data_18925 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18925 _Entry.PDB_ID 2M2P 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 18925 _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 3 3 VAL HA H 3 3.742 3.742 4.074 -0.332 18925 2 1 1 . 1 1 3 3 VAL H H 3 8.235 8.235 8.654 -0.419 18925 3 1 1 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.206 0.000 18925 4 1 1 . 1 1 4 4 GLU H H 4 8.415 8.415 8.475 -0.060 18925 5 1 1 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.015 1.110 18925 6 1 1 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.132 0.768 18925 7 1 1 . 1 1 8 8 THR HA H 8 4.217 4.217 4.267 -0.050 18925 8 1 1 . 1 1 9 9 SER HA H 9 4.702 4.702 4.694 0.008 18925 9 1 1 . 1 1 10 10 ILE HA H 10 4.222 4.222 3.985 0.237 18925 10 1 1 . 1 1 10 10 ILE H H 10 7.901 7.901 8.133 -0.232 18925 11 1 1 . 1 1 12 12 SER HA H 12 4.629 4.629 4.490 0.139 18925 12 1 1 . 1 1 12 12 SER H H 12 8.616 8.616 8.867 -0.251 18925 13 1 1 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.141 -0.144 18925 14 1 1 . 1 1 13 13 LEU H H 13 8.709 8.709 8.853 -0.144 18925 15 1 1 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.289 0.103 18925 16 1 1 . 1 1 14 14 TYR H H 14 7.742 7.742 8.353 -0.611 18925 17 1 1 . 1 1 15 15 GLN HA H 15 4.021 4.021 3.991 0.030 18925 18 1 1 . 1 1 15 15 GLN H H 15 7.606 7.606 7.790 -0.184 18925 19 1 1 . 1 1 16 16 LEU HA H 16 4.215 4.215 4.189 0.026 18925 20 1 1 . 1 1 16 16 LEU H H 16 7.966 7.966 7.714 0.252 18925 21 1 1 . 1 1 17 17 GLU HA H 17 4.145 4.145 3.910 0.235 18925 22 1 1 . 1 1 17 17 GLU H H 17 8.225 8.225 8.445 -0.220 18925 23 1 1 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.206 0.317 18925 24 1 1 . 1 1 18 18 ASN H H 18 7.503 7.503 7.377 0.126 18925 25 1 1 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.570 0.008 18925 26 1 1 . 1 1 19 19 TYR H H 19 7.996 7.996 7.433 0.563 18925 27 1 1 . 1 1 20 20 CYS H H 20 7.606 7.606 7.911 -0.305 18925 28 1 2 . 1 1 3 3 VAL HA H 3 3.742 3.742 3.804 -0.062 18925 29 1 2 . 1 1 3 3 VAL H H 3 8.235 8.235 7.943 0.292 18925 30 1 2 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.165 0.041 18925 31 1 2 . 1 1 4 4 GLU H H 4 8.415 8.415 7.583 0.832 18925 32 1 2 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.623 0.502 18925 33 1 2 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.049 0.851 18925 34 1 2 . 1 1 8 8 THR HA H 8 4.217 4.217 4.215 0.002 18925 35 1 2 . 1 1 9 9 SER HA H 9 4.702 4.702 4.552 0.150 18925 36 1 2 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.091 0.131 18925 37 1 2 . 1 1 10 10 ILE H H 10 7.901 7.901 8.240 -0.339 18925 38 1 2 . 1 1 12 12 SER HA H 12 4.629 4.629 4.804 -0.175 18925 39 1 2 . 1 1 12 12 SER H H 12 8.616 8.616 9.087 -0.471 18925 40 1 2 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.118 -0.121 18925 41 1 2 . 1 1 13 13 LEU H H 13 8.709 8.709 8.717 -0.008 18925 42 1 2 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.042 0.350 18925 43 1 2 . 1 1 14 14 TYR H H 14 7.742 7.742 8.386 -0.644 18925 44 1 2 . 1 1 15 15 GLN HA H 15 4.021 4.021 3.845 0.176 18925 45 1 2 . 1 1 15 15 GLN H H 15 7.606 7.606 7.787 -0.181 18925 46 1 2 . 1 1 16 16 LEU HA H 16 4.215 4.215 4.294 -0.079 18925 47 1 2 . 1 1 16 16 LEU H H 16 7.966 7.966 8.148 -0.182 18925 48 1 2 . 1 1 17 17 GLU HA H 17 4.145 4.145 3.945 0.200 18925 49 1 2 . 1 1 17 17 GLU H H 17 8.225 8.225 8.537 -0.312 18925 50 1 2 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.515 0.008 18925 51 1 2 . 1 1 18 18 ASN H H 18 7.503 7.503 7.384 0.119 18925 52 1 2 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.568 0.010 18925 53 1 2 . 1 1 19 19 TYR H H 19 7.996 7.996 7.692 0.304 18925 54 1 2 . 1 1 20 20 CYS H H 20 7.606 7.606 8.054 -0.448 18925 55 1 3 . 1 1 3 3 VAL HA H 3 3.742 3.742 4.419 -0.677 18925 56 1 3 . 1 1 3 3 VAL H H 3 8.235 8.235 8.186 0.049 18925 57 1 3 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.750 -0.544 18925 58 1 3 . 1 1 4 4 GLU H H 4 8.415 8.415 8.022 0.393 18925 59 1 3 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.595 0.530 18925 60 1 3 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.571 0.329 18925 61 1 3 . 1 1 8 8 THR HA H 8 4.217 4.217 3.977 0.240 18925 62 1 3 . 1 1 9 9 SER HA H 9 4.702 4.702 4.704 -0.002 18925 63 1 3 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.306 -0.084 18925 64 1 3 . 1 1 10 10 ILE H H 10 7.901 7.901 8.320 -0.419 18925 65 1 3 . 1 1 12 12 SER HA H 12 4.629 4.629 4.673 -0.044 18925 66 1 3 . 1 1 12 12 SER H H 12 8.616 8.616 8.821 -0.205 18925 67 1 3 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.131 -0.134 18925 68 1 3 . 1 1 13 13 LEU H H 13 8.709 8.709 8.863 -0.154 18925 69 1 3 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.085 0.307 18925 70 1 3 . 1 1 14 14 TYR H H 14 7.742 7.742 7.795 -0.053 18925 71 1 3 . 1 1 15 15 GLN HA H 15 4.021 4.021 3.642 0.379 18925 72 1 3 . 1 1 15 15 GLN H H 15 7.606 7.606 7.705 -0.099 18925 73 1 3 . 1 1 16 16 LEU HA H 16 4.215 4.215 3.892 0.323 18925 74 1 3 . 1 1 16 16 LEU H H 16 7.966 7.966 7.299 0.667 18925 75 1 3 . 1 1 17 17 GLU HA H 17 4.145 4.145 3.855 0.290 18925 76 1 3 . 1 1 17 17 GLU H H 17 8.225 8.225 8.339 -0.114 18925 77 1 3 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.289 0.234 18925 78 1 3 . 1 1 18 18 ASN H H 18 7.503 7.503 7.586 -0.083 18925 79 1 3 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.368 0.210 18925 80 1 3 . 1 1 19 19 TYR H H 19 7.996 7.996 7.384 0.612 18925 81 1 3 . 1 1 20 20 CYS H H 20 7.606 7.606 7.964 -0.358 18925 82 1 4 . 1 1 3 3 VAL HA H 3 3.742 3.742 4.291 -0.549 18925 83 1 4 . 1 1 3 3 VAL H H 3 8.235 8.235 8.381 -0.146 18925 84 1 4 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.608 -0.402 18925 85 1 4 . 1 1 4 4 GLU H H 4 8.415 8.415 8.004 0.411 18925 86 1 4 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.561 0.564 18925 87 1 4 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.382 0.518 18925 88 1 4 . 1 1 8 8 THR HA H 8 4.217 4.217 4.551 -0.334 18925 89 1 4 . 1 1 9 9 SER HA H 9 4.702 4.702 4.594 0.108 18925 90 1 4 . 1 1 10 10 ILE HA H 10 4.222 4.222 3.925 0.297 18925 91 1 4 . 1 1 10 10 ILE H H 10 7.901 7.901 8.019 -0.118 18925 92 1 4 . 1 1 12 12 SER HA H 12 4.629 4.629 4.838 -0.209 18925 93 1 4 . 1 1 12 12 SER H H 12 8.616 8.616 8.442 0.174 18925 94 1 4 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.045 -0.048 18925 95 1 4 . 1 1 13 13 LEU H H 13 8.709 8.709 8.907 -0.198 18925 96 1 4 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.164 0.228 18925 97 1 4 . 1 1 14 14 TYR H H 14 7.742 7.742 8.231 -0.489 18925 98 1 4 . 1 1 15 15 GLN HA H 15 4.021 4.021 3.906 0.115 18925 99 1 4 . 1 1 15 15 GLN H H 15 7.606 7.606 7.762 -0.156 18925 100 1 4 . 1 1 16 16 LEU HA H 16 4.215 4.215 4.263 -0.048 18925 101 1 4 . 1 1 16 16 LEU H H 16 7.966 7.966 8.055 -0.089 18925 102 1 4 . 1 1 17 17 GLU HA H 17 4.145 4.145 4.064 0.081 18925 103 1 4 . 1 1 17 17 GLU H H 17 8.225 8.225 8.628 -0.403 18925 104 1 4 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.352 0.171 18925 105 1 4 . 1 1 18 18 ASN H H 18 7.503 7.503 7.534 -0.031 18925 106 1 4 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.430 0.148 18925 107 1 4 . 1 1 19 19 TYR H H 19 7.996 7.996 7.514 0.482 18925 108 1 4 . 1 1 20 20 CYS H H 20 7.606 7.606 7.743 -0.137 18925 109 1 5 . 1 1 3 3 VAL HA H 3 3.742 3.742 4.553 -0.811 18925 110 1 5 . 1 1 3 3 VAL H H 3 8.235 8.235 8.087 0.148 18925 111 1 5 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.191 0.015 18925 112 1 5 . 1 1 4 4 GLU H H 4 8.415 8.415 8.831 -0.416 18925 113 1 5 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.349 0.776 18925 114 1 5 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.541 0.359 18925 115 1 5 . 1 1 8 8 THR HA H 8 4.217 4.217 4.194 0.023 18925 116 1 5 . 1 1 9 9 SER HA H 9 4.702 4.702 4.383 0.319 18925 117 1 5 . 1 1 10 10 ILE HA H 10 4.222 4.222 3.771 0.451 18925 118 1 5 . 1 1 10 10 ILE H H 10 7.901 7.901 8.432 -0.531 18925 119 1 5 . 1 1 12 12 SER HA H 12 4.629 4.629 4.756 -0.127 18925 120 1 5 . 1 1 12 12 SER H H 12 8.616 8.616 8.139 0.477 18925 121 1 5 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.103 -0.106 18925 122 1 5 . 1 1 13 13 LEU H H 13 8.709 8.709 8.777 -0.068 18925 123 1 5 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.048 0.344 18925 124 1 5 . 1 1 14 14 TYR H H 14 7.742 7.742 8.407 -0.665 18925 125 1 5 . 1 1 15 15 GLN HA H 15 4.021 4.021 3.956 0.065 18925 126 1 5 . 1 1 15 15 GLN H H 15 7.606 7.606 7.807 -0.201 18925 127 1 5 . 1 1 16 16 LEU HA H 16 4.215 4.215 4.367 -0.152 18925 128 1 5 . 1 1 16 16 LEU H H 16 7.966 7.966 7.599 0.367 18925 129 1 5 . 1 1 17 17 GLU HA H 17 4.145 4.145 4.092 0.053 18925 130 1 5 . 1 1 17 17 GLU H H 17 8.225 8.225 8.634 -0.409 18925 131 1 5 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.289 0.234 18925 132 1 5 . 1 1 18 18 ASN H H 18 7.503 7.503 7.921 -0.418 18925 133 1 5 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.579 -0.001 18925 134 1 5 . 1 1 19 19 TYR H H 19 7.996 7.996 7.946 0.050 18925 135 1 5 . 1 1 20 20 CYS H H 20 7.606 7.606 8.028 -0.422 18925 136 1 6 . 1 1 3 3 VAL HA H 3 3.742 3.742 4.254 -0.512 18925 137 1 6 . 1 1 3 3 VAL H H 3 8.235 8.235 8.631 -0.396 18925 138 1 6 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.620 -0.414 18925 139 1 6 . 1 1 4 4 GLU H H 4 8.415 8.415 8.053 0.362 18925 140 1 6 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.171 0.954 18925 141 1 6 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.266 0.634 18925 142 1 6 . 1 1 8 8 THR HA H 8 4.217 4.217 4.321 -0.104 18925 143 1 6 . 1 1 9 9 SER HA H 9 4.702 4.702 4.714 -0.012 18925 144 1 6 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.176 0.046 18925 145 1 6 . 1 1 10 10 ILE H H 10 7.901 7.901 8.387 -0.486 18925 146 1 6 . 1 1 12 12 SER HA H 12 4.629 4.629 4.509 0.120 18925 147 1 6 . 1 1 12 12 SER H H 12 8.616 8.616 8.441 0.175 18925 148 1 6 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.148 -0.151 18925 149 1 6 . 1 1 13 13 LEU H H 13 8.709 8.709 8.831 -0.122 18925 150 1 6 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.165 0.227 18925 151 1 6 . 1 1 14 14 TYR H H 14 7.742 7.742 8.572 -0.830 18925 152 1 6 . 1 1 15 15 GLN HA H 15 4.021 4.021 4.020 0.001 18925 153 1 6 . 1 1 15 15 GLN H H 15 7.606 7.606 7.722 -0.116 18925 154 1 6 . 1 1 16 16 LEU HA H 16 4.215 4.215 4.216 -0.001 18925 155 1 6 . 1 1 16 16 LEU H H 16 7.966 7.966 8.099 -0.133 18925 156 1 6 . 1 1 17 17 GLU HA H 17 4.145 4.145 3.949 0.196 18925 157 1 6 . 1 1 17 17 GLU H H 17 8.225 8.225 8.452 -0.227 18925 158 1 6 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.321 0.202 18925 159 1 6 . 1 1 18 18 ASN H H 18 7.503 7.503 7.578 -0.075 18925 160 1 6 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.259 0.319 18925 161 1 6 . 1 1 19 19 TYR H H 19 7.996 7.996 7.804 0.192 18925 162 1 6 . 1 1 20 20 CYS H H 20 7.606 7.606 8.117 -0.511 18925 163 1 7 . 1 1 3 3 VAL HA H 3 3.742 3.742 4.196 -0.454 18925 164 1 7 . 1 1 3 3 VAL H H 3 8.235 8.235 8.256 -0.021 18925 165 1 7 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.649 -0.443 18925 166 1 7 . 1 1 4 4 GLU H H 4 8.415 8.415 7.947 0.468 18925 167 1 7 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.855 0.270 18925 168 1 7 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.221 0.679 18925 169 1 7 . 1 1 8 8 THR HA H 8 4.217 4.217 4.305 -0.088 18925 170 1 7 . 1 1 9 9 SER HA H 9 4.702 4.702 4.662 0.040 18925 171 1 7 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.141 0.081 18925 172 1 7 . 1 1 10 10 ILE H H 10 7.901 7.901 8.465 -0.564 18925 173 1 7 . 1 1 12 12 SER HA H 12 4.629 4.629 4.657 -0.028 18925 174 1 7 . 1 1 12 12 SER H H 12 8.616 8.616 8.962 -0.346 18925 175 1 7 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.131 -0.134 18925 176 1 7 . 1 1 13 13 LEU H H 13 8.709 8.709 8.694 0.015 18925 177 1 7 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.392 -0.000 18925 178 1 7 . 1 1 14 14 TYR H H 14 7.742 7.742 8.311 -0.569 18925 179 1 7 . 1 1 15 15 GLN HA H 15 4.021 4.021 4.006 0.015 18925 180 1 7 . 1 1 15 15 GLN H H 15 7.606 7.606 7.800 -0.194 18925 181 1 7 . 1 1 16 16 LEU HA H 16 4.215 4.215 4.133 0.082 18925 182 1 7 . 1 1 16 16 LEU H H 16 7.966 7.966 7.543 0.423 18925 183 1 7 . 1 1 17 17 GLU HA H 17 4.145 4.145 3.918 0.227 18925 184 1 7 . 1 1 17 17 GLU H H 17 8.225 8.225 7.991 0.234 18925 185 1 7 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.282 0.240 18925 186 1 7 . 1 1 18 18 ASN H H 18 7.503 7.503 7.406 0.097 18925 187 1 7 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.585 -0.007 18925 188 1 7 . 1 1 19 19 TYR H H 19 7.996 7.996 7.616 0.380 18925 189 1 7 . 1 1 20 20 CYS H H 20 7.606 7.606 7.930 -0.324 18925 190 1 8 . 1 1 3 3 VAL HA H 3 3.742 3.742 3.986 -0.244 18925 191 1 8 . 1 1 3 3 VAL H H 3 8.235 8.235 8.112 0.123 18925 192 1 8 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.407 -0.201 18925 193 1 8 . 1 1 4 4 GLU H H 4 8.415 8.415 7.695 0.720 18925 194 1 8 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.259 0.866 18925 195 1 8 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.543 0.357 18925 196 1 8 . 1 1 8 8 THR HA H 8 4.217 4.217 4.369 -0.152 18925 197 1 8 . 1 1 9 9 SER HA H 9 4.702 4.702 4.559 0.143 18925 198 1 8 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.273 -0.051 18925 199 1 8 . 1 1 10 10 ILE H H 10 7.901 7.901 8.202 -0.301 18925 200 1 8 . 1 1 12 12 SER HA H 12 4.629 4.629 4.545 0.084 18925 201 1 8 . 1 1 12 12 SER H H 12 8.616 8.616 8.679 -0.063 18925 202 1 8 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.053 -0.056 18925 203 1 8 . 1 1 13 13 LEU H H 13 8.709 8.709 8.871 -0.162 18925 204 1 8 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.026 0.366 18925 205 1 8 . 1 1 14 14 TYR H H 14 7.742 7.742 8.485 -0.743 18925 206 1 8 . 1 1 15 15 GLN HA H 15 4.021 4.021 3.544 0.477 18925 207 1 8 . 1 1 15 15 GLN H H 15 7.606 7.606 7.892 -0.286 18925 208 1 8 . 1 1 16 16 LEU HA H 16 4.215 4.215 3.775 0.440 18925 209 1 8 . 1 1 16 16 LEU H H 16 7.966 7.966 7.314 0.652 18925 210 1 8 . 1 1 17 17 GLU HA H 17 4.145 4.145 3.852 0.293 18925 211 1 8 . 1 1 17 17 GLU H H 17 8.225 8.225 8.483 -0.258 18925 212 1 8 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.335 0.188 18925 213 1 8 . 1 1 18 18 ASN H H 18 7.503 7.503 7.641 -0.138 18925 214 1 8 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.450 0.128 18925 215 1 8 . 1 1 19 19 TYR H H 19 7.996 7.996 7.615 0.381 18925 216 1 8 . 1 1 20 20 CYS H H 20 7.606 7.606 8.175 -0.569 18925 217 1 9 . 1 1 3 3 VAL HA H 3 3.742 3.742 4.054 -0.312 18925 218 1 9 . 1 1 3 3 VAL H H 3 8.235 8.235 8.292 -0.057 18925 219 1 9 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.686 -0.480 18925 220 1 9 . 1 1 4 4 GLU H H 4 8.415 8.415 8.132 0.283 18925 221 1 9 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.559 0.566 18925 222 1 9 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.431 0.469 18925 223 1 9 . 1 1 8 8 THR HA H 8 4.217 4.217 4.435 -0.218 18925 224 1 9 . 1 1 9 9 SER HA H 9 4.702 4.702 4.731 -0.029 18925 225 1 9 . 1 1 10 10 ILE HA H 10 4.222 4.222 3.961 0.261 18925 226 1 9 . 1 1 10 10 ILE H H 10 7.901 7.901 8.406 -0.505 18925 227 1 9 . 1 1 12 12 SER HA H 12 4.629 4.629 4.138 0.491 18925 228 1 9 . 1 1 12 12 SER H H 12 8.616 8.616 7.920 0.696 18925 229 1 9 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.033 -0.036 18925 230 1 9 . 1 1 13 13 LEU H H 13 8.709 8.709 8.701 0.008 18925 231 1 9 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.340 0.052 18925 232 1 9 . 1 1 14 14 TYR H H 14 7.742 7.742 8.533 -0.791 18925 233 1 9 . 1 1 15 15 GLN HA H 15 4.021 4.021 4.278 -0.257 18925 234 1 9 . 1 1 15 15 GLN H H 15 7.606 7.606 7.690 -0.084 18925 235 1 9 . 1 1 16 16 LEU HA H 16 4.215 4.215 4.238 -0.023 18925 236 1 9 . 1 1 16 16 LEU H H 16 7.966 7.966 7.947 0.019 18925 237 1 9 . 1 1 17 17 GLU HA H 17 4.145 4.145 4.066 0.079 18925 238 1 9 . 1 1 17 17 GLU H H 17 8.225 8.225 8.259 -0.034 18925 239 1 9 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.483 0.040 18925 240 1 9 . 1 1 18 18 ASN H H 18 7.503 7.503 7.806 -0.303 18925 241 1 9 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.419 0.159 18925 242 1 9 . 1 1 19 19 TYR H H 19 7.996 7.996 8.058 -0.062 18925 243 1 9 . 1 1 20 20 CYS H H 20 7.606 7.606 7.937 -0.331 18925 244 1 10 . 1 1 3 3 VAL HA H 3 3.742 3.742 3.959 -0.217 18925 245 1 10 . 1 1 3 3 VAL H H 3 8.235 8.235 8.312 -0.077 18925 246 1 10 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.640 -0.434 18925 247 1 10 . 1 1 4 4 GLU H H 4 8.415 8.415 7.999 0.416 18925 248 1 10 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.786 0.339 18925 249 1 10 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.559 0.341 18925 250 1 10 . 1 1 8 8 THR HA H 8 4.217 4.217 4.367 -0.150 18925 251 1 10 . 1 1 9 9 SER HA H 9 4.702 4.702 4.536 0.166 18925 252 1 10 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.276 -0.054 18925 253 1 10 . 1 1 10 10 ILE H H 10 7.901 7.901 8.167 -0.266 18925 254 1 10 . 1 1 12 12 SER HA H 12 4.629 4.629 4.532 0.097 18925 255 1 10 . 1 1 12 12 SER H H 12 8.616 8.616 8.676 -0.060 18925 256 1 10 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.129 -0.132 18925 257 1 10 . 1 1 13 13 LEU H H 13 8.709 8.709 8.812 -0.103 18925 258 1 10 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.333 0.059 18925 259 1 10 . 1 1 14 14 TYR H H 14 7.742 7.742 8.343 -0.601 18925 260 1 10 . 1 1 15 15 GLN HA H 15 4.021 4.021 4.021 -0.000 18925 261 1 10 . 1 1 15 15 GLN H H 15 7.606 7.606 7.827 -0.221 18925 262 1 10 . 1 1 16 16 LEU HA H 16 4.215 4.215 4.223 -0.008 18925 263 1 10 . 1 1 16 16 LEU H H 16 7.966 7.966 8.354 -0.388 18925 264 1 10 . 1 1 17 17 GLU HA H 17 4.145 4.145 4.019 0.126 18925 265 1 10 . 1 1 17 17 GLU H H 17 8.225 8.225 8.426 -0.201 18925 266 1 10 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.362 0.161 18925 267 1 10 . 1 1 18 18 ASN H H 18 7.503 7.503 7.625 -0.122 18925 268 1 10 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.524 0.054 18925 269 1 10 . 1 1 19 19 TYR H H 19 7.996 7.996 7.877 0.119 18925 270 1 10 . 1 1 20 20 CYS H H 20 7.606 7.606 7.880 -0.274 18925 271 1 11 . 1 1 3 3 VAL HA H 3 3.742 3.742 3.777 -0.035 18925 272 1 11 . 1 1 3 3 VAL H H 3 8.235 8.235 8.478 -0.243 18925 273 1 11 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.165 0.041 18925 274 1 11 . 1 1 4 4 GLU H H 4 8.415 8.415 7.647 0.768 18925 275 1 11 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.718 0.407 18925 276 1 11 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.465 0.435 18925 277 1 11 . 1 1 8 8 THR HA H 8 4.217 4.217 4.278 -0.061 18925 278 1 11 . 1 1 9 9 SER HA H 9 4.702 4.702 4.719 -0.017 18925 279 1 11 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.121 0.101 18925 280 1 11 . 1 1 10 10 ILE H H 10 7.901 7.901 8.220 -0.319 18925 281 1 11 . 1 1 12 12 SER HA H 12 4.629 4.629 4.447 0.182 18925 282 1 11 . 1 1 12 12 SER H H 12 8.616 8.616 9.360 -0.744 18925 283 1 11 . 1 1 13 13 LEU HA H 13 3.997 3.997 3.911 0.086 18925 284 1 11 . 1 1 13 13 LEU H H 13 8.709 8.709 7.813 0.896 18925 285 1 11 . 1 1 14 14 TYR HA H 14 4.392 4.392 3.943 0.449 18925 286 1 11 . 1 1 14 14 TYR H H 14 7.742 7.742 8.212 -0.470 18925 287 1 11 . 1 1 15 15 GLN HA H 15 4.021 4.021 3.590 0.431 18925 288 1 11 . 1 1 15 15 GLN H H 15 7.606 7.606 8.267 -0.661 18925 289 1 11 . 1 1 16 16 LEU HA H 16 4.215 4.215 3.907 0.308 18925 290 1 11 . 1 1 16 16 LEU H H 16 7.966 7.966 7.457 0.509 18925 291 1 11 . 1 1 17 17 GLU HA H 17 4.145 4.145 3.903 0.242 18925 292 1 11 . 1 1 17 17 GLU H H 17 8.225 8.225 7.935 0.290 18925 293 1 11 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.472 0.051 18925 294 1 11 . 1 1 18 18 ASN H H 18 7.503 7.503 7.728 -0.225 18925 295 1 11 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.421 0.157 18925 296 1 11 . 1 1 19 19 TYR H H 19 7.996 7.996 7.508 0.488 18925 297 1 11 . 1 1 20 20 CYS H H 20 7.606 7.606 8.155 -0.549 18925 298 1 12 . 1 1 3 3 VAL HA H 3 3.742 3.742 4.062 -0.320 18925 299 1 12 . 1 1 3 3 VAL H H 3 8.235 8.235 8.113 0.122 18925 300 1 12 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.196 0.010 18925 301 1 12 . 1 1 4 4 GLU H H 4 8.415 8.415 8.460 -0.045 18925 302 1 12 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.301 0.824 18925 303 1 12 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.672 0.228 18925 304 1 12 . 1 1 8 8 THR HA H 8 4.217 4.217 3.998 0.219 18925 305 1 12 . 1 1 9 9 SER HA H 9 4.702 4.702 4.716 -0.014 18925 306 1 12 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.196 0.026 18925 307 1 12 . 1 1 10 10 ILE H H 10 7.901 7.901 8.251 -0.350 18925 308 1 12 . 1 1 12 12 SER HA H 12 4.629 4.629 4.619 0.010 18925 309 1 12 . 1 1 12 12 SER H H 12 8.616 8.616 8.102 0.514 18925 310 1 12 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.133 -0.136 18925 311 1 12 . 1 1 13 13 LEU H H 13 8.709 8.709 8.770 -0.061 18925 312 1 12 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.390 0.002 18925 313 1 12 . 1 1 14 14 TYR H H 14 7.742 7.742 8.318 -0.576 18925 314 1 12 . 1 1 15 15 GLN HA H 15 4.021 4.021 3.912 0.110 18925 315 1 12 . 1 1 15 15 GLN H H 15 7.606 7.606 7.672 -0.066 18925 316 1 12 . 1 1 16 16 LEU HA H 16 4.215 4.215 4.176 0.039 18925 317 1 12 . 1 1 16 16 LEU H H 16 7.966 7.966 8.232 -0.266 18925 318 1 12 . 1 1 17 17 GLU HA H 17 4.145 4.145 4.104 0.041 18925 319 1 12 . 1 1 17 17 GLU H H 17 8.225 8.225 8.378 -0.153 18925 320 1 12 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.479 0.044 18925 321 1 12 . 1 1 18 18 ASN H H 18 7.503 7.503 7.686 -0.183 18925 322 1 12 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.506 0.072 18925 323 1 12 . 1 1 19 19 TYR H H 19 7.996 7.996 7.850 0.146 18925 324 1 12 . 1 1 20 20 CYS H H 20 7.606 7.606 8.051 -0.445 18925 325 1 13 . 1 1 3 3 VAL HA H 3 3.742 3.742 4.103 -0.361 18925 326 1 13 . 1 1 3 3 VAL H H 3 8.235 8.235 8.176 0.059 18925 327 1 13 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.547 -0.341 18925 328 1 13 . 1 1 4 4 GLU H H 4 8.415 8.415 7.745 0.670 18925 329 1 13 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.689 0.436 18925 330 1 13 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.665 0.235 18925 331 1 13 . 1 1 8 8 THR HA H 8 4.217 4.217 3.912 0.305 18925 332 1 13 . 1 1 9 9 SER HA H 9 4.702 4.702 4.593 0.109 18925 333 1 13 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.250 -0.028 18925 334 1 13 . 1 1 10 10 ILE H H 10 7.901 7.901 8.129 -0.228 18925 335 1 13 . 1 1 12 12 SER HA H 12 4.629 4.629 4.646 -0.017 18925 336 1 13 . 1 1 12 12 SER H H 12 8.616 8.616 8.661 -0.045 18925 337 1 13 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.109 -0.112 18925 338 1 13 . 1 1 13 13 LEU H H 13 8.709 8.709 8.841 -0.132 18925 339 1 13 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.116 0.276 18925 340 1 13 . 1 1 14 14 TYR H H 14 7.742 7.742 8.539 -0.797 18925 341 1 13 . 1 1 15 15 GLN HA H 15 4.021 4.021 3.705 0.316 18925 342 1 13 . 1 1 15 15 GLN H H 15 7.606 7.606 7.982 -0.376 18925 343 1 13 . 1 1 16 16 LEU HA H 16 4.215 4.215 4.029 0.186 18925 344 1 13 . 1 1 16 16 LEU H H 16 7.966 7.966 7.396 0.570 18925 345 1 13 . 1 1 17 17 GLU HA H 17 4.145 4.145 3.867 0.278 18925 346 1 13 . 1 1 17 17 GLU H H 17 8.225 8.225 8.566 -0.341 18925 347 1 13 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.310 0.213 18925 348 1 13 . 1 1 18 18 ASN H H 18 7.503 7.503 7.611 -0.108 18925 349 1 13 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.375 0.203 18925 350 1 13 . 1 1 19 19 TYR H H 19 7.996 7.996 7.041 0.955 18925 351 1 13 . 1 1 20 20 CYS H H 20 7.606 7.606 8.018 -0.412 18925 352 1 14 . 1 1 3 3 VAL HA H 3 3.742 3.742 4.382 -0.640 18925 353 1 14 . 1 1 3 3 VAL H H 3 8.235 8.235 8.351 -0.116 18925 354 1 14 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.677 -0.471 18925 355 1 14 . 1 1 4 4 GLU H H 4 8.415 8.415 7.924 0.491 18925 356 1 14 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.495 0.630 18925 357 1 14 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.554 0.346 18925 358 1 14 . 1 1 8 8 THR HA H 8 4.217 4.217 4.271 -0.054 18925 359 1 14 . 1 1 9 9 SER HA H 9 4.702 4.702 4.697 0.005 18925 360 1 14 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.203 0.019 18925 361 1 14 . 1 1 10 10 ILE H H 10 7.901 7.901 8.137 -0.236 18925 362 1 14 . 1 1 12 12 SER HA H 12 4.629 4.629 4.660 -0.031 18925 363 1 14 . 1 1 12 12 SER H H 12 8.616 8.616 8.493 0.123 18925 364 1 14 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.122 -0.125 18925 365 1 14 . 1 1 13 13 LEU H H 13 8.709 8.709 8.901 -0.192 18925 366 1 14 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.233 0.159 18925 367 1 14 . 1 1 14 14 TYR H H 14 7.742 7.742 8.434 -0.692 18925 368 1 14 . 1 1 15 15 GLN HA H 15 4.021 4.021 3.932 0.089 18925 369 1 14 . 1 1 15 15 GLN H H 15 7.606 7.606 7.884 -0.278 18925 370 1 14 . 1 1 16 16 LEU HA H 16 4.215 4.215 3.891 0.324 18925 371 1 14 . 1 1 16 16 LEU H H 16 7.966 7.966 7.266 0.700 18925 372 1 14 . 1 1 17 17 GLU HA H 17 4.145 4.145 3.845 0.300 18925 373 1 14 . 1 1 17 17 GLU H H 17 8.225 8.225 8.265 -0.040 18925 374 1 14 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.309 0.214 18925 375 1 14 . 1 1 18 18 ASN H H 18 7.503 7.503 7.551 -0.048 18925 376 1 14 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.415 0.163 18925 377 1 14 . 1 1 19 19 TYR H H 19 7.996 7.996 7.235 0.761 18925 378 1 14 . 1 1 20 20 CYS H H 20 7.606 7.606 7.892 -0.286 18925 379 1 15 . 1 1 3 3 VAL HA H 3 3.742 3.742 3.631 0.111 18925 380 1 15 . 1 1 3 3 VAL H H 3 8.235 8.235 7.991 0.244 18925 381 1 15 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.277 -0.071 18925 382 1 15 . 1 1 4 4 GLU H H 4 8.415 8.415 7.789 0.626 18925 383 1 15 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.543 0.582 18925 384 1 15 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.477 0.423 18925 385 1 15 . 1 1 8 8 THR HA H 8 4.217 4.217 4.297 -0.080 18925 386 1 15 . 1 1 9 9 SER HA H 9 4.702 4.702 4.588 0.114 18925 387 1 15 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.125 0.097 18925 388 1 15 . 1 1 10 10 ILE H H 10 7.901 7.901 8.252 -0.351 18925 389 1 15 . 1 1 12 12 SER HA H 12 4.629 4.629 4.459 0.170 18925 390 1 15 . 1 1 12 12 SER H H 12 8.616 8.616 9.164 -0.548 18925 391 1 15 . 1 1 13 13 LEU HA H 13 3.997 3.997 3.866 0.131 18925 392 1 15 . 1 1 13 13 LEU H H 13 8.709 8.709 8.070 0.639 18925 393 1 15 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.304 0.088 18925 394 1 15 . 1 1 14 14 TYR H H 14 7.742 7.742 8.195 -0.453 18925 395 1 15 . 1 1 15 15 GLN HA H 15 4.021 4.021 3.774 0.247 18925 396 1 15 . 1 1 15 15 GLN H H 15 7.606 7.606 8.654 -1.048 18925 397 1 15 . 1 1 16 16 LEU HA H 16 4.215 4.215 4.232 -0.017 18925 398 1 15 . 1 1 16 16 LEU H H 16 7.966 7.966 7.752 0.214 18925 399 1 15 . 1 1 17 17 GLU HA H 17 4.145 4.145 3.962 0.183 18925 400 1 15 . 1 1 17 17 GLU H H 17 8.225 8.225 7.956 0.269 18925 401 1 15 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.304 0.219 18925 402 1 15 . 1 1 18 18 ASN H H 18 7.503 7.503 7.512 -0.009 18925 403 1 15 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.778 -0.200 18925 404 1 15 . 1 1 19 19 TYR H H 19 7.996 7.996 7.689 0.307 18925 405 1 15 . 1 1 20 20 CYS H H 20 7.606 7.606 7.954 -0.348 18925 406 1 16 . 1 1 3 3 VAL HA H 3 3.742 3.742 4.148 -0.406 18925 407 1 16 . 1 1 3 3 VAL H H 3 8.235 8.235 7.671 0.564 18925 408 1 16 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.647 -0.441 18925 409 1 16 . 1 1 4 4 GLU H H 4 8.415 8.415 8.428 -0.013 18925 410 1 16 . 1 1 6 6 CYS HA H 6 5.125 5.125 5.098 0.027 18925 411 1 16 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.652 0.248 18925 412 1 16 . 1 1 8 8 THR HA H 8 4.217 4.217 4.090 0.127 18925 413 1 16 . 1 1 9 9 SER HA H 9 4.702 4.702 4.766 -0.064 18925 414 1 16 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.066 0.156 18925 415 1 16 . 1 1 10 10 ILE H H 10 7.901 7.901 8.558 -0.657 18925 416 1 16 . 1 1 12 12 SER HA H 12 4.629 4.629 4.626 0.003 18925 417 1 16 . 1 1 12 12 SER H H 12 8.616 8.616 8.430 0.186 18925 418 1 16 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.065 -0.068 18925 419 1 16 . 1 1 13 13 LEU H H 13 8.709 8.709 8.753 -0.044 18925 420 1 16 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.178 0.214 18925 421 1 16 . 1 1 14 14 TYR H H 14 7.742 7.742 8.227 -0.485 18925 422 1 16 . 1 1 15 15 GLN HA H 15 4.021 4.021 3.965 0.056 18925 423 1 16 . 1 1 15 15 GLN H H 15 7.606 7.606 7.683 -0.077 18925 424 1 16 . 1 1 16 16 LEU HA H 16 4.215 4.215 4.139 0.076 18925 425 1 16 . 1 1 16 16 LEU H H 16 7.966 7.966 8.015 -0.049 18925 426 1 16 . 1 1 17 17 GLU HA H 17 4.145 4.145 4.063 0.082 18925 427 1 16 . 1 1 17 17 GLU H H 17 8.225 8.225 7.910 0.315 18925 428 1 16 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.442 0.081 18925 429 1 16 . 1 1 18 18 ASN H H 18 7.503 7.503 7.856 -0.353 18925 430 1 16 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.522 0.056 18925 431 1 16 . 1 1 19 19 TYR H H 19 7.996 7.996 7.989 0.007 18925 432 1 16 . 1 1 20 20 CYS H H 20 7.606 7.606 7.876 -0.270 18925 433 1 17 . 1 1 3 3 VAL HA H 3 3.742 3.742 4.574 -0.832 18925 434 1 17 . 1 1 3 3 VAL H H 3 8.235 8.235 8.483 -0.248 18925 435 1 17 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.338 -0.132 18925 436 1 17 . 1 1 4 4 GLU H H 4 8.415 8.415 8.968 -0.553 18925 437 1 17 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.276 0.849 18925 438 1 17 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.656 0.244 18925 439 1 17 . 1 1 8 8 THR HA H 8 4.217 4.217 4.277 -0.060 18925 440 1 17 . 1 1 9 9 SER HA H 9 4.702 4.702 4.630 0.072 18925 441 1 17 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.157 0.065 18925 442 1 17 . 1 1 10 10 ILE H H 10 7.901 7.901 8.300 -0.399 18925 443 1 17 . 1 1 12 12 SER HA H 12 4.629 4.629 4.657 -0.028 18925 444 1 17 . 1 1 12 12 SER H H 12 8.616 8.616 8.936 -0.320 18925 445 1 17 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.110 -0.113 18925 446 1 17 . 1 1 13 13 LEU H H 13 8.709 8.709 8.791 -0.082 18925 447 1 17 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.372 0.020 18925 448 1 17 . 1 1 14 14 TYR H H 14 7.742 7.742 7.829 -0.087 18925 449 1 17 . 1 1 15 15 GLN HA H 15 4.021 4.021 3.987 0.034 18925 450 1 17 . 1 1 15 15 GLN H H 15 7.606 7.606 7.706 -0.100 18925 451 1 17 . 1 1 16 16 LEU HA H 16 4.215 4.215 4.055 0.160 18925 452 1 17 . 1 1 16 16 LEU H H 16 7.966 7.966 7.835 0.131 18925 453 1 17 . 1 1 17 17 GLU HA H 17 4.145 4.145 4.097 0.048 18925 454 1 17 . 1 1 17 17 GLU H H 17 8.225 8.225 8.268 -0.043 18925 455 1 17 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.539 -0.016 18925 456 1 17 . 1 1 18 18 ASN H H 18 7.503 7.503 7.566 -0.063 18925 457 1 17 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.330 0.248 18925 458 1 17 . 1 1 19 19 TYR H H 19 7.996 7.996 7.785 0.211 18925 459 1 17 . 1 1 20 20 CYS H H 20 7.606 7.606 7.954 -0.348 18925 460 1 18 . 1 1 3 3 VAL HA H 3 3.742 3.742 4.117 -0.375 18925 461 1 18 . 1 1 3 3 VAL H H 3 8.235 8.235 8.531 -0.296 18925 462 1 18 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.585 -0.379 18925 463 1 18 . 1 1 4 4 GLU H H 4 8.415 8.415 7.886 0.529 18925 464 1 18 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.580 0.545 18925 465 1 18 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.737 0.163 18925 466 1 18 . 1 1 8 8 THR HA H 8 4.217 4.217 4.219 -0.002 18925 467 1 18 . 1 1 9 9 SER HA H 9 4.702 4.702 4.716 -0.014 18925 468 1 18 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.221 0.001 18925 469 1 18 . 1 1 10 10 ILE H H 10 7.901 7.901 8.162 -0.261 18925 470 1 18 . 1 1 12 12 SER HA H 12 4.629 4.629 4.627 0.002 18925 471 1 18 . 1 1 12 12 SER H H 12 8.616 8.616 9.305 -0.689 18925 472 1 18 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.172 -0.175 18925 473 1 18 . 1 1 13 13 LEU H H 13 8.709 8.709 8.852 -0.143 18925 474 1 18 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.183 0.209 18925 475 1 18 . 1 1 14 14 TYR H H 14 7.742 7.742 7.923 -0.181 18925 476 1 18 . 1 1 15 15 GLN HA H 15 4.021 4.021 3.926 0.095 18925 477 1 18 . 1 1 15 15 GLN H H 15 7.606 7.606 7.699 -0.093 18925 478 1 18 . 1 1 16 16 LEU HA H 16 4.215 4.215 4.226 -0.011 18925 479 1 18 . 1 1 16 16 LEU H H 16 7.966 7.966 7.953 0.013 18925 480 1 18 . 1 1 17 17 GLU HA H 17 4.145 4.145 3.976 0.169 18925 481 1 18 . 1 1 17 17 GLU H H 17 8.225 8.225 8.403 -0.178 18925 482 1 18 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.352 0.171 18925 483 1 18 . 1 1 18 18 ASN H H 18 7.503 7.503 7.596 -0.093 18925 484 1 18 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.307 0.271 18925 485 1 18 . 1 1 19 19 TYR H H 19 7.996 7.996 7.809 0.187 18925 486 1 18 . 1 1 20 20 CYS H H 20 7.606 7.606 7.989 -0.383 18925 487 1 19 . 1 1 3 3 VAL HA H 3 3.742 3.742 3.942 -0.200 18925 488 1 19 . 1 1 3 3 VAL H H 3 8.235 8.235 7.477 0.758 18925 489 1 19 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.214 -0.008 18925 490 1 19 . 1 1 4 4 GLU H H 4 8.415 8.415 8.653 -0.238 18925 491 1 19 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.470 0.655 18925 492 1 19 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.697 0.203 18925 493 1 19 . 1 1 8 8 THR HA H 8 4.217 4.217 4.190 0.027 18925 494 1 19 . 1 1 9 9 SER HA H 9 4.702 4.702 4.675 0.027 18925 495 1 19 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.031 0.191 18925 496 1 19 . 1 1 10 10 ILE H H 10 7.901 7.901 8.227 -0.326 18925 497 1 19 . 1 1 12 12 SER HA H 12 4.629 4.629 4.550 0.079 18925 498 1 19 . 1 1 12 12 SER H H 12 8.616 8.616 9.066 -0.450 18925 499 1 19 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.098 -0.101 18925 500 1 19 . 1 1 13 13 LEU H H 13 8.709 8.709 8.848 -0.139 18925 501 1 19 . 1 1 14 14 TYR HA H 14 4.392 4.392 3.962 0.430 18925 502 1 19 . 1 1 14 14 TYR H H 14 7.742 7.742 7.706 0.036 18925 503 1 19 . 1 1 15 15 GLN HA H 15 4.021 4.021 3.738 0.283 18925 504 1 19 . 1 1 15 15 GLN H H 15 7.606 7.606 7.765 -0.159 18925 505 1 19 . 1 1 16 16 LEU HA H 16 4.215 4.215 3.914 0.301 18925 506 1 19 . 1 1 16 16 LEU H H 16 7.966 7.966 7.864 0.102 18925 507 1 19 . 1 1 17 17 GLU HA H 17 4.145 4.145 3.865 0.280 18925 508 1 19 . 1 1 17 17 GLU H H 17 8.225 8.225 8.476 -0.251 18925 509 1 19 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.499 0.024 18925 510 1 19 . 1 1 18 18 ASN H H 18 7.503 7.503 7.481 0.022 18925 511 1 19 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.442 0.136 18925 512 1 19 . 1 1 19 19 TYR H H 19 7.996 7.996 7.399 0.597 18925 513 1 19 . 1 1 20 20 CYS H H 20 7.606 7.606 8.078 -0.472 18925 514 1 20 . 1 1 3 3 VAL HA H 3 3.742 3.742 4.410 -0.668 18925 515 1 20 . 1 1 3 3 VAL H H 3 8.235 8.235 8.072 0.163 18925 516 1 20 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.402 -0.196 18925 517 1 20 . 1 1 4 4 GLU H H 4 8.415 8.415 8.826 -0.411 18925 518 1 20 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.849 0.276 18925 519 1 20 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.351 0.549 18925 520 1 20 . 1 1 8 8 THR HA H 8 4.217 4.217 4.432 -0.215 18925 521 1 20 . 1 1 9 9 SER HA H 9 4.702 4.702 4.705 -0.003 18925 522 1 20 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.156 0.066 18925 523 1 20 . 1 1 10 10 ILE H H 10 7.901 7.901 8.420 -0.519 18925 524 1 20 . 1 1 12 12 SER HA H 12 4.629 4.629 4.536 0.093 18925 525 1 20 . 1 1 12 12 SER H H 12 8.616 8.616 8.696 -0.080 18925 526 1 20 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.147 -0.150 18925 527 1 20 . 1 1 13 13 LEU H H 13 8.709 8.709 8.820 -0.111 18925 528 1 20 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.381 0.011 18925 529 1 20 . 1 1 14 14 TYR H H 14 7.742 7.742 8.036 -0.293 18925 530 1 20 . 1 1 15 15 GLN HA H 15 4.021 4.021 3.923 0.098 18925 531 1 20 . 1 1 15 15 GLN H H 15 7.606 7.606 7.746 -0.140 18925 532 1 20 . 1 1 16 16 LEU HA H 16 4.215 4.215 4.174 0.041 18925 533 1 20 . 1 1 16 16 LEU H H 16 7.966 7.966 8.215 -0.249 18925 534 1 20 . 1 1 17 17 GLU HA H 17 4.145 4.145 3.973 0.172 18925 535 1 20 . 1 1 17 17 GLU H H 17 8.225 8.225 8.397 -0.172 18925 536 1 20 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.434 0.089 18925 537 1 20 . 1 1 18 18 ASN H H 18 7.503 7.503 7.662 -0.159 18925 538 1 20 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.348 0.230 18925 539 1 20 . 1 1 19 19 TYR H H 19 7.996 7.996 7.679 0.317 18925 540 1 20 . 1 1 20 20 CYS H H 20 7.606 7.606 7.923 -0.317 18925 541 1 21 . 1 1 3 3 VAL HA H 3 3.742 3.742 4.391 -0.649 18925 542 1 21 . 1 1 3 3 VAL H H 3 8.235 8.235 7.823 0.412 18925 543 1 21 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.505 -0.299 18925 544 1 21 . 1 1 4 4 GLU H H 4 8.415 8.415 8.947 -0.532 18925 545 1 21 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.581 0.544 18925 546 1 21 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.290 0.610 18925 547 1 21 . 1 1 8 8 THR HA H 8 4.217 4.217 4.349 -0.132 18925 548 1 21 . 1 1 9 9 SER HA H 9 4.702 4.702 4.723 -0.021 18925 549 1 21 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.285 -0.063 18925 550 1 21 . 1 1 10 10 ILE H H 10 7.901 7.901 8.391 -0.490 18925 551 1 21 . 1 1 12 12 SER HA H 12 4.629 4.629 4.645 -0.016 18925 552 1 21 . 1 1 12 12 SER H H 12 8.616 8.616 8.152 0.464 18925 553 1 21 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.070 -0.073 18925 554 1 21 . 1 1 13 13 LEU H H 13 8.709 8.709 8.794 -0.085 18925 555 1 21 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.215 0.177 18925 556 1 21 . 1 1 14 14 TYR H H 14 7.742 7.742 8.476 -0.734 18925 557 1 21 . 1 1 15 15 GLN HA H 15 4.021 4.021 4.063 -0.042 18925 558 1 21 . 1 1 15 15 GLN H H 15 7.606 7.606 7.832 -0.226 18925 559 1 21 . 1 1 16 16 LEU HA H 16 4.215 4.215 4.122 0.093 18925 560 1 21 . 1 1 16 16 LEU H H 16 7.966 7.966 8.312 -0.346 18925 561 1 21 . 1 1 17 17 GLU HA H 17 4.145 4.145 3.969 0.176 18925 562 1 21 . 1 1 17 17 GLU H H 17 8.225 8.225 8.478 -0.253 18925 563 1 21 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.469 0.054 18925 564 1 21 . 1 1 18 18 ASN H H 18 7.503 7.503 7.754 -0.251 18925 565 1 21 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.408 0.170 18925 566 1 21 . 1 1 19 19 TYR H H 19 7.996 7.996 8.140 -0.144 18925 567 1 21 . 1 1 20 20 CYS H H 20 7.606 7.606 8.070 -0.464 18925 568 1 22 . 1 1 3 3 VAL HA H 3 3.742 3.742 4.129 -0.387 18925 569 1 22 . 1 1 3 3 VAL H H 3 8.235 8.235 7.957 0.278 18925 570 1 22 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.111 0.095 18925 571 1 22 . 1 1 4 4 GLU H H 4 8.415 8.415 8.782 -0.367 18925 572 1 22 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.797 0.328 18925 573 1 22 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.774 0.126 18925 574 1 22 . 1 1 8 8 THR HA H 8 4.217 4.217 3.958 0.259 18925 575 1 22 . 1 1 9 9 SER HA H 9 4.702 4.702 4.610 0.092 18925 576 1 22 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.120 0.102 18925 577 1 22 . 1 1 10 10 ILE H H 10 7.901 7.901 8.198 -0.297 18925 578 1 22 . 1 1 12 12 SER HA H 12 4.629 4.629 4.717 -0.088 18925 579 1 22 . 1 1 12 12 SER H H 12 8.616 8.616 9.160 -0.544 18925 580 1 22 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.237 -0.240 18925 581 1 22 . 1 1 13 13 LEU H H 13 8.709 8.709 8.801 -0.092 18925 582 1 22 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.318 0.074 18925 583 1 22 . 1 1 14 14 TYR H H 14 7.742 7.742 7.840 -0.098 18925 584 1 22 . 1 1 15 15 GLN HA H 15 4.021 4.021 4.124 -0.103 18925 585 1 22 . 1 1 15 15 GLN H H 15 7.606 7.606 7.890 -0.284 18925 586 1 22 . 1 1 16 16 LEU HA H 16 4.215 4.215 4.237 -0.022 18925 587 1 22 . 1 1 16 16 LEU H H 16 7.966 7.966 7.988 -0.022 18925 588 1 22 . 1 1 17 17 GLU HA H 17 4.145 4.145 3.947 0.198 18925 589 1 22 . 1 1 17 17 GLU H H 17 8.225 8.225 7.864 0.361 18925 590 1 22 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.487 0.036 18925 591 1 22 . 1 1 18 18 ASN H H 18 7.503 7.503 8.060 -0.557 18925 592 1 22 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.438 0.140 18925 593 1 22 . 1 1 19 19 TYR H H 19 7.996 7.996 8.108 -0.112 18925 594 1 22 . 1 1 20 20 CYS H H 20 7.606 7.606 8.028 -0.422 18925 595 1 23 . 1 1 3 3 VAL HA H 3 3.742 3.742 3.775 -0.033 18925 596 1 23 . 1 1 3 3 VAL H H 3 8.235 8.235 8.467 -0.232 18925 597 1 23 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.185 0.021 18925 598 1 23 . 1 1 4 4 GLU H H 4 8.415 8.415 8.151 0.264 18925 599 1 23 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.204 0.921 18925 600 1 23 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.706 0.194 18925 601 1 23 . 1 1 8 8 THR HA H 8 4.217 4.217 3.896 0.321 18925 602 1 23 . 1 1 9 9 SER HA H 9 4.702 4.702 4.591 0.111 18925 603 1 23 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.234 -0.012 18925 604 1 23 . 1 1 10 10 ILE H H 10 7.901 7.901 8.281 -0.380 18925 605 1 23 . 1 1 12 12 SER HA H 12 4.629 4.629 4.900 -0.271 18925 606 1 23 . 1 1 12 12 SER H H 12 8.616 8.616 8.320 0.296 18925 607 1 23 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.141 -0.144 18925 608 1 23 . 1 1 13 13 LEU H H 13 8.709 8.709 8.744 -0.035 18925 609 1 23 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.396 -0.004 18925 610 1 23 . 1 1 14 14 TYR H H 14 7.742 7.742 8.341 -0.599 18925 611 1 23 . 1 1 15 15 GLN HA H 15 4.021 4.021 3.633 0.388 18925 612 1 23 . 1 1 15 15 GLN H H 15 7.606 7.606 7.945 -0.339 18925 613 1 23 . 1 1 16 16 LEU HA H 16 4.215 4.215 3.824 0.391 18925 614 1 23 . 1 1 16 16 LEU H H 16 7.966 7.966 7.828 0.138 18925 615 1 23 . 1 1 17 17 GLU HA H 17 4.145 4.145 3.903 0.242 18925 616 1 23 . 1 1 17 17 GLU H H 17 8.225 8.225 8.598 -0.373 18925 617 1 23 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.591 -0.068 18925 618 1 23 . 1 1 18 18 ASN H H 18 7.503 7.503 7.223 0.280 18925 619 1 23 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.377 0.201 18925 620 1 23 . 1 1 19 19 TYR H H 19 7.996 7.996 7.392 0.604 18925 621 1 23 . 1 1 20 20 CYS H H 20 7.606 7.606 8.037 -0.431 18925 622 1 24 . 1 1 3 3 VAL HA H 3 3.742 3.742 4.466 -0.724 18925 623 1 24 . 1 1 3 3 VAL H H 3 8.235 8.235 7.371 0.864 18925 624 1 24 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.165 0.041 18925 625 1 24 . 1 1 4 4 GLU H H 4 8.415 8.415 8.637 -0.222 18925 626 1 24 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.842 0.283 18925 627 1 24 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.595 0.305 18925 628 1 24 . 1 1 8 8 THR HA H 8 4.217 4.217 4.284 -0.067 18925 629 1 24 . 1 1 9 9 SER HA H 9 4.702 4.702 4.794 -0.092 18925 630 1 24 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.336 -0.114 18925 631 1 24 . 1 1 10 10 ILE H H 10 7.901 7.901 8.265 -0.364 18925 632 1 24 . 1 1 12 12 SER HA H 12 4.629 4.629 4.777 -0.148 18925 633 1 24 . 1 1 12 12 SER H H 12 8.616 8.616 9.171 -0.555 18925 634 1 24 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.077 -0.080 18925 635 1 24 . 1 1 13 13 LEU H H 13 8.709 8.709 8.847 -0.138 18925 636 1 24 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.142 0.250 18925 637 1 24 . 1 1 14 14 TYR H H 14 7.742 7.742 8.517 -0.775 18925 638 1 24 . 1 1 15 15 GLN HA H 15 4.021 4.021 3.746 0.275 18925 639 1 24 . 1 1 15 15 GLN H H 15 7.606 7.606 7.794 -0.188 18925 640 1 24 . 1 1 16 16 LEU HA H 16 4.215 4.215 4.203 0.012 18925 641 1 24 . 1 1 16 16 LEU H H 16 7.966 7.966 7.290 0.676 18925 642 1 24 . 1 1 17 17 GLU HA H 17 4.145 4.145 3.885 0.260 18925 643 1 24 . 1 1 17 17 GLU H H 17 8.225 8.225 8.361 -0.136 18925 644 1 24 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.335 0.188 18925 645 1 24 . 1 1 18 18 ASN H H 18 7.503 7.503 7.674 -0.171 18925 646 1 24 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.441 0.137 18925 647 1 24 . 1 1 19 19 TYR H H 19 7.996 7.996 7.617 0.379 18925 648 1 24 . 1 1 20 20 CYS H H 20 7.606 7.606 7.729 -0.123 18925 649 1 25 . 1 1 3 3 VAL HA H 3 3.742 3.742 4.218 -0.476 18925 650 1 25 . 1 1 3 3 VAL H H 3 8.235 8.235 8.589 -0.354 18925 651 1 25 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.227 -0.021 18925 652 1 25 . 1 1 4 4 GLU H H 4 8.415 8.415 8.352 0.063 18925 653 1 25 . 1 1 6 6 CYS HA H 6 5.125 5.125 3.929 1.196 18925 654 1 25 . 1 1 7 7 CYS HA H 7 4.900 4.900 3.929 0.971 18925 655 1 25 . 1 1 8 8 THR HA H 8 4.217 4.217 4.127 0.090 18925 656 1 25 . 1 1 9 9 SER HA H 9 4.702 4.702 4.674 0.028 18925 657 1 25 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.151 0.071 18925 658 1 25 . 1 1 10 10 ILE H H 10 7.901 7.901 8.309 -0.408 18925 659 1 25 . 1 1 12 12 SER HA H 12 4.629 4.629 4.763 -0.134 18925 660 1 25 . 1 1 12 12 SER H H 12 8.616 8.616 9.156 -0.540 18925 661 1 25 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.103 -0.106 18925 662 1 25 . 1 1 13 13 LEU H H 13 8.709 8.709 8.836 -0.127 18925 663 1 25 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.337 0.056 18925 664 1 25 . 1 1 14 14 TYR H H 14 7.742 7.742 8.383 -0.641 18925 665 1 25 . 1 1 15 15 GLN HA H 15 4.021 4.021 4.044 -0.023 18925 666 1 25 . 1 1 15 15 GLN H H 15 7.606 7.606 7.763 -0.157 18925 667 1 25 . 1 1 16 16 LEU HA H 16 4.215 4.215 4.262 -0.047 18925 668 1 25 . 1 1 16 16 LEU H H 16 7.966 7.966 7.989 -0.023 18925 669 1 25 . 1 1 17 17 GLU HA H 17 4.145 4.145 4.028 0.117 18925 670 1 25 . 1 1 17 17 GLU H H 17 8.225 8.225 8.198 0.027 18925 671 1 25 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.388 0.135 18925 672 1 25 . 1 1 18 18 ASN H H 18 7.503 7.503 7.659 -0.156 18925 673 1 25 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.525 0.053 18925 674 1 25 . 1 1 19 19 TYR H H 19 7.996 7.996 7.836 0.160 18925 675 1 25 . 1 1 20 20 CYS H H 20 7.606 7.606 7.948 -0.342 18925 676 1 26 . 1 1 3 3 VAL HA H 3 3.742 3.742 4.147 -0.405 18925 677 1 26 . 1 1 3 3 VAL H H 3 8.235 8.235 8.611 -0.376 18925 678 1 26 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.324 -0.118 18925 679 1 26 . 1 1 4 4 GLU H H 4 8.415 8.415 8.486 -0.071 18925 680 1 26 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.611 0.514 18925 681 1 26 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.048 0.852 18925 682 1 26 . 1 1 8 8 THR HA H 8 4.217 4.217 4.238 -0.021 18925 683 1 26 . 1 1 9 9 SER HA H 9 4.702 4.702 4.642 0.060 18925 684 1 26 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.174 0.048 18925 685 1 26 . 1 1 10 10 ILE H H 10 7.901 7.901 8.334 -0.433 18925 686 1 26 . 1 1 12 12 SER HA H 12 4.629 4.629 4.542 0.087 18925 687 1 26 . 1 1 12 12 SER H H 12 8.616 8.616 8.516 0.100 18925 688 1 26 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.014 -0.017 18925 689 1 26 . 1 1 13 13 LEU H H 13 8.709 8.709 8.797 -0.088 18925 690 1 26 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.172 0.220 18925 691 1 26 . 1 1 14 14 TYR H H 14 7.742 7.742 8.468 -0.726 18925 692 1 26 . 1 1 15 15 GLN HA H 15 4.021 4.021 3.927 0.094 18925 693 1 26 . 1 1 15 15 GLN H H 15 7.606 7.606 7.969 -0.363 18925 694 1 26 . 1 1 16 16 LEU HA H 16 4.215 4.215 4.261 -0.046 18925 695 1 26 . 1 1 16 16 LEU H H 16 7.966 7.966 8.279 -0.313 18925 696 1 26 . 1 1 17 17 GLU HA H 17 4.145 4.145 4.139 0.006 18925 697 1 26 . 1 1 17 17 GLU H H 17 8.225 8.225 8.165 0.060 18925 698 1 26 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.367 0.156 18925 699 1 26 . 1 1 18 18 ASN H H 18 7.503 7.503 7.581 -0.078 18925 700 1 26 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.352 0.226 18925 701 1 26 . 1 1 19 19 TYR H H 19 7.996 7.996 7.591 0.405 18925 702 1 26 . 1 1 20 20 CYS H H 20 7.606 7.606 7.714 -0.108 18925 703 1 27 . 1 1 3 3 VAL HA H 3 3.742 3.742 4.198 -0.456 18925 704 1 27 . 1 1 3 3 VAL H H 3 8.235 8.235 8.112 0.123 18925 705 1 27 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.508 -0.302 18925 706 1 27 . 1 1 4 4 GLU H H 4 8.415 8.415 7.661 0.754 18925 707 1 27 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.697 0.428 18925 708 1 27 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.567 0.333 18925 709 1 27 . 1 1 8 8 THR HA H 8 4.217 4.217 4.511 -0.294 18925 710 1 27 . 1 1 9 9 SER HA H 9 4.702 4.702 4.229 0.473 18925 711 1 27 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.167 0.055 18925 712 1 27 . 1 1 10 10 ILE H H 10 7.901 7.901 8.395 -0.494 18925 713 1 27 . 1 1 12 12 SER HA H 12 4.629 4.629 4.708 -0.079 18925 714 1 27 . 1 1 12 12 SER H H 12 8.616 8.616 8.793 -0.177 18925 715 1 27 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.109 -0.112 18925 716 1 27 . 1 1 13 13 LEU H H 13 8.709 8.709 8.832 -0.123 18925 717 1 27 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.208 0.184 18925 718 1 27 . 1 1 14 14 TYR H H 14 7.742 7.742 8.497 -0.755 18925 719 1 27 . 1 1 15 15 GLN HA H 15 4.021 4.021 3.714 0.307 18925 720 1 27 . 1 1 15 15 GLN H H 15 7.606 7.606 7.838 -0.232 18925 721 1 27 . 1 1 16 16 LEU HA H 16 4.215 4.215 3.902 0.313 18925 722 1 27 . 1 1 16 16 LEU H H 16 7.966 7.966 7.268 0.698 18925 723 1 27 . 1 1 17 17 GLU HA H 17 4.145 4.145 3.884 0.261 18925 724 1 27 . 1 1 17 17 GLU H H 17 8.225 8.225 8.515 -0.290 18925 725 1 27 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.353 0.170 18925 726 1 27 . 1 1 18 18 ASN H H 18 7.503 7.503 7.645 -0.142 18925 727 1 27 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.452 0.126 18925 728 1 27 . 1 1 19 19 TYR H H 19 7.996 7.996 7.405 0.591 18925 729 1 27 . 1 1 20 20 CYS H H 20 7.606 7.606 7.896 -0.290 18925 730 1 28 . 1 1 3 3 VAL HA H 3 3.742 3.742 3.804 -0.062 18925 731 1 28 . 1 1 3 3 VAL H H 3 8.235 8.235 8.253 -0.018 18925 732 1 28 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.388 -0.182 18925 733 1 28 . 1 1 4 4 GLU H H 4 8.415 8.415 8.169 0.246 18925 734 1 28 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.566 0.559 18925 735 1 28 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.820 0.080 18925 736 1 28 . 1 1 8 8 THR HA H 8 4.217 4.217 3.937 0.280 18925 737 1 28 . 1 1 9 9 SER HA H 9 4.702 4.702 4.659 0.043 18925 738 1 28 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.174 0.048 18925 739 1 28 . 1 1 10 10 ILE H H 10 7.901 7.901 8.497 -0.596 18925 740 1 28 . 1 1 12 12 SER HA H 12 4.629 4.629 4.572 0.057 18925 741 1 28 . 1 1 12 12 SER H H 12 8.616 8.616 8.314 0.302 18925 742 1 28 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.114 -0.117 18925 743 1 28 . 1 1 13 13 LEU H H 13 8.709 8.709 8.874 -0.165 18925 744 1 28 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.101 0.291 18925 745 1 28 . 1 1 14 14 TYR H H 14 7.742 7.742 8.292 -0.550 18925 746 1 28 . 1 1 15 15 GLN HA H 15 4.021 4.021 3.940 0.081 18925 747 1 28 . 1 1 15 15 GLN H H 15 7.606 7.606 8.117 -0.511 18925 748 1 28 . 1 1 16 16 LEU HA H 16 4.215 4.215 4.222 -0.007 18925 749 1 28 . 1 1 16 16 LEU H H 16 7.966 7.966 7.586 0.380 18925 750 1 28 . 1 1 17 17 GLU HA H 17 4.145 4.145 3.987 0.158 18925 751 1 28 . 1 1 17 17 GLU H H 17 8.225 8.225 7.792 0.433 18925 752 1 28 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.653 -0.130 18925 753 1 28 . 1 1 18 18 ASN H H 18 7.503 7.503 7.652 -0.149 18925 754 1 28 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.372 0.206 18925 755 1 28 . 1 1 19 19 TYR H H 19 7.996 7.996 8.047 -0.051 18925 756 1 28 . 1 1 20 20 CYS H H 20 7.606 7.606 8.021 -0.415 18925 757 1 29 . 1 1 3 3 VAL HA H 3 3.742 3.742 4.327 -0.585 18925 758 1 29 . 1 1 3 3 VAL H H 3 8.235 8.235 7.977 0.258 18925 759 1 29 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.111 0.095 18925 760 1 29 . 1 1 4 4 GLU H H 4 8.415 8.415 8.578 -0.163 18925 761 1 29 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.237 0.888 18925 762 1 29 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.673 0.227 18925 763 1 29 . 1 1 8 8 THR HA H 8 4.217 4.217 3.961 0.256 18925 764 1 29 . 1 1 9 9 SER HA H 9 4.702 4.702 4.600 0.102 18925 765 1 29 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.152 0.070 18925 766 1 29 . 1 1 10 10 ILE H H 10 7.901 7.901 8.312 -0.411 18925 767 1 29 . 1 1 12 12 SER HA H 12 4.629 4.629 4.643 -0.014 18925 768 1 29 . 1 1 12 12 SER H H 12 8.616 8.616 8.316 0.300 18925 769 1 29 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.074 -0.077 18925 770 1 29 . 1 1 13 13 LEU H H 13 8.709 8.709 8.748 -0.039 18925 771 1 29 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.068 0.324 18925 772 1 29 . 1 1 14 14 TYR H H 14 7.742 7.742 7.906 -0.164 18925 773 1 29 . 1 1 15 15 GLN HA H 15 4.021 4.021 3.744 0.277 18925 774 1 29 . 1 1 15 15 GLN H H 15 7.606 7.606 7.918 -0.312 18925 775 1 29 . 1 1 16 16 LEU HA H 16 4.215 4.215 4.156 0.059 18925 776 1 29 . 1 1 16 16 LEU H H 16 7.966 7.966 7.251 0.715 18925 777 1 29 . 1 1 17 17 GLU HA H 17 4.145 4.145 3.873 0.272 18925 778 1 29 . 1 1 17 17 GLU H H 17 8.225 8.225 8.728 -0.503 18925 779 1 29 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.451 0.072 18925 780 1 29 . 1 1 18 18 ASN H H 18 7.503 7.503 7.401 0.102 18925 781 1 29 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.404 0.174 18925 782 1 29 . 1 1 19 19 TYR H H 19 7.996 7.996 7.450 0.546 18925 783 1 29 . 1 1 20 20 CYS H H 20 7.606 7.606 8.023 -0.417 18925 784 1 30 . 1 1 3 3 VAL HA H 3 3.742 3.742 4.160 -0.418 18925 785 1 30 . 1 1 3 3 VAL H H 3 8.235 8.235 8.445 -0.210 18925 786 1 30 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.041 0.165 18925 787 1 30 . 1 1 4 4 GLU H H 4 8.415 8.415 8.684 -0.269 18925 788 1 30 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.353 0.772 18925 789 1 30 . 1 1 7 7 CYS HA H 7 4.900 4.900 3.975 0.925 18925 790 1 30 . 1 1 8 8 THR HA H 8 4.217 4.217 4.224 -0.007 18925 791 1 30 . 1 1 9 9 SER HA H 9 4.702 4.702 4.570 0.132 18925 792 1 30 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.162 0.060 18925 793 1 30 . 1 1 10 10 ILE H H 10 7.901 7.901 8.156 -0.255 18925 794 1 30 . 1 1 12 12 SER HA H 12 4.629 4.629 4.818 -0.189 18925 795 1 30 . 1 1 12 12 SER H H 12 8.616 8.616 8.303 0.313 18925 796 1 30 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.102 -0.105 18925 797 1 30 . 1 1 13 13 LEU H H 13 8.709 8.709 8.820 -0.111 18925 798 1 30 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.084 0.308 18925 799 1 30 . 1 1 14 14 TYR H H 14 7.742 7.742 8.373 -0.631 18925 800 1 30 . 1 1 15 15 GLN HA H 15 4.021 4.021 4.088 -0.067 18925 801 1 30 . 1 1 15 15 GLN H H 15 7.606 7.606 7.973 -0.367 18925 802 1 30 . 1 1 16 16 LEU HA H 16 4.215 4.215 4.255 -0.040 18925 803 1 30 . 1 1 16 16 LEU H H 16 7.966 7.966 8.547 -0.581 18925 804 1 30 . 1 1 17 17 GLU HA H 17 4.145 4.145 4.004 0.141 18925 805 1 30 . 1 1 17 17 GLU H H 17 8.225 8.225 8.578 -0.353 18925 806 1 30 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.480 0.043 18925 807 1 30 . 1 1 18 18 ASN H H 18 7.503 7.503 7.660 -0.157 18925 808 1 30 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.341 0.237 18925 809 1 30 . 1 1 19 19 TYR H H 19 7.996 7.996 7.882 0.114 18925 810 1 30 . 1 1 20 20 CYS H H 20 7.606 7.606 7.972 -0.366 18925 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 18925 2 1 1 "Average Difference" HA 15 0.383 -0.164 0.358 18925 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18925 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 18925 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 18925 6 1 1 "Average Difference" HN 12 0.324 0.124 0.313 18925 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 18925 8 1 2 "Average Difference" HA 15 0.291 -0.132 0.268 18925 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18925 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 18925 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 18925 12 1 2 "Average Difference" HN 12 0.408 0.087 0.417 18925 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 18925 14 1 3 "Average Difference" HA 15 0.342 -0.091 0.341 18925 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18925 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 18925 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 18925 18 1 3 "Average Difference" HN 12 0.339 -0.020 0.353 18925 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 18925 20 1 4 "Average Difference" HA 15 0.309 -0.043 0.317 18925 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18925 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 18925 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 18925 24 1 4 "Average Difference" HN 12 0.283 0.058 0.289 18925 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 18925 26 1 5 "Average Difference" HA 15 0.358 -0.096 0.357 18925 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18925 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 18925 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 18925 30 1 5 "Average Difference" HN 12 0.392 0.174 0.367 18925 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 18925 32 1 6 "Average Difference" HA 15 0.368 -0.100 0.366 18925 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18925 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 18925 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 18925 36 1 6 "Average Difference" HN 12 0.370 0.180 0.337 18925 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 18925 38 1 7 "Average Difference" HA 15 0.269 -0.032 0.277 18925 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18925 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 18925 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 18925 42 1 7 "Average Difference" HN 12 0.355 0.033 0.369 18925 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 18925 44 1 8 "Average Difference" HA 15 0.339 -0.176 0.300 18925 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18925 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 18925 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 18925 48 1 8 "Average Difference" HN 12 0.435 0.054 0.451 18925 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 18925 50 1 9 "Average Difference" HA 15 0.298 -0.051 0.304 18925 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18925 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 18925 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 18925 54 1 9 "Average Difference" HN 12 0.372 0.097 0.375 18925 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 18925 56 1 10 "Average Difference" HA 15 0.199 -0.023 0.205 18925 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18925 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 18925 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 18925 60 1 10 "Average Difference" HN 12 0.284 0.148 0.253 18925 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 18925 62 1 11 "Average Difference" HA 15 0.256 -0.185 0.183 18925 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 18925 64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 18925 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 18925 66 1 11 "Average Difference" HN 12 0.555 0.022 0.579 18925 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 18925 68 1 12 "Average Difference" HA 15 0.248 -0.077 0.244 18925 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 18925 70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 18925 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 18925 72 1 12 "Average Difference" HN 12 0.301 0.114 0.292 18925 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 18925 74 1 13 "Average Difference" HA 15 0.256 -0.113 0.238 18925 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 18925 76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 18925 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 18925 78 1 13 "Average Difference" HN 12 0.486 0.015 0.507 18925 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 18925 80 1 14 "Average Difference" HA 15 0.313 -0.062 0.317 18925 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 18925 82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 18925 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 18925 84 1 14 "Average Difference" HN 12 0.416 -0.016 0.434 18925 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 18925 86 1 15 "Average Difference" HA 15 0.231 -0.133 0.196 18925 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 18925 88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 18925 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 18925 90 1 15 "Average Difference" HN 12 0.493 0.038 0.514 18925 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 18925 92 1 16 "Average Difference" HA 15 0.190 -0.010 0.196 18925 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 18925 94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 18925 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 18925 96 1 16 "Average Difference" HN 12 0.333 0.073 0.339 18925 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 18925 98 1 17 "Average Difference" HA 15 0.327 -0.037 0.337 18925 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 18925 100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 18925 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 18925 102 1 17 "Average Difference" HN 12 0.265 0.158 0.222 18925 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 18925 104 1 18 "Average Difference" HA 15 0.234 -0.045 0.238 18925 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 18925 106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 18925 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 18925 108 1 18 "Average Difference" HN 12 0.316 0.132 0.299 18925 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 18925 110 1 19 "Average Difference" HA 15 0.261 -0.155 0.217 18925 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 18925 112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 18925 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 18925 114 1 19 "Average Difference" HN 12 0.369 0.043 0.383 18925 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 18925 116 1 20 "Average Difference" HA 15 0.264 -0.026 0.272 18925 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 18925 118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 18925 119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 18925 120 1 20 "Average Difference" HN 12 0.275 0.164 0.230 18925 121 1 21 "Average Difference" N 0 0.000 0.000 0.000 18925 122 1 21 "Average Difference" HA 15 0.296 -0.035 0.304 18925 123 1 21 "Average Difference" C 0 0.000 0.000 0.000 18925 124 1 21 "Average Difference" CA 0 0.000 0.000 0.000 18925 125 1 21 "Average Difference" CB 0 0.000 0.000 0.000 18925 126 1 21 "Average Difference" HN 12 0.407 0.221 0.357 18925 127 1 22 "Average Difference" N 0 0.000 0.000 0.000 18925 128 1 22 "Average Difference" HA 15 0.184 -0.041 0.186 18925 129 1 22 "Average Difference" C 0 0.000 0.000 0.000 18925 130 1 22 "Average Difference" CA 0 0.000 0.000 0.000 18925 131 1 22 "Average Difference" CB 0 0.000 0.000 0.000 18925 132 1 22 "Average Difference" HN 12 0.332 0.180 0.292 18925 133 1 23 "Average Difference" N 0 0.000 0.000 0.000 18925 134 1 23 "Average Difference" HA 15 0.317 -0.150 0.288 18925 135 1 23 "Average Difference" C 0 0.000 0.000 0.000 18925 136 1 23 "Average Difference" CA 0 0.000 0.000 0.000 18925 137 1 23 "Average Difference" CB 0 0.000 0.000 0.000 18925 138 1 23 "Average Difference" HN 12 0.367 0.067 0.377 18925 139 1 24 "Average Difference" N 0 0.000 0.000 0.000 18925 140 1 24 "Average Difference" HA 15 0.260 -0.035 0.267 18925 141 1 24 "Average Difference" C 0 0.000 0.000 0.000 18925 142 1 24 "Average Difference" CA 0 0.000 0.000 0.000 18925 143 1 24 "Average Difference" CB 0 0.000 0.000 0.000 18925 144 1 24 "Average Difference" HN 12 0.461 0.063 0.477 18925 145 1 25 "Average Difference" N 0 0.000 0.000 0.000 18925 146 1 25 "Average Difference" HA 15 0.423 -0.127 0.418 18925 147 1 25 "Average Difference" C 0 0.000 0.000 0.000 18925 148 1 25 "Average Difference" CA 0 0.000 0.000 0.000 18925 149 1 25 "Average Difference" CB 0 0.000 0.000 0.000 18925 150 1 25 "Average Difference" HN 12 0.317 0.208 0.250 18925 151 1 26 "Average Difference" N 0 0.000 0.000 0.000 18925 152 1 26 "Average Difference" HA 15 0.296 -0.110 0.285 18925 153 1 26 "Average Difference" C 0 0.000 0.000 0.000 18925 154 1 26 "Average Difference" CA 0 0.000 0.000 0.000 18925 155 1 26 "Average Difference" CB 0 0.000 0.000 0.000 18925 156 1 26 "Average Difference" HN 12 0.328 0.166 0.296 18925 157 1 27 "Average Difference" N 0 0.000 0.000 0.000 18925 158 1 27 "Average Difference" HA 15 0.290 -0.094 0.284 18925 159 1 27 "Average Difference" C 0 0.000 0.000 0.000 18925 160 1 27 "Average Difference" CA 0 0.000 0.000 0.000 18925 161 1 27 "Average Difference" CB 0 0.000 0.000 0.000 18925 162 1 27 "Average Difference" HN 12 0.458 0.028 0.478 18925 163 1 28 "Average Difference" N 0 0.000 0.000 0.000 18925 164 1 28 "Average Difference" HA 15 0.205 -0.087 0.192 18925 165 1 28 "Average Difference" C 0 0.000 0.000 0.000 18925 166 1 28 "Average Difference" CA 0 0.000 0.000 0.000 18925 167 1 28 "Average Difference" CB 0 0.000 0.000 0.000 18925 168 1 28 "Average Difference" HN 12 0.368 0.091 0.373 18925 169 1 29 "Average Difference" N 0 0.000 0.000 0.000 18925 170 1 29 "Average Difference" HA 15 0.324 -0.143 0.301 18925 171 1 29 "Average Difference" C 0 0.000 0.000 0.000 18925 172 1 29 "Average Difference" CA 0 0.000 0.000 0.000 18925 173 1 29 "Average Difference" CB 0 0.000 0.000 0.000 18925 174 1 29 "Average Difference" HN 12 0.379 0.007 0.396 18925 175 1 30 "Average Difference" N 0 0.000 0.000 0.000 18925 176 1 30 "Average Difference" HA 15 0.356 -0.130 0.343 18925 177 1 30 "Average Difference" C 0 0.000 0.000 0.000 18925 178 1 30 "Average Difference" CA 0 0.000 0.000 0.000 18925 179 1 30 "Average Difference" CB 0 0.000 0.000 0.000 18925 180 1 30 "Average Difference" HN 12 0.349 0.239 0.265 18925 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 18925 _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 3 3 VAL HA H 3 3.742 3.742 4.145 -0.403 18925 2 1 . 1 1 3 3 VAL H H 3 8.235 8.235 8.193 0.042 18925 3 1 . 1 1 4 4 GLU HA H 4 4.206 4.206 4.385 -0.179 18925 4 1 . 1 1 4 4 GLU H H 4 8.415 8.415 8.250 0.165 18925 5 1 . 1 1 6 6 CYS HA H 6 5.125 5.125 4.520 0.605 18925 6 1 . 1 1 7 7 CYS HA H 7 4.900 4.900 4.467 0.433 18925 7 1 . 1 1 8 8 THR HA H 8 4.217 4.217 4.215 0.002 18925 8 1 . 1 1 9 9 SER HA H 9 4.702 4.702 4.634 0.068 18925 9 1 . 1 1 10 10 ILE HA H 10 4.222 4.222 4.146 0.076 18925 10 1 . 1 1 10 10 ILE H H 10 7.901 7.901 8.286 -0.385 18925 11 1 . 1 1 12 12 SER HA H 12 4.629 4.629 4.628 0.001 18925 12 1 . 1 1 12 12 SER H H 12 8.616 8.616 8.682 -0.066 18925 13 1 . 1 1 13 13 LEU HA H 13 3.997 3.997 4.094 -0.097 18925 14 1 . 1 1 13 13 LEU H H 13 8.709 8.709 8.753 -0.044 18925 15 1 . 1 1 14 14 TYR HA H 14 4.392 4.392 4.200 0.192 18925 16 1 . 1 1 14 14 TYR H H 14 7.742 7.742 8.264 -0.522 18925 17 1 . 1 1 15 15 GLN HA H 15 4.021 4.021 3.889 0.132 18925 18 1 . 1 1 15 15 GLN H H 15 7.606 7.606 7.863 -0.257 18925 19 1 . 1 1 16 16 LEU HA H 16 4.215 4.215 4.126 0.089 18925 20 1 . 1 1 16 16 LEU H H 16 7.966 7.966 7.813 0.153 18925 21 1 . 1 1 17 17 GLU HA H 17 4.145 4.145 3.965 0.180 18925 22 1 . 1 1 17 17 GLU H H 17 8.225 8.225 8.334 -0.109 18925 23 1 . 1 1 18 18 ASN HA H 18 4.523 4.523 4.405 0.118 18925 24 1 . 1 1 18 18 ASN H H 18 7.503 7.503 7.614 -0.111 18925 25 1 . 1 1 19 19 TYR HA H 19 4.578 4.578 4.444 0.134 18925 26 1 . 1 1 19 19 TYR H H 19 7.996 7.996 7.680 0.316 18925 27 1 . 1 1 20 20 CYS H H 20 7.606 7.606 7.969 -0.363 18925 stop_ save_