data_19115 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 19115 _Entry.PDB_ID 2M67 save_ save_delta_chem_shifts _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts _Entity_delta_chem_shifts.Model_type single _Entity_delta_chem_shifts.Entry_ID 19115 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 5 5 LYS N N 5 120.900 120.900 118.125 2.775 19115 2 1 1 . 1 1 5 5 LYS C C 5 176.700 176.700 177.468 -0.768 19115 3 1 1 . 1 1 5 5 LYS CA C 5 58.780 58.780 59.198 -0.418 19115 4 1 1 . 1 1 6 6 THR N N 6 121.660 121.660 112.211 9.449 19115 5 1 1 . 1 1 6 6 THR C C 6 173.630 173.630 176.482 -2.852 19115 6 1 1 . 1 1 6 6 THR CA C 6 65.620 65.620 64.037 1.583 19115 7 1 1 . 1 1 7 7 LEU N N 7 124.020 124.020 124.194 -0.174 19115 8 1 1 . 1 1 7 7 LEU C C 7 176.320 176.320 177.879 -1.559 19115 9 1 1 . 1 1 7 7 LEU CA C 7 56.090 56.090 58.175 -2.085 19115 10 1 1 . 1 1 8 8 LEU N N 8 122.080 122.080 117.645 4.435 19115 11 1 1 . 1 1 8 8 LEU C C 8 175.820 175.820 178.469 -2.649 19115 12 1 1 . 1 1 8 8 LEU CA C 8 56.180 56.180 56.194 -0.014 19115 13 1 1 . 1 1 9 9 ARG N N 9 120.750 120.750 120.275 0.475 19115 14 1 1 . 1 1 9 9 ARG C C 9 176.260 176.260 177.705 -1.445 19115 15 1 1 . 1 1 9 9 ARG CA C 9 56.590 56.590 58.717 -2.127 19115 16 1 1 . 1 1 10 10 VAL N N 10 119.300 119.300 119.705 -0.405 19115 17 1 1 . 1 1 10 10 VAL C C 10 175.990 175.990 177.853 -1.863 19115 18 1 1 . 1 1 10 10 VAL CA C 10 64.090 64.090 66.612 -2.522 19115 19 1 1 . 1 1 11 11 SER N N 11 120.480 120.480 115.784 4.696 19115 20 1 1 . 1 1 11 11 SER C C 11 174.790 174.790 176.806 -2.016 19115 21 1 1 . 1 1 11 11 SER CA C 11 61.550 61.550 61.700 -0.150 19115 22 1 1 . 1 1 12 12 ILE N N 12 125.380 125.380 121.864 3.516 19115 23 1 1 . 1 1 12 12 ILE C C 12 176.980 176.980 178.123 -1.143 19115 24 1 1 . 1 1 12 12 ILE CA C 12 63.850 63.850 64.814 -0.964 19115 25 1 1 . 1 1 13 13 ILE N N 13 122.450 122.450 116.817 5.633 19115 26 1 1 . 1 1 13 13 ILE C C 13 175.220 175.220 178.046 -2.826 19115 27 1 1 . 1 1 13 13 ILE CA C 13 63.910 63.910 63.888 0.022 19115 28 1 1 . 1 1 15 15 THR N N 15 120.570 120.570 118.387 2.183 19115 29 1 1 . 1 1 15 15 THR C C 15 174.670 174.670 176.809 -2.139 19115 30 1 1 . 1 1 15 15 THR CA C 15 66.150 66.150 66.644 -0.494 19115 31 1 1 . 1 1 16 16 THR N N 16 120.300 120.300 119.599 0.701 19115 32 1 1 . 1 1 16 16 THR C C 16 173.330 173.330 176.201 -2.871 19115 33 1 1 . 1 1 16 16 THR CA C 16 65.950 65.950 66.884 -0.934 19115 34 1 1 . 1 1 17 17 LEU N N 17 123.250 123.250 121.603 1.647 19115 35 1 1 . 1 1 17 17 LEU C C 17 175.940 175.940 178.650 -2.710 19115 36 1 1 . 1 1 17 17 LEU CA C 17 56.290 56.290 58.107 -1.817 19115 37 1 1 . 1 1 18 18 VAL N N 18 120.680 120.680 119.140 1.540 19115 38 1 1 . 1 1 18 18 VAL C C 18 176.240 176.240 177.745 -1.505 19115 39 1 1 . 1 1 18 18 VAL CA C 18 64.840 64.840 66.406 -1.566 19115 40 1 1 . 1 1 19 19 ALA N N 19 120.350 120.350 122.186 -1.836 19115 41 1 1 . 1 1 19 19 ALA C C 19 177.010 177.010 179.352 -2.342 19115 42 1 1 . 1 1 19 19 ALA CA C 19 53.880 53.880 54.992 -1.112 19115 43 1 1 . 1 1 20 20 LEU N N 20 119.220 119.220 118.684 0.536 19115 44 1 1 . 1 1 20 20 LEU C C 20 177.090 177.090 179.722 -2.632 19115 45 1 1 . 1 1 20 20 LEU CA C 20 55.890 55.890 57.423 -1.533 19115 46 1 1 . 1 1 21 21 SER N N 21 116.930 116.930 115.458 1.472 19115 47 1 1 . 1 1 21 21 SER C C 21 172.150 172.150 177.009 -4.859 19115 48 1 1 . 1 1 21 21 SER CA C 21 57.960 57.960 61.135 -3.175 19115 49 1 1 . 1 1 22 22 SER N N 22 121.910 121.910 116.993 4.917 19115 50 1 1 . 1 1 22 22 SER C C 22 172.440 172.440 174.545 -2.105 19115 51 1 1 . 1 1 22 22 SER CA C 22 59.270 59.270 60.372 -1.102 19115 52 1 1 . 1 1 23 23 PHE N N 23 120.760 120.760 117.230 3.530 19115 53 1 1 . 1 1 23 23 PHE C C 23 175.110 175.110 177.017 -1.907 19115 54 1 1 . 1 1 23 23 PHE CA C 23 56.220 56.220 58.578 -2.357 19115 55 1 1 . 1 1 24 24 THR N N 24 119.530 119.530 118.048 1.482 19115 56 1 1 . 1 1 24 24 THR C C 24 174.140 174.140 173.532 0.608 19115 57 1 1 . 1 1 24 24 THR CA C 24 63.380 63.380 68.939 -5.559 19115 58 1 1 . 1 1 26 26 VAL N N 26 120.730 120.730 118.299 2.431 19115 59 1 1 . 1 1 26 26 VAL C C 26 175.440 175.440 177.860 -2.420 19115 60 1 1 . 1 1 26 26 VAL CA C 26 65.460 65.460 66.072 -0.612 19115 61 1 1 . 1 1 27 27 LEU N N 27 120.380 120.380 119.326 1.054 19115 62 1 1 . 1 1 27 27 LEU C C 27 177.360 177.360 179.338 -1.978 19115 63 1 1 . 1 1 27 27 LEU CA C 27 56.180 56.180 58.172 -1.992 19115 64 1 1 . 1 1 28 28 VAL N N 28 120.420 120.420 119.321 1.099 19115 65 1 1 . 1 1 28 28 VAL C C 28 174.360 174.360 178.173 -3.813 19115 66 1 1 . 1 1 28 28 VAL CA C 28 66.370 66.370 66.515 -0.145 19115 67 1 1 . 1 1 29 29 ILE N N 29 121.960 121.960 120.075 1.885 19115 68 1 1 . 1 1 29 29 ILE C C 29 176.320 176.320 177.956 -1.636 19115 69 1 1 . 1 1 29 29 ILE CA C 29 63.700 63.700 65.466 -1.766 19115 70 1 1 . 1 1 30 30 LEU N N 30 122.400 122.400 120.936 1.464 19115 71 1 1 . 1 1 30 30 LEU C C 30 175.820 175.820 178.755 -2.935 19115 72 1 1 . 1 1 30 30 LEU CA C 30 56.790 56.790 58.076 -1.286 19115 73 1 1 . 1 1 31 31 LEU N N 31 118.640 118.640 118.526 0.114 19115 74 1 1 . 1 1 31 31 LEU C C 31 177.530 177.530 178.830 -1.300 19115 75 1 1 . 1 1 31 31 LEU CA C 31 56.700 56.700 57.871 -1.171 19115 76 1 1 . 1 1 33 33 VAL N N 33 123.000 123.000 123.551 -0.551 19115 77 1 1 . 1 1 33 33 VAL C C 33 174.230 174.230 178.247 -4.017 19115 78 1 1 . 1 1 33 33 VAL CA C 33 65.950 65.950 66.144 -0.194 19115 79 1 1 . 1 1 34 34 VAL N N 34 123.380 123.380 119.257 4.123 19115 80 1 1 . 1 1 34 34 VAL C C 34 176.160 176.160 177.659 -1.499 19115 81 1 1 . 1 1 34 34 VAL CA C 34 65.160 65.160 65.105 0.055 19115 82 1 1 . 1 1 36 36 LEU N N 36 121.010 121.010 121.594 -0.584 19115 83 1 1 . 1 1 36 36 LEU C C 36 177.200 177.200 178.026 -0.826 19115 84 1 1 . 1 1 36 36 LEU CA C 36 55.890 55.890 57.186 -1.296 19115 85 1 1 . 1 1 37 37 SER N N 37 119.220 119.220 114.394 4.826 19115 86 1 1 . 1 1 37 37 SER C C 37 174.230 174.230 176.269 -2.039 19115 87 1 1 . 1 1 37 37 SER CA C 37 59.900 59.900 62.220 -2.320 19115 88 1 1 . 1 1 38 38 ALA N N 38 125.190 125.190 124.161 1.029 19115 89 1 1 . 1 1 38 38 ALA C C 38 178.020 178.020 178.752 -0.732 19115 90 1 1 . 1 1 38 38 ALA CA C 38 53.060 53.060 54.782 -1.722 19115 91 1 1 . 1 1 39 39 LEU N N 39 118.060 118.060 119.698 -1.638 19115 92 1 1 . 1 1 39 39 LEU C C 39 174.840 174.840 179.491 -4.651 19115 93 1 1 . 1 1 39 39 LEU CA C 39 55.150 55.150 57.331 -2.181 19115 94 1 1 . 1 1 40 40 THR N N 40 104.520 104.520 111.960 -7.440 19115 95 1 1 . 1 1 40 40 THR C C 40 171.370 171.370 175.325 -3.955 19115 96 1 1 . 1 1 40 40 THR CA C 40 59.980 59.980 63.240 -3.260 19115 97 1 1 . 1 1 42 42 TYR N N 42 120.780 120.780 120.308 0.472 19115 98 1 1 . 1 1 42 42 TYR C C 42 172.920 172.920 176.947 -4.027 19115 99 1 1 . 1 1 42 42 TYR CA C 42 57.310 57.310 56.711 0.599 19115 100 1 1 . 1 1 43 43 LEU N N 43 123.030 123.030 120.951 2.079 19115 101 1 1 . 1 1 43 43 LEU C C 43 174.780 174.780 178.473 -3.693 19115 102 1 1 . 1 1 43 43 LEU CA C 43 56.500 56.500 58.291 -1.791 19115 103 1 1 . 1 1 44 44 ASP N N 44 121.320 121.320 118.545 2.775 19115 104 1 1 . 1 1 44 44 ASP C C 44 174.780 174.780 178.016 -3.236 19115 105 1 1 . 1 1 44 44 ASP CA C 44 56.500 56.500 56.473 0.027 19115 106 1 1 . 1 1 45 45 TYR N N 45 120.640 120.640 121.884 -1.244 19115 107 1 1 . 1 1 45 45 TYR C C 45 174.010 174.010 174.949 -0.939 19115 108 1 1 . 1 1 45 45 TYR CA C 45 59.780 59.780 58.115 1.665 19115 109 1 1 . 1 1 46 46 VAL N N 46 120.490 120.490 118.495 1.995 19115 110 1 1 . 1 1 46 46 VAL C C 46 173.030 173.030 175.591 -2.561 19115 111 1 1 . 1 1 46 46 VAL CA C 46 60.050 60.050 62.651 -2.602 19115 112 1 1 . 1 1 47 47 LEU N N 47 120.990 120.990 120.862 0.128 19115 113 1 1 . 1 1 47 47 LEU C C 47 176.320 176.320 178.204 -1.884 19115 114 1 1 . 1 1 47 47 LEU CA C 47 56.700 56.700 57.445 -0.745 19115 115 1 1 . 1 1 48 48 LEU N N 48 122.020 122.020 120.490 1.530 19115 116 1 1 . 1 1 48 48 LEU C C 48 174.670 174.670 176.366 -1.696 19115 117 1 1 . 1 1 48 48 LEU CA C 48 57.800 57.800 59.934 -2.134 19115 118 1 1 . 1 1 50 50 ALA N N 50 119.130 119.130 121.359 -2.229 19115 119 1 1 . 1 1 50 50 ALA C C 50 177.690 177.690 179.679 -1.989 19115 120 1 1 . 1 1 50 50 ALA CA C 50 54.680 54.680 54.559 0.121 19115 121 1 1 . 1 1 51 51 LEU N N 51 122.780 122.780 119.960 2.820 19115 122 1 1 . 1 1 51 51 LEU C C 51 176.650 176.650 178.045 -1.395 19115 123 1 1 . 1 1 51 51 LEU CA C 51 57.570 57.570 57.350 0.220 19115 124 1 1 . 1 1 52 52 ALA N N 52 123.870 123.870 122.359 1.511 19115 125 1 1 . 1 1 52 52 ALA C C 52 178.020 178.020 179.650 -1.630 19115 126 1 1 . 1 1 52 52 ALA CA C 52 53.730 53.730 55.078 -1.348 19115 127 1 1 . 1 1 53 53 ILE N N 53 120.070 120.070 118.505 1.565 19115 128 1 1 . 1 1 53 53 ILE C C 53 176.100 176.100 177.760 -1.660 19115 129 1 1 . 1 1 53 53 ILE CA C 53 63.300 63.300 65.256 -1.956 19115 130 1 1 . 1 1 54 54 PHE N N 54 117.590 117.590 120.762 -3.172 19115 131 1 1 . 1 1 54 54 PHE C C 54 175.960 175.960 177.024 -1.064 19115 132 1 1 . 1 1 54 54 PHE CA C 54 60.210 60.210 61.298 -1.088 19115 133 1 1 . 1 1 55 55 ILE N N 55 121.880 121.880 118.425 3.455 19115 134 1 1 . 1 1 55 55 ILE C C 55 176.870 176.870 178.294 -1.424 19115 135 1 1 . 1 1 55 55 ILE CA C 55 64.700 64.700 64.300 0.400 19115 136 1 1 . 1 1 57 57 LEU N N 57 121.970 121.970 122.105 -0.135 19115 137 1 1 . 1 1 57 57 LEU C C 57 176.050 176.050 178.148 -2.098 19115 138 1 1 . 1 1 57 57 LEU CA C 57 56.250 56.250 57.754 -1.504 19115 139 1 1 . 1 1 58 58 THR N N 58 121.370 121.370 113.149 8.221 19115 140 1 1 . 1 1 58 58 THR C C 58 173.460 173.460 176.750 -3.290 19115 141 1 1 . 1 1 58 58 THR CA C 58 66.340 66.340 65.530 0.810 19115 142 1 1 . 1 1 59 59 ILE N N 59 122.490 122.490 121.608 0.882 19115 143 1 1 . 1 1 59 59 ILE C C 59 175.990 175.990 178.273 -2.283 19115 144 1 1 . 1 1 59 59 ILE CA C 59 63.400 63.400 64.093 -0.693 19115 145 1 1 . 1 1 60 60 TYR N N 60 120.950 120.950 118.754 2.196 19115 146 1 1 . 1 1 60 60 TYR C C 60 174.890 174.890 178.338 -3.448 19115 147 1 1 . 1 1 60 60 TYR CA C 60 60.000 60.000 59.352 0.648 19115 148 1 1 . 1 1 61 61 ALA N N 61 119.910 119.910 122.807 -2.897 19115 149 1 1 . 1 1 61 61 ALA C C 61 178.130 178.130 179.344 -1.214 19115 150 1 1 . 1 1 61 61 ALA CA C 61 54.640 54.640 54.815 -0.175 19115 151 1 1 . 1 1 62 62 ILE N N 62 122.480 122.480 118.578 3.902 19115 152 1 1 . 1 1 62 62 ILE C C 62 176.210 176.210 177.238 -1.028 19115 153 1 1 . 1 1 62 62 ILE CA C 62 64.200 64.200 63.625 0.575 19115 154 1 1 . 1 1 63 63 GLN N N 63 118.550 118.550 118.558 -0.008 19115 155 1 1 . 1 1 63 63 GLN C C 63 176.980 176.980 178.456 -1.476 19115 156 1 1 . 1 1 63 63 GLN CA C 63 55.740 55.740 59.281 -3.541 19115 157 1 1 . 1 1 64 64 ARG N N 64 120.750 120.750 118.335 2.415 19115 158 1 1 . 1 1 64 64 ARG C C 64 176.370 176.370 178.274 -1.904 19115 159 1 1 . 1 1 64 64 ARG CA C 64 56.660 56.660 57.683 -1.023 19115 160 1 1 . 1 1 65 65 LYS N N 65 120.970 120.970 119.776 1.194 19115 161 1 1 . 1 1 65 65 LYS C C 65 176.760 176.760 178.502 -1.742 19115 162 1 1 . 1 1 65 65 LYS CA C 65 57.100 57.100 60.180 -3.080 19115 163 1 1 . 1 1 66 66 ARG N N 66 121.030 121.030 116.689 4.341 19115 164 1 1 . 1 1 66 66 ARG C C 66 175.880 175.880 178.710 -2.830 19115 165 1 1 . 1 1 66 66 ARG CA C 66 56.300 56.300 58.677 -2.377 19115 166 1 1 . 1 1 67 67 GLN N N 67 122.080 122.080 119.962 2.118 19115 167 1 1 . 1 1 67 67 GLN C C 67 174.560 174.560 178.348 -3.788 19115 168 1 1 . 1 1 67 67 GLN CA C 67 54.940 54.940 58.794 -3.854 19115 169 1 1 . 1 1 68 68 ALA N N 68 125.730 125.730 122.562 3.168 19115 170 1 1 . 1 1 68 68 ALA C C 68 176.500 176.500 179.400 -2.900 19115 171 1 1 . 1 1 68 68 ALA CA C 68 51.180 51.180 55.491 -4.311 19115 172 1 1 . 1 1 69 69 ASP N N 69 119.350 119.350 119.196 0.154 19115 173 1 1 . 1 1 69 69 ASP C C 69 174.900 174.900 177.803 -2.903 19115 174 1 1 . 1 1 69 69 ASP CA C 69 53.150 53.150 56.410 -3.260 19115 175 1 2 . 1 1 5 5 LYS N N 5 120.900 120.900 115.652 5.248 19115 176 1 2 . 1 1 5 5 LYS C C 5 176.700 176.700 177.653 -0.953 19115 177 1 2 . 1 1 5 5 LYS CA C 5 58.780 58.780 58.333 0.447 19115 178 1 2 . 1 1 6 6 THR N N 6 121.660 121.660 113.597 8.063 19115 179 1 2 . 1 1 6 6 THR C C 6 173.630 173.630 175.001 -1.371 19115 180 1 2 . 1 1 6 6 THR CA C 6 65.620 65.620 64.136 1.484 19115 181 1 2 . 1 1 7 7 LEU N N 7 124.020 124.020 120.144 3.876 19115 182 1 2 . 1 1 7 7 LEU C C 7 176.320 176.320 179.305 -2.985 19115 183 1 2 . 1 1 7 7 LEU CA C 7 56.090 56.090 56.489 -0.399 19115 184 1 2 . 1 1 8 8 LEU N N 8 122.080 122.080 120.917 1.163 19115 185 1 2 . 1 1 8 8 LEU C C 8 175.820 175.820 179.138 -3.318 19115 186 1 2 . 1 1 8 8 LEU CA C 8 56.180 56.180 57.249 -1.069 19115 187 1 2 . 1 1 9 9 ARG N N 9 120.750 120.750 119.220 1.530 19115 188 1 2 . 1 1 9 9 ARG C C 9 176.260 176.260 178.065 -1.805 19115 189 1 2 . 1 1 9 9 ARG CA C 9 56.590 56.590 58.894 -2.304 19115 190 1 2 . 1 1 10 10 VAL N N 10 119.300 119.300 120.390 -1.090 19115 191 1 2 . 1 1 10 10 VAL C C 10 175.990 175.990 177.010 -1.020 19115 192 1 2 . 1 1 10 10 VAL CA C 10 64.090 64.090 65.523 -1.433 19115 193 1 2 . 1 1 11 11 SER N N 11 120.480 120.480 115.578 4.902 19115 194 1 2 . 1 1 11 11 SER C C 11 174.790 174.790 177.100 -2.310 19115 195 1 2 . 1 1 11 11 SER CA C 11 61.550 61.550 62.264 -0.714 19115 196 1 2 . 1 1 12 12 ILE N N 12 125.380 125.380 121.996 3.384 19115 197 1 2 . 1 1 12 12 ILE C C 12 176.980 176.980 178.220 -1.240 19115 198 1 2 . 1 1 12 12 ILE CA C 12 63.850 63.850 64.707 -0.857 19115 199 1 2 . 1 1 13 13 ILE N N 13 122.450 122.450 120.329 2.121 19115 200 1 2 . 1 1 13 13 ILE C C 13 175.220 175.220 179.047 -3.827 19115 201 1 2 . 1 1 13 13 ILE CA C 13 63.910 63.910 62.775 1.135 19115 202 1 2 . 1 1 15 15 THR N N 15 120.570 120.570 118.460 2.110 19115 203 1 2 . 1 1 15 15 THR C C 15 174.670 174.670 176.803 -2.133 19115 204 1 2 . 1 1 15 15 THR CA C 15 66.150 66.150 66.639 -0.489 19115 205 1 2 . 1 1 16 16 THR N N 16 120.300 120.300 117.086 3.214 19115 206 1 2 . 1 1 16 16 THR C C 16 173.330 173.330 175.866 -2.536 19115 207 1 2 . 1 1 16 16 THR CA C 16 65.950 65.950 65.327 0.623 19115 208 1 2 . 1 1 17 17 LEU N N 17 123.250 123.250 123.096 0.154 19115 209 1 2 . 1 1 17 17 LEU C C 17 175.940 175.940 178.311 -2.371 19115 210 1 2 . 1 1 17 17 LEU CA C 17 56.290 56.290 58.343 -2.053 19115 211 1 2 . 1 1 18 18 VAL N N 18 120.680 120.680 118.603 2.077 19115 212 1 2 . 1 1 18 18 VAL C C 18 176.240 176.240 177.753 -1.513 19115 213 1 2 . 1 1 18 18 VAL CA C 18 64.840 64.840 66.219 -1.379 19115 214 1 2 . 1 1 19 19 ALA N N 19 120.350 120.350 121.965 -1.615 19115 215 1 2 . 1 1 19 19 ALA C C 19 177.010 177.010 180.539 -3.529 19115 216 1 2 . 1 1 19 19 ALA CA C 19 53.880 53.880 55.121 -1.241 19115 217 1 2 . 1 1 20 20 LEU N N 20 119.220 119.220 118.608 0.612 19115 218 1 2 . 1 1 20 20 LEU C C 20 177.090 177.090 179.098 -2.008 19115 219 1 2 . 1 1 20 20 LEU CA C 20 55.890 55.890 57.734 -1.844 19115 220 1 2 . 1 1 21 21 SER N N 21 116.930 116.930 114.111 2.819 19115 221 1 2 . 1 1 21 21 SER C C 21 172.150 172.150 176.018 -3.868 19115 222 1 2 . 1 1 21 21 SER CA C 21 57.960 57.960 61.212 -3.252 19115 223 1 2 . 1 1 22 22 SER N N 22 121.910 121.910 115.732 6.178 19115 224 1 2 . 1 1 22 22 SER C C 22 172.440 172.440 174.666 -2.226 19115 225 1 2 . 1 1 22 22 SER CA C 22 59.270 59.270 60.216 -0.946 19115 226 1 2 . 1 1 23 23 PHE N N 23 120.760 120.760 119.695 1.065 19115 227 1 2 . 1 1 23 23 PHE C C 23 175.110 175.110 177.722 -2.612 19115 228 1 2 . 1 1 23 23 PHE CA C 23 56.220 56.220 60.221 -4.001 19115 229 1 2 . 1 1 24 24 THR N N 24 119.530 119.530 115.876 3.654 19115 230 1 2 . 1 1 24 24 THR C C 24 174.140 174.140 174.104 0.036 19115 231 1 2 . 1 1 24 24 THR CA C 24 63.380 63.380 67.509 -4.129 19115 232 1 2 . 1 1 26 26 VAL N N 26 120.730 120.730 117.276 3.454 19115 233 1 2 . 1 1 26 26 VAL C C 26 175.440 175.440 178.417 -2.977 19115 234 1 2 . 1 1 26 26 VAL CA C 26 65.460 65.460 66.222 -0.762 19115 235 1 2 . 1 1 27 27 LEU N N 27 120.380 120.380 120.063 0.317 19115 236 1 2 . 1 1 27 27 LEU C C 27 177.360 177.360 178.889 -1.529 19115 237 1 2 . 1 1 27 27 LEU CA C 27 56.180 56.180 57.921 -1.741 19115 238 1 2 . 1 1 28 28 VAL N N 28 120.420 120.420 118.906 1.514 19115 239 1 2 . 1 1 28 28 VAL C C 28 174.360 174.360 177.634 -3.274 19115 240 1 2 . 1 1 28 28 VAL CA C 28 66.370 66.370 65.884 0.486 19115 241 1 2 . 1 1 29 29 ILE N N 29 121.960 121.960 121.092 0.868 19115 242 1 2 . 1 1 29 29 ILE C C 29 176.320 176.320 177.148 -0.828 19115 243 1 2 . 1 1 29 29 ILE CA C 29 63.700 63.700 64.863 -1.163 19115 244 1 2 . 1 1 30 30 LEU N N 30 122.400 122.400 120.408 1.992 19115 245 1 2 . 1 1 30 30 LEU C C 30 175.820 175.820 178.632 -2.812 19115 246 1 2 . 1 1 30 30 LEU CA C 30 56.790 56.790 57.549 -0.759 19115 247 1 2 . 1 1 31 31 LEU N N 31 118.640 118.640 118.542 0.098 19115 248 1 2 . 1 1 31 31 LEU C C 31 177.530 177.530 178.755 -1.225 19115 249 1 2 . 1 1 31 31 LEU CA C 31 56.700 56.700 57.440 -0.740 19115 250 1 2 . 1 1 33 33 VAL N N 33 123.000 123.000 120.288 2.712 19115 251 1 2 . 1 1 33 33 VAL C C 33 174.230 174.230 177.731 -3.501 19115 252 1 2 . 1 1 33 33 VAL CA C 33 65.950 65.950 65.473 0.477 19115 253 1 2 . 1 1 34 34 VAL N N 34 123.380 123.380 119.066 4.314 19115 254 1 2 . 1 1 34 34 VAL C C 34 176.160 176.160 177.688 -1.528 19115 255 1 2 . 1 1 34 34 VAL CA C 34 65.160 65.160 65.248 -0.088 19115 256 1 2 . 1 1 36 36 LEU N N 36 121.010 121.010 120.609 0.401 19115 257 1 2 . 1 1 36 36 LEU C C 36 177.200 177.200 178.451 -1.251 19115 258 1 2 . 1 1 36 36 LEU CA C 36 55.890 55.890 57.083 -1.193 19115 259 1 2 . 1 1 37 37 SER N N 37 119.220 119.220 115.400 3.820 19115 260 1 2 . 1 1 37 37 SER C C 37 174.230 174.230 176.130 -1.900 19115 261 1 2 . 1 1 37 37 SER CA C 37 59.900 59.900 61.505 -1.605 19115 262 1 2 . 1 1 38 38 ALA N N 38 125.190 125.190 124.183 1.007 19115 263 1 2 . 1 1 38 38 ALA C C 38 178.020 178.020 179.215 -1.195 19115 264 1 2 . 1 1 38 38 ALA CA C 38 53.060 53.060 54.518 -1.458 19115 265 1 2 . 1 1 39 39 LEU N N 39 118.060 118.060 119.473 -1.413 19115 266 1 2 . 1 1 39 39 LEU C C 39 174.840 174.840 179.298 -4.458 19115 267 1 2 . 1 1 39 39 LEU CA C 39 55.150 55.150 57.312 -2.162 19115 268 1 2 . 1 1 40 40 THR N N 40 104.520 104.520 112.429 -7.909 19115 269 1 2 . 1 1 40 40 THR C C 40 171.370 171.370 174.697 -3.327 19115 270 1 2 . 1 1 40 40 THR CA C 40 59.980 59.980 63.301 -3.321 19115 271 1 2 . 1 1 42 42 TYR N N 42 120.780 120.780 119.790 0.990 19115 272 1 2 . 1 1 42 42 TYR C C 42 172.920 172.920 176.947 -4.027 19115 273 1 2 . 1 1 42 42 TYR CA C 42 57.310 57.310 56.209 1.101 19115 274 1 2 . 1 1 43 43 LEU N N 43 123.030 123.030 122.347 0.683 19115 275 1 2 . 1 1 43 43 LEU C C 43 174.780 174.780 178.935 -4.155 19115 276 1 2 . 1 1 43 43 LEU CA C 43 56.500 56.500 58.066 -1.566 19115 277 1 2 . 1 1 44 44 ASP N N 44 121.320 121.320 118.368 2.952 19115 278 1 2 . 1 1 44 44 ASP C C 44 174.780 174.780 176.802 -2.022 19115 279 1 2 . 1 1 44 44 ASP CA C 44 56.500 56.500 56.420 0.080 19115 280 1 2 . 1 1 45 45 TYR N N 45 120.640 120.640 118.338 2.302 19115 281 1 2 . 1 1 45 45 TYR C C 45 174.010 174.010 175.211 -1.201 19115 282 1 2 . 1 1 45 45 TYR CA C 45 59.780 59.780 57.770 2.010 19115 283 1 2 . 1 1 46 46 VAL N N 46 120.490 120.490 119.198 1.292 19115 284 1 2 . 1 1 46 46 VAL C C 46 173.030 173.030 176.631 -3.601 19115 285 1 2 . 1 1 46 46 VAL CA C 46 60.050 60.050 63.090 -3.040 19115 286 1 2 . 1 1 47 47 LEU N N 47 120.990 120.990 120.896 0.094 19115 287 1 2 . 1 1 47 47 LEU C C 47 176.320 176.320 179.138 -2.818 19115 288 1 2 . 1 1 47 47 LEU CA C 47 56.700 56.700 57.813 -1.113 19115 289 1 2 . 1 1 48 48 LEU N N 48 122.020 122.020 119.805 2.215 19115 290 1 2 . 1 1 48 48 LEU C C 48 174.670 174.670 176.006 -1.336 19115 291 1 2 . 1 1 48 48 LEU CA C 48 57.800 57.800 59.728 -1.928 19115 292 1 2 . 1 1 50 50 ALA N N 50 119.130 119.130 118.842 0.288 19115 293 1 2 . 1 1 50 50 ALA C C 50 177.690 177.690 179.759 -2.069 19115 294 1 2 . 1 1 50 50 ALA CA C 50 54.680 54.680 54.558 0.122 19115 295 1 2 . 1 1 51 51 LEU N N 51 122.780 122.780 119.197 3.583 19115 296 1 2 . 1 1 51 51 LEU C C 51 176.650 176.650 178.541 -1.891 19115 297 1 2 . 1 1 51 51 LEU CA C 51 57.570 57.570 57.281 0.289 19115 298 1 2 . 1 1 52 52 ALA N N 52 123.870 123.870 121.755 2.115 19115 299 1 2 . 1 1 52 52 ALA C C 52 178.020 178.020 179.790 -1.770 19115 300 1 2 . 1 1 52 52 ALA CA C 52 53.730 53.730 54.971 -1.241 19115 301 1 2 . 1 1 53 53 ILE N N 53 120.070 120.070 118.944 1.126 19115 302 1 2 . 1 1 53 53 ILE C C 53 176.100 176.100 178.287 -2.187 19115 303 1 2 . 1 1 53 53 ILE CA C 53 63.300 63.300 64.956 -1.656 19115 304 1 2 . 1 1 54 54 PHE N N 54 117.590 117.590 119.513 -1.923 19115 305 1 2 . 1 1 54 54 PHE C C 54 175.960 175.960 178.142 -2.182 19115 306 1 2 . 1 1 54 54 PHE CA C 54 60.210 60.210 62.231 -2.022 19115 307 1 2 . 1 1 55 55 ILE N N 55 121.880 121.880 118.762 3.118 19115 308 1 2 . 1 1 55 55 ILE C C 55 176.870 176.870 177.829 -0.959 19115 309 1 2 . 1 1 55 55 ILE CA C 55 64.700 64.700 64.450 0.250 19115 310 1 2 . 1 1 57 57 LEU N N 57 121.970 121.970 121.713 0.257 19115 311 1 2 . 1 1 57 57 LEU C C 57 176.050 176.050 178.372 -2.322 19115 312 1 2 . 1 1 57 57 LEU CA C 57 56.250 56.250 57.993 -1.743 19115 313 1 2 . 1 1 58 58 THR N N 58 121.370 121.370 113.856 7.514 19115 314 1 2 . 1 1 58 58 THR C C 58 173.460 173.460 176.828 -3.368 19115 315 1 2 . 1 1 58 58 THR CA C 58 66.340 66.340 65.718 0.622 19115 316 1 2 . 1 1 59 59 ILE N N 59 122.490 122.490 121.782 0.708 19115 317 1 2 . 1 1 59 59 ILE C C 59 175.990 175.990 177.629 -1.639 19115 318 1 2 . 1 1 59 59 ILE CA C 59 63.400 63.400 63.789 -0.389 19115 319 1 2 . 1 1 60 60 TYR N N 60 120.950 120.950 121.362 -0.412 19115 320 1 2 . 1 1 60 60 TYR C C 60 174.890 174.890 176.516 -1.626 19115 321 1 2 . 1 1 60 60 TYR CA C 60 60.000 60.000 60.406 -0.406 19115 322 1 2 . 1 1 61 61 ALA N N 61 119.910 119.910 121.595 -1.685 19115 323 1 2 . 1 1 61 61 ALA C C 61 178.130 178.130 179.318 -1.188 19115 324 1 2 . 1 1 61 61 ALA CA C 61 54.640 54.640 54.816 -0.177 19115 325 1 2 . 1 1 62 62 ILE N N 62 122.480 122.480 117.390 5.090 19115 326 1 2 . 1 1 62 62 ILE C C 62 176.210 176.210 177.863 -1.653 19115 327 1 2 . 1 1 62 62 ILE CA C 62 64.200 64.200 64.448 -0.248 19115 328 1 2 . 1 1 63 63 GLN N N 63 118.550 118.550 117.747 0.803 19115 329 1 2 . 1 1 63 63 GLN C C 63 176.980 176.980 178.458 -1.478 19115 330 1 2 . 1 1 63 63 GLN CA C 63 55.740 55.740 58.779 -3.039 19115 331 1 2 . 1 1 64 64 ARG N N 64 120.750 120.750 118.347 2.403 19115 332 1 2 . 1 1 64 64 ARG C C 64 176.370 176.370 178.139 -1.769 19115 333 1 2 . 1 1 64 64 ARG CA C 64 56.660 56.660 58.334 -1.674 19115 334 1 2 . 1 1 65 65 LYS N N 65 120.970 120.970 120.385 0.585 19115 335 1 2 . 1 1 65 65 LYS C C 65 176.760 176.760 178.779 -2.019 19115 336 1 2 . 1 1 65 65 LYS CA C 65 57.100 57.100 59.201 -2.101 19115 337 1 2 . 1 1 66 66 ARG N N 66 121.030 121.030 117.078 3.952 19115 338 1 2 . 1 1 66 66 ARG C C 66 175.880 175.880 178.799 -2.919 19115 339 1 2 . 1 1 66 66 ARG CA C 66 56.300 56.300 58.939 -2.639 19115 340 1 2 . 1 1 67 67 GLN N N 67 122.080 122.080 119.611 2.469 19115 341 1 2 . 1 1 67 67 GLN C C 67 174.560 174.560 178.321 -3.761 19115 342 1 2 . 1 1 67 67 GLN CA C 67 54.940 54.940 58.630 -3.690 19115 343 1 2 . 1 1 68 68 ALA N N 68 125.730 125.730 122.434 3.296 19115 344 1 2 . 1 1 68 68 ALA C C 68 176.500 176.500 179.446 -2.946 19115 345 1 2 . 1 1 68 68 ALA CA C 68 51.180 51.180 55.461 -4.281 19115 346 1 2 . 1 1 69 69 ASP N N 69 119.350 119.350 119.589 -0.239 19115 347 1 2 . 1 1 69 69 ASP C C 69 174.900 174.900 178.319 -3.419 19115 348 1 2 . 1 1 69 69 ASP CA C 69 53.150 53.150 56.093 -2.943 19115 349 1 3 . 1 1 5 5 LYS N N 5 120.900 120.900 117.342 3.558 19115 350 1 3 . 1 1 5 5 LYS C C 5 176.700 176.700 177.213 -0.513 19115 351 1 3 . 1 1 5 5 LYS CA C 5 58.780 58.780 59.152 -0.372 19115 352 1 3 . 1 1 6 6 THR N N 6 121.660 121.660 108.055 13.605 19115 353 1 3 . 1 1 6 6 THR C C 6 173.630 173.630 175.871 -2.241 19115 354 1 3 . 1 1 6 6 THR CA C 6 65.620 65.620 63.764 1.856 19115 355 1 3 . 1 1 7 7 LEU N N 7 124.020 124.020 123.442 0.578 19115 356 1 3 . 1 1 7 7 LEU C C 7 176.320 176.320 178.519 -2.199 19115 357 1 3 . 1 1 7 7 LEU CA C 7 56.090 56.090 58.141 -2.051 19115 358 1 3 . 1 1 8 8 LEU N N 8 122.080 122.080 120.136 1.944 19115 359 1 3 . 1 1 8 8 LEU C C 8 175.820 175.820 178.283 -2.463 19115 360 1 3 . 1 1 8 8 LEU CA C 8 56.180 56.180 58.246 -2.067 19115 361 1 3 . 1 1 9 9 ARG N N 9 120.750 120.750 117.580 3.170 19115 362 1 3 . 1 1 9 9 ARG C C 9 176.260 176.260 177.579 -1.319 19115 363 1 3 . 1 1 9 9 ARG CA C 9 56.590 56.590 58.857 -2.267 19115 364 1 3 . 1 1 10 10 VAL N N 10 119.300 119.300 118.426 0.874 19115 365 1 3 . 1 1 10 10 VAL C C 10 175.990 175.990 178.078 -2.088 19115 366 1 3 . 1 1 10 10 VAL CA C 10 64.090 64.090 65.060 -0.970 19115 367 1 3 . 1 1 11 11 SER N N 11 120.480 120.480 116.787 3.693 19115 368 1 3 . 1 1 11 11 SER C C 11 174.790 174.790 176.890 -2.100 19115 369 1 3 . 1 1 11 11 SER CA C 11 61.550 61.550 61.865 -0.315 19115 370 1 3 . 1 1 12 12 ILE N N 12 125.380 125.380 122.413 2.967 19115 371 1 3 . 1 1 12 12 ILE C C 12 176.980 176.980 176.840 0.140 19115 372 1 3 . 1 1 12 12 ILE CA C 12 63.850 63.850 63.881 -0.031 19115 373 1 3 . 1 1 13 13 ILE N N 13 122.450 122.450 119.647 2.803 19115 374 1 3 . 1 1 13 13 ILE C C 13 175.220 175.220 177.981 -2.761 19115 375 1 3 . 1 1 13 13 ILE CA C 13 63.910 63.910 65.161 -1.251 19115 376 1 3 . 1 1 15 15 THR N N 15 120.570 120.570 118.101 2.469 19115 377 1 3 . 1 1 15 15 THR C C 15 174.670 174.670 176.621 -1.951 19115 378 1 3 . 1 1 15 15 THR CA C 15 66.150 66.150 66.663 -0.513 19115 379 1 3 . 1 1 16 16 THR N N 16 120.300 120.300 119.676 0.624 19115 380 1 3 . 1 1 16 16 THR C C 16 173.330 173.330 176.229 -2.899 19115 381 1 3 . 1 1 16 16 THR CA C 16 65.950 65.950 66.614 -0.664 19115 382 1 3 . 1 1 17 17 LEU N N 17 123.250 123.250 122.408 0.842 19115 383 1 3 . 1 1 17 17 LEU C C 17 175.940 175.940 178.403 -2.463 19115 384 1 3 . 1 1 17 17 LEU CA C 17 56.290 56.290 57.691 -1.401 19115 385 1 3 . 1 1 18 18 VAL N N 18 120.680 120.680 119.156 1.524 19115 386 1 3 . 1 1 18 18 VAL C C 18 176.240 176.240 177.922 -1.682 19115 387 1 3 . 1 1 18 18 VAL CA C 18 64.840 64.840 66.507 -1.667 19115 388 1 3 . 1 1 19 19 ALA N N 19 120.350 120.350 122.188 -1.838 19115 389 1 3 . 1 1 19 19 ALA C C 19 177.010 177.010 180.271 -3.261 19115 390 1 3 . 1 1 19 19 ALA CA C 19 53.880 53.880 54.976 -1.096 19115 391 1 3 . 1 1 20 20 LEU N N 20 119.220 119.220 119.704 -0.484 19115 392 1 3 . 1 1 20 20 LEU C C 20 177.090 177.090 178.949 -1.859 19115 393 1 3 . 1 1 20 20 LEU CA C 20 55.890 55.890 57.362 -1.472 19115 394 1 3 . 1 1 21 21 SER N N 21 116.930 116.930 115.159 1.771 19115 395 1 3 . 1 1 21 21 SER C C 21 172.150 172.150 175.644 -3.494 19115 396 1 3 . 1 1 21 21 SER CA C 21 57.960 57.960 60.934 -2.974 19115 397 1 3 . 1 1 22 22 SER N N 22 121.910 121.910 115.696 6.214 19115 398 1 3 . 1 1 22 22 SER C C 22 172.440 172.440 174.477 -2.037 19115 399 1 3 . 1 1 22 22 SER CA C 22 59.270 59.270 60.582 -1.312 19115 400 1 3 . 1 1 23 23 PHE N N 23 120.760 120.760 121.548 -0.788 19115 401 1 3 . 1 1 23 23 PHE C C 23 175.110 175.110 176.896 -1.786 19115 402 1 3 . 1 1 23 23 PHE CA C 23 56.220 56.220 59.970 -3.750 19115 403 1 3 . 1 1 24 24 THR N N 24 119.530 119.530 116.120 3.410 19115 404 1 3 . 1 1 24 24 THR C C 24 174.140 174.140 173.890 0.250 19115 405 1 3 . 1 1 24 24 THR CA C 24 63.380 63.380 66.906 -3.526 19115 406 1 3 . 1 1 26 26 VAL N N 26 120.730 120.730 117.373 3.357 19115 407 1 3 . 1 1 26 26 VAL C C 26 175.440 175.440 177.687 -2.247 19115 408 1 3 . 1 1 26 26 VAL CA C 26 65.460 65.460 65.669 -0.209 19115 409 1 3 . 1 1 27 27 LEU N N 27 120.380 120.380 117.325 3.055 19115 410 1 3 . 1 1 27 27 LEU C C 27 177.360 177.360 178.508 -1.148 19115 411 1 3 . 1 1 27 27 LEU CA C 27 56.180 56.180 58.139 -1.959 19115 412 1 3 . 1 1 28 28 VAL N N 28 120.420 120.420 119.694 0.726 19115 413 1 3 . 1 1 28 28 VAL C C 28 174.360 174.360 178.429 -4.069 19115 414 1 3 . 1 1 28 28 VAL CA C 28 66.370 66.370 65.976 0.394 19115 415 1 3 . 1 1 29 29 ILE N N 29 121.960 121.960 119.790 2.170 19115 416 1 3 . 1 1 29 29 ILE C C 29 176.320 176.320 177.916 -1.596 19115 417 1 3 . 1 1 29 29 ILE CA C 29 63.700 63.700 64.477 -0.777 19115 418 1 3 . 1 1 30 30 LEU N N 30 122.400 122.400 120.469 1.931 19115 419 1 3 . 1 1 30 30 LEU C C 30 175.820 175.820 178.584 -2.764 19115 420 1 3 . 1 1 30 30 LEU CA C 30 56.790 56.790 58.692 -1.902 19115 421 1 3 . 1 1 31 31 LEU N N 31 118.640 118.640 117.434 1.206 19115 422 1 3 . 1 1 31 31 LEU C C 31 177.530 177.530 178.973 -1.443 19115 423 1 3 . 1 1 31 31 LEU CA C 31 56.700 56.700 57.494 -0.794 19115 424 1 3 . 1 1 33 33 VAL N N 33 123.000 123.000 119.426 3.574 19115 425 1 3 . 1 1 33 33 VAL C C 33 174.230 174.230 177.807 -3.577 19115 426 1 3 . 1 1 33 33 VAL CA C 33 65.950 65.950 65.565 0.385 19115 427 1 3 . 1 1 34 34 VAL N N 34 123.380 123.380 119.832 3.548 19115 428 1 3 . 1 1 34 34 VAL C C 34 176.160 176.160 178.104 -1.944 19115 429 1 3 . 1 1 34 34 VAL CA C 34 65.160 65.160 66.126 -0.966 19115 430 1 3 . 1 1 36 36 LEU N N 36 121.010 121.010 120.679 0.331 19115 431 1 3 . 1 1 36 36 LEU C C 36 177.200 177.200 178.221 -1.021 19115 432 1 3 . 1 1 36 36 LEU CA C 36 55.890 55.890 57.389 -1.498 19115 433 1 3 . 1 1 37 37 SER N N 37 119.220 119.220 114.281 4.939 19115 434 1 3 . 1 1 37 37 SER C C 37 174.230 174.230 176.395 -2.165 19115 435 1 3 . 1 1 37 37 SER CA C 37 59.900 59.900 61.406 -1.506 19115 436 1 3 . 1 1 38 38 ALA N N 38 125.190 125.190 124.378 0.812 19115 437 1 3 . 1 1 38 38 ALA C C 38 178.020 178.020 179.396 -1.376 19115 438 1 3 . 1 1 38 38 ALA CA C 38 53.060 53.060 54.701 -1.641 19115 439 1 3 . 1 1 39 39 LEU N N 39 118.060 118.060 118.006 0.054 19115 440 1 3 . 1 1 39 39 LEU C C 39 174.840 174.840 179.224 -4.384 19115 441 1 3 . 1 1 39 39 LEU CA C 39 55.150 55.150 57.179 -2.029 19115 442 1 3 . 1 1 40 40 THR N N 40 104.520 104.520 108.315 -3.795 19115 443 1 3 . 1 1 40 40 THR C C 40 171.370 171.370 175.237 -3.867 19115 444 1 3 . 1 1 40 40 THR CA C 40 59.980 59.980 62.312 -2.332 19115 445 1 3 . 1 1 42 42 TYR N N 42 120.780 120.780 124.473 -3.693 19115 446 1 3 . 1 1 42 42 TYR C C 42 172.920 172.920 175.295 -2.375 19115 447 1 3 . 1 1 42 42 TYR CA C 42 57.310 57.310 57.271 0.039 19115 448 1 3 . 1 1 43 43 LEU N N 43 123.030 123.030 124.847 -1.817 19115 449 1 3 . 1 1 43 43 LEU C C 43 174.780 174.780 178.210 -3.430 19115 450 1 3 . 1 1 43 43 LEU CA C 43 56.500 56.500 56.432 0.068 19115 451 1 3 . 1 1 44 44 ASP N N 44 121.320 121.320 118.189 3.131 19115 452 1 3 . 1 1 44 44 ASP C C 44 174.780 174.780 175.731 -0.951 19115 453 1 3 . 1 1 44 44 ASP CA C 44 56.500 56.500 54.618 1.882 19115 454 1 3 . 1 1 45 45 TYR N N 45 120.640 120.640 118.409 2.231 19115 455 1 3 . 1 1 45 45 TYR C C 45 174.010 174.010 174.749 -0.739 19115 456 1 3 . 1 1 45 45 TYR CA C 45 59.780 59.780 58.426 1.354 19115 457 1 3 . 1 1 46 46 VAL N N 46 120.490 120.490 117.262 3.228 19115 458 1 3 . 1 1 46 46 VAL C C 46 173.030 173.030 176.109 -3.079 19115 459 1 3 . 1 1 46 46 VAL CA C 46 60.050 60.050 62.758 -2.708 19115 460 1 3 . 1 1 47 47 LEU N N 47 120.990 120.990 120.036 0.954 19115 461 1 3 . 1 1 47 47 LEU C C 47 176.320 176.320 178.364 -2.044 19115 462 1 3 . 1 1 47 47 LEU CA C 47 56.700 56.700 57.119 -0.419 19115 463 1 3 . 1 1 48 48 LEU N N 48 122.020 122.020 120.283 1.737 19115 464 1 3 . 1 1 48 48 LEU C C 48 174.670 174.670 176.542 -1.872 19115 465 1 3 . 1 1 48 48 LEU CA C 48 57.800 57.800 59.744 -1.944 19115 466 1 3 . 1 1 50 50 ALA N N 50 119.130 119.130 121.276 -2.146 19115 467 1 3 . 1 1 50 50 ALA C C 50 177.690 177.690 179.643 -1.953 19115 468 1 3 . 1 1 50 50 ALA CA C 50 54.680 54.680 54.684 -0.004 19115 469 1 3 . 1 1 51 51 LEU N N 51 122.780 122.780 118.148 4.632 19115 470 1 3 . 1 1 51 51 LEU C C 51 176.650 176.650 178.797 -2.147 19115 471 1 3 . 1 1 51 51 LEU CA C 51 57.570 57.570 56.875 0.695 19115 472 1 3 . 1 1 52 52 ALA N N 52 123.870 123.870 123.099 0.771 19115 473 1 3 . 1 1 52 52 ALA C C 52 178.020 178.020 179.888 -1.868 19115 474 1 3 . 1 1 52 52 ALA CA C 52 53.730 53.730 55.383 -1.653 19115 475 1 3 . 1 1 53 53 ILE N N 53 120.070 120.070 118.625 1.445 19115 476 1 3 . 1 1 53 53 ILE C C 53 176.100 176.100 178.094 -1.994 19115 477 1 3 . 1 1 53 53 ILE CA C 53 63.300 63.300 62.953 0.347 19115 478 1 3 . 1 1 54 54 PHE N N 54 117.590 117.590 119.281 -1.691 19115 479 1 3 . 1 1 54 54 PHE C C 54 175.960 175.960 178.304 -2.344 19115 480 1 3 . 1 1 54 54 PHE CA C 54 60.210 60.210 62.777 -2.567 19115 481 1 3 . 1 1 55 55 ILE N N 55 121.880 121.880 119.407 2.473 19115 482 1 3 . 1 1 55 55 ILE C C 55 176.870 176.870 178.283 -1.413 19115 483 1 3 . 1 1 55 55 ILE CA C 55 64.700 64.700 65.190 -0.490 19115 484 1 3 . 1 1 57 57 LEU N N 57 121.970 121.970 122.385 -0.415 19115 485 1 3 . 1 1 57 57 LEU C C 57 176.050 176.050 179.245 -3.195 19115 486 1 3 . 1 1 57 57 LEU CA C 57 56.250 56.250 58.238 -1.988 19115 487 1 3 . 1 1 58 58 THR N N 58 121.370 121.370 115.539 5.831 19115 488 1 3 . 1 1 58 58 THR C C 58 173.460 173.460 176.611 -3.151 19115 489 1 3 . 1 1 58 58 THR CA C 58 66.340 66.340 66.915 -0.575 19115 490 1 3 . 1 1 59 59 ILE N N 59 122.490 122.490 117.783 4.707 19115 491 1 3 . 1 1 59 59 ILE C C 59 175.990 175.990 177.878 -1.888 19115 492 1 3 . 1 1 59 59 ILE CA C 59 63.400 63.400 64.374 -0.973 19115 493 1 3 . 1 1 60 60 TYR N N 60 120.950 120.950 121.930 -0.980 19115 494 1 3 . 1 1 60 60 TYR C C 60 174.890 174.890 177.637 -2.747 19115 495 1 3 . 1 1 60 60 TYR CA C 60 60.000 60.000 62.534 -2.534 19115 496 1 3 . 1 1 61 61 ALA N N 61 119.910 119.910 122.357 -2.447 19115 497 1 3 . 1 1 61 61 ALA C C 61 178.130 178.130 179.206 -1.076 19115 498 1 3 . 1 1 61 61 ALA CA C 61 54.640 54.640 54.820 -0.180 19115 499 1 3 . 1 1 62 62 ILE N N 62 122.480 122.480 118.552 3.928 19115 500 1 3 . 1 1 62 62 ILE C C 62 176.210 176.210 177.026 -0.816 19115 501 1 3 . 1 1 62 62 ILE CA C 62 64.200 64.200 63.722 0.478 19115 502 1 3 . 1 1 63 63 GLN N N 63 118.550 118.550 117.694 0.856 19115 503 1 3 . 1 1 63 63 GLN C C 63 176.980 176.980 178.123 -1.143 19115 504 1 3 . 1 1 63 63 GLN CA C 63 55.740 55.740 58.297 -2.557 19115 505 1 3 . 1 1 64 64 ARG N N 64 120.750 120.750 118.532 2.218 19115 506 1 3 . 1 1 64 64 ARG C C 64 176.370 176.370 177.735 -1.365 19115 507 1 3 . 1 1 64 64 ARG CA C 64 56.660 56.660 57.983 -1.323 19115 508 1 3 . 1 1 65 65 LYS N N 65 120.970 120.970 119.389 1.581 19115 509 1 3 . 1 1 65 65 LYS C C 65 176.760 176.760 178.436 -1.676 19115 510 1 3 . 1 1 65 65 LYS CA C 65 57.100 57.100 59.899 -2.799 19115 511 1 3 . 1 1 66 66 ARG N N 66 121.030 121.030 118.205 2.825 19115 512 1 3 . 1 1 66 66 ARG C C 66 175.880 175.880 178.547 -2.667 19115 513 1 3 . 1 1 66 66 ARG CA C 66 56.300 56.300 58.758 -2.458 19115 514 1 3 . 1 1 67 67 GLN N N 67 122.080 122.080 119.787 2.293 19115 515 1 3 . 1 1 67 67 GLN C C 67 174.560 174.560 177.870 -3.310 19115 516 1 3 . 1 1 67 67 GLN CA C 67 54.940 54.940 58.668 -3.728 19115 517 1 3 . 1 1 68 68 ALA N N 68 125.730 125.730 121.856 3.874 19115 518 1 3 . 1 1 68 68 ALA C C 68 176.500 176.500 179.652 -3.152 19115 519 1 3 . 1 1 68 68 ALA CA C 68 51.180 51.180 55.328 -4.148 19115 520 1 3 . 1 1 69 69 ASP N N 69 119.350 119.350 119.202 0.148 19115 521 1 3 . 1 1 69 69 ASP C C 69 174.900 174.900 178.433 -3.533 19115 522 1 3 . 1 1 69 69 ASP CA C 69 53.150 53.150 56.863 -3.713 19115 523 1 4 . 1 1 5 5 LYS N N 5 120.900 120.900 116.145 4.755 19115 524 1 4 . 1 1 5 5 LYS C C 5 176.700 176.700 177.131 -0.431 19115 525 1 4 . 1 1 5 5 LYS CA C 5 58.780 58.780 58.416 0.364 19115 526 1 4 . 1 1 6 6 THR N N 6 121.660 121.660 112.285 9.375 19115 527 1 4 . 1 1 6 6 THR C C 6 173.630 173.630 175.686 -2.056 19115 528 1 4 . 1 1 6 6 THR CA C 6 65.620 65.620 64.537 1.083 19115 529 1 4 . 1 1 7 7 LEU N N 7 124.020 124.020 121.919 2.101 19115 530 1 4 . 1 1 7 7 LEU C C 7 176.320 176.320 178.351 -2.031 19115 531 1 4 . 1 1 7 7 LEU CA C 7 56.090 56.090 58.340 -2.251 19115 532 1 4 . 1 1 8 8 LEU N N 8 122.080 122.080 118.726 3.354 19115 533 1 4 . 1 1 8 8 LEU C C 8 175.820 175.820 178.866 -3.046 19115 534 1 4 . 1 1 8 8 LEU CA C 8 56.180 56.180 57.584 -1.404 19115 535 1 4 . 1 1 9 9 ARG N N 9 120.750 120.750 117.395 3.355 19115 536 1 4 . 1 1 9 9 ARG C C 9 176.260 176.260 178.757 -2.497 19115 537 1 4 . 1 1 9 9 ARG CA C 9 56.590 56.590 58.178 -1.588 19115 538 1 4 . 1 1 10 10 VAL N N 10 119.300 119.300 120.426 -1.126 19115 539 1 4 . 1 1 10 10 VAL C C 10 175.990 175.990 177.260 -1.270 19115 540 1 4 . 1 1 10 10 VAL CA C 10 64.090 64.090 65.433 -1.343 19115 541 1 4 . 1 1 11 11 SER N N 11 120.480 120.480 116.262 4.218 19115 542 1 4 . 1 1 11 11 SER C C 11 174.790 174.790 176.835 -2.045 19115 543 1 4 . 1 1 11 11 SER CA C 11 61.550 61.550 62.129 -0.579 19115 544 1 4 . 1 1 12 12 ILE N N 12 125.380 125.380 123.121 2.259 19115 545 1 4 . 1 1 12 12 ILE C C 12 176.980 176.980 178.137 -1.157 19115 546 1 4 . 1 1 12 12 ILE CA C 12 63.850 63.850 64.237 -0.387 19115 547 1 4 . 1 1 13 13 ILE N N 13 122.450 122.450 119.778 2.672 19115 548 1 4 . 1 1 13 13 ILE C C 13 175.220 175.220 178.461 -3.241 19115 549 1 4 . 1 1 13 13 ILE CA C 13 63.910 63.910 65.419 -1.509 19115 550 1 4 . 1 1 15 15 THR N N 15 120.570 120.570 114.620 5.950 19115 551 1 4 . 1 1 15 15 THR C C 15 174.670 174.670 176.618 -1.948 19115 552 1 4 . 1 1 15 15 THR CA C 15 66.150 66.150 66.203 -0.053 19115 553 1 4 . 1 1 16 16 THR N N 16 120.300 120.300 117.863 2.437 19115 554 1 4 . 1 1 16 16 THR C C 16 173.330 173.330 176.324 -2.994 19115 555 1 4 . 1 1 16 16 THR CA C 16 65.950 65.950 65.571 0.379 19115 556 1 4 . 1 1 17 17 LEU N N 17 123.250 123.250 122.420 0.830 19115 557 1 4 . 1 1 17 17 LEU C C 17 175.940 175.940 179.110 -3.170 19115 558 1 4 . 1 1 17 17 LEU CA C 17 56.290 56.290 58.184 -1.894 19115 559 1 4 . 1 1 18 18 VAL N N 18 120.680 120.680 118.172 2.508 19115 560 1 4 . 1 1 18 18 VAL C C 18 176.240 176.240 177.799 -1.559 19115 561 1 4 . 1 1 18 18 VAL CA C 18 64.840 64.840 66.476 -1.636 19115 562 1 4 . 1 1 19 19 ALA N N 19 120.350 120.350 122.947 -2.597 19115 563 1 4 . 1 1 19 19 ALA C C 19 177.010 177.010 179.689 -2.679 19115 564 1 4 . 1 1 19 19 ALA CA C 19 53.880 53.880 55.528 -1.648 19115 565 1 4 . 1 1 20 20 LEU N N 20 119.220 119.220 115.898 3.322 19115 566 1 4 . 1 1 20 20 LEU C C 20 177.090 177.090 179.549 -2.459 19115 567 1 4 . 1 1 20 20 LEU CA C 20 55.890 55.890 57.844 -1.954 19115 568 1 4 . 1 1 21 21 SER N N 21 116.930 116.930 116.962 -0.032 19115 569 1 4 . 1 1 21 21 SER C C 21 172.150 172.150 176.739 -4.589 19115 570 1 4 . 1 1 21 21 SER CA C 21 57.960 57.960 61.155 -3.195 19115 571 1 4 . 1 1 22 22 SER N N 22 121.910 121.910 117.769 4.141 19115 572 1 4 . 1 1 22 22 SER C C 22 172.440 172.440 175.126 -2.686 19115 573 1 4 . 1 1 22 22 SER CA C 22 59.270 59.270 61.088 -1.818 19115 574 1 4 . 1 1 23 23 PHE N N 23 120.760 120.760 121.233 -0.473 19115 575 1 4 . 1 1 23 23 PHE C C 23 175.110 175.110 176.867 -1.757 19115 576 1 4 . 1 1 23 23 PHE CA C 23 56.220 56.220 59.022 -2.802 19115 577 1 4 . 1 1 24 24 THR N N 24 119.530 119.530 116.647 2.883 19115 578 1 4 . 1 1 24 24 THR C C 24 174.140 174.140 173.811 0.329 19115 579 1 4 . 1 1 24 24 THR CA C 24 63.380 63.380 67.859 -4.479 19115 580 1 4 . 1 1 26 26 VAL N N 26 120.730 120.730 118.247 2.483 19115 581 1 4 . 1 1 26 26 VAL C C 26 175.440 175.440 177.262 -1.822 19115 582 1 4 . 1 1 26 26 VAL CA C 26 65.460 65.460 65.043 0.416 19115 583 1 4 . 1 1 27 27 LEU N N 27 120.380 120.380 120.268 0.112 19115 584 1 4 . 1 1 27 27 LEU C C 27 177.360 177.360 179.105 -1.745 19115 585 1 4 . 1 1 27 27 LEU CA C 27 56.180 56.180 57.823 -1.643 19115 586 1 4 . 1 1 28 28 VAL N N 28 120.420 120.420 119.590 0.830 19115 587 1 4 . 1 1 28 28 VAL C C 28 174.360 174.360 177.848 -3.488 19115 588 1 4 . 1 1 28 28 VAL CA C 28 66.370 66.370 66.579 -0.209 19115 589 1 4 . 1 1 29 29 ILE N N 29 121.960 121.960 119.541 2.419 19115 590 1 4 . 1 1 29 29 ILE C C 29 176.320 176.320 177.784 -1.464 19115 591 1 4 . 1 1 29 29 ILE CA C 29 63.700 63.700 65.033 -1.333 19115 592 1 4 . 1 1 30 30 LEU N N 30 122.400 122.400 120.913 1.487 19115 593 1 4 . 1 1 30 30 LEU C C 30 175.820 175.820 178.404 -2.584 19115 594 1 4 . 1 1 30 30 LEU CA C 30 56.790 56.790 58.637 -1.847 19115 595 1 4 . 1 1 31 31 LEU N N 31 118.640 118.640 118.141 0.499 19115 596 1 4 . 1 1 31 31 LEU C C 31 177.530 177.530 179.126 -1.596 19115 597 1 4 . 1 1 31 31 LEU CA C 31 56.700 56.700 58.091 -1.391 19115 598 1 4 . 1 1 33 33 VAL N N 33 123.000 123.000 123.170 -0.170 19115 599 1 4 . 1 1 33 33 VAL C C 33 174.230 174.230 178.129 -3.899 19115 600 1 4 . 1 1 33 33 VAL CA C 33 65.950 65.950 66.651 -0.701 19115 601 1 4 . 1 1 34 34 VAL N N 34 123.380 123.380 119.857 3.523 19115 602 1 4 . 1 1 34 34 VAL C C 34 176.160 176.160 178.325 -2.165 19115 603 1 4 . 1 1 34 34 VAL CA C 34 65.160 65.160 66.728 -1.567 19115 604 1 4 . 1 1 36 36 LEU N N 36 121.010 121.010 122.149 -1.139 19115 605 1 4 . 1 1 36 36 LEU C C 36 177.200 177.200 179.195 -1.995 19115 606 1 4 . 1 1 36 36 LEU CA C 36 55.890 55.890 57.613 -1.723 19115 607 1 4 . 1 1 37 37 SER N N 37 119.220 119.220 115.287 3.933 19115 608 1 4 . 1 1 37 37 SER C C 37 174.230 174.230 176.392 -2.162 19115 609 1 4 . 1 1 37 37 SER CA C 37 59.900 59.900 61.692 -1.792 19115 610 1 4 . 1 1 38 38 ALA N N 38 125.190 125.190 124.088 1.102 19115 611 1 4 . 1 1 38 38 ALA C C 38 178.020 178.020 180.036 -2.016 19115 612 1 4 . 1 1 38 38 ALA CA C 38 53.060 53.060 54.974 -1.914 19115 613 1 4 . 1 1 39 39 LEU N N 39 118.060 118.060 119.417 -1.357 19115 614 1 4 . 1 1 39 39 LEU C C 39 174.840 174.840 178.469 -3.629 19115 615 1 4 . 1 1 39 39 LEU CA C 39 55.150 55.150 57.513 -2.363 19115 616 1 4 . 1 1 40 40 THR N N 40 104.520 104.520 112.727 -8.207 19115 617 1 4 . 1 1 40 40 THR C C 40 171.370 171.370 174.773 -3.403 19115 618 1 4 . 1 1 40 40 THR CA C 40 59.980 59.980 62.266 -2.286 19115 619 1 4 . 1 1 42 42 TYR N N 42 120.780 120.780 121.651 -0.871 19115 620 1 4 . 1 1 42 42 TYR C C 42 172.920 172.920 174.954 -2.034 19115 621 1 4 . 1 1 42 42 TYR CA C 42 57.310 57.310 57.651 -0.341 19115 622 1 4 . 1 1 43 43 LEU N N 43 123.030 123.030 118.657 4.373 19115 623 1 4 . 1 1 43 43 LEU C C 43 174.780 174.780 176.403 -1.623 19115 624 1 4 . 1 1 43 43 LEU CA C 43 56.500 56.500 55.138 1.362 19115 625 1 4 . 1 1 44 44 ASP N N 44 121.320 121.320 120.920 0.400 19115 626 1 4 . 1 1 44 44 ASP C C 44 174.780 174.780 176.284 -1.504 19115 627 1 4 . 1 1 44 44 ASP CA C 44 56.500 56.500 55.535 0.965 19115 628 1 4 . 1 1 45 45 TYR N N 45 120.640 120.640 121.036 -0.396 19115 629 1 4 . 1 1 45 45 TYR C C 45 174.010 174.010 174.567 -0.557 19115 630 1 4 . 1 1 45 45 TYR CA C 45 59.780 59.780 57.678 2.102 19115 631 1 4 . 1 1 46 46 VAL N N 46 120.490 120.490 119.087 1.403 19115 632 1 4 . 1 1 46 46 VAL C C 46 173.030 173.030 176.039 -3.009 19115 633 1 4 . 1 1 46 46 VAL CA C 46 60.050 60.050 62.541 -2.491 19115 634 1 4 . 1 1 47 47 LEU N N 47 120.990 120.990 119.984 1.006 19115 635 1 4 . 1 1 47 47 LEU C C 47 176.320 176.320 179.145 -2.825 19115 636 1 4 . 1 1 47 47 LEU CA C 47 56.700 56.700 56.617 0.083 19115 637 1 4 . 1 1 48 48 LEU N N 48 122.020 122.020 120.930 1.090 19115 638 1 4 . 1 1 48 48 LEU C C 48 174.670 174.670 175.796 -1.126 19115 639 1 4 . 1 1 48 48 LEU CA C 48 57.800 57.800 60.247 -2.447 19115 640 1 4 . 1 1 50 50 ALA N N 50 119.130 119.130 119.358 -0.228 19115 641 1 4 . 1 1 50 50 ALA C C 50 177.690 177.690 179.879 -2.189 19115 642 1 4 . 1 1 50 50 ALA CA C 50 54.680 54.680 54.775 -0.095 19115 643 1 4 . 1 1 51 51 LEU N N 51 122.780 122.780 119.165 3.615 19115 644 1 4 . 1 1 51 51 LEU C C 51 176.650 176.650 178.912 -2.262 19115 645 1 4 . 1 1 51 51 LEU CA C 51 57.570 57.570 58.138 -0.568 19115 646 1 4 . 1 1 52 52 ALA N N 52 123.870 123.870 122.660 1.210 19115 647 1 4 . 1 1 52 52 ALA C C 52 178.020 178.020 180.002 -1.982 19115 648 1 4 . 1 1 52 52 ALA CA C 52 53.730 53.730 55.214 -1.484 19115 649 1 4 . 1 1 53 53 ILE N N 53 120.070 120.070 119.595 0.475 19115 650 1 4 . 1 1 53 53 ILE C C 53 176.100 176.100 178.197 -2.097 19115 651 1 4 . 1 1 53 53 ILE CA C 53 63.300 63.300 64.965 -1.665 19115 652 1 4 . 1 1 54 54 PHE N N 54 117.590 117.590 119.332 -1.742 19115 653 1 4 . 1 1 54 54 PHE C C 54 175.960 175.960 178.147 -2.187 19115 654 1 4 . 1 1 54 54 PHE CA C 54 60.210 60.210 62.451 -2.241 19115 655 1 4 . 1 1 55 55 ILE N N 55 121.880 121.880 120.103 1.777 19115 656 1 4 . 1 1 55 55 ILE C C 55 176.870 176.870 178.631 -1.761 19115 657 1 4 . 1 1 55 55 ILE CA C 55 64.700 64.700 65.353 -0.653 19115 658 1 4 . 1 1 57 57 LEU N N 57 121.970 121.970 123.152 -1.182 19115 659 1 4 . 1 1 57 57 LEU C C 57 176.050 176.050 178.381 -2.331 19115 660 1 4 . 1 1 57 57 LEU CA C 57 56.250 56.250 57.836 -1.585 19115 661 1 4 . 1 1 58 58 THR N N 58 121.370 121.370 114.276 7.094 19115 662 1 4 . 1 1 58 58 THR C C 58 173.460 173.460 177.108 -3.648 19115 663 1 4 . 1 1 58 58 THR CA C 58 66.340 66.340 65.965 0.375 19115 664 1 4 . 1 1 59 59 ILE N N 59 122.490 122.490 118.881 3.609 19115 665 1 4 . 1 1 59 59 ILE C C 59 175.990 175.990 177.490 -1.500 19115 666 1 4 . 1 1 59 59 ILE CA C 59 63.400 63.400 64.199 -0.799 19115 667 1 4 . 1 1 60 60 TYR N N 60 120.950 120.950 122.626 -1.676 19115 668 1 4 . 1 1 60 60 TYR C C 60 174.890 174.890 177.179 -2.289 19115 669 1 4 . 1 1 60 60 TYR CA C 60 60.000 60.000 60.822 -0.822 19115 670 1 4 . 1 1 61 61 ALA N N 61 119.910 119.910 121.935 -2.025 19115 671 1 4 . 1 1 61 61 ALA C C 61 178.130 178.130 179.250 -1.120 19115 672 1 4 . 1 1 61 61 ALA CA C 61 54.640 54.640 55.050 -0.410 19115 673 1 4 . 1 1 62 62 ILE N N 62 122.480 122.480 117.894 4.586 19115 674 1 4 . 1 1 62 62 ILE C C 62 176.210 176.210 177.787 -1.577 19115 675 1 4 . 1 1 62 62 ILE CA C 62 64.200 64.200 64.189 0.011 19115 676 1 4 . 1 1 63 63 GLN N N 63 118.550 118.550 117.513 1.037 19115 677 1 4 . 1 1 63 63 GLN C C 63 176.980 176.980 178.530 -1.550 19115 678 1 4 . 1 1 63 63 GLN CA C 63 55.740 55.740 58.690 -2.950 19115 679 1 4 . 1 1 64 64 ARG N N 64 120.750 120.750 118.573 2.177 19115 680 1 4 . 1 1 64 64 ARG C C 64 176.370 176.370 178.087 -1.717 19115 681 1 4 . 1 1 64 64 ARG CA C 64 56.660 56.660 58.262 -1.602 19115 682 1 4 . 1 1 65 65 LYS N N 65 120.970 120.970 119.623 1.347 19115 683 1 4 . 1 1 65 65 LYS C C 65 176.760 176.760 178.217 -1.457 19115 684 1 4 . 1 1 65 65 LYS CA C 65 57.100 57.100 59.883 -2.783 19115 685 1 4 . 1 1 66 66 ARG N N 66 121.030 121.030 117.535 3.495 19115 686 1 4 . 1 1 66 66 ARG C C 66 175.880 175.880 178.659 -2.779 19115 687 1 4 . 1 1 66 66 ARG CA C 66 56.300 56.300 58.803 -2.503 19115 688 1 4 . 1 1 67 67 GLN N N 67 122.080 122.080 119.862 2.218 19115 689 1 4 . 1 1 67 67 GLN C C 67 174.560 174.560 177.982 -3.422 19115 690 1 4 . 1 1 67 67 GLN CA C 67 54.940 54.940 58.203 -3.263 19115 691 1 4 . 1 1 68 68 ALA N N 68 125.730 125.730 123.067 2.663 19115 692 1 4 . 1 1 68 68 ALA C C 68 176.500 176.500 179.725 -3.225 19115 693 1 4 . 1 1 68 68 ALA CA C 68 51.180 51.180 55.219 -4.039 19115 694 1 4 . 1 1 69 69 ASP N N 69 119.350 119.350 118.558 0.792 19115 695 1 4 . 1 1 69 69 ASP C C 69 174.900 174.900 178.466 -3.566 19115 696 1 4 . 1 1 69 69 ASP CA C 69 53.150 53.150 57.289 -4.139 19115 697 1 5 . 1 1 5 5 LYS N N 5 120.900 120.900 117.047 3.853 19115 698 1 5 . 1 1 5 5 LYS C C 5 176.700 176.700 177.217 -0.517 19115 699 1 5 . 1 1 5 5 LYS CA C 5 58.780 58.780 58.270 0.510 19115 700 1 5 . 1 1 6 6 THR N N 6 121.660 121.660 116.198 5.462 19115 701 1 5 . 1 1 6 6 THR C C 6 173.630 173.630 176.423 -2.793 19115 702 1 5 . 1 1 6 6 THR CA C 6 65.620 65.620 65.365 0.255 19115 703 1 5 . 1 1 7 7 LEU N N 7 124.020 124.020 121.852 2.168 19115 704 1 5 . 1 1 7 7 LEU C C 7 176.320 176.320 179.405 -3.085 19115 705 1 5 . 1 1 7 7 LEU CA C 7 56.090 56.090 58.109 -2.019 19115 706 1 5 . 1 1 8 8 LEU N N 8 122.080 122.080 120.525 1.555 19115 707 1 5 . 1 1 8 8 LEU C C 8 175.820 175.820 178.092 -2.272 19115 708 1 5 . 1 1 8 8 LEU CA C 8 56.180 56.180 57.597 -1.417 19115 709 1 5 . 1 1 9 9 ARG N N 9 120.750 120.750 118.400 2.350 19115 710 1 5 . 1 1 9 9 ARG C C 9 176.260 176.260 177.972 -1.712 19115 711 1 5 . 1 1 9 9 ARG CA C 9 56.590 56.590 59.413 -2.823 19115 712 1 5 . 1 1 10 10 VAL N N 10 119.300 119.300 118.877 0.423 19115 713 1 5 . 1 1 10 10 VAL C C 10 175.990 175.990 177.950 -1.960 19115 714 1 5 . 1 1 10 10 VAL CA C 10 64.090 64.090 66.400 -2.310 19115 715 1 5 . 1 1 11 11 SER N N 11 120.480 120.480 116.162 4.318 19115 716 1 5 . 1 1 11 11 SER C C 11 174.790 174.790 176.903 -2.113 19115 717 1 5 . 1 1 11 11 SER CA C 11 61.550 61.550 61.998 -0.448 19115 718 1 5 . 1 1 12 12 ILE N N 12 125.380 125.380 124.194 1.186 19115 719 1 5 . 1 1 12 12 ILE C C 12 176.980 176.980 179.056 -2.076 19115 720 1 5 . 1 1 12 12 ILE CA C 12 63.850 63.850 64.168 -0.319 19115 721 1 5 . 1 1 13 13 ILE N N 13 122.450 122.450 120.494 1.956 19115 722 1 5 . 1 1 13 13 ILE C C 13 175.220 175.220 177.418 -2.198 19115 723 1 5 . 1 1 13 13 ILE CA C 13 63.910 63.910 63.775 0.135 19115 724 1 5 . 1 1 15 15 THR N N 15 120.570 120.570 113.456 7.114 19115 725 1 5 . 1 1 15 15 THR C C 15 174.670 174.670 176.749 -2.079 19115 726 1 5 . 1 1 15 15 THR CA C 15 66.150 66.150 65.028 1.122 19115 727 1 5 . 1 1 16 16 THR N N 16 120.300 120.300 119.382 0.918 19115 728 1 5 . 1 1 16 16 THR C C 16 173.330 173.330 176.300 -2.970 19115 729 1 5 . 1 1 16 16 THR CA C 16 65.950 65.950 67.566 -1.616 19115 730 1 5 . 1 1 17 17 LEU N N 17 123.250 123.250 119.565 3.685 19115 731 1 5 . 1 1 17 17 LEU C C 17 175.940 175.940 178.895 -2.955 19115 732 1 5 . 1 1 17 17 LEU CA C 17 56.290 56.290 58.501 -2.211 19115 733 1 5 . 1 1 18 18 VAL N N 18 120.680 120.680 119.922 0.758 19115 734 1 5 . 1 1 18 18 VAL C C 18 176.240 176.240 178.120 -1.880 19115 735 1 5 . 1 1 18 18 VAL CA C 18 64.840 64.840 66.116 -1.276 19115 736 1 5 . 1 1 19 19 ALA N N 19 120.350 120.350 123.520 -3.170 19115 737 1 5 . 1 1 19 19 ALA C C 19 177.010 177.010 181.001 -3.991 19115 738 1 5 . 1 1 19 19 ALA CA C 19 53.880 53.880 55.086 -1.206 19115 739 1 5 . 1 1 20 20 LEU N N 20 119.220 119.220 118.735 0.485 19115 740 1 5 . 1 1 20 20 LEU C C 20 177.090 177.090 179.622 -2.532 19115 741 1 5 . 1 1 20 20 LEU CA C 20 55.890 55.890 57.429 -1.539 19115 742 1 5 . 1 1 21 21 SER N N 21 116.930 116.930 115.377 1.553 19115 743 1 5 . 1 1 21 21 SER C C 21 172.150 172.150 177.000 -4.850 19115 744 1 5 . 1 1 21 21 SER CA C 21 57.960 57.960 61.428 -3.468 19115 745 1 5 . 1 1 22 22 SER N N 22 121.910 121.910 117.919 3.991 19115 746 1 5 . 1 1 22 22 SER C C 22 172.440 172.440 174.896 -2.456 19115 747 1 5 . 1 1 22 22 SER CA C 22 59.270 59.270 60.953 -1.683 19115 748 1 5 . 1 1 23 23 PHE N N 23 120.760 120.760 117.833 2.927 19115 749 1 5 . 1 1 23 23 PHE C C 23 175.110 175.110 176.444 -1.334 19115 750 1 5 . 1 1 23 23 PHE CA C 23 56.220 56.220 59.095 -2.875 19115 751 1 5 . 1 1 24 24 THR N N 24 119.530 119.530 117.251 2.279 19115 752 1 5 . 1 1 24 24 THR C C 24 174.140 174.140 173.715 0.425 19115 753 1 5 . 1 1 24 24 THR CA C 24 63.380 63.380 69.187 -5.807 19115 754 1 5 . 1 1 26 26 VAL N N 26 120.730 120.730 118.600 2.130 19115 755 1 5 . 1 1 26 26 VAL C C 26 175.440 175.440 178.493 -3.053 19115 756 1 5 . 1 1 26 26 VAL CA C 26 65.460 65.460 65.943 -0.483 19115 757 1 5 . 1 1 27 27 LEU N N 27 120.380 120.380 119.356 1.024 19115 758 1 5 . 1 1 27 27 LEU C C 27 177.360 177.360 178.710 -1.350 19115 759 1 5 . 1 1 27 27 LEU CA C 27 56.180 56.180 57.998 -1.818 19115 760 1 5 . 1 1 28 28 VAL N N 28 120.420 120.420 119.305 1.115 19115 761 1 5 . 1 1 28 28 VAL C C 28 174.360 174.360 178.729 -4.369 19115 762 1 5 . 1 1 28 28 VAL CA C 28 66.370 66.370 66.920 -0.550 19115 763 1 5 . 1 1 29 29 ILE N N 29 121.960 121.960 120.745 1.215 19115 764 1 5 . 1 1 29 29 ILE C C 29 176.320 176.320 177.179 -0.859 19115 765 1 5 . 1 1 29 29 ILE CA C 29 63.700 63.700 64.555 -0.855 19115 766 1 5 . 1 1 30 30 LEU N N 30 122.400 122.400 120.375 2.025 19115 767 1 5 . 1 1 30 30 LEU C C 30 175.820 175.820 179.036 -3.216 19115 768 1 5 . 1 1 30 30 LEU CA C 30 56.790 56.790 58.042 -1.252 19115 769 1 5 . 1 1 31 31 LEU N N 31 118.640 118.640 117.952 0.688 19115 770 1 5 . 1 1 31 31 LEU C C 31 177.530 177.530 179.271 -1.741 19115 771 1 5 . 1 1 31 31 LEU CA C 31 56.700 56.700 57.805 -1.105 19115 772 1 5 . 1 1 33 33 VAL N N 33 123.000 123.000 120.032 2.968 19115 773 1 5 . 1 1 33 33 VAL C C 33 174.230 174.230 177.792 -3.562 19115 774 1 5 . 1 1 33 33 VAL CA C 33 65.950 65.950 65.350 0.600 19115 775 1 5 . 1 1 34 34 VAL N N 34 123.380 123.380 120.059 3.321 19115 776 1 5 . 1 1 34 34 VAL C C 34 176.160 176.160 179.031 -2.871 19115 777 1 5 . 1 1 34 34 VAL CA C 34 65.160 65.160 65.818 -0.658 19115 778 1 5 . 1 1 36 36 LEU N N 36 121.010 121.010 121.778 -0.768 19115 779 1 5 . 1 1 36 36 LEU C C 36 177.200 177.200 178.473 -1.273 19115 780 1 5 . 1 1 36 36 LEU CA C 36 55.890 55.890 57.062 -1.172 19115 781 1 5 . 1 1 37 37 SER N N 37 119.220 119.220 115.574 3.646 19115 782 1 5 . 1 1 37 37 SER C C 37 174.230 174.230 176.330 -2.100 19115 783 1 5 . 1 1 37 37 SER CA C 37 59.900 59.900 61.784 -1.884 19115 784 1 5 . 1 1 38 38 ALA N N 38 125.190 125.190 124.450 0.740 19115 785 1 5 . 1 1 38 38 ALA C C 38 178.020 178.020 178.805 -0.785 19115 786 1 5 . 1 1 38 38 ALA CA C 38 53.060 53.060 54.662 -1.602 19115 787 1 5 . 1 1 39 39 LEU N N 39 118.060 118.060 116.997 1.063 19115 788 1 5 . 1 1 39 39 LEU C C 39 174.840 174.840 179.387 -4.547 19115 789 1 5 . 1 1 39 39 LEU CA C 39 55.150 55.150 57.220 -2.070 19115 790 1 5 . 1 1 40 40 THR N N 40 104.520 104.520 109.812 -5.292 19115 791 1 5 . 1 1 40 40 THR C C 40 171.370 171.370 177.182 -5.812 19115 792 1 5 . 1 1 40 40 THR CA C 40 59.980 59.980 63.580 -3.600 19115 793 1 5 . 1 1 42 42 TYR N N 42 120.780 120.780 124.650 -3.870 19115 794 1 5 . 1 1 42 42 TYR C C 42 172.920 172.920 176.382 -3.462 19115 795 1 5 . 1 1 42 42 TYR CA C 42 57.310 57.310 59.626 -2.316 19115 796 1 5 . 1 1 43 43 LEU N N 43 123.030 123.030 127.531 -4.501 19115 797 1 5 . 1 1 43 43 LEU C C 43 174.780 174.780 176.289 -1.509 19115 798 1 5 . 1 1 43 43 LEU CA C 43 56.500 56.500 54.505 1.995 19115 799 1 5 . 1 1 44 44 ASP N N 44 121.320 121.320 119.537 1.783 19115 800 1 5 . 1 1 44 44 ASP C C 44 174.780 174.780 176.958 -2.178 19115 801 1 5 . 1 1 44 44 ASP CA C 44 56.500 56.500 56.151 0.349 19115 802 1 5 . 1 1 45 45 TYR N N 45 120.640 120.640 116.753 3.887 19115 803 1 5 . 1 1 45 45 TYR C C 45 174.010 174.010 174.714 -0.704 19115 804 1 5 . 1 1 45 45 TYR CA C 45 59.780 59.780 56.732 3.048 19115 805 1 5 . 1 1 46 46 VAL N N 46 120.490 120.490 117.369 3.121 19115 806 1 5 . 1 1 46 46 VAL C C 46 173.030 173.030 175.857 -2.827 19115 807 1 5 . 1 1 46 46 VAL CA C 46 60.050 60.050 62.281 -2.231 19115 808 1 5 . 1 1 47 47 LEU N N 47 120.990 120.990 121.178 -0.188 19115 809 1 5 . 1 1 47 47 LEU C C 47 176.320 176.320 178.216 -1.896 19115 810 1 5 . 1 1 47 47 LEU CA C 47 56.700 56.700 57.163 -0.463 19115 811 1 5 . 1 1 48 48 LEU N N 48 122.020 122.020 120.253 1.767 19115 812 1 5 . 1 1 48 48 LEU C C 48 174.670 174.670 176.894 -2.224 19115 813 1 5 . 1 1 48 48 LEU CA C 48 57.800 57.800 60.186 -2.386 19115 814 1 5 . 1 1 50 50 ALA N N 50 119.130 119.130 120.842 -1.712 19115 815 1 5 . 1 1 50 50 ALA C C 50 177.690 177.690 179.493 -1.803 19115 816 1 5 . 1 1 50 50 ALA CA C 50 54.680 54.680 54.591 0.089 19115 817 1 5 . 1 1 51 51 LEU N N 51 122.780 122.780 118.907 3.873 19115 818 1 5 . 1 1 51 51 LEU C C 51 176.650 176.650 178.536 -1.886 19115 819 1 5 . 1 1 51 51 LEU CA C 51 57.570 57.570 57.138 0.432 19115 820 1 5 . 1 1 52 52 ALA N N 52 123.870 123.870 122.301 1.569 19115 821 1 5 . 1 1 52 52 ALA C C 52 178.020 178.020 179.562 -1.542 19115 822 1 5 . 1 1 52 52 ALA CA C 52 53.730 53.730 54.996 -1.266 19115 823 1 5 . 1 1 53 53 ILE N N 53 120.070 120.070 118.455 1.615 19115 824 1 5 . 1 1 53 53 ILE C C 53 176.100 176.100 177.677 -1.577 19115 825 1 5 . 1 1 53 53 ILE CA C 53 63.300 63.300 65.075 -1.775 19115 826 1 5 . 1 1 54 54 PHE N N 54 117.590 117.590 119.869 -2.279 19115 827 1 5 . 1 1 54 54 PHE C C 54 175.960 175.960 177.695 -1.735 19115 828 1 5 . 1 1 54 54 PHE CA C 54 60.210 60.210 62.212 -2.002 19115 829 1 5 . 1 1 55 55 ILE N N 55 121.880 121.880 119.200 2.680 19115 830 1 5 . 1 1 55 55 ILE C C 55 176.870 176.870 178.731 -1.861 19115 831 1 5 . 1 1 55 55 ILE CA C 55 64.700 64.700 62.651 2.049 19115 832 1 5 . 1 1 57 57 LEU N N 57 121.970 121.970 122.575 -0.605 19115 833 1 5 . 1 1 57 57 LEU C C 57 176.050 176.050 179.301 -3.251 19115 834 1 5 . 1 1 57 57 LEU CA C 57 56.250 56.250 58.270 -2.019 19115 835 1 5 . 1 1 58 58 THR N N 58 121.370 121.370 114.469 6.901 19115 836 1 5 . 1 1 58 58 THR C C 58 173.460 173.460 176.823 -3.363 19115 837 1 5 . 1 1 58 58 THR CA C 58 66.340 66.340 66.112 0.228 19115 838 1 5 . 1 1 59 59 ILE N N 59 122.490 122.490 119.056 3.434 19115 839 1 5 . 1 1 59 59 ILE C C 59 175.990 175.990 178.010 -2.020 19115 840 1 5 . 1 1 59 59 ILE CA C 59 63.400 63.400 63.937 -0.537 19115 841 1 5 . 1 1 60 60 TYR N N 60 120.950 120.950 122.408 -1.458 19115 842 1 5 . 1 1 60 60 TYR C C 60 174.890 174.890 176.619 -1.729 19115 843 1 5 . 1 1 60 60 TYR CA C 60 60.000 60.000 61.735 -1.735 19115 844 1 5 . 1 1 61 61 ALA N N 61 119.910 119.910 121.582 -1.672 19115 845 1 5 . 1 1 61 61 ALA C C 61 178.130 178.130 179.406 -1.276 19115 846 1 5 . 1 1 61 61 ALA CA C 61 54.640 54.640 54.800 -0.160 19115 847 1 5 . 1 1 62 62 ILE N N 62 122.480 122.480 117.501 4.979 19115 848 1 5 . 1 1 62 62 ILE C C 62 176.210 176.210 177.667 -1.457 19115 849 1 5 . 1 1 62 62 ILE CA C 62 64.200 64.200 63.553 0.647 19115 850 1 5 . 1 1 63 63 GLN N N 63 118.550 118.550 118.665 -0.115 19115 851 1 5 . 1 1 63 63 GLN C C 63 176.980 176.980 178.603 -1.623 19115 852 1 5 . 1 1 63 63 GLN CA C 63 55.740 55.740 58.744 -3.004 19115 853 1 5 . 1 1 64 64 ARG N N 64 120.750 120.750 117.096 3.654 19115 854 1 5 . 1 1 64 64 ARG C C 64 176.370 176.370 178.180 -1.810 19115 855 1 5 . 1 1 64 64 ARG CA C 64 56.660 56.660 56.874 -0.214 19115 856 1 5 . 1 1 65 65 LYS N N 65 120.970 120.970 120.339 0.631 19115 857 1 5 . 1 1 65 65 LYS C C 65 176.760 176.760 178.785 -2.025 19115 858 1 5 . 1 1 65 65 LYS CA C 65 57.100 57.100 59.379 -2.279 19115 859 1 5 . 1 1 66 66 ARG N N 66 121.030 121.030 117.638 3.392 19115 860 1 5 . 1 1 66 66 ARG C C 66 175.880 175.880 178.845 -2.965 19115 861 1 5 . 1 1 66 66 ARG CA C 66 56.300 56.300 58.967 -2.667 19115 862 1 5 . 1 1 67 67 GLN N N 67 122.080 122.080 119.673 2.407 19115 863 1 5 . 1 1 67 67 GLN C C 67 174.560 174.560 177.776 -3.216 19115 864 1 5 . 1 1 67 67 GLN CA C 67 54.940 54.940 58.855 -3.915 19115 865 1 5 . 1 1 68 68 ALA N N 68 125.730 125.730 121.475 4.255 19115 866 1 5 . 1 1 68 68 ALA C C 68 176.500 176.500 178.435 -1.935 19115 867 1 5 . 1 1 68 68 ALA CA C 68 51.180 51.180 55.537 -4.357 19115 868 1 5 . 1 1 69 69 ASP N N 69 119.350 119.350 117.154 2.196 19115 869 1 5 . 1 1 69 69 ASP C C 69 174.900 174.900 178.233 -3.333 19115 870 1 5 . 1 1 69 69 ASP CA C 69 53.150 53.150 56.227 -3.077 19115 871 1 6 . 1 1 5 5 LYS N N 5 120.900 120.900 117.604 3.296 19115 872 1 6 . 1 1 5 5 LYS C C 5 176.700 176.700 176.967 -0.267 19115 873 1 6 . 1 1 5 5 LYS CA C 5 58.780 58.780 58.475 0.305 19115 874 1 6 . 1 1 6 6 THR N N 6 121.660 121.660 111.023 10.637 19115 875 1 6 . 1 1 6 6 THR C C 6 173.630 173.630 175.537 -1.907 19115 876 1 6 . 1 1 6 6 THR CA C 6 65.620 65.620 63.445 2.175 19115 877 1 6 . 1 1 7 7 LEU N N 7 124.020 124.020 123.298 0.722 19115 878 1 6 . 1 1 7 7 LEU C C 7 176.320 176.320 179.004 -2.684 19115 879 1 6 . 1 1 7 7 LEU CA C 7 56.090 56.090 58.407 -2.317 19115 880 1 6 . 1 1 8 8 LEU N N 8 122.080 122.080 118.379 3.701 19115 881 1 6 . 1 1 8 8 LEU C C 8 175.820 175.820 179.489 -3.669 19115 882 1 6 . 1 1 8 8 LEU CA C 8 56.180 56.180 57.530 -1.350 19115 883 1 6 . 1 1 9 9 ARG N N 9 120.750 120.750 119.660 1.090 19115 884 1 6 . 1 1 9 9 ARG C C 9 176.260 176.260 178.524 -2.264 19115 885 1 6 . 1 1 9 9 ARG CA C 9 56.590 56.590 58.932 -2.342 19115 886 1 6 . 1 1 10 10 VAL N N 10 119.300 119.300 119.559 -0.259 19115 887 1 6 . 1 1 10 10 VAL C C 10 175.990 175.990 177.299 -1.309 19115 888 1 6 . 1 1 10 10 VAL CA C 10 64.090 64.090 65.936 -1.846 19115 889 1 6 . 1 1 11 11 SER N N 11 120.480 120.480 114.985 5.495 19115 890 1 6 . 1 1 11 11 SER C C 11 174.790 174.790 176.642 -1.852 19115 891 1 6 . 1 1 11 11 SER CA C 11 61.550 61.550 61.565 -0.015 19115 892 1 6 . 1 1 12 12 ILE N N 12 125.380 125.380 120.955 4.425 19115 893 1 6 . 1 1 12 12 ILE C C 12 176.980 176.980 178.197 -1.217 19115 894 1 6 . 1 1 12 12 ILE CA C 12 63.850 63.850 63.917 -0.067 19115 895 1 6 . 1 1 13 13 ILE N N 13 122.450 122.450 116.187 6.263 19115 896 1 6 . 1 1 13 13 ILE C C 13 175.220 175.220 178.310 -3.090 19115 897 1 6 . 1 1 13 13 ILE CA C 13 63.910 63.910 64.537 -0.627 19115 898 1 6 . 1 1 15 15 THR N N 15 120.570 120.570 117.411 3.159 19115 899 1 6 . 1 1 15 15 THR C C 15 174.670 174.670 176.292 -1.622 19115 900 1 6 . 1 1 15 15 THR CA C 15 66.150 66.150 65.754 0.396 19115 901 1 6 . 1 1 16 16 THR N N 16 120.300 120.300 116.607 3.693 19115 902 1 6 . 1 1 16 16 THR C C 16 173.330 173.330 175.666 -2.336 19115 903 1 6 . 1 1 16 16 THR CA C 16 65.950 65.950 66.203 -0.253 19115 904 1 6 . 1 1 17 17 LEU N N 17 123.250 123.250 121.941 1.309 19115 905 1 6 . 1 1 17 17 LEU C C 17 175.940 175.940 179.159 -3.219 19115 906 1 6 . 1 1 17 17 LEU CA C 17 56.290 56.290 57.821 -1.531 19115 907 1 6 . 1 1 18 18 VAL N N 18 120.680 120.680 119.016 1.664 19115 908 1 6 . 1 1 18 18 VAL C C 18 176.240 176.240 177.734 -1.494 19115 909 1 6 . 1 1 18 18 VAL CA C 18 64.840 64.840 66.398 -1.558 19115 910 1 6 . 1 1 19 19 ALA N N 19 120.350 120.350 122.760 -2.410 19115 911 1 6 . 1 1 19 19 ALA C C 19 177.010 177.010 179.852 -2.842 19115 912 1 6 . 1 1 19 19 ALA CA C 19 53.880 53.880 54.967 -1.087 19115 913 1 6 . 1 1 20 20 LEU N N 20 119.220 119.220 115.876 3.344 19115 914 1 6 . 1 1 20 20 LEU C C 20 177.090 177.090 179.168 -2.078 19115 915 1 6 . 1 1 20 20 LEU CA C 20 55.890 55.890 57.786 -1.896 19115 916 1 6 . 1 1 21 21 SER N N 21 116.930 116.930 117.319 -0.389 19115 917 1 6 . 1 1 21 21 SER C C 21 172.150 172.150 176.826 -4.676 19115 918 1 6 . 1 1 21 21 SER CA C 21 57.960 57.960 61.954 -3.994 19115 919 1 6 . 1 1 22 22 SER N N 22 121.910 121.910 117.616 4.294 19115 920 1 6 . 1 1 22 22 SER C C 22 172.440 172.440 175.503 -3.063 19115 921 1 6 . 1 1 22 22 SER CA C 22 59.270 59.270 60.811 -1.541 19115 922 1 6 . 1 1 23 23 PHE N N 23 120.760 120.760 119.357 1.403 19115 923 1 6 . 1 1 23 23 PHE C C 23 175.110 175.110 176.870 -1.760 19115 924 1 6 . 1 1 23 23 PHE CA C 23 56.220 56.220 59.041 -2.821 19115 925 1 6 . 1 1 24 24 THR N N 24 119.530 119.530 115.571 3.959 19115 926 1 6 . 1 1 24 24 THR C C 24 174.140 174.140 173.853 0.287 19115 927 1 6 . 1 1 24 24 THR CA C 24 63.380 63.380 67.416 -4.036 19115 928 1 6 . 1 1 26 26 VAL N N 26 120.730 120.730 118.119 2.611 19115 929 1 6 . 1 1 26 26 VAL C C 26 175.440 175.440 177.789 -2.349 19115 930 1 6 . 1 1 26 26 VAL CA C 26 65.460 65.460 66.207 -0.747 19115 931 1 6 . 1 1 27 27 LEU N N 27 120.380 120.380 119.367 1.013 19115 932 1 6 . 1 1 27 27 LEU C C 27 177.360 177.360 178.629 -1.269 19115 933 1 6 . 1 1 27 27 LEU CA C 27 56.180 56.180 57.636 -1.456 19115 934 1 6 . 1 1 28 28 VAL N N 28 120.420 120.420 119.266 1.154 19115 935 1 6 . 1 1 28 28 VAL C C 28 174.360 174.360 177.997 -3.637 19115 936 1 6 . 1 1 28 28 VAL CA C 28 66.370 66.370 67.063 -0.693 19115 937 1 6 . 1 1 29 29 ILE N N 29 121.960 121.960 118.889 3.071 19115 938 1 6 . 1 1 29 29 ILE C C 29 176.320 176.320 177.087 -0.767 19115 939 1 6 . 1 1 29 29 ILE CA C 29 63.700 63.700 64.179 -0.479 19115 940 1 6 . 1 1 30 30 LEU N N 30 122.400 122.400 121.132 1.268 19115 941 1 6 . 1 1 30 30 LEU C C 30 175.820 175.820 178.737 -2.917 19115 942 1 6 . 1 1 30 30 LEU CA C 30 56.790 56.790 58.049 -1.259 19115 943 1 6 . 1 1 31 31 LEU N N 31 118.640 118.640 118.433 0.207 19115 944 1 6 . 1 1 31 31 LEU C C 31 177.530 177.530 179.229 -1.699 19115 945 1 6 . 1 1 31 31 LEU CA C 31 56.700 56.700 58.249 -1.549 19115 946 1 6 . 1 1 33 33 VAL N N 33 123.000 123.000 120.318 2.682 19115 947 1 6 . 1 1 33 33 VAL C C 33 174.230 174.230 177.793 -3.563 19115 948 1 6 . 1 1 33 33 VAL CA C 33 65.950 65.950 65.119 0.831 19115 949 1 6 . 1 1 34 34 VAL N N 34 123.380 123.380 119.647 3.733 19115 950 1 6 . 1 1 34 34 VAL C C 34 176.160 176.160 178.572 -2.412 19115 951 1 6 . 1 1 34 34 VAL CA C 34 65.160 65.160 65.848 -0.688 19115 952 1 6 . 1 1 36 36 LEU N N 36 121.010 121.010 121.338 -0.328 19115 953 1 6 . 1 1 36 36 LEU C C 36 177.200 177.200 178.299 -1.099 19115 954 1 6 . 1 1 36 36 LEU CA C 36 55.890 55.890 57.094 -1.204 19115 955 1 6 . 1 1 37 37 SER N N 37 119.220 119.220 116.064 3.156 19115 956 1 6 . 1 1 37 37 SER C C 37 174.230 174.230 176.489 -2.259 19115 957 1 6 . 1 1 37 37 SER CA C 37 59.900 59.900 61.350 -1.450 19115 958 1 6 . 1 1 38 38 ALA N N 38 125.190 125.190 125.146 0.044 19115 959 1 6 . 1 1 38 38 ALA C C 38 178.020 178.020 179.151 -1.131 19115 960 1 6 . 1 1 38 38 ALA CA C 38 53.060 53.060 54.728 -1.669 19115 961 1 6 . 1 1 39 39 LEU N N 39 118.060 118.060 117.318 0.742 19115 962 1 6 . 1 1 39 39 LEU C C 39 174.840 174.840 179.146 -4.306 19115 963 1 6 . 1 1 39 39 LEU CA C 39 55.150 55.150 57.148 -1.998 19115 964 1 6 . 1 1 40 40 THR N N 40 104.520 104.520 111.373 -6.853 19115 965 1 6 . 1 1 40 40 THR C C 40 171.370 171.370 175.637 -4.267 19115 966 1 6 . 1 1 40 40 THR CA C 40 59.980 59.980 63.271 -3.291 19115 967 1 6 . 1 1 42 42 TYR N N 42 120.780 120.780 116.925 3.855 19115 968 1 6 . 1 1 42 42 TYR C C 42 172.920 172.920 174.792 -1.872 19115 969 1 6 . 1 1 42 42 TYR CA C 42 57.310 57.310 54.346 2.964 19115 970 1 6 . 1 1 43 43 LEU N N 43 123.030 123.030 122.079 0.951 19115 971 1 6 . 1 1 43 43 LEU C C 43 174.780 174.780 177.026 -2.246 19115 972 1 6 . 1 1 43 43 LEU CA C 43 56.500 56.500 55.739 0.761 19115 973 1 6 . 1 1 44 44 ASP N N 44 121.320 121.320 119.688 1.632 19115 974 1 6 . 1 1 44 44 ASP C C 44 174.780 174.780 177.151 -2.371 19115 975 1 6 . 1 1 44 44 ASP CA C 44 56.500 56.500 56.712 -0.212 19115 976 1 6 . 1 1 45 45 TYR N N 45 120.640 120.640 118.564 2.076 19115 977 1 6 . 1 1 45 45 TYR C C 45 174.010 174.010 175.391 -1.381 19115 978 1 6 . 1 1 45 45 TYR CA C 45 59.780 59.780 58.427 1.353 19115 979 1 6 . 1 1 46 46 VAL N N 46 120.490 120.490 116.465 4.025 19115 980 1 6 . 1 1 46 46 VAL C C 46 173.030 173.030 175.680 -2.650 19115 981 1 6 . 1 1 46 46 VAL CA C 46 60.050 60.050 62.519 -2.469 19115 982 1 6 . 1 1 47 47 LEU N N 47 120.990 120.990 122.740 -1.750 19115 983 1 6 . 1 1 47 47 LEU C C 47 176.320 176.320 177.530 -1.210 19115 984 1 6 . 1 1 47 47 LEU CA C 47 56.700 56.700 57.953 -1.253 19115 985 1 6 . 1 1 48 48 LEU N N 48 122.020 122.020 119.918 2.102 19115 986 1 6 . 1 1 48 48 LEU C C 48 174.670 174.670 176.402 -1.732 19115 987 1 6 . 1 1 48 48 LEU CA C 48 57.800 57.800 59.426 -1.626 19115 988 1 6 . 1 1 50 50 ALA N N 50 119.130 119.130 119.970 -0.840 19115 989 1 6 . 1 1 50 50 ALA C C 50 177.690 177.690 179.630 -1.940 19115 990 1 6 . 1 1 50 50 ALA CA C 50 54.680 54.680 54.774 -0.094 19115 991 1 6 . 1 1 51 51 LEU N N 51 122.780 122.780 119.670 3.110 19115 992 1 6 . 1 1 51 51 LEU C C 51 176.650 176.650 178.386 -1.736 19115 993 1 6 . 1 1 51 51 LEU CA C 51 57.570 57.570 57.633 -0.063 19115 994 1 6 . 1 1 52 52 ALA N N 52 123.870 123.870 122.157 1.713 19115 995 1 6 . 1 1 52 52 ALA C C 52 178.020 178.020 179.485 -1.465 19115 996 1 6 . 1 1 52 52 ALA CA C 52 53.730 53.730 55.351 -1.621 19115 997 1 6 . 1 1 53 53 ILE N N 53 120.070 120.070 119.519 0.551 19115 998 1 6 . 1 1 53 53 ILE C C 53 176.100 176.100 177.833 -1.733 19115 999 1 6 . 1 1 53 53 ILE CA C 53 63.300 63.300 63.957 -0.657 19115 1000 1 6 . 1 1 54 54 PHE N N 54 117.590 117.590 118.766 -1.176 19115 1001 1 6 . 1 1 54 54 PHE C C 54 175.960 175.960 178.156 -2.196 19115 1002 1 6 . 1 1 54 54 PHE CA C 54 60.210 60.210 62.426 -2.216 19115 1003 1 6 . 1 1 55 55 ILE N N 55 121.880 121.880 119.254 2.626 19115 1004 1 6 . 1 1 55 55 ILE C C 55 176.870 176.870 178.484 -1.614 19115 1005 1 6 . 1 1 55 55 ILE CA C 55 64.700 64.700 64.228 0.472 19115 1006 1 6 . 1 1 57 57 LEU N N 57 121.970 121.970 122.017 -0.047 19115 1007 1 6 . 1 1 57 57 LEU C C 57 176.050 176.050 178.602 -2.552 19115 1008 1 6 . 1 1 57 57 LEU CA C 57 56.250 56.250 57.825 -1.575 19115 1009 1 6 . 1 1 58 58 THR N N 58 121.370 121.370 115.468 5.902 19115 1010 1 6 . 1 1 58 58 THR C C 58 173.460 173.460 177.244 -3.784 19115 1011 1 6 . 1 1 58 58 THR CA C 58 66.340 66.340 67.485 -1.145 19115 1012 1 6 . 1 1 59 59 ILE N N 59 122.490 122.490 122.492 -0.002 19115 1013 1 6 . 1 1 59 59 ILE C C 59 175.990 175.990 176.987 -0.997 19115 1014 1 6 . 1 1 59 59 ILE CA C 59 63.400 63.400 63.845 -0.445 19115 1015 1 6 . 1 1 60 60 TYR N N 60 120.950 120.950 120.498 0.452 19115 1016 1 6 . 1 1 60 60 TYR C C 60 174.890 174.890 177.339 -2.449 19115 1017 1 6 . 1 1 60 60 TYR CA C 60 60.000 60.000 61.784 -1.784 19115 1018 1 6 . 1 1 61 61 ALA N N 61 119.910 119.910 122.429 -2.519 19115 1019 1 6 . 1 1 61 61 ALA C C 61 178.130 178.130 179.121 -0.991 19115 1020 1 6 . 1 1 61 61 ALA CA C 61 54.640 54.640 55.250 -0.610 19115 1021 1 6 . 1 1 62 62 ILE N N 62 122.480 122.480 117.933 4.547 19115 1022 1 6 . 1 1 62 62 ILE C C 62 176.210 176.210 178.220 -2.010 19115 1023 1 6 . 1 1 62 62 ILE CA C 62 64.200 64.200 63.490 0.709 19115 1024 1 6 . 1 1 63 63 GLN N N 63 118.550 118.550 118.690 -0.140 19115 1025 1 6 . 1 1 63 63 GLN C C 63 176.980 176.980 178.533 -1.553 19115 1026 1 6 . 1 1 63 63 GLN CA C 63 55.740 55.740 58.915 -3.175 19115 1027 1 6 . 1 1 64 64 ARG N N 64 120.750 120.750 119.325 1.425 19115 1028 1 6 . 1 1 64 64 ARG C C 64 176.370 176.370 178.145 -1.775 19115 1029 1 6 . 1 1 64 64 ARG CA C 64 56.660 56.660 58.310 -1.650 19115 1030 1 6 . 1 1 65 65 LYS N N 65 120.970 120.970 119.403 1.567 19115 1031 1 6 . 1 1 65 65 LYS C C 65 176.760 176.760 178.924 -2.164 19115 1032 1 6 . 1 1 65 65 LYS CA C 65 57.100 57.100 59.906 -2.806 19115 1033 1 6 . 1 1 66 66 ARG N N 66 121.030 121.030 117.495 3.535 19115 1034 1 6 . 1 1 66 66 ARG C C 66 175.880 175.880 179.035 -3.155 19115 1035 1 6 . 1 1 66 66 ARG CA C 66 56.300 56.300 59.172 -2.872 19115 1036 1 6 . 1 1 67 67 GLN N N 67 122.080 122.080 119.134 2.946 19115 1037 1 6 . 1 1 67 67 GLN C C 67 174.560 174.560 178.256 -3.696 19115 1038 1 6 . 1 1 67 67 GLN CA C 67 54.940 54.940 58.531 -3.591 19115 1039 1 6 . 1 1 68 68 ALA N N 68 125.730 125.730 122.593 3.137 19115 1040 1 6 . 1 1 68 68 ALA C C 68 176.500 176.500 179.361 -2.861 19115 1041 1 6 . 1 1 68 68 ALA CA C 68 51.180 51.180 55.505 -4.325 19115 1042 1 6 . 1 1 69 69 ASP N N 69 119.350 119.350 119.828 -0.478 19115 1043 1 6 . 1 1 69 69 ASP C C 69 174.900 174.900 178.574 -3.674 19115 1044 1 6 . 1 1 69 69 ASP CA C 69 53.150 53.150 57.350 -4.200 19115 1045 1 7 . 1 1 5 5 LYS N N 5 120.900 120.900 122.484 -1.584 19115 1046 1 7 . 1 1 5 5 LYS C C 5 176.700 176.700 176.736 -0.036 19115 1047 1 7 . 1 1 5 5 LYS CA C 5 58.780 58.780 58.565 0.215 19115 1048 1 7 . 1 1 6 6 THR N N 6 121.660 121.660 111.736 9.924 19115 1049 1 7 . 1 1 6 6 THR C C 6 173.630 173.630 175.704 -2.074 19115 1050 1 7 . 1 1 6 6 THR CA C 6 65.620 65.620 62.950 2.670 19115 1051 1 7 . 1 1 7 7 LEU N N 7 124.020 124.020 120.870 3.150 19115 1052 1 7 . 1 1 7 7 LEU C C 7 176.320 176.320 178.553 -2.233 19115 1053 1 7 . 1 1 7 7 LEU CA C 7 56.090 56.090 57.243 -1.153 19115 1054 1 7 . 1 1 8 8 LEU N N 8 122.080 122.080 119.510 2.570 19115 1055 1 7 . 1 1 8 8 LEU C C 8 175.820 175.820 179.031 -3.211 19115 1056 1 7 . 1 1 8 8 LEU CA C 8 56.180 56.180 57.102 -0.923 19115 1057 1 7 . 1 1 9 9 ARG N N 9 120.750 120.750 118.345 2.405 19115 1058 1 7 . 1 1 9 9 ARG C C 9 176.260 176.260 178.546 -2.286 19115 1059 1 7 . 1 1 9 9 ARG CA C 9 56.590 56.590 58.279 -1.689 19115 1060 1 7 . 1 1 10 10 VAL N N 10 119.300 119.300 121.049 -1.749 19115 1061 1 7 . 1 1 10 10 VAL C C 10 175.990 175.990 177.383 -1.393 19115 1062 1 7 . 1 1 10 10 VAL CA C 10 64.090 64.090 65.608 -1.518 19115 1063 1 7 . 1 1 11 11 SER N N 11 120.480 120.480 115.795 4.685 19115 1064 1 7 . 1 1 11 11 SER C C 11 174.790 174.790 177.363 -2.573 19115 1065 1 7 . 1 1 11 11 SER CA C 11 61.550 61.550 62.439 -0.889 19115 1066 1 7 . 1 1 12 12 ILE N N 12 125.380 125.380 122.360 3.020 19115 1067 1 7 . 1 1 12 12 ILE C C 12 176.980 176.980 178.421 -1.441 19115 1068 1 7 . 1 1 12 12 ILE CA C 12 63.850 63.850 64.724 -0.874 19115 1069 1 7 . 1 1 13 13 ILE N N 13 122.450 122.450 120.065 2.385 19115 1070 1 7 . 1 1 13 13 ILE C C 13 175.220 175.220 178.421 -3.201 19115 1071 1 7 . 1 1 13 13 ILE CA C 13 63.910 63.910 65.186 -1.276 19115 1072 1 7 . 1 1 15 15 THR N N 15 120.570 120.570 113.483 7.087 19115 1073 1 7 . 1 1 15 15 THR C C 15 174.670 174.670 176.760 -2.090 19115 1074 1 7 . 1 1 15 15 THR CA C 15 66.150 66.150 65.671 0.479 19115 1075 1 7 . 1 1 16 16 THR N N 16 120.300 120.300 119.107 1.193 19115 1076 1 7 . 1 1 16 16 THR C C 16 173.330 173.330 175.984 -2.654 19115 1077 1 7 . 1 1 16 16 THR CA C 16 65.950 65.950 66.067 -0.117 19115 1078 1 7 . 1 1 17 17 LEU N N 17 123.250 123.250 123.140 0.110 19115 1079 1 7 . 1 1 17 17 LEU C C 17 175.940 175.940 177.761 -1.821 19115 1080 1 7 . 1 1 17 17 LEU CA C 17 56.290 56.290 58.303 -2.013 19115 1081 1 7 . 1 1 18 18 VAL N N 18 120.680 120.680 114.265 6.415 19115 1082 1 7 . 1 1 18 18 VAL C C 18 176.240 176.240 177.639 -1.399 19115 1083 1 7 . 1 1 18 18 VAL CA C 18 64.840 64.840 65.495 -0.655 19115 1084 1 7 . 1 1 19 19 ALA N N 19 120.350 120.350 123.494 -3.144 19115 1085 1 7 . 1 1 19 19 ALA C C 19 177.010 177.010 180.249 -3.239 19115 1086 1 7 . 1 1 19 19 ALA CA C 19 53.880 53.880 55.153 -1.273 19115 1087 1 7 . 1 1 20 20 LEU N N 20 119.220 119.220 117.971 1.249 19115 1088 1 7 . 1 1 20 20 LEU C C 20 177.090 177.090 179.673 -2.583 19115 1089 1 7 . 1 1 20 20 LEU CA C 20 55.890 55.890 57.234 -1.344 19115 1090 1 7 . 1 1 21 21 SER N N 21 116.930 116.930 115.515 1.415 19115 1091 1 7 . 1 1 21 21 SER C C 21 172.150 172.150 176.702 -4.552 19115 1092 1 7 . 1 1 21 21 SER CA C 21 57.960 57.960 61.413 -3.454 19115 1093 1 7 . 1 1 22 22 SER N N 22 121.910 121.910 117.461 4.449 19115 1094 1 7 . 1 1 22 22 SER C C 22 172.440 172.440 175.169 -2.729 19115 1095 1 7 . 1 1 22 22 SER CA C 22 59.270 59.270 60.760 -1.490 19115 1096 1 7 . 1 1 23 23 PHE N N 23 120.760 120.760 119.941 0.819 19115 1097 1 7 . 1 1 23 23 PHE C C 23 175.110 175.110 177.169 -2.059 19115 1098 1 7 . 1 1 23 23 PHE CA C 23 56.220 56.220 59.770 -3.550 19115 1099 1 7 . 1 1 24 24 THR N N 24 119.530 119.530 116.727 2.803 19115 1100 1 7 . 1 1 24 24 THR C C 24 174.140 174.140 173.787 0.353 19115 1101 1 7 . 1 1 24 24 THR CA C 24 63.380 63.380 67.661 -4.281 19115 1102 1 7 . 1 1 26 26 VAL N N 26 120.730 120.730 114.436 6.294 19115 1103 1 7 . 1 1 26 26 VAL C C 26 175.440 175.440 177.486 -2.046 19115 1104 1 7 . 1 1 26 26 VAL CA C 26 65.460 65.460 65.655 -0.195 19115 1105 1 7 . 1 1 27 27 LEU N N 27 120.380 120.380 121.656 -1.276 19115 1106 1 7 . 1 1 27 27 LEU C C 27 177.360 177.360 179.409 -2.049 19115 1107 1 7 . 1 1 27 27 LEU CA C 27 56.180 56.180 57.539 -1.359 19115 1108 1 7 . 1 1 28 28 VAL N N 28 120.420 120.420 118.970 1.450 19115 1109 1 7 . 1 1 28 28 VAL C C 28 174.360 174.360 177.371 -3.011 19115 1110 1 7 . 1 1 28 28 VAL CA C 28 66.370 66.370 66.508 -0.138 19115 1111 1 7 . 1 1 29 29 ILE N N 29 121.960 121.960 120.154 1.806 19115 1112 1 7 . 1 1 29 29 ILE C C 29 176.320 176.320 177.192 -0.872 19115 1113 1 7 . 1 1 29 29 ILE CA C 29 63.700 63.700 64.709 -1.009 19115 1114 1 7 . 1 1 30 30 LEU N N 30 122.400 122.400 119.174 3.226 19115 1115 1 7 . 1 1 30 30 LEU C C 30 175.820 175.820 179.141 -3.321 19115 1116 1 7 . 1 1 30 30 LEU CA C 30 56.790 56.790 58.079 -1.289 19115 1117 1 7 . 1 1 31 31 LEU N N 31 118.640 118.640 119.955 -1.315 19115 1118 1 7 . 1 1 31 31 LEU C C 31 177.530 177.530 178.970 -1.440 19115 1119 1 7 . 1 1 31 31 LEU CA C 31 56.700 56.700 57.878 -1.178 19115 1120 1 7 . 1 1 33 33 VAL N N 33 123.000 123.000 122.397 0.603 19115 1121 1 7 . 1 1 33 33 VAL C C 33 174.230 174.230 177.870 -3.640 19115 1122 1 7 . 1 1 33 33 VAL CA C 33 65.950 65.950 65.953 -0.003 19115 1123 1 7 . 1 1 34 34 VAL N N 34 123.380 123.380 118.459 4.921 19115 1124 1 7 . 1 1 34 34 VAL C C 34 176.160 176.160 178.122 -1.962 19115 1125 1 7 . 1 1 34 34 VAL CA C 34 65.160 65.160 66.421 -1.261 19115 1126 1 7 . 1 1 36 36 LEU N N 36 121.010 121.010 120.848 0.162 19115 1127 1 7 . 1 1 36 36 LEU C C 36 177.200 177.200 178.332 -1.132 19115 1128 1 7 . 1 1 36 36 LEU CA C 36 55.890 55.890 57.362 -1.472 19115 1129 1 7 . 1 1 37 37 SER N N 37 119.220 119.220 115.081 4.139 19115 1130 1 7 . 1 1 37 37 SER C C 37 174.230 174.230 176.705 -2.475 19115 1131 1 7 . 1 1 37 37 SER CA C 37 59.900 59.900 61.101 -1.201 19115 1132 1 7 . 1 1 38 38 ALA N N 38 125.190 125.190 125.193 -0.003 19115 1133 1 7 . 1 1 38 38 ALA C C 38 178.020 178.020 179.096 -1.076 19115 1134 1 7 . 1 1 38 38 ALA CA C 38 53.060 53.060 54.832 -1.772 19115 1135 1 7 . 1 1 39 39 LEU N N 39 118.060 118.060 117.468 0.592 19115 1136 1 7 . 1 1 39 39 LEU C C 39 174.840 174.840 179.093 -4.253 19115 1137 1 7 . 1 1 39 39 LEU CA C 39 55.150 55.150 57.506 -2.356 19115 1138 1 7 . 1 1 40 40 THR N N 40 104.520 104.520 108.351 -3.831 19115 1139 1 7 . 1 1 40 40 THR C C 40 171.370 171.370 176.083 -4.713 19115 1140 1 7 . 1 1 40 40 THR CA C 40 59.980 59.980 62.455 -2.475 19115 1141 1 7 . 1 1 42 42 TYR N N 42 120.780 120.780 117.296 3.484 19115 1142 1 7 . 1 1 42 42 TYR C C 42 172.920 172.920 174.758 -1.838 19115 1143 1 7 . 1 1 42 42 TYR CA C 42 57.310 57.310 54.452 2.858 19115 1144 1 7 . 1 1 43 43 LEU N N 43 123.030 123.030 117.852 5.178 19115 1145 1 7 . 1 1 43 43 LEU C C 43 174.780 174.780 176.790 -2.010 19115 1146 1 7 . 1 1 43 43 LEU CA C 43 56.500 56.500 54.779 1.721 19115 1147 1 7 . 1 1 44 44 ASP N N 44 121.320 121.320 121.856 -0.536 19115 1148 1 7 . 1 1 44 44 ASP C C 44 174.780 174.780 176.656 -1.876 19115 1149 1 7 . 1 1 44 44 ASP CA C 44 56.500 56.500 56.196 0.304 19115 1150 1 7 . 1 1 45 45 TYR N N 45 120.640 120.640 118.813 1.827 19115 1151 1 7 . 1 1 45 45 TYR C C 45 174.010 174.010 175.427 -1.417 19115 1152 1 7 . 1 1 45 45 TYR CA C 45 59.780 59.780 57.930 1.850 19115 1153 1 7 . 1 1 46 46 VAL N N 46 120.490 120.490 113.493 6.997 19115 1154 1 7 . 1 1 46 46 VAL C C 46 173.030 173.030 176.110 -3.080 19115 1155 1 7 . 1 1 46 46 VAL CA C 46 60.050 60.050 62.220 -2.170 19115 1156 1 7 . 1 1 47 47 LEU N N 47 120.990 120.990 118.037 2.953 19115 1157 1 7 . 1 1 47 47 LEU C C 47 176.320 176.320 178.186 -1.866 19115 1158 1 7 . 1 1 47 47 LEU CA C 47 56.700 56.700 57.427 -0.727 19115 1159 1 7 . 1 1 48 48 LEU N N 48 122.020 122.020 121.424 0.596 19115 1160 1 7 . 1 1 48 48 LEU C C 48 174.670 174.670 176.532 -1.862 19115 1161 1 7 . 1 1 48 48 LEU CA C 48 57.800 57.800 58.662 -0.862 19115 1162 1 7 . 1 1 50 50 ALA N N 50 119.130 119.130 120.811 -1.681 19115 1163 1 7 . 1 1 50 50 ALA C C 50 177.690 177.690 179.083 -1.393 19115 1164 1 7 . 1 1 50 50 ALA CA C 50 54.680 54.680 54.514 0.166 19115 1165 1 7 . 1 1 51 51 LEU N N 51 122.780 122.780 120.207 2.573 19115 1166 1 7 . 1 1 51 51 LEU C C 51 176.650 176.650 178.105 -1.455 19115 1167 1 7 . 1 1 51 51 LEU CA C 51 57.570 57.570 57.281 0.289 19115 1168 1 7 . 1 1 52 52 ALA N N 52 123.870 123.870 122.548 1.322 19115 1169 1 7 . 1 1 52 52 ALA C C 52 178.020 178.020 179.675 -1.655 19115 1170 1 7 . 1 1 52 52 ALA CA C 52 53.730 53.730 55.014 -1.284 19115 1171 1 7 . 1 1 53 53 ILE N N 53 120.070 120.070 118.621 1.449 19115 1172 1 7 . 1 1 53 53 ILE C C 53 176.100 176.100 177.315 -1.215 19115 1173 1 7 . 1 1 53 53 ILE CA C 53 63.300 63.300 64.580 -1.280 19115 1174 1 7 . 1 1 54 54 PHE N N 54 117.590 117.590 119.260 -1.670 19115 1175 1 7 . 1 1 54 54 PHE C C 54 175.960 175.960 178.202 -2.242 19115 1176 1 7 . 1 1 54 54 PHE CA C 54 60.210 60.210 62.627 -2.417 19115 1177 1 7 . 1 1 55 55 ILE N N 55 121.880 121.880 120.039 1.841 19115 1178 1 7 . 1 1 55 55 ILE C C 55 176.870 176.870 178.624 -1.754 19115 1179 1 7 . 1 1 55 55 ILE CA C 55 64.700 64.700 65.339 -0.639 19115 1180 1 7 . 1 1 57 57 LEU N N 57 121.970 121.970 122.543 -0.573 19115 1181 1 7 . 1 1 57 57 LEU C C 57 176.050 176.050 178.446 -2.396 19115 1182 1 7 . 1 1 57 57 LEU CA C 57 56.250 56.250 57.518 -1.268 19115 1183 1 7 . 1 1 58 58 THR N N 58 121.370 121.370 113.690 7.680 19115 1184 1 7 . 1 1 58 58 THR C C 58 173.460 173.460 177.268 -3.808 19115 1185 1 7 . 1 1 58 58 THR CA C 58 66.340 66.340 65.897 0.443 19115 1186 1 7 . 1 1 59 59 ILE N N 59 122.490 122.490 123.232 -0.742 19115 1187 1 7 . 1 1 59 59 ILE C C 59 175.990 175.990 177.153 -1.163 19115 1188 1 7 . 1 1 59 59 ILE CA C 59 63.400 63.400 63.846 -0.446 19115 1189 1 7 . 1 1 60 60 TYR N N 60 120.950 120.950 121.249 -0.299 19115 1190 1 7 . 1 1 60 60 TYR C C 60 174.890 174.890 176.692 -1.802 19115 1191 1 7 . 1 1 60 60 TYR CA C 60 60.000 60.000 60.861 -0.861 19115 1192 1 7 . 1 1 61 61 ALA N N 61 119.910 119.910 121.829 -1.919 19115 1193 1 7 . 1 1 61 61 ALA C C 61 178.130 178.130 179.099 -0.969 19115 1194 1 7 . 1 1 61 61 ALA CA C 61 54.640 54.640 54.273 0.367 19115 1195 1 7 . 1 1 62 62 ILE N N 62 122.480 122.480 118.452 4.028 19115 1196 1 7 . 1 1 62 62 ILE C C 62 176.210 176.210 177.204 -0.994 19115 1197 1 7 . 1 1 62 62 ILE CA C 62 64.200 64.200 63.831 0.369 19115 1198 1 7 . 1 1 63 63 GLN N N 63 118.550 118.550 119.170 -0.620 19115 1199 1 7 . 1 1 63 63 GLN C C 63 176.980 176.980 178.217 -1.237 19115 1200 1 7 . 1 1 63 63 GLN CA C 63 55.740 55.740 58.428 -2.688 19115 1201 1 7 . 1 1 64 64 ARG N N 64 120.750 120.750 119.358 1.392 19115 1202 1 7 . 1 1 64 64 ARG C C 64 176.370 176.370 178.160 -1.790 19115 1203 1 7 . 1 1 64 64 ARG CA C 64 56.660 56.660 58.162 -1.502 19115 1204 1 7 . 1 1 65 65 LYS N N 65 120.970 120.970 119.654 1.316 19115 1205 1 7 . 1 1 65 65 LYS C C 65 176.760 176.760 178.725 -1.965 19115 1206 1 7 . 1 1 65 65 LYS CA C 65 57.100 57.100 59.632 -2.532 19115 1207 1 7 . 1 1 66 66 ARG N N 66 121.030 121.030 117.859 3.171 19115 1208 1 7 . 1 1 66 66 ARG C C 66 175.880 175.880 178.670 -2.790 19115 1209 1 7 . 1 1 66 66 ARG CA C 66 56.300 56.300 58.348 -2.048 19115 1210 1 7 . 1 1 67 67 GLN N N 67 122.080 122.080 119.945 2.135 19115 1211 1 7 . 1 1 67 67 GLN C C 67 174.560 174.560 177.530 -2.970 19115 1212 1 7 . 1 1 67 67 GLN CA C 67 54.940 54.940 58.901 -3.961 19115 1213 1 7 . 1 1 68 68 ALA N N 68 125.730 125.730 121.629 4.101 19115 1214 1 7 . 1 1 68 68 ALA C C 68 176.500 176.500 179.330 -2.830 19115 1215 1 7 . 1 1 68 68 ALA CA C 68 51.180 51.180 55.128 -3.948 19115 1216 1 7 . 1 1 69 69 ASP N N 69 119.350 119.350 118.660 0.690 19115 1217 1 7 . 1 1 69 69 ASP C C 69 174.900 174.900 177.694 -2.794 19115 1218 1 7 . 1 1 69 69 ASP CA C 69 53.150 53.150 56.673 -3.523 19115 1219 1 8 . 1 1 5 5 LYS N N 5 120.900 120.900 111.953 8.947 19115 1220 1 8 . 1 1 5 5 LYS C C 5 176.700 176.700 176.954 -0.254 19115 1221 1 8 . 1 1 5 5 LYS CA C 5 58.780 58.780 58.096 0.684 19115 1222 1 8 . 1 1 6 6 THR N N 6 121.660 121.660 110.383 11.277 19115 1223 1 8 . 1 1 6 6 THR C C 6 173.630 173.630 175.312 -1.682 19115 1224 1 8 . 1 1 6 6 THR CA C 6 65.620 65.620 62.780 2.840 19115 1225 1 8 . 1 1 7 7 LEU N N 7 124.020 124.020 123.684 0.336 19115 1226 1 8 . 1 1 7 7 LEU C C 7 176.320 176.320 178.453 -2.133 19115 1227 1 8 . 1 1 7 7 LEU CA C 7 56.090 56.090 57.324 -1.234 19115 1228 1 8 . 1 1 8 8 LEU N N 8 122.080 122.080 119.008 3.072 19115 1229 1 8 . 1 1 8 8 LEU C C 8 175.820 175.820 178.757 -2.937 19115 1230 1 8 . 1 1 8 8 LEU CA C 8 56.180 56.180 57.324 -1.144 19115 1231 1 8 . 1 1 9 9 ARG N N 9 120.750 120.750 118.634 2.116 19115 1232 1 8 . 1 1 9 9 ARG C C 9 176.260 176.260 177.622 -1.362 19115 1233 1 8 . 1 1 9 9 ARG CA C 9 56.590 56.590 58.329 -1.739 19115 1234 1 8 . 1 1 10 10 VAL N N 10 119.300 119.300 119.179 0.121 19115 1235 1 8 . 1 1 10 10 VAL C C 10 175.990 175.990 177.338 -1.348 19115 1236 1 8 . 1 1 10 10 VAL CA C 10 64.090 64.090 66.552 -2.462 19115 1237 1 8 . 1 1 11 11 SER N N 11 120.480 120.480 115.922 4.558 19115 1238 1 8 . 1 1 11 11 SER C C 11 174.790 174.790 176.572 -1.782 19115 1239 1 8 . 1 1 11 11 SER CA C 11 61.550 61.550 61.935 -0.385 19115 1240 1 8 . 1 1 12 12 ILE N N 12 125.380 125.380 122.030 3.350 19115 1241 1 8 . 1 1 12 12 ILE C C 12 176.980 176.980 177.957 -0.977 19115 1242 1 8 . 1 1 12 12 ILE CA C 12 63.850 63.850 64.564 -0.714 19115 1243 1 8 . 1 1 13 13 ILE N N 13 122.450 122.450 120.044 2.406 19115 1244 1 8 . 1 1 13 13 ILE C C 13 175.220 175.220 178.594 -3.374 19115 1245 1 8 . 1 1 13 13 ILE CA C 13 63.910 63.910 65.131 -1.221 19115 1246 1 8 . 1 1 15 15 THR N N 15 120.570 120.570 117.198 3.372 19115 1247 1 8 . 1 1 15 15 THR C C 15 174.670 174.670 176.444 -1.774 19115 1248 1 8 . 1 1 15 15 THR CA C 15 66.150 66.150 66.295 -0.145 19115 1249 1 8 . 1 1 16 16 THR N N 16 120.300 120.300 118.401 1.899 19115 1250 1 8 . 1 1 16 16 THR C C 16 173.330 173.330 176.084 -2.754 19115 1251 1 8 . 1 1 16 16 THR CA C 16 65.950 65.950 67.030 -1.080 19115 1252 1 8 . 1 1 17 17 LEU N N 17 123.250 123.250 121.858 1.392 19115 1253 1 8 . 1 1 17 17 LEU C C 17 175.940 175.940 178.956 -3.016 19115 1254 1 8 . 1 1 17 17 LEU CA C 17 56.290 56.290 58.146 -1.856 19115 1255 1 8 . 1 1 18 18 VAL N N 18 120.680 120.680 119.081 1.599 19115 1256 1 8 . 1 1 18 18 VAL C C 18 176.240 176.240 178.165 -1.925 19115 1257 1 8 . 1 1 18 18 VAL CA C 18 64.840 64.840 66.197 -1.357 19115 1258 1 8 . 1 1 19 19 ALA N N 19 120.350 120.350 122.381 -2.031 19115 1259 1 8 . 1 1 19 19 ALA C C 19 177.010 177.010 180.611 -3.601 19115 1260 1 8 . 1 1 19 19 ALA CA C 19 53.880 53.880 55.196 -1.316 19115 1261 1 8 . 1 1 20 20 LEU N N 20 119.220 119.220 119.524 -0.304 19115 1262 1 8 . 1 1 20 20 LEU C C 20 177.090 177.090 179.315 -2.225 19115 1263 1 8 . 1 1 20 20 LEU CA C 20 55.890 55.890 57.376 -1.486 19115 1264 1 8 . 1 1 21 21 SER N N 21 116.930 116.930 113.050 3.880 19115 1265 1 8 . 1 1 21 21 SER C C 21 172.150 172.150 175.368 -3.218 19115 1266 1 8 . 1 1 21 21 SER CA C 21 57.960 57.960 60.747 -2.787 19115 1267 1 8 . 1 1 22 22 SER N N 22 121.910 121.910 114.864 7.046 19115 1268 1 8 . 1 1 22 22 SER C C 22 172.440 172.440 174.629 -2.189 19115 1269 1 8 . 1 1 22 22 SER CA C 22 59.270 59.270 60.340 -1.070 19115 1270 1 8 . 1 1 23 23 PHE N N 23 120.760 120.760 117.719 3.041 19115 1271 1 8 . 1 1 23 23 PHE C C 23 175.110 175.110 176.528 -1.418 19115 1272 1 8 . 1 1 23 23 PHE CA C 23 56.220 56.220 59.290 -3.070 19115 1273 1 8 . 1 1 24 24 THR N N 24 119.530 119.530 117.263 2.267 19115 1274 1 8 . 1 1 24 24 THR C C 24 174.140 174.140 173.618 0.522 19115 1275 1 8 . 1 1 24 24 THR CA C 24 63.380 63.380 69.407 -6.027 19115 1276 1 8 . 1 1 26 26 VAL N N 26 120.730 120.730 118.364 2.366 19115 1277 1 8 . 1 1 26 26 VAL C C 26 175.440 175.440 178.592 -3.152 19115 1278 1 8 . 1 1 26 26 VAL CA C 26 65.460 65.460 66.388 -0.927 19115 1279 1 8 . 1 1 27 27 LEU N N 27 120.380 120.380 119.166 1.214 19115 1280 1 8 . 1 1 27 27 LEU C C 27 177.360 177.360 179.524 -2.164 19115 1281 1 8 . 1 1 27 27 LEU CA C 27 56.180 56.180 57.569 -1.389 19115 1282 1 8 . 1 1 28 28 VAL N N 28 120.420 120.420 119.180 1.240 19115 1283 1 8 . 1 1 28 28 VAL C C 28 174.360 174.360 178.748 -4.388 19115 1284 1 8 . 1 1 28 28 VAL CA C 28 66.370 66.370 66.686 -0.316 19115 1285 1 8 . 1 1 29 29 ILE N N 29 121.960 121.960 120.212 1.748 19115 1286 1 8 . 1 1 29 29 ILE C C 29 176.320 176.320 177.577 -1.257 19115 1287 1 8 . 1 1 29 29 ILE CA C 29 63.700 63.700 65.059 -1.359 19115 1288 1 8 . 1 1 30 30 LEU N N 30 122.400 122.400 120.692 1.708 19115 1289 1 8 . 1 1 30 30 LEU C C 30 175.820 175.820 178.327 -2.507 19115 1290 1 8 . 1 1 30 30 LEU CA C 30 56.790 56.790 58.171 -1.381 19115 1291 1 8 . 1 1 31 31 LEU N N 31 118.640 118.640 116.140 2.500 19115 1292 1 8 . 1 1 31 31 LEU C C 31 177.530 177.530 178.804 -1.274 19115 1293 1 8 . 1 1 31 31 LEU CA C 31 56.700 56.700 57.627 -0.927 19115 1294 1 8 . 1 1 33 33 VAL N N 33 123.000 123.000 122.287 0.713 19115 1295 1 8 . 1 1 33 33 VAL C C 33 174.230 174.230 178.290 -4.060 19115 1296 1 8 . 1 1 33 33 VAL CA C 33 65.950 65.950 65.826 0.124 19115 1297 1 8 . 1 1 34 34 VAL N N 34 123.380 123.380 116.603 6.777 19115 1298 1 8 . 1 1 34 34 VAL C C 34 176.160 176.160 177.760 -1.600 19115 1299 1 8 . 1 1 34 34 VAL CA C 34 65.160 65.160 65.888 -0.728 19115 1300 1 8 . 1 1 36 36 LEU N N 36 121.010 121.010 120.179 0.831 19115 1301 1 8 . 1 1 36 36 LEU C C 36 177.200 177.200 178.178 -0.978 19115 1302 1 8 . 1 1 36 36 LEU CA C 36 55.890 55.890 57.230 -1.340 19115 1303 1 8 . 1 1 37 37 SER N N 37 119.220 119.220 115.086 4.134 19115 1304 1 8 . 1 1 37 37 SER C C 37 174.230 174.230 176.182 -1.952 19115 1305 1 8 . 1 1 37 37 SER CA C 37 59.900 59.900 61.447 -1.547 19115 1306 1 8 . 1 1 38 38 ALA N N 38 125.190 125.190 123.201 1.989 19115 1307 1 8 . 1 1 38 38 ALA C C 38 178.020 178.020 179.233 -1.213 19115 1308 1 8 . 1 1 38 38 ALA CA C 38 53.060 53.060 54.617 -1.556 19115 1309 1 8 . 1 1 39 39 LEU N N 39 118.060 118.060 115.743 2.317 19115 1310 1 8 . 1 1 39 39 LEU C C 39 174.840 174.840 178.914 -4.074 19115 1311 1 8 . 1 1 39 39 LEU CA C 39 55.150 55.150 57.218 -2.067 19115 1312 1 8 . 1 1 40 40 THR N N 40 104.520 104.520 114.440 -9.920 19115 1313 1 8 . 1 1 40 40 THR C C 40 171.370 171.370 176.030 -4.660 19115 1314 1 8 . 1 1 40 40 THR CA C 40 59.980 59.980 63.906 -3.926 19115 1315 1 8 . 1 1 42 42 TYR N N 42 120.780 120.780 118.997 1.783 19115 1316 1 8 . 1 1 42 42 TYR C C 42 172.920 172.920 174.605 -1.685 19115 1317 1 8 . 1 1 42 42 TYR CA C 42 57.310 57.310 55.886 1.424 19115 1318 1 8 . 1 1 43 43 LEU N N 43 123.030 123.030 126.070 -3.040 19115 1319 1 8 . 1 1 43 43 LEU C C 43 174.780 174.780 177.484 -2.704 19115 1320 1 8 . 1 1 43 43 LEU CA C 43 56.500 56.500 55.546 0.954 19115 1321 1 8 . 1 1 44 44 ASP N N 44 121.320 121.320 121.298 0.022 19115 1322 1 8 . 1 1 44 44 ASP C C 44 174.780 174.780 176.909 -2.129 19115 1323 1 8 . 1 1 44 44 ASP CA C 44 56.500 56.500 56.684 -0.184 19115 1324 1 8 . 1 1 45 45 TYR N N 45 120.640 120.640 120.485 0.155 19115 1325 1 8 . 1 1 45 45 TYR C C 45 174.010 174.010 174.621 -0.611 19115 1326 1 8 . 1 1 45 45 TYR CA C 45 59.780 59.780 57.342 2.438 19115 1327 1 8 . 1 1 46 46 VAL N N 46 120.490 120.490 119.213 1.277 19115 1328 1 8 . 1 1 46 46 VAL C C 46 173.030 173.030 175.859 -2.829 19115 1329 1 8 . 1 1 46 46 VAL CA C 46 60.050 60.050 62.697 -2.647 19115 1330 1 8 . 1 1 47 47 LEU N N 47 120.990 120.990 120.879 0.111 19115 1331 1 8 . 1 1 47 47 LEU C C 47 176.320 176.320 178.191 -1.871 19115 1332 1 8 . 1 1 47 47 LEU CA C 47 56.700 56.700 57.286 -0.586 19115 1333 1 8 . 1 1 48 48 LEU N N 48 122.020 122.020 120.661 1.359 19115 1334 1 8 . 1 1 48 48 LEU C C 48 174.670 174.670 176.534 -1.864 19115 1335 1 8 . 1 1 48 48 LEU CA C 48 57.800 57.800 59.933 -2.133 19115 1336 1 8 . 1 1 50 50 ALA N N 50 119.130 119.130 122.109 -2.979 19115 1337 1 8 . 1 1 50 50 ALA C C 50 177.690 177.690 179.239 -1.549 19115 1338 1 8 . 1 1 50 50 ALA CA C 50 54.680 54.680 54.815 -0.135 19115 1339 1 8 . 1 1 51 51 LEU N N 51 122.780 122.780 119.810 2.970 19115 1340 1 8 . 1 1 51 51 LEU C C 51 176.650 176.650 178.157 -1.507 19115 1341 1 8 . 1 1 51 51 LEU CA C 51 57.570 57.570 57.200 0.370 19115 1342 1 8 . 1 1 52 52 ALA N N 52 123.870 123.870 122.330 1.540 19115 1343 1 8 . 1 1 52 52 ALA C C 52 178.020 178.020 179.754 -1.734 19115 1344 1 8 . 1 1 52 52 ALA CA C 52 53.730 53.730 55.193 -1.463 19115 1345 1 8 . 1 1 53 53 ILE N N 53 120.070 120.070 115.346 4.724 19115 1346 1 8 . 1 1 53 53 ILE C C 53 176.100 176.100 177.558 -1.458 19115 1347 1 8 . 1 1 53 53 ILE CA C 53 63.300 63.300 64.551 -1.251 19115 1348 1 8 . 1 1 54 54 PHE N N 54 117.590 117.590 119.881 -2.291 19115 1349 1 8 . 1 1 54 54 PHE C C 54 175.960 175.960 178.066 -2.106 19115 1350 1 8 . 1 1 54 54 PHE CA C 54 60.210 60.210 62.380 -2.170 19115 1351 1 8 . 1 1 55 55 ILE N N 55 121.880 121.880 119.133 2.747 19115 1352 1 8 . 1 1 55 55 ILE C C 55 176.870 176.870 178.497 -1.627 19115 1353 1 8 . 1 1 55 55 ILE CA C 55 64.700 64.700 64.085 0.615 19115 1354 1 8 . 1 1 57 57 LEU N N 57 121.970 121.970 121.337 0.633 19115 1355 1 8 . 1 1 57 57 LEU C C 57 176.050 176.050 178.183 -2.133 19115 1356 1 8 . 1 1 57 57 LEU CA C 57 56.250 56.250 57.680 -1.430 19115 1357 1 8 . 1 1 58 58 THR N N 58 121.370 121.370 114.261 7.109 19115 1358 1 8 . 1 1 58 58 THR C C 58 173.460 173.460 176.835 -3.375 19115 1359 1 8 . 1 1 58 58 THR CA C 58 66.340 66.340 65.794 0.546 19115 1360 1 8 . 1 1 59 59 ILE N N 59 122.490 122.490 122.138 0.352 19115 1361 1 8 . 1 1 59 59 ILE C C 59 175.990 175.990 176.839 -0.849 19115 1362 1 8 . 1 1 59 59 ILE CA C 59 63.400 63.400 64.142 -0.743 19115 1363 1 8 . 1 1 60 60 TYR N N 60 120.950 120.950 121.041 -0.091 19115 1364 1 8 . 1 1 60 60 TYR C C 60 174.890 174.890 176.792 -1.902 19115 1365 1 8 . 1 1 60 60 TYR CA C 60 60.000 60.000 62.304 -2.304 19115 1366 1 8 . 1 1 61 61 ALA N N 61 119.910 119.910 121.060 -1.150 19115 1367 1 8 . 1 1 61 61 ALA C C 61 178.130 178.130 179.647 -1.517 19115 1368 1 8 . 1 1 61 61 ALA CA C 61 54.640 54.640 54.842 -0.202 19115 1369 1 8 . 1 1 62 62 ILE N N 62 122.480 122.480 118.635 3.845 19115 1370 1 8 . 1 1 62 62 ILE C C 62 176.210 176.210 178.331 -2.121 19115 1371 1 8 . 1 1 62 62 ILE CA C 62 64.200 64.200 65.295 -1.095 19115 1372 1 8 . 1 1 63 63 GLN N N 63 118.550 118.550 117.942 0.608 19115 1373 1 8 . 1 1 63 63 GLN C C 63 176.980 176.980 178.790 -1.810 19115 1374 1 8 . 1 1 63 63 GLN CA C 63 55.740 55.740 58.747 -3.007 19115 1375 1 8 . 1 1 64 64 ARG N N 64 120.750 120.750 118.965 1.785 19115 1376 1 8 . 1 1 64 64 ARG C C 64 176.370 176.370 178.083 -1.713 19115 1377 1 8 . 1 1 64 64 ARG CA C 64 56.660 56.660 56.885 -0.225 19115 1378 1 8 . 1 1 65 65 LYS N N 65 120.970 120.970 120.479 0.491 19115 1379 1 8 . 1 1 65 65 LYS C C 65 176.760 176.760 178.710 -1.950 19115 1380 1 8 . 1 1 65 65 LYS CA C 65 57.100 57.100 59.855 -2.755 19115 1381 1 8 . 1 1 66 66 ARG N N 66 121.030 121.030 118.106 2.924 19115 1382 1 8 . 1 1 66 66 ARG C C 66 175.880 175.880 178.383 -2.503 19115 1383 1 8 . 1 1 66 66 ARG CA C 66 56.300 56.300 58.995 -2.695 19115 1384 1 8 . 1 1 67 67 GLN N N 67 122.080 122.080 119.675 2.405 19115 1385 1 8 . 1 1 67 67 GLN C C 67 174.560 174.560 177.894 -3.334 19115 1386 1 8 . 1 1 67 67 GLN CA C 67 54.940 54.940 58.789 -3.849 19115 1387 1 8 . 1 1 68 68 ALA N N 68 125.730 125.730 121.771 3.959 19115 1388 1 8 . 1 1 68 68 ALA C C 68 176.500 176.500 179.390 -2.890 19115 1389 1 8 . 1 1 68 68 ALA CA C 68 51.180 51.180 55.681 -4.501 19115 1390 1 8 . 1 1 69 69 ASP N N 69 119.350 119.350 119.552 -0.202 19115 1391 1 8 . 1 1 69 69 ASP C C 69 174.900 174.900 178.065 -3.165 19115 1392 1 8 . 1 1 69 69 ASP CA C 69 53.150 53.150 57.199 -4.049 19115 1393 1 9 . 1 1 5 5 LYS N N 5 120.900 120.900 115.513 5.387 19115 1394 1 9 . 1 1 5 5 LYS C C 5 176.700 176.700 177.133 -0.433 19115 1395 1 9 . 1 1 5 5 LYS CA C 5 58.780 58.780 58.372 0.408 19115 1396 1 9 . 1 1 6 6 THR N N 6 121.660 121.660 112.677 8.983 19115 1397 1 9 . 1 1 6 6 THR C C 6 173.630 173.630 175.263 -1.633 19115 1398 1 9 . 1 1 6 6 THR CA C 6 65.620 65.620 63.743 1.877 19115 1399 1 9 . 1 1 7 7 LEU N N 7 124.020 124.020 123.773 0.247 19115 1400 1 9 . 1 1 7 7 LEU C C 7 176.320 176.320 177.982 -1.662 19115 1401 1 9 . 1 1 7 7 LEU CA C 7 56.090 56.090 58.656 -2.566 19115 1402 1 9 . 1 1 8 8 LEU N N 8 122.080 122.080 117.522 4.558 19115 1403 1 9 . 1 1 8 8 LEU C C 8 175.820 175.820 179.109 -3.289 19115 1404 1 9 . 1 1 8 8 LEU CA C 8 56.180 56.180 57.071 -0.891 19115 1405 1 9 . 1 1 9 9 ARG N N 9 120.750 120.750 120.187 0.563 19115 1406 1 9 . 1 1 9 9 ARG C C 9 176.260 176.260 178.376 -2.116 19115 1407 1 9 . 1 1 9 9 ARG CA C 9 56.590 56.590 59.096 -2.506 19115 1408 1 9 . 1 1 10 10 VAL N N 10 119.300 119.300 119.483 -0.183 19115 1409 1 9 . 1 1 10 10 VAL C C 10 175.990 175.990 177.872 -1.882 19115 1410 1 9 . 1 1 10 10 VAL CA C 10 64.090 64.090 66.481 -2.391 19115 1411 1 9 . 1 1 11 11 SER N N 11 120.480 120.480 115.658 4.822 19115 1412 1 9 . 1 1 11 11 SER C C 11 174.790 174.790 177.148 -2.358 19115 1413 1 9 . 1 1 11 11 SER CA C 11 61.550 61.550 62.023 -0.473 19115 1414 1 9 . 1 1 12 12 ILE N N 12 125.380 125.380 122.200 3.180 19115 1415 1 9 . 1 1 12 12 ILE C C 12 176.980 176.980 177.902 -0.922 19115 1416 1 9 . 1 1 12 12 ILE CA C 12 63.850 63.850 64.943 -1.093 19115 1417 1 9 . 1 1 13 13 ILE N N 13 122.450 122.450 120.301 2.149 19115 1418 1 9 . 1 1 13 13 ILE C C 13 175.220 175.220 178.261 -3.041 19115 1419 1 9 . 1 1 13 13 ILE CA C 13 63.910 63.910 65.089 -1.179 19115 1420 1 9 . 1 1 15 15 THR N N 15 120.570 120.570 118.243 2.327 19115 1421 1 9 . 1 1 15 15 THR C C 15 174.670 174.670 176.759 -2.089 19115 1422 1 9 . 1 1 15 15 THR CA C 15 66.150 66.150 66.710 -0.560 19115 1423 1 9 . 1 1 16 16 THR N N 16 120.300 120.300 119.418 0.882 19115 1424 1 9 . 1 1 16 16 THR C C 16 173.330 173.330 175.731 -2.401 19115 1425 1 9 . 1 1 16 16 THR CA C 16 65.950 65.950 66.585 -0.635 19115 1426 1 9 . 1 1 17 17 LEU N N 17 123.250 123.250 122.653 0.597 19115 1427 1 9 . 1 1 17 17 LEU C C 17 175.940 175.940 177.863 -1.923 19115 1428 1 9 . 1 1 17 17 LEU CA C 17 56.290 56.290 58.176 -1.886 19115 1429 1 9 . 1 1 18 18 VAL N N 18 120.680 120.680 118.052 2.628 19115 1430 1 9 . 1 1 18 18 VAL C C 18 176.240 176.240 176.940 -0.700 19115 1431 1 9 . 1 1 18 18 VAL CA C 18 64.840 64.840 65.369 -0.529 19115 1432 1 9 . 1 1 19 19 ALA N N 19 120.350 120.350 123.180 -2.830 19115 1433 1 9 . 1 1 19 19 ALA C C 19 177.010 177.010 180.635 -3.625 19115 1434 1 9 . 1 1 19 19 ALA CA C 19 53.880 53.880 54.998 -1.118 19115 1435 1 9 . 1 1 20 20 LEU N N 20 119.220 119.220 119.643 -0.423 19115 1436 1 9 . 1 1 20 20 LEU C C 20 177.090 177.090 179.254 -2.164 19115 1437 1 9 . 1 1 20 20 LEU CA C 20 55.890 55.890 58.218 -2.328 19115 1438 1 9 . 1 1 21 21 SER N N 21 116.930 116.930 113.052 3.878 19115 1439 1 9 . 1 1 21 21 SER C C 21 172.150 172.150 175.555 -3.405 19115 1440 1 9 . 1 1 21 21 SER CA C 21 57.960 57.960 61.330 -3.370 19115 1441 1 9 . 1 1 22 22 SER N N 22 121.910 121.910 115.351 6.559 19115 1442 1 9 . 1 1 22 22 SER C C 22 172.440 172.440 174.821 -2.381 19115 1443 1 9 . 1 1 22 22 SER CA C 22 59.270 59.270 60.645 -1.375 19115 1444 1 9 . 1 1 23 23 PHE N N 23 120.760 120.760 118.762 1.998 19115 1445 1 9 . 1 1 23 23 PHE C C 23 175.110 175.110 177.160 -2.050 19115 1446 1 9 . 1 1 23 23 PHE CA C 23 56.220 56.220 59.029 -2.809 19115 1447 1 9 . 1 1 24 24 THR N N 24 119.530 119.530 117.185 2.345 19115 1448 1 9 . 1 1 24 24 THR C C 24 174.140 174.140 173.752 0.388 19115 1449 1 9 . 1 1 24 24 THR CA C 24 63.380 63.380 68.394 -5.014 19115 1450 1 9 . 1 1 26 26 VAL N N 26 120.730 120.730 115.724 5.006 19115 1451 1 9 . 1 1 26 26 VAL C C 26 175.440 175.440 177.953 -2.513 19115 1452 1 9 . 1 1 26 26 VAL CA C 26 65.460 65.460 66.179 -0.719 19115 1453 1 9 . 1 1 27 27 LEU N N 27 120.380 120.380 120.631 -0.251 19115 1454 1 9 . 1 1 27 27 LEU C C 27 177.360 177.360 179.262 -1.902 19115 1455 1 9 . 1 1 27 27 LEU CA C 27 56.180 56.180 57.692 -1.512 19115 1456 1 9 . 1 1 28 28 VAL N N 28 120.420 120.420 119.225 1.195 19115 1457 1 9 . 1 1 28 28 VAL C C 28 174.360 174.360 178.259 -3.899 19115 1458 1 9 . 1 1 28 28 VAL CA C 28 66.370 66.370 66.530 -0.160 19115 1459 1 9 . 1 1 29 29 ILE N N 29 121.960 121.960 119.956 2.004 19115 1460 1 9 . 1 1 29 29 ILE C C 29 176.320 176.320 177.185 -0.865 19115 1461 1 9 . 1 1 29 29 ILE CA C 29 63.700 63.700 64.325 -0.625 19115 1462 1 9 . 1 1 30 30 LEU N N 30 122.400 122.400 120.510 1.890 19115 1463 1 9 . 1 1 30 30 LEU C C 30 175.820 175.820 178.221 -2.401 19115 1464 1 9 . 1 1 30 30 LEU CA C 30 56.790 56.790 58.450 -1.659 19115 1465 1 9 . 1 1 31 31 LEU N N 31 118.640 118.640 118.738 -0.098 19115 1466 1 9 . 1 1 31 31 LEU C C 31 177.530 177.530 179.241 -1.711 19115 1467 1 9 . 1 1 31 31 LEU CA C 31 56.700 56.700 58.674 -1.974 19115 1468 1 9 . 1 1 33 33 VAL N N 33 123.000 123.000 123.463 -0.463 19115 1469 1 9 . 1 1 33 33 VAL C C 33 174.230 174.230 178.071 -3.841 19115 1470 1 9 . 1 1 33 33 VAL CA C 33 65.950 65.950 66.406 -0.456 19115 1471 1 9 . 1 1 34 34 VAL N N 34 123.380 123.380 119.663 3.717 19115 1472 1 9 . 1 1 34 34 VAL C C 34 176.160 176.160 177.882 -1.722 19115 1473 1 9 . 1 1 34 34 VAL CA C 34 65.160 65.160 65.504 -0.344 19115 1474 1 9 . 1 1 36 36 LEU N N 36 121.010 121.010 122.039 -1.029 19115 1475 1 9 . 1 1 36 36 LEU C C 36 177.200 177.200 178.875 -1.675 19115 1476 1 9 . 1 1 36 36 LEU CA C 36 55.890 55.890 57.487 -1.597 19115 1477 1 9 . 1 1 37 37 SER N N 37 119.220 119.220 116.057 3.163 19115 1478 1 9 . 1 1 37 37 SER C C 37 174.230 174.230 176.464 -2.234 19115 1479 1 9 . 1 1 37 37 SER CA C 37 59.900 59.900 61.540 -1.640 19115 1480 1 9 . 1 1 38 38 ALA N N 38 125.190 125.190 125.148 0.042 19115 1481 1 9 . 1 1 38 38 ALA C C 38 178.020 178.020 178.656 -0.636 19115 1482 1 9 . 1 1 38 38 ALA CA C 38 53.060 53.060 54.580 -1.520 19115 1483 1 9 . 1 1 39 39 LEU N N 39 118.060 118.060 116.706 1.354 19115 1484 1 9 . 1 1 39 39 LEU C C 39 174.840 174.840 178.988 -4.148 19115 1485 1 9 . 1 1 39 39 LEU CA C 39 55.150 55.150 56.927 -1.777 19115 1486 1 9 . 1 1 40 40 THR N N 40 104.520 104.520 111.332 -6.812 19115 1487 1 9 . 1 1 40 40 THR C C 40 171.370 171.370 174.989 -3.619 19115 1488 1 9 . 1 1 40 40 THR CA C 40 59.980 59.980 62.380 -2.400 19115 1489 1 9 . 1 1 42 42 TYR N N 42 120.780 120.780 117.822 2.958 19115 1490 1 9 . 1 1 42 42 TYR C C 42 172.920 172.920 177.133 -4.213 19115 1491 1 9 . 1 1 42 42 TYR CA C 42 57.310 57.310 58.001 -0.691 19115 1492 1 9 . 1 1 43 43 LEU N N 43 123.030 123.030 119.813 3.217 19115 1493 1 9 . 1 1 43 43 LEU C C 43 174.780 174.780 177.380 -2.600 19115 1494 1 9 . 1 1 43 43 LEU CA C 43 56.500 56.500 56.031 0.469 19115 1495 1 9 . 1 1 44 44 ASP N N 44 121.320 121.320 121.731 -0.411 19115 1496 1 9 . 1 1 44 44 ASP C C 44 174.780 174.780 177.151 -2.371 19115 1497 1 9 . 1 1 44 44 ASP CA C 44 56.500 56.500 56.571 -0.070 19115 1498 1 9 . 1 1 45 45 TYR N N 45 120.640 120.640 121.403 -0.763 19115 1499 1 9 . 1 1 45 45 TYR C C 45 174.010 174.010 174.808 -0.798 19115 1500 1 9 . 1 1 45 45 TYR CA C 45 59.780 59.780 57.637 2.143 19115 1501 1 9 . 1 1 46 46 VAL N N 46 120.490 120.490 118.480 2.010 19115 1502 1 9 . 1 1 46 46 VAL C C 46 173.030 173.030 175.801 -2.771 19115 1503 1 9 . 1 1 46 46 VAL CA C 46 60.050 60.050 62.474 -2.424 19115 1504 1 9 . 1 1 47 47 LEU N N 47 120.990 120.990 121.387 -0.397 19115 1505 1 9 . 1 1 47 47 LEU C C 47 176.320 176.320 178.051 -1.731 19115 1506 1 9 . 1 1 47 47 LEU CA C 47 56.700 56.700 57.553 -0.853 19115 1507 1 9 . 1 1 48 48 LEU N N 48 122.020 122.020 119.826 2.194 19115 1508 1 9 . 1 1 48 48 LEU C C 48 174.670 174.670 176.822 -2.152 19115 1509 1 9 . 1 1 48 48 LEU CA C 48 57.800 57.800 59.438 -1.638 19115 1510 1 9 . 1 1 50 50 ALA N N 50 119.130 119.130 121.482 -2.352 19115 1511 1 9 . 1 1 50 50 ALA C C 50 177.690 177.690 179.149 -1.459 19115 1512 1 9 . 1 1 50 50 ALA CA C 50 54.680 54.680 54.761 -0.081 19115 1513 1 9 . 1 1 51 51 LEU N N 51 122.780 122.780 118.925 3.855 19115 1514 1 9 . 1 1 51 51 LEU C C 51 176.650 176.650 178.765 -2.115 19115 1515 1 9 . 1 1 51 51 LEU CA C 51 57.570 57.570 56.874 0.696 19115 1516 1 9 . 1 1 52 52 ALA N N 52 123.870 123.870 122.788 1.082 19115 1517 1 9 . 1 1 52 52 ALA C C 52 178.020 178.020 179.654 -1.634 19115 1518 1 9 . 1 1 52 52 ALA CA C 52 53.730 53.730 55.002 -1.272 19115 1519 1 9 . 1 1 53 53 ILE N N 53 120.070 120.070 119.327 0.743 19115 1520 1 9 . 1 1 53 53 ILE C C 53 176.100 176.100 177.019 -0.919 19115 1521 1 9 . 1 1 53 53 ILE CA C 53 63.300 63.300 64.877 -1.577 19115 1522 1 9 . 1 1 54 54 PHE N N 54 117.590 117.590 120.537 -2.947 19115 1523 1 9 . 1 1 54 54 PHE C C 54 175.960 175.960 177.413 -1.453 19115 1524 1 9 . 1 1 54 54 PHE CA C 54 60.210 60.210 61.391 -1.181 19115 1525 1 9 . 1 1 55 55 ILE N N 55 121.880 121.880 118.404 3.476 19115 1526 1 9 . 1 1 55 55 ILE C C 55 176.870 176.870 178.500 -1.630 19115 1527 1 9 . 1 1 55 55 ILE CA C 55 64.700 64.700 62.612 2.087 19115 1528 1 9 . 1 1 57 57 LEU N N 57 121.970 121.970 122.276 -0.306 19115 1529 1 9 . 1 1 57 57 LEU C C 57 176.050 176.050 178.103 -2.053 19115 1530 1 9 . 1 1 57 57 LEU CA C 57 56.250 56.250 57.582 -1.332 19115 1531 1 9 . 1 1 58 58 THR N N 58 121.370 121.370 114.937 6.433 19115 1532 1 9 . 1 1 58 58 THR C C 58 173.460 173.460 176.576 -3.116 19115 1533 1 9 . 1 1 58 58 THR CA C 58 66.340 66.340 66.822 -0.482 19115 1534 1 9 . 1 1 59 59 ILE N N 59 122.490 122.490 121.558 0.932 19115 1535 1 9 . 1 1 59 59 ILE C C 59 175.990 175.990 177.167 -1.177 19115 1536 1 9 . 1 1 59 59 ILE CA C 59 63.400 63.400 64.550 -1.151 19115 1537 1 9 . 1 1 60 60 TYR N N 60 120.950 120.950 120.322 0.628 19115 1538 1 9 . 1 1 60 60 TYR C C 60 174.890 174.890 176.406 -1.516 19115 1539 1 9 . 1 1 60 60 TYR CA C 60 60.000 60.000 62.115 -2.115 19115 1540 1 9 . 1 1 61 61 ALA N N 61 119.910 119.910 121.313 -1.403 19115 1541 1 9 . 1 1 61 61 ALA C C 61 178.130 178.130 179.485 -1.355 19115 1542 1 9 . 1 1 61 61 ALA CA C 61 54.640 54.640 54.730 -0.090 19115 1543 1 9 . 1 1 62 62 ILE N N 62 122.480 122.480 119.324 3.156 19115 1544 1 9 . 1 1 62 62 ILE C C 62 176.210 176.210 178.298 -2.088 19115 1545 1 9 . 1 1 62 62 ILE CA C 62 64.200 64.200 64.144 0.056 19115 1546 1 9 . 1 1 63 63 GLN N N 63 118.550 118.550 117.808 0.742 19115 1547 1 9 . 1 1 63 63 GLN C C 63 176.980 176.980 178.698 -1.718 19115 1548 1 9 . 1 1 63 63 GLN CA C 63 55.740 55.740 58.637 -2.897 19115 1549 1 9 . 1 1 64 64 ARG N N 64 120.750 120.750 117.739 3.011 19115 1550 1 9 . 1 1 64 64 ARG C C 64 176.370 176.370 178.265 -1.895 19115 1551 1 9 . 1 1 64 64 ARG CA C 64 56.660 56.660 56.773 -0.113 19115 1552 1 9 . 1 1 65 65 LYS N N 65 120.970 120.970 119.918 1.052 19115 1553 1 9 . 1 1 65 65 LYS C C 65 176.760 176.760 178.713 -1.953 19115 1554 1 9 . 1 1 65 65 LYS CA C 65 57.100 57.100 59.294 -2.194 19115 1555 1 9 . 1 1 66 66 ARG N N 66 121.030 121.030 118.228 2.802 19115 1556 1 9 . 1 1 66 66 ARG C C 66 175.880 175.880 178.423 -2.543 19115 1557 1 9 . 1 1 66 66 ARG CA C 66 56.300 56.300 58.490 -2.190 19115 1558 1 9 . 1 1 67 67 GLN N N 67 122.080 122.080 119.204 2.876 19115 1559 1 9 . 1 1 67 67 GLN C C 67 174.560 174.560 177.836 -3.276 19115 1560 1 9 . 1 1 67 67 GLN CA C 67 54.940 54.940 58.284 -3.344 19115 1561 1 9 . 1 1 68 68 ALA N N 68 125.730 125.730 123.116 2.614 19115 1562 1 9 . 1 1 68 68 ALA C C 68 176.500 176.500 179.899 -3.399 19115 1563 1 9 . 1 1 68 68 ALA CA C 68 51.180 51.180 55.165 -3.985 19115 1564 1 9 . 1 1 69 69 ASP N N 69 119.350 119.350 119.585 -0.235 19115 1565 1 9 . 1 1 69 69 ASP C C 69 174.900 174.900 178.306 -3.406 19115 1566 1 9 . 1 1 69 69 ASP CA C 69 53.150 53.150 57.224 -4.074 19115 1567 1 10 . 1 1 5 5 LYS N N 5 120.900 120.900 120.745 0.155 19115 1568 1 10 . 1 1 5 5 LYS C C 5 176.700 176.700 177.337 -0.637 19115 1569 1 10 . 1 1 5 5 LYS CA C 5 58.780 58.780 58.057 0.723 19115 1570 1 10 . 1 1 6 6 THR N N 6 121.660 121.660 112.620 9.040 19115 1571 1 10 . 1 1 6 6 THR C C 6 173.630 173.630 174.571 -0.941 19115 1572 1 10 . 1 1 6 6 THR CA C 6 65.620 65.620 63.694 1.926 19115 1573 1 10 . 1 1 7 7 LEU N N 7 124.020 124.020 120.730 3.290 19115 1574 1 10 . 1 1 7 7 LEU C C 7 176.320 176.320 179.144 -2.824 19115 1575 1 10 . 1 1 7 7 LEU CA C 7 56.090 56.090 56.968 -0.878 19115 1576 1 10 . 1 1 8 8 LEU N N 8 122.080 122.080 121.290 0.790 19115 1577 1 10 . 1 1 8 8 LEU C C 8 175.820 175.820 178.344 -2.524 19115 1578 1 10 . 1 1 8 8 LEU CA C 8 56.180 56.180 57.655 -1.475 19115 1579 1 10 . 1 1 9 9 ARG N N 9 120.750 120.750 118.388 2.362 19115 1580 1 10 . 1 1 9 9 ARG C C 9 176.260 176.260 178.038 -1.778 19115 1581 1 10 . 1 1 9 9 ARG CA C 9 56.590 56.590 58.617 -2.027 19115 1582 1 10 . 1 1 10 10 VAL N N 10 119.300 119.300 120.352 -1.052 19115 1583 1 10 . 1 1 10 10 VAL C C 10 175.990 175.990 176.988 -0.998 19115 1584 1 10 . 1 1 10 10 VAL CA C 10 64.090 64.090 66.326 -2.236 19115 1585 1 10 . 1 1 11 11 SER N N 11 120.480 120.480 116.546 3.934 19115 1586 1 10 . 1 1 11 11 SER C C 11 174.790 174.790 176.640 -1.850 19115 1587 1 10 . 1 1 11 11 SER CA C 11 61.550 61.550 62.327 -0.777 19115 1588 1 10 . 1 1 12 12 ILE N N 12 125.380 125.380 122.760 2.620 19115 1589 1 10 . 1 1 12 12 ILE C C 12 176.980 176.980 178.145 -1.165 19115 1590 1 10 . 1 1 12 12 ILE CA C 12 63.850 63.850 62.566 1.284 19115 1591 1 10 . 1 1 13 13 ILE N N 13 122.450 122.450 119.526 2.924 19115 1592 1 10 . 1 1 13 13 ILE C C 13 175.220 175.220 178.727 -3.507 19115 1593 1 10 . 1 1 13 13 ILE CA C 13 63.910 63.910 65.523 -1.613 19115 1594 1 10 . 1 1 15 15 THR N N 15 120.570 120.570 117.347 3.223 19115 1595 1 10 . 1 1 15 15 THR C C 15 174.670 174.670 176.631 -1.961 19115 1596 1 10 . 1 1 15 15 THR CA C 15 66.150 66.150 66.886 -0.736 19115 1597 1 10 . 1 1 16 16 THR N N 16 120.300 120.300 118.211 2.089 19115 1598 1 10 . 1 1 16 16 THR C C 16 173.330 173.330 175.684 -2.354 19115 1599 1 10 . 1 1 16 16 THR CA C 16 65.950 65.950 65.649 0.301 19115 1600 1 10 . 1 1 17 17 LEU N N 17 123.250 123.250 123.626 -0.376 19115 1601 1 10 . 1 1 17 17 LEU C C 17 175.940 175.940 177.886 -1.946 19115 1602 1 10 . 1 1 17 17 LEU CA C 17 56.290 56.290 57.405 -1.115 19115 1603 1 10 . 1 1 18 18 VAL N N 18 120.680 120.680 119.902 0.778 19115 1604 1 10 . 1 1 18 18 VAL C C 18 176.240 176.240 177.474 -1.234 19115 1605 1 10 . 1 1 18 18 VAL CA C 18 64.840 64.840 67.151 -2.311 19115 1606 1 10 . 1 1 19 19 ALA N N 19 120.350 120.350 120.686 -0.336 19115 1607 1 10 . 1 1 19 19 ALA C C 19 177.010 177.010 180.188 -3.178 19115 1608 1 10 . 1 1 19 19 ALA CA C 19 53.880 53.880 54.801 -0.921 19115 1609 1 10 . 1 1 20 20 LEU N N 20 119.220 119.220 118.475 0.745 19115 1610 1 10 . 1 1 20 20 LEU C C 20 177.090 177.090 179.539 -2.449 19115 1611 1 10 . 1 1 20 20 LEU CA C 20 55.890 55.890 57.656 -1.766 19115 1612 1 10 . 1 1 21 21 SER N N 21 116.930 116.930 115.443 1.487 19115 1613 1 10 . 1 1 21 21 SER C C 21 172.150 172.150 176.452 -4.302 19115 1614 1 10 . 1 1 21 21 SER CA C 21 57.960 57.960 61.539 -3.579 19115 1615 1 10 . 1 1 22 22 SER N N 22 121.910 121.910 117.046 4.864 19115 1616 1 10 . 1 1 22 22 SER C C 22 172.440 172.440 174.779 -2.339 19115 1617 1 10 . 1 1 22 22 SER CA C 22 59.270 59.270 60.495 -1.225 19115 1618 1 10 . 1 1 23 23 PHE N N 23 120.760 120.760 119.619 1.141 19115 1619 1 10 . 1 1 23 23 PHE C C 23 175.110 175.110 177.251 -2.141 19115 1620 1 10 . 1 1 23 23 PHE CA C 23 56.220 56.220 59.244 -3.024 19115 1621 1 10 . 1 1 24 24 THR N N 24 119.530 119.530 116.719 2.811 19115 1622 1 10 . 1 1 24 24 THR C C 24 174.140 174.140 174.122 0.018 19115 1623 1 10 . 1 1 24 24 THR CA C 24 63.380 63.380 67.203 -3.823 19115 1624 1 10 . 1 1 26 26 VAL N N 26 120.730 120.730 117.621 3.109 19115 1625 1 10 . 1 1 26 26 VAL C C 26 175.440 175.440 177.718 -2.278 19115 1626 1 10 . 1 1 26 26 VAL CA C 26 65.460 65.460 66.156 -0.696 19115 1627 1 10 . 1 1 27 27 LEU N N 27 120.380 120.380 119.265 1.115 19115 1628 1 10 . 1 1 27 27 LEU C C 27 177.360 177.360 179.150 -1.790 19115 1629 1 10 . 1 1 27 27 LEU CA C 27 56.180 56.180 57.798 -1.618 19115 1630 1 10 . 1 1 28 28 VAL N N 28 120.420 120.420 117.503 2.917 19115 1631 1 10 . 1 1 28 28 VAL C C 28 174.360 174.360 177.365 -3.005 19115 1632 1 10 . 1 1 28 28 VAL CA C 28 66.370 66.370 65.919 0.451 19115 1633 1 10 . 1 1 29 29 ILE N N 29 121.960 121.960 117.390 4.570 19115 1634 1 10 . 1 1 29 29 ILE C C 29 176.320 176.320 177.349 -1.029 19115 1635 1 10 . 1 1 29 29 ILE CA C 29 63.700 63.700 64.305 -0.605 19115 1636 1 10 . 1 1 30 30 LEU N N 30 122.400 122.400 121.906 0.494 19115 1637 1 10 . 1 1 30 30 LEU C C 30 175.820 175.820 178.550 -2.730 19115 1638 1 10 . 1 1 30 30 LEU CA C 30 56.790 56.790 58.205 -1.415 19115 1639 1 10 . 1 1 31 31 LEU N N 31 118.640 118.640 119.136 -0.496 19115 1640 1 10 . 1 1 31 31 LEU C C 31 177.530 177.530 179.190 -1.660 19115 1641 1 10 . 1 1 31 31 LEU CA C 31 56.700 56.700 57.666 -0.966 19115 1642 1 10 . 1 1 33 33 VAL N N 33 123.000 123.000 122.986 0.014 19115 1643 1 10 . 1 1 33 33 VAL C C 33 174.230 174.230 178.046 -3.816 19115 1644 1 10 . 1 1 33 33 VAL CA C 33 65.950 65.950 66.346 -0.396 19115 1645 1 10 . 1 1 34 34 VAL N N 34 123.380 123.380 118.539 4.841 19115 1646 1 10 . 1 1 34 34 VAL C C 34 176.160 176.160 178.696 -2.536 19115 1647 1 10 . 1 1 34 34 VAL CA C 34 65.160 65.160 66.101 -0.941 19115 1648 1 10 . 1 1 36 36 LEU N N 36 121.010 121.010 121.931 -0.921 19115 1649 1 10 . 1 1 36 36 LEU C C 36 177.200 177.200 178.515 -1.315 19115 1650 1 10 . 1 1 36 36 LEU CA C 36 55.890 55.890 57.119 -1.229 19115 1651 1 10 . 1 1 37 37 SER N N 37 119.220 119.220 115.448 3.772 19115 1652 1 10 . 1 1 37 37 SER C C 37 174.230 174.230 176.087 -1.857 19115 1653 1 10 . 1 1 37 37 SER CA C 37 59.900 59.900 61.195 -1.295 19115 1654 1 10 . 1 1 38 38 ALA N N 38 125.190 125.190 124.765 0.425 19115 1655 1 10 . 1 1 38 38 ALA C C 38 178.020 178.020 179.224 -1.204 19115 1656 1 10 . 1 1 38 38 ALA CA C 38 53.060 53.060 54.648 -1.588 19115 1657 1 10 . 1 1 39 39 LEU N N 39 118.060 118.060 117.349 0.711 19115 1658 1 10 . 1 1 39 39 LEU C C 39 174.840 174.840 179.084 -4.244 19115 1659 1 10 . 1 1 39 39 LEU CA C 39 55.150 55.150 57.076 -1.926 19115 1660 1 10 . 1 1 40 40 THR N N 40 104.520 104.520 111.344 -6.824 19115 1661 1 10 . 1 1 40 40 THR C C 40 171.370 171.370 176.305 -4.935 19115 1662 1 10 . 1 1 40 40 THR CA C 40 59.980 59.980 65.180 -5.199 19115 1663 1 10 . 1 1 42 42 TYR N N 42 120.780 120.780 124.510 -3.730 19115 1664 1 10 . 1 1 42 42 TYR C C 42 172.920 172.920 176.730 -3.810 19115 1665 1 10 . 1 1 42 42 TYR CA C 42 57.310 57.310 58.080 -0.770 19115 1666 1 10 . 1 1 43 43 LEU N N 43 123.030 123.030 122.567 0.463 19115 1667 1 10 . 1 1 43 43 LEU C C 43 174.780 174.780 177.876 -3.096 19115 1668 1 10 . 1 1 43 43 LEU CA C 43 56.500 56.500 55.243 1.257 19115 1669 1 10 . 1 1 44 44 ASP N N 44 121.320 121.320 122.279 -0.959 19115 1670 1 10 . 1 1 44 44 ASP C C 44 174.780 174.780 176.551 -1.771 19115 1671 1 10 . 1 1 44 44 ASP CA C 44 56.500 56.500 56.728 -0.228 19115 1672 1 10 . 1 1 45 45 TYR N N 45 120.640 120.640 118.782 1.858 19115 1673 1 10 . 1 1 45 45 TYR C C 45 174.010 174.010 175.474 -1.464 19115 1674 1 10 . 1 1 45 45 TYR CA C 45 59.780 59.780 57.945 1.835 19115 1675 1 10 . 1 1 46 46 VAL N N 46 120.490 120.490 119.465 1.025 19115 1676 1 10 . 1 1 46 46 VAL C C 46 173.030 173.030 176.462 -3.432 19115 1677 1 10 . 1 1 46 46 VAL CA C 46 60.050 60.050 63.275 -3.225 19115 1678 1 10 . 1 1 47 47 LEU N N 47 120.990 120.990 121.398 -0.408 19115 1679 1 10 . 1 1 47 47 LEU C C 47 176.320 176.320 178.468 -2.148 19115 1680 1 10 . 1 1 47 47 LEU CA C 47 56.700 56.700 56.965 -0.265 19115 1681 1 10 . 1 1 48 48 LEU N N 48 122.020 122.020 120.674 1.346 19115 1682 1 10 . 1 1 48 48 LEU C C 48 174.670 174.670 176.672 -2.002 19115 1683 1 10 . 1 1 48 48 LEU CA C 48 57.800 57.800 59.926 -2.126 19115 1684 1 10 . 1 1 50 50 ALA N N 50 119.130 119.130 119.083 0.047 19115 1685 1 10 . 1 1 50 50 ALA C C 50 177.690 177.690 179.710 -2.020 19115 1686 1 10 . 1 1 50 50 ALA CA C 50 54.680 54.680 54.835 -0.155 19115 1687 1 10 . 1 1 51 51 LEU N N 51 122.780 122.780 119.751 3.029 19115 1688 1 10 . 1 1 51 51 LEU C C 51 176.650 176.650 178.693 -2.043 19115 1689 1 10 . 1 1 51 51 LEU CA C 51 57.570 57.570 57.595 -0.025 19115 1690 1 10 . 1 1 52 52 ALA N N 52 123.870 123.870 122.379 1.491 19115 1691 1 10 . 1 1 52 52 ALA C C 52 178.020 178.020 180.173 -2.153 19115 1692 1 10 . 1 1 52 52 ALA CA C 52 53.730 53.730 55.261 -1.531 19115 1693 1 10 . 1 1 53 53 ILE N N 53 120.070 120.070 119.473 0.597 19115 1694 1 10 . 1 1 53 53 ILE C C 53 176.100 176.100 177.830 -1.730 19115 1695 1 10 . 1 1 53 53 ILE CA C 53 63.300 63.300 64.150 -0.850 19115 1696 1 10 . 1 1 54 54 PHE N N 54 117.590 117.590 120.862 -3.272 19115 1697 1 10 . 1 1 54 54 PHE C C 54 175.960 175.960 177.651 -1.691 19115 1698 1 10 . 1 1 54 54 PHE CA C 54 60.210 60.210 62.241 -2.031 19115 1699 1 10 . 1 1 55 55 ILE N N 55 121.880 121.880 119.409 2.471 19115 1700 1 10 . 1 1 55 55 ILE C C 55 176.870 176.870 177.360 -0.490 19115 1701 1 10 . 1 1 55 55 ILE CA C 55 64.700 64.700 64.411 0.289 19115 1702 1 10 . 1 1 57 57 LEU N N 57 121.970 121.970 121.678 0.292 19115 1703 1 10 . 1 1 57 57 LEU C C 57 176.050 176.050 178.379 -2.329 19115 1704 1 10 . 1 1 57 57 LEU CA C 57 56.250 56.250 57.667 -1.417 19115 1705 1 10 . 1 1 58 58 THR N N 58 121.370 121.370 114.997 6.373 19115 1706 1 10 . 1 1 58 58 THR C C 58 173.460 173.460 177.141 -3.681 19115 1707 1 10 . 1 1 58 58 THR CA C 58 66.340 66.340 66.414 -0.074 19115 1708 1 10 . 1 1 59 59 ILE N N 59 122.490 122.490 123.159 -0.669 19115 1709 1 10 . 1 1 59 59 ILE C C 59 175.990 175.990 177.009 -1.019 19115 1710 1 10 . 1 1 59 59 ILE CA C 59 63.400 63.400 62.630 0.770 19115 1711 1 10 . 1 1 60 60 TYR N N 60 120.950 120.950 120.682 0.268 19115 1712 1 10 . 1 1 60 60 TYR C C 60 174.890 174.890 177.359 -2.469 19115 1713 1 10 . 1 1 60 60 TYR CA C 60 60.000 60.000 62.325 -2.325 19115 1714 1 10 . 1 1 61 61 ALA N N 61 119.910 119.910 122.502 -2.592 19115 1715 1 10 . 1 1 61 61 ALA C C 61 178.130 178.130 179.386 -1.256 19115 1716 1 10 . 1 1 61 61 ALA CA C 61 54.640 54.640 54.816 -0.175 19115 1717 1 10 . 1 1 62 62 ILE N N 62 122.480 122.480 118.516 3.964 19115 1718 1 10 . 1 1 62 62 ILE C C 62 176.210 176.210 177.125 -0.915 19115 1719 1 10 . 1 1 62 62 ILE CA C 62 64.200 64.200 63.209 0.991 19115 1720 1 10 . 1 1 63 63 GLN N N 63 118.550 118.550 118.681 -0.131 19115 1721 1 10 . 1 1 63 63 GLN C C 63 176.980 176.980 178.316 -1.336 19115 1722 1 10 . 1 1 63 63 GLN CA C 63 55.740 55.740 59.132 -3.392 19115 1723 1 10 . 1 1 64 64 ARG N N 64 120.750 120.750 118.683 2.067 19115 1724 1 10 . 1 1 64 64 ARG C C 64 176.370 176.370 178.366 -1.996 19115 1725 1 10 . 1 1 64 64 ARG CA C 64 56.660 56.660 58.726 -2.066 19115 1726 1 10 . 1 1 65 65 LYS N N 65 120.970 120.970 119.769 1.201 19115 1727 1 10 . 1 1 65 65 LYS C C 65 176.760 176.760 178.528 -1.768 19115 1728 1 10 . 1 1 65 65 LYS CA C 65 57.100 57.100 59.067 -1.967 19115 1729 1 10 . 1 1 66 66 ARG N N 66 121.030 121.030 117.394 3.636 19115 1730 1 10 . 1 1 66 66 ARG C C 66 175.880 175.880 178.607 -2.727 19115 1731 1 10 . 1 1 66 66 ARG CA C 66 56.300 56.300 58.267 -1.967 19115 1732 1 10 . 1 1 67 67 GLN N N 67 122.080 122.080 119.736 2.344 19115 1733 1 10 . 1 1 67 67 GLN C C 67 174.560 174.560 177.865 -3.305 19115 1734 1 10 . 1 1 67 67 GLN CA C 67 54.940 54.940 57.953 -3.013 19115 1735 1 10 . 1 1 68 68 ALA N N 68 125.730 125.730 122.502 3.228 19115 1736 1 10 . 1 1 68 68 ALA C C 68 176.500 176.500 179.533 -3.033 19115 1737 1 10 . 1 1 68 68 ALA CA C 68 51.180 51.180 55.654 -4.474 19115 1738 1 10 . 1 1 69 69 ASP N N 69 119.350 119.350 119.656 -0.306 19115 1739 1 10 . 1 1 69 69 ASP C C 69 174.900 174.900 178.829 -3.929 19115 1740 1 10 . 1 1 69 69 ASP CA C 69 53.150 53.150 57.256 -4.106 19115 stop_ loop_ _SPARTA_output.Data_ID _SPARTA_output.Entity_delta_chem_shifts_ID _SPARTA_output.Conformer_ID _SPARTA_output.Data_type _SPARTA_output.Data_atom _SPARTA_output.Data_num_shifts _SPARTA_output.Data_value _SPARTA_output.Data_low_range _SPARTA_output.Data_high_range _SPARTA_output.Entry_ID 1 1 1 "Average Difference" N 58 3.078 -1.580 2.665 19115 2 1 1 "Average Difference" HA 0 0.000 0.000 0.000 19115 3 1 1 "Average Difference" C 58 2.470 2.233 1.066 19115 4 1 1 "Average Difference" CA 58 1.927 1.287 1.446 19115 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 19115 6 1 1 "Average Difference" HN 0 0.000 0.000 0.000 19115 7 1 2 "Average Difference" N 58 3.051 -1.797 2.487 19115 8 1 2 "Average Difference" HA 0 0.000 0.000 0.000 19115 9 1 2 "Average Difference" C 58 2.480 2.271 1.004 19115 10 1 2 "Average Difference" CA 58 1.841 1.170 1.433 19115 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 19115 12 1 2 "Average Difference" HN 0 0.000 0.000 0.000 19115 13 1 3 "Average Difference" N 58 3.230 -1.802 2.704 19115 14 1 3 "Average Difference" HA 0 0.000 0.000 0.000 19115 15 1 3 "Average Difference" C 58 2.355 2.142 0.986 19115 16 1 3 "Average Difference" CA 58 1.849 1.251 1.373 19115 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 19115 18 1 3 "Average Difference" HN 0 0.000 0.000 0.000 19115 19 1 4 "Average Difference" N 58 3.068 -1.581 2.652 19115 20 1 4 "Average Difference" HA 0 0.000 0.000 0.000 19115 21 1 4 "Average Difference" C 58 2.395 2.217 0.913 19115 22 1 4 "Average Difference" CA 58 1.890 1.328 1.356 19115 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 19115 24 1 4 "Average Difference" HN 0 0.000 0.000 0.000 19115 25 1 5 "Average Difference" N 58 2.968 -1.611 2.515 19115 26 1 5 "Average Difference" HA 0 0.000 0.000 0.000 19115 27 1 5 "Average Difference" C 58 2.558 2.312 1.105 19115 28 1 5 "Average Difference" CA 58 2.033 1.259 1.611 19115 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 19115 30 1 5 "Average Difference" HN 0 0.000 0.000 0.000 19115 31 1 6 "Average Difference" N 58 3.148 -1.846 2.572 19115 32 1 6 "Average Difference" HA 0 0.000 0.000 0.000 19115 33 1 6 "Average Difference" C 58 2.434 2.216 1.016 19115 34 1 6 "Average Difference" CA 58 1.945 1.245 1.507 19115 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 19115 36 1 6 "Average Difference" HN 0 0.000 0.000 0.000 19115 37 1 7 "Average Difference" N 58 3.345 -1.873 2.796 19115 38 1 7 "Average Difference" HA 0 0.000 0.000 0.000 19115 39 1 7 "Average Difference" C 58 2.360 2.145 0.993 19115 40 1 7 "Average Difference" CA 58 1.829 1.080 1.489 19115 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 19115 42 1 7 "Average Difference" HN 0 0.000 0.000 0.000 19115 43 1 8 "Average Difference" N 58 3.540 -1.845 3.047 19115 44 1 8 "Average Difference" HA 0 0.000 0.000 0.000 19115 45 1 8 "Average Difference" C 58 2.352 2.132 1.002 19115 46 1 8 "Average Difference" CA 58 2.020 1.276 1.580 19115 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 19115 48 1 8 "Average Difference" HN 0 0.000 0.000 0.000 19115 49 1 9 "Average Difference" N 58 3.011 -1.592 2.577 19115 50 1 9 "Average Difference" HA 0 0.000 0.000 0.000 19115 51 1 9 "Average Difference" C 58 2.349 2.141 0.975 19115 52 1 9 "Average Difference" CA 58 1.877 1.261 1.403 19115 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 19115 54 1 9 "Average Difference" HN 0 0.000 0.000 0.000 19115 55 1 10 "Average Difference" N 58 2.808 -1.342 2.488 19115 56 1 10 "Average Difference" HA 0 0.000 0.000 0.000 19115 57 1 10 "Average Difference" C 58 2.436 2.209 1.035 19115 58 1 10 "Average Difference" CA 58 1.951 1.237 1.523 19115 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 19115 60 1 10 "Average Difference" HN 0 0.000 0.000 0.000 19115 stop_ save_ save_delta_chem_shifts_average _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average _Entity_delta_chem_shifts.Model_type average _Entity_delta_chem_shifts.Entry_ID 19115 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 5 5 LYS N N 5 120.900 120.900 117.261 3.639 19115 2 1 . 1 1 5 5 LYS C C 5 176.700 176.700 177.181 -0.481 19115 3 1 . 1 1 5 5 LYS CA C 5 58.780 58.780 58.493 0.287 19115 4 1 . 1 1 6 6 THR N N 6 121.660 121.660 112.079 9.582 19115 5 1 . 1 1 6 6 THR C C 6 173.630 173.630 175.585 -1.955 19115 6 1 . 1 1 6 6 THR CA C 6 65.620 65.620 63.845 1.775 19115 7 1 . 1 1 7 7 LEU N N 7 124.020 124.020 122.391 1.629 19115 8 1 . 1 1 7 7 LEU C C 7 176.320 176.320 178.660 -2.340 19115 9 1 . 1 1 7 7 LEU CA C 7 56.090 56.090 57.785 -1.695 19115 10 1 . 1 1 8 8 LEU N N 8 122.080 122.080 119.366 2.714 19115 11 1 . 1 1 8 8 LEU C C 8 175.820 175.820 178.758 -2.938 19115 12 1 . 1 1 8 8 LEU CA C 8 56.180 56.180 57.355 -1.175 19115 13 1 . 1 1 9 9 ARG N N 9 120.750 120.750 118.808 1.942 19115 14 1 . 1 1 9 9 ARG C C 9 176.260 176.260 178.118 -1.858 19115 15 1 . 1 1 9 9 ARG CA C 9 56.590 56.590 58.731 -2.141 19115 16 1 . 1 1 10 10 VAL N N 10 119.300 119.300 119.745 -0.445 19115 17 1 . 1 1 10 10 VAL C C 10 175.990 175.990 177.503 -1.513 19115 18 1 . 1 1 10 10 VAL CA C 10 64.090 64.090 65.993 -1.903 19115 19 1 . 1 1 11 11 SER N N 11 120.480 120.480 115.948 4.532 19115 20 1 . 1 1 11 11 SER C C 11 174.790 174.790 176.890 -2.100 19115 21 1 . 1 1 11 11 SER CA C 11 61.550 61.550 62.025 -0.475 19115 22 1 . 1 1 12 12 ILE N N 12 125.380 125.380 122.389 2.991 19115 23 1 . 1 1 12 12 ILE C C 12 176.980 176.980 178.100 -1.120 19115 24 1 . 1 1 12 12 ILE CA C 12 63.850 63.850 64.252 -0.402 19115 25 1 . 1 1 13 13 ILE N N 13 122.450 122.450 119.319 3.131 19115 26 1 . 1 1 13 13 ILE C C 13 175.220 175.220 178.327 -3.107 19115 27 1 . 1 1 13 13 ILE CA C 13 63.910 63.910 64.648 -0.738 19115 28 1 . 1 1 15 15 THR N N 15 120.570 120.570 116.671 3.899 19115 29 1 . 1 1 15 15 THR C C 15 174.670 174.670 176.649 -1.979 19115 30 1 . 1 1 15 15 THR CA C 15 66.150 66.150 66.249 -0.099 19115 31 1 . 1 1 16 16 THR N N 16 120.300 120.300 118.535 1.765 19115 32 1 . 1 1 16 16 THR C C 16 173.330 173.330 176.007 -2.677 19115 33 1 . 1 1 16 16 THR CA C 16 65.950 65.950 66.350 -0.400 19115 34 1 . 1 1 17 17 LEU N N 17 123.250 123.250 122.231 1.019 19115 35 1 . 1 1 17 17 LEU C C 17 175.940 175.940 178.499 -2.559 19115 36 1 . 1 1 17 17 LEU CA C 17 56.290 56.290 58.068 -1.778 19115 37 1 . 1 1 18 18 VAL N N 18 120.680 120.680 118.531 2.149 19115 38 1 . 1 1 18 18 VAL C C 18 176.240 176.240 177.729 -1.489 19115 39 1 . 1 1 18 18 VAL CA C 18 64.840 64.840 66.233 -1.393 19115 40 1 . 1 1 19 19 ALA N N 19 120.350 120.350 122.531 -2.181 19115 41 1 . 1 1 19 19 ALA C C 19 177.010 177.010 180.239 -3.229 19115 42 1 . 1 1 19 19 ALA CA C 19 53.880 53.880 55.082 -1.202 19115 43 1 . 1 1 20 20 LEU N N 20 119.220 119.220 118.312 0.908 19115 44 1 . 1 1 20 20 LEU C C 20 177.090 177.090 179.389 -2.299 19115 45 1 . 1 1 20 20 LEU CA C 20 55.890 55.890 57.606 -1.716 19115 46 1 . 1 1 21 21 SER N N 21 116.930 116.930 115.145 1.785 19115 47 1 . 1 1 21 21 SER C C 21 172.150 172.150 176.331 -4.181 19115 48 1 . 1 1 21 21 SER CA C 21 57.960 57.960 61.285 -3.325 19115 49 1 . 1 1 22 22 SER N N 22 121.910 121.910 116.645 5.265 19115 50 1 . 1 1 22 22 SER C C 22 172.440 172.440 174.861 -2.421 19115 51 1 . 1 1 22 22 SER CA C 22 59.270 59.270 60.626 -1.356 19115 52 1 . 1 1 23 23 PHE N N 23 120.760 120.760 119.294 1.466 19115 53 1 . 1 1 23 23 PHE C C 23 175.110 175.110 176.992 -1.882 19115 54 1 . 1 1 23 23 PHE CA C 23 56.220 56.220 59.326 -3.106 19115 55 1 . 1 1 24 24 THR N N 24 119.530 119.530 116.741 2.789 19115 56 1 . 1 1 24 24 THR C C 24 174.140 174.140 173.818 0.322 19115 57 1 . 1 1 24 24 THR CA C 24 63.380 63.380 68.048 -4.668 19115 58 1 . 1 1 26 26 VAL N N 26 120.730 120.730 117.406 3.324 19115 59 1 . 1 1 26 26 VAL C C 26 175.440 175.440 177.926 -2.486 19115 60 1 . 1 1 26 26 VAL CA C 26 65.460 65.460 65.953 -0.493 19115 61 1 . 1 1 27 27 LEU N N 27 120.380 120.380 119.642 0.738 19115 62 1 . 1 1 27 27 LEU C C 27 177.360 177.360 179.052 -1.692 19115 63 1 . 1 1 27 27 LEU CA C 27 56.180 56.180 57.829 -1.649 19115 64 1 . 1 1 28 28 VAL N N 28 120.420 120.420 119.096 1.324 19115 65 1 . 1 1 28 28 VAL C C 28 174.360 174.360 178.055 -3.695 19115 66 1 . 1 1 28 28 VAL CA C 28 66.370 66.370 66.458 -0.088 19115 67 1 . 1 1 29 29 ILE N N 29 121.960 121.960 119.784 2.176 19115 68 1 . 1 1 29 29 ILE C C 29 176.320 176.320 177.437 -1.117 19115 69 1 . 1 1 29 29 ILE CA C 29 63.700 63.700 64.697 -0.997 19115 70 1 . 1 1 30 30 LEU N N 30 122.400 122.400 120.651 1.748 19115 71 1 . 1 1 30 30 LEU C C 30 175.820 175.820 178.639 -2.819 19115 72 1 . 1 1 30 30 LEU CA C 30 56.790 56.790 58.195 -1.405 19115 73 1 . 1 1 31 31 LEU N N 31 118.640 118.640 118.300 0.340 19115 74 1 . 1 1 31 31 LEU C C 31 177.530 177.530 179.039 -1.509 19115 75 1 . 1 1 31 31 LEU CA C 31 56.700 56.700 57.880 -1.179 19115 76 1 . 1 1 33 33 VAL N N 33 123.000 123.000 121.792 1.208 19115 77 1 . 1 1 33 33 VAL C C 33 174.230 174.230 177.978 -3.748 19115 78 1 . 1 1 33 33 VAL CA C 33 65.950 65.950 65.883 0.067 19115 79 1 . 1 1 34 34 VAL N N 34 123.380 123.380 119.098 4.282 19115 80 1 . 1 1 34 34 VAL C C 34 176.160 176.160 178.184 -2.024 19115 81 1 . 1 1 34 34 VAL CA C 34 65.160 65.160 65.879 -0.719 19115 82 1 . 1 1 36 36 LEU N N 36 121.010 121.010 121.314 -0.304 19115 83 1 . 1 1 36 36 LEU C C 36 177.200 177.200 178.456 -1.256 19115 84 1 . 1 1 36 36 LEU CA C 36 55.890 55.890 57.263 -1.372 19115 85 1 . 1 1 37 37 SER N N 37 119.220 119.220 115.267 3.953 19115 86 1 . 1 1 37 37 SER C C 37 174.230 174.230 176.344 -2.114 19115 87 1 . 1 1 37 37 SER CA C 37 59.900 59.900 61.524 -1.624 19115 88 1 . 1 1 38 38 ALA N N 38 125.190 125.190 124.471 0.719 19115 89 1 . 1 1 38 38 ALA C C 38 178.020 178.020 179.156 -1.136 19115 90 1 . 1 1 38 38 ALA CA C 38 53.060 53.060 54.704 -1.644 19115 91 1 . 1 1 39 39 LEU N N 39 118.060 118.060 117.817 0.242 19115 92 1 . 1 1 39 39 LEU C C 39 174.840 174.840 179.109 -4.269 19115 93 1 . 1 1 39 39 LEU CA C 39 55.150 55.150 57.243 -2.093 19115 94 1 . 1 1 40 40 THR N N 40 104.520 104.520 111.208 -6.688 19115 95 1 . 1 1 40 40 THR C C 40 171.370 171.370 175.626 -4.256 19115 96 1 . 1 1 40 40 THR CA C 40 59.980 59.980 63.189 -3.209 19115 97 1 . 1 1 42 42 TYR N N 42 120.780 120.780 120.642 0.138 19115 98 1 . 1 1 42 42 TYR C C 42 172.920 172.920 175.854 -2.934 19115 99 1 . 1 1 42 42 TYR CA C 42 57.310 57.310 56.823 0.487 19115 100 1 . 1 1 43 43 LEU N N 43 123.030 123.030 122.271 0.759 19115 101 1 . 1 1 43 43 LEU C C 43 174.780 174.780 177.487 -2.707 19115 102 1 . 1 1 43 43 LEU CA C 43 56.500 56.500 55.977 0.523 19115 103 1 . 1 1 44 44 ASP N N 44 121.320 121.320 120.241 1.079 19115 104 1 . 1 1 44 44 ASP C C 44 174.780 174.780 176.821 -2.041 19115 105 1 . 1 1 44 44 ASP CA C 44 56.500 56.500 56.209 0.291 19115 106 1 . 1 1 45 45 TYR N N 45 120.640 120.640 119.447 1.193 19115 107 1 . 1 1 45 45 TYR C C 45 174.010 174.010 174.991 -0.981 19115 108 1 . 1 1 45 45 TYR CA C 45 59.780 59.780 57.800 1.980 19115 109 1 . 1 1 46 46 VAL N N 46 120.490 120.490 117.853 2.637 19115 110 1 . 1 1 46 46 VAL C C 46 173.030 173.030 176.014 -2.984 19115 111 1 . 1 1 46 46 VAL CA C 46 60.050 60.050 62.651 -2.601 19115 112 1 . 1 1 47 47 LEU N N 47 120.990 120.990 120.740 0.250 19115 113 1 . 1 1 47 47 LEU C C 47 176.320 176.320 178.349 -2.029 19115 114 1 . 1 1 47 47 LEU CA C 47 56.700 56.700 57.334 -0.634 19115 115 1 . 1 1 48 48 LEU N N 48 122.020 122.020 120.426 1.594 19115 116 1 . 1 1 48 48 LEU C C 48 174.670 174.670 176.457 -1.787 19115 117 1 . 1 1 48 48 LEU CA C 48 57.800 57.800 59.722 -1.922 19115 118 1 . 1 1 50 50 ALA N N 50 119.130 119.130 120.513 -1.383 19115 119 1 . 1 1 50 50 ALA C C 50 177.690 177.690 179.526 -1.836 19115 120 1 . 1 1 50 50 ALA CA C 50 54.680 54.680 54.687 -0.007 19115 121 1 . 1 1 51 51 LEU N N 51 122.780 122.780 119.374 3.406 19115 122 1 . 1 1 51 51 LEU C C 51 176.650 176.650 178.494 -1.844 19115 123 1 . 1 1 51 51 LEU CA C 51 57.570 57.570 57.337 0.234 19115 124 1 . 1 1 52 52 ALA N N 52 123.870 123.870 122.438 1.432 19115 125 1 . 1 1 52 52 ALA C C 52 178.020 178.020 179.763 -1.743 19115 126 1 . 1 1 52 52 ALA CA C 52 53.730 53.730 55.146 -1.416 19115 127 1 . 1 1 53 53 ILE N N 53 120.070 120.070 118.641 1.429 19115 128 1 . 1 1 53 53 ILE C C 53 176.100 176.100 177.757 -1.657 19115 129 1 . 1 1 53 53 ILE CA C 53 63.300 63.300 64.532 -1.232 19115 130 1 . 1 1 54 54 PHE N N 54 117.590 117.590 119.806 -2.216 19115 131 1 . 1 1 54 54 PHE C C 54 175.960 175.960 177.880 -1.920 19115 132 1 . 1 1 54 54 PHE CA C 54 60.210 60.210 62.203 -1.993 19115 133 1 . 1 1 55 55 ILE N N 55 121.880 121.880 119.214 2.666 19115 134 1 . 1 1 55 55 ILE C C 55 176.870 176.870 178.323 -1.453 19115 135 1 . 1 1 55 55 ILE CA C 55 64.700 64.700 64.262 0.438 19115 136 1 . 1 1 57 57 LEU N N 57 121.970 121.970 122.178 -0.208 19115 137 1 . 1 1 57 57 LEU C C 57 176.050 176.050 178.516 -2.466 19115 138 1 . 1 1 57 57 LEU CA C 57 56.250 56.250 57.836 -1.586 19115 139 1 . 1 1 58 58 THR N N 58 121.370 121.370 114.464 6.906 19115 140 1 . 1 1 58 58 THR C C 58 173.460 173.460 176.918 -3.458 19115 141 1 . 1 1 58 58 THR CA C 58 66.340 66.340 66.265 0.075 19115 142 1 . 1 1 59 59 ILE N N 59 122.490 122.490 121.169 1.321 19115 143 1 . 1 1 59 59 ILE C C 59 175.990 175.990 177.444 -1.454 19115 144 1 . 1 1 59 59 ILE CA C 59 63.400 63.400 63.940 -0.541 19115 145 1 . 1 1 60 60 TYR N N 60 120.950 120.950 121.087 -0.137 19115 146 1 . 1 1 60 60 TYR C C 60 174.890 174.890 177.088 -2.198 19115 147 1 . 1 1 60 60 TYR CA C 60 60.000 60.000 61.424 -1.424 19115 148 1 . 1 1 61 61 ALA N N 61 119.910 119.910 121.941 -2.031 19115 149 1 . 1 1 61 61 ALA C C 61 178.130 178.130 179.326 -1.196 19115 150 1 . 1 1 61 61 ALA CA C 61 54.640 54.640 54.821 -0.181 19115 151 1 . 1 1 62 62 ILE N N 62 122.480 122.480 118.278 4.202 19115 152 1 . 1 1 62 62 ILE C C 62 176.210 176.210 177.676 -1.466 19115 153 1 . 1 1 62 62 ILE CA C 62 64.200 64.200 63.951 0.249 19115 154 1 . 1 1 63 63 GLN N N 63 118.550 118.550 118.247 0.303 19115 155 1 . 1 1 63 63 GLN C C 63 176.980 176.980 178.472 -1.492 19115 156 1 . 1 1 63 63 GLN CA C 63 55.740 55.740 58.765 -3.025 19115 157 1 . 1 1 64 64 ARG N N 64 120.750 120.750 118.495 2.255 19115 158 1 . 1 1 64 64 ARG C C 64 176.370 176.370 178.143 -1.773 19115 159 1 . 1 1 64 64 ARG CA C 64 56.660 56.660 57.799 -1.139 19115 160 1 . 1 1 65 65 LYS N N 65 120.970 120.970 119.873 1.097 19115 161 1 . 1 1 65 65 LYS C C 65 176.760 176.760 178.632 -1.872 19115 162 1 . 1 1 65 65 LYS CA C 65 57.100 57.100 59.630 -2.530 19115 163 1 . 1 1 66 66 ARG N N 66 121.030 121.030 117.623 3.407 19115 164 1 . 1 1 66 66 ARG C C 66 175.880 175.880 178.668 -2.788 19115 165 1 . 1 1 66 66 ARG CA C 66 56.300 56.300 58.742 -2.442 19115 166 1 . 1 1 67 67 GLN N N 67 122.080 122.080 119.659 2.421 19115 167 1 . 1 1 67 67 GLN C C 67 174.560 174.560 177.968 -3.408 19115 168 1 . 1 1 67 67 GLN CA C 67 54.940 54.940 58.561 -3.621 19115 169 1 . 1 1 68 68 ALA N N 68 125.730 125.730 122.300 3.429 19115 170 1 . 1 1 68 68 ALA C C 68 176.500 176.500 179.417 -2.917 19115 171 1 . 1 1 68 68 ALA CA C 68 51.180 51.180 55.417 -4.237 19115 172 1 . 1 1 69 69 ASP N N 69 119.350 119.350 119.098 0.252 19115 173 1 . 1 1 69 69 ASP C C 69 174.900 174.900 178.272 -3.372 19115 174 1 . 1 1 69 69 ASP CA C 69 53.150 53.150 56.858 -3.708 19115 stop_ save_