Calculation Parameters
| Chain Sequence(s) |
DVQLQESGPSLVKPSQSLSLTCTVTGYSITSDFAWNWIRQFPGNKLEWMGYISYSGNTRYNPSLKSRISITRDTSKNQFFLQLNSVTIEDTATYYCVTAGRGFPYWGQGTLVTVSAAKTTPPSVYPLAPGCGDTTGSSVTLGCLVKGYFPESVTVTWNSGSLSSSVHTFPALLQSGLYTMSSSVTVPSSTWPSETVTCSVAHPASSTTVDKKLEPSDILMTQSPSSMSVSLGDTVSITCHSSQDINSNIGWLQQKPGKSFKGLIYHGTNLDDEVPSRFSGSGSGADYSLTISSLESEDFADYYCVQYAQFPWTFGGGTKLEIKRADAAPTVSIFPPSSEQLTSGGASVVCFLNNFYPKDINVKWKIDGSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERHNSYTCEATHKTSTSPIVKSFNRNEC
input.pdb
|
| Selected Chain(s) | B (Heavy), A (Light) |
| Distance of Aggregation | 10 Å |
| FoldX Energy Minimization | Yes |
| pH Calculations | Yes |
| Downloads | Download all data (.tar.gz) |
Aggrescan4D Profile
Per-Residue A4D Scores
Download CSVResidues with A4D score > 0.0 are highlighted as aggregation-prone.
| Index | Residue | Chain | A4D Score | Classification |
|---|---|---|---|---|
| 1 | D | B | -2.3835 | Soluble |
| 2 | V | B | -1.2309 | Soluble |
| 3 | Q | B | -1.9550 | Soluble |
| 4 | L | B | 0.0000 | Buried |
| 5 | Q | B | -1.9366 | Soluble |
| 6 | E | B | -1.0442 | Soluble |
| 7 | S | B | -0.8257 | Soluble |
| 8 | G | B | -0.5460 | Soluble |
| 9 | P | B | -0.0288 | Soluble |
| 11 | S | B | 0.5080 | Aggregation-prone |
| 12 | L | B | 0.6748 | Aggregation-prone |
| 13 | V | B | 0.0000 | Buried |
| 14 | K | B | -1.5656 | Soluble |
| 15 | P | B | -1.1636 | Soluble |
| 16 | S | B | -1.2613 | Soluble |
| 17 | Q | B | -2.0056 | Soluble |
| 18 | S | B | -1.4699 | Soluble |
| 19 | L | B | 0.0000 | Buried |
| 20 | S | B | -0.7200 | Soluble |
| 21 | L | B | 0.0000 | Buried |
| 22 | T | B | -0.5181 | Soluble |
| 23 | C | B | 0.0000 | Buried |
| 24 | T | B | -1.1208 | Soluble |
| 25 | V | B | 0.0000 | Buried |
| 26 | T | B | -1.1501 | Soluble |
| 27 | G | B | -0.8857 | Soluble |
| 28 | Y | B | -0.2848 | Soluble |
| 29 | S | B | -0.2540 | Soluble |
| 30 | I | B | 0.0000 | Buried |
| 31 | T | B | -0.1792 | Soluble |
| 35 | S | B | -0.3125 | Soluble |
| 36 | D | B | -0.5654 | Soluble |
| 37 | F | B | -0.2479 | Soluble |
| 38 | A | B | -0.1917 | Soluble |
| 39 | W | B | 0.0000 | Buried |
| 40 | N | B | 0.0000 | Buried |
| 41 | W | B | 0.0000 | Buried |
| 42 | I | B | 0.0000 | Buried |
| 43 | R | B | 0.0000 | Buried |
| 44 | Q | B | 0.0000 | Buried |
| 45 | F | B | -0.9059 | Soluble |
| 46 | P | B | -0.9986 | Soluble |
| 47 | G | B | -1.3558 | Soluble |
| 48 | N | B | -1.9810 | Soluble |
| 49 | K | B | -2.3182 | Soluble |
| 50 | L | B | 0.0000 | Buried |
| 51 | E | B | -0.6334 | Soluble |
| 52 | W | B | 0.0000 | Buried |
| 53 | M | B | 0.0000 | Buried |
| 54 | G | B | 0.0000 | Buried |
| 55 | Y | B | -0.2832 | Soluble |
| 56 | I | B | 0.0000 | Buried |
| 57 | S | B | -0.4968 | Soluble |
| 58 | Y | B | 0.0728 | Aggregation-prone |
| 59 | S | B | -0.4315 | Soluble |
| 63 | G | B | -0.7486 | Soluble |
| 64 | N | B | -1.5259 | Soluble |
| 65 | T | B | -1.1449 | Soluble |
| 66 | R | B | -1.5062 | Soluble |
| 67 | Y | B | -0.9484 | Soluble |
| 68 | N | B | 0.0000 | Buried |
| 69 | P | B | -1.2919 | Soluble |
| 70 | S | B | -0.8806 | Soluble |
| 71 | L | B | 0.0000 | Buried |
| 72 | K | B | -2.1447 | Soluble |
| 74 | S | B | -1.3102 | Soluble |
| 75 | R | B | -1.2814 | Soluble |
| 76 | I | B | 0.0000 | Buried |
| 77 | S | B | -0.7691 | Soluble |
| 78 | I | B | 0.0000 | Buried |
| 79 | T | B | -0.5295 | Soluble |
| 80 | R | B | -0.8399 | Soluble |
| 81 | D | B | -1.2351 | Soluble |
| 82 | T | B | -1.0549 | Soluble |
| 83 | S | B | -1.3379 | Soluble |
| 84 | K | B | -2.1640 | Soluble |
| 85 | N | B | -1.4022 | Soluble |
| 86 | Q | B | -1.2283 | Soluble |
| 87 | F | B | 0.0000 | Buried |
| 88 | F | B | -0.0703 | Soluble |
| 89 | L | B | 0.0000 | Buried |
| 90 | Q | B | -0.8501 | Soluble |
| 91 | L | B | 0.0000 | Buried |
| 92 | N | B | -1.2658 | Soluble |
| 93 | S | B | -1.2855 | Soluble |
| 94 | V | B | 0.0000 | Buried |
| 95 | T | B | -0.5455 | Soluble |
| 96 | I | B | 0.2556 | Aggregation-prone |
| 97 | E | B | -1.1170 | Soluble |
| 98 | D | B | 0.0000 | Buried |
| 99 | T | B | 0.2487 | Aggregation-prone |
| 100 | A | B | 0.0000 | Buried |
| 101 | T | B | 0.4862 | Aggregation-prone |
| 102 | Y | B | 0.0000 | Buried |
| 103 | Y | B | 0.0000 | Buried |
| 104 | C | B | 0.0000 | Buried |
| 105 | V | B | 0.0000 | Buried |
| 106 | T | B | 0.0000 | Buried |
| 107 | A | B | 0.0000 | Buried |
| 108 | G | B | -1.0812 | Soluble |
| 109 | R | B | -2.2058 | Soluble |
| 114 | G | B | 0.0000 | Buried |
| 115 | F | B | 0.0000 | Buried |
| 116 | P | B | -0.9374 | Soluble |
| 117 | Y | B | -0.6305 | Soluble |
| 118 | W | B | -0.5833 | Soluble |
| 119 | G | B | 0.0000 | Buried |
| 120 | Q | B | -1.9537 | Soluble |
| 121 | G | B | 0.0000 | Buried |
| 122 | T | B | 0.1011 | Aggregation-prone |
| 123 | L | B | 1.5691 | Aggregation-prone |
| 124 | V | B | 0.0000 | Buried |
| 125 | T | B | 0.3285 | Aggregation-prone |
| 126 | V | B | 0.0000 | Buried |
| 127 | S | B | -0.4526 | Soluble |
| 128 | A | B | -0.6139 | Soluble |
| 129 | A | B | -1.0779 | Soluble |
| 130 | K | B | -1.7391 | Soluble |
| 131 | T | B | -1.0437 | Soluble |
| 132 | T | B | -0.6916 | Soluble |
| 133 | P | B | -0.4255 | Soluble |
| 134 | P | B | 0.0000 | Buried |
| 135 | S | B | -0.3376 | Soluble |
| 136 | V | B | 0.0000 | Buried |
| 137 | Y | B | 0.0000 | Buried |
| 138 | P | B | -1.1490 | Soluble |
| 139 | L | B | 0.0000 | Buried |
| 140 | A | B | -0.4739 | Soluble |
| 141 | P | B | -0.6071 | Soluble |
| 142 | G | B | -0.6975 | Soluble |
| 143 | C | B | -0.4107 | Soluble |
| 144 | G | B | -1.3435 | Soluble |
| 145 | D | B | -2.0877 | Soluble |
| 146 | T | B | -1.0675 | Soluble |
| 147 | T | B | -0.8786 | Soluble |
| 148 | G | B | -0.9050 | Soluble |
| 149 | S | B | -0.6719 | Soluble |
| 150 | S | B | -0.6347 | Soluble |
| 151 | V | B | 0.0000 | Buried |
| 152 | T | B | -0.0891 | Soluble |
| 153 | L | B | 0.0000 | Buried |
| 154 | G | B | 0.0000 | Buried |
| 155 | C | B | 0.0000 | Buried |
| 156 | L | B | 0.0000 | Buried |
| 157 | V | B | 0.0000 | Buried |
| 158 | K | B | -0.0691 | Soluble |
| 159 | G | B | -0.0534 | Soluble |
| 160 | Y | B | 0.0000 | Buried |
| 161 | F | B | 0.0000 | Buried |
| 162 | P | B | -0.8265 | Soluble |
| 163 | E | B | -1.0395 | Soluble |
| 164 | S | B | -0.7062 | Soluble |
| 165 | V | B | -0.2432 | Soluble |
| 166 | T | B | -0.1157 | Soluble |
| 167 | V | B | -0.0827 | Soluble |
| 168 | T | B | -0.4618 | Soluble |
| 169 | W | B | 0.0000 | Buried |
| 170 | N | B | -1.2128 | Soluble |
| 171 | S | B | -0.7596 | Soluble |
| 172 | G | B | -0.7578 | Soluble |
| 173 | S | B | -0.6429 | Soluble |
| 174 | L | B | -0.3225 | Soluble |
| 175 | S | B | -0.2739 | Soluble |
| 176 | S | B | -0.1656 | Soluble |
| 177 | S | B | -0.2088 | Soluble |
| 178 | V | B | 0.2659 | Aggregation-prone |
| 179 | H | B | 0.0000 | Buried |
| 180 | T | B | -0.1061 | Soluble |
| 181 | F | B | 0.0000 | Buried |
| 182 | P | B | -0.2643 | Soluble |
| 183 | A | B | 0.1973 | Aggregation-prone |
| 184 | L | B | 0.6950 | Aggregation-prone |
| 185 | L | B | 1.3253 | Aggregation-prone |
| 186 | Q | B | 0.4710 | Aggregation-prone |
| 187 | S | B | -0.0626 | Soluble |
| 188 | G | B | -0.0464 | Soluble |
| 189 | L | B | 0.1021 | Aggregation-prone |
| 190 | Y | B | 0.3767 | Aggregation-prone |
| 191 | T | B | 0.0000 | Buried |
| 192 | M | B | 0.0000 | Buried |
| 193 | S | B | 0.0000 | Buried |
| 194 | S | B | 0.0000 | Buried |
| 195 | S | B | 0.0000 | Buried |
| 196 | V | B | 0.0000 | Buried |
| 197 | T | B | -0.0729 | Soluble |
| 198 | V | B | 0.0000 | Buried |
| 199 | P | B | -0.5969 | Soluble |
| 200 | S | B | -0.6210 | Soluble |
| 201 | S | B | -0.7767 | Soluble |
| 202 | T | B | -0.9618 | Soluble |
| 203 | W | B | 0.0000 | Buried |
| 204 | P | B | -1.3990 | Soluble |
| 205 | S | B | -1.2877 | Soluble |
| 206 | E | B | -2.0630 | Soluble |
| 207 | T | B | -1.7748 | Soluble |
| 208 | V | B | 0.0000 | Buried |
| 209 | T | B | -1.9423 | Soluble |
| 210 | C | B | 0.0000 | Buried |
| 211 | S | B | -1.1644 | Soluble |
| 212 | V | B | 0.0000 | Buried |
| 213 | A | B | -0.2112 | Soluble |
| 214 | H | B | 0.0000 | Buried |
| 215 | P | B | -0.4946 | Soluble |
| 216 | A | B | -0.3855 | Soluble |
| 217 | S | B | -0.2824 | Soluble |
| 218 | S | B | -0.3579 | Soluble |
| 219 | T | B | -0.1056 | Soluble |
| 220 | T | B | -0.3059 | Soluble |
| 221 | V | B | -0.4430 | Soluble |
| 222 | D | B | -2.1763 | Soluble |
| 223 | K | B | -2.1885 | Soluble |
| 224 | K | B | -2.8478 | Soluble |
| 225 | L | B | 0.0000 | Buried |
| 226 | E | B | -2.4762 | Soluble |
| 227 | P | B | -1.1052 | Soluble |
| 228 | S | B | -0.4099 | Soluble |
| 1 | D | A | -1.5658 | Soluble |
| 2 | I | A | 0.0000 | Buried |
| 3 | L | A | 0.7151 | Aggregation-prone |
| 4 | M | A | 0.0000 | Buried |
| 5 | T | A | -0.2562 | Soluble |
| 6 | Q | A | 0.0000 | Buried |
| 7 | S | A | -0.4826 | Soluble |
| 8 | P | A | -0.4345 | Soluble |
| 9 | S | A | -0.5153 | Soluble |
| 10 | S | A | -0.3948 | Soluble |
| 11 | M | A | -0.2298 | Soluble |
| 12 | S | A | -0.6026 | Soluble |
| 13 | V | A | 0.0000 | Buried |
| 14 | S | A | -0.3132 | Soluble |
| 15 | L | A | 0.1439 | Aggregation-prone |
| 16 | G | A | -0.6306 | Soluble |
| 17 | D | A | -0.8890 | Soluble |
| 18 | T | A | -0.5439 | Soluble |
| 19 | V | A | 0.0000 | Buried |
| 20 | S | A | -0.3745 | Soluble |
| 21 | I | A | 0.0000 | Buried |
| 22 | T | A | -0.7695 | Soluble |
| 23 | C | A | 0.0000 | Buried |
| 24 | H | A | -1.5236 | Soluble |
| 25 | S | A | 0.0000 | Buried |
| 26 | S | A | -1.1453 | Soluble |
| 27 | Q | A | -2.5236 | Soluble |
| 28 | D | A | -3.2663 | Soluble |
| 29 | I | A | 0.0000 | Buried |
| 36 | N | A | -2.4989 | Soluble |
| 37 | S | A | -1.7754 | Soluble |
| 38 | N | A | -1.3285 | Soluble |
| 39 | I | A | 0.0000 | Buried |
| 40 | G | A | 0.0000 | Buried |
| 41 | W | A | 0.0000 | Buried |
| 42 | L | A | 0.0000 | Buried |
| 43 | Q | A | 0.0000 | Buried |
| 44 | Q | A | -1.0608 | Soluble |
| 45 | K | A | -1.5884 | Soluble |
| 46 | P | A | -1.5912 | Soluble |
| 47 | G | A | -1.4638 | Soluble |
| 48 | K | A | -2.3863 | Soluble |
| 49 | S | A | -1.5976 | Soluble |
| 50 | F | A | 0.0000 | Buried |
| 51 | K | A | -1.0013 | Soluble |
| 52 | G | A | 0.0000 | Buried |
| 53 | L | A | 0.0000 | Buried |
| 54 | I | A | 0.0000 | Buried |
| 55 | Y | A | 0.0000 | Buried |
| 56 | H | A | -1.3855 | Soluble |
| 57 | G | A | 0.0000 | Buried |
| 65 | T | A | -0.6204 | Soluble |
| 66 | N | A | -0.9984 | Soluble |
| 67 | L | A | -0.8532 | Soluble |
| 68 | D | A | -1.7726 | Soluble |
| 69 | D | A | -3.0459 | Soluble |
| 70 | E | A | -2.8663 | Soluble |
| 71 | V | A | -1.4391 | Soluble |
| 72 | P | A | -0.9142 | Soluble |
| 74 | S | A | -0.5899 | Soluble |
| 75 | R | A | -0.8296 | Soluble |
| 76 | F | A | 0.0000 | Buried |
| 77 | S | A | -0.3895 | Soluble |
| 78 | G | A | -0.4505 | Soluble |
| 79 | S | A | -0.9239 | Soluble |
| 80 | G | A | -1.4753 | Soluble |
| 83 | S | A | -1.7162 | Soluble |
| 84 | G | A | -2.3195 | Soluble |
| 85 | A | A | -2.5797 | Soluble |
| 86 | D | A | -2.8544 | Soluble |
| 87 | Y | A | 0.0000 | Buried |
| 88 | S | A | -0.8189 | Soluble |
| 89 | L | A | 0.0000 | Buried |
| 90 | T | A | -0.3476 | Soluble |
| 91 | I | A | 0.0000 | Buried |
| 92 | S | A | -0.7693 | Soluble |
| 93 | S | A | -0.9048 | Soluble |
| 94 | L | A | 0.0000 | Buried |
| 95 | E | A | -2.1059 | Soluble |
| 96 | S | A | -1.4404 | Soluble |
| 97 | E | A | -2.2792 | Soluble |
| 98 | D | A | 0.0000 | Buried |
| 99 | F | A | -0.6065 | Soluble |
| 100 | A | A | 0.0000 | Buried |
| 101 | D | A | -0.5865 | Soluble |
| 102 | Y | A | 0.0000 | Buried |
| 103 | Y | A | 0.0000 | Buried |
| 104 | C | A | 0.0000 | Buried |
| 105 | V | A | 0.0000 | Buried |
| 106 | Q | A | 0.0000 | Buried |
| 107 | Y | A | -0.2676 | Soluble |
| 108 | A | A | -0.9949 | Soluble |
| 109 | Q | A | -0.7238 | Soluble |
| 114 | F | A | -0.2764 | Soluble |
| 115 | P | A | 0.0000 | Buried |
| 116 | W | A | 0.0000 | Buried |
| 117 | T | A | 0.0289 | Aggregation-prone |
| 118 | F | A | 0.0475 | Aggregation-prone |
| 119 | G | A | 0.0000 | Buried |
| 120 | G | A | -1.0065 | Soluble |
| 121 | G | A | 0.0000 | Buried |
| 122 | T | A | 0.0000 | Buried |
| 123 | K | A | -0.4472 | Soluble |
| 124 | L | A | 0.0000 | Buried |
| 125 | E | A | 0.0000 | Buried |
| 126 | I | A | -0.0578 | Soluble |
| 127 | K | A | -1.5883 | Soluble |
| 128 | R | A | -1.6276 | Soluble |
| 129 | A | A | -1.4073 | Soluble |
| 130 | D | A | -2.4359 | Soluble |
| 131 | A | A | -1.2705 | Soluble |
| 132 | A | A | -0.6803 | Soluble |
| 133 | P | A | 0.0000 | Buried |
| 134 | T | A | -0.1047 | Soluble |
| 135 | V | A | 0.0000 | Buried |
| 136 | S | A | -0.2893 | Soluble |
| 137 | I | A | 0.0000 | Buried |
| 138 | F | A | 0.0000 | Buried |
| 139 | P | A | -0.2672 | Soluble |
| 140 | P | A | 0.0000 | Buried |
| 141 | S | A | -0.5663 | Soluble |
| 142 | S | A | -0.9576 | Soluble |
| 143 | E | A | -1.6644 | Soluble |
| 144 | Q | A | 0.0000 | Buried |
| 145 | L | A | -1.1701 | Soluble |
| 146 | T | A | -0.9080 | Soluble |
| 147 | S | A | -0.8581 | Soluble |
| 148 | G | A | -1.2663 | Soluble |
| 149 | G | A | -1.0953 | Soluble |
| 150 | A | A | 0.0000 | Buried |
| 151 | S | A | 0.0000 | Buried |
| 152 | V | A | 0.0000 | Buried |
| 153 | V | A | 0.0000 | Buried |
| 154 | C | A | 0.0000 | Buried |
| 155 | F | A | 0.0000 | Buried |
| 156 | L | A | 0.0000 | Buried |
| 157 | N | A | 0.0000 | Buried |
| 158 | N | A | -0.5199 | Soluble |
| 159 | F | A | 0.0000 | Buried |
| 160 | Y | A | 0.0000 | Buried |
| 161 | P | A | -2.0522 | Soluble |
| 162 | K | A | -2.2142 | Soluble |
| 163 | D | A | -2.5928 | Soluble |
| 164 | I | A | -1.7095 | Soluble |
| 165 | N | A | -1.7519 | Soluble |
| 166 | V | A | -0.7557 | Soluble |
| 167 | K | A | -1.6522 | Soluble |
| 168 | W | A | 0.0000 | Buried |
| 169 | K | A | -2.2519 | Soluble |
| 170 | I | A | 0.0000 | Buried |
| 171 | D | A | -2.7848 | Soluble |
| 172 | G | A | -1.9952 | Soluble |
| 173 | S | A | -2.1100 | Soluble |
| 174 | E | A | -3.1380 | Soluble |
| 175 | R | A | -2.6333 | Soluble |
| 176 | Q | A | -2.4852 | Soluble |
| 177 | N | A | -2.0432 | Soluble |
| 178 | G | A | -0.8668 | Soluble |
| 179 | V | A | -0.5578 | Soluble |
| 180 | L | A | -0.0649 | Soluble |
| 181 | N | A | -0.2227 | Soluble |
| 182 | S | A | 0.0910 | Aggregation-prone |
| 183 | W | A | 0.0900 | Aggregation-prone |
| 184 | T | A | -0.6783 | Soluble |
| 185 | D | A | -1.8671 | Soluble |
| 186 | Q | A | 0.0000 | Buried |
| 187 | D | A | -1.5669 | Soluble |
| 188 | S | A | -1.5242 | Soluble |
| 189 | K | A | -2.1780 | Soluble |
| 190 | D | A | -1.5650 | Soluble |
| 191 | S | A | -1.5171 | Soluble |
| 192 | T | A | 0.0000 | Buried |
| 193 | Y | A | 0.0000 | Buried |
| 194 | S | A | 0.0000 | Buried |
| 195 | M | A | 0.0000 | Buried |
| 196 | S | A | 0.0000 | Buried |
| 197 | S | A | 0.0000 | Buried |
| 198 | T | A | 0.0000 | Buried |
| 199 | L | A | 0.0000 | Buried |
| 200 | T | A | -0.2281 | Soluble |
| 201 | L | A | 0.0000 | Buried |
| 202 | T | A | -1.5289 | Soluble |
| 203 | K | A | -2.5433 | Soluble |
| 204 | D | A | -3.3805 | Soluble |
| 205 | E | A | -2.7171 | Soluble |
| 206 | Y | A | 0.0000 | Buried |
| 207 | E | A | -4.1315 | Soluble |
| 208 | R | A | -3.9485 | Soluble |
| 209 | H | A | -3.3317 | Soluble |
| 210 | N | A | -3.6586 | Soluble |
| 211 | S | A | -2.1241 | Soluble |
| 212 | Y | A | 0.0000 | Buried |
| 213 | T | A | -1.1720 | Soluble |
| 214 | C | A | 0.0000 | Buried |
| 215 | E | A | -0.4527 | Soluble |
| 216 | A | A | 0.0000 | Buried |
| 217 | T | A | -1.0514 | Soluble |
| 218 | H | A | 0.0000 | Buried |
| 219 | K | A | -2.4419 | Soluble |
| 220 | T | A | -1.3740 | Soluble |
| 221 | S | A | -0.7401 | Soluble |
| 222 | T | A | -0.5739 | Soluble |
| 223 | S | A | -0.4005 | Soluble |
| 224 | P | A | -0.3910 | Soluble |
| 225 | I | A | 0.4793 | Aggregation-prone |
| 226 | V | A | 0.5404 | Aggregation-prone |
| 227 | K | A | -0.4092 | Soluble |
| 228 | S | A | -0.8322 | Soluble |
| 229 | F | A | -1.6341 | Soluble |
| 230 | N | A | -2.9125 | Soluble |
| 231 | R | A | -3.2997 | Soluble |
| 232 | N | A | -3.2630 | Soluble |
| 233 | E | A | -2.6235 | Soluble |
| 234 | C | A | -0.5777 | Soluble |
3D Structure — colored by A4D score
pH-Dependent Aggregation Profiles
A4D scores calculated across 11 pH conditions (4.0–9.0, step 0.5). Click a row to view the structure at that pH. The input structure is globular — max score is recommended for pH analysis.
| pH | Avg A4D Score | Max A4D Score | Downloads |
|---|---|---|---|
| 4.0 | -0.5467 | 2.3499 | CSV PDB |
| 4.5 | -0.6023 | 2.2586 | CSV PDB |
| 5.0 | -0.6677 | 2.2112 | CSV PDB |
| 5.5 | -0.7327 | 2.2065 | CSV PDB |
| 6.0 | -0.787 | 2.2025 | CSV PDB |
| 6.5 | -0.8227 | 2.1999 | CSV PDB |
| 7.0 | -0.839 | 2.1986 | CSV PDB |
| 7.5 | -0.8416 | 2.1981 | CSV PDB |
| 8.0 | -0.8355 | 2.1979 | CSV PDB |
| 8.5 | -0.8212 | 2.1979 | CSV PDB |
| 9.0 | -0.7975 | 2.1978 | CSV PDB |