 0.0 4.83 1537 1356 A 48 VAL HGy% A 49 GLY HAy 1.0 0.0 4.83 1538 1357 A 51 ASN HA A 48 VAL HGx% 1.0 0.0 4.72 1539 1357 A 48 VAL HGy% A 51 ASN HA 1.0 0.0 4.72 1540 1358 A 58 ILE HG2% A 27 THR HG2% 1.0 0.0 4.72 1541 1359 A 20 TRP HZ3 A 8 VAL HGx% 1.0 0.0 4.56 1542 1359 A 8 VAL HGy% A 20 TRP HZ3 1.0 0.0 4.56 1543 1360 A 44 LEU HBy A 44 LEU HDy% 1.0 0.0 3.26 1544 1361 A 44 LEU HBx A 44 LEU HDy% 1.0 0.0 3.26 1545 1362 A 65 ILE HG2% A 65 ILE H 1.0 0.0 3.96 1546 1363 A 39 ILE HG2% A 82 VAL HA 1.0 0.0 4.01 1547 1364 A 58 ILE HG1x A 59 VAL H 1.0 0.0 5.38 1548 1365 A 20 TRP H A 92 VAL HGx% 1.0 0.0 4.76 1549 1366 A 70 ILE HD1% A 89 CYS HBx 1.0 0.0 4.07 1550 1367 A 97 ILE HG2% A 98 PRO HDy 1.0 0.0 3.81 1551 1368 A 22 LYS HBy A 12 TRP HA 1.0 0.0 4.06 1552 1369 A 12 TRP HH2 A 22 LYS HGx 1.0 0.0 5.36 1553 1370 A 83 TYR H A 82 VAL HGy% 1.0 0.0 4.32 1554 1371 A 22 LYS HGx A 24 GLU HBx 1.0 0.0 4.35 1555 1371 A 24 GLU HBy A 22 LYS HGx 1.0 0.0 4.35 1556 1372 A 28 PHE H A 58 ILE HG2% 1.0 0.0 4.07 1557 1373 A 12 TRP HBy A 93 PRO HBy 1.0 0.0 5.29 1558 1374 A 19 THR HG2% A 42 PRO HBx 1.0 0.0 4.38 1559 1374 A 42 PRO HBy A 19 THR HG2% 1.0 0.0 4.38 1560 1375 A 85 PRO HBy A 84 CYS HA 1.0 0.0 5.50 1561 1376 A 70 ILE HG2% A 87 ARG HGy 1.0 0.0 4.06 1562 1377 A 38 ARG H A 46 ALA HB% 1.0 0.0 5.50 1563 1378 A 40 GLY H A 46 ALA HB% 1.0 0.0 5.50 1564 1379 A 12 TRP HZ2 A 22 LYS HEx 1.0 0.0 4.06 1565 1379 A 22 LYS HEy A 12 TRP HZ2 1.0 0.0 4.06 1566 1380 A 12 TRP HZ2 A 63 VAL HGx% 1.0 0.0 4.81 1567 1381 A 65 ILE HD1% A 12 TRP HZ2 1.0 0.0 4.27 1568 1382 A 71 TRP HZ2 A 44 LEU HG 1.0 0.0 3.64 1569 1383 A 71 TRP HZ2 A 44 LEU HDx% 1.0 0.0 4.50 1570 1384 A 69 HIS HD2 A 102 TRP HZ2 1.0 0.0 4.50 1571 1385 A 20 TRP HZ2 A 14 LYS HBy 1.0 0.0 4.06 1572 1386 A 20 TRP HZ2 A 92 VAL HB 1.0 0.0 5.15 1573 1387 A 20 TRP HD1 A 92 VAL HB 1.0 0.0 3.85 1574 1388 A 20 TRP HD1 A 92 VAL HGy% 1.0 0.0 4.16 1575 1389 A 20 TRP HD1 A 93 PRO HDx 1.0 0.0 4.32 1576 1390 A 20 TRP HD1 A 65 ILE HB 1.0 0.0 4.23 1577 1391 A 102 TRP H A 102 TRP HD1 1.0 0.0 4.01 1578 1392 A 102 TRP HA A 102 TRP HD1 1.0 0.0 3.13 1579 1393 A 35 ILE HD1% A 102 TRP HD1 1.0 0.0 5.16 1580 1394 A 102 TRP HD1 A 100 VAL HGx% 1.0 0.0 3.76 1581 1394 A 100 VAL HGy% A 102 TRP HD1 1.0 0.0 3.76 1582 1395 A 71 TRP HD1 A 71 TRP H 1.0 0.0 3.46 1583 1396 A 12 TRP HD1 A 93 PRO HBx 1.0 0.0 4.38 1584 1397 A 12 TRP HD1 A 93 PRO HBy 1.0 0.0 4.38 1585 1398 A 69 HIS HD2 A 102 TRP HH2 1.0 0.0 3.50 1586 1399 A 102 TRP HZ3 A 69 HIS HD2 1.0 0.0 4.96 1587 1400 A 69 HIS HD2 A 69 HIS HA 1.0 0.0 4.32 1588 1401 A 69 HIS HD2 A 69 HIS HBx 1.0 0.0 3.82 1589 1402 A 69 HIS HD2 A 88 THR HG2% 1.0 0.0 3.64 1590 1403 A 69 HIS HD2 A 85 PRO HBx 1.0 0.0 4.46 1591 1404 A 71 TRP HE3 A 72 ILE H 1.0 0.0 4.33 1592 1405 A 71 TRP HE3 A 71 TRP HA 1.0 0.0 4.58 1593 1406 A 71 TRP HE3 A 83 TYR HBy 1.0 0.0 4.07 1594 1407 A 71 TRP HE3 A 83 TYR HBx 1.0 0.0 4.07 1595 1408 A 71 TRP HZ3 A 44 LEU HA 1.0 0.0 5.43 1596 1409 A 71 TRP HZ3 A 38 ARG HBx 1.0 0.0 4.00 1597 1409 A 71 TRP HZ3 A 38 ARG HBy 1.0 0.0 4.00 1598 1410 A 71 TRP HH2 A 38 ARG HGy 1.0 0.0 4.86 1599 1411 A 67 ALA HB% A 71 TRP HH2 1.0 0.0 5.50 1600 1412 A 71 TRP HH2 A 38 ARG HGx 1.0 0.0 4.14 1601 1413 A 14 LYS H A 20 TRP HZ3 1.0 0.0 4.38 1602 1414 A 20 TRP HZ3 A 13 LYS HA 1.0 0.0 4.07 1603 1415 A 20 TRP HZ3 A 12 TRP HBy 1.0 0.0 4.40 1604 1416 A 20 TRP HZ3 A 12 TRP HBx 1.0 0.0 4.40 1605 1417 A 20 TRP HE3 A 12 TRP HBy 1.0 0.0 3.75 1606 1418 A 20 TRP HE3 A 12 TRP HBx 1.0 0.0 3.75 1607 1419 A 20 TRP HE3 A 12 TRP HA 1.0 0.0 4.42 1608 1420 A 12 TRP HZ3 A 21 TYR HA 1.0 0.0 3.59 1609 1421 A 12 TRP HZ3 A 64 CYS HA 1.0 0.0 3.95 1610 1422 A 12 TRP HZ3 A 65 ILE HG1x 1.0 0.0 4.18 1611 1423 A 12 TRP HZ3 A 65 ILE HG1y 1.0 0.0 4.99 1612 1424 A 12 TRP HZ3 A 70 ILE HG2% 1.0 0.0 5.50 1613 1425 A 12 TRP HE3 A 20 TRP HE3 1.0 0.0 4.17 1614 1426 A 12 TRP HE3 A 21 TYR HA 1.0 0.0 3.98 1615 1427 A 12 TRP HE3 A 12 TRP HA 1.0 0.0 4.01 1616 1428 A 12 TRP HE3 A 20 TRP HBx 1.0 0.0 3.80 1617 1429 A 12 TRP HE3 A 22 LYS HBx 1.0 0.0 4.36 1618 1430 A 12 TRP HH2 A 65 ILE HG1x 1.0 0.0 4.07 1619 1431 A 105 PHE HD% A 105 PHE HA 1.0 0.0 3.79 1620 1432 A 105 PHE HD% A 106 LYS H 1.0 0.0 4.43 1621 1433 A 105 PHE HZ A 72 ILE HG2% 1.0 0.0 4.43 1622 1434 A 17 TYR HE% A 16 GLN HGx 1.0 0.0 3.81 1623 1434 A 16 GLN HGy A 17 TYR HE% 1.0 0.0 3.81 1624 1435 A 17 TYR HA A 17 TYR HD% 1.0 0.0 3.71 1625 1436 A 17 TYR HD% A 16 GLN HGx 1.0 0.0 3.82 1626 1436 A 16 GLN HGy A 17 TYR HD% 1.0 0.0 3.82 1627 1437 A 21 TYR HE% A 15 ASN HBx 1.0 0.0 4.16 1628 1438 A 21 TYR HE% A 13 LYS HBy 1.0 0.0 3.88 1629 1439 A 21 TYR HE% A 13 LYS HBx 1.0 0.0 3.88 1630 1440 A 21 TYR HD% A 14 LYS HA 1.0 0.0 4.54 1631 1441 A 22 LYS HA A 21 TYR HD% 1.0 0.0 4.80 1632 1442 A 19 THR HG2% A 21 TYR HD% 1.0 0.0 4.30 1633 1443 A 21 TYR HD% A 15 ASN H 1.0 0.0 4.25 1634 1444 A 84 CYS HBx A 74 TYR HE% 1.0 0.0 3.77 1635 1445 A 72 ILE HG1x A 74 TYR HE% 1.0 0.0 4.03 1636 1446 A 72 ILE HB A 74 TYR HE% 1.0 0.0 4.60 1637 1447 A 72 ILE HG1y A 74 TYR HE% 1.0 0.0 4.23 1638 1448 A 74 TYR HE% A 82 VAL HGx% 1.0 0.0 3.74 1639 1449 A 72 ILE HD1% A 74 TYR HE% 1.0 0.0 3.78 1640 1450 A 60 TYR HBx A 74 TYR HD% 1.0 0.0 4.19 1641 1451 A 72 ILE HG1x A 74 TYR HD% 1.0 0.0 4.13 1642 1452 A 74 TYR HD% A 72 ILE HB 1.0 0.0 4.17 1643 1453 A 72 ILE HG1y A 74 TYR HD% 1.0 0.0 4.64 1644 1454 A 74 TYR HD% A 82 VAL HB 1.0 0.0 4.14 1645 1455 A 43 PHE HA A 43 PHE HD% 1.0 0.0 4.11 1646 1456 A 43 PHE HD% A 41 SER HBy 1.0 0.0 4.03 1647 1457 A 43 PHE HD% A 66 GLN HGx 1.0 0.0 4.90 1648 1458 A 74 TYR HE% A 84 CYS HBy 1.0 0.0 3.66 1649 1459 A 28 PHE HZ A 30 ASN HD2x 1.0 0.0 5.50 1650 1460 A 20 TRP HBx A 12 TRP HZ3 1.0 0.0 4.57 1651 1461 A 12 TRP HZ3 A 20 TRP HBy 1.0 0.0 4.54 1652 1462 A 12 TRP HZ3 A 21 TYR HBy 1.0 0.0 5.50 1653 1463 A 12 TRP HH2 A 21 TYR HA 1.0 0.0 5.50 1654 1464 A 12 TRP HH2 A 64 CYS HA 1.0 0.0 5.50 1655 1465 A 12 TRP HH2 A 22 LYS HEx 1.0 0.0 4.37 1656 1465 A 12 TRP HH2 A 22 LYS HEy 1.0 0.0 4.37 1657 1466 A 12 TRP HH2 A 63 VAL HB 1.0 0.0 4.56 1658 1467 A 12 TRP HE3 A 20 TRP HBy 1.0 0.0 4.35 1659 1468 A 12 TRP HD1 A 11 SER HA 1.0 0.0 5.33 1660 1469 A 60 TYR HE% A 60 TYR H 1.0 0.0 4.48 1661 1470 A 83 TYR HD% A 38 ARG HBx 1.0 0.0 4.96 1662 1470 A 83 TYR HD% A 38 ARG HBy 1.0 0.0 4.96 1663 1471 A 37 THR HA A 38 ARG H 1.0 0.0 3.21 1664 1472 A 38 ARG H A 37 THR HB 1.0 0.0 3.16 1665 1473 A 38 ARG H A 38 ARG HGy 1.0 0.0 4.38 1666 1474 A 38 ARG H A 38 ARG HBx 1.0 0.0 3.56 1667 1474 A 38 ARG H A 38 ARG HBy 1.0 0.0 3.56 1668 1475 A 38 ARG H A 38 ARG HGx 1.0 0.0 4.37 1669 1476 A 64 CYS H A 71 TRP H 1.0 0.0 3.73 1670 1477 A 64 CYS H A 72 ILE HA 1.0 0.0 4.21 1671 1478 A 64 CYS H A 70 ILE HA 1.0 0.0 5.26 1672 1479 A 64 CYS H A 64 CYS HBy 1.0 0.0 4.17 1673 1480 A 64 CYS H A 64 CYS HBx 1.0 0.0 4.17 1674 1481 A 64 CYS H A 62 GLU HBx 1.0 0.0 5.50 1675 1482 A 64 CYS H A 63 VAL HB 1.0 0.0 4.29 1676 1483 A 64 CYS H A 70 ILE HG2% 1.0 0.0 4.02 1677 1484 A 40 GLY H A 83 TYR H 1.0 0.0 5.05 1678 1485 A 40 GLY H A 81 ARG H 1.0 0.0 5.13 1679 1486 A 40 GLY H A 82 VAL H 1.0 0.0 5.50 1680 1487 A 40 GLY H A 39 ILE HA 1.0 0.0 2.90 1681 1488 A 40 GLY H A 81 ARG HBy 1.0 0.0 4.67 1682 1489 A 40 GLY H A 39 ILE HG1y 1.0 0.0 4.44 1683 1490 A 40 GLY H A 39 ILE HG1x 1.0 0.0 5.28 1684 1491 A 104 VAL H A 29 VAL H 1.0 0.0 3.72 1685 1492 A 30 ASN HA A 104 VAL H 1.0 0.0 4.65 1686 1493 A 104 VAL H A 103 GLY HAy 1.0 0.0 3.15 1687 1494 A 104 VAL H A 29 VAL HB 1.0 0.0 3.62 1688 1495 A 70 ILE H A 69 HIS H 1.0 0.0 4.50 1689 1496 A 87 ARG H A 70 ILE H 1.0 0.0 4.23 1690 1497 A 70 ILE H A 88 THR HA 1.0 0.0 4.06 1691 1498 A 70 ILE H A 69 HIS HBx 1.0 0.0 3.55 1692 1499 A 70 ILE HG1y A 70 ILE H 1.0 0.0 3.74 1693 1500 A 70 ILE HB A 70 ILE H 1.0 0.0 3.43 1694 1501 A 70 ILE HG2% A 70 ILE H 1.0 0.0 4.06 1695 1502 A 70 ILE HD1% A 70 ILE H 1.0 0.0 4.25 1696 1503 A 67 ALA H A 68 GLY H 1.0 0.0 4.10 1697 1504 A 69 HIS HA A 68 GLY H 1.0 0.0 5.45 1698 1505 A 67 ALA HB% A 68 GLY H 1.0 0.0 4.24 1699 1506 A 21 TYR H A 13 LYS H 1.0 0.0 3.70 1700 1507 A 12 TRP HE3 A 21 TYR H 1.0 0.0 4.15 1701 1508 A 20 TRP HE3 A 21 TYR H 1.0 0.0 4.57 1702 1509 A 21 TYR H A 21 TYR HD% 1.0 0.0 3.47 1703 1510 A 21 TYR H A 20 TRP HA 1.0 0.0 3.16 1704 1511 A 20 TRP HBx A 21 TYR H 1.0 0.0 4.15 1705 1512 A 21 TYR H A 21 TYR HBy 1.0 0.0 4.15 1706 1513 A 21 TYR H A 14 LYS HBy 1.0 0.0 5.50 1707 1514 A 21 TYR H A 22 LYS HBx 1.0 0.0 5.50 1708 1515 A 20 TRP HE1 A 18 GLY HAy 1.0 0.0 5.50 1709 1516 A 20 TRP HBy A 20 TRP HE1 1.0 0.0 4.94 1710 1517 A 20 TRP HE1 A 14 LYS HEx 1.0 0.0 4.90 1711 1518 A 92 VAL HB A 20 TRP HE1 1.0 0.0 3.51 1712 1519 A 93 PRO HDx A 20 TRP HE1 1.0 0.0 4.58 1713 1520 A 92 VAL HGx% A 20 TRP HE1 1.0 0.0 3.19 1714 1521 A 92 VAL HGy% A 20 TRP HE1 1.0 0.0 3.32 1715 1522 A 87 ARG HA A 102 TRP HE1 1.0 0.0 4.05 1716 1523 A 88 THR HG2% A 102 TRP HE1 1.0 0.0 4.64 1717 1524 A 102 TRP HE1 A 100 VAL HGx% 1.0 0.0 3.86 1718 1524 A 100 VAL HGy% A 102 TRP HE1 1.0 0.0 3.86 1719 1525 A 71 TRP H A 70 ILE H 1.0 0.0 4.85 1720 1526 A 70 ILE HG1y A 71 TRP H 1.0 0.0 4.49 1721 1527 A 70 ILE HB A 71 TRP H 1.0 0.0 4.76 1722 1528 A 71 TRP H A 63 VAL HGx% 1.0 0.0 5.50 1723 1529 A 70 ILE HG2% A 71 TRP H 1.0 0.0 3.28 1724 1530 A 70 ILE HD1% A 71 TRP H 1.0 0.0 5.03 1725 1531 A 65 ILE HD1% A 71 TRP H 1.0 0.0 5.50 1726 1532 A 71 TRP HE3 A 84 CYS H 1.0 0.0 4.62 1727 1533 A 74 TYR HE% A 84 CYS H 1.0 0.0 4.24 1728 1534 A 83 TYR HA A 84 CYS H 1.0 0.0 3.07 1729 1535 A 84 CYS H A 73 GLY HAy 1.0 0.0 4.81 1730 1536 A 85 PRO HA A 84 CYS H 1.0 0.0 5.35 1731 1537 A 84 CYS H A 85 PRO HDx 1.0 0.0 5.50 1732 1538 A 84 CYS HBx A 84 CYS H 1.0 0.0 3.60 1733 1539 A 84 CYS H A 83 TYR HBy 1.0 0.0 4.53 1734 1540 A 84 CYS HBy A 84 CYS H 1.0 0.0 3.74 1735 1541 A 72 ILE HG1x A 84 CYS H 1.0 0.0 3.99 1736 1542 A 37 THR HG2% A 84 CYS H 1.0 0.0 5.07 1737 1543 A 72 ILE HG1y A 84 CYS H 1.0 0.0 4.14 1738 1544 A 72 ILE HD1% A 84 CYS H 1.0 0.0 4.33 1739 1545 A 58 ILE H A 57 THR HB 1.0 0.0 4.20 1740 1546 A 28 PHE HBx A 58 ILE H 1.0 0.0 4.57 1741 1547 A 58 ILE HB A 58 ILE H 1.0 0.0 3.48 1742 1548 A 58 ILE H A 27 THR HG2% 1.0 0.0 3.51 1743 1549 A 58 ILE HG1x A 58 ILE H 1.0 0.0 4.19 1744 1550 A 58 ILE H A 29 VAL HGx% 1.0 0.0 5.50 1745 1551 A 58 ILE HD1% A 58 ILE H 1.0 0.0 4.09 1746 1552 A 28 PHE HBy A 28 PHE H 1.0 0.0 3.85 1747 1553 A 28 PHE HBx A 28 PHE H 1.0 0.0 3.60 1748 1554 A 28 PHE H A 27 THR HG2% 1.0 0.0 3.14 1749 1555 A 28 PHE HA A 106 LYS H 1.0 0.0 4.64 1750 1556 A 106 LYS H A 27 THR HB 1.0 0.0 4.19 1751 1557 A 106 LYS H A 105 PHE HBx 1.0 0.0 4.16 1752 1558 A 106 LYS H A 106 LYS HBx 1.0 0.0 4.13 1753 1559 A 106 LYS H A 106 LYS HBy 1.0 0.0 3.94 1754 1560 A 106 LYS H A 106 LYS HGx 1.0 0.0 3.66 1755 1560 A 106 LYS H A 106 LYS HGy 1.0 0.0 3.66 1756 1561 A 106 LYS H A 27 THR HG2% 1.0 0.0 4.41 1757 1562 A 12 TRP HZ3 A 65 ILE H 1.0 0.0 4.17 1758 1563 A 64 CYS HA A 65 ILE H 1.0 0.0 3.09 1759 1564 A 20 TRP HBx A 65 ILE H 1.0 0.0 4.90 1760 1565 A 65 ILE H A 64 CYS HBy 1.0 0.0 4.36 1761 1566 A 65 ILE H A 64 CYS HBx 1.0 0.0 4.36 1762 1567 A 65 ILE HB A 65 ILE H 1.0 0.0 3.48 1763 1568 A 65 ILE HG1x A 65 ILE H 1.0 0.0 3.91 1764 1569 A 19 THR HG2% A 65 ILE H 1.0 0.0 3.71 1765 1570 A 65 ILE HG1y A 65 ILE H 1.0 0.0 4.26 1766 1571 A 65 ILE HD1% A 65 ILE H 1.0 0.0 4.34 1767 1572 A 101 ALA H A 102 TRP HD1 1.0 0.0 5.50 1768 1573 A 105 PHE HE% A 101 ALA H 1.0 0.0 5.50 1769 1574 A 101 ALA H A 100 VAL HA 1.0 0.0 2.67 1770 1575 A 101 ALA H A 100 VAL HB 1.0 0.0 4.36 1771 1576 A 101 ALA H A 100 VAL HGx% 1.0 0.0 3.20 1772 1576 A 100 VAL HGy% A 101 ALA H 1.0 0.0 3.20 1773 1577 A 82 VAL H A 76 ALA H 1.0 0.0 4.97 1774 1578 A 82 VAL H A 81 ARG HA 1.0 0.0 2.96 1775 1579 A 82 VAL H A 81 ARG HDy 1.0 0.0 4.33 1776 1580 A 82 VAL H A 81 ARG HDx 1.0 0.0 4.33 1777 1581 A 82 VAL H A 81 ARG HBy 1.0 0.0 4.54 1778 1582 A 82 VAL H A 81 ARG HGx 1.0 0.0 4.06 1779 1583 A 28 PHE HBx A 29 VAL H 1.0 0.0 4.56 1780 1584 A 29 VAL H A 104 VAL HB 1.0 0.0 4.66 1781 1585 A 29 VAL H A 29 VAL HB 1.0 0.0 3.41 1782 1586 A 29 VAL H A 106 LYS HGx 1.0 0.0 5.44 1783 1586 A 29 VAL H A 106 LYS HGy 1.0 0.0 5.44 1784 1587 A 29 VAL H A 27 THR HG2% 1.0 0.0 4.43 1785 1588 A 29 VAL H A 29 VAL HGy% 1.0 0.0 3.86 1786 1589 A 36 VAL H A 52 LEU H 1.0 0.0 5.08 1787 1590 A 36 VAL H A 37 THR H 1.0 0.0 4.83 1788 1591 A 35 ILE HA A 36 VAL H 1.0 0.0 2.81 1789 1592 A 36 VAL H A 36 VAL HB 1.0 0.0 2.98 1790 1593 A 35 ILE HG2% A 36 VAL H 1.0 0.0 3.05 1791 1594 A 30 ASN H A 56 ALA H 1.0 0.0 4.29 1792 1595 A 30 ASN HD2x A 30 ASN H 1.0 0.0 5.01 1793 1596 A 30 ASN H A 57 THR HA 1.0 0.0 4.28 1794 1597 A 29 VAL HA A 30 ASN H 1.0 0.0 2.80 1795 1598 A 30 ASN H A 55 GLY HAx 1.0 0.0 5.04 1796 1598 A 30 ASN H A 55 GLY HAy 1.0 0.0 5.04 1797 1599 A 30 ASN H A 30 ASN HBx 1.0 0.0 3.36 1798 1600 A 30 ASN HBy A 30 ASN H 1.0 0.0 3.21 1799 1601 A 30 ASN H A 52 LEU HDx% 1.0 0.0 5.36 1800 1602 A 30 ASN H A 52 LEU HDy% 1.0 0.0 5.36 1801 1603 A 58 ILE HG1x A 30 ASN H 1.0 0.0 5.50 1802 1604 A 30 ASN H A 29 VAL HGy% 1.0 0.0 4.28 1803 1605 A 66 GLN H A 71 TRP HE1 1.0 0.0 3.77 1804 1606 A 66 GLN H A 65 ILE H 1.0 0.0 4.57 1805 1607 A 66 GLN H A 71 TRP H 1.0 0.0 5.07 1806 1608 A 71 TRP HD1 A 66 GLN H 1.0 0.0 3.65 1807 1609 A 66 GLN H A 65 ILE HA 1.0 0.0 2.92 1808 1610 A 66 GLN H A 66 GLN HBy 1.0 0.0 4.14 1809 1611 A 66 GLN H A 66 GLN HBx 1.0 0.0 4.14 1810 1612 A 65 ILE HB A 66 GLN H 1.0 0.0 4.58 1811 1613 A 66 GLN H A 19 THR HG2% 1.0 0.0 4.30 1812 1614 A 66 GLN H A 65 ILE HG2% 1.0 0.0 3.31 1813 1615 A 77 TYR H A 76 ALA H 1.0 0.0 5.07 1814 1616 A 75 ASN HA A 76 ALA H 1.0 0.0 2.81 1815 1617 A 76 ALA H A 75 ASN HBy 1.0 0.0 4.34 1816 1618 A 76 ALA H A 75 ASN HBx 1.0 0.0 4.34 1817 1619 A 76 ALA HB% A 76 ALA H 1.0 0.0 2.84 1818 1620 A 82 VAL HB A 76 ALA H 1.0 0.0 5.43 1819 1621 A 60 TYR HD% A 60 TYR H 1.0 0.0 4.10 1820 1622 A 27 THR HA A 60 TYR H 1.0 0.0 3.67 1821 1623 A 59 VAL HA A 60 TYR H 1.0 0.0 3.03 1822 1624 A 60 TYR H A 59 VAL HB 1.0 0.0 4.73 1823 1625 A 60 TYR H A 59 VAL HGx% 1.0 0.0 4.48 1824 1626 A 58 ILE HG2% A 60 TYR H 1.0 0.0 4.02 1825 1627 A 54 ALA H A 34 PRO HA 1.0 0.0 4.21 1826 1628 A 54 ALA H A 34 PRO HDx 1.0 0.0 4.65 1827 1629 A 54 ALA H A 53 PRO HBx 1.0 0.0 4.14 1828 1630 A 34 PRO HBx A 54 ALA H 1.0 0.0 3.95 1829 1631 A 53 PRO HBy A 54 ALA H 1.0 0.0 3.65 1830 1632 A 54 ALA H A 34 PRO HBy 1.0 0.0 5.13 1831 1633 A 54 ALA HB% A 54 ALA H 1.0 0.0 2.68 1832 1634 A 19 THR H A 15 ASN H 1.0 0.0 4.10 1833 1635 A 21 TYR HE% A 15 ASN H 1.0 0.0 4.01 1834 1636 A 15 ASN H A 14 LYS HA 1.0 0.0 3.44 1835 1637 A 19 THR HB A 15 ASN H 1.0 0.0 4.48 1836 1638 A 15 ASN H A 15 ASN HBy 1.0 0.0 4.12 1837 1639 A 15 ASN H A 15 ASN HBx 1.0 0.0 4.12 1838 1640 A 19 THR HG2% A 15 ASN H 1.0 0.0 5.50 1839 1641 A 15 ASN H A 14 LYS HGy 1.0 0.0 3.67 1840 1642 A 15 ASN H A 14 LYS HGx 1.0 0.0 3.67 1841 1643 A 14 LYS HBx A 15 ASN H 1.0 0.0 3.94 1842 1644 A 96 GLN H A 95 ASN H 1.0 0.0 3.72 1843 1645 A 95 ASN H A 93 PRO HA 1.0 0.0 3.36 1844 1646 A 95 ASN H A 94 PRO HDx 1.0 0.0 3.81 1845 1646 A 95 ASN H A 94 PRO HDy 1.0 0.0 3.81 1846 1647 A 95 ASN H A 95 ASN HBy 1.0 0.0 3.71 1847 1648 A 95 ASN H A 95 ASN HBx 1.0 0.0 3.71 1848 1649 A 95 ASN H A 93 PRO HBx 1.0 0.0 4.78 1849 1650 A 95 ASN H A 96 GLN HBx 1.0 0.0 4.96 1850 1651 A 95 ASN H A 93 PRO HBy 1.0 0.0 4.78 1851 1652 A 61 ASP H A 62 GLU H 1.0 0.0 3.04 1852 1653 A 60 TYR HD% A 62 GLU H 1.0 0.0 3.65 1853 1654 A 60 TYR HE% A 62 GLU H 1.0 0.0 4.31 1854 1655 A 60 TYR HBy A 62 GLU H 1.0 0.0 3.89 1855 1656 A 62 GLU H A 61 ASP HBy 1.0 0.0 4.76 1856 1657 A 60 TYR HBx A 62 GLU H 1.0 0.0 4.64 1857 1658 A 62 GLU H A 62 GLU HGx 1.0 0.0 4.94 1858 1659 A 62 GLU H A 62 GLU HGy 1.0 0.0 4.87 1859 1660 A 62 GLU HBx A 62 GLU H 1.0 0.0 3.87 1860 1661 A 62 GLU HBy A 62 GLU H 1.0 0.0 3.64 1861 1662 A 72 ILE HB A 62 GLU H 1.0 0.0 4.59 1862 1663 A 72 ILE HD1% A 62 GLU H 1.0 0.0 5.50 1863 1664 A 72 ILE HG2% A 62 GLU H 1.0 0.0 4.78 1864 1665 A 59 VAL H A 58 ILE H 1.0 0.0 4.70 1865 1666 A 59 VAL H A 60 TYR H 1.0 0.0 4.51 1866 1667 A 59 VAL H A 58 ILE HG2% 1.0 0.0 3.44 1867 1668 A 97 ILE H A 91 GLY H 1.0 0.0 5.21 1868 1669 A 97 ILE H A 90 GLN H 1.0 0.0 3.84 1869 1670 A 97 ILE H A 98 PRO HDx 1.0 0.0 4.41 1870 1671 A 97 ILE H A 90 GLN HBx 1.0 0.0 4.21 1871 1672 A 97 ILE H A 96 GLN HGy 1.0 0.0 4.23 1872 1673 A 97 ILE H A 97 ILE HB 1.0 0.0 3.43 1873 1674 A 97 ILE H A 97 ILE HG1x 1.0 0.0 3.56 1874 1675 A 97 ILE H A 96 GLN HBy 1.0 0.0 3.74 1875 1676 A 97 ILE H A 97 ILE HG1y 1.0 0.0 4.24 1876 1677 A 63 VAL H A 23 PRO HA 1.0 0.0 5.27 1877 1678 A 63 VAL H A 62 GLU HBx 1.0 0.0 3.99 1878 1679 A 63 VAL H A 24 GLU HBx 1.0 0.0 4.04 1879 1679 A 24 GLU HBy A 63 VAL H 1.0 0.0 4.04 1880 1680 A 63 VAL H A 22 LYS HGx 1.0 0.0 4.54 1881 1681 A 96 GLN H A 93 PRO HA 1.0 0.0 3.48 1882 1682 A 96 GLN H A 95 ASN HBy 1.0 0.0 4.84 1883 1683 A 96 GLN H A 95 ASN HBx 1.0 0.0 4.84 1884 1684 A 96 GLN H A 96 GLN HBy 1.0 0.0 3.76 1885 1685 A 96 GLN H A 96 GLN HBx 1.0 0.0 3.47 1886 1686 A 96 GLN H A 93 PRO HBy 1.0 0.0 4.78 1887 1687 A 12 TRP HE3 A 13 LYS H 1.0 0.0 4.31 1888 1688 A 20 TRP HE3 A 13 LYS H 1.0 0.0 4.60 1889 1689 A 12 TRP HA A 13 LYS H 1.0 0.0 2.90 1890 1690 A 13 LYS H A 12 TRP HBy 1.0 0.0 4.37 1891 1691 A 13 LYS H A 12 TRP HBx 1.0 0.0 4.37 1892 1692 A 20 TRP HBx A 13 LYS H 1.0 0.0 5.03 1893 1693 A 13 LYS H A 13 LYS HBy 1.0 0.0 3.80 1894 1694 A 13 LYS H A 13 LYS HGx 1.0 0.0 3.73 1895 1694 A 13 LYS HGy A 13 LYS H 1.0 0.0 3.73 1896 1695 A 13 LYS H A 13 LYS HBx 1.0 0.0 3.80 1897 1696 A 22 LYS HBx A 13 LYS H 1.0 0.0 4.13 1898 1697 A 81 ARG H A 80 ASN HA 1.0 0.0 2.88 1899 1698 A 80 ASN HBy A 81 ARG H 1.0 0.0 4.11 1900 1699 A 80 ASN HBx A 81 ARG H 1.0 0.0 3.42 1901 1700 A 81 ARG H A 81 ARG HBy 1.0 0.0 3.40 1902 1701 A 81 ARG H A 81 ARG HBx 1.0 0.0 3.31 1903 1702 A 81 ARG HGx A 81 ARG H 1.0 0.0 4.71 1904 1703 A 39 ILE HG2% A 81 ARG H 1.0 0.0 4.14 1905 1704 A 102 TRP H A 101 ALA HA 1.0 0.0 2.90 1906 1705 A 102 TRP HBx A 102 TRP H 1.0 0.0 3.89 1907 1706 A 102 TRP HBy A 102 TRP H 1.0 0.0 3.39 1908 1707 A 102 TRP H A 87 ARG HBx 1.0 0.0 3.72 1909 1708 A 86 VAL HB A 102 TRP H 1.0 0.0 4.37 1910 1709 A 102 TRP H A 101 ALA HB% 1.0 0.0 3.29 1911 1710 A 35 ILE HD1% A 102 TRP H 1.0 0.0 4.72 1912 1711 A 102 TRP H A 100 VAL HGx% 1.0 0.0 4.63 1913 1711 A 102 TRP H A 100 VAL HGy% 1.0 0.0 4.63 1914 1712 A 102 TRP H A 86 VAL HGy% 1.0 0.0 4.61 1915 1713 A 101 ALA H A 100 VAL H 1.0 0.0 4.65 1916 1714 A 100 VAL H A 99 GLY HAy 1.0 0.0 3.14 1917 1715 A 100 VAL H A 99 GLY HAx 1.0 0.0 3.14 1918 1716 A 100 VAL HB A 100 VAL H 1.0 0.0 2.92 1919 1717 A 100 VAL H A 100 VAL HGx% 1.0 0.0 2.84 1920 1717 A 100 VAL HGy% A 100 VAL H 1.0 0.0 2.84 1921 1718 A 105 PHE HD% A 105 PHE H 1.0 0.0 3.95 1922 1719 A 105 PHE HE% A 105 PHE H 1.0 0.0 5.50 1923 1720 A 105 PHE H A 105 PHE HBy 1.0 0.0 3.35 1924 1721 A 104 VAL HB A 105 PHE H 1.0 0.0 3.47 1925 1722 A 49 GLY H A 48 VAL H 1.0 0.0 4.74 1926 1723 A 47 PRO HA A 48 VAL H 1.0 0.0 2.72 1927 1724 A 48 VAL H A 48 VAL HB 1.0 0.0 2.90 1928 1725 A 48 VAL H A 48 VAL HGx% 1.0 0.0 2.74 1929 1725 A 48 VAL HGy% A 48 VAL H 1.0 0.0 2.74 1930 1726 A 39 ILE H A 38 ARG H 1.0 0.0 4.81 1931 1727 A 40 GLY H A 39 ILE H 1.0 0.0 5.09 1932 1728 A 39 ILE H A 38 ARG HA 1.0 0.0 3.04 1933 1729 A 39 ILE H A 48 VAL HA 1.0 0.0 4.44 1934 1730 A 39 ILE H A 47 PRO HDx 1.0 0.0 4.72 1935 1730 A 39 ILE H A 47 PRO HDy 1.0 0.0 4.72 1936 1731 A 39 ILE H A 38 ARG HDx 1.0 0.0 4.38 1937 1732 A 39 ILE H A 38 ARG HGy 1.0 0.0 5.05 1938 1733 A 39 ILE H A 38 ARG HBx 1.0 0.0 3.60 1939 1733 A 39 ILE H A 38 ARG HBy 1.0 0.0 3.60 1940 1734 A 39 ILE HB A 39 ILE H 1.0 0.0 3.15 1941 1735 A 39 ILE H A 39 ILE HG1y 1.0 0.0 4.15 1942 1736 A 39 ILE H A 39 ILE HG1x 1.0 0.0 3.57 1943 1737 A 22 LYS H A 21 TYR HD% 1.0 0.0 4.34 1944 1738 A 12 TRP HZ3 A 22 LYS H 1.0 0.0 4.57 1945 1739 A 21 TYR HA A 22 LYS H 1.0 0.0 3.06 1946 1740 A 21 TYR HBx A 22 LYS H 1.0 0.0 4.12 1947 1741 A 22 LYS H A 21 TYR HBy 1.0 0.0 3.82 1948 1742 A 22 LYS H A 62 GLU HGy 1.0 0.0 4.17 1949 1743 A 22 LYS H A 24 GLU HBx 1.0 0.0 5.44 1950 1743 A 24 GLU HBy A 22 LYS H 1.0 0.0 5.44 1951 1744 A 63 VAL HB A 22 LYS H 1.0 0.0 5.50 1952 1745 A 22 LYS HBx A 22 LYS H 1.0 0.0 3.74 1953 1746 A 22 LYS HBy A 22 LYS H 1.0 0.0 4.06 1954 1747 A 22 LYS HGy A 22 LYS H 1.0 0.0 3.84 1955 1748 A 83 TYR H A 38 ARG H 1.0 0.0 3.74 1956 1749 A 83 TYR HD% A 83 TYR H 1.0 0.0 4.10 1957 1750 A 83 TYR H A 82 VAL HA 1.0 0.0 2.91 1958 1751 A 83 TYR H A 37 THR HB 1.0 0.0 4.66 1959 1752 A 83 TYR H A 83 TYR HBy 1.0 0.0 4.19 1960 1753 A 83 TYR H A 38 ARG HBx 1.0 0.0 4.11 1961 1753 A 83 TYR H A 38 ARG HBy 1.0 0.0 4.11 1962 1754 A 37 THR HG2% A 83 TYR H 1.0 0.0 5.50 1963 1755 A 83 TYR H A 82 VAL HGx% 1.0 0.0 4.32 1964 1756 A 22 LYS HGx A 22 LYS H 1.0 0.0 3.90 1965 1757 A 44 LEU H A 45 ASN H 1.0 0.0 3.57 1966 1758 A 44 LEU H A 71 TRP HZ2 1.0 0.0 4.81 1967 1759 A 44 LEU H A 71 TRP HH2 1.0 0.0 5.47 1968 1760 A 44 LEU H A 43 PHE HA 1.0 0.0 3.05 1969 1761 A 44 LEU H A 43 PHE HBx 1.0 0.0 3.61 1970 1762 A 44 LEU H A 43 PHE HBy 1.0 0.0 4.24 1971 1763 A 44 LEU H A 44 LEU HG 1.0 0.0 2.79 1972 1764 A 69 HIS H A 71 TRP HE1 1.0 0.0 4.12 1973 1765 A 69 HIS H A 68 GLY H 1.0 0.0 3.36 1974 1766 A 66 GLN H A 69 HIS H 1.0 0.0 3.86 1975 1767 A 69 HIS H A 69 HIS HBx 1.0 0.0 4.02 1976 1768 A 69 HIS HBy A 69 HIS H 1.0 0.0 3.49 1977 1769 A 65 ILE HG2% A 69 HIS H 1.0 0.0 4.30 1978 1770 A 73 GLY H A 74 TYR H 1.0 0.0 4.81 1979 1771 A 74 TYR H A 75 ASN H 1.0 0.0 4.54 1980 1772 A 82 VAL H A 74 TYR H 1.0 0.0 3.73 1981 1773 A 74 TYR HD% A 74 TYR H 1.0 0.0 3.59 1982 1774 A 74 TYR HE% A 74 TYR H 1.0 0.0 4.45 1983 1775 A 83 TYR HA A 74 TYR H 1.0 0.0 4.20 1984 1776 A 74 TYR H A 73 GLY HAy 1.0 0.0 3.12 1985 1777 A 74 TYR H A 81 ARG HA 1.0 0.0 5.16 1986 1778 A 82 VAL HA A 74 TYR H 1.0 0.0 5.50 1987 1779 A 74 TYR H A 73 GLY HAx 1.0 0.0 3.25 1988 1780 A 74 TYR H A 82 VAL HB 1.0 0.0 4.44 1989 1781 A 74 TYR H A 82 VAL HGy% 1.0 0.0 4.85 1990 1782 A 74 TYR HD% A 75 ASN H 1.0 0.0 4.00 1991 1783 A 74 TYR HA A 75 ASN H 1.0 0.0 3.24 1992 1784 A 74 TYR HBx A 75 ASN H 1.0 0.0 4.08 1993 1785 A 74 TYR HBy A 75 ASN H 1.0 0.0 3.23 1994 1786 A 75 ASN H A 75 ASN HBy 1.0 0.0 3.76 1995 1787 A 75 ASN H A 75 ASN HBx 1.0 0.0 3.76 1996 1788 A 60 TYR HD% A 61 ASP H 1.0 0.0 4.31 1997 1789 A 26 ALA H A 61 ASP H 1.0 0.0 5.50 1998 1790 A 60 TYR HE% A 61 ASP H 1.0 0.0 5.50 1999 1791 A 60 TYR HA A 61 ASP H 1.0 0.0 3.28 2000 1792 A 61 ASP H A 74 TYR HA 1.0 0.0 4.59 2001 1793 A 60 TYR HBy A 61 ASP H 1.0 0.0 3.59 2002 1794 A 74 TYR HBx A 61 ASP H 1.0 0.0 4.34 2003 1795 A 61 ASP H A 61 ASP HBy 1.0 0.0 4.16 2004 1796 A 60 TYR HBx A 61 ASP H 1.0 0.0 4.17 2005 1797 A 49 GLY H A 38 ARG HA 1.0 0.0 3.61 2006 1798 A 49 GLY H A 48 VAL HA 1.0 0.0 2.81 2007 1799 A 49 GLY H A 38 ARG HDx 1.0 0.0 4.78 2008 1800 A 49 GLY H A 48 VAL HB 1.0 0.0 4.10 2009 1801 A 37 THR HG2% A 49 GLY H 1.0 0.0 5.26 2010 1802 A 49 GLY H A 39 ILE HG1y 1.0 0.0 5.50 2011 1803 A 49 GLY H A 48 VAL HGx% 1.0 0.0 3.18 2012 1803 A 49 GLY H A 48 VAL HGy% 1.0 0.0 3.18 2013 1804 A 72 ILE H A 84 CYS H 1.0 0.0 3.86 2014 1805 A 72 ILE H A 71 TRP HA 1.0 0.0 3.30 2015 1806 A 72 ILE H A 71 TRP HBy 1.0 0.0 4.35 2016 1807 A 72 ILE H A 71 TRP HBx 1.0 0.0 4.35 2017 1808 A 72 ILE H A 84 CYS HBy 1.0 0.0 5.47 2018 1809 A 72 ILE H A 72 ILE HG1x 1.0 0.0 3.73 2019 1810 A 72 ILE H A 72 ILE HG1y 1.0 0.0 3.37 2020 1811 A 72 ILE H A 72 ILE HD1% 1.0 0.0 3.82 2021 1812 A 92 VAL H A 91 GLY H 1.0 0.0 4.65 2022 1813 A 91 GLY H A 90 GLN HA 1.0 0.0 3.09 2023 1814 A 91 GLY H A 90 GLN HGx 1.0 0.0 4.91 2024 1815 A 90 GLN HBx A 91 GLY H 1.0 0.0 4.54 2025 1816 A 90 GLN HBy A 91 GLY H 1.0 0.0 4.73 2026 1817 A 92 VAL HGx% A 91 GLY H 1.0 0.0 5.08 2027 1818 A 31 GLY H A 32 ASN H 1.0 0.0 4.30 2028 1819 A 31 GLY H A 30 ASN HA 1.0 0.0 2.99 2029 1820 A 31 GLY H A 103 GLY HAx 1.0 0.0 3.71 2030 1821 A 31 GLY H A 30 ASN HBy 1.0 0.0 4.39 2031 1822 A 31 GLY H A 35 ILE HG1y 1.0 0.0 5.35 2032 1823 A 57 THR H A 57 THR HB 1.0 0.0 3.71 2033 1824 A 57 THR H A 56 ALA HB% 1.0 0.0 3.07 2034 1825 A 58 ILE HD1% A 57 THR H 1.0 0.0 5.18 2035 1826 A 31 GLY HAy A 32 ASN H 1.0 0.0 3.52 2036 1827 A 31 GLY HAx A 32 ASN H 1.0 0.0 3.16 2037 1828 A 32 ASN H A 32 ASN HBx 1.0 0.0 3.07 2038 1828 A 32 ASN HBy A 32 ASN H 1.0 0.0 3.07 2039 1829 A 54 ALA HB% A 32 ASN H 1.0 0.0 4.50 2040 1830 A 28 PHE H A 27 THR H 1.0 0.0 4.72 2041 1831 A 106 LYS H A 27 THR H 1.0 0.0 3.94 2042 1832 A 27 THR H A 27 THR HB 1.0 0.0 3.05 2043 1833 A 27 THR H A 106 LYS HBx 1.0 0.0 5.30 2044 1834 A 27 THR H A 106 LYS HGx 1.0 0.0 4.18 2045 1834 A 27 THR H A 106 LYS HGy 1.0 0.0 4.18 2046 1835 A 72 ILE H A 73 GLY H 1.0 0.0 4.47 2047 1836 A 73 GLY H A 62 GLU H 1.0 0.0 4.12 2048 1837 A 73 GLY H A 63 VAL HA 1.0 0.0 4.20 2049 1838 A 73 GLY H A 72 ILE HA 1.0 0.0 3.07 2050 1839 A 73 GLY H A 60 TYR HBy 1.0 0.0 4.35 2051 1840 A 73 GLY H A 60 TYR HBx 1.0 0.0 5.25 2052 1841 A 73 GLY H A 62 GLU HGx 1.0 0.0 4.81 2053 1842 A 73 GLY H A 62 GLU HBx 1.0 0.0 4.61 2054 1843 A 73 GLY H A 72 ILE HB 1.0 0.0 3.73 2055 1844 A 88 THR H A 102 TRP HE1 1.0 0.0 5.14 2056 1845 A 88 THR H A 99 GLY H 1.0 0.0 4.23 2057 1846 A 88 THR H A 88 THR HB 1.0 0.0 4.19 2058 1847 A 88 THR H A 87 ARG HA 1.0 0.0 3.16 2059 1848 A 88 THR H A 87 ARG HBx 1.0 0.0 3.86 2060 1849 A 88 THR H A 87 ARG HBy 1.0 0.0 3.40 2061 1850 A 88 THR H A 88 THR HG2% 1.0 0.0 3.02 2062 1851 A 88 THR H A 100 VAL HGx% 1.0 0.0 4.90 2063 1851 A 88 THR H A 100 VAL HGy% 1.0 0.0 4.90 2064 1852 A 99 GLY H A 89 CYS H 1.0 0.0 5.50 2065 1853 A 90 GLN H A 99 GLY H 1.0 0.0 5.50 2066 1854 A 98 PRO HA A 99 GLY H 1.0 0.0 2.88 2067 1855 A 98 PRO HBy A 99 GLY H 1.0 0.0 3.97 2068 1856 A 98 PRO HBx A 99 GLY H 1.0 0.0 4.10 2069 1857 A 87 ARG HGx A 99 GLY H 1.0 0.0 4.17 2070 1858 A 99 GLY H A 87 ARG HBy 1.0 0.0 4.09 2071 1859 A 70 ILE HD1% A 99 GLY H 1.0 0.0 4.23 2072 1860 A 86 VAL H A 71 TRP HA 1.0 0.0 3.85 2073 1861 A 86 VAL H A 87 ARG HGy 1.0 0.0 4.64 2074 1862 A 86 VAL H A 70 ILE HB 1.0 0.0 4.48 2075 1863 A 86 VAL H A 72 ILE HG1y 1.0 0.0 4.92 2076 1864 A 78 ASN H A 79 GLY H 1.0 0.0 3.87 2077 1865 A 76 ALA HB% A 79 GLY H 1.0 0.0 3.88 2078 1866 A 92 VAL H A 91 GLY HAx 1.0 0.0 2.97 2079 1867 A 92 VAL H A 91 GLY HAy 1.0 0.0 3.09 2080 1868 A 92 VAL H A 92 VAL HB 1.0 0.0 4.20 2081 1869 A 93 PRO HDx A 92 VAL H 1.0 0.0 4.83 2082 1870 A 49 GLY H A 50 GLY H 1.0 0.0 3.51 2083 1871 A 37 THR H A 50 GLY H 1.0 0.0 4.66 2084 1872 A 50 GLY H A 48 VAL HB 1.0 0.0 4.61 2085 1873 A 50 GLY H A 48 VAL HGx% 1.0 0.0 2.95 2086 1873 A 48 VAL HGy% A 50 GLY H 1.0 0.0 2.95 2087 1874 A 39 ILE HD1% A 50 GLY H 1.0 0.0 5.27 2088 1875 A 30 ASN HD2x A 55 GLY H 1.0 0.0 4.14 2089 1876 A 55 GLY H A 55 GLY HAx 1.0 0.0 2.92 2090 1876 A 55 GLY H A 55 GLY HAy 1.0 0.0 2.92 2091 1877 A 55 GLY H A 30 ASN HBx 1.0 0.0 3.70 2092 1878 A 30 ASN HBy A 55 GLY H 1.0 0.0 4.16 2093 1879 A 43 PHE HA A 45 ASN H 1.0 0.0 4.57 2094 1880 A 43 PHE HBx A 45 ASN H 1.0 0.0 3.75 2095 1881 A 45 ASN H A 45 ASN HBy 1.0 0.0 4.18 2096 1882 A 45 ASN H A 45 ASN HBx 1.0 0.0 4.18 2097 1883 A 43 PHE HBy A 45 ASN H 1.0 0.0 3.97 2098 1884 A 46 ALA HB% A 45 ASN H 1.0 0.0 4.55 2099 1885 A 40 GLY H A 41 SER H 1.0 0.0 4.04 2100 1886 A 41 SER H A 81 ARG HBx 1.0 0.0 4.16 2101 1887 A 41 SER H A 42 PRO HDy 1.0 0.0 5.50 2102 1888 A 41 SER H A 42 PRO HDx 1.0 0.0 5.50 2103 1889 A 39 ILE HG2% A 41 SER H 1.0 0.0 5.17 2104 1890 A 78 ASN H A 77 TYR HBx 1.0 0.0 5.30 2105 1891 A 76 ALA HB% A 78 ASN H 1.0 0.0 4.48 2106 1892 A 37 THR H A 52 LEU H 1.0 0.0 4.50 2107 1893 A 37 THR H A 51 ASN H 1.0 0.0 5.50 2108 1894 A 37 THR H A 51 ASN HA 1.0 0.0 3.65 2109 1895 A 37 THR H A 37 THR HB 1.0 0.0 4.14 2110 1896 A 37 THR H A 36 VAL HA 1.0 0.0 2.78 2111 1897 A 37 THR H A 36 VAL HB 1.0 0.0 4.35 2112 1898 A 35 ILE HG2% A 37 THR H 1.0 0.0 5.41 2113 1899 A 37 THR H A 36 VAL HGx% 1.0 0.0 4.16 2114 1900 A 37 THR H A 48 VAL HGx% 1.0 0.0 3.65 2115 1900 A 48 VAL HGy% A 37 THR H 1.0 0.0 3.65 2116 1901 A 89 CYS H A 70 ILE H 1.0 0.0 4.27 2117 1902 A 89 CYS H A 69 HIS HA 1.0 0.0 3.87 2118 1903 A 89 CYS H A 88 THR HA 1.0 0.0 2.99 2119 1904 A 89 CYS H A 88 THR HB 1.0 0.0 2.92 2120 1905 A 89 CYS H A 89 CYS HBx 1.0 0.0 3.60 2121 1906 A 90 GLN HBy A 89 CYS H 1.0 0.0 5.47 2122 1907 A 19 THR H A 18 GLY H 1.0 0.0 3.23 2123 1908 A 19 THR H A 17 TYR HD% 1.0 0.0 5.27 2124 1909 A 19 THR H A 21 TYR HD% 1.0 0.0 5.50 2125 1910 A 19 THR H A 19 THR HB 1.0 0.0 3.02 2126 1911 A 19 THR H A 17 TYR HBy 1.0 0.0 4.37 2127 1912 A 19 THR H A 17 TYR HBx 1.0 0.0 4.37 2128 1913 A 19 THR HG2% A 19 THR H 1.0 0.0 3.87 2129 1914 A 33 GLN H A 32 ASN H 1.0 0.0 3.48 2130 1915 A 33 GLN HE2y A 33 GLN H 1.0 0.0 4.55 2131 1916 A 33 GLN H A 32 ASN HA 1.0 0.0 3.42 2132 1917 A 33 GLN H A 31 GLY HAx 1.0 0.0 3.85 2133 1918 A 33 GLN H A 32 ASN HBx 1.0 0.0 3.77 2134 1918 A 32 ASN HBy A 33 GLN H 1.0 0.0 3.77 2135 1919 A 33 GLN H A 33 GLN HGx 1.0 0.0 3.47 2136 1919 A 33 GLN HGy A 33 GLN H 1.0 0.0 3.47 2137 1920 A 33 GLN HBx A 33 GLN H 1.0 0.0 3.47 2138 1921 A 54 ALA HB% A 33 GLN H 1.0 0.0 3.41 2139 1922 A 76 ALA H A 80 ASN H 1.0 0.0 4.55 2140 1923 A 81 ARG H A 80 ASN H 1.0 0.0 4.76 2141 1924 A 79 GLY H A 80 ASN H 1.0 0.0 3.23 2142 1925 A 78 ASN H A 80 ASN H 1.0 0.0 4.22 2143 1926 A 80 ASN HBy A 80 ASN H 1.0 0.0 2.97 2144 1927 A 80 ASN HBx A 80 ASN H 1.0 0.0 3.75 2145 1928 A 18 GLY H A 17 TYR H 1.0 0.0 3.04 2146 1929 A 19 THR H A 17 TYR H 1.0 0.0 4.17 2147 1930 A 17 TYR HD% A 17 TYR H 1.0 0.0 3.60 2148 1931 A 17 TYR H A 17 TYR HBy 1.0 0.0 3.60 2149 1932 A 18 GLY HAy A 17 TYR H 1.0 0.0 5.04 2150 1933 A 17 TYR H A 17 TYR HBx 1.0 0.0 3.60 2151 1934 A 17 TYR H A 16 GLN HBy 1.0 0.0 4.26 2152 1935 A 17 TYR H A 16 GLN HBx 1.0 0.0 4.26 2153 1936 A 17 TYR H A 16 GLN HGx 1.0 0.0 3.47 2154 1936 A 16 GLN HGy A 17 TYR H 1.0 0.0 3.47 2155 1937 A 35 ILE H A 52 LEU H 1.0 0.0 3.59 2156 1938 A 35 ILE H A 36 VAL H 1.0 0.0 4.59 2157 1939 A 35 ILE H A 30 ASN HD2y 1.0 0.0 4.14 2158 1940 A 35 ILE H A 30 ASN HD2x 1.0 0.0 4.68 2159 1941 A 35 ILE H A 34 PRO HA 1.0 0.0 3.01 2160 1942 A 35 ILE H A 34 PRO HBx 1.0 0.0 3.79 2161 1943 A 35 ILE H A 52 LEU HBx 1.0 0.0 3.57 2162 1944 A 35 ILE H A 35 ILE HG1x 1.0 0.0 3.63 2163 1945 A 35 ILE H A 34 PRO HBy 1.0 0.0 3.76 2164 1946 A 35 ILE H A 35 ILE HG2% 1.0 0.0 3.99 2165 1947 A 14 LYS H A 21 TYR H 1.0 0.0 5.15 2166 1948 A 14 LYS H A 13 LYS H 1.0 0.0 4.57 2167 1949 A 14 LYS H A 15 ASN H 1.0 0.0 4.69 2168 1950 A 14 LYS H A 13 LYS HA 1.0 0.0 2.89 2169 1951 A 35 ILE H A 35 ILE HB 1.0 0.0 3.63 2170 1952 A 35 ILE H A 35 ILE HG1y 1.0 0.0 3.51 2171 1953 A 14 LYS H A 14 LYS HBy 1.0 0.0 3.21 2172 1954 A 14 LYS HBx A 14 LYS H 1.0 0.0 3.38 2173 1955 A 12 TRP HD1 A 12 TRP H 1.0 0.0 3.62 2174 1956 A 12 TRP H A 11 SER HBy 1.0 0.0 4.09 2175 1957 A 12 TRP H A 11 SER HBx 1.0 0.0 4.09 2176 1958 A 12 TRP H A 12 TRP HBy 1.0 0.0 3.87 2177 1959 A 12 TRP H A 12 TRP HBx 1.0 0.0 3.87 2178 1960 A 24 GLU H A 25 ASN H 1.0 0.0 4.46 2179 1961 A 24 GLU HA A 25 ASN H 1.0 0.0 2.80 2180 1962 A 25 ASN H A 25 ASN HBx 1.0 0.0 3.06 2181 1962 A 25 ASN HBy A 25 ASN H 1.0 0.0 3.06 2182 1963 A 25 ASN H A 24 GLU HBx 1.0 0.0 4.09 2183 1963 A 24 GLU HBy A 25 ASN H 1.0 0.0 4.09 2184 1964 A 26 ALA HB% A 25 ASN H 1.0 0.0 4.55 2185 1965 A 63 VAL H A 24 GLU H 1.0 0.0 4.33 2186 1966 A 24 GLU H A 62 GLU H 1.0 0.0 4.94 2187 1967 A 24 GLU H A 61 ASP HA 1.0 0.0 4.56 2188 1968 A 62 GLU HA A 24 GLU H 1.0 0.0 3.20 2189 1969 A 24 GLU H A 23 PRO HA 1.0 0.0 3.21 2190 1970 A 24 GLU H A 23 PRO HBy 1.0 0.0 4.63 2191 1971 A 24 GLU H A 23 PRO HGx 1.0 0.0 4.95 2192 1971 A 23 PRO HGy A 24 GLU H 1.0 0.0 4.95 2193 1972 A 24 GLU H A 24 GLU HBx 1.0 0.0 3.29 2194 1972 A 24 GLU HBy A 24 GLU H 1.0 0.0 3.29 2195 1973 A 62 GLU HBy A 24 GLU H 1.0 0.0 5.33 2196 1974 A 56 ALA H A 57 THR H 1.0 0.0 4.82 2197 1975 A 55 GLY H A 56 ALA H 1.0 0.0 3.62 2198 1976 A 30 ASN HD2x A 56 ALA H 1.0 0.0 4.28 2199 1977 A 56 ALA H A 55 GLY HAx 1.0 0.0 3.48 2200 1977 A 56 ALA H A 55 GLY HAy 1.0 0.0 3.48 2201 1978 A 56 ALA H A 30 ASN HBx 1.0 0.0 3.22 2202 1979 A 30 ASN HBy A 56 ALA H 1.0 0.0 3.75 2203 1980 A 56 ALA H A 53 PRO HBy 1.0 0.0 4.57 2204 1981 A 56 ALA H A 52 LEU HG 1.0 0.0 5.08 2205 1982 A 56 ALA H A 56 ALA HB% 1.0 0.0 2.74 2206 1983 A 56 ALA H A 52 LEU HDx% 1.0 0.0 4.47 2207 1984 A 56 ALA H A 52 LEU HDy% 1.0 0.0 4.47 2208 1985 A 60 TYR H A 26 ALA H 1.0 0.0 4.68 2209 1986 A 26 ALA H A 25 ASN H 1.0 0.0 4.42 2210 1987 A 26 ALA H A 25 ASN HA 1.0 0.0 2.73 2211 1988 A 26 ALA H A 24 GLU HGx 1.0 0.0 5.50 2212 1989 A 44 LEU H A 46 ALA H 1.0 0.0 4.64 2213 1990 A 46 ALA H A 45 ASN H 1.0 0.0 3.26 2214 1991 A 44 LEU HA A 46 ALA H 1.0 0.0 4.44 2215 1992 A 46 ALA H A 47 PRO HDx 1.0 0.0 4.83 2216 1992 A 47 PRO HDy A 46 ALA H 1.0 0.0 4.83 2217 1993 A 38 ARG HDy A 46 ALA H 1.0 0.0 3.93 2218 1994 A 43 PHE HBy A 46 ALA H 1.0 0.0 4.15 2219 1995 A 46 ALA HB% A 46 ALA H 1.0 0.0 2.94 2220 1996 A 44 LEU H A 43 PHE H 1.0 0.0 4.86 2221 1997 A 43 PHE H A 46 ALA H 1.0 0.0 4.68 2222 1998 A 43 PHE HD% A 43 PHE H 1.0 0.0 4.21 2223 1999 A 43 PHE H A 43 PHE HBx 1.0 0.0 4.07 2224 2000 A 43 PHE H A 42 PRO HA 1.0 0.0 3.23 2225 2001 A 43 PHE HBy A 43 PHE H 1.0 0.0 3.36 2226 2002 A 43 PHE H A 38 ARG HBx 1.0 0.0 4.35 2227 2002 A 38 ARG HBy A 43 PHE H 1.0 0.0 4.35 2228 2003 A 46 ALA HB% A 43 PHE H 1.0 0.0 3.35 2229 2004 A 43 PHE H A 42 PRO HBx 1.0 0.0 4.21 2230 2004 A 42 PRO HBy A 43 PHE H 1.0 0.0 4.21 2231 2005 A 86 VAL H A 87 ARG H 1.0 0.0 3.10 2232 2006 A 69 HIS HD2 A 87 ARG H 1.0 0.0 5.50 2233 2007 A 87 ARG H A 69 HIS HBx 1.0 0.0 5.18 2234 2008 A 87 ARG HGx A 87 ARG H 1.0 0.0 4.23 2235 2009 A 87 ARG H A 87 ARG HGy 1.0 0.0 3.63 2236 2010 A 70 ILE HB A 87 ARG H 1.0 0.0 4.05 2237 2011 A 70 ILE HG2% A 87 ARG H 1.0 0.0 4.45 2238 2012 A 87 ARG H A 86 VAL HGx% 1.0 0.0 4.25 2239 2013 A 87 ARG H A 86 VAL HGy% 1.0 0.0 4.25 2240 2014 A 20 TRP H A 65 ILE H 1.0 0.0 4.10 2241 2015 A 20 TRP H A 19 THR H 1.0 0.0 5.21 2242 2016 A 20 TRP HD1 A 20 TRP H 1.0 0.0 3.83 2243 2017 A 20 TRP H A 19 THR HA 1.0 0.0 3.09 2244 2018 A 20 TRP HBx A 20 TRP H 1.0 0.0 3.90 2245 2019 A 20 TRP H A 20 TRP HBy 1.0 0.0 3.60 2246 2020 A 65 ILE HB A 20 TRP H 1.0 0.0 3.97 2247 2021 A 65 ILE HA A 71 TRP HE1 1.0 0.0 5.14 2248 2022 A 70 ILE HA A 71 TRP HE1 1.0 0.0 5.41 2249 2023 A 71 TRP HE1 A 69 HIS HBx 1.0 0.0 4.02 2250 2024 A 69 HIS HBy A 71 TRP HE1 1.0 0.0 3.56 2251 2025 A 67 ALA HB% A 71 TRP HE1 1.0 0.0 3.74 2252 2026 A 66 GLN HBx A 71 TRP HE1 1.0 0.0 4.31 2253 2027 A 65 ILE HG2% A 71 TRP HE1 1.0 0.0 5.50 2254 2028 A 66 GLN HA A 67 ALA H 1.0 0.0 3.39 2255 2029 A 67 ALA HB% A 67 ALA H 1.0 0.0 3.61 2256 2030 A 66 GLN HGx A 67 ALA H 1.0 0.0 3.92 2257 2031 A 66 GLN HGy A 67 ALA H 1.0 0.0 4.25 2258 2032 A 35 ILE HA A 52 LEU H 1.0 0.0 5.50 2259 2033 A 37 THR HB A 52 LEU H 1.0 0.0 5.50 2260 2034 A 36 VAL HA A 52 LEU H 1.0 0.0 4.09 2261 2035 A 52 LEU H A 51 ASN HBx 1.0 0.0 4.39 2262 2036 A 52 LEU HBx A 52 LEU H 1.0 0.0 3.37 2263 2037 A 35 ILE HB A 52 LEU H 1.0 0.0 4.37 2264 2038 A 37 THR HG2% A 52 LEU H 1.0 0.0 3.22 2265 2039 A 52 LEU H A 52 LEU HDx% 1.0 0.0 4.44 2266 2040 A 52 LEU H A 52 LEU HDy% 1.0 0.0 4.44 2267 2041 A 18 GLY H A 17 TYR HD% 1.0 0.0 4.78 2268 2042 A 16 GLN HA A 18 GLY H 1.0 0.0 4.15 2269 2043 A 18 GLY H A 17 TYR HBx 1.0 0.0 4.49 2270 2044 A 18 GLY H A 16 GLN HGx 1.0 0.0 4.65 2271 2044 A 16 GLN HGy A 18 GLY H 1.0 0.0 4.65 2272 2045 A 90 GLN H A 91 GLY H 1.0 0.0 4.45 2273 2046 A 90 GLN H A 89 CYS HA 1.0 0.0 2.97 2274 2047 A 90 GLN H A 89 CYS HBx 1.0 0.0 4.99 2275 2048 A 90 GLN H A 90 GLN HBx 1.0 0.0 3.59 2276 2049 A 90 GLN H A 90 GLN HBy 1.0 0.0 3.44 2277 2050 A 90 GLN H A 97 ILE HB 1.0 0.0 4.00 2278 2051 A 90 GLN H A 97 ILE HG1x 1.0 0.0 4.99 2279 2052 A 90 GLN H A 97 ILE HG2% 1.0 0.0 4.07 2280 2053 A 102 TRP H A 103 GLY H 1.0 0.0 3.66 2281 2054 A 104 VAL H A 103 GLY H 1.0 0.0 4.64 2282 2055 A 103 GLY H A 102 TRP HD1 1.0 0.0 4.87 2283 2056 A 101 ALA HA A 103 GLY H 1.0 0.0 4.58 2284 2057 A 58 ILE HG2% A 61 ASP H 1.0 0.0 5.50 2285 2058 A 72 ILE HB A 61 ASP H 1.0 0.0 5.05 2286 2059 A 96 GLN H A 96 GLN HGx 1.0 0.0 4.22 2287 2060 A 49 GLY H A 37 THR H 1.0 0.0 4.94 2288 2061 A 39 ILE HD1% A 39 ILE H 1.0 0.0 4.71 2289 2062 A 95 ASN H A 94 PRO HGy 1.0 0.0 4.37 2290 2063 A 44 LEU H A 44 LEU HBx 1.0 0.0 3.69 2291 2064 A 31 GLY H A 54 ALA HB% 1.0 0.0 5.50 2292 2065 A 70 ILE H A 70 ILE HG1x 1.0 0.0 4.23 2293 2066 A 79 GLY H A 78 ASN HBx 1.0 0.0 4.75 2294 2067 A 79 GLY H A 78 ASN HBy 1.0 0.0 4.75 2295 2068 A 55 GLY H A 32 ASN HA 1.0 0.0 5.33 2296 2069 A 89 CYS HBy A 89 CYS H 1.0 0.0 3.77 2297 2070 A 76 ALA HB% A 80 ASN H 1.0 0.0 3.24 2298 2071 A 83 TYR HD% A 41 SER H 1.0 0.0 4.54 2299 2072 A 2 THR HA A 3 PRO HDx 1.0 0.0 2.85 2300 2072 A 2 THR HA A 3 PRO HDy 1.0 0.0 2.85 2301 2073 A 2 THR HG2% A 3 PRO HBy 1.0 0.0 5.22 2302 2073 A 2 THR HG2% A 3 PRO HBx 1.0 0.0 5.22 2303 2074 A 2 THR HG2% A 3 PRO HDx 1.0 0.0 4.17 2304 2074 A 2 THR HG2% A 3 PRO HDy 1.0 0.0 4.17 2305 2075 A 6 ARG HBx A 6 ARG HDx 1.0 0.0 3.46 2306 2075 A 6 ARG HBy A 6 ARG HDx 1.0 0.0 3.46 2307 2075 A 6 ARG HDy A 6 ARG HBy 1.0 0.0 3.46 2308 2075 A 6 ARG HDy A 6 ARG HBx 1.0 0.0 3.46 2309 2076 A 6 ARG HBx A 7 PRO HDx 1.0 0.0 3.18 2310 2076 A 7 PRO HDy A 6 ARG HBy 1.0 0.0 3.18 2311 2076 A 6 ARG HBx A 7 PRO HDy 1.0 0.0 3.18 2312 2076 A 6 ARG HBy A 7 PRO HDx 1.0 0.0 3.18 2313 2077 A 6 ARG HGx A 7 PRO HDx 1.0 0.0 3.23 2314 2077 A 7 PRO HDy A 6 ARG HGx 1.0 0.0 3.23 2315 2077 A 6 ARG HGy A 7 PRO HDy 1.0 0.0 3.23 2316 2077 A 6 ARG HGy A 7 PRO HDx 1.0 0.0 3.23 2317 2078 A 7 PRO HBx A 8 VAL HGx% 1.0 0.0 4.88 2318 2078 A 7 PRO HBy A 8 VAL HGx% 1.0 0.0 4.88 2319 2078 A 8 VAL HGy% A 7 PRO HBy 1.0 0.0 4.88 2320 2078 A 8 VAL HGy% A 7 PRO HBx 1.0 0.0 4.88 2321 2079 A 9 THR HG2% A 94 PRO HBy 1.0 0.0 4.63 2322 2079 A 9 THR HG2% A 94 PRO HBx 1.0 0.0 4.63 2323 2080 A 12 TRP H A 12 TRP HBx 1.0 0.0 3.36 2324 2080 A 12 TRP H A 12 TRP HBy 1.0 0.0 3.36 2325 2081 A 12 TRP HA A 22 LYS HDy 1.0 0.0 4.53 2326 2081 A 12 TRP HA A 22 LYS HDx 1.0 0.0 4.53 2327 2082 A 12 TRP HE3 A 12 TRP HBx 1.0 0.0 3.63 2328 2082 A 12 TRP HE3 A 12 TRP HBy 1.0 0.0 3.63 2329 2083 A 13 LYS H A 12 TRP HBx 1.0 0.0 3.71 2330 2083 A 13 LYS H A 12 TRP HBy 1.0 0.0 3.71 2331 2084 A 12 TRP HBx A 13 LYS HGx 1.0 0.0 5.34 2332 2084 A 13 LYS HGy A 12 TRP HBx 1.0 0.0 5.34 2333 2084 A 13 LYS HGy A 12 TRP HBy 1.0 0.0 5.34 2334 2084 A 12 TRP HBy A 13 LYS HGx 1.0 0.0 5.34 2335 2085 A 20 TRP HA A 12 TRP HBx 1.0 0.0 5.27 2336 2085 A 20 TRP HA A 12 TRP HBy 1.0 0.0 5.27 2337 2086 A 20 TRP HE3 A 12 TRP HBx 1.0 0.0 3.27 2338 2086 A 20 TRP HE3 A 12 TRP HBy 1.0 0.0 3.27 2339 2087 A 20 TRP HZ3 A 12 TRP HBx 1.0 0.0 3.85 2340 2087 A 20 TRP HZ3 A 12 TRP HBy 1.0 0.0 3.85 2341 2088 A 22 LYS HBx A 12 TRP HBx 1.0 0.0 5.00 2342 2088 A 22 LYS HBx A 12 TRP HBy 1.0 0.0 5.00 2343 2089 A 12 TRP HBx A 93 PRO HBx 1.0 0.0 3.89 2344 2089 A 12 TRP HBy A 93 PRO HBx 1.0 0.0 3.89 2345 2089 A 93 PRO HBy A 12 TRP HBx 1.0 0.0 3.89 2346 2089 A 12 TRP HBy A 93 PRO HBy 1.0 0.0 3.89 2347 2090 A 93 PRO HGx A 12 TRP HBx 1.0 0.0 4.32 2348 2090 A 93 PRO HGx A 12 TRP HBy 1.0 0.0 4.32 2349 2091 A 93 PRO HGy A 12 TRP HBx 1.0 0.0 4.72 2350 2091 A 93 PRO HGy A 12 TRP HBy 1.0 0.0 4.72 2351 2092 A 12 TRP HD1 A 22 LYS HDy 1.0 0.0 4.30 2352 2092 A 12 TRP HD1 A 22 LYS HDx 1.0 0.0 4.30 2353 2093 A 12 TRP HD1 A 93 PRO HBx 1.0 0.0 3.76 2354 2093 A 12 TRP HD1 A 93 PRO HBy 1.0 0.0 3.76 2355 2094 A 12 TRP HZ3 A 63 VAL HGy% 1.0 0.0 3.72 2356 2094 A 12 TRP HZ3 A 63 VAL HGx% 1.0 0.0 3.72 2357 2095 A 12 TRP HZ3 A 64 CYS HBx 1.0 0.0 5.34 2358 2095 A 12 TRP HZ3 A 64 CYS HBy 1.0 0.0 5.34 2359 2096 A 12 TRP HZ2 A 63 VAL HGy% 1.0 0.0 3.96 2360 2096 A 12 TRP HZ2 A 63 VAL HGx% 1.0 0.0 3.96 2361 2097 A 12 TRP HH2 A 63 VAL HGy% 1.0 0.0 3.12 2362 2097 A 12 TRP HH2 A 63 VAL HGx% 1.0 0.0 3.12 2363 2098 A 13 LYS H A 13 LYS HBx 1.0 0.0 3.22 2364 2098 A 13 LYS H A 13 LYS HBy 1.0 0.0 3.22 2365 2099 A 13 LYS HBx A 13 LYS HDx 1.0 0.0 3.45 2366 2099 A 13 LYS HBy A 13 LYS HDx 1.0 0.0 3.45 2367 2099 A 13 LYS HDy A 13 LYS HBx 1.0 0.0 3.45 2368 2099 A 13 LYS HDy A 13 LYS HBy 1.0 0.0 3.45 2369 2100 A 13 LYS HBy A 13 LYS HEx 1.0 0.0 3.78 2370 2100 A 13 LYS HEy A 13 LYS HBx 1.0 0.0 3.78 2371 2100 A 13 LYS HEy A 13 LYS HBy 1.0 0.0 3.78 2372 2100 A 13 LYS HBx A 13 LYS HEx 1.0 0.0 3.78 2373 2101 A 14 LYS H A 13 LYS HBx 1.0 0.0 3.37 2374 2101 A 14 LYS H A 13 LYS HBy 1.0 0.0 3.37 2375 2102 A 21 TYR H A 13 LYS HBx 1.0 0.0 4.42 2376 2102 A 21 TYR H A 13 LYS HBy 1.0 0.0 4.42 2377 2103 A 21 TYR HE% A 13 LYS HBx 1.0 0.0 3.39 2378 2103 A 21 TYR HE% A 13 LYS HBy 1.0 0.0 3.39 2379 2104 A 14 LYS H A 14 LYS HGy 1.0 0.0 4.32 2380 2104 A 14 LYS H A 14 LYS HGx 1.0 0.0 4.32 2381 2105 A 14 LYS H A 14 LYS HDx 1.0 0.0 5.34 2382 2105 A 14 LYS H A 14 LYS HDy 1.0 0.0 5.34 2383 2106 A 14 LYS HA A 14 LYS HGy 1.0 0.0 3.72 2384 2106 A 14 LYS HA A 14 LYS HGx 1.0 0.0 3.72 2385 2107 A 14 LYS HBy A 14 LYS HDx 1.0 0.0 3.20 2386 2107 A 14 LYS HBy A 14 LYS HDy 1.0 0.0 3.20 2387 2108 A 14 LYS HBy A 14 LYS HEx 1.0 0.0 4.06 2388 2108 A 14 LYS HBy A 14 LYS HEy 1.0 0.0 4.06 2389 2109 A 14 LYS HBx A 14 LYS HDx 1.0 0.0 3.43 2390 2109 A 14 LYS HBx A 14 LYS HDy 1.0 0.0 3.43 2391 2110 A 14 LYS HEy A 14 LYS HGy 1.0 0.0 3.15 2392 2110 A 14 LYS HEx A 14 LYS HGy 1.0 0.0 3.15 2393 2110 A 14 LYS HGx A 14 LYS HEx 1.0 0.0 3.15 2394 2110 A 14 LYS HGx A 14 LYS HEy 1.0 0.0 3.15 2395 2111 A 18 GLY H A 14 LYS HGy 1.0 0.0 3.98 2396 2111 A 18 GLY H A 14 LYS HGx 1.0 0.0 3.98 2397 2112 A 18 GLY HAy A 14 LYS HGy 1.0 0.0 3.64 2398 2112 A 18 GLY HAy A 14 LYS HGx 1.0 0.0 3.64 2399 2113 A 18 GLY HAx A 14 LYS HGy 1.0 0.0 4.42 2400 2113 A 14 LYS HGx A 18 GLY HAx 1.0 0.0 4.42 2401 2114 A 19 THR H A 14 LYS HGy 1.0 0.0 4.31 2402 2114 A 19 THR H A 14 LYS HGx 1.0 0.0 4.31 2403 2115 A 20 TRP HA A 14 LYS HGy 1.0 0.0 4.48 2404 2115 A 20 TRP HA A 14 LYS HGx 1.0 0.0 4.48 2405 2116 A 15 ASN H A 14 LYS HDx 1.0 0.0 5.34 2406 2116 A 15 ASN H A 14 LYS HDy 1.0 0.0 5.34 2407 2117 A 18 GLY H A 14 LYS HDx 1.0 0.0 5.30 2408 2117 A 18 GLY H A 14 LYS HDy 1.0 0.0 5.30 2409 2118 A 18 GLY HAy A 14 LYS HDx 1.0 0.0 3.68 2410 2118 A 18 GLY HAy A 14 LYS HDy 1.0 0.0 3.68 2411 2119 A 18 GLY HAx A 14 LYS HDx 1.0 0.0 4.28 2412 2119 A 14 LYS HDy A 18 GLY HAx 1.0 0.0 4.28 2413 2120 A 20 TRP H A 14 LYS HDx 1.0 0.0 5.34 2414 2120 A 20 TRP H A 14 LYS HDy 1.0 0.0 5.34 2415 2121 A 20 TRP HE1 A 14 LYS HDx 1.0 0.0 3.84 2416 2121 A 20 TRP HE1 A 14 LYS HDy 1.0 0.0 3.84 2417 2122 A 20 TRP HZ2 A 14 LYS HDx 1.0 0.0 3.69 2418 2122 A 20 TRP HZ2 A 14 LYS HDy 1.0 0.0 3.69 2419 2123 A 15 ASN H A 14 LYS HEx 1.0 0.0 5.34 2420 2123 A 15 ASN H A 14 LYS HEy 1.0 0.0 5.34 2421 2124 A 18 GLY HAy A 14 LYS HEx 1.0 0.0 3.75 2422 2124 A 18 GLY HAy A 14 LYS HEy 1.0 0.0 3.75 2423 2125 A 18 GLY HAx A 14 LYS HEx 1.0 0.0 4.46 2424 2125 A 14 LYS HEy A 18 GLY HAx 1.0 0.0 4.46 2425 2126 A 20 TRP HE1 A 14 LYS HEx 1.0 0.0 4.27 2426 2126 A 20 TRP HE1 A 14 LYS HEy 1.0 0.0 4.27 2427 2127 A 20 TRP HZ2 A 14 LYS HEx 1.0 0.0 4.31 2428 2127 A 20 TRP HZ2 A 14 LYS HEy 1.0 0.0 4.31 2429 2128 A 92 VAL HGy% A 14 LYS HEx 1.0 0.0 5.34 2430 2128 A 92 VAL HGy% A 14 LYS HEy 1.0 0.0 5.34 2431 2129 A 15 ASN H A 15 ASN HBx 1.0 0.0 3.48 2432 2129 A 15 ASN H A 15 ASN HBy 1.0 0.0 3.48 2433 2130 A 15 ASN HBx A 15 ASN HD2y 1.0 0.0 3.17 2434 2130 A 15 ASN HBy A 15 ASN HD2y 1.0 0.0 3.17 2435 2130 A 15 ASN HD2x A 15 ASN HBx 1.0 0.0 3.17 2436 2130 A 15 ASN HBy A 15 ASN HD2x 1.0 0.0 3.17 2437 2131 A 15 ASN HBy A 16 GLN HGx 1.0 0.0 4.88 2438 2131 A 16 GLN HGy A 15 ASN HBx 1.0 0.0 4.88 2439 2131 A 16 GLN HGy A 15 ASN HBy 1.0 0.0 4.88 2440 2131 A 15 ASN HBx A 16 GLN HGx 1.0 0.0 4.88 2441 2132 A 21 TYR HD% A 15 ASN HBx 1.0 0.0 4.16 2442 2132 A 21 TYR HD% A 15 ASN HBy 1.0 0.0 4.16 2443 2133 A 21 TYR HE% A 15 ASN HBx 1.0 0.0 3.36 2444 2133 A 21 TYR HE% A 15 ASN HBy 1.0 0.0 3.36 2445 2134 A 19 THR HB A 15 ASN HD2y 1.0 0.0 3.92 2446 2134 A 19 THR HB A 15 ASN HD2x 1.0 0.0 3.92 2447 2135 A 19 THR HG2% A 15 ASN HD2y 1.0 0.0 3.92 2448 2135 A 19 THR HG2% A 15 ASN HD2x 1.0 0.0 3.92 2449 2136 A 17 TYR HE% A 16 GLN HBy 1.0 0.0 5.34 2450 2136 A 17 TYR HE% A 16 GLN HBx 1.0 0.0 5.34 2451 2137 A 18 GLY H A 16 GLN HBy 1.0 0.0 5.34 2452 2137 A 18 GLY H A 16 GLN HBx 1.0 0.0 5.34 2453 2138 A 17 TYR H A 17 TYR HBx 1.0 0.0 3.05 2454 2138 A 17 TYR H A 17 TYR HBy 1.0 0.0 3.05 2455 2139 A 18 GLY H A 17 TYR HBx 1.0 0.0 3.95 2456 2139 A 18 GLY H A 17 TYR HBy 1.0 0.0 3.95 2457 2140 A 19 THR H A 17 TYR HBx 1.0 0.0 3.77 2458 2140 A 19 THR H A 17 TYR HBy 1.0 0.0 3.77 2459 2141 A 19 THR HB A 17 TYR HBx 1.0 0.0 4.40 2460 2141 A 19 THR HB A 17 TYR HBy 1.0 0.0 4.40 2461 2142 A 66 GLN HE2x A 19 THR H 1.0 0.0 4.50 2462 2142 A 66 GLN HE2y A 19 THR H 1.0 0.0 4.50 2463 2143 A 66 GLN HE2x A 19 THR HA 1.0 0.0 3.52 2464 2143 A 66 GLN HE2y A 19 THR HA 1.0 0.0 3.52 2465 2144 A 19 THR HG2% A 42 PRO HDx 1.0 0.0 4.59 2466 2144 A 19 THR HG2% A 42 PRO HDy 1.0 0.0 4.59 2467 2145 A 19 THR HG2% A 64 CYS HBx 1.0 0.0 2.88 2468 2145 A 19 THR HG2% A 64 CYS HBy 1.0 0.0 2.88 2469 2146 A 19 THR HG2% A 66 GLN HE2x 1.0 0.0 3.92 2470 2146 A 19 THR HG2% A 66 GLN HE2y 1.0 0.0 3.92 2471 2147 A 20 TRP H A 66 GLN HE2x 1.0 0.0 5.34 2472 2147 A 20 TRP H A 66 GLN HE2y 1.0 0.0 5.34 2473 2148 A 20 TRP HBx A 93 PRO HBx 1.0 0.0 5.34 2474 2148 A 20 TRP HBx A 93 PRO HBy 1.0 0.0 5.34 2475 2149 A 21 TYR HA A 63 VAL HGy% 1.0 0.0 5.44 2476 2149 A 21 TYR HA A 63 VAL HGx% 1.0 0.0 5.44 2477 2150 A 22 LYS HBy A 22 LYS HDy 1.0 0.0 3.59 2478 2150 A 22 LYS HBy A 22 LYS HDx 1.0 0.0 3.59 2479 2151 A 22 LYS HBx A 22 LYS HDy 1.0 0.0 3.56 2480 2151 A 22 LYS HBx A 22 LYS HDx 1.0 0.0 3.56 2481 2152 A 22 LYS HGy A 63 VAL HGy% 1.0 0.0 3.63 2482 2152 A 22 LYS HGy A 63 VAL HGx% 1.0 0.0 3.63 2483 2153 A 22 LYS HGx A 63 VAL HGy% 1.0 0.0 3.89 2484 2153 A 22 LYS HGx A 63 VAL HGx% 1.0 0.0 3.89 2485 2154 A 22 LYS HEx A 63 VAL HGy% 1.0 0.0 3.08 2486 2154 A 22 LYS HEy A 63 VAL HGy% 1.0 0.0 3.08 2487 2154 A 63 VAL HGx% A 22 LYS HEx 1.0 0.0 3.08 2488 2154 A 22 LYS HEy A 63 VAL HGx% 1.0 0.0 3.08 2489 2155 A 24 GLU H A 23 PRO HBy 1.0 0.0 3.98 2490 2155 A 24 GLU H A 23 PRO HBx 1.0 0.0 3.98 2491 2156 A 24 GLU H A 24 GLU HGy 1.0 0.0 4.97 2492 2156 A 24 GLU H A 24 GLU HGx 1.0 0.0 4.97 2493 2157 A 24 GLU H A 63 VAL HGy% 1.0 0.0 4.32 2494 2157 A 24 GLU H A 63 VAL HGx% 1.0 0.0 4.32 2495 2158 A 24 GLU HA A 24 GLU HGy 1.0 0.0 3.08 2496 2158 A 24 GLU HA A 24 GLU HGx 1.0 0.0 3.08 2497 2159 A 24 GLU HA A 63 VAL HGy% 1.0 0.0 4.56 2498 2159 A 24 GLU HA A 63 VAL HGx% 1.0 0.0 4.56 2499 2160 A 24 GLU HBx A 63 VAL HGy% 1.0 0.0 2.92 2500 2160 A 63 VAL HGx% A 24 GLU HBx 1.0 0.0 2.92 2501 2160 A 24 GLU HBy A 63 VAL HGx% 1.0 0.0 2.92 2502 2160 A 24 GLU HBy A 63 VAL HGy% 1.0 0.0 2.92 2503 2161 A 25 ASN H A 24 GLU HGy 1.0 0.0 3.68 2504 2161 A 25 ASN H A 24 GLU HGx 1.0 0.0 3.68 2505 2162 A 26 ALA H A 24 GLU HGy 1.0 0.0 4.63 2506 2162 A 26 ALA H A 24 GLU HGx 1.0 0.0 4.63 2507 2163 A 26 ALA HB% A 24 GLU HGy 1.0 0.0 3.21 2508 2163 A 26 ALA HB% A 24 GLU HGx 1.0 0.0 3.21 2509 2164 A 24 GLU HGy A 63 VAL HGy% 1.0 0.0 3.90 2510 2164 A 24 GLU HGx A 63 VAL HGy% 1.0 0.0 3.90 2511 2164 A 63 VAL HGx% A 24 GLU HGy 1.0 0.0 3.90 2512 2164 A 63 VAL HGx% A 24 GLU HGx 1.0 0.0 3.90 2513 2165 A 25 ASN HA A 59 VAL HGy% 1.0 0.0 5.34 2514 2165 A 25 ASN HA A 59 VAL HGx% 1.0 0.0 5.34 2515 2166 A 25 ASN HA A 61 ASP HBx 1.0 0.0 4.08 2516 2166 A 25 ASN HA A 61 ASP HBy 1.0 0.0 4.08 2517 2167 A 25 ASN HBy A 61 ASP HBx 1.0 0.0 4.70 2518 2167 A 61 ASP HBy A 25 ASN HBx 1.0 0.0 4.70 2519 2167 A 25 ASN HBy A 61 ASP HBy 1.0 0.0 4.70 2520 2167 A 25 ASN HBx A 61 ASP HBx 1.0 0.0 4.70 2521 2168 A 25 ASN HD2x A 59 VAL HGy% 1.0 0.0 4.04 2522 2168 A 25 ASN HD2y A 59 VAL HGy% 1.0 0.0 4.04 2523 2168 A 59 VAL HGx% A 25 ASN HD2y 1.0 0.0 4.04 2524 2168 A 59 VAL HGx% A 25 ASN HD2x 1.0 0.0 4.04 2525 2169 A 26 ALA H A 59 VAL HGy% 1.0 0.0 4.34 2526 2169 A 26 ALA H A 59 VAL HGx% 1.0 0.0 4.34 2527 2170 A 26 ALA H A 61 ASP HBx 1.0 0.0 5.12 2528 2170 A 26 ALA H A 61 ASP HBy 1.0 0.0 5.12 2529 2171 A 27 THR HA A 59 VAL HGy% 1.0 0.0 4.04 2530 2171 A 27 THR HA A 59 VAL HGx% 1.0 0.0 4.04 2531 2172 A 27 THR HB A 29 VAL HGy% 1.0 0.0 4.77 2532 2172 A 27 THR HB A 29 VAL HGx% 1.0 0.0 4.77 2533 2173 A 27 THR HB A 59 VAL HGy% 1.0 0.0 5.44 2534 2173 A 27 THR HB A 59 VAL HGx% 1.0 0.0 5.44 2535 2174 A 27 THR HG2% A 29 VAL HGy% 1.0 0.0 2.78 2536 2174 A 27 THR HG2% A 29 VAL HGx% 1.0 0.0 2.78 2537 2175 A 28 PHE H A 29 VAL HGy% 1.0 0.0 4.67 2538 2175 A 28 PHE H A 29 VAL HGx% 1.0 0.0 4.67 2539 2176 A 28 PHE HA A 29 VAL HGy% 1.0 0.0 4.02 2540 2176 A 28 PHE HA A 29 VAL HGx% 1.0 0.0 4.02 2541 2177 A 28 PHE HA A 104 VAL HGy% 1.0 0.0 5.41 2542 2177 A 28 PHE HA A 104 VAL HGx% 1.0 0.0 5.41 2543 2178 A 28 PHE HBx A 86 VAL HGy% 1.0 0.0 4.97 2544 2178 A 28 PHE HBx A 86 VAL HGx% 1.0 0.0 4.97 2545 2179 A 28 PHE HD% A 86 VAL HGy% 1.0 0.0 4.63 2546 2179 A 28 PHE HD% A 86 VAL HGx% 1.0 0.0 4.63 2547 2180 A 28 PHE HD% A 104 VAL HGy% 1.0 0.0 5.44 2548 2180 A 28 PHE HD% A 104 VAL HGx% 1.0 0.0 5.44 2549 2181 A 28 PHE HZ A 52 LEU HDy% 1.0 0.0 4.20 2550 2181 A 28 PHE HZ A 52 LEU HDx% 1.0 0.0 4.20 2551 2182 A 28 PHE HZ A 86 VAL HGy% 1.0 0.0 3.82 2552 2182 A 28 PHE HZ A 86 VAL HGx% 1.0 0.0 3.82 2553 2183 A 29 VAL H A 29 VAL HGy% 1.0 0.0 3.08 2554 2183 A 29 VAL H A 29 VAL HGx% 1.0 0.0 3.08 2555 2184 A 29 VAL H A 104 VAL HGy% 1.0 0.0 3.62 2556 2184 A 29 VAL H A 104 VAL HGx% 1.0 0.0 3.62 2557 2185 A 29 VAL HA A 52 LEU HDy% 1.0 0.0 4.89 2558 2185 A 29 VAL HA A 52 LEU HDx% 1.0 0.0 4.89 2559 2186 A 29 VAL HB A 104 VAL HGy% 1.0 0.0 2.82 2560 2186 A 29 VAL HB A 104 VAL HGx% 1.0 0.0 2.82 2561 2187 A 30 ASN H A 29 VAL HGy% 1.0 0.0 3.14 2562 2187 A 30 ASN H A 29 VAL HGx% 1.0 0.0 3.14 2563 2188 A 30 ASN HA A 29 VAL HGy% 1.0 0.0 4.59 2564 2188 A 30 ASN HA A 29 VAL HGx% 1.0 0.0 4.59 2565 2189 A 30 ASN HBx A 29 VAL HGy% 1.0 0.0 4.61 2566 2189 A 30 ASN HBx A 29 VAL HGx% 1.0 0.0 4.61 2567 2190 A 55 GLY H A 29 VAL HGy% 1.0 0.0 4.64 2568 2190 A 55 GLY H A 29 VAL HGx% 1.0 0.0 4.64 2569 2191 A 29 VAL HGx% A 55 GLY HAx 1.0 0.0 3.58 2570 2191 A 29 VAL HGy% A 55 GLY HAx 1.0 0.0 3.58 2571 2191 A 55 GLY HAy A 29 VAL HGy% 1.0 0.0 3.58 2572 2191 A 55 GLY HAy A 29 VAL HGx% 1.0 0.0 3.58 2573 2192 A 56 ALA H A 29 VAL HGy% 1.0 0.0 4.95 2574 2192 A 56 ALA H A 29 VAL HGx% 1.0 0.0 4.95 2575 2193 A 57 THR HA A 29 VAL HGy% 1.0 0.0 3.26 2576 2193 A 57 THR HA A 29 VAL HGx% 1.0 0.0 3.26 2577 2194 A 57 THR HB A 29 VAL HGy% 1.0 0.0 4.52 2578 2194 A 57 THR HB A 29 VAL HGx% 1.0 0.0 4.52 2579 2195 A 57 THR HG2% A 29 VAL HGy% 1.0 0.0 2.64 2580 2195 A 57 THR HG2% A 29 VAL HGx% 1.0 0.0 2.64 2581 2196 A 58 ILE H A 29 VAL HGy% 1.0 0.0 4.06 2582 2196 A 58 ILE H A 29 VAL HGx% 1.0 0.0 4.06 2583 2197 A 104 VAL H A 29 VAL HGy% 1.0 0.0 3.85 2584 2197 A 104 VAL H A 29 VAL HGx% 1.0 0.0 3.85 2585 2198 A 104 VAL HB A 29 VAL HGy% 1.0 0.0 4.08 2586 2198 A 104 VAL HB A 29 VAL HGx% 1.0 0.0 4.08 2587 2199 A 29 VAL HGx% A 104 VAL HGy% 1.0 0.0 2.78 2588 2199 A 29 VAL HGy% A 104 VAL HGy% 1.0 0.0 2.78 2589 2199 A 104 VAL HGx% A 29 VAL HGy% 1.0 0.0 2.78 2590 2199 A 29 VAL HGx% A 104 VAL HGx% 1.0 0.0 2.78 2591 2200 A 105 PHE HA A 29 VAL HGy% 1.0 0.0 5.22 2592 2200 A 105 PHE HA A 29 VAL HGx% 1.0 0.0 5.22 2593 2201 A 106 LYS H A 29 VAL HGy% 1.0 0.0 4.87 2594 2201 A 106 LYS H A 29 VAL HGx% 1.0 0.0 4.87 2595 2202 A 106 LYS HBy A 29 VAL HGy% 1.0 0.0 4.89 2596 2202 A 106 LYS HBy A 29 VAL HGx% 1.0 0.0 4.89 2597 2203 A 29 VAL HGx% A 106 LYS HGx 1.0 0.0 3.21 2598 2203 A 29 VAL HGy% A 106 LYS HGx 1.0 0.0 3.21 2599 2203 A 106 LYS HGy A 29 VAL HGy% 1.0 0.0 3.21 2600 2203 A 106 LYS HGy A 29 VAL HGx% 1.0 0.0 3.21 2601 2204 A 29 VAL HGx% A 106 LYS HDx 1.0 0.0 4.18 2602 2204 A 29 VAL HGy% A 106 LYS HDx 1.0 0.0 4.18 2603 2204 A 106 LYS HDy A 29 VAL HGy% 1.0 0.0 4.18 2604 2204 A 106 LYS HDy A 29 VAL HGx% 1.0 0.0 4.18 2605 2205 A 29 VAL HGx% A 106 LYS HEx 1.0 0.0 3.39 2606 2205 A 29 VAL HGy% A 106 LYS HEx 1.0 0.0 3.39 2607 2205 A 106 LYS HEy A 29 VAL HGy% 1.0 0.0 3.39 2608 2205 A 106 LYS HEy A 29 VAL HGx% 1.0 0.0 3.39 2609 2206 A 30 ASN H A 52 LEU HDy% 1.0 0.0 3.85 2610 2206 A 30 ASN H A 52 LEU HDx% 1.0 0.0 3.85 2611 2207 A 30 ASN H A 104 VAL HGy% 1.0 0.0 5.16 2612 2207 A 30 ASN H A 104 VAL HGx% 1.0 0.0 5.16 2613 2208 A 30 ASN HA A 52 LEU HDy% 1.0 0.0 4.24 2614 2208 A 30 ASN HA A 52 LEU HDx% 1.0 0.0 4.24 2615 2209 A 30 ASN HBy A 52 LEU HDy% 1.0 0.0 3.23 2616 2209 A 30 ASN HBy A 52 LEU HDx% 1.0 0.0 3.23 2617 2210 A 30 ASN HBx A 52 LEU HDy% 1.0 0.0 3.63 2618 2210 A 30 ASN HBx A 52 LEU HDx% 1.0 0.0 3.63 2619 2211 A 30 ASN HD2x A 52 LEU HDy% 1.0 0.0 3.59 2620 2211 A 30 ASN HD2x A 52 LEU HDx% 1.0 0.0 3.59 2621 2212 A 30 ASN HD2y A 52 LEU HDy% 1.0 0.0 3.76 2622 2212 A 30 ASN HD2y A 52 LEU HDx% 1.0 0.0 3.76 2623 2213 A 31 GLY H A 52 LEU HDy% 1.0 0.0 5.44 2624 2213 A 31 GLY H A 52 LEU HDx% 1.0 0.0 5.44 2625 2214 A 33 GLN H A 32 ASN HD2x 1.0 0.0 4.83 2626 2214 A 33 GLN H A 32 ASN HD2y 1.0 0.0 4.83 2627 2215 A 34 PRO HA A 51 ASN HBx 1.0 0.0 5.32 2628 2215 A 34 PRO HA A 51 ASN HBy 1.0 0.0 5.32 2629 2216 A 34 PRO HBy A 51 ASN HBx 1.0 0.0 3.71 2630 2216 A 34 PRO HBy A 51 ASN HBy 1.0 0.0 3.71 2631 2217 A 34 PRO HGy A 51 ASN HBx 1.0 0.0 4.67 2632 2217 A 34 PRO HGx A 51 ASN HBx 1.0 0.0 4.67 2633 2217 A 51 ASN HBy A 34 PRO HGy 1.0 0.0 4.67 2634 2217 A 51 ASN HBy A 34 PRO HGx 1.0 0.0 4.67 2635 2218 A 54 ALA H A 34 PRO HGy 1.0 0.0 4.44 2636 2218 A 54 ALA H A 34 PRO HGx 1.0 0.0 4.44 2637 2219 A 54 ALA HB% A 34 PRO HGy 1.0 0.0 4.32 2638 2219 A 54 ALA HB% A 34 PRO HGx 1.0 0.0 4.32 2639 2220 A 35 ILE H A 51 ASN HBx 1.0 0.0 4.44 2640 2220 A 35 ILE H A 51 ASN HBy 1.0 0.0 4.44 2641 2221 A 35 ILE H A 52 LEU HDy% 1.0 0.0 4.70 2642 2221 A 35 ILE H A 52 LEU HDx% 1.0 0.0 4.70 2643 2222 A 35 ILE HA A 36 VAL HGy% 1.0 0.0 4.41 2644 2222 A 35 ILE HA A 36 VAL HGx% 1.0 0.0 4.41 2645 2223 A 35 ILE HA A 51 ASN HBx 1.0 0.0 5.34 2646 2223 A 35 ILE HA A 51 ASN HBy 1.0 0.0 5.34 2647 2224 A 35 ILE HG2% A 86 VAL HGy% 1.0 0.0 4.26 2648 2224 A 35 ILE HG2% A 86 VAL HGx% 1.0 0.0 4.26 2649 2225 A 35 ILE HG1x A 52 LEU HDy% 1.0 0.0 4.10 2650 2225 A 35 ILE HG1x A 52 LEU HDx% 1.0 0.0 4.10 2651 2226 A 35 ILE HD1% A 86 VAL HGy% 1.0 0.0 3.93 2652 2226 A 35 ILE HD1% A 86 VAL HGx% 1.0 0.0 3.93 2653 2227 A 36 VAL H A 36 VAL HGy% 1.0 0.0 2.67 2654 2227 A 36 VAL H A 36 VAL HGx% 1.0 0.0 2.67 2655 2228 A 36 VAL HA A 51 ASN HBx 1.0 0.0 4.10 2656 2228 A 36 VAL HA A 51 ASN HBy 1.0 0.0 4.10 2657 2229 A 37 THR H A 36 VAL HGy% 1.0 0.0 3.19 2658 2229 A 37 THR H A 36 VAL HGx% 1.0 0.0 3.19 2659 2230 A 37 THR HA A 36 VAL HGy% 1.0 0.0 4.62 2660 2230 A 37 THR HA A 36 VAL HGx% 1.0 0.0 4.62 2661 2231 A 38 ARG H A 36 VAL HGy% 1.0 0.0 5.44 2662 2231 A 38 ARG H A 36 VAL HGx% 1.0 0.0 5.44 2663 2232 A 38 ARG HGy A 36 VAL HGy% 1.0 0.0 4.88 2664 2232 A 38 ARG HGy A 36 VAL HGx% 1.0 0.0 4.88 2665 2233 A 38 ARG HGx A 36 VAL HGy% 1.0 0.0 5.44 2666 2233 A 38 ARG HGx A 36 VAL HGx% 1.0 0.0 5.44 2667 2234 A 51 ASN H A 36 VAL HGy% 1.0 0.0 5.25 2668 2234 A 51 ASN H A 36 VAL HGx% 1.0 0.0 5.25 2669 2235 A 51 ASN HA A 36 VAL HGy% 1.0 0.0 3.56 2670 2235 A 51 ASN HA A 36 VAL HGx% 1.0 0.0 3.56 2671 2236 A 36 VAL HGx% A 51 ASN HBx 1.0 0.0 4.08 2672 2236 A 51 ASN HBy A 36 VAL HGy% 1.0 0.0 4.08 2673 2236 A 51 ASN HBy A 36 VAL HGx% 1.0 0.0 4.08 2674 2236 A 36 VAL HGy% A 51 ASN HBx 1.0 0.0 4.08 2675 2237 A 51 ASN HD2y A 36 VAL HGx% 1.0 0.0 4.17 2676 2237 A 51 ASN HD2y A 36 VAL HGy% 1.0 0.0 4.17 2677 2237 A 51 ASN HD2x A 36 VAL HGy% 1.0 0.0 4.17 2678 2237 A 51 ASN HD2x A 36 VAL HGx% 1.0 0.0 4.17 2679 2238 A 52 LEU H A 36 VAL HGy% 1.0 0.0 5.13 2680 2238 A 52 LEU H A 36 VAL HGx% 1.0 0.0 5.13 2681 2239 A 37 THR HA A 82 VAL HGy% 1.0 0.0 4.44 2682 2239 A 37 THR HA A 82 VAL HGx% 1.0 0.0 4.44 2683 2240 A 37 THR HB A 82 VAL HGy% 1.0 0.0 2.85 2684 2240 A 37 THR HB A 82 VAL HGx% 1.0 0.0 2.85 2685 2241 A 37 THR HG2% A 50 GLY HAx 1.0 0.0 5.34 2686 2241 A 37 THR HG2% A 50 GLY HAy 1.0 0.0 5.34 2687 2242 A 37 THR HG2% A 51 ASN HBx 1.0 0.0 5.11 2688 2242 A 37 THR HG2% A 51 ASN HBy 1.0 0.0 5.11 2689 2243 A 37 THR HG2% A 52 LEU HDy% 1.0 0.0 3.77 2690 2243 A 37 THR HG2% A 52 LEU HDx% 1.0 0.0 3.77 2691 2244 A 37 THR HG2% A 82 VAL HGy% 1.0 0.0 3.16 2692 2244 A 37 THR HG2% A 82 VAL HGx% 1.0 0.0 3.16 2693 2245 A 38 ARG H A 82 VAL HGy% 1.0 0.0 3.52 2694 2245 A 38 ARG H A 82 VAL HGx% 1.0 0.0 3.52 2695 2246 A 38 ARG HA A 49 GLY HAx 1.0 0.0 4.69 2696 2246 A 38 ARG HA A 49 GLY HAy 1.0 0.0 4.69 2697 2247 A 38 ARG HBx A 82 VAL HGy% 1.0 0.0 5.00 2698 2247 A 38 ARG HBy A 82 VAL HGy% 1.0 0.0 5.00 2699 2247 A 82 VAL HGx% A 38 ARG HBx 1.0 0.0 5.00 2700 2247 A 38 ARG HBy A 82 VAL HGx% 1.0 0.0 5.00 2701 2248 A 38 ARG HGy A 44 LEU HDy% 1.0 0.0 5.44 2702 2248 A 38 ARG HGy A 44 LEU HDx% 1.0 0.0 5.44 2703 2249 A 38 ARG HGx A 44 LEU HDy% 1.0 0.0 4.90 2704 2249 A 38 ARG HGx A 44 LEU HDx% 1.0 0.0 4.90 2705 2250 A 38 ARG HDy A 44 LEU HDy% 1.0 0.0 5.44 2706 2250 A 38 ARG HDy A 44 LEU HDx% 1.0 0.0 5.44 2707 2251 A 80 ASN HD2y A 39 ILE HG2% 1.0 0.0 4.64 2708 2251 A 80 ASN HD2x A 39 ILE HG2% 1.0 0.0 4.64 2709 2252 A 39 ILE HG2% A 82 VAL HGy% 1.0 0.0 3.05 2710 2252 A 39 ILE HG2% A 82 VAL HGx% 1.0 0.0 3.05 2711 2253 A 39 ILE HG1y A 49 GLY HAx 1.0 0.0 3.45 2712 2253 A 39 ILE HG1y A 49 GLY HAy 1.0 0.0 3.45 2713 2254 A 39 ILE HG1y A 82 VAL HGy% 1.0 0.0 4.43 2714 2254 A 39 ILE HG1y A 82 VAL HGx% 1.0 0.0 4.43 2715 2255 A 39 ILE HG1x A 49 GLY HAx 1.0 0.0 3.31 2716 2255 A 39 ILE HG1x A 49 GLY HAy 1.0 0.0 3.31 2717 2256 A 39 ILE HG1x A 82 VAL HGy% 1.0 0.0 4.90 2718 2256 A 39 ILE HG1x A 82 VAL HGx% 1.0 0.0 4.90 2719 2257 A 39 ILE HD1% A 49 GLY HAx 1.0 0.0 2.98 2720 2257 A 39 ILE HD1% A 49 GLY HAy 1.0 0.0 2.98 2721 2258 A 39 ILE HD1% A 82 VAL HGy% 1.0 0.0 3.65 2722 2258 A 39 ILE HD1% A 82 VAL HGx% 1.0 0.0 3.65 2723 2259 A 40 GLY H A 82 VAL HGy% 1.0 0.0 4.95 2724 2259 A 40 GLY H A 82 VAL HGx% 1.0 0.0 4.95 2725 2260 A 41 SER HA A 42 PRO HDx 1.0 0.0 3.03 2726 2260 A 41 SER HA A 42 PRO HDy 1.0 0.0 3.03 2727 2261 A 41 SER HBx A 42 PRO HDx 1.0 0.0 3.90 2728 2261 A 41 SER HBy A 42 PRO HDx 1.0 0.0 3.90 2729 2261 A 42 PRO HDy A 41 SER HBx 1.0 0.0 3.90 2730 2261 A 42 PRO HDy A 41 SER HBy 1.0 0.0 3.90 2731 2262 A 43 PHE HD% A 41 SER HBx 1.0 0.0 3.28 2732 2262 A 43 PHE HD% A 41 SER HBy 1.0 0.0 3.28 2733 2263 A 43 PHE HE% A 41 SER HBx 1.0 0.0 4.13 2734 2263 A 43 PHE HE% A 41 SER HBy 1.0 0.0 4.13 2735 2264 A 46 ALA HB% A 41 SER HBx 1.0 0.0 4.14 2736 2264 A 46 ALA HB% A 41 SER HBy 1.0 0.0 4.14 2737 2265 A 42 PRO HA A 71 TRP HBx 1.0 0.0 4.89 2738 2265 A 42 PRO HA A 71 TRP HBy 1.0 0.0 4.89 2739 2266 A 42 PRO HA A 83 TYR HBx 1.0 0.0 4.22 2740 2266 A 42 PRO HA A 83 TYR HBy 1.0 0.0 4.22 2741 2267 A 42 PRO HBy A 71 TRP HBx 1.0 0.0 4.17 2742 2267 A 71 TRP HBy A 42 PRO HBx 1.0 0.0 4.17 2743 2267 A 42 PRO HBy A 71 TRP HBy 1.0 0.0 4.17 2744 2267 A 42 PRO HBx A 71 TRP HBx 1.0 0.0 4.17 2745 2268 A 42 PRO HBy A 83 TYR HBx 1.0 0.0 3.63 2746 2268 A 42 PRO HBx A 83 TYR HBx 1.0 0.0 3.63 2747 2268 A 83 TYR HBy A 42 PRO HBx 1.0 0.0 3.63 2748 2268 A 42 PRO HBy A 83 TYR HBy 1.0 0.0 3.63 2749 2269 A 42 PRO HGy A 64 CYS HBx 1.0 0.0 4.69 2750 2269 A 42 PRO HGy A 64 CYS HBy 1.0 0.0 4.69 2751 2270 A 42 PRO HGx A 64 CYS HBx 1.0 0.0 3.90 2752 2270 A 42 PRO HGx A 64 CYS HBy 1.0 0.0 3.90 2753 2271 A 42 PRO HGx A 83 TYR HBx 1.0 0.0 4.56 2754 2271 A 42 PRO HGx A 83 TYR HBy 1.0 0.0 4.56 2755 2272 A 43 PHE H A 44 LEU HDy% 1.0 0.0 5.03 2756 2272 A 43 PHE H A 44 LEU HDx% 1.0 0.0 5.03 2757 2273 A 43 PHE H A 83 TYR HBx 1.0 0.0 5.34 2758 2273 A 43 PHE H A 83 TYR HBy 1.0 0.0 5.34 2759 2274 A 43 PHE HA A 44 LEU HDy% 1.0 0.0 4.45 2760 2274 A 43 PHE HA A 44 LEU HDx% 1.0 0.0 4.45 2761 2275 A 43 PHE HBy A 44 LEU HDy% 1.0 0.0 5.44 2762 2275 A 43 PHE HBy A 44 LEU HDx% 1.0 0.0 5.44 2763 2276 A 44 LEU H A 44 LEU HBy 1.0 0.0 3.12 2764 2276 A 44 LEU H A 44 LEU HBx 1.0 0.0 3.12 2765 2277 A 44 LEU H A 44 LEU HDy% 1.0 0.0 3.43 2766 2277 A 44 LEU H A 44 LEU HDx% 1.0 0.0 3.43 2767 2278 A 44 LEU HA A 44 LEU HDy% 1.0 0.0 2.67 2768 2278 A 44 LEU HA A 44 LEU HDx% 1.0 0.0 2.67 2769 2279 A 44 LEU HBx A 44 LEU HDy% 1.0 0.0 2.30 2770 2279 A 44 LEU HBy A 44 LEU HDy% 1.0 0.0 2.30 2771 2279 A 44 LEU HDx% A 44 LEU HBy 1.0 0.0 2.30 2772 2279 A 44 LEU HDx% A 44 LEU HBx 1.0 0.0 2.30 2773 2280 A 45 ASN H A 44 LEU HBy 1.0 0.0 4.33 2774 2280 A 45 ASN H A 44 LEU HBx 1.0 0.0 4.33 2775 2281 A 46 ALA H A 44 LEU HBy 1.0 0.0 5.34 2776 2281 A 46 ALA H A 44 LEU HBx 1.0 0.0 5.34 2777 2282 A 46 ALA H A 44 LEU HDy% 1.0 0.0 5.44 2778 2282 A 46 ALA H A 44 LEU HDx% 1.0 0.0 5.44 2779 2283 A 67 ALA HA A 44 LEU HDy% 1.0 0.0 5.44 2780 2283 A 67 ALA HA A 44 LEU HDx% 1.0 0.0 5.44 2781 2284 A 67 ALA HB% A 44 LEU HDy% 1.0 0.0 4.09 2782 2284 A 67 ALA HB% A 44 LEU HDx% 1.0 0.0 4.09 2783 2285 A 69 HIS HE1 A 44 LEU HDy% 1.0 0.0 4.06 2784 2285 A 69 HIS HE1 A 44 LEU HDx% 1.0 0.0 4.06 2785 2286 A 71 TRP HE1 A 44 LEU HDy% 1.0 0.0 5.44 2786 2286 A 71 TRP HE1 A 44 LEU HDx% 1.0 0.0 5.44 2787 2287 A 71 TRP HZ2 A 44 LEU HDy% 1.0 0.0 3.21 2788 2287 A 71 TRP HZ2 A 44 LEU HDx% 1.0 0.0 3.21 2789 2288 A 71 TRP HH2 A 44 LEU HDy% 1.0 0.0 3.09 2790 2288 A 71 TRP HH2 A 44 LEU HDx% 1.0 0.0 3.09 2791 2289 A 85 PRO HBy A 44 LEU HDy% 1.0 0.0 4.83 2792 2289 A 85 PRO HBy A 44 LEU HDx% 1.0 0.0 4.83 2793 2290 A 85 PRO HGy A 44 LEU HDy% 1.0 0.0 4.58 2794 2290 A 85 PRO HGy A 44 LEU HDx% 1.0 0.0 4.58 2795 2291 A 85 PRO HDy A 44 LEU HDy% 1.0 0.0 5.44 2796 2291 A 85 PRO HDy A 44 LEU HDx% 1.0 0.0 5.44 2797 2292 A 48 VAL HA A 49 GLY HAx 1.0 0.0 4.45 2798 2292 A 48 VAL HA A 49 GLY HAy 1.0 0.0 4.45 2799 2293 A 48 VAL HGy% A 49 GLY HAx 1.0 0.0 4.06 2800 2293 A 48 VAL HGx% A 49 GLY HAx 1.0 0.0 4.06 2801 2293 A 49 GLY HAy A 48 VAL HGx% 1.0 0.0 4.06 2802 2293 A 48 VAL HGy% A 49 GLY HAy 1.0 0.0 4.06 2803 2294 A 48 VAL HGy% A 50 GLY HAx 1.0 0.0 3.66 2804 2294 A 48 VAL HGx% A 50 GLY HAx 1.0 0.0 3.66 2805 2294 A 50 GLY HAy A 48 VAL HGx% 1.0 0.0 3.66 2806 2294 A 48 VAL HGy% A 50 GLY HAy 1.0 0.0 3.66 2807 2295 A 48 VAL HGy% A 51 ASN HBx 1.0 0.0 5.34 2808 2295 A 48 VAL HGx% A 51 ASN HBx 1.0 0.0 5.34 2809 2295 A 51 ASN HBy A 48 VAL HGx% 1.0 0.0 5.34 2810 2295 A 48 VAL HGy% A 51 ASN HBy 1.0 0.0 5.34 2811 2296 A 49 GLY HAy A 82 VAL HGy% 1.0 0.0 3.99 2812 2296 A 49 GLY HAx A 82 VAL HGy% 1.0 0.0 3.99 2813 2296 A 82 VAL HGx% A 49 GLY HAx 1.0 0.0 3.99 2814 2296 A 82 VAL HGx% A 49 GLY HAy 1.0 0.0 3.99 2815 2297 A 82 VAL HGx% A 49 GLY HAy 1.0 0.0 6.23 2816 2298 A 50 GLY H A 82 VAL HGy% 1.0 0.0 5.44 2817 2298 A 50 GLY H A 82 VAL HGx% 1.0 0.0 5.44 2818 2299 A 52 LEU H A 51 ASN HBx 1.0 0.0 3.60 2819 2299 A 52 LEU H A 51 ASN HBy 1.0 0.0 3.60 2820 2300 A 53 PRO HA A 51 ASN HBx 1.0 0.0 5.34 2821 2300 A 53 PRO HA A 51 ASN HBy 1.0 0.0 5.34 2822 2301 A 52 LEU H A 52 LEU HDy% 1.0 0.0 3.84 2823 2301 A 52 LEU H A 52 LEU HDx% 1.0 0.0 3.84 2824 2302 A 52 LEU HA A 52 LEU HDy% 1.0 0.0 3.00 2825 2302 A 52 LEU HA A 52 LEU HDx% 1.0 0.0 3.00 2826 2303 A 52 LEU HBy A 52 LEU HDy% 1.0 0.0 2.67 2827 2303 A 52 LEU HBy A 52 LEU HDx% 1.0 0.0 2.67 2828 2304 A 52 LEU HBx A 52 LEU HDy% 1.0 0.0 2.91 2829 2304 A 52 LEU HBx A 52 LEU HDx% 1.0 0.0 2.91 2830 2305 A 53 PRO HA A 52 LEU HDy% 1.0 0.0 4.69 2831 2305 A 53 PRO HA A 52 LEU HDx% 1.0 0.0 4.69 2832 2306 A 53 PRO HBx A 52 LEU HDy% 1.0 0.0 5.44 2833 2306 A 53 PRO HBx A 52 LEU HDx% 1.0 0.0 5.44 2834 2307 A 53 PRO HGy A 52 LEU HDy% 1.0 0.0 3.66 2835 2307 A 53 PRO HGy A 52 LEU HDx% 1.0 0.0 3.66 2836 2308 A 53 PRO HGx A 52 LEU HDy% 1.0 0.0 4.23 2837 2308 A 53 PRO HGx A 52 LEU HDx% 1.0 0.0 4.23 2838 2309 A 53 PRO HDy A 52 LEU HDy% 1.0 0.0 2.99 2839 2309 A 53 PRO HDy A 52 LEU HDx% 1.0 0.0 2.99 2840 2310 A 53 PRO HDx A 52 LEU HDy% 1.0 0.0 3.47 2841 2310 A 53 PRO HDx A 52 LEU HDx% 1.0 0.0 3.47 2842 2311 A 55 GLY H A 52 LEU HDy% 1.0 0.0 4.97 2843 2311 A 55 GLY H A 52 LEU HDx% 1.0 0.0 4.97 2844 2312 A 56 ALA H A 52 LEU HDy% 1.0 0.0 3.91 2845 2312 A 56 ALA H A 52 LEU HDx% 1.0 0.0 3.91 2846 2313 A 56 ALA HA A 52 LEU HDy% 1.0 0.0 5.03 2847 2313 A 56 ALA HA A 52 LEU HDx% 1.0 0.0 5.03 2848 2314 A 56 ALA HB% A 52 LEU HDy% 1.0 0.0 2.51 2849 2314 A 56 ALA HB% A 52 LEU HDx% 1.0 0.0 2.51 2850 2315 A 57 THR H A 52 LEU HDy% 1.0 0.0 4.60 2851 2315 A 57 THR H A 52 LEU HDx% 1.0 0.0 4.60 2852 2316 A 57 THR HA A 52 LEU HDy% 1.0 0.0 5.44 2853 2316 A 57 THR HA A 52 LEU HDx% 1.0 0.0 5.44 2854 2317 A 58 ILE H A 52 LEU HDy% 1.0 0.0 4.94 2855 2317 A 58 ILE H A 52 LEU HDx% 1.0 0.0 4.94 2856 2318 A 58 ILE HB A 52 LEU HDy% 1.0 0.0 5.15 2857 2318 A 58 ILE HB A 52 LEU HDx% 1.0 0.0 5.15 2858 2319 A 58 ILE HG2% A 52 LEU HDy% 1.0 0.0 4.18 2859 2319 A 58 ILE HG2% A 52 LEU HDx% 1.0 0.0 4.18 2860 2320 A 58 ILE HG1y A 52 LEU HDy% 1.0 0.0 2.78 2861 2320 A 58 ILE HG1y A 52 LEU HDx% 1.0 0.0 2.78 2862 2321 A 58 ILE HG1x A 52 LEU HDy% 1.0 0.0 2.93 2863 2321 A 58 ILE HG1x A 52 LEU HDx% 1.0 0.0 2.93 2864 2322 A 58 ILE HD1% A 52 LEU HDy% 1.0 0.0 3.02 2865 2322 A 58 ILE HD1% A 52 LEU HDx% 1.0 0.0 3.02 2866 2323 A 74 TYR HE% A 52 LEU HDy% 1.0 0.0 4.51 2867 2323 A 74 TYR HE% A 52 LEU HDx% 1.0 0.0 4.51 2868 2324 A 84 CYS HBy A 52 LEU HDy% 1.0 0.0 4.91 2869 2324 A 84 CYS HBy A 52 LEU HDx% 1.0 0.0 4.91 2870 2325 A 58 ILE HA A 59 VAL HGy% 1.0 0.0 3.70 2871 2325 A 58 ILE HA A 59 VAL HGx% 1.0 0.0 3.70 2872 2326 A 58 ILE HG2% A 59 VAL HGy% 1.0 0.0 4.07 2873 2326 A 58 ILE HG2% A 59 VAL HGx% 1.0 0.0 4.07 2874 2327 A 58 ILE HG2% A 86 VAL HGy% 1.0 0.0 4.98 2875 2327 A 58 ILE HG2% A 86 VAL HGx% 1.0 0.0 4.98 2876 2328 A 59 VAL H A 59 VAL HGy% 1.0 0.0 2.86 2877 2328 A 59 VAL H A 59 VAL HGx% 1.0 0.0 2.86 2878 2329 A 60 TYR H A 59 VAL HGy% 1.0 0.0 3.61 2879 2329 A 60 TYR H A 59 VAL HGx% 1.0 0.0 3.61 2880 2330 A 60 TYR HA A 59 VAL HGy% 1.0 0.0 4.30 2881 2330 A 60 TYR HA A 59 VAL HGx% 1.0 0.0 4.30 2882 2331 A 60 TYR HD% A 59 VAL HGy% 1.0 0.0 5.04 2883 2331 A 60 TYR HD% A 59 VAL HGx% 1.0 0.0 5.04 2884 2332 A 74 TYR HD% A 59 VAL HGy% 1.0 0.0 5.44 2885 2332 A 74 TYR HD% A 59 VAL HGx% 1.0 0.0 5.44 2886 2333 A 61 ASP H A 61 ASP HBx 1.0 0.0 3.56 2887 2333 A 61 ASP H A 61 ASP HBy 1.0 0.0 3.56 2888 2334 A 62 GLU H A 61 ASP HBx 1.0 0.0 4.08 2889 2334 A 62 GLU H A 61 ASP HBy 1.0 0.0 4.08 2890 2335 A 62 GLU HBy A 61 ASP HBx 1.0 0.0 4.34 2891 2335 A 62 GLU HBy A 61 ASP HBy 1.0 0.0 4.34 2892 2336 A 62 GLU H A 63 VAL HGy% 1.0 0.0 5.17 2893 2336 A 62 GLU H A 63 VAL HGx% 1.0 0.0 5.17 2894 2337 A 62 GLU HA A 63 VAL HGy% 1.0 0.0 4.20 2895 2337 A 62 GLU HA A 63 VAL HGx% 1.0 0.0 4.20 2896 2338 A 62 GLU HGx A 63 VAL HGy% 1.0 0.0 5.11 2897 2338 A 62 GLU HGx A 63 VAL HGx% 1.0 0.0 5.11 2898 2339 A 62 GLU HGy A 63 VAL HGy% 1.0 0.0 4.87 2899 2339 A 62 GLU HGy A 63 VAL HGx% 1.0 0.0 4.87 2900 2340 A 63 VAL H A 63 VAL HGy% 1.0 0.0 3.15 2901 2340 A 63 VAL H A 63 VAL HGx% 1.0 0.0 3.15 2902 2341 A 63 VAL HA A 63 VAL HGy% 1.0 0.0 2.99 2903 2341 A 63 VAL HA A 63 VAL HGx% 1.0 0.0 2.99 2904 2342 A 63 VAL HA A 64 CYS HBx 1.0 0.0 4.88 2905 2342 A 63 VAL HA A 64 CYS HBy 1.0 0.0 4.88 2906 2343 A 64 CYS H A 63 VAL HGy% 1.0 0.0 3.40 2907 2343 A 64 CYS H A 63 VAL HGx% 1.0 0.0 3.40 2908 2344 A 64 CYS HA A 63 VAL HGy% 1.0 0.0 4.14 2909 2344 A 64 CYS HA A 63 VAL HGx% 1.0 0.0 4.14 2910 2345 A 65 ILE HD1% A 63 VAL HGy% 1.0 0.0 4.05 2911 2345 A 65 ILE HD1% A 63 VAL HGx% 1.0 0.0 4.05 2912 2346 A 70 ILE HG2% A 63 VAL HGy% 1.0 0.0 2.76 2913 2346 A 70 ILE HG2% A 63 VAL HGx% 1.0 0.0 2.76 2914 2347 A 70 ILE HD1% A 63 VAL HGy% 1.0 0.0 3.56 2915 2347 A 70 ILE HD1% A 63 VAL HGx% 1.0 0.0 3.56 2916 2348 A 71 TRP H A 63 VAL HGy% 1.0 0.0 4.02 2917 2348 A 71 TRP H A 63 VAL HGx% 1.0 0.0 4.02 2918 2349 A 72 ILE HA A 63 VAL HGy% 1.0 0.0 3.59 2919 2349 A 72 ILE HA A 63 VAL HGx% 1.0 0.0 3.59 2920 2350 A 72 ILE HG2% A 63 VAL HGy% 1.0 0.0 2.86 2921 2350 A 72 ILE HG2% A 63 VAL HGx% 1.0 0.0 2.86 2922 2351 A 73 GLY H A 63 VAL HGy% 1.0 0.0 5.01 2923 2351 A 73 GLY H A 63 VAL HGx% 1.0 0.0 5.01 2924 2352 A 64 CYS H A 64 CYS HBx 1.0 0.0 3.60 2925 2352 A 64 CYS H A 64 CYS HBy 1.0 0.0 3.60 2926 2353 A 64 CYS H A 71 TRP HBx 1.0 0.0 4.33 2927 2353 A 64 CYS H A 71 TRP HBy 1.0 0.0 4.33 2928 2354 A 65 ILE H A 64 CYS HBx 1.0 0.0 3.48 2929 2354 A 65 ILE H A 64 CYS HBy 1.0 0.0 3.48 2930 2355 A 71 TRP H A 64 CYS HBx 1.0 0.0 4.67 2931 2355 A 71 TRP H A 64 CYS HBy 1.0 0.0 4.67 2932 2356 A 64 CYS HBx A 71 TRP HBx 1.0 0.0 3.72 2933 2356 A 64 CYS HBy A 71 TRP HBx 1.0 0.0 3.72 2934 2356 A 71 TRP HBy A 64 CYS HBx 1.0 0.0 3.72 2935 2356 A 64 CYS HBy A 71 TRP HBy 1.0 0.0 3.72 2936 2357 A 65 ILE HD1% A 93 PRO HBx 1.0 0.0 3.88 2937 2357 A 65 ILE HD1% A 93 PRO HBy 1.0 0.0 3.88 2938 2358 A 65 ILE HD1% A 96 GLN HE2x 1.0 0.0 4.26 2939 2358 A 65 ILE HD1% A 96 GLN HE2y 1.0 0.0 4.26 2940 2359 A 66 GLN HBy A 66 GLN HE2x 1.0 0.0 4.46 2941 2359 A 66 GLN HBy A 66 GLN HE2y 1.0 0.0 4.46 2942 2360 A 66 GLN HE2x A 66 GLN HGy 1.0 0.0 3.49 2943 2360 A 66 GLN HE2y A 66 GLN HGy 1.0 0.0 3.49 2944 2361 A 67 ALA HA A 68 GLY HAy 1.0 0.0 4.47 2945 2361 A 67 ALA HA A 68 GLY HAx 1.0 0.0 4.47 2946 2362 A 89 CYS H A 68 GLY HAy 1.0 0.0 4.56 2947 2362 A 89 CYS H A 68 GLY HAx 1.0 0.0 4.56 2948 2363 A 70 ILE H A 86 VAL HGy% 1.0 0.0 4.96 2949 2363 A 70 ILE H A 86 VAL HGx% 1.0 0.0 4.96 2950 2364 A 70 ILE HB A 86 VAL HGy% 1.0 0.0 3.48 2951 2364 A 70 ILE HB A 86 VAL HGx% 1.0 0.0 3.48 2952 2365 A 70 ILE HG2% A 86 VAL HGy% 1.0 0.0 2.84 2953 2365 A 70 ILE HG2% A 86 VAL HGx% 1.0 0.0 2.84 2954 2366 A 70 ILE HD1% A 86 VAL HGy% 1.0 0.0 3.83 2955 2366 A 70 ILE HD1% A 86 VAL HGx% 1.0 0.0 3.83 2956 2367 A 70 ILE HD1% A 96 GLN HE2x 1.0 0.0 4.67 2957 2367 A 70 ILE HD1% A 96 GLN HE2y 1.0 0.0 4.67 2958 2368 A 71 TRP H A 71 TRP HBx 1.0 0.0 3.66 2959 2368 A 71 TRP H A 71 TRP HBy 1.0 0.0 3.66 2960 2369 A 71 TRP H A 86 VAL HGy% 1.0 0.0 4.98 2961 2369 A 71 TRP H A 86 VAL HGx% 1.0 0.0 4.98 2962 2370 A 71 TRP HA A 86 VAL HGy% 1.0 0.0 3.69 2963 2370 A 71 TRP HA A 86 VAL HGx% 1.0 0.0 3.69 2964 2371 A 71 TRP HE3 A 71 TRP HBx 1.0 0.0 3.68 2965 2371 A 71 TRP HE3 A 71 TRP HBy 1.0 0.0 3.68 2966 2372 A 72 ILE H A 71 TRP HBx 1.0 0.0 3.77 2967 2372 A 72 ILE H A 71 TRP HBy 1.0 0.0 3.77 2968 2373 A 72 ILE HG1y A 71 TRP HBx 1.0 0.0 5.26 2969 2373 A 72 ILE HG1y A 71 TRP HBy 1.0 0.0 5.26 2970 2374 A 71 TRP HBx A 83 TYR HBx 1.0 0.0 3.98 2971 2374 A 71 TRP HBy A 83 TYR HBx 1.0 0.0 3.98 2972 2374 A 83 TYR HBy A 71 TRP HBx 1.0 0.0 3.98 2973 2374 A 71 TRP HBy A 83 TYR HBy 1.0 0.0 3.98 2974 2375 A 83 TYR HD% A 71 TRP HBx 1.0 0.0 4.36 2975 2375 A 83 TYR HD% A 71 TRP HBy 1.0 0.0 4.36 2976 2376 A 84 CYS H A 71 TRP HBx 1.0 0.0 5.34 2977 2376 A 84 CYS H A 71 TRP HBy 1.0 0.0 5.34 2978 2377 A 85 PRO HA A 71 TRP HBx 1.0 0.0 5.34 2979 2377 A 85 PRO HA A 71 TRP HBy 1.0 0.0 5.34 2980 2378 A 71 TRP HZ3 A 83 TYR HBx 1.0 0.0 4.78 2981 2378 A 71 TRP HZ3 A 83 TYR HBy 1.0 0.0 4.78 2982 2379 A 72 ILE H A 86 VAL HGy% 1.0 0.0 4.04 2983 2379 A 72 ILE H A 86 VAL HGx% 1.0 0.0 4.04 2984 2380 A 72 ILE HA A 86 VAL HGy% 1.0 0.0 5.44 2985 2380 A 72 ILE HA A 86 VAL HGx% 1.0 0.0 5.44 2986 2381 A 72 ILE HB A 86 VAL HGy% 1.0 0.0 4.73 2987 2381 A 72 ILE HB A 86 VAL HGx% 1.0 0.0 4.73 2988 2382 A 72 ILE HG2% A 86 VAL HGy% 1.0 0.0 2.64 2989 2382 A 72 ILE HG2% A 86 VAL HGx% 1.0 0.0 2.64 2990 2383 A 72 ILE HG1y A 86 VAL HGy% 1.0 0.0 3.47 2991 2383 A 72 ILE HG1y A 86 VAL HGx% 1.0 0.0 3.47 2992 2384 A 72 ILE HG1x A 86 VAL HGy% 1.0 0.0 3.89 2993 2384 A 72 ILE HG1x A 86 VAL HGx% 1.0 0.0 3.89 2994 2385 A 72 ILE HD1% A 86 VAL HGy% 1.0 0.0 3.01 2995 2385 A 72 ILE HD1% A 86 VAL HGx% 1.0 0.0 3.01 2996 2386 A 74 TYR H A 82 VAL HGy% 1.0 0.0 4.20 2997 2386 A 74 TYR H A 82 VAL HGx% 1.0 0.0 4.20 2998 2387 A 74 TYR HBy A 75 ASN HBx 1.0 0.0 4.81 2999 2387 A 74 TYR HBy A 75 ASN HBy 1.0 0.0 4.81 3000 2388 A 74 TYR HD% A 82 VAL HGy% 1.0 0.0 3.63 3001 2388 A 74 TYR HD% A 82 VAL HGx% 1.0 0.0 3.63 3002 2389 A 74 TYR HE% A 82 VAL HGy% 1.0 0.0 3.14 3003 2389 A 74 TYR HE% A 82 VAL HGx% 1.0 0.0 3.14 3004 2390 A 74 TYR HE% A 86 VAL HGy% 1.0 0.0 5.29 3005 2390 A 74 TYR HE% A 86 VAL HGx% 1.0 0.0 5.29 3006 2391 A 75 ASN H A 75 ASN HBx 1.0 0.0 3.09 3007 2391 A 75 ASN H A 75 ASN HBy 1.0 0.0 3.09 3008 2392 A 75 ASN H A 75 ASN HD2x 1.0 0.0 4.67 3009 2392 A 75 ASN H A 75 ASN HD2y 1.0 0.0 4.67 3010 2393 A 75 ASN HA A 81 ARG HDy 1.0 0.0 4.46 3011 2393 A 75 ASN HA A 81 ARG HDx 1.0 0.0 4.46 3012 2394 A 75 ASN HA A 82 VAL HGy% 1.0 0.0 4.28 3013 2394 A 75 ASN HA A 82 VAL HGx% 1.0 0.0 4.28 3014 2395 A 75 ASN HBy A 75 ASN HD2x 1.0 0.0 3.19 3015 2395 A 75 ASN HBx A 75 ASN HD2x 1.0 0.0 3.19 3016 2395 A 75 ASN HD2y A 75 ASN HBx 1.0 0.0 3.19 3017 2395 A 75 ASN HBy A 75 ASN HD2y 1.0 0.0 3.19 3018 2396 A 76 ALA H A 75 ASN HBx 1.0 0.0 3.53 3019 2396 A 76 ALA H A 75 ASN HBy 1.0 0.0 3.53 3020 2397 A 75 ASN HBy A 79 GLY HAy 1.0 0.0 4.10 3021 2397 A 75 ASN HBx A 79 GLY HAy 1.0 0.0 4.10 3022 2397 A 79 GLY HAx A 75 ASN HBx 1.0 0.0 4.10 3023 2397 A 75 ASN HBy A 79 GLY HAx 1.0 0.0 4.10 3024 2398 A 76 ALA H A 81 ARG HDy 1.0 0.0 5.34 3025 2398 A 76 ALA H A 81 ARG HDx 1.0 0.0 5.34 3026 2399 A 76 ALA H A 82 VAL HGy% 1.0 0.0 3.46 3027 2399 A 76 ALA H A 82 VAL HGx% 1.0 0.0 3.46 3028 2400 A 76 ALA HA A 77 TYR HBx 1.0 0.0 4.65 3029 2400 A 76 ALA HA A 77 TYR HBy 1.0 0.0 4.65 3030 2401 A 76 ALA HA A 82 VAL HGy% 1.0 0.0 4.19 3031 2401 A 76 ALA HA A 82 VAL HGx% 1.0 0.0 4.19 3032 2402 A 76 ALA HB% A 77 TYR HBx 1.0 0.0 4.13 3033 2402 A 76 ALA HB% A 77 TYR HBy 1.0 0.0 4.13 3034 2403 A 76 ALA HB% A 82 VAL HGy% 1.0 0.0 2.65 3035 2403 A 76 ALA HB% A 82 VAL HGx% 1.0 0.0 2.65 3036 2404 A 78 ASN HA A 78 ASN HBx 1.0 0.0 2.64 3037 2404 A 78 ASN HA A 78 ASN HBy 1.0 0.0 2.64 3038 2405 A 79 GLY H A 78 ASN HBx 1.0 0.0 4.09 3039 2405 A 79 GLY H A 78 ASN HBy 1.0 0.0 4.09 3040 2406 A 78 ASN HBx A 79 GLY HAy 1.0 0.0 4.96 3041 2406 A 78 ASN HBy A 79 GLY HAy 1.0 0.0 4.96 3042 2406 A 79 GLY HAx A 78 ASN HBx 1.0 0.0 4.96 3043 2406 A 79 GLY HAx A 78 ASN HBy 1.0 0.0 4.96 3044 2407 A 80 ASN H A 78 ASN HBx 1.0 0.0 4.42 3045 2407 A 80 ASN H A 78 ASN HBy 1.0 0.0 4.42 3046 2408 A 80 ASN HA A 79 GLY HAy 1.0 0.0 4.68 3047 2408 A 80 ASN HA A 79 GLY HAx 1.0 0.0 4.68 3048 2409 A 80 ASN HD2y A 80 ASN H 1.0 0.0 4.42 3049 2409 A 80 ASN HD2x A 80 ASN H 1.0 0.0 4.42 3050 2410 A 80 ASN H A 82 VAL HGy% 1.0 0.0 4.66 3051 2410 A 80 ASN H A 82 VAL HGx% 1.0 0.0 4.66 3052 2411 A 80 ASN HD2y A 80 ASN HA 1.0 0.0 4.22 3053 2411 A 80 ASN HD2x A 80 ASN HA 1.0 0.0 4.22 3054 2412 A 80 ASN HBy A 82 VAL HGy% 1.0 0.0 4.19 3055 2412 A 80 ASN HBy A 82 VAL HGx% 1.0 0.0 4.19 3056 2413 A 80 ASN HBx A 82 VAL HGy% 1.0 0.0 4.00 3057 2413 A 80 ASN HBx A 82 VAL HGx% 1.0 0.0 4.00 3058 2414 A 81 ARG H A 81 ARG HDy 1.0 0.0 4.39 3059 2414 A 81 ARG H A 81 ARG HDx 1.0 0.0 4.39 3060 2415 A 81 ARG H A 82 VAL HGy% 1.0 0.0 4.61 3061 2415 A 81 ARG H A 82 VAL HGx% 1.0 0.0 4.61 3062 2416 A 81 ARG HA A 81 ARG HDy 1.0 0.0 3.01 3063 2416 A 81 ARG HA A 81 ARG HDx 1.0 0.0 3.01 3064 2417 A 81 ARG HBy A 81 ARG HDy 1.0 0.0 3.48 3065 2417 A 81 ARG HBy A 81 ARG HDx 1.0 0.0 3.48 3066 2418 A 81 ARG HBx A 81 ARG HDy 1.0 0.0 3.57 3067 2418 A 81 ARG HBx A 81 ARG HDx 1.0 0.0 3.57 3068 2419 A 81 ARG HGx A 82 VAL HGy% 1.0 0.0 5.44 3069 2419 A 81 ARG HGx A 82 VAL HGx% 1.0 0.0 5.44 3070 2420 A 81 ARG HDx A 82 VAL HGy% 1.0 0.0 5.28 3071 2420 A 81 ARG HDy A 82 VAL HGy% 1.0 0.0 5.28 3072 2420 A 82 VAL HGx% A 81 ARG HDy 1.0 0.0 5.28 3073 2420 A 82 VAL HGx% A 81 ARG HDx 1.0 0.0 5.28 3074 2421 A 82 VAL H A 82 VAL HGy% 1.0 0.0 3.09 3075 2421 A 82 VAL H A 82 VAL HGx% 1.0 0.0 3.09 3076 2422 A 82 VAL HA A 82 VAL HGy% 1.0 0.0 2.78 3077 2422 A 82 VAL HA A 82 VAL HGx% 1.0 0.0 2.78 3078 2423 A 83 TYR H A 82 VAL HGy% 1.0 0.0 2.97 3079 2423 A 83 TYR H A 82 VAL HGx% 1.0 0.0 2.97 3080 2424 A 83 TYR HA A 82 VAL HGy% 1.0 0.0 4.07 3081 2424 A 83 TYR HA A 82 VAL HGx% 1.0 0.0 4.07 3082 2425 A 82 VAL HGy% A 83 TYR HBx 1.0 0.0 5.28 3083 2425 A 82 VAL HGx% A 83 TYR HBx 1.0 0.0 5.28 3084 2425 A 83 TYR HBy A 82 VAL HGy% 1.0 0.0 5.28 3085 2425 A 82 VAL HGx% A 83 TYR HBy 1.0 0.0 5.28 3086 2426 A 84 CYS H A 82 VAL HGy% 1.0 0.0 4.47 3087 2426 A 84 CYS H A 82 VAL HGx% 1.0 0.0 4.47 3088 2427 A 84 CYS HBy A 82 VAL HGy% 1.0 0.0 4.27 3089 2427 A 84 CYS HBy A 82 VAL HGx% 1.0 0.0 4.27 3090 2428 A 84 CYS HBx A 82 VAL HGy% 1.0 0.0 4.75 3091 2428 A 84 CYS HBx A 82 VAL HGx% 1.0 0.0 4.75 3092 2429 A 83 TYR H A 83 TYR HBx 1.0 0.0 3.64 3093 2429 A 83 TYR H A 83 TYR HBy 1.0 0.0 3.64 3094 2430 A 84 CYS H A 83 TYR HBx 1.0 0.0 3.86 3095 2430 A 84 CYS H A 83 TYR HBy 1.0 0.0 3.86 3096 2431 A 84 CYS H A 86 VAL HGy% 1.0 0.0 4.99 3097 2431 A 84 CYS H A 86 VAL HGx% 1.0 0.0 4.99 3098 2432 A 84 CYS HBy A 86 VAL HGy% 1.0 0.0 5.28 3099 2432 A 84 CYS HBy A 86 VAL HGx% 1.0 0.0 5.28 3100 2433 A 84 CYS HBx A 86 VAL HGy% 1.0 0.0 4.10 3101 2433 A 84 CYS HBx A 86 VAL HGx% 1.0 0.0 4.10 3102 2434 A 85 PRO HA A 86 VAL HGy% 1.0 0.0 3.58 3103 2434 A 85 PRO HA A 86 VAL HGx% 1.0 0.0 3.58 3104 2435 A 86 VAL H A 86 VAL HGy% 1.0 0.0 2.85 3105 2435 A 86 VAL H A 86 VAL HGx% 1.0 0.0 2.85 3106 2436 A 86 VAL HA A 86 VAL HGy% 1.0 0.0 2.78 3107 2436 A 86 VAL HA A 86 VAL HGx% 1.0 0.0 2.78 3108 2437 A 87 ARG H A 86 VAL HGy% 1.0 0.0 3.31 3109 2437 A 87 ARG H A 86 VAL HGx% 1.0 0.0 3.31 3110 2438 A 87 ARG HA A 86 VAL HGy% 1.0 0.0 4.75 3111 2438 A 87 ARG HA A 86 VAL HGx% 1.0 0.0 4.75 3112 2439 A 87 ARG HBy A 86 VAL HGy% 1.0 0.0 4.69 3113 2439 A 87 ARG HBy A 86 VAL HGx% 1.0 0.0 4.69 3114 2440 A 87 ARG HBx A 86 VAL HGy% 1.0 0.0 4.49 3115 2440 A 87 ARG HBx A 86 VAL HGx% 1.0 0.0 4.49 3116 2441 A 87 ARG HGy A 86 VAL HGy% 1.0 0.0 3.47 3117 2441 A 87 ARG HGy A 86 VAL HGx% 1.0 0.0 3.47 3118 2442 A 87 ARG HGx A 86 VAL HGy% 1.0 0.0 3.91 3119 2442 A 87 ARG HGx A 86 VAL HGx% 1.0 0.0 3.91 3120 2443 A 86 VAL HGy% A 87 ARG HDx 1.0 0.0 3.75 3121 2443 A 87 ARG HDy A 86 VAL HGy% 1.0 0.0 3.75 3122 2443 A 87 ARG HDy A 86 VAL HGx% 1.0 0.0 3.75 3123 2443 A 86 VAL HGx% A 87 ARG HDx 1.0 0.0 3.75 3124 2444 A 101 ALA HB% A 86 VAL HGy% 1.0 0.0 3.93 3125 2444 A 101 ALA HB% A 86 VAL HGx% 1.0 0.0 3.93 3126 2445 A 102 TRP H A 86 VAL HGy% 1.0 0.0 4.05 3127 2445 A 102 TRP H A 86 VAL HGx% 1.0 0.0 4.05 3128 2446 A 102 TRP HBy A 86 VAL HGy% 1.0 0.0 4.83 3129 2446 A 102 TRP HBy A 86 VAL HGx% 1.0 0.0 4.83 3130 2447 A 102 TRP HBx A 86 VAL HGy% 1.0 0.0 5.44 3131 2447 A 102 TRP HBx A 86 VAL HGx% 1.0 0.0 5.44 3132 2448 A 102 TRP HE3 A 86 VAL HGy% 1.0 0.0 4.79 3133 2448 A 102 TRP HE3 A 86 VAL HGx% 1.0 0.0 4.79 3134 2449 A 105 PHE HD% A 86 VAL HGy% 1.0 0.0 5.21 3135 2449 A 105 PHE HD% A 86 VAL HGx% 1.0 0.0 5.21 3136 2450 A 105 PHE HE% A 86 VAL HGy% 1.0 0.0 3.18 3137 2450 A 105 PHE HE% A 86 VAL HGx% 1.0 0.0 3.18 3138 2451 A 105 PHE HZ A 86 VAL HGy% 1.0 0.0 2.92 3139 2451 A 105 PHE HZ A 86 VAL HGx% 1.0 0.0 2.92 3140 2452 A 87 ARG HBy A 99 GLY HAx 1.0 0.0 4.86 3141 2452 A 87 ARG HBy A 99 GLY HAy 1.0 0.0 4.86 3142 2453 A 88 THR H A 99 GLY HAx 1.0 0.0 4.39 3143 2453 A 88 THR H A 99 GLY HAy 1.0 0.0 4.39 3144 2454 A 91 GLY H A 90 GLN HGx 1.0 0.0 4.11 3145 2454 A 91 GLY H A 90 GLN HGy 1.0 0.0 4.11 3146 2455 A 97 ILE HB A 90 GLN HGx 1.0 0.0 4.64 3147 2455 A 97 ILE HB A 90 GLN HGy 1.0 0.0 4.64 3148 2456 A 97 ILE HG2% A 90 GLN HGx 1.0 0.0 4.83 3149 2456 A 97 ILE HG2% A 90 GLN HGy 1.0 0.0 4.83 3150 2457 A 97 ILE HD1% A 90 GLN HGx 1.0 0.0 4.09 3151 2457 A 97 ILE HD1% A 90 GLN HGy 1.0 0.0 4.09 3152 2458 A 97 ILE HD1% A 90 GLN HE2x 1.0 0.0 4.26 3153 2458 A 97 ILE HD1% A 90 GLN HE2y 1.0 0.0 4.26 3154 2459 A 93 PRO HA A 94 PRO HBy 1.0 0.0 4.27 3155 2459 A 93 PRO HA A 94 PRO HBx 1.0 0.0 4.27 3156 2460 A 94 PRO HA A 93 PRO HBx 1.0 0.0 3.11 3157 2460 A 94 PRO HA A 93 PRO HBy 1.0 0.0 3.11 3158 2461 A 93 PRO HBx A 94 PRO HBy 1.0 0.0 4.43 3159 2461 A 93 PRO HBy A 94 PRO HBy 1.0 0.0 4.43 3160 2461 A 94 PRO HBx A 93 PRO HBx 1.0 0.0 4.43 3161 2461 A 94 PRO HBx A 93 PRO HBy 1.0 0.0 4.43 3162 2462 A 95 ASN H A 93 PRO HBx 1.0 0.0 4.16 3163 2462 A 95 ASN H A 93 PRO HBy 1.0 0.0 4.16 3164 2463 A 96 GLN H A 93 PRO HBx 1.0 0.0 4.09 3165 2463 A 96 GLN H A 93 PRO HBy 1.0 0.0 4.09 3166 2464 A 93 PRO HGy A 96 GLN HE2x 1.0 0.0 4.73 3167 2464 A 93 PRO HGy A 96 GLN HE2y 1.0 0.0 4.73 3168 2465 A 93 PRO HDy A 96 GLN HE2x 1.0 0.0 5.12 3169 2465 A 93 PRO HDy A 96 GLN HE2y 1.0 0.0 5.12 3170 2466 A 95 ASN H A 94 PRO HBy 1.0 0.0 4.10 3171 2466 A 95 ASN H A 94 PRO HBx 1.0 0.0 4.10 3172 2467 A 94 PRO HGy A 95 ASN HBx 1.0 0.0 5.31 3173 2467 A 94 PRO HGy A 95 ASN HBy 1.0 0.0 5.31 3174 2468 A 94 PRO HDy A 95 ASN HBx 1.0 0.0 4.80 3175 2468 A 94 PRO HDx A 95 ASN HBx 1.0 0.0 4.80 3176 2468 A 95 ASN HBy A 94 PRO HDx 1.0 0.0 4.80 3177 2468 A 94 PRO HDy A 95 ASN HBy 1.0 0.0 4.80 3178 2469 A 95 ASN HD2x A 94 PRO HDx 1.0 0.0 4.26 3179 2469 A 94 PRO HDy A 95 ASN HD2x 1.0 0.0 4.26 3180 2469 A 95 ASN HD2y A 94 PRO HDx 1.0 0.0 4.26 3181 2469 A 94 PRO HDy A 95 ASN HD2y 1.0 0.0 4.26 3182 2470 A 95 ASN H A 95 ASN HBx 1.0 0.0 3.09 3183 2470 A 95 ASN H A 95 ASN HBy 1.0 0.0 3.09 3184 2471 A 95 ASN H A 95 ASN HD2y 1.0 0.0 4.34 3185 2471 A 95 ASN H A 95 ASN HD2x 1.0 0.0 4.34 3186 2472 A 95 ASN HD2y A 95 ASN HBx 1.0 0.0 3.20 3187 2472 A 95 ASN HD2x A 95 ASN HBy 1.0 0.0 3.20 3188 2472 A 95 ASN HD2y A 95 ASN HBy 1.0 0.0 3.20 3189 2472 A 95 ASN HD2x A 95 ASN HBx 1.0 0.0 3.20 3190 2473 A 96 GLN H A 95 ASN HBx 1.0 0.0 4.19 3191 2473 A 96 GLN H A 95 ASN HBy 1.0 0.0 4.19 3192 2474 A 97 ILE HD1% A 95 ASN HBx 1.0 0.0 4.94 3193 2474 A 97 ILE HD1% A 95 ASN HBy 1.0 0.0 4.94 3194 2475 A 96 GLN HGx A 96 GLN HE2x 1.0 0.0 3.55 3195 2475 A 96 GLN HGx A 96 GLN HE2y 1.0 0.0 3.55 3196 2476 A 100 VAL HB A 99 GLY HAx 1.0 0.0 4.54 3197 2476 A 100 VAL HB A 99 GLY HAy 1.0 0.0 4.54 3198 2477 A 99 GLY HAy A 100 VAL HGx% 1.0 0.0 3.99 3199 2477 A 99 GLY HAx A 100 VAL HGx% 1.0 0.0 3.99 3200 2477 A 100 VAL HGy% A 99 GLY HAx 1.0 0.0 3.99 3201 2477 A 100 VAL HGy% A 99 GLY HAy 1.0 0.0 3.99 3202 2478 A 103 GLY H A 104 VAL HGy% 1.0 0.0 5.44 3203 2478 A 103 GLY H A 104 VAL HGx% 1.0 0.0 5.44 3204 2479 A 103 GLY HAx A 104 VAL HGy% 1.0 0.0 3.79 3205 2479 A 103 GLY HAx A 104 VAL HGx% 1.0 0.0 3.79 3206 2480 A 103 GLY HAy A 104 VAL HGy% 1.0 0.0 4.19 3207 2480 A 103 GLY HAy A 104 VAL HGx% 1.0 0.0 4.19 3208 2481 A 104 VAL H A 104 VAL HGy% 1.0 0.0 2.99 3209 2481 A 104 VAL H A 104 VAL HGx% 1.0 0.0 2.99 3210 2482 A 105 PHE H A 104 VAL HGy% 1.0 0.0 3.03 3211 2482 A 105 PHE H A 104 VAL HGx% 1.0 0.0 3.03 3212 2483 A 105 PHE HA A 104 VAL HGy% 1.0 0.0 4.17 3213 2483 A 105 PHE HA A 104 VAL HGx% 1.0 0.0 4.17 3214 2484 A 105 PHE HBy A 104 VAL HGy% 1.0 0.0 4.76 3215 2484 A 105 PHE HBy A 104 VAL HGx% 1.0 0.0 4.76 3216 2485 A 105 PHE HBx A 104 VAL HGy% 1.0 0.0 5.21 3217 2485 A 105 PHE HBx A 104 VAL HGx% 1.0 0.0 5.21 3218 2486 A 105 PHE HD% A 104 VAL HGy% 1.0 0.0 5.22 3219 2486 A 105 PHE HD% A 104 VAL HGx% 1.0 0.0 5.22 3220 2487 A 106 LYS H A 104 VAL HGy% 1.0 0.0 4.51 3221 2487 A 106 LYS H A 104 VAL HGx% 1.0 0.0 4.51 3222 2488 A 106 LYS HBy A 104 VAL HGy% 1.0 0.0 4.72 3223 2488 A 106 LYS HBy A 104 VAL HGx% 1.0 0.0 4.72 3224 2489 A 104 VAL HGy% A 106 LYS HGx 1.0 0.0 4.06 3225 2489 A 104 VAL HGx% A 106 LYS HGx 1.0 0.0 4.06 3226 2489 A 106 LYS HGy A 104 VAL HGy% 1.0 0.0 4.06 3227 2489 A 106 LYS HGy A 104 VAL HGx% 1.0 0.0 4.06 3228 2490 A 104 VAL HGy% A 106 LYS HDx 1.0 0.0 4.44 3229 2490 A 104 VAL HGx% A 106 LYS HDx 1.0 0.0 4.44 3230 2490 A 106 LYS HDy A 104 VAL HGy% 1.0 0.0 4.44 3231 2490 A 106 LYS HDy A 104 VAL HGx% 1.0 0.0 4.44 3232 2491 A 104 VAL HGx% A 106 LYS HEx 1.0 0.0 3.71 3233 2491 A 104 VAL HGy% A 106 LYS HEx 1.0 0.0 3.71 3234 2491 A 106 LYS HEy A 104 VAL HGy% 1.0 0.0 3.71 3235 2491 A 106 LYS HEy A 104 VAL HGx% 1.0 0.0 3.71 stop_ save_ save_CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 11 SER C A 12 TRP N A 12 TRP CA A 12 TRP C 1.0 -140.54 -58.06 PHI 2 2 A 12 TRP C A 13 LYS N A 13 LYS CA A 13 LYS C 1.0 -165.00 -109.30 PHI 3 3 A 13 LYS C A 14 LYS N A 14 LYS CA A 14 LYS C 1.0 -144.34 -66.90 PHI 4 4 A 14 LYS C A 15 ASN N A 15 ASN CA A 15 ASN C 1.0 -97.83 -71.73 PHI 5 5 A 15 ASN C A 16 GLN N A 16 GLN CA A 16 GLN C 1.0 -79.90 -47.92 PHI 6 6 A 16 GLN C A 17 TYR N A 17 TYR CA A 17 TYR C 1.0 -118.70 -68.66 PHI 7 7 A 18 GLY C A 19 THR N A 19 THR CA A 19 THR C 1.0 -104.61 -48.45 PHI 8 8 A 19 THR C A 20 TRP N A 20 TRP CA A 20 TRP C 1.0 -145.33 -70.17 PHI 9 9 A 20 TRP C A 21 TYR N A 21 TYR CA A 21 TYR C 1.0 -162.33 -93.49 PHI 10 10 A 22 LYS C A 23 PRO N A 23 PRO CA A 23 PRO C 1.0 -87.82 -40.02 PHI 11 11 A 23 PRO C A 24 GLU N A 24 GLU CA A 24 GLU C 1.0 -175.63 -67.35 PHI 12 12 A 24 GLU C A 25 ASN N A 25 ASN CA A 25 ASN C 1.0 -136.70 -80.64 PHI 13 13 A 25 ASN C A 26 ALA N A 26 ALA CA A 26 ALA C 1.0 -194.10 -71.90 PHI 14 14 A 26 ALA C A 27 THR N A 27 THR CA A 27 THR C 1.0 -161.35 -78.67 PHI 15 15 A 27 THR C A 28 PHE N A 28 PHE CA A 28 PHE C 1.0 -142.85 -100.09 PHI 16 16 A 28 PHE C A 29 VAL N A 29 VAL CA A 29 VAL C 1.0 -121.03 -86.57 PHI 17 17 A 29 VAL C A 30 ASN N A 30 ASN CA A 30 ASN C 1.0 -138.22 -8.80 PHI 18 18 A 31 GLY C A 32 ASN N A 32 ASN CA A 32 ASN C 1.0 -113.34 -56.96 PHI 19 19 A 32 ASN C A 33 GLN N A 33 GLN CA A 33 GLN C 1.0 -153.52 -103.14 PHI 20 20 A 33 GLN C A 34 PRO N A 34 PRO CA A 34 PRO C 1.0 -78.27 -53.19 PHI 21 21 A 34 PRO C A 35 ILE N A 35 ILE CA A 35 ILE C 1.0 -143.72 -109.96 PHI 22 22 A 35 ILE C A 36 VAL N A 36 VAL CA A 36 VAL C 1.0 -117.86 -44.90 PHI 23 23 A 36 VAL C A 37 THR N A 37 THR CA A 37 THR C 1.0 -134.38 -73.90 PHI 24 24 A 37 THR C A 38 ARG N A 38 ARG CA A 38 ARG C 1.0 -164.16 -115.72 PHI 25 25 A 38 ARG C A 39 ILE N A 39 ILE CA A 39 ILE C 1.0 -132.79 -34.83 PHI 26 26 A 39 ILE C A 40 GLY N A 40 GLY CA A 40 GLY C 1.0 39.72 110.06 PHI 27 27 A 40 GLY C A 41 SER N A 41 SER CA A 41 SER C 1.0 -136.84 -52.16 PHI 28 28 A 42 PRO C A 43 PHE N A 43 PHE CA A 43 PHE C 1.0 -148.67 -82.33 PHI 29 29 A 43 PHE C A 44 LEU N A 44 LEU CA A 44 LEU C 1.0 -76.02 -48.66 PHI 30 30 A 44 LEU C A 45 ASN N A 45 ASN CA A 45 ASN C 1.0 -124.74 -78.96 PHI 31 31 A 45 ASN C A 46 ALA N A 46 ALA CA A 46 ALA C 1.0 -138.60 -8.48 PHI 32 32 A 46 ALA C A 47 PRO N A 47 PRO CA A 47 PRO C 1.0 -84.32 -58.24 PHI 33 33 A 47 PRO C A 48 VAL N A 48 VAL CA A 48 VAL C 1.0 -114.27 -20.47 PHI 34 34 A 50 GLY C A 51 ASN N A 51 ASN CA A 51 ASN C 1.0 -155.31 -66.27 PHI 35 35 A 51 ASN C A 52 LEU N A 52 LEU CA A 52 LEU C 1.0 -143.27 -48.67 PHI 36 36 A 52 LEU C A 53 PRO N A 53 PRO CA A 53 PRO C 1.0 -74.70 -39.58 PHI 37 37 A 54 ALA C A 55 GLY N A 55 GLY CA A 55 GLY C 1.0 69.39 103.99 PHI 38 38 A 55 GLY C A 56 ALA N A 56 ALA CA A 56 ALA C 1.0 -102.84 -51.48 PHI 39 39 A 56 ALA C A 57 THR N A 57 THR CA A 57 THR C 1.0 -156.39 -89.81 PHI 40 40 A 57 THR C A 58 ILE N A 58 ILE CA A 58 ILE C 1.0 -150.05 -90.93 PHI 41 41 A 58 ILE C A 59 VAL N A 59 VAL CA A 59 VAL C 1.0 -116.09 -89.11 PHI 42 42 A 59 VAL C A 60 TYR N A 60 TYR CA A 60 TYR C 1.0 -156.22 -100.58 PHI 43 43 A 60 TYR C A 61 ASP N A 61 ASP CA A 61 ASP C 1.0 -182.86 -73.80 PHI 44 44 A 62 GLU C A 63 VAL N A 63 VAL CA A 63 VAL C 1.0 -149.25 -107.37 PHI 45 45 A 63 VAL C A 64 CYS N A 64 CYS CA A 64 CYS C 1.0 -151.59 -116.63 PHI 46 46 A 64 CYS C A 65 ILE N A 65 ILE CA A 65 ILE C 1.0 -169.21 -92.45 PHI 47 47 A 65 ILE C A 66 GLN N A 66 GLN CA A 66 GLN C 1.0 -173.05 -69.93 PHI 48 48 A 67 ALA C A 68 GLY N A 68 GLY CA A 68 GLY C 1.0 42.21 110.85 PHI 49 49 A 68 GLY C A 69 HIS N A 69 HIS CA A 69 HIS C 1.0 -118.73 -58.27 PHI 50 50 A 69 HIS C A 70 ILE N A 70 ILE CA A 70 ILE C 1.0 -142.72 -84.90 PHI 51 51 A 70 ILE C A 71 TRP N A 71 TRP CA A 71 TRP C 1.0 -133.05 -87.87 PHI 52 52 A 71 TRP C A 72 ILE N A 72 ILE CA A 72 ILE C 1.0 -156.62 -93.62 PHI 53 53 A 73 GLY C A 74 TYR N A 74 TYR CA A 74 TYR C 1.0 -166.88 -79.66 PHI 54 54 A 74 TYR C A 75 ASN N A 75 ASN CA A 75 ASN C 1.0 -165.23 -76.99 PHI 55 55 A 75 ASN C A 76 ALA N A 76 ALA CA A 76 ALA C 1.0 -147.66 -32.18 PHI 56 56 A 76 ALA C A 77 TYR N A 77 TYR CA A 77 TYR C 1.0 -70.05 -49.85 PHI 57 57 A 77 TYR C A 78 ASN N A 78 ASN CA A 78 ASN C 1.0 -104.69 -65.33 PHI 58 58 A 78 ASN C A 79 GLY N A 79 GLY CA A 79 GLY C 1.0 78.29 102.51 PHI 59 59 A 80 ASN C A 81 ARG N A 81 ARG CA A 81 ARG C 1.0 -139.33 -73.39 PHI 60 60 A 81 ARG C A 82 VAL N A 82 VAL CA A 82 VAL C 1.0 -157.53 -85.65 PHI 61 61 A 82 VAL C A 83 TYR N A 83 TYR CA A 83 TYR C 1.0 -150.76 -110.38 PHI 62 62 A 83 TYR C A 84 CYS N A 84 CYS CA A 84 CYS C 1.0 -150.38 -83.14 PHI 63 63 A 84 CYS C A 85 PRO N A 85 PRO CA A 85 PRO C 1.0 -81.45 -49.19 PHI 64 64 A 85 PRO C A 86 VAL N A 86 VAL CA A 86 VAL C 1.0 -155.00 -45.92 PHI 65 65 A 86 VAL C A 87 ARG N A 87 ARG CA A 87 ARG C 1.0 -193.32 -69.82 PHI 66 66 A 89 CYS C A 90 GLN N A 90 GLN CA A 90 GLN C 1.0 -162.66 -62.42 PHI 67 67 A 92 VAL C A 93 PRO N A 93 PRO CA A 93 PRO C 1.0 -87.82 -59.18 PHI 68 68 A 95 ASN C A 96 GLN N A 96 GLN CA A 96 GLN C 1.0 -142.41 -48.19 PHI 69 69 A 96 GLN C A 97 ILE N A 97 ILE CA A 97 ILE C 1.0 -148.69 -70.77 PHI 70 70 A 97 ILE C A 98 PRO N A 98 PRO CA A 98 PRO C 1.0 -90.82 -48.36 PHI 71 71 A 99 GLY C A 100 VAL N A 100 VAL CA A 100 VAL C 1.0 -98.34 -63.92 PHI 72 72 A 100 VAL C A 101 ALA N A 101 ALA CA A 101 ALA C 1.0 -116.12 -37.84 PHI 73 73 A 103 GLY C A 104 VAL N A 104 VAL CA A 104 VAL C 1.0 -166.99 -92.79 PHI 74 74 A 104 VAL C A 105 PHE N A 105 PHE CA A 105 PHE C 1.0 -145.94 -90.80 PHI 75 75 A 12 TRP N A 12 TRP CA A 12 TRP C A 13 LYS N 1.0 105.27 173.85 PSI 76 76 A 13 LYS N A 13 LYS CA A 13 LYS C A 14 LYS N 1.0 135.65 173.09 PSI 77 77 A 14 LYS N A 14 LYS CA A 14 LYS C A 15 ASN N 1.0 107.13 154.11 PSI 78 78 A 15 ASN N A 15 ASN CA A 15 ASN C A 16 GLN N 1.0 99.53 232.65 PSI 79 79 A 16 GLN N A 16 GLN CA A 16 GLN C A 17 TYR N 1.0 -44.19 14.25 PSI 80 80 A 17 TYR N A 17 TYR CA A 17 TYR C A 18 GLY N 1.0 -26.57 38.57 PSI 81 81 A 19 THR N A 19 THR CA A 19 THR C A 20 TRP N 1.0 110.66 165.14 PSI 82 82 A 20 TRP N A 20 TRP CA A 20 TRP C A 21 TYR N 1.0 103.25 169.39 PSI 83 83 A 21 TYR N A 21 TYR CA A 21 TYR C A 22 LYS N 1.0 117.23 184.59 PSI 84 84 A 23 PRO N A 23 PRO CA A 23 PRO C A 24 GLU N 1.0 113.51 171.83 PSI 85 85 A 24 GLU N A 24 GLU CA A 24 GLU C A 25 ASN N 1.0 125.58 166.62 PSI 86 86 A 25 ASN N A 25 ASN CA A 25 ASN C A 26 ALA N 1.0 107.18 160.68 PSI 87 87 A 26 ALA N A 26 ALA CA A 26 ALA C A 27 THR N 1.0 88.56 211.36 PSI 88 88 A 27 THR N A 27 THR CA A 27 THR C A 28 PHE N 1.0 96.43 158.71 PSI 89 89 A 28 PHE N A 28 PHE CA A 28 PHE C A 29 VAL N 1.0 108.30 142.16 PSI 90 90 A 29 VAL N A 29 VAL CA A 29 VAL C A 30 ASN N 1.0 87.64 152.56 PSI 91 91 A 30 ASN N A 30 ASN CA A 30 ASN C A 31 GLY N 1.0 95.21 157.45 PSI 92 92 A 32 ASN N A 32 ASN CA A 32 ASN C A 33 GLN N 1.0 -69.73 20.61 PSI 93 93 A 33 GLN N A 33 GLN CA A 33 GLN C A 34 PRO N 1.0 27.01 164.19 PSI 94 94 A 34 PRO N A 34 PRO CA A 34 PRO C A 35 ILE N 1.0 128.39 172.51 PSI 95 95 A 35 ILE N A 35 ILE CA A 35 ILE C A 36 VAL N 1.0 114.92 150.02 PSI 96 96 A 36 VAL N A 36 VAL CA A 36 VAL C A 37 THR N 1.0 79.10 183.06 PSI 97 97 A 37 THR N A 37 THR CA A 37 THR C A 38 ARG N 1.0 119.03 168.45 PSI 98 98 A 38 ARG N A 38 ARG CA A 38 ARG C A 39 ILE N 1.0 139.46 179.70 PSI 99 99 A 39 ILE N A 39 ILE CA A 39 ILE C A 40 GLY N 1.0 107.66 163.82 PSI 100 100 A 40 GLY N A 40 GLY CA A 40 GLY C A 41 SER N 1.0 -47.93 67.53 PSI 101 101 A 41 SER N A 41 SER CA A 41 SER C A 42 PRO N 1.0 116.07 173.75 PSI 102 102 A 43 PHE N A 43 PHE CA A 43 PHE C A 44 LEU N 1.0 140.77 187.61 PSI 103 103 A 44 LEU N A 44 LEU CA A 44 LEU C A 45 ASN N 1.0 -57.66 15.06 PSI 104 104 A 45 ASN N A 45 ASN CA A 45 ASN C A 46 ALA N 1.0 -20.81 37.15 PSI 105 105 A 46 ALA N A 46 ALA CA A 46 ALA C A 47 PRO N 1.0 83.38 176.66 PSI 106 106 A 47 PRO N A 47 PRO CA A 47 PRO C A 48 VAL N 1.0 135.90 172.14 PSI 107 107 A 49 GLY N A 49 GLY CA A 49 GLY C A 50 GLY N 1.0 -28.25 25.87 PSI 108 108 A 50 GLY N A 50 GLY CA A 50 GLY C A 51 ASN N 1.0 122.03 182.59 PSI 109 109 A 51 ASN N A 51 ASN CA A 51 ASN C A 52 LEU N 1.0 90.38 157.66 PSI 110 110 A 52 LEU N A 52 LEU CA A 52 LEU C A 53 PRO N 1.0 92.32 159.44 PSI 111 111 A 53 PRO N A 53 PRO CA A 53 PRO C A 54 ALA N 1.0 126.64 160.04 PSI 112 112 A 55 GLY N A 55 GLY CA A 55 GLY C A 56 ALA N 1.0 -33.38 22.34 PSI 113 113 A 56 ALA N A 56 ALA CA A 56 ALA C A 57 THR N 1.0 126.79 180.15 PSI 114 114 A 57 THR N A 57 THR CA A 57 THR C A 58 ILE N 1.0 103.81 161.97 PSI 115 115 A 58 ILE N A 58 ILE CA A 58 ILE C A 59 VAL N 1.0 102.58 180.28 PSI 116 116 A 59 VAL N A 59 VAL CA A 59 VAL C A 60 TYR N 1.0 117.63 137.85 PSI 117 117 A 60 TYR N A 60 TYR CA A 60 TYR C A 61 ASP N 1.0 143.32 174.04 PSI 118 118 A 62 GLU N A 62 GLU CA A 62 GLU C A 63 VAL N 1.0 120.35 157.71 PSI 119 119 A 63 VAL N A 63 VAL CA A 63 VAL C A 64 CYS N 1.0 115.23 170.43 PSI 120 120 A 64 CYS N A 64 CYS CA A 64 CYS C A 65 ILE N 1.0 128.83 164.99 PSI 121 121 A 65 ILE N A 65 ILE CA A 65 ILE C A 66 GLN N 1.0 104.95 148.19 PSI 122 122 A 66 GLN N A 66 GLN CA A 66 GLN C A 67 ALA N 1.0 98.49 152.47 PSI 123 123 A 68 GLY N A 68 GLY CA A 68 GLY C A 69 HIS N 1.0 -42.26 54.42 PSI 124 124 A 69 HIS N A 69 HIS CA A 69 HIS C A 70 ILE N 1.0 69.05 206.93 PSI 125 125 A 70 ILE N A 70 ILE CA A 70 ILE C A 71 TRP N 1.0 103.99 153.57 PSI 126 126 A 71 TRP N A 71 TRP CA A 71 TRP C A 72 ILE N 1.0 123.53 178.23 PSI 127 127 A 72 ILE N A 72 ILE CA A 72 ILE C A 73 GLY N 1.0 130.78 176.04 PSI 128 128 A 74 TYR N A 74 TYR CA A 74 TYR C A 75 ASN N 1.0 123.28 181.44 PSI 129 129 A 75 ASN N A 75 ASN CA A 75 ASN C A 76 ALA N 1.0 100.79 165.03 PSI 130 130 A 76 ALA N A 76 ALA CA A 76 ALA C A 77 TYR N 1.0 102.01 202.11 PSI 131 131 A 77 TYR N A 77 TYR CA A 77 TYR C A 78 ASN N 1.0 -49.16 -9.86 PSI 132 132 A 78 ASN N A 78 ASN CA A 78 ASN C A 79 GLY N 1.0 -19.18 21.38 PSI 133 133 A 79 GLY N A 79 GLY CA A 79 GLY C A 80 ASN N 1.0 -20.42 7.06 PSI 134 134 A 81 ARG N A 81 ARG CA A 81 ARG C A 82 VAL N 1.0 87.53 158.87 PSI 135 135 A 82 VAL N A 82 VAL CA A 82 VAL C A 83 TYR N 1.0 120.44 173.84 PSI 136 136 A 83 TYR N A 83 TYR CA A 83 TYR C A 84 CYS N 1.0 120.43 165.73 PSI 137 137 A 84 CYS N A 84 CYS CA A 84 CYS C A 85 PRO N 1.0 71.42 174.56 PSI 138 138 A 85 PRO N A 85 PRO CA A 85 PRO C A 86 VAL N 1.0 119.73 181.31 PSI 139 139 A 86 VAL N A 86 VAL CA A 86 VAL C A 87 ARG N 1.0 -38.70 28.84 PSI 140 140 A 87 ARG N A 87 ARG CA A 87 ARG C A 88 THR N 1.0 151.08 176.20 PSI 141 141 A 91 GLY N A 91 GLY CA A 91 GLY C A 92 VAL N 1.0 96.96 204.42 PSI 142 142 A 93 PRO N A 93 PRO CA A 93 PRO C A 94 PRO N 1.0 116.97 172.69 PSI 143 143 A 95 ASN N A 95 ASN CA A 95 ASN C A 96 GLN N 1.0 81.29 164.87 PSI 144 144 A 96 GLN N A 96 GLN CA A 96 GLN C A 97 ILE N 1.0 104.35 170.13 PSI 145 145 A 97 ILE N A 97 ILE CA A 97 ILE C A 98 PRO N 1.0 80.83 179.89 PSI 146 146 A 98 PRO N A 98 PRO CA A 98 PRO C A 99 GLY N 1.0 125.90 169.60 PSI 147 147 A 100 VAL N A 100 VAL CA A 100 VAL C A 101 ALA N 1.0 87.09 176.55 PSI 148 148 A 102 TRP N A 102 TRP CA A 102 TRP C A 103 GLY N 1.0 0.42 27.28 PSI 149 149 A 104 VAL N A 104 VAL CA A 104 VAL C A 105 PHE N 1.0 114.04 171.70 PSI 150 150 A 105 PHE N A 105 PHE CA A 105 PHE C A 106 LYS N 1.0 103.36 156.96 PSI stop_ save_