Calculation Parameters
| Chain Sequence(s) |
EVQLVQSGAEVKKPGESLKVSCKASGYTFTSYYMHWVRQAPGQGLEWMGAIEPMYGSTSYAQKFQGRVTMTRDTSTSTVYMELSSLRSEDTAVYYCARGSAYYYDFADYWGQGTLVTVSSASTKGPSVFPLAPSSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPSYVLTQPSSVSVAPGQTATISCGGHNIGSKNVHWYQQRPGQSPVLVIYQDNKRPSGIPERFSGSNSGNTATLTISGTQAMDEADYYCQVWDNYSVLFGGGTKLTVLRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRG
input.pdb
|
| Selected Chain(s) | A (Heavy), B (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 |
|---|---|---|---|---|
| 2 | V | A | 0.5133 | Aggregation-prone |
| 3 | Q | A | -0.8343 | Soluble |
| 4 | L | A | 0.0000 | Buried |
| 5 | V | A | -0.5766 | Soluble |
| 6 | Q | A | 0.0000 | Buried |
| 7 | S | A | -0.7991 | Soluble |
| 8 | G | A | -0.5966 | Soluble |
| 9 | A | A | -0.3893 | Soluble |
| 11 | E | A | -0.8439 | Soluble |
| 12 | V | A | -0.0902 | Soluble |
| 13 | K | A | -1.3740 | Soluble |
| 14 | K | A | -2.0870 | Soluble |
| 15 | P | A | -2.4237 | Soluble |
| 16 | G | A | -2.1286 | Soluble |
| 17 | E | A | -2.4899 | Soluble |
| 18 | S | A | -2.0331 | Soluble |
| 19 | L | A | 0.0000 | Buried |
| 20 | K | A | -2.1186 | Soluble |
| 21 | V | A | 0.0000 | Buried |
| 22 | S | A | -0.7684 | Soluble |
| 23 | C | A | 0.0000 | Buried |
| 24 | K | A | -1.5789 | Soluble |
| 25 | A | A | 0.0000 | Buried |
| 26 | S | A | -0.6435 | Soluble |
| 27 | G | A | -0.2383 | Soluble |
| 28 | Y | A | 0.0689 | Aggregation-prone |
| 29 | T | A | 0.0413 | Aggregation-prone |
| 30 | F | A | 0.0000 | Buried |
| 35 | T | A | 0.6382 | Aggregation-prone |
| 36 | S | A | 0.7386 | Aggregation-prone |
| 37 | Y | A | 1.0602 | Aggregation-prone |
| 38 | Y | A | 0.7820 | Aggregation-prone |
| 39 | M | A | 0.0000 | Buried |
| 40 | H | A | 0.0000 | Buried |
| 41 | W | A | 0.0000 | Buried |
| 42 | V | A | 0.0000 | Buried |
| 43 | R | A | 0.0000 | Buried |
| 44 | Q | A | -0.6637 | Soluble |
| 45 | A | A | -0.9912 | Soluble |
| 46 | P | A | -0.8695 | Soluble |
| 47 | G | A | -1.3045 | Soluble |
| 48 | Q | A | -1.7608 | Soluble |
| 49 | G | A | -1.1866 | Soluble |
| 50 | L | A | 0.0000 | Buried |
| 51 | E | A | -0.8030 | Soluble |
| 52 | W | A | 0.0000 | Buried |
| 53 | M | A | 0.0000 | Buried |
| 54 | G | A | 0.0000 | Buried |
| 55 | A | A | 0.0000 | Buried |
| 56 | I | A | 0.0000 | Buried |
| 57 | E | A | 0.0000 | Buried |
| 58 | P | A | 0.0000 | Buried |
| 59 | M | A | 1.4324 | Aggregation-prone |
| 62 | Y | A | 1.6011 | Aggregation-prone |
| 63 | G | A | 0.5200 | Aggregation-prone |
| 64 | S | A | 0.3067 | Aggregation-prone |
| 65 | T | A | 0.0560 | Aggregation-prone |
| 66 | S | A | -0.0353 | Soluble |
| 67 | Y | A | -0.6420 | Soluble |
| 68 | A | A | -1.2540 | Soluble |
| 69 | Q | A | -2.5044 | Soluble |
| 70 | K | A | -2.6961 | Soluble |
| 71 | F | A | 0.0000 | Buried |
| 72 | Q | A | -2.3706 | Soluble |
| 74 | G | A | -1.6148 | Soluble |
| 75 | R | A | -1.4981 | Soluble |
| 76 | V | A | 0.0000 | Buried |
| 77 | T | A | -0.8051 | Soluble |
| 78 | M | A | 0.0000 | Buried |
| 79 | T | A | -0.4765 | Soluble |
| 80 | R | A | -0.7218 | Soluble |
| 81 | D | A | -0.9781 | Soluble |
| 82 | T | A | -0.4475 | Soluble |
| 83 | S | A | -0.5328 | Soluble |
| 84 | T | A | -0.7501 | Soluble |
| 85 | S | A | -0.8878 | Soluble |
| 86 | T | A | -0.9741 | Soluble |
| 87 | V | A | 0.0000 | Buried |
| 88 | Y | A | -0.6449 | Soluble |
| 89 | M | A | 0.0000 | Buried |
| 90 | E | A | -1.5191 | Soluble |
| 91 | L | A | 0.0000 | Buried |
| 92 | S | A | -1.4906 | Soluble |
| 93 | S | A | -1.5310 | Soluble |
| 94 | L | A | 0.0000 | Buried |
| 95 | R | A | -2.9437 | Soluble |
| 96 | S | A | -2.1798 | Soluble |
| 97 | E | A | -2.4532 | Soluble |
| 98 | D | A | 0.0000 | Buried |
| 99 | T | A | -0.7981 | Soluble |
| 100 | A | A | 0.0000 | Buried |
| 101 | V | A | 0.2110 | Aggregation-prone |
| 102 | Y | A | 0.0000 | Buried |
| 103 | Y | A | 0.0000 | Buried |
| 104 | C | A | 0.0000 | Buried |
| 105 | A | A | 0.0000 | Buried |
| 106 | R | A | 0.0000 | Buried |
| 107 | G | A | 0.0000 | Buried |
| 108 | S | A | 0.5408 | Aggregation-prone |
| 109 | A | A | 0.7689 | Aggregation-prone |
| 110 | Y | A | 1.5936 | Aggregation-prone |
| 111 | Y | A | 1.0532 | Aggregation-prone |
| 112 | Y | A | 0.0000 | Buried |
| 113 | D | A | -0.0651 | Soluble |
| 114 | F | A | 0.0000 | Buried |
| 115 | A | A | 0.0000 | Buried |
| 116 | D | A | 0.2794 | Aggregation-prone |
| 117 | Y | A | 0.6253 | Aggregation-prone |
| 118 | W | A | 0.2463 | Aggregation-prone |
| 119 | G | A | 0.0000 | Buried |
| 120 | Q | A | -1.3738 | Soluble |
| 121 | G | A | -0.6887 | Soluble |
| 122 | T | A | 0.0000 | Buried |
| 123 | L | A | -0.0587 | Soluble |
| 124 | V | A | 0.0000 | Buried |
| 125 | T | A | 0.0000 | Buried |
| 126 | V | A | 0.0000 | Buried |
| 127 | S | A | -1.1187 | Soluble |
| 128 | S | A | -0.8198 | Soluble |
| 129 | A | A | -0.4924 | Soluble |
| 130 | S | A | -0.5863 | Soluble |
| 131 | T | A | -0.5710 | Soluble |
| 132 | K | A | -1.3159 | Soluble |
| 133 | G | A | -1.4805 | Soluble |
| 134 | P | A | 0.0000 | Buried |
| 135 | S | A | -0.2915 | Soluble |
| 136 | V | A | 0.0000 | Buried |
| 137 | F | A | 0.0000 | Buried |
| 138 | P | A | -1.0932 | Soluble |
| 139 | L | A | 0.0000 | Buried |
| 140 | A | A | -0.8541 | Soluble |
| 141 | P | A | 0.0000 | Buried |
| 142 | S | A | -0.5156 | Soluble |
| 143 | S | A | -0.3818 | Soluble |
| 144 | G | A | -0.7891 | Soluble |
| 145 | G | A | -0.8962 | Soluble |
| 146 | T | A | -0.6443 | Soluble |
| 147 | A | A | -0.3844 | Soluble |
| 148 | A | A | 0.0000 | Buried |
| 149 | L | A | 0.0000 | Buried |
| 150 | G | A | 0.0000 | Buried |
| 151 | C | A | 0.0000 | Buried |
| 152 | L | A | 0.0000 | Buried |
| 153 | V | A | 0.0000 | Buried |
| 154 | K | A | 0.0000 | Buried |
| 155 | D | A | -0.3757 | Soluble |
| 156 | Y | A | 0.0000 | Buried |
| 157 | F | A | 0.0000 | Buried |
| 158 | P | A | 0.0000 | Buried |
| 159 | E | A | -0.6584 | Soluble |
| 160 | P | A | -0.9120 | Soluble |
| 161 | V | A | 0.0000 | Buried |
| 162 | T | A | -0.7565 | Soluble |
| 163 | V | A | -0.5248 | Soluble |
| 164 | S | A | -0.4651 | Soluble |
| 165 | W | A | 0.0000 | Buried |
| 166 | N | A | -0.7147 | Soluble |
| 167 | S | A | -0.6724 | Soluble |
| 168 | G | A | -0.5360 | Soluble |
| 169 | A | A | -0.2747 | Soluble |
| 170 | L | A | 0.0107 | Aggregation-prone |
| 171 | T | A | -0.1813 | Soluble |
| 172 | S | A | -0.1893 | Soluble |
| 173 | G | A | -0.2883 | Soluble |
| 174 | V | A | 0.1671 | Aggregation-prone |
| 175 | H | A | -0.3495 | Soluble |
| 176 | T | A | -0.0126 | Soluble |
| 177 | F | A | 0.0000 | Buried |
| 178 | P | A | -0.3449 | Soluble |
| 179 | A | A | 0.1557 | Aggregation-prone |
| 180 | V | A | 0.4096 | Aggregation-prone |
| 181 | L | A | 1.2954 | Aggregation-prone |
| 182 | Q | A | 0.2506 | Aggregation-prone |
| 183 | S | A | -0.0376 | Soluble |
| 184 | S | A | -0.1860 | Soluble |
| 185 | G | A | 0.0711 | Aggregation-prone |
| 186 | L | A | 0.0771 | Aggregation-prone |
| 187 | Y | A | 0.0000 | Buried |
| 188 | S | A | 0.2004 | Aggregation-prone |
| 189 | L | A | 0.0000 | Buried |
| 190 | S | A | 0.0000 | Buried |
| 191 | S | A | 0.0000 | Buried |
| 192 | V | A | 0.0000 | Buried |
| 193 | V | A | 0.0000 | Buried |
| 194 | T | A | -0.1355 | Soluble |
| 195 | V | A | 0.0000 | Buried |
| 196 | P | A | -0.5974 | Soluble |
| 197 | S | A | -0.6664 | Soluble |
| 198 | S | A | -0.6721 | Soluble |
| 199 | S | A | -0.7487 | Soluble |
| 200 | L | A | -0.9505 | Soluble |
| 201 | G | A | -1.0776 | Soluble |
| 202 | T | A | -0.8737 | Soluble |
| 203 | Q | A | -1.4922 | Soluble |
| 204 | T | A | -1.1895 | Soluble |
| 205 | Y | A | 0.0000 | Buried |
| 206 | I | A | -0.9467 | Soluble |
| 207 | C | A | 0.0000 | Buried |
| 208 | N | A | -1.4967 | Soluble |
| 209 | V | A | 0.0000 | Buried |
| 210 | N | A | -2.3532 | Soluble |
| 211 | H | A | 0.0000 | Buried |
| 212 | K | A | -2.9259 | Soluble |
| 213 | P | A | -1.7120 | Soluble |
| 214 | S | A | -1.9654 | Soluble |
| 215 | N | A | -2.7436 | Soluble |
| 216 | T | A | -2.2416 | Soluble |
| 217 | K | A | -2.8242 | Soluble |
| 218 | V | A | -1.5850 | Soluble |
| 219 | D | A | -2.4986 | Soluble |
| 220 | K | A | -1.9013 | Soluble |
| 221 | K | A | -2.0101 | Soluble |
| 222 | V | A | 0.0000 | Buried |
| 223 | E | A | -2.3933 | Soluble |
| 224 | P | A | -1.2509 | Soluble |
| 1 | S | B | -0.0411 | Soluble |
| 2 | Y | B | 0.6589 | Aggregation-prone |
| 3 | V | B | 1.5820 | Aggregation-prone |
| 4 | L | B | 0.7681 | Aggregation-prone |
| 5 | T | B | 0.0550 | Aggregation-prone |
| 6 | Q | B | -0.4061 | Soluble |
| 7 | P | B | -0.6147 | Soluble |
| 8 | S | B | -0.7986 | Soluble |
| 9 | S | B | -0.7963 | Soluble |
| 11 | V | B | -0.3021 | Soluble |
| 12 | S | B | -0.2072 | Soluble |
| 13 | V | B | 0.0000 | Buried |
| 14 | A | B | -0.5230 | Soluble |
| 15 | P | B | -1.0181 | Soluble |
| 16 | G | B | -1.4394 | Soluble |
| 17 | Q | B | -1.6123 | Soluble |
| 18 | T | B | -0.9452 | Soluble |
| 19 | A | B | 0.0000 | Buried |
| 20 | T | B | -0.1288 | Soluble |
| 21 | I | B | 0.0000 | Buried |
| 22 | S | B | -0.2485 | Soluble |
| 23 | C | B | 0.0000 | Buried |
| 24 | G | B | -0.7303 | Soluble |
| 25 | G | B | -0.8703 | Soluble |
| 26 | H | B | -1.7449 | Soluble |
| 27 | N | B | -2.5422 | Soluble |
| 28 | I | B | 0.0000 | Buried |
| 29 | G | B | -1.9212 | Soluble |
| 36 | S | B | -1.4427 | Soluble |
| 37 | K | B | -1.3357 | Soluble |
| 38 | N | B | -1.6950 | Soluble |
| 39 | V | B | 0.0000 | Buried |
| 40 | H | B | 0.0000 | Buried |
| 41 | W | B | 0.0000 | Buried |
| 42 | Y | B | 0.0000 | Buried |
| 43 | Q | B | 0.0000 | Buried |
| 44 | Q | B | 0.0000 | Buried |
| 45 | R | B | -1.0892 | Soluble |
| 46 | P | B | -1.6190 | Soluble |
| 47 | G | B | -1.5136 | Soluble |
| 48 | Q | B | -1.8068 | Soluble |
| 49 | S | B | -0.8839 | Soluble |
| 50 | P | B | 0.0000 | Buried |
| 51 | V | B | 0.6585 | Aggregation-prone |
| 52 | L | B | 0.0000 | Buried |
| 53 | V | B | 0.0000 | Buried |
| 54 | I | B | 0.0000 | Buried |
| 55 | Y | B | -1.5582 | Soluble |
| 56 | Q | B | -2.2156 | Soluble |
| 57 | D | B | -2.2374 | Soluble |
| 65 | N | B | -2.7672 | Soluble |
| 66 | K | B | -2.8270 | Soluble |
| 67 | R | B | -2.0774 | Soluble |
| 68 | P | B | -0.9900 | Soluble |
| 69 | S | B | -0.8581 | Soluble |
| 70 | G | B | -0.7693 | Soluble |
| 71 | I | B | -0.6242 | Soluble |
| 72 | P | B | -1.2922 | Soluble |
| 74 | E | B | -2.2300 | Soluble |
| 75 | R | B | -1.3977 | Soluble |
| 76 | F | B | 0.0000 | Buried |
| 77 | S | B | -1.4148 | Soluble |
| 78 | G | B | 0.0000 | Buried |
| 79 | S | B | -1.2656 | Soluble |
| 80 | N | B | -1.4132 | Soluble |
| 83 | S | B | -1.1700 | Soluble |
| 84 | G | B | -1.8061 | Soluble |
| 85 | N | B | -2.3039 | Soluble |
| 86 | T | B | -1.3083 | Soluble |
| 87 | A | B | 0.0000 | Buried |
| 88 | T | B | -0.4767 | Soluble |
| 89 | L | B | 0.0000 | Buried |
| 90 | T | B | -0.2621 | Soluble |
| 91 | I | B | 0.0000 | Buried |
| 92 | S | B | -1.1637 | Soluble |
| 93 | G | B | -1.2927 | Soluble |
| 94 | T | B | 0.0000 | Buried |
| 95 | Q | B | -0.9175 | Soluble |
| 96 | A | B | -0.6005 | Soluble |
| 97 | M | B | 0.6094 | Aggregation-prone |
| 98 | D | B | 0.0000 | Buried |
| 99 | E | B | -0.8107 | Soluble |
| 100 | A | B | 0.0000 | Buried |
| 101 | D | B | -1.0635 | Soluble |
| 102 | Y | B | 0.0000 | Buried |
| 103 | Y | B | 0.0000 | Buried |
| 104 | C | B | 0.0000 | Buried |
| 105 | Q | B | 0.0000 | Buried |
| 106 | V | B | 0.0000 | Buried |
| 107 | W | B | -0.0017 | Soluble |
| 108 | D | B | 0.0000 | Buried |
| 109 | N | B | -0.5985 | Soluble |
| 114 | Y | B | 0.7094 | Aggregation-prone |
| 115 | S | B | 0.1536 | Aggregation-prone |
| 116 | V | B | 0.0000 | Buried |
| 117 | L | B | 0.5238 | Aggregation-prone |
| 118 | F | B | 0.3457 | Aggregation-prone |
| 119 | G | B | 0.0000 | Buried |
| 120 | G | B | -0.7504 | Soluble |
| 121 | G | B | -0.9310 | Soluble |
| 122 | T | B | 0.0000 | Buried |
| 123 | K | B | -1.6342 | Soluble |
| 124 | L | B | 0.0000 | Buried |
| 125 | T | B | -0.5630 | Soluble |
| 126 | V | B | 0.0000 | Buried |
| 127 | L | B | 0.5674 | Aggregation-prone |
| 128 | R | B | 0.0366 | Aggregation-prone |
| 129 | T | B | 0.6800 | Aggregation-prone |
| 130 | V | B | 1.2910 | Aggregation-prone |
| 131 | A | B | 0.3206 | Aggregation-prone |
| 132 | A | B | 0.0691 | Aggregation-prone |
| 133 | P | B | 0.0000 | Buried |
| 134 | S | B | -0.3157 | Soluble |
| 135 | V | B | 0.0000 | Buried |
| 136 | F | B | -0.0533 | Soluble |
| 137 | I | B | 0.0000 | Buried |
| 138 | F | B | 0.0000 | Buried |
| 139 | P | B | -0.6541 | Soluble |
| 140 | P | B | -0.9113 | Soluble |
| 141 | S | B | -1.7684 | Soluble |
| 142 | D | B | -3.1460 | Soluble |
| 143 | E | B | -3.3048 | Soluble |
| 144 | Q | B | 0.0000 | Buried |
| 145 | L | B | -2.3638 | Soluble |
| 146 | K | B | -3.0378 | Soluble |
| 147 | S | B | -1.8864 | Soluble |
| 148 | G | B | -1.5502 | Soluble |
| 149 | T | B | -0.9335 | Soluble |
| 150 | A | B | 0.0000 | Buried |
| 151 | S | B | 0.0000 | Buried |
| 152 | V | B | 0.0000 | Buried |
| 153 | V | B | 0.0000 | Buried |
| 154 | C | B | 0.0000 | Buried |
| 155 | L | B | 0.0000 | Buried |
| 156 | L | B | 0.0000 | Buried |
| 157 | N | B | 0.0000 | Buried |
| 158 | N | B | -0.9156 | Soluble |
| 159 | F | B | 0.0000 | Buried |
| 160 | Y | B | -0.5809 | Soluble |
| 161 | P | B | -1.2092 | Soluble |
| 162 | R | B | -3.0284 | Soluble |
| 163 | E | B | -3.2597 | Soluble |
| 164 | A | B | -2.3603 | Soluble |
| 165 | K | B | -2.4004 | Soluble |
| 166 | V | B | -1.1225 | Soluble |
| 167 | Q | B | -0.4839 | Soluble |
| 168 | W | B | 0.0000 | Buried |
| 169 | K | B | -0.4614 | Soluble |
| 170 | V | B | 0.0000 | Buried |
| 171 | D | B | -1.4309 | Soluble |
| 172 | N | B | -1.1597 | Soluble |
| 173 | A | B | -0.1154 | Soluble |
| 174 | L | B | 0.8822 | Aggregation-prone |
| 175 | Q | B | -0.1851 | Soluble |
| 176 | S | B | -0.7292 | Soluble |
| 177 | G | B | -1.3566 | Soluble |
| 178 | N | B | -1.7402 | Soluble |
| 179 | S | B | -1.7555 | Soluble |
| 180 | Q | B | -1.9886 | Soluble |
| 181 | E | B | -2.0600 | Soluble |
| 182 | S | B | -0.9101 | Soluble |
| 183 | V | B | -0.8571 | Soluble |
| 184 | T | B | -1.1441 | Soluble |
| 185 | E | B | -2.2740 | Soluble |
| 186 | Q | B | 0.0000 | Buried |
| 187 | D | B | -2.1505 | Soluble |
| 188 | S | B | -1.7550 | Soluble |
| 189 | K | B | -2.3758 | Soluble |
| 190 | D | B | -1.9755 | Soluble |
| 191 | S | B | -1.5286 | Soluble |
| 192 | T | B | 0.0000 | Buried |
| 193 | Y | B | 0.0000 | Buried |
| 194 | S | B | 0.0000 | Buried |
| 195 | L | B | 0.0000 | Buried |
| 196 | S | B | 0.0000 | Buried |
| 197 | S | B | 0.0000 | Buried |
| 198 | T | B | -0.9229 | Soluble |
| 199 | L | B | 0.0000 | Buried |
| 200 | T | B | -0.7543 | Soluble |
| 201 | L | B | -0.9338 | Soluble |
| 202 | S | B | -1.4421 | Soluble |
| 203 | K | B | -2.4543 | Soluble |
| 204 | A | B | -2.1579 | Soluble |
| 205 | D | B | -2.7389 | Soluble |
| 206 | Y | B | 0.0000 | Buried |
| 207 | E | B | -3.7887 | Soluble |
| 208 | K | B | -3.6731 | Soluble |
| 209 | H | B | -2.8897 | Soluble |
| 210 | K | B | -2.9232 | Soluble |
| 211 | V | B | -1.3401 | Soluble |
| 212 | Y | B | 0.0000 | Buried |
| 213 | A | B | -1.0527 | Soluble |
| 214 | C | B | 0.0000 | Buried |
| 215 | E | B | -0.8808 | Soluble |
| 216 | V | B | 0.0000 | Buried |
| 217 | T | B | -1.1613 | Soluble |
| 218 | H | B | 0.0000 | Buried |
| 219 | Q | B | -1.6246 | Soluble |
| 220 | G | B | -0.2229 | Soluble |
| 221 | L | B | -0.1663 | Soluble |
| 222 | S | B | -0.4242 | Soluble |
| 223 | S | B | -0.4126 | Soluble |
| 224 | P | B | -0.4181 | Soluble |
| 225 | V | B | -0.1031 | Soluble |
| 226 | T | B | -0.5632 | Soluble |
| 227 | K | B | -0.9164 | Soluble |
| 228 | S | B | -0.7209 | Soluble |
| 229 | F | B | -0.9544 | Soluble |
| 230 | N | B | -1.9059 | Soluble |
| 231 | R | B | -2.1665 | Soluble |
| 232 | G | B | -1.3849 | 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 | -0.6189 | 1.955 | CSV PDB |
| 4.5 | -0.6549 | 1.9452 | CSV PDB |
| 5.0 | -0.6975 | 1.9337 | CSV PDB |
| 5.5 | -0.7375 | 1.9217 | CSV PDB |
| 6.0 | -0.7646 | 1.9094 | CSV PDB |
| 6.5 | -0.7696 | 1.8971 | CSV PDB |
| 7.0 | -0.7519 | 1.8847 | CSV PDB |
| 7.5 | -0.7194 | 1.8723 | CSV PDB |
| 8.0 | -0.679 | 1.8599 | CSV PDB |
| 8.5 | -0.6334 | 1.8469 | CSV PDB |
| 9.0 | -0.5837 | 1.8312 | CSV PDB |