data_18769 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18769 _Entry.PDB_ID 2LZQ 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 18769 _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 SER HA H 2 4.611 4.611 4.673 -0.062 18769 2 1 1 . 1 1 2 2 SER CA C 2 58.466 58.466 57.827 0.639 18769 3 1 1 . 1 1 2 2 SER CB C 2 65.003 65.003 64.939 0.064 18769 4 1 1 . 1 1 2 2 SER H H 2 8.606 8.606 8.189 0.417 18769 5 1 1 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.330 0.024 18769 6 1 1 . 1 1 3 3 ALA CA C 3 54.477 54.477 54.417 0.060 18769 7 1 1 . 1 1 3 3 ALA CB C 3 19.356 19.356 18.719 0.637 18769 8 1 1 . 1 1 3 3 ALA H H 3 8.654 8.654 8.477 0.177 18769 9 1 1 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.640 -0.370 18769 10 1 1 . 1 1 4 4 LEU CA C 4 57.815 57.815 56.200 1.615 18769 11 1 1 . 1 1 4 4 LEU CB C 4 43.003 43.003 41.738 1.265 18769 12 1 1 . 1 1 4 4 LEU H H 4 7.954 7.954 8.053 -0.099 18769 13 1 1 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.102 -0.223 18769 14 1 1 . 1 1 5 5 VAL CA C 5 65.477 65.477 65.239 0.238 18769 15 1 1 . 1 1 5 5 VAL CB C 5 33.015 33.015 32.998 0.017 18769 16 1 1 . 1 1 5 5 VAL H H 5 7.494 7.494 7.601 -0.107 18769 17 1 1 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.525 0.109 18769 18 1 1 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.397 -0.311 18769 19 1 1 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.211 0.797 18769 20 1 1 . 1 1 6 6 ASN H H 6 7.994 7.994 7.984 0.011 18769 21 1 1 . 1 1 7 7 SER HA H 7 4.429 4.429 4.419 0.010 18769 22 1 1 . 1 1 7 7 SER CA C 7 62.214 62.214 62.264 -0.050 18769 23 1 1 . 1 1 7 7 SER CB C 7 64.026 64.026 63.027 0.999 18769 24 1 1 . 1 1 7 7 SER H H 7 8.222 8.222 8.232 -0.010 18769 25 1 1 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.457 -0.027 18769 26 1 1 . 1 1 8 8 TYR CA C 8 61.958 61.958 60.487 1.471 18769 27 1 1 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.218 0.722 18769 28 1 1 . 1 1 8 8 TYR H H 8 8.191 8.191 8.407 -0.216 18769 29 1 1 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.648 0.410 18769 30 1 1 . 1 1 9 9 LEU CA C 9 58.791 58.791 58.130 0.661 18769 31 1 1 . 1 1 9 9 LEU CB C 9 42.528 42.528 40.898 1.630 18769 32 1 1 . 1 1 9 9 LEU H H 9 8.306 8.306 8.370 -0.064 18769 33 1 1 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.400 0.210 18769 34 1 1 . 1 1 10 10 TRP CA C 10 61.451 61.451 61.274 0.177 18769 35 1 1 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.395 0.648 18769 36 1 1 . 1 1 10 10 TRP H H 10 8.281 8.281 8.783 -0.502 18769 37 1 1 . 1 1 11 11 GLN HA H 11 3.999 3.999 2.995 1.004 18769 38 1 1 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.117 0.966 18769 39 1 1 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.297 1.133 18769 40 1 1 . 1 1 11 11 GLN H H 11 8.275 8.275 8.686 -0.411 18769 41 1 1 . 1 1 12 12 ARG HA H 12 4.072 4.072 4.011 0.061 18769 42 1 1 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.180 0.675 18769 43 1 1 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.959 0.329 18769 44 1 1 . 1 1 12 12 ARG H H 12 8.158 8.158 7.825 0.333 18769 45 1 1 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.376 0.037 18769 46 1 1 . 1 1 13 13 TRP CA C 13 62.193 62.193 60.212 1.982 18769 47 1 1 . 1 1 13 13 TRP CB C 13 29.421 29.421 28.985 0.436 18769 48 1 1 . 1 1 13 13 TRP H H 13 8.425 8.425 7.664 0.761 18769 49 1 1 . 1 1 14 14 GLU HA H 14 3.698 3.698 2.709 0.989 18769 50 1 1 . 1 1 14 14 GLU CA C 14 59.978 59.978 58.911 1.067 18769 51 1 1 . 1 1 14 14 GLU CB C 14 28.680 28.680 28.765 -0.085 18769 52 1 1 . 1 1 14 14 GLU H H 14 8.774 8.774 7.265 1.509 18769 53 1 1 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.452 0.043 18769 54 1 1 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.800 0.766 18769 55 1 1 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.574 1.454 18769 56 1 1 . 1 1 15 15 ASN H H 15 8.059 8.059 8.242 -0.183 18769 57 1 1 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.270 -0.032 18769 58 1 1 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.892 1.353 18769 59 1 1 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.348 -0.157 18769 60 1 1 . 1 1 16 16 TRP H H 16 8.071 8.071 8.120 -0.049 18769 61 1 1 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.039 0.407 18769 62 1 1 . 1 1 17 17 PHE CA C 17 62.026 62.026 60.928 1.098 18769 63 1 1 . 1 1 17 17 PHE CB C 17 39.605 39.605 37.959 1.646 18769 64 1 1 . 1 1 17 17 PHE H H 17 8.768 8.768 7.837 0.931 18769 65 1 1 . 1 1 18 18 TRP HA H 18 4.223 4.223 3.617 0.606 18769 66 1 1 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.967 0.848 18769 67 1 1 . 1 1 18 18 TRP CB C 18 29.900 29.900 28.829 1.071 18769 68 1 1 . 1 1 18 18 TRP H H 18 8.456 8.456 8.377 0.079 18769 69 1 1 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.297 0.034 18769 70 1 1 . 1 1 19 19 ASN CA C 19 57.260 57.260 57.122 0.138 18769 71 1 1 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.525 1.504 18769 72 1 1 . 1 1 19 19 ASN H H 19 7.768 7.768 8.247 -0.479 18769 73 1 1 . 1 1 20 20 VAL HA H 20 3.728 3.728 3.945 -0.217 18769 74 1 1 . 1 1 20 20 VAL CA C 20 65.593 65.593 65.162 0.432 18769 75 1 1 . 1 1 20 20 VAL CB C 20 32.363 32.363 31.588 0.775 18769 76 1 1 . 1 1 20 20 VAL H H 20 7.983 7.983 7.413 0.570 18769 77 1 1 . 1 1 21 21 THR HA H 21 3.886 3.886 3.952 -0.066 18769 78 1 1 . 1 1 21 21 THR CA C 21 65.003 65.003 65.445 -0.442 18769 79 1 1 . 1 1 21 21 THR CB C 21 69.837 69.837 68.661 1.176 18769 80 1 1 . 1 1 21 21 THR H H 21 7.523 7.523 7.443 0.080 18769 81 1 1 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.216 0.095 18769 82 1 1 . 1 1 22 22 LEU CA C 22 56.094 56.094 55.965 0.129 18769 83 1 1 . 1 1 22 22 LEU CB C 22 42.641 42.641 42.604 0.037 18769 84 1 1 . 1 1 22 22 LEU H H 22 7.598 7.598 8.127 -0.529 18769 85 1 1 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.078 0.292 18769 86 1 1 . 1 1 23 23 ARG CA C 23 56.977 56.977 55.960 1.017 18769 87 1 1 . 1 1 23 23 ARG CB C 23 30.139 30.139 28.341 1.798 18769 88 1 1 . 1 1 23 23 ARG H H 23 7.480 7.480 7.643 -0.163 18769 89 1 1 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.582 -0.191 18769 90 1 1 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.729 2.307 18769 91 1 1 . 1 1 24 24 PRO CB C 24 32.233 32.233 30.703 1.530 18769 92 1 1 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.471 -0.119 18769 93 1 1 . 1 1 25 25 GLU CA C 25 57.150 57.150 55.498 1.652 18769 94 1 1 . 1 1 25 25 GLU CB C 25 29.234 29.234 31.119 -1.885 18769 95 1 1 . 1 1 25 25 GLU H H 25 8.002 8.002 8.151 -0.149 18769 96 1 2 . 1 1 2 2 SER HA H 2 4.611 4.611 4.219 0.392 18769 97 1 2 . 1 1 2 2 SER CA C 2 58.466 58.466 58.911 -0.445 18769 98 1 2 . 1 1 2 2 SER CB C 2 65.003 65.003 63.508 1.495 18769 99 1 2 . 1 1 2 2 SER H H 2 8.606 8.606 8.352 0.254 18769 100 1 2 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.446 -0.092 18769 101 1 2 . 1 1 3 3 ALA CA C 3 54.477 54.477 53.163 1.314 18769 102 1 2 . 1 1 3 3 ALA CB C 3 19.356 19.356 19.054 0.302 18769 103 1 2 . 1 1 3 3 ALA H H 3 8.654 8.654 8.339 0.315 18769 104 1 2 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.376 -0.106 18769 105 1 2 . 1 1 4 4 LEU CA C 4 57.815 57.815 55.548 2.267 18769 106 1 2 . 1 1 4 4 LEU CB C 4 43.003 43.003 41.930 1.073 18769 107 1 2 . 1 1 4 4 LEU H H 4 7.954 7.954 8.038 -0.084 18769 108 1 2 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.205 -0.326 18769 109 1 2 . 1 1 5 5 VAL CA C 5 65.477 65.477 63.968 1.509 18769 110 1 2 . 1 1 5 5 VAL CB C 5 33.015 33.015 32.946 0.069 18769 111 1 2 . 1 1 5 5 VAL H H 5 7.494 7.494 7.654 -0.160 18769 112 1 2 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.545 0.089 18769 113 1 2 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.884 -0.798 18769 114 1 2 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.589 0.419 18769 115 1 2 . 1 1 6 6 ASN H H 6 7.994 7.994 8.311 -0.317 18769 116 1 2 . 1 1 7 7 SER HA H 7 4.429 4.429 4.347 0.082 18769 117 1 2 . 1 1 7 7 SER CA C 7 62.214 62.214 62.302 -0.088 18769 118 1 2 . 1 1 7 7 SER CB C 7 64.026 64.026 63.221 0.805 18769 119 1 2 . 1 1 7 7 SER H H 7 8.222 8.222 8.040 0.182 18769 120 1 2 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.479 -0.049 18769 121 1 2 . 1 1 8 8 TYR CA C 8 61.958 61.958 60.064 1.894 18769 122 1 2 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.235 0.705 18769 123 1 2 . 1 1 8 8 TYR H H 8 8.191 8.191 8.189 0.002 18769 124 1 2 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.277 0.781 18769 125 1 2 . 1 1 9 9 LEU CA C 9 58.791 58.791 57.558 1.233 18769 126 1 2 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.838 0.690 18769 127 1 2 . 1 1 9 9 LEU H H 9 8.306 8.306 7.739 0.567 18769 128 1 2 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.349 0.261 18769 129 1 2 . 1 1 10 10 TRP CA C 10 61.451 61.451 60.799 0.652 18769 130 1 2 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.566 0.477 18769 131 1 2 . 1 1 10 10 TRP H H 10 8.281 8.281 8.718 -0.437 18769 132 1 2 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.263 0.736 18769 133 1 2 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.206 0.877 18769 134 1 2 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.146 1.284 18769 135 1 2 . 1 1 11 11 GLN H H 11 8.275 8.275 7.999 0.276 18769 136 1 2 . 1 1 12 12 ARG HA H 12 4.072 4.072 4.025 0.047 18769 137 1 2 . 1 1 12 12 ARG CA C 12 59.855 59.855 58.753 1.102 18769 138 1 2 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.957 0.331 18769 139 1 2 . 1 1 12 12 ARG H H 12 8.158 8.158 7.640 0.518 18769 140 1 2 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.508 -0.095 18769 141 1 2 . 1 1 13 13 TRP CA C 13 62.193 62.193 58.134 4.059 18769 142 1 2 . 1 1 13 13 TRP CB C 13 29.421 29.421 31.032 -1.611 18769 143 1 2 . 1 1 13 13 TRP H H 13 8.425 8.425 7.486 0.939 18769 144 1 2 . 1 1 14 14 GLU HA H 14 3.698 3.698 3.686 0.012 18769 145 1 2 . 1 1 14 14 GLU CA C 14 59.978 59.978 59.365 0.613 18769 146 1 2 . 1 1 14 14 GLU CB C 14 28.680 28.680 29.390 -0.710 18769 147 1 2 . 1 1 14 14 GLU H H 14 8.774 8.774 7.686 1.088 18769 148 1 2 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.588 -0.093 18769 149 1 2 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.903 0.663 18769 150 1 2 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.559 1.469 18769 151 1 2 . 1 1 15 15 ASN H H 15 8.059 8.059 8.319 -0.260 18769 152 1 2 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.354 -0.116 18769 153 1 2 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.925 1.319 18769 154 1 2 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.395 -0.204 18769 155 1 2 . 1 1 16 16 TRP H H 16 8.071 8.071 7.719 0.352 18769 156 1 2 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.079 0.367 18769 157 1 2 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.441 0.585 18769 158 1 2 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.633 0.972 18769 159 1 2 . 1 1 17 17 PHE H H 17 8.768 8.768 7.773 0.995 18769 160 1 2 . 1 1 18 18 TRP HA H 18 4.223 4.223 4.062 0.161 18769 161 1 2 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.442 1.373 18769 162 1 2 . 1 1 18 18 TRP CB C 18 29.900 29.900 29.229 0.671 18769 163 1 2 . 1 1 18 18 TRP H H 18 8.456 8.456 8.657 -0.201 18769 164 1 2 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.500 -0.169 18769 165 1 2 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.554 0.706 18769 166 1 2 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.892 1.137 18769 167 1 2 . 1 1 19 19 ASN H H 19 7.768 7.768 7.963 -0.195 18769 168 1 2 . 1 1 20 20 VAL HA H 20 3.728 3.728 4.071 -0.343 18769 169 1 2 . 1 1 20 20 VAL CA C 20 65.593 65.593 64.404 1.188 18769 170 1 2 . 1 1 20 20 VAL CB C 20 32.363 32.363 31.261 1.102 18769 171 1 2 . 1 1 20 20 VAL H H 20 7.983 7.983 7.936 0.047 18769 172 1 2 . 1 1 21 21 THR HA H 21 3.886 3.886 4.158 -0.272 18769 173 1 2 . 1 1 21 21 THR CA C 21 65.003 65.003 64.541 0.462 18769 174 1 2 . 1 1 21 21 THR CB C 21 69.837 69.837 69.877 -0.040 18769 175 1 2 . 1 1 21 21 THR H H 21 7.523 7.523 7.434 0.089 18769 176 1 2 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.357 -0.046 18769 177 1 2 . 1 1 22 22 LEU CA C 22 56.094 56.094 55.900 0.194 18769 178 1 2 . 1 1 22 22 LEU CB C 22 42.641 42.641 43.381 -0.740 18769 179 1 2 . 1 1 22 22 LEU H H 22 7.598 7.598 8.138 -0.540 18769 180 1 2 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.605 -0.235 18769 181 1 2 . 1 1 23 23 ARG CA C 23 56.977 56.977 53.428 3.549 18769 182 1 2 . 1 1 23 23 ARG CB C 23 30.139 30.139 29.437 0.702 18769 183 1 2 . 1 1 23 23 ARG H H 23 7.480 7.480 7.500 -0.020 18769 184 1 2 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.331 0.060 18769 185 1 2 . 1 1 24 24 PRO CA C 24 65.036 65.036 63.169 1.867 18769 186 1 2 . 1 1 24 24 PRO CB C 24 32.233 32.233 31.412 0.821 18769 187 1 2 . 1 1 25 25 GLU HA H 25 4.352 4.352 3.984 0.368 18769 188 1 2 . 1 1 25 25 GLU CA C 25 57.150 57.150 57.235 -0.085 18769 189 1 2 . 1 1 25 25 GLU CB C 25 29.234 29.234 30.005 -0.771 18769 190 1 2 . 1 1 25 25 GLU H H 25 8.002 8.002 8.513 -0.511 18769 191 1 3 . 1 1 2 2 SER HA H 2 4.611 4.611 4.546 0.065 18769 192 1 3 . 1 1 2 2 SER CA C 2 58.466 58.466 59.578 -1.112 18769 193 1 3 . 1 1 2 2 SER CB C 2 65.003 65.003 63.871 1.132 18769 194 1 3 . 1 1 2 2 SER H H 2 8.606 8.606 8.743 -0.137 18769 195 1 3 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.146 0.208 18769 196 1 3 . 1 1 3 3 ALA CA C 3 54.477 54.477 53.536 0.941 18769 197 1 3 . 1 1 3 3 ALA CB C 3 19.356 19.356 17.952 1.404 18769 198 1 3 . 1 1 3 3 ALA H H 3 8.654 8.654 8.043 0.611 18769 199 1 3 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.618 -0.348 18769 200 1 3 . 1 1 4 4 LEU CA C 4 57.815 57.815 54.909 2.906 18769 201 1 3 . 1 1 4 4 LEU CB C 4 43.003 43.003 43.173 -0.170 18769 202 1 3 . 1 1 4 4 LEU H H 4 7.954 7.954 7.633 0.321 18769 203 1 3 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.089 -0.210 18769 204 1 3 . 1 1 5 5 VAL CA C 5 65.477 65.477 65.467 0.010 18769 205 1 3 . 1 1 5 5 VAL CB C 5 33.015 33.015 31.665 1.350 18769 206 1 3 . 1 1 5 5 VAL H H 5 7.494 7.494 8.126 -0.632 18769 207 1 3 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.639 -0.005 18769 208 1 3 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.400 -0.314 18769 209 1 3 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.426 0.582 18769 210 1 3 . 1 1 6 6 ASN H H 6 7.994 7.994 8.686 -0.692 18769 211 1 3 . 1 1 7 7 SER HA H 7 4.429 4.429 4.420 0.009 18769 212 1 3 . 1 1 7 7 SER CA C 7 62.214 62.214 61.852 0.362 18769 213 1 3 . 1 1 7 7 SER CB C 7 64.026 64.026 62.756 1.270 18769 214 1 3 . 1 1 7 7 SER H H 7 8.222 8.222 8.622 -0.400 18769 215 1 3 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.342 0.088 18769 216 1 3 . 1 1 8 8 TYR CA C 8 61.958 61.958 60.796 1.162 18769 217 1 3 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.621 0.319 18769 218 1 3 . 1 1 8 8 TYR H H 8 8.191 8.191 7.665 0.526 18769 219 1 3 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.664 0.394 18769 220 1 3 . 1 1 9 9 LEU CA C 9 58.791 58.791 57.961 0.831 18769 221 1 3 . 1 1 9 9 LEU CB C 9 42.528 42.528 40.899 1.629 18769 222 1 3 . 1 1 9 9 LEU H H 9 8.306 8.306 8.079 0.227 18769 223 1 3 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.272 0.338 18769 224 1 3 . 1 1 10 10 TRP CA C 10 61.451 61.451 61.387 0.064 18769 225 1 3 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.322 0.721 18769 226 1 3 . 1 1 10 10 TRP H H 10 8.281 8.281 8.918 -0.637 18769 227 1 3 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.134 0.865 18769 228 1 3 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.437 0.646 18769 229 1 3 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.260 1.170 18769 230 1 3 . 1 1 11 11 GLN H H 11 8.275 8.275 8.493 -0.218 18769 231 1 3 . 1 1 12 12 ARG HA H 12 4.072 4.072 4.012 0.060 18769 232 1 3 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.788 0.067 18769 233 1 3 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.751 0.537 18769 234 1 3 . 1 1 12 12 ARG H H 12 8.158 8.158 7.619 0.539 18769 235 1 3 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.262 0.151 18769 236 1 3 . 1 1 13 13 TRP CA C 13 62.193 62.193 59.488 2.705 18769 237 1 3 . 1 1 13 13 TRP CB C 13 29.421 29.421 29.456 -0.035 18769 238 1 3 . 1 1 13 13 TRP H H 13 8.425 8.425 7.303 1.122 18769 239 1 3 . 1 1 14 14 GLU HA H 14 3.698 3.698 3.928 -0.230 18769 240 1 3 . 1 1 14 14 GLU CA C 14 59.978 59.978 59.586 0.392 18769 241 1 3 . 1 1 14 14 GLU CB C 14 28.680 28.680 29.240 -0.560 18769 242 1 3 . 1 1 14 14 GLU H H 14 8.774 8.774 7.714 1.060 18769 243 1 3 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.513 -0.018 18769 244 1 3 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.575 0.991 18769 245 1 3 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.752 1.276 18769 246 1 3 . 1 1 15 15 ASN H H 15 8.059 8.059 8.561 -0.502 18769 247 1 3 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.382 -0.144 18769 248 1 3 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.922 1.323 18769 249 1 3 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.522 -0.331 18769 250 1 3 . 1 1 16 16 TRP H H 16 8.071 8.071 8.026 0.045 18769 251 1 3 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.203 0.243 18769 252 1 3 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.098 0.928 18769 253 1 3 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.417 1.188 18769 254 1 3 . 1 1 17 17 PHE H H 17 8.768 8.768 7.988 0.780 18769 255 1 3 . 1 1 18 18 TRP HA H 18 4.223 4.223 3.713 0.510 18769 256 1 3 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.530 1.285 18769 257 1 3 . 1 1 18 18 TRP CB C 18 29.900 29.900 29.168 0.732 18769 258 1 3 . 1 1 18 18 TRP H H 18 8.456 8.456 8.644 -0.188 18769 259 1 3 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.425 -0.094 18769 260 1 3 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.469 0.791 18769 261 1 3 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.643 1.386 18769 262 1 3 . 1 1 19 19 ASN H H 19 7.768 7.768 8.054 -0.286 18769 263 1 3 . 1 1 20 20 VAL HA H 20 3.728 3.728 4.079 -0.351 18769 264 1 3 . 1 1 20 20 VAL CA C 20 65.593 65.593 64.783 0.810 18769 265 1 3 . 1 1 20 20 VAL CB C 20 32.363 32.363 31.070 1.293 18769 266 1 3 . 1 1 20 20 VAL H H 20 7.983 7.983 7.625 0.358 18769 267 1 3 . 1 1 21 21 THR HA H 21 3.886 3.886 3.920 -0.034 18769 268 1 3 . 1 1 21 21 THR CA C 21 65.003 65.003 65.704 -0.701 18769 269 1 3 . 1 1 21 21 THR CB C 21 69.837 69.837 68.880 0.957 18769 270 1 3 . 1 1 21 21 THR H H 21 7.523 7.523 7.734 -0.211 18769 271 1 3 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.282 0.029 18769 272 1 3 . 1 1 22 22 LEU CA C 22 56.094 56.094 55.530 0.564 18769 273 1 3 . 1 1 22 22 LEU CB C 22 42.641 42.641 41.928 0.713 18769 274 1 3 . 1 1 22 22 LEU H H 22 7.598 7.598 8.001 -0.403 18769 275 1 3 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.175 0.195 18769 276 1 3 . 1 1 23 23 ARG CA C 23 56.977 56.977 59.983 -3.006 18769 277 1 3 . 1 1 23 23 ARG CB C 23 30.139 30.139 28.256 1.883 18769 278 1 3 . 1 1 23 23 ARG H H 23 7.480 7.480 7.500 -0.020 18769 279 1 3 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.597 -0.206 18769 280 1 3 . 1 1 24 24 PRO CA C 24 65.036 65.036 63.023 2.013 18769 281 1 3 . 1 1 24 24 PRO CB C 24 32.233 32.233 29.986 2.247 18769 282 1 3 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.339 0.013 18769 283 1 3 . 1 1 25 25 GLU CA C 25 57.150 57.150 56.579 0.571 18769 284 1 3 . 1 1 25 25 GLU CB C 25 29.234 29.234 31.339 -2.105 18769 285 1 3 . 1 1 25 25 GLU H H 25 8.002 8.002 8.278 -0.276 18769 286 1 4 . 1 1 2 2 SER HA H 2 4.611 4.611 4.902 -0.291 18769 287 1 4 . 1 1 2 2 SER CA C 2 58.466 58.466 58.197 0.269 18769 288 1 4 . 1 1 2 2 SER CB C 2 65.003 65.003 65.153 -0.150 18769 289 1 4 . 1 1 2 2 SER H H 2 8.606 8.606 8.378 0.228 18769 290 1 4 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.541 -0.187 18769 291 1 4 . 1 1 3 3 ALA CA C 3 54.477 54.477 53.169 1.308 18769 292 1 4 . 1 1 3 3 ALA CB C 3 19.356 19.356 18.906 0.450 18769 293 1 4 . 1 1 3 3 ALA H H 3 8.654 8.654 8.489 0.165 18769 294 1 4 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.501 -0.231 18769 295 1 4 . 1 1 4 4 LEU CA C 4 57.815 57.815 55.564 2.251 18769 296 1 4 . 1 1 4 4 LEU CB C 4 43.003 43.003 42.521 0.482 18769 297 1 4 . 1 1 4 4 LEU H H 4 7.954 7.954 8.063 -0.109 18769 298 1 4 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.219 -0.340 18769 299 1 4 . 1 1 5 5 VAL CA C 5 65.477 65.477 64.567 0.910 18769 300 1 4 . 1 1 5 5 VAL CB C 5 33.015 33.015 33.246 -0.231 18769 301 1 4 . 1 1 5 5 VAL H H 5 7.494 7.494 7.834 -0.340 18769 302 1 4 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.686 -0.052 18769 303 1 4 . 1 1 6 6 ASN CA C 6 56.086 56.086 55.926 0.160 18769 304 1 4 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.602 0.406 18769 305 1 4 . 1 1 6 6 ASN H H 6 7.994 7.994 8.653 -0.659 18769 306 1 4 . 1 1 7 7 SER HA H 7 4.429 4.429 4.227 0.202 18769 307 1 4 . 1 1 7 7 SER CA C 7 62.214 62.214 61.375 0.839 18769 308 1 4 . 1 1 7 7 SER CB C 7 64.026 64.026 63.059 0.967 18769 309 1 4 . 1 1 7 7 SER H H 7 8.222 8.222 8.519 -0.297 18769 310 1 4 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.800 -0.370 18769 311 1 4 . 1 1 8 8 TYR CA C 8 61.958 61.958 59.471 2.487 18769 312 1 4 . 1 1 8 8 TYR CB C 8 38.940 38.940 40.030 -1.090 18769 313 1 4 . 1 1 8 8 TYR H H 8 8.191 8.191 7.532 0.659 18769 314 1 4 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.729 0.329 18769 315 1 4 . 1 1 9 9 LEU CA C 9 58.791 58.791 57.553 1.238 18769 316 1 4 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.048 1.480 18769 317 1 4 . 1 1 9 9 LEU H H 9 8.306 8.306 7.800 0.506 18769 318 1 4 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.277 0.333 18769 319 1 4 . 1 1 10 10 TRP CA C 10 61.451 61.451 62.423 -0.972 18769 320 1 4 . 1 1 10 10 TRP CB C 10 30.043 30.043 28.988 1.055 18769 321 1 4 . 1 1 10 10 TRP H H 10 8.281 8.281 8.908 -0.627 18769 322 1 4 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.223 0.776 18769 323 1 4 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.448 0.635 18769 324 1 4 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.232 1.198 18769 325 1 4 . 1 1 11 11 GLN H H 11 8.275 8.275 8.421 -0.146 18769 326 1 4 . 1 1 12 12 ARG HA H 12 4.072 4.072 4.035 0.037 18769 327 1 4 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.262 0.593 18769 328 1 4 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.712 0.576 18769 329 1 4 . 1 1 12 12 ARG H H 12 8.158 8.158 7.312 0.846 18769 330 1 4 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.219 0.194 18769 331 1 4 . 1 1 13 13 TRP CA C 13 62.193 62.193 60.117 2.076 18769 332 1 4 . 1 1 13 13 TRP CB C 13 29.421 29.421 29.762 -0.341 18769 333 1 4 . 1 1 13 13 TRP H H 13 8.425 8.425 8.512 -0.087 18769 334 1 4 . 1 1 14 14 GLU HA H 14 3.698 3.698 3.804 -0.106 18769 335 1 4 . 1 1 14 14 GLU CA C 14 59.978 59.978 59.601 0.377 18769 336 1 4 . 1 1 14 14 GLU CB C 14 28.680 28.680 29.152 -0.472 18769 337 1 4 . 1 1 14 14 GLU H H 14 8.774 8.774 8.364 0.410 18769 338 1 4 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.512 -0.017 18769 339 1 4 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.477 1.089 18769 340 1 4 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.687 1.341 18769 341 1 4 . 1 1 15 15 ASN H H 15 8.059 8.059 8.354 -0.295 18769 342 1 4 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.372 -0.134 18769 343 1 4 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.846 1.399 18769 344 1 4 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.494 -0.303 18769 345 1 4 . 1 1 16 16 TRP H H 16 8.071 8.071 7.961 0.110 18769 346 1 4 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.123 0.323 18769 347 1 4 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.445 0.581 18769 348 1 4 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.565 1.040 18769 349 1 4 . 1 1 17 17 PHE H H 17 8.768 8.768 7.951 0.817 18769 350 1 4 . 1 1 18 18 TRP HA H 18 4.223 4.223 3.929 0.294 18769 351 1 4 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.510 1.305 18769 352 1 4 . 1 1 18 18 TRP CB C 18 29.900 29.900 29.166 0.734 18769 353 1 4 . 1 1 18 18 TRP H H 18 8.456 8.456 8.717 -0.261 18769 354 1 4 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.467 -0.136 18769 355 1 4 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.348 0.912 18769 356 1 4 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.790 1.239 18769 357 1 4 . 1 1 19 19 ASN H H 19 7.768 7.768 7.946 -0.178 18769 358 1 4 . 1 1 20 20 VAL HA H 20 3.728 3.728 4.116 -0.388 18769 359 1 4 . 1 1 20 20 VAL CA C 20 65.593 65.593 64.157 1.436 18769 360 1 4 . 1 1 20 20 VAL CB C 20 32.363 32.363 31.737 0.626 18769 361 1 4 . 1 1 20 20 VAL H H 20 7.983 7.983 7.638 0.345 18769 362 1 4 . 1 1 21 21 THR HA H 21 3.886 3.886 4.077 -0.191 18769 363 1 4 . 1 1 21 21 THR CA C 21 65.003 65.003 65.074 -0.071 18769 364 1 4 . 1 1 21 21 THR CB C 21 69.837 69.837 69.062 0.775 18769 365 1 4 . 1 1 21 21 THR H H 21 7.523 7.523 7.602 -0.079 18769 366 1 4 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.284 0.027 18769 367 1 4 . 1 1 22 22 LEU CA C 22 56.094 56.094 56.214 -0.120 18769 368 1 4 . 1 1 22 22 LEU CB C 22 42.641 42.641 41.858 0.783 18769 369 1 4 . 1 1 22 22 LEU H H 22 7.598 7.598 7.932 -0.334 18769 370 1 4 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.274 0.096 18769 371 1 4 . 1 1 23 23 ARG CA C 23 56.977 56.977 57.929 -0.952 18769 372 1 4 . 1 1 23 23 ARG CB C 23 30.139 30.139 28.593 1.546 18769 373 1 4 . 1 1 23 23 ARG H H 23 7.480 7.480 7.890 -0.410 18769 374 1 4 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.609 -0.218 18769 375 1 4 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.729 2.307 18769 376 1 4 . 1 1 24 24 PRO CB C 24 32.233 32.233 32.381 -0.148 18769 377 1 4 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.265 0.087 18769 378 1 4 . 1 1 25 25 GLU CA C 25 57.150 57.150 57.191 -0.041 18769 379 1 4 . 1 1 25 25 GLU CB C 25 29.234 29.234 30.244 -1.010 18769 380 1 4 . 1 1 25 25 GLU H H 25 8.002 8.002 8.441 -0.439 18769 381 1 5 . 1 1 2 2 SER HA H 2 4.611 4.611 4.839 -0.228 18769 382 1 5 . 1 1 2 2 SER CA C 2 58.466 58.466 57.502 0.964 18769 383 1 5 . 1 1 2 2 SER CB C 2 65.003 65.003 65.014 -0.011 18769 384 1 5 . 1 1 2 2 SER H H 2 8.606 8.606 8.131 0.475 18769 385 1 5 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.244 0.110 18769 386 1 5 . 1 1 3 3 ALA CA C 3 54.477 54.477 54.685 -0.208 18769 387 1 5 . 1 1 3 3 ALA CB C 3 19.356 19.356 18.779 0.577 18769 388 1 5 . 1 1 3 3 ALA H H 3 8.654 8.654 8.841 -0.187 18769 389 1 5 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.345 -0.075 18769 390 1 5 . 1 1 4 4 LEU CA C 4 57.815 57.815 56.224 1.591 18769 391 1 5 . 1 1 4 4 LEU CB C 4 43.003 43.003 42.495 0.508 18769 392 1 5 . 1 1 4 4 LEU H H 4 7.954 7.954 8.143 -0.189 18769 393 1 5 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.238 -0.359 18769 394 1 5 . 1 1 5 5 VAL CA C 5 65.477 65.477 63.953 1.524 18769 395 1 5 . 1 1 5 5 VAL CB C 5 33.015 33.015 33.453 -0.438 18769 396 1 5 . 1 1 5 5 VAL H H 5 7.494 7.494 7.285 0.209 18769 397 1 5 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.616 0.018 18769 398 1 5 . 1 1 6 6 ASN CA C 6 56.086 56.086 55.581 0.505 18769 399 1 5 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.545 0.463 18769 400 1 5 . 1 1 6 6 ASN H H 6 7.994 7.994 8.446 -0.452 18769 401 1 5 . 1 1 7 7 SER HA H 7 4.429 4.429 4.195 0.234 18769 402 1 5 . 1 1 7 7 SER CA C 7 62.214 62.214 61.988 0.226 18769 403 1 5 . 1 1 7 7 SER CB C 7 64.026 64.026 63.103 0.923 18769 404 1 5 . 1 1 7 7 SER H H 7 8.222 8.222 8.130 0.092 18769 405 1 5 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.447 -0.017 18769 406 1 5 . 1 1 8 8 TYR CA C 8 61.958 61.958 61.108 0.850 18769 407 1 5 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.701 0.239 18769 408 1 5 . 1 1 8 8 TYR H H 8 8.191 8.191 7.750 0.441 18769 409 1 5 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.779 0.279 18769 410 1 5 . 1 1 9 9 LEU CA C 9 58.791 58.791 57.915 0.876 18769 411 1 5 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.754 0.774 18769 412 1 5 . 1 1 9 9 LEU H H 9 8.306 8.306 7.716 0.590 18769 413 1 5 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.322 0.288 18769 414 1 5 . 1 1 10 10 TRP CA C 10 61.451 61.451 61.681 -0.230 18769 415 1 5 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.504 0.539 18769 416 1 5 . 1 1 10 10 TRP H H 10 8.281 8.281 8.895 -0.614 18769 417 1 5 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.278 0.721 18769 418 1 5 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.266 0.817 18769 419 1 5 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.435 0.995 18769 420 1 5 . 1 1 11 11 GLN H H 11 8.275 8.275 7.911 0.364 18769 421 1 5 . 1 1 12 12 ARG HA H 12 4.072 4.072 3.952 0.120 18769 422 1 5 . 1 1 12 12 ARG CA C 12 59.855 59.855 58.927 0.928 18769 423 1 5 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.617 0.670 18769 424 1 5 . 1 1 12 12 ARG H H 12 8.158 8.158 8.133 0.025 18769 425 1 5 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.465 -0.052 18769 426 1 5 . 1 1 13 13 TRP CA C 13 62.193 62.193 58.637 3.556 18769 427 1 5 . 1 1 13 13 TRP CB C 13 29.421 29.421 30.388 -0.967 18769 428 1 5 . 1 1 13 13 TRP H H 13 8.425 8.425 7.169 1.256 18769 429 1 5 . 1 1 14 14 GLU HA H 14 3.698 3.698 3.808 -0.110 18769 430 1 5 . 1 1 14 14 GLU CA C 14 59.978 59.978 59.698 0.280 18769 431 1 5 . 1 1 14 14 GLU CB C 14 28.680 28.680 28.969 -0.289 18769 432 1 5 . 1 1 14 14 GLU H H 14 8.774 8.774 8.429 0.345 18769 433 1 5 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.503 -0.008 18769 434 1 5 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.842 0.724 18769 435 1 5 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.570 1.458 18769 436 1 5 . 1 1 15 15 ASN H H 15 8.059 8.059 8.639 -0.580 18769 437 1 5 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.403 -0.165 18769 438 1 5 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.286 1.959 18769 439 1 5 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.418 -0.227 18769 440 1 5 . 1 1 16 16 TRP H H 16 8.071 8.071 7.847 0.224 18769 441 1 5 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.039 0.407 18769 442 1 5 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.045 0.980 18769 443 1 5 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.319 1.286 18769 444 1 5 . 1 1 17 17 PHE H H 17 8.768 8.768 7.833 0.935 18769 445 1 5 . 1 1 18 18 TRP HA H 18 4.223 4.223 3.627 0.596 18769 446 1 5 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.986 0.829 18769 447 1 5 . 1 1 18 18 TRP CB C 18 29.900 29.900 29.082 0.818 18769 448 1 5 . 1 1 18 18 TRP H H 18 8.456 8.456 8.544 -0.088 18769 449 1 5 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.373 -0.042 18769 450 1 5 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.591 0.669 18769 451 1 5 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.582 1.447 18769 452 1 5 . 1 1 19 19 ASN H H 19 7.768 7.768 7.843 -0.075 18769 453 1 5 . 1 1 20 20 VAL HA H 20 3.728 3.728 4.066 -0.338 18769 454 1 5 . 1 1 20 20 VAL CA C 20 65.593 65.593 64.952 0.641 18769 455 1 5 . 1 1 20 20 VAL CB C 20 32.363 32.363 30.926 1.437 18769 456 1 5 . 1 1 20 20 VAL H H 20 7.983 7.983 7.441 0.542 18769 457 1 5 . 1 1 21 21 THR HA H 21 3.886 3.886 3.990 -0.104 18769 458 1 5 . 1 1 21 21 THR CA C 21 65.003 65.003 65.688 -0.685 18769 459 1 5 . 1 1 21 21 THR CB C 21 69.837 69.837 68.698 1.139 18769 460 1 5 . 1 1 21 21 THR H H 21 7.523 7.523 7.594 -0.071 18769 461 1 5 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.195 0.116 18769 462 1 5 . 1 1 22 22 LEU CA C 22 56.094 56.094 55.848 0.246 18769 463 1 5 . 1 1 22 22 LEU CB C 22 42.641 42.641 41.838 0.803 18769 464 1 5 . 1 1 22 22 LEU H H 22 7.598 7.598 7.880 -0.282 18769 465 1 5 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.221 0.149 18769 466 1 5 . 1 1 23 23 ARG CA C 23 56.977 56.977 57.779 -0.802 18769 467 1 5 . 1 1 23 23 ARG CB C 23 30.139 30.139 28.402 1.737 18769 468 1 5 . 1 1 23 23 ARG H H 23 7.480 7.480 8.076 -0.596 18769 469 1 5 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.487 -0.096 18769 470 1 5 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.270 2.766 18769 471 1 5 . 1 1 24 24 PRO CB C 24 32.233 32.233 31.862 0.371 18769 472 1 5 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.206 0.146 18769 473 1 5 . 1 1 25 25 GLU CA C 25 57.150 57.150 56.769 0.381 18769 474 1 5 . 1 1 25 25 GLU CB C 25 29.234 29.234 30.252 -1.018 18769 475 1 5 . 1 1 25 25 GLU H H 25 8.002 8.002 8.407 -0.405 18769 476 1 6 . 1 1 2 2 SER HA H 2 4.611 4.611 5.056 -0.445 18769 477 1 6 . 1 1 2 2 SER CA C 2 58.466 58.466 58.185 0.281 18769 478 1 6 . 1 1 2 2 SER CB C 2 65.003 65.003 65.172 -0.169 18769 479 1 6 . 1 1 2 2 SER H H 2 8.606 8.606 8.874 -0.268 18769 480 1 6 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.565 -0.211 18769 481 1 6 . 1 1 3 3 ALA CA C 3 54.477 54.477 52.755 1.722 18769 482 1 6 . 1 1 3 3 ALA CB C 3 19.356 19.356 19.394 -0.038 18769 483 1 6 . 1 1 3 3 ALA H H 3 8.654 8.654 8.485 0.169 18769 484 1 6 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.408 -0.138 18769 485 1 6 . 1 1 4 4 LEU CA C 4 57.815 57.815 55.520 2.295 18769 486 1 6 . 1 1 4 4 LEU CB C 4 43.003 43.003 42.258 0.745 18769 487 1 6 . 1 1 4 4 LEU H H 4 7.954 7.954 8.451 -0.497 18769 488 1 6 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.201 -0.322 18769 489 1 6 . 1 1 5 5 VAL CA C 5 65.477 65.477 64.884 0.593 18769 490 1 6 . 1 1 5 5 VAL CB C 5 33.015 33.015 32.648 0.367 18769 491 1 6 . 1 1 5 5 VAL H H 5 7.494 7.494 7.961 -0.467 18769 492 1 6 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.607 0.027 18769 493 1 6 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.497 -0.411 18769 494 1 6 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.072 0.936 18769 495 1 6 . 1 1 6 6 ASN H H 6 7.994 7.994 8.490 -0.496 18769 496 1 6 . 1 1 7 7 SER HA H 7 4.429 4.429 4.309 0.120 18769 497 1 6 . 1 1 7 7 SER CA C 7 62.214 62.214 62.209 0.005 18769 498 1 6 . 1 1 7 7 SER CB C 7 64.026 64.026 62.972 1.054 18769 499 1 6 . 1 1 7 7 SER H H 7 8.222 8.222 7.793 0.429 18769 500 1 6 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.669 -0.239 18769 501 1 6 . 1 1 8 8 TYR CA C 8 61.958 61.958 60.876 1.082 18769 502 1 6 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.221 0.719 18769 503 1 6 . 1 1 8 8 TYR H H 8 8.191 8.191 8.408 -0.217 18769 504 1 6 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.605 0.453 18769 505 1 6 . 1 1 9 9 LEU CA C 9 58.791 58.791 57.862 0.929 18769 506 1 6 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.703 0.826 18769 507 1 6 . 1 1 9 9 LEU H H 9 8.306 8.306 8.187 0.119 18769 508 1 6 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.367 0.243 18769 509 1 6 . 1 1 10 10 TRP CA C 10 61.451 61.451 61.724 -0.273 18769 510 1 6 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.319 0.724 18769 511 1 6 . 1 1 10 10 TRP H H 10 8.281 8.281 8.665 -0.384 18769 512 1 6 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.621 0.378 18769 513 1 6 . 1 1 11 11 GLN CA C 11 60.083 60.083 58.622 1.461 18769 514 1 6 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.404 1.026 18769 515 1 6 . 1 1 11 11 GLN H H 11 8.275 8.275 8.120 0.155 18769 516 1 6 . 1 1 12 12 ARG HA H 12 4.072 4.072 3.990 0.082 18769 517 1 6 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.322 0.533 18769 518 1 6 . 1 1 12 12 ARG CB C 12 30.288 30.288 30.341 -0.053 18769 519 1 6 . 1 1 12 12 ARG H H 12 8.158 8.158 7.626 0.532 18769 520 1 6 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.364 0.049 18769 521 1 6 . 1 1 13 13 TRP CA C 13 62.193 62.193 60.277 1.916 18769 522 1 6 . 1 1 13 13 TRP CB C 13 29.421 29.421 29.050 0.371 18769 523 1 6 . 1 1 13 13 TRP H H 13 8.425 8.425 8.130 0.295 18769 524 1 6 . 1 1 14 14 GLU HA H 14 3.698 3.698 2.396 1.302 18769 525 1 6 . 1 1 14 14 GLU CA C 14 59.978 59.978 58.961 1.017 18769 526 1 6 . 1 1 14 14 GLU CB C 14 28.680 28.680 28.636 0.044 18769 527 1 6 . 1 1 14 14 GLU H H 14 8.774 8.774 7.214 1.560 18769 528 1 6 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.433 0.062 18769 529 1 6 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.416 1.150 18769 530 1 6 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.742 1.286 18769 531 1 6 . 1 1 15 15 ASN H H 15 8.059 8.059 7.733 0.326 18769 532 1 6 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.263 -0.025 18769 533 1 6 . 1 1 16 16 TRP CA C 16 62.245 62.245 61.054 1.191 18769 534 1 6 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.240 -0.049 18769 535 1 6 . 1 1 16 16 TRP H H 16 8.071 8.071 8.499 -0.428 18769 536 1 6 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.039 0.407 18769 537 1 6 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.328 0.698 18769 538 1 6 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.193 1.412 18769 539 1 6 . 1 1 17 17 PHE H H 17 8.768 8.768 8.338 0.430 18769 540 1 6 . 1 1 18 18 TRP HA H 18 4.223 4.223 3.850 0.373 18769 541 1 6 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.475 1.340 18769 542 1 6 . 1 1 18 18 TRP CB C 18 29.900 29.900 28.941 0.959 18769 543 1 6 . 1 1 18 18 TRP H H 18 8.456 8.456 8.368 0.088 18769 544 1 6 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.455 -0.124 18769 545 1 6 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.930 0.330 18769 546 1 6 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.656 1.373 18769 547 1 6 . 1 1 19 19 ASN H H 19 7.768 7.768 8.049 -0.281 18769 548 1 6 . 1 1 20 20 VAL HA H 20 3.728 3.728 3.958 -0.230 18769 549 1 6 . 1 1 20 20 VAL CA C 20 65.593 65.593 65.052 0.541 18769 550 1 6 . 1 1 20 20 VAL CB C 20 32.363 32.363 30.933 1.430 18769 551 1 6 . 1 1 20 20 VAL H H 20 7.983 7.983 7.675 0.308 18769 552 1 6 . 1 1 21 21 THR HA H 21 3.886 3.886 3.943 -0.057 18769 553 1 6 . 1 1 21 21 THR CA C 21 65.003 65.003 64.867 0.136 18769 554 1 6 . 1 1 21 21 THR CB C 21 69.837 69.837 69.041 0.796 18769 555 1 6 . 1 1 21 21 THR H H 21 7.523 7.523 7.784 -0.261 18769 556 1 6 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.326 -0.015 18769 557 1 6 . 1 1 22 22 LEU CA C 22 56.094 56.094 55.094 1.000 18769 558 1 6 . 1 1 22 22 LEU CB C 22 42.641 42.641 43.212 -0.571 18769 559 1 6 . 1 1 22 22 LEU H H 22 7.598 7.598 7.504 0.094 18769 560 1 6 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.125 0.245 18769 561 1 6 . 1 1 23 23 ARG CA C 23 56.977 56.977 55.878 1.099 18769 562 1 6 . 1 1 23 23 ARG CB C 23 30.139 30.139 28.815 1.324 18769 563 1 6 . 1 1 23 23 ARG H H 23 7.480 7.480 7.457 0.023 18769 564 1 6 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.457 -0.066 18769 565 1 6 . 1 1 24 24 PRO CA C 24 65.036 65.036 63.042 1.994 18769 566 1 6 . 1 1 24 24 PRO CB C 24 32.233 32.233 32.415 -0.182 18769 567 1 6 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.359 -0.007 18769 568 1 6 . 1 1 25 25 GLU CA C 25 57.150 57.150 55.633 1.517 18769 569 1 6 . 1 1 25 25 GLU CB C 25 29.234 29.234 29.161 0.073 18769 570 1 6 . 1 1 25 25 GLU H H 25 8.002 8.002 8.539 -0.537 18769 571 1 7 . 1 1 2 2 SER HA H 2 4.611 4.611 4.757 -0.146 18769 572 1 7 . 1 1 2 2 SER CA C 2 58.466 58.466 57.218 1.248 18769 573 1 7 . 1 1 2 2 SER CB C 2 65.003 65.003 64.756 0.247 18769 574 1 7 . 1 1 2 2 SER H H 2 8.606 8.606 8.425 0.181 18769 575 1 7 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.310 0.044 18769 576 1 7 . 1 1 3 3 ALA CA C 3 54.477 54.477 54.656 -0.179 18769 577 1 7 . 1 1 3 3 ALA CB C 3 19.356 19.356 18.717 0.639 18769 578 1 7 . 1 1 3 3 ALA H H 3 8.654 8.654 8.768 -0.114 18769 579 1 7 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.247 0.023 18769 580 1 7 . 1 1 4 4 LEU CA C 4 57.815 57.815 57.369 0.446 18769 581 1 7 . 1 1 4 4 LEU CB C 4 43.003 43.003 40.794 2.209 18769 582 1 7 . 1 1 4 4 LEU H H 4 7.954 7.954 7.992 -0.038 18769 583 1 7 . 1 1 5 5 VAL HA H 5 3.879 3.879 3.811 0.068 18769 584 1 7 . 1 1 5 5 VAL CA C 5 65.477 65.477 66.747 -1.270 18769 585 1 7 . 1 1 5 5 VAL CB C 5 33.015 33.015 31.472 1.543 18769 586 1 7 . 1 1 5 5 VAL H H 5 7.494 7.494 7.941 -0.447 18769 587 1 7 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.515 0.119 18769 588 1 7 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.454 -0.368 18769 589 1 7 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.313 0.695 18769 590 1 7 . 1 1 6 6 ASN H H 6 7.994 7.994 7.887 0.107 18769 591 1 7 . 1 1 7 7 SER HA H 7 4.429 4.429 4.366 0.063 18769 592 1 7 . 1 1 7 7 SER CA C 7 62.214 62.214 62.108 0.107 18769 593 1 7 . 1 1 7 7 SER CB C 7 64.026 64.026 63.137 0.889 18769 594 1 7 . 1 1 7 7 SER H H 7 8.222 8.222 7.812 0.410 18769 595 1 7 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.379 0.051 18769 596 1 7 . 1 1 8 8 TYR CA C 8 61.958 61.958 61.260 0.699 18769 597 1 7 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.508 0.432 18769 598 1 7 . 1 1 8 8 TYR H H 8 8.191 8.191 7.920 0.271 18769 599 1 7 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.663 0.395 18769 600 1 7 . 1 1 9 9 LEU CA C 9 58.791 58.791 58.017 0.774 18769 601 1 7 . 1 1 9 9 LEU CB C 9 42.528 42.528 40.895 1.633 18769 602 1 7 . 1 1 9 9 LEU H H 9 8.306 8.306 8.326 -0.020 18769 603 1 7 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.291 0.319 18769 604 1 7 . 1 1 10 10 TRP CA C 10 61.451 61.451 61.197 0.255 18769 605 1 7 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.272 0.771 18769 606 1 7 . 1 1 10 10 TRP H H 10 8.281 8.281 8.812 -0.531 18769 607 1 7 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.221 0.778 18769 608 1 7 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.485 0.598 18769 609 1 7 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.174 1.256 18769 610 1 7 . 1 1 11 11 GLN H H 11 8.275 8.275 7.950 0.325 18769 611 1 7 . 1 1 12 12 ARG HA H 12 4.072 4.072 3.952 0.120 18769 612 1 7 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.799 0.056 18769 613 1 7 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.584 0.704 18769 614 1 7 . 1 1 12 12 ARG H H 12 8.158 8.158 7.590 0.568 18769 615 1 7 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.186 0.227 18769 616 1 7 . 1 1 13 13 TRP CA C 13 62.193 62.193 59.380 2.813 18769 617 1 7 . 1 1 13 13 TRP CB C 13 29.421 29.421 29.410 0.011 18769 618 1 7 . 1 1 13 13 TRP H H 13 8.425 8.425 7.346 1.079 18769 619 1 7 . 1 1 14 14 GLU HA H 14 3.698 3.698 3.653 0.045 18769 620 1 7 . 1 1 14 14 GLU CA C 14 59.978 59.978 59.489 0.489 18769 621 1 7 . 1 1 14 14 GLU CB C 14 28.680 28.680 29.003 -0.323 18769 622 1 7 . 1 1 14 14 GLU H H 14 8.774 8.774 7.631 1.143 18769 623 1 7 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.569 -0.074 18769 624 1 7 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.896 0.670 18769 625 1 7 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.752 1.276 18769 626 1 7 . 1 1 15 15 ASN H H 15 8.059 8.059 8.599 -0.540 18769 627 1 7 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.338 -0.100 18769 628 1 7 . 1 1 16 16 TRP CA C 16 62.245 62.245 61.082 1.163 18769 629 1 7 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.498 -0.307 18769 630 1 7 . 1 1 16 16 TRP H H 16 8.071 8.071 8.085 -0.014 18769 631 1 7 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.094 0.352 18769 632 1 7 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.418 0.608 18769 633 1 7 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.514 1.091 18769 634 1 7 . 1 1 17 17 PHE H H 17 8.768 8.768 7.872 0.896 18769 635 1 7 . 1 1 18 18 TRP HA H 18 4.223 4.223 3.965 0.259 18769 636 1 7 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.076 1.739 18769 637 1 7 . 1 1 18 18 TRP CB C 18 29.900 29.900 29.115 0.785 18769 638 1 7 . 1 1 18 18 TRP H H 18 8.456 8.456 8.679 -0.223 18769 639 1 7 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.491 -0.160 18769 640 1 7 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.326 0.934 18769 641 1 7 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.102 1.927 18769 642 1 7 . 1 1 19 19 ASN H H 19 7.768 7.768 8.070 -0.302 18769 643 1 7 . 1 1 20 20 VAL HA H 20 3.728 3.728 4.060 -0.332 18769 644 1 7 . 1 1 20 20 VAL CA C 20 65.593 65.593 64.992 0.601 18769 645 1 7 . 1 1 20 20 VAL CB C 20 32.363 32.363 31.019 1.344 18769 646 1 7 . 1 1 20 20 VAL H H 20 7.983 7.983 7.614 0.369 18769 647 1 7 . 1 1 21 21 THR HA H 21 3.886 3.886 3.994 -0.108 18769 648 1 7 . 1 1 21 21 THR CA C 21 65.003 65.003 65.330 -0.327 18769 649 1 7 . 1 1 21 21 THR CB C 21 69.837 69.837 69.011 0.826 18769 650 1 7 . 1 1 21 21 THR H H 21 7.523 7.523 7.668 -0.145 18769 651 1 7 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.268 0.043 18769 652 1 7 . 1 1 22 22 LEU CA C 22 56.094 56.094 55.082 1.012 18769 653 1 7 . 1 1 22 22 LEU CB C 22 42.641 42.641 42.650 -0.009 18769 654 1 7 . 1 1 22 22 LEU H H 22 7.598 7.598 7.673 -0.075 18769 655 1 7 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.201 0.169 18769 656 1 7 . 1 1 23 23 ARG CA C 23 56.977 56.977 55.881 1.096 18769 657 1 7 . 1 1 23 23 ARG CB C 23 30.139 30.139 28.023 2.116 18769 658 1 7 . 1 1 23 23 ARG H H 23 7.480 7.480 7.526 -0.046 18769 659 1 7 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.462 -0.071 18769 660 1 7 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.747 2.289 18769 661 1 7 . 1 1 24 24 PRO CB C 24 32.233 32.233 32.647 -0.414 18769 662 1 7 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.432 -0.080 18769 663 1 7 . 1 1 25 25 GLU CA C 25 57.150 57.150 56.353 0.797 18769 664 1 7 . 1 1 25 25 GLU CB C 25 29.234 29.234 30.452 -1.218 18769 665 1 7 . 1 1 25 25 GLU H H 25 8.002 8.002 8.639 -0.637 18769 666 1 8 . 1 1 2 2 SER HA H 2 4.611 4.611 4.604 0.007 18769 667 1 8 . 1 1 2 2 SER CA C 2 58.466 58.466 57.688 0.777 18769 668 1 8 . 1 1 2 2 SER CB C 2 65.003 65.003 64.898 0.105 18769 669 1 8 . 1 1 2 2 SER H H 2 8.606 8.606 8.160 0.446 18769 670 1 8 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.564 -0.210 18769 671 1 8 . 1 1 3 3 ALA CA C 3 54.477 54.477 53.276 1.201 18769 672 1 8 . 1 1 3 3 ALA CB C 3 19.356 19.356 19.349 0.007 18769 673 1 8 . 1 1 3 3 ALA H H 3 8.654 8.654 8.527 0.127 18769 674 1 8 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.556 -0.286 18769 675 1 8 . 1 1 4 4 LEU CA C 4 57.815 57.815 55.559 2.256 18769 676 1 8 . 1 1 4 4 LEU CB C 4 43.003 43.003 42.482 0.521 18769 677 1 8 . 1 1 4 4 LEU H H 4 7.954 7.954 8.276 -0.322 18769 678 1 8 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.397 -0.518 18769 679 1 8 . 1 1 5 5 VAL CA C 5 65.477 65.477 63.496 1.981 18769 680 1 8 . 1 1 5 5 VAL CB C 5 33.015 33.015 32.780 0.235 18769 681 1 8 . 1 1 5 5 VAL H H 5 7.494 7.494 7.790 -0.296 18769 682 1 8 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.733 -0.099 18769 683 1 8 . 1 1 6 6 ASN CA C 6 56.086 56.086 55.456 0.630 18769 684 1 8 . 1 1 6 6 ASN CB C 6 39.008 39.008 39.533 -0.525 18769 685 1 8 . 1 1 6 6 ASN H H 6 7.994 7.994 8.381 -0.387 18769 686 1 8 . 1 1 7 7 SER HA H 7 4.429 4.429 4.295 0.134 18769 687 1 8 . 1 1 7 7 SER CA C 7 62.214 62.214 62.874 -0.660 18769 688 1 8 . 1 1 7 7 SER CB C 7 64.026 64.026 63.285 0.741 18769 689 1 8 . 1 1 7 7 SER H H 7 8.222 8.222 8.381 -0.159 18769 690 1 8 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.446 -0.016 18769 691 1 8 . 1 1 8 8 TYR CA C 8 61.958 61.958 60.257 1.701 18769 692 1 8 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.011 0.929 18769 693 1 8 . 1 1 8 8 TYR H H 8 8.191 8.191 8.553 -0.362 18769 694 1 8 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.555 0.503 18769 695 1 8 . 1 1 9 9 LEU CA C 9 58.791 58.791 57.172 1.619 18769 696 1 8 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.146 1.382 18769 697 1 8 . 1 1 9 9 LEU H H 9 8.306 8.306 7.177 1.129 18769 698 1 8 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.300 0.310 18769 699 1 8 . 1 1 10 10 TRP CA C 10 61.451 61.451 61.743 -0.292 18769 700 1 8 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.276 0.767 18769 701 1 8 . 1 1 10 10 TRP H H 10 8.281 8.281 8.564 -0.283 18769 702 1 8 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.211 0.788 18769 703 1 8 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.232 0.851 18769 704 1 8 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.391 1.039 18769 705 1 8 . 1 1 11 11 GLN H H 11 8.275 8.275 7.990 0.285 18769 706 1 8 . 1 1 12 12 ARG HA H 12 4.072 4.072 4.018 0.054 18769 707 1 8 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.602 0.253 18769 708 1 8 . 1 1 12 12 ARG CB C 12 30.288 30.288 30.048 0.240 18769 709 1 8 . 1 1 12 12 ARG H H 12 8.158 8.158 7.679 0.479 18769 710 1 8 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.407 0.006 18769 711 1 8 . 1 1 13 13 TRP CA C 13 62.193 62.193 60.074 2.119 18769 712 1 8 . 1 1 13 13 TRP CB C 13 29.421 29.421 29.196 0.225 18769 713 1 8 . 1 1 13 13 TRP H H 13 8.425 8.425 8.029 0.396 18769 714 1 8 . 1 1 14 14 GLU HA H 14 3.698 3.698 2.726 0.972 18769 715 1 8 . 1 1 14 14 GLU CA C 14 59.978 59.978 59.162 0.816 18769 716 1 8 . 1 1 14 14 GLU CB C 14 28.680 28.680 28.652 0.028 18769 717 1 8 . 1 1 14 14 GLU H H 14 8.774 8.774 7.267 1.507 18769 718 1 8 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.432 0.063 18769 719 1 8 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.687 0.879 18769 720 1 8 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.650 1.378 18769 721 1 8 . 1 1 15 15 ASN H H 15 8.059 8.059 8.258 -0.199 18769 722 1 8 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.304 -0.066 18769 723 1 8 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.621 1.624 18769 724 1 8 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.493 -0.302 18769 725 1 8 . 1 1 16 16 TRP H H 16 8.071 8.071 8.252 -0.181 18769 726 1 8 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.046 0.400 18769 727 1 8 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.416 0.610 18769 728 1 8 . 1 1 17 17 PHE CB C 17 39.605 39.605 37.941 1.664 18769 729 1 8 . 1 1 17 17 PHE H H 17 8.768 8.768 8.270 0.498 18769 730 1 8 . 1 1 18 18 TRP HA H 18 4.223 4.223 3.687 0.536 18769 731 1 8 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.608 1.207 18769 732 1 8 . 1 1 18 18 TRP CB C 18 29.900 29.900 28.894 1.006 18769 733 1 8 . 1 1 18 18 TRP H H 18 8.456 8.456 8.363 0.093 18769 734 1 8 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.353 -0.022 18769 735 1 8 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.364 0.896 18769 736 1 8 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.410 1.619 18769 737 1 8 . 1 1 19 19 ASN H H 19 7.768 7.768 7.997 -0.229 18769 738 1 8 . 1 1 20 20 VAL HA H 20 3.728 3.728 4.157 -0.429 18769 739 1 8 . 1 1 20 20 VAL CA C 20 65.593 65.593 63.741 1.852 18769 740 1 8 . 1 1 20 20 VAL CB C 20 32.363 32.363 32.415 -0.052 18769 741 1 8 . 1 1 20 20 VAL H H 20 7.983 7.983 6.931 1.052 18769 742 1 8 . 1 1 21 21 THR HA H 21 3.886 3.886 3.762 0.124 18769 743 1 8 . 1 1 21 21 THR CA C 21 65.003 65.003 66.266 -1.263 18769 744 1 8 . 1 1 21 21 THR CB C 21 69.837 69.837 68.261 1.576 18769 745 1 8 . 1 1 21 21 THR H H 21 7.523 7.523 7.652 -0.129 18769 746 1 8 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.102 0.209 18769 747 1 8 . 1 1 22 22 LEU CA C 22 56.094 56.094 57.322 -1.228 18769 748 1 8 . 1 1 22 22 LEU CB C 22 42.641 42.641 42.531 0.110 18769 749 1 8 . 1 1 22 22 LEU H H 22 7.598 7.598 7.702 -0.104 18769 750 1 8 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.659 -0.289 18769 751 1 8 . 1 1 23 23 ARG CA C 23 56.977 56.977 53.259 3.718 18769 752 1 8 . 1 1 23 23 ARG CB C 23 30.139 30.139 30.948 -0.809 18769 753 1 8 . 1 1 23 23 ARG H H 23 7.480 7.480 7.874 -0.394 18769 754 1 8 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.627 -0.236 18769 755 1 8 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.577 2.459 18769 756 1 8 . 1 1 24 24 PRO CB C 24 32.233 32.233 30.581 1.652 18769 757 1 8 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.594 -0.242 18769 758 1 8 . 1 1 25 25 GLU CA C 25 57.150 57.150 55.053 2.097 18769 759 1 8 . 1 1 25 25 GLU CB C 25 29.234 29.234 31.115 -1.881 18769 760 1 8 . 1 1 25 25 GLU H H 25 8.002 8.002 8.343 -0.341 18769 761 1 9 . 1 1 2 2 SER HA H 2 4.611 4.611 4.842 -0.231 18769 762 1 9 . 1 1 2 2 SER CA C 2 58.466 58.466 58.213 0.253 18769 763 1 9 . 1 1 2 2 SER CB C 2 65.003 65.003 64.598 0.405 18769 764 1 9 . 1 1 2 2 SER H H 2 8.606 8.606 8.454 0.152 18769 765 1 9 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.392 -0.038 18769 766 1 9 . 1 1 3 3 ALA CA C 3 54.477 54.477 53.317 1.160 18769 767 1 9 . 1 1 3 3 ALA CB C 3 19.356 19.356 19.134 0.222 18769 768 1 9 . 1 1 3 3 ALA H H 3 8.654 8.654 8.650 0.004 18769 769 1 9 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.833 -0.563 18769 770 1 9 . 1 1 4 4 LEU CA C 4 57.815 57.815 56.820 0.995 18769 771 1 9 . 1 1 4 4 LEU CB C 4 43.003 43.003 41.941 1.062 18769 772 1 9 . 1 1 4 4 LEU H H 4 7.954 7.954 7.955 -0.001 18769 773 1 9 . 1 1 5 5 VAL HA H 5 3.879 3.879 3.895 -0.016 18769 774 1 9 . 1 1 5 5 VAL CA C 5 65.477 65.477 66.064 -0.587 18769 775 1 9 . 1 1 5 5 VAL CB C 5 33.015 33.015 31.224 1.791 18769 776 1 9 . 1 1 5 5 VAL H H 5 7.494 7.494 8.103 -0.609 18769 777 1 9 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.592 0.042 18769 778 1 9 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.608 -0.522 18769 779 1 9 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.132 0.876 18769 780 1 9 . 1 1 6 6 ASN H H 6 7.994 7.994 8.620 -0.626 18769 781 1 9 . 1 1 7 7 SER HA H 7 4.429 4.429 4.389 0.040 18769 782 1 9 . 1 1 7 7 SER CA C 7 62.214 62.214 62.399 -0.185 18769 783 1 9 . 1 1 7 7 SER CB C 7 64.026 64.026 63.277 0.749 18769 784 1 9 . 1 1 7 7 SER H H 7 8.222 8.222 8.213 0.009 18769 785 1 9 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.298 0.132 18769 786 1 9 . 1 1 8 8 TYR CA C 8 61.958 61.958 61.371 0.587 18769 787 1 9 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.620 0.320 18769 788 1 9 . 1 1 8 8 TYR H H 8 8.191 8.191 8.171 0.020 18769 789 1 9 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.846 0.212 18769 790 1 9 . 1 1 9 9 LEU CA C 9 58.791 58.791 57.731 1.060 18769 791 1 9 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.157 1.371 18769 792 1 9 . 1 1 9 9 LEU H H 9 8.306 8.306 7.918 0.388 18769 793 1 9 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.447 0.163 18769 794 1 9 . 1 1 10 10 TRP CA C 10 61.451 61.451 61.510 -0.058 18769 795 1 9 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.322 0.721 18769 796 1 9 . 1 1 10 10 TRP H H 10 8.281 8.281 8.826 -0.545 18769 797 1 9 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.094 0.905 18769 798 1 9 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.328 0.755 18769 799 1 9 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.115 1.315 18769 800 1 9 . 1 1 11 11 GLN H H 11 8.275 8.275 8.675 -0.400 18769 801 1 9 . 1 1 12 12 ARG HA H 12 4.072 4.072 4.010 0.062 18769 802 1 9 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.580 0.275 18769 803 1 9 . 1 1 12 12 ARG CB C 12 30.288 30.288 30.190 0.098 18769 804 1 9 . 1 1 12 12 ARG H H 12 8.158 8.158 7.523 0.635 18769 805 1 9 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.317 0.096 18769 806 1 9 . 1 1 13 13 TRP CA C 13 62.193 62.193 60.004 2.189 18769 807 1 9 . 1 1 13 13 TRP CB C 13 29.421 29.421 29.103 0.318 18769 808 1 9 . 1 1 13 13 TRP H H 13 8.425 8.425 7.903 0.522 18769 809 1 9 . 1 1 14 14 GLU HA H 14 3.698 3.698 2.671 1.027 18769 810 1 9 . 1 1 14 14 GLU CA C 14 59.978 59.978 58.977 1.001 18769 811 1 9 . 1 1 14 14 GLU CB C 14 28.680 28.680 28.744 -0.063 18769 812 1 9 . 1 1 14 14 GLU H H 14 8.774 8.774 7.341 1.433 18769 813 1 9 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.452 0.043 18769 814 1 9 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.349 1.217 18769 815 1 9 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.625 1.403 18769 816 1 9 . 1 1 15 15 ASN H H 15 8.059 8.059 8.078 -0.019 18769 817 1 9 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.269 -0.031 18769 818 1 9 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.901 1.344 18769 819 1 9 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.274 -0.083 18769 820 1 9 . 1 1 16 16 TRP H H 16 8.071 8.071 8.077 -0.006 18769 821 1 9 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.031 0.415 18769 822 1 9 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.129 0.897 18769 823 1 9 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.148 1.457 18769 824 1 9 . 1 1 17 17 PHE H H 17 8.768 8.768 7.718 1.050 18769 825 1 9 . 1 1 18 18 TRP HA H 18 4.223 4.223 3.841 0.382 18769 826 1 9 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.776 1.040 18769 827 1 9 . 1 1 18 18 TRP CB C 18 29.900 29.900 29.074 0.826 18769 828 1 9 . 1 1 18 18 TRP H H 18 8.456 8.456 8.297 0.159 18769 829 1 9 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.393 -0.062 18769 830 1 9 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.219 1.041 18769 831 1 9 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.722 1.307 18769 832 1 9 . 1 1 19 19 ASN H H 19 7.768 7.768 7.783 -0.015 18769 833 1 9 . 1 1 20 20 VAL HA H 20 3.728 3.728 4.250 -0.522 18769 834 1 9 . 1 1 20 20 VAL CA C 20 65.593 65.593 62.529 3.063 18769 835 1 9 . 1 1 20 20 VAL CB C 20 32.363 32.363 32.119 0.244 18769 836 1 9 . 1 1 20 20 VAL H H 20 7.983 7.983 6.976 1.007 18769 837 1 9 . 1 1 21 21 THR HA H 21 3.886 3.886 4.170 -0.284 18769 838 1 9 . 1 1 21 21 THR CA C 21 65.003 65.003 63.590 1.413 18769 839 1 9 . 1 1 21 21 THR CB C 21 69.837 69.837 69.974 -0.137 18769 840 1 9 . 1 1 21 21 THR H H 21 7.523 7.523 7.262 0.261 18769 841 1 9 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.144 0.167 18769 842 1 9 . 1 1 22 22 LEU CA C 22 56.094 56.094 57.030 -0.936 18769 843 1 9 . 1 1 22 22 LEU CB C 22 42.641 42.641 42.160 0.481 18769 844 1 9 . 1 1 22 22 LEU H H 22 7.598 7.598 8.096 -0.498 18769 845 1 9 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.100 0.270 18769 846 1 9 . 1 1 23 23 ARG CA C 23 56.977 56.977 55.413 1.564 18769 847 1 9 . 1 1 23 23 ARG CB C 23 30.139 30.139 29.155 0.984 18769 848 1 9 . 1 1 23 23 ARG H H 23 7.480 7.480 8.335 -0.855 18769 849 1 9 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.653 -0.262 18769 850 1 9 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.541 2.495 18769 851 1 9 . 1 1 24 24 PRO CB C 24 32.233 32.233 32.325 -0.092 18769 852 1 9 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.275 0.077 18769 853 1 9 . 1 1 25 25 GLU CA C 25 57.150 57.150 57.040 0.110 18769 854 1 9 . 1 1 25 25 GLU CB C 25 29.234 29.234 29.471 -0.237 18769 855 1 9 . 1 1 25 25 GLU H H 25 8.002 8.002 8.380 -0.378 18769 856 1 10 . 1 1 2 2 SER HA H 2 4.611 4.611 4.601 0.010 18769 857 1 10 . 1 1 2 2 SER CA C 2 58.466 58.466 58.142 0.324 18769 858 1 10 . 1 1 2 2 SER CB C 2 65.003 65.003 64.091 0.911 18769 859 1 10 . 1 1 2 2 SER H H 2 8.606 8.606 8.579 0.027 18769 860 1 10 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.549 -0.195 18769 861 1 10 . 1 1 3 3 ALA CA C 3 54.477 54.477 53.070 1.407 18769 862 1 10 . 1 1 3 3 ALA CB C 3 19.356 19.356 19.194 0.162 18769 863 1 10 . 1 1 3 3 ALA H H 3 8.654 8.654 8.574 0.080 18769 864 1 10 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.563 -0.293 18769 865 1 10 . 1 1 4 4 LEU CA C 4 57.815 57.815 55.458 2.357 18769 866 1 10 . 1 1 4 4 LEU CB C 4 43.003 43.003 40.902 2.101 18769 867 1 10 . 1 1 4 4 LEU H H 4 7.954 7.954 8.343 -0.389 18769 868 1 10 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.039 -0.160 18769 869 1 10 . 1 1 5 5 VAL CA C 5 65.477 65.477 65.209 0.268 18769 870 1 10 . 1 1 5 5 VAL CB C 5 33.015 33.015 32.477 0.538 18769 871 1 10 . 1 1 5 5 VAL H H 5 7.494 7.494 7.808 -0.314 18769 872 1 10 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.459 0.175 18769 873 1 10 . 1 1 6 6 ASN CA C 6 56.086 56.086 57.138 -1.052 18769 874 1 10 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.644 0.364 18769 875 1 10 . 1 1 6 6 ASN H H 6 7.994 7.994 8.545 -0.551 18769 876 1 10 . 1 1 7 7 SER HA H 7 4.429 4.429 4.270 0.159 18769 877 1 10 . 1 1 7 7 SER CA C 7 62.214 62.214 62.017 0.197 18769 878 1 10 . 1 1 7 7 SER CB C 7 64.026 64.026 63.271 0.755 18769 879 1 10 . 1 1 7 7 SER H H 7 8.222 8.222 7.827 0.395 18769 880 1 10 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.358 0.072 18769 881 1 10 . 1 1 8 8 TYR CA C 8 61.958 61.958 60.411 1.547 18769 882 1 10 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.612 0.328 18769 883 1 10 . 1 1 8 8 TYR H H 8 8.191 8.191 7.770 0.421 18769 884 1 10 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.690 0.368 18769 885 1 10 . 1 1 9 9 LEU CA C 9 58.791 58.791 57.722 1.069 18769 886 1 10 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.675 0.853 18769 887 1 10 . 1 1 9 9 LEU H H 9 8.306 8.306 8.395 -0.089 18769 888 1 10 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.420 0.190 18769 889 1 10 . 1 1 10 10 TRP CA C 10 61.451 61.451 60.561 0.890 18769 890 1 10 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.345 0.698 18769 891 1 10 . 1 1 10 10 TRP H H 10 8.281 8.281 8.352 -0.071 18769 892 1 10 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.678 0.321 18769 893 1 10 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.367 0.716 18769 894 1 10 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.383 1.047 18769 895 1 10 . 1 1 11 11 GLN H H 11 8.275 8.275 7.861 0.414 18769 896 1 10 . 1 1 12 12 ARG HA H 12 4.072 4.072 3.975 0.097 18769 897 1 10 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.209 0.646 18769 898 1 10 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.442 0.846 18769 899 1 10 . 1 1 12 12 ARG H H 12 8.158 8.158 7.846 0.312 18769 900 1 10 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.284 0.130 18769 901 1 10 . 1 1 13 13 TRP CA C 13 62.193 62.193 59.636 2.557 18769 902 1 10 . 1 1 13 13 TRP CB C 13 29.421 29.421 29.481 -0.060 18769 903 1 10 . 1 1 13 13 TRP H H 13 8.425 8.425 7.561 0.864 18769 904 1 10 . 1 1 14 14 GLU HA H 14 3.698 3.698 3.938 -0.240 18769 905 1 10 . 1 1 14 14 GLU CA C 14 59.978 59.978 59.559 0.420 18769 906 1 10 . 1 1 14 14 GLU CB C 14 28.680 28.680 29.262 -0.582 18769 907 1 10 . 1 1 14 14 GLU H H 14 8.774 8.774 7.838 0.936 18769 908 1 10 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.585 -0.090 18769 909 1 10 . 1 1 15 15 ASN CA C 15 57.566 57.566 57.204 0.362 18769 910 1 10 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.767 1.261 18769 911 1 10 . 1 1 15 15 ASN H H 15 8.059 8.059 8.700 -0.641 18769 912 1 10 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.368 -0.130 18769 913 1 10 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.937 1.308 18769 914 1 10 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.612 -0.421 18769 915 1 10 . 1 1 16 16 TRP H H 16 8.071 8.071 8.059 0.012 18769 916 1 10 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.246 0.200 18769 917 1 10 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.237 0.789 18769 918 1 10 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.457 1.148 18769 919 1 10 . 1 1 17 17 PHE H H 17 8.768 8.768 8.075 0.693 18769 920 1 10 . 1 1 18 18 TRP HA H 18 4.223 4.223 3.726 0.497 18769 921 1 10 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.640 1.175 18769 922 1 10 . 1 1 18 18 TRP CB C 18 29.900 29.900 29.087 0.813 18769 923 1 10 . 1 1 18 18 TRP H H 18 8.456 8.456 8.714 -0.258 18769 924 1 10 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.422 -0.091 18769 925 1 10 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.268 0.992 18769 926 1 10 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.909 1.120 18769 927 1 10 . 1 1 19 19 ASN H H 19 7.768 7.768 7.973 -0.205 18769 928 1 10 . 1 1 20 20 VAL HA H 20 3.728 3.728 4.229 -0.501 18769 929 1 10 . 1 1 20 20 VAL CA C 20 65.593 65.593 62.407 3.186 18769 930 1 10 . 1 1 20 20 VAL CB C 20 32.363 32.363 31.151 1.212 18769 931 1 10 . 1 1 20 20 VAL H H 20 7.983 7.983 7.372 0.611 18769 932 1 10 . 1 1 21 21 THR HA H 21 3.886 3.886 4.113 -0.227 18769 933 1 10 . 1 1 21 21 THR CA C 21 65.003 65.003 63.715 1.288 18769 934 1 10 . 1 1 21 21 THR CB C 21 69.837 69.837 69.398 0.439 18769 935 1 10 . 1 1 21 21 THR H H 21 7.523 7.523 6.906 0.617 18769 936 1 10 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.140 0.171 18769 937 1 10 . 1 1 22 22 LEU CA C 22 56.094 56.094 57.030 -0.936 18769 938 1 10 . 1 1 22 22 LEU CB C 22 42.641 42.641 42.704 -0.063 18769 939 1 10 . 1 1 22 22 LEU H H 22 7.598 7.598 7.970 -0.372 18769 940 1 10 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.603 -0.233 18769 941 1 10 . 1 1 23 23 ARG CA C 23 56.977 56.977 54.019 2.958 18769 942 1 10 . 1 1 23 23 ARG CB C 23 30.139 30.139 29.055 1.084 18769 943 1 10 . 1 1 23 23 ARG H H 23 7.480 7.480 8.013 -0.533 18769 944 1 10 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.578 -0.187 18769 945 1 10 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.510 2.526 18769 946 1 10 . 1 1 24 24 PRO CB C 24 32.233 32.233 32.251 -0.018 18769 947 1 10 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.048 0.304 18769 948 1 10 . 1 1 25 25 GLU CA C 25 57.150 57.150 57.703 -0.553 18769 949 1 10 . 1 1 25 25 GLU CB C 25 29.234 29.234 30.174 -0.940 18769 950 1 10 . 1 1 25 25 GLU H H 25 8.002 8.002 8.497 -0.495 18769 951 1 11 . 1 1 2 2 SER HA H 2 4.611 4.611 4.785 -0.174 18769 952 1 11 . 1 1 2 2 SER CA C 2 58.466 58.466 57.223 1.243 18769 953 1 11 . 1 1 2 2 SER CB C 2 65.003 65.003 65.373 -0.370 18769 954 1 11 . 1 1 2 2 SER H H 2 8.606 8.606 8.374 0.232 18769 955 1 11 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.608 -0.254 18769 956 1 11 . 1 1 3 3 ALA CA C 3 54.477 54.477 53.870 0.607 18769 957 1 11 . 1 1 3 3 ALA CB C 3 19.356 19.356 19.223 0.133 18769 958 1 11 . 1 1 3 3 ALA H H 3 8.654 8.654 8.613 0.041 18769 959 1 11 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.396 -0.126 18769 960 1 11 . 1 1 4 4 LEU CA C 4 57.815 57.815 55.859 1.956 18769 961 1 11 . 1 1 4 4 LEU CB C 4 43.003 43.003 41.700 1.302 18769 962 1 11 . 1 1 4 4 LEU H H 4 7.954 7.954 8.251 -0.297 18769 963 1 11 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.251 -0.372 18769 964 1 11 . 1 1 5 5 VAL CA C 5 65.477 65.477 63.884 1.593 18769 965 1 11 . 1 1 5 5 VAL CB C 5 33.015 33.015 33.637 -0.622 18769 966 1 11 . 1 1 5 5 VAL H H 5 7.494 7.494 7.536 -0.042 18769 967 1 11 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.554 0.080 18769 968 1 11 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.193 -0.107 18769 969 1 11 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.349 0.659 18769 970 1 11 . 1 1 6 6 ASN H H 6 7.994 7.994 7.876 0.118 18769 971 1 11 . 1 1 7 7 SER HA H 7 4.429 4.429 4.233 0.196 18769 972 1 11 . 1 1 7 7 SER CA C 7 62.214 62.214 62.173 0.041 18769 973 1 11 . 1 1 7 7 SER CB C 7 64.026 64.026 63.198 0.828 18769 974 1 11 . 1 1 7 7 SER H H 7 8.222 8.222 8.065 0.157 18769 975 1 11 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.441 -0.011 18769 976 1 11 . 1 1 8 8 TYR CA C 8 61.958 61.958 60.549 1.409 18769 977 1 11 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.461 0.479 18769 978 1 11 . 1 1 8 8 TYR H H 8 8.191 8.191 7.984 0.207 18769 979 1 11 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.470 0.588 18769 980 1 11 . 1 1 9 9 LEU CA C 9 58.791 58.791 57.841 0.950 18769 981 1 11 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.710 0.818 18769 982 1 11 . 1 1 9 9 LEU H H 9 8.306 8.306 7.658 0.648 18769 983 1 11 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.358 0.252 18769 984 1 11 . 1 1 10 10 TRP CA C 10 61.451 61.451 61.382 0.069 18769 985 1 11 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.391 0.652 18769 986 1 11 . 1 1 10 10 TRP H H 10 8.281 8.281 8.718 -0.437 18769 987 1 11 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.310 0.689 18769 988 1 11 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.178 0.905 18769 989 1 11 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.167 1.263 18769 990 1 11 . 1 1 11 11 GLN H H 11 8.275 8.275 7.846 0.429 18769 991 1 11 . 1 1 12 12 ARG HA H 12 4.072 4.072 3.957 0.116 18769 992 1 11 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.113 0.742 18769 993 1 11 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.352 0.936 18769 994 1 11 . 1 1 12 12 ARG H H 12 8.158 8.158 8.019 0.139 18769 995 1 11 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.205 0.208 18769 996 1 11 . 1 1 13 13 TRP CA C 13 62.193 62.193 59.606 2.587 18769 997 1 11 . 1 1 13 13 TRP CB C 13 29.421 29.421 29.541 -0.120 18769 998 1 11 . 1 1 13 13 TRP H H 13 8.425 8.425 7.477 0.948 18769 999 1 11 . 1 1 14 14 GLU HA H 14 3.698 3.698 3.632 0.066 18769 1000 1 11 . 1 1 14 14 GLU CA C 14 59.978 59.978 59.447 0.531 18769 1001 1 11 . 1 1 14 14 GLU CB C 14 28.680 28.680 29.279 -0.599 18769 1002 1 11 . 1 1 14 14 GLU H H 14 8.774 8.774 7.706 1.068 18769 1003 1 11 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.514 -0.019 18769 1004 1 11 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.622 0.944 18769 1005 1 11 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.701 1.327 18769 1006 1 11 . 1 1 15 15 ASN H H 15 8.059 8.059 8.699 -0.640 18769 1007 1 11 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.319 -0.081 18769 1008 1 11 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.850 1.395 18769 1009 1 11 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.576 -0.385 18769 1010 1 11 . 1 1 16 16 TRP H H 16 8.071 8.071 8.013 0.058 18769 1011 1 11 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.404 0.042 18769 1012 1 11 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.229 0.797 18769 1013 1 11 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.846 0.759 18769 1014 1 11 . 1 1 17 17 PHE H H 17 8.768 8.768 7.993 0.775 18769 1015 1 11 . 1 1 18 18 TRP HA H 18 4.223 4.223 4.332 -0.109 18769 1016 1 11 . 1 1 18 18 TRP CA C 18 60.815 60.815 58.429 2.385 18769 1017 1 11 . 1 1 18 18 TRP CB C 18 29.900 29.900 29.304 0.596 18769 1018 1 11 . 1 1 18 18 TRP H H 18 8.456 8.456 8.607 -0.151 18769 1019 1 11 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.801 -0.470 18769 1020 1 11 . 1 1 19 19 ASN CA C 19 57.260 57.260 55.363 1.897 18769 1021 1 11 . 1 1 19 19 ASN CB C 19 40.029 40.029 40.261 -0.232 18769 1022 1 11 . 1 1 19 19 ASN H H 19 7.768 7.768 7.483 0.285 18769 1023 1 11 . 1 1 20 20 VAL HA H 20 3.728 3.728 3.934 -0.206 18769 1024 1 11 . 1 1 20 20 VAL CA C 20 65.593 65.593 64.396 1.197 18769 1025 1 11 . 1 1 20 20 VAL CB C 20 32.363 32.363 31.779 0.584 18769 1026 1 11 . 1 1 20 20 VAL H H 20 7.983 7.983 8.064 -0.081 18769 1027 1 11 . 1 1 21 21 THR HA H 21 3.886 3.886 3.910 -0.024 18769 1028 1 11 . 1 1 21 21 THR CA C 21 65.003 65.003 64.560 0.443 18769 1029 1 11 . 1 1 21 21 THR CB C 21 69.837 69.837 68.356 1.481 18769 1030 1 11 . 1 1 21 21 THR H H 21 7.523 7.523 7.328 0.195 18769 1031 1 11 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.222 0.089 18769 1032 1 11 . 1 1 22 22 LEU CA C 22 56.094 56.094 55.984 0.110 18769 1033 1 11 . 1 1 22 22 LEU CB C 22 42.641 42.641 42.476 0.165 18769 1034 1 11 . 1 1 22 22 LEU H H 22 7.598 7.598 7.311 0.287 18769 1035 1 11 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.061 0.309 18769 1036 1 11 . 1 1 23 23 ARG CA C 23 56.977 56.977 55.950 1.028 18769 1037 1 11 . 1 1 23 23 ARG CB C 23 30.139 30.139 28.945 1.194 18769 1038 1 11 . 1 1 23 23 ARG H H 23 7.480 7.480 8.303 -0.823 18769 1039 1 11 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.444 -0.053 18769 1040 1 11 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.609 2.427 18769 1041 1 11 . 1 1 24 24 PRO CB C 24 32.233 32.233 30.348 1.885 18769 1042 1 11 . 1 1 25 25 GLU HA H 25 4.352 4.352 3.930 0.422 18769 1043 1 11 . 1 1 25 25 GLU CA C 25 57.150 57.150 57.421 -0.271 18769 1044 1 11 . 1 1 25 25 GLU CB C 25 29.234 29.234 29.100 0.134 18769 1045 1 11 . 1 1 25 25 GLU H H 25 8.002 8.002 8.207 -0.205 18769 1046 1 12 . 1 1 2 2 SER HA H 2 4.611 4.611 4.818 -0.207 18769 1047 1 12 . 1 1 2 2 SER CA C 2 58.466 58.466 58.306 0.160 18769 1048 1 12 . 1 1 2 2 SER CB C 2 65.003 65.003 65.193 -0.190 18769 1049 1 12 . 1 1 2 2 SER H H 2 8.606 8.606 8.505 0.101 18769 1050 1 12 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.574 -0.220 18769 1051 1 12 . 1 1 3 3 ALA CA C 3 54.477 54.477 53.333 1.144 18769 1052 1 12 . 1 1 3 3 ALA CB C 3 19.356 19.356 19.166 0.190 18769 1053 1 12 . 1 1 3 3 ALA H H 3 8.654 8.654 8.702 -0.048 18769 1054 1 12 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.514 -0.244 18769 1055 1 12 . 1 1 4 4 LEU CA C 4 57.815 57.815 55.928 1.887 18769 1056 1 12 . 1 1 4 4 LEU CB C 4 43.003 43.003 42.490 0.513 18769 1057 1 12 . 1 1 4 4 LEU H H 4 7.954 7.954 7.951 0.003 18769 1058 1 12 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.253 -0.374 18769 1059 1 12 . 1 1 5 5 VAL CA C 5 65.477 65.477 64.327 1.150 18769 1060 1 12 . 1 1 5 5 VAL CB C 5 33.015 33.015 32.803 0.212 18769 1061 1 12 . 1 1 5 5 VAL H H 5 7.494 7.494 7.855 -0.361 18769 1062 1 12 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.465 0.169 18769 1063 1 12 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.979 -0.893 18769 1064 1 12 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.270 0.738 18769 1065 1 12 . 1 1 6 6 ASN H H 6 7.994 7.994 8.285 -0.291 18769 1066 1 12 . 1 1 7 7 SER HA H 7 4.429 4.429 4.313 0.116 18769 1067 1 12 . 1 1 7 7 SER CA C 7 62.214 62.214 61.937 0.277 18769 1068 1 12 . 1 1 7 7 SER CB C 7 64.026 64.026 63.266 0.760 18769 1069 1 12 . 1 1 7 7 SER H H 7 8.222 8.222 8.225 -0.003 18769 1070 1 12 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.390 0.040 18769 1071 1 12 . 1 1 8 8 TYR CA C 8 61.958 61.958 60.562 1.396 18769 1072 1 12 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.326 0.614 18769 1073 1 12 . 1 1 8 8 TYR H H 8 8.191 8.191 8.233 -0.042 18769 1074 1 12 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.633 0.425 18769 1075 1 12 . 1 1 9 9 LEU CA C 9 58.791 58.791 58.542 0.249 18769 1076 1 12 . 1 1 9 9 LEU CB C 9 42.528 42.528 40.922 1.607 18769 1077 1 12 . 1 1 9 9 LEU H H 9 8.306 8.306 8.401 -0.095 18769 1078 1 12 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.519 0.091 18769 1079 1 12 . 1 1 10 10 TRP CA C 10 61.451 61.451 60.715 0.736 18769 1080 1 12 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.584 0.459 18769 1081 1 12 . 1 1 10 10 TRP H H 10 8.281 8.281 7.963 0.318 18769 1082 1 12 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.357 0.642 18769 1083 1 12 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.444 0.639 18769 1084 1 12 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.343 1.087 18769 1085 1 12 . 1 1 11 11 GLN H H 11 8.275 8.275 8.237 0.038 18769 1086 1 12 . 1 1 12 12 ARG HA H 12 4.072 4.072 3.975 0.097 18769 1087 1 12 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.495 0.360 18769 1088 1 12 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.502 0.787 18769 1089 1 12 . 1 1 12 12 ARG H H 12 8.158 8.158 8.154 0.004 18769 1090 1 12 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.216 0.197 18769 1091 1 12 . 1 1 13 13 TRP CA C 13 62.193 62.193 59.500 2.693 18769 1092 1 12 . 1 1 13 13 TRP CB C 13 29.421 29.421 29.525 -0.104 18769 1093 1 12 . 1 1 13 13 TRP H H 13 8.425 8.425 7.315 1.110 18769 1094 1 12 . 1 1 14 14 GLU HA H 14 3.698 3.698 3.684 0.014 18769 1095 1 12 . 1 1 14 14 GLU CA C 14 59.978 59.978 59.424 0.554 18769 1096 1 12 . 1 1 14 14 GLU CB C 14 28.680 28.680 29.082 -0.402 18769 1097 1 12 . 1 1 14 14 GLU H H 14 8.774 8.774 7.735 1.039 18769 1098 1 12 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.559 -0.064 18769 1099 1 12 . 1 1 15 15 ASN CA C 15 57.566 57.566 57.270 0.296 18769 1100 1 12 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.694 1.334 18769 1101 1 12 . 1 1 15 15 ASN H H 15 8.059 8.059 8.815 -0.756 18769 1102 1 12 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.399 -0.161 18769 1103 1 12 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.782 1.463 18769 1104 1 12 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.574 -0.383 18769 1105 1 12 . 1 1 16 16 TRP H H 16 8.071 8.071 7.986 0.085 18769 1106 1 12 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.060 0.386 18769 1107 1 12 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.594 0.432 18769 1108 1 12 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.539 1.066 18769 1109 1 12 . 1 1 17 17 PHE H H 17 8.768 8.768 7.950 0.818 18769 1110 1 12 . 1 1 18 18 TRP HA H 18 4.223 4.223 4.031 0.192 18769 1111 1 12 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.049 1.766 18769 1112 1 12 . 1 1 18 18 TRP CB C 18 29.900 29.900 29.466 0.434 18769 1113 1 12 . 1 1 18 18 TRP H H 18 8.456 8.456 8.665 -0.209 18769 1114 1 12 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.465 -0.134 18769 1115 1 12 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.546 0.714 18769 1116 1 12 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.716 1.313 18769 1117 1 12 . 1 1 19 19 ASN H H 19 7.768 7.768 8.253 -0.485 18769 1118 1 12 . 1 1 20 20 VAL HA H 20 3.728 3.728 3.690 0.038 18769 1119 1 12 . 1 1 20 20 VAL CA C 20 65.593 65.593 65.384 0.209 18769 1120 1 12 . 1 1 20 20 VAL CB C 20 32.363 32.363 31.735 0.628 18769 1121 1 12 . 1 1 20 20 VAL H H 20 7.983 7.983 8.135 -0.152 18769 1122 1 12 . 1 1 21 21 THR HA H 21 3.886 3.886 3.976 -0.090 18769 1123 1 12 . 1 1 21 21 THR CA C 21 65.003 65.003 65.307 -0.304 18769 1124 1 12 . 1 1 21 21 THR CB C 21 69.837 69.837 68.818 1.019 18769 1125 1 12 . 1 1 21 21 THR H H 21 7.523 7.523 7.375 0.148 18769 1126 1 12 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.385 -0.074 18769 1127 1 12 . 1 1 22 22 LEU CA C 22 56.094 56.094 54.969 1.125 18769 1128 1 12 . 1 1 22 22 LEU CB C 22 42.641 42.641 42.822 -0.181 18769 1129 1 12 . 1 1 22 22 LEU H H 22 7.598 7.598 7.895 -0.297 18769 1130 1 12 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.206 0.164 18769 1131 1 12 . 1 1 23 23 ARG CA C 23 56.977 56.977 55.733 1.244 18769 1132 1 12 . 1 1 23 23 ARG CB C 23 30.139 30.139 28.979 1.160 18769 1133 1 12 . 1 1 23 23 ARG H H 23 7.480 7.480 7.415 0.065 18769 1134 1 12 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.650 -0.259 18769 1135 1 12 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.758 2.278 18769 1136 1 12 . 1 1 24 24 PRO CB C 24 32.233 32.233 32.725 -0.492 18769 1137 1 12 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.349 0.003 18769 1138 1 12 . 1 1 25 25 GLU CA C 25 57.150 57.150 56.963 0.187 18769 1139 1 12 . 1 1 25 25 GLU CB C 25 29.234 29.234 30.181 -0.947 18769 1140 1 12 . 1 1 25 25 GLU H H 25 8.002 8.002 8.602 -0.600 18769 1141 1 13 . 1 1 2 2 SER HA H 2 4.611 4.611 4.891 -0.280 18769 1142 1 13 . 1 1 2 2 SER CA C 2 58.466 58.466 57.184 1.282 18769 1143 1 13 . 1 1 2 2 SER CB C 2 65.003 65.003 64.662 0.341 18769 1144 1 13 . 1 1 2 2 SER H H 2 8.606 8.606 8.797 -0.191 18769 1145 1 13 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.525 -0.171 18769 1146 1 13 . 1 1 3 3 ALA CA C 3 54.477 54.477 54.006 0.471 18769 1147 1 13 . 1 1 3 3 ALA CB C 3 19.356 19.356 18.931 0.425 18769 1148 1 13 . 1 1 3 3 ALA H H 3 8.654 8.654 8.499 0.155 18769 1149 1 13 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.500 -0.230 18769 1150 1 13 . 1 1 4 4 LEU CA C 4 57.815 57.815 55.336 2.479 18769 1151 1 13 . 1 1 4 4 LEU CB C 4 43.003 43.003 42.510 0.493 18769 1152 1 13 . 1 1 4 4 LEU H H 4 7.954 7.954 8.156 -0.202 18769 1153 1 13 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.190 -0.311 18769 1154 1 13 . 1 1 5 5 VAL CA C 5 65.477 65.477 63.651 1.826 18769 1155 1 13 . 1 1 5 5 VAL CB C 5 33.015 33.015 33.013 0.002 18769 1156 1 13 . 1 1 5 5 VAL H H 5 7.494 7.494 7.634 -0.140 18769 1157 1 13 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.533 0.101 18769 1158 1 13 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.952 -0.866 18769 1159 1 13 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.314 0.694 18769 1160 1 13 . 1 1 6 6 ASN H H 6 7.994 7.994 8.273 -0.279 18769 1161 1 13 . 1 1 7 7 SER HA H 7 4.429 4.429 4.368 0.061 18769 1162 1 13 . 1 1 7 7 SER CA C 7 62.214 62.214 62.391 -0.177 18769 1163 1 13 . 1 1 7 7 SER CB C 7 64.026 64.026 63.326 0.700 18769 1164 1 13 . 1 1 7 7 SER H H 7 8.222 8.222 8.361 -0.139 18769 1165 1 13 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.419 0.011 18769 1166 1 13 . 1 1 8 8 TYR CA C 8 61.958 61.958 60.915 1.043 18769 1167 1 13 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.456 0.484 18769 1168 1 13 . 1 1 8 8 TYR H H 8 8.191 8.191 7.704 0.487 18769 1169 1 13 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.683 0.375 18769 1170 1 13 . 1 1 9 9 LEU CA C 9 58.791 58.791 58.182 0.609 18769 1171 1 13 . 1 1 9 9 LEU CB C 9 42.528 42.528 40.956 1.571 18769 1172 1 13 . 1 1 9 9 LEU H H 9 8.306 8.306 7.801 0.505 18769 1173 1 13 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.324 0.286 18769 1174 1 13 . 1 1 10 10 TRP CA C 10 61.451 61.451 60.872 0.579 18769 1175 1 13 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.400 0.643 18769 1176 1 13 . 1 1 10 10 TRP H H 10 8.281 8.281 8.854 -0.573 18769 1177 1 13 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.284 0.715 18769 1178 1 13 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.141 0.943 18769 1179 1 13 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.078 1.352 18769 1180 1 13 . 1 1 11 11 GLN H H 11 8.275 8.275 8.112 0.163 18769 1181 1 13 . 1 1 12 12 ARG HA H 12 4.072 4.072 4.025 0.047 18769 1182 1 13 . 1 1 12 12 ARG CA C 12 59.855 59.855 58.821 1.034 18769 1183 1 13 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.496 0.792 18769 1184 1 13 . 1 1 12 12 ARG H H 12 8.158 8.158 8.053 0.105 18769 1185 1 13 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.356 0.057 18769 1186 1 13 . 1 1 13 13 TRP CA C 13 62.193 62.193 59.094 3.099 18769 1187 1 13 . 1 1 13 13 TRP CB C 13 29.421 29.421 29.986 -0.565 18769 1188 1 13 . 1 1 13 13 TRP H H 13 8.425 8.425 7.530 0.895 18769 1189 1 13 . 1 1 14 14 GLU HA H 14 3.698 3.698 3.601 0.097 18769 1190 1 13 . 1 1 14 14 GLU CA C 14 59.978 59.978 59.626 0.352 18769 1191 1 13 . 1 1 14 14 GLU CB C 14 28.680 28.680 29.115 -0.435 18769 1192 1 13 . 1 1 14 14 GLU H H 14 8.774 8.774 7.630 1.144 18769 1193 1 13 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.513 -0.019 18769 1194 1 13 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.837 0.729 18769 1195 1 13 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.714 1.314 18769 1196 1 13 . 1 1 15 15 ASN H H 15 8.059 8.059 8.746 -0.687 18769 1197 1 13 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.349 -0.111 18769 1198 1 13 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.628 1.617 18769 1199 1 13 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.425 -0.234 18769 1200 1 13 . 1 1 16 16 TRP H H 16 8.071 8.071 7.650 0.421 18769 1201 1 13 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.019 0.427 18769 1202 1 13 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.760 0.266 18769 1203 1 13 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.346 1.259 18769 1204 1 13 . 1 1 17 17 PHE H H 17 8.768 8.768 7.718 1.050 18769 1205 1 13 . 1 1 18 18 TRP HA H 18 4.223 4.223 3.916 0.307 18769 1206 1 13 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.587 1.228 18769 1207 1 13 . 1 1 18 18 TRP CB C 18 29.900 29.900 28.925 0.975 18769 1208 1 13 . 1 1 18 18 TRP H H 18 8.456 8.456 8.469 -0.013 18769 1209 1 13 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.359 -0.028 18769 1210 1 13 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.763 0.497 18769 1211 1 13 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.769 1.260 18769 1212 1 13 . 1 1 19 19 ASN H H 19 7.768 7.768 8.100 -0.332 18769 1213 1 13 . 1 1 20 20 VAL HA H 20 3.728 3.728 3.976 -0.248 18769 1214 1 13 . 1 1 20 20 VAL CA C 20 65.593 65.593 64.547 1.046 18769 1215 1 13 . 1 1 20 20 VAL CB C 20 32.363 32.363 31.753 0.610 18769 1216 1 13 . 1 1 20 20 VAL H H 20 7.983 7.983 7.283 0.700 18769 1217 1 13 . 1 1 21 21 THR HA H 21 3.886 3.886 3.840 0.046 18769 1218 1 13 . 1 1 21 21 THR CA C 21 65.003 65.003 66.042 -1.039 18769 1219 1 13 . 1 1 21 21 THR CB C 21 69.837 69.837 68.780 1.057 18769 1220 1 13 . 1 1 21 21 THR H H 21 7.523 7.523 7.768 -0.245 18769 1221 1 13 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.219 0.092 18769 1222 1 13 . 1 1 22 22 LEU CA C 22 56.094 56.094 56.634 -0.540 18769 1223 1 13 . 1 1 22 22 LEU CB C 22 42.641 42.641 42.694 -0.053 18769 1224 1 13 . 1 1 22 22 LEU H H 22 7.598 7.598 7.928 -0.330 18769 1225 1 13 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.618 -0.248 18769 1226 1 13 . 1 1 23 23 ARG CA C 23 56.977 56.977 53.508 3.469 18769 1227 1 13 . 1 1 23 23 ARG CB C 23 30.139 30.139 32.070 -1.931 18769 1228 1 13 . 1 1 23 23 ARG H H 23 7.480 7.480 7.793 -0.313 18769 1229 1 13 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.728 -0.337 18769 1230 1 13 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.585 2.451 18769 1231 1 13 . 1 1 24 24 PRO CB C 24 32.233 32.233 32.809 -0.576 18769 1232 1 13 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.200 0.152 18769 1233 1 13 . 1 1 25 25 GLU CA C 25 57.150 57.150 57.581 -0.431 18769 1234 1 13 . 1 1 25 25 GLU CB C 25 29.234 29.234 30.349 -1.115 18769 1235 1 13 . 1 1 25 25 GLU H H 25 8.002 8.002 8.870 -0.868 18769 1236 1 14 . 1 1 2 2 SER HA H 2 4.611 4.611 4.846 -0.235 18769 1237 1 14 . 1 1 2 2 SER CA C 2 58.466 58.466 58.087 0.379 18769 1238 1 14 . 1 1 2 2 SER CB C 2 65.003 65.003 64.678 0.325 18769 1239 1 14 . 1 1 2 2 SER H H 2 8.606 8.606 8.235 0.371 18769 1240 1 14 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.500 -0.145 18769 1241 1 14 . 1 1 3 3 ALA CA C 3 54.477 54.477 53.091 1.386 18769 1242 1 14 . 1 1 3 3 ALA CB C 3 19.356 19.356 18.928 0.428 18769 1243 1 14 . 1 1 3 3 ALA H H 3 8.654 8.654 8.642 0.012 18769 1244 1 14 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.387 -0.117 18769 1245 1 14 . 1 1 4 4 LEU CA C 4 57.815 57.815 56.591 1.224 18769 1246 1 14 . 1 1 4 4 LEU CB C 4 43.003 43.003 42.000 1.003 18769 1247 1 14 . 1 1 4 4 LEU H H 4 7.954 7.954 8.106 -0.152 18769 1248 1 14 . 1 1 5 5 VAL HA H 5 3.879 3.879 3.845 0.034 18769 1249 1 14 . 1 1 5 5 VAL CA C 5 65.477 65.477 65.987 -0.511 18769 1250 1 14 . 1 1 5 5 VAL CB C 5 33.015 33.015 31.088 1.927 18769 1251 1 14 . 1 1 5 5 VAL H H 5 7.494 7.494 8.266 -0.772 18769 1252 1 14 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.615 0.019 18769 1253 1 14 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.540 -0.454 18769 1254 1 14 . 1 1 6 6 ASN CB C 6 39.008 39.008 37.954 1.054 18769 1255 1 14 . 1 1 6 6 ASN H H 6 7.994 7.994 8.744 -0.750 18769 1256 1 14 . 1 1 7 7 SER HA H 7 4.429 4.429 4.437 -0.008 18769 1257 1 14 . 1 1 7 7 SER CA C 7 62.214 62.214 62.526 -0.312 18769 1258 1 14 . 1 1 7 7 SER CB C 7 64.026 64.026 63.050 0.976 18769 1259 1 14 . 1 1 7 7 SER H H 7 8.222 8.222 7.604 0.618 18769 1260 1 14 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.285 0.145 18769 1261 1 14 . 1 1 8 8 TYR CA C 8 61.958 61.958 61.338 0.620 18769 1262 1 14 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.464 0.476 18769 1263 1 14 . 1 1 8 8 TYR H H 8 8.191 8.191 7.947 0.244 18769 1264 1 14 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.603 0.455 18769 1265 1 14 . 1 1 9 9 LEU CA C 9 58.791 58.791 58.403 0.388 18769 1266 1 14 . 1 1 9 9 LEU CB C 9 42.528 42.528 40.826 1.702 18769 1267 1 14 . 1 1 9 9 LEU H H 9 8.306 8.306 8.550 -0.244 18769 1268 1 14 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.400 0.210 18769 1269 1 14 . 1 1 10 10 TRP CA C 10 61.451 61.451 61.121 0.330 18769 1270 1 14 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.334 0.709 18769 1271 1 14 . 1 1 10 10 TRP H H 10 8.281 8.281 8.844 -0.563 18769 1272 1 14 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.499 0.500 18769 1273 1 14 . 1 1 11 11 GLN CA C 11 60.083 60.083 58.984 1.099 18769 1274 1 14 . 1 1 11 11 GLN CB C 11 29.430 29.430 27.929 1.501 18769 1275 1 14 . 1 1 11 11 GLN H H 11 8.275 8.275 8.346 -0.071 18769 1276 1 14 . 1 1 12 12 ARG HA H 12 4.072 4.072 3.991 0.081 18769 1277 1 14 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.154 0.701 18769 1278 1 14 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.584 0.704 18769 1279 1 14 . 1 1 12 12 ARG H H 12 8.158 8.158 8.262 -0.104 18769 1280 1 14 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.298 0.115 18769 1281 1 14 . 1 1 13 13 TRP CA C 13 62.193 62.193 59.761 2.432 18769 1282 1 14 . 1 1 13 13 TRP CB C 13 29.421 29.421 29.671 -0.250 18769 1283 1 14 . 1 1 13 13 TRP H H 13 8.425 8.425 7.598 0.827 18769 1284 1 14 . 1 1 14 14 GLU HA H 14 3.698 3.698 4.047 -0.349 18769 1285 1 14 . 1 1 14 14 GLU CA C 14 59.978 59.978 59.563 0.415 18769 1286 1 14 . 1 1 14 14 GLU CB C 14 28.680 28.680 29.493 -0.813 18769 1287 1 14 . 1 1 14 14 GLU H H 14 8.774 8.774 7.765 1.009 18769 1288 1 14 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.632 -0.137 18769 1289 1 14 . 1 1 15 15 ASN CA C 15 57.566 57.566 57.048 0.518 18769 1290 1 14 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.812 1.216 18769 1291 1 14 . 1 1 15 15 ASN H H 15 8.059 8.059 8.848 -0.789 18769 1292 1 14 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.305 -0.067 18769 1293 1 14 . 1 1 16 16 TRP CA C 16 62.245 62.245 61.189 1.056 18769 1294 1 14 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.366 -0.176 18769 1295 1 14 . 1 1 16 16 TRP H H 16 8.071 8.071 8.073 -0.002 18769 1296 1 14 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.162 0.284 18769 1297 1 14 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.175 0.851 18769 1298 1 14 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.414 1.191 18769 1299 1 14 . 1 1 17 17 PHE H H 17 8.768 8.768 7.717 1.051 18769 1300 1 14 . 1 1 18 18 TRP HA H 18 4.223 4.223 3.796 0.427 18769 1301 1 14 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.924 0.891 18769 1302 1 14 . 1 1 18 18 TRP CB C 18 29.900 29.900 28.992 0.908 18769 1303 1 14 . 1 1 18 18 TRP H H 18 8.456 8.456 8.310 0.146 18769 1304 1 14 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.481 -0.150 18769 1305 1 14 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.006 1.254 18769 1306 1 14 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.404 1.625 18769 1307 1 14 . 1 1 19 19 ASN H H 19 7.768 7.768 7.990 -0.222 18769 1308 1 14 . 1 1 20 20 VAL HA H 20 3.728 3.728 4.116 -0.388 18769 1309 1 14 . 1 1 20 20 VAL CA C 20 65.593 65.593 63.786 1.806 18769 1310 1 14 . 1 1 20 20 VAL CB C 20 32.363 32.363 31.581 0.782 18769 1311 1 14 . 1 1 20 20 VAL H H 20 7.983 7.983 7.474 0.509 18769 1312 1 14 . 1 1 21 21 THR HA H 21 3.886 3.886 4.004 -0.118 18769 1313 1 14 . 1 1 21 21 THR CA C 21 65.003 65.003 64.600 0.403 18769 1314 1 14 . 1 1 21 21 THR CB C 21 69.837 69.837 69.285 0.552 18769 1315 1 14 . 1 1 21 21 THR H H 21 7.523 7.523 7.450 0.073 18769 1316 1 14 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.395 -0.084 18769 1317 1 14 . 1 1 22 22 LEU CA C 22 56.094 56.094 56.151 -0.057 18769 1318 1 14 . 1 1 22 22 LEU CB C 22 42.641 42.641 43.399 -0.758 18769 1319 1 14 . 1 1 22 22 LEU H H 22 7.598 7.598 7.906 -0.308 18769 1320 1 14 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.577 -0.207 18769 1321 1 14 . 1 1 23 23 ARG CA C 23 56.977 56.977 54.065 2.912 18769 1322 1 14 . 1 1 23 23 ARG CB C 23 30.139 30.139 32.517 -2.378 18769 1323 1 14 . 1 1 23 23 ARG H H 23 7.480 7.480 8.170 -0.690 18769 1324 1 14 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.682 -0.291 18769 1325 1 14 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.772 2.264 18769 1326 1 14 . 1 1 24 24 PRO CB C 24 32.233 32.233 32.736 -0.503 18769 1327 1 14 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.426 -0.074 18769 1328 1 14 . 1 1 25 25 GLU CA C 25 57.150 57.150 57.054 0.096 18769 1329 1 14 . 1 1 25 25 GLU CB C 25 29.234 29.234 30.343 -1.109 18769 1330 1 14 . 1 1 25 25 GLU H H 25 8.002 8.002 8.621 -0.619 18769 1331 1 15 . 1 1 2 2 SER HA H 2 4.611 4.611 4.620 -0.009 18769 1332 1 15 . 1 1 2 2 SER CA C 2 58.466 58.466 58.273 0.193 18769 1333 1 15 . 1 1 2 2 SER CB C 2 65.003 65.003 64.116 0.887 18769 1334 1 15 . 1 1 2 2 SER H H 2 8.606 8.606 8.603 0.003 18769 1335 1 15 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.584 -0.230 18769 1336 1 15 . 1 1 3 3 ALA CA C 3 54.477 54.477 53.042 1.435 18769 1337 1 15 . 1 1 3 3 ALA CB C 3 19.356 19.356 19.219 0.137 18769 1338 1 15 . 1 1 3 3 ALA H H 3 8.654 8.654 8.594 0.060 18769 1339 1 15 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.415 -0.145 18769 1340 1 15 . 1 1 4 4 LEU CA C 4 57.815 57.815 55.886 1.929 18769 1341 1 15 . 1 1 4 4 LEU CB C 4 43.003 43.003 41.871 1.132 18769 1342 1 15 . 1 1 4 4 LEU H H 4 7.954 7.954 8.094 -0.140 18769 1343 1 15 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.283 -0.404 18769 1344 1 15 . 1 1 5 5 VAL CA C 5 65.477 65.477 64.673 0.804 18769 1345 1 15 . 1 1 5 5 VAL CB C 5 33.015 33.015 32.668 0.347 18769 1346 1 15 . 1 1 5 5 VAL H H 5 7.494 7.494 7.750 -0.256 18769 1347 1 15 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.699 -0.065 18769 1348 1 15 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.222 -0.136 18769 1349 1 15 . 1 1 6 6 ASN CB C 6 39.008 39.008 39.031 -0.023 18769 1350 1 15 . 1 1 6 6 ASN H H 6 7.994 7.994 8.105 -0.111 18769 1351 1 15 . 1 1 7 7 SER HA H 7 4.429 4.429 4.231 0.198 18769 1352 1 15 . 1 1 7 7 SER CA C 7 62.214 62.214 62.201 0.013 18769 1353 1 15 . 1 1 7 7 SER CB C 7 64.026 64.026 63.377 0.649 18769 1354 1 15 . 1 1 7 7 SER H H 7 8.222 8.222 7.768 0.454 18769 1355 1 15 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.366 0.064 18769 1356 1 15 . 1 1 8 8 TYR CA C 8 61.958 61.958 60.278 1.680 18769 1357 1 15 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.034 0.906 18769 1358 1 15 . 1 1 8 8 TYR H H 8 8.191 8.191 8.541 -0.350 18769 1359 1 15 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.381 0.677 18769 1360 1 15 . 1 1 9 9 LEU CA C 9 58.791 58.791 57.498 1.293 18769 1361 1 15 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.387 1.141 18769 1362 1 15 . 1 1 9 9 LEU H H 9 8.306 8.306 7.269 1.037 18769 1363 1 15 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.152 0.458 18769 1364 1 15 . 1 1 10 10 TRP CA C 10 61.451 61.451 59.570 1.881 18769 1365 1 15 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.792 0.251 18769 1366 1 15 . 1 1 10 10 TRP H H 10 8.281 8.281 8.284 -0.003 18769 1367 1 15 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.714 0.285 18769 1368 1 15 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.836 0.247 18769 1369 1 15 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.489 0.941 18769 1370 1 15 . 1 1 11 11 GLN H H 11 8.275 8.275 7.971 0.304 18769 1371 1 15 . 1 1 12 12 ARG HA H 12 4.072 4.072 3.966 0.105 18769 1372 1 15 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.581 0.274 18769 1373 1 15 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.780 0.508 18769 1374 1 15 . 1 1 12 12 ARG H H 12 8.158 8.158 7.670 0.488 18769 1375 1 15 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.249 0.164 18769 1376 1 15 . 1 1 13 13 TRP CA C 13 62.193 62.193 59.737 2.455 18769 1377 1 15 . 1 1 13 13 TRP CB C 13 29.421 29.421 29.709 -0.288 18769 1378 1 15 . 1 1 13 13 TRP H H 13 8.425 8.425 7.544 0.881 18769 1379 1 15 . 1 1 14 14 GLU HA H 14 3.698 3.698 3.659 0.039 18769 1380 1 15 . 1 1 14 14 GLU CA C 14 59.978 59.978 59.506 0.472 18769 1381 1 15 . 1 1 14 14 GLU CB C 14 28.680 28.680 29.172 -0.492 18769 1382 1 15 . 1 1 14 14 GLU H H 14 8.774 8.774 7.478 1.296 18769 1383 1 15 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.562 -0.067 18769 1384 1 15 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.774 0.792 18769 1385 1 15 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.725 1.302 18769 1386 1 15 . 1 1 15 15 ASN H H 15 8.059 8.059 8.798 -0.739 18769 1387 1 15 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.330 -0.092 18769 1388 1 15 . 1 1 16 16 TRP CA C 16 62.245 62.245 61.052 1.193 18769 1389 1 15 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.459 -0.268 18769 1390 1 15 . 1 1 16 16 TRP H H 16 8.071 8.071 7.976 0.095 18769 1391 1 15 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.057 0.389 18769 1392 1 15 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.310 0.716 18769 1393 1 15 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.499 1.106 18769 1394 1 15 . 1 1 17 17 PHE H H 17 8.768 8.768 7.799 0.969 18769 1395 1 15 . 1 1 18 18 TRP HA H 18 4.223 4.223 4.005 0.218 18769 1396 1 15 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.116 1.699 18769 1397 1 15 . 1 1 18 18 TRP CB C 18 29.900 29.900 29.147 0.753 18769 1398 1 15 . 1 1 18 18 TRP H H 18 8.456 8.456 8.589 -0.133 18769 1399 1 15 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.493 -0.162 18769 1400 1 15 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.488 0.772 18769 1401 1 15 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.837 1.192 18769 1402 1 15 . 1 1 19 19 ASN H H 19 7.768 7.768 7.989 -0.221 18769 1403 1 15 . 1 1 20 20 VAL HA H 20 3.728 3.728 4.049 -0.321 18769 1404 1 15 . 1 1 20 20 VAL CA C 20 65.593 65.593 64.923 0.670 18769 1405 1 15 . 1 1 20 20 VAL CB C 20 32.363 32.363 31.408 0.955 18769 1406 1 15 . 1 1 20 20 VAL H H 20 7.983 7.983 7.751 0.232 18769 1407 1 15 . 1 1 21 21 THR HA H 21 3.886 3.886 3.913 -0.027 18769 1408 1 15 . 1 1 21 21 THR CA C 21 65.003 65.003 65.208 -0.205 18769 1409 1 15 . 1 1 21 21 THR CB C 21 69.837 69.837 68.911 0.926 18769 1410 1 15 . 1 1 21 21 THR H H 21 7.523 7.523 7.816 -0.293 18769 1411 1 15 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.327 -0.016 18769 1412 1 15 . 1 1 22 22 LEU CA C 22 56.094 56.094 54.868 1.226 18769 1413 1 15 . 1 1 22 22 LEU CB C 22 42.641 42.641 42.983 -0.342 18769 1414 1 15 . 1 1 22 22 LEU H H 22 7.598 7.598 7.580 0.018 18769 1415 1 15 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.099 0.271 18769 1416 1 15 . 1 1 23 23 ARG CA C 23 56.977 56.977 55.496 1.480 18769 1417 1 15 . 1 1 23 23 ARG CB C 23 30.139 30.139 28.989 1.150 18769 1418 1 15 . 1 1 23 23 ARG H H 23 7.480 7.480 7.488 -0.008 18769 1419 1 15 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.465 -0.074 18769 1420 1 15 . 1 1 24 24 PRO CA C 24 65.036 65.036 63.075 1.961 18769 1421 1 15 . 1 1 24 24 PRO CB C 24 32.233 32.233 31.738 0.495 18769 1422 1 15 . 1 1 25 25 GLU HA H 25 4.352 4.352 3.840 0.512 18769 1423 1 15 . 1 1 25 25 GLU CA C 25 57.150 57.150 56.696 0.454 18769 1424 1 15 . 1 1 25 25 GLU CB C 25 29.234 29.234 29.094 0.140 18769 1425 1 15 . 1 1 25 25 GLU H H 25 8.002 8.002 8.745 -0.743 18769 1426 1 16 . 1 1 2 2 SER HA H 2 4.611 4.611 4.809 -0.198 18769 1427 1 16 . 1 1 2 2 SER CA C 2 58.466 58.466 57.480 0.986 18769 1428 1 16 . 1 1 2 2 SER CB C 2 65.003 65.003 66.413 -1.410 18769 1429 1 16 . 1 1 2 2 SER H H 2 8.606 8.606 8.176 0.430 18769 1430 1 16 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.221 0.133 18769 1431 1 16 . 1 1 3 3 ALA CA C 3 54.477 54.477 54.785 -0.308 18769 1432 1 16 . 1 1 3 3 ALA CB C 3 19.356 19.356 18.812 0.544 18769 1433 1 16 . 1 1 3 3 ALA H H 3 8.654 8.654 8.803 -0.149 18769 1434 1 16 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.202 0.068 18769 1435 1 16 . 1 1 4 4 LEU CA C 4 57.815 57.815 57.190 0.625 18769 1436 1 16 . 1 1 4 4 LEU CB C 4 43.003 43.003 41.795 1.208 18769 1437 1 16 . 1 1 4 4 LEU H H 4 7.954 7.954 8.123 -0.169 18769 1438 1 16 . 1 1 5 5 VAL HA H 5 3.879 3.879 3.674 0.205 18769 1439 1 16 . 1 1 5 5 VAL CA C 5 65.477 65.477 66.468 -0.991 18769 1440 1 16 . 1 1 5 5 VAL CB C 5 33.015 33.015 31.583 1.432 18769 1441 1 16 . 1 1 5 5 VAL H H 5 7.494 7.494 7.768 -0.274 18769 1442 1 16 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.515 0.119 18769 1443 1 16 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.466 -0.380 18769 1444 1 16 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.377 0.631 18769 1445 1 16 . 1 1 6 6 ASN H H 6 7.994 7.994 8.596 -0.602 18769 1446 1 16 . 1 1 7 7 SER HA H 7 4.429 4.429 4.247 0.182 18769 1447 1 16 . 1 1 7 7 SER CA C 7 62.214 62.214 61.782 0.432 18769 1448 1 16 . 1 1 7 7 SER CB C 7 64.026 64.026 63.324 0.702 18769 1449 1 16 . 1 1 7 7 SER H H 7 8.222 8.222 7.968 0.254 18769 1450 1 16 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.423 0.007 18769 1451 1 16 . 1 1 8 8 TYR CA C 8 61.958 61.958 60.833 1.125 18769 1452 1 16 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.864 0.076 18769 1453 1 16 . 1 1 8 8 TYR H H 8 8.191 8.191 7.687 0.504 18769 1454 1 16 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.703 0.355 18769 1455 1 16 . 1 1 9 9 LEU CA C 9 58.791 58.791 58.314 0.477 18769 1456 1 16 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.765 0.763 18769 1457 1 16 . 1 1 9 9 LEU H H 9 8.306 8.306 8.408 -0.102 18769 1458 1 16 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.224 0.386 18769 1459 1 16 . 1 1 10 10 TRP CA C 10 61.451 61.451 60.705 0.746 18769 1460 1 16 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.662 0.381 18769 1461 1 16 . 1 1 10 10 TRP H H 10 8.281 8.281 8.474 -0.193 18769 1462 1 16 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.728 0.271 18769 1463 1 16 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.851 0.232 18769 1464 1 16 . 1 1 11 11 GLN CB C 11 29.430 29.430 27.980 1.450 18769 1465 1 16 . 1 1 11 11 GLN H H 11 8.275 8.275 7.627 0.648 18769 1466 1 16 . 1 1 12 12 ARG HA H 12 4.072 4.072 3.924 0.148 18769 1467 1 16 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.667 0.188 18769 1468 1 16 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.730 0.558 18769 1469 1 16 . 1 1 12 12 ARG H H 12 8.158 8.158 7.594 0.564 18769 1470 1 16 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.236 0.177 18769 1471 1 16 . 1 1 13 13 TRP CA C 13 62.193 62.193 59.730 2.463 18769 1472 1 16 . 1 1 13 13 TRP CB C 13 29.421 29.421 29.575 -0.154 18769 1473 1 16 . 1 1 13 13 TRP H H 13 8.425 8.425 7.856 0.569 18769 1474 1 16 . 1 1 14 14 GLU HA H 14 3.698 3.698 3.602 0.096 18769 1475 1 16 . 1 1 14 14 GLU CA C 14 59.978 59.978 59.481 0.497 18769 1476 1 16 . 1 1 14 14 GLU CB C 14 28.680 28.680 28.986 -0.306 18769 1477 1 16 . 1 1 14 14 GLU H H 14 8.774 8.774 7.520 1.254 18769 1478 1 16 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.547 -0.052 18769 1479 1 16 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.933 0.633 18769 1480 1 16 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.653 1.375 18769 1481 1 16 . 1 1 15 15 ASN H H 15 8.059 8.059 8.695 -0.636 18769 1482 1 16 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.364 -0.126 18769 1483 1 16 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.967 1.278 18769 1484 1 16 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.548 -0.357 18769 1485 1 16 . 1 1 16 16 TRP H H 16 8.071 8.071 8.058 0.013 18769 1486 1 16 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.094 0.352 18769 1487 1 16 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.371 0.655 18769 1488 1 16 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.575 1.030 18769 1489 1 16 . 1 1 17 17 PHE H H 17 8.768 8.768 7.878 0.890 18769 1490 1 16 . 1 1 18 18 TRP HA H 18 4.223 4.223 3.998 0.225 18769 1491 1 16 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.041 1.774 18769 1492 1 16 . 1 1 18 18 TRP CB C 18 29.900 29.900 29.285 0.615 18769 1493 1 16 . 1 1 18 18 TRP H H 18 8.456 8.456 8.700 -0.244 18769 1494 1 16 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.488 -0.157 18769 1495 1 16 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.535 0.725 18769 1496 1 16 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.735 1.294 18769 1497 1 16 . 1 1 19 19 ASN H H 19 7.768 7.768 8.054 -0.286 18769 1498 1 16 . 1 1 20 20 VAL HA H 20 3.728 3.728 4.069 -0.341 18769 1499 1 16 . 1 1 20 20 VAL CA C 20 65.593 65.593 64.882 0.711 18769 1500 1 16 . 1 1 20 20 VAL CB C 20 32.363 32.363 30.679 1.684 18769 1501 1 16 . 1 1 20 20 VAL H H 20 7.983 7.983 7.863 0.120 18769 1502 1 16 . 1 1 21 21 THR HA H 21 3.886 3.886 3.958 -0.072 18769 1503 1 16 . 1 1 21 21 THR CA C 21 65.003 65.003 65.290 -0.287 18769 1504 1 16 . 1 1 21 21 THR CB C 21 69.837 69.837 69.136 0.701 18769 1505 1 16 . 1 1 21 21 THR H H 21 7.523 7.523 7.762 -0.239 18769 1506 1 16 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.432 -0.121 18769 1507 1 16 . 1 1 22 22 LEU CA C 22 56.094 56.094 54.878 1.216 18769 1508 1 16 . 1 1 22 22 LEU CB C 22 42.641 42.641 43.195 -0.554 18769 1509 1 16 . 1 1 22 22 LEU H H 22 7.598 7.598 7.778 -0.180 18769 1510 1 16 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.160 0.210 18769 1511 1 16 . 1 1 23 23 ARG CA C 23 56.977 56.977 55.877 1.100 18769 1512 1 16 . 1 1 23 23 ARG CB C 23 30.139 30.139 28.729 1.410 18769 1513 1 16 . 1 1 23 23 ARG H H 23 7.480 7.480 7.488 -0.008 18769 1514 1 16 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.378 0.013 18769 1515 1 16 . 1 1 24 24 PRO CA C 24 65.036 65.036 63.140 1.896 18769 1516 1 16 . 1 1 24 24 PRO CB C 24 32.233 32.233 31.329 0.904 18769 1517 1 16 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.561 -0.209 18769 1518 1 16 . 1 1 25 25 GLU CA C 25 57.150 57.150 55.828 1.322 18769 1519 1 16 . 1 1 25 25 GLU CB C 25 29.234 29.234 31.265 -2.031 18769 1520 1 16 . 1 1 25 25 GLU H H 25 8.002 8.002 8.228 -0.226 18769 1521 1 17 . 1 1 2 2 SER HA H 2 4.611 4.611 4.750 -0.139 18769 1522 1 17 . 1 1 2 2 SER CA C 2 58.466 58.466 58.025 0.441 18769 1523 1 17 . 1 1 2 2 SER CB C 2 65.003 65.003 64.434 0.569 18769 1524 1 17 . 1 1 2 2 SER H H 2 8.606 8.606 8.408 0.198 18769 1525 1 17 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.657 -0.303 18769 1526 1 17 . 1 1 3 3 ALA CA C 3 54.477 54.477 53.532 0.945 18769 1527 1 17 . 1 1 3 3 ALA CB C 3 19.356 19.356 19.189 0.167 18769 1528 1 17 . 1 1 3 3 ALA H H 3 8.654 8.654 8.402 0.252 18769 1529 1 17 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.566 -0.296 18769 1530 1 17 . 1 1 4 4 LEU CA C 4 57.815 57.815 55.367 2.449 18769 1531 1 17 . 1 1 4 4 LEU CB C 4 43.003 43.003 43.138 -0.135 18769 1532 1 17 . 1 1 4 4 LEU H H 4 7.954 7.954 8.037 -0.083 18769 1533 1 17 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.354 -0.475 18769 1534 1 17 . 1 1 5 5 VAL CA C 5 65.477 65.477 64.622 0.855 18769 1535 1 17 . 1 1 5 5 VAL CB C 5 33.015 33.015 32.603 0.412 18769 1536 1 17 . 1 1 5 5 VAL H H 5 7.494 7.494 7.875 -0.381 18769 1537 1 17 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.573 0.061 18769 1538 1 17 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.943 -0.857 18769 1539 1 17 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.079 0.929 18769 1540 1 17 . 1 1 6 6 ASN H H 6 7.994 7.994 8.634 -0.640 18769 1541 1 17 . 1 1 7 7 SER HA H 7 4.429 4.429 4.285 0.144 18769 1542 1 17 . 1 1 7 7 SER CA C 7 62.214 62.214 61.979 0.235 18769 1543 1 17 . 1 1 7 7 SER CB C 7 64.026 64.026 63.360 0.666 18769 1544 1 17 . 1 1 7 7 SER H H 7 8.222 8.222 8.309 -0.087 18769 1545 1 17 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.390 0.040 18769 1546 1 17 . 1 1 8 8 TYR CA C 8 61.958 61.958 60.892 1.066 18769 1547 1 17 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.379 0.561 18769 1548 1 17 . 1 1 8 8 TYR H H 8 8.191 8.191 8.382 -0.191 18769 1549 1 17 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.692 0.366 18769 1550 1 17 . 1 1 9 9 LEU CA C 9 58.791 58.791 58.039 0.752 18769 1551 1 17 . 1 1 9 9 LEU CB C 9 42.528 42.528 40.956 1.572 18769 1552 1 17 . 1 1 9 9 LEU H H 9 8.306 8.306 8.448 -0.142 18769 1553 1 17 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.372 0.238 18769 1554 1 17 . 1 1 10 10 TRP CA C 10 61.451 61.451 61.360 0.091 18769 1555 1 17 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.269 0.774 18769 1556 1 17 . 1 1 10 10 TRP H H 10 8.281 8.281 8.694 -0.413 18769 1557 1 17 . 1 1 11 11 GLN HA H 11 3.999 3.999 2.980 1.019 18769 1558 1 17 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.182 0.901 18769 1559 1 17 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.262 1.168 18769 1560 1 17 . 1 1 11 11 GLN H H 11 8.275 8.275 7.954 0.321 18769 1561 1 17 . 1 1 12 12 ARG HA H 12 4.072 4.072 4.032 0.040 18769 1562 1 17 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.462 0.393 18769 1563 1 17 . 1 1 12 12 ARG CB C 12 30.288 30.288 30.118 0.170 18769 1564 1 17 . 1 1 12 12 ARG H H 12 8.158 8.158 7.587 0.571 18769 1565 1 17 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.372 0.041 18769 1566 1 17 . 1 1 13 13 TRP CA C 13 62.193 62.193 59.868 2.325 18769 1567 1 17 . 1 1 13 13 TRP CB C 13 29.421 29.421 28.984 0.437 18769 1568 1 17 . 1 1 13 13 TRP H H 13 8.425 8.425 7.274 1.151 18769 1569 1 17 . 1 1 14 14 GLU HA H 14 3.698 3.698 2.462 1.236 18769 1570 1 17 . 1 1 14 14 GLU CA C 14 59.978 59.978 58.955 1.023 18769 1571 1 17 . 1 1 14 14 GLU CB C 14 28.680 28.680 28.562 0.118 18769 1572 1 17 . 1 1 14 14 GLU H H 14 8.774 8.774 7.186 1.588 18769 1573 1 17 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.429 0.066 18769 1574 1 17 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.712 0.854 18769 1575 1 17 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.677 1.351 18769 1576 1 17 . 1 1 15 15 ASN H H 15 8.059 8.059 7.747 0.312 18769 1577 1 17 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.274 -0.036 18769 1578 1 17 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.698 1.547 18769 1579 1 17 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.455 -0.264 18769 1580 1 17 . 1 1 16 16 TRP H H 16 8.071 8.071 8.092 -0.021 18769 1581 1 17 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.037 0.409 18769 1582 1 17 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.252 0.774 18769 1583 1 17 . 1 1 17 17 PHE CB C 17 39.605 39.605 37.953 1.653 18769 1584 1 17 . 1 1 17 17 PHE H H 17 8.768 8.768 8.255 0.513 18769 1585 1 17 . 1 1 18 18 TRP HA H 18 4.223 4.223 3.777 0.446 18769 1586 1 17 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.396 1.419 18769 1587 1 17 . 1 1 18 18 TRP CB C 18 29.900 29.900 28.856 1.044 18769 1588 1 17 . 1 1 18 18 TRP H H 18 8.456 8.456 8.137 0.319 18769 1589 1 17 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.373 -0.042 18769 1590 1 17 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.529 0.731 18769 1591 1 17 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.225 1.804 18769 1592 1 17 . 1 1 19 19 ASN H H 19 7.768 7.768 7.777 -0.009 18769 1593 1 17 . 1 1 20 20 VAL HA H 20 3.728 3.728 4.050 -0.322 18769 1594 1 17 . 1 1 20 20 VAL CA C 20 65.593 65.593 64.644 0.949 18769 1595 1 17 . 1 1 20 20 VAL CB C 20 32.363 32.363 30.910 1.453 18769 1596 1 17 . 1 1 20 20 VAL H H 20 7.983 7.983 7.399 0.584 18769 1597 1 17 . 1 1 21 21 THR HA H 21 3.886 3.886 3.873 0.013 18769 1598 1 17 . 1 1 21 21 THR CA C 21 65.003 65.003 65.518 -0.515 18769 1599 1 17 . 1 1 21 21 THR CB C 21 69.837 69.837 68.683 1.155 18769 1600 1 17 . 1 1 21 21 THR H H 21 7.523 7.523 7.823 -0.300 18769 1601 1 17 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.514 -0.203 18769 1602 1 17 . 1 1 22 22 LEU CA C 22 56.094 56.094 54.791 1.303 18769 1603 1 17 . 1 1 22 22 LEU CB C 22 42.641 42.641 43.052 -0.411 18769 1604 1 17 . 1 1 22 22 LEU H H 22 7.598 7.598 7.845 -0.247 18769 1605 1 17 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.347 0.023 18769 1606 1 17 . 1 1 23 23 ARG CA C 23 56.977 56.977 56.088 0.889 18769 1607 1 17 . 1 1 23 23 ARG CB C 23 30.139 30.139 29.615 0.524 18769 1608 1 17 . 1 1 23 23 ARG H H 23 7.480 7.480 8.320 -0.841 18769 1609 1 17 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.629 -0.238 18769 1610 1 17 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.317 2.719 18769 1611 1 17 . 1 1 24 24 PRO CB C 24 32.233 32.233 31.909 0.324 18769 1612 1 17 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.413 -0.061 18769 1613 1 17 . 1 1 25 25 GLU CA C 25 57.150 57.150 56.737 0.413 18769 1614 1 17 . 1 1 25 25 GLU CB C 25 29.234 29.234 30.209 -0.975 18769 1615 1 17 . 1 1 25 25 GLU H H 25 8.002 8.002 8.377 -0.375 18769 1616 1 18 . 1 1 2 2 SER HA H 2 4.611 4.611 4.196 0.415 18769 1617 1 18 . 1 1 2 2 SER CA C 2 58.466 58.466 59.008 -0.542 18769 1618 1 18 . 1 1 2 2 SER CB C 2 65.003 65.003 63.275 1.728 18769 1619 1 18 . 1 1 2 2 SER H H 2 8.606 8.606 8.381 0.225 18769 1620 1 18 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.494 -0.140 18769 1621 1 18 . 1 1 3 3 ALA CA C 3 54.477 54.477 53.045 1.432 18769 1622 1 18 . 1 1 3 3 ALA CB C 3 19.356 19.356 19.237 0.119 18769 1623 1 18 . 1 1 3 3 ALA H H 3 8.654 8.654 8.323 0.331 18769 1624 1 18 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.625 -0.355 18769 1625 1 18 . 1 1 4 4 LEU CA C 4 57.815 57.815 54.878 2.937 18769 1626 1 18 . 1 1 4 4 LEU CB C 4 43.003 43.003 40.477 2.526 18769 1627 1 18 . 1 1 4 4 LEU H H 4 7.954 7.954 8.392 -0.438 18769 1628 1 18 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.144 -0.265 18769 1629 1 18 . 1 1 5 5 VAL CA C 5 65.477 65.477 64.775 0.702 18769 1630 1 18 . 1 1 5 5 VAL CB C 5 33.015 33.015 32.999 0.016 18769 1631 1 18 . 1 1 5 5 VAL H H 5 7.494 7.494 7.969 -0.475 18769 1632 1 18 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.525 0.109 18769 1633 1 18 . 1 1 6 6 ASN CA C 6 56.086 56.086 57.061 -0.975 18769 1634 1 18 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.705 0.303 18769 1635 1 18 . 1 1 6 6 ASN H H 6 7.994 7.994 8.238 -0.244 18769 1636 1 18 . 1 1 7 7 SER HA H 7 4.429 4.429 4.269 0.160 18769 1637 1 18 . 1 1 7 7 SER CA C 7 62.214 62.214 62.248 -0.034 18769 1638 1 18 . 1 1 7 7 SER CB C 7 64.026 64.026 63.233 0.793 18769 1639 1 18 . 1 1 7 7 SER H H 7 8.222 8.222 8.112 0.110 18769 1640 1 18 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.432 -0.002 18769 1641 1 18 . 1 1 8 8 TYR CA C 8 61.958 61.958 60.126 1.832 18769 1642 1 18 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.562 0.378 18769 1643 1 18 . 1 1 8 8 TYR H H 8 8.191 8.191 7.957 0.234 18769 1644 1 18 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.641 0.417 18769 1645 1 18 . 1 1 9 9 LEU CA C 9 58.791 58.791 57.993 0.798 18769 1646 1 18 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.710 0.818 18769 1647 1 18 . 1 1 9 9 LEU H H 9 8.306 8.306 8.275 0.031 18769 1648 1 18 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.379 0.231 18769 1649 1 18 . 1 1 10 10 TRP CA C 10 61.451 61.451 61.336 0.115 18769 1650 1 18 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.244 0.799 18769 1651 1 18 . 1 1 10 10 TRP H H 10 8.281 8.281 8.534 -0.253 18769 1652 1 18 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.075 0.924 18769 1653 1 18 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.410 0.673 18769 1654 1 18 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.201 1.229 18769 1655 1 18 . 1 1 11 11 GLN H H 11 8.275 8.275 7.939 0.336 18769 1656 1 18 . 1 1 12 12 ARG HA H 12 4.072 4.072 3.936 0.136 18769 1657 1 18 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.414 0.441 18769 1658 1 18 . 1 1 12 12 ARG CB C 12 30.288 30.288 30.046 0.242 18769 1659 1 18 . 1 1 12 12 ARG H H 12 8.158 8.158 7.740 0.418 18769 1660 1 18 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.378 0.035 18769 1661 1 18 . 1 1 13 13 TRP CA C 13 62.193 62.193 60.096 2.097 18769 1662 1 18 . 1 1 13 13 TRP CB C 13 29.421 29.421 29.154 0.267 18769 1663 1 18 . 1 1 13 13 TRP H H 13 8.425 8.425 7.765 0.660 18769 1664 1 18 . 1 1 14 14 GLU HA H 14 3.698 3.698 2.696 1.002 18769 1665 1 18 . 1 1 14 14 GLU CA C 14 59.978 59.978 58.931 1.046 18769 1666 1 18 . 1 1 14 14 GLU CB C 14 28.680 28.680 28.724 -0.044 18769 1667 1 18 . 1 1 14 14 GLU H H 14 8.774 8.774 7.212 1.562 18769 1668 1 18 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.470 0.025 18769 1669 1 18 . 1 1 15 15 ASN CA C 15 57.566 57.566 57.022 0.544 18769 1670 1 18 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.588 1.440 18769 1671 1 18 . 1 1 15 15 ASN H H 15 8.059 8.059 8.399 -0.340 18769 1672 1 18 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.303 -0.065 18769 1673 1 18 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.730 1.514 18769 1674 1 18 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.335 -0.144 18769 1675 1 18 . 1 1 16 16 TRP H H 16 8.071 8.071 8.054 0.017 18769 1676 1 18 . 1 1 17 17 PHE HA H 17 3.446 3.446 2.959 0.487 18769 1677 1 18 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.612 0.414 18769 1678 1 18 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.202 1.403 18769 1679 1 18 . 1 1 17 17 PHE H H 17 8.768 8.768 7.715 1.053 18769 1680 1 18 . 1 1 18 18 TRP HA H 18 4.223 4.223 3.966 0.257 18769 1681 1 18 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.461 1.354 18769 1682 1 18 . 1 1 18 18 TRP CB C 18 29.900 29.900 29.183 0.717 18769 1683 1 18 . 1 1 18 18 TRP H H 18 8.456 8.456 8.535 -0.079 18769 1684 1 18 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.387 -0.056 18769 1685 1 18 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.351 0.909 18769 1686 1 18 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.268 1.761 18769 1687 1 18 . 1 1 19 19 ASN H H 19 7.768 7.768 8.018 -0.250 18769 1688 1 18 . 1 1 20 20 VAL HA H 20 3.728 3.728 4.046 -0.318 18769 1689 1 18 . 1 1 20 20 VAL CA C 20 65.593 65.593 64.984 0.609 18769 1690 1 18 . 1 1 20 20 VAL CB C 20 32.363 32.363 31.631 0.732 18769 1691 1 18 . 1 1 20 20 VAL H H 20 7.983 7.983 7.480 0.503 18769 1692 1 18 . 1 1 21 21 THR HA H 21 3.886 3.886 4.053 -0.167 18769 1693 1 18 . 1 1 21 21 THR CA C 21 65.003 65.003 65.435 -0.432 18769 1694 1 18 . 1 1 21 21 THR CB C 21 69.837 69.837 68.962 0.875 18769 1695 1 18 . 1 1 21 21 THR H H 21 7.523 7.523 7.276 0.247 18769 1696 1 18 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.356 -0.045 18769 1697 1 18 . 1 1 22 22 LEU CA C 22 56.094 56.094 54.528 1.567 18769 1698 1 18 . 1 1 22 22 LEU CB C 22 42.641 42.641 42.114 0.527 18769 1699 1 18 . 1 1 22 22 LEU H H 22 7.598 7.598 8.013 -0.415 18769 1700 1 18 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.089 0.281 18769 1701 1 18 . 1 1 23 23 ARG CA C 23 56.977 56.977 59.868 -2.891 18769 1702 1 18 . 1 1 23 23 ARG CB C 23 30.139 30.139 28.554 1.585 18769 1703 1 18 . 1 1 23 23 ARG H H 23 7.480 7.480 7.532 -0.052 18769 1704 1 18 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.430 -0.039 18769 1705 1 18 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.732 2.304 18769 1706 1 18 . 1 1 24 24 PRO CB C 24 32.233 32.233 30.845 1.388 18769 1707 1 18 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.227 0.125 18769 1708 1 18 . 1 1 25 25 GLU CA C 25 57.150 57.150 55.670 1.480 18769 1709 1 18 . 1 1 25 25 GLU CB C 25 29.234 29.234 30.391 -1.157 18769 1710 1 18 . 1 1 25 25 GLU H H 25 8.002 8.002 8.322 -0.320 18769 1711 1 19 . 1 1 2 2 SER HA H 2 4.611 4.611 4.162 0.449 18769 1712 1 19 . 1 1 2 2 SER CA C 2 58.466 58.466 59.494 -1.028 18769 1713 1 19 . 1 1 2 2 SER CB C 2 65.003 65.003 62.775 2.228 18769 1714 1 19 . 1 1 2 2 SER H H 2 8.606 8.606 8.669 -0.063 18769 1715 1 19 . 1 1 3 3 ALA HA H 3 4.354 4.354 3.958 0.396 18769 1716 1 19 . 1 1 3 3 ALA CA C 3 54.477 54.477 54.370 0.107 18769 1717 1 19 . 1 1 3 3 ALA CB C 3 19.356 19.356 17.611 1.745 18769 1718 1 19 . 1 1 3 3 ALA H H 3 8.654 8.654 8.555 0.099 18769 1719 1 19 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.522 -0.252 18769 1720 1 19 . 1 1 4 4 LEU CA C 4 57.815 57.815 55.650 2.165 18769 1721 1 19 . 1 1 4 4 LEU CB C 4 43.003 43.003 42.844 0.159 18769 1722 1 19 . 1 1 4 4 LEU H H 4 7.954 7.954 8.005 -0.051 18769 1723 1 19 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.301 -0.422 18769 1724 1 19 . 1 1 5 5 VAL CA C 5 65.477 65.477 64.591 0.886 18769 1725 1 19 . 1 1 5 5 VAL CB C 5 33.015 33.015 32.978 0.037 18769 1726 1 19 . 1 1 5 5 VAL H H 5 7.494 7.494 7.885 -0.391 18769 1727 1 19 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.785 -0.151 18769 1728 1 19 . 1 1 6 6 ASN CA C 6 56.086 56.086 55.687 0.399 18769 1729 1 19 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.690 0.318 18769 1730 1 19 . 1 1 6 6 ASN H H 6 7.994 7.994 8.578 -0.584 18769 1731 1 19 . 1 1 7 7 SER HA H 7 4.429 4.429 4.362 0.067 18769 1732 1 19 . 1 1 7 7 SER CA C 7 62.214 62.214 61.955 0.259 18769 1733 1 19 . 1 1 7 7 SER CB C 7 64.026 64.026 63.101 0.925 18769 1734 1 19 . 1 1 7 7 SER H H 7 8.222 8.222 8.594 -0.372 18769 1735 1 19 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.388 0.042 18769 1736 1 19 . 1 1 8 8 TYR CA C 8 61.958 61.958 60.875 1.083 18769 1737 1 19 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.265 0.675 18769 1738 1 19 . 1 1 8 8 TYR H H 8 8.191 8.191 8.306 -0.116 18769 1739 1 19 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.633 0.425 18769 1740 1 19 . 1 1 9 9 LEU CA C 9 58.791 58.791 57.824 0.967 18769 1741 1 19 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.791 0.737 18769 1742 1 19 . 1 1 9 9 LEU H H 9 8.306 8.306 7.577 0.729 18769 1743 1 19 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.375 0.235 18769 1744 1 19 . 1 1 10 10 TRP CA C 10 61.451 61.451 61.903 -0.452 18769 1745 1 19 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.382 0.661 18769 1746 1 19 . 1 1 10 10 TRP H H 10 8.281 8.281 9.000 -0.719 18769 1747 1 19 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.167 0.832 18769 1748 1 19 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.113 0.970 18769 1749 1 19 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.224 1.206 18769 1750 1 19 . 1 1 11 11 GLN H H 11 8.275 8.275 7.899 0.376 18769 1751 1 19 . 1 1 12 12 ARG HA H 12 4.072 4.072 3.975 0.097 18769 1752 1 19 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.280 0.575 18769 1753 1 19 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.907 0.382 18769 1754 1 19 . 1 1 12 12 ARG H H 12 8.158 8.158 7.783 0.375 18769 1755 1 19 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.406 0.007 18769 1756 1 19 . 1 1 13 13 TRP CA C 13 62.193 62.193 60.146 2.047 18769 1757 1 19 . 1 1 13 13 TRP CB C 13 29.421 29.421 29.074 0.347 18769 1758 1 19 . 1 1 13 13 TRP H H 13 8.425 8.425 7.913 0.512 18769 1759 1 19 . 1 1 14 14 GLU HA H 14 3.698 3.698 2.787 0.911 18769 1760 1 19 . 1 1 14 14 GLU CA C 14 59.978 59.978 59.012 0.966 18769 1761 1 19 . 1 1 14 14 GLU CB C 14 28.680 28.680 28.676 0.004 18769 1762 1 19 . 1 1 14 14 GLU H H 14 8.774 8.774 7.341 1.433 18769 1763 1 19 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.391 0.104 18769 1764 1 19 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.569 0.997 18769 1765 1 19 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.627 1.401 18769 1766 1 19 . 1 1 15 15 ASN H H 15 8.059 8.059 8.250 -0.191 18769 1767 1 19 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.335 -0.097 18769 1768 1 19 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.380 1.865 18769 1769 1 19 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.516 -0.325 18769 1770 1 19 . 1 1 16 16 TRP H H 16 8.071 8.071 7.940 0.131 18769 1771 1 19 . 1 1 17 17 PHE HA H 17 3.446 3.446 2.946 0.500 18769 1772 1 19 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.444 0.582 18769 1773 1 19 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.119 1.486 18769 1774 1 19 . 1 1 17 17 PHE H H 17 8.768 8.768 7.984 0.784 18769 1775 1 19 . 1 1 18 18 TRP HA H 18 4.223 4.223 3.920 0.303 18769 1776 1 19 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.352 1.463 18769 1777 1 19 . 1 1 18 18 TRP CB C 18 29.900 29.900 29.214 0.686 18769 1778 1 19 . 1 1 18 18 TRP H H 18 8.456 8.456 8.429 0.027 18769 1779 1 19 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.452 -0.121 18769 1780 1 19 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.114 1.146 18769 1781 1 19 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.052 1.977 18769 1782 1 19 . 1 1 19 19 ASN H H 19 7.768 7.768 7.801 -0.033 18769 1783 1 19 . 1 1 20 20 VAL HA H 20 3.728 3.728 4.212 -0.484 18769 1784 1 19 . 1 1 20 20 VAL CA C 20 65.593 65.593 64.309 1.284 18769 1785 1 19 . 1 1 20 20 VAL CB C 20 32.363 32.363 31.794 0.569 18769 1786 1 19 . 1 1 20 20 VAL H H 20 7.983 7.983 7.289 0.694 18769 1787 1 19 . 1 1 21 21 THR HA H 21 3.886 3.886 4.058 -0.172 18769 1788 1 19 . 1 1 21 21 THR CA C 21 65.003 65.003 64.864 0.139 18769 1789 1 19 . 1 1 21 21 THR CB C 21 69.837 69.837 69.096 0.741 18769 1790 1 19 . 1 1 21 21 THR H H 21 7.523 7.523 7.401 0.122 18769 1791 1 19 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.261 0.050 18769 1792 1 19 . 1 1 22 22 LEU CA C 22 56.094 56.094 56.719 -0.625 18769 1793 1 19 . 1 1 22 22 LEU CB C 22 42.641 42.641 41.667 0.974 18769 1794 1 19 . 1 1 22 22 LEU H H 22 7.598 7.598 8.274 -0.676 18769 1795 1 19 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.154 0.216 18769 1796 1 19 . 1 1 23 23 ARG CA C 23 56.977 56.977 59.277 -2.300 18769 1797 1 19 . 1 1 23 23 ARG CB C 23 30.139 30.139 28.063 2.076 18769 1798 1 19 . 1 1 23 23 ARG H H 23 7.480 7.480 8.390 -0.910 18769 1799 1 19 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.623 -0.232 18769 1800 1 19 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.013 3.023 18769 1801 1 19 . 1 1 24 24 PRO CB C 24 32.233 32.233 31.199 1.034 18769 1802 1 19 . 1 1 25 25 GLU HA H 25 4.352 4.352 3.836 0.516 18769 1803 1 19 . 1 1 25 25 GLU CA C 25 57.150 57.150 57.989 -0.838 18769 1804 1 19 . 1 1 25 25 GLU CB C 25 29.234 29.234 29.444 -0.210 18769 1805 1 19 . 1 1 25 25 GLU H H 25 8.002 8.002 7.829 0.173 18769 1806 1 20 . 1 1 2 2 SER HA H 2 4.611 4.611 4.731 -0.120 18769 1807 1 20 . 1 1 2 2 SER CA C 2 58.466 58.466 57.668 0.798 18769 1808 1 20 . 1 1 2 2 SER CB C 2 65.003 65.003 64.341 0.662 18769 1809 1 20 . 1 1 2 2 SER H H 2 8.606 8.606 8.447 0.159 18769 1810 1 20 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.272 0.082 18769 1811 1 20 . 1 1 3 3 ALA CA C 3 54.477 54.477 53.868 0.609 18769 1812 1 20 . 1 1 3 3 ALA CB C 3 19.356 19.356 19.034 0.322 18769 1813 1 20 . 1 1 3 3 ALA H H 3 8.654 8.654 8.886 -0.232 18769 1814 1 20 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.371 -0.101 18769 1815 1 20 . 1 1 4 4 LEU CA C 4 57.815 57.815 55.704 2.111 18769 1816 1 20 . 1 1 4 4 LEU CB C 4 43.003 43.003 40.657 2.346 18769 1817 1 20 . 1 1 4 4 LEU H H 4 7.954 7.954 8.227 -0.273 18769 1818 1 20 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.056 -0.177 18769 1819 1 20 . 1 1 5 5 VAL CA C 5 65.477 65.477 64.931 0.545 18769 1820 1 20 . 1 1 5 5 VAL CB C 5 33.015 33.015 32.893 0.122 18769 1821 1 20 . 1 1 5 5 VAL H H 5 7.494 7.494 7.554 -0.060 18769 1822 1 20 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.600 0.034 18769 1823 1 20 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.607 -0.521 18769 1824 1 20 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.857 0.151 18769 1825 1 20 . 1 1 6 6 ASN H H 6 7.994 7.994 7.850 0.144 18769 1826 1 20 . 1 1 7 7 SER HA H 7 4.429 4.429 4.449 -0.020 18769 1827 1 20 . 1 1 7 7 SER CA C 7 62.214 62.214 62.452 -0.238 18769 1828 1 20 . 1 1 7 7 SER CB C 7 64.026 64.026 63.300 0.726 18769 1829 1 20 . 1 1 7 7 SER H H 7 8.222 8.222 7.871 0.351 18769 1830 1 20 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.331 0.099 18769 1831 1 20 . 1 1 8 8 TYR CA C 8 61.958 61.958 60.624 1.334 18769 1832 1 20 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.395 0.545 18769 1833 1 20 . 1 1 8 8 TYR H H 8 8.191 8.191 8.035 0.156 18769 1834 1 20 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.626 0.432 18769 1835 1 20 . 1 1 9 9 LEU CA C 9 58.791 58.791 57.840 0.951 18769 1836 1 20 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.761 0.767 18769 1837 1 20 . 1 1 9 9 LEU H H 9 8.306 8.306 7.820 0.486 18769 1838 1 20 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.452 0.158 18769 1839 1 20 . 1 1 10 10 TRP CA C 10 61.451 61.451 61.031 0.420 18769 1840 1 20 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.241 0.802 18769 1841 1 20 . 1 1 10 10 TRP H H 10 8.281 8.281 8.839 -0.558 18769 1842 1 20 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.201 0.798 18769 1843 1 20 . 1 1 11 11 GLN CA C 11 60.083 60.083 58.841 1.242 18769 1844 1 20 . 1 1 11 11 GLN CB C 11 29.430 29.430 27.654 1.776 18769 1845 1 20 . 1 1 11 11 GLN H H 11 8.275 8.275 8.161 0.114 18769 1846 1 20 . 1 1 12 12 ARG HA H 12 4.072 4.072 4.036 0.036 18769 1847 1 20 . 1 1 12 12 ARG CA C 12 59.855 59.855 58.961 0.894 18769 1848 1 20 . 1 1 12 12 ARG CB C 12 30.288 30.288 30.098 0.190 18769 1849 1 20 . 1 1 12 12 ARG H H 12 8.158 8.158 7.996 0.162 18769 1850 1 20 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.429 -0.016 18769 1851 1 20 . 1 1 13 13 TRP CA C 13 62.193 62.193 60.124 2.069 18769 1852 1 20 . 1 1 13 13 TRP CB C 13 29.421 29.421 29.131 0.290 18769 1853 1 20 . 1 1 13 13 TRP H H 13 8.425 8.425 7.762 0.663 18769 1854 1 20 . 1 1 14 14 GLU HA H 14 3.698 3.698 2.748 0.950 18769 1855 1 20 . 1 1 14 14 GLU CA C 14 59.978 59.978 59.304 0.674 18769 1856 1 20 . 1 1 14 14 GLU CB C 14 28.680 28.680 28.756 -0.076 18769 1857 1 20 . 1 1 14 14 GLU H H 14 8.774 8.774 7.381 1.393 18769 1858 1 20 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.397 0.098 18769 1859 1 20 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.357 1.209 18769 1860 1 20 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.670 1.358 18769 1861 1 20 . 1 1 15 15 ASN H H 15 8.059 8.059 8.258 -0.199 18769 1862 1 20 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.291 -0.053 18769 1863 1 20 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.762 1.483 18769 1864 1 20 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.381 -0.190 18769 1865 1 20 . 1 1 16 16 TRP H H 16 8.071 8.071 7.930 0.141 18769 1866 1 20 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.087 0.359 18769 1867 1 20 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.306 0.720 18769 1868 1 20 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.009 1.596 18769 1869 1 20 . 1 1 17 17 PHE H H 17 8.768 8.768 8.287 0.481 18769 1870 1 20 . 1 1 18 18 TRP HA H 18 4.223 4.223 3.704 0.519 18769 1871 1 20 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.628 1.187 18769 1872 1 20 . 1 1 18 18 TRP CB C 18 29.900 29.900 28.904 0.996 18769 1873 1 20 . 1 1 18 18 TRP H H 18 8.456 8.456 8.385 0.071 18769 1874 1 20 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.382 -0.051 18769 1875 1 20 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.370 0.890 18769 1876 1 20 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.454 1.575 18769 1877 1 20 . 1 1 19 19 ASN H H 19 7.768 7.768 8.082 -0.314 18769 1878 1 20 . 1 1 20 20 VAL HA H 20 3.728 3.728 4.245 -0.517 18769 1879 1 20 . 1 1 20 20 VAL CA C 20 65.593 65.593 63.736 1.857 18769 1880 1 20 . 1 1 20 20 VAL CB C 20 32.363 32.363 32.094 0.269 18769 1881 1 20 . 1 1 20 20 VAL H H 20 7.983 7.983 7.333 0.650 18769 1882 1 20 . 1 1 21 21 THR HA H 21 3.886 3.886 4.079 -0.193 18769 1883 1 20 . 1 1 21 21 THR CA C 21 65.003 65.003 64.784 0.219 18769 1884 1 20 . 1 1 21 21 THR CB C 21 69.837 69.837 69.156 0.681 18769 1885 1 20 . 1 1 21 21 THR H H 21 7.523 7.523 7.417 0.106 18769 1886 1 20 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.209 0.102 18769 1887 1 20 . 1 1 22 22 LEU CA C 22 56.094 56.094 56.174 -0.080 18769 1888 1 20 . 1 1 22 22 LEU CB C 22 42.641 42.641 41.955 0.687 18769 1889 1 20 . 1 1 22 22 LEU H H 22 7.598 7.598 8.073 -0.475 18769 1890 1 20 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.161 0.209 18769 1891 1 20 . 1 1 23 23 ARG CA C 23 56.977 56.977 59.496 -2.519 18769 1892 1 20 . 1 1 23 23 ARG CB C 23 30.139 30.139 27.981 2.158 18769 1893 1 20 . 1 1 23 23 ARG H H 23 7.480 7.480 8.084 -0.604 18769 1894 1 20 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.599 -0.208 18769 1895 1 20 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.802 2.234 18769 1896 1 20 . 1 1 24 24 PRO CB C 24 32.233 32.233 30.102 2.131 18769 1897 1 20 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.546 -0.194 18769 1898 1 20 . 1 1 25 25 GLU CA C 25 57.150 57.150 55.672 1.478 18769 1899 1 20 . 1 1 25 25 GLU CB C 25 29.234 29.234 32.573 -3.339 18769 1900 1 20 . 1 1 25 25 GLU H H 25 8.002 8.002 8.042 -0.040 18769 1901 1 21 . 1 1 2 2 SER HA H 2 4.611 4.611 4.548 0.063 18769 1902 1 21 . 1 1 2 2 SER CA C 2 58.466 58.466 58.144 0.322 18769 1903 1 21 . 1 1 2 2 SER CB C 2 65.003 65.003 64.087 0.916 18769 1904 1 21 . 1 1 2 2 SER H H 2 8.606 8.606 8.769 -0.163 18769 1905 1 21 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.584 -0.230 18769 1906 1 21 . 1 1 3 3 ALA CA C 3 54.477 54.477 52.337 2.140 18769 1907 1 21 . 1 1 3 3 ALA CB C 3 19.356 19.356 19.813 -0.457 18769 1908 1 21 . 1 1 3 3 ALA H H 3 8.654 8.654 8.537 0.117 18769 1909 1 21 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.421 -0.151 18769 1910 1 21 . 1 1 4 4 LEU CA C 4 57.815 57.815 56.173 1.642 18769 1911 1 21 . 1 1 4 4 LEU CB C 4 43.003 43.003 42.909 0.094 18769 1912 1 21 . 1 1 4 4 LEU H H 4 7.954 7.954 7.870 0.084 18769 1913 1 21 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.161 -0.282 18769 1914 1 21 . 1 1 5 5 VAL CA C 5 65.477 65.477 64.314 1.163 18769 1915 1 21 . 1 1 5 5 VAL CB C 5 33.015 33.015 32.839 0.176 18769 1916 1 21 . 1 1 5 5 VAL H H 5 7.494 7.494 7.659 -0.165 18769 1917 1 21 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.811 -0.177 18769 1918 1 21 . 1 1 6 6 ASN CA C 6 56.086 56.086 54.810 1.276 18769 1919 1 21 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.710 0.298 18769 1920 1 21 . 1 1 6 6 ASN H H 6 7.994 7.994 8.475 -0.481 18769 1921 1 21 . 1 1 7 7 SER HA H 7 4.429 4.429 4.364 0.065 18769 1922 1 21 . 1 1 7 7 SER CA C 7 62.214 62.214 62.291 -0.077 18769 1923 1 21 . 1 1 7 7 SER CB C 7 64.026 64.026 63.407 0.619 18769 1924 1 21 . 1 1 7 7 SER H H 7 8.222 8.222 8.444 -0.222 18769 1925 1 21 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.424 0.006 18769 1926 1 21 . 1 1 8 8 TYR CA C 8 61.958 61.958 60.540 1.418 18769 1927 1 21 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.389 0.551 18769 1928 1 21 . 1 1 8 8 TYR H H 8 8.191 8.191 8.484 -0.293 18769 1929 1 21 . 1 1 9 9 LEU HA H 9 4.058 4.058 4.112 -0.054 18769 1930 1 21 . 1 1 9 9 LEU CA C 9 58.791 58.791 56.934 1.857 18769 1931 1 21 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.524 1.004 18769 1932 1 21 . 1 1 9 9 LEU H H 9 8.306 8.306 7.711 0.595 18769 1933 1 21 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.819 -0.209 18769 1934 1 21 . 1 1 10 10 TRP CA C 10 61.451 61.451 59.752 1.699 18769 1935 1 21 . 1 1 10 10 TRP CB C 10 30.043 30.043 30.591 -0.548 18769 1936 1 21 . 1 1 10 10 TRP H H 10 8.281 8.281 8.556 -0.275 18769 1937 1 21 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.566 0.433 18769 1938 1 21 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.673 0.410 18769 1939 1 21 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.287 1.143 18769 1940 1 21 . 1 1 11 11 GLN H H 11 8.275 8.275 8.159 0.116 18769 1941 1 21 . 1 1 12 12 ARG HA H 12 4.072 4.072 4.002 0.070 18769 1942 1 21 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.375 0.480 18769 1943 1 21 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.851 0.437 18769 1944 1 21 . 1 1 12 12 ARG H H 12 8.158 8.158 8.106 0.052 18769 1945 1 21 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.354 0.059 18769 1946 1 21 . 1 1 13 13 TRP CA C 13 62.193 62.193 59.932 2.261 18769 1947 1 21 . 1 1 13 13 TRP CB C 13 29.421 29.421 28.930 0.491 18769 1948 1 21 . 1 1 13 13 TRP H H 13 8.425 8.425 7.834 0.591 18769 1949 1 21 . 1 1 14 14 GLU HA H 14 3.698 3.698 2.447 1.251 18769 1950 1 21 . 1 1 14 14 GLU CA C 14 59.978 59.978 58.623 1.355 18769 1951 1 21 . 1 1 14 14 GLU CB C 14 28.680 28.680 28.581 0.099 18769 1952 1 21 . 1 1 14 14 GLU H H 14 8.774 8.774 7.061 1.713 18769 1953 1 21 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.459 0.036 18769 1954 1 21 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.919 0.647 18769 1955 1 21 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.693 1.335 18769 1956 1 21 . 1 1 15 15 ASN H H 15 8.059 8.059 8.062 -0.003 18769 1957 1 21 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.294 -0.056 18769 1958 1 21 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.669 1.576 18769 1959 1 21 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.447 -0.256 18769 1960 1 21 . 1 1 16 16 TRP H H 16 8.071 8.071 7.892 0.179 18769 1961 1 21 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.013 0.433 18769 1962 1 21 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.296 0.730 18769 1963 1 21 . 1 1 17 17 PHE CB C 17 39.605 39.605 37.978 1.627 18769 1964 1 21 . 1 1 17 17 PHE H H 17 8.768 8.768 7.998 0.770 18769 1965 1 21 . 1 1 18 18 TRP HA H 18 4.223 4.223 3.838 0.385 18769 1966 1 21 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.353 1.462 18769 1967 1 21 . 1 1 18 18 TRP CB C 18 29.900 29.900 28.934 0.966 18769 1968 1 21 . 1 1 18 18 TRP H H 18 8.456 8.456 8.408 0.048 18769 1969 1 21 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.419 -0.088 18769 1970 1 21 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.355 0.905 18769 1971 1 21 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.214 1.815 18769 1972 1 21 . 1 1 19 19 ASN H H 19 7.768 7.768 7.920 -0.152 18769 1973 1 21 . 1 1 20 20 VAL HA H 20 3.728 3.728 4.232 -0.504 18769 1974 1 21 . 1 1 20 20 VAL CA C 20 65.593 65.593 63.776 1.817 18769 1975 1 21 . 1 1 20 20 VAL CB C 20 32.363 32.363 32.421 -0.058 18769 1976 1 21 . 1 1 20 20 VAL H H 20 7.983 7.983 7.235 0.748 18769 1977 1 21 . 1 1 21 21 THR HA H 21 3.886 3.886 3.816 0.070 18769 1978 1 21 . 1 1 21 21 THR CA C 21 65.003 65.003 66.015 -1.012 18769 1979 1 21 . 1 1 21 21 THR CB C 21 69.837 69.837 68.522 1.315 18769 1980 1 21 . 1 1 21 21 THR H H 21 7.523 7.523 7.797 -0.274 18769 1981 1 21 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.093 0.218 18769 1982 1 21 . 1 1 22 22 LEU CA C 22 56.094 56.094 56.836 -0.742 18769 1983 1 21 . 1 1 22 22 LEU CB C 22 42.641 42.641 42.730 -0.089 18769 1984 1 21 . 1 1 22 22 LEU H H 22 7.598 7.598 7.510 0.088 18769 1985 1 21 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.704 -0.334 18769 1986 1 21 . 1 1 23 23 ARG CA C 23 56.977 56.977 52.719 4.258 18769 1987 1 21 . 1 1 23 23 ARG CB C 23 30.139 30.139 31.787 -1.648 18769 1988 1 21 . 1 1 23 23 ARG H H 23 7.480 7.480 7.747 -0.267 18769 1989 1 21 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.648 -0.257 18769 1990 1 21 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.543 2.493 18769 1991 1 21 . 1 1 24 24 PRO CB C 24 32.233 32.233 32.213 0.020 18769 1992 1 21 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.749 -0.397 18769 1993 1 21 . 1 1 25 25 GLU CA C 25 57.150 57.150 55.720 1.430 18769 1994 1 21 . 1 1 25 25 GLU CB C 25 29.234 29.234 31.882 -2.648 18769 1995 1 21 . 1 1 25 25 GLU H H 25 8.002 8.002 8.480 -0.478 18769 1996 1 22 . 1 1 2 2 SER HA H 2 4.611 4.611 4.912 -0.301 18769 1997 1 22 . 1 1 2 2 SER CA C 2 58.466 58.466 58.370 0.096 18769 1998 1 22 . 1 1 2 2 SER CB C 2 65.003 65.003 65.007 -0.004 18769 1999 1 22 . 1 1 2 2 SER H H 2 8.606 8.606 8.261 0.345 18769 2000 1 22 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.469 -0.115 18769 2001 1 22 . 1 1 3 3 ALA CA C 3 54.477 54.477 53.206 1.271 18769 2002 1 22 . 1 1 3 3 ALA CB C 3 19.356 19.356 19.194 0.162 18769 2003 1 22 . 1 1 3 3 ALA H H 3 8.654 8.654 8.574 0.080 18769 2004 1 22 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.662 -0.392 18769 2005 1 22 . 1 1 4 4 LEU CA C 4 57.815 57.815 55.105 2.710 18769 2006 1 22 . 1 1 4 4 LEU CB C 4 43.003 43.003 42.327 0.676 18769 2007 1 22 . 1 1 4 4 LEU H H 4 7.954 7.954 8.113 -0.159 18769 2008 1 22 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.318 -0.439 18769 2009 1 22 . 1 1 5 5 VAL CA C 5 65.477 65.477 64.991 0.486 18769 2010 1 22 . 1 1 5 5 VAL CB C 5 33.015 33.015 32.348 0.667 18769 2011 1 22 . 1 1 5 5 VAL H H 5 7.494 7.494 7.985 -0.491 18769 2012 1 22 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.620 0.014 18769 2013 1 22 . 1 1 6 6 ASN CA C 6 56.086 56.086 55.712 0.374 18769 2014 1 22 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.540 0.468 18769 2015 1 22 . 1 1 6 6 ASN H H 6 7.994 7.994 8.407 -0.413 18769 2016 1 22 . 1 1 7 7 SER HA H 7 4.429 4.429 4.206 0.223 18769 2017 1 22 . 1 1 7 7 SER CA C 7 62.214 62.214 62.595 -0.381 18769 2018 1 22 . 1 1 7 7 SER CB C 7 64.026 64.026 63.368 0.658 18769 2019 1 22 . 1 1 7 7 SER H H 7 8.222 8.222 8.338 -0.116 18769 2020 1 22 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.399 0.031 18769 2021 1 22 . 1 1 8 8 TYR CA C 8 61.958 61.958 59.701 2.257 18769 2022 1 22 . 1 1 8 8 TYR CB C 8 38.940 38.940 37.909 1.031 18769 2023 1 22 . 1 1 8 8 TYR H H 8 8.191 8.191 7.982 0.209 18769 2024 1 22 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.459 0.599 18769 2025 1 22 . 1 1 9 9 LEU CA C 9 58.791 58.791 57.895 0.896 18769 2026 1 22 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.297 1.231 18769 2027 1 22 . 1 1 9 9 LEU H H 9 8.306 8.306 7.145 1.161 18769 2028 1 22 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.382 0.228 18769 2029 1 22 . 1 1 10 10 TRP CA C 10 61.451 61.451 58.971 2.480 18769 2030 1 22 . 1 1 10 10 TRP CB C 10 30.043 30.043 30.236 -0.193 18769 2031 1 22 . 1 1 10 10 TRP H H 10 8.281 8.281 7.713 0.568 18769 2032 1 22 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.894 0.105 18769 2033 1 22 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.404 0.679 18769 2034 1 22 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.440 0.990 18769 2035 1 22 . 1 1 11 11 GLN H H 11 8.275 8.275 7.932 0.343 18769 2036 1 22 . 1 1 12 12 ARG HA H 12 4.072 4.072 4.178 -0.106 18769 2037 1 22 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.088 0.767 18769 2038 1 22 . 1 1 12 12 ARG CB C 12 30.288 30.288 30.102 0.186 18769 2039 1 22 . 1 1 12 12 ARG H H 12 8.158 8.158 8.482 -0.324 18769 2040 1 22 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.596 -0.183 18769 2041 1 22 . 1 1 13 13 TRP CA C 13 62.193 62.193 58.458 3.735 18769 2042 1 22 . 1 1 13 13 TRP CB C 13 29.421 29.421 30.691 -1.270 18769 2043 1 22 . 1 1 13 13 TRP H H 13 8.425 8.425 7.261 1.164 18769 2044 1 22 . 1 1 14 14 GLU HA H 14 3.698 3.698 3.563 0.135 18769 2045 1 22 . 1 1 14 14 GLU CA C 14 59.978 59.978 59.438 0.540 18769 2046 1 22 . 1 1 14 14 GLU CB C 14 28.680 28.680 29.262 -0.582 18769 2047 1 22 . 1 1 14 14 GLU H H 14 8.774 8.774 7.854 0.920 18769 2048 1 22 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.559 -0.064 18769 2049 1 22 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.682 0.884 18769 2050 1 22 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.649 1.379 18769 2051 1 22 . 1 1 15 15 ASN H H 15 8.059 8.059 8.361 -0.302 18769 2052 1 22 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.406 -0.168 18769 2053 1 22 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.697 1.548 18769 2054 1 22 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.515 -0.324 18769 2055 1 22 . 1 1 16 16 TRP H H 16 8.071 8.071 7.754 0.317 18769 2056 1 22 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.038 0.408 18769 2057 1 22 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.430 0.596 18769 2058 1 22 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.600 1.005 18769 2059 1 22 . 1 1 17 17 PHE H H 17 8.768 8.768 7.936 0.832 18769 2060 1 22 . 1 1 18 18 TRP HA H 18 4.223 4.223 4.018 0.205 18769 2061 1 22 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.265 1.550 18769 2062 1 22 . 1 1 18 18 TRP CB C 18 29.900 29.900 29.152 0.748 18769 2063 1 22 . 1 1 18 18 TRP H H 18 8.456 8.456 8.498 -0.042 18769 2064 1 22 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.552 -0.221 18769 2065 1 22 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.407 0.853 18769 2066 1 22 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.532 1.497 18769 2067 1 22 . 1 1 19 19 ASN H H 19 7.768 7.768 7.712 0.056 18769 2068 1 22 . 1 1 20 20 VAL HA H 20 3.728 3.728 3.914 -0.186 18769 2069 1 22 . 1 1 20 20 VAL CA C 20 65.593 65.593 63.731 1.862 18769 2070 1 22 . 1 1 20 20 VAL CB C 20 32.363 32.363 31.472 0.891 18769 2071 1 22 . 1 1 20 20 VAL H H 20 7.983 7.983 8.154 -0.171 18769 2072 1 22 . 1 1 21 21 THR HA H 21 3.886 3.886 4.159 -0.273 18769 2073 1 22 . 1 1 21 21 THR CA C 21 65.003 65.003 65.012 -0.009 18769 2074 1 22 . 1 1 21 21 THR CB C 21 69.837 69.837 68.914 0.923 18769 2075 1 22 . 1 1 21 21 THR H H 21 7.523 7.523 7.959 -0.436 18769 2076 1 22 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.119 0.192 18769 2077 1 22 . 1 1 22 22 LEU CA C 22 56.094 56.094 56.452 -0.358 18769 2078 1 22 . 1 1 22 22 LEU CB C 22 42.641 42.641 42.480 0.161 18769 2079 1 22 . 1 1 22 22 LEU H H 22 7.598 7.598 7.478 0.120 18769 2080 1 22 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.175 0.195 18769 2081 1 22 . 1 1 23 23 ARG CA C 23 56.977 56.977 56.087 0.890 18769 2082 1 22 . 1 1 23 23 ARG CB C 23 30.139 30.139 27.721 2.418 18769 2083 1 22 . 1 1 23 23 ARG H H 23 7.480 7.480 8.011 -0.531 18769 2084 1 22 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.447 -0.056 18769 2085 1 22 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.743 2.293 18769 2086 1 22 . 1 1 24 24 PRO CB C 24 32.233 32.233 32.411 -0.178 18769 2087 1 22 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.042 0.310 18769 2088 1 22 . 1 1 25 25 GLU CA C 25 57.150 57.150 57.677 -0.527 18769 2089 1 22 . 1 1 25 25 GLU CB C 25 29.234 29.234 29.315 -0.081 18769 2090 1 22 . 1 1 25 25 GLU H H 25 8.002 8.002 8.717 -0.715 18769 2091 1 23 . 1 1 2 2 SER HA H 2 4.611 4.611 4.905 -0.294 18769 2092 1 23 . 1 1 2 2 SER CA C 2 58.466 58.466 58.155 0.311 18769 2093 1 23 . 1 1 2 2 SER CB C 2 65.003 65.003 65.482 -0.479 18769 2094 1 23 . 1 1 2 2 SER H H 2 8.606 8.606 8.968 -0.362 18769 2095 1 23 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.462 -0.108 18769 2096 1 23 . 1 1 3 3 ALA CA C 3 54.477 54.477 53.964 0.513 18769 2097 1 23 . 1 1 3 3 ALA CB C 3 19.356 19.356 19.114 0.242 18769 2098 1 23 . 1 1 3 3 ALA H H 3 8.654 8.654 8.704 -0.050 18769 2099 1 23 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.419 -0.149 18769 2100 1 23 . 1 1 4 4 LEU CA C 4 57.815 57.815 55.887 1.928 18769 2101 1 23 . 1 1 4 4 LEU CB C 4 43.003 43.003 42.204 0.799 18769 2102 1 23 . 1 1 4 4 LEU H H 4 7.954 7.954 8.198 -0.244 18769 2103 1 23 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.148 -0.269 18769 2104 1 23 . 1 1 5 5 VAL CA C 5 65.477 65.477 64.296 1.181 18769 2105 1 23 . 1 1 5 5 VAL CB C 5 33.015 33.015 33.123 -0.108 18769 2106 1 23 . 1 1 5 5 VAL H H 5 7.494 7.494 7.751 -0.257 18769 2107 1 23 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.567 0.067 18769 2108 1 23 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.969 -0.883 18769 2109 1 23 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.432 0.576 18769 2110 1 23 . 1 1 6 6 ASN H H 6 7.994 7.994 8.283 -0.289 18769 2111 1 23 . 1 1 7 7 SER HA H 7 4.429 4.429 4.376 0.053 18769 2112 1 23 . 1 1 7 7 SER CA C 7 62.214 62.214 62.799 -0.585 18769 2113 1 23 . 1 1 7 7 SER CB C 7 64.026 64.026 63.346 0.680 18769 2114 1 23 . 1 1 7 7 SER H H 7 8.222 8.222 7.835 0.387 18769 2115 1 23 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.343 0.087 18769 2116 1 23 . 1 1 8 8 TYR CA C 8 61.958 61.958 61.217 0.741 18769 2117 1 23 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.336 0.604 18769 2118 1 23 . 1 1 8 8 TYR H H 8 8.191 8.191 8.340 -0.149 18769 2119 1 23 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.723 0.335 18769 2120 1 23 . 1 1 9 9 LEU CA C 9 58.791 58.791 57.811 0.980 18769 2121 1 23 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.311 1.217 18769 2122 1 23 . 1 1 9 9 LEU H H 9 8.306 8.306 8.021 0.285 18769 2123 1 23 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.373 0.237 18769 2124 1 23 . 1 1 10 10 TRP CA C 10 61.451 61.451 61.603 -0.152 18769 2125 1 23 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.368 0.675 18769 2126 1 23 . 1 1 10 10 TRP H H 10 8.281 8.281 8.993 -0.712 18769 2127 1 23 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.187 0.812 18769 2128 1 23 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.414 0.669 18769 2129 1 23 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.314 1.116 18769 2130 1 23 . 1 1 11 11 GLN H H 11 8.275 8.275 8.637 -0.362 18769 2131 1 23 . 1 1 12 12 ARG HA H 12 4.072 4.072 3.997 0.075 18769 2132 1 23 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.079 0.776 18769 2133 1 23 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.711 0.577 18769 2134 1 23 . 1 1 12 12 ARG H H 12 8.158 8.158 7.567 0.591 18769 2135 1 23 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.355 0.058 18769 2136 1 23 . 1 1 13 13 TRP CA C 13 62.193 62.193 60.145 2.048 18769 2137 1 23 . 1 1 13 13 TRP CB C 13 29.421 29.421 28.974 0.447 18769 2138 1 23 . 1 1 13 13 TRP H H 13 8.425 8.425 8.015 0.410 18769 2139 1 23 . 1 1 14 14 GLU HA H 14 3.698 3.698 2.856 0.842 18769 2140 1 23 . 1 1 14 14 GLU CA C 14 59.978 59.978 58.889 1.089 18769 2141 1 23 . 1 1 14 14 GLU CB C 14 28.680 28.680 28.790 -0.110 18769 2142 1 23 . 1 1 14 14 GLU H H 14 8.774 8.774 7.304 1.470 18769 2143 1 23 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.406 0.089 18769 2144 1 23 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.760 0.806 18769 2145 1 23 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.600 1.428 18769 2146 1 23 . 1 1 15 15 ASN H H 15 8.059 8.059 8.131 -0.072 18769 2147 1 23 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.263 -0.025 18769 2148 1 23 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.930 1.315 18769 2149 1 23 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.367 -0.176 18769 2150 1 23 . 1 1 16 16 TRP H H 16 8.071 8.071 8.092 -0.021 18769 2151 1 23 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.016 0.430 18769 2152 1 23 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.114 0.912 18769 2153 1 23 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.031 1.574 18769 2154 1 23 . 1 1 17 17 PHE H H 17 8.768 8.768 7.793 0.975 18769 2155 1 23 . 1 1 18 18 TRP HA H 18 4.223 4.223 3.637 0.586 18769 2156 1 23 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.595 1.220 18769 2157 1 23 . 1 1 18 18 TRP CB C 18 29.900 29.900 28.865 1.035 18769 2158 1 23 . 1 1 18 18 TRP H H 18 8.456 8.456 8.463 -0.007 18769 2159 1 23 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.374 -0.043 18769 2160 1 23 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.742 0.518 18769 2161 1 23 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.361 1.668 18769 2162 1 23 . 1 1 19 19 ASN H H 19 7.768 7.768 8.088 -0.320 18769 2163 1 23 . 1 1 20 20 VAL HA H 20 3.728 3.728 4.123 -0.395 18769 2164 1 23 . 1 1 20 20 VAL CA C 20 65.593 65.593 64.357 1.236 18769 2165 1 23 . 1 1 20 20 VAL CB C 20 32.363 32.363 30.648 1.715 18769 2166 1 23 . 1 1 20 20 VAL H H 20 7.983 7.983 7.527 0.456 18769 2167 1 23 . 1 1 21 21 THR HA H 21 3.886 3.886 3.887 -0.001 18769 2168 1 23 . 1 1 21 21 THR CA C 21 65.003 65.003 65.112 -0.109 18769 2169 1 23 . 1 1 21 21 THR CB C 21 69.837 69.837 68.841 0.996 18769 2170 1 23 . 1 1 21 21 THR H H 21 7.523 7.523 7.457 0.066 18769 2171 1 23 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.240 0.071 18769 2172 1 23 . 1 1 22 22 LEU CA C 22 56.094 56.094 56.359 -0.265 18769 2173 1 23 . 1 1 22 22 LEU CB C 22 42.641 42.641 43.166 -0.526 18769 2174 1 23 . 1 1 22 22 LEU H H 22 7.598 7.598 8.088 -0.490 18769 2175 1 23 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.731 -0.361 18769 2176 1 23 . 1 1 23 23 ARG CA C 23 56.977 56.977 52.895 4.082 18769 2177 1 23 . 1 1 23 23 ARG CB C 23 30.139 30.139 30.157 -0.018 18769 2178 1 23 . 1 1 23 23 ARG H H 23 7.480 7.480 7.653 -0.173 18769 2179 1 23 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.552 -0.161 18769 2180 1 23 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.504 2.532 18769 2181 1 23 . 1 1 24 24 PRO CB C 24 32.233 32.233 32.575 -0.342 18769 2182 1 23 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.425 -0.073 18769 2183 1 23 . 1 1 25 25 GLU CA C 25 57.150 57.150 57.707 -0.557 18769 2184 1 23 . 1 1 25 25 GLU CB C 25 29.234 29.234 30.167 -0.933 18769 2185 1 23 . 1 1 25 25 GLU H H 25 8.002 8.002 8.890 -0.888 18769 2186 1 24 . 1 1 2 2 SER HA H 2 4.611 4.611 4.854 -0.243 18769 2187 1 24 . 1 1 2 2 SER CA C 2 58.466 58.466 57.406 1.060 18769 2188 1 24 . 1 1 2 2 SER CB C 2 65.003 65.003 64.410 0.593 18769 2189 1 24 . 1 1 2 2 SER H H 2 8.606 8.606 8.287 0.319 18769 2190 1 24 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.554 -0.200 18769 2191 1 24 . 1 1 3 3 ALA CA C 3 54.477 54.477 53.144 1.333 18769 2192 1 24 . 1 1 3 3 ALA CB C 3 19.356 19.356 19.055 0.301 18769 2193 1 24 . 1 1 3 3 ALA H H 3 8.654 8.654 8.392 0.262 18769 2194 1 24 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.769 -0.499 18769 2195 1 24 . 1 1 4 4 LEU CA C 4 57.815 57.815 55.824 1.991 18769 2196 1 24 . 1 1 4 4 LEU CB C 4 43.003 43.003 42.472 0.531 18769 2197 1 24 . 1 1 4 4 LEU H H 4 7.954 7.954 7.986 -0.032 18769 2198 1 24 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.137 -0.258 18769 2199 1 24 . 1 1 5 5 VAL CA C 5 65.477 65.477 64.322 1.155 18769 2200 1 24 . 1 1 5 5 VAL CB C 5 33.015 33.015 32.696 0.319 18769 2201 1 24 . 1 1 5 5 VAL H H 5 7.494 7.494 7.653 -0.159 18769 2202 1 24 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.579 0.055 18769 2203 1 24 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.400 -0.314 18769 2204 1 24 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.374 0.634 18769 2205 1 24 . 1 1 6 6 ASN H H 6 7.994 7.994 8.387 -0.393 18769 2206 1 24 . 1 1 7 7 SER HA H 7 4.429 4.429 4.439 -0.010 18769 2207 1 24 . 1 1 7 7 SER CA C 7 62.214 62.214 62.686 -0.472 18769 2208 1 24 . 1 1 7 7 SER CB C 7 64.026 64.026 63.063 0.963 18769 2209 1 24 . 1 1 7 7 SER H H 7 8.222 8.222 8.433 -0.211 18769 2210 1 24 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.637 -0.207 18769 2211 1 24 . 1 1 8 8 TYR CA C 8 61.958 61.958 60.582 1.376 18769 2212 1 24 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.331 0.608 18769 2213 1 24 . 1 1 8 8 TYR H H 8 8.191 8.191 8.168 0.023 18769 2214 1 24 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.717 0.341 18769 2215 1 24 . 1 1 9 9 LEU CA C 9 58.791 58.791 57.784 1.007 18769 2216 1 24 . 1 1 9 9 LEU CB C 9 42.528 42.528 40.983 1.545 18769 2217 1 24 . 1 1 9 9 LEU H H 9 8.306 8.306 7.820 0.486 18769 2218 1 24 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.386 0.224 18769 2219 1 24 . 1 1 10 10 TRP CA C 10 61.451 61.451 61.430 0.021 18769 2220 1 24 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.377 0.666 18769 2221 1 24 . 1 1 10 10 TRP H H 10 8.281 8.281 9.011 -0.730 18769 2222 1 24 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.043 0.956 18769 2223 1 24 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.891 0.192 18769 2224 1 24 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.324 1.106 18769 2225 1 24 . 1 1 11 11 GLN H H 11 8.275 8.275 8.758 -0.483 18769 2226 1 24 . 1 1 12 12 ARG HA H 12 4.072 4.072 3.981 0.091 18769 2227 1 24 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.743 0.112 18769 2228 1 24 . 1 1 12 12 ARG CB C 12 30.288 30.288 30.118 0.170 18769 2229 1 24 . 1 1 12 12 ARG H H 12 8.158 8.158 7.562 0.596 18769 2230 1 24 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.418 -0.005 18769 2231 1 24 . 1 1 13 13 TRP CA C 13 62.193 62.193 59.655 2.538 18769 2232 1 24 . 1 1 13 13 TRP CB C 13 29.421 29.421 29.134 0.287 18769 2233 1 24 . 1 1 13 13 TRP H H 13 8.425 8.425 7.236 1.189 18769 2234 1 24 . 1 1 14 14 GLU HA H 14 3.698 3.698 2.458 1.240 18769 2235 1 24 . 1 1 14 14 GLU CA C 14 59.978 59.978 58.804 1.174 18769 2236 1 24 . 1 1 14 14 GLU CB C 14 28.680 28.680 28.894 -0.214 18769 2237 1 24 . 1 1 14 14 GLU H H 14 8.774 8.774 7.291 1.483 18769 2238 1 24 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.401 0.094 18769 2239 1 24 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.327 1.240 18769 2240 1 24 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.605 1.423 18769 2241 1 24 . 1 1 15 15 ASN H H 15 8.059 8.059 8.023 0.036 18769 2242 1 24 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.325 -0.087 18769 2243 1 24 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.291 1.954 18769 2244 1 24 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.574 -0.383 18769 2245 1 24 . 1 1 16 16 TRP H H 16 8.071 8.071 7.760 0.311 18769 2246 1 24 . 1 1 17 17 PHE HA H 17 3.446 3.446 2.974 0.472 18769 2247 1 24 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.153 0.873 18769 2248 1 24 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.040 1.565 18769 2249 1 24 . 1 1 17 17 PHE H H 17 8.768 8.768 8.010 0.758 18769 2250 1 24 . 1 1 18 18 TRP HA H 18 4.223 4.223 3.854 0.369 18769 2251 1 24 . 1 1 18 18 TRP CA C 18 60.815 60.815 58.979 1.836 18769 2252 1 24 . 1 1 18 18 TRP CB C 18 29.900 29.900 28.901 0.999 18769 2253 1 24 . 1 1 18 18 TRP H H 18 8.456 8.456 8.150 0.305 18769 2254 1 24 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.389 -0.058 18769 2255 1 24 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.215 1.045 18769 2256 1 24 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.666 1.363 18769 2257 1 24 . 1 1 19 19 ASN H H 19 7.768 7.768 7.362 0.406 18769 2258 1 24 . 1 1 20 20 VAL HA H 20 3.728 3.728 4.186 -0.458 18769 2259 1 24 . 1 1 20 20 VAL CA C 20 65.593 65.593 63.729 1.864 18769 2260 1 24 . 1 1 20 20 VAL CB C 20 32.363 32.363 32.200 0.163 18769 2261 1 24 . 1 1 20 20 VAL H H 20 7.983 7.983 6.997 0.986 18769 2262 1 24 . 1 1 21 21 THR HA H 21 3.886 3.886 3.930 -0.044 18769 2263 1 24 . 1 1 21 21 THR CA C 21 65.003 65.003 64.768 0.235 18769 2264 1 24 . 1 1 21 21 THR CB C 21 69.837 69.837 68.490 1.347 18769 2265 1 24 . 1 1 21 21 THR H H 21 7.523 7.523 8.036 -0.513 18769 2266 1 24 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.239 0.072 18769 2267 1 24 . 1 1 22 22 LEU CA C 22 56.094 56.094 55.586 0.508 18769 2268 1 24 . 1 1 22 22 LEU CB C 22 42.641 42.641 42.702 -0.061 18769 2269 1 24 . 1 1 22 22 LEU H H 22 7.598 7.598 7.526 0.072 18769 2270 1 24 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.047 0.323 18769 2271 1 24 . 1 1 23 23 ARG CA C 23 56.977 56.977 55.797 1.179 18769 2272 1 24 . 1 1 23 23 ARG CB C 23 30.139 30.139 29.349 0.791 18769 2273 1 24 . 1 1 23 23 ARG H H 23 7.480 7.480 7.619 -0.139 18769 2274 1 24 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.470 -0.079 18769 2275 1 24 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.567 2.469 18769 2276 1 24 . 1 1 24 24 PRO CB C 24 32.233 32.233 30.339 1.894 18769 2277 1 24 . 1 1 25 25 GLU HA H 25 4.352 4.352 3.757 0.595 18769 2278 1 24 . 1 1 25 25 GLU CA C 25 57.150 57.150 57.320 -0.170 18769 2279 1 24 . 1 1 25 25 GLU CB C 25 29.234 29.234 28.791 0.443 18769 2280 1 24 . 1 1 25 25 GLU H H 25 8.002 8.002 8.124 -0.122 18769 2281 1 25 . 1 1 2 2 SER HA H 2 4.611 4.611 4.749 -0.138 18769 2282 1 25 . 1 1 2 2 SER CA C 2 58.466 58.466 57.828 0.638 18769 2283 1 25 . 1 1 2 2 SER CB C 2 65.003 65.003 64.692 0.311 18769 2284 1 25 . 1 1 2 2 SER H H 2 8.606 8.606 8.547 0.059 18769 2285 1 25 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.737 -0.383 18769 2286 1 25 . 1 1 3 3 ALA CA C 3 54.477 54.477 53.453 1.024 18769 2287 1 25 . 1 1 3 3 ALA CB C 3 19.356 19.356 19.100 0.256 18769 2288 1 25 . 1 1 3 3 ALA H H 3 8.654 8.654 8.680 -0.026 18769 2289 1 25 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.469 -0.199 18769 2290 1 25 . 1 1 4 4 LEU CA C 4 57.815 57.815 56.956 0.858 18769 2291 1 25 . 1 1 4 4 LEU CB C 4 43.003 43.003 41.640 1.363 18769 2292 1 25 . 1 1 4 4 LEU H H 4 7.954 7.954 7.975 -0.021 18769 2293 1 25 . 1 1 5 5 VAL HA H 5 3.879 3.879 3.862 0.017 18769 2294 1 25 . 1 1 5 5 VAL CA C 5 65.477 65.477 66.685 -1.208 18769 2295 1 25 . 1 1 5 5 VAL CB C 5 33.015 33.015 31.544 1.471 18769 2296 1 25 . 1 1 5 5 VAL H H 5 7.494 7.494 7.986 -0.492 18769 2297 1 25 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.472 0.162 18769 2298 1 25 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.407 -0.321 18769 2299 1 25 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.130 0.877 18769 2300 1 25 . 1 1 6 6 ASN H H 6 7.994 7.994 8.264 -0.270 18769 2301 1 25 . 1 1 7 7 SER HA H 7 4.429 4.429 4.325 0.104 18769 2302 1 25 . 1 1 7 7 SER CA C 7 62.214 62.214 61.903 0.311 18769 2303 1 25 . 1 1 7 7 SER CB C 7 64.026 64.026 63.303 0.723 18769 2304 1 25 . 1 1 7 7 SER H H 7 8.222 8.222 7.743 0.479 18769 2305 1 25 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.346 0.084 18769 2306 1 25 . 1 1 8 8 TYR CA C 8 61.958 61.958 60.804 1.153 18769 2307 1 25 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.387 0.553 18769 2308 1 25 . 1 1 8 8 TYR H H 8 8.191 8.191 7.962 0.229 18769 2309 1 25 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.353 0.705 18769 2310 1 25 . 1 1 9 9 LEU CA C 9 58.791 58.791 57.083 1.708 18769 2311 1 25 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.066 1.462 18769 2312 1 25 . 1 1 9 9 LEU H H 9 8.306 8.306 8.269 0.037 18769 2313 1 25 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.238 0.372 18769 2314 1 25 . 1 1 10 10 TRP CA C 10 61.451 61.451 59.768 1.683 18769 2315 1 25 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.747 0.296 18769 2316 1 25 . 1 1 10 10 TRP H H 10 8.281 8.281 8.677 -0.396 18769 2317 1 25 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.769 0.230 18769 2318 1 25 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.508 0.575 18769 2319 1 25 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.630 0.800 18769 2320 1 25 . 1 1 11 11 GLN H H 11 8.275 8.275 7.958 0.317 18769 2321 1 25 . 1 1 12 12 ARG HA H 12 4.072 4.072 4.023 0.049 18769 2322 1 25 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.735 0.120 18769 2323 1 25 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.852 0.436 18769 2324 1 25 . 1 1 12 12 ARG H H 12 8.158 8.158 7.635 0.523 18769 2325 1 25 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.242 0.171 18769 2326 1 25 . 1 1 13 13 TRP CA C 13 62.193 62.193 60.035 2.158 18769 2327 1 25 . 1 1 13 13 TRP CB C 13 29.421 29.421 29.799 -0.378 18769 2328 1 25 . 1 1 13 13 TRP H H 13 8.425 8.425 8.116 0.309 18769 2329 1 25 . 1 1 14 14 GLU HA H 14 3.698 3.698 3.591 0.107 18769 2330 1 25 . 1 1 14 14 GLU CA C 14 59.978 59.978 58.922 1.056 18769 2331 1 25 . 1 1 14 14 GLU CB C 14 28.680 28.680 28.957 -0.277 18769 2332 1 25 . 1 1 14 14 GLU H H 14 8.774 8.774 7.736 1.038 18769 2333 1 25 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.517 -0.022 18769 2334 1 25 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.897 0.669 18769 2335 1 25 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.709 1.319 18769 2336 1 25 . 1 1 15 15 ASN H H 15 8.059 8.059 8.586 -0.527 18769 2337 1 25 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.394 -0.156 18769 2338 1 25 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.964 1.281 18769 2339 1 25 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.489 -0.298 18769 2340 1 25 . 1 1 16 16 TRP H H 16 8.071 8.071 8.110 -0.039 18769 2341 1 25 . 1 1 17 17 PHE HA H 17 3.446 3.446 2.997 0.449 18769 2342 1 25 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.803 0.223 18769 2343 1 25 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.569 1.036 18769 2344 1 25 . 1 1 17 17 PHE H H 17 8.768 8.768 7.860 0.908 18769 2345 1 25 . 1 1 18 18 TRP HA H 18 4.223 4.223 4.095 0.128 18769 2346 1 25 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.233 1.582 18769 2347 1 25 . 1 1 18 18 TRP CB C 18 29.900 29.900 29.384 0.516 18769 2348 1 25 . 1 1 18 18 TRP H H 18 8.456 8.456 8.652 -0.196 18769 2349 1 25 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.476 -0.145 18769 2350 1 25 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.506 0.754 18769 2351 1 25 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.580 1.449 18769 2352 1 25 . 1 1 19 19 ASN H H 19 7.768 7.768 7.961 -0.193 18769 2353 1 25 . 1 1 20 20 VAL HA H 20 3.728 3.728 3.777 -0.049 18769 2354 1 25 . 1 1 20 20 VAL CA C 20 65.593 65.593 65.001 0.592 18769 2355 1 25 . 1 1 20 20 VAL CB C 20 32.363 32.363 31.796 0.567 18769 2356 1 25 . 1 1 20 20 VAL H H 20 7.983 7.983 8.308 -0.325 18769 2357 1 25 . 1 1 21 21 THR HA H 21 3.886 3.886 4.038 -0.152 18769 2358 1 25 . 1 1 21 21 THR CA C 21 65.003 65.003 65.226 -0.223 18769 2359 1 25 . 1 1 21 21 THR CB C 21 69.837 69.837 69.161 0.676 18769 2360 1 25 . 1 1 21 21 THR H H 21 7.523 7.523 7.302 0.221 18769 2361 1 25 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.286 0.025 18769 2362 1 25 . 1 1 22 22 LEU CA C 22 56.094 56.094 56.541 -0.446 18769 2363 1 25 . 1 1 22 22 LEU CB C 22 42.641 42.641 43.496 -0.855 18769 2364 1 25 . 1 1 22 22 LEU H H 22 7.598 7.598 8.146 -0.548 18769 2365 1 25 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.666 -0.296 18769 2366 1 25 . 1 1 23 23 ARG CA C 23 56.977 56.977 53.329 3.648 18769 2367 1 25 . 1 1 23 23 ARG CB C 23 30.139 30.139 32.039 -1.900 18769 2368 1 25 . 1 1 23 23 ARG H H 23 7.480 7.480 8.031 -0.551 18769 2369 1 25 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.696 -0.305 18769 2370 1 25 . 1 1 24 24 PRO CA C 24 65.036 65.036 63.104 1.932 18769 2371 1 25 . 1 1 24 24 PRO CB C 24 32.233 32.233 30.907 1.326 18769 2372 1 25 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.294 0.058 18769 2373 1 25 . 1 1 25 25 GLU CA C 25 57.150 57.150 57.315 -0.164 18769 2374 1 25 . 1 1 25 25 GLU CB C 25 29.234 29.234 30.920 -1.686 18769 2375 1 25 . 1 1 25 25 GLU H H 25 8.002 8.002 8.528 -0.526 18769 2376 1 26 . 1 1 2 2 SER HA H 2 4.611 4.611 4.183 0.428 18769 2377 1 26 . 1 1 2 2 SER CA C 2 58.466 58.466 59.067 -0.601 18769 2378 1 26 . 1 1 2 2 SER CB C 2 65.003 65.003 63.347 1.656 18769 2379 1 26 . 1 1 2 2 SER H H 2 8.606 8.606 8.380 0.226 18769 2380 1 26 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.373 -0.019 18769 2381 1 26 . 1 1 3 3 ALA CA C 3 54.477 54.477 53.101 1.376 18769 2382 1 26 . 1 1 3 3 ALA CB C 3 19.356 19.356 19.424 -0.068 18769 2383 1 26 . 1 1 3 3 ALA H H 3 8.654 8.654 8.211 0.443 18769 2384 1 26 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.569 -0.299 18769 2385 1 26 . 1 1 4 4 LEU CA C 4 57.815 57.815 55.734 2.081 18769 2386 1 26 . 1 1 4 4 LEU CB C 4 43.003 43.003 42.558 0.445 18769 2387 1 26 . 1 1 4 4 LEU H H 4 7.954 7.954 8.603 -0.649 18769 2388 1 26 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.035 -0.156 18769 2389 1 26 . 1 1 5 5 VAL CA C 5 65.477 65.477 64.831 0.646 18769 2390 1 26 . 1 1 5 5 VAL CB C 5 33.015 33.015 32.636 0.379 18769 2391 1 26 . 1 1 5 5 VAL H H 5 7.494 7.494 7.594 -0.100 18769 2392 1 26 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.561 0.073 18769 2393 1 26 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.782 -0.696 18769 2394 1 26 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.610 0.398 18769 2395 1 26 . 1 1 6 6 ASN H H 6 7.994 7.994 8.641 -0.647 18769 2396 1 26 . 1 1 7 7 SER HA H 7 4.429 4.429 4.362 0.067 18769 2397 1 26 . 1 1 7 7 SER CA C 7 62.214 62.214 62.559 -0.345 18769 2398 1 26 . 1 1 7 7 SER CB C 7 64.026 64.026 63.217 0.809 18769 2399 1 26 . 1 1 7 7 SER H H 7 8.222 8.222 8.318 -0.096 18769 2400 1 26 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.408 0.022 18769 2401 1 26 . 1 1 8 8 TYR CA C 8 61.958 61.958 60.601 1.357 18769 2402 1 26 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.458 0.482 18769 2403 1 26 . 1 1 8 8 TYR H H 8 8.191 8.191 7.949 0.242 18769 2404 1 26 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.629 0.429 18769 2405 1 26 . 1 1 9 9 LEU CA C 9 58.791 58.791 58.117 0.674 18769 2406 1 26 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.761 0.767 18769 2407 1 26 . 1 1 9 9 LEU H H 9 8.306 8.306 8.153 0.153 18769 2408 1 26 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.443 0.167 18769 2409 1 26 . 1 1 10 10 TRP CA C 10 61.451 61.451 61.151 0.300 18769 2410 1 26 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.549 0.494 18769 2411 1 26 . 1 1 10 10 TRP H H 10 8.281 8.281 8.707 -0.426 18769 2412 1 26 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.057 0.942 18769 2413 1 26 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.199 0.884 18769 2414 1 26 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.143 1.286 18769 2415 1 26 . 1 1 11 11 GLN H H 11 8.275 8.275 8.554 -0.279 18769 2416 1 26 . 1 1 12 12 ARG HA H 12 4.072 4.072 3.964 0.108 18769 2417 1 26 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.590 0.265 18769 2418 1 26 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.772 0.516 18769 2419 1 26 . 1 1 12 12 ARG H H 12 8.158 8.158 8.248 -0.090 18769 2420 1 26 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.352 0.061 18769 2421 1 26 . 1 1 13 13 TRP CA C 13 62.193 62.193 59.678 2.515 18769 2422 1 26 . 1 1 13 13 TRP CB C 13 29.421 29.421 28.992 0.429 18769 2423 1 26 . 1 1 13 13 TRP H H 13 8.425 8.425 7.248 1.177 18769 2424 1 26 . 1 1 14 14 GLU HA H 14 3.698 3.698 2.757 0.941 18769 2425 1 26 . 1 1 14 14 GLU CA C 14 59.978 59.978 58.961 1.017 18769 2426 1 26 . 1 1 14 14 GLU CB C 14 28.680 28.680 28.560 0.120 18769 2427 1 26 . 1 1 14 14 GLU H H 14 8.774 8.774 7.202 1.572 18769 2428 1 26 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.415 0.080 18769 2429 1 26 . 1 1 15 15 ASN CA C 15 57.566 57.566 57.005 0.561 18769 2430 1 26 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.577 1.451 18769 2431 1 26 . 1 1 15 15 ASN H H 15 8.059 8.059 8.262 -0.203 18769 2432 1 26 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.310 -0.072 18769 2433 1 26 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.714 1.531 18769 2434 1 26 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.485 -0.294 18769 2435 1 26 . 1 1 16 16 TRP H H 16 8.071 8.071 7.830 0.241 18769 2436 1 26 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.145 0.301 18769 2437 1 26 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.298 0.728 18769 2438 1 26 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.086 1.519 18769 2439 1 26 . 1 1 17 17 PHE H H 17 8.768 8.768 8.159 0.609 18769 2440 1 26 . 1 1 18 18 TRP HA H 18 4.223 4.223 4.082 0.141 18769 2441 1 26 . 1 1 18 18 TRP CA C 18 60.815 60.815 58.324 2.491 18769 2442 1 26 . 1 1 18 18 TRP CB C 18 29.900 29.900 29.873 0.026 18769 2443 1 26 . 1 1 18 18 TRP H H 18 8.456 8.456 7.915 0.541 18769 2444 1 26 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.402 -0.071 18769 2445 1 26 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.747 0.513 18769 2446 1 26 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.362 1.667 18769 2447 1 26 . 1 1 19 19 ASN H H 19 7.768 7.768 8.662 -0.894 18769 2448 1 26 . 1 1 20 20 VAL HA H 20 3.728 3.728 3.721 0.007 18769 2449 1 26 . 1 1 20 20 VAL CA C 20 65.593 65.593 65.702 -0.109 18769 2450 1 26 . 1 1 20 20 VAL CB C 20 32.363 32.363 30.800 1.563 18769 2451 1 26 . 1 1 20 20 VAL H H 20 7.983 7.983 7.898 0.085 18769 2452 1 26 . 1 1 21 21 THR HA H 21 3.886 3.886 4.175 -0.289 18769 2453 1 26 . 1 1 21 21 THR CA C 21 65.003 65.003 64.189 0.814 18769 2454 1 26 . 1 1 21 21 THR CB C 21 69.837 69.837 69.423 0.414 18769 2455 1 26 . 1 1 21 21 THR H H 21 7.523 7.523 7.223 0.300 18769 2456 1 26 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.588 -0.277 18769 2457 1 26 . 1 1 22 22 LEU CA C 22 56.094 56.094 54.864 1.230 18769 2458 1 26 . 1 1 22 22 LEU CB C 22 42.641 42.641 41.972 0.669 18769 2459 1 26 . 1 1 22 22 LEU H H 22 7.598 7.598 8.154 -0.556 18769 2460 1 26 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.110 0.260 18769 2461 1 26 . 1 1 23 23 ARG CA C 23 56.977 56.977 59.177 -2.200 18769 2462 1 26 . 1 1 23 23 ARG CB C 23 30.139 30.139 28.981 1.158 18769 2463 1 26 . 1 1 23 23 ARG H H 23 7.480 7.480 7.480 -0.000 18769 2464 1 26 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.429 -0.038 18769 2465 1 26 . 1 1 24 24 PRO CA C 24 65.036 65.036 63.053 1.983 18769 2466 1 26 . 1 1 24 24 PRO CB C 24 32.233 32.233 30.093 2.140 18769 2467 1 26 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.368 -0.016 18769 2468 1 26 . 1 1 25 25 GLU CA C 25 57.150 57.150 55.962 1.188 18769 2469 1 26 . 1 1 25 25 GLU CB C 25 29.234 29.234 30.625 -1.391 18769 2470 1 26 . 1 1 25 25 GLU H H 25 8.002 8.002 8.071 -0.069 18769 2471 1 27 . 1 1 2 2 SER HA H 2 4.611 4.611 4.831 -0.220 18769 2472 1 27 . 1 1 2 2 SER CA C 2 58.466 58.466 57.868 0.598 18769 2473 1 27 . 1 1 2 2 SER CB C 2 65.003 65.003 65.439 -0.436 18769 2474 1 27 . 1 1 2 2 SER H H 2 8.606 8.606 8.250 0.356 18769 2475 1 27 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.585 -0.231 18769 2476 1 27 . 1 1 3 3 ALA CA C 3 54.477 54.477 53.786 0.691 18769 2477 1 27 . 1 1 3 3 ALA CB C 3 19.356 19.356 19.187 0.169 18769 2478 1 27 . 1 1 3 3 ALA H H 3 8.654 8.654 8.635 0.019 18769 2479 1 27 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.516 -0.246 18769 2480 1 27 . 1 1 4 4 LEU CA C 4 57.815 57.815 55.620 2.195 18769 2481 1 27 . 1 1 4 4 LEU CB C 4 43.003 43.003 42.116 0.887 18769 2482 1 27 . 1 1 4 4 LEU H H 4 7.954 7.954 8.052 -0.098 18769 2483 1 27 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.110 -0.231 18769 2484 1 27 . 1 1 5 5 VAL CA C 5 65.477 65.477 65.164 0.313 18769 2485 1 27 . 1 1 5 5 VAL CB C 5 33.015 33.015 32.149 0.866 18769 2486 1 27 . 1 1 5 5 VAL H H 5 7.494 7.494 7.839 -0.345 18769 2487 1 27 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.508 0.126 18769 2488 1 27 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.559 -0.473 18769 2489 1 27 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.516 0.492 18769 2490 1 27 . 1 1 6 6 ASN H H 6 7.994 7.994 8.309 -0.315 18769 2491 1 27 . 1 1 7 7 SER HA H 7 4.429 4.429 4.339 0.090 18769 2492 1 27 . 1 1 7 7 SER CA C 7 62.214 62.214 62.018 0.196 18769 2493 1 27 . 1 1 7 7 SER CB C 7 64.026 64.026 63.232 0.794 18769 2494 1 27 . 1 1 7 7 SER H H 7 8.222 8.222 8.139 0.083 18769 2495 1 27 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.412 0.018 18769 2496 1 27 . 1 1 8 8 TYR CA C 8 61.958 61.958 61.000 0.958 18769 2497 1 27 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.634 0.306 18769 2498 1 27 . 1 1 8 8 TYR H H 8 8.191 8.191 7.948 0.243 18769 2499 1 27 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.914 0.144 18769 2500 1 27 . 1 1 9 9 LEU CA C 9 58.791 58.791 57.595 1.196 18769 2501 1 27 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.247 1.281 18769 2502 1 27 . 1 1 9 9 LEU H H 9 8.306 8.306 8.293 0.013 18769 2503 1 27 . 1 1 10 10 TRP HA H 10 4.610 4.610 5.029 -0.419 18769 2504 1 27 . 1 1 10 10 TRP CA C 10 61.451 61.451 60.162 1.289 18769 2505 1 27 . 1 1 10 10 TRP CB C 10 30.043 30.043 30.227 -0.184 18769 2506 1 27 . 1 1 10 10 TRP H H 10 8.281 8.281 8.453 -0.172 18769 2507 1 27 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.553 0.446 18769 2508 1 27 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.274 0.809 18769 2509 1 27 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.540 0.890 18769 2510 1 27 . 1 1 11 11 GLN H H 11 8.275 8.275 8.677 -0.402 18769 2511 1 27 . 1 1 12 12 ARG HA H 12 4.072 4.072 4.040 0.032 18769 2512 1 27 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.473 0.382 18769 2513 1 27 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.627 0.661 18769 2514 1 27 . 1 1 12 12 ARG H H 12 8.158 8.158 7.680 0.478 18769 2515 1 27 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.404 0.009 18769 2516 1 27 . 1 1 13 13 TRP CA C 13 62.193 62.193 59.840 2.353 18769 2517 1 27 . 1 1 13 13 TRP CB C 13 29.421 29.421 29.140 0.281 18769 2518 1 27 . 1 1 13 13 TRP H H 13 8.425 8.425 7.805 0.620 18769 2519 1 27 . 1 1 14 14 GLU HA H 14 3.698 3.698 2.585 1.113 18769 2520 1 27 . 1 1 14 14 GLU CA C 14 59.978 59.978 59.016 0.963 18769 2521 1 27 . 1 1 14 14 GLU CB C 14 28.680 28.680 28.785 -0.105 18769 2522 1 27 . 1 1 14 14 GLU H H 14 8.774 8.774 7.637 1.137 18769 2523 1 27 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.502 -0.007 18769 2524 1 27 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.619 0.947 18769 2525 1 27 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.732 1.296 18769 2526 1 27 . 1 1 15 15 ASN H H 15 8.059 8.059 8.467 -0.408 18769 2527 1 27 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.320 -0.082 18769 2528 1 27 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.549 1.696 18769 2529 1 27 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.519 -0.328 18769 2530 1 27 . 1 1 16 16 TRP H H 16 8.071 8.071 8.034 0.037 18769 2531 1 27 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.136 0.309 18769 2532 1 27 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.076 0.950 18769 2533 1 27 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.016 1.589 18769 2534 1 27 . 1 1 17 17 PHE H H 17 8.768 8.768 8.125 0.643 18769 2535 1 27 . 1 1 18 18 TRP HA H 18 4.223 4.223 3.819 0.404 18769 2536 1 27 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.661 1.153 18769 2537 1 27 . 1 1 18 18 TRP CB C 18 29.900 29.900 28.713 1.187 18769 2538 1 27 . 1 1 18 18 TRP H H 18 8.456 8.456 8.477 -0.021 18769 2539 1 27 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.397 -0.066 18769 2540 1 27 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.273 0.987 18769 2541 1 27 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.574 1.455 18769 2542 1 27 . 1 1 19 19 ASN H H 19 7.768 7.768 7.633 0.135 18769 2543 1 27 . 1 1 20 20 VAL HA H 20 3.728 3.728 4.244 -0.516 18769 2544 1 27 . 1 1 20 20 VAL CA C 20 65.593 65.593 62.819 2.774 18769 2545 1 27 . 1 1 20 20 VAL CB C 20 32.363 32.363 31.948 0.415 18769 2546 1 27 . 1 1 20 20 VAL H H 20 7.983 7.983 7.041 0.942 18769 2547 1 27 . 1 1 21 21 THR HA H 21 3.886 3.886 4.189 -0.303 18769 2548 1 27 . 1 1 21 21 THR CA C 21 65.003 65.003 63.833 1.170 18769 2549 1 27 . 1 1 21 21 THR CB C 21 69.837 69.837 70.260 -0.423 18769 2550 1 27 . 1 1 21 21 THR H H 21 7.523 7.523 7.361 0.162 18769 2551 1 27 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.026 0.285 18769 2552 1 27 . 1 1 22 22 LEU CA C 22 56.094 56.094 57.520 -1.426 18769 2553 1 27 . 1 1 22 22 LEU CB C 22 42.641 42.641 42.073 0.568 18769 2554 1 27 . 1 1 22 22 LEU H H 22 7.598 7.598 7.894 -0.296 18769 2555 1 27 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.308 0.062 18769 2556 1 27 . 1 1 23 23 ARG CA C 23 56.977 56.977 58.063 -1.086 18769 2557 1 27 . 1 1 23 23 ARG CB C 23 30.139 30.139 28.432 1.707 18769 2558 1 27 . 1 1 23 23 ARG H H 23 7.480 7.480 8.349 -0.869 18769 2559 1 27 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.400 -0.009 18769 2560 1 27 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.872 2.164 18769 2561 1 27 . 1 1 24 24 PRO CB C 24 32.233 32.233 31.290 0.943 18769 2562 1 27 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.529 -0.177 18769 2563 1 27 . 1 1 25 25 GLU CA C 25 57.150 57.150 55.545 1.605 18769 2564 1 27 . 1 1 25 25 GLU CB C 25 29.234 29.234 31.261 -2.027 18769 2565 1 27 . 1 1 25 25 GLU H H 25 8.002 8.002 8.173 -0.171 18769 2566 1 28 . 1 1 2 2 SER HA H 2 4.611 4.611 4.915 -0.304 18769 2567 1 28 . 1 1 2 2 SER CA C 2 58.466 58.466 57.763 0.703 18769 2568 1 28 . 1 1 2 2 SER CB C 2 65.003 65.003 65.220 -0.217 18769 2569 1 28 . 1 1 2 2 SER H H 2 8.606 8.606 8.554 0.052 18769 2570 1 28 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.506 -0.152 18769 2571 1 28 . 1 1 3 3 ALA CA C 3 54.477 54.477 54.085 0.392 18769 2572 1 28 . 1 1 3 3 ALA CB C 3 19.356 19.356 19.092 0.264 18769 2573 1 28 . 1 1 3 3 ALA H H 3 8.654 8.654 8.659 -0.005 18769 2574 1 28 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.412 -0.142 18769 2575 1 28 . 1 1 4 4 LEU CA C 4 57.815 57.815 56.014 1.801 18769 2576 1 28 . 1 1 4 4 LEU CB C 4 43.003 43.003 41.947 1.056 18769 2577 1 28 . 1 1 4 4 LEU H H 4 7.954 7.954 8.078 -0.124 18769 2578 1 28 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.107 -0.228 18769 2579 1 28 . 1 1 5 5 VAL CA C 5 65.477 65.477 64.365 1.113 18769 2580 1 28 . 1 1 5 5 VAL CB C 5 33.015 33.015 32.734 0.281 18769 2581 1 28 . 1 1 5 5 VAL H H 5 7.494 7.494 7.660 -0.166 18769 2582 1 28 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.570 0.064 18769 2583 1 28 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.173 -0.087 18769 2584 1 28 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.568 0.440 18769 2585 1 28 . 1 1 6 6 ASN H H 6 7.994 7.994 8.128 -0.134 18769 2586 1 28 . 1 1 7 7 SER HA H 7 4.429 4.429 4.292 0.137 18769 2587 1 28 . 1 1 7 7 SER CA C 7 62.214 62.214 62.124 0.090 18769 2588 1 28 . 1 1 7 7 SER CB C 7 64.026 64.026 63.117 0.909 18769 2589 1 28 . 1 1 7 7 SER H H 7 8.222 8.222 7.708 0.514 18769 2590 1 28 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.484 -0.054 18769 2591 1 28 . 1 1 8 8 TYR CA C 8 61.958 61.958 60.542 1.416 18769 2592 1 28 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.518 0.422 18769 2593 1 28 . 1 1 8 8 TYR H H 8 8.191 8.191 8.272 -0.081 18769 2594 1 28 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.688 0.370 18769 2595 1 28 . 1 1 9 9 LEU CA C 9 58.791 58.791 57.647 1.144 18769 2596 1 28 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.943 0.585 18769 2597 1 28 . 1 1 9 9 LEU H H 9 8.306 8.306 7.940 0.366 18769 2598 1 28 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.279 0.331 18769 2599 1 28 . 1 1 10 10 TRP CA C 10 61.451 61.451 61.556 -0.105 18769 2600 1 28 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.192 0.851 18769 2601 1 28 . 1 1 10 10 TRP H H 10 8.281 8.281 8.923 -0.642 18769 2602 1 28 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.856 0.143 18769 2603 1 28 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.315 0.768 18769 2604 1 28 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.451 0.979 18769 2605 1 28 . 1 1 11 11 GLN H H 11 8.275 8.275 7.801 0.474 18769 2606 1 28 . 1 1 12 12 ARG HA H 12 4.072 4.072 4.030 0.042 18769 2607 1 28 . 1 1 12 12 ARG CA C 12 59.855 59.855 58.223 1.632 18769 2608 1 28 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.433 0.855 18769 2609 1 28 . 1 1 12 12 ARG H H 12 8.158 8.158 7.640 0.518 18769 2610 1 28 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.745 -0.332 18769 2611 1 28 . 1 1 13 13 TRP CA C 13 62.193 62.193 58.733 3.460 18769 2612 1 28 . 1 1 13 13 TRP CB C 13 29.421 29.421 31.230 -1.809 18769 2613 1 28 . 1 1 13 13 TRP H H 13 8.425 8.425 7.602 0.823 18769 2614 1 28 . 1 1 14 14 GLU HA H 14 3.698 3.698 4.123 -0.425 18769 2615 1 28 . 1 1 14 14 GLU CA C 14 59.978 59.978 59.398 0.580 18769 2616 1 28 . 1 1 14 14 GLU CB C 14 28.680 28.680 29.587 -0.906 18769 2617 1 28 . 1 1 14 14 GLU H H 14 8.774 8.774 8.320 0.454 18769 2618 1 28 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.597 -0.102 18769 2619 1 28 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.609 0.957 18769 2620 1 28 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.742 1.286 18769 2621 1 28 . 1 1 15 15 ASN H H 15 8.059 8.059 8.213 -0.154 18769 2622 1 28 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.364 -0.126 18769 2623 1 28 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.962 1.283 18769 2624 1 28 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.419 -0.228 18769 2625 1 28 . 1 1 16 16 TRP H H 16 8.071 8.071 7.864 0.207 18769 2626 1 28 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.087 0.359 18769 2627 1 28 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.662 0.364 18769 2628 1 28 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.804 0.801 18769 2629 1 28 . 1 1 17 17 PHE H H 17 8.768 8.768 7.809 0.959 18769 2630 1 28 . 1 1 18 18 TRP HA H 18 4.223 4.223 4.046 0.177 18769 2631 1 28 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.400 1.415 18769 2632 1 28 . 1 1 18 18 TRP CB C 18 29.900 29.900 29.287 0.613 18769 2633 1 28 . 1 1 18 18 TRP H H 18 8.456 8.456 8.525 -0.069 18769 2634 1 28 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.368 -0.037 18769 2635 1 28 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.559 0.701 18769 2636 1 28 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.348 1.681 18769 2637 1 28 . 1 1 19 19 ASN H H 19 7.768 7.768 7.853 -0.085 18769 2638 1 28 . 1 1 20 20 VAL HA H 20 3.728 3.728 3.805 -0.077 18769 2639 1 28 . 1 1 20 20 VAL CA C 20 65.593 65.593 65.167 0.426 18769 2640 1 28 . 1 1 20 20 VAL CB C 20 32.363 32.363 31.166 1.198 18769 2641 1 28 . 1 1 20 20 VAL H H 20 7.983 7.983 7.558 0.425 18769 2642 1 28 . 1 1 21 21 THR HA H 21 3.886 3.886 4.049 -0.163 18769 2643 1 28 . 1 1 21 21 THR CA C 21 65.003 65.003 64.684 0.319 18769 2644 1 28 . 1 1 21 21 THR CB C 21 69.837 69.837 69.403 0.434 18769 2645 1 28 . 1 1 21 21 THR H H 21 7.523 7.523 7.269 0.254 18769 2646 1 28 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.246 0.065 18769 2647 1 28 . 1 1 22 22 LEU CA C 22 56.094 56.094 57.238 -1.144 18769 2648 1 28 . 1 1 22 22 LEU CB C 22 42.641 42.641 43.313 -0.672 18769 2649 1 28 . 1 1 22 22 LEU H H 22 7.598 7.598 8.066 -0.468 18769 2650 1 28 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.581 -0.211 18769 2651 1 28 . 1 1 23 23 ARG CA C 23 56.977 56.977 54.461 2.516 18769 2652 1 28 . 1 1 23 23 ARG CB C 23 30.139 30.139 29.501 0.638 18769 2653 1 28 . 1 1 23 23 ARG H H 23 7.480 7.480 7.556 -0.076 18769 2654 1 28 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.601 -0.210 18769 2655 1 28 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.090 2.946 18769 2656 1 28 . 1 1 24 24 PRO CB C 24 32.233 32.233 32.640 -0.407 18769 2657 1 28 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.129 0.223 18769 2658 1 28 . 1 1 25 25 GLU CA C 25 57.150 57.150 57.866 -0.716 18769 2659 1 28 . 1 1 25 25 GLU CB C 25 29.234 29.234 29.584 -0.350 18769 2660 1 28 . 1 1 25 25 GLU H H 25 8.002 8.002 8.417 -0.415 18769 2661 1 29 . 1 1 2 2 SER HA H 2 4.611 4.611 4.764 -0.153 18769 2662 1 29 . 1 1 2 2 SER CA C 2 58.466 58.466 57.177 1.289 18769 2663 1 29 . 1 1 2 2 SER CB C 2 65.003 65.003 64.794 0.209 18769 2664 1 29 . 1 1 2 2 SER H H 2 8.606 8.606 8.159 0.447 18769 2665 1 29 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.661 -0.307 18769 2666 1 29 . 1 1 3 3 ALA CA C 3 54.477 54.477 53.634 0.843 18769 2667 1 29 . 1 1 3 3 ALA CB C 3 19.356 19.356 19.098 0.258 18769 2668 1 29 . 1 1 3 3 ALA H H 3 8.654 8.654 8.748 -0.094 18769 2669 1 29 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.174 0.096 18769 2670 1 29 . 1 1 4 4 LEU CA C 4 57.815 57.815 57.390 0.425 18769 2671 1 29 . 1 1 4 4 LEU CB C 4 43.003 43.003 40.910 2.093 18769 2672 1 29 . 1 1 4 4 LEU H H 4 7.954 7.954 8.305 -0.351 18769 2673 1 29 . 1 1 5 5 VAL HA H 5 3.879 3.879 3.696 0.183 18769 2674 1 29 . 1 1 5 5 VAL CA C 5 65.477 65.477 66.815 -1.338 18769 2675 1 29 . 1 1 5 5 VAL CB C 5 33.015 33.015 31.403 1.612 18769 2676 1 29 . 1 1 5 5 VAL H H 5 7.494 7.494 7.975 -0.481 18769 2677 1 29 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.523 0.111 18769 2678 1 29 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.322 -0.236 18769 2679 1 29 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.370 0.638 18769 2680 1 29 . 1 1 6 6 ASN H H 6 7.994 7.994 7.900 0.094 18769 2681 1 29 . 1 1 7 7 SER HA H 7 4.429 4.429 4.214 0.215 18769 2682 1 29 . 1 1 7 7 SER CA C 7 62.214 62.214 62.274 -0.060 18769 2683 1 29 . 1 1 7 7 SER CB C 7 64.026 64.026 63.379 0.647 18769 2684 1 29 . 1 1 7 7 SER H H 7 8.222 8.222 8.053 0.169 18769 2685 1 29 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.571 -0.141 18769 2686 1 29 . 1 1 8 8 TYR CA C 8 61.958 61.958 60.763 1.195 18769 2687 1 29 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.431 0.509 18769 2688 1 29 . 1 1 8 8 TYR H H 8 8.191 8.191 7.903 0.288 18769 2689 1 29 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.596 0.462 18769 2690 1 29 . 1 1 9 9 LEU CA C 9 58.791 58.791 57.909 0.882 18769 2691 1 29 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.713 0.815 18769 2692 1 29 . 1 1 9 9 LEU H H 9 8.306 8.306 8.070 0.236 18769 2693 1 29 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.540 0.070 18769 2694 1 29 . 1 1 10 10 TRP CA C 10 61.451 61.451 61.578 -0.127 18769 2695 1 29 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.394 0.649 18769 2696 1 29 . 1 1 10 10 TRP H H 10 8.281 8.281 8.770 -0.489 18769 2697 1 29 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.299 0.700 18769 2698 1 29 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.274 0.809 18769 2699 1 29 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.345 1.085 18769 2700 1 29 . 1 1 11 11 GLN H H 11 8.275 8.275 8.080 0.195 18769 2701 1 29 . 1 1 12 12 ARG HA H 12 4.072 4.072 4.048 0.024 18769 2702 1 29 . 1 1 12 12 ARG CA C 12 59.855 59.855 58.596 1.259 18769 2703 1 29 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.853 0.435 18769 2704 1 29 . 1 1 12 12 ARG H H 12 8.158 8.158 7.833 0.325 18769 2705 1 29 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.303 0.110 18769 2706 1 29 . 1 1 13 13 TRP CA C 13 62.193 62.193 60.005 2.188 18769 2707 1 29 . 1 1 13 13 TRP CB C 13 29.421 29.421 29.016 0.405 18769 2708 1 29 . 1 1 13 13 TRP H H 13 8.425 8.425 8.014 0.411 18769 2709 1 29 . 1 1 14 14 GLU HA H 14 3.698 3.698 2.297 1.401 18769 2710 1 29 . 1 1 14 14 GLU CA C 14 59.978 59.978 58.815 1.163 18769 2711 1 29 . 1 1 14 14 GLU CB C 14 28.680 28.680 28.496 0.184 18769 2712 1 29 . 1 1 14 14 GLU H H 14 8.774 8.774 7.067 1.707 18769 2713 1 29 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.446 0.049 18769 2714 1 29 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.260 1.306 18769 2715 1 29 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.599 1.429 18769 2716 1 29 . 1 1 15 15 ASN H H 15 8.059 8.059 7.550 0.509 18769 2717 1 29 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.289 -0.051 18769 2718 1 29 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.690 1.555 18769 2719 1 29 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.447 -0.256 18769 2720 1 29 . 1 1 16 16 TRP H H 16 8.071 8.071 7.788 0.283 18769 2721 1 29 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.061 0.385 18769 2722 1 29 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.557 0.469 18769 2723 1 29 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.309 1.296 18769 2724 1 29 . 1 1 17 17 PHE H H 17 8.768 8.768 7.967 0.801 18769 2725 1 29 . 1 1 18 18 TRP HA H 18 4.223 4.223 3.981 0.242 18769 2726 1 29 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.208 1.607 18769 2727 1 29 . 1 1 18 18 TRP CB C 18 29.900 29.900 28.967 0.933 18769 2728 1 29 . 1 1 18 18 TRP H H 18 8.456 8.456 8.020 0.436 18769 2729 1 29 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.479 -0.148 18769 2730 1 29 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.145 1.115 18769 2731 1 29 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.927 1.102 18769 2732 1 29 . 1 1 19 19 ASN H H 19 7.768 7.768 7.594 0.174 18769 2733 1 29 . 1 1 20 20 VAL HA H 20 3.728 3.728 4.141 -0.413 18769 2734 1 29 . 1 1 20 20 VAL CA C 20 65.593 65.593 63.969 1.624 18769 2735 1 29 . 1 1 20 20 VAL CB C 20 32.363 32.363 32.045 0.318 18769 2736 1 29 . 1 1 20 20 VAL H H 20 7.983 7.983 6.985 0.998 18769 2737 1 29 . 1 1 21 21 THR HA H 21 3.886 3.886 3.879 0.007 18769 2738 1 29 . 1 1 21 21 THR CA C 21 65.003 65.003 65.886 -0.883 18769 2739 1 29 . 1 1 21 21 THR CB C 21 69.837 69.837 68.522 1.315 18769 2740 1 29 . 1 1 21 21 THR H H 21 7.523 7.523 8.002 -0.479 18769 2741 1 29 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.213 0.098 18769 2742 1 29 . 1 1 22 22 LEU CA C 22 56.094 56.094 55.231 0.863 18769 2743 1 29 . 1 1 22 22 LEU CB C 22 42.641 42.641 42.329 0.312 18769 2744 1 29 . 1 1 22 22 LEU H H 22 7.598 7.598 7.414 0.184 18769 2745 1 29 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.060 0.310 18769 2746 1 29 . 1 1 23 23 ARG CA C 23 56.977 56.977 55.790 1.187 18769 2747 1 29 . 1 1 23 23 ARG CB C 23 30.139 30.139 29.286 0.853 18769 2748 1 29 . 1 1 23 23 ARG H H 23 7.480 7.480 8.183 -0.703 18769 2749 1 29 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.546 -0.155 18769 2750 1 29 . 1 1 24 24 PRO CA C 24 65.036 65.036 63.417 1.619 18769 2751 1 29 . 1 1 24 24 PRO CB C 24 32.233 32.233 30.390 1.843 18769 2752 1 29 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.372 -0.020 18769 2753 1 29 . 1 1 25 25 GLU CA C 25 57.150 57.150 57.166 -0.016 18769 2754 1 29 . 1 1 25 25 GLU CB C 25 29.234 29.234 31.579 -2.345 18769 2755 1 29 . 1 1 25 25 GLU H H 25 8.002 8.002 8.686 -0.684 18769 2756 1 30 . 1 1 2 2 SER HA H 2 4.611 4.611 4.823 -0.212 18769 2757 1 30 . 1 1 2 2 SER CA C 2 58.466 58.466 58.354 0.112 18769 2758 1 30 . 1 1 2 2 SER CB C 2 65.003 65.003 64.188 0.815 18769 2759 1 30 . 1 1 2 2 SER H H 2 8.606 8.606 8.536 0.070 18769 2760 1 30 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.780 -0.426 18769 2761 1 30 . 1 1 3 3 ALA CA C 3 54.477 54.477 52.805 1.672 18769 2762 1 30 . 1 1 3 3 ALA CB C 3 19.356 19.356 19.176 0.180 18769 2763 1 30 . 1 1 3 3 ALA H H 3 8.654 8.654 8.504 0.150 18769 2764 1 30 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.867 -0.597 18769 2765 1 30 . 1 1 4 4 LEU CA C 4 57.815 57.815 55.675 2.140 18769 2766 1 30 . 1 1 4 4 LEU CB C 4 43.003 43.003 42.520 0.483 18769 2767 1 30 . 1 1 4 4 LEU H H 4 7.954 7.954 7.545 0.409 18769 2768 1 30 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.031 -0.152 18769 2769 1 30 . 1 1 5 5 VAL CA C 5 65.477 65.477 65.383 0.094 18769 2770 1 30 . 1 1 5 5 VAL CB C 5 33.015 33.015 31.720 1.295 18769 2771 1 30 . 1 1 5 5 VAL H H 5 7.494 7.494 7.901 -0.407 18769 2772 1 30 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.537 0.097 18769 2773 1 30 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.388 -0.302 18769 2774 1 30 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.583 0.425 18769 2775 1 30 . 1 1 6 6 ASN H H 6 7.994 7.994 8.654 -0.660 18769 2776 1 30 . 1 1 7 7 SER HA H 7 4.429 4.429 4.248 0.181 18769 2777 1 30 . 1 1 7 7 SER CA C 7 62.214 62.214 62.071 0.143 18769 2778 1 30 . 1 1 7 7 SER CB C 7 64.026 64.026 63.097 0.929 18769 2779 1 30 . 1 1 7 7 SER H H 7 8.222 8.222 8.706 -0.484 18769 2780 1 30 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.371 0.059 18769 2781 1 30 . 1 1 8 8 TYR CA C 8 61.958 61.958 60.899 1.059 18769 2782 1 30 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.566 0.374 18769 2783 1 30 . 1 1 8 8 TYR H H 8 8.191 8.191 7.755 0.436 18769 2784 1 30 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.696 0.362 18769 2785 1 30 . 1 1 9 9 LEU CA C 9 58.791 58.791 58.115 0.676 18769 2786 1 30 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.196 1.332 18769 2787 1 30 . 1 1 9 9 LEU H H 9 8.306 8.306 8.062 0.244 18769 2788 1 30 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.315 0.295 18769 2789 1 30 . 1 1 10 10 TRP CA C 10 61.451 61.451 58.810 2.641 18769 2790 1 30 . 1 1 10 10 TRP CB C 10 30.043 30.043 30.350 -0.307 18769 2791 1 30 . 1 1 10 10 TRP H H 10 8.281 8.281 8.871 -0.590 18769 2792 1 30 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.900 0.099 18769 2793 1 30 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.157 0.926 18769 2794 1 30 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.223 1.208 18769 2795 1 30 . 1 1 11 11 GLN H H 11 8.275 8.275 8.102 0.173 18769 2796 1 30 . 1 1 12 12 ARG HA H 12 4.072 4.072 4.044 0.028 18769 2797 1 30 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.127 0.728 18769 2798 1 30 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.764 0.524 18769 2799 1 30 . 1 1 12 12 ARG H H 12 8.158 8.158 8.109 0.049 18769 2800 1 30 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.544 -0.131 18769 2801 1 30 . 1 1 13 13 TRP CA C 13 62.193 62.193 58.611 3.582 18769 2802 1 30 . 1 1 13 13 TRP CB C 13 29.421 29.421 30.791 -1.370 18769 2803 1 30 . 1 1 13 13 TRP H H 13 8.425 8.425 7.525 0.900 18769 2804 1 30 . 1 1 14 14 GLU HA H 14 3.698 3.698 3.692 0.006 18769 2805 1 30 . 1 1 14 14 GLU CA C 14 59.978 59.978 59.172 0.806 18769 2806 1 30 . 1 1 14 14 GLU CB C 14 28.680 28.680 29.246 -0.566 18769 2807 1 30 . 1 1 14 14 GLU H H 14 8.774 8.774 7.755 1.019 18769 2808 1 30 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.603 -0.108 18769 2809 1 30 . 1 1 15 15 ASN CA C 15 57.566 57.566 57.437 0.129 18769 2810 1 30 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.741 1.287 18769 2811 1 30 . 1 1 15 15 ASN H H 15 8.059 8.059 8.989 -0.930 18769 2812 1 30 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.421 -0.183 18769 2813 1 30 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.454 1.791 18769 2814 1 30 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.671 -0.480 18769 2815 1 30 . 1 1 16 16 TRP H H 16 8.071 8.071 7.831 0.240 18769 2816 1 30 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.278 0.168 18769 2817 1 30 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.736 0.290 18769 2818 1 30 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.558 1.047 18769 2819 1 30 . 1 1 17 17 PHE H H 17 8.768 8.768 7.818 0.950 18769 2820 1 30 . 1 1 18 18 TRP HA H 18 4.223 4.223 4.195 0.028 18769 2821 1 30 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.869 0.946 18769 2822 1 30 . 1 1 18 18 TRP CB C 18 29.900 29.900 29.296 0.604 18769 2823 1 30 . 1 1 18 18 TRP H H 18 8.456 8.456 8.671 -0.215 18769 2824 1 30 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.547 -0.216 18769 2825 1 30 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.095 1.165 18769 2826 1 30 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.441 1.588 18769 2827 1 30 . 1 1 19 19 ASN H H 19 7.768 7.768 8.229 -0.461 18769 2828 1 30 . 1 1 20 20 VAL HA H 20 3.728 3.728 3.916 -0.188 18769 2829 1 30 . 1 1 20 20 VAL CA C 20 65.593 65.593 64.612 0.981 18769 2830 1 30 . 1 1 20 20 VAL CB C 20 32.363 32.363 31.811 0.552 18769 2831 1 30 . 1 1 20 20 VAL H H 20 7.983 7.983 7.907 0.076 18769 2832 1 30 . 1 1 21 21 THR HA H 21 3.886 3.886 4.120 -0.234 18769 2833 1 30 . 1 1 21 21 THR CA C 21 65.003 65.003 65.291 -0.288 18769 2834 1 30 . 1 1 21 21 THR CB C 21 69.837 69.837 69.535 0.302 18769 2835 1 30 . 1 1 21 21 THR H H 21 7.523 7.523 7.870 -0.347 18769 2836 1 30 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.227 0.084 18769 2837 1 30 . 1 1 22 22 LEU CA C 22 56.094 56.094 57.358 -1.264 18769 2838 1 30 . 1 1 22 22 LEU CB C 22 42.641 42.641 42.021 0.620 18769 2839 1 30 . 1 1 22 22 LEU H H 22 7.598 7.598 8.055 -0.457 18769 2840 1 30 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.159 0.211 18769 2841 1 30 . 1 1 23 23 ARG CA C 23 56.977 56.977 60.852 -3.875 18769 2842 1 30 . 1 1 23 23 ARG CB C 23 30.139 30.139 28.171 1.968 18769 2843 1 30 . 1 1 23 23 ARG H H 23 7.480 7.480 8.341 -0.861 18769 2844 1 30 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.613 -0.222 18769 2845 1 30 . 1 1 24 24 PRO CA C 24 65.036 65.036 63.536 1.500 18769 2846 1 30 . 1 1 24 24 PRO CB C 24 32.233 32.233 30.173 2.060 18769 2847 1 30 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.416 -0.064 18769 2848 1 30 . 1 1 25 25 GLU CA C 25 57.150 57.150 57.311 -0.161 18769 2849 1 30 . 1 1 25 25 GLU CB C 25 29.234 29.234 31.898 -2.664 18769 2850 1 30 . 1 1 25 25 GLU H H 25 8.002 8.002 8.579 -0.577 18769 2851 1 31 . 1 1 2 2 SER HA H 2 4.611 4.611 4.213 0.398 18769 2852 1 31 . 1 1 2 2 SER CA C 2 58.466 58.466 58.396 0.070 18769 2853 1 31 . 1 1 2 2 SER CB C 2 65.003 65.003 63.700 1.303 18769 2854 1 31 . 1 1 2 2 SER H H 2 8.606 8.606 8.255 0.351 18769 2855 1 31 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.361 -0.007 18769 2856 1 31 . 1 1 3 3 ALA CA C 3 54.477 54.477 53.235 1.242 18769 2857 1 31 . 1 1 3 3 ALA CB C 3 19.356 19.356 18.990 0.366 18769 2858 1 31 . 1 1 3 3 ALA H H 3 8.654 8.654 8.259 0.395 18769 2859 1 31 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.369 -0.099 18769 2860 1 31 . 1 1 4 4 LEU CA C 4 57.815 57.815 56.854 0.961 18769 2861 1 31 . 1 1 4 4 LEU CB C 4 43.003 43.003 42.010 0.993 18769 2862 1 31 . 1 1 4 4 LEU H H 4 7.954 7.954 8.288 -0.334 18769 2863 1 31 . 1 1 5 5 VAL HA H 5 3.879 3.879 3.718 0.161 18769 2864 1 31 . 1 1 5 5 VAL CA C 5 65.477 65.477 66.377 -0.901 18769 2865 1 31 . 1 1 5 5 VAL CB C 5 33.015 33.015 31.445 1.571 18769 2866 1 31 . 1 1 5 5 VAL H H 5 7.494 7.494 8.036 -0.542 18769 2867 1 31 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.502 0.132 18769 2868 1 31 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.122 -0.036 18769 2869 1 31 . 1 1 6 6 ASN CB C 6 39.008 39.008 37.840 1.168 18769 2870 1 31 . 1 1 6 6 ASN H H 6 7.994 7.994 8.403 -0.409 18769 2871 1 31 . 1 1 7 7 SER HA H 7 4.429 4.429 4.280 0.149 18769 2872 1 31 . 1 1 7 7 SER CA C 7 62.214 62.214 61.936 0.278 18769 2873 1 31 . 1 1 7 7 SER CB C 7 64.026 64.026 63.303 0.723 18769 2874 1 31 . 1 1 7 7 SER H H 7 8.222 8.222 7.746 0.476 18769 2875 1 31 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.359 0.071 18769 2876 1 31 . 1 1 8 8 TYR CA C 8 61.958 61.958 61.153 0.805 18769 2877 1 31 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.581 0.359 18769 2878 1 31 . 1 1 8 8 TYR H H 8 8.191 8.191 8.047 0.144 18769 2879 1 31 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.656 0.402 18769 2880 1 31 . 1 1 9 9 LEU CA C 9 58.791 58.791 57.871 0.920 18769 2881 1 31 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.774 0.754 18769 2882 1 31 . 1 1 9 9 LEU H H 9 8.306 8.306 8.362 -0.056 18769 2883 1 31 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.326 0.284 18769 2884 1 31 . 1 1 10 10 TRP CA C 10 61.451 61.451 61.724 -0.272 18769 2885 1 31 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.250 0.793 18769 2886 1 31 . 1 1 10 10 TRP H H 10 8.281 8.281 8.848 -0.567 18769 2887 1 31 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.338 0.661 18769 2888 1 31 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.190 0.893 18769 2889 1 31 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.259 1.171 18769 2890 1 31 . 1 1 11 11 GLN H H 11 8.275 8.275 7.858 0.417 18769 2891 1 31 . 1 1 12 12 ARG HA H 12 4.072 4.072 4.092 -0.020 18769 2892 1 31 . 1 1 12 12 ARG CA C 12 59.855 59.855 58.689 1.166 18769 2893 1 31 . 1 1 12 12 ARG CB C 12 30.288 30.288 30.051 0.237 18769 2894 1 31 . 1 1 12 12 ARG H H 12 8.158 8.158 7.636 0.522 18769 2895 1 31 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.372 0.041 18769 2896 1 31 . 1 1 13 13 TRP CA C 13 62.193 62.193 60.443 1.750 18769 2897 1 31 . 1 1 13 13 TRP CB C 13 29.421 29.421 28.951 0.470 18769 2898 1 31 . 1 1 13 13 TRP H H 13 8.425 8.425 8.257 0.168 18769 2899 1 31 . 1 1 14 14 GLU HA H 14 3.698 3.698 2.703 0.995 18769 2900 1 31 . 1 1 14 14 GLU CA C 14 59.978 59.978 59.004 0.974 18769 2901 1 31 . 1 1 14 14 GLU CB C 14 28.680 28.680 28.786 -0.106 18769 2902 1 31 . 1 1 14 14 GLU H H 14 8.774 8.774 7.187 1.587 18769 2903 1 31 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.418 0.077 18769 2904 1 31 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.243 1.323 18769 2905 1 31 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.755 1.273 18769 2906 1 31 . 1 1 15 15 ASN H H 15 8.059 8.059 7.869 0.190 18769 2907 1 31 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.298 -0.060 18769 2908 1 31 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.859 1.386 18769 2909 1 31 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.384 -0.193 18769 2910 1 31 . 1 1 16 16 TRP H H 16 8.071 8.071 8.533 -0.462 18769 2911 1 31 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.145 0.301 18769 2912 1 31 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.386 0.640 18769 2913 1 31 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.052 1.553 18769 2914 1 31 . 1 1 17 17 PHE H H 17 8.768 8.768 8.443 0.325 18769 2915 1 31 . 1 1 18 18 TRP HA H 18 4.223 4.223 3.776 0.447 18769 2916 1 31 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.428 1.387 18769 2917 1 31 . 1 1 18 18 TRP CB C 18 29.900 29.900 29.137 0.763 18769 2918 1 31 . 1 1 18 18 TRP H H 18 8.456 8.456 8.364 0.092 18769 2919 1 31 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.386 -0.055 18769 2920 1 31 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.040 1.220 18769 2921 1 31 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.626 1.403 18769 2922 1 31 . 1 1 19 19 ASN H H 19 7.768 7.768 7.909 -0.141 18769 2923 1 31 . 1 1 20 20 VAL HA H 20 3.728 3.728 4.178 -0.450 18769 2924 1 31 . 1 1 20 20 VAL CA C 20 65.593 65.593 63.422 2.171 18769 2925 1 31 . 1 1 20 20 VAL CB C 20 32.363 32.363 32.521 -0.158 18769 2926 1 31 . 1 1 20 20 VAL H H 20 7.983 7.983 7.175 0.808 18769 2927 1 31 . 1 1 21 21 THR HA H 21 3.886 3.886 3.847 0.039 18769 2928 1 31 . 1 1 21 21 THR CA C 21 65.003 65.003 66.387 -1.384 18769 2929 1 31 . 1 1 21 21 THR CB C 21 69.837 69.837 68.490 1.347 18769 2930 1 31 . 1 1 21 21 THR H H 21 7.523 7.523 7.656 -0.133 18769 2931 1 31 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.196 0.115 18769 2932 1 31 . 1 1 22 22 LEU CA C 22 56.094 56.094 55.271 0.823 18769 2933 1 31 . 1 1 22 22 LEU CB C 22 42.641 42.641 42.121 0.520 18769 2934 1 31 . 1 1 22 22 LEU H H 22 7.598 7.598 7.668 -0.070 18769 2935 1 31 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.061 0.309 18769 2936 1 31 . 1 1 23 23 ARG CA C 23 56.977 56.977 55.879 1.098 18769 2937 1 31 . 1 1 23 23 ARG CB C 23 30.139 30.139 28.568 1.571 18769 2938 1 31 . 1 1 23 23 ARG H H 23 7.480 7.480 7.325 0.155 18769 2939 1 31 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.410 -0.019 18769 2940 1 31 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.932 2.104 18769 2941 1 31 . 1 1 24 24 PRO CB C 24 32.233 32.233 29.928 2.305 18769 2942 1 31 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.585 -0.233 18769 2943 1 31 . 1 1 25 25 GLU CA C 25 57.150 57.150 55.622 1.528 18769 2944 1 31 . 1 1 25 25 GLU CB C 25 29.234 29.234 31.659 -2.425 18769 2945 1 31 . 1 1 25 25 GLU H H 25 8.002 8.002 8.315 -0.313 18769 2946 1 32 . 1 1 2 2 SER HA H 2 4.611 4.611 4.809 -0.198 18769 2947 1 32 . 1 1 2 2 SER CA C 2 58.466 58.466 58.045 0.421 18769 2948 1 32 . 1 1 2 2 SER CB C 2 65.003 65.003 64.107 0.896 18769 2949 1 32 . 1 1 2 2 SER H H 2 8.606 8.606 8.635 -0.029 18769 2950 1 32 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.371 -0.017 18769 2951 1 32 . 1 1 3 3 ALA CA C 3 54.477 54.477 53.500 0.977 18769 2952 1 32 . 1 1 3 3 ALA CB C 3 19.356 19.356 19.349 0.007 18769 2953 1 32 . 1 1 3 3 ALA H H 3 8.654 8.654 8.878 -0.224 18769 2954 1 32 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.629 -0.359 18769 2955 1 32 . 1 1 4 4 LEU CA C 4 57.815 57.815 55.685 2.130 18769 2956 1 32 . 1 1 4 4 LEU CB C 4 43.003 43.003 42.515 0.488 18769 2957 1 32 . 1 1 4 4 LEU H H 4 7.954 7.954 8.029 -0.075 18769 2958 1 32 . 1 1 5 5 VAL HA H 5 3.879 3.879 3.704 0.175 18769 2959 1 32 . 1 1 5 5 VAL CA C 5 65.477 65.477 66.726 -1.249 18769 2960 1 32 . 1 1 5 5 VAL CB C 5 33.015 33.015 31.675 1.340 18769 2961 1 32 . 1 1 5 5 VAL H H 5 7.494 7.494 8.143 -0.649 18769 2962 1 32 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.616 0.018 18769 2963 1 32 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.561 -0.475 18769 2964 1 32 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.233 0.775 18769 2965 1 32 . 1 1 6 6 ASN H H 6 7.994 7.994 8.515 -0.521 18769 2966 1 32 . 1 1 7 7 SER HA H 7 4.429 4.429 4.271 0.158 18769 2967 1 32 . 1 1 7 7 SER CA C 7 62.214 62.214 62.615 -0.401 18769 2968 1 32 . 1 1 7 7 SER CB C 7 64.026 64.026 63.276 0.750 18769 2969 1 32 . 1 1 7 7 SER H H 7 8.222 8.222 8.072 0.150 18769 2970 1 32 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.304 0.126 18769 2971 1 32 . 1 1 8 8 TYR CA C 8 61.958 61.958 61.277 0.681 18769 2972 1 32 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.615 0.325 18769 2973 1 32 . 1 1 8 8 TYR H H 8 8.191 8.191 7.993 0.198 18769 2974 1 32 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.714 0.344 18769 2975 1 32 . 1 1 9 9 LEU CA C 9 58.791 58.791 58.198 0.593 18769 2976 1 32 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.981 0.547 18769 2977 1 32 . 1 1 9 9 LEU H H 9 8.306 8.306 7.906 0.400 18769 2978 1 32 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.260 0.350 18769 2979 1 32 . 1 1 10 10 TRP CA C 10 61.451 61.451 59.565 1.886 18769 2980 1 32 . 1 1 10 10 TRP CB C 10 30.043 30.043 30.013 0.030 18769 2981 1 32 . 1 1 10 10 TRP H H 10 8.281 8.281 8.762 -0.481 18769 2982 1 32 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.667 0.332 18769 2983 1 32 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.392 0.691 18769 2984 1 32 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.433 0.997 18769 2985 1 32 . 1 1 11 11 GLN H H 11 8.275 8.275 7.932 0.343 18769 2986 1 32 . 1 1 12 12 ARG HA H 12 4.072 4.072 3.968 0.104 18769 2987 1 32 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.730 0.124 18769 2988 1 32 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.905 0.383 18769 2989 1 32 . 1 1 12 12 ARG H H 12 8.158 8.158 7.793 0.365 18769 2990 1 32 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.283 0.130 18769 2991 1 32 . 1 1 13 13 TRP CA C 13 62.193 62.193 59.415 2.778 18769 2992 1 32 . 1 1 13 13 TRP CB C 13 29.421 29.421 29.643 -0.222 18769 2993 1 32 . 1 1 13 13 TRP H H 13 8.425 8.425 7.343 1.082 18769 2994 1 32 . 1 1 14 14 GLU HA H 14 3.698 3.698 3.788 -0.090 18769 2995 1 32 . 1 1 14 14 GLU CA C 14 59.978 59.978 59.472 0.506 18769 2996 1 32 . 1 1 14 14 GLU CB C 14 28.680 28.680 29.087 -0.407 18769 2997 1 32 . 1 1 14 14 GLU H H 14 8.774 8.774 7.438 1.336 18769 2998 1 32 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.542 -0.047 18769 2999 1 32 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.671 0.895 18769 3000 1 32 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.762 1.266 18769 3001 1 32 . 1 1 15 15 ASN H H 15 8.059 8.059 8.837 -0.778 18769 3002 1 32 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.405 -0.167 18769 3003 1 32 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.570 1.675 18769 3004 1 32 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.648 -0.457 18769 3005 1 32 . 1 1 16 16 TRP H H 16 8.071 8.071 7.868 0.203 18769 3006 1 32 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.187 0.259 18769 3007 1 32 . 1 1 17 17 PHE CA C 17 62.026 62.026 60.660 1.366 18769 3008 1 32 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.374 1.231 18769 3009 1 32 . 1 1 17 17 PHE H H 17 8.768 8.768 7.919 0.849 18769 3010 1 32 . 1 1 18 18 TRP HA H 18 4.223 4.223 3.584 0.639 18769 3011 1 32 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.682 1.133 18769 3012 1 32 . 1 1 18 18 TRP CB C 18 29.900 29.900 29.182 0.718 18769 3013 1 32 . 1 1 18 18 TRP H H 18 8.456 8.456 8.546 -0.090 18769 3014 1 32 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.465 -0.134 18769 3015 1 32 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.249 1.011 18769 3016 1 32 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.516 1.513 18769 3017 1 32 . 1 1 19 19 ASN H H 19 7.768 7.768 7.689 0.079 18769 3018 1 32 . 1 1 20 20 VAL HA H 20 3.728 3.728 3.917 -0.189 18769 3019 1 32 . 1 1 20 20 VAL CA C 20 65.593 65.593 64.247 1.346 18769 3020 1 32 . 1 1 20 20 VAL CB C 20 32.363 32.363 31.546 0.817 18769 3021 1 32 . 1 1 20 20 VAL H H 20 7.983 7.983 7.794 0.189 18769 3022 1 32 . 1 1 21 21 THR HA H 21 3.886 3.886 4.147 -0.261 18769 3023 1 32 . 1 1 21 21 THR CA C 21 65.003 65.003 64.823 0.180 18769 3024 1 32 . 1 1 21 21 THR CB C 21 69.837 69.837 69.735 0.102 18769 3025 1 32 . 1 1 21 21 THR H H 21 7.523 7.523 7.483 0.040 18769 3026 1 32 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.309 0.002 18769 3027 1 32 . 1 1 22 22 LEU CA C 22 56.094 56.094 57.090 -0.996 18769 3028 1 32 . 1 1 22 22 LEU CB C 22 42.641 42.641 42.044 0.598 18769 3029 1 32 . 1 1 22 22 LEU H H 22 7.598 7.598 8.024 -0.426 18769 3030 1 32 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.198 0.172 18769 3031 1 32 . 1 1 23 23 ARG CA C 23 56.977 56.977 58.596 -1.619 18769 3032 1 32 . 1 1 23 23 ARG CB C 23 30.139 30.139 27.968 2.171 18769 3033 1 32 . 1 1 23 23 ARG H H 23 7.480 7.480 7.889 -0.409 18769 3034 1 32 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.453 -0.062 18769 3035 1 32 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.166 2.870 18769 3036 1 32 . 1 1 24 24 PRO CB C 24 32.233 32.233 29.764 2.469 18769 3037 1 32 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.369 -0.017 18769 3038 1 32 . 1 1 25 25 GLU CA C 25 57.150 57.150 55.565 1.585 18769 3039 1 32 . 1 1 25 25 GLU CB C 25 29.234 29.234 29.973 -0.739 18769 3040 1 32 . 1 1 25 25 GLU H H 25 8.002 8.002 7.980 0.022 18769 3041 1 33 . 1 1 2 2 SER HA H 2 4.611 4.611 4.531 0.080 18769 3042 1 33 . 1 1 2 2 SER CA C 2 58.466 58.466 58.819 -0.353 18769 3043 1 33 . 1 1 2 2 SER CB C 2 65.003 65.003 63.601 1.402 18769 3044 1 33 . 1 1 2 2 SER H H 2 8.606 8.606 8.513 0.093 18769 3045 1 33 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.116 0.238 18769 3046 1 33 . 1 1 3 3 ALA CA C 3 54.477 54.477 54.246 0.231 18769 3047 1 33 . 1 1 3 3 ALA CB C 3 19.356 19.356 17.377 1.979 18769 3048 1 33 . 1 1 3 3 ALA H H 3 8.654 8.654 8.265 0.389 18769 3049 1 33 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.628 -0.358 18769 3050 1 33 . 1 1 4 4 LEU CA C 4 57.815 57.815 55.264 2.551 18769 3051 1 33 . 1 1 4 4 LEU CB C 4 43.003 43.003 42.031 0.972 18769 3052 1 33 . 1 1 4 4 LEU H H 4 7.954 7.954 7.963 -0.009 18769 3053 1 33 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.281 -0.402 18769 3054 1 33 . 1 1 5 5 VAL CA C 5 65.477 65.477 64.162 1.315 18769 3055 1 33 . 1 1 5 5 VAL CB C 5 33.015 33.015 32.582 0.433 18769 3056 1 33 . 1 1 5 5 VAL H H 5 7.494 7.494 7.702 -0.208 18769 3057 1 33 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.735 -0.101 18769 3058 1 33 . 1 1 6 6 ASN CA C 6 56.086 56.086 55.325 0.761 18769 3059 1 33 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.157 0.851 18769 3060 1 33 . 1 1 6 6 ASN H H 6 7.994 7.994 8.344 -0.350 18769 3061 1 33 . 1 1 7 7 SER HA H 7 4.429 4.429 4.350 0.079 18769 3062 1 33 . 1 1 7 7 SER CA C 7 62.214 62.214 62.423 -0.209 18769 3063 1 33 . 1 1 7 7 SER CB C 7 64.026 64.026 62.912 1.114 18769 3064 1 33 . 1 1 7 7 SER H H 7 8.222 8.222 8.370 -0.148 18769 3065 1 33 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.433 -0.003 18769 3066 1 33 . 1 1 8 8 TYR CA C 8 61.958 61.958 61.205 0.753 18769 3067 1 33 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.737 0.203 18769 3068 1 33 . 1 1 8 8 TYR H H 8 8.191 8.191 8.302 -0.111 18769 3069 1 33 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.978 0.080 18769 3070 1 33 . 1 1 9 9 LEU CA C 9 58.791 58.791 57.748 1.043 18769 3071 1 33 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.707 0.821 18769 3072 1 33 . 1 1 9 9 LEU H H 9 8.306 8.306 7.656 0.650 18769 3073 1 33 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.413 0.197 18769 3074 1 33 . 1 1 10 10 TRP CA C 10 61.451 61.451 60.770 0.681 18769 3075 1 33 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.424 0.619 18769 3076 1 33 . 1 1 10 10 TRP H H 10 8.281 8.281 8.840 -0.559 18769 3077 1 33 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.577 0.422 18769 3078 1 33 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.325 0.758 18769 3079 1 33 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.009 1.421 18769 3080 1 33 . 1 1 11 11 GLN H H 11 8.275 8.275 7.781 0.494 18769 3081 1 33 . 1 1 12 12 ARG HA H 12 4.072 4.072 3.984 0.088 18769 3082 1 33 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.805 0.050 18769 3083 1 33 . 1 1 12 12 ARG CB C 12 30.288 30.288 30.041 0.247 18769 3084 1 33 . 1 1 12 12 ARG H H 12 8.158 8.158 7.842 0.316 18769 3085 1 33 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.247 0.166 18769 3086 1 33 . 1 1 13 13 TRP CA C 13 62.193 62.193 59.459 2.734 18769 3087 1 33 . 1 1 13 13 TRP CB C 13 29.421 29.421 29.547 -0.126 18769 3088 1 33 . 1 1 13 13 TRP H H 13 8.425 8.425 7.420 1.005 18769 3089 1 33 . 1 1 14 14 GLU HA H 14 3.698 3.698 3.652 0.046 18769 3090 1 33 . 1 1 14 14 GLU CA C 14 59.978 59.978 59.626 0.353 18769 3091 1 33 . 1 1 14 14 GLU CB C 14 28.680 28.680 29.047 -0.367 18769 3092 1 33 . 1 1 14 14 GLU H H 14 8.774 8.774 7.719 1.055 18769 3093 1 33 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.561 -0.066 18769 3094 1 33 . 1 1 15 15 ASN CA C 15 57.566 57.566 57.180 0.386 18769 3095 1 33 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.677 1.351 18769 3096 1 33 . 1 1 15 15 ASN H H 15 8.059 8.059 8.820 -0.761 18769 3097 1 33 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.376 -0.138 18769 3098 1 33 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.886 1.359 18769 3099 1 33 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.686 -0.495 18769 3100 1 33 . 1 1 16 16 TRP H H 16 8.071 8.071 8.055 0.016 18769 3101 1 33 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.327 0.119 18769 3102 1 33 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.640 0.386 18769 3103 1 33 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.675 0.930 18769 3104 1 33 . 1 1 17 17 PHE H H 17 8.768 8.768 8.253 0.515 18769 3105 1 33 . 1 1 18 18 TRP HA H 18 4.223 4.223 3.998 0.225 18769 3106 1 33 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.454 1.361 18769 3107 1 33 . 1 1 18 18 TRP CB C 18 29.900 29.900 29.229 0.671 18769 3108 1 33 . 1 1 18 18 TRP H H 18 8.456 8.456 8.686 -0.230 18769 3109 1 33 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.453 -0.122 18769 3110 1 33 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.615 0.645 18769 3111 1 33 . 1 1 19 19 ASN CB C 19 40.029 40.029 39.072 0.957 18769 3112 1 33 . 1 1 19 19 ASN H H 19 7.768 7.768 7.783 -0.015 18769 3113 1 33 . 1 1 20 20 VAL HA H 20 3.728 3.728 3.864 -0.136 18769 3114 1 33 . 1 1 20 20 VAL CA C 20 65.593 65.593 65.233 0.360 18769 3115 1 33 . 1 1 20 20 VAL CB C 20 32.363 32.363 31.419 0.944 18769 3116 1 33 . 1 1 20 20 VAL H H 20 7.983 7.983 7.901 0.082 18769 3117 1 33 . 1 1 21 21 THR HA H 21 3.886 3.886 3.855 0.031 18769 3118 1 33 . 1 1 21 21 THR CA C 21 65.003 65.003 65.824 -0.821 18769 3119 1 33 . 1 1 21 21 THR CB C 21 69.837 69.837 68.543 1.294 18769 3120 1 33 . 1 1 21 21 THR H H 21 7.523 7.523 7.900 -0.377 18769 3121 1 33 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.139 0.172 18769 3122 1 33 . 1 1 22 22 LEU CA C 22 56.094 56.094 56.072 0.022 18769 3123 1 33 . 1 1 22 22 LEU CB C 22 42.641 42.641 42.490 0.151 18769 3124 1 33 . 1 1 22 22 LEU H H 22 7.598 7.598 7.457 0.141 18769 3125 1 33 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.047 0.323 18769 3126 1 33 . 1 1 23 23 ARG CA C 23 56.977 56.977 56.048 0.929 18769 3127 1 33 . 1 1 23 23 ARG CB C 23 30.139 30.139 28.799 1.340 18769 3128 1 33 . 1 1 23 23 ARG H H 23 7.480 7.480 7.543 -0.063 18769 3129 1 33 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.571 -0.180 18769 3130 1 33 . 1 1 24 24 PRO CA C 24 65.036 65.036 63.447 1.589 18769 3131 1 33 . 1 1 24 24 PRO CB C 24 32.233 32.233 30.498 1.735 18769 3132 1 33 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.314 0.038 18769 3133 1 33 . 1 1 25 25 GLU CA C 25 57.150 57.150 57.087 0.063 18769 3134 1 33 . 1 1 25 25 GLU CB C 25 29.234 29.234 31.196 -1.962 18769 3135 1 33 . 1 1 25 25 GLU H H 25 8.002 8.002 8.671 -0.669 18769 3136 1 34 . 1 1 2 2 SER HA H 2 4.611 4.611 4.539 0.072 18769 3137 1 34 . 1 1 2 2 SER CA C 2 58.466 58.466 59.764 -1.298 18769 3138 1 34 . 1 1 2 2 SER CB C 2 65.003 65.003 63.866 1.137 18769 3139 1 34 . 1 1 2 2 SER H H 2 8.606 8.606 8.852 -0.246 18769 3140 1 34 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.104 0.250 18769 3141 1 34 . 1 1 3 3 ALA CA C 3 54.477 54.477 53.599 0.878 18769 3142 1 34 . 1 1 3 3 ALA CB C 3 19.356 19.356 18.034 1.322 18769 3143 1 34 . 1 1 3 3 ALA H H 3 8.654 8.654 8.135 0.519 18769 3144 1 34 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.661 -0.391 18769 3145 1 34 . 1 1 4 4 LEU CA C 4 57.815 57.815 55.091 2.724 18769 3146 1 34 . 1 1 4 4 LEU CB C 4 43.003 43.003 42.899 0.104 18769 3147 1 34 . 1 1 4 4 LEU H H 4 7.954 7.954 7.929 0.025 18769 3148 1 34 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.303 -0.424 18769 3149 1 34 . 1 1 5 5 VAL CA C 5 65.477 65.477 65.244 0.233 18769 3150 1 34 . 1 1 5 5 VAL CB C 5 33.015 33.015 32.194 0.821 18769 3151 1 34 . 1 1 5 5 VAL H H 5 7.494 7.494 7.957 -0.463 18769 3152 1 34 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.643 -0.009 18769 3153 1 34 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.377 -0.291 18769 3154 1 34 . 1 1 6 6 ASN CB C 6 39.008 39.008 37.809 1.199 18769 3155 1 34 . 1 1 6 6 ASN H H 6 7.994 7.994 8.676 -0.682 18769 3156 1 34 . 1 1 7 7 SER HA H 7 4.429 4.429 4.342 0.087 18769 3157 1 34 . 1 1 7 7 SER CA C 7 62.214 62.214 61.649 0.565 18769 3158 1 34 . 1 1 7 7 SER CB C 7 64.026 64.026 62.775 1.251 18769 3159 1 34 . 1 1 7 7 SER H H 7 8.222 8.222 8.632 -0.410 18769 3160 1 34 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.379 0.051 18769 3161 1 34 . 1 1 8 8 TYR CA C 8 61.958 61.958 60.276 1.682 18769 3162 1 34 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.391 0.549 18769 3163 1 34 . 1 1 8 8 TYR H H 8 8.191 8.191 7.756 0.435 18769 3164 1 34 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.565 0.493 18769 3165 1 34 . 1 1 9 9 LEU CA C 9 58.791 58.791 58.269 0.522 18769 3166 1 34 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.193 1.335 18769 3167 1 34 . 1 1 9 9 LEU H H 9 8.306 8.306 8.340 -0.034 18769 3168 1 34 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.334 0.276 18769 3169 1 34 . 1 1 10 10 TRP CA C 10 61.451 61.451 61.429 0.022 18769 3170 1 34 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.331 0.712 18769 3171 1 34 . 1 1 10 10 TRP H H 10 8.281 8.281 8.908 -0.627 18769 3172 1 34 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.069 0.930 18769 3173 1 34 . 1 1 11 11 GLN CA C 11 60.083 60.083 58.836 1.247 18769 3174 1 34 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.062 1.368 18769 3175 1 34 . 1 1 11 11 GLN H H 11 8.275 8.275 8.559 -0.284 18769 3176 1 34 . 1 1 12 12 ARG HA H 12 4.072 4.072 4.073 -0.001 18769 3177 1 34 . 1 1 12 12 ARG CA C 12 59.855 59.855 58.917 0.938 18769 3178 1 34 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.755 0.533 18769 3179 1 34 . 1 1 12 12 ARG H H 12 8.158 8.158 7.629 0.529 18769 3180 1 34 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.318 0.095 18769 3181 1 34 . 1 1 13 13 TRP CA C 13 62.193 62.193 60.117 2.076 18769 3182 1 34 . 1 1 13 13 TRP CB C 13 29.421 29.421 28.971 0.450 18769 3183 1 34 . 1 1 13 13 TRP H H 13 8.425 8.425 7.781 0.644 18769 3184 1 34 . 1 1 14 14 GLU HA H 14 3.698 3.698 2.495 1.203 18769 3185 1 34 . 1 1 14 14 GLU CA C 14 59.978 59.978 58.281 1.697 18769 3186 1 34 . 1 1 14 14 GLU CB C 14 28.680 28.680 28.698 -0.018 18769 3187 1 34 . 1 1 14 14 GLU H H 14 8.774 8.774 7.089 1.685 18769 3188 1 34 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.398 0.097 18769 3189 1 34 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.447 1.119 18769 3190 1 34 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.610 1.418 18769 3191 1 34 . 1 1 15 15 ASN H H 15 8.059 8.059 7.985 0.074 18769 3192 1 34 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.269 -0.031 18769 3193 1 34 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.830 1.415 18769 3194 1 34 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.318 -0.127 18769 3195 1 34 . 1 1 16 16 TRP H H 16 8.071 8.071 7.926 0.145 18769 3196 1 34 . 1 1 17 17 PHE HA H 17 3.446 3.446 2.866 0.580 18769 3197 1 34 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.644 0.382 18769 3198 1 34 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.333 1.272 18769 3199 1 34 . 1 1 17 17 PHE H H 17 8.768 8.768 7.535 1.233 18769 3200 1 34 . 1 1 18 18 TRP HA H 18 4.223 4.223 4.437 -0.214 18769 3201 1 34 . 1 1 18 18 TRP CA C 18 60.815 60.815 57.827 2.988 18769 3202 1 34 . 1 1 18 18 TRP CB C 18 29.900 29.900 29.494 0.406 18769 3203 1 34 . 1 1 18 18 TRP H H 18 8.456 8.456 8.525 -0.069 18769 3204 1 34 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.456 -0.125 18769 3205 1 34 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.554 0.706 18769 3206 1 34 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.852 1.177 18769 3207 1 34 . 1 1 19 19 ASN H H 19 7.768 7.768 8.037 -0.269 18769 3208 1 34 . 1 1 20 20 VAL HA H 20 3.728 3.728 3.911 -0.183 18769 3209 1 34 . 1 1 20 20 VAL CA C 20 65.593 65.593 65.283 0.310 18769 3210 1 34 . 1 1 20 20 VAL CB C 20 32.363 32.363 31.194 1.169 18769 3211 1 34 . 1 1 20 20 VAL H H 20 7.983 7.983 7.628 0.355 18769 3212 1 34 . 1 1 21 21 THR HA H 21 3.886 3.886 4.145 -0.259 18769 3213 1 34 . 1 1 21 21 THR CA C 21 65.003 65.003 64.533 0.470 18769 3214 1 34 . 1 1 21 21 THR CB C 21 69.837 69.837 69.319 0.518 18769 3215 1 34 . 1 1 21 21 THR H H 21 7.523 7.523 7.210 0.313 18769 3216 1 34 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.223 0.088 18769 3217 1 34 . 1 1 22 22 LEU CA C 22 56.094 56.094 55.706 0.388 18769 3218 1 34 . 1 1 22 22 LEU CB C 22 42.641 42.641 42.549 0.092 18769 3219 1 34 . 1 1 22 22 LEU H H 22 7.598 7.598 7.913 -0.315 18769 3220 1 34 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.206 0.164 18769 3221 1 34 . 1 1 23 23 ARG CA C 23 56.977 56.977 55.865 1.112 18769 3222 1 34 . 1 1 23 23 ARG CB C 23 30.139 30.139 28.821 1.318 18769 3223 1 34 . 1 1 23 23 ARG H H 23 7.480 7.480 7.574 -0.094 18769 3224 1 34 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.631 -0.240 18769 3225 1 34 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.769 2.267 18769 3226 1 34 . 1 1 24 24 PRO CB C 24 32.233 32.233 32.897 -0.663 18769 3227 1 34 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.340 0.012 18769 3228 1 34 . 1 1 25 25 GLU CA C 25 57.150 57.150 56.838 0.312 18769 3229 1 34 . 1 1 25 25 GLU CB C 25 29.234 29.234 29.967 -0.733 18769 3230 1 34 . 1 1 25 25 GLU H H 25 8.002 8.002 8.680 -0.678 18769 3231 1 35 . 1 1 2 2 SER HA H 2 4.611 4.611 4.701 -0.090 18769 3232 1 35 . 1 1 2 2 SER CA C 2 58.466 58.466 58.128 0.338 18769 3233 1 35 . 1 1 2 2 SER CB C 2 65.003 65.003 64.284 0.719 18769 3234 1 35 . 1 1 2 2 SER H H 2 8.606 8.606 8.508 0.098 18769 3235 1 35 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.432 -0.078 18769 3236 1 35 . 1 1 3 3 ALA CA C 3 54.477 54.477 53.023 1.454 18769 3237 1 35 . 1 1 3 3 ALA CB C 3 19.356 19.356 19.206 0.150 18769 3238 1 35 . 1 1 3 3 ALA H H 3 8.654 8.654 8.670 -0.016 18769 3239 1 35 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.590 -0.320 18769 3240 1 35 . 1 1 4 4 LEU CA C 4 57.815 57.815 55.824 1.991 18769 3241 1 35 . 1 1 4 4 LEU CB C 4 43.003 43.003 42.769 0.234 18769 3242 1 35 . 1 1 4 4 LEU H H 4 7.954 7.954 8.084 -0.130 18769 3243 1 35 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.196 -0.317 18769 3244 1 35 . 1 1 5 5 VAL CA C 5 65.477 65.477 64.537 0.940 18769 3245 1 35 . 1 1 5 5 VAL CB C 5 33.015 33.015 33.198 -0.183 18769 3246 1 35 . 1 1 5 5 VAL H H 5 7.494 7.494 7.847 -0.353 18769 3247 1 35 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.663 -0.029 18769 3248 1 35 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.602 -0.516 18769 3249 1 35 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.482 0.526 18769 3250 1 35 . 1 1 6 6 ASN H H 6 7.994 7.994 8.527 -0.533 18769 3251 1 35 . 1 1 7 7 SER HA H 7 4.429 4.429 4.465 -0.036 18769 3252 1 35 . 1 1 7 7 SER CA C 7 62.214 62.214 62.406 -0.192 18769 3253 1 35 . 1 1 7 7 SER CB C 7 64.026 64.026 63.244 0.782 18769 3254 1 35 . 1 1 7 7 SER H H 7 8.222 8.222 8.492 -0.270 18769 3255 1 35 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.348 0.082 18769 3256 1 35 . 1 1 8 8 TYR CA C 8 61.958 61.958 61.143 0.815 18769 3257 1 35 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.264 0.676 18769 3258 1 35 . 1 1 8 8 TYR H H 8 8.191 8.191 8.351 -0.160 18769 3259 1 35 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.717 0.341 18769 3260 1 35 . 1 1 9 9 LEU CA C 9 58.791 58.791 57.662 1.129 18769 3261 1 35 . 1 1 9 9 LEU CB C 9 42.528 42.528 40.988 1.540 18769 3262 1 35 . 1 1 9 9 LEU H H 9 8.306 8.306 7.900 0.406 18769 3263 1 35 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.473 0.137 18769 3264 1 35 . 1 1 10 10 TRP CA C 10 61.451 61.451 60.770 0.681 18769 3265 1 35 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.548 0.495 18769 3266 1 35 . 1 1 10 10 TRP H H 10 8.281 8.281 8.841 -0.560 18769 3267 1 35 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.299 0.700 18769 3268 1 35 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.733 0.350 18769 3269 1 35 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.255 1.175 18769 3270 1 35 . 1 1 11 11 GLN H H 11 8.275 8.275 8.600 -0.325 18769 3271 1 35 . 1 1 12 12 ARG HA H 12 4.072 4.072 3.993 0.079 18769 3272 1 35 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.597 0.258 18769 3273 1 35 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.804 0.484 18769 3274 1 35 . 1 1 12 12 ARG H H 12 8.158 8.158 7.483 0.675 18769 3275 1 35 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.265 0.148 18769 3276 1 35 . 1 1 13 13 TRP CA C 13 62.193 62.193 59.701 2.492 18769 3277 1 35 . 1 1 13 13 TRP CB C 13 29.421 29.421 29.686 -0.266 18769 3278 1 35 . 1 1 13 13 TRP H H 13 8.425 8.425 7.445 0.980 18769 3279 1 35 . 1 1 14 14 GLU HA H 14 3.698 3.698 4.016 -0.318 18769 3280 1 35 . 1 1 14 14 GLU CA C 14 59.978 59.978 59.774 0.204 18769 3281 1 35 . 1 1 14 14 GLU CB C 14 28.680 28.680 29.516 -0.836 18769 3282 1 35 . 1 1 14 14 GLU H H 14 8.774 8.774 7.845 0.929 18769 3283 1 35 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.514 -0.019 18769 3284 1 35 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.620 0.946 18769 3285 1 35 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.836 1.192 18769 3286 1 35 . 1 1 15 15 ASN H H 15 8.059 8.059 8.866 -0.807 18769 3287 1 35 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.364 -0.126 18769 3288 1 35 . 1 1 16 16 TRP CA C 16 62.245 62.245 61.042 1.203 18769 3289 1 35 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.444 -0.253 18769 3290 1 35 . 1 1 16 16 TRP H H 16 8.071 8.071 8.217 -0.146 18769 3291 1 35 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.149 0.297 18769 3292 1 35 . 1 1 17 17 PHE CA C 17 62.026 62.026 60.837 1.189 18769 3293 1 35 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.316 1.290 18769 3294 1 35 . 1 1 17 17 PHE H H 17 8.768 8.768 8.008 0.760 18769 3295 1 35 . 1 1 18 18 TRP HA H 18 4.223 4.223 3.678 0.545 18769 3296 1 35 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.781 1.034 18769 3297 1 35 . 1 1 18 18 TRP CB C 18 29.900 29.900 29.040 0.860 18769 3298 1 35 . 1 1 18 18 TRP H H 18 8.456 8.456 8.648 -0.192 18769 3299 1 35 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.513 -0.182 18769 3300 1 35 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.036 1.224 18769 3301 1 35 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.437 1.593 18769 3302 1 35 . 1 1 19 19 ASN H H 19 7.768 7.768 8.210 -0.442 18769 3303 1 35 . 1 1 20 20 VAL HA H 20 3.728 3.728 4.056 -0.328 18769 3304 1 35 . 1 1 20 20 VAL CA C 20 65.593 65.593 63.273 2.320 18769 3305 1 35 . 1 1 20 20 VAL CB C 20 32.363 32.363 32.385 -0.022 18769 3306 1 35 . 1 1 20 20 VAL H H 20 7.983 7.983 7.914 0.069 18769 3307 1 35 . 1 1 21 21 THR HA H 21 3.886 3.886 4.147 -0.261 18769 3308 1 35 . 1 1 21 21 THR CA C 21 65.003 65.003 64.126 0.877 18769 3309 1 35 . 1 1 21 21 THR CB C 21 69.837 69.837 69.146 0.691 18769 3310 1 35 . 1 1 21 21 THR H H 21 7.523 7.523 7.470 0.053 18769 3311 1 35 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.128 0.183 18769 3312 1 35 . 1 1 22 22 LEU CA C 22 56.094 56.094 57.387 -1.293 18769 3313 1 35 . 1 1 22 22 LEU CB C 22 42.641 42.641 41.836 0.805 18769 3314 1 35 . 1 1 22 22 LEU H H 22 7.598 7.598 7.986 -0.388 18769 3315 1 35 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.182 0.188 18769 3316 1 35 . 1 1 23 23 ARG CA C 23 56.977 56.977 58.706 -1.729 18769 3317 1 35 . 1 1 23 23 ARG CB C 23 30.139 30.139 28.396 1.743 18769 3318 1 35 . 1 1 23 23 ARG H H 23 7.480 7.480 8.402 -0.922 18769 3319 1 35 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.485 -0.094 18769 3320 1 35 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.539 2.497 18769 3321 1 35 . 1 1 24 24 PRO CB C 24 32.233 32.233 31.880 0.354 18769 3322 1 35 . 1 1 25 25 GLU HA H 25 4.352 4.352 3.985 0.367 18769 3323 1 35 . 1 1 25 25 GLU CA C 25 57.150 57.150 57.725 -0.575 18769 3324 1 35 . 1 1 25 25 GLU CB C 25 29.234 29.234 29.790 -0.556 18769 3325 1 35 . 1 1 25 25 GLU H H 25 8.002 8.002 8.565 -0.563 18769 3326 1 36 . 1 1 2 2 SER HA H 2 4.611 4.611 4.631 -0.020 18769 3327 1 36 . 1 1 2 2 SER CA C 2 58.466 58.466 58.017 0.449 18769 3328 1 36 . 1 1 2 2 SER CB C 2 65.003 65.003 64.502 0.501 18769 3329 1 36 . 1 1 2 2 SER H H 2 8.606 8.606 8.453 0.153 18769 3330 1 36 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.296 0.058 18769 3331 1 36 . 1 1 3 3 ALA CA C 3 54.477 54.477 54.728 -0.251 18769 3332 1 36 . 1 1 3 3 ALA CB C 3 19.356 19.356 18.756 0.600 18769 3333 1 36 . 1 1 3 3 ALA H H 3 8.654 8.654 8.486 0.168 18769 3334 1 36 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.492 -0.222 18769 3335 1 36 . 1 1 4 4 LEU CA C 4 57.815 57.815 55.214 2.601 18769 3336 1 36 . 1 1 4 4 LEU CB C 4 43.003 43.003 42.265 0.738 18769 3337 1 36 . 1 1 4 4 LEU H H 4 7.954 7.954 8.025 -0.071 18769 3338 1 36 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.104 -0.225 18769 3339 1 36 . 1 1 5 5 VAL CA C 5 65.477 65.477 64.597 0.880 18769 3340 1 36 . 1 1 5 5 VAL CB C 5 33.015 33.015 32.847 0.168 18769 3341 1 36 . 1 1 5 5 VAL H H 5 7.494 7.494 7.191 0.303 18769 3342 1 36 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.682 -0.048 18769 3343 1 36 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.017 0.069 18769 3344 1 36 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.782 0.226 18769 3345 1 36 . 1 1 6 6 ASN H H 6 7.994 7.994 8.022 -0.028 18769 3346 1 36 . 1 1 7 7 SER HA H 7 4.429 4.429 4.301 0.128 18769 3347 1 36 . 1 1 7 7 SER CA C 7 62.214 62.214 62.677 -0.463 18769 3348 1 36 . 1 1 7 7 SER CB C 7 64.026 64.026 63.220 0.806 18769 3349 1 36 . 1 1 7 7 SER H H 7 8.222 8.222 8.296 -0.074 18769 3350 1 36 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.404 0.026 18769 3351 1 36 . 1 1 8 8 TYR CA C 8 61.958 61.958 60.600 1.358 18769 3352 1 36 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.395 0.545 18769 3353 1 36 . 1 1 8 8 TYR H H 8 8.191 8.191 8.128 0.063 18769 3354 1 36 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.609 0.449 18769 3355 1 36 . 1 1 9 9 LEU CA C 9 58.791 58.791 57.709 1.083 18769 3356 1 36 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.666 0.862 18769 3357 1 36 . 1 1 9 9 LEU H H 9 8.306 8.306 7.565 0.741 18769 3358 1 36 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.377 0.233 18769 3359 1 36 . 1 1 10 10 TRP CA C 10 61.451 61.451 61.487 -0.036 18769 3360 1 36 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.341 0.702 18769 3361 1 36 . 1 1 10 10 TRP H H 10 8.281 8.281 8.530 -0.249 18769 3362 1 36 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.282 0.717 18769 3363 1 36 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.095 0.988 18769 3364 1 36 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.247 1.183 18769 3365 1 36 . 1 1 11 11 GLN H H 11 8.275 8.275 8.011 0.264 18769 3366 1 36 . 1 1 12 12 ARG HA H 12 4.072 4.072 4.071 0.001 18769 3367 1 36 . 1 1 12 12 ARG CA C 12 59.855 59.855 58.867 0.987 18769 3368 1 36 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.919 0.369 18769 3369 1 36 . 1 1 12 12 ARG H H 12 8.158 8.158 7.895 0.263 18769 3370 1 36 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.353 0.060 18769 3371 1 36 . 1 1 13 13 TRP CA C 13 62.193 62.193 60.282 1.911 18769 3372 1 36 . 1 1 13 13 TRP CB C 13 29.421 29.421 28.941 0.480 18769 3373 1 36 . 1 1 13 13 TRP H H 13 8.425 8.425 7.857 0.568 18769 3374 1 36 . 1 1 14 14 GLU HA H 14 3.698 3.698 2.739 0.959 18769 3375 1 36 . 1 1 14 14 GLU CA C 14 59.978 59.978 58.975 1.003 18769 3376 1 36 . 1 1 14 14 GLU CB C 14 28.680 28.680 28.953 -0.273 18769 3377 1 36 . 1 1 14 14 GLU H H 14 8.774 8.774 7.164 1.610 18769 3378 1 36 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.438 0.057 18769 3379 1 36 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.321 1.245 18769 3380 1 36 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.752 1.276 18769 3381 1 36 . 1 1 15 15 ASN H H 15 8.059 8.059 8.375 -0.316 18769 3382 1 36 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.260 -0.022 18769 3383 1 36 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.993 1.252 18769 3384 1 36 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.246 -0.055 18769 3385 1 36 . 1 1 16 16 TRP H H 16 8.071 8.071 8.376 -0.305 18769 3386 1 36 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.088 0.358 18769 3387 1 36 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.297 0.729 18769 3388 1 36 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.387 1.218 18769 3389 1 36 . 1 1 17 17 PHE H H 17 8.768 8.768 7.730 1.038 18769 3390 1 36 . 1 1 18 18 TRP HA H 18 4.223 4.223 4.172 0.051 18769 3391 1 36 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.228 1.587 18769 3392 1 36 . 1 1 18 18 TRP CB C 18 29.900 29.900 28.871 1.029 18769 3393 1 36 . 1 1 18 18 TRP H H 18 8.456 8.456 8.517 -0.061 18769 3394 1 36 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.715 -0.384 18769 3395 1 36 . 1 1 19 19 ASN CA C 19 57.260 57.260 55.330 1.930 18769 3396 1 36 . 1 1 19 19 ASN CB C 19 40.029 40.029 39.119 0.910 18769 3397 1 36 . 1 1 19 19 ASN H H 19 7.768 7.768 7.428 0.340 18769 3398 1 36 . 1 1 20 20 VAL HA H 20 3.728 3.728 4.279 -0.551 18769 3399 1 36 . 1 1 20 20 VAL CA C 20 65.593 65.593 62.378 3.215 18769 3400 1 36 . 1 1 20 20 VAL CB C 20 32.363 32.363 31.122 1.241 18769 3401 1 36 . 1 1 20 20 VAL H H 20 7.983 7.983 7.571 0.412 18769 3402 1 36 . 1 1 21 21 THR HA H 21 3.886 3.886 4.137 -0.251 18769 3403 1 36 . 1 1 21 21 THR CA C 21 65.003 65.003 64.240 0.763 18769 3404 1 36 . 1 1 21 21 THR CB C 21 69.837 69.837 68.868 0.969 18769 3405 1 36 . 1 1 21 21 THR H H 21 7.523 7.523 7.610 -0.087 18769 3406 1 36 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.314 -0.003 18769 3407 1 36 . 1 1 22 22 LEU CA C 22 56.094 56.094 56.481 -0.387 18769 3408 1 36 . 1 1 22 22 LEU CB C 22 42.641 42.641 42.994 -0.353 18769 3409 1 36 . 1 1 22 22 LEU H H 22 7.598 7.598 7.616 -0.018 18769 3410 1 36 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.665 -0.295 18769 3411 1 36 . 1 1 23 23 ARG CA C 23 56.977 56.977 53.858 3.119 18769 3412 1 36 . 1 1 23 23 ARG CB C 23 30.139 30.139 30.495 -0.356 18769 3413 1 36 . 1 1 23 23 ARG H H 23 7.480 7.480 7.991 -0.511 18769 3414 1 36 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.463 -0.072 18769 3415 1 36 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.495 2.541 18769 3416 1 36 . 1 1 24 24 PRO CB C 24 32.233 32.233 30.159 2.075 18769 3417 1 36 . 1 1 25 25 GLU HA H 25 4.352 4.352 3.950 0.402 18769 3418 1 36 . 1 1 25 25 GLU CA C 25 57.150 57.150 57.399 -0.249 18769 3419 1 36 . 1 1 25 25 GLU CB C 25 29.234 29.234 28.947 0.287 18769 3420 1 36 . 1 1 25 25 GLU H H 25 8.002 8.002 8.096 -0.094 18769 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 0 0.000 0.000 0.000 18769 2 1 1 "Average Difference" HA 24 0.362 -0.126 0.346 18769 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18769 4 1 1 "Average Difference" CA 24 1.043 -0.770 0.718 18769 5 1 1 "Average Difference" CB 24 1.084 -0.731 0.818 18769 6 1 1 "Average Difference" HN 23 0.487 -0.083 0.491 18769 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 18769 8 1 2 "Average Difference" HA 24 0.298 -0.059 0.298 18769 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18769 10 1 2 "Average Difference" CA 24 1.541 -1.084 1.119 18769 11 1 2 "Average Difference" CB 24 0.885 -0.435 0.786 18769 12 1 2 "Average Difference" HN 23 0.470 -0.126 0.463 18769 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 18769 14 1 3 "Average Difference" HA 24 0.279 -0.064 0.278 18769 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18769 16 1 3 "Average Difference" CA 24 1.315 -0.593 1.199 18769 17 1 3 "Average Difference" CB 24 1.191 -0.774 0.924 18769 18 1 3 "Average Difference" HN 23 0.527 -0.043 0.537 18769 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 18769 20 1 4 "Average Difference" HA 24 0.275 -0.002 0.281 18769 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18769 22 1 4 "Average Difference" CA 24 1.235 -0.834 0.930 18769 23 1 4 "Average Difference" CB 24 0.873 -0.456 0.760 18769 24 1 4 "Average Difference" HN 23 0.427 0.008 0.436 18769 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 18769 26 1 5 "Average Difference" HA 24 0.266 -0.066 0.264 18769 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18769 28 1 5 "Average Difference" CA 24 1.254 -0.808 0.980 18769 29 1 5 "Average Difference" CB 24 0.914 -0.551 0.744 18769 30 1 5 "Average Difference" HN 23 0.488 -0.085 0.491 18769 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 18769 32 1 6 "Average Difference" HA 24 0.353 -0.078 0.352 18769 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18769 34 1 6 "Average Difference" CA 24 1.155 -0.923 0.709 18769 35 1 6 "Average Difference" CB 24 0.839 -0.600 0.598 18769 36 1 6 "Average Difference" HN 23 0.469 -0.030 0.478 18769 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 18769 38 1 7 "Average Difference" HA 24 0.239 -0.084 0.229 18769 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18769 40 1 7 "Average Difference" CA 24 1.077 -0.677 0.856 18769 41 1 7 "Average Difference" CB 24 1.127 -0.755 0.855 18769 42 1 7 "Average Difference" HN 23 0.488 -0.096 0.489 18769 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 18769 44 1 8 "Average Difference" HA 24 0.367 -0.071 0.368 18769 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18769 46 1 8 "Average Difference" CA 24 1.585 -1.088 1.178 18769 47 1 8 "Average Difference" CB 24 0.990 -0.486 0.881 18769 48 1 8 "Average Difference" HN 23 0.535 -0.114 0.535 18769 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 18769 50 1 9 "Average Difference" HA 24 0.365 -0.084 0.363 18769 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18769 52 1 9 "Average Difference" CA 24 1.261 -0.840 0.960 18769 53 1 9 "Average Difference" CB 24 0.867 -0.639 0.599 18769 54 1 9 "Average Difference" HN 23 0.569 -0.073 0.577 18769 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 18769 56 1 10 "Average Difference" HA 24 0.242 -0.015 0.247 18769 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18769 58 1 10 "Average Difference" CA 24 1.497 -1.018 1.121 18769 59 1 10 "Average Difference" CB 24 0.877 -0.566 0.684 18769 60 1 10 "Average Difference" HN 23 0.476 -0.064 0.483 18769 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 18769 62 1 11 "Average Difference" HA 24 0.274 -0.048 0.276 18769 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 18769 64 1 11 "Average Difference" CA 24 1.306 -1.037 0.812 18769 65 1 11 "Average Difference" CB 24 0.865 -0.536 0.694 18769 66 1 11 "Average Difference" HN 23 0.468 -0.126 0.461 18769 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 18769 68 1 12 "Average Difference" HA 24 0.235 -0.031 0.238 18769 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 18769 70 1 12 "Average Difference" CA 24 1.154 -0.823 0.826 18769 71 1 12 "Average Difference" CB 24 0.805 -0.468 0.670 18769 72 1 12 "Average Difference" HN 23 0.451 -0.017 0.461 18769 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 18769 74 1 13 "Average Difference" HA 24 0.257 -0.033 0.260 18769 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 18769 76 1 13 "Average Difference" CA 24 1.462 -0.915 1.164 18769 77 1 13 "Average Difference" CB 24 0.919 -0.378 0.856 18769 78 1 13 "Average Difference" HN 23 0.534 -0.057 0.543 18769 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 18769 80 1 14 "Average Difference" HA 24 0.239 0.004 0.244 18769 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 18769 82 1 14 "Average Difference" CA 24 1.192 -0.821 0.883 18769 83 1 14 "Average Difference" CB 24 1.103 -0.462 1.023 18769 84 1 14 "Average Difference" HN 23 0.547 0.018 0.559 18769 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 18769 86 1 15 "Average Difference" HA 24 0.271 -0.074 0.266 18769 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 18769 88 1 15 "Average Difference" CA 24 1.211 -0.971 0.739 18769 89 1 15 "Average Difference" CB 24 0.784 -0.563 0.557 18769 90 1 15 "Average Difference" HN 23 0.534 -0.124 0.531 18769 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 18769 92 1 16 "Average Difference" HA 24 0.204 -0.070 0.196 18769 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 18769 94 1 16 "Average Difference" CA 24 1.040 -0.713 0.774 18769 95 1 16 "Average Difference" CB 24 1.034 -0.498 0.925 18769 96 1 16 "Average Difference" HN 23 0.474 -0.084 0.477 18769 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 18769 98 1 17 "Average Difference" HA 24 0.397 -0.084 0.397 18769 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 18769 100 1 17 "Average Difference" CA 24 1.211 -0.904 0.823 18769 101 1 17 "Average Difference" CB 24 0.930 -0.628 0.700 18769 102 1 17 "Average Difference" HN 23 0.551 -0.091 0.556 18769 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 18769 104 1 18 "Average Difference" HA 24 0.358 -0.131 0.340 18769 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 18769 106 1 18 "Average Difference" CA 24 1.397 -0.746 1.207 18769 107 1 18 "Average Difference" CB 24 1.085 -0.762 0.788 18769 108 1 18 "Average Difference" HN 23 0.503 -0.125 0.498 18769 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 18769 110 1 19 "Average Difference" HA 24 0.377 -0.134 0.360 18769 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 18769 112 1 19 "Average Difference" CA 24 1.306 -0.653 1.155 18769 113 1 19 "Average Difference" CB 24 1.081 -0.826 0.712 18769 114 1 19 "Average Difference" HN 23 0.543 -0.059 0.552 18769 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 18769 116 1 20 "Average Difference" HA 24 0.334 -0.093 0.328 18769 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 18769 118 1 20 "Average Difference" CA 24 1.282 -0.815 1.010 18769 119 1 20 "Average Difference" CB 24 1.302 -0.689 1.128 18769 120 1 20 "Average Difference" HN 23 0.453 -0.101 0.451 18769 121 1 21 "Average Difference" N 0 0.000 0.000 0.000 18769 122 1 21 "Average Difference" HA 24 0.353 -0.015 0.360 18769 123 1 21 "Average Difference" C 0 0.000 0.000 0.000 18769 124 1 21 "Average Difference" CA 24 1.629 -1.230 1.092 18769 125 1 21 "Average Difference" CB 24 1.023 -0.300 0.999 18769 126 1 21 "Average Difference" HN 23 0.500 -0.101 0.501 18769 127 1 22 "Average Difference" N 0 0.000 0.000 0.000 18769 128 1 22 "Average Difference" HA 24 0.255 -0.006 0.260 18769 129 1 22 "Average Difference" C 0 0.000 0.000 0.000 18769 130 1 22 "Average Difference" CA 24 1.492 -1.062 1.070 18769 131 1 22 "Average Difference" CB 24 0.925 -0.519 0.782 18769 132 1 22 "Average Difference" HN 23 0.537 -0.105 0.538 18769 133 1 23 "Average Difference" N 0 0.000 0.000 0.000 18769 134 1 23 "Average Difference" HA 24 0.330 -0.078 0.328 18769 135 1 23 "Average Difference" C 0 0.000 0.000 0.000 18769 136 1 23 "Average Difference" CA 24 1.362 -0.846 1.090 18769 137 1 23 "Average Difference" CB 24 0.900 -0.527 0.745 18769 138 1 23 "Average Difference" HN 23 0.521 -0.011 0.533 18769 139 1 24 "Average Difference" N 0 0.000 0.000 0.000 18769 140 1 24 "Average Difference" HA 24 0.416 -0.112 0.409 18769 141 1 24 "Average Difference" C 0 0.000 0.000 0.000 18769 142 1 24 "Average Difference" CA 24 1.310 -1.009 0.854 18769 143 1 24 "Average Difference" CB 24 0.924 -0.711 0.602 18769 144 1 24 "Average Difference" HN 23 0.574 -0.193 0.552 18769 145 1 25 "Average Difference" N 0 0.000 0.000 0.000 18769 146 1 25 "Average Difference" HA 24 0.246 -0.034 0.249 18769 147 1 25 "Average Difference" C 0 0.000 0.000 0.000 18769 148 1 25 "Average Difference" CA 24 1.290 -0.817 1.020 18769 149 1 25 "Average Difference" CB 24 1.001 -0.419 0.929 18769 150 1 25 "Average Difference" HN 23 0.443 -0.000 0.453 18769 151 1 26 "Average Difference" N 0 0.000 0.000 0.000 18769 152 1 26 "Average Difference" HA 24 0.333 -0.116 0.319 18769 153 1 26 "Average Difference" C 0 0.000 0.000 0.000 18769 154 1 26 "Average Difference" CA 24 1.295 -0.759 1.072 18769 155 1 26 "Average Difference" CB 24 1.026 -0.693 0.773 18769 156 1 26 "Average Difference" HN 23 0.563 -0.069 0.571 18769 157 1 27 "Average Difference" N 0 0.000 0.000 0.000 18769 158 1 27 "Average Difference" HA 24 0.330 -0.022 0.337 18769 159 1 27 "Average Difference" C 0 0.000 0.000 0.000 18769 160 1 27 "Average Difference" CA 24 1.351 -0.933 0.998 18769 161 1 27 "Average Difference" CB 24 0.960 -0.512 0.830 18769 162 1 27 "Average Difference" HN 23 0.462 -0.077 0.466 18769 163 1 28 "Average Difference" N 0 0.000 0.000 0.000 18769 164 1 28 "Average Difference" HA 24 0.218 0.027 0.221 18769 165 1 28 "Average Difference" C 0 0.000 0.000 0.000 18769 166 1 28 "Average Difference" CA 24 1.389 -0.916 1.068 18769 167 1 28 "Average Difference" CB 24 0.858 -0.363 0.795 18769 168 1 28 "Average Difference" HN 23 0.412 -0.114 0.404 18769 169 1 29 "Average Difference" N 0 0.000 0.000 0.000 18769 170 1 29 "Average Difference" HA 24 0.380 -0.128 0.365 18769 171 1 29 "Average Difference" C 0 0.000 0.000 0.000 18769 172 1 29 "Average Difference" CA 24 1.143 -0.781 0.853 18769 173 1 29 "Average Difference" CB 24 1.085 -0.681 0.863 18769 174 1 29 "Average Difference" HN 23 0.576 -0.173 0.562 18769 175 1 30 "Average Difference" N 0 0.000 0.000 0.000 18769 176 1 30 "Average Difference" HA 24 0.225 0.046 0.225 18769 177 1 30 "Average Difference" C 0 0.000 0.000 0.000 18769 178 1 30 "Average Difference" CA 24 1.533 -0.645 1.421 18769 179 1 30 "Average Difference" CB 24 1.145 -0.509 1.048 18769 180 1 30 "Average Difference" HN 23 0.552 0.055 0.561 18769 181 1 31 "Average Difference" N 0 0.000 0.000 0.000 18769 182 1 31 "Average Difference" HA 24 0.328 -0.152 0.297 18769 183 1 31 "Average Difference" C 0 0.000 0.000 0.000 18769 184 1 31 "Average Difference" CA 24 1.188 -0.840 0.859 18769 185 1 31 "Average Difference" CB 24 1.165 -0.740 0.919 18769 186 1 31 "Average Difference" HN 23 0.493 -0.113 0.491 18769 187 1 32 "Average Difference" N 0 0.000 0.000 0.000 18769 188 1 32 "Average Difference" HA 24 0.232 -0.053 0.230 18769 189 1 32 "Average Difference" C 0 0.000 0.000 0.000 18769 190 1 32 "Average Difference" CA 24 1.361 -0.755 1.157 18769 191 1 32 "Average Difference" CB 24 1.006 -0.650 0.784 18769 192 1 32 "Average Difference" HN 23 0.518 -0.068 0.525 18769 193 1 33 "Average Difference" N 0 0.000 0.000 0.000 18769 194 1 33 "Average Difference" HA 24 0.196 -0.033 0.197 18769 195 1 33 "Average Difference" C 0 0.000 0.000 0.000 18769 196 1 33 "Average Difference" CA 24 1.079 -0.706 0.833 18769 197 1 33 "Average Difference" CB 24 1.077 -0.687 0.848 18769 198 1 33 "Average Difference" HN 23 0.470 -0.055 0.477 18769 199 1 34 "Average Difference" N 0 0.000 0.000 0.000 18769 200 1 34 "Average Difference" HA 24 0.390 -0.105 0.384 18769 201 1 34 "Average Difference" C 0 0.000 0.000 0.000 18769 202 1 34 "Average Difference" CA 24 1.336 -0.936 0.974 18769 203 1 34 "Average Difference" CB 24 0.941 -0.692 0.651 18769 204 1 34 "Average Difference" HN 23 0.582 -0.078 0.590 18769 205 1 35 "Average Difference" N 0 0.000 0.000 0.000 18769 206 1 35 "Average Difference" HA 24 0.274 -0.036 0.278 18769 207 1 35 "Average Difference" C 0 0.000 0.000 0.000 18769 208 1 35 "Average Difference" CA 24 1.290 -0.735 1.083 18769 209 1 35 "Average Difference" CB 24 0.866 -0.550 0.683 18769 210 1 35 "Average Difference" HN 23 0.519 0.080 0.525 18769 211 1 36 "Average Difference" N 0 0.000 0.000 0.000 18769 212 1 36 "Average Difference" HA 24 0.337 -0.059 0.339 18769 213 1 36 "Average Difference" C 0 0.000 0.000 0.000 18769 214 1 36 "Average Difference" CA 24 1.512 -1.097 1.063 18769 215 1 36 "Average Difference" CB 24 0.851 -0.631 0.583 18769 216 1 36 "Average Difference" HN 23 0.496 -0.179 0.473 18769 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 18769 _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 SER HA H 2 4.611 4.611 4.682 -0.071 18769 2 1 . 1 1 2 2 SER CA C 2 58.466 58.466 58.153 0.313 18769 3 1 . 1 1 2 2 SER CB C 2 65.003 65.003 64.500 0.503 18769 4 1 . 1 1 2 2 SER H H 2 8.606 8.606 8.467 0.139 18769 5 1 . 1 1 3 3 ALA HA H 3 4.354 4.354 4.441 -0.087 18769 6 1 . 1 1 3 3 ALA CA C 3 54.477 54.477 53.579 0.898 18769 7 1 . 1 1 3 3 ALA CB C 3 19.356 19.356 18.959 0.397 18769 8 1 . 1 1 3 3 ALA H H 3 8.654 8.654 8.543 0.111 18769 9 1 . 1 1 4 4 LEU HA H 4 4.270 4.270 4.506 -0.236 18769 10 1 . 1 1 4 4 LEU CA C 4 57.815 57.815 55.885 1.930 18769 11 1 . 1 1 4 4 LEU CB C 4 43.003 43.003 42.106 0.897 18769 12 1 . 1 1 4 4 LEU H H 4 7.954 7.954 8.093 -0.139 18769 13 1 . 1 1 5 5 VAL HA H 5 3.879 3.879 4.096 -0.217 18769 14 1 . 1 1 5 5 VAL CA C 5 65.477 65.477 65.009 0.468 18769 15 1 . 1 1 5 5 VAL CB C 5 33.015 33.015 32.453 0.562 18769 16 1 . 1 1 5 5 VAL H H 5 7.494 7.494 7.808 -0.314 18769 17 1 . 1 1 6 6 ASN HA H 6 4.634 4.634 4.594 0.040 18769 18 1 . 1 1 6 6 ASN CA C 6 56.086 56.086 56.348 -0.262 18769 19 1 . 1 1 6 6 ASN CB C 6 39.008 39.008 38.440 0.568 18769 20 1 . 1 1 6 6 ASN H H 6 7.994 7.994 8.364 -0.370 18769 21 1 . 1 1 7 7 SER HA H 7 4.429 4.429 4.322 0.107 18769 22 1 . 1 1 7 7 SER CA C 7 62.214 62.214 62.224 -0.010 18769 23 1 . 1 1 7 7 SER CB C 7 64.026 64.026 63.192 0.834 18769 24 1 . 1 1 7 7 SER H H 7 8.222 8.222 8.160 0.062 18769 25 1 . 1 1 8 8 TYR HA H 8 4.430 4.430 4.421 0.009 18769 26 1 . 1 1 8 8 TYR CA C 8 61.958 61.958 60.705 1.253 18769 27 1 . 1 1 8 8 TYR CB C 8 38.940 38.940 38.470 0.470 18769 28 1 . 1 1 8 8 TYR H H 8 8.191 8.191 8.069 0.122 18769 29 1 . 1 1 9 9 LEU HA H 9 4.058 4.058 3.657 0.401 18769 30 1 . 1 1 9 9 LEU CA C 9 58.791 58.791 57.846 0.945 18769 31 1 . 1 1 9 9 LEU CB C 9 42.528 42.528 41.393 1.135 18769 32 1 . 1 1 9 9 LEU H H 9 8.306 8.306 7.976 0.330 18769 33 1 . 1 1 10 10 TRP HA H 10 4.610 4.610 4.389 0.221 18769 34 1 . 1 1 10 10 TRP CA C 10 61.451 61.451 60.967 0.484 18769 35 1 . 1 1 10 10 TRP CB C 10 30.043 30.043 29.515 0.528 18769 36 1 . 1 1 10 10 TRP H H 10 8.281 8.281 8.696 -0.415 18769 37 1 . 1 1 11 11 GLN HA H 11 3.999 3.999 3.372 0.627 18769 38 1 . 1 1 11 11 GLN CA C 11 60.083 60.083 59.310 0.773 18769 39 1 . 1 1 11 11 GLN CB C 11 29.430 29.430 28.253 1.176 18769 40 1 . 1 1 11 11 GLN H H 11 8.275 8.275 8.155 0.120 18769 41 1 . 1 1 12 12 ARG HA H 12 4.072 4.072 4.008 0.064 18769 42 1 . 1 1 12 12 ARG CA C 12 59.855 59.855 59.278 0.577 18769 43 1 . 1 1 12 12 ARG CB C 12 30.288 30.288 29.827 0.461 18769 44 1 . 1 1 12 12 ARG H H 12 8.158 8.158 7.800 0.358 18769 45 1 . 1 1 13 13 TRP HA H 13 4.413 4.413 4.352 0.061 18769 46 1 . 1 1 13 13 TRP CA C 13 62.193 62.193 59.670 2.523 18769 47 1 . 1 1 13 13 TRP CB C 13 29.421 29.421 29.518 -0.097 18769 48 1 . 1 1 13 13 TRP H H 13 8.425 8.425 7.664 0.761 18769 49 1 . 1 1 14 14 GLU HA H 14 3.698 3.698 3.222 0.476 18769 50 1 . 1 1 14 14 GLU CA C 14 59.978 59.978 59.215 0.763 18769 51 1 . 1 1 14 14 GLU CB C 14 28.680 28.680 28.970 -0.289 18769 52 1 . 1 1 14 14 GLU H H 14 8.774 8.774 7.538 1.236 18769 53 1 . 1 1 15 15 ASN HA H 15 4.495 4.495 4.495 -0.000 18769 54 1 . 1 1 15 15 ASN CA C 15 57.566 57.566 56.730 0.836 18769 55 1 . 1 1 15 15 ASN CB C 15 40.028 40.028 38.683 1.345 18769 56 1 . 1 1 15 15 ASN H H 15 8.059 8.059 8.393 -0.334 18769 57 1 . 1 1 16 16 TRP HA H 16 4.238 4.238 4.332 -0.094 18769 58 1 . 1 1 16 16 TRP CA C 16 62.245 62.245 60.795 1.450 18769 59 1 . 1 1 16 16 TRP CB C 16 29.191 29.191 29.461 -0.270 18769 60 1 . 1 1 16 16 TRP H H 16 8.071 8.071 8.010 0.061 18769 61 1 . 1 1 17 17 PHE HA H 17 3.446 3.446 3.091 0.355 18769 62 1 . 1 1 17 17 PHE CA C 17 62.026 62.026 61.337 0.689 18769 63 1 . 1 1 17 17 PHE CB C 17 39.605 39.605 38.327 1.278 18769 64 1 . 1 1 17 17 PHE H H 17 8.768 8.768 7.953 0.815 18769 65 1 . 1 1 18 18 TRP HA H 18 4.223 4.223 3.908 0.315 18769 66 1 . 1 1 18 18 TRP CA C 18 60.815 60.815 59.369 1.446 18769 67 1 . 1 1 18 18 TRP CB C 18 29.900 29.900 29.116 0.784 18769 68 1 . 1 1 18 18 TRP H H 18 8.456 8.456 8.479 -0.023 18769 69 1 . 1 1 19 19 ASN HA H 19 4.331 4.331 4.451 -0.120 18769 70 1 . 1 1 19 19 ASN CA C 19 57.260 57.260 56.365 0.895 18769 71 1 . 1 1 19 19 ASN CB C 19 40.029 40.029 38.627 1.402 18769 72 1 . 1 1 19 19 ASN H H 19 7.768 7.768 7.932 -0.164 18769 73 1 . 1 1 20 20 VAL HA H 20 3.728 3.728 4.044 -0.316 18769 74 1 . 1 1 20 20 VAL CA C 20 65.593 65.593 64.291 1.302 18769 75 1 . 1 1 20 20 VAL CB C 20 32.363 32.363 31.558 0.805 18769 76 1 . 1 1 20 20 VAL H H 20 7.983 7.983 7.563 0.420 18769 77 1 . 1 1 21 21 THR HA H 21 3.886 3.886 4.007 -0.121 18769 78 1 . 1 1 21 21 THR CA C 21 65.003 65.003 65.049 -0.046 18769 79 1 . 1 1 21 21 THR CB C 21 69.837 69.837 69.034 0.803 18769 80 1 . 1 1 21 21 THR H H 21 7.523 7.523 7.558 -0.035 18769 81 1 . 1 1 22 22 LEU HA H 22 4.311 4.311 4.256 0.055 18769 82 1 . 1 1 22 22 LEU CA C 22 56.094 56.094 56.075 0.019 18769 83 1 . 1 1 22 22 LEU CB C 22 42.641 42.641 42.543 0.098 18769 84 1 . 1 1 22 22 LEU H H 22 7.598 7.598 7.851 -0.253 18769 85 1 . 1 1 23 23 ARG HA H 23 4.370 4.370 4.289 0.081 18769 86 1 . 1 1 23 23 ARG CA C 23 56.977 56.977 56.195 0.782 18769 87 1 . 1 1 23 23 ARG CB C 23 30.139 30.139 29.220 0.919 18769 88 1 . 1 1 23 23 ARG H H 23 7.480 7.480 7.847 -0.367 18769 89 1 . 1 1 24 24 PRO HA H 24 4.391 4.391 4.540 -0.149 18769 90 1 . 1 1 24 24 PRO CA C 24 65.036 65.036 62.748 2.288 18769 91 1 . 1 1 24 24 PRO CB C 24 32.233 32.233 31.402 0.831 18769 92 1 . 1 1 25 25 GLU HA H 25 4.352 4.352 4.276 0.076 18769 93 1 . 1 1 25 25 GLU CA C 25 57.150 57.150 56.736 0.414 18769 94 1 . 1 1 25 25 GLU CB C 25 29.234 29.234 30.384 -1.150 18769 95 1 . 1 1 25 25 GLU H H 25 8.002 8.002 8.417 -0.415 18769 stop_ save_