data_19978 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 19978 _Entry.PDB_ID 2MPG 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 19978 _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 ILE HA H 2 3.982 3.982 3.531 0.451 19978 2 1 1 . 1 1 2 2 ILE H H 2 8.556 8.556 8.319 0.237 19978 3 1 1 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.705 -0.048 19978 4 1 1 . 1 1 3 3 VAL H H 3 8.158 8.158 7.981 0.177 19978 5 1 1 . 1 1 4 4 GLU HA H 4 4.230 4.230 4.042 0.188 19978 6 1 1 . 1 1 4 4 GLU H H 4 8.093 8.093 8.434 -0.341 19978 7 1 1 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.118 -0.003 19978 8 1 1 . 1 1 5 5 GLN H H 5 8.265 8.265 8.109 0.156 19978 9 1 1 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.600 0.374 19978 10 1 1 . 1 1 6 6 CYS H H 6 8.320 8.320 8.370 -0.050 19978 11 1 1 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.305 0.577 19978 12 1 1 . 1 1 7 7 CYS H H 7 8.255 8.255 8.188 0.067 19978 13 1 1 . 1 1 8 8 THR HA H 8 4.136 4.136 4.435 -0.299 19978 14 1 1 . 1 1 8 8 THR H H 8 8.250 8.250 7.619 0.631 19978 15 1 1 . 1 1 9 9 SER HA H 9 4.769 4.769 4.704 0.065 19978 16 1 1 . 1 1 9 9 SER H H 9 7.478 7.478 7.482 -0.004 19978 17 1 1 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.043 0.321 19978 18 1 1 . 1 1 10 10 ILE H H 10 7.915 7.915 8.324 -0.409 19978 19 1 1 . 1 1 11 11 CYS H H 11 9.622 9.622 8.603 1.019 19978 20 1 1 . 1 1 12 12 SER HA H 12 4.607 4.607 4.606 0.001 19978 21 1 1 . 1 1 12 12 SER H H 12 8.822 8.822 9.260 -0.438 19978 22 1 1 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.049 -0.162 19978 23 1 1 . 1 1 13 13 LEU H H 13 8.677 8.677 8.791 -0.114 19978 24 1 1 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.352 -0.172 19978 25 1 1 . 1 1 14 14 TYR H H 14 7.545 7.545 7.611 -0.066 19978 26 1 1 . 1 1 15 15 GLN HA H 15 4.005 4.005 4.012 -0.007 19978 27 1 1 . 1 1 15 15 GLN H H 15 7.578 7.578 7.683 -0.105 19978 28 1 1 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.310 -0.117 19978 29 1 1 . 1 1 16 16 LEU H H 16 8.122 8.122 8.747 -0.625 19978 30 1 1 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.967 0.242 19978 31 1 1 . 1 1 17 17 GLU H H 17 8.102 8.102 8.058 0.044 19978 32 1 1 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.413 0.081 19978 33 1 1 . 1 1 18 18 ASN H H 18 7.427 7.427 7.864 -0.437 19978 34 1 1 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.552 -0.109 19978 35 1 1 . 1 1 19 19 TYR H H 19 7.945 7.945 7.842 0.103 19978 36 1 1 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.620 0.323 19978 37 1 1 . 1 1 20 20 CYS H H 20 7.423 7.423 7.994 -0.571 19978 38 1 2 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.250 0.732 19978 39 1 2 . 1 1 2 2 ILE H H 2 8.556 8.556 8.134 0.422 19978 40 1 2 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.759 -0.102 19978 41 1 2 . 1 1 3 3 VAL H H 3 8.158 8.158 7.832 0.326 19978 42 1 2 . 1 1 4 4 GLU HA H 4 4.230 4.230 4.054 0.176 19978 43 1 2 . 1 1 4 4 GLU H H 4 8.093 8.093 8.502 -0.409 19978 44 1 2 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.205 -0.090 19978 45 1 2 . 1 1 5 5 GLN H H 5 8.265 8.265 8.182 0.083 19978 46 1 2 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.414 0.560 19978 47 1 2 . 1 1 6 6 CYS H H 6 8.320 8.320 7.776 0.544 19978 48 1 2 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.328 0.554 19978 49 1 2 . 1 1 7 7 CYS H H 7 8.255 8.255 8.503 -0.248 19978 50 1 2 . 1 1 8 8 THR HA H 8 4.136 4.136 4.188 -0.052 19978 51 1 2 . 1 1 8 8 THR H H 8 8.250 8.250 8.172 0.078 19978 52 1 2 . 1 1 9 9 SER HA H 9 4.769 4.769 4.611 0.158 19978 53 1 2 . 1 1 9 9 SER H H 9 7.478 7.478 7.479 -0.001 19978 54 1 2 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.128 0.236 19978 55 1 2 . 1 1 10 10 ILE H H 10 7.915 7.915 8.188 -0.273 19978 56 1 2 . 1 1 11 11 CYS H H 11 9.622 9.622 8.559 1.063 19978 57 1 2 . 1 1 12 12 SER HA H 12 4.607 4.607 4.923 -0.316 19978 58 1 2 . 1 1 12 12 SER H H 12 8.822 8.822 9.481 -0.659 19978 59 1 2 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.095 -0.208 19978 60 1 2 . 1 1 13 13 LEU H H 13 8.677 8.677 8.860 -0.183 19978 61 1 2 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.149 0.031 19978 62 1 2 . 1 1 14 14 TYR H H 14 7.545 7.545 8.393 -0.848 19978 63 1 2 . 1 1 15 15 GLN HA H 15 4.005 4.005 4.045 -0.040 19978 64 1 2 . 1 1 15 15 GLN H H 15 7.578 7.578 7.703 -0.125 19978 65 1 2 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.192 0.001 19978 66 1 2 . 1 1 16 16 LEU H H 16 8.122 8.122 8.365 -0.243 19978 67 1 2 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.908 0.301 19978 68 1 2 . 1 1 17 17 GLU H H 17 8.102 8.102 8.179 -0.077 19978 69 1 2 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.353 0.141 19978 70 1 2 . 1 1 18 18 ASN H H 18 7.427 7.427 7.740 -0.313 19978 71 1 2 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.686 -0.243 19978 72 1 2 . 1 1 19 19 TYR H H 19 7.945 7.945 7.259 0.686 19978 73 1 2 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.710 0.233 19978 74 1 2 . 1 1 20 20 CYS H H 20 7.423 7.423 7.683 -0.260 19978 75 1 3 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.210 0.772 19978 76 1 3 . 1 1 2 2 ILE H H 2 8.556 8.556 8.161 0.395 19978 77 1 3 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.696 -0.039 19978 78 1 3 . 1 1 3 3 VAL H H 3 8.158 8.158 7.832 0.326 19978 79 1 3 . 1 1 4 4 GLU HA H 4 4.230 4.230 3.989 0.241 19978 80 1 3 . 1 1 4 4 GLU H H 4 8.093 8.093 8.500 -0.407 19978 81 1 3 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.089 0.026 19978 82 1 3 . 1 1 5 5 GLN H H 5 8.265 8.265 8.178 0.087 19978 83 1 3 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.293 0.681 19978 84 1 3 . 1 1 6 6 CYS H H 6 8.320 8.320 7.955 0.365 19978 85 1 3 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.414 0.468 19978 86 1 3 . 1 1 7 7 CYS H H 7 8.255 8.255 7.942 0.313 19978 87 1 3 . 1 1 8 8 THR HA H 8 4.136 4.136 4.258 -0.122 19978 88 1 3 . 1 1 8 8 THR H H 8 8.250 8.250 8.308 -0.058 19978 89 1 3 . 1 1 9 9 SER HA H 9 4.769 4.769 4.657 0.112 19978 90 1 3 . 1 1 9 9 SER H H 9 7.478 7.478 7.692 -0.214 19978 91 1 3 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.071 0.293 19978 92 1 3 . 1 1 10 10 ILE H H 10 7.915 7.915 8.223 -0.308 19978 93 1 3 . 1 1 11 11 CYS H H 11 9.622 9.622 8.636 0.986 19978 94 1 3 . 1 1 12 12 SER HA H 12 4.607 4.607 4.568 0.039 19978 95 1 3 . 1 1 12 12 SER H H 12 8.822 8.822 8.685 0.137 19978 96 1 3 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.049 -0.162 19978 97 1 3 . 1 1 13 13 LEU H H 13 8.677 8.677 8.758 -0.081 19978 98 1 3 . 1 1 14 14 TYR HA H 14 4.180 4.180 3.988 0.192 19978 99 1 3 . 1 1 14 14 TYR H H 14 7.545 7.545 8.481 -0.936 19978 100 1 3 . 1 1 15 15 GLN HA H 15 4.005 4.005 3.809 0.196 19978 101 1 3 . 1 1 15 15 GLN H H 15 7.578 7.578 7.598 -0.020 19978 102 1 3 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.126 0.067 19978 103 1 3 . 1 1 16 16 LEU H H 16 8.122 8.122 8.458 -0.336 19978 104 1 3 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.930 0.279 19978 105 1 3 . 1 1 17 17 GLU H H 17 8.102 8.102 8.194 -0.092 19978 106 1 3 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.413 0.081 19978 107 1 3 . 1 1 18 18 ASN H H 18 7.427 7.427 7.723 -0.296 19978 108 1 3 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.610 -0.167 19978 109 1 3 . 1 1 19 19 TYR H H 19 7.945 7.945 7.646 0.299 19978 110 1 3 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.647 0.296 19978 111 1 3 . 1 1 20 20 CYS H H 20 7.423 7.423 7.782 -0.359 19978 112 1 4 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.524 0.458 19978 113 1 4 . 1 1 2 2 ILE H H 2 8.556 8.556 8.426 0.130 19978 114 1 4 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.648 0.009 19978 115 1 4 . 1 1 3 3 VAL H H 3 8.158 8.158 8.017 0.141 19978 116 1 4 . 1 1 4 4 GLU HA H 4 4.230 4.230 4.123 0.107 19978 117 1 4 . 1 1 4 4 GLU H H 4 8.093 8.093 8.549 -0.456 19978 118 1 4 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.086 0.029 19978 119 1 4 . 1 1 5 5 GLN H H 5 8.265 8.265 8.158 0.107 19978 120 1 4 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.453 0.521 19978 121 1 4 . 1 1 6 6 CYS H H 6 8.320 8.320 8.328 -0.008 19978 122 1 4 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.362 0.520 19978 123 1 4 . 1 1 7 7 CYS H H 7 8.255 8.255 8.261 -0.006 19978 124 1 4 . 1 1 8 8 THR HA H 8 4.136 4.136 4.278 -0.142 19978 125 1 4 . 1 1 8 8 THR H H 8 8.250 8.250 8.135 0.115 19978 126 1 4 . 1 1 9 9 SER HA H 9 4.769 4.769 4.642 0.127 19978 127 1 4 . 1 1 9 9 SER H H 9 7.478 7.478 7.829 -0.351 19978 128 1 4 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.141 0.223 19978 129 1 4 . 1 1 10 10 ILE H H 10 7.915 7.915 8.191 -0.276 19978 130 1 4 . 1 1 11 11 CYS H H 11 9.622 9.622 8.753 0.869 19978 131 1 4 . 1 1 12 12 SER HA H 12 4.607 4.607 4.819 -0.212 19978 132 1 4 . 1 1 12 12 SER H H 12 8.822 8.822 8.427 0.395 19978 133 1 4 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.138 -0.251 19978 134 1 4 . 1 1 13 13 LEU H H 13 8.677 8.677 8.917 -0.240 19978 135 1 4 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.236 -0.056 19978 136 1 4 . 1 1 14 14 TYR H H 14 7.545 7.545 8.397 -0.852 19978 137 1 4 . 1 1 15 15 GLN HA H 15 4.005 4.005 4.170 -0.165 19978 138 1 4 . 1 1 15 15 GLN H H 15 7.578 7.578 7.698 -0.120 19978 139 1 4 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.292 -0.099 19978 140 1 4 . 1 1 16 16 LEU H H 16 8.122 8.122 8.509 -0.387 19978 141 1 4 . 1 1 17 17 GLU HA H 17 4.209 4.209 4.006 0.203 19978 142 1 4 . 1 1 17 17 GLU H H 17 8.102 8.102 7.985 0.117 19978 143 1 4 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.501 -0.007 19978 144 1 4 . 1 1 18 18 ASN H H 18 7.427 7.427 8.318 -0.891 19978 145 1 4 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.603 -0.160 19978 146 1 4 . 1 1 19 19 TYR H H 19 7.945 7.945 7.620 0.325 19978 147 1 4 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.602 0.341 19978 148 1 4 . 1 1 20 20 CYS H H 20 7.423 7.423 7.716 -0.293 19978 149 1 5 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.399 0.583 19978 150 1 5 . 1 1 2 2 ILE H H 2 8.556 8.556 8.359 0.197 19978 151 1 5 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.651 0.006 19978 152 1 5 . 1 1 3 3 VAL H H 3 8.158 8.158 8.311 -0.153 19978 153 1 5 . 1 1 4 4 GLU HA H 4 4.230 4.230 4.111 0.119 19978 154 1 5 . 1 1 4 4 GLU H H 4 8.093 8.093 8.455 -0.362 19978 155 1 5 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.255 -0.140 19978 156 1 5 . 1 1 5 5 GLN H H 5 8.265 8.265 8.245 0.020 19978 157 1 5 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.581 0.393 19978 158 1 5 . 1 1 6 6 CYS H H 6 8.320 8.320 7.970 0.350 19978 159 1 5 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.406 0.476 19978 160 1 5 . 1 1 7 7 CYS H H 7 8.255 8.255 8.200 0.055 19978 161 1 5 . 1 1 8 8 THR HA H 8 4.136 4.136 4.475 -0.339 19978 162 1 5 . 1 1 8 8 THR H H 8 8.250 8.250 7.719 0.531 19978 163 1 5 . 1 1 9 9 SER HA H 9 4.769 4.769 4.189 0.580 19978 164 1 5 . 1 1 9 9 SER H H 9 7.478 7.478 8.459 -0.981 19978 165 1 5 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.382 -0.018 19978 166 1 5 . 1 1 10 10 ILE H H 10 7.915 7.915 8.168 -0.253 19978 167 1 5 . 1 1 11 11 CYS H H 11 9.622 9.622 8.682 0.940 19978 168 1 5 . 1 1 12 12 SER HA H 12 4.607 4.607 4.829 -0.222 19978 169 1 5 . 1 1 12 12 SER H H 12 8.822 8.822 8.851 -0.029 19978 170 1 5 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.165 -0.278 19978 171 1 5 . 1 1 13 13 LEU H H 13 8.677 8.677 8.856 -0.179 19978 172 1 5 . 1 1 14 14 TYR HA H 14 4.180 4.180 3.992 0.188 19978 173 1 5 . 1 1 14 14 TYR H H 14 7.545 7.545 8.259 -0.714 19978 174 1 5 . 1 1 15 15 GLN HA H 15 4.005 4.005 3.881 0.124 19978 175 1 5 . 1 1 15 15 GLN H H 15 7.578 7.578 7.650 -0.072 19978 176 1 5 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.090 0.103 19978 177 1 5 . 1 1 16 16 LEU H H 16 8.122 8.122 8.459 -0.337 19978 178 1 5 . 1 1 17 17 GLU HA H 17 4.209 4.209 4.051 0.158 19978 179 1 5 . 1 1 17 17 GLU H H 17 8.102 8.102 8.148 -0.046 19978 180 1 5 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.427 0.067 19978 181 1 5 . 1 1 18 18 ASN H H 18 7.427 7.427 7.692 -0.265 19978 182 1 5 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.520 -0.077 19978 183 1 5 . 1 1 19 19 TYR H H 19 7.945 7.945 7.321 0.624 19978 184 1 5 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.468 0.475 19978 185 1 5 . 1 1 20 20 CYS H H 20 7.423 7.423 7.683 -0.260 19978 186 1 6 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.501 0.481 19978 187 1 6 . 1 1 2 2 ILE H H 2 8.556 8.556 8.310 0.246 19978 188 1 6 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.767 -0.110 19978 189 1 6 . 1 1 3 3 VAL H H 3 8.158 8.158 7.935 0.223 19978 190 1 6 . 1 1 4 4 GLU HA H 4 4.230 4.230 4.031 0.199 19978 191 1 6 . 1 1 4 4 GLU H H 4 8.093 8.093 8.464 -0.371 19978 192 1 6 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.100 0.015 19978 193 1 6 . 1 1 5 5 GLN H H 5 8.265 8.265 8.323 -0.058 19978 194 1 6 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.762 0.212 19978 195 1 6 . 1 1 6 6 CYS H H 6 8.320 8.320 8.368 -0.048 19978 196 1 6 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.532 0.350 19978 197 1 6 . 1 1 7 7 CYS H H 7 8.255 8.255 8.377 -0.122 19978 198 1 6 . 1 1 8 8 THR HA H 8 4.136 4.136 4.294 -0.158 19978 199 1 6 . 1 1 8 8 THR H H 8 8.250 8.250 8.112 0.138 19978 200 1 6 . 1 1 9 9 SER HA H 9 4.769 4.769 4.623 0.146 19978 201 1 6 . 1 1 9 9 SER H H 9 7.478 7.478 7.712 -0.234 19978 202 1 6 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.165 0.199 19978 203 1 6 . 1 1 10 10 ILE H H 10 7.915 7.915 8.391 -0.476 19978 204 1 6 . 1 1 11 11 CYS H H 11 9.622 9.622 8.055 1.567 19978 205 1 6 . 1 1 12 12 SER HA H 12 4.607 4.607 4.815 -0.208 19978 206 1 6 . 1 1 12 12 SER H H 12 8.822 8.822 8.815 0.007 19978 207 1 6 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.026 -0.139 19978 208 1 6 . 1 1 13 13 LEU H H 13 8.677 8.677 8.911 -0.234 19978 209 1 6 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.389 -0.209 19978 210 1 6 . 1 1 14 14 TYR H H 14 7.545 7.545 8.464 -0.919 19978 211 1 6 . 1 1 15 15 GLN HA H 15 4.005 4.005 3.971 0.034 19978 212 1 6 . 1 1 15 15 GLN H H 15 7.578 7.578 7.770 -0.192 19978 213 1 6 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.228 -0.035 19978 214 1 6 . 1 1 16 16 LEU H H 16 8.122 8.122 8.354 -0.232 19978 215 1 6 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.911 0.298 19978 216 1 6 . 1 1 17 17 GLU H H 17 8.102 8.102 8.044 0.058 19978 217 1 6 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.332 0.162 19978 218 1 6 . 1 1 18 18 ASN H H 18 7.427 7.427 7.549 -0.122 19978 219 1 6 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.616 -0.173 19978 220 1 6 . 1 1 19 19 TYR H H 19 7.945 7.945 7.573 0.372 19978 221 1 6 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.819 0.124 19978 222 1 6 . 1 1 20 20 CYS H H 20 7.423 7.423 7.716 -0.293 19978 223 1 7 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.471 0.511 19978 224 1 7 . 1 1 2 2 ILE H H 2 8.556 8.556 7.771 0.785 19978 225 1 7 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.723 -0.066 19978 226 1 7 . 1 1 3 3 VAL H H 3 8.158 8.158 8.053 0.105 19978 227 1 7 . 1 1 4 4 GLU HA H 4 4.230 4.230 3.983 0.247 19978 228 1 7 . 1 1 4 4 GLU H H 4 8.093 8.093 8.369 -0.276 19978 229 1 7 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.147 -0.032 19978 230 1 7 . 1 1 5 5 GLN H H 5 8.265 8.265 8.084 0.181 19978 231 1 7 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.418 0.556 19978 232 1 7 . 1 1 6 6 CYS H H 6 8.320 8.320 8.009 0.311 19978 233 1 7 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.296 0.586 19978 234 1 7 . 1 1 7 7 CYS H H 7 8.255 8.255 8.345 -0.090 19978 235 1 7 . 1 1 8 8 THR HA H 8 4.136 4.136 4.348 -0.212 19978 236 1 7 . 1 1 8 8 THR H H 8 8.250 8.250 7.721 0.529 19978 237 1 7 . 1 1 9 9 SER HA H 9 4.769 4.769 4.711 0.058 19978 238 1 7 . 1 1 9 9 SER H H 9 7.478 7.478 8.055 -0.577 19978 239 1 7 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.186 0.178 19978 240 1 7 . 1 1 10 10 ILE H H 10 7.915 7.915 8.323 -0.408 19978 241 1 7 . 1 1 11 11 CYS H H 11 9.622 9.622 8.888 0.734 19978 242 1 7 . 1 1 12 12 SER HA H 12 4.607 4.607 4.529 0.078 19978 243 1 7 . 1 1 12 12 SER H H 12 8.822 8.822 9.121 -0.299 19978 244 1 7 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.057 -0.170 19978 245 1 7 . 1 1 13 13 LEU H H 13 8.677 8.677 8.831 -0.154 19978 246 1 7 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.476 -0.296 19978 247 1 7 . 1 1 14 14 TYR H H 14 7.545 7.545 8.367 -0.822 19978 248 1 7 . 1 1 15 15 GLN HA H 15 4.005 4.005 4.085 -0.080 19978 249 1 7 . 1 1 15 15 GLN H H 15 7.578 7.578 7.736 -0.158 19978 250 1 7 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.247 -0.054 19978 251 1 7 . 1 1 16 16 LEU H H 16 8.122 8.122 8.674 -0.552 19978 252 1 7 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.951 0.258 19978 253 1 7 . 1 1 17 17 GLU H H 17 8.102 8.102 8.107 -0.005 19978 254 1 7 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.442 0.052 19978 255 1 7 . 1 1 18 18 ASN H H 18 7.427 7.427 8.313 -0.886 19978 256 1 7 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.583 -0.140 19978 257 1 7 . 1 1 19 19 TYR H H 19 7.945 7.945 7.724 0.221 19978 258 1 7 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.432 0.511 19978 259 1 7 . 1 1 20 20 CYS H H 20 7.423 7.423 7.699 -0.276 19978 260 1 8 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.545 0.437 19978 261 1 8 . 1 1 2 2 ILE H H 2 8.556 8.556 7.961 0.595 19978 262 1 8 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.853 -0.196 19978 263 1 8 . 1 1 3 3 VAL H H 3 8.158 8.158 8.094 0.064 19978 264 1 8 . 1 1 4 4 GLU HA H 4 4.230 4.230 4.018 0.212 19978 265 1 8 . 1 1 4 4 GLU H H 4 8.093 8.093 8.445 -0.352 19978 266 1 8 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.209 -0.094 19978 267 1 8 . 1 1 5 5 GLN H H 5 8.265 8.265 8.084 0.181 19978 268 1 8 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.281 0.693 19978 269 1 8 . 1 1 6 6 CYS H H 6 8.320 8.320 7.670 0.650 19978 270 1 8 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.381 0.501 19978 271 1 8 . 1 1 7 7 CYS H H 7 8.255 8.255 8.612 -0.357 19978 272 1 8 . 1 1 8 8 THR HA H 8 4.136 4.136 4.298 -0.162 19978 273 1 8 . 1 1 8 8 THR H H 8 8.250 8.250 8.078 0.172 19978 274 1 8 . 1 1 9 9 SER HA H 9 4.769 4.769 4.678 0.091 19978 275 1 8 . 1 1 9 9 SER H H 9 7.478 7.478 7.466 0.012 19978 276 1 8 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.381 -0.017 19978 277 1 8 . 1 1 10 10 ILE H H 10 7.915 7.915 8.355 -0.440 19978 278 1 8 . 1 1 11 11 CYS H H 11 9.622 9.622 8.828 0.794 19978 279 1 8 . 1 1 12 12 SER HA H 12 4.607 4.607 4.824 -0.217 19978 280 1 8 . 1 1 12 12 SER H H 12 8.822 8.822 8.865 -0.043 19978 281 1 8 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.107 -0.220 19978 282 1 8 . 1 1 13 13 LEU H H 13 8.677 8.677 8.851 -0.174 19978 283 1 8 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.328 -0.148 19978 284 1 8 . 1 1 14 14 TYR H H 14 7.545 7.545 8.278 -0.733 19978 285 1 8 . 1 1 15 15 GLN HA H 15 4.005 4.005 3.858 0.147 19978 286 1 8 . 1 1 15 15 GLN H H 15 7.578 7.578 7.747 -0.169 19978 287 1 8 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.306 -0.113 19978 288 1 8 . 1 1 16 16 LEU H H 16 8.122 8.122 8.381 -0.259 19978 289 1 8 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.928 0.281 19978 290 1 8 . 1 1 17 17 GLU H H 17 8.102 8.102 8.272 -0.170 19978 291 1 8 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.374 0.120 19978 292 1 8 . 1 1 18 18 ASN H H 18 7.427 7.427 7.738 -0.311 19978 293 1 8 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.585 -0.142 19978 294 1 8 . 1 1 19 19 TYR H H 19 7.945 7.945 7.831 0.114 19978 295 1 8 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.452 0.491 19978 296 1 8 . 1 1 20 20 CYS H H 20 7.423 7.423 7.981 -0.558 19978 297 1 9 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.405 0.577 19978 298 1 9 . 1 1 2 2 ILE H H 2 8.556 8.556 8.005 0.551 19978 299 1 9 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.832 -0.175 19978 300 1 9 . 1 1 3 3 VAL H H 3 8.158 8.158 7.837 0.321 19978 301 1 9 . 1 1 4 4 GLU HA H 4 4.230 4.230 4.106 0.124 19978 302 1 9 . 1 1 4 4 GLU H H 4 8.093 8.093 8.390 -0.297 19978 303 1 9 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.304 -0.189 19978 304 1 9 . 1 1 5 5 GLN H H 5 8.265 8.265 8.038 0.227 19978 305 1 9 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.648 0.326 19978 306 1 9 . 1 1 6 6 CYS H H 6 8.320 8.320 7.886 0.434 19978 307 1 9 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.393 0.489 19978 308 1 9 . 1 1 7 7 CYS H H 7 8.255 8.255 8.480 -0.226 19978 309 1 9 . 1 1 8 8 THR HA H 8 4.136 4.136 4.517 -0.381 19978 310 1 9 . 1 1 8 8 THR H H 8 8.250 8.250 7.741 0.509 19978 311 1 9 . 1 1 9 9 SER HA H 9 4.769 4.769 4.143 0.626 19978 312 1 9 . 1 1 9 9 SER H H 9 7.478 7.478 8.355 -0.877 19978 313 1 9 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.352 0.012 19978 314 1 9 . 1 1 10 10 ILE H H 10 7.915 7.915 8.346 -0.431 19978 315 1 9 . 1 1 11 11 CYS H H 11 9.622 9.622 8.902 0.720 19978 316 1 9 . 1 1 12 12 SER HA H 12 4.607 4.607 4.872 -0.265 19978 317 1 9 . 1 1 12 12 SER H H 12 8.822 8.822 9.390 -0.568 19978 318 1 9 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.051 -0.164 19978 319 1 9 . 1 1 13 13 LEU H H 13 8.677 8.677 8.863 -0.186 19978 320 1 9 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.063 0.117 19978 321 1 9 . 1 1 14 14 TYR H H 14 7.545 7.545 8.424 -0.879 19978 322 1 9 . 1 1 15 15 GLN HA H 15 4.005 4.005 3.995 0.010 19978 323 1 9 . 1 1 15 15 GLN H H 15 7.578 7.578 7.641 -0.063 19978 324 1 9 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.174 0.019 19978 325 1 9 . 1 1 16 16 LEU H H 16 8.122 8.122 8.417 -0.295 19978 326 1 9 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.996 0.213 19978 327 1 9 . 1 1 17 17 GLU H H 17 8.102 8.102 8.209 -0.107 19978 328 1 9 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.413 0.081 19978 329 1 9 . 1 1 18 18 ASN H H 18 7.427 7.427 8.066 -0.639 19978 330 1 9 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.519 -0.076 19978 331 1 9 . 1 1 19 19 TYR H H 19 7.945 7.945 7.668 0.277 19978 332 1 9 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.413 0.530 19978 333 1 9 . 1 1 20 20 CYS H H 20 7.423 7.423 7.900 -0.477 19978 334 1 10 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.495 0.487 19978 335 1 10 . 1 1 2 2 ILE H H 2 8.556 8.556 8.327 0.229 19978 336 1 10 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.649 0.008 19978 337 1 10 . 1 1 3 3 VAL H H 3 8.158 8.158 7.898 0.260 19978 338 1 10 . 1 1 4 4 GLU HA H 4 4.230 4.230 4.009 0.221 19978 339 1 10 . 1 1 4 4 GLU H H 4 8.093 8.093 8.420 -0.327 19978 340 1 10 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.105 0.010 19978 341 1 10 . 1 1 5 5 GLN H H 5 8.265 8.265 8.466 -0.201 19978 342 1 10 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.682 0.292 19978 343 1 10 . 1 1 6 6 CYS H H 6 8.320 8.320 7.795 0.525 19978 344 1 10 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.328 0.554 19978 345 1 10 . 1 1 7 7 CYS H H 7 8.255 8.255 8.225 0.030 19978 346 1 10 . 1 1 8 8 THR HA H 8 4.136 4.136 4.254 -0.118 19978 347 1 10 . 1 1 8 8 THR H H 8 8.250 8.250 7.986 0.264 19978 348 1 10 . 1 1 9 9 SER HA H 9 4.769 4.769 4.670 0.099 19978 349 1 10 . 1 1 9 9 SER H H 9 7.478 7.478 7.549 -0.071 19978 350 1 10 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.050 0.314 19978 351 1 10 . 1 1 10 10 ILE H H 10 7.915 7.915 8.306 -0.391 19978 352 1 10 . 1 1 11 11 CYS H H 11 9.622 9.622 8.839 0.783 19978 353 1 10 . 1 1 12 12 SER HA H 12 4.607 4.607 4.816 -0.209 19978 354 1 10 . 1 1 12 12 SER H H 12 8.822 8.822 8.379 0.443 19978 355 1 10 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.150 -0.263 19978 356 1 10 . 1 1 13 13 LEU H H 13 8.677 8.677 8.863 -0.186 19978 357 1 10 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.013 0.167 19978 358 1 10 . 1 1 14 14 TYR H H 14 7.545 7.545 8.452 -0.907 19978 359 1 10 . 1 1 15 15 GLN HA H 15 4.005 4.005 3.990 0.015 19978 360 1 10 . 1 1 15 15 GLN H H 15 7.578 7.578 7.898 -0.320 19978 361 1 10 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.195 -0.002 19978 362 1 10 . 1 1 16 16 LEU H H 16 8.122 8.122 8.514 -0.392 19978 363 1 10 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.957 0.252 19978 364 1 10 . 1 1 17 17 GLU H H 17 8.102 8.102 8.233 -0.131 19978 365 1 10 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.423 0.071 19978 366 1 10 . 1 1 18 18 ASN H H 18 7.427 7.427 7.867 -0.440 19978 367 1 10 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.576 -0.133 19978 368 1 10 . 1 1 19 19 TYR H H 19 7.945 7.945 7.813 0.132 19978 369 1 10 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.719 0.224 19978 370 1 10 . 1 1 20 20 CYS H H 20 7.423 7.423 7.803 -0.380 19978 371 1 11 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.410 0.572 19978 372 1 11 . 1 1 2 2 ILE H H 2 8.556 8.556 8.034 0.522 19978 373 1 11 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.602 0.055 19978 374 1 11 . 1 1 3 3 VAL H H 3 8.158 8.158 7.984 0.174 19978 375 1 11 . 1 1 4 4 GLU HA H 4 4.230 4.230 3.967 0.263 19978 376 1 11 . 1 1 4 4 GLU H H 4 8.093 8.093 8.616 -0.523 19978 377 1 11 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.132 -0.017 19978 378 1 11 . 1 1 5 5 GLN H H 5 8.265 8.265 8.166 0.099 19978 379 1 11 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.372 0.602 19978 380 1 11 . 1 1 6 6 CYS H H 6 8.320 8.320 7.734 0.586 19978 381 1 11 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.201 0.681 19978 382 1 11 . 1 1 7 7 CYS H H 7 8.255 8.255 8.385 -0.130 19978 383 1 11 . 1 1 8 8 THR HA H 8 4.136 4.136 4.363 -0.227 19978 384 1 11 . 1 1 8 8 THR H H 8 8.250 8.250 7.778 0.472 19978 385 1 11 . 1 1 9 9 SER HA H 9 4.769 4.769 4.183 0.586 19978 386 1 11 . 1 1 9 9 SER H H 9 7.478 7.478 8.343 -0.865 19978 387 1 11 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.145 0.219 19978 388 1 11 . 1 1 10 10 ILE H H 10 7.915 7.915 8.092 -0.177 19978 389 1 11 . 1 1 11 11 CYS H H 11 9.622 9.622 8.537 1.085 19978 390 1 11 . 1 1 12 12 SER HA H 12 4.607 4.607 4.710 -0.103 19978 391 1 11 . 1 1 12 12 SER H H 12 8.822 8.822 8.397 0.425 19978 392 1 11 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.085 -0.198 19978 393 1 11 . 1 1 13 13 LEU H H 13 8.677 8.677 8.929 -0.252 19978 394 1 11 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.067 0.113 19978 395 1 11 . 1 1 14 14 TYR H H 14 7.545 7.545 8.422 -0.877 19978 396 1 11 . 1 1 15 15 GLN HA H 15 4.005 4.005 3.912 0.093 19978 397 1 11 . 1 1 15 15 GLN H H 15 7.578 7.578 7.576 0.002 19978 398 1 11 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.200 -0.007 19978 399 1 11 . 1 1 16 16 LEU H H 16 8.122 8.122 8.499 -0.377 19978 400 1 11 . 1 1 17 17 GLU HA H 17 4.209 4.209 4.012 0.197 19978 401 1 11 . 1 1 17 17 GLU H H 17 8.102 8.102 8.453 -0.351 19978 402 1 11 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.405 0.089 19978 403 1 11 . 1 1 18 18 ASN H H 18 7.427 7.427 8.116 -0.689 19978 404 1 11 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.560 -0.117 19978 405 1 11 . 1 1 19 19 TYR H H 19 7.945 7.945 7.857 0.088 19978 406 1 11 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.669 0.274 19978 407 1 11 . 1 1 20 20 CYS H H 20 7.423 7.423 7.568 -0.145 19978 408 1 12 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.554 0.428 19978 409 1 12 . 1 1 2 2 ILE H H 2 8.556 8.556 7.951 0.605 19978 410 1 12 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.616 0.041 19978 411 1 12 . 1 1 3 3 VAL H H 3 8.158 8.158 7.995 0.163 19978 412 1 12 . 1 1 4 4 GLU HA H 4 4.230 4.230 4.086 0.144 19978 413 1 12 . 1 1 4 4 GLU H H 4 8.093 8.093 7.844 0.249 19978 414 1 12 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.144 -0.029 19978 415 1 12 . 1 1 5 5 GLN H H 5 8.265 8.265 8.150 0.115 19978 416 1 12 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.859 0.115 19978 417 1 12 . 1 1 6 6 CYS H H 6 8.320 8.320 8.160 0.160 19978 418 1 12 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.312 0.570 19978 419 1 12 . 1 1 7 7 CYS H H 7 8.255 8.255 8.431 -0.176 19978 420 1 12 . 1 1 8 8 THR HA H 8 4.136 4.136 4.338 -0.202 19978 421 1 12 . 1 1 8 8 THR H H 8 8.250 8.250 8.442 -0.192 19978 422 1 12 . 1 1 9 9 SER HA H 9 4.769 4.769 4.696 0.073 19978 423 1 12 . 1 1 9 9 SER H H 9 7.478 7.478 7.557 -0.079 19978 424 1 12 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.073 0.291 19978 425 1 12 . 1 1 10 10 ILE H H 10 7.915 7.915 8.305 -0.390 19978 426 1 12 . 1 1 11 11 CYS H H 11 9.622 9.622 8.731 0.891 19978 427 1 12 . 1 1 12 12 SER HA H 12 4.607 4.607 4.861 -0.254 19978 428 1 12 . 1 1 12 12 SER H H 12 8.822 8.822 8.255 0.567 19978 429 1 12 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.038 -0.151 19978 430 1 12 . 1 1 13 13 LEU H H 13 8.677 8.677 8.735 -0.058 19978 431 1 12 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.444 -0.264 19978 432 1 12 . 1 1 14 14 TYR H H 14 7.545 7.545 8.319 -0.774 19978 433 1 12 . 1 1 15 15 GLN HA H 15 4.005 4.005 4.078 -0.073 19978 434 1 12 . 1 1 15 15 GLN H H 15 7.578 7.578 7.718 -0.140 19978 435 1 12 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.267 -0.074 19978 436 1 12 . 1 1 16 16 LEU H H 16 8.122 8.122 8.266 -0.144 19978 437 1 12 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.896 0.313 19978 438 1 12 . 1 1 17 17 GLU H H 17 8.102 8.102 8.142 -0.040 19978 439 1 12 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.325 0.169 19978 440 1 12 . 1 1 18 18 ASN H H 18 7.427 7.427 7.660 -0.233 19978 441 1 12 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.613 -0.170 19978 442 1 12 . 1 1 19 19 TYR H H 19 7.945 7.945 7.519 0.426 19978 443 1 12 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.793 0.150 19978 444 1 12 . 1 1 20 20 CYS H H 20 7.423 7.423 7.910 -0.487 19978 445 1 13 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.440 0.542 19978 446 1 13 . 1 1 2 2 ILE H H 2 8.556 8.556 7.955 0.601 19978 447 1 13 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.918 -0.261 19978 448 1 13 . 1 1 3 3 VAL H H 3 8.158 8.158 7.776 0.382 19978 449 1 13 . 1 1 4 4 GLU HA H 4 4.230 4.230 3.939 0.291 19978 450 1 13 . 1 1 4 4 GLU H H 4 8.093 8.093 8.375 -0.282 19978 451 1 13 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.187 -0.072 19978 452 1 13 . 1 1 5 5 GLN H H 5 8.265 8.265 7.813 0.452 19978 453 1 13 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.706 0.268 19978 454 1 13 . 1 1 6 6 CYS H H 6 8.320 8.320 8.345 -0.025 19978 455 1 13 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.464 0.418 19978 456 1 13 . 1 1 7 7 CYS H H 7 8.255 8.255 8.385 -0.130 19978 457 1 13 . 1 1 8 8 THR HA H 8 4.136 4.136 4.411 -0.275 19978 458 1 13 . 1 1 8 8 THR H H 8 8.250 8.250 7.857 0.393 19978 459 1 13 . 1 1 9 9 SER HA H 9 4.769 4.769 4.751 0.018 19978 460 1 13 . 1 1 9 9 SER H H 9 7.478 7.478 7.881 -0.403 19978 461 1 13 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.359 0.005 19978 462 1 13 . 1 1 10 10 ILE H H 10 7.915 7.915 8.294 -0.379 19978 463 1 13 . 1 1 11 11 CYS H H 11 9.622 9.622 8.501 1.121 19978 464 1 13 . 1 1 12 12 SER HA H 12 4.607 4.607 4.823 -0.216 19978 465 1 13 . 1 1 12 12 SER H H 12 8.822 8.822 8.296 0.526 19978 466 1 13 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.137 -0.250 19978 467 1 13 . 1 1 13 13 LEU H H 13 8.677 8.677 8.773 -0.096 19978 468 1 13 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.422 -0.242 19978 469 1 13 . 1 1 14 14 TYR H H 14 7.545 7.545 8.225 -0.680 19978 470 1 13 . 1 1 15 15 GLN HA H 15 4.005 4.005 3.901 0.104 19978 471 1 13 . 1 1 15 15 GLN H H 15 7.578 7.578 7.812 -0.234 19978 472 1 13 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.265 -0.072 19978 473 1 13 . 1 1 16 16 LEU H H 16 8.122 8.122 8.028 0.094 19978 474 1 13 . 1 1 17 17 GLU HA H 17 4.209 4.209 4.008 0.201 19978 475 1 13 . 1 1 17 17 GLU H H 17 8.102 8.102 7.929 0.173 19978 476 1 13 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.343 0.151 19978 477 1 13 . 1 1 18 18 ASN H H 18 7.427 7.427 7.562 -0.135 19978 478 1 13 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.519 -0.076 19978 479 1 13 . 1 1 19 19 TYR H H 19 7.945 7.945 7.352 0.593 19978 480 1 13 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.699 0.244 19978 481 1 13 . 1 1 20 20 CYS H H 20 7.423 7.423 7.533 -0.110 19978 482 1 14 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.144 0.838 19978 483 1 14 . 1 1 2 2 ILE H H 2 8.556 8.556 8.197 0.359 19978 484 1 14 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.868 -0.211 19978 485 1 14 . 1 1 3 3 VAL H H 3 8.158 8.158 7.769 0.389 19978 486 1 14 . 1 1 4 4 GLU HA H 4 4.230 4.230 4.013 0.217 19978 487 1 14 . 1 1 4 4 GLU H H 4 8.093 8.093 8.428 -0.335 19978 488 1 14 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.235 -0.120 19978 489 1 14 . 1 1 5 5 GLN H H 5 8.265 8.265 7.785 0.480 19978 490 1 14 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.569 0.405 19978 491 1 14 . 1 1 6 6 CYS H H 6 8.320 8.320 8.146 0.174 19978 492 1 14 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.344 0.538 19978 493 1 14 . 1 1 7 7 CYS H H 7 8.255 8.255 8.341 -0.087 19978 494 1 14 . 1 1 8 8 THR HA H 8 4.136 4.136 4.414 -0.278 19978 495 1 14 . 1 1 8 8 THR H H 8 8.250 8.250 7.778 0.472 19978 496 1 14 . 1 1 9 9 SER HA H 9 4.769 4.769 4.713 0.056 19978 497 1 14 . 1 1 9 9 SER H H 9 7.478 7.478 7.977 -0.499 19978 498 1 14 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.244 0.120 19978 499 1 14 . 1 1 10 10 ILE H H 10 7.915 7.915 8.228 -0.313 19978 500 1 14 . 1 1 11 11 CYS H H 11 9.622 9.622 8.703 0.919 19978 501 1 14 . 1 1 12 12 SER HA H 12 4.607 4.607 4.824 -0.217 19978 502 1 14 . 1 1 12 12 SER H H 12 8.822 8.822 9.371 -0.549 19978 503 1 14 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.104 -0.217 19978 504 1 14 . 1 1 13 13 LEU H H 13 8.677 8.677 8.855 -0.178 19978 505 1 14 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.148 0.032 19978 506 1 14 . 1 1 14 14 TYR H H 14 7.545 7.545 8.349 -0.804 19978 507 1 14 . 1 1 15 15 GLN HA H 15 4.005 4.005 3.847 0.158 19978 508 1 14 . 1 1 15 15 GLN H H 15 7.578 7.578 7.529 0.049 19978 509 1 14 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.082 0.111 19978 510 1 14 . 1 1 16 16 LEU H H 16 8.122 8.122 8.254 -0.132 19978 511 1 14 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.906 0.303 19978 512 1 14 . 1 1 17 17 GLU H H 17 8.102 8.102 8.152 -0.050 19978 513 1 14 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.391 0.103 19978 514 1 14 . 1 1 18 18 ASN H H 18 7.427 7.427 7.759 -0.332 19978 515 1 14 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.501 -0.058 19978 516 1 14 . 1 1 19 19 TYR H H 19 7.945 7.945 7.620 0.325 19978 517 1 14 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.604 0.339 19978 518 1 14 . 1 1 20 20 CYS H H 20 7.423 7.423 7.955 -0.532 19978 519 1 15 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.035 0.947 19978 520 1 15 . 1 1 2 2 ILE H H 2 8.556 8.556 7.924 0.632 19978 521 1 15 . 1 1 3 3 VAL HA H 3 3.657 3.657 4.011 -0.354 19978 522 1 15 . 1 1 3 3 VAL H H 3 8.158 8.158 7.760 0.398 19978 523 1 15 . 1 1 4 4 GLU HA H 4 4.230 4.230 4.133 0.097 19978 524 1 15 . 1 1 4 4 GLU H H 4 8.093 8.093 8.281 -0.188 19978 525 1 15 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.434 -0.319 19978 526 1 15 . 1 1 5 5 GLN H H 5 8.265 8.265 7.995 0.270 19978 527 1 15 . 1 1 6 6 CYS HA H 6 4.974 4.974 5.002 -0.028 19978 528 1 15 . 1 1 6 6 CYS H H 6 8.320 8.320 7.828 0.492 19978 529 1 15 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.432 0.450 19978 530 1 15 . 1 1 7 7 CYS H H 7 8.255 8.255 8.025 0.230 19978 531 1 15 . 1 1 8 8 THR HA H 8 4.136 4.136 4.506 -0.370 19978 532 1 15 . 1 1 8 8 THR H H 8 8.250 8.250 7.615 0.635 19978 533 1 15 . 1 1 9 9 SER HA H 9 4.769 4.769 4.234 0.535 19978 534 1 15 . 1 1 9 9 SER H H 9 7.478 7.478 8.273 -0.795 19978 535 1 15 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.385 -0.021 19978 536 1 15 . 1 1 10 10 ILE H H 10 7.915 7.915 8.156 -0.241 19978 537 1 15 . 1 1 11 11 CYS H H 11 9.622 9.622 8.763 0.859 19978 538 1 15 . 1 1 12 12 SER HA H 12 4.607 4.607 4.828 -0.221 19978 539 1 15 . 1 1 12 12 SER H H 12 8.822 8.822 8.652 0.170 19978 540 1 15 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.148 -0.261 19978 541 1 15 . 1 1 13 13 LEU H H 13 8.677 8.677 8.676 0.001 19978 542 1 15 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.028 0.152 19978 543 1 15 . 1 1 14 14 TYR H H 14 7.545 7.545 8.295 -0.750 19978 544 1 15 . 1 1 15 15 GLN HA H 15 4.005 4.005 3.940 0.065 19978 545 1 15 . 1 1 15 15 GLN H H 15 7.578 7.578 7.775 -0.197 19978 546 1 15 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.206 -0.013 19978 547 1 15 . 1 1 16 16 LEU H H 16 8.122 8.122 8.210 -0.088 19978 548 1 15 . 1 1 17 17 GLU HA H 17 4.209 4.209 4.047 0.162 19978 549 1 15 . 1 1 17 17 GLU H H 17 8.102 8.102 8.059 0.043 19978 550 1 15 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.378 0.116 19978 551 1 15 . 1 1 18 18 ASN H H 18 7.427 7.427 7.865 -0.438 19978 552 1 15 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.930 -0.487 19978 553 1 15 . 1 1 19 19 TYR H H 19 7.945 7.945 7.655 0.290 19978 554 1 15 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.446 0.497 19978 555 1 15 . 1 1 20 20 CYS H H 20 7.423 7.423 7.985 -0.562 19978 556 1 16 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.894 0.088 19978 557 1 16 . 1 1 2 2 ILE H H 2 8.556 8.556 8.601 -0.045 19978 558 1 16 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.806 -0.149 19978 559 1 16 . 1 1 3 3 VAL H H 3 8.158 8.158 7.993 0.165 19978 560 1 16 . 1 1 4 4 GLU HA H 4 4.230 4.230 3.912 0.318 19978 561 1 16 . 1 1 4 4 GLU H H 4 8.093 8.093 7.796 0.297 19978 562 1 16 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.095 0.020 19978 563 1 16 . 1 1 5 5 GLN H H 5 8.265 8.265 7.998 0.267 19978 564 1 16 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.287 0.687 19978 565 1 16 . 1 1 6 6 CYS H H 6 8.320 8.320 8.099 0.221 19978 566 1 16 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.270 0.612 19978 567 1 16 . 1 1 7 7 CYS H H 7 8.255 8.255 8.492 -0.237 19978 568 1 16 . 1 1 8 8 THR HA H 8 4.136 4.136 4.354 -0.218 19978 569 1 16 . 1 1 8 8 THR H H 8 8.250 8.250 7.909 0.341 19978 570 1 16 . 1 1 9 9 SER HA H 9 4.769 4.769 4.719 0.050 19978 571 1 16 . 1 1 9 9 SER H H 9 7.478 7.478 7.442 0.036 19978 572 1 16 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.331 0.033 19978 573 1 16 . 1 1 10 10 ILE H H 10 7.915 7.915 8.233 -0.318 19978 574 1 16 . 1 1 11 11 CYS H H 11 9.622 9.622 8.607 1.015 19978 575 1 16 . 1 1 12 12 SER HA H 12 4.607 4.607 4.726 -0.119 19978 576 1 16 . 1 1 12 12 SER H H 12 8.822 8.822 7.934 0.888 19978 577 1 16 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.084 -0.197 19978 578 1 16 . 1 1 13 13 LEU H H 13 8.677 8.677 8.789 -0.112 19978 579 1 16 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.417 -0.237 19978 580 1 16 . 1 1 14 14 TYR H H 14 7.545 7.545 8.243 -0.698 19978 581 1 16 . 1 1 15 15 GLN HA H 15 4.005 4.005 4.008 -0.003 19978 582 1 16 . 1 1 15 15 GLN H H 15 7.578 7.578 7.846 -0.268 19978 583 1 16 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.055 0.138 19978 584 1 16 . 1 1 16 16 LEU H H 16 8.122 8.122 8.389 -0.267 19978 585 1 16 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.830 0.379 19978 586 1 16 . 1 1 17 17 GLU H H 17 8.102 8.102 8.137 -0.035 19978 587 1 16 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.348 0.146 19978 588 1 16 . 1 1 18 18 ASN H H 18 7.427 7.427 7.811 -0.384 19978 589 1 16 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.660 -0.217 19978 590 1 16 . 1 1 19 19 TYR H H 19 7.945 7.945 7.616 0.329 19978 591 1 16 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.528 0.415 19978 592 1 16 . 1 1 20 20 CYS H H 20 7.423 7.423 7.947 -0.524 19978 593 1 17 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.535 0.447 19978 594 1 17 . 1 1 2 2 ILE H H 2 8.556 8.556 7.929 0.627 19978 595 1 17 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.585 0.072 19978 596 1 17 . 1 1 3 3 VAL H H 3 8.158 8.158 8.228 -0.070 19978 597 1 17 . 1 1 4 4 GLU HA H 4 4.230 4.230 4.027 0.203 19978 598 1 17 . 1 1 4 4 GLU H H 4 8.093 8.093 8.353 -0.260 19978 599 1 17 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.188 -0.073 19978 600 1 17 . 1 1 5 5 GLN H H 5 8.265 8.265 8.070 0.195 19978 601 1 17 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.380 0.594 19978 602 1 17 . 1 1 6 6 CYS H H 6 8.320 8.320 8.188 0.132 19978 603 1 17 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.325 0.557 19978 604 1 17 . 1 1 7 7 CYS H H 7 8.255 8.255 8.128 0.127 19978 605 1 17 . 1 1 8 8 THR HA H 8 4.136 4.136 4.389 -0.253 19978 606 1 17 . 1 1 8 8 THR H H 8 8.250 8.250 7.657 0.593 19978 607 1 17 . 1 1 9 9 SER HA H 9 4.769 4.769 4.759 0.010 19978 608 1 17 . 1 1 9 9 SER H H 9 7.478 7.478 8.318 -0.840 19978 609 1 17 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.056 0.308 19978 610 1 17 . 1 1 10 10 ILE H H 10 7.915 7.915 8.219 -0.304 19978 611 1 17 . 1 1 11 11 CYS H H 11 9.622 9.622 8.616 1.006 19978 612 1 17 . 1 1 12 12 SER HA H 12 4.607 4.607 4.807 -0.200 19978 613 1 17 . 1 1 12 12 SER H H 12 8.822 8.822 8.343 0.479 19978 614 1 17 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.046 -0.159 19978 615 1 17 . 1 1 13 13 LEU H H 13 8.677 8.677 8.882 -0.205 19978 616 1 17 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.448 -0.268 19978 617 1 17 . 1 1 14 14 TYR H H 14 7.545 7.545 8.322 -0.777 19978 618 1 17 . 1 1 15 15 GLN HA H 15 4.005 4.005 3.987 0.018 19978 619 1 17 . 1 1 15 15 GLN H H 15 7.578 7.578 7.785 -0.207 19978 620 1 17 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.241 -0.048 19978 621 1 17 . 1 1 16 16 LEU H H 16 8.122 8.122 8.522 -0.400 19978 622 1 17 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.962 0.247 19978 623 1 17 . 1 1 17 17 GLU H H 17 8.102 8.102 8.362 -0.260 19978 624 1 17 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.359 0.135 19978 625 1 17 . 1 1 18 18 ASN H H 18 7.427 7.427 7.939 -0.511 19978 626 1 17 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.648 -0.205 19978 627 1 17 . 1 1 19 19 TYR H H 19 7.945 7.945 7.903 0.042 19978 628 1 17 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.430 0.513 19978 629 1 17 . 1 1 20 20 CYS H H 20 7.423 7.423 7.982 -0.559 19978 630 1 18 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.526 0.456 19978 631 1 18 . 1 1 2 2 ILE H H 2 8.556 8.556 7.966 0.590 19978 632 1 18 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.606 0.051 19978 633 1 18 . 1 1 3 3 VAL H H 3 8.158 8.158 8.136 0.022 19978 634 1 18 . 1 1 4 4 GLU HA H 4 4.230 4.230 4.043 0.187 19978 635 1 18 . 1 1 4 4 GLU H H 4 8.093 8.093 8.431 -0.339 19978 636 1 18 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.275 -0.160 19978 637 1 18 . 1 1 5 5 GLN H H 5 8.265 8.265 7.989 0.276 19978 638 1 18 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.554 0.420 19978 639 1 18 . 1 1 6 6 CYS H H 6 8.320 8.320 7.790 0.530 19978 640 1 18 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.476 0.406 19978 641 1 18 . 1 1 7 7 CYS H H 7 8.255 8.255 8.337 -0.082 19978 642 1 18 . 1 1 8 8 THR HA H 8 4.136 4.136 4.446 -0.310 19978 643 1 18 . 1 1 8 8 THR H H 8 8.250 8.250 7.536 0.714 19978 644 1 18 . 1 1 9 9 SER HA H 9 4.769 4.769 4.194 0.575 19978 645 1 18 . 1 1 9 9 SER H H 9 7.478 7.478 8.266 -0.788 19978 646 1 18 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.417 -0.053 19978 647 1 18 . 1 1 10 10 ILE H H 10 7.915 7.915 8.091 -0.176 19978 648 1 18 . 1 1 11 11 CYS H H 11 9.622 9.622 8.779 0.843 19978 649 1 18 . 1 1 12 12 SER HA H 12 4.607 4.607 4.853 -0.246 19978 650 1 18 . 1 1 12 12 SER H H 12 8.822 8.822 8.845 -0.023 19978 651 1 18 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.100 -0.213 19978 652 1 18 . 1 1 13 13 LEU H H 13 8.677 8.677 8.832 -0.155 19978 653 1 18 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.066 0.114 19978 654 1 18 . 1 1 14 14 TYR H H 14 7.545 7.545 8.498 -0.953 19978 655 1 18 . 1 1 15 15 GLN HA H 15 4.005 4.005 3.933 0.072 19978 656 1 18 . 1 1 15 15 GLN H H 15 7.578 7.578 7.654 -0.076 19978 657 1 18 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.249 -0.056 19978 658 1 18 . 1 1 16 16 LEU H H 16 8.122 8.122 8.276 -0.154 19978 659 1 18 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.942 0.267 19978 660 1 18 . 1 1 17 17 GLU H H 17 8.102 8.102 8.278 -0.176 19978 661 1 18 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.408 0.086 19978 662 1 18 . 1 1 18 18 ASN H H 18 7.427 7.427 7.923 -0.496 19978 663 1 18 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.534 -0.091 19978 664 1 18 . 1 1 19 19 TYR H H 19 7.945 7.945 7.641 0.304 19978 665 1 18 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.822 0.121 19978 666 1 18 . 1 1 20 20 CYS H H 20 7.423 7.423 7.723 -0.299 19978 667 1 19 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.833 0.149 19978 668 1 19 . 1 1 2 2 ILE H H 2 8.556 8.556 8.428 0.128 19978 669 1 19 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.789 -0.132 19978 670 1 19 . 1 1 3 3 VAL H H 3 8.158 8.158 8.174 -0.016 19978 671 1 19 . 1 1 4 4 GLU HA H 4 4.230 4.230 3.983 0.247 19978 672 1 19 . 1 1 4 4 GLU H H 4 8.093 8.093 7.575 0.518 19978 673 1 19 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.072 0.043 19978 674 1 19 . 1 1 5 5 GLN H H 5 8.265 8.265 7.995 0.270 19978 675 1 19 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.227 0.747 19978 676 1 19 . 1 1 6 6 CYS H H 6 8.320 8.320 8.285 0.035 19978 677 1 19 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.275 0.607 19978 678 1 19 . 1 1 7 7 CYS H H 7 8.255 8.255 8.296 -0.041 19978 679 1 19 . 1 1 8 8 THR HA H 8 4.136 4.136 4.330 -0.194 19978 680 1 19 . 1 1 8 8 THR H H 8 8.250 8.250 8.016 0.234 19978 681 1 19 . 1 1 9 9 SER HA H 9 4.769 4.769 4.710 0.059 19978 682 1 19 . 1 1 9 9 SER H H 9 7.478 7.478 7.560 -0.082 19978 683 1 19 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.251 0.113 19978 684 1 19 . 1 1 10 10 ILE H H 10 7.915 7.915 8.169 -0.254 19978 685 1 19 . 1 1 11 11 CYS H H 11 9.622 9.622 8.675 0.947 19978 686 1 19 . 1 1 12 12 SER HA H 12 4.607 4.607 4.878 -0.271 19978 687 1 19 . 1 1 12 12 SER H H 12 8.822 8.822 9.034 -0.212 19978 688 1 19 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.052 -0.165 19978 689 1 19 . 1 1 13 13 LEU H H 13 8.677 8.677 8.843 -0.166 19978 690 1 19 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.038 0.142 19978 691 1 19 . 1 1 14 14 TYR H H 14 7.545 7.545 8.380 -0.835 19978 692 1 19 . 1 1 15 15 GLN HA H 15 4.005 4.005 4.145 -0.140 19978 693 1 19 . 1 1 15 15 GLN H H 15 7.578 7.578 7.696 -0.118 19978 694 1 19 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.214 -0.021 19978 695 1 19 . 1 1 16 16 LEU H H 16 8.122 8.122 8.596 -0.474 19978 696 1 19 . 1 1 17 17 GLU HA H 17 4.209 4.209 4.031 0.178 19978 697 1 19 . 1 1 17 17 GLU H H 17 8.102 8.102 8.139 -0.037 19978 698 1 19 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.475 0.019 19978 699 1 19 . 1 1 18 18 ASN H H 18 7.427 7.427 8.045 -0.618 19978 700 1 19 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.419 0.024 19978 701 1 19 . 1 1 19 19 TYR H H 19 7.945 7.945 7.632 0.313 19978 702 1 19 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.537 0.406 19978 703 1 19 . 1 1 20 20 CYS H H 20 7.423 7.423 7.715 -0.292 19978 704 1 20 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.935 0.047 19978 705 1 20 . 1 1 2 2 ILE H H 2 8.556 8.556 7.991 0.565 19978 706 1 20 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.800 -0.143 19978 707 1 20 . 1 1 3 3 VAL H H 3 8.158 8.158 7.899 0.259 19978 708 1 20 . 1 1 4 4 GLU HA H 4 4.230 4.230 4.063 0.167 19978 709 1 20 . 1 1 4 4 GLU H H 4 8.093 8.093 8.510 -0.417 19978 710 1 20 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.199 -0.084 19978 711 1 20 . 1 1 5 5 GLN H H 5 8.265 8.265 7.842 0.423 19978 712 1 20 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.862 0.112 19978 713 1 20 . 1 1 6 6 CYS H H 6 8.320 8.320 8.518 -0.198 19978 714 1 20 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.284 0.598 19978 715 1 20 . 1 1 7 7 CYS H H 7 8.255 8.255 8.125 0.130 19978 716 1 20 . 1 1 8 8 THR HA H 8 4.136 4.136 4.369 -0.233 19978 717 1 20 . 1 1 8 8 THR H H 8 8.250 8.250 8.370 -0.120 19978 718 1 20 . 1 1 9 9 SER HA H 9 4.769 4.769 4.753 0.016 19978 719 1 20 . 1 1 9 9 SER H H 9 7.478 7.478 7.635 -0.157 19978 720 1 20 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.266 0.098 19978 721 1 20 . 1 1 10 10 ILE H H 10 7.915 7.915 8.373 -0.458 19978 722 1 20 . 1 1 11 11 CYS H H 11 9.622 9.622 8.115 1.507 19978 723 1 20 . 1 1 12 12 SER HA H 12 4.607 4.607 4.652 -0.045 19978 724 1 20 . 1 1 12 12 SER H H 12 8.822 8.822 8.177 0.645 19978 725 1 20 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.072 -0.185 19978 726 1 20 . 1 1 13 13 LEU H H 13 8.677 8.677 8.947 -0.270 19978 727 1 20 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.500 -0.320 19978 728 1 20 . 1 1 14 14 TYR H H 14 7.545 7.545 8.256 -0.711 19978 729 1 20 . 1 1 15 15 GLN HA H 15 4.005 4.005 4.010 -0.005 19978 730 1 20 . 1 1 15 15 GLN H H 15 7.578 7.578 7.801 -0.223 19978 731 1 20 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.206 -0.013 19978 732 1 20 . 1 1 16 16 LEU H H 16 8.122 8.122 8.508 -0.386 19978 733 1 20 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.949 0.260 19978 734 1 20 . 1 1 17 17 GLU H H 17 8.102 8.102 8.347 -0.245 19978 735 1 20 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.425 0.069 19978 736 1 20 . 1 1 18 18 ASN H H 18 7.427 7.427 8.165 -0.738 19978 737 1 20 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.472 -0.029 19978 738 1 20 . 1 1 19 19 TYR H H 19 7.945 7.945 7.731 0.214 19978 739 1 20 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.523 0.420 19978 740 1 20 . 1 1 20 20 CYS H H 20 7.423 7.423 7.506 -0.083 19978 741 1 21 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.867 0.115 19978 742 1 21 . 1 1 2 2 ILE H H 2 8.556 8.556 8.124 0.432 19978 743 1 21 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.640 0.017 19978 744 1 21 . 1 1 3 3 VAL H H 3 8.158 8.158 7.962 0.196 19978 745 1 21 . 1 1 4 4 GLU HA H 4 4.230 4.230 4.032 0.198 19978 746 1 21 . 1 1 4 4 GLU H H 4 8.093 8.093 8.039 0.054 19978 747 1 21 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.289 -0.174 19978 748 1 21 . 1 1 5 5 GLN H H 5 8.265 8.265 7.995 0.270 19978 749 1 21 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.688 0.286 19978 750 1 21 . 1 1 6 6 CYS H H 6 8.320 8.320 8.109 0.211 19978 751 1 21 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.366 0.516 19978 752 1 21 . 1 1 7 7 CYS H H 7 8.255 8.255 8.023 0.232 19978 753 1 21 . 1 1 8 8 THR HA H 8 4.136 4.136 4.206 -0.070 19978 754 1 21 . 1 1 8 8 THR H H 8 8.250 8.250 7.847 0.403 19978 755 1 21 . 1 1 9 9 SER HA H 9 4.769 4.769 4.684 0.085 19978 756 1 21 . 1 1 9 9 SER H H 9 7.478 7.478 7.740 -0.262 19978 757 1 21 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.167 0.197 19978 758 1 21 . 1 1 10 10 ILE H H 10 7.915 7.915 8.282 -0.367 19978 759 1 21 . 1 1 11 11 CYS H H 11 9.622 9.622 8.647 0.975 19978 760 1 21 . 1 1 12 12 SER HA H 12 4.607 4.607 4.852 -0.245 19978 761 1 21 . 1 1 12 12 SER H H 12 8.822 8.822 8.403 0.419 19978 762 1 21 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.080 -0.193 19978 763 1 21 . 1 1 13 13 LEU H H 13 8.677 8.677 8.912 -0.235 19978 764 1 21 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.501 -0.321 19978 765 1 21 . 1 1 14 14 TYR H H 14 7.545 7.545 8.449 -0.904 19978 766 1 21 . 1 1 15 15 GLN HA H 15 4.005 4.005 3.996 0.009 19978 767 1 21 . 1 1 15 15 GLN H H 15 7.578 7.578 7.704 -0.126 19978 768 1 21 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.234 -0.041 19978 769 1 21 . 1 1 16 16 LEU H H 16 8.122 8.122 8.715 -0.593 19978 770 1 21 . 1 1 17 17 GLU HA H 17 4.209 4.209 4.008 0.201 19978 771 1 21 . 1 1 17 17 GLU H H 17 8.102 8.102 8.065 0.037 19978 772 1 21 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.445 0.049 19978 773 1 21 . 1 1 18 18 ASN H H 18 7.427 7.427 7.864 -0.437 19978 774 1 21 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.529 -0.086 19978 775 1 21 . 1 1 19 19 TYR H H 19 7.945 7.945 8.100 -0.155 19978 776 1 21 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.812 0.131 19978 777 1 21 . 1 1 20 20 CYS H H 20 7.423 7.423 8.078 -0.655 19978 778 1 22 . 1 1 2 2 ILE HA H 2 3.982 3.982 4.024 -0.042 19978 779 1 22 . 1 1 2 2 ILE H H 2 8.556 8.556 8.134 0.422 19978 780 1 22 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.709 -0.052 19978 781 1 22 . 1 1 3 3 VAL H H 3 8.158 8.158 7.960 0.198 19978 782 1 22 . 1 1 4 4 GLU HA H 4 4.230 4.230 4.043 0.187 19978 783 1 22 . 1 1 4 4 GLU H H 4 8.093 8.093 7.729 0.364 19978 784 1 22 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.134 -0.019 19978 785 1 22 . 1 1 5 5 GLN H H 5 8.265 8.265 7.801 0.464 19978 786 1 22 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.299 0.675 19978 787 1 22 . 1 1 6 6 CYS H H 6 8.320 8.320 8.034 0.286 19978 788 1 22 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.164 0.718 19978 789 1 22 . 1 1 7 7 CYS H H 7 8.255 8.255 8.215 0.040 19978 790 1 22 . 1 1 8 8 THR HA H 8 4.136 4.136 4.317 -0.181 19978 791 1 22 . 1 1 8 8 THR H H 8 8.250 8.250 7.857 0.393 19978 792 1 22 . 1 1 9 9 SER HA H 9 4.769 4.769 4.691 0.078 19978 793 1 22 . 1 1 9 9 SER H H 9 7.478 7.478 7.521 -0.043 19978 794 1 22 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.295 0.069 19978 795 1 22 . 1 1 10 10 ILE H H 10 7.915 7.915 8.222 -0.307 19978 796 1 22 . 1 1 11 11 CYS H H 11 9.622 9.622 8.734 0.888 19978 797 1 22 . 1 1 12 12 SER HA H 12 4.607 4.607 4.862 -0.255 19978 798 1 22 . 1 1 12 12 SER H H 12 8.822 8.822 9.195 -0.373 19978 799 1 22 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.013 -0.126 19978 800 1 22 . 1 1 13 13 LEU H H 13 8.677 8.677 8.900 -0.223 19978 801 1 22 . 1 1 14 14 TYR HA H 14 4.180 4.180 3.975 0.205 19978 802 1 22 . 1 1 14 14 TYR H H 14 7.545 7.545 8.266 -0.721 19978 803 1 22 . 1 1 15 15 GLN HA H 15 4.005 4.005 3.825 0.180 19978 804 1 22 . 1 1 15 15 GLN H H 15 7.578 7.578 7.655 -0.077 19978 805 1 22 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.233 -0.040 19978 806 1 22 . 1 1 16 16 LEU H H 16 8.122 8.122 8.556 -0.434 19978 807 1 22 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.944 0.265 19978 808 1 22 . 1 1 17 17 GLU H H 17 8.102 8.102 8.128 -0.026 19978 809 1 22 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.324 0.170 19978 810 1 22 . 1 1 18 18 ASN H H 18 7.427 7.427 7.558 -0.131 19978 811 1 22 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.509 -0.066 19978 812 1 22 . 1 1 19 19 TYR H H 19 7.945 7.945 7.455 0.490 19978 813 1 22 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.788 0.155 19978 814 1 22 . 1 1 20 20 CYS H H 20 7.423 7.423 7.726 -0.303 19978 815 1 23 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.903 0.079 19978 816 1 23 . 1 1 2 2 ILE H H 2 8.556 8.556 8.326 0.230 19978 817 1 23 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.931 -0.274 19978 818 1 23 . 1 1 3 3 VAL H H 3 8.158 8.158 7.941 0.217 19978 819 1 23 . 1 1 4 4 GLU HA H 4 4.230 4.230 4.144 0.086 19978 820 1 23 . 1 1 4 4 GLU H H 4 8.093 8.093 8.316 -0.223 19978 821 1 23 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.347 -0.232 19978 822 1 23 . 1 1 5 5 GLN H H 5 8.265 8.265 8.047 0.218 19978 823 1 23 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.760 0.214 19978 824 1 23 . 1 1 6 6 CYS H H 6 8.320 8.320 8.278 0.042 19978 825 1 23 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.513 0.369 19978 826 1 23 . 1 1 7 7 CYS H H 7 8.255 8.255 7.866 0.389 19978 827 1 23 . 1 1 8 8 THR HA H 8 4.136 4.136 4.318 -0.182 19978 828 1 23 . 1 1 8 8 THR H H 8 8.250 8.250 7.892 0.358 19978 829 1 23 . 1 1 9 9 SER HA H 9 4.769 4.769 4.165 0.604 19978 830 1 23 . 1 1 9 9 SER H H 9 7.478 7.478 8.444 -0.966 19978 831 1 23 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.346 0.018 19978 832 1 23 . 1 1 10 10 ILE H H 10 7.915 7.915 8.127 -0.212 19978 833 1 23 . 1 1 11 11 CYS H H 11 9.622 9.622 8.643 0.979 19978 834 1 23 . 1 1 12 12 SER HA H 12 4.607 4.607 4.705 -0.098 19978 835 1 23 . 1 1 12 12 SER H H 12 8.822 8.822 9.049 -0.227 19978 836 1 23 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.062 -0.175 19978 837 1 23 . 1 1 13 13 LEU H H 13 8.677 8.677 8.747 -0.070 19978 838 1 23 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.402 -0.222 19978 839 1 23 . 1 1 14 14 TYR H H 14 7.545 7.545 8.437 -0.892 19978 840 1 23 . 1 1 15 15 GLN HA H 15 4.005 4.005 4.167 -0.162 19978 841 1 23 . 1 1 15 15 GLN H H 15 7.578 7.578 7.704 -0.126 19978 842 1 23 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.319 -0.126 19978 843 1 23 . 1 1 16 16 LEU H H 16 8.122 8.122 8.340 -0.218 19978 844 1 23 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.977 0.232 19978 845 1 23 . 1 1 17 17 GLU H H 17 8.102 8.102 8.096 0.006 19978 846 1 23 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.391 0.103 19978 847 1 23 . 1 1 18 18 ASN H H 18 7.427 7.427 7.802 -0.375 19978 848 1 23 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.456 -0.013 19978 849 1 23 . 1 1 19 19 TYR H H 19 7.945 7.945 7.665 0.280 19978 850 1 23 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.829 0.114 19978 851 1 23 . 1 1 20 20 CYS H H 20 7.423 7.423 7.833 -0.410 19978 852 1 24 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.779 0.203 19978 853 1 24 . 1 1 2 2 ILE H H 2 8.556 8.556 7.970 0.586 19978 854 1 24 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.596 0.061 19978 855 1 24 . 1 1 3 3 VAL H H 3 8.158 8.158 8.120 0.038 19978 856 1 24 . 1 1 4 4 GLU HA H 4 4.230 4.230 4.009 0.221 19978 857 1 24 . 1 1 4 4 GLU H H 4 8.093 8.093 8.493 -0.400 19978 858 1 24 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.246 -0.131 19978 859 1 24 . 1 1 5 5 GLN H H 5 8.265 8.265 7.714 0.551 19978 860 1 24 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.617 0.357 19978 861 1 24 . 1 1 6 6 CYS H H 6 8.320 8.320 7.974 0.346 19978 862 1 24 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.408 0.474 19978 863 1 24 . 1 1 7 7 CYS H H 7 8.255 8.255 8.038 0.217 19978 864 1 24 . 1 1 8 8 THR HA H 8 4.136 4.136 4.431 -0.295 19978 865 1 24 . 1 1 8 8 THR H H 8 8.250 8.250 7.286 0.964 19978 866 1 24 . 1 1 9 9 SER HA H 9 4.769 4.769 4.190 0.579 19978 867 1 24 . 1 1 9 9 SER H H 9 7.478 7.478 8.305 -0.827 19978 868 1 24 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.320 0.044 19978 869 1 24 . 1 1 10 10 ILE H H 10 7.915 7.915 8.105 -0.190 19978 870 1 24 . 1 1 11 11 CYS H H 11 9.622 9.622 8.757 0.865 19978 871 1 24 . 1 1 12 12 SER HA H 12 4.607 4.607 4.786 -0.179 19978 872 1 24 . 1 1 12 12 SER H H 12 8.822 8.822 8.630 0.192 19978 873 1 24 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.045 -0.158 19978 874 1 24 . 1 1 13 13 LEU H H 13 8.677 8.677 9.027 -0.350 19978 875 1 24 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.255 -0.075 19978 876 1 24 . 1 1 14 14 TYR H H 14 7.545 7.545 8.384 -0.839 19978 877 1 24 . 1 1 15 15 GLN HA H 15 4.005 4.005 4.103 -0.098 19978 878 1 24 . 1 1 15 15 GLN H H 15 7.578 7.578 7.797 -0.219 19978 879 1 24 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.176 0.017 19978 880 1 24 . 1 1 16 16 LEU H H 16 8.122 8.122 8.376 -0.254 19978 881 1 24 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.940 0.269 19978 882 1 24 . 1 1 17 17 GLU H H 17 8.102 8.102 8.178 -0.076 19978 883 1 24 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.435 0.059 19978 884 1 24 . 1 1 18 18 ASN H H 18 7.427 7.427 8.096 -0.669 19978 885 1 24 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.594 -0.151 19978 886 1 24 . 1 1 19 19 TYR H H 19 7.945 7.945 8.069 -0.124 19978 887 1 24 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.411 0.532 19978 888 1 24 . 1 1 20 20 CYS H H 20 7.423 7.423 8.066 -0.643 19978 889 1 25 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.519 0.463 19978 890 1 25 . 1 1 2 2 ILE H H 2 8.556 8.556 8.271 0.285 19978 891 1 25 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.716 -0.059 19978 892 1 25 . 1 1 3 3 VAL H H 3 8.158 8.158 7.834 0.324 19978 893 1 25 . 1 1 4 4 GLU HA H 4 4.230 4.230 4.096 0.134 19978 894 1 25 . 1 1 4 4 GLU H H 4 8.093 8.093 8.302 -0.209 19978 895 1 25 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.341 -0.226 19978 896 1 25 . 1 1 5 5 GLN H H 5 8.265 8.265 7.998 0.267 19978 897 1 25 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.802 0.172 19978 898 1 25 . 1 1 6 6 CYS H H 6 8.320 8.320 8.186 0.134 19978 899 1 25 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.492 0.390 19978 900 1 25 . 1 1 7 7 CYS H H 7 8.255 8.255 8.498 -0.243 19978 901 1 25 . 1 1 8 8 THR HA H 8 4.136 4.136 4.181 -0.045 19978 902 1 25 . 1 1 8 8 THR H H 8 8.250 8.250 7.894 0.356 19978 903 1 25 . 1 1 9 9 SER HA H 9 4.769 4.769 4.764 0.005 19978 904 1 25 . 1 1 9 9 SER H H 9 7.478 7.478 7.655 -0.177 19978 905 1 25 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.324 0.040 19978 906 1 25 . 1 1 10 10 ILE H H 10 7.915 7.915 8.253 -0.338 19978 907 1 25 . 1 1 11 11 CYS H H 11 9.622 9.622 8.868 0.754 19978 908 1 25 . 1 1 12 12 SER HA H 12 4.607 4.607 4.745 -0.138 19978 909 1 25 . 1 1 12 12 SER H H 12 8.822 8.822 9.062 -0.240 19978 910 1 25 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.071 -0.184 19978 911 1 25 . 1 1 13 13 LEU H H 13 8.677 8.677 8.690 -0.013 19978 912 1 25 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.217 -0.037 19978 913 1 25 . 1 1 14 14 TYR H H 14 7.545 7.545 8.219 -0.674 19978 914 1 25 . 1 1 15 15 GLN HA H 15 4.005 4.005 3.879 0.126 19978 915 1 25 . 1 1 15 15 GLN H H 15 7.578 7.578 7.765 -0.187 19978 916 1 25 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.085 0.108 19978 917 1 25 . 1 1 16 16 LEU H H 16 8.122 8.122 8.466 -0.344 19978 918 1 25 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.862 0.347 19978 919 1 25 . 1 1 17 17 GLU H H 17 8.102 8.102 8.164 -0.062 19978 920 1 25 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.368 0.126 19978 921 1 25 . 1 1 18 18 ASN H H 18 7.427 7.427 7.871 -0.444 19978 922 1 25 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.560 -0.117 19978 923 1 25 . 1 1 19 19 TYR H H 19 7.945 7.945 7.596 0.349 19978 924 1 25 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.543 0.400 19978 925 1 25 . 1 1 20 20 CYS H H 20 7.423 7.423 7.955 -0.532 19978 926 1 26 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.705 0.277 19978 927 1 26 . 1 1 2 2 ILE H H 2 8.556 8.556 8.246 0.310 19978 928 1 26 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.800 -0.143 19978 929 1 26 . 1 1 3 3 VAL H H 3 8.158 8.158 7.890 0.268 19978 930 1 26 . 1 1 4 4 GLU HA H 4 4.230 4.230 4.008 0.222 19978 931 1 26 . 1 1 4 4 GLU H H 4 8.093 8.093 8.457 -0.364 19978 932 1 26 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.255 -0.140 19978 933 1 26 . 1 1 5 5 GLN H H 5 8.265 8.265 8.062 0.203 19978 934 1 26 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.674 0.300 19978 935 1 26 . 1 1 6 6 CYS H H 6 8.320 8.320 8.465 -0.145 19978 936 1 26 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.342 0.540 19978 937 1 26 . 1 1 7 7 CYS H H 7 8.255 8.255 8.284 -0.029 19978 938 1 26 . 1 1 8 8 THR HA H 8 4.136 4.136 4.459 -0.323 19978 939 1 26 . 1 1 8 8 THR H H 8 8.250 8.250 8.086 0.164 19978 940 1 26 . 1 1 9 9 SER HA H 9 4.769 4.769 4.240 0.529 19978 941 1 26 . 1 1 9 9 SER H H 9 7.478 7.478 8.574 -1.096 19978 942 1 26 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.185 0.179 19978 943 1 26 . 1 1 10 10 ILE H H 10 7.915 7.915 8.268 -0.353 19978 944 1 26 . 1 1 11 11 CYS H H 11 9.622 9.622 8.342 1.280 19978 945 1 26 . 1 1 12 12 SER HA H 12 4.607 4.607 4.537 0.070 19978 946 1 26 . 1 1 12 12 SER H H 12 8.822 8.822 8.818 0.004 19978 947 1 26 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.026 -0.139 19978 948 1 26 . 1 1 13 13 LEU H H 13 8.677 8.677 8.842 -0.165 19978 949 1 26 . 1 1 14 14 TYR HA H 14 4.180 4.180 3.953 0.227 19978 950 1 26 . 1 1 14 14 TYR H H 14 7.545 7.545 8.457 -0.912 19978 951 1 26 . 1 1 15 15 GLN HA H 15 4.005 4.005 3.905 0.100 19978 952 1 26 . 1 1 15 15 GLN H H 15 7.578 7.578 7.791 -0.213 19978 953 1 26 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.250 -0.057 19978 954 1 26 . 1 1 16 16 LEU H H 16 8.122 8.122 8.510 -0.388 19978 955 1 26 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.982 0.227 19978 956 1 26 . 1 1 17 17 GLU H H 17 8.102 8.102 8.273 -0.171 19978 957 1 26 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.430 0.064 19978 958 1 26 . 1 1 18 18 ASN H H 18 7.427 7.427 7.677 -0.250 19978 959 1 26 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.448 -0.005 19978 960 1 26 . 1 1 19 19 TYR H H 19 7.945 7.945 7.508 0.437 19978 961 1 26 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.560 0.383 19978 962 1 26 . 1 1 20 20 CYS H H 20 7.423 7.423 7.675 -0.252 19978 963 1 27 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.863 0.119 19978 964 1 27 . 1 1 2 2 ILE H H 2 8.556 8.556 8.024 0.532 19978 965 1 27 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.836 -0.179 19978 966 1 27 . 1 1 3 3 VAL H H 3 8.158 8.158 8.074 0.084 19978 967 1 27 . 1 1 4 4 GLU HA H 4 4.230 4.230 4.106 0.124 19978 968 1 27 . 1 1 4 4 GLU H H 4 8.093 8.093 8.479 -0.386 19978 969 1 27 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.283 -0.168 19978 970 1 27 . 1 1 5 5 GLN H H 5 8.265 8.265 7.983 0.282 19978 971 1 27 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.695 0.279 19978 972 1 27 . 1 1 6 6 CYS H H 6 8.320 8.320 8.082 0.238 19978 973 1 27 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.402 0.480 19978 974 1 27 . 1 1 7 7 CYS H H 7 8.255 8.255 7.889 0.365 19978 975 1 27 . 1 1 8 8 THR HA H 8 4.136 4.136 4.473 -0.337 19978 976 1 27 . 1 1 8 8 THR H H 8 8.250 8.250 7.588 0.662 19978 977 1 27 . 1 1 9 9 SER HA H 9 4.769 4.769 4.223 0.546 19978 978 1 27 . 1 1 9 9 SER H H 9 7.478 7.478 8.245 -0.767 19978 979 1 27 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.242 0.122 19978 980 1 27 . 1 1 10 10 ILE H H 10 7.915 7.915 8.152 -0.237 19978 981 1 27 . 1 1 11 11 CYS H H 11 9.622 9.622 8.718 0.904 19978 982 1 27 . 1 1 12 12 SER HA H 12 4.607 4.607 4.817 -0.210 19978 983 1 27 . 1 1 12 12 SER H H 12 8.822 8.822 8.941 -0.119 19978 984 1 27 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.022 -0.135 19978 985 1 27 . 1 1 13 13 LEU H H 13 8.677 8.677 8.836 -0.159 19978 986 1 27 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.424 -0.244 19978 987 1 27 . 1 1 14 14 TYR H H 14 7.545 7.545 8.431 -0.886 19978 988 1 27 . 1 1 15 15 GLN HA H 15 4.005 4.005 3.948 0.057 19978 989 1 27 . 1 1 15 15 GLN H H 15 7.578 7.578 7.867 -0.289 19978 990 1 27 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.234 -0.041 19978 991 1 27 . 1 1 16 16 LEU H H 16 8.122 8.122 8.283 -0.161 19978 992 1 27 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.905 0.304 19978 993 1 27 . 1 1 17 17 GLU H H 17 8.102 8.102 8.227 -0.125 19978 994 1 27 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.359 0.135 19978 995 1 27 . 1 1 18 18 ASN H H 18 7.427 7.427 8.168 -0.741 19978 996 1 27 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.677 -0.234 19978 997 1 27 . 1 1 19 19 TYR H H 19 7.945 7.945 8.040 -0.095 19978 998 1 27 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.543 0.400 19978 999 1 27 . 1 1 20 20 CYS H H 20 7.423 7.423 8.072 -0.649 19978 1000 1 28 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.888 0.094 19978 1001 1 28 . 1 1 2 2 ILE H H 2 8.556 8.556 8.463 0.093 19978 1002 1 28 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.870 -0.213 19978 1003 1 28 . 1 1 3 3 VAL H H 3 8.158 8.158 7.992 0.166 19978 1004 1 28 . 1 1 4 4 GLU HA H 4 4.230 4.230 4.100 0.130 19978 1005 1 28 . 1 1 4 4 GLU H H 4 8.093 8.093 8.402 -0.309 19978 1006 1 28 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.306 -0.191 19978 1007 1 28 . 1 1 5 5 GLN H H 5 8.265 8.265 8.384 -0.119 19978 1008 1 28 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.647 0.327 19978 1009 1 28 . 1 1 6 6 CYS H H 6 8.320 8.320 8.131 0.189 19978 1010 1 28 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.445 0.437 19978 1011 1 28 . 1 1 7 7 CYS H H 7 8.255 8.255 8.071 0.184 19978 1012 1 28 . 1 1 8 8 THR HA H 8 4.136 4.136 4.087 0.049 19978 1013 1 28 . 1 1 8 8 THR H H 8 8.250 8.250 8.019 0.231 19978 1014 1 28 . 1 1 9 9 SER HA H 9 4.769 4.769 4.603 0.166 19978 1015 1 28 . 1 1 9 9 SER H H 9 7.478 7.478 7.428 0.050 19978 1016 1 28 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.154 0.210 19978 1017 1 28 . 1 1 10 10 ILE H H 10 7.915 7.915 8.151 -0.236 19978 1018 1 28 . 1 1 11 11 CYS H H 11 9.622 9.622 8.554 1.068 19978 1019 1 28 . 1 1 12 12 SER HA H 12 4.607 4.607 4.693 -0.086 19978 1020 1 28 . 1 1 12 12 SER H H 12 8.822 8.822 8.152 0.670 19978 1021 1 28 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.123 -0.236 19978 1022 1 28 . 1 1 13 13 LEU H H 13 8.677 8.677 8.928 -0.251 19978 1023 1 28 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.373 -0.193 19978 1024 1 28 . 1 1 14 14 TYR H H 14 7.545 7.545 8.199 -0.654 19978 1025 1 28 . 1 1 15 15 GLN HA H 15 4.005 4.005 3.889 0.116 19978 1026 1 28 . 1 1 15 15 GLN H H 15 7.578 7.578 7.643 -0.065 19978 1027 1 28 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.129 0.064 19978 1028 1 28 . 1 1 16 16 LEU H H 16 8.122 8.122 8.727 -0.605 19978 1029 1 28 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.897 0.312 19978 1030 1 28 . 1 1 17 17 GLU H H 17 8.102 8.102 7.989 0.113 19978 1031 1 28 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.486 0.008 19978 1032 1 28 . 1 1 18 18 ASN H H 18 7.427 7.427 7.901 -0.474 19978 1033 1 28 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.600 -0.157 19978 1034 1 28 . 1 1 19 19 TYR H H 19 7.945 7.945 8.030 -0.085 19978 1035 1 28 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.862 0.081 19978 1036 1 28 . 1 1 20 20 CYS H H 20 7.423 7.423 7.671 -0.248 19978 1037 1 29 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.805 0.177 19978 1038 1 29 . 1 1 2 2 ILE H H 2 8.556 8.556 8.207 0.349 19978 1039 1 29 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.913 -0.256 19978 1040 1 29 . 1 1 3 3 VAL H H 3 8.158 8.158 8.176 -0.018 19978 1041 1 29 . 1 1 4 4 GLU HA H 4 4.230 4.230 4.018 0.212 19978 1042 1 29 . 1 1 4 4 GLU H H 4 8.093 8.093 8.513 -0.420 19978 1043 1 29 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.080 0.035 19978 1044 1 29 . 1 1 5 5 GLN H H 5 8.265 8.265 8.185 0.080 19978 1045 1 29 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.663 0.311 19978 1046 1 29 . 1 1 6 6 CYS H H 6 8.320 8.320 8.184 0.136 19978 1047 1 29 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.233 0.649 19978 1048 1 29 . 1 1 7 7 CYS H H 7 8.255 8.255 8.254 0.001 19978 1049 1 29 . 1 1 8 8 THR HA H 8 4.136 4.136 4.352 -0.216 19978 1050 1 29 . 1 1 8 8 THR H H 8 8.250 8.250 7.874 0.376 19978 1051 1 29 . 1 1 9 9 SER HA H 9 4.769 4.769 4.712 0.057 19978 1052 1 29 . 1 1 9 9 SER H H 9 7.478 7.478 8.019 -0.541 19978 1053 1 29 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.057 0.307 19978 1054 1 29 . 1 1 10 10 ILE H H 10 7.915 7.915 8.287 -0.372 19978 1055 1 29 . 1 1 11 11 CYS H H 11 9.622 9.622 8.515 1.107 19978 1056 1 29 . 1 1 12 12 SER HA H 12 4.607 4.607 4.779 -0.172 19978 1057 1 29 . 1 1 12 12 SER H H 12 8.822 8.822 9.259 -0.437 19978 1058 1 29 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.114 -0.227 19978 1059 1 29 . 1 1 13 13 LEU H H 13 8.677 8.677 8.785 -0.108 19978 1060 1 29 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.461 -0.281 19978 1061 1 29 . 1 1 14 14 TYR H H 14 7.545 7.545 8.192 -0.647 19978 1062 1 29 . 1 1 15 15 GLN HA H 15 4.005 4.005 3.942 0.063 19978 1063 1 29 . 1 1 15 15 GLN H H 15 7.578 7.578 7.796 -0.218 19978 1064 1 29 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.080 0.113 19978 1065 1 29 . 1 1 16 16 LEU H H 16 8.122 8.122 8.617 -0.495 19978 1066 1 29 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.976 0.233 19978 1067 1 29 . 1 1 17 17 GLU H H 17 8.102 8.102 7.902 0.200 19978 1068 1 29 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.440 0.054 19978 1069 1 29 . 1 1 18 18 ASN H H 18 7.427 7.427 7.583 -0.156 19978 1070 1 29 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.392 0.051 19978 1071 1 29 . 1 1 19 19 TYR H H 19 7.945 7.945 7.228 0.717 19978 1072 1 29 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.611 0.332 19978 1073 1 29 . 1 1 20 20 CYS H H 20 7.423 7.423 7.661 -0.238 19978 1074 1 30 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.122 0.860 19978 1075 1 30 . 1 1 2 2 ILE H H 2 8.556 8.556 7.964 0.592 19978 1076 1 30 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.917 -0.260 19978 1077 1 30 . 1 1 3 3 VAL H H 3 8.158 8.158 7.870 0.288 19978 1078 1 30 . 1 1 4 4 GLU HA H 4 4.230 4.230 4.117 0.113 19978 1079 1 30 . 1 1 4 4 GLU H H 4 8.093 8.093 8.405 -0.312 19978 1080 1 30 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.182 -0.067 19978 1081 1 30 . 1 1 5 5 GLN H H 5 8.265 8.265 8.123 0.142 19978 1082 1 30 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.606 0.368 19978 1083 1 30 . 1 1 6 6 CYS H H 6 8.320 8.320 8.220 0.100 19978 1084 1 30 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.391 0.491 19978 1085 1 30 . 1 1 7 7 CYS H H 7 8.255 8.255 8.155 0.100 19978 1086 1 30 . 1 1 8 8 THR HA H 8 4.136 4.136 4.522 -0.386 19978 1087 1 30 . 1 1 8 8 THR H H 8 8.250 8.250 7.822 0.428 19978 1088 1 30 . 1 1 9 9 SER HA H 9 4.769 4.769 4.711 0.058 19978 1089 1 30 . 1 1 9 9 SER H H 9 7.478 7.478 7.472 0.006 19978 1090 1 30 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.236 0.128 19978 1091 1 30 . 1 1 10 10 ILE H H 10 7.915 7.915 8.344 -0.429 19978 1092 1 30 . 1 1 11 11 CYS H H 11 9.622 9.622 8.956 0.666 19978 1093 1 30 . 1 1 12 12 SER HA H 12 4.607 4.607 4.411 0.196 19978 1094 1 30 . 1 1 12 12 SER H H 12 8.822 8.822 8.867 -0.045 19978 1095 1 30 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.112 -0.225 19978 1096 1 30 . 1 1 13 13 LEU H H 13 8.677 8.677 8.850 -0.173 19978 1097 1 30 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.061 0.119 19978 1098 1 30 . 1 1 14 14 TYR H H 14 7.545 7.545 8.353 -0.808 19978 1099 1 30 . 1 1 15 15 GLN HA H 15 4.005 4.005 4.086 -0.081 19978 1100 1 30 . 1 1 15 15 GLN H H 15 7.578 7.578 7.739 -0.161 19978 1101 1 30 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.221 -0.028 19978 1102 1 30 . 1 1 16 16 LEU H H 16 8.122 8.122 8.535 -0.413 19978 1103 1 30 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.900 0.309 19978 1104 1 30 . 1 1 17 17 GLU H H 17 8.102 8.102 8.084 0.018 19978 1105 1 30 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.336 0.158 19978 1106 1 30 . 1 1 18 18 ASN H H 18 7.427 7.427 7.984 -0.557 19978 1107 1 30 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.594 -0.151 19978 1108 1 30 . 1 1 19 19 TYR H H 19 7.945 7.945 7.772 0.173 19978 1109 1 30 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.565 0.378 19978 1110 1 30 . 1 1 20 20 CYS H H 20 7.423 7.423 7.807 -0.384 19978 1111 1 31 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.919 0.063 19978 1112 1 31 . 1 1 2 2 ILE H H 2 8.556 8.556 8.333 0.223 19978 1113 1 31 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.771 -0.114 19978 1114 1 31 . 1 1 3 3 VAL H H 3 8.158 8.158 7.983 0.175 19978 1115 1 31 . 1 1 4 4 GLU HA H 4 4.230 4.230 3.978 0.252 19978 1116 1 31 . 1 1 4 4 GLU H H 4 8.093 8.093 7.576 0.517 19978 1117 1 31 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.034 0.081 19978 1118 1 31 . 1 1 5 5 GLN H H 5 8.265 8.265 8.179 0.086 19978 1119 1 31 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.288 0.686 19978 1120 1 31 . 1 1 6 6 CYS H H 6 8.320 8.320 8.133 0.187 19978 1121 1 31 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.280 0.602 19978 1122 1 31 . 1 1 7 7 CYS H H 7 8.255 8.255 7.945 0.310 19978 1123 1 31 . 1 1 8 8 THR HA H 8 4.136 4.136 4.198 -0.062 19978 1124 1 31 . 1 1 8 8 THR H H 8 8.250 8.250 8.272 -0.022 19978 1125 1 31 . 1 1 9 9 SER HA H 9 4.769 4.769 4.691 0.078 19978 1126 1 31 . 1 1 9 9 SER H H 9 7.478 7.478 7.470 0.008 19978 1127 1 31 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.320 0.044 19978 1128 1 31 . 1 1 10 10 ILE H H 10 7.915 7.915 8.134 -0.219 19978 1129 1 31 . 1 1 11 11 CYS H H 11 9.622 9.622 8.651 0.971 19978 1130 1 31 . 1 1 12 12 SER HA H 12 4.607 4.607 4.846 -0.239 19978 1131 1 31 . 1 1 12 12 SER H H 12 8.822 8.822 8.552 0.270 19978 1132 1 31 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.106 -0.219 19978 1133 1 31 . 1 1 13 13 LEU H H 13 8.677 8.677 8.778 -0.101 19978 1134 1 31 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.405 -0.225 19978 1135 1 31 . 1 1 14 14 TYR H H 14 7.545 7.545 8.331 -0.786 19978 1136 1 31 . 1 1 15 15 GLN HA H 15 4.005 4.005 3.666 0.339 19978 1137 1 31 . 1 1 15 15 GLN H H 15 7.578 7.578 7.648 -0.070 19978 1138 1 31 . 1 1 16 16 LEU HA H 16 4.193 4.193 3.786 0.407 19978 1139 1 31 . 1 1 16 16 LEU H H 16 8.122 8.122 8.171 -0.049 19978 1140 1 31 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.846 0.363 19978 1141 1 31 . 1 1 17 17 GLU H H 17 8.102 8.102 8.044 0.058 19978 1142 1 31 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.447 0.047 19978 1143 1 31 . 1 1 18 18 ASN H H 18 7.427 7.427 7.838 -0.411 19978 1144 1 31 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.640 -0.197 19978 1145 1 31 . 1 1 19 19 TYR H H 19 7.945 7.945 7.580 0.365 19978 1146 1 31 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.710 0.233 19978 1147 1 31 . 1 1 20 20 CYS H H 20 7.423 7.423 7.889 -0.466 19978 1148 1 32 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.902 0.080 19978 1149 1 32 . 1 1 2 2 ILE H H 2 8.556 8.556 8.436 0.120 19978 1150 1 32 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.706 -0.049 19978 1151 1 32 . 1 1 3 3 VAL H H 3 8.158 8.158 8.066 0.092 19978 1152 1 32 . 1 1 4 4 GLU HA H 4 4.230 4.230 3.926 0.304 19978 1153 1 32 . 1 1 4 4 GLU H H 4 8.093 8.093 8.604 -0.511 19978 1154 1 32 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.082 0.033 19978 1155 1 32 . 1 1 5 5 GLN H H 5 8.265 8.265 8.272 -0.007 19978 1156 1 32 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.338 0.636 19978 1157 1 32 . 1 1 6 6 CYS H H 6 8.320 8.320 8.141 0.179 19978 1158 1 32 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.267 0.615 19978 1159 1 32 . 1 1 7 7 CYS H H 7 8.255 8.255 8.007 0.248 19978 1160 1 32 . 1 1 8 8 THR HA H 8 4.136 4.136 4.244 -0.108 19978 1161 1 32 . 1 1 8 8 THR H H 8 8.250 8.250 8.147 0.103 19978 1162 1 32 . 1 1 9 9 SER HA H 9 4.769 4.769 4.688 0.081 19978 1163 1 32 . 1 1 9 9 SER H H 9 7.478 7.478 8.189 -0.711 19978 1164 1 32 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.367 -0.003 19978 1165 1 32 . 1 1 10 10 ILE H H 10 7.915 7.915 8.229 -0.314 19978 1166 1 32 . 1 1 11 11 CYS H H 11 9.622 9.622 8.277 1.345 19978 1167 1 32 . 1 1 12 12 SER HA H 12 4.607 4.607 4.884 -0.277 19978 1168 1 32 . 1 1 12 12 SER H H 12 8.822 8.822 8.585 0.237 19978 1169 1 32 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.090 -0.203 19978 1170 1 32 . 1 1 13 13 LEU H H 13 8.677 8.677 8.909 -0.232 19978 1171 1 32 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.398 -0.218 19978 1172 1 32 . 1 1 14 14 TYR H H 14 7.545 7.545 8.322 -0.777 19978 1173 1 32 . 1 1 15 15 GLN HA H 15 4.005 4.005 4.114 -0.109 19978 1174 1 32 . 1 1 15 15 GLN H H 15 7.578 7.578 7.811 -0.233 19978 1175 1 32 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.208 -0.015 19978 1176 1 32 . 1 1 16 16 LEU H H 16 8.122 8.122 8.191 -0.069 19978 1177 1 32 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.882 0.327 19978 1178 1 32 . 1 1 17 17 GLU H H 17 8.102 8.102 7.911 0.191 19978 1179 1 32 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.378 0.116 19978 1180 1 32 . 1 1 18 18 ASN H H 18 7.427 7.427 8.052 -0.625 19978 1181 1 32 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.508 -0.065 19978 1182 1 32 . 1 1 19 19 TYR H H 19 7.945 7.945 7.620 0.325 19978 1183 1 32 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.806 0.137 19978 1184 1 32 . 1 1 20 20 CYS H H 20 7.423 7.423 7.799 -0.376 19978 1185 1 33 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.720 0.262 19978 1186 1 33 . 1 1 2 2 ILE H H 2 8.556 8.556 8.295 0.261 19978 1187 1 33 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.715 -0.058 19978 1188 1 33 . 1 1 3 3 VAL H H 3 8.158 8.158 8.095 0.063 19978 1189 1 33 . 1 1 4 4 GLU HA H 4 4.230 4.230 3.993 0.237 19978 1190 1 33 . 1 1 4 4 GLU H H 4 8.093 8.093 7.699 0.394 19978 1191 1 33 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.198 -0.083 19978 1192 1 33 . 1 1 5 5 GLN H H 5 8.265 8.265 8.210 0.055 19978 1193 1 33 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.778 0.196 19978 1194 1 33 . 1 1 6 6 CYS H H 6 8.320 8.320 8.225 0.095 19978 1195 1 33 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.407 0.475 19978 1196 1 33 . 1 1 7 7 CYS H H 7 8.255 8.255 8.052 0.203 19978 1197 1 33 . 1 1 8 8 THR HA H 8 4.136 4.136 4.280 -0.144 19978 1198 1 33 . 1 1 8 8 THR H H 8 8.250 8.250 8.469 -0.219 19978 1199 1 33 . 1 1 9 9 SER HA H 9 4.769 4.769 4.632 0.137 19978 1200 1 33 . 1 1 9 9 SER H H 9 7.478 7.478 7.554 -0.076 19978 1201 1 33 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.142 0.222 19978 1202 1 33 . 1 1 10 10 ILE H H 10 7.915 7.915 8.230 -0.315 19978 1203 1 33 . 1 1 11 11 CYS H H 11 9.622 9.622 8.329 1.293 19978 1204 1 33 . 1 1 12 12 SER HA H 12 4.607 4.607 4.720 -0.113 19978 1205 1 33 . 1 1 12 12 SER H H 12 8.822 8.822 9.276 -0.454 19978 1206 1 33 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.124 -0.237 19978 1207 1 33 . 1 1 13 13 LEU H H 13 8.677 8.677 8.818 -0.141 19978 1208 1 33 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.596 -0.416 19978 1209 1 33 . 1 1 14 14 TYR H H 14 7.545 7.545 8.223 -0.678 19978 1210 1 33 . 1 1 15 15 GLN HA H 15 4.005 4.005 4.122 -0.117 19978 1211 1 33 . 1 1 15 15 GLN H H 15 7.578 7.578 7.930 -0.352 19978 1212 1 33 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.211 -0.018 19978 1213 1 33 . 1 1 16 16 LEU H H 16 8.122 8.122 8.884 -0.762 19978 1214 1 33 . 1 1 17 17 GLU HA H 17 4.209 4.209 4.019 0.190 19978 1215 1 33 . 1 1 17 17 GLU H H 17 8.102 8.102 8.319 -0.217 19978 1216 1 33 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.519 -0.025 19978 1217 1 33 . 1 1 18 18 ASN H H 18 7.427 7.427 8.038 -0.611 19978 1218 1 33 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.541 -0.098 19978 1219 1 33 . 1 1 19 19 TYR H H 19 7.945 7.945 7.590 0.355 19978 1220 1 33 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.533 0.410 19978 1221 1 33 . 1 1 20 20 CYS H H 20 7.423 7.423 7.644 -0.221 19978 1222 1 34 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.950 0.032 19978 1223 1 34 . 1 1 2 2 ILE H H 2 8.556 8.556 8.219 0.337 19978 1224 1 34 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.668 -0.011 19978 1225 1 34 . 1 1 3 3 VAL H H 3 8.158 8.158 8.209 -0.051 19978 1226 1 34 . 1 1 4 4 GLU HA H 4 4.230 4.230 3.936 0.294 19978 1227 1 34 . 1 1 4 4 GLU H H 4 8.093 8.093 7.652 0.441 19978 1228 1 34 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.065 0.050 19978 1229 1 34 . 1 1 5 5 GLN H H 5 8.265 8.265 7.898 0.367 19978 1230 1 34 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.291 0.683 19978 1231 1 34 . 1 1 6 6 CYS H H 6 8.320 8.320 8.157 0.163 19978 1232 1 34 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.292 0.590 19978 1233 1 34 . 1 1 7 7 CYS H H 7 8.255 8.255 8.018 0.237 19978 1234 1 34 . 1 1 8 8 THR HA H 8 4.136 4.136 4.248 -0.112 19978 1235 1 34 . 1 1 8 8 THR H H 8 8.250 8.250 8.164 0.086 19978 1236 1 34 . 1 1 9 9 SER HA H 9 4.769 4.769 4.706 0.063 19978 1237 1 34 . 1 1 9 9 SER H H 9 7.478 7.478 8.065 -0.587 19978 1238 1 34 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.256 0.108 19978 1239 1 34 . 1 1 10 10 ILE H H 10 7.915 7.915 8.228 -0.313 19978 1240 1 34 . 1 1 11 11 CYS H H 11 9.622 9.622 8.569 1.053 19978 1241 1 34 . 1 1 12 12 SER HA H 12 4.607 4.607 4.904 -0.297 19978 1242 1 34 . 1 1 12 12 SER H H 12 8.822 8.822 8.571 0.251 19978 1243 1 34 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.058 -0.171 19978 1244 1 34 . 1 1 13 13 LEU H H 13 8.677 8.677 8.838 -0.161 19978 1245 1 34 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.329 -0.149 19978 1246 1 34 . 1 1 14 14 TYR H H 14 7.545 7.545 8.233 -0.688 19978 1247 1 34 . 1 1 15 15 GLN HA H 15 4.005 4.005 3.927 0.078 19978 1248 1 34 . 1 1 15 15 GLN H H 15 7.578 7.578 7.811 -0.233 19978 1249 1 34 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.082 0.111 19978 1250 1 34 . 1 1 16 16 LEU H H 16 8.122 8.122 8.467 -0.345 19978 1251 1 34 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.866 0.343 19978 1252 1 34 . 1 1 17 17 GLU H H 17 8.102 8.102 7.961 0.141 19978 1253 1 34 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.392 0.102 19978 1254 1 34 . 1 1 18 18 ASN H H 18 7.427 7.427 7.362 0.064 19978 1255 1 34 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.602 -0.159 19978 1256 1 34 . 1 1 19 19 TYR H H 19 7.945 7.945 7.364 0.581 19978 1257 1 34 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.840 0.103 19978 1258 1 34 . 1 1 20 20 CYS H H 20 7.423 7.423 7.945 -0.522 19978 1259 1 35 . 1 1 2 2 ILE HA H 2 3.982 3.982 3.836 0.146 19978 1260 1 35 . 1 1 2 2 ILE H H 2 8.556 8.556 7.960 0.596 19978 1261 1 35 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.894 -0.237 19978 1262 1 35 . 1 1 3 3 VAL H H 3 8.158 8.158 7.872 0.286 19978 1263 1 35 . 1 1 4 4 GLU HA H 4 4.230 4.230 4.025 0.205 19978 1264 1 35 . 1 1 4 4 GLU H H 4 8.093 8.093 8.281 -0.188 19978 1265 1 35 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.308 -0.193 19978 1266 1 35 . 1 1 5 5 GLN H H 5 8.265 8.265 7.988 0.277 19978 1267 1 35 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.783 0.191 19978 1268 1 35 . 1 1 6 6 CYS H H 6 8.320 8.320 7.994 0.326 19978 1269 1 35 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.318 0.564 19978 1270 1 35 . 1 1 7 7 CYS H H 7 8.255 8.255 7.987 0.268 19978 1271 1 35 . 1 1 8 8 THR HA H 8 4.136 4.136 4.424 -0.288 19978 1272 1 35 . 1 1 8 8 THR H H 8 8.250 8.250 7.736 0.514 19978 1273 1 35 . 1 1 9 9 SER HA H 9 4.769 4.769 4.192 0.577 19978 1274 1 35 . 1 1 9 9 SER H H 9 7.478 7.478 8.372 -0.894 19978 1275 1 35 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.285 0.079 19978 1276 1 35 . 1 1 10 10 ILE H H 10 7.915 7.915 8.134 -0.219 19978 1277 1 35 . 1 1 11 11 CYS H H 11 9.622 9.622 8.739 0.883 19978 1278 1 35 . 1 1 12 12 SER HA H 12 4.607 4.607 4.846 -0.239 19978 1279 1 35 . 1 1 12 12 SER H H 12 8.822 8.822 9.318 -0.496 19978 1280 1 35 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.191 -0.304 19978 1281 1 35 . 1 1 13 13 LEU H H 13 8.677 8.677 8.856 -0.179 19978 1282 1 35 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.128 0.052 19978 1283 1 35 . 1 1 14 14 TYR H H 14 7.545 7.545 8.365 -0.820 19978 1284 1 35 . 1 1 15 15 GLN HA H 15 4.005 4.005 3.816 0.189 19978 1285 1 35 . 1 1 15 15 GLN H H 15 7.578 7.578 7.622 -0.044 19978 1286 1 35 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.089 0.104 19978 1287 1 35 . 1 1 16 16 LEU H H 16 8.122 8.122 8.402 -0.280 19978 1288 1 35 . 1 1 17 17 GLU HA H 17 4.209 4.209 4.006 0.203 19978 1289 1 35 . 1 1 17 17 GLU H H 17 8.102 8.102 7.932 0.170 19978 1290 1 35 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.377 0.117 19978 1291 1 35 . 1 1 18 18 ASN H H 18 7.427 7.427 7.540 -0.113 19978 1292 1 35 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.598 -0.155 19978 1293 1 35 . 1 1 19 19 TYR H H 19 7.945 7.945 7.719 0.226 19978 1294 1 35 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.371 0.572 19978 1295 1 35 . 1 1 20 20 CYS H H 20 7.423 7.423 8.100 -0.677 19978 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 19978 2 1 1 "Average Difference" HA 18 0.254 -0.095 0.243 19978 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19978 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 19978 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 19978 6 1 1 "Average Difference" HN 19 0.396 0.038 0.405 19978 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 19978 8 1 2 "Average Difference" HA 18 0.304 -0.115 0.289 19978 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19978 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 19978 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 19978 12 1 2 "Average Difference" HN 19 0.455 0.023 0.467 19978 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 19978 14 1 3 "Average Difference" HA 18 0.313 -0.181 0.263 19978 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19978 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 19978 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 19978 18 1 3 "Average Difference" HN 19 0.405 0.011 0.416 19978 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 19978 20 1 4 "Average Difference" HA 18 0.256 -0.080 0.250 19978 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19978 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 19978 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 19978 24 1 4 "Average Difference" HN 19 0.418 0.088 0.420 19978 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 19978 26 1 5 "Average Difference" HA 18 0.303 -0.122 0.286 19978 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19978 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 19978 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 19978 30 1 5 "Average Difference" HN 19 0.441 0.049 0.451 19978 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 19978 32 1 6 "Average Difference" HA 18 0.212 -0.066 0.207 19978 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19978 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 19978 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 19978 36 1 6 "Average Difference" HN 19 0.473 0.036 0.485 19978 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 19978 38 1 7 "Average Difference" HA 18 0.293 -0.110 0.279 19978 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19978 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 19978 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 19978 42 1 7 "Average Difference" HN 19 0.469 0.086 0.474 19978 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 19978 44 1 8 "Average Difference" HA 18 0.294 -0.093 0.287 19978 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19978 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 19978 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 19978 48 1 8 "Average Difference" HN 19 0.400 0.052 0.407 19978 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 19978 50 1 9 "Average Difference" HA 18 0.311 -0.104 0.302 19978 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19978 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 19978 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 19978 54 1 9 "Average Difference" HN 19 0.485 0.106 0.486 19978 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 19978 56 1 10 "Average Difference" HA 18 0.245 -0.111 0.225 19978 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19978 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 19978 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 19978 60 1 10 "Average Difference" HN 19 0.402 0.057 0.409 19978 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 19978 62 1 11 "Average Difference" HA 18 0.323 -0.171 0.282 19978 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 19978 64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 19978 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 19978 66 1 11 "Average Difference" HN 19 0.508 0.049 0.520 19978 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 19978 68 1 12 "Average Difference" HA 18 0.238 -0.060 0.237 19978 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 19978 70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 19978 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 19978 72 1 12 "Average Difference" HN 19 0.394 -0.024 0.404 19978 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 19978 74 1 13 "Average Difference" HA 18 0.246 -0.043 0.249 19978 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 19978 76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 19978 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 19978 78 1 13 "Average Difference" HN 19 0.444 -0.098 0.445 19978 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 19978 80 1 14 "Average Difference" HA 18 0.308 -0.118 0.293 19978 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 19978 82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 19978 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 19978 84 1 14 "Average Difference" HN 19 0.434 0.034 0.444 19978 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 19978 86 1 15 "Average Difference" HA 18 0.367 -0.053 0.374 19978 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 19978 88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 19978 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 19978 90 1 15 "Average Difference" HN 19 0.460 -0.040 0.471 19978 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 19978 92 1 16 "Average Difference" HA 18 0.293 -0.097 0.284 19978 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 19978 94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 19978 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 19978 96 1 16 "Average Difference" HN 19 0.430 -0.035 0.440 19978 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 19978 98 1 17 "Average Difference" HA 18 0.298 -0.105 0.287 19978 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 19978 100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 19978 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 19978 102 1 17 "Average Difference" HN 19 0.482 0.063 0.491 19978 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 19978 104 1 18 "Average Difference" HA 18 0.266 -0.090 0.257 19978 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 19978 106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 19978 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 19978 108 1 18 "Average Difference" HN 19 0.466 0.023 0.478 19978 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 19978 110 1 19 "Average Difference" HA 18 0.281 -0.101 0.270 19978 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 19978 112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 19978 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 19978 114 1 19 "Average Difference" HN 19 0.395 0.037 0.404 19978 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 19978 116 1 20 "Average Difference" HA 18 0.221 -0.040 0.224 19978 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 19978 118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 19978 119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 19978 120 1 20 "Average Difference" HN 19 0.521 0.014 0.535 19978 121 1 21 "Average Difference" N 0 0.000 0.000 0.000 19978 122 1 21 "Average Difference" HA 18 0.204 -0.037 0.207 19978 123 1 21 "Average Difference" C 0 0.000 0.000 0.000 19978 124 1 21 "Average Difference" CA 0 0.000 0.000 0.000 19978 125 1 21 "Average Difference" CB 0 0.000 0.000 0.000 19978 126 1 21 "Average Difference" HN 19 0.446 0.027 0.457 19978 127 1 22 "Average Difference" N 0 0.000 0.000 0.000 19978 128 1 22 "Average Difference" HA 18 0.273 -0.107 0.258 19978 129 1 22 "Average Difference" C 0 0.000 0.000 0.000 19978 130 1 22 "Average Difference" CA 0 0.000 0.000 0.000 19978 131 1 22 "Average Difference" CB 0 0.000 0.000 0.000 19978 132 1 22 "Average Difference" HN 19 0.394 -0.048 0.401 19978 133 1 23 "Average Difference" N 0 0.000 0.000 0.000 19978 134 1 23 "Average Difference" HA 18 0.228 -0.019 0.233 19978 135 1 23 "Average Difference" C 0 0.000 0.000 0.000 19978 136 1 23 "Average Difference" CA 0 0.000 0.000 0.000 19978 137 1 23 "Average Difference" CB 0 0.000 0.000 0.000 19978 138 1 23 "Average Difference" HN 19 0.442 0.053 0.451 19978 139 1 24 "Average Difference" N 0 0.000 0.000 0.000 19978 140 1 24 "Average Difference" HA 18 0.273 -0.096 0.263 19978 141 1 24 "Average Difference" C 0 0.000 0.000 0.000 19978 142 1 24 "Average Difference" CA 0 0.000 0.000 0.000 19978 143 1 24 "Average Difference" CB 0 0.000 0.000 0.000 19978 144 1 24 "Average Difference" HN 19 0.525 0.044 0.537 19978 145 1 25 "Average Difference" N 0 0.000 0.000 0.000 19978 146 1 25 "Average Difference" HA 18 0.219 -0.084 0.208 19978 147 1 25 "Average Difference" C 0 0.000 0.000 0.000 19978 148 1 25 "Average Difference" CA 0 0.000 0.000 0.000 19978 149 1 25 "Average Difference" CB 0 0.000 0.000 0.000 19978 150 1 25 "Average Difference" HN 19 0.362 0.052 0.368 19978 151 1 26 "Average Difference" N 0 0.000 0.000 0.000 19978 152 1 26 "Average Difference" HA 18 0.264 -0.128 0.237 19978 153 1 26 "Average Difference" C 0 0.000 0.000 0.000 19978 154 1 26 "Average Difference" CA 0 0.000 0.000 0.000 19978 155 1 26 "Average Difference" CB 0 0.000 0.000 0.000 19978 156 1 26 "Average Difference" HN 19 0.500 0.088 0.506 19978 157 1 27 "Average Difference" N 0 0.000 0.000 0.000 19978 158 1 27 "Average Difference" HA 18 0.266 -0.057 0.268 19978 159 1 27 "Average Difference" C 0 0.000 0.000 0.000 19978 160 1 27 "Average Difference" CA 0 0.000 0.000 0.000 19978 161 1 27 "Average Difference" CB 0 0.000 0.000 0.000 19978 162 1 27 "Average Difference" HN 19 0.489 0.081 0.495 19978 163 1 28 "Average Difference" N 0 0.000 0.000 0.000 19978 164 1 28 "Average Difference" HA 18 0.201 -0.051 0.200 19978 165 1 28 "Average Difference" C 0 0.000 0.000 0.000 19978 166 1 28 "Average Difference" CA 0 0.000 0.000 0.000 19978 167 1 28 "Average Difference" CB 0 0.000 0.000 0.000 19978 168 1 28 "Average Difference" HN 19 0.403 0.015 0.414 19978 169 1 29 "Average Difference" N 0 0.000 0.000 0.000 19978 170 1 29 "Average Difference" HA 18 0.253 -0.080 0.247 19978 171 1 29 "Average Difference" C 0 0.000 0.000 0.000 19978 172 1 29 "Average Difference" CA 0 0.000 0.000 0.000 19978 173 1 29 "Average Difference" CB 0 0.000 0.000 0.000 19978 174 1 29 "Average Difference" HN 19 0.440 0.036 0.450 19978 175 1 30 "Average Difference" N 0 0.000 0.000 0.000 19978 176 1 30 "Average Difference" HA 18 0.313 -0.110 0.302 19978 177 1 30 "Average Difference" C 0 0.000 0.000 0.000 19978 178 1 30 "Average Difference" CA 0 0.000 0.000 0.000 19978 179 1 30 "Average Difference" CB 0 0.000 0.000 0.000 19978 180 1 30 "Average Difference" HN 19 0.380 0.040 0.389 19978 181 1 31 "Average Difference" N 0 0.000 0.000 0.000 19978 182 1 31 "Average Difference" HA 18 0.298 -0.119 0.281 19978 183 1 31 "Average Difference" C 0 0.000 0.000 0.000 19978 184 1 31 "Average Difference" CA 0 0.000 0.000 0.000 19978 185 1 31 "Average Difference" CB 0 0.000 0.000 0.000 19978 186 1 31 "Average Difference" HN 19 0.378 -0.055 0.384 19978 187 1 32 "Average Difference" N 0 0.000 0.000 0.000 19978 188 1 32 "Average Difference" HA 18 0.261 -0.071 0.258 19978 189 1 32 "Average Difference" C 0 0.000 0.000 0.000 19978 190 1 32 "Average Difference" CA 0 0.000 0.000 0.000 19978 191 1 32 "Average Difference" CB 0 0.000 0.000 0.000 19978 192 1 32 "Average Difference" HN 19 0.473 0.053 0.483 19978 193 1 33 "Average Difference" N 0 0.000 0.000 0.000 19978 194 1 33 "Average Difference" HA 18 0.231 -0.046 0.233 19978 195 1 33 "Average Difference" C 0 0.000 0.000 0.000 19978 196 1 33 "Average Difference" CA 0 0.000 0.000 0.000 19978 197 1 33 "Average Difference" CB 0 0.000 0.000 0.000 19978 198 1 33 "Average Difference" HN 19 0.464 0.070 0.471 19978 199 1 34 "Average Difference" N 0 0.000 0.000 0.000 19978 200 1 34 "Average Difference" HA 18 0.264 -0.092 0.255 19978 201 1 34 "Average Difference" C 0 0.000 0.000 0.000 19978 202 1 34 "Average Difference" CA 0 0.000 0.000 0.000 19978 203 1 34 "Average Difference" CB 0 0.000 0.000 0.000 19978 204 1 34 "Average Difference" HN 19 0.427 -0.043 0.436 19978 205 1 35 "Average Difference" N 0 0.000 0.000 0.000 19978 206 1 35 "Average Difference" HA 18 0.292 -0.088 0.287 19978 207 1 35 "Average Difference" C 0 0.000 0.000 0.000 19978 208 1 35 "Average Difference" CA 0 0.000 0.000 0.000 19978 209 1 35 "Average Difference" CB 0 0.000 0.000 0.000 19978 210 1 35 "Average Difference" HN 19 0.470 0.019 0.483 19978 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 19978 _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 ILE HA H 2 3.982 3.982 3.613 0.369 19978 2 1 . 1 1 2 2 ILE H H 2 8.556 8.556 8.163 0.393 19978 3 1 . 1 1 3 3 VAL HA H 3 3.657 3.657 3.759 -0.102 19978 4 1 . 1 1 3 3 VAL H H 3 8.158 8.158 7.987 0.171 19978 5 1 . 1 1 4 4 GLU HA H 4 4.230 4.230 4.033 0.197 19978 6 1 . 1 1 4 4 GLU H H 4 8.093 8.093 8.277 -0.184 19978 7 1 . 1 1 5 5 GLN HA H 5 4.115 4.115 4.192 -0.077 19978 8 1 . 1 1 5 5 GLN H H 5 8.265 8.265 8.072 0.193 19978 9 1 . 1 1 6 6 CYS HA H 6 4.974 4.974 4.568 0.406 19978 10 1 . 1 1 6 6 CYS H H 6 8.320 8.320 8.101 0.219 19978 11 1 . 1 1 7 7 CYS HA H 7 4.882 4.882 4.356 0.526 19978 12 1 . 1 1 7 7 CYS H H 7 8.255 8.255 8.211 0.044 19978 13 1 . 1 1 8 8 THR HA H 8 4.136 4.136 4.343 -0.207 19978 14 1 . 1 1 8 8 THR H H 8 8.250 8.250 7.929 0.321 19978 15 1 . 1 1 9 9 SER HA H 9 4.769 4.769 4.549 0.220 19978 16 1 . 1 1 9 9 SER H H 9 7.478 7.478 7.897 -0.419 19978 17 1 . 1 1 10 10 ILE HA H 10 4.364 4.364 4.232 0.132 19978 18 1 . 1 1 10 10 ILE H H 10 7.915 7.915 8.232 -0.317 19978 19 1 . 1 1 11 11 CYS H H 11 9.622 9.622 8.631 0.991 19978 20 1 . 1 1 12 12 SER HA H 12 4.607 4.607 4.770 -0.163 19978 21 1 . 1 1 12 12 SER H H 12 8.822 8.822 8.779 0.043 19978 22 1 . 1 1 13 13 LEU HA H 13 3.887 3.887 4.085 -0.198 19978 23 1 . 1 1 13 13 LEU H H 13 8.677 8.677 8.842 -0.165 19978 24 1 . 1 1 14 14 TYR HA H 14 4.180 4.180 4.258 -0.078 19978 25 1 . 1 1 14 14 TYR H H 14 7.545 7.545 8.323 -0.778 19978 26 1 . 1 1 15 15 GLN HA H 15 4.005 4.005 3.970 0.035 19978 27 1 . 1 1 15 15 GLN H H 15 7.578 7.578 7.731 -0.153 19978 28 1 . 1 1 16 16 LEU HA H 16 4.193 4.193 4.185 0.008 19978 29 1 . 1 1 16 16 LEU H H 16 8.122 8.122 8.448 -0.326 19978 30 1 . 1 1 17 17 GLU HA H 17 4.209 4.209 3.949 0.260 19978 31 1 . 1 1 17 17 GLU H H 17 8.102 8.102 8.134 -0.032 19978 32 1 . 1 1 18 18 ASN HA H 18 4.494 4.494 4.402 0.092 19978 33 1 . 1 1 18 18 ASN H H 18 7.427 7.427 7.859 -0.432 19978 34 1 . 1 1 19 19 TYR HA H 19 4.443 4.443 4.570 -0.127 19978 35 1 . 1 1 19 19 TYR H H 19 7.945 7.945 7.662 0.283 19978 36 1 . 1 1 20 20 CYS HA H 20 4.943 4.943 4.620 0.323 19978 37 1 . 1 1 20 20 CYS H H 20 7.423 7.423 7.820 -0.397 19978 stop_ save_