data_15594_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 15594
_Entry.PDB_ID 1N65
_Entry.NMR_STAR_version 3.0.9.100
save_
save_delta_chem_shifts_single
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single
_Entity_delta_chem_shifts.Conformer_type "single"
_Entity_delta_chem_shifts.Conformer_count 20
_Entity_delta_chem_shifts.Best_conformer 1
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Conformer_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_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.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 6 . 1 1 1 A 2 2 SER H H 2 9.010 8.258 0.752 1
1 7 . 1 1 1 A 2 2 SER HA H 2 4.680 4.549 0.131 1
1 8 . 1 1 1 A 2 2 SER N N 2 119.390 115.047 4.343 1
1 9 . 1 1 1 A 3 3 PRO C C 3 177.630 178.805 -1.175 1
1 10 . 1 1 1 A 3 3 PRO CA C 3 65.000 64.950 0.050 1
1 11 . 1 1 1 A 3 3 PRO CB C 3 31.790 32.140 -0.350 1
1 12 . 1 1 1 A 4 4 GLU H H 4 8.600 8.389 0.211 1
1 13 . 1 1 1 A 4 4 GLU HA H 4 3.900 4.099 -0.199 1
1 14 . 1 1 1 A 4 4 GLU C C 4 177.910 179.275 -1.365 1
1 15 . 1 1 1 A 4 4 GLU CB C 4 28.980 29.073 -0.093 1
1 16 . 1 1 1 A 4 4 GLU N N 4 117.750 117.751 -0.001 1
1 17 . 1 1 1 A 5 5 GLU H H 5 7.980 8.119 -0.139 1
1 18 . 1 1 1 A 5 5 GLU HA H 5 4.170 4.086 0.084 1
1 19 . 1 1 1 A 5 5 GLU C C 5 178.290 179.298 -1.008 1
1 20 . 1 1 1 A 5 5 GLU CA C 5 58.140 59.237 -1.097 1
1 21 . 1 1 1 A 5 5 GLU CB C 5 30.450 29.288 1.162 1
1 22 . 1 1 1 A 5 5 GLU N N 5 121.890 120.234 1.656 1
1 23 . 1 1 1 A 6 6 LEU H H 6 8.450 8.149 0.301 1
1 24 . 1 1 1 A 6 6 LEU HA H 6 4.310 3.972 0.338 1
1 25 . 1 1 1 A 6 6 LEU C C 6 176.660 178.763 -2.103 1
1 26 . 1 1 1 A 6 6 LEU CA C 6 57.310 57.738 -0.428 1
1 27 . 1 1 1 A 6 6 LEU CB C 6 42.090 41.600 0.490 1
1 28 . 1 1 1 A 6 6 LEU N N 6 120.250 120.596 -0.346 1
1 29 . 1 1 1 A 7 7 LYS H H 7 8.100 8.904 -0.804 1
1 30 . 1 1 1 A 7 7 LYS HA H 7 3.760 4.201 -0.441 1
1 31 . 1 1 1 A 7 7 LYS C C 7 176.160 179.655 -3.495 1
1 32 . 1 1 1 A 7 7 LYS CA C 7 59.110 59.892 -0.782 1
1 33 . 1 1 1 A 7 7 LYS CB C 7 32.110 32.503 -0.393 1
1 34 . 1 1 1 A 7 7 LYS N N 7 120.960 118.676 2.284 1
1 35 . 1 1 1 A 8 8 GLY H H 8 7.860 8.338 -0.478 1
1 36 . 1 1 1 A 8 8 GLY HA2 H 8 3.970 3.751 0.219 1
1 37 . 1 1 1 A 8 8 GLY HA3 H 8 3.970 3.774 0.196 1
1 38 . 1 1 1 A 8 8 GLY C C 8 175.520 176.345 -0.825 1
1 39 . 1 1 1 A 8 8 GLY CA C 8 46.490 47.405 -0.915 1
1 40 . 1 1 1 A 8 8 GLY N N 8 105.430 107.090 -1.660 1
1 41 . 1 1 1 A 9 9 ILE H H 9 8.130 9.300 -1.170 1
1 42 . 1 1 1 A 9 9 ILE HA H 9 4.140 3.939 0.201 1
1 43 . 1 1 1 A 9 9 ILE C C 9 175.320 177.981 -2.661 1
1 44 . 1 1 1 A 9 9 ILE CA C 9 65.010 64.590 0.420 1
1 45 . 1 1 1 A 9 9 ILE CB C 9 39.040 37.880 1.160 1
1 46 . 1 1 1 A 9 9 ILE N N 9 122.870 122.651 0.219 1
1 47 . 1 1 1 A 10 10 PHE H H 10 8.590 8.908 -0.318 1
1 48 . 1 1 1 A 10 10 PHE HA H 10 4.470 3.885 0.585 1
1 49 . 1 1 1 A 10 10 PHE C C 10 175.010 177.303 -2.293 1
1 50 . 1 1 1 A 10 10 PHE CA C 10 62.470 62.445 0.025 1
1 51 . 1 1 1 A 10 10 PHE CB C 10 39.670 39.285 0.385 1
1 52 . 1 1 1 A 10 10 PHE N N 10 120.430 120.528 -0.098 1
1 53 . 1 1 1 A 11 11 GLU H H 11 8.600 8.169 0.431 1
1 54 . 1 1 1 A 11 11 GLU HA H 11 3.750 3.898 -0.148 1
1 55 . 1 1 1 A 11 11 GLU C C 11 177.630 178.885 -1.255 1
1 56 . 1 1 1 A 11 11 GLU CA C 11 58.440 59.718 -1.278 1
1 57 . 1 1 1 A 11 11 GLU CB C 11 29.840 29.006 0.834 1
1 58 . 1 1 1 A 11 11 GLU N N 11 115.410 118.034 -2.624 1
1 59 . 1 1 1 A 12 12 LYS H H 12 7.940 8.788 -0.848 1
1 60 . 1 1 1 A 12 12 LYS HA H 12 4.080 4.062 0.018 1
1 61 . 1 1 1 A 12 12 LYS CA C 12 58.440 59.074 -0.634 1
1 62 . 1 1 1 A 12 12 LYS CB C 12 32.720 32.373 0.347 1
1 63 . 1 1 1 A 12 12 LYS N N 12 119.220 120.225 -1.005 1
1 64 . 1 1 1 A 13 13 TYR H H 13 7.740 7.451 0.289 1
1 65 . 1 1 1 A 13 13 TYR HA H 13 4.580 4.345 0.235 1
1 66 . 1 1 1 A 13 13 TYR C C 13 39.870 178.207 -138.337 1
1 67 . 1 1 1 A 13 13 TYR CA C 13 61.280 60.285 0.995 1
1 68 . 1 1 1 A 13 13 TYR CB C 13 175.510 39.314 136.196 1
1 69 . 1 1 1 A 13 13 TYR N N 13 115.320 117.154 -1.834 1
1 70 . 1 1 1 A 14 14 ALA H H 14 9.060 8.747 0.313 1
1 71 . 1 1 1 A 14 14 ALA HA H 14 3.850 3.986 -0.136 1
1 72 . 1 1 1 A 14 14 ALA C C 14 177.990 179.782 -1.792 1
1 73 . 1 1 1 A 14 14 ALA CA C 14 54.280 54.575 -0.295 1
1 74 . 1 1 1 A 14 14 ALA CB C 14 18.790 17.713 1.077 1
1 75 . 1 1 1 A 14 14 ALA N N 14 120.140 122.988 -2.848 1
1 76 . 1 1 1 A 15 15 ALA H H 15 7.350 8.933 -1.583 1
1 77 . 1 1 1 A 15 15 ALA HA H 15 4.550 4.046 0.504 1
1 78 . 1 1 1 A 15 15 ALA C C 15 176.270 179.701 -3.431 1
1 79 . 1 1 1 A 15 15 ALA CA C 15 52.280 55.057 -2.777 1
1 80 . 1 1 1 A 15 15 ALA CB C 15 19.670 18.041 1.629 1
1 81 . 1 1 1 A 15 15 ALA N N 15 117.640 119.980 -2.340 1
1 82 . 1 1 1 A 16 16 LYS H H 16 7.690 7.679 0.011 1
1 83 . 1 1 1 A 16 16 LYS HA H 16 4.200 4.028 0.172 1
1 84 . 1 1 1 A 16 16 LYS C C 16 175.830 177.310 -1.480 1
1 85 . 1 1 1 A 16 16 LYS CA C 16 59.780 59.453 0.327 1
1 86 . 1 1 1 A 16 16 LYS CB C 16 33.300 32.395 0.905 1
1 87 . 1 1 1 A 16 16 LYS N N 16 120.340 117.013 3.327 1
1 88 . 1 1 1 A 17 17 GLU H H 17 10.170 7.726 2.444 1
1 89 . 1 1 1 A 17 17 GLU HA H 17 4.990 4.446 0.544 1
1 90 . 1 1 1 A 17 17 GLU C C 17 174.790 176.952 -2.162 1
1 91 . 1 1 1 A 17 17 GLU CA C 17 53.910 55.559 -1.649 1
1 92 . 1 1 1 A 17 17 GLU N N 17 116.560 118.139 -1.579 1
1 93 . 1 1 1 A 18 18 GLY H H 18 9.100 8.476 0.624 1
1 94 . 1 1 1 A 18 18 GLY N N 18 113.230 111.251 1.979 1
1 95 . 1 1 1 A 19 19 ASP H H 19 7.730 8.675 -0.945 1
1 96 . 1 1 1 A 19 19 ASP N N 19 126.280 120.903 5.377 1
1 97 . 1 1 1 A 21 21 ASN H H 21 9.090 8.243 0.847 1
1 98 . 1 1 1 A 21 21 ASN N N 21 115.850 115.294 0.556 1
1 99 . 1 1 1 A 24 24 SER C C 24 176.120 174.596 1.524 1
1 100 . 1 1 1 A 25 25 LYS H H 25 10.400 8.541 1.859 1
1 101 . 1 1 1 A 25 25 LYS C C 25 177.600 177.883 -0.283 1
1 102 . 1 1 1 A 25 25 LYS N N 25 124.350 124.953 -0.603 1
1 103 . 1 1 1 A 26 26 GLU H H 26 9.250 8.340 0.910 1
1 104 . 1 1 1 A 26 26 GLU N N 26 118.470 117.590 0.880 1
1 105 . 1 1 1 A 27 27 GLU C C 27 178.580 178.744 -0.164 1
1 106 . 1 1 1 A 27 27 GLU CA C 27 59.920 59.150 0.770 1
1 107 . 1 1 1 A 28 28 LEU H H 28 10.810 9.298 1.512 1
1 108 . 1 1 1 A 28 28 LEU C C 28 177.280 178.538 -1.258 1
1 109 . 1 1 1 A 28 28 LEU CB C 28 43.570 41.699 1.871 1
1 110 . 1 1 1 A 28 28 LEU N N 28 121.060 121.929 -0.869 1
1 111 . 1 1 1 A 29 29 LYS H H 29 9.680 8.522 1.158 1
1 112 . 1 1 1 A 29 29 LYS HA H 29 4.480 3.974 0.506 1
1 113 . 1 1 1 A 29 29 LYS C C 29 176.670 178.739 -2.069 1
1 114 . 1 1 1 A 29 29 LYS CA C 29 60.770 60.058 0.712 1
1 115 . 1 1 1 A 29 29 LYS CB C 29 32.910 32.502 0.408 1
1 116 . 1 1 1 A 29 29 LYS N N 29 121.140 119.316 1.824 1
1 117 . 1 1 1 A 30 30 LEU H H 30 8.410 7.942 0.468 1
1 118 . 1 1 1 A 30 30 LEU CA C 30 57.730 57.946 -0.216 1
1 119 . 1 1 1 A 30 30 LEU CB C 30 42.570 42.035 0.535 1
1 120 . 1 1 1 A 30 30 LEU N N 30 119.000 119.597 -0.597 1
1 121 . 1 1 1 A 31 31 LEU H H 31 9.010 8.001 1.009 1
1 122 . 1 1 1 A 31 31 LEU HA H 31 2.920 3.612 -0.692 1
1 123 . 1 1 1 A 31 31 LEU C C 31 178.280 178.349 -0.069 1
1 124 . 1 1 1 A 31 31 LEU CA C 31 59.030 58.554 0.476 1
1 125 . 1 1 1 A 31 31 LEU N N 31 124.840 119.943 4.897 1
1 126 . 1 1 1 A 32 32 LEU H H 32 9.680 8.937 0.743 1
1 127 . 1 1 1 A 32 32 LEU HA H 32 4.490 4.051 0.439 1
1 128 . 1 1 1 A 32 32 LEU C C 32 177.360 179.764 -2.404 1
1 129 . 1 1 1 A 32 32 LEU CA C 32 58.520 57.265 1.255 1
1 130 . 1 1 1 A 32 32 LEU CB C 32 42.760 41.608 1.152 1
1 131 . 1 1 1 A 32 32 LEU N N 32 120.580 119.068 1.512 1
1 132 . 1 1 1 A 33 33 GLN H H 33 9.140 8.227 0.913 1
1 133 . 1 1 1 A 33 33 GLN HA H 33 4.250 4.152 0.098 1
1 134 . 1 1 1 A 33 33 GLN C C 33 176.050 178.163 -2.113 1
1 135 . 1 1 1 A 33 33 GLN CA C 33 58.600 58.811 -0.211 1
1 136 . 1 1 1 A 33 33 GLN CB C 33 29.730 28.584 1.146 1
1 137 . 1 1 1 A 33 33 GLN N N 33 115.010 119.759 -4.749 1
1 138 . 1 1 1 A 34 34 THR H H 34 8.000 7.996 0.004 1
1 139 . 1 1 1 A 34 34 THR HA H 34 4.390 4.067 0.323 1
1 140 . 1 1 1 A 34 34 THR C C 34 174.130 175.951 -1.821 1
1 141 . 1 1 1 A 34 34 THR CA C 34 65.250 66.252 -1.002 1
1 142 . 1 1 1 A 34 34 THR CB C 34 69.920 69.151 0.769 1
1 143 . 1 1 1 A 34 34 THR N N 34 111.180 114.903 -3.723 1
1 144 . 1 1 1 A 35 35 GLU H H 35 8.810 8.604 0.206 1
1 145 . 1 1 1 A 35 35 GLU HA H 35 4.470 3.956 0.514 1
1 146 . 1 1 1 A 35 35 GLU C C 35 175.430 176.245 -0.815 1
1 147 . 1 1 1 A 35 35 GLU CA C 35 56.170 59.200 -3.030 1
1 148 . 1 1 1 A 35 35 GLU CB C 35 30.900 29.777 1.123 1
1 149 . 1 1 1 A 35 35 GLU N N 35 116.410 121.686 -5.276 1
1 150 . 1 1 1 A 36 36 PHE H H 36 8.230 7.966 0.264 1
1 151 . 1 1 1 A 36 36 PHE HA H 36 5.500 5.070 0.430 1
1 152 . 1 1 1 A 36 36 PHE N N 36 115.090 115.783 -0.693 1
1 153 . 1 1 1 A 37 37 PRO C C 37 178.140 177.791 0.349 1
1 154 . 1 1 1 A 37 37 PRO CA C 37 64.940 64.378 0.562 1
1 155 . 1 1 1 A 37 37 PRO CB C 37 31.600 31.940 -0.340 1
1 156 . 1 1 1 A 38 38 SER H H 38 8.660 8.472 0.188 1
1 157 . 1 1 1 A 38 38 SER HA H 38 4.500 4.291 0.209 1
1 158 . 1 1 1 A 38 38 SER C C 38 174.830 177.013 -2.183 1
1 159 . 1 1 1 A 38 38 SER CA C 38 59.970 61.422 -1.452 1
1 160 . 1 1 1 A 38 38 SER CB C 38 62.690 63.053 -0.363 1
1 161 . 1 1 1 A 38 38 SER N N 38 114.030 113.987 0.043 1
1 162 . 1 1 1 A 39 39 LEU H H 39 8.260 8.170 0.090 1
1 163 . 1 1 1 A 39 39 LEU HA H 39 4.520 4.076 0.444 1
1 164 . 1 1 1 A 39 39 LEU C C 39 176.780 179.689 -2.909 1
1 165 . 1 1 1 A 39 39 LEU CA C 39 56.600 57.202 -0.602 1
1 166 . 1 1 1 A 39 39 LEU CB C 39 42.610 41.395 1.215 1
1 167 . 1 1 1 A 39 39 LEU N N 39 122.650 121.913 0.737 1
1 168 . 1 1 1 A 40 40 LEU H H 40 8.070 8.071 -0.001 1
1 169 . 1 1 1 A 40 40 LEU HA H 40 4.830 4.080 0.750 1
1 170 . 1 1 1 A 40 40 LEU C C 40 175.690 179.520 -3.830 1
1 171 . 1 1 1 A 40 40 LEU CA C 40 54.510 57.930 -3.420 1
1 172 . 1 1 1 A 40 40 LEU CB C 40 42.020 41.083 0.937 1
1 173 . 1 1 1 A 40 40 LEU N N 40 117.390 118.623 -1.233 1
1 174 . 1 1 1 A 41 41 LYS H H 41 7.770 7.896 -0.126 1
1 175 . 1 1 1 A 41 41 LYS HA H 41 4.610 4.115 0.495 1
1 176 . 1 1 1 A 41 41 LYS C C 41 175.380 177.441 -2.061 1
1 177 . 1 1 1 A 41 41 LYS CA C 41 56.170 58.695 -2.525 1
1 178 . 1 1 1 A 41 41 LYS CB C 41 32.950 31.759 1.191 1
1 179 . 1 1 1 A 41 41 LYS N N 41 120.530 117.879 2.651 1
1 180 . 1 1 1 A 42 42 GLY H H 42 8.390 7.940 0.450 1
1 181 . 1 1 1 A 42 42 GLY HA2 H 42 4.280 4.059 0.221 1
1 182 . 1 1 1 A 42 42 GLY HA3 H 42 4.280 4.061 0.219 1
1 183 . 1 1 1 A 42 42 GLY C C 42 177.190 174.964 2.226 1
1 184 . 1 1 1 A 42 42 GLY N N 42 109.280 108.330 0.950 1
1 185 . 1 1 1 A 43 43 MET H H 43 9.020 8.570 0.450 1
1 186 . 1 1 1 A 43 43 MET C C 43 175.520 175.765 -0.245 1
1 187 . 1 1 1 A 43 43 MET N N 43 121.110 119.073 2.037 1
1 188 . 1 1 1 A 44 44 SER H H 44 8.700 7.798 0.902 1
1 189 . 1 1 1 A 44 44 SER C C 44 173.540 174.155 -0.615 1
1 190 . 1 1 1 A 44 44 SER N N 44 116.190 117.281 -1.091 1
1 191 . 1 1 1 A 45 45 THR H H 45 8.440 8.673 -0.233 1
1 192 . 1 1 1 A 45 45 THR C C 45 174.300 175.290 -0.990 1
1 193 . 1 1 1 A 45 45 THR N N 45 113.740 119.284 -5.544 1
1 194 . 1 1 1 A 46 46 LEU H H 46 9.380 8.828 0.552 1
1 195 . 1 1 1 A 46 46 LEU C C 46 177.760 178.081 -0.321 1
1 196 . 1 1 1 A 46 46 LEU N N 46 123.970 123.456 0.514 1
1 197 . 1 1 1 A 47 47 ASP H H 47 8.990 8.317 0.673 1
1 198 . 1 1 1 A 47 47 ASP N N 47 118.620 118.197 0.423 1
1 199 . 1 1 1 A 49 49 LEU H H 49 9.740 8.886 0.854 1
1 200 . 1 1 1 A 49 49 LEU N N 49 123.880 120.704 3.176 1
1 201 . 1 1 1 A 50 50 PHE H H 50 10.730 9.144 1.586 1
1 202 . 1 1 1 A 50 50 PHE N N 50 121.380 119.488 1.892 1
1 203 . 1 1 1 A 51 51 GLU H H 51 7.860 9.224 -1.364 1
1 204 . 1 1 1 A 51 51 GLU HA H 51 3.530 3.920 -0.390 1
1 205 . 1 1 1 A 51 51 GLU N N 51 114.870 118.835 -3.965 1
1 206 . 1 1 1 A 66 66 PHE CA C 66 58.850 61.236 -2.386 1
1 207 . 1 1 1 A 67 67 GLN H H 67 5.670 8.946 -3.276 1
1 208 . 1 1 1 A 67 67 GLN C C 67 174.810 178.017 -3.207 1
1 209 . 1 1 1 A 67 67 GLN CA C 67 56.340 58.243 -1.903 1
1 210 . 1 1 1 A 67 67 GLN N N 67 114.050 117.394 -3.344 1
1 211 . 1 1 1 A 68 68 VAL H H 68 5.760 7.886 -2.126 1
1 212 . 1 1 1 A 68 68 VAL C C 68 175.770 178.414 -2.644 1
1 213 . 1 1 1 A 68 68 VAL CA C 68 63.990 65.746 -1.756 1
1 214 . 1 1 1 A 68 68 VAL CB C 68 31.310 31.544 -0.234 1
1 215 . 1 1 1 A 68 68 VAL N N 68 116.280 119.756 -3.476 1
1 216 . 1 1 1 A 69 69 LEU H H 69 7.150 8.563 -1.413 1
1 217 . 1 1 1 A 69 69 LEU HA H 69 4.040 4.026 0.014 1
1 218 . 1 1 1 A 69 69 LEU C C 69 176.210 178.343 -2.133 1
1 219 . 1 1 1 A 69 69 LEU CA C 69 56.270 57.326 -1.056 1
1 220 . 1 1 1 A 69 69 LEU CB C 69 42.010 41.955 0.055 1
1 221 . 1 1 1 A 69 69 LEU N N 69 120.350 121.473 -1.123 1
1 222 . 1 1 1 A 70 70 VAL H H 70 6.810 7.200 -0.390 1
1 223 . 1 1 1 A 70 70 VAL HA H 70 3.170 3.233 -0.063 1
1 224 . 1 1 1 A 70 70 VAL C C 70 175.760 177.623 -1.863 1
1 225 . 1 1 1 A 70 70 VAL CA C 70 65.110 66.767 -1.657 1
1 226 . 1 1 1 A 70 70 VAL CB C 70 31.190 31.169 0.021 1
1 227 . 1 1 1 A 70 70 VAL N N 70 115.790 118.781 -2.991 1
1 228 . 1 1 1 A 71 71 LYS H H 71 7.190 8.427 -1.237 1
1 229 . 1 1 1 A 71 71 LYS HA H 71 3.880 3.880 0.000 1
1 230 . 1 1 1 A 71 71 LYS C C 71 176.100 179.107 -3.007 1
1 231 . 1 1 1 A 71 71 LYS CA C 71 57.680 59.306 -1.626 1
1 232 . 1 1 1 A 71 71 LYS CB C 71 31.930 32.152 -0.222 1
1 233 . 1 1 1 A 71 71 LYS N N 71 117.820 119.851 -2.031 1
1 234 . 1 1 1 A 72 72 LYS H H 72 7.450 7.224 0.226 1
1 235 . 1 1 1 A 72 72 LYS HA H 72 4.180 4.045 0.135 1
1 236 . 1 1 1 A 72 72 LYS C C 72 176.180 179.280 -3.100 1
1 237 . 1 1 1 A 72 72 LYS CA C 72 56.950 58.337 -1.387 1
1 238 . 1 1 1 A 72 72 LYS CB C 72 33.610 31.665 1.945 1
1 239 . 1 1 1 A 72 72 LYS N N 72 116.930 118.042 -1.112 1
1 240 . 1 1 1 A 73 73 ILE H H 73 7.440 8.024 -0.584 1
1 241 . 1 1 1 A 73 73 ILE HA H 73 4.180 3.518 0.662 1
1 242 . 1 1 1 A 73 73 ILE C C 73 174.440 178.030 -3.590 1
1 243 . 1 1 1 A 73 73 ILE CA C 73 61.510 64.709 -3.199 1
1 244 . 1 1 1 A 73 73 ILE CB C 73 38.610 37.583 1.027 1
1 245 . 1 1 1 A 73 73 ILE N N 73 114.560 121.114 -6.554 1
1 246 . 1 1 1 A 74 74 SER H H 74 7.790 8.819 -1.029 1
1 247 . 1 1 1 A 74 74 SER HA H 74 4.520 4.123 0.397 1
1 248 . 1 1 1 A 74 74 SER C C 74 171.580 177.608 -6.028 1
1 249 . 1 1 1 A 74 74 SER CA C 74 57.960 61.474 -3.514 1
1 250 . 1 1 1 A 74 74 SER CB C 74 63.820 62.928 0.892 1
1 251 . 1 1 1 A 74 74 SER N N 74 117.310 115.674 1.636 1
1 6 . 2 1 1 A 2 2 SER H H 2 9.010 8.258 0.752 1
1 7 . 2 1 1 A 2 2 SER HA H 2 4.680 4.549 0.131 1
1 8 . 2 1 1 A 2 2 SER N N 2 119.390 115.047 4.343 1
1 9 . 2 1 1 A 3 3 PRO C C 3 177.630 178.805 -1.175 1
1 10 . 2 1 1 A 3 3 PRO CA C 3 65.000 64.950 0.050 1
1 11 . 2 1 1 A 3 3 PRO CB C 3 31.790 32.140 -0.350 1
1 12 . 2 1 1 A 4 4 GLU H H 4 8.600 8.389 0.211 1
1 13 . 2 1 1 A 4 4 GLU HA H 4 3.900 4.099 -0.199 1
1 14 . 2 1 1 A 4 4 GLU C C 4 177.910 179.275 -1.365 1
1 15 . 2 1 1 A 4 4 GLU CB C 4 28.980 29.073 -0.093 1
1 16 . 2 1 1 A 4 4 GLU N N 4 117.750 117.751 -0.001 1
1 17 . 2 1 1 A 5 5 GLU H H 5 7.980 8.119 -0.139 1
1 18 . 2 1 1 A 5 5 GLU HA H 5 4.170 4.086 0.084 1
1 19 . 2 1 1 A 5 5 GLU C C 5 178.290 179.298 -1.008 1
1 20 . 2 1 1 A 5 5 GLU CA C 5 58.140 59.237 -1.097 1
1 21 . 2 1 1 A 5 5 GLU CB C 5 30.450 29.288 1.162 1
1 22 . 2 1 1 A 5 5 GLU N N 5 121.890 120.234 1.656 1
1 23 . 2 1 1 A 6 6 LEU H H 6 8.450 8.149 0.301 1
1 24 . 2 1 1 A 6 6 LEU HA H 6 4.310 3.972 0.338 1
1 25 . 2 1 1 A 6 6 LEU C C 6 176.660 178.763 -2.103 1
1 26 . 2 1 1 A 6 6 LEU CA C 6 57.310 57.738 -0.428 1
1 27 . 2 1 1 A 6 6 LEU CB C 6 42.090 41.600 0.490 1
1 28 . 2 1 1 A 6 6 LEU N N 6 120.250 120.596 -0.346 1
1 29 . 2 1 1 A 7 7 LYS H H 7 8.100 8.904 -0.804 1
1 30 . 2 1 1 A 7 7 LYS HA H 7 3.760 4.201 -0.441 1
1 31 . 2 1 1 A 7 7 LYS C C 7 176.160 179.655 -3.495 1
1 32 . 2 1 1 A 7 7 LYS CA C 7 59.110 59.892 -0.782 1
1 33 . 2 1 1 A 7 7 LYS CB C 7 32.110 32.503 -0.393 1
1 34 . 2 1 1 A 7 7 LYS N N 7 120.960 118.676 2.284 1
1 35 . 2 1 1 A 8 8 GLY H H 8 7.860 8.338 -0.478 1
1 36 . 2 1 1 A 8 8 GLY HA2 H 8 3.970 3.751 0.219 1
1 37 . 2 1 1 A 8 8 GLY HA3 H 8 3.970 3.774 0.196 1
1 38 . 2 1 1 A 8 8 GLY C C 8 175.520 176.345 -0.825 1
1 39 . 2 1 1 A 8 8 GLY CA C 8 46.490 47.405 -0.915 1
1 40 . 2 1 1 A 8 8 GLY N N 8 105.430 107.090 -1.660 1
1 41 . 2 1 1 A 9 9 ILE H H 9 8.130 9.300 -1.170 1
1 42 . 2 1 1 A 9 9 ILE HA H 9 4.140 3.939 0.201 1
1 43 . 2 1 1 A 9 9 ILE C C 9 175.320 177.981 -2.661 1
1 44 . 2 1 1 A 9 9 ILE CA C 9 65.010 64.590 0.420 1
1 45 . 2 1 1 A 9 9 ILE CB C 9 39.040 37.880 1.160 1
1 46 . 2 1 1 A 9 9 ILE N N 9 122.870 122.651 0.219 1
1 47 . 2 1 1 A 10 10 PHE H H 10 8.590 8.908 -0.318 1
1 48 . 2 1 1 A 10 10 PHE HA H 10 4.470 3.885 0.585 1
1 49 . 2 1 1 A 10 10 PHE C C 10 175.010 177.303 -2.293 1
1 50 . 2 1 1 A 10 10 PHE CA C 10 62.470 62.445 0.025 1
1 51 . 2 1 1 A 10 10 PHE CB C 10 39.670 39.285 0.385 1
1 52 . 2 1 1 A 10 10 PHE N N 10 120.430 120.528 -0.098 1
1 53 . 2 1 1 A 11 11 GLU H H 11 8.600 8.169 0.431 1
1 54 . 2 1 1 A 11 11 GLU HA H 11 3.750 3.898 -0.148 1
1 55 . 2 1 1 A 11 11 GLU C C 11 177.630 178.885 -1.255 1
1 56 . 2 1 1 A 11 11 GLU CA C 11 58.440 59.718 -1.278 1
1 57 . 2 1 1 A 11 11 GLU CB C 11 29.840 29.006 0.834 1
1 58 . 2 1 1 A 11 11 GLU N N 11 115.410 118.034 -2.624 1
1 59 . 2 1 1 A 12 12 LYS H H 12 7.940 8.788 -0.848 1
1 60 . 2 1 1 A 12 12 LYS HA H 12 4.080 4.062 0.018 1
1 61 . 2 1 1 A 12 12 LYS CA C 12 58.440 59.074 -0.634 1
1 62 . 2 1 1 A 12 12 LYS CB C 12 32.720 32.373 0.347 1
1 63 . 2 1 1 A 12 12 LYS N N 12 119.220 120.225 -1.005 1
1 64 . 2 1 1 A 13 13 TYR H H 13 7.740 7.451 0.289 1
1 65 . 2 1 1 A 13 13 TYR HA H 13 4.580 4.345 0.235 1
1 66 . 2 1 1 A 13 13 TYR C C 13 39.870 178.207 -138.337 1
1 67 . 2 1 1 A 13 13 TYR CA C 13 61.280 60.285 0.995 1
1 68 . 2 1 1 A 13 13 TYR CB C 13 175.510 39.314 136.196 1
1 69 . 2 1 1 A 13 13 TYR N N 13 115.320 117.154 -1.834 1
1 70 . 2 1 1 A 14 14 ALA H H 14 9.060 8.747 0.313 1
1 71 . 2 1 1 A 14 14 ALA HA H 14 3.850 3.986 -0.136 1
1 72 . 2 1 1 A 14 14 ALA C C 14 177.990 179.782 -1.792 1
1 73 . 2 1 1 A 14 14 ALA CA C 14 54.280 54.575 -0.295 1
1 74 . 2 1 1 A 14 14 ALA CB C 14 18.790 17.713 1.077 1
1 75 . 2 1 1 A 14 14 ALA N N 14 120.140 122.988 -2.848 1
1 76 . 2 1 1 A 15 15 ALA H H 15 7.350 8.933 -1.583 1
1 77 . 2 1 1 A 15 15 ALA HA H 15 4.550 4.046 0.504 1
1 78 . 2 1 1 A 15 15 ALA C C 15 176.270 179.701 -3.431 1
1 79 . 2 1 1 A 15 15 ALA CA C 15 52.280 55.057 -2.777 1
1 80 . 2 1 1 A 15 15 ALA CB C 15 19.670 18.041 1.629 1
1 81 . 2 1 1 A 15 15 ALA N N 15 117.640 119.980 -2.340 1
1 82 . 2 1 1 A 16 16 LYS H H 16 7.690 7.679 0.011 1
1 83 . 2 1 1 A 16 16 LYS HA H 16 4.200 4.028 0.172 1
1 84 . 2 1 1 A 16 16 LYS C C 16 175.830 177.310 -1.480 1
1 85 . 2 1 1 A 16 16 LYS CA C 16 59.780 59.453 0.327 1
1 86 . 2 1 1 A 16 16 LYS CB C 16 33.300 32.395 0.905 1
1 87 . 2 1 1 A 16 16 LYS N N 16 120.340 117.013 3.327 1
1 88 . 2 1 1 A 17 17 GLU H H 17 10.170 7.726 2.444 1
1 89 . 2 1 1 A 17 17 GLU HA H 17 4.990 4.446 0.544 1
1 90 . 2 1 1 A 17 17 GLU C C 17 174.790 176.952 -2.162 1
1 91 . 2 1 1 A 17 17 GLU CA C 17 53.910 55.559 -1.649 1
1 92 . 2 1 1 A 17 17 GLU N N 17 116.560 118.139 -1.579 1
1 93 . 2 1 1 A 18 18 GLY H H 18 9.100 8.476 0.624 1
1 94 . 2 1 1 A 18 18 GLY N N 18 113.230 111.251 1.979 1
1 95 . 2 1 1 A 19 19 ASP H H 19 7.730 8.675 -0.945 1
1 96 . 2 1 1 A 19 19 ASP N N 19 126.280 120.903 5.377 1
1 97 . 2 1 1 A 21 21 ASN H H 21 9.090 8.243 0.847 1
1 98 . 2 1 1 A 21 21 ASN N N 21 115.850 115.294 0.556 1
1 99 . 2 1 1 A 24 24 SER C C 24 176.120 174.596 1.524 1
1 100 . 2 1 1 A 25 25 LYS H H 25 10.400 8.541 1.859 1
1 101 . 2 1 1 A 25 25 LYS C C 25 177.600 177.883 -0.283 1
1 102 . 2 1 1 A 25 25 LYS N N 25 124.350 124.953 -0.603 1
1 103 . 2 1 1 A 26 26 GLU H H 26 9.250 8.340 0.910 1
1 104 . 2 1 1 A 26 26 GLU N N 26 118.470 117.590 0.880 1
1 105 . 2 1 1 A 27 27 GLU C C 27 178.580 178.744 -0.164 1
1 106 . 2 1 1 A 27 27 GLU CA C 27 59.920 59.150 0.770 1
1 107 . 2 1 1 A 28 28 LEU H H 28 10.810 9.298 1.512 1
1 108 . 2 1 1 A 28 28 LEU C C 28 177.280 178.538 -1.258 1
1 109 . 2 1 1 A 28 28 LEU CB C 28 43.570 41.699 1.871 1
1 110 . 2 1 1 A 28 28 LEU N N 28 121.060 121.929 -0.869 1
1 111 . 2 1 1 A 29 29 LYS H H 29 9.680 8.522 1.158 1
1 112 . 2 1 1 A 29 29 LYS HA H 29 4.480 3.974 0.506 1
1 113 . 2 1 1 A 29 29 LYS C C 29 176.670 178.739 -2.069 1
1 114 . 2 1 1 A 29 29 LYS CA C 29 60.770 60.058 0.712 1
1 115 . 2 1 1 A 29 29 LYS CB C 29 32.910 32.502 0.408 1
1 116 . 2 1 1 A 29 29 LYS N N 29 121.140 119.316 1.824 1
1 117 . 2 1 1 A 30 30 LEU H H 30 8.410 7.942 0.468 1
1 118 . 2 1 1 A 30 30 LEU CA C 30 57.730 57.946 -0.216 1
1 119 . 2 1 1 A 30 30 LEU CB C 30 42.570 42.035 0.535 1
1 120 . 2 1 1 A 30 30 LEU N N 30 119.000 119.597 -0.597 1
1 121 . 2 1 1 A 31 31 LEU H H 31 9.010 8.001 1.009 1
1 122 . 2 1 1 A 31 31 LEU HA H 31 2.920 3.612 -0.692 1
1 123 . 2 1 1 A 31 31 LEU C C 31 178.280 178.349 -0.069 1
1 124 . 2 1 1 A 31 31 LEU CA C 31 59.030 58.554 0.476 1
1 125 . 2 1 1 A 31 31 LEU N N 31 124.840 119.943 4.897 1
1 126 . 2 1 1 A 32 32 LEU H H 32 9.680 8.937 0.743 1
1 127 . 2 1 1 A 32 32 LEU HA H 32 4.490 4.051 0.439 1
1 128 . 2 1 1 A 32 32 LEU C C 32 177.360 179.764 -2.404 1
1 129 . 2 1 1 A 32 32 LEU CA C 32 58.520 57.265 1.255 1
1 130 . 2 1 1 A 32 32 LEU CB C 32 42.760 41.608 1.152 1
1 131 . 2 1 1 A 32 32 LEU N N 32 120.580 119.068 1.512 1
1 132 . 2 1 1 A 33 33 GLN H H 33 9.140 8.227 0.913 1
1 133 . 2 1 1 A 33 33 GLN HA H 33 4.250 4.152 0.098 1
1 134 . 2 1 1 A 33 33 GLN C C 33 176.050 178.163 -2.113 1
1 135 . 2 1 1 A 33 33 GLN CA C 33 58.600 58.811 -0.211 1
1 136 . 2 1 1 A 33 33 GLN CB C 33 29.730 28.584 1.146 1
1 137 . 2 1 1 A 33 33 GLN N N 33 115.010 119.759 -4.749 1
1 138 . 2 1 1 A 34 34 THR H H 34 8.000 7.996 0.004 1
1 139 . 2 1 1 A 34 34 THR HA H 34 4.390 4.067 0.323 1
1 140 . 2 1 1 A 34 34 THR C C 34 174.130 175.951 -1.821 1
1 141 . 2 1 1 A 34 34 THR CA C 34 65.250 66.252 -1.002 1
1 142 . 2 1 1 A 34 34 THR CB C 34 69.920 69.151 0.769 1
1 143 . 2 1 1 A 34 34 THR N N 34 111.180 114.903 -3.723 1
1 144 . 2 1 1 A 35 35 GLU H H 35 8.810 8.604 0.206 1
1 145 . 2 1 1 A 35 35 GLU HA H 35 4.470 3.956 0.514 1
1 146 . 2 1 1 A 35 35 GLU C C 35 175.430 176.245 -0.815 1
1 147 . 2 1 1 A 35 35 GLU CA C 35 56.170 59.200 -3.030 1
1 148 . 2 1 1 A 35 35 GLU CB C 35 30.900 29.777 1.123 1
1 149 . 2 1 1 A 35 35 GLU N N 35 116.410 121.686 -5.276 1
1 150 . 2 1 1 A 36 36 PHE H H 36 8.230 7.966 0.264 1
1 151 . 2 1 1 A 36 36 PHE HA H 36 5.500 5.070 0.430 1
1 152 . 2 1 1 A 36 36 PHE N N 36 115.090 115.783 -0.693 1
1 153 . 2 1 1 A 37 37 PRO C C 37 178.140 177.791 0.349 1
1 154 . 2 1 1 A 37 37 PRO CA C 37 64.940 64.378 0.562 1
1 155 . 2 1 1 A 37 37 PRO CB C 37 31.600 31.940 -0.340 1
1 156 . 2 1 1 A 38 38 SER H H 38 8.660 8.472 0.188 1
1 157 . 2 1 1 A 38 38 SER HA H 38 4.500 4.291 0.209 1
1 158 . 2 1 1 A 38 38 SER C C 38 174.830 177.013 -2.183 1
1 159 . 2 1 1 A 38 38 SER CA C 38 59.970 61.422 -1.452 1
1 160 . 2 1 1 A 38 38 SER CB C 38 62.690 63.053 -0.363 1
1 161 . 2 1 1 A 38 38 SER N N 38 114.030 113.987 0.043 1
1 162 . 2 1 1 A 39 39 LEU H H 39 8.260 8.170 0.090 1
1 163 . 2 1 1 A 39 39 LEU HA H 39 4.520 4.076 0.444 1
1 164 . 2 1 1 A 39 39 LEU C C 39 176.780 179.689 -2.909 1
1 165 . 2 1 1 A 39 39 LEU CA C 39 56.600 57.202 -0.602 1
1 166 . 2 1 1 A 39 39 LEU CB C 39 42.610 41.395 1.215 1
1 167 . 2 1 1 A 39 39 LEU N N 39 122.650 121.913 0.737 1
1 168 . 2 1 1 A 40 40 LEU H H 40 8.070 8.071 -0.001 1
1 169 . 2 1 1 A 40 40 LEU HA H 40 4.830 4.080 0.750 1
1 170 . 2 1 1 A 40 40 LEU C C 40 175.690 179.520 -3.830 1
1 171 . 2 1 1 A 40 40 LEU CA C 40 54.510 57.930 -3.420 1
1 172 . 2 1 1 A 40 40 LEU CB C 40 42.020 41.083 0.937 1
1 173 . 2 1 1 A 40 40 LEU N N 40 117.390 118.623 -1.233 1
1 174 . 2 1 1 A 41 41 LYS H H 41 7.770 7.896 -0.126 1
1 175 . 2 1 1 A 41 41 LYS HA H 41 4.610 4.115 0.495 1
1 176 . 2 1 1 A 41 41 LYS C C 41 175.380 177.441 -2.061 1
1 177 . 2 1 1 A 41 41 LYS CA C 41 56.170 58.695 -2.525 1
1 178 . 2 1 1 A 41 41 LYS CB C 41 32.950 31.759 1.191 1
1 179 . 2 1 1 A 41 41 LYS N N 41 120.530 117.879 2.651 1
1 180 . 2 1 1 A 42 42 GLY H H 42 8.390 7.940 0.450 1
1 181 . 2 1 1 A 42 42 GLY HA2 H 42 4.280 4.059 0.221 1
1 182 . 2 1 1 A 42 42 GLY HA3 H 42 4.280 4.061 0.219 1
1 183 . 2 1 1 A 42 42 GLY C C 42 177.190 174.964 2.226 1
1 184 . 2 1 1 A 42 42 GLY N N 42 109.280 108.330 0.950 1
1 185 . 2 1 1 A 43 43 MET H H 43 9.020 8.570 0.450 1
1 186 . 2 1 1 A 43 43 MET C C 43 175.520 175.765 -0.245 1
1 187 . 2 1 1 A 43 43 MET N N 43 121.110 119.073 2.037 1
1 188 . 2 1 1 A 44 44 SER H H 44 8.700 7.798 0.902 1
1 189 . 2 1 1 A 44 44 SER C C 44 173.540 174.155 -0.615 1
1 190 . 2 1 1 A 44 44 SER N N 44 116.190 117.281 -1.091 1
1 191 . 2 1 1 A 45 45 THR H H 45 8.440 8.673 -0.233 1
1 192 . 2 1 1 A 45 45 THR C C 45 174.300 175.290 -0.990 1
1 193 . 2 1 1 A 45 45 THR N N 45 113.740 119.284 -5.544 1
1 194 . 2 1 1 A 46 46 LEU H H 46 9.380 8.828 0.552 1
1 195 . 2 1 1 A 46 46 LEU C C 46 177.760 178.081 -0.321 1
1 196 . 2 1 1 A 46 46 LEU N N 46 123.970 123.456 0.514 1
1 197 . 2 1 1 A 47 47 ASP H H 47 8.990 8.317 0.673 1
1 198 . 2 1 1 A 47 47 ASP N N 47 118.620 118.197 0.423 1
1 199 . 2 1 1 A 49 49 LEU H H 49 9.740 8.886 0.854 1
1 200 . 2 1 1 A 49 49 LEU N N 49 123.880 120.704 3.176 1
1 201 . 2 1 1 A 50 50 PHE H H 50 10.730 9.144 1.586 1
1 202 . 2 1 1 A 50 50 PHE N N 50 121.380 119.488 1.892 1
1 203 . 2 1 1 A 51 51 GLU H H 51 7.860 9.224 -1.364 1
1 204 . 2 1 1 A 51 51 GLU HA H 51 3.530 3.920 -0.390 1
1 205 . 2 1 1 A 51 51 GLU N N 51 114.870 118.835 -3.965 1
1 206 . 2 1 1 A 66 66 PHE CA C 66 58.850 61.236 -2.386 1
1 207 . 2 1 1 A 67 67 GLN H H 67 5.670 8.946 -3.276 1
1 208 . 2 1 1 A 67 67 GLN C C 67 174.810 178.017 -3.207 1
1 209 . 2 1 1 A 67 67 GLN CA C 67 56.340 58.243 -1.903 1
1 210 . 2 1 1 A 67 67 GLN N N 67 114.050 117.394 -3.344 1
1 211 . 2 1 1 A 68 68 VAL H H 68 5.760 7.886 -2.126 1
1 212 . 2 1 1 A 68 68 VAL C C 68 175.770 178.414 -2.644 1
1 213 . 2 1 1 A 68 68 VAL CA C 68 63.990 65.746 -1.756 1
1 214 . 2 1 1 A 68 68 VAL CB C 68 31.310 31.544 -0.234 1
1 215 . 2 1 1 A 68 68 VAL N N 68 116.280 119.756 -3.476 1
1 216 . 2 1 1 A 69 69 LEU H H 69 7.150 8.563 -1.413 1
1 217 . 2 1 1 A 69 69 LEU HA H 69 4.040 4.026 0.014 1
1 218 . 2 1 1 A 69 69 LEU C C 69 176.210 178.343 -2.133 1
1 219 . 2 1 1 A 69 69 LEU CA C 69 56.270 57.326 -1.056 1
1 220 . 2 1 1 A 69 69 LEU CB C 69 42.010 41.955 0.055 1
1 221 . 2 1 1 A 69 69 LEU N N 69 120.350 121.473 -1.123 1
1 222 . 2 1 1 A 70 70 VAL H H 70 6.810 7.200 -0.390 1
1 223 . 2 1 1 A 70 70 VAL HA H 70 3.170 3.233 -0.063 1
1 224 . 2 1 1 A 70 70 VAL C C 70 175.760 177.623 -1.863 1
1 225 . 2 1 1 A 70 70 VAL CA C 70 65.110 66.767 -1.657 1
1 226 . 2 1 1 A 70 70 VAL CB C 70 31.190 31.169 0.021 1
1 227 . 2 1 1 A 70 70 VAL N N 70 115.790 118.781 -2.991 1
1 228 . 2 1 1 A 71 71 LYS H H 71 7.190 8.427 -1.237 1
1 229 . 2 1 1 A 71 71 LYS HA H 71 3.880 3.880 0.000 1
1 230 . 2 1 1 A 71 71 LYS C C 71 176.100 179.107 -3.007 1
1 231 . 2 1 1 A 71 71 LYS CA C 71 57.680 59.306 -1.626 1
1 232 . 2 1 1 A 71 71 LYS CB C 71 31.930 32.152 -0.222 1
1 233 . 2 1 1 A 71 71 LYS N N 71 117.820 119.851 -2.031 1
1 234 . 2 1 1 A 72 72 LYS H H 72 7.450 7.224 0.226 1
1 235 . 2 1 1 A 72 72 LYS HA H 72 4.180 4.045 0.135 1
1 236 . 2 1 1 A 72 72 LYS C C 72 176.180 179.280 -3.100 1
1 237 . 2 1 1 A 72 72 LYS CA C 72 56.950 58.337 -1.387 1
1 238 . 2 1 1 A 72 72 LYS CB C 72 33.610 31.665 1.945 1
1 239 . 2 1 1 A 72 72 LYS N N 72 116.930 118.042 -1.112 1
1 240 . 2 1 1 A 73 73 ILE H H 73 7.440 8.024 -0.584 1
1 241 . 2 1 1 A 73 73 ILE HA H 73 4.180 3.518 0.662 1
1 242 . 2 1 1 A 73 73 ILE C C 73 174.440 178.030 -3.590 1
1 243 . 2 1 1 A 73 73 ILE CA C 73 61.510 64.709 -3.199 1
1 244 . 2 1 1 A 73 73 ILE CB C 73 38.610 37.583 1.027 1
1 245 . 2 1 1 A 73 73 ILE N N 73 114.560 121.114 -6.554 1
1 246 . 2 1 1 A 74 74 SER H H 74 7.790 8.819 -1.029 1
1 247 . 2 1 1 A 74 74 SER HA H 74 4.520 4.123 0.397 1
1 248 . 2 1 1 A 74 74 SER C C 74 171.580 177.608 -6.028 1
1 249 . 2 1 1 A 74 74 SER CA C 74 57.960 61.474 -3.514 1
1 250 . 2 1 1 A 74 74 SER CB C 74 63.820 62.928 0.892 1
1 251 . 2 1 1 A 74 74 SER N N 74 117.310 115.674 1.636 1
1 6 . 3 1 1 A 2 2 SER H H 2 9.010 8.521 0.489 1
1 7 . 3 1 1 A 2 2 SER HA H 2 4.680 4.636 0.044 1
1 8 . 3 1 1 A 2 2 SER N N 2 119.390 117.965 1.425 1
1 9 . 3 1 1 A 3 3 PRO C C 3 177.630 178.894 -1.264 1
1 10 . 3 1 1 A 3 3 PRO CA C 3 65.000 64.967 0.033 1
1 11 . 3 1 1 A 3 3 PRO CB C 3 31.790 32.144 -0.354 1
1 12 . 3 1 1 A 4 4 GLU H H 4 8.600 8.474 0.126 1
1 13 . 3 1 1 A 4 4 GLU HA H 4 3.900 4.117 -0.217 1
1 14 . 3 1 1 A 4 4 GLU C C 4 177.910 179.577 -1.667 1
1 15 . 3 1 1 A 4 4 GLU CB C 4 28.980 29.073 -0.093 1
1 16 . 3 1 1 A 4 4 GLU N N 4 117.750 117.941 -0.191 1
1 17 . 3 1 1 A 5 5 GLU H H 5 7.980 8.142 -0.162 1
1 18 . 3 1 1 A 5 5 GLU HA H 5 4.170 4.110 0.060 1
1 19 . 3 1 1 A 5 5 GLU C C 5 178.290 179.301 -1.011 1
1 20 . 3 1 1 A 5 5 GLU CA C 5 58.140 59.233 -1.093 1
1 21 . 3 1 1 A 5 5 GLU CB C 5 30.450 29.314 1.136 1
1 22 . 3 1 1 A 5 5 GLU N N 5 121.890 120.372 1.518 1
1 23 . 3 1 1 A 6 6 LEU H H 6 8.450 8.105 0.345 1
1 24 . 3 1 1 A 6 6 LEU HA H 6 4.310 4.017 0.293 1
1 25 . 3 1 1 A 6 6 LEU C C 6 176.660 179.011 -2.351 1
1 26 . 3 1 1 A 6 6 LEU CA C 6 57.310 57.792 -0.482 1
1 27 . 3 1 1 A 6 6 LEU CB C 6 42.090 41.689 0.401 1
1 28 . 3 1 1 A 6 6 LEU N N 6 120.250 120.478 -0.228 1
1 29 . 3 1 1 A 7 7 LYS H H 7 8.100 8.875 -0.775 1
1 30 . 3 1 1 A 7 7 LYS HA H 7 3.760 4.141 -0.381 1
1 31 . 3 1 1 A 7 7 LYS C C 7 176.160 179.637 -3.477 1
1 32 . 3 1 1 A 7 7 LYS CA C 7 59.110 60.060 -0.950 1
1 33 . 3 1 1 A 7 7 LYS CB C 7 32.110 32.397 -0.287 1
1 34 . 3 1 1 A 7 7 LYS N N 7 120.960 118.421 2.539 1
1 35 . 3 1 1 A 8 8 GLY H H 8 7.860 8.328 -0.468 1
1 36 . 3 1 1 A 8 8 GLY HA2 H 8 3.970 3.828 0.142 1
1 37 . 3 1 1 A 8 8 GLY HA3 H 8 3.970 3.831 0.139 1
1 38 . 3 1 1 A 8 8 GLY C C 8 175.520 176.179 -0.659 1
1 39 . 3 1 1 A 8 8 GLY CA C 8 46.490 47.483 -0.993 1
1 40 . 3 1 1 A 8 8 GLY N N 8 105.430 106.815 -1.385 1
1 41 . 3 1 1 A 9 9 ILE H H 9 8.130 8.612 -0.482 1
1 42 . 3 1 1 A 9 9 ILE HA H 9 4.140 3.939 0.201 1
1 43 . 3 1 1 A 9 9 ILE C C 9 175.320 178.052 -2.732 1
1 44 . 3 1 1 A 9 9 ILE CA C 9 65.010 64.626 0.384 1
1 45 . 3 1 1 A 9 9 ILE CB C 9 39.040 37.986 1.054 1
1 46 . 3 1 1 A 9 9 ILE N N 9 122.870 122.653 0.217 1
1 47 . 3 1 1 A 10 10 PHE H H 10 8.590 8.915 -0.325 1
1 48 . 3 1 1 A 10 10 PHE HA H 10 4.470 3.995 0.475 1
1 49 . 3 1 1 A 10 10 PHE C C 10 175.010 177.260 -2.250 1
1 50 . 3 1 1 A 10 10 PHE CA C 10 62.470 62.513 -0.043 1
1 51 . 3 1 1 A 10 10 PHE CB C 10 39.670 39.303 0.367 1
1 52 . 3 1 1 A 10 10 PHE N N 10 120.430 120.490 -0.060 1
1 53 . 3 1 1 A 11 11 GLU H H 11 8.600 8.371 0.229 1
1 54 . 3 1 1 A 11 11 GLU HA H 11 3.750 3.734 0.016 1
1 55 . 3 1 1 A 11 11 GLU C C 11 177.630 178.611 -0.981 1
1 56 . 3 1 1 A 11 11 GLU CA C 11 58.440 59.692 -1.252 1
1 57 . 3 1 1 A 11 11 GLU CB C 11 29.840 29.036 0.804 1
1 58 . 3 1 1 A 11 11 GLU N N 11 115.410 118.045 -2.635 1
1 59 . 3 1 1 A 12 12 LYS H H 12 7.940 8.573 -0.633 1
1 60 . 3 1 1 A 12 12 LYS HA H 12 4.080 3.963 0.117 1
1 61 . 3 1 1 A 12 12 LYS CA C 12 58.440 59.150 -0.710 1
1 62 . 3 1 1 A 12 12 LYS CB C 12 32.720 32.295 0.425 1
1 63 . 3 1 1 A 12 12 LYS N N 12 119.220 120.081 -0.861 1
1 64 . 3 1 1 A 13 13 TYR H H 13 7.740 7.303 0.437 1
1 65 . 3 1 1 A 13 13 TYR HA H 13 4.580 4.372 0.208 1
1 66 . 3 1 1 A 13 13 TYR C C 13 39.870 178.250 -138.380 1
1 67 . 3 1 1 A 13 13 TYR CA C 13 61.280 60.274 1.006 1
1 68 . 3 1 1 A 13 13 TYR CB C 13 175.510 39.261 136.249 1
1 69 . 3 1 1 A 13 13 TYR N N 13 115.320 117.127 -1.807 1
1 70 . 3 1 1 A 14 14 ALA H H 14 9.060 8.546 0.514 1
1 71 . 3 1 1 A 14 14 ALA HA H 14 3.850 3.925 -0.075 1
1 72 . 3 1 1 A 14 14 ALA C C 14 177.990 179.863 -1.873 1
1 73 . 3 1 1 A 14 14 ALA CA C 14 54.280 54.848 -0.568 1
1 74 . 3 1 1 A 14 14 ALA CB C 14 18.790 17.738 1.052 1
1 75 . 3 1 1 A 14 14 ALA N N 14 120.140 122.510 -2.370 1
1 76 . 3 1 1 A 15 15 ALA H H 15 7.350 8.515 -1.165 1
1 77 . 3 1 1 A 15 15 ALA HA H 15 4.550 4.048 0.502 1
1 78 . 3 1 1 A 15 15 ALA C C 15 176.270 179.301 -3.031 1
1 79 . 3 1 1 A 15 15 ALA CA C 15 52.280 55.090 -2.810 1
1 80 . 3 1 1 A 15 15 ALA CB C 15 19.670 18.053 1.617 1
1 81 . 3 1 1 A 15 15 ALA N N 15 117.640 120.557 -2.917 1
1 82 . 3 1 1 A 16 16 LYS H H 16 7.690 8.054 -0.364 1
1 83 . 3 1 1 A 16 16 LYS HA H 16 4.200 4.050 0.150 1
1 84 . 3 1 1 A 16 16 LYS C C 16 175.830 176.994 -1.164 1
1 85 . 3 1 1 A 16 16 LYS CA C 16 59.780 59.727 0.053 1
1 86 . 3 1 1 A 16 16 LYS CB C 16 33.300 32.109 1.191 1
1 87 . 3 1 1 A 16 16 LYS N N 16 120.340 117.695 2.645 1
1 88 . 3 1 1 A 17 17 GLU H H 17 10.170 8.113 2.057 1
1 89 . 3 1 1 A 17 17 GLU HA H 17 4.990 4.517 0.473 1
1 90 . 3 1 1 A 17 17 GLU C C 17 174.790 176.468 -1.678 1
1 91 . 3 1 1 A 17 17 GLU CA C 17 53.910 55.238 -1.328 1
1 92 . 3 1 1 A 17 17 GLU N N 17 116.560 117.767 -1.207 1
1 93 . 3 1 1 A 18 18 GLY H H 18 9.100 8.541 0.559 1
1 94 . 3 1 1 A 18 18 GLY N N 18 113.230 111.166 2.064 1
1 95 . 3 1 1 A 19 19 ASP H H 19 7.730 8.298 -0.568 1
1 96 . 3 1 1 A 19 19 ASP N N 19 126.280 120.285 5.995 1
1 97 . 3 1 1 A 21 21 ASN H H 21 9.090 8.297 0.793 1
1 98 . 3 1 1 A 21 21 ASN N N 21 115.850 115.424 0.426 1
1 99 . 3 1 1 A 24 24 SER C C 24 176.120 174.543 1.577 1
1 100 . 3 1 1 A 25 25 LYS H H 25 10.400 8.612 1.788 1
1 101 . 3 1 1 A 25 25 LYS C C 25 177.600 177.775 -0.175 1
1 102 . 3 1 1 A 25 25 LYS N N 25 124.350 125.032 -0.682 1
1 103 . 3 1 1 A 26 26 GLU H H 26 9.250 8.361 0.889 1
1 104 . 3 1 1 A 26 26 GLU N N 26 118.470 118.047 0.423 1
1 105 . 3 1 1 A 27 27 GLU C C 27 178.580 178.532 0.048 1
1 106 . 3 1 1 A 27 27 GLU CA C 27 59.920 59.117 0.803 1
1 107 . 3 1 1 A 28 28 LEU H H 28 10.810 9.021 1.789 1
1 108 . 3 1 1 A 28 28 LEU C C 28 177.280 178.435 -1.155 1
1 109 . 3 1 1 A 28 28 LEU CB C 28 43.570 41.539 2.031 1
1 110 . 3 1 1 A 28 28 LEU N N 28 121.060 121.740 -0.680 1
1 111 . 3 1 1 A 29 29 LYS H H 29 9.680 8.439 1.241 1
1 112 . 3 1 1 A 29 29 LYS HA H 29 4.480 3.934 0.546 1
1 113 . 3 1 1 A 29 29 LYS C C 29 176.670 178.650 -1.980 1
1 114 . 3 1 1 A 29 29 LYS CA C 29 60.770 60.013 0.757 1
1 115 . 3 1 1 A 29 29 LYS CB C 29 32.910 32.468 0.442 1
1 116 . 3 1 1 A 29 29 LYS N N 29 121.140 119.109 2.031 1
1 117 . 3 1 1 A 30 30 LEU H H 30 8.410 7.791 0.619 1
1 118 . 3 1 1 A 30 30 LEU CA C 30 57.730 57.805 -0.075 1
1 119 . 3 1 1 A 30 30 LEU CB C 30 42.570 41.941 0.629 1
1 120 . 3 1 1 A 30 30 LEU N N 30 119.000 119.463 -0.463 1
1 121 . 3 1 1 A 31 31 LEU H H 31 9.010 7.525 1.485 1
1 122 . 3 1 1 A 31 31 LEU HA H 31 2.920 3.677 -0.757 1
1 123 . 3 1 1 A 31 31 LEU C C 31 178.280 178.202 0.078 1
1 124 . 3 1 1 A 31 31 LEU CA C 31 59.030 58.402 0.628 1
1 125 . 3 1 1 A 31 31 LEU N N 31 124.840 119.572 5.268 1
1 126 . 3 1 1 A 32 32 LEU H H 32 9.680 8.909 0.771 1
1 127 . 3 1 1 A 32 32 LEU HA H 32 4.490 4.069 0.421 1
1 128 . 3 1 1 A 32 32 LEU C C 32 177.360 179.811 -2.451 1
1 129 . 3 1 1 A 32 32 LEU CA C 32 58.520 57.275 1.245 1
1 130 . 3 1 1 A 32 32 LEU CB C 32 42.760 41.521 1.239 1
1 131 . 3 1 1 A 32 32 LEU N N 32 120.580 119.041 1.539 1
1 132 . 3 1 1 A 33 33 GLN H H 33 9.140 8.137 1.003 1
1 133 . 3 1 1 A 33 33 GLN HA H 33 4.250 4.138 0.112 1
1 134 . 3 1 1 A 33 33 GLN C C 33 176.050 178.300 -2.250 1
1 135 . 3 1 1 A 33 33 GLN CA C 33 58.600 58.794 -0.194 1
1 136 . 3 1 1 A 33 33 GLN CB C 33 29.730 28.599 1.131 1
1 137 . 3 1 1 A 33 33 GLN N N 33 115.010 119.737 -4.727 1
1 138 . 3 1 1 A 34 34 THR H H 34 8.000 8.029 -0.029 1
1 139 . 3 1 1 A 34 34 THR HA H 34 4.390 4.048 0.342 1
1 140 . 3 1 1 A 34 34 THR C C 34 174.130 175.943 -1.813 1
1 141 . 3 1 1 A 34 34 THR CA C 34 65.250 66.432 -1.182 1
1 142 . 3 1 1 A 34 34 THR CB C 34 69.920 69.176 0.744 1
1 143 . 3 1 1 A 34 34 THR N N 34 111.180 114.750 -3.570 1
1 144 . 3 1 1 A 35 35 GLU H H 35 8.810 8.736 0.074 1
1 145 . 3 1 1 A 35 35 GLU HA H 35 4.470 4.140 0.330 1
1 146 . 3 1 1 A 35 35 GLU C C 35 175.430 176.366 -0.936 1
1 147 . 3 1 1 A 35 35 GLU CA C 35 56.170 59.377 -3.207 1
1 148 . 3 1 1 A 35 35 GLU CB C 35 30.900 29.930 0.970 1
1 149 . 3 1 1 A 35 35 GLU N N 35 116.410 121.782 -5.372 1
1 150 . 3 1 1 A 36 36 PHE H H 36 8.230 8.047 0.183 1
1 151 . 3 1 1 A 36 36 PHE HA H 36 5.500 5.088 0.412 1
1 152 . 3 1 1 A 36 36 PHE N N 36 115.090 115.830 -0.740 1
1 153 . 3 1 1 A 37 37 PRO C C 37 178.140 177.765 0.375 1
1 154 . 3 1 1 A 37 37 PRO CA C 37 64.940 64.295 0.645 1
1 155 . 3 1 1 A 37 37 PRO CB C 37 31.600 32.021 -0.421 1
1 156 . 3 1 1 A 38 38 SER H H 38 8.660 8.330 0.330 1
1 157 . 3 1 1 A 38 38 SER HA H 38 4.500 4.351 0.149 1
1 158 . 3 1 1 A 38 38 SER C C 38 174.830 177.169 -2.339 1
1 159 . 3 1 1 A 38 38 SER CA C 38 59.970 59.872 0.098 1
1 160 . 3 1 1 A 38 38 SER CB C 38 62.690 63.484 -0.794 1
1 161 . 3 1 1 A 38 38 SER N N 38 114.030 113.399 0.631 1
1 162 . 3 1 1 A 39 39 LEU H H 39 8.260 7.781 0.479 1
1 163 . 3 1 1 A 39 39 LEU HA H 39 4.520 4.143 0.377 1
1 164 . 3 1 1 A 39 39 LEU C C 39 176.780 179.856 -3.076 1
1 165 . 3 1 1 A 39 39 LEU CA C 39 56.600 57.347 -0.747 1
1 166 . 3 1 1 A 39 39 LEU CB C 39 42.610 41.589 1.021 1
1 167 . 3 1 1 A 39 39 LEU N N 39 122.650 123.336 -0.686 1
1 168 . 3 1 1 A 40 40 LEU H H 40 8.070 8.068 0.002 1
1 169 . 3 1 1 A 40 40 LEU HA H 40 4.830 4.035 0.795 1
1 170 . 3 1 1 A 40 40 LEU C C 40 175.690 179.675 -3.985 1
1 171 . 3 1 1 A 40 40 LEU CA C 40 54.510 57.954 -3.444 1
1 172 . 3 1 1 A 40 40 LEU CB C 40 42.020 41.435 0.585 1
1 173 . 3 1 1 A 40 40 LEU N N 40 117.390 119.565 -2.175 1
1 174 . 3 1 1 A 41 41 LYS H H 41 7.770 8.058 -0.288 1
1 175 . 3 1 1 A 41 41 LYS HA H 41 4.610 4.077 0.533 1
1 176 . 3 1 1 A 41 41 LYS C C 41 175.380 177.467 -2.087 1
1 177 . 3 1 1 A 41 41 LYS CA C 41 56.170 58.761 -2.591 1
1 178 . 3 1 1 A 41 41 LYS CB C 41 32.950 31.869 1.081 1
1 179 . 3 1 1 A 41 41 LYS N N 41 120.530 117.800 2.730 1
1 180 . 3 1 1 A 42 42 GLY H H 42 8.390 8.211 0.179 1
1 181 . 3 1 1 A 42 42 GLY HA2 H 42 4.280 4.095 0.185 1
1 182 . 3 1 1 A 42 42 GLY HA3 H 42 4.280 4.095 0.185 1
1 183 . 3 1 1 A 42 42 GLY C C 42 177.190 174.860 2.330 1
1 184 . 3 1 1 A 42 42 GLY N N 42 109.280 108.384 0.896 1
1 185 . 3 1 1 A 43 43 MET H H 43 9.020 8.578 0.442 1
1 186 . 3 1 1 A 43 43 MET C C 43 175.520 175.759 -0.239 1
1 187 . 3 1 1 A 43 43 MET N N 43 121.110 119.078 2.032 1
1 188 . 3 1 1 A 44 44 SER H H 44 8.700 7.806 0.894 1
1 189 . 3 1 1 A 44 44 SER C C 44 173.540 174.143 -0.603 1
1 190 . 3 1 1 A 44 44 SER N N 44 116.190 116.947 -0.757 1
1 191 . 3 1 1 A 45 45 THR H H 45 8.440 8.687 -0.247 1
1 192 . 3 1 1 A 45 45 THR C C 45 174.300 175.361 -1.061 1
1 193 . 3 1 1 A 45 45 THR N N 45 113.740 119.369 -5.629 1
1 194 . 3 1 1 A 46 46 LEU H H 46 9.380 8.842 0.538 1
1 195 . 3 1 1 A 46 46 LEU C C 46 177.760 178.174 -0.414 1
1 196 . 3 1 1 A 46 46 LEU N N 46 123.970 123.539 0.431 1
1 197 . 3 1 1 A 47 47 ASP H H 47 8.990 8.517 0.473 1
1 198 . 3 1 1 A 47 47 ASP N N 47 118.620 118.206 0.414 1
1 199 . 3 1 1 A 49 49 LEU H H 49 9.740 8.752 0.988 1
1 200 . 3 1 1 A 49 49 LEU N N 49 123.880 120.618 3.262 1
1 201 . 3 1 1 A 50 50 PHE H H 50 10.730 9.097 1.633 1
1 202 . 3 1 1 A 50 50 PHE N N 50 121.380 119.446 1.934 1
1 203 . 3 1 1 A 51 51 GLU H H 51 7.860 8.324 -0.464 1
1 204 . 3 1 1 A 51 51 GLU HA H 51 3.530 3.924 -0.394 1
1 205 . 3 1 1 A 51 51 GLU N N 51 114.870 118.863 -3.993 1
1 206 . 3 1 1 A 66 66 PHE CA C 66 58.850 61.203 -2.353 1
1 207 . 3 1 1 A 67 67 GLN H H 67 5.670 8.888 -3.218 1
1 208 . 3 1 1 A 67 67 GLN C C 67 174.810 178.007 -3.197 1
1 209 . 3 1 1 A 67 67 GLN CA C 67 56.340 58.177 -1.837 1
1 210 . 3 1 1 A 67 67 GLN N N 67 114.050 117.360 -3.310 1
1 211 . 3 1 1 A 68 68 VAL H H 68 5.760 7.819 -2.059 1
1 212 . 3 1 1 A 68 68 VAL C C 68 175.770 178.413 -2.643 1
1 213 . 3 1 1 A 68 68 VAL CA C 68 63.990 65.860 -1.870 1
1 214 . 3 1 1 A 68 68 VAL CB C 68 31.310 31.485 -0.175 1
1 215 . 3 1 1 A 68 68 VAL N N 68 116.280 119.569 -3.289 1
1 216 . 3 1 1 A 69 69 LEU H H 69 7.150 8.414 -1.264 1
1 217 . 3 1 1 A 69 69 LEU HA H 69 4.040 4.019 0.021 1
1 218 . 3 1 1 A 69 69 LEU C C 69 176.210 178.232 -2.022 1
1 219 . 3 1 1 A 69 69 LEU CA C 69 56.270 57.293 -1.023 1
1 220 . 3 1 1 A 69 69 LEU CB C 69 42.010 41.955 0.055 1
1 221 . 3 1 1 A 69 69 LEU N N 69 120.350 121.637 -1.287 1
1 222 . 3 1 1 A 70 70 VAL H H 70 6.810 7.209 -0.399 1
1 223 . 3 1 1 A 70 70 VAL HA H 70 3.170 3.187 -0.017 1
1 224 . 3 1 1 A 70 70 VAL C C 70 175.760 177.611 -1.851 1
1 225 . 3 1 1 A 70 70 VAL CA C 70 65.110 66.817 -1.707 1
1 226 . 3 1 1 A 70 70 VAL CB C 70 31.190 31.137 0.053 1
1 227 . 3 1 1 A 70 70 VAL N N 70 115.790 118.789 -2.999 1
1 228 . 3 1 1 A 71 71 LYS H H 71 7.190 8.245 -1.055 1
1 229 . 3 1 1 A 71 71 LYS HA H 71 3.880 3.876 0.004 1
1 230 . 3 1 1 A 71 71 LYS C C 71 176.100 179.018 -2.918 1
1 231 . 3 1 1 A 71 71 LYS CA C 71 57.680 59.253 -1.573 1
1 232 . 3 1 1 A 71 71 LYS CB C 71 31.930 32.128 -0.198 1
1 233 . 3 1 1 A 71 71 LYS N N 71 117.820 119.665 -1.845 1
1 234 . 3 1 1 A 72 72 LYS H H 72 7.450 7.625 -0.175 1
1 235 . 3 1 1 A 72 72 LYS HA H 72 4.180 4.032 0.148 1
1 236 . 3 1 1 A 72 72 LYS C C 72 176.180 179.248 -3.068 1
1 237 . 3 1 1 A 72 72 LYS CA C 72 56.950 58.470 -1.520 1
1 238 . 3 1 1 A 72 72 LYS CB C 72 33.610 31.497 2.113 1
1 239 . 3 1 1 A 72 72 LYS N N 72 116.930 118.092 -1.162 1
1 240 . 3 1 1 A 73 73 ILE H H 73 7.440 8.057 -0.617 1
1 241 . 3 1 1 A 73 73 ILE HA H 73 4.180 3.389 0.791 1
1 242 . 3 1 1 A 73 73 ILE C C 73 174.440 178.169 -3.729 1
1 243 . 3 1 1 A 73 73 ILE CA C 73 61.510 64.473 -2.963 1
1 244 . 3 1 1 A 73 73 ILE CB C 73 38.610 37.384 1.226 1
1 245 . 3 1 1 A 73 73 ILE N N 73 114.560 121.293 -6.733 1
1 246 . 3 1 1 A 74 74 SER H H 74 7.790 9.139 -1.349 1
1 247 . 3 1 1 A 74 74 SER HA H 74 4.520 4.176 0.344 1
1 248 . 3 1 1 A 74 74 SER C C 74 171.580 177.448 -5.868 1
1 249 . 3 1 1 A 74 74 SER CA C 74 57.960 61.299 -3.339 1
1 250 . 3 1 1 A 74 74 SER CB C 74 63.820 63.120 0.700 1
1 251 . 3 1 1 A 74 74 SER N N 74 117.310 116.141 1.169 1
1 6 . 4 1 1 A 2 2 SER H H 2 9.010 8.521 0.489 1
1 7 . 4 1 1 A 2 2 SER HA H 2 4.680 4.636 0.044 1
1 8 . 4 1 1 A 2 2 SER N N 2 119.390 117.965 1.425 1
1 9 . 4 1 1 A 3 3 PRO C C 3 177.630 178.894 -1.264 1
1 10 . 4 1 1 A 3 3 PRO CA C 3 65.000 64.967 0.033 1
1 11 . 4 1 1 A 3 3 PRO CB C 3 31.790 32.144 -0.354 1
1 12 . 4 1 1 A 4 4 GLU H H 4 8.600 8.474 0.126 1
1 13 . 4 1 1 A 4 4 GLU HA H 4 3.900 4.117 -0.217 1
1 14 . 4 1 1 A 4 4 GLU C C 4 177.910 179.577 -1.667 1
1 15 . 4 1 1 A 4 4 GLU CB C 4 28.980 29.073 -0.093 1
1 16 . 4 1 1 A 4 4 GLU N N 4 117.750 117.941 -0.191 1
1 17 . 4 1 1 A 5 5 GLU H H 5 7.980 8.142 -0.162 1
1 18 . 4 1 1 A 5 5 GLU HA H 5 4.170 4.110 0.060 1
1 19 . 4 1 1 A 5 5 GLU C C 5 178.290 179.301 -1.011 1
1 20 . 4 1 1 A 5 5 GLU CA C 5 58.140 59.233 -1.093 1
1 21 . 4 1 1 A 5 5 GLU CB C 5 30.450 29.314 1.136 1
1 22 . 4 1 1 A 5 5 GLU N N 5 121.890 120.372 1.518 1
1 23 . 4 1 1 A 6 6 LEU H H 6 8.450 8.105 0.345 1
1 24 . 4 1 1 A 6 6 LEU HA H 6 4.310 4.017 0.293 1
1 25 . 4 1 1 A 6 6 LEU C C 6 176.660 179.011 -2.351 1
1 26 . 4 1 1 A 6 6 LEU CA C 6 57.310 57.792 -0.482 1
1 27 . 4 1 1 A 6 6 LEU CB C 6 42.090 41.689 0.401 1
1 28 . 4 1 1 A 6 6 LEU N N 6 120.250 120.478 -0.228 1
1 29 . 4 1 1 A 7 7 LYS H H 7 8.100 8.875 -0.775 1
1 30 . 4 1 1 A 7 7 LYS HA H 7 3.760 4.141 -0.381 1
1 31 . 4 1 1 A 7 7 LYS C C 7 176.160 179.637 -3.477 1
1 32 . 4 1 1 A 7 7 LYS CA C 7 59.110 60.060 -0.950 1
1 33 . 4 1 1 A 7 7 LYS CB C 7 32.110 32.397 -0.287 1
1 34 . 4 1 1 A 7 7 LYS N N 7 120.960 118.421 2.539 1
1 35 . 4 1 1 A 8 8 GLY H H 8 7.860 8.328 -0.468 1
1 36 . 4 1 1 A 8 8 GLY HA2 H 8 3.970 3.828 0.142 1
1 37 . 4 1 1 A 8 8 GLY HA3 H 8 3.970 3.831 0.139 1
1 38 . 4 1 1 A 8 8 GLY C C 8 175.520 176.179 -0.659 1
1 39 . 4 1 1 A 8 8 GLY CA C 8 46.490 47.483 -0.993 1
1 40 . 4 1 1 A 8 8 GLY N N 8 105.430 106.815 -1.385 1
1 41 . 4 1 1 A 9 9 ILE H H 9 8.130 8.612 -0.482 1
1 42 . 4 1 1 A 9 9 ILE HA H 9 4.140 3.939 0.201 1
1 43 . 4 1 1 A 9 9 ILE C C 9 175.320 178.052 -2.732 1
1 44 . 4 1 1 A 9 9 ILE CA C 9 65.010 64.626 0.384 1
1 45 . 4 1 1 A 9 9 ILE CB C 9 39.040 37.986 1.054 1
1 46 . 4 1 1 A 9 9 ILE N N 9 122.870 122.653 0.217 1
1 47 . 4 1 1 A 10 10 PHE H H 10 8.590 8.915 -0.325 1
1 48 . 4 1 1 A 10 10 PHE HA H 10 4.470 3.995 0.475 1
1 49 . 4 1 1 A 10 10 PHE C C 10 175.010 177.260 -2.250 1
1 50 . 4 1 1 A 10 10 PHE CA C 10 62.470 62.513 -0.043 1
1 51 . 4 1 1 A 10 10 PHE CB C 10 39.670 39.303 0.367 1
1 52 . 4 1 1 A 10 10 PHE N N 10 120.430 120.490 -0.060 1
1 53 . 4 1 1 A 11 11 GLU H H 11 8.600 8.371 0.229 1
1 54 . 4 1 1 A 11 11 GLU HA H 11 3.750 3.734 0.016 1
1 55 . 4 1 1 A 11 11 GLU C C 11 177.630 178.611 -0.981 1
1 56 . 4 1 1 A 11 11 GLU CA C 11 58.440 59.692 -1.252 1
1 57 . 4 1 1 A 11 11 GLU CB C 11 29.840 29.036 0.804 1
1 58 . 4 1 1 A 11 11 GLU N N 11 115.410 118.045 -2.635 1
1 59 . 4 1 1 A 12 12 LYS H H 12 7.940 8.573 -0.633 1
1 60 . 4 1 1 A 12 12 LYS HA H 12 4.080 3.963 0.117 1
1 61 . 4 1 1 A 12 12 LYS CA C 12 58.440 59.150 -0.710 1
1 62 . 4 1 1 A 12 12 LYS CB C 12 32.720 32.295 0.425 1
1 63 . 4 1 1 A 12 12 LYS N N 12 119.220 120.081 -0.861 1
1 64 . 4 1 1 A 13 13 TYR H H 13 7.740 7.303 0.437 1
1 65 . 4 1 1 A 13 13 TYR HA H 13 4.580 4.372 0.208 1
1 66 . 4 1 1 A 13 13 TYR C C 13 39.870 178.250 -138.380 1
1 67 . 4 1 1 A 13 13 TYR CA C 13 61.280 60.274 1.006 1
1 68 . 4 1 1 A 13 13 TYR CB C 13 175.510 39.261 136.249 1
1 69 . 4 1 1 A 13 13 TYR N N 13 115.320 117.127 -1.807 1
1 70 . 4 1 1 A 14 14 ALA H H 14 9.060 8.546 0.514 1
1 71 . 4 1 1 A 14 14 ALA HA H 14 3.850 3.925 -0.075 1
1 72 . 4 1 1 A 14 14 ALA C C 14 177.990 179.863 -1.873 1
1 73 . 4 1 1 A 14 14 ALA CA C 14 54.280 54.848 -0.568 1
1 74 . 4 1 1 A 14 14 ALA CB C 14 18.790 17.738 1.052 1
1 75 . 4 1 1 A 14 14 ALA N N 14 120.140 122.510 -2.370 1
1 76 . 4 1 1 A 15 15 ALA H H 15 7.350 8.515 -1.165 1
1 77 . 4 1 1 A 15 15 ALA HA H 15 4.550 4.048 0.502 1
1 78 . 4 1 1 A 15 15 ALA C C 15 176.270 179.301 -3.031 1
1 79 . 4 1 1 A 15 15 ALA CA C 15 52.280 55.090 -2.810 1
1 80 . 4 1 1 A 15 15 ALA CB C 15 19.670 18.053 1.617 1
1 81 . 4 1 1 A 15 15 ALA N N 15 117.640 120.557 -2.917 1
1 82 . 4 1 1 A 16 16 LYS H H 16 7.690 8.054 -0.364 1
1 83 . 4 1 1 A 16 16 LYS HA H 16 4.200 4.050 0.150 1
1 84 . 4 1 1 A 16 16 LYS C C 16 175.830 176.994 -1.164 1
1 85 . 4 1 1 A 16 16 LYS CA C 16 59.780 59.727 0.053 1
1 86 . 4 1 1 A 16 16 LYS CB C 16 33.300 32.109 1.191 1
1 87 . 4 1 1 A 16 16 LYS N N 16 120.340 117.695 2.645 1
1 88 . 4 1 1 A 17 17 GLU H H 17 10.170 8.113 2.057 1
1 89 . 4 1 1 A 17 17 GLU HA H 17 4.990 4.517 0.473 1
1 90 . 4 1 1 A 17 17 GLU C C 17 174.790 176.468 -1.678 1
1 91 . 4 1 1 A 17 17 GLU CA C 17 53.910 55.238 -1.328 1
1 92 . 4 1 1 A 17 17 GLU N N 17 116.560 117.767 -1.207 1
1 93 . 4 1 1 A 18 18 GLY H H 18 9.100 8.541 0.559 1
1 94 . 4 1 1 A 18 18 GLY N N 18 113.230 111.166 2.064 1
1 95 . 4 1 1 A 19 19 ASP H H 19 7.730 8.298 -0.568 1
1 96 . 4 1 1 A 19 19 ASP N N 19 126.280 120.285 5.995 1
1 97 . 4 1 1 A 21 21 ASN H H 21 9.090 8.297 0.793 1
1 98 . 4 1 1 A 21 21 ASN N N 21 115.850 115.424 0.426 1
1 99 . 4 1 1 A 24 24 SER C C 24 176.120 174.543 1.577 1
1 100 . 4 1 1 A 25 25 LYS H H 25 10.400 8.612 1.788 1
1 101 . 4 1 1 A 25 25 LYS C C 25 177.600 177.775 -0.175 1
1 102 . 4 1 1 A 25 25 LYS N N 25 124.350 125.032 -0.682 1
1 103 . 4 1 1 A 26 26 GLU H H 26 9.250 8.361 0.889 1
1 104 . 4 1 1 A 26 26 GLU N N 26 118.470 118.047 0.423 1
1 105 . 4 1 1 A 27 27 GLU C C 27 178.580 178.532 0.048 1
1 106 . 4 1 1 A 27 27 GLU CA C 27 59.920 59.117 0.803 1
1 107 . 4 1 1 A 28 28 LEU H H 28 10.810 9.021 1.789 1
1 108 . 4 1 1 A 28 28 LEU C C 28 177.280 178.435 -1.155 1
1 109 . 4 1 1 A 28 28 LEU CB C 28 43.570 41.539 2.031 1
1 110 . 4 1 1 A 28 28 LEU N N 28 121.060 121.740 -0.680 1
1 111 . 4 1 1 A 29 29 LYS H H 29 9.680 8.439 1.241 1
1 112 . 4 1 1 A 29 29 LYS HA H 29 4.480 3.934 0.546 1
1 113 . 4 1 1 A 29 29 LYS C C 29 176.670 178.650 -1.980 1
1 114 . 4 1 1 A 29 29 LYS CA C 29 60.770 60.013 0.757 1
1 115 . 4 1 1 A 29 29 LYS CB C 29 32.910 32.468 0.442 1
1 116 . 4 1 1 A 29 29 LYS N N 29 121.140 119.109 2.031 1
1 117 . 4 1 1 A 30 30 LEU H H 30 8.410 7.791 0.619 1
1 118 . 4 1 1 A 30 30 LEU CA C 30 57.730 57.805 -0.075 1
1 119 . 4 1 1 A 30 30 LEU CB C 30 42.570 41.941 0.629 1
1 120 . 4 1 1 A 30 30 LEU N N 30 119.000 119.463 -0.463 1
1 121 . 4 1 1 A 31 31 LEU H H 31 9.010 7.525 1.485 1
1 122 . 4 1 1 A 31 31 LEU HA H 31 2.920 3.677 -0.757 1
1 123 . 4 1 1 A 31 31 LEU C C 31 178.280 178.202 0.078 1
1 124 . 4 1 1 A 31 31 LEU CA C 31 59.030 58.402 0.628 1
1 125 . 4 1 1 A 31 31 LEU N N 31 124.840 119.572 5.268 1
1 126 . 4 1 1 A 32 32 LEU H H 32 9.680 8.909 0.771 1
1 127 . 4 1 1 A 32 32 LEU HA H 32 4.490 4.069 0.421 1
1 128 . 4 1 1 A 32 32 LEU C C 32 177.360 179.811 -2.451 1
1 129 . 4 1 1 A 32 32 LEU CA C 32 58.520 57.275 1.245 1
1 130 . 4 1 1 A 32 32 LEU CB C 32 42.760 41.521 1.239 1
1 131 . 4 1 1 A 32 32 LEU N N 32 120.580 119.041 1.539 1
1 132 . 4 1 1 A 33 33 GLN H H 33 9.140 8.137 1.003 1
1 133 . 4 1 1 A 33 33 GLN HA H 33 4.250 4.138 0.112 1
1 134 . 4 1 1 A 33 33 GLN C C 33 176.050 178.300 -2.250 1
1 135 . 4 1 1 A 33 33 GLN CA C 33 58.600 58.794 -0.194 1
1 136 . 4 1 1 A 33 33 GLN CB C 33 29.730 28.599 1.131 1
1 137 . 4 1 1 A 33 33 GLN N N 33 115.010 119.737 -4.727 1
1 138 . 4 1 1 A 34 34 THR H H 34 8.000 8.029 -0.029 1
1 139 . 4 1 1 A 34 34 THR HA H 34 4.390 4.048 0.342 1
1 140 . 4 1 1 A 34 34 THR C C 34 174.130 175.943 -1.813 1
1 141 . 4 1 1 A 34 34 THR CA C 34 65.250 66.432 -1.182 1
1 142 . 4 1 1 A 34 34 THR CB C 34 69.920 69.176 0.744 1
1 143 . 4 1 1 A 34 34 THR N N 34 111.180 114.750 -3.570 1
1 144 . 4 1 1 A 35 35 GLU H H 35 8.810 8.736 0.074 1
1 145 . 4 1 1 A 35 35 GLU HA H 35 4.470 4.140 0.330 1
1 146 . 4 1 1 A 35 35 GLU C C 35 175.430 176.366 -0.936 1
1 147 . 4 1 1 A 35 35 GLU CA C 35 56.170 59.377 -3.207 1
1 148 . 4 1 1 A 35 35 GLU CB C 35 30.900 29.930 0.970 1
1 149 . 4 1 1 A 35 35 GLU N N 35 116.410 121.782 -5.372 1
1 150 . 4 1 1 A 36 36 PHE H H 36 8.230 8.047 0.183 1
1 151 . 4 1 1 A 36 36 PHE HA H 36 5.500 5.088 0.412 1
1 152 . 4 1 1 A 36 36 PHE N N 36 115.090 115.830 -0.740 1
1 153 . 4 1 1 A 37 37 PRO C C 37 178.140 177.765 0.375 1
1 154 . 4 1 1 A 37 37 PRO CA C 37 64.940 64.295 0.645 1
1 155 . 4 1 1 A 37 37 PRO CB C 37 31.600 32.021 -0.421 1
1 156 . 4 1 1 A 38 38 SER H H 38 8.660 8.330 0.330 1
1 157 . 4 1 1 A 38 38 SER HA H 38 4.500 4.351 0.149 1
1 158 . 4 1 1 A 38 38 SER C C 38 174.830 177.169 -2.339 1
1 159 . 4 1 1 A 38 38 SER CA C 38 59.970 59.872 0.098 1
1 160 . 4 1 1 A 38 38 SER CB C 38 62.690 63.484 -0.794 1
1 161 . 4 1 1 A 38 38 SER N N 38 114.030 113.399 0.631 1
1 162 . 4 1 1 A 39 39 LEU H H 39 8.260 7.781 0.479 1
1 163 . 4 1 1 A 39 39 LEU HA H 39 4.520 4.143 0.377 1
1 164 . 4 1 1 A 39 39 LEU C C 39 176.780 179.856 -3.076 1
1 165 . 4 1 1 A 39 39 LEU CA C 39 56.600 57.347 -0.747 1
1 166 . 4 1 1 A 39 39 LEU CB C 39 42.610 41.589 1.021 1
1 167 . 4 1 1 A 39 39 LEU N N 39 122.650 123.336 -0.686 1
1 168 . 4 1 1 A 40 40 LEU H H 40 8.070 8.068 0.002 1
1 169 . 4 1 1 A 40 40 LEU HA H 40 4.830 4.035 0.795 1
1 170 . 4 1 1 A 40 40 LEU C C 40 175.690 179.675 -3.985 1
1 171 . 4 1 1 A 40 40 LEU CA C 40 54.510 57.954 -3.444 1
1 172 . 4 1 1 A 40 40 LEU CB C 40 42.020 41.435 0.585 1
1 173 . 4 1 1 A 40 40 LEU N N 40 117.390 119.565 -2.175 1
1 174 . 4 1 1 A 41 41 LYS H H 41 7.770 8.058 -0.288 1
1 175 . 4 1 1 A 41 41 LYS HA H 41 4.610 4.077 0.533 1
1 176 . 4 1 1 A 41 41 LYS C C 41 175.380 177.467 -2.087 1
1 177 . 4 1 1 A 41 41 LYS CA C 41 56.170 58.761 -2.591 1
1 178 . 4 1 1 A 41 41 LYS CB C 41 32.950 31.869 1.081 1
1 179 . 4 1 1 A 41 41 LYS N N 41 120.530 117.800 2.730 1
1 180 . 4 1 1 A 42 42 GLY H H 42 8.390 8.211 0.179 1
1 181 . 4 1 1 A 42 42 GLY HA2 H 42 4.280 4.095 0.185 1
1 182 . 4 1 1 A 42 42 GLY HA3 H 42 4.280 4.095 0.185 1
1 183 . 4 1 1 A 42 42 GLY C C 42 177.190 174.860 2.330 1
1 184 . 4 1 1 A 42 42 GLY N N 42 109.280 108.384 0.896 1
1 185 . 4 1 1 A 43 43 MET H H 43 9.020 8.578 0.442 1
1 186 . 4 1 1 A 43 43 MET C C 43 175.520 175.759 -0.239 1
1 187 . 4 1 1 A 43 43 MET N N 43 121.110 119.078 2.032 1
1 188 . 4 1 1 A 44 44 SER H H 44 8.700 7.806 0.894 1
1 189 . 4 1 1 A 44 44 SER C C 44 173.540 174.143 -0.603 1
1 190 . 4 1 1 A 44 44 SER N N 44 116.190 116.947 -0.757 1
1 191 . 4 1 1 A 45 45 THR H H 45 8.440 8.687 -0.247 1
1 192 . 4 1 1 A 45 45 THR C C 45 174.300 175.361 -1.061 1
1 193 . 4 1 1 A 45 45 THR N N 45 113.740 119.369 -5.629 1
1 194 . 4 1 1 A 46 46 LEU H H 46 9.380 8.842 0.538 1
1 195 . 4 1 1 A 46 46 LEU C C 46 177.760 178.174 -0.414 1
1 196 . 4 1 1 A 46 46 LEU N N 46 123.970 123.539 0.431 1
1 197 . 4 1 1 A 47 47 ASP H H 47 8.990 8.517 0.473 1
1 198 . 4 1 1 A 47 47 ASP N N 47 118.620 118.206 0.414 1
1 199 . 4 1 1 A 49 49 LEU H H 49 9.740 8.752 0.988 1
1 200 . 4 1 1 A 49 49 LEU N N 49 123.880 120.618 3.262 1
1 201 . 4 1 1 A 50 50 PHE H H 50 10.730 9.097 1.633 1
1 202 . 4 1 1 A 50 50 PHE N N 50 121.380 119.446 1.934 1
1 203 . 4 1 1 A 51 51 GLU H H 51 7.860 8.324 -0.464 1
1 204 . 4 1 1 A 51 51 GLU HA H 51 3.530 3.924 -0.394 1
1 205 . 4 1 1 A 51 51 GLU N N 51 114.870 118.863 -3.993 1
1 206 . 4 1 1 A 66 66 PHE CA C 66 58.850 61.203 -2.353 1
1 207 . 4 1 1 A 67 67 GLN H H 67 5.670 8.888 -3.218 1
1 208 . 4 1 1 A 67 67 GLN C C 67 174.810 178.007 -3.197 1
1 209 . 4 1 1 A 67 67 GLN CA C 67 56.340 58.177 -1.837 1
1 210 . 4 1 1 A 67 67 GLN N N 67 114.050 117.360 -3.310 1
1 211 . 4 1 1 A 68 68 VAL H H 68 5.760 7.819 -2.059 1
1 212 . 4 1 1 A 68 68 VAL C C 68 175.770 178.413 -2.643 1
1 213 . 4 1 1 A 68 68 VAL CA C 68 63.990 65.860 -1.870 1
1 214 . 4 1 1 A 68 68 VAL CB C 68 31.310 31.485 -0.175 1
1 215 . 4 1 1 A 68 68 VAL N N 68 116.280 119.569 -3.289 1
1 216 . 4 1 1 A 69 69 LEU H H 69 7.150 8.414 -1.264 1
1 217 . 4 1 1 A 69 69 LEU HA H 69 4.040 4.019 0.021 1
1 218 . 4 1 1 A 69 69 LEU C C 69 176.210 178.232 -2.022 1
1 219 . 4 1 1 A 69 69 LEU CA C 69 56.270 57.293 -1.023 1
1 220 . 4 1 1 A 69 69 LEU CB C 69 42.010 41.955 0.055 1
1 221 . 4 1 1 A 69 69 LEU N N 69 120.350 121.637 -1.287 1
1 222 . 4 1 1 A 70 70 VAL H H 70 6.810 7.209 -0.399 1
1 223 . 4 1 1 A 70 70 VAL HA H 70 3.170 3.187 -0.017 1
1 224 . 4 1 1 A 70 70 VAL C C 70 175.760 177.611 -1.851 1
1 225 . 4 1 1 A 70 70 VAL CA C 70 65.110 66.817 -1.707 1
1 226 . 4 1 1 A 70 70 VAL CB C 70 31.190 31.137 0.053 1
1 227 . 4 1 1 A 70 70 VAL N N 70 115.790 118.789 -2.999 1
1 228 . 4 1 1 A 71 71 LYS H H 71 7.190 8.245 -1.055 1
1 229 . 4 1 1 A 71 71 LYS HA H 71 3.880 3.876 0.004 1
1 230 . 4 1 1 A 71 71 LYS C C 71 176.100 179.018 -2.918 1
1 231 . 4 1 1 A 71 71 LYS CA C 71 57.680 59.253 -1.573 1
1 232 . 4 1 1 A 71 71 LYS CB C 71 31.930 32.128 -0.198 1
1 233 . 4 1 1 A 71 71 LYS N N 71 117.820 119.665 -1.845 1
1 234 . 4 1 1 A 72 72 LYS H H 72 7.450 7.625 -0.175 1
1 235 . 4 1 1 A 72 72 LYS HA H 72 4.180 4.032 0.148 1
1 236 . 4 1 1 A 72 72 LYS C C 72 176.180 179.248 -3.068 1
1 237 . 4 1 1 A 72 72 LYS CA C 72 56.950 58.470 -1.520 1
1 238 . 4 1 1 A 72 72 LYS CB C 72 33.610 31.497 2.113 1
1 239 . 4 1 1 A 72 72 LYS N N 72 116.930 118.092 -1.162 1
1 240 . 4 1 1 A 73 73 ILE H H 73 7.440 8.057 -0.617 1
1 241 . 4 1 1 A 73 73 ILE HA H 73 4.180 3.389 0.791 1
1 242 . 4 1 1 A 73 73 ILE C C 73 174.440 178.169 -3.729 1
1 243 . 4 1 1 A 73 73 ILE CA C 73 61.510 64.473 -2.963 1
1 244 . 4 1 1 A 73 73 ILE CB C 73 38.610 37.384 1.226 1
1 245 . 4 1 1 A 73 73 ILE N N 73 114.560 121.293 -6.733 1
1 246 . 4 1 1 A 74 74 SER H H 74 7.790 9.139 -1.349 1
1 247 . 4 1 1 A 74 74 SER HA H 74 4.520 4.176 0.344 1
1 248 . 4 1 1 A 74 74 SER C C 74 171.580 177.448 -5.868 1
1 249 . 4 1 1 A 74 74 SER CA C 74 57.960 61.299 -3.339 1
1 250 . 4 1 1 A 74 74 SER CB C 74 63.820 63.120 0.700 1
1 251 . 4 1 1 A 74 74 SER N N 74 117.310 116.141 1.169 1
1 6 . 5 1 1 A 2 2 SER H H 2 9.010 8.649 0.361 1
1 7 . 5 1 1 A 2 2 SER HA H 2 4.680 4.807 -0.127 1
1 8 . 5 1 1 A 2 2 SER N N 2 119.390 119.999 -0.609 1
1 9 . 5 1 1 A 3 3 PRO C C 3 177.630 178.940 -1.310 1
1 10 . 5 1 1 A 3 3 PRO CA C 3 65.000 64.762 0.238 1
1 11 . 5 1 1 A 3 3 PRO CB C 3 31.790 32.146 -0.356 1
1 12 . 5 1 1 A 4 4 GLU H H 4 8.600 8.111 0.489 1
1 13 . 5 1 1 A 4 4 GLU HA H 4 3.900 4.113 -0.213 1
1 14 . 5 1 1 A 4 4 GLU C C 4 177.910 179.237 -1.327 1
1 15 . 5 1 1 A 4 4 GLU CB C 4 28.980 29.226 -0.246 1
1 16 . 5 1 1 A 4 4 GLU N N 4 117.750 117.803 -0.053 1
1 17 . 5 1 1 A 5 5 GLU H H 5 7.980 8.124 -0.144 1
1 18 . 5 1 1 A 5 5 GLU HA H 5 4.170 4.047 0.123 1
1 19 . 5 1 1 A 5 5 GLU C C 5 178.290 179.304 -1.014 1
1 20 . 5 1 1 A 5 5 GLU CA C 5 58.140 59.210 -1.070 1
1 21 . 5 1 1 A 5 5 GLU CB C 5 30.450 29.383 1.067 1
1 22 . 5 1 1 A 5 5 GLU N N 5 121.890 120.123 1.767 1
1 23 . 5 1 1 A 6 6 LEU H H 6 8.450 7.981 0.469 1
1 24 . 5 1 1 A 6 6 LEU HA H 6 4.310 4.010 0.300 1
1 25 . 5 1 1 A 6 6 LEU C C 6 176.660 178.740 -2.080 1
1 26 . 5 1 1 A 6 6 LEU CA C 6 57.310 57.756 -0.446 1
1 27 . 5 1 1 A 6 6 LEU CB C 6 42.090 41.718 0.372 1
1 28 . 5 1 1 A 6 6 LEU N N 6 120.250 120.651 -0.401 1
1 29 . 5 1 1 A 7 7 LYS H H 7 8.100 9.118 -1.018 1
1 30 . 5 1 1 A 7 7 LYS HA H 7 3.760 4.325 -0.565 1
1 31 . 5 1 1 A 7 7 LYS C C 7 176.160 179.558 -3.398 1
1 32 . 5 1 1 A 7 7 LYS CA C 7 59.110 59.981 -0.871 1
1 33 . 5 1 1 A 7 7 LYS CB C 7 32.110 32.615 -0.505 1
1 34 . 5 1 1 A 7 7 LYS N N 7 120.960 118.924 2.036 1
1 35 . 5 1 1 A 8 8 GLY H H 8 7.860 8.782 -0.922 1
1 36 . 5 1 1 A 8 8 GLY HA2 H 8 3.970 3.844 0.126 1
1 37 . 5 1 1 A 8 8 GLY HA3 H 8 3.970 3.879 0.091 1
1 38 . 5 1 1 A 8 8 GLY C C 8 175.520 176.085 -0.565 1
1 39 . 5 1 1 A 8 8 GLY CA C 8 46.490 47.466 -0.976 1
1 40 . 5 1 1 A 8 8 GLY N N 8 105.430 107.150 -1.720 1
1 41 . 5 1 1 A 9 9 ILE H H 9 8.130 9.543 -1.413 1
1 42 . 5 1 1 A 9 9 ILE HA H 9 4.140 3.919 0.221 1
1 43 . 5 1 1 A 9 9 ILE C C 9 175.320 177.972 -2.652 1
1 44 . 5 1 1 A 9 9 ILE CA C 9 65.010 64.749 0.261 1
1 45 . 5 1 1 A 9 9 ILE CB C 9 39.040 37.992 1.048 1
1 46 . 5 1 1 A 9 9 ILE N N 9 122.870 122.614 0.256 1
1 47 . 5 1 1 A 10 10 PHE H H 10 8.590 9.709 -1.119 1
1 48 . 5 1 1 A 10 10 PHE HA H 10 4.470 3.826 0.644 1
1 49 . 5 1 1 A 10 10 PHE C C 10 175.010 177.271 -2.261 1
1 50 . 5 1 1 A 10 10 PHE CA C 10 62.470 62.278 0.192 1
1 51 . 5 1 1 A 10 10 PHE CB C 10 39.670 38.873 0.797 1
1 52 . 5 1 1 A 10 10 PHE N N 10 120.430 120.481 -0.051 1
1 53 . 5 1 1 A 11 11 GLU H H 11 8.600 8.772 -0.172 1
1 54 . 5 1 1 A 11 11 GLU HA H 11 3.750 3.840 -0.090 1
1 55 . 5 1 1 A 11 11 GLU C C 11 177.630 178.479 -0.849 1
1 56 . 5 1 1 A 11 11 GLU CA C 11 58.440 59.557 -1.117 1
1 57 . 5 1 1 A 11 11 GLU CB C 11 29.840 28.829 1.011 1
1 58 . 5 1 1 A 11 11 GLU N N 11 115.410 118.551 -3.141 1
1 59 . 5 1 1 A 12 12 LYS H H 12 7.940 8.830 -0.890 1
1 60 . 5 1 1 A 12 12 LYS HA H 12 4.080 4.023 0.057 1
1 61 . 5 1 1 A 12 12 LYS CA C 12 58.440 58.996 -0.556 1
1 62 . 5 1 1 A 12 12 LYS CB C 12 32.720 32.339 0.381 1
1 63 . 5 1 1 A 12 12 LYS N N 12 119.220 119.836 -0.616 1
1 64 . 5 1 1 A 13 13 TYR H H 13 7.740 7.397 0.343 1
1 65 . 5 1 1 A 13 13 TYR HA H 13 4.580 4.372 0.208 1
1 66 . 5 1 1 A 13 13 TYR C C 13 39.870 178.283 -138.413 1
1 67 . 5 1 1 A 13 13 TYR CA C 13 61.280 60.465 0.815 1
1 68 . 5 1 1 A 13 13 TYR CB C 13 175.510 39.237 136.273 1
1 69 . 5 1 1 A 13 13 TYR N N 13 115.320 117.514 -2.194 1
1 70 . 5 1 1 A 14 14 ALA H H 14 9.060 8.744 0.316 1
1 71 . 5 1 1 A 14 14 ALA HA H 14 3.850 3.740 0.110 1
1 72 . 5 1 1 A 14 14 ALA C C 14 177.990 179.758 -1.768 1
1 73 . 5 1 1 A 14 14 ALA CA C 14 54.280 54.850 -0.570 1
1 74 . 5 1 1 A 14 14 ALA CB C 14 18.790 17.561 1.229 1
1 75 . 5 1 1 A 14 14 ALA N N 14 120.140 122.626 -2.486 1
1 76 . 5 1 1 A 15 15 ALA H H 15 7.350 8.815 -1.465 1
1 77 . 5 1 1 A 15 15 ALA HA H 15 4.550 4.068 0.482 1
1 78 . 5 1 1 A 15 15 ALA C C 15 176.270 179.445 -3.175 1
1 79 . 5 1 1 A 15 15 ALA CA C 15 52.280 55.045 -2.765 1
1 80 . 5 1 1 A 15 15 ALA CB C 15 19.670 18.264 1.406 1
1 81 . 5 1 1 A 15 15 ALA N N 15 117.640 120.525 -2.885 1
1 82 . 5 1 1 A 16 16 LYS H H 16 7.690 8.158 -0.468 1
1 83 . 5 1 1 A 16 16 LYS HA H 16 4.200 4.020 0.180 1
1 84 . 5 1 1 A 16 16 LYS C C 16 175.830 177.263 -1.433 1
1 85 . 5 1 1 A 16 16 LYS CA C 16 59.780 59.635 0.145 1
1 86 . 5 1 1 A 16 16 LYS CB C 16 33.300 32.279 1.021 1
1 87 . 5 1 1 A 16 16 LYS N N 16 120.340 117.474 2.866 1
1 88 . 5 1 1 A 17 17 GLU H H 17 10.170 8.070 2.100 1
1 89 . 5 1 1 A 17 17 GLU HA H 17 4.990 4.465 0.525 1
1 90 . 5 1 1 A 17 17 GLU C C 17 174.790 177.021 -2.231 1
1 91 . 5 1 1 A 17 17 GLU CA C 17 53.910 55.412 -1.502 1
1 92 . 5 1 1 A 17 17 GLU N N 17 116.560 118.318 -1.758 1
1 93 . 5 1 1 A 18 18 GLY H H 18 9.100 8.535 0.565 1
1 94 . 5 1 1 A 18 18 GLY N N 18 113.230 111.272 1.958 1
1 95 . 5 1 1 A 19 19 ASP H H 19 7.730 8.622 -0.892 1
1 96 . 5 1 1 A 19 19 ASP N N 19 126.280 121.698 4.582 1
1 97 . 5 1 1 A 21 21 ASN H H 21 9.090 8.215 0.875 1
1 98 . 5 1 1 A 21 21 ASN N N 21 115.850 115.207 0.643 1
1 99 . 5 1 1 A 24 24 SER C C 24 176.120 174.555 1.565 1
1 100 . 5 1 1 A 25 25 LYS H H 25 10.400 8.612 1.788 1
1 101 . 5 1 1 A 25 25 LYS C C 25 177.600 177.925 -0.325 1
1 102 . 5 1 1 A 25 25 LYS N N 25 124.350 125.021 -0.671 1
1 103 . 5 1 1 A 26 26 GLU H H 26 9.250 8.330 0.920 1
1 104 . 5 1 1 A 26 26 GLU N N 26 118.470 117.668 0.802 1
1 105 . 5 1 1 A 27 27 GLU C C 27 178.580 178.652 -0.072 1
1 106 . 5 1 1 A 27 27 GLU CA C 27 59.920 59.133 0.787 1
1 107 . 5 1 1 A 28 28 LEU H H 28 10.810 9.169 1.641 1
1 108 . 5 1 1 A 28 28 LEU C C 28 177.280 178.472 -1.192 1
1 109 . 5 1 1 A 28 28 LEU CB C 28 43.570 41.746 1.824 1
1 110 . 5 1 1 A 28 28 LEU N N 28 121.060 121.806 -0.746 1
1 111 . 5 1 1 A 29 29 LYS H H 29 9.680 8.482 1.198 1
1 112 . 5 1 1 A 29 29 LYS HA H 29 4.480 3.945 0.535 1
1 113 . 5 1 1 A 29 29 LYS C C 29 176.670 178.684 -2.014 1
1 114 . 5 1 1 A 29 29 LYS CA C 29 60.770 60.017 0.753 1
1 115 . 5 1 1 A 29 29 LYS CB C 29 32.910 32.479 0.431 1
1 116 . 5 1 1 A 29 29 LYS N N 29 121.140 119.128 2.012 1
1 117 . 5 1 1 A 30 30 LEU H H 30 8.410 7.881 0.529 1
1 118 . 5 1 1 A 30 30 LEU CA C 30 57.730 57.899 -0.169 1
1 119 . 5 1 1 A 30 30 LEU CB C 30 42.570 42.012 0.558 1
1 120 . 5 1 1 A 30 30 LEU N N 30 119.000 119.529 -0.529 1
1 121 . 5 1 1 A 31 31 LEU H H 31 9.010 7.899 1.111 1
1 122 . 5 1 1 A 31 31 LEU HA H 31 2.920 3.462 -0.542 1
1 123 . 5 1 1 A 31 31 LEU C C 31 178.280 178.109 0.171 1
1 124 . 5 1 1 A 31 31 LEU CA C 31 59.030 58.348 0.682 1
1 125 . 5 1 1 A 31 31 LEU N N 31 124.840 119.690 5.150 1
1 126 . 5 1 1 A 32 32 LEU H H 32 9.680 8.968 0.712 1
1 127 . 5 1 1 A 32 32 LEU HA H 32 4.490 4.159 0.331 1
1 128 . 5 1 1 A 32 32 LEU C C 32 177.360 179.793 -2.433 1
1 129 . 5 1 1 A 32 32 LEU CA C 32 58.520 57.255 1.265 1
1 130 . 5 1 1 A 32 32 LEU CB C 32 42.760 41.492 1.268 1
1 131 . 5 1 1 A 32 32 LEU N N 32 120.580 119.017 1.563 1
1 132 . 5 1 1 A 33 33 GLN H H 33 9.140 8.157 0.983 1
1 133 . 5 1 1 A 33 33 GLN HA H 33 4.250 4.132 0.118 1
1 134 . 5 1 1 A 33 33 GLN C C 33 176.050 178.365 -2.315 1
1 135 . 5 1 1 A 33 33 GLN CA C 33 58.600 58.782 -0.182 1
1 136 . 5 1 1 A 33 33 GLN CB C 33 29.730 28.595 1.135 1
1 137 . 5 1 1 A 33 33 GLN N N 33 115.010 119.723 -4.713 1
1 138 . 5 1 1 A 34 34 THR H H 34 8.000 7.896 0.104 1
1 139 . 5 1 1 A 34 34 THR HA H 34 4.390 4.028 0.362 1
1 140 . 5 1 1 A 34 34 THR C C 34 174.130 175.950 -1.820 1
1 141 . 5 1 1 A 34 34 THR CA C 34 65.250 66.390 -1.140 1
1 142 . 5 1 1 A 34 34 THR CB C 34 69.920 69.134 0.786 1
1 143 . 5 1 1 A 34 34 THR N N 34 111.180 114.532 -3.352 1
1 144 . 5 1 1 A 35 35 GLU H H 35 8.810 8.609 0.201 1
1 145 . 5 1 1 A 35 35 GLU HA H 35 4.470 4.004 0.466 1
1 146 . 5 1 1 A 35 35 GLU C C 35 175.430 176.233 -0.803 1
1 147 . 5 1 1 A 35 35 GLU CA C 35 56.170 59.243 -3.073 1
1 148 . 5 1 1 A 35 35 GLU CB C 35 30.900 29.777 1.123 1
1 149 . 5 1 1 A 35 35 GLU N N 35 116.410 121.692 -5.282 1
1 150 . 5 1 1 A 36 36 PHE H H 36 8.230 7.960 0.270 1
1 151 . 5 1 1 A 36 36 PHE HA H 36 5.500 5.073 0.427 1
1 152 . 5 1 1 A 36 36 PHE N N 36 115.090 115.804 -0.714 1
1 153 . 5 1 1 A 37 37 PRO C C 37 178.140 177.622 0.518 1
1 154 . 5 1 1 A 37 37 PRO CA C 37 64.940 64.318 0.622 1
1 155 . 5 1 1 A 37 37 PRO CB C 37 31.600 32.082 -0.482 1
1 156 . 5 1 1 A 38 38 SER H H 38 8.660 8.322 0.338 1
1 157 . 5 1 1 A 38 38 SER HA H 38 4.500 4.281 0.219 1
1 158 . 5 1 1 A 38 38 SER C C 38 174.830 177.510 -2.680 1
1 159 . 5 1 1 A 38 38 SER CA C 38 59.970 60.685 -0.715 1
1 160 . 5 1 1 A 38 38 SER CB C 38 62.690 63.041 -0.351 1
1 161 . 5 1 1 A 38 38 SER N N 38 114.030 113.333 0.697 1
1 162 . 5 1 1 A 39 39 LEU H H 39 8.260 8.027 0.233 1
1 163 . 5 1 1 A 39 39 LEU HA H 39 4.520 4.111 0.409 1
1 164 . 5 1 1 A 39 39 LEU C C 39 176.780 177.985 -1.205 1
1 165 . 5 1 1 A 39 39 LEU CA C 39 56.600 57.315 -0.715 1
1 166 . 5 1 1 A 39 39 LEU CB C 39 42.610 41.386 1.224 1
1 167 . 5 1 1 A 39 39 LEU N N 39 122.650 121.863 0.787 1
1 168 . 5 1 1 A 40 40 LEU H H 40 8.070 7.617 0.453 1
1 169 . 5 1 1 A 40 40 LEU HA H 40 4.830 4.258 0.572 1
1 170 . 5 1 1 A 40 40 LEU C C 40 175.690 177.602 -1.912 1
1 171 . 5 1 1 A 40 40 LEU CA C 40 54.510 55.633 -1.123 1
1 172 . 5 1 1 A 40 40 LEU CB C 40 42.020 41.571 0.449 1
1 173 . 5 1 1 A 40 40 LEU N N 40 117.390 117.576 -0.186 1
1 174 . 5 1 1 A 41 41 LYS H H 41 7.770 7.813 -0.043 1
1 175 . 5 1 1 A 41 41 LYS HA H 41 4.610 4.318 0.292 1
1 176 . 5 1 1 A 41 41 LYS C C 41 175.380 177.400 -2.020 1
1 177 . 5 1 1 A 41 41 LYS CA C 41 56.170 57.444 -1.274 1
1 178 . 5 1 1 A 41 41 LYS CB C 41 32.950 33.230 -0.280 1
1 179 . 5 1 1 A 41 41 LYS N N 41 120.530 117.270 3.260 1
1 180 . 5 1 1 A 42 42 GLY H H 42 8.390 7.832 0.558 1
1 181 . 5 1 1 A 42 42 GLY HA2 H 42 4.280 4.094 0.186 1
1 182 . 5 1 1 A 42 42 GLY HA3 H 42 4.280 4.095 0.185 1
1 183 . 5 1 1 A 42 42 GLY C C 42 177.190 174.812 2.378 1
1 184 . 5 1 1 A 42 42 GLY N N 42 109.280 108.885 0.395 1
1 185 . 5 1 1 A 43 43 MET H H 43 9.020 8.572 0.448 1
1 186 . 5 1 1 A 43 43 MET C C 43 175.520 175.746 -0.226 1
1 187 . 5 1 1 A 43 43 MET N N 43 121.110 119.021 2.089 1
1 188 . 5 1 1 A 44 44 SER H H 44 8.700 7.800 0.900 1
1 189 . 5 1 1 A 44 44 SER C C 44 173.540 174.159 -0.619 1
1 190 . 5 1 1 A 44 44 SER N N 44 116.190 116.809 -0.619 1
1 191 . 5 1 1 A 45 45 THR H H 45 8.440 8.724 -0.284 1
1 192 . 5 1 1 A 45 45 THR C C 45 174.300 175.340 -1.040 1
1 193 . 5 1 1 A 45 45 THR N N 45 113.740 119.375 -5.635 1
1 194 . 5 1 1 A 46 46 LEU H H 46 9.380 8.768 0.612 1
1 195 . 5 1 1 A 46 46 LEU C C 46 177.760 178.174 -0.414 1
1 196 . 5 1 1 A 46 46 LEU N N 46 123.970 123.468 0.502 1
1 197 . 5 1 1 A 47 47 ASP H H 47 8.990 8.228 0.762 1
1 198 . 5 1 1 A 47 47 ASP N N 47 118.620 118.175 0.445 1
1 199 . 5 1 1 A 49 49 LEU H H 49 9.740 9.011 0.729 1
1 200 . 5 1 1 A 49 49 LEU N N 49 123.880 120.457 3.423 1
1 201 . 5 1 1 A 50 50 PHE H H 50 10.730 9.074 1.656 1
1 202 . 5 1 1 A 50 50 PHE N N 50 121.380 119.360 2.020 1
1 203 . 5 1 1 A 51 51 GLU H H 51 7.860 8.335 -0.475 1
1 204 . 5 1 1 A 51 51 GLU HA H 51 3.530 3.940 -0.410 1
1 205 . 5 1 1 A 51 51 GLU N N 51 114.870 118.912 -4.042 1
1 206 . 5 1 1 A 66 66 PHE CA C 66 58.850 61.390 -2.540 1
1 207 . 5 1 1 A 67 67 GLN H H 67 5.670 9.075 -3.405 1
1 208 . 5 1 1 A 67 67 GLN C C 67 174.810 178.173 -3.363 1
1 209 . 5 1 1 A 67 67 GLN CA C 67 56.340 58.481 -2.141 1
1 210 . 5 1 1 A 67 67 GLN N N 67 114.050 117.444 -3.394 1
1 211 . 5 1 1 A 68 68 VAL H H 68 5.760 8.003 -2.243 1
1 212 . 5 1 1 A 68 68 VAL C C 68 175.770 178.529 -2.759 1
1 213 . 5 1 1 A 68 68 VAL CA C 68 63.990 66.039 -2.049 1
1 214 . 5 1 1 A 68 68 VAL CB C 68 31.310 31.477 -0.167 1
1 215 . 5 1 1 A 68 68 VAL N N 68 116.280 119.770 -3.490 1
1 216 . 5 1 1 A 69 69 LEU H H 69 7.150 8.656 -1.506 1
1 217 . 5 1 1 A 69 69 LEU HA H 69 4.040 4.043 -0.003 1
1 218 . 5 1 1 A 69 69 LEU C C 69 176.210 178.213 -2.003 1
1 219 . 5 1 1 A 69 69 LEU CA C 69 56.270 57.663 -1.393 1
1 220 . 5 1 1 A 69 69 LEU CB C 69 42.010 41.554 0.456 1
1 221 . 5 1 1 A 69 69 LEU N N 69 120.350 121.164 -0.814 1
1 222 . 5 1 1 A 70 70 VAL H H 70 6.810 7.352 -0.542 1
1 223 . 5 1 1 A 70 70 VAL HA H 70 3.170 3.263 -0.093 1
1 224 . 5 1 1 A 70 70 VAL C C 70 175.760 177.647 -1.887 1
1 225 . 5 1 1 A 70 70 VAL CA C 70 65.110 66.785 -1.675 1
1 226 . 5 1 1 A 70 70 VAL CB C 70 31.190 31.132 0.058 1
1 227 . 5 1 1 A 70 70 VAL N N 70 115.790 118.964 -3.174 1
1 228 . 5 1 1 A 71 71 LYS H H 71 7.190 8.449 -1.259 1
1 229 . 5 1 1 A 71 71 LYS HA H 71 3.880 3.909 -0.029 1
1 230 . 5 1 1 A 71 71 LYS C C 71 176.100 179.142 -3.042 1
1 231 . 5 1 1 A 71 71 LYS CA C 71 57.680 59.387 -1.707 1
1 232 . 5 1 1 A 71 71 LYS CB C 71 31.930 32.186 -0.256 1
1 233 . 5 1 1 A 71 71 LYS N N 71 117.820 119.841 -2.021 1
1 234 . 5 1 1 A 72 72 LYS H H 72 7.450 7.284 0.166 1
1 235 . 5 1 1 A 72 72 LYS HA H 72 4.180 4.073 0.107 1
1 236 . 5 1 1 A 72 72 LYS C C 72 176.180 179.285 -3.105 1
1 237 . 5 1 1 A 72 72 LYS CA C 72 56.950 58.257 -1.307 1
1 238 . 5 1 1 A 72 72 LYS CB C 72 33.610 31.934 1.676 1
1 239 . 5 1 1 A 72 72 LYS N N 72 116.930 118.165 -1.235 1
1 240 . 5 1 1 A 73 73 ILE H H 73 7.440 7.912 -0.472 1
1 241 . 5 1 1 A 73 73 ILE HA H 73 4.180 3.582 0.598 1
1 242 . 5 1 1 A 73 73 ILE C C 73 174.440 178.197 -3.757 1
1 243 . 5 1 1 A 73 73 ILE CA C 73 61.510 64.222 -2.712 1
1 244 . 5 1 1 A 73 73 ILE CB C 73 38.610 37.304 1.306 1
1 245 . 5 1 1 A 73 73 ILE N N 73 114.560 121.617 -7.057 1
1 246 . 5 1 1 A 74 74 SER H H 74 7.790 8.598 -0.808 1
1 247 . 5 1 1 A 74 74 SER HA H 74 4.520 4.154 0.366 1
1 248 . 5 1 1 A 74 74 SER C C 74 171.580 177.495 -5.915 1
1 249 . 5 1 1 A 74 74 SER CA C 74 57.960 61.286 -3.326 1
1 250 . 5 1 1 A 74 74 SER CB C 74 63.820 62.805 1.015 1
1 251 . 5 1 1 A 74 74 SER N N 74 117.310 116.345 0.965 1
1 6 . 6 1 1 A 2 2 SER H H 2 9.010 8.649 0.361 1
1 7 . 6 1 1 A 2 2 SER HA H 2 4.680 4.807 -0.127 1
1 8 . 6 1 1 A 2 2 SER N N 2 119.390 119.999 -0.609 1
1 9 . 6 1 1 A 3 3 PRO C C 3 177.630 178.940 -1.310 1
1 10 . 6 1 1 A 3 3 PRO CA C 3 65.000 64.762 0.238 1
1 11 . 6 1 1 A 3 3 PRO CB C 3 31.790 32.146 -0.356 1
1 12 . 6 1 1 A 4 4 GLU H H 4 8.600 8.111 0.489 1
1 13 . 6 1 1 A 4 4 GLU HA H 4 3.900 4.113 -0.213 1
1 14 . 6 1 1 A 4 4 GLU C C 4 177.910 179.237 -1.327 1
1 15 . 6 1 1 A 4 4 GLU CB C 4 28.980 29.226 -0.246 1
1 16 . 6 1 1 A 4 4 GLU N N 4 117.750 117.803 -0.053 1
1 17 . 6 1 1 A 5 5 GLU H H 5 7.980 8.124 -0.144 1
1 18 . 6 1 1 A 5 5 GLU HA H 5 4.170 4.047 0.123 1
1 19 . 6 1 1 A 5 5 GLU C C 5 178.290 179.304 -1.014 1
1 20 . 6 1 1 A 5 5 GLU CA C 5 58.140 59.210 -1.070 1
1 21 . 6 1 1 A 5 5 GLU CB C 5 30.450 29.383 1.067 1
1 22 . 6 1 1 A 5 5 GLU N N 5 121.890 120.123 1.767 1
1 23 . 6 1 1 A 6 6 LEU H H 6 8.450 7.981 0.469 1
1 24 . 6 1 1 A 6 6 LEU HA H 6 4.310 4.010 0.300 1
1 25 . 6 1 1 A 6 6 LEU C C 6 176.660 178.740 -2.080 1
1 26 . 6 1 1 A 6 6 LEU CA C 6 57.310 57.756 -0.446 1
1 27 . 6 1 1 A 6 6 LEU CB C 6 42.090 41.718 0.372 1
1 28 . 6 1 1 A 6 6 LEU N N 6 120.250 120.651 -0.401 1
1 29 . 6 1 1 A 7 7 LYS H H 7 8.100 9.118 -1.018 1
1 30 . 6 1 1 A 7 7 LYS HA H 7 3.760 4.325 -0.565 1
1 31 . 6 1 1 A 7 7 LYS C C 7 176.160 179.558 -3.398 1
1 32 . 6 1 1 A 7 7 LYS CA C 7 59.110 59.981 -0.871 1
1 33 . 6 1 1 A 7 7 LYS CB C 7 32.110 32.615 -0.505 1
1 34 . 6 1 1 A 7 7 LYS N N 7 120.960 118.924 2.036 1
1 35 . 6 1 1 A 8 8 GLY H H 8 7.860 8.782 -0.922 1
1 36 . 6 1 1 A 8 8 GLY HA2 H 8 3.970 3.844 0.126 1
1 37 . 6 1 1 A 8 8 GLY HA3 H 8 3.970 3.879 0.091 1
1 38 . 6 1 1 A 8 8 GLY C C 8 175.520 176.085 -0.565 1
1 39 . 6 1 1 A 8 8 GLY CA C 8 46.490 47.466 -0.976 1
1 40 . 6 1 1 A 8 8 GLY N N 8 105.430 107.150 -1.720 1
1 41 . 6 1 1 A 9 9 ILE H H 9 8.130 9.543 -1.413 1
1 42 . 6 1 1 A 9 9 ILE HA H 9 4.140 3.919 0.221 1
1 43 . 6 1 1 A 9 9 ILE C C 9 175.320 177.972 -2.652 1
1 44 . 6 1 1 A 9 9 ILE CA C 9 65.010 64.749 0.261 1
1 45 . 6 1 1 A 9 9 ILE CB C 9 39.040 37.992 1.048 1
1 46 . 6 1 1 A 9 9 ILE N N 9 122.870 122.614 0.256 1
1 47 . 6 1 1 A 10 10 PHE H H 10 8.590 9.709 -1.119 1
1 48 . 6 1 1 A 10 10 PHE HA H 10 4.470 3.826 0.644 1
1 49 . 6 1 1 A 10 10 PHE C C 10 175.010 177.271 -2.261 1
1 50 . 6 1 1 A 10 10 PHE CA C 10 62.470 62.278 0.192 1
1 51 . 6 1 1 A 10 10 PHE CB C 10 39.670 38.873 0.797 1
1 52 . 6 1 1 A 10 10 PHE N N 10 120.430 120.481 -0.051 1
1 53 . 6 1 1 A 11 11 GLU H H 11 8.600 8.772 -0.172 1
1 54 . 6 1 1 A 11 11 GLU HA H 11 3.750 3.840 -0.090 1
1 55 . 6 1 1 A 11 11 GLU C C 11 177.630 178.479 -0.849 1
1 56 . 6 1 1 A 11 11 GLU CA C 11 58.440 59.557 -1.117 1
1 57 . 6 1 1 A 11 11 GLU CB C 11 29.840 28.829 1.011 1
1 58 . 6 1 1 A 11 11 GLU N N 11 115.410 118.551 -3.141 1
1 59 . 6 1 1 A 12 12 LYS H H 12 7.940 8.830 -0.890 1
1 60 . 6 1 1 A 12 12 LYS HA H 12 4.080 4.023 0.057 1
1 61 . 6 1 1 A 12 12 LYS CA C 12 58.440 58.996 -0.556 1
1 62 . 6 1 1 A 12 12 LYS CB C 12 32.720 32.339 0.381 1
1 63 . 6 1 1 A 12 12 LYS N N 12 119.220 119.836 -0.616 1
1 64 . 6 1 1 A 13 13 TYR H H 13 7.740 7.397 0.343 1
1 65 . 6 1 1 A 13 13 TYR HA H 13 4.580 4.372 0.208 1
1 66 . 6 1 1 A 13 13 TYR C C 13 39.870 178.283 -138.413 1
1 67 . 6 1 1 A 13 13 TYR CA C 13 61.280 60.465 0.815 1
1 68 . 6 1 1 A 13 13 TYR CB C 13 175.510 39.237 136.273 1
1 69 . 6 1 1 A 13 13 TYR N N 13 115.320 117.514 -2.194 1
1 70 . 6 1 1 A 14 14 ALA H H 14 9.060 8.744 0.316 1
1 71 . 6 1 1 A 14 14 ALA HA H 14 3.850 3.740 0.110 1
1 72 . 6 1 1 A 14 14 ALA C C 14 177.990 179.758 -1.768 1
1 73 . 6 1 1 A 14 14 ALA CA C 14 54.280 54.850 -0.570 1
1 74 . 6 1 1 A 14 14 ALA CB C 14 18.790 17.561 1.229 1
1 75 . 6 1 1 A 14 14 ALA N N 14 120.140 122.626 -2.486 1
1 76 . 6 1 1 A 15 15 ALA H H 15 7.350 8.815 -1.465 1
1 77 . 6 1 1 A 15 15 ALA HA H 15 4.550 4.068 0.482 1
1 78 . 6 1 1 A 15 15 ALA C C 15 176.270 179.445 -3.175 1
1 79 . 6 1 1 A 15 15 ALA CA C 15 52.280 55.045 -2.765 1
1 80 . 6 1 1 A 15 15 ALA CB C 15 19.670 18.264 1.406 1
1 81 . 6 1 1 A 15 15 ALA N N 15 117.640 120.525 -2.885 1
1 82 . 6 1 1 A 16 16 LYS H H 16 7.690 8.158 -0.468 1
1 83 . 6 1 1 A 16 16 LYS HA H 16 4.200 4.020 0.180 1
1 84 . 6 1 1 A 16 16 LYS C C 16 175.830 177.263 -1.433 1
1 85 . 6 1 1 A 16 16 LYS CA C 16 59.780 59.635 0.145 1
1 86 . 6 1 1 A 16 16 LYS CB C 16 33.300 32.279 1.021 1
1 87 . 6 1 1 A 16 16 LYS N N 16 120.340 117.474 2.866 1
1 88 . 6 1 1 A 17 17 GLU H H 17 10.170 8.070 2.100 1
1 89 . 6 1 1 A 17 17 GLU HA H 17 4.990 4.465 0.525 1
1 90 . 6 1 1 A 17 17 GLU C C 17 174.790 177.021 -2.231 1
1 91 . 6 1 1 A 17 17 GLU CA C 17 53.910 55.412 -1.502 1
1 92 . 6 1 1 A 17 17 GLU N N 17 116.560 118.318 -1.758 1
1 93 . 6 1 1 A 18 18 GLY H H 18 9.100 8.535 0.565 1
1 94 . 6 1 1 A 18 18 GLY N N 18 113.230 111.272 1.958 1
1 95 . 6 1 1 A 19 19 ASP H H 19 7.730 8.622 -0.892 1
1 96 . 6 1 1 A 19 19 ASP N N 19 126.280 121.698 4.582 1
1 97 . 6 1 1 A 21 21 ASN H H 21 9.090 8.215 0.875 1
1 98 . 6 1 1 A 21 21 ASN N N 21 115.850 115.207 0.643 1
1 99 . 6 1 1 A 24 24 SER C C 24 176.120 174.555 1.565 1
1 100 . 6 1 1 A 25 25 LYS H H 25 10.400 8.612 1.788 1
1 101 . 6 1 1 A 25 25 LYS C C 25 177.600 177.925 -0.325 1
1 102 . 6 1 1 A 25 25 LYS N N 25 124.350 125.021 -0.671 1
1 103 . 6 1 1 A 26 26 GLU H H 26 9.250 8.330 0.920 1
1 104 . 6 1 1 A 26 26 GLU N N 26 118.470 117.668 0.802 1
1 105 . 6 1 1 A 27 27 GLU C C 27 178.580 178.652 -0.072 1
1 106 . 6 1 1 A 27 27 GLU CA C 27 59.920 59.133 0.787 1
1 107 . 6 1 1 A 28 28 LEU H H 28 10.810 9.169 1.641 1
1 108 . 6 1 1 A 28 28 LEU C C 28 177.280 178.472 -1.192 1
1 109 . 6 1 1 A 28 28 LEU CB C 28 43.570 41.746 1.824 1
1 110 . 6 1 1 A 28 28 LEU N N 28 121.060 121.806 -0.746 1
1 111 . 6 1 1 A 29 29 LYS H H 29 9.680 8.482 1.198 1
1 112 . 6 1 1 A 29 29 LYS HA H 29 4.480 3.945 0.535 1
1 113 . 6 1 1 A 29 29 LYS C C 29 176.670 178.684 -2.014 1
1 114 . 6 1 1 A 29 29 LYS CA C 29 60.770 60.017 0.753 1
1 115 . 6 1 1 A 29 29 LYS CB C 29 32.910 32.479 0.431 1
1 116 . 6 1 1 A 29 29 LYS N N 29 121.140 119.128 2.012 1
1 117 . 6 1 1 A 30 30 LEU H H 30 8.410 7.881 0.529 1
1 118 . 6 1 1 A 30 30 LEU CA C 30 57.730 57.899 -0.169 1
1 119 . 6 1 1 A 30 30 LEU CB C 30 42.570 42.012 0.558 1
1 120 . 6 1 1 A 30 30 LEU N N 30 119.000 119.529 -0.529 1
1 121 . 6 1 1 A 31 31 LEU H H 31 9.010 7.899 1.111 1
1 122 . 6 1 1 A 31 31 LEU HA H 31 2.920 3.462 -0.542 1
1 123 . 6 1 1 A 31 31 LEU C C 31 178.280 178.109 0.171 1
1 124 . 6 1 1 A 31 31 LEU CA C 31 59.030 58.348 0.682 1
1 125 . 6 1 1 A 31 31 LEU N N 31 124.840 119.690 5.150 1
1 126 . 6 1 1 A 32 32 LEU H H 32 9.680 8.968 0.712 1
1 127 . 6 1 1 A 32 32 LEU HA H 32 4.490 4.159 0.331 1
1 128 . 6 1 1 A 32 32 LEU C C 32 177.360 179.793 -2.433 1
1 129 . 6 1 1 A 32 32 LEU CA C 32 58.520 57.255 1.265 1
1 130 . 6 1 1 A 32 32 LEU CB C 32 42.760 41.492 1.268 1
1 131 . 6 1 1 A 32 32 LEU N N 32 120.580 119.017 1.563 1
1 132 . 6 1 1 A 33 33 GLN H H 33 9.140 8.157 0.983 1
1 133 . 6 1 1 A 33 33 GLN HA H 33 4.250 4.132 0.118 1
1 134 . 6 1 1 A 33 33 GLN C C 33 176.050 178.365 -2.315 1
1 135 . 6 1 1 A 33 33 GLN CA C 33 58.600 58.782 -0.182 1
1 136 . 6 1 1 A 33 33 GLN CB C 33 29.730 28.595 1.135 1
1 137 . 6 1 1 A 33 33 GLN N N 33 115.010 119.723 -4.713 1
1 138 . 6 1 1 A 34 34 THR H H 34 8.000 7.896 0.104 1
1 139 . 6 1 1 A 34 34 THR HA H 34 4.390 4.028 0.362 1
1 140 . 6 1 1 A 34 34 THR C C 34 174.130 175.950 -1.820 1
1 141 . 6 1 1 A 34 34 THR CA C 34 65.250 66.390 -1.140 1
1 142 . 6 1 1 A 34 34 THR CB C 34 69.920 69.134 0.786 1
1 143 . 6 1 1 A 34 34 THR N N 34 111.180 114.532 -3.352 1
1 144 . 6 1 1 A 35 35 GLU H H 35 8.810 8.609 0.201 1
1 145 . 6 1 1 A 35 35 GLU HA H 35 4.470 4.004 0.466 1
1 146 . 6 1 1 A 35 35 GLU C C 35 175.430 176.233 -0.803 1
1 147 . 6 1 1 A 35 35 GLU CA C 35 56.170 59.243 -3.073 1
1 148 . 6 1 1 A 35 35 GLU CB C 35 30.900 29.777 1.123 1
1 149 . 6 1 1 A 35 35 GLU N N 35 116.410 121.692 -5.282 1
1 150 . 6 1 1 A 36 36 PHE H H 36 8.230 7.960 0.270 1
1 151 . 6 1 1 A 36 36 PHE HA H 36 5.500 5.073 0.427 1
1 152 . 6 1 1 A 36 36 PHE N N 36 115.090 115.804 -0.714 1
1 153 . 6 1 1 A 37 37 PRO C C 37 178.140 177.622 0.518 1
1 154 . 6 1 1 A 37 37 PRO CA C 37 64.940 64.318 0.622 1
1 155 . 6 1 1 A 37 37 PRO CB C 37 31.600 32.082 -0.482 1
1 156 . 6 1 1 A 38 38 SER H H 38 8.660 8.322 0.338 1
1 157 . 6 1 1 A 38 38 SER HA H 38 4.500 4.281 0.219 1
1 158 . 6 1 1 A 38 38 SER C C 38 174.830 177.510 -2.680 1
1 159 . 6 1 1 A 38 38 SER CA C 38 59.970 60.685 -0.715 1
1 160 . 6 1 1 A 38 38 SER CB C 38 62.690 63.041 -0.351 1
1 161 . 6 1 1 A 38 38 SER N N 38 114.030 113.333 0.697 1
1 162 . 6 1 1 A 39 39 LEU H H 39 8.260 8.027 0.233 1
1 163 . 6 1 1 A 39 39 LEU HA H 39 4.520 4.111 0.409 1
1 164 . 6 1 1 A 39 39 LEU C C 39 176.780 177.985 -1.205 1
1 165 . 6 1 1 A 39 39 LEU CA C 39 56.600 57.315 -0.715 1
1 166 . 6 1 1 A 39 39 LEU CB C 39 42.610 41.386 1.224 1
1 167 . 6 1 1 A 39 39 LEU N N 39 122.650 121.863 0.787 1
1 168 . 6 1 1 A 40 40 LEU H H 40 8.070 7.617 0.453 1
1 169 . 6 1 1 A 40 40 LEU HA H 40 4.830 4.258 0.572 1
1 170 . 6 1 1 A 40 40 LEU C C 40 175.690 177.602 -1.912 1
1 171 . 6 1 1 A 40 40 LEU CA C 40 54.510 55.633 -1.123 1
1 172 . 6 1 1 A 40 40 LEU CB C 40 42.020 41.571 0.449 1
1 173 . 6 1 1 A 40 40 LEU N N 40 117.390 117.576 -0.186 1
1 174 . 6 1 1 A 41 41 LYS H H 41 7.770 7.813 -0.043 1
1 175 . 6 1 1 A 41 41 LYS HA H 41 4.610 4.318 0.292 1
1 176 . 6 1 1 A 41 41 LYS C C 41 175.380 177.400 -2.020 1
1 177 . 6 1 1 A 41 41 LYS CA C 41 56.170 57.444 -1.274 1
1 178 . 6 1 1 A 41 41 LYS CB C 41 32.950 33.230 -0.280 1
1 179 . 6 1 1 A 41 41 LYS N N 41 120.530 117.270 3.260 1
1 180 . 6 1 1 A 42 42 GLY H H 42 8.390 7.832 0.558 1
1 181 . 6 1 1 A 42 42 GLY HA2 H 42 4.280 4.094 0.186 1
1 182 . 6 1 1 A 42 42 GLY HA3 H 42 4.280 4.095 0.185 1
1 183 . 6 1 1 A 42 42 GLY C C 42 177.190 174.812 2.378 1
1 184 . 6 1 1 A 42 42 GLY N N 42 109.280 108.885 0.395 1
1 185 . 6 1 1 A 43 43 MET H H 43 9.020 8.572 0.448 1
1 186 . 6 1 1 A 43 43 MET C C 43 175.520 175.746 -0.226 1
1 187 . 6 1 1 A 43 43 MET N N 43 121.110 119.021 2.089 1
1 188 . 6 1 1 A 44 44 SER H H 44 8.700 7.800 0.900 1
1 189 . 6 1 1 A 44 44 SER C C 44 173.540 174.159 -0.619 1
1 190 . 6 1 1 A 44 44 SER N N 44 116.190 116.809 -0.619 1
1 191 . 6 1 1 A 45 45 THR H H 45 8.440 8.724 -0.284 1
1 192 . 6 1 1 A 45 45 THR C C 45 174.300 175.340 -1.040 1
1 193 . 6 1 1 A 45 45 THR N N 45 113.740 119.375 -5.635 1
1 194 . 6 1 1 A 46 46 LEU H H 46 9.380 8.768 0.612 1
1 195 . 6 1 1 A 46 46 LEU C C 46 177.760 178.174 -0.414 1
1 196 . 6 1 1 A 46 46 LEU N N 46 123.970 123.468 0.502 1
1 197 . 6 1 1 A 47 47 ASP H H 47 8.990 8.228 0.762 1
1 198 . 6 1 1 A 47 47 ASP N N 47 118.620 118.175 0.445 1
1 199 . 6 1 1 A 49 49 LEU H H 49 9.740 9.011 0.729 1
1 200 . 6 1 1 A 49 49 LEU N N 49 123.880 120.457 3.423 1
1 201 . 6 1 1 A 50 50 PHE H H 50 10.730 9.074 1.656 1
1 202 . 6 1 1 A 50 50 PHE N N 50 121.380 119.360 2.020 1
1 203 . 6 1 1 A 51 51 GLU H H 51 7.860 8.335 -0.475 1
1 204 . 6 1 1 A 51 51 GLU HA H 51 3.530 3.940 -0.410 1
1 205 . 6 1 1 A 51 51 GLU N N 51 114.870 118.912 -4.042 1
1 206 . 6 1 1 A 66 66 PHE CA C 66 58.850 61.390 -2.540 1
1 207 . 6 1 1 A 67 67 GLN H H 67 5.670 9.075 -3.405 1
1 208 . 6 1 1 A 67 67 GLN C C 67 174.810 178.173 -3.363 1
1 209 . 6 1 1 A 67 67 GLN CA C 67 56.340 58.481 -2.141 1
1 210 . 6 1 1 A 67 67 GLN N N 67 114.050 117.444 -3.394 1
1 211 . 6 1 1 A 68 68 VAL H H 68 5.760 8.003 -2.243 1
1 212 . 6 1 1 A 68 68 VAL C C 68 175.770 178.529 -2.759 1
1 213 . 6 1 1 A 68 68 VAL CA C 68 63.990 66.039 -2.049 1
1 214 . 6 1 1 A 68 68 VAL CB C 68 31.310 31.477 -0.167 1
1 215 . 6 1 1 A 68 68 VAL N N 68 116.280 119.770 -3.490 1
1 216 . 6 1 1 A 69 69 LEU H H 69 7.150 8.656 -1.506 1
1 217 . 6 1 1 A 69 69 LEU HA H 69 4.040 4.043 -0.003 1
1 218 . 6 1 1 A 69 69 LEU C C 69 176.210 178.213 -2.003 1
1 219 . 6 1 1 A 69 69 LEU CA C 69 56.270 57.663 -1.393 1
1 220 . 6 1 1 A 69 69 LEU CB C 69 42.010 41.554 0.456 1
1 221 . 6 1 1 A 69 69 LEU N N 69 120.350 121.164 -0.814 1
1 222 . 6 1 1 A 70 70 VAL H H 70 6.810 7.352 -0.542 1
1 223 . 6 1 1 A 70 70 VAL HA H 70 3.170 3.263 -0.093 1
1 224 . 6 1 1 A 70 70 VAL C C 70 175.760 177.647 -1.887 1
1 225 . 6 1 1 A 70 70 VAL CA C 70 65.110 66.785 -1.675 1
1 226 . 6 1 1 A 70 70 VAL CB C 70 31.190 31.132 0.058 1
1 227 . 6 1 1 A 70 70 VAL N N 70 115.790 118.964 -3.174 1
1 228 . 6 1 1 A 71 71 LYS H H 71 7.190 8.449 -1.259 1
1 229 . 6 1 1 A 71 71 LYS HA H 71 3.880 3.909 -0.029 1
1 230 . 6 1 1 A 71 71 LYS C C 71 176.100 179.142 -3.042 1
1 231 . 6 1 1 A 71 71 LYS CA C 71 57.680 59.387 -1.707 1
1 232 . 6 1 1 A 71 71 LYS CB C 71 31.930 32.186 -0.256 1
1 233 . 6 1 1 A 71 71 LYS N N 71 117.820 119.841 -2.021 1
1 234 . 6 1 1 A 72 72 LYS H H 72 7.450 7.284 0.166 1
1 235 . 6 1 1 A 72 72 LYS HA H 72 4.180 4.073 0.107 1
1 236 . 6 1 1 A 72 72 LYS C C 72 176.180 179.285 -3.105 1
1 237 . 6 1 1 A 72 72 LYS CA C 72 56.950 58.257 -1.307 1
1 238 . 6 1 1 A 72 72 LYS CB C 72 33.610 31.934 1.676 1
1 239 . 6 1 1 A 72 72 LYS N N 72 116.930 118.165 -1.235 1
1 240 . 6 1 1 A 73 73 ILE H H 73 7.440 7.912 -0.472 1
1 241 . 6 1 1 A 73 73 ILE HA H 73 4.180 3.582 0.598 1
1 242 . 6 1 1 A 73 73 ILE C C 73 174.440 178.197 -3.757 1
1 243 . 6 1 1 A 73 73 ILE CA C 73 61.510 64.222 -2.712 1
1 244 . 6 1 1 A 73 73 ILE CB C 73 38.610 37.304 1.306 1
1 245 . 6 1 1 A 73 73 ILE N N 73 114.560 121.617 -7.057 1
1 246 . 6 1 1 A 74 74 SER H H 74 7.790 8.598 -0.808 1
1 247 . 6 1 1 A 74 74 SER HA H 74 4.520 4.154 0.366 1
1 248 . 6 1 1 A 74 74 SER C C 74 171.580 177.495 -5.915 1
1 249 . 6 1 1 A 74 74 SER CA C 74 57.960 61.286 -3.326 1
1 250 . 6 1 1 A 74 74 SER CB C 74 63.820 62.805 1.015 1
1 251 . 6 1 1 A 74 74 SER N N 74 117.310 116.345 0.965 1
1 6 . 7 1 1 A 2 2 SER H H 2 9.010 8.395 0.615 1
1 7 . 7 1 1 A 2 2 SER HA H 2 4.680 4.580 0.100 1
1 8 . 7 1 1 A 2 2 SER N N 2 119.390 115.412 3.978 1
1 9 . 7 1 1 A 3 3 PRO C C 3 177.630 178.880 -1.250 1
1 10 . 7 1 1 A 3 3 PRO CA C 3 65.000 64.973 0.027 1
1 11 . 7 1 1 A 3 3 PRO CB C 3 31.790 32.113 -0.323 1
1 12 . 7 1 1 A 4 4 GLU H H 4 8.600 8.471 0.129 1
1 13 . 7 1 1 A 4 4 GLU HA H 4 3.900 4.103 -0.203 1
1 14 . 7 1 1 A 4 4 GLU C C 4 177.910 179.551 -1.641 1
1 15 . 7 1 1 A 4 4 GLU CB C 4 28.980 29.108 -0.128 1
1 16 . 7 1 1 A 4 4 GLU N N 4 117.750 117.922 -0.172 1
1 17 . 7 1 1 A 5 5 GLU H H 5 7.980 8.123 -0.143 1
1 18 . 7 1 1 A 5 5 GLU HA H 5 4.170 4.095 0.075 1
1 19 . 7 1 1 A 5 5 GLU C C 5 178.290 179.244 -0.954 1
1 20 . 7 1 1 A 5 5 GLU CA C 5 58.140 59.214 -1.074 1
1 21 . 7 1 1 A 5 5 GLU CB C 5 30.450 29.306 1.144 1
1 22 . 7 1 1 A 5 5 GLU N N 5 121.890 120.235 1.655 1
1 23 . 7 1 1 A 6 6 LEU H H 6 8.450 8.063 0.387 1
1 24 . 7 1 1 A 6 6 LEU HA H 6 4.310 4.019 0.291 1
1 25 . 7 1 1 A 6 6 LEU C C 6 176.660 178.876 -2.216 1
1 26 . 7 1 1 A 6 6 LEU CA C 6 57.310 57.766 -0.456 1
1 27 . 7 1 1 A 6 6 LEU CB C 6 42.090 41.813 0.277 1
1 28 . 7 1 1 A 6 6 LEU N N 6 120.250 120.574 -0.324 1
1 29 . 7 1 1 A 7 7 LYS H H 7 8.100 8.966 -0.866 1
1 30 . 7 1 1 A 7 7 LYS HA H 7 3.760 4.021 -0.261 1
1 31 . 7 1 1 A 7 7 LYS C C 7 176.160 179.383 -3.223 1
1 32 . 7 1 1 A 7 7 LYS CA C 7 59.110 59.806 -0.696 1
1 33 . 7 1 1 A 7 7 LYS CB C 7 32.110 32.343 -0.233 1
1 34 . 7 1 1 A 7 7 LYS N N 7 120.960 118.377 2.583 1
1 35 . 7 1 1 A 8 8 GLY H H 8 7.860 8.591 -0.731 1
1 36 . 7 1 1 A 8 8 GLY HA2 H 8 3.970 3.792 0.178 1
1 37 . 7 1 1 A 8 8 GLY HA3 H 8 3.970 3.794 0.176 1
1 38 . 7 1 1 A 8 8 GLY C C 8 175.520 176.191 -0.671 1
1 39 . 7 1 1 A 8 8 GLY CA C 8 46.490 47.483 -0.993 1
1 40 . 7 1 1 A 8 8 GLY N N 8 105.430 107.256 -1.826 1
1 41 . 7 1 1 A 9 9 ILE H H 9 8.130 9.512 -1.382 1
1 42 . 7 1 1 A 9 9 ILE HA H 9 4.140 3.896 0.244 1
1 43 . 7 1 1 A 9 9 ILE C C 9 175.320 178.040 -2.720 1
1 44 . 7 1 1 A 9 9 ILE CA C 9 65.010 64.597 0.413 1
1 45 . 7 1 1 A 9 9 ILE CB C 9 39.040 37.963 1.077 1
1 46 . 7 1 1 A 9 9 ILE N N 9 122.870 122.497 0.373 1
1 47 . 7 1 1 A 10 10 PHE H H 10 8.590 9.747 -1.157 1
1 48 . 7 1 1 A 10 10 PHE HA H 10 4.470 4.023 0.447 1
1 49 . 7 1 1 A 10 10 PHE C C 10 175.010 177.223 -2.213 1
1 50 . 7 1 1 A 10 10 PHE CA C 10 62.470 62.537 -0.067 1
1 51 . 7 1 1 A 10 10 PHE CB C 10 39.670 39.274 0.396 1
1 52 . 7 1 1 A 10 10 PHE N N 10 120.430 120.465 -0.035 1
1 53 . 7 1 1 A 11 11 GLU H H 11 8.600 8.917 -0.317 1
1 54 . 7 1 1 A 11 11 GLU HA H 11 3.750 3.736 0.014 1
1 55 . 7 1 1 A 11 11 GLU C C 11 177.630 178.548 -0.918 1
1 56 . 7 1 1 A 11 11 GLU CA C 11 58.440 59.551 -1.111 1
1 57 . 7 1 1 A 11 11 GLU CB C 11 29.840 29.004 0.836 1
1 58 . 7 1 1 A 11 11 GLU N N 11 115.410 118.172 -2.762 1
1 59 . 7 1 1 A 12 12 LYS H H 12 7.940 8.628 -0.688 1
1 60 . 7 1 1 A 12 12 LYS HA H 12 4.080 3.945 0.135 1
1 61 . 7 1 1 A 12 12 LYS CA C 12 58.440 58.985 -0.545 1
1 62 . 7 1 1 A 12 12 LYS CB C 12 32.720 32.271 0.449 1
1 63 . 7 1 1 A 12 12 LYS N N 12 119.220 119.768 -0.548 1
1 64 . 7 1 1 A 13 13 TYR H H 13 7.740 7.364 0.376 1
1 65 . 7 1 1 A 13 13 TYR HA H 13 4.580 4.366 0.214 1
1 66 . 7 1 1 A 13 13 TYR C C 13 39.870 178.456 -138.586 1
1 67 . 7 1 1 A 13 13 TYR CA C 13 61.280 60.332 0.948 1
1 68 . 7 1 1 A 13 13 TYR CB C 13 175.510 39.276 136.234 1
1 69 . 7 1 1 A 13 13 TYR N N 13 115.320 117.448 -2.128 1
1 70 . 7 1 1 A 14 14 ALA H H 14 9.060 8.564 0.496 1
1 71 . 7 1 1 A 14 14 ALA HA H 14 3.850 3.845 0.005 1
1 72 . 7 1 1 A 14 14 ALA C C 14 177.990 179.718 -1.728 1
1 73 . 7 1 1 A 14 14 ALA CA C 14 54.280 54.665 -0.385 1
1 74 . 7 1 1 A 14 14 ALA CB C 14 18.790 17.862 0.928 1
1 75 . 7 1 1 A 14 14 ALA N N 14 120.140 122.636 -2.496 1
1 76 . 7 1 1 A 15 15 ALA H H 15 7.350 8.330 -0.980 1
1 77 . 7 1 1 A 15 15 ALA HA H 15 4.550 3.994 0.556 1
1 78 . 7 1 1 A 15 15 ALA C C 15 176.270 179.233 -2.963 1
1 79 . 7 1 1 A 15 15 ALA CA C 15 52.280 54.952 -2.672 1
1 80 . 7 1 1 A 15 15 ALA CB C 15 19.670 18.380 1.290 1
1 81 . 7 1 1 A 15 15 ALA N N 15 117.640 119.567 -1.927 1
1 82 . 7 1 1 A 16 16 LYS H H 16 7.690 8.065 -0.375 1
1 83 . 7 1 1 A 16 16 LYS HA H 16 4.200 4.024 0.176 1
1 84 . 7 1 1 A 16 16 LYS C C 16 175.830 177.154 -1.324 1
1 85 . 7 1 1 A 16 16 LYS CA C 16 59.780 59.532 0.248 1
1 86 . 7 1 1 A 16 16 LYS CB C 16 33.300 32.429 0.871 1
1 87 . 7 1 1 A 16 16 LYS N N 16 120.340 117.087 3.253 1
1 88 . 7 1 1 A 17 17 GLU H H 17 10.170 8.579 1.591 1
1 89 . 7 1 1 A 17 17 GLU HA H 17 4.990 4.484 0.506 1
1 90 . 7 1 1 A 17 17 GLU C C 17 174.790 177.014 -2.224 1
1 91 . 7 1 1 A 17 17 GLU CA C 17 53.910 55.347 -1.437 1
1 92 . 7 1 1 A 17 17 GLU N N 17 116.560 118.374 -1.814 1
1 93 . 7 1 1 A 18 18 GLY H H 18 9.100 8.584 0.516 1
1 94 . 7 1 1 A 18 18 GLY N N 18 113.230 111.267 1.963 1
1 95 . 7 1 1 A 19 19 ASP H H 19 7.730 8.622 -0.892 1
1 96 . 7 1 1 A 19 19 ASP N N 19 126.280 121.484 4.796 1
1 97 . 7 1 1 A 21 21 ASN H H 21 9.090 8.222 0.868 1
1 98 . 7 1 1 A 21 21 ASN N N 21 115.850 115.155 0.695 1
1 99 . 7 1 1 A 24 24 SER C C 24 176.120 174.727 1.393 1
1 100 . 7 1 1 A 25 25 LYS H H 25 10.400 8.563 1.837 1
1 101 . 7 1 1 A 25 25 LYS C C 25 177.600 177.888 -0.288 1
1 102 . 7 1 1 A 25 25 LYS N N 25 124.350 124.954 -0.604 1
1 103 . 7 1 1 A 26 26 GLU H H 26 9.250 8.371 0.879 1
1 104 . 7 1 1 A 26 26 GLU N N 26 118.470 117.638 0.832 1
1 105 . 7 1 1 A 27 27 GLU C C 27 178.580 178.553 0.027 1
1 106 . 7 1 1 A 27 27 GLU CA C 27 59.920 58.977 0.943 1
1 107 . 7 1 1 A 28 28 LEU H H 28 10.810 9.280 1.530 1
1 108 . 7 1 1 A 28 28 LEU C C 28 177.280 178.421 -1.141 1
1 109 . 7 1 1 A 28 28 LEU CB C 28 43.570 41.611 1.959 1
1 110 . 7 1 1 A 28 28 LEU N N 28 121.060 121.767 -0.707 1
1 111 . 7 1 1 A 29 29 LYS H H 29 9.680 8.479 1.201 1
1 112 . 7 1 1 A 29 29 LYS HA H 29 4.480 3.923 0.557 1
1 113 . 7 1 1 A 29 29 LYS C C 29 176.670 178.646 -1.976 1
1 114 . 7 1 1 A 29 29 LYS CA C 29 60.770 59.991 0.779 1
1 115 . 7 1 1 A 29 29 LYS CB C 29 32.910 32.461 0.449 1
1 116 . 7 1 1 A 29 29 LYS N N 29 121.140 119.230 1.910 1
1 117 . 7 1 1 A 30 30 LEU H H 30 8.410 7.792 0.618 1
1 118 . 7 1 1 A 30 30 LEU CA C 30 57.730 57.818 -0.088 1
1 119 . 7 1 1 A 30 30 LEU CB C 30 42.570 41.923 0.647 1
1 120 . 7 1 1 A 30 30 LEU N N 30 119.000 119.464 -0.464 1
1 121 . 7 1 1 A 31 31 LEU H H 31 9.010 7.423 1.587 1
1 122 . 7 1 1 A 31 31 LEU HA H 31 2.920 3.602 -0.682 1
1 123 . 7 1 1 A 31 31 LEU C C 31 178.280 178.316 -0.036 1
1 124 . 7 1 1 A 31 31 LEU CA C 31 59.030 58.388 0.642 1
1 125 . 7 1 1 A 31 31 LEU N N 31 124.840 119.539 5.301 1
1 126 . 7 1 1 A 32 32 LEU H H 32 9.680 8.943 0.737 1
1 127 . 7 1 1 A 32 32 LEU HA H 32 4.490 4.090 0.400 1
1 128 . 7 1 1 A 32 32 LEU C C 32 177.360 179.799 -2.439 1
1 129 . 7 1 1 A 32 32 LEU CA C 32 58.520 57.268 1.252 1
1 130 . 7 1 1 A 32 32 LEU CB C 32 42.760 41.506 1.254 1
1 131 . 7 1 1 A 32 32 LEU N N 32 120.580 119.034 1.546 1
1 132 . 7 1 1 A 33 33 GLN H H 33 9.140 8.172 0.968 1
1 133 . 7 1 1 A 33 33 GLN HA H 33 4.250 4.133 0.117 1
1 134 . 7 1 1 A 33 33 GLN C C 33 176.050 178.231 -2.181 1
1 135 . 7 1 1 A 33 33 GLN CA C 33 58.600 58.786 -0.186 1
1 136 . 7 1 1 A 33 33 GLN CB C 33 29.730 28.555 1.175 1
1 137 . 7 1 1 A 33 33 GLN N N 33 115.010 119.726 -4.716 1
1 138 . 7 1 1 A 34 34 THR H H 34 8.000 7.957 0.043 1
1 139 . 7 1 1 A 34 34 THR HA H 34 4.390 4.067 0.323 1
1 140 . 7 1 1 A 34 34 THR C C 34 174.130 175.980 -1.850 1
1 141 . 7 1 1 A 34 34 THR CA C 34 65.250 66.263 -1.013 1
1 142 . 7 1 1 A 34 34 THR CB C 34 69.920 69.150 0.770 1
1 143 . 7 1 1 A 34 34 THR N N 34 111.180 114.887 -3.707 1
1 144 . 7 1 1 A 35 35 GLU H H 35 8.810 8.667 0.143 1
1 145 . 7 1 1 A 35 35 GLU HA H 35 4.470 4.080 0.390 1
1 146 . 7 1 1 A 35 35 GLU C C 35 175.430 176.367 -0.937 1
1 147 . 7 1 1 A 35 35 GLU CA C 35 56.170 59.319 -3.149 1
1 148 . 7 1 1 A 35 35 GLU CB C 35 30.900 29.961 0.939 1
1 149 . 7 1 1 A 35 35 GLU N N 35 116.410 121.751 -5.341 1
1 150 . 7 1 1 A 36 36 PHE H H 36 8.230 8.013 0.217 1
1 151 . 7 1 1 A 36 36 PHE HA H 36 5.500 5.101 0.399 1
1 152 . 7 1 1 A 36 36 PHE N N 36 115.090 115.656 -0.566 1
1 153 . 7 1 1 A 37 37 PRO C C 37 178.140 177.781 0.359 1
1 154 . 7 1 1 A 37 37 PRO CA C 37 64.940 64.494 0.446 1
1 155 . 7 1 1 A 37 37 PRO CB C 37 31.600 31.864 -0.264 1
1 156 . 7 1 1 A 38 38 SER H H 38 8.660 8.387 0.273 1
1 157 . 7 1 1 A 38 38 SER HA H 38 4.500 4.321 0.179 1
1 158 . 7 1 1 A 38 38 SER C C 38 174.830 177.090 -2.260 1
1 159 . 7 1 1 A 38 38 SER CA C 38 59.970 61.471 -1.501 1
1 160 . 7 1 1 A 38 38 SER CB C 38 62.690 63.174 -0.484 1
1 161 . 7 1 1 A 38 38 SER N N 38 114.030 113.466 0.564 1
1 162 . 7 1 1 A 39 39 LEU H H 39 8.260 8.169 0.091 1
1 163 . 7 1 1 A 39 39 LEU HA H 39 4.520 4.111 0.409 1
1 164 . 7 1 1 A 39 39 LEU C C 39 176.780 179.846 -3.066 1
1 165 . 7 1 1 A 39 39 LEU CA C 39 56.600 57.377 -0.777 1
1 166 . 7 1 1 A 39 39 LEU CB C 39 42.610 41.237 1.373 1
1 167 . 7 1 1 A 39 39 LEU N N 39 122.650 122.403 0.247 1
1 168 . 7 1 1 A 40 40 LEU H H 40 8.070 7.833 0.237 1
1 169 . 7 1 1 A 40 40 LEU HA H 40 4.830 4.111 0.719 1
1 170 . 7 1 1 A 40 40 LEU C C 40 175.690 179.087 -3.397 1
1 171 . 7 1 1 A 40 40 LEU CA C 40 54.510 57.867 -3.357 1
1 172 . 7 1 1 A 40 40 LEU CB C 40 42.020 41.072 0.948 1
1 173 . 7 1 1 A 40 40 LEU N N 40 117.390 119.326 -1.936 1
1 174 . 7 1 1 A 41 41 LYS H H 41 7.770 7.647 0.123 1
1 175 . 7 1 1 A 41 41 LYS HA H 41 4.610 4.058 0.552 1
1 176 . 7 1 1 A 41 41 LYS C C 41 175.380 177.998 -2.618 1
1 177 . 7 1 1 A 41 41 LYS CA C 41 56.170 59.344 -3.174 1
1 178 . 7 1 1 A 41 41 LYS CB C 41 32.950 32.090 0.860 1
1 179 . 7 1 1 A 41 41 LYS N N 41 120.530 118.066 2.464 1
1 180 . 7 1 1 A 42 42 GLY H H 42 8.390 7.956 0.434 1
1 181 . 7 1 1 A 42 42 GLY HA2 H 42 4.280 4.059 0.221 1
1 182 . 7 1 1 A 42 42 GLY HA3 H 42 4.280 4.061 0.219 1
1 183 . 7 1 1 A 42 42 GLY C C 42 177.190 174.979 2.211 1
1 184 . 7 1 1 A 42 42 GLY N N 42 109.280 108.761 0.519 1
1 185 . 7 1 1 A 43 43 MET H H 43 9.020 8.598 0.422 1
1 186 . 7 1 1 A 43 43 MET C C 43 175.520 175.508 0.012 1
1 187 . 7 1 1 A 43 43 MET N N 43 121.110 119.107 2.003 1
1 188 . 7 1 1 A 44 44 SER H H 44 8.700 7.765 0.935 1
1 189 . 7 1 1 A 44 44 SER C C 44 173.540 174.060 -0.520 1
1 190 . 7 1 1 A 44 44 SER N N 44 116.190 117.349 -1.159 1
1 191 . 7 1 1 A 45 45 THR H H 45 8.440 8.672 -0.232 1
1 192 . 7 1 1 A 45 45 THR C C 45 174.300 175.337 -1.037 1
1 193 . 7 1 1 A 45 45 THR N N 45 113.740 119.282 -5.542 1
1 194 . 7 1 1 A 46 46 LEU H H 46 9.380 8.837 0.543 1
1 195 . 7 1 1 A 46 46 LEU C C 46 177.760 178.128 -0.368 1
1 196 . 7 1 1 A 46 46 LEU N N 46 123.970 123.483 0.487 1
1 197 . 7 1 1 A 47 47 ASP H H 47 8.990 8.511 0.479 1
1 198 . 7 1 1 A 47 47 ASP N N 47 118.620 118.282 0.338 1
1 199 . 7 1 1 A 49 49 LEU H H 49 9.740 8.387 1.353 1
1 200 . 7 1 1 A 49 49 LEU N N 49 123.880 120.896 2.984 1
1 201 . 7 1 1 A 50 50 PHE H H 50 10.730 8.839 1.891 1
1 202 . 7 1 1 A 50 50 PHE N N 50 121.380 119.805 1.575 1
1 203 . 7 1 1 A 51 51 GLU H H 51 7.860 8.575 -0.715 1
1 204 . 7 1 1 A 51 51 GLU HA H 51 3.530 4.069 -0.539 1
1 205 . 7 1 1 A 51 51 GLU N N 51 114.870 118.689 -3.819 1
1 206 . 7 1 1 A 66 66 PHE CA C 66 58.850 61.292 -2.442 1
1 207 . 7 1 1 A 67 67 GLN H H 67 5.670 8.135 -2.465 1
1 208 . 7 1 1 A 67 67 GLN C C 67 174.810 178.077 -3.267 1
1 209 . 7 1 1 A 67 67 GLN CA C 67 56.340 58.300 -1.960 1
1 210 . 7 1 1 A 67 67 GLN N N 67 114.050 117.204 -3.154 1
1 211 . 7 1 1 A 68 68 VAL H H 68 5.760 7.582 -1.822 1
1 212 . 7 1 1 A 68 68 VAL C C 68 175.770 178.431 -2.661 1
1 213 . 7 1 1 A 68 68 VAL CA C 68 63.990 65.894 -1.904 1
1 214 . 7 1 1 A 68 68 VAL CB C 68 31.310 31.510 -0.200 1
1 215 . 7 1 1 A 68 68 VAL N N 68 116.280 119.716 -3.436 1
1 216 . 7 1 1 A 69 69 LEU H H 69 7.150 8.525 -1.375 1
1 217 . 7 1 1 A 69 69 LEU HA H 69 4.040 4.024 0.016 1
1 218 . 7 1 1 A 69 69 LEU C C 69 176.210 178.311 -2.101 1
1 219 . 7 1 1 A 69 69 LEU CA C 69 56.270 57.315 -1.045 1
1 220 . 7 1 1 A 69 69 LEU CB C 69 42.010 41.846 0.164 1
1 221 . 7 1 1 A 69 69 LEU N N 69 120.350 121.495 -1.145 1
1 222 . 7 1 1 A 70 70 VAL H H 70 6.810 7.281 -0.471 1
1 223 . 7 1 1 A 70 70 VAL HA H 70 3.170 3.276 -0.106 1
1 224 . 7 1 1 A 70 70 VAL C C 70 175.760 177.623 -1.863 1
1 225 . 7 1 1 A 70 70 VAL CA C 70 65.110 66.993 -1.883 1
1 226 . 7 1 1 A 70 70 VAL CB C 70 31.190 31.183 0.007 1
1 227 . 7 1 1 A 70 70 VAL N N 70 115.790 118.906 -3.116 1
1 228 . 7 1 1 A 71 71 LYS H H 71 7.190 8.332 -1.142 1
1 229 . 7 1 1 A 71 71 LYS HA H 71 3.880 3.878 0.002 1
1 230 . 7 1 1 A 71 71 LYS C C 71 176.100 178.834 -2.734 1
1 231 . 7 1 1 A 71 71 LYS CA C 71 57.680 59.375 -1.695 1
1 232 . 7 1 1 A 71 71 LYS CB C 71 31.930 32.144 -0.214 1
1 233 . 7 1 1 A 71 71 LYS N N 71 117.820 119.734 -1.914 1
1 234 . 7 1 1 A 72 72 LYS H H 72 7.450 7.477 -0.027 1
1 235 . 7 1 1 A 72 72 LYS HA H 72 4.180 4.031 0.149 1
1 236 . 7 1 1 A 72 72 LYS C C 72 176.180 179.247 -3.067 1
1 237 . 7 1 1 A 72 72 LYS CA C 72 56.950 58.502 -1.552 1
1 238 . 7 1 1 A 72 72 LYS CB C 72 33.610 31.495 2.115 1
1 239 . 7 1 1 A 72 72 LYS N N 72 116.930 117.924 -0.994 1
1 240 . 7 1 1 A 73 73 ILE H H 73 7.440 7.954 -0.514 1
1 241 . 7 1 1 A 73 73 ILE HA H 73 4.180 3.452 0.728 1
1 242 . 7 1 1 A 73 73 ILE C C 73 174.440 178.163 -3.723 1
1 243 . 7 1 1 A 73 73 ILE CA C 73 61.510 64.538 -3.028 1
1 244 . 7 1 1 A 73 73 ILE CB C 73 38.610 37.470 1.140 1
1 245 . 7 1 1 A 73 73 ILE N N 73 114.560 121.321 -6.761 1
1 246 . 7 1 1 A 74 74 SER H H 74 7.790 9.042 -1.252 1
1 247 . 7 1 1 A 74 74 SER HA H 74 4.520 4.148 0.372 1
1 248 . 7 1 1 A 74 74 SER C C 74 171.580 177.615 -6.035 1
1 249 . 7 1 1 A 74 74 SER CA C 74 57.960 61.488 -3.528 1
1 250 . 7 1 1 A 74 74 SER CB C 74 63.820 62.940 0.880 1
1 251 . 7 1 1 A 74 74 SER N N 74 117.310 115.901 1.409 1
1 6 . 8 1 1 A 2 2 SER H H 2 9.010 8.395 0.615 1
1 7 . 8 1 1 A 2 2 SER HA H 2 4.680 4.580 0.100 1
1 8 . 8 1 1 A 2 2 SER N N 2 119.390 115.412 3.978 1
1 9 . 8 1 1 A 3 3 PRO C C 3 177.630 178.880 -1.250 1
1 10 . 8 1 1 A 3 3 PRO CA C 3 65.000 64.973 0.027 1
1 11 . 8 1 1 A 3 3 PRO CB C 3 31.790 32.113 -0.323 1
1 12 . 8 1 1 A 4 4 GLU H H 4 8.600 8.471 0.129 1
1 13 . 8 1 1 A 4 4 GLU HA H 4 3.900 4.103 -0.203 1
1 14 . 8 1 1 A 4 4 GLU C C 4 177.910 179.551 -1.641 1
1 15 . 8 1 1 A 4 4 GLU CB C 4 28.980 29.108 -0.128 1
1 16 . 8 1 1 A 4 4 GLU N N 4 117.750 117.922 -0.172 1
1 17 . 8 1 1 A 5 5 GLU H H 5 7.980 8.123 -0.143 1
1 18 . 8 1 1 A 5 5 GLU HA H 5 4.170 4.095 0.075 1
1 19 . 8 1 1 A 5 5 GLU C C 5 178.290 179.244 -0.954 1
1 20 . 8 1 1 A 5 5 GLU CA C 5 58.140 59.214 -1.074 1
1 21 . 8 1 1 A 5 5 GLU CB C 5 30.450 29.306 1.144 1
1 22 . 8 1 1 A 5 5 GLU N N 5 121.890 120.235 1.655 1
1 23 . 8 1 1 A 6 6 LEU H H 6 8.450 8.063 0.387 1
1 24 . 8 1 1 A 6 6 LEU HA H 6 4.310 4.019 0.291 1
1 25 . 8 1 1 A 6 6 LEU C C 6 176.660 178.876 -2.216 1
1 26 . 8 1 1 A 6 6 LEU CA C 6 57.310 57.766 -0.456 1
1 27 . 8 1 1 A 6 6 LEU CB C 6 42.090 41.813 0.277 1
1 28 . 8 1 1 A 6 6 LEU N N 6 120.250 120.574 -0.324 1
1 29 . 8 1 1 A 7 7 LYS H H 7 8.100 8.966 -0.866 1
1 30 . 8 1 1 A 7 7 LYS HA H 7 3.760 4.021 -0.261 1
1 31 . 8 1 1 A 7 7 LYS C C 7 176.160 179.383 -3.223 1
1 32 . 8 1 1 A 7 7 LYS CA C 7 59.110 59.806 -0.696 1
1 33 . 8 1 1 A 7 7 LYS CB C 7 32.110 32.343 -0.233 1
1 34 . 8 1 1 A 7 7 LYS N N 7 120.960 118.377 2.583 1
1 35 . 8 1 1 A 8 8 GLY H H 8 7.860 8.591 -0.731 1
1 36 . 8 1 1 A 8 8 GLY HA2 H 8 3.970 3.792 0.178 1
1 37 . 8 1 1 A 8 8 GLY HA3 H 8 3.970 3.794 0.176 1
1 38 . 8 1 1 A 8 8 GLY C C 8 175.520 176.191 -0.671 1
1 39 . 8 1 1 A 8 8 GLY CA C 8 46.490 47.483 -0.993 1
1 40 . 8 1 1 A 8 8 GLY N N 8 105.430 107.256 -1.826 1
1 41 . 8 1 1 A 9 9 ILE H H 9 8.130 9.512 -1.382 1
1 42 . 8 1 1 A 9 9 ILE HA H 9 4.140 3.896 0.244 1
1 43 . 8 1 1 A 9 9 ILE C C 9 175.320 178.040 -2.720 1
1 44 . 8 1 1 A 9 9 ILE CA C 9 65.010 64.597 0.413 1
1 45 . 8 1 1 A 9 9 ILE CB C 9 39.040 37.963 1.077 1
1 46 . 8 1 1 A 9 9 ILE N N 9 122.870 122.497 0.373 1
1 47 . 8 1 1 A 10 10 PHE H H 10 8.590 9.747 -1.157 1
1 48 . 8 1 1 A 10 10 PHE HA H 10 4.470 4.023 0.447 1
1 49 . 8 1 1 A 10 10 PHE C C 10 175.010 177.223 -2.213 1
1 50 . 8 1 1 A 10 10 PHE CA C 10 62.470 62.537 -0.067 1
1 51 . 8 1 1 A 10 10 PHE CB C 10 39.670 39.274 0.396 1
1 52 . 8 1 1 A 10 10 PHE N N 10 120.430 120.465 -0.035 1
1 53 . 8 1 1 A 11 11 GLU H H 11 8.600 8.917 -0.317 1
1 54 . 8 1 1 A 11 11 GLU HA H 11 3.750 3.736 0.014 1
1 55 . 8 1 1 A 11 11 GLU C C 11 177.630 178.548 -0.918 1
1 56 . 8 1 1 A 11 11 GLU CA C 11 58.440 59.551 -1.111 1
1 57 . 8 1 1 A 11 11 GLU CB C 11 29.840 29.004 0.836 1
1 58 . 8 1 1 A 11 11 GLU N N 11 115.410 118.172 -2.762 1
1 59 . 8 1 1 A 12 12 LYS H H 12 7.940 8.628 -0.688 1
1 60 . 8 1 1 A 12 12 LYS HA H 12 4.080 3.945 0.135 1
1 61 . 8 1 1 A 12 12 LYS CA C 12 58.440 58.985 -0.545 1
1 62 . 8 1 1 A 12 12 LYS CB C 12 32.720 32.271 0.449 1
1 63 . 8 1 1 A 12 12 LYS N N 12 119.220 119.768 -0.548 1
1 64 . 8 1 1 A 13 13 TYR H H 13 7.740 7.364 0.376 1
1 65 . 8 1 1 A 13 13 TYR HA H 13 4.580 4.366 0.214 1
1 66 . 8 1 1 A 13 13 TYR C C 13 39.870 178.456 -138.586 1
1 67 . 8 1 1 A 13 13 TYR CA C 13 61.280 60.332 0.948 1
1 68 . 8 1 1 A 13 13 TYR CB C 13 175.510 39.276 136.234 1
1 69 . 8 1 1 A 13 13 TYR N N 13 115.320 117.448 -2.128 1
1 70 . 8 1 1 A 14 14 ALA H H 14 9.060 8.564 0.496 1
1 71 . 8 1 1 A 14 14 ALA HA H 14 3.850 3.845 0.005 1
1 72 . 8 1 1 A 14 14 ALA C C 14 177.990 179.718 -1.728 1
1 73 . 8 1 1 A 14 14 ALA CA C 14 54.280 54.665 -0.385 1
1 74 . 8 1 1 A 14 14 ALA CB C 14 18.790 17.862 0.928 1
1 75 . 8 1 1 A 14 14 ALA N N 14 120.140 122.636 -2.496 1
1 76 . 8 1 1 A 15 15 ALA H H 15 7.350 8.330 -0.980 1
1 77 . 8 1 1 A 15 15 ALA HA H 15 4.550 3.994 0.556 1
1 78 . 8 1 1 A 15 15 ALA C C 15 176.270 179.233 -2.963 1
1 79 . 8 1 1 A 15 15 ALA CA C 15 52.280 54.952 -2.672 1
1 80 . 8 1 1 A 15 15 ALA CB C 15 19.670 18.380 1.290 1
1 81 . 8 1 1 A 15 15 ALA N N 15 117.640 119.567 -1.927 1
1 82 . 8 1 1 A 16 16 LYS H H 16 7.690 8.065 -0.375 1
1 83 . 8 1 1 A 16 16 LYS HA H 16 4.200 4.024 0.176 1
1 84 . 8 1 1 A 16 16 LYS C C 16 175.830 177.154 -1.324 1
1 85 . 8 1 1 A 16 16 LYS CA C 16 59.780 59.532 0.248 1
1 86 . 8 1 1 A 16 16 LYS CB C 16 33.300 32.429 0.871 1
1 87 . 8 1 1 A 16 16 LYS N N 16 120.340 117.087 3.253 1
1 88 . 8 1 1 A 17 17 GLU H H 17 10.170 8.579 1.591 1
1 89 . 8 1 1 A 17 17 GLU HA H 17 4.990 4.484 0.506 1
1 90 . 8 1 1 A 17 17 GLU C C 17 174.790 177.014 -2.224 1
1 91 . 8 1 1 A 17 17 GLU CA C 17 53.910 55.347 -1.437 1
1 92 . 8 1 1 A 17 17 GLU N N 17 116.560 118.374 -1.814 1
1 93 . 8 1 1 A 18 18 GLY H H 18 9.100 8.584 0.516 1
1 94 . 8 1 1 A 18 18 GLY N N 18 113.230 111.267 1.963 1
1 95 . 8 1 1 A 19 19 ASP H H 19 7.730 8.622 -0.892 1
1 96 . 8 1 1 A 19 19 ASP N N 19 126.280 121.484 4.796 1
1 97 . 8 1 1 A 21 21 ASN H H 21 9.090 8.222 0.868 1
1 98 . 8 1 1 A 21 21 ASN N N 21 115.850 115.155 0.695 1
1 99 . 8 1 1 A 24 24 SER C C 24 176.120 174.727 1.393 1
1 100 . 8 1 1 A 25 25 LYS H H 25 10.400 8.563 1.837 1
1 101 . 8 1 1 A 25 25 LYS C C 25 177.600 177.888 -0.288 1
1 102 . 8 1 1 A 25 25 LYS N N 25 124.350 124.954 -0.604 1
1 103 . 8 1 1 A 26 26 GLU H H 26 9.250 8.371 0.879 1
1 104 . 8 1 1 A 26 26 GLU N N 26 118.470 117.638 0.832 1
1 105 . 8 1 1 A 27 27 GLU C C 27 178.580 178.553 0.027 1
1 106 . 8 1 1 A 27 27 GLU CA C 27 59.920 58.977 0.943 1
1 107 . 8 1 1 A 28 28 LEU H H 28 10.810 9.280 1.530 1
1 108 . 8 1 1 A 28 28 LEU C C 28 177.280 178.421 -1.141 1
1 109 . 8 1 1 A 28 28 LEU CB C 28 43.570 41.611 1.959 1
1 110 . 8 1 1 A 28 28 LEU N N 28 121.060 121.767 -0.707 1
1 111 . 8 1 1 A 29 29 LYS H H 29 9.680 8.479 1.201 1
1 112 . 8 1 1 A 29 29 LYS HA H 29 4.480 3.923 0.557 1
1 113 . 8 1 1 A 29 29 LYS C C 29 176.670 178.646 -1.976 1
1 114 . 8 1 1 A 29 29 LYS CA C 29 60.770 59.991 0.779 1
1 115 . 8 1 1 A 29 29 LYS CB C 29 32.910 32.461 0.449 1
1 116 . 8 1 1 A 29 29 LYS N N 29 121.140 119.230 1.910 1
1 117 . 8 1 1 A 30 30 LEU H H 30 8.410 7.792 0.618 1
1 118 . 8 1 1 A 30 30 LEU CA C 30 57.730 57.818 -0.088 1
1 119 . 8 1 1 A 30 30 LEU CB C 30 42.570 41.923 0.647 1
1 120 . 8 1 1 A 30 30 LEU N N 30 119.000 119.464 -0.464 1
1 121 . 8 1 1 A 31 31 LEU H H 31 9.010 7.423 1.587 1
1 122 . 8 1 1 A 31 31 LEU HA H 31 2.920 3.602 -0.682 1
1 123 . 8 1 1 A 31 31 LEU C C 31 178.280 178.316 -0.036 1
1 124 . 8 1 1 A 31 31 LEU CA C 31 59.030 58.388 0.642 1
1 125 . 8 1 1 A 31 31 LEU N N 31 124.840 119.539 5.301 1
1 126 . 8 1 1 A 32 32 LEU H H 32 9.680 8.943 0.737 1
1 127 . 8 1 1 A 32 32 LEU HA H 32 4.490 4.090 0.400 1
1 128 . 8 1 1 A 32 32 LEU C C 32 177.360 179.799 -2.439 1
1 129 . 8 1 1 A 32 32 LEU CA C 32 58.520 57.268 1.252 1
1 130 . 8 1 1 A 32 32 LEU CB C 32 42.760 41.506 1.254 1
1 131 . 8 1 1 A 32 32 LEU N N 32 120.580 119.034 1.546 1
1 132 . 8 1 1 A 33 33 GLN H H 33 9.140 8.172 0.968 1
1 133 . 8 1 1 A 33 33 GLN HA H 33 4.250 4.133 0.117 1
1 134 . 8 1 1 A 33 33 GLN C C 33 176.050 178.231 -2.181 1
1 135 . 8 1 1 A 33 33 GLN CA C 33 58.600 58.786 -0.186 1
1 136 . 8 1 1 A 33 33 GLN CB C 33 29.730 28.555 1.175 1
1 137 . 8 1 1 A 33 33 GLN N N 33 115.010 119.726 -4.716 1
1 138 . 8 1 1 A 34 34 THR H H 34 8.000 7.957 0.043 1
1 139 . 8 1 1 A 34 34 THR HA H 34 4.390 4.067 0.323 1
1 140 . 8 1 1 A 34 34 THR C C 34 174.130 175.980 -1.850 1
1 141 . 8 1 1 A 34 34 THR CA C 34 65.250 66.263 -1.013 1
1 142 . 8 1 1 A 34 34 THR CB C 34 69.920 69.150 0.770 1
1 143 . 8 1 1 A 34 34 THR N N 34 111.180 114.887 -3.707 1
1 144 . 8 1 1 A 35 35 GLU H H 35 8.810 8.667 0.143 1
1 145 . 8 1 1 A 35 35 GLU HA H 35 4.470 4.080 0.390 1
1 146 . 8 1 1 A 35 35 GLU C C 35 175.430 176.367 -0.937 1
1 147 . 8 1 1 A 35 35 GLU CA C 35 56.170 59.319 -3.149 1
1 148 . 8 1 1 A 35 35 GLU CB C 35 30.900 29.961 0.939 1
1 149 . 8 1 1 A 35 35 GLU N N 35 116.410 121.751 -5.341 1
1 150 . 8 1 1 A 36 36 PHE H H 36 8.230 8.013 0.217 1
1 151 . 8 1 1 A 36 36 PHE HA H 36 5.500 5.101 0.399 1
1 152 . 8 1 1 A 36 36 PHE N N 36 115.090 115.656 -0.566 1
1 153 . 8 1 1 A 37 37 PRO C C 37 178.140 177.781 0.359 1
1 154 . 8 1 1 A 37 37 PRO CA C 37 64.940 64.494 0.446 1
1 155 . 8 1 1 A 37 37 PRO CB C 37 31.600 31.864 -0.264 1
1 156 . 8 1 1 A 38 38 SER H H 38 8.660 8.387 0.273 1
1 157 . 8 1 1 A 38 38 SER HA H 38 4.500 4.321 0.179 1
1 158 . 8 1 1 A 38 38 SER C C 38 174.830 177.090 -2.260 1
1 159 . 8 1 1 A 38 38 SER CA C 38 59.970 61.471 -1.501 1
1 160 . 8 1 1 A 38 38 SER CB C 38 62.690 63.174 -0.484 1
1 161 . 8 1 1 A 38 38 SER N N 38 114.030 113.466 0.564 1
1 162 . 8 1 1 A 39 39 LEU H H 39 8.260 8.169 0.091 1
1 163 . 8 1 1 A 39 39 LEU HA H 39 4.520 4.111 0.409 1
1 164 . 8 1 1 A 39 39 LEU C C 39 176.780 179.846 -3.066 1
1 165 . 8 1 1 A 39 39 LEU CA C 39 56.600 57.377 -0.777 1
1 166 . 8 1 1 A 39 39 LEU CB C 39 42.610 41.237 1.373 1
1 167 . 8 1 1 A 39 39 LEU N N 39 122.650 122.403 0.247 1
1 168 . 8 1 1 A 40 40 LEU H H 40 8.070 7.833 0.237 1
1 169 . 8 1 1 A 40 40 LEU HA H 40 4.830 4.111 0.719 1
1 170 . 8 1 1 A 40 40 LEU C C 40 175.690 179.087 -3.397 1
1 171 . 8 1 1 A 40 40 LEU CA C 40 54.510 57.867 -3.357 1
1 172 . 8 1 1 A 40 40 LEU CB C 40 42.020 41.072 0.948 1
1 173 . 8 1 1 A 40 40 LEU N N 40 117.390 119.326 -1.936 1
1 174 . 8 1 1 A 41 41 LYS H H 41 7.770 7.647 0.123 1
1 175 . 8 1 1 A 41 41 LYS HA H 41 4.610 4.058 0.552 1
1 176 . 8 1 1 A 41 41 LYS C C 41 175.380 177.998 -2.618 1
1 177 . 8 1 1 A 41 41 LYS CA C 41 56.170 59.344 -3.174 1
1 178 . 8 1 1 A 41 41 LYS CB C 41 32.950 32.090 0.860 1
1 179 . 8 1 1 A 41 41 LYS N N 41 120.530 118.066 2.464 1
1 180 . 8 1 1 A 42 42 GLY H H 42 8.390 7.956 0.434 1
1 181 . 8 1 1 A 42 42 GLY HA2 H 42 4.280 4.059 0.221 1
1 182 . 8 1 1 A 42 42 GLY HA3 H 42 4.280 4.061 0.219 1
1 183 . 8 1 1 A 42 42 GLY C C 42 177.190 174.979 2.211 1
1 184 . 8 1 1 A 42 42 GLY N N 42 109.280 108.761 0.519 1
1 185 . 8 1 1 A 43 43 MET H H 43 9.020 8.598 0.422 1
1 186 . 8 1 1 A 43 43 MET C C 43 175.520 175.508 0.012 1
1 187 . 8 1 1 A 43 43 MET N N 43 121.110 119.107 2.003 1
1 188 . 8 1 1 A 44 44 SER H H 44 8.700 7.765 0.935 1
1 189 . 8 1 1 A 44 44 SER C C 44 173.540 174.060 -0.520 1
1 190 . 8 1 1 A 44 44 SER N N 44 116.190 117.349 -1.159 1
1 191 . 8 1 1 A 45 45 THR H H 45 8.440 8.672 -0.232 1
1 192 . 8 1 1 A 45 45 THR C C 45 174.300 175.337 -1.037 1
1 193 . 8 1 1 A 45 45 THR N N 45 113.740 119.282 -5.542 1
1 194 . 8 1 1 A 46 46 LEU H H 46 9.380 8.837 0.543 1
1 195 . 8 1 1 A 46 46 LEU C C 46 177.760 178.128 -0.368 1
1 196 . 8 1 1 A 46 46 LEU N N 46 123.970 123.483 0.487 1
1 197 . 8 1 1 A 47 47 ASP H H 47 8.990 8.511 0.479 1
1 198 . 8 1 1 A 47 47 ASP N N 47 118.620 118.282 0.338 1
1 199 . 8 1 1 A 49 49 LEU H H 49 9.740 8.387 1.353 1
1 200 . 8 1 1 A 49 49 LEU N N 49 123.880 120.896 2.984 1
1 201 . 8 1 1 A 50 50 PHE H H 50 10.730 8.839 1.891 1
1 202 . 8 1 1 A 50 50 PHE N N 50 121.380 119.805 1.575 1
1 203 . 8 1 1 A 51 51 GLU H H 51 7.860 8.575 -0.715 1
1 204 . 8 1 1 A 51 51 GLU HA H 51 3.530 4.069 -0.539 1
1 205 . 8 1 1 A 51 51 GLU N N 51 114.870 118.689 -3.819 1
1 206 . 8 1 1 A 66 66 PHE CA C 66 58.850 61.292 -2.442 1
1 207 . 8 1 1 A 67 67 GLN H H 67 5.670 8.135 -2.465 1
1 208 . 8 1 1 A 67 67 GLN C C 67 174.810 178.077 -3.267 1
1 209 . 8 1 1 A 67 67 GLN CA C 67 56.340 58.300 -1.960 1
1 210 . 8 1 1 A 67 67 GLN N N 67 114.050 117.204 -3.154 1
1 211 . 8 1 1 A 68 68 VAL H H 68 5.760 7.582 -1.822 1
1 212 . 8 1 1 A 68 68 VAL C C 68 175.770 178.431 -2.661 1
1 213 . 8 1 1 A 68 68 VAL CA C 68 63.990 65.894 -1.904 1
1 214 . 8 1 1 A 68 68 VAL CB C 68 31.310 31.510 -0.200 1
1 215 . 8 1 1 A 68 68 VAL N N 68 116.280 119.716 -3.436 1
1 216 . 8 1 1 A 69 69 LEU H H 69 7.150 8.525 -1.375 1
1 217 . 8 1 1 A 69 69 LEU HA H 69 4.040 4.024 0.016 1
1 218 . 8 1 1 A 69 69 LEU C C 69 176.210 178.311 -2.101 1
1 219 . 8 1 1 A 69 69 LEU CA C 69 56.270 57.315 -1.045 1
1 220 . 8 1 1 A 69 69 LEU CB C 69 42.010 41.846 0.164 1
1 221 . 8 1 1 A 69 69 LEU N N 69 120.350 121.495 -1.145 1
1 222 . 8 1 1 A 70 70 VAL H H 70 6.810 7.281 -0.471 1
1 223 . 8 1 1 A 70 70 VAL HA H 70 3.170 3.276 -0.106 1
1 224 . 8 1 1 A 70 70 VAL C C 70 175.760 177.623 -1.863 1
1 225 . 8 1 1 A 70 70 VAL CA C 70 65.110 66.993 -1.883 1
1 226 . 8 1 1 A 70 70 VAL CB C 70 31.190 31.183 0.007 1
1 227 . 8 1 1 A 70 70 VAL N N 70 115.790 118.906 -3.116 1
1 228 . 8 1 1 A 71 71 LYS H H 71 7.190 8.332 -1.142 1
1 229 . 8 1 1 A 71 71 LYS HA H 71 3.880 3.878 0.002 1
1 230 . 8 1 1 A 71 71 LYS C C 71 176.100 178.834 -2.734 1
1 231 . 8 1 1 A 71 71 LYS CA C 71 57.680 59.375 -1.695 1
1 232 . 8 1 1 A 71 71 LYS CB C 71 31.930 32.144 -0.214 1
1 233 . 8 1 1 A 71 71 LYS N N 71 117.820 119.734 -1.914 1
1 234 . 8 1 1 A 72 72 LYS H H 72 7.450 7.477 -0.027 1
1 235 . 8 1 1 A 72 72 LYS HA H 72 4.180 4.031 0.149 1
1 236 . 8 1 1 A 72 72 LYS C C 72 176.180 179.247 -3.067 1
1 237 . 8 1 1 A 72 72 LYS CA C 72 56.950 58.502 -1.552 1
1 238 . 8 1 1 A 72 72 LYS CB C 72 33.610 31.495 2.115 1
1 239 . 8 1 1 A 72 72 LYS N N 72 116.930 117.924 -0.994 1
1 240 . 8 1 1 A 73 73 ILE H H 73 7.440 7.954 -0.514 1
1 241 . 8 1 1 A 73 73 ILE HA H 73 4.180 3.452 0.728 1
1 242 . 8 1 1 A 73 73 ILE C C 73 174.440 178.163 -3.723 1
1 243 . 8 1 1 A 73 73 ILE CA C 73 61.510 64.538 -3.028 1
1 244 . 8 1 1 A 73 73 ILE CB C 73 38.610 37.470 1.140 1
1 245 . 8 1 1 A 73 73 ILE N N 73 114.560 121.321 -6.761 1
1 246 . 8 1 1 A 74 74 SER H H 74 7.790 9.042 -1.252 1
1 247 . 8 1 1 A 74 74 SER HA H 74 4.520 4.148 0.372 1
1 248 . 8 1 1 A 74 74 SER C C 74 171.580 177.615 -6.035 1
1 249 . 8 1 1 A 74 74 SER CA C 74 57.960 61.488 -3.528 1
1 250 . 8 1 1 A 74 74 SER CB C 74 63.820 62.940 0.880 1
1 251 . 8 1 1 A 74 74 SER N N 74 117.310 115.901 1.409 1
1 6 . 9 1 1 A 2 2 SER H H 2 9.010 8.635 0.375 1
1 7 . 9 1 1 A 2 2 SER HA H 2 4.680 4.621 0.059 1
1 8 . 9 1 1 A 2 2 SER N N 2 119.390 119.114 0.276 1
1 9 . 9 1 1 A 3 3 PRO C C 3 177.630 178.807 -1.177 1
1 10 . 9 1 1 A 3 3 PRO CA C 3 65.000 64.849 0.151 1
1 11 . 9 1 1 A 3 3 PRO CB C 3 31.790 32.137 -0.347 1
1 12 . 9 1 1 A 4 4 GLU H H 4 8.600 8.370 0.230 1
1 13 . 9 1 1 A 4 4 GLU HA H 4 3.900 4.112 -0.212 1
1 14 . 9 1 1 A 4 4 GLU C C 4 177.910 179.246 -1.336 1
1 15 . 9 1 1 A 4 4 GLU CB C 4 28.980 29.105 -0.125 1
1 16 . 9 1 1 A 4 4 GLU N N 4 117.750 117.764 -0.014 1
1 17 . 9 1 1 A 5 5 GLU H H 5 7.980 8.119 -0.139 1
1 18 . 9 1 1 A 5 5 GLU HA H 5 4.170 4.082 0.088 1
1 19 . 9 1 1 A 5 5 GLU C C 5 178.290 179.288 -0.998 1
1 20 . 9 1 1 A 5 5 GLU CA C 5 58.140 59.137 -0.997 1
1 21 . 9 1 1 A 5 5 GLU CB C 5 30.450 29.355 1.095 1
1 22 . 9 1 1 A 5 5 GLU N N 5 121.890 120.221 1.669 1
1 23 . 9 1 1 A 6 6 LEU H H 6 8.450 8.031 0.419 1
1 24 . 9 1 1 A 6 6 LEU HA H 6 4.310 3.979 0.331 1
1 25 . 9 1 1 A 6 6 LEU C C 6 176.660 178.867 -2.207 1
1 26 . 9 1 1 A 6 6 LEU CA C 6 57.310 57.770 -0.460 1
1 27 . 9 1 1 A 6 6 LEU CB C 6 42.090 41.804 0.286 1
1 28 . 9 1 1 A 6 6 LEU N N 6 120.250 120.673 -0.423 1
1 29 . 9 1 1 A 7 7 LYS H H 7 8.100 9.123 -1.023 1
1 30 . 9 1 1 A 7 7 LYS HA H 7 3.760 4.065 -0.305 1
1 31 . 9 1 1 A 7 7 LYS C C 7 176.160 179.510 -3.350 1
1 32 . 9 1 1 A 7 7 LYS CA C 7 59.110 59.938 -0.828 1
1 33 . 9 1 1 A 7 7 LYS CB C 7 32.110 32.456 -0.346 1
1 34 . 9 1 1 A 7 7 LYS N N 7 120.960 118.651 2.309 1
1 35 . 9 1 1 A 8 8 GLY H H 8 7.860 8.833 -0.973 1
1 36 . 9 1 1 A 8 8 GLY HA2 H 8 3.970 3.860 0.110 1
1 37 . 9 1 1 A 8 8 GLY HA3 H 8 3.970 3.897 0.073 1
1 38 . 9 1 1 A 8 8 GLY C C 8 175.520 176.137 -0.617 1
1 39 . 9 1 1 A 8 8 GLY CA C 8 46.490 47.379 -0.889 1
1 40 . 9 1 1 A 8 8 GLY N N 8 105.430 107.070 -1.640 1
1 41 . 9 1 1 A 9 9 ILE H H 9 8.130 9.495 -1.365 1
1 42 . 9 1 1 A 9 9 ILE HA H 9 4.140 3.949 0.191 1
1 43 . 9 1 1 A 9 9 ILE C C 9 175.320 178.042 -2.722 1
1 44 . 9 1 1 A 9 9 ILE CA C 9 65.010 64.776 0.234 1
1 45 . 9 1 1 A 9 9 ILE CB C 9 39.040 38.026 1.014 1
1 46 . 9 1 1 A 9 9 ILE N N 9 122.870 122.621 0.249 1
1 47 . 9 1 1 A 10 10 PHE H H 10 8.590 9.092 -0.502 1
1 48 . 9 1 1 A 10 10 PHE HA H 10 4.470 3.955 0.515 1
1 49 . 9 1 1 A 10 10 PHE C C 10 175.010 177.185 -2.175 1
1 50 . 9 1 1 A 10 10 PHE CA C 10 62.470 62.486 -0.016 1
1 51 . 9 1 1 A 10 10 PHE CB C 10 39.670 39.219 0.451 1
1 52 . 9 1 1 A 10 10 PHE N N 10 120.430 120.614 -0.184 1
1 53 . 9 1 1 A 11 11 GLU H H 11 8.600 8.570 0.030 1
1 54 . 9 1 1 A 11 11 GLU HA H 11 3.750 3.825 -0.075 1
1 55 . 9 1 1 A 11 11 GLU C C 11 177.630 178.954 -1.324 1
1 56 . 9 1 1 A 11 11 GLU CA C 11 58.440 59.897 -1.457 1
1 57 . 9 1 1 A 11 11 GLU CB C 11 29.840 29.386 0.454 1
1 58 . 9 1 1 A 11 11 GLU N N 11 115.410 118.147 -2.737 1
1 59 . 9 1 1 A 12 12 LYS H H 12 7.940 8.864 -0.924 1
1 60 . 9 1 1 A 12 12 LYS HA H 12 4.080 3.952 0.128 1
1 61 . 9 1 1 A 12 12 LYS CA C 12 58.440 59.041 -0.601 1
1 62 . 9 1 1 A 12 12 LYS CB C 12 32.720 32.310 0.410 1
1 63 . 9 1 1 A 12 12 LYS N N 12 119.220 120.362 -1.142 1
1 64 . 9 1 1 A 13 13 TYR H H 13 7.740 7.434 0.306 1
1 65 . 9 1 1 A 13 13 TYR HA H 13 4.580 4.386 0.194 1
1 66 . 9 1 1 A 13 13 TYR C C 13 39.870 178.548 -138.678 1
1 67 . 9 1 1 A 13 13 TYR CA C 13 61.280 60.349 0.931 1
1 68 . 9 1 1 A 13 13 TYR CB C 13 175.510 39.294 136.216 1
1 69 . 9 1 1 A 13 13 TYR N N 13 115.320 117.446 -2.126 1
1 70 . 9 1 1 A 14 14 ALA H H 14 9.060 9.147 -0.087 1
1 71 . 9 1 1 A 14 14 ALA HA H 14 3.850 4.021 -0.171 1
1 72 . 9 1 1 A 14 14 ALA C C 14 177.990 179.828 -1.838 1
1 73 . 9 1 1 A 14 14 ALA CA C 14 54.280 54.731 -0.451 1
1 74 . 9 1 1 A 14 14 ALA CB C 14 18.790 17.634 1.156 1
1 75 . 9 1 1 A 14 14 ALA N N 14 120.140 122.631 -2.491 1
1 76 . 9 1 1 A 15 15 ALA H H 15 7.350 8.138 -0.788 1
1 77 . 9 1 1 A 15 15 ALA HA H 15 4.550 4.011 0.539 1
1 78 . 9 1 1 A 15 15 ALA C C 15 176.270 179.293 -3.023 1
1 79 . 9 1 1 A 15 15 ALA CA C 15 52.280 54.966 -2.686 1
1 80 . 9 1 1 A 15 15 ALA CB C 15 19.670 18.378 1.292 1
1 81 . 9 1 1 A 15 15 ALA N N 15 117.640 119.725 -2.085 1
1 82 . 9 1 1 A 16 16 LYS H H 16 7.690 8.268 -0.578 1
1 83 . 9 1 1 A 16 16 LYS HA H 16 4.200 4.063 0.137 1
1 84 . 9 1 1 A 16 16 LYS C C 16 175.830 176.484 -0.654 1
1 85 . 9 1 1 A 16 16 LYS CA C 16 59.780 59.663 0.117 1
1 86 . 9 1 1 A 16 16 LYS CB C 16 33.300 32.217 1.083 1
1 87 . 9 1 1 A 16 16 LYS N N 16 120.340 116.875 3.465 1
1 88 . 9 1 1 A 17 17 GLU H H 17 10.170 7.715 2.455 1
1 89 . 9 1 1 A 17 17 GLU HA H 17 4.990 4.486 0.504 1
1 90 . 9 1 1 A 17 17 GLU C C 17 174.790 176.696 -1.906 1
1 91 . 9 1 1 A 17 17 GLU CA C 17 53.910 55.273 -1.363 1
1 92 . 9 1 1 A 17 17 GLU N N 17 116.560 117.244 -0.684 1
1 93 . 9 1 1 A 18 18 GLY H H 18 9.100 8.652 0.448 1
1 94 . 9 1 1 A 18 18 GLY N N 18 113.230 111.579 1.651 1
1 95 . 9 1 1 A 19 19 ASP H H 19 7.730 8.612 -0.882 1
1 96 . 9 1 1 A 19 19 ASP N N 19 126.280 121.693 4.587 1
1 97 . 9 1 1 A 21 21 ASN H H 21 9.090 8.259 0.831 1
1 98 . 9 1 1 A 21 21 ASN N N 21 115.850 115.410 0.440 1
1 99 . 9 1 1 A 24 24 SER C C 24 176.120 174.576 1.544 1
1 100 . 9 1 1 A 25 25 LYS H H 25 10.400 8.523 1.877 1
1 101 . 9 1 1 A 25 25 LYS C C 25 177.600 177.854 -0.254 1
1 102 . 9 1 1 A 25 25 LYS N N 25 124.350 124.837 -0.487 1
1 103 . 9 1 1 A 26 26 GLU H H 26 9.250 8.410 0.840 1
1 104 . 9 1 1 A 26 26 GLU N N 26 118.470 117.697 0.773 1
1 105 . 9 1 1 A 27 27 GLU C C 27 178.580 178.440 0.140 1
1 106 . 9 1 1 A 27 27 GLU CA C 27 59.920 59.053 0.867 1
1 107 . 9 1 1 A 28 28 LEU H H 28 10.810 9.153 1.657 1
1 108 . 9 1 1 A 28 28 LEU C C 28 177.280 178.489 -1.209 1
1 109 . 9 1 1 A 28 28 LEU CB C 28 43.570 41.672 1.898 1
1 110 . 9 1 1 A 28 28 LEU N N 28 121.060 121.849 -0.789 1
1 111 . 9 1 1 A 29 29 LYS H H 29 9.680 8.483 1.197 1
1 112 . 9 1 1 A 29 29 LYS HA H 29 4.480 3.947 0.533 1
1 113 . 9 1 1 A 29 29 LYS C C 29 176.670 178.682 -2.012 1
1 114 . 9 1 1 A 29 29 LYS CA C 29 60.770 60.018 0.752 1
1 115 . 9 1 1 A 29 29 LYS CB C 29 32.910 32.559 0.351 1
1 116 . 9 1 1 A 29 29 LYS N N 29 121.140 119.192 1.948 1
1 117 . 9 1 1 A 30 30 LEU H H 30 8.410 7.890 0.520 1
1 118 . 9 1 1 A 30 30 LEU CA C 30 57.730 57.853 -0.123 1
1 119 . 9 1 1 A 30 30 LEU CB C 30 42.570 42.001 0.569 1
1 120 . 9 1 1 A 30 30 LEU N N 30 119.000 119.520 -0.520 1
1 121 . 9 1 1 A 31 31 LEU H H 31 9.010 7.723 1.287 1
1 122 . 9 1 1 A 31 31 LEU HA H 31 2.920 3.514 -0.594 1
1 123 . 9 1 1 A 31 31 LEU C C 31 178.280 178.136 0.144 1
1 124 . 9 1 1 A 31 31 LEU CA C 31 59.030 58.408 0.622 1
1 125 . 9 1 1 A 31 31 LEU N N 31 124.840 119.697 5.143 1
1 126 . 9 1 1 A 32 32 LEU H H 32 9.680 8.931 0.749 1
1 127 . 9 1 1 A 32 32 LEU HA H 32 4.490 4.040 0.450 1
1 128 . 9 1 1 A 32 32 LEU C C 32 177.360 179.567 -2.207 1
1 129 . 9 1 1 A 32 32 LEU CA C 32 58.520 57.257 1.263 1
1 130 . 9 1 1 A 32 32 LEU CB C 32 42.760 41.520 1.240 1
1 131 . 9 1 1 A 32 32 LEU N N 32 120.580 119.029 1.551 1
1 132 . 9 1 1 A 33 33 GLN H H 33 9.140 8.189 0.951 1
1 133 . 9 1 1 A 33 33 GLN HA H 33 4.250 4.130 0.120 1
1 134 . 9 1 1 A 33 33 GLN C C 33 176.050 178.275 -2.225 1
1 135 . 9 1 1 A 33 33 GLN CA C 33 58.600 58.860 -0.260 1
1 136 . 9 1 1 A 33 33 GLN CB C 33 29.730 28.657 1.073 1
1 137 . 9 1 1 A 33 33 GLN N N 33 115.010 119.725 -4.715 1
1 138 . 9 1 1 A 34 34 THR H H 34 8.000 8.041 -0.041 1
1 139 . 9 1 1 A 34 34 THR HA H 34 4.390 4.015 0.375 1
1 140 . 9 1 1 A 34 34 THR C C 34 174.130 175.885 -1.755 1
1 141 . 9 1 1 A 34 34 THR CA C 34 65.250 66.403 -1.153 1
1 142 . 9 1 1 A 34 34 THR CB C 34 69.920 69.137 0.783 1
1 143 . 9 1 1 A 34 34 THR N N 34 111.180 114.728 -3.548 1
1 144 . 9 1 1 A 35 35 GLU H H 35 8.810 8.625 0.185 1
1 145 . 9 1 1 A 35 35 GLU HA H 35 4.470 4.000 0.470 1
1 146 . 9 1 1 A 35 35 GLU C C 35 175.430 176.190 -0.760 1
1 147 . 9 1 1 A 35 35 GLU CA C 35 56.170 59.240 -3.070 1
1 148 . 9 1 1 A 35 35 GLU CB C 35 30.900 29.874 1.026 1
1 149 . 9 1 1 A 35 35 GLU N N 35 116.410 121.691 -5.281 1
1 150 . 9 1 1 A 36 36 PHE H H 36 8.230 7.965 0.265 1
1 151 . 9 1 1 A 36 36 PHE HA H 36 5.500 5.062 0.438 1
1 152 . 9 1 1 A 36 36 PHE N N 36 115.090 115.759 -0.669 1
1 153 . 9 1 1 A 37 37 PRO C C 37 178.140 177.493 0.647 1
1 154 . 9 1 1 A 37 37 PRO CA C 37 64.940 64.178 0.762 1
1 155 . 9 1 1 A 37 37 PRO CB C 37 31.600 32.000 -0.400 1
1 156 . 9 1 1 A 38 38 SER H H 38 8.660 8.554 0.106 1
1 157 . 9 1 1 A 38 38 SER HA H 38 4.500 4.382 0.118 1
1 158 . 9 1 1 A 38 38 SER C C 38 174.830 176.317 -1.487 1
1 159 . 9 1 1 A 38 38 SER CA C 38 59.970 60.596 -0.626 1
1 160 . 9 1 1 A 38 38 SER CB C 38 62.690 63.548 -0.858 1
1 161 . 9 1 1 A 38 38 SER N N 38 114.030 114.034 -0.004 1
1 162 . 9 1 1 A 39 39 LEU H H 39 8.260 7.846 0.414 1
1 163 . 9 1 1 A 39 39 LEU HA H 39 4.520 4.101 0.419 1
1 164 . 9 1 1 A 39 39 LEU C C 39 176.780 179.629 -2.849 1
1 165 . 9 1 1 A 39 39 LEU CA C 39 56.600 57.268 -0.668 1
1 166 . 9 1 1 A 39 39 LEU CB C 39 42.610 41.706 0.904 1
1 167 . 9 1 1 A 39 39 LEU N N 39 122.650 122.328 0.322 1
1 168 . 9 1 1 A 40 40 LEU H H 40 8.070 8.098 -0.028 1
1 169 . 9 1 1 A 40 40 LEU HA H 40 4.830 4.024 0.806 1
1 170 . 9 1 1 A 40 40 LEU C C 40 175.690 179.581 -3.891 1
1 171 . 9 1 1 A 40 40 LEU CA C 40 54.510 57.944 -3.434 1
1 172 . 9 1 1 A 40 40 LEU CB C 40 42.020 41.407 0.613 1
1 173 . 9 1 1 A 40 40 LEU N N 40 117.390 118.830 -1.440 1
1 174 . 9 1 1 A 41 41 LYS H H 41 7.770 7.887 -0.117 1
1 175 . 9 1 1 A 41 41 LYS HA H 41 4.610 4.128 0.482 1
1 176 . 9 1 1 A 41 41 LYS C C 41 175.380 177.402 -2.022 1
1 177 . 9 1 1 A 41 41 LYS CA C 41 56.170 58.743 -2.573 1
1 178 . 9 1 1 A 41 41 LYS CB C 41 32.950 31.779 1.171 1
1 179 . 9 1 1 A 41 41 LYS N N 41 120.530 117.724 2.806 1
1 180 . 9 1 1 A 42 42 GLY H H 42 8.390 7.896 0.494 1
1 181 . 9 1 1 A 42 42 GLY HA2 H 42 4.280 4.011 0.269 1
1 182 . 9 1 1 A 42 42 GLY HA3 H 42 4.280 4.012 0.268 1
1 183 . 9 1 1 A 42 42 GLY C C 42 177.190 175.023 2.167 1
1 184 . 9 1 1 A 42 42 GLY N N 42 109.280 108.292 0.988 1
1 185 . 9 1 1 A 43 43 MET H H 43 9.020 8.596 0.424 1
1 186 . 9 1 1 A 43 43 MET C C 43 175.520 175.947 -0.427 1
1 187 . 9 1 1 A 43 43 MET N N 43 121.110 119.647 1.463 1
1 188 . 9 1 1 A 44 44 SER H H 44 8.700 7.797 0.903 1
1 189 . 9 1 1 A 44 44 SER C C 44 173.540 174.056 -0.516 1
1 190 . 9 1 1 A 44 44 SER N N 44 116.190 116.225 -0.035 1
1 191 . 9 1 1 A 45 45 THR H H 45 8.440 8.686 -0.246 1
1 192 . 9 1 1 A 45 45 THR C C 45 174.300 175.284 -0.984 1
1 193 . 9 1 1 A 45 45 THR N N 45 113.740 119.423 -5.683 1
1 194 . 9 1 1 A 46 46 LEU H H 46 9.380 8.809 0.571 1
1 195 . 9 1 1 A 46 46 LEU C C 46 177.760 178.277 -0.517 1
1 196 . 9 1 1 A 46 46 LEU N N 46 123.970 123.469 0.501 1
1 197 . 9 1 1 A 47 47 ASP H H 47 8.990 8.551 0.439 1
1 198 . 9 1 1 A 47 47 ASP N N 47 118.620 118.024 0.596 1
1 199 . 9 1 1 A 49 49 LEU H H 49 9.740 8.107 1.633 1
1 200 . 9 1 1 A 49 49 LEU N N 49 123.880 120.989 2.891 1
1 201 . 9 1 1 A 50 50 PHE H H 50 10.730 8.804 1.926 1
1 202 . 9 1 1 A 50 50 PHE N N 50 121.380 119.373 2.007 1
1 203 . 9 1 1 A 51 51 GLU H H 51 7.860 8.562 -0.702 1
1 204 . 9 1 1 A 51 51 GLU HA H 51 3.530 4.019 -0.489 1
1 205 . 9 1 1 A 51 51 GLU N N 51 114.870 118.351 -3.481 1
1 206 . 9 1 1 A 66 66 PHE CA C 66 58.850 61.165 -2.315 1
1 207 . 9 1 1 A 67 67 GLN H H 67 5.670 8.015 -2.345 1
1 208 . 9 1 1 A 67 67 GLN C C 67 174.810 178.067 -3.257 1
1 209 . 9 1 1 A 67 67 GLN CA C 67 56.340 58.297 -1.957 1
1 210 . 9 1 1 A 67 67 GLN N N 67 114.050 117.267 -3.217 1
1 211 . 9 1 1 A 68 68 VAL H H 68 5.760 7.922 -2.162 1
1 212 . 9 1 1 A 68 68 VAL C C 68 175.770 178.491 -2.721 1
1 213 . 9 1 1 A 68 68 VAL CA C 68 63.990 65.932 -1.942 1
1 214 . 9 1 1 A 68 68 VAL CB C 68 31.310 31.459 -0.149 1
1 215 . 9 1 1 A 68 68 VAL N N 68 116.280 119.696 -3.416 1
1 216 . 9 1 1 A 69 69 LEU H H 69 7.150 8.587 -1.437 1
1 217 . 9 1 1 A 69 69 LEU HA H 69 4.040 4.027 0.013 1
1 218 . 9 1 1 A 69 69 LEU C C 69 176.210 178.355 -2.145 1
1 219 . 9 1 1 A 69 69 LEU CA C 69 56.270 57.345 -1.075 1
1 220 . 9 1 1 A 69 69 LEU CB C 69 42.010 41.868 0.142 1
1 221 . 9 1 1 A 69 69 LEU N N 69 120.350 121.060 -0.710 1
1 222 . 9 1 1 A 70 70 VAL H H 70 6.810 7.174 -0.364 1
1 223 . 9 1 1 A 70 70 VAL HA H 70 3.170 3.238 -0.068 1
1 224 . 9 1 1 A 70 70 VAL C C 70 175.760 177.569 -1.809 1
1 225 . 9 1 1 A 70 70 VAL CA C 70 65.110 66.964 -1.854 1
1 226 . 9 1 1 A 70 70 VAL CB C 70 31.190 31.120 0.070 1
1 227 . 9 1 1 A 70 70 VAL N N 70 115.790 118.632 -2.842 1
1 228 . 9 1 1 A 71 71 LYS H H 71 7.190 7.988 -0.798 1
1 229 . 9 1 1 A 71 71 LYS HA H 71 3.880 3.848 0.032 1
1 230 . 9 1 1 A 71 71 LYS C C 71 176.100 178.894 -2.794 1
1 231 . 9 1 1 A 71 71 LYS CA C 71 57.680 59.433 -1.753 1
1 232 . 9 1 1 A 71 71 LYS CB C 71 31.930 32.160 -0.230 1
1 233 . 9 1 1 A 71 71 LYS N N 71 117.820 119.830 -2.010 1
1 234 . 9 1 1 A 72 72 LYS H H 72 7.450 7.484 -0.034 1
1 235 . 9 1 1 A 72 72 LYS HA H 72 4.180 4.025 0.155 1
1 236 . 9 1 1 A 72 72 LYS C C 72 176.180 179.317 -3.137 1
1 237 . 9 1 1 A 72 72 LYS CA C 72 56.950 58.579 -1.629 1
1 238 . 9 1 1 A 72 72 LYS CB C 72 33.610 31.478 2.132 1
1 239 . 9 1 1 A 72 72 LYS N N 72 116.930 117.858 -0.928 1
1 240 . 9 1 1 A 73 73 ILE H H 73 7.440 8.066 -0.626 1
1 241 . 9 1 1 A 73 73 ILE HA H 73 4.180 3.493 0.687 1
1 242 . 9 1 1 A 73 73 ILE C C 73 174.440 178.189 -3.749 1
1 243 . 9 1 1 A 73 73 ILE CA C 73 61.510 64.339 -2.829 1
1 244 . 9 1 1 A 73 73 ILE CB C 73 38.610 37.430 1.180 1
1 245 . 9 1 1 A 73 73 ILE N N 73 114.560 121.280 -6.720 1
1 246 . 9 1 1 A 74 74 SER H H 74 7.790 9.052 -1.262 1
1 247 . 9 1 1 A 74 74 SER HA H 74 4.520 4.113 0.407 1
1 248 . 9 1 1 A 74 74 SER C C 74 171.580 177.599 -6.019 1
1 249 . 9 1 1 A 74 74 SER CA C 74 57.960 61.488 -3.528 1
1 250 . 9 1 1 A 74 74 SER CB C 74 63.820 62.921 0.899 1
1 251 . 9 1 1 A 74 74 SER N N 74 117.310 116.168 1.142 1
1 6 . 10 1 1 A 2 2 SER H H 2 9.010 8.635 0.375 1
1 7 . 10 1 1 A 2 2 SER HA H 2 4.680 4.621 0.059 1
1 8 . 10 1 1 A 2 2 SER N N 2 119.390 119.114 0.276 1
1 9 . 10 1 1 A 3 3 PRO C C 3 177.630 178.807 -1.177 1
1 10 . 10 1 1 A 3 3 PRO CA C 3 65.000 64.849 0.151 1
1 11 . 10 1 1 A 3 3 PRO CB C 3 31.790 32.137 -0.347 1
1 12 . 10 1 1 A 4 4 GLU H H 4 8.600 8.370 0.230 1
1 13 . 10 1 1 A 4 4 GLU HA H 4 3.900 4.112 -0.212 1
1 14 . 10 1 1 A 4 4 GLU C C 4 177.910 179.246 -1.336 1
1 15 . 10 1 1 A 4 4 GLU CB C 4 28.980 29.105 -0.125 1
1 16 . 10 1 1 A 4 4 GLU N N 4 117.750 117.764 -0.014 1
1 17 . 10 1 1 A 5 5 GLU H H 5 7.980 8.119 -0.139 1
1 18 . 10 1 1 A 5 5 GLU HA H 5 4.170 4.082 0.088 1
1 19 . 10 1 1 A 5 5 GLU C C 5 178.290 179.288 -0.998 1
1 20 . 10 1 1 A 5 5 GLU CA C 5 58.140 59.137 -0.997 1
1 21 . 10 1 1 A 5 5 GLU CB C 5 30.450 29.355 1.095 1
1 22 . 10 1 1 A 5 5 GLU N N 5 121.890 120.221 1.669 1
1 23 . 10 1 1 A 6 6 LEU H H 6 8.450 8.031 0.419 1
1 24 . 10 1 1 A 6 6 LEU HA H 6 4.310 3.979 0.331 1
1 25 . 10 1 1 A 6 6 LEU C C 6 176.660 178.867 -2.207 1
1 26 . 10 1 1 A 6 6 LEU CA C 6 57.310 57.770 -0.460 1
1 27 . 10 1 1 A 6 6 LEU CB C 6 42.090 41.804 0.286 1
1 28 . 10 1 1 A 6 6 LEU N N 6 120.250 120.673 -0.423 1
1 29 . 10 1 1 A 7 7 LYS H H 7 8.100 9.123 -1.023 1
1 30 . 10 1 1 A 7 7 LYS HA H 7 3.760 4.065 -0.305 1
1 31 . 10 1 1 A 7 7 LYS C C 7 176.160 179.510 -3.350 1
1 32 . 10 1 1 A 7 7 LYS CA C 7 59.110 59.938 -0.828 1
1 33 . 10 1 1 A 7 7 LYS CB C 7 32.110 32.456 -0.346 1
1 34 . 10 1 1 A 7 7 LYS N N 7 120.960 118.651 2.309 1
1 35 . 10 1 1 A 8 8 GLY H H 8 7.860 8.833 -0.973 1
1 36 . 10 1 1 A 8 8 GLY HA2 H 8 3.970 3.860 0.110 1
1 37 . 10 1 1 A 8 8 GLY HA3 H 8 3.970 3.897 0.073 1
1 38 . 10 1 1 A 8 8 GLY C C 8 175.520 176.137 -0.617 1
1 39 . 10 1 1 A 8 8 GLY CA C 8 46.490 47.379 -0.889 1
1 40 . 10 1 1 A 8 8 GLY N N 8 105.430 107.070 -1.640 1
1 41 . 10 1 1 A 9 9 ILE H H 9 8.130 9.495 -1.365 1
1 42 . 10 1 1 A 9 9 ILE HA H 9 4.140 3.949 0.191 1
1 43 . 10 1 1 A 9 9 ILE C C 9 175.320 178.042 -2.722 1
1 44 . 10 1 1 A 9 9 ILE CA C 9 65.010 64.776 0.234 1
1 45 . 10 1 1 A 9 9 ILE CB C 9 39.040 38.026 1.014 1
1 46 . 10 1 1 A 9 9 ILE N N 9 122.870 122.621 0.249 1
1 47 . 10 1 1 A 10 10 PHE H H 10 8.590 9.092 -0.502 1
1 48 . 10 1 1 A 10 10 PHE HA H 10 4.470 3.955 0.515 1
1 49 . 10 1 1 A 10 10 PHE C C 10 175.010 177.185 -2.175 1
1 50 . 10 1 1 A 10 10 PHE CA C 10 62.470 62.486 -0.016 1
1 51 . 10 1 1 A 10 10 PHE CB C 10 39.670 39.219 0.451 1
1 52 . 10 1 1 A 10 10 PHE N N 10 120.430 120.614 -0.184 1
1 53 . 10 1 1 A 11 11 GLU H H 11 8.600 8.570 0.030 1
1 54 . 10 1 1 A 11 11 GLU HA H 11 3.750 3.825 -0.075 1
1 55 . 10 1 1 A 11 11 GLU C C 11 177.630 178.954 -1.324 1
1 56 . 10 1 1 A 11 11 GLU CA C 11 58.440 59.897 -1.457 1
1 57 . 10 1 1 A 11 11 GLU CB C 11 29.840 29.386 0.454 1
1 58 . 10 1 1 A 11 11 GLU N N 11 115.410 118.147 -2.737 1
1 59 . 10 1 1 A 12 12 LYS H H 12 7.940 8.864 -0.924 1
1 60 . 10 1 1 A 12 12 LYS HA H 12 4.080 3.952 0.128 1
1 61 . 10 1 1 A 12 12 LYS CA C 12 58.440 59.041 -0.601 1
1 62 . 10 1 1 A 12 12 LYS CB C 12 32.720 32.310 0.410 1
1 63 . 10 1 1 A 12 12 LYS N N 12 119.220 120.362 -1.142 1
1 64 . 10 1 1 A 13 13 TYR H H 13 7.740 7.434 0.306 1
1 65 . 10 1 1 A 13 13 TYR HA H 13 4.580 4.386 0.194 1
1 66 . 10 1 1 A 13 13 TYR C C 13 39.870 178.548 -138.678 1
1 67 . 10 1 1 A 13 13 TYR CA C 13 61.280 60.349 0.931 1
1 68 . 10 1 1 A 13 13 TYR CB C 13 175.510 39.294 136.216 1
1 69 . 10 1 1 A 13 13 TYR N N 13 115.320 117.446 -2.126 1
1 70 . 10 1 1 A 14 14 ALA H H 14 9.060 9.147 -0.087 1
1 71 . 10 1 1 A 14 14 ALA HA H 14 3.850 4.021 -0.171 1
1 72 . 10 1 1 A 14 14 ALA C C 14 177.990 179.828 -1.838 1
1 73 . 10 1 1 A 14 14 ALA CA C 14 54.280 54.731 -0.451 1
1 74 . 10 1 1 A 14 14 ALA CB C 14 18.790 17.634 1.156 1
1 75 . 10 1 1 A 14 14 ALA N N 14 120.140 122.631 -2.491 1
1 76 . 10 1 1 A 15 15 ALA H H 15 7.350 8.138 -0.788 1
1 77 . 10 1 1 A 15 15 ALA HA H 15 4.550 4.011 0.539 1
1 78 . 10 1 1 A 15 15 ALA C C 15 176.270 179.293 -3.023 1
1 79 . 10 1 1 A 15 15 ALA CA C 15 52.280 54.966 -2.686 1
1 80 . 10 1 1 A 15 15 ALA CB C 15 19.670 18.378 1.292 1
1 81 . 10 1 1 A 15 15 ALA N N 15 117.640 119.725 -2.085 1
1 82 . 10 1 1 A 16 16 LYS H H 16 7.690 8.268 -0.578 1
1 83 . 10 1 1 A 16 16 LYS HA H 16 4.200 4.063 0.137 1
1 84 . 10 1 1 A 16 16 LYS C C 16 175.830 176.484 -0.654 1
1 85 . 10 1 1 A 16 16 LYS CA C 16 59.780 59.663 0.117 1
1 86 . 10 1 1 A 16 16 LYS CB C 16 33.300 32.217 1.083 1
1 87 . 10 1 1 A 16 16 LYS N N 16 120.340 116.875 3.465 1
1 88 . 10 1 1 A 17 17 GLU H H 17 10.170 7.715 2.455 1
1 89 . 10 1 1 A 17 17 GLU HA H 17 4.990 4.486 0.504 1
1 90 . 10 1 1 A 17 17 GLU C C 17 174.790 176.696 -1.906 1
1 91 . 10 1 1 A 17 17 GLU CA C 17 53.910 55.273 -1.363 1
1 92 . 10 1 1 A 17 17 GLU N N 17 116.560 117.244 -0.684 1
1 93 . 10 1 1 A 18 18 GLY H H 18 9.100 8.652 0.448 1
1 94 . 10 1 1 A 18 18 GLY N N 18 113.230 111.579 1.651 1
1 95 . 10 1 1 A 19 19 ASP H H 19 7.730 8.612 -0.882 1
1 96 . 10 1 1 A 19 19 ASP N N 19 126.280 121.693 4.587 1
1 97 . 10 1 1 A 21 21 ASN H H 21 9.090 8.259 0.831 1
1 98 . 10 1 1 A 21 21 ASN N N 21 115.850 115.410 0.440 1
1 99 . 10 1 1 A 24 24 SER C C 24 176.120 174.576 1.544 1
1 100 . 10 1 1 A 25 25 LYS H H 25 10.400 8.523 1.877 1
1 101 . 10 1 1 A 25 25 LYS C C 25 177.600 177.854 -0.254 1
1 102 . 10 1 1 A 25 25 LYS N N 25 124.350 124.837 -0.487 1
1 103 . 10 1 1 A 26 26 GLU H H 26 9.250 8.410 0.840 1
1 104 . 10 1 1 A 26 26 GLU N N 26 118.470 117.697 0.773 1
1 105 . 10 1 1 A 27 27 GLU C C 27 178.580 178.440 0.140 1
1 106 . 10 1 1 A 27 27 GLU CA C 27 59.920 59.053 0.867 1
1 107 . 10 1 1 A 28 28 LEU H H 28 10.810 9.153 1.657 1
1 108 . 10 1 1 A 28 28 LEU C C 28 177.280 178.489 -1.209 1
1 109 . 10 1 1 A 28 28 LEU CB C 28 43.570 41.672 1.898 1
1 110 . 10 1 1 A 28 28 LEU N N 28 121.060 121.849 -0.789 1
1 111 . 10 1 1 A 29 29 LYS H H 29 9.680 8.483 1.197 1
1 112 . 10 1 1 A 29 29 LYS HA H 29 4.480 3.947 0.533 1
1 113 . 10 1 1 A 29 29 LYS C C 29 176.670 178.682 -2.012 1
1 114 . 10 1 1 A 29 29 LYS CA C 29 60.770 60.018 0.752 1
1 115 . 10 1 1 A 29 29 LYS CB C 29 32.910 32.559 0.351 1
1 116 . 10 1 1 A 29 29 LYS N N 29 121.140 119.192 1.948 1
1 117 . 10 1 1 A 30 30 LEU H H 30 8.410 7.890 0.520 1
1 118 . 10 1 1 A 30 30 LEU CA C 30 57.730 57.853 -0.123 1
1 119 . 10 1 1 A 30 30 LEU CB C 30 42.570 42.001 0.569 1
1 120 . 10 1 1 A 30 30 LEU N N 30 119.000 119.520 -0.520 1
1 121 . 10 1 1 A 31 31 LEU H H 31 9.010 7.723 1.287 1
1 122 . 10 1 1 A 31 31 LEU HA H 31 2.920 3.514 -0.594 1
1 123 . 10 1 1 A 31 31 LEU C C 31 178.280 178.136 0.144 1
1 124 . 10 1 1 A 31 31 LEU CA C 31 59.030 58.408 0.622 1
1 125 . 10 1 1 A 31 31 LEU N N 31 124.840 119.697 5.143 1
1 126 . 10 1 1 A 32 32 LEU H H 32 9.680 8.931 0.749 1
1 127 . 10 1 1 A 32 32 LEU HA H 32 4.490 4.040 0.450 1
1 128 . 10 1 1 A 32 32 LEU C C 32 177.360 179.567 -2.207 1
1 129 . 10 1 1 A 32 32 LEU CA C 32 58.520 57.257 1.263 1
1 130 . 10 1 1 A 32 32 LEU CB C 32 42.760 41.520 1.240 1
1 131 . 10 1 1 A 32 32 LEU N N 32 120.580 119.029 1.551 1
1 132 . 10 1 1 A 33 33 GLN H H 33 9.140 8.189 0.951 1
1 133 . 10 1 1 A 33 33 GLN HA H 33 4.250 4.130 0.120 1
1 134 . 10 1 1 A 33 33 GLN C C 33 176.050 178.275 -2.225 1
1 135 . 10 1 1 A 33 33 GLN CA C 33 58.600 58.860 -0.260 1
1 136 . 10 1 1 A 33 33 GLN CB C 33 29.730 28.657 1.073 1
1 137 . 10 1 1 A 33 33 GLN N N 33 115.010 119.725 -4.715 1
1 138 . 10 1 1 A 34 34 THR H H 34 8.000 8.041 -0.041 1
1 139 . 10 1 1 A 34 34 THR HA H 34 4.390 4.015 0.375 1
1 140 . 10 1 1 A 34 34 THR C C 34 174.130 175.885 -1.755 1
1 141 . 10 1 1 A 34 34 THR CA C 34 65.250 66.403 -1.153 1
1 142 . 10 1 1 A 34 34 THR CB C 34 69.920 69.137 0.783 1
1 143 . 10 1 1 A 34 34 THR N N 34 111.180 114.728 -3.548 1
1 144 . 10 1 1 A 35 35 GLU H H 35 8.810 8.625 0.185 1
1 145 . 10 1 1 A 35 35 GLU HA H 35 4.470 4.000 0.470 1
1 146 . 10 1 1 A 35 35 GLU C C 35 175.430 176.190 -0.760 1
1 147 . 10 1 1 A 35 35 GLU CA C 35 56.170 59.240 -3.070 1
1 148 . 10 1 1 A 35 35 GLU CB C 35 30.900 29.874 1.026 1
1 149 . 10 1 1 A 35 35 GLU N N 35 116.410 121.691 -5.281 1
1 150 . 10 1 1 A 36 36 PHE H H 36 8.230 7.965 0.265 1
1 151 . 10 1 1 A 36 36 PHE HA H 36 5.500 5.062 0.438 1
1 152 . 10 1 1 A 36 36 PHE N N 36 115.090 115.759 -0.669 1
1 153 . 10 1 1 A 37 37 PRO C C 37 178.140 177.493 0.647 1
1 154 . 10 1 1 A 37 37 PRO CA C 37 64.940 64.178 0.762 1
1 155 . 10 1 1 A 37 37 PRO CB C 37 31.600 32.000 -0.400 1
1 156 . 10 1 1 A 38 38 SER H H 38 8.660 8.554 0.106 1
1 157 . 10 1 1 A 38 38 SER HA H 38 4.500 4.382 0.118 1
1 158 . 10 1 1 A 38 38 SER C C 38 174.830 176.317 -1.487 1
1 159 . 10 1 1 A 38 38 SER CA C 38 59.970 60.596 -0.626 1
1 160 . 10 1 1 A 38 38 SER CB C 38 62.690 63.548 -0.858 1
1 161 . 10 1 1 A 38 38 SER N N 38 114.030 114.034 -0.004 1
1 162 . 10 1 1 A 39 39 LEU H H 39 8.260 7.846 0.414 1
1 163 . 10 1 1 A 39 39 LEU HA H 39 4.520 4.101 0.419 1
1 164 . 10 1 1 A 39 39 LEU C C 39 176.780 179.629 -2.849 1
1 165 . 10 1 1 A 39 39 LEU CA C 39 56.600 57.268 -0.668 1
1 166 . 10 1 1 A 39 39 LEU CB C 39 42.610 41.706 0.904 1
1 167 . 10 1 1 A 39 39 LEU N N 39 122.650 122.328 0.322 1
1 168 . 10 1 1 A 40 40 LEU H H 40 8.070 8.098 -0.028 1
1 169 . 10 1 1 A 40 40 LEU HA H 40 4.830 4.024 0.806 1
1 170 . 10 1 1 A 40 40 LEU C C 40 175.690 179.581 -3.891 1
1 171 . 10 1 1 A 40 40 LEU CA C 40 54.510 57.944 -3.434 1
1 172 . 10 1 1 A 40 40 LEU CB C 40 42.020 41.407 0.613 1
1 173 . 10 1 1 A 40 40 LEU N N 40 117.390 118.830 -1.440 1
1 174 . 10 1 1 A 41 41 LYS H H 41 7.770 7.887 -0.117 1
1 175 . 10 1 1 A 41 41 LYS HA H 41 4.610 4.128 0.482 1
1 176 . 10 1 1 A 41 41 LYS C C 41 175.380 177.402 -2.022 1
1 177 . 10 1 1 A 41 41 LYS CA C 41 56.170 58.743 -2.573 1
1 178 . 10 1 1 A 41 41 LYS CB C 41 32.950 31.779 1.171 1
1 179 . 10 1 1 A 41 41 LYS N N 41 120.530 117.724 2.806 1
1 180 . 10 1 1 A 42 42 GLY H H 42 8.390 7.896 0.494 1
1 181 . 10 1 1 A 42 42 GLY HA2 H 42 4.280 4.011 0.269 1
1 182 . 10 1 1 A 42 42 GLY HA3 H 42 4.280 4.012 0.268 1
1 183 . 10 1 1 A 42 42 GLY C C 42 177.190 175.023 2.167 1
1 184 . 10 1 1 A 42 42 GLY N N 42 109.280 108.292 0.988 1
1 185 . 10 1 1 A 43 43 MET H H 43 9.020 8.596 0.424 1
1 186 . 10 1 1 A 43 43 MET C C 43 175.520 175.947 -0.427 1
1 187 . 10 1 1 A 43 43 MET N N 43 121.110 119.647 1.463 1
1 188 . 10 1 1 A 44 44 SER H H 44 8.700 7.797 0.903 1
1 189 . 10 1 1 A 44 44 SER C C 44 173.540 174.056 -0.516 1
1 190 . 10 1 1 A 44 44 SER N N 44 116.190 116.225 -0.035 1
1 191 . 10 1 1 A 45 45 THR H H 45 8.440 8.686 -0.246 1
1 192 . 10 1 1 A 45 45 THR C C 45 174.300 175.284 -0.984 1
1 193 . 10 1 1 A 45 45 THR N N 45 113.740 119.423 -5.683 1
1 194 . 10 1 1 A 46 46 LEU H H 46 9.380 8.809 0.571 1
1 195 . 10 1 1 A 46 46 LEU C C 46 177.760 178.277 -0.517 1
1 196 . 10 1 1 A 46 46 LEU N N 46 123.970 123.469 0.501 1
1 197 . 10 1 1 A 47 47 ASP H H 47 8.990 8.551 0.439 1
1 198 . 10 1 1 A 47 47 ASP N N 47 118.620 118.024 0.596 1
1 199 . 10 1 1 A 49 49 LEU H H 49 9.740 8.107 1.633 1
1 200 . 10 1 1 A 49 49 LEU N N 49 123.880 120.989 2.891 1
1 201 . 10 1 1 A 50 50 PHE H H 50 10.730 8.804 1.926 1
1 202 . 10 1 1 A 50 50 PHE N N 50 121.380 119.373 2.007 1
1 203 . 10 1 1 A 51 51 GLU H H 51 7.860 8.562 -0.702 1
1 204 . 10 1 1 A 51 51 GLU HA H 51 3.530 4.019 -0.489 1
1 205 . 10 1 1 A 51 51 GLU N N 51 114.870 118.351 -3.481 1
1 206 . 10 1 1 A 66 66 PHE CA C 66 58.850 61.165 -2.315 1
1 207 . 10 1 1 A 67 67 GLN H H 67 5.670 8.015 -2.345 1
1 208 . 10 1 1 A 67 67 GLN C C 67 174.810 178.067 -3.257 1
1 209 . 10 1 1 A 67 67 GLN CA C 67 56.340 58.297 -1.957 1
1 210 . 10 1 1 A 67 67 GLN N N 67 114.050 117.267 -3.217 1
1 211 . 10 1 1 A 68 68 VAL H H 68 5.760 7.922 -2.162 1
1 212 . 10 1 1 A 68 68 VAL C C 68 175.770 178.491 -2.721 1
1 213 . 10 1 1 A 68 68 VAL CA C 68 63.990 65.932 -1.942 1
1 214 . 10 1 1 A 68 68 VAL CB C 68 31.310 31.459 -0.149 1
1 215 . 10 1 1 A 68 68 VAL N N 68 116.280 119.696 -3.416 1
1 216 . 10 1 1 A 69 69 LEU H H 69 7.150 8.587 -1.437 1
1 217 . 10 1 1 A 69 69 LEU HA H 69 4.040 4.027 0.013 1
1 218 . 10 1 1 A 69 69 LEU C C 69 176.210 178.355 -2.145 1
1 219 . 10 1 1 A 69 69 LEU CA C 69 56.270 57.345 -1.075 1
1 220 . 10 1 1 A 69 69 LEU CB C 69 42.010 41.868 0.142 1
1 221 . 10 1 1 A 69 69 LEU N N 69 120.350 121.060 -0.710 1
1 222 . 10 1 1 A 70 70 VAL H H 70 6.810 7.174 -0.364 1
1 223 . 10 1 1 A 70 70 VAL HA H 70 3.170 3.238 -0.068 1
1 224 . 10 1 1 A 70 70 VAL C C 70 175.760 177.569 -1.809 1
1 225 . 10 1 1 A 70 70 VAL CA C 70 65.110 66.964 -1.854 1
1 226 . 10 1 1 A 70 70 VAL CB C 70 31.190 31.120 0.070 1
1 227 . 10 1 1 A 70 70 VAL N N 70 115.790 118.632 -2.842 1
1 228 . 10 1 1 A 71 71 LYS H H 71 7.190 7.988 -0.798 1
1 229 . 10 1 1 A 71 71 LYS HA H 71 3.880 3.848 0.032 1
1 230 . 10 1 1 A 71 71 LYS C C 71 176.100 178.894 -2.794 1
1 231 . 10 1 1 A 71 71 LYS CA C 71 57.680 59.433 -1.753 1
1 232 . 10 1 1 A 71 71 LYS CB C 71 31.930 32.160 -0.230 1
1 233 . 10 1 1 A 71 71 LYS N N 71 117.820 119.830 -2.010 1
1 234 . 10 1 1 A 72 72 LYS H H 72 7.450 7.484 -0.034 1
1 235 . 10 1 1 A 72 72 LYS HA H 72 4.180 4.025 0.155 1
1 236 . 10 1 1 A 72 72 LYS C C 72 176.180 179.317 -3.137 1
1 237 . 10 1 1 A 72 72 LYS CA C 72 56.950 58.579 -1.629 1
1 238 . 10 1 1 A 72 72 LYS CB C 72 33.610 31.478 2.132 1
1 239 . 10 1 1 A 72 72 LYS N N 72 116.930 117.858 -0.928 1
1 240 . 10 1 1 A 73 73 ILE H H 73 7.440 8.066 -0.626 1
1 241 . 10 1 1 A 73 73 ILE HA H 73 4.180 3.493 0.687 1
1 242 . 10 1 1 A 73 73 ILE C C 73 174.440 178.189 -3.749 1
1 243 . 10 1 1 A 73 73 ILE CA C 73 61.510 64.339 -2.829 1
1 244 . 10 1 1 A 73 73 ILE CB C 73 38.610 37.430 1.180 1
1 245 . 10 1 1 A 73 73 ILE N N 73 114.560 121.280 -6.720 1
1 246 . 10 1 1 A 74 74 SER H H 74 7.790 9.052 -1.262 1
1 247 . 10 1 1 A 74 74 SER HA H 74 4.520 4.113 0.407 1
1 248 . 10 1 1 A 74 74 SER C C 74 171.580 177.599 -6.019 1
1 249 . 10 1 1 A 74 74 SER CA C 74 57.960 61.488 -3.528 1
1 250 . 10 1 1 A 74 74 SER CB C 74 63.820 62.921 0.899 1
1 251 . 10 1 1 A 74 74 SER N N 74 117.310 116.168 1.142 1
1 6 . 11 1 1 A 2 2 SER H H 2 9.010 8.181 0.829 1
1 7 . 11 1 1 A 2 2 SER HA H 2 4.680 4.548 0.132 1
1 8 . 11 1 1 A 2 2 SER N N 2 119.390 115.102 4.288 1
1 9 . 11 1 1 A 3 3 PRO C C 3 177.630 178.646 -1.016 1
1 10 . 11 1 1 A 3 3 PRO CA C 3 65.000 65.010 -0.010 1
1 11 . 11 1 1 A 3 3 PRO CB C 3 31.790 32.078 -0.288 1
1 12 . 11 1 1 A 4 4 GLU H H 4 8.600 8.397 0.203 1
1 13 . 11 1 1 A 4 4 GLU HA H 4 3.900 4.108 -0.208 1
1 14 . 11 1 1 A 4 4 GLU C C 4 177.910 179.249 -1.339 1
1 15 . 11 1 1 A 4 4 GLU CB C 4 28.980 29.220 -0.240 1
1 16 . 11 1 1 A 4 4 GLU N N 4 117.750 117.660 0.090 1
1 17 . 11 1 1 A 5 5 GLU H H 5 7.980 8.119 -0.139 1
1 18 . 11 1 1 A 5 5 GLU HA H 5 4.170 4.046 0.124 1
1 19 . 11 1 1 A 5 5 GLU C C 5 178.290 179.221 -0.931 1
1 20 . 11 1 1 A 5 5 GLU CA C 5 58.140 59.132 -0.992 1
1 21 . 11 1 1 A 5 5 GLU CB C 5 30.450 29.362 1.088 1
1 22 . 11 1 1 A 5 5 GLU N N 5 121.890 120.395 1.495 1
1 23 . 11 1 1 A 6 6 LEU H H 6 8.450 8.162 0.288 1
1 24 . 11 1 1 A 6 6 LEU HA H 6 4.310 4.016 0.294 1
1 25 . 11 1 1 A 6 6 LEU C C 6 176.660 178.863 -2.203 1
1 26 . 11 1 1 A 6 6 LEU CA C 6 57.310 57.789 -0.479 1
1 27 . 11 1 1 A 6 6 LEU CB C 6 42.090 41.748 0.342 1
1 28 . 11 1 1 A 6 6 LEU N N 6 120.250 120.710 -0.460 1
1 29 . 11 1 1 A 7 7 LYS H H 7 8.100 9.038 -0.938 1
1 30 . 11 1 1 A 7 7 LYS HA H 7 3.760 4.117 -0.357 1
1 31 . 11 1 1 A 7 7 LYS C C 7 176.160 179.475 -3.315 1
1 32 . 11 1 1 A 7 7 LYS CA C 7 59.110 59.890 -0.780 1
1 33 . 11 1 1 A 7 7 LYS CB C 7 32.110 32.467 -0.357 1
1 34 . 11 1 1 A 7 7 LYS N N 7 120.960 118.806 2.154 1
1 35 . 11 1 1 A 8 8 GLY H H 8 7.860 8.998 -1.138 1
1 36 . 11 1 1 A 8 8 GLY HA2 H 8 3.970 3.844 0.126 1
1 37 . 11 1 1 A 8 8 GLY HA3 H 8 3.970 3.878 0.092 1
1 38 . 11 1 1 A 8 8 GLY C C 8 175.520 176.216 -0.696 1
1 39 . 11 1 1 A 8 8 GLY CA C 8 46.490 47.487 -0.997 1
1 40 . 11 1 1 A 8 8 GLY N N 8 105.430 107.323 -1.893 1
1 41 . 11 1 1 A 9 9 ILE H H 9 8.130 9.524 -1.394 1
1 42 . 11 1 1 A 9 9 ILE HA H 9 4.140 3.923 0.217 1
1 43 . 11 1 1 A 9 9 ILE C C 9 175.320 178.025 -2.705 1
1 44 . 11 1 1 A 9 9 ILE CA C 9 65.010 64.749 0.261 1
1 45 . 11 1 1 A 9 9 ILE CB C 9 39.040 37.945 1.095 1
1 46 . 11 1 1 A 9 9 ILE N N 9 122.870 122.668 0.202 1
1 47 . 11 1 1 A 10 10 PHE H H 10 8.590 9.301 -0.711 1
1 48 . 11 1 1 A 10 10 PHE HA H 10 4.470 3.895 0.575 1
1 49 . 11 1 1 A 10 10 PHE C C 10 175.010 177.110 -2.100 1
1 50 . 11 1 1 A 10 10 PHE CA C 10 62.470 62.410 0.060 1
1 51 . 11 1 1 A 10 10 PHE CB C 10 39.670 39.123 0.547 1
1 52 . 11 1 1 A 10 10 PHE N N 10 120.430 120.470 -0.040 1
1 53 . 11 1 1 A 11 11 GLU H H 11 8.600 8.740 -0.140 1
1 54 . 11 1 1 A 11 11 GLU HA H 11 3.750 3.839 -0.089 1
1 55 . 11 1 1 A 11 11 GLU C C 11 177.630 178.895 -1.265 1
1 56 . 11 1 1 A 11 11 GLU CA C 11 58.440 59.859 -1.419 1
1 57 . 11 1 1 A 11 11 GLU CB C 11 29.840 29.421 0.419 1
1 58 . 11 1 1 A 11 11 GLU N N 11 115.410 118.213 -2.803 1
1 59 . 11 1 1 A 12 12 LYS H H 12 7.940 8.736 -0.796 1
1 60 . 11 1 1 A 12 12 LYS HA H 12 4.080 3.994 0.086 1
1 61 . 11 1 1 A 12 12 LYS CA C 12 58.440 59.098 -0.658 1
1 62 . 11 1 1 A 12 12 LYS CB C 12 32.720 32.281 0.439 1
1 63 . 11 1 1 A 12 12 LYS N N 12 119.220 120.309 -1.089 1
1 64 . 11 1 1 A 13 13 TYR H H 13 7.740 7.372 0.368 1
1 65 . 11 1 1 A 13 13 TYR HA H 13 4.580 4.336 0.244 1
1 66 . 11 1 1 A 13 13 TYR C C 13 39.870 178.316 -138.446 1
1 67 . 11 1 1 A 13 13 TYR CA C 13 61.280 60.285 0.995 1
1 68 . 11 1 1 A 13 13 TYR CB C 13 175.510 39.258 136.252 1
1 69 . 11 1 1 A 13 13 TYR N N 13 115.320 117.172 -1.852 1
1 70 . 11 1 1 A 14 14 ALA H H 14 9.060 8.886 0.174 1
1 71 . 11 1 1 A 14 14 ALA HA H 14 3.850 3.783 0.067 1
1 72 . 11 1 1 A 14 14 ALA C C 14 177.990 179.964 -1.974 1
1 73 . 11 1 1 A 14 14 ALA CA C 14 54.280 54.725 -0.445 1
1 74 . 11 1 1 A 14 14 ALA CB C 14 18.790 17.666 1.124 1
1 75 . 11 1 1 A 14 14 ALA N N 14 120.140 122.626 -2.486 1
1 76 . 11 1 1 A 15 15 ALA H H 15 7.350 8.683 -1.333 1
1 77 . 11 1 1 A 15 15 ALA HA H 15 4.550 4.015 0.535 1
1 78 . 11 1 1 A 15 15 ALA C C 15 176.270 179.173 -2.903 1
1 79 . 11 1 1 A 15 15 ALA CA C 15 52.280 54.982 -2.702 1
1 80 . 11 1 1 A 15 15 ALA CB C 15 19.670 18.374 1.296 1
1 81 . 11 1 1 A 15 15 ALA N N 15 117.640 120.013 -2.373 1
1 82 . 11 1 1 A 16 16 LYS H H 16 7.690 8.049 -0.359 1
1 83 . 11 1 1 A 16 16 LYS HA H 16 4.200 4.002 0.198 1
1 84 . 11 1 1 A 16 16 LYS C C 16 175.830 177.087 -1.257 1
1 85 . 11 1 1 A 16 16 LYS CA C 16 59.780 59.722 0.058 1
1 86 . 11 1 1 A 16 16 LYS CB C 16 33.300 32.322 0.978 1
1 87 . 11 1 1 A 16 16 LYS N N 16 120.340 117.164 3.176 1
1 88 . 11 1 1 A 17 17 GLU H H 17 10.170 8.341 1.829 1
1 89 . 11 1 1 A 17 17 GLU HA H 17 4.990 4.472 0.518 1
1 90 . 11 1 1 A 17 17 GLU C C 17 174.790 176.943 -2.153 1
1 91 . 11 1 1 A 17 17 GLU CA C 17 53.910 55.314 -1.404 1
1 92 . 11 1 1 A 17 17 GLU N N 17 116.560 118.265 -1.705 1
1 93 . 11 1 1 A 18 18 GLY H H 18 9.100 8.536 0.564 1
1 94 . 11 1 1 A 18 18 GLY N N 18 113.230 111.285 1.945 1
1 95 . 11 1 1 A 19 19 ASP H H 19 7.730 8.626 -0.896 1
1 96 . 11 1 1 A 19 19 ASP N N 19 126.280 121.329 4.951 1
1 97 . 11 1 1 A 21 21 ASN H H 21 9.090 8.237 0.853 1
1 98 . 11 1 1 A 21 21 ASN N N 21 115.850 115.273 0.577 1
1 99 . 11 1 1 A 24 24 SER C C 24 176.120 174.543 1.577 1
1 100 . 11 1 1 A 25 25 LYS H H 25 10.400 8.594 1.806 1
1 101 . 11 1 1 A 25 25 LYS C C 25 177.600 177.866 -0.266 1
1 102 . 11 1 1 A 25 25 LYS N N 25 124.350 125.001 -0.651 1
1 103 . 11 1 1 A 26 26 GLU H H 26 9.250 8.361 0.889 1
1 104 . 11 1 1 A 26 26 GLU N N 26 118.470 117.661 0.809 1
1 105 . 11 1 1 A 27 27 GLU C C 27 178.580 178.630 -0.050 1
1 106 . 11 1 1 A 27 27 GLU CA C 27 59.920 58.997 0.923 1
1 107 . 11 1 1 A 28 28 LEU H H 28 10.810 9.236 1.574 1
1 108 . 11 1 1 A 28 28 LEU C C 28 177.280 178.406 -1.126 1
1 109 . 11 1 1 A 28 28 LEU CB C 28 43.570 41.702 1.868 1
1 110 . 11 1 1 A 28 28 LEU N N 28 121.060 121.802 -0.742 1
1 111 . 11 1 1 A 29 29 LYS H H 29 9.680 8.463 1.217 1
1 112 . 11 1 1 A 29 29 LYS HA H 29 4.480 3.947 0.533 1
1 113 . 11 1 1 A 29 29 LYS C C 29 176.670 178.667 -1.997 1
1 114 . 11 1 1 A 29 29 LYS CA C 29 60.770 60.006 0.764 1
1 115 . 11 1 1 A 29 29 LYS CB C 29 32.910 32.548 0.362 1
1 116 . 11 1 1 A 29 29 LYS N N 29 121.140 119.127 2.013 1
1 117 . 11 1 1 A 30 30 LEU H H 30 8.410 7.832 0.578 1
1 118 . 11 1 1 A 30 30 LEU CA C 30 57.730 57.861 -0.131 1
1 119 . 11 1 1 A 30 30 LEU CB C 30 42.570 41.980 0.590 1
1 120 . 11 1 1 A 30 30 LEU N N 30 119.000 119.554 -0.554 1
1 121 . 11 1 1 A 31 31 LEU H H 31 9.010 7.806 1.204 1
1 122 . 11 1 1 A 31 31 LEU HA H 31 2.920 3.407 -0.487 1
1 123 . 11 1 1 A 31 31 LEU C C 31 178.280 178.127 0.153 1
1 124 . 11 1 1 A 31 31 LEU CA C 31 59.030 58.312 0.718 1
1 125 . 11 1 1 A 31 31 LEU N N 31 124.840 119.619 5.221 1
1 126 . 11 1 1 A 32 32 LEU H H 32 9.680 9.035 0.645 1
1 127 . 11 1 1 A 32 32 LEU HA H 32 4.490 4.024 0.466 1
1 128 . 11 1 1 A 32 32 LEU C C 32 177.360 179.723 -2.363 1
1 129 . 11 1 1 A 32 32 LEU CA C 32 58.520 57.221 1.299 1
1 130 . 11 1 1 A 32 32 LEU CB C 32 42.760 41.492 1.268 1
1 131 . 11 1 1 A 32 32 LEU N N 32 120.580 119.008 1.572 1
1 132 . 11 1 1 A 33 33 GLN H H 33 9.140 8.119 1.021 1
1 133 . 11 1 1 A 33 33 GLN HA H 33 4.250 4.120 0.130 1
1 134 . 11 1 1 A 33 33 GLN C C 33 176.050 178.128 -2.078 1
1 135 . 11 1 1 A 33 33 GLN CA C 33 58.600 58.768 -0.168 1
1 136 . 11 1 1 A 33 33 GLN CB C 33 29.730 28.538 1.192 1
1 137 . 11 1 1 A 33 33 GLN N N 33 115.010 119.703 -4.693 1
1 138 . 11 1 1 A 34 34 THR H H 34 8.000 7.869 0.131 1
1 139 . 11 1 1 A 34 34 THR HA H 34 4.390 4.045 0.345 1
1 140 . 11 1 1 A 34 34 THR C C 34 174.130 175.937 -1.807 1
1 141 . 11 1 1 A 34 34 THR CA C 34 65.250 66.118 -0.868 1
1 142 . 11 1 1 A 34 34 THR CB C 34 69.920 69.152 0.768 1
1 143 . 11 1 1 A 34 34 THR N N 34 111.180 114.429 -3.249 1
1 144 . 11 1 1 A 35 35 GLU H H 35 8.810 8.583 0.227 1
1 145 . 11 1 1 A 35 35 GLU HA H 35 4.470 4.003 0.467 1
1 146 . 11 1 1 A 35 35 GLU C C 35 175.430 176.212 -0.782 1
1 147 . 11 1 1 A 35 35 GLU CA C 35 56.170 59.238 -3.068 1
1 148 . 11 1 1 A 35 35 GLU CB C 35 30.900 29.789 1.111 1
1 149 . 11 1 1 A 35 35 GLU N N 35 116.410 121.583 -5.173 1
1 150 . 11 1 1 A 36 36 PHE H H 36 8.230 7.991 0.239 1
1 151 . 11 1 1 A 36 36 PHE HA H 36 5.500 5.069 0.431 1
1 152 . 11 1 1 A 36 36 PHE N N 36 115.090 115.805 -0.715 1
1 153 . 11 1 1 A 37 37 PRO C C 37 178.140 177.843 0.297 1
1 154 . 11 1 1 A 37 37 PRO CA C 37 64.940 64.480 0.460 1
1 155 . 11 1 1 A 37 37 PRO CB C 37 31.600 31.877 -0.277 1
1 156 . 11 1 1 A 38 38 SER H H 38 8.660 8.351 0.309 1
1 157 . 11 1 1 A 38 38 SER HA H 38 4.500 4.282 0.218 1
1 158 . 11 1 1 A 38 38 SER C C 38 174.830 177.097 -2.267 1
1 159 . 11 1 1 A 38 38 SER CA C 38 59.970 61.221 -1.251 1
1 160 . 11 1 1 A 38 38 SER CB C 38 62.690 62.745 -0.055 1
1 161 . 11 1 1 A 38 38 SER N N 38 114.030 112.898 1.132 1
1 162 . 11 1 1 A 39 39 LEU H H 39 8.260 8.117 0.143 1
1 163 . 11 1 1 A 39 39 LEU HA H 39 4.520 4.113 0.407 1
1 164 . 11 1 1 A 39 39 LEU C C 39 176.780 180.010 -3.230 1
1 165 . 11 1 1 A 39 39 LEU CA C 39 56.600 57.367 -0.767 1
1 166 . 11 1 1 A 39 39 LEU CB C 39 42.610 41.495 1.115 1
1 167 . 11 1 1 A 39 39 LEU N N 39 122.650 124.120 -1.470 1
1 168 . 11 1 1 A 40 40 LEU H H 40 8.070 7.919 0.151 1
1 169 . 11 1 1 A 40 40 LEU HA H 40 4.830 4.063 0.767 1
1 170 . 11 1 1 A 40 40 LEU C C 40 175.690 179.453 -3.763 1
1 171 . 11 1 1 A 40 40 LEU CA C 40 54.510 57.921 -3.411 1
1 172 . 11 1 1 A 40 40 LEU CB C 40 42.020 41.072 0.948 1
1 173 . 11 1 1 A 40 40 LEU N N 40 117.390 119.449 -2.059 1
1 174 . 11 1 1 A 41 41 LYS H H 41 7.770 8.072 -0.302 1
1 175 . 11 1 1 A 41 41 LYS HA H 41 4.610 4.116 0.494 1
1 176 . 11 1 1 A 41 41 LYS C C 41 175.380 177.488 -2.108 1
1 177 . 11 1 1 A 41 41 LYS CA C 41 56.170 58.748 -2.578 1
1 178 . 11 1 1 A 41 41 LYS CB C 41 32.950 31.611 1.339 1
1 179 . 11 1 1 A 41 41 LYS N N 41 120.530 117.881 2.649 1
1 180 . 11 1 1 A 42 42 GLY H H 42 8.390 7.888 0.502 1
1 181 . 11 1 1 A 42 42 GLY HA2 H 42 4.280 4.055 0.225 1
1 182 . 11 1 1 A 42 42 GLY HA3 H 42 4.280 4.056 0.224 1
1 183 . 11 1 1 A 42 42 GLY C C 42 177.190 174.859 2.331 1
1 184 . 11 1 1 A 42 42 GLY N N 42 109.280 108.301 0.979 1
1 185 . 11 1 1 A 43 43 MET H H 43 9.020 8.568 0.452 1
1 186 . 11 1 1 A 43 43 MET C C 43 175.520 176.673 -1.153 1
1 187 . 11 1 1 A 43 43 MET N N 43 121.110 119.012 2.098 1
1 188 . 11 1 1 A 44 44 SER H H 44 8.700 7.916 0.784 1
1 189 . 11 1 1 A 44 44 SER C C 44 173.540 173.472 0.068 1
1 190 . 11 1 1 A 44 44 SER N N 44 116.190 115.011 1.179 1
1 191 . 11 1 1 A 45 45 THR H H 45 8.440 8.719 -0.279 1
1 192 . 11 1 1 A 45 45 THR C C 45 174.300 175.213 -0.913 1
1 193 . 11 1 1 A 45 45 THR N N 45 113.740 118.547 -4.807 1
1 194 . 11 1 1 A 46 46 LEU H H 46 9.380 8.807 0.573 1
1 195 . 11 1 1 A 46 46 LEU C C 46 177.760 178.038 -0.278 1
1 196 . 11 1 1 A 46 46 LEU N N 46 123.970 123.386 0.584 1
1 197 . 11 1 1 A 47 47 ASP H H 47 8.990 8.378 0.612 1
1 198 . 11 1 1 A 47 47 ASP N N 47 118.620 118.021 0.599 1
1 199 . 11 1 1 A 49 49 LEU H H 49 9.740 9.246 0.494 1
1 200 . 11 1 1 A 49 49 LEU N N 49 123.880 121.006 2.874 1
1 201 . 11 1 1 A 50 50 PHE H H 50 10.730 9.255 1.475 1
1 202 . 11 1 1 A 50 50 PHE N N 50 121.380 119.575 1.805 1
1 203 . 11 1 1 A 51 51 GLU H H 51 7.860 8.471 -0.611 1
1 204 . 11 1 1 A 51 51 GLU HA H 51 3.530 3.918 -0.388 1
1 205 . 11 1 1 A 51 51 GLU N N 51 114.870 118.991 -4.121 1
1 206 . 11 1 1 A 66 66 PHE CA C 66 58.850 61.289 -2.439 1
1 207 . 11 1 1 A 67 67 GLN H H 67 5.670 8.714 -3.044 1
1 208 . 11 1 1 A 67 67 GLN C C 67 174.810 178.169 -3.359 1
1 209 . 11 1 1 A 67 67 GLN CA C 67 56.340 58.239 -1.899 1
1 210 . 11 1 1 A 67 67 GLN N N 67 114.050 117.640 -3.590 1
1 211 . 11 1 1 A 68 68 VAL H H 68 5.760 7.513 -1.753 1
1 212 . 11 1 1 A 68 68 VAL C C 68 175.770 178.475 -2.705 1
1 213 . 11 1 1 A 68 68 VAL CA C 68 63.990 65.824 -1.834 1
1 214 . 11 1 1 A 68 68 VAL CB C 68 31.310 31.559 -0.249 1
1 215 . 11 1 1 A 68 68 VAL N N 68 116.280 119.876 -3.596 1
1 216 . 11 1 1 A 69 69 LEU H H 69 7.150 8.237 -1.087 1
1 217 . 11 1 1 A 69 69 LEU HA H 69 4.040 4.063 -0.023 1
1 218 . 11 1 1 A 69 69 LEU C C 69 176.210 178.294 -2.084 1
1 219 . 11 1 1 A 69 69 LEU CA C 69 56.270 57.397 -1.127 1
1 220 . 11 1 1 A 69 69 LEU CB C 69 42.010 42.061 -0.051 1
1 221 . 11 1 1 A 69 69 LEU N N 69 120.350 121.644 -1.294 1
1 222 . 11 1 1 A 70 70 VAL H H 70 6.810 7.482 -0.672 1
1 223 . 11 1 1 A 70 70 VAL HA H 70 3.170 3.245 -0.075 1
1 224 . 11 1 1 A 70 70 VAL C C 70 175.760 177.722 -1.962 1
1 225 . 11 1 1 A 70 70 VAL CA C 70 65.110 66.707 -1.597 1
1 226 . 11 1 1 A 70 70 VAL CB C 70 31.190 30.952 0.238 1
1 227 . 11 1 1 A 70 70 VAL N N 70 115.790 118.804 -3.014 1
1 228 . 11 1 1 A 71 71 LYS H H 71 7.190 8.386 -1.196 1
1 229 . 11 1 1 A 71 71 LYS HA H 71 3.880 3.927 -0.047 1
1 230 . 11 1 1 A 71 71 LYS C C 71 176.100 179.466 -3.366 1
1 231 . 11 1 1 A 71 71 LYS CA C 71 57.680 59.310 -1.630 1
1 232 . 11 1 1 A 71 71 LYS CB C 71 31.930 32.147 -0.217 1
1 233 . 11 1 1 A 71 71 LYS N N 71 117.820 119.778 -1.958 1
1 234 . 11 1 1 A 72 72 LYS H H 72 7.450 7.235 0.215 1
1 235 . 11 1 1 A 72 72 LYS HA H 72 4.180 4.066 0.114 1
1 236 . 11 1 1 A 72 72 LYS C C 72 176.180 179.224 -3.044 1
1 237 . 11 1 1 A 72 72 LYS CA C 72 56.950 58.245 -1.295 1
1 238 . 11 1 1 A 72 72 LYS CB C 72 33.610 31.912 1.698 1
1 239 . 11 1 1 A 72 72 LYS N N 72 116.930 118.258 -1.328 1
1 240 . 11 1 1 A 73 73 ILE H H 73 7.440 7.846 -0.406 1
1 241 . 11 1 1 A 73 73 ILE HA H 73 4.180 3.439 0.741 1
1 242 . 11 1 1 A 73 73 ILE C C 73 174.440 177.660 -3.220 1
1 243 . 11 1 1 A 73 73 ILE CA C 73 61.510 64.556 -3.046 1
1 244 . 11 1 1 A 73 73 ILE CB C 73 38.610 37.480 1.130 1
1 245 . 11 1 1 A 73 73 ILE N N 73 114.560 121.499 -6.939 1
1 246 . 11 1 1 A 74 74 SER H H 74 7.790 8.944 -1.154 1
1 247 . 11 1 1 A 74 74 SER HA H 74 4.520 4.166 0.354 1
1 248 . 11 1 1 A 74 74 SER C C 74 171.580 176.430 -4.850 1
1 249 . 11 1 1 A 74 74 SER CA C 74 57.960 61.520 -3.560 1
1 250 . 11 1 1 A 74 74 SER CB C 74 63.820 63.061 0.759 1
1 251 . 11 1 1 A 74 74 SER N N 74 117.310 116.553 0.757 1
1 6 . 12 1 1 A 2 2 SER H H 2 9.010 8.181 0.829 1
1 7 . 12 1 1 A 2 2 SER HA H 2 4.680 4.548 0.132 1
1 8 . 12 1 1 A 2 2 SER N N 2 119.390 115.102 4.288 1
1 9 . 12 1 1 A 3 3 PRO C C 3 177.630 178.646 -1.016 1
1 10 . 12 1 1 A 3 3 PRO CA C 3 65.000 65.010 -0.010 1
1 11 . 12 1 1 A 3 3 PRO CB C 3 31.790 32.078 -0.288 1
1 12 . 12 1 1 A 4 4 GLU H H 4 8.600 8.397 0.203 1
1 13 . 12 1 1 A 4 4 GLU HA H 4 3.900 4.108 -0.208 1
1 14 . 12 1 1 A 4 4 GLU C C 4 177.910 179.249 -1.339 1
1 15 . 12 1 1 A 4 4 GLU CB C 4 28.980 29.220 -0.240 1
1 16 . 12 1 1 A 4 4 GLU N N 4 117.750 117.660 0.090 1
1 17 . 12 1 1 A 5 5 GLU H H 5 7.980 8.119 -0.139 1
1 18 . 12 1 1 A 5 5 GLU HA H 5 4.170 4.046 0.124 1
1 19 . 12 1 1 A 5 5 GLU C C 5 178.290 179.221 -0.931 1
1 20 . 12 1 1 A 5 5 GLU CA C 5 58.140 59.132 -0.992 1
1 21 . 12 1 1 A 5 5 GLU CB C 5 30.450 29.362 1.088 1
1 22 . 12 1 1 A 5 5 GLU N N 5 121.890 120.395 1.495 1
1 23 . 12 1 1 A 6 6 LEU H H 6 8.450 8.162 0.288 1
1 24 . 12 1 1 A 6 6 LEU HA H 6 4.310 4.016 0.294 1
1 25 . 12 1 1 A 6 6 LEU C C 6 176.660 178.863 -2.203 1
1 26 . 12 1 1 A 6 6 LEU CA C 6 57.310 57.789 -0.479 1
1 27 . 12 1 1 A 6 6 LEU CB C 6 42.090 41.748 0.342 1
1 28 . 12 1 1 A 6 6 LEU N N 6 120.250 120.710 -0.460 1
1 29 . 12 1 1 A 7 7 LYS H H 7 8.100 9.038 -0.938 1
1 30 . 12 1 1 A 7 7 LYS HA H 7 3.760 4.117 -0.357 1
1 31 . 12 1 1 A 7 7 LYS C C 7 176.160 179.475 -3.315 1
1 32 . 12 1 1 A 7 7 LYS CA C 7 59.110 59.890 -0.780 1
1 33 . 12 1 1 A 7 7 LYS CB C 7 32.110 32.467 -0.357 1
1 34 . 12 1 1 A 7 7 LYS N N 7 120.960 118.806 2.154 1
1 35 . 12 1 1 A 8 8 GLY H H 8 7.860 8.998 -1.138 1
1 36 . 12 1 1 A 8 8 GLY HA2 H 8 3.970 3.844 0.126 1
1 37 . 12 1 1 A 8 8 GLY HA3 H 8 3.970 3.878 0.092 1
1 38 . 12 1 1 A 8 8 GLY C C 8 175.520 176.216 -0.696 1
1 39 . 12 1 1 A 8 8 GLY CA C 8 46.490 47.487 -0.997 1
1 40 . 12 1 1 A 8 8 GLY N N 8 105.430 107.323 -1.893 1
1 41 . 12 1 1 A 9 9 ILE H H 9 8.130 9.524 -1.394 1
1 42 . 12 1 1 A 9 9 ILE HA H 9 4.140 3.923 0.217 1
1 43 . 12 1 1 A 9 9 ILE C C 9 175.320 178.025 -2.705 1
1 44 . 12 1 1 A 9 9 ILE CA C 9 65.010 64.749 0.261 1
1 45 . 12 1 1 A 9 9 ILE CB C 9 39.040 37.945 1.095 1
1 46 . 12 1 1 A 9 9 ILE N N 9 122.870 122.668 0.202 1
1 47 . 12 1 1 A 10 10 PHE H H 10 8.590 9.301 -0.711 1
1 48 . 12 1 1 A 10 10 PHE HA H 10 4.470 3.895 0.575 1
1 49 . 12 1 1 A 10 10 PHE C C 10 175.010 177.110 -2.100 1
1 50 . 12 1 1 A 10 10 PHE CA C 10 62.470 62.410 0.060 1
1 51 . 12 1 1 A 10 10 PHE CB C 10 39.670 39.123 0.547 1
1 52 . 12 1 1 A 10 10 PHE N N 10 120.430 120.470 -0.040 1
1 53 . 12 1 1 A 11 11 GLU H H 11 8.600 8.740 -0.140 1
1 54 . 12 1 1 A 11 11 GLU HA H 11 3.750 3.839 -0.089 1
1 55 . 12 1 1 A 11 11 GLU C C 11 177.630 178.895 -1.265 1
1 56 . 12 1 1 A 11 11 GLU CA C 11 58.440 59.859 -1.419 1
1 57 . 12 1 1 A 11 11 GLU CB C 11 29.840 29.421 0.419 1
1 58 . 12 1 1 A 11 11 GLU N N 11 115.410 118.213 -2.803 1
1 59 . 12 1 1 A 12 12 LYS H H 12 7.940 8.736 -0.796 1
1 60 . 12 1 1 A 12 12 LYS HA H 12 4.080 3.994 0.086 1
1 61 . 12 1 1 A 12 12 LYS CA C 12 58.440 59.098 -0.658 1
1 62 . 12 1 1 A 12 12 LYS CB C 12 32.720 32.281 0.439 1
1 63 . 12 1 1 A 12 12 LYS N N 12 119.220 120.309 -1.089 1
1 64 . 12 1 1 A 13 13 TYR H H 13 7.740 7.372 0.368 1
1 65 . 12 1 1 A 13 13 TYR HA H 13 4.580 4.336 0.244 1
1 66 . 12 1 1 A 13 13 TYR C C 13 39.870 178.316 -138.446 1
1 67 . 12 1 1 A 13 13 TYR CA C 13 61.280 60.285 0.995 1
1 68 . 12 1 1 A 13 13 TYR CB C 13 175.510 39.258 136.252 1
1 69 . 12 1 1 A 13 13 TYR N N 13 115.320 117.172 -1.852 1
1 70 . 12 1 1 A 14 14 ALA H H 14 9.060 8.886 0.174 1
1 71 . 12 1 1 A 14 14 ALA HA H 14 3.850 3.783 0.067 1
1 72 . 12 1 1 A 14 14 ALA C C 14 177.990 179.964 -1.974 1
1 73 . 12 1 1 A 14 14 ALA CA C 14 54.280 54.725 -0.445 1
1 74 . 12 1 1 A 14 14 ALA CB C 14 18.790 17.666 1.124 1
1 75 . 12 1 1 A 14 14 ALA N N 14 120.140 122.626 -2.486 1
1 76 . 12 1 1 A 15 15 ALA H H 15 7.350 8.683 -1.333 1
1 77 . 12 1 1 A 15 15 ALA HA H 15 4.550 4.015 0.535 1
1 78 . 12 1 1 A 15 15 ALA C C 15 176.270 179.173 -2.903 1
1 79 . 12 1 1 A 15 15 ALA CA C 15 52.280 54.982 -2.702 1
1 80 . 12 1 1 A 15 15 ALA CB C 15 19.670 18.374 1.296 1
1 81 . 12 1 1 A 15 15 ALA N N 15 117.640 120.013 -2.373 1
1 82 . 12 1 1 A 16 16 LYS H H 16 7.690 8.049 -0.359 1
1 83 . 12 1 1 A 16 16 LYS HA H 16 4.200 4.002 0.198 1
1 84 . 12 1 1 A 16 16 LYS C C 16 175.830 177.087 -1.257 1
1 85 . 12 1 1 A 16 16 LYS CA C 16 59.780 59.722 0.058 1
1 86 . 12 1 1 A 16 16 LYS CB C 16 33.300 32.322 0.978 1
1 87 . 12 1 1 A 16 16 LYS N N 16 120.340 117.164 3.176 1
1 88 . 12 1 1 A 17 17 GLU H H 17 10.170 8.341 1.829 1
1 89 . 12 1 1 A 17 17 GLU HA H 17 4.990 4.472 0.518 1
1 90 . 12 1 1 A 17 17 GLU C C 17 174.790 176.943 -2.153 1
1 91 . 12 1 1 A 17 17 GLU CA C 17 53.910 55.314 -1.404 1
1 92 . 12 1 1 A 17 17 GLU N N 17 116.560 118.265 -1.705 1
1 93 . 12 1 1 A 18 18 GLY H H 18 9.100 8.536 0.564 1
1 94 . 12 1 1 A 18 18 GLY N N 18 113.230 111.285 1.945 1
1 95 . 12 1 1 A 19 19 ASP H H 19 7.730 8.626 -0.896 1
1 96 . 12 1 1 A 19 19 ASP N N 19 126.280 121.329 4.951 1
1 97 . 12 1 1 A 21 21 ASN H H 21 9.090 8.237 0.853 1
1 98 . 12 1 1 A 21 21 ASN N N 21 115.850 115.273 0.577 1
1 99 . 12 1 1 A 24 24 SER C C 24 176.120 174.543 1.577 1
1 100 . 12 1 1 A 25 25 LYS H H 25 10.400 8.594 1.806 1
1 101 . 12 1 1 A 25 25 LYS C C 25 177.600 177.866 -0.266 1
1 102 . 12 1 1 A 25 25 LYS N N 25 124.350 125.001 -0.651 1
1 103 . 12 1 1 A 26 26 GLU H H 26 9.250 8.361 0.889 1
1 104 . 12 1 1 A 26 26 GLU N N 26 118.470 117.661 0.809 1
1 105 . 12 1 1 A 27 27 GLU C C 27 178.580 178.630 -0.050 1
1 106 . 12 1 1 A 27 27 GLU CA C 27 59.920 58.997 0.923 1
1 107 . 12 1 1 A 28 28 LEU H H 28 10.810 9.236 1.574 1
1 108 . 12 1 1 A 28 28 LEU C C 28 177.280 178.406 -1.126 1
1 109 . 12 1 1 A 28 28 LEU CB C 28 43.570 41.702 1.868 1
1 110 . 12 1 1 A 28 28 LEU N N 28 121.060 121.802 -0.742 1
1 111 . 12 1 1 A 29 29 LYS H H 29 9.680 8.463 1.217 1
1 112 . 12 1 1 A 29 29 LYS HA H 29 4.480 3.947 0.533 1
1 113 . 12 1 1 A 29 29 LYS C C 29 176.670 178.667 -1.997 1
1 114 . 12 1 1 A 29 29 LYS CA C 29 60.770 60.006 0.764 1
1 115 . 12 1 1 A 29 29 LYS CB C 29 32.910 32.548 0.362 1
1 116 . 12 1 1 A 29 29 LYS N N 29 121.140 119.127 2.013 1
1 117 . 12 1 1 A 30 30 LEU H H 30 8.410 7.832 0.578 1
1 118 . 12 1 1 A 30 30 LEU CA C 30 57.730 57.861 -0.131 1
1 119 . 12 1 1 A 30 30 LEU CB C 30 42.570 41.980 0.590 1
1 120 . 12 1 1 A 30 30 LEU N N 30 119.000 119.554 -0.554 1
1 121 . 12 1 1 A 31 31 LEU H H 31 9.010 7.806 1.204 1
1 122 . 12 1 1 A 31 31 LEU HA H 31 2.920 3.407 -0.487 1
1 123 . 12 1 1 A 31 31 LEU C C 31 178.280 178.127 0.153 1
1 124 . 12 1 1 A 31 31 LEU CA C 31 59.030 58.312 0.718 1
1 125 . 12 1 1 A 31 31 LEU N N 31 124.840 119.619 5.221 1
1 126 . 12 1 1 A 32 32 LEU H H 32 9.680 9.035 0.645 1
1 127 . 12 1 1 A 32 32 LEU HA H 32 4.490 4.024 0.466 1
1 128 . 12 1 1 A 32 32 LEU C C 32 177.360 179.723 -2.363 1
1 129 . 12 1 1 A 32 32 LEU CA C 32 58.520 57.221 1.299 1
1 130 . 12 1 1 A 32 32 LEU CB C 32 42.760 41.492 1.268 1
1 131 . 12 1 1 A 32 32 LEU N N 32 120.580 119.008 1.572 1
1 132 . 12 1 1 A 33 33 GLN H H 33 9.140 8.119 1.021 1
1 133 . 12 1 1 A 33 33 GLN HA H 33 4.250 4.120 0.130 1
1 134 . 12 1 1 A 33 33 GLN C C 33 176.050 178.128 -2.078 1
1 135 . 12 1 1 A 33 33 GLN CA C 33 58.600 58.768 -0.168 1
1 136 . 12 1 1 A 33 33 GLN CB C 33 29.730 28.538 1.192 1
1 137 . 12 1 1 A 33 33 GLN N N 33 115.010 119.703 -4.693 1
1 138 . 12 1 1 A 34 34 THR H H 34 8.000 7.869 0.131 1
1 139 . 12 1 1 A 34 34 THR HA H 34 4.390 4.045 0.345 1
1 140 . 12 1 1 A 34 34 THR C C 34 174.130 175.937 -1.807 1
1 141 . 12 1 1 A 34 34 THR CA C 34 65.250 66.118 -0.868 1
1 142 . 12 1 1 A 34 34 THR CB C 34 69.920 69.152 0.768 1
1 143 . 12 1 1 A 34 34 THR N N 34 111.180 114.429 -3.249 1
1 144 . 12 1 1 A 35 35 GLU H H 35 8.810 8.583 0.227 1
1 145 . 12 1 1 A 35 35 GLU HA H 35 4.470 4.003 0.467 1
1 146 . 12 1 1 A 35 35 GLU C C 35 175.430 176.212 -0.782 1
1 147 . 12 1 1 A 35 35 GLU CA C 35 56.170 59.238 -3.068 1
1 148 . 12 1 1 A 35 35 GLU CB C 35 30.900 29.789 1.111 1
1 149 . 12 1 1 A 35 35 GLU N N 35 116.410 121.583 -5.173 1
1 150 . 12 1 1 A 36 36 PHE H H 36 8.230 7.991 0.239 1
1 151 . 12 1 1 A 36 36 PHE HA H 36 5.500 5.069 0.431 1
1 152 . 12 1 1 A 36 36 PHE N N 36 115.090 115.805 -0.715 1
1 153 . 12 1 1 A 37 37 PRO C C 37 178.140 177.843 0.297 1
1 154 . 12 1 1 A 37 37 PRO CA C 37 64.940 64.480 0.460 1
1 155 . 12 1 1 A 37 37 PRO CB C 37 31.600 31.877 -0.277 1
1 156 . 12 1 1 A 38 38 SER H H 38 8.660 8.351 0.309 1
1 157 . 12 1 1 A 38 38 SER HA H 38 4.500 4.282 0.218 1
1 158 . 12 1 1 A 38 38 SER C C 38 174.830 177.097 -2.267 1
1 159 . 12 1 1 A 38 38 SER CA C 38 59.970 61.221 -1.251 1
1 160 . 12 1 1 A 38 38 SER CB C 38 62.690 62.745 -0.055 1
1 161 . 12 1 1 A 38 38 SER N N 38 114.030 112.898 1.132 1
1 162 . 12 1 1 A 39 39 LEU H H 39 8.260 8.117 0.143 1
1 163 . 12 1 1 A 39 39 LEU HA H 39 4.520 4.113 0.407 1
1 164 . 12 1 1 A 39 39 LEU C C 39 176.780 180.010 -3.230 1
1 165 . 12 1 1 A 39 39 LEU CA C 39 56.600 57.367 -0.767 1
1 166 . 12 1 1 A 39 39 LEU CB C 39 42.610 41.495 1.115 1
1 167 . 12 1 1 A 39 39 LEU N N 39 122.650 124.120 -1.470 1
1 168 . 12 1 1 A 40 40 LEU H H 40 8.070 7.919 0.151 1
1 169 . 12 1 1 A 40 40 LEU HA H 40 4.830 4.063 0.767 1
1 170 . 12 1 1 A 40 40 LEU C C 40 175.690 179.453 -3.763 1
1 171 . 12 1 1 A 40 40 LEU CA C 40 54.510 57.921 -3.411 1
1 172 . 12 1 1 A 40 40 LEU CB C 40 42.020 41.072 0.948 1
1 173 . 12 1 1 A 40 40 LEU N N 40 117.390 119.449 -2.059 1
1 174 . 12 1 1 A 41 41 LYS H H 41 7.770 8.072 -0.302 1
1 175 . 12 1 1 A 41 41 LYS HA H 41 4.610 4.116 0.494 1
1 176 . 12 1 1 A 41 41 LYS C C 41 175.380 177.488 -2.108 1
1 177 . 12 1 1 A 41 41 LYS CA C 41 56.170 58.748 -2.578 1
1 178 . 12 1 1 A 41 41 LYS CB C 41 32.950 31.611 1.339 1
1 179 . 12 1 1 A 41 41 LYS N N 41 120.530 117.881 2.649 1
1 180 . 12 1 1 A 42 42 GLY H H 42 8.390 7.888 0.502 1
1 181 . 12 1 1 A 42 42 GLY HA2 H 42 4.280 4.055 0.225 1
1 182 . 12 1 1 A 42 42 GLY HA3 H 42 4.280 4.056 0.224 1
1 183 . 12 1 1 A 42 42 GLY C C 42 177.190 174.859 2.331 1
1 184 . 12 1 1 A 42 42 GLY N N 42 109.280 108.301 0.979 1
1 185 . 12 1 1 A 43 43 MET H H 43 9.020 8.568 0.452 1
1 186 . 12 1 1 A 43 43 MET C C 43 175.520 176.673 -1.153 1
1 187 . 12 1 1 A 43 43 MET N N 43 121.110 119.012 2.098 1
1 188 . 12 1 1 A 44 44 SER H H 44 8.700 7.916 0.784 1
1 189 . 12 1 1 A 44 44 SER C C 44 173.540 173.472 0.068 1
1 190 . 12 1 1 A 44 44 SER N N 44 116.190 115.011 1.179 1
1 191 . 12 1 1 A 45 45 THR H H 45 8.440 8.719 -0.279 1
1 192 . 12 1 1 A 45 45 THR C C 45 174.300 175.213 -0.913 1
1 193 . 12 1 1 A 45 45 THR N N 45 113.740 118.547 -4.807 1
1 194 . 12 1 1 A 46 46 LEU H H 46 9.380 8.807 0.573 1
1 195 . 12 1 1 A 46 46 LEU C C 46 177.760 178.038 -0.278 1
1 196 . 12 1 1 A 46 46 LEU N N 46 123.970 123.386 0.584 1
1 197 . 12 1 1 A 47 47 ASP H H 47 8.990 8.378 0.612 1
1 198 . 12 1 1 A 47 47 ASP N N 47 118.620 118.021 0.599 1
1 199 . 12 1 1 A 49 49 LEU H H 49 9.740 9.246 0.494 1
1 200 . 12 1 1 A 49 49 LEU N N 49 123.880 121.006 2.874 1
1 201 . 12 1 1 A 50 50 PHE H H 50 10.730 9.255 1.475 1
1 202 . 12 1 1 A 50 50 PHE N N 50 121.380 119.575 1.805 1
1 203 . 12 1 1 A 51 51 GLU H H 51 7.860 8.471 -0.611 1
1 204 . 12 1 1 A 51 51 GLU HA H 51 3.530 3.918 -0.388 1
1 205 . 12 1 1 A 51 51 GLU N N 51 114.870 118.991 -4.121 1
1 206 . 12 1 1 A 66 66 PHE CA C 66 58.850 61.289 -2.439 1
1 207 . 12 1 1 A 67 67 GLN H H 67 5.670 8.714 -3.044 1
1 208 . 12 1 1 A 67 67 GLN C C 67 174.810 178.169 -3.359 1
1 209 . 12 1 1 A 67 67 GLN CA C 67 56.340 58.239 -1.899 1
1 210 . 12 1 1 A 67 67 GLN N N 67 114.050 117.640 -3.590 1
1 211 . 12 1 1 A 68 68 VAL H H 68 5.760 7.513 -1.753 1
1 212 . 12 1 1 A 68 68 VAL C C 68 175.770 178.475 -2.705 1
1 213 . 12 1 1 A 68 68 VAL CA C 68 63.990 65.824 -1.834 1
1 214 . 12 1 1 A 68 68 VAL CB C 68 31.310 31.559 -0.249 1
1 215 . 12 1 1 A 68 68 VAL N N 68 116.280 119.876 -3.596 1
1 216 . 12 1 1 A 69 69 LEU H H 69 7.150 8.237 -1.087 1
1 217 . 12 1 1 A 69 69 LEU HA H 69 4.040 4.063 -0.023 1
1 218 . 12 1 1 A 69 69 LEU C C 69 176.210 178.294 -2.084 1
1 219 . 12 1 1 A 69 69 LEU CA C 69 56.270 57.397 -1.127 1
1 220 . 12 1 1 A 69 69 LEU CB C 69 42.010 42.061 -0.051 1
1 221 . 12 1 1 A 69 69 LEU N N 69 120.350 121.644 -1.294 1
1 222 . 12 1 1 A 70 70 VAL H H 70 6.810 7.482 -0.672 1
1 223 . 12 1 1 A 70 70 VAL HA H 70 3.170 3.245 -0.075 1
1 224 . 12 1 1 A 70 70 VAL C C 70 175.760 177.722 -1.962 1
1 225 . 12 1 1 A 70 70 VAL CA C 70 65.110 66.707 -1.597 1
1 226 . 12 1 1 A 70 70 VAL CB C 70 31.190 30.952 0.238 1
1 227 . 12 1 1 A 70 70 VAL N N 70 115.790 118.804 -3.014 1
1 228 . 12 1 1 A 71 71 LYS H H 71 7.190 8.386 -1.196 1
1 229 . 12 1 1 A 71 71 LYS HA H 71 3.880 3.927 -0.047 1
1 230 . 12 1 1 A 71 71 LYS C C 71 176.100 179.466 -3.366 1
1 231 . 12 1 1 A 71 71 LYS CA C 71 57.680 59.310 -1.630 1
1 232 . 12 1 1 A 71 71 LYS CB C 71 31.930 32.147 -0.217 1
1 233 . 12 1 1 A 71 71 LYS N N 71 117.820 119.778 -1.958 1
1 234 . 12 1 1 A 72 72 LYS H H 72 7.450 7.235 0.215 1
1 235 . 12 1 1 A 72 72 LYS HA H 72 4.180 4.066 0.114 1
1 236 . 12 1 1 A 72 72 LYS C C 72 176.180 179.224 -3.044 1
1 237 . 12 1 1 A 72 72 LYS CA C 72 56.950 58.245 -1.295 1
1 238 . 12 1 1 A 72 72 LYS CB C 72 33.610 31.912 1.698 1
1 239 . 12 1 1 A 72 72 LYS N N 72 116.930 118.258 -1.328 1
1 240 . 12 1 1 A 73 73 ILE H H 73 7.440 7.846 -0.406 1
1 241 . 12 1 1 A 73 73 ILE HA H 73 4.180 3.439 0.741 1
1 242 . 12 1 1 A 73 73 ILE C C 73 174.440 177.660 -3.220 1
1 243 . 12 1 1 A 73 73 ILE CA C 73 61.510 64.556 -3.046 1
1 244 . 12 1 1 A 73 73 ILE CB C 73 38.610 37.480 1.130 1
1 245 . 12 1 1 A 73 73 ILE N N 73 114.560 121.499 -6.939 1
1 246 . 12 1 1 A 74 74 SER H H 74 7.790 8.944 -1.154 1
1 247 . 12 1 1 A 74 74 SER HA H 74 4.520 4.166 0.354 1
1 248 . 12 1 1 A 74 74 SER C C 74 171.580 176.430 -4.850 1
1 249 . 12 1 1 A 74 74 SER CA C 74 57.960 61.520 -3.560 1
1 250 . 12 1 1 A 74 74 SER CB C 74 63.820 63.061 0.759 1
1 251 . 12 1 1 A 74 74 SER N N 74 117.310 116.553 0.757 1
1 6 . 13 1 1 A 2 2 SER H H 2 9.010 8.009 1.001 1
1 7 . 13 1 1 A 2 2 SER HA H 2 4.680 4.537 0.143 1
1 8 . 13 1 1 A 2 2 SER N N 2 119.390 115.082 4.308 1
1 9 . 13 1 1 A 3 3 PRO C C 3 177.630 178.857 -1.227 1
1 10 . 13 1 1 A 3 3 PRO CA C 3 65.000 64.957 0.043 1
1 11 . 13 1 1 A 3 3 PRO CB C 3 31.790 32.148 -0.358 1
1 12 . 13 1 1 A 4 4 GLU H H 4 8.600 8.393 0.207 1
1 13 . 13 1 1 A 4 4 GLU HA H 4 3.900 4.095 -0.195 1
1 14 . 13 1 1 A 4 4 GLU C C 4 177.910 179.453 -1.543 1
1 15 . 13 1 1 A 4 4 GLU CB C 4 28.980 29.209 -0.229 1
1 16 . 13 1 1 A 4 4 GLU N N 4 117.750 117.687 0.063 1
1 17 . 13 1 1 A 5 5 GLU H H 5 7.980 8.089 -0.109 1
1 18 . 13 1 1 A 5 5 GLU HA H 5 4.170 4.090 0.080 1
1 19 . 13 1 1 A 5 5 GLU C C 5 178.290 179.281 -0.991 1
1 20 . 13 1 1 A 5 5 GLU CA C 5 58.140 59.204 -1.064 1
1 21 . 13 1 1 A 5 5 GLU CB C 5 30.450 29.309 1.141 1
1 22 . 13 1 1 A 5 5 GLU N N 5 121.890 120.184 1.706 1
1 23 . 13 1 1 A 6 6 LEU H H 6 8.450 8.109 0.341 1
1 24 . 13 1 1 A 6 6 LEU HA H 6 4.310 3.977 0.333 1
1 25 . 13 1 1 A 6 6 LEU C C 6 176.660 178.557 -1.897 1
1 26 . 13 1 1 A 6 6 LEU CA C 6 57.310 57.837 -0.527 1
1 27 . 13 1 1 A 6 6 LEU CB C 6 42.090 41.612 0.478 1
1 28 . 13 1 1 A 6 6 LEU N N 6 120.250 120.617 -0.367 1
1 29 . 13 1 1 A 7 7 LYS H H 7 8.100 8.671 -0.571 1
1 30 . 13 1 1 A 7 7 LYS HA H 7 3.760 4.120 -0.360 1
1 31 . 13 1 1 A 7 7 LYS C C 7 176.160 179.644 -3.484 1
1 32 . 13 1 1 A 7 7 LYS CA C 7 59.110 59.855 -0.745 1
1 33 . 13 1 1 A 7 7 LYS CB C 7 32.110 32.382 -0.272 1
1 34 . 13 1 1 A 7 7 LYS N N 7 120.960 118.275 2.685 1
1 35 . 13 1 1 A 8 8 GLY H H 8 7.860 8.347 -0.487 1
1 36 . 13 1 1 A 8 8 GLY HA2 H 8 3.970 3.719 0.251 1
1 37 . 13 1 1 A 8 8 GLY HA3 H 8 3.970 3.721 0.249 1
1 38 . 13 1 1 A 8 8 GLY C C 8 175.520 176.276 -0.756 1
1 39 . 13 1 1 A 8 8 GLY CA C 8 46.490 47.366 -0.876 1
1 40 . 13 1 1 A 8 8 GLY N N 8 105.430 106.991 -1.561 1
1 41 . 13 1 1 A 9 9 ILE H H 9 8.130 9.250 -1.120 1
1 42 . 13 1 1 A 9 9 ILE HA H 9 4.140 3.895 0.245 1
1 43 . 13 1 1 A 9 9 ILE C C 9 175.320 177.922 -2.602 1
1 44 . 13 1 1 A 9 9 ILE CA C 9 65.010 64.545 0.465 1
1 45 . 13 1 1 A 9 9 ILE CB C 9 39.040 37.896 1.144 1
1 46 . 13 1 1 A 9 9 ILE N N 9 122.870 122.615 0.255 1
1 47 . 13 1 1 A 10 10 PHE H H 10 8.590 8.679 -0.089 1
1 48 . 13 1 1 A 10 10 PHE HA H 10 4.470 3.818 0.652 1
1 49 . 13 1 1 A 10 10 PHE C C 10 175.010 177.098 -2.088 1
1 50 . 13 1 1 A 10 10 PHE CA C 10 62.470 62.397 0.073 1
1 51 . 13 1 1 A 10 10 PHE CB C 10 39.670 39.149 0.521 1
1 52 . 13 1 1 A 10 10 PHE N N 10 120.430 120.463 -0.033 1
1 53 . 13 1 1 A 11 11 GLU H H 11 8.600 8.106 0.494 1
1 54 . 13 1 1 A 11 11 GLU HA H 11 3.750 3.675 0.075 1
1 55 . 13 1 1 A 11 11 GLU C C 11 177.630 178.899 -1.269 1
1 56 . 13 1 1 A 11 11 GLU CA C 11 58.440 59.748 -1.308 1
1 57 . 13 1 1 A 11 11 GLU CB C 11 29.840 29.182 0.658 1
1 58 . 13 1 1 A 11 11 GLU N N 11 115.410 118.621 -3.211 1
1 59 . 13 1 1 A 12 12 LYS H H 12 7.940 8.782 -0.842 1
1 60 . 13 1 1 A 12 12 LYS HA H 12 4.080 4.035 0.045 1
1 61 . 13 1 1 A 12 12 LYS CA C 12 58.440 59.030 -0.590 1
1 62 . 13 1 1 A 12 12 LYS CB C 12 32.720 32.394 0.326 1
1 63 . 13 1 1 A 12 12 LYS N N 12 119.220 120.277 -1.057 1
1 64 . 13 1 1 A 13 13 TYR H H 13 7.740 7.452 0.288 1
1 65 . 13 1 1 A 13 13 TYR HA H 13 4.580 4.361 0.219 1
1 66 . 13 1 1 A 13 13 TYR C C 13 39.870 178.289 -138.419 1
1 67 . 13 1 1 A 13 13 TYR CA C 13 61.280 60.259 1.021 1
1 68 . 13 1 1 A 13 13 TYR CB C 13 175.510 39.274 136.236 1
1 69 . 13 1 1 A 13 13 TYR N N 13 115.320 117.422 -2.102 1
1 70 . 13 1 1 A 14 14 ALA H H 14 9.060 8.638 0.422 1
1 71 . 13 1 1 A 14 14 ALA HA H 14 3.850 3.757 0.093 1
1 72 . 13 1 1 A 14 14 ALA C C 14 177.990 179.739 -1.749 1
1 73 . 13 1 1 A 14 14 ALA CA C 14 54.280 54.844 -0.564 1
1 74 . 13 1 1 A 14 14 ALA CB C 14 18.790 17.644 1.146 1
1 75 . 13 1 1 A 14 14 ALA N N 14 120.140 122.641 -2.501 1
1 76 . 13 1 1 A 15 15 ALA H H 15 7.350 8.501 -1.151 1
1 77 . 13 1 1 A 15 15 ALA HA H 15 4.550 4.041 0.509 1
1 78 . 13 1 1 A 15 15 ALA C C 15 176.270 179.130 -2.860 1
1 79 . 13 1 1 A 15 15 ALA CA C 15 52.280 55.080 -2.800 1
1 80 . 13 1 1 A 15 15 ALA CB C 15 19.670 18.288 1.382 1
1 81 . 13 1 1 A 15 15 ALA N N 15 117.640 120.337 -2.697 1
1 82 . 13 1 1 A 16 16 LYS H H 16 7.690 8.064 -0.374 1
1 83 . 13 1 1 A 16 16 LYS HA H 16 4.200 4.045 0.155 1
1 84 . 13 1 1 A 16 16 LYS C C 16 175.830 176.929 -1.099 1
1 85 . 13 1 1 A 16 16 LYS CA C 16 59.780 59.743 0.037 1
1 86 . 13 1 1 A 16 16 LYS CB C 16 33.300 32.098 1.202 1
1 87 . 13 1 1 A 16 16 LYS N N 16 120.340 117.397 2.943 1
1 88 . 13 1 1 A 17 17 GLU H H 17 10.170 8.225 1.945 1
1 89 . 13 1 1 A 17 17 GLU HA H 17 4.990 4.484 0.506 1
1 90 . 13 1 1 A 17 17 GLU C C 17 174.790 176.767 -1.977 1
1 91 . 13 1 1 A 17 17 GLU CA C 17 53.910 55.234 -1.324 1
1 92 . 13 1 1 A 17 17 GLU N N 17 116.560 117.635 -1.075 1
1 93 . 13 1 1 A 18 18 GLY H H 18 9.100 8.565 0.535 1
1 94 . 13 1 1 A 18 18 GLY N N 18 113.230 111.248 1.982 1
1 95 . 13 1 1 A 19 19 ASP H H 19 7.730 8.610 -0.880 1
1 96 . 13 1 1 A 19 19 ASP N N 19 126.280 121.676 4.604 1
1 97 . 13 1 1 A 21 21 ASN H H 21 9.090 8.169 0.921 1
1 98 . 13 1 1 A 21 21 ASN N N 21 115.850 115.345 0.505 1
1 99 . 13 1 1 A 24 24 SER C C 24 176.120 174.579 1.541 1
1 100 . 13 1 1 A 25 25 LYS H H 25 10.400 8.581 1.819 1
1 101 . 13 1 1 A 25 25 LYS C C 25 177.600 177.917 -0.317 1
1 102 . 13 1 1 A 25 25 LYS N N 25 124.350 124.997 -0.647 1
1 103 . 13 1 1 A 26 26 GLU H H 26 9.250 8.332 0.918 1
1 104 . 13 1 1 A 26 26 GLU N N 26 118.470 117.725 0.745 1
1 105 . 13 1 1 A 27 27 GLU C C 27 178.580 178.760 -0.180 1
1 106 . 13 1 1 A 27 27 GLU CA C 27 59.920 59.155 0.765 1
1 107 . 13 1 1 A 28 28 LEU H H 28 10.810 9.143 1.667 1
1 108 . 13 1 1 A 28 28 LEU C C 28 177.280 178.607 -1.327 1
1 109 . 13 1 1 A 28 28 LEU CB C 28 43.570 41.623 1.947 1
1 110 . 13 1 1 A 28 28 LEU N N 28 121.060 121.915 -0.855 1
1 111 . 13 1 1 A 29 29 LYS H H 29 9.680 8.622 1.058 1
1 112 . 13 1 1 A 29 29 LYS HA H 29 4.480 3.994 0.486 1
1 113 . 13 1 1 A 29 29 LYS C C 29 176.670 178.755 -2.085 1
1 114 . 13 1 1 A 29 29 LYS CA C 29 60.770 60.091 0.679 1
1 115 . 13 1 1 A 29 29 LYS CB C 29 32.910 32.496 0.414 1
1 116 . 13 1 1 A 29 29 LYS N N 29 121.140 119.338 1.802 1
1 117 . 13 1 1 A 30 30 LEU H H 30 8.410 7.902 0.508 1
1 118 . 13 1 1 A 30 30 LEU CA C 30 57.730 57.965 -0.235 1
1 119 . 13 1 1 A 30 30 LEU CB C 30 42.570 42.027 0.543 1
1 120 . 13 1 1 A 30 30 LEU N N 30 119.000 119.601 -0.601 1
1 121 . 13 1 1 A 31 31 LEU H H 31 9.010 8.130 0.880 1
1 122 . 13 1 1 A 31 31 LEU HA H 31 2.920 3.680 -0.760 1
1 123 . 13 1 1 A 31 31 LEU C C 31 178.280 178.384 -0.104 1
1 124 . 13 1 1 A 31 31 LEU CA C 31 59.030 58.599 0.431 1
1 125 . 13 1 1 A 31 31 LEU N N 31 124.840 120.002 4.838 1
1 126 . 13 1 1 A 32 32 LEU H H 32 9.680 8.926 0.754 1
1 127 . 13 1 1 A 32 32 LEU HA H 32 4.490 4.091 0.399 1
1 128 . 13 1 1 A 32 32 LEU C C 32 177.360 179.789 -2.429 1
1 129 . 13 1 1 A 32 32 LEU CA C 32 58.520 57.304 1.216 1
1 130 . 13 1 1 A 32 32 LEU CB C 32 42.760 41.560 1.200 1
1 131 . 13 1 1 A 32 32 LEU N N 32 120.580 119.098 1.482 1
1 132 . 13 1 1 A 33 33 GLN H H 33 9.140 8.247 0.893 1
1 133 . 13 1 1 A 33 33 GLN HA H 33 4.250 4.161 0.089 1
1 134 . 13 1 1 A 33 33 GLN C C 33 176.050 178.477 -2.427 1
1 135 . 13 1 1 A 33 33 GLN CA C 33 58.600 58.838 -0.238 1
1 136 . 13 1 1 A 33 33 GLN CB C 33 29.730 28.623 1.107 1
1 137 . 13 1 1 A 33 33 GLN N N 33 115.010 119.778 -4.768 1
1 138 . 13 1 1 A 34 34 THR H H 34 8.000 8.000 0.000 1
1 139 . 13 1 1 A 34 34 THR HA H 34 4.390 4.046 0.344 1
1 140 . 13 1 1 A 34 34 THR C C 34 174.130 175.912 -1.782 1
1 141 . 13 1 1 A 34 34 THR CA C 34 65.250 66.421 -1.171 1
1 142 . 13 1 1 A 34 34 THR CB C 34 69.920 69.165 0.755 1
1 143 . 13 1 1 A 34 34 THR N N 34 111.180 114.577 -3.397 1
1 144 . 13 1 1 A 35 35 GLU H H 35 8.810 8.652 0.158 1
1 145 . 13 1 1 A 35 35 GLU HA H 35 4.470 4.023 0.447 1
1 146 . 13 1 1 A 35 35 GLU C C 35 175.430 176.334 -0.904 1
1 147 . 13 1 1 A 35 35 GLU CA C 35 56.170 59.270 -3.100 1
1 148 . 13 1 1 A 35 35 GLU CB C 35 30.900 29.817 1.083 1
1 149 . 13 1 1 A 35 35 GLU N N 35 116.410 121.723 -5.313 1
1 150 . 13 1 1 A 36 36 PHE H H 36 8.230 8.006 0.224 1
1 151 . 13 1 1 A 36 36 PHE HA H 36 5.500 5.097 0.403 1
1 152 . 13 1 1 A 36 36 PHE N N 36 115.090 115.657 -0.567 1
1 153 . 13 1 1 A 37 37 PRO C C 37 178.140 177.890 0.250 1
1 154 . 13 1 1 A 37 37 PRO CA C 37 64.940 64.511 0.429 1
1 155 . 13 1 1 A 37 37 PRO CB C 37 31.600 31.875 -0.275 1
1 156 . 13 1 1 A 38 38 SER H H 38 8.660 8.360 0.300 1
1 157 . 13 1 1 A 38 38 SER HA H 38 4.500 4.280 0.220 1
1 158 . 13 1 1 A 38 38 SER C C 38 174.830 177.277 -2.447 1
1 159 . 13 1 1 A 38 38 SER CA C 38 59.970 61.232 -1.262 1
1 160 . 13 1 1 A 38 38 SER CB C 38 62.690 62.723 -0.033 1
1 161 . 13 1 1 A 38 38 SER N N 38 114.030 112.808 1.222 1
1 162 . 13 1 1 A 39 39 LEU H H 39 8.260 8.171 0.089 1
1 163 . 13 1 1 A 39 39 LEU HA H 39 4.520 4.103 0.417 1
1 164 . 13 1 1 A 39 39 LEU C C 39 176.780 180.014 -3.234 1
1 165 . 13 1 1 A 39 39 LEU CA C 39 56.600 57.322 -0.722 1
1 166 . 13 1 1 A 39 39 LEU CB C 39 42.610 41.298 1.312 1
1 167 . 13 1 1 A 39 39 LEU N N 39 122.650 124.176 -1.526 1
1 168 . 13 1 1 A 40 40 LEU H H 40 8.070 7.922 0.148 1
1 169 . 13 1 1 A 40 40 LEU HA H 40 4.830 4.061 0.769 1
1 170 . 13 1 1 A 40 40 LEU C C 40 175.690 179.346 -3.656 1
1 171 . 13 1 1 A 40 40 LEU CA C 40 54.510 57.929 -3.419 1
1 172 . 13 1 1 A 40 40 LEU CB C 40 42.020 41.189 0.831 1
1 173 . 13 1 1 A 40 40 LEU N N 40 117.390 119.518 -2.128 1
1 174 . 13 1 1 A 41 41 LYS H H 41 7.770 8.015 -0.245 1
1 175 . 13 1 1 A 41 41 LYS HA H 41 4.610 4.139 0.471 1
1 176 . 13 1 1 A 41 41 LYS C C 41 175.380 177.468 -2.088 1
1 177 . 13 1 1 A 41 41 LYS CA C 41 56.170 58.761 -2.591 1
1 178 . 13 1 1 A 41 41 LYS CB C 41 32.950 31.585 1.365 1
1 179 . 13 1 1 A 41 41 LYS N N 41 120.530 117.941 2.589 1
1 180 . 13 1 1 A 42 42 GLY H H 42 8.390 7.890 0.500 1
1 181 . 13 1 1 A 42 42 GLY HA2 H 42 4.280 4.070 0.210 1
1 182 . 13 1 1 A 42 42 GLY HA3 H 42 4.280 4.072 0.208 1
1 183 . 13 1 1 A 42 42 GLY C C 42 177.190 174.866 2.324 1
1 184 . 13 1 1 A 42 42 GLY N N 42 109.280 108.338 0.942 1
1 185 . 13 1 1 A 43 43 MET H H 43 9.020 8.575 0.445 1
1 186 . 13 1 1 A 43 43 MET C C 43 175.520 176.117 -0.597 1
1 187 . 13 1 1 A 43 43 MET N N 43 121.110 119.072 2.038 1
1 188 . 13 1 1 A 44 44 SER H H 44 8.700 7.858 0.842 1
1 189 . 13 1 1 A 44 44 SER C C 44 173.540 174.142 -0.602 1
1 190 . 13 1 1 A 44 44 SER N N 44 116.190 115.735 0.455 1
1 191 . 13 1 1 A 45 45 THR H H 45 8.440 8.677 -0.237 1
1 192 . 13 1 1 A 45 45 THR C C 45 174.300 175.241 -0.941 1
1 193 . 13 1 1 A 45 45 THR N N 45 113.740 119.292 -5.552 1
1 194 . 13 1 1 A 46 46 LEU H H 46 9.380 8.817 0.563 1
1 195 . 13 1 1 A 46 46 LEU C C 46 177.760 178.161 -0.401 1
1 196 . 13 1 1 A 46 46 LEU N N 46 123.970 123.417 0.553 1
1 197 . 13 1 1 A 47 47 ASP H H 47 8.990 8.537 0.453 1
1 198 . 13 1 1 A 47 47 ASP N N 47 118.620 118.105 0.515 1
1 199 . 13 1 1 A 49 49 LEU H H 49 9.740 8.487 1.253 1
1 200 . 13 1 1 A 49 49 LEU N N 49 123.880 120.841 3.039 1
1 201 . 13 1 1 A 50 50 PHE H H 50 10.730 8.826 1.904 1
1 202 . 13 1 1 A 50 50 PHE N N 50 121.380 119.359 2.021 1
1 203 . 13 1 1 A 51 51 GLU H H 51 7.860 8.809 -0.949 1
1 204 . 13 1 1 A 51 51 GLU HA H 51 3.530 3.968 -0.438 1
1 205 . 13 1 1 A 51 51 GLU N N 51 114.870 118.430 -3.560 1
1 206 . 13 1 1 A 66 66 PHE CA C 66 58.850 61.229 -2.379 1
1 207 . 13 1 1 A 67 67 GLN H H 67 5.670 8.096 -2.426 1
1 208 . 13 1 1 A 67 67 GLN C C 67 174.810 178.039 -3.229 1
1 209 . 13 1 1 A 67 67 GLN CA C 67 56.340 58.328 -1.988 1
1 210 . 13 1 1 A 67 67 GLN N N 67 114.050 117.015 -2.965 1
1 211 . 13 1 1 A 68 68 VAL H H 68 5.760 7.604 -1.844 1
1 212 . 13 1 1 A 68 68 VAL C C 68 175.770 178.329 -2.559 1
1 213 . 13 1 1 A 68 68 VAL CA C 68 63.990 66.035 -2.045 1
1 214 . 13 1 1 A 68 68 VAL CB C 68 31.310 31.475 -0.165 1
1 215 . 13 1 1 A 68 68 VAL N N 68 116.280 119.943 -3.663 1
1 216 . 13 1 1 A 69 69 LEU H H 69 7.150 8.628 -1.478 1
1 217 . 13 1 1 A 69 69 LEU HA H 69 4.040 3.943 0.097 1
1 218 . 13 1 1 A 69 69 LEU C C 69 176.210 178.255 -2.045 1
1 219 . 13 1 1 A 69 69 LEU CA C 69 56.270 57.610 -1.340 1
1 220 . 13 1 1 A 69 69 LEU CB C 69 42.010 41.403 0.607 1
1 221 . 13 1 1 A 69 69 LEU N N 69 120.350 120.625 -0.275 1
1 222 . 13 1 1 A 70 70 VAL H H 70 6.810 7.293 -0.483 1
1 223 . 13 1 1 A 70 70 VAL HA H 70 3.170 3.226 -0.056 1
1 224 . 13 1 1 A 70 70 VAL C C 70 175.760 177.438 -1.678 1
1 225 . 13 1 1 A 70 70 VAL CA C 70 65.110 66.895 -1.785 1
1 226 . 13 1 1 A 70 70 VAL CB C 70 31.190 31.169 0.021 1
1 227 . 13 1 1 A 70 70 VAL N N 70 115.790 118.737 -2.947 1
1 228 . 13 1 1 A 71 71 LYS H H 71 7.190 8.212 -1.022 1
1 229 . 13 1 1 A 71 71 LYS HA H 71 3.880 3.920 -0.040 1
1 230 . 13 1 1 A 71 71 LYS C C 71 176.100 179.348 -3.248 1
1 231 . 13 1 1 A 71 71 LYS CA C 71 57.680 59.184 -1.504 1
1 232 . 13 1 1 A 71 71 LYS CB C 71 31.930 32.110 -0.180 1
1 233 . 13 1 1 A 71 71 LYS N N 71 117.820 119.764 -1.944 1
1 234 . 13 1 1 A 72 72 LYS H H 72 7.450 7.331 0.119 1
1 235 . 13 1 1 A 72 72 LYS HA H 72 4.180 4.052 0.128 1
1 236 . 13 1 1 A 72 72 LYS C C 72 176.180 179.205 -3.025 1
1 237 . 13 1 1 A 72 72 LYS CA C 72 56.950 58.201 -1.251 1
1 238 . 13 1 1 A 72 72 LYS CB C 72 33.610 31.834 1.776 1
1 239 . 13 1 1 A 72 72 LYS N N 72 116.930 117.899 -0.969 1
1 240 . 13 1 1 A 73 73 ILE H H 73 7.440 8.002 -0.562 1
1 241 . 13 1 1 A 73 73 ILE HA H 73 4.180 3.425 0.755 1
1 242 . 13 1 1 A 73 73 ILE C C 73 174.440 178.207 -3.767 1
1 243 . 13 1 1 A 73 73 ILE CA C 73 61.510 64.584 -3.074 1
1 244 . 13 1 1 A 73 73 ILE CB C 73 38.610 37.544 1.066 1
1 245 . 13 1 1 A 73 73 ILE N N 73 114.560 121.511 -6.951 1
1 246 . 13 1 1 A 74 74 SER H H 74 7.790 8.974 -1.184 1
1 247 . 13 1 1 A 74 74 SER HA H 74 4.520 4.129 0.391 1
1 248 . 13 1 1 A 74 74 SER C C 74 171.580 177.063 -5.483 1
1 249 . 13 1 1 A 74 74 SER CA C 74 57.960 61.230 -3.270 1
1 250 . 13 1 1 A 74 74 SER CB C 74 63.820 62.997 0.823 1
1 251 . 13 1 1 A 74 74 SER N N 74 117.310 115.591 1.719 1
1 6 . 14 1 1 A 2 2 SER H H 2 9.010 8.009 1.001 1
1 7 . 14 1 1 A 2 2 SER HA H 2 4.680 4.537 0.143 1
1 8 . 14 1 1 A 2 2 SER N N 2 119.390 115.082 4.308 1
1 9 . 14 1 1 A 3 3 PRO C C 3 177.630 178.857 -1.227 1
1 10 . 14 1 1 A 3 3 PRO CA C 3 65.000 64.957 0.043 1
1 11 . 14 1 1 A 3 3 PRO CB C 3 31.790 32.148 -0.358 1
1 12 . 14 1 1 A 4 4 GLU H H 4 8.600 8.393 0.207 1
1 13 . 14 1 1 A 4 4 GLU HA H 4 3.900 4.095 -0.195 1
1 14 . 14 1 1 A 4 4 GLU C C 4 177.910 179.453 -1.543 1
1 15 . 14 1 1 A 4 4 GLU CB C 4 28.980 29.209 -0.229 1
1 16 . 14 1 1 A 4 4 GLU N N 4 117.750 117.687 0.063 1
1 17 . 14 1 1 A 5 5 GLU H H 5 7.980 8.089 -0.109 1
1 18 . 14 1 1 A 5 5 GLU HA H 5 4.170 4.090 0.080 1
1 19 . 14 1 1 A 5 5 GLU C C 5 178.290 179.281 -0.991 1
1 20 . 14 1 1 A 5 5 GLU CA C 5 58.140 59.204 -1.064 1
1 21 . 14 1 1 A 5 5 GLU CB C 5 30.450 29.309 1.141 1
1 22 . 14 1 1 A 5 5 GLU N N 5 121.890 120.184 1.706 1
1 23 . 14 1 1 A 6 6 LEU H H 6 8.450 8.109 0.341 1
1 24 . 14 1 1 A 6 6 LEU HA H 6 4.310 3.977 0.333 1
1 25 . 14 1 1 A 6 6 LEU C C 6 176.660 178.557 -1.897 1
1 26 . 14 1 1 A 6 6 LEU CA C 6 57.310 57.837 -0.527 1
1 27 . 14 1 1 A 6 6 LEU CB C 6 42.090 41.612 0.478 1
1 28 . 14 1 1 A 6 6 LEU N N 6 120.250 120.617 -0.367 1
1 29 . 14 1 1 A 7 7 LYS H H 7 8.100 8.671 -0.571 1
1 30 . 14 1 1 A 7 7 LYS HA H 7 3.760 4.120 -0.360 1
1 31 . 14 1 1 A 7 7 LYS C C 7 176.160 179.644 -3.484 1
1 32 . 14 1 1 A 7 7 LYS CA C 7 59.110 59.855 -0.745 1
1 33 . 14 1 1 A 7 7 LYS CB C 7 32.110 32.382 -0.272 1
1 34 . 14 1 1 A 7 7 LYS N N 7 120.960 118.275 2.685 1
1 35 . 14 1 1 A 8 8 GLY H H 8 7.860 8.347 -0.487 1
1 36 . 14 1 1 A 8 8 GLY HA2 H 8 3.970 3.719 0.251 1
1 37 . 14 1 1 A 8 8 GLY HA3 H 8 3.970 3.721 0.249 1
1 38 . 14 1 1 A 8 8 GLY C C 8 175.520 176.276 -0.756 1
1 39 . 14 1 1 A 8 8 GLY CA C 8 46.490 47.366 -0.876 1
1 40 . 14 1 1 A 8 8 GLY N N 8 105.430 106.991 -1.561 1
1 41 . 14 1 1 A 9 9 ILE H H 9 8.130 9.250 -1.120 1
1 42 . 14 1 1 A 9 9 ILE HA H 9 4.140 3.895 0.245 1
1 43 . 14 1 1 A 9 9 ILE C C 9 175.320 177.922 -2.602 1
1 44 . 14 1 1 A 9 9 ILE CA C 9 65.010 64.545 0.465 1
1 45 . 14 1 1 A 9 9 ILE CB C 9 39.040 37.896 1.144 1
1 46 . 14 1 1 A 9 9 ILE N N 9 122.870 122.615 0.255 1
1 47 . 14 1 1 A 10 10 PHE H H 10 8.590 8.679 -0.089 1
1 48 . 14 1 1 A 10 10 PHE HA H 10 4.470 3.818 0.652 1
1 49 . 14 1 1 A 10 10 PHE C C 10 175.010 177.098 -2.088 1
1 50 . 14 1 1 A 10 10 PHE CA C 10 62.470 62.397 0.073 1
1 51 . 14 1 1 A 10 10 PHE CB C 10 39.670 39.149 0.521 1
1 52 . 14 1 1 A 10 10 PHE N N 10 120.430 120.463 -0.033 1
1 53 . 14 1 1 A 11 11 GLU H H 11 8.600 8.106 0.494 1
1 54 . 14 1 1 A 11 11 GLU HA H 11 3.750 3.675 0.075 1
1 55 . 14 1 1 A 11 11 GLU C C 11 177.630 178.899 -1.269 1
1 56 . 14 1 1 A 11 11 GLU CA C 11 58.440 59.748 -1.308 1
1 57 . 14 1 1 A 11 11 GLU CB C 11 29.840 29.182 0.658 1
1 58 . 14 1 1 A 11 11 GLU N N 11 115.410 118.621 -3.211 1
1 59 . 14 1 1 A 12 12 LYS H H 12 7.940 8.782 -0.842 1
1 60 . 14 1 1 A 12 12 LYS HA H 12 4.080 4.035 0.045 1
1 61 . 14 1 1 A 12 12 LYS CA C 12 58.440 59.030 -0.590 1
1 62 . 14 1 1 A 12 12 LYS CB C 12 32.720 32.394 0.326 1
1 63 . 14 1 1 A 12 12 LYS N N 12 119.220 120.277 -1.057 1
1 64 . 14 1 1 A 13 13 TYR H H 13 7.740 7.452 0.288 1
1 65 . 14 1 1 A 13 13 TYR HA H 13 4.580 4.361 0.219 1
1 66 . 14 1 1 A 13 13 TYR C C 13 39.870 178.289 -138.419 1
1 67 . 14 1 1 A 13 13 TYR CA C 13 61.280 60.259 1.021 1
1 68 . 14 1 1 A 13 13 TYR CB C 13 175.510 39.274 136.236 1
1 69 . 14 1 1 A 13 13 TYR N N 13 115.320 117.422 -2.102 1
1 70 . 14 1 1 A 14 14 ALA H H 14 9.060 8.638 0.422 1
1 71 . 14 1 1 A 14 14 ALA HA H 14 3.850 3.757 0.093 1
1 72 . 14 1 1 A 14 14 ALA C C 14 177.990 179.739 -1.749 1
1 73 . 14 1 1 A 14 14 ALA CA C 14 54.280 54.844 -0.564 1
1 74 . 14 1 1 A 14 14 ALA CB C 14 18.790 17.644 1.146 1
1 75 . 14 1 1 A 14 14 ALA N N 14 120.140 122.641 -2.501 1
1 76 . 14 1 1 A 15 15 ALA H H 15 7.350 8.501 -1.151 1
1 77 . 14 1 1 A 15 15 ALA HA H 15 4.550 4.041 0.509 1
1 78 . 14 1 1 A 15 15 ALA C C 15 176.270 179.130 -2.860 1
1 79 . 14 1 1 A 15 15 ALA CA C 15 52.280 55.080 -2.800 1
1 80 . 14 1 1 A 15 15 ALA CB C 15 19.670 18.288 1.382 1
1 81 . 14 1 1 A 15 15 ALA N N 15 117.640 120.337 -2.697 1
1 82 . 14 1 1 A 16 16 LYS H H 16 7.690 8.064 -0.374 1
1 83 . 14 1 1 A 16 16 LYS HA H 16 4.200 4.045 0.155 1
1 84 . 14 1 1 A 16 16 LYS C C 16 175.830 176.929 -1.099 1
1 85 . 14 1 1 A 16 16 LYS CA C 16 59.780 59.743 0.037 1
1 86 . 14 1 1 A 16 16 LYS CB C 16 33.300 32.098 1.202 1
1 87 . 14 1 1 A 16 16 LYS N N 16 120.340 117.397 2.943 1
1 88 . 14 1 1 A 17 17 GLU H H 17 10.170 8.225 1.945 1
1 89 . 14 1 1 A 17 17 GLU HA H 17 4.990 4.484 0.506 1
1 90 . 14 1 1 A 17 17 GLU C C 17 174.790 176.767 -1.977 1
1 91 . 14 1 1 A 17 17 GLU CA C 17 53.910 55.234 -1.324 1
1 92 . 14 1 1 A 17 17 GLU N N 17 116.560 117.635 -1.075 1
1 93 . 14 1 1 A 18 18 GLY H H 18 9.100 8.565 0.535 1
1 94 . 14 1 1 A 18 18 GLY N N 18 113.230 111.248 1.982 1
1 95 . 14 1 1 A 19 19 ASP H H 19 7.730 8.610 -0.880 1
1 96 . 14 1 1 A 19 19 ASP N N 19 126.280 121.676 4.604 1
1 97 . 14 1 1 A 21 21 ASN H H 21 9.090 8.169 0.921 1
1 98 . 14 1 1 A 21 21 ASN N N 21 115.850 115.345 0.505 1
1 99 . 14 1 1 A 24 24 SER C C 24 176.120 174.579 1.541 1
1 100 . 14 1 1 A 25 25 LYS H H 25 10.400 8.581 1.819 1
1 101 . 14 1 1 A 25 25 LYS C C 25 177.600 177.917 -0.317 1
1 102 . 14 1 1 A 25 25 LYS N N 25 124.350 124.997 -0.647 1
1 103 . 14 1 1 A 26 26 GLU H H 26 9.250 8.332 0.918 1
1 104 . 14 1 1 A 26 26 GLU N N 26 118.470 117.725 0.745 1
1 105 . 14 1 1 A 27 27 GLU C C 27 178.580 178.760 -0.180 1
1 106 . 14 1 1 A 27 27 GLU CA C 27 59.920 59.155 0.765 1
1 107 . 14 1 1 A 28 28 LEU H H 28 10.810 9.143 1.667 1
1 108 . 14 1 1 A 28 28 LEU C C 28 177.280 178.607 -1.327 1
1 109 . 14 1 1 A 28 28 LEU CB C 28 43.570 41.623 1.947 1
1 110 . 14 1 1 A 28 28 LEU N N 28 121.060 121.915 -0.855 1
1 111 . 14 1 1 A 29 29 LYS H H 29 9.680 8.622 1.058 1
1 112 . 14 1 1 A 29 29 LYS HA H 29 4.480 3.994 0.486 1
1 113 . 14 1 1 A 29 29 LYS C C 29 176.670 178.755 -2.085 1
1 114 . 14 1 1 A 29 29 LYS CA C 29 60.770 60.091 0.679 1
1 115 . 14 1 1 A 29 29 LYS CB C 29 32.910 32.496 0.414 1
1 116 . 14 1 1 A 29 29 LYS N N 29 121.140 119.338 1.802 1
1 117 . 14 1 1 A 30 30 LEU H H 30 8.410 7.902 0.508 1
1 118 . 14 1 1 A 30 30 LEU CA C 30 57.730 57.965 -0.235 1
1 119 . 14 1 1 A 30 30 LEU CB C 30 42.570 42.027 0.543 1
1 120 . 14 1 1 A 30 30 LEU N N 30 119.000 119.601 -0.601 1
1 121 . 14 1 1 A 31 31 LEU H H 31 9.010 8.130 0.880 1
1 122 . 14 1 1 A 31 31 LEU HA H 31 2.920 3.680 -0.760 1
1 123 . 14 1 1 A 31 31 LEU C C 31 178.280 178.384 -0.104 1
1 124 . 14 1 1 A 31 31 LEU CA C 31 59.030 58.599 0.431 1
1 125 . 14 1 1 A 31 31 LEU N N 31 124.840 120.002 4.838 1
1 126 . 14 1 1 A 32 32 LEU H H 32 9.680 8.926 0.754 1
1 127 . 14 1 1 A 32 32 LEU HA H 32 4.490 4.091 0.399 1
1 128 . 14 1 1 A 32 32 LEU C C 32 177.360 179.789 -2.429 1
1 129 . 14 1 1 A 32 32 LEU CA C 32 58.520 57.304 1.216 1
1 130 . 14 1 1 A 32 32 LEU CB C 32 42.760 41.560 1.200 1
1 131 . 14 1 1 A 32 32 LEU N N 32 120.580 119.098 1.482 1
1 132 . 14 1 1 A 33 33 GLN H H 33 9.140 8.247 0.893 1
1 133 . 14 1 1 A 33 33 GLN HA H 33 4.250 4.161 0.089 1
1 134 . 14 1 1 A 33 33 GLN C C 33 176.050 178.477 -2.427 1
1 135 . 14 1 1 A 33 33 GLN CA C 33 58.600 58.838 -0.238 1
1 136 . 14 1 1 A 33 33 GLN CB C 33 29.730 28.623 1.107 1
1 137 . 14 1 1 A 33 33 GLN N N 33 115.010 119.778 -4.768 1
1 138 . 14 1 1 A 34 34 THR H H 34 8.000 8.000 0.000 1
1 139 . 14 1 1 A 34 34 THR HA H 34 4.390 4.046 0.344 1
1 140 . 14 1 1 A 34 34 THR C C 34 174.130 175.912 -1.782 1
1 141 . 14 1 1 A 34 34 THR CA C 34 65.250 66.421 -1.171 1
1 142 . 14 1 1 A 34 34 THR CB C 34 69.920 69.165 0.755 1
1 143 . 14 1 1 A 34 34 THR N N 34 111.180 114.577 -3.397 1
1 144 . 14 1 1 A 35 35 GLU H H 35 8.810 8.652 0.158 1
1 145 . 14 1 1 A 35 35 GLU HA H 35 4.470 4.023 0.447 1
1 146 . 14 1 1 A 35 35 GLU C C 35 175.430 176.334 -0.904 1
1 147 . 14 1 1 A 35 35 GLU CA C 35 56.170 59.270 -3.100 1
1 148 . 14 1 1 A 35 35 GLU CB C 35 30.900 29.817 1.083 1
1 149 . 14 1 1 A 35 35 GLU N N 35 116.410 121.723 -5.313 1
1 150 . 14 1 1 A 36 36 PHE H H 36 8.230 8.006 0.224 1
1 151 . 14 1 1 A 36 36 PHE HA H 36 5.500 5.097 0.403 1
1 152 . 14 1 1 A 36 36 PHE N N 36 115.090 115.657 -0.567 1
1 153 . 14 1 1 A 37 37 PRO C C 37 178.140 177.890 0.250 1
1 154 . 14 1 1 A 37 37 PRO CA C 37 64.940 64.511 0.429 1
1 155 . 14 1 1 A 37 37 PRO CB C 37 31.600 31.875 -0.275 1
1 156 . 14 1 1 A 38 38 SER H H 38 8.660 8.360 0.300 1
1 157 . 14 1 1 A 38 38 SER HA H 38 4.500 4.280 0.220 1
1 158 . 14 1 1 A 38 38 SER C C 38 174.830 177.277 -2.447 1
1 159 . 14 1 1 A 38 38 SER CA C 38 59.970 61.232 -1.262 1
1 160 . 14 1 1 A 38 38 SER CB C 38 62.690 62.723 -0.033 1
1 161 . 14 1 1 A 38 38 SER N N 38 114.030 112.808 1.222 1
1 162 . 14 1 1 A 39 39 LEU H H 39 8.260 8.171 0.089 1
1 163 . 14 1 1 A 39 39 LEU HA H 39 4.520 4.103 0.417 1
1 164 . 14 1 1 A 39 39 LEU C C 39 176.780 180.014 -3.234 1
1 165 . 14 1 1 A 39 39 LEU CA C 39 56.600 57.322 -0.722 1
1 166 . 14 1 1 A 39 39 LEU CB C 39 42.610 41.298 1.312 1
1 167 . 14 1 1 A 39 39 LEU N N 39 122.650 124.176 -1.526 1
1 168 . 14 1 1 A 40 40 LEU H H 40 8.070 7.922 0.148 1
1 169 . 14 1 1 A 40 40 LEU HA H 40 4.830 4.061 0.769 1
1 170 . 14 1 1 A 40 40 LEU C C 40 175.690 179.346 -3.656 1
1 171 . 14 1 1 A 40 40 LEU CA C 40 54.510 57.929 -3.419 1
1 172 . 14 1 1 A 40 40 LEU CB C 40 42.020 41.189 0.831 1
1 173 . 14 1 1 A 40 40 LEU N N 40 117.390 119.518 -2.128 1
1 174 . 14 1 1 A 41 41 LYS H H 41 7.770 8.015 -0.245 1
1 175 . 14 1 1 A 41 41 LYS HA H 41 4.610 4.139 0.471 1
1 176 . 14 1 1 A 41 41 LYS C C 41 175.380 177.468 -2.088 1
1 177 . 14 1 1 A 41 41 LYS CA C 41 56.170 58.761 -2.591 1
1 178 . 14 1 1 A 41 41 LYS CB C 41 32.950 31.585 1.365 1
1 179 . 14 1 1 A 41 41 LYS N N 41 120.530 117.941 2.589 1
1 180 . 14 1 1 A 42 42 GLY H H 42 8.390 7.890 0.500 1
1 181 . 14 1 1 A 42 42 GLY HA2 H 42 4.280 4.070 0.210 1
1 182 . 14 1 1 A 42 42 GLY HA3 H 42 4.280 4.072 0.208 1
1 183 . 14 1 1 A 42 42 GLY C C 42 177.190 174.866 2.324 1
1 184 . 14 1 1 A 42 42 GLY N N 42 109.280 108.338 0.942 1
1 185 . 14 1 1 A 43 43 MET H H 43 9.020 8.575 0.445 1
1 186 . 14 1 1 A 43 43 MET C C 43 175.520 176.117 -0.597 1
1 187 . 14 1 1 A 43 43 MET N N 43 121.110 119.072 2.038 1
1 188 . 14 1 1 A 44 44 SER H H 44 8.700 7.858 0.842 1
1 189 . 14 1 1 A 44 44 SER C C 44 173.540 174.142 -0.602 1
1 190 . 14 1 1 A 44 44 SER N N 44 116.190 115.735 0.455 1
1 191 . 14 1 1 A 45 45 THR H H 45 8.440 8.677 -0.237 1
1 192 . 14 1 1 A 45 45 THR C C 45 174.300 175.241 -0.941 1
1 193 . 14 1 1 A 45 45 THR N N 45 113.740 119.292 -5.552 1
1 194 . 14 1 1 A 46 46 LEU H H 46 9.380 8.817 0.563 1
1 195 . 14 1 1 A 46 46 LEU C C 46 177.760 178.161 -0.401 1
1 196 . 14 1 1 A 46 46 LEU N N 46 123.970 123.417 0.553 1
1 197 . 14 1 1 A 47 47 ASP H H 47 8.990 8.537 0.453 1
1 198 . 14 1 1 A 47 47 ASP N N 47 118.620 118.105 0.515 1
1 199 . 14 1 1 A 49 49 LEU H H 49 9.740 8.487 1.253 1
1 200 . 14 1 1 A 49 49 LEU N N 49 123.880 120.841 3.039 1
1 201 . 14 1 1 A 50 50 PHE H H 50 10.730 8.826 1.904 1
1 202 . 14 1 1 A 50 50 PHE N N 50 121.380 119.359 2.021 1
1 203 . 14 1 1 A 51 51 GLU H H 51 7.860 8.809 -0.949 1
1 204 . 14 1 1 A 51 51 GLU HA H 51 3.530 3.968 -0.438 1
1 205 . 14 1 1 A 51 51 GLU N N 51 114.870 118.430 -3.560 1
1 206 . 14 1 1 A 66 66 PHE CA C 66 58.850 61.229 -2.379 1
1 207 . 14 1 1 A 67 67 GLN H H 67 5.670 8.096 -2.426 1
1 208 . 14 1 1 A 67 67 GLN C C 67 174.810 178.039 -3.229 1
1 209 . 14 1 1 A 67 67 GLN CA C 67 56.340 58.328 -1.988 1
1 210 . 14 1 1 A 67 67 GLN N N 67 114.050 117.015 -2.965 1
1 211 . 14 1 1 A 68 68 VAL H H 68 5.760 7.604 -1.844 1
1 212 . 14 1 1 A 68 68 VAL C C 68 175.770 178.329 -2.559 1
1 213 . 14 1 1 A 68 68 VAL CA C 68 63.990 66.035 -2.045 1
1 214 . 14 1 1 A 68 68 VAL CB C 68 31.310 31.475 -0.165 1
1 215 . 14 1 1 A 68 68 VAL N N 68 116.280 119.943 -3.663 1
1 216 . 14 1 1 A 69 69 LEU H H 69 7.150 8.628 -1.478 1
1 217 . 14 1 1 A 69 69 LEU HA H 69 4.040 3.943 0.097 1
1 218 . 14 1 1 A 69 69 LEU C C 69 176.210 178.255 -2.045 1
1 219 . 14 1 1 A 69 69 LEU CA C 69 56.270 57.610 -1.340 1
1 220 . 14 1 1 A 69 69 LEU CB C 69 42.010 41.403 0.607 1
1 221 . 14 1 1 A 69 69 LEU N N 69 120.350 120.625 -0.275 1
1 222 . 14 1 1 A 70 70 VAL H H 70 6.810 7.293 -0.483 1
1 223 . 14 1 1 A 70 70 VAL HA H 70 3.170 3.226 -0.056 1
1 224 . 14 1 1 A 70 70 VAL C C 70 175.760 177.438 -1.678 1
1 225 . 14 1 1 A 70 70 VAL CA C 70 65.110 66.895 -1.785 1
1 226 . 14 1 1 A 70 70 VAL CB C 70 31.190 31.169 0.021 1
1 227 . 14 1 1 A 70 70 VAL N N 70 115.790 118.737 -2.947 1
1 228 . 14 1 1 A 71 71 LYS H H 71 7.190 8.212 -1.022 1
1 229 . 14 1 1 A 71 71 LYS HA H 71 3.880 3.920 -0.040 1
1 230 . 14 1 1 A 71 71 LYS C C 71 176.100 179.348 -3.248 1
1 231 . 14 1 1 A 71 71 LYS CA C 71 57.680 59.184 -1.504 1
1 232 . 14 1 1 A 71 71 LYS CB C 71 31.930 32.110 -0.180 1
1 233 . 14 1 1 A 71 71 LYS N N 71 117.820 119.764 -1.944 1
1 234 . 14 1 1 A 72 72 LYS H H 72 7.450 7.331 0.119 1
1 235 . 14 1 1 A 72 72 LYS HA H 72 4.180 4.052 0.128 1
1 236 . 14 1 1 A 72 72 LYS C C 72 176.180 179.205 -3.025 1
1 237 . 14 1 1 A 72 72 LYS CA C 72 56.950 58.201 -1.251 1
1 238 . 14 1 1 A 72 72 LYS CB C 72 33.610 31.834 1.776 1
1 239 . 14 1 1 A 72 72 LYS N N 72 116.930 117.899 -0.969 1
1 240 . 14 1 1 A 73 73 ILE H H 73 7.440 8.002 -0.562 1
1 241 . 14 1 1 A 73 73 ILE HA H 73 4.180 3.425 0.755 1
1 242 . 14 1 1 A 73 73 ILE C C 73 174.440 178.207 -3.767 1
1 243 . 14 1 1 A 73 73 ILE CA C 73 61.510 64.584 -3.074 1
1 244 . 14 1 1 A 73 73 ILE CB C 73 38.610 37.544 1.066 1
1 245 . 14 1 1 A 73 73 ILE N N 73 114.560 121.511 -6.951 1
1 246 . 14 1 1 A 74 74 SER H H 74 7.790 8.974 -1.184 1
1 247 . 14 1 1 A 74 74 SER HA H 74 4.520 4.129 0.391 1
1 248 . 14 1 1 A 74 74 SER C C 74 171.580 177.063 -5.483 1
1 249 . 14 1 1 A 74 74 SER CA C 74 57.960 61.230 -3.270 1
1 250 . 14 1 1 A 74 74 SER CB C 74 63.820 62.997 0.823 1
1 251 . 14 1 1 A 74 74 SER N N 74 117.310 115.591 1.719 1
1 6 . 15 1 1 A 2 2 SER H H 2 9.010 8.809 0.201 1
1 7 . 15 1 1 A 2 2 SER HA H 2 4.680 4.626 0.054 1
1 8 . 15 1 1 A 2 2 SER N N 2 119.390 121.441 -2.051 1
1 9 . 15 1 1 A 3 3 PRO C C 3 177.630 178.895 -1.265 1
1 10 . 15 1 1 A 3 3 PRO CA C 3 65.000 64.724 0.276 1
1 11 . 15 1 1 A 3 3 PRO CB C 3 31.790 32.146 -0.356 1
1 12 . 15 1 1 A 4 4 GLU H H 4 8.600 8.367 0.233 1
1 13 . 15 1 1 A 4 4 GLU HA H 4 3.900 4.108 -0.208 1
1 14 . 15 1 1 A 4 4 GLU C C 4 177.910 179.522 -1.612 1
1 15 . 15 1 1 A 4 4 GLU CB C 4 28.980 29.089 -0.109 1
1 16 . 15 1 1 A 4 4 GLU N N 4 117.750 118.085 -0.335 1
1 17 . 15 1 1 A 5 5 GLU H H 5 7.980 8.129 -0.149 1
1 18 . 15 1 1 A 5 5 GLU HA H 5 4.170 4.050 0.120 1
1 19 . 15 1 1 A 5 5 GLU C C 5 178.290 179.225 -0.935 1
1 20 . 15 1 1 A 5 5 GLU CA C 5 58.140 59.204 -1.064 1
1 21 . 15 1 1 A 5 5 GLU CB C 5 30.450 29.386 1.064 1
1 22 . 15 1 1 A 5 5 GLU N N 5 121.890 120.292 1.598 1
1 23 . 15 1 1 A 6 6 LEU H H 6 8.450 8.102 0.348 1
1 24 . 15 1 1 A 6 6 LEU HA H 6 4.310 4.072 0.238 1
1 25 . 15 1 1 A 6 6 LEU C C 6 176.660 178.843 -2.183 1
1 26 . 15 1 1 A 6 6 LEU CA C 6 57.310 57.837 -0.527 1
1 27 . 15 1 1 A 6 6 LEU CB C 6 42.090 41.772 0.318 1
1 28 . 15 1 1 A 6 6 LEU N N 6 120.250 120.556 -0.306 1
1 29 . 15 1 1 A 7 7 LYS H H 7 8.100 9.016 -0.916 1
1 30 . 15 1 1 A 7 7 LYS HA H 7 3.760 4.074 -0.314 1
1 31 . 15 1 1 A 7 7 LYS C C 7 176.160 179.420 -3.260 1
1 32 . 15 1 1 A 7 7 LYS CA C 7 59.110 59.892 -0.782 1
1 33 . 15 1 1 A 7 7 LYS CB C 7 32.110 32.326 -0.216 1
1 34 . 15 1 1 A 7 7 LYS N N 7 120.960 118.636 2.324 1
1 35 . 15 1 1 A 8 8 GLY H H 8 7.860 8.799 -0.939 1
1 36 . 15 1 1 A 8 8 GLY HA2 H 8 3.970 3.794 0.176 1
1 37 . 15 1 1 A 8 8 GLY HA3 H 8 3.970 3.798 0.172 1
1 38 . 15 1 1 A 8 8 GLY C C 8 175.520 176.297 -0.777 1
1 39 . 15 1 1 A 8 8 GLY CA C 8 46.490 47.450 -0.960 1
1 40 . 15 1 1 A 8 8 GLY N N 8 105.430 107.266 -1.836 1
1 41 . 15 1 1 A 9 9 ILE H H 9 8.130 9.206 -1.076 1
1 42 . 15 1 1 A 9 9 ILE HA H 9 4.140 3.907 0.233 1
1 43 . 15 1 1 A 9 9 ILE C C 9 175.320 178.042 -2.722 1
1 44 . 15 1 1 A 9 9 ILE CA C 9 65.010 64.609 0.401 1
1 45 . 15 1 1 A 9 9 ILE CB C 9 39.040 37.999 1.041 1
1 46 . 15 1 1 A 9 9 ILE N N 9 122.870 122.500 0.370 1
1 47 . 15 1 1 A 10 10 PHE H H 10 8.590 9.483 -0.893 1
1 48 . 15 1 1 A 10 10 PHE HA H 10 4.470 3.994 0.476 1
1 49 . 15 1 1 A 10 10 PHE C C 10 175.010 177.153 -2.143 1
1 50 . 15 1 1 A 10 10 PHE CA C 10 62.470 62.524 -0.054 1
1 51 . 15 1 1 A 10 10 PHE CB C 10 39.670 39.275 0.395 1
1 52 . 15 1 1 A 10 10 PHE N N 10 120.430 120.482 -0.052 1
1 53 . 15 1 1 A 11 11 GLU H H 11 8.600 8.711 -0.111 1
1 54 . 15 1 1 A 11 11 GLU HA H 11 3.750 3.690 0.060 1
1 55 . 15 1 1 A 11 11 GLU C C 11 177.630 178.902 -1.272 1
1 56 . 15 1 1 A 11 11 GLU CA C 11 58.440 59.746 -1.306 1
1 57 . 15 1 1 A 11 11 GLU CB C 11 29.840 29.292 0.548 1
1 58 . 15 1 1 A 11 11 GLU N N 11 115.410 117.949 -2.539 1
1 59 . 15 1 1 A 12 12 LYS H H 12 7.940 8.644 -0.704 1
1 60 . 15 1 1 A 12 12 LYS HA H 12 4.080 3.950 0.130 1
1 61 . 15 1 1 A 12 12 LYS CA C 12 58.440 59.067 -0.627 1
1 62 . 15 1 1 A 12 12 LYS CB C 12 32.720 32.291 0.429 1
1 63 . 15 1 1 A 12 12 LYS N N 12 119.220 120.344 -1.124 1
1 64 . 15 1 1 A 13 13 TYR H H 13 7.740 7.351 0.389 1
1 65 . 15 1 1 A 13 13 TYR HA H 13 4.580 4.343 0.237 1
1 66 . 15 1 1 A 13 13 TYR C C 13 39.870 178.411 -138.541 1
1 67 . 15 1 1 A 13 13 TYR CA C 13 61.280 60.256 1.024 1
1 68 . 15 1 1 A 13 13 TYR CB C 13 175.510 39.274 136.236 1
1 69 . 15 1 1 A 13 13 TYR N N 13 115.320 117.211 -1.891 1
1 70 . 15 1 1 A 14 14 ALA H H 14 9.060 8.604 0.456 1
1 71 . 15 1 1 A 14 14 ALA HA H 14 3.850 3.785 0.065 1
1 72 . 15 1 1 A 14 14 ALA C C 14 177.990 179.855 -1.865 1
1 73 . 15 1 1 A 14 14 ALA CA C 14 54.280 54.747 -0.467 1
1 74 . 15 1 1 A 14 14 ALA CB C 14 18.790 17.685 1.105 1
1 75 . 15 1 1 A 14 14 ALA N N 14 120.140 122.623 -2.483 1
1 76 . 15 1 1 A 15 15 ALA H H 15 7.350 8.355 -1.005 1
1 77 . 15 1 1 A 15 15 ALA HA H 15 4.550 3.992 0.558 1
1 78 . 15 1 1 A 15 15 ALA C C 15 176.270 179.162 -2.892 1
1 79 . 15 1 1 A 15 15 ALA CA C 15 52.280 54.950 -2.670 1
1 80 . 15 1 1 A 15 15 ALA CB C 15 19.670 18.350 1.320 1
1 81 . 15 1 1 A 15 15 ALA N N 15 117.640 120.085 -2.445 1
1 82 . 15 1 1 A 16 16 LYS H H 16 7.690 8.226 -0.536 1
1 83 . 15 1 1 A 16 16 LYS HA H 16 4.200 3.994 0.206 1
1 84 . 15 1 1 A 16 16 LYS C C 16 175.830 177.121 -1.291 1
1 85 . 15 1 1 A 16 16 LYS CA C 16 59.780 59.723 0.057 1
1 86 . 15 1 1 A 16 16 LYS CB C 16 33.300 32.233 1.067 1
1 87 . 15 1 1 A 16 16 LYS N N 16 120.340 117.113 3.227 1
1 88 . 15 1 1 A 17 17 GLU H H 17 10.170 8.280 1.890 1
1 89 . 15 1 1 A 17 17 GLU HA H 17 4.990 4.480 0.510 1
1 90 . 15 1 1 A 17 17 GLU C C 17 174.790 177.019 -2.229 1
1 91 . 15 1 1 A 17 17 GLU CA C 17 53.910 55.327 -1.417 1
1 92 . 15 1 1 A 17 17 GLU N N 17 116.560 118.315 -1.755 1
1 93 . 15 1 1 A 18 18 GLY H H 18 9.100 8.580 0.520 1
1 94 . 15 1 1 A 18 18 GLY N N 18 113.230 111.595 1.635 1
1 95 . 15 1 1 A 19 19 ASP H H 19 7.730 8.356 -0.626 1
1 96 . 15 1 1 A 19 19 ASP N N 19 126.280 121.515 4.765 1
1 97 . 15 1 1 A 21 21 ASN H H 21 9.090 8.160 0.930 1
1 98 . 15 1 1 A 21 21 ASN N N 21 115.850 115.373 0.477 1
1 99 . 15 1 1 A 24 24 SER C C 24 176.120 174.503 1.617 1
1 100 . 15 1 1 A 25 25 LYS H H 25 10.400 8.512 1.888 1
1 101 . 15 1 1 A 25 25 LYS C C 25 177.600 177.821 -0.221 1
1 102 . 15 1 1 A 25 25 LYS N N 25 124.350 124.936 -0.586 1
1 103 . 15 1 1 A 26 26 GLU H H 26 9.250 8.320 0.930 1
1 104 . 15 1 1 A 26 26 GLU N N 26 118.470 117.665 0.805 1
1 105 . 15 1 1 A 27 27 GLU C C 27 178.580 178.558 0.022 1
1 106 . 15 1 1 A 27 27 GLU CA C 27 59.920 58.989 0.931 1
1 107 . 15 1 1 A 28 28 LEU H H 28 10.810 9.051 1.759 1
1 108 . 15 1 1 A 28 28 LEU C C 28 177.280 178.455 -1.175 1
1 109 . 15 1 1 A 28 28 LEU CB C 28 43.570 41.522 2.048 1
1 110 . 15 1 1 A 28 28 LEU N N 28 121.060 121.760 -0.700 1
1 111 . 15 1 1 A 29 29 LYS H H 29 9.680 8.528 1.152 1
1 112 . 15 1 1 A 29 29 LYS HA H 29 4.480 3.931 0.549 1
1 113 . 15 1 1 A 29 29 LYS C C 29 176.670 178.649 -1.979 1
1 114 . 15 1 1 A 29 29 LYS CA C 29 60.770 60.012 0.758 1
1 115 . 15 1 1 A 29 29 LYS CB C 29 32.910 32.465 0.445 1
1 116 . 15 1 1 A 29 29 LYS N N 29 121.140 119.207 1.933 1
1 117 . 15 1 1 A 30 30 LEU H H 30 8.410 7.742 0.668 1
1 118 . 15 1 1 A 30 30 LEU CA C 30 57.730 57.788 -0.058 1
1 119 . 15 1 1 A 30 30 LEU CB C 30 42.570 41.925 0.645 1
1 120 . 15 1 1 A 30 30 LEU N N 30 119.000 119.459 -0.459 1
1 121 . 15 1 1 A 31 31 LEU H H 31 9.010 7.521 1.489 1
1 122 . 15 1 1 A 31 31 LEU HA H 31 2.920 3.625 -0.705 1
1 123 . 15 1 1 A 31 31 LEU C C 31 178.280 178.157 0.123 1
1 124 . 15 1 1 A 31 31 LEU CA C 31 59.030 58.401 0.629 1
1 125 . 15 1 1 A 31 31 LEU N N 31 124.840 119.574 5.266 1
1 126 . 15 1 1 A 32 32 LEU H H 32 9.680 8.884 0.796 1
1 127 . 15 1 1 A 32 32 LEU HA H 32 4.490 4.061 0.429 1
1 128 . 15 1 1 A 32 32 LEU C C 32 177.360 179.698 -2.338 1
1 129 . 15 1 1 A 32 32 LEU CA C 32 58.520 57.267 1.253 1
1 130 . 15 1 1 A 32 32 LEU CB C 32 42.760 41.504 1.256 1
1 131 . 15 1 1 A 32 32 LEU N N 32 120.580 119.041 1.539 1
1 132 . 15 1 1 A 33 33 GLN H H 33 9.140 8.157 0.983 1
1 133 . 15 1 1 A 33 33 GLN HA H 33 4.250 4.133 0.117 1
1 134 . 15 1 1 A 33 33 GLN C C 33 176.050 178.051 -2.001 1
1 135 . 15 1 1 A 33 33 GLN CA C 33 58.600 58.836 -0.236 1
1 136 . 15 1 1 A 33 33 GLN CB C 33 29.730 28.549 1.181 1
1 137 . 15 1 1 A 33 33 GLN N N 33 115.010 119.726 -4.716 1
1 138 . 15 1 1 A 34 34 THR H H 34 8.000 7.981 0.019 1
1 139 . 15 1 1 A 34 34 THR HA H 34 4.390 4.066 0.324 1
1 140 . 15 1 1 A 34 34 THR C C 34 174.130 175.979 -1.849 1
1 141 . 15 1 1 A 34 34 THR CA C 34 65.250 66.157 -0.907 1
1 142 . 15 1 1 A 34 34 THR CB C 34 69.920 69.191 0.729 1
1 143 . 15 1 1 A 34 34 THR N N 34 111.180 114.726 -3.546 1
1 144 . 15 1 1 A 35 35 GLU H H 35 8.810 8.678 0.132 1
1 145 . 15 1 1 A 35 35 GLU HA H 35 4.470 4.098 0.372 1
1 146 . 15 1 1 A 35 35 GLU C C 35 175.430 176.302 -0.872 1
1 147 . 15 1 1 A 35 35 GLU CA C 35 56.170 59.337 -3.167 1
1 148 . 15 1 1 A 35 35 GLU CB C 35 30.900 29.903 0.997 1
1 149 . 15 1 1 A 35 35 GLU N N 35 116.410 121.655 -5.245 1
1 150 . 15 1 1 A 36 36 PHE H H 36 8.230 8.044 0.186 1
1 151 . 15 1 1 A 36 36 PHE HA H 36 5.500 5.084 0.416 1
1 152 . 15 1 1 A 36 36 PHE N N 36 115.090 115.837 -0.747 1
1 153 . 15 1 1 A 37 37 PRO C C 37 178.140 178.309 -0.169 1
1 154 . 15 1 1 A 37 37 PRO CA C 37 64.940 64.720 0.220 1
1 155 . 15 1 1 A 37 37 PRO CB C 37 31.600 32.033 -0.433 1
1 156 . 15 1 1 A 38 38 SER H H 38 8.660 8.596 0.064 1
1 157 . 15 1 1 A 38 38 SER HA H 38 4.500 4.268 0.232 1
1 158 . 15 1 1 A 38 38 SER C C 38 174.830 177.105 -2.275 1
1 159 . 15 1 1 A 38 38 SER CA C 38 59.970 61.355 -1.385 1
1 160 . 15 1 1 A 38 38 SER CB C 38 62.690 62.808 -0.118 1
1 161 . 15 1 1 A 38 38 SER N N 38 114.030 114.405 -0.375 1
1 162 . 15 1 1 A 39 39 LEU H H 39 8.260 8.160 0.100 1
1 163 . 15 1 1 A 39 39 LEU HA H 39 4.520 4.113 0.407 1
1 164 . 15 1 1 A 39 39 LEU C C 39 176.780 180.030 -3.250 1
1 165 . 15 1 1 A 39 39 LEU CA C 39 56.600 57.384 -0.784 1
1 166 . 15 1 1 A 39 39 LEU CB C 39 42.610 41.531 1.079 1
1 167 . 15 1 1 A 39 39 LEU N N 39 122.650 122.008 0.642 1
1 168 . 15 1 1 A 40 40 LEU H H 40 8.070 8.178 -0.108 1
1 169 . 15 1 1 A 40 40 LEU HA H 40 4.830 4.039 0.791 1
1 170 . 15 1 1 A 40 40 LEU C C 40 175.690 179.487 -3.797 1
1 171 . 15 1 1 A 40 40 LEU CA C 40 54.510 57.933 -3.423 1
1 172 . 15 1 1 A 40 40 LEU CB C 40 42.020 41.283 0.737 1
1 173 . 15 1 1 A 40 40 LEU N N 40 117.390 119.536 -2.146 1
1 174 . 15 1 1 A 41 41 LYS H H 41 7.770 8.084 -0.314 1
1 175 . 15 1 1 A 41 41 LYS HA H 41 4.610 4.119 0.491 1
1 176 . 15 1 1 A 41 41 LYS C C 41 175.380 177.466 -2.086 1
1 177 . 15 1 1 A 41 41 LYS CA C 41 56.170 58.709 -2.539 1
1 178 . 15 1 1 A 41 41 LYS CB C 41 32.950 31.747 1.203 1
1 179 . 15 1 1 A 41 41 LYS N N 41 120.530 117.783 2.747 1
1 180 . 15 1 1 A 42 42 GLY H H 42 8.390 7.955 0.435 1
1 181 . 15 1 1 A 42 42 GLY HA2 H 42 4.280 4.090 0.190 1
1 182 . 15 1 1 A 42 42 GLY HA3 H 42 4.280 4.092 0.188 1
1 183 . 15 1 1 A 42 42 GLY C C 42 177.190 174.860 2.330 1
1 184 . 15 1 1 A 42 42 GLY N N 42 109.280 108.341 0.939 1
1 185 . 15 1 1 A 43 43 MET H H 43 9.020 8.566 0.454 1
1 186 . 15 1 1 A 43 43 MET C C 43 175.520 176.190 -0.670 1
1 187 . 15 1 1 A 43 43 MET N N 43 121.110 119.049 2.061 1
1 188 . 15 1 1 A 44 44 SER H H 44 8.700 7.887 0.813 1
1 189 . 15 1 1 A 44 44 SER C C 44 173.540 174.128 -0.588 1
1 190 . 15 1 1 A 44 44 SER N N 44 116.190 115.826 0.364 1
1 191 . 15 1 1 A 45 45 THR H H 45 8.440 8.687 -0.247 1
1 192 . 15 1 1 A 45 45 THR C C 45 174.300 175.337 -1.037 1
1 193 . 15 1 1 A 45 45 THR N N 45 113.740 119.372 -5.632 1
1 194 . 15 1 1 A 46 46 LEU H H 46 9.380 8.824 0.556 1
1 195 . 15 1 1 A 46 46 LEU C C 46 177.760 178.168 -0.408 1
1 196 . 15 1 1 A 46 46 LEU N N 46 123.970 123.532 0.438 1
1 197 . 15 1 1 A 47 47 ASP H H 47 8.990 8.534 0.456 1
1 198 . 15 1 1 A 47 47 ASP N N 47 118.620 118.080 0.540 1
1 199 . 15 1 1 A 49 49 LEU H H 49 9.740 8.559 1.181 1
1 200 . 15 1 1 A 49 49 LEU N N 49 123.880 120.808 3.072 1
1 201 . 15 1 1 A 50 50 PHE H H 50 10.730 8.813 1.917 1
1 202 . 15 1 1 A 50 50 PHE N N 50 121.380 119.342 2.038 1
1 203 . 15 1 1 A 51 51 GLU H H 51 7.860 8.368 -0.508 1
1 204 . 15 1 1 A 51 51 GLU HA H 51 3.530 3.825 -0.295 1
1 205 . 15 1 1 A 51 51 GLU N N 51 114.870 119.311 -4.441 1
1 206 . 15 1 1 A 66 66 PHE CA C 66 58.850 61.297 -2.447 1
1 207 . 15 1 1 A 67 67 GLN H H 67 5.670 8.289 -2.619 1
1 208 . 15 1 1 A 67 67 GLN C C 67 174.810 178.033 -3.223 1
1 209 . 15 1 1 A 67 67 GLN CA C 67 56.340 58.189 -1.849 1
1 210 . 15 1 1 A 67 67 GLN N N 67 114.050 117.448 -3.398 1
1 211 . 15 1 1 A 68 68 VAL H H 68 5.760 7.385 -1.625 1
1 212 . 15 1 1 A 68 68 VAL C C 68 175.770 178.502 -2.732 1
1 213 . 15 1 1 A 68 68 VAL CA C 68 63.990 65.907 -1.917 1
1 214 . 15 1 1 A 68 68 VAL CB C 68 31.310 31.407 -0.097 1
1 215 . 15 1 1 A 68 68 VAL N N 68 116.280 119.682 -3.402 1
1 216 . 15 1 1 A 69 69 LEU H H 69 7.150 8.485 -1.335 1
1 217 . 15 1 1 A 69 69 LEU HA H 69 4.040 4.019 0.021 1
1 218 . 15 1 1 A 69 69 LEU C C 69 176.210 178.264 -2.054 1
1 219 . 15 1 1 A 69 69 LEU CA C 69 56.270 57.364 -1.094 1
1 220 . 15 1 1 A 69 69 LEU CB C 69 42.010 41.777 0.233 1
1 221 . 15 1 1 A 69 69 LEU N N 69 120.350 121.125 -0.775 1
1 222 . 15 1 1 A 70 70 VAL H H 70 6.810 7.289 -0.479 1
1 223 . 15 1 1 A 70 70 VAL HA H 70 3.170 3.216 -0.046 1
1 224 . 15 1 1 A 70 70 VAL C C 70 175.760 177.509 -1.749 1
1 225 . 15 1 1 A 70 70 VAL CA C 70 65.110 66.766 -1.656 1
1 226 . 15 1 1 A 70 70 VAL CB C 70 31.190 31.119 0.071 1
1 227 . 15 1 1 A 70 70 VAL N N 70 115.790 118.869 -3.079 1
1 228 . 15 1 1 A 71 71 LYS H H 71 7.190 8.285 -1.095 1
1 229 . 15 1 1 A 71 71 LYS HA H 71 3.880 3.872 0.008 1
1 230 . 15 1 1 A 71 71 LYS C C 71 176.100 179.293 -3.193 1
1 231 . 15 1 1 A 71 71 LYS CA C 71 57.680 59.323 -1.643 1
1 232 . 15 1 1 A 71 71 LYS CB C 71 31.930 32.086 -0.156 1
1 233 . 15 1 1 A 71 71 LYS N N 71 117.820 119.767 -1.947 1
1 234 . 15 1 1 A 72 72 LYS H H 72 7.450 7.177 0.273 1
1 235 . 15 1 1 A 72 72 LYS HA H 72 4.180 4.051 0.129 1
1 236 . 15 1 1 A 72 72 LYS C C 72 176.180 179.201 -3.021 1
1 237 . 15 1 1 A 72 72 LYS CA C 72 56.950 58.201 -1.251 1
1 238 . 15 1 1 A 72 72 LYS CB C 72 33.610 31.828 1.782 1
1 239 . 15 1 1 A 72 72 LYS N N 72 116.930 118.124 -1.194 1
1 240 . 15 1 1 A 73 73 ILE H H 73 7.440 7.747 -0.307 1
1 241 . 15 1 1 A 73 73 ILE HA H 73 4.180 3.391 0.789 1
1 242 . 15 1 1 A 73 73 ILE C C 73 174.440 177.835 -3.395 1
1 243 . 15 1 1 A 73 73 ILE CA C 73 61.510 64.555 -3.045 1
1 244 . 15 1 1 A 73 73 ILE CB C 73 38.610 37.467 1.143 1
1 245 . 15 1 1 A 73 73 ILE N N 73 114.560 121.499 -6.939 1
1 246 . 15 1 1 A 74 74 SER H H 74 7.790 8.967 -1.177 1
1 247 . 15 1 1 A 74 74 SER HA H 74 4.520 4.181 0.339 1
1 248 . 15 1 1 A 74 74 SER C C 74 171.580 176.390 -4.810 1
1 249 . 15 1 1 A 74 74 SER CA C 74 57.960 61.557 -3.597 1
1 250 . 15 1 1 A 74 74 SER CB C 74 63.820 63.129 0.691 1
1 251 . 15 1 1 A 74 74 SER N N 74 117.310 116.351 0.959 1
1 6 . 16 1 1 A 2 2 SER H H 2 9.010 8.809 0.201 1
1 7 . 16 1 1 A 2 2 SER HA H 2 4.680 4.626 0.054 1
1 8 . 16 1 1 A 2 2 SER N N 2 119.390 121.441 -2.051 1
1 9 . 16 1 1 A 3 3 PRO C C 3 177.630 178.895 -1.265 1
1 10 . 16 1 1 A 3 3 PRO CA C 3 65.000 64.724 0.276 1
1 11 . 16 1 1 A 3 3 PRO CB C 3 31.790 32.146 -0.356 1
1 12 . 16 1 1 A 4 4 GLU H H 4 8.600 8.367 0.233 1
1 13 . 16 1 1 A 4 4 GLU HA H 4 3.900 4.108 -0.208 1
1 14 . 16 1 1 A 4 4 GLU C C 4 177.910 179.522 -1.612 1
1 15 . 16 1 1 A 4 4 GLU CB C 4 28.980 29.089 -0.109 1
1 16 . 16 1 1 A 4 4 GLU N N 4 117.750 118.085 -0.335 1
1 17 . 16 1 1 A 5 5 GLU H H 5 7.980 8.129 -0.149 1
1 18 . 16 1 1 A 5 5 GLU HA H 5 4.170 4.050 0.120 1
1 19 . 16 1 1 A 5 5 GLU C C 5 178.290 179.225 -0.935 1
1 20 . 16 1 1 A 5 5 GLU CA C 5 58.140 59.204 -1.064 1
1 21 . 16 1 1 A 5 5 GLU CB C 5 30.450 29.386 1.064 1
1 22 . 16 1 1 A 5 5 GLU N N 5 121.890 120.292 1.598 1
1 23 . 16 1 1 A 6 6 LEU H H 6 8.450 8.102 0.348 1
1 24 . 16 1 1 A 6 6 LEU HA H 6 4.310 4.072 0.238 1
1 25 . 16 1 1 A 6 6 LEU C C 6 176.660 178.843 -2.183 1
1 26 . 16 1 1 A 6 6 LEU CA C 6 57.310 57.837 -0.527 1
1 27 . 16 1 1 A 6 6 LEU CB C 6 42.090 41.772 0.318 1
1 28 . 16 1 1 A 6 6 LEU N N 6 120.250 120.556 -0.306 1
1 29 . 16 1 1 A 7 7 LYS H H 7 8.100 9.016 -0.916 1
1 30 . 16 1 1 A 7 7 LYS HA H 7 3.760 4.074 -0.314 1
1 31 . 16 1 1 A 7 7 LYS C C 7 176.160 179.420 -3.260 1
1 32 . 16 1 1 A 7 7 LYS CA C 7 59.110 59.892 -0.782 1
1 33 . 16 1 1 A 7 7 LYS CB C 7 32.110 32.326 -0.216 1
1 34 . 16 1 1 A 7 7 LYS N N 7 120.960 118.636 2.324 1
1 35 . 16 1 1 A 8 8 GLY H H 8 7.860 8.799 -0.939 1
1 36 . 16 1 1 A 8 8 GLY HA2 H 8 3.970 3.794 0.176 1
1 37 . 16 1 1 A 8 8 GLY HA3 H 8 3.970 3.798 0.172 1
1 38 . 16 1 1 A 8 8 GLY C C 8 175.520 176.297 -0.777 1
1 39 . 16 1 1 A 8 8 GLY CA C 8 46.490 47.450 -0.960 1
1 40 . 16 1 1 A 8 8 GLY N N 8 105.430 107.266 -1.836 1
1 41 . 16 1 1 A 9 9 ILE H H 9 8.130 9.206 -1.076 1
1 42 . 16 1 1 A 9 9 ILE HA H 9 4.140 3.907 0.233 1
1 43 . 16 1 1 A 9 9 ILE C C 9 175.320 178.042 -2.722 1
1 44 . 16 1 1 A 9 9 ILE CA C 9 65.010 64.609 0.401 1
1 45 . 16 1 1 A 9 9 ILE CB C 9 39.040 37.999 1.041 1
1 46 . 16 1 1 A 9 9 ILE N N 9 122.870 122.500 0.370 1
1 47 . 16 1 1 A 10 10 PHE H H 10 8.590 9.483 -0.893 1
1 48 . 16 1 1 A 10 10 PHE HA H 10 4.470 3.994 0.476 1
1 49 . 16 1 1 A 10 10 PHE C C 10 175.010 177.153 -2.143 1
1 50 . 16 1 1 A 10 10 PHE CA C 10 62.470 62.524 -0.054 1
1 51 . 16 1 1 A 10 10 PHE CB C 10 39.670 39.275 0.395 1
1 52 . 16 1 1 A 10 10 PHE N N 10 120.430 120.482 -0.052 1
1 53 . 16 1 1 A 11 11 GLU H H 11 8.600 8.711 -0.111 1
1 54 . 16 1 1 A 11 11 GLU HA H 11 3.750 3.690 0.060 1
1 55 . 16 1 1 A 11 11 GLU C C 11 177.630 178.902 -1.272 1
1 56 . 16 1 1 A 11 11 GLU CA C 11 58.440 59.746 -1.306 1
1 57 . 16 1 1 A 11 11 GLU CB C 11 29.840 29.292 0.548 1
1 58 . 16 1 1 A 11 11 GLU N N 11 115.410 117.949 -2.539 1
1 59 . 16 1 1 A 12 12 LYS H H 12 7.940 8.644 -0.704 1
1 60 . 16 1 1 A 12 12 LYS HA H 12 4.080 3.950 0.130 1
1 61 . 16 1 1 A 12 12 LYS CA C 12 58.440 59.067 -0.627 1
1 62 . 16 1 1 A 12 12 LYS CB C 12 32.720 32.291 0.429 1
1 63 . 16 1 1 A 12 12 LYS N N 12 119.220 120.344 -1.124 1
1 64 . 16 1 1 A 13 13 TYR H H 13 7.740 7.351 0.389 1
1 65 . 16 1 1 A 13 13 TYR HA H 13 4.580 4.343 0.237 1
1 66 . 16 1 1 A 13 13 TYR C C 13 39.870 178.411 -138.541 1
1 67 . 16 1 1 A 13 13 TYR CA C 13 61.280 60.256 1.024 1
1 68 . 16 1 1 A 13 13 TYR CB C 13 175.510 39.274 136.236 1
1 69 . 16 1 1 A 13 13 TYR N N 13 115.320 117.211 -1.891 1
1 70 . 16 1 1 A 14 14 ALA H H 14 9.060 8.604 0.456 1
1 71 . 16 1 1 A 14 14 ALA HA H 14 3.850 3.785 0.065 1
1 72 . 16 1 1 A 14 14 ALA C C 14 177.990 179.855 -1.865 1
1 73 . 16 1 1 A 14 14 ALA CA C 14 54.280 54.747 -0.467 1
1 74 . 16 1 1 A 14 14 ALA CB C 14 18.790 17.685 1.105 1
1 75 . 16 1 1 A 14 14 ALA N N 14 120.140 122.623 -2.483 1
1 76 . 16 1 1 A 15 15 ALA H H 15 7.350 8.355 -1.005 1
1 77 . 16 1 1 A 15 15 ALA HA H 15 4.550 3.992 0.558 1
1 78 . 16 1 1 A 15 15 ALA C C 15 176.270 179.162 -2.892 1
1 79 . 16 1 1 A 15 15 ALA CA C 15 52.280 54.950 -2.670 1
1 80 . 16 1 1 A 15 15 ALA CB C 15 19.670 18.350 1.320 1
1 81 . 16 1 1 A 15 15 ALA N N 15 117.640 120.085 -2.445 1
1 82 . 16 1 1 A 16 16 LYS H H 16 7.690 8.226 -0.536 1
1 83 . 16 1 1 A 16 16 LYS HA H 16 4.200 3.994 0.206 1
1 84 . 16 1 1 A 16 16 LYS C C 16 175.830 177.121 -1.291 1
1 85 . 16 1 1 A 16 16 LYS CA C 16 59.780 59.723 0.057 1
1 86 . 16 1 1 A 16 16 LYS CB C 16 33.300 32.233 1.067 1
1 87 . 16 1 1 A 16 16 LYS N N 16 120.340 117.113 3.227 1
1 88 . 16 1 1 A 17 17 GLU H H 17 10.170 8.280 1.890 1
1 89 . 16 1 1 A 17 17 GLU HA H 17 4.990 4.480 0.510 1
1 90 . 16 1 1 A 17 17 GLU C C 17 174.790 177.019 -2.229 1
1 91 . 16 1 1 A 17 17 GLU CA C 17 53.910 55.327 -1.417 1
1 92 . 16 1 1 A 17 17 GLU N N 17 116.560 118.315 -1.755 1
1 93 . 16 1 1 A 18 18 GLY H H 18 9.100 8.580 0.520 1
1 94 . 16 1 1 A 18 18 GLY N N 18 113.230 111.595 1.635 1
1 95 . 16 1 1 A 19 19 ASP H H 19 7.730 8.356 -0.626 1
1 96 . 16 1 1 A 19 19 ASP N N 19 126.280 121.515 4.765 1
1 97 . 16 1 1 A 21 21 ASN H H 21 9.090 8.160 0.930 1
1 98 . 16 1 1 A 21 21 ASN N N 21 115.850 115.373 0.477 1
1 99 . 16 1 1 A 24 24 SER C C 24 176.120 174.503 1.617 1
1 100 . 16 1 1 A 25 25 LYS H H 25 10.400 8.512 1.888 1
1 101 . 16 1 1 A 25 25 LYS C C 25 177.600 177.821 -0.221 1
1 102 . 16 1 1 A 25 25 LYS N N 25 124.350 124.936 -0.586 1
1 103 . 16 1 1 A 26 26 GLU H H 26 9.250 8.320 0.930 1
1 104 . 16 1 1 A 26 26 GLU N N 26 118.470 117.665 0.805 1
1 105 . 16 1 1 A 27 27 GLU C C 27 178.580 178.558 0.022 1
1 106 . 16 1 1 A 27 27 GLU CA C 27 59.920 58.989 0.931 1
1 107 . 16 1 1 A 28 28 LEU H H 28 10.810 9.051 1.759 1
1 108 . 16 1 1 A 28 28 LEU C C 28 177.280 178.455 -1.175 1
1 109 . 16 1 1 A 28 28 LEU CB C 28 43.570 41.522 2.048 1
1 110 . 16 1 1 A 28 28 LEU N N 28 121.060 121.760 -0.700 1
1 111 . 16 1 1 A 29 29 LYS H H 29 9.680 8.528 1.152 1
1 112 . 16 1 1 A 29 29 LYS HA H 29 4.480 3.931 0.549 1
1 113 . 16 1 1 A 29 29 LYS C C 29 176.670 178.649 -1.979 1
1 114 . 16 1 1 A 29 29 LYS CA C 29 60.770 60.012 0.758 1
1 115 . 16 1 1 A 29 29 LYS CB C 29 32.910 32.465 0.445 1
1 116 . 16 1 1 A 29 29 LYS N N 29 121.140 119.207 1.933 1
1 117 . 16 1 1 A 30 30 LEU H H 30 8.410 7.742 0.668 1
1 118 . 16 1 1 A 30 30 LEU CA C 30 57.730 57.788 -0.058 1
1 119 . 16 1 1 A 30 30 LEU CB C 30 42.570 41.925 0.645 1
1 120 . 16 1 1 A 30 30 LEU N N 30 119.000 119.459 -0.459 1
1 121 . 16 1 1 A 31 31 LEU H H 31 9.010 7.521 1.489 1
1 122 . 16 1 1 A 31 31 LEU HA H 31 2.920 3.625 -0.705 1
1 123 . 16 1 1 A 31 31 LEU C C 31 178.280 178.157 0.123 1
1 124 . 16 1 1 A 31 31 LEU CA C 31 59.030 58.401 0.629 1
1 125 . 16 1 1 A 31 31 LEU N N 31 124.840 119.574 5.266 1
1 126 . 16 1 1 A 32 32 LEU H H 32 9.680 8.884 0.796 1
1 127 . 16 1 1 A 32 32 LEU HA H 32 4.490 4.061 0.429 1
1 128 . 16 1 1 A 32 32 LEU C C 32 177.360 179.698 -2.338 1
1 129 . 16 1 1 A 32 32 LEU CA C 32 58.520 57.267 1.253 1
1 130 . 16 1 1 A 32 32 LEU CB C 32 42.760 41.504 1.256 1
1 131 . 16 1 1 A 32 32 LEU N N 32 120.580 119.041 1.539 1
1 132 . 16 1 1 A 33 33 GLN H H 33 9.140 8.157 0.983 1
1 133 . 16 1 1 A 33 33 GLN HA H 33 4.250 4.133 0.117 1
1 134 . 16 1 1 A 33 33 GLN C C 33 176.050 178.051 -2.001 1
1 135 . 16 1 1 A 33 33 GLN CA C 33 58.600 58.836 -0.236 1
1 136 . 16 1 1 A 33 33 GLN CB C 33 29.730 28.549 1.181 1
1 137 . 16 1 1 A 33 33 GLN N N 33 115.010 119.726 -4.716 1
1 138 . 16 1 1 A 34 34 THR H H 34 8.000 7.981 0.019 1
1 139 . 16 1 1 A 34 34 THR HA H 34 4.390 4.066 0.324 1
1 140 . 16 1 1 A 34 34 THR C C 34 174.130 175.979 -1.849 1
1 141 . 16 1 1 A 34 34 THR CA C 34 65.250 66.157 -0.907 1
1 142 . 16 1 1 A 34 34 THR CB C 34 69.920 69.191 0.729 1
1 143 . 16 1 1 A 34 34 THR N N 34 111.180 114.726 -3.546 1
1 144 . 16 1 1 A 35 35 GLU H H 35 8.810 8.678 0.132 1
1 145 . 16 1 1 A 35 35 GLU HA H 35 4.470 4.098 0.372 1
1 146 . 16 1 1 A 35 35 GLU C C 35 175.430 176.302 -0.872 1
1 147 . 16 1 1 A 35 35 GLU CA C 35 56.170 59.337 -3.167 1
1 148 . 16 1 1 A 35 35 GLU CB C 35 30.900 29.903 0.997 1
1 149 . 16 1 1 A 35 35 GLU N N 35 116.410 121.655 -5.245 1
1 150 . 16 1 1 A 36 36 PHE H H 36 8.230 8.044 0.186 1
1 151 . 16 1 1 A 36 36 PHE HA H 36 5.500 5.084 0.416 1
1 152 . 16 1 1 A 36 36 PHE N N 36 115.090 115.837 -0.747 1
1 153 . 16 1 1 A 37 37 PRO C C 37 178.140 178.309 -0.169 1
1 154 . 16 1 1 A 37 37 PRO CA C 37 64.940 64.720 0.220 1
1 155 . 16 1 1 A 37 37 PRO CB C 37 31.600 32.033 -0.433 1
1 156 . 16 1 1 A 38 38 SER H H 38 8.660 8.596 0.064 1
1 157 . 16 1 1 A 38 38 SER HA H 38 4.500 4.268 0.232 1
1 158 . 16 1 1 A 38 38 SER C C 38 174.830 177.105 -2.275 1
1 159 . 16 1 1 A 38 38 SER CA C 38 59.970 61.355 -1.385 1
1 160 . 16 1 1 A 38 38 SER CB C 38 62.690 62.808 -0.118 1
1 161 . 16 1 1 A 38 38 SER N N 38 114.030 114.405 -0.375 1
1 162 . 16 1 1 A 39 39 LEU H H 39 8.260 8.160 0.100 1
1 163 . 16 1 1 A 39 39 LEU HA H 39 4.520 4.113 0.407 1
1 164 . 16 1 1 A 39 39 LEU C C 39 176.780 180.030 -3.250 1
1 165 . 16 1 1 A 39 39 LEU CA C 39 56.600 57.384 -0.784 1
1 166 . 16 1 1 A 39 39 LEU CB C 39 42.610 41.531 1.079 1
1 167 . 16 1 1 A 39 39 LEU N N 39 122.650 122.008 0.642 1
1 168 . 16 1 1 A 40 40 LEU H H 40 8.070 8.178 -0.108 1
1 169 . 16 1 1 A 40 40 LEU HA H 40 4.830 4.039 0.791 1
1 170 . 16 1 1 A 40 40 LEU C C 40 175.690 179.487 -3.797 1
1 171 . 16 1 1 A 40 40 LEU CA C 40 54.510 57.933 -3.423 1
1 172 . 16 1 1 A 40 40 LEU CB C 40 42.020 41.283 0.737 1
1 173 . 16 1 1 A 40 40 LEU N N 40 117.390 119.536 -2.146 1
1 174 . 16 1 1 A 41 41 LYS H H 41 7.770 8.084 -0.314 1
1 175 . 16 1 1 A 41 41 LYS HA H 41 4.610 4.119 0.491 1
1 176 . 16 1 1 A 41 41 LYS C C 41 175.380 177.466 -2.086 1
1 177 . 16 1 1 A 41 41 LYS CA C 41 56.170 58.709 -2.539 1
1 178 . 16 1 1 A 41 41 LYS CB C 41 32.950 31.747 1.203 1
1 179 . 16 1 1 A 41 41 LYS N N 41 120.530 117.783 2.747 1
1 180 . 16 1 1 A 42 42 GLY H H 42 8.390 7.955 0.435 1
1 181 . 16 1 1 A 42 42 GLY HA2 H 42 4.280 4.090 0.190 1
1 182 . 16 1 1 A 42 42 GLY HA3 H 42 4.280 4.092 0.188 1
1 183 . 16 1 1 A 42 42 GLY C C 42 177.190 174.860 2.330 1
1 184 . 16 1 1 A 42 42 GLY N N 42 109.280 108.341 0.939 1
1 185 . 16 1 1 A 43 43 MET H H 43 9.020 8.566 0.454 1
1 186 . 16 1 1 A 43 43 MET C C 43 175.520 176.190 -0.670 1
1 187 . 16 1 1 A 43 43 MET N N 43 121.110 119.049 2.061 1
1 188 . 16 1 1 A 44 44 SER H H 44 8.700 7.887 0.813 1
1 189 . 16 1 1 A 44 44 SER C C 44 173.540 174.128 -0.588 1
1 190 . 16 1 1 A 44 44 SER N N 44 116.190 115.826 0.364 1
1 191 . 16 1 1 A 45 45 THR H H 45 8.440 8.687 -0.247 1
1 192 . 16 1 1 A 45 45 THR C C 45 174.300 175.337 -1.037 1
1 193 . 16 1 1 A 45 45 THR N N 45 113.740 119.372 -5.632 1
1 194 . 16 1 1 A 46 46 LEU H H 46 9.380 8.824 0.556 1
1 195 . 16 1 1 A 46 46 LEU C C 46 177.760 178.168 -0.408 1
1 196 . 16 1 1 A 46 46 LEU N N 46 123.970 123.532 0.438 1
1 197 . 16 1 1 A 47 47 ASP H H 47 8.990 8.534 0.456 1
1 198 . 16 1 1 A 47 47 ASP N N 47 118.620 118.080 0.540 1
1 199 . 16 1 1 A 49 49 LEU H H 49 9.740 8.559 1.181 1
1 200 . 16 1 1 A 49 49 LEU N N 49 123.880 120.808 3.072 1
1 201 . 16 1 1 A 50 50 PHE H H 50 10.730 8.813 1.917 1
1 202 . 16 1 1 A 50 50 PHE N N 50 121.380 119.342 2.038 1
1 203 . 16 1 1 A 51 51 GLU H H 51 7.860 8.368 -0.508 1
1 204 . 16 1 1 A 51 51 GLU HA H 51 3.530 3.825 -0.295 1
1 205 . 16 1 1 A 51 51 GLU N N 51 114.870 119.311 -4.441 1
1 206 . 16 1 1 A 66 66 PHE CA C 66 58.850 61.297 -2.447 1
1 207 . 16 1 1 A 67 67 GLN H H 67 5.670 8.289 -2.619 1
1 208 . 16 1 1 A 67 67 GLN C C 67 174.810 178.033 -3.223 1
1 209 . 16 1 1 A 67 67 GLN CA C 67 56.340 58.189 -1.849 1
1 210 . 16 1 1 A 67 67 GLN N N 67 114.050 117.448 -3.398 1
1 211 . 16 1 1 A 68 68 VAL H H 68 5.760 7.385 -1.625 1
1 212 . 16 1 1 A 68 68 VAL C C 68 175.770 178.502 -2.732 1
1 213 . 16 1 1 A 68 68 VAL CA C 68 63.990 65.907 -1.917 1
1 214 . 16 1 1 A 68 68 VAL CB C 68 31.310 31.407 -0.097 1
1 215 . 16 1 1 A 68 68 VAL N N 68 116.280 119.682 -3.402 1
1 216 . 16 1 1 A 69 69 LEU H H 69 7.150 8.485 -1.335 1
1 217 . 16 1 1 A 69 69 LEU HA H 69 4.040 4.019 0.021 1
1 218 . 16 1 1 A 69 69 LEU C C 69 176.210 178.264 -2.054 1
1 219 . 16 1 1 A 69 69 LEU CA C 69 56.270 57.364 -1.094 1
1 220 . 16 1 1 A 69 69 LEU CB C 69 42.010 41.777 0.233 1
1 221 . 16 1 1 A 69 69 LEU N N 69 120.350 121.125 -0.775 1
1 222 . 16 1 1 A 70 70 VAL H H 70 6.810 7.289 -0.479 1
1 223 . 16 1 1 A 70 70 VAL HA H 70 3.170 3.216 -0.046 1
1 224 . 16 1 1 A 70 70 VAL C C 70 175.760 177.509 -1.749 1
1 225 . 16 1 1 A 70 70 VAL CA C 70 65.110 66.766 -1.656 1
1 226 . 16 1 1 A 70 70 VAL CB C 70 31.190 31.119 0.071 1
1 227 . 16 1 1 A 70 70 VAL N N 70 115.790 118.869 -3.079 1
1 228 . 16 1 1 A 71 71 LYS H H 71 7.190 8.285 -1.095 1
1 229 . 16 1 1 A 71 71 LYS HA H 71 3.880 3.872 0.008 1
1 230 . 16 1 1 A 71 71 LYS C C 71 176.100 179.293 -3.193 1
1 231 . 16 1 1 A 71 71 LYS CA C 71 57.680 59.323 -1.643 1
1 232 . 16 1 1 A 71 71 LYS CB C 71 31.930 32.086 -0.156 1
1 233 . 16 1 1 A 71 71 LYS N N 71 117.820 119.767 -1.947 1
1 234 . 16 1 1 A 72 72 LYS H H 72 7.450 7.177 0.273 1
1 235 . 16 1 1 A 72 72 LYS HA H 72 4.180 4.051 0.129 1
1 236 . 16 1 1 A 72 72 LYS C C 72 176.180 179.201 -3.021 1
1 237 . 16 1 1 A 72 72 LYS CA C 72 56.950 58.201 -1.251 1
1 238 . 16 1 1 A 72 72 LYS CB C 72 33.610 31.828 1.782 1
1 239 . 16 1 1 A 72 72 LYS N N 72 116.930 118.124 -1.194 1
1 240 . 16 1 1 A 73 73 ILE H H 73 7.440 7.747 -0.307 1
1 241 . 16 1 1 A 73 73 ILE HA H 73 4.180 3.391 0.789 1
1 242 . 16 1 1 A 73 73 ILE C C 73 174.440 177.835 -3.395 1
1 243 . 16 1 1 A 73 73 ILE CA C 73 61.510 64.555 -3.045 1
1 244 . 16 1 1 A 73 73 ILE CB C 73 38.610 37.467 1.143 1
1 245 . 16 1 1 A 73 73 ILE N N 73 114.560 121.499 -6.939 1
1 246 . 16 1 1 A 74 74 SER H H 74 7.790 8.967 -1.177 1
1 247 . 16 1 1 A 74 74 SER HA H 74 4.520 4.181 0.339 1
1 248 . 16 1 1 A 74 74 SER C C 74 171.580 176.390 -4.810 1
1 249 . 16 1 1 A 74 74 SER CA C 74 57.960 61.557 -3.597 1
1 250 . 16 1 1 A 74 74 SER CB C 74 63.820 63.129 0.691 1
1 251 . 16 1 1 A 74 74 SER N N 74 117.310 116.351 0.959 1
1 6 . 17 1 1 A 2 2 SER H H 2 9.010 8.254 0.756 1
1 7 . 17 1 1 A 2 2 SER HA H 2 4.680 4.565 0.115 1
1 8 . 17 1 1 A 2 2 SER N N 2 119.390 116.445 2.945 1
1 9 . 17 1 1 A 3 3 PRO C C 3 177.630 178.811 -1.181 1
1 10 . 17 1 1 A 3 3 PRO CA C 3 65.000 64.993 0.007 1
1 11 . 17 1 1 A 3 3 PRO CB C 3 31.790 32.143 -0.353 1
1 12 . 17 1 1 A 4 4 GLU H H 4 8.600 8.412 0.188 1
1 13 . 17 1 1 A 4 4 GLU HA H 4 3.900 4.053 -0.153 1
1 14 . 17 1 1 A 4 4 GLU C C 4 177.910 179.354 -1.444 1
1 15 . 17 1 1 A 4 4 GLU CB C 4 28.980 29.064 -0.084 1
1 16 . 17 1 1 A 4 4 GLU N N 4 117.750 117.787 -0.037 1
1 17 . 17 1 1 A 5 5 GLU H H 5 7.980 8.096 -0.116 1
1 18 . 17 1 1 A 5 5 GLU HA H 5 4.170 4.059 0.111 1
1 19 . 17 1 1 A 5 5 GLU C C 5 178.290 179.094 -0.804 1
1 20 . 17 1 1 A 5 5 GLU CA C 5 58.140 59.210 -1.070 1
1 21 . 17 1 1 A 5 5 GLU CB C 5 30.450 29.250 1.200 1
1 22 . 17 1 1 A 5 5 GLU N N 5 121.890 120.170 1.720 1
1 23 . 17 1 1 A 6 6 LEU H H 6 8.450 8.054 0.396 1
1 24 . 17 1 1 A 6 6 LEU HA H 6 4.310 3.953 0.357 1
1 25 . 17 1 1 A 6 6 LEU C C 6 176.660 178.800 -2.140 1
1 26 . 17 1 1 A 6 6 LEU CA C 6 57.310 57.686 -0.376 1
1 27 . 17 1 1 A 6 6 LEU CB C 6 42.090 41.818 0.272 1
1 28 . 17 1 1 A 6 6 LEU N N 6 120.250 120.474 -0.224 1
1 29 . 17 1 1 A 7 7 LYS H H 7 8.100 8.957 -0.857 1
1 30 . 17 1 1 A 7 7 LYS HA H 7 3.760 3.928 -0.168 1
1 31 . 17 1 1 A 7 7 LYS C C 7 176.160 179.485 -3.325 1
1 32 . 17 1 1 A 7 7 LYS CA C 7 59.110 59.861 -0.751 1
1 33 . 17 1 1 A 7 7 LYS CB C 7 32.110 32.082 0.028 1
1 34 . 17 1 1 A 7 7 LYS N N 7 120.960 118.136 2.824 1
1 35 . 17 1 1 A 8 8 GLY H H 8 7.860 8.986 -1.126 1
1 36 . 17 1 1 A 8 8 GLY HA2 H 8 3.970 3.783 0.187 1
1 37 . 17 1 1 A 8 8 GLY HA3 H 8 3.970 3.792 0.178 1
1 38 . 17 1 1 A 8 8 GLY C C 8 175.520 176.281 -0.761 1
1 39 . 17 1 1 A 8 8 GLY CA C 8 46.490 47.363 -0.873 1
1 40 . 17 1 1 A 8 8 GLY N N 8 105.430 107.159 -1.729 1
1 41 . 17 1 1 A 9 9 ILE H H 9 8.130 8.672 -0.542 1
1 42 . 17 1 1 A 9 9 ILE HA H 9 4.140 3.870 0.270 1
1 43 . 17 1 1 A 9 9 ILE C C 9 175.320 177.859 -2.539 1
1 44 . 17 1 1 A 9 9 ILE CA C 9 65.010 64.657 0.353 1
1 45 . 17 1 1 A 9 9 ILE CB C 9 39.040 37.875 1.165 1
1 46 . 17 1 1 A 9 9 ILE N N 9 122.870 122.551 0.319 1
1 47 . 17 1 1 A 10 10 PHE H H 10 8.590 8.590 0.000 1
1 48 . 17 1 1 A 10 10 PHE HA H 10 4.470 3.787 0.683 1
1 49 . 17 1 1 A 10 10 PHE C C 10 175.010 177.232 -2.222 1
1 50 . 17 1 1 A 10 10 PHE CA C 10 62.470 62.318 0.152 1
1 51 . 17 1 1 A 10 10 PHE CB C 10 39.670 39.129 0.541 1
1 52 . 17 1 1 A 10 10 PHE N N 10 120.430 120.449 -0.019 1
1 53 . 17 1 1 A 11 11 GLU H H 11 8.600 8.823 -0.223 1
1 54 . 17 1 1 A 11 11 GLU HA H 11 3.750 3.769 -0.019 1
1 55 . 17 1 1 A 11 11 GLU C C 11 177.630 178.862 -1.232 1
1 56 . 17 1 1 A 11 11 GLU CA C 11 58.440 59.724 -1.284 1
1 57 . 17 1 1 A 11 11 GLU CB C 11 29.840 28.935 0.905 1
1 58 . 17 1 1 A 11 11 GLU N N 11 115.410 117.990 -2.580 1
1 59 . 17 1 1 A 12 12 LYS H H 12 7.940 8.860 -0.920 1
1 60 . 17 1 1 A 12 12 LYS HA H 12 4.080 4.030 0.050 1
1 61 . 17 1 1 A 12 12 LYS CA C 12 58.440 59.074 -0.634 1
1 62 . 17 1 1 A 12 12 LYS CB C 12 32.720 32.414 0.306 1
1 63 . 17 1 1 A 12 12 LYS N N 12 119.220 119.918 -0.698 1
1 64 . 17 1 1 A 13 13 TYR H H 13 7.740 7.450 0.290 1
1 65 . 17 1 1 A 13 13 TYR HA H 13 4.580 4.366 0.214 1
1 66 . 17 1 1 A 13 13 TYR C C 13 39.870 178.349 -138.479 1
1 67 . 17 1 1 A 13 13 TYR CA C 13 61.280 60.293 0.987 1
1 68 . 17 1 1 A 13 13 TYR CB C 13 175.510 39.280 136.230 1
1 69 . 17 1 1 A 13 13 TYR N N 13 115.320 117.449 -2.129 1
1 70 . 17 1 1 A 14 14 ALA H H 14 9.060 8.803 0.257 1
1 71 . 17 1 1 A 14 14 ALA HA H 14 3.850 3.889 -0.039 1
1 72 . 17 1 1 A 14 14 ALA C C 14 177.990 179.745 -1.755 1
1 73 . 17 1 1 A 14 14 ALA CA C 14 54.280 54.767 -0.487 1
1 74 . 17 1 1 A 14 14 ALA CB C 14 18.790 17.792 0.998 1
1 75 . 17 1 1 A 14 14 ALA N N 14 120.140 122.650 -2.510 1
1 76 . 17 1 1 A 15 15 ALA H H 15 7.350 8.325 -0.975 1
1 77 . 17 1 1 A 15 15 ALA HA H 15 4.550 4.019 0.531 1
1 78 . 17 1 1 A 15 15 ALA C C 15 176.270 179.247 -2.977 1
1 79 . 17 1 1 A 15 15 ALA CA C 15 52.280 54.985 -2.705 1
1 80 . 17 1 1 A 15 15 ALA CB C 15 19.670 18.434 1.236 1
1 81 . 17 1 1 A 15 15 ALA N N 15 117.640 119.839 -2.199 1
1 82 . 17 1 1 A 16 16 LYS H H 16 7.690 7.951 -0.261 1
1 83 . 17 1 1 A 16 16 LYS HA H 16 4.200 4.025 0.175 1
1 84 . 17 1 1 A 16 16 LYS C C 16 175.830 177.137 -1.307 1
1 85 . 17 1 1 A 16 16 LYS CA C 16 59.780 59.446 0.334 1
1 86 . 17 1 1 A 16 16 LYS CB C 16 33.300 32.404 0.896 1
1 87 . 17 1 1 A 16 16 LYS N N 16 120.340 117.094 3.246 1
1 88 . 17 1 1 A 17 17 GLU H H 17 10.170 7.789 2.381 1
1 89 . 17 1 1 A 17 17 GLU HA H 17 4.990 4.468 0.522 1
1 90 . 17 1 1 A 17 17 GLU C C 17 174.790 176.933 -2.143 1
1 91 . 17 1 1 A 17 17 GLU CA C 17 53.910 55.298 -1.388 1
1 92 . 17 1 1 A 17 17 GLU N N 17 116.560 118.272 -1.712 1
1 93 . 17 1 1 A 18 18 GLY H H 18 9.100 8.532 0.568 1
1 94 . 17 1 1 A 18 18 GLY N N 18 113.230 111.271 1.959 1
1 95 . 17 1 1 A 19 19 ASP H H 19 7.730 8.603 -0.873 1
1 96 . 17 1 1 A 19 19 ASP N N 19 126.280 121.336 4.944 1
1 97 . 17 1 1 A 21 21 ASN H H 21 9.090 8.175 0.915 1
1 98 . 17 1 1 A 21 21 ASN N N 21 115.850 115.388 0.462 1
1 99 . 17 1 1 A 24 24 SER C C 24 176.120 174.599 1.521 1
1 100 . 17 1 1 A 25 25 LYS H H 25 10.400 8.664 1.736 1
1 101 . 17 1 1 A 25 25 LYS C C 25 177.600 177.917 -0.317 1
1 102 . 17 1 1 A 25 25 LYS N N 25 124.350 125.073 -0.723 1
1 103 . 17 1 1 A 26 26 GLU H H 26 9.250 8.305 0.945 1
1 104 . 17 1 1 A 26 26 GLU N N 26 118.470 117.700 0.770 1
1 105 . 17 1 1 A 27 27 GLU C C 27 178.580 178.742 -0.162 1
1 106 . 17 1 1 A 27 27 GLU CA C 27 59.920 59.155 0.765 1
1 107 . 17 1 1 A 28 28 LEU H H 28 10.810 9.319 1.491 1
1 108 . 17 1 1 A 28 28 LEU C C 28 177.280 178.578 -1.298 1
1 109 . 17 1 1 A 28 28 LEU CB C 28 43.570 41.582 1.988 1
1 110 . 17 1 1 A 28 28 LEU N N 28 121.060 121.892 -0.832 1
1 111 . 17 1 1 A 29 29 LYS H H 29 9.680 8.657 1.023 1
1 112 . 17 1 1 A 29 29 LYS HA H 29 4.480 3.989 0.491 1
1 113 . 17 1 1 A 29 29 LYS C C 29 176.670 178.740 -2.070 1
1 114 . 17 1 1 A 29 29 LYS CA C 29 60.770 60.084 0.686 1
1 115 . 17 1 1 A 29 29 LYS CB C 29 32.910 32.495 0.415 1
1 116 . 17 1 1 A 29 29 LYS N N 29 121.140 119.305 1.835 1
1 117 . 17 1 1 A 30 30 LEU H H 30 8.410 7.894 0.516 1
1 118 . 17 1 1 A 30 30 LEU CA C 30 57.730 57.942 -0.212 1
1 119 . 17 1 1 A 30 30 LEU CB C 30 42.570 42.042 0.528 1
1 120 . 17 1 1 A 30 30 LEU N N 30 119.000 119.584 -0.584 1
1 121 . 17 1 1 A 31 31 LEU H H 31 9.010 8.023 0.987 1
1 122 . 17 1 1 A 31 31 LEU HA H 31 2.920 3.637 -0.717 1
1 123 . 17 1 1 A 31 31 LEU C C 31 178.280 178.224 0.056 1
1 124 . 17 1 1 A 31 31 LEU CA C 31 59.030 58.523 0.507 1
1 125 . 17 1 1 A 31 31 LEU N N 31 124.840 119.929 4.911 1
1 126 . 17 1 1 A 32 32 LEU H H 32 9.680 8.934 0.746 1
1 127 . 17 1 1 A 32 32 LEU HA H 32 4.490 4.082 0.408 1
1 128 . 17 1 1 A 32 32 LEU C C 32 177.360 179.826 -2.466 1
1 129 . 17 1 1 A 32 32 LEU CA C 32 58.520 57.297 1.223 1
1 130 . 17 1 1 A 32 32 LEU CB C 32 42.760 41.542 1.218 1
1 131 . 17 1 1 A 32 32 LEU N N 32 120.580 119.086 1.494 1
1 132 . 17 1 1 A 33 33 GLN H H 33 9.140 8.190 0.950 1
1 133 . 17 1 1 A 33 33 GLN HA H 33 4.250 4.158 0.092 1
1 134 . 17 1 1 A 33 33 GLN C C 33 176.050 178.198 -2.148 1
1 135 . 17 1 1 A 33 33 GLN CA C 33 58.600 58.814 -0.214 1
1 136 . 17 1 1 A 33 33 GLN CB C 33 29.730 28.625 1.105 1
1 137 . 17 1 1 A 33 33 GLN N N 33 115.010 119.763 -4.753 1
1 138 . 17 1 1 A 34 34 THR H H 34 8.000 7.941 0.059 1
1 139 . 17 1 1 A 34 34 THR HA H 34 4.390 4.069 0.321 1
1 140 . 17 1 1 A 34 34 THR C C 34 174.130 175.957 -1.827 1
1 141 . 17 1 1 A 34 34 THR CA C 34 65.250 66.148 -0.898 1
1 142 . 17 1 1 A 34 34 THR CB C 34 69.920 69.126 0.794 1
1 143 . 17 1 1 A 34 34 THR N N 34 111.180 114.882 -3.702 1
1 144 . 17 1 1 A 35 35 GLU H H 35 8.810 8.640 0.170 1
1 145 . 17 1 1 A 35 35 GLU HA H 35 4.470 3.931 0.539 1
1 146 . 17 1 1 A 35 35 GLU C C 35 175.430 176.179 -0.749 1
1 147 . 17 1 1 A 35 35 GLU CA C 35 56.170 59.196 -3.026 1
1 148 . 17 1 1 A 35 35 GLU CB C 35 30.900 29.736 1.164 1
1 149 . 17 1 1 A 35 35 GLU N N 35 116.410 121.693 -5.283 1
1 150 . 17 1 1 A 36 36 PHE H H 36 8.230 8.016 0.214 1
1 151 . 17 1 1 A 36 36 PHE HA H 36 5.500 5.097 0.403 1
1 152 . 17 1 1 A 36 36 PHE N N 36 115.090 115.719 -0.629 1
1 153 . 17 1 1 A 37 37 PRO C C 37 178.140 177.888 0.252 1
1 154 . 17 1 1 A 37 37 PRO CA C 37 64.940 64.578 0.362 1
1 155 . 17 1 1 A 37 37 PRO CB C 37 31.600 31.882 -0.282 1
1 156 . 17 1 1 A 38 38 SER H H 38 8.660 8.355 0.305 1
1 157 . 17 1 1 A 38 38 SER HA H 38 4.500 4.265 0.235 1
1 158 . 17 1 1 A 38 38 SER C C 38 174.830 177.257 -2.427 1
1 159 . 17 1 1 A 38 38 SER CA C 38 59.970 61.402 -1.432 1
1 160 . 17 1 1 A 38 38 SER CB C 38 62.690 62.649 0.041 1
1 161 . 17 1 1 A 38 38 SER N N 38 114.030 112.746 1.284 1
1 162 . 17 1 1 A 39 39 LEU H H 39 8.260 8.140 0.120 1
1 163 . 17 1 1 A 39 39 LEU HA H 39 4.520 4.136 0.384 1
1 164 . 17 1 1 A 39 39 LEU C C 39 176.780 179.654 -2.874 1
1 165 . 17 1 1 A 39 39 LEU CA C 39 56.600 57.196 -0.596 1
1 166 . 17 1 1 A 39 39 LEU CB C 39 42.610 41.494 1.116 1
1 167 . 17 1 1 A 39 39 LEU N N 39 122.650 124.324 -1.674 1
1 168 . 17 1 1 A 40 40 LEU H H 40 8.070 7.904 0.166 1
1 169 . 17 1 1 A 40 40 LEU HA H 40 4.830 4.100 0.730 1
1 170 . 17 1 1 A 40 40 LEU C C 40 175.690 179.812 -4.122 1
1 171 . 17 1 1 A 40 40 LEU CA C 40 54.510 57.951 -3.441 1
1 172 . 17 1 1 A 40 40 LEU CB C 40 42.020 41.205 0.815 1
1 173 . 17 1 1 A 40 40 LEU N N 40 117.390 118.621 -1.231 1
1 174 . 17 1 1 A 41 41 LYS H H 41 7.770 8.050 -0.280 1
1 175 . 17 1 1 A 41 41 LYS HA H 41 4.610 4.095 0.515 1
1 176 . 17 1 1 A 41 41 LYS C C 41 175.380 177.427 -2.047 1
1 177 . 17 1 1 A 41 41 LYS CA C 41 56.170 58.676 -2.506 1
1 178 . 17 1 1 A 41 41 LYS CB C 41 32.950 31.802 1.148 1
1 179 . 17 1 1 A 41 41 LYS N N 41 120.530 117.761 2.769 1
1 180 . 17 1 1 A 42 42 GLY H H 42 8.390 8.094 0.296 1
1 181 . 17 1 1 A 42 42 GLY HA2 H 42 4.280 4.064 0.216 1
1 182 . 17 1 1 A 42 42 GLY HA3 H 42 4.280 4.064 0.216 1
1 183 . 17 1 1 A 42 42 GLY C C 42 177.190 174.867 2.323 1
1 184 . 17 1 1 A 42 42 GLY N N 42 109.280 108.469 0.811 1
1 185 . 17 1 1 A 43 43 MET H H 43 9.020 8.566 0.454 1
1 186 . 17 1 1 A 43 43 MET C C 43 175.520 176.265 -0.745 1
1 187 . 17 1 1 A 43 43 MET N N 43 121.110 118.995 2.115 1
1 188 . 17 1 1 A 44 44 SER H H 44 8.700 7.882 0.818 1
1 189 . 17 1 1 A 44 44 SER C C 44 173.540 174.134 -0.594 1
1 190 . 17 1 1 A 44 44 SER N N 44 116.190 115.585 0.605 1
1 191 . 17 1 1 A 45 45 THR H H 45 8.440 8.694 -0.254 1
1 192 . 17 1 1 A 45 45 THR C C 45 174.300 175.298 -0.998 1
1 193 . 17 1 1 A 45 45 THR N N 45 113.740 119.384 -5.644 1
1 194 . 17 1 1 A 46 46 LEU H H 46 9.380 8.827 0.553 1
1 195 . 17 1 1 A 46 46 LEU C C 46 177.760 178.108 -0.348 1
1 196 . 17 1 1 A 46 46 LEU N N 46 123.970 123.486 0.484 1
1 197 . 17 1 1 A 47 47 ASP H H 47 8.990 8.438 0.552 1
1 198 . 17 1 1 A 47 47 ASP N N 47 118.620 118.395 0.225 1
1 199 . 17 1 1 A 49 49 LEU H H 49 9.740 8.973 0.767 1
1 200 . 17 1 1 A 49 49 LEU N N 49 123.880 120.633 3.247 1
1 201 . 17 1 1 A 50 50 PHE H H 50 10.730 9.165 1.565 1
1 202 . 17 1 1 A 50 50 PHE N N 50 121.380 119.601 1.779 1
1 203 . 17 1 1 A 51 51 GLU H H 51 7.860 8.497 -0.637 1
1 204 . 17 1 1 A 51 51 GLU HA H 51 3.530 3.854 -0.324 1
1 205 . 17 1 1 A 51 51 GLU N N 51 114.870 118.559 -3.689 1
1 206 . 17 1 1 A 66 66 PHE CA C 66 58.850 61.172 -2.322 1
1 207 . 17 1 1 A 67 67 GLN H H 67 5.670 8.876 -3.206 1
1 208 . 17 1 1 A 67 67 GLN C C 67 174.810 177.991 -3.181 1
1 209 . 17 1 1 A 67 67 GLN CA C 67 56.340 58.172 -1.832 1
1 210 . 17 1 1 A 67 67 GLN N N 67 114.050 117.239 -3.189 1
1 211 . 17 1 1 A 68 68 VAL H H 68 5.760 7.317 -1.557 1
1 212 . 17 1 1 A 68 68 VAL C C 68 175.770 178.528 -2.758 1
1 213 . 17 1 1 A 68 68 VAL CA C 68 63.990 65.889 -1.899 1
1 214 . 17 1 1 A 68 68 VAL CB C 68 31.310 31.451 -0.141 1
1 215 . 17 1 1 A 68 68 VAL N N 68 116.280 119.822 -3.542 1
1 216 . 17 1 1 A 69 69 LEU H H 69 7.150 8.260 -1.110 1
1 217 . 17 1 1 A 69 69 LEU HA H 69 4.040 4.027 0.013 1
1 218 . 17 1 1 A 69 69 LEU C C 69 176.210 178.591 -2.381 1
1 219 . 17 1 1 A 69 69 LEU CA C 69 56.270 57.404 -1.134 1
1 220 . 17 1 1 A 69 69 LEU CB C 69 42.010 42.008 0.002 1
1 221 . 17 1 1 A 69 69 LEU N N 69 120.350 121.078 -0.728 1
1 222 . 17 1 1 A 70 70 VAL H H 70 6.810 7.645 -0.835 1
1 223 . 17 1 1 A 70 70 VAL HA H 70 3.170 3.253 -0.083 1
1 224 . 17 1 1 A 70 70 VAL C C 70 175.760 177.672 -1.912 1
1 225 . 17 1 1 A 70 70 VAL CA C 70 65.110 66.510 -1.400 1
1 226 . 17 1 1 A 70 70 VAL CB C 70 31.190 31.077 0.113 1
1 227 . 17 1 1 A 70 70 VAL N N 70 115.790 118.747 -2.957 1
1 228 . 17 1 1 A 71 71 LYS H H 71 7.190 8.005 -0.815 1
1 229 . 17 1 1 A 71 71 LYS HA H 71 3.880 3.893 -0.013 1
1 230 . 17 1 1 A 71 71 LYS C C 71 176.100 179.256 -3.156 1
1 231 . 17 1 1 A 71 71 LYS CA C 71 57.680 59.400 -1.720 1
1 232 . 17 1 1 A 71 71 LYS CB C 71 31.930 32.160 -0.230 1
1 233 . 17 1 1 A 71 71 LYS N N 71 117.820 119.473 -1.653 1
1 234 . 17 1 1 A 72 72 LYS H H 72 7.450 7.399 0.051 1
1 235 . 17 1 1 A 72 72 LYS HA H 72 4.180 4.059 0.121 1
1 236 . 17 1 1 A 72 72 LYS C C 72 176.180 179.217 -3.037 1
1 237 . 17 1 1 A 72 72 LYS CA C 72 56.950 58.208 -1.258 1
1 238 . 17 1 1 A 72 72 LYS CB C 72 33.610 31.838 1.772 1
1 239 . 17 1 1 A 72 72 LYS N N 72 116.930 118.154 -1.224 1
1 240 . 17 1 1 A 73 73 ILE H H 73 7.440 7.857 -0.417 1
1 241 . 17 1 1 A 73 73 ILE HA H 73 4.180 3.557 0.623 1
1 242 . 17 1 1 A 73 73 ILE C C 73 174.440 178.015 -3.575 1
1 243 . 17 1 1 A 73 73 ILE CA C 73 61.510 64.524 -3.014 1
1 244 . 17 1 1 A 73 73 ILE CB C 73 38.610 37.471 1.139 1
1 245 . 17 1 1 A 73 73 ILE N N 73 114.560 121.529 -6.969 1
1 246 . 17 1 1 A 74 74 SER H H 74 7.790 8.985 -1.195 1
1 247 . 17 1 1 A 74 74 SER HA H 74 4.520 4.199 0.321 1
1 248 . 17 1 1 A 74 74 SER C C 74 171.580 176.349 -4.769 1
1 249 . 17 1 1 A 74 74 SER CA C 74 57.960 61.540 -3.580 1
1 250 . 17 1 1 A 74 74 SER CB C 74 63.820 63.091 0.729 1
1 251 . 17 1 1 A 74 74 SER N N 74 117.310 116.590 0.720 1
1 6 . 18 1 1 A 2 2 SER H H 2 9.010 8.254 0.756 1
1 7 . 18 1 1 A 2 2 SER HA H 2 4.680 4.565 0.115 1
1 8 . 18 1 1 A 2 2 SER N N 2 119.390 116.445 2.945 1
1 9 . 18 1 1 A 3 3 PRO C C 3 177.630 178.811 -1.181 1
1 10 . 18 1 1 A 3 3 PRO CA C 3 65.000 64.993 0.007 1
1 11 . 18 1 1 A 3 3 PRO CB C 3 31.790 32.143 -0.353 1
1 12 . 18 1 1 A 4 4 GLU H H 4 8.600 8.412 0.188 1
1 13 . 18 1 1 A 4 4 GLU HA H 4 3.900 4.053 -0.153 1
1 14 . 18 1 1 A 4 4 GLU C C 4 177.910 179.354 -1.444 1
1 15 . 18 1 1 A 4 4 GLU CB C 4 28.980 29.064 -0.084 1
1 16 . 18 1 1 A 4 4 GLU N N 4 117.750 117.787 -0.037 1
1 17 . 18 1 1 A 5 5 GLU H H 5 7.980 8.096 -0.116 1
1 18 . 18 1 1 A 5 5 GLU HA H 5 4.170 4.059 0.111 1
1 19 . 18 1 1 A 5 5 GLU C C 5 178.290 179.094 -0.804 1
1 20 . 18 1 1 A 5 5 GLU CA C 5 58.140 59.210 -1.070 1
1 21 . 18 1 1 A 5 5 GLU CB C 5 30.450 29.250 1.200 1
1 22 . 18 1 1 A 5 5 GLU N N 5 121.890 120.170 1.720 1
1 23 . 18 1 1 A 6 6 LEU H H 6 8.450 8.054 0.396 1
1 24 . 18 1 1 A 6 6 LEU HA H 6 4.310 3.953 0.357 1
1 25 . 18 1 1 A 6 6 LEU C C 6 176.660 178.800 -2.140 1
1 26 . 18 1 1 A 6 6 LEU CA C 6 57.310 57.686 -0.376 1
1 27 . 18 1 1 A 6 6 LEU CB C 6 42.090 41.818 0.272 1
1 28 . 18 1 1 A 6 6 LEU N N 6 120.250 120.474 -0.224 1
1 29 . 18 1 1 A 7 7 LYS H H 7 8.100 8.957 -0.857 1
1 30 . 18 1 1 A 7 7 LYS HA H 7 3.760 3.928 -0.168 1
1 31 . 18 1 1 A 7 7 LYS C C 7 176.160 179.485 -3.325 1
1 32 . 18 1 1 A 7 7 LYS CA C 7 59.110 59.861 -0.751 1
1 33 . 18 1 1 A 7 7 LYS CB C 7 32.110 32.082 0.028 1
1 34 . 18 1 1 A 7 7 LYS N N 7 120.960 118.136 2.824 1
1 35 . 18 1 1 A 8 8 GLY H H 8 7.860 8.986 -1.126 1
1 36 . 18 1 1 A 8 8 GLY HA2 H 8 3.970 3.783 0.187 1
1 37 . 18 1 1 A 8 8 GLY HA3 H 8 3.970 3.792 0.178 1
1 38 . 18 1 1 A 8 8 GLY C C 8 175.520 176.281 -0.761 1
1 39 . 18 1 1 A 8 8 GLY CA C 8 46.490 47.363 -0.873 1
1 40 . 18 1 1 A 8 8 GLY N N 8 105.430 107.159 -1.729 1
1 41 . 18 1 1 A 9 9 ILE H H 9 8.130 8.672 -0.542 1
1 42 . 18 1 1 A 9 9 ILE HA H 9 4.140 3.870 0.270 1
1 43 . 18 1 1 A 9 9 ILE C C 9 175.320 177.859 -2.539 1
1 44 . 18 1 1 A 9 9 ILE CA C 9 65.010 64.657 0.353 1
1 45 . 18 1 1 A 9 9 ILE CB C 9 39.040 37.875 1.165 1
1 46 . 18 1 1 A 9 9 ILE N N 9 122.870 122.551 0.319 1
1 47 . 18 1 1 A 10 10 PHE H H 10 8.590 8.590 0.000 1
1 48 . 18 1 1 A 10 10 PHE HA H 10 4.470 3.787 0.683 1
1 49 . 18 1 1 A 10 10 PHE C C 10 175.010 177.232 -2.222 1
1 50 . 18 1 1 A 10 10 PHE CA C 10 62.470 62.318 0.152 1
1 51 . 18 1 1 A 10 10 PHE CB C 10 39.670 39.129 0.541 1
1 52 . 18 1 1 A 10 10 PHE N N 10 120.430 120.449 -0.019 1
1 53 . 18 1 1 A 11 11 GLU H H 11 8.600 8.823 -0.223 1
1 54 . 18 1 1 A 11 11 GLU HA H 11 3.750 3.769 -0.019 1
1 55 . 18 1 1 A 11 11 GLU C C 11 177.630 178.862 -1.232 1
1 56 . 18 1 1 A 11 11 GLU CA C 11 58.440 59.724 -1.284 1
1 57 . 18 1 1 A 11 11 GLU CB C 11 29.840 28.935 0.905 1
1 58 . 18 1 1 A 11 11 GLU N N 11 115.410 117.990 -2.580 1
1 59 . 18 1 1 A 12 12 LYS H H 12 7.940 8.860 -0.920 1
1 60 . 18 1 1 A 12 12 LYS HA H 12 4.080 4.030 0.050 1
1 61 . 18 1 1 A 12 12 LYS CA C 12 58.440 59.074 -0.634 1
1 62 . 18 1 1 A 12 12 LYS CB C 12 32.720 32.414 0.306 1
1 63 . 18 1 1 A 12 12 LYS N N 12 119.220 119.918 -0.698 1
1 64 . 18 1 1 A 13 13 TYR H H 13 7.740 7.450 0.290 1
1 65 . 18 1 1 A 13 13 TYR HA H 13 4.580 4.366 0.214 1
1 66 . 18 1 1 A 13 13 TYR C C 13 39.870 178.349 -138.479 1
1 67 . 18 1 1 A 13 13 TYR CA C 13 61.280 60.293 0.987 1
1 68 . 18 1 1 A 13 13 TYR CB C 13 175.510 39.280 136.230 1
1 69 . 18 1 1 A 13 13 TYR N N 13 115.320 117.449 -2.129 1
1 70 . 18 1 1 A 14 14 ALA H H 14 9.060 8.803 0.257 1
1 71 . 18 1 1 A 14 14 ALA HA H 14 3.850 3.889 -0.039 1
1 72 . 18 1 1 A 14 14 ALA C C 14 177.990 179.745 -1.755 1
1 73 . 18 1 1 A 14 14 ALA CA C 14 54.280 54.767 -0.487 1
1 74 . 18 1 1 A 14 14 ALA CB C 14 18.790 17.792 0.998 1
1 75 . 18 1 1 A 14 14 ALA N N 14 120.140 122.650 -2.510 1
1 76 . 18 1 1 A 15 15 ALA H H 15 7.350 8.325 -0.975 1
1 77 . 18 1 1 A 15 15 ALA HA H 15 4.550 4.019 0.531 1
1 78 . 18 1 1 A 15 15 ALA C C 15 176.270 179.247 -2.977 1
1 79 . 18 1 1 A 15 15 ALA CA C 15 52.280 54.985 -2.705 1
1 80 . 18 1 1 A 15 15 ALA CB C 15 19.670 18.434 1.236 1
1 81 . 18 1 1 A 15 15 ALA N N 15 117.640 119.839 -2.199 1
1 82 . 18 1 1 A 16 16 LYS H H 16 7.690 7.951 -0.261 1
1 83 . 18 1 1 A 16 16 LYS HA H 16 4.200 4.025 0.175 1
1 84 . 18 1 1 A 16 16 LYS C C 16 175.830 177.137 -1.307 1
1 85 . 18 1 1 A 16 16 LYS CA C 16 59.780 59.446 0.334 1
1 86 . 18 1 1 A 16 16 LYS CB C 16 33.300 32.404 0.896 1
1 87 . 18 1 1 A 16 16 LYS N N 16 120.340 117.094 3.246 1
1 88 . 18 1 1 A 17 17 GLU H H 17 10.170 7.789 2.381 1
1 89 . 18 1 1 A 17 17 GLU HA H 17 4.990 4.468 0.522 1
1 90 . 18 1 1 A 17 17 GLU C C 17 174.790 176.933 -2.143 1
1 91 . 18 1 1 A 17 17 GLU CA C 17 53.910 55.298 -1.388 1
1 92 . 18 1 1 A 17 17 GLU N N 17 116.560 118.272 -1.712 1
1 93 . 18 1 1 A 18 18 GLY H H 18 9.100 8.532 0.568 1
1 94 . 18 1 1 A 18 18 GLY N N 18 113.230 111.271 1.959 1
1 95 . 18 1 1 A 19 19 ASP H H 19 7.730 8.603 -0.873 1
1 96 . 18 1 1 A 19 19 ASP N N 19 126.280 121.336 4.944 1
1 97 . 18 1 1 A 21 21 ASN H H 21 9.090 8.175 0.915 1
1 98 . 18 1 1 A 21 21 ASN N N 21 115.850 115.388 0.462 1
1 99 . 18 1 1 A 24 24 SER C C 24 176.120 174.599 1.521 1
1 100 . 18 1 1 A 25 25 LYS H H 25 10.400 8.664 1.736 1
1 101 . 18 1 1 A 25 25 LYS C C 25 177.600 177.917 -0.317 1
1 102 . 18 1 1 A 25 25 LYS N N 25 124.350 125.073 -0.723 1
1 103 . 18 1 1 A 26 26 GLU H H 26 9.250 8.305 0.945 1
1 104 . 18 1 1 A 26 26 GLU N N 26 118.470 117.700 0.770 1
1 105 . 18 1 1 A 27 27 GLU C C 27 178.580 178.742 -0.162 1
1 106 . 18 1 1 A 27 27 GLU CA C 27 59.920 59.155 0.765 1
1 107 . 18 1 1 A 28 28 LEU H H 28 10.810 9.319 1.491 1
1 108 . 18 1 1 A 28 28 LEU C C 28 177.280 178.578 -1.298 1
1 109 . 18 1 1 A 28 28 LEU CB C 28 43.570 41.582 1.988 1
1 110 . 18 1 1 A 28 28 LEU N N 28 121.060 121.892 -0.832 1
1 111 . 18 1 1 A 29 29 LYS H H 29 9.680 8.657 1.023 1
1 112 . 18 1 1 A 29 29 LYS HA H 29 4.480 3.989 0.491 1
1 113 . 18 1 1 A 29 29 LYS C C 29 176.670 178.740 -2.070 1
1 114 . 18 1 1 A 29 29 LYS CA C 29 60.770 60.084 0.686 1
1 115 . 18 1 1 A 29 29 LYS CB C 29 32.910 32.495 0.415 1
1 116 . 18 1 1 A 29 29 LYS N N 29 121.140 119.305 1.835 1
1 117 . 18 1 1 A 30 30 LEU H H 30 8.410 7.894 0.516 1
1 118 . 18 1 1 A 30 30 LEU CA C 30 57.730 57.942 -0.212 1
1 119 . 18 1 1 A 30 30 LEU CB C 30 42.570 42.042 0.528 1
1 120 . 18 1 1 A 30 30 LEU N N 30 119.000 119.584 -0.584 1
1 121 . 18 1 1 A 31 31 LEU H H 31 9.010 8.023 0.987 1
1 122 . 18 1 1 A 31 31 LEU HA H 31 2.920 3.637 -0.717 1
1 123 . 18 1 1 A 31 31 LEU C C 31 178.280 178.224 0.056 1
1 124 . 18 1 1 A 31 31 LEU CA C 31 59.030 58.523 0.507 1
1 125 . 18 1 1 A 31 31 LEU N N 31 124.840 119.929 4.911 1
1 126 . 18 1 1 A 32 32 LEU H H 32 9.680 8.934 0.746 1
1 127 . 18 1 1 A 32 32 LEU HA H 32 4.490 4.082 0.408 1
1 128 . 18 1 1 A 32 32 LEU C C 32 177.360 179.826 -2.466 1
1 129 . 18 1 1 A 32 32 LEU CA C 32 58.520 57.297 1.223 1
1 130 . 18 1 1 A 32 32 LEU CB C 32 42.760 41.542 1.218 1
1 131 . 18 1 1 A 32 32 LEU N N 32 120.580 119.086 1.494 1
1 132 . 18 1 1 A 33 33 GLN H H 33 9.140 8.190 0.950 1
1 133 . 18 1 1 A 33 33 GLN HA H 33 4.250 4.158 0.092 1
1 134 . 18 1 1 A 33 33 GLN C C 33 176.050 178.198 -2.148 1
1 135 . 18 1 1 A 33 33 GLN CA C 33 58.600 58.814 -0.214 1
1 136 . 18 1 1 A 33 33 GLN CB C 33 29.730 28.625 1.105 1
1 137 . 18 1 1 A 33 33 GLN N N 33 115.010 119.763 -4.753 1
1 138 . 18 1 1 A 34 34 THR H H 34 8.000 7.941 0.059 1
1 139 . 18 1 1 A 34 34 THR HA H 34 4.390 4.069 0.321 1
1 140 . 18 1 1 A 34 34 THR C C 34 174.130 175.957 -1.827 1
1 141 . 18 1 1 A 34 34 THR CA C 34 65.250 66.148 -0.898 1
1 142 . 18 1 1 A 34 34 THR CB C 34 69.920 69.126 0.794 1
1 143 . 18 1 1 A 34 34 THR N N 34 111.180 114.882 -3.702 1
1 144 . 18 1 1 A 35 35 GLU H H 35 8.810 8.640 0.170 1
1 145 . 18 1 1 A 35 35 GLU HA H 35 4.470 3.931 0.539 1
1 146 . 18 1 1 A 35 35 GLU C C 35 175.430 176.179 -0.749 1
1 147 . 18 1 1 A 35 35 GLU CA C 35 56.170 59.196 -3.026 1
1 148 . 18 1 1 A 35 35 GLU CB C 35 30.900 29.736 1.164 1
1 149 . 18 1 1 A 35 35 GLU N N 35 116.410 121.693 -5.283 1
1 150 . 18 1 1 A 36 36 PHE H H 36 8.230 8.016 0.214 1
1 151 . 18 1 1 A 36 36 PHE HA H 36 5.500 5.097 0.403 1
1 152 . 18 1 1 A 36 36 PHE N N 36 115.090 115.719 -0.629 1
1 153 . 18 1 1 A 37 37 PRO C C 37 178.140 177.888 0.252 1
1 154 . 18 1 1 A 37 37 PRO CA C 37 64.940 64.578 0.362 1
1 155 . 18 1 1 A 37 37 PRO CB C 37 31.600 31.882 -0.282 1
1 156 . 18 1 1 A 38 38 SER H H 38 8.660 8.355 0.305 1
1 157 . 18 1 1 A 38 38 SER HA H 38 4.500 4.265 0.235 1
1 158 . 18 1 1 A 38 38 SER C C 38 174.830 177.257 -2.427 1
1 159 . 18 1 1 A 38 38 SER CA C 38 59.970 61.402 -1.432 1
1 160 . 18 1 1 A 38 38 SER CB C 38 62.690 62.649 0.041 1
1 161 . 18 1 1 A 38 38 SER N N 38 114.030 112.746 1.284 1
1 162 . 18 1 1 A 39 39 LEU H H 39 8.260 8.140 0.120 1
1 163 . 18 1 1 A 39 39 LEU HA H 39 4.520 4.136 0.384 1
1 164 . 18 1 1 A 39 39 LEU C C 39 176.780 179.654 -2.874 1
1 165 . 18 1 1 A 39 39 LEU CA C 39 56.600 57.196 -0.596 1
1 166 . 18 1 1 A 39 39 LEU CB C 39 42.610 41.494 1.116 1
1 167 . 18 1 1 A 39 39 LEU N N 39 122.650 124.324 -1.674 1
1 168 . 18 1 1 A 40 40 LEU H H 40 8.070 7.904 0.166 1
1 169 . 18 1 1 A 40 40 LEU HA H 40 4.830 4.100 0.730 1
1 170 . 18 1 1 A 40 40 LEU C C 40 175.690 179.812 -4.122 1
1 171 . 18 1 1 A 40 40 LEU CA C 40 54.510 57.951 -3.441 1
1 172 . 18 1 1 A 40 40 LEU CB C 40 42.020 41.205 0.815 1
1 173 . 18 1 1 A 40 40 LEU N N 40 117.390 118.621 -1.231 1
1 174 . 18 1 1 A 41 41 LYS H H 41 7.770 8.050 -0.280 1
1 175 . 18 1 1 A 41 41 LYS HA H 41 4.610 4.095 0.515 1
1 176 . 18 1 1 A 41 41 LYS C C 41 175.380 177.427 -2.047 1
1 177 . 18 1 1 A 41 41 LYS CA C 41 56.170 58.676 -2.506 1
1 178 . 18 1 1 A 41 41 LYS CB C 41 32.950 31.802 1.148 1
1 179 . 18 1 1 A 41 41 LYS N N 41 120.530 117.761 2.769 1
1 180 . 18 1 1 A 42 42 GLY H H 42 8.390 8.094 0.296 1
1 181 . 18 1 1 A 42 42 GLY HA2 H 42 4.280 4.064 0.216 1
1 182 . 18 1 1 A 42 42 GLY HA3 H 42 4.280 4.064 0.216 1
1 183 . 18 1 1 A 42 42 GLY C C 42 177.190 174.867 2.323 1
1 184 . 18 1 1 A 42 42 GLY N N 42 109.280 108.469 0.811 1
1 185 . 18 1 1 A 43 43 MET H H 43 9.020 8.566 0.454 1
1 186 . 18 1 1 A 43 43 MET C C 43 175.520 176.265 -0.745 1
1 187 . 18 1 1 A 43 43 MET N N 43 121.110 118.995 2.115 1
1 188 . 18 1 1 A 44 44 SER H H 44 8.700 7.882 0.818 1
1 189 . 18 1 1 A 44 44 SER C C 44 173.540 174.134 -0.594 1
1 190 . 18 1 1 A 44 44 SER N N 44 116.190 115.585 0.605 1
1 191 . 18 1 1 A 45 45 THR H H 45 8.440 8.694 -0.254 1
1 192 . 18 1 1 A 45 45 THR C C 45 174.300 175.298 -0.998 1
1 193 . 18 1 1 A 45 45 THR N N 45 113.740 119.384 -5.644 1
1 194 . 18 1 1 A 46 46 LEU H H 46 9.380 8.827 0.553 1
1 195 . 18 1 1 A 46 46 LEU C C 46 177.760 178.108 -0.348 1
1 196 . 18 1 1 A 46 46 LEU N N 46 123.970 123.486 0.484 1
1 197 . 18 1 1 A 47 47 ASP H H 47 8.990 8.438 0.552 1
1 198 . 18 1 1 A 47 47 ASP N N 47 118.620 118.395 0.225 1
1 199 . 18 1 1 A 49 49 LEU H H 49 9.740 8.973 0.767 1
1 200 . 18 1 1 A 49 49 LEU N N 49 123.880 120.633 3.247 1
1 201 . 18 1 1 A 50 50 PHE H H 50 10.730 9.165 1.565 1
1 202 . 18 1 1 A 50 50 PHE N N 50 121.380 119.601 1.779 1
1 203 . 18 1 1 A 51 51 GLU H H 51 7.860 8.497 -0.637 1
1 204 . 18 1 1 A 51 51 GLU HA H 51 3.530 3.854 -0.324 1
1 205 . 18 1 1 A 51 51 GLU N N 51 114.870 118.559 -3.689 1
1 206 . 18 1 1 A 66 66 PHE CA C 66 58.850 61.172 -2.322 1
1 207 . 18 1 1 A 67 67 GLN H H 67 5.670 8.876 -3.206 1
1 208 . 18 1 1 A 67 67 GLN C C 67 174.810 177.991 -3.181 1
1 209 . 18 1 1 A 67 67 GLN CA C 67 56.340 58.172 -1.832 1
1 210 . 18 1 1 A 67 67 GLN N N 67 114.050 117.239 -3.189 1
1 211 . 18 1 1 A 68 68 VAL H H 68 5.760 7.317 -1.557 1
1 212 . 18 1 1 A 68 68 VAL C C 68 175.770 178.528 -2.758 1
1 213 . 18 1 1 A 68 68 VAL CA C 68 63.990 65.889 -1.899 1
1 214 . 18 1 1 A 68 68 VAL CB C 68 31.310 31.451 -0.141 1
1 215 . 18 1 1 A 68 68 VAL N N 68 116.280 119.822 -3.542 1
1 216 . 18 1 1 A 69 69 LEU H H 69 7.150 8.260 -1.110 1
1 217 . 18 1 1 A 69 69 LEU HA H 69 4.040 4.027 0.013 1
1 218 . 18 1 1 A 69 69 LEU C C 69 176.210 178.591 -2.381 1
1 219 . 18 1 1 A 69 69 LEU CA C 69 56.270 57.404 -1.134 1
1 220 . 18 1 1 A 69 69 LEU CB C 69 42.010 42.008 0.002 1
1 221 . 18 1 1 A 69 69 LEU N N 69 120.350 121.078 -0.728 1
1 222 . 18 1 1 A 70 70 VAL H H 70 6.810 7.645 -0.835 1
1 223 . 18 1 1 A 70 70 VAL HA H 70 3.170 3.253 -0.083 1
1 224 . 18 1 1 A 70 70 VAL C C 70 175.760 177.672 -1.912 1
1 225 . 18 1 1 A 70 70 VAL CA C 70 65.110 66.510 -1.400 1
1 226 . 18 1 1 A 70 70 VAL CB C 70 31.190 31.077 0.113 1
1 227 . 18 1 1 A 70 70 VAL N N 70 115.790 118.747 -2.957 1
1 228 . 18 1 1 A 71 71 LYS H H 71 7.190 8.005 -0.815 1
1 229 . 18 1 1 A 71 71 LYS HA H 71 3.880 3.893 -0.013 1
1 230 . 18 1 1 A 71 71 LYS C C 71 176.100 179.256 -3.156 1
1 231 . 18 1 1 A 71 71 LYS CA C 71 57.680 59.400 -1.720 1
1 232 . 18 1 1 A 71 71 LYS CB C 71 31.930 32.160 -0.230 1
1 233 . 18 1 1 A 71 71 LYS N N 71 117.820 119.473 -1.653 1
1 234 . 18 1 1 A 72 72 LYS H H 72 7.450 7.399 0.051 1
1 235 . 18 1 1 A 72 72 LYS HA H 72 4.180 4.059 0.121 1
1 236 . 18 1 1 A 72 72 LYS C C 72 176.180 179.217 -3.037 1
1 237 . 18 1 1 A 72 72 LYS CA C 72 56.950 58.208 -1.258 1
1 238 . 18 1 1 A 72 72 LYS CB C 72 33.610 31.838 1.772 1
1 239 . 18 1 1 A 72 72 LYS N N 72 116.930 118.154 -1.224 1
1 240 . 18 1 1 A 73 73 ILE H H 73 7.440 7.857 -0.417 1
1 241 . 18 1 1 A 73 73 ILE HA H 73 4.180 3.557 0.623 1
1 242 . 18 1 1 A 73 73 ILE C C 73 174.440 178.015 -3.575 1
1 243 . 18 1 1 A 73 73 ILE CA C 73 61.510 64.524 -3.014 1
1 244 . 18 1 1 A 73 73 ILE CB C 73 38.610 37.471 1.139 1
1 245 . 18 1 1 A 73 73 ILE N N 73 114.560 121.529 -6.969 1
1 246 . 18 1 1 A 74 74 SER H H 74 7.790 8.985 -1.195 1
1 247 . 18 1 1 A 74 74 SER HA H 74 4.520 4.199 0.321 1
1 248 . 18 1 1 A 74 74 SER C C 74 171.580 176.349 -4.769 1
1 249 . 18 1 1 A 74 74 SER CA C 74 57.960 61.540 -3.580 1
1 250 . 18 1 1 A 74 74 SER CB C 74 63.820 63.091 0.729 1
1 251 . 18 1 1 A 74 74 SER N N 74 117.310 116.590 0.720 1
1 6 . 19 1 1 A 2 2 SER H H 2 9.010 8.156 0.854 1
1 7 . 19 1 1 A 2 2 SER HA H 2 4.680 4.562 0.118 1
1 8 . 19 1 1 A 2 2 SER N N 2 119.390 114.304 5.086 1
1 9 . 19 1 1 A 3 3 PRO C C 3 177.630 178.595 -0.965 1
1 10 . 19 1 1 A 3 3 PRO CA C 3 65.000 65.171 -0.171 1
1 11 . 19 1 1 A 3 3 PRO CB C 3 31.790 32.028 -0.238 1
1 12 . 19 1 1 A 4 4 GLU H H 4 8.600 8.344 0.256 1
1 13 . 19 1 1 A 4 4 GLU HA H 4 3.900 4.092 -0.192 1
1 14 . 19 1 1 A 4 4 GLU C C 4 177.910 179.221 -1.311 1
1 15 . 19 1 1 A 4 4 GLU CB C 4 28.980 29.226 -0.246 1
1 16 . 19 1 1 A 4 4 GLU N N 4 117.750 117.948 -0.198 1
1 17 . 19 1 1 A 5 5 GLU H H 5 7.980 8.117 -0.137 1
1 18 . 19 1 1 A 5 5 GLU HA H 5 4.170 4.041 0.129 1
1 19 . 19 1 1 A 5 5 GLU C C 5 178.290 179.298 -1.008 1
1 20 . 19 1 1 A 5 5 GLU CA C 5 58.140 59.224 -1.084 1
1 21 . 19 1 1 A 5 5 GLU CB C 5 30.450 29.308 1.142 1
1 22 . 19 1 1 A 5 5 GLU N N 5 121.890 120.333 1.557 1
1 23 . 19 1 1 A 6 6 LEU H H 6 8.450 8.249 0.201 1
1 24 . 19 1 1 A 6 6 LEU HA H 6 4.310 4.062 0.248 1
1 25 . 19 1 1 A 6 6 LEU C C 6 176.660 178.830 -2.170 1
1 26 . 19 1 1 A 6 6 LEU CA C 6 57.310 57.807 -0.497 1
1 27 . 19 1 1 A 6 6 LEU CB C 6 42.090 41.735 0.355 1
1 28 . 19 1 1 A 6 6 LEU N N 6 120.250 120.546 -0.296 1
1 29 . 19 1 1 A 7 7 LYS H H 7 8.100 8.979 -0.879 1
1 30 . 19 1 1 A 7 7 LYS HA H 7 3.760 4.090 -0.330 1
1 31 . 19 1 1 A 7 7 LYS C C 7 176.160 179.494 -3.334 1
1 32 . 19 1 1 A 7 7 LYS CA C 7 59.110 59.884 -0.774 1
1 33 . 19 1 1 A 7 7 LYS CB C 7 32.110 32.285 -0.175 1
1 34 . 19 1 1 A 7 7 LYS N N 7 120.960 118.716 2.244 1
1 35 . 19 1 1 A 8 8 GLY H H 8 7.860 8.510 -0.650 1
1 36 . 19 1 1 A 8 8 GLY HA2 H 8 3.970 3.824 0.146 1
1 37 . 19 1 1 A 8 8 GLY HA3 H 8 3.970 3.831 0.139 1
1 38 . 19 1 1 A 8 8 GLY C C 8 175.520 176.146 -0.626 1
1 39 . 19 1 1 A 8 8 GLY CA C 8 46.490 47.461 -0.971 1
1 40 . 19 1 1 A 8 8 GLY N N 8 105.430 107.071 -1.641 1
1 41 . 19 1 1 A 9 9 ILE H H 9 8.130 9.603 -1.473 1
1 42 . 19 1 1 A 9 9 ILE HA H 9 4.140 3.933 0.207 1
1 43 . 19 1 1 A 9 9 ILE C C 9 175.320 178.085 -2.765 1
1 44 . 19 1 1 A 9 9 ILE CA C 9 65.010 64.613 0.397 1
1 45 . 19 1 1 A 9 9 ILE CB C 9 39.040 37.948 1.092 1
1 46 . 19 1 1 A 9 9 ILE N N 9 122.870 122.717 0.153 1
1 47 . 19 1 1 A 10 10 PHE H H 10 8.590 9.703 -1.113 1
1 48 . 19 1 1 A 10 10 PHE HA H 10 4.470 4.072 0.398 1
1 49 . 19 1 1 A 10 10 PHE C C 10 175.010 177.247 -2.237 1
1 50 . 19 1 1 A 10 10 PHE CA C 10 62.470 62.547 -0.077 1
1 51 . 19 1 1 A 10 10 PHE CB C 10 39.670 39.326 0.344 1
1 52 . 19 1 1 A 10 10 PHE N N 10 120.430 120.471 -0.041 1
1 53 . 19 1 1 A 11 11 GLU H H 11 8.600 8.460 0.140 1
1 54 . 19 1 1 A 11 11 GLU HA H 11 3.750 3.674 0.076 1
1 55 . 19 1 1 A 11 11 GLU C C 11 177.630 178.807 -1.177 1
1 56 . 19 1 1 A 11 11 GLU CA C 11 58.440 59.715 -1.275 1
1 57 . 19 1 1 A 11 11 GLU CB C 11 29.840 29.014 0.826 1
1 58 . 19 1 1 A 11 11 GLU N N 11 115.410 118.005 -2.595 1
1 59 . 19 1 1 A 12 12 LYS H H 12 7.940 8.685 -0.745 1
1 60 . 19 1 1 A 12 12 LYS HA H 12 4.080 3.959 0.121 1
1 61 . 19 1 1 A 12 12 LYS CA C 12 58.440 59.142 -0.702 1
1 62 . 19 1 1 A 12 12 LYS CB C 12 32.720 32.288 0.432 1
1 63 . 19 1 1 A 12 12 LYS N N 12 119.220 120.053 -0.833 1
1 64 . 19 1 1 A 13 13 TYR H H 13 7.740 7.315 0.425 1
1 65 . 19 1 1 A 13 13 TYR HA H 13 4.580 4.386 0.194 1
1 66 . 19 1 1 A 13 13 TYR C C 13 39.870 178.516 -138.646 1
1 67 . 19 1 1 A 13 13 TYR CA C 13 61.280 60.353 0.927 1
1 68 . 19 1 1 A 13 13 TYR CB C 13 175.510 39.309 136.201 1
1 69 . 19 1 1 A 13 13 TYR N N 13 115.320 117.499 -2.179 1
1 70 . 19 1 1 A 14 14 ALA H H 14 9.060 8.525 0.535 1
1 71 . 19 1 1 A 14 14 ALA HA H 14 3.850 4.079 -0.229 1
1 72 . 19 1 1 A 14 14 ALA C C 14 177.990 179.656 -1.666 1
1 73 . 19 1 1 A 14 14 ALA CA C 14 54.280 54.450 -0.170 1
1 74 . 19 1 1 A 14 14 ALA CB C 14 18.790 18.012 0.778 1
1 75 . 19 1 1 A 14 14 ALA N N 14 120.140 122.679 -2.539 1
1 76 . 19 1 1 A 15 15 ALA H H 15 7.350 8.188 -0.838 1
1 77 . 19 1 1 A 15 15 ALA HA H 15 4.550 4.097 0.453 1
1 78 . 19 1 1 A 15 15 ALA C C 15 176.270 179.085 -2.815 1
1 79 . 19 1 1 A 15 15 ALA CA C 15 52.280 54.666 -2.386 1
1 80 . 19 1 1 A 15 15 ALA CB C 15 19.670 18.655 1.015 1
1 81 . 19 1 1 A 15 15 ALA N N 15 117.640 119.697 -2.057 1
1 82 . 19 1 1 A 16 16 LYS H H 16 7.690 8.295 -0.605 1
1 83 . 19 1 1 A 16 16 LYS HA H 16 4.200 3.967 0.233 1
1 84 . 19 1 1 A 16 16 LYS C C 16 175.830 177.194 -1.364 1
1 85 . 19 1 1 A 16 16 LYS CA C 16 59.780 59.639 0.141 1
1 86 . 19 1 1 A 16 16 LYS CB C 16 33.300 32.263 1.037 1
1 87 . 19 1 1 A 16 16 LYS N N 16 120.340 117.185 3.155 1
1 88 . 19 1 1 A 17 17 GLU H H 17 10.170 7.788 2.382 1
1 89 . 19 1 1 A 17 17 GLU HA H 17 4.990 4.488 0.502 1
1 90 . 19 1 1 A 17 17 GLU C C 17 174.790 177.036 -2.246 1
1 91 . 19 1 1 A 17 17 GLU CA C 17 53.910 55.345 -1.435 1
1 92 . 19 1 1 A 17 17 GLU N N 17 116.560 118.072 -1.512 1
1 93 . 19 1 1 A 18 18 GLY H H 18 9.100 8.614 0.486 1
1 94 . 19 1 1 A 18 18 GLY N N 18 113.230 111.675 1.555 1
1 95 . 19 1 1 A 19 19 ASP H H 19 7.730 8.636 -0.906 1
1 96 . 19 1 1 A 19 19 ASP N N 19 126.280 121.601 4.679 1
1 97 . 19 1 1 A 21 21 ASN H H 21 9.090 8.501 0.589 1
1 98 . 19 1 1 A 21 21 ASN N N 21 115.850 115.995 -0.145 1
1 99 . 19 1 1 A 24 24 SER C C 24 176.120 174.582 1.538 1
1 100 . 19 1 1 A 25 25 LYS H H 25 10.400 8.572 1.828 1
1 101 . 19 1 1 A 25 25 LYS C C 25 177.600 177.889 -0.289 1
1 102 . 19 1 1 A 25 25 LYS N N 25 124.350 124.996 -0.646 1
1 103 . 19 1 1 A 26 26 GLU H H 26 9.250 8.346 0.904 1
1 104 . 19 1 1 A 26 26 GLU N N 26 118.470 117.717 0.753 1
1 105 . 19 1 1 A 27 27 GLU C C 27 178.580 178.565 0.015 1
1 106 . 19 1 1 A 27 27 GLU CA C 27 59.920 58.986 0.934 1
1 107 . 19 1 1 A 28 28 LEU H H 28 10.810 9.269 1.541 1
1 108 . 19 1 1 A 28 28 LEU C C 28 177.280 178.395 -1.115 1
1 109 . 19 1 1 A 28 28 LEU CB C 28 43.570 41.560 2.010 1
1 110 . 19 1 1 A 28 28 LEU N N 28 121.060 121.775 -0.715 1
1 111 . 19 1 1 A 29 29 LYS H H 29 9.680 8.560 1.120 1
1 112 . 19 1 1 A 29 29 LYS HA H 29 4.480 3.922 0.558 1
1 113 . 19 1 1 A 29 29 LYS C C 29 176.670 178.640 -1.970 1
1 114 . 19 1 1 A 29 29 LYS CA C 29 60.770 59.989 0.781 1
1 115 . 19 1 1 A 29 29 LYS CB C 29 32.910 32.541 0.369 1
1 116 . 19 1 1 A 29 29 LYS N N 29 121.140 119.139 2.001 1
1 117 . 19 1 1 A 30 30 LEU H H 30 8.410 7.796 0.614 1
1 118 . 19 1 1 A 30 30 LEU CA C 30 57.730 57.771 -0.041 1
1 119 . 19 1 1 A 30 30 LEU CB C 30 42.570 41.896 0.674 1
1 120 . 19 1 1 A 30 30 LEU N N 30 119.000 119.463 -0.463 1
1 121 . 19 1 1 A 31 31 LEU H H 31 9.010 7.393 1.617 1
1 122 . 19 1 1 A 31 31 LEU HA H 31 2.920 3.608 -0.688 1
1 123 . 19 1 1 A 31 31 LEU C C 31 178.280 178.318 -0.038 1
1 124 . 19 1 1 A 31 31 LEU CA C 31 59.030 58.395 0.635 1
1 125 . 19 1 1 A 31 31 LEU N N 31 124.840 119.539 5.301 1
1 126 . 19 1 1 A 32 32 LEU H H 32 9.680 8.904 0.776 1
1 127 . 19 1 1 A 32 32 LEU HA H 32 4.490 4.055 0.435 1
1 128 . 19 1 1 A 32 32 LEU C C 32 177.360 179.807 -2.447 1
1 129 . 19 1 1 A 32 32 LEU CA C 32 58.520 57.272 1.248 1
1 130 . 19 1 1 A 32 32 LEU CB C 32 42.760 41.508 1.252 1
1 131 . 19 1 1 A 32 32 LEU N N 32 120.580 119.035 1.545 1
1 132 . 19 1 1 A 33 33 GLN H H 33 9.140 8.154 0.986 1
1 133 . 19 1 1 A 33 33 GLN HA H 33 4.250 4.142 0.108 1
1 134 . 19 1 1 A 33 33 GLN C C 33 176.050 178.501 -2.451 1
1 135 . 19 1 1 A 33 33 GLN CA C 33 58.600 58.782 -0.182 1
1 136 . 19 1 1 A 33 33 GLN CB C 33 29.730 28.621 1.109 1
1 137 . 19 1 1 A 33 33 GLN N N 33 115.010 119.729 -4.719 1
1 138 . 19 1 1 A 34 34 THR H H 34 8.000 7.939 0.061 1
1 139 . 19 1 1 A 34 34 THR HA H 34 4.390 4.033 0.357 1
1 140 . 19 1 1 A 34 34 THR C C 34 174.130 175.921 -1.791 1
1 141 . 19 1 1 A 34 34 THR CA C 34 65.250 66.426 -1.176 1
1 142 . 19 1 1 A 34 34 THR CB C 34 69.920 69.166 0.754 1
1 143 . 19 1 1 A 34 34 THR N N 34 111.180 114.556 -3.376 1
1 144 . 19 1 1 A 35 35 GLU H H 35 8.810 8.695 0.115 1
1 145 . 19 1 1 A 35 35 GLU HA H 35 4.470 4.042 0.428 1
1 146 . 19 1 1 A 35 35 GLU C C 35 175.430 176.322 -0.892 1
1 147 . 19 1 1 A 35 35 GLU CA C 35 56.170 59.285 -3.115 1
1 148 . 19 1 1 A 35 35 GLU CB C 35 30.900 29.861 1.039 1
1 149 . 19 1 1 A 35 35 GLU N N 35 116.410 121.740 -5.330 1
1 150 . 19 1 1 A 36 36 PHE H H 36 8.230 8.004 0.226 1
1 151 . 19 1 1 A 36 36 PHE HA H 36 5.500 5.090 0.410 1
1 152 . 19 1 1 A 36 36 PHE N N 36 115.090 115.670 -0.580 1
1 153 . 19 1 1 A 37 37 PRO C C 37 178.140 177.875 0.265 1
1 154 . 19 1 1 A 37 37 PRO CA C 37 64.940 64.483 0.457 1
1 155 . 19 1 1 A 37 37 PRO CB C 37 31.600 31.989 -0.389 1
1 156 . 19 1 1 A 38 38 SER H H 38 8.660 8.511 0.149 1
1 157 . 19 1 1 A 38 38 SER HA H 38 4.500 4.269 0.231 1
1 158 . 19 1 1 A 38 38 SER C C 38 174.830 176.933 -2.103 1
1 159 . 19 1 1 A 38 38 SER CA C 38 59.970 61.423 -1.453 1
1 160 . 19 1 1 A 38 38 SER CB C 38 62.690 63.084 -0.394 1
1 161 . 19 1 1 A 38 38 SER N N 38 114.030 114.123 -0.093 1
1 162 . 19 1 1 A 39 39 LEU H H 39 8.260 8.170 0.090 1
1 163 . 19 1 1 A 39 39 LEU HA H 39 4.520 4.107 0.413 1
1 164 . 19 1 1 A 39 39 LEU C C 39 176.780 180.018 -3.238 1
1 165 . 19 1 1 A 39 39 LEU CA C 39 56.600 57.258 -0.658 1
1 166 . 19 1 1 A 39 39 LEU CB C 39 42.610 41.441 1.169 1
1 167 . 19 1 1 A 39 39 LEU N N 39 122.650 121.928 0.722 1
1 168 . 19 1 1 A 40 40 LEU H H 40 8.070 8.120 -0.050 1
1 169 . 19 1 1 A 40 40 LEU HA H 40 4.830 4.051 0.779 1
1 170 . 19 1 1 A 40 40 LEU C C 40 175.690 179.281 -3.591 1
1 171 . 19 1 1 A 40 40 LEU CA C 40 54.510 57.918 -3.408 1
1 172 . 19 1 1 A 40 40 LEU CB C 40 42.020 41.158 0.862 1
1 173 . 19 1 1 A 40 40 LEU N N 40 117.390 119.488 -2.098 1
1 174 . 19 1 1 A 41 41 LYS H H 41 7.770 7.936 -0.166 1
1 175 . 19 1 1 A 41 41 LYS HA H 41 4.610 4.146 0.464 1
1 176 . 19 1 1 A 41 41 LYS C C 41 175.380 177.442 -2.062 1
1 177 . 19 1 1 A 41 41 LYS CA C 41 56.170 58.703 -2.533 1
1 178 . 19 1 1 A 41 41 LYS CB C 41 32.950 31.806 1.144 1
1 179 . 19 1 1 A 41 41 LYS N N 41 120.530 117.752 2.778 1
1 180 . 19 1 1 A 42 42 GLY H H 42 8.390 7.795 0.595 1
1 181 . 19 1 1 A 42 42 GLY HA2 H 42 4.280 4.062 0.218 1
1 182 . 19 1 1 A 42 42 GLY HA3 H 42 4.280 4.064 0.216 1
1 183 . 19 1 1 A 42 42 GLY C C 42 177.190 174.937 2.253 1
1 184 . 19 1 1 A 42 42 GLY N N 42 109.280 108.338 0.942 1
1 185 . 19 1 1 A 43 43 MET H H 43 9.020 8.570 0.450 1
1 186 . 19 1 1 A 43 43 MET C C 43 175.520 175.935 -0.415 1
1 187 . 19 1 1 A 43 43 MET N N 43 121.110 119.134 1.976 1
1 188 . 19 1 1 A 44 44 SER H H 44 8.700 7.784 0.916 1
1 189 . 19 1 1 A 44 44 SER C C 44 173.540 174.116 -0.576 1
1 190 . 19 1 1 A 44 44 SER N N 44 116.190 116.771 -0.581 1
1 191 . 19 1 1 A 45 45 THR H H 45 8.440 8.711 -0.271 1
1 192 . 19 1 1 A 45 45 THR C C 45 174.300 175.297 -0.997 1
1 193 . 19 1 1 A 45 45 THR N N 45 113.740 119.293 -5.553 1
1 194 . 19 1 1 A 46 46 LEU H H 46 9.380 8.816 0.564 1
1 195 . 19 1 1 A 46 46 LEU C C 46 177.760 178.153 -0.393 1
1 196 . 19 1 1 A 46 46 LEU N N 46 123.970 123.473 0.497 1
1 197 . 19 1 1 A 47 47 ASP H H 47 8.990 8.548 0.442 1
1 198 . 19 1 1 A 47 47 ASP N N 47 118.620 118.042 0.578 1
1 199 . 19 1 1 A 49 49 LEU H H 49 9.740 8.275 1.465 1
1 200 . 19 1 1 A 49 49 LEU N N 49 123.880 120.921 2.959 1
1 201 . 19 1 1 A 50 50 PHE H H 50 10.730 8.869 1.861 1
1 202 . 19 1 1 A 50 50 PHE N N 50 121.380 119.381 1.999 1
1 203 . 19 1 1 A 51 51 GLU H H 51 7.860 8.699 -0.839 1
1 204 . 19 1 1 A 51 51 GLU HA H 51 3.530 4.046 -0.516 1
1 205 . 19 1 1 A 51 51 GLU N N 51 114.870 118.636 -3.766 1
1 206 . 19 1 1 A 66 66 PHE CA C 66 58.850 61.218 -2.368 1
1 207 . 19 1 1 A 67 67 GLN H H 67 5.670 8.874 -3.204 1
1 208 . 19 1 1 A 67 67 GLN C C 67 174.810 177.981 -3.171 1
1 209 . 19 1 1 A 67 67 GLN CA C 67 56.340 58.058 -1.718 1
1 210 . 19 1 1 A 67 67 GLN N N 67 114.050 117.613 -3.563 1
1 211 . 19 1 1 A 68 68 VAL H H 68 5.760 7.352 -1.592 1
1 212 . 19 1 1 A 68 68 VAL C C 68 175.770 178.402 -2.632 1
1 213 . 19 1 1 A 68 68 VAL CA C 68 63.990 65.652 -1.662 1
1 214 . 19 1 1 A 68 68 VAL CB C 68 31.310 31.681 -0.371 1
1 215 . 19 1 1 A 68 68 VAL N N 68 116.280 119.542 -3.262 1
1 216 . 19 1 1 A 69 69 LEU H H 69 7.150 8.565 -1.415 1
1 217 . 19 1 1 A 69 69 LEU HA H 69 4.040 4.009 0.031 1
1 218 . 19 1 1 A 69 69 LEU C C 69 176.210 178.302 -2.092 1
1 219 . 19 1 1 A 69 69 LEU CA C 69 56.270 57.271 -1.001 1
1 220 . 19 1 1 A 69 69 LEU CB C 69 42.010 41.921 0.089 1
1 221 . 19 1 1 A 69 69 LEU N N 69 120.350 121.646 -1.296 1
1 222 . 19 1 1 A 70 70 VAL H H 70 6.810 7.239 -0.429 1
1 223 . 19 1 1 A 70 70 VAL HA H 70 3.170 3.265 -0.095 1
1 224 . 19 1 1 A 70 70 VAL C C 70 175.760 177.701 -1.941 1
1 225 . 19 1 1 A 70 70 VAL CA C 70 65.110 66.732 -1.622 1
1 226 . 19 1 1 A 70 70 VAL CB C 70 31.190 30.942 0.248 1
1 227 . 19 1 1 A 70 70 VAL N N 70 115.790 118.717 -2.927 1
1 228 . 19 1 1 A 71 71 LYS H H 71 7.190 8.503 -1.313 1
1 229 . 19 1 1 A 71 71 LYS HA H 71 3.880 3.878 0.002 1
1 230 . 19 1 1 A 71 71 LYS C C 71 176.100 179.120 -3.020 1
1 231 . 19 1 1 A 71 71 LYS CA C 71 57.680 59.382 -1.702 1
1 232 . 19 1 1 A 71 71 LYS CB C 71 31.930 32.179 -0.249 1
1 233 . 19 1 1 A 71 71 LYS N N 71 117.820 119.854 -2.034 1
1 234 . 19 1 1 A 72 72 LYS H H 72 7.450 7.253 0.197 1
1 235 . 19 1 1 A 72 72 LYS HA H 72 4.180 4.058 0.122 1
1 236 . 19 1 1 A 72 72 LYS C C 72 176.180 179.222 -3.042 1
1 237 . 19 1 1 A 72 72 LYS CA C 72 56.950 58.209 -1.259 1
1 238 . 19 1 1 A 72 72 LYS CB C 72 33.610 31.830 1.780 1
1 239 . 19 1 1 A 72 72 LYS N N 72 116.930 117.927 -0.997 1
1 240 . 19 1 1 A 73 73 ILE H H 73 7.440 7.892 -0.452 1
1 241 . 19 1 1 A 73 73 ILE HA H 73 4.180 3.577 0.603 1
1 242 . 19 1 1 A 73 73 ILE C C 73 174.440 178.239 -3.799 1
1 243 . 19 1 1 A 73 73 ILE CA C 73 61.510 64.508 -2.998 1
1 244 . 19 1 1 A 73 73 ILE CB C 73 38.610 37.374 1.236 1
1 245 . 19 1 1 A 73 73 ILE N N 73 114.560 121.524 -6.964 1
1 246 . 19 1 1 A 74 74 SER H H 74 7.790 8.680 -0.890 1
1 247 . 19 1 1 A 74 74 SER HA H 74 4.520 4.146 0.374 1
1 248 . 19 1 1 A 74 74 SER C C 74 171.580 177.491 -5.911 1
1 249 . 19 1 1 A 74 74 SER CA C 74 57.960 61.265 -3.305 1
1 250 . 19 1 1 A 74 74 SER CB C 74 63.820 62.919 0.901 1
1 251 . 19 1 1 A 74 74 SER N N 74 117.310 116.093 1.217 1
1 6 . 20 1 1 A 2 2 SER H H 2 9.010 8.156 0.854 1
1 7 . 20 1 1 A 2 2 SER HA H 2 4.680 4.562 0.118 1
1 8 . 20 1 1 A 2 2 SER N N 2 119.390 114.304 5.086 1
1 9 . 20 1 1 A 3 3 PRO C C 3 177.630 178.595 -0.965 1
1 10 . 20 1 1 A 3 3 PRO CA C 3 65.000 65.171 -0.171 1
1 11 . 20 1 1 A 3 3 PRO CB C 3 31.790 32.028 -0.238 1
1 12 . 20 1 1 A 4 4 GLU H H 4 8.600 8.344 0.256 1
1 13 . 20 1 1 A 4 4 GLU HA H 4 3.900 4.092 -0.192 1
1 14 . 20 1 1 A 4 4 GLU C C 4 177.910 179.221 -1.311 1
1 15 . 20 1 1 A 4 4 GLU CB C 4 28.980 29.226 -0.246 1
1 16 . 20 1 1 A 4 4 GLU N N 4 117.750 117.948 -0.198 1
1 17 . 20 1 1 A 5 5 GLU H H 5 7.980 8.117 -0.137 1
1 18 . 20 1 1 A 5 5 GLU HA H 5 4.170 4.041 0.129 1
1 19 . 20 1 1 A 5 5 GLU C C 5 178.290 179.298 -1.008 1
1 20 . 20 1 1 A 5 5 GLU CA C 5 58.140 59.224 -1.084 1
1 21 . 20 1 1 A 5 5 GLU CB C 5 30.450 29.308 1.142 1
1 22 . 20 1 1 A 5 5 GLU N N 5 121.890 120.333 1.557 1
1 23 . 20 1 1 A 6 6 LEU H H 6 8.450 8.249 0.201 1
1 24 . 20 1 1 A 6 6 LEU HA H 6 4.310 4.062 0.248 1
1 25 . 20 1 1 A 6 6 LEU C C 6 176.660 178.830 -2.170 1
1 26 . 20 1 1 A 6 6 LEU CA C 6 57.310 57.807 -0.497 1
1 27 . 20 1 1 A 6 6 LEU CB C 6 42.090 41.735 0.355 1
1 28 . 20 1 1 A 6 6 LEU N N 6 120.250 120.546 -0.296 1
1 29 . 20 1 1 A 7 7 LYS H H 7 8.100 8.979 -0.879 1
1 30 . 20 1 1 A 7 7 LYS HA H 7 3.760 4.090 -0.330 1
1 31 . 20 1 1 A 7 7 LYS C C 7 176.160 179.494 -3.334 1
1 32 . 20 1 1 A 7 7 LYS CA C 7 59.110 59.884 -0.774 1
1 33 . 20 1 1 A 7 7 LYS CB C 7 32.110 32.285 -0.175 1
1 34 . 20 1 1 A 7 7 LYS N N 7 120.960 118.716 2.244 1
1 35 . 20 1 1 A 8 8 GLY H H 8 7.860 8.510 -0.650 1
1 36 . 20 1 1 A 8 8 GLY HA2 H 8 3.970 3.824 0.146 1
1 37 . 20 1 1 A 8 8 GLY HA3 H 8 3.970 3.831 0.139 1
1 38 . 20 1 1 A 8 8 GLY C C 8 175.520 176.146 -0.626 1
1 39 . 20 1 1 A 8 8 GLY CA C 8 46.490 47.461 -0.971 1
1 40 . 20 1 1 A 8 8 GLY N N 8 105.430 107.071 -1.641 1
1 41 . 20 1 1 A 9 9 ILE H H 9 8.130 9.603 -1.473 1
1 42 . 20 1 1 A 9 9 ILE HA H 9 4.140 3.933 0.207 1
1 43 . 20 1 1 A 9 9 ILE C C 9 175.320 178.085 -2.765 1
1 44 . 20 1 1 A 9 9 ILE CA C 9 65.010 64.613 0.397 1
1 45 . 20 1 1 A 9 9 ILE CB C 9 39.040 37.948 1.092 1
1 46 . 20 1 1 A 9 9 ILE N N 9 122.870 122.717 0.153 1
1 47 . 20 1 1 A 10 10 PHE H H 10 8.590 9.703 -1.113 1
1 48 . 20 1 1 A 10 10 PHE HA H 10 4.470 4.072 0.398 1
1 49 . 20 1 1 A 10 10 PHE C C 10 175.010 177.247 -2.237 1
1 50 . 20 1 1 A 10 10 PHE CA C 10 62.470 62.547 -0.077 1
1 51 . 20 1 1 A 10 10 PHE CB C 10 39.670 39.326 0.344 1
1 52 . 20 1 1 A 10 10 PHE N N 10 120.430 120.471 -0.041 1
1 53 . 20 1 1 A 11 11 GLU H H 11 8.600 8.460 0.140 1
1 54 . 20 1 1 A 11 11 GLU HA H 11 3.750 3.674 0.076 1
1 55 . 20 1 1 A 11 11 GLU C C 11 177.630 178.807 -1.177 1
1 56 . 20 1 1 A 11 11 GLU CA C 11 58.440 59.715 -1.275 1
1 57 . 20 1 1 A 11 11 GLU CB C 11 29.840 29.014 0.826 1
1 58 . 20 1 1 A 11 11 GLU N N 11 115.410 118.005 -2.595 1
1 59 . 20 1 1 A 12 12 LYS H H 12 7.940 8.685 -0.745 1
1 60 . 20 1 1 A 12 12 LYS HA H 12 4.080 3.959 0.121 1
1 61 . 20 1 1 A 12 12 LYS CA C 12 58.440 59.142 -0.702 1
1 62 . 20 1 1 A 12 12 LYS CB C 12 32.720 32.288 0.432 1
1 63 . 20 1 1 A 12 12 LYS N N 12 119.220 120.053 -0.833 1
1 64 . 20 1 1 A 13 13 TYR H H 13 7.740 7.315 0.425 1
1 65 . 20 1 1 A 13 13 TYR HA H 13 4.580 4.386 0.194 1
1 66 . 20 1 1 A 13 13 TYR C C 13 39.870 178.516 -138.646 1
1 67 . 20 1 1 A 13 13 TYR CA C 13 61.280 60.353 0.927 1
1 68 . 20 1 1 A 13 13 TYR CB C 13 175.510 39.309 136.201 1
1 69 . 20 1 1 A 13 13 TYR N N 13 115.320 117.499 -2.179 1
1 70 . 20 1 1 A 14 14 ALA H H 14 9.060 8.525 0.535 1
1 71 . 20 1 1 A 14 14 ALA HA H 14 3.850 4.079 -0.229 1
1 72 . 20 1 1 A 14 14 ALA C C 14 177.990 179.656 -1.666 1
1 73 . 20 1 1 A 14 14 ALA CA C 14 54.280 54.450 -0.170 1
1 74 . 20 1 1 A 14 14 ALA CB C 14 18.790 18.012 0.778 1
1 75 . 20 1 1 A 14 14 ALA N N 14 120.140 122.679 -2.539 1
1 76 . 20 1 1 A 15 15 ALA H H 15 7.350 8.188 -0.838 1
1 77 . 20 1 1 A 15 15 ALA HA H 15 4.550 4.097 0.453 1
1 78 . 20 1 1 A 15 15 ALA C C 15 176.270 179.085 -2.815 1
1 79 . 20 1 1 A 15 15 ALA CA C 15 52.280 54.666 -2.386 1
1 80 . 20 1 1 A 15 15 ALA CB C 15 19.670 18.655 1.015 1
1 81 . 20 1 1 A 15 15 ALA N N 15 117.640 119.697 -2.057 1
1 82 . 20 1 1 A 16 16 LYS H H 16 7.690 8.295 -0.605 1
1 83 . 20 1 1 A 16 16 LYS HA H 16 4.200 3.967 0.233 1
1 84 . 20 1 1 A 16 16 LYS C C 16 175.830 177.194 -1.364 1
1 85 . 20 1 1 A 16 16 LYS CA C 16 59.780 59.639 0.141 1
1 86 . 20 1 1 A 16 16 LYS CB C 16 33.300 32.263 1.037 1
1 87 . 20 1 1 A 16 16 LYS N N 16 120.340 117.185 3.155 1
1 88 . 20 1 1 A 17 17 GLU H H 17 10.170 7.788 2.382 1
1 89 . 20 1 1 A 17 17 GLU HA H 17 4.990 4.488 0.502 1
1 90 . 20 1 1 A 17 17 GLU C C 17 174.790 177.036 -2.246 1
1 91 . 20 1 1 A 17 17 GLU CA C 17 53.910 55.345 -1.435 1
1 92 . 20 1 1 A 17 17 GLU N N 17 116.560 118.072 -1.512 1
1 93 . 20 1 1 A 18 18 GLY H H 18 9.100 8.614 0.486 1
1 94 . 20 1 1 A 18 18 GLY N N 18 113.230 111.675 1.555 1
1 95 . 20 1 1 A 19 19 ASP H H 19 7.730 8.636 -0.906 1
1 96 . 20 1 1 A 19 19 ASP N N 19 126.280 121.601 4.679 1
1 97 . 20 1 1 A 21 21 ASN H H 21 9.090 8.501 0.589 1
1 98 . 20 1 1 A 21 21 ASN N N 21 115.850 115.995 -0.145 1
1 99 . 20 1 1 A 24 24 SER C C 24 176.120 174.582 1.538 1
1 100 . 20 1 1 A 25 25 LYS H H 25 10.400 8.572 1.828 1
1 101 . 20 1 1 A 25 25 LYS C C 25 177.600 177.889 -0.289 1
1 102 . 20 1 1 A 25 25 LYS N N 25 124.350 124.996 -0.646 1
1 103 . 20 1 1 A 26 26 GLU H H 26 9.250 8.346 0.904 1
1 104 . 20 1 1 A 26 26 GLU N N 26 118.470 117.717 0.753 1
1 105 . 20 1 1 A 27 27 GLU C C 27 178.580 178.565 0.015 1
1 106 . 20 1 1 A 27 27 GLU CA C 27 59.920 58.986 0.934 1
1 107 . 20 1 1 A 28 28 LEU H H 28 10.810 9.269 1.541 1
1 108 . 20 1 1 A 28 28 LEU C C 28 177.280 178.395 -1.115 1
1 109 . 20 1 1 A 28 28 LEU CB C 28 43.570 41.560 2.010 1
1 110 . 20 1 1 A 28 28 LEU N N 28 121.060 121.775 -0.715 1
1 111 . 20 1 1 A 29 29 LYS H H 29 9.680 8.560 1.120 1
1 112 . 20 1 1 A 29 29 LYS HA H 29 4.480 3.922 0.558 1
1 113 . 20 1 1 A 29 29 LYS C C 29 176.670 178.640 -1.970 1
1 114 . 20 1 1 A 29 29 LYS CA C 29 60.770 59.989 0.781 1
1 115 . 20 1 1 A 29 29 LYS CB C 29 32.910 32.541 0.369 1
1 116 . 20 1 1 A 29 29 LYS N N 29 121.140 119.139 2.001 1
1 117 . 20 1 1 A 30 30 LEU H H 30 8.410 7.796 0.614 1
1 118 . 20 1 1 A 30 30 LEU CA C 30 57.730 57.771 -0.041 1
1 119 . 20 1 1 A 30 30 LEU CB C 30 42.570 41.896 0.674 1
1 120 . 20 1 1 A 30 30 LEU N N 30 119.000 119.463 -0.463 1
1 121 . 20 1 1 A 31 31 LEU H H 31 9.010 7.393 1.617 1
1 122 . 20 1 1 A 31 31 LEU HA H 31 2.920 3.608 -0.688 1
1 123 . 20 1 1 A 31 31 LEU C C 31 178.280 178.318 -0.038 1
1 124 . 20 1 1 A 31 31 LEU CA C 31 59.030 58.395 0.635 1
1 125 . 20 1 1 A 31 31 LEU N N 31 124.840 119.539 5.301 1
1 126 . 20 1 1 A 32 32 LEU H H 32 9.680 8.904 0.776 1
1 127 . 20 1 1 A 32 32 LEU HA H 32 4.490 4.055 0.435 1
1 128 . 20 1 1 A 32 32 LEU C C 32 177.360 179.807 -2.447 1
1 129 . 20 1 1 A 32 32 LEU CA C 32 58.520 57.272 1.248 1
1 130 . 20 1 1 A 32 32 LEU CB C 32 42.760 41.508 1.252 1
1 131 . 20 1 1 A 32 32 LEU N N 32 120.580 119.035 1.545 1
1 132 . 20 1 1 A 33 33 GLN H H 33 9.140 8.154 0.986 1
1 133 . 20 1 1 A 33 33 GLN HA H 33 4.250 4.142 0.108 1
1 134 . 20 1 1 A 33 33 GLN C C 33 176.050 178.501 -2.451 1
1 135 . 20 1 1 A 33 33 GLN CA C 33 58.600 58.782 -0.182 1
1 136 . 20 1 1 A 33 33 GLN CB C 33 29.730 28.621 1.109 1
1 137 . 20 1 1 A 33 33 GLN N N 33 115.010 119.729 -4.719 1
1 138 . 20 1 1 A 34 34 THR H H 34 8.000 7.939 0.061 1
1 139 . 20 1 1 A 34 34 THR HA H 34 4.390 4.033 0.357 1
1 140 . 20 1 1 A 34 34 THR C C 34 174.130 175.921 -1.791 1
1 141 . 20 1 1 A 34 34 THR CA C 34 65.250 66.426 -1.176 1
1 142 . 20 1 1 A 34 34 THR CB C 34 69.920 69.166 0.754 1
1 143 . 20 1 1 A 34 34 THR N N 34 111.180 114.556 -3.376 1
1 144 . 20 1 1 A 35 35 GLU H H 35 8.810 8.695 0.115 1
1 145 . 20 1 1 A 35 35 GLU HA H 35 4.470 4.042 0.428 1
1 146 . 20 1 1 A 35 35 GLU C C 35 175.430 176.322 -0.892 1
1 147 . 20 1 1 A 35 35 GLU CA C 35 56.170 59.285 -3.115 1
1 148 . 20 1 1 A 35 35 GLU CB C 35 30.900 29.861 1.039 1
1 149 . 20 1 1 A 35 35 GLU N N 35 116.410 121.740 -5.330 1
1 150 . 20 1 1 A 36 36 PHE H H 36 8.230 8.004 0.226 1
1 151 . 20 1 1 A 36 36 PHE HA H 36 5.500 5.090 0.410 1
1 152 . 20 1 1 A 36 36 PHE N N 36 115.090 115.670 -0.580 1
1 153 . 20 1 1 A 37 37 PRO C C 37 178.140 177.875 0.265 1
1 154 . 20 1 1 A 37 37 PRO CA C 37 64.940 64.483 0.457 1
1 155 . 20 1 1 A 37 37 PRO CB C 37 31.600 31.989 -0.389 1
1 156 . 20 1 1 A 38 38 SER H H 38 8.660 8.511 0.149 1
1 157 . 20 1 1 A 38 38 SER HA H 38 4.500 4.269 0.231 1
1 158 . 20 1 1 A 38 38 SER C C 38 174.830 176.933 -2.103 1
1 159 . 20 1 1 A 38 38 SER CA C 38 59.970 61.423 -1.453 1
1 160 . 20 1 1 A 38 38 SER CB C 38 62.690 63.084 -0.394 1
1 161 . 20 1 1 A 38 38 SER N N 38 114.030 114.123 -0.093 1
1 162 . 20 1 1 A 39 39 LEU H H 39 8.260 8.170 0.090 1
1 163 . 20 1 1 A 39 39 LEU HA H 39 4.520 4.107 0.413 1
1 164 . 20 1 1 A 39 39 LEU C C 39 176.780 180.018 -3.238 1
1 165 . 20 1 1 A 39 39 LEU CA C 39 56.600 57.258 -0.658 1
1 166 . 20 1 1 A 39 39 LEU CB C 39 42.610 41.441 1.169 1
1 167 . 20 1 1 A 39 39 LEU N N 39 122.650 121.928 0.722 1
1 168 . 20 1 1 A 40 40 LEU H H 40 8.070 8.120 -0.050 1
1 169 . 20 1 1 A 40 40 LEU HA H 40 4.830 4.051 0.779 1
1 170 . 20 1 1 A 40 40 LEU C C 40 175.690 179.281 -3.591 1
1 171 . 20 1 1 A 40 40 LEU CA C 40 54.510 57.918 -3.408 1
1 172 . 20 1 1 A 40 40 LEU CB C 40 42.020 41.158 0.862 1
1 173 . 20 1 1 A 40 40 LEU N N 40 117.390 119.488 -2.098 1
1 174 . 20 1 1 A 41 41 LYS H H 41 7.770 7.936 -0.166 1
1 175 . 20 1 1 A 41 41 LYS HA H 41 4.610 4.146 0.464 1
1 176 . 20 1 1 A 41 41 LYS C C 41 175.380 177.442 -2.062 1
1 177 . 20 1 1 A 41 41 LYS CA C 41 56.170 58.703 -2.533 1
1 178 . 20 1 1 A 41 41 LYS CB C 41 32.950 31.806 1.144 1
1 179 . 20 1 1 A 41 41 LYS N N 41 120.530 117.752 2.778 1
1 180 . 20 1 1 A 42 42 GLY H H 42 8.390 7.795 0.595 1
1 181 . 20 1 1 A 42 42 GLY HA2 H 42 4.280 4.062 0.218 1
1 182 . 20 1 1 A 42 42 GLY HA3 H 42 4.280 4.064 0.216 1
1 183 . 20 1 1 A 42 42 GLY C C 42 177.190 174.937 2.253 1
1 184 . 20 1 1 A 42 42 GLY N N 42 109.280 108.338 0.942 1
1 185 . 20 1 1 A 43 43 MET H H 43 9.020 8.570 0.450 1
1 186 . 20 1 1 A 43 43 MET C C 43 175.520 175.935 -0.415 1
1 187 . 20 1 1 A 43 43 MET N N 43 121.110 119.134 1.976 1
1 188 . 20 1 1 A 44 44 SER H H 44 8.700 7.784 0.916 1
1 189 . 20 1 1 A 44 44 SER C C 44 173.540 174.116 -0.576 1
1 190 . 20 1 1 A 44 44 SER N N 44 116.190 116.771 -0.581 1
1 191 . 20 1 1 A 45 45 THR H H 45 8.440 8.711 -0.271 1
1 192 . 20 1 1 A 45 45 THR C C 45 174.300 175.297 -0.997 1
1 193 . 20 1 1 A 45 45 THR N N 45 113.740 119.293 -5.553 1
1 194 . 20 1 1 A 46 46 LEU H H 46 9.380 8.816 0.564 1
1 195 . 20 1 1 A 46 46 LEU C C 46 177.760 178.153 -0.393 1
1 196 . 20 1 1 A 46 46 LEU N N 46 123.970 123.473 0.497 1
1 197 . 20 1 1 A 47 47 ASP H H 47 8.990 8.548 0.442 1
1 198 . 20 1 1 A 47 47 ASP N N 47 118.620 118.042 0.578 1
1 199 . 20 1 1 A 49 49 LEU H H 49 9.740 8.275 1.465 1
1 200 . 20 1 1 A 49 49 LEU N N 49 123.880 120.921 2.959 1
1 201 . 20 1 1 A 50 50 PHE H H 50 10.730 8.869 1.861 1
1 202 . 20 1 1 A 50 50 PHE N N 50 121.380 119.381 1.999 1
1 203 . 20 1 1 A 51 51 GLU H H 51 7.860 8.699 -0.839 1
1 204 . 20 1 1 A 51 51 GLU HA H 51 3.530 4.046 -0.516 1
1 205 . 20 1 1 A 51 51 GLU N N 51 114.870 118.636 -3.766 1
1 206 . 20 1 1 A 66 66 PHE CA C 66 58.850 61.218 -2.368 1
1 207 . 20 1 1 A 67 67 GLN H H 67 5.670 8.874 -3.204 1
1 208 . 20 1 1 A 67 67 GLN C C 67 174.810 177.981 -3.171 1
1 209 . 20 1 1 A 67 67 GLN CA C 67 56.340 58.058 -1.718 1
1 210 . 20 1 1 A 67 67 GLN N N 67 114.050 117.613 -3.563 1
1 211 . 20 1 1 A 68 68 VAL H H 68 5.760 7.352 -1.592 1
1 212 . 20 1 1 A 68 68 VAL C C 68 175.770 178.402 -2.632 1
1 213 . 20 1 1 A 68 68 VAL CA C 68 63.990 65.652 -1.662 1
1 214 . 20 1 1 A 68 68 VAL CB C 68 31.310 31.681 -0.371 1
1 215 . 20 1 1 A 68 68 VAL N N 68 116.280 119.542 -3.262 1
1 216 . 20 1 1 A 69 69 LEU H H 69 7.150 8.565 -1.415 1
1 217 . 20 1 1 A 69 69 LEU HA H 69 4.040 4.009 0.031 1
1 218 . 20 1 1 A 69 69 LEU C C 69 176.210 178.302 -2.092 1
1 219 . 20 1 1 A 69 69 LEU CA C 69 56.270 57.271 -1.001 1
1 220 . 20 1 1 A 69 69 LEU CB C 69 42.010 41.921 0.089 1
1 221 . 20 1 1 A 69 69 LEU N N 69 120.350 121.646 -1.296 1
1 222 . 20 1 1 A 70 70 VAL H H 70 6.810 7.239 -0.429 1
1 223 . 20 1 1 A 70 70 VAL HA H 70 3.170 3.265 -0.095 1
1 224 . 20 1 1 A 70 70 VAL C C 70 175.760 177.701 -1.941 1
1 225 . 20 1 1 A 70 70 VAL CA C 70 65.110 66.732 -1.622 1
1 226 . 20 1 1 A 70 70 VAL CB C 70 31.190 30.942 0.248 1
1 227 . 20 1 1 A 70 70 VAL N N 70 115.790 118.717 -2.927 1
1 228 . 20 1 1 A 71 71 LYS H H 71 7.190 8.503 -1.313 1
1 229 . 20 1 1 A 71 71 LYS HA H 71 3.880 3.878 0.002 1
1 230 . 20 1 1 A 71 71 LYS C C 71 176.100 179.120 -3.020 1
1 231 . 20 1 1 A 71 71 LYS CA C 71 57.680 59.382 -1.702 1
1 232 . 20 1 1 A 71 71 LYS CB C 71 31.930 32.179 -0.249 1
1 233 . 20 1 1 A 71 71 LYS N N 71 117.820 119.854 -2.034 1
1 234 . 20 1 1 A 72 72 LYS H H 72 7.450 7.253 0.197 1
1 235 . 20 1 1 A 72 72 LYS HA H 72 4.180 4.058 0.122 1
1 236 . 20 1 1 A 72 72 LYS C C 72 176.180 179.222 -3.042 1
1 237 . 20 1 1 A 72 72 LYS CA C 72 56.950 58.209 -1.259 1
1 238 . 20 1 1 A 72 72 LYS CB C 72 33.610 31.830 1.780 1
1 239 . 20 1 1 A 72 72 LYS N N 72 116.930 117.927 -0.997 1
1 240 . 20 1 1 A 73 73 ILE H H 73 7.440 7.892 -0.452 1
1 241 . 20 1 1 A 73 73 ILE HA H 73 4.180 3.577 0.603 1
1 242 . 20 1 1 A 73 73 ILE C C 73 174.440 178.239 -3.799 1
1 243 . 20 1 1 A 73 73 ILE CA C 73 61.510 64.508 -2.998 1
1 244 . 20 1 1 A 73 73 ILE CB C 73 38.610 37.374 1.236 1
1 245 . 20 1 1 A 73 73 ILE N N 73 114.560 121.524 -6.964 1
1 246 . 20 1 1 A 74 74 SER H H 74 7.790 8.680 -0.890 1
1 247 . 20 1 1 A 74 74 SER HA H 74 4.520 4.146 0.374 1
1 248 . 20 1 1 A 74 74 SER C C 74 171.580 177.491 -5.911 1
1 249 . 20 1 1 A 74 74 SER CA C 74 57.960 61.265 -3.305 1
1 250 . 20 1 1 A 74 74 SER CB C 74 63.820 62.919 0.901 1
1 251 . 20 1 1 A 74 74 SER N N 74 117.310 116.093 1.217 1
stop_
loop_
_SPARTA_output.Data_ID
_SPARTA_output.Assigned_chem_shift_list_ID
_SPARTA_output.Conformer_ID
_SPARTA_output.Entity_ID
_SPARTA_output.Data_type
_SPARTA_output.Data_atom
_SPARTA_output.Data_num_shifts
_SPARTA_output.Data_value
_SPARTA_output.Entity_delta_chem_shifts_ID
1 1 1 1 "RMS(OBS, PRED)" C 42 21.724 1
2 1 1 1 "RMS(OBS, PRED)" CA 36 1.640 1
3 1 1 1 "RMS(OBS, PRED)" CB 32 24.479 1
4 1 1 1 "RMS(OBS, PRED)" H 50 1.039 1
5 1 1 1 "RMS(OBS, PRED)" HA 36 0.375 1
6 1 1 1 "RMS(OBS, PRED)" N 50 2.704 1
7 1 2 1 "RMS(OBS, PRED)" C 42 21.724 1
8 1 2 1 "RMS(OBS, PRED)" CA 36 1.640 1
9 1 2 1 "RMS(OBS, PRED)" CB 32 24.479 1
10 1 2 1 "RMS(OBS, PRED)" H 50 1.039 1
11 1 2 1 "RMS(OBS, PRED)" HA 36 0.375 1
12 1 2 1 "RMS(OBS, PRED)" N 50 2.704 1
13 1 3 1 "RMS(OBS, PRED)" C 42 21.730 1
14 1 3 1 "RMS(OBS, PRED)" CA 36 1.622 1
15 1 3 1 "RMS(OBS, PRED)" CB 32 24.489 1
16 1 3 1 "RMS(OBS, PRED)" H 50 0.990 1
17 1 3 1 "RMS(OBS, PRED)" HA 36 0.366 1
18 1 3 1 "RMS(OBS, PRED)" N 50 2.679 1
19 1 4 1 "RMS(OBS, PRED)" C 42 21.730 1
20 1 4 1 "RMS(OBS, PRED)" CA 36 1.622 1
21 1 4 1 "RMS(OBS, PRED)" CB 32 24.489 1
22 1 4 1 "RMS(OBS, PRED)" H 50 0.990 1
23 1 4 1 "RMS(OBS, PRED)" HA 36 0.366 1
24 1 4 1 "RMS(OBS, PRED)" N 50 2.679 1
25 1 5 1 "RMS(OBS, PRED)" C 42 21.727 1
26 1 5 1 "RMS(OBS, PRED)" CA 36 1.484 1
27 1 5 1 "RMS(OBS, PRED)" CB 32 24.492 1
28 1 5 1 "RMS(OBS, PRED)" H 50 1.056 1
29 1 5 1 "RMS(OBS, PRED)" HA 36 0.346 1
30 1 5 1 "RMS(OBS, PRED)" N 50 2.655 1
31 1 6 1 "RMS(OBS, PRED)" C 42 21.727 1
32 1 6 1 "RMS(OBS, PRED)" CA 36 1.484 1
33 1 6 1 "RMS(OBS, PRED)" CB 32 24.492 1
34 1 6 1 "RMS(OBS, PRED)" H 50 1.056 1
35 1 6 1 "RMS(OBS, PRED)" HA 36 0.346 1
36 1 6 1 "RMS(OBS, PRED)" N 50 2.655 1
37 1 7 1 "RMS(OBS, PRED)" C 42 21.760 1
38 1 7 1 "RMS(OBS, PRED)" CA 36 1.679 1
39 1 7 1 "RMS(OBS, PRED)" CB 32 24.486 1
40 1 7 1 "RMS(OBS, PRED)" H 50 0.973 1
41 1 7 1 "RMS(OBS, PRED)" HA 36 0.365 1
42 1 7 1 "RMS(OBS, PRED)" N 50 2.677 1
43 1 8 1 "RMS(OBS, PRED)" C 42 21.760 1
44 1 8 1 "RMS(OBS, PRED)" CA 36 1.679 1
45 1 8 1 "RMS(OBS, PRED)" CB 32 24.486 1
46 1 8 1 "RMS(OBS, PRED)" H 50 0.973 1
47 1 8 1 "RMS(OBS, PRED)" HA 36 0.365 1
48 1 8 1 "RMS(OBS, PRED)" N 50 2.677 1
49 1 9 1 "RMS(OBS, PRED)" C 42 21.772 1
50 1 9 1 "RMS(OBS, PRED)" CA 36 1.631 1
51 1 9 1 "RMS(OBS, PRED)" CB 32 24.482 1
52 1 9 1 "RMS(OBS, PRED)" H 50 1.009 1
53 1 9 1 "RMS(OBS, PRED)" HA 36 0.369 1
54 1 9 1 "RMS(OBS, PRED)" N 50 2.562 1
55 1 10 1 "RMS(OBS, PRED)" C 42 21.772 1
56 1 10 1 "RMS(OBS, PRED)" CA 36 1.631 1
57 1 10 1 "RMS(OBS, PRED)" CB 32 24.482 1
58 1 10 1 "RMS(OBS, PRED)" H 50 1.009 1
59 1 10 1 "RMS(OBS, PRED)" HA 36 0.369 1
60 1 10 1 "RMS(OBS, PRED)" N 50 2.562 1
61 1 11 1 "RMS(OBS, PRED)" C 42 21.732 1
62 1 11 1 "RMS(OBS, PRED)" CA 36 1.633 1
63 1 11 1 "RMS(OBS, PRED)" CB 32 24.488 1
64 1 11 1 "RMS(OBS, PRED)" H 50 0.975 1
65 1 11 1 "RMS(OBS, PRED)" HA 36 0.364 1
66 1 11 1 "RMS(OBS, PRED)" N 50 2.693 1
67 1 12 1 "RMS(OBS, PRED)" C 42 21.732 1
68 1 12 1 "RMS(OBS, PRED)" CA 36 1.633 1
69 1 12 1 "RMS(OBS, PRED)" CB 32 24.488 1
70 1 12 1 "RMS(OBS, PRED)" H 50 0.975 1
71 1 12 1 "RMS(OBS, PRED)" HA 36 0.364 1
72 1 12 1 "RMS(OBS, PRED)" N 50 2.693 1
73 1 13 1 "RMS(OBS, PRED)" C 42 21.732 1
74 1 13 1 "RMS(OBS, PRED)" CA 36 1.632 1
75 1 13 1 "RMS(OBS, PRED)" CB 32 24.486 1
76 1 13 1 "RMS(OBS, PRED)" H 50 0.952 1
77 1 13 1 "RMS(OBS, PRED)" HA 36 0.380 1
78 1 13 1 "RMS(OBS, PRED)" N 50 2.689 1
79 1 14 1 "RMS(OBS, PRED)" C 42 21.732 1
80 1 14 1 "RMS(OBS, PRED)" CA 36 1.632 1
81 1 14 1 "RMS(OBS, PRED)" CB 32 24.486 1
82 1 14 1 "RMS(OBS, PRED)" H 50 0.952 1
83 1 14 1 "RMS(OBS, PRED)" HA 36 0.380 1
84 1 14 1 "RMS(OBS, PRED)" N 50 2.689 1
85 1 15 1 "RMS(OBS, PRED)" C 42 21.747 1
86 1 15 1 "RMS(OBS, PRED)" CA 36 1.641 1
87 1 15 1 "RMS(OBS, PRED)" CB 32 24.485 1
88 1 15 1 "RMS(OBS, PRED)" H 50 0.966 1
89 1 15 1 "RMS(OBS, PRED)" HA 36 0.365 1
90 1 15 1 "RMS(OBS, PRED)" N 50 2.664 1
91 1 16 1 "RMS(OBS, PRED)" C 42 21.747 1
92 1 16 1 "RMS(OBS, PRED)" CA 36 1.641 1
93 1 16 1 "RMS(OBS, PRED)" CB 32 24.485 1
94 1 16 1 "RMS(OBS, PRED)" H 50 0.966 1
95 1 16 1 "RMS(OBS, PRED)" HA 36 0.365 1
96 1 16 1 "RMS(OBS, PRED)" N 50 2.664 1
97 1 17 1 "RMS(OBS, PRED)" C 42 21.739 1
98 1 17 1 "RMS(OBS, PRED)" CA 36 1.612 1
99 1 17 1 "RMS(OBS, PRED)" CB 32 24.484 1
100 1 17 1 "RMS(OBS, PRED)" H 50 0.957 1
101 1 17 1 "RMS(OBS, PRED)" HA 36 0.364 1
102 1 17 1 "RMS(OBS, PRED)" N 50 2.665 1
103 1 18 1 "RMS(OBS, PRED)" C 42 21.739 1
104 1 18 1 "RMS(OBS, PRED)" CA 36 1.612 1
105 1 18 1 "RMS(OBS, PRED)" CB 32 24.484 1
106 1 18 1 "RMS(OBS, PRED)" H 50 0.957 1
107 1 18 1 "RMS(OBS, PRED)" HA 36 0.364 1
108 1 18 1 "RMS(OBS, PRED)" N 50 2.665 1
109 1 19 1 "RMS(OBS, PRED)" C 42 21.769 1
110 1 19 1 "RMS(OBS, PRED)" CA 36 1.591 1
111 1 19 1 "RMS(OBS, PRED)" CB 32 24.479 1
112 1 19 1 "RMS(OBS, PRED)" H 50 1.042 1
113 1 19 1 "RMS(OBS, PRED)" HA 36 0.359 1
114 1 19 1 "RMS(OBS, PRED)" N 50 2.707 1
115 1 20 1 "RMS(OBS, PRED)" C 42 21.769 1
116 1 20 1 "RMS(OBS, PRED)" CA 36 1.591 1
117 1 20 1 "RMS(OBS, PRED)" CB 32 24.479 1
118 1 20 1 "RMS(OBS, PRED)" H 50 1.042 1
119 1 20 1 "RMS(OBS, PRED)" HA 36 0.359 1
120 1 20 1 "RMS(OBS, PRED)" N 50 2.707 1
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.Conformer_type "average"
_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.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_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.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 6 . 1 1 A 2 2 SER H H 2 9.010 8.387 0.623 2
1 7 . 1 1 A 2 2 SER HA H 2 4.680 4.603 0.077 2
1 8 . 1 1 A 2 2 SER N N 2 119.390 116.991 2.399 2
1 9 . 1 1 A 3 3 PRO C C 3 177.630 178.813 -1.183 2
1 10 . 1 1 A 3 3 PRO CA C 3 65.000 64.936 0.064 2
1 11 . 1 1 A 3 3 PRO CB C 3 31.790 32.122 -0.332 2
1 12 . 1 1 A 4 4 GLU H H 4 8.600 8.373 0.227 2
1 13 . 1 1 A 4 4 GLU HA H 4 3.900 4.100 -0.200 2
1 14 . 1 1 A 4 4 GLU C C 4 177.910 179.369 -1.458 2
1 15 . 1 1 A 4 4 GLU CB C 4 28.980 29.139 -0.159 2
1 16 . 1 1 A 4 4 GLU N N 4 117.750 117.835 -0.085 2
1 17 . 1 1 A 5 5 GLU H H 5 7.980 8.118 -0.138 2
1 18 . 1 1 A 5 5 GLU HA H 5 4.170 4.071 0.099 2
1 19 . 1 1 A 5 5 GLU C C 5 178.290 179.255 -0.965 2
1 20 . 1 1 A 5 5 GLU CA C 5 58.140 59.200 -1.060 2
1 21 . 1 1 A 5 5 GLU CB C 5 30.450 29.326 1.124 2
1 22 . 1 1 A 5 5 GLU N N 5 121.890 120.256 1.634 2
1 23 . 1 1 A 6 6 LEU H H 6 8.450 8.101 0.349 2
1 24 . 1 1 A 6 6 LEU HA H 6 4.310 4.008 0.302 2
1 25 . 1 1 A 6 6 LEU C C 6 176.660 178.815 -2.155 2
1 26 . 1 1 A 6 6 LEU CA C 6 57.310 57.778 -0.468 2
1 27 . 1 1 A 6 6 LEU CB C 6 42.090 41.731 0.359 2
1 28 . 1 1 A 6 6 LEU N N 6 120.250 120.588 -0.337 2
1 29 . 1 1 A 7 7 LYS H H 7 8.100 8.965 -0.865 2
1 30 . 1 1 A 7 7 LYS HA H 7 3.760 4.108 -0.348 2
1 31 . 1 1 A 7 7 LYS C C 7 176.160 179.526 -3.366 2
1 32 . 1 1 A 7 7 LYS CA C 7 59.110 59.906 -0.796 2
1 33 . 1 1 A 7 7 LYS CB C 7 32.110 32.386 -0.276 2
1 34 . 1 1 A 7 7 LYS N N 7 120.960 118.562 2.398 2
1 35 . 1 1 A 8 8 GLY H H 8 7.860 8.651 -0.791 2
1 36 . 1 1 A 8 8 GLY HA2 H 8 3.970 3.804 0.166 2
1 37 . 1 1 A 8 8 GLY HA3 H 8 3.970 3.820 0.150 2
1 38 . 1 1 A 8 8 GLY C C 8 175.520 176.215 -0.695 2
1 39 . 1 1 A 8 8 GLY CA C 8 46.490 47.434 -0.944 2
1 40 . 1 1 A 8 8 GLY N N 8 105.430 107.119 -1.689 2
1 41 . 1 1 A 9 9 ILE H H 9 8.130 9.272 -1.142 2
1 42 . 1 1 A 9 9 ILE HA H 9 4.140 3.917 0.223 2
1 43 . 1 1 A 9 9 ILE C C 9 175.320 178.002 -2.682 2
1 44 . 1 1 A 9 9 ILE CA C 9 65.010 64.651 0.359 2
1 45 . 1 1 A 9 9 ILE CB C 9 39.040 37.951 1.089 2
1 46 . 1 1 A 9 9 ILE N N 9 122.870 122.609 0.261 2
1 47 . 1 1 A 10 10 PHE H H 10 8.590 9.213 -0.623 2
1 48 . 1 1 A 10 10 PHE HA H 10 4.470 3.925 0.545 2
1 49 . 1 1 A 10 10 PHE C C 10 175.010 177.208 -2.198 2
1 50 . 1 1 A 10 10 PHE CA C 10 62.470 62.446 0.024 2
1 51 . 1 1 A 10 10 PHE CB C 10 39.670 39.196 0.474 2
1 52 . 1 1 A 10 10 PHE N N 10 120.430 120.491 -0.061 2
1 53 . 1 1 A 11 11 GLU H H 11 8.600 8.564 0.036 2
1 54 . 1 1 A 11 11 GLU HA H 11 3.750 3.768 -0.018 2
1 55 . 1 1 A 11 11 GLU C C 11 177.630 178.784 -1.154 2
1 56 . 1 1 A 11 11 GLU CA C 11 58.440 59.721 -1.281 2
1 57 . 1 1 A 11 11 GLU CB C 11 29.840 29.110 0.729 2
1 58 . 1 1 A 11 11 GLU N N 11 115.410 118.173 -2.763 2
1 59 . 1 1 A 12 12 LYS H H 12 7.940 8.739 -0.799 2
1 60 . 1 1 A 12 12 LYS HA H 12 4.080 3.991 0.089 2
1 61 . 1 1 A 12 12 LYS CA C 12 58.440 59.066 -0.626 2
1 62 . 1 1 A 12 12 LYS CB C 12 32.720 32.326 0.394 2
1 63 . 1 1 A 12 12 LYS N N 12 119.220 120.117 -0.897 2
1 64 . 1 1 A 13 13 TYR H H 13 7.740 7.389 0.351 2
1 65 . 1 1 A 13 13 TYR HA H 13 4.580 4.363 0.217 2
1 66 . 1 1 A 13 13 TYR C C 13 39.870 178.363 -138.493 2
1 67 . 1 1 A 13 13 TYR CA C 13 61.280 60.315 0.965 2
1 68 . 1 1 A 13 13 TYR CB C 13 175.510 39.278 136.232 2
1 69 . 1 1 A 13 13 TYR N N 13 115.320 117.344 -2.024 2
1 70 . 1 1 A 14 14 ALA H H 14 9.060 8.720 0.340 2
1 71 . 1 1 A 14 14 ALA HA H 14 3.850 3.881 -0.031 2
1 72 . 1 1 A 14 14 ALA C C 14 177.990 179.791 -1.801 2
1 73 . 1 1 A 14 14 ALA CA C 14 54.280 54.720 -0.440 2
1 74 . 1 1 A 14 14 ALA CB C 14 18.790 17.731 1.059 2
1 75 . 1 1 A 14 14 ALA N N 14 120.140 122.661 -2.521 2
1 76 . 1 1 A 15 15 ALA H H 15 7.350 8.478 -1.128 2
1 77 . 1 1 A 15 15 ALA HA H 15 4.550 4.033 0.517 2
1 78 . 1 1 A 15 15 ALA C C 15 176.270 179.277 -3.007 2
1 79 . 1 1 A 15 15 ALA CA C 15 52.280 54.977 -2.697 2
1 80 . 1 1 A 15 15 ALA CB C 15 19.670 18.322 1.348 2
1 81 . 1 1 A 15 15 ALA N N 15 117.640 120.032 -2.393 2
1 82 . 1 1 A 16 16 LYS H H 16 7.690 8.081 -0.391 2
1 83 . 1 1 A 16 16 LYS HA H 16 4.200 4.022 0.178 2
1 84 . 1 1 A 16 16 LYS C C 16 175.830 177.067 -1.237 2
1 85 . 1 1 A 16 16 LYS CA C 16 59.780 59.628 0.152 2
1 86 . 1 1 A 16 16 LYS CB C 16 33.300 32.275 1.025 2
1 87 . 1 1 A 16 16 LYS N N 16 120.340 117.210 3.130 2
1 88 . 1 1 A 17 17 GLU H H 17 10.170 8.063 2.107 2
1 89 . 1 1 A 17 17 GLU HA H 17 4.990 4.479 0.511 2
1 90 . 1 1 A 17 17 GLU C C 17 174.790 176.885 -2.095 2
1 91 . 1 1 A 17 17 GLU CA C 17 53.910 55.335 -1.425 2
1 92 . 1 1 A 17 17 GLU N N 17 116.560 118.040 -1.480 2
1 93 . 1 1 A 18 18 GLY H H 18 9.100 8.562 0.538 2
1 94 . 1 1 A 18 18 GLY N N 18 113.230 111.361 1.869 2
1 95 . 1 1 A 19 19 ASP H H 19 7.730 8.566 -0.836 2
1 96 . 1 1 A 19 19 ASP N N 19 126.280 121.352 4.928 2
1 97 . 1 1 A 21 21 ASN H H 21 9.090 8.248 0.842 2
1 98 . 1 1 A 21 21 ASN N N 21 115.850 115.386 0.464 2
1 99 . 1 1 A 24 24 SER C C 24 176.120 174.580 1.540 2
1 100 . 1 1 A 25 25 LYS H H 25 10.400 8.577 1.823 2
1 101 . 1 1 A 25 25 LYS C C 25 177.600 177.874 -0.273 2
1 102 . 1 1 A 25 25 LYS N N 25 124.350 124.980 -0.630 2
1 103 . 1 1 A 26 26 GLU H H 26 9.250 8.348 0.902 2
1 104 . 1 1 A 26 26 GLU N N 26 118.470 117.711 0.759 2
1 105 . 1 1 A 27 27 GLU C C 27 178.580 178.618 -0.038 2
1 106 . 1 1 A 27 27 GLU CA C 27 59.920 59.071 0.849 2
1 107 . 1 1 A 28 28 LEU H H 28 10.810 9.194 1.616 2
1 108 . 1 1 A 28 28 LEU C C 28 177.280 178.480 -1.200 2
1 109 . 1 1 A 28 28 LEU CB C 28 43.570 41.626 1.944 2
1 110 . 1 1 A 28 28 LEU N N 28 121.060 121.823 -0.763 2
1 111 . 1 1 A 29 29 LYS H H 29 9.680 8.524 1.157 2
1 112 . 1 1 A 29 29 LYS HA H 29 4.480 3.951 0.529 2
1 113 . 1 1 A 29 29 LYS C C 29 176.670 178.685 -2.015 2
1 114 . 1 1 A 29 29 LYS CA C 29 60.770 60.028 0.742 2
1 115 . 1 1 A 29 29 LYS CB C 29 32.910 32.501 0.409 2
1 116 . 1 1 A 29 29 LYS N N 29 121.140 119.209 1.931 2
1 117 . 1 1 A 30 30 LEU H H 30 8.410 7.846 0.564 2
1 118 . 1 1 A 30 30 LEU CA C 30 57.730 57.865 -0.135 2
1 119 . 1 1 A 30 30 LEU CB C 30 42.570 41.978 0.592 2
1 120 . 1 1 A 30 30 LEU N N 30 119.000 119.523 -0.523 2
1 121 . 1 1 A 31 31 LEU H H 31 9.010 7.744 1.266 2
1 122 . 1 1 A 31 31 LEU HA H 31 2.920 3.582 -0.662 2
1 123 . 1 1 A 31 31 LEU C C 31 178.280 178.232 0.048 2
1 124 . 1 1 A 31 31 LEU CA C 31 59.030 58.433 0.597 2
1 125 . 1 1 A 31 31 LEU N N 31 124.840 119.710 5.130 2
1 126 . 1 1 A 32 32 LEU H H 32 9.680 8.937 0.743 2
1 127 . 1 1 A 32 32 LEU HA H 32 4.490 4.072 0.418 2
1 128 . 1 1 A 32 32 LEU C C 32 177.360 179.758 -2.398 2
1 129 . 1 1 A 32 32 LEU CA C 32 58.520 57.268 1.252 2
1 130 . 1 1 A 32 32 LEU CB C 32 42.760 41.525 1.235 2
1 131 . 1 1 A 32 32 LEU N N 32 120.580 119.046 1.534 2
1 132 . 1 1 A 33 33 GLN H H 33 9.140 8.175 0.965 2
1 133 . 1 1 A 33 33 GLN HA H 33 4.250 4.140 0.110 2
1 134 . 1 1 A 33 33 GLN C C 33 176.050 178.269 -2.219 2
1 135 . 1 1 A 33 33 GLN CA C 33 58.600 58.807 -0.207 2
1 136 . 1 1 A 33 33 GLN CB C 33 29.730 28.595 1.135 2
1 137 . 1 1 A 33 33 GLN N N 33 115.010 119.737 -4.727 2
1 138 . 1 1 A 34 34 THR H H 34 8.000 7.965 0.035 2
1 139 . 1 1 A 34 34 THR HA H 34 4.390 4.048 0.342 2
1 140 . 1 1 A 34 34 THR C C 34 174.130 175.941 -1.811 2
1 141 . 1 1 A 34 34 THR CA C 34 65.250 66.301 -1.051 2
1 142 . 1 1 A 34 34 THR CB C 34 69.920 69.155 0.765 2
1 143 . 1 1 A 34 34 THR N N 34 111.180 114.697 -3.517 2
1 144 . 1 1 A 35 35 GLU H H 35 8.810 8.649 0.161 2
1 145 . 1 1 A 35 35 GLU HA H 35 4.470 4.028 0.442 2
1 146 . 1 1 A 35 35 GLU C C 35 175.430 176.275 -0.845 2
1 147 . 1 1 A 35 35 GLU CA C 35 56.170 59.270 -3.101 2
1 148 . 1 1 A 35 35 GLU CB C 35 30.900 29.843 1.057 2
1 149 . 1 1 A 35 35 GLU N N 35 116.410 121.700 -5.290 2
1 150 . 1 1 A 36 36 PHE H H 36 8.230 8.001 0.229 2
1 151 . 1 1 A 36 36 PHE HA H 36 5.500 5.083 0.417 2
1 152 . 1 1 A 36 36 PHE N N 36 115.090 115.752 -0.662 2
1 153 . 1 1 A 37 37 PRO C C 37 178.140 177.826 0.314 2
1 154 . 1 1 A 37 37 PRO CA C 37 64.940 64.444 0.496 2
1 155 . 1 1 A 37 37 PRO CB C 37 31.600 31.956 -0.356 2
1 156 . 1 1 A 38 38 SER H H 38 8.660 8.424 0.236 2
1 157 . 1 1 A 38 38 SER HA H 38 4.500 4.299 0.201 2
1 158 . 1 1 A 38 38 SER C C 38 174.830 177.077 -2.247 2
1 159 . 1 1 A 38 38 SER CA C 38 59.970 61.068 -1.098 2
1 160 . 1 1 A 38 38 SER CB C 38 62.690 63.031 -0.341 2
1 161 . 1 1 A 38 38 SER N N 38 114.030 113.520 0.510 2
1 162 . 1 1 A 39 39 LEU H H 39 8.260 8.075 0.185 2
1 163 . 1 1 A 39 39 LEU HA H 39 4.520 4.111 0.409 2
1 164 . 1 1 A 39 39 LEU C C 39 176.780 179.673 -2.893 2
1 165 . 1 1 A 39 39 LEU CA C 39 56.600 57.304 -0.704 2
1 166 . 1 1 A 39 39 LEU CB C 39 42.610 41.457 1.153 2
1 167 . 1 1 A 39 39 LEU N N 39 122.650 122.840 -0.190 2
1 168 . 1 1 A 40 40 LEU H H 40 8.070 7.973 0.097 2
1 169 . 1 1 A 40 40 LEU HA H 40 4.830 4.082 0.748 2
1 170 . 1 1 A 40 40 LEU C C 40 175.690 179.284 -3.594 2
1 171 . 1 1 A 40 40 LEU CA C 40 54.510 57.698 -3.188 2
1 172 . 1 1 A 40 40 LEU CB C 40 42.020 41.248 0.773 2
1 173 . 1 1 A 40 40 LEU N N 40 117.390 119.053 -1.663 2
1 174 . 1 1 A 41 41 LYS H H 41 7.770 7.946 -0.176 2
1 175 . 1 1 A 41 41 LYS HA H 41 4.610 4.131 0.479 2
1 176 . 1 1 A 41 41 LYS C C 41 175.380 177.500 -2.120 2
1 177 . 1 1 A 41 41 LYS CA C 41 56.170 58.658 -2.488 2
1 178 . 1 1 A 41 41 LYS CB C 41 32.950 31.928 1.022 2
1 179 . 1 1 A 41 41 LYS N N 41 120.530 117.786 2.744 2
1 180 . 1 1 A 42 42 GLY H H 42 8.390 7.946 0.444 2
1 181 . 1 1 A 42 42 GLY HA2 H 42 4.280 4.066 0.214 2
1 182 . 1 1 A 42 42 GLY HA3 H 42 4.280 4.067 0.213 2
1 183 . 1 1 A 42 42 GLY C C 42 177.190 174.903 2.287 2
1 184 . 1 1 A 42 42 GLY N N 42 109.280 108.444 0.836 2
1 185 . 1 1 A 43 43 MET H H 43 9.020 8.576 0.444 2
1 186 . 1 1 A 43 43 MET C C 43 175.520 175.990 -0.471 2
1 187 . 1 1 A 43 43 MET N N 43 121.110 119.119 1.991 2
1 188 . 1 1 A 44 44 SER H H 44 8.700 7.829 0.871 2
1 189 . 1 1 A 44 44 SER C C 44 173.540 174.056 -0.517 2
1 190 . 1 1 A 44 44 SER N N 44 116.190 116.354 -0.164 2
1 191 . 1 1 A 45 45 THR H H 45 8.440 8.693 -0.253 2
1 192 . 1 1 A 45 45 THR C C 45 174.300 175.300 -1.000 2
1 193 . 1 1 A 45 45 THR N N 45 113.740 119.262 -5.522 2
1 194 . 1 1 A 46 46 LEU H H 46 9.380 8.818 0.562 2
1 195 . 1 1 A 46 46 LEU C C 46 177.760 178.146 -0.386 2
1 196 . 1 1 A 46 46 LEU N N 46 123.970 123.471 0.499 2
1 197 . 1 1 A 47 47 ASP H H 47 8.990 8.456 0.534 2
1 198 . 1 1 A 47 47 ASP N N 47 118.620 118.153 0.467 2
1 199 . 1 1 A 49 49 LEU H H 49 9.740 8.668 1.072 2
1 200 . 1 1 A 49 49 LEU N N 49 123.880 120.787 3.093 2
1 201 . 1 1 A 50 50 PHE H H 50 10.730 8.989 1.741 2
1 202 . 1 1 A 50 50 PHE N N 50 121.380 119.473 1.907 2
1 203 . 1 1 A 51 51 GLU H H 51 7.860 8.586 -0.726 2
1 204 . 1 1 A 51 51 GLU HA H 51 3.530 3.948 -0.418 2
1 205 . 1 1 A 51 51 GLU N N 51 114.870 118.758 -3.888 2
1 206 . 1 1 A 66 66 PHE CA C 66 58.850 61.249 -2.399 2
1 207 . 1 1 A 67 67 GLN H H 67 5.670 8.591 -2.921 2
1 208 . 1 1 A 67 67 GLN C C 67 174.810 178.055 -3.245 2
1 209 . 1 1 A 67 67 GLN CA C 67 56.340 58.248 -1.908 2
1 210 . 1 1 A 67 67 GLN N N 67 114.050 117.362 -3.312 2
1 211 . 1 1 A 68 68 VAL H H 68 5.760 7.638 -1.878 2
1 212 . 1 1 A 68 68 VAL C C 68 175.770 178.451 -2.681 2
1 213 . 1 1 A 68 68 VAL CA C 68 63.990 65.878 -1.888 2
1 214 . 1 1 A 68 68 VAL CB C 68 31.310 31.505 -0.195 2
1 215 . 1 1 A 68 68 VAL N N 68 116.280 119.737 -3.457 2
1 216 . 1 1 A 69 69 LEU H H 69 7.150 8.492 -1.342 2
1 217 . 1 1 A 69 69 LEU HA H 69 4.040 4.020 0.020 2
1 218 . 1 1 A 69 69 LEU C C 69 176.210 178.316 -2.106 2
1 219 . 1 1 A 69 69 LEU CA C 69 56.270 57.399 -1.129 2
1 220 . 1 1 A 69 69 LEU CB C 69 42.010 41.835 0.175 2
1 221 . 1 1 A 69 69 LEU N N 69 120.350 121.295 -0.945 2
1 222 . 1 1 A 70 70 VAL H H 70 6.810 7.316 -0.506 2
1 223 . 1 1 A 70 70 VAL HA H 70 3.170 3.240 -0.070 2
1 224 . 1 1 A 70 70 VAL C C 70 175.760 177.612 -1.852 2
1 225 . 1 1 A 70 70 VAL CA C 70 65.110 66.794 -1.684 2
1 226 . 1 1 A 70 70 VAL CB C 70 31.190 31.100 0.090 2
1 227 . 1 1 A 70 70 VAL N N 70 115.790 118.795 -3.005 2
1 228 . 1 1 A 71 71 LYS H H 71 7.190 8.283 -1.093 2
1 229 . 1 1 A 71 71 LYS HA H 71 3.880 3.888 -0.008 2
1 230 . 1 1 A 71 71 LYS C C 71 176.100 179.148 -3.048 2
1 231 . 1 1 A 71 71 LYS CA C 71 57.680 59.335 -1.655 2
1 232 . 1 1 A 71 71 LYS CB C 71 31.930 32.145 -0.215 2
1 233 . 1 1 A 71 71 LYS N N 71 117.820 119.756 -1.936 2
1 234 . 1 1 A 72 72 LYS H H 72 7.450 7.349 0.101 2
1 235 . 1 1 A 72 72 LYS HA H 72 4.180 4.049 0.131 2
1 236 . 1 1 A 72 72 LYS C C 72 176.180 179.245 -3.065 2
1 237 . 1 1 A 72 72 LYS CA C 72 56.950 58.321 -1.371 2
1 238 . 1 1 A 72 72 LYS CB C 72 33.610 31.731 1.879 2
1 239 . 1 1 A 72 72 LYS N N 72 116.930 118.044 -1.114 2
1 240 . 1 1 A 73 73 ILE H H 73 7.440 7.936 -0.496 2
1 241 . 1 1 A 73 73 ILE HA H 73 4.180 3.482 0.698 2
1 242 . 1 1 A 73 73 ILE C C 73 174.440 178.070 -3.630 2
1 243 . 1 1 A 73 73 ILE CA C 73 61.510 64.501 -2.991 2
1 244 . 1 1 A 73 73 ILE CB C 73 38.610 37.451 1.159 2
1 245 . 1 1 A 73 73 ILE N N 73 114.560 121.419 -6.859 2
1 246 . 1 1 A 74 74 SER H H 74 7.790 8.920 -1.130 2
1 247 . 1 1 A 74 74 SER HA H 74 4.520 4.154 0.366 2
1 248 . 1 1 A 74 74 SER C C 74 171.580 177.149 -5.569 2
1 249 . 1 1 A 74 74 SER CA C 74 57.960 61.415 -3.455 2
1 250 . 1 1 A 74 74 SER CB C 74 63.820 62.991 0.829 2
1 251 . 1 1 A 74 74 SER N N 74 117.310 116.141 1.169 2
stop_
save_