Calculation Parameters
| Chain Sequence(s) |
EVQLVQSGAEVKKPGASVKVSCKASGYKFTDSEMHWVRQAPGQGLEWIGGVDPETEGAAYNQKFKGRATITRDTSTTAYLELSSLRSEDTAVYYCTRGYDYDYALDYWGQGTLVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYLSSVVTVPSSLGTQTYICNVNHKPSNTKVDKKVEPKSDIQMTQSPSSLSASVGDRVTITCRASSSVEFIHWYQQKPGKAPKPLISATSNLASGVPSRFSGSGSGTDFTLTISSLQPEDFATYYCQQWSSAPWTFGQGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGE
input.pdb
|
| Selected Chain(s) | H (Heavy), L (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 | H | -2.1243 | Soluble |
| 2 | V | H | -1.3122 | Soluble |
| 3 | Q | H | -1.5001 | Soluble |
| 4 | L | H | 0.0000 | Buried |
| 5 | V | H | -0.3339 | Soluble |
| 6 | Q | H | 0.0000 | Buried |
| 7 | S | H | -0.8601 | Soluble |
| 8 | G | H | -1.0445 | Soluble |
| 9 | A | H | -0.8898 | Soluble |
| 11 | E | H | -1.4795 | Soluble |
| 12 | V | H | -0.9739 | Soluble |
| 13 | K | H | -1.7312 | Soluble |
| 14 | K | H | -2.4860 | Soluble |
| 15 | P | H | -2.2232 | Soluble |
| 16 | G | H | -1.6002 | Soluble |
| 17 | A | H | -1.2676 | Soluble |
| 18 | S | H | -1.4025 | Soluble |
| 19 | V | H | 0.0000 | Buried |
| 20 | K | H | -2.1232 | Soluble |
| 21 | V | H | 0.0000 | Buried |
| 22 | S | H | -0.8026 | Soluble |
| 23 | C | H | 0.0000 | Buried |
| 24 | K | H | -1.6068 | Soluble |
| 25 | A | H | -1.0723 | Soluble |
| 26 | S | H | -1.4310 | Soluble |
| 27 | G | H | -1.5408 | Soluble |
| 28 | Y | H | -1.4518 | Soluble |
| 29 | K | H | -2.1322 | Soluble |
| 30 | F | H | -1.9768 | Soluble |
| 35 | T | H | -2.5004 | Soluble |
| 36 | D | H | -2.8480 | Soluble |
| 37 | S | H | 0.0000 | Buried |
| 38 | E | H | -1.9797 | Soluble |
| 39 | M | H | 0.0000 | Buried |
| 40 | H | H | 0.0000 | Buried |
| 41 | W | H | 0.0000 | Buried |
| 42 | V | H | 0.0000 | Buried |
| 43 | R | H | -0.5699 | Soluble |
| 44 | Q | H | 0.0000 | Buried |
| 45 | A | H | -0.9994 | Soluble |
| 46 | P | H | -0.9203 | Soluble |
| 47 | G | H | -1.3254 | Soluble |
| 48 | Q | H | -1.8507 | Soluble |
| 49 | G | H | -1.3634 | Soluble |
| 50 | L | H | 0.0000 | Buried |
| 51 | E | H | -1.3989 | Soluble |
| 52 | W | H | 0.0000 | Buried |
| 53 | I | H | 0.0000 | Buried |
| 54 | G | H | 0.0000 | Buried |
| 55 | G | H | 0.0000 | Buried |
| 56 | V | H | 0.0000 | Buried |
| 57 | D | H | -2.4692 | Soluble |
| 58 | P | H | 0.0000 | Buried |
| 59 | E | H | -3.1027 | Soluble |
| 62 | T | H | -2.0934 | Soluble |
| 63 | E | H | -2.9325 | Soluble |
| 64 | G | H | -1.8141 | Soluble |
| 65 | A | H | -0.7250 | Soluble |
| 66 | A | H | 0.1204 | Aggregation-prone |
| 67 | Y | H | -0.1672 | Soluble |
| 68 | N | H | 0.0000 | Buried |
| 69 | Q | H | -1.9184 | Soluble |
| 70 | K | H | -2.6768 | Soluble |
| 71 | F | H | 0.0000 | Buried |
| 72 | K | H | -2.7118 | Soluble |
| 74 | G | H | -1.7618 | Soluble |
| 75 | R | H | -1.5445 | Soluble |
| 76 | A | H | 0.0000 | Buried |
| 77 | T | H | -0.5942 | Soluble |
| 78 | I | H | 0.0000 | Buried |
| 79 | T | H | -0.8500 | Soluble |
| 80 | R | H | -1.3925 | Soluble |
| 81 | D | H | -1.3021 | Soluble |
| 82 | T | H | -1.2191 | Soluble |
| 83 | S | H | -0.5091 | Soluble |
| 84 | T | H | -0.7320 | Soluble |
| 86 | T | H | 0.0000 | Buried |
| 87 | A | H | 0.0000 | Buried |
| 88 | Y | H | -0.7947 | Soluble |
| 89 | L | H | 0.0000 | Buried |
| 90 | E | H | -1.6071 | Soluble |
| 91 | L | H | 0.0000 | Buried |
| 92 | S | H | -1.1582 | Soluble |
| 93 | S | H | -1.1791 | Soluble |
| 94 | L | H | 0.0000 | Buried |
| 95 | R | H | -2.9985 | Soluble |
| 96 | S | H | -2.3324 | Soluble |
| 97 | E | H | -2.5169 | Soluble |
| 98 | D | H | 0.0000 | Buried |
| 99 | T | H | -0.9460 | Soluble |
| 100 | A | H | 0.0000 | Buried |
| 101 | V | H | 0.0879 | Aggregation-prone |
| 102 | Y | H | 0.0000 | Buried |
| 103 | Y | H | 0.0000 | Buried |
| 104 | C | H | 0.0000 | Buried |
| 105 | T | H | 0.0000 | Buried |
| 106 | R | H | 0.0000 | Buried |
| 107 | G | H | -0.3212 | Soluble |
| 108 | Y | H | 0.0491 | Aggregation-prone |
| 109 | D | H | -1.0447 | Soluble |
| 110 | Y | H | 0.0364 | Aggregation-prone |
| 112 | D | H | -1.3650 | Soluble |
| 113 | Y | H | 0.0692 | Aggregation-prone |
| 114 | A | H | 0.0000 | Buried |
| 115 | L | H | 0.0000 | Buried |
| 116 | D | H | 0.0755 | Aggregation-prone |
| 117 | Y | H | 0.2717 | Aggregation-prone |
| 118 | W | H | -0.3190 | Soluble |
| 119 | G | H | 0.0000 | Buried |
| 120 | Q | H | -1.4325 | Soluble |
| 121 | G | H | -0.7699 | Soluble |
| 122 | T | H | 0.0000 | Buried |
| 123 | L | H | -0.1388 | Soluble |
| 124 | V | H | 0.0000 | Buried |
| 125 | T | H | -0.9846 | Soluble |
| 126 | V | H | 0.0000 | Buried |
| 127 | S | H | -1.4121 | Soluble |
| 128 | S | H | -0.9666 | Soluble |
| 129 | A | H | -0.5500 | Soluble |
| 130 | S | H | -0.5903 | Soluble |
| 131 | T | H | -0.6839 | Soluble |
| 132 | K | H | -1.1315 | Soluble |
| 133 | G | H | -1.3278 | Soluble |
| 134 | P | H | -0.6133 | Soluble |
| 135 | S | H | -0.5110 | Soluble |
| 136 | V | H | 0.0000 | Buried |
| 137 | F | H | 0.0000 | Buried |
| 138 | P | H | -1.3211 | Soluble |
| 139 | L | H | 0.0000 | Buried |
| 140 | A | H | -1.4155 | Soluble |
| 141 | P | H | 0.0000 | Buried |
| 142 | S | H | -1.1825 | Soluble |
| 143 | S | H | -0.8350 | Soluble |
| 144 | K | H | -1.1062 | Soluble |
| 145 | S | H | 0.0000 | Buried |
| 146 | T | H | -0.6147 | Soluble |
| 147 | S | H | -0.6344 | Soluble |
| 148 | G | H | -0.7929 | Soluble |
| 149 | G | H | -0.8718 | Soluble |
| 150 | T | H | -0.6037 | Soluble |
| 151 | A | H | 0.0000 | Buried |
| 152 | A | H | 0.0000 | Buried |
| 153 | L | H | 0.0000 | Buried |
| 154 | G | H | 0.0000 | Buried |
| 155 | C | H | 0.0000 | Buried |
| 156 | L | H | 0.0000 | Buried |
| 157 | V | H | 0.0000 | Buried |
| 158 | K | H | -0.2575 | Soluble |
| 159 | D | H | -0.3991 | Soluble |
| 160 | Y | H | 0.0000 | Buried |
| 161 | F | H | -0.2120 | Soluble |
| 162 | P | H | 0.0000 | Buried |
| 163 | E | H | -0.8044 | Soluble |
| 164 | P | H | -0.8040 | Soluble |
| 165 | V | H | 0.0000 | Buried |
| 166 | T | H | -0.5394 | Soluble |
| 167 | V | H | -0.3670 | Soluble |
| 168 | S | H | -0.3993 | Soluble |
| 169 | W | H | 0.0000 | Buried |
| 170 | N | H | -0.8349 | Soluble |
| 171 | S | H | -0.7097 | Soluble |
| 172 | G | H | -0.6138 | Soluble |
| 173 | A | H | -0.2863 | Soluble |
| 174 | L | H | -0.0348 | Soluble |
| 175 | T | H | -0.2017 | Soluble |
| 176 | S | H | -0.1942 | Soluble |
| 177 | G | H | -0.2423 | Soluble |
| 178 | V | H | 0.1505 | Aggregation-prone |
| 179 | H | H | -0.2776 | Soluble |
| 180 | T | H | -0.0618 | Soluble |
| 181 | F | H | 0.0000 | Buried |
| 182 | P | H | -0.2161 | Soluble |
| 183 | A | H | 0.2199 | Aggregation-prone |
| 184 | V | H | 0.6145 | Aggregation-prone |
| 185 | L | H | 1.3674 | Aggregation-prone |
| 186 | Q | H | 0.3741 | Aggregation-prone |
| 187 | S | H | -0.0112 | Soluble |
| 188 | S | H | -0.1645 | Soluble |
| 189 | G | H | 0.2021 | Aggregation-prone |
| 190 | L | H | 0.1967 | Aggregation-prone |
| 191 | Y | H | 0.5221 | Aggregation-prone |
| 193 | L | H | 0.1610 | Aggregation-prone |
| 194 | S | H | 0.0000 | Buried |
| 195 | S | H | 0.0000 | Buried |
| 196 | V | H | 0.0000 | Buried |
| 197 | V | H | 0.0000 | Buried |
| 198 | T | H | -0.1433 | Soluble |
| 199 | V | H | 0.0000 | Buried |
| 200 | P | H | -0.6322 | Soluble |
| 201 | S | H | -0.5485 | Soluble |
| 202 | S | H | -0.5769 | Soluble |
| 204 | L | H | -0.8076 | Soluble |
| 205 | G | H | -1.0142 | Soluble |
| 206 | T | H | -0.8372 | Soluble |
| 207 | Q | H | -1.5518 | Soluble |
| 208 | T | H | -1.2393 | Soluble |
| 209 | Y | H | 0.0000 | Buried |
| 210 | I | H | -1.1398 | Soluble |
| 211 | C | H | 0.0000 | Buried |
| 212 | N | H | -1.4647 | Soluble |
| 213 | V | H | 0.0000 | Buried |
| 214 | N | H | -1.6828 | Soluble |
| 215 | H | H | 0.0000 | Buried |
| 216 | K | H | -2.6077 | Soluble |
| 217 | P | H | -1.6579 | Soluble |
| 218 | S | H | -1.6978 | Soluble |
| 219 | N | H | -2.5180 | Soluble |
| 220 | T | H | -1.9336 | Soluble |
| 221 | K | H | -2.5671 | Soluble |
| 222 | V | H | -1.5122 | Soluble |
| 223 | D | H | -2.5217 | Soluble |
| 224 | K | H | -2.2490 | Soluble |
| 225 | K | H | -2.5063 | Soluble |
| 226 | V | H | 0.0000 | Buried |
| 227 | E | H | -2.8997 | Soluble |
| 228 | P | H | -1.9341 | Soluble |
| 229 | K | H | -2.4437 | Soluble |
| 230 | S | H | -1.5142 | Soluble |
| 1 | D | L | -2.1369 | Soluble |
| 2 | I | L | 0.0000 | Buried |
| 3 | Q | L | -2.0084 | Soluble |
| 4 | M | L | 0.0000 | Buried |
| 5 | T | L | -1.1224 | Soluble |
| 6 | Q | L | 0.0000 | Buried |
| 7 | S | L | -0.5919 | Soluble |
| 8 | P | L | -0.5253 | Soluble |
| 9 | S | L | -0.8420 | Soluble |
| 10 | S | L | -0.8186 | Soluble |
| 11 | L | L | -0.5072 | Soluble |
| 12 | S | L | -0.8774 | Soluble |
| 13 | A | L | -0.9523 | Soluble |
| 14 | S | L | -0.9400 | Soluble |
| 15 | V | L | -0.2862 | Soluble |
| 16 | G | L | -0.9372 | Soluble |
| 17 | D | L | -1.8215 | Soluble |
| 18 | R | L | -2.3471 | Soluble |
| 19 | V | L | 0.0000 | Buried |
| 20 | T | L | -0.6292 | Soluble |
| 21 | I | L | 0.0000 | Buried |
| 22 | T | L | -0.6722 | Soluble |
| 23 | C | L | 0.0000 | Buried |
| 24 | R | L | -1.8111 | Soluble |
| 25 | A | L | 0.0000 | Buried |
| 26 | S | L | -1.4102 | Soluble |
| 27 | S | L | -1.1435 | Soluble |
| 28 | S | L | -1.1661 | Soluble |
| 29 | V | L | 0.0000 | Buried |
| 37 | E | L | -2.1573 | Soluble |
| 38 | F | L | 0.0000 | Buried |
| 39 | I | L | 0.0000 | Buried |
| 40 | H | L | 0.0000 | Buried |
| 41 | W | L | 0.0000 | Buried |
| 42 | Y | L | 0.0000 | Buried |
| 43 | Q | L | 0.0000 | Buried |
| 44 | Q | L | 0.0000 | Buried |
| 45 | K | L | -1.7776 | Soluble |
| 46 | P | L | -1.3617 | Soluble |
| 47 | G | L | -1.7203 | Soluble |
| 48 | K | L | -2.5066 | Soluble |
| 49 | A | L | -1.4951 | Soluble |
| 50 | P | L | 0.0000 | Buried |
| 51 | K | L | -1.2202 | Soluble |
| 52 | P | L | -0.3357 | Soluble |
| 53 | L | L | 0.0000 | Buried |
| 54 | I | L | 0.0000 | Buried |
| 55 | S | L | 0.0000 | Buried |
| 56 | A | L | -0.7632 | Soluble |
| 57 | T | L | 0.0000 | Buried |
| 65 | S | L | -0.8575 | Soluble |
| 66 | N | L | -1.2607 | Soluble |
| 67 | L | L | -0.2995 | Soluble |
| 68 | A | L | -0.3226 | Soluble |
| 69 | S | L | -0.4805 | Soluble |
| 70 | G | L | -0.4639 | Soluble |
| 71 | V | L | -0.3872 | Soluble |
| 72 | P | L | -0.2961 | Soluble |
| 74 | S | L | -0.3844 | Soluble |
| 75 | R | L | -0.7279 | Soluble |
| 76 | F | L | 0.0000 | Buried |
| 77 | S | L | -0.5077 | Soluble |
| 78 | G | L | -0.5390 | Soluble |
| 79 | S | L | -0.7971 | Soluble |
| 80 | G | L | -0.9772 | Soluble |
| 83 | S | L | -1.2773 | Soluble |
| 84 | G | L | -1.3584 | Soluble |
| 85 | T | L | -1.4870 | Soluble |
| 86 | D | L | -1.8183 | Soluble |
| 87 | F | L | 0.0000 | Buried |
| 88 | T | L | -0.6546 | Soluble |
| 89 | L | L | 0.0000 | Buried |
| 90 | T | L | -0.6196 | Soluble |
| 91 | I | L | 0.0000 | Buried |
| 92 | S | L | -1.3847 | Soluble |
| 93 | S | L | -1.2419 | Soluble |
| 94 | L | L | 0.0000 | Buried |
| 95 | Q | L | -1.1553 | Soluble |
| 96 | P | L | -1.7957 | Soluble |
| 97 | E | L | -2.2859 | Soluble |
| 98 | D | L | 0.0000 | Buried |
| 99 | F | L | 0.0000 | Buried |
| 100 | A | L | 0.0000 | Buried |
| 101 | T | L | -0.8489 | Soluble |
| 102 | Y | L | 0.0000 | Buried |
| 103 | Y | L | 0.0000 | Buried |
| 104 | C | L | 0.0000 | Buried |
| 105 | Q | L | 0.0000 | Buried |
| 106 | Q | L | 0.0000 | Buried |
| 107 | W | L | 0.0000 | Buried |
| 108 | S | L | -0.4916 | Soluble |
| 109 | S | L | -0.6887 | Soluble |
| 114 | A | L | -0.3356 | Soluble |
| 115 | P | L | 0.0000 | Buried |
| 116 | W | L | -0.3685 | Soluble |
| 117 | T | L | -0.8353 | Soluble |
| 118 | F | L | 0.0000 | Buried |
| 119 | G | L | 0.0000 | Buried |
| 120 | Q | L | -1.5908 | Soluble |
| 121 | G | L | 0.0000 | Buried |
| 122 | T | L | 0.0000 | Buried |
| 123 | K | L | -1.4943 | Soluble |
| 124 | V | L | 0.0000 | Buried |
| 125 | E | L | -1.2816 | Soluble |
| 126 | I | L | 0.0000 | Buried |
| 127 | K | L | -1.2372 | Soluble |
| 128 | R | L | -0.9861 | Soluble |
| 129 | T | L | -0.1891 | Soluble |
| 130 | V | L | 0.3051 | Aggregation-prone |
| 131 | A | L | -0.0472 | Soluble |
| 132 | A | L | -0.1319 | Soluble |
| 133 | P | L | 0.0000 | Buried |
| 134 | S | L | -0.2218 | Soluble |
| 135 | V | L | 0.0000 | Buried |
| 136 | F | L | 0.0000 | Buried |
| 137 | I | L | 0.0000 | Buried |
| 138 | F | L | 0.0000 | Buried |
| 139 | P | L | -1.0073 | Soluble |
| 140 | P | L | 0.0000 | Buried |
| 141 | S | L | -1.8323 | Soluble |
| 142 | D | L | -2.9686 | Soluble |
| 143 | E | L | -3.0755 | Soluble |
| 144 | Q | L | 0.0000 | Buried |
| 145 | L | L | -2.2069 | Soluble |
| 146 | K | L | -2.8356 | Soluble |
| 147 | S | L | -1.7422 | Soluble |
| 148 | G | L | -1.1519 | Soluble |
| 149 | T | L | -1.1178 | Soluble |
| 150 | A | L | 0.0000 | Buried |
| 151 | S | L | 0.0000 | Buried |
| 152 | V | L | 0.0000 | Buried |
| 153 | V | L | 0.0000 | Buried |
| 154 | C | L | 0.0000 | Buried |
| 155 | L | L | 0.0000 | Buried |
| 156 | L | L | 0.0000 | Buried |
| 157 | N | L | 0.0000 | Buried |
| 158 | N | L | -0.9437 | Soluble |
| 159 | F | L | 0.0000 | Buried |
| 160 | Y | L | 0.0000 | Buried |
| 161 | P | L | -1.4027 | Soluble |
| 162 | R | L | -2.1864 | Soluble |
| 163 | E | L | -2.8095 | Soluble |
| 164 | A | L | -2.0762 | Soluble |
| 165 | K | L | -2.3302 | Soluble |
| 166 | V | L | -1.1085 | Soluble |
| 167 | Q | L | -0.6243 | Soluble |
| 168 | W | L | 0.0000 | Buried |
| 169 | K | L | -0.6466 | Soluble |
| 170 | V | L | 0.0000 | Buried |
| 171 | D | L | -2.2206 | Soluble |
| 172 | N | L | -1.6898 | Soluble |
| 173 | A | L | -0.4311 | Soluble |
| 174 | L | L | 0.4565 | Aggregation-prone |
| 175 | Q | L | -0.1903 | Soluble |
| 176 | S | L | -0.4414 | Soluble |
| 177 | G | L | -0.8612 | Soluble |
| 178 | N | L | -0.7448 | Soluble |
| 179 | S | L | -1.0895 | Soluble |
| 180 | Q | L | -1.2543 | Soluble |
| 181 | E | L | -1.7106 | Soluble |
| 182 | S | L | -0.8383 | Soluble |
| 183 | V | L | -0.6311 | Soluble |
| 184 | T | L | 0.0000 | Buried |
| 185 | E | L | -1.5398 | Soluble |
| 186 | Q | L | 0.0000 | Buried |
| 187 | D | L | -2.1216 | Soluble |
| 189 | K | L | -2.6728 | Soluble |
| 190 | D | L | -1.9427 | Soluble |
| 191 | S | L | 0.0000 | Buried |
| 192 | T | L | 0.0000 | Buried |
| 193 | Y | L | 0.0000 | Buried |
| 194 | S | L | 0.0000 | Buried |
| 195 | L | L | 0.0000 | Buried |
| 196 | S | L | 0.0000 | Buried |
| 197 | S | L | 0.0000 | Buried |
| 198 | T | L | -0.6350 | Soluble |
| 199 | L | L | 0.0000 | Buried |
| 200 | T | L | -0.3883 | Soluble |
| 201 | L | L | -0.6279 | Soluble |
| 202 | S | L | -0.9695 | Soluble |
| 203 | K | L | -1.9538 | Soluble |
| 204 | A | L | -1.8387 | Soluble |
| 205 | D | L | -2.5306 | Soluble |
| 206 | Y | L | 0.0000 | Buried |
| 207 | E | L | -3.6935 | Soluble |
| 208 | K | L | -3.7333 | Soluble |
| 209 | H | L | -3.1529 | Soluble |
| 210 | K | L | -3.5017 | Soluble |
| 211 | V | L | -1.6852 | Soluble |
| 212 | Y | L | 0.0000 | Buried |
| 213 | A | L | 0.0000 | Buried |
| 214 | C | L | 0.0000 | Buried |
| 215 | E | L | -0.5747 | Soluble |
| 216 | V | L | 0.0000 | Buried |
| 217 | T | L | -1.2144 | Soluble |
| 218 | H | L | 0.0000 | Buried |
| 219 | Q | L | -1.6487 | Soluble |
| 220 | G | L | -0.4255 | Soluble |
| 221 | L | L | -0.2233 | Soluble |
| 222 | S | L | -0.4506 | Soluble |
| 223 | S | L | -0.4323 | Soluble |
| 224 | P | L | -0.5822 | Soluble |
| 225 | V | L | 0.0248 | Aggregation-prone |
| 226 | T | L | -0.3657 | Soluble |
| 227 | K | L | -0.6723 | Soluble |
| 228 | S | L | -0.6394 | Soluble |
| 229 | F | L | 0.0000 | Buried |
| 230 | N | L | -2.2290 | Soluble |
| 231 | R | L | -2.8091 | Soluble |
| 232 | G | L | -2.3091 | Soluble |
| 233 | E | L | -2.6303 | 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 | -0.804 | 1.8792 | CSV PDB |
| 4.5 | -0.8555 | 1.733 | CSV PDB |
| 5.0 | -0.9178 | 1.6812 | CSV PDB |
| 5.5 | -0.9781 | 1.6242 | CSV PDB |
| 6.0 | -1.0218 | 1.5692 | CSV PDB |
| 6.5 | -1.0381 | 1.5252 | CSV PDB |
| 7.0 | -1.0264 | 1.5252 | CSV PDB |
| 7.5 | -0.995 | 1.5252 | CSV PDB |
| 8.0 | -0.9523 | 1.5252 | CSV PDB |
| 8.5 | -0.9017 | 1.5252 | CSV PDB |
| 9.0 | -0.8439 | 1.5252 | CSV PDB |