data_c18282_2lpy_nmr-data-str save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 2 GLY start . false 2 A 3 GLN middle . . 3 A 4 GLU middle . . 4 A 5 LEU middle . . 5 A 6 SER middle . . 6 A 7 GLN middle . . 7 A 8 HIS middle . . 8 A 9 GLU middle . . 9 A 10 ARG middle . . 10 A 11 TYR middle . . 11 A 12 VAL middle . . 12 A 13 GLU middle . . 13 A 14 GLN middle . . 14 A 15 LEU middle . . 15 A 16 LYS middle . . 16 A 17 GLN middle . . 17 A 18 ALA middle . . 18 A 19 LEU middle . . 19 A 20 LYS middle . . 20 A 21 THR middle . . 21 A 22 ARG middle . . 22 A 23 GLY middle . false 23 A 24 VAL middle . . 24 A 25 LYS middle . . 25 A 26 VAL middle . . 26 A 27 LYS middle . . 27 A 28 TYR middle . . 28 A 29 ALA middle . . 29 A 30 ASP middle . . 30 A 31 LEU middle . . 31 A 32 LEU middle . . 32 A 33 LYS middle . . 33 A 34 PHE middle . . 34 A 35 PHE middle . . 35 A 36 ASP middle . . 36 A 37 PHE middle . . 37 A 38 VAL middle . . 38 A 39 LYS middle . . 39 A 40 ASP middle . . 40 A 41 THR middle . . 41 A 42 CYS middle . . 42 A 43 PRO middle . false 43 A 44 TRP middle . . 44 A 45 PHE middle . . 45 A 46 PRO middle . false 46 A 47 GLN middle . . 47 A 48 GLU middle . . 48 A 49 GLY middle . false 49 A 50 THR middle . . 50 A 51 ILE middle . . 51 A 52 ASP middle . . 52 A 53 ILE middle . . 53 A 54 LYS middle . . 54 A 55 ARG middle . . 55 A 56 TRP middle . . 56 A 57 ARG middle . . 57 A 58 ARG middle . . 58 A 59 VAL middle . . 59 A 60 GLY middle . false 60 A 61 ASP middle . . 61 A 62 CYS middle . . 62 A 63 PHE middle . . 63 A 64 GLN middle . . 64 A 65 ASP middle . . 65 A 66 TYR middle . . 66 A 67 TYR middle . . 67 A 68 ASN middle . . 68 A 69 THR middle . . 69 A 70 PHE middle . . 70 A 71 GLY middle . false 71 A 72 PRO middle . false 72 A 73 GLU middle . . 73 A 74 LYS middle . . 74 A 75 VAL middle . . 75 A 76 PRO middle . false 76 A 77 VAL middle . . 77 A 78 THR middle . . 78 A 79 ALA middle . . 79 A 80 PHE middle . . 80 A 81 SER middle . . 81 A 82 TYR middle . . 82 A 83 TRP middle . . 83 A 84 ASN middle . . 84 A 85 LEU middle . . 85 A 86 ILE middle . . 86 A 87 LYS middle . . 87 A 88 GLU middle . . 88 A 89 LEU middle . . 89 A 90 ILE middle . . 90 A 91 ASP middle . . 91 A 92 LYS middle . . 92 A 93 LYS middle . . 93 A 94 GLU middle . . 94 A 95 VAL middle . . 95 A 96 ASN middle . . 96 A 97 PRO middle . false 97 A 98 GLN middle . . 98 A 99 VAL middle . . 99 A 100 MET middle . . 100 A 101 ALA middle . . 101 A 102 ALA middle . . 102 A 103 VAL middle . . 103 A 104 ALA middle . . 104 A 105 GLN middle . . 105 A 106 THR middle . . 106 A 107 GLU middle . . 107 A 108 GLU middle . . 108 A 109 ILE middle . . 109 A 110 LEU middle . . 110 A 111 LYS middle . . 111 A 112 SER middle . . 112 A 113 ASN middle . . 113 A 114 SER middle . . 114 A 115 GLN middle . . 115 A 116 THR middle . . 116 A 117 ASP middle . . 117 A 118 LEU middle . . 118 A 119 GLU middle . . 119 A 120 HIS middle . . 120 A 121 HIS middle . . 121 A 122 HIS middle . . 122 A 123 HIS middle . . 123 A 124 HIS middle . . 124 A 125 HIS end . . 125 B 1 MYR single . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 2 GLY H H 1 7.2594 0.02 A 2 GLY C C 13 176.8344 0.5 A 2 GLY CA C 13 48.5291 0.5 A 2 GLY N N 15 108.4950 0.5 A 3 GLN H H 1 9.3099 0.002 A 3 GLN HA H 1 3.8955 0.02 A 3 GLN C C 13 178.6723 0.5 A 3 GLN CA C 13 58.7941 0.063 A 3 GLN N N 15 122.2284 0.041 A 4 GLU H H 1 8.4887 0.007 A 4 GLU C C 13 175.5041 0.5 A 4 GLU CA C 13 59.5607 0.131 A 4 GLU CB C 13 28.8759 0.067 A 4 GLU N N 15 119.5292 0.033 A 5 LEU H H 1 8.2100 0.012 A 5 LEU HA H 1 3.7162 0.012 A 5 LEU HBy H 1 1.3784 0.032 A 5 LEU HG H 1 1.0199 0.028 A 5 LEU HDy% H 1 0.8450 0.012 A 5 LEU C C 13 178.2756 0.5 A 5 LEU CA C 13 57.8135 0.152 A 5 LEU CB C 13 40.8437 0.080 A 5 LEU CG C 13 25.1343 0.071 A 5 LEU CDy C 13 21.8382 0.180 A 5 LEU N N 15 114.8317 0.071 A 6 SER H H 1 8.2473 0.028 A 6 SER HA H 1 4.1267 0.004 A 6 SER C C 13 178.5084 0.5 A 6 SER CA C 13 60.4015 0.142 A 6 SER CB C 13 63.5355 0.212 A 6 SER N N 15 109.7259 0.052 A 7 GLN H H 1 8.7189 0.006 A 7 GLN HA H 1 4.0256 0.02 A 7 GLN HBy H 1 1.9942 0.02 A 7 GLN CA C 13 58.4736 0.5 A 7 GLN N N 15 117.2031 0.079 A 8 HIS HBy H 1 3.0275 0.016 A 8 HIS C C 13 178.6224 0.5 A 9 GLU H H 1 7.7009 0.003 A 9 GLU HA H 1 3.9687 0.032 A 9 GLU HBy H 1 1.9933 0.027 A 9 GLU C C 13 178.4081 0.5 A 9 GLU CA C 13 58.2436 0.5 A 9 GLU CB C 13 29.0133 0.077 A 9 GLU CG C 13 36.0746 0.5 A 9 GLU N N 15 120.3566 0.021 A 10 ARG H H 1 8.9097 0.022 A 10 ARG HA H 1 4.1239 0.011 A 10 ARG HBy H 1 1.9089 0.024 A 10 ARG C C 13 178.5992 0.5 A 10 ARG CA C 13 58.6328 0.5 A 10 ARG CB C 13 29.0045 0.175 A 10 ARG CD C 13 42.8720 0.123 A 10 ARG N N 15 118.7907 0.065 A 11 TYR H H 1 7.5619 0.004 A 11 TYR HA H 1 4.1861 0.031 A 11 TYR HBy H 1 3.0863 0.038 A 11 TYR HDx H 1 6.9737 0.038 A 11 TYR HDy H 1 6.9737 0.038 A 11 TYR HEx H 1 7.1831 0.041 A 11 TYR HEy H 1 7.1831 0.041 A 11 TYR C C 13 176.6445 0.5 A 11 TYR CA C 13 61.3108 0.103 A 11 TYR CB C 13 37.9563 0.139 A 11 TYR N N 15 121.2390 0.034 A 12 VAL H H 1 8.0872 0.026 A 12 VAL HA H 1 3.1189 0.024 A 12 VAL HB H 1 2.0734 0.009 A 12 VAL HGx% H 1 0.6344 0.020 A 12 VAL HGy% H 1 1.1279 0.015 A 12 VAL C C 13 177.2752 0.5 A 12 VAL CA C 13 66.9249 0.169 A 12 VAL CB C 13 30.9809 0.143 A 12 VAL CGy C 13 22.9939 0.154 A 12 VAL CGx C 13 20.9904 0.069 A 12 VAL N N 15 119.2488 0.034 A 13 GLU H H 1 8.3121 0.028 A 13 GLU HA H 1 4.2133 0.010 A 13 GLU HBy H 1 2.0664 0.02 A 13 GLU C C 13 175.2067 0.5 A 13 GLU CA C 13 55.9705 0.051 A 13 GLU CB C 13 28.4387 0.5 A 13 GLU N N 15 119.5692 0.06 A 14 GLN H H 1 7.6904 0.18 A 14 GLN HA H 1 3.6566 0.005 A 14 GLN HBy H 1 2.1842 0.03 A 14 GLN HGy H 1 2.5528 0.007 A 14 GLN CA C 13 54.2937 0.057 A 14 GLN CB C 13 29.6812 0.133 A 14 GLN CG C 13 37.0107 0.08 A 14 GLN N N 15 119.3747 0.067 A 15 LEU HA H 1 3.8650 0.012 A 15 LEU HBy H 1 1.8415 0.029 A 15 LEU HG H 1 0.7288 0.017 A 15 LEU HDy% H 1 0.3437 0.005 A 15 LEU CA C 13 58.1768 0.162 A 15 LEU CB C 13 40.6925 0.104 A 15 LEU CG C 13 25.8630 0.113 A 15 LEU CDy C 13 21.9197 0.122 A 16 LYS HA H 1 3.7373 0.012 A 16 LYS HBy H 1 1.7511 0.023 A 16 LYS HGy H 1 1.3502 0.017 A 16 LYS HDy H 1 1.7316 0.021 A 16 LYS HEy H 1 2.9284 0.02 A 16 LYS C C 13 177.8171 0.5 A 16 LYS CA C 13 60.3523 0.146 A 16 LYS CB C 13 32.1057 0.143 A 16 LYS CG C 13 25.8035 0.182 A 16 LYS CD C 13 29.0638 0.203 A 16 LYS CE C 13 41.4666 0.171 A 17 GLN H H 1 7.8618 0.013 A 17 GLN HA H 1 3.8638 0.02 A 17 GLN HB3 H 1 2.0510 0.02 A 17 GLN CA C 13 58.3068 0.5 A 17 GLN CB C 13 27.7878 0.5 A 17 GLN N N 15 117.4981 0.015 A 18 ALA HA H 1 3.7935 0.008 A 18 ALA HB% H 1 1.3697 0.041 A 18 ALA C C 13 179.1469 0.5 A 18 ALA CA C 13 54.7922 0.091 A 18 ALA CB C 13 17.6932 0.128 A 19 LEU H H 1 8.1682 0.021 A 19 LEU HA H 1 3.7842 0.028 A 19 LEU HBy H 1 1.7144 0.027 A 19 LEU HG H 1 0.7442 0.008 A 19 LEU HDy% H 1 0.6347 0.01 A 19 LEU C C 13 174.9355 0.5 A 19 LEU CA C 13 57.7310 0.142 A 19 LEU CB C 13 40.7025 0.117 A 19 LEU CG C 13 25.1334 0.119 A 19 LEU CDy C 13 22.3714 0.190 A 19 LEU N N 15 117.2781 0.124 A 20 LYS H H 1 8.3448 0.008 A 20 LYS C C 13 177.9815 0.5 A 20 LYS CA C 13 60.4392 0.5 A 20 LYS N N 15 118.0255 0.192 A 21 THR H H 1 7.8957 0.022 A 21 THR HA H 1 4.1259 0.01 A 21 THR HB H 1 4.2170 0.014 A 21 THR HG2% H 1 1.3630 0.021 A 21 THR C C 13 175.4686 0.5 A 21 THR CA C 13 64.6434 0.078 A 21 THR CB C 13 68.6520 0.091 A 21 THR CG2 C 13 21.3198 0.169 A 21 THR N N 15 116.3447 0.038 A 22 ARG H H 1 7.3170 0.023 A 22 ARG HA H 1 4.3747 0.022 A 22 ARG HBy H 1 2.1219 0.037 A 22 ARG HGy H 1 1.6074 0.045 A 22 ARG C C 13 176.3641 0.5 A 22 ARG CA C 13 54.1571 0.074 A 22 ARG CB C 13 29.4527 0.07 A 22 ARG N N 15 118.7920 0.19 A 23 GLY H H 1 7.8815 0.025 A 23 GLY HAy H 1 3.8539 0.03 A 23 GLY C C 13 174.1538 0.5 A 23 GLY CA C 13 45.9533 0.5 A 23 GLY N N 15 108.4279 0.026 A 24 VAL H H 1 7.4312 0.012 A 24 VAL HA H 1 4.0361 0.027 A 24 VAL HB H 1 2.0117 0.025 A 24 VAL HGy% H 1 0.9118 0.032 A 24 VAL C C 13 175.6007 0.5 A 24 VAL CA C 13 61.6350 0.152 A 24 VAL CB C 13 32.5886 0.154 A 24 VAL CGy C 13 20.6349 0.137 A 24 VAL N N 15 117.3193 0.066 A 25 LYS H H 1 8.6648 0.01 A 25 LYS HA H 1 4.3356 0.007 A 25 LYS HBy H 1 1.7137 0.021 A 25 LYS HEy H 1 2.9385 0.02 A 25 LYS C C 13 175.5503 0.5 A 25 LYS CA C 13 55.8113 0.108 A 25 LYS CB C 13 32.2692 0.067 A 25 LYS CG C 13 24.6618 0.5 A 25 LYS CD C 13 29.0553 0.5 A 25 LYS CE C 13 41.8716 0.22 A 25 LYS N N 15 127.4240 0.051 A 26 VAL H H 1 7.5454 0.004 A 26 VAL HA H 1 4.1404 0.02 A 26 VAL HB H 1 1.8120 0.026 A 26 VAL HGx% H 1 0.7470 0.019 A 26 VAL HGy% H 1 0.6906 0.014 A 26 VAL C C 13 174.2061 0.5 A 26 VAL CA C 13 60.3158 0.114 A 26 VAL CB C 13 33.9199 0.101 A 26 VAL CGx C 13 20.8328 0.089 A 26 VAL CGy C 13 21.0333 0.077 A 26 VAL N N 15 120.7640 0.054 A 27 LYS H H 1 8.6081 0.012 A 27 LYS HA H 1 4.1154 0.02 A 27 LYS HBy H 1 1.6613 0.005 A 27 LYS HGy H 1 1.5016 0.028 A 27 LYS HDy H 1 1.7068 0.006 A 27 LYS HEy H 1 2.9519 0.02 A 27 LYS CA C 13 55.2106 0.5 A 27 LYS CB C 13 31.9296 0.137 A 27 LYS CG C 13 24.5209 0.173 A 27 LYS CD C 13 28.9923 0.052 A 27 LYS CE C 13 41.8198 0.5 A 27 LYS N N 15 125.7074 0.059 A 28 TYR CA C 13 56.4183 0.5 A 28 TYR CB C 13 37.0365 0.5 A 29 ALA H H 1 8.3261 0.004 A 29 ALA HA H 1 3.7118 0.004 A 29 ALA HB% H 1 1.2311 0.008 A 29 ALA C C 13 180.2103 0.5 A 29 ALA CA C 13 54.9114 0.041 A 29 ALA CB C 13 18.0337 0.069 A 29 ALA N N 15 120.7117 0.148 A 30 ASP H H 1 6.9131 0.024 A 30 ASP HA H 1 4.3788 0.013 A 30 ASP HBy H 1 2.7081 0.029 A 30 ASP C C 13 178.4274 0.5 A 30 ASP CA C 13 56.4591 0.5 A 30 ASP CB C 13 39.9617 0.011 A 30 ASP N N 15 117.1657 0.088 A 31 LEU H H 1 7.5433 0.024 A 31 LEU HA H 1 3.4908 0.009 A 31 LEU HG H 1 0.5948 0.006 A 31 LEU HD2% H 1 0.5616 0.011 A 31 LEU CA C 13 56.8413 0.076 A 31 LEU CB C 13 40.8880 0.159 A 31 LEU CG C 13 25.4690 0.064 A 31 LEU CDy C 13 23.7594 0.105 A 31 LEU N N 15 123.1045 0.07 A 32 LEU HA H 1 3.6110 0.009 A 32 LEU HBy H 1 1.3068 0.01 A 32 LEU HG H 1 0.8029 0.014 A 32 LEU C C 13 179.1197 0.5 A 32 LEU CA C 13 58.1028 0.084 A 32 LEU CB C 13 40.5936 0.127 A 32 LEU CG C 13 25.4037 0.17 A 32 LEU CDy C 13 21.7343 0.105 A 33 LYS H H 1 7.1890 0.033 A 33 LYS HA H 1 4.2017 0.018 A 33 LYS HBy H 1 1.9095 0.009 A 33 LYS C C 13 180.0445 0.5 A 33 LYS CA C 13 59.0808 0.088 A 33 LYS CB C 13 31.7349 0.101 A 33 LYS N N 15 118.0740 0.054 A 34 PHE H H 1 7.7684 0.035 A 34 PHE HBy H 1 3.1509 0.02 A 34 PHE HDx H 1 6.8119 0.004 A 34 PHE HDy H 1 6.8119 0.004 A 34 PHE HEx H 1 7.0015 0.011 A 34 PHE HEy H 1 7.0015 0.011 A 34 PHE CA C 13 60.4024 0.5 A 34 PHE N N 15 122.9774 0.027 A 35 PHE HA H 1 3.7996 0.025 A 35 PHE HBy H 1 2.8974 0.05 A 35 PHE HDx H 1 6.9330 0.012 A 35 PHE HDy H 1 6.9330 0.012 A 35 PHE HEx H 1 6.6371 0.035 A 35 PHE HEy H 1 6.6371 0.035 A 35 PHE C C 13 176.3545 0.5 A 35 PHE CA C 13 61.8128 0.104 A 35 PHE CB C 13 37.1645 0.139 A 36 ASP H H 1 8.3378 0.021 A 36 ASP C C 13 177.0871 0.5 A 36 ASP CA C 13 58.2784 0.5 A 36 ASP CB C 13 39.5781 0.5 A 36 ASP N N 15 119.9685 0.06 A 37 PHE H H 1 7.8596 0.012 A 37 PHE HBy H 1 2.7683 0.01 A 37 PHE HDx H 1 7.5396 0.011 A 37 PHE HDy H 1 7.5396 0.011 A 37 PHE C C 13 178.7880 0.5 A 37 PHE CA C 13 61.4159 0.18 A 37 PHE CB C 13 38.3689 0.5 A 37 PHE N N 15 122.9009 0.079 A 38 VAL H H 1 8.4514 0.015 A 38 VAL HA H 1 3.0996 0.02 A 38 VAL HB H 1 2.3065 0.009 A 38 VAL HGx% H 1 0.6985 0.008 A 38 VAL HGy% H 1 0.5095 0.006 A 38 VAL C C 13 176.1472 0.5 A 38 VAL CA C 13 67.1533 0.135 A 38 VAL CB C 13 30.6248 0.086 A 38 VAL CGy C 13 23.7707 0.104 A 38 VAL CGx C 13 20.9663 0.084 A 38 VAL N N 15 122.3286 0.037 A 39 LYS H H 1 7.5808 0.015 A 39 LYS HA H 1 3.4725 0.016 A 39 LYS HBy H 1 2.0096 0.004 A 39 LYS HGy H 1 1.4033 0.02 A 39 LYS HDy H 1 1.5804 0.02 A 39 LYS HEy H 1 2.9545 0.005 A 39 LYS C C 13 176.3606 0.5 A 39 LYS CA C 13 59.5192 0.098 A 39 LYS CB C 13 31.6278 0.075 A 39 LYS CG C 13 24.7511 0.123 A 39 LYS CD C 13 29.0573 0.168 A 39 LYS CE C 13 41.9340 0.5 A 39 LYS N N 15 118.8366 0.111 A 40 ASP H H 1 8.0520 0.006 A 40 ASP HA H 1 4.2605 0.03 A 40 ASP HBy H 1 2.6198 0.011 A 40 ASP CA C 13 56.5797 0.117 A 40 ASP CB C 13 40.9771 0.165 A 40 ASP N N 15 116.2105 0.036 A 41 THR H H 1 7.2318 0.05 A 41 THR HG1 H 1 6.1414 0.007 A 41 THR C C 13 174.5589 0.5 A 41 THR N N 15 109.2148 0.5 A 42 CYS H H 1 7.1974 0.006 A 42 CYS CA C 13 55.8649 0.5 A 42 CYS CB C 13 28.4998 0.5 A 42 CYS N N 15 117.9274 0.072 A 43 PRO HA H 1 3.9872 0.031 A 43 PRO HBy H 1 2.4449 0.033 A 43 PRO HGy H 1 2.0897 0.024 A 43 PRO HDy H 1 3.9048 0.034 A 43 PRO C C 13 176.6875 0.5 A 43 PRO CA C 13 65.2060 0.126 A 43 PRO CB C 13 30.7673 0.176 A 43 PRO CG C 13 27.1767 0.068 A 43 PRO CD C 13 50.5045 0.226 A 44 TRP H H 1 6.6320 0.006 A 44 TRP HA H 1 4.3606 0.042 A 44 TRP HE1 H 1 9.9586 0.014 A 44 TRP HE3 H 1 7.4869 0.014 A 44 TRP HZ2 H 1 7.0417 0.05 A 44 TRP HZ3 H 1 6.7939 0.05 A 44 TRP C C 13 176.9815 0.5 A 44 TRP CA C 13 61.7580 0.024 A 44 TRP CB C 13 27.7708 0.039 A 44 TRP N N 15 113.8053 0.043 A 44 TRP NE1 N 15 128.3779 0.5 A 45 PHE H H 1 7.3020 0.007 A 45 PHE HA H 1 4.0434 0.012 A 45 PHE HDx H 1 6.7849 0.014 A 45 PHE HDy H 1 6.7849 0.014 A 45 PHE HEx H 1 6.9323 0.05 A 45 PHE HEy H 1 6.9323 0.05 A 45 PHE CA C 13 62.9901 0.104 A 45 PHE CB C 13 35.1087 0.5 A 45 PHE N N 15 123.0188 0.039 A 46 PRO HA H 1 4.0146 0.009 A 46 PRO HBy H 1 2.5579 0.05 A 46 PRO HGy H 1 2.0726 0.031 A 46 PRO HDy H 1 3.3689 0.01 A 46 PRO C C 13 176.4621 0.5 A 46 PRO CA C 13 64.5824 0.117 A 46 PRO CB C 13 30.2540 0.5 A 46 PRO CG C 13 27.8387 0.5 A 46 PRO CD C 13 49.2874 0.12 A 47 GLN H H 1 6.5442 0.026 A 47 GLN HA H 1 3.9405 0.005 A 47 GLN HBy H 1 2.1064 0.005 A 47 GLN C C 13 177.2338 0.5 A 47 GLN CA C 13 58.3283 0.167 A 47 GLN CB C 13 28.4713 0.196 A 47 GLN CG C 13 33.7498 0.5 A 47 GLN N N 15 114.4041 0.183 A 48 GLU H H 1 7.7098 0.01 A 48 GLU HA H 1 4.0853 0.012 A 48 GLU HBy H 1 2.1316 0.035 A 48 GLU HGy H 1 2.5563 0.014 A 48 GLU C C 13 179.1303 0.5 A 48 GLU CA C 13 58.2152 0.139 A 48 GLU CB C 13 29.2472 0.1 A 48 GLU CG C 13 33.5324 0.5 A 48 GLU N N 15 117.3559 0.057 A 49 GLY H H 1 7.2959 0.013 A 49 GLY HAy H 1 3.5773 0.05 A 49 GLY C C 13 171.0062 0.5 A 49 GLY CA C 13 47.0854 0.016 A 49 GLY N N 15 105.4558 0.073 A 50 THR H H 1 7.5991 0.006 A 50 THR HA H 1 4.2476 0.02 A 50 THR HB H 1 3.5107 0.008 A 50 THR HG2% H 1 1.1348 0.025 A 50 THR CA C 13 61.8302 0.088 A 50 THR CB C 13 70.6924 0.184 A 50 THR CG2 C 13 20.4543 0.5 A 50 THR N N 15 114.0149 0.087 A 51 ILE HA H 1 4.1350 0.019 A 51 ILE HB H 1 1.9859 0.011 A 51 ILE HG1y H 1 1.2655 0.011 A 51 ILE HG2% H 1 0.6242 0.011 A 51 ILE HD1% H 1 0.6223 0.014 A 51 ILE C C 13 172.6078 0.5 A 51 ILE CA C 13 59.0750 0.181 A 51 ILE CB C 13 35.4159 0.131 A 51 ILE CG1 C 13 26.5168 0.135 A 51 ILE CG2 C 13 17.7612 0.189 A 51 ILE CD1 C 13 12.4797 0.105 A 52 ASP H H 1 7.1761 0.026 A 52 ASP HA H 1 4.6249 0.014 A 52 ASP HBy H 1 2.7215 0.005 A 52 ASP C C 13 175.7700 0.5 A 52 ASP CA C 13 51.6342 0.164 A 52 ASP CB C 13 42.5280 0.5 A 52 ASP N N 15 121.8586 0.174 A 53 ILE H H 1 8.7774 0.018 A 53 ILE HA H 1 4.1499 0.014 A 53 ILE HB H 1 1.9414 0.021 A 53 ILE HG1y H 1 1.5550 0.010 A 53 ILE HG2% H 1 1.0553 0.007 A 53 ILE HD1% H 1 0.9821 0.02 A 53 ILE C C 13 176.9611 0.5 A 53 ILE CA C 13 61.8992 0.117 A 53 ILE CB C 13 37.7003 0.5 A 53 ILE CG1 C 13 28.3247 0.11 A 53 ILE CG2 C 13 17.9641 0.091 A 53 ILE CD1 C 13 13.3700 0.11 A 53 ILE N N 15 119.5492 0.071 A 54 LYS H H 1 8.1061 0.01 A 54 LYS HA H 1 4.1163 0.005 A 54 LYS HBy H 1 1.9073 0.011 A 54 LYS C C 13 180.4481 0.5 A 54 LYS CA C 13 59.9339 0.087 A 54 LYS CB C 13 31.8750 0.5 A 54 LYS CG C 13 24.9421 0.5 A 54 LYS CD C 13 29.2171 0.5 A 54 LYS CE C 13 41.9354 0.5 A 54 LYS N N 15 123.5146 0.048 A 55 ARG H H 1 9.1829 0.004 A 55 ARG HA H 1 4.4220 0.003 A 55 ARG HGy H 1 1.4270 0.031 A 55 ARG C C 13 179.1585 0.5 A 55 ARG CA C 13 59.7259 0.117 A 55 ARG N N 15 120.3706 0.087 A 56 TRP H H 1 8.9267 0.009 A 56 TRP HA H 1 4.7473 0.005 A 56 TRP HBy H 1 3.3082 0.015 A 56 TRP HZ2 H 1 7.2699 0.04 A 56 TRP HZ3 H 1 6.6552 0.032 A 56 TRP HH2 H 1 7.0336 0.049 A 56 TRP C C 13 179.9542 0.5 A 56 TRP CA C 13 60.1047 0.077 A 56 TRP CB C 13 29.9971 0.5 A 56 TRP N N 15 120.7552 0.082 A 57 ARG H H 1 9.2205 0.03 A 57 ARG HA H 1 4.4056 0.006 A 57 ARG HB3 H 1 2.1782 0.006 A 57 ARG C C 13 178.1012 0.5 A 57 ARG CA C 13 60.1984 0.121 A 57 ARG CB C 13 29.5855 0.109 A 57 ARG N N 15 122.1943 0.111 A 58 ARG H H 1 7.6053 0.002 A 58 ARG HA H 1 4.1858 0.003 A 58 ARG HBy H 1 2.1913 0.013 A 58 ARG C C 13 179.4449 0.5 A 58 ARG CA C 13 59.8320 0.1 A 58 ARG CB C 13 29.7534 0.059 A 58 ARG N N 15 120.6744 0.056 A 59 VAL H H 1 7.8188 0.007 A 59 VAL HA H 1 3.6752 0.005 A 59 VAL HB H 1 1.4889 0.031 A 59 VAL HGx% H 1 -0.4147 0.006 A 59 VAL HGy% H 1 0.4454 0.009 A 59 VAL C C 13 176.5648 0.5 A 59 VAL CA C 13 65.9197 0.1 A 59 VAL CB C 13 30.7850 0.059 A 59 VAL CGy C 13 22.7347 0.088 A 59 VAL CGx C 13 20.4342 0.073 A 59 VAL N N 15 121.8328 0.081 A 60 GLY H H 1 7.5404 0.01 A 60 GLY HAx H 1 4.3121 0.05 A 60 GLY C C 13 175.9226 0.5 A 60 GLY CA C 13 45.9820 0.5 A 60 GLY N N 15 106.5213 0.054 A 61 ASP H H 1 8.1972 0.003 A 61 ASP HA H 1 4.2611 0.006 A 61 ASP HBy H 1 2.6950 0.016 A 61 ASP C C 13 178.5367 0.5 A 61 ASP CA C 13 56.9068 0.05 A 61 ASP CB C 13 39.6535 0.058 A 61 ASP N N 15 123.0655 0.03 A 62 CYS H H 1 7.8581 0.021 A 62 CYS C C 13 177.0825 0.5 A 62 CYS CA C 13 62.3803 0.094 A 62 CYS CB C 13 26.0109 0.025 A 62 CYS N N 15 121.0051 0.044 A 63 PHE H H 1 8.5296 0.011 A 63 PHE HA H 1 4.1174 0.011 A 63 PHE HE1 H 1 7.2582 0.044 A 63 PHE HE2 H 1 7.2582 0.044 A 63 PHE C C 13 178.0811 0.5 A 63 PHE CA C 13 57.8430 0.2 A 63 PHE CB C 13 36.6052 0.071 A 63 PHE N N 15 119.3615 0.299 A 64 GLN H H 1 8.2361 0.003 A 64 GLN HA H 1 4.1992 0.011 A 64 GLN HBx H 1 2.0111 0.013 A 64 GLN HBy H 1 2.2092 0.031 A 64 GLN HGy H 1 2.4708 0.05 A 64 GLN C C 13 177.6451 0.5 A 64 GLN CA C 13 59.0939 0.094 A 64 GLN CB C 13 28.3372 0.5 A 64 GLN CG C 13 33.6222 0.134 A 64 GLN N N 15 118.8290 0.092 A 65 ASP H H 1 8.2569 0.003 A 65 ASP HA H 1 4.4805 0.034 A 65 ASP HBy H 1 2.8002 0.014 A 65 ASP CA C 13 57.3008 0.089 A 65 ASP CB C 13 40.7731 0.149 A 65 ASP N N 15 120.2340 0.092 A 66 TYR HA H 1 4.5977 0.007 A 66 TYR HBy H 1 3.2578 0.038 A 66 TYR HDx H 1 7.2366 0.035 A 66 TYR HDy H 1 7.2366 0.035 A 66 TYR HEx H 1 6.8938 0.05 A 66 TYR HEy H 1 6.8938 0.05 A 66 TYR C C 13 178.5242 0.5 A 66 TYR CA C 13 60.3546 0.116 A 66 TYR CB C 13 37.7963 0.018 A 67 TYR H H 1 9.0831 0.007 A 67 TYR HA H 1 4.0441 0.006 A 67 TYR HBy H 1 3.3058 0.039 A 67 TYR HEx H 1 6.5800 0.025 A 67 TYR HEy H 1 6.5800 0.025 A 67 TYR C C 13 178.2196 0.5 A 67 TYR CA C 13 61.7261 0.141 A 67 TYR CB C 13 38.9323 0.127 A 67 TYR N N 15 122.7411 0.038 A 68 ASN H H 1 8.7964 0.003 A 68 ASN HA H 1 4.3777 0.023 A 68 ASN HBy H 1 2.9845 0.064 A 68 ASN C C 13 176.6326 0.5 A 68 ASN CA C 13 55.2934 0.087 A 68 ASN CB C 13 37.8597 0.5 A 68 ASN N N 15 118.5301 0.093 A 69 THR H H 1 7.9603 0.007 A 69 THR HA H 1 3.8723 0.021 A 69 THR HB H 1 3.6046 0.012 A 69 THR HG2% H 1 0.3130 0.003 A 69 THR C C 13 174.8319 0.5 A 69 THR CA C 13 65.2236 0.13 A 69 THR CB C 13 69.4836 0.5 A 69 THR CG2 C 13 20.4235 0.06 A 69 THR N N 15 114.3280 0.064 A 70 PHE H H 1 8.5906 0.03 A 70 PHE HA H 1 4.6259 0.025 A 70 PHE HBy H 1 2.7075 0.05 A 70 PHE HDx H 1 7.1727 0.027 A 70 PHE HDy H 1 7.1727 0.027 A 70 PHE C C 13 176.4954 0.5 A 70 PHE CA C 13 58.4094 0.099 A 70 PHE CB C 13 40.7416 0.104 A 70 PHE N N 15 118.1071 0.02 A 71 GLY H H 1 7.8932 0.014 A 71 GLY HAy H 1 3.5022 0.05 A 71 GLY CA C 13 44.6839 0.5 A 71 GLY N N 15 109.3092 0.054 A 72 PRO HA H 1 4.6909 0.009 A 72 PRO HBy H 1 2.4487 0.019 A 72 PRO HGy H 1 2.0316 0.018 A 72 PRO HDy H 1 3.2773 0.019 A 72 PRO C C 13 177.7716 0.5 A 72 PRO CA C 13 63.4578 0.138 A 72 PRO CB C 13 31.8231 0.164 A 72 PRO CG C 13 26.9963 0.108 A 72 PRO CD C 13 49.9004 0.172 A 73 GLU H H 1 8.5953 0.007 A 73 GLU HA H 1 4.0605 0.036 A 73 GLU HBy H 1 1.9906 0.005 A 73 GLU HGy H 1 2.4497 0.009 A 73 GLU C C 13 177.2356 0.5 A 73 GLU CA C 13 58.5699 0.169 A 73 GLU CB C 13 28.8530 0.103 A 73 GLU CG C 13 36.1405 0.135 A 73 GLU N N 15 117.4206 0.08 A 74 LYS H H 1 7.4934 0.019 A 74 LYS HA H 1 4.3813 0.019 A 74 LYS HBy H 1 1.6127 0.017 A 74 LYS HGy H 1 1.2961 0.004 A 74 LYS HDy H 1 1.9703 0.01 A 74 LYS C C 13 175.6616 0.5 A 74 LYS CA C 13 55.2634 0.156 A 74 LYS CB C 13 33.8906 0.17 A 74 LYS CG C 13 24.6897 0.5 A 74 LYS CD C 13 27.5384 0.5 A 74 LYS CE C 13 42.0128 0.5 A 74 LYS N N 15 116.8461 0.101 A 75 VAL H H 1 7.3419 0.02 A 75 VAL HA H 1 4.4228 0.019 A 75 VAL HB H 1 2.1952 0.021 A 75 VAL HGy% H 1 0.5112 0.511 A 75 VAL CA C 13 58.4381 0.061 A 75 VAL CB C 13 33.7630 0.140 A 75 VAL CG2 C 13 20.9684 0.130 A 75 VAL N N 15 118.0557 0.054 A 76 PRO HA H 1 4.5850 0.003 A 76 PRO HBy H 1 2.2564 0.011 A 76 PRO HGy H 1 1.7348 0.05 A 76 PRO HDy H 1 2.7183 0.007 A 76 PRO C C 13 178.5435 0.5 A 76 PRO CA C 13 61.9112 0.157 A 76 PRO CB C 13 32.0353 0.128 A 76 PRO CG C 13 26.9439 0.5 A 76 PRO CD C 13 50.0475 0.095 A 77 VAL H H 1 8.6040 0.006 A 77 VAL HA H 1 3.9208 0.007 A 77 VAL HB H 1 2.2227 0.015 A 77 VAL HGy% H 1 1.0712 0.03 A 77 VAL CA C 13 65.3156 0.081 A 77 VAL CB C 13 31.3163 0.112 A 77 VAL CG2 C 13 20.8494 0.116 A 77 VAL N N 15 119.8253 0.046 A 78 THR H H 1 7.3798 0.012 A 78 THR HA H 1 3.9142 0.021 A 78 THR HB H 1 3.8825 0.024 A 78 THR HG2% H 1 1.1119 0.02 A 78 THR C C 13 175.7323 0.5 A 78 THR CA C 13 62.8032 0.112 A 78 THR CB C 13 68.3566 0.116 A 78 THR CG2 C 13 22.0189 0.04 A 78 THR N N 15 109.3897 0.098 A 79 ALA H H 1 7.8109 0.006 A 79 ALA HA H 1 4.0010 0.009 A 79 ALA HB% H 1 0.8079 0.032 A 79 ALA C C 13 179.5268 0.5 A 79 ALA CA C 13 55.0913 0.036 A 79 ALA CB C 13 17.5607 0.129 A 79 ALA N N 15 123.6608 0.084 A 80 PHE H H 1 7.3055 0.016 A 80 PHE HA H 1 4.4520 0.009 A 80 PHE HBy H 1 2.9615 0.035 A 80 PHE HDx H 1 6.9349 0.05 A 80 PHE HDy H 1 6.9349 0.05 A 80 PHE C C 13 178.5856 0.5 A 80 PHE CA C 13 61.6555 0.111 A 80 PHE CB C 13 37.6941 0.139 A 80 PHE N N 15 114.2583 0.031 A 81 SER H H 1 7.7333 0.015 A 81 SER CA C 13 61.8238 0.5 A 81 SER N N 15 116.8649 0.059 A 82 TYR H H 1 8.1506 0.005 A 82 TYR HA H 1 4.1330 0.05 A 82 TYR HBy H 1 1.5880 0.002 A 82 TYR HDx H 1 7.4545 0.02 A 82 TYR HDy H 1 7.4545 0.02 A 82 TYR HEx H 1 6.5577 0.05 A 82 TYR HEy H 1 6.5577 0.05 A 82 TYR C C 13 177.7008 0.5 A 82 TYR CA C 13 60.0272 0.5 A 82 TYR CB C 13 34.1040 0.038 A 82 TYR N N 15 121.9317 0.058 A 83 TRP H H 1 8.6450 0.021 A 83 TRP HA H 1 4.4355 0.018 A 83 TRP HBy H 1 3.6338 0.004 A 83 TRP CA C 13 63.9751 0.095 A 83 TRP CB C 13 28.5572 0.101 A 83 TRP N N 15 120.8168 0.057 A 84 ASN HA H 1 4.2301 0.01 A 84 ASN HBy H 1 2.9110 0.009 A 84 ASN C C 13 176.1404 0.5 A 84 ASN CA C 13 56.6827 0.016 A 84 ASN CB C 13 39.1156 0.067 A 85 LEU H H 1 7.7511 0.013 A 85 LEU HA H 1 4.0542 0.012 A 85 LEU HBy H 1 1.7669 0.022 A 85 LEU HG H 1 1.7496 0.022 A 85 LEU HDy% H 1 0.8031 0.022 A 85 LEU C C 13 178.3685 0.5 A 85 LEU CA C 13 58.2276 0.112 A 85 LEU CB C 13 41.5756 0.155 A 85 LEU CG C 13 26.0507 0.075 A 85 LEU CDy C 13 25.3790 0.232 A 85 LEU N N 15 121.8838 0.032 A 86 ILE H H 1 7.9525 0.026 A 86 ILE HA H 1 3.4621 0.013 A 86 ILE HB H 1 1.9762 0.013 A 86 ILE HG1y H 1 1.4438 0.029 A 86 ILE HG2% H 1 -0.4912 0.011 A 86 ILE HD1% H 1 0.8200 0.019 A 86 ILE C C 13 176.8089 0.5 A 86 ILE CA C 13 61.3454 0.135 A 86 ILE CB C 13 34.0988 0.245 A 86 ILE CG1 C 13 27.4995 0.158 A 86 ILE CG2 C 13 16.2516 0.101 A 86 ILE CD1 C 13 9.2365 0.101 A 86 ILE N N 15 116.8246 0.076 A 87 LYS H H 1 7.8758 0.025 A 87 LYS HA H 1 3.2307 0.025 A 87 LYS HGy H 1 1.7470 0.028 A 87 LYS C C 13 177.2211 0.5 A 87 LYS CA C 13 60.0334 0.09 A 87 LYS CB C 13 31.0054 0.062 A 87 LYS CG C 13 23.9580 0.5 A 87 LYS CD C 13 29.0074 0.5 A 87 LYS CE C 13 42.2085 0.5 A 87 LYS N N 15 121.8464 0.015 A 88 GLU H H 1 7.6790 0.015 A 88 GLU HA H 1 3.8612 0.006 A 88 GLU HBy H 1 2.0439 0.03 A 88 GLU HGy H 1 2.2596 0.016 A 88 GLU C C 13 178.8096 0.5 A 88 GLU CA C 13 58.9486 0.165 A 88 GLU CB C 13 29.2210 0.101 A 88 GLU CG C 13 35.8015 0.17 A 88 GLU N N 15 116.3306 0.036 A 89 LEU H H 1 7.4407 0.016 A 89 LEU HA H 1 3.9093 0.006 A 89 LEU HBy H 1 1.2249 0.033 A 89 LEU HG H 1 0.6405 0.007 A 89 LEU HDy% H 1 0.6225 0.012 A 89 LEU CA C 13 57.6881 0.086 A 89 LEU CB C 13 41.4357 0.117 A 89 LEU CG C 13 25.5798 0.167 A 89 LEU CDy C 13 22.7490 0.12 A 89 LEU N N 15 118.0902 0.02 A 90 ILE HA H 1 3.3439 0.007 A 90 ILE HB H 1 1.9789 0.028 A 90 ILE HG1y H 1 1.6202 0.006 A 90 ILE HG2% H 1 0.6075 0.019 A 90 ILE HD1% H 1 0.0245 0.015 A 90 ILE CA C 13 65.0817 0.106 A 90 ILE CB C 13 37.5558 0.161 A 90 ILE CG1 C 13 28.1388 0.140 A 90 ILE CG2 C 13 17.2421 0.146 A 90 ILE CD1 C 13 13.2509 0.134 A 91 ASP HA H 1 3.8941 0.05 A 91 ASP CA C 13 57.6785 0.5 A 91 ASP CB C 13 40.5461 0.5 A 92 LYS H H 1 7.9030 0.012 A 92 LYS HBy H 1 1.8980 0.045 A 92 LYS CA C 13 54.6000 0.5 A 92 LYS CB C 13 32.0142 0.5 A 92 LYS N N 15 119.4219 0.122 A 93 LYS HA H 1 4.5407 0.05 A 93 LYS HBy H 1 1.7532 0.05 A 93 LYS HGy H 1 1.4888 0.05 A 93 LYS HDy H 1 1.6406 0.05 A 93 LYS HEy H 1 3.0667 0.05 A 93 LYS CA C 13 55.2017 0.047 A 93 LYS CB C 13 31.7576 0.151 A 93 LYS CG C 13 24.7737 0.5 A 93 LYS CD C 13 29.0884 0.5 A 93 LYS CE C 13 41.9735 0.5 A 94 GLU H H 1 8.1405 0.004 A 94 GLU HA H 1 4.2833 0.021 A 94 GLU HBy H 1 2.0050 0.002 A 94 GLU C C 13 175.6133 0.5 A 94 GLU CA C 13 56.2961 0.5 A 94 GLU CB C 13 29.4154 0.119 A 94 GLU CG C 13 36.0902 0.5 A 94 GLU N N 15 115.9221 0.109 A 95 VAL H H 1 8.0029 0.002 A 95 VAL HA H 1 3.7732 0.003 A 95 VAL HB H 1 2.0646 0.006 A 95 VAL HGy% H 1 0.8809 0.027 A 95 VAL CA C 13 62.2566 0.043 A 95 VAL CB C 13 32.0475 0.238 A 95 VAL CGy C 13 20.2930 0.5 A 95 VAL N N 15 121.3042 0.052 A 96 ASN H H 1 7.5185 0.003 A 97 PRO HA H 1 4.3192 0.008 A 97 PRO HBy H 1 2.4024 0.013 A 97 PRO HDy H 1 3.6783 0.006 A 97 PRO C C 13 179.0877 0.5 A 97 PRO CA C 13 64.9625 0.150 A 97 PRO CB C 13 32.0352 0.065 A 97 PRO CD C 13 49.8270 0.053 A 98 GLN H H 1 8.3506 0.036 A 98 GLN HA H 1 3.9518 0.011 A 98 GLN HBy H 1 2.0329 0.015 A 98 GLN HGy H 1 2.4268 0.018 A 98 GLN C C 13 179.2716 0.5 A 98 GLN CA C 13 55.6914 0.113 A 98 GLN CB C 13 28.3783 0.173 A 98 GLN CG C 13 33.4670 0.038 A 98 GLN N N 15 117.7928 0.112 A 99 VAL H H 1 7.9008 0.024 A 99 VAL HA H 1 3.4401 0.011 A 99 VAL HB H 1 2.1389 0.016 A 99 VAL HGx% H 1 0.8256 0.01 A 99 VAL HGy% H 1 0.8582 0.023 A 99 VAL CA C 13 67.7757 0.063 A 99 VAL CB C 13 31.5738 0.098 A 99 VAL CGx C 13 21.6638 0.038 A 99 VAL CGy C 13 21.8547 0.147 A 99 VAL N N 15 121.2469 0.036 A 101 ALA HA H 1 4.2180 0.009 A 101 ALA HB% H 1 1.4084 0.011 A 101 ALA C C 13 179.5986 0.5 A 101 ALA CA C 13 54.6851 0.08 A 101 ALA CB C 13 17.5620 0.088 A 102 ALA H H 1 7.5589 0.016 A 102 ALA HA H 1 4.0045 0.004 A 102 ALA HB% H 1 1.3065 0.018 A 102 ALA C C 13 180.9699 0.5 A 102 ALA CA C 13 55.0133 0.075 A 102 ALA CB C 13 17.4220 0.088 A 102 ALA N N 15 119.5334 0.015 A 103 VAL H H 1 8.8506 0.007 A 103 VAL HA H 1 4.0866 0.017 A 103 VAL HB H 1 2.0515 0.037 A 103 VAL HGy% H 1 0.8242 0.018 A 103 VAL C C 13 175.6657 0.5 A 103 VAL CA C 13 61.8498 0.075 A 103 VAL CB C 13 32.5760 0.094 A 103 VAL CGy C 13 20.6504 0.096 A 103 VAL N N 15 122.6692 0.025 A 104 ALA H H 1 8.3741 0.004 A 104 ALA HA H 1 4.2881 0.003 A 104 ALA HB% H 1 1.3801 0.04 A 104 ALA C C 13 177.3439 0.5 A 104 ALA CA C 13 52.1941 0.076 A 104 ALA CB C 13 19.0212 0.056 A 104 ALA N N 15 128.0477 0.055 A 105 GLN H H 1 8.3743 0.003 A 105 GLN HA H 1 4.2811 0.05 A 105 GLN HBy H 1 1.8352 0.05 A 105 GLN CA C 13 55.6556 0.5 A 105 GLN CB C 13 32.5806 0.5 A 105 GLN N N 15 120.2846 0.031 A 106 THR HA H 1 4.2932 0.047 A 106 THR HB H 1 4.2196 0.05 A 106 THR C C 13 174.3836 0.5 A 106 THR CA C 13 61.6628 0.193 A 106 THR CB C 13 69.4583 0.05 A 107 GLU H H 1 8.4148 0.003 A 107 GLU HA H 1 4.2410 0.002 A 107 GLU HBy H 1 1.9208 0.023 A 107 GLU C C 13 176.3310 0.5 A 107 GLU CA C 13 56.6210 0.052 A 107 GLU CB C 13 30.0044 0.059 A 107 GLU CG C 13 36.0098 0.5 A 107 GLU N N 15 122.7442 0.024 A 108 GLU H H 1 8.3340 0.01 A 108 GLU HA H 1 4.1840 0.006 A 108 GLU HBy H 1 1.8649 0.035 A 108 GLU HGy H 1 2.1664 0.007 A 108 GLU C C 13 176.4039 0.5 A 108 GLU CA C 13 56.7214 0.082 A 108 GLU CB C 13 29.7697 0.235 A 108 GLU CG C 13 35.9186 0.067 A 108 GLU N N 15 121.9935 0.035 A 109 ILE H H 1 8.0683 0.027 A 109 ILE HA H 1 4.0517 0.006 A 109 ILE HB H 1 1.8096 0.005 A 109 ILE HG1x H 1 1.1411 0.021 A 109 ILE HG1y H 1 1.4345 0.002 A 109 ILE HG2% H 1 0.8484 0.012 A 109 ILE HD1% H 1 0.8045 0.006 A 109 ILE C C 13 176.2614 0.5 A 109 ILE CA C 13 61.2452 0.151 A 109 ILE CB C 13 38.1572 0.078 A 109 ILE CG1 C 13 27.1299 0.067 A 109 ILE CG2 C 13 17.2810 0.114 A 109 ILE CD1 C 13 12.4997 0.046 A 109 ILE N N 15 122.2043 0.02 A 110 LEU H H 1 8.1874 0.013 A 110 LEU HA H 1 4.2953 0.01 A 110 LEU HBy H 1 1.5833 0.02 A 110 LEU HG H 1 1.5156 0.051 A 110 LEU C C 13 177.2753 0.5 A 110 LEU CA C 13 55.1034 0.114 A 110 LEU CB C 13 41.9293 0.167 A 110 LEU CG C 13 26.8036 0.113 A 110 LEU CDy C 13 23.8371 0.112 A 110 LEU N N 15 125.6077 0.024 A 111 LYS H H 1 8.2056 0.007 A 111 LYS HA H 1 4.2781 0.005 A 111 LYS HBy H 1 1.7935 0.016 A 111 LYS HGy H 1 1.3806 0.028 A 111 LYS HDy H 1 1.6371 0.01 A 111 LYS C C 13 176.6056 0.5 A 111 LYS CA C 13 56.1246 0.114 A 111 LYS CB C 13 32.4229 0.167 A 111 LYS CG C 13 24.5683 0.065 A 111 LYS CD C 13 28.9473 0.145 A 111 LYS CE C 13 41.9298 0.026 A 111 LYS N N 15 122.1537 0.059 A 112 SER H H 1 8.2173 0.013 A 112 SER HA H 1 4.3949 0.002 A 112 SER HBy H 1 3.8396 0.05 A 112 SER HBx H 1 3.8394 0.05 A 112 SER C C 13 175.1680 0.5 A 112 SER CA C 13 58.4555 0.177 A 112 SER CB C 13 63.4946 0.035 A 112 SER N N 15 116.3809 0.278 A 113 ASN H H 1 7.9495 0.006 A 113 ASN HA H 1 4.6988 0.016 A 113 ASN HBy H 1 2.7581 0.024 A 113 ASN C C 13 175.5518 0.5 A 113 ASN CA C 13 53.5920 0.219 A 113 ASN CB C 13 38.7723 0.111 A 113 ASN N N 15 119.7985 0.034 A 114 SER H H 1 7.9701 0.007 A 114 SER HA H 1 4.3822 0.05 A 114 SER HBy H 1 3.8617 0.022 A 114 SER C C 13 174.5583 0.5 A 114 SER CA C 13 58.9187 0.013 A 114 SER CB C 13 63.4943 0.05 A 114 SER N N 15 115.4299 0.016 A 115 GLN H H 1 8.3820 0.002 A 115 GLN HA H 1 4.3474 0.05 A 115 GLN HBy H 1 2.0877 0.026 A 115 GLN C C 13 176.2463 0.5 A 115 GLN CA C 13 56.0356 0.036 A 115 GLN CB C 13 29.1958 0.5 A 115 GLN N N 15 121.9728 0.04 A 116 THR H H 1 8.0699 0.005 A 116 THR HA H 1 4.2376 0.013 A 116 THR HB H 1 4.1647 0.01 A 116 THR C C 13 174.2763 0.5 A 116 THR CA C 13 62.2212 0.088 A 116 THR CB C 13 69.4054 0.014 A 116 THR N N 15 114.7008 0.054 A 117 ASP H H 1 8.2880 0.007 A 117 ASP HA H 1 4.5751 0.004 A 117 ASP HBy H 1 2.6909 0.015 A 117 ASP C C 13 176.2406 0.5 A 117 ASP CA C 13 54.2864 0.109 A 117 ASP CB C 13 40.6090 0.028 A 117 ASP N N 15 122.5657 0.014 A 118 LEU H H 1 8.0877 0.004 A 118 LEU HA H 1 4.1632 0.015 A 118 LEU HBy H 1 1.5370 0.021 A 118 LEU HG H 1 0.8355 0.22 A 118 LEU HDy% H 1 0.7556 0.04 A 118 LEU C C 13 177.6367 0.5 A 118 LEU CA C 13 55.4751 0.112 A 118 LEU CB C 13 41.9639 0.185 A 118 LEU CG C 13 24.7501 0.066 A 118 LEU CDy C 13 23.0796 0.1 A 118 LEU N N 15 122.1176 0.029 A 119 GLU H H 1 8.1344 0.005 A 119 GLU HA H 1 4.0860 0.018 A 119 GLU C C 13 176.2648 0.5 A 119 GLU CA C 13 56.5694 0.073 A 119 GLU CB C 13 29.4858 0.105 A 119 GLU CG C 13 35.8965 0.5 A 119 GLU N N 15 119.5271 0.051 A 120 HIS H H 1 8.1341 0.003 A 120 HIS HA H 1 4.4847 0.05 A 120 HIS HBy H 1 3.0570 0.05 A 120 HIS CA C 13 55.4216 0.011 A 120 HIS CB C 13 28.6284 0.011 A 120 HIS N N 15 118.0762 0.067 A 121 HIS H H 1 8.3719 0.002 A 121 HIS HA H 1 4.2418 0.017 A 121 HIS CA C 13 56.7316 0.5 A 121 HIS N N 15 119.3233 0.036 A 122 HIS H H 1 7.9002 0.006 A 122 HIS CA C 13 57.0363 0.5 A 122 HIS CB C 13 29.9233 0.5 A 122 HIS N N 15 126.0319 0.063 A 123 HIS H H 1 8.5948 0.003 A 123 HIS HA H 1 4.5949 0.008 A 123 HIS HBy H 1 3.0969 0.024 A 123 HIS CA C 13 55.3716 0.026 A 123 HIS CB C 13 29.1654 0.111 A 123 HIS N N 15 121.0117 0.05 A 124 HIS H H 1 8.5578 0.004 A 124 HIS CA C 13 57.3805 0.052 A 124 HIS CB C 13 35.4906 0.07 A 124 HIS N N 15 120.3427 0.051 A 125 HIS H H 1 8.0692 0.004 A 125 HIS HA H 1 4.4050 0.004 A 125 HIS HBy H 1 3.0485 0.05 A 125 HIS CA C 13 56.8796 0.5 A 125 HIS CB C 13 29.5355 0.157 A 125 HIS N N 15 120.0947 0.009 B 1 MYR H12x H 1 1.0084 0.02 B 1 MYR H141 H 1 0.5974 0.02 B 1 MYR H3x H 1 1.0084 0.02 B 1 MYR H5x H 1 1.0084 0.02 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 69 THR HG1 A 69 THR HB 1.0 2.3 3.5 2 2 A 11 TYR HBy A 12 VAL HGy% 1.0 3.4 5.2 3 3 A 86 ILE HD1% A 85 LEU HG 1.0 3.4 5.0 4 4 A 53 ILE HA A 56 TRP HBx 1.0 2.7 4.1 5 5 A 74 LYS HA A 74 LYS HGy 1.0 2.6 3.8 6 6 A 53 ILE HD1% A 51 ILE HG1y 1.0 3.4 5.2 7 7 A 53 ILE HD1% A 53 ILE H 1.0 2.8 5.8 8 8 A 19 LEU HA A 21 THR H 1.0 3.1 4.7 9 9 A 19 LEU HA A 19 LEU H 1.0 2.8 4.2 10 10 A 109 ILE HA A 110 LEU H 1.0 2.8 4.2 11 11 A 84 ASN HBx A 85 LEU HBx 1.0 3.4 5.2 12 12 A 89 LEU HA A 89 LEU HG 1.0 2.2 3.4 13 13 A 90 ILE HD1% A 90 ILE HA 1.0 1.9 4.3 14 14 A 85 LEU HBx A 19 LEU HDy% 1.0 2.6 4.8 15 15 A 116 THR HB A 116 THR H 1.0 2.9 4.3 16 16 A 43 PRO HDy A 43 PRO HA 1.0 3.1 4.7 17 17 A 101 ALA HB% A 102 ALA H 1.0 3.0 4.4 18 18 A 69 THR HB A 69 THR HA 1.0 2.6 3.8 19 19 A 31 LEU HG A 12 VAL HA 1.0 3.1 5.7 20 20 A 97 PRO HA A 97 PRO HBy 1.0 2.2 3.2 21 21 A 31 LEU HA A 33 LYS H 1.0 3.7 5.5 22 22 A 97 PRO HA A 98 GLN HA 1.0 3.0 4.6 23 23 A 38 VAL HA A 42 CYS H 1.0 3.2 4.8 24 24 A 14 GLN HBy A 14 GLN HGx 1.0 2.7 4.1 25 25 A 12 VAL HGy% A 35 PHE HA 1.0 3.7 5.5 26 26 A 43 PRO HA A 46 PRO HDx 1.0 2.6 5.1 27 27 A 69 THR HG1 A 69 THR H 1.0 3.0 4.6 28 28 A 80 PHE HBy A 80 PHE H 1.0 2.6 3.8 29 29 A 90 ILE HD1% A 52 ASP HA 1.0 3.8 5.6 30 30 A 86 ILE HG1x A 86 ILE HG1y 1.0 1.8 5.6 31 31 A 12 VAL HGy% A 12 VAL HGx% 1.0 1.3 4.9 32 32 A 80 PHE H A 77 VAL HA 1.0 2.6 4.0 33 33 A 9 GLU HBx A 9 GLU H 1.0 2.5 3.7 34 34 A 75 VAL HA A 77 VAL HGy% 1.0 3.5 5.3 35 35 A 35 PHE HA A 12 VAL HGx% 1.0 3.7 5.5 36 36 A 85 LEU HG A 85 LEU H 1.0 2.7 4.1 37 37 A 89 LEU HA A 88 GLU H 1.0 2.6 5.0 38 38 A 12 VAL HGy% A 9 GLU HA 1.0 3.4 5.2 39 39 A 26 VAL HB A 26 VAL HGy% 1.0 1.9 4.3 40 40 A 90 ILE HA A 95 VAL HB 1.0 3.1 4.7 41 41 A 76 PRO HDx A 75 VAL HGy% 1.0 2.0 6.0 42 42 A 102 ALA HB% A 99 VAL HA 1.0 3.1 4.7 43 43 A 85 LEU HG A 89 LEU HBx 1.0 2.3 3.5 44 44 A 101 ALA HA A 104 ALA HB% 1.0 2.6 4.0 45 45 A 72 PRO HGy A 72 PRO HBy 1.0 2.1 3.1 46 46 A 38 VAL HA A 38 VAL H 1.0 3.0 4.4 47 47 A 50 THR HA A 48 GLU HGx 1.0 3.1 5.5 48 48 A 31 LEU HA A 31 LEU HD11 1.0 3.1 4.7 49 49 A 90 ILE HD1% A 52 ASP H 1.0 3.8 5.8 50 50 A 116 THR H A 116 THR HA 1.0 2.9 4.3 51 51 A 86 ILE HD1% A 51 ILE HD1% 1.0 3.0 4.6 52 52 A 21 THR HA A 23 GLY H 1.0 2.8 4.2 53 53 A 53 ILE HA A 53 ILE HG1y 1.0 2.7 4.1 54 54 A 51 ILE HB A 51 ILE HA 1.0 3.3 4.9 55 55 A 86 ILE HA A 89 LEU HD11 1.0 3.5 5.3 56 56 A 90 ILE HG1x A 51 ILE HG1y 1.0 2.9 5.3 57 57 A 9 GLU HA A 10 ARG H 1.0 2.7 4.1 58 58 A 35 PHE HBy A 36 ASP H 1.0 2.3 4.9 59 59 A 97 PRO HA A 99 VAL H 1.0 3.1 4.7 60 60 A 26 VAL HB A 27 LYS H 1.0 3.3 4.9 61 61 A 77 VAL HA A 79 ALA H 1.0 3.3 4.9 62 62 A 117 ASP HBx A 110 LEU HBx 1.0 3.1 4.7 63 63 A 86 ILE HD1% A 51 ILE HB 1.0 3.3 4.9 64 64 A 53 ILE HD1% A 83 TRP HA 1.0 3.4 5.2 65 65 A 16 LYS HA A 19 LEU HG 1.0 2.7 5.1 66 66 A 53 ILE HD1% A 53 ILE HG1y 1.0 2.4 3.6 67 67 A 90 ILE HA A 90 ILE HG1x 1.0 1.9 4.3 68 68 A 72 PRO HGy A 72 PRO HDx 1.0 2.2 3.4 69 69 A 53 ILE HA A 51 ILE HG1x 1.0 3.5 5.3 70 70 A 53 ILE HD1% A 90 ILE HB 1.0 2.0 6.0 71 71 A 26 VAL HB A 26 VAL H 1.0 2.9 4.3 72 72 A 19 LEU HG A 21 THR HG1 1.0 4.2 6.2 73 73 A 53 ILE H A 90 ILE HG1x 1.0 3.5 5.3 74 74 A 69 THR HG1 A 69 THR HB 1.0 2.5 3.7 75 75 A 90 ILE HD1% A 90 ILE HB 1.0 1.7 5.5 76 76 A 97 PRO HA A 97 PRO HGx 1.0 2.8 5.2 77 77 A 33 LYS HA A 33 LYS HBx 1.0 2.3 3.5 78 78 A 99 VAL HA A 99 VAL HGx% 1.0 1.9 4.3 79 79 A 53 ILE HD1% A 52 ASP HBy 1.0 3.5 5.3 80 80 A 12 VAL HGy% A 11 TYR HA 1.0 3.0 5.4 81 81 A 69 THR HA A 69 THR H 1.0 2.9 4.3 82 82 A 69 THR HB A 70 PHE H 1.0 2.9 4.3 83 83 A 86 ILE HD1% A 86 ILE HG1x 1.0 1.2 4.8 84 84 A 50 THR HB A 50 THR H 1.0 3.0 4.6 85 85 A 97 PRO HA A 98 GLN H 1.0 3.0 4.4 86 86 A 102 ALA H A 102 ALA HA 1.0 2.7 4.1 87 87 A 90 ILE HG1x A 89 LEU H 1.0 3.8 5.6 88 88 A 29 ALA HA A 32 LEU HG 1.0 2.7 4.1 89 89 A 31 LEU HA A 31 LEU H 1.0 3.1 4.7 90 90 A 59 VAL HGx% A 59 VAL HA 1.0 3.0 4.6 91 91 A 86 ILE HG1x A 86 ILE HA 1.0 1.5 5.3 92 92 A 97 PRO HA A 97 PRO HDy 1.0 3.0 4.6 93 93 A 14 GLN HBy A 14 GLN HA 1.0 3.0 4.6 94 94 A 26 VAL HB A 16 LYS HGy 1.0 3.4 5.0 95 95 A 77 VAL HGy% A 77 VAL H 1.0 2.7 4.1 96 96 A 19 LEU H A 18 ALA HA 1.0 2.9 4.3 97 97 A 90 ILE HG1x A 51 ILE HG1y 1.0 3.0 4.6 98 98 A 33 LYS HA A 37 PHE HBx 1.0 2.6 4.8 99 99 A 77 VAL HA A 77 VAL HGy% 1.0 2.6 4.0 100 100 A 39 LYS HA A 40 ASP H 1.0 3.4 5.0 101 101 A 51 ILE HD1% A 51 ILE HB 1.0 2.1 4.7 102 102 A 15 LEU HG A 15 LEU HA 1.0 1.0 4.6 103 103 A 86 ILE HG1x A 87 LYS HA 1.0 1.8 5.8 104 104 A 85 LEU HG A 85 LEU HA 1.0 2.6 4.0 105 105 A 29 ALA HA A 29 ALA HB% 1.0 1.7 4.1 106 106 A 95 VAL HB A 90 ILE HG1x 1.0 3.4 5.2 107 107 A 12 VAL HGx% A 12 VAL HB 1.0 1.7 4.1 108 108 A 59 VAL HGx% A 59 VAL HB 1.0 1.4 5.2 109 109 A 38 VAL HGx% A 38 VAL HGy% 1.0 1.9 4.3 110 110 A 39 LYS HGx A 39 LYS HEy 1.0 2.3 3.5 111 111 A 110 LEU HA A 111 LYS H 1.0 2.7 4.1 112 112 A 109 ILE HB A 109 ILE HG1x 1.0 1.9 5.9 113 113 A 110 LEU HG A 109 ILE HG1y 1.0 2.4 3.6 114 114 A 38 VAL HA A 59 VAL HGx% 1.0 3.7 5.5 115 115 A 52 ASP H A 51 ILE HD1% 1.0 3.1 4.7 116 116 A 38 VAL HGx% A 38 VAL HGy% 1.0 1.4 5.2 117 117 A 87 LYS HA A 87 LYS H 1.0 3.0 4.4 118 118 A 102 ALA HB% A 99 VAL HB 1.0 2.9 5.3 119 119 A 85 LEU HBx A 89 LEU HBx 1.0 2.4 5.6 120 120 A 72 PRO HGy A 68 ASN HA 1.0 2.6 4.0 121 121 A 87 LYS HA A 53 ILE HG1x 1.0 3.4 5.0 122 122 A 77 VAL H A 77 VAL HB 1.0 2.6 3.8 123 123 A 86 ILE HA A 86 ILE HB 1.0 3.1 4.7 124 124 A 74 LYS HBy A 74 LYS H 1.0 2.8 4.2 125 125 A 21 THR HG1 A 21 THR HB 1.0 2.6 3.8 126 126 A 14 GLN HBy A 15 LEU HD11 1.0 4.1 6.1 127 127 A 14 GLN HBy A 11 TYR HA 1.0 2.5 4.7 128 128 A 59 VAL HB A 59 VAL HGy% 1.0 1.4 5.0 129 129 A 11 TYR HA A 15 LEU HG 1.0 3.4 6.0 130 130 A 95 VAL HB A 98 GLN HGx 1.0 2.1 4.1 131 131 A 16 LYS HGy A 16 LYS HBx 1.0 2.1 3.1 132 132 A 12 VAL HA A 12 VAL H 1.0 3.0 4.4 133 133 A 118 LEU HBx A 118 LEU HG 1.0 2.5 3.7 134 134 A 90 ILE HA A 90 ILE HG1x 1.0 1.1 4.7 135 135 A 59 VAL HA A 58 ARG HA 1.0 3.7 5.5 136 136 A 78 THR HB A 78 THR H 1.0 3.4 5.2 137 137 A 110 LEU HG A 108 GLU HBy 1.0 2.2 3.4 138 138 A 69 THR HB A 69 THR H 1.0 2.7 4.1 139 139 A 59 VAL HA A 59 VAL H 1.0 3.0 4.4 140 140 A 102 ALA HB% A 102 ALA HA 1.0 1.7 4.1 141 141 A 29 ALA HA A 30 ASP H 1.0 3.0 4.6 142 142 A 31 LEU HG A 30 ASP HA 1.0 3.3 5.9 143 143 A 51 ILE HD1% A 90 ILE HB 1.0 2.7 5.1 144 144 A 86 ILE HA A 86 ILE H 1.0 3.1 4.7 145 145 A 47 GLN HA A 48 GLU H 1.0 2.6 3.8 146 146 A 76 PRO HDx A 78 THR HG1 1.0 4.2 6.4 147 147 A 97 PRO HDy A 96 ASN H 1.0 3.4 5.2 148 148 A 53 ILE HG1y A 53 ILE HG1x 1.0 2.5 3.7 149 149 A 77 VAL HGy% A 77 VAL HB 1.0 1.7 4.1 150 150 A 89 LEU HA A 89 LEU HD11 1.0 1.7 4.1 151 151 A 9 GLU HA A 12 VAL H 1.0 3.0 4.6 152 152 A 5 LEU HG A 5 LEU HA 1.0 2.0 4.4 153 153 A 53 ILE HD1% A 90 ILE HA 1.0 3.0 5.6 154 154 A 102 ALA HA A 103 VAL HGy% 1.0 2.9 5.3 155 155 A 111 LYS HBy A 108 GLU H 1.0 2.5 3.7 156 156 A 51 ILE HD1% A 51 ILE HB 1.0 3.0 4.6 157 157 A 89 LEU HBx A 51 ILE HD1% 1.0 2.8 4.2 158 158 A 53 ILE HA A 53 ILE HG1y 1.0 2.6 4.0 159 159 A 53 ILE H A 53 ILE HG1y 1.0 2.9 4.3 160 160 A 19 LEU HA A 19 LEU HDy% 1.0 2.6 4.0 161 161 A 89 LEU HBx A 86 ILE HG1y 1.0 3.0 4.6 162 162 A 89 LEU HG A 89 LEU HBx 1.0 2.5 3.7 163 163 A 75 VAL HGy% A 72 PRO HDx 1.0 3.8 5.8 164 164 A 76 PRO HDx A 76 PRO HBy 1.0 3.4 5.2 165 165 A 19 LEU HA A 18 ALA HB% 1.0 3.1 4.7 166 166 A 61 ASP HBx A 61 ASP HA 1.0 2.5 3.7 167 167 A 12 VAL HGy% A 31 LEU HA 1.0 3.7 5.5 168 168 A 79 ALA H A 79 ALA HA 1.0 2.8 4.2 169 169 A 23 GLY H A 21 THR HB 1.0 2.9 5.3 170 170 A 90 ILE HG1x A 90 ILE HG1x 1.0 2.6 4.0 171 171 A 89 LEU HA A 89 LEU H 1.0 2.7 4.1 172 172 A 38 VAL HGy% A 59 VAL HGy% 1.0 3.6 5.4 173 173 A 31 LEU HD11 A 32 LEU HG 1.0 2.4 4.6 174 174 A 12 VAL HGy% A 12 VAL HGx% 1.0 1.2 4.8 175 175 A 53 ILE HD1% A 51 ILE HG1y 1.0 3.0 5.6 176 176 A 14 GLN HGx A 11 TYR HA 1.0 3.4 5.2 177 177 A 50 THR HB A 50 THR HG1 1.0 1.1 4.7 178 178 A 16 LYS HBx A 26 VAL HGx% 1.0 3.4 5.0 179 179 A 78 THR HG1 A 78 THR HA 1.0 2.5 3.7 180 180 A 59 VAL HGx% A 59 VAL HGy% 1.0 1.4 5.0 181 181 A 98 GLN HA A 99 VAL HGy% 1.0 3.3 4.9 182 182 A 85 LEU HG A 89 LEU HA 1.0 2.4 5.6 183 183 A 97 PRO HBy A 97 PRO HDy 1.0 3.0 4.6 184 184 A 89 LEU HA A 89 LEU HBx 1.0 2.9 4.3 185 185 A 111 LYS HGy A 115 GLN HBx 1.0 2.6 4.8 186 186 A 90 ILE HB A 90 ILE HG1x 1.0 2.3 3.5 187 187 A 69 THR HG1 A 69 THR HA 1.0 2.4 3.6 188 188 A 85 LEU HA A 88 GLU HBy 1.0 2.1 4.1 189 189 A 86 ILE HD1% A 85 LEU HG 1.0 2.9 5.3 190 190 A 5 LEU HA A 6 SER H 1.0 3.3 4.9 191 191 A 39 LYS HA A 38 VAL HGx% 1.0 3.9 5.9 192 192 A 32 LEU HG A 32 LEU HBx 1.0 2.6 3.8 193 193 A 90 ILE HD1% A 51 ILE HG1y 1.0 2.9 4.3 194 194 A 86 ILE HD1% A 53 ILE HG1x 1.0 4.2 6.2 195 195 A 53 ILE HD1% A 53 ILE HB 1.0 2.9 4.3 196 196 A 59 VAL HB A 38 VAL HGx% 1.0 3.6 5.4 197 197 A 76 PRO HDx A 75 VAL H 1.0 4.0 6.0 198 198 A 102 ALA H A 102 ALA HB% 1.0 1.8 4.2 199 199 A 77 VAL HA A 75 VAL HB 1.0 2.6 6.0 200 200 A 53 ILE HA A 53 ILE HD1% 1.0 1.8 4.2 201 201 A 51 ILE HA A 50 THR HG1 1.0 2.5 3.7 202 202 A 86 ILE HD1% A 86 ILE HB 1.0 0.9 4.3 203 203 A 86 ILE HG1x A 89 LEU H 1.0 3.5 5.3 204 204 A 53 ILE HD1% A 53 ILE HG1y 1.0 2.6 4.0 205 205 A 85 LEU HG A 89 LEU H 1.0 2.6 4.0 206 206 A 45 PHE HA A 45 PHE H 1.0 1.9 4.3 207 207 A 86 ILE HD1% A 87 LYS H 1.0 3.4 5.2 208 208 A 19 LEU H A 18 ALA HB% 1.0 2.6 4.0 209 209 A 32 LEU HBx A 32 LEU HA 1.0 2.8 4.2 210 210 A 65 ASP HBy A 65 ASP HA 1.0 2.3 3.5 211 211 A 118 LEU HA A 119 GLU H 1.0 2.4 3.6 212 212 A 116 THR HA A 117 ASP H 1.0 2.5 3.7 213 213 A 64 GLN HBy A 64 GLN H 1.0 2.4 3.6 214 214 A 88 GLU HBy A 87 LYS HBx 1.0 2.6 6.0 215 215 A 110 LEU H A 110 LEU HG 1.0 2.8 4.2 216 216 A 15 LEU HG A 86 ILE HG1y 1.0 2.6 5.0 217 217 A 84 ASN HBx A 84 ASN HA 1.0 2.6 4.0 218 218 A 26 VAL HB A 26 VAL HA 1.0 2.8 4.2 219 219 A 59 VAL HGy% A 60 GLY HAy 1.0 4.2 6.4 220 220 A 77 VAL HA A 77 VAL H 1.0 2.7 4.1 221 221 A 16 LYS HA A 16 LYS HGy 1.0 2.6 4.0 222 222 A 86 ILE HD1% A 89 LEU HBx 1.0 3.4 5.2 223 223 A 85 LEU HBx A 86 ILE HA 1.0 3.1 5.7 224 224 A 102 ALA HB% A 103 VAL HGy% 1.0 3.4 5.2 225 225 A 65 ASP HBy A 64 GLN HA 1.0 2.6 6.0 226 226 A 90 ILE HD1% A 90 ILE HG1x 1.0 2.0 4.4 227 227 A 110 LEU H A 108 GLU HGy 1.0 3.1 4.7 228 228 A 77 VAL HB A 79 ALA HB% 1.0 3.0 5.6 229 229 A 99 VAL HA A 99 VAL HB 1.0 2.9 4.3 230 230 A 18 ALA HA A 17 GLN H 1.0 3.2 5.8 231 231 A 72 PRO HDx A 75 VAL H 1.0 3.2 5.8 232 232 A 59 VAL HGx% A 38 VAL HGx% 1.0 3.1 6.1 233 233 A 30 ASP HA A 16 LYS HDy 1.0 2.6 5.2 234 234 A 12 VAL HGy% A 12 VAL H 1.0 2.0 4.4 235 235 A 43 PRO HA A 43 PRO HGx 1.0 2.6 3.8 236 236 A 111 LYS H A 112 SER HA 1.0 2.6 5.0 237 237 A 21 THR HA A 21 THR HG1 1.0 3.0 4.4 238 238 A 31 LEU HA A 32 LEU HG 1.0 3.1 5.9 239 239 A 75 VAL HGy% A 67 TYR HBx 1.0 3.0 6.4 240 240 A 79 ALA HA A 79 ALA HB% 1.0 0.7 4.1 241 241 A 89 LEU HBx A 89 LEU H 1.0 1.0 4.6 242 242 A 46 PRO HA A 46 PRO HGy 1.0 0.6 3.8 243 243 A 46 PRO HDx A 45 PHE H 1.0 2.0 4.6 244 244 A 59 VAL HA A 60 GLY H 1.0 3.2 4.8 245 245 A 87 LYS HA A 87 LYS HGx 1.0 2.9 4.3 246 246 A 89 LEU HA A 88 GLU HBy 1.0 2.2 5.2 247 247 A 29 ALA HA A 29 ALA HB% 1.0 1.6 3.8 248 248 A 86 ILE H A 86 ILE HG1y 1.0 3.0 4.6 249 249 A 15 LEU HD11 A 86 ILE HG1y 1.0 3.2 4.8 250 250 A 90 ILE HD1% A 90 ILE HG1x 1.0 1.2 4.8 251 251 A 70 PHE H A 68 ASN HA 1.0 2.5 3.7 252 252 A 72 PRO HDx A 68 ASN HA 1.0 2.4 3.6 253 253 A 53 ILE H A 53 ILE HB 1.0 2.6 3.8 254 254 A 85 LEU HG A 19 LEU HG 1.0 0.2 4.2 255 255 A 86 ILE HG1x A 86 ILE HB 1.0 1.8 4.2 256 256 A 74 LYS HBy A 73 GLU HA 1.0 3.1 5.7 257 257 A 86 ILE HD1% A 89 LEU HD11 1.0 3.2 5.8 258 258 A 33 LYS H A 35 PHE HBy 1.0 3.4 5.2 259 259 A 53 ILE HG1y A 53 ILE HB 1.0 2.6 3.8 260 260 A 77 VAL HA A 77 VAL HB 1.0 2.5 3.7 261 261 A 39 LYS HA A 39 LYS H 1.0 3.0 4.4 262 262 A 79 ALA HA A 82 TYR HBx 1.0 3.0 4.4 263 263 A 11 TYR HBy A 14 GLN HBy 1.0 3.2 5.8 264 264 A 76 PRO HDx A 79 ALA HB% 1.0 3.3 5.9 265 265 A 65 ASP HA A 66 TYR HBx 1.0 2.7 6.1 266 266 A 77 VAL HA A 77 VAL HGy% 1.0 1.9 4.3 267 267 A 19 LEU HBy A 20 LYS H 1.0 3.0 4.6 268 268 A 43 PRO HDy A 43 PRO HGx 1.0 2.3 3.5 269 269 A 26 VAL HB A 26 VAL HGy% 1.0 2.6 3.8 270 270 A 90 ILE HD1% A 86 ILE HG1x 1.0 3.5 5.3 271 271 A 52 ASP HA A 53 ILE HG1y 1.0 2.9 5.3 272 272 A 75 VAL HB A 74 LYS HDy 1.0 2.4 4.6 273 273 A 85 LEU HG A 89 LEU HG 1.0 2.2 5.2 274 274 A 72 PRO HDx A 71 GLY H 1.0 2.4 5.2 275 275 A 88 GLU HBy A 87 LYS HGx 1.0 2.2 3.2 276 276 A 50 THR HG1 A 45 PHE HA 1.0 3.4 5.2 277 277 A 77 VAL HGy% A 76 PRO HDx 1.0 3.2 5.8 278 278 A 86 ILE HG1x A 86 ILE HB 1.0 1.4 6.6 279 279 A 67 TYR HBx A 64 GLN HBx 1.0 3.6 5.4 280 280 A 90 ILE HD1% A 90 ILE HA 1.0 1.0 6.0 281 281 A 115 GLN HBx A 119 GLU HA 1.0 2.6 4.0 282 282 A 85 LEU HG A 88 GLU HGy 1.0 2.8 4.2 283 283 A 83 TRP HA A 86 ILE HB 1.0 2.9 4.3 284 284 A 108 GLU HBy A 109 ILE H 1.0 2.4 4.6 285 285 A 15 LEU HA A 15 LEU HD11 1.0 1.0 4.4 286 286 A 75 VAL HGy% A 67 TYR HBx 1.0 4.2 6.2 287 287 A 99 VAL HA A 99 VAL H 1.0 2.9 4.3 288 288 A 18 ALA HA A 18 ALA HB% 1.0 0.8 4.2 289 289 A 92 LYS HBy A 95 VAL HG11 1.0 2.9 5.3 290 290 A 86 ILE HG1x A 90 ILE HB 1.0 3.5 5.3 291 291 A 45 PHE H A 43 PRO HBy 1.0 3.5 5.3 292 292 A 88 GLU HBy A 88 GLU HA 1.0 2.1 3.1 293 293 A 32 LEU HBx A 34 PHE H 1.0 3.1 4.7 294 294 A 101 ALA HB% A 99 VAL HB 1.0 3.1 5.7 295 295 A 72 PRO HBy A 72 PRO HDx 1.0 2.8 5.2 296 296 A 26 VAL H A 25 LYS HA 1.0 2.3 3.5 297 297 A 89 LEU HBx A 86 ILE HA 1.0 1.4 5.0 298 298 A 74 LYS HBy A 73 GLU H 1.0 3.3 4.9 299 299 A 38 VAL HGy% A 38 VAL HB 1.0 1.4 5.0 300 300 A 118 LEU HBx A 118 LEU HA 1.0 2.2 3.2 301 301 A 38 VAL H A 38 VAL HGy% 1.0 1.0 4.6 302 302 A 80 PHE HBy A 77 VAL HA 1.0 3.4 5.2 303 303 A 85 LEU HA A 86 ILE HB 1.0 2.0 5.5 304 304 A 79 ALA H A 78 THR HB 1.0 3.6 5.4 305 305 A 68 ASN HA A 68 ASN HBy 1.0 2.5 3.7 306 306 A 75 VAL HGy% A 75 VAL HB 1.0 2.6 4.0 307 307 A 90 ILE HD1% A 51 ILE HD1% 1.0 3.0 4.4 308 308 A 59 VAL HGy% A 58 ARG HBy 1.0 3.8 5.6 309 309 A 12 VAL HGy% A 9 GLU HA 1.0 3.0 4.6 310 310 A 74 LYS H A 73 GLU HBy 1.0 2.3 3.5 311 311 A 101 ALA HA A 103 VAL HB 1.0 2.6 4.0 312 312 A 29 ALA HA A 27 LYS HDx 1.0 3.0 4.4 313 313 A 31 LEU HG A 31 LEU HA 1.0 1.8 4.2 314 314 A 19 LEU HDy% A 18 ALA HA 1.0 4.2 6.2 315 315 A 86 ILE HG1x A 51 ILE HD1% 1.0 3.4 5.0 316 316 A 12 VAL HGy% A 31 LEU HD11 1.0 3.7 5.5 317 317 A 35 PHE HA A 34 PHE H 1.0 2.7 6.1 318 318 A 51 ILE HD1% A 86 ILE HG1y 1.0 2.7 5.5 319 319 A 80 PHE H A 79 ALA HA 1.0 2.9 4.3 320 320 A 38 VAL HA A 38 VAL HGx% 1.0 1.0 4.6 321 321 A 98 GLN HA A 102 ALA HB% 1.0 3.3 4.9 322 322 A 53 ILE HA A 53 ILE HB 1.0 2.7 4.1 323 323 A 11 TYR HBy A 12 VAL H 1.0 3.1 4.7 324 324 A 5 LEU HG A 8 HIS HBx 1.0 3.0 5.4 325 325 A 51 ILE HD1% A 51 ILE HA 1.0 2.1 4.7 326 326 A 19 LEU HG A 21 THR HG1 1.0 2.7 5.1 327 327 A 87 LYS HGx A 88 GLU HA 1.0 2.3 3.5 328 328 A 32 LEU HA A 34 PHE H 1.0 3.0 5.4 329 329 A 98 GLN HA A 98 GLN HGx 1.0 2.2 3.4 330 330 A 87 LYS HA A 86 ILE HB 1.0 3.2 4.8 331 331 A 85 LEU HBx A 85 LEU HA 1.0 2.2 3.4 332 332 A 77 VAL HGy% A 77 VAL HB 1.0 2.4 3.6 333 333 A 14 GLN HBy A 10 ARG HBx 1.0 2.2 4.2 334 334 A 86 ILE HG1x A 86 ILE HG1y 1.0 3.0 4.6 335 335 A 38 VAL HGx% A 38 VAL HB 1.0 1.4 5.2 336 336 A 75 VAL HGy% A 75 VAL HB 1.0 1.4 5.0 337 337 A 53 ILE HD1% A 90 ILE HG1x 1.0 3.2 6.2 338 338 A 15 LEU HG A 15 LEU HBy 1.0 2.3 3.5 339 339 A 9 GLU HA A 12 VAL HB 1.0 2.2 3.2 340 340 A 99 VAL HA A 99 VAL HB 1.0 3.0 4.6 341 341 A 86 ILE HA A 89 LEU H 1.0 3.2 4.8 342 342 A 85 LEU HG A 89 LEU HBx 1.0 3.1 4.7 343 343 A 15 LEU HD11 A 15 LEU HBy 1.0 1.1 6.1 344 344 A 59 VAL HB A 59 VAL HGy% 1.0 1.0 4.6 345 345 A 14 GLN HGx A 10 ARG HBx 1.0 3.1 4.7 346 346 A 90 ILE HA A 89 LEU HBx 1.0 3.4 5.2 347 347 A 90 ILE HA A 90 ILE HG1x 1.0 2.0 4.4 348 348 A 76 PRO HDx A 76 PRO HGy 1.0 3.0 4.4 349 349 A 16 LYS HBx A 17 GLN H 1.0 2.8 4.2 350 350 A 98 GLN HA A 98 GLN H 1.0 2.6 4.0 351 351 A 112 SER HA A 113 ASN HBx 1.0 3.8 5.8 352 352 A 18 ALA HB% A 15 LEU HBy 1.0 3.0 5.4 353 353 A 101 ALA HB% A 97 PRO HA 1.0 3.8 5.6 354 354 A 14 GLN HBy A 14 GLN HGx 1.0 2.9 4.3 355 355 A 26 VAL HB A 26 VAL HA 1.0 2.3 3.5 356 356 A 59 VAL HGy% A 41 THR HA 1.0 4.1 6.1 357 357 A 16 LYS HA A 16 LYS HDx 1.0 2.6 4.8 358 358 A 99 VAL H A 99 VAL HB 1.0 1.6 4.0 359 359 A 99 VAL HB A 99 VAL HGy% 1.0 1.8 4.2 360 360 A 80 PHE HBy A 81 SER H 1.0 2.8 4.2 361 361 A 118 LEU HBx A 118 LEU HA 1.0 2.1 4.7 362 362 A 53 ILE HG1y A 90 ILE HB 1.0 2.3 3.5 363 363 A 74 LYS HA A 74 LYS HBy 1.0 1.8 4.2 364 364 A 12 VAL HGy% A 12 VAL HB 1.0 1.8 4.2 365 365 A 12 VAL HGy% A 12 VAL HA 1.0 1.0 4.4 366 366 A 117 ASP H A 117 ASP HA 1.0 2.6 4.0 367 367 A 117 ASP HA A 118 LEU H 1.0 2.4 3.6 368 368 A 53 ILE HA A 53 ILE HD1% 1.0 2.0 4.4 369 369 A 38 VAL H A 38 VAL HGx% 1.0 2.6 5.4 370 370 A 35 PHE HA A 35 PHE HBy 1.0 2.7 4.1 371 371 A 21 THR HA A 22 ARG H 1.0 3.2 4.8 372 372 A 90 ILE HD1% A 90 ILE HG1x 1.0 1.4 5.2 373 373 A 90 ILE HA A 51 ILE HG1y 1.0 3.1 4.7 374 374 A 21 THR HB A 22 ARG H 1.0 3.3 4.9 375 375 A 11 TYR HBy A 12 VAL HGy% 1.0 3.0 4.4 376 376 A 46 PRO HDx A 46 PRO HBx 1.0 3.0 4.4 377 377 A 59 VAL HGx% A 59 VAL HB 1.0 1.0 4.4 378 378 A 77 VAL HGy% A 75 VAL HGy% 1.0 3.0 5.6 379 379 A 90 ILE HD1% A 86 ILE HG1x 1.0 3.5 5.3 380 380 A 52 ASP H A 51 ILE HD1% 1.0 2.9 4.3 381 381 A 53 ILE HG1x A 53 ILE HB 1.0 2.6 3.8 382 382 A 15 LEU HG A 15 LEU HD11 1.0 1.0 4.6 383 383 A 19 LEU HDy% A 85 LEU HDy% 1.0 2.6 5.0 384 384 A 59 VAL HA A 59 VAL HB 1.0 1.2 4.8 385 385 A 86 ILE HA A 15 LEU HD11 1.0 3.4 5.2 386 386 A 59 VAL HA A 59 VAL HGy% 1.0 1.1 4.7 387 387 A 87 LYS H A 88 GLU HA 1.0 2.6 5.2 388 388 A 39 LYS HA A 39 LYS HGx 1.0 2.6 4.0 389 389 A 51 ILE HG1x A 53 ILE HB 1.0 3.5 5.3 390 390 A 86 ILE HD1% A 86 ILE HA 1.0 3.0 4.4 391 391 A 38 VAL H A 38 VAL HB 1.0 3.0 4.6 392 392 A 59 VAL HGy% A 60 GLY H 1.0 3.2 4.8 393 393 A 98 GLN H A 99 VAL HB 1.0 2.9 5.3 394 394 A 27 LYS H A 27 LYS HBx 1.0 2.9 4.3 395 395 A 88 GLU H A 87 LYS HA 1.0 3.4 5.2 396 396 A 59 VAL HGx% A 59 VAL HGy% 1.0 1.1 4.7 397 397 A 89 LEU HBx A 85 LEU HA 1.0 2.6 5.0 398 398 A 77 VAL HGy% A 75 VAL HB 1.0 3.4 5.0 399 399 A 46 PRO HDx A 46 PRO HGy 1.0 2.8 4.2 400 400 A 38 VAL HGx% A 39 LYS H 1.0 3.4 5.2 401 401 A 97 PRO HGx A 97 PRO HDy 1.0 2.5 5.7 402 402 A 31 LEU H A 29 ALA HB% 1.0 4.2 6.2 403 403 A 85 LEU HG A 89 LEU H 1.0 2.9 4.3 404 404 A 16 LYS HA A 20 LYS H 1.0 2.9 4.3 405 405 A 85 LEU HA A 22 ARG HGy 1.0 2.4 5.6 406 406 A 90 ILE HA A 90 ILE HG1x 1.0 1.4 5.2 407 407 A 38 VAL HGx% A 37 PHE HBy 1.0 3.2 4.8 408 408 A 54 LYS HBx A 54 LYS H 1.0 2.6 4.0 409 409 A 53 ILE HD1% A 90 ILE HD1% 1.0 2.3 6.5 410 410 A 38 VAL HGy% A 38 VAL HB 1.0 2.0 4.4 411 411 A 90 ILE HD1% A 95 VAL HG11 1.0 3.8 5.6 412 412 A 59 VAL HGy% A 60 GLY HAx 1.0 3.5 5.3 413 413 A 35 PHE HA A 35 PHE HBy 1.0 2.5 3.7 414 414 A 27 LYS HGx A 27 LYS HEx 1.0 2.5 3.7 415 415 A 118 LEU HG A 118 LEU HA 1.0 2.4 3.6 416 416 A 38 VAL HA A 39 LYS H 1.0 3.0 4.6 417 417 A 86 ILE HG1x A 86 ILE HA 1.0 3.1 4.7 418 418 A 19 LEU H A 16 LYS HA 1.0 3.2 4.8 419 419 A 95 VAL HB A 95 VAL HG11 1.0 1.3 4.9 420 420 A 86 ILE HA A 86 ILE HG1y 1.0 1.5 5.3 421 421 A 67 TYR HBx A 63 PHE HA 1.0 3.0 4.4 422 422 A 109 ILE HA A 107 GLU HBx 1.0 2.7 5.1 423 423 A 14 GLN HGx A 14 GLN HA 1.0 3.4 5.0 424 424 A 89 LEU H A 88 GLU HGy 1.0 2.5 3.7 425 425 A 74 LYS HA A 74 LYS HBy 1.0 2.4 3.6 426 426 A 75 VAL HGy% A 75 VAL H 1.0 2.0 4.4 427 427 A 38 VAL HA A 38 VAL HGy% 1.0 3.0 4.6 428 428 A 102 ALA HB% A 103 VAL H 1.0 3.2 4.8 429 429 A 26 VAL HGx% A 26 VAL HA 1.0 1.8 4.2 430 430 A 89 LEU HBx A 87 LYS HA 1.0 2.7 6.1 431 431 A 53 ILE HB A 54 LYS H 1.0 2.0 4.6 432 432 A 27 LYS H A 26 VAL HA 1.0 2.2 3.4 433 433 A 59 VAL HGy% A 59 VAL H 1.0 3.1 4.7 434 434 A 15 LEU HD11 A 15 LEU HBy 1.0 1.9 4.3 435 435 A 74 LYS HBy A 74 LYS HDy 1.0 2.3 3.5 436 436 A 88 GLU HBy A 88 GLU HGy 1.0 1.7 2.5 437 437 A 51 ILE HD1% A 86 ILE H 1.0 3.4 5.2 438 438 A 89 LEU HG A 51 ILE HG1y 1.0 2.6 5.8 439 439 A 53 ILE HD1% A 53 ILE HB 1.0 3.0 4.4 440 440 A 69 THR HG1 A 69 THR HA 1.0 2.5 3.7 441 441 A 29 ALA HB% A 30 ASP H 1.0 3.1 4.7 442 442 A 43 PRO HDy A 43 PRO HBy 1.0 3.0 4.6 443 443 A 73 GLU H A 73 GLU HBy 1.0 2.4 3.6 444 444 A 19 LEU HA A 21 THR HG1 1.0 3.2 4.8 445 445 A 33 LYS H A 33 LYS HBx 1.0 2.5 3.7 446 446 A 90 ILE HD1% A 51 ILE HA 1.0 3.4 5.2 447 447 A 51 ILE HB A 51 ILE HG1y 1.0 1.0 4.6 448 448 A 21 THR H A 19 LEU HBy 1.0 2.9 5.3 449 449 A 52 ASP H A 51 ILE HG1y 1.0 3.4 5.2 450 450 A 32 LEU HG A 32 LEU HA 1.0 2.5 3.7 451 451 A 101 ALA HA A 102 ALA HA 1.0 2.6 5.0 452 452 A 77 VAL HA A 77 VAL HB 1.0 2.4 3.6 453 453 A 52 ASP HA A 52 ASP HBy 1.0 2.6 4.0 454 454 A 69 THR HG1 A 70 PHE H 1.0 3.0 4.6 455 455 A 18 ALA HA A 20 LYS HBx 1.0 3.0 6.6 456 456 A 16 LYS HDx A 30 ASP HBy 1.0 2.8 4.2 457 457 A 89 LEU HA A 89 LEU HBx 1.0 2.6 4.0 458 458 A 117 ASP HBx A 117 ASP HA 1.0 2.3 3.5 459 459 A 97 PRO HA A 99 VAL HA 1.0 3.0 6.4 460 460 A 87 LYS HA A 87 LYS HBx 1.0 2.8 4.2 461 461 A 51 ILE HB A 51 ILE HG1y 1.0 2.1 4.7 462 462 A 86 ILE HD1% A 86 ILE HA 1.0 3.2 4.8 463 463 A 59 VAL HB A 59 VAL H 1.0 2.0 4.4 464 464 A 31 LEU HA A 31 LEU HD11 1.0 3.0 4.4 465 465 A 48 GLU H A 48 GLU HBx 1.0 2.3 3.5 466 466 A 59 VAL HB A 60 GLY H 1.0 3.0 4.4 467 467 A 38 VAL HGx% A 43 PRO HBy 1.0 3.3 5.9 468 468 A 86 ILE HB A 86 ILE HG1y 1.0 2.5 3.7 469 469 A 87 LYS H A 88 GLU HGy 1.0 2.8 4.2 470 470 A 86 ILE HD1% A 86 ILE HB 1.0 1.8 5.8 471 471 A 15 LEU HG A 15 LEU HBy 1.0 2.6 3.8 472 472 A 54 LYS H A 54 LYS HA 1.0 2.6 3.8 473 473 A 21 THR HG1 A 21 THR HB 1.0 1.9 4.3 474 474 A 85 LEU HA A 85 LEU HDy% 1.0 3.0 4.4 475 475 A 35 PHE HA A 36 ASP H 1.0 3.8 5.6 476 476 A 84 ASN HBx A 85 LEU H 1.0 2.7 4.1 477 477 A 18 ALA HA A 18 ALA HB% 1.0 2.6 3.8 478 478 A 16 LYS HDx A 30 ASP HBy 1.0 2.8 5.2 479 479 A 5 LEU HA A 7 GLN H 1.0 3.1 4.7 480 480 A 86 ILE HG1x A 88 GLU HGy 1.0 4.2 6.4 481 481 A 89 LEU HG A 89 LEU HBx 1.0 2.6 3.8 482 482 A 110 LEU HG A 109 ILE HD1% 1.0 2.9 4.3 483 483 A 109 ILE HB A 109 ILE H 1.0 3.3 4.9 484 484 A 102 ALA HB% A 102 ALA HA 1.0 1.9 4.3 485 485 A 53 ILE HA A 53 ILE HB 1.0 2.6 3.8 486 486 A 80 PHE HBy A 80 PHE HA 1.0 2.7 4.1 487 487 A 31 LEU HA A 34 PHE H 1.0 3.1 4.7 488 488 A 24 VAL HA A 25 LYS H 1.0 2.3 3.5 489 489 A 109 ILE HA A 109 ILE HG1x 1.0 2.7 4.1 490 490 A 85 LEU HG A 19 LEU HDy% 1.0 3.0 4.4 491 491 A 99 VAL HA A 98 GLN H 1.0 3.5 5.3 492 492 A 109 ILE HA A 109 ILE HG1y 1.0 2.7 4.1 493 493 A 113 ASN HBx A 113 ASN H 1.0 2.7 4.1 494 494 A 101 ALA HB% A 99 VAL H 1.0 2.6 4.8 495 495 A 39 LYS H A 38 VAL HB 1.0 3.0 4.4 496 496 A 90 ILE HA A 90 ILE HB 1.0 2.9 4.3 497 497 A 65 ASP HBy A 64 GLN HA 1.0 2.9 5.5 498 498 A 72 PRO HBy A 73 GLU H 1.0 3.7 5.5 499 499 A 68 ASN HA A 67 TYR HBx 1.0 3.0 5.6 500 500 A 33 LYS H A 32 LEU HA 1.0 3.1 4.7 501 501 A 21 THR H A 21 THR HG1 1.0 1.9 4.3 502 502 A 123 HIS HA A 123 HIS HBx 1.0 2.0 3.0 503 503 A 101 ALA HB% A 101 ALA HA 1.0 2.4 3.6 504 504 A 16 LYS HBx A 17 GLN HA 1.0 2.5 5.7 505 505 A 50 THR HB A 48 GLU HBx 1.0 3.5 5.3 506 506 A 16 LYS HA A 24 VAL HG11 1.0 3.4 5.2 507 507 A 98 GLN HA A 99 VAL H 1.0 2.5 3.7 508 508 A 14 GLN HA A 13 GLU H 1.0 3.5 5.3 509 509 A 90 ILE HG1x A 90 ILE HG1x 1.0 2.2 4.8 510 510 A 15 LEU HG A 15 LEU HD11 1.0 2.6 3.8 511 511 A 59 VAL HGx% A 59 VAL HA 1.0 3.3 4.9 512 512 A 19 LEU HDy% A 18 ALA HB% 1.0 3.4 5.2 513 513 A 118 LEU HBx A 118 LEU HG 1.0 2.2 3.2 514 514 A 50 THR HA A 50 THR HG1 1.0 3.0 4.6 515 515 A 89 LEU HBx A 86 ILE HB 1.0 2.6 6.0 516 516 A 78 THR HB A 78 THR HG1 1.0 1.0 4.4 517 517 A 74 LYS HGy A 74 LYS HBy 1.0 2.6 3.8 518 518 A 59 VAL HA A 59 VAL HGy% 1.0 1.2 4.8 519 519 A 39 LYS HA A 39 LYS HDy 1.0 2.6 5.0 520 520 A 86 ILE HG1x A 86 ILE H 1.0 3.4 5.2 521 521 A 69 THR HG1 A 70 PHE HA 1.0 2.7 5.1 522 522 A 85 LEU HG A 86 ILE HA 1.0 2.9 4.3 523 523 A 75 VAL HA A 76 PRO HDx 1.0 2.7 4.1 524 524 A 31 LEU HD11 A 16 LYS HDx 1.0 3.4 5.2 525 525 A 19 LEU HA A 19 LEU HBy 1.0 2.8 4.2 526 526 A 19 LEU HA A 19 LEU HG 1.0 2.4 3.6 527 527 A 69 THR HA A 70 PHE HA 1.0 3.0 4.4 528 528 A 75 VAL HA A 75 VAL HGy% 1.0 1.7 5.5 529 529 A 38 VAL HA A 37 PHE H 1.0 2.9 5.3 530 530 A 56 TRP HBx A 56 TRP H 1.0 1.7 4.1 531 531 A 70 PHE H A 71 GLY H 1.0 2.0 4.6 532 532 A 23 GLY H A 22 ARG H 1.0 2.6 4.0 533 533 A 64 GLN HBx A 63 PHE H 1.0 2.2 5.4 534 534 A 56 TRP H A 55 ARG HA 1.0 2.9 4.3 535 535 A 27 LYS H A 26 VAL HA 1.0 2.5 3.7 536 536 A 114 SER H A 114 SER HBy 1.0 2.6 4.0 537 537 A 43 PRO HA A 44 TRP H 1.0 3.1 4.7 538 538 A 19 LEU HBy A 20 LYS H 1.0 2.3 3.5 539 539 A 78 THR H A 78 THR HG1 1.0 1.4 5.0 540 540 A 56 TRP H A 55 ARG HBx 1.0 3.0 4.6 541 541 A 22 ARG H A 22 ARG HBy 1.0 2.8 4.2 542 542 A 53 ILE H A 54 LYS H 1.0 2.6 4.0 543 543 A 52 ASP H A 51 ILE HD1% 1.0 3.6 5.4 544 544 A 33 LYS HBx A 34 PHE H 1.0 2.9 4.3 545 545 A 34 PHE H A 34 PHE HBx 1.0 1.7 4.1 546 546 A 9 GLU HA A 10 ARG H 1.0 3.0 4.6 547 547 A 9 GLU HBx A 10 ARG H 1.0 2.7 4.1 548 548 A 53 ILE H A 53 ILE HB 1.0 2.2 4.8 549 549 A 56 TRP H A 55 ARG H 1.0 2.6 4.0 550 550 A 64 GLN HBy A 63 PHE H 1.0 2.6 4.8 551 551 A 74 LYS HDy A 73 GLU H 1.0 2.6 3.8 552 552 A 46 PRO HGy A 47 GLN H 1.0 2.4 4.6 553 553 A 7 GLN H A 6 SER HA 1.0 2.8 5.2 554 554 A 63 PHE HA A 63 PHE H 1.0 0.9 4.3 555 555 A 60 GLY H A 62 CYS H 1.0 2.9 4.3 556 556 A 30 ASP H A 30 ASP HBy 1.0 2.5 3.7 557 557 A 68 ASN HBy A 68 ASN H 1.0 2.0 4.4 558 558 A 85 LEU HG A 86 ILE H 1.0 2.7 4.1 559 559 A 98 GLN HA A 98 GLN H 1.0 2.9 4.3 560 560 A 31 LEU H A 30 ASP H 1.0 2.6 4.0 561 561 A 50 THR H A 49 GLY H 1.0 2.8 4.2 562 562 A 70 PHE H A 71 GLY H 1.0 2.7 4.1 563 563 A 53 ILE HB A 55 ARG H 1.0 3.0 5.4 564 564 A 74 LYS H A 73 GLU H 1.0 2.0 4.4 565 565 A 57 ARG H A 57 ARG HBx 1.0 2.7 4.1 566 566 A 24 VAL HA A 25 LYS H 1.0 2.6 4.0 567 567 A 23 GLY H A 23 GLY HAx 1.0 2.6 3.8 568 568 A 29 ALA HB% A 30 ASP H 1.0 1.5 5.3 569 569 A 78 THR HB A 78 THR H 1.0 3.0 4.4 570 570 A 103 VAL HGy% A 103 VAL H 1.0 2.2 4.8 571 571 A 50 THR HB A 49 GLY H 1.0 3.0 4.4 572 572 A 67 TYR HBx A 68 ASN H 1.0 3.1 4.7 573 573 A 118 LEU HA A 118 LEU H 1.0 1.9 2.9 574 574 A 71 GLY H A 71 GLY HAx 1.0 2.8 4.2 575 575 A 6 SER H A 7 GLN HA 1.0 2.6 6.0 576 576 A 48 GLU HBx A 49 GLY H 1.0 3.1 4.7 577 577 A 74 LYS H A 73 GLU HBy 1.0 2.3 3.5 578 578 A 114 SER H A 113 ASN HA 1.0 2.3 3.5 579 579 A 26 VAL HB A 27 LYS H 1.0 2.6 4.8 580 580 A 24 VAL HG11 A 24 VAL H 1.0 3.6 5.4 581 581 A 99 VAL H A 98 GLN H 1.0 2.7 4.1 582 582 A 48 GLU H A 47 GLN HBy 1.0 2.7 4.1 583 583 A 53 ILE H A 52 ASP HA 1.0 2.0 4.6 584 584 A 7 GLN H A 7 GLN HBx 1.0 2.3 3.5 585 585 A 27 LYS H A 26 VAL HGx% 1.0 3.6 5.4 586 586 A 67 TYR H A 66 TYR HBy 1.0 3.0 4.4 587 587 A 48 GLU H A 48 GLU HA 1.0 3.2 4.8 588 588 A 31 LEU H A 30 ASP HBy 1.0 2.6 4.0 589 589 A 116 THR H A 116 THR HA 1.0 2.3 3.5 590 590 A 23 GLY HAx A 24 VAL H 1.0 3.1 4.7 591 591 A 64 GLN HA A 63 PHE H 1.0 2.6 5.8 592 592 A 30 ASP H A 30 ASP HA 1.0 3.0 4.6 593 593 A 74 LYS HBy A 74 LYS H 1.0 2.6 3.8 594 594 A 69 THR HA A 69 THR H 1.0 2.0 3.0 595 595 A 47 GLN HA A 47 GLN H 1.0 2.9 4.3 596 596 A 24 VAL H A 24 VAL HB 1.0 1.0 4.6 597 597 A 53 ILE HA A 52 ASP H 1.0 2.6 5.8 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin 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 86 ILE HG1x A 83 TRP HA 1.0 3.0 4.6 2 2 A 86 ILE HG1x A 44 TRP HZ2 1.0 3.0 4.6 3 3 A 86 ILE HG1x A 51 ILE HG1x 1.0 1.7 4.3 4 4 A 90 ILE HD1% A 51 ILE HG1x 1.0 2.7 4.3 5 5 A 77 VAL HB A 79 ALA HB% 1.0 3.2 5.8 6 6 A 18 ALA HB% A 85 LEU HD11 1.0 2.7 4.3 7 7 A 53 ILE HG1x A 54 LYS H 1.0 2.7 4.3 8 8 A 69 THR HG1 A 66 TYR HDx 1.0 2.7 4.3 9 9 A 59 VAL HGy% A 56 TRP HH2 1.0 2.5 4.3 10 10 A 59 VAL HGy% A 63 PHE HE1 1.0 2.7 4.3 11 11 A 59 VAL HGy% A 56 TRP HZ3 1.0 2.7 4.3 12 12 A 59 VAL HGy% A 60 GLY H 1.0 2.7 4.3 13 13 A 59 VAL HGy% A 63 PHE H 1.0 2.7 4.3 14 14 A 59 VAL HGy% A 43 PRO HBx 1.0 3.2 4.8 15 15 A 56 TRP HBx A 59 VAL HGx% 1.0 2.7 4.3 16 16 A 59 VAL HGy% A 43 PRO HBx 1.0 2.7 4.3 17 17 A 37 PHE HBx A 59 VAL HGy% 1.0 2.7 5.3 18 18 A 38 VAL HGy% A 37 PHE H 1.0 2.7 4.3 19 19 A 80 PHE HBx A 80 PHE HDx 1.0 3.0 4.6 20 20 A 75 VAL HGy% A 72 PRO HA 1.0 2.7 4.3 21 21 A 75 VAL HGy% A 74 LYS HBx 1.0 2.7 5.3 22 22 A 24 VAL HGy% A 19 LEU HD11 1.0 2.7 4.3 23 23 A 24 VAL HGy% A 22 ARG HGx 1.0 2.7 4.3 24 24 A 24 VAL HGy% A 82 TYR HEx 1.0 2.7 4.3 25 25 A 21 THR HG1 A 22 ARG HBx 1.0 2.7 4.3 26 26 A 21 THR HG1 A 22 ARG HGx 1.0 2.7 4.3 27 27 A 21 THR HG1 A 20 LYS H 1.0 2.7 4.3 28 28 A 50 THR HG1 A 49 GLY H 1.0 2.7 5.3 29 29 A 52 ASP H A 50 THR HG1 1.0 2.7 4.3 30 30 A 50 THR HG1 A 47 GLN H 1.0 2.7 5.3 31 31 A 50 THR HG1 A 45 PHE HEx 1.0 2.7 4.3 32 32 A 96 ASN H A 99 VAL HGy% 1.0 2.7 4.3 33 33 A 8 HIS HBx A 5 LEU HD11 1.0 2.7 4.3 34 34 A 15 LEU HD11 A 17 GLN H 1.0 2.7 4.3 35 35 A 19 LEU H A 15 LEU HD11 1.0 2.7 4.3 36 36 A 19 LEU HD11 A 82 TYR HDx 1.0 2.7 4.3 37 37 A 59 VAL HGx% A 41 THR HG1 1.0 2.7 5.3 38 38 A 59 VAL HGx% A 44 TRP HZ3 1.0 2.7 4.3 39 39 A 59 VAL HGx% A 56 TRP HH2 1.0 2.7 5.3 40 40 A 59 VAL HGx% A 56 TRP HZ2 1.0 2.7 5.3 41 41 A 12 VAL HGy% A 16 LYS HDx 1.0 2.7 4.3 42 42 A 12 VAL HGy% A 35 PHE HA 1.0 2.7 4.3 43 43 A 12 VAL HGy% A 35 PHE HDx 1.0 2.7 4.3 44 44 A 31 LEU HD11 A 30 ASP H 1.0 2.7 4.3 45 45 A 38 VAL HGy% A 39 LYS HDx 1.0 2.7 5.3 46 46 A 38 VAL HGy% A 43 PRO HDx 1.0 2.7 4.3 47 47 A 38 VAL HGx% A 59 VAL HGy% 1.0 2.7 4.3 48 48 A 32 LEU HG A 30 ASP H 1.0 2.7 4.3 49 49 A 89 LEU HG A 86 ILE HA 1.0 2.7 5.3 50 50 A 89 LEU HG A 86 ILE HG1y 1.0 2.7 5.3 51 51 A 31 LEU HG A 35 PHE HDx 1.0 2.7 4.3 52 52 A 51 ILE HG1x A 86 ILE HG1y 1.0 2.7 4.3 53 52 A 51 ILE HG1y A 86 ILE HG1y 1.0 2.7 4.3 54 52 A 86 ILE HG1x A 51 ILE HG1y 1.0 2.7 4.3 55 52 A 51 ILE HG1x A 86 ILE HG1x 1.0 2.7 4.3 56 53 A 90 ILE HA A 51 ILE HG1y 1.0 2.7 4.3 57 53 A 90 ILE HA A 51 ILE HG1x 1.0 2.7 4.3 58 54 A 16 LYS HGy A 13 GLU H 1.0 2.7 5.3 59 55 A 17 GLN H A 16 LYS HGx 1.0 2.7 5.3 60 56 A 43 PRO HDx A 44 TRP HA 1.0 2.7 5.3 61 57 A 26 VAL HB A 27 LYS H 1.0 2.7 4.3 62 58 A 51 ILE HD1% A 11 TYR HEx 1.0 3.3 4.9 63 59 A 69 THR HB A 70 PHE HDx 1.0 3.3 4.9 64 60 A 15 LEU HG A 11 TYR HDx 1.0 3.1 4.7 65 61 A 46 PRO HDy A 45 PHE HDx 1.0 3.4 5.2 66 62 A 11 TYR HDx A 15 LEU HDy% 1.0 3.5 5.7 67 63 A 11 TYR HDx A 11 TYR HBx 1.0 2.1 4.7 68 64 A 69 THR HG1 A 70 PHE HDx 1.0 3.0 4.4 69 65 A 35 PHE HDx A 35 PHE HBx 1.0 2.0 4.4 70 66 A 66 TYR HBx A 66 TYR HDx 1.0 2.0 4.4 71 67 A 38 VAL HGy% A 34 PHE HDx 1.0 3.3 4.9 72 68 A 38 VAL HGx% A 34 PHE HEx 1.0 3.1 4.7 73 69 A 86 ILE HD1% A 11 TYR HEx 1.0 3.6 5.4 74 70 A 86 ILE HD1% A 11 TYR HDx 1.0 3.6 5.4 75 71 A 68 ASN HA A 67 TYR HEx 1.0 3.3 4.9 76 72 A 86 ILE HG1x A 11 TYR HEx 1.0 4.2 6.4 77 73 A 11 TYR HEx A 11 TYR HBx 1.0 3.2 4.8 78 74 A 51 ILE HD1% A 11 TYR HEx 1.0 3.0 4.6 79 75 A 66 TYR HBx A 66 TYR HEx 1.0 3.3 4.9 80 76 A 67 TYR HEx A 75 VAL HG11 1.0 2.8 5.6 81 77 A 79 ALA HB% A 56 TRP HZ2 1.0 3.0 4.4 82 78 A 38 VAL HGx% A 37 PHE HDx 1.0 3.3 4.9 83 79 A 72 PRO HDx A 67 TYR HEx 1.0 3.3 4.9 84 80 A 86 ILE HB A 82 TYR HDx 1.0 2.7 4.3 85 81 A 86 ILE HB A 83 TRP H 1.0 2.7 4.3 86 82 A 77 VAL HGy% A 75 VAL HB 1.0 2.7 4.3 87 83 A 51 ILE HB A 44 TRP HE1 1.0 2.7 4.3 88 84 A 52 ASP H A 51 ILE HB 1.0 2.7 4.3 89 85 A 34 PHE H A 35 PHE HBx 1.0 2.7 5.3 90 86 A 11 TYR HEx A 15 LEU HBx 1.0 2.7 4.3 91 87 A 33 LYS H A 32 LEU HBx 1.0 2.7 4.3 92 88 A 33 LYS HA A 32 LEU HBx 1.0 2.7 4.3 93 89 A 53 ILE H A 52 ASP HA 1.0 1.7 4.3 94 90 A 52 ASP HA A 53 ILE HG1x 1.0 2.7 5.5 95 91 A 25 LYS HA A 24 VAL HB 1.0 2.7 4.3 96 92 A 26 VAL HGy% A 25 LYS HA 1.0 2.7 4.3 97 93 A 31 LEU HA A 35 PHE HA 1.0 2.7 4.3 98 94 A 31 LEU HA A 35 PHE HDx 1.0 2.7 4.3 99 95 A 19 LEU HA A 22 ARG HA 1.0 2.7 5.3 100 96 A 33 LYS HA A 32 LEU HA 1.0 2.7 4.3 101 97 A 39 LYS HA A 40 ASP HA 1.0 2.7 5.3 102 98 A 14 GLN HA A 17 GLN H 1.0 2.7 4.3 103 99 A 14 GLN HA A 10 ARG HBy 1.0 2.7 5.3 104 100 A 90 ILE HD1% A 87 LYS HA 1.0 2.7 5.3 105 101 A 86 ILE HG1x A 87 LYS HA 1.0 2.7 4.3 106 102 A 86 ILE HG1x A 87 LYS HA 1.0 2.7 4.3 107 103 A 86 ILE HA A 87 LYS HA 1.0 2.7 5.3 108 104 A 87 LYS HA A 84 ASN HA 1.0 2.7 5.3 109 105 A 9 GLU HA A 12 VAL HB 1.0 2.7 4.3 110 106 A 5 LEU HG A 6 SER HA 1.0 2.7 4.3 111 107 A 16 LYS HA A 20 LYS H 1.0 2.7 4.3 112 108 A 86 ILE HA A 85 LEU HA 1.0 2.7 5.3 113 109 A 69 THR HA A 70 PHE H 1.0 2.7 4.3 114 110 A 90 ILE HA A 95 VAL HG11 1.0 2.7 4.3 115 111 A 90 ILE HA A 92 LYS HBx 1.0 2.7 5.3 116 112 A 97 PRO HA A 99 VAL H 1.0 2.7 4.3 117 113 A 59 VAL HA A 63 PHE HE1 1.0 2.7 4.3 118 114 A 78 THR HB A 82 TYR HEx 1.0 2.7 4.3 119 115 A 98 GLN HA A 50 THR HB 1.0 2.7 5.3 120 116 A 74 LYS H A 73 GLU HGx 1.0 2.7 5.3 121 117 A 86 ILE HD1% A 44 TRP HE3 1.0 2.7 5.3 122 117 A 86 ILE HD1% A 44 TRP HE1 1.0 2.7 5.3 123 118 A 59 VAL HGy% A 37 PHE HDx 1.0 2.7 5.3 124 119 A 38 VAL HGy% A 34 PHE HEx 1.0 2.7 5.3 125 120 A 12 VAL HGy% A 35 PHE HEx 1.0 2.7 5.3 126 121 A 35 PHE HEx A 31 LEU HD2% 1.0 2.7 5.3 127 122 A 57 ARG HA A 56 TRP HD1 1.0 2.7 5.3 128 123 A 70 PHE HDx A 66 TYR HA 1.0 2.7 5.3 129 124 A 34 PHE HDx A 33 LYS HGx 1.0 2.7 5.3 130 125 A 48 GLU HBy A 98 GLN HGy 1.0 1.2 5.7 131 126 A 98 GLN HA A 48 GLU HBy 1.0 1.2 5.7 132 127 A 102 ALA HB% A 48 GLU HBy 1.0 1.2 5.7 133 128 A 101 ALA HB% A 48 GLU HBy 1.0 1.2 5.7 134 129 A 104 ALA HB% A 48 GLU HBy 1.0 1.2 5.7 135 130 A 102 ALA HB% A 48 GLU HGy 1.0 1.2 5.7 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 9 GLU H A 5 LEU O 1.0 1.8 2.3 2 2 A 5 LEU O A 9 GLU N 1.0 2.8 3.3 3 3 A 10 ARG H A 6 SER O 1.0 1.8 2.3 4 4 A 6 SER O A 10 ARG N 1.0 2.8 3.3 5 5 A 11 TYR H A 7 GLN O 1.0 1.8 2.3 6 6 A 7 GLN O A 11 TYR N 1.0 2.8 3.3 7 7 A 12 VAL H A 8 HIS O 1.0 1.8 2.3 8 8 A 8 HIS O A 12 VAL N 1.0 2.8 3.3 9 9 A 13 GLU H A 9 GLU O 1.0 1.8 2.3 10 10 A 9 GLU O A 13 GLU N 1.0 2.8 3.3 11 11 A 14 GLN H A 10 ARG O 1.0 1.8 2.3 12 12 A 10 ARG O A 14 GLN N 1.0 2.8 3.3 13 13 A 15 LEU H A 11 TYR O 1.0 1.8 2.3 14 14 A 11 TYR O A 15 LEU N 1.0 2.8 3.3 15 15 A 16 LYS H A 12 VAL O 1.0 1.8 2.3 16 16 A 12 VAL O A 16 LYS N 1.0 2.8 3.3 17 17 A 17 GLN H A 13 GLU O 1.0 1.8 2.3 18 18 A 13 GLU O A 17 GLN N 1.0 2.8 3.3 19 19 A 18 ALA H A 14 GLN O 1.0 1.8 2.3 20 20 A 14 GLN O A 18 ALA N 1.0 2.8 3.3 21 21 A 19 LEU H A 15 LEU O 1.0 1.8 2.3 22 22 A 15 LEU O A 19 LEU N 1.0 2.8 3.3 23 23 A 20 LYS H A 16 LYS O 1.0 1.8 2.3 24 24 A 16 LYS O A 20 LYS N 1.0 2.8 3.3 25 25 A 21 THR H A 17 GLN O 1.0 1.8 2.3 26 26 A 17 GLN O A 21 THR N 1.0 2.8 3.3 27 27 A 32 LEU H A 28 TYR O 1.0 1.8 2.3 28 28 A 28 TYR O A 32 LEU N 1.0 2.8 3.3 29 29 A 34 PHE H A 30 ASP O 1.0 1.8 2.3 30 30 A 30 ASP O A 34 PHE N 1.0 2.8 3.3 31 31 A 35 PHE H A 31 LEU O 1.0 1.8 2.3 32 32 A 31 LEU O A 35 PHE N 1.0 2.8 3.3 33 33 A 36 ASP H A 32 LEU O 1.0 1.8 2.3 34 34 A 32 LEU O A 36 ASP N 1.0 2.8 3.3 35 35 A 37 PHE H A 33 LYS O 1.0 1.8 2.3 36 36 A 33 LYS O A 37 PHE N 1.0 2.8 3.3 37 37 A 38 VAL H A 34 PHE O 1.0 1.8 2.3 38 38 A 34 PHE O A 38 VAL N 1.0 2.8 3.3 39 39 A 39 LYS H A 35 PHE O 1.0 1.8 2.3 40 40 A 35 PHE O A 39 LYS N 1.0 2.8 3.3 41 41 A 40 ASP H A 36 ASP O 1.0 1.8 2.3 42 42 A 36 ASP O A 40 ASP N 1.0 2.8 3.3 43 43 A 58 ARG H A 54 LYS O 1.0 1.8 2.3 44 44 A 54 LYS O A 58 ARG N 1.0 2.8 3.3 45 45 A 59 VAL H A 55 ARG O 1.0 1.8 2.3 46 46 A 55 ARG O A 59 VAL N 1.0 2.8 3.3 47 47 A 60 GLY H A 56 TRP O 1.0 1.8 2.3 48 48 A 56 TRP O A 60 GLY N 1.0 2.8 3.3 49 49 A 61 ASP H A 57 ARG O 1.0 1.8 2.3 50 50 A 57 ARG O A 61 ASP N 1.0 2.8 3.3 51 51 A 62 CYS H A 58 ARG O 1.0 1.8 2.3 52 52 A 58 ARG O A 62 CYS N 1.0 2.8 3.3 53 53 A 63 PHE H A 59 VAL O 1.0 1.8 2.3 54 54 A 59 VAL O A 63 PHE N 1.0 2.8 3.3 55 55 A 64 GLN H A 60 GLY O 1.0 1.8 2.3 56 56 A 60 GLY O A 64 GLN N 1.0 2.8 3.3 57 57 A 65 ASP H A 61 ASP O 1.0 1.8 2.3 58 58 A 61 ASP O A 65 ASP N 1.0 2.8 3.3 59 59 A 66 TYR H A 62 CYS O 1.0 1.8 2.3 60 60 A 62 CYS O A 66 TYR N 1.0 2.8 3.3 61 61 A 67 TYR H A 63 PHE O 1.0 1.8 2.3 62 62 A 63 PHE O A 67 TYR N 1.0 2.8 3.3 63 63 A 68 ASN H A 64 GLN O 1.0 1.8 2.3 64 64 A 64 GLN O A 68 ASN N 1.0 2.8 3.3 65 65 A 69 THR H A 65 ASP O 1.0 1.8 2.3 66 66 A 65 ASP O A 69 THR N 1.0 2.8 3.3 67 67 A 83 TRP H A 79 ALA O 1.0 1.8 2.3 68 68 A 79 ALA O A 83 TRP N 1.0 2.8 3.3 69 69 A 84 ASN H A 80 PHE O 1.0 1.8 2.3 70 70 A 80 PHE O A 84 ASN N 1.0 2.8 3.3 71 71 A 85 LEU H A 81 SER O 1.0 1.8 2.3 72 72 A 81 SER O A 85 LEU N 1.0 2.8 3.3 73 73 A 86 ILE H A 82 TYR O 1.0 1.8 2.3 74 74 A 82 TYR O A 86 ILE N 1.0 2.8 3.3 75 75 A 87 LYS H A 83 TRP O 1.0 1.8 2.3 76 76 A 83 TRP O A 87 LYS N 1.0 2.8 3.3 77 77 A 88 GLU H A 84 ASN O 1.0 1.8 2.3 78 78 A 84 ASN O A 88 GLU N 1.0 2.8 3.3 79 79 A 89 LEU H A 85 LEU O 1.0 1.8 2.3 80 80 A 85 LEU O A 89 LEU N 1.0 2.8 3.3 81 81 A 90 ILE H A 86 ILE O 1.0 1.8 2.3 82 82 A 86 ILE O A 90 ILE N 1.0 2.8 3.3 83 83 A 102 ALA H A 98 GLN O 1.0 1.8 2.3 84 84 A 98 GLN O A 102 ALA N 1.0 2.8 3.3 stop_ save_ save_CNS/XPLOR_dihedral_5 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_5 _nef_dihedral_restraint_list.restraint_origin chemical_shift _nef_dihedral_restraint_list.potential_type square-well-parabolic 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 5 LEU N A 5 LEU CA A 5 LEU C A 6 SER N 1.0 -64.3 -24.3 PSI 2 2 A 5 LEU C A 6 SER N A 6 SER CA A 6 SER C 1.0 -84.2 -44.2 PHI 3 3 A 6 SER N A 6 SER CA A 6 SER C A 7 GLN N 1.0 -62.6 -22.6 PSI 4 4 A 6 SER C A 7 GLN N A 7 GLN CA A 7 GLN C 1.0 -88.0 -48.0 PHI 5 5 A 7 GLN N A 7 GLN CA A 7 GLN C A 8 HIS N 1.0 -60.9 -20.9 PSI 6 6 A 7 GLN C A 8 HIS N A 8 HIS CA A 8 HIS C 1.0 -82.7 -42.7 PHI 7 7 A 8 HIS N A 8 HIS CA A 8 HIS C A 9 GLU N 1.0 -61.8 -21.8 PSI 8 8 A 8 HIS C A 9 GLU N A 9 GLU CA A 9 GLU C 1.0 -85.2 -45.2 PHI 9 9 A 9 GLU N A 9 GLU CA A 9 GLU C A 10 ARG N 1.0 -63.1 -23.1 PSI 10 10 A 9 GLU C A 10 ARG N A 10 ARG CA A 10 ARG C 1.0 -88.1 -48.1 PHI 11 11 A 10 ARG N A 10 ARG CA A 10 ARG C A 11 TYR N 1.0 -55.7 -15.7 PSI 12 12 A 10 ARG C A 11 TYR N A 11 TYR CA A 11 TYR C 1.0 -104.0 -37.0 PHI 13 13 A 11 TYR N A 11 TYR CA A 11 TYR C A 12 VAL N 1.0 -65.1 -19.1 PSI 14 14 A 11 TYR C A 12 VAL N A 12 VAL CA A 12 VAL C 1.0 -89.6 -46.8 PHI 15 15 A 12 VAL N A 12 VAL CA A 12 VAL C A 13 GLU N 1.0 -60.6 -20.6 PSI 16 16 A 12 VAL C A 13 GLU N A 13 GLU CA A 13 GLU C 1.0 -120.5 -54.5 PHI 17 17 A 13 GLU N A 13 GLU CA A 13 GLU C A 14 GLN N 1.0 -47.1 32.5 PSI 18 18 A 14 GLN C A 15 LEU N A 15 LEU CA A 15 LEU C 1.0 -79.7 -39.7 PHI 19 19 A 15 LEU N A 15 LEU CA A 15 LEU C A 16 LYS N 1.0 -60.2 -20.2 PSI 20 20 A 15 LEU C A 16 LYS N A 16 LYS CA A 16 LYS C 1.0 -81.7 -41.7 PHI 21 21 A 16 LYS N A 16 LYS CA A 16 LYS C A 17 GLN N 1.0 -65.1 -25.1 PSI 22 22 A 16 LYS C A 17 GLN N A 17 GLN CA A 17 GLN C 1.0 -83.0 -43.0 PHI 23 23 A 17 GLN N A 17 GLN CA A 17 GLN C A 18 ALA N 1.0 -61.0 -21.0 PSI 24 24 A 17 GLN C A 18 ALA N A 18 ALA CA A 18 ALA C 1.0 -82.0 -42.0 PHI 25 25 A 18 ALA N A 18 ALA CA A 18 ALA C A 19 LEU N 1.0 -60.0 -20.0 PSI 26 26 A 18 ALA C A 19 LEU N A 19 LEU CA A 19 LEU C 1.0 -82.9 -42.9 PHI 27 27 A 19 LEU N A 19 LEU CA A 19 LEU C A 20 LYS N 1.0 -62.6 -22.6 PSI 28 28 A 19 LEU C A 20 LYS N A 20 LYS CA A 20 LYS C 1.0 -80.3 -40.3 PHI 29 29 A 20 LYS N A 20 LYS CA A 20 LYS C A 21 THR N 1.0 -59.2 -19.2 PSI 30 30 A 20 LYS C A 21 THR N A 21 THR CA A 21 THR C 1.0 -86.7 -46.7 PHI 31 31 A 21 THR N A 21 THR CA A 21 THR C A 22 ARG N 1.0 -52.3 -12.3 PSI 32 32 A 21 THR C A 22 ARG N A 22 ARG CA A 22 ARG C 1.0 -106.5 -66.5 PHI 33 33 A 22 ARG N A 22 ARG CA A 22 ARG C A 23 GLY N 1.0 -23.5 25.5 PSI 34 34 A 22 ARG C A 23 GLY N A 23 GLY CA A 23 GLY C 1.0 62.6 107.8 PHI 35 35 A 23 GLY N A 23 GLY CA A 23 GLY C A 24 VAL N 1.0 -30.9 52.3 PSI 36 36 A 23 GLY C A 24 VAL N A 24 VAL CA A 24 VAL C 1.0 -106.6 -55.2 PHI 37 37 A 24 VAL N A 24 VAL CA A 24 VAL C A 25 LYS N 1.0 105.2 168.0 PSI 38 38 A 26 VAL C A 27 LYS N A 27 LYS CA A 27 LYS C 1.0 -108.7 -54.1 PHI 39 39 A 27 LYS N A 27 LYS CA A 27 LYS C A 28 TYR N 1.0 82.3 163.5 PSI 40 40 A 27 LYS C A 28 TYR N A 28 TYR CA A 28 TYR C 1.0 -78.5 -38.5 PHI 41 41 A 28 TYR N A 28 TYR CA A 28 TYR C A 29 ALA N 1.0 -60.4 -20.4 PSI 42 42 A 28 TYR C A 29 ALA N A 29 ALA CA A 29 ALA C 1.0 -79.3 -39.3 PHI 43 43 A 29 ALA N A 29 ALA CA A 29 ALA C A 30 ASP N 1.0 -66.1 -26.1 PSI 44 44 A 29 ALA C A 30 ASP N A 30 ASP CA A 30 ASP C 1.0 -88.8 -48.8 PHI 45 45 A 30 ASP N A 30 ASP CA A 30 ASP C A 31 LEU N 1.0 -55.6 -15.2 PSI 46 46 A 30 ASP C A 31 LEU N A 31 LEU CA A 31 LEU C 1.0 -105.0 -32.0 PHI 47 47 A 31 LEU N A 31 LEU CA A 31 LEU C A 32 LEU N 1.0 -58.9 -15.3 PSI 48 48 A 31 LEU C A 32 LEU N A 32 LEU CA A 32 LEU C 1.0 -82.4 -42.4 PHI 49 49 A 32 LEU N A 32 LEU CA A 32 LEU C A 33 LYS N 1.0 -66.3 -26.3 PSI 50 50 A 32 LEU C A 33 LYS N A 33 LYS CA A 33 LYS C 1.0 -85.3 -45.3 PHI 51 51 A 33 LYS N A 33 LYS CA A 33 LYS C A 34 PHE N 1.0 -56.7 -14.1 PSI 52 52 A 33 LYS C A 34 PHE N A 34 PHE CA A 34 PHE C 1.0 -83.5 -43.5 PHI 53 53 A 34 PHE N A 34 PHE CA A 34 PHE C A 35 PHE N 1.0 -64.6 -24.6 PSI 54 54 A 34 PHE C A 35 PHE N A 35 PHE CA A 35 PHE C 1.0 -82.5 -42.5 PHI 55 55 A 35 PHE N A 35 PHE CA A 35 PHE C A 36 ASP N 1.0 -62.7 -22.7 PSI 56 56 A 35 PHE C A 36 ASP N A 36 ASP CA A 36 ASP C 1.0 -86.1 -46.1 PHI 57 57 A 36 ASP N A 36 ASP CA A 36 ASP C A 37 PHE N 1.0 -62.4 -22.4 PSI 58 58 A 36 ASP C A 37 PHE N A 37 PHE CA A 37 PHE C 1.0 -86.0 -46.0 PHI 59 59 A 37 PHE N A 37 PHE CA A 37 PHE C A 38 VAL N 1.0 -60.3 -20.3 PSI 60 60 A 37 PHE C A 38 VAL N A 38 VAL CA A 38 VAL C 1.0 -83.7 -43.7 PHI 61 61 A 38 VAL N A 38 VAL CA A 38 VAL C A 39 LYS N 1.0 -63.8 -23.8 PSI 62 62 A 38 VAL C A 39 LYS N A 39 LYS CA A 39 LYS C 1.0 -80.9 -40.9 PHI 63 63 A 39 LYS N A 39 LYS CA A 39 LYS C A 40 ASP N 1.0 -66.2 -26.2 PSI 64 64 A 39 LYS C A 40 ASP N A 40 ASP CA A 40 ASP C 1.0 -101.5 -26.7 PHI 65 65 A 40 ASP N A 40 ASP CA A 40 ASP C A 41 THR N 1.0 -61.1 -21.1 PSI 66 66 A 40 ASP C A 41 THR N A 41 THR CA A 41 THR C 1.0 -114.6 -65.2 PHI 67 67 A 41 THR N A 41 THR CA A 41 THR C A 42 CYS N 1.0 -63.6 18.4 PSI 68 68 A 42 CYS C A 43 PRO N A 43 PRO CA A 43 PRO C 1.0 -79.7 -39.7 PHI 69 69 A 43 PRO N A 43 PRO CA A 43 PRO C A 44 TRP N 1.0 -38.1 1.9 PSI 70 70 A 43 PRO C A 44 TRP N A 44 TRP CA A 44 TRP C 1.0 -121.8 -58.4 PHI 71 71 A 44 TRP N A 44 TRP CA A 44 TRP C A 45 PHE N 1.0 -43.2 26.2 PSI 72 72 A 45 PHE C A 46 PRO N A 46 PRO CA A 46 PRO C 1.0 -79.4 -39.4 PHI 73 73 A 46 PRO N A 46 PRO CA A 46 PRO C A 47 GLN N 1.0 -48.5 -1.1 PSI 74 74 A 46 PRO C A 47 GLN N A 47 GLN CA A 47 GLN C 1.0 -82.9 -42.9 PHI 75 75 A 47 GLN N A 47 GLN CA A 47 GLN C A 48 GLU N 1.0 -52.7 -12.7 PSI 76 76 A 47 GLN C A 48 GLU N A 48 GLU CA A 48 GLU C 1.0 -86.0 -46.0 PHI 77 77 A 48 GLU N A 48 GLU CA A 48 GLU C A 49 GLY N 1.0 -55.7 -15.7 PSI 78 78 A 49 GLY C A 50 THR N A 50 THR CA A 50 THR C 1.0 -168.9 -57.9 PHI 79 79 A 50 THR N A 50 THR CA A 50 THR C A 51 ILE N 1.0 113.0 170.4 PSI 80 80 A 50 THR C A 51 ILE N A 51 ILE CA A 51 ILE C 1.0 -169.5 -63.1 PHI 81 81 A 51 ILE N A 51 ILE CA A 51 ILE C A 52 ASP N 1.0 72.1 186.7 PSI 82 82 A 51 ILE C A 52 ASP N A 52 ASP CA A 52 ASP C 1.0 -174.8 -61.4 PHI 83 83 A 52 ASP N A 52 ASP CA A 52 ASP C A 53 ILE N 1.0 125.4 189.6 PSI 84 84 A 52 ASP C A 53 ILE N A 53 ILE CA A 53 ILE C 1.0 -92.7 -42.5 PHI 85 85 A 53 ILE N A 53 ILE CA A 53 ILE C A 54 LYS N 1.0 -54.3 -14.3 PSI 86 86 A 53 ILE C A 54 LYS N A 54 LYS CA A 54 LYS C 1.0 -84.3 -44.3 PHI 87 87 A 54 LYS N A 54 LYS CA A 54 LYS C A 55 ARG N 1.0 -59.2 -19.2 PSI 88 88 A 54 LYS C A 55 ARG N A 55 ARG CA A 55 ARG C 1.0 -84.6 -44.6 PHI 89 89 A 55 ARG N A 55 ARG CA A 55 ARG C A 56 TRP N 1.0 -58.7 -18.7 PSI 90 90 A 55 ARG C A 56 TRP N A 56 TRP CA A 56 TRP C 1.0 -84.9 -44.9 PHI 91 91 A 56 TRP N A 56 TRP CA A 56 TRP C A 57 ARG N 1.0 -60.6 -20.6 PSI 92 92 A 56 TRP C A 57 ARG N A 57 ARG CA A 57 ARG C 1.0 -83.9 -43.9 PHI 93 93 A 57 ARG N A 57 ARG CA A 57 ARG C A 58 ARG N 1.0 -59.8 -19.8 PSI 94 94 A 57 ARG C A 58 ARG N A 58 ARG CA A 58 ARG C 1.0 -83.9 -43.9 PHI 95 95 A 58 ARG N A 58 ARG CA A 58 ARG C A 59 VAL N 1.0 -61.8 -21.8 PSI 96 96 A 58 ARG C A 59 VAL N A 59 VAL CA A 59 VAL C 1.0 -84.1 -44.1 PHI 97 97 A 59 VAL N A 59 VAL CA A 59 VAL C A 60 GLY N 1.0 -62.8 -22.8 PSI 98 98 A 59 VAL C A 60 GLY N A 60 GLY CA A 60 GLY C 1.0 -83.5 -43.5 PHI 99 99 A 60 GLY N A 60 GLY CA A 60 GLY C A 61 ASP N 1.0 -61.2 -21.2 PSI 100 100 A 60 GLY C A 61 ASP N A 61 ASP CA A 61 ASP C 1.0 -86.3 -46.3 PHI 101 101 A 61 ASP N A 61 ASP CA A 61 ASP C A 62 CYS N 1.0 -60.4 -20.4 PSI 102 102 A 61 ASP C A 62 CYS N A 62 CYS CA A 62 CYS C 1.0 -81.5 -41.5 PHI 103 103 A 62 CYS N A 62 CYS CA A 62 CYS C A 63 PHE N 1.0 -65.9 -25.9 PSI 104 104 A 62 CYS C A 63 PHE N A 63 PHE CA A 63 PHE C 1.0 -84.6 -44.6 PHI 105 105 A 63 PHE N A 63 PHE CA A 63 PHE C A 64 GLN N 1.0 -61.2 -21.2 PSI 106 106 A 63 PHE C A 64 GLN N A 64 GLN CA A 64 GLN C 1.0 -83.7 -43.7 PHI 107 107 A 64 GLN N A 64 GLN CA A 64 GLN C A 65 ASP N 1.0 -58.3 -18.3 PSI 108 108 A 64 GLN C A 65 ASP N A 65 ASP CA A 65 ASP C 1.0 -88.2 -48.2 PHI 109 109 A 65 ASP N A 65 ASP CA A 65 ASP C A 66 TYR N 1.0 -59.1 -19.1 PSI 110 110 A 65 ASP C A 66 TYR N A 66 TYR CA A 66 TYR C 1.0 -86.7 -46.7 PHI 111 111 A 66 TYR N A 66 TYR CA A 66 TYR C A 67 TYR N 1.0 -56.2 -16.2 PSI 112 112 A 66 TYR C A 67 TYR N A 67 TYR CA A 67 TYR C 1.0 -84.2 -44.2 PHI 113 113 A 67 TYR N A 67 TYR CA A 67 TYR C A 68 ASN N 1.0 -63.1 -23.1 PSI 114 114 A 67 TYR C A 68 ASN N A 68 ASN CA A 68 ASN C 1.0 -84.6 -44.6 PHI 115 115 A 68 ASN N A 68 ASN CA A 68 ASN C A 69 THR N 1.0 -59.1 -19.1 PSI 116 116 A 68 ASN C A 69 THR N A 69 THR CA A 69 THR C 1.0 -88.2 -48.2 PHI 117 117 A 69 THR N A 69 THR CA A 69 THR C A 70 PHE N 1.0 -59.0 -19.0 PSI 118 118 A 69 THR C A 70 PHE N A 70 PHE CA A 70 PHE C 1.0 -128.0 -60.4 PHI 119 119 A 70 PHE N A 70 PHE CA A 70 PHE C A 71 GLY N 1.0 -48.4 14.4 PSI 120 120 A 72 PRO C A 73 GLU N A 73 GLU CA A 73 GLU C 1.0 -85.8 -45.8 PHI 121 121 A 73 GLU N A 73 GLU CA A 73 GLU C A 74 LYS N 1.0 -49.2 7.2 PSI 122 122 A 73 GLU C A 74 LYS N A 74 LYS CA A 74 LYS C 1.0 -136.4 -59.8 PHI 123 123 A 74 LYS N A 74 LYS CA A 74 LYS C A 75 VAL N 1.0 -46.5 31.7 PSI 124 124 A 75 VAL C A 76 PRO N A 76 PRO CA A 76 PRO C 1.0 -85.2 -40.4 PHI 125 125 A 76 PRO N A 76 PRO CA A 76 PRO C A 77 VAL N 1.0 128.3 168.3 PSI 126 126 A 76 PRO C A 77 VAL N A 77 VAL CA A 77 VAL C 1.0 -79.6 -25.4 PHI 127 127 A 77 VAL N A 77 VAL CA A 77 VAL C A 78 THR N 1.0 -67.2 -7.4 PSI 128 128 A 77 VAL C A 78 THR N A 78 THR CA A 78 THR C 1.0 -101.6 -41.8 PHI 129 129 A 78 THR N A 78 THR CA A 78 THR C A 79 ALA N 1.0 -56.2 4.0 PSI 130 130 A 78 THR C A 79 ALA N A 79 ALA CA A 79 ALA C 1.0 -82.5 -42.5 PHI 131 131 A 79 ALA N A 79 ALA CA A 79 ALA C A 80 PHE N 1.0 -64.7 -24.7 PSI 132 132 A 79 ALA C A 80 PHE N A 80 PHE CA A 80 PHE C 1.0 -84.0 -44.0 PHI 133 133 A 80 PHE N A 80 PHE CA A 80 PHE C A 81 SER N 1.0 -56.8 -16.8 PSI 134 134 A 80 PHE C A 81 SER N A 81 SER CA A 81 SER C 1.0 -84.7 -44.7 PHI 135 135 A 81 SER N A 81 SER CA A 81 SER C A 82 TYR N 1.0 -63.6 -23.6 PSI 136 136 A 81 SER C A 82 TYR N A 82 TYR CA A 82 TYR C 1.0 -81.3 -41.3 PHI 137 137 A 82 TYR N A 82 TYR CA A 82 TYR C A 83 TRP N 1.0 -61.4 -21.4 PSI 138 138 A 82 TYR C A 83 TRP N A 83 TRP CA A 83 TRP C 1.0 -80.7 -40.7 PHI 139 139 A 83 TRP N A 83 TRP CA A 83 TRP C A 84 ASN N 1.0 -61.6 -21.6 PSI 140 140 A 83 TRP C A 84 ASN N A 84 ASN CA A 84 ASN C 1.0 -81.7 -41.7 PHI 141 141 A 84 ASN N A 84 ASN CA A 84 ASN C A 85 LEU N 1.0 -62.5 -22.5 PSI 142 142 A 84 ASN C A 85 LEU N A 85 LEU CA A 85 LEU C 1.0 -81.6 -41.6 PHI 143 143 A 85 LEU N A 85 LEU CA A 85 LEU C A 86 ILE N 1.0 -64.9 -24.9 PSI 144 144 A 85 LEU C A 86 ILE N A 86 ILE CA A 86 ILE C 1.0 -84.4 -44.4 PHI 145 145 A 86 ILE N A 86 ILE CA A 86 ILE C A 87 LYS N 1.0 -56.8 -16.8 PSI 146 146 A 86 ILE C A 87 LYS N A 87 LYS CA A 87 LYS C 1.0 -80.2 -40.2 PHI 147 147 A 87 LYS N A 87 LYS CA A 87 LYS C A 88 GLU N 1.0 -64.8 -24.8 PSI 148 148 A 87 LYS C A 88 GLU N A 88 GLU CA A 88 GLU C 1.0 -79.8 -39.8 PHI 149 149 A 88 GLU N A 88 GLU CA A 88 GLU C A 89 LEU N 1.0 -60.8 -20.8 PSI 150 150 A 88 GLU C A 89 LEU N A 89 LEU CA A 89 LEU C 1.0 -84.2 -44.2 PHI 151 151 A 89 LEU N A 89 LEU CA A 89 LEU C A 90 ILE N 1.0 -61.3 -21.3 PSI 152 152 A 89 LEU C A 90 ILE N A 90 ILE CA A 90 ILE C 1.0 -84.1 -44.1 PHI 153 153 A 90 ILE N A 90 ILE CA A 90 ILE C A 91 ASP N 1.0 -64.5 -24.5 PSI 154 154 A 90 ILE C A 91 ASP N A 91 ASP CA A 91 ASP C 1.0 -85.0 -45.0 PHI 155 155 A 91 ASP N A 91 ASP CA A 91 ASP C A 92 LYS N 1.0 -51.2 -8.2 PSI 156 156 A 93 LYS C A 94 GLU N A 94 GLU CA A 94 GLU C 1.0 -134.8 -55.2 PHI 157 157 A 94 GLU N A 94 GLU CA A 94 GLU C A 95 VAL N 1.0 -48.4 53.8 PSI 158 158 A 95 VAL C A 96 ASN N A 96 ASN CA A 96 ASN C 1.0 -153.2 -26.6 PHI 159 159 A 96 ASN N A 96 ASN CA A 96 ASN C A 97 PRO N 1.0 88.3 194.3 PSI 160 160 A 96 ASN C A 97 PRO N A 97 PRO CA A 97 PRO C 1.0 -74.4 -34.4 PHI 161 161 A 97 PRO N A 97 PRO CA A 97 PRO C A 98 GLN N 1.0 -54.5 -14.5 PSI 162 162 A 97 PRO C A 98 GLN N A 98 GLN CA A 98 GLN C 1.0 -87.3 -47.3 PHI 163 163 A 98 GLN N A 98 GLN CA A 98 GLN C A 99 VAL N 1.0 -56.1 -16.1 PSI 164 164 A 98 GLN C A 99 VAL N A 99 VAL CA A 99 VAL C 1.0 -84.5 -44.5 PHI 165 165 A 99 VAL N A 99 VAL CA A 99 VAL C A 100 MET N 1.0 -61.4 -21.4 PSI 166 166 A 99 VAL C A 100 MET N A 100 MET CA A 100 MET C 1.0 -81.8 -41.8 PHI 167 167 A 100 MET N A 100 MET CA A 100 MET C A 101 ALA N 1.0 -62.5 -22.5 PSI 168 168 A 100 MET C A 101 ALA N A 101 ALA CA A 101 ALA C 1.0 -83.4 -43.4 PHI 169 169 A 101 ALA N A 101 ALA CA A 101 ALA C A 102 ALA N 1.0 -61.6 -21.6 PSI 170 170 A 101 ALA C A 102 ALA N A 102 ALA CA A 102 ALA C 1.0 -90.0 -50.0 PHI 171 171 A 102 ALA N A 102 ALA CA A 102 ALA C A 103 VAL N 1.0 -57.0 -17.0 PSI 172 172 A 102 ALA C A 103 VAL N A 103 VAL CA A 103 VAL C 1.0 -106.0 -34.0 PHI 173 173 A 103 VAL N A 103 VAL CA A 103 VAL C A 104 ALA N 1.0 -71.0 -3.0 PSI 174 174 A 103 VAL C A 104 ALA N A 104 ALA CA A 104 ALA C 1.0 -80.8 -40.8 PHI 175 175 A 104 ALA N A 104 ALA CA A 104 ALA C A 105 GLN N 1.0 -58.5 -3.9 PSI 176 176 A 120 HIS C A 121 HIS N A 121 HIS CA A 121 HIS C 1.0 -149.1 -24.9 PHI 177 177 A 121 HIS N A 121 HIS CA A 121 HIS C A 122 HIS N 1.0 54.6 187.2 PSI stop_ save_