Calculation Parameters
| Chain Sequence(s) |
QVQLVESGGGVVQPGRSLRLSCAASGFTFSSYTMHWVRQAPGKGLEWVTFISYDGNNKYYADSVKGRFTISRDNSKNTLYLQMNSLRAEDTAIYYCARTGWLGPFDYWGQGTLVTVSSASTKGPSVFPLAPSSTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKRVEPEIVLTQSPGTLSLSPGERATLSCRASQSVGSSYLAWYQQKPGQAPRLLIYGAFSRATGIPDRFSGSGSGTDFTLTISRLEPEDFAVYYCQQYGSSPWTFGQGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNR
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 | Q | h | -1.1910 | Soluble |
| 2 | V | h | -0.2881 | Soluble |
| 3 | Q | h | -0.8331 | Soluble |
| 4 | L | h | 0.0000 | Buried |
| 5 | V | h | 0.3637 | Aggregation-prone |
| 6 | E | h | 0.0000 | Buried |
| 7 | S | h | -0.5650 | Soluble |
| 8 | G | h | -0.8878 | Soluble |
| 9 | G | h | -0.3884 | Soluble |
| 11 | G | h | -0.1383 | Soluble |
| 12 | V | h | 0.2724 | Aggregation-prone |
| 13 | V | h | 0.0000 | Buried |
| 14 | Q | h | -2.1193 | Soluble |
| 15 | P | h | -2.3811 | Soluble |
| 16 | G | h | -2.4063 | Soluble |
| 17 | R | h | -2.9160 | Soluble |
| 18 | S | h | -2.1002 | Soluble |
| 19 | L | h | -1.3611 | Soluble |
| 20 | R | h | -1.8381 | Soluble |
| 21 | L | h | 0.0000 | Buried |
| 22 | S | h | -0.4112 | Soluble |
| 23 | C | h | 0.0000 | Buried |
| 24 | A | h | -0.2732 | Soluble |
| 25 | A | h | 0.0000 | Buried |
| 26 | S | h | -0.5502 | Soluble |
| 27 | G | h | -0.8076 | Soluble |
| 28 | F | h | -0.2322 | Soluble |
| 29 | T | h | -0.0773 | Soluble |
| 30 | F | h | 0.0000 | Buried |
| 35 | S | h | -0.4287 | Soluble |
| 36 | S | h | 0.1532 | Aggregation-prone |
| 37 | Y | h | 0.5695 | Aggregation-prone |
| 38 | T | h | 0.0000 | Buried |
| 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 | 0.0000 | Buried |
| 44 | Q | h | -0.7589 | Soluble |
| 45 | A | h | -1.1214 | Soluble |
| 46 | P | h | -1.0651 | Soluble |
| 47 | G | h | -1.4802 | Soluble |
| 48 | K | h | -2.4133 | Soluble |
| 49 | G | h | -1.6373 | Soluble |
| 50 | L | h | 0.0000 | Buried |
| 51 | E | h | -1.3020 | Soluble |
| 52 | W | h | 0.0000 | Buried |
| 53 | V | h | 0.0000 | Buried |
| 54 | T | h | 0.0000 | Buried |
| 55 | F | h | 0.1128 | Aggregation-prone |
| 56 | I | h | 0.0000 | Buried |
| 57 | S | h | -0.7150 | Soluble |
| 58 | Y | h | -0.1876 | Soluble |
| 59 | D | h | -2.0358 | Soluble |
| 62 | G | h | -1.8957 | Soluble |
| 63 | N | h | -2.3717 | Soluble |
| 64 | N | h | -2.0694 | Soluble |
| 65 | K | h | -0.9145 | Soluble |
| 66 | Y | h | -0.0741 | Soluble |
| 67 | Y | h | -0.6226 | Soluble |
| 68 | A | h | -1.2942 | Soluble |
| 69 | D | h | -2.3730 | Soluble |
| 70 | S | h | -1.5794 | Soluble |
| 71 | V | h | 0.0000 | Buried |
| 72 | K | h | -2.4998 | Soluble |
| 74 | G | h | -1.7881 | Soluble |
| 75 | R | h | -1.3943 | Soluble |
| 76 | F | h | 0.0000 | Buried |
| 77 | T | h | -0.7735 | Soluble |
| 78 | I | h | 0.0000 | Buried |
| 79 | S | h | -0.8947 | Soluble |
| 80 | R | h | -1.1056 | Soluble |
| 81 | D | h | -1.9222 | Soluble |
| 82 | N | h | -1.8626 | Soluble |
| 83 | S | h | -1.6579 | Soluble |
| 84 | K | h | -2.4157 | Soluble |
| 85 | N | h | -1.7943 | Soluble |
| 86 | T | h | 0.0000 | Buried |
| 87 | L | h | 0.0000 | Buried |
| 88 | Y | h | -0.4247 | Soluble |
| 89 | L | h | 0.0000 | Buried |
| 90 | Q | h | -1.0902 | Soluble |
| 91 | M | h | 0.0000 | Buried |
| 92 | N | h | -1.9130 | Soluble |
| 93 | S | h | -1.9541 | Soluble |
| 94 | L | h | 0.0000 | Buried |
| 95 | R | h | -3.1235 | Soluble |
| 96 | A | h | -2.0173 | Soluble |
| 97 | E | h | -2.3982 | Soluble |
| 98 | D | h | 0.0000 | Buried |
| 99 | T | h | -0.7238 | Soluble |
| 100 | A | h | 0.0000 | Buried |
| 101 | I | h | 0.4852 | Aggregation-prone |
| 102 | Y | h | 0.0000 | Buried |
| 103 | Y | h | 0.0000 | Buried |
| 104 | C | h | 0.0000 | Buried |
| 105 | A | h | 0.0000 | Buried |
| 106 | R | h | 0.0000 | Buried |
| 107 | T | h | 0.6641 | Aggregation-prone |
| 108 | G | h | 0.0000 | Buried |
| 109 | W | h | 1.6436 | Aggregation-prone |
| 110 | L | h | 2.0181 | Aggregation-prone |
| 113 | G | h | 0.9649 | Aggregation-prone |
| 114 | P | h | 0.0000 | Buried |
| 115 | F | h | 0.0000 | Buried |
| 116 | D | h | 0.1822 | Aggregation-prone |
| 117 | Y | h | 0.2422 | Aggregation-prone |
| 118 | W | h | -0.2020 | Soluble |
| 119 | G | h | 0.0000 | Buried |
| 120 | Q | h | -1.2377 | Soluble |
| 121 | G | h | -0.4824 | Soluble |
| 122 | T | h | 0.0357 | Aggregation-prone |
| 123 | L | h | 0.5331 | Aggregation-prone |
| 124 | V | h | 0.0000 | Buried |
| 125 | T | h | 0.0000 | Buried |
| 126 | V | h | 0.0000 | Buried |
| 127 | S | h | -0.9880 | Soluble |
| 128 | S | h | -0.8572 | Soluble |
| 129 | A | h | -0.4689 | Soluble |
| 130 | S | h | -0.5501 | Soluble |
| 131 | T | h | -0.5356 | Soluble |
| 132 | K | h | -1.1144 | Soluble |
| 133 | G | h | -1.2748 | Soluble |
| 134 | P | h | -0.5353 | Soluble |
| 135 | S | h | -0.4098 | Soluble |
| 136 | V | h | 0.0000 | Buried |
| 137 | F | h | 0.0000 | Buried |
| 138 | P | h | -1.2556 | Soluble |
| 139 | L | h | 0.0000 | Buried |
| 140 | A | h | -0.8188 | Soluble |
| 141 | P | h | 0.0000 | Buried |
| 142 | S | h | -0.3454 | Soluble |
| 143 | S | h | -0.3621 | Soluble |
| 144 | T | h | -0.2834 | Soluble |
| 145 | A | h | -0.2025 | Soluble |
| 146 | A | h | 0.0000 | Buried |
| 147 | L | h | 0.0000 | Buried |
| 148 | G | h | 0.0000 | Buried |
| 149 | C | h | 0.0000 | Buried |
| 150 | L | h | 0.0000 | Buried |
| 151 | V | h | 0.0000 | Buried |
| 152 | K | h | 0.0000 | Buried |
| 153 | D | h | -0.2578 | Soluble |
| 154 | Y | h | 0.0000 | Buried |
| 155 | F | h | 0.0000 | Buried |
| 156 | P | h | 0.0000 | Buried |
| 157 | E | h | -0.7087 | Soluble |
| 158 | P | h | -0.8759 | Soluble |
| 159 | V | h | -0.7399 | Soluble |
| 160 | T | h | -0.6304 | Soluble |
| 161 | V | h | -0.3264 | Soluble |
| 162 | S | h | -0.3561 | Soluble |
| 163 | W | h | 0.0000 | Buried |
| 164 | N | h | -0.8090 | Soluble |
| 165 | S | h | -0.6643 | Soluble |
| 166 | G | h | -0.5622 | Soluble |
| 167 | A | h | -0.2853 | Soluble |
| 168 | L | h | -0.0286 | Soluble |
| 169 | T | h | -0.1732 | Soluble |
| 170 | S | h | -0.1735 | Soluble |
| 171 | G | h | -0.1869 | Soluble |
| 172 | V | h | 0.2086 | Aggregation-prone |
| 173 | H | h | -0.2351 | Soluble |
| 174 | T | h | -0.1136 | Soluble |
| 175 | F | h | 0.0000 | Buried |
| 176 | P | h | -0.2110 | Soluble |
| 177 | A | h | 0.2588 | Aggregation-prone |
| 178 | V | h | 0.7229 | Aggregation-prone |
| 179 | L | h | 1.4544 | Aggregation-prone |
| 180 | Q | h | 0.4559 | Aggregation-prone |
| 181 | S | h | -0.0968 | Soluble |
| 182 | S | h | -0.1422 | Soluble |
| 183 | G | h | 0.1347 | Aggregation-prone |
| 184 | L | h | 0.1342 | Aggregation-prone |
| 185 | Y | h | 0.0000 | Buried |
| 186 | S | h | 0.0000 | Buried |
| 187 | L | h | 0.0000 | Buried |
| 188 | S | h | 0.0000 | Buried |
| 189 | S | h | 0.0000 | Buried |
| 190 | V | h | 0.0000 | Buried |
| 191 | V | h | 0.0000 | Buried |
| 192 | T | h | -0.1129 | Soluble |
| 193 | V | h | 0.0000 | Buried |
| 194 | P | h | -0.3779 | Soluble |
| 195 | S | h | -0.4734 | Soluble |
| 196 | S | h | -0.5606 | Soluble |
| 197 | S | h | -0.6861 | Soluble |
| 198 | L | h | -0.9715 | Soluble |
| 199 | G | h | -1.2435 | Soluble |
| 200 | T | h | -0.8842 | Soluble |
| 201 | Q | h | -1.5649 | Soluble |
| 202 | T | h | -1.3150 | Soluble |
| 203 | Y | h | 0.0000 | Buried |
| 204 | I | h | -1.0237 | Soluble |
| 205 | C | h | 0.0000 | Buried |
| 206 | N | h | -1.4215 | Soluble |
| 207 | V | h | 0.0000 | Buried |
| 208 | N | h | -1.8481 | Soluble |
| 209 | H | h | 0.0000 | Buried |
| 210 | K | h | -2.8484 | Soluble |
| 211 | P | h | -1.6046 | Soluble |
| 212 | S | h | -1.8165 | Soluble |
| 213 | N | h | -2.6427 | Soluble |
| 214 | T | h | -2.0893 | Soluble |
| 215 | K | h | -2.6203 | Soluble |
| 216 | V | h | -1.3831 | Soluble |
| 217 | D | h | -2.4120 | Soluble |
| 218 | K | h | -2.0227 | Soluble |
| 219 | R | h | -2.6309 | Soluble |
| 220 | V | h | 0.0000 | Buried |
| 221 | E | h | -2.5377 | Soluble |
| 222 | P | h | -1.2591 | Soluble |
| 1 | E | l | -1.5641 | Soluble |
| 2 | I | l | -0.4398 | Soluble |
| 3 | V | l | 0.3873 | Aggregation-prone |
| 4 | L | l | 0.0000 | Buried |
| 5 | T | l | -0.9093 | Soluble |
| 6 | Q | l | -1.1457 | Soluble |
| 7 | S | l | -0.9643 | Soluble |
| 8 | P | l | -0.5883 | Soluble |
| 9 | G | l | -0.9543 | Soluble |
| 10 | T | l | -0.5062 | Soluble |
| 11 | L | l | -0.2527 | Soluble |
| 12 | S | l | -0.5679 | Soluble |
| 13 | L | l | -0.9551 | Soluble |
| 14 | S | l | -1.4608 | Soluble |
| 15 | P | l | -1.7728 | Soluble |
| 16 | G | l | -2.1569 | Soluble |
| 17 | E | l | -3.0324 | Soluble |
| 18 | R | l | -3.1629 | Soluble |
| 19 | A | l | 0.0000 | Buried |
| 20 | T | l | -0.6775 | Soluble |
| 21 | L | l | 0.0000 | Buried |
| 22 | S | l | -0.9064 | Soluble |
| 23 | C | l | 0.0000 | Buried |
| 24 | R | l | -2.4714 | Soluble |
| 25 | A | l | -1.2839 | Soluble |
| 26 | S | l | -1.0877 | Soluble |
| 27 | Q | l | -1.8014 | Soluble |
| 28 | S | l | -1.4642 | Soluble |
| 29 | V | l | 0.0000 | Buried |
| 30 | G | l | -0.7695 | Soluble |
| 36 | S | l | -0.3876 | Soluble |
| 37 | S | l | -0.0422 | Soluble |
| 38 | Y | l | 0.7511 | Aggregation-prone |
| 39 | L | l | 0.0000 | Buried |
| 40 | A | 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 | -1.4793 | Soluble |
| 46 | P | l | -1.3209 | Soluble |
| 47 | G | l | -1.2849 | Soluble |
| 48 | Q | l | -1.9405 | Soluble |
| 49 | A | l | -1.2894 | Soluble |
| 50 | P | l | 0.0000 | Buried |
| 51 | R | l | -1.7658 | Soluble |
| 52 | L | l | 0.0000 | Buried |
| 53 | L | l | 0.0000 | Buried |
| 54 | I | l | 0.0000 | Buried |
| 55 | Y | l | 0.6829 | Aggregation-prone |
| 56 | G | l | 0.7763 | Aggregation-prone |
| 57 | A | l | 0.0000 | Buried |
| 65 | F | l | 1.5244 | Aggregation-prone |
| 66 | S | l | 0.2248 | Aggregation-prone |
| 67 | R | l | -1.1520 | Soluble |
| 68 | A | l | 0.0000 | Buried |
| 69 | T | l | -0.5712 | Soluble |
| 70 | G | l | -0.8196 | Soluble |
| 71 | I | l | -0.9953 | Soluble |
| 72 | P | l | -1.2633 | Soluble |
| 74 | D | l | -2.2113 | Soluble |
| 75 | R | l | -1.8948 | Soluble |
| 76 | F | l | 0.0000 | Buried |
| 77 | S | l | -0.4028 | Soluble |
| 78 | G | l | 0.3923 | Aggregation-prone |
| 79 | S | l | -0.0524 | Soluble |
| 80 | G | l | -0.7642 | Soluble |
| 83 | S | l | -0.6567 | Soluble |
| 84 | G | l | -1.2726 | Soluble |
| 85 | T | l | -1.8853 | Soluble |
| 86 | D | l | -2.4025 | Soluble |
| 87 | F | l | 0.0000 | Buried |
| 88 | T | l | -0.5479 | Soluble |
| 89 | L | l | 0.0000 | Buried |
| 90 | T | l | -0.8074 | Soluble |
| 91 | I | l | 0.0000 | Buried |
| 92 | S | l | -2.4235 | Soluble |
| 93 | R | l | -3.1972 | Soluble |
| 94 | L | l | 0.0000 | Buried |
| 95 | E | l | -1.6673 | Soluble |
| 96 | P | l | -1.3826 | Soluble |
| 97 | E | l | -1.9336 | Soluble |
| 98 | D | l | 0.0000 | Buried |
| 99 | F | l | -0.5029 | Soluble |
| 100 | A | l | 0.0000 | Buried |
| 101 | V | l | -0.2268 | 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 | Y | l | 0.0000 | Buried |
| 108 | G | l | -0.3156 | Soluble |
| 109 | S | l | -0.6153 | Soluble |
| 114 | S | l | -0.4543 | Soluble |
| 115 | P | l | -0.5186 | Soluble |
| 116 | W | l | -0.1419 | Soluble |
| 117 | T | l | -0.2361 | Soluble |
| 118 | F | l | -0.0587 | Soluble |
| 119 | G | l | 0.0000 | Buried |
| 120 | Q | l | -1.6875 | Soluble |
| 121 | G | l | -1.1923 | Soluble |
| 122 | T | l | 0.0000 | Buried |
| 123 | K | l | -1.0058 | Soluble |
| 124 | V | l | 0.0000 | Buried |
| 125 | E | l | 0.0000 | Buried |
| 126 | I | l | -0.4900 | Soluble |
| 127 | K | l | -1.2693 | Soluble |
| 128 | R | l | -0.7970 | Soluble |
| 129 | T | l | 0.2134 | Aggregation-prone |
| 130 | V | l | 1.0874 | Aggregation-prone |
| 131 | A | l | 0.4722 | Aggregation-prone |
| 132 | A | l | 0.0748 | Aggregation-prone |
| 133 | P | l | 0.0000 | Buried |
| 134 | S | l | -0.1235 | Soluble |
| 135 | V | l | 0.0000 | Buried |
| 136 | F | l | -0.0085 | Soluble |
| 137 | I | l | 0.0000 | Buried |
| 138 | F | l | 0.0000 | Buried |
| 139 | P | l | -0.5267 | Soluble |
| 140 | P | l | 0.0000 | Buried |
| 141 | S | l | -1.7080 | Soluble |
| 142 | D | l | -3.0809 | Soluble |
| 143 | E | l | -3.2725 | Soluble |
| 144 | Q | l | 0.0000 | Buried |
| 145 | L | l | -2.3969 | Soluble |
| 146 | K | l | -2.8962 | Soluble |
| 147 | S | l | -1.8582 | Soluble |
| 148 | G | l | -1.1347 | Soluble |
| 149 | T | l | -0.8563 | 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 | -0.7060 | Soluble |
| 159 | F | l | 0.0000 | Buried |
| 160 | Y | l | 0.0000 | Buried |
| 161 | P | l | -1.0002 | Soluble |
| 162 | R | l | -1.6767 | Soluble |
| 163 | E | l | -2.5937 | Soluble |
| 164 | A | l | -2.0484 | Soluble |
| 165 | K | l | -2.2062 | Soluble |
| 166 | V | l | -1.1292 | Soluble |
| 167 | Q | l | -0.4549 | Soluble |
| 168 | W | l | 0.0000 | Buried |
| 169 | K | l | -0.5636 | Soluble |
| 170 | V | l | -0.8737 | Soluble |
| 171 | D | l | -1.8626 | Soluble |
| 173 | A | l | -0.0161 | Soluble |
| 174 | L | l | 0.8522 | Aggregation-prone |
| 175 | Q | l | -0.1252 | Soluble |
| 176 | S | l | -0.4936 | Soluble |
| 177 | G | l | -0.8475 | Soluble |
| 178 | N | l | -0.6728 | Soluble |
| 179 | S | l | -0.8313 | Soluble |
| 180 | Q | l | -0.9336 | Soluble |
| 181 | E | l | -1.4661 | Soluble |
| 182 | S | l | -0.6874 | Soluble |
| 183 | V | l | -0.5555 | Soluble |
| 184 | T | l | -0.9278 | Soluble |
| 185 | E | l | -2.0814 | Soluble |
| 186 | Q | l | -1.6565 | Soluble |
| 187 | D | l | -1.8328 | Soluble |
| 188 | S | l | -1.7064 | Soluble |
| 189 | K | l | -2.1967 | Soluble |
| 190 | D | l | -1.6652 | Soluble |
| 191 | S | l | -1.6162 | Soluble |
| 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 | -0.5291 | Soluble |
| 199 | L | l | 0.0000 | Buried |
| 200 | T | l | -0.2104 | Soluble |
| 201 | L | l | -0.3925 | Soluble |
| 202 | S | l | -1.1260 | Soluble |
| 203 | K | l | -1.8086 | Soluble |
| 204 | A | l | -2.0030 | Soluble |
| 205 | D | l | -2.4940 | Soluble |
| 206 | Y | l | -2.4568 | Soluble |
| 207 | E | l | -3.7046 | Soluble |
| 208 | K | l | -3.5078 | Soluble |
| 209 | H | l | -3.2407 | Soluble |
| 210 | K | l | -3.2042 | Soluble |
| 211 | V | l | -1.6450 | Soluble |
| 212 | Y | l | 0.0000 | Buried |
| 213 | A | l | 0.0000 | Buried |
| 214 | C | l | 0.0000 | Buried |
| 215 | E | l | -0.9086 | Soluble |
| 216 | V | l | 0.0000 | Buried |
| 217 | T | l | -1.0950 | Soluble |
| 218 | H | l | 0.0000 | Buried |
| 219 | Q | l | -1.5408 | Soluble |
| 220 | G | l | -0.3293 | Soluble |
| 221 | L | l | -0.2063 | Soluble |
| 222 | S | l | -0.4948 | Soluble |
| 223 | S | l | -0.3703 | Soluble |
| 224 | P | l | -0.4698 | Soluble |
| 225 | V | l | 0.0799 | Aggregation-prone |
| 226 | T | l | -0.4846 | Soluble |
| 227 | K | l | -0.5824 | Soluble |
| 228 | S | l | -0.1867 | Soluble |
| 229 | F | l | -0.2043 | Soluble |
| 230 | N | l | -1.8760 | Soluble |
| 231 | R | l | -2.7499 | 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 | -0.6785 | 3.5232 | CSV PDB |
| 4.5 | -0.7246 | 3.5167 | CSV PDB |
| 5.0 | -0.7786 | 3.5101 | CSV PDB |
| 5.5 | -0.8314 | 3.5034 | CSV PDB |
| 6.0 | -0.873 | 3.4968 | CSV PDB |
| 6.5 | -0.8944 | 3.4902 | CSV PDB |
| 7.0 | -0.8941 | 3.4838 | CSV PDB |
| 7.5 | -0.8786 | 3.4781 | CSV PDB |
| 8.0 | -0.8541 | 3.4738 | CSV PDB |
| 8.5 | -0.8227 | 3.4712 | CSV PDB |
| 9.0 | -0.7848 | 3.4699 | CSV PDB |