data_nef_c16818_2k8a 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 49 ALA start . . 2 A 50 ASN middle . . 3 A 51 GLN middle . . 4 A 52 GLN middle . . 5 A 53 THR middle . . 6 A 54 SER middle . . 7 A 55 GLY middle . false 8 A 56 LYS middle . . 9 A 57 VAL middle . . 10 A 58 LEU middle . . 11 A 59 TYR middle . . 12 A 60 GLU middle . . 13 A 61 GLY middle . false 14 A 62 LYS middle . . 15 A 63 GLU middle . . 16 A 64 PHE middle . . 17 A 65 ASP middle . . 18 A 66 TYR middle . . 19 A 67 VAL middle . . 20 A 68 PHE middle . . 21 A 69 SER middle . . 22 A 70 ILE middle . . 23 A 71 ASP middle . . 24 A 72 VAL middle . . 25 A 73 ASN middle . . 26 A 74 GLU middle . . 27 A 75 GLY middle . false 28 A 76 GLY middle . false 29 A 77 PRO middle . false 30 A 78 SER middle . . 31 A 79 TYR middle . . 32 A 80 LYS middle . . 33 A 81 LEU middle . . 34 A 82 PRO middle . false 35 A 83 TYR middle . . 36 A 84 ASN middle . . 37 A 85 THR middle . . 38 A 86 SER middle . . 39 A 87 ASP middle . . 40 A 88 ASP middle . . 41 A 89 PRO middle . false 42 A 90 TRP middle . . 43 A 91 LEU middle . . 44 A 92 THR middle . . 45 A 93 ALA middle . . 46 A 94 TYR middle . . 47 A 95 ASN middle . . 48 A 96 PHE middle . . 49 A 97 LEU middle . . 50 A 98 GLN middle . . 51 A 99 LYS middle . . 52 A 100 ASN middle . . 53 A 101 ASP middle . . 54 A 102 LEU middle . . 55 A 103 ASN middle . . 56 A 104 PRO middle . false 57 A 105 MET middle . . 58 A 106 PHE middle . . 59 A 107 LEU middle . . 60 A 108 ASP middle . . 61 A 109 GLN middle . . 62 A 110 VAL middle . . 63 A 111 ALA middle . . 64 A 112 LYS middle . . 65 A 113 PHE middle . . 66 A 114 ILE middle . . 67 A 115 ILE middle . . 68 A 116 ASP middle . . 69 A 117 ASN middle . . 70 A 118 THR middle . . 71 A 119 LYS middle . . 72 A 120 GLY middle . false 73 A 121 GLN middle . . 74 A 122 MET middle . . 75 A 123 LEU middle . . 76 A 124 GLY middle . false 77 A 125 LEU middle . . 78 A 126 GLY middle . false 79 A 127 ASN middle . . 80 A 128 PRO end . false 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 49 ALA H1 H 1 8.538 0.003 A 49 ALA HA H 1 4.377 0.000 A 49 ALA HB% H 1 1.435 0.000 A 49 ALA CA C 13 52.967 0.000 A 49 ALA CB C 13 19.232 0.152 A 49 ALA N N 15 125.884 0.036 A 50 ASN H H 1 8.381 0.004 A 50 ASN HD2y H 1 7.598 0.003 A 50 ASN HD2x H 1 6.939 0.004 A 50 ASN CA C 13 53.364 0.012 A 50 ASN CB C 13 38.758 0.017 A 50 ASN N N 15 117.439 0.022 A 50 ASN ND2 N 15 112.410 0.040 A 51 GLN H H 1 8.293 0.003 A 51 GLN HA H 1 4.783 0.000 A 51 GLN HBx H 1 2.019 0.000 A 51 GLN HE2y H 1 7.514 0.004 A 51 GLN HE2x H 1 6.862 0.006 A 51 GLN CA C 13 56.091 0.014 A 51 GLN CB C 13 29.499 0.036 A 51 GLN CG C 13 33.846 0.010 A 51 GLN N N 15 120.554 0.047 A 51 GLN NE2 N 15 111.967 0.077 A 52 GLN H H 1 8.481 0.004 A 52 GLN HA H 1 4.372 0.000 A 52 GLN HBx H 1 2.076 0.000 A 52 GLN HGx H 1 2.392 0.000 A 52 GLN CA C 13 56.034 0.000 A 52 GLN CB C 13 29.600 0.000 A 52 GLN CG C 13 33.911 0.000 A 52 GLN N N 15 121.707 0.045 A 53 THR H H 1 8.308 0.002 A 53 THR HA H 1 4.411 0.018 A 53 THR HB H 1 4.235 0.010 A 53 THR HG2% H 1 1.194 0.011 A 53 THR CA C 13 61.854 0.083 A 53 THR CB C 13 69.624 0.050 A 53 THR CG2 C 13 21.390 0.158 A 53 THR N N 15 115.778 0.073 A 54 SER H H 1 8.389 0.003 A 54 SER HA H 1 4.486 0.027 A 54 SER HBx H 1 3.890 0.009 A 54 SER CA C 13 58.349 0.097 A 54 SER CB C 13 64.118 0.124 A 54 SER N N 15 118.175 0.040 A 55 GLY H H 1 8.380 0.004 A 55 GLY HAx H 1 3.945 0.025 A 55 GLY CA C 13 45.118 0.018 A 55 GLY N N 15 110.982 0.030 A 56 LYS H H 1 7.999 0.014 A 56 LYS HA H 1 4.495 0.026 A 56 LYS HBx H 1 1.584 0.025 A 56 LYS HDy H 1 1.535 0.004 A 56 LYS HDx H 1 1.244 0.009 A 56 LYS HEx H 1 2.829 0.006 A 56 LYS HGx H 1 1.260 0.014 A 56 LYS CA C 13 55.285 0.021 A 56 LYS CB C 13 34.261 0.033 A 56 LYS CD C 13 28.817 0.117 A 56 LYS CE C 13 42.249 0.059 A 56 LYS CG C 13 25.084 0.019 A 56 LYS N N 15 119.585 0.024 A 57 VAL H H 1 9.115 0.003 A 57 VAL HA H 1 4.258 0.006 A 57 VAL HB H 1 1.890 0.004 A 57 VAL HGx% H 1 0.939 0.005 A 57 VAL HGy% H 1 0.870 0.008 A 57 VAL CA C 13 61.214 0.082 A 57 VAL CB C 13 34.218 0.050 A 57 VAL CGy C 13 21.960 0.254 A 57 VAL CGx C 13 20.694 0.048 A 57 VAL N N 15 121.215 0.042 A 58 LEU H H 1 8.338 0.002 A 58 LEU HA H 1 5.001 0.010 A 58 LEU HBy H 1 1.606 0.017 A 58 LEU HBx H 1 1.547 0.008 A 58 LEU HDx% H 1 0.767 0.012 A 58 LEU HG H 1 1.533 0.007 A 58 LEU CA C 13 54.265 0.193 A 58 LEU CB C 13 43.557 0.090 A 58 LEU CDx C 13 24.423 0.163 A 58 LEU CG C 13 27.487 0.111 A 58 LEU N N 15 126.530 0.042 A 59 TYR H H 1 9.593 0.013 A 59 TYR HA H 1 4.612 0.006 A 59 TYR HBy H 1 3.025 0.000 A 59 TYR HBx H 1 2.965 0.012 A 59 TYR HDx H 1 7.096 0.012 A 59 TYR HEx H 1 7.580 0.003 A 59 TYR CA C 13 58.685 0.029 A 59 TYR CB C 13 41.357 0.051 A 59 TYR N N 15 125.802 0.031 A 60 GLU H H 1 8.966 0.009 A 60 GLU HA H 1 3.589 0.011 A 60 GLU HBy H 1 2.007 0.007 A 60 GLU HBx H 1 1.734 0.016 A 60 GLU HGy H 1 1.571 0.010 A 60 GLU HGx H 1 1.385 0.009 A 60 GLU CA C 13 56.974 0.073 A 60 GLU CB C 13 27.372 0.117 A 60 GLU CG C 13 36.076 0.037 A 60 GLU N N 15 126.307 0.039 A 61 GLY H H 1 8.392 0.011 A 61 GLY HAy H 1 4.142 0.006 A 61 GLY HAx H 1 3.560 0.005 A 61 GLY CA C 13 45.662 0.109 A 61 GLY N N 15 130.756 0.022 A 62 LYS H H 1 7.945 0.012 A 62 LYS HA H 1 4.574 0.007 A 62 LYS HBy H 1 1.890 0.008 A 62 LYS HBx H 1 1.588 0.007 A 62 LYS HDx H 1 1.735 0.006 A 62 LYS HEx H 1 3.028 0.009 A 62 LYS HGy H 1 1.444 0.014 A 62 LYS HGx H 1 1.290 0.009 A 62 LYS CA C 13 54.455 0.055 A 62 LYS CB C 13 35.811 0.034 A 62 LYS CD C 13 28.988 0.099 A 62 LYS CE C 13 42.202 0.062 A 62 LYS CG C 13 25.092 0.022 A 62 LYS N N 15 122.066 0.035 A 63 GLU H H 1 8.106 0.005 A 63 GLU HA H 1 4.696 0.015 A 63 GLU HBy H 1 1.773 0.007 A 63 GLU HBx H 1 1.565 0.009 A 63 GLU HGy H 1 2.200 0.011 A 63 GLU HGx H 1 1.891 0.008 A 63 GLU CA C 13 55.804 0.058 A 63 GLU CB C 13 31.721 0.069 A 63 GLU CG C 13 37.268 0.089 A 63 GLU N N 15 119.517 0.063 A 64 PHE H H 1 9.173 0.008 A 64 PHE HA H 1 5.421 0.024 A 64 PHE HBy H 1 3.144 0.010 A 64 PHE HBx H 1 2.360 0.007 A 64 PHE HDx H 1 7.112 0.005 A 64 PHE CA C 13 56.494 0.075 A 64 PHE CB C 13 44.156 0.222 A 64 PHE N N 15 122.130 0.031 A 65 ASP H H 1 8.503 0.004 A 65 ASP HA H 1 4.402 0.010 A 65 ASP HBy H 1 3.095 0.006 A 65 ASP HBx H 1 2.554 0.006 A 65 ASP CA C 13 58.131 0.073 A 65 ASP CB C 13 42.883 0.078 A 65 ASP N N 15 120.503 0.020 A 66 TYR H H 1 8.425 0.007 A 66 TYR HA H 1 4.415 0.004 A 66 TYR HBy H 1 2.165 0.007 A 66 TYR HBx H 1 1.737 0.004 A 66 TYR HDx H 1 6.977 0.018 A 66 TYR CA C 13 56.662 0.026 A 66 TYR CB C 13 43.689 0.034 A 66 TYR N N 15 113.399 0.025 A 67 VAL H H 1 8.326 0.003 A 67 VAL HA H 1 3.855 0.007 A 67 VAL HB H 1 1.787 0.016 A 67 VAL HGx% H 1 0.579 0.008 A 67 VAL HGy% H 1 0.352 0.010 A 67 VAL CA C 13 63.074 0.117 A 67 VAL CB C 13 33.165 0.101 A 67 VAL CGx C 13 21.724 0.232 A 67 VAL N N 15 119.177 0.073 A 68 PHE H H 1 8.125 0.011 A 68 PHE HA H 1 4.889 0.006 A 68 PHE HBy H 1 3.242 0.006 A 68 PHE HBx H 1 2.720 0.005 A 68 PHE HDx H 1 7.244 0.008 A 68 PHE CA C 13 56.833 0.058 A 68 PHE CB C 13 41.100 0.062 A 68 PHE N N 15 126.483 0.030 A 69 SER H H 1 8.698 0.004 A 69 SER HA H 1 5.142 0.011 A 69 SER HBx H 1 3.696 0.022 A 69 SER CA C 13 57.492 0.080 A 69 SER CB C 13 63.745 0.087 A 69 SER N N 15 116.843 0.026 A 70 ILE H H 1 9.002 0.010 A 70 ILE HA H 1 4.171 0.006 A 70 ILE HB H 1 0.981 0.017 A 70 ILE HD1% H 1 -0.058 0.011 A 70 ILE HG1y H 1 0.561 0.010 A 70 ILE HG1x H 1 0.405 0.042 A 70 ILE HG2% H 1 0.387 0.012 A 70 ILE CA C 13 58.728 0.034 A 70 ILE CB C 13 41.068 0.029 A 70 ILE CD1 C 13 13.329 0.043 A 70 ILE CG1 C 13 27.673 0.025 A 70 ILE CG2 C 13 16.147 0.077 A 70 ILE N N 15 124.935 0.065 A 71 ASP H H 1 8.131 0.005 A 71 ASP HA H 1 5.115 0.000 A 71 ASP HBy H 1 2.575 0.010 A 71 ASP HBx H 1 2.443 0.012 A 71 ASP CA C 13 52.499 0.000 A 71 ASP CB C 13 41.101 0.005 A 71 ASP N N 15 127.240 0.020 A 72 VAL H H 1 8.235 0.000 A 72 VAL HA H 1 3.855 0.006 A 72 VAL HB H 1 1.645 0.007 A 72 VAL HGx% H 1 0.655 0.003 A 72 VAL HGy% H 1 0.361 0.005 A 72 VAL CA C 13 62.631 0.089 A 72 VAL CB C 13 32.027 0.041 A 72 VAL CGx C 13 20.442 0.155 A 72 VAL N N 15 118.814 0.000 A 73 ASN H H 1 8.096 0.006 A 73 ASN HA H 1 4.720 0.008 A 73 ASN HBy H 1 2.846 0.011 A 73 ASN HBx H 1 2.662 0.007 A 73 ASN CA C 13 52.951 0.084 A 73 ASN CB C 13 39.888 0.019 A 73 ASN N N 15 116.540 0.021 A 74 GLU H H 1 8.639 0.006 A 74 GLU HA H 1 4.223 0.001 A 74 GLU HBx H 1 2.015 0.010 A 74 GLU HGx H 1 2.277 0.003 A 74 GLU CA C 13 57.483 0.055 A 74 GLU CB C 13 29.468 0.000 A 74 GLU CG C 13 36.276 0.059 A 74 GLU N N 15 122.630 0.025 A 75 GLY H H 1 8.893 0.004 A 75 GLY HAy H 1 4.198 0.007 A 75 GLY HAx H 1 3.799 0.006 A 75 GLY CA C 13 45.487 0.037 A 75 GLY N N 15 113.478 0.028 A 76 GLY H H 1 8.143 0.004 A 76 GLY HAy H 1 4.418 0.005 A 76 GLY HAx H 1 3.902 0.006 A 76 GLY CA C 13 44.351 0.015 A 76 GLY N N 15 109.020 0.040 A 77 PRO HA H 1 4.415 0.006 A 77 PRO HBy H 1 2.117 0.009 A 77 PRO HBx H 1 1.605 0.009 A 77 PRO HDx H 1 3.604 0.010 A 77 PRO HDy H 1 3.604 0.010 A 77 PRO HGy H 1 1.931 0.000 A 77 PRO HGx H 1 1.769 0.004 A 77 PRO CA C 13 62.646 0.031 A 77 PRO CB C 13 32.017 0.020 A 77 PRO CD C 13 49.912 0.176 A 77 PRO CG C 13 26.637 0.111 A 78 SER H H 1 7.969 0.002 A 78 SER HA H 1 4.718 0.006 A 78 SER HBy H 1 3.681 0.002 A 78 SER HBx H 1 3.565 0.007 A 78 SER CA C 13 57.786 0.034 A 78 SER CB C 13 64.068 0.153 A 78 SER N N 15 114.529 0.016 A 79 TYR H H 1 8.863 0.002 A 79 TYR HA H 1 4.714 0.001 A 79 TYR HBy H 1 3.141 0.000 A 79 TYR HBx H 1 2.884 0.000 A 79 TYR HDx H 1 7.145 0.000 A 79 TYR HDy H 1 7.145 0.000 A 79 TYR CA C 13 57.400 0.000 A 79 TYR N N 15 122.610 0.022 A 80 LYS H H 1 8.660 0.000 A 80 LYS HA H 1 5.078 0.006 A 80 LYS HBy H 1 1.890 0.007 A 80 LYS HBx H 1 1.050 0.008 A 80 LYS HDy H 1 1.573 0.014 A 80 LYS HDx H 1 1.475 0.002 A 80 LYS HEx H 1 2.947 0.006 A 80 LYS HGx H 1 1.450 0.016 A 80 LYS CA C 13 54.270 0.108 A 80 LYS CB C 13 33.402 0.043 A 80 LYS CD C 13 28.666 0.040 A 80 LYS CE C 13 42.497 0.095 A 80 LYS CG C 13 24.822 0.097 A 80 LYS N N 15 119.781 0.000 A 81 LEU H H 1 8.769 0.008 A 81 LEU HA H 1 4.650 0.006 A 81 LEU HBy H 1 1.511 0.008 A 81 LEU HBx H 1 0.522 0.013 A 81 LEU HDx% H 1 0.300 0.011 A 81 LEU HDy% H 1 0.131 0.008 A 81 LEU HG H 1 1.248 0.009 A 81 LEU CA C 13 51.307 0.152 A 81 LEU CB C 13 44.684 0.108 A 81 LEU CDx C 13 23.996 0.154 A 81 LEU CG C 13 27.551 0.175 A 81 LEU N N 15 124.156 0.026 A 82 PRO HA H 1 4.613 0.010 A 82 PRO HBy H 1 0.402 0.014 A 82 PRO HBx H 1 -0.026 0.009 A 82 PRO HDy H 1 3.626 0.009 A 82 PRO HDx H 1 2.956 0.008 A 82 PRO HGy H 1 1.604 0.013 A 82 PRO HGx H 1 1.131 0.009 A 82 PRO CA C 13 61.417 0.036 A 82 PRO CB C 13 29.921 0.084 A 82 PRO CD C 13 50.477 0.167 A 82 PRO CG C 13 27.076 0.127 A 83 TYR H H 1 8.923 0.008 A 83 TYR HA H 1 4.904 0.006 A 83 TYR HBy H 1 2.989 0.004 A 83 TYR HBx H 1 2.450 0.014 A 83 TYR HDx H 1 7.126 0.020 A 83 TYR HDy H 1 7.141 0.000 A 83 TYR HEx H 1 7.139 0.005 A 83 TYR CA C 13 58.527 0.053 A 83 TYR CB C 13 43.215 0.045 A 83 TYR N N 15 122.405 0.032 A 84 ASN H H 1 7.566 0.007 A 84 ASN HA H 1 5.623 0.356 A 84 ASN HBx H 1 2.631 0.013 A 84 ASN HD2y H 1 7.893 0.004 A 84 ASN HD2x H 1 6.581 0.013 A 84 ASN CA C 13 51.246 0.039 A 84 ASN CB C 13 40.289 0.245 A 84 ASN N N 15 125.954 0.021 A 84 ASN ND2 N 15 114.127 0.286 A 85 THR H H 1 9.755 0.013 A 85 THR HA H 1 4.032 0.006 A 85 THR HB H 1 4.421 0.008 A 85 THR HG2% H 1 1.593 0.008 A 85 THR CA C 13 65.175 0.057 A 85 THR CB C 13 68.929 0.086 A 85 THR CG2 C 13 22.576 0.023 A 85 THR N N 15 113.910 0.018 A 86 SER H H 1 7.737 0.011 A 86 SER HA H 1 4.283 0.007 A 86 SER HBy H 1 4.068 0.012 A 86 SER HBx H 1 3.831 0.010 A 86 SER CA C 13 59.097 0.141 A 86 SER CB C 13 63.313 0.106 A 86 SER N N 15 112.951 0.040 A 87 ASP H H 1 8.145 0.004 A 87 ASP HA H 1 4.819 0.014 A 87 ASP HBy H 1 3.100 0.007 A 87 ASP HBx H 1 2.613 0.011 A 87 ASP CA C 13 53.744 0.106 A 87 ASP CB C 13 41.269 0.061 A 87 ASP N N 15 123.340 0.033 A 88 ASP H H 1 9.261 0.011 A 88 ASP HA H 1 5.111 0.006 A 88 ASP HBx H 1 3.018 0.006 A 88 ASP CA C 13 52.318 0.138 A 88 ASP N N 15 125.332 0.018 A 89 PRO HA H 1 4.122 0.008 A 89 PRO HBy H 1 1.988 0.014 A 89 PRO HBx H 1 1.448 0.008 A 89 PRO HDy H 1 4.380 0.002 A 89 PRO HDx H 1 4.269 0.009 A 89 PRO HGx H 1 2.016 0.007 A 89 PRO CA C 13 66.049 0.043 A 89 PRO CB C 13 32.354 0.064 A 89 PRO CD C 13 51.782 0.054 A 89 PRO CG C 13 27.367 0.077 A 90 TRP H H 1 8.157 0.009 A 90 TRP HA H 1 4.054 0.017 A 90 TRP HBy H 1 3.567 0.012 A 90 TRP HBx H 1 3.329 0.011 A 90 TRP HE1 H 1 10.263 0.000 A 90 TRP HH2 H 1 6.572 0.000 A 90 TRP CA C 13 56.130 0.000 A 90 TRP CB C 13 27.802 0.121 A 90 TRP N N 15 119.713 0.040 A 90 TRP NE1 N 15 129.461 0.000 A 91 LEU H H 1 8.318 0.008 A 91 LEU HA H 1 4.388 0.011 A 91 LEU HBx H 1 1.949 0.012 A 91 LEU HDy% H 1 1.060 0.017 A 91 LEU HG H 1 1.870 0.012 A 91 LEU CA C 13 57.878 0.036 A 91 LEU CB C 13 42.097 0.095 A 91 LEU CDx C 13 24.453 0.109 A 91 LEU CG C 13 27.198 0.035 A 91 LEU N N 15 122.681 0.033 A 92 THR H H 1 8.301 0.007 A 92 THR HA H 1 4.114 0.011 A 92 THR HB H 1 4.283 0.006 A 92 THR HG2% H 1 1.512 0.014 A 92 THR CA C 13 67.582 0.039 A 92 THR CB C 13 68.663 0.096 A 92 THR CG2 C 13 22.199 0.045 A 92 THR N N 15 115.061 0.023 A 93 ALA H H 1 8.273 0.004 A 93 ALA HA H 1 3.871 0.005 A 93 ALA HB% H 1 1.467 0.006 A 93 ALA CA C 13 56.118 0.035 A 93 ALA CB C 13 19.449 0.091 A 93 ALA N N 15 124.590 0.026 A 94 TYR H H 1 8.458 0.008 A 94 TYR HA H 1 4.011 0.009 A 94 TYR HBx H 1 3.299 0.005 A 94 TYR HDx H 1 7.197 0.016 A 94 TYR CA C 13 62.454 0.059 A 94 TYR CB C 13 38.764 0.081 A 94 TYR N N 15 119.405 0.031 A 95 ASN H H 1 8.584 0.004 A 95 ASN HA H 1 4.448 0.008 A 95 ASN HBy H 1 3.086 0.010 A 95 ASN HBx H 1 2.936 0.010 A 95 ASN HD2y H 1 7.771 0.013 A 95 ASN HD2x H 1 6.993 0.016 A 95 ASN CA C 13 56.137 0.050 A 95 ASN CB C 13 38.282 0.188 A 95 ASN N N 15 118.073 0.020 A 95 ASN ND2 N 15 111.025 0.069 A 96 PHE H H 1 8.382 0.007 A 96 PHE HA H 1 4.357 0.009 A 96 PHE HBx H 1 3.282 0.012 A 96 PHE HDx H 1 7.133 0.004 A 96 PHE CA C 13 60.698 0.047 A 96 PHE CB C 13 38.944 0.057 A 96 PHE N N 15 122.951 0.052 A 97 LEU H H 1 8.226 0.005 A 97 LEU HA H 1 3.509 0.009 A 97 LEU HBy H 1 1.938 0.009 A 97 LEU HBx H 1 1.238 0.010 A 97 LEU HDx% H 1 0.902 0.017 A 97 LEU HG H 1 2.255 0.008 A 97 LEU CA C 13 58.082 0.040 A 97 LEU CB C 13 40.190 0.054 A 97 LEU CDx C 13 24.584 0.148 A 97 LEU CG C 13 26.772 0.198 A 97 LEU N N 15 121.549 0.035 A 98 GLN H H 1 7.707 0.017 A 98 GLN HA H 1 4.000 0.006 A 98 GLN HBx H 1 1.773 0.010 A 98 GLN HE2y H 1 7.213 0.003 A 98 GLN HE2x H 1 6.758 0.004 A 98 GLN HGy H 1 2.234 0.008 A 98 GLN HGx H 1 2.060 0.010 A 98 GLN CA C 13 58.752 0.052 A 98 GLN CB C 13 28.949 0.069 A 98 GLN CG C 13 33.880 0.037 A 98 GLN N N 15 117.005 0.030 A 98 GLN NE2 N 15 111.599 0.255 A 99 LYS H H 1 8.348 0.010 A 99 LYS HA H 1 4.003 0.007 A 99 LYS HBy H 1 2.014 0.011 A 99 LYS HBx H 1 1.779 0.006 A 99 LYS HDx H 1 1.760 0.009 A 99 LYS HEx H 1 3.092 0.012 A 99 LYS HGx H 1 1.465 0.012 A 99 LYS CA C 13 58.574 0.134 A 99 LYS CB C 13 32.470 0.070 A 99 LYS CD C 13 29.237 0.000 A 99 LYS CE C 13 42.285 0.036 A 99 LYS CG C 13 24.598 0.233 A 99 LYS N N 15 119.804 0.108 A 100 ASN H H 1 6.802 0.012 A 100 ASN HA H 1 4.642 0.008 A 100 ASN HBy H 1 2.343 0.010 A 100 ASN HBx H 1 1.539 0.009 A 100 ASN HD2y H 1 7.652 0.004 A 100 ASN HD2x H 1 6.698 0.058 A 100 ASN CA C 13 53.196 0.112 A 100 ASN CB C 13 40.222 0.166 A 100 ASN N N 15 112.227 0.034 A 100 ASN ND2 N 15 112.448 0.052 A 101 ASP H H 1 7.614 0.007 A 101 ASP HA H 1 4.288 0.008 A 101 ASP HBy H 1 3.034 0.007 A 101 ASP HBx H 1 2.470 0.007 A 101 ASP CA C 13 55.252 0.116 A 101 ASP CB C 13 39.464 0.173 A 101 ASP N N 15 119.118 0.025 A 102 LEU H H 1 8.116 0.003 A 102 LEU HA H 1 4.552 0.006 A 102 LEU HBy H 1 1.482 0.010 A 102 LEU HBx H 1 1.204 0.008 A 102 LEU HDx% H 1 0.684 0.006 A 102 LEU HDy% H 1 -0.069 0.007 A 102 LEU HG H 1 1.041 0.008 A 102 LEU CA C 13 52.842 0.056 A 102 LEU CB C 13 46.258 0.094 A 102 LEU CDx C 13 22.302 0.165 A 102 LEU CG C 13 26.120 0.163 A 102 LEU N N 15 117.421 0.019 A 103 ASN H H 1 8.083 0.004 A 103 ASN HA H 1 4.526 0.009 A 103 ASN HBy H 1 2.672 0.009 A 103 ASN HBx H 1 2.235 0.010 A 103 ASN HD2y H 1 7.620 0.001 A 103 ASN HD2x H 1 6.922 0.006 A 103 ASN CA C 13 51.843 0.045 A 103 ASN CB C 13 39.410 0.161 A 103 ASN N N 15 120.393 0.062 A 103 ASN ND2 N 15 113.846 0.121 A 104 PRO HA H 1 4.286 0.006 A 104 PRO HBy H 1 2.426 0.008 A 104 PRO HBx H 1 2.002 0.007 A 104 PRO HDy H 1 3.891 0.012 A 104 PRO HDx H 1 3.735 0.006 A 104 PRO HGx H 1 2.018 0.006 A 104 PRO CA C 13 64.768 0.053 A 104 PRO CB C 13 32.267 0.068 A 104 PRO CD C 13 51.526 0.036 A 104 PRO CG C 13 27.230 0.139 A 105 MET H H 1 8.627 0.010 A 105 MET HA H 1 4.297 0.011 A 105 MET HBy H 1 2.208 0.010 A 105 MET HBx H 1 1.883 0.011 A 105 MET HGx H 1 2.145 0.011 A 105 MET CA C 13 57.119 0.001 A 105 MET CB C 13 31.509 0.068 A 105 MET N N 15 116.865 0.044 A 106 PHE H H 1 7.781 0.009 A 106 PHE HA H 1 4.820 0.007 A 106 PHE HBy H 1 3.419 0.007 A 106 PHE HBx H 1 3.002 0.011 A 106 PHE HDx H 1 7.349 0.027 A 106 PHE CA C 13 57.848 0.071 A 106 PHE CB C 13 38.429 0.013 A 106 PHE N N 15 118.309 0.028 A 107 LEU H H 1 7.546 0.017 A 107 LEU HA H 1 3.753 0.007 A 107 LEU HBy H 1 2.042 0.018 A 107 LEU HBx H 1 1.967 0.001 A 107 LEU HDx% H 1 1.275 0.015 A 107 LEU HDy% H 1 1.250 0.002 A 107 LEU HG H 1 1.874 0.008 A 107 LEU CA C 13 60.665 0.035 A 107 LEU CB C 13 42.312 0.079 A 107 LEU CDy C 13 26.079 0.041 A 107 LEU CDx C 13 25.047 0.104 A 107 LEU CG C 13 27.460 0.015 A 107 LEU N N 15 122.095 0.023 A 108 ASP H H 1 8.614 0.011 A 108 ASP HA H 1 4.424 0.006 A 108 ASP HBy H 1 2.827 0.017 A 108 ASP HBx H 1 2.764 0.001 A 108 ASP CA C 13 57.985 0.023 A 108 ASP CB C 13 40.583 0.068 A 108 ASP N N 15 116.669 0.078 A 109 GLN H H 1 8.243 0.012 A 109 GLN HA H 1 4.035 0.014 A 109 GLN HBx H 1 2.052 0.011 A 109 GLN HE2y H 1 7.695 0.001 A 109 GLN HE2x H 1 6.895 0.008 A 109 GLN HGx H 1 2.404 0.008 A 109 GLN CA C 13 58.916 0.031 A 109 GLN CB C 13 28.873 0.008 A 109 GLN CG C 13 33.739 0.059 A 109 GLN N N 15 118.615 0.074 A 109 GLN NE2 N 15 111.139 0.044 A 110 VAL H H 1 8.106 0.009 A 110 VAL HA H 1 3.380 0.008 A 110 VAL HB H 1 1.975 0.008 A 110 VAL HGx% H 1 0.949 0.008 A 110 VAL HGy% H 1 0.554 0.008 A 110 VAL CA C 13 66.529 0.036 A 110 VAL CB C 13 31.554 0.083 A 110 VAL CGy C 13 22.986 0.136 A 110 VAL CGx C 13 21.857 0.170 A 110 VAL N N 15 121.096 0.050 A 111 ALA H H 1 8.406 0.011 A 111 ALA HA H 1 3.333 0.008 A 111 ALA HB% H 1 0.111 0.025 A 111 ALA CA C 13 55.698 0.090 A 111 ALA CB C 13 16.235 0.108 A 111 ALA N N 15 122.590 0.066 A 112 LYS H H 1 7.906 0.011 A 112 LYS HA H 1 3.673 0.006 A 112 LYS HBy H 1 1.807 0.004 A 112 LYS HDx H 1 1.675 0.010 A 112 LYS HEx H 1 3.050 0.009 A 112 LYS HGy H 1 1.445 0.039 A 112 LYS HGx H 1 1.360 0.012 A 112 LYS CA C 13 59.213 0.072 A 112 LYS CB C 13 32.097 0.020 A 112 LYS CD C 13 28.981 0.196 A 112 LYS CE C 13 42.303 0.035 A 112 LYS CG C 13 25.690 0.028 A 112 LYS N N 15 115.149 0.031 A 113 PHE H H 1 7.515 0.014 A 113 PHE HA H 1 3.969 0.006 A 113 PHE HBy H 1 3.167 0.009 A 113 PHE HBx H 1 2.960 0.007 A 113 PHE HDx H 1 6.559 0.145 A 113 PHE CA C 13 61.497 0.045 A 113 PHE CB C 13 38.568 0.027 A 113 PHE N N 15 120.089 0.027 A 114 ILE H H 1 7.633 0.104 A 114 ILE HA H 1 2.564 0.008 A 114 ILE HB H 1 1.586 0.010 A 114 ILE HD1% H 1 0.541 0.008 A 114 ILE HG1y H 1 1.650 0.023 A 114 ILE HG1x H 1 0.254 0.011 A 114 ILE HG2% H 1 -0.194 0.007 A 114 ILE CA C 13 65.812 0.028 A 114 ILE CB C 13 37.925 0.027 A 114 ILE CD1 C 13 14.440 0.089 A 114 ILE CG1 C 13 28.320 0.124 A 114 ILE CG2 C 13 16.010 0.098 A 114 ILE N N 15 120.188 0.044 A 115 ILE H H 1 7.923 0.012 A 115 ILE HA H 1 3.253 0.007 A 115 ILE HB H 1 1.665 0.009 A 115 ILE HD1% H 1 0.691 0.011 A 115 ILE HG1y H 1 1.433 0.008 A 115 ILE HG1x H 1 0.935 0.008 A 115 ILE HG2% H 1 0.884 0.017 A 115 ILE CA C 13 65.761 0.021 A 115 ILE CB C 13 38.589 0.030 A 115 ILE CD1 C 13 13.381 0.055 A 115 ILE CG1 C 13 29.703 0.098 A 115 ILE CG2 C 13 17.042 0.103 A 115 ILE N N 15 121.800 0.048 A 116 ASP H H 1 8.746 0.011 A 116 ASP HA H 1 4.251 0.007 A 116 ASP HBy H 1 2.452 0.013 A 116 ASP HBx H 1 2.364 0.020 A 116 ASP CA C 13 56.864 0.080 A 116 ASP CB C 13 40.169 0.052 A 116 ASP N N 15 119.021 0.025 A 117 ASN H H 1 7.235 0.011 A 117 ASN HA H 1 4.429 0.011 A 117 ASN HBx H 1 4.212 0.000 A 117 ASN HBy H 1 4.212 0.000 A 117 ASN HD2y H 1 7.614 0.009 A 117 ASN HD2x H 1 6.913 0.012 A 117 ASN CA C 13 54.915 0.042 A 117 ASN CB C 13 39.630 0.058 A 117 ASN N N 15 114.819 0.039 A 117 ASN ND2 N 15 113.410 0.108 A 118 THR H H 1 7.309 0.011 A 118 THR HA H 1 4.380 0.006 A 118 THR HB H 1 4.388 0.005 A 118 THR HG2% H 1 0.932 0.006 A 118 THR CA C 13 61.947 0.045 A 118 THR CB C 13 69.990 0.054 A 118 THR CG2 C 13 21.955 0.131 A 118 THR N N 15 109.240 0.040 A 119 LYS H H 1 7.819 0.010 A 119 LYS HA H 1 4.357 0.010 A 119 LYS HBx H 1 1.924 0.007 A 119 LYS HDx H 1 1.728 0.008 A 119 LYS HEx H 1 3.030 0.007 A 119 LYS HGx H 1 1.522 0.010 A 119 LYS CA C 13 57.224 0.078 A 119 LYS CB C 13 32.630 0.055 A 119 LYS CD C 13 29.057 0.199 A 119 LYS CE C 13 42.231 0.113 A 119 LYS CG C 13 24.370 0.066 A 119 LYS N N 15 122.175 0.046 A 120 GLY H H 1 8.416 0.005 A 120 GLY HAy H 1 4.793 0.007 A 120 GLY HAx H 1 3.984 0.000 A 120 GLY CA C 13 45.672 0.000 A 120 GLY N N 15 108.907 0.079 A 121 GLN H H 1 8.150 0.004 A 121 GLN HA H 1 4.388 0.015 A 121 GLN HBy H 1 2.172 0.007 A 121 GLN HBx H 1 2.044 0.013 A 121 GLN HE2y H 1 7.551 0.005 A 121 GLN HE2x H 1 6.872 0.003 A 121 GLN HGx H 1 2.392 0.010 A 121 GLN CA C 13 55.927 0.120 A 121 GLN CB C 13 29.378 0.148 A 121 GLN CG C 13 33.850 0.043 A 121 GLN N N 15 119.366 0.051 A 121 GLN NE2 N 15 111.962 0.038 A 122 MET H H 1 8.384 0.002 A 122 MET HA H 1 4.531 0.005 A 122 MET HBy H 1 2.117 0.010 A 122 MET HBx H 1 2.071 0.000 A 122 MET HGx H 1 2.591 0.013 A 122 MET HGy H 1 2.655 0.003 A 122 MET CA C 13 55.686 0.054 A 122 MET CB C 13 32.337 0.041 A 122 MET N N 15 120.993 0.037 A 123 LEU H H 1 8.254 0.000 A 123 LEU HA H 1 4.477 0.017 A 123 LEU HBx H 1 1.670 0.000 A 123 LEU HDx% H 1 0.936 0.011 A 123 LEU HG H 1 1.681 0.003 A 123 LEU CA C 13 55.485 0.000 A 123 LEU CB C 13 42.409 0.000 A 123 LEU CDy C 13 25.040 0.040 A 123 LEU CDx C 13 23.340 0.001 A 123 LEU CG C 13 27.141 0.001 A 123 LEU N N 15 123.238 0.044 A 124 GLY H H 1 8.390 0.003 A 124 GLY HAy H 1 4.795 0.000 A 124 GLY HAx H 1 4.454 0.000 A 124 GLY CA C 13 45.508 0.000 A 124 GLY N N 15 109.521 0.109 A 125 LEU H H 1 8.088 0.001 A 125 LEU HA H 1 4.407 0.008 A 125 LEU HBx H 1 1.660 0.013 A 125 LEU HDx% H 1 0.929 0.018 A 125 LEU HG H 1 1.666 0.004 A 125 LEU CA C 13 55.240 0.000 A 125 LEU CB C 13 42.549 0.144 A 125 LEU CDy C 13 24.994 0.071 A 125 LEU CDx C 13 23.088 0.120 A 125 LEU CG C 13 26.866 0.108 A 125 LEU N N 15 121.129 0.009 A 126 GLY H H 1 8.421 0.003 A 126 GLY HAx H 1 4.081 0.204 A 126 GLY CA C 13 45.324 0.000 A 126 GLY N N 15 109.036 0.064 A 127 ASN H H 1 7.888 0.002 A 127 ASN HA H 1 4.764 0.033 A 127 ASN HBx H 1 2.654 0.022 A 127 ASN HD2y H 1 7.537 0.000 A 127 ASN HD2x H 1 6.842 0.000 A 127 ASN CA C 13 51.238 0.000 A 127 ASN CB C 13 40.477 0.012 A 127 ASN N N 15 118.305 0.020 A 127 ASN ND2 N 15 112.326 0.097 stop_ save_ save_CNS/XPLOR_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_2 _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 55 GLY C A 56 LYS N A 56 LYS CA A 56 LYS C 1.0 -131.00 -91.00 PHI 2 2 A 56 LYS N A 56 LYS CA A 56 LYS C A 57 VAL N 1.0 123.00 163.00 PSI 3 3 A 56 LYS C A 57 VAL N A 57 VAL CA A 57 VAL C 1.0 -134.00 -94.00 PHI 4 4 A 57 VAL N A 57 VAL CA A 57 VAL C A 58 LEU N 1.0 115.00 145.00 PSI 5 5 A 57 VAL C A 58 LEU N A 58 LEU CA A 58 LEU C 1.0 -113.00 -83.00 PHI 6 6 A 58 LEU N A 58 LEU CA A 58 LEU C A 59 TYR N 1.0 111.00 141.00 PSI 7 7 A 58 LEU C A 59 TYR N A 59 TYR CA A 59 TYR C 1.0 -148.00 -118.00 PHI 8 8 A 59 TYR N A 59 TYR CA A 59 TYR C A 60 GLU N 1.0 113.00 143.00 PSI 9 9 A 62 LYS N A 62 LYS CA A 62 LYS C A 63 GLU N 1.0 151.00 181.00 PSI 10 10 A 62 LYS C A 63 GLU N A 63 GLU CA A 63 GLU C 1.0 -121.00 -91.00 PHI 11 11 A 63 GLU N A 63 GLU CA A 63 GLU C A 64 PHE N 1.0 121.00 151.00 PSI 12 12 A 63 GLU C A 64 PHE N A 64 PHE CA A 64 PHE C 1.0 -139.00 -109.00 PHI 13 13 A 64 PHE N A 64 PHE CA A 64 PHE C A 65 ASP N 1.0 131.00 171.00 PSI 14 14 A 64 PHE C A 65 ASP N A 65 ASP CA A 65 ASP C 1.0 -82.00 -42.00 PHI 15 15 A 65 ASP N A 65 ASP CA A 65 ASP C A 66 TYR N 1.0 -72.00 -32.00 PSI 16 16 A 66 TYR C A 67 VAL N A 67 VAL CA A 67 VAL C 1.0 -114.00 -74.00 PHI 17 17 A 67 VAL N A 67 VAL CA A 67 VAL C A 68 PHE N 1.0 116.00 146.00 PSI 18 18 A 67 VAL C A 68 PHE N A 68 PHE CA A 68 PHE C 1.0 -132.00 -92.00 PHI 19 19 A 68 PHE N A 68 PHE CA A 68 PHE C A 69 SER N 1.0 131.00 151.00 PSI 20 20 A 68 PHE C A 69 SER N A 69 SER CA A 69 SER C 1.0 -107.00 -87.00 PHI 21 21 A 69 SER N A 69 SER CA A 69 SER C A 70 ILE N 1.0 118.00 148.00 PSI 22 22 A 69 SER C A 70 ILE N A 70 ILE CA A 70 ILE C 1.0 -135.00 -95.00 PHI 23 23 A 70 ILE N A 70 ILE CA A 70 ILE C A 71 ASP N 1.0 121.00 151.00 PSI 24 24 A 70 ILE C A 71 ASP N A 71 ASP CA A 71 ASP C 1.0 -109.00 -79.00 PHI 25 25 A 71 ASP N A 71 ASP CA A 71 ASP C A 72 VAL N 1.0 116.00 146.00 PSI 26 26 A 72 VAL C A 73 ASN N A 73 ASN CA A 73 ASN C 1.0 -114.00 -64.00 PHI 27 27 A 73 ASN N A 73 ASN CA A 73 ASN C A 74 GLU N 1.0 110.00 166.00 PSI 28 28 A 73 ASN C A 74 GLU N A 74 GLU CA A 74 GLU C 1.0 -97.00 -47.00 PHI 29 29 A 74 GLU N A 74 GLU CA A 74 GLU C A 75 GLY N 1.0 107.00 149.00 PSI 30 30 A 76 GLY N A 76 GLY CA A 76 GLY C A 77 PRO N 1.0 162.00 192.00 PSI 31 31 A 76 GLY C A 77 PRO N A 77 PRO CA A 77 PRO C 1.0 -78.00 -48.00 PHI 32 32 A 77 PRO N A 77 PRO CA A 77 PRO C A 78 SER N 1.0 134.00 164.00 PSI 33 33 A 77 PRO C A 78 SER N A 78 SER CA A 78 SER C 1.0 -124.65 -75.43 PHI 34 34 A 78 SER N A 78 SER CA A 78 SER C A 79 TYR N 1.0 103.31 153.93 PSI 35 35 A 78 SER C A 79 TYR N A 79 TYR CA A 79 TYR C 1.0 -134.00 -94.00 PHI 36 36 A 79 TYR N A 79 TYR CA A 79 TYR C A 80 LYS N 1.0 123.00 163.00 PSI 37 37 A 79 TYR C A 80 LYS N A 80 LYS CA A 80 LYS C 1.0 -131.26 -90.96 PHI 38 38 A 80 LYS N A 80 LYS CA A 80 LYS C A 81 LEU N 1.0 120.39 152.07 PSI 39 39 A 80 LYS C A 81 LEU N A 81 LEU CA A 81 LEU C 1.0 -134.00 -104.00 PHI 40 40 A 81 LEU N A 81 LEU CA A 81 LEU C A 82 PRO N 1.0 91.00 121.00 PSI 41 41 A 81 LEU C A 82 PRO N A 82 PRO CA A 82 PRO C 1.0 -99.70 -59.70 PHI 42 42 A 82 PRO N A 82 PRO CA A 82 PRO C A 83 TYR N 1.0 112.24 152.24 PSI 43 43 A 82 PRO C A 83 TYR N A 83 TYR CA A 83 TYR C 1.0 -135.00 -95.00 PHI 44 44 A 83 TYR N A 83 TYR CA A 83 TYR C A 84 ASN N 1.0 116.00 156.00 PSI 45 45 A 83 TYR C A 84 ASN N A 84 ASN CA A 84 ASN C 1.0 -136.00 -96.00 PHI 46 46 A 84 ASN N A 84 ASN CA A 84 ASN C A 85 THR N 1.0 111.00 151.00 PSI 47 47 A 84 ASN C A 85 THR N A 85 THR CA A 85 THR C 1.0 -78.00 -48.00 PHI 48 48 A 85 THR N A 85 THR CA A 85 THR C A 86 SER N 1.0 -38.00 -8.00 PSI 49 49 A 85 THR C A 86 SER N A 86 SER CA A 86 SER C 1.0 -105.00 -65.00 PHI 50 50 A 86 SER N A 86 SER CA A 86 SER C A 87 ASP N 1.0 -29.00 11.00 PSI 51 51 A 86 SER C A 87 ASP N A 87 ASP CA A 87 ASP C 1.0 -110.00 -70.00 PHI 52 52 A 87 ASP N A 87 ASP CA A 87 ASP C A 88 ASP N 1.0 124.00 154.00 PSI 53 53 A 87 ASP C A 88 ASP N A 88 ASP CA A 88 ASP C 1.0 -115.00 -75.00 PHI 54 54 A 88 ASP N A 88 ASP CA A 88 ASP C A 89 PRO N 1.0 129.00 169.00 PSI 55 55 A 88 ASP C A 89 PRO N A 89 PRO CA A 89 PRO C 1.0 -73.00 -43.00 PHI 56 56 A 89 PRO N A 89 PRO CA A 89 PRO C A 90 TRP N 1.0 -61.00 -31.00 PSI 57 57 A 89 PRO C A 90 TRP N A 90 TRP CA A 90 TRP C 1.0 -77.56 -47.56 PHI 58 58 A 90 TRP N A 90 TRP CA A 90 TRP C A 91 LEU N 1.0 -56.01 -26.01 PSI 59 59 A 90 TRP C A 91 LEU N A 91 LEU CA A 91 LEU C 1.0 -78.00 -48.00 PHI 60 60 A 91 LEU N A 91 LEU CA A 91 LEU C A 92 THR N 1.0 -55.00 -25.00 PSI 61 61 A 91 LEU C A 92 THR N A 92 THR CA A 92 THR C 1.0 -82.00 -52.00 PHI 62 62 A 92 THR N A 92 THR CA A 92 THR C A 93 ALA N 1.0 -56.00 -26.00 PSI 63 63 A 92 THR C A 93 ALA N A 93 ALA CA A 93 ALA C 1.0 -80.00 -50.00 PHI 64 64 A 93 ALA N A 93 ALA CA A 93 ALA C A 94 TYR N 1.0 -58.00 -28.00 PSI 65 65 A 93 ALA C A 94 TYR N A 94 TYR CA A 94 TYR C 1.0 -79.00 -49.00 PHI 66 66 A 94 TYR N A 94 TYR CA A 94 TYR C A 95 ASN N 1.0 -54.00 -24.00 PSI 67 67 A 94 TYR C A 95 ASN N A 95 ASN CA A 95 ASN C 1.0 -81.00 -51.00 PHI 68 68 A 95 ASN N A 95 ASN CA A 95 ASN C A 96 PHE N 1.0 -52.00 -22.00 PSI 69 69 A 95 ASN C A 96 PHE N A 96 PHE CA A 96 PHE C 1.0 -82.00 -52.00 PHI 70 70 A 96 PHE N A 96 PHE CA A 96 PHE C A 97 LEU N 1.0 -58.00 -28.00 PSI 71 71 A 96 PHE C A 97 LEU N A 97 LEU CA A 97 LEU C 1.0 -78.00 -48.00 PHI 72 72 A 97 LEU N A 97 LEU CA A 97 LEU C A 98 GLN N 1.0 -55.00 -25.00 PSI 73 73 A 97 LEU C A 98 GLN N A 98 GLN CA A 98 GLN C 1.0 -79.00 -49.00 PHI 74 74 A 98 GLN N A 98 GLN CA A 98 GLN C A 99 LYS N 1.0 -56.00 -26.00 PSI 75 75 A 98 GLN C A 99 LYS N A 99 LYS CA A 99 LYS C 1.0 -85.00 -55.00 PHI 76 76 A 99 LYS N A 99 LYS CA A 99 LYS C A 100 ASN N 1.0 -42.00 -12.00 PSI 77 77 A 99 LYS C A 100 ASN N A 100 ASN CA A 100 ASN C 1.0 -111.00 -81.00 PHI 78 78 A 100 ASN N A 100 ASN CA A 100 ASN C A 101 ASP N 1.0 -16.00 14.00 PSI 79 79 A 101 ASP C A 102 LEU N A 102 LEU CA A 102 LEU C 1.0 -140.00 -100.00 PHI 80 80 A 102 LEU N A 102 LEU CA A 102 LEU C A 103 ASN N 1.0 145.00 175.00 PSI 81 81 A 102 LEU C A 103 ASN N A 103 ASN CA A 103 ASN C 1.0 -106.16 -66.16 PHI 82 82 A 103 ASN N A 103 ASN CA A 103 ASN C A 104 PRO N 1.0 110.42 150.42 PSI 83 83 A 103 ASN C A 104 PRO N A 104 PRO CA A 104 PRO C 1.0 -71.95 -41.95 PHI 84 84 A 104 PRO N A 104 PRO CA A 104 PRO C A 105 MET N 1.0 -46.79 -16.79 PSI 85 85 A 104 PRO C A 105 MET N A 105 MET CA A 105 MET C 1.0 -82.51 -52.51 PHI 86 86 A 105 MET N A 105 MET CA A 105 MET C A 106 PHE N 1.0 -43.54 -3.54 PSI 87 87 A 105 MET C A 106 PHE N A 106 PHE CA A 106 PHE C 1.0 -114.05 -74.05 PHI 88 88 A 106 PHE N A 106 PHE CA A 106 PHE C A 107 LEU N 1.0 -21.78 18.22 PSI 89 89 A 106 PHE C A 107 LEU N A 107 LEU CA A 107 LEU C 1.0 -74.27 -44.27 PHI 90 90 A 107 LEU N A 107 LEU CA A 107 LEU C A 108 ASP N 1.0 -62.60 -32.60 PSI 91 91 A 107 LEU C A 108 ASP N A 108 ASP CA A 108 ASP C 1.0 -74.66 -44.66 PHI 92 92 A 108 ASP N A 108 ASP CA A 108 ASP C A 109 GLN N 1.0 -55.76 -25.76 PSI 93 93 A 108 ASP C A 109 GLN N A 109 GLN CA A 109 GLN C 1.0 -81.30 -51.30 PHI 94 94 A 109 GLN N A 109 GLN CA A 109 GLN C A 110 VAL N 1.0 -53.48 -23.48 PSI 95 95 A 109 GLN C A 110 VAL N A 110 VAL CA A 110 VAL C 1.0 -79.88 -49.88 PHI 96 96 A 110 VAL N A 110 VAL CA A 110 VAL C A 111 ALA N 1.0 -57.28 -27.28 PSI 97 97 A 110 VAL C A 111 ALA N A 111 ALA CA A 111 ALA C 1.0 -79.66 -49.66 PHI 98 98 A 111 ALA N A 111 ALA CA A 111 ALA C A 112 LYS N 1.0 -58.84 -28.84 PSI 99 99 A 111 ALA C A 112 LYS N A 112 LYS CA A 112 LYS C 1.0 -79.55 -49.55 PHI 100 100 A 112 LYS N A 112 LYS CA A 112 LYS C A 113 PHE N 1.0 -54.56 -24.56 PSI 101 101 A 112 LYS C A 113 PHE N A 113 PHE CA A 113 PHE C 1.0 -79.71 -49.71 PHI 102 102 A 113 PHE N A 113 PHE CA A 113 PHE C A 114 ILE N 1.0 -59.73 -29.73 PSI 103 103 A 113 PHE C A 114 ILE N A 114 ILE CA A 114 ILE C 1.0 -77.91 -47.91 PHI 104 104 A 114 ILE N A 114 ILE CA A 114 ILE C A 115 ILE N 1.0 -59.51 -29.51 PSI 105 105 A 114 ILE C A 115 ILE N A 115 ILE CA A 115 ILE C 1.0 -78.23 -48.23 PHI 106 106 A 115 ILE N A 115 ILE CA A 115 ILE C A 116 ASP N 1.0 -58.34 -28.34 PSI 107 107 A 115 ILE C A 116 ASP N A 116 ASP CA A 116 ASP C 1.0 -77.95 -47.95 PHI 108 108 A 116 ASP N A 116 ASP CA A 116 ASP C A 117 ASN N 1.0 -49.84 -19.84 PSI 109 109 A 116 ASP C A 117 ASN N A 117 ASN CA A 117 ASN C 1.0 -86.18 -55.94 PHI 110 110 A 117 ASN N A 117 ASN CA A 117 ASN C A 118 THR N 1.0 -48.13 -18.13 PSI stop_ save_