data_25281 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25281 _Entry.PDB_ID 2MVR save_ save_delta_chem_shifts _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts _Entity_delta_chem_shifts.Model_type single _Entity_delta_chem_shifts.Entry_ID 25281 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 2 2 GLY N N 2 112.280 112.280 110.319 1.961 25281 2 1 1 . 1 1 2 2 GLY CA C 2 44.830 44.830 44.723 0.107 25281 3 1 1 . 1 1 2 2 GLY H H 2 8.460 8.460 8.208 0.252 25281 4 1 1 . 1 1 3 3 GLU N N 3 118.460 118.460 121.261 -2.801 25281 5 1 1 . 1 1 3 3 GLU CA C 3 56.840 56.840 56.529 0.311 25281 6 1 1 . 1 1 3 3 GLU CB C 3 29.980 29.980 30.290 -0.310 25281 7 1 1 . 1 1 3 3 GLU H H 3 7.630 7.630 8.417 -0.787 25281 8 1 1 . 1 1 4 4 SER N N 4 119.000 119.000 116.609 2.391 25281 9 1 1 . 1 1 4 4 SER CA C 4 57.280 57.280 57.414 -0.134 25281 10 1 1 . 1 1 4 4 SER CB C 4 65.860 65.860 66.196 -0.336 25281 11 1 1 . 1 1 4 4 SER H H 4 8.820 8.820 8.209 0.611 25281 12 1 1 . 1 1 5 5 SER N N 5 118.300 118.300 116.387 1.913 25281 13 1 1 . 1 1 5 5 SER CA C 5 57.560 57.560 57.556 0.004 25281 14 1 1 . 1 1 5 5 SER CB C 5 65.480 65.480 66.186 -0.706 25281 15 1 1 . 1 1 5 5 SER H H 5 8.700 8.700 7.916 0.784 25281 16 1 1 . 1 1 6 6 ILE N N 6 123.240 123.240 118.113 5.127 25281 17 1 1 . 1 1 6 6 ILE CA C 6 54.110 54.110 59.525 -5.415 25281 18 1 1 . 1 1 6 6 ILE CB C 6 33.870 33.870 42.330 -8.460 25281 19 1 1 . 1 1 6 6 ILE H H 6 9.080 9.080 7.992 1.088 25281 20 1 1 . 1 1 7 7 SER N N 7 116.100 116.100 116.446 -0.346 25281 21 1 1 . 1 1 7 7 SER CA C 7 57.130 57.130 57.290 -0.160 25281 22 1 1 . 1 1 7 7 SER CB C 7 65.710 65.710 65.586 0.124 25281 23 1 1 . 1 1 7 7 SER H H 7 8.570 8.570 8.154 0.416 25281 24 1 1 . 1 1 8 8 ILE N N 8 114.140 114.140 118.540 -4.400 25281 25 1 1 . 1 1 8 8 ILE CA C 8 58.460 58.460 58.713 -0.253 25281 26 1 1 . 1 1 8 8 ILE CB C 8 40.880 40.880 41.879 -0.999 25281 27 1 1 . 1 1 8 8 ILE H H 8 8.300 8.300 8.638 -0.338 25281 28 1 1 . 1 1 9 9 GLY N N 9 109.200 109.200 108.018 1.182 25281 29 1 1 . 1 1 9 9 GLY CA C 9 45.550 45.550 45.768 -0.218 25281 30 1 1 . 1 1 9 9 GLY H H 9 9.060 9.060 7.855 1.205 25281 31 1 1 . 1 1 10 10 TYR N N 10 121.410 121.410 119.512 1.898 25281 32 1 1 . 1 1 10 10 TYR CA C 10 56.970 56.970 57.056 -0.086 25281 33 1 1 . 1 1 10 10 TYR CB C 10 41.520 41.520 41.728 -0.208 25281 34 1 1 . 1 1 10 10 TYR H H 10 8.870 8.870 8.161 0.709 25281 35 1 1 . 1 1 11 11 ALA N N 11 125.250 125.250 124.135 1.115 25281 36 1 1 . 1 1 11 11 ALA CA C 11 48.740 48.740 50.059 -1.319 25281 37 1 1 . 1 1 11 11 ALA CB C 11 21.610 21.610 22.056 -0.446 25281 38 1 1 . 1 1 11 11 ALA H H 11 7.210 7.210 8.092 -0.882 25281 39 1 1 . 1 1 12 12 GLN N N 12 119.180 119.180 121.639 -2.459 25281 40 1 1 . 1 1 12 12 GLN CA C 12 54.690 54.690 54.761 -0.071 25281 41 1 1 . 1 1 12 12 GLN CB C 12 32.000 32.000 33.548 -1.548 25281 42 1 1 . 1 1 12 12 GLN H H 12 8.330 8.330 8.108 0.222 25281 43 1 1 . 1 1 13 13 SER N N 13 122.790 122.790 117.841 4.949 25281 44 1 1 . 1 1 13 13 SER CA C 13 57.780 57.780 56.959 0.821 25281 45 1 1 . 1 1 13 13 SER CB C 13 64.540 64.540 64.571 -0.031 25281 46 1 1 . 1 1 13 13 SER H H 13 8.610 8.610 8.751 -0.141 25281 47 1 1 . 1 1 14 14 ARG N N 14 121.140 121.140 129.437 -8.297 25281 48 1 1 . 1 1 14 14 ARG CA C 14 54.960 54.960 55.601 -0.641 25281 49 1 1 . 1 1 14 14 ARG CB C 14 32.370 32.370 32.839 -0.469 25281 50 1 1 . 1 1 14 14 ARG H H 14 8.520 8.520 8.598 -0.078 25281 51 1 1 . 1 1 15 15 VAL N N 15 115.890 115.890 122.369 -6.479 25281 52 1 1 . 1 1 15 15 VAL CA C 15 60.970 60.970 60.684 0.286 25281 53 1 1 . 1 1 15 15 VAL CB C 15 34.320 34.320 34.962 -0.643 25281 54 1 1 . 1 1 15 15 VAL H H 15 8.440 8.440 7.969 0.471 25281 55 1 1 . 1 1 16 16 LYS N N 16 126.010 126.010 125.599 0.411 25281 56 1 1 . 1 1 16 16 LYS CA C 16 55.120 55.120 56.074 -0.954 25281 57 1 1 . 1 1 16 16 LYS CB C 16 34.350 34.350 32.564 1.786 25281 58 1 1 . 1 1 16 16 LYS H H 16 8.850 8.850 8.691 0.159 25281 59 1 1 . 1 1 17 17 GLU N N 17 119.140 119.140 124.479 -5.339 25281 60 1 1 . 1 1 17 17 GLU CA C 17 54.460 54.460 54.897 -0.437 25281 61 1 1 . 1 1 17 17 GLU CB C 17 33.430 33.430 31.331 2.099 25281 62 1 1 . 1 1 17 17 GLU H H 17 8.030 8.030 8.607 -0.577 25281 63 1 1 . 1 1 18 18 ASP N N 18 120.280 120.280 120.752 -0.472 25281 64 1 1 . 1 1 18 18 ASP CA C 18 56.500 56.500 53.589 2.911 25281 65 1 1 . 1 1 18 18 ASP CB C 18 33.780 33.780 40.320 -6.540 25281 66 1 1 . 1 1 18 18 ASP H H 18 8.120 8.120 8.530 -0.410 25281 67 1 1 . 1 1 19 19 GLY N N 19 118.750 118.750 111.199 7.551 25281 68 1 1 . 1 1 19 19 GLY CA C 19 44.130 44.130 45.017 -0.886 25281 69 1 1 . 1 1 19 19 GLY H H 19 8.430 8.430 7.689 0.741 25281 70 1 1 . 1 1 20 20 TYR N N 20 117.080 117.080 122.465 -5.385 25281 71 1 1 . 1 1 20 20 TYR CA C 20 60.940 60.940 58.086 2.854 25281 72 1 1 . 1 1 20 20 TYR CB C 20 42.010 42.010 37.611 4.399 25281 73 1 1 . 1 1 20 20 TYR H H 20 8.610 8.610 8.514 0.096 25281 74 1 1 . 1 1 21 21 LYS N N 21 127.240 127.240 123.471 3.769 25281 75 1 1 . 1 1 21 21 LYS CA C 21 56.760 56.760 57.431 -0.671 25281 76 1 1 . 1 1 21 21 LYS CB C 21 29.100 29.100 32.435 -3.335 25281 77 1 1 . 1 1 21 21 LYS H H 21 7.970 7.970 8.397 -0.427 25281 78 1 1 . 1 1 22 22 LEU N N 22 122.270 122.270 120.090 2.180 25281 79 1 1 . 1 1 22 22 LEU CA C 22 59.170 59.170 57.314 1.856 25281 80 1 1 . 1 1 22 22 LEU CB C 22 40.030 40.030 41.703 -1.673 25281 81 1 1 . 1 1 22 22 LEU H H 22 8.370 8.370 8.135 0.235 25281 82 1 1 . 1 1 23 23 ASP N N 23 114.790 114.790 113.337 1.453 25281 83 1 1 . 1 1 23 23 ASP CA C 23 51.840 51.840 53.305 -1.465 25281 84 1 1 . 1 1 23 23 ASP CB C 23 37.730 37.730 41.012 -3.282 25281 85 1 1 . 1 1 23 23 ASP H H 23 8.210 8.210 8.200 0.010 25281 86 1 1 . 1 1 24 24 LYS N N 24 115.470 115.470 114.834 0.636 25281 87 1 1 . 1 1 24 24 LYS CA C 24 58.860 58.860 57.760 1.100 25281 88 1 1 . 1 1 24 24 LYS CB C 24 28.330 28.330 30.283 -1.953 25281 89 1 1 . 1 1 24 24 LYS H H 24 9.230 9.230 7.913 1.317 25281 90 1 1 . 1 1 25 25 ASN N N 25 121.610 121.610 119.598 2.012 25281 91 1 1 . 1 1 25 25 ASN CA C 25 54.430 54.430 49.794 4.636 25281 92 1 1 . 1 1 25 25 ASN CB C 25 42.500 42.500 39.070 3.430 25281 93 1 1 . 1 1 25 25 ASN H H 25 8.150 8.150 8.040 0.110 25281 94 1 1 . 1 1 26 26 PRO CA C 26 63.340 63.340 62.502 0.838 25281 95 1 1 . 1 1 26 26 PRO CB C 26 30.940 30.940 32.993 -2.053 25281 96 1 1 . 1 1 27 27 ARG N N 27 120.730 120.730 118.081 2.649 25281 97 1 1 . 1 1 27 27 ARG CA C 27 54.340 54.340 55.480 -1.140 25281 98 1 1 . 1 1 27 27 ARG CB C 27 33.500 33.500 32.406 1.094 25281 99 1 1 . 1 1 27 27 ARG H H 27 8.290 8.290 8.370 -0.080 25281 100 1 1 . 1 1 28 28 GLY N N 28 112.000 112.000 109.236 2.764 25281 101 1 1 . 1 1 28 28 GLY CA C 28 46.940 46.940 44.710 2.230 25281 102 1 1 . 1 1 28 28 GLY H H 28 8.810 8.810 8.135 0.675 25281 103 1 1 . 1 1 29 29 PHE N N 29 121.230 121.230 117.798 3.432 25281 104 1 1 . 1 1 29 29 PHE CA C 29 55.230 55.230 56.873 -1.643 25281 105 1 1 . 1 1 29 29 PHE CB C 29 43.700 43.700 43.653 0.047 25281 106 1 1 . 1 1 29 29 PHE H H 29 8.470 8.470 8.399 0.071 25281 107 1 1 . 1 1 30 30 ASN N N 30 117.250 117.250 121.369 -4.119 25281 108 1 1 . 1 1 30 30 ASN CA C 30 50.220 50.220 52.378 -2.158 25281 109 1 1 . 1 1 30 30 ASN CB C 30 45.810 45.810 41.314 4.496 25281 110 1 1 . 1 1 30 30 ASN H H 30 8.630 8.630 8.949 -0.319 25281 111 1 1 . 1 1 31 31 LEU N N 31 128.180 128.180 126.196 1.984 25281 112 1 1 . 1 1 31 31 LEU CA C 31 53.930 53.930 53.779 0.151 25281 113 1 1 . 1 1 31 31 LEU CB C 31 45.810 45.810 44.973 0.837 25281 114 1 1 . 1 1 31 31 LEU H H 31 9.080 9.080 8.403 0.677 25281 115 1 1 . 1 1 32 32 LYS N N 32 119.980 119.980 120.891 -0.911 25281 116 1 1 . 1 1 32 32 LYS CA C 32 55.730 55.730 54.762 0.968 25281 117 1 1 . 1 1 32 32 LYS CB C 32 36.070 36.070 36.718 -0.648 25281 118 1 1 . 1 1 32 32 LYS H H 32 8.780 8.780 8.360 0.420 25281 119 1 1 . 1 1 33 33 TYR N N 33 121.500 121.500 123.761 -2.261 25281 120 1 1 . 1 1 33 33 TYR CA C 33 55.830 55.830 56.863 -1.033 25281 121 1 1 . 1 1 33 33 TYR CB C 33 42.110 42.110 42.528 -0.418 25281 122 1 1 . 1 1 33 33 TYR H H 33 8.640 8.640 8.290 0.350 25281 123 1 1 . 1 1 34 34 ARG N N 34 128.980 128.980 128.688 0.292 25281 124 1 1 . 1 1 34 34 ARG CA C 34 52.690 52.690 54.019 -1.329 25281 125 1 1 . 1 1 34 34 ARG CB C 34 34.320 34.320 34.104 0.216 25281 126 1 1 . 1 1 34 34 ARG H H 34 8.830 8.830 7.812 1.018 25281 127 1 1 . 1 1 35 35 TYR N N 35 124.820 124.820 127.334 -2.514 25281 128 1 1 . 1 1 35 35 TYR CA C 35 56.640 56.640 57.109 -0.469 25281 129 1 1 . 1 1 35 35 TYR CB C 35 41.980 41.980 41.347 0.633 25281 130 1 1 . 1 1 35 35 TYR H H 35 8.840 8.840 8.097 0.743 25281 131 1 1 . 1 1 39 39 ASN N N 39 127.690 127.690 121.477 6.213 25281 132 1 1 . 1 1 39 39 ASN CA C 39 54.850 54.850 53.271 1.579 25281 133 1 1 . 1 1 39 39 ASN CB C 39 38.290 38.290 37.413 0.876 25281 134 1 1 . 1 1 39 39 ASN H H 39 7.990 7.990 8.497 -0.507 25281 135 1 1 . 1 1 40 40 ASP N N 40 115.200 115.200 121.656 -6.456 25281 136 1 1 . 1 1 40 40 ASP CA C 40 55.210 55.210 52.994 2.216 25281 137 1 1 . 1 1 40 40 ASP CB C 40 44.010 44.010 41.772 2.238 25281 138 1 1 . 1 1 40 40 ASP H H 40 8.370 8.370 8.106 0.264 25281 139 1 1 . 1 1 41 41 TRP N N 41 124.210 124.210 119.432 4.778 25281 140 1 1 . 1 1 41 41 TRP CA C 41 55.840 55.840 56.324 -0.484 25281 141 1 1 . 1 1 41 41 TRP CB C 41 33.540 33.540 30.397 3.143 25281 142 1 1 . 1 1 41 41 TRP H H 41 9.130 9.130 7.812 1.318 25281 143 1 1 . 1 1 42 42 GLY N N 42 107.800 107.800 110.714 -2.914 25281 144 1 1 . 1 1 42 42 GLY CA C 42 45.870 45.870 44.095 1.775 25281 145 1 1 . 1 1 42 42 GLY H H 42 8.610 8.610 8.097 0.513 25281 146 1 1 . 1 1 43 43 VAL N N 43 116.260 116.260 118.273 -2.013 25281 147 1 1 . 1 1 43 43 VAL CA C 43 58.980 58.980 61.411 -2.431 25281 148 1 1 . 1 1 43 43 VAL CB C 43 35.430 35.430 34.986 0.444 25281 149 1 1 . 1 1 43 43 VAL H H 43 8.880 8.880 7.758 1.122 25281 150 1 1 . 1 1 44 44 ILE N N 44 124.720 124.720 125.599 -0.879 25281 151 1 1 . 1 1 44 44 ILE CA C 44 58.390 58.390 58.546 -0.156 25281 152 1 1 . 1 1 44 44 ILE CB C 44 42.890 42.890 42.101 0.789 25281 153 1 1 . 1 1 44 44 ILE H H 44 9.110 9.110 8.110 1.000 25281 154 1 1 . 1 1 45 45 GLY N N 45 110.610 110.610 113.618 -3.008 25281 155 1 1 . 1 1 45 45 GLY CA C 45 43.150 43.150 43.711 -0.561 25281 156 1 1 . 1 1 45 45 GLY H H 45 8.910 8.910 8.141 0.769 25281 157 1 1 . 1 1 46 46 SER N N 46 116.210 116.210 117.891 -1.681 25281 158 1 1 . 1 1 46 46 SER CA C 46 56.250 56.250 56.129 0.121 25281 159 1 1 . 1 1 46 46 SER CB C 46 63.720 63.720 64.883 -1.163 25281 160 1 1 . 1 1 46 46 SER H H 46 9.250 9.250 7.823 1.427 25281 161 1 1 . 1 1 47 47 PHE N N 47 126.400 126.400 126.565 -0.165 25281 162 1 1 . 1 1 47 47 PHE CA C 47 55.090 55.090 56.245 -1.155 25281 163 1 1 . 1 1 47 47 PHE CB C 47 42.560 42.560 42.801 -0.241 25281 164 1 1 . 1 1 47 47 PHE H H 47 8.940 8.940 8.484 0.456 25281 165 1 1 . 1 1 48 48 ALA N N 48 131.930 131.930 124.419 7.511 25281 166 1 1 . 1 1 48 48 ALA CA C 48 50.350 50.350 50.531 -0.181 25281 167 1 1 . 1 1 48 48 ALA CB C 48 21.280 21.280 22.732 -1.452 25281 168 1 1 . 1 1 48 48 ALA H H 48 8.790 8.790 8.508 0.282 25281 169 1 1 . 1 1 49 49 GLN N N 49 116.070 116.070 122.355 -6.285 25281 170 1 1 . 1 1 49 49 GLN CA C 49 54.110 54.110 55.009 -0.899 25281 171 1 1 . 1 1 49 49 GLN CB C 49 31.140 31.140 33.512 -2.372 25281 172 1 1 . 1 1 49 49 GLN H H 49 7.720 7.720 8.345 -0.625 25281 173 1 1 . 1 1 50 50 THR N N 50 115.990 115.990 116.031 -0.041 25281 174 1 1 . 1 1 50 50 THR CA C 50 59.270 59.270 60.660 -1.389 25281 175 1 1 . 1 1 50 50 THR CB C 50 70.980 70.980 70.907 0.073 25281 176 1 1 . 1 1 50 50 THR H H 50 9.470 9.470 8.389 1.081 25281 177 1 1 . 1 1 51 51 ARG N N 51 117.600 117.600 121.926 -4.326 25281 178 1 1 . 1 1 51 51 ARG CA C 51 55.350 55.350 53.917 1.433 25281 179 1 1 . 1 1 51 51 ARG CB C 51 33.610 33.610 33.575 0.035 25281 180 1 1 . 1 1 51 51 ARG H H 51 8.600 8.600 8.023 0.577 25281 181 1 1 . 1 1 52 52 ARG N N 52 121.400 121.400 122.141 -0.741 25281 182 1 1 . 1 1 52 52 ARG CA C 52 56.910 56.910 56.665 0.245 25281 183 1 1 . 1 1 52 52 ARG CB C 52 29.370 29.370 30.679 -1.309 25281 184 1 1 . 1 1 52 52 ARG H H 52 8.380 8.380 8.115 0.265 25281 185 1 1 . 1 1 53 53 GLY N N 53 111.040 111.040 116.200 -5.160 25281 186 1 1 . 1 1 53 53 GLY CA C 53 45.190 45.190 46.759 -1.569 25281 187 1 1 . 1 1 53 53 GLY H H 53 8.330 8.330 9.098 -0.768 25281 188 1 1 . 1 1 54 54 PHE N N 54 119.210 119.210 118.061 1.149 25281 189 1 1 . 1 1 54 54 PHE CA C 54 55.670 55.670 57.299 -1.629 25281 190 1 1 . 1 1 54 54 PHE CB C 54 29.220 29.220 42.529 -13.309 25281 191 1 1 . 1 1 54 54 PHE H H 54 7.720 7.720 7.811 -0.091 25281 192 1 1 . 1 1 55 55 GLU N N 55 123.470 123.470 123.817 -0.347 25281 193 1 1 . 1 1 55 55 GLU CA C 55 55.580 55.580 55.551 0.029 25281 194 1 1 . 1 1 55 55 GLU CB C 55 32.920 32.920 30.069 2.851 25281 195 1 1 . 1 1 55 55 GLU H H 55 8.400 8.400 7.475 0.925 25281 196 1 1 . 1 1 56 56 GLU N N 56 121.950 121.950 124.537 -2.587 25281 197 1 1 . 1 1 56 56 GLU CA C 56 56.690 56.690 55.400 1.290 25281 198 1 1 . 1 1 56 56 GLU CB C 56 29.450 29.450 31.798 -2.348 25281 199 1 1 . 1 1 56 56 GLU H H 56 8.500 8.500 8.505 -0.005 25281 200 1 1 . 1 1 57 57 SER N N 57 123.330 123.330 118.376 4.954 25281 201 1 1 . 1 1 57 57 SER CA C 57 55.090 55.090 57.465 -2.375 25281 202 1 1 . 1 1 57 57 SER CB C 57 64.890 64.890 64.165 0.725 25281 203 1 1 . 1 1 57 57 SER H H 57 8.640 8.640 8.491 0.149 25281 204 1 1 . 1 1 58 58 VAL N N 58 122.060 122.060 124.415 -2.355 25281 205 1 1 . 1 1 58 58 VAL CA C 58 57.660 57.660 62.035 -4.375 25281 206 1 1 . 1 1 58 58 VAL CB C 58 31.640 31.640 34.605 -2.965 25281 207 1 1 . 1 1 58 58 VAL H H 58 8.480 8.480 8.398 0.082 25281 208 1 1 . 1 1 59 59 ASP N N 59 123.390 123.390 126.514 -3.124 25281 209 1 1 . 1 1 59 59 ASP CA C 59 54.960 54.960 53.966 0.994 25281 210 1 1 . 1 1 59 59 ASP CB C 59 42.840 42.840 41.446 1.395 25281 211 1 1 . 1 1 59 59 ASP H H 59 9.360 9.360 8.521 0.839 25281 212 1 1 . 1 1 60 60 GLY N N 60 105.230 105.230 106.696 -1.466 25281 213 1 1 . 1 1 60 60 GLY CA C 60 45.130 45.130 44.486 0.644 25281 214 1 1 . 1 1 60 60 GLY H H 60 8.210 8.210 7.677 0.533 25281 215 1 1 . 1 1 61 61 PHE N N 61 121.440 121.440 120.425 1.015 25281 216 1 1 . 1 1 61 61 PHE CA C 61 57.330 57.330 57.822 -0.492 25281 217 1 1 . 1 1 61 61 PHE CB C 61 39.420 39.420 39.260 0.160 25281 218 1 1 . 1 1 61 61 PHE H H 61 8.330 8.330 8.500 -0.170 25281 219 1 1 . 1 1 62 62 LYS N N 62 119.870 119.870 123.761 -3.891 25281 220 1 1 . 1 1 62 62 LYS CA C 62 56.340 56.340 54.534 1.806 25281 221 1 1 . 1 1 62 62 LYS CB C 62 33.850 33.850 35.741 -1.891 25281 222 1 1 . 1 1 62 62 LYS H H 62 8.480 8.480 8.261 0.219 25281 223 1 1 . 1 1 63 63 LEU N N 63 125.160 125.160 123.332 1.828 25281 224 1 1 . 1 1 63 63 LEU CA C 63 56.220 56.220 57.212 -0.992 25281 225 1 1 . 1 1 63 63 LEU CB C 63 41.520 41.520 41.158 0.362 25281 226 1 1 . 1 1 63 63 LEU H H 63 8.910 8.910 8.800 0.110 25281 227 1 1 . 1 1 64 64 ILE N N 64 119.660 119.660 120.710 -1.050 25281 228 1 1 . 1 1 64 64 ILE CA C 64 62.420 62.420 64.758 -2.338 25281 229 1 1 . 1 1 64 64 ILE CB C 64 37.700 37.700 37.757 -0.057 25281 230 1 1 . 1 1 64 64 ILE H H 64 8.210 8.210 7.805 0.405 25281 231 1 1 . 1 1 65 65 ASP N N 65 117.080 117.080 119.690 -2.610 25281 232 1 1 . 1 1 65 65 ASP CA C 65 57.420 57.420 56.324 1.096 25281 233 1 1 . 1 1 65 65 ASP CB C 65 38.350 38.350 40.534 -2.184 25281 234 1 1 . 1 1 65 65 ASP H H 65 7.710 7.710 8.448 -0.738 25281 235 1 1 . 1 1 66 66 GLY N N 66 106.440 106.440 106.104 0.336 25281 236 1 1 . 1 1 66 66 GLY CA C 66 45.170 45.170 45.274 -0.104 25281 237 1 1 . 1 1 66 66 GLY H H 66 7.920 7.920 7.428 0.492 25281 238 1 1 . 1 1 67 67 ASP N N 67 118.490 118.490 120.895 -2.405 25281 239 1 1 . 1 1 67 67 ASP CA C 67 57.340 57.340 55.045 2.295 25281 240 1 1 . 1 1 67 67 ASP CB C 67 29.870 29.870 41.410 -11.540 25281 241 1 1 . 1 1 67 67 ASP H H 67 7.820 7.820 7.898 -0.078 25281 242 1 1 . 1 1 68 68 PHE N N 68 125.320 125.320 122.740 2.580 25281 243 1 1 . 1 1 68 68 PHE CA C 68 56.090 56.090 57.763 -1.673 25281 244 1 1 . 1 1 68 68 PHE CB C 68 41.940 41.940 41.412 0.528 25281 245 1 1 . 1 1 68 68 PHE H H 68 8.310 8.310 8.496 -0.186 25281 246 1 1 . 1 1 69 69 LYS N N 69 124.770 124.770 129.151 -4.381 25281 247 1 1 . 1 1 69 69 LYS CA C 69 54.880 54.880 54.532 0.347 25281 248 1 1 . 1 1 69 69 LYS CB C 69 36.920 36.920 35.464 1.456 25281 249 1 1 . 1 1 69 69 LYS H H 69 8.730 8.730 7.797 0.933 25281 250 1 1 . 1 1 70 70 TYR N N 70 123.740 123.740 127.864 -4.124 25281 251 1 1 . 1 1 70 70 TYR CA C 70 55.540 55.540 56.075 -0.535 25281 252 1 1 . 1 1 70 70 TYR CB C 70 40.150 40.150 41.963 -1.813 25281 253 1 1 . 1 1 70 70 TYR H H 70 8.680 8.680 8.153 0.527 25281 254 1 1 . 1 1 71 71 TYR N N 71 123.920 123.920 122.678 1.242 25281 255 1 1 . 1 1 71 71 TYR CA C 71 54.500 54.500 55.330 -0.830 25281 256 1 1 . 1 1 71 71 TYR CB C 71 42.420 42.420 41.675 0.745 25281 257 1 1 . 1 1 71 71 TYR H H 71 8.620 8.620 8.146 0.474 25281 258 1 1 . 1 1 72 72 SER N N 72 113.820 113.820 114.649 -0.829 25281 259 1 1 . 1 1 72 72 SER CA C 72 56.320 56.320 56.840 -0.520 25281 260 1 1 . 1 1 72 72 SER CB C 72 65.790 65.790 67.283 -1.493 25281 261 1 1 . 1 1 72 72 SER H H 72 8.800 8.800 8.347 0.453 25281 262 1 1 . 1 1 73 73 VAL N N 73 119.260 119.260 116.874 2.386 25281 263 1 1 . 1 1 73 73 VAL CA C 73 60.730 60.730 59.723 1.007 25281 264 1 1 . 1 1 73 73 VAL CB C 73 33.870 33.870 34.894 -1.024 25281 265 1 1 . 1 1 73 73 VAL H H 73 8.170 8.170 8.044 0.126 25281 266 1 1 . 1 1 74 74 THR N N 74 115.360 115.360 113.721 1.639 25281 267 1 1 . 1 1 74 74 THR CA C 74 59.040 59.040 60.075 -1.035 25281 268 1 1 . 1 1 74 74 THR CB C 74 73.250 73.250 72.112 1.138 25281 269 1 1 . 1 1 74 74 THR H H 74 9.200 9.200 7.897 1.303 25281 270 1 1 . 1 1 75 75 ALA N N 75 119.330 119.330 122.234 -2.904 25281 271 1 1 . 1 1 75 75 ALA CA C 75 51.390 51.390 51.141 0.249 25281 272 1 1 . 1 1 75 75 ALA CB C 75 22.380 22.380 22.441 -0.061 25281 273 1 1 . 1 1 75 75 ALA H H 75 9.130 9.130 8.601 0.529 25281 274 1 1 . 1 1 76 76 GLY N N 76 103.130 103.130 106.905 -3.775 25281 275 1 1 . 1 1 76 76 GLY CA C 76 45.900 45.900 44.758 1.142 25281 276 1 1 . 1 1 76 76 GLY H H 76 8.760 8.760 7.969 0.791 25281 277 1 1 . 1 1 77 77 PRO CA C 77 61.250 61.250 62.538 -1.288 25281 278 1 1 . 1 1 77 77 PRO CB C 77 32.590 32.590 32.734 -0.144 25281 279 1 1 . 1 1 78 78 VAL N N 78 115.250 115.250 119.757 -4.507 25281 280 1 1 . 1 1 78 78 VAL CA C 78 58.430 58.430 61.720 -3.290 25281 281 1 1 . 1 1 78 78 VAL CB C 78 32.700 32.700 34.513 -1.813 25281 282 1 1 . 1 1 78 78 VAL H H 78 8.240 8.240 8.465 -0.225 25281 283 1 1 . 1 1 79 79 PHE N N 79 130.610 130.610 127.718 2.892 25281 284 1 1 . 1 1 79 79 PHE CA C 79 55.090 55.090 56.240 -1.150 25281 285 1 1 . 1 1 79 79 PHE CB C 79 41.590 41.590 43.195 -1.605 25281 286 1 1 . 1 1 79 79 PHE H H 79 9.540 9.540 8.491 1.049 25281 287 1 1 . 1 1 80 80 ARG N N 80 130.350 130.350 125.990 4.360 25281 288 1 1 . 1 1 80 80 ARG CA C 80 55.490 55.490 56.516 -1.026 25281 289 1 1 . 1 1 80 80 ARG CB C 80 29.520 29.520 30.616 -1.096 25281 290 1 1 . 1 1 80 80 ARG H H 80 8.810 8.810 8.176 0.634 25281 291 1 1 . 1 1 81 81 ILE N N 81 127.480 127.480 125.308 2.172 25281 292 1 1 . 1 1 81 81 ILE CA C 81 62.850 62.850 62.946 -0.096 25281 293 1 1 . 1 1 81 81 ILE CB C 81 37.650 37.650 39.170 -1.520 25281 294 1 1 . 1 1 81 81 ILE H H 81 8.260 8.260 9.023 -0.763 25281 295 1 1 . 1 1 82 82 ASN N N 82 113.110 113.110 116.474 -3.364 25281 296 1 1 . 1 1 82 82 ASN CA C 82 55.630 55.630 52.278 3.352 25281 297 1 1 . 1 1 82 82 ASN CB C 82 43.210 43.210 38.607 4.603 25281 298 1 1 . 1 1 82 82 ASN H H 82 7.970 7.970 7.805 0.165 25281 299 1 1 . 1 1 85 85 VAL N N 85 118.090 118.090 118.728 -0.638 25281 300 1 1 . 1 1 85 85 VAL CA C 85 61.120 61.120 60.807 0.313 25281 301 1 1 . 1 1 85 85 VAL CB C 85 34.910 34.910 34.910 0.000 25281 302 1 1 . 1 1 85 85 VAL H H 85 7.840 7.840 7.542 0.298 25281 303 1 1 . 1 1 86 86 SER N N 86 119.050 119.050 121.029 -1.979 25281 304 1 1 . 1 1 86 86 SER CA C 86 57.100 57.100 56.831 0.269 25281 305 1 1 . 1 1 86 86 SER CB C 86 65.400 65.400 65.277 0.123 25281 306 1 1 . 1 1 86 86 SER H H 86 8.240 8.240 8.704 -0.464 25281 307 1 1 . 1 1 87 87 LEU N N 87 124.640 124.640 125.537 -0.897 25281 308 1 1 . 1 1 87 87 LEU CA C 87 53.750 53.750 53.843 -0.093 25281 309 1 1 . 1 1 87 87 LEU CB C 87 46.320 46.320 44.590 1.730 25281 310 1 1 . 1 1 87 87 LEU H H 87 9.130 9.130 8.112 1.018 25281 311 1 1 . 1 1 88 88 TYR N N 88 118.740 118.740 118.531 0.209 25281 312 1 1 . 1 1 88 88 TYR CA C 88 55.080 55.080 56.071 -0.991 25281 313 1 1 . 1 1 88 88 TYR CB C 88 42.630 42.630 40.995 1.635 25281 314 1 1 . 1 1 88 88 TYR H H 88 8.740 8.740 7.908 0.832 25281 315 1 1 . 1 1 89 89 GLY N N 89 103.920 103.920 106.802 -2.882 25281 316 1 1 . 1 1 89 89 GLY CA C 89 43.250 43.250 43.259 -0.009 25281 317 1 1 . 1 1 89 89 GLY H H 89 7.720 7.720 8.275 -0.555 25281 318 1 1 . 1 1 90 90 LEU N N 90 117.530 117.530 121.343 -3.813 25281 319 1 1 . 1 1 90 90 LEU CA C 90 53.200 53.200 53.837 -0.637 25281 320 1 1 . 1 1 90 90 LEU CB C 90 45.810 45.810 44.645 1.165 25281 321 1 1 . 1 1 90 90 LEU H H 90 8.520 8.520 8.327 0.193 25281 322 1 1 . 1 1 91 91 LEU N N 91 120.670 120.670 124.442 -3.772 25281 323 1 1 . 1 1 91 91 LEU CA C 91 53.590 53.590 53.890 -0.300 25281 324 1 1 . 1 1 91 91 LEU CB C 91 46.330 46.330 45.584 0.746 25281 325 1 1 . 1 1 91 91 LEU H H 91 9.250 9.250 8.041 1.209 25281 326 1 1 . 1 1 92 92 GLY N N 92 108.770 108.770 112.529 -3.759 25281 327 1 1 . 1 1 92 92 GLY CA C 92 46.520 46.520 46.096 0.424 25281 328 1 1 . 1 1 92 92 GLY H H 92 8.480 8.480 8.536 -0.056 25281 329 1 1 . 1 1 93 93 ALA N N 93 126.760 126.760 120.487 6.273 25281 330 1 1 . 1 1 93 93 ALA CA C 93 49.890 49.890 51.093 -1.203 25281 331 1 1 . 1 1 93 93 ALA CB C 93 21.860 21.860 22.547 -0.687 25281 332 1 1 . 1 1 93 93 ALA H H 93 8.860 8.860 7.835 1.025 25281 333 1 1 . 1 1 94 94 GLY N N 94 107.510 107.510 106.626 0.884 25281 334 1 1 . 1 1 94 94 GLY CA C 94 42.760 42.760 44.056 -1.296 25281 335 1 1 . 1 1 94 94 GLY H H 94 8.880 8.880 8.086 0.794 25281 336 1 1 . 1 1 95 95 HIS N N 95 122.340 122.340 118.581 3.759 25281 337 1 1 . 1 1 95 95 HIS CA C 95 54.570 54.570 54.478 0.092 25281 338 1 1 . 1 1 95 95 HIS CB C 95 32.700 32.700 34.266 -1.566 25281 339 1 1 . 1 1 95 95 HIS H H 95 9.200 9.200 8.542 0.658 25281 340 1 1 . 1 1 96 96 GLY N N 96 112.170 112.170 107.554 4.616 25281 341 1 1 . 1 1 96 96 GLY CA C 96 43.150 43.150 43.899 -0.749 25281 342 1 1 . 1 1 96 96 GLY H H 96 8.620 8.620 8.723 -0.103 25281 343 1 1 . 1 1 97 97 LYS N N 97 120.580 120.580 122.234 -1.654 25281 344 1 1 . 1 1 97 97 LYS CA C 97 54.890 54.890 55.375 -0.485 25281 345 1 1 . 1 1 97 97 LYS CB C 97 35.560 35.560 36.321 -0.761 25281 346 1 1 . 1 1 97 97 LYS H H 97 9.010 9.010 8.512 0.498 25281 347 1 1 . 1 1 98 98 ALA N N 98 126.740 126.740 128.562 -1.822 25281 348 1 1 . 1 1 98 98 ALA CA C 98 50.020 50.020 51.362 -1.342 25281 349 1 1 . 1 1 98 98 ALA CB C 98 22.380 22.380 22.659 -0.279 25281 350 1 1 . 1 1 98 98 ALA H H 98 9.120 9.120 9.057 0.063 25281 351 1 1 . 1 1 99 99 LYS N N 99 122.360 122.360 122.799 -0.439 25281 352 1 1 . 1 1 99 99 LYS CA C 99 55.090 55.090 55.424 -0.334 25281 353 1 1 . 1 1 99 99 LYS CB C 99 34.970 34.970 36.535 -1.565 25281 354 1 1 . 1 1 99 99 LYS H H 99 8.580 8.580 8.415 0.165 25281 355 1 1 . 1 1 100 100 PHE N N 100 121.170 121.170 121.915 -0.745 25281 356 1 1 . 1 1 100 100 PHE CA C 100 56.390 56.390 57.797 -1.407 25281 357 1 1 . 1 1 100 100 PHE CB C 100 42.110 42.110 40.025 2.085 25281 358 1 1 . 1 1 100 100 PHE H H 100 8.750 8.750 8.240 0.510 25281 359 1 1 . 1 1 101 101 SER N N 101 117.280 117.280 114.977 2.303 25281 360 1 1 . 1 1 101 101 SER CA C 101 57.070 57.070 57.447 -0.377 25281 361 1 1 . 1 1 101 101 SER CB C 101 65.830 65.830 64.962 0.868 25281 362 1 1 . 1 1 101 101 SER H H 101 8.990 8.990 8.207 0.783 25281 363 1 1 . 1 1 102 102 SER N N 102 117.600 117.600 116.149 1.451 25281 364 1 1 . 1 1 102 102 SER CA C 102 56.500 56.500 58.105 -1.605 25281 365 1 1 . 1 1 102 102 SER CB C 102 67.540 67.540 63.391 4.149 25281 366 1 1 . 1 1 102 102 SER H H 102 8.680 8.680 8.561 0.119 25281 367 1 1 . 1 1 103 103 ILE N N 103 114.980 114.980 122.588 -7.608 25281 368 1 1 . 1 1 103 103 ILE CA C 103 59.180 59.180 60.309 -1.129 25281 369 1 1 . 1 1 103 103 ILE CB C 103 40.550 40.550 40.219 0.330 25281 370 1 1 . 1 1 103 103 ILE H H 103 7.700 7.700 8.042 -0.342 25281 371 1 1 . 1 1 104 104 PHE N N 104 123.710 123.710 122.195 1.515 25281 372 1 1 . 1 1 104 104 PHE CA C 104 53.190 53.190 57.763 -4.573 25281 373 1 1 . 1 1 104 104 PHE CB C 104 43.900 43.900 39.640 4.260 25281 374 1 1 . 1 1 104 104 PHE H H 104 8.590 8.590 8.534 0.056 25281 375 1 1 . 1 1 105 105 GLY N N 105 109.080 109.080 111.750 -2.670 25281 376 1 1 . 1 1 105 105 GLY CA C 105 45.420 45.420 44.354 1.066 25281 377 1 1 . 1 1 105 105 GLY H H 105 8.400 8.400 8.327 0.073 25281 378 1 1 . 1 1 106 106 GLN N N 106 119.680 119.680 120.393 -0.713 25281 379 1 1 . 1 1 106 106 GLN CA C 106 53.720 53.720 55.888 -2.168 25281 380 1 1 . 1 1 106 106 GLN CB C 106 30.100 30.100 29.591 0.509 25281 381 1 1 . 1 1 106 106 GLN H H 106 8.530 8.530 8.335 0.195 25281 382 1 1 . 1 1 107 107 SER N N 107 119.160 119.160 114.500 4.660 25281 383 1 1 . 1 1 107 107 SER CA C 107 57.360 57.360 57.724 -0.364 25281 384 1 1 . 1 1 107 107 SER CB C 107 66.050 66.050 65.348 0.702 25281 385 1 1 . 1 1 107 107 SER H H 107 8.800 8.800 8.302 0.498 25281 386 1 1 . 1 1 108 108 GLU N N 108 125.360 125.360 119.861 5.499 25281 387 1 1 . 1 1 108 108 GLU CA C 108 58.910 58.910 56.484 2.426 25281 388 1 1 . 1 1 108 108 GLU CB C 108 40.880 40.880 31.780 9.100 25281 389 1 1 . 1 1 108 108 GLU H H 108 8.960 8.960 8.194 0.766 25281 390 1 1 . 1 1 109 109 SER N N 109 118.890 118.890 114.597 4.293 25281 391 1 1 . 1 1 109 109 SER CA C 109 56.710 56.710 57.643 -0.933 25281 392 1 1 . 1 1 109 109 SER CB C 109 66.180 66.180 64.395 1.785 25281 393 1 1 . 1 1 109 109 SER H H 109 9.080 9.080 8.472 0.608 25281 394 1 1 . 1 1 110 110 ARG N N 110 119.830 119.830 123.191 -3.361 25281 395 1 1 . 1 1 110 110 ARG CA C 110 58.390 58.390 54.975 3.415 25281 396 1 1 . 1 1 110 110 ARG CB C 110 40.940 40.940 34.765 6.175 25281 397 1 1 . 1 1 110 110 ARG H H 110 8.850 8.850 8.915 -0.065 25281 398 1 1 . 1 1 111 111 SER N N 111 114.870 114.870 114.760 0.110 25281 399 1 1 . 1 1 111 111 SER CA C 111 57.290 57.290 56.983 0.307 25281 400 1 1 . 1 1 111 111 SER CB C 111 66.110 66.110 66.351 -0.241 25281 401 1 1 . 1 1 111 111 SER H H 111 8.740 8.740 8.423 0.317 25281 402 1 1 . 1 1 112 112 LYS N N 112 120.870 120.870 120.218 0.652 25281 403 1 1 . 1 1 112 112 LYS CA C 112 55.150 55.150 54.832 0.318 25281 404 1 1 . 1 1 112 112 LYS CB C 112 36.330 36.330 35.502 0.828 25281 405 1 1 . 1 1 112 112 LYS H H 112 8.520 8.520 8.260 0.260 25281 406 1 1 . 1 1 113 113 THR N N 113 121.390 121.390 115.517 5.873 25281 407 1 1 . 1 1 113 113 THR CA C 113 61.250 61.250 60.260 0.990 25281 408 1 1 . 1 1 113 113 THR CB C 113 70.010 70.010 70.263 -0.253 25281 409 1 1 . 1 1 113 113 THR H H 113 8.440 8.440 8.404 0.036 25281 410 1 1 . 1 1 114 114 SER N N 114 120.730 120.730 120.426 0.304 25281 411 1 1 . 1 1 114 114 SER CA C 114 56.190 56.190 56.535 -0.345 25281 412 1 1 . 1 1 114 114 SER CB C 114 66.380 66.380 65.656 0.724 25281 413 1 1 . 1 1 114 114 SER H H 114 9.350 9.350 8.449 0.901 25281 414 1 1 . 1 1 115 115 LEU N N 115 121.540 121.540 120.974 0.566 25281 415 1 1 . 1 1 115 115 LEU CA C 115 55.480 55.480 54.323 1.157 25281 416 1 1 . 1 1 115 115 LEU CB C 115 42.890 42.890 43.807 -0.917 25281 417 1 1 . 1 1 115 115 LEU H H 115 8.200 8.200 8.829 -0.629 25281 418 1 1 . 1 1 116 116 ALA N N 116 129.060 129.060 124.763 4.297 25281 419 1 1 . 1 1 116 116 ALA CA C 116 49.960 49.960 50.100 -0.140 25281 420 1 1 . 1 1 116 116 ALA CB C 116 20.310 20.310 22.276 -1.966 25281 421 1 1 . 1 1 116 116 ALA H H 116 8.600 8.600 8.744 -0.144 25281 422 1 1 . 1 1 117 117 TYR N N 117 115.890 115.890 125.707 -9.817 25281 423 1 1 . 1 1 117 117 TYR CA C 117 55.150 55.150 57.389 -2.240 25281 424 1 1 . 1 1 117 117 TYR CB C 117 41.200 41.200 42.286 -1.086 25281 425 1 1 . 1 1 117 117 TYR H H 117 8.450 8.450 8.183 0.267 25281 426 1 1 . 1 1 118 118 GLY N N 118 107.330 107.330 111.080 -3.750 25281 427 1 1 . 1 1 118 118 GLY CA C 118 45.940 45.940 45.239 0.701 25281 428 1 1 . 1 1 118 118 GLY H H 118 9.340 9.340 7.475 1.865 25281 429 1 1 . 1 1 119 119 ALA N N 119 118.880 118.880 119.266 -0.386 25281 430 1 1 . 1 1 119 119 ALA CA C 119 51.320 51.320 50.907 0.413 25281 431 1 1 . 1 1 119 119 ALA CB C 119 22.120 22.120 22.246 -0.126 25281 432 1 1 . 1 1 119 119 ALA H H 119 8.770 8.770 6.793 1.977 25281 433 1 1 . 1 1 120 120 GLY N N 120 105.730 105.730 105.576 0.154 25281 434 1 1 . 1 1 120 120 GLY CA C 120 45.650 45.650 44.263 1.387 25281 435 1 1 . 1 1 120 120 GLY H H 120 7.940 7.940 7.489 0.451 25281 436 1 1 . 1 1 121 121 LEU N N 121 115.480 115.480 119.747 -4.267 25281 437 1 1 . 1 1 121 121 LEU CA C 121 52.980 52.980 54.049 -1.069 25281 438 1 1 . 1 1 121 121 LEU CB C 121 46.460 46.460 45.606 0.854 25281 439 1 1 . 1 1 121 121 LEU H H 121 9.010 9.010 8.275 0.735 25281 440 1 1 . 1 1 122 122 GLN N N 122 112.530 112.530 120.766 -8.236 25281 441 1 1 . 1 1 122 122 GLN CA C 122 54.780 54.780 54.256 0.524 25281 442 1 1 . 1 1 122 122 GLN CB C 122 31.400 31.400 32.520 -1.120 25281 443 1 1 . 1 1 122 122 GLN H H 122 8.090 8.090 8.388 -0.298 25281 444 1 1 . 1 1 123 123 PHE N N 123 126.050 126.050 124.390 1.660 25281 445 1 1 . 1 1 123 123 PHE CA C 123 54.180 54.180 56.409 -2.229 25281 446 1 1 . 1 1 123 123 PHE CB C 123 42.560 42.560 43.081 -0.521 25281 447 1 1 . 1 1 123 123 PHE H H 123 10.020 10.020 8.664 1.356 25281 448 1 1 . 1 1 124 124 ASN N N 124 121.910 121.910 120.690 1.220 25281 449 1 1 . 1 1 124 124 ASN CA C 124 50.940 50.940 50.076 0.864 25281 450 1 1 . 1 1 124 124 ASN CB C 124 40.360 40.360 41.185 -0.825 25281 451 1 1 . 1 1 124 124 ASN H H 124 9.520 9.520 8.567 0.953 25281 452 1 1 . 1 1 125 125 PRO CA C 125 63.390 63.390 62.898 0.492 25281 453 1 1 . 1 1 125 125 PRO CB C 125 31.210 31.210 32.311 -1.101 25281 454 1 1 . 1 1 126 126 HIS N N 126 116.830 116.830 119.442 -2.612 25281 455 1 1 . 1 1 126 126 HIS CA C 126 54.110 54.110 56.209 -2.099 25281 456 1 1 . 1 1 126 126 HIS CB C 126 34.910 34.910 28.951 5.959 25281 457 1 1 . 1 1 126 126 HIS H H 126 7.630 7.630 8.074 -0.444 25281 458 1 1 . 1 1 127 127 PRO CA C 127 65.370 65.370 63.518 1.852 25281 459 1 1 . 1 1 127 127 PRO CB C 127 31.030 31.030 30.460 0.570 25281 460 1 1 . 1 1 128 128 ASN N N 128 114.680 114.680 117.113 -2.433 25281 461 1 1 . 1 1 128 128 ASN CA C 128 53.990 53.990 53.732 0.258 25281 462 1 1 . 1 1 128 128 ASN CB C 128 40.550 40.550 41.020 -0.470 25281 463 1 1 . 1 1 128 128 ASN H H 128 10.460 10.460 8.246 2.214 25281 464 1 1 . 1 1 129 129 PHE N N 129 119.630 119.630 117.139 2.491 25281 465 1 1 . 1 1 129 129 PHE CA C 129 56.530 56.530 57.051 -0.521 25281 466 1 1 . 1 1 129 129 PHE CB C 129 44.310 44.310 42.988 1.322 25281 467 1 1 . 1 1 129 129 PHE H H 129 8.340 8.340 7.554 0.786 25281 468 1 1 . 1 1 130 130 VAL N N 130 123.000 123.000 120.323 2.677 25281 469 1 1 . 1 1 130 130 VAL CA C 130 60.340 60.340 61.395 -1.055 25281 470 1 1 . 1 1 130 130 VAL CB C 130 34.970 34.970 35.291 -0.321 25281 471 1 1 . 1 1 130 130 VAL H H 130 7.820 7.820 8.736 -0.916 25281 472 1 1 . 1 1 131 131 ILE N N 131 124.470 124.470 127.173 -2.703 25281 473 1 1 . 1 1 131 131 ILE CA C 131 60.210 60.210 59.333 0.877 25281 474 1 1 . 1 1 131 131 ILE CB C 131 39.510 39.510 41.403 -1.893 25281 475 1 1 . 1 1 131 131 ILE H H 131 8.830 8.830 8.941 -0.111 25281 476 1 1 . 1 1 132 132 ASP N N 132 130.700 130.700 129.483 1.217 25281 477 1 1 . 1 1 132 132 ASP CA C 132 53.530 53.530 52.998 0.532 25281 478 1 1 . 1 1 132 132 ASP CB C 132 47.620 47.620 44.360 3.260 25281 479 1 1 . 1 1 132 132 ASP H H 132 9.040 9.040 8.372 0.668 25281 480 1 1 . 1 1 133 133 ALA N N 133 126.900 126.900 128.729 -1.829 25281 481 1 1 . 1 1 133 133 ALA CA C 133 51.390 51.390 50.350 1.040 25281 482 1 1 . 1 1 133 133 ALA CB C 133 21.730 21.730 22.069 -0.339 25281 483 1 1 . 1 1 133 133 ALA H H 133 8.800 8.800 8.154 0.646 25281 484 1 1 . 1 1 134 134 SER N N 134 113.760 113.760 117.356 -3.596 25281 485 1 1 . 1 1 134 134 SER CA C 134 58.140 58.140 57.150 0.990 25281 486 1 1 . 1 1 134 134 SER CB C 134 67.020 67.020 66.236 0.784 25281 487 1 1 . 1 1 134 134 SER H H 134 9.160 9.160 8.709 0.451 25281 488 1 1 . 1 1 135 135 TYR N N 135 118.500 118.500 116.082 2.418 25281 489 1 1 . 1 1 135 135 TYR CA C 135 55.690 55.690 56.152 -0.462 25281 490 1 1 . 1 1 135 135 TYR CB C 135 43.150 43.150 41.343 1.808 25281 491 1 1 . 1 1 135 135 TYR H H 135 8.820 8.820 7.808 1.012 25281 492 1 1 . 1 1 136 136 GLU N N 136 126.290 126.290 118.804 7.486 25281 493 1 1 . 1 1 136 136 GLU CA C 136 53.530 53.530 54.983 -1.453 25281 494 1 1 . 1 1 136 136 GLU CB C 136 34.450 34.450 34.699 -0.249 25281 495 1 1 . 1 1 136 136 GLU H H 136 8.380 8.380 8.744 -0.364 25281 496 1 1 . 1 1 137 137 TYR N N 137 123.630 123.630 120.790 2.840 25281 497 1 1 . 1 1 137 137 TYR CA C 137 55.670 55.670 56.919 -1.249 25281 498 1 1 . 1 1 137 137 TYR CB C 137 43.150 43.150 42.742 0.408 25281 499 1 1 . 1 1 137 137 TYR H H 137 9.300 9.300 8.899 0.401 25281 500 1 1 . 1 1 138 138 SER N N 138 118.300 118.300 116.378 1.922 25281 501 1 1 . 1 1 138 138 SER CA C 138 58.270 58.270 56.010 2.260 25281 502 1 1 . 1 1 138 138 SER CB C 138 67.090 67.090 65.366 1.724 25281 503 1 1 . 1 1 138 138 SER H H 138 7.980 7.980 9.007 -1.027 25281 504 1 1 . 1 1 139 139 LYS N N 139 127.450 127.450 128.785 -1.335 25281 505 1 1 . 1 1 139 139 LYS CA C 139 55.160 55.160 55.841 -0.681 25281 506 1 1 . 1 1 139 139 LYS CB C 139 32.640 32.640 32.959 -0.319 25281 507 1 1 . 1 1 139 139 LYS H H 139 8.630 8.630 8.506 0.124 25281 508 1 1 . 1 1 140 140 LEU N N 140 129.650 129.650 126.902 2.748 25281 509 1 1 . 1 1 140 140 LEU CA C 140 52.500 52.500 53.569 -1.069 25281 510 1 1 . 1 1 140 140 LEU CB C 140 40.000 40.000 44.468 -4.468 25281 511 1 1 . 1 1 140 140 LEU H H 140 9.060 9.060 7.971 1.089 25281 512 1 1 . 1 1 141 141 ASP N N 141 121.470 121.470 123.219 -1.749 25281 513 1 1 . 1 1 141 141 ASP CA C 141 57.190 57.190 56.812 0.378 25281 514 1 1 . 1 1 141 141 ASP CB C 141 39.730 39.730 40.910 -1.180 25281 515 1 1 . 1 1 141 141 ASP H H 141 8.590 8.590 8.650 -0.060 25281 516 1 1 . 1 1 142 142 ASP N N 142 121.510 121.510 118.685 2.825 25281 517 1 1 . 1 1 142 142 ASP CA C 142 55.180 55.180 55.167 0.013 25281 518 1 1 . 1 1 142 142 ASP CB C 142 41.090 41.090 41.326 -0.236 25281 519 1 1 . 1 1 142 142 ASP H H 142 8.430 8.430 8.391 0.039 25281 520 1 1 . 1 1 143 143 VAL N N 143 121.420 121.420 112.192 9.228 25281 521 1 1 . 1 1 143 143 VAL CA C 143 62.240 62.240 60.747 1.493 25281 522 1 1 . 1 1 143 143 VAL CB C 143 31.280 31.280 34.825 -3.545 25281 523 1 1 . 1 1 143 143 VAL H H 143 8.020 8.020 7.391 0.629 25281 524 1 1 . 1 1 144 144 LYS N N 144 127.950 127.950 123.875 4.075 25281 525 1 1 . 1 1 144 144 LYS CA C 144 55.440 55.440 55.795 -0.356 25281 526 1 1 . 1 1 144 144 LYS CB C 144 32.640 32.640 33.724 -1.084 25281 527 1 1 . 1 1 144 144 LYS H H 144 8.660 8.660 8.436 0.224 25281 528 1 1 . 1 1 145 145 VAL N N 145 124.120 124.120 126.483 -2.363 25281 529 1 1 . 1 1 145 145 VAL CA C 145 55.910 55.910 60.507 -4.597 25281 530 1 1 . 1 1 145 145 VAL CB C 145 32.570 32.570 34.563 -1.993 25281 531 1 1 . 1 1 145 145 VAL H H 145 8.720 8.720 7.905 0.815 25281 532 1 1 . 1 1 146 146 GLY N N 146 116.240 116.240 114.494 1.746 25281 533 1 1 . 1 1 146 146 GLY CA C 146 44.080 44.080 43.891 0.189 25281 534 1 1 . 1 1 146 146 GLY H H 146 8.400 8.400 8.467 -0.067 25281 535 1 1 . 1 1 147 147 THR N N 147 124.620 124.620 120.293 4.327 25281 536 1 1 . 1 1 147 147 THR CA C 147 61.450 61.450 61.237 0.213 25281 537 1 1 . 1 1 147 147 THR CB C 147 70.260 70.260 70.788 -0.528 25281 538 1 1 . 1 1 147 147 THR H H 147 9.080 9.080 8.294 0.786 25281 539 1 1 . 1 1 148 148 TRP N N 148 124.790 124.790 126.567 -1.777 25281 540 1 1 . 1 1 148 148 TRP CA C 148 54.770 54.770 56.346 -1.576 25281 541 1 1 . 1 1 148 148 TRP CB C 148 33.090 33.090 33.027 0.063 25281 542 1 1 . 1 1 148 148 TRP H H 148 8.510 8.510 9.016 -0.506 25281 543 1 1 . 1 1 149 149 MET N N 149 118.880 118.880 120.348 -1.468 25281 544 1 1 . 1 1 149 149 MET CA C 149 54.540 54.540 54.714 -0.174 25281 545 1 1 . 1 1 149 149 MET CB C 149 34.640 34.640 36.035 -1.395 25281 546 1 1 . 1 1 149 149 MET H H 149 9.150 9.150 9.332 -0.182 25281 547 1 1 . 1 1 150 150 LEU N N 150 122.830 122.830 125.673 -2.843 25281 548 1 1 . 1 1 150 150 LEU CA C 150 54.100 54.100 54.192 -0.092 25281 549 1 1 . 1 1 150 150 LEU CB C 150 45.800 45.800 46.072 -0.272 25281 550 1 1 . 1 1 150 150 LEU H H 150 8.480 8.480 8.154 0.326 25281 551 1 1 . 1 1 151 151 GLY N N 151 112.730 112.730 111.814 0.916 25281 552 1 1 . 1 1 151 151 GLY CA C 151 45.940 45.940 45.697 0.243 25281 553 1 1 . 1 1 151 151 GLY H H 151 9.820 9.820 8.195 1.625 25281 554 1 1 . 1 1 152 152 ALA N N 152 119.460 119.460 120.210 -0.750 25281 555 1 1 . 1 1 152 152 ALA CA C 152 49.760 49.760 50.662 -0.902 25281 556 1 1 . 1 1 152 152 ALA CB C 152 22.700 22.700 22.881 -0.181 25281 557 1 1 . 1 1 152 152 ALA H H 152 8.840 8.840 8.380 0.460 25281 558 1 1 . 1 1 153 153 GLY N N 153 104.360 104.360 107.040 -2.680 25281 559 1 1 . 1 1 153 153 GLY CA C 153 46.440 46.440 44.710 1.730 25281 560 1 1 . 1 1 153 153 GLY H H 153 8.540 8.540 8.926 -0.386 25281 561 1 1 . 1 1 154 154 TYR N N 154 120.680 120.680 120.037 0.643 25281 562 1 1 . 1 1 154 154 TYR CA C 154 55.370 55.370 56.476 -1.106 25281 563 1 1 . 1 1 154 154 TYR CB C 154 44.250 44.250 42.592 1.658 25281 564 1 1 . 1 1 154 154 TYR H H 154 8.310 8.310 8.137 0.173 25281 565 1 1 . 1 1 155 155 ARG N N 155 127.050 127.050 128.958 -1.908 25281 566 1 1 . 1 1 155 155 ARG CA C 155 53.480 53.480 55.434 -1.954 25281 567 1 1 . 1 1 155 155 ARG CB C 155 32.160 32.160 30.674 1.486 25281 568 1 1 . 1 1 155 155 ARG H H 155 7.640 7.640 7.969 -0.329 25281 569 1 2 . 1 1 2 2 GLY N N 2 112.280 112.280 109.885 2.395 25281 570 1 2 . 1 1 2 2 GLY CA C 2 44.830 44.830 45.524 -0.694 25281 571 1 2 . 1 1 2 2 GLY H H 2 8.460 8.460 8.439 0.021 25281 572 1 2 . 1 1 3 3 GLU N N 3 118.460 118.460 120.115 -1.655 25281 573 1 2 . 1 1 3 3 GLU CA C 3 56.840 56.840 56.689 0.151 25281 574 1 2 . 1 1 3 3 GLU CB C 3 29.980 29.980 30.911 -0.931 25281 575 1 2 . 1 1 3 3 GLU H H 3 7.630 7.630 8.431 -0.800 25281 576 1 2 . 1 1 4 4 SER N N 4 119.000 119.000 117.298 1.702 25281 577 1 2 . 1 1 4 4 SER CA C 4 57.280 57.280 56.983 0.297 25281 578 1 2 . 1 1 4 4 SER CB C 4 65.860 65.860 66.576 -0.716 25281 579 1 2 . 1 1 4 4 SER H H 4 8.820 8.820 8.264 0.556 25281 580 1 2 . 1 1 5 5 SER N N 5 118.300 118.300 117.402 0.898 25281 581 1 2 . 1 1 5 5 SER CA C 5 57.560 57.560 57.109 0.451 25281 582 1 2 . 1 1 5 5 SER CB C 5 65.480 65.480 65.230 0.250 25281 583 1 2 . 1 1 5 5 SER H H 5 8.700 8.700 8.021 0.679 25281 584 1 2 . 1 1 6 6 ILE N N 6 123.240 123.240 127.377 -4.137 25281 585 1 2 . 1 1 6 6 ILE CA C 6 54.110 54.110 60.544 -6.434 25281 586 1 2 . 1 1 6 6 ILE CB C 6 33.870 33.870 40.522 -6.652 25281 587 1 2 . 1 1 6 6 ILE H H 6 9.080 9.080 7.648 1.432 25281 588 1 2 . 1 1 7 7 SER N N 7 116.100 116.100 121.531 -5.431 25281 589 1 2 . 1 1 7 7 SER CA C 7 57.130 57.130 57.340 -0.210 25281 590 1 2 . 1 1 7 7 SER CB C 7 65.710 65.710 65.926 -0.216 25281 591 1 2 . 1 1 7 7 SER H H 7 8.570 8.570 8.146 0.424 25281 592 1 2 . 1 1 8 8 ILE N N 8 114.140 114.140 122.204 -8.064 25281 593 1 2 . 1 1 8 8 ILE CA C 8 58.460 58.460 59.138 -0.678 25281 594 1 2 . 1 1 8 8 ILE CB C 8 40.880 40.880 42.306 -1.426 25281 595 1 2 . 1 1 8 8 ILE H H 8 8.300 8.300 8.115 0.185 25281 596 1 2 . 1 1 9 9 GLY N N 9 109.200 109.200 111.390 -2.190 25281 597 1 2 . 1 1 9 9 GLY CA C 9 45.550 45.550 45.581 -0.032 25281 598 1 2 . 1 1 9 9 GLY H H 9 9.060 9.060 7.787 1.273 25281 599 1 2 . 1 1 10 10 TYR N N 10 121.410 121.410 119.249 2.161 25281 600 1 2 . 1 1 10 10 TYR CA C 10 56.970 56.970 56.943 0.027 25281 601 1 2 . 1 1 10 10 TYR CB C 10 41.520 41.520 41.580 -0.060 25281 602 1 2 . 1 1 10 10 TYR H H 10 8.870 8.870 7.948 0.922 25281 603 1 2 . 1 1 11 11 ALA N N 11 125.250 125.250 123.275 1.975 25281 604 1 2 . 1 1 11 11 ALA CA C 11 48.740 48.740 50.407 -1.667 25281 605 1 2 . 1 1 11 11 ALA CB C 11 21.610 21.610 22.566 -0.956 25281 606 1 2 . 1 1 11 11 ALA H H 11 7.210 7.210 8.131 -0.921 25281 607 1 2 . 1 1 12 12 GLN N N 12 119.180 119.180 120.394 -1.214 25281 608 1 2 . 1 1 12 12 GLN CA C 12 54.690 54.690 54.950 -0.260 25281 609 1 2 . 1 1 12 12 GLN CB C 12 32.000 32.000 33.560 -1.560 25281 610 1 2 . 1 1 12 12 GLN H H 12 8.330 8.330 8.167 0.163 25281 611 1 2 . 1 1 13 13 SER N N 13 122.790 122.790 118.118 4.672 25281 612 1 2 . 1 1 13 13 SER CA C 13 57.780 57.780 57.706 0.074 25281 613 1 2 . 1 1 13 13 SER CB C 13 64.540 64.540 64.536 0.004 25281 614 1 2 . 1 1 13 13 SER H H 13 8.610 8.610 8.784 -0.174 25281 615 1 2 . 1 1 14 14 ARG N N 14 121.140 121.140 126.192 -5.052 25281 616 1 2 . 1 1 14 14 ARG CA C 14 54.960 54.960 54.808 0.152 25281 617 1 2 . 1 1 14 14 ARG CB C 14 32.370 32.370 32.233 0.137 25281 618 1 2 . 1 1 14 14 ARG H H 14 8.520 8.520 9.107 -0.587 25281 619 1 2 . 1 1 15 15 VAL N N 15 115.890 115.890 120.876 -4.986 25281 620 1 2 . 1 1 15 15 VAL CA C 15 60.970 60.970 60.401 0.569 25281 621 1 2 . 1 1 15 15 VAL CB C 15 34.320 34.320 35.871 -1.551 25281 622 1 2 . 1 1 15 15 VAL H H 15 8.440 8.440 7.899 0.541 25281 623 1 2 . 1 1 16 16 LYS N N 16 126.010 126.010 125.287 0.723 25281 624 1 2 . 1 1 16 16 LYS CA C 16 55.120 55.120 55.964 -0.844 25281 625 1 2 . 1 1 16 16 LYS CB C 16 34.350 34.350 32.395 1.955 25281 626 1 2 . 1 1 16 16 LYS H H 16 8.850 8.850 8.650 0.200 25281 627 1 2 . 1 1 17 17 GLU N N 17 119.140 119.140 124.912 -5.772 25281 628 1 2 . 1 1 17 17 GLU CA C 17 54.460 54.460 54.809 -0.350 25281 629 1 2 . 1 1 17 17 GLU CB C 17 33.430 33.430 32.056 1.374 25281 630 1 2 . 1 1 17 17 GLU H H 17 8.030 8.030 8.453 -0.423 25281 631 1 2 . 1 1 18 18 ASP N N 18 120.280 120.280 120.202 0.078 25281 632 1 2 . 1 1 18 18 ASP CA C 18 56.500 56.500 55.275 1.225 25281 633 1 2 . 1 1 18 18 ASP CB C 18 33.780 33.780 41.188 -7.408 25281 634 1 2 . 1 1 18 18 ASP H H 18 8.120 8.120 8.464 -0.344 25281 635 1 2 . 1 1 19 19 GLY N N 19 118.750 118.750 108.640 10.110 25281 636 1 2 . 1 1 19 19 GLY CA C 19 44.130 44.130 44.452 -0.322 25281 637 1 2 . 1 1 19 19 GLY H H 19 8.430 8.430 8.281 0.149 25281 638 1 2 . 1 1 20 20 TYR N N 20 117.080 117.080 124.306 -7.226 25281 639 1 2 . 1 1 20 20 TYR CA C 20 60.940 60.940 58.517 2.423 25281 640 1 2 . 1 1 20 20 TYR CB C 20 42.010 42.010 37.815 4.195 25281 641 1 2 . 1 1 20 20 TYR H H 20 8.610 8.610 8.591 0.019 25281 642 1 2 . 1 1 21 21 LYS N N 21 127.240 127.240 123.892 3.348 25281 643 1 2 . 1 1 21 21 LYS CA C 21 56.760 56.760 56.661 0.099 25281 644 1 2 . 1 1 21 21 LYS CB C 21 29.100 29.100 32.495 -3.395 25281 645 1 2 . 1 1 21 21 LYS H H 21 7.970 7.970 8.557 -0.588 25281 646 1 2 . 1 1 22 22 LEU N N 22 122.270 122.270 120.800 1.470 25281 647 1 2 . 1 1 22 22 LEU CA C 22 59.170 59.170 57.004 2.166 25281 648 1 2 . 1 1 22 22 LEU CB C 22 40.030 40.030 41.423 -1.393 25281 649 1 2 . 1 1 22 22 LEU H H 22 8.370 8.370 8.011 0.359 25281 650 1 2 . 1 1 23 23 ASP N N 23 114.790 114.790 115.446 -0.656 25281 651 1 2 . 1 1 23 23 ASP CA C 23 51.840 51.840 53.884 -2.044 25281 652 1 2 . 1 1 23 23 ASP CB C 23 37.730 37.730 41.519 -3.789 25281 653 1 2 . 1 1 23 23 ASP H H 23 8.210 8.210 8.175 0.035 25281 654 1 2 . 1 1 24 24 LYS N N 24 115.470 115.470 114.961 0.509 25281 655 1 2 . 1 1 24 24 LYS CA C 24 58.860 58.860 57.851 1.009 25281 656 1 2 . 1 1 24 24 LYS CB C 24 28.330 28.330 30.373 -2.043 25281 657 1 2 . 1 1 24 24 LYS H H 24 9.230 9.230 7.733 1.497 25281 658 1 2 . 1 1 25 25 ASN N N 25 121.610 121.610 115.794 5.816 25281 659 1 2 . 1 1 25 25 ASN CA C 25 54.430 54.430 50.797 3.633 25281 660 1 2 . 1 1 25 25 ASN CB C 25 42.500 42.500 39.962 2.538 25281 661 1 2 . 1 1 25 25 ASN H H 25 8.150 8.150 8.021 0.129 25281 662 1 2 . 1 1 26 26 PRO CA C 26 63.340 63.340 62.638 0.702 25281 663 1 2 . 1 1 26 26 PRO CB C 26 30.940 30.940 33.692 -2.752 25281 664 1 2 . 1 1 27 27 ARG N N 27 120.730 120.730 119.242 1.488 25281 665 1 2 . 1 1 27 27 ARG CA C 27 54.340 54.340 55.712 -1.373 25281 666 1 2 . 1 1 27 27 ARG CB C 27 33.500 33.500 31.354 2.146 25281 667 1 2 . 1 1 27 27 ARG H H 27 8.290 8.290 8.396 -0.106 25281 668 1 2 . 1 1 28 28 GLY N N 28 112.000 112.000 112.115 -0.115 25281 669 1 2 . 1 1 28 28 GLY CA C 28 46.940 46.940 44.658 2.282 25281 670 1 2 . 1 1 28 28 GLY H H 28 8.810 8.810 7.713 1.097 25281 671 1 2 . 1 1 29 29 PHE N N 29 121.230 121.230 117.679 3.551 25281 672 1 2 . 1 1 29 29 PHE CA C 29 55.230 55.230 56.646 -1.416 25281 673 1 2 . 1 1 29 29 PHE CB C 29 43.700 43.700 43.463 0.237 25281 674 1 2 . 1 1 29 29 PHE H H 29 8.470 8.470 8.299 0.171 25281 675 1 2 . 1 1 30 30 ASN N N 30 117.250 117.250 121.224 -3.974 25281 676 1 2 . 1 1 30 30 ASN CA C 30 50.220 50.220 52.564 -2.344 25281 677 1 2 . 1 1 30 30 ASN CB C 30 45.810 45.810 41.834 3.976 25281 678 1 2 . 1 1 30 30 ASN H H 30 8.630 8.630 8.629 0.001 25281 679 1 2 . 1 1 31 31 LEU N N 31 128.180 128.180 128.159 0.021 25281 680 1 2 . 1 1 31 31 LEU CA C 31 53.930 53.930 53.850 0.080 25281 681 1 2 . 1 1 31 31 LEU CB C 31 45.810 45.810 45.615 0.195 25281 682 1 2 . 1 1 31 31 LEU H H 31 9.080 9.080 8.825 0.255 25281 683 1 2 . 1 1 32 32 LYS N N 32 119.980 119.980 126.094 -6.114 25281 684 1 2 . 1 1 32 32 LYS CA C 32 55.730 55.730 54.592 1.138 25281 685 1 2 . 1 1 32 32 LYS CB C 32 36.070 36.070 36.421 -0.351 25281 686 1 2 . 1 1 32 32 LYS H H 32 8.780 8.780 8.153 0.627 25281 687 1 2 . 1 1 33 33 TYR N N 33 121.500 121.500 123.975 -2.475 25281 688 1 2 . 1 1 33 33 TYR CA C 33 55.830 55.830 56.698 -0.868 25281 689 1 2 . 1 1 33 33 TYR CB C 33 42.110 42.110 42.478 -0.368 25281 690 1 2 . 1 1 33 33 TYR H H 33 8.640 8.640 8.320 0.320 25281 691 1 2 . 1 1 34 34 ARG N N 34 128.980 128.980 128.998 -0.018 25281 692 1 2 . 1 1 34 34 ARG CA C 34 52.690 52.690 54.054 -1.364 25281 693 1 2 . 1 1 34 34 ARG CB C 34 34.320 34.320 34.162 0.158 25281 694 1 2 . 1 1 34 34 ARG H H 34 8.830 8.830 7.744 1.086 25281 695 1 2 . 1 1 35 35 TYR N N 35 124.820 124.820 128.655 -3.835 25281 696 1 2 . 1 1 35 35 TYR CA C 35 56.640 56.640 56.387 0.253 25281 697 1 2 . 1 1 35 35 TYR CB C 35 41.980 41.980 41.336 0.644 25281 698 1 2 . 1 1 35 35 TYR H H 35 8.840 8.840 8.119 0.721 25281 699 1 2 . 1 1 39 39 ASN N N 39 127.690 127.690 122.382 5.308 25281 700 1 2 . 1 1 39 39 ASN CA C 39 54.850 54.850 53.290 1.560 25281 701 1 2 . 1 1 39 39 ASN CB C 39 38.290 38.290 37.361 0.930 25281 702 1 2 . 1 1 39 39 ASN H H 39 7.990 7.990 8.360 -0.370 25281 703 1 2 . 1 1 40 40 ASP N N 40 115.200 115.200 122.564 -7.364 25281 704 1 2 . 1 1 40 40 ASP CA C 40 55.210 55.210 53.313 1.897 25281 705 1 2 . 1 1 40 40 ASP CB C 40 44.010 44.010 41.907 2.103 25281 706 1 2 . 1 1 40 40 ASP H H 40 8.370 8.370 7.804 0.566 25281 707 1 2 . 1 1 41 41 TRP N N 41 124.210 124.210 119.235 4.975 25281 708 1 2 . 1 1 41 41 TRP CA C 41 55.840 55.840 56.219 -0.379 25281 709 1 2 . 1 1 41 41 TRP CB C 41 33.540 33.540 30.524 3.016 25281 710 1 2 . 1 1 41 41 TRP H H 41 9.130 9.130 8.159 0.971 25281 711 1 2 . 1 1 42 42 GLY N N 42 107.800 107.800 108.886 -1.086 25281 712 1 2 . 1 1 42 42 GLY CA C 42 45.870 45.870 44.430 1.440 25281 713 1 2 . 1 1 42 42 GLY H H 42 8.610 8.610 8.081 0.529 25281 714 1 2 . 1 1 43 43 VAL N N 43 116.260 116.260 118.551 -2.291 25281 715 1 2 . 1 1 43 43 VAL CA C 43 58.980 58.980 61.064 -2.084 25281 716 1 2 . 1 1 43 43 VAL CB C 43 35.430 35.430 35.127 0.303 25281 717 1 2 . 1 1 43 43 VAL H H 43 8.880 8.880 7.809 1.071 25281 718 1 2 . 1 1 44 44 ILE N N 44 124.720 124.720 125.724 -1.004 25281 719 1 2 . 1 1 44 44 ILE CA C 44 58.390 58.390 58.770 -0.381 25281 720 1 2 . 1 1 44 44 ILE CB C 44 42.890 42.890 42.123 0.767 25281 721 1 2 . 1 1 44 44 ILE H H 44 9.110 9.110 8.042 1.068 25281 722 1 2 . 1 1 45 45 GLY N N 45 110.610 110.610 114.175 -3.565 25281 723 1 2 . 1 1 45 45 GLY CA C 45 43.150 43.150 43.637 -0.487 25281 724 1 2 . 1 1 45 45 GLY H H 45 8.910 8.910 8.228 0.682 25281 725 1 2 . 1 1 46 46 SER N N 46 116.210 116.210 118.313 -2.103 25281 726 1 2 . 1 1 46 46 SER CA C 46 56.250 56.250 56.182 0.068 25281 727 1 2 . 1 1 46 46 SER CB C 46 63.720 63.720 64.769 -1.049 25281 728 1 2 . 1 1 46 46 SER H H 46 9.250 9.250 8.727 0.523 25281 729 1 2 . 1 1 47 47 PHE N N 47 126.400 126.400 126.380 0.020 25281 730 1 2 . 1 1 47 47 PHE CA C 47 55.090 55.090 56.282 -1.192 25281 731 1 2 . 1 1 47 47 PHE CB C 47 42.560 42.560 42.891 -0.331 25281 732 1 2 . 1 1 47 47 PHE H H 47 8.940 8.940 8.687 0.253 25281 733 1 2 . 1 1 48 48 ALA N N 48 131.930 131.930 123.913 8.017 25281 734 1 2 . 1 1 48 48 ALA CA C 48 50.350 50.350 51.035 -0.685 25281 735 1 2 . 1 1 48 48 ALA CB C 48 21.280 21.280 23.184 -1.904 25281 736 1 2 . 1 1 48 48 ALA H H 48 8.790 8.790 8.469 0.321 25281 737 1 2 . 1 1 49 49 GLN N N 49 116.070 116.070 118.278 -2.208 25281 738 1 2 . 1 1 49 49 GLN CA C 49 54.110 54.110 54.614 -0.504 25281 739 1 2 . 1 1 49 49 GLN CB C 49 31.140 31.140 33.106 -1.966 25281 740 1 2 . 1 1 49 49 GLN H H 49 7.720 7.720 8.433 -0.713 25281 741 1 2 . 1 1 50 50 THR N N 50 115.990 115.990 114.402 1.588 25281 742 1 2 . 1 1 50 50 THR CA C 50 59.270 59.270 61.330 -2.059 25281 743 1 2 . 1 1 50 50 THR CB C 50 70.980 70.980 71.694 -0.714 25281 744 1 2 . 1 1 50 50 THR H H 50 9.470 9.470 8.495 0.975 25281 745 1 2 . 1 1 51 51 ARG N N 51 117.600 117.600 123.845 -6.245 25281 746 1 2 . 1 1 51 51 ARG CA C 51 55.350 55.350 54.850 0.500 25281 747 1 2 . 1 1 51 51 ARG CB C 51 33.610 33.610 32.442 1.168 25281 748 1 2 . 1 1 51 51 ARG H H 51 8.600 8.600 8.053 0.547 25281 749 1 2 . 1 1 52 52 ARG N N 52 121.400 121.400 126.192 -4.792 25281 750 1 2 . 1 1 52 52 ARG CA C 52 56.910 56.910 55.563 1.347 25281 751 1 2 . 1 1 52 52 ARG CB C 52 29.370 29.370 31.098 -1.728 25281 752 1 2 . 1 1 52 52 ARG H H 52 8.380 8.380 7.819 0.561 25281 753 1 2 . 1 1 53 53 GLY N N 53 111.040 111.040 110.186 0.854 25281 754 1 2 . 1 1 53 53 GLY CA C 53 45.190 45.190 45.148 0.042 25281 755 1 2 . 1 1 53 53 GLY H H 53 8.330 8.330 8.660 -0.330 25281 756 1 2 . 1 1 54 54 PHE N N 54 119.210 119.210 122.282 -3.072 25281 757 1 2 . 1 1 54 54 PHE CA C 54 55.670 55.670 58.612 -2.942 25281 758 1 2 . 1 1 54 54 PHE CB C 54 29.220 29.220 38.118 -8.898 25281 759 1 2 . 1 1 54 54 PHE H H 54 7.720 7.720 8.125 -0.405 25281 760 1 2 . 1 1 55 55 GLU N N 55 123.470 123.470 125.214 -1.744 25281 761 1 2 . 1 1 55 55 GLU CA C 55 55.580 55.580 55.823 -0.243 25281 762 1 2 . 1 1 55 55 GLU CB C 55 32.920 32.920 31.607 1.313 25281 763 1 2 . 1 1 55 55 GLU H H 55 8.400 8.400 8.408 -0.008 25281 764 1 2 . 1 1 56 56 GLU N N 56 121.950 121.950 124.081 -2.131 25281 765 1 2 . 1 1 56 56 GLU CA C 56 56.690 56.690 56.757 -0.067 25281 766 1 2 . 1 1 56 56 GLU CB C 56 29.450 29.450 29.329 0.121 25281 767 1 2 . 1 1 56 56 GLU H H 56 8.500 8.500 8.593 -0.093 25281 768 1 2 . 1 1 57 57 SER N N 57 123.330 123.330 120.463 2.867 25281 769 1 2 . 1 1 57 57 SER CA C 57 55.090 55.090 57.636 -2.546 25281 770 1 2 . 1 1 57 57 SER CB C 57 64.890 64.890 63.973 0.917 25281 771 1 2 . 1 1 57 57 SER H H 57 8.640 8.640 8.206 0.434 25281 772 1 2 . 1 1 58 58 VAL N N 58 122.060 122.060 124.883 -2.823 25281 773 1 2 . 1 1 58 58 VAL CA C 58 57.660 57.660 62.516 -4.856 25281 774 1 2 . 1 1 58 58 VAL CB C 58 31.640 31.640 34.186 -2.546 25281 775 1 2 . 1 1 58 58 VAL H H 58 8.480 8.480 8.432 0.048 25281 776 1 2 . 1 1 59 59 ASP N N 59 123.390 123.390 127.710 -4.320 25281 777 1 2 . 1 1 59 59 ASP CA C 59 54.960 54.960 53.537 1.423 25281 778 1 2 . 1 1 59 59 ASP CB C 59 42.840 42.840 42.037 0.803 25281 779 1 2 . 1 1 59 59 ASP H H 59 9.360 9.360 8.928 0.432 25281 780 1 2 . 1 1 60 60 GLY N N 60 105.230 105.230 107.453 -2.223 25281 781 1 2 . 1 1 60 60 GLY CA C 60 45.130 45.130 45.051 0.079 25281 782 1 2 . 1 1 60 60 GLY H H 60 8.210 8.210 7.515 0.695 25281 783 1 2 . 1 1 61 61 PHE N N 61 121.440 121.440 122.387 -0.947 25281 784 1 2 . 1 1 61 61 PHE CA C 61 57.330 57.330 58.341 -1.011 25281 785 1 2 . 1 1 61 61 PHE CB C 61 39.420 39.420 38.978 0.442 25281 786 1 2 . 1 1 61 61 PHE H H 61 8.330 8.330 8.457 -0.127 25281 787 1 2 . 1 1 62 62 LYS N N 62 119.870 119.870 126.585 -6.715 25281 788 1 2 . 1 1 62 62 LYS CA C 62 56.340 56.340 54.371 1.969 25281 789 1 2 . 1 1 62 62 LYS CB C 62 33.850 33.850 35.574 -1.724 25281 790 1 2 . 1 1 62 62 LYS H H 62 8.480 8.480 7.700 0.780 25281 791 1 2 . 1 1 63 63 LEU N N 63 125.160 125.160 122.607 2.553 25281 792 1 2 . 1 1 63 63 LEU CA C 63 56.220 56.220 57.289 -1.069 25281 793 1 2 . 1 1 63 63 LEU CB C 63 41.520 41.520 41.813 -0.293 25281 794 1 2 . 1 1 63 63 LEU H H 63 8.910 8.910 8.711 0.199 25281 795 1 2 . 1 1 64 64 ILE N N 64 119.660 119.660 114.321 5.339 25281 796 1 2 . 1 1 64 64 ILE CA C 64 62.420 62.420 63.793 -1.373 25281 797 1 2 . 1 1 64 64 ILE CB C 64 37.700 37.700 36.955 0.745 25281 798 1 2 . 1 1 64 64 ILE H H 64 8.210 8.210 7.870 0.340 25281 799 1 2 . 1 1 65 65 ASP N N 65 117.080 117.080 120.226 -3.146 25281 800 1 2 . 1 1 65 65 ASP CA C 65 57.420 57.420 56.334 1.086 25281 801 1 2 . 1 1 65 65 ASP CB C 65 38.350 38.350 40.043 -1.693 25281 802 1 2 . 1 1 65 65 ASP H H 65 7.710 7.710 7.675 0.035 25281 803 1 2 . 1 1 66 66 GLY N N 66 106.440 106.440 106.096 0.344 25281 804 1 2 . 1 1 66 66 GLY CA C 66 45.170 45.170 45.170 -0.000 25281 805 1 2 . 1 1 66 66 GLY H H 66 7.920 7.920 7.502 0.418 25281 806 1 2 . 1 1 67 67 ASP N N 67 118.490 118.490 120.106 -1.616 25281 807 1 2 . 1 1 67 67 ASP CA C 67 57.340 57.340 55.168 2.172 25281 808 1 2 . 1 1 67 67 ASP CB C 67 29.870 29.870 40.254 -10.384 25281 809 1 2 . 1 1 67 67 ASP H H 67 7.820 7.820 7.798 0.022 25281 810 1 2 . 1 1 68 68 PHE N N 68 125.320 125.320 118.910 6.410 25281 811 1 2 . 1 1 68 68 PHE CA C 68 56.090 56.090 56.398 -0.308 25281 812 1 2 . 1 1 68 68 PHE CB C 68 41.940 41.940 41.813 0.127 25281 813 1 2 . 1 1 68 68 PHE H H 68 8.310 8.310 7.613 0.697 25281 814 1 2 . 1 1 69 69 LYS N N 69 124.770 124.770 119.609 5.161 25281 815 1 2 . 1 1 69 69 LYS CA C 69 54.880 54.880 55.123 -0.242 25281 816 1 2 . 1 1 69 69 LYS CB C 69 36.920 36.920 35.786 1.134 25281 817 1 2 . 1 1 69 69 LYS H H 69 8.730 8.730 8.507 0.223 25281 818 1 2 . 1 1 70 70 TYR N N 70 123.740 123.740 125.513 -1.773 25281 819 1 2 . 1 1 70 70 TYR CA C 70 55.540 55.540 56.329 -0.789 25281 820 1 2 . 1 1 70 70 TYR CB C 70 40.150 40.150 42.123 -1.973 25281 821 1 2 . 1 1 70 70 TYR H H 70 8.680 8.680 8.390 0.290 25281 822 1 2 . 1 1 71 71 TYR N N 71 123.920 123.920 122.958 0.962 25281 823 1 2 . 1 1 71 71 TYR CA C 71 54.500 54.500 55.099 -0.599 25281 824 1 2 . 1 1 71 71 TYR CB C 71 42.420 42.420 41.563 0.857 25281 825 1 2 . 1 1 71 71 TYR H H 71 8.620 8.620 7.404 1.216 25281 826 1 2 . 1 1 72 72 SER N N 72 113.820 113.820 114.539 -0.719 25281 827 1 2 . 1 1 72 72 SER CA C 72 56.320 56.320 57.638 -1.318 25281 828 1 2 . 1 1 72 72 SER CB C 72 65.790 65.790 66.999 -1.209 25281 829 1 2 . 1 1 72 72 SER H H 72 8.800 8.800 8.388 0.412 25281 830 1 2 . 1 1 73 73 VAL N N 73 119.260 119.260 122.671 -3.411 25281 831 1 2 . 1 1 73 73 VAL CA C 73 60.730 60.730 59.738 0.992 25281 832 1 2 . 1 1 73 73 VAL CB C 73 33.870 33.870 35.321 -1.450 25281 833 1 2 . 1 1 73 73 VAL H H 73 8.170 8.170 8.111 0.059 25281 834 1 2 . 1 1 74 74 THR N N 74 115.360 115.360 122.854 -7.494 25281 835 1 2 . 1 1 74 74 THR CA C 74 59.040 59.040 60.834 -1.794 25281 836 1 2 . 1 1 74 74 THR CB C 74 73.250 73.250 70.957 2.293 25281 837 1 2 . 1 1 74 74 THR H H 74 9.200 9.200 8.016 1.184 25281 838 1 2 . 1 1 75 75 ALA N N 75 119.330 119.330 125.997 -6.667 25281 839 1 2 . 1 1 75 75 ALA CA C 75 51.390 51.390 50.483 0.907 25281 840 1 2 . 1 1 75 75 ALA CB C 75 22.380 22.380 22.654 -0.274 25281 841 1 2 . 1 1 75 75 ALA H H 75 9.130 9.130 8.305 0.825 25281 842 1 2 . 1 1 76 76 GLY N N 76 103.130 103.130 105.726 -2.596 25281 843 1 2 . 1 1 76 76 GLY CA C 76 45.900 45.900 44.911 0.989 25281 844 1 2 . 1 1 76 76 GLY H H 76 8.760 8.760 7.960 0.800 25281 845 1 2 . 1 1 77 77 PRO CA C 77 61.250 61.250 62.355 -1.105 25281 846 1 2 . 1 1 77 77 PRO CB C 77 32.590 32.590 33.257 -0.667 25281 847 1 2 . 1 1 78 78 VAL N N 78 115.250 115.250 119.452 -4.202 25281 848 1 2 . 1 1 78 78 VAL CA C 78 58.430 58.430 61.326 -2.896 25281 849 1 2 . 1 1 78 78 VAL CB C 78 32.700 32.700 35.451 -2.751 25281 850 1 2 . 1 1 78 78 VAL H H 78 8.240 8.240 7.958 0.282 25281 851 1 2 . 1 1 79 79 PHE N N 79 130.610 130.610 128.598 2.012 25281 852 1 2 . 1 1 79 79 PHE CA C 79 55.090 55.090 56.150 -1.060 25281 853 1 2 . 1 1 79 79 PHE CB C 79 41.590 41.590 43.020 -1.430 25281 854 1 2 . 1 1 79 79 PHE H H 79 9.540 9.540 8.425 1.115 25281 855 1 2 . 1 1 80 80 ARG N N 80 130.350 130.350 126.367 3.983 25281 856 1 2 . 1 1 80 80 ARG CA C 80 55.490 55.490 56.800 -1.310 25281 857 1 2 . 1 1 80 80 ARG CB C 80 29.520 29.520 30.291 -0.771 25281 858 1 2 . 1 1 80 80 ARG H H 80 8.810 8.810 8.097 0.713 25281 859 1 2 . 1 1 81 81 ILE N N 81 127.480 127.480 124.540 2.940 25281 860 1 2 . 1 1 81 81 ILE CA C 81 62.850 62.850 61.748 1.102 25281 861 1 2 . 1 1 81 81 ILE CB C 81 37.650 37.650 38.408 -0.758 25281 862 1 2 . 1 1 81 81 ILE H H 81 8.260 8.260 9.007 -0.747 25281 863 1 2 . 1 1 82 82 ASN N N 82 113.110 113.110 117.738 -4.628 25281 864 1 2 . 1 1 82 82 ASN CA C 82 55.630 55.630 51.907 3.723 25281 865 1 2 . 1 1 82 82 ASN CB C 82 43.210 43.210 39.370 3.840 25281 866 1 2 . 1 1 82 82 ASN H H 82 7.970 7.970 7.568 0.402 25281 867 1 2 . 1 1 85 85 VAL N N 85 118.090 118.090 123.668 -5.578 25281 868 1 2 . 1 1 85 85 VAL CA C 85 61.120 61.120 61.232 -0.112 25281 869 1 2 . 1 1 85 85 VAL CB C 85 34.910 34.910 35.131 -0.221 25281 870 1 2 . 1 1 85 85 VAL H H 85 7.840 7.840 7.193 0.647 25281 871 1 2 . 1 1 86 86 SER N N 86 119.050 119.050 120.794 -1.744 25281 872 1 2 . 1 1 86 86 SER CA C 86 57.100 57.100 56.217 0.883 25281 873 1 2 . 1 1 86 86 SER CB C 86 65.400 65.400 66.424 -1.024 25281 874 1 2 . 1 1 86 86 SER H H 86 8.240 8.240 8.188 0.052 25281 875 1 2 . 1 1 87 87 LEU N N 87 124.640 124.640 123.549 1.091 25281 876 1 2 . 1 1 87 87 LEU CA C 87 53.750 53.750 54.613 -0.863 25281 877 1 2 . 1 1 87 87 LEU CB C 87 46.320 46.320 46.043 0.277 25281 878 1 2 . 1 1 87 87 LEU H H 87 9.130 9.130 8.091 1.039 25281 879 1 2 . 1 1 88 88 TYR N N 88 118.740 118.740 122.737 -3.997 25281 880 1 2 . 1 1 88 88 TYR CA C 88 55.080 55.080 55.965 -0.885 25281 881 1 2 . 1 1 88 88 TYR CB C 88 42.630 42.630 41.011 1.619 25281 882 1 2 . 1 1 88 88 TYR H H 88 8.740 8.740 8.070 0.670 25281 883 1 2 . 1 1 89 89 GLY N N 89 103.920 103.920 106.966 -3.046 25281 884 1 2 . 1 1 89 89 GLY CA C 89 43.250 43.250 43.583 -0.333 25281 885 1 2 . 1 1 89 89 GLY H H 89 7.720 7.720 8.313 -0.593 25281 886 1 2 . 1 1 90 90 LEU N N 90 117.530 117.530 122.665 -5.135 25281 887 1 2 . 1 1 90 90 LEU CA C 90 53.200 53.200 53.901 -0.701 25281 888 1 2 . 1 1 90 90 LEU CB C 90 45.810 45.810 44.675 1.135 25281 889 1 2 . 1 1 90 90 LEU H H 90 8.520 8.520 7.973 0.547 25281 890 1 2 . 1 1 91 91 LEU N N 91 120.670 120.670 117.577 3.093 25281 891 1 2 . 1 1 91 91 LEU CA C 91 53.590 53.590 53.919 -0.329 25281 892 1 2 . 1 1 91 91 LEU CB C 91 46.330 46.330 45.542 0.788 25281 893 1 2 . 1 1 91 91 LEU H H 91 9.250 9.250 7.967 1.283 25281 894 1 2 . 1 1 92 92 GLY N N 92 108.770 108.770 108.802 -0.032 25281 895 1 2 . 1 1 92 92 GLY CA C 92 46.520 46.520 46.232 0.288 25281 896 1 2 . 1 1 92 92 GLY H H 92 8.480 8.480 8.738 -0.258 25281 897 1 2 . 1 1 93 93 ALA N N 93 126.760 126.760 121.089 5.671 25281 898 1 2 . 1 1 93 93 ALA CA C 93 49.890 49.890 51.226 -1.336 25281 899 1 2 . 1 1 93 93 ALA CB C 93 21.860 21.860 22.611 -0.751 25281 900 1 2 . 1 1 93 93 ALA H H 93 8.860 8.860 7.916 0.944 25281 901 1 2 . 1 1 94 94 GLY N N 94 107.510 107.510 106.807 0.703 25281 902 1 2 . 1 1 94 94 GLY CA C 94 42.760 42.760 44.163 -1.403 25281 903 1 2 . 1 1 94 94 GLY H H 94 8.880 8.880 8.552 0.328 25281 904 1 2 . 1 1 95 95 HIS N N 95 122.340 122.340 117.610 4.730 25281 905 1 2 . 1 1 95 95 HIS CA C 95 54.570 54.570 54.487 0.083 25281 906 1 2 . 1 1 95 95 HIS CB C 95 32.700 32.700 34.362 -1.662 25281 907 1 2 . 1 1 95 95 HIS H H 95 9.200 9.200 7.367 1.833 25281 908 1 2 . 1 1 96 96 GLY N N 96 112.170 112.170 107.787 4.383 25281 909 1 2 . 1 1 96 96 GLY CA C 96 43.150 43.150 44.067 -0.917 25281 910 1 2 . 1 1 96 96 GLY H H 96 8.620 8.620 8.137 0.483 25281 911 1 2 . 1 1 97 97 LYS N N 97 120.580 120.580 119.168 1.412 25281 912 1 2 . 1 1 97 97 LYS CA C 97 54.890 54.890 54.848 0.042 25281 913 1 2 . 1 1 97 97 LYS CB C 97 35.560 35.560 36.828 -1.268 25281 914 1 2 . 1 1 97 97 LYS H H 97 9.010 9.010 8.430 0.580 25281 915 1 2 . 1 1 98 98 ALA N N 98 126.740 126.740 123.968 2.772 25281 916 1 2 . 1 1 98 98 ALA CA C 98 50.020 50.020 50.909 -0.889 25281 917 1 2 . 1 1 98 98 ALA CB C 98 22.380 22.380 21.752 0.628 25281 918 1 2 . 1 1 98 98 ALA H H 98 9.120 9.120 8.131 0.989 25281 919 1 2 . 1 1 99 99 LYS N N 99 122.360 122.360 121.495 0.865 25281 920 1 2 . 1 1 99 99 LYS CA C 99 55.090 55.090 55.374 -0.284 25281 921 1 2 . 1 1 99 99 LYS CB C 99 34.970 34.970 35.142 -0.172 25281 922 1 2 . 1 1 99 99 LYS H H 99 8.580 8.580 8.696 -0.116 25281 923 1 2 . 1 1 100 100 PHE N N 100 121.170 121.170 122.644 -1.474 25281 924 1 2 . 1 1 100 100 PHE CA C 100 56.390 56.390 56.683 -0.293 25281 925 1 2 . 1 1 100 100 PHE CB C 100 42.110 42.110 39.402 2.708 25281 926 1 2 . 1 1 100 100 PHE H H 100 8.750 8.750 8.591 0.159 25281 927 1 2 . 1 1 101 101 SER N N 101 117.280 117.280 114.867 2.413 25281 928 1 2 . 1 1 101 101 SER CA C 101 57.070 57.070 56.587 0.483 25281 929 1 2 . 1 1 101 101 SER CB C 101 65.830 65.830 65.337 0.493 25281 930 1 2 . 1 1 101 101 SER H H 101 8.990 8.990 8.276 0.714 25281 931 1 2 . 1 1 102 102 SER N N 102 117.600 117.600 115.971 1.629 25281 932 1 2 . 1 1 102 102 SER CA C 102 56.500 56.500 58.041 -1.540 25281 933 1 2 . 1 1 102 102 SER CB C 102 67.540 67.540 63.422 4.118 25281 934 1 2 . 1 1 102 102 SER H H 102 8.680 8.680 8.234 0.446 25281 935 1 2 . 1 1 103 103 ILE N N 103 114.980 114.980 122.882 -7.902 25281 936 1 2 . 1 1 103 103 ILE CA C 103 59.180 59.180 60.130 -0.950 25281 937 1 2 . 1 1 103 103 ILE CB C 103 40.550 40.550 40.701 -0.151 25281 938 1 2 . 1 1 103 103 ILE H H 103 7.700 7.700 8.247 -0.547 25281 939 1 2 . 1 1 104 104 PHE N N 104 123.710 123.710 122.621 1.089 25281 940 1 2 . 1 1 104 104 PHE CA C 104 53.190 53.190 57.948 -4.758 25281 941 1 2 . 1 1 104 104 PHE CB C 104 43.900 43.900 39.435 4.465 25281 942 1 2 . 1 1 104 104 PHE H H 104 8.590 8.590 8.652 -0.062 25281 943 1 2 . 1 1 105 105 GLY N N 105 109.080 109.080 111.302 -2.222 25281 944 1 2 . 1 1 105 105 GLY CA C 105 45.420 45.420 44.428 0.992 25281 945 1 2 . 1 1 105 105 GLY H H 105 8.400 8.400 8.431 -0.031 25281 946 1 2 . 1 1 106 106 GLN N N 106 119.680 119.680 120.238 -0.558 25281 947 1 2 . 1 1 106 106 GLN CA C 106 53.720 53.720 55.304 -1.584 25281 948 1 2 . 1 1 106 106 GLN CB C 106 30.100 30.100 29.950 0.150 25281 949 1 2 . 1 1 106 106 GLN H H 106 8.530 8.530 8.320 0.210 25281 950 1 2 . 1 1 107 107 SER N N 107 119.160 119.160 117.457 1.703 25281 951 1 2 . 1 1 107 107 SER CA C 107 57.360 57.360 57.753 -0.393 25281 952 1 2 . 1 1 107 107 SER CB C 107 66.050 66.050 63.429 2.621 25281 953 1 2 . 1 1 107 107 SER H H 107 8.800 8.800 8.249 0.551 25281 954 1 2 . 1 1 108 108 GLU N N 108 125.360 125.360 120.590 4.770 25281 955 1 2 . 1 1 108 108 GLU CA C 108 58.910 58.910 55.235 3.675 25281 956 1 2 . 1 1 108 108 GLU CB C 108 40.880 40.880 33.330 7.550 25281 957 1 2 . 1 1 108 108 GLU H H 108 8.960 8.960 7.762 1.198 25281 958 1 2 . 1 1 109 109 SER N N 109 118.890 118.890 115.097 3.793 25281 959 1 2 . 1 1 109 109 SER CA C 109 56.710 56.710 57.382 -0.672 25281 960 1 2 . 1 1 109 109 SER CB C 109 66.180 66.180 66.087 0.093 25281 961 1 2 . 1 1 109 109 SER H H 109 9.080 9.080 8.399 0.681 25281 962 1 2 . 1 1 110 110 ARG N N 110 119.830 119.830 120.187 -0.357 25281 963 1 2 . 1 1 110 110 ARG CA C 110 58.390 58.390 55.254 3.136 25281 964 1 2 . 1 1 110 110 ARG CB C 110 40.940 40.940 34.698 6.242 25281 965 1 2 . 1 1 110 110 ARG H H 110 8.850 8.850 8.381 0.469 25281 966 1 2 . 1 1 111 111 SER N N 111 114.870 114.870 115.539 -0.669 25281 967 1 2 . 1 1 111 111 SER CA C 111 57.290 57.290 57.132 0.158 25281 968 1 2 . 1 1 111 111 SER CB C 111 66.110 66.110 66.612 -0.502 25281 969 1 2 . 1 1 111 111 SER H H 111 8.740 8.740 8.499 0.241 25281 970 1 2 . 1 1 112 112 LYS N N 112 120.870 120.870 120.753 0.117 25281 971 1 2 . 1 1 112 112 LYS CA C 112 55.150 55.150 56.135 -0.985 25281 972 1 2 . 1 1 112 112 LYS CB C 112 36.330 36.330 36.206 0.124 25281 973 1 2 . 1 1 112 112 LYS H H 112 8.520 8.520 8.610 -0.090 25281 974 1 2 . 1 1 113 113 THR N N 113 121.390 121.390 116.774 4.616 25281 975 1 2 . 1 1 113 113 THR CA C 113 61.250 61.250 61.187 0.063 25281 976 1 2 . 1 1 113 113 THR CB C 113 70.010 70.010 70.747 -0.737 25281 977 1 2 . 1 1 113 113 THR H H 113 8.440 8.440 8.375 0.065 25281 978 1 2 . 1 1 114 114 SER N N 114 120.730 120.730 121.161 -0.431 25281 979 1 2 . 1 1 114 114 SER CA C 114 56.190 56.190 57.403 -1.213 25281 980 1 2 . 1 1 114 114 SER CB C 114 66.380 66.380 65.407 0.973 25281 981 1 2 . 1 1 114 114 SER H H 114 9.350 9.350 8.290 1.060 25281 982 1 2 . 1 1 115 115 LEU N N 115 121.540 121.540 125.202 -3.662 25281 983 1 2 . 1 1 115 115 LEU CA C 115 55.480 55.480 54.766 0.714 25281 984 1 2 . 1 1 115 115 LEU CB C 115 42.890 42.890 43.108 -0.218 25281 985 1 2 . 1 1 115 115 LEU H H 115 8.200 8.200 9.002 -0.802 25281 986 1 2 . 1 1 116 116 ALA N N 116 129.060 129.060 122.961 6.099 25281 987 1 2 . 1 1 116 116 ALA CA C 116 49.960 49.960 50.602 -0.642 25281 988 1 2 . 1 1 116 116 ALA CB C 116 20.310 20.310 22.367 -2.057 25281 989 1 2 . 1 1 116 116 ALA H H 116 8.600 8.600 8.523 0.077 25281 990 1 2 . 1 1 117 117 TYR N N 117 115.890 115.890 119.325 -3.435 25281 991 1 2 . 1 1 117 117 TYR CA C 117 55.150 55.150 56.105 -0.954 25281 992 1 2 . 1 1 117 117 TYR CB C 117 41.200 41.200 41.287 -0.087 25281 993 1 2 . 1 1 117 117 TYR H H 117 8.450 8.450 7.954 0.496 25281 994 1 2 . 1 1 118 118 GLY N N 118 107.330 107.330 106.390 0.940 25281 995 1 2 . 1 1 118 118 GLY CA C 118 45.940 45.940 45.858 0.082 25281 996 1 2 . 1 1 118 118 GLY H H 118 9.340 9.340 8.165 1.175 25281 997 1 2 . 1 1 119 119 ALA N N 119 118.880 118.880 119.742 -0.862 25281 998 1 2 . 1 1 119 119 ALA CA C 119 51.320 51.320 50.882 0.438 25281 999 1 2 . 1 1 119 119 ALA CB C 119 22.120 22.120 22.296 -0.176 25281 1000 1 2 . 1 1 119 119 ALA H H 119 8.770 8.770 7.002 1.768 25281 1001 1 2 . 1 1 120 120 GLY N N 120 105.730 105.730 105.694 0.036 25281 1002 1 2 . 1 1 120 120 GLY CA C 120 45.650 45.650 45.166 0.484 25281 1003 1 2 . 1 1 120 120 GLY H H 120 7.940 7.940 7.455 0.485 25281 1004 1 2 . 1 1 121 121 LEU N N 121 115.480 115.480 113.432 2.048 25281 1005 1 2 . 1 1 121 121 LEU CA C 121 52.980 52.980 53.713 -0.733 25281 1006 1 2 . 1 1 121 121 LEU CB C 121 46.460 46.460 45.714 0.746 25281 1007 1 2 . 1 1 121 121 LEU H H 121 9.010 9.010 8.054 0.956 25281 1008 1 2 . 1 1 122 122 GLN N N 122 112.530 112.530 118.569 -6.039 25281 1009 1 2 . 1 1 122 122 GLN CA C 122 54.780 54.780 54.521 0.259 25281 1010 1 2 . 1 1 122 122 GLN CB C 122 31.400 31.400 33.248 -1.848 25281 1011 1 2 . 1 1 122 122 GLN H H 122 8.090 8.090 7.858 0.232 25281 1012 1 2 . 1 1 123 123 PHE N N 123 126.050 126.050 123.826 2.224 25281 1013 1 2 . 1 1 123 123 PHE CA C 123 54.180 54.180 56.211 -2.031 25281 1014 1 2 . 1 1 123 123 PHE CB C 123 42.560 42.560 41.302 1.258 25281 1015 1 2 . 1 1 123 123 PHE H H 123 10.020 10.020 8.811 1.209 25281 1016 1 2 . 1 1 124 124 ASN N N 124 121.910 121.910 121.407 0.503 25281 1017 1 2 . 1 1 124 124 ASN CA C 124 50.940 50.940 49.575 1.365 25281 1018 1 2 . 1 1 124 124 ASN CB C 124 40.360 40.360 39.557 0.803 25281 1019 1 2 . 1 1 124 124 ASN H H 124 9.520 9.520 8.349 1.171 25281 1020 1 2 . 1 1 125 125 PRO CA C 125 63.390 63.390 62.147 1.243 25281 1021 1 2 . 1 1 125 125 PRO CB C 125 31.210 31.210 32.617 -1.407 25281 1022 1 2 . 1 1 126 126 HIS N N 126 116.830 116.830 116.881 -0.051 25281 1023 1 2 . 1 1 126 126 HIS CA C 126 54.110 54.110 57.173 -3.063 25281 1024 1 2 . 1 1 126 126 HIS CB C 126 34.910 34.910 29.249 5.661 25281 1025 1 2 . 1 1 126 126 HIS H H 126 7.630 7.630 8.331 -0.701 25281 1026 1 2 . 1 1 127 127 PRO CA C 127 65.370 65.370 63.997 1.373 25281 1027 1 2 . 1 1 127 127 PRO CB C 127 31.030 31.030 30.125 0.905 25281 1028 1 2 . 1 1 128 128 ASN N N 128 114.680 114.680 117.572 -2.892 25281 1029 1 2 . 1 1 128 128 ASN CA C 128 53.990 53.990 53.978 0.012 25281 1030 1 2 . 1 1 128 128 ASN CB C 128 40.550 40.550 41.018 -0.468 25281 1031 1 2 . 1 1 128 128 ASN H H 128 10.460 10.460 9.009 1.451 25281 1032 1 2 . 1 1 129 129 PHE N N 129 119.630 119.630 117.958 1.672 25281 1033 1 2 . 1 1 129 129 PHE CA C 129 56.530 56.530 57.719 -1.189 25281 1034 1 2 . 1 1 129 129 PHE CB C 129 44.310 44.310 42.960 1.350 25281 1035 1 2 . 1 1 129 129 PHE H H 129 8.340 8.340 7.579 0.761 25281 1036 1 2 . 1 1 130 130 VAL N N 130 123.000 123.000 120.338 2.662 25281 1037 1 2 . 1 1 130 130 VAL CA C 130 60.340 60.340 61.128 -0.788 25281 1038 1 2 . 1 1 130 130 VAL CB C 130 34.970 34.970 35.033 -0.063 25281 1039 1 2 . 1 1 130 130 VAL H H 130 7.820 7.820 8.931 -1.111 25281 1040 1 2 . 1 1 131 131 ILE N N 131 124.470 124.470 128.016 -3.546 25281 1041 1 2 . 1 1 131 131 ILE CA C 131 60.210 60.210 60.672 -0.463 25281 1042 1 2 . 1 1 131 131 ILE CB C 131 39.510 39.510 40.159 -0.649 25281 1043 1 2 . 1 1 131 131 ILE H H 131 8.830 8.830 8.313 0.517 25281 1044 1 2 . 1 1 132 132 ASP N N 132 130.700 130.700 128.510 2.190 25281 1045 1 2 . 1 1 132 132 ASP CA C 132 53.530 53.530 52.761 0.769 25281 1046 1 2 . 1 1 132 132 ASP CB C 132 47.620 47.620 44.231 3.389 25281 1047 1 2 . 1 1 132 132 ASP H H 132 9.040 9.040 8.242 0.798 25281 1048 1 2 . 1 1 133 133 ALA N N 133 126.900 126.900 128.634 -1.734 25281 1049 1 2 . 1 1 133 133 ALA CA C 133 51.390 51.390 50.503 0.887 25281 1050 1 2 . 1 1 133 133 ALA CB C 133 21.730 21.730 21.900 -0.170 25281 1051 1 2 . 1 1 133 133 ALA H H 133 8.800 8.800 8.021 0.779 25281 1052 1 2 . 1 1 134 134 SER N N 134 113.760 113.760 117.465 -3.705 25281 1053 1 2 . 1 1 134 134 SER CA C 134 58.140 58.140 57.288 0.852 25281 1054 1 2 . 1 1 134 134 SER CB C 134 67.020 67.020 66.131 0.889 25281 1055 1 2 . 1 1 134 134 SER H H 134 9.160 9.160 8.058 1.102 25281 1056 1 2 . 1 1 135 135 TYR N N 135 118.500 118.500 115.219 3.281 25281 1057 1 2 . 1 1 135 135 TYR CA C 135 55.690 55.690 56.237 -0.547 25281 1058 1 2 . 1 1 135 135 TYR CB C 135 43.150 43.150 41.293 1.857 25281 1059 1 2 . 1 1 135 135 TYR H H 135 8.820 8.820 7.530 1.290 25281 1060 1 2 . 1 1 136 136 GLU N N 136 126.290 126.290 119.026 7.264 25281 1061 1 2 . 1 1 136 136 GLU CA C 136 53.530 53.530 54.968 -1.438 25281 1062 1 2 . 1 1 136 136 GLU CB C 136 34.450 34.450 34.525 -0.075 25281 1063 1 2 . 1 1 136 136 GLU H H 136 8.380 8.380 8.168 0.212 25281 1064 1 2 . 1 1 137 137 TYR N N 137 123.630 123.630 120.500 3.130 25281 1065 1 2 . 1 1 137 137 TYR CA C 137 55.670 55.670 56.648 -0.978 25281 1066 1 2 . 1 1 137 137 TYR CB C 137 43.150 43.150 42.658 0.492 25281 1067 1 2 . 1 1 137 137 TYR H H 137 9.300 9.300 8.752 0.548 25281 1068 1 2 . 1 1 138 138 SER N N 138 118.300 118.300 115.947 2.353 25281 1069 1 2 . 1 1 138 138 SER CA C 138 58.270 58.270 57.305 0.965 25281 1070 1 2 . 1 1 138 138 SER CB C 138 67.090 67.090 66.474 0.616 25281 1071 1 2 . 1 1 138 138 SER H H 138 7.980 7.980 8.827 -0.847 25281 1072 1 2 . 1 1 139 139 LYS N N 139 127.450 127.450 125.313 2.137 25281 1073 1 2 . 1 1 139 139 LYS CA C 139 55.160 55.160 55.696 -0.536 25281 1074 1 2 . 1 1 139 139 LYS CB C 139 32.640 32.640 34.329 -1.689 25281 1075 1 2 . 1 1 139 139 LYS H H 139 8.630 8.630 8.662 -0.032 25281 1076 1 2 . 1 1 140 140 LEU N N 140 129.650 129.650 128.068 1.582 25281 1077 1 2 . 1 1 140 140 LEU CA C 140 52.500 52.500 53.732 -1.232 25281 1078 1 2 . 1 1 140 140 LEU CB C 140 40.000 40.000 45.179 -5.179 25281 1079 1 2 . 1 1 140 140 LEU H H 140 9.060 9.060 8.014 1.046 25281 1080 1 2 . 1 1 141 141 ASP N N 141 121.470 121.470 120.385 1.085 25281 1081 1 2 . 1 1 141 141 ASP CA C 141 57.190 57.190 55.746 1.444 25281 1082 1 2 . 1 1 141 141 ASP CB C 141 39.730 39.730 41.073 -1.343 25281 1083 1 2 . 1 1 141 141 ASP H H 141 8.590 8.590 8.446 0.144 25281 1084 1 2 . 1 1 142 142 ASP N N 142 121.510 121.510 118.567 2.943 25281 1085 1 2 . 1 1 142 142 ASP CA C 142 55.180 55.180 54.367 0.813 25281 1086 1 2 . 1 1 142 142 ASP CB C 142 41.090 41.090 42.143 -1.053 25281 1087 1 2 . 1 1 142 142 ASP H H 142 8.430 8.430 8.250 0.180 25281 1088 1 2 . 1 1 143 143 VAL N N 143 121.420 121.420 114.118 7.302 25281 1089 1 2 . 1 1 143 143 VAL CA C 143 62.240 62.240 59.914 2.326 25281 1090 1 2 . 1 1 143 143 VAL CB C 143 31.280 31.280 34.877 -3.597 25281 1091 1 2 . 1 1 143 143 VAL H H 143 8.020 8.020 7.477 0.543 25281 1092 1 2 . 1 1 144 144 LYS N N 144 127.950 127.950 123.373 4.577 25281 1093 1 2 . 1 1 144 144 LYS CA C 144 55.440 55.440 55.899 -0.459 25281 1094 1 2 . 1 1 144 144 LYS CB C 144 32.640 32.640 33.796 -1.156 25281 1095 1 2 . 1 1 144 144 LYS H H 144 8.660 8.660 8.416 0.244 25281 1096 1 2 . 1 1 145 145 VAL N N 145 124.120 124.120 125.649 -1.529 25281 1097 1 2 . 1 1 145 145 VAL CA C 145 55.910 55.910 59.787 -3.877 25281 1098 1 2 . 1 1 145 145 VAL CB C 145 32.570 32.570 33.907 -1.337 25281 1099 1 2 . 1 1 145 145 VAL H H 145 8.720 8.720 7.888 0.832 25281 1100 1 2 . 1 1 146 146 GLY N N 146 116.240 116.240 114.403 1.837 25281 1101 1 2 . 1 1 146 146 GLY CA C 146 44.080 44.080 43.778 0.302 25281 1102 1 2 . 1 1 146 146 GLY H H 146 8.400 8.400 8.556 -0.156 25281 1103 1 2 . 1 1 147 147 THR N N 147 124.620 124.620 115.473 9.147 25281 1104 1 2 . 1 1 147 147 THR CA C 147 61.450 61.450 59.497 1.953 25281 1105 1 2 . 1 1 147 147 THR CB C 147 70.260 70.260 71.597 -1.337 25281 1106 1 2 . 1 1 147 147 THR H H 147 9.080 9.080 8.584 0.496 25281 1107 1 2 . 1 1 148 148 TRP N N 148 124.790 124.790 127.640 -2.850 25281 1108 1 2 . 1 1 148 148 TRP CA C 148 54.770 54.770 55.932 -1.162 25281 1109 1 2 . 1 1 148 148 TRP CB C 148 33.090 33.090 33.645 -0.555 25281 1110 1 2 . 1 1 148 148 TRP H H 148 8.510 8.510 8.629 -0.119 25281 1111 1 2 . 1 1 149 149 MET N N 149 118.880 118.880 126.632 -7.752 25281 1112 1 2 . 1 1 149 149 MET CA C 149 54.540 54.540 53.238 1.302 25281 1113 1 2 . 1 1 149 149 MET CB C 149 34.640 34.640 35.640 -1.000 25281 1114 1 2 . 1 1 149 149 MET H H 149 9.150 9.150 7.908 1.242 25281 1115 1 2 . 1 1 150 150 LEU N N 150 122.830 122.830 122.201 0.629 25281 1116 1 2 . 1 1 150 150 LEU CA C 150 54.100 54.100 54.243 -0.144 25281 1117 1 2 . 1 1 150 150 LEU CB C 150 45.800 45.800 45.213 0.587 25281 1118 1 2 . 1 1 150 150 LEU H H 150 8.480 8.480 8.139 0.341 25281 1119 1 2 . 1 1 151 151 GLY N N 151 112.730 112.730 108.279 4.451 25281 1120 1 2 . 1 1 151 151 GLY CA C 151 45.940 45.940 45.954 -0.014 25281 1121 1 2 . 1 1 151 151 GLY H H 151 9.820 9.820 8.045 1.775 25281 1122 1 2 . 1 1 152 152 ALA N N 152 119.460 119.460 120.437 -0.977 25281 1123 1 2 . 1 1 152 152 ALA CA C 152 49.760 49.760 50.185 -0.425 25281 1124 1 2 . 1 1 152 152 ALA CB C 152 22.700 22.700 22.944 -0.244 25281 1125 1 2 . 1 1 152 152 ALA H H 152 8.840 8.840 7.937 0.903 25281 1126 1 2 . 1 1 153 153 GLY N N 153 104.360 104.360 107.232 -2.872 25281 1127 1 2 . 1 1 153 153 GLY CA C 153 46.440 46.440 44.674 1.766 25281 1128 1 2 . 1 1 153 153 GLY H H 153 8.540 8.540 8.508 0.032 25281 1129 1 2 . 1 1 154 154 TYR N N 154 120.680 120.680 114.725 5.955 25281 1130 1 2 . 1 1 154 154 TYR CA C 154 55.370 55.370 55.943 -0.573 25281 1131 1 2 . 1 1 154 154 TYR CB C 154 44.250 44.250 41.179 3.071 25281 1132 1 2 . 1 1 154 154 TYR H H 154 8.310 8.310 7.713 0.597 25281 1133 1 2 . 1 1 155 155 ARG N N 155 127.050 127.050 124.002 3.048 25281 1134 1 2 . 1 1 155 155 ARG CA C 155 53.480 53.480 55.836 -2.356 25281 1135 1 2 . 1 1 155 155 ARG CB C 155 32.160 32.160 31.240 0.920 25281 1136 1 2 . 1 1 155 155 ARG H H 155 7.640 7.640 8.642 -1.002 25281 1137 1 3 . 1 1 2 2 GLY N N 2 112.280 112.280 109.299 2.981 25281 1138 1 3 . 1 1 2 2 GLY CA C 2 44.830 44.830 44.822 0.008 25281 1139 1 3 . 1 1 2 2 GLY H H 2 8.460 8.460 8.052 0.408 25281 1140 1 3 . 1 1 3 3 GLU N N 3 118.460 118.460 122.304 -3.844 25281 1141 1 3 . 1 1 3 3 GLU CA C 3 56.840 56.840 55.960 0.880 25281 1142 1 3 . 1 1 3 3 GLU CB C 3 29.980 29.980 31.717 -1.737 25281 1143 1 3 . 1 1 3 3 GLU H H 3 7.630 7.630 8.386 -0.756 25281 1144 1 3 . 1 1 4 4 SER N N 4 119.000 119.000 116.921 2.079 25281 1145 1 3 . 1 1 4 4 SER CA C 4 57.280 57.280 57.689 -0.409 25281 1146 1 3 . 1 1 4 4 SER CB C 4 65.860 65.860 65.090 0.770 25281 1147 1 3 . 1 1 4 4 SER H H 4 8.820 8.820 8.567 0.253 25281 1148 1 3 . 1 1 5 5 SER N N 5 118.300 118.300 120.912 -2.612 25281 1149 1 3 . 1 1 5 5 SER CA C 5 57.560 57.560 57.990 -0.430 25281 1150 1 3 . 1 1 5 5 SER CB C 5 65.480 65.480 66.283 -0.803 25281 1151 1 3 . 1 1 5 5 SER H H 5 8.700 8.700 8.154 0.546 25281 1152 1 3 . 1 1 6 6 ILE N N 6 123.240 123.240 117.801 5.439 25281 1153 1 3 . 1 1 6 6 ILE CA C 6 54.110 54.110 59.350 -5.240 25281 1154 1 3 . 1 1 6 6 ILE CB C 6 33.870 33.870 41.962 -8.092 25281 1155 1 3 . 1 1 6 6 ILE H H 6 9.080 9.080 7.979 1.101 25281 1156 1 3 . 1 1 7 7 SER N N 7 116.100 116.100 115.074 1.026 25281 1157 1 3 . 1 1 7 7 SER CA C 7 57.130 57.130 57.409 -0.279 25281 1158 1 3 . 1 1 7 7 SER CB C 7 65.710 65.710 65.606 0.103 25281 1159 1 3 . 1 1 7 7 SER H H 7 8.570 8.570 7.974 0.596 25281 1160 1 3 . 1 1 8 8 ILE N N 8 114.140 114.140 124.007 -9.867 25281 1161 1 3 . 1 1 8 8 ILE CA C 8 58.460 58.460 59.737 -1.277 25281 1162 1 3 . 1 1 8 8 ILE CB C 8 40.880 40.880 41.918 -1.038 25281 1163 1 3 . 1 1 8 8 ILE H H 8 8.300 8.300 8.300 -0.000 25281 1164 1 3 . 1 1 9 9 GLY N N 9 109.200 109.200 110.104 -0.904 25281 1165 1 3 . 1 1 9 9 GLY CA C 9 45.550 45.550 45.479 0.071 25281 1166 1 3 . 1 1 9 9 GLY H H 9 9.060 9.060 7.883 1.177 25281 1167 1 3 . 1 1 10 10 TYR N N 10 121.410 121.410 119.050 2.360 25281 1168 1 3 . 1 1 10 10 TYR CA C 10 56.970 56.970 56.923 0.047 25281 1169 1 3 . 1 1 10 10 TYR CB C 10 41.520 41.520 41.888 -0.368 25281 1170 1 3 . 1 1 10 10 TYR H H 10 8.870 8.870 8.125 0.745 25281 1171 1 3 . 1 1 11 11 ALA N N 11 125.250 125.250 124.591 0.659 25281 1172 1 3 . 1 1 11 11 ALA CA C 11 48.740 48.740 50.317 -1.577 25281 1173 1 3 . 1 1 11 11 ALA CB C 11 21.610 21.610 21.492 0.118 25281 1174 1 3 . 1 1 11 11 ALA H H 11 7.210 7.210 8.261 -1.051 25281 1175 1 3 . 1 1 12 12 GLN N N 12 119.180 119.180 122.787 -3.607 25281 1176 1 3 . 1 1 12 12 GLN CA C 12 54.690 54.690 54.627 0.063 25281 1177 1 3 . 1 1 12 12 GLN CB C 12 32.000 32.000 33.779 -1.779 25281 1178 1 3 . 1 1 12 12 GLN H H 12 8.330 8.330 8.144 0.186 25281 1179 1 3 . 1 1 13 13 SER N N 13 122.790 122.790 116.510 6.280 25281 1180 1 3 . 1 1 13 13 SER CA C 13 57.780 57.780 57.249 0.531 25281 1181 1 3 . 1 1 13 13 SER CB C 13 64.540 64.540 65.863 -1.323 25281 1182 1 3 . 1 1 13 13 SER H H 13 8.610 8.610 8.637 -0.027 25281 1183 1 3 . 1 1 14 14 ARG N N 14 121.140 121.140 122.939 -1.799 25281 1184 1 3 . 1 1 14 14 ARG CA C 14 54.960 54.960 55.787 -0.827 25281 1185 1 3 . 1 1 14 14 ARG CB C 14 32.370 32.370 32.163 0.207 25281 1186 1 3 . 1 1 14 14 ARG H H 14 8.520 8.520 8.246 0.274 25281 1187 1 3 . 1 1 15 15 VAL N N 15 115.890 115.890 120.702 -4.812 25281 1188 1 3 . 1 1 15 15 VAL CA C 15 60.970 60.970 60.012 0.958 25281 1189 1 3 . 1 1 15 15 VAL CB C 15 34.320 34.320 36.161 -1.841 25281 1190 1 3 . 1 1 15 15 VAL H H 15 8.440 8.440 7.924 0.516 25281 1191 1 3 . 1 1 16 16 LYS N N 16 126.010 126.010 126.744 -0.734 25281 1192 1 3 . 1 1 16 16 LYS CA C 16 55.120 55.120 55.811 -0.691 25281 1193 1 3 . 1 1 16 16 LYS CB C 16 34.350 34.350 32.192 2.158 25281 1194 1 3 . 1 1 16 16 LYS H H 16 8.850 8.850 8.582 0.268 25281 1195 1 3 . 1 1 17 17 GLU N N 17 119.140 119.140 123.459 -4.319 25281 1196 1 3 . 1 1 17 17 GLU CA C 17 54.460 54.460 55.286 -0.826 25281 1197 1 3 . 1 1 17 17 GLU CB C 17 33.430 33.430 31.272 2.158 25281 1198 1 3 . 1 1 17 17 GLU H H 17 8.030 8.030 8.385 -0.355 25281 1199 1 3 . 1 1 18 18 ASP N N 18 120.280 120.280 120.301 -0.021 25281 1200 1 3 . 1 1 18 18 ASP CA C 18 56.500 56.500 54.446 2.054 25281 1201 1 3 . 1 1 18 18 ASP CB C 18 33.780 33.780 41.236 -7.456 25281 1202 1 3 . 1 1 18 18 ASP H H 18 8.120 8.120 8.312 -0.192 25281 1203 1 3 . 1 1 19 19 GLY N N 19 118.750 118.750 111.397 7.353 25281 1204 1 3 . 1 1 19 19 GLY CA C 19 44.130 44.130 44.625 -0.495 25281 1205 1 3 . 1 1 19 19 GLY H H 19 8.430 8.430 8.328 0.102 25281 1206 1 3 . 1 1 20 20 TYR N N 20 117.080 117.080 125.083 -8.003 25281 1207 1 3 . 1 1 20 20 TYR CA C 20 60.940 60.940 57.142 3.798 25281 1208 1 3 . 1 1 20 20 TYR CB C 20 42.010 42.010 38.141 3.869 25281 1209 1 3 . 1 1 20 20 TYR H H 20 8.610 8.610 8.666 -0.056 25281 1210 1 3 . 1 1 21 21 LYS N N 21 127.240 127.240 123.389 3.851 25281 1211 1 3 . 1 1 21 21 LYS CA C 21 56.760 56.760 57.398 -0.638 25281 1212 1 3 . 1 1 21 21 LYS CB C 21 29.100 29.100 32.603 -3.503 25281 1213 1 3 . 1 1 21 21 LYS H H 21 7.970 7.970 8.635 -0.665 25281 1214 1 3 . 1 1 22 22 LEU N N 22 122.270 122.270 121.744 0.526 25281 1215 1 3 . 1 1 22 22 LEU CA C 22 59.170 59.170 57.321 1.849 25281 1216 1 3 . 1 1 22 22 LEU CB C 22 40.030 40.030 42.143 -2.113 25281 1217 1 3 . 1 1 22 22 LEU H H 22 8.370 8.370 7.854 0.516 25281 1218 1 3 . 1 1 23 23 ASP N N 23 114.790 114.790 114.776 0.014 25281 1219 1 3 . 1 1 23 23 ASP CA C 23 51.840 51.840 53.607 -1.767 25281 1220 1 3 . 1 1 23 23 ASP CB C 23 37.730 37.730 41.250 -3.520 25281 1221 1 3 . 1 1 23 23 ASP H H 23 8.210 8.210 8.186 0.024 25281 1222 1 3 . 1 1 24 24 LYS N N 24 115.470 115.470 114.593 0.877 25281 1223 1 3 . 1 1 24 24 LYS CA C 24 58.860 58.860 57.693 1.167 25281 1224 1 3 . 1 1 24 24 LYS CB C 24 28.330 28.330 30.133 -1.803 25281 1225 1 3 . 1 1 24 24 LYS H H 24 9.230 9.230 8.053 1.177 25281 1226 1 3 . 1 1 25 25 ASN N N 25 121.610 121.610 118.674 2.936 25281 1227 1 3 . 1 1 25 25 ASN CA C 25 54.430 54.430 50.499 3.931 25281 1228 1 3 . 1 1 25 25 ASN CB C 25 42.500 42.500 38.902 3.598 25281 1229 1 3 . 1 1 25 25 ASN H H 25 8.150 8.150 7.901 0.249 25281 1230 1 3 . 1 1 26 26 PRO CA C 26 63.340 63.340 62.673 0.667 25281 1231 1 3 . 1 1 26 26 PRO CB C 26 30.940 30.940 34.057 -3.117 25281 1232 1 3 . 1 1 27 27 ARG N N 27 120.730 120.730 117.957 2.773 25281 1233 1 3 . 1 1 27 27 ARG CA C 27 54.340 54.340 55.327 -0.987 25281 1234 1 3 . 1 1 27 27 ARG CB C 27 33.500 33.500 33.245 0.255 25281 1235 1 3 . 1 1 27 27 ARG H H 27 8.290 8.290 8.386 -0.096 25281 1236 1 3 . 1 1 28 28 GLY N N 28 112.000 112.000 109.761 2.239 25281 1237 1 3 . 1 1 28 28 GLY CA C 28 46.940 46.940 44.778 2.162 25281 1238 1 3 . 1 1 28 28 GLY H H 28 8.810 8.810 7.790 1.020 25281 1239 1 3 . 1 1 29 29 PHE N N 29 121.230 121.230 117.276 3.954 25281 1240 1 3 . 1 1 29 29 PHE CA C 29 55.230 55.230 57.038 -1.808 25281 1241 1 3 . 1 1 29 29 PHE CB C 29 43.700 43.700 42.933 0.767 25281 1242 1 3 . 1 1 29 29 PHE H H 29 8.470 8.470 8.037 0.433 25281 1243 1 3 . 1 1 30 30 ASN N N 30 117.250 117.250 120.748 -3.498 25281 1244 1 3 . 1 1 30 30 ASN CA C 30 50.220 50.220 52.230 -2.010 25281 1245 1 3 . 1 1 30 30 ASN CB C 30 45.810 45.810 40.501 5.309 25281 1246 1 3 . 1 1 30 30 ASN H H 30 8.630 8.630 8.563 0.067 25281 1247 1 3 . 1 1 31 31 LEU N N 31 128.180 128.180 126.511 1.669 25281 1248 1 3 . 1 1 31 31 LEU CA C 31 53.930 53.930 53.910 0.020 25281 1249 1 3 . 1 1 31 31 LEU CB C 31 45.810 45.810 44.129 1.681 25281 1250 1 3 . 1 1 31 31 LEU H H 31 9.080 9.080 9.073 0.007 25281 1251 1 3 . 1 1 32 32 LYS N N 32 119.980 119.980 120.782 -0.802 25281 1252 1 3 . 1 1 32 32 LYS CA C 32 55.730 55.730 54.814 0.916 25281 1253 1 3 . 1 1 32 32 LYS CB C 32 36.070 36.070 36.811 -0.741 25281 1254 1 3 . 1 1 32 32 LYS H H 32 8.780 8.780 7.930 0.850 25281 1255 1 3 . 1 1 33 33 TYR N N 33 121.500 121.500 120.022 1.478 25281 1256 1 3 . 1 1 33 33 TYR CA C 33 55.830 55.830 57.132 -1.302 25281 1257 1 3 . 1 1 33 33 TYR CB C 33 42.110 42.110 42.249 -0.139 25281 1258 1 3 . 1 1 33 33 TYR H H 33 8.640 8.640 8.809 -0.169 25281 1259 1 3 . 1 1 34 34 ARG N N 34 128.980 128.980 120.819 8.161 25281 1260 1 3 . 1 1 34 34 ARG CA C 34 52.690 52.690 55.003 -2.313 25281 1261 1 3 . 1 1 34 34 ARG CB C 34 34.320 34.320 33.921 0.399 25281 1262 1 3 . 1 1 34 34 ARG H H 34 8.830 8.830 8.723 0.107 25281 1263 1 3 . 1 1 35 35 TYR N N 35 124.820 124.820 125.241 -0.421 25281 1264 1 3 . 1 1 35 35 TYR CA C 35 56.640 56.640 57.135 -0.495 25281 1265 1 3 . 1 1 35 35 TYR CB C 35 41.980 41.980 41.684 0.296 25281 1266 1 3 . 1 1 35 35 TYR H H 35 8.840 8.840 8.119 0.721 25281 1267 1 3 . 1 1 39 39 ASN N N 39 127.690 127.690 116.203 11.487 25281 1268 1 3 . 1 1 39 39 ASN CA C 39 54.850 54.850 54.517 0.333 25281 1269 1 3 . 1 1 39 39 ASN CB C 39 38.290 38.290 38.376 -0.086 25281 1270 1 3 . 1 1 39 39 ASN H H 39 7.990 7.990 8.552 -0.562 25281 1271 1 3 . 1 1 40 40 ASP N N 40 115.200 115.200 115.830 -0.630 25281 1272 1 3 . 1 1 40 40 ASP CA C 40 55.210 55.210 52.782 2.428 25281 1273 1 3 . 1 1 40 40 ASP CB C 40 44.010 44.010 42.447 1.563 25281 1274 1 3 . 1 1 40 40 ASP H H 40 8.370 8.370 7.587 0.783 25281 1275 1 3 . 1 1 41 41 TRP N N 41 124.210 124.210 120.451 3.759 25281 1276 1 3 . 1 1 41 41 TRP CA C 41 55.840 55.840 56.659 -0.819 25281 1277 1 3 . 1 1 41 41 TRP CB C 41 33.540 33.540 30.452 3.088 25281 1278 1 3 . 1 1 41 41 TRP H H 41 9.130 9.130 8.432 0.698 25281 1279 1 3 . 1 1 42 42 GLY N N 42 107.800 107.800 109.099 -1.299 25281 1280 1 3 . 1 1 42 42 GLY CA C 42 45.870 45.870 44.776 1.094 25281 1281 1 3 . 1 1 42 42 GLY H H 42 8.610 8.610 8.172 0.438 25281 1282 1 3 . 1 1 43 43 VAL N N 43 116.260 116.260 118.960 -2.700 25281 1283 1 3 . 1 1 43 43 VAL CA C 43 58.980 58.980 60.602 -1.623 25281 1284 1 3 . 1 1 43 43 VAL CB C 43 35.430 35.430 35.609 -0.179 25281 1285 1 3 . 1 1 43 43 VAL H H 43 8.880 8.880 7.806 1.074 25281 1286 1 3 . 1 1 44 44 ILE N N 44 124.720 124.720 127.115 -2.395 25281 1287 1 3 . 1 1 44 44 ILE CA C 44 58.390 58.390 59.910 -1.520 25281 1288 1 3 . 1 1 44 44 ILE CB C 44 42.890 42.890 41.147 1.743 25281 1289 1 3 . 1 1 44 44 ILE H H 44 9.110 9.110 8.105 1.005 25281 1290 1 3 . 1 1 45 45 GLY N N 45 110.610 110.610 113.600 -2.990 25281 1291 1 3 . 1 1 45 45 GLY CA C 45 43.150 43.150 43.669 -0.519 25281 1292 1 3 . 1 1 45 45 GLY H H 45 8.910 8.910 8.366 0.544 25281 1293 1 3 . 1 1 46 46 SER N N 46 116.210 116.210 119.390 -3.180 25281 1294 1 3 . 1 1 46 46 SER CA C 46 56.250 56.250 57.576 -1.326 25281 1295 1 3 . 1 1 46 46 SER CB C 46 63.720 63.720 66.213 -2.493 25281 1296 1 3 . 1 1 46 46 SER H H 46 9.250 9.250 8.714 0.536 25281 1297 1 3 . 1 1 47 47 PHE N N 47 126.400 126.400 122.832 3.568 25281 1298 1 3 . 1 1 47 47 PHE CA C 47 55.090 55.090 56.600 -1.510 25281 1299 1 3 . 1 1 47 47 PHE CB C 47 42.560 42.560 42.789 -0.229 25281 1300 1 3 . 1 1 47 47 PHE H H 47 8.940 8.940 9.372 -0.432 25281 1301 1 3 . 1 1 48 48 ALA N N 48 131.930 131.930 123.647 8.283 25281 1302 1 3 . 1 1 48 48 ALA CA C 48 50.350 50.350 50.770 -0.420 25281 1303 1 3 . 1 1 48 48 ALA CB C 48 21.280 21.280 23.189 -1.909 25281 1304 1 3 . 1 1 48 48 ALA H H 48 8.790 8.790 8.737 0.053 25281 1305 1 3 . 1 1 49 49 GLN N N 49 116.070 116.070 118.567 -2.497 25281 1306 1 3 . 1 1 49 49 GLN CA C 49 54.110 54.110 53.947 0.163 25281 1307 1 3 . 1 1 49 49 GLN CB C 49 31.140 31.140 32.259 -1.119 25281 1308 1 3 . 1 1 49 49 GLN H H 49 7.720 7.720 8.336 -0.616 25281 1309 1 3 . 1 1 50 50 THR N N 50 115.990 115.990 111.369 4.621 25281 1310 1 3 . 1 1 50 50 THR CA C 50 59.270 59.270 60.379 -1.109 25281 1311 1 3 . 1 1 50 50 THR CB C 50 70.980 70.980 72.749 -1.769 25281 1312 1 3 . 1 1 50 50 THR H H 50 9.470 9.470 8.848 0.622 25281 1313 1 3 . 1 1 51 51 ARG N N 51 117.600 117.600 121.523 -3.923 25281 1314 1 3 . 1 1 51 51 ARG CA C 51 55.350 55.350 55.629 -0.279 25281 1315 1 3 . 1 1 51 51 ARG CB C 51 33.610 33.610 33.983 -0.373 25281 1316 1 3 . 1 1 51 51 ARG H H 51 8.600 8.600 8.101 0.499 25281 1317 1 3 . 1 1 52 52 ARG N N 52 121.400 121.400 126.890 -5.490 25281 1318 1 3 . 1 1 52 52 ARG CA C 52 56.910 56.910 55.428 1.482 25281 1319 1 3 . 1 1 52 52 ARG CB C 52 29.370 29.370 30.825 -1.455 25281 1320 1 3 . 1 1 52 52 ARG H H 52 8.380 8.380 8.136 0.244 25281 1321 1 3 . 1 1 53 53 GLY N N 53 111.040 111.040 110.394 0.646 25281 1322 1 3 . 1 1 53 53 GLY CA C 53 45.190 45.190 45.352 -0.162 25281 1323 1 3 . 1 1 53 53 GLY H H 53 8.330 8.330 8.777 -0.447 25281 1324 1 3 . 1 1 54 54 PHE N N 54 119.210 119.210 121.010 -1.800 25281 1325 1 3 . 1 1 54 54 PHE CA C 54 55.670 55.670 59.568 -3.898 25281 1326 1 3 . 1 1 54 54 PHE CB C 54 29.220 29.220 39.994 -10.774 25281 1327 1 3 . 1 1 54 54 PHE H H 54 7.720 7.720 7.730 -0.010 25281 1328 1 3 . 1 1 55 55 GLU N N 55 123.470 123.470 124.213 -0.743 25281 1329 1 3 . 1 1 55 55 GLU CA C 55 55.580 55.580 55.687 -0.107 25281 1330 1 3 . 1 1 55 55 GLU CB C 55 32.920 32.920 30.564 2.357 25281 1331 1 3 . 1 1 55 55 GLU H H 55 8.400 8.400 7.545 0.855 25281 1332 1 3 . 1 1 56 56 GLU N N 56 121.950 121.950 121.146 0.804 25281 1333 1 3 . 1 1 56 56 GLU CA C 56 56.690 56.690 56.606 0.084 25281 1334 1 3 . 1 1 56 56 GLU CB C 56 29.450 29.450 30.022 -0.572 25281 1335 1 3 . 1 1 56 56 GLU H H 56 8.500 8.500 8.329 0.171 25281 1336 1 3 . 1 1 57 57 SER N N 57 123.330 123.330 117.536 5.794 25281 1337 1 3 . 1 1 57 57 SER CA C 57 55.090 55.090 57.444 -2.354 25281 1338 1 3 . 1 1 57 57 SER CB C 57 64.890 64.890 64.795 0.095 25281 1339 1 3 . 1 1 57 57 SER H H 57 8.640 8.640 8.261 0.379 25281 1340 1 3 . 1 1 58 58 VAL N N 58 122.060 122.060 122.097 -0.037 25281 1341 1 3 . 1 1 58 58 VAL CA C 58 57.660 57.660 61.956 -4.296 25281 1342 1 3 . 1 1 58 58 VAL CB C 58 31.640 31.640 34.107 -2.467 25281 1343 1 3 . 1 1 58 58 VAL H H 58 8.480 8.480 8.325 0.155 25281 1344 1 3 . 1 1 59 59 ASP N N 59 123.390 123.390 124.880 -1.490 25281 1345 1 3 . 1 1 59 59 ASP CA C 59 54.960 54.960 54.980 -0.020 25281 1346 1 3 . 1 1 59 59 ASP CB C 59 42.840 42.840 41.357 1.483 25281 1347 1 3 . 1 1 59 59 ASP H H 59 9.360 9.360 8.527 0.833 25281 1348 1 3 . 1 1 60 60 GLY N N 60 105.230 105.230 106.269 -1.039 25281 1349 1 3 . 1 1 60 60 GLY CA C 60 45.130 45.130 44.472 0.658 25281 1350 1 3 . 1 1 60 60 GLY H H 60 8.210 8.210 7.450 0.760 25281 1351 1 3 . 1 1 61 61 PHE N N 61 121.440 121.440 120.317 1.123 25281 1352 1 3 . 1 1 61 61 PHE CA C 61 57.330 57.330 58.774 -1.444 25281 1353 1 3 . 1 1 61 61 PHE CB C 61 39.420 39.420 40.003 -0.583 25281 1354 1 3 . 1 1 61 61 PHE H H 61 8.330 8.330 8.273 0.057 25281 1355 1 3 . 1 1 62 62 LYS N N 62 119.870 119.870 121.739 -1.869 25281 1356 1 3 . 1 1 62 62 LYS CA C 62 56.340 56.340 55.219 1.121 25281 1357 1 3 . 1 1 62 62 LYS CB C 62 33.850 33.850 34.566 -0.716 25281 1358 1 3 . 1 1 62 62 LYS H H 62 8.480 8.480 8.128 0.352 25281 1359 1 3 . 1 1 63 63 LEU N N 63 125.160 125.160 123.124 2.036 25281 1360 1 3 . 1 1 63 63 LEU CA C 63 56.220 56.220 57.209 -0.989 25281 1361 1 3 . 1 1 63 63 LEU CB C 63 41.520 41.520 41.572 -0.052 25281 1362 1 3 . 1 1 63 63 LEU H H 63 8.910 8.910 9.008 -0.098 25281 1363 1 3 . 1 1 64 64 ILE N N 64 119.660 119.660 113.755 5.905 25281 1364 1 3 . 1 1 64 64 ILE CA C 64 62.420 62.420 63.211 -0.791 25281 1365 1 3 . 1 1 64 64 ILE CB C 64 37.700 37.700 36.830 0.870 25281 1366 1 3 . 1 1 64 64 ILE H H 64 8.210 8.210 8.005 0.205 25281 1367 1 3 . 1 1 65 65 ASP N N 65 117.080 117.080 121.419 -4.339 25281 1368 1 3 . 1 1 65 65 ASP CA C 65 57.420 57.420 56.698 0.722 25281 1369 1 3 . 1 1 65 65 ASP CB C 65 38.350 38.350 40.659 -2.309 25281 1370 1 3 . 1 1 65 65 ASP H H 65 7.710 7.710 7.741 -0.031 25281 1371 1 3 . 1 1 66 66 GLY N N 66 106.440 106.440 106.092 0.348 25281 1372 1 3 . 1 1 66 66 GLY CA C 66 45.170 45.170 45.145 0.025 25281 1373 1 3 . 1 1 66 66 GLY H H 66 7.920 7.920 7.597 0.323 25281 1374 1 3 . 1 1 67 67 ASP N N 67 118.490 118.490 121.400 -2.910 25281 1375 1 3 . 1 1 67 67 ASP CA C 67 57.340 57.340 55.205 2.135 25281 1376 1 3 . 1 1 67 67 ASP CB C 67 29.870 29.870 41.651 -11.781 25281 1377 1 3 . 1 1 67 67 ASP H H 67 7.820 7.820 7.926 -0.106 25281 1378 1 3 . 1 1 68 68 PHE N N 68 125.320 125.320 117.877 7.443 25281 1379 1 3 . 1 1 68 68 PHE CA C 68 56.090 56.090 58.176 -2.086 25281 1380 1 3 . 1 1 68 68 PHE CB C 68 41.940 41.940 40.919 1.021 25281 1381 1 3 . 1 1 68 68 PHE H H 68 8.310 8.310 8.571 -0.261 25281 1382 1 3 . 1 1 69 69 LYS N N 69 124.770 124.770 123.794 0.976 25281 1383 1 3 . 1 1 69 69 LYS CA C 69 54.880 54.880 55.273 -0.392 25281 1384 1 3 . 1 1 69 69 LYS CB C 69 36.920 36.920 35.772 1.148 25281 1385 1 3 . 1 1 69 69 LYS H H 69 8.730 8.730 8.872 -0.142 25281 1386 1 3 . 1 1 70 70 TYR N N 70 123.740 123.740 128.262 -4.522 25281 1387 1 3 . 1 1 70 70 TYR CA C 70 55.540 55.540 56.693 -1.153 25281 1388 1 3 . 1 1 70 70 TYR CB C 70 40.150 40.150 42.161 -2.011 25281 1389 1 3 . 1 1 70 70 TYR H H 70 8.680 8.680 8.443 0.237 25281 1390 1 3 . 1 1 71 71 TYR N N 71 123.920 123.920 127.268 -3.348 25281 1391 1 3 . 1 1 71 71 TYR CA C 71 54.500 54.500 56.480 -1.980 25281 1392 1 3 . 1 1 71 71 TYR CB C 71 42.420 42.420 42.545 -0.125 25281 1393 1 3 . 1 1 71 71 TYR H H 71 8.620 8.620 8.095 0.525 25281 1394 1 3 . 1 1 72 72 SER N N 72 113.820 113.820 115.492 -1.672 25281 1395 1 3 . 1 1 72 72 SER CA C 72 56.320 56.320 56.741 -0.421 25281 1396 1 3 . 1 1 72 72 SER CB C 72 65.790 65.790 65.197 0.593 25281 1397 1 3 . 1 1 72 72 SER H H 72 8.800 8.800 8.552 0.248 25281 1398 1 3 . 1 1 73 73 VAL N N 73 119.260 119.260 120.676 -1.416 25281 1399 1 3 . 1 1 73 73 VAL CA C 73 60.730 60.730 59.505 1.225 25281 1400 1 3 . 1 1 73 73 VAL CB C 73 33.870 33.870 35.209 -1.339 25281 1401 1 3 . 1 1 73 73 VAL H H 73 8.170 8.170 8.065 0.105 25281 1402 1 3 . 1 1 74 74 THR N N 74 115.360 115.360 117.556 -2.196 25281 1403 1 3 . 1 1 74 74 THR CA C 74 59.040 59.040 61.401 -2.361 25281 1404 1 3 . 1 1 74 74 THR CB C 74 73.250 73.250 71.363 1.887 25281 1405 1 3 . 1 1 74 74 THR H H 74 9.200 9.200 8.246 0.954 25281 1406 1 3 . 1 1 75 75 ALA N N 75 119.330 119.330 126.808 -7.478 25281 1407 1 3 . 1 1 75 75 ALA CA C 75 51.390 51.390 50.903 0.487 25281 1408 1 3 . 1 1 75 75 ALA CB C 75 22.380 22.380 22.585 -0.205 25281 1409 1 3 . 1 1 75 75 ALA H H 75 9.130 9.130 8.743 0.387 25281 1410 1 3 . 1 1 76 76 GLY N N 76 103.130 103.130 106.283 -3.153 25281 1411 1 3 . 1 1 76 76 GLY CA C 76 45.900 45.900 44.718 1.182 25281 1412 1 3 . 1 1 76 76 GLY H H 76 8.760 8.760 7.984 0.776 25281 1413 1 3 . 1 1 77 77 PRO CA C 77 61.250 61.250 62.476 -1.226 25281 1414 1 3 . 1 1 77 77 PRO CB C 77 32.590 32.590 33.431 -0.841 25281 1415 1 3 . 1 1 78 78 VAL N N 78 115.250 115.250 118.675 -3.425 25281 1416 1 3 . 1 1 78 78 VAL CA C 78 58.430 58.430 60.535 -2.105 25281 1417 1 3 . 1 1 78 78 VAL CB C 78 32.700 32.700 35.074 -2.374 25281 1418 1 3 . 1 1 78 78 VAL H H 78 8.240 8.240 8.022 0.218 25281 1419 1 3 . 1 1 79 79 PHE N N 79 130.610 130.610 128.602 2.008 25281 1420 1 3 . 1 1 79 79 PHE CA C 79 55.090 55.090 55.625 -0.535 25281 1421 1 3 . 1 1 79 79 PHE CB C 79 41.590 41.590 43.108 -1.518 25281 1422 1 3 . 1 1 79 79 PHE H H 79 9.540 9.540 8.438 1.102 25281 1423 1 3 . 1 1 80 80 ARG N N 80 130.350 130.350 125.620 4.730 25281 1424 1 3 . 1 1 80 80 ARG CA C 80 55.490 55.490 54.415 1.075 25281 1425 1 3 . 1 1 80 80 ARG CB C 80 29.520 29.520 29.756 -0.236 25281 1426 1 3 . 1 1 80 80 ARG H H 80 8.810 8.810 7.871 0.939 25281 1427 1 3 . 1 1 81 81 ILE N N 81 127.480 127.480 122.954 4.526 25281 1428 1 3 . 1 1 81 81 ILE CA C 81 62.850 62.850 62.390 0.460 25281 1429 1 3 . 1 1 81 81 ILE CB C 81 37.650 37.650 39.229 -1.579 25281 1430 1 3 . 1 1 81 81 ILE H H 81 8.260 8.260 8.717 -0.457 25281 1431 1 3 . 1 1 82 82 ASN N N 82 113.110 113.110 114.334 -1.224 25281 1432 1 3 . 1 1 82 82 ASN CA C 82 55.630 55.630 53.159 2.471 25281 1433 1 3 . 1 1 82 82 ASN CB C 82 43.210 43.210 40.083 3.127 25281 1434 1 3 . 1 1 82 82 ASN H H 82 7.970 7.970 7.551 0.419 25281 1435 1 3 . 1 1 85 85 VAL N N 85 118.090 118.090 119.037 -0.947 25281 1436 1 3 . 1 1 85 85 VAL CA C 85 61.120 61.120 61.321 -0.201 25281 1437 1 3 . 1 1 85 85 VAL CB C 85 34.910 34.910 35.398 -0.488 25281 1438 1 3 . 1 1 85 85 VAL H H 85 7.840 7.840 7.585 0.255 25281 1439 1 3 . 1 1 86 86 SER N N 86 119.050 119.050 122.164 -3.114 25281 1440 1 3 . 1 1 86 86 SER CA C 86 57.100 57.100 57.389 -0.289 25281 1441 1 3 . 1 1 86 86 SER CB C 86 65.400 65.400 66.397 -0.997 25281 1442 1 3 . 1 1 86 86 SER H H 86 8.240 8.240 8.094 0.146 25281 1443 1 3 . 1 1 87 87 LEU N N 87 124.640 124.640 125.393 -0.753 25281 1444 1 3 . 1 1 87 87 LEU CA C 87 53.750 53.750 54.232 -0.482 25281 1445 1 3 . 1 1 87 87 LEU CB C 87 46.320 46.320 45.150 1.170 25281 1446 1 3 . 1 1 87 87 LEU H H 87 9.130 9.130 8.272 0.858 25281 1447 1 3 . 1 1 88 88 TYR N N 88 118.740 118.740 122.640 -3.900 25281 1448 1 3 . 1 1 88 88 TYR CA C 88 55.080 55.080 56.086 -1.006 25281 1449 1 3 . 1 1 88 88 TYR CB C 88 42.630 42.630 40.954 1.676 25281 1450 1 3 . 1 1 88 88 TYR H H 88 8.740 8.740 7.983 0.757 25281 1451 1 3 . 1 1 89 89 GLY N N 89 103.920 103.920 106.788 -2.868 25281 1452 1 3 . 1 1 89 89 GLY CA C 89 43.250 43.250 43.502 -0.252 25281 1453 1 3 . 1 1 89 89 GLY H H 89 7.720 7.720 8.219 -0.499 25281 1454 1 3 . 1 1 90 90 LEU N N 90 117.530 117.530 117.223 0.307 25281 1455 1 3 . 1 1 90 90 LEU CA C 90 53.200 53.200 54.339 -1.139 25281 1456 1 3 . 1 1 90 90 LEU CB C 90 45.810 45.810 45.111 0.699 25281 1457 1 3 . 1 1 90 90 LEU H H 90 8.520 8.520 8.059 0.461 25281 1458 1 3 . 1 1 91 91 LEU N N 91 120.670 120.670 115.513 5.157 25281 1459 1 3 . 1 1 91 91 LEU CA C 91 53.590 53.590 53.910 -0.320 25281 1460 1 3 . 1 1 91 91 LEU CB C 91 46.330 46.330 45.787 0.543 25281 1461 1 3 . 1 1 91 91 LEU H H 91 9.250 9.250 7.996 1.254 25281 1462 1 3 . 1 1 92 92 GLY N N 92 108.770 108.770 106.667 2.103 25281 1463 1 3 . 1 1 92 92 GLY CA C 92 46.520 46.520 46.172 0.348 25281 1464 1 3 . 1 1 92 92 GLY H H 92 8.480 8.480 8.356 0.124 25281 1465 1 3 . 1 1 93 93 ALA N N 93 126.760 126.760 121.263 5.497 25281 1466 1 3 . 1 1 93 93 ALA CA C 93 49.890 49.890 51.286 -1.396 25281 1467 1 3 . 1 1 93 93 ALA CB C 93 21.860 21.860 22.391 -0.531 25281 1468 1 3 . 1 1 93 93 ALA H H 93 8.860 8.860 7.774 1.086 25281 1469 1 3 . 1 1 94 94 GLY N N 94 107.510 107.510 106.681 0.829 25281 1470 1 3 . 1 1 94 94 GLY CA C 94 42.760 42.760 44.598 -1.838 25281 1471 1 3 . 1 1 94 94 GLY H H 94 8.880 8.880 7.830 1.050 25281 1472 1 3 . 1 1 95 95 HIS N N 95 122.340 122.340 118.603 3.737 25281 1473 1 3 . 1 1 95 95 HIS CA C 95 54.570 54.570 54.612 -0.042 25281 1474 1 3 . 1 1 95 95 HIS CB C 95 32.700 32.700 34.445 -1.745 25281 1475 1 3 . 1 1 95 95 HIS H H 95 9.200 9.200 8.113 1.087 25281 1476 1 3 . 1 1 96 96 GLY N N 96 112.170 112.170 108.478 3.692 25281 1477 1 3 . 1 1 96 96 GLY CA C 96 43.150 43.150 44.343 -1.193 25281 1478 1 3 . 1 1 96 96 GLY H H 96 8.620 8.620 8.475 0.145 25281 1479 1 3 . 1 1 97 97 LYS N N 97 120.580 120.580 123.097 -2.517 25281 1480 1 3 . 1 1 97 97 LYS CA C 97 54.890 54.890 54.740 0.150 25281 1481 1 3 . 1 1 97 97 LYS CB C 97 35.560 35.560 37.699 -2.139 25281 1482 1 3 . 1 1 97 97 LYS H H 97 9.010 9.010 9.266 -0.256 25281 1483 1 3 . 1 1 98 98 ALA N N 98 126.740 126.740 124.373 2.367 25281 1484 1 3 . 1 1 98 98 ALA CA C 98 50.020 50.020 50.910 -0.890 25281 1485 1 3 . 1 1 98 98 ALA CB C 98 22.380 22.380 22.768 -0.388 25281 1486 1 3 . 1 1 98 98 ALA H H 98 9.120 9.120 8.514 0.606 25281 1487 1 3 . 1 1 99 99 LYS N N 99 122.360 122.360 120.957 1.403 25281 1488 1 3 . 1 1 99 99 LYS CA C 99 55.090 55.090 54.882 0.208 25281 1489 1 3 . 1 1 99 99 LYS CB C 99 34.970 34.970 35.963 -0.993 25281 1490 1 3 . 1 1 99 99 LYS H H 99 8.580 8.580 8.636 -0.056 25281 1491 1 3 . 1 1 100 100 PHE N N 100 121.170 121.170 122.273 -1.103 25281 1492 1 3 . 1 1 100 100 PHE CA C 100 56.390 56.390 56.204 0.186 25281 1493 1 3 . 1 1 100 100 PHE CB C 100 42.110 42.110 39.508 2.602 25281 1494 1 3 . 1 1 100 100 PHE H H 100 8.750 8.750 8.560 0.190 25281 1495 1 3 . 1 1 101 101 SER N N 101 117.280 117.280 114.968 2.312 25281 1496 1 3 . 1 1 101 101 SER CA C 101 57.070 57.070 56.360 0.710 25281 1497 1 3 . 1 1 101 101 SER CB C 101 65.830 65.830 65.151 0.679 25281 1498 1 3 . 1 1 101 101 SER H H 101 8.990 8.990 7.993 0.997 25281 1499 1 3 . 1 1 102 102 SER N N 102 117.600 117.600 115.430 2.170 25281 1500 1 3 . 1 1 102 102 SER CA C 102 56.500 56.500 57.769 -1.269 25281 1501 1 3 . 1 1 102 102 SER CB C 102 67.540 67.540 63.235 4.305 25281 1502 1 3 . 1 1 102 102 SER H H 102 8.680 8.680 8.155 0.525 25281 1503 1 3 . 1 1 103 103 ILE N N 103 114.980 114.980 124.967 -9.987 25281 1504 1 3 . 1 1 103 103 ILE CA C 103 59.180 59.180 59.904 -0.724 25281 1505 1 3 . 1 1 103 103 ILE CB C 103 40.550 40.550 40.647 -0.097 25281 1506 1 3 . 1 1 103 103 ILE H H 103 7.700 7.700 8.102 -0.402 25281 1507 1 3 . 1 1 104 104 PHE N N 104 123.710 123.710 122.539 1.171 25281 1508 1 3 . 1 1 104 104 PHE CA C 104 53.190 53.190 57.907 -4.717 25281 1509 1 3 . 1 1 104 104 PHE CB C 104 43.900 43.900 39.418 4.482 25281 1510 1 3 . 1 1 104 104 PHE H H 104 8.590 8.590 8.645 -0.055 25281 1511 1 3 . 1 1 105 105 GLY N N 105 109.080 109.080 111.283 -2.203 25281 1512 1 3 . 1 1 105 105 GLY CA C 105 45.420 45.420 44.389 1.031 25281 1513 1 3 . 1 1 105 105 GLY H H 105 8.400 8.400 8.454 -0.054 25281 1514 1 3 . 1 1 106 106 GLN N N 106 119.680 119.680 118.928 0.752 25281 1515 1 3 . 1 1 106 106 GLN CA C 106 53.720 53.720 55.372 -1.652 25281 1516 1 3 . 1 1 106 106 GLN CB C 106 30.100 30.100 29.570 0.530 25281 1517 1 3 . 1 1 106 106 GLN H H 106 8.530 8.530 8.315 0.215 25281 1518 1 3 . 1 1 107 107 SER N N 107 119.160 119.160 117.768 1.392 25281 1519 1 3 . 1 1 107 107 SER CA C 107 57.360 57.360 57.165 0.195 25281 1520 1 3 . 1 1 107 107 SER CB C 107 66.050 66.050 63.769 2.281 25281 1521 1 3 . 1 1 107 107 SER H H 107 8.800 8.800 8.195 0.605 25281 1522 1 3 . 1 1 108 108 GLU N N 108 125.360 125.360 120.222 5.138 25281 1523 1 3 . 1 1 108 108 GLU CA C 108 58.910 58.910 55.732 3.178 25281 1524 1 3 . 1 1 108 108 GLU CB C 108 40.880 40.880 33.233 7.647 25281 1525 1 3 . 1 1 108 108 GLU H H 108 8.960 8.960 7.849 1.111 25281 1526 1 3 . 1 1 109 109 SER N N 109 118.890 118.890 117.018 1.872 25281 1527 1 3 . 1 1 109 109 SER CA C 109 56.710 56.710 57.389 -0.679 25281 1528 1 3 . 1 1 109 109 SER CB C 109 66.180 66.180 65.853 0.327 25281 1529 1 3 . 1 1 109 109 SER H H 109 9.080 9.080 8.441 0.639 25281 1530 1 3 . 1 1 110 110 ARG N N 110 119.830 119.830 124.220 -4.390 25281 1531 1 3 . 1 1 110 110 ARG CA C 110 58.390 58.390 55.975 2.415 25281 1532 1 3 . 1 1 110 110 ARG CB C 110 40.940 40.940 33.556 7.384 25281 1533 1 3 . 1 1 110 110 ARG H H 110 8.850 8.850 8.318 0.532 25281 1534 1 3 . 1 1 111 111 SER N N 111 114.870 114.870 118.208 -3.338 25281 1535 1 3 . 1 1 111 111 SER CA C 111 57.290 57.290 56.976 0.314 25281 1536 1 3 . 1 1 111 111 SER CB C 111 66.110 66.110 65.502 0.608 25281 1537 1 3 . 1 1 111 111 SER H H 111 8.740 8.740 8.593 0.147 25281 1538 1 3 . 1 1 112 112 LYS N N 112 120.870 120.870 125.434 -4.564 25281 1539 1 3 . 1 1 112 112 LYS CA C 112 55.150 55.150 55.298 -0.148 25281 1540 1 3 . 1 1 112 112 LYS CB C 112 36.330 36.330 36.427 -0.097 25281 1541 1 3 . 1 1 112 112 LYS H H 112 8.520 8.520 8.906 -0.386 25281 1542 1 3 . 1 1 113 113 THR N N 113 121.390 121.390 117.660 3.730 25281 1543 1 3 . 1 1 113 113 THR CA C 113 61.250 61.250 61.637 -0.387 25281 1544 1 3 . 1 1 113 113 THR CB C 113 70.010 70.010 70.539 -0.529 25281 1545 1 3 . 1 1 113 113 THR H H 113 8.440 8.440 8.594 -0.154 25281 1546 1 3 . 1 1 114 114 SER N N 114 120.730 120.730 120.547 0.183 25281 1547 1 3 . 1 1 114 114 SER CA C 114 56.190 56.190 57.238 -1.048 25281 1548 1 3 . 1 1 114 114 SER CB C 114 66.380 66.380 65.962 0.418 25281 1549 1 3 . 1 1 114 114 SER H H 114 9.350 9.350 8.352 0.998 25281 1550 1 3 . 1 1 115 115 LEU N N 115 121.540 121.540 122.135 -0.595 25281 1551 1 3 . 1 1 115 115 LEU CA C 115 55.480 55.480 54.216 1.264 25281 1552 1 3 . 1 1 115 115 LEU CB C 115 42.890 42.890 45.394 -2.504 25281 1553 1 3 . 1 1 115 115 LEU H H 115 8.200 8.200 8.081 0.119 25281 1554 1 3 . 1 1 116 116 ALA N N 116 129.060 129.060 126.428 2.632 25281 1555 1 3 . 1 1 116 116 ALA CA C 116 49.960 49.960 50.433 -0.473 25281 1556 1 3 . 1 1 116 116 ALA CB C 116 20.310 20.310 21.539 -1.229 25281 1557 1 3 . 1 1 116 116 ALA H H 116 8.600 8.600 8.322 0.278 25281 1558 1 3 . 1 1 117 117 TYR N N 117 115.890 115.890 125.645 -9.755 25281 1559 1 3 . 1 1 117 117 TYR CA C 117 55.150 55.150 57.324 -2.174 25281 1560 1 3 . 1 1 117 117 TYR CB C 117 41.200 41.200 41.958 -0.758 25281 1561 1 3 . 1 1 117 117 TYR H H 117 8.450 8.450 7.819 0.631 25281 1562 1 3 . 1 1 118 118 GLY N N 118 107.330 107.330 110.745 -3.415 25281 1563 1 3 . 1 1 118 118 GLY CA C 118 45.940 45.940 45.097 0.843 25281 1564 1 3 . 1 1 118 118 GLY H H 118 9.340 9.340 7.660 1.680 25281 1565 1 3 . 1 1 119 119 ALA N N 119 118.880 118.880 119.237 -0.357 25281 1566 1 3 . 1 1 119 119 ALA CA C 119 51.320 51.320 50.704 0.616 25281 1567 1 3 . 1 1 119 119 ALA CB C 119 22.120 22.120 22.215 -0.095 25281 1568 1 3 . 1 1 119 119 ALA H H 119 8.770 8.770 6.994 1.776 25281 1569 1 3 . 1 1 120 120 GLY N N 120 105.730 105.730 105.555 0.175 25281 1570 1 3 . 1 1 120 120 GLY CA C 120 45.650 45.650 44.380 1.270 25281 1571 1 3 . 1 1 120 120 GLY H H 120 7.940 7.940 7.490 0.450 25281 1572 1 3 . 1 1 121 121 LEU N N 121 115.480 115.480 119.308 -3.828 25281 1573 1 3 . 1 1 121 121 LEU CA C 121 52.980 52.980 53.446 -0.466 25281 1574 1 3 . 1 1 121 121 LEU CB C 121 46.460 46.460 45.992 0.468 25281 1575 1 3 . 1 1 121 121 LEU H H 121 9.010 9.010 8.399 0.611 25281 1576 1 3 . 1 1 122 122 GLN N N 122 112.530 112.530 121.426 -8.896 25281 1577 1 3 . 1 1 122 122 GLN CA C 122 54.780 54.780 54.301 0.479 25281 1578 1 3 . 1 1 122 122 GLN CB C 122 31.400 31.400 32.422 -1.022 25281 1579 1 3 . 1 1 122 122 GLN H H 122 8.090 8.090 8.103 -0.013 25281 1580 1 3 . 1 1 123 123 PHE N N 123 126.050 126.050 124.848 1.202 25281 1581 1 3 . 1 1 123 123 PHE CA C 123 54.180 54.180 55.938 -1.758 25281 1582 1 3 . 1 1 123 123 PHE CB C 123 42.560 42.560 42.689 -0.129 25281 1583 1 3 . 1 1 123 123 PHE H H 123 10.020 10.020 8.478 1.542 25281 1584 1 3 . 1 1 124 124 ASN N N 124 121.910 121.910 120.426 1.484 25281 1585 1 3 . 1 1 124 124 ASN CA C 124 50.940 50.940 50.470 0.470 25281 1586 1 3 . 1 1 124 124 ASN CB C 124 40.360 40.360 38.500 1.860 25281 1587 1 3 . 1 1 124 124 ASN H H 124 9.520 9.520 8.397 1.123 25281 1588 1 3 . 1 1 125 125 PRO CA C 125 63.390 63.390 63.338 0.052 25281 1589 1 3 . 1 1 125 125 PRO CB C 125 31.210 31.210 32.103 -0.893 25281 1590 1 3 . 1 1 126 126 HIS N N 126 116.830 116.830 118.653 -1.823 25281 1591 1 3 . 1 1 126 126 HIS CA C 126 54.110 54.110 56.056 -1.946 25281 1592 1 3 . 1 1 126 126 HIS CB C 126 34.910 34.910 28.758 6.152 25281 1593 1 3 . 1 1 126 126 HIS H H 126 7.630 7.630 7.891 -0.261 25281 1594 1 3 . 1 1 127 127 PRO CA C 127 65.370 65.370 63.228 2.142 25281 1595 1 3 . 1 1 127 127 PRO CB C 127 31.030 31.030 31.054 -0.024 25281 1596 1 3 . 1 1 128 128 ASN N N 128 114.680 114.680 117.461 -2.781 25281 1597 1 3 . 1 1 128 128 ASN CA C 128 53.990 53.990 52.781 1.209 25281 1598 1 3 . 1 1 128 128 ASN CB C 128 40.550 40.550 39.824 0.726 25281 1599 1 3 . 1 1 128 128 ASN H H 128 10.460 10.460 7.932 2.528 25281 1600 1 3 . 1 1 129 129 PHE N N 129 119.630 119.630 117.276 2.354 25281 1601 1 3 . 1 1 129 129 PHE CA C 129 56.530 56.530 57.172 -0.642 25281 1602 1 3 . 1 1 129 129 PHE CB C 129 44.310 44.310 43.122 1.188 25281 1603 1 3 . 1 1 129 129 PHE H H 129 8.340 8.340 7.374 0.966 25281 1604 1 3 . 1 1 130 130 VAL N N 130 123.000 123.000 114.995 8.005 25281 1605 1 3 . 1 1 130 130 VAL CA C 130 60.340 60.340 60.893 -0.553 25281 1606 1 3 . 1 1 130 130 VAL CB C 130 34.970 34.970 35.587 -0.617 25281 1607 1 3 . 1 1 130 130 VAL H H 130 7.820 7.820 8.444 -0.624 25281 1608 1 3 . 1 1 131 131 ILE N N 131 124.470 124.470 122.372 2.098 25281 1609 1 3 . 1 1 131 131 ILE CA C 131 60.210 60.210 59.180 1.030 25281 1610 1 3 . 1 1 131 131 ILE CB C 131 39.510 39.510 39.276 0.234 25281 1611 1 3 . 1 1 131 131 ILE H H 131 8.830 8.830 8.807 0.023 25281 1612 1 3 . 1 1 132 132 ASP N N 132 130.700 130.700 128.265 2.435 25281 1613 1 3 . 1 1 132 132 ASP CA C 132 53.530 53.530 53.136 0.394 25281 1614 1 3 . 1 1 132 132 ASP CB C 132 47.620 47.620 43.739 3.881 25281 1615 1 3 . 1 1 132 132 ASP H H 132 9.040 9.040 8.577 0.463 25281 1616 1 3 . 1 1 133 133 ALA N N 133 126.900 126.900 127.195 -0.295 25281 1617 1 3 . 1 1 133 133 ALA CA C 133 51.390 51.390 50.893 0.497 25281 1618 1 3 . 1 1 133 133 ALA CB C 133 21.730 21.730 22.322 -0.592 25281 1619 1 3 . 1 1 133 133 ALA H H 133 8.800 8.800 8.269 0.531 25281 1620 1 3 . 1 1 134 134 SER N N 134 113.760 113.760 118.213 -4.453 25281 1621 1 3 . 1 1 134 134 SER CA C 134 58.140 58.140 57.592 0.548 25281 1622 1 3 . 1 1 134 134 SER CB C 134 67.020 67.020 66.475 0.544 25281 1623 1 3 . 1 1 134 134 SER H H 134 9.160 9.160 8.372 0.788 25281 1624 1 3 . 1 1 135 135 TYR N N 135 118.500 118.500 115.544 2.956 25281 1625 1 3 . 1 1 135 135 TYR CA C 135 55.690 55.690 56.409 -0.719 25281 1626 1 3 . 1 1 135 135 TYR CB C 135 43.150 43.150 41.345 1.805 25281 1627 1 3 . 1 1 135 135 TYR H H 135 8.820 8.820 7.777 1.043 25281 1628 1 3 . 1 1 136 136 GLU N N 136 126.290 126.290 118.161 8.129 25281 1629 1 3 . 1 1 136 136 GLU CA C 136 53.530 53.530 54.998 -1.468 25281 1630 1 3 . 1 1 136 136 GLU CB C 136 34.450 34.450 33.867 0.583 25281 1631 1 3 . 1 1 136 136 GLU H H 136 8.380 8.380 8.897 -0.517 25281 1632 1 3 . 1 1 137 137 TYR N N 137 123.630 123.630 117.459 6.171 25281 1633 1 3 . 1 1 137 137 TYR CA C 137 55.670 55.670 55.910 -0.241 25281 1634 1 3 . 1 1 137 137 TYR CB C 137 43.150 43.150 41.542 1.607 25281 1635 1 3 . 1 1 137 137 TYR H H 137 9.300 9.300 8.406 0.894 25281 1636 1 3 . 1 1 138 138 SER N N 138 118.300 118.300 114.949 3.351 25281 1637 1 3 . 1 1 138 138 SER CA C 138 58.270 58.270 56.111 2.159 25281 1638 1 3 . 1 1 138 138 SER CB C 138 67.090 67.090 65.530 1.560 25281 1639 1 3 . 1 1 138 138 SER H H 138 7.980 7.980 8.453 -0.473 25281 1640 1 3 . 1 1 139 139 LYS N N 139 127.450 127.450 126.690 0.760 25281 1641 1 3 . 1 1 139 139 LYS CA C 139 55.160 55.160 55.835 -0.675 25281 1642 1 3 . 1 1 139 139 LYS CB C 139 32.640 32.640 33.289 -0.649 25281 1643 1 3 . 1 1 139 139 LYS H H 139 8.630 8.630 8.599 0.031 25281 1644 1 3 . 1 1 140 140 LEU N N 140 129.650 129.650 126.584 3.066 25281 1645 1 3 . 1 1 140 140 LEU CA C 140 52.500 52.500 52.536 -0.036 25281 1646 1 3 . 1 1 140 140 LEU CB C 140 40.000 40.000 45.367 -5.367 25281 1647 1 3 . 1 1 140 140 LEU H H 140 9.060 9.060 8.058 1.002 25281 1648 1 3 . 1 1 141 141 ASP N N 141 121.470 121.470 123.801 -2.331 25281 1649 1 3 . 1 1 141 141 ASP CA C 141 57.190 57.190 56.733 0.457 25281 1650 1 3 . 1 1 141 141 ASP CB C 141 39.730 39.730 40.632 -0.902 25281 1651 1 3 . 1 1 141 141 ASP H H 141 8.590 8.590 8.786 -0.196 25281 1652 1 3 . 1 1 142 142 ASP N N 142 121.510 121.510 118.320 3.190 25281 1653 1 3 . 1 1 142 142 ASP CA C 142 55.180 55.180 55.026 0.153 25281 1654 1 3 . 1 1 142 142 ASP CB C 142 41.090 41.090 41.808 -0.718 25281 1655 1 3 . 1 1 142 142 ASP H H 142 8.430 8.430 8.142 0.288 25281 1656 1 3 . 1 1 143 143 VAL N N 143 121.420 121.420 119.265 2.155 25281 1657 1 3 . 1 1 143 143 VAL CA C 143 62.240 62.240 61.306 0.934 25281 1658 1 3 . 1 1 143 143 VAL CB C 143 31.280 31.280 34.174 -2.894 25281 1659 1 3 . 1 1 143 143 VAL H H 143 8.020 8.020 7.957 0.063 25281 1660 1 3 . 1 1 144 144 LYS N N 144 127.950 127.950 126.200 1.750 25281 1661 1 3 . 1 1 144 144 LYS CA C 144 55.440 55.440 55.590 -0.151 25281 1662 1 3 . 1 1 144 144 LYS CB C 144 32.640 32.640 34.006 -1.366 25281 1663 1 3 . 1 1 144 144 LYS H H 144 8.660 8.660 8.514 0.146 25281 1664 1 3 . 1 1 145 145 VAL N N 145 124.120 124.120 124.783 -0.663 25281 1665 1 3 . 1 1 145 145 VAL CA C 145 55.910 55.910 59.511 -3.600 25281 1666 1 3 . 1 1 145 145 VAL CB C 145 32.570 32.570 36.017 -3.446 25281 1667 1 3 . 1 1 145 145 VAL H H 145 8.720 8.720 7.799 0.921 25281 1668 1 3 . 1 1 146 146 GLY N N 146 116.240 116.240 114.862 1.378 25281 1669 1 3 . 1 1 146 146 GLY CA C 146 44.080 44.080 44.395 -0.315 25281 1670 1 3 . 1 1 146 146 GLY H H 146 8.400 8.400 8.297 0.103 25281 1671 1 3 . 1 1 147 147 THR N N 147 124.620 124.620 121.195 3.425 25281 1672 1 3 . 1 1 147 147 THR CA C 147 61.450 61.450 61.741 -0.291 25281 1673 1 3 . 1 1 147 147 THR CB C 147 70.260 70.260 70.990 -0.730 25281 1674 1 3 . 1 1 147 147 THR H H 147 9.080 9.080 8.922 0.158 25281 1675 1 3 . 1 1 148 148 TRP N N 148 124.790 124.790 127.832 -3.042 25281 1676 1 3 . 1 1 148 148 TRP CA C 148 54.770 54.770 56.422 -1.652 25281 1677 1 3 . 1 1 148 148 TRP CB C 148 33.090 33.090 32.587 0.503 25281 1678 1 3 . 1 1 148 148 TRP H H 148 8.510 8.510 9.109 -0.599 25281 1679 1 3 . 1 1 149 149 MET N N 149 118.880 118.880 120.209 -1.329 25281 1680 1 3 . 1 1 149 149 MET CA C 149 54.540 54.540 54.664 -0.124 25281 1681 1 3 . 1 1 149 149 MET CB C 149 34.640 34.640 36.770 -2.131 25281 1682 1 3 . 1 1 149 149 MET H H 149 9.150 9.150 9.239 -0.089 25281 1683 1 3 . 1 1 150 150 LEU N N 150 122.830 122.830 124.474 -1.644 25281 1684 1 3 . 1 1 150 150 LEU CA C 150 54.100 54.100 54.215 -0.115 25281 1685 1 3 . 1 1 150 150 LEU CB C 150 45.800 45.800 46.248 -0.448 25281 1686 1 3 . 1 1 150 150 LEU H H 150 8.480 8.480 8.176 0.304 25281 1687 1 3 . 1 1 151 151 GLY N N 151 112.730 112.730 111.827 0.903 25281 1688 1 3 . 1 1 151 151 GLY CA C 151 45.940 45.940 45.894 0.046 25281 1689 1 3 . 1 1 151 151 GLY H H 151 9.820 9.820 8.285 1.535 25281 1690 1 3 . 1 1 152 152 ALA N N 152 119.460 119.460 119.997 -0.537 25281 1691 1 3 . 1 1 152 152 ALA CA C 152 49.760 49.760 50.977 -1.217 25281 1692 1 3 . 1 1 152 152 ALA CB C 152 22.700 22.700 22.828 -0.128 25281 1693 1 3 . 1 1 152 152 ALA H H 152 8.840 8.840 8.151 0.689 25281 1694 1 3 . 1 1 153 153 GLY N N 153 104.360 104.360 106.754 -2.394 25281 1695 1 3 . 1 1 153 153 GLY CA C 153 46.440 46.440 44.509 1.931 25281 1696 1 3 . 1 1 153 153 GLY H H 153 8.540 8.540 8.080 0.460 25281 1697 1 3 . 1 1 154 154 TYR N N 154 120.680 120.680 120.186 0.494 25281 1698 1 3 . 1 1 154 154 TYR CA C 154 55.370 55.370 56.601 -1.231 25281 1699 1 3 . 1 1 154 154 TYR CB C 154 44.250 44.250 42.344 1.905 25281 1700 1 3 . 1 1 154 154 TYR H H 154 8.310 8.310 8.059 0.251 25281 1701 1 3 . 1 1 155 155 ARG N N 155 127.050 127.050 126.896 0.154 25281 1702 1 3 . 1 1 155 155 ARG CA C 155 53.480 53.480 54.968 -1.488 25281 1703 1 3 . 1 1 155 155 ARG CB C 155 32.160 32.160 30.803 1.357 25281 1704 1 3 . 1 1 155 155 ARG H H 155 7.640 7.640 7.907 -0.267 25281 1705 1 4 . 1 1 2 2 GLY N N 2 112.280 112.280 108.274 4.006 25281 1706 1 4 . 1 1 2 2 GLY CA C 2 44.830 44.830 44.746 0.084 25281 1707 1 4 . 1 1 2 2 GLY H H 2 8.460 8.460 7.982 0.478 25281 1708 1 4 . 1 1 3 3 GLU N N 3 118.460 118.460 120.935 -2.475 25281 1709 1 4 . 1 1 3 3 GLU CA C 3 56.840 56.840 56.505 0.335 25281 1710 1 4 . 1 1 3 3 GLU CB C 3 29.980 29.980 30.214 -0.234 25281 1711 1 4 . 1 1 3 3 GLU H H 3 7.630 7.630 8.249 -0.619 25281 1712 1 4 . 1 1 4 4 SER N N 4 119.000 119.000 116.263 2.737 25281 1713 1 4 . 1 1 4 4 SER CA C 4 57.280 57.280 57.088 0.192 25281 1714 1 4 . 1 1 4 4 SER CB C 4 65.860 65.860 66.552 -0.692 25281 1715 1 4 . 1 1 4 4 SER H H 4 8.820 8.820 8.355 0.465 25281 1716 1 4 . 1 1 5 5 SER N N 5 118.300 118.300 114.757 3.543 25281 1717 1 4 . 1 1 5 5 SER CA C 5 57.560 57.560 57.361 0.199 25281 1718 1 4 . 1 1 5 5 SER CB C 5 65.480 65.480 66.153 -0.673 25281 1719 1 4 . 1 1 5 5 SER H H 5 8.700 8.700 8.273 0.427 25281 1720 1 4 . 1 1 6 6 ILE N N 6 123.240 123.240 120.726 2.514 25281 1721 1 4 . 1 1 6 6 ILE CA C 6 54.110 54.110 60.521 -6.411 25281 1722 1 4 . 1 1 6 6 ILE CB C 6 33.870 33.870 41.092 -7.222 25281 1723 1 4 . 1 1 6 6 ILE H H 6 9.080 9.080 7.671 1.409 25281 1724 1 4 . 1 1 7 7 SER N N 7 116.100 116.100 121.042 -4.942 25281 1725 1 4 . 1 1 7 7 SER CA C 7 57.130 57.130 56.252 0.878 25281 1726 1 4 . 1 1 7 7 SER CB C 7 65.710 65.710 65.356 0.354 25281 1727 1 4 . 1 1 7 7 SER H H 7 8.570 8.570 8.428 0.142 25281 1728 1 4 . 1 1 8 8 ILE N N 8 114.140 114.140 118.881 -4.741 25281 1729 1 4 . 1 1 8 8 ILE CA C 8 58.460 58.460 58.631 -0.171 25281 1730 1 4 . 1 1 8 8 ILE CB C 8 40.880 40.880 42.043 -1.163 25281 1731 1 4 . 1 1 8 8 ILE H H 8 8.300 8.300 9.132 -0.832 25281 1732 1 4 . 1 1 9 9 GLY N N 9 109.200 109.200 107.989 1.211 25281 1733 1 4 . 1 1 9 9 GLY CA C 9 45.550 45.550 45.757 -0.207 25281 1734 1 4 . 1 1 9 9 GLY H H 9 9.060 9.060 7.967 1.093 25281 1735 1 4 . 1 1 10 10 TYR N N 10 121.410 121.410 119.450 1.960 25281 1736 1 4 . 1 1 10 10 TYR CA C 10 56.970 56.970 57.116 -0.146 25281 1737 1 4 . 1 1 10 10 TYR CB C 10 41.520 41.520 41.609 -0.089 25281 1738 1 4 . 1 1 10 10 TYR H H 10 8.870 8.870 8.127 0.743 25281 1739 1 4 . 1 1 11 11 ALA N N 11 125.250 125.250 124.229 1.021 25281 1740 1 4 . 1 1 11 11 ALA CA C 11 48.740 48.740 50.245 -1.505 25281 1741 1 4 . 1 1 11 11 ALA CB C 11 21.610 21.610 21.486 0.124 25281 1742 1 4 . 1 1 11 11 ALA H H 11 7.210 7.210 8.221 -1.011 25281 1743 1 4 . 1 1 12 12 GLN N N 12 119.180 119.180 122.248 -3.068 25281 1744 1 4 . 1 1 12 12 GLN CA C 12 54.690 54.690 55.099 -0.409 25281 1745 1 4 . 1 1 12 12 GLN CB C 12 32.000 32.000 33.454 -1.454 25281 1746 1 4 . 1 1 12 12 GLN H H 12 8.330 8.330 8.221 0.109 25281 1747 1 4 . 1 1 13 13 SER N N 13 122.790 122.790 117.546 5.244 25281 1748 1 4 . 1 1 13 13 SER CA C 13 57.780 57.780 56.705 1.075 25281 1749 1 4 . 1 1 13 13 SER CB C 13 64.540 64.540 64.629 -0.090 25281 1750 1 4 . 1 1 13 13 SER H H 13 8.610 8.610 8.643 -0.033 25281 1751 1 4 . 1 1 14 14 ARG N N 14 121.140 121.140 126.903 -5.763 25281 1752 1 4 . 1 1 14 14 ARG CA C 14 54.960 54.960 54.398 0.562 25281 1753 1 4 . 1 1 14 14 ARG CB C 14 32.370 32.370 32.218 0.152 25281 1754 1 4 . 1 1 14 14 ARG H H 14 8.520 8.520 8.356 0.164 25281 1755 1 4 . 1 1 15 15 VAL N N 15 115.890 115.890 119.833 -3.943 25281 1756 1 4 . 1 1 15 15 VAL CA C 15 60.970 60.970 60.909 0.061 25281 1757 1 4 . 1 1 15 15 VAL CB C 15 34.320 34.320 35.490 -1.170 25281 1758 1 4 . 1 1 15 15 VAL H H 15 8.440 8.440 7.836 0.604 25281 1759 1 4 . 1 1 16 16 LYS N N 16 126.010 126.010 126.433 -0.423 25281 1760 1 4 . 1 1 16 16 LYS CA C 16 55.120 55.120 56.044 -0.924 25281 1761 1 4 . 1 1 16 16 LYS CB C 16 34.350 34.350 32.434 1.915 25281 1762 1 4 . 1 1 16 16 LYS H H 16 8.850 8.850 8.516 0.334 25281 1763 1 4 . 1 1 17 17 GLU N N 17 119.140 119.140 124.492 -5.352 25281 1764 1 4 . 1 1 17 17 GLU CA C 17 54.460 54.460 55.164 -0.704 25281 1765 1 4 . 1 1 17 17 GLU CB C 17 33.430 33.430 31.491 1.939 25281 1766 1 4 . 1 1 17 17 GLU H H 17 8.030 8.030 8.282 -0.252 25281 1767 1 4 . 1 1 18 18 ASP N N 18 120.280 120.280 120.667 -0.387 25281 1768 1 4 . 1 1 18 18 ASP CA C 18 56.500 56.500 54.435 2.065 25281 1769 1 4 . 1 1 18 18 ASP CB C 18 33.780 33.780 41.448 -7.668 25281 1770 1 4 . 1 1 18 18 ASP H H 18 8.120 8.120 8.439 -0.319 25281 1771 1 4 . 1 1 19 19 GLY N N 19 118.750 118.750 109.307 9.443 25281 1772 1 4 . 1 1 19 19 GLY CA C 19 44.130 44.130 44.522 -0.391 25281 1773 1 4 . 1 1 19 19 GLY H H 19 8.430 8.430 8.217 0.213 25281 1774 1 4 . 1 1 20 20 TYR N N 20 117.080 117.080 124.809 -7.729 25281 1775 1 4 . 1 1 20 20 TYR CA C 20 60.940 60.940 57.282 3.658 25281 1776 1 4 . 1 1 20 20 TYR CB C 20 42.010 42.010 37.888 4.122 25281 1777 1 4 . 1 1 20 20 TYR H H 20 8.610 8.610 8.552 0.058 25281 1778 1 4 . 1 1 21 21 LYS N N 21 127.240 127.240 123.184 4.056 25281 1779 1 4 . 1 1 21 21 LYS CA C 21 56.760 56.760 57.182 -0.423 25281 1780 1 4 . 1 1 21 21 LYS CB C 21 29.100 29.100 32.535 -3.434 25281 1781 1 4 . 1 1 21 21 LYS H H 21 7.970 7.970 8.473 -0.503 25281 1782 1 4 . 1 1 22 22 LEU N N 22 122.270 122.270 119.968 2.302 25281 1783 1 4 . 1 1 22 22 LEU CA C 22 59.170 59.170 57.278 1.892 25281 1784 1 4 . 1 1 22 22 LEU CB C 22 40.030 40.030 41.671 -1.641 25281 1785 1 4 . 1 1 22 22 LEU H H 22 8.370 8.370 8.077 0.293 25281 1786 1 4 . 1 1 23 23 ASP N N 23 114.790 114.790 113.310 1.480 25281 1787 1 4 . 1 1 23 23 ASP CA C 23 51.840 51.840 53.267 -1.427 25281 1788 1 4 . 1 1 23 23 ASP CB C 23 37.730 37.730 41.036 -3.306 25281 1789 1 4 . 1 1 23 23 ASP H H 23 8.210 8.210 8.122 0.088 25281 1790 1 4 . 1 1 24 24 LYS N N 24 115.470 115.470 114.321 1.149 25281 1791 1 4 . 1 1 24 24 LYS CA C 24 58.860 58.860 57.936 0.924 25281 1792 1 4 . 1 1 24 24 LYS CB C 24 28.330 28.330 30.067 -1.737 25281 1793 1 4 . 1 1 24 24 LYS H H 24 9.230 9.230 7.936 1.294 25281 1794 1 4 . 1 1 25 25 ASN N N 25 121.610 121.610 118.424 3.186 25281 1795 1 4 . 1 1 25 25 ASN CA C 25 54.430 54.430 50.277 4.153 25281 1796 1 4 . 1 1 25 25 ASN CB C 25 42.500 42.500 38.424 4.076 25281 1797 1 4 . 1 1 25 25 ASN H H 25 8.150 8.150 7.860 0.290 25281 1798 1 4 . 1 1 26 26 PRO CA C 26 63.340 63.340 62.799 0.541 25281 1799 1 4 . 1 1 26 26 PRO CB C 26 30.940 30.940 32.885 -1.945 25281 1800 1 4 . 1 1 27 27 ARG N N 27 120.730 120.730 119.495 1.235 25281 1801 1 4 . 1 1 27 27 ARG CA C 27 54.340 54.340 54.878 -0.538 25281 1802 1 4 . 1 1 27 27 ARG CB C 27 33.500 33.500 31.997 1.503 25281 1803 1 4 . 1 1 27 27 ARG H H 27 8.290 8.290 8.091 0.199 25281 1804 1 4 . 1 1 28 28 GLY N N 28 112.000 112.000 109.326 2.674 25281 1805 1 4 . 1 1 28 28 GLY CA C 28 46.940 46.940 44.907 2.033 25281 1806 1 4 . 1 1 28 28 GLY H H 28 8.810 8.810 7.835 0.975 25281 1807 1 4 . 1 1 29 29 PHE N N 29 121.230 121.230 118.043 3.187 25281 1808 1 4 . 1 1 29 29 PHE CA C 29 55.230 55.230 56.950 -1.720 25281 1809 1 4 . 1 1 29 29 PHE CB C 29 43.700 43.700 43.095 0.605 25281 1810 1 4 . 1 1 29 29 PHE H H 29 8.470 8.470 8.096 0.374 25281 1811 1 4 . 1 1 30 30 ASN N N 30 117.250 117.250 121.416 -4.166 25281 1812 1 4 . 1 1 30 30 ASN CA C 30 50.220 50.220 52.414 -2.195 25281 1813 1 4 . 1 1 30 30 ASN CB C 30 45.810 45.810 41.025 4.785 25281 1814 1 4 . 1 1 30 30 ASN H H 30 8.630 8.630 8.925 -0.295 25281 1815 1 4 . 1 1 31 31 LEU N N 31 128.180 128.180 126.532 1.648 25281 1816 1 4 . 1 1 31 31 LEU CA C 31 53.930 53.930 53.888 0.042 25281 1817 1 4 . 1 1 31 31 LEU CB C 31 45.810 45.810 44.421 1.389 25281 1818 1 4 . 1 1 31 31 LEU H H 31 9.080 9.080 9.313 -0.233 25281 1819 1 4 . 1 1 32 32 LYS N N 32 119.980 119.980 121.808 -1.828 25281 1820 1 4 . 1 1 32 32 LYS CA C 32 55.730 55.730 54.780 0.950 25281 1821 1 4 . 1 1 32 32 LYS CB C 32 36.070 36.070 36.692 -0.622 25281 1822 1 4 . 1 1 32 32 LYS H H 32 8.780 8.780 8.579 0.201 25281 1823 1 4 . 1 1 33 33 TYR N N 33 121.500 121.500 119.331 2.169 25281 1824 1 4 . 1 1 33 33 TYR CA C 33 55.830 55.830 55.406 0.425 25281 1825 1 4 . 1 1 33 33 TYR CB C 33 42.110 42.110 42.069 0.041 25281 1826 1 4 . 1 1 33 33 TYR H H 33 8.640 8.640 8.000 0.640 25281 1827 1 4 . 1 1 34 34 ARG N N 34 128.980 128.980 123.798 5.182 25281 1828 1 4 . 1 1 34 34 ARG CA C 34 52.690 52.690 54.572 -1.882 25281 1829 1 4 . 1 1 34 34 ARG CB C 34 34.320 34.320 34.177 0.143 25281 1830 1 4 . 1 1 34 34 ARG H H 34 8.830 8.830 8.205 0.625 25281 1831 1 4 . 1 1 35 35 TYR N N 35 124.820 124.820 127.902 -3.082 25281 1832 1 4 . 1 1 35 35 TYR CA C 35 56.640 56.640 56.760 -0.120 25281 1833 1 4 . 1 1 35 35 TYR CB C 35 41.980 41.980 41.856 0.124 25281 1834 1 4 . 1 1 35 35 TYR H H 35 8.840 8.840 8.368 0.472 25281 1835 1 4 . 1 1 39 39 ASN N N 39 127.690 127.690 120.912 6.778 25281 1836 1 4 . 1 1 39 39 ASN CA C 39 54.850 54.850 54.195 0.655 25281 1837 1 4 . 1 1 39 39 ASN CB C 39 38.290 38.290 36.916 1.374 25281 1838 1 4 . 1 1 39 39 ASN H H 39 7.990 7.990 8.811 -0.821 25281 1839 1 4 . 1 1 40 40 ASP N N 40 115.200 115.200 114.511 0.689 25281 1840 1 4 . 1 1 40 40 ASP CA C 40 55.210 55.210 53.084 2.126 25281 1841 1 4 . 1 1 40 40 ASP CB C 40 44.010 44.010 41.394 2.616 25281 1842 1 4 . 1 1 40 40 ASP H H 40 8.370 8.370 7.495 0.875 25281 1843 1 4 . 1 1 41 41 TRP N N 41 124.210 124.210 119.074 5.136 25281 1844 1 4 . 1 1 41 41 TRP CA C 41 55.840 55.840 56.358 -0.518 25281 1845 1 4 . 1 1 41 41 TRP CB C 41 33.540 33.540 30.712 2.828 25281 1846 1 4 . 1 1 41 41 TRP H H 41 9.130 9.130 7.803 1.327 25281 1847 1 4 . 1 1 42 42 GLY N N 42 107.800 107.800 106.660 1.140 25281 1848 1 4 . 1 1 42 42 GLY CA C 42 45.870 45.870 45.047 0.823 25281 1849 1 4 . 1 1 42 42 GLY H H 42 8.610 8.610 8.135 0.475 25281 1850 1 4 . 1 1 43 43 VAL N N 43 116.260 116.260 114.880 1.380 25281 1851 1 4 . 1 1 43 43 VAL CA C 43 58.980 58.980 59.006 -0.026 25281 1852 1 4 . 1 1 43 43 VAL CB C 43 35.430 35.430 35.303 0.127 25281 1853 1 4 . 1 1 43 43 VAL H H 43 8.880 8.880 7.993 0.887 25281 1854 1 4 . 1 1 44 44 ILE N N 44 124.720 124.720 121.363 3.357 25281 1855 1 4 . 1 1 44 44 ILE CA C 44 58.390 58.390 58.882 -0.492 25281 1856 1 4 . 1 1 44 44 ILE CB C 44 42.890 42.890 41.556 1.334 25281 1857 1 4 . 1 1 44 44 ILE H H 44 9.110 9.110 7.918 1.192 25281 1858 1 4 . 1 1 45 45 GLY N N 45 110.610 110.610 112.989 -2.379 25281 1859 1 4 . 1 1 45 45 GLY CA C 45 43.150 43.150 43.399 -0.249 25281 1860 1 4 . 1 1 45 45 GLY H H 45 8.910 8.910 7.207 1.703 25281 1861 1 4 . 1 1 46 46 SER N N 46 116.210 116.210 117.791 -1.581 25281 1862 1 4 . 1 1 46 46 SER CA C 46 56.250 56.250 56.256 -0.006 25281 1863 1 4 . 1 1 46 46 SER CB C 46 63.720 63.720 65.570 -1.849 25281 1864 1 4 . 1 1 46 46 SER H H 46 9.250 9.250 8.792 0.458 25281 1865 1 4 . 1 1 47 47 PHE N N 47 126.400 126.400 129.478 -3.078 25281 1866 1 4 . 1 1 47 47 PHE CA C 47 55.090 55.090 55.665 -0.575 25281 1867 1 4 . 1 1 47 47 PHE CB C 47 42.560 42.560 43.046 -0.486 25281 1868 1 4 . 1 1 47 47 PHE H H 47 8.940 8.940 9.306 -0.366 25281 1869 1 4 . 1 1 48 48 ALA N N 48 131.930 131.930 128.685 3.245 25281 1870 1 4 . 1 1 48 48 ALA CA C 48 50.350 50.350 50.336 0.014 25281 1871 1 4 . 1 1 48 48 ALA CB C 48 21.280 21.280 22.960 -1.680 25281 1872 1 4 . 1 1 48 48 ALA H H 48 8.790 8.790 7.651 1.139 25281 1873 1 4 . 1 1 49 49 GLN N N 49 116.070 116.070 118.264 -2.194 25281 1874 1 4 . 1 1 49 49 GLN CA C 49 54.110 54.110 54.068 0.042 25281 1875 1 4 . 1 1 49 49 GLN CB C 49 31.140 31.140 32.465 -1.325 25281 1876 1 4 . 1 1 49 49 GLN H H 49 7.720 7.720 7.939 -0.219 25281 1877 1 4 . 1 1 50 50 THR N N 50 115.990 115.990 114.918 1.072 25281 1878 1 4 . 1 1 50 50 THR CA C 50 59.270 59.270 60.709 -1.439 25281 1879 1 4 . 1 1 50 50 THR CB C 50 70.980 70.980 70.503 0.477 25281 1880 1 4 . 1 1 50 50 THR H H 50 9.470 9.470 8.247 1.223 25281 1881 1 4 . 1 1 51 51 ARG N N 51 117.600 117.600 121.697 -4.097 25281 1882 1 4 . 1 1 51 51 ARG CA C 51 55.350 55.350 54.397 0.953 25281 1883 1 4 . 1 1 51 51 ARG CB C 51 33.610 33.610 34.416 -0.806 25281 1884 1 4 . 1 1 51 51 ARG H H 51 8.600 8.600 7.987 0.613 25281 1885 1 4 . 1 1 52 52 ARG N N 52 121.400 121.400 123.236 -1.836 25281 1886 1 4 . 1 1 52 52 ARG CA C 52 56.910 56.910 56.522 0.388 25281 1887 1 4 . 1 1 52 52 ARG CB C 52 29.370 29.370 30.717 -1.347 25281 1888 1 4 . 1 1 52 52 ARG H H 52 8.380 8.380 8.412 -0.032 25281 1889 1 4 . 1 1 53 53 GLY N N 53 111.040 111.040 114.246 -3.206 25281 1890 1 4 . 1 1 53 53 GLY CA C 53 45.190 45.190 45.129 0.061 25281 1891 1 4 . 1 1 53 53 GLY H H 53 8.330 8.330 8.844 -0.514 25281 1892 1 4 . 1 1 54 54 PHE N N 54 119.210 119.210 115.209 4.001 25281 1893 1 4 . 1 1 54 54 PHE CA C 54 55.670 55.670 55.426 0.244 25281 1894 1 4 . 1 1 54 54 PHE CB C 54 29.220 29.220 40.453 -11.233 25281 1895 1 4 . 1 1 54 54 PHE H H 54 7.720 7.720 7.139 0.581 25281 1896 1 4 . 1 1 55 55 GLU N N 55 123.470 123.470 121.886 1.584 25281 1897 1 4 . 1 1 55 55 GLU CA C 55 55.580 55.580 55.832 -0.252 25281 1898 1 4 . 1 1 55 55 GLU CB C 55 32.920 32.920 31.565 1.355 25281 1899 1 4 . 1 1 55 55 GLU H H 55 8.400 8.400 8.616 -0.216 25281 1900 1 4 . 1 1 56 56 GLU N N 56 121.950 121.950 125.900 -3.950 25281 1901 1 4 . 1 1 56 56 GLU CA C 56 56.690 56.690 55.709 0.981 25281 1902 1 4 . 1 1 56 56 GLU CB C 56 29.450 29.450 31.690 -2.240 25281 1903 1 4 . 1 1 56 56 GLU H H 56 8.500 8.500 8.750 -0.250 25281 1904 1 4 . 1 1 57 57 SER N N 57 123.330 123.330 120.033 3.297 25281 1905 1 4 . 1 1 57 57 SER CA C 57 55.090 55.090 57.752 -2.662 25281 1906 1 4 . 1 1 57 57 SER CB C 57 64.890 64.890 63.269 1.621 25281 1907 1 4 . 1 1 57 57 SER H H 57 8.640 8.640 8.580 0.060 25281 1908 1 4 . 1 1 58 58 VAL N N 58 122.060 122.060 121.782 0.278 25281 1909 1 4 . 1 1 58 58 VAL CA C 58 57.660 57.660 60.243 -2.583 25281 1910 1 4 . 1 1 58 58 VAL CB C 58 31.640 31.640 34.053 -2.413 25281 1911 1 4 . 1 1 58 58 VAL H H 58 8.480 8.480 8.230 0.250 25281 1912 1 4 . 1 1 59 59 ASP N N 59 123.390 123.390 122.787 0.603 25281 1913 1 4 . 1 1 59 59 ASP CA C 59 54.960 54.960 54.609 0.351 25281 1914 1 4 . 1 1 59 59 ASP CB C 59 42.840 42.840 41.269 1.571 25281 1915 1 4 . 1 1 59 59 ASP H H 59 9.360 9.360 8.612 0.748 25281 1916 1 4 . 1 1 60 60 GLY N N 60 105.230 105.230 106.614 -1.384 25281 1917 1 4 . 1 1 60 60 GLY CA C 60 45.130 45.130 44.651 0.479 25281 1918 1 4 . 1 1 60 60 GLY H H 60 8.210 8.210 7.454 0.756 25281 1919 1 4 . 1 1 61 61 PHE N N 61 121.440 121.440 119.610 1.830 25281 1920 1 4 . 1 1 61 61 PHE CA C 61 57.330 57.330 58.010 -0.680 25281 1921 1 4 . 1 1 61 61 PHE CB C 61 39.420 39.420 40.495 -1.075 25281 1922 1 4 . 1 1 61 61 PHE H H 61 8.330 8.330 8.504 -0.174 25281 1923 1 4 . 1 1 62 62 LYS N N 62 119.870 119.870 122.729 -2.859 25281 1924 1 4 . 1 1 62 62 LYS CA C 62 56.340 56.340 54.965 1.375 25281 1925 1 4 . 1 1 62 62 LYS CB C 62 33.850 33.850 35.540 -1.690 25281 1926 1 4 . 1 1 62 62 LYS H H 62 8.480 8.480 8.484 -0.004 25281 1927 1 4 . 1 1 63 63 LEU N N 63 125.160 125.160 122.959 2.201 25281 1928 1 4 . 1 1 63 63 LEU CA C 63 56.220 56.220 57.315 -1.095 25281 1929 1 4 . 1 1 63 63 LEU CB C 63 41.520 41.520 42.031 -0.510 25281 1930 1 4 . 1 1 63 63 LEU H H 63 8.910 8.910 8.772 0.138 25281 1931 1 4 . 1 1 64 64 ILE N N 64 119.660 119.660 118.760 0.900 25281 1932 1 4 . 1 1 64 64 ILE CA C 64 62.420 62.420 64.803 -2.383 25281 1933 1 4 . 1 1 64 64 ILE CB C 64 37.700 37.700 37.015 0.685 25281 1934 1 4 . 1 1 64 64 ILE H H 64 8.210 8.210 7.884 0.326 25281 1935 1 4 . 1 1 65 65 ASP N N 65 117.080 117.080 119.184 -2.104 25281 1936 1 4 . 1 1 65 65 ASP CA C 65 57.420 57.420 56.770 0.649 25281 1937 1 4 . 1 1 65 65 ASP CB C 65 38.350 38.350 39.610 -1.260 25281 1938 1 4 . 1 1 65 65 ASP H H 65 7.710 7.710 8.753 -1.043 25281 1939 1 4 . 1 1 66 66 GLY N N 66 106.440 106.440 107.598 -1.158 25281 1940 1 4 . 1 1 66 66 GLY CA C 66 45.170 45.170 45.965 -0.795 25281 1941 1 4 . 1 1 66 66 GLY H H 66 7.920 7.920 7.687 0.233 25281 1942 1 4 . 1 1 67 67 ASP N N 67 118.490 118.490 121.962 -3.472 25281 1943 1 4 . 1 1 67 67 ASP CA C 67 57.340 57.340 57.536 -0.196 25281 1944 1 4 . 1 1 67 67 ASP CB C 67 29.870 29.870 41.037 -11.167 25281 1945 1 4 . 1 1 67 67 ASP H H 67 7.820 7.820 7.828 -0.008 25281 1946 1 4 . 1 1 68 68 PHE N N 68 125.320 125.320 115.943 9.377 25281 1947 1 4 . 1 1 68 68 PHE CA C 68 56.090 56.090 57.156 -1.066 25281 1948 1 4 . 1 1 68 68 PHE CB C 68 41.940 41.940 41.234 0.706 25281 1949 1 4 . 1 1 68 68 PHE H H 68 8.310 8.310 8.091 0.219 25281 1950 1 4 . 1 1 69 69 LYS N N 69 124.770 124.770 125.099 -0.329 25281 1951 1 4 . 1 1 69 69 LYS CA C 69 54.880 54.880 55.586 -0.706 25281 1952 1 4 . 1 1 69 69 LYS CB C 69 36.920 36.920 36.809 0.111 25281 1953 1 4 . 1 1 69 69 LYS H H 69 8.730 8.730 8.441 0.289 25281 1954 1 4 . 1 1 70 70 TYR N N 70 123.740 123.740 128.274 -4.534 25281 1955 1 4 . 1 1 70 70 TYR CA C 70 55.540 55.540 56.451 -0.911 25281 1956 1 4 . 1 1 70 70 TYR CB C 70 40.150 40.150 41.691 -1.541 25281 1957 1 4 . 1 1 70 70 TYR H H 70 8.680 8.680 8.437 0.243 25281 1958 1 4 . 1 1 71 71 TYR N N 71 123.920 123.920 128.020 -4.100 25281 1959 1 4 . 1 1 71 71 TYR CA C 71 54.500 54.500 55.911 -1.411 25281 1960 1 4 . 1 1 71 71 TYR CB C 71 42.420 42.420 41.701 0.719 25281 1961 1 4 . 1 1 71 71 TYR H H 71 8.620 8.620 7.608 1.012 25281 1962 1 4 . 1 1 72 72 SER N N 72 113.820 113.820 116.144 -2.324 25281 1963 1 4 . 1 1 72 72 SER CA C 72 56.320 56.320 56.931 -0.611 25281 1964 1 4 . 1 1 72 72 SER CB C 72 65.790 65.790 66.431 -0.641 25281 1965 1 4 . 1 1 72 72 SER H H 72 8.800 8.800 8.135 0.665 25281 1966 1 4 . 1 1 73 73 VAL N N 73 119.260 119.260 115.841 3.419 25281 1967 1 4 . 1 1 73 73 VAL CA C 73 60.730 60.730 59.745 0.985 25281 1968 1 4 . 1 1 73 73 VAL CB C 73 33.870 33.870 35.623 -1.753 25281 1969 1 4 . 1 1 73 73 VAL H H 73 8.170 8.170 8.068 0.102 25281 1970 1 4 . 1 1 74 74 THR N N 74 115.360 115.360 117.365 -2.005 25281 1971 1 4 . 1 1 74 74 THR CA C 74 59.040 59.040 61.544 -2.505 25281 1972 1 4 . 1 1 74 74 THR CB C 74 73.250 73.250 71.191 2.059 25281 1973 1 4 . 1 1 74 74 THR H H 74 9.200 9.200 8.182 1.018 25281 1974 1 4 . 1 1 75 75 ALA N N 75 119.330 119.330 127.219 -7.889 25281 1975 1 4 . 1 1 75 75 ALA CA C 75 51.390 51.390 50.878 0.512 25281 1976 1 4 . 1 1 75 75 ALA CB C 75 22.380 22.380 22.616 -0.236 25281 1977 1 4 . 1 1 75 75 ALA H H 75 9.130 9.130 8.559 0.571 25281 1978 1 4 . 1 1 76 76 GLY N N 76 103.130 103.130 106.113 -2.983 25281 1979 1 4 . 1 1 76 76 GLY CA C 76 45.900 45.900 44.600 1.300 25281 1980 1 4 . 1 1 76 76 GLY H H 76 8.760 8.760 7.947 0.813 25281 1981 1 4 . 1 1 77 77 PRO CA C 77 61.250 61.250 62.515 -1.265 25281 1982 1 4 . 1 1 77 77 PRO CB C 77 32.590 32.590 32.532 0.058 25281 1983 1 4 . 1 1 78 78 VAL N N 78 115.250 115.250 119.816 -4.566 25281 1984 1 4 . 1 1 78 78 VAL CA C 78 58.430 58.430 61.510 -3.080 25281 1985 1 4 . 1 1 78 78 VAL CB C 78 32.700 32.700 34.270 -1.569 25281 1986 1 4 . 1 1 78 78 VAL H H 78 8.240 8.240 8.240 -0.000 25281 1987 1 4 . 1 1 79 79 PHE N N 79 130.610 130.610 126.214 4.396 25281 1988 1 4 . 1 1 79 79 PHE CA C 79 55.090 55.090 56.358 -1.268 25281 1989 1 4 . 1 1 79 79 PHE CB C 79 41.590 41.590 43.078 -1.488 25281 1990 1 4 . 1 1 79 79 PHE H H 79 9.540 9.540 8.634 0.906 25281 1991 1 4 . 1 1 80 80 ARG N N 80 130.350 130.350 124.815 5.535 25281 1992 1 4 . 1 1 80 80 ARG CA C 80 55.490 55.490 56.537 -1.047 25281 1993 1 4 . 1 1 80 80 ARG CB C 80 29.520 29.520 30.997 -1.477 25281 1994 1 4 . 1 1 80 80 ARG H H 80 8.810 8.810 8.854 -0.044 25281 1995 1 4 . 1 1 81 81 ILE N N 81 127.480 127.480 127.893 -0.413 25281 1996 1 4 . 1 1 81 81 ILE CA C 81 62.850 62.850 62.586 0.264 25281 1997 1 4 . 1 1 81 81 ILE CB C 81 37.650 37.650 39.130 -1.480 25281 1998 1 4 . 1 1 81 81 ILE H H 81 8.260 8.260 9.140 -0.880 25281 1999 1 4 . 1 1 82 82 ASN N N 82 113.110 113.110 117.167 -4.057 25281 2000 1 4 . 1 1 82 82 ASN CA C 82 55.630 55.630 52.284 3.346 25281 2001 1 4 . 1 1 82 82 ASN CB C 82 43.210 43.210 39.582 3.628 25281 2002 1 4 . 1 1 82 82 ASN H H 82 7.970 7.970 7.649 0.321 25281 2003 1 4 . 1 1 85 85 VAL N N 85 118.090 118.090 120.640 -2.550 25281 2004 1 4 . 1 1 85 85 VAL CA C 85 61.120 61.120 61.167 -0.047 25281 2005 1 4 . 1 1 85 85 VAL CB C 85 34.910 34.910 35.315 -0.404 25281 2006 1 4 . 1 1 85 85 VAL H H 85 7.840 7.840 7.317 0.523 25281 2007 1 4 . 1 1 86 86 SER N N 86 119.050 119.050 121.720 -2.670 25281 2008 1 4 . 1 1 86 86 SER CA C 86 57.100 57.100 56.694 0.406 25281 2009 1 4 . 1 1 86 86 SER CB C 86 65.400 65.400 65.718 -0.318 25281 2010 1 4 . 1 1 86 86 SER H H 86 8.240 8.240 8.054 0.186 25281 2011 1 4 . 1 1 87 87 LEU N N 87 124.640 124.640 128.926 -4.286 25281 2012 1 4 . 1 1 87 87 LEU CA C 87 53.750 53.750 54.094 -0.344 25281 2013 1 4 . 1 1 87 87 LEU CB C 87 46.320 46.320 44.696 1.624 25281 2014 1 4 . 1 1 87 87 LEU H H 87 9.130 9.130 8.640 0.490 25281 2015 1 4 . 1 1 88 88 TYR N N 88 118.740 118.740 122.433 -3.693 25281 2016 1 4 . 1 1 88 88 TYR CA C 88 55.080 55.080 55.576 -0.496 25281 2017 1 4 . 1 1 88 88 TYR CB C 88 42.630 42.630 41.197 1.433 25281 2018 1 4 . 1 1 88 88 TYR H H 88 8.740 8.740 7.704 1.036 25281 2019 1 4 . 1 1 89 89 GLY N N 89 103.920 103.920 106.923 -3.003 25281 2020 1 4 . 1 1 89 89 GLY CA C 89 43.250 43.250 43.304 -0.054 25281 2021 1 4 . 1 1 89 89 GLY H H 89 7.720 7.720 8.245 -0.525 25281 2022 1 4 . 1 1 90 90 LEU N N 90 117.530 117.530 121.320 -3.790 25281 2023 1 4 . 1 1 90 90 LEU CA C 90 53.200 53.200 54.176 -0.976 25281 2024 1 4 . 1 1 90 90 LEU CB C 90 45.810 45.810 45.917 -0.107 25281 2025 1 4 . 1 1 90 90 LEU H H 90 8.520 8.520 8.699 -0.179 25281 2026 1 4 . 1 1 91 91 LEU N N 91 120.670 120.670 125.352 -4.682 25281 2027 1 4 . 1 1 91 91 LEU CA C 91 53.590 53.590 53.815 -0.225 25281 2028 1 4 . 1 1 91 91 LEU CB C 91 46.330 46.330 46.017 0.314 25281 2029 1 4 . 1 1 91 91 LEU H H 91 9.250 9.250 7.939 1.311 25281 2030 1 4 . 1 1 92 92 GLY N N 92 108.770 108.770 112.868 -4.098 25281 2031 1 4 . 1 1 92 92 GLY CA C 92 46.520 46.520 46.085 0.435 25281 2032 1 4 . 1 1 92 92 GLY H H 92 8.480 8.480 8.348 0.132 25281 2033 1 4 . 1 1 93 93 ALA N N 93 126.760 126.760 120.272 6.488 25281 2034 1 4 . 1 1 93 93 ALA CA C 93 49.890 49.890 51.347 -1.458 25281 2035 1 4 . 1 1 93 93 ALA CB C 93 21.860 21.860 22.539 -0.679 25281 2036 1 4 . 1 1 93 93 ALA H H 93 8.860 8.860 7.834 1.026 25281 2037 1 4 . 1 1 94 94 GLY N N 94 107.510 107.510 106.693 0.817 25281 2038 1 4 . 1 1 94 94 GLY CA C 94 42.760 42.760 44.562 -1.802 25281 2039 1 4 . 1 1 94 94 GLY H H 94 8.880 8.880 8.095 0.785 25281 2040 1 4 . 1 1 95 95 HIS N N 95 122.340 122.340 116.790 5.550 25281 2041 1 4 . 1 1 95 95 HIS CA C 95 54.570 54.570 53.870 0.700 25281 2042 1 4 . 1 1 95 95 HIS CB C 95 32.700 32.700 33.158 -0.459 25281 2043 1 4 . 1 1 95 95 HIS H H 95 9.200 9.200 8.089 1.111 25281 2044 1 4 . 1 1 96 96 GLY N N 96 112.170 112.170 105.835 6.335 25281 2045 1 4 . 1 1 96 96 GLY CA C 96 43.150 43.150 44.844 -1.694 25281 2046 1 4 . 1 1 96 96 GLY H H 96 8.620 8.620 8.659 -0.039 25281 2047 1 4 . 1 1 97 97 LYS N N 97 120.580 120.580 119.836 0.744 25281 2048 1 4 . 1 1 97 97 LYS CA C 97 54.890 54.890 54.986 -0.096 25281 2049 1 4 . 1 1 97 97 LYS CB C 97 35.560 35.560 36.902 -1.342 25281 2050 1 4 . 1 1 97 97 LYS H H 97 9.010 9.010 8.529 0.481 25281 2051 1 4 . 1 1 98 98 ALA N N 98 126.740 126.740 123.098 3.642 25281 2052 1 4 . 1 1 98 98 ALA CA C 98 50.020 50.020 50.102 -0.082 25281 2053 1 4 . 1 1 98 98 ALA CB C 98 22.380 22.380 22.249 0.131 25281 2054 1 4 . 1 1 98 98 ALA H H 98 9.120 9.120 8.472 0.648 25281 2055 1 4 . 1 1 99 99 LYS N N 99 122.360 122.360 125.331 -2.971 25281 2056 1 4 . 1 1 99 99 LYS CA C 99 55.090 55.090 54.913 0.177 25281 2057 1 4 . 1 1 99 99 LYS CB C 99 34.970 34.970 36.267 -1.296 25281 2058 1 4 . 1 1 99 99 LYS H H 99 8.580 8.580 7.939 0.641 25281 2059 1 4 . 1 1 100 100 PHE N N 100 121.170 121.170 126.390 -5.220 25281 2060 1 4 . 1 1 100 100 PHE CA C 100 56.390 56.390 55.242 1.148 25281 2061 1 4 . 1 1 100 100 PHE CB C 100 42.110 42.110 39.783 2.327 25281 2062 1 4 . 1 1 100 100 PHE H H 100 8.750 8.750 8.319 0.431 25281 2063 1 4 . 1 1 101 101 SER N N 101 117.280 117.280 114.352 2.928 25281 2064 1 4 . 1 1 101 101 SER CA C 101 57.070 57.070 56.343 0.728 25281 2065 1 4 . 1 1 101 101 SER CB C 101 65.830 65.830 64.615 1.214 25281 2066 1 4 . 1 1 101 101 SER H H 101 8.990 8.990 8.139 0.851 25281 2067 1 4 . 1 1 102 102 SER N N 102 117.600 117.600 116.071 1.529 25281 2068 1 4 . 1 1 102 102 SER CA C 102 56.500 56.500 57.982 -1.482 25281 2069 1 4 . 1 1 102 102 SER CB C 102 67.540 67.540 63.189 4.351 25281 2070 1 4 . 1 1 102 102 SER H H 102 8.680 8.680 8.148 0.532 25281 2071 1 4 . 1 1 103 103 ILE N N 103 114.980 114.980 120.770 -5.790 25281 2072 1 4 . 1 1 103 103 ILE CA C 103 59.180 59.180 59.485 -0.305 25281 2073 1 4 . 1 1 103 103 ILE CB C 103 40.550 40.550 40.289 0.261 25281 2074 1 4 . 1 1 103 103 ILE H H 103 7.700 7.700 8.161 -0.461 25281 2075 1 4 . 1 1 104 104 PHE N N 104 123.710 123.710 121.517 2.193 25281 2076 1 4 . 1 1 104 104 PHE CA C 104 53.190 53.190 58.053 -4.863 25281 2077 1 4 . 1 1 104 104 PHE CB C 104 43.900 43.900 39.530 4.370 25281 2078 1 4 . 1 1 104 104 PHE H H 104 8.590 8.590 8.642 -0.052 25281 2079 1 4 . 1 1 105 105 GLY N N 105 109.080 109.080 111.814 -2.734 25281 2080 1 4 . 1 1 105 105 GLY CA C 105 45.420 45.420 44.343 1.077 25281 2081 1 4 . 1 1 105 105 GLY H H 105 8.400 8.400 8.436 -0.036 25281 2082 1 4 . 1 1 106 106 GLN N N 106 119.680 119.680 120.517 -0.837 25281 2083 1 4 . 1 1 106 106 GLN CA C 106 53.720 53.720 55.740 -2.020 25281 2084 1 4 . 1 1 106 106 GLN CB C 106 30.100 30.100 29.628 0.472 25281 2085 1 4 . 1 1 106 106 GLN H H 106 8.530 8.530 8.349 0.181 25281 2086 1 4 . 1 1 107 107 SER N N 107 119.160 119.160 120.747 -1.587 25281 2087 1 4 . 1 1 107 107 SER CA C 107 57.360 57.360 57.740 -0.380 25281 2088 1 4 . 1 1 107 107 SER CB C 107 66.050 66.050 63.305 2.745 25281 2089 1 4 . 1 1 107 107 SER H H 107 8.800 8.800 8.317 0.483 25281 2090 1 4 . 1 1 108 108 GLU N N 108 125.360 125.360 121.542 3.818 25281 2091 1 4 . 1 1 108 108 GLU CA C 108 58.910 58.910 55.463 3.447 25281 2092 1 4 . 1 1 108 108 GLU CB C 108 40.880 40.880 31.717 9.163 25281 2093 1 4 . 1 1 108 108 GLU H H 108 8.960 8.960 7.932 1.028 25281 2094 1 4 . 1 1 109 109 SER N N 109 118.890 118.890 119.498 -0.608 25281 2095 1 4 . 1 1 109 109 SER CA C 109 56.710 56.710 57.788 -1.078 25281 2096 1 4 . 1 1 109 109 SER CB C 109 66.180 66.180 64.763 1.417 25281 2097 1 4 . 1 1 109 109 SER H H 109 9.080 9.080 8.444 0.636 25281 2098 1 4 . 1 1 110 110 ARG N N 110 119.830 119.830 124.885 -5.055 25281 2099 1 4 . 1 1 110 110 ARG CA C 110 58.390 58.390 55.326 3.064 25281 2100 1 4 . 1 1 110 110 ARG CB C 110 40.940 40.940 33.737 7.203 25281 2101 1 4 . 1 1 110 110 ARG H H 110 8.850 8.850 8.466 0.384 25281 2102 1 4 . 1 1 111 111 SER N N 111 114.870 114.870 116.189 -1.319 25281 2103 1 4 . 1 1 111 111 SER CA C 111 57.290 57.290 57.515 -0.225 25281 2104 1 4 . 1 1 111 111 SER CB C 111 66.110 66.110 66.142 -0.033 25281 2105 1 4 . 1 1 111 111 SER H H 111 8.740 8.740 8.549 0.191 25281 2106 1 4 . 1 1 112 112 LYS N N 112 120.870 120.870 123.207 -2.337 25281 2107 1 4 . 1 1 112 112 LYS CA C 112 55.150 55.150 55.642 -0.492 25281 2108 1 4 . 1 1 112 112 LYS CB C 112 36.330 36.330 35.534 0.796 25281 2109 1 4 . 1 1 112 112 LYS H H 112 8.520 8.520 8.939 -0.419 25281 2110 1 4 . 1 1 113 113 THR N N 113 121.390 121.390 116.529 4.861 25281 2111 1 4 . 1 1 113 113 THR CA C 113 61.250 61.250 60.706 0.544 25281 2112 1 4 . 1 1 113 113 THR CB C 113 70.010 70.010 70.652 -0.642 25281 2113 1 4 . 1 1 113 113 THR H H 113 8.440 8.440 8.479 -0.039 25281 2114 1 4 . 1 1 114 114 SER N N 114 120.730 120.730 117.797 2.933 25281 2115 1 4 . 1 1 114 114 SER CA C 114 56.190 56.190 57.358 -1.168 25281 2116 1 4 . 1 1 114 114 SER CB C 114 66.380 66.380 65.399 0.981 25281 2117 1 4 . 1 1 114 114 SER H H 114 9.350 9.350 8.520 0.830 25281 2118 1 4 . 1 1 115 115 LEU N N 115 121.540 121.540 116.638 4.902 25281 2119 1 4 . 1 1 115 115 LEU CA C 115 55.480 55.480 53.911 1.569 25281 2120 1 4 . 1 1 115 115 LEU CB C 115 42.890 42.890 45.079 -2.189 25281 2121 1 4 . 1 1 115 115 LEU H H 115 8.200 8.200 8.471 -0.271 25281 2122 1 4 . 1 1 116 116 ALA N N 116 129.060 129.060 121.548 7.512 25281 2123 1 4 . 1 1 116 116 ALA CA C 116 49.960 49.960 50.458 -0.498 25281 2124 1 4 . 1 1 116 116 ALA CB C 116 20.310 20.310 22.203 -1.893 25281 2125 1 4 . 1 1 116 116 ALA H H 116 8.600 8.600 8.361 0.239 25281 2126 1 4 . 1 1 117 117 TYR N N 117 115.890 115.890 124.721 -8.831 25281 2127 1 4 . 1 1 117 117 TYR CA C 117 55.150 55.150 57.118 -1.968 25281 2128 1 4 . 1 1 117 117 TYR CB C 117 41.200 41.200 42.104 -0.904 25281 2129 1 4 . 1 1 117 117 TYR H H 117 8.450 8.450 7.911 0.539 25281 2130 1 4 . 1 1 118 118 GLY N N 118 107.330 107.330 110.764 -3.434 25281 2131 1 4 . 1 1 118 118 GLY CA C 118 45.940 45.940 45.184 0.756 25281 2132 1 4 . 1 1 118 118 GLY H H 118 9.340 9.340 7.627 1.713 25281 2133 1 4 . 1 1 119 119 ALA N N 119 118.880 118.880 119.348 -0.468 25281 2134 1 4 . 1 1 119 119 ALA CA C 119 51.320 51.320 50.875 0.445 25281 2135 1 4 . 1 1 119 119 ALA CB C 119 22.120 22.120 22.217 -0.097 25281 2136 1 4 . 1 1 119 119 ALA H H 119 8.770 8.770 7.204 1.566 25281 2137 1 4 . 1 1 120 120 GLY N N 120 105.730 105.730 105.104 0.626 25281 2138 1 4 . 1 1 120 120 GLY CA C 120 45.650 45.650 44.589 1.061 25281 2139 1 4 . 1 1 120 120 GLY H H 120 7.940 7.940 7.383 0.557 25281 2140 1 4 . 1 1 121 121 LEU N N 121 115.480 115.480 118.827 -3.347 25281 2141 1 4 . 1 1 121 121 LEU CA C 121 52.980 52.980 53.781 -0.801 25281 2142 1 4 . 1 1 121 121 LEU CB C 121 46.460 46.460 45.778 0.682 25281 2143 1 4 . 1 1 121 121 LEU H H 121 9.010 9.010 7.939 1.071 25281 2144 1 4 . 1 1 122 122 GLN N N 122 112.530 112.530 121.269 -8.739 25281 2145 1 4 . 1 1 122 122 GLN CA C 122 54.780 54.780 54.053 0.727 25281 2146 1 4 . 1 1 122 122 GLN CB C 122 31.400 31.400 32.449 -1.048 25281 2147 1 4 . 1 1 122 122 GLN H H 122 8.090 8.090 8.000 0.090 25281 2148 1 4 . 1 1 123 123 PHE N N 123 126.050 126.050 124.136 1.914 25281 2149 1 4 . 1 1 123 123 PHE CA C 123 54.180 54.180 56.278 -2.098 25281 2150 1 4 . 1 1 123 123 PHE CB C 123 42.560 42.560 42.890 -0.330 25281 2151 1 4 . 1 1 123 123 PHE H H 123 10.020 10.020 8.621 1.399 25281 2152 1 4 . 1 1 124 124 ASN N N 124 121.910 121.910 120.612 1.298 25281 2153 1 4 . 1 1 124 124 ASN CA C 124 50.940 50.940 49.919 1.021 25281 2154 1 4 . 1 1 124 124 ASN CB C 124 40.360 40.360 40.916 -0.556 25281 2155 1 4 . 1 1 124 124 ASN H H 124 9.520 9.520 8.455 1.065 25281 2156 1 4 . 1 1 125 125 PRO CA C 125 63.390 63.390 62.694 0.696 25281 2157 1 4 . 1 1 125 125 PRO CB C 125 31.210 31.210 32.105 -0.895 25281 2158 1 4 . 1 1 126 126 HIS N N 126 116.830 116.830 118.917 -2.087 25281 2159 1 4 . 1 1 126 126 HIS CA C 126 54.110 54.110 56.130 -2.020 25281 2160 1 4 . 1 1 126 126 HIS CB C 126 34.910 34.910 28.326 6.584 25281 2161 1 4 . 1 1 126 126 HIS H H 126 7.630 7.630 7.792 -0.162 25281 2162 1 4 . 1 1 127 127 PRO CA C 127 65.370 65.370 63.737 1.633 25281 2163 1 4 . 1 1 127 127 PRO CB C 127 31.030 31.030 30.965 0.065 25281 2164 1 4 . 1 1 128 128 ASN N N 128 114.680 114.680 117.392 -2.712 25281 2165 1 4 . 1 1 128 128 ASN CA C 128 53.990 53.990 53.306 0.684 25281 2166 1 4 . 1 1 128 128 ASN CB C 128 40.550 40.550 41.238 -0.688 25281 2167 1 4 . 1 1 128 128 ASN H H 128 10.460 10.460 8.248 2.212 25281 2168 1 4 . 1 1 129 129 PHE N N 129 119.630 119.630 118.467 1.163 25281 2169 1 4 . 1 1 129 129 PHE CA C 129 56.530 56.530 57.454 -0.924 25281 2170 1 4 . 1 1 129 129 PHE CB C 129 44.310 44.310 42.735 1.575 25281 2171 1 4 . 1 1 129 129 PHE H H 129 8.340 8.340 7.581 0.759 25281 2172 1 4 . 1 1 130 130 VAL N N 130 123.000 123.000 120.236 2.764 25281 2173 1 4 . 1 1 130 130 VAL CA C 130 60.340 60.340 61.063 -0.723 25281 2174 1 4 . 1 1 130 130 VAL CB C 130 34.970 34.970 35.278 -0.308 25281 2175 1 4 . 1 1 130 130 VAL H H 130 7.820 7.820 8.992 -1.172 25281 2176 1 4 . 1 1 131 131 ILE N N 131 124.470 124.470 126.459 -1.989 25281 2177 1 4 . 1 1 131 131 ILE CA C 131 60.210 60.210 59.263 0.947 25281 2178 1 4 . 1 1 131 131 ILE CB C 131 39.510 39.510 41.739 -2.229 25281 2179 1 4 . 1 1 131 131 ILE H H 131 8.830 8.830 8.894 -0.064 25281 2180 1 4 . 1 1 132 132 ASP N N 132 130.700 130.700 129.169 1.531 25281 2181 1 4 . 1 1 132 132 ASP CA C 132 53.530 53.530 53.051 0.479 25281 2182 1 4 . 1 1 132 132 ASP CB C 132 47.620 47.620 44.367 3.253 25281 2183 1 4 . 1 1 132 132 ASP H H 132 9.040 9.040 8.172 0.868 25281 2184 1 4 . 1 1 133 133 ALA N N 133 126.900 126.900 128.636 -1.736 25281 2185 1 4 . 1 1 133 133 ALA CA C 133 51.390 51.390 50.276 1.113 25281 2186 1 4 . 1 1 133 133 ALA CB C 133 21.730 21.730 22.181 -0.451 25281 2187 1 4 . 1 1 133 133 ALA H H 133 8.800 8.800 8.130 0.670 25281 2188 1 4 . 1 1 134 134 SER N N 134 113.760 113.760 117.007 -3.247 25281 2189 1 4 . 1 1 134 134 SER CA C 134 58.140 58.140 57.308 0.832 25281 2190 1 4 . 1 1 134 134 SER CB C 134 67.020 67.020 66.361 0.659 25281 2191 1 4 . 1 1 134 134 SER H H 134 9.160 9.160 8.112 1.048 25281 2192 1 4 . 1 1 135 135 TYR N N 135 118.500 118.500 115.557 2.943 25281 2193 1 4 . 1 1 135 135 TYR CA C 135 55.690 55.690 56.613 -0.923 25281 2194 1 4 . 1 1 135 135 TYR CB C 135 43.150 43.150 41.743 1.407 25281 2195 1 4 . 1 1 135 135 TYR H H 135 8.820 8.820 7.700 1.120 25281 2196 1 4 . 1 1 136 136 GLU N N 136 126.290 126.290 118.182 8.108 25281 2197 1 4 . 1 1 136 136 GLU CA C 136 53.530 53.530 55.050 -1.520 25281 2198 1 4 . 1 1 136 136 GLU CB C 136 34.450 34.450 33.982 0.468 25281 2199 1 4 . 1 1 136 136 GLU H H 136 8.380 8.380 9.123 -0.743 25281 2200 1 4 . 1 1 137 137 TYR N N 137 123.630 123.630 117.136 6.494 25281 2201 1 4 . 1 1 137 137 TYR CA C 137 55.670 55.670 56.106 -0.436 25281 2202 1 4 . 1 1 137 137 TYR CB C 137 43.150 43.150 41.274 1.876 25281 2203 1 4 . 1 1 137 137 TYR H H 137 9.300 9.300 8.385 0.915 25281 2204 1 4 . 1 1 138 138 SER N N 138 118.300 118.300 115.916 2.384 25281 2205 1 4 . 1 1 138 138 SER CA C 138 58.270 58.270 56.936 1.334 25281 2206 1 4 . 1 1 138 138 SER CB C 138 67.090 67.090 66.179 0.911 25281 2207 1 4 . 1 1 138 138 SER H H 138 7.980 7.980 8.697 -0.717 25281 2208 1 4 . 1 1 139 139 LYS N N 139 127.450 127.450 125.099 2.351 25281 2209 1 4 . 1 1 139 139 LYS CA C 139 55.160 55.160 55.950 -0.790 25281 2210 1 4 . 1 1 139 139 LYS CB C 139 32.640 32.640 33.418 -0.778 25281 2211 1 4 . 1 1 139 139 LYS H H 139 8.630 8.630 8.605 0.025 25281 2212 1 4 . 1 1 140 140 LEU N N 140 129.650 129.650 128.350 1.300 25281 2213 1 4 . 1 1 140 140 LEU CA C 140 52.500 52.500 53.822 -1.322 25281 2214 1 4 . 1 1 140 140 LEU CB C 140 40.000 40.000 44.478 -4.478 25281 2215 1 4 . 1 1 140 140 LEU H H 140 9.060 9.060 8.325 0.735 25281 2216 1 4 . 1 1 141 141 ASP N N 141 121.470 121.470 125.226 -3.756 25281 2217 1 4 . 1 1 141 141 ASP CA C 141 57.190 57.190 57.238 -0.048 25281 2218 1 4 . 1 1 141 141 ASP CB C 141 39.730 39.730 40.857 -1.127 25281 2219 1 4 . 1 1 141 141 ASP H H 141 8.590 8.590 8.846 -0.256 25281 2220 1 4 . 1 1 142 142 ASP N N 142 121.510 121.510 118.009 3.501 25281 2221 1 4 . 1 1 142 142 ASP CA C 142 55.180 55.180 55.353 -0.173 25281 2222 1 4 . 1 1 142 142 ASP CB C 142 41.090 41.090 41.324 -0.234 25281 2223 1 4 . 1 1 142 142 ASP H H 142 8.430 8.430 8.372 0.058 25281 2224 1 4 . 1 1 143 143 VAL N N 143 121.420 121.420 118.772 2.648 25281 2225 1 4 . 1 1 143 143 VAL CA C 143 62.240 62.240 60.429 1.810 25281 2226 1 4 . 1 1 143 143 VAL CB C 143 31.280 31.280 34.572 -3.292 25281 2227 1 4 . 1 1 143 143 VAL H H 143 8.020 8.020 7.476 0.544 25281 2228 1 4 . 1 1 144 144 LYS N N 144 127.950 127.950 125.900 2.050 25281 2229 1 4 . 1 1 144 144 LYS CA C 144 55.440 55.440 55.681 -0.241 25281 2230 1 4 . 1 1 144 144 LYS CB C 144 32.640 32.640 33.913 -1.273 25281 2231 1 4 . 1 1 144 144 LYS H H 144 8.660 8.660 8.391 0.269 25281 2232 1 4 . 1 1 145 145 VAL N N 145 124.120 124.120 124.208 -0.088 25281 2233 1 4 . 1 1 145 145 VAL CA C 145 55.910 55.910 59.549 -3.639 25281 2234 1 4 . 1 1 145 145 VAL CB C 145 32.570 32.570 35.969 -3.400 25281 2235 1 4 . 1 1 145 145 VAL H H 145 8.720 8.720 7.830 0.890 25281 2236 1 4 . 1 1 146 146 GLY N N 146 116.240 116.240 115.019 1.221 25281 2237 1 4 . 1 1 146 146 GLY CA C 146 44.080 44.080 44.375 -0.295 25281 2238 1 4 . 1 1 146 146 GLY H H 146 8.400 8.400 8.712 -0.312 25281 2239 1 4 . 1 1 147 147 THR N N 147 124.620 124.620 120.703 3.917 25281 2240 1 4 . 1 1 147 147 THR CA C 147 61.450 61.450 62.141 -0.691 25281 2241 1 4 . 1 1 147 147 THR CB C 147 70.260 70.260 70.903 -0.643 25281 2242 1 4 . 1 1 147 147 THR H H 147 9.080 9.080 9.190 -0.110 25281 2243 1 4 . 1 1 148 148 TRP N N 148 124.790 124.790 129.621 -4.831 25281 2244 1 4 . 1 1 148 148 TRP CA C 148 54.770 54.770 56.082 -1.312 25281 2245 1 4 . 1 1 148 148 TRP CB C 148 33.090 33.090 33.248 -0.158 25281 2246 1 4 . 1 1 148 148 TRP H H 148 8.510 8.510 9.095 -0.585 25281 2247 1 4 . 1 1 149 149 MET N N 149 118.880 118.880 125.113 -6.233 25281 2248 1 4 . 1 1 149 149 MET CA C 149 54.540 54.540 54.285 0.255 25281 2249 1 4 . 1 1 149 149 MET CB C 149 34.640 34.640 36.173 -1.533 25281 2250 1 4 . 1 1 149 149 MET H H 149 9.150 9.150 8.246 0.904 25281 2251 1 4 . 1 1 150 150 LEU N N 150 122.830 122.830 124.739 -1.909 25281 2252 1 4 . 1 1 150 150 LEU CA C 150 54.100 54.100 54.167 -0.067 25281 2253 1 4 . 1 1 150 150 LEU CB C 150 45.800 45.800 46.195 -0.395 25281 2254 1 4 . 1 1 150 150 LEU H H 150 8.480 8.480 8.071 0.409 25281 2255 1 4 . 1 1 151 151 GLY N N 151 112.730 112.730 111.643 1.087 25281 2256 1 4 . 1 1 151 151 GLY CA C 151 45.940 45.940 45.260 0.680 25281 2257 1 4 . 1 1 151 151 GLY H H 151 9.820 9.820 8.124 1.696 25281 2258 1 4 . 1 1 152 152 ALA N N 152 119.460 119.460 120.053 -0.593 25281 2259 1 4 . 1 1 152 152 ALA CA C 152 49.760 49.760 50.474 -0.714 25281 2260 1 4 . 1 1 152 152 ALA CB C 152 22.700 22.700 22.828 -0.128 25281 2261 1 4 . 1 1 152 152 ALA H H 152 8.840 8.840 8.949 -0.109 25281 2262 1 4 . 1 1 153 153 GLY N N 153 104.360 104.360 106.668 -2.308 25281 2263 1 4 . 1 1 153 153 GLY CA C 153 46.440 46.440 45.038 1.402 25281 2264 1 4 . 1 1 153 153 GLY H H 153 8.540 8.540 9.051 -0.511 25281 2265 1 4 . 1 1 154 154 TYR N N 154 120.680 120.680 114.957 5.723 25281 2266 1 4 . 1 1 154 154 TYR CA C 154 55.370 55.370 56.019 -0.649 25281 2267 1 4 . 1 1 154 154 TYR CB C 154 44.250 44.250 41.351 2.899 25281 2268 1 4 . 1 1 154 154 TYR H H 154 8.310 8.310 7.651 0.659 25281 2269 1 4 . 1 1 155 155 ARG N N 155 127.050 127.050 121.519 5.531 25281 2270 1 4 . 1 1 155 155 ARG CA C 155 53.480 53.480 55.278 -1.798 25281 2271 1 4 . 1 1 155 155 ARG CB C 155 32.160 32.160 30.870 1.290 25281 2272 1 4 . 1 1 155 155 ARG H H 155 7.640 7.640 8.257 -0.617 25281 2273 1 5 . 1 1 2 2 GLY N N 2 112.280 112.280 109.571 2.709 25281 2274 1 5 . 1 1 2 2 GLY CA C 2 44.830 44.830 44.961 -0.131 25281 2275 1 5 . 1 1 2 2 GLY H H 2 8.460 8.460 8.115 0.345 25281 2276 1 5 . 1 1 3 3 GLU N N 3 118.460 118.460 121.417 -2.957 25281 2277 1 5 . 1 1 3 3 GLU CA C 3 56.840 56.840 56.846 -0.006 25281 2278 1 5 . 1 1 3 3 GLU CB C 3 29.980 29.980 30.170 -0.190 25281 2279 1 5 . 1 1 3 3 GLU H H 3 7.630 7.630 8.099 -0.469 25281 2280 1 5 . 1 1 4 4 SER N N 4 119.000 119.000 118.430 0.570 25281 2281 1 5 . 1 1 4 4 SER CA C 4 57.280 57.280 57.276 0.004 25281 2282 1 5 . 1 1 4 4 SER CB C 4 65.860 65.860 66.402 -0.542 25281 2283 1 5 . 1 1 4 4 SER H H 4 8.820 8.820 8.278 0.542 25281 2284 1 5 . 1 1 5 5 SER N N 5 118.300 118.300 116.540 1.760 25281 2285 1 5 . 1 1 5 5 SER CA C 5 57.560 57.560 57.397 0.163 25281 2286 1 5 . 1 1 5 5 SER CB C 5 65.480 65.480 65.081 0.399 25281 2287 1 5 . 1 1 5 5 SER H H 5 8.700 8.700 7.965 0.735 25281 2288 1 5 . 1 1 6 6 ILE N N 6 123.240 123.240 120.402 2.838 25281 2289 1 5 . 1 1 6 6 ILE CA C 6 54.110 54.110 59.435 -5.325 25281 2290 1 5 . 1 1 6 6 ILE CB C 6 33.870 33.870 41.562 -7.692 25281 2291 1 5 . 1 1 6 6 ILE H H 6 9.080 9.080 7.874 1.206 25281 2292 1 5 . 1 1 7 7 SER N N 7 116.100 116.100 116.208 -0.108 25281 2293 1 5 . 1 1 7 7 SER CA C 7 57.130 57.130 57.537 -0.407 25281 2294 1 5 . 1 1 7 7 SER CB C 7 65.710 65.710 66.511 -0.801 25281 2295 1 5 . 1 1 7 7 SER H H 7 8.570 8.570 8.024 0.546 25281 2296 1 5 . 1 1 8 8 ILE N N 8 114.140 114.140 121.734 -7.594 25281 2297 1 5 . 1 1 8 8 ILE CA C 8 58.460 58.460 59.014 -0.554 25281 2298 1 5 . 1 1 8 8 ILE CB C 8 40.880 40.880 42.173 -1.293 25281 2299 1 5 . 1 1 8 8 ILE H H 8 8.300 8.300 8.091 0.209 25281 2300 1 5 . 1 1 9 9 GLY N N 9 109.200 109.200 111.680 -2.480 25281 2301 1 5 . 1 1 9 9 GLY CA C 9 45.550 45.550 45.549 0.001 25281 2302 1 5 . 1 1 9 9 GLY H H 9 9.060 9.060 7.787 1.273 25281 2303 1 5 . 1 1 10 10 TYR N N 10 121.410 121.410 119.032 2.378 25281 2304 1 5 . 1 1 10 10 TYR CA C 10 56.970 56.970 56.977 -0.007 25281 2305 1 5 . 1 1 10 10 TYR CB C 10 41.520 41.520 41.621 -0.101 25281 2306 1 5 . 1 1 10 10 TYR H H 10 8.870 8.870 7.969 0.901 25281 2307 1 5 . 1 1 11 11 ALA N N 11 125.250 125.250 124.340 0.910 25281 2308 1 5 . 1 1 11 11 ALA CA C 11 48.740 48.740 49.806 -1.066 25281 2309 1 5 . 1 1 11 11 ALA CB C 11 21.610 21.610 21.228 0.382 25281 2310 1 5 . 1 1 11 11 ALA H H 11 7.210 7.210 8.276 -1.066 25281 2311 1 5 . 1 1 12 12 GLN N N 12 119.180 119.180 123.654 -4.474 25281 2312 1 5 . 1 1 12 12 GLN CA C 12 54.690 54.690 54.818 -0.128 25281 2313 1 5 . 1 1 12 12 GLN CB C 12 32.000 32.000 31.836 0.164 25281 2314 1 5 . 1 1 12 12 GLN H H 12 8.330 8.330 8.638 -0.308 25281 2315 1 5 . 1 1 13 13 SER N N 13 122.790 122.790 119.167 3.623 25281 2316 1 5 . 1 1 13 13 SER CA C 13 57.780 57.780 57.125 0.655 25281 2317 1 5 . 1 1 13 13 SER CB C 13 64.540 64.540 66.680 -2.140 25281 2318 1 5 . 1 1 13 13 SER H H 13 8.610 8.610 8.429 0.181 25281 2319 1 5 . 1 1 14 14 ARG N N 14 121.140 121.140 121.559 -0.419 25281 2320 1 5 . 1 1 14 14 ARG CA C 14 54.960 54.960 55.224 -0.264 25281 2321 1 5 . 1 1 14 14 ARG CB C 14 32.370 32.370 34.132 -1.762 25281 2322 1 5 . 1 1 14 14 ARG H H 14 8.520 8.520 8.488 0.032 25281 2323 1 5 . 1 1 15 15 VAL N N 15 115.890 115.890 120.225 -4.335 25281 2324 1 5 . 1 1 15 15 VAL CA C 15 60.970 60.970 61.636 -0.666 25281 2325 1 5 . 1 1 15 15 VAL CB C 15 34.320 34.320 35.589 -1.269 25281 2326 1 5 . 1 1 15 15 VAL H H 15 8.440 8.440 8.721 -0.281 25281 2327 1 5 . 1 1 16 16 LYS N N 16 126.010 126.010 125.636 0.374 25281 2328 1 5 . 1 1 16 16 LYS CA C 16 55.120 55.120 56.106 -0.986 25281 2329 1 5 . 1 1 16 16 LYS CB C 16 34.350 34.350 32.862 1.488 25281 2330 1 5 . 1 1 16 16 LYS H H 16 8.850 8.850 8.589 0.261 25281 2331 1 5 . 1 1 17 17 GLU N N 17 119.140 119.140 124.560 -5.420 25281 2332 1 5 . 1 1 17 17 GLU CA C 17 54.460 54.460 55.100 -0.640 25281 2333 1 5 . 1 1 17 17 GLU CB C 17 33.430 33.430 32.675 0.755 25281 2334 1 5 . 1 1 17 17 GLU H H 17 8.030 8.030 8.402 -0.372 25281 2335 1 5 . 1 1 18 18 ASP N N 18 120.280 120.280 120.251 0.029 25281 2336 1 5 . 1 1 18 18 ASP CA C 18 56.500 56.500 53.587 2.913 25281 2337 1 5 . 1 1 18 18 ASP CB C 18 33.780 33.780 41.027 -7.247 25281 2338 1 5 . 1 1 18 18 ASP H H 18 8.120 8.120 8.331 -0.211 25281 2339 1 5 . 1 1 19 19 GLY N N 19 118.750 118.750 113.972 4.778 25281 2340 1 5 . 1 1 19 19 GLY CA C 19 44.130 44.130 45.115 -0.985 25281 2341 1 5 . 1 1 19 19 GLY H H 19 8.430 8.430 7.670 0.760 25281 2342 1 5 . 1 1 20 20 TYR N N 20 117.080 117.080 122.709 -5.629 25281 2343 1 5 . 1 1 20 20 TYR CA C 20 60.940 60.940 58.874 2.066 25281 2344 1 5 . 1 1 20 20 TYR CB C 20 42.010 42.010 38.270 3.740 25281 2345 1 5 . 1 1 20 20 TYR H H 20 8.610 8.610 8.533 0.077 25281 2346 1 5 . 1 1 21 21 LYS N N 21 127.240 127.240 123.653 3.587 25281 2347 1 5 . 1 1 21 21 LYS CA C 21 56.760 56.760 57.209 -0.449 25281 2348 1 5 . 1 1 21 21 LYS CB C 21 29.100 29.100 32.576 -3.476 25281 2349 1 5 . 1 1 21 21 LYS H H 21 7.970 7.970 8.648 -0.678 25281 2350 1 5 . 1 1 22 22 LEU N N 22 122.270 122.270 120.932 1.338 25281 2351 1 5 . 1 1 22 22 LEU CA C 22 59.170 59.170 57.905 1.265 25281 2352 1 5 . 1 1 22 22 LEU CB C 22 40.030 40.030 41.828 -1.798 25281 2353 1 5 . 1 1 22 22 LEU H H 22 8.370 8.370 8.005 0.365 25281 2354 1 5 . 1 1 23 23 ASP N N 23 114.790 114.790 114.727 0.063 25281 2355 1 5 . 1 1 23 23 ASP CA C 23 51.840 51.840 53.979 -2.139 25281 2356 1 5 . 1 1 23 23 ASP CB C 23 37.730 37.730 41.298 -3.568 25281 2357 1 5 . 1 1 23 23 ASP H H 23 8.210 8.210 8.378 -0.168 25281 2358 1 5 . 1 1 24 24 LYS N N 24 115.470 115.470 115.191 0.279 25281 2359 1 5 . 1 1 24 24 LYS CA C 24 58.860 58.860 57.346 1.514 25281 2360 1 5 . 1 1 24 24 LYS CB C 24 28.330 28.330 31.164 -2.834 25281 2361 1 5 . 1 1 24 24 LYS H H 24 9.230 9.230 7.752 1.478 25281 2362 1 5 . 1 1 25 25 ASN N N 25 121.610 121.610 117.774 3.836 25281 2363 1 5 . 1 1 25 25 ASN CA C 25 54.430 54.430 49.809 4.622 25281 2364 1 5 . 1 1 25 25 ASN CB C 25 42.500 42.500 39.048 3.452 25281 2365 1 5 . 1 1 25 25 ASN H H 25 8.150 8.150 7.882 0.268 25281 2366 1 5 . 1 1 26 26 PRO CA C 26 63.340 63.340 62.676 0.664 25281 2367 1 5 . 1 1 26 26 PRO CB C 26 30.940 30.940 32.993 -2.053 25281 2368 1 5 . 1 1 27 27 ARG N N 27 120.730 120.730 118.496 2.234 25281 2369 1 5 . 1 1 27 27 ARG CA C 27 54.340 54.340 54.602 -0.262 25281 2370 1 5 . 1 1 27 27 ARG CB C 27 33.500 33.500 32.258 1.242 25281 2371 1 5 . 1 1 27 27 ARG H H 27 8.290 8.290 7.961 0.329 25281 2372 1 5 . 1 1 28 28 GLY N N 28 112.000 112.000 107.032 4.968 25281 2373 1 5 . 1 1 28 28 GLY CA C 28 46.940 46.940 45.149 1.791 25281 2374 1 5 . 1 1 28 28 GLY H H 28 8.810 8.810 7.737 1.073 25281 2375 1 5 . 1 1 29 29 PHE N N 29 121.230 121.230 117.788 3.442 25281 2376 1 5 . 1 1 29 29 PHE CA C 29 55.230 55.230 56.869 -1.639 25281 2377 1 5 . 1 1 29 29 PHE CB C 29 43.700 43.700 42.907 0.793 25281 2378 1 5 . 1 1 29 29 PHE H H 29 8.470 8.470 8.072 0.398 25281 2379 1 5 . 1 1 30 30 ASN N N 30 117.250 117.250 121.407 -4.157 25281 2380 1 5 . 1 1 30 30 ASN CA C 30 50.220 50.220 52.664 -2.444 25281 2381 1 5 . 1 1 30 30 ASN CB C 30 45.810 45.810 41.178 4.632 25281 2382 1 5 . 1 1 30 30 ASN H H 30 8.630 8.630 8.439 0.191 25281 2383 1 5 . 1 1 31 31 LEU N N 31 128.180 128.180 126.523 1.657 25281 2384 1 5 . 1 1 31 31 LEU CA C 31 53.930 53.930 53.455 0.475 25281 2385 1 5 . 1 1 31 31 LEU CB C 31 45.810 45.810 45.014 0.796 25281 2386 1 5 . 1 1 31 31 LEU H H 31 9.080 9.080 9.256 -0.176 25281 2387 1 5 . 1 1 32 32 LYS N N 32 119.980 119.980 122.471 -2.491 25281 2388 1 5 . 1 1 32 32 LYS CA C 32 55.730 55.730 54.684 1.046 25281 2389 1 5 . 1 1 32 32 LYS CB C 32 36.070 36.070 36.594 -0.524 25281 2390 1 5 . 1 1 32 32 LYS H H 32 8.780 8.780 7.917 0.863 25281 2391 1 5 . 1 1 33 33 TYR N N 33 121.500 121.500 120.224 1.276 25281 2392 1 5 . 1 1 33 33 TYR CA C 33 55.830 55.830 57.036 -1.206 25281 2393 1 5 . 1 1 33 33 TYR CB C 33 42.110 42.110 42.432 -0.322 25281 2394 1 5 . 1 1 33 33 TYR H H 33 8.640 8.640 8.412 0.228 25281 2395 1 5 . 1 1 34 34 ARG N N 34 128.980 128.980 119.953 9.027 25281 2396 1 5 . 1 1 34 34 ARG CA C 34 52.690 52.690 54.774 -2.084 25281 2397 1 5 . 1 1 34 34 ARG CB C 34 34.320 34.320 33.585 0.735 25281 2398 1 5 . 1 1 34 34 ARG H H 34 8.830 8.830 8.524 0.306 25281 2399 1 5 . 1 1 35 35 TYR N N 35 124.820 124.820 121.536 3.284 25281 2400 1 5 . 1 1 35 35 TYR CA C 35 56.640 56.640 56.882 -0.242 25281 2401 1 5 . 1 1 35 35 TYR CB C 35 41.980 41.980 42.475 -0.495 25281 2402 1 5 . 1 1 35 35 TYR H H 35 8.840 8.840 8.144 0.696 25281 2403 1 5 . 1 1 39 39 ASN N N 39 127.690 127.690 117.684 10.006 25281 2404 1 5 . 1 1 39 39 ASN CA C 39 54.850 54.850 53.423 1.427 25281 2405 1 5 . 1 1 39 39 ASN CB C 39 38.290 38.290 38.403 -0.113 25281 2406 1 5 . 1 1 39 39 ASN H H 39 7.990 7.990 8.333 -0.343 25281 2407 1 5 . 1 1 40 40 ASP N N 40 115.200 115.200 119.166 -3.966 25281 2408 1 5 . 1 1 40 40 ASP CA C 40 55.210 55.210 53.230 1.980 25281 2409 1 5 . 1 1 40 40 ASP CB C 40 44.010 44.010 42.121 1.889 25281 2410 1 5 . 1 1 40 40 ASP H H 40 8.370 8.370 7.867 0.503 25281 2411 1 5 . 1 1 41 41 TRP N N 41 124.210 124.210 118.978 5.232 25281 2412 1 5 . 1 1 41 41 TRP CA C 41 55.840 55.840 56.355 -0.515 25281 2413 1 5 . 1 1 41 41 TRP CB C 41 33.540 33.540 29.974 3.566 25281 2414 1 5 . 1 1 41 41 TRP H H 41 9.130 9.130 7.971 1.159 25281 2415 1 5 . 1 1 42 42 GLY N N 42 107.800 107.800 107.721 0.079 25281 2416 1 5 . 1 1 42 42 GLY CA C 42 45.870 45.870 44.105 1.765 25281 2417 1 5 . 1 1 42 42 GLY H H 42 8.610 8.610 8.096 0.514 25281 2418 1 5 . 1 1 43 43 VAL N N 43 116.260 116.260 114.733 1.527 25281 2419 1 5 . 1 1 43 43 VAL CA C 43 58.980 58.980 60.201 -1.221 25281 2420 1 5 . 1 1 43 43 VAL CB C 43 35.430 35.430 34.835 0.595 25281 2421 1 5 . 1 1 43 43 VAL H H 43 8.880 8.880 7.701 1.179 25281 2422 1 5 . 1 1 44 44 ILE N N 44 124.720 124.720 116.896 7.824 25281 2423 1 5 . 1 1 44 44 ILE CA C 44 58.390 58.390 58.721 -0.331 25281 2424 1 5 . 1 1 44 44 ILE CB C 44 42.890 42.890 41.948 0.942 25281 2425 1 5 . 1 1 44 44 ILE H H 44 9.110 9.110 8.037 1.073 25281 2426 1 5 . 1 1 45 45 GLY N N 45 110.610 110.610 108.306 2.304 25281 2427 1 5 . 1 1 45 45 GLY CA C 45 43.150 43.150 44.559 -1.409 25281 2428 1 5 . 1 1 45 45 GLY H H 45 8.910 8.910 8.199 0.711 25281 2429 1 5 . 1 1 46 46 SER N N 46 116.210 116.210 117.614 -1.404 25281 2430 1 5 . 1 1 46 46 SER CA C 46 56.250 56.250 57.049 -0.799 25281 2431 1 5 . 1 1 46 46 SER CB C 46 63.720 63.720 65.260 -1.540 25281 2432 1 5 . 1 1 46 46 SER H H 46 9.250 9.250 8.777 0.473 25281 2433 1 5 . 1 1 47 47 PHE N N 47 126.400 126.400 125.156 1.244 25281 2434 1 5 . 1 1 47 47 PHE CA C 47 55.090 55.090 56.587 -1.497 25281 2435 1 5 . 1 1 47 47 PHE CB C 47 42.560 42.560 42.003 0.557 25281 2436 1 5 . 1 1 47 47 PHE H H 47 8.940 8.940 9.379 -0.439 25281 2437 1 5 . 1 1 48 48 ALA N N 48 131.930 131.930 125.204 6.726 25281 2438 1 5 . 1 1 48 48 ALA CA C 48 50.350 50.350 51.166 -0.816 25281 2439 1 5 . 1 1 48 48 ALA CB C 48 21.280 21.280 23.331 -2.051 25281 2440 1 5 . 1 1 48 48 ALA H H 48 8.790 8.790 8.545 0.245 25281 2441 1 5 . 1 1 49 49 GLN N N 49 116.070 116.070 118.476 -2.406 25281 2442 1 5 . 1 1 49 49 GLN CA C 49 54.110 54.110 54.428 -0.319 25281 2443 1 5 . 1 1 49 49 GLN CB C 49 31.140 31.140 32.707 -1.567 25281 2444 1 5 . 1 1 49 49 GLN H H 49 7.720 7.720 8.393 -0.673 25281 2445 1 5 . 1 1 50 50 THR N N 50 115.990 115.990 111.314 4.676 25281 2446 1 5 . 1 1 50 50 THR CA C 50 59.270 59.270 59.814 -0.544 25281 2447 1 5 . 1 1 50 50 THR CB C 50 70.980 70.980 72.037 -1.058 25281 2448 1 5 . 1 1 50 50 THR H H 50 9.470 9.470 8.682 0.788 25281 2449 1 5 . 1 1 51 51 ARG N N 51 117.600 117.600 119.959 -2.359 25281 2450 1 5 . 1 1 51 51 ARG CA C 51 55.350 55.350 54.960 0.390 25281 2451 1 5 . 1 1 51 51 ARG CB C 51 33.610 33.610 35.026 -1.416 25281 2452 1 5 . 1 1 51 51 ARG H H 51 8.600 8.600 8.552 0.048 25281 2453 1 5 . 1 1 52 52 ARG N N 52 121.400 121.400 123.176 -1.776 25281 2454 1 5 . 1 1 52 52 ARG CA C 52 56.910 56.910 55.991 0.919 25281 2455 1 5 . 1 1 52 52 ARG CB C 52 29.370 29.370 31.446 -2.076 25281 2456 1 5 . 1 1 52 52 ARG H H 52 8.380 8.380 8.180 0.200 25281 2457 1 5 . 1 1 53 53 GLY N N 53 111.040 111.040 114.155 -3.115 25281 2458 1 5 . 1 1 53 53 GLY CA C 53 45.190 45.190 45.213 -0.023 25281 2459 1 5 . 1 1 53 53 GLY H H 53 8.330 8.330 8.983 -0.653 25281 2460 1 5 . 1 1 54 54 PHE N N 54 119.210 119.210 123.229 -4.019 25281 2461 1 5 . 1 1 54 54 PHE CA C 54 55.670 55.670 58.963 -3.293 25281 2462 1 5 . 1 1 54 54 PHE CB C 54 29.220 29.220 37.733 -8.513 25281 2463 1 5 . 1 1 54 54 PHE H H 54 7.720 7.720 7.903 -0.183 25281 2464 1 5 . 1 1 55 55 GLU N N 55 123.470 123.470 126.270 -2.800 25281 2465 1 5 . 1 1 55 55 GLU CA C 55 55.580 55.580 55.114 0.466 25281 2466 1 5 . 1 1 55 55 GLU CB C 55 32.920 32.920 32.451 0.469 25281 2467 1 5 . 1 1 55 55 GLU H H 55 8.400 8.400 8.162 0.238 25281 2468 1 5 . 1 1 56 56 GLU N N 56 121.950 121.950 124.736 -2.786 25281 2469 1 5 . 1 1 56 56 GLU CA C 56 56.690 56.690 56.785 -0.095 25281 2470 1 5 . 1 1 56 56 GLU CB C 56 29.450 29.450 29.488 -0.038 25281 2471 1 5 . 1 1 56 56 GLU H H 56 8.500 8.500 8.344 0.156 25281 2472 1 5 . 1 1 57 57 SER N N 57 123.330 123.330 119.496 3.834 25281 2473 1 5 . 1 1 57 57 SER CA C 57 55.090 55.090 57.477 -2.388 25281 2474 1 5 . 1 1 57 57 SER CB C 57 64.890 64.890 64.735 0.155 25281 2475 1 5 . 1 1 57 57 SER H H 57 8.640 8.640 8.296 0.344 25281 2476 1 5 . 1 1 58 58 VAL N N 58 122.060 122.060 121.642 0.418 25281 2477 1 5 . 1 1 58 58 VAL CA C 58 57.660 57.660 62.126 -4.465 25281 2478 1 5 . 1 1 58 58 VAL CB C 58 31.640 31.640 33.102 -1.462 25281 2479 1 5 . 1 1 58 58 VAL H H 58 8.480 8.480 8.462 0.018 25281 2480 1 5 . 1 1 59 59 ASP N N 59 123.390 123.390 127.153 -3.763 25281 2481 1 5 . 1 1 59 59 ASP CA C 59 54.960 54.960 53.849 1.111 25281 2482 1 5 . 1 1 59 59 ASP CB C 59 42.840 42.840 41.458 1.382 25281 2483 1 5 . 1 1 59 59 ASP H H 59 9.360 9.360 8.597 0.763 25281 2484 1 5 . 1 1 60 60 GLY N N 60 105.230 105.230 108.886 -3.656 25281 2485 1 5 . 1 1 60 60 GLY CA C 60 45.130 45.130 44.677 0.453 25281 2486 1 5 . 1 1 60 60 GLY H H 60 8.210 8.210 8.006 0.204 25281 2487 1 5 . 1 1 61 61 PHE N N 61 121.440 121.440 124.651 -3.211 25281 2488 1 5 . 1 1 61 61 PHE CA C 61 57.330 57.330 57.890 -0.560 25281 2489 1 5 . 1 1 61 61 PHE CB C 61 39.420 39.420 38.697 0.723 25281 2490 1 5 . 1 1 61 61 PHE H H 61 8.330 8.330 8.419 -0.089 25281 2491 1 5 . 1 1 62 62 LYS N N 62 119.870 119.870 126.078 -6.208 25281 2492 1 5 . 1 1 62 62 LYS CA C 62 56.340 56.340 54.115 2.225 25281 2493 1 5 . 1 1 62 62 LYS CB C 62 33.850 33.850 35.091 -1.241 25281 2494 1 5 . 1 1 62 62 LYS H H 62 8.480 8.480 7.800 0.680 25281 2495 1 5 . 1 1 63 63 LEU N N 63 125.160 125.160 122.643 2.517 25281 2496 1 5 . 1 1 63 63 LEU CA C 63 56.220 56.220 57.678 -1.458 25281 2497 1 5 . 1 1 63 63 LEU CB C 63 41.520 41.520 41.376 0.144 25281 2498 1 5 . 1 1 63 63 LEU H H 63 8.910 8.910 8.552 0.358 25281 2499 1 5 . 1 1 64 64 ILE N N 64 119.660 119.660 115.088 4.572 25281 2500 1 5 . 1 1 64 64 ILE CA C 64 62.420 62.420 63.582 -1.162 25281 2501 1 5 . 1 1 64 64 ILE CB C 64 37.700 37.700 36.743 0.957 25281 2502 1 5 . 1 1 64 64 ILE H H 64 8.210 8.210 7.950 0.260 25281 2503 1 5 . 1 1 65 65 ASP N N 65 117.080 117.080 122.262 -5.182 25281 2504 1 5 . 1 1 65 65 ASP CA C 65 57.420 57.420 55.438 1.982 25281 2505 1 5 . 1 1 65 65 ASP CB C 65 38.350 38.350 39.614 -1.264 25281 2506 1 5 . 1 1 65 65 ASP H H 65 7.710 7.710 7.637 0.073 25281 2507 1 5 . 1 1 66 66 GLY N N 66 106.440 106.440 108.195 -1.755 25281 2508 1 5 . 1 1 66 66 GLY CA C 66 45.170 45.170 44.969 0.201 25281 2509 1 5 . 1 1 66 66 GLY H H 66 7.920 7.920 7.583 0.337 25281 2510 1 5 . 1 1 67 67 ASP N N 67 118.490 118.490 119.117 -0.627 25281 2511 1 5 . 1 1 67 67 ASP CA C 67 57.340 57.340 55.303 2.037 25281 2512 1 5 . 1 1 67 67 ASP CB C 67 29.870 29.870 40.850 -10.980 25281 2513 1 5 . 1 1 67 67 ASP H H 67 7.820 7.820 7.627 0.193 25281 2514 1 5 . 1 1 68 68 PHE N N 68 125.320 125.320 117.501 7.819 25281 2515 1 5 . 1 1 68 68 PHE CA C 68 56.090 56.090 57.284 -1.194 25281 2516 1 5 . 1 1 68 68 PHE CB C 68 41.940 41.940 42.917 -0.977 25281 2517 1 5 . 1 1 68 68 PHE H H 68 8.310 8.310 8.607 -0.297 25281 2518 1 5 . 1 1 69 69 LYS N N 69 124.770 124.770 120.398 4.372 25281 2519 1 5 . 1 1 69 69 LYS CA C 69 54.880 54.880 55.212 -0.332 25281 2520 1 5 . 1 1 69 69 LYS CB C 69 36.920 36.920 36.454 0.466 25281 2521 1 5 . 1 1 69 69 LYS H H 69 8.730 8.730 8.512 0.218 25281 2522 1 5 . 1 1 70 70 TYR N N 70 123.740 123.740 123.548 0.192 25281 2523 1 5 . 1 1 70 70 TYR CA C 70 55.540 55.540 56.481 -0.941 25281 2524 1 5 . 1 1 70 70 TYR CB C 70 40.150 40.150 42.130 -1.980 25281 2525 1 5 . 1 1 70 70 TYR H H 70 8.680 8.680 7.994 0.686 25281 2526 1 5 . 1 1 71 71 TYR N N 71 123.920 123.920 125.891 -1.971 25281 2527 1 5 . 1 1 71 71 TYR CA C 71 54.500 54.500 56.014 -1.514 25281 2528 1 5 . 1 1 71 71 TYR CB C 71 42.420 42.420 41.967 0.453 25281 2529 1 5 . 1 1 71 71 TYR H H 71 8.620 8.620 8.494 0.126 25281 2530 1 5 . 1 1 72 72 SER N N 72 113.820 113.820 115.712 -1.892 25281 2531 1 5 . 1 1 72 72 SER CA C 72 56.320 56.320 57.593 -1.274 25281 2532 1 5 . 1 1 72 72 SER CB C 72 65.790 65.790 66.710 -0.920 25281 2533 1 5 . 1 1 72 72 SER H H 72 8.800 8.800 8.747 0.053 25281 2534 1 5 . 1 1 73 73 VAL N N 73 119.260 119.260 124.231 -4.971 25281 2535 1 5 . 1 1 73 73 VAL CA C 73 60.730 60.730 60.148 0.583 25281 2536 1 5 . 1 1 73 73 VAL CB C 73 33.870 33.870 34.876 -1.006 25281 2537 1 5 . 1 1 73 73 VAL H H 73 8.170 8.170 8.144 0.026 25281 2538 1 5 . 1 1 74 74 THR N N 74 115.360 115.360 119.032 -3.672 25281 2539 1 5 . 1 1 74 74 THR CA C 74 59.040 59.040 59.798 -0.758 25281 2540 1 5 . 1 1 74 74 THR CB C 74 73.250 73.250 72.204 1.046 25281 2541 1 5 . 1 1 74 74 THR H H 74 9.200 9.200 8.116 1.084 25281 2542 1 5 . 1 1 75 75 ALA N N 75 119.330 119.330 122.023 -2.693 25281 2543 1 5 . 1 1 75 75 ALA CA C 75 51.390 51.390 51.602 -0.213 25281 2544 1 5 . 1 1 75 75 ALA CB C 75 22.380 22.380 22.084 0.296 25281 2545 1 5 . 1 1 75 75 ALA H H 75 9.130 9.130 8.817 0.313 25281 2546 1 5 . 1 1 76 76 GLY N N 76 103.130 103.130 106.673 -3.543 25281 2547 1 5 . 1 1 76 76 GLY CA C 76 45.900 45.900 44.814 1.086 25281 2548 1 5 . 1 1 76 76 GLY H H 76 8.760 8.760 8.009 0.751 25281 2549 1 5 . 1 1 77 77 PRO CA C 77 61.250 61.250 62.307 -1.058 25281 2550 1 5 . 1 1 77 77 PRO CB C 77 32.590 32.590 33.562 -0.972 25281 2551 1 5 . 1 1 78 78 VAL N N 78 115.250 115.250 118.326 -3.076 25281 2552 1 5 . 1 1 78 78 VAL CA C 78 58.430 58.430 60.343 -1.913 25281 2553 1 5 . 1 1 78 78 VAL CB C 78 32.700 32.700 34.467 -1.767 25281 2554 1 5 . 1 1 78 78 VAL H H 78 8.240 8.240 7.583 0.657 25281 2555 1 5 . 1 1 79 79 PHE N N 79 130.610 130.610 125.979 4.631 25281 2556 1 5 . 1 1 79 79 PHE CA C 79 55.090 55.090 56.398 -1.308 25281 2557 1 5 . 1 1 79 79 PHE CB C 79 41.590 41.590 42.757 -1.167 25281 2558 1 5 . 1 1 79 79 PHE H H 79 9.540 9.540 8.534 1.006 25281 2559 1 5 . 1 1 80 80 ARG N N 80 130.350 130.350 123.813 6.537 25281 2560 1 5 . 1 1 80 80 ARG CA C 80 55.490 55.490 56.855 -1.365 25281 2561 1 5 . 1 1 80 80 ARG CB C 80 29.520 29.520 30.654 -1.134 25281 2562 1 5 . 1 1 80 80 ARG H H 80 8.810 8.810 8.758 0.052 25281 2563 1 5 . 1 1 81 81 ILE N N 81 127.480 127.480 123.427 4.053 25281 2564 1 5 . 1 1 81 81 ILE CA C 81 62.850 62.850 62.283 0.567 25281 2565 1 5 . 1 1 81 81 ILE CB C 81 37.650 37.650 39.076 -1.426 25281 2566 1 5 . 1 1 81 81 ILE H H 81 8.260 8.260 9.142 -0.882 25281 2567 1 5 . 1 1 82 82 ASN N N 82 113.110 113.110 117.452 -4.342 25281 2568 1 5 . 1 1 82 82 ASN CA C 82 55.630 55.630 52.178 3.452 25281 2569 1 5 . 1 1 82 82 ASN CB C 82 43.210 43.210 39.698 3.512 25281 2570 1 5 . 1 1 82 82 ASN H H 82 7.970 7.970 7.777 0.193 25281 2571 1 5 . 1 1 85 85 VAL N N 85 118.090 118.090 120.837 -2.747 25281 2572 1 5 . 1 1 85 85 VAL CA C 85 61.120 61.120 61.127 -0.007 25281 2573 1 5 . 1 1 85 85 VAL CB C 85 34.910 34.910 35.337 -0.427 25281 2574 1 5 . 1 1 85 85 VAL H H 85 7.840 7.840 7.166 0.674 25281 2575 1 5 . 1 1 86 86 SER N N 86 119.050 119.050 120.626 -1.576 25281 2576 1 5 . 1 1 86 86 SER CA C 86 57.100 57.100 56.663 0.437 25281 2577 1 5 . 1 1 86 86 SER CB C 86 65.400 65.400 66.864 -1.464 25281 2578 1 5 . 1 1 86 86 SER H H 86 8.240 8.240 8.076 0.164 25281 2579 1 5 . 1 1 87 87 LEU N N 87 124.640 124.640 123.023 1.617 25281 2580 1 5 . 1 1 87 87 LEU CA C 87 53.750 53.750 54.423 -0.673 25281 2581 1 5 . 1 1 87 87 LEU CB C 87 46.320 46.320 45.896 0.424 25281 2582 1 5 . 1 1 87 87 LEU H H 87 9.130 9.130 8.240 0.890 25281 2583 1 5 . 1 1 88 88 TYR N N 88 118.740 118.740 122.762 -4.022 25281 2584 1 5 . 1 1 88 88 TYR CA C 88 55.080 55.080 55.885 -0.805 25281 2585 1 5 . 1 1 88 88 TYR CB C 88 42.630 42.630 41.087 1.543 25281 2586 1 5 . 1 1 88 88 TYR H H 88 8.740 8.740 8.078 0.662 25281 2587 1 5 . 1 1 89 89 GLY N N 89 103.920 103.920 106.676 -2.756 25281 2588 1 5 . 1 1 89 89 GLY CA C 89 43.250 43.250 43.587 -0.337 25281 2589 1 5 . 1 1 89 89 GLY H H 89 7.720 7.720 8.357 -0.637 25281 2590 1 5 . 1 1 90 90 LEU N N 90 117.530 117.530 122.222 -4.692 25281 2591 1 5 . 1 1 90 90 LEU CA C 90 53.200 53.200 53.475 -0.275 25281 2592 1 5 . 1 1 90 90 LEU CB C 90 45.810 45.810 42.908 2.902 25281 2593 1 5 . 1 1 90 90 LEU H H 90 8.520 8.520 7.800 0.720 25281 2594 1 5 . 1 1 91 91 LEU N N 91 120.670 120.670 120.975 -0.305 25281 2595 1 5 . 1 1 91 91 LEU CA C 91 53.590 53.590 53.596 -0.006 25281 2596 1 5 . 1 1 91 91 LEU CB C 91 46.330 46.330 45.475 0.855 25281 2597 1 5 . 1 1 91 91 LEU H H 91 9.250 9.250 8.005 1.245 25281 2598 1 5 . 1 1 92 92 GLY N N 92 108.770 108.770 109.624 -0.854 25281 2599 1 5 . 1 1 92 92 GLY CA C 92 46.520 46.520 46.302 0.218 25281 2600 1 5 . 1 1 92 92 GLY H H 92 8.480 8.480 8.601 -0.121 25281 2601 1 5 . 1 1 93 93 ALA N N 93 126.760 126.760 120.699 6.061 25281 2602 1 5 . 1 1 93 93 ALA CA C 93 49.890 49.890 51.368 -1.478 25281 2603 1 5 . 1 1 93 93 ALA CB C 93 21.860 21.860 22.477 -0.617 25281 2604 1 5 . 1 1 93 93 ALA H H 93 8.860 8.860 7.830 1.030 25281 2605 1 5 . 1 1 94 94 GLY N N 94 107.510 107.510 106.729 0.781 25281 2606 1 5 . 1 1 94 94 GLY CA C 94 42.760 42.760 44.393 -1.633 25281 2607 1 5 . 1 1 94 94 GLY H H 94 8.880 8.880 8.172 0.708 25281 2608 1 5 . 1 1 95 95 HIS N N 95 122.340 122.340 117.595 4.745 25281 2609 1 5 . 1 1 95 95 HIS CA C 95 54.570 54.570 53.967 0.603 25281 2610 1 5 . 1 1 95 95 HIS CB C 95 32.700 32.700 33.185 -0.485 25281 2611 1 5 . 1 1 95 95 HIS H H 95 9.200 9.200 8.602 0.598 25281 2612 1 5 . 1 1 96 96 GLY N N 96 112.170 112.170 105.738 6.432 25281 2613 1 5 . 1 1 96 96 GLY CA C 96 43.150 43.150 44.725 -1.575 25281 2614 1 5 . 1 1 96 96 GLY H H 96 8.620 8.620 8.283 0.337 25281 2615 1 5 . 1 1 97 97 LYS N N 97 120.580 120.580 119.394 1.186 25281 2616 1 5 . 1 1 97 97 LYS CA C 97 54.890 54.890 55.135 -0.245 25281 2617 1 5 . 1 1 97 97 LYS CB C 97 35.560 35.560 36.889 -1.329 25281 2618 1 5 . 1 1 97 97 LYS H H 97 9.010 9.010 8.437 0.573 25281 2619 1 5 . 1 1 98 98 ALA N N 98 126.740 126.740 123.949 2.791 25281 2620 1 5 . 1 1 98 98 ALA CA C 98 50.020 50.020 50.643 -0.623 25281 2621 1 5 . 1 1 98 98 ALA CB C 98 22.380 22.380 22.377 0.003 25281 2622 1 5 . 1 1 98 98 ALA H H 98 9.120 9.120 8.490 0.630 25281 2623 1 5 . 1 1 99 99 LYS N N 99 122.360 122.360 120.491 1.869 25281 2624 1 5 . 1 1 99 99 LYS CA C 99 55.090 55.090 55.365 -0.275 25281 2625 1 5 . 1 1 99 99 LYS CB C 99 34.970 34.970 35.068 -0.098 25281 2626 1 5 . 1 1 99 99 LYS H H 99 8.580 8.580 8.412 0.168 25281 2627 1 5 . 1 1 100 100 PHE N N 100 121.170 121.170 121.343 -0.173 25281 2628 1 5 . 1 1 100 100 PHE CA C 100 56.390 56.390 57.970 -1.580 25281 2629 1 5 . 1 1 100 100 PHE CB C 100 42.110 42.110 40.418 1.692 25281 2630 1 5 . 1 1 100 100 PHE H H 100 8.750 8.750 8.213 0.537 25281 2631 1 5 . 1 1 101 101 SER N N 101 117.280 117.280 116.310 0.970 25281 2632 1 5 . 1 1 101 101 SER CA C 101 57.070 57.070 57.693 -0.623 25281 2633 1 5 . 1 1 101 101 SER CB C 101 65.830 65.830 64.311 1.519 25281 2634 1 5 . 1 1 101 101 SER H H 101 8.990 8.990 8.174 0.816 25281 2635 1 5 . 1 1 102 102 SER N N 102 117.600 117.600 116.886 0.714 25281 2636 1 5 . 1 1 102 102 SER CA C 102 56.500 56.500 58.436 -1.936 25281 2637 1 5 . 1 1 102 102 SER CB C 102 67.540 67.540 63.376 4.165 25281 2638 1 5 . 1 1 102 102 SER H H 102 8.680 8.680 8.403 0.277 25281 2639 1 5 . 1 1 103 103 ILE N N 103 114.980 114.980 120.241 -5.261 25281 2640 1 5 . 1 1 103 103 ILE CA C 103 59.180 59.180 59.874 -0.694 25281 2641 1 5 . 1 1 103 103 ILE CB C 103 40.550 40.550 40.295 0.254 25281 2642 1 5 . 1 1 103 103 ILE H H 103 7.700 7.700 8.082 -0.382 25281 2643 1 5 . 1 1 104 104 PHE N N 104 123.710 123.710 121.626 2.084 25281 2644 1 5 . 1 1 104 104 PHE CA C 104 53.190 53.190 58.104 -4.914 25281 2645 1 5 . 1 1 104 104 PHE CB C 104 43.900 43.900 39.476 4.424 25281 2646 1 5 . 1 1 104 104 PHE H H 104 8.590 8.590 8.622 -0.032 25281 2647 1 5 . 1 1 105 105 GLY N N 105 109.080 109.080 112.032 -2.952 25281 2648 1 5 . 1 1 105 105 GLY CA C 105 45.420 45.420 44.399 1.021 25281 2649 1 5 . 1 1 105 105 GLY H H 105 8.400 8.400 8.429 -0.029 25281 2650 1 5 . 1 1 106 106 GLN N N 106 119.680 119.680 120.197 -0.517 25281 2651 1 5 . 1 1 106 106 GLN CA C 106 53.720 53.720 55.695 -1.975 25281 2652 1 5 . 1 1 106 106 GLN CB C 106 30.100 30.100 29.774 0.326 25281 2653 1 5 . 1 1 106 106 GLN H H 106 8.530 8.530 8.377 0.153 25281 2654 1 5 . 1 1 107 107 SER N N 107 119.160 119.160 117.587 1.573 25281 2655 1 5 . 1 1 107 107 SER CA C 107 57.360 57.360 58.231 -0.871 25281 2656 1 5 . 1 1 107 107 SER CB C 107 66.050 66.050 64.081 1.969 25281 2657 1 5 . 1 1 107 107 SER H H 107 8.800 8.800 8.376 0.424 25281 2658 1 5 . 1 1 108 108 GLU N N 108 125.360 125.360 121.627 3.733 25281 2659 1 5 . 1 1 108 108 GLU CA C 108 58.910 58.910 55.129 3.781 25281 2660 1 5 . 1 1 108 108 GLU CB C 108 40.880 40.880 31.271 9.609 25281 2661 1 5 . 1 1 108 108 GLU H H 108 8.960 8.960 8.451 0.509 25281 2662 1 5 . 1 1 109 109 SER N N 109 118.890 118.890 116.839 2.051 25281 2663 1 5 . 1 1 109 109 SER CA C 109 56.710 56.710 57.354 -0.644 25281 2664 1 5 . 1 1 109 109 SER CB C 109 66.180 66.180 65.860 0.320 25281 2665 1 5 . 1 1 109 109 SER H H 109 9.080 9.080 8.350 0.730 25281 2666 1 5 . 1 1 110 110 ARG N N 110 119.830 119.830 118.420 1.410 25281 2667 1 5 . 1 1 110 110 ARG CA C 110 58.390 58.390 55.486 2.904 25281 2668 1 5 . 1 1 110 110 ARG CB C 110 40.940 40.940 33.522 7.418 25281 2669 1 5 . 1 1 110 110 ARG H H 110 8.850 8.850 8.547 0.303 25281 2670 1 5 . 1 1 111 111 SER N N 111 114.870 114.870 115.452 -0.582 25281 2671 1 5 . 1 1 111 111 SER CA C 111 57.290 57.290 57.087 0.203 25281 2672 1 5 . 1 1 111 111 SER CB C 111 66.110 66.110 66.809 -0.699 25281 2673 1 5 . 1 1 111 111 SER H H 111 8.740 8.740 8.444 0.296 25281 2674 1 5 . 1 1 112 112 LYS N N 112 120.870 120.870 120.910 -0.040 25281 2675 1 5 . 1 1 112 112 LYS CA C 112 55.150 55.150 55.609 -0.459 25281 2676 1 5 . 1 1 112 112 LYS CB C 112 36.330 36.330 35.996 0.334 25281 2677 1 5 . 1 1 112 112 LYS H H 112 8.520 8.520 8.541 -0.021 25281 2678 1 5 . 1 1 113 113 THR N N 113 121.390 121.390 117.853 3.537 25281 2679 1 5 . 1 1 113 113 THR CA C 113 61.250 61.250 61.955 -0.705 25281 2680 1 5 . 1 1 113 113 THR CB C 113 70.010 70.010 70.158 -0.148 25281 2681 1 5 . 1 1 113 113 THR H H 113 8.440 8.440 8.506 -0.066 25281 2682 1 5 . 1 1 114 114 SER N N 114 120.730 120.730 121.062 -0.332 25281 2683 1 5 . 1 1 114 114 SER CA C 114 56.190 56.190 57.500 -1.310 25281 2684 1 5 . 1 1 114 114 SER CB C 114 66.380 66.380 66.687 -0.307 25281 2685 1 5 . 1 1 114 114 SER H H 114 9.350 9.350 8.407 0.943 25281 2686 1 5 . 1 1 115 115 LEU N N 115 121.540 121.540 122.400 -0.860 25281 2687 1 5 . 1 1 115 115 LEU CA C 115 55.480 55.480 54.192 1.288 25281 2688 1 5 . 1 1 115 115 LEU CB C 115 42.890 42.890 44.063 -1.173 25281 2689 1 5 . 1 1 115 115 LEU H H 115 8.200 8.200 8.862 -0.662 25281 2690 1 5 . 1 1 116 116 ALA N N 116 129.060 129.060 123.996 5.064 25281 2691 1 5 . 1 1 116 116 ALA CA C 116 49.960 49.960 50.049 -0.089 25281 2692 1 5 . 1 1 116 116 ALA CB C 116 20.310 20.310 22.529 -2.220 25281 2693 1 5 . 1 1 116 116 ALA H H 116 8.600 8.600 8.768 -0.168 25281 2694 1 5 . 1 1 117 117 TYR N N 117 115.890 115.890 118.618 -2.728 25281 2695 1 5 . 1 1 117 117 TYR CA C 117 55.150 55.150 55.984 -0.834 25281 2696 1 5 . 1 1 117 117 TYR CB C 117 41.200 41.200 41.431 -0.231 25281 2697 1 5 . 1 1 117 117 TYR H H 117 8.450 8.450 7.803 0.647 25281 2698 1 5 . 1 1 118 118 GLY N N 118 107.330 107.330 106.525 0.805 25281 2699 1 5 . 1 1 118 118 GLY CA C 118 45.940 45.940 45.762 0.178 25281 2700 1 5 . 1 1 118 118 GLY H H 118 9.340 9.340 8.065 1.275 25281 2701 1 5 . 1 1 119 119 ALA N N 119 118.880 118.880 119.933 -1.053 25281 2702 1 5 . 1 1 119 119 ALA CA C 119 51.320 51.320 50.720 0.600 25281 2703 1 5 . 1 1 119 119 ALA CB C 119 22.120 22.120 22.361 -0.241 25281 2704 1 5 . 1 1 119 119 ALA H H 119 8.770 8.770 7.030 1.740 25281 2705 1 5 . 1 1 120 120 GLY N N 120 105.730 105.730 105.969 -0.239 25281 2706 1 5 . 1 1 120 120 GLY CA C 120 45.650 45.650 44.557 1.093 25281 2707 1 5 . 1 1 120 120 GLY H H 120 7.940 7.940 7.769 0.171 25281 2708 1 5 . 1 1 121 121 LEU N N 121 115.480 115.480 114.513 0.967 25281 2709 1 5 . 1 1 121 121 LEU CA C 121 52.980 52.980 53.399 -0.419 25281 2710 1 5 . 1 1 121 121 LEU CB C 121 46.460 46.460 46.125 0.335 25281 2711 1 5 . 1 1 121 121 LEU H H 121 9.010 9.010 8.575 0.435 25281 2712 1 5 . 1 1 122 122 GLN N N 122 112.530 112.530 119.569 -7.039 25281 2713 1 5 . 1 1 122 122 GLN CA C 122 54.780 54.780 55.061 -0.281 25281 2714 1 5 . 1 1 122 122 GLN CB C 122 31.400 31.400 33.328 -1.927 25281 2715 1 5 . 1 1 122 122 GLN H H 122 8.090 8.090 8.087 0.003 25281 2716 1 5 . 1 1 123 123 PHE N N 123 126.050 126.050 124.139 1.911 25281 2717 1 5 . 1 1 123 123 PHE CA C 123 54.180 54.180 55.839 -1.659 25281 2718 1 5 . 1 1 123 123 PHE CB C 123 42.560 42.560 42.928 -0.368 25281 2719 1 5 . 1 1 123 123 PHE H H 123 10.020 10.020 8.741 1.279 25281 2720 1 5 . 1 1 124 124 ASN N N 124 121.910 121.910 120.489 1.421 25281 2721 1 5 . 1 1 124 124 ASN CA C 124 50.940 50.940 50.289 0.650 25281 2722 1 5 . 1 1 124 124 ASN CB C 124 40.360 40.360 38.798 1.562 25281 2723 1 5 . 1 1 124 124 ASN H H 124 9.520 9.520 8.433 1.087 25281 2724 1 5 . 1 1 125 125 PRO CA C 125 63.390 63.390 63.076 0.314 25281 2725 1 5 . 1 1 125 125 PRO CB C 125 31.210 31.210 32.252 -1.042 25281 2726 1 5 . 1 1 126 126 HIS N N 126 116.830 116.830 117.178 -0.348 25281 2727 1 5 . 1 1 126 126 HIS CA C 126 54.110 54.110 56.054 -1.944 25281 2728 1 5 . 1 1 126 126 HIS CB C 126 34.910 34.910 28.545 6.365 25281 2729 1 5 . 1 1 126 126 HIS H H 126 7.630 7.630 8.362 -0.732 25281 2730 1 5 . 1 1 127 127 PRO CA C 127 65.370 65.370 65.246 0.124 25281 2731 1 5 . 1 1 127 127 PRO CB C 127 31.030 31.030 31.971 -0.941 25281 2732 1 5 . 1 1 128 128 ASN N N 128 114.680 114.680 114.763 -0.083 25281 2733 1 5 . 1 1 128 128 ASN CA C 128 53.990 53.990 55.419 -1.429 25281 2734 1 5 . 1 1 128 128 ASN CB C 128 40.550 40.550 38.952 1.598 25281 2735 1 5 . 1 1 128 128 ASN H H 128 10.460 10.460 8.451 2.009 25281 2736 1 5 . 1 1 129 129 PHE N N 129 119.630 119.630 116.371 3.259 25281 2737 1 5 . 1 1 129 129 PHE CA C 129 56.530 56.530 57.094 -0.565 25281 2738 1 5 . 1 1 129 129 PHE CB C 129 44.310 44.310 42.912 1.398 25281 2739 1 5 . 1 1 129 129 PHE H H 129 8.340 8.340 8.176 0.164 25281 2740 1 5 . 1 1 130 130 VAL N N 130 123.000 123.000 120.670 2.330 25281 2741 1 5 . 1 1 130 130 VAL CA C 130 60.340 60.340 61.287 -0.947 25281 2742 1 5 . 1 1 130 130 VAL CB C 130 34.970 34.970 35.284 -0.314 25281 2743 1 5 . 1 1 130 130 VAL H H 130 7.820 7.820 8.263 -0.443 25281 2744 1 5 . 1 1 131 131 ILE N N 131 124.470 124.470 127.733 -3.263 25281 2745 1 5 . 1 1 131 131 ILE CA C 131 60.210 60.210 60.574 -0.364 25281 2746 1 5 . 1 1 131 131 ILE CB C 131 39.510 39.510 40.241 -0.731 25281 2747 1 5 . 1 1 131 131 ILE H H 131 8.830 8.830 9.064 -0.234 25281 2748 1 5 . 1 1 132 132 ASP N N 132 130.700 130.700 127.824 2.876 25281 2749 1 5 . 1 1 132 132 ASP CA C 132 53.530 53.530 53.203 0.327 25281 2750 1 5 . 1 1 132 132 ASP CB C 132 47.620 47.620 44.672 2.948 25281 2751 1 5 . 1 1 132 132 ASP H H 132 9.040 9.040 8.698 0.342 25281 2752 1 5 . 1 1 133 133 ALA N N 133 126.900 126.900 125.763 1.137 25281 2753 1 5 . 1 1 133 133 ALA CA C 133 51.390 51.390 51.082 0.308 25281 2754 1 5 . 1 1 133 133 ALA CB C 133 21.730 21.730 22.759 -1.029 25281 2755 1 5 . 1 1 133 133 ALA H H 133 8.800 8.800 8.327 0.473 25281 2756 1 5 . 1 1 134 134 SER N N 134 113.760 113.760 118.022 -4.262 25281 2757 1 5 . 1 1 134 134 SER CA C 134 58.140 58.140 57.531 0.609 25281 2758 1 5 . 1 1 134 134 SER CB C 134 67.020 67.020 66.454 0.566 25281 2759 1 5 . 1 1 134 134 SER H H 134 9.160 9.160 8.737 0.423 25281 2760 1 5 . 1 1 135 135 TYR N N 135 118.500 118.500 116.028 2.472 25281 2761 1 5 . 1 1 135 135 TYR CA C 135 55.690 55.690 56.188 -0.498 25281 2762 1 5 . 1 1 135 135 TYR CB C 135 43.150 43.150 41.179 1.971 25281 2763 1 5 . 1 1 135 135 TYR H H 135 8.820 8.820 7.834 0.986 25281 2764 1 5 . 1 1 136 136 GLU N N 136 126.290 126.290 116.763 9.527 25281 2765 1 5 . 1 1 136 136 GLU CA C 136 53.530 53.530 54.725 -1.196 25281 2766 1 5 . 1 1 136 136 GLU CB C 136 34.450 34.450 33.608 0.842 25281 2767 1 5 . 1 1 136 136 GLU H H 136 8.380 8.380 8.099 0.281 25281 2768 1 5 . 1 1 137 137 TYR N N 137 123.630 123.630 118.315 5.315 25281 2769 1 5 . 1 1 137 137 TYR CA C 137 55.670 55.670 56.351 -0.681 25281 2770 1 5 . 1 1 137 137 TYR CB C 137 43.150 43.150 42.653 0.497 25281 2771 1 5 . 1 1 137 137 TYR H H 137 9.300 9.300 8.286 1.014 25281 2772 1 5 . 1 1 138 138 SER N N 138 118.300 118.300 115.952 2.348 25281 2773 1 5 . 1 1 138 138 SER CA C 138 58.270 58.270 56.539 1.731 25281 2774 1 5 . 1 1 138 138 SER CB C 138 67.090 67.090 65.256 1.834 25281 2775 1 5 . 1 1 138 138 SER H H 138 7.980 7.980 9.060 -1.080 25281 2776 1 5 . 1 1 139 139 LYS N N 139 127.450 127.450 128.921 -1.471 25281 2777 1 5 . 1 1 139 139 LYS CA C 139 55.160 55.160 55.921 -0.761 25281 2778 1 5 . 1 1 139 139 LYS CB C 139 32.640 32.640 33.208 -0.568 25281 2779 1 5 . 1 1 139 139 LYS H H 139 8.630 8.630 8.438 0.192 25281 2780 1 5 . 1 1 140 140 LEU N N 140 129.650 129.650 126.897 2.753 25281 2781 1 5 . 1 1 140 140 LEU CA C 140 52.500 52.500 53.764 -1.264 25281 2782 1 5 . 1 1 140 140 LEU CB C 140 40.000 40.000 44.741 -4.741 25281 2783 1 5 . 1 1 140 140 LEU H H 140 9.060 9.060 8.031 1.029 25281 2784 1 5 . 1 1 141 141 ASP N N 141 121.470 121.470 123.316 -1.846 25281 2785 1 5 . 1 1 141 141 ASP CA C 141 57.190 57.190 57.154 0.036 25281 2786 1 5 . 1 1 141 141 ASP CB C 141 39.730 39.730 41.038 -1.308 25281 2787 1 5 . 1 1 141 141 ASP H H 141 8.590 8.590 8.686 -0.096 25281 2788 1 5 . 1 1 142 142 ASP N N 142 121.510 121.510 118.468 3.042 25281 2789 1 5 . 1 1 142 142 ASP CA C 142 55.180 55.180 55.193 -0.013 25281 2790 1 5 . 1 1 142 142 ASP CB C 142 41.090 41.090 41.260 -0.170 25281 2791 1 5 . 1 1 142 142 ASP H H 142 8.430 8.430 8.350 0.080 25281 2792 1 5 . 1 1 143 143 VAL N N 143 121.420 121.420 113.064 8.356 25281 2793 1 5 . 1 1 143 143 VAL CA C 143 62.240 62.240 60.187 2.053 25281 2794 1 5 . 1 1 143 143 VAL CB C 143 31.280 31.280 34.672 -3.392 25281 2795 1 5 . 1 1 143 143 VAL H H 143 8.020 8.020 7.473 0.547 25281 2796 1 5 . 1 1 144 144 LYS N N 144 127.950 127.950 122.294 5.656 25281 2797 1 5 . 1 1 144 144 LYS CA C 144 55.440 55.440 55.816 -0.376 25281 2798 1 5 . 1 1 144 144 LYS CB C 144 32.640 32.640 33.937 -1.297 25281 2799 1 5 . 1 1 144 144 LYS H H 144 8.660 8.660 8.298 0.362 25281 2800 1 5 . 1 1 145 145 VAL N N 145 124.120 124.120 123.657 0.463 25281 2801 1 5 . 1 1 145 145 VAL CA C 145 55.910 55.910 60.435 -4.525 25281 2802 1 5 . 1 1 145 145 VAL CB C 145 32.570 32.570 34.407 -1.837 25281 2803 1 5 . 1 1 145 145 VAL H H 145 8.720 8.720 7.885 0.835 25281 2804 1 5 . 1 1 146 146 GLY N N 146 116.240 116.240 113.754 2.486 25281 2805 1 5 . 1 1 146 146 GLY CA C 146 44.080 44.080 44.003 0.077 25281 2806 1 5 . 1 1 146 146 GLY H H 146 8.400 8.400 8.298 0.102 25281 2807 1 5 . 1 1 147 147 THR N N 147 124.620 124.620 115.648 8.972 25281 2808 1 5 . 1 1 147 147 THR CA C 147 61.450 61.450 59.744 1.706 25281 2809 1 5 . 1 1 147 147 THR CB C 147 70.260 70.260 71.685 -1.425 25281 2810 1 5 . 1 1 147 147 THR H H 147 9.080 9.080 8.329 0.751 25281 2811 1 5 . 1 1 148 148 TRP N N 148 124.790 124.790 124.995 -0.205 25281 2812 1 5 . 1 1 148 148 TRP CA C 148 54.770 54.770 56.102 -1.332 25281 2813 1 5 . 1 1 148 148 TRP CB C 148 33.090 33.090 33.031 0.059 25281 2814 1 5 . 1 1 148 148 TRP H H 148 8.510 8.510 9.176 -0.666 25281 2815 1 5 . 1 1 149 149 MET N N 149 118.880 118.880 121.136 -2.256 25281 2816 1 5 . 1 1 149 149 MET CA C 149 54.540 54.540 55.068 -0.528 25281 2817 1 5 . 1 1 149 149 MET CB C 149 34.640 34.640 35.059 -0.419 25281 2818 1 5 . 1 1 149 149 MET H H 149 9.150 9.150 9.131 0.019 25281 2819 1 5 . 1 1 150 150 LEU N N 150 122.830 122.830 123.862 -1.032 25281 2820 1 5 . 1 1 150 150 LEU CA C 150 54.100 54.100 53.480 0.620 25281 2821 1 5 . 1 1 150 150 LEU CB C 150 45.800 45.800 44.999 0.801 25281 2822 1 5 . 1 1 150 150 LEU H H 150 8.480 8.480 8.042 0.438 25281 2823 1 5 . 1 1 151 151 GLY N N 151 112.730 112.730 109.388 3.342 25281 2824 1 5 . 1 1 151 151 GLY CA C 151 45.940 45.940 46.126 -0.186 25281 2825 1 5 . 1 1 151 151 GLY H H 151 9.820 9.820 8.194 1.626 25281 2826 1 5 . 1 1 152 152 ALA N N 152 119.460 119.460 120.071 -0.611 25281 2827 1 5 . 1 1 152 152 ALA CA C 152 49.760 49.760 50.769 -1.009 25281 2828 1 5 . 1 1 152 152 ALA CB C 152 22.700 22.700 22.829 -0.129 25281 2829 1 5 . 1 1 152 152 ALA H H 152 8.840 8.840 7.926 0.914 25281 2830 1 5 . 1 1 153 153 GLY N N 153 104.360 104.360 107.034 -2.674 25281 2831 1 5 . 1 1 153 153 GLY CA C 153 46.440 46.440 43.681 2.759 25281 2832 1 5 . 1 1 153 153 GLY H H 153 8.540 8.540 8.010 0.530 25281 2833 1 5 . 1 1 154 154 TYR N N 154 120.680 120.680 116.384 4.296 25281 2834 1 5 . 1 1 154 154 TYR CA C 154 55.370 55.370 57.173 -1.803 25281 2835 1 5 . 1 1 154 154 TYR CB C 154 44.250 44.250 42.077 2.173 25281 2836 1 5 . 1 1 154 154 TYR H H 154 8.310 8.310 7.790 0.520 25281 2837 1 5 . 1 1 155 155 ARG N N 155 127.050 127.050 121.006 6.044 25281 2838 1 5 . 1 1 155 155 ARG CA C 155 53.480 53.480 54.700 -1.220 25281 2839 1 5 . 1 1 155 155 ARG CB C 155 32.160 32.160 30.941 1.219 25281 2840 1 5 . 1 1 155 155 ARG H H 155 7.640 7.640 8.912 -1.272 25281 2841 1 6 . 1 1 2 2 GLY N N 2 112.280 112.280 108.799 3.481 25281 2842 1 6 . 1 1 2 2 GLY CA C 2 44.830 44.830 44.662 0.168 25281 2843 1 6 . 1 1 2 2 GLY H H 2 8.460 8.460 8.315 0.145 25281 2844 1 6 . 1 1 3 3 GLU N N 3 118.460 118.460 122.024 -3.564 25281 2845 1 6 . 1 1 3 3 GLU CA C 3 56.840 56.840 57.336 -0.496 25281 2846 1 6 . 1 1 3 3 GLU CB C 3 29.980 29.980 30.797 -0.817 25281 2847 1 6 . 1 1 3 3 GLU H H 3 7.630 7.630 8.181 -0.551 25281 2848 1 6 . 1 1 4 4 SER N N 4 119.000 119.000 118.566 0.434 25281 2849 1 6 . 1 1 4 4 SER CA C 4 57.280 57.280 57.358 -0.078 25281 2850 1 6 . 1 1 4 4 SER CB C 4 65.860 65.860 66.192 -0.332 25281 2851 1 6 . 1 1 4 4 SER H H 4 8.820 8.820 8.674 0.146 25281 2852 1 6 . 1 1 5 5 SER N N 5 118.300 118.300 116.638 1.662 25281 2853 1 6 . 1 1 5 5 SER CA C 5 57.560 57.560 56.925 0.635 25281 2854 1 6 . 1 1 5 5 SER CB C 5 65.480 65.480 66.553 -1.073 25281 2855 1 6 . 1 1 5 5 SER H H 5 8.700 8.700 8.429 0.271 25281 2856 1 6 . 1 1 6 6 ILE N N 6 123.240 123.240 121.051 2.189 25281 2857 1 6 . 1 1 6 6 ILE CA C 6 54.110 54.110 60.100 -5.990 25281 2858 1 6 . 1 1 6 6 ILE CB C 6 33.870 33.870 42.122 -8.252 25281 2859 1 6 . 1 1 6 6 ILE H H 6 9.080 9.080 7.539 1.541 25281 2860 1 6 . 1 1 7 7 SER N N 7 116.100 116.100 120.590 -4.490 25281 2861 1 6 . 1 1 7 7 SER CA C 7 57.130 57.130 57.203 -0.073 25281 2862 1 6 . 1 1 7 7 SER CB C 7 65.710 65.710 66.677 -0.966 25281 2863 1 6 . 1 1 7 7 SER H H 7 8.570 8.570 8.233 0.337 25281 2864 1 6 . 1 1 8 8 ILE N N 8 114.140 114.140 120.512 -6.372 25281 2865 1 6 . 1 1 8 8 ILE CA C 8 58.460 58.460 59.321 -0.861 25281 2866 1 6 . 1 1 8 8 ILE CB C 8 40.880 40.880 42.175 -1.294 25281 2867 1 6 . 1 1 8 8 ILE H H 8 8.300 8.300 8.641 -0.341 25281 2868 1 6 . 1 1 9 9 GLY N N 9 109.200 109.200 111.677 -2.477 25281 2869 1 6 . 1 1 9 9 GLY CA C 9 45.550 45.550 45.285 0.265 25281 2870 1 6 . 1 1 9 9 GLY H H 9 9.060 9.060 7.889 1.171 25281 2871 1 6 . 1 1 10 10 TYR N N 10 121.410 121.410 119.267 2.143 25281 2872 1 6 . 1 1 10 10 TYR CA C 10 56.970 56.970 57.286 -0.316 25281 2873 1 6 . 1 1 10 10 TYR CB C 10 41.520 41.520 41.090 0.430 25281 2874 1 6 . 1 1 10 10 TYR H H 10 8.870 8.870 8.392 0.478 25281 2875 1 6 . 1 1 11 11 ALA N N 11 125.250 125.250 125.518 -0.268 25281 2876 1 6 . 1 1 11 11 ALA CA C 11 48.740 48.740 50.261 -1.521 25281 2877 1 6 . 1 1 11 11 ALA CB C 11 21.610 21.610 21.252 0.358 25281 2878 1 6 . 1 1 11 11 ALA H H 11 7.210 7.210 8.322 -1.112 25281 2879 1 6 . 1 1 12 12 GLN N N 12 119.180 119.180 122.780 -3.600 25281 2880 1 6 . 1 1 12 12 GLN CA C 12 54.690 54.690 54.754 -0.064 25281 2881 1 6 . 1 1 12 12 GLN CB C 12 32.000 32.000 33.463 -1.463 25281 2882 1 6 . 1 1 12 12 GLN H H 12 8.330 8.330 8.170 0.160 25281 2883 1 6 . 1 1 13 13 SER N N 13 122.790 122.790 118.971 3.819 25281 2884 1 6 . 1 1 13 13 SER CA C 13 57.780 57.780 56.789 0.991 25281 2885 1 6 . 1 1 13 13 SER CB C 13 64.540 64.540 64.487 0.053 25281 2886 1 6 . 1 1 13 13 SER H H 13 8.610 8.610 8.726 -0.116 25281 2887 1 6 . 1 1 14 14 ARG N N 14 121.140 121.140 127.932 -6.792 25281 2888 1 6 . 1 1 14 14 ARG CA C 14 54.960 54.960 55.450 -0.490 25281 2889 1 6 . 1 1 14 14 ARG CB C 14 32.370 32.370 32.388 -0.018 25281 2890 1 6 . 1 1 14 14 ARG H H 14 8.520 8.520 8.492 0.028 25281 2891 1 6 . 1 1 15 15 VAL N N 15 115.890 115.890 122.509 -6.619 25281 2892 1 6 . 1 1 15 15 VAL CA C 15 60.970 60.970 61.407 -0.437 25281 2893 1 6 . 1 1 15 15 VAL CB C 15 34.320 34.320 35.306 -0.987 25281 2894 1 6 . 1 1 15 15 VAL H H 15 8.440 8.440 7.910 0.530 25281 2895 1 6 . 1 1 16 16 LYS N N 16 126.010 126.010 125.622 0.388 25281 2896 1 6 . 1 1 16 16 LYS CA C 16 55.120 55.120 56.225 -1.105 25281 2897 1 6 . 1 1 16 16 LYS CB C 16 34.350 34.350 33.002 1.348 25281 2898 1 6 . 1 1 16 16 LYS H H 16 8.850 8.850 8.686 0.164 25281 2899 1 6 . 1 1 17 17 GLU N N 17 119.140 119.140 123.197 -4.057 25281 2900 1 6 . 1 1 17 17 GLU CA C 17 54.460 54.460 54.779 -0.319 25281 2901 1 6 . 1 1 17 17 GLU CB C 17 33.430 33.430 33.175 0.255 25281 2902 1 6 . 1 1 17 17 GLU H H 17 8.030 8.030 8.484 -0.454 25281 2903 1 6 . 1 1 18 18 ASP N N 18 120.280 120.280 119.969 0.311 25281 2904 1 6 . 1 1 18 18 ASP CA C 18 56.500 56.500 54.804 1.696 25281 2905 1 6 . 1 1 18 18 ASP CB C 18 33.780 33.780 41.493 -7.713 25281 2906 1 6 . 1 1 18 18 ASP H H 18 8.120 8.120 8.514 -0.394 25281 2907 1 6 . 1 1 19 19 GLY N N 19 118.750 118.750 110.437 8.313 25281 2908 1 6 . 1 1 19 19 GLY CA C 19 44.130 44.130 44.643 -0.513 25281 2909 1 6 . 1 1 19 19 GLY H H 19 8.430 8.430 8.324 0.106 25281 2910 1 6 . 1 1 20 20 TYR N N 20 117.080 117.080 124.612 -7.532 25281 2911 1 6 . 1 1 20 20 TYR CA C 20 60.940 60.940 57.755 3.185 25281 2912 1 6 . 1 1 20 20 TYR CB C 20 42.010 42.010 37.872 4.138 25281 2913 1 6 . 1 1 20 20 TYR H H 20 8.610 8.610 8.661 -0.051 25281 2914 1 6 . 1 1 21 21 LYS N N 21 127.240 127.240 122.771 4.469 25281 2915 1 6 . 1 1 21 21 LYS CA C 21 56.760 56.760 56.491 0.269 25281 2916 1 6 . 1 1 21 21 LYS CB C 21 29.100 29.100 32.498 -3.398 25281 2917 1 6 . 1 1 21 21 LYS H H 21 7.970 7.970 8.482 -0.512 25281 2918 1 6 . 1 1 22 22 LEU N N 22 122.270 122.270 120.315 1.955 25281 2919 1 6 . 1 1 22 22 LEU CA C 22 59.170 59.170 56.775 2.395 25281 2920 1 6 . 1 1 22 22 LEU CB C 22 40.030 40.030 41.667 -1.637 25281 2921 1 6 . 1 1 22 22 LEU H H 22 8.370 8.370 7.828 0.542 25281 2922 1 6 . 1 1 23 23 ASP N N 23 114.790 114.790 115.494 -0.704 25281 2923 1 6 . 1 1 23 23 ASP CA C 23 51.840 51.840 53.791 -1.951 25281 2924 1 6 . 1 1 23 23 ASP CB C 23 37.730 37.730 41.197 -3.467 25281 2925 1 6 . 1 1 23 23 ASP H H 23 8.210 8.210 8.141 0.069 25281 2926 1 6 . 1 1 24 24 LYS N N 24 115.470 115.470 115.439 0.031 25281 2927 1 6 . 1 1 24 24 LYS CA C 24 58.860 58.860 57.634 1.226 25281 2928 1 6 . 1 1 24 24 LYS CB C 24 28.330 28.330 31.214 -2.884 25281 2929 1 6 . 1 1 24 24 LYS H H 24 9.230 9.230 7.699 1.531 25281 2930 1 6 . 1 1 25 25 ASN N N 25 121.610 121.610 115.498 6.112 25281 2931 1 6 . 1 1 25 25 ASN CA C 25 54.430 54.430 50.138 4.293 25281 2932 1 6 . 1 1 25 25 ASN CB C 25 42.500 42.500 39.238 3.262 25281 2933 1 6 . 1 1 25 25 ASN H H 25 8.150 8.150 8.064 0.086 25281 2934 1 6 . 1 1 26 26 PRO CA C 26 63.340 63.340 62.550 0.790 25281 2935 1 6 . 1 1 26 26 PRO CB C 26 30.940 30.940 33.265 -2.325 25281 2936 1 6 . 1 1 27 27 ARG N N 27 120.730 120.730 117.814 2.916 25281 2937 1 6 . 1 1 27 27 ARG CA C 27 54.340 54.340 55.384 -1.044 25281 2938 1 6 . 1 1 27 27 ARG CB C 27 33.500 33.500 32.573 0.927 25281 2939 1 6 . 1 1 27 27 ARG H H 27 8.290 8.290 7.941 0.349 25281 2940 1 6 . 1 1 28 28 GLY N N 28 112.000 112.000 109.758 2.242 25281 2941 1 6 . 1 1 28 28 GLY CA C 28 46.940 46.940 44.973 1.967 25281 2942 1 6 . 1 1 28 28 GLY H H 28 8.810 8.810 7.761 1.049 25281 2943 1 6 . 1 1 29 29 PHE N N 29 121.230 121.230 116.746 4.484 25281 2944 1 6 . 1 1 29 29 PHE CA C 29 55.230 55.230 56.934 -1.704 25281 2945 1 6 . 1 1 29 29 PHE CB C 29 43.700 43.700 43.612 0.088 25281 2946 1 6 . 1 1 29 29 PHE H H 29 8.470 8.470 8.280 0.190 25281 2947 1 6 . 1 1 30 30 ASN N N 30 117.250 117.250 120.215 -2.965 25281 2948 1 6 . 1 1 30 30 ASN CA C 30 50.220 50.220 52.593 -2.373 25281 2949 1 6 . 1 1 30 30 ASN CB C 30 45.810 45.810 41.653 4.157 25281 2950 1 6 . 1 1 30 30 ASN H H 30 8.630 8.630 8.484 0.146 25281 2951 1 6 . 1 1 31 31 LEU N N 31 128.180 128.180 127.917 0.263 25281 2952 1 6 . 1 1 31 31 LEU CA C 31 53.930 53.930 53.893 0.037 25281 2953 1 6 . 1 1 31 31 LEU CB C 31 45.810 45.810 45.309 0.501 25281 2954 1 6 . 1 1 31 31 LEU H H 31 9.080 9.080 8.417 0.663 25281 2955 1 6 . 1 1 32 32 LYS N N 32 119.980 119.980 126.489 -6.509 25281 2956 1 6 . 1 1 32 32 LYS CA C 32 55.730 55.730 54.710 1.020 25281 2957 1 6 . 1 1 32 32 LYS CB C 32 36.070 36.070 35.532 0.538 25281 2958 1 6 . 1 1 32 32 LYS H H 32 8.780 8.780 8.136 0.644 25281 2959 1 6 . 1 1 33 33 TYR N N 33 121.500 121.500 124.673 -3.173 25281 2960 1 6 . 1 1 33 33 TYR CA C 33 55.830 55.830 56.877 -1.048 25281 2961 1 6 . 1 1 33 33 TYR CB C 33 42.110 42.110 42.445 -0.335 25281 2962 1 6 . 1 1 33 33 TYR H H 33 8.640 8.640 8.295 0.345 25281 2963 1 6 . 1 1 34 34 ARG N N 34 128.980 128.980 129.048 -0.068 25281 2964 1 6 . 1 1 34 34 ARG CA C 34 52.690 52.690 54.171 -1.481 25281 2965 1 6 . 1 1 34 34 ARG CB C 34 34.320 34.320 34.179 0.141 25281 2966 1 6 . 1 1 34 34 ARG H H 34 8.830 8.830 7.744 1.086 25281 2967 1 6 . 1 1 35 35 TYR N N 35 124.820 124.820 128.157 -3.337 25281 2968 1 6 . 1 1 35 35 TYR CA C 35 56.640 56.640 56.552 0.088 25281 2969 1 6 . 1 1 35 35 TYR CB C 35 41.980 41.980 42.052 -0.072 25281 2970 1 6 . 1 1 35 35 TYR H H 35 8.840 8.840 8.099 0.741 25281 2971 1 6 . 1 1 39 39 ASN N N 39 127.690 127.690 120.966 6.724 25281 2972 1 6 . 1 1 39 39 ASN CA C 39 54.850 54.850 54.341 0.509 25281 2973 1 6 . 1 1 39 39 ASN CB C 39 38.290 38.290 37.898 0.392 25281 2974 1 6 . 1 1 39 39 ASN H H 39 7.990 7.990 8.781 -0.791 25281 2975 1 6 . 1 1 40 40 ASP N N 40 115.200 115.200 117.018 -1.818 25281 2976 1 6 . 1 1 40 40 ASP CA C 40 55.210 55.210 52.774 2.436 25281 2977 1 6 . 1 1 40 40 ASP CB C 40 44.010 44.010 41.933 2.077 25281 2978 1 6 . 1 1 40 40 ASP H H 40 8.370 8.370 7.683 0.687 25281 2979 1 6 . 1 1 41 41 TRP N N 41 124.210 124.210 120.750 3.460 25281 2980 1 6 . 1 1 41 41 TRP CA C 41 55.840 55.840 56.057 -0.217 25281 2981 1 6 . 1 1 41 41 TRP CB C 41 33.540 33.540 29.874 3.666 25281 2982 1 6 . 1 1 41 41 TRP H H 41 9.130 9.130 7.735 1.395 25281 2983 1 6 . 1 1 42 42 GLY N N 42 107.800 107.800 109.072 -1.272 25281 2984 1 6 . 1 1 42 42 GLY CA C 42 45.870 45.870 43.864 2.006 25281 2985 1 6 . 1 1 42 42 GLY H H 42 8.610 8.610 7.923 0.687 25281 2986 1 6 . 1 1 43 43 VAL N N 43 116.260 116.260 118.478 -2.218 25281 2987 1 6 . 1 1 43 43 VAL CA C 43 58.980 58.980 61.331 -2.351 25281 2988 1 6 . 1 1 43 43 VAL CB C 43 35.430 35.430 35.236 0.194 25281 2989 1 6 . 1 1 43 43 VAL H H 43 8.880 8.880 7.781 1.099 25281 2990 1 6 . 1 1 44 44 ILE N N 44 124.720 124.720 125.756 -1.036 25281 2991 1 6 . 1 1 44 44 ILE CA C 44 58.390 58.390 58.623 -0.233 25281 2992 1 6 . 1 1 44 44 ILE CB C 44 42.890 42.890 42.076 0.814 25281 2993 1 6 . 1 1 44 44 ILE H H 44 9.110 9.110 8.098 1.012 25281 2994 1 6 . 1 1 45 45 GLY N N 45 110.610 110.610 114.234 -3.624 25281 2995 1 6 . 1 1 45 45 GLY CA C 45 43.150 43.150 43.863 -0.713 25281 2996 1 6 . 1 1 45 45 GLY H H 45 8.910 8.910 8.234 0.676 25281 2997 1 6 . 1 1 46 46 SER N N 46 116.210 116.210 118.781 -2.571 25281 2998 1 6 . 1 1 46 46 SER CA C 46 56.250 56.250 57.292 -1.042 25281 2999 1 6 . 1 1 46 46 SER CB C 46 63.720 63.720 66.231 -2.510 25281 3000 1 6 . 1 1 46 46 SER H H 46 9.250 9.250 8.466 0.784 25281 3001 1 6 . 1 1 47 47 PHE N N 47 126.400 126.400 123.573 2.827 25281 3002 1 6 . 1 1 47 47 PHE CA C 47 55.090 55.090 56.339 -1.248 25281 3003 1 6 . 1 1 47 47 PHE CB C 47 42.560 42.560 42.844 -0.284 25281 3004 1 6 . 1 1 47 47 PHE H H 47 8.940 8.940 8.402 0.538 25281 3005 1 6 . 1 1 48 48 ALA N N 48 131.930 131.930 123.673 8.257 25281 3006 1 6 . 1 1 48 48 ALA CA C 48 50.350 50.350 50.711 -0.361 25281 3007 1 6 . 1 1 48 48 ALA CB C 48 21.280 21.280 23.208 -1.928 25281 3008 1 6 . 1 1 48 48 ALA H H 48 8.790 8.790 8.484 0.306 25281 3009 1 6 . 1 1 49 49 GLN N N 49 116.070 116.070 118.824 -2.754 25281 3010 1 6 . 1 1 49 49 GLN CA C 49 54.110 54.110 54.316 -0.206 25281 3011 1 6 . 1 1 49 49 GLN CB C 49 31.140 31.140 33.298 -2.158 25281 3012 1 6 . 1 1 49 49 GLN H H 49 7.720 7.720 8.393 -0.673 25281 3013 1 6 . 1 1 50 50 THR N N 50 115.990 115.990 115.127 0.863 25281 3014 1 6 . 1 1 50 50 THR CA C 50 59.270 59.270 61.148 -1.878 25281 3015 1 6 . 1 1 50 50 THR CB C 50 70.980 70.980 71.190 -0.210 25281 3016 1 6 . 1 1 50 50 THR H H 50 9.470 9.470 8.170 1.300 25281 3017 1 6 . 1 1 51 51 ARG N N 51 117.600 117.600 120.500 -2.900 25281 3018 1 6 . 1 1 51 51 ARG CA C 51 55.350 55.350 54.078 1.272 25281 3019 1 6 . 1 1 51 51 ARG CB C 51 33.610 33.610 32.934 0.676 25281 3020 1 6 . 1 1 51 51 ARG H H 51 8.600 8.600 8.000 0.600 25281 3021 1 6 . 1 1 52 52 ARG N N 52 121.400 121.400 121.715 -0.315 25281 3022 1 6 . 1 1 52 52 ARG CA C 52 56.910 56.910 55.516 1.394 25281 3023 1 6 . 1 1 52 52 ARG CB C 52 29.370 29.370 29.900 -0.530 25281 3024 1 6 . 1 1 52 52 ARG H H 52 8.380 8.380 8.423 -0.043 25281 3025 1 6 . 1 1 53 53 GLY N N 53 111.040 111.040 115.647 -4.607 25281 3026 1 6 . 1 1 53 53 GLY CA C 53 45.190 45.190 46.662 -1.472 25281 3027 1 6 . 1 1 53 53 GLY H H 53 8.330 8.330 8.862 -0.532 25281 3028 1 6 . 1 1 54 54 PHE N N 54 119.210 119.210 119.715 -0.505 25281 3029 1 6 . 1 1 54 54 PHE CA C 54 55.670 55.670 57.141 -1.471 25281 3030 1 6 . 1 1 54 54 PHE CB C 54 29.220 29.220 41.451 -12.231 25281 3031 1 6 . 1 1 54 54 PHE H H 54 7.720 7.720 7.753 -0.033 25281 3032 1 6 . 1 1 55 55 GLU N N 55 123.470 123.470 121.231 2.239 25281 3033 1 6 . 1 1 55 55 GLU CA C 55 55.580 55.580 56.523 -0.943 25281 3034 1 6 . 1 1 55 55 GLU CB C 55 32.920 32.920 30.448 2.472 25281 3035 1 6 . 1 1 55 55 GLU H H 55 8.400 8.400 8.641 -0.241 25281 3036 1 6 . 1 1 56 56 GLU N N 56 121.950 121.950 120.535 1.415 25281 3037 1 6 . 1 1 56 56 GLU CA C 56 56.690 56.690 57.423 -0.733 25281 3038 1 6 . 1 1 56 56 GLU CB C 56 29.450 29.450 29.228 0.222 25281 3039 1 6 . 1 1 56 56 GLU H H 56 8.500 8.500 8.694 -0.194 25281 3040 1 6 . 1 1 57 57 SER N N 57 123.330 123.330 119.733 3.597 25281 3041 1 6 . 1 1 57 57 SER CA C 57 55.090 55.090 57.858 -2.768 25281 3042 1 6 . 1 1 57 57 SER CB C 57 64.890 64.890 65.003 -0.113 25281 3043 1 6 . 1 1 57 57 SER H H 57 8.640 8.640 8.259 0.381 25281 3044 1 6 . 1 1 58 58 VAL N N 58 122.060 122.060 119.417 2.643 25281 3045 1 6 . 1 1 58 58 VAL CA C 58 57.660 57.660 60.799 -3.139 25281 3046 1 6 . 1 1 58 58 VAL CB C 58 31.640 31.640 34.647 -3.007 25281 3047 1 6 . 1 1 58 58 VAL H H 58 8.480 8.480 8.158 0.322 25281 3048 1 6 . 1 1 59 59 ASP N N 59 123.390 123.390 123.938 -0.548 25281 3049 1 6 . 1 1 59 59 ASP CA C 59 54.960 54.960 54.222 0.738 25281 3050 1 6 . 1 1 59 59 ASP CB C 59 42.840 42.840 41.518 1.322 25281 3051 1 6 . 1 1 59 59 ASP H H 59 9.360 9.360 8.703 0.657 25281 3052 1 6 . 1 1 60 60 GLY N N 60 105.230 105.230 107.972 -2.742 25281 3053 1 6 . 1 1 60 60 GLY CA C 60 45.130 45.130 45.176 -0.046 25281 3054 1 6 . 1 1 60 60 GLY H H 60 8.210 8.210 7.504 0.706 25281 3055 1 6 . 1 1 61 61 PHE N N 61 121.440 121.440 122.796 -1.356 25281 3056 1 6 . 1 1 61 61 PHE CA C 61 57.330 57.330 58.134 -0.804 25281 3057 1 6 . 1 1 61 61 PHE CB C 61 39.420 39.420 38.716 0.704 25281 3058 1 6 . 1 1 61 61 PHE H H 61 8.330 8.330 8.531 -0.201 25281 3059 1 6 . 1 1 62 62 LYS N N 62 119.870 119.870 126.535 -6.665 25281 3060 1 6 . 1 1 62 62 LYS CA C 62 56.340 56.340 54.361 1.979 25281 3061 1 6 . 1 1 62 62 LYS CB C 62 33.850 33.850 35.538 -1.688 25281 3062 1 6 . 1 1 62 62 LYS H H 62 8.480 8.480 8.431 0.049 25281 3063 1 6 . 1 1 63 63 LEU N N 63 125.160 125.160 122.441 2.719 25281 3064 1 6 . 1 1 63 63 LEU CA C 63 56.220 56.220 57.469 -1.249 25281 3065 1 6 . 1 1 63 63 LEU CB C 63 41.520 41.520 41.345 0.175 25281 3066 1 6 . 1 1 63 63 LEU H H 63 8.910 8.910 8.666 0.244 25281 3067 1 6 . 1 1 64 64 ILE N N 64 119.660 119.660 120.227 -0.567 25281 3068 1 6 . 1 1 64 64 ILE CA C 64 62.420 62.420 64.490 -2.070 25281 3069 1 6 . 1 1 64 64 ILE CB C 64 37.700 37.700 36.708 0.992 25281 3070 1 6 . 1 1 64 64 ILE H H 64 8.210 8.210 7.888 0.322 25281 3071 1 6 . 1 1 65 65 ASP N N 65 117.080 117.080 118.252 -1.172 25281 3072 1 6 . 1 1 65 65 ASP CA C 65 57.420 57.420 55.670 1.750 25281 3073 1 6 . 1 1 65 65 ASP CB C 65 38.350 38.350 38.944 -0.594 25281 3074 1 6 . 1 1 65 65 ASP H H 65 7.710 7.710 8.510 -0.800 25281 3075 1 6 . 1 1 66 66 GLY N N 66 106.440 106.440 107.147 -0.707 25281 3076 1 6 . 1 1 66 66 GLY CA C 66 45.170 45.170 45.326 -0.156 25281 3077 1 6 . 1 1 66 66 GLY H H 66 7.920 7.920 7.483 0.437 25281 3078 1 6 . 1 1 67 67 ASP N N 67 118.490 118.490 119.922 -1.432 25281 3079 1 6 . 1 1 67 67 ASP CA C 67 57.340 57.340 55.885 1.455 25281 3080 1 6 . 1 1 67 67 ASP CB C 67 29.870 29.870 40.968 -11.098 25281 3081 1 6 . 1 1 67 67 ASP H H 67 7.820 7.820 7.947 -0.127 25281 3082 1 6 . 1 1 68 68 PHE N N 68 125.320 125.320 112.841 12.479 25281 3083 1 6 . 1 1 68 68 PHE CA C 68 56.090 56.090 56.041 0.049 25281 3084 1 6 . 1 1 68 68 PHE CB C 68 41.940 41.940 42.275 -0.335 25281 3085 1 6 . 1 1 68 68 PHE H H 68 8.310 8.310 7.872 0.438 25281 3086 1 6 . 1 1 69 69 LYS N N 69 124.770 124.770 119.435 5.335 25281 3087 1 6 . 1 1 69 69 LYS CA C 69 54.880 54.880 54.921 -0.041 25281 3088 1 6 . 1 1 69 69 LYS CB C 69 36.920 36.920 35.908 1.012 25281 3089 1 6 . 1 1 69 69 LYS H H 69 8.730 8.730 8.370 0.360 25281 3090 1 6 . 1 1 70 70 TYR N N 70 123.740 123.740 124.558 -0.818 25281 3091 1 6 . 1 1 70 70 TYR CA C 70 55.540 55.540 56.582 -1.042 25281 3092 1 6 . 1 1 70 70 TYR CB C 70 40.150 40.150 41.825 -1.675 25281 3093 1 6 . 1 1 70 70 TYR H H 70 8.680 8.680 7.918 0.762 25281 3094 1 6 . 1 1 71 71 TYR N N 71 123.920 123.920 126.019 -2.099 25281 3095 1 6 . 1 1 71 71 TYR CA C 71 54.500 54.500 55.690 -1.190 25281 3096 1 6 . 1 1 71 71 TYR CB C 71 42.420 42.420 42.746 -0.326 25281 3097 1 6 . 1 1 71 71 TYR H H 71 8.620 8.620 8.957 -0.337 25281 3098 1 6 . 1 1 72 72 SER N N 72 113.820 113.820 116.093 -2.273 25281 3099 1 6 . 1 1 72 72 SER CA C 72 56.320 56.320 57.234 -0.914 25281 3100 1 6 . 1 1 72 72 SER CB C 72 65.790 65.790 65.449 0.341 25281 3101 1 6 . 1 1 72 72 SER H H 72 8.800 8.800 8.459 0.341 25281 3102 1 6 . 1 1 73 73 VAL N N 73 119.260 119.260 127.223 -7.963 25281 3103 1 6 . 1 1 73 73 VAL CA C 73 60.730 60.730 61.262 -0.532 25281 3104 1 6 . 1 1 73 73 VAL CB C 73 33.870 33.870 34.842 -0.972 25281 3105 1 6 . 1 1 73 73 VAL H H 73 8.170 8.170 8.118 0.052 25281 3106 1 6 . 1 1 74 74 THR N N 74 115.360 115.360 121.694 -6.334 25281 3107 1 6 . 1 1 74 74 THR CA C 74 59.040 59.040 60.650 -1.610 25281 3108 1 6 . 1 1 74 74 THR CB C 74 73.250 73.250 71.295 1.955 25281 3109 1 6 . 1 1 74 74 THR H H 74 9.200 9.200 8.006 1.194 25281 3110 1 6 . 1 1 75 75 ALA N N 75 119.330 119.330 127.157 -7.827 25281 3111 1 6 . 1 1 75 75 ALA CA C 75 51.390 51.390 50.952 0.438 25281 3112 1 6 . 1 1 75 75 ALA CB C 75 22.380 22.380 22.639 -0.259 25281 3113 1 6 . 1 1 75 75 ALA H H 75 9.130 9.130 8.800 0.330 25281 3114 1 6 . 1 1 76 76 GLY N N 76 103.130 103.130 106.391 -3.261 25281 3115 1 6 . 1 1 76 76 GLY CA C 76 45.900 45.900 44.638 1.262 25281 3116 1 6 . 1 1 76 76 GLY H H 76 8.760 8.760 8.089 0.671 25281 3117 1 6 . 1 1 77 77 PRO CA C 77 61.250 61.250 62.469 -1.219 25281 3118 1 6 . 1 1 77 77 PRO CB C 77 32.590 32.590 32.921 -0.331 25281 3119 1 6 . 1 1 78 78 VAL N N 78 115.250 115.250 118.790 -3.540 25281 3120 1 6 . 1 1 78 78 VAL CA C 78 58.430 58.430 61.431 -3.001 25281 3121 1 6 . 1 1 78 78 VAL CB C 78 32.700 32.700 34.202 -1.502 25281 3122 1 6 . 1 1 78 78 VAL H H 78 8.240 8.240 8.173 0.067 25281 3123 1 6 . 1 1 79 79 PHE N N 79 130.610 130.610 125.519 5.091 25281 3124 1 6 . 1 1 79 79 PHE CA C 79 55.090 55.090 56.469 -1.379 25281 3125 1 6 . 1 1 79 79 PHE CB C 79 41.590 41.590 42.551 -0.961 25281 3126 1 6 . 1 1 79 79 PHE H H 79 9.540 9.540 8.564 0.976 25281 3127 1 6 . 1 1 80 80 ARG N N 80 130.350 130.350 123.721 6.629 25281 3128 1 6 . 1 1 80 80 ARG CA C 80 55.490 55.490 56.913 -1.423 25281 3129 1 6 . 1 1 80 80 ARG CB C 80 29.520 29.520 30.972 -1.452 25281 3130 1 6 . 1 1 80 80 ARG H H 80 8.810 8.810 8.815 -0.005 25281 3131 1 6 . 1 1 81 81 ILE N N 81 127.480 127.480 124.772 2.708 25281 3132 1 6 . 1 1 81 81 ILE CA C 81 62.850 62.850 61.787 1.063 25281 3133 1 6 . 1 1 81 81 ILE CB C 81 37.650 37.650 38.795 -1.145 25281 3134 1 6 . 1 1 81 81 ILE H H 81 8.260 8.260 9.107 -0.847 25281 3135 1 6 . 1 1 82 82 ASN N N 82 113.110 113.110 116.678 -3.568 25281 3136 1 6 . 1 1 82 82 ASN CA C 82 55.630 55.630 52.891 2.739 25281 3137 1 6 . 1 1 82 82 ASN CB C 82 43.210 43.210 39.965 3.245 25281 3138 1 6 . 1 1 82 82 ASN H H 82 7.970 7.970 7.911 0.059 25281 3139 1 6 . 1 1 85 85 VAL N N 85 118.090 118.090 118.935 -0.845 25281 3140 1 6 . 1 1 85 85 VAL CA C 85 61.120 61.120 61.316 -0.196 25281 3141 1 6 . 1 1 85 85 VAL CB C 85 34.910 34.910 35.238 -0.328 25281 3142 1 6 . 1 1 85 85 VAL H H 85 7.840 7.840 7.689 0.151 25281 3143 1 6 . 1 1 86 86 SER N N 86 119.050 119.050 121.878 -2.828 25281 3144 1 6 . 1 1 86 86 SER CA C 86 57.100 57.100 56.820 0.280 25281 3145 1 6 . 1 1 86 86 SER CB C 86 65.400 65.400 65.433 -0.033 25281 3146 1 6 . 1 1 86 86 SER H H 86 8.240 8.240 8.143 0.097 25281 3147 1 6 . 1 1 87 87 LEU N N 87 124.640 124.640 126.102 -1.462 25281 3148 1 6 . 1 1 87 87 LEU CA C 87 53.750 53.750 53.787 -0.037 25281 3149 1 6 . 1 1 87 87 LEU CB C 87 46.320 46.320 44.396 1.924 25281 3150 1 6 . 1 1 87 87 LEU H H 87 9.130 9.130 8.203 0.927 25281 3151 1 6 . 1 1 88 88 TYR N N 88 118.740 118.740 118.985 -0.245 25281 3152 1 6 . 1 1 88 88 TYR CA C 88 55.080 55.080 56.120 -1.040 25281 3153 1 6 . 1 1 88 88 TYR CB C 88 42.630 42.630 41.102 1.528 25281 3154 1 6 . 1 1 88 88 TYR H H 88 8.740 8.740 7.891 0.849 25281 3155 1 6 . 1 1 89 89 GLY N N 89 103.920 103.920 107.096 -3.176 25281 3156 1 6 . 1 1 89 89 GLY CA C 89 43.250 43.250 43.506 -0.256 25281 3157 1 6 . 1 1 89 89 GLY H H 89 7.720 7.720 8.385 -0.665 25281 3158 1 6 . 1 1 90 90 LEU N N 90 117.530 117.530 122.535 -5.005 25281 3159 1 6 . 1 1 90 90 LEU CA C 90 53.200 53.200 53.970 -0.770 25281 3160 1 6 . 1 1 90 90 LEU CB C 90 45.810 45.810 44.609 1.201 25281 3161 1 6 . 1 1 90 90 LEU H H 90 8.520 8.520 8.640 -0.120 25281 3162 1 6 . 1 1 91 91 LEU N N 91 120.670 120.670 121.533 -0.863 25281 3163 1 6 . 1 1 91 91 LEU CA C 91 53.590 53.590 53.531 0.059 25281 3164 1 6 . 1 1 91 91 LEU CB C 91 46.330 46.330 45.350 0.980 25281 3165 1 6 . 1 1 91 91 LEU H H 91 9.250 9.250 7.969 1.281 25281 3166 1 6 . 1 1 92 92 GLY N N 92 108.770 108.770 109.754 -0.984 25281 3167 1 6 . 1 1 92 92 GLY CA C 92 46.520 46.520 46.269 0.251 25281 3168 1 6 . 1 1 92 92 GLY H H 92 8.480 8.480 8.530 -0.050 25281 3169 1 6 . 1 1 93 93 ALA N N 93 126.760 126.760 120.796 5.964 25281 3170 1 6 . 1 1 93 93 ALA CA C 93 49.890 49.890 50.900 -1.010 25281 3171 1 6 . 1 1 93 93 ALA CB C 93 21.860 21.860 22.654 -0.794 25281 3172 1 6 . 1 1 93 93 ALA H H 93 8.860 8.860 8.009 0.851 25281 3173 1 6 . 1 1 94 94 GLY N N 94 107.510 107.510 106.374 1.136 25281 3174 1 6 . 1 1 94 94 GLY CA C 94 42.760 42.760 43.940 -1.180 25281 3175 1 6 . 1 1 94 94 GLY H H 94 8.880 8.880 7.811 1.069 25281 3176 1 6 . 1 1 95 95 HIS N N 95 122.340 122.340 120.439 1.901 25281 3177 1 6 . 1 1 95 95 HIS CA C 95 54.570 54.570 54.480 0.090 25281 3178 1 6 . 1 1 95 95 HIS CB C 95 32.700 32.700 34.295 -1.595 25281 3179 1 6 . 1 1 95 95 HIS H H 95 9.200 9.200 8.880 0.320 25281 3180 1 6 . 1 1 96 96 GLY N N 96 112.170 112.170 107.585 4.585 25281 3181 1 6 . 1 1 96 96 GLY CA C 96 43.150 43.150 44.892 -1.742 25281 3182 1 6 . 1 1 96 96 GLY H H 96 8.620 8.620 8.272 0.348 25281 3183 1 6 . 1 1 97 97 LYS N N 97 120.580 120.580 118.727 1.853 25281 3184 1 6 . 1 1 97 97 LYS CA C 97 54.890 54.890 54.865 0.025 25281 3185 1 6 . 1 1 97 97 LYS CB C 97 35.560 35.560 36.932 -1.372 25281 3186 1 6 . 1 1 97 97 LYS H H 97 9.010 9.010 8.536 0.474 25281 3187 1 6 . 1 1 98 98 ALA N N 98 126.740 126.740 123.335 3.405 25281 3188 1 6 . 1 1 98 98 ALA CA C 98 50.020 50.020 50.757 -0.737 25281 3189 1 6 . 1 1 98 98 ALA CB C 98 22.380 22.380 21.519 0.861 25281 3190 1 6 . 1 1 98 98 ALA H H 98 9.120 9.120 8.352 0.768 25281 3191 1 6 . 1 1 99 99 LYS N N 99 122.360 122.360 125.599 -3.239 25281 3192 1 6 . 1 1 99 99 LYS CA C 99 55.090 55.090 55.563 -0.473 25281 3193 1 6 . 1 1 99 99 LYS CB C 99 34.970 34.970 35.509 -0.539 25281 3194 1 6 . 1 1 99 99 LYS H H 99 8.580 8.580 8.767 -0.187 25281 3195 1 6 . 1 1 100 100 PHE N N 100 121.170 121.170 124.955 -3.785 25281 3196 1 6 . 1 1 100 100 PHE CA C 100 56.390 56.390 55.744 0.646 25281 3197 1 6 . 1 1 100 100 PHE CB C 100 42.110 42.110 39.469 2.641 25281 3198 1 6 . 1 1 100 100 PHE H H 100 8.750 8.750 8.535 0.215 25281 3199 1 6 . 1 1 101 101 SER N N 101 117.280 117.280 115.002 2.278 25281 3200 1 6 . 1 1 101 101 SER CA C 101 57.070 57.070 57.151 -0.081 25281 3201 1 6 . 1 1 101 101 SER CB C 101 65.830 65.830 64.895 0.935 25281 3202 1 6 . 1 1 101 101 SER H H 101 8.990 8.990 8.173 0.817 25281 3203 1 6 . 1 1 102 102 SER N N 102 117.600 117.600 117.189 0.411 25281 3204 1 6 . 1 1 102 102 SER CA C 102 56.500 56.500 58.438 -1.938 25281 3205 1 6 . 1 1 102 102 SER CB C 102 67.540 67.540 63.352 4.189 25281 3206 1 6 . 1 1 102 102 SER H H 102 8.680 8.680 8.279 0.401 25281 3207 1 6 . 1 1 103 103 ILE N N 103 114.980 114.980 121.578 -6.598 25281 3208 1 6 . 1 1 103 103 ILE CA C 103 59.180 59.180 59.658 -0.478 25281 3209 1 6 . 1 1 103 103 ILE CB C 103 40.550 40.550 40.322 0.228 25281 3210 1 6 . 1 1 103 103 ILE H H 103 7.700 7.700 8.359 -0.659 25281 3211 1 6 . 1 1 104 104 PHE N N 104 123.710 123.710 122.115 1.595 25281 3212 1 6 . 1 1 104 104 PHE CA C 104 53.190 53.190 57.736 -4.546 25281 3213 1 6 . 1 1 104 104 PHE CB C 104 43.900 43.900 39.608 4.292 25281 3214 1 6 . 1 1 104 104 PHE H H 104 8.590 8.590 8.508 0.082 25281 3215 1 6 . 1 1 105 105 GLY N N 105 109.080 109.080 113.121 -4.041 25281 3216 1 6 . 1 1 105 105 GLY CA C 105 45.420 45.420 44.116 1.304 25281 3217 1 6 . 1 1 105 105 GLY H H 105 8.400 8.400 7.745 0.655 25281 3218 1 6 . 1 1 106 106 GLN N N 106 119.680 119.680 120.635 -0.955 25281 3219 1 6 . 1 1 106 106 GLN CA C 106 53.720 53.720 55.613 -1.893 25281 3220 1 6 . 1 1 106 106 GLN CB C 106 30.100 30.100 29.639 0.461 25281 3221 1 6 . 1 1 106 106 GLN H H 106 8.530 8.530 8.256 0.274 25281 3222 1 6 . 1 1 107 107 SER N N 107 119.160 119.160 118.009 1.151 25281 3223 1 6 . 1 1 107 107 SER CA C 107 57.360 57.360 57.096 0.264 25281 3224 1 6 . 1 1 107 107 SER CB C 107 66.050 66.050 63.416 2.634 25281 3225 1 6 . 1 1 107 107 SER H H 107 8.800 8.800 8.208 0.592 25281 3226 1 6 . 1 1 108 108 GLU N N 108 125.360 125.360 119.672 5.688 25281 3227 1 6 . 1 1 108 108 GLU CA C 108 58.910 58.910 55.726 3.184 25281 3228 1 6 . 1 1 108 108 GLU CB C 108 40.880 40.880 31.892 8.988 25281 3229 1 6 . 1 1 108 108 GLU H H 108 8.960 8.960 7.983 0.977 25281 3230 1 6 . 1 1 109 109 SER N N 109 118.890 118.890 118.552 0.338 25281 3231 1 6 . 1 1 109 109 SER CA C 109 56.710 56.710 57.499 -0.789 25281 3232 1 6 . 1 1 109 109 SER CB C 109 66.180 66.180 64.566 1.614 25281 3233 1 6 . 1 1 109 109 SER H H 109 9.080 9.080 8.468 0.612 25281 3234 1 6 . 1 1 110 110 ARG N N 110 119.830 119.830 125.384 -5.554 25281 3235 1 6 . 1 1 110 110 ARG CA C 110 58.390 58.390 55.043 3.347 25281 3236 1 6 . 1 1 110 110 ARG CB C 110 40.940 40.940 34.688 6.252 25281 3237 1 6 . 1 1 110 110 ARG H H 110 8.850 8.850 8.321 0.529 25281 3238 1 6 . 1 1 111 111 SER N N 111 114.870 114.870 116.109 -1.239 25281 3239 1 6 . 1 1 111 111 SER CA C 111 57.290 57.290 57.310 -0.020 25281 3240 1 6 . 1 1 111 111 SER CB C 111 66.110 66.110 66.490 -0.380 25281 3241 1 6 . 1 1 111 111 SER H H 111 8.740 8.740 8.412 0.328 25281 3242 1 6 . 1 1 112 112 LYS N N 112 120.870 120.870 121.177 -0.307 25281 3243 1 6 . 1 1 112 112 LYS CA C 112 55.150 55.150 55.160 -0.010 25281 3244 1 6 . 1 1 112 112 LYS CB C 112 36.330 36.330 36.075 0.256 25281 3245 1 6 . 1 1 112 112 LYS H H 112 8.520 8.520 8.557 -0.037 25281 3246 1 6 . 1 1 113 113 THR N N 113 121.390 121.390 116.583 4.807 25281 3247 1 6 . 1 1 113 113 THR CA C 113 61.250 61.250 61.506 -0.256 25281 3248 1 6 . 1 1 113 113 THR CB C 113 70.010 70.010 70.349 -0.339 25281 3249 1 6 . 1 1 113 113 THR H H 113 8.440 8.440 8.470 -0.030 25281 3250 1 6 . 1 1 114 114 SER N N 114 120.730 120.730 119.915 0.815 25281 3251 1 6 . 1 1 114 114 SER CA C 114 56.190 56.190 57.392 -1.202 25281 3252 1 6 . 1 1 114 114 SER CB C 114 66.380 66.380 65.502 0.878 25281 3253 1 6 . 1 1 114 114 SER H H 114 9.350 9.350 8.046 1.304 25281 3254 1 6 . 1 1 115 115 LEU N N 115 121.540 121.540 122.133 -0.593 25281 3255 1 6 . 1 1 115 115 LEU CA C 115 55.480 55.480 54.564 0.916 25281 3256 1 6 . 1 1 115 115 LEU CB C 115 42.890 42.890 45.344 -2.454 25281 3257 1 6 . 1 1 115 115 LEU H H 115 8.200 8.200 8.757 -0.557 25281 3258 1 6 . 1 1 116 116 ALA N N 116 129.060 129.060 124.924 4.136 25281 3259 1 6 . 1 1 116 116 ALA CA C 116 49.960 49.960 50.130 -0.170 25281 3260 1 6 . 1 1 116 116 ALA CB C 116 20.310 20.310 22.043 -1.733 25281 3261 1 6 . 1 1 116 116 ALA H H 116 8.600 8.600 8.789 -0.189 25281 3262 1 6 . 1 1 117 117 TYR N N 117 115.890 115.890 118.872 -2.982 25281 3263 1 6 . 1 1 117 117 TYR CA C 117 55.150 55.150 55.936 -0.786 25281 3264 1 6 . 1 1 117 117 TYR CB C 117 41.200 41.200 41.469 -0.269 25281 3265 1 6 . 1 1 117 117 TYR H H 117 8.450 8.450 7.779 0.671 25281 3266 1 6 . 1 1 118 118 GLY N N 118 107.330 107.330 106.821 0.509 25281 3267 1 6 . 1 1 118 118 GLY CA C 118 45.940 45.940 46.062 -0.122 25281 3268 1 6 . 1 1 118 118 GLY H H 118 9.340 9.340 8.179 1.161 25281 3269 1 6 . 1 1 119 119 ALA N N 119 118.880 118.880 120.881 -2.001 25281 3270 1 6 . 1 1 119 119 ALA CA C 119 51.320 51.320 50.948 0.372 25281 3271 1 6 . 1 1 119 119 ALA CB C 119 22.120 22.120 22.635 -0.515 25281 3272 1 6 . 1 1 119 119 ALA H H 119 8.770 8.770 7.873 0.897 25281 3273 1 6 . 1 1 120 120 GLY N N 120 105.730 105.730 106.382 -0.652 25281 3274 1 6 . 1 1 120 120 GLY CA C 120 45.650 45.650 43.851 1.799 25281 3275 1 6 . 1 1 120 120 GLY H H 120 7.940 7.940 7.676 0.264 25281 3276 1 6 . 1 1 121 121 LEU N N 121 115.480 115.480 120.149 -4.669 25281 3277 1 6 . 1 1 121 121 LEU CA C 121 52.980 52.980 53.964 -0.984 25281 3278 1 6 . 1 1 121 121 LEU CB C 121 46.460 46.460 46.325 0.135 25281 3279 1 6 . 1 1 121 121 LEU H H 121 9.010 9.010 8.041 0.969 25281 3280 1 6 . 1 1 122 122 GLN N N 122 112.530 112.530 121.149 -8.619 25281 3281 1 6 . 1 1 122 122 GLN CA C 122 54.780 54.780 54.240 0.540 25281 3282 1 6 . 1 1 122 122 GLN CB C 122 31.400 31.400 32.528 -1.128 25281 3283 1 6 . 1 1 122 122 GLN H H 122 8.090 8.090 8.058 0.032 25281 3284 1 6 . 1 1 123 123 PHE N N 123 126.050 126.050 124.293 1.757 25281 3285 1 6 . 1 1 123 123 PHE CA C 123 54.180 54.180 56.600 -2.420 25281 3286 1 6 . 1 1 123 123 PHE CB C 123 42.560 42.560 42.406 0.155 25281 3287 1 6 . 1 1 123 123 PHE H H 123 10.020 10.020 8.591 1.429 25281 3288 1 6 . 1 1 124 124 ASN N N 124 121.910 121.910 121.644 0.266 25281 3289 1 6 . 1 1 124 124 ASN CA C 124 50.940 50.940 49.744 1.196 25281 3290 1 6 . 1 1 124 124 ASN CB C 124 40.360 40.360 39.510 0.850 25281 3291 1 6 . 1 1 124 124 ASN H H 124 9.520 9.520 8.387 1.133 25281 3292 1 6 . 1 1 125 125 PRO CA C 125 63.390 63.390 62.780 0.610 25281 3293 1 6 . 1 1 125 125 PRO CB C 125 31.210 31.210 32.672 -1.462 25281 3294 1 6 . 1 1 126 126 HIS N N 126 116.830 116.830 119.463 -2.633 25281 3295 1 6 . 1 1 126 126 HIS CA C 126 54.110 54.110 59.059 -4.949 25281 3296 1 6 . 1 1 126 126 HIS CB C 126 34.910 34.910 28.817 6.093 25281 3297 1 6 . 1 1 126 126 HIS H H 126 7.630 7.630 8.778 -1.148 25281 3298 1 6 . 1 1 127 127 PRO CA C 127 65.370 65.370 63.206 2.164 25281 3299 1 6 . 1 1 127 127 PRO CB C 127 31.030 31.030 32.266 -1.236 25281 3300 1 6 . 1 1 128 128 ASN N N 128 114.680 114.680 115.758 -1.078 25281 3301 1 6 . 1 1 128 128 ASN CA C 128 53.990 53.990 53.012 0.978 25281 3302 1 6 . 1 1 128 128 ASN CB C 128 40.550 40.550 38.232 2.318 25281 3303 1 6 . 1 1 128 128 ASN H H 128 10.460 10.460 8.357 2.103 25281 3304 1 6 . 1 1 129 129 PHE N N 129 119.630 119.630 117.978 1.652 25281 3305 1 6 . 1 1 129 129 PHE CA C 129 56.530 56.530 56.750 -0.220 25281 3306 1 6 . 1 1 129 129 PHE CB C 129 44.310 44.310 42.326 1.984 25281 3307 1 6 . 1 1 129 129 PHE H H 129 8.340 8.340 7.488 0.852 25281 3308 1 6 . 1 1 130 130 VAL N N 130 123.000 123.000 121.264 1.736 25281 3309 1 6 . 1 1 130 130 VAL CA C 130 60.340 60.340 61.232 -0.892 25281 3310 1 6 . 1 1 130 130 VAL CB C 130 34.970 34.970 35.318 -0.348 25281 3311 1 6 . 1 1 130 130 VAL H H 130 7.820 7.820 9.412 -1.592 25281 3312 1 6 . 1 1 131 131 ILE N N 131 124.470 124.470 127.950 -3.480 25281 3313 1 6 . 1 1 131 131 ILE CA C 131 60.210 60.210 60.810 -0.600 25281 3314 1 6 . 1 1 131 131 ILE CB C 131 39.510 39.510 39.650 -0.140 25281 3315 1 6 . 1 1 131 131 ILE H H 131 8.830 8.830 8.253 0.577 25281 3316 1 6 . 1 1 132 132 ASP N N 132 130.700 130.700 128.911 1.789 25281 3317 1 6 . 1 1 132 132 ASP CA C 132 53.530 53.530 53.016 0.514 25281 3318 1 6 . 1 1 132 132 ASP CB C 132 47.620 47.620 44.402 3.218 25281 3319 1 6 . 1 1 132 132 ASP H H 132 9.040 9.040 8.211 0.829 25281 3320 1 6 . 1 1 133 133 ALA N N 133 126.900 126.900 125.915 0.985 25281 3321 1 6 . 1 1 133 133 ALA CA C 133 51.390 51.390 51.028 0.362 25281 3322 1 6 . 1 1 133 133 ALA CB C 133 21.730 21.730 22.746 -1.016 25281 3323 1 6 . 1 1 133 133 ALA H H 133 8.800 8.800 8.261 0.539 25281 3324 1 6 . 1 1 134 134 SER N N 134 113.760 113.760 116.924 -3.164 25281 3325 1 6 . 1 1 134 134 SER CA C 134 58.140 58.140 56.732 1.408 25281 3326 1 6 . 1 1 134 134 SER CB C 134 67.020 67.020 66.793 0.227 25281 3327 1 6 . 1 1 134 134 SER H H 134 9.160 9.160 7.958 1.202 25281 3328 1 6 . 1 1 135 135 TYR N N 135 118.500 118.500 120.598 -2.098 25281 3329 1 6 . 1 1 135 135 TYR CA C 135 55.690 55.690 56.139 -0.449 25281 3330 1 6 . 1 1 135 135 TYR CB C 135 43.150 43.150 40.982 2.168 25281 3331 1 6 . 1 1 135 135 TYR H H 135 8.820 8.820 8.069 0.751 25281 3332 1 6 . 1 1 136 136 GLU N N 136 126.290 126.290 121.463 4.827 25281 3333 1 6 . 1 1 136 136 GLU CA C 136 53.530 53.530 54.584 -1.054 25281 3334 1 6 . 1 1 136 136 GLU CB C 136 34.450 34.450 34.580 -0.130 25281 3335 1 6 . 1 1 136 136 GLU H H 136 8.380 8.380 8.510 -0.130 25281 3336 1 6 . 1 1 137 137 TYR N N 137 123.630 123.630 123.801 -0.171 25281 3337 1 6 . 1 1 137 137 TYR CA C 137 55.670 55.670 56.507 -0.837 25281 3338 1 6 . 1 1 137 137 TYR CB C 137 43.150 43.150 42.388 0.762 25281 3339 1 6 . 1 1 137 137 TYR H H 137 9.300 9.300 8.560 0.740 25281 3340 1 6 . 1 1 138 138 SER N N 138 118.300 118.300 120.454 -2.154 25281 3341 1 6 . 1 1 138 138 SER CA C 138 58.270 58.270 55.701 2.569 25281 3342 1 6 . 1 1 138 138 SER CB C 138 67.090 67.090 65.429 1.661 25281 3343 1 6 . 1 1 138 138 SER H H 138 7.980 7.980 7.794 0.186 25281 3344 1 6 . 1 1 139 139 LYS N N 139 127.450 127.450 126.887 0.563 25281 3345 1 6 . 1 1 139 139 LYS CA C 139 55.160 55.160 55.338 -0.178 25281 3346 1 6 . 1 1 139 139 LYS CB C 139 32.640 32.640 32.620 0.020 25281 3347 1 6 . 1 1 139 139 LYS H H 139 8.630 8.630 8.232 0.398 25281 3348 1 6 . 1 1 140 140 LEU N N 140 129.650 129.650 127.440 2.210 25281 3349 1 6 . 1 1 140 140 LEU CA C 140 52.500 52.500 53.220 -0.720 25281 3350 1 6 . 1 1 140 140 LEU CB C 140 40.000 40.000 45.160 -5.160 25281 3351 1 6 . 1 1 140 140 LEU H H 140 9.060 9.060 7.994 1.066 25281 3352 1 6 . 1 1 141 141 ASP N N 141 121.470 121.470 125.016 -3.546 25281 3353 1 6 . 1 1 141 141 ASP CA C 141 57.190 57.190 56.714 0.476 25281 3354 1 6 . 1 1 141 141 ASP CB C 141 39.730 39.730 40.480 -0.750 25281 3355 1 6 . 1 1 141 141 ASP H H 141 8.590 8.590 8.766 -0.176 25281 3356 1 6 . 1 1 142 142 ASP N N 142 121.510 121.510 120.064 1.446 25281 3357 1 6 . 1 1 142 142 ASP CA C 142 55.180 55.180 55.896 -0.716 25281 3358 1 6 . 1 1 142 142 ASP CB C 142 41.090 41.090 41.090 -0.000 25281 3359 1 6 . 1 1 142 142 ASP H H 142 8.430 8.430 8.673 -0.243 25281 3360 1 6 . 1 1 143 143 VAL N N 143 121.420 121.420 111.865 9.555 25281 3361 1 6 . 1 1 143 143 VAL CA C 143 62.240 62.240 59.751 2.489 25281 3362 1 6 . 1 1 143 143 VAL CB C 143 31.280 31.280 35.716 -4.436 25281 3363 1 6 . 1 1 143 143 VAL H H 143 8.020 8.020 7.285 0.735 25281 3364 1 6 . 1 1 144 144 LYS N N 144 127.950 127.950 121.482 6.468 25281 3365 1 6 . 1 1 144 144 LYS CA C 144 55.440 55.440 54.549 0.891 25281 3366 1 6 . 1 1 144 144 LYS CB C 144 32.640 32.640 33.788 -1.148 25281 3367 1 6 . 1 1 144 144 LYS H H 144 8.660 8.660 8.183 0.477 25281 3368 1 6 . 1 1 145 145 VAL N N 145 124.120 124.120 122.652 1.468 25281 3369 1 6 . 1 1 145 145 VAL CA C 145 55.910 55.910 60.098 -4.188 25281 3370 1 6 . 1 1 145 145 VAL CB C 145 32.570 32.570 34.184 -1.615 25281 3371 1 6 . 1 1 145 145 VAL H H 145 8.720 8.720 7.592 1.128 25281 3372 1 6 . 1 1 146 146 GLY N N 146 116.240 116.240 114.549 1.691 25281 3373 1 6 . 1 1 146 146 GLY CA C 146 44.080 44.080 43.809 0.271 25281 3374 1 6 . 1 1 146 146 GLY H H 146 8.400 8.400 8.600 -0.200 25281 3375 1 6 . 1 1 147 147 THR N N 147 124.620 124.620 122.337 2.283 25281 3376 1 6 . 1 1 147 147 THR CA C 147 61.450 61.450 61.680 -0.230 25281 3377 1 6 . 1 1 147 147 THR CB C 147 70.260 70.260 71.087 -0.827 25281 3378 1 6 . 1 1 147 147 THR H H 147 9.080 9.080 8.751 0.329 25281 3379 1 6 . 1 1 148 148 TRP N N 148 124.790 124.790 128.190 -3.400 25281 3380 1 6 . 1 1 148 148 TRP CA C 148 54.770 54.770 56.363 -1.593 25281 3381 1 6 . 1 1 148 148 TRP CB C 148 33.090 33.090 32.545 0.544 25281 3382 1 6 . 1 1 148 148 TRP H H 148 8.510 8.510 9.139 -0.629 25281 3383 1 6 . 1 1 149 149 MET N N 149 118.880 118.880 120.708 -1.828 25281 3384 1 6 . 1 1 149 149 MET CA C 149 54.540 54.540 53.801 0.739 25281 3385 1 6 . 1 1 149 149 MET CB C 149 34.640 34.640 35.294 -0.654 25281 3386 1 6 . 1 1 149 149 MET H H 149 9.150 9.150 8.831 0.319 25281 3387 1 6 . 1 1 150 150 LEU N N 150 122.830 122.830 126.135 -3.305 25281 3388 1 6 . 1 1 150 150 LEU CA C 150 54.100 54.100 54.161 -0.061 25281 3389 1 6 . 1 1 150 150 LEU CB C 150 45.800 45.800 46.101 -0.301 25281 3390 1 6 . 1 1 150 150 LEU H H 150 8.480 8.480 8.249 0.231 25281 3391 1 6 . 1 1 151 151 GLY N N 151 112.730 112.730 111.956 0.774 25281 3392 1 6 . 1 1 151 151 GLY CA C 151 45.940 45.940 45.755 0.185 25281 3393 1 6 . 1 1 151 151 GLY H H 151 9.820 9.820 8.267 1.553 25281 3394 1 6 . 1 1 152 152 ALA N N 152 119.460 119.460 120.140 -0.680 25281 3395 1 6 . 1 1 152 152 ALA CA C 152 49.760 49.760 50.368 -0.608 25281 3396 1 6 . 1 1 152 152 ALA CB C 152 22.700 22.700 23.009 -0.309 25281 3397 1 6 . 1 1 152 152 ALA H H 152 8.840 8.840 8.449 0.391 25281 3398 1 6 . 1 1 153 153 GLY N N 153 104.360 104.360 106.425 -2.065 25281 3399 1 6 . 1 1 153 153 GLY CA C 153 46.440 46.440 45.095 1.345 25281 3400 1 6 . 1 1 153 153 GLY H H 153 8.540 8.540 8.810 -0.270 25281 3401 1 6 . 1 1 154 154 TYR N N 154 120.680 120.680 115.661 5.019 25281 3402 1 6 . 1 1 154 154 TYR CA C 154 55.370 55.370 55.526 -0.156 25281 3403 1 6 . 1 1 154 154 TYR CB C 154 44.250 44.250 41.437 2.813 25281 3404 1 6 . 1 1 154 154 TYR H H 154 8.310 8.310 7.770 0.540 25281 3405 1 6 . 1 1 155 155 ARG N N 155 127.050 127.050 123.758 3.292 25281 3406 1 6 . 1 1 155 155 ARG CA C 155 53.480 53.480 55.821 -2.341 25281 3407 1 6 . 1 1 155 155 ARG CB C 155 32.160 32.160 31.057 1.103 25281 3408 1 6 . 1 1 155 155 ARG H H 155 7.640 7.640 8.619 -0.979 25281 3409 1 7 . 1 1 2 2 GLY N N 2 112.280 112.280 109.775 2.505 25281 3410 1 7 . 1 1 2 2 GLY CA C 2 44.830 44.830 44.523 0.307 25281 3411 1 7 . 1 1 2 2 GLY H H 2 8.460 8.460 7.930 0.530 25281 3412 1 7 . 1 1 3 3 GLU N N 3 118.460 118.460 120.560 -2.100 25281 3413 1 7 . 1 1 3 3 GLU CA C 3 56.840 56.840 56.489 0.351 25281 3414 1 7 . 1 1 3 3 GLU CB C 3 29.980 29.980 30.248 -0.268 25281 3415 1 7 . 1 1 3 3 GLU H H 3 7.630 7.630 8.349 -0.719 25281 3416 1 7 . 1 1 4 4 SER N N 4 119.000 119.000 116.728 2.272 25281 3417 1 7 . 1 1 4 4 SER CA C 4 57.280 57.280 57.618 -0.338 25281 3418 1 7 . 1 1 4 4 SER CB C 4 65.860 65.860 65.268 0.592 25281 3419 1 7 . 1 1 4 4 SER H H 4 8.820 8.820 8.234 0.586 25281 3420 1 7 . 1 1 5 5 SER N N 5 118.300 118.300 120.215 -1.915 25281 3421 1 7 . 1 1 5 5 SER CA C 5 57.560 57.560 57.375 0.185 25281 3422 1 7 . 1 1 5 5 SER CB C 5 65.480 65.480 65.804 -0.324 25281 3423 1 7 . 1 1 5 5 SER H H 5 8.700 8.700 8.135 0.565 25281 3424 1 7 . 1 1 6 6 ILE N N 6 123.240 123.240 124.203 -0.963 25281 3425 1 7 . 1 1 6 6 ILE CA C 6 54.110 54.110 59.606 -5.496 25281 3426 1 7 . 1 1 6 6 ILE CB C 6 33.870 33.870 41.784 -7.914 25281 3427 1 7 . 1 1 6 6 ILE H H 6 9.080 9.080 7.623 1.457 25281 3428 1 7 . 1 1 7 7 SER N N 7 116.100 116.100 120.580 -4.480 25281 3429 1 7 . 1 1 7 7 SER CA C 7 57.130 57.130 56.544 0.586 25281 3430 1 7 . 1 1 7 7 SER CB C 7 65.710 65.710 65.366 0.344 25281 3431 1 7 . 1 1 7 7 SER H H 7 8.570 8.570 7.866 0.704 25281 3432 1 7 . 1 1 8 8 ILE N N 8 114.140 114.140 122.896 -8.756 25281 3433 1 7 . 1 1 8 8 ILE CA C 8 58.460 58.460 59.728 -1.268 25281 3434 1 7 . 1 1 8 8 ILE CB C 8 40.880 40.880 42.106 -1.226 25281 3435 1 7 . 1 1 8 8 ILE H H 8 8.300 8.300 8.140 0.160 25281 3436 1 7 . 1 1 9 9 GLY N N 9 109.200 109.200 110.105 -0.905 25281 3437 1 7 . 1 1 9 9 GLY CA C 9 45.550 45.550 45.370 0.180 25281 3438 1 7 . 1 1 9 9 GLY H H 9 9.060 9.060 8.377 0.683 25281 3439 1 7 . 1 1 10 10 TYR N N 10 121.410 121.410 119.004 2.406 25281 3440 1 7 . 1 1 10 10 TYR CA C 10 56.970 56.970 57.097 -0.127 25281 3441 1 7 . 1 1 10 10 TYR CB C 10 41.520 41.520 41.580 -0.060 25281 3442 1 7 . 1 1 10 10 TYR H H 10 8.870 8.870 7.983 0.887 25281 3443 1 7 . 1 1 11 11 ALA N N 11 125.250 125.250 124.370 0.880 25281 3444 1 7 . 1 1 11 11 ALA CA C 11 48.740 48.740 49.825 -1.085 25281 3445 1 7 . 1 1 11 11 ALA CB C 11 21.610 21.610 21.385 0.225 25281 3446 1 7 . 1 1 11 11 ALA H H 11 7.210 7.210 8.364 -1.154 25281 3447 1 7 . 1 1 12 12 GLN N N 12 119.180 119.180 122.151 -2.971 25281 3448 1 7 . 1 1 12 12 GLN CA C 12 54.690 54.690 54.007 0.683 25281 3449 1 7 . 1 1 12 12 GLN CB C 12 32.000 32.000 33.821 -1.821 25281 3450 1 7 . 1 1 12 12 GLN H H 12 8.330 8.330 7.309 1.021 25281 3451 1 7 . 1 1 13 13 SER N N 13 122.790 122.790 116.037 6.753 25281 3452 1 7 . 1 1 13 13 SER CA C 13 57.780 57.780 56.849 0.931 25281 3453 1 7 . 1 1 13 13 SER CB C 13 64.540 64.540 66.116 -1.576 25281 3454 1 7 . 1 1 13 13 SER H H 13 8.610 8.610 8.424 0.186 25281 3455 1 7 . 1 1 14 14 ARG N N 14 121.140 121.140 123.560 -2.420 25281 3456 1 7 . 1 1 14 14 ARG CA C 14 54.960 54.960 55.870 -0.910 25281 3457 1 7 . 1 1 14 14 ARG CB C 14 32.370 32.370 32.002 0.368 25281 3458 1 7 . 1 1 14 14 ARG H H 14 8.520 8.520 8.316 0.204 25281 3459 1 7 . 1 1 15 15 VAL N N 15 115.890 115.890 120.125 -4.235 25281 3460 1 7 . 1 1 15 15 VAL CA C 15 60.970 60.970 61.152 -0.182 25281 3461 1 7 . 1 1 15 15 VAL CB C 15 34.320 34.320 36.173 -1.853 25281 3462 1 7 . 1 1 15 15 VAL H H 15 8.440 8.440 7.889 0.551 25281 3463 1 7 . 1 1 16 16 LYS N N 16 126.010 126.010 126.506 -0.496 25281 3464 1 7 . 1 1 16 16 LYS CA C 16 55.120 55.120 55.528 -0.408 25281 3465 1 7 . 1 1 16 16 LYS CB C 16 34.350 34.350 32.827 1.523 25281 3466 1 7 . 1 1 16 16 LYS H H 16 8.850 8.850 8.537 0.313 25281 3467 1 7 . 1 1 17 17 GLU N N 17 119.140 119.140 124.190 -5.050 25281 3468 1 7 . 1 1 17 17 GLU CA C 17 54.460 54.460 55.326 -0.866 25281 3469 1 7 . 1 1 17 17 GLU CB C 17 33.430 33.430 32.668 0.762 25281 3470 1 7 . 1 1 17 17 GLU H H 17 8.030 8.030 8.446 -0.416 25281 3471 1 7 . 1 1 18 18 ASP N N 18 120.280 120.280 121.843 -1.563 25281 3472 1 7 . 1 1 18 18 ASP CA C 18 56.500 56.500 54.599 1.901 25281 3473 1 7 . 1 1 18 18 ASP CB C 18 33.780 33.780 41.289 -7.509 25281 3474 1 7 . 1 1 18 18 ASP H H 18 8.120 8.120 8.462 -0.342 25281 3475 1 7 . 1 1 19 19 GLY N N 19 118.750 118.750 111.192 7.558 25281 3476 1 7 . 1 1 19 19 GLY CA C 19 44.130 44.130 44.636 -0.506 25281 3477 1 7 . 1 1 19 19 GLY H H 19 8.430 8.430 8.327 0.103 25281 3478 1 7 . 1 1 20 20 TYR N N 20 117.080 117.080 124.848 -7.768 25281 3479 1 7 . 1 1 20 20 TYR CA C 20 60.940 60.940 57.574 3.366 25281 3480 1 7 . 1 1 20 20 TYR CB C 20 42.010 42.010 37.946 4.064 25281 3481 1 7 . 1 1 20 20 TYR H H 20 8.610 8.610 8.684 -0.074 25281 3482 1 7 . 1 1 21 21 LYS N N 21 127.240 127.240 123.732 3.508 25281 3483 1 7 . 1 1 21 21 LYS CA C 21 56.760 56.760 57.416 -0.656 25281 3484 1 7 . 1 1 21 21 LYS CB C 21 29.100 29.100 32.582 -3.482 25281 3485 1 7 . 1 1 21 21 LYS H H 21 7.970 7.970 8.618 -0.648 25281 3486 1 7 . 1 1 22 22 LEU N N 22 122.270 122.270 119.851 2.419 25281 3487 1 7 . 1 1 22 22 LEU CA C 22 59.170 59.170 57.538 1.632 25281 3488 1 7 . 1 1 22 22 LEU CB C 22 40.030 40.030 41.860 -1.830 25281 3489 1 7 . 1 1 22 22 LEU H H 22 8.370 8.370 8.070 0.300 25281 3490 1 7 . 1 1 23 23 ASP N N 23 114.790 114.790 113.950 0.840 25281 3491 1 7 . 1 1 23 23 ASP CA C 23 51.840 51.840 53.291 -1.452 25281 3492 1 7 . 1 1 23 23 ASP CB C 23 37.730 37.730 41.222 -3.492 25281 3493 1 7 . 1 1 23 23 ASP H H 23 8.210 8.210 8.272 -0.062 25281 3494 1 7 . 1 1 24 24 LYS N N 24 115.470 115.470 114.499 0.971 25281 3495 1 7 . 1 1 24 24 LYS CA C 24 58.860 58.860 57.922 0.938 25281 3496 1 7 . 1 1 24 24 LYS CB C 24 28.330 28.330 30.190 -1.860 25281 3497 1 7 . 1 1 24 24 LYS H H 24 9.230 9.230 8.047 1.183 25281 3498 1 7 . 1 1 25 25 ASN N N 25 121.610 121.610 117.417 4.193 25281 3499 1 7 . 1 1 25 25 ASN CA C 25 54.430 54.430 50.989 3.441 25281 3500 1 7 . 1 1 25 25 ASN CB C 25 42.500 42.500 38.910 3.590 25281 3501 1 7 . 1 1 25 25 ASN H H 25 8.150 8.150 7.973 0.177 25281 3502 1 7 . 1 1 26 26 PRO CA C 26 63.340 63.340 62.539 0.801 25281 3503 1 7 . 1 1 26 26 PRO CB C 26 30.940 30.940 33.008 -2.068 25281 3504 1 7 . 1 1 27 27 ARG N N 27 120.730 120.730 118.023 2.707 25281 3505 1 7 . 1 1 27 27 ARG CA C 27 54.340 54.340 54.696 -0.356 25281 3506 1 7 . 1 1 27 27 ARG CB C 27 33.500 33.500 31.617 1.883 25281 3507 1 7 . 1 1 27 27 ARG H H 27 8.290 8.290 8.312 -0.022 25281 3508 1 7 . 1 1 28 28 GLY N N 28 112.000 112.000 109.903 2.097 25281 3509 1 7 . 1 1 28 28 GLY CA C 28 46.940 46.940 44.732 2.208 25281 3510 1 7 . 1 1 28 28 GLY H H 28 8.810 8.810 7.905 0.905 25281 3511 1 7 . 1 1 29 29 PHE N N 29 121.230 121.230 118.194 3.036 25281 3512 1 7 . 1 1 29 29 PHE CA C 29 55.230 55.230 56.955 -1.725 25281 3513 1 7 . 1 1 29 29 PHE CB C 29 43.700 43.700 43.061 0.639 25281 3514 1 7 . 1 1 29 29 PHE H H 29 8.470 8.470 8.474 -0.004 25281 3515 1 7 . 1 1 30 30 ASN N N 30 117.250 117.250 121.572 -4.322 25281 3516 1 7 . 1 1 30 30 ASN CA C 30 50.220 50.220 52.271 -2.051 25281 3517 1 7 . 1 1 30 30 ASN CB C 30 45.810 45.810 41.532 4.278 25281 3518 1 7 . 1 1 30 30 ASN H H 30 8.630 8.630 8.582 0.048 25281 3519 1 7 . 1 1 31 31 LEU N N 31 128.180 128.180 122.038 6.142 25281 3520 1 7 . 1 1 31 31 LEU CA C 31 53.930 53.930 53.543 0.387 25281 3521 1 7 . 1 1 31 31 LEU CB C 31 45.810 45.810 45.476 0.334 25281 3522 1 7 . 1 1 31 31 LEU H H 31 9.080 9.080 8.431 0.649 25281 3523 1 7 . 1 1 32 32 LYS N N 32 119.980 119.980 116.993 2.987 25281 3524 1 7 . 1 1 32 32 LYS CA C 32 55.730 55.730 55.212 0.517 25281 3525 1 7 . 1 1 32 32 LYS CB C 32 36.070 36.070 36.375 -0.305 25281 3526 1 7 . 1 1 32 32 LYS H H 32 8.780 8.780 7.981 0.799 25281 3527 1 7 . 1 1 33 33 TYR N N 33 121.500 121.500 118.374 3.126 25281 3528 1 7 . 1 1 33 33 TYR CA C 33 55.830 55.830 57.000 -1.170 25281 3529 1 7 . 1 1 33 33 TYR CB C 33 42.110 42.110 42.635 -0.525 25281 3530 1 7 . 1 1 33 33 TYR H H 33 8.640 8.640 8.179 0.461 25281 3531 1 7 . 1 1 34 34 ARG N N 34 128.980 128.980 122.837 6.143 25281 3532 1 7 . 1 1 34 34 ARG CA C 34 52.690 52.690 55.003 -2.313 25281 3533 1 7 . 1 1 34 34 ARG CB C 34 34.320 34.320 33.928 0.392 25281 3534 1 7 . 1 1 34 34 ARG H H 34 8.830 8.830 8.669 0.161 25281 3535 1 7 . 1 1 35 35 TYR N N 35 124.820 124.820 127.841 -3.021 25281 3536 1 7 . 1 1 35 35 TYR CA C 35 56.640 56.640 56.842 -0.202 25281 3537 1 7 . 1 1 35 35 TYR CB C 35 41.980 41.980 40.842 1.139 25281 3538 1 7 . 1 1 35 35 TYR H H 35 8.840 8.840 8.166 0.674 25281 3539 1 7 . 1 1 39 39 ASN N N 39 127.690 127.690 117.637 10.053 25281 3540 1 7 . 1 1 39 39 ASN CA C 39 54.850 54.850 54.597 0.253 25281 3541 1 7 . 1 1 39 39 ASN CB C 39 38.290 38.290 37.075 1.215 25281 3542 1 7 . 1 1 39 39 ASN H H 39 7.990 7.990 8.954 -0.964 25281 3543 1 7 . 1 1 40 40 ASP N N 40 115.200 115.200 117.227 -2.027 25281 3544 1 7 . 1 1 40 40 ASP CA C 40 55.210 55.210 53.122 2.088 25281 3545 1 7 . 1 1 40 40 ASP CB C 40 44.010 44.010 43.068 0.942 25281 3546 1 7 . 1 1 40 40 ASP H H 40 8.370 8.370 7.731 0.639 25281 3547 1 7 . 1 1 41 41 TRP N N 41 124.210 124.210 119.392 4.818 25281 3548 1 7 . 1 1 41 41 TRP CA C 41 55.840 55.840 55.893 -0.053 25281 3549 1 7 . 1 1 41 41 TRP CB C 41 33.540 33.540 30.932 2.608 25281 3550 1 7 . 1 1 41 41 TRP H H 41 9.130 9.130 8.148 0.982 25281 3551 1 7 . 1 1 42 42 GLY N N 42 107.800 107.800 104.998 2.802 25281 3552 1 7 . 1 1 42 42 GLY CA C 42 45.870 45.870 45.046 0.824 25281 3553 1 7 . 1 1 42 42 GLY H H 42 8.610 8.610 8.065 0.545 25281 3554 1 7 . 1 1 43 43 VAL N N 43 116.260 116.260 118.910 -2.650 25281 3555 1 7 . 1 1 43 43 VAL CA C 43 58.980 58.980 59.325 -0.345 25281 3556 1 7 . 1 1 43 43 VAL CB C 43 35.430 35.430 35.561 -0.131 25281 3557 1 7 . 1 1 43 43 VAL H H 43 8.880 8.880 7.935 0.945 25281 3558 1 7 . 1 1 44 44 ILE N N 44 124.720 124.720 121.179 3.541 25281 3559 1 7 . 1 1 44 44 ILE CA C 44 58.390 58.390 58.510 -0.120 25281 3560 1 7 . 1 1 44 44 ILE CB C 44 42.890 42.890 41.422 1.468 25281 3561 1 7 . 1 1 44 44 ILE H H 44 9.110 9.110 8.038 1.072 25281 3562 1 7 . 1 1 45 45 GLY N N 45 110.610 110.610 108.671 1.939 25281 3563 1 7 . 1 1 45 45 GLY CA C 45 43.150 43.150 43.983 -0.833 25281 3564 1 7 . 1 1 45 45 GLY H H 45 8.910 8.910 8.070 0.840 25281 3565 1 7 . 1 1 46 46 SER N N 46 116.210 116.210 119.512 -3.302 25281 3566 1 7 . 1 1 46 46 SER CA C 46 56.250 56.250 57.349 -1.099 25281 3567 1 7 . 1 1 46 46 SER CB C 46 63.720 63.720 65.956 -2.236 25281 3568 1 7 . 1 1 46 46 SER H H 46 9.250 9.250 8.670 0.580 25281 3569 1 7 . 1 1 47 47 PHE N N 47 126.400 126.400 123.035 3.365 25281 3570 1 7 . 1 1 47 47 PHE CA C 47 55.090 55.090 56.303 -1.213 25281 3571 1 7 . 1 1 47 47 PHE CB C 47 42.560 42.560 42.778 -0.218 25281 3572 1 7 . 1 1 47 47 PHE H H 47 8.940 8.940 8.980 -0.040 25281 3573 1 7 . 1 1 48 48 ALA N N 48 131.930 131.930 123.641 8.289 25281 3574 1 7 . 1 1 48 48 ALA CA C 48 50.350 50.350 50.497 -0.147 25281 3575 1 7 . 1 1 48 48 ALA CB C 48 21.280 21.280 23.165 -1.885 25281 3576 1 7 . 1 1 48 48 ALA H H 48 8.790 8.790 8.265 0.525 25281 3577 1 7 . 1 1 49 49 GLN N N 49 116.070 116.070 119.380 -3.310 25281 3578 1 7 . 1 1 49 49 GLN CA C 49 54.110 54.110 54.702 -0.592 25281 3579 1 7 . 1 1 49 49 GLN CB C 49 31.140 31.140 33.205 -2.065 25281 3580 1 7 . 1 1 49 49 GLN H H 49 7.720 7.720 8.361 -0.641 25281 3581 1 7 . 1 1 50 50 THR N N 50 115.990 115.990 115.315 0.675 25281 3582 1 7 . 1 1 50 50 THR CA C 50 59.270 59.270 61.006 -1.736 25281 3583 1 7 . 1 1 50 50 THR CB C 50 70.980 70.980 71.136 -0.156 25281 3584 1 7 . 1 1 50 50 THR H H 50 9.470 9.470 8.504 0.966 25281 3585 1 7 . 1 1 51 51 ARG N N 51 117.600 117.600 124.337 -6.737 25281 3586 1 7 . 1 1 51 51 ARG CA C 51 55.350 55.350 54.739 0.611 25281 3587 1 7 . 1 1 51 51 ARG CB C 51 33.610 33.610 33.135 0.475 25281 3588 1 7 . 1 1 51 51 ARG H H 51 8.600 8.600 8.028 0.572 25281 3589 1 7 . 1 1 52 52 ARG N N 52 121.400 121.400 126.588 -5.188 25281 3590 1 7 . 1 1 52 52 ARG CA C 52 56.910 56.910 56.199 0.711 25281 3591 1 7 . 1 1 52 52 ARG CB C 52 29.370 29.370 31.105 -1.736 25281 3592 1 7 . 1 1 52 52 ARG H H 52 8.380 8.380 8.110 0.270 25281 3593 1 7 . 1 1 53 53 GLY N N 53 111.040 111.040 111.400 -0.360 25281 3594 1 7 . 1 1 53 53 GLY CA C 53 45.190 45.190 45.362 -0.172 25281 3595 1 7 . 1 1 53 53 GLY H H 53 8.330 8.330 8.937 -0.607 25281 3596 1 7 . 1 1 54 54 PHE N N 54 119.210 119.210 117.707 1.503 25281 3597 1 7 . 1 1 54 54 PHE CA C 54 55.670 55.670 55.845 -0.175 25281 3598 1 7 . 1 1 54 54 PHE CB C 54 29.220 29.220 42.509 -13.289 25281 3599 1 7 . 1 1 54 54 PHE H H 54 7.720 7.720 7.762 -0.042 25281 3600 1 7 . 1 1 55 55 GLU N N 55 123.470 123.470 120.965 2.505 25281 3601 1 7 . 1 1 55 55 GLU CA C 55 55.580 55.580 55.965 -0.385 25281 3602 1 7 . 1 1 55 55 GLU CB C 55 32.920 32.920 30.186 2.734 25281 3603 1 7 . 1 1 55 55 GLU H H 55 8.400 8.400 7.339 1.061 25281 3604 1 7 . 1 1 56 56 GLU N N 56 121.950 121.950 120.905 1.045 25281 3605 1 7 . 1 1 56 56 GLU CA C 56 56.690 56.690 57.454 -0.764 25281 3606 1 7 . 1 1 56 56 GLU CB C 56 29.450 29.450 29.425 0.025 25281 3607 1 7 . 1 1 56 56 GLU H H 56 8.500 8.500 8.715 -0.215 25281 3608 1 7 . 1 1 57 57 SER N N 57 123.330 123.330 120.297 3.033 25281 3609 1 7 . 1 1 57 57 SER CA C 57 55.090 55.090 57.518 -2.428 25281 3610 1 7 . 1 1 57 57 SER CB C 57 64.890 64.890 64.882 0.008 25281 3611 1 7 . 1 1 57 57 SER H H 57 8.640 8.640 8.518 0.122 25281 3612 1 7 . 1 1 58 58 VAL N N 58 122.060 122.060 125.146 -3.086 25281 3613 1 7 . 1 1 58 58 VAL CA C 58 57.660 57.660 61.612 -3.952 25281 3614 1 7 . 1 1 58 58 VAL CB C 58 31.640 31.640 34.474 -2.834 25281 3615 1 7 . 1 1 58 58 VAL H H 58 8.480 8.480 8.679 -0.199 25281 3616 1 7 . 1 1 59 59 ASP N N 59 123.390 123.390 125.985 -2.595 25281 3617 1 7 . 1 1 59 59 ASP CA C 59 54.960 54.960 54.541 0.419 25281 3618 1 7 . 1 1 59 59 ASP CB C 59 42.840 42.840 42.754 0.086 25281 3619 1 7 . 1 1 59 59 ASP H H 59 9.360 9.360 8.927 0.433 25281 3620 1 7 . 1 1 60 60 GLY N N 60 105.230 105.230 107.730 -2.500 25281 3621 1 7 . 1 1 60 60 GLY CA C 60 45.130 45.130 45.245 -0.114 25281 3622 1 7 . 1 1 60 60 GLY H H 60 8.210 8.210 7.710 0.500 25281 3623 1 7 . 1 1 61 61 PHE N N 61 121.440 121.440 121.450 -0.010 25281 3624 1 7 . 1 1 61 61 PHE CA C 61 57.330 57.330 57.440 -0.110 25281 3625 1 7 . 1 1 61 61 PHE CB C 61 39.420 39.420 38.524 0.896 25281 3626 1 7 . 1 1 61 61 PHE H H 61 8.330 8.330 8.356 -0.026 25281 3627 1 7 . 1 1 62 62 LYS N N 62 119.870 119.870 126.211 -6.341 25281 3628 1 7 . 1 1 62 62 LYS CA C 62 56.340 56.340 54.503 1.837 25281 3629 1 7 . 1 1 62 62 LYS CB C 62 33.850 33.850 35.546 -1.696 25281 3630 1 7 . 1 1 62 62 LYS H H 62 8.480 8.480 7.766 0.714 25281 3631 1 7 . 1 1 63 63 LEU N N 63 125.160 125.160 122.503 2.657 25281 3632 1 7 . 1 1 63 63 LEU CA C 63 56.220 56.220 57.449 -1.229 25281 3633 1 7 . 1 1 63 63 LEU CB C 63 41.520 41.520 41.484 0.036 25281 3634 1 7 . 1 1 63 63 LEU H H 63 8.910 8.910 8.313 0.597 25281 3635 1 7 . 1 1 64 64 ILE N N 64 119.660 119.660 118.231 1.429 25281 3636 1 7 . 1 1 64 64 ILE CA C 64 62.420 62.420 64.151 -1.731 25281 3637 1 7 . 1 1 64 64 ILE CB C 64 37.700 37.700 37.215 0.485 25281 3638 1 7 . 1 1 64 64 ILE H H 64 8.210 8.210 7.723 0.487 25281 3639 1 7 . 1 1 65 65 ASP N N 65 117.080 117.080 119.969 -2.889 25281 3640 1 7 . 1 1 65 65 ASP CA C 65 57.420 57.420 56.523 0.897 25281 3641 1 7 . 1 1 65 65 ASP CB C 65 38.350 38.350 40.178 -1.828 25281 3642 1 7 . 1 1 65 65 ASP H H 65 7.710 7.710 8.120 -0.410 25281 3643 1 7 . 1 1 66 66 GLY N N 66 106.440 106.440 105.951 0.489 25281 3644 1 7 . 1 1 66 66 GLY CA C 66 45.170 45.170 45.665 -0.495 25281 3645 1 7 . 1 1 66 66 GLY H H 66 7.920 7.920 7.512 0.408 25281 3646 1 7 . 1 1 67 67 ASP N N 67 118.490 118.490 119.461 -0.971 25281 3647 1 7 . 1 1 67 67 ASP CA C 67 57.340 57.340 55.990 1.350 25281 3648 1 7 . 1 1 67 67 ASP CB C 67 29.870 29.870 39.947 -10.077 25281 3649 1 7 . 1 1 67 67 ASP H H 67 7.820 7.820 7.491 0.329 25281 3650 1 7 . 1 1 68 68 PHE N N 68 125.320 125.320 118.507 6.813 25281 3651 1 7 . 1 1 68 68 PHE CA C 68 56.090 56.090 57.541 -1.451 25281 3652 1 7 . 1 1 68 68 PHE CB C 68 41.940 41.940 42.745 -0.805 25281 3653 1 7 . 1 1 68 68 PHE H H 68 8.310 8.310 8.256 0.054 25281 3654 1 7 . 1 1 69 69 LYS N N 69 124.770 124.770 122.074 2.696 25281 3655 1 7 . 1 1 69 69 LYS CA C 69 54.880 54.880 54.873 0.007 25281 3656 1 7 . 1 1 69 69 LYS CB C 69 36.920 36.920 35.581 1.339 25281 3657 1 7 . 1 1 69 69 LYS H H 69 8.730 8.730 8.643 0.087 25281 3658 1 7 . 1 1 70 70 TYR N N 70 123.740 123.740 128.849 -5.109 25281 3659 1 7 . 1 1 70 70 TYR CA C 70 55.540 55.540 56.554 -1.014 25281 3660 1 7 . 1 1 70 70 TYR CB C 70 40.150 40.150 41.957 -1.807 25281 3661 1 7 . 1 1 70 70 TYR H H 70 8.680 8.680 8.429 0.251 25281 3662 1 7 . 1 1 71 71 TYR N N 71 123.920 123.920 130.173 -6.253 25281 3663 1 7 . 1 1 71 71 TYR CA C 71 54.500 54.500 56.263 -1.763 25281 3664 1 7 . 1 1 71 71 TYR CB C 71 42.420 42.420 42.378 0.042 25281 3665 1 7 . 1 1 71 71 TYR H H 71 8.620 8.620 8.207 0.413 25281 3666 1 7 . 1 1 72 72 SER N N 72 113.820 113.820 119.679 -5.859 25281 3667 1 7 . 1 1 72 72 SER CA C 72 56.320 56.320 56.775 -0.455 25281 3668 1 7 . 1 1 72 72 SER CB C 72 65.790 65.790 66.653 -0.863 25281 3669 1 7 . 1 1 72 72 SER H H 72 8.800 8.800 8.027 0.773 25281 3670 1 7 . 1 1 73 73 VAL N N 73 119.260 119.260 121.547 -2.287 25281 3671 1 7 . 1 1 73 73 VAL CA C 73 60.730 60.730 61.363 -0.633 25281 3672 1 7 . 1 1 73 73 VAL CB C 73 33.870 33.870 34.742 -0.872 25281 3673 1 7 . 1 1 73 73 VAL H H 73 8.170 8.170 7.932 0.238 25281 3674 1 7 . 1 1 74 74 THR N N 74 115.360 115.360 116.998 -1.638 25281 3675 1 7 . 1 1 74 74 THR CA C 74 59.040 59.040 59.537 -0.497 25281 3676 1 7 . 1 1 74 74 THR CB C 74 73.250 73.250 72.100 1.150 25281 3677 1 7 . 1 1 74 74 THR H H 74 9.200 9.200 8.584 0.616 25281 3678 1 7 . 1 1 75 75 ALA N N 75 119.330 119.330 122.980 -3.650 25281 3679 1 7 . 1 1 75 75 ALA CA C 75 51.390 51.390 51.682 -0.292 25281 3680 1 7 . 1 1 75 75 ALA CB C 75 22.380 22.380 22.256 0.124 25281 3681 1 7 . 1 1 75 75 ALA H H 75 9.130 9.130 8.793 0.337 25281 3682 1 7 . 1 1 76 76 GLY N N 76 103.130 103.130 105.609 -2.479 25281 3683 1 7 . 1 1 76 76 GLY CA C 76 45.900 45.900 44.724 1.176 25281 3684 1 7 . 1 1 76 76 GLY H H 76 8.760 8.760 7.983 0.777 25281 3685 1 7 . 1 1 77 77 PRO CA C 77 61.250 61.250 62.540 -1.290 25281 3686 1 7 . 1 1 77 77 PRO CB C 77 32.590 32.590 32.937 -0.347 25281 3687 1 7 . 1 1 78 78 VAL N N 78 115.250 115.250 118.862 -3.612 25281 3688 1 7 . 1 1 78 78 VAL CA C 78 58.430 58.430 61.763 -3.333 25281 3689 1 7 . 1 1 78 78 VAL CB C 78 32.700 32.700 34.835 -2.135 25281 3690 1 7 . 1 1 78 78 VAL H H 78 8.240 8.240 8.124 0.116 25281 3691 1 7 . 1 1 79 79 PHE N N 79 130.610 130.610 125.876 4.734 25281 3692 1 7 . 1 1 79 79 PHE CA C 79 55.090 55.090 56.743 -1.653 25281 3693 1 7 . 1 1 79 79 PHE CB C 79 41.590 41.590 42.904 -1.314 25281 3694 1 7 . 1 1 79 79 PHE H H 79 9.540 9.540 8.405 1.135 25281 3695 1 7 . 1 1 80 80 ARG N N 80 130.350 130.350 123.165 7.185 25281 3696 1 7 . 1 1 80 80 ARG CA C 80 55.490 55.490 55.256 0.234 25281 3697 1 7 . 1 1 80 80 ARG CB C 80 29.520 29.520 31.766 -2.246 25281 3698 1 7 . 1 1 80 80 ARG H H 80 8.810 8.810 8.652 0.158 25281 3699 1 7 . 1 1 81 81 ILE N N 81 127.480 127.480 123.438 4.042 25281 3700 1 7 . 1 1 81 81 ILE CA C 81 62.850 62.850 61.968 0.882 25281 3701 1 7 . 1 1 81 81 ILE CB C 81 37.650 37.650 38.478 -0.828 25281 3702 1 7 . 1 1 81 81 ILE H H 81 8.260 8.260 9.202 -0.942 25281 3703 1 7 . 1 1 82 82 ASN N N 82 113.110 113.110 115.918 -2.808 25281 3704 1 7 . 1 1 82 82 ASN CA C 82 55.630 55.630 52.405 3.225 25281 3705 1 7 . 1 1 82 82 ASN CB C 82 43.210 43.210 39.467 3.743 25281 3706 1 7 . 1 1 82 82 ASN H H 82 7.970 7.970 7.897 0.073 25281 3707 1 7 . 1 1 85 85 VAL N N 85 118.090 118.090 117.003 1.087 25281 3708 1 7 . 1 1 85 85 VAL CA C 85 61.120 61.120 61.385 -0.265 25281 3709 1 7 . 1 1 85 85 VAL CB C 85 34.910 34.910 34.372 0.538 25281 3710 1 7 . 1 1 85 85 VAL H H 85 7.840 7.840 7.830 0.010 25281 3711 1 7 . 1 1 86 86 SER N N 86 119.050 119.050 121.961 -2.911 25281 3712 1 7 . 1 1 86 86 SER CA C 86 57.100 57.100 56.994 0.106 25281 3713 1 7 . 1 1 86 86 SER CB C 86 65.400 65.400 66.467 -1.067 25281 3714 1 7 . 1 1 86 86 SER H H 86 8.240 8.240 8.058 0.182 25281 3715 1 7 . 1 1 87 87 LEU N N 87 124.640 124.640 125.011 -0.371 25281 3716 1 7 . 1 1 87 87 LEU CA C 87 53.750 53.750 54.467 -0.717 25281 3717 1 7 . 1 1 87 87 LEU CB C 87 46.320 46.320 45.289 1.031 25281 3718 1 7 . 1 1 87 87 LEU H H 87 9.130 9.130 8.607 0.523 25281 3719 1 7 . 1 1 88 88 TYR N N 88 118.740 118.740 122.212 -3.472 25281 3720 1 7 . 1 1 88 88 TYR CA C 88 55.080 55.080 55.983 -0.903 25281 3721 1 7 . 1 1 88 88 TYR CB C 88 42.630 42.630 41.086 1.544 25281 3722 1 7 . 1 1 88 88 TYR H H 88 8.740 8.740 7.964 0.776 25281 3723 1 7 . 1 1 89 89 GLY N N 89 103.920 103.920 107.107 -3.187 25281 3724 1 7 . 1 1 89 89 GLY CA C 89 43.250 43.250 43.317 -0.067 25281 3725 1 7 . 1 1 89 89 GLY H H 89 7.720 7.720 8.451 -0.731 25281 3726 1 7 . 1 1 90 90 LEU N N 90 117.530 117.530 123.550 -6.020 25281 3727 1 7 . 1 1 90 90 LEU CA C 90 53.200 53.200 53.953 -0.753 25281 3728 1 7 . 1 1 90 90 LEU CB C 90 45.810 45.810 45.444 0.366 25281 3729 1 7 . 1 1 90 90 LEU H H 90 8.520 8.520 8.312 0.208 25281 3730 1 7 . 1 1 91 91 LEU N N 91 120.670 120.670 121.219 -0.549 25281 3731 1 7 . 1 1 91 91 LEU CA C 91 53.590 53.590 53.478 0.112 25281 3732 1 7 . 1 1 91 91 LEU CB C 91 46.330 46.330 45.844 0.486 25281 3733 1 7 . 1 1 91 91 LEU H H 91 9.250 9.250 7.978 1.272 25281 3734 1 7 . 1 1 92 92 GLY N N 92 108.770 108.770 107.153 1.617 25281 3735 1 7 . 1 1 92 92 GLY CA C 92 46.520 46.520 46.171 0.349 25281 3736 1 7 . 1 1 92 92 GLY H H 92 8.480 8.480 8.347 0.133 25281 3737 1 7 . 1 1 93 93 ALA N N 93 126.760 126.760 121.063 5.697 25281 3738 1 7 . 1 1 93 93 ALA CA C 93 49.890 49.890 51.147 -1.257 25281 3739 1 7 . 1 1 93 93 ALA CB C 93 21.860 21.860 22.781 -0.921 25281 3740 1 7 . 1 1 93 93 ALA H H 93 8.860 8.860 7.838 1.022 25281 3741 1 7 . 1 1 94 94 GLY N N 94 107.510 107.510 107.378 0.132 25281 3742 1 7 . 1 1 94 94 GLY CA C 94 42.760 42.760 44.110 -1.350 25281 3743 1 7 . 1 1 94 94 GLY H H 94 8.880 8.880 8.326 0.554 25281 3744 1 7 . 1 1 95 95 HIS N N 95 122.340 122.340 119.257 3.083 25281 3745 1 7 . 1 1 95 95 HIS CA C 95 54.570 54.570 54.679 -0.109 25281 3746 1 7 . 1 1 95 95 HIS CB C 95 32.700 32.700 34.635 -1.935 25281 3747 1 7 . 1 1 95 95 HIS H H 95 9.200 9.200 8.218 0.982 25281 3748 1 7 . 1 1 96 96 GLY N N 96 112.170 112.170 108.234 3.936 25281 3749 1 7 . 1 1 96 96 GLY CA C 96 43.150 43.150 44.426 -1.276 25281 3750 1 7 . 1 1 96 96 GLY H H 96 8.620 8.620 8.433 0.187 25281 3751 1 7 . 1 1 97 97 LYS N N 97 120.580 120.580 123.711 -3.131 25281 3752 1 7 . 1 1 97 97 LYS CA C 97 54.890 54.890 54.887 0.003 25281 3753 1 7 . 1 1 97 97 LYS CB C 97 35.560 35.560 36.024 -0.464 25281 3754 1 7 . 1 1 97 97 LYS H H 97 9.010 9.010 9.135 -0.125 25281 3755 1 7 . 1 1 98 98 ALA N N 98 126.740 126.740 125.655 1.085 25281 3756 1 7 . 1 1 98 98 ALA CA C 98 50.020 50.020 51.643 -1.623 25281 3757 1 7 . 1 1 98 98 ALA CB C 98 22.380 22.380 21.959 0.421 25281 3758 1 7 . 1 1 98 98 ALA H H 98 9.120 9.120 8.329 0.791 25281 3759 1 7 . 1 1 99 99 LYS N N 99 122.360 122.360 125.250 -2.890 25281 3760 1 7 . 1 1 99 99 LYS CA C 99 55.090 55.090 56.127 -1.037 25281 3761 1 7 . 1 1 99 99 LYS CB C 99 34.970 34.970 35.080 -0.109 25281 3762 1 7 . 1 1 99 99 LYS H H 99 8.580 8.580 8.441 0.139 25281 3763 1 7 . 1 1 100 100 PHE N N 100 121.170 121.170 122.564 -1.394 25281 3764 1 7 . 1 1 100 100 PHE CA C 100 56.390 56.390 56.988 -0.598 25281 3765 1 7 . 1 1 100 100 PHE CB C 100 42.110 42.110 39.975 2.135 25281 3766 1 7 . 1 1 100 100 PHE H H 100 8.750 8.750 8.293 0.457 25281 3767 1 7 . 1 1 101 101 SER N N 101 117.280 117.280 115.432 1.848 25281 3768 1 7 . 1 1 101 101 SER CA C 101 57.070 57.070 57.543 -0.473 25281 3769 1 7 . 1 1 101 101 SER CB C 101 65.830 65.830 64.706 1.124 25281 3770 1 7 . 1 1 101 101 SER H H 101 8.990 8.990 8.192 0.798 25281 3771 1 7 . 1 1 102 102 SER N N 102 117.600 117.600 116.217 1.383 25281 3772 1 7 . 1 1 102 102 SER CA C 102 56.500 56.500 57.676 -1.177 25281 3773 1 7 . 1 1 102 102 SER CB C 102 67.540 67.540 63.358 4.181 25281 3774 1 7 . 1 1 102 102 SER H H 102 8.680 8.680 8.456 0.224 25281 3775 1 7 . 1 1 103 103 ILE N N 103 114.980 114.980 124.779 -9.799 25281 3776 1 7 . 1 1 103 103 ILE CA C 103 59.180 59.180 60.015 -0.835 25281 3777 1 7 . 1 1 103 103 ILE CB C 103 40.550 40.550 40.517 0.033 25281 3778 1 7 . 1 1 103 103 ILE H H 103 7.700 7.700 8.146 -0.446 25281 3779 1 7 . 1 1 104 104 PHE N N 104 123.710 123.710 122.580 1.130 25281 3780 1 7 . 1 1 104 104 PHE CA C 104 53.190 53.190 57.905 -4.715 25281 3781 1 7 . 1 1 104 104 PHE CB C 104 43.900 43.900 39.437 4.463 25281 3782 1 7 . 1 1 104 104 PHE H H 104 8.590 8.590 8.680 -0.090 25281 3783 1 7 . 1 1 105 105 GLY N N 105 109.080 109.080 111.305 -2.225 25281 3784 1 7 . 1 1 105 105 GLY CA C 105 45.420 45.420 44.402 1.018 25281 3785 1 7 . 1 1 105 105 GLY H H 105 8.400 8.400 8.413 -0.013 25281 3786 1 7 . 1 1 106 106 GLN N N 106 119.680 119.680 120.299 -0.619 25281 3787 1 7 . 1 1 106 106 GLN CA C 106 53.720 53.720 55.475 -1.755 25281 3788 1 7 . 1 1 106 106 GLN CB C 106 30.100 30.100 29.864 0.236 25281 3789 1 7 . 1 1 106 106 GLN H H 106 8.530 8.530 8.366 0.164 25281 3790 1 7 . 1 1 107 107 SER N N 107 119.160 119.160 117.835 1.325 25281 3791 1 7 . 1 1 107 107 SER CA C 107 57.360 57.360 57.940 -0.580 25281 3792 1 7 . 1 1 107 107 SER CB C 107 66.050 66.050 64.432 1.618 25281 3793 1 7 . 1 1 107 107 SER H H 107 8.800 8.800 8.438 0.362 25281 3794 1 7 . 1 1 108 108 GLU N N 108 125.360 125.360 120.552 4.808 25281 3795 1 7 . 1 1 108 108 GLU CA C 108 58.910 58.910 55.118 3.792 25281 3796 1 7 . 1 1 108 108 GLU CB C 108 40.880 40.880 32.444 8.435 25281 3797 1 7 . 1 1 108 108 GLU H H 108 8.960 8.960 8.450 0.510 25281 3798 1 7 . 1 1 109 109 SER N N 109 118.890 118.890 115.896 2.994 25281 3799 1 7 . 1 1 109 109 SER CA C 109 56.710 56.710 57.717 -1.006 25281 3800 1 7 . 1 1 109 109 SER CB C 109 66.180 66.180 64.939 1.241 25281 3801 1 7 . 1 1 109 109 SER H H 109 9.080 9.080 8.357 0.723 25281 3802 1 7 . 1 1 110 110 ARG N N 110 119.830 119.830 126.272 -6.442 25281 3803 1 7 . 1 1 110 110 ARG CA C 110 58.390 58.390 55.803 2.587 25281 3804 1 7 . 1 1 110 110 ARG CB C 110 40.940 40.940 33.525 7.415 25281 3805 1 7 . 1 1 110 110 ARG H H 110 8.850 8.850 8.314 0.536 25281 3806 1 7 . 1 1 111 111 SER N N 111 114.870 114.870 117.753 -2.883 25281 3807 1 7 . 1 1 111 111 SER CA C 111 57.290 57.290 56.903 0.387 25281 3808 1 7 . 1 1 111 111 SER CB C 111 66.110 66.110 66.385 -0.274 25281 3809 1 7 . 1 1 111 111 SER H H 111 8.740 8.740 8.462 0.278 25281 3810 1 7 . 1 1 112 112 LYS N N 112 120.870 120.870 121.271 -0.401 25281 3811 1 7 . 1 1 112 112 LYS CA C 112 55.150 55.150 55.774 -0.624 25281 3812 1 7 . 1 1 112 112 LYS CB C 112 36.330 36.330 35.496 0.834 25281 3813 1 7 . 1 1 112 112 LYS H H 112 8.520 8.520 8.284 0.236 25281 3814 1 7 . 1 1 113 113 THR N N 113 121.390 121.390 120.225 1.165 25281 3815 1 7 . 1 1 113 113 THR CA C 113 61.250 61.250 61.996 -0.746 25281 3816 1 7 . 1 1 113 113 THR CB C 113 70.010 70.010 69.894 0.116 25281 3817 1 7 . 1 1 113 113 THR H H 113 8.440 8.440 8.478 -0.038 25281 3818 1 7 . 1 1 114 114 SER N N 114 120.730 120.730 121.032 -0.302 25281 3819 1 7 . 1 1 114 114 SER CA C 114 56.190 56.190 57.123 -0.933 25281 3820 1 7 . 1 1 114 114 SER CB C 114 66.380 66.380 64.346 2.034 25281 3821 1 7 . 1 1 114 114 SER H H 114 9.350 9.350 8.220 1.130 25281 3822 1 7 . 1 1 115 115 LEU N N 115 121.540 121.540 124.002 -2.462 25281 3823 1 7 . 1 1 115 115 LEU CA C 115 55.480 55.480 53.883 1.597 25281 3824 1 7 . 1 1 115 115 LEU CB C 115 42.890 42.890 45.231 -2.341 25281 3825 1 7 . 1 1 115 115 LEU H H 115 8.200 8.200 8.438 -0.238 25281 3826 1 7 . 1 1 116 116 ALA N N 116 129.060 129.060 123.407 5.653 25281 3827 1 7 . 1 1 116 116 ALA CA C 116 49.960 49.960 50.239 -0.279 25281 3828 1 7 . 1 1 116 116 ALA CB C 116 20.310 20.310 22.182 -1.872 25281 3829 1 7 . 1 1 116 116 ALA H H 116 8.600 8.600 8.449 0.151 25281 3830 1 7 . 1 1 117 117 TYR N N 117 115.890 115.890 125.427 -9.537 25281 3831 1 7 . 1 1 117 117 TYR CA C 117 55.150 55.150 57.229 -2.079 25281 3832 1 7 . 1 1 117 117 TYR CB C 117 41.200 41.200 42.040 -0.840 25281 3833 1 7 . 1 1 117 117 TYR H H 117 8.450 8.450 7.809 0.641 25281 3834 1 7 . 1 1 118 118 GLY N N 118 107.330 107.330 111.067 -3.737 25281 3835 1 7 . 1 1 118 118 GLY CA C 118 45.940 45.940 45.342 0.598 25281 3836 1 7 . 1 1 118 118 GLY H H 118 9.340 9.340 7.819 1.521 25281 3837 1 7 . 1 1 119 119 ALA N N 119 118.880 118.880 119.516 -0.636 25281 3838 1 7 . 1 1 119 119 ALA CA C 119 51.320 51.320 50.587 0.733 25281 3839 1 7 . 1 1 119 119 ALA CB C 119 22.120 22.120 22.300 -0.180 25281 3840 1 7 . 1 1 119 119 ALA H H 119 8.770 8.770 7.029 1.741 25281 3841 1 7 . 1 1 120 120 GLY N N 120 105.730 105.730 105.131 0.599 25281 3842 1 7 . 1 1 120 120 GLY CA C 120 45.650 45.650 44.132 1.518 25281 3843 1 7 . 1 1 120 120 GLY H H 120 7.940 7.940 7.432 0.508 25281 3844 1 7 . 1 1 121 121 LEU N N 121 115.480 115.480 119.755 -4.275 25281 3845 1 7 . 1 1 121 121 LEU CA C 121 52.980 52.980 53.124 -0.144 25281 3846 1 7 . 1 1 121 121 LEU CB C 121 46.460 46.460 45.839 0.621 25281 3847 1 7 . 1 1 121 121 LEU H H 121 9.010 9.010 7.955 1.055 25281 3848 1 7 . 1 1 122 122 GLN N N 122 112.530 112.530 121.619 -9.089 25281 3849 1 7 . 1 1 122 122 GLN CA C 122 54.780 54.780 54.183 0.597 25281 3850 1 7 . 1 1 122 122 GLN CB C 122 31.400 31.400 32.310 -0.910 25281 3851 1 7 . 1 1 122 122 GLN H H 122 8.090 8.090 7.956 0.134 25281 3852 1 7 . 1 1 123 123 PHE N N 123 126.050 126.050 123.737 2.313 25281 3853 1 7 . 1 1 123 123 PHE CA C 123 54.180 54.180 55.940 -1.760 25281 3854 1 7 . 1 1 123 123 PHE CB C 123 42.560 42.560 42.745 -0.185 25281 3855 1 7 . 1 1 123 123 PHE H H 123 10.020 10.020 8.594 1.426 25281 3856 1 7 . 1 1 124 124 ASN N N 124 121.910 121.910 120.546 1.364 25281 3857 1 7 . 1 1 124 124 ASN CA C 124 50.940 50.940 50.049 0.891 25281 3858 1 7 . 1 1 124 124 ASN CB C 124 40.360 40.360 40.733 -0.373 25281 3859 1 7 . 1 1 124 124 ASN H H 124 9.520 9.520 8.276 1.244 25281 3860 1 7 . 1 1 125 125 PRO CA C 125 63.390 63.390 63.038 0.352 25281 3861 1 7 . 1 1 125 125 PRO CB C 125 31.210 31.210 32.490 -1.280 25281 3862 1 7 . 1 1 126 126 HIS N N 126 116.830 116.830 119.922 -3.092 25281 3863 1 7 . 1 1 126 126 HIS CA C 126 54.110 54.110 57.009 -2.899 25281 3864 1 7 . 1 1 126 126 HIS CB C 126 34.910 34.910 29.756 5.154 25281 3865 1 7 . 1 1 126 126 HIS H H 126 7.630 7.630 8.566 -0.936 25281 3866 1 7 . 1 1 127 127 PRO CA C 127 65.370 65.370 63.796 1.574 25281 3867 1 7 . 1 1 127 127 PRO CB C 127 31.030 31.030 31.381 -0.351 25281 3868 1 7 . 1 1 128 128 ASN N N 128 114.680 114.680 116.647 -1.967 25281 3869 1 7 . 1 1 128 128 ASN CA C 128 53.990 53.990 53.498 0.492 25281 3870 1 7 . 1 1 128 128 ASN CB C 128 40.550 40.550 40.421 0.129 25281 3871 1 7 . 1 1 128 128 ASN H H 128 10.460 10.460 7.572 2.888 25281 3872 1 7 . 1 1 129 129 PHE N N 129 119.630 119.630 118.557 1.073 25281 3873 1 7 . 1 1 129 129 PHE CA C 129 56.530 56.530 57.499 -0.969 25281 3874 1 7 . 1 1 129 129 PHE CB C 129 44.310 44.310 42.805 1.505 25281 3875 1 7 . 1 1 129 129 PHE H H 129 8.340 8.340 7.601 0.739 25281 3876 1 7 . 1 1 130 130 VAL N N 130 123.000 123.000 120.101 2.899 25281 3877 1 7 . 1 1 130 130 VAL CA C 130 60.340 60.340 61.527 -1.187 25281 3878 1 7 . 1 1 130 130 VAL CB C 130 34.970 34.970 35.496 -0.526 25281 3879 1 7 . 1 1 130 130 VAL H H 130 7.820 7.820 8.899 -1.079 25281 3880 1 7 . 1 1 131 131 ILE N N 131 124.470 124.470 127.266 -2.796 25281 3881 1 7 . 1 1 131 131 ILE CA C 131 60.210 60.210 59.248 0.962 25281 3882 1 7 . 1 1 131 131 ILE CB C 131 39.510 39.510 41.544 -2.034 25281 3883 1 7 . 1 1 131 131 ILE H H 131 8.830 8.830 8.858 -0.028 25281 3884 1 7 . 1 1 132 132 ASP N N 132 130.700 130.700 129.239 1.461 25281 3885 1 7 . 1 1 132 132 ASP CA C 132 53.530 53.530 53.461 0.069 25281 3886 1 7 . 1 1 132 132 ASP CB C 132 47.620 47.620 44.788 2.832 25281 3887 1 7 . 1 1 132 132 ASP H H 132 9.040 9.040 8.491 0.549 25281 3888 1 7 . 1 1 133 133 ALA N N 133 126.900 126.900 128.374 -1.474 25281 3889 1 7 . 1 1 133 133 ALA CA C 133 51.390 51.390 50.249 1.141 25281 3890 1 7 . 1 1 133 133 ALA CB C 133 21.730 21.730 22.671 -0.941 25281 3891 1 7 . 1 1 133 133 ALA H H 133 8.800 8.800 8.235 0.565 25281 3892 1 7 . 1 1 134 134 SER N N 134 113.760 113.760 117.677 -3.917 25281 3893 1 7 . 1 1 134 134 SER CA C 134 58.140 58.140 57.227 0.912 25281 3894 1 7 . 1 1 134 134 SER CB C 134 67.020 67.020 65.265 1.755 25281 3895 1 7 . 1 1 134 134 SER H H 134 9.160 9.160 8.293 0.867 25281 3896 1 7 . 1 1 135 135 TYR N N 135 118.500 118.500 121.431 -2.931 25281 3897 1 7 . 1 1 135 135 TYR CA C 135 55.690 55.690 56.009 -0.319 25281 3898 1 7 . 1 1 135 135 TYR CB C 135 43.150 43.150 41.566 1.584 25281 3899 1 7 . 1 1 135 135 TYR H H 135 8.820 8.820 7.886 0.934 25281 3900 1 7 . 1 1 136 136 GLU N N 136 126.290 126.290 120.476 5.814 25281 3901 1 7 . 1 1 136 136 GLU CA C 136 53.530 53.530 55.278 -1.748 25281 3902 1 7 . 1 1 136 136 GLU CB C 136 34.450 34.450 33.786 0.664 25281 3903 1 7 . 1 1 136 136 GLU H H 136 8.380 8.380 9.515 -1.135 25281 3904 1 7 . 1 1 137 137 TYR N N 137 123.630 123.630 117.409 6.221 25281 3905 1 7 . 1 1 137 137 TYR CA C 137 55.670 55.670 56.245 -0.575 25281 3906 1 7 . 1 1 137 137 TYR CB C 137 43.150 43.150 41.054 2.096 25281 3907 1 7 . 1 1 137 137 TYR H H 137 9.300 9.300 8.015 1.285 25281 3908 1 7 . 1 1 138 138 SER N N 138 118.300 118.300 115.651 2.649 25281 3909 1 7 . 1 1 138 138 SER CA C 138 58.270 58.270 57.089 1.181 25281 3910 1 7 . 1 1 138 138 SER CB C 138 67.090 67.090 65.967 1.123 25281 3911 1 7 . 1 1 138 138 SER H H 138 7.980 7.980 8.736 -0.756 25281 3912 1 7 . 1 1 139 139 LYS N N 139 127.450 127.450 125.922 1.528 25281 3913 1 7 . 1 1 139 139 LYS CA C 139 55.160 55.160 55.973 -0.813 25281 3914 1 7 . 1 1 139 139 LYS CB C 139 32.640 32.640 33.301 -0.661 25281 3915 1 7 . 1 1 139 139 LYS H H 139 8.630 8.630 8.556 0.074 25281 3916 1 7 . 1 1 140 140 LEU N N 140 129.650 129.650 127.955 1.695 25281 3917 1 7 . 1 1 140 140 LEU CA C 140 52.500 52.500 54.085 -1.585 25281 3918 1 7 . 1 1 140 140 LEU CB C 140 40.000 40.000 44.261 -4.261 25281 3919 1 7 . 1 1 140 140 LEU H H 140 9.060 9.060 8.086 0.974 25281 3920 1 7 . 1 1 141 141 ASP N N 141 121.470 121.470 122.652 -1.182 25281 3921 1 7 . 1 1 141 141 ASP CA C 141 57.190 57.190 57.063 0.127 25281 3922 1 7 . 1 1 141 141 ASP CB C 141 39.730 39.730 41.058 -1.328 25281 3923 1 7 . 1 1 141 141 ASP H H 141 8.590 8.590 8.659 -0.069 25281 3924 1 7 . 1 1 142 142 ASP N N 142 121.510 121.510 118.988 2.522 25281 3925 1 7 . 1 1 142 142 ASP CA C 142 55.180 55.180 55.213 -0.033 25281 3926 1 7 . 1 1 142 142 ASP CB C 142 41.090 41.090 41.297 -0.207 25281 3927 1 7 . 1 1 142 142 ASP H H 142 8.430 8.430 8.397 0.033 25281 3928 1 7 . 1 1 143 143 VAL N N 143 121.420 121.420 118.005 3.415 25281 3929 1 7 . 1 1 143 143 VAL CA C 143 62.240 62.240 61.476 0.764 25281 3930 1 7 . 1 1 143 143 VAL CB C 143 31.280 31.280 35.290 -4.010 25281 3931 1 7 . 1 1 143 143 VAL H H 143 8.020 8.020 7.567 0.453 25281 3932 1 7 . 1 1 144 144 LYS N N 144 127.950 127.950 126.552 1.398 25281 3933 1 7 . 1 1 144 144 LYS CA C 144 55.440 55.440 55.800 -0.360 25281 3934 1 7 . 1 1 144 144 LYS CB C 144 32.640 32.640 33.825 -1.185 25281 3935 1 7 . 1 1 144 144 LYS H H 144 8.660 8.660 8.503 0.157 25281 3936 1 7 . 1 1 145 145 VAL N N 145 124.120 124.120 126.850 -2.730 25281 3937 1 7 . 1 1 145 145 VAL CA C 145 55.910 55.910 59.703 -3.793 25281 3938 1 7 . 1 1 145 145 VAL CB C 145 32.570 32.570 35.918 -3.348 25281 3939 1 7 . 1 1 145 145 VAL H H 145 8.720 8.720 7.846 0.874 25281 3940 1 7 . 1 1 146 146 GLY N N 146 116.240 116.240 114.420 1.820 25281 3941 1 7 . 1 1 146 146 GLY CA C 146 44.080 44.080 44.353 -0.273 25281 3942 1 7 . 1 1 146 146 GLY H H 146 8.400 8.400 8.446 -0.046 25281 3943 1 7 . 1 1 147 147 THR N N 147 124.620 124.620 115.735 8.885 25281 3944 1 7 . 1 1 147 147 THR CA C 147 61.450 61.450 60.092 1.358 25281 3945 1 7 . 1 1 147 147 THR CB C 147 70.260 70.260 71.323 -1.063 25281 3946 1 7 . 1 1 147 147 THR H H 147 9.080 9.080 9.126 -0.046 25281 3947 1 7 . 1 1 148 148 TRP N N 148 124.790 124.790 122.105 2.685 25281 3948 1 7 . 1 1 148 148 TRP CA C 148 54.770 54.770 55.831 -1.061 25281 3949 1 7 . 1 1 148 148 TRP CB C 148 33.090 33.090 32.801 0.289 25281 3950 1 7 . 1 1 148 148 TRP H H 148 8.510 8.510 8.067 0.443 25281 3951 1 7 . 1 1 149 149 MET N N 149 118.880 118.880 115.915 2.965 25281 3952 1 7 . 1 1 149 149 MET CA C 149 54.540 54.540 54.182 0.358 25281 3953 1 7 . 1 1 149 149 MET CB C 149 34.640 34.640 36.306 -1.667 25281 3954 1 7 . 1 1 149 149 MET H H 149 9.150 9.150 8.976 0.174 25281 3955 1 7 . 1 1 150 150 LEU N N 150 122.830 122.830 123.130 -0.300 25281 3956 1 7 . 1 1 150 150 LEU CA C 150 54.100 54.100 54.273 -0.173 25281 3957 1 7 . 1 1 150 150 LEU CB C 150 45.800 45.800 45.746 0.054 25281 3958 1 7 . 1 1 150 150 LEU H H 150 8.480 8.480 8.177 0.303 25281 3959 1 7 . 1 1 151 151 GLY N N 151 112.730 112.730 112.128 0.602 25281 3960 1 7 . 1 1 151 151 GLY CA C 151 45.940 45.940 45.434 0.506 25281 3961 1 7 . 1 1 151 151 GLY H H 151 9.820 9.820 8.216 1.604 25281 3962 1 7 . 1 1 152 152 ALA N N 152 119.460 119.460 120.154 -0.694 25281 3963 1 7 . 1 1 152 152 ALA CA C 152 49.760 49.760 50.916 -1.156 25281 3964 1 7 . 1 1 152 152 ALA CB C 152 22.700 22.700 22.840 -0.140 25281 3965 1 7 . 1 1 152 152 ALA H H 152 8.840 8.840 8.077 0.763 25281 3966 1 7 . 1 1 153 153 GLY N N 153 104.360 104.360 107.337 -2.977 25281 3967 1 7 . 1 1 153 153 GLY CA C 153 46.440 46.440 43.919 2.521 25281 3968 1 7 . 1 1 153 153 GLY H H 153 8.540 8.540 8.824 -0.284 25281 3969 1 7 . 1 1 154 154 TYR N N 154 120.680 120.680 115.807 4.873 25281 3970 1 7 . 1 1 154 154 TYR CA C 154 55.370 55.370 55.514 -0.144 25281 3971 1 7 . 1 1 154 154 TYR CB C 154 44.250 44.250 40.665 3.585 25281 3972 1 7 . 1 1 154 154 TYR H H 154 8.310 8.310 7.553 0.757 25281 3973 1 7 . 1 1 155 155 ARG N N 155 127.050 127.050 122.248 4.802 25281 3974 1 7 . 1 1 155 155 ARG CA C 155 53.480 53.480 55.691 -2.212 25281 3975 1 7 . 1 1 155 155 ARG CB C 155 32.160 32.160 31.047 1.113 25281 3976 1 7 . 1 1 155 155 ARG H H 155 7.640 7.640 8.523 -0.883 25281 3977 1 8 . 1 1 2 2 GLY N N 2 112.280 112.280 109.047 3.233 25281 3978 1 8 . 1 1 2 2 GLY CA C 2 44.830 44.830 44.714 0.116 25281 3979 1 8 . 1 1 2 2 GLY H H 2 8.460 8.460 7.971 0.489 25281 3980 1 8 . 1 1 3 3 GLU N N 3 118.460 118.460 120.700 -2.240 25281 3981 1 8 . 1 1 3 3 GLU CA C 3 56.840 56.840 56.822 0.019 25281 3982 1 8 . 1 1 3 3 GLU CB C 3 29.980 29.980 30.576 -0.596 25281 3983 1 8 . 1 1 3 3 GLU H H 3 7.630 7.630 8.491 -0.861 25281 3984 1 8 . 1 1 4 4 SER N N 4 119.000 119.000 116.814 2.186 25281 3985 1 8 . 1 1 4 4 SER CA C 4 57.280 57.280 57.679 -0.400 25281 3986 1 8 . 1 1 4 4 SER CB C 4 65.860 65.860 66.417 -0.557 25281 3987 1 8 . 1 1 4 4 SER H H 4 8.820 8.820 8.482 0.338 25281 3988 1 8 . 1 1 5 5 SER N N 5 118.300 118.300 116.094 2.206 25281 3989 1 8 . 1 1 5 5 SER CA C 5 57.560 57.560 57.268 0.292 25281 3990 1 8 . 1 1 5 5 SER CB C 5 65.480 65.480 64.893 0.587 25281 3991 1 8 . 1 1 5 5 SER H H 5 8.700 8.700 7.974 0.726 25281 3992 1 8 . 1 1 6 6 ILE N N 6 123.240 123.240 120.176 3.064 25281 3993 1 8 . 1 1 6 6 ILE CA C 6 54.110 54.110 59.103 -4.993 25281 3994 1 8 . 1 1 6 6 ILE CB C 6 33.870 33.870 42.149 -8.279 25281 3995 1 8 . 1 1 6 6 ILE H H 6 9.080 9.080 7.894 1.186 25281 3996 1 8 . 1 1 7 7 SER N N 7 116.100 116.100 114.683 1.417 25281 3997 1 8 . 1 1 7 7 SER CA C 7 57.130 57.130 57.369 -0.239 25281 3998 1 8 . 1 1 7 7 SER CB C 7 65.710 65.710 66.308 -0.598 25281 3999 1 8 . 1 1 7 7 SER H H 7 8.570 8.570 7.974 0.596 25281 4000 1 8 . 1 1 8 8 ILE N N 8 114.140 114.140 114.559 -0.419 25281 4001 1 8 . 1 1 8 8 ILE CA C 8 58.460 58.460 58.890 -0.430 25281 4002 1 8 . 1 1 8 8 ILE CB C 8 40.880 40.880 42.320 -1.440 25281 4003 1 8 . 1 1 8 8 ILE H H 8 8.300 8.300 8.364 -0.064 25281 4004 1 8 . 1 1 9 9 GLY N N 9 109.200 109.200 107.761 1.439 25281 4005 1 8 . 1 1 9 9 GLY CA C 9 45.550 45.550 45.749 -0.199 25281 4006 1 8 . 1 1 9 9 GLY H H 9 9.060 9.060 7.729 1.331 25281 4007 1 8 . 1 1 10 10 TYR N N 10 121.410 121.410 119.059 2.351 25281 4008 1 8 . 1 1 10 10 TYR CA C 10 56.970 56.970 56.990 -0.020 25281 4009 1 8 . 1 1 10 10 TYR CB C 10 41.520 41.520 41.819 -0.299 25281 4010 1 8 . 1 1 10 10 TYR H H 10 8.870 8.870 7.982 0.888 25281 4011 1 8 . 1 1 11 11 ALA N N 11 125.250 125.250 123.851 1.399 25281 4012 1 8 . 1 1 11 11 ALA CA C 11 48.740 48.740 49.962 -1.222 25281 4013 1 8 . 1 1 11 11 ALA CB C 11 21.610 21.610 21.539 0.071 25281 4014 1 8 . 1 1 11 11 ALA H H 11 7.210 7.210 8.322 -1.112 25281 4015 1 8 . 1 1 12 12 GLN N N 12 119.180 119.180 123.064 -3.884 25281 4016 1 8 . 1 1 12 12 GLN CA C 12 54.690 54.690 54.684 0.006 25281 4017 1 8 . 1 1 12 12 GLN CB C 12 32.000 32.000 33.053 -1.053 25281 4018 1 8 . 1 1 12 12 GLN H H 12 8.330 8.330 8.660 -0.330 25281 4019 1 8 . 1 1 13 13 SER N N 13 122.790 122.790 117.279 5.511 25281 4020 1 8 . 1 1 13 13 SER CA C 13 57.780 57.780 57.001 0.779 25281 4021 1 8 . 1 1 13 13 SER CB C 13 64.540 64.540 67.211 -2.671 25281 4022 1 8 . 1 1 13 13 SER H H 13 8.610 8.610 8.347 0.263 25281 4023 1 8 . 1 1 14 14 ARG N N 14 121.140 121.140 118.167 2.973 25281 4024 1 8 . 1 1 14 14 ARG CA C 14 54.960 54.960 54.823 0.137 25281 4025 1 8 . 1 1 14 14 ARG CB C 14 32.370 32.370 33.560 -1.190 25281 4026 1 8 . 1 1 14 14 ARG H H 14 8.520 8.520 8.677 -0.157 25281 4027 1 8 . 1 1 15 15 VAL N N 15 115.890 115.890 120.396 -4.506 25281 4028 1 8 . 1 1 15 15 VAL CA C 15 60.970 60.970 61.391 -0.421 25281 4029 1 8 . 1 1 15 15 VAL CB C 15 34.320 34.320 35.809 -1.489 25281 4030 1 8 . 1 1 15 15 VAL H H 15 8.440 8.440 8.577 -0.137 25281 4031 1 8 . 1 1 16 16 LYS N N 16 126.010 126.010 126.999 -0.989 25281 4032 1 8 . 1 1 16 16 LYS CA C 16 55.120 55.120 56.211 -1.091 25281 4033 1 8 . 1 1 16 16 LYS CB C 16 34.350 34.350 32.776 1.574 25281 4034 1 8 . 1 1 16 16 LYS H H 16 8.850 8.850 8.571 0.279 25281 4035 1 8 . 1 1 17 17 GLU N N 17 119.140 119.140 122.516 -3.376 25281 4036 1 8 . 1 1 17 17 GLU CA C 17 54.460 54.460 55.082 -0.622 25281 4037 1 8 . 1 1 17 17 GLU CB C 17 33.430 33.430 31.727 1.703 25281 4038 1 8 . 1 1 17 17 GLU H H 17 8.030 8.030 8.393 -0.363 25281 4039 1 8 . 1 1 18 18 ASP N N 18 120.280 120.280 120.389 -0.109 25281 4040 1 8 . 1 1 18 18 ASP CA C 18 56.500 56.500 53.369 3.131 25281 4041 1 8 . 1 1 18 18 ASP CB C 18 33.780 33.780 40.376 -6.596 25281 4042 1 8 . 1 1 18 18 ASP H H 18 8.120 8.120 8.506 -0.386 25281 4043 1 8 . 1 1 19 19 GLY N N 19 118.750 118.750 112.862 5.888 25281 4044 1 8 . 1 1 19 19 GLY CA C 19 44.130 44.130 44.972 -0.842 25281 4045 1 8 . 1 1 19 19 GLY H H 19 8.430 8.430 7.689 0.741 25281 4046 1 8 . 1 1 20 20 TYR N N 20 117.080 117.080 122.080 -5.000 25281 4047 1 8 . 1 1 20 20 TYR CA C 20 60.940 60.940 59.049 1.891 25281 4048 1 8 . 1 1 20 20 TYR CB C 20 42.010 42.010 38.177 3.833 25281 4049 1 8 . 1 1 20 20 TYR H H 20 8.610 8.610 8.670 -0.060 25281 4050 1 8 . 1 1 21 21 LYS N N 21 127.240 127.240 123.606 3.634 25281 4051 1 8 . 1 1 21 21 LYS CA C 21 56.760 56.760 57.260 -0.500 25281 4052 1 8 . 1 1 21 21 LYS CB C 21 29.100 29.100 32.647 -3.547 25281 4053 1 8 . 1 1 21 21 LYS H H 21 7.970 7.970 8.792 -0.822 25281 4054 1 8 . 1 1 22 22 LEU N N 22 122.270 122.270 121.158 1.112 25281 4055 1 8 . 1 1 22 22 LEU CA C 22 59.170 59.170 57.917 1.253 25281 4056 1 8 . 1 1 22 22 LEU CB C 22 40.030 40.030 41.809 -1.779 25281 4057 1 8 . 1 1 22 22 LEU H H 22 8.370 8.370 7.978 0.392 25281 4058 1 8 . 1 1 23 23 ASP N N 23 114.790 114.790 113.775 1.015 25281 4059 1 8 . 1 1 23 23 ASP CA C 23 51.840 51.840 53.529 -1.689 25281 4060 1 8 . 1 1 23 23 ASP CB C 23 37.730 37.730 40.866 -3.136 25281 4061 1 8 . 1 1 23 23 ASP H H 23 8.210 8.210 8.267 -0.057 25281 4062 1 8 . 1 1 24 24 LYS N N 24 115.470 115.470 114.464 1.006 25281 4063 1 8 . 1 1 24 24 LYS CA C 24 58.860 58.860 57.846 1.014 25281 4064 1 8 . 1 1 24 24 LYS CB C 24 28.330 28.330 29.980 -1.650 25281 4065 1 8 . 1 1 24 24 LYS H H 24 9.230 9.230 7.957 1.273 25281 4066 1 8 . 1 1 25 25 ASN N N 25 121.610 121.610 118.167 3.443 25281 4067 1 8 . 1 1 25 25 ASN CA C 25 54.430 54.430 50.167 4.263 25281 4068 1 8 . 1 1 25 25 ASN CB C 25 42.500 42.500 40.220 2.280 25281 4069 1 8 . 1 1 25 25 ASN H H 25 8.150 8.150 8.054 0.096 25281 4070 1 8 . 1 1 26 26 PRO CA C 26 63.340 63.340 62.564 0.776 25281 4071 1 8 . 1 1 26 26 PRO CB C 26 30.940 30.940 33.200 -2.260 25281 4072 1 8 . 1 1 27 27 ARG N N 27 120.730 120.730 117.025 3.705 25281 4073 1 8 . 1 1 27 27 ARG CA C 27 54.340 54.340 54.409 -0.069 25281 4074 1 8 . 1 1 27 27 ARG CB C 27 33.500 33.500 33.506 -0.006 25281 4075 1 8 . 1 1 27 27 ARG H H 27 8.290 8.290 8.400 -0.110 25281 4076 1 8 . 1 1 28 28 GLY N N 28 112.000 112.000 106.416 5.584 25281 4077 1 8 . 1 1 28 28 GLY CA C 28 46.940 46.940 45.341 1.599 25281 4078 1 8 . 1 1 28 28 GLY H H 28 8.810 8.810 7.734 1.076 25281 4079 1 8 . 1 1 29 29 PHE N N 29 121.230 121.230 116.917 4.313 25281 4080 1 8 . 1 1 29 29 PHE CA C 29 55.230 55.230 57.043 -1.813 25281 4081 1 8 . 1 1 29 29 PHE CB C 29 43.700 43.700 42.998 0.702 25281 4082 1 8 . 1 1 29 29 PHE H H 29 8.470 8.470 8.441 0.029 25281 4083 1 8 . 1 1 30 30 ASN N N 30 117.250 117.250 120.922 -3.672 25281 4084 1 8 . 1 1 30 30 ASN CA C 30 50.220 50.220 52.657 -2.437 25281 4085 1 8 . 1 1 30 30 ASN CB C 30 45.810 45.810 40.605 5.205 25281 4086 1 8 . 1 1 30 30 ASN H H 30 8.630 8.630 8.441 0.189 25281 4087 1 8 . 1 1 31 31 LEU N N 31 128.180 128.180 126.402 1.778 25281 4088 1 8 . 1 1 31 31 LEU CA C 31 53.930 53.930 53.815 0.115 25281 4089 1 8 . 1 1 31 31 LEU CB C 31 45.810 45.810 45.159 0.651 25281 4090 1 8 . 1 1 31 31 LEU H H 31 9.080 9.080 8.335 0.745 25281 4091 1 8 . 1 1 32 32 LYS N N 32 119.980 119.980 120.267 -0.287 25281 4092 1 8 . 1 1 32 32 LYS CA C 32 55.730 55.730 54.609 1.121 25281 4093 1 8 . 1 1 32 32 LYS CB C 32 36.070 36.070 36.995 -0.925 25281 4094 1 8 . 1 1 32 32 LYS H H 32 8.780 8.780 7.816 0.964 25281 4095 1 8 . 1 1 33 33 TYR N N 33 121.500 121.500 119.711 1.789 25281 4096 1 8 . 1 1 33 33 TYR CA C 33 55.830 55.830 57.065 -1.235 25281 4097 1 8 . 1 1 33 33 TYR CB C 33 42.110 42.110 42.132 -0.022 25281 4098 1 8 . 1 1 33 33 TYR H H 33 8.640 8.640 8.275 0.365 25281 4099 1 8 . 1 1 34 34 ARG N N 34 128.980 128.980 120.050 8.930 25281 4100 1 8 . 1 1 34 34 ARG CA C 34 52.690 52.690 54.527 -1.837 25281 4101 1 8 . 1 1 34 34 ARG CB C 34 34.320 34.320 33.953 0.367 25281 4102 1 8 . 1 1 34 34 ARG H H 34 8.830 8.830 8.499 0.331 25281 4103 1 8 . 1 1 35 35 TYR N N 35 124.820 124.820 121.657 3.163 25281 4104 1 8 . 1 1 35 35 TYR CA C 35 56.640 56.640 57.066 -0.426 25281 4105 1 8 . 1 1 35 35 TYR CB C 35 41.980 41.980 41.982 -0.002 25281 4106 1 8 . 1 1 35 35 TYR H H 35 8.840 8.840 8.029 0.811 25281 4107 1 8 . 1 1 39 39 ASN N N 39 127.690 127.690 114.419 13.271 25281 4108 1 8 . 1 1 39 39 ASN CA C 39 54.850 54.850 54.292 0.558 25281 4109 1 8 . 1 1 39 39 ASN CB C 39 38.290 38.290 37.519 0.771 25281 4110 1 8 . 1 1 39 39 ASN H H 39 7.990 7.990 8.747 -0.757 25281 4111 1 8 . 1 1 40 40 ASP N N 40 115.200 115.200 115.756 -0.556 25281 4112 1 8 . 1 1 40 40 ASP CA C 40 55.210 55.210 53.158 2.052 25281 4113 1 8 . 1 1 40 40 ASP CB C 40 44.010 44.010 41.152 2.858 25281 4114 1 8 . 1 1 40 40 ASP H H 40 8.370 8.370 7.372 0.998 25281 4115 1 8 . 1 1 41 41 TRP N N 41 124.210 124.210 118.488 5.722 25281 4116 1 8 . 1 1 41 41 TRP CA C 41 55.840 55.840 55.838 0.002 25281 4117 1 8 . 1 1 41 41 TRP CB C 41 33.540 33.540 30.129 3.411 25281 4118 1 8 . 1 1 41 41 TRP H H 41 9.130 9.130 7.613 1.517 25281 4119 1 8 . 1 1 42 42 GLY N N 42 107.800 107.800 109.078 -1.278 25281 4120 1 8 . 1 1 42 42 GLY CA C 42 45.870 45.870 43.893 1.977 25281 4121 1 8 . 1 1 42 42 GLY H H 42 8.610 8.610 8.374 0.236 25281 4122 1 8 . 1 1 43 43 VAL N N 43 116.260 116.260 118.602 -2.342 25281 4123 1 8 . 1 1 43 43 VAL CA C 43 58.980 58.980 61.055 -2.075 25281 4124 1 8 . 1 1 43 43 VAL CB C 43 35.430 35.430 34.710 0.720 25281 4125 1 8 . 1 1 43 43 VAL H H 43 8.880 8.880 7.704 1.176 25281 4126 1 8 . 1 1 44 44 ILE N N 44 124.720 124.720 125.113 -0.393 25281 4127 1 8 . 1 1 44 44 ILE CA C 44 58.390 58.390 59.896 -1.506 25281 4128 1 8 . 1 1 44 44 ILE CB C 44 42.890 42.890 41.084 1.806 25281 4129 1 8 . 1 1 44 44 ILE H H 44 9.110 9.110 8.129 0.981 25281 4130 1 8 . 1 1 45 45 GLY N N 45 110.610 110.610 113.680 -3.070 25281 4131 1 8 . 1 1 45 45 GLY CA C 45 43.150 43.150 43.828 -0.678 25281 4132 1 8 . 1 1 45 45 GLY H H 45 8.910 8.910 8.427 0.483 25281 4133 1 8 . 1 1 46 46 SER N N 46 116.210 116.210 120.111 -3.901 25281 4134 1 8 . 1 1 46 46 SER CA C 46 56.250 56.250 56.945 -0.695 25281 4135 1 8 . 1 1 46 46 SER CB C 46 63.720 63.720 65.348 -1.628 25281 4136 1 8 . 1 1 46 46 SER H H 46 9.250 9.250 8.866 0.384 25281 4137 1 8 . 1 1 47 47 PHE N N 47 126.400 126.400 129.500 -3.100 25281 4138 1 8 . 1 1 47 47 PHE CA C 47 55.090 55.090 56.167 -1.077 25281 4139 1 8 . 1 1 47 47 PHE CB C 47 42.560 42.560 42.939 -0.379 25281 4140 1 8 . 1 1 47 47 PHE H H 47 8.940 8.940 8.670 0.270 25281 4141 1 8 . 1 1 48 48 ALA N N 48 131.930 131.930 129.430 2.500 25281 4142 1 8 . 1 1 48 48 ALA CA C 48 50.350 50.350 49.690 0.660 25281 4143 1 8 . 1 1 48 48 ALA CB C 48 21.280 21.280 22.668 -1.387 25281 4144 1 8 . 1 1 48 48 ALA H H 48 8.790 8.790 7.910 0.880 25281 4145 1 8 . 1 1 49 49 GLN N N 49 116.070 116.070 123.532 -7.462 25281 4146 1 8 . 1 1 49 49 GLN CA C 49 54.110 54.110 54.535 -0.425 25281 4147 1 8 . 1 1 49 49 GLN CB C 49 31.140 31.140 32.909 -1.769 25281 4148 1 8 . 1 1 49 49 GLN H H 49 7.720 7.720 8.244 -0.524 25281 4149 1 8 . 1 1 50 50 THR N N 50 115.990 115.990 117.356 -1.366 25281 4150 1 8 . 1 1 50 50 THR CA C 50 59.270 59.270 60.007 -0.737 25281 4151 1 8 . 1 1 50 50 THR CB C 50 70.980 70.980 72.200 -1.220 25281 4152 1 8 . 1 1 50 50 THR H H 50 9.470 9.470 9.269 0.201 25281 4153 1 8 . 1 1 51 51 ARG N N 51 117.600 117.600 119.553 -1.953 25281 4154 1 8 . 1 1 51 51 ARG CA C 51 55.350 55.350 53.961 1.389 25281 4155 1 8 . 1 1 51 51 ARG CB C 51 33.610 33.610 32.748 0.862 25281 4156 1 8 . 1 1 51 51 ARG H H 51 8.600 8.600 8.089 0.511 25281 4157 1 8 . 1 1 52 52 ARG N N 52 121.400 121.400 121.279 0.121 25281 4158 1 8 . 1 1 52 52 ARG CA C 52 56.910 56.910 55.044 1.866 25281 4159 1 8 . 1 1 52 52 ARG CB C 52 29.370 29.370 30.783 -1.413 25281 4160 1 8 . 1 1 52 52 ARG H H 52 8.380 8.380 8.178 0.202 25281 4161 1 8 . 1 1 53 53 GLY N N 53 111.040 111.040 117.232 -6.192 25281 4162 1 8 . 1 1 53 53 GLY CA C 53 45.190 45.190 46.629 -1.439 25281 4163 1 8 . 1 1 53 53 GLY H H 53 8.330 8.330 9.071 -0.741 25281 4164 1 8 . 1 1 54 54 PHE N N 54 119.210 119.210 119.280 -0.070 25281 4165 1 8 . 1 1 54 54 PHE CA C 54 55.670 55.670 56.937 -1.267 25281 4166 1 8 . 1 1 54 54 PHE CB C 54 29.220 29.220 41.403 -12.183 25281 4167 1 8 . 1 1 54 54 PHE H H 54 7.720 7.720 7.994 -0.274 25281 4168 1 8 . 1 1 55 55 GLU N N 55 123.470 123.470 120.882 2.588 25281 4169 1 8 . 1 1 55 55 GLU CA C 55 55.580 55.580 56.062 -0.481 25281 4170 1 8 . 1 1 55 55 GLU CB C 55 32.920 32.920 30.188 2.732 25281 4171 1 8 . 1 1 55 55 GLU H H 55 8.400 8.400 7.016 1.384 25281 4172 1 8 . 1 1 56 56 GLU N N 56 121.950 121.950 122.401 -0.451 25281 4173 1 8 . 1 1 56 56 GLU CA C 56 56.690 56.690 57.637 -0.947 25281 4174 1 8 . 1 1 56 56 GLU CB C 56 29.450 29.450 29.609 -0.159 25281 4175 1 8 . 1 1 56 56 GLU H H 56 8.500 8.500 8.633 -0.133 25281 4176 1 8 . 1 1 57 57 SER N N 57 123.330 123.330 122.253 1.077 25281 4177 1 8 . 1 1 57 57 SER CA C 57 55.090 55.090 57.771 -2.681 25281 4178 1 8 . 1 1 57 57 SER CB C 57 64.890 64.890 66.181 -1.291 25281 4179 1 8 . 1 1 57 57 SER H H 57 8.640 8.640 8.456 0.184 25281 4180 1 8 . 1 1 58 58 VAL N N 58 122.060 122.060 120.192 1.868 25281 4181 1 8 . 1 1 58 58 VAL CA C 58 57.660 57.660 61.276 -3.616 25281 4182 1 8 . 1 1 58 58 VAL CB C 58 31.640 31.640 34.519 -2.879 25281 4183 1 8 . 1 1 58 58 VAL H H 58 8.480 8.480 8.364 0.116 25281 4184 1 8 . 1 1 59 59 ASP N N 59 123.390 123.390 127.030 -3.640 25281 4185 1 8 . 1 1 59 59 ASP CA C 59 54.960 54.960 53.612 1.348 25281 4186 1 8 . 1 1 59 59 ASP CB C 59 42.840 42.840 41.847 0.993 25281 4187 1 8 . 1 1 59 59 ASP H H 59 9.360 9.360 8.888 0.472 25281 4188 1 8 . 1 1 60 60 GLY N N 60 105.230 105.230 106.733 -1.503 25281 4189 1 8 . 1 1 60 60 GLY CA C 60 45.130 45.130 44.483 0.646 25281 4190 1 8 . 1 1 60 60 GLY H H 60 8.210 8.210 7.503 0.707 25281 4191 1 8 . 1 1 61 61 PHE N N 61 121.440 121.440 120.727 0.713 25281 4192 1 8 . 1 1 61 61 PHE CA C 61 57.330 57.330 58.425 -1.095 25281 4193 1 8 . 1 1 61 61 PHE CB C 61 39.420 39.420 38.678 0.742 25281 4194 1 8 . 1 1 61 61 PHE H H 61 8.330 8.330 8.543 -0.213 25281 4195 1 8 . 1 1 62 62 LYS N N 62 119.870 119.870 122.830 -2.960 25281 4196 1 8 . 1 1 62 62 LYS CA C 62 56.340 56.340 54.776 1.563 25281 4197 1 8 . 1 1 62 62 LYS CB C 62 33.850 33.850 35.545 -1.695 25281 4198 1 8 . 1 1 62 62 LYS H H 62 8.480 8.480 7.836 0.644 25281 4199 1 8 . 1 1 63 63 LEU N N 63 125.160 125.160 123.251 1.909 25281 4200 1 8 . 1 1 63 63 LEU CA C 63 56.220 56.220 57.166 -0.946 25281 4201 1 8 . 1 1 63 63 LEU CB C 63 41.520 41.520 41.735 -0.215 25281 4202 1 8 . 1 1 63 63 LEU H H 63 8.910 8.910 8.571 0.339 25281 4203 1 8 . 1 1 64 64 ILE N N 64 119.660 119.660 118.875 0.785 25281 4204 1 8 . 1 1 64 64 ILE CA C 64 62.420 62.420 64.262 -1.842 25281 4205 1 8 . 1 1 64 64 ILE CB C 64 37.700 37.700 36.929 0.771 25281 4206 1 8 . 1 1 64 64 ILE H H 64 8.210 8.210 7.921 0.289 25281 4207 1 8 . 1 1 65 65 ASP N N 65 117.080 117.080 119.074 -1.994 25281 4208 1 8 . 1 1 65 65 ASP CA C 65 57.420 57.420 56.419 1.001 25281 4209 1 8 . 1 1 65 65 ASP CB C 65 38.350 38.350 40.327 -1.977 25281 4210 1 8 . 1 1 65 65 ASP H H 65 7.710 7.710 8.365 -0.655 25281 4211 1 8 . 1 1 66 66 GLY N N 66 106.440 106.440 106.912 -0.472 25281 4212 1 8 . 1 1 66 66 GLY CA C 66 45.170 45.170 45.180 -0.010 25281 4213 1 8 . 1 1 66 66 GLY H H 66 7.920 7.920 7.432 0.488 25281 4214 1 8 . 1 1 67 67 ASP N N 67 118.490 118.490 118.818 -0.328 25281 4215 1 8 . 1 1 67 67 ASP CA C 67 57.340 57.340 55.790 1.550 25281 4216 1 8 . 1 1 67 67 ASP CB C 67 29.870 29.870 40.856 -10.986 25281 4217 1 8 . 1 1 67 67 ASP H H 67 7.820 7.820 7.889 -0.069 25281 4218 1 8 . 1 1 68 68 PHE N N 68 125.320 125.320 116.893 8.427 25281 4219 1 8 . 1 1 68 68 PHE CA C 68 56.090 56.090 57.398 -1.308 25281 4220 1 8 . 1 1 68 68 PHE CB C 68 41.940 41.940 43.460 -1.520 25281 4221 1 8 . 1 1 68 68 PHE H H 68 8.310 8.310 8.604 -0.294 25281 4222 1 8 . 1 1 69 69 LYS N N 69 124.770 124.770 120.030 4.740 25281 4223 1 8 . 1 1 69 69 LYS CA C 69 54.880 54.880 55.309 -0.430 25281 4224 1 8 . 1 1 69 69 LYS CB C 69 36.920 36.920 35.982 0.938 25281 4225 1 8 . 1 1 69 69 LYS H H 69 8.730 8.730 8.899 -0.169 25281 4226 1 8 . 1 1 70 70 TYR N N 70 123.740 123.740 125.873 -2.133 25281 4227 1 8 . 1 1 70 70 TYR CA C 70 55.540 55.540 56.734 -1.194 25281 4228 1 8 . 1 1 70 70 TYR CB C 70 40.150 40.150 42.261 -2.111 25281 4229 1 8 . 1 1 70 70 TYR H H 70 8.680 8.680 8.386 0.294 25281 4230 1 8 . 1 1 71 71 TYR N N 71 123.920 123.920 123.206 0.714 25281 4231 1 8 . 1 1 71 71 TYR CA C 71 54.500 54.500 55.264 -0.764 25281 4232 1 8 . 1 1 71 71 TYR CB C 71 42.420 42.420 41.616 0.804 25281 4233 1 8 . 1 1 71 71 TYR H H 71 8.620 8.620 8.313 0.307 25281 4234 1 8 . 1 1 72 72 SER N N 72 113.820 113.820 114.072 -0.252 25281 4235 1 8 . 1 1 72 72 SER CA C 72 56.320 56.320 56.801 -0.481 25281 4236 1 8 . 1 1 72 72 SER CB C 72 65.790 65.790 66.536 -0.746 25281 4237 1 8 . 1 1 72 72 SER H H 72 8.800 8.800 8.173 0.627 25281 4238 1 8 . 1 1 73 73 VAL N N 73 119.260 119.260 114.867 4.393 25281 4239 1 8 . 1 1 73 73 VAL CA C 73 60.730 60.730 60.375 0.355 25281 4240 1 8 . 1 1 73 73 VAL CB C 73 33.870 33.870 35.723 -1.853 25281 4241 1 8 . 1 1 73 73 VAL H H 73 8.170 8.170 7.949 0.221 25281 4242 1 8 . 1 1 74 74 THR N N 74 115.360 115.360 117.793 -2.433 25281 4243 1 8 . 1 1 74 74 THR CA C 74 59.040 59.040 61.571 -2.531 25281 4244 1 8 . 1 1 74 74 THR CB C 74 73.250 73.250 71.287 1.963 25281 4245 1 8 . 1 1 74 74 THR H H 74 9.200 9.200 8.188 1.012 25281 4246 1 8 . 1 1 75 75 ALA N N 75 119.330 119.330 126.096 -6.766 25281 4247 1 8 . 1 1 75 75 ALA CA C 75 51.390 51.390 50.726 0.664 25281 4248 1 8 . 1 1 75 75 ALA CB C 75 22.380 22.380 22.761 -0.381 25281 4249 1 8 . 1 1 75 75 ALA H H 75 9.130 9.130 8.604 0.526 25281 4250 1 8 . 1 1 76 76 GLY N N 76 103.130 103.130 106.081 -2.951 25281 4251 1 8 . 1 1 76 76 GLY CA C 76 45.900 45.900 44.750 1.150 25281 4252 1 8 . 1 1 76 76 GLY H H 76 8.760 8.760 8.002 0.758 25281 4253 1 8 . 1 1 77 77 PRO CA C 77 61.250 61.250 62.347 -1.097 25281 4254 1 8 . 1 1 77 77 PRO CB C 77 32.590 32.590 33.230 -0.640 25281 4255 1 8 . 1 1 78 78 VAL N N 78 115.250 115.250 120.426 -5.176 25281 4256 1 8 . 1 1 78 78 VAL CA C 78 58.430 58.430 60.021 -1.591 25281 4257 1 8 . 1 1 78 78 VAL CB C 78 32.700 32.700 35.124 -2.424 25281 4258 1 8 . 1 1 78 78 VAL H H 78 8.240 8.240 7.949 0.291 25281 4259 1 8 . 1 1 79 79 PHE N N 79 130.610 130.610 124.369 6.241 25281 4260 1 8 . 1 1 79 79 PHE CA C 79 55.090 55.090 55.170 -0.080 25281 4261 1 8 . 1 1 79 79 PHE CB C 79 41.590 41.590 41.925 -0.335 25281 4262 1 8 . 1 1 79 79 PHE H H 79 9.540 9.540 8.023 1.517 25281 4263 1 8 . 1 1 80 80 ARG N N 80 130.350 130.350 124.320 6.030 25281 4264 1 8 . 1 1 80 80 ARG CA C 80 55.490 55.490 56.631 -1.141 25281 4265 1 8 . 1 1 80 80 ARG CB C 80 29.520 29.520 30.576 -1.056 25281 4266 1 8 . 1 1 80 80 ARG H H 80 8.810 8.810 8.607 0.203 25281 4267 1 8 . 1 1 81 81 ILE N N 81 127.480 127.480 123.600 3.880 25281 4268 1 8 . 1 1 81 81 ILE CA C 81 62.850 62.850 61.038 1.812 25281 4269 1 8 . 1 1 81 81 ILE CB C 81 37.650 37.650 38.412 -0.762 25281 4270 1 8 . 1 1 81 81 ILE H H 81 8.260 8.260 8.940 -0.680 25281 4271 1 8 . 1 1 82 82 ASN N N 82 113.110 113.110 116.969 -3.859 25281 4272 1 8 . 1 1 82 82 ASN CA C 82 55.630 55.630 52.023 3.607 25281 4273 1 8 . 1 1 82 82 ASN CB C 82 43.210 43.210 40.601 2.609 25281 4274 1 8 . 1 1 82 82 ASN H H 82 7.970 7.970 7.584 0.386 25281 4275 1 8 . 1 1 85 85 VAL N N 85 118.090 118.090 120.397 -2.307 25281 4276 1 8 . 1 1 85 85 VAL CA C 85 61.120 61.120 60.956 0.164 25281 4277 1 8 . 1 1 85 85 VAL CB C 85 34.910 34.910 34.894 0.016 25281 4278 1 8 . 1 1 85 85 VAL H H 85 7.840 7.840 7.215 0.625 25281 4279 1 8 . 1 1 86 86 SER N N 86 119.050 119.050 121.847 -2.797 25281 4280 1 8 . 1 1 86 86 SER CA C 86 57.100 57.100 57.104 -0.004 25281 4281 1 8 . 1 1 86 86 SER CB C 86 65.400 65.400 65.019 0.382 25281 4282 1 8 . 1 1 86 86 SER H H 86 8.240 8.240 8.046 0.194 25281 4283 1 8 . 1 1 87 87 LEU N N 87 124.640 124.640 126.929 -2.289 25281 4284 1 8 . 1 1 87 87 LEU CA C 87 53.750 53.750 54.088 -0.338 25281 4285 1 8 . 1 1 87 87 LEU CB C 87 46.320 46.320 45.784 0.536 25281 4286 1 8 . 1 1 87 87 LEU H H 87 9.130 9.130 7.678 1.452 25281 4287 1 8 . 1 1 88 88 TYR N N 88 118.740 118.740 118.814 -0.074 25281 4288 1 8 . 1 1 88 88 TYR CA C 88 55.080 55.080 56.126 -1.046 25281 4289 1 8 . 1 1 88 88 TYR CB C 88 42.630 42.630 40.990 1.640 25281 4290 1 8 . 1 1 88 88 TYR H H 88 8.740 8.740 7.941 0.799 25281 4291 1 8 . 1 1 89 89 GLY N N 89 103.920 103.920 106.896 -2.976 25281 4292 1 8 . 1 1 89 89 GLY CA C 89 43.250 43.250 43.573 -0.323 25281 4293 1 8 . 1 1 89 89 GLY H H 89 7.720 7.720 8.341 -0.621 25281 4294 1 8 . 1 1 90 90 LEU N N 90 117.530 117.530 122.419 -4.889 25281 4295 1 8 . 1 1 90 90 LEU CA C 90 53.200 53.200 53.821 -0.621 25281 4296 1 8 . 1 1 90 90 LEU CB C 90 45.810 45.810 44.794 1.016 25281 4297 1 8 . 1 1 90 90 LEU H H 90 8.520 8.520 8.311 0.209 25281 4298 1 8 . 1 1 91 91 LEU N N 91 120.670 120.670 118.463 2.207 25281 4299 1 8 . 1 1 91 91 LEU CA C 91 53.590 53.590 53.593 -0.003 25281 4300 1 8 . 1 1 91 91 LEU CB C 91 46.330 46.330 45.644 0.686 25281 4301 1 8 . 1 1 91 91 LEU H H 91 9.250 9.250 7.976 1.274 25281 4302 1 8 . 1 1 92 92 GLY N N 92 108.770 108.770 108.663 0.107 25281 4303 1 8 . 1 1 92 92 GLY CA C 92 46.520 46.520 46.136 0.384 25281 4304 1 8 . 1 1 92 92 GLY H H 92 8.480 8.480 8.681 -0.201 25281 4305 1 8 . 1 1 93 93 ALA N N 93 126.760 126.760 121.087 5.673 25281 4306 1 8 . 1 1 93 93 ALA CA C 93 49.890 49.890 51.049 -1.159 25281 4307 1 8 . 1 1 93 93 ALA CB C 93 21.860 21.860 22.819 -0.959 25281 4308 1 8 . 1 1 93 93 ALA H H 93 8.860 8.860 7.926 0.934 25281 4309 1 8 . 1 1 94 94 GLY N N 94 107.510 107.510 107.194 0.316 25281 4310 1 8 . 1 1 94 94 GLY CA C 94 42.760 42.760 44.218 -1.458 25281 4311 1 8 . 1 1 94 94 GLY H H 94 8.880 8.880 8.388 0.492 25281 4312 1 8 . 1 1 95 95 HIS N N 95 122.340 122.340 120.161 2.179 25281 4313 1 8 . 1 1 95 95 HIS CA C 95 54.570 54.570 54.758 -0.188 25281 4314 1 8 . 1 1 95 95 HIS CB C 95 32.700 32.700 33.206 -0.506 25281 4315 1 8 . 1 1 95 95 HIS H H 95 9.200 9.200 8.465 0.735 25281 4316 1 8 . 1 1 96 96 GLY N N 96 112.170 112.170 111.531 0.639 25281 4317 1 8 . 1 1 96 96 GLY CA C 96 43.150 43.150 43.870 -0.720 25281 4318 1 8 . 1 1 96 96 GLY H H 96 8.620 8.620 7.822 0.798 25281 4319 1 8 . 1 1 97 97 LYS N N 97 120.580 120.580 123.517 -2.937 25281 4320 1 8 . 1 1 97 97 LYS CA C 97 54.890 54.890 55.249 -0.359 25281 4321 1 8 . 1 1 97 97 LYS CB C 97 35.560 35.560 37.199 -1.639 25281 4322 1 8 . 1 1 97 97 LYS H H 97 9.010 9.010 8.964 0.046 25281 4323 1 8 . 1 1 98 98 ALA N N 98 126.740 126.740 127.972 -1.232 25281 4324 1 8 . 1 1 98 98 ALA CA C 98 50.020 50.020 50.585 -0.565 25281 4325 1 8 . 1 1 98 98 ALA CB C 98 22.380 22.380 22.255 0.126 25281 4326 1 8 . 1 1 98 98 ALA H H 98 9.120 9.120 8.786 0.334 25281 4327 1 8 . 1 1 99 99 LYS N N 99 122.360 122.360 124.529 -2.169 25281 4328 1 8 . 1 1 99 99 LYS CA C 99 55.090 55.090 55.516 -0.426 25281 4329 1 8 . 1 1 99 99 LYS CB C 99 34.970 34.970 34.987 -0.017 25281 4330 1 8 . 1 1 99 99 LYS H H 99 8.580 8.580 8.535 0.045 25281 4331 1 8 . 1 1 100 100 PHE N N 100 121.170 121.170 124.443 -3.273 25281 4332 1 8 . 1 1 100 100 PHE CA C 100 56.390 56.390 57.339 -0.949 25281 4333 1 8 . 1 1 100 100 PHE CB C 100 42.110 42.110 40.770 1.340 25281 4334 1 8 . 1 1 100 100 PHE H H 100 8.750 8.750 8.260 0.490 25281 4335 1 8 . 1 1 101 101 SER N N 101 117.280 117.280 116.045 1.235 25281 4336 1 8 . 1 1 101 101 SER CA C 101 57.070 57.070 57.293 -0.223 25281 4337 1 8 . 1 1 101 101 SER CB C 101 65.830 65.830 64.462 1.369 25281 4338 1 8 . 1 1 101 101 SER H H 101 8.990 8.990 7.092 1.898 25281 4339 1 8 . 1 1 102 102 SER N N 102 117.600 117.600 116.398 1.202 25281 4340 1 8 . 1 1 102 102 SER CA C 102 56.500 56.500 58.720 -2.220 25281 4341 1 8 . 1 1 102 102 SER CB C 102 67.540 67.540 63.813 3.727 25281 4342 1 8 . 1 1 102 102 SER H H 102 8.680 8.680 8.545 0.135 25281 4343 1 8 . 1 1 103 103 ILE N N 103 114.980 114.980 123.886 -8.906 25281 4344 1 8 . 1 1 103 103 ILE CA C 103 59.180 59.180 60.281 -1.101 25281 4345 1 8 . 1 1 103 103 ILE CB C 103 40.550 40.550 40.709 -0.159 25281 4346 1 8 . 1 1 103 103 ILE H H 103 7.700 7.700 8.372 -0.672 25281 4347 1 8 . 1 1 104 104 PHE N N 104 123.710 123.710 122.520 1.190 25281 4348 1 8 . 1 1 104 104 PHE CA C 104 53.190 53.190 57.576 -4.386 25281 4349 1 8 . 1 1 104 104 PHE CB C 104 43.900 43.900 39.513 4.387 25281 4350 1 8 . 1 1 104 104 PHE H H 104 8.590 8.590 8.499 0.091 25281 4351 1 8 . 1 1 105 105 GLY N N 105 109.080 109.080 113.499 -4.419 25281 4352 1 8 . 1 1 105 105 GLY CA C 105 45.420 45.420 44.422 0.998 25281 4353 1 8 . 1 1 105 105 GLY H H 105 8.400 8.400 7.904 0.496 25281 4354 1 8 . 1 1 106 106 GLN N N 106 119.680 119.680 120.458 -0.778 25281 4355 1 8 . 1 1 106 106 GLN CA C 106 53.720 53.720 55.320 -1.600 25281 4356 1 8 . 1 1 106 106 GLN CB C 106 30.100 30.100 29.424 0.676 25281 4357 1 8 . 1 1 106 106 GLN H H 106 8.530 8.530 8.233 0.297 25281 4358 1 8 . 1 1 107 107 SER N N 107 119.160 119.160 117.825 1.335 25281 4359 1 8 . 1 1 107 107 SER CA C 107 57.360 57.360 57.919 -0.559 25281 4360 1 8 . 1 1 107 107 SER CB C 107 66.050 66.050 64.445 1.605 25281 4361 1 8 . 1 1 107 107 SER H H 107 8.800 8.800 8.462 0.338 25281 4362 1 8 . 1 1 108 108 GLU N N 108 125.360 125.360 119.677 5.683 25281 4363 1 8 . 1 1 108 108 GLU CA C 108 58.910 58.910 55.467 3.443 25281 4364 1 8 . 1 1 108 108 GLU CB C 108 40.880 40.880 32.453 8.427 25281 4365 1 8 . 1 1 108 108 GLU H H 108 8.960 8.960 8.616 0.344 25281 4366 1 8 . 1 1 109 109 SER N N 109 118.890 118.890 116.084 2.806 25281 4367 1 8 . 1 1 109 109 SER CA C 109 56.710 56.710 57.283 -0.573 25281 4368 1 8 . 1 1 109 109 SER CB C 109 66.180 66.180 65.061 1.119 25281 4369 1 8 . 1 1 109 109 SER H H 109 9.080 9.080 8.476 0.604 25281 4370 1 8 . 1 1 110 110 ARG N N 110 119.830 119.830 124.632 -4.802 25281 4371 1 8 . 1 1 110 110 ARG CA C 110 58.390 58.390 54.795 3.595 25281 4372 1 8 . 1 1 110 110 ARG CB C 110 40.940 40.940 33.067 7.873 25281 4373 1 8 . 1 1 110 110 ARG H H 110 8.850 8.850 8.309 0.541 25281 4374 1 8 . 1 1 111 111 SER N N 111 114.870 114.870 119.403 -4.533 25281 4375 1 8 . 1 1 111 111 SER CA C 111 57.290 57.290 56.696 0.594 25281 4376 1 8 . 1 1 111 111 SER CB C 111 66.110 66.110 66.176 -0.066 25281 4377 1 8 . 1 1 111 111 SER H H 111 8.740 8.740 8.574 0.166 25281 4378 1 8 . 1 1 112 112 LYS N N 112 120.870 120.870 122.760 -1.890 25281 4379 1 8 . 1 1 112 112 LYS CA C 112 55.150 55.150 54.823 0.327 25281 4380 1 8 . 1 1 112 112 LYS CB C 112 36.330 36.330 35.929 0.401 25281 4381 1 8 . 1 1 112 112 LYS H H 112 8.520 8.520 8.087 0.433 25281 4382 1 8 . 1 1 113 113 THR N N 113 121.390 121.390 113.633 7.757 25281 4383 1 8 . 1 1 113 113 THR CA C 113 61.250 61.250 60.812 0.438 25281 4384 1 8 . 1 1 113 113 THR CB C 113 70.010 70.010 70.523 -0.513 25281 4385 1 8 . 1 1 113 113 THR H H 113 8.440 8.440 8.341 0.099 25281 4386 1 8 . 1 1 114 114 SER N N 114 120.730 120.730 118.003 2.727 25281 4387 1 8 . 1 1 114 114 SER CA C 114 56.190 56.190 57.588 -1.398 25281 4388 1 8 . 1 1 114 114 SER CB C 114 66.380 66.380 65.571 0.809 25281 4389 1 8 . 1 1 114 114 SER H H 114 9.350 9.350 8.122 1.228 25281 4390 1 8 . 1 1 115 115 LEU N N 115 121.540 121.540 126.235 -4.695 25281 4391 1 8 . 1 1 115 115 LEU CA C 115 55.480 55.480 54.413 1.067 25281 4392 1 8 . 1 1 115 115 LEU CB C 115 42.890 42.890 43.029 -0.139 25281 4393 1 8 . 1 1 115 115 LEU H H 115 8.200 8.200 9.050 -0.850 25281 4394 1 8 . 1 1 116 116 ALA N N 116 129.060 129.060 127.797 1.263 25281 4395 1 8 . 1 1 116 116 ALA CA C 116 49.960 49.960 50.264 -0.304 25281 4396 1 8 . 1 1 116 116 ALA CB C 116 20.310 20.310 22.551 -2.241 25281 4397 1 8 . 1 1 116 116 ALA H H 116 8.600 8.600 8.823 -0.223 25281 4398 1 8 . 1 1 117 117 TYR N N 117 115.890 115.890 125.181 -9.291 25281 4399 1 8 . 1 1 117 117 TYR CA C 117 55.150 55.150 57.393 -2.243 25281 4400 1 8 . 1 1 117 117 TYR CB C 117 41.200 41.200 42.338 -1.138 25281 4401 1 8 . 1 1 117 117 TYR H H 117 8.450 8.450 8.173 0.277 25281 4402 1 8 . 1 1 118 118 GLY N N 118 107.330 107.330 110.790 -3.460 25281 4403 1 8 . 1 1 118 118 GLY CA C 118 45.940 45.940 44.513 1.427 25281 4404 1 8 . 1 1 118 118 GLY H H 118 9.340 9.340 7.766 1.574 25281 4405 1 8 . 1 1 119 119 ALA N N 119 118.880 118.880 119.283 -0.403 25281 4406 1 8 . 1 1 119 119 ALA CA C 119 51.320 51.320 50.855 0.465 25281 4407 1 8 . 1 1 119 119 ALA CB C 119 22.120 22.120 22.162 -0.042 25281 4408 1 8 . 1 1 119 119 ALA H H 119 8.770 8.770 6.958 1.812 25281 4409 1 8 . 1 1 120 120 GLY N N 120 105.730 105.730 105.529 0.201 25281 4410 1 8 . 1 1 120 120 GLY CA C 120 45.650 45.650 45.131 0.519 25281 4411 1 8 . 1 1 120 120 GLY H H 120 7.940 7.940 7.517 0.423 25281 4412 1 8 . 1 1 121 121 LEU N N 121 115.480 115.480 114.290 1.190 25281 4413 1 8 . 1 1 121 121 LEU CA C 121 52.980 52.980 53.395 -0.415 25281 4414 1 8 . 1 1 121 121 LEU CB C 121 46.460 46.460 45.975 0.485 25281 4415 1 8 . 1 1 121 121 LEU H H 121 9.010 9.010 8.238 0.772 25281 4416 1 8 . 1 1 122 122 GLN N N 122 112.530 112.530 119.709 -7.179 25281 4417 1 8 . 1 1 122 122 GLN CA C 122 54.780 54.780 54.831 -0.051 25281 4418 1 8 . 1 1 122 122 GLN CB C 122 31.400 31.400 33.420 -2.020 25281 4419 1 8 . 1 1 122 122 GLN H H 122 8.090 8.090 8.860 -0.770 25281 4420 1 8 . 1 1 123 123 PHE N N 123 126.050 126.050 124.520 1.530 25281 4421 1 8 . 1 1 123 123 PHE CA C 123 54.180 54.180 56.389 -2.209 25281 4422 1 8 . 1 1 123 123 PHE CB C 123 42.560 42.560 42.728 -0.168 25281 4423 1 8 . 1 1 123 123 PHE H H 123 10.020 10.020 8.786 1.234 25281 4424 1 8 . 1 1 124 124 ASN N N 124 121.910 121.910 121.470 0.440 25281 4425 1 8 . 1 1 124 124 ASN CA C 124 50.940 50.940 50.059 0.881 25281 4426 1 8 . 1 1 124 124 ASN CB C 124 40.360 40.360 40.664 -0.304 25281 4427 1 8 . 1 1 124 124 ASN H H 124 9.520 9.520 8.638 0.882 25281 4428 1 8 . 1 1 125 125 PRO CA C 125 63.390 63.390 63.035 0.355 25281 4429 1 8 . 1 1 125 125 PRO CB C 125 31.210 31.210 32.210 -1.000 25281 4430 1 8 . 1 1 126 126 HIS N N 126 116.830 116.830 119.955 -3.125 25281 4431 1 8 . 1 1 126 126 HIS CA C 126 54.110 54.110 56.987 -2.877 25281 4432 1 8 . 1 1 126 126 HIS CB C 126 34.910 34.910 29.674 5.236 25281 4433 1 8 . 1 1 126 126 HIS H H 126 7.630 7.630 8.284 -0.654 25281 4434 1 8 . 1 1 127 127 PRO CA C 127 65.370 65.370 63.692 1.678 25281 4435 1 8 . 1 1 127 127 PRO CB C 127 31.030 31.030 30.614 0.416 25281 4436 1 8 . 1 1 128 128 ASN N N 128 114.680 114.680 117.605 -2.925 25281 4437 1 8 . 1 1 128 128 ASN CA C 128 53.990 53.990 53.998 -0.008 25281 4438 1 8 . 1 1 128 128 ASN CB C 128 40.550 40.550 41.051 -0.501 25281 4439 1 8 . 1 1 128 128 ASN H H 128 10.460 10.460 8.160 2.300 25281 4440 1 8 . 1 1 129 129 PHE N N 129 119.630 119.630 117.556 2.074 25281 4441 1 8 . 1 1 129 129 PHE CA C 129 56.530 56.530 57.071 -0.541 25281 4442 1 8 . 1 1 129 129 PHE CB C 129 44.310 44.310 42.944 1.367 25281 4443 1 8 . 1 1 129 129 PHE H H 129 8.340 8.340 7.437 0.903 25281 4444 1 8 . 1 1 130 130 VAL N N 130 123.000 123.000 120.094 2.906 25281 4445 1 8 . 1 1 130 130 VAL CA C 130 60.340 60.340 61.670 -1.330 25281 4446 1 8 . 1 1 130 130 VAL CB C 130 34.970 34.970 35.452 -0.482 25281 4447 1 8 . 1 1 130 130 VAL H H 130 7.820 7.820 8.458 -0.638 25281 4448 1 8 . 1 1 131 131 ILE N N 131 124.470 124.470 127.307 -2.837 25281 4449 1 8 . 1 1 131 131 ILE CA C 131 60.210 60.210 59.268 0.942 25281 4450 1 8 . 1 1 131 131 ILE CB C 131 39.510 39.510 41.703 -2.193 25281 4451 1 8 . 1 1 131 131 ILE H H 131 8.830 8.830 8.920 -0.090 25281 4452 1 8 . 1 1 132 132 ASP N N 132 130.700 130.700 129.575 1.125 25281 4453 1 8 . 1 1 132 132 ASP CA C 132 53.530 53.530 53.046 0.484 25281 4454 1 8 . 1 1 132 132 ASP CB C 132 47.620 47.620 44.571 3.049 25281 4455 1 8 . 1 1 132 132 ASP H H 132 9.040 9.040 8.493 0.547 25281 4456 1 8 . 1 1 133 133 ALA N N 133 126.900 126.900 128.845 -1.945 25281 4457 1 8 . 1 1 133 133 ALA CA C 133 51.390 51.390 50.484 0.906 25281 4458 1 8 . 1 1 133 133 ALA CB C 133 21.730 21.730 22.127 -0.397 25281 4459 1 8 . 1 1 133 133 ALA H H 133 8.800 8.800 8.274 0.526 25281 4460 1 8 . 1 1 134 134 SER N N 134 113.760 113.760 118.173 -4.413 25281 4461 1 8 . 1 1 134 134 SER CA C 134 58.140 58.140 57.307 0.833 25281 4462 1 8 . 1 1 134 134 SER CB C 134 67.020 67.020 65.885 1.135 25281 4463 1 8 . 1 1 134 134 SER H H 134 9.160 9.160 8.404 0.756 25281 4464 1 8 . 1 1 135 135 TYR N N 135 118.500 118.500 119.762 -1.262 25281 4465 1 8 . 1 1 135 135 TYR CA C 135 55.690 55.690 55.630 0.060 25281 4466 1 8 . 1 1 135 135 TYR CB C 135 43.150 43.150 41.227 1.923 25281 4467 1 8 . 1 1 135 135 TYR H H 135 8.820 8.820 7.923 0.897 25281 4468 1 8 . 1 1 136 136 GLU N N 136 126.290 126.290 118.377 7.913 25281 4469 1 8 . 1 1 136 136 GLU CA C 136 53.530 53.530 54.673 -1.143 25281 4470 1 8 . 1 1 136 136 GLU CB C 136 34.450 34.450 34.676 -0.226 25281 4471 1 8 . 1 1 136 136 GLU H H 136 8.380 8.380 8.913 -0.533 25281 4472 1 8 . 1 1 137 137 TYR N N 137 123.630 123.630 123.565 0.065 25281 4473 1 8 . 1 1 137 137 TYR CA C 137 55.670 55.670 56.678 -1.008 25281 4474 1 8 . 1 1 137 137 TYR CB C 137 43.150 43.150 42.780 0.370 25281 4475 1 8 . 1 1 137 137 TYR H H 137 9.300 9.300 8.940 0.360 25281 4476 1 8 . 1 1 138 138 SER N N 138 118.300 118.300 121.540 -3.240 25281 4477 1 8 . 1 1 138 138 SER CA C 138 58.270 58.270 56.017 2.253 25281 4478 1 8 . 1 1 138 138 SER CB C 138 67.090 67.090 65.648 1.442 25281 4479 1 8 . 1 1 138 138 SER H H 138 7.980 7.980 8.471 -0.491 25281 4480 1 8 . 1 1 139 139 LYS N N 139 127.450 127.450 127.200 0.250 25281 4481 1 8 . 1 1 139 139 LYS CA C 139 55.160 55.160 55.839 -0.679 25281 4482 1 8 . 1 1 139 139 LYS CB C 139 32.640 32.640 32.924 -0.284 25281 4483 1 8 . 1 1 139 139 LYS H H 139 8.630 8.630 7.942 0.688 25281 4484 1 8 . 1 1 140 140 LEU N N 140 129.650 129.650 126.106 3.544 25281 4485 1 8 . 1 1 140 140 LEU CA C 140 52.500 52.500 53.417 -0.917 25281 4486 1 8 . 1 1 140 140 LEU CB C 140 40.000 40.000 44.937 -4.937 25281 4487 1 8 . 1 1 140 140 LEU H H 140 9.060 9.060 7.899 1.161 25281 4488 1 8 . 1 1 141 141 ASP N N 141 121.470 121.470 124.190 -2.720 25281 4489 1 8 . 1 1 141 141 ASP CA C 141 57.190 57.190 56.935 0.255 25281 4490 1 8 . 1 1 141 141 ASP CB C 141 39.730 39.730 40.740 -1.010 25281 4491 1 8 . 1 1 141 141 ASP H H 141 8.590 8.590 8.752 -0.162 25281 4492 1 8 . 1 1 142 142 ASP N N 142 121.510 121.510 119.286 2.224 25281 4493 1 8 . 1 1 142 142 ASP CA C 142 55.180 55.180 55.401 -0.221 25281 4494 1 8 . 1 1 142 142 ASP CB C 142 41.090 41.090 41.183 -0.093 25281 4495 1 8 . 1 1 142 142 ASP H H 142 8.430 8.430 8.357 0.073 25281 4496 1 8 . 1 1 143 143 VAL N N 143 121.420 121.420 110.582 10.838 25281 4497 1 8 . 1 1 143 143 VAL CA C 143 62.240 62.240 60.328 1.911 25281 4498 1 8 . 1 1 143 143 VAL CB C 143 31.280 31.280 35.108 -3.829 25281 4499 1 8 . 1 1 143 143 VAL H H 143 8.020 8.020 7.489 0.531 25281 4500 1 8 . 1 1 144 144 LYS N N 144 127.950 127.950 122.305 5.645 25281 4501 1 8 . 1 1 144 144 LYS CA C 144 55.440 55.440 54.612 0.828 25281 4502 1 8 . 1 1 144 144 LYS CB C 144 32.640 32.640 33.521 -0.881 25281 4503 1 8 . 1 1 144 144 LYS H H 144 8.660 8.660 8.206 0.454 25281 4504 1 8 . 1 1 145 145 VAL N N 145 124.120 124.120 123.071 1.049 25281 4505 1 8 . 1 1 145 145 VAL CA C 145 55.910 55.910 60.332 -4.422 25281 4506 1 8 . 1 1 145 145 VAL CB C 145 32.570 32.570 33.861 -1.291 25281 4507 1 8 . 1 1 145 145 VAL H H 145 8.720 8.720 7.462 1.258 25281 4508 1 8 . 1 1 146 146 GLY N N 146 116.240 116.240 114.977 1.263 25281 4509 1 8 . 1 1 146 146 GLY CA C 146 44.080 44.080 44.340 -0.260 25281 4510 1 8 . 1 1 146 146 GLY H H 146 8.400 8.400 8.450 -0.050 25281 4511 1 8 . 1 1 147 147 THR N N 147 124.620 124.620 115.677 8.943 25281 4512 1 8 . 1 1 147 147 THR CA C 147 61.450 61.450 59.601 1.849 25281 4513 1 8 . 1 1 147 147 THR CB C 147 70.260 70.260 71.260 -1.000 25281 4514 1 8 . 1 1 147 147 THR H H 147 9.080 9.080 8.724 0.356 25281 4515 1 8 . 1 1 148 148 TRP N N 148 124.790 124.790 124.816 -0.026 25281 4516 1 8 . 1 1 148 148 TRP CA C 148 54.770 54.770 56.310 -1.540 25281 4517 1 8 . 1 1 148 148 TRP CB C 148 33.090 33.090 33.886 -0.796 25281 4518 1 8 . 1 1 148 148 TRP H H 148 8.510 8.510 9.507 -0.997 25281 4519 1 8 . 1 1 149 149 MET N N 149 118.880 118.880 120.965 -2.085 25281 4520 1 8 . 1 1 149 149 MET CA C 149 54.540 54.540 54.719 -0.179 25281 4521 1 8 . 1 1 149 149 MET CB C 149 34.640 34.640 36.139 -1.499 25281 4522 1 8 . 1 1 149 149 MET H H 149 9.150 9.150 9.426 -0.276 25281 4523 1 8 . 1 1 150 150 LEU N N 150 122.830 122.830 125.051 -2.221 25281 4524 1 8 . 1 1 150 150 LEU CA C 150 54.100 54.100 53.778 0.322 25281 4525 1 8 . 1 1 150 150 LEU CB C 150 45.800 45.800 45.575 0.225 25281 4526 1 8 . 1 1 150 150 LEU H H 150 8.480 8.480 8.136 0.344 25281 4527 1 8 . 1 1 151 151 GLY N N 151 112.730 112.730 111.585 1.145 25281 4528 1 8 . 1 1 151 151 GLY CA C 151 45.940 45.940 45.747 0.193 25281 4529 1 8 . 1 1 151 151 GLY H H 151 9.820 9.820 8.129 1.691 25281 4530 1 8 . 1 1 152 152 ALA N N 152 119.460 119.460 119.974 -0.514 25281 4531 1 8 . 1 1 152 152 ALA CA C 152 49.760 49.760 50.849 -1.089 25281 4532 1 8 . 1 1 152 152 ALA CB C 152 22.700 22.700 22.840 -0.140 25281 4533 1 8 . 1 1 152 152 ALA H H 152 8.840 8.840 8.129 0.711 25281 4534 1 8 . 1 1 153 153 GLY N N 153 104.360 104.360 106.738 -2.378 25281 4535 1 8 . 1 1 153 153 GLY CA C 153 46.440 46.440 44.450 1.990 25281 4536 1 8 . 1 1 153 153 GLY H H 153 8.540 8.540 8.510 0.030 25281 4537 1 8 . 1 1 154 154 TYR N N 154 120.680 120.680 119.905 0.775 25281 4538 1 8 . 1 1 154 154 TYR CA C 154 55.370 55.370 56.381 -1.011 25281 4539 1 8 . 1 1 154 154 TYR CB C 154 44.250 44.250 42.259 1.991 25281 4540 1 8 . 1 1 154 154 TYR H H 154 8.310 8.310 7.952 0.358 25281 4541 1 8 . 1 1 155 155 ARG N N 155 127.050 127.050 126.385 0.665 25281 4542 1 8 . 1 1 155 155 ARG CA C 155 53.480 53.480 55.064 -1.584 25281 4543 1 8 . 1 1 155 155 ARG CB C 155 32.160 32.160 30.871 1.289 25281 4544 1 8 . 1 1 155 155 ARG H H 155 7.640 7.640 7.604 0.036 25281 4545 1 9 . 1 1 2 2 GLY N N 2 112.280 112.280 108.845 3.435 25281 4546 1 9 . 1 1 2 2 GLY CA C 2 44.830 44.830 44.591 0.239 25281 4547 1 9 . 1 1 2 2 GLY H H 2 8.460 8.460 7.910 0.550 25281 4548 1 9 . 1 1 3 3 GLU N N 3 118.460 118.460 120.763 -2.303 25281 4549 1 9 . 1 1 3 3 GLU CA C 3 56.840 56.840 56.924 -0.084 25281 4550 1 9 . 1 1 3 3 GLU CB C 3 29.980 29.980 30.349 -0.369 25281 4551 1 9 . 1 1 3 3 GLU H H 3 7.630 7.630 8.347 -0.717 25281 4552 1 9 . 1 1 4 4 SER N N 4 119.000 119.000 117.436 1.564 25281 4553 1 9 . 1 1 4 4 SER CA C 4 57.280 57.280 57.222 0.058 25281 4554 1 9 . 1 1 4 4 SER CB C 4 65.860 65.860 65.037 0.823 25281 4555 1 9 . 1 1 4 4 SER H H 4 8.820 8.820 8.367 0.453 25281 4556 1 9 . 1 1 5 5 SER N N 5 118.300 118.300 118.738 -0.438 25281 4557 1 9 . 1 1 5 5 SER CA C 5 57.560 57.560 57.247 0.313 25281 4558 1 9 . 1 1 5 5 SER CB C 5 65.480 65.480 65.150 0.331 25281 4559 1 9 . 1 1 5 5 SER H H 5 8.700 8.700 8.142 0.558 25281 4560 1 9 . 1 1 6 6 ILE N N 6 123.240 123.240 125.622 -2.382 25281 4561 1 9 . 1 1 6 6 ILE CA C 6 54.110 54.110 59.451 -5.341 25281 4562 1 9 . 1 1 6 6 ILE CB C 6 33.870 33.870 39.241 -5.371 25281 4563 1 9 . 1 1 6 6 ILE H H 6 9.080 9.080 8.065 1.015 25281 4564 1 9 . 1 1 7 7 SER N N 7 116.100 116.100 121.680 -5.580 25281 4565 1 9 . 1 1 7 7 SER CA C 7 57.130 57.130 57.625 -0.495 25281 4566 1 9 . 1 1 7 7 SER CB C 7 65.710 65.710 65.666 0.044 25281 4567 1 9 . 1 1 7 7 SER H H 7 8.570 8.570 8.927 -0.357 25281 4568 1 9 . 1 1 8 8 ILE N N 8 114.140 114.140 117.569 -3.429 25281 4569 1 9 . 1 1 8 8 ILE CA C 8 58.460 58.460 58.588 -0.128 25281 4570 1 9 . 1 1 8 8 ILE CB C 8 40.880 40.880 42.428 -1.548 25281 4571 1 9 . 1 1 8 8 ILE H H 8 8.300 8.300 8.506 -0.206 25281 4572 1 9 . 1 1 9 9 GLY N N 9 109.200 109.200 107.949 1.251 25281 4573 1 9 . 1 1 9 9 GLY CA C 9 45.550 45.550 45.730 -0.180 25281 4574 1 9 . 1 1 9 9 GLY H H 9 9.060 9.060 7.786 1.274 25281 4575 1 9 . 1 1 10 10 TYR N N 10 121.410 121.410 119.110 2.300 25281 4576 1 9 . 1 1 10 10 TYR CA C 10 56.970 56.970 57.239 -0.269 25281 4577 1 9 . 1 1 10 10 TYR CB C 10 41.520 41.520 41.583 -0.063 25281 4578 1 9 . 1 1 10 10 TYR H H 10 8.870 8.870 7.962 0.908 25281 4579 1 9 . 1 1 11 11 ALA N N 11 125.250 125.250 123.192 2.058 25281 4580 1 9 . 1 1 11 11 ALA CA C 11 48.740 48.740 50.032 -1.292 25281 4581 1 9 . 1 1 11 11 ALA CB C 11 21.610 21.610 22.042 -0.432 25281 4582 1 9 . 1 1 11 11 ALA H H 11 7.210 7.210 8.327 -1.117 25281 4583 1 9 . 1 1 12 12 GLN N N 12 119.180 119.180 120.817 -1.637 25281 4584 1 9 . 1 1 12 12 GLN CA C 12 54.690 54.690 54.120 0.570 25281 4585 1 9 . 1 1 12 12 GLN CB C 12 32.000 32.000 33.041 -1.042 25281 4586 1 9 . 1 1 12 12 GLN H H 12 8.330 8.330 8.650 -0.320 25281 4587 1 9 . 1 1 13 13 SER N N 13 122.790 122.790 116.210 6.580 25281 4588 1 9 . 1 1 13 13 SER CA C 13 57.780 57.780 57.265 0.515 25281 4589 1 9 . 1 1 13 13 SER CB C 13 64.540 64.540 66.960 -2.420 25281 4590 1 9 . 1 1 13 13 SER H H 13 8.610 8.610 8.831 -0.221 25281 4591 1 9 . 1 1 14 14 ARG N N 14 121.140 121.140 120.135 1.005 25281 4592 1 9 . 1 1 14 14 ARG CA C 14 54.960 54.960 55.258 -0.298 25281 4593 1 9 . 1 1 14 14 ARG CB C 14 32.370 32.370 33.584 -1.214 25281 4594 1 9 . 1 1 14 14 ARG H H 14 8.520 8.520 8.577 -0.057 25281 4595 1 9 . 1 1 15 15 VAL N N 15 115.890 115.890 119.803 -3.913 25281 4596 1 9 . 1 1 15 15 VAL CA C 15 60.970 60.970 61.550 -0.580 25281 4597 1 9 . 1 1 15 15 VAL CB C 15 34.320 34.320 34.895 -0.575 25281 4598 1 9 . 1 1 15 15 VAL H H 15 8.440 8.440 8.570 -0.130 25281 4599 1 9 . 1 1 16 16 LYS N N 16 126.010 126.010 125.498 0.512 25281 4600 1 9 . 1 1 16 16 LYS CA C 16 55.120 55.120 55.832 -0.712 25281 4601 1 9 . 1 1 16 16 LYS CB C 16 34.350 34.350 32.327 2.023 25281 4602 1 9 . 1 1 16 16 LYS H H 16 8.850 8.850 8.433 0.417 25281 4603 1 9 . 1 1 17 17 GLU N N 17 119.140 119.140 123.633 -4.493 25281 4604 1 9 . 1 1 17 17 GLU CA C 17 54.460 54.460 54.701 -0.241 25281 4605 1 9 . 1 1 17 17 GLU CB C 17 33.430 33.430 31.385 2.045 25281 4606 1 9 . 1 1 17 17 GLU H H 17 8.030 8.030 8.612 -0.582 25281 4607 1 9 . 1 1 18 18 ASP N N 18 120.280 120.280 120.446 -0.166 25281 4608 1 9 . 1 1 18 18 ASP CA C 18 56.500 56.500 54.641 1.859 25281 4609 1 9 . 1 1 18 18 ASP CB C 18 33.780 33.780 41.142 -7.362 25281 4610 1 9 . 1 1 18 18 ASP H H 18 8.120 8.120 8.612 -0.492 25281 4611 1 9 . 1 1 19 19 GLY N N 19 118.750 118.750 109.837 8.913 25281 4612 1 9 . 1 1 19 19 GLY CA C 19 44.130 44.130 44.743 -0.613 25281 4613 1 9 . 1 1 19 19 GLY H H 19 8.430 8.430 8.378 0.052 25281 4614 1 9 . 1 1 20 20 TYR N N 20 117.080 117.080 124.268 -7.188 25281 4615 1 9 . 1 1 20 20 TYR CA C 20 60.940 60.940 58.120 2.820 25281 4616 1 9 . 1 1 20 20 TYR CB C 20 42.010 42.010 38.109 3.901 25281 4617 1 9 . 1 1 20 20 TYR H H 20 8.610 8.610 8.682 -0.072 25281 4618 1 9 . 1 1 21 21 LYS N N 21 127.240 127.240 125.619 1.621 25281 4619 1 9 . 1 1 21 21 LYS CA C 21 56.760 56.760 57.285 -0.525 25281 4620 1 9 . 1 1 21 21 LYS CB C 21 29.100 29.100 32.501 -3.401 25281 4621 1 9 . 1 1 21 21 LYS H H 21 7.970 7.970 8.914 -0.944 25281 4622 1 9 . 1 1 22 22 LEU N N 22 122.270 122.270 122.138 0.132 25281 4623 1 9 . 1 1 22 22 LEU CA C 22 59.170 59.170 57.654 1.516 25281 4624 1 9 . 1 1 22 22 LEU CB C 22 40.030 40.030 41.019 -0.989 25281 4625 1 9 . 1 1 22 22 LEU H H 22 8.370 8.370 8.205 0.165 25281 4626 1 9 . 1 1 23 23 ASP N N 23 114.790 114.790 113.851 0.939 25281 4627 1 9 . 1 1 23 23 ASP CA C 23 51.840 51.840 53.351 -1.511 25281 4628 1 9 . 1 1 23 23 ASP CB C 23 37.730 37.730 40.927 -3.197 25281 4629 1 9 . 1 1 23 23 ASP H H 23 8.210 8.210 8.194 0.016 25281 4630 1 9 . 1 1 24 24 LYS N N 24 115.470 115.470 114.122 1.348 25281 4631 1 9 . 1 1 24 24 LYS CA C 24 58.860 58.860 57.805 1.055 25281 4632 1 9 . 1 1 24 24 LYS CB C 24 28.330 28.330 30.531 -2.201 25281 4633 1 9 . 1 1 24 24 LYS H H 24 9.230 9.230 8.033 1.197 25281 4634 1 9 . 1 1 25 25 ASN N N 25 121.610 121.610 118.605 3.005 25281 4635 1 9 . 1 1 25 25 ASN CA C 25 54.430 54.430 49.958 4.472 25281 4636 1 9 . 1 1 25 25 ASN CB C 25 42.500 42.500 39.579 2.921 25281 4637 1 9 . 1 1 25 25 ASN H H 25 8.150 8.150 7.987 0.163 25281 4638 1 9 . 1 1 26 26 PRO CA C 26 63.340 63.340 62.861 0.479 25281 4639 1 9 . 1 1 26 26 PRO CB C 26 30.940 30.940 33.296 -2.356 25281 4640 1 9 . 1 1 27 27 ARG N N 27 120.730 120.730 117.855 2.875 25281 4641 1 9 . 1 1 27 27 ARG CA C 27 54.340 54.340 55.021 -0.681 25281 4642 1 9 . 1 1 27 27 ARG CB C 27 33.500 33.500 33.595 -0.095 25281 4643 1 9 . 1 1 27 27 ARG H H 27 8.290 8.290 8.154 0.136 25281 4644 1 9 . 1 1 28 28 GLY N N 28 112.000 112.000 107.540 4.460 25281 4645 1 9 . 1 1 28 28 GLY CA C 28 46.940 46.940 45.057 1.883 25281 4646 1 9 . 1 1 28 28 GLY H H 28 8.810 8.810 7.849 0.961 25281 4647 1 9 . 1 1 29 29 PHE N N 29 121.230 121.230 116.655 4.575 25281 4648 1 9 . 1 1 29 29 PHE CA C 29 55.230 55.230 57.100 -1.870 25281 4649 1 9 . 1 1 29 29 PHE CB C 29 43.700 43.700 43.045 0.655 25281 4650 1 9 . 1 1 29 29 PHE H H 29 8.470 8.470 8.429 0.041 25281 4651 1 9 . 1 1 30 30 ASN N N 30 117.250 117.250 120.307 -3.057 25281 4652 1 9 . 1 1 30 30 ASN CA C 30 50.220 50.220 52.716 -2.496 25281 4653 1 9 . 1 1 30 30 ASN CB C 30 45.810 45.810 40.544 5.266 25281 4654 1 9 . 1 1 30 30 ASN H H 30 8.630 8.630 8.380 0.250 25281 4655 1 9 . 1 1 31 31 LEU N N 31 128.180 128.180 126.817 1.363 25281 4656 1 9 . 1 1 31 31 LEU CA C 31 53.930 53.930 53.917 0.013 25281 4657 1 9 . 1 1 31 31 LEU CB C 31 45.810 45.810 44.456 1.354 25281 4658 1 9 . 1 1 31 31 LEU H H 31 9.080 9.080 8.807 0.273 25281 4659 1 9 . 1 1 32 32 LYS N N 32 119.980 119.980 121.829 -1.849 25281 4660 1 9 . 1 1 32 32 LYS CA C 32 55.730 55.730 54.734 0.996 25281 4661 1 9 . 1 1 32 32 LYS CB C 32 36.070 36.070 36.933 -0.863 25281 4662 1 9 . 1 1 32 32 LYS H H 32 8.780 8.780 8.565 0.215 25281 4663 1 9 . 1 1 33 33 TYR N N 33 121.500 121.500 119.657 1.843 25281 4664 1 9 . 1 1 33 33 TYR CA C 33 55.830 55.830 55.449 0.381 25281 4665 1 9 . 1 1 33 33 TYR CB C 33 42.110 42.110 41.724 0.386 25281 4666 1 9 . 1 1 33 33 TYR H H 33 8.640 8.640 7.916 0.724 25281 4667 1 9 . 1 1 34 34 ARG N N 34 128.980 128.980 121.185 7.795 25281 4668 1 9 . 1 1 34 34 ARG CA C 34 52.690 52.690 54.861 -2.171 25281 4669 1 9 . 1 1 34 34 ARG CB C 34 34.320 34.320 33.777 0.543 25281 4670 1 9 . 1 1 34 34 ARG H H 34 8.830 8.830 8.467 0.363 25281 4671 1 9 . 1 1 35 35 TYR N N 35 124.820 124.820 126.415 -1.595 25281 4672 1 9 . 1 1 35 35 TYR CA C 35 56.640 56.640 56.935 -0.295 25281 4673 1 9 . 1 1 35 35 TYR CB C 35 41.980 41.980 40.853 1.127 25281 4674 1 9 . 1 1 35 35 TYR H H 35 8.840 8.840 8.174 0.666 25281 4675 1 9 . 1 1 39 39 ASN N N 39 127.690 127.690 118.108 9.582 25281 4676 1 9 . 1 1 39 39 ASN CA C 39 54.850 54.850 54.354 0.496 25281 4677 1 9 . 1 1 39 39 ASN CB C 39 38.290 38.290 38.049 0.241 25281 4678 1 9 . 1 1 39 39 ASN H H 39 7.990 7.990 8.763 -0.773 25281 4679 1 9 . 1 1 40 40 ASP N N 40 115.200 115.200 116.766 -1.566 25281 4680 1 9 . 1 1 40 40 ASP CA C 40 55.210 55.210 53.011 2.199 25281 4681 1 9 . 1 1 40 40 ASP CB C 40 44.010 44.010 42.112 1.898 25281 4682 1 9 . 1 1 40 40 ASP H H 40 8.370 8.370 7.945 0.425 25281 4683 1 9 . 1 1 41 41 TRP N N 41 124.210 124.210 118.681 5.529 25281 4684 1 9 . 1 1 41 41 TRP CA C 41 55.840 55.840 56.178 -0.338 25281 4685 1 9 . 1 1 41 41 TRP CB C 41 33.540 33.540 30.365 3.175 25281 4686 1 9 . 1 1 41 41 TRP H H 41 9.130 9.130 7.298 1.832 25281 4687 1 9 . 1 1 42 42 GLY N N 42 107.800 107.800 105.870 1.930 25281 4688 1 9 . 1 1 42 42 GLY CA C 42 45.870 45.870 44.986 0.884 25281 4689 1 9 . 1 1 42 42 GLY H H 42 8.610 8.610 8.105 0.505 25281 4690 1 9 . 1 1 43 43 VAL N N 43 116.260 116.260 119.205 -2.945 25281 4691 1 9 . 1 1 43 43 VAL CA C 43 58.980 58.980 59.339 -0.359 25281 4692 1 9 . 1 1 43 43 VAL CB C 43 35.430 35.430 35.373 0.056 25281 4693 1 9 . 1 1 43 43 VAL H H 43 8.880 8.880 7.891 0.989 25281 4694 1 9 . 1 1 44 44 ILE N N 44 124.720 124.720 121.178 3.542 25281 4695 1 9 . 1 1 44 44 ILE CA C 44 58.390 58.390 58.453 -0.063 25281 4696 1 9 . 1 1 44 44 ILE CB C 44 42.890 42.890 40.935 1.954 25281 4697 1 9 . 1 1 44 44 ILE H H 44 9.110 9.110 8.053 1.057 25281 4698 1 9 . 1 1 45 45 GLY N N 45 110.610 110.610 108.420 2.190 25281 4699 1 9 . 1 1 45 45 GLY CA C 45 43.150 43.150 43.784 -0.634 25281 4700 1 9 . 1 1 45 45 GLY H H 45 8.910 8.910 7.259 1.651 25281 4701 1 9 . 1 1 46 46 SER N N 46 116.210 116.210 118.649 -2.439 25281 4702 1 9 . 1 1 46 46 SER CA C 46 56.250 56.250 56.169 0.081 25281 4703 1 9 . 1 1 46 46 SER CB C 46 63.720 63.720 64.960 -1.240 25281 4704 1 9 . 1 1 46 46 SER H H 46 9.250 9.250 8.536 0.714 25281 4705 1 9 . 1 1 47 47 PHE N N 47 126.400 126.400 127.609 -1.209 25281 4706 1 9 . 1 1 47 47 PHE CA C 47 55.090 55.090 56.408 -1.318 25281 4707 1 9 . 1 1 47 47 PHE CB C 47 42.560 42.560 43.253 -0.693 25281 4708 1 9 . 1 1 47 47 PHE H H 47 8.940 8.940 8.821 0.119 25281 4709 1 9 . 1 1 48 48 ALA N N 48 131.930 131.930 123.981 7.949 25281 4710 1 9 . 1 1 48 48 ALA CA C 48 50.350 50.350 51.046 -0.696 25281 4711 1 9 . 1 1 48 48 ALA CB C 48 21.280 21.280 23.097 -1.817 25281 4712 1 9 . 1 1 48 48 ALA H H 48 8.790 8.790 8.608 0.182 25281 4713 1 9 . 1 1 49 49 GLN N N 49 116.070 116.070 119.454 -3.384 25281 4714 1 9 . 1 1 49 49 GLN CA C 49 54.110 54.110 54.937 -0.827 25281 4715 1 9 . 1 1 49 49 GLN CB C 49 31.140 31.140 33.424 -2.284 25281 4716 1 9 . 1 1 49 49 GLN H H 49 7.720 7.720 8.415 -0.695 25281 4717 1 9 . 1 1 50 50 THR N N 50 115.990 115.990 113.576 2.414 25281 4718 1 9 . 1 1 50 50 THR CA C 50 59.270 59.270 59.887 -0.617 25281 4719 1 9 . 1 1 50 50 THR CB C 50 70.980 70.980 71.734 -0.754 25281 4720 1 9 . 1 1 50 50 THR H H 50 9.470 9.470 9.328 0.142 25281 4721 1 9 . 1 1 51 51 ARG N N 51 117.600 117.600 119.925 -2.325 25281 4722 1 9 . 1 1 51 51 ARG CA C 51 55.350 55.350 55.212 0.137 25281 4723 1 9 . 1 1 51 51 ARG CB C 51 33.610 33.610 33.541 0.069 25281 4724 1 9 . 1 1 51 51 ARG H H 51 8.600 8.600 8.308 0.292 25281 4725 1 9 . 1 1 52 52 ARG N N 52 121.400 121.400 122.776 -1.376 25281 4726 1 9 . 1 1 52 52 ARG CA C 52 56.910 56.910 55.236 1.674 25281 4727 1 9 . 1 1 52 52 ARG CB C 52 29.370 29.370 30.793 -1.423 25281 4728 1 9 . 1 1 52 52 ARG H H 52 8.380 8.380 8.046 0.334 25281 4729 1 9 . 1 1 53 53 GLY N N 53 111.040 111.040 116.053 -5.013 25281 4730 1 9 . 1 1 53 53 GLY CA C 53 45.190 45.190 46.817 -1.627 25281 4731 1 9 . 1 1 53 53 GLY H H 53 8.330 8.330 8.917 -0.587 25281 4732 1 9 . 1 1 54 54 PHE N N 54 119.210 119.210 115.511 3.699 25281 4733 1 9 . 1 1 54 54 PHE CA C 54 55.670 55.670 56.093 -0.423 25281 4734 1 9 . 1 1 54 54 PHE CB C 54 29.220 29.220 40.241 -11.021 25281 4735 1 9 . 1 1 54 54 PHE H H 54 7.720 7.720 7.680 0.040 25281 4736 1 9 . 1 1 55 55 GLU N N 55 123.470 123.470 119.977 3.493 25281 4737 1 9 . 1 1 55 55 GLU CA C 55 55.580 55.580 57.310 -1.730 25281 4738 1 9 . 1 1 55 55 GLU CB C 55 32.920 32.920 30.389 2.531 25281 4739 1 9 . 1 1 55 55 GLU H H 55 8.400 8.400 8.552 -0.152 25281 4740 1 9 . 1 1 56 56 GLU N N 56 121.950 121.950 120.244 1.706 25281 4741 1 9 . 1 1 56 56 GLU CA C 56 56.690 56.690 55.943 0.747 25281 4742 1 9 . 1 1 56 56 GLU CB C 56 29.450 29.450 29.734 -0.284 25281 4743 1 9 . 1 1 56 56 GLU H H 56 8.500 8.500 8.521 -0.021 25281 4744 1 9 . 1 1 57 57 SER N N 57 123.330 123.330 120.558 2.772 25281 4745 1 9 . 1 1 57 57 SER CA C 57 55.090 55.090 57.342 -2.252 25281 4746 1 9 . 1 1 57 57 SER CB C 57 64.890 64.890 65.617 -0.727 25281 4747 1 9 . 1 1 57 57 SER H H 57 8.640 8.640 8.689 -0.049 25281 4748 1 9 . 1 1 58 58 VAL N N 58 122.060 122.060 121.493 0.567 25281 4749 1 9 . 1 1 58 58 VAL CA C 58 57.660 57.660 62.168 -4.508 25281 4750 1 9 . 1 1 58 58 VAL CB C 58 31.640 31.640 34.414 -2.774 25281 4751 1 9 . 1 1 58 58 VAL H H 58 8.480 8.480 8.408 0.072 25281 4752 1 9 . 1 1 59 59 ASP N N 59 123.390 123.390 125.441 -2.051 25281 4753 1 9 . 1 1 59 59 ASP CA C 59 54.960 54.960 53.489 1.471 25281 4754 1 9 . 1 1 59 59 ASP CB C 59 42.840 42.840 41.628 1.212 25281 4755 1 9 . 1 1 59 59 ASP H H 59 9.360 9.360 8.759 0.601 25281 4756 1 9 . 1 1 60 60 GLY N N 60 105.230 105.230 105.500 -0.270 25281 4757 1 9 . 1 1 60 60 GLY CA C 60 45.130 45.130 44.139 0.991 25281 4758 1 9 . 1 1 60 60 GLY H H 60 8.210 8.210 7.288 0.922 25281 4759 1 9 . 1 1 61 61 PHE N N 61 121.440 121.440 118.283 3.157 25281 4760 1 9 . 1 1 61 61 PHE CA C 61 57.330 57.330 56.411 0.919 25281 4761 1 9 . 1 1 61 61 PHE CB C 61 39.420 39.420 37.741 1.679 25281 4762 1 9 . 1 1 61 61 PHE H H 61 8.330 8.330 8.279 0.051 25281 4763 1 9 . 1 1 62 62 LYS N N 62 119.870 119.870 124.077 -4.207 25281 4764 1 9 . 1 1 62 62 LYS CA C 62 56.340 56.340 54.715 1.625 25281 4765 1 9 . 1 1 62 62 LYS CB C 62 33.850 33.850 35.438 -1.588 25281 4766 1 9 . 1 1 62 62 LYS H H 62 8.480 8.480 8.160 0.320 25281 4767 1 9 . 1 1 63 63 LEU N N 63 125.160 125.160 123.165 1.995 25281 4768 1 9 . 1 1 63 63 LEU CA C 63 56.220 56.220 57.334 -1.114 25281 4769 1 9 . 1 1 63 63 LEU CB C 63 41.520 41.520 41.883 -0.363 25281 4770 1 9 . 1 1 63 63 LEU H H 63 8.910 8.910 8.535 0.375 25281 4771 1 9 . 1 1 64 64 ILE N N 64 119.660 119.660 119.854 -0.194 25281 4772 1 9 . 1 1 64 64 ILE CA C 64 62.420 62.420 64.368 -1.948 25281 4773 1 9 . 1 1 64 64 ILE CB C 64 37.700 37.700 36.868 0.832 25281 4774 1 9 . 1 1 64 64 ILE H H 64 8.210 8.210 8.025 0.185 25281 4775 1 9 . 1 1 65 65 ASP N N 65 117.080 117.080 117.659 -0.579 25281 4776 1 9 . 1 1 65 65 ASP CA C 65 57.420 57.420 55.366 2.054 25281 4777 1 9 . 1 1 65 65 ASP CB C 65 38.350 38.350 39.205 -0.855 25281 4778 1 9 . 1 1 65 65 ASP H H 65 7.710 7.710 7.931 -0.221 25281 4779 1 9 . 1 1 66 66 GLY N N 66 106.440 106.440 107.071 -0.631 25281 4780 1 9 . 1 1 66 66 GLY CA C 66 45.170 45.170 44.595 0.575 25281 4781 1 9 . 1 1 66 66 GLY H H 66 7.920 7.920 7.546 0.374 25281 4782 1 9 . 1 1 67 67 ASP N N 67 118.490 118.490 120.421 -1.931 25281 4783 1 9 . 1 1 67 67 ASP CA C 67 57.340 57.340 54.552 2.788 25281 4784 1 9 . 1 1 67 67 ASP CB C 67 29.870 29.870 40.803 -10.933 25281 4785 1 9 . 1 1 67 67 ASP H H 67 7.820 7.820 7.752 0.068 25281 4786 1 9 . 1 1 68 68 PHE N N 68 125.320 125.320 116.204 9.116 25281 4787 1 9 . 1 1 68 68 PHE CA C 68 56.090 56.090 57.108 -1.018 25281 4788 1 9 . 1 1 68 68 PHE CB C 68 41.940 41.940 43.193 -1.253 25281 4789 1 9 . 1 1 68 68 PHE H H 68 8.310 8.310 8.119 0.191 25281 4790 1 9 . 1 1 69 69 LYS N N 69 124.770 124.770 120.051 4.719 25281 4791 1 9 . 1 1 69 69 LYS CA C 69 54.880 54.880 55.307 -0.427 25281 4792 1 9 . 1 1 69 69 LYS CB C 69 36.920 36.920 35.527 1.393 25281 4793 1 9 . 1 1 69 69 LYS H H 69 8.730 8.730 8.606 0.124 25281 4794 1 9 . 1 1 70 70 TYR N N 70 123.740 123.740 125.467 -1.727 25281 4795 1 9 . 1 1 70 70 TYR CA C 70 55.540 55.540 56.651 -1.111 25281 4796 1 9 . 1 1 70 70 TYR CB C 70 40.150 40.150 42.603 -2.453 25281 4797 1 9 . 1 1 70 70 TYR H H 70 8.680 8.680 8.367 0.313 25281 4798 1 9 . 1 1 71 71 TYR N N 71 123.920 123.920 121.775 2.145 25281 4799 1 9 . 1 1 71 71 TYR CA C 71 54.500 54.500 55.560 -1.060 25281 4800 1 9 . 1 1 71 71 TYR CB C 71 42.420 42.420 41.301 1.119 25281 4801 1 9 . 1 1 71 71 TYR H H 71 8.620 8.620 7.535 1.085 25281 4802 1 9 . 1 1 72 72 SER N N 72 113.820 113.820 114.380 -0.560 25281 4803 1 9 . 1 1 72 72 SER CA C 72 56.320 56.320 57.292 -0.972 25281 4804 1 9 . 1 1 72 72 SER CB C 72 65.790 65.790 66.977 -1.187 25281 4805 1 9 . 1 1 72 72 SER H H 72 8.800 8.800 8.378 0.422 25281 4806 1 9 . 1 1 73 73 VAL N N 73 119.260 119.260 122.975 -3.715 25281 4807 1 9 . 1 1 73 73 VAL CA C 73 60.730 60.730 59.822 0.908 25281 4808 1 9 . 1 1 73 73 VAL CB C 73 33.870 33.870 34.588 -0.718 25281 4809 1 9 . 1 1 73 73 VAL H H 73 8.170 8.170 8.055 0.115 25281 4810 1 9 . 1 1 74 74 THR N N 74 115.360 115.360 119.496 -4.136 25281 4811 1 9 . 1 1 74 74 THR CA C 74 59.040 59.040 59.582 -0.542 25281 4812 1 9 . 1 1 74 74 THR CB C 74 73.250 73.250 72.077 1.173 25281 4813 1 9 . 1 1 74 74 THR H H 74 9.200 9.200 8.218 0.982 25281 4814 1 9 . 1 1 75 75 ALA N N 75 119.330 119.330 122.437 -3.107 25281 4815 1 9 . 1 1 75 75 ALA CA C 75 51.390 51.390 51.520 -0.130 25281 4816 1 9 . 1 1 75 75 ALA CB C 75 22.380 22.380 22.092 0.288 25281 4817 1 9 . 1 1 75 75 ALA H H 75 9.130 9.130 8.503 0.627 25281 4818 1 9 . 1 1 76 76 GLY N N 76 103.130 103.130 106.627 -3.497 25281 4819 1 9 . 1 1 76 76 GLY CA C 76 45.900 45.900 44.710 1.190 25281 4820 1 9 . 1 1 76 76 GLY H H 76 8.760 8.760 7.916 0.844 25281 4821 1 9 . 1 1 77 77 PRO CA C 77 61.250 61.250 62.590 -1.340 25281 4822 1 9 . 1 1 77 77 PRO CB C 77 32.590 32.590 33.088 -0.498 25281 4823 1 9 . 1 1 78 78 VAL N N 78 115.250 115.250 119.014 -3.764 25281 4824 1 9 . 1 1 78 78 VAL CA C 78 58.430 58.430 61.543 -3.113 25281 4825 1 9 . 1 1 78 78 VAL CB C 78 32.700 32.700 34.958 -2.258 25281 4826 1 9 . 1 1 78 78 VAL H H 78 8.240 8.240 8.335 -0.095 25281 4827 1 9 . 1 1 79 79 PHE N N 79 130.610 130.610 128.253 2.357 25281 4828 1 9 . 1 1 79 79 PHE CA C 79 55.090 55.090 56.168 -1.078 25281 4829 1 9 . 1 1 79 79 PHE CB C 79 41.590 41.590 43.179 -1.589 25281 4830 1 9 . 1 1 79 79 PHE H H 79 9.540 9.540 8.460 1.080 25281 4831 1 9 . 1 1 80 80 ARG N N 80 130.350 130.350 127.835 2.515 25281 4832 1 9 . 1 1 80 80 ARG CA C 80 55.490 55.490 56.696 -1.206 25281 4833 1 9 . 1 1 80 80 ARG CB C 80 29.520 29.520 30.400 -0.880 25281 4834 1 9 . 1 1 80 80 ARG H H 80 8.810 8.810 8.234 0.576 25281 4835 1 9 . 1 1 81 81 ILE N N 81 127.480 127.480 127.352 0.128 25281 4836 1 9 . 1 1 81 81 ILE CA C 81 62.850 62.850 62.281 0.570 25281 4837 1 9 . 1 1 81 81 ILE CB C 81 37.650 37.650 39.154 -1.504 25281 4838 1 9 . 1 1 81 81 ILE H H 81 8.260 8.260 9.004 -0.744 25281 4839 1 9 . 1 1 82 82 ASN N N 82 113.110 113.110 117.435 -4.325 25281 4840 1 9 . 1 1 82 82 ASN CA C 82 55.630 55.630 51.524 4.106 25281 4841 1 9 . 1 1 82 82 ASN CB C 82 43.210 43.210 39.797 3.413 25281 4842 1 9 . 1 1 82 82 ASN H H 82 7.970 7.970 7.579 0.391 25281 4843 1 9 . 1 1 85 85 VAL N N 85 118.090 118.090 120.907 -2.817 25281 4844 1 9 . 1 1 85 85 VAL CA C 85 61.120 61.120 61.297 -0.177 25281 4845 1 9 . 1 1 85 85 VAL CB C 85 34.910 34.910 34.966 -0.056 25281 4846 1 9 . 1 1 85 85 VAL H H 85 7.840 7.840 7.165 0.675 25281 4847 1 9 . 1 1 86 86 SER N N 86 119.050 119.050 122.355 -3.305 25281 4848 1 9 . 1 1 86 86 SER CA C 86 57.100 57.100 56.879 0.221 25281 4849 1 9 . 1 1 86 86 SER CB C 86 65.400 65.400 65.577 -0.177 25281 4850 1 9 . 1 1 86 86 SER H H 86 8.240 8.240 8.125 0.115 25281 4851 1 9 . 1 1 87 87 LEU N N 87 124.640 124.640 128.872 -4.232 25281 4852 1 9 . 1 1 87 87 LEU CA C 87 53.750 53.750 53.882 -0.132 25281 4853 1 9 . 1 1 87 87 LEU CB C 87 46.320 46.320 45.100 1.220 25281 4854 1 9 . 1 1 87 87 LEU H H 87 9.130 9.130 8.148 0.982 25281 4855 1 9 . 1 1 88 88 TYR N N 88 118.740 118.740 123.036 -4.296 25281 4856 1 9 . 1 1 88 88 TYR CA C 88 55.080 55.080 55.471 -0.391 25281 4857 1 9 . 1 1 88 88 TYR CB C 88 42.630 42.630 41.200 1.431 25281 4858 1 9 . 1 1 88 88 TYR H H 88 8.740 8.740 7.868 0.872 25281 4859 1 9 . 1 1 89 89 GLY N N 89 103.920 103.920 106.864 -2.944 25281 4860 1 9 . 1 1 89 89 GLY CA C 89 43.250 43.250 43.318 -0.068 25281 4861 1 9 . 1 1 89 89 GLY H H 89 7.720 7.720 8.289 -0.569 25281 4862 1 9 . 1 1 90 90 LEU N N 90 117.530 117.530 121.193 -3.663 25281 4863 1 9 . 1 1 90 90 LEU CA C 90 53.200 53.200 53.920 -0.720 25281 4864 1 9 . 1 1 90 90 LEU CB C 90 45.810 45.810 44.752 1.058 25281 4865 1 9 . 1 1 90 90 LEU H H 90 8.520 8.520 8.861 -0.341 25281 4866 1 9 . 1 1 91 91 LEU N N 91 120.670 120.670 124.506 -3.836 25281 4867 1 9 . 1 1 91 91 LEU CA C 91 53.590 53.590 53.903 -0.313 25281 4868 1 9 . 1 1 91 91 LEU CB C 91 46.330 46.330 45.927 0.403 25281 4869 1 9 . 1 1 91 91 LEU H H 91 9.250 9.250 7.963 1.287 25281 4870 1 9 . 1 1 92 92 GLY N N 92 108.770 108.770 112.786 -4.016 25281 4871 1 9 . 1 1 92 92 GLY CA C 92 46.520 46.520 46.055 0.465 25281 4872 1 9 . 1 1 92 92 GLY H H 92 8.480 8.480 8.566 -0.086 25281 4873 1 9 . 1 1 93 93 ALA N N 93 126.760 126.760 119.711 7.049 25281 4874 1 9 . 1 1 93 93 ALA CA C 93 49.890 49.890 51.354 -1.464 25281 4875 1 9 . 1 1 93 93 ALA CB C 93 21.860 21.860 22.354 -0.494 25281 4876 1 9 . 1 1 93 93 ALA H H 93 8.860 8.860 7.777 1.083 25281 4877 1 9 . 1 1 94 94 GLY N N 94 107.510 107.510 106.234 1.276 25281 4878 1 9 . 1 1 94 94 GLY CA C 94 42.760 42.760 43.721 -0.961 25281 4879 1 9 . 1 1 94 94 GLY H H 94 8.880 8.880 7.988 0.892 25281 4880 1 9 . 1 1 95 95 HIS N N 95 122.340 122.340 118.774 3.566 25281 4881 1 9 . 1 1 95 95 HIS CA C 95 54.570 54.570 54.444 0.126 25281 4882 1 9 . 1 1 95 95 HIS CB C 95 32.700 32.700 34.377 -1.677 25281 4883 1 9 . 1 1 95 95 HIS H H 95 9.200 9.200 7.644 1.556 25281 4884 1 9 . 1 1 96 96 GLY N N 96 112.170 112.170 107.523 4.647 25281 4885 1 9 . 1 1 96 96 GLY CA C 96 43.150 43.150 44.033 -0.883 25281 4886 1 9 . 1 1 96 96 GLY H H 96 8.620 8.620 8.445 0.175 25281 4887 1 9 . 1 1 97 97 LYS N N 97 120.580 120.580 124.255 -3.675 25281 4888 1 9 . 1 1 97 97 LYS CA C 97 54.890 54.890 55.153 -0.263 25281 4889 1 9 . 1 1 97 97 LYS CB C 97 35.560 35.560 36.134 -0.574 25281 4890 1 9 . 1 1 97 97 LYS H H 97 9.010 9.010 9.014 -0.004 25281 4891 1 9 . 1 1 98 98 ALA N N 98 126.740 126.740 127.954 -1.214 25281 4892 1 9 . 1 1 98 98 ALA CA C 98 50.020 50.020 51.349 -1.329 25281 4893 1 9 . 1 1 98 98 ALA CB C 98 22.380 22.380 22.604 -0.224 25281 4894 1 9 . 1 1 98 98 ALA H H 98 9.120 9.120 8.284 0.836 25281 4895 1 9 . 1 1 99 99 LYS N N 99 122.360 122.360 123.573 -1.213 25281 4896 1 9 . 1 1 99 99 LYS CA C 99 55.090 55.090 55.520 -0.430 25281 4897 1 9 . 1 1 99 99 LYS CB C 99 34.970 34.970 35.730 -0.760 25281 4898 1 9 . 1 1 99 99 LYS H H 99 8.580 8.580 8.441 0.139 25281 4899 1 9 . 1 1 100 100 PHE N N 100 121.170 121.170 123.874 -2.704 25281 4900 1 9 . 1 1 100 100 PHE CA C 100 56.390 56.390 56.107 0.283 25281 4901 1 9 . 1 1 100 100 PHE CB C 100 42.110 42.110 39.312 2.798 25281 4902 1 9 . 1 1 100 100 PHE H H 100 8.750 8.750 8.629 0.121 25281 4903 1 9 . 1 1 101 101 SER N N 101 117.280 117.280 114.992 2.288 25281 4904 1 9 . 1 1 101 101 SER CA C 101 57.070 57.070 56.042 1.028 25281 4905 1 9 . 1 1 101 101 SER CB C 101 65.830 65.830 64.772 1.058 25281 4906 1 9 . 1 1 101 101 SER H H 101 8.990 8.990 7.975 1.015 25281 4907 1 9 . 1 1 102 102 SER N N 102 117.600 117.600 117.054 0.546 25281 4908 1 9 . 1 1 102 102 SER CA C 102 56.500 56.500 58.042 -1.542 25281 4909 1 9 . 1 1 102 102 SER CB C 102 67.540 67.540 63.244 4.296 25281 4910 1 9 . 1 1 102 102 SER H H 102 8.680 8.680 8.085 0.595 25281 4911 1 9 . 1 1 103 103 ILE N N 103 114.980 114.980 119.579 -4.599 25281 4912 1 9 . 1 1 103 103 ILE CA C 103 59.180 59.180 59.594 -0.414 25281 4913 1 9 . 1 1 103 103 ILE CB C 103 40.550 40.550 39.695 0.855 25281 4914 1 9 . 1 1 103 103 ILE H H 103 7.700 7.700 7.717 -0.017 25281 4915 1 9 . 1 1 104 104 PHE N N 104 123.710 123.710 121.552 2.158 25281 4916 1 9 . 1 1 104 104 PHE CA C 104 53.190 53.190 57.865 -4.675 25281 4917 1 9 . 1 1 104 104 PHE CB C 104 43.900 43.900 39.716 4.184 25281 4918 1 9 . 1 1 104 104 PHE H H 104 8.590 8.590 8.602 -0.012 25281 4919 1 9 . 1 1 105 105 GLY N N 105 109.080 109.080 111.824 -2.744 25281 4920 1 9 . 1 1 105 105 GLY CA C 105 45.420 45.420 44.396 1.024 25281 4921 1 9 . 1 1 105 105 GLY H H 105 8.400 8.400 8.369 0.031 25281 4922 1 9 . 1 1 106 106 GLN N N 106 119.680 119.680 119.893 -0.213 25281 4923 1 9 . 1 1 106 106 GLN CA C 106 53.720 53.720 55.311 -1.591 25281 4924 1 9 . 1 1 106 106 GLN CB C 106 30.100 30.100 29.752 0.348 25281 4925 1 9 . 1 1 106 106 GLN H H 106 8.530 8.530 8.223 0.307 25281 4926 1 9 . 1 1 107 107 SER N N 107 119.160 119.160 117.224 1.936 25281 4927 1 9 . 1 1 107 107 SER CA C 107 57.360 57.360 57.224 0.137 25281 4928 1 9 . 1 1 107 107 SER CB C 107 66.050 66.050 63.651 2.399 25281 4929 1 9 . 1 1 107 107 SER H H 107 8.800 8.800 8.269 0.531 25281 4930 1 9 . 1 1 108 108 GLU N N 108 125.360 125.360 122.358 3.002 25281 4931 1 9 . 1 1 108 108 GLU CA C 108 58.910 58.910 55.396 3.514 25281 4932 1 9 . 1 1 108 108 GLU CB C 108 40.880 40.880 33.021 7.859 25281 4933 1 9 . 1 1 108 108 GLU H H 108 8.960 8.960 7.567 1.393 25281 4934 1 9 . 1 1 109 109 SER N N 109 118.890 118.890 117.288 1.602 25281 4935 1 9 . 1 1 109 109 SER CA C 109 56.710 56.710 57.311 -0.601 25281 4936 1 9 . 1 1 109 109 SER CB C 109 66.180 66.180 65.841 0.339 25281 4937 1 9 . 1 1 109 109 SER H H 109 9.080 9.080 8.463 0.617 25281 4938 1 9 . 1 1 110 110 ARG N N 110 119.830 119.830 123.123 -3.293 25281 4939 1 9 . 1 1 110 110 ARG CA C 110 58.390 58.390 55.434 2.956 25281 4940 1 9 . 1 1 110 110 ARG CB C 110 40.940 40.940 33.866 7.074 25281 4941 1 9 . 1 1 110 110 ARG H H 110 8.850 8.850 8.288 0.562 25281 4942 1 9 . 1 1 111 111 SER N N 111 114.870 114.870 116.188 -1.318 25281 4943 1 9 . 1 1 111 111 SER CA C 111 57.290 57.290 57.201 0.089 25281 4944 1 9 . 1 1 111 111 SER CB C 111 66.110 66.110 65.271 0.839 25281 4945 1 9 . 1 1 111 111 SER H H 111 8.740 8.740 8.516 0.224 25281 4946 1 9 . 1 1 112 112 LYS N N 112 120.870 120.870 124.777 -3.907 25281 4947 1 9 . 1 1 112 112 LYS CA C 112 55.150 55.150 55.236 -0.086 25281 4948 1 9 . 1 1 112 112 LYS CB C 112 36.330 36.330 35.357 0.973 25281 4949 1 9 . 1 1 112 112 LYS H H 112 8.520 8.520 8.242 0.278 25281 4950 1 9 . 1 1 113 113 THR N N 113 121.390 121.390 117.572 3.818 25281 4951 1 9 . 1 1 113 113 THR CA C 113 61.250 61.250 61.638 -0.388 25281 4952 1 9 . 1 1 113 113 THR CB C 113 70.010 70.010 70.019 -0.009 25281 4953 1 9 . 1 1 113 113 THR H H 113 8.440 8.440 8.551 -0.111 25281 4954 1 9 . 1 1 114 114 SER N N 114 120.730 120.730 120.061 0.669 25281 4955 1 9 . 1 1 114 114 SER CA C 114 56.190 56.190 56.615 -0.425 25281 4956 1 9 . 1 1 114 114 SER CB C 114 66.380 66.380 65.094 1.286 25281 4957 1 9 . 1 1 114 114 SER H H 114 9.350 9.350 8.105 1.245 25281 4958 1 9 . 1 1 115 115 LEU N N 115 121.540 121.540 125.257 -3.717 25281 4959 1 9 . 1 1 115 115 LEU CA C 115 55.480 55.480 54.052 1.428 25281 4960 1 9 . 1 1 115 115 LEU CB C 115 42.890 42.890 44.670 -1.780 25281 4961 1 9 . 1 1 115 115 LEU H H 115 8.200 8.200 8.888 -0.688 25281 4962 1 9 . 1 1 116 116 ALA N N 116 129.060 129.060 123.458 5.602 25281 4963 1 9 . 1 1 116 116 ALA CA C 116 49.960 49.960 50.432 -0.472 25281 4964 1 9 . 1 1 116 116 ALA CB C 116 20.310 20.310 23.042 -2.732 25281 4965 1 9 . 1 1 116 116 ALA H H 116 8.600 8.600 8.664 -0.064 25281 4966 1 9 . 1 1 117 117 TYR N N 117 115.890 115.890 117.421 -1.531 25281 4967 1 9 . 1 1 117 117 TYR CA C 117 55.150 55.150 56.042 -0.892 25281 4968 1 9 . 1 1 117 117 TYR CB C 117 41.200 41.200 41.253 -0.053 25281 4969 1 9 . 1 1 117 117 TYR H H 117 8.450 8.450 7.819 0.631 25281 4970 1 9 . 1 1 118 118 GLY N N 118 107.330 107.330 106.218 1.112 25281 4971 1 9 . 1 1 118 118 GLY CA C 118 45.940 45.940 45.757 0.183 25281 4972 1 9 . 1 1 118 118 GLY H H 118 9.340 9.340 8.367 0.973 25281 4973 1 9 . 1 1 119 119 ALA N N 119 118.880 118.880 119.794 -0.914 25281 4974 1 9 . 1 1 119 119 ALA CA C 119 51.320 51.320 50.924 0.396 25281 4975 1 9 . 1 1 119 119 ALA CB C 119 22.120 22.120 22.358 -0.238 25281 4976 1 9 . 1 1 119 119 ALA H H 119 8.770 8.770 7.039 1.731 25281 4977 1 9 . 1 1 120 120 GLY N N 120 105.730 105.730 105.532 0.198 25281 4978 1 9 . 1 1 120 120 GLY CA C 120 45.650 45.650 44.529 1.121 25281 4979 1 9 . 1 1 120 120 GLY H H 120 7.940 7.940 7.463 0.477 25281 4980 1 9 . 1 1 121 121 LEU N N 121 115.480 115.480 119.568 -4.088 25281 4981 1 9 . 1 1 121 121 LEU CA C 121 52.980 52.980 53.762 -0.782 25281 4982 1 9 . 1 1 121 121 LEU CB C 121 46.460 46.460 45.609 0.851 25281 4983 1 9 . 1 1 121 121 LEU H H 121 9.010 9.010 8.053 0.957 25281 4984 1 9 . 1 1 122 122 GLN N N 122 112.530 112.530 120.696 -8.166 25281 4985 1 9 . 1 1 122 122 GLN CA C 122 54.780 54.780 54.377 0.403 25281 4986 1 9 . 1 1 122 122 GLN CB C 122 31.400 31.400 32.799 -1.399 25281 4987 1 9 . 1 1 122 122 GLN H H 122 8.090 8.090 8.304 -0.214 25281 4988 1 9 . 1 1 123 123 PHE N N 123 126.050 126.050 124.288 1.762 25281 4989 1 9 . 1 1 123 123 PHE CA C 123 54.180 54.180 56.248 -2.068 25281 4990 1 9 . 1 1 123 123 PHE CB C 123 42.560 42.560 41.670 0.890 25281 4991 1 9 . 1 1 123 123 PHE H H 123 10.020 10.020 8.986 1.034 25281 4992 1 9 . 1 1 124 124 ASN N N 124 121.910 121.910 122.331 -0.421 25281 4993 1 9 . 1 1 124 124 ASN CA C 124 50.940 50.940 50.447 0.493 25281 4994 1 9 . 1 1 124 124 ASN CB C 124 40.360 40.360 38.837 1.523 25281 4995 1 9 . 1 1 124 124 ASN H H 124 9.520 9.520 8.196 1.324 25281 4996 1 9 . 1 1 125 125 PRO CA C 125 63.390 63.390 61.992 1.398 25281 4997 1 9 . 1 1 125 125 PRO CB C 125 31.210 31.210 31.864 -0.654 25281 4998 1 9 . 1 1 126 126 HIS N N 126 116.830 116.830 116.689 0.141 25281 4999 1 9 . 1 1 126 126 HIS CA C 126 54.110 54.110 56.618 -2.508 25281 5000 1 9 . 1 1 126 126 HIS CB C 126 34.910 34.910 28.961 5.949 25281 5001 1 9 . 1 1 126 126 HIS H H 126 7.630 7.630 8.152 -0.522 25281 5002 1 9 . 1 1 127 127 PRO CA C 127 65.370 65.370 64.116 1.254 25281 5003 1 9 . 1 1 127 127 PRO CB C 127 31.030 31.030 30.032 0.998 25281 5004 1 9 . 1 1 128 128 ASN N N 128 114.680 114.680 118.313 -3.633 25281 5005 1 9 . 1 1 128 128 ASN CA C 128 53.990 53.990 54.205 -0.215 25281 5006 1 9 . 1 1 128 128 ASN CB C 128 40.550 40.550 41.038 -0.488 25281 5007 1 9 . 1 1 128 128 ASN H H 128 10.460 10.460 9.000 1.460 25281 5008 1 9 . 1 1 129 129 PHE N N 129 119.630 119.630 115.272 4.358 25281 5009 1 9 . 1 1 129 129 PHE CA C 129 56.530 56.530 56.910 -0.380 25281 5010 1 9 . 1 1 129 129 PHE CB C 129 44.310 44.310 41.185 3.125 25281 5011 1 9 . 1 1 129 129 PHE H H 129 8.340 8.340 7.233 1.107 25281 5012 1 9 . 1 1 130 130 VAL N N 130 123.000 123.000 119.577 3.423 25281 5013 1 9 . 1 1 130 130 VAL CA C 130 60.340 60.340 61.347 -1.007 25281 5014 1 9 . 1 1 130 130 VAL CB C 130 34.970 34.970 35.457 -0.487 25281 5015 1 9 . 1 1 130 130 VAL H H 130 7.820 7.820 8.622 -0.802 25281 5016 1 9 . 1 1 131 131 ILE N N 131 124.470 124.470 127.904 -3.434 25281 5017 1 9 . 1 1 131 131 ILE CA C 131 60.210 60.210 59.254 0.956 25281 5018 1 9 . 1 1 131 131 ILE CB C 131 39.510 39.510 41.426 -1.916 25281 5019 1 9 . 1 1 131 131 ILE H H 131 8.830 8.830 8.279 0.551 25281 5020 1 9 . 1 1 132 132 ASP N N 132 130.700 130.700 127.950 2.750 25281 5021 1 9 . 1 1 132 132 ASP CA C 132 53.530 53.530 52.158 1.372 25281 5022 1 9 . 1 1 132 132 ASP CB C 132 47.620 47.620 44.688 2.933 25281 5023 1 9 . 1 1 132 132 ASP H H 132 9.040 9.040 8.666 0.374 25281 5024 1 9 . 1 1 133 133 ALA N N 133 126.900 126.900 120.490 6.410 25281 5025 1 9 . 1 1 133 133 ALA CA C 133 51.390 51.390 51.407 -0.017 25281 5026 1 9 . 1 1 133 133 ALA CB C 133 21.730 21.730 22.501 -0.771 25281 5027 1 9 . 1 1 133 133 ALA H H 133 8.800 8.800 8.245 0.555 25281 5028 1 9 . 1 1 134 134 SER N N 134 113.760 113.760 116.495 -2.735 25281 5029 1 9 . 1 1 134 134 SER CA C 134 58.140 58.140 57.639 0.501 25281 5030 1 9 . 1 1 134 134 SER CB C 134 67.020 67.020 66.477 0.543 25281 5031 1 9 . 1 1 134 134 SER H H 134 9.160 9.160 8.623 0.537 25281 5032 1 9 . 1 1 135 135 TYR N N 135 118.500 118.500 115.726 2.774 25281 5033 1 9 . 1 1 135 135 TYR CA C 135 55.690 55.690 55.927 -0.237 25281 5034 1 9 . 1 1 135 135 TYR CB C 135 43.150 43.150 41.188 1.962 25281 5035 1 9 . 1 1 135 135 TYR H H 135 8.820 8.820 7.605 1.215 25281 5036 1 9 . 1 1 136 136 GLU N N 136 126.290 126.290 117.154 9.136 25281 5037 1 9 . 1 1 136 136 GLU CA C 136 53.530 53.530 54.605 -1.075 25281 5038 1 9 . 1 1 136 136 GLU CB C 136 34.450 34.450 33.668 0.782 25281 5039 1 9 . 1 1 136 136 GLU H H 136 8.380 8.380 8.180 0.200 25281 5040 1 9 . 1 1 137 137 TYR N N 137 123.630 123.630 118.531 5.099 25281 5041 1 9 . 1 1 137 137 TYR CA C 137 55.670 55.670 56.271 -0.601 25281 5042 1 9 . 1 1 137 137 TYR CB C 137 43.150 43.150 42.548 0.602 25281 5043 1 9 . 1 1 137 137 TYR H H 137 9.300 9.300 8.184 1.116 25281 5044 1 9 . 1 1 138 138 SER N N 138 118.300 118.300 116.638 1.662 25281 5045 1 9 . 1 1 138 138 SER CA C 138 58.270 58.270 56.498 1.772 25281 5046 1 9 . 1 1 138 138 SER CB C 138 67.090 67.090 65.606 1.484 25281 5047 1 9 . 1 1 138 138 SER H H 138 7.980 7.980 9.034 -1.054 25281 5048 1 9 . 1 1 139 139 LYS N N 139 127.450 127.450 128.383 -0.933 25281 5049 1 9 . 1 1 139 139 LYS CA C 139 55.160 55.160 55.898 -0.738 25281 5050 1 9 . 1 1 139 139 LYS CB C 139 32.640 32.640 33.201 -0.561 25281 5051 1 9 . 1 1 139 139 LYS H H 139 8.630 8.630 7.947 0.683 25281 5052 1 9 . 1 1 140 140 LEU N N 140 129.650 129.650 127.946 1.704 25281 5053 1 9 . 1 1 140 140 LEU CA C 140 52.500 52.500 53.664 -1.164 25281 5054 1 9 . 1 1 140 140 LEU CB C 140 40.000 40.000 44.590 -4.590 25281 5055 1 9 . 1 1 140 140 LEU H H 140 9.060 9.060 8.103 0.957 25281 5056 1 9 . 1 1 141 141 ASP N N 141 121.470 121.470 122.938 -1.468 25281 5057 1 9 . 1 1 141 141 ASP CA C 141 57.190 57.190 56.519 0.671 25281 5058 1 9 . 1 1 141 141 ASP CB C 141 39.730 39.730 40.830 -1.099 25281 5059 1 9 . 1 1 141 141 ASP H H 141 8.590 8.590 8.736 -0.146 25281 5060 1 9 . 1 1 142 142 ASP N N 142 121.510 121.510 118.409 3.101 25281 5061 1 9 . 1 1 142 142 ASP CA C 142 55.180 55.180 55.372 -0.192 25281 5062 1 9 . 1 1 142 142 ASP CB C 142 41.090 41.090 41.229 -0.139 25281 5063 1 9 . 1 1 142 142 ASP H H 142 8.430 8.430 8.527 -0.097 25281 5064 1 9 . 1 1 143 143 VAL N N 143 121.420 121.420 112.793 8.627 25281 5065 1 9 . 1 1 143 143 VAL CA C 143 62.240 62.240 59.645 2.595 25281 5066 1 9 . 1 1 143 143 VAL CB C 143 31.280 31.280 34.901 -3.621 25281 5067 1 9 . 1 1 143 143 VAL H H 143 8.020 8.020 7.500 0.520 25281 5068 1 9 . 1 1 144 144 LYS N N 144 127.950 127.950 122.440 5.510 25281 5069 1 9 . 1 1 144 144 LYS CA C 144 55.440 55.440 55.765 -0.325 25281 5070 1 9 . 1 1 144 144 LYS CB C 144 32.640 32.640 32.979 -0.339 25281 5071 1 9 . 1 1 144 144 LYS H H 144 8.660 8.660 8.394 0.266 25281 5072 1 9 . 1 1 145 145 VAL N N 145 124.120 124.120 126.373 -2.253 25281 5073 1 9 . 1 1 145 145 VAL CA C 145 55.910 55.910 60.337 -4.427 25281 5074 1 9 . 1 1 145 145 VAL CB C 145 32.570 32.570 33.766 -1.196 25281 5075 1 9 . 1 1 145 145 VAL H H 145 8.720 8.720 7.881 0.839 25281 5076 1 9 . 1 1 146 146 GLY N N 146 116.240 116.240 115.547 0.693 25281 5077 1 9 . 1 1 146 146 GLY CA C 146 44.080 44.080 44.498 -0.418 25281 5078 1 9 . 1 1 146 146 GLY H H 146 8.400 8.400 8.494 -0.094 25281 5079 1 9 . 1 1 147 147 THR N N 147 124.620 124.620 121.960 2.660 25281 5080 1 9 . 1 1 147 147 THR CA C 147 61.450 61.450 61.996 -0.546 25281 5081 1 9 . 1 1 147 147 THR CB C 147 70.260 70.260 71.090 -0.830 25281 5082 1 9 . 1 1 147 147 THR H H 147 9.080 9.080 8.568 0.512 25281 5083 1 9 . 1 1 148 148 TRP N N 148 124.790 124.790 127.761 -2.971 25281 5084 1 9 . 1 1 148 148 TRP CA C 148 54.770 54.770 56.088 -1.318 25281 5085 1 9 . 1 1 148 148 TRP CB C 148 33.090 33.090 32.475 0.615 25281 5086 1 9 . 1 1 148 148 TRP H H 148 8.510 8.510 9.477 -0.967 25281 5087 1 9 . 1 1 149 149 MET N N 149 118.880 118.880 120.613 -1.733 25281 5088 1 9 . 1 1 149 149 MET CA C 149 54.540 54.540 54.989 -0.448 25281 5089 1 9 . 1 1 149 149 MET CB C 149 34.640 34.640 36.285 -1.645 25281 5090 1 9 . 1 1 149 149 MET H H 149 9.150 9.150 8.890 0.260 25281 5091 1 9 . 1 1 150 150 LEU N N 150 122.830 122.830 122.640 0.190 25281 5092 1 9 . 1 1 150 150 LEU CA C 150 54.100 54.100 53.531 0.569 25281 5093 1 9 . 1 1 150 150 LEU CB C 150 45.800 45.800 45.409 0.391 25281 5094 1 9 . 1 1 150 150 LEU H H 150 8.480 8.480 8.102 0.378 25281 5095 1 9 . 1 1 151 151 GLY N N 151 112.730 112.730 108.775 3.955 25281 5096 1 9 . 1 1 151 151 GLY CA C 151 45.940 45.940 46.048 -0.108 25281 5097 1 9 . 1 1 151 151 GLY H H 151 9.820 9.820 8.154 1.666 25281 5098 1 9 . 1 1 152 152 ALA N N 152 119.460 119.460 119.782 -0.322 25281 5099 1 9 . 1 1 152 152 ALA CA C 152 49.760 49.760 51.024 -1.264 25281 5100 1 9 . 1 1 152 152 ALA CB C 152 22.700 22.700 22.796 -0.096 25281 5101 1 9 . 1 1 152 152 ALA H H 152 8.840 8.840 8.230 0.610 25281 5102 1 9 . 1 1 153 153 GLY N N 153 104.360 104.360 105.991 -1.631 25281 5103 1 9 . 1 1 153 153 GLY CA C 153 46.440 46.440 44.130 2.310 25281 5104 1 9 . 1 1 153 153 GLY H H 153 8.540 8.540 8.392 0.148 25281 5105 1 9 . 1 1 154 154 TYR N N 154 120.680 120.680 117.242 3.438 25281 5106 1 9 . 1 1 154 154 TYR CA C 154 55.370 55.370 56.566 -1.196 25281 5107 1 9 . 1 1 154 154 TYR CB C 154 44.250 44.250 42.519 1.732 25281 5108 1 9 . 1 1 154 154 TYR H H 154 8.310 8.310 8.020 0.290 25281 5109 1 9 . 1 1 155 155 ARG N N 155 127.050 127.050 121.654 5.396 25281 5110 1 9 . 1 1 155 155 ARG CA C 155 53.480 53.480 55.862 -2.382 25281 5111 1 9 . 1 1 155 155 ARG CB C 155 32.160 32.160 30.367 1.793 25281 5112 1 9 . 1 1 155 155 ARG H H 155 7.640 7.640 8.579 -0.939 25281 5113 1 10 . 1 1 2 2 GLY N N 2 112.280 112.280 110.456 1.824 25281 5114 1 10 . 1 1 2 2 GLY CA C 2 44.830 44.830 44.373 0.457 25281 5115 1 10 . 1 1 2 2 GLY H H 2 8.460 8.460 8.408 0.052 25281 5116 1 10 . 1 1 3 3 GLU N N 3 118.460 118.460 119.821 -1.361 25281 5117 1 10 . 1 1 3 3 GLU CA C 3 56.840 56.840 57.056 -0.215 25281 5118 1 10 . 1 1 3 3 GLU CB C 3 29.980 29.980 30.450 -0.470 25281 5119 1 10 . 1 1 3 3 GLU H H 3 7.630 7.630 8.428 -0.798 25281 5120 1 10 . 1 1 4 4 SER N N 4 119.000 119.000 117.130 1.870 25281 5121 1 10 . 1 1 4 4 SER CA C 4 57.280 57.280 57.516 -0.236 25281 5122 1 10 . 1 1 4 4 SER CB C 4 65.860 65.860 66.487 -0.627 25281 5123 1 10 . 1 1 4 4 SER H H 4 8.820 8.820 8.627 0.193 25281 5124 1 10 . 1 1 5 5 SER N N 5 118.300 118.300 116.181 2.119 25281 5125 1 10 . 1 1 5 5 SER CA C 5 57.560 57.560 56.952 0.608 25281 5126 1 10 . 1 1 5 5 SER CB C 5 65.480 65.480 65.098 0.382 25281 5127 1 10 . 1 1 5 5 SER H H 5 8.700 8.700 8.080 0.620 25281 5128 1 10 . 1 1 6 6 ILE N N 6 123.240 123.240 123.966 -0.726 25281 5129 1 10 . 1 1 6 6 ILE CA C 6 54.110 54.110 60.152 -6.042 25281 5130 1 10 . 1 1 6 6 ILE CB C 6 33.870 33.870 41.037 -7.167 25281 5131 1 10 . 1 1 6 6 ILE H H 6 9.080 9.080 7.570 1.510 25281 5132 1 10 . 1 1 7 7 SER N N 7 116.100 116.100 120.482 -4.382 25281 5133 1 10 . 1 1 7 7 SER CA C 7 57.130 57.130 56.236 0.894 25281 5134 1 10 . 1 1 7 7 SER CB C 7 65.710 65.710 65.352 0.358 25281 5135 1 10 . 1 1 7 7 SER H H 7 8.570 8.570 7.930 0.640 25281 5136 1 10 . 1 1 8 8 ILE N N 8 114.140 114.140 124.435 -10.295 25281 5137 1 10 . 1 1 8 8 ILE CA C 8 58.460 58.460 59.868 -1.409 25281 5138 1 10 . 1 1 8 8 ILE CB C 8 40.880 40.880 42.119 -1.239 25281 5139 1 10 . 1 1 8 8 ILE H H 8 8.300 8.300 8.746 -0.446 25281 5140 1 10 . 1 1 9 9 GLY N N 9 109.200 109.200 110.342 -1.142 25281 5141 1 10 . 1 1 9 9 GLY CA C 9 45.550 45.550 45.556 -0.006 25281 5142 1 10 . 1 1 9 9 GLY H H 9 9.060 9.060 8.225 0.835 25281 5143 1 10 . 1 1 10 10 TYR N N 10 121.410 121.410 118.846 2.564 25281 5144 1 10 . 1 1 10 10 TYR CA C 10 56.970 56.970 56.900 0.070 25281 5145 1 10 . 1 1 10 10 TYR CB C 10 41.520 41.520 42.252 -0.732 25281 5146 1 10 . 1 1 10 10 TYR H H 10 8.870 8.870 8.132 0.738 25281 5147 1 10 . 1 1 11 11 ALA N N 11 125.250 125.250 123.037 2.213 25281 5148 1 10 . 1 1 11 11 ALA CA C 11 48.740 48.740 50.117 -1.377 25281 5149 1 10 . 1 1 11 11 ALA CB C 11 21.610 21.610 22.218 -0.608 25281 5150 1 10 . 1 1 11 11 ALA H H 11 7.210 7.210 8.154 -0.944 25281 5151 1 10 . 1 1 12 12 GLN N N 12 119.180 119.180 122.143 -2.963 25281 5152 1 10 . 1 1 12 12 GLN CA C 12 54.690 54.690 54.959 -0.269 25281 5153 1 10 . 1 1 12 12 GLN CB C 12 32.000 32.000 33.831 -1.831 25281 5154 1 10 . 1 1 12 12 GLN H H 12 8.330 8.330 8.235 0.095 25281 5155 1 10 . 1 1 13 13 SER N N 13 122.790 122.790 118.308 4.482 25281 5156 1 10 . 1 1 13 13 SER CA C 13 57.780 57.780 57.137 0.643 25281 5157 1 10 . 1 1 13 13 SER CB C 13 64.540 64.540 64.381 0.159 25281 5158 1 10 . 1 1 13 13 SER H H 13 8.610 8.610 8.690 -0.080 25281 5159 1 10 . 1 1 14 14 ARG N N 14 121.140 121.140 125.109 -3.969 25281 5160 1 10 . 1 1 14 14 ARG CA C 14 54.960 54.960 54.772 0.188 25281 5161 1 10 . 1 1 14 14 ARG CB C 14 32.370 32.370 32.156 0.214 25281 5162 1 10 . 1 1 14 14 ARG H H 14 8.520 8.520 8.584 -0.064 25281 5163 1 10 . 1 1 15 15 VAL N N 15 115.890 115.890 120.782 -4.892 25281 5164 1 10 . 1 1 15 15 VAL CA C 15 60.970 60.970 61.325 -0.355 25281 5165 1 10 . 1 1 15 15 VAL CB C 15 34.320 34.320 35.955 -1.635 25281 5166 1 10 . 1 1 15 15 VAL H H 15 8.440 8.440 7.891 0.549 25281 5167 1 10 . 1 1 16 16 LYS N N 16 126.010 126.010 126.481 -0.471 25281 5168 1 10 . 1 1 16 16 LYS CA C 16 55.120 55.120 56.176 -1.056 25281 5169 1 10 . 1 1 16 16 LYS CB C 16 34.350 34.350 32.659 1.691 25281 5170 1 10 . 1 1 16 16 LYS H H 16 8.850 8.850 8.684 0.166 25281 5171 1 10 . 1 1 17 17 GLU N N 17 119.140 119.140 124.460 -5.320 25281 5172 1 10 . 1 1 17 17 GLU CA C 17 54.460 54.460 54.905 -0.445 25281 5173 1 10 . 1 1 17 17 GLU CB C 17 33.430 33.430 31.290 2.140 25281 5174 1 10 . 1 1 17 17 GLU H H 17 8.030 8.030 8.601 -0.571 25281 5175 1 10 . 1 1 18 18 ASP N N 18 120.280 120.280 120.994 -0.714 25281 5176 1 10 . 1 1 18 18 ASP CA C 18 56.500 56.500 53.634 2.866 25281 5177 1 10 . 1 1 18 18 ASP CB C 18 33.780 33.780 39.904 -6.125 25281 5178 1 10 . 1 1 18 18 ASP H H 18 8.120 8.120 8.414 -0.294 25281 5179 1 10 . 1 1 19 19 GLY N N 19 118.750 118.750 111.025 7.725 25281 5180 1 10 . 1 1 19 19 GLY CA C 19 44.130 44.130 44.851 -0.721 25281 5181 1 10 . 1 1 19 19 GLY H H 19 8.430 8.430 7.860 0.570 25281 5182 1 10 . 1 1 20 20 TYR N N 20 117.080 117.080 122.730 -5.650 25281 5183 1 10 . 1 1 20 20 TYR CA C 20 60.940 60.940 57.931 3.009 25281 5184 1 10 . 1 1 20 20 TYR CB C 20 42.010 42.010 37.627 4.383 25281 5185 1 10 . 1 1 20 20 TYR H H 20 8.610 8.610 8.509 0.101 25281 5186 1 10 . 1 1 21 21 LYS N N 21 127.240 127.240 123.758 3.482 25281 5187 1 10 . 1 1 21 21 LYS CA C 21 56.760 56.760 57.410 -0.650 25281 5188 1 10 . 1 1 21 21 LYS CB C 21 29.100 29.100 32.583 -3.483 25281 5189 1 10 . 1 1 21 21 LYS H H 21 7.970 7.970 8.465 -0.495 25281 5190 1 10 . 1 1 22 22 LEU N N 22 122.270 122.270 122.486 -0.216 25281 5191 1 10 . 1 1 22 22 LEU CA C 22 59.170 59.170 57.248 1.921 25281 5192 1 10 . 1 1 22 22 LEU CB C 22 40.030 40.030 41.512 -1.482 25281 5193 1 10 . 1 1 22 22 LEU H H 22 8.370 8.370 7.937 0.433 25281 5194 1 10 . 1 1 23 23 ASP N N 23 114.790 114.790 115.304 -0.514 25281 5195 1 10 . 1 1 23 23 ASP CA C 23 51.840 51.840 53.916 -2.076 25281 5196 1 10 . 1 1 23 23 ASP CB C 23 37.730 37.730 41.276 -3.546 25281 5197 1 10 . 1 1 23 23 ASP H H 23 8.210 8.210 8.231 -0.021 25281 5198 1 10 . 1 1 24 24 LYS N N 24 115.470 115.470 115.054 0.416 25281 5199 1 10 . 1 1 24 24 LYS CA C 24 58.860 58.860 57.555 1.305 25281 5200 1 10 . 1 1 24 24 LYS CB C 24 28.330 28.330 30.773 -2.443 25281 5201 1 10 . 1 1 24 24 LYS H H 24 9.230 9.230 7.821 1.409 25281 5202 1 10 . 1 1 25 25 ASN N N 25 121.610 121.610 117.450 4.160 25281 5203 1 10 . 1 1 25 25 ASN CA C 25 54.430 54.430 50.257 4.173 25281 5204 1 10 . 1 1 25 25 ASN CB C 25 42.500 42.500 38.550 3.950 25281 5205 1 10 . 1 1 25 25 ASN H H 25 8.150 8.150 7.985 0.165 25281 5206 1 10 . 1 1 26 26 PRO CA C 26 63.340 63.340 62.800 0.540 25281 5207 1 10 . 1 1 26 26 PRO CB C 26 30.940 30.940 33.641 -2.701 25281 5208 1 10 . 1 1 27 27 ARG N N 27 120.730 120.730 119.199 1.531 25281 5209 1 10 . 1 1 27 27 ARG CA C 27 54.340 54.340 54.565 -0.225 25281 5210 1 10 . 1 1 27 27 ARG CB C 27 33.500 33.500 31.738 1.762 25281 5211 1 10 . 1 1 27 27 ARG H H 27 8.290 8.290 8.400 -0.110 25281 5212 1 10 . 1 1 28 28 GLY N N 28 112.000 112.000 108.349 3.651 25281 5213 1 10 . 1 1 28 28 GLY CA C 28 46.940 46.940 44.818 2.122 25281 5214 1 10 . 1 1 28 28 GLY H H 28 8.810 8.810 8.178 0.632 25281 5215 1 10 . 1 1 29 29 PHE N N 29 121.230 121.230 118.239 2.991 25281 5216 1 10 . 1 1 29 29 PHE CA C 29 55.230 55.230 56.973 -1.743 25281 5217 1 10 . 1 1 29 29 PHE CB C 29 43.700 43.700 43.152 0.548 25281 5218 1 10 . 1 1 29 29 PHE H H 29 8.470 8.470 8.033 0.437 25281 5219 1 10 . 1 1 30 30 ASN N N 30 117.250 117.250 121.840 -4.590 25281 5220 1 10 . 1 1 30 30 ASN CA C 30 50.220 50.220 52.330 -2.110 25281 5221 1 10 . 1 1 30 30 ASN CB C 30 45.810 45.810 41.357 4.453 25281 5222 1 10 . 1 1 30 30 ASN H H 30 8.630 8.630 8.862 -0.232 25281 5223 1 10 . 1 1 31 31 LEU N N 31 128.180 128.180 126.867 1.313 25281 5224 1 10 . 1 1 31 31 LEU CA C 31 53.930 53.930 54.036 -0.106 25281 5225 1 10 . 1 1 31 31 LEU CB C 31 45.810 45.810 45.758 0.052 25281 5226 1 10 . 1 1 31 31 LEU H H 31 9.080 9.080 8.660 0.420 25281 5227 1 10 . 1 1 32 32 LYS N N 32 119.980 119.980 121.409 -1.429 25281 5228 1 10 . 1 1 32 32 LYS CA C 32 55.730 55.730 54.566 1.164 25281 5229 1 10 . 1 1 32 32 LYS CB C 32 36.070 36.070 36.410 -0.341 25281 5230 1 10 . 1 1 32 32 LYS H H 32 8.780 8.780 7.924 0.856 25281 5231 1 10 . 1 1 33 33 TYR N N 33 121.500 121.500 120.819 0.681 25281 5232 1 10 . 1 1 33 33 TYR CA C 33 55.830 55.830 57.201 -1.371 25281 5233 1 10 . 1 1 33 33 TYR CB C 33 42.110 42.110 41.562 0.548 25281 5234 1 10 . 1 1 33 33 TYR H H 33 8.640 8.640 8.438 0.202 25281 5235 1 10 . 1 1 34 34 ARG N N 34 128.980 128.980 121.289 7.691 25281 5236 1 10 . 1 1 34 34 ARG CA C 34 52.690 52.690 54.997 -2.307 25281 5237 1 10 . 1 1 34 34 ARG CB C 34 34.320 34.320 33.735 0.585 25281 5238 1 10 . 1 1 34 34 ARG H H 34 8.830 8.830 8.471 0.359 25281 5239 1 10 . 1 1 35 35 TYR N N 35 124.820 124.820 127.361 -2.541 25281 5240 1 10 . 1 1 35 35 TYR CA C 35 56.640 56.640 57.058 -0.418 25281 5241 1 10 . 1 1 35 35 TYR CB C 35 41.980 41.980 41.751 0.229 25281 5242 1 10 . 1 1 35 35 TYR H H 35 8.840 8.840 8.268 0.572 25281 5243 1 10 . 1 1 39 39 ASN N N 39 127.690 127.690 118.549 9.141 25281 5244 1 10 . 1 1 39 39 ASN CA C 39 54.850 54.850 54.411 0.439 25281 5245 1 10 . 1 1 39 39 ASN CB C 39 38.290 38.290 38.184 0.106 25281 5246 1 10 . 1 1 39 39 ASN H H 39 7.990 7.990 8.757 -0.767 25281 5247 1 10 . 1 1 40 40 ASP N N 40 115.200 115.200 117.469 -2.269 25281 5248 1 10 . 1 1 40 40 ASP CA C 40 55.210 55.210 52.644 2.566 25281 5249 1 10 . 1 1 40 40 ASP CB C 40 44.010 44.010 42.357 1.653 25281 5250 1 10 . 1 1 40 40 ASP H H 40 8.370 8.370 7.701 0.669 25281 5251 1 10 . 1 1 41 41 TRP N N 41 124.210 124.210 120.960 3.250 25281 5252 1 10 . 1 1 41 41 TRP CA C 41 55.840 55.840 56.407 -0.567 25281 5253 1 10 . 1 1 41 41 TRP CB C 41 33.540 33.540 30.320 3.220 25281 5254 1 10 . 1 1 41 41 TRP H H 41 9.130 9.130 7.877 1.253 25281 5255 1 10 . 1 1 42 42 GLY N N 42 107.800 107.800 108.363 -0.563 25281 5256 1 10 . 1 1 42 42 GLY CA C 42 45.870 45.870 44.310 1.560 25281 5257 1 10 . 1 1 42 42 GLY H H 42 8.610 8.610 8.200 0.410 25281 5258 1 10 . 1 1 43 43 VAL N N 43 116.260 116.260 118.777 -2.517 25281 5259 1 10 . 1 1 43 43 VAL CA C 43 58.980 58.980 61.546 -2.566 25281 5260 1 10 . 1 1 43 43 VAL CB C 43 35.430 35.430 35.120 0.310 25281 5261 1 10 . 1 1 43 43 VAL H H 43 8.880 8.880 7.957 0.923 25281 5262 1 10 . 1 1 44 44 ILE N N 44 124.720 124.720 125.858 -1.138 25281 5263 1 10 . 1 1 44 44 ILE CA C 44 58.390 58.390 58.668 -0.278 25281 5264 1 10 . 1 1 44 44 ILE CB C 44 42.890 42.890 42.071 0.819 25281 5265 1 10 . 1 1 44 44 ILE H H 44 9.110 9.110 8.039 1.071 25281 5266 1 10 . 1 1 45 45 GLY N N 45 110.610 110.610 114.055 -3.445 25281 5267 1 10 . 1 1 45 45 GLY CA C 45 43.150 43.150 43.836 -0.686 25281 5268 1 10 . 1 1 45 45 GLY H H 45 8.910 8.910 8.226 0.684 25281 5269 1 10 . 1 1 46 46 SER N N 46 116.210 116.210 118.630 -2.420 25281 5270 1 10 . 1 1 46 46 SER CA C 46 56.250 56.250 57.391 -1.141 25281 5271 1 10 . 1 1 46 46 SER CB C 46 63.720 63.720 66.055 -2.335 25281 5272 1 10 . 1 1 46 46 SER H H 46 9.250 9.250 8.165 1.085 25281 5273 1 10 . 1 1 47 47 PHE N N 47 126.400 126.400 123.966 2.434 25281 5274 1 10 . 1 1 47 47 PHE CA C 47 55.090 55.090 56.511 -1.421 25281 5275 1 10 . 1 1 47 47 PHE CB C 47 42.560 42.560 42.917 -0.357 25281 5276 1 10 . 1 1 47 47 PHE H H 47 8.940 8.940 9.041 -0.101 25281 5277 1 10 . 1 1 48 48 ALA N N 48 131.930 131.930 123.944 7.986 25281 5278 1 10 . 1 1 48 48 ALA CA C 48 50.350 50.350 50.475 -0.125 25281 5279 1 10 . 1 1 48 48 ALA CB C 48 21.280 21.280 22.953 -1.673 25281 5280 1 10 . 1 1 48 48 ALA H H 48 8.790 8.790 8.555 0.235 25281 5281 1 10 . 1 1 49 49 GLN N N 49 116.070 116.070 121.727 -5.657 25281 5282 1 10 . 1 1 49 49 GLN CA C 49 54.110 54.110 55.106 -0.996 25281 5283 1 10 . 1 1 49 49 GLN CB C 49 31.140 31.140 33.312 -2.172 25281 5284 1 10 . 1 1 49 49 GLN H H 49 7.720 7.720 8.427 -0.707 25281 5285 1 10 . 1 1 50 50 THR N N 50 115.990 115.990 120.001 -4.011 25281 5286 1 10 . 1 1 50 50 THR CA C 50 59.270 59.270 61.558 -2.288 25281 5287 1 10 . 1 1 50 50 THR CB C 50 70.980 70.980 71.454 -0.474 25281 5288 1 10 . 1 1 50 50 THR H H 50 9.470 9.470 9.052 0.418 25281 5289 1 10 . 1 1 51 51 ARG N N 51 117.600 117.600 125.013 -7.413 25281 5290 1 10 . 1 1 51 51 ARG CA C 51 55.350 55.350 55.126 0.224 25281 5291 1 10 . 1 1 51 51 ARG CB C 51 33.610 33.610 32.761 0.849 25281 5292 1 10 . 1 1 51 51 ARG H H 51 8.600 8.600 8.222 0.378 25281 5293 1 10 . 1 1 52 52 ARG N N 52 121.400 121.400 124.700 -3.300 25281 5294 1 10 . 1 1 52 52 ARG CA C 52 56.910 56.910 54.820 2.090 25281 5295 1 10 . 1 1 52 52 ARG CB C 52 29.370 29.370 30.957 -1.587 25281 5296 1 10 . 1 1 52 52 ARG H H 52 8.380 8.380 8.047 0.333 25281 5297 1 10 . 1 1 53 53 GLY N N 53 111.040 111.040 111.273 -0.233 25281 5298 1 10 . 1 1 53 53 GLY CA C 53 45.190 45.190 45.497 -0.307 25281 5299 1 10 . 1 1 53 53 GLY H H 53 8.330 8.330 9.059 -0.729 25281 5300 1 10 . 1 1 54 54 PHE N N 54 119.210 119.210 123.126 -3.916 25281 5301 1 10 . 1 1 54 54 PHE CA C 54 55.670 55.670 58.735 -3.065 25281 5302 1 10 . 1 1 54 54 PHE CB C 54 29.220 29.220 37.510 -8.290 25281 5303 1 10 . 1 1 54 54 PHE H H 54 7.720 7.720 8.046 -0.326 25281 5304 1 10 . 1 1 55 55 GLU N N 55 123.470 123.470 125.833 -2.363 25281 5305 1 10 . 1 1 55 55 GLU CA C 55 55.580 55.580 55.706 -0.126 25281 5306 1 10 . 1 1 55 55 GLU CB C 55 32.920 32.920 32.151 0.769 25281 5307 1 10 . 1 1 55 55 GLU H H 55 8.400 8.400 8.139 0.261 25281 5308 1 10 . 1 1 56 56 GLU N N 56 121.950 121.950 125.145 -3.195 25281 5309 1 10 . 1 1 56 56 GLU CA C 56 56.690 56.690 56.782 -0.092 25281 5310 1 10 . 1 1 56 56 GLU CB C 56 29.450 29.450 29.603 -0.153 25281 5311 1 10 . 1 1 56 56 GLU H H 56 8.500 8.500 8.613 -0.113 25281 5312 1 10 . 1 1 57 57 SER N N 57 123.330 123.330 121.076 2.254 25281 5313 1 10 . 1 1 57 57 SER CA C 57 55.090 55.090 57.241 -2.151 25281 5314 1 10 . 1 1 57 57 SER CB C 57 64.890 64.890 63.985 0.905 25281 5315 1 10 . 1 1 57 57 SER H H 57 8.640 8.640 8.341 0.299 25281 5316 1 10 . 1 1 58 58 VAL N N 58 122.060 122.060 124.782 -2.722 25281 5317 1 10 . 1 1 58 58 VAL CA C 58 57.660 57.660 61.992 -4.332 25281 5318 1 10 . 1 1 58 58 VAL CB C 58 31.640 31.640 33.527 -1.887 25281 5319 1 10 . 1 1 58 58 VAL H H 58 8.480 8.480 8.551 -0.071 25281 5320 1 10 . 1 1 59 59 ASP N N 59 123.390 123.390 124.951 -1.561 25281 5321 1 10 . 1 1 59 59 ASP CA C 59 54.960 54.960 53.961 0.999 25281 5322 1 10 . 1 1 59 59 ASP CB C 59 42.840 42.840 42.415 0.425 25281 5323 1 10 . 1 1 59 59 ASP H H 59 9.360 9.360 8.819 0.541 25281 5324 1 10 . 1 1 60 60 GLY N N 60 105.230 105.230 107.780 -2.550 25281 5325 1 10 . 1 1 60 60 GLY CA C 60 45.130 45.130 44.370 0.760 25281 5326 1 10 . 1 1 60 60 GLY H H 60 8.210 8.210 7.654 0.556 25281 5327 1 10 . 1 1 61 61 PHE N N 61 121.440 121.440 122.409 -0.969 25281 5328 1 10 . 1 1 61 61 PHE CA C 61 57.330 57.330 58.190 -0.860 25281 5329 1 10 . 1 1 61 61 PHE CB C 61 39.420 39.420 38.742 0.678 25281 5330 1 10 . 1 1 61 61 PHE H H 61 8.330 8.330 8.443 -0.113 25281 5331 1 10 . 1 1 62 62 LYS N N 62 119.870 119.870 123.294 -3.424 25281 5332 1 10 . 1 1 62 62 LYS CA C 62 56.340 56.340 54.979 1.361 25281 5333 1 10 . 1 1 62 62 LYS CB C 62 33.850 33.850 35.733 -1.883 25281 5334 1 10 . 1 1 62 62 LYS H H 62 8.480 8.480 7.827 0.653 25281 5335 1 10 . 1 1 63 63 LEU N N 63 125.160 125.160 123.331 1.829 25281 5336 1 10 . 1 1 63 63 LEU CA C 63 56.220 56.220 56.921 -0.701 25281 5337 1 10 . 1 1 63 63 LEU CB C 63 41.520 41.520 41.837 -0.317 25281 5338 1 10 . 1 1 63 63 LEU H H 63 8.910 8.910 8.954 -0.044 25281 5339 1 10 . 1 1 64 64 ILE N N 64 119.660 119.660 121.643 -1.983 25281 5340 1 10 . 1 1 64 64 ILE CA C 64 62.420 62.420 63.694 -1.274 25281 5341 1 10 . 1 1 64 64 ILE CB C 64 37.700 37.700 37.703 -0.003 25281 5342 1 10 . 1 1 64 64 ILE H H 64 8.210 8.210 7.905 0.305 25281 5343 1 10 . 1 1 65 65 ASP N N 65 117.080 117.080 119.747 -2.667 25281 5344 1 10 . 1 1 65 65 ASP CA C 65 57.420 57.420 55.279 2.141 25281 5345 1 10 . 1 1 65 65 ASP CB C 65 38.350 38.350 39.620 -1.270 25281 5346 1 10 . 1 1 65 65 ASP H H 65 7.710 7.710 8.012 -0.302 25281 5347 1 10 . 1 1 66 66 GLY N N 66 106.440 106.440 108.318 -1.878 25281 5348 1 10 . 1 1 66 66 GLY CA C 66 45.170 45.170 45.157 0.013 25281 5349 1 10 . 1 1 66 66 GLY H H 66 7.920 7.920 7.718 0.202 25281 5350 1 10 . 1 1 67 67 ASP N N 67 118.490 118.490 118.795 -0.305 25281 5351 1 10 . 1 1 67 67 ASP CA C 67 57.340 57.340 55.300 2.040 25281 5352 1 10 . 1 1 67 67 ASP CB C 67 29.870 29.870 40.786 -10.916 25281 5353 1 10 . 1 1 67 67 ASP H H 67 7.820 7.820 7.500 0.320 25281 5354 1 10 . 1 1 68 68 PHE N N 68 125.320 125.320 118.467 6.853 25281 5355 1 10 . 1 1 68 68 PHE CA C 68 56.090 56.090 57.359 -1.269 25281 5356 1 10 . 1 1 68 68 PHE CB C 68 41.940 41.940 43.146 -1.206 25281 5357 1 10 . 1 1 68 68 PHE H H 68 8.310 8.310 8.438 -0.128 25281 5358 1 10 . 1 1 69 69 LYS N N 69 124.770 124.770 120.808 3.962 25281 5359 1 10 . 1 1 69 69 LYS CA C 69 54.880 54.880 55.388 -0.508 25281 5360 1 10 . 1 1 69 69 LYS CB C 69 36.920 36.920 35.763 1.157 25281 5361 1 10 . 1 1 69 69 LYS H H 69 8.730 8.730 8.887 -0.157 25281 5362 1 10 . 1 1 70 70 TYR N N 70 123.740 123.740 126.453 -2.713 25281 5363 1 10 . 1 1 70 70 TYR CA C 70 55.540 55.540 56.711 -1.171 25281 5364 1 10 . 1 1 70 70 TYR CB C 70 40.150 40.150 42.449 -2.299 25281 5365 1 10 . 1 1 70 70 TYR H H 70 8.680 8.680 8.459 0.221 25281 5366 1 10 . 1 1 71 71 TYR N N 71 123.920 123.920 121.860 2.060 25281 5367 1 10 . 1 1 71 71 TYR CA C 71 54.500 54.500 55.758 -1.258 25281 5368 1 10 . 1 1 71 71 TYR CB C 71 42.420 42.420 41.267 1.153 25281 5369 1 10 . 1 1 71 71 TYR H H 71 8.620 8.620 7.527 1.093 25281 5370 1 10 . 1 1 72 72 SER N N 72 113.820 113.820 114.845 -1.025 25281 5371 1 10 . 1 1 72 72 SER CA C 72 56.320 56.320 57.704 -1.384 25281 5372 1 10 . 1 1 72 72 SER CB C 72 65.790 65.790 66.397 -0.607 25281 5373 1 10 . 1 1 72 72 SER H H 72 8.800 8.800 8.175 0.625 25281 5374 1 10 . 1 1 73 73 VAL N N 73 119.260 119.260 123.687 -4.427 25281 5375 1 10 . 1 1 73 73 VAL CA C 73 60.730 60.730 60.940 -0.210 25281 5376 1 10 . 1 1 73 73 VAL CB C 73 33.870 33.870 34.034 -0.164 25281 5377 1 10 . 1 1 73 73 VAL H H 73 8.170 8.170 8.064 0.106 25281 5378 1 10 . 1 1 74 74 THR N N 74 115.360 115.360 117.034 -1.674 25281 5379 1 10 . 1 1 74 74 THR CA C 74 59.040 59.040 59.626 -0.586 25281 5380 1 10 . 1 1 74 74 THR CB C 74 73.250 73.250 72.109 1.141 25281 5381 1 10 . 1 1 74 74 THR H H 74 9.200 9.200 8.185 1.015 25281 5382 1 10 . 1 1 75 75 ALA N N 75 119.330 119.330 122.440 -3.110 25281 5383 1 10 . 1 1 75 75 ALA CA C 75 51.390 51.390 51.343 0.047 25281 5384 1 10 . 1 1 75 75 ALA CB C 75 22.380 22.380 22.323 0.057 25281 5385 1 10 . 1 1 75 75 ALA H H 75 9.130 9.130 8.648 0.482 25281 5386 1 10 . 1 1 76 76 GLY N N 76 103.130 103.130 106.325 -3.195 25281 5387 1 10 . 1 1 76 76 GLY CA C 76 45.900 45.900 45.001 0.900 25281 5388 1 10 . 1 1 76 76 GLY H H 76 8.760 8.760 7.981 0.779 25281 5389 1 10 . 1 1 77 77 PRO CA C 77 61.250 61.250 62.331 -1.081 25281 5390 1 10 . 1 1 77 77 PRO CB C 77 32.590 32.590 33.369 -0.779 25281 5391 1 10 . 1 1 78 78 VAL N N 78 115.250 115.250 119.805 -4.555 25281 5392 1 10 . 1 1 78 78 VAL CA C 78 58.430 58.430 60.921 -2.491 25281 5393 1 10 . 1 1 78 78 VAL CB C 78 32.700 32.700 35.207 -2.507 25281 5394 1 10 . 1 1 78 78 VAL H H 78 8.240 8.240 8.008 0.232 25281 5395 1 10 . 1 1 79 79 PHE N N 79 130.610 130.610 124.370 6.240 25281 5396 1 10 . 1 1 79 79 PHE CA C 79 55.090 55.090 55.271 -0.181 25281 5397 1 10 . 1 1 79 79 PHE CB C 79 41.590 41.590 41.983 -0.393 25281 5398 1 10 . 1 1 79 79 PHE H H 79 9.540 9.540 7.832 1.708 25281 5399 1 10 . 1 1 80 80 ARG N N 80 130.350 130.350 123.742 6.608 25281 5400 1 10 . 1 1 80 80 ARG CA C 80 55.490 55.490 56.562 -1.072 25281 5401 1 10 . 1 1 80 80 ARG CB C 80 29.520 29.520 30.344 -0.824 25281 5402 1 10 . 1 1 80 80 ARG H H 80 8.810 8.810 8.762 0.048 25281 5403 1 10 . 1 1 81 81 ILE N N 81 127.480 127.480 126.606 0.874 25281 5404 1 10 . 1 1 81 81 ILE CA C 81 62.850 62.850 63.922 -1.072 25281 5405 1 10 . 1 1 81 81 ILE CB C 81 37.650 37.650 38.588 -0.938 25281 5406 1 10 . 1 1 81 81 ILE H H 81 8.260 8.260 8.951 -0.691 25281 5407 1 10 . 1 1 82 82 ASN N N 82 113.110 113.110 114.797 -1.687 25281 5408 1 10 . 1 1 82 82 ASN CA C 82 55.630 55.630 53.276 2.354 25281 5409 1 10 . 1 1 82 82 ASN CB C 82 43.210 43.210 38.694 4.516 25281 5410 1 10 . 1 1 82 82 ASN H H 82 7.970 7.970 7.850 0.120 25281 5411 1 10 . 1 1 85 85 VAL N N 85 118.090 118.090 113.335 4.755 25281 5412 1 10 . 1 1 85 85 VAL CA C 85 61.120 61.120 59.941 1.179 25281 5413 1 10 . 1 1 85 85 VAL CB C 85 34.910 34.910 35.151 -0.241 25281 5414 1 10 . 1 1 85 85 VAL H H 85 7.840 7.840 7.627 0.213 25281 5415 1 10 . 1 1 86 86 SER N N 86 119.050 119.050 120.641 -1.591 25281 5416 1 10 . 1 1 86 86 SER CA C 86 57.100 57.100 57.533 -0.433 25281 5417 1 10 . 1 1 86 86 SER CB C 86 65.400 65.400 65.825 -0.425 25281 5418 1 10 . 1 1 86 86 SER H H 86 8.240 8.240 8.068 0.172 25281 5419 1 10 . 1 1 87 87 LEU N N 87 124.640 124.640 124.903 -0.263 25281 5420 1 10 . 1 1 87 87 LEU CA C 87 53.750 53.750 53.627 0.123 25281 5421 1 10 . 1 1 87 87 LEU CB C 87 46.320 46.320 44.905 1.415 25281 5422 1 10 . 1 1 87 87 LEU H H 87 9.130 9.130 7.618 1.512 25281 5423 1 10 . 1 1 88 88 TYR N N 88 118.740 118.740 122.475 -3.735 25281 5424 1 10 . 1 1 88 88 TYR CA C 88 55.080 55.080 55.497 -0.417 25281 5425 1 10 . 1 1 88 88 TYR CB C 88 42.630 42.630 41.137 1.493 25281 5426 1 10 . 1 1 88 88 TYR H H 88 8.740 8.740 7.704 1.036 25281 5427 1 10 . 1 1 89 89 GLY N N 89 103.920 103.920 106.991 -3.071 25281 5428 1 10 . 1 1 89 89 GLY CA C 89 43.250 43.250 43.402 -0.152 25281 5429 1 10 . 1 1 89 89 GLY H H 89 7.720 7.720 8.282 -0.562 25281 5430 1 10 . 1 1 90 90 LEU N N 90 117.530 117.530 122.612 -5.082 25281 5431 1 10 . 1 1 90 90 LEU CA C 90 53.200 53.200 54.182 -0.982 25281 5432 1 10 . 1 1 90 90 LEU CB C 90 45.810 45.810 45.222 0.588 25281 5433 1 10 . 1 1 90 90 LEU H H 90 8.520 8.520 8.119 0.401 25281 5434 1 10 . 1 1 91 91 LEU N N 91 120.670 120.670 118.796 1.874 25281 5435 1 10 . 1 1 91 91 LEU CA C 91 53.590 53.590 53.659 -0.069 25281 5436 1 10 . 1 1 91 91 LEU CB C 91 46.330 46.330 45.747 0.583 25281 5437 1 10 . 1 1 91 91 LEU H H 91 9.250 9.250 7.869 1.381 25281 5438 1 10 . 1 1 92 92 GLY N N 92 108.770 108.770 108.515 0.255 25281 5439 1 10 . 1 1 92 92 GLY CA C 92 46.520 46.520 46.125 0.395 25281 5440 1 10 . 1 1 92 92 GLY H H 92 8.480 8.480 8.117 0.363 25281 5441 1 10 . 1 1 93 93 ALA N N 93 126.760 126.760 121.323 5.437 25281 5442 1 10 . 1 1 93 93 ALA CA C 93 49.890 49.890 51.068 -1.178 25281 5443 1 10 . 1 1 93 93 ALA CB C 93 21.860 21.860 22.517 -0.657 25281 5444 1 10 . 1 1 93 93 ALA H H 93 8.860 8.860 7.803 1.057 25281 5445 1 10 . 1 1 94 94 GLY N N 94 107.510 107.510 106.828 0.682 25281 5446 1 10 . 1 1 94 94 GLY CA C 94 42.760 42.760 43.890 -1.130 25281 5447 1 10 . 1 1 94 94 GLY H H 94 8.880 8.880 7.815 1.065 25281 5448 1 10 . 1 1 95 95 HIS N N 95 122.340 122.340 118.846 3.494 25281 5449 1 10 . 1 1 95 95 HIS CA C 95 54.570 54.570 54.282 0.288 25281 5450 1 10 . 1 1 95 95 HIS CB C 95 32.700 32.700 34.264 -1.564 25281 5451 1 10 . 1 1 95 95 HIS H H 95 9.200 9.200 7.562 1.638 25281 5452 1 10 . 1 1 96 96 GLY N N 96 112.170 112.170 107.908 4.262 25281 5453 1 10 . 1 1 96 96 GLY CA C 96 43.150 43.150 44.388 -1.238 25281 5454 1 10 . 1 1 96 96 GLY H H 96 8.620 8.620 8.281 0.339 25281 5455 1 10 . 1 1 97 97 LYS N N 97 120.580 120.580 122.643 -2.063 25281 5456 1 10 . 1 1 97 97 LYS CA C 97 54.890 54.890 54.744 0.146 25281 5457 1 10 . 1 1 97 97 LYS CB C 97 35.560 35.560 37.933 -2.373 25281 5458 1 10 . 1 1 97 97 LYS H H 97 9.010 9.010 8.889 0.121 25281 5459 1 10 . 1 1 98 98 ALA N N 98 126.740 126.740 124.116 2.624 25281 5460 1 10 . 1 1 98 98 ALA CA C 98 50.020 50.020 50.663 -0.643 25281 5461 1 10 . 1 1 98 98 ALA CB C 98 22.380 22.380 22.204 0.176 25281 5462 1 10 . 1 1 98 98 ALA H H 98 9.120 9.120 8.415 0.705 25281 5463 1 10 . 1 1 99 99 LYS N N 99 122.360 122.360 124.092 -1.732 25281 5464 1 10 . 1 1 99 99 LYS CA C 99 55.090 55.090 55.413 -0.323 25281 5465 1 10 . 1 1 99 99 LYS CB C 99 34.970 34.970 35.135 -0.165 25281 5466 1 10 . 1 1 99 99 LYS H H 99 8.580 8.580 8.427 0.153 25281 5467 1 10 . 1 1 100 100 PHE N N 100 121.170 121.170 124.844 -3.674 25281 5468 1 10 . 1 1 100 100 PHE CA C 100 56.390 56.390 57.754 -1.364 25281 5469 1 10 . 1 1 100 100 PHE CB C 100 42.110 42.110 40.490 1.620 25281 5470 1 10 . 1 1 100 100 PHE H H 100 8.750 8.750 8.371 0.379 25281 5471 1 10 . 1 1 101 101 SER N N 101 117.280 117.280 116.125 1.155 25281 5472 1 10 . 1 1 101 101 SER CA C 101 57.070 57.070 57.440 -0.370 25281 5473 1 10 . 1 1 101 101 SER CB C 101 65.830 65.830 64.765 1.065 25281 5474 1 10 . 1 1 101 101 SER H H 101 8.990 8.990 7.160 1.830 25281 5475 1 10 . 1 1 102 102 SER N N 102 117.600 117.600 116.617 0.983 25281 5476 1 10 . 1 1 102 102 SER CA C 102 56.500 56.500 58.171 -1.671 25281 5477 1 10 . 1 1 102 102 SER CB C 102 67.540 67.540 63.288 4.252 25281 5478 1 10 . 1 1 102 102 SER H H 102 8.680 8.680 8.334 0.346 25281 5479 1 10 . 1 1 103 103 ILE N N 103 114.980 114.980 122.748 -7.768 25281 5480 1 10 . 1 1 103 103 ILE CA C 103 59.180 59.180 60.306 -1.126 25281 5481 1 10 . 1 1 103 103 ILE CB C 103 40.550 40.550 40.321 0.229 25281 5482 1 10 . 1 1 103 103 ILE H H 103 7.700 7.700 8.120 -0.420 25281 5483 1 10 . 1 1 104 104 PHE N N 104 123.710 123.710 122.598 1.112 25281 5484 1 10 . 1 1 104 104 PHE CA C 104 53.190 53.190 57.920 -4.730 25281 5485 1 10 . 1 1 104 104 PHE CB C 104 43.900 43.900 39.379 4.521 25281 5486 1 10 . 1 1 104 104 PHE H H 104 8.590 8.590 8.615 -0.025 25281 5487 1 10 . 1 1 105 105 GLY N N 105 109.080 109.080 111.246 -2.166 25281 5488 1 10 . 1 1 105 105 GLY CA C 105 45.420 45.420 44.391 1.029 25281 5489 1 10 . 1 1 105 105 GLY H H 105 8.400 8.400 8.455 -0.055 25281 5490 1 10 . 1 1 106 106 GLN N N 106 119.680 119.680 119.416 0.264 25281 5491 1 10 . 1 1 106 106 GLN CA C 106 53.720 53.720 55.370 -1.650 25281 5492 1 10 . 1 1 106 106 GLN CB C 106 30.100 30.100 29.784 0.317 25281 5493 1 10 . 1 1 106 106 GLN H H 106 8.530 8.530 8.195 0.335 25281 5494 1 10 . 1 1 107 107 SER N N 107 119.160 119.160 118.203 0.957 25281 5495 1 10 . 1 1 107 107 SER CA C 107 57.360 57.360 58.132 -0.772 25281 5496 1 10 . 1 1 107 107 SER CB C 107 66.050 66.050 64.256 1.794 25281 5497 1 10 . 1 1 107 107 SER H H 107 8.800 8.800 8.415 0.385 25281 5498 1 10 . 1 1 108 108 GLU N N 108 125.360 125.360 120.638 4.722 25281 5499 1 10 . 1 1 108 108 GLU CA C 108 58.910 58.910 55.479 3.431 25281 5500 1 10 . 1 1 108 108 GLU CB C 108 40.880 40.880 32.600 8.280 25281 5501 1 10 . 1 1 108 108 GLU H H 108 8.960 8.960 8.506 0.454 25281 5502 1 10 . 1 1 109 109 SER N N 109 118.890 118.890 115.880 3.010 25281 5503 1 10 . 1 1 109 109 SER CA C 109 56.710 56.710 57.306 -0.597 25281 5504 1 10 . 1 1 109 109 SER CB C 109 66.180 66.180 65.372 0.808 25281 5505 1 10 . 1 1 109 109 SER H H 109 9.080 9.080 8.448 0.632 25281 5506 1 10 . 1 1 110 110 ARG N N 110 119.830 119.830 123.946 -4.116 25281 5507 1 10 . 1 1 110 110 ARG CA C 110 58.390 58.390 55.191 3.199 25281 5508 1 10 . 1 1 110 110 ARG CB C 110 40.940 40.940 33.746 7.194 25281 5509 1 10 . 1 1 110 110 ARG H H 110 8.850 8.850 8.404 0.446 25281 5510 1 10 . 1 1 111 111 SER N N 111 114.870 114.870 116.251 -1.381 25281 5511 1 10 . 1 1 111 111 SER CA C 111 57.290 57.290 57.090 0.200 25281 5512 1 10 . 1 1 111 111 SER CB C 111 66.110 66.110 66.470 -0.360 25281 5513 1 10 . 1 1 111 111 SER H H 111 8.740 8.740 8.416 0.324 25281 5514 1 10 . 1 1 112 112 LYS N N 112 120.870 120.870 120.495 0.375 25281 5515 1 10 . 1 1 112 112 LYS CA C 112 55.150 55.150 55.663 -0.513 25281 5516 1 10 . 1 1 112 112 LYS CB C 112 36.330 36.330 36.165 0.165 25281 5517 1 10 . 1 1 112 112 LYS H H 112 8.520 8.520 8.474 0.046 25281 5518 1 10 . 1 1 113 113 THR N N 113 121.390 121.390 116.057 5.333 25281 5519 1 10 . 1 1 113 113 THR CA C 113 61.250 61.250 60.741 0.509 25281 5520 1 10 . 1 1 113 113 THR CB C 113 70.010 70.010 70.664 -0.654 25281 5521 1 10 . 1 1 113 113 THR H H 113 8.440 8.440 8.437 0.003 25281 5522 1 10 . 1 1 114 114 SER N N 114 120.730 120.730 118.342 2.388 25281 5523 1 10 . 1 1 114 114 SER CA C 114 56.190 56.190 57.676 -1.486 25281 5524 1 10 . 1 1 114 114 SER CB C 114 66.380 66.380 64.493 1.887 25281 5525 1 10 . 1 1 114 114 SER H H 114 9.350 9.350 8.319 1.031 25281 5526 1 10 . 1 1 115 115 LEU N N 115 121.540 121.540 124.466 -2.926 25281 5527 1 10 . 1 1 115 115 LEU CA C 115 55.480 55.480 54.002 1.478 25281 5528 1 10 . 1 1 115 115 LEU CB C 115 42.890 42.890 44.643 -1.753 25281 5529 1 10 . 1 1 115 115 LEU H H 115 8.200 8.200 8.729 -0.529 25281 5530 1 10 . 1 1 116 116 ALA N N 116 129.060 129.060 123.835 5.225 25281 5531 1 10 . 1 1 116 116 ALA CA C 116 49.960 49.960 50.202 -0.242 25281 5532 1 10 . 1 1 116 116 ALA CB C 116 20.310 20.310 22.441 -2.131 25281 5533 1 10 . 1 1 116 116 ALA H H 116 8.600 8.600 8.130 0.470 25281 5534 1 10 . 1 1 117 117 TYR N N 117 115.890 115.890 124.646 -8.756 25281 5535 1 10 . 1 1 117 117 TYR CA C 117 55.150 55.150 57.229 -2.079 25281 5536 1 10 . 1 1 117 117 TYR CB C 117 41.200 41.200 42.119 -0.919 25281 5537 1 10 . 1 1 117 117 TYR H H 117 8.450 8.450 7.896 0.554 25281 5538 1 10 . 1 1 118 118 GLY N N 118 107.330 107.330 110.581 -3.251 25281 5539 1 10 . 1 1 118 118 GLY CA C 118 45.940 45.940 45.084 0.856 25281 5540 1 10 . 1 1 118 118 GLY H H 118 9.340 9.340 7.632 1.708 25281 5541 1 10 . 1 1 119 119 ALA N N 119 118.880 118.880 119.056 -0.176 25281 5542 1 10 . 1 1 119 119 ALA CA C 119 51.320 51.320 50.765 0.555 25281 5543 1 10 . 1 1 119 119 ALA CB C 119 22.120 22.120 22.184 -0.064 25281 5544 1 10 . 1 1 119 119 ALA H H 119 8.770 8.770 6.527 2.243 25281 5545 1 10 . 1 1 120 120 GLY N N 120 105.730 105.730 105.083 0.647 25281 5546 1 10 . 1 1 120 120 GLY CA C 120 45.650 45.650 44.479 1.171 25281 5547 1 10 . 1 1 120 120 GLY H H 120 7.940 7.940 7.402 0.538 25281 5548 1 10 . 1 1 121 121 LEU N N 121 115.480 115.480 119.239 -3.759 25281 5549 1 10 . 1 1 121 121 LEU CA C 121 52.980 52.980 53.665 -0.685 25281 5550 1 10 . 1 1 121 121 LEU CB C 121 46.460 46.460 45.742 0.718 25281 5551 1 10 . 1 1 121 121 LEU H H 121 9.010 9.010 8.463 0.547 25281 5552 1 10 . 1 1 122 122 GLN N N 122 112.530 112.530 120.699 -8.169 25281 5553 1 10 . 1 1 122 122 GLN CA C 122 54.780 54.780 54.260 0.520 25281 5554 1 10 . 1 1 122 122 GLN CB C 122 31.400 31.400 32.439 -1.039 25281 5555 1 10 . 1 1 122 122 GLN H H 122 8.090 8.090 8.017 0.073 25281 5556 1 10 . 1 1 123 123 PHE N N 123 126.050 126.050 125.098 0.952 25281 5557 1 10 . 1 1 123 123 PHE CA C 123 54.180 54.180 56.695 -2.515 25281 5558 1 10 . 1 1 123 123 PHE CB C 123 42.560 42.560 41.285 1.275 25281 5559 1 10 . 1 1 123 123 PHE H H 123 10.020 10.020 8.840 1.180 25281 5560 1 10 . 1 1 124 124 ASN N N 124 121.910 121.910 122.305 -0.395 25281 5561 1 10 . 1 1 124 124 ASN CA C 124 50.940 50.940 50.467 0.473 25281 5562 1 10 . 1 1 124 124 ASN CB C 124 40.360 40.360 38.547 1.813 25281 5563 1 10 . 1 1 124 124 ASN H H 124 9.520 9.520 8.206 1.314 25281 5564 1 10 . 1 1 125 125 PRO CA C 125 63.390 63.390 62.157 1.233 25281 5565 1 10 . 1 1 125 125 PRO CB C 125 31.210 31.210 32.512 -1.302 25281 5566 1 10 . 1 1 126 126 HIS N N 126 116.830 116.830 116.816 0.014 25281 5567 1 10 . 1 1 126 126 HIS CA C 126 54.110 54.110 58.309 -4.199 25281 5568 1 10 . 1 1 126 126 HIS CB C 126 34.910 34.910 28.178 6.732 25281 5569 1 10 . 1 1 126 126 HIS H H 126 7.630 7.630 8.518 -0.888 25281 5570 1 10 . 1 1 127 127 PRO CA C 127 65.370 65.370 63.367 2.003 25281 5571 1 10 . 1 1 127 127 PRO CB C 127 31.030 31.030 32.218 -1.188 25281 5572 1 10 . 1 1 128 128 ASN N N 128 114.680 114.680 117.243 -2.563 25281 5573 1 10 . 1 1 128 128 ASN CA C 128 53.990 53.990 53.345 0.645 25281 5574 1 10 . 1 1 128 128 ASN CB C 128 40.550 40.550 38.120 2.429 25281 5575 1 10 . 1 1 128 128 ASN H H 128 10.460 10.460 8.599 1.861 25281 5576 1 10 . 1 1 129 129 PHE N N 129 119.630 119.630 117.196 2.434 25281 5577 1 10 . 1 1 129 129 PHE CA C 129 56.530 56.530 56.935 -0.405 25281 5578 1 10 . 1 1 129 129 PHE CB C 129 44.310 44.310 42.267 2.043 25281 5579 1 10 . 1 1 129 129 PHE H H 129 8.340 8.340 7.510 0.830 25281 5580 1 10 . 1 1 130 130 VAL N N 130 123.000 123.000 121.085 1.915 25281 5581 1 10 . 1 1 130 130 VAL CA C 130 60.340 60.340 60.700 -0.360 25281 5582 1 10 . 1 1 130 130 VAL CB C 130 34.970 34.970 35.111 -0.141 25281 5583 1 10 . 1 1 130 130 VAL H H 130 7.820 7.820 9.468 -1.648 25281 5584 1 10 . 1 1 131 131 ILE N N 131 124.470 124.470 128.185 -3.715 25281 5585 1 10 . 1 1 131 131 ILE CA C 131 60.210 60.210 60.872 -0.662 25281 5586 1 10 . 1 1 131 131 ILE CB C 131 39.510 39.510 39.472 0.038 25281 5587 1 10 . 1 1 131 131 ILE H H 131 8.830 8.830 8.313 0.517 25281 5588 1 10 . 1 1 132 132 ASP N N 132 130.700 130.700 128.665 2.035 25281 5589 1 10 . 1 1 132 132 ASP CA C 132 53.530 53.530 53.402 0.128 25281 5590 1 10 . 1 1 132 132 ASP CB C 132 47.620 47.620 44.112 3.508 25281 5591 1 10 . 1 1 132 132 ASP H H 132 9.040 9.040 8.564 0.476 25281 5592 1 10 . 1 1 133 133 ALA N N 133 126.900 126.900 126.541 0.359 25281 5593 1 10 . 1 1 133 133 ALA CA C 133 51.390 51.390 50.893 0.497 25281 5594 1 10 . 1 1 133 133 ALA CB C 133 21.730 21.730 23.052 -1.322 25281 5595 1 10 . 1 1 133 133 ALA H H 133 8.800 8.800 8.631 0.169 25281 5596 1 10 . 1 1 134 134 SER N N 134 113.760 113.760 118.214 -4.454 25281 5597 1 10 . 1 1 134 134 SER CA C 134 58.140 58.140 57.194 0.945 25281 5598 1 10 . 1 1 134 134 SER CB C 134 67.020 67.020 66.062 0.958 25281 5599 1 10 . 1 1 134 134 SER H H 134 9.160 9.160 8.516 0.644 25281 5600 1 10 . 1 1 135 135 TYR N N 135 118.500 118.500 119.512 -1.012 25281 5601 1 10 . 1 1 135 135 TYR CA C 135 55.690 55.690 55.416 0.274 25281 5602 1 10 . 1 1 135 135 TYR CB C 135 43.150 43.150 41.550 1.600 25281 5603 1 10 . 1 1 135 135 TYR H H 135 8.820 8.820 8.144 0.676 25281 5604 1 10 . 1 1 136 136 GLU N N 136 126.290 126.290 121.708 4.582 25281 5605 1 10 . 1 1 136 136 GLU CA C 136 53.530 53.530 55.019 -1.488 25281 5606 1 10 . 1 1 136 136 GLU CB C 136 34.450 34.450 34.447 0.003 25281 5607 1 10 . 1 1 136 136 GLU H H 136 8.380 8.380 8.925 -0.545 25281 5608 1 10 . 1 1 137 137 TYR N N 137 123.630 123.630 121.304 2.326 25281 5609 1 10 . 1 1 137 137 TYR CA C 137 55.670 55.670 55.918 -0.248 25281 5610 1 10 . 1 1 137 137 TYR CB C 137 43.150 43.150 41.218 1.932 25281 5611 1 10 . 1 1 137 137 TYR H H 137 9.300 9.300 8.105 1.195 25281 5612 1 10 . 1 1 138 138 SER N N 138 118.300 118.300 115.778 2.522 25281 5613 1 10 . 1 1 138 138 SER CA C 138 58.270 58.270 56.904 1.366 25281 5614 1 10 . 1 1 138 138 SER CB C 138 67.090 67.090 66.269 0.821 25281 5615 1 10 . 1 1 138 138 SER H H 138 7.980 7.980 8.883 -0.903 25281 5616 1 10 . 1 1 139 139 LYS N N 139 127.450 127.450 125.191 2.259 25281 5617 1 10 . 1 1 139 139 LYS CA C 139 55.160 55.160 55.874 -0.715 25281 5618 1 10 . 1 1 139 139 LYS CB C 139 32.640 32.640 33.120 -0.480 25281 5619 1 10 . 1 1 139 139 LYS H H 139 8.630 8.630 8.614 0.016 25281 5620 1 10 . 1 1 140 140 LEU N N 140 129.650 129.650 127.255 2.395 25281 5621 1 10 . 1 1 140 140 LEU CA C 140 52.500 52.500 53.805 -1.305 25281 5622 1 10 . 1 1 140 140 LEU CB C 140 40.000 40.000 43.996 -3.996 25281 5623 1 10 . 1 1 140 140 LEU H H 140 9.060 9.060 8.050 1.010 25281 5624 1 10 . 1 1 141 141 ASP N N 141 121.470 121.470 122.269 -0.799 25281 5625 1 10 . 1 1 141 141 ASP CA C 141 57.190 57.190 56.430 0.760 25281 5626 1 10 . 1 1 141 141 ASP CB C 141 39.730 39.730 40.740 -1.010 25281 5627 1 10 . 1 1 141 141 ASP H H 141 8.590 8.590 8.653 -0.063 25281 5628 1 10 . 1 1 142 142 ASP N N 142 121.510 121.510 119.843 1.667 25281 5629 1 10 . 1 1 142 142 ASP CA C 142 55.180 55.180 55.451 -0.271 25281 5630 1 10 . 1 1 142 142 ASP CB C 142 41.090 41.090 41.095 -0.005 25281 5631 1 10 . 1 1 142 142 ASP H H 142 8.430 8.430 8.441 -0.011 25281 5632 1 10 . 1 1 143 143 VAL N N 143 121.420 121.420 112.709 8.711 25281 5633 1 10 . 1 1 143 143 VAL CA C 143 62.240 62.240 60.204 2.036 25281 5634 1 10 . 1 1 143 143 VAL CB C 143 31.280 31.280 34.474 -3.194 25281 5635 1 10 . 1 1 143 143 VAL H H 143 8.020 8.020 7.707 0.313 25281 5636 1 10 . 1 1 144 144 LYS N N 144 127.950 127.950 122.806 5.144 25281 5637 1 10 . 1 1 144 144 LYS CA C 144 55.440 55.440 55.922 -0.482 25281 5638 1 10 . 1 1 144 144 LYS CB C 144 32.640 32.640 33.695 -1.055 25281 5639 1 10 . 1 1 144 144 LYS H H 144 8.660 8.660 8.402 0.258 25281 5640 1 10 . 1 1 145 145 VAL N N 145 124.120 124.120 126.071 -1.951 25281 5641 1 10 . 1 1 145 145 VAL CA C 145 55.910 55.910 59.972 -4.062 25281 5642 1 10 . 1 1 145 145 VAL CB C 145 32.570 32.570 33.983 -1.413 25281 5643 1 10 . 1 1 145 145 VAL H H 145 8.720 8.720 7.877 0.843 25281 5644 1 10 . 1 1 146 146 GLY N N 146 116.240 116.240 115.104 1.136 25281 5645 1 10 . 1 1 146 146 GLY CA C 146 44.080 44.080 44.263 -0.183 25281 5646 1 10 . 1 1 146 146 GLY H H 146 8.400 8.400 8.442 -0.042 25281 5647 1 10 . 1 1 147 147 THR N N 147 124.620 124.620 121.827 2.793 25281 5648 1 10 . 1 1 147 147 THR CA C 147 61.450 61.450 61.535 -0.085 25281 5649 1 10 . 1 1 147 147 THR CB C 147 70.260 70.260 71.225 -0.965 25281 5650 1 10 . 1 1 147 147 THR H H 147 9.080 9.080 8.977 0.103 25281 5651 1 10 . 1 1 148 148 TRP N N 148 124.790 124.790 127.704 -2.914 25281 5652 1 10 . 1 1 148 148 TRP CA C 148 54.770 54.770 56.273 -1.502 25281 5653 1 10 . 1 1 148 148 TRP CB C 148 33.090 33.090 32.373 0.717 25281 5654 1 10 . 1 1 148 148 TRP H H 148 8.510 8.510 8.865 -0.355 25281 5655 1 10 . 1 1 149 149 MET N N 149 118.880 118.880 121.104 -2.224 25281 5656 1 10 . 1 1 149 149 MET CA C 149 54.540 54.540 54.930 -0.390 25281 5657 1 10 . 1 1 149 149 MET CB C 149 34.640 34.640 35.271 -0.631 25281 5658 1 10 . 1 1 149 149 MET H H 149 9.150 9.150 9.333 -0.183 25281 5659 1 10 . 1 1 150 150 LEU N N 150 122.830 122.830 123.494 -0.664 25281 5660 1 10 . 1 1 150 150 LEU CA C 150 54.100 54.100 53.390 0.710 25281 5661 1 10 . 1 1 150 150 LEU CB C 150 45.800 45.800 45.064 0.736 25281 5662 1 10 . 1 1 150 150 LEU H H 150 8.480 8.480 8.074 0.406 25281 5663 1 10 . 1 1 151 151 GLY N N 151 112.730 112.730 109.017 3.713 25281 5664 1 10 . 1 1 151 151 GLY CA C 151 45.940 45.940 45.997 -0.057 25281 5665 1 10 . 1 1 151 151 GLY H H 151 9.820 9.820 8.176 1.644 25281 5666 1 10 . 1 1 152 152 ALA N N 152 119.460 119.460 120.045 -0.585 25281 5667 1 10 . 1 1 152 152 ALA CA C 152 49.760 49.760 50.798 -1.038 25281 5668 1 10 . 1 1 152 152 ALA CB C 152 22.700 22.700 23.020 -0.320 25281 5669 1 10 . 1 1 152 152 ALA H H 152 8.840 8.840 8.508 0.332 25281 5670 1 10 . 1 1 153 153 GLY N N 153 104.360 104.360 106.289 -1.929 25281 5671 1 10 . 1 1 153 153 GLY CA C 153 46.440 46.440 44.489 1.951 25281 5672 1 10 . 1 1 153 153 GLY H H 153 8.540 8.540 8.745 -0.205 25281 5673 1 10 . 1 1 154 154 TYR N N 154 120.680 120.680 115.129 5.551 25281 5674 1 10 . 1 1 154 154 TYR CA C 154 55.370 55.370 55.527 -0.157 25281 5675 1 10 . 1 1 154 154 TYR CB C 154 44.250 44.250 41.408 2.841 25281 5676 1 10 . 1 1 154 154 TYR H H 154 8.310 8.310 7.655 0.655 25281 5677 1 10 . 1 1 155 155 ARG N N 155 127.050 127.050 123.564 3.486 25281 5678 1 10 . 1 1 155 155 ARG CA C 155 53.480 53.480 55.532 -2.051 25281 5679 1 10 . 1 1 155 155 ARG CB C 155 32.160 32.160 31.182 0.978 25281 5680 1 10 . 1 1 155 155 ARG H H 155 7.640 7.640 8.613 -0.973 25281 stop_ loop_ _SPARTA_output.Data_ID _SPARTA_output.Entity_delta_chem_shifts_ID _SPARTA_output.Conformer_ID _SPARTA_output.Data_type _SPARTA_output.Data_atom _SPARTA_output.Data_num_shifts _SPARTA_output.Data_value _SPARTA_output.Data_low_range _SPARTA_output.Data_high_range _SPARTA_output.Entry_ID 1 1 1 "Average Difference" N 145 3.483 0.164 3.491 25281 2 1 1 "Average Difference" HA 0 0.000 0.000 0.000 25281 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 25281 4 1 1 "Average Difference" CA 149 1.509 0.205 1.500 25281 5 1 1 "Average Difference" CB 129 2.674 0.151 2.681 25281 6 1 1 "Average Difference" HN 145 0.690 -0.337 0.604 25281 7 1 2 "Average Difference" N 145 3.804 0.073 3.816 25281 8 1 2 "Average Difference" HA 0 0.000 0.000 0.000 25281 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 25281 10 1 2 "Average Difference" CA 149 1.522 0.208 1.513 25281 11 1 2 "Average Difference" CB 129 2.425 0.132 2.431 25281 12 1 2 "Average Difference" HN 145 0.717 -0.400 0.598 25281 13 1 3 "Average Difference" N 145 3.771 -0.179 3.780 25281 14 1 3 "Average Difference" HA 0 0.000 0.000 0.000 25281 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 25281 16 1 3 "Average Difference" CA 149 1.463 0.257 1.446 25281 17 1 3 "Average Difference" CB 129 2.656 0.176 2.661 25281 18 1 3 "Average Difference" HN 145 0.664 -0.356 0.563 25281 19 1 4 "Average Difference" N 145 3.768 -0.035 3.781 25281 20 1 4 "Average Difference" HA 0 0.000 0.000 0.000 25281 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 25281 22 1 4 "Average Difference" CA 149 1.440 0.169 1.435 25281 23 1 4 "Average Difference" CB 129 2.638 0.106 2.646 25281 24 1 4 "Average Difference" HN 145 0.715 -0.350 0.625 25281 25 1 5 "Average Difference" N 145 3.701 -0.606 3.664 25281 26 1 5 "Average Difference" HA 0 0.000 0.000 0.000 25281 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 25281 28 1 5 "Average Difference" CA 149 1.502 0.272 1.482 25281 29 1 5 "Average Difference" CB 129 2.527 0.126 2.534 25281 30 1 5 "Average Difference" HN 145 0.661 -0.336 0.571 25281 31 1 6 "Average Difference" N 145 3.751 0.198 3.759 25281 32 1 6 "Average Difference" HA 0 0.000 0.000 0.000 25281 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 25281 34 1 6 "Average Difference" CA 149 1.545 0.220 1.534 25281 35 1 6 "Average Difference" CB 129 2.657 0.101 2.665 25281 36 1 6 "Average Difference" HN 145 0.700 -0.339 0.614 25281 37 1 7 "Average Difference" N 145 3.875 -0.039 3.888 25281 38 1 7 "Average Difference" HA 0 0.000 0.000 0.000 25281 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 25281 40 1 7 "Average Difference" CA 149 1.433 0.255 1.415 25281 41 1 7 "Average Difference" CB 129 2.653 0.168 2.658 25281 42 1 7 "Average Difference" HN 145 0.708 -0.355 0.615 25281 43 1 8 "Average Difference" N 145 3.784 -0.208 3.792 25281 44 1 8 "Average Difference" HA 0 0.000 0.000 0.000 25281 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 25281 46 1 8 "Average Difference" CA 149 1.476 0.195 1.468 25281 47 1 8 "Average Difference" CB 129 2.608 0.198 2.610 25281 48 1 8 "Average Difference" HN 145 0.725 -0.356 0.635 25281 49 1 9 "Average Difference" N 145 3.608 -0.375 3.601 25281 50 1 9 "Average Difference" HA 0 0.000 0.000 0.000 25281 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 25281 52 1 9 "Average Difference" CA 149 1.486 0.161 1.482 25281 53 1 9 "Average Difference" CB 129 2.538 0.032 2.548 25281 54 1 9 "Average Difference" HN 145 0.703 -0.345 0.615 25281 55 1 10 "Average Difference" N 145 3.639 0.105 3.650 25281 56 1 10 "Average Difference" HA 0 0.000 0.000 0.000 25281 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 25281 58 1 10 "Average Difference" CA 149 1.553 0.261 1.536 25281 59 1 10 "Average Difference" CB 129 2.484 0.016 2.494 25281 60 1 10 "Average Difference" HN 145 0.726 -0.344 0.642 25281 stop_ save_ save_delta_chem_shifts_average _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average _Entity_delta_chem_shifts.Model_type average _Entity_delta_chem_shifts.Entry_ID 25281 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 2 2 GLY N N 2 112.280 112.280 109.427 2.853 25281 2 1 . 1 1 2 2 GLY CA C 2 44.830 44.830 44.764 0.066 25281 3 1 . 1 1 2 2 GLY H H 2 8.460 8.460 8.133 0.327 25281 4 1 . 1 1 3 3 GLU N N 3 118.460 118.460 120.990 -2.530 25281 5 1 . 1 1 3 3 GLU CA C 3 56.840 56.840 56.716 0.125 25281 6 1 . 1 1 3 3 GLU CB C 3 29.980 29.980 30.572 -0.592 25281 7 1 . 1 1 3 3 GLU H H 3 7.630 7.630 8.338 -0.708 25281 8 1 . 1 1 4 4 SER N N 4 119.000 119.000 117.219 1.780 25281 9 1 . 1 1 4 4 SER CA C 4 57.280 57.280 57.384 -0.104 25281 10 1 . 1 1 4 4 SER CB C 4 65.860 65.860 66.022 -0.162 25281 11 1 . 1 1 4 4 SER H H 4 8.820 8.820 8.406 0.414 25281 12 1 . 1 1 5 5 SER N N 5 118.300 118.300 117.386 0.914 25281 13 1 . 1 1 5 5 SER CA C 5 57.560 57.560 57.318 0.242 25281 14 1 . 1 1 5 5 SER CB C 5 65.480 65.480 65.643 -0.163 25281 15 1 . 1 1 5 5 SER H H 5 8.700 8.700 8.109 0.591 25281 16 1 . 1 1 6 6 ILE N N 6 123.240 123.240 121.944 1.296 25281 17 1 . 1 1 6 6 ILE CA C 6 54.110 54.110 59.779 -5.669 25281 18 1 . 1 1 6 6 ILE CB C 6 33.870 33.870 41.380 -7.510 25281 19 1 . 1 1 6 6 ILE H H 6 9.080 9.080 7.785 1.295 25281 20 1 . 1 1 7 7 SER N N 7 116.100 116.100 118.832 -2.732 25281 21 1 . 1 1 7 7 SER CA C 7 57.130 57.130 57.080 0.050 25281 22 1 . 1 1 7 7 SER CB C 7 65.710 65.710 65.835 -0.125 25281 23 1 . 1 1 7 7 SER H H 7 8.570 8.570 8.166 0.404 25281 24 1 . 1 1 8 8 ILE N N 8 114.140 114.140 120.534 -6.394 25281 25 1 . 1 1 8 8 ILE CA C 8 58.460 58.460 59.163 -0.703 25281 26 1 . 1 1 8 8 ILE CB C 8 40.880 40.880 42.147 -1.267 25281 27 1 . 1 1 8 8 ILE H H 8 8.300 8.300 8.467 -0.167 25281 28 1 . 1 1 9 9 GLY N N 9 109.200 109.200 109.702 -0.501 25281 29 1 . 1 1 9 9 GLY CA C 9 45.550 45.550 45.582 -0.033 25281 30 1 . 1 1 9 9 GLY H H 9 9.060 9.060 7.928 1.132 25281 31 1 . 1 1 10 10 TYR N N 10 121.410 121.410 119.158 2.252 25281 32 1 . 1 1 10 10 TYR CA C 10 56.970 56.970 57.053 -0.083 25281 33 1 . 1 1 10 10 TYR CB C 10 41.520 41.520 41.675 -0.155 25281 34 1 . 1 1 10 10 TYR H H 10 8.870 8.870 8.078 0.792 25281 35 1 . 1 1 11 11 ALA N N 11 125.250 125.250 124.054 1.196 25281 36 1 . 1 1 11 11 ALA CA C 11 48.740 48.740 50.103 -1.363 25281 37 1 . 1 1 11 11 ALA CB C 11 21.610 21.610 21.726 -0.116 25281 38 1 . 1 1 11 11 ALA H H 11 7.210 7.210 8.247 -1.037 25281 39 1 . 1 1 12 12 GLN N N 12 119.180 119.180 122.168 -2.988 25281 40 1 . 1 1 12 12 GLN CA C 12 54.690 54.690 54.678 0.012 25281 41 1 . 1 1 12 12 GLN CB C 12 32.000 32.000 33.339 -1.339 25281 42 1 . 1 1 12 12 GLN H H 12 8.330 8.330 8.230 0.100 25281 43 1 . 1 1 13 13 SER N N 13 122.790 122.790 117.599 5.191 25281 44 1 . 1 1 13 13 SER CA C 13 57.780 57.780 57.079 0.701 25281 45 1 . 1 1 13 13 SER CB C 13 64.540 64.540 65.543 -1.003 25281 46 1 . 1 1 13 13 SER H H 13 8.610 8.610 8.626 -0.016 25281 47 1 . 1 1 14 14 ARG N N 14 121.140 121.140 124.193 -3.053 25281 48 1 . 1 1 14 14 ARG CA C 14 54.960 54.960 55.199 -0.239 25281 49 1 . 1 1 14 14 ARG CB C 14 32.370 32.370 32.728 -0.357 25281 50 1 . 1 1 14 14 ARG H H 14 8.520 8.520 8.544 -0.024 25281 51 1 . 1 1 15 15 VAL N N 15 115.890 115.890 120.762 -4.872 25281 52 1 . 1 1 15 15 VAL CA C 15 60.970 60.970 61.047 -0.077 25281 53 1 . 1 1 15 15 VAL CB C 15 34.320 34.320 35.621 -1.301 25281 54 1 . 1 1 15 15 VAL H H 15 8.440 8.440 8.119 0.321 25281 55 1 . 1 1 16 16 LYS N N 16 126.010 126.010 126.080 -0.071 25281 56 1 . 1 1 16 16 LYS CA C 16 55.120 55.120 55.997 -0.877 25281 57 1 . 1 1 16 16 LYS CB C 16 34.350 34.350 32.604 1.746 25281 58 1 . 1 1 16 16 LYS H H 16 8.850 8.850 8.594 0.256 25281 59 1 . 1 1 17 17 GLU N N 17 119.140 119.140 123.990 -4.850 25281 60 1 . 1 1 17 17 GLU CA C 17 54.460 54.460 55.005 -0.545 25281 61 1 . 1 1 17 17 GLU CB C 17 33.430 33.430 31.907 1.523 25281 62 1 . 1 1 17 17 GLU H H 17 8.030 8.030 8.466 -0.436 25281 63 1 . 1 1 18 18 ASP N N 18 120.280 120.280 120.581 -0.301 25281 64 1 . 1 1 18 18 ASP CA C 18 56.500 56.500 54.238 2.262 25281 65 1 . 1 1 18 18 ASP CB C 18 33.780 33.780 40.942 -7.162 25281 66 1 . 1 1 18 18 ASP H H 18 8.120 8.120 8.458 -0.338 25281 67 1 . 1 1 19 19 GLY N N 19 118.750 118.750 110.987 7.763 25281 68 1 . 1 1 19 19 GLY CA C 19 44.130 44.130 44.758 -0.627 25281 69 1 . 1 1 19 19 GLY H H 19 8.430 8.430 8.076 0.354 25281 70 1 . 1 1 20 20 TYR N N 20 117.080 117.080 123.791 -6.711 25281 71 1 . 1 1 20 20 TYR CA C 20 60.940 60.940 58.033 2.907 25281 72 1 . 1 1 20 20 TYR CB C 20 42.010 42.010 37.946 4.064 25281 73 1 . 1 1 20 20 TYR H H 20 8.610 8.610 8.606 0.004 25281 74 1 . 1 1 21 21 LYS N N 21 127.240 127.240 123.708 3.533 25281 75 1 . 1 1 21 21 LYS CA C 21 56.760 56.760 57.174 -0.414 25281 76 1 . 1 1 21 21 LYS CB C 21 29.100 29.100 32.545 -3.445 25281 77 1 . 1 1 21 21 LYS H H 21 7.970 7.970 8.598 -0.628 25281 78 1 . 1 1 22 22 LEU N N 22 122.270 122.270 120.948 1.322 25281 79 1 . 1 1 22 22 LEU CA C 22 59.170 59.170 57.395 1.775 25281 80 1 . 1 1 22 22 LEU CB C 22 40.030 40.030 41.664 -1.634 25281 81 1 . 1 1 22 22 LEU H H 22 8.370 8.370 8.010 0.360 25281 82 1 . 1 1 23 23 ASP N N 23 114.790 114.790 114.397 0.393 25281 83 1 . 1 1 23 23 ASP CA C 23 51.840 51.840 53.592 -1.752 25281 84 1 . 1 1 23 23 ASP CB C 23 37.730 37.730 41.160 -3.430 25281 85 1 . 1 1 23 23 ASP H H 23 8.210 8.210 8.217 -0.007 25281 86 1 . 1 1 24 24 LYS N N 24 115.470 115.470 114.748 0.722 25281 87 1 . 1 1 24 24 LYS CA C 24 58.860 58.860 57.735 1.125 25281 88 1 . 1 1 24 24 LYS CB C 24 28.330 28.330 30.471 -2.141 25281 89 1 . 1 1 24 24 LYS H H 24 9.230 9.230 7.894 1.336 25281 90 1 . 1 1 25 25 ASN N N 25 121.610 121.610 117.740 3.870 25281 91 1 . 1 1 25 25 ASN CA C 25 54.430 54.430 50.269 4.162 25281 92 1 . 1 1 25 25 ASN CB C 25 42.500 42.500 39.190 3.310 25281 93 1 . 1 1 25 25 ASN H H 25 8.150 8.150 7.977 0.173 25281 94 1 . 1 1 26 26 PRO CA C 26 63.340 63.340 62.660 0.680 25281 95 1 . 1 1 26 26 PRO CB C 26 30.940 30.940 33.303 -2.363 25281 96 1 . 1 1 27 27 ARG N N 27 120.730 120.730 118.319 2.411 25281 97 1 . 1 1 27 27 ARG CA C 27 54.340 54.340 55.007 -0.668 25281 98 1 . 1 1 27 27 ARG CB C 27 33.500 33.500 32.429 1.071 25281 99 1 . 1 1 27 27 ARG H H 27 8.290 8.290 8.241 0.049 25281 100 1 . 1 1 28 28 GLY N N 28 112.000 112.000 108.944 3.056 25281 101 1 . 1 1 28 28 GLY CA C 28 46.940 46.940 44.912 2.028 25281 102 1 . 1 1 28 28 GLY H H 28 8.810 8.810 7.864 0.946 25281 103 1 . 1 1 29 29 PHE N N 29 121.230 121.230 117.534 3.697 25281 104 1 . 1 1 29 29 PHE CA C 29 55.230 55.230 56.938 -1.708 25281 105 1 . 1 1 29 29 PHE CB C 29 43.700 43.700 43.192 0.508 25281 106 1 . 1 1 29 29 PHE H H 29 8.470 8.470 8.256 0.214 25281 107 1 . 1 1 30 30 ASN N N 30 117.250 117.250 121.102 -3.852 25281 108 1 . 1 1 30 30 ASN CA C 30 50.220 50.220 52.482 -2.262 25281 109 1 . 1 1 30 30 ASN CB C 30 45.810 45.810 41.154 4.656 25281 110 1 . 1 1 30 30 ASN H H 30 8.630 8.630 8.625 0.005 25281 111 1 . 1 1 31 31 LEU N N 31 128.180 128.180 126.396 1.784 25281 112 1 . 1 1 31 31 LEU CA C 31 53.930 53.930 53.809 0.121 25281 113 1 . 1 1 31 31 LEU CB C 31 45.810 45.810 45.031 0.779 25281 114 1 . 1 1 31 31 LEU H H 31 9.080 9.080 8.752 0.328 25281 115 1 . 1 1 32 32 LYS N N 32 119.980 119.980 121.903 -1.923 25281 116 1 . 1 1 32 32 LYS CA C 32 55.730 55.730 54.746 0.984 25281 117 1 . 1 1 32 32 LYS CB C 32 36.070 36.070 36.548 -0.478 25281 118 1 . 1 1 32 32 LYS H H 32 8.780 8.780 8.136 0.644 25281 119 1 . 1 1 33 33 TYR N N 33 121.500 121.500 121.055 0.445 25281 120 1 . 1 1 33 33 TYR CA C 33 55.830 55.830 56.673 -0.843 25281 121 1 . 1 1 33 33 TYR CB C 33 42.110 42.110 42.225 -0.115 25281 122 1 . 1 1 33 33 TYR H H 33 8.640 8.640 8.293 0.347 25281 123 1 . 1 1 34 34 ARG N N 34 128.980 128.980 123.666 5.314 25281 124 1 . 1 1 34 34 ARG CA C 34 52.690 52.690 54.598 -1.908 25281 125 1 . 1 1 34 34 ARG CB C 34 34.320 34.320 33.952 0.368 25281 126 1 . 1 1 34 34 ARG H H 34 8.830 8.830 8.286 0.544 25281 127 1 . 1 1 35 35 TYR N N 35 124.820 124.820 126.210 -1.390 25281 128 1 . 1 1 35 35 TYR CA C 35 56.640 56.640 56.873 -0.233 25281 129 1 . 1 1 35 35 TYR CB C 35 41.980 41.980 41.618 0.362 25281 130 1 . 1 1 35 35 TYR H H 35 8.840 8.840 8.158 0.682 25281 131 1 . 1 1 39 39 ASN N N 39 127.690 127.690 118.834 8.856 25281 132 1 . 1 1 39 39 ASN CA C 39 54.850 54.850 54.069 0.781 25281 133 1 . 1 1 39 39 ASN CB C 39 38.290 38.290 37.719 0.571 25281 134 1 . 1 1 39 39 ASN H H 39 7.990 7.990 8.655 -0.665 25281 135 1 . 1 1 40 40 ASP N N 40 115.200 115.200 117.796 -2.596 25281 136 1 . 1 1 40 40 ASP CA C 40 55.210 55.210 53.011 2.199 25281 137 1 . 1 1 40 40 ASP CB C 40 44.010 44.010 42.026 1.984 25281 138 1 . 1 1 40 40 ASP H H 40 8.370 8.370 7.729 0.641 25281 139 1 . 1 1 41 41 TRP N N 41 124.210 124.210 119.544 4.666 25281 140 1 . 1 1 41 41 TRP CA C 41 55.840 55.840 56.229 -0.389 25281 141 1 . 1 1 41 41 TRP CB C 41 33.540 33.540 30.368 3.172 25281 142 1 . 1 1 41 41 TRP H H 41 9.130 9.130 7.885 1.245 25281 143 1 . 1 1 42 42 GLY N N 42 107.800 107.800 108.046 -0.246 25281 144 1 . 1 1 42 42 GLY CA C 42 45.870 45.870 44.455 1.415 25281 145 1 . 1 1 42 42 GLY H H 42 8.610 8.610 8.125 0.485 25281 146 1 . 1 1 43 43 VAL N N 43 116.260 116.260 117.937 -1.677 25281 147 1 . 1 1 43 43 VAL CA C 43 58.980 58.980 60.488 -1.508 25281 148 1 . 1 1 43 43 VAL CB C 43 35.430 35.430 35.186 0.244 25281 149 1 . 1 1 43 43 VAL H H 43 8.880 8.880 7.833 1.047 25281 150 1 . 1 1 44 44 ILE N N 44 124.720 124.720 123.578 1.142 25281 151 1 . 1 1 44 44 ILE CA C 44 58.390 58.390 58.898 -0.508 25281 152 1 . 1 1 44 44 ILE CB C 44 42.890 42.890 41.646 1.244 25281 153 1 . 1 1 44 44 ILE H H 44 9.110 9.110 8.057 1.053 25281 154 1 . 1 1 45 45 GLY N N 45 110.610 110.610 112.175 -1.565 25281 155 1 . 1 1 45 45 GLY CA C 45 43.150 43.150 43.827 -0.677 25281 156 1 . 1 1 45 45 GLY H H 45 8.910 8.910 8.036 0.874 25281 157 1 . 1 1 46 46 SER N N 46 116.210 116.210 118.668 -2.458 25281 158 1 . 1 1 46 46 SER CA C 46 56.250 56.250 56.834 -0.584 25281 159 1 . 1 1 46 46 SER CB C 46 63.720 63.720 65.524 -1.804 25281 160 1 . 1 1 46 46 SER H H 46 9.250 9.250 8.554 0.696 25281 161 1 . 1 1 47 47 PHE N N 47 126.400 126.400 125.809 0.591 25281 162 1 . 1 1 47 47 PHE CA C 47 55.090 55.090 56.311 -1.221 25281 163 1 . 1 1 47 47 PHE CB C 47 42.560 42.560 42.826 -0.266 25281 164 1 . 1 1 47 47 PHE H H 47 8.940 8.940 8.914 0.026 25281 165 1 . 1 1 48 48 ALA N N 48 131.930 131.930 125.054 6.876 25281 166 1 . 1 1 48 48 ALA CA C 48 50.350 50.350 50.626 -0.276 25281 167 1 . 1 1 48 48 ALA CB C 48 21.280 21.280 23.049 -1.769 25281 168 1 . 1 1 48 48 ALA H H 48 8.790 8.790 8.373 0.417 25281 169 1 . 1 1 49 49 GLN N N 49 116.070 116.070 119.886 -3.816 25281 170 1 . 1 1 49 49 GLN CA C 49 54.110 54.110 54.566 -0.456 25281 171 1 . 1 1 49 49 GLN CB C 49 31.140 31.140 33.020 -1.880 25281 172 1 . 1 1 49 49 GLN H H 49 7.720 7.720 8.329 -0.609 25281 173 1 . 1 1 50 50 THR N N 50 115.990 115.990 114.941 1.049 25281 174 1 . 1 1 50 50 THR CA C 50 59.270 59.270 60.650 -1.380 25281 175 1 . 1 1 50 50 THR CB C 50 70.980 70.980 71.560 -0.581 25281 176 1 . 1 1 50 50 THR H H 50 9.470 9.470 8.698 0.772 25281 177 1 . 1 1 51 51 ARG N N 51 117.600 117.600 121.828 -4.228 25281 178 1 . 1 1 51 51 ARG CA C 51 55.350 55.350 54.687 0.663 25281 179 1 . 1 1 51 51 ARG CB C 51 33.610 33.610 33.456 0.154 25281 180 1 . 1 1 51 51 ARG H H 51 8.600 8.600 8.136 0.464 25281 181 1 . 1 1 52 52 ARG N N 52 121.400 121.400 123.869 -2.469 25281 182 1 . 1 1 52 52 ARG CA C 52 56.910 56.910 55.698 1.212 25281 183 1 . 1 1 52 52 ARG CB C 52 29.370 29.370 30.830 -1.460 25281 184 1 . 1 1 52 52 ARG H H 52 8.380 8.380 8.147 0.233 25281 185 1 . 1 1 53 53 GLY N N 53 111.040 111.040 113.679 -2.639 25281 186 1 . 1 1 53 53 GLY CA C 53 45.190 45.190 45.857 -0.667 25281 187 1 . 1 1 53 53 GLY H H 53 8.330 8.330 8.921 -0.591 25281 188 1 . 1 1 54 54 PHE N N 54 119.210 119.210 119.513 -0.303 25281 189 1 . 1 1 54 54 PHE CA C 54 55.670 55.670 57.462 -1.792 25281 190 1 . 1 1 54 54 PHE CB C 54 29.220 29.220 40.194 -10.974 25281 191 1 . 1 1 54 54 PHE H H 54 7.720 7.720 7.794 -0.074 25281 192 1 . 1 1 55 55 GLU N N 55 123.470 123.470 123.029 0.441 25281 193 1 . 1 1 55 55 GLU CA C 55 55.580 55.580 55.957 -0.377 25281 194 1 . 1 1 55 55 GLU CB C 55 32.920 32.920 30.962 1.958 25281 195 1 . 1 1 55 55 GLU H H 55 8.400 8.400 7.989 0.411 25281 196 1 . 1 1 56 56 GLU N N 56 121.950 121.950 122.963 -1.013 25281 197 1 . 1 1 56 56 GLU CA C 56 56.690 56.690 56.650 0.040 25281 198 1 . 1 1 56 56 GLU CB C 56 29.450 29.450 29.993 -0.543 25281 199 1 . 1 1 56 56 GLU H H 56 8.500 8.500 8.570 -0.070 25281 200 1 . 1 1 57 57 SER N N 57 123.330 123.330 119.982 3.348 25281 201 1 . 1 1 57 57 SER CA C 57 55.090 55.090 57.550 -2.461 25281 202 1 . 1 1 57 57 SER CB C 57 64.890 64.890 64.660 0.229 25281 203 1 . 1 1 57 57 SER H H 57 8.640 8.640 8.410 0.230 25281 204 1 . 1 1 58 58 VAL N N 58 122.060 122.060 122.585 -0.525 25281 205 1 . 1 1 58 58 VAL CA C 58 57.660 57.660 61.672 -4.012 25281 206 1 . 1 1 58 58 VAL CB C 58 31.640 31.640 34.163 -2.523 25281 207 1 . 1 1 58 58 VAL H H 58 8.480 8.480 8.401 0.079 25281 208 1 . 1 1 59 59 ASP N N 59 123.390 123.390 125.639 -2.249 25281 209 1 . 1 1 59 59 ASP CA C 59 54.960 54.960 54.077 0.883 25281 210 1 . 1 1 59 59 ASP CB C 59 42.840 42.840 41.773 1.067 25281 211 1 . 1 1 59 59 ASP H H 59 9.360 9.360 8.728 0.632 25281 212 1 . 1 1 60 60 GLY N N 60 105.230 105.230 107.163 -1.933 25281 213 1 . 1 1 60 60 GLY CA C 60 45.130 45.130 44.675 0.455 25281 214 1 . 1 1 60 60 GLY H H 60 8.210 8.210 7.576 0.634 25281 215 1 . 1 1 61 61 PHE N N 61 121.440 121.440 121.306 0.135 25281 216 1 . 1 1 61 61 PHE CA C 61 57.330 57.330 57.944 -0.614 25281 217 1 . 1 1 61 61 PHE CB C 61 39.420 39.420 38.983 0.437 25281 218 1 . 1 1 61 61 PHE H H 61 8.330 8.330 8.430 -0.100 25281 219 1 . 1 1 62 62 LYS N N 62 119.870 119.870 124.384 -4.514 25281 220 1 . 1 1 62 62 LYS CA C 62 56.340 56.340 54.654 1.686 25281 221 1 . 1 1 62 62 LYS CB C 62 33.850 33.850 35.431 -1.581 25281 222 1 . 1 1 62 62 LYS H H 62 8.480 8.480 8.039 0.441 25281 223 1 . 1 1 63 63 LEU N N 63 125.160 125.160 122.936 2.224 25281 224 1 . 1 1 63 63 LEU CA C 63 56.220 56.220 57.304 -1.084 25281 225 1 . 1 1 63 63 LEU CB C 63 41.520 41.520 41.623 -0.103 25281 226 1 . 1 1 63 63 LEU H H 63 8.910 8.910 8.688 0.222 25281 227 1 . 1 1 64 64 ILE N N 64 119.660 119.660 118.146 1.514 25281 228 1 . 1 1 64 64 ILE CA C 64 62.420 62.420 64.111 -1.691 25281 229 1 . 1 1 64 64 ILE CB C 64 37.700 37.700 37.072 0.628 25281 230 1 . 1 1 64 64 ILE H H 64 8.210 8.210 7.898 0.312 25281 231 1 . 1 1 65 65 ASP N N 65 117.080 117.080 119.748 -2.668 25281 232 1 . 1 1 65 65 ASP CA C 65 57.420 57.420 56.082 1.338 25281 233 1 . 1 1 65 65 ASP CB C 65 38.350 38.350 39.873 -1.523 25281 234 1 . 1 1 65 65 ASP H H 65 7.710 7.710 8.119 -0.409 25281 235 1 . 1 1 66 66 GLY N N 66 106.440 106.440 106.948 -0.508 25281 236 1 . 1 1 66 66 GLY CA C 66 45.170 45.170 45.245 -0.075 25281 237 1 . 1 1 66 66 GLY H H 66 7.920 7.920 7.549 0.371 25281 238 1 . 1 1 67 67 ASP N N 67 118.490 118.490 120.090 -1.600 25281 239 1 . 1 1 67 67 ASP CA C 67 57.340 57.340 55.577 1.763 25281 240 1 . 1 1 67 67 ASP CB C 67 29.870 29.870 40.856 -10.986 25281 241 1 . 1 1 67 67 ASP H H 67 7.820 7.820 7.766 0.054 25281 242 1 . 1 1 68 68 PHE N N 68 125.320 125.320 117.588 7.732 25281 243 1 . 1 1 68 68 PHE CA C 68 56.090 56.090 57.222 -1.132 25281 244 1 . 1 1 68 68 PHE CB C 68 41.940 41.940 42.311 -0.371 25281 245 1 . 1 1 68 68 PHE H H 68 8.310 8.310 8.267 0.043 25281 246 1 . 1 1 69 69 LYS N N 69 124.770 124.770 122.045 2.725 25281 247 1 . 1 1 69 69 LYS CA C 69 54.880 54.880 55.152 -0.272 25281 248 1 . 1 1 69 69 LYS CB C 69 36.920 36.920 35.905 1.015 25281 249 1 . 1 1 69 69 LYS H H 69 8.730 8.730 8.553 0.177 25281 250 1 . 1 1 70 70 TYR N N 70 123.740 123.740 126.466 -2.726 25281 251 1 . 1 1 70 70 TYR CA C 70 55.540 55.540 56.526 -0.986 25281 252 1 . 1 1 70 70 TYR CB C 70 40.150 40.150 42.116 -1.966 25281 253 1 . 1 1 70 70 TYR H H 70 8.680 8.680 8.298 0.382 25281 254 1 . 1 1 71 71 TYR N N 71 123.920 123.920 124.985 -1.065 25281 255 1 . 1 1 71 71 TYR CA C 71 54.500 54.500 55.737 -1.237 25281 256 1 . 1 1 71 71 TYR CB C 71 42.420 42.420 41.876 0.544 25281 257 1 . 1 1 71 71 TYR H H 71 8.620 8.620 8.029 0.591 25281 258 1 . 1 1 72 72 SER N N 72 113.820 113.820 115.561 -1.740 25281 259 1 . 1 1 72 72 SER CA C 72 56.320 56.320 57.155 -0.835 25281 260 1 . 1 1 72 72 SER CB C 72 65.790 65.790 66.463 -0.673 25281 261 1 . 1 1 72 72 SER H H 72 8.800 8.800 8.338 0.462 25281 262 1 . 1 1 73 73 VAL N N 73 119.260 119.260 121.059 -1.799 25281 263 1 . 1 1 73 73 VAL CA C 73 60.730 60.730 60.262 0.468 25281 264 1 . 1 1 73 73 VAL CB C 73 33.870 33.870 34.985 -1.115 25281 265 1 . 1 1 73 73 VAL H H 73 8.170 8.170 8.055 0.115 25281 266 1 . 1 1 74 74 THR N N 74 115.360 115.360 118.354 -2.994 25281 267 1 . 1 1 74 74 THR CA C 74 59.040 59.040 60.462 -1.422 25281 268 1 . 1 1 74 74 THR CB C 74 73.250 73.250 71.669 1.581 25281 269 1 . 1 1 74 74 THR H H 74 9.200 9.200 8.164 1.036 25281 270 1 . 1 1 75 75 ALA N N 75 119.330 119.330 124.539 -5.209 25281 271 1 . 1 1 75 75 ALA CA C 75 51.390 51.390 51.123 0.267 25281 272 1 . 1 1 75 75 ALA CB C 75 22.380 22.380 22.445 -0.065 25281 273 1 . 1 1 75 75 ALA H H 75 9.130 9.130 8.637 0.493 25281 274 1 . 1 1 76 76 GLY N N 76 103.130 103.130 106.273 -3.143 25281 275 1 . 1 1 76 76 GLY CA C 76 45.900 45.900 44.762 1.138 25281 276 1 . 1 1 76 76 GLY H H 76 8.760 8.760 7.984 0.776 25281 277 1 . 1 1 77 77 PRO CA C 77 61.250 61.250 62.447 -1.197 25281 278 1 . 1 1 77 77 PRO CB C 77 32.590 32.590 33.106 -0.516 25281 279 1 . 1 1 78 78 VAL N N 78 115.250 115.250 119.292 -4.042 25281 280 1 . 1 1 78 78 VAL CA C 78 58.430 58.430 61.111 -2.681 25281 281 1 . 1 1 78 78 VAL CB C 78 32.700 32.700 34.810 -2.110 25281 282 1 . 1 1 78 78 VAL H H 78 8.240 8.240 8.086 0.154 25281 283 1 . 1 1 79 79 PHE N N 79 130.610 130.610 126.550 4.060 25281 284 1 . 1 1 79 79 PHE CA C 79 55.090 55.090 56.059 -0.969 25281 285 1 . 1 1 79 79 PHE CB C 79 41.590 41.590 42.770 -1.180 25281 286 1 . 1 1 79 79 PHE H H 79 9.540 9.540 8.381 1.159 25281 287 1 . 1 1 80 80 ARG N N 80 130.350 130.350 124.939 5.411 25281 288 1 . 1 1 80 80 ARG CA C 80 55.490 55.490 56.318 -0.828 25281 289 1 . 1 1 80 80 ARG CB C 80 29.520 29.520 30.637 -1.117 25281 290 1 . 1 1 80 80 ARG H H 80 8.810 8.810 8.483 0.327 25281 291 1 . 1 1 81 81 ILE N N 81 127.480 127.480 124.989 2.491 25281 292 1 . 1 1 81 81 ILE CA C 81 62.850 62.850 62.295 0.555 25281 293 1 . 1 1 81 81 ILE CB C 81 37.650 37.650 38.844 -1.194 25281 294 1 . 1 1 81 81 ILE H H 81 8.260 8.260 9.023 -0.763 25281 295 1 . 1 1 82 82 ASN N N 82 113.110 113.110 116.496 -3.386 25281 296 1 . 1 1 82 82 ASN CA C 82 55.630 55.630 52.392 3.237 25281 297 1 . 1 1 82 82 ASN CB C 82 43.210 43.210 39.586 3.624 25281 298 1 . 1 1 82 82 ASN H H 82 7.970 7.970 7.717 0.253 25281 299 1 . 1 1 85 85 VAL N N 85 118.090 118.090 119.349 -1.259 25281 300 1 . 1 1 85 85 VAL CA C 85 61.120 61.120 61.055 0.065 25281 301 1 . 1 1 85 85 VAL CB C 85 34.910 34.910 35.071 -0.161 25281 302 1 . 1 1 85 85 VAL H H 85 7.840 7.840 7.433 0.407 25281 303 1 . 1 1 86 86 SER N N 86 119.050 119.050 121.502 -2.452 25281 304 1 . 1 1 86 86 SER CA C 86 57.100 57.100 56.912 0.188 25281 305 1 . 1 1 86 86 SER CB C 86 65.400 65.400 65.900 -0.500 25281 306 1 . 1 1 86 86 SER H H 86 8.240 8.240 8.156 0.084 25281 307 1 . 1 1 87 87 LEU N N 87 124.640 124.640 125.824 -1.185 25281 308 1 . 1 1 87 87 LEU CA C 87 53.750 53.750 54.106 -0.356 25281 309 1 . 1 1 87 87 LEU CB C 87 46.320 46.320 45.185 1.135 25281 310 1 . 1 1 87 87 LEU H H 87 9.130 9.130 8.161 0.969 25281 311 1 . 1 1 88 88 TYR N N 88 118.740 118.740 121.463 -2.723 25281 312 1 . 1 1 88 88 TYR CA C 88 55.080 55.080 55.878 -0.798 25281 313 1 . 1 1 88 88 TYR CB C 88 42.630 42.630 41.076 1.554 25281 314 1 . 1 1 88 88 TYR H H 88 8.740 8.740 7.911 0.829 25281 315 1 . 1 1 89 89 GLY N N 89 103.920 103.920 106.911 -2.991 25281 316 1 . 1 1 89 89 GLY CA C 89 43.250 43.250 43.435 -0.185 25281 317 1 . 1 1 89 89 GLY H H 89 7.720 7.720 8.316 -0.596 25281 318 1 . 1 1 90 90 LEU N N 90 117.530 117.530 121.708 -4.178 25281 319 1 . 1 1 90 90 LEU CA C 90 53.200 53.200 53.957 -0.757 25281 320 1 . 1 1 90 90 LEU CB C 90 45.810 45.810 44.808 1.002 25281 321 1 . 1 1 90 90 LEU H H 90 8.520 8.520 8.310 0.210 25281 322 1 . 1 1 91 91 LEU N N 91 120.670 120.670 120.838 -0.168 25281 323 1 . 1 1 91 91 LEU CA C 91 53.590 53.590 53.729 -0.139 25281 324 1 . 1 1 91 91 LEU CB C 91 46.330 46.330 45.692 0.638 25281 325 1 . 1 1 91 91 LEU H H 91 9.250 9.250 7.970 1.280 25281 326 1 . 1 1 92 92 GLY N N 92 108.770 108.770 109.736 -0.966 25281 327 1 . 1 1 92 92 GLY CA C 92 46.520 46.520 46.164 0.356 25281 328 1 . 1 1 92 92 GLY H H 92 8.480 8.480 8.482 -0.002 25281 329 1 . 1 1 93 93 ALA N N 93 126.760 126.760 120.779 5.981 25281 330 1 . 1 1 93 93 ALA CA C 93 49.890 49.890 51.184 -1.294 25281 331 1 . 1 1 93 93 ALA CB C 93 21.860 21.860 22.569 -0.709 25281 332 1 . 1 1 93 93 ALA H H 93 8.860 8.860 7.854 1.006 25281 333 1 . 1 1 94 94 GLY N N 94 107.510 107.510 106.754 0.756 25281 334 1 . 1 1 94 94 GLY CA C 94 42.760 42.760 44.165 -1.405 25281 335 1 . 1 1 94 94 GLY H H 94 8.880 8.880 8.106 0.774 25281 336 1 . 1 1 95 95 HIS N N 95 122.340 122.340 118.666 3.674 25281 337 1 . 1 1 95 95 HIS CA C 95 54.570 54.570 54.406 0.164 25281 338 1 . 1 1 95 95 HIS CB C 95 32.700 32.700 34.019 -1.319 25281 339 1 . 1 1 95 95 HIS H H 95 9.200 9.200 8.148 1.052 25281 340 1 . 1 1 96 96 GLY N N 96 112.170 112.170 107.817 4.353 25281 341 1 . 1 1 96 96 GLY CA C 96 43.150 43.150 44.349 -1.199 25281 342 1 . 1 1 96 96 GLY H H 96 8.620 8.620 8.353 0.267 25281 343 1 . 1 1 97 97 LYS N N 97 120.580 120.580 121.658 -1.078 25281 344 1 . 1 1 97 97 LYS CA C 97 54.890 54.890 54.998 -0.108 25281 345 1 . 1 1 97 97 LYS CB C 97 35.560 35.560 36.886 -1.326 25281 346 1 . 1 1 97 97 LYS H H 97 9.010 9.010 8.771 0.239 25281 347 1 . 1 1 98 98 ALA N N 98 126.740 126.740 125.298 1.442 25281 348 1 . 1 1 98 98 ALA CA C 98 50.020 50.020 50.892 -0.872 25281 349 1 . 1 1 98 98 ALA CB C 98 22.380 22.380 22.235 0.146 25281 350 1 . 1 1 98 98 ALA H H 98 9.120 9.120 8.483 0.637 25281 351 1 . 1 1 99 99 LYS N N 99 122.360 122.360 123.412 -1.052 25281 352 1 . 1 1 99 99 LYS CA C 99 55.090 55.090 55.410 -0.320 25281 353 1 . 1 1 99 99 LYS CB C 99 34.970 34.970 35.542 -0.571 25281 354 1 . 1 1 99 99 LYS H H 99 8.580 8.580 8.471 0.109 25281 355 1 . 1 1 100 100 PHE N N 100 121.170 121.170 123.524 -2.355 25281 356 1 . 1 1 100 100 PHE CA C 100 56.390 56.390 56.783 -0.393 25281 357 1 . 1 1 100 100 PHE CB C 100 42.110 42.110 39.915 2.195 25281 358 1 . 1 1 100 100 PHE H H 100 8.750 8.750 8.401 0.349 25281 359 1 . 1 1 101 101 SER N N 101 117.280 117.280 115.307 1.973 25281 360 1 . 1 1 101 101 SER CA C 101 57.070 57.070 56.990 0.080 25281 361 1 . 1 1 101 101 SER CB C 101 65.830 65.830 64.798 1.032 25281 362 1 . 1 1 101 101 SER H H 101 8.990 8.990 7.938 1.052 25281 363 1 . 1 1 102 102 SER N N 102 117.600 117.600 116.398 1.202 25281 364 1 . 1 1 102 102 SER CA C 102 56.500 56.500 58.138 -1.638 25281 365 1 . 1 1 102 102 SER CB C 102 67.540 67.540 63.367 4.173 25281 366 1 . 1 1 102 102 SER H H 102 8.680 8.680 8.320 0.360 25281 367 1 . 1 1 103 103 ILE N N 103 114.980 114.980 122.402 -7.422 25281 368 1 . 1 1 103 103 ILE CA C 103 59.180 59.180 59.956 -0.776 25281 369 1 . 1 1 103 103 ILE CB C 103 40.550 40.550 40.372 0.178 25281 370 1 . 1 1 103 103 ILE H H 103 7.700 7.700 8.135 -0.435 25281 371 1 . 1 1 104 104 PHE N N 104 123.710 123.710 122.186 1.524 25281 372 1 . 1 1 104 104 PHE CA C 104 53.190 53.190 57.878 -4.688 25281 373 1 . 1 1 104 104 PHE CB C 104 43.900 43.900 39.515 4.385 25281 374 1 . 1 1 104 104 PHE H H 104 8.590 8.590 8.600 -0.010 25281 375 1 . 1 1 105 105 GLY N N 105 109.080 109.080 111.918 -2.838 25281 376 1 . 1 1 105 105 GLY CA C 105 45.420 45.420 44.364 1.056 25281 377 1 . 1 1 105 105 GLY H H 105 8.400 8.400 8.296 0.104 25281 378 1 . 1 1 106 106 GLN N N 106 119.680 119.680 120.097 -0.417 25281 379 1 . 1 1 106 106 GLN CA C 106 53.720 53.720 55.509 -1.789 25281 380 1 . 1 1 106 106 GLN CB C 106 30.100 30.100 29.698 0.403 25281 381 1 . 1 1 106 106 GLN H H 106 8.530 8.530 8.297 0.233 25281 382 1 . 1 1 107 107 SER N N 107 119.160 119.160 117.716 1.445 25281 383 1 . 1 1 107 107 SER CA C 107 57.360 57.360 57.692 -0.332 25281 384 1 . 1 1 107 107 SER CB C 107 66.050 66.050 64.013 2.037 25281 385 1 . 1 1 107 107 SER H H 107 8.800 8.800 8.323 0.477 25281 386 1 . 1 1 108 108 GLU N N 108 125.360 125.360 120.674 4.686 25281 387 1 . 1 1 108 108 GLU CA C 108 58.910 58.910 55.523 3.387 25281 388 1 . 1 1 108 108 GLU CB C 108 40.880 40.880 32.374 8.506 25281 389 1 . 1 1 108 108 GLU H H 108 8.960 8.960 8.131 0.829 25281 390 1 . 1 1 109 109 SER N N 109 118.890 118.890 116.675 2.215 25281 391 1 . 1 1 109 109 SER CA C 109 56.710 56.710 57.467 -0.757 25281 392 1 . 1 1 109 109 SER CB C 109 66.180 66.180 65.274 0.906 25281 393 1 . 1 1 109 109 SER H H 109 9.080 9.080 8.432 0.648 25281 394 1 . 1 1 110 110 ARG N N 110 119.830 119.830 123.426 -3.596 25281 395 1 . 1 1 110 110 ARG CA C 110 58.390 58.390 55.328 3.062 25281 396 1 . 1 1 110 110 ARG CB C 110 40.940 40.940 33.917 7.023 25281 397 1 . 1 1 110 110 ARG H H 110 8.850 8.850 8.426 0.424 25281 398 1 . 1 1 111 111 SER N N 111 114.870 114.870 116.585 -1.715 25281 399 1 . 1 1 111 111 SER CA C 111 57.290 57.290 57.089 0.201 25281 400 1 . 1 1 111 111 SER CB C 111 66.110 66.110 66.221 -0.111 25281 401 1 . 1 1 111 111 SER H H 111 8.740 8.740 8.489 0.251 25281 402 1 . 1 1 112 112 LYS N N 112 120.870 120.870 122.100 -1.230 25281 403 1 . 1 1 112 112 LYS CA C 112 55.150 55.150 55.417 -0.267 25281 404 1 . 1 1 112 112 LYS CB C 112 36.330 36.330 35.869 0.461 25281 405 1 . 1 1 112 112 LYS H H 112 8.520 8.520 8.490 0.030 25281 406 1 . 1 1 113 113 THR N N 113 121.390 121.390 116.840 4.550 25281 407 1 . 1 1 113 113 THR CA C 113 61.250 61.250 61.244 0.006 25281 408 1 . 1 1 113 113 THR CB C 113 70.010 70.010 70.381 -0.371 25281 409 1 . 1 1 113 113 THR H H 113 8.440 8.440 8.463 -0.024 25281 410 1 . 1 1 114 114 SER N N 114 120.730 120.730 119.835 0.895 25281 411 1 . 1 1 114 114 SER CA C 114 56.190 56.190 57.243 -1.053 25281 412 1 . 1 1 114 114 SER CB C 114 66.380 66.380 65.412 0.968 25281 413 1 . 1 1 114 114 SER H H 114 9.350 9.350 8.283 1.067 25281 414 1 . 1 1 115 115 LEU N N 115 121.540 121.540 122.944 -1.404 25281 415 1 . 1 1 115 115 LEU CA C 115 55.480 55.480 54.232 1.248 25281 416 1 . 1 1 115 115 LEU CB C 115 42.890 42.890 44.437 -1.547 25281 417 1 . 1 1 115 115 LEU H H 115 8.200 8.200 8.711 -0.511 25281 418 1 . 1 1 116 116 ALA N N 116 129.060 129.060 124.312 4.748 25281 419 1 . 1 1 116 116 ALA CA C 116 49.960 49.960 50.291 -0.331 25281 420 1 . 1 1 116 116 ALA CB C 116 20.310 20.310 22.317 -2.007 25281 421 1 . 1 1 116 116 ALA H H 116 8.600 8.600 8.557 0.043 25281 422 1 . 1 1 117 117 TYR N N 117 115.890 115.890 122.556 -6.666 25281 423 1 . 1 1 117 117 TYR CA C 117 55.150 55.150 56.775 -1.625 25281 424 1 . 1 1 117 117 TYR CB C 117 41.200 41.200 41.828 -0.629 25281 425 1 . 1 1 117 117 TYR H H 117 8.450 8.450 7.915 0.535 25281 426 1 . 1 1 118 118 GLY N N 118 107.330 107.330 109.098 -1.768 25281 427 1 . 1 1 118 118 GLY CA C 118 45.940 45.940 45.390 0.550 25281 428 1 . 1 1 118 118 GLY H H 118 9.340 9.340 7.876 1.465 25281 429 1 . 1 1 119 119 ALA N N 119 118.880 118.880 119.606 -0.726 25281 430 1 . 1 1 119 119 ALA CA C 119 51.320 51.320 50.817 0.503 25281 431 1 . 1 1 119 119 ALA CB C 119 22.120 22.120 22.297 -0.177 25281 432 1 . 1 1 119 119 ALA H H 119 8.770 8.770 7.045 1.725 25281 433 1 . 1 1 120 120 GLY N N 120 105.730 105.730 105.556 0.174 25281 434 1 . 1 1 120 120 GLY CA C 120 45.650 45.650 44.508 1.142 25281 435 1 . 1 1 120 120 GLY H H 120 7.940 7.940 7.508 0.432 25281 436 1 . 1 1 121 121 LEU N N 121 115.480 115.480 117.883 -2.403 25281 437 1 . 1 1 121 121 LEU CA C 121 52.980 52.980 53.630 -0.650 25281 438 1 . 1 1 121 121 LEU CB C 121 46.460 46.460 45.870 0.589 25281 439 1 . 1 1 121 121 LEU H H 121 9.010 9.010 8.199 0.811 25281 440 1 . 1 1 122 122 GLN N N 122 112.530 112.530 120.547 -8.017 25281 441 1 . 1 1 122 122 GLN CA C 122 54.780 54.780 54.408 0.372 25281 442 1 . 1 1 122 122 GLN CB C 122 31.400 31.400 32.746 -1.346 25281 443 1 . 1 1 122 122 GLN H H 122 8.090 8.090 8.163 -0.073 25281 444 1 . 1 1 123 123 PHE N N 123 126.050 126.050 124.327 1.723 25281 445 1 . 1 1 123 123 PHE CA C 123 54.180 54.180 56.255 -2.075 25281 446 1 . 1 1 123 123 PHE CB C 123 42.560 42.560 42.372 0.188 25281 447 1 . 1 1 123 123 PHE H H 123 10.020 10.020 8.711 1.309 25281 448 1 . 1 1 124 124 ASN N N 124 121.910 121.910 121.192 0.718 25281 449 1 . 1 1 124 124 ASN CA C 124 50.940 50.940 50.109 0.830 25281 450 1 . 1 1 124 124 ASN CB C 124 40.360 40.360 39.725 0.635 25281 451 1 . 1 1 124 124 ASN H H 124 9.520 9.520 8.390 1.130 25281 452 1 . 1 1 125 125 PRO CA C 125 63.390 63.390 62.715 0.674 25281 453 1 . 1 1 125 125 PRO CB C 125 31.210 31.210 32.314 -1.104 25281 454 1 . 1 1 126 126 HIS N N 126 116.830 116.830 118.392 -1.562 25281 455 1 . 1 1 126 126 HIS CA C 126 54.110 54.110 56.960 -2.850 25281 456 1 . 1 1 126 126 HIS CB C 126 34.910 34.910 28.922 5.988 25281 457 1 . 1 1 126 126 HIS H H 126 7.630 7.630 8.275 -0.645 25281 458 1 . 1 1 127 127 PRO CA C 127 65.370 65.370 63.790 1.580 25281 459 1 . 1 1 127 127 PRO CB C 127 31.030 31.030 31.109 -0.079 25281 460 1 . 1 1 128 128 ASN N N 128 114.680 114.680 116.987 -2.307 25281 461 1 . 1 1 128 128 ASN CA C 128 53.990 53.990 53.727 0.263 25281 462 1 . 1 1 128 128 ASN CB C 128 40.550 40.550 40.091 0.459 25281 463 1 . 1 1 128 128 ASN H H 128 10.460 10.460 8.357 2.103 25281 464 1 . 1 1 129 129 PHE N N 129 119.630 119.630 117.377 2.253 25281 465 1 . 1 1 129 129 PHE CA C 129 56.530 56.530 57.165 -0.636 25281 466 1 . 1 1 129 129 PHE CB C 129 44.310 44.310 42.624 1.686 25281 467 1 . 1 1 129 129 PHE H H 129 8.340 8.340 7.553 0.787 25281 468 1 . 1 1 130 130 VAL N N 130 123.000 123.000 119.868 3.132 25281 469 1 . 1 1 130 130 VAL CA C 130 60.340 60.340 61.224 -0.884 25281 470 1 . 1 1 130 130 VAL CB C 130 34.970 34.970 35.331 -0.361 25281 471 1 . 1 1 130 130 VAL H H 130 7.820 7.820 8.823 -1.002 25281 472 1 . 1 1 131 131 ILE N N 131 124.470 124.470 127.036 -2.567 25281 473 1 . 1 1 131 131 ILE CA C 131 60.210 60.210 59.847 0.363 25281 474 1 . 1 1 131 131 ILE CB C 131 39.510 39.510 40.661 -1.151 25281 475 1 . 1 1 131 131 ILE H H 131 8.830 8.830 8.664 0.166 25281 476 1 . 1 1 132 132 ASP N N 132 130.700 130.700 128.759 1.941 25281 477 1 . 1 1 132 132 ASP CA C 132 53.530 53.530 53.023 0.507 25281 478 1 . 1 1 132 132 ASP CB C 132 47.620 47.620 44.393 3.227 25281 479 1 . 1 1 132 132 ASP H H 132 9.040 9.040 8.449 0.591 25281 480 1 . 1 1 133 133 ALA N N 133 126.900 126.900 126.912 -0.012 25281 481 1 . 1 1 133 133 ALA CA C 133 51.390 51.390 50.716 0.673 25281 482 1 . 1 1 133 133 ALA CB C 133 21.730 21.730 22.433 -0.703 25281 483 1 . 1 1 133 133 ALA H H 133 8.800 8.800 8.255 0.545 25281 484 1 . 1 1 134 134 SER N N 134 113.760 113.760 117.555 -3.795 25281 485 1 . 1 1 134 134 SER CA C 134 58.140 58.140 57.297 0.843 25281 486 1 . 1 1 134 134 SER CB C 134 67.020 67.020 66.214 0.806 25281 487 1 . 1 1 134 134 SER H H 134 9.160 9.160 8.378 0.782 25281 488 1 . 1 1 135 135 TYR N N 135 118.500 118.500 117.546 0.954 25281 489 1 . 1 1 135 135 TYR CA C 135 55.690 55.690 56.072 -0.382 25281 490 1 . 1 1 135 135 TYR CB C 135 43.150 43.150 41.342 1.809 25281 491 1 . 1 1 135 135 TYR H H 135 8.820 8.820 7.828 0.992 25281 492 1 . 1 1 136 136 GLU N N 136 126.290 126.290 119.011 7.279 25281 493 1 . 1 1 136 136 GLU CA C 136 53.530 53.530 54.888 -1.358 25281 494 1 . 1 1 136 136 GLU CB C 136 34.450 34.450 34.184 0.266 25281 495 1 . 1 1 136 136 GLU H H 136 8.380 8.380 8.707 -0.327 25281 496 1 . 1 1 137 137 TYR N N 137 123.630 123.630 119.881 3.749 25281 497 1 . 1 1 137 137 TYR CA C 137 55.670 55.670 56.355 -0.685 25281 498 1 . 1 1 137 137 TYR CB C 137 43.150 43.150 42.086 1.064 25281 499 1 . 1 1 137 137 TYR H H 137 9.300 9.300 8.453 0.847 25281 500 1 . 1 1 138 138 SER N N 138 118.300 118.300 116.920 1.380 25281 501 1 . 1 1 138 138 SER CA C 138 58.270 58.270 56.511 1.759 25281 502 1 . 1 1 138 138 SER CB C 138 67.090 67.090 65.772 1.318 25281 503 1 . 1 1 138 138 SER H H 138 7.980 7.980 8.696 -0.716 25281 504 1 . 1 1 139 139 LYS N N 139 127.450 127.450 126.839 0.611 25281 505 1 . 1 1 139 139 LYS CA C 139 55.160 55.160 55.817 -0.657 25281 506 1 . 1 1 139 139 LYS CB C 139 32.640 32.640 33.237 -0.597 25281 507 1 . 1 1 139 139 LYS H H 139 8.630 8.630 8.410 0.220 25281 508 1 . 1 1 140 140 LEU N N 140 129.650 129.650 127.350 2.300 25281 509 1 . 1 1 140 140 LEU CA C 140 52.500 52.500 53.561 -1.061 25281 510 1 . 1 1 140 140 LEU CB C 140 40.000 40.000 44.718 -4.718 25281 511 1 . 1 1 140 140 LEU H H 140 9.060 9.060 8.053 1.007 25281 512 1 . 1 1 141 141 ASP N N 141 121.470 121.470 123.301 -1.831 25281 513 1 . 1 1 141 141 ASP CA C 141 57.190 57.190 56.734 0.456 25281 514 1 . 1 1 141 141 ASP CB C 141 39.730 39.730 40.836 -1.106 25281 515 1 . 1 1 141 141 ASP H H 141 8.590 8.590 8.698 -0.108 25281 516 1 . 1 1 142 142 ASP N N 142 121.510 121.510 118.864 2.646 25281 517 1 . 1 1 142 142 ASP CA C 142 55.180 55.180 55.244 -0.064 25281 518 1 . 1 1 142 142 ASP CB C 142 41.090 41.090 41.376 -0.285 25281 519 1 . 1 1 142 142 ASP H H 142 8.430 8.430 8.390 0.040 25281 520 1 . 1 1 143 143 VAL N N 143 121.420 121.420 114.337 7.084 25281 521 1 . 1 1 143 143 VAL CA C 143 62.240 62.240 60.399 1.841 25281 522 1 . 1 1 143 143 VAL CB C 143 31.280 31.280 34.861 -3.581 25281 523 1 . 1 1 143 143 VAL H H 143 8.020 8.020 7.532 0.488 25281 524 1 . 1 1 144 144 LYS N N 144 127.950 127.950 123.723 4.227 25281 525 1 . 1 1 144 144 LYS CA C 144 55.440 55.440 55.543 -0.103 25281 526 1 . 1 1 144 144 LYS CB C 144 32.640 32.640 33.718 -1.078 25281 527 1 . 1 1 144 144 LYS H H 144 8.660 8.660 8.374 0.286 25281 528 1 . 1 1 145 145 VAL N N 145 124.120 124.120 124.980 -0.860 25281 529 1 . 1 1 145 145 VAL CA C 145 55.910 55.910 60.023 -4.113 25281 530 1 . 1 1 145 145 VAL CB C 145 32.570 32.570 34.658 -2.088 25281 531 1 . 1 1 145 145 VAL H H 145 8.720 8.720 7.796 0.923 25281 532 1 . 1 1 146 146 GLY N N 146 116.240 116.240 114.713 1.527 25281 533 1 . 1 1 146 146 GLY CA C 146 44.080 44.080 44.170 -0.090 25281 534 1 . 1 1 146 146 GLY H H 146 8.400 8.400 8.476 -0.076 25281 535 1 . 1 1 147 147 THR N N 147 124.620 124.620 119.085 5.535 25281 536 1 . 1 1 147 147 THR CA C 147 61.450 61.450 60.926 0.524 25281 537 1 . 1 1 147 147 THR CB C 147 70.260 70.260 71.195 -0.935 25281 538 1 . 1 1 147 147 THR H H 147 9.080 9.080 8.747 0.334 25281 539 1 . 1 1 148 148 TRP N N 148 124.790 124.790 126.723 -1.933 25281 540 1 . 1 1 148 148 TRP CA C 148 54.770 54.770 56.175 -1.405 25281 541 1 . 1 1 148 148 TRP CB C 148 33.090 33.090 32.962 0.128 25281 542 1 . 1 1 148 148 TRP H H 148 8.510 8.510 9.008 -0.498 25281 543 1 . 1 1 149 149 MET N N 149 118.880 118.880 121.274 -2.394 25281 544 1 . 1 1 149 149 MET CA C 149 54.540 54.540 54.459 0.081 25281 545 1 . 1 1 149 149 MET CB C 149 34.640 34.640 35.897 -1.257 25281 546 1 . 1 1 149 149 MET H H 149 9.150 9.150 8.931 0.219 25281 547 1 . 1 1 150 150 LEU N N 150 122.830 122.830 124.140 -1.310 25281 548 1 . 1 1 150 150 LEU CA C 150 54.100 54.100 53.943 0.157 25281 549 1 . 1 1 150 150 LEU CB C 150 45.800 45.800 45.662 0.138 25281 550 1 . 1 1 150 150 LEU H H 150 8.480 8.480 8.132 0.348 25281 551 1 . 1 1 151 151 GLY N N 151 112.730 112.730 110.641 2.089 25281 552 1 . 1 1 151 151 GLY CA C 151 45.940 45.940 45.791 0.149 25281 553 1 . 1 1 151 151 GLY H H 151 9.820 9.820 8.178 1.641 25281 554 1 . 1 1 152 152 ALA N N 152 119.460 119.460 120.086 -0.626 25281 555 1 . 1 1 152 152 ALA CA C 152 49.760 49.760 50.702 -0.942 25281 556 1 . 1 1 152 152 ALA CB C 152 22.700 22.700 22.882 -0.182 25281 557 1 . 1 1 152 152 ALA H H 152 8.840 8.840 8.274 0.566 25281 558 1 . 1 1 153 153 GLY N N 153 104.360 104.360 106.751 -2.391 25281 559 1 . 1 1 153 153 GLY CA C 153 46.440 46.440 44.469 1.971 25281 560 1 . 1 1 153 153 GLY H H 153 8.540 8.540 8.586 -0.046 25281 561 1 . 1 1 154 154 TYR N N 154 120.680 120.680 117.003 3.677 25281 562 1 . 1 1 154 154 TYR CA C 154 55.370 55.370 56.173 -0.803 25281 563 1 . 1 1 154 154 TYR CB C 154 44.250 44.250 41.783 2.467 25281 564 1 . 1 1 154 154 TYR H H 154 8.310 8.310 7.830 0.480 25281 565 1 . 1 1 155 155 ARG N N 155 127.050 127.050 123.999 3.051 25281 566 1 . 1 1 155 155 ARG CA C 155 53.480 53.480 55.419 -1.939 25281 567 1 . 1 1 155 155 ARG CB C 155 32.160 32.160 30.905 1.255 25281 568 1 . 1 1 155 155 ARG H H 155 7.640 7.640 8.363 -0.723 25281 stop_ save_