Calculation Parameters
| Chain Sequence(s) |
QVQLKQSGPGLVQPSQSLSITCTVSGFSLTNYGVHWVRQSPGKGLEWLGVIWSGGNTDYNTPFTSRLSINKDNSKSQVFFKMNSLQSNDTAIYYCARALTYYDYEFAYWGQGTLVTVSAASTKGPSVFPLAPGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKRVEPKDILLTQSPVILSVSPGERVSFSCRASQSIGTNIHWYQQRTNGSPRLLIKYASESISGIPSRFSGSGSGTDFTLSINSVESEDIADYYCQQNNNWPTTFGAGTKLELKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGA
input.pdb
|
| Selected Chain(s) | D (Heavy), C (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 | Q | D | -1.3669 | Soluble |
| 2 | V | D | -0.6981 | Soluble |
| 3 | Q | D | -1.2496 | Soluble |
| 4 | L | D | 0.0000 | Buried |
| 5 | K | D | -2.1090 | Soluble |
| 6 | Q | D | 0.0000 | Buried |
| 7 | S | D | -0.7893 | Soluble |
| 8 | G | D | -0.9821 | Soluble |
| 9 | P | D | -0.4532 | Soluble |
| 11 | G | D | -0.4185 | Soluble |
| 12 | L | D | -0.1452 | Soluble |
| 13 | V | D | 0.0000 | Buried |
| 14 | Q | D | -1.7860 | Soluble |
| 15 | P | D | -1.6365 | Soluble |
| 16 | S | D | -1.6809 | Soluble |
| 17 | Q | D | -2.1070 | Soluble |
| 18 | S | D | -1.9197 | Soluble |
| 19 | L | D | 0.0000 | Buried |
| 20 | S | D | -0.8780 | Soluble |
| 21 | I | D | 0.0000 | Buried |
| 22 | T | D | -0.5042 | Soluble |
| 23 | C | D | 0.0000 | Buried |
| 24 | T | D | -1.0580 | Soluble |
| 25 | V | D | 0.0000 | Buried |
| 26 | S | D | -0.9445 | Soluble |
| 27 | G | D | -0.8851 | Soluble |
| 28 | F | D | -0.5037 | Soluble |
| 29 | S | D | -0.8575 | Soluble |
| 30 | L | D | 0.0000 | Buried |
| 35 | T | D | -0.8740 | Soluble |
| 36 | N | D | -0.8298 | Soluble |
| 37 | Y | D | 0.4826 | Aggregation-prone |
| 38 | G | D | 0.0000 | Buried |
| 39 | V | D | 0.0000 | Buried |
| 40 | H | D | 0.0000 | Buried |
| 41 | W | D | 0.0000 | Buried |
| 42 | V | D | 0.0000 | Buried |
| 43 | R | D | 0.0000 | Buried |
| 44 | Q | D | -0.5098 | Soluble |
| 45 | S | D | -1.0263 | Soluble |
| 46 | P | D | -1.1906 | Soluble |
| 47 | G | D | -1.7508 | Soluble |
| 48 | K | D | -2.2346 | Soluble |
| 49 | G | D | -1.2184 | Soluble |
| 50 | L | D | 0.0000 | Buried |
| 51 | E | D | 0.0000 | Buried |
| 52 | W | D | 0.0000 | Buried |
| 53 | L | D | 0.0000 | Buried |
| 54 | G | D | 0.0000 | Buried |
| 55 | V | D | 0.0000 | Buried |
| 56 | I | D | 0.0000 | Buried |
| 57 | W | D | -0.3458 | Soluble |
| 58 | S | D | -0.5804 | Soluble |
| 59 | G | D | -1.1080 | Soluble |
| 63 | G | D | -1.4653 | Soluble |
| 64 | N | D | -1.8478 | Soluble |
| 65 | T | D | -1.3451 | Soluble |
| 66 | D | D | -1.1064 | Soluble |
| 67 | Y | D | -0.4002 | Soluble |
| 68 | N | D | 0.0000 | Buried |
| 69 | T | D | -0.1946 | Soluble |
| 70 | P | D | -0.3550 | Soluble |
| 71 | F | D | 0.0000 | Buried |
| 72 | T | D | -0.4561 | Soluble |
| 74 | S | D | -0.6479 | Soluble |
| 75 | R | D | -1.2588 | Soluble |
| 76 | L | D | 0.0000 | Buried |
| 77 | S | D | -1.2546 | Soluble |
| 78 | I | D | 0.0000 | Buried |
| 79 | N | D | -1.7398 | Soluble |
| 80 | K | D | -1.3807 | Soluble |
| 81 | D | D | -1.7574 | Soluble |
| 82 | N | D | -2.1165 | Soluble |
| 83 | S | D | -1.6735 | Soluble |
| 84 | K | D | -2.3449 | Soluble |
| 85 | S | D | -1.6177 | Soluble |
| 86 | Q | D | -1.4719 | Soluble |
| 87 | V | D | 0.0000 | Buried |
| 88 | F | D | -0.2316 | Soluble |
| 89 | F | D | 0.0000 | Buried |
| 90 | K | D | -2.0007 | Soluble |
| 91 | M | D | 0.0000 | Buried |
| 92 | N | D | -2.3401 | Soluble |
| 93 | S | D | -1.7177 | Soluble |
| 94 | L | D | 0.0000 | Buried |
| 95 | Q | D | -2.1062 | Soluble |
| 96 | S | D | -1.5225 | Soluble |
| 97 | N | D | -2.0279 | Soluble |
| 98 | D | D | 0.0000 | Buried |
| 99 | T | D | -0.6464 | Soluble |
| 100 | A | D | 0.0000 | Buried |
| 101 | I | D | 0.3846 | Aggregation-prone |
| 102 | Y | D | 0.0000 | Buried |
| 103 | Y | D | 0.0000 | Buried |
| 104 | C | D | 0.0000 | Buried |
| 105 | A | D | 0.0000 | Buried |
| 106 | R | D | 0.0000 | Buried |
| 107 | A | D | 0.0000 | Buried |
| 108 | L | D | 1.0206 | Aggregation-prone |
| 109 | T | D | 1.1493 | Aggregation-prone |
| 110 | Y | D | 1.8494 | Aggregation-prone |
| 111 | Y | D | 1.9494 | Aggregation-prone |
| 112 | D | D | 0.0000 | Buried |
| 113 | Y | D | 0.0000 | Buried |
| 114 | E | D | 0.0000 | Buried |
| 115 | F | D | 0.0000 | Buried |
| 116 | A | D | 0.2084 | Aggregation-prone |
| 117 | Y | D | 0.2410 | Aggregation-prone |
| 118 | W | D | -0.4116 | Soluble |
| 119 | G | D | 0.0000 | Buried |
| 120 | Q | D | -1.7502 | Soluble |
| 121 | G | D | -0.9125 | Soluble |
| 122 | T | D | 0.0000 | Buried |
| 123 | L | D | 0.1650 | Aggregation-prone |
| 124 | V | D | 0.0000 | Buried |
| 125 | T | D | -0.4035 | Soluble |
| 126 | V | D | 0.0000 | Buried |
| 127 | S | D | -0.6303 | Soluble |
| 128 | A | D | -0.4457 | Soluble |
| 129 | A | D | -0.3667 | Soluble |
| 130 | S | D | -0.5791 | Soluble |
| 131 | T | D | -0.7053 | Soluble |
| 132 | K | D | -1.4238 | Soluble |
| 133 | G | D | -1.5337 | Soluble |
| 134 | P | D | -0.7276 | Soluble |
| 135 | S | D | -0.4767 | Soluble |
| 136 | V | D | 0.0000 | Buried |
| 137 | F | D | 0.0000 | Buried |
| 138 | P | D | 0.0000 | Buried |
| 139 | L | D | 0.0000 | Buried |
| 140 | A | D | -0.9749 | Soluble |
| 141 | P | D | -0.6088 | Soluble |
| 142 | G | D | -0.6334 | Soluble |
| 143 | T | D | -0.4829 | Soluble |
| 144 | A | D | -0.2543 | Soluble |
| 145 | A | D | 0.0000 | Buried |
| 146 | L | D | 0.0000 | Buried |
| 147 | G | D | 0.0000 | Buried |
| 148 | C | D | 0.0000 | Buried |
| 149 | L | D | 0.0000 | Buried |
| 150 | V | D | 0.0000 | Buried |
| 151 | K | D | 0.0000 | Buried |
| 152 | D | D | -0.5169 | Soluble |
| 153 | Y | D | 0.0000 | Buried |
| 154 | F | D | 0.0000 | Buried |
| 155 | P | D | 0.0000 | Buried |
| 156 | E | D | -0.3863 | Soluble |
| 157 | P | D | -0.6210 | Soluble |
| 158 | V | D | -0.6820 | Soluble |
| 159 | T | D | -0.6465 | Soluble |
| 160 | V | D | -0.2640 | Soluble |
| 161 | S | D | -0.4574 | Soluble |
| 162 | W | D | 0.0000 | Buried |
| 163 | N | D | -0.8130 | Soluble |
| 164 | S | D | -0.6965 | Soluble |
| 165 | G | D | -0.5411 | Soluble |
| 166 | A | D | -0.2507 | Soluble |
| 167 | L | D | -0.0116 | Soluble |
| 168 | T | D | -0.1678 | Soluble |
| 169 | S | D | -0.1872 | Soluble |
| 170 | G | D | -0.2206 | Soluble |
| 171 | V | D | 0.1537 | Aggregation-prone |
| 172 | H | D | -0.2816 | Soluble |
| 173 | T | D | 0.0120 | Aggregation-prone |
| 174 | F | D | 0.0000 | Buried |
| 175 | P | D | -0.4547 | Soluble |
| 176 | A | D | 0.2778 | Aggregation-prone |
| 177 | V | D | 0.6033 | Aggregation-prone |
| 178 | L | D | 1.3127 | Aggregation-prone |
| 179 | Q | D | 0.3283 | Aggregation-prone |
| 180 | S | D | -0.0362 | Soluble |
| 181 | S | D | -0.2144 | Soluble |
| 182 | G | D | 0.0332 | Aggregation-prone |
| 183 | L | D | 0.0796 | Aggregation-prone |
| 184 | Y | D | 0.4548 | Aggregation-prone |
| 185 | S | D | 0.0000 | Buried |
| 186 | L | D | 0.3675 | Aggregation-prone |
| 187 | S | D | 0.0000 | Buried |
| 188 | S | D | 0.0000 | Buried |
| 189 | V | D | 0.0000 | Buried |
| 190 | V | D | 0.0000 | Buried |
| 191 | T | D | -0.1391 | Soluble |
| 192 | V | D | 0.0000 | Buried |
| 193 | P | D | -0.5621 | Soluble |
| 194 | S | D | -0.5072 | Soluble |
| 195 | S | D | -0.5947 | Soluble |
| 196 | S | D | -0.5849 | Soluble |
| 197 | L | D | -0.6813 | Soluble |
| 198 | G | D | -0.8745 | Soluble |
| 199 | T | D | -0.6958 | Soluble |
| 200 | Q | D | -1.1499 | Soluble |
| 201 | T | D | -1.0111 | Soluble |
| 202 | Y | D | 0.0000 | Buried |
| 203 | I | D | -1.1584 | Soluble |
| 204 | C | D | 0.0000 | Buried |
| 205 | N | D | -1.4978 | Soluble |
| 206 | V | D | 0.0000 | Buried |
| 207 | N | D | -2.1606 | Soluble |
| 208 | H | D | 0.0000 | Buried |
| 209 | K | D | -2.6547 | Soluble |
| 210 | P | D | -1.5624 | Soluble |
| 211 | S | D | -1.8284 | Soluble |
| 212 | N | D | -2.5448 | Soluble |
| 213 | T | D | -2.1103 | Soluble |
| 214 | K | D | -2.7237 | Soluble |
| 215 | V | D | -1.6437 | Soluble |
| 216 | D | D | -2.4673 | Soluble |
| 217 | K | D | -1.9832 | Soluble |
| 218 | R | D | -2.3012 | Soluble |
| 219 | V | D | 0.0000 | Buried |
| 220 | E | D | -2.0910 | Soluble |
| 221 | P | D | -1.5066 | Soluble |
| 222 | K | D | -2.0407 | Soluble |
| 1 | D | C | -1.2398 | Soluble |
| 2 | I | C | -0.2790 | Soluble |
| 3 | L | C | 0.7192 | Aggregation-prone |
| 4 | L | C | 0.0000 | Buried |
| 5 | T | C | -0.3688 | Soluble |
| 6 | Q | C | 0.0000 | Buried |
| 7 | S | C | 0.1941 | Aggregation-prone |
| 8 | P | C | 0.9231 | Aggregation-prone |
| 9 | V | C | 1.9825 | Aggregation-prone |
| 10 | I | C | 1.5306 | Aggregation-prone |
| 11 | L | C | 0.6058 | Aggregation-prone |
| 12 | S | C | -0.2072 | Soluble |
| 13 | V | C | 0.0000 | Buried |
| 14 | S | C | -1.8008 | Soluble |
| 15 | P | C | -1.9162 | Soluble |
| 16 | G | C | -2.2461 | Soluble |
| 17 | E | C | -3.1705 | Soluble |
| 18 | R | C | -3.4951 | Soluble |
| 19 | V | C | 0.0000 | Buried |
| 20 | S | C | -0.9342 | Soluble |
| 21 | F | C | 0.0000 | Buried |
| 22 | S | C | -0.8113 | Soluble |
| 23 | C | C | 0.0000 | Buried |
| 24 | R | C | -2.4817 | Soluble |
| 25 | A | C | 0.0000 | Buried |
| 26 | S | C | -0.9362 | Soluble |
| 27 | Q | C | -1.2809 | Soluble |
| 28 | S | C | -1.4365 | Soluble |
| 29 | I | C | 0.0000 | Buried |
| 36 | G | C | -0.9270 | Soluble |
| 37 | T | C | -0.7369 | Soluble |
| 38 | N | C | -0.7835 | Soluble |
| 39 | I | C | 0.0000 | Buried |
| 40 | H | C | 0.0000 | Buried |
| 41 | W | C | 0.0000 | Buried |
| 42 | Y | C | 0.0000 | Buried |
| 43 | Q | C | 0.0000 | Buried |
| 44 | Q | C | -1.3219 | Soluble |
| 45 | R | C | -2.0330 | Soluble |
| 46 | T | C | -1.7382 | Soluble |
| 47 | N | C | -1.8399 | Soluble |
| 48 | G | C | -1.5348 | Soluble |
| 49 | S | C | -1.0222 | Soluble |
| 50 | P | C | 0.0000 | Buried |
| 51 | R | C | -0.7269 | Soluble |
| 52 | L | C | 0.0000 | Buried |
| 53 | L | C | 0.0000 | Buried |
| 54 | I | C | 0.0000 | Buried |
| 55 | K | C | -0.8466 | Soluble |
| 56 | Y | C | -0.5913 | Soluble |
| 57 | A | C | 0.0000 | Buried |
| 65 | S | C | -1.2158 | Soluble |
| 66 | E | C | -1.8913 | Soluble |
| 67 | S | C | -1.1476 | Soluble |
| 68 | I | C | -0.4996 | Soluble |
| 69 | S | C | -0.3389 | Soluble |
| 70 | G | C | -0.4764 | Soluble |
| 71 | I | C | -0.2903 | Soluble |
| 72 | P | C | -0.3823 | Soluble |
| 74 | S | C | -0.6908 | Soluble |
| 75 | R | C | -1.3295 | Soluble |
| 76 | F | C | 0.0000 | Buried |
| 77 | S | C | -0.9715 | Soluble |
| 78 | G | C | -0.7160 | Soluble |
| 79 | S | C | -0.8487 | Soluble |
| 80 | G | C | -1.0899 | Soluble |
| 83 | S | C | -0.9322 | Soluble |
| 84 | G | C | -1.2950 | Soluble |
| 85 | T | C | -1.8998 | Soluble |
| 86 | D | C | -2.5765 | Soluble |
| 87 | F | C | 0.0000 | Buried |
| 88 | T | C | -0.8905 | Soluble |
| 89 | L | C | 0.0000 | Buried |
| 90 | S | C | 0.0000 | Buried |
| 91 | I | C | 0.0000 | Buried |
| 92 | N | C | -2.8735 | Soluble |
| 93 | S | C | -2.4832 | Soluble |
| 94 | V | C | 0.0000 | Buried |
| 95 | E | C | -2.5997 | Soluble |
| 96 | S | C | -2.3768 | Soluble |
| 97 | E | C | -2.4732 | Soluble |
| 98 | D | C | 0.0000 | Buried |
| 99 | I | C | -1.6073 | Soluble |
| 100 | A | C | 0.0000 | Buried |
| 101 | D | C | -0.9119 | Soluble |
| 102 | Y | C | 0.0000 | Buried |
| 103 | Y | C | 0.0000 | Buried |
| 104 | C | C | 0.0000 | Buried |
| 105 | Q | C | 0.0000 | Buried |
| 106 | Q | C | 0.0000 | Buried |
| 107 | N | C | -0.6568 | Soluble |
| 108 | N | C | -1.1517 | Soluble |
| 109 | N | C | -0.9719 | Soluble |
| 114 | W | C | 0.1484 | Aggregation-prone |
| 115 | P | C | 0.0000 | Buried |
| 116 | T | C | 0.0000 | Buried |
| 117 | T | C | 0.0252 | Aggregation-prone |
| 118 | F | C | 0.2307 | Aggregation-prone |
| 119 | G | C | 0.0000 | Buried |
| 120 | A | C | 0.0501 | Aggregation-prone |
| 121 | G | C | 0.1183 | Aggregation-prone |
| 122 | T | C | 0.0000 | Buried |
| 123 | K | C | -0.2069 | Soluble |
| 124 | L | C | 0.0000 | Buried |
| 125 | E | C | -0.9557 | Soluble |
| 126 | L | C | 0.0000 | Buried |
| 127 | K | C | -1.5368 | Soluble |
| 128 | R | C | -1.1114 | Soluble |
| 129 | T | C | -0.0161 | Soluble |
| 130 | V | C | 0.5641 | Aggregation-prone |
| 131 | A | C | 0.2690 | Aggregation-prone |
| 132 | A | C | -0.0194 | Soluble |
| 133 | P | C | 0.0000 | Buried |
| 134 | S | C | -0.1458 | Soluble |
| 135 | V | C | 0.0000 | Buried |
| 136 | F | C | 0.1006 | Aggregation-prone |
| 137 | I | C | 0.0896 | Aggregation-prone |
| 138 | F | C | 0.0000 | Buried |
| 139 | P | C | -0.5422 | Soluble |
| 140 | P | C | -0.7713 | Soluble |
| 141 | S | C | -1.7707 | Soluble |
| 142 | D | C | -2.8182 | Soluble |
| 143 | E | C | -2.7547 | Soluble |
| 144 | Q | C | 0.0000 | Buried |
| 145 | L | C | -2.1926 | Soluble |
| 146 | K | C | -2.6588 | Soluble |
| 147 | S | C | -1.6105 | Soluble |
| 148 | G | C | -1.2510 | Soluble |
| 149 | T | C | -0.8110 | Soluble |
| 150 | A | C | 0.0000 | Buried |
| 151 | S | C | 0.0000 | Buried |
| 152 | V | C | 0.0000 | Buried |
| 153 | V | C | 0.0000 | Buried |
| 154 | C | C | 0.0000 | Buried |
| 155 | L | C | 0.0000 | Buried |
| 156 | L | C | 0.0000 | Buried |
| 157 | N | C | 0.0000 | Buried |
| 158 | N | C | -0.7879 | Soluble |
| 159 | F | C | 0.0000 | Buried |
| 160 | Y | C | 0.0000 | Buried |
| 161 | P | C | -1.5823 | Soluble |
| 162 | R | C | -2.7443 | Soluble |
| 163 | E | C | -3.1922 | Soluble |
| 164 | A | C | -2.3077 | Soluble |
| 165 | K | C | -2.3053 | Soluble |
| 166 | V | C | -1.1885 | Soluble |
| 167 | Q | C | -0.8204 | Soluble |
| 168 | W | C | 0.0000 | Buried |
| 169 | K | C | -0.7256 | Soluble |
| 170 | V | C | 0.0000 | Buried |
| 171 | D | C | -1.9592 | Soluble |
| 172 | N | C | -1.6002 | Soluble |
| 173 | A | C | -0.3411 | Soluble |
| 174 | L | C | 0.5256 | Aggregation-prone |
| 175 | Q | C | -0.2170 | Soluble |
| 176 | S | C | -0.4513 | Soluble |
| 177 | G | C | -0.8972 | Soluble |
| 178 | N | C | -0.8178 | Soluble |
| 179 | S | C | -1.2040 | Soluble |
| 180 | Q | C | -1.4821 | Soluble |
| 181 | E | C | -2.0290 | Soluble |
| 182 | S | C | -0.8954 | Soluble |
| 183 | V | C | -0.8412 | Soluble |
| 184 | T | C | -1.1084 | Soluble |
| 185 | E | C | -2.2018 | Soluble |
| 186 | Q | C | 0.0000 | Buried |
| 187 | D | C | -2.0675 | Soluble |
| 188 | S | C | -2.4897 | Soluble |
| 189 | K | C | -2.8043 | Soluble |
| 190 | D | C | -2.1130 | Soluble |
| 191 | S | C | 0.0000 | Buried |
| 192 | T | C | 0.0000 | Buried |
| 193 | Y | C | -1.3071 | Soluble |
| 194 | S | C | 0.0000 | Buried |
| 195 | L | C | 0.0000 | Buried |
| 196 | S | C | 0.0000 | Buried |
| 197 | S | C | 0.0000 | Buried |
| 198 | T | C | -0.6969 | Soluble |
| 199 | L | C | 0.0000 | Buried |
| 200 | T | C | -0.3206 | Soluble |
| 201 | L | C | -0.7314 | Soluble |
| 202 | S | C | -1.0989 | Soluble |
| 203 | K | C | -2.0887 | Soluble |
| 204 | A | C | -2.0774 | Soluble |
| 205 | D | C | -2.8274 | Soluble |
| 206 | Y | C | 0.0000 | Buried |
| 207 | E | C | -3.7811 | Soluble |
| 208 | K | C | -3.8162 | Soluble |
| 209 | H | C | -3.2603 | Soluble |
| 210 | K | C | -3.1234 | Soluble |
| 211 | V | C | -1.4006 | Soluble |
| 212 | Y | C | 0.0000 | Buried |
| 213 | A | C | 0.0000 | Buried |
| 214 | C | C | 0.0000 | Buried |
| 215 | E | C | -1.0272 | Soluble |
| 216 | V | C | 0.0000 | Buried |
| 217 | T | C | -1.2219 | Soluble |
| 218 | H | C | 0.0000 | Buried |
| 219 | Q | C | -1.6959 | Soluble |
| 220 | G | C | -0.3259 | Soluble |
| 221 | L | C | -0.1647 | Soluble |
| 222 | S | C | -0.4300 | Soluble |
| 223 | S | C | -0.4252 | Soluble |
| 224 | P | C | -0.5739 | Soluble |
| 225 | V | C | -0.1191 | Soluble |
| 226 | T | C | -0.5362 | Soluble |
| 227 | K | C | -0.7647 | Soluble |
| 228 | S | C | -0.6412 | Soluble |
| 229 | F | C | -0.7253 | Soluble |
| 230 | N | C | -1.6294 | Soluble |
| 231 | R | C | -2.1877 | Soluble |
| 232 | G | C | -1.4044 | Soluble |
| 233 | A | C | -0.7281 | 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 | -0.6656 | 2.6675 | CSV PDB |
| 4.5 | -0.7036 | 2.5966 | CSV PDB |
| 5.0 | -0.7487 | 2.5175 | CSV PDB |
| 5.5 | -0.7923 | 2.4355 | CSV PDB |
| 6.0 | -0.8241 | 2.3525 | CSV PDB |
| 6.5 | -0.8356 | 2.2694 | CSV PDB |
| 7.0 | -0.8265 | 2.1867 | CSV PDB |
| 7.5 | -0.8031 | 2.173 | CSV PDB |
| 8.0 | -0.7719 | 2.1725 | CSV PDB |
| 8.5 | -0.7348 | 2.1709 | CSV PDB |
| 9.0 | -0.6922 | 2.2066 | CSV PDB |