Calculation Parameters
| Chain Sequence(s) |
EVQLLESGGGLVQPGGSLRLSCAASGFTFSQYGMDWVRQAPGKGLEWVSGIGPSGGSTVYADSVKGRFTISRDNSKNTLYLQMNSLRAEDTAVYYCTRGGPYYYYGMDVWGQGTTVTVSSASTKGPSVFPLAPGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPKDIQMTQSPSSLSASVGDRVTITCQASQDISNYLNWYQQKPGKAPKLLIYDASNLETGVPSRFSGSGSGTDFTFTISSLQPEDIATYYCQQANSFPVTFGGGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYSREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGE
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 | -1.8136 | Soluble |
| 2 | V | H | -0.6748 | Soluble |
| 3 | Q | H | -0.8812 | Soluble |
| 4 | L | H | 0.0000 | Buried |
| 5 | L | H | 0.5983 | Aggregation-prone |
| 6 | E | H | 0.0000 | Buried |
| 7 | S | H | -0.5479 | Soluble |
| 8 | G | H | -0.8723 | Soluble |
| 9 | G | H | -0.7583 | Soluble |
| 11 | G | H | -0.4749 | Soluble |
| 12 | L | H | -0.2670 | Soluble |
| 13 | V | H | 0.0000 | Buried |
| 14 | Q | H | -1.6384 | Soluble |
| 15 | P | H | -1.5163 | Soluble |
| 16 | G | H | -1.4465 | Soluble |
| 17 | G | H | 0.0000 | Buried |
| 18 | S | H | -1.1802 | Soluble |
| 19 | L | H | -1.0608 | Soluble |
| 20 | R | H | -2.1246 | Soluble |
| 21 | L | H | 0.0000 | Buried |
| 22 | S | H | -0.4552 | Soluble |
| 23 | C | H | 0.0000 | Buried |
| 24 | A | H | -0.1400 | Soluble |
| 25 | A | H | 0.0000 | Buried |
| 26 | S | H | -0.5907 | Soluble |
| 27 | G | H | -0.9511 | Soluble |
| 28 | F | H | -0.4685 | Soluble |
| 29 | T | H | -0.4210 | Soluble |
| 30 | F | H | 0.0000 | Buried |
| 35 | S | H | -1.1790 | Soluble |
| 36 | Q | H | -1.1865 | Soluble |
| 37 | Y | H | -0.3825 | Soluble |
| 38 | G | H | -0.4728 | Soluble |
| 39 | M | H | 0.0000 | Buried |
| 40 | D | H | 0.0000 | Buried |
| 41 | W | H | 0.0000 | Buried |
| 42 | V | H | 0.0000 | Buried |
| 43 | R | H | 0.0000 | Buried |
| 44 | Q | H | 0.0000 | Buried |
| 45 | A | H | -1.2467 | Soluble |
| 46 | P | H | -1.3191 | Soluble |
| 47 | G | H | -1.5548 | Soluble |
| 48 | K | H | -2.2738 | Soluble |
| 49 | G | H | -1.4822 | Soluble |
| 50 | L | H | 0.0000 | Buried |
| 51 | E | H | -1.3088 | Soluble |
| 52 | W | H | 0.0000 | Buried |
| 53 | V | H | 0.0000 | Buried |
| 54 | S | H | 0.0000 | Buried |
| 55 | G | H | 0.0000 | Buried |
| 56 | I | H | 0.0000 | Buried |
| 57 | G | H | -0.6216 | Soluble |
| 58 | P | H | -1.0137 | Soluble |
| 59 | S | H | -1.0003 | Soluble |
| 62 | G | H | -0.8661 | Soluble |
| 63 | G | H | -0.7335 | Soluble |
| 64 | S | H | -0.5126 | Soluble |
| 65 | T | H | -0.1593 | Soluble |
| 66 | V | H | 0.1279 | Aggregation-prone |
| 67 | Y | H | -0.5496 | Soluble |
| 68 | A | H | -1.1840 | Soluble |
| 69 | D | H | -2.4676 | Soluble |
| 70 | S | H | -1.8072 | Soluble |
| 71 | V | H | 0.0000 | Buried |
| 72 | K | H | -2.5843 | Soluble |
| 74 | G | H | -1.8211 | Soluble |
| 75 | R | H | -1.6327 | Soluble |
| 76 | F | H | 0.0000 | Buried |
| 77 | T | H | -0.8709 | Soluble |
| 78 | I | H | 0.0000 | Buried |
| 79 | S | H | -0.5236 | Soluble |
| 80 | R | H | 0.0000 | Buried |
| 81 | D | H | -1.8179 | Soluble |
| 82 | N | H | -1.9436 | Soluble |
| 83 | S | H | -1.6426 | Soluble |
| 84 | K | H | -2.3758 | Soluble |
| 85 | N | H | -1.6939 | Soluble |
| 86 | T | H | 0.0000 | Buried |
| 87 | L | H | 0.0000 | Buried |
| 88 | Y | H | -0.6393 | Soluble |
| 89 | L | H | 0.0000 | Buried |
| 90 | Q | H | -1.3215 | Soluble |
| 91 | M | H | 0.0000 | Buried |
| 92 | N | H | -1.5372 | Soluble |
| 93 | S | H | -1.3029 | Soluble |
| 94 | L | H | 0.0000 | Buried |
| 95 | R | H | -2.3512 | Soluble |
| 96 | A | H | -1.7240 | Soluble |
| 97 | E | H | -2.2568 | Soluble |
| 98 | D | H | 0.0000 | Buried |
| 99 | T | H | -0.7591 | Soluble |
| 100 | A | H | 0.0000 | Buried |
| 101 | V | H | -0.1341 | Soluble |
| 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 | -0.2439 | Soluble |
| 107 | G | H | 0.0792 | Aggregation-prone |
| 108 | G | H | 0.0000 | Buried |
| 109 | P | H | 0.8681 | Aggregation-prone |
| 110 | Y | H | 1.8802 | Aggregation-prone |
| 111 | Y | H | 1.9355 | Aggregation-prone |
| 112 | Y | H | 0.0000 | Buried |
| 113 | Y | H | 0.7984 | Aggregation-prone |
| 114 | G | H | 0.0000 | Buried |
| 115 | M | H | 0.0000 | Buried |
| 116 | D | H | -0.5241 | Soluble |
| 117 | V | H | -0.3481 | Soluble |
| 118 | W | H | -0.3353 | Soluble |
| 119 | G | H | 0.0000 | Buried |
| 120 | Q | H | -1.3593 | Soluble |
| 121 | G | H | -0.5867 | Soluble |
| 122 | T | H | -0.2389 | Soluble |
| 123 | T | H | -0.1694 | Soluble |
| 124 | V | H | 0.0000 | Buried |
| 125 | T | H | -0.6058 | Soluble |
| 126 | V | H | 0.0000 | Buried |
| 127 | S | H | -0.7688 | Soluble |
| 128 | S | H | -0.7345 | Soluble |
| 129 | A | H | -0.4341 | Soluble |
| 130 | S | H | -0.5821 | Soluble |
| 131 | T | H | -1.0038 | Soluble |
| 132 | K | H | -1.4642 | Soluble |
| 133 | G | H | -1.5084 | Soluble |
| 134 | P | H | 0.0000 | Buried |
| 135 | S | H | -0.3814 | Soluble |
| 136 | V | H | 0.0000 | Buried |
| 137 | F | H | 0.0000 | Buried |
| 138 | P | H | -0.9847 | Soluble |
| 139 | L | H | 0.0000 | Buried |
| 140 | A | H | -1.2059 | Soluble |
| 141 | P | H | -0.8291 | Soluble |
| 142 | G | H | -0.6289 | Soluble |
| 143 | T | H | -0.4585 | Soluble |
| 144 | A | H | -0.2408 | Soluble |
| 145 | A | H | 0.0000 | Buried |
| 146 | L | H | 0.0000 | Buried |
| 147 | G | H | 0.0000 | Buried |
| 148 | C | H | 0.0000 | Buried |
| 149 | L | H | 0.0000 | Buried |
| 150 | V | H | 0.0000 | Buried |
| 151 | K | H | 0.0000 | Buried |
| 152 | D | H | -0.7411 | Soluble |
| 153 | Y | H | 0.0000 | Buried |
| 154 | F | H | -0.4423 | Soluble |
| 155 | P | H | 0.0000 | Buried |
| 156 | E | H | -0.8456 | Soluble |
| 157 | P | H | -0.8610 | Soluble |
| 158 | V | H | -0.5099 | Soluble |
| 159 | T | H | -0.5716 | Soluble |
| 160 | V | H | -0.1466 | Soluble |
| 161 | S | H | -0.3178 | Soluble |
| 162 | W | H | 0.0000 | Buried |
| 163 | N | H | -0.7216 | Soluble |
| 164 | S | H | -0.6297 | Soluble |
| 165 | G | H | -0.4919 | Soluble |
| 166 | A | H | -0.2116 | Soluble |
| 167 | L | H | 0.0518 | Aggregation-prone |
| 168 | T | H | -0.1007 | Soluble |
| 169 | S | H | -0.1452 | Soluble |
| 170 | G | H | -0.1220 | Soluble |
| 171 | V | H | 0.1954 | Aggregation-prone |
| 172 | H | H | -0.3054 | Soluble |
| 173 | T | H | 0.0398 | Aggregation-prone |
| 174 | F | H | 0.0000 | Buried |
| 175 | P | H | -0.4336 | Soluble |
| 176 | A | H | 0.0511 | Aggregation-prone |
| 177 | V | H | 0.1775 | Aggregation-prone |
| 178 | L | H | 0.7099 | Aggregation-prone |
| 179 | Q | H | 0.0188 | Aggregation-prone |
| 180 | S | H | -0.3087 | Soluble |
| 181 | S | H | -0.3580 | Soluble |
| 182 | G | H | -0.1436 | Soluble |
| 183 | L | H | -0.1552 | Soluble |
| 184 | Y | H | 0.1198 | Aggregation-prone |
| 185 | S | H | 0.0000 | Buried |
| 186 | L | H | 0.0000 | Buried |
| 187 | S | H | 0.0000 | Buried |
| 188 | S | H | 0.0000 | Buried |
| 189 | V | H | 0.0000 | Buried |
| 190 | V | H | 0.0000 | Buried |
| 191 | T | H | -0.1414 | Soluble |
| 192 | V | H | 0.0000 | Buried |
| 193 | P | H | -0.6016 | Soluble |
| 194 | S | H | -0.5656 | Soluble |
| 195 | S | H | -0.6569 | Soluble |
| 196 | S | H | 0.0000 | Buried |
| 197 | L | H | -0.8814 | Soluble |
| 198 | G | H | -0.9889 | Soluble |
| 199 | T | H | -0.8409 | Soluble |
| 200 | Q | H | -1.4554 | Soluble |
| 201 | T | H | -1.2206 | Soluble |
| 202 | Y | H | 0.0000 | Buried |
| 203 | I | H | -1.1283 | Soluble |
| 204 | C | H | 0.0000 | Buried |
| 205 | N | H | -1.3273 | Soluble |
| 206 | V | H | 0.0000 | Buried |
| 207 | N | H | -1.7763 | Soluble |
| 208 | H | H | 0.0000 | Buried |
| 209 | K | H | -2.6648 | Soluble |
| 210 | P | H | -1.5753 | Soluble |
| 211 | S | H | -1.8191 | Soluble |
| 212 | N | H | -2.4516 | Soluble |
| 213 | T | H | -2.2234 | Soluble |
| 214 | K | H | -2.6137 | Soluble |
| 215 | V | H | -1.4337 | Soluble |
| 216 | D | H | -2.3656 | Soluble |
| 217 | K | H | -1.8349 | Soluble |
| 218 | K | H | -2.3817 | Soluble |
| 219 | V | H | 0.0000 | Buried |
| 220 | E | H | -2.8719 | Soluble |
| 221 | P | H | -2.1032 | Soluble |
| 222 | K | H | -2.5702 | Soluble |
| 1 | D | L | -1.9826 | Soluble |
| 2 | I | L | 0.0000 | Buried |
| 3 | Q | L | -1.9570 | Soluble |
| 4 | M | L | 0.0000 | Buried |
| 5 | T | L | -1.1163 | Soluble |
| 6 | Q | L | -0.7716 | Soluble |
| 7 | S | L | -0.6614 | Soluble |
| 8 | P | L | -0.5550 | Soluble |
| 9 | S | L | -0.7508 | Soluble |
| 10 | S | L | -0.8922 | Soluble |
| 11 | L | L | -0.6515 | Soluble |
| 12 | S | L | -0.9074 | Soluble |
| 13 | A | L | -1.1348 | Soluble |
| 14 | S | L | -1.0429 | Soluble |
| 15 | V | L | -0.3562 | Soluble |
| 16 | G | L | -0.9227 | Soluble |
| 17 | D | L | -1.8307 | Soluble |
| 18 | R | L | -2.3908 | Soluble |
| 19 | V | L | 0.0000 | Buried |
| 20 | T | L | -0.6342 | Soluble |
| 21 | I | L | 0.0000 | Buried |
| 22 | T | L | -0.7907 | Soluble |
| 23 | C | L | 0.0000 | Buried |
| 24 | Q | L | -2.2825 | Soluble |
| 25 | A | L | 0.0000 | Buried |
| 26 | S | L | -2.0411 | Soluble |
| 27 | Q | L | -2.5623 | Soluble |
| 28 | D | L | -2.6690 | Soluble |
| 29 | I | L | 0.0000 | Buried |
| 36 | S | L | -1.3160 | Soluble |
| 37 | N | L | -1.1176 | Soluble |
| 38 | Y | L | 0.1072 | Aggregation-prone |
| 39 | L | L | 0.0000 | Buried |
| 40 | N | 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 | -1.3009 | Soluble |
| 45 | K | L | -1.7262 | Soluble |
| 46 | P | L | -1.5886 | Soluble |
| 47 | G | L | -1.8147 | Soluble |
| 48 | K | L | -2.5169 | Soluble |
| 49 | A | L | -1.6150 | Soluble |
| 50 | P | L | 0.0000 | Buried |
| 51 | K | L | -1.5247 | Soluble |
| 52 | L | L | 0.0000 | Buried |
| 53 | L | L | 0.0000 | Buried |
| 54 | I | L | 0.0000 | Buried |
| 55 | Y | L | 0.0000 | Buried |
| 56 | D | L | -0.7959 | Soluble |
| 57 | A | L | 0.0000 | Buried |
| 65 | S | L | -1.0261 | Soluble |
| 66 | N | L | -1.3686 | Soluble |
| 67 | L | L | -0.4654 | Soluble |
| 68 | E | L | -0.5442 | Soluble |
| 69 | T | L | -0.4292 | Soluble |
| 70 | G | L | -0.4695 | Soluble |
| 71 | V | L | -0.1872 | Soluble |
| 72 | P | L | -0.3282 | Soluble |
| 74 | S | L | -0.4069 | Soluble |
| 75 | R | L | -0.7998 | Soluble |
| 76 | F | L | 0.0000 | Buried |
| 77 | S | L | -0.5013 | Soluble |
| 78 | G | L | -0.5716 | Soluble |
| 79 | S | L | -1.0675 | Soluble |
| 80 | G | L | -1.3584 | Soluble |
| 83 | S | L | -1.4866 | Soluble |
| 84 | G | L | -1.8171 | Soluble |
| 85 | T | L | -2.2683 | Soluble |
| 86 | D | L | -2.7420 | Soluble |
| 87 | F | L | 0.0000 | Buried |
| 88 | T | L | -0.7853 | Soluble |
| 89 | F | L | 0.0000 | Buried |
| 90 | T | L | -0.6359 | Soluble |
| 91 | I | L | 0.0000 | Buried |
| 92 | S | L | -1.4314 | Soluble |
| 93 | S | L | -1.2444 | Soluble |
| 94 | L | L | 0.0000 | Buried |
| 95 | Q | L | -0.8795 | Soluble |
| 96 | P | L | -1.5708 | Soluble |
| 97 | E | L | -1.6414 | Soluble |
| 98 | D | L | 0.0000 | Buried |
| 99 | I | L | 0.0000 | Buried |
| 100 | A | L | 0.0000 | Buried |
| 101 | T | L | 0.0000 | Buried |
| 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 | A | L | 0.2700 | Aggregation-prone |
| 108 | N | L | -0.4223 | Soluble |
| 109 | S | L | 0.1564 | Aggregation-prone |
| 114 | F | L | 1.0521 | Aggregation-prone |
| 115 | P | L | 0.2296 | Aggregation-prone |
| 116 | V | L | 0.0000 | Buried |
| 117 | T | L | -0.5485 | Soluble |
| 118 | F | L | -0.4294 | Soluble |
| 119 | G | L | 0.0000 | Buried |
| 120 | G | L | -1.0467 | Soluble |
| 121 | G | L | -0.8997 | Soluble |
| 122 | T | L | 0.0000 | Buried |
| 123 | K | L | -1.4098 | Soluble |
| 124 | V | L | 0.0000 | Buried |
| 125 | E | L | -1.6415 | Soluble |
| 126 | I | L | 0.0000 | Buried |
| 127 | K | L | -1.4193 | Soluble |
| 128 | R | L | -1.0773 | Soluble |
| 129 | T | L | -0.1954 | Soluble |
| 130 | V | L | 0.1845 | Aggregation-prone |
| 131 | A | L | -0.1064 | Soluble |
| 132 | A | L | -0.0977 | Soluble |
| 133 | P | L | 0.0000 | Buried |
| 134 | S | L | 0.0526 | Aggregation-prone |
| 135 | V | L | 0.2358 | Aggregation-prone |
| 136 | F | L | 0.4485 | Aggregation-prone |
| 137 | I | L | 0.2905 | Aggregation-prone |
| 138 | F | L | 0.0000 | Buried |
| 139 | P | L | -0.6951 | Soluble |
| 140 | P | L | 0.0000 | Buried |
| 141 | S | L | -1.4067 | Soluble |
| 142 | D | L | -2.1957 | Soluble |
| 143 | E | L | -2.3117 | Soluble |
| 144 | Q | L | 0.0000 | Buried |
| 145 | L | L | -1.7156 | Soluble |
| 146 | K | L | -2.5425 | Soluble |
| 147 | S | L | -1.5749 | Soluble |
| 148 | G | L | -1.3468 | Soluble |
| 149 | T | L | -0.9388 | 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 | -0.9210 | Soluble |
| 159 | F | L | 0.0000 | Buried |
| 160 | Y | L | 0.0000 | Buried |
| 161 | S | L | -1.8613 | Soluble |
| 162 | R | L | -2.9438 | Soluble |
| 163 | E | L | -3.2760 | Soluble |
| 164 | A | L | -2.2836 | Soluble |
| 165 | K | L | -2.1825 | Soluble |
| 166 | V | L | -0.9379 | Soluble |
| 167 | Q | L | -0.4527 | Soluble |
| 168 | W | L | 0.0000 | Buried |
| 169 | K | L | -0.5078 | Soluble |
| 170 | V | L | 0.0000 | Buried |
| 171 | D | L | -2.1277 | Soluble |
| 172 | N | L | -1.5761 | Soluble |
| 173 | A | L | -0.2671 | Soluble |
| 174 | L | L | 0.7692 | Aggregation-prone |
| 175 | Q | L | -0.2064 | Soluble |
| 176 | S | L | -0.6243 | Soluble |
| 177 | G | L | -1.2545 | Soluble |
| 178 | N | L | -1.5264 | Soluble |
| 179 | S | L | -1.4160 | Soluble |
| 180 | Q | L | -1.5712 | Soluble |
| 181 | E | L | -1.9085 | Soluble |
| 182 | S | L | -1.0182 | Soluble |
| 183 | V | L | -0.8621 | Soluble |
| 184 | T | L | -1.1895 | Soluble |
| 185 | E | L | -2.3736 | Soluble |
| 186 | Q | L | 0.0000 | Buried |
| 187 | D | L | -2.0405 | Soluble |
| 188 | S | L | -2.2160 | Soluble |
| 189 | K | L | -2.5479 | Soluble |
| 190 | D | L | -1.9765 | 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 | -0.7495 | Soluble |
| 199 | L | L | 0.0000 | Buried |
| 200 | T | L | -0.4806 | Soluble |
| 201 | L | L | -0.7476 | Soluble |
| 202 | S | L | -1.2135 | Soluble |
| 203 | K | L | -1.9987 | Soluble |
| 204 | A | L | -1.8560 | Soluble |
| 205 | D | L | -2.7024 | Soluble |
| 206 | Y | L | 0.0000 | Buried |
| 207 | E | L | -3.2952 | Soluble |
| 208 | K | L | -3.5586 | Soluble |
| 209 | H | L | -3.1176 | Soluble |
| 210 | K | L | -3.2212 | Soluble |
| 211 | V | L | -1.6053 | Soluble |
| 212 | Y | L | 0.0000 | Buried |
| 213 | A | L | 0.0000 | Buried |
| 214 | C | L | 0.0000 | Buried |
| 215 | E | L | -0.6454 | Soluble |
| 216 | V | L | 0.0000 | Buried |
| 217 | T | L | -1.2115 | Soluble |
| 218 | H | L | 0.0000 | Buried |
| 219 | Q | L | -1.8387 | Soluble |
| 220 | G | L | -0.5034 | Soluble |
| 221 | L | L | -0.2360 | Soluble |
| 222 | S | L | -0.4520 | Soluble |
| 223 | S | L | -0.4519 | Soluble |
| 224 | P | L | -0.5871 | Soluble |
| 225 | V | L | 0.0138 | Aggregation-prone |
| 226 | T | L | -0.4051 | Soluble |
| 227 | K | L | -0.6405 | Soluble |
| 228 | S | L | -0.6072 | Soluble |
| 229 | F | L | -1.2081 | Soluble |
| 230 | N | L | -2.3880 | Soluble |
| 231 | R | L | -2.4930 | Soluble |
| 232 | G | L | -2.1011 | Soluble |
| 233 | E | L | -2.6793 | 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 | -0.6817 | 3.1232 | CSV PDB |
| 4.5 | -0.7305 | 3.0605 | CSV PDB |
| 5.0 | -0.7858 | 2.9911 | CSV PDB |
| 5.5 | -0.8379 | 2.9192 | CSV PDB |
| 6.0 | -0.8757 | 2.8466 | CSV PDB |
| 6.5 | -0.8905 | 2.7739 | CSV PDB |
| 7.0 | -0.8827 | 2.7015 | CSV PDB |
| 7.5 | -0.8601 | 2.6305 | CSV PDB |
| 8.0 | -0.8288 | 2.5636 | CSV PDB |
| 8.5 | -0.7899 | 2.5066 | CSV PDB |
| 9.0 | -0.7431 | 2.4676 | CSV PDB |