Calculation Parameters
| Chain Sequence(s) |
QVQLKQSGPGLVQPSQSLSITCTVSGFSLTNYGVHWVRQSPGKGLEWLGVIWSGGNTDYNTPFTSRLSINKDNSKSQVFFKMNSLQSNDTAIYYCARALTYYDYEFAYWGQGTLVTVSAASTKGPSVFPLAPSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKRVEPKDILLTQSPVILSVSPGERVSFSCRASQSIGTNIHWYQQRTNGSPRLLIKYASESISGIPSRFSGSGSGTDFTLSINSVESEDIADYYCQQNNNWPTTFGAGTKLELKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGA
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 | Q | B | -1.4679 | Soluble |
| 2 | V | B | -0.8889 | Soluble |
| 3 | Q | B | -1.5683 | Soluble |
| 4 | L | B | 0.0000 | Buried |
| 5 | K | B | -2.0618 | Soluble |
| 6 | Q | B | 0.0000 | Buried |
| 7 | S | B | -0.7634 | Soluble |
| 8 | G | B | -0.8995 | Soluble |
| 9 | P | B | -0.4426 | Soluble |
| 11 | G | B | -0.3533 | Soluble |
| 12 | L | B | -0.1109 | Soluble |
| 13 | V | B | 0.0000 | Buried |
| 14 | Q | B | -1.8531 | Soluble |
| 15 | P | B | -1.6068 | Soluble |
| 16 | S | B | -1.6569 | Soluble |
| 17 | Q | B | -2.0225 | Soluble |
| 18 | S | B | -1.5124 | Soluble |
| 19 | L | B | 0.0000 | Buried |
| 20 | S | B | -0.4849 | Soluble |
| 21 | I | B | 0.0000 | Buried |
| 22 | T | B | -0.4188 | Soluble |
| 23 | C | B | 0.0000 | Buried |
| 24 | T | B | -1.0671 | Soluble |
| 25 | V | B | 0.0000 | Buried |
| 26 | S | B | -1.1798 | Soluble |
| 27 | G | B | -0.9921 | Soluble |
| 28 | F | B | -0.5251 | Soluble |
| 29 | S | B | -0.9079 | Soluble |
| 30 | L | B | 0.0000 | Buried |
| 35 | T | B | -0.9856 | Soluble |
| 36 | N | B | -0.8788 | Soluble |
| 37 | Y | B | 0.4738 | Aggregation-prone |
| 38 | G | B | 0.0000 | Buried |
| 39 | V | B | 0.0000 | Buried |
| 40 | H | B | 0.0000 | Buried |
| 41 | W | B | 0.0000 | Buried |
| 42 | V | B | 0.0000 | Buried |
| 43 | R | B | 0.0000 | Buried |
| 44 | Q | B | -0.5208 | Soluble |
| 45 | S | B | -1.0709 | Soluble |
| 46 | P | B | -1.1773 | Soluble |
| 47 | G | B | -1.7254 | Soluble |
| 48 | K | B | -2.2883 | Soluble |
| 49 | G | B | -1.1910 | Soluble |
| 50 | L | B | 0.0000 | Buried |
| 51 | E | B | -0.5953 | Soluble |
| 52 | W | B | 0.0000 | Buried |
| 53 | L | B | 0.0000 | Buried |
| 54 | G | B | 0.0000 | Buried |
| 55 | V | B | 0.0000 | Buried |
| 56 | I | B | 0.0000 | Buried |
| 57 | W | B | -0.5145 | Soluble |
| 58 | S | B | -0.6897 | Soluble |
| 59 | G | B | -1.1316 | Soluble |
| 63 | G | B | -1.5405 | Soluble |
| 64 | N | B | -1.8416 | Soluble |
| 65 | T | B | -1.2991 | Soluble |
| 66 | D | B | -1.0216 | Soluble |
| 67 | Y | B | -0.3523 | Soluble |
| 68 | N | B | 0.0000 | Buried |
| 69 | T | B | -0.1819 | Soluble |
| 70 | P | B | -0.3534 | Soluble |
| 71 | F | B | 0.0000 | Buried |
| 72 | T | B | -0.4255 | Soluble |
| 74 | S | B | -0.5026 | Soluble |
| 75 | R | B | -0.8104 | Soluble |
| 76 | L | B | 0.0000 | Buried |
| 77 | S | B | -0.8241 | Soluble |
| 78 | I | B | 0.0000 | Buried |
| 79 | N | B | -1.6766 | Soluble |
| 80 | K | B | -1.5622 | Soluble |
| 81 | D | B | -2.0144 | Soluble |
| 82 | N | B | -2.5767 | Soluble |
| 83 | S | B | -1.8989 | Soluble |
| 84 | K | B | -2.4993 | Soluble |
| 85 | S | B | -1.7487 | Soluble |
| 86 | Q | B | -1.5780 | Soluble |
| 87 | V | B | 0.0000 | Buried |
| 88 | F | B | -0.1544 | Soluble |
| 89 | F | B | 0.0000 | Buried |
| 90 | K | B | -1.0874 | Soluble |
| 91 | M | B | 0.0000 | Buried |
| 92 | N | B | -1.4089 | Soluble |
| 93 | S | B | -1.4373 | Soluble |
| 94 | L | B | 0.0000 | Buried |
| 95 | Q | B | -2.2600 | Soluble |
| 96 | S | B | -1.6213 | Soluble |
| 97 | N | B | -2.0964 | Soluble |
| 98 | D | B | 0.0000 | Buried |
| 99 | T | B | -0.6602 | Soluble |
| 100 | A | B | 0.0000 | Buried |
| 101 | I | B | 0.4507 | Aggregation-prone |
| 102 | Y | B | 0.0000 | Buried |
| 103 | Y | B | 0.0000 | Buried |
| 104 | C | B | 0.0000 | Buried |
| 105 | A | B | 0.0000 | Buried |
| 106 | R | B | 0.0000 | Buried |
| 107 | A | B | 0.0000 | Buried |
| 108 | L | B | 1.0508 | Aggregation-prone |
| 109 | T | B | 1.1494 | Aggregation-prone |
| 110 | Y | B | 1.8570 | Aggregation-prone |
| 111 | Y | B | 1.9432 | Aggregation-prone |
| 112 | D | B | 0.0000 | Buried |
| 113 | Y | B | 0.0000 | Buried |
| 114 | E | B | 0.0000 | Buried |
| 115 | F | B | 0.0000 | Buried |
| 116 | A | B | 0.1424 | Aggregation-prone |
| 117 | Y | B | 0.1020 | Aggregation-prone |
| 118 | W | B | -0.5245 | Soluble |
| 119 | G | B | 0.0000 | Buried |
| 120 | Q | B | -1.7290 | Soluble |
| 121 | G | B | -0.8614 | Soluble |
| 122 | T | B | 0.0000 | Buried |
| 123 | L | B | 0.3332 | Aggregation-prone |
| 124 | V | B | 0.0000 | Buried |
| 125 | T | B | 0.0000 | Buried |
| 126 | V | B | 0.0000 | Buried |
| 127 | S | B | -0.6720 | Soluble |
| 128 | A | B | -0.4573 | Soluble |
| 129 | A | B | -0.3449 | Soluble |
| 130 | S | B | -0.5351 | Soluble |
| 131 | T | B | -0.6957 | Soluble |
| 132 | K | B | -1.1792 | Soluble |
| 133 | G | B | -1.3641 | Soluble |
| 134 | P | B | 0.0000 | Buried |
| 135 | S | B | -0.4197 | Soluble |
| 136 | V | B | 0.0000 | Buried |
| 137 | F | B | 0.0000 | Buried |
| 138 | P | B | -1.4200 | Soluble |
| 139 | L | B | 0.0000 | Buried |
| 140 | A | B | -1.2614 | Soluble |
| 141 | P | B | 0.0000 | Buried |
| 142 | S | B | -0.7311 | Soluble |
| 143 | G | B | -0.7724 | Soluble |
| 144 | G | B | -0.8613 | Soluble |
| 145 | T | B | -0.6050 | Soluble |
| 146 | A | B | 0.0000 | Buried |
| 147 | A | B | 0.0000 | Buried |
| 148 | L | B | 0.0000 | Buried |
| 149 | G | B | 0.0000 | Buried |
| 150 | C | B | 0.0000 | Buried |
| 151 | L | B | 0.0000 | Buried |
| 152 | V | B | 0.0000 | Buried |
| 153 | K | B | 0.0000 | Buried |
| 154 | D | B | -0.3652 | Soluble |
| 155 | Y | B | 0.0000 | Buried |
| 156 | F | B | 0.0000 | Buried |
| 157 | P | B | 0.0000 | Buried |
| 158 | E | B | -0.2055 | Soluble |
| 159 | P | B | -0.4736 | Soluble |
| 160 | V | B | -0.5671 | Soluble |
| 161 | T | B | -0.5569 | Soluble |
| 162 | V | B | -0.1737 | Soluble |
| 163 | S | B | -0.4375 | Soluble |
| 164 | W | B | 0.0000 | Buried |
| 165 | N | B | -0.9253 | Soluble |
| 166 | S | B | -0.7433 | Soluble |
| 167 | G | B | -0.6043 | Soluble |
| 168 | A | B | -0.2787 | Soluble |
| 169 | L | B | -0.0605 | Soluble |
| 170 | T | B | -0.1831 | Soluble |
| 171 | S | B | -0.1822 | Soluble |
| 172 | G | B | -0.2182 | Soluble |
| 173 | V | B | 0.1663 | Aggregation-prone |
| 174 | H | B | -0.3107 | Soluble |
| 175 | T | B | -0.0012 | Soluble |
| 176 | F | B | 0.0000 | Buried |
| 177 | P | B | -0.3450 | Soluble |
| 178 | A | B | 0.2899 | Aggregation-prone |
| 179 | V | B | 0.5350 | Aggregation-prone |
| 180 | L | B | 1.3705 | Aggregation-prone |
| 181 | Q | B | 0.2888 | Aggregation-prone |
| 182 | S | B | -0.0343 | Soluble |
| 183 | S | B | -0.1866 | Soluble |
| 184 | G | B | 0.0946 | Aggregation-prone |
| 185 | L | B | 0.2219 | Aggregation-prone |
| 186 | Y | B | 0.5500 | Aggregation-prone |
| 187 | S | B | 0.0000 | Buried |
| 188 | L | B | 0.0000 | Buried |
| 189 | S | B | 0.0000 | Buried |
| 190 | S | B | 0.0000 | Buried |
| 191 | V | B | 0.0000 | Buried |
| 192 | V | B | 0.0000 | Buried |
| 193 | T | B | -0.1328 | Soluble |
| 194 | V | B | 0.0000 | Buried |
| 195 | P | B | -0.6274 | Soluble |
| 196 | S | B | -0.6840 | Soluble |
| 197 | S | B | -0.6163 | Soluble |
| 198 | S | B | 0.0000 | Buried |
| 199 | L | B | -0.8183 | Soluble |
| 200 | G | B | -0.9711 | Soluble |
| 201 | T | B | -0.7670 | Soluble |
| 202 | Q | B | -1.1342 | Soluble |
| 203 | T | B | -1.2196 | Soluble |
| 204 | Y | B | 0.0000 | Buried |
| 205 | I | B | -1.5160 | Soluble |
| 206 | C | B | 0.0000 | Buried |
| 207 | N | B | -1.5381 | Soluble |
| 208 | V | B | 0.0000 | Buried |
| 209 | N | B | -1.9745 | Soluble |
| 210 | H | B | 0.0000 | Buried |
| 211 | K | B | -2.7539 | Soluble |
| 212 | P | B | -1.5396 | Soluble |
| 213 | S | B | -1.8230 | Soluble |
| 214 | N | B | -2.5723 | Soluble |
| 215 | T | B | -2.0536 | Soluble |
| 216 | K | B | -2.7360 | Soluble |
| 217 | V | B | -1.7450 | Soluble |
| 218 | D | B | -2.6227 | Soluble |
| 219 | K | B | -2.3412 | Soluble |
| 220 | R | B | -2.7924 | Soluble |
| 221 | V | B | 0.0000 | Buried |
| 222 | E | B | -2.8289 | Soluble |
| 223 | P | B | -1.8853 | Soluble |
| 224 | K | B | -2.4832 | Soluble |
| 1 | D | A | -1.2768 | Soluble |
| 2 | I | A | 0.0000 | Buried |
| 3 | L | A | 0.6636 | Aggregation-prone |
| 4 | L | A | 0.0000 | Buried |
| 5 | T | A | -0.2951 | Soluble |
| 6 | Q | A | 0.0000 | Buried |
| 7 | S | A | 0.2304 | Aggregation-prone |
| 8 | P | A | 0.9003 | Aggregation-prone |
| 9 | V | A | 1.9184 | Aggregation-prone |
| 10 | I | A | 1.3619 | Aggregation-prone |
| 11 | L | A | 0.5490 | Aggregation-prone |
| 12 | S | A | -0.3383 | Soluble |
| 13 | V | A | -1.1758 | Soluble |
| 14 | S | A | -1.8652 | Soluble |
| 15 | P | A | -2.0703 | Soluble |
| 16 | G | A | -2.3509 | Soluble |
| 17 | E | A | -3.1679 | Soluble |
| 18 | R | A | -3.3267 | Soluble |
| 19 | V | A | 0.0000 | Buried |
| 20 | S | A | -0.7254 | Soluble |
| 21 | F | A | 0.0000 | Buried |
| 22 | S | A | -0.6900 | Soluble |
| 23 | C | A | 0.0000 | Buried |
| 24 | R | A | -2.2083 | Soluble |
| 25 | A | A | -1.1598 | Soluble |
| 26 | S | A | -0.9057 | Soluble |
| 27 | Q | A | -1.2883 | Soluble |
| 28 | S | A | -1.4342 | Soluble |
| 29 | I | A | 0.0000 | Buried |
| 36 | G | A | -1.0091 | Soluble |
| 37 | T | A | -0.8132 | Soluble |
| 38 | N | A | -0.8029 | Soluble |
| 39 | I | A | 0.0000 | Buried |
| 40 | H | A | 0.0000 | Buried |
| 41 | W | A | 0.0000 | Buried |
| 42 | Y | A | 0.0000 | Buried |
| 43 | Q | A | 0.0000 | Buried |
| 44 | Q | A | -1.8643 | Soluble |
| 45 | R | A | -2.8290 | Soluble |
| 46 | T | A | -2.1907 | Soluble |
| 47 | N | A | -2.0544 | Soluble |
| 48 | G | A | -1.8833 | Soluble |
| 49 | S | A | -1.2381 | Soluble |
| 50 | P | A | 0.0000 | Buried |
| 51 | R | A | -1.1553 | Soluble |
| 52 | L | A | 0.0000 | Buried |
| 53 | L | A | 0.0000 | Buried |
| 54 | I | A | 0.0000 | Buried |
| 55 | K | A | -0.7486 | Soluble |
| 56 | Y | A | -0.6477 | Soluble |
| 57 | A | A | 0.0000 | Buried |
| 65 | S | A | -1.2912 | Soluble |
| 66 | E | A | -2.0004 | Soluble |
| 67 | S | A | -1.1992 | Soluble |
| 68 | I | A | -0.5403 | Soluble |
| 69 | S | A | -0.3464 | Soluble |
| 70 | G | A | -0.4823 | Soluble |
| 71 | I | A | -0.3247 | Soluble |
| 72 | P | A | -0.3598 | Soluble |
| 74 | S | A | -0.6599 | Soluble |
| 75 | R | A | -1.3061 | Soluble |
| 76 | F | A | 0.0000 | Buried |
| 77 | S | A | -0.9891 | Soluble |
| 78 | G | A | -0.7310 | Soluble |
| 79 | S | A | -0.9196 | Soluble |
| 80 | G | A | -1.1750 | Soluble |
| 83 | S | A | -1.1989 | Soluble |
| 84 | G | A | -1.3578 | Soluble |
| 85 | T | A | -1.9360 | Soluble |
| 86 | D | A | -2.7162 | Soluble |
| 87 | F | A | 0.0000 | Buried |
| 88 | T | A | -0.8695 | Soluble |
| 89 | L | A | 0.0000 | Buried |
| 90 | S | A | -0.9631 | Soluble |
| 91 | I | A | 0.0000 | Buried |
| 92 | N | A | -2.9089 | Soluble |
| 93 | S | A | -2.6504 | Soluble |
| 94 | V | A | 0.0000 | Buried |
| 95 | E | A | -2.4422 | Soluble |
| 96 | S | A | -2.0058 | Soluble |
| 98 | D | A | -1.3000 | Soluble |
| 99 | I | A | -1.5557 | Soluble |
| 100 | A | A | 0.0000 | Buried |
| 101 | D | A | -1.1755 | Soluble |
| 102 | Y | A | 0.0000 | Buried |
| 103 | Y | A | 0.0000 | Buried |
| 104 | C | A | 0.0000 | Buried |
| 105 | Q | A | 0.0000 | Buried |
| 106 | Q | A | 0.0000 | Buried |
| 107 | N | A | -0.6428 | Soluble |
| 108 | N | A | -1.0743 | Soluble |
| 109 | N | A | -0.8205 | Soluble |
| 114 | W | A | 0.2765 | Aggregation-prone |
| 115 | P | A | 0.0000 | Buried |
| 116 | T | A | 0.0000 | Buried |
| 117 | T | A | -0.0301 | Soluble |
| 118 | F | A | 0.1472 | Aggregation-prone |
| 119 | G | A | 0.0000 | Buried |
| 120 | A | A | 0.0322 | Aggregation-prone |
| 121 | G | A | 0.0715 | Aggregation-prone |
| 122 | T | A | 0.0000 | Buried |
| 123 | K | A | -0.3231 | Soluble |
| 124 | L | A | 0.0000 | Buried |
| 125 | E | A | -1.0279 | Soluble |
| 126 | L | A | 0.0000 | Buried |
| 127 | K | A | -1.5757 | Soluble |
| 128 | R | A | -1.1645 | Soluble |
| 129 | T | A | -0.0856 | Soluble |
| 130 | V | A | 0.4440 | Aggregation-prone |
| 131 | A | A | -0.0099 | Soluble |
| 132 | A | A | -0.0990 | Soluble |
| 133 | P | A | 0.0000 | Buried |
| 134 | S | A | -0.1938 | Soluble |
| 135 | V | A | 0.0000 | Buried |
| 136 | F | A | 0.0322 | Aggregation-prone |
| 137 | I | A | 0.0208 | Aggregation-prone |
| 138 | F | A | 0.0000 | Buried |
| 139 | P | A | -0.5396 | Soluble |
| 140 | P | A | 0.0000 | Buried |
| 141 | S | A | -1.9014 | Soluble |
| 142 | D | A | -3.1481 | Soluble |
| 143 | E | A | -3.0322 | Soluble |
| 144 | Q | A | 0.0000 | Buried |
| 145 | L | A | -2.3036 | Soluble |
| 146 | K | A | -2.7672 | Soluble |
| 147 | S | A | -1.7235 | Soluble |
| 148 | G | A | -1.3827 | Soluble |
| 149 | T | A | -0.8373 | 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 | L | A | 0.0000 | Buried |
| 156 | L | A | 0.0000 | Buried |
| 157 | N | A | 0.0000 | Buried |
| 158 | N | A | -0.9430 | Soluble |
| 159 | F | A | 0.0000 | Buried |
| 160 | Y | A | 0.0000 | Buried |
| 161 | P | A | -1.7524 | Soluble |
| 162 | R | A | -2.9312 | Soluble |
| 163 | E | A | -3.2588 | Soluble |
| 164 | A | A | -2.3592 | Soluble |
| 165 | K | A | -2.2654 | Soluble |
| 166 | V | A | -1.1520 | Soluble |
| 167 | Q | A | -0.6971 | Soluble |
| 168 | W | A | 0.0000 | Buried |
| 169 | K | A | -0.6062 | Soluble |
| 170 | V | A | 0.0000 | Buried |
| 171 | D | A | -1.8594 | Soluble |
| 172 | N | A | -1.4985 | Soluble |
| 173 | A | A | -0.2479 | Soluble |
| 174 | L | A | 0.7654 | Aggregation-prone |
| 175 | Q | A | -0.1501 | Soluble |
| 176 | S | A | -0.4698 | Soluble |
| 177 | G | A | -0.9670 | Soluble |
| 178 | N | A | -0.9106 | Soluble |
| 179 | S | A | -1.3539 | Soluble |
| 180 | Q | A | -1.9091 | Soluble |
| 181 | E | A | -2.2046 | Soluble |
| 182 | S | A | -1.1545 | Soluble |
| 183 | V | A | -0.8421 | Soluble |
| 184 | T | A | -1.1472 | Soluble |
| 185 | E | A | -2.3738 | Soluble |
| 186 | Q | A | 0.0000 | Buried |
| 187 | D | A | -1.8460 | Soluble |
| 188 | S | A | -2.1508 | Soluble |
| 189 | K | A | -2.5116 | Soluble |
| 190 | D | A | -1.9004 | Soluble |
| 191 | S | A | 0.0000 | Buried |
| 192 | T | A | 0.0000 | Buried |
| 193 | Y | A | -1.3737 | Soluble |
| 194 | S | A | 0.0000 | Buried |
| 195 | L | A | 0.0000 | Buried |
| 196 | S | A | 0.0000 | Buried |
| 197 | S | A | 0.0000 | Buried |
| 198 | T | A | -0.7930 | Soluble |
| 199 | L | A | 0.0000 | Buried |
| 200 | T | A | -0.4843 | Soluble |
| 201 | L | A | -0.6455 | Soluble |
| 202 | S | A | -1.0249 | Soluble |
| 203 | K | A | -2.0035 | Soluble |
| 204 | A | A | -1.8959 | Soluble |
| 205 | D | A | -2.5443 | Soluble |
| 206 | Y | A | 0.0000 | Buried |
| 207 | E | A | -3.7053 | Soluble |
| 208 | K | A | -3.7041 | Soluble |
| 209 | H | A | -3.0505 | Soluble |
| 210 | K | A | -3.0719 | Soluble |
| 211 | V | A | -1.2907 | Soluble |
| 212 | Y | A | 0.0000 | Buried |
| 213 | A | A | -0.8356 | Soluble |
| 214 | C | A | 0.0000 | Buried |
| 215 | E | A | -0.9886 | Soluble |
| 216 | V | A | 0.0000 | Buried |
| 217 | T | A | -1.2630 | Soluble |
| 218 | H | A | 0.0000 | Buried |
| 219 | Q | A | -1.7294 | Soluble |
| 220 | G | A | -0.3867 | Soluble |
| 221 | L | A | -0.2083 | Soluble |
| 222 | S | A | -0.4485 | Soluble |
| 223 | S | A | -0.3938 | Soluble |
| 224 | P | A | -0.5602 | Soluble |
| 225 | V | A | 0.0241 | Aggregation-prone |
| 226 | T | A | -0.5030 | Soluble |
| 227 | K | A | -0.8292 | Soluble |
| 228 | S | A | -0.6427 | Soluble |
| 229 | F | A | -0.6656 | Soluble |
| 230 | N | A | -1.4580 | Soluble |
| 231 | R | A | -2.2694 | Soluble |
| 232 | G | A | -1.4062 | Soluble |
| 233 | A | A | -0.7165 | 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 | -0.715 | 2.8899 | CSV PDB |
| 4.5 | -0.7527 | 2.8227 | CSV PDB |
| 5.0 | -0.7975 | 2.7423 | CSV PDB |
| 5.5 | -0.8404 | 2.6566 | CSV PDB |
| 6.0 | -0.871 | 2.5689 | CSV PDB |
| 6.5 | -0.8814 | 2.4808 | CSV PDB |
| 7.0 | -0.8716 | 2.3927 | CSV PDB |
| 7.5 | -0.8479 | 2.3055 | CSV PDB |
| 8.0 | -0.8162 | 2.2764 | CSV PDB |
| 8.5 | -0.7789 | 2.3243 | CSV PDB |
| 9.0 | -0.7362 | 2.3758 | CSV PDB |