Calculation Parameters
| Chain Sequence(s) |
EVQLVESGGCLVQPGRSLRLSCAASGFTFDDYAMHWVRQAPGKGLEWVSAITWNSGHIDYADSVEGRFTISRDNAKNSLYLQMNSLRAEDTAVYYCAKVSYLSTASSLDYWGQGTLVTVSSASTKGPSVFPLAPSSKGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKCSNTKVDKKVEPIQMTQSPSSLSASVGDRVTITCRASQGIRNYLAWYQQKCGKAPKLLIYAASTLQSGVPSRFSGSGSGTDFTLTISSLQPEDVATYYCQRYNRAPYTFGQGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTCQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRG
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 | E | B | -2.0352 | Soluble |
| 2 | V | B | -1.0482 | Soluble |
| 3 | Q | B | -1.1375 | Soluble |
| 4 | L | B | 0.0000 | Buried |
| 5 | V | B | 1.0291 | Aggregation-prone |
| 6 | E | B | 0.2435 | Aggregation-prone |
| 7 | S | B | -0.4599 | Soluble |
| 8 | G | B | -0.9317 | Soluble |
| 9 | G | B | -0.4581 | Soluble |
| 11 | C | B | -0.0089 | Soluble |
| 12 | L | B | 0.0843 | Aggregation-prone |
| 13 | V | B | 0.0000 | Buried |
| 14 | Q | B | -2.1416 | Soluble |
| 15 | P | B | -2.2380 | Soluble |
| 16 | G | B | -2.2400 | Soluble |
| 17 | R | B | -2.8651 | Soluble |
| 18 | S | B | -2.1534 | Soluble |
| 19 | L | B | -1.5410 | Soluble |
| 20 | R | B | -2.1025 | Soluble |
| 21 | L | B | 0.0000 | Buried |
| 22 | S | B | -0.4304 | Soluble |
| 23 | C | B | 0.0000 | Buried |
| 24 | A | B | -0.2594 | Soluble |
| 25 | A | B | 0.0000 | Buried |
| 26 | S | B | -0.7529 | Soluble |
| 27 | G | B | -1.1339 | Soluble |
| 28 | F | B | -0.7710 | Soluble |
| 29 | T | B | -0.8626 | Soluble |
| 30 | F | B | 0.0000 | Buried |
| 35 | D | B | -2.3422 | Soluble |
| 36 | D | B | -1.0619 | Soluble |
| 37 | Y | B | 0.0522 | Aggregation-prone |
| 38 | A | B | 0.0000 | Buried |
| 39 | M | 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 | -0.8295 | Soluble |
| 45 | A | B | -1.2551 | Soluble |
| 46 | P | B | -0.9653 | Soluble |
| 47 | G | B | -1.4736 | Soluble |
| 48 | K | B | -2.3291 | Soluble |
| 49 | G | B | -1.5736 | Soluble |
| 50 | L | B | 0.0000 | Buried |
| 51 | E | B | -1.0633 | Soluble |
| 52 | W | B | 0.0000 | Buried |
| 53 | V | B | 0.0000 | Buried |
| 54 | S | B | 0.0000 | Buried |
| 55 | A | B | 0.0000 | Buried |
| 56 | I | B | 0.0000 | Buried |
| 57 | T | B | 0.0000 | Buried |
| 58 | W | B | -1.2483 | Soluble |
| 59 | N | B | -2.1377 | Soluble |
| 62 | S | B | -1.1849 | Soluble |
| 63 | G | B | -1.2216 | Soluble |
| 64 | H | B | -1.1921 | Soluble |
| 65 | I | B | -0.1398 | Soluble |
| 66 | D | B | -1.2234 | Soluble |
| 67 | Y | B | -1.0677 | Soluble |
| 68 | A | B | 0.0000 | Buried |
| 69 | D | B | -2.5297 | Soluble |
| 70 | S | B | -1.4852 | Soluble |
| 71 | V | B | 0.0000 | Buried |
| 72 | E | B | -2.7165 | Soluble |
| 74 | G | B | -1.6881 | Soluble |
| 75 | R | B | 0.0000 | Buried |
| 76 | F | B | 0.0000 | Buried |
| 77 | T | B | -0.7709 | Soluble |
| 78 | I | B | 0.0000 | Buried |
| 79 | S | B | -0.3566 | Soluble |
| 80 | R | B | -1.1699 | Soluble |
| 81 | D | B | -1.7304 | Soluble |
| 82 | N | B | -2.0905 | Soluble |
| 83 | A | B | -1.5488 | Soluble |
| 84 | K | B | -2.2109 | Soluble |
| 85 | N | B | -1.9485 | Soluble |
| 86 | S | B | -0.9444 | Soluble |
| 87 | L | B | 0.0000 | Buried |
| 88 | Y | B | -0.4508 | Soluble |
| 89 | L | B | 0.0000 | Buried |
| 90 | Q | B | -1.1929 | Soluble |
| 91 | M | B | 0.0000 | Buried |
| 92 | N | B | -1.7978 | Soluble |
| 93 | S | B | -1.7627 | Soluble |
| 94 | L | B | 0.0000 | Buried |
| 95 | R | B | -2.5322 | Soluble |
| 96 | A | B | -1.7532 | Soluble |
| 97 | E | B | -2.2243 | Soluble |
| 98 | D | B | 0.0000 | Buried |
| 99 | T | B | -0.7476 | Soluble |
| 100 | A | B | 0.0000 | Buried |
| 101 | V | B | 0.1627 | 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 | K | B | 0.0000 | Buried |
| 107 | V | B | 0.0000 | Buried |
| 108 | S | B | 0.0000 | Buried |
| 109 | Y | B | 1.9367 | Aggregation-prone |
| 110 | L | B | 1.8644 | Aggregation-prone |
| 111 | S | B | 1.0613 | Aggregation-prone |
| 112A | T | B | 0.2043 | Aggregation-prone |
| 112 | A | B | -0.0775 | Soluble |
| 113 | S | B | 0.0000 | Buried |
| 114 | S | B | 0.0000 | Buried |
| 115 | L | B | 0.0000 | Buried |
| 116 | D | B | -0.0152 | Soluble |
| 117 | Y | B | 0.2137 | Aggregation-prone |
| 118 | W | B | 0.0000 | Buried |
| 119 | G | B | 0.0000 | Buried |
| 120 | Q | B | -1.2970 | Soluble |
| 121 | G | B | -0.5192 | Soluble |
| 122 | T | B | -0.0190 | Soluble |
| 123 | L | B | 0.0852 | Aggregation-prone |
| 124 | V | B | 0.0000 | Buried |
| 125 | T | B | 0.0000 | Buried |
| 126 | V | B | 0.0000 | Buried |
| 127 | S | B | -0.9418 | Soluble |
| 128 | S | B | -0.6985 | Soluble |
| 129 | A | B | -0.4210 | Soluble |
| 130 | S | B | -0.5724 | Soluble |
| 131 | T | B | -0.6944 | Soluble |
| 132 | K | B | -1.2388 | Soluble |
| 133 | G | B | -1.3759 | Soluble |
| 134 | P | B | 0.0000 | Buried |
| 135 | S | B | -0.4363 | Soluble |
| 136 | V | B | 0.0000 | Buried |
| 137 | F | B | 0.0000 | Buried |
| 138 | P | B | -1.2355 | Soluble |
| 139 | L | B | 0.0000 | Buried |
| 140 | A | B | -0.9614 | Soluble |
| 141 | P | B | 0.0000 | Buried |
| 142 | S | B | -0.7678 | Soluble |
| 143 | S | B | -0.6478 | Soluble |
| 144 | K | B | -0.8138 | Soluble |
| 145 | G | B | -0.6014 | Soluble |
| 146 | T | B | -0.5018 | Soluble |
| 147 | A | B | -0.4355 | Soluble |
| 148 | A | B | 0.0000 | Buried |
| 149 | L | B | 0.0000 | Buried |
| 150 | G | B | 0.0000 | Buried |
| 151 | C | B | 0.0000 | Buried |
| 152 | L | B | 0.0000 | Buried |
| 153 | V | B | 0.0000 | Buried |
| 154 | K | B | 0.0000 | Buried |
| 155 | D | B | -0.2824 | Soluble |
| 156 | Y | B | 0.0000 | Buried |
| 157 | F | B | 0.0000 | Buried |
| 158 | P | B | 0.0000 | Buried |
| 159 | E | B | -0.2275 | Soluble |
| 160 | P | B | -0.5315 | Soluble |
| 161 | V | B | -0.6697 | Soluble |
| 162 | T | B | -0.6257 | Soluble |
| 163 | V | B | -0.2735 | Soluble |
| 164 | S | B | -0.3947 | Soluble |
| 165 | W | B | 0.0000 | Buried |
| 166 | N | B | -0.7037 | Soluble |
| 167 | S | B | -0.6110 | Soluble |
| 168 | G | B | -0.4068 | Soluble |
| 169 | A | B | -0.2016 | Soluble |
| 170 | L | B | 0.0099 | Aggregation-prone |
| 171 | T | B | -0.1528 | Soluble |
| 172 | S | B | -0.1964 | Soluble |
| 173 | G | B | -0.2309 | Soluble |
| 174 | V | B | 0.1908 | Aggregation-prone |
| 175 | H | B | 0.0615 | Aggregation-prone |
| 176 | T | B | 0.0764 | Aggregation-prone |
| 177 | F | B | 0.0000 | Buried |
| 178 | P | B | 0.0906 | Aggregation-prone |
| 179 | A | B | 0.3936 | Aggregation-prone |
| 180 | V | B | 0.7150 | Aggregation-prone |
| 181 | L | B | 1.3409 | Aggregation-prone |
| 182 | Q | B | 0.2546 | Aggregation-prone |
| 183 | S | B | -0.1381 | Soluble |
| 184 | S | B | -0.1750 | Soluble |
| 185 | G | B | 0.1488 | Aggregation-prone |
| 186 | L | B | 0.2900 | Aggregation-prone |
| 187 | Y | B | 0.6395 | Aggregation-prone |
| 188 | S | B | 0.0000 | Buried |
| 189 | L | B | 0.0000 | Buried |
| 190 | S | B | 0.0000 | Buried |
| 191 | S | B | 0.0000 | Buried |
| 192 | V | B | 0.0000 | Buried |
| 193 | V | B | 0.0000 | Buried |
| 194 | T | B | -0.1527 | Soluble |
| 195 | V | B | 0.0000 | Buried |
| 196 | P | B | -0.5489 | Soluble |
| 197 | S | B | -0.5611 | Soluble |
| 198 | S | B | -0.5860 | Soluble |
| 199 | S | B | -0.6283 | Soluble |
| 200 | L | B | -0.8390 | Soluble |
| 201 | G | B | -1.0355 | Soluble |
| 202 | T | B | -0.7501 | Soluble |
| 203 | Q | B | -1.2782 | Soluble |
| 204 | T | B | -1.1221 | Soluble |
| 205 | Y | B | 0.0000 | Buried |
| 206 | I | B | -1.3207 | Soluble |
| 207 | C | B | 0.0000 | Buried |
| 208 | N | B | -1.4958 | Soluble |
| 209 | V | B | 0.0000 | Buried |
| 210 | N | B | -2.1614 | Soluble |
| 211 | H | B | 0.0000 | Buried |
| 212 | K | B | -2.5773 | Soluble |
| 213 | C | B | -1.3291 | Soluble |
| 214 | S | B | -1.7740 | Soluble |
| 215 | N | B | -2.4675 | Soluble |
| 216 | T | B | -2.0749 | Soluble |
| 217 | K | B | -2.7150 | Soluble |
| 218 | V | B | -1.4812 | Soluble |
| 219 | D | B | -2.4390 | Soluble |
| 220 | K | B | -2.0666 | Soluble |
| 221 | K | B | -2.5293 | Soluble |
| 222 | V | B | 0.0000 | Buried |
| 223 | E | B | -2.4942 | Soluble |
| 224 | P | B | -1.2355 | Soluble |
| 2 | I | A | 0.8965 | Aggregation-prone |
| 3 | Q | A | -0.8613 | Soluble |
| 4 | M | A | 0.0000 | Buried |
| 5 | T | A | -1.5629 | Soluble |
| 6 | Q | A | 0.0000 | Buried |
| 7 | S | A | -0.6872 | Soluble |
| 8 | P | A | -0.6584 | Soluble |
| 9 | S | A | -0.9691 | Soluble |
| 10 | S | A | -0.9521 | Soluble |
| 11 | L | A | -0.6164 | Soluble |
| 12 | S | A | -0.6886 | Soluble |
| 13 | A | A | -0.8871 | Soluble |
| 14 | S | A | -0.8314 | Soluble |
| 15 | V | A | -0.2138 | Soluble |
| 16 | G | A | -0.8929 | Soluble |
| 17 | D | A | -1.7872 | Soluble |
| 18 | R | A | -2.3496 | Soluble |
| 19 | V | A | 0.0000 | Buried |
| 20 | T | A | -0.6041 | Soluble |
| 21 | I | A | 0.0000 | Buried |
| 22 | T | A | -0.9014 | Soluble |
| 23 | C | A | 0.0000 | Buried |
| 24 | R | A | -2.9698 | Soluble |
| 25 | A | A | 0.0000 | Buried |
| 26 | S | A | -1.3377 | Soluble |
| 27 | Q | A | -1.6472 | Soluble |
| 28 | G | A | -1.8450 | Soluble |
| 29 | I | A | 0.0000 | Buried |
| 36 | R | A | -2.6085 | Soluble |
| 37 | N | A | -1.4351 | Soluble |
| 38 | Y | A | -0.7213 | Soluble |
| 39 | L | A | 0.0000 | Buried |
| 40 | A | A | 0.0000 | Buried |
| 41 | W | A | 0.0000 | Buried |
| 42 | Y | A | 0.0000 | Buried |
| 43 | Q | A | -1.0278 | Soluble |
| 44 | Q | A | 0.0000 | Buried |
| 45 | K | A | -1.2465 | Soluble |
| 46 | C | A | -0.1819 | Soluble |
| 47 | G | A | -1.0990 | Soluble |
| 48 | K | A | -2.2818 | Soluble |
| 49 | A | A | -1.5294 | Soluble |
| 50 | P | A | 0.0000 | Buried |
| 51 | K | A | -1.8413 | Soluble |
| 52 | L | A | 0.0000 | Buried |
| 53 | L | A | 0.0000 | Buried |
| 54 | I | A | 0.0000 | Buried |
| 55 | Y | A | 0.2143 | Aggregation-prone |
| 56 | A | A | -0.1952 | Soluble |
| 57 | A | A | 0.0000 | Buried |
| 65 | S | A | -0.2019 | Soluble |
| 66 | T | A | 0.0378 | Aggregation-prone |
| 67 | L | A | 0.2344 | Aggregation-prone |
| 68 | Q | A | -0.4103 | Soluble |
| 69 | S | A | -0.4549 | Soluble |
| 70 | G | A | -0.6077 | Soluble |
| 71 | V | A | 0.0000 | Buried |
| 72 | P | A | -0.4493 | Soluble |
| 74 | S | A | -0.4809 | Soluble |
| 75 | R | A | -0.7913 | Soluble |
| 76 | F | A | 0.0000 | Buried |
| 77 | S | A | -0.2727 | Soluble |
| 78 | G | A | 0.0000 | Buried |
| 79 | S | A | -0.6715 | Soluble |
| 80 | G | A | -1.4763 | Soluble |
| 83 | S | A | -1.6444 | Soluble |
| 84 | G | A | -2.2907 | Soluble |
| 85 | T | A | -2.3978 | Soluble |
| 86 | D | A | -3.0532 | Soluble |
| 87 | F | A | 0.0000 | Buried |
| 88 | T | A | -0.8416 | Soluble |
| 89 | L | A | 0.0000 | Buried |
| 90 | T | A | -0.6026 | Soluble |
| 91 | I | A | 0.0000 | Buried |
| 92 | S | A | -1.3660 | Soluble |
| 93 | S | A | -1.2189 | Soluble |
| 94 | L | A | 0.0000 | Buried |
| 95 | Q | A | -1.1317 | Soluble |
| 96 | P | A | -1.9384 | Soluble |
| 97 | E | A | -2.4529 | Soluble |
| 98 | D | A | 0.0000 | Buried |
| 99 | V | A | -1.1968 | Soluble |
| 100 | A | A | 0.0000 | Buried |
| 101 | T | A | -0.8029 | 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 | R | A | 0.0000 | Buried |
| 107 | Y | A | 0.0000 | Buried |
| 108 | N | A | -1.5115 | Soluble |
| 109 | R | A | -1.8280 | Soluble |
| 114 | A | A | -0.7543 | Soluble |
| 115 | P | A | -0.6297 | Soluble |
| 116 | Y | A | 0.0000 | Buried |
| 117 | T | A | -0.3630 | Soluble |
| 118 | F | A | 0.0000 | Buried |
| 119 | G | A | 0.0000 | Buried |
| 120 | Q | A | -1.7689 | Soluble |
| 121 | G | A | 0.0000 | Buried |
| 122 | T | A | 0.0000 | Buried |
| 123 | K | A | -1.9967 | Soluble |
| 124 | V | A | 0.0000 | Buried |
| 125 | E | A | -1.1559 | Soluble |
| 126 | I | A | 0.0000 | Buried |
| 127 | K | A | -0.9766 | Soluble |
| 128 | R | A | -0.7618 | Soluble |
| 129 | T | A | 0.2019 | Aggregation-prone |
| 130 | V | A | 1.0096 | Aggregation-prone |
| 131 | A | A | 0.2984 | Aggregation-prone |
| 132 | A | A | 0.0342 | Aggregation-prone |
| 133 | P | A | 0.0000 | Buried |
| 134 | S | A | -0.2414 | Soluble |
| 135 | V | A | 0.0000 | Buried |
| 136 | F | A | 0.0000 | Buried |
| 137 | I | A | 0.0000 | Buried |
| 138 | F | A | 0.0000 | Buried |
| 139 | P | A | -0.8374 | Soluble |
| 140 | P | A | -1.0925 | Soluble |
| 141 | S | A | -1.7137 | Soluble |
| 142 | D | A | -2.9799 | Soluble |
| 143 | E | A | -2.9849 | Soluble |
| 144 | Q | A | 0.0000 | Buried |
| 145 | L | A | -2.3368 | Soluble |
| 146 | K | A | -2.8107 | Soluble |
| 147 | S | A | -1.7846 | Soluble |
| 148 | G | A | -1.2398 | Soluble |
| 149 | T | A | -0.9039 | 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 | -0.9470 | Soluble |
| 159 | F | A | 0.0000 | Buried |
| 160 | Y | A | 0.0000 | Buried |
| 161 | P | A | 0.0000 | Buried |
| 162 | R | A | -1.9802 | Soluble |
| 163 | E | A | -2.8830 | Soluble |
| 164 | A | A | -2.2086 | Soluble |
| 165 | K | A | -2.2418 | Soluble |
| 166 | V | A | -1.1800 | Soluble |
| 167 | Q | A | -0.6725 | Soluble |
| 168 | W | A | 0.0000 | Buried |
| 169 | K | A | -0.8439 | Soluble |
| 170 | V | A | 0.0000 | Buried |
| 171 | D | A | -1.9385 | Soluble |
| 172 | N | A | -1.4648 | Soluble |
| 173 | A | A | -0.6093 | Soluble |
| 174 | L | A | -0.0961 | Soluble |
| 175 | Q | A | -0.6000 | Soluble |
| 176 | S | A | -0.5793 | Soluble |
| 177 | G | A | -0.9899 | Soluble |
| 178 | N | A | -0.9974 | Soluble |
| 179 | S | A | -1.3021 | Soluble |
| 180 | Q | A | -1.7500 | Soluble |
| 181 | E | A | -1.7197 | Soluble |
| 182 | S | A | 0.0000 | Buried |
| 183 | V | A | 0.0692 | Aggregation-prone |
| 184 | T | A | 0.2519 | Aggregation-prone |
| 185 | C | A | 0.3184 | Aggregation-prone |
| 186 | Q | A | 0.0000 | Buried |
| 187 | D | A | -1.9522 | Soluble |
| 188 | S | A | -2.2390 | Soluble |
| 189 | K | A | -3.0438 | Soluble |
| 190 | D | A | -2.6466 | Soluble |
| 191 | S | A | 0.0000 | Buried |
| 192 | T | A | 0.0000 | Buried |
| 193 | Y | A | 0.0000 | Buried |
| 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 | -0.8032 | Soluble |
| 199 | L | A | 0.0000 | Buried |
| 200 | T | A | -0.5954 | Soluble |
| 201 | L | A | 0.0000 | Buried |
| 202 | S | A | -1.1861 | Soluble |
| 203 | K | A | -2.2456 | Soluble |
| 204 | A | A | -2.0405 | Soluble |
| 205 | D | A | -2.5965 | Soluble |
| 206 | Y | A | 0.0000 | Buried |
| 207 | E | A | -4.0352 | Soluble |
| 208 | K | A | -3.9235 | Soluble |
| 209 | H | A | -3.2977 | Soluble |
| 210 | K | A | -3.4767 | Soluble |
| 211 | V | A | -1.6062 | Soluble |
| 212 | Y | A | 0.0000 | Buried |
| 213 | A | A | 0.0000 | Buried |
| 214 | C | A | 0.0000 | Buried |
| 215 | E | A | -0.7671 | Soluble |
| 216 | V | A | 0.0000 | Buried |
| 217 | T | A | -1.1850 | Soluble |
| 218 | H | A | 0.0000 | Buried |
| 219 | Q | A | -1.5028 | Soluble |
| 220 | G | A | -0.1667 | Soluble |
| 221 | L | A | -0.1685 | Soluble |
| 222 | S | A | -0.4593 | Soluble |
| 223 | S | A | -0.4536 | Soluble |
| 224 | P | A | -0.5731 | Soluble |
| 225 | V | A | -0.0780 | Soluble |
| 226 | T | A | -0.3959 | Soluble |
| 227 | K | A | -0.6646 | Soluble |
| 228 | S | A | -0.6853 | Soluble |
| 229 | F | A | -1.0557 | Soluble |
| 230 | N | A | -2.1743 | Soluble |
| 231 | R | A | -3.3912 | Soluble |
| 232 | G | A | -3.3636 | 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 | -0.7461 | 2.5651 | CSV PDB |
| 4.5 | -0.7874 | 2.5013 | CSV PDB |
| 5.0 | -0.8363 | 2.4225 | CSV PDB |
| 5.5 | -0.8839 | 2.3359 | CSV PDB |
| 6.0 | -0.9189 | 2.2463 | CSV PDB |
| 6.5 | -0.9323 | 2.1558 | CSV PDB |
| 7.0 | -0.9242 | 2.0751 | CSV PDB |
| 7.5 | -0.9024 | 2.0394 | CSV PDB |
| 8.0 | -0.8732 | 2.0041 | CSV PDB |
| 8.5 | -0.8379 | 1.969 | CSV PDB |
| 9.0 | -0.7961 | 1.9316 | CSV PDB |