Calculation Parameters
| Chain Sequence(s) |
EVQLVESGGGLVQPGGSLRLSCAASGYSFTGHWMNWVRQAPGKGLEWVGMIHPSDSETRYNQKFKDRFTISVDKSKNTLYLQMNSLRAEDTAVYYCARGIYFYGTTYFDYWGQGTLVTVSSASTKGPSVFPLAPSSGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEDIQMTQSPSSLSASVGDRVTITCRASKTISKYLAWYQQKPGKAPKLLIYSGSTLQSGVPSRFSGSGSGTDFTLTISSLQPEDFATYYCQQHNEYPLTFGQGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC
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 | -2.1828 | Soluble |
| 2 | V | B | -1.3074 | Soluble |
| 3 | Q | B | -1.2528 | Soluble |
| 4 | L | B | 0.0000 | Buried |
| 5 | V | B | 1.1379 | Aggregation-prone |
| 6 | E | B | 0.0000 | Buried |
| 7 | S | B | -0.3879 | Soluble |
| 8 | G | B | -0.9136 | Soluble |
| 9 | G | B | -0.7725 | Soluble |
| 11 | G | B | -0.4806 | Soluble |
| 12 | L | B | -0.2341 | Soluble |
| 13 | V | B | 0.0000 | Buried |
| 14 | Q | B | -1.6807 | Soluble |
| 15 | P | B | -1.9346 | Soluble |
| 16 | G | B | -1.6806 | Soluble |
| 17 | G | B | -1.3948 | Soluble |
| 18 | S | B | -1.5397 | Soluble |
| 19 | L | B | -1.5245 | Soluble |
| 20 | R | B | -2.4268 | Soluble |
| 21 | L | B | 0.0000 | Buried |
| 22 | S | B | -0.3893 | Soluble |
| 23 | C | B | 0.0000 | Buried |
| 24 | A | B | -0.2946 | Soluble |
| 25 | A | B | 0.0000 | Buried |
| 26 | S | B | -1.0762 | Soluble |
| 27 | G | B | -1.4522 | Soluble |
| 28 | Y | B | -0.7109 | Soluble |
| 29 | S | B | -0.3823 | Soluble |
| 30 | F | B | 0.0000 | Buried |
| 35 | T | B | -0.9309 | Soluble |
| 36 | G | B | -0.3838 | Soluble |
| 37 | H | B | -0.1509 | Soluble |
| 38 | W | B | -0.1749 | Soluble |
| 39 | M | B | 0.0000 | Buried |
| 40 | N | B | 0.0000 | Buried |
| 41 | W | B | 0.0000 | Buried |
| 42 | V | B | 0.0000 | Buried |
| 43 | R | B | -0.5134 | Soluble |
| 44 | Q | B | -0.8094 | Soluble |
| 45 | A | B | -1.1434 | Soluble |
| 46 | P | B | -0.9308 | Soluble |
| 47 | G | B | -1.4354 | Soluble |
| 48 | K | B | -2.3597 | Soluble |
| 49 | G | B | -1.5757 | Soluble |
| 50 | L | B | 0.0000 | Buried |
| 51 | E | B | -0.8301 | Soluble |
| 52 | W | B | 0.0000 | Buried |
| 53 | V | B | 0.0000 | Buried |
| 54 | G | B | 0.0000 | Buried |
| 55 | M | B | 0.0000 | Buried |
| 56 | I | B | 0.0000 | Buried |
| 57 | H | B | -1.4718 | Soluble |
| 58 | P | B | 0.0000 | Buried |
| 59 | S | B | -1.7965 | Soluble |
| 62 | D | B | -2.7072 | Soluble |
| 63 | S | B | -2.3959 | Soluble |
| 64 | E | B | -2.8210 | Soluble |
| 65 | T | B | -1.8009 | Soluble |
| 66 | R | B | -1.8880 | Soluble |
| 67 | Y | B | -1.6460 | Soluble |
| 68 | N | B | 0.0000 | Buried |
| 69 | Q | B | -2.9640 | Soluble |
| 70 | K | B | -3.0762 | Soluble |
| 71 | F | B | 0.0000 | Buried |
| 72 | K | B | -3.6401 | Soluble |
| 74 | D | B | -3.3716 | Soluble |
| 75 | R | B | -2.4030 | Soluble |
| 76 | F | B | 0.0000 | Buried |
| 77 | T | B | -1.4143 | Soluble |
| 78 | I | B | 0.0000 | Buried |
| 79 | S | B | -0.6937 | Soluble |
| 80 | V | B | -1.1472 | Soluble |
| 81 | D | B | -2.0191 | Soluble |
| 82 | K | B | -2.9629 | Soluble |
| 83 | S | B | -2.1403 | Soluble |
| 84 | K | B | -2.6955 | Soluble |
| 85 | N | B | -2.1221 | Soluble |
| 86 | T | B | 0.0000 | Buried |
| 87 | L | B | 0.0000 | Buried |
| 88 | Y | B | 0.0000 | Buried |
| 89 | L | B | 0.0000 | Buried |
| 90 | Q | B | -1.8767 | Soluble |
| 91 | M | B | 0.0000 | Buried |
| 92 | N | B | -2.3687 | Soluble |
| 93 | S | B | -1.7476 | Soluble |
| 94 | L | B | 0.0000 | Buried |
| 95 | R | B | -2.6036 | Soluble |
| 96 | A | B | -1.8140 | Soluble |
| 97 | E | B | -2.2789 | Soluble |
| 98 | D | B | 0.0000 | Buried |
| 99 | T | B | -0.8192 | Soluble |
| 100 | A | B | 0.0000 | Buried |
| 101 | V | B | 0.0923 | 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 | G | B | 0.0000 | Buried |
| 108 | I | B | 0.0000 | Buried |
| 109 | Y | B | 1.6812 | Aggregation-prone |
| 110 | F | B | 2.5178 | Aggregation-prone |
| 111 | Y | B | 1.5557 | Aggregation-prone |
| 112A | G | B | 0.1911 | Aggregation-prone |
| 112 | T | B | 0.0000 | Buried |
| 113 | T | B | 0.0000 | Buried |
| 114 | Y | B | 0.0000 | Buried |
| 115 | F | B | 0.0000 | Buried |
| 116 | D | B | -0.1213 | Soluble |
| 117 | Y | B | 0.1688 | Aggregation-prone |
| 118 | W | B | -0.2083 | Soluble |
| 119 | G | B | 0.0000 | Buried |
| 120 | Q | B | -1.3529 | Soluble |
| 121 | G | B | -0.6642 | Soluble |
| 122 | T | B | -0.1135 | Soluble |
| 123 | L | B | 0.0282 | Aggregation-prone |
| 124 | V | B | 0.0000 | Buried |
| 125 | T | B | -0.5880 | Soluble |
| 126 | V | B | 0.0000 | Buried |
| 127 | S | B | -1.0341 | Soluble |
| 128 | S | B | -0.8563 | Soluble |
| 129 | A | B | -0.5193 | Soluble |
| 130 | S | B | -0.6797 | Soluble |
| 131 | T | B | -0.8999 | Soluble |
| 132 | K | B | -1.6138 | Soluble |
| 133 | G | B | -1.6305 | Soluble |
| 134 | P | B | 0.0000 | Buried |
| 135 | S | B | -0.3442 | Soluble |
| 136 | V | B | 0.0000 | Buried |
| 137 | F | B | -0.7249 | Soluble |
| 138 | P | B | -1.1496 | Soluble |
| 139 | L | B | 0.0000 | Buried |
| 140 | A | B | -0.6195 | Soluble |
| 141 | P | B | -0.4456 | Soluble |
| 142 | S | B | -0.3699 | Soluble |
| 143 | S | B | -0.3047 | Soluble |
| 144 | G | B | -0.6454 | Soluble |
| 145 | T | B | -0.5054 | 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 | -0.7980 | Soluble |
| 155 | Y | B | 0.0000 | Buried |
| 156 | F | B | 0.0000 | Buried |
| 157 | P | B | 0.0000 | Buried |
| 158 | E | B | -0.6864 | Soluble |
| 159 | P | B | -0.6574 | Soluble |
| 160 | V | B | -0.6862 | Soluble |
| 161 | T | B | -0.5742 | Soluble |
| 162 | V | B | -0.1605 | Soluble |
| 163 | S | B | -0.3684 | Soluble |
| 164 | W | B | 0.0000 | Buried |
| 165 | N | B | -0.7875 | Soluble |
| 166 | S | B | -0.6385 | Soluble |
| 167 | G | B | -0.5686 | Soluble |
| 168 | A | B | -0.2483 | Soluble |
| 169 | L | B | 0.0120 | Aggregation-prone |
| 170 | T | B | -0.1221 | Soluble |
| 171 | S | B | -0.1048 | Soluble |
| 172 | G | B | -0.0425 | Soluble |
| 173 | V | B | 0.2560 | Aggregation-prone |
| 174 | H | B | -0.2121 | Soluble |
| 175 | T | B | -0.0971 | Soluble |
| 176 | F | B | 0.0000 | Buried |
| 177 | P | B | -0.2800 | Soluble |
| 178 | A | B | 0.1061 | Aggregation-prone |
| 179 | V | B | 0.3104 | Aggregation-prone |
| 180 | L | B | 0.9749 | Aggregation-prone |
| 181 | Q | B | 0.1061 | Aggregation-prone |
| 182 | S | B | -0.1671 | Soluble |
| 183 | S | B | -0.2759 | Soluble |
| 184 | G | B | -0.0401 | Soluble |
| 185 | L | B | -0.0575 | Soluble |
| 186 | Y | B | 0.2658 | 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 | -0.0965 | Soluble |
| 194 | V | B | 0.0000 | Buried |
| 195 | P | B | -0.4952 | Soluble |
| 196 | S | B | -0.5914 | Soluble |
| 197 | S | B | -0.6231 | Soluble |
| 198 | S | B | -0.6339 | Soluble |
| 199 | L | B | -0.6738 | Soluble |
| 200 | G | B | -0.6819 | Soluble |
| 201 | T | B | -0.7640 | Soluble |
| 202 | Q | B | -1.1857 | Soluble |
| 203 | T | B | -1.1380 | Soluble |
| 204 | Y | B | 0.0000 | Buried |
| 205 | I | B | -1.2991 | Soluble |
| 206 | C | B | 0.0000 | Buried |
| 207 | N | B | -1.3470 | Soluble |
| 208 | V | B | 0.0000 | Buried |
| 209 | N | B | -1.8821 | Soluble |
| 210 | H | B | 0.0000 | Buried |
| 211 | K | B | -2.7806 | Soluble |
| 212 | P | B | -1.6462 | Soluble |
| 213 | S | B | -1.9125 | Soluble |
| 214 | N | B | -2.6530 | Soluble |
| 215 | T | B | -2.1146 | Soluble |
| 216 | K | B | -2.6352 | Soluble |
| 217 | V | B | -1.6506 | Soluble |
| 218 | D | B | -2.2470 | Soluble |
| 219 | K | B | -1.9768 | Soluble |
| 220 | K | B | -2.5023 | Soluble |
| 221 | V | B | 0.0000 | Buried |
| 222 | E | B | -2.2013 | Soluble |
| 1 | D | A | -2.4174 | Soluble |
| 2 | I | A | 0.0000 | Buried |
| 3 | Q | A | -2.3193 | Soluble |
| 4 | M | A | 0.0000 | Buried |
| 5 | T | A | -1.2824 | Soluble |
| 6 | Q | A | 0.0000 | Buried |
| 7 | S | A | -0.7178 | Soluble |
| 8 | P | A | -0.4369 | Soluble |
| 9 | S | A | -0.7564 | Soluble |
| 10 | S | A | -0.6606 | Soluble |
| 11 | L | A | -0.4532 | Soluble |
| 12 | S | A | -0.6763 | Soluble |
| 13 | A | A | -0.9618 | Soluble |
| 14 | S | A | -0.9123 | Soluble |
| 15 | V | A | -0.2522 | Soluble |
| 16 | G | A | -0.6994 | Soluble |
| 17 | D | A | -1.8438 | Soluble |
| 18 | R | A | -2.3454 | Soluble |
| 19 | V | A | 0.0000 | Buried |
| 20 | T | A | -0.6632 | Soluble |
| 21 | I | A | 0.0000 | Buried |
| 22 | T | A | -0.7638 | Soluble |
| 23 | C | A | 0.0000 | Buried |
| 24 | R | A | -2.3942 | Soluble |
| 25 | A | A | -2.0158 | Soluble |
| 26 | S | A | -2.1432 | Soluble |
| 27 | K | A | -2.6072 | Soluble |
| 28 | T | A | -1.6213 | Soluble |
| 29 | I | A | 0.0000 | Buried |
| 36 | S | A | -1.2942 | Soluble |
| 37 | K | A | -1.9825 | Soluble |
| 38 | Y | A | -0.7647 | 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 | 0.0000 | Buried |
| 44 | Q | A | 0.0000 | Buried |
| 45 | K | A | -1.8588 | Soluble |
| 46 | P | A | -1.4768 | Soluble |
| 47 | G | A | -1.8026 | Soluble |
| 48 | K | A | -2.5786 | Soluble |
| 49 | A | A | -1.5410 | Soluble |
| 50 | P | A | 0.0000 | Buried |
| 51 | K | A | -1.3558 | Soluble |
| 52 | L | A | 0.0000 | Buried |
| 53 | L | A | 0.0000 | Buried |
| 54 | I | A | 0.0000 | Buried |
| 55 | Y | A | 0.0787 | Aggregation-prone |
| 56 | S | A | -0.3693 | Soluble |
| 57 | G | A | 0.0000 | Buried |
| 65 | S | A | -0.5136 | Soluble |
| 66 | T | A | 0.0436 | Aggregation-prone |
| 67 | L | A | 0.2113 | Aggregation-prone |
| 68 | Q | A | -0.3002 | Soluble |
| 69 | S | A | -0.3866 | Soluble |
| 70 | G | A | -0.5028 | Soluble |
| 71 | V | A | -0.3399 | Soluble |
| 72 | P | A | -0.3607 | Soluble |
| 74 | S | A | -0.4667 | Soluble |
| 75 | R | A | -0.8553 | Soluble |
| 76 | F | A | 0.0000 | Buried |
| 77 | S | A | -0.4021 | Soluble |
| 78 | G | A | -0.2970 | Soluble |
| 79 | S | A | -0.9687 | Soluble |
| 80 | G | A | -1.4344 | Soluble |
| 83 | S | A | -1.6169 | Soluble |
| 84 | G | A | -1.5789 | Soluble |
| 85 | T | A | -2.0040 | Soluble |
| 86 | D | A | -2.5376 | Soluble |
| 87 | F | A | 0.0000 | Buried |
| 88 | T | A | -0.7582 | Soluble |
| 89 | L | A | 0.0000 | Buried |
| 90 | T | A | -0.6711 | Soluble |
| 91 | I | A | 0.0000 | Buried |
| 92 | S | A | -1.3766 | Soluble |
| 93 | S | A | -1.1673 | Soluble |
| 94 | L | A | 0.0000 | Buried |
| 95 | Q | A | -1.1154 | Soluble |
| 96 | P | A | -1.8908 | Soluble |
| 97 | E | A | -2.4484 | Soluble |
| 98 | D | A | 0.0000 | Buried |
| 99 | F | A | 0.0000 | Buried |
| 100 | A | A | 0.0000 | Buried |
| 101 | T | A | -0.7186 | 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 | H | A | 0.0000 | Buried |
| 108 | N | A | -0.9259 | Soluble |
| 109 | E | A | -1.1804 | Soluble |
| 114 | Y | A | -0.7499 | Soluble |
| 115 | P | A | -1.0154 | Soluble |
| 116 | L | A | 0.0000 | Buried |
| 117 | T | A | -0.8235 | Soluble |
| 118 | F | A | -0.4258 | Soluble |
| 119 | G | A | 0.0000 | Buried |
| 120 | Q | A | -1.6422 | Soluble |
| 121 | G | A | 0.0000 | Buried |
| 122 | T | A | 0.0000 | Buried |
| 123 | K | A | -1.0931 | Soluble |
| 124 | V | A | 0.0000 | Buried |
| 125 | E | A | -1.1116 | Soluble |
| 126 | I | A | 0.0000 | Buried |
| 127 | K | A | -1.1953 | Soluble |
| 128 | R | A | -0.8275 | Soluble |
| 129 | T | A | -0.0580 | Soluble |
| 130 | V | A | 0.3639 | Aggregation-prone |
| 131 | A | A | 0.1395 | Aggregation-prone |
| 132 | A | A | -0.0994 | Soluble |
| 133 | P | A | 0.0000 | Buried |
| 134 | S | A | -0.0736 | Soluble |
| 135 | V | A | 0.0000 | Buried |
| 136 | F | A | 0.1937 | Aggregation-prone |
| 137 | I | A | 0.1210 | Aggregation-prone |
| 138 | F | A | 0.0000 | Buried |
| 139 | P | A | -0.3260 | Soluble |
| 140 | P | A | -0.7915 | Soluble |
| 141 | S | A | -1.6810 | Soluble |
| 142 | D | A | -3.0585 | Soluble |
| 143 | E | A | -3.1720 | Soluble |
| 144 | Q | A | 0.0000 | Buried |
| 145 | L | A | -2.2435 | Soluble |
| 146 | K | A | -2.8905 | Soluble |
| 147 | S | A | -1.7372 | Soluble |
| 148 | G | A | -1.2039 | Soluble |
| 149 | T | A | -0.9271 | 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 | -0.9325 | Soluble |
| 159 | F | A | 0.0000 | Buried |
| 160 | Y | A | 0.0000 | Buried |
| 161 | P | A | -1.7052 | Soluble |
| 162 | R | A | -2.9170 | Soluble |
| 163 | E | A | -3.1742 | Soluble |
| 164 | A | A | -2.3062 | Soluble |
| 165 | K | A | -2.3284 | Soluble |
| 166 | V | A | -1.1998 | Soluble |
| 167 | Q | A | -0.6542 | Soluble |
| 168 | W | A | 0.0000 | Buried |
| 169 | K | A | -0.6901 | Soluble |
| 170 | V | A | 0.0000 | Buried |
| 171 | D | A | -1.6583 | Soluble |
| 172 | N | A | -1.4224 | Soluble |
| 173 | A | A | -0.4154 | Soluble |
| 174 | L | A | 0.4493 | Aggregation-prone |
| 175 | Q | A | -0.3327 | Soluble |
| 176 | S | A | -0.5318 | Soluble |
| 177 | G | A | -0.9327 | Soluble |
| 178 | N | A | -0.9531 | Soluble |
| 179 | S | A | -1.1419 | Soluble |
| 180 | Q | A | -1.3472 | Soluble |
| 181 | E | A | -1.8899 | Soluble |
| 182 | S | A | -0.9236 | Soluble |
| 183 | V | A | -0.8337 | Soluble |
| 184 | T | A | -0.8820 | Soluble |
| 185 | E | A | -1.8077 | Soluble |
| 186 | Q | A | 0.0000 | Buried |
| 187 | D | A | -2.0581 | Soluble |
| 188 | S | A | -2.4270 | Soluble |
| 189 | K | A | -2.8632 | Soluble |
| 190 | D | A | -2.3428 | 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 | -0.6401 | Soluble |
| 199 | L | A | 0.0000 | Buried |
| 200 | T | A | -0.5128 | Soluble |
| 201 | L | A | -0.8296 | Soluble |
| 202 | S | A | -1.2449 | Soluble |
| 203 | K | A | -2.2856 | Soluble |
| 204 | A | A | -2.0514 | Soluble |
| 205 | D | A | -2.8600 | Soluble |
| 206 | Y | A | 0.0000 | Buried |
| 207 | E | A | -3.3881 | Soluble |
| 208 | K | A | -3.3978 | Soluble |
| 209 | H | A | -2.7016 | Soluble |
| 210 | K | A | -2.5438 | Soluble |
| 211 | V | A | -1.4741 | Soluble |
| 212 | Y | A | 0.0000 | Buried |
| 213 | A | A | 0.0000 | Buried |
| 214 | C | A | 0.0000 | Buried |
| 215 | E | A | -0.9223 | Soluble |
| 216 | V | A | 0.0000 | Buried |
| 217 | T | A | -1.2355 | Soluble |
| 218 | H | A | 0.0000 | Buried |
| 219 | Q | A | -1.5540 | Soluble |
| 220 | G | A | -0.3979 | Soluble |
| 221 | L | A | -0.1859 | Soluble |
| 222 | S | A | -0.4279 | Soluble |
| 223 | S | A | -0.4041 | Soluble |
| 224 | P | A | -0.5399 | Soluble |
| 225 | V | A | 0.0075 | Aggregation-prone |
| 226 | T | A | -0.4359 | Soluble |
| 227 | K | A | -0.6729 | Soluble |
| 228 | S | A | -0.4566 | Soluble |
| 229 | F | A | 0.0000 | Buried |
| 230 | N | A | -1.4910 | Soluble |
| 231 | R | A | -2.1015 | Soluble |
| 232 | G | A | -1.7835 | Soluble |
| 233 | E | A | -2.0755 | Soluble |
| 234 | C | A | -0.7570 | 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 | -0.8403 | 4.8879 | CSV PDB |
| 4.5 | -0.8858 | 4.8879 | CSV PDB |
| 5.0 | -0.9399 | 4.8879 | CSV PDB |
| 5.5 | -0.9915 | 4.8879 | CSV PDB |
| 6.0 | -1.028 | 4.8879 | CSV PDB |
| 6.5 | -1.0388 | 4.8879 | CSV PDB |
| 7.0 | -1.0229 | 4.8879 | CSV PDB |
| 7.5 | -0.9892 | 4.8879 | CSV PDB |
| 8.0 | -0.9458 | 4.8878 | CSV PDB |
| 8.5 | -0.8957 | 4.8873 | CSV PDB |
| 9.0 | -0.8386 | 4.886 | CSV PDB |