Calculation Parameters
| Chain Sequence(s) |
EVKLVESGGGLVQPGGLRLSCAASGFAFSSYDMSWVRQAPGKRLEWVATISGGGRYTYYPDTVKGRFTISRDNAKNSHYLQMNSLRAEDTAVYFCASPYGGYFDVWGQGTLVTVSSASTKGPSVFPLAPSRSTSESTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTKTYTCNVDHKPSNTKVDKRVEEIVLTQSPATLSLSPGERATLSCRASQSISNFLHWYQQKPGQAPRLLIKYASQSISGIPARFSGGSGTDFTLTISSLEPEDFAVYFCQQSNSWPHTFGQGTKVEIKRTVAAPVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQEVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGE
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 | -1.9773 | Soluble |
| 2 | V | H | -0.8568 | Soluble |
| 3 | K | H | -1.6875 | Soluble |
| 4 | L | H | 0.0000 | Buried |
| 5 | V | H | -0.1853 | Soluble |
| 6 | E | H | -0.3337 | Soluble |
| 7 | S | H | -0.5466 | Soluble |
| 8 | G | H | -0.7052 | Soluble |
| 9 | G | H | 0.0523 | Aggregation-prone |
| 11 | G | H | 0.5652 | Aggregation-prone |
| 12 | L | H | 0.8352 | Aggregation-prone |
| 13 | V | H | 0.0000 | Buried |
| 14 | Q | H | -1.5346 | Soluble |
| 15 | P | H | -1.8494 | Soluble |
| 16 | G | H | -1.6211 | Soluble |
| 17 | G | H | -1.2160 | Soluble |
| 19 | L | H | -0.7995 | Soluble |
| 20 | R | H | -1.6731 | Soluble |
| 21 | L | H | 0.0000 | Buried |
| 22 | S | H | -0.4914 | Soluble |
| 23 | C | H | 0.0000 | Buried |
| 24 | A | H | -0.6152 | Soluble |
| 25 | A | H | 0.0000 | Buried |
| 26 | S | H | -0.9470 | Soluble |
| 27 | G | H | -1.0314 | Soluble |
| 28 | F | H | -0.2567 | Soluble |
| 29 | A | H | 0.0251 | Aggregation-prone |
| 30 | F | H | 0.0000 | Buried |
| 35 | S | H | -0.7198 | Soluble |
| 36 | S | H | -0.3028 | Soluble |
| 37 | Y | H | 0.1700 | Aggregation-prone |
| 38 | D | H | -0.2581 | Soluble |
| 39 | M | H | 0.0000 | Buried |
| 40 | S | 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 | -0.5288 | Soluble |
| 45 | A | H | -0.9616 | Soluble |
| 46 | P | H | -0.9864 | Soluble |
| 47 | G | H | -1.4952 | Soluble |
| 48 | K | H | -2.1969 | Soluble |
| 49 | R | H | -1.7545 | Soluble |
| 50 | L | H | 0.0000 | Buried |
| 51 | E | H | -0.6656 | Soluble |
| 52 | W | H | 0.0000 | Buried |
| 53 | V | H | 0.0000 | Buried |
| 54 | A | H | 0.0000 | Buried |
| 55 | T | H | 0.0000 | Buried |
| 56 | I | H | 0.0000 | Buried |
| 57 | S | H | -0.4753 | Soluble |
| 58 | G | H | -0.7556 | Soluble |
| 59 | G | H | -1.2136 | Soluble |
| 62 | G | H | -1.2774 | Soluble |
| 63 | R | H | -1.4898 | Soluble |
| 64 | Y | H | 0.3147 | Aggregation-prone |
| 65 | T | H | 0.4040 | Aggregation-prone |
| 66 | Y | H | 0.7099 | Aggregation-prone |
| 67 | Y | H | -0.3795 | Soluble |
| 68 | P | H | 0.0000 | Buried |
| 69 | D | H | -2.4251 | Soluble |
| 70 | T | H | -1.4736 | Soluble |
| 71 | V | H | 0.0000 | Buried |
| 72 | K | H | -2.5503 | Soluble |
| 74 | G | H | -1.8308 | Soluble |
| 75 | R | H | -1.6768 | Soluble |
| 76 | F | H | 0.0000 | Buried |
| 77 | T | H | -0.7699 | Soluble |
| 78 | I | H | 0.0000 | Buried |
| 79 | S | H | -0.4822 | Soluble |
| 80 | R | H | -1.3057 | Soluble |
| 81 | D | H | -1.7249 | Soluble |
| 82 | N | H | -1.7704 | Soluble |
| 83 | A | H | -1.4049 | Soluble |
| 84 | K | H | -2.3309 | Soluble |
| 85 | N | H | -1.7486 | Soluble |
| 86 | S | H | -1.1597 | Soluble |
| 87 | H | H | 0.0000 | Buried |
| 88 | Y | H | -0.4373 | Soluble |
| 89 | L | H | 0.0000 | Buried |
| 90 | Q | H | -1.0796 | Soluble |
| 91 | M | H | 0.0000 | Buried |
| 92 | N | H | -1.7867 | Soluble |
| 93 | S | H | -1.4776 | Soluble |
| 94 | L | H | 0.0000 | Buried |
| 95 | R | H | -2.7153 | Soluble |
| 96 | A | H | -1.8706 | Soluble |
| 97 | E | H | -2.3361 | Soluble |
| 98 | D | H | 0.0000 | Buried |
| 99 | T | H | -0.4732 | Soluble |
| 100 | A | H | 0.0000 | Buried |
| 101 | V | H | 0.7222 | Aggregation-prone |
| 102 | Y | H | 0.0000 | Buried |
| 103 | F | H | 0.0000 | Buried |
| 104 | C | H | 0.0000 | Buried |
| 105 | A | H | 0.0000 | Buried |
| 106 | S | H | 0.0000 | Buried |
| 107 | P | H | 0.0000 | Buried |
| 108 | Y | H | 0.8288 | Aggregation-prone |
| 109 | G | H | 0.0856 | Aggregation-prone |
| 113 | G | H | 0.0291 | Aggregation-prone |
| 114 | Y | H | 0.0000 | Buried |
| 115 | F | H | 0.0000 | Buried |
| 116 | D | H | -0.9463 | Soluble |
| 117 | V | H | -0.3143 | Soluble |
| 118 | W | H | -0.7180 | Soluble |
| 119 | G | H | 0.0000 | Buried |
| 120 | Q | H | -1.4539 | Soluble |
| 121 | G | H | -0.4795 | Soluble |
| 122 | T | H | 0.3576 | Aggregation-prone |
| 123 | L | H | 1.5057 | Aggregation-prone |
| 124 | V | H | 0.0000 | Buried |
| 125 | T | H | 0.0175 | Aggregation-prone |
| 126 | V | H | 0.0000 | Buried |
| 127 | S | H | -0.7117 | Soluble |
| 128 | S | H | -0.6695 | Soluble |
| 129 | A | H | -0.4117 | Soluble |
| 130 | S | H | -0.4754 | Soluble |
| 131 | T | H | -0.6968 | Soluble |
| 132 | K | H | -1.1714 | Soluble |
| 133 | G | H | -1.4149 | Soluble |
| 134 | P | H | 0.0000 | Buried |
| 135 | S | H | -0.4755 | Soluble |
| 136 | V | H | 0.0000 | Buried |
| 137 | F | H | 0.0000 | Buried |
| 138 | P | H | -1.2478 | Soluble |
| 139 | L | H | 0.0000 | Buried |
| 140 | A | H | -0.8691 | Soluble |
| 141 | P | H | -0.8698 | Soluble |
| 143 | S | H | -1.4097 | Soluble |
| 144 | R | H | -2.3975 | Soluble |
| 145 | S | H | -1.5184 | Soluble |
| 146 | T | H | -1.4559 | Soluble |
| 147 | S | H | -1.1959 | Soluble |
| 148 | E | H | -2.1274 | Soluble |
| 149 | S | H | -1.2550 | Soluble |
| 150 | T | H | -0.8187 | 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 | 0.0000 | Buried |
| 159 | D | H | -0.5401 | Soluble |
| 160 | Y | H | 0.0000 | Buried |
| 161 | F | H | 0.0000 | Buried |
| 162 | P | H | -0.6564 | Soluble |
| 163 | E | H | -1.0574 | Soluble |
| 164 | P | H | -1.0659 | Soluble |
| 165 | V | H | -0.7961 | Soluble |
| 166 | T | H | -0.6066 | Soluble |
| 167 | V | H | -0.1674 | Soluble |
| 168 | S | H | -0.4567 | Soluble |
| 169 | W | H | 0.0000 | Buried |
| 170 | N | H | -1.0266 | Soluble |
| 171 | S | H | -0.7704 | Soluble |
| 172 | G | H | -0.5912 | Soluble |
| 173 | A | H | -0.2761 | Soluble |
| 174 | L | H | -0.0980 | Soluble |
| 175 | T | H | -0.1948 | Soluble |
| 176 | S | H | -0.1947 | Soluble |
| 177 | G | H | -0.2423 | Soluble |
| 178 | V | H | 0.1421 | Aggregation-prone |
| 179 | H | H | -0.2489 | Soluble |
| 180 | T | H | 0.1111 | Aggregation-prone |
| 181 | F | H | 0.0000 | Buried |
| 182 | P | H | -0.2273 | Soluble |
| 183 | A | H | 0.2221 | Aggregation-prone |
| 184 | V | H | 0.5925 | Aggregation-prone |
| 185 | L | H | 1.2709 | Aggregation-prone |
| 186 | Q | H | 0.3380 | Aggregation-prone |
| 187 | S | H | -0.0049 | Soluble |
| 188 | S | H | -0.1820 | Soluble |
| 189 | G | H | 0.0709 | Aggregation-prone |
| 190 | L | H | 0.0465 | Aggregation-prone |
| 191 | Y | H | 0.4092 | Aggregation-prone |
| 192 | S | H | 0.1507 | Aggregation-prone |
| 193 | L | H | 0.0000 | Buried |
| 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 | -0.1281 | Soluble |
| 199 | V | H | 0.0000 | Buried |
| 200 | P | H | -0.6392 | Soluble |
| 201 | S | H | -1.0099 | Soluble |
| 202 | S | H | -0.7427 | Soluble |
| 203 | S | H | 0.0000 | Buried |
| 204 | L | H | -1.0848 | Soluble |
| 205 | G | H | -1.1905 | Soluble |
| 206 | T | H | -0.8795 | Soluble |
| 207 | K | H | -1.4478 | Soluble |
| 208 | T | H | -1.4684 | Soluble |
| 209 | Y | H | 0.0000 | Buried |
| 210 | T | H | 0.0000 | Buried |
| 211 | C | H | 0.0000 | Buried |
| 212 | N | H | -1.5890 | Soluble |
| 213 | V | H | 0.0000 | Buried |
| 214 | D | H | -1.9464 | Soluble |
| 215 | H | H | 0.0000 | Buried |
| 216 | K | H | -2.7855 | Soluble |
| 217 | P | H | -1.6953 | Soluble |
| 218 | S | H | -1.8435 | Soluble |
| 219 | N | H | -2.5565 | Soluble |
| 220 | T | H | -2.0666 | Soluble |
| 221 | K | H | -2.6694 | Soluble |
| 222 | V | H | -1.7097 | Soluble |
| 223 | D | H | -2.6551 | Soluble |
| 224 | K | H | -2.2104 | Soluble |
| 225 | R | H | -2.8510 | Soluble |
| 226 | V | H | 0.0000 | Buried |
| 227 | E | H | -2.6078 | Soluble |
| 1 | E | L | -1.5299 | Soluble |
| 2 | I | L | 0.0000 | Buried |
| 3 | V | L | -0.0627 | Soluble |
| 4 | L | L | 0.0000 | Buried |
| 5 | T | L | -0.7965 | Soluble |
| 6 | Q | L | 0.0000 | Buried |
| 7 | S | L | -0.6222 | Soluble |
| 8 | P | L | -0.2289 | Soluble |
| 9 | A | L | -0.1931 | Soluble |
| 10 | T | L | -0.0781 | Soluble |
| 11 | L | L | 0.0259 | Aggregation-prone |
| 12 | S | L | -0.4035 | Soluble |
| 13 | L | L | -0.7866 | Soluble |
| 14 | S | L | -1.2118 | Soluble |
| 15 | P | L | -1.5961 | Soluble |
| 16 | G | L | -1.6580 | Soluble |
| 17 | E | L | -2.0560 | Soluble |
| 18 | R | L | -2.4031 | Soluble |
| 19 | A | L | 0.0000 | Buried |
| 20 | T | L | -0.6555 | Soluble |
| 21 | L | L | 0.0000 | Buried |
| 22 | S | L | -0.9709 | Soluble |
| 23 | C | L | 0.0000 | Buried |
| 24 | R | L | -2.5904 | Soluble |
| 25 | A | L | 0.0000 | Buried |
| 26 | S | L | -1.3083 | Soluble |
| 27 | Q | L | -1.9335 | Soluble |
| 28 | S | L | -1.4023 | Soluble |
| 29 | I | L | 0.0000 | Buried |
| 36 | S | L | -0.7071 | Soluble |
| 37 | N | L | -0.4947 | Soluble |
| 38 | F | L | 0.3521 | Aggregation-prone |
| 39 | L | 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 | -0.8769 | Soluble |
| 44 | Q | L | -1.1926 | Soluble |
| 45 | K | L | -1.6595 | Soluble |
| 46 | P | L | -1.3737 | Soluble |
| 47 | G | L | -1.5040 | Soluble |
| 48 | Q | L | -2.2400 | Soluble |
| 49 | A | L | -1.5005 | Soluble |
| 50 | P | L | 0.0000 | Buried |
| 51 | R | L | -1.8430 | Soluble |
| 52 | L | L | 0.0000 | Buried |
| 53 | L | L | 0.0000 | Buried |
| 54 | I | L | 0.0000 | Buried |
| 55 | K | L | -0.7818 | Soluble |
| 56 | Y | L | -0.2221 | Soluble |
| 57 | A | L | 0.0000 | Buried |
| 65 | S | L | -0.8886 | Soluble |
| 66 | Q | L | -1.4214 | Soluble |
| 67 | S | L | -0.8591 | Soluble |
| 68 | I | L | -0.5643 | Soluble |
| 69 | S | L | -0.4570 | Soluble |
| 70 | G | L | -0.4455 | Soluble |
| 71 | I | L | -0.1360 | Soluble |
| 72 | P | L | -0.2131 | Soluble |
| 74 | A | L | -0.2055 | Soluble |
| 75 | R | L | -0.7018 | Soluble |
| 76 | F | L | 0.0000 | Buried |
| 77 | S | L | -0.5368 | Soluble |
| 78 | G | L | -0.6626 | Soluble |
| 80 | G | L | -1.3469 | Soluble |
| 83 | S | L | -0.9314 | Soluble |
| 84 | G | L | -1.2991 | Soluble |
| 85 | T | L | -2.0048 | Soluble |
| 86 | D | L | -2.5736 | Soluble |
| 87 | F | L | 0.0000 | Buried |
| 88 | T | L | -0.8835 | Soluble |
| 89 | L | L | 0.0000 | Buried |
| 90 | T | L | -0.6049 | Soluble |
| 91 | I | L | 0.0000 | Buried |
| 92 | S | L | -1.3192 | Soluble |
| 93 | S | L | -1.6576 | Soluble |
| 94 | L | L | 0.0000 | Buried |
| 95 | E | L | -2.1926 | Soluble |
| 96 | P | L | -1.6678 | Soluble |
| 97 | E | L | -2.3510 | Soluble |
| 98 | D | L | 0.0000 | Buried |
| 99 | F | L | -0.5960 | Soluble |
| 100 | A | L | 0.0000 | Buried |
| 101 | V | L | -0.0942 | Soluble |
| 102 | Y | L | 0.0000 | Buried |
| 103 | F | L | 0.0000 | Buried |
| 104 | C | L | 0.0000 | Buried |
| 105 | Q | L | 0.0000 | Buried |
| 106 | Q | L | 0.0000 | Buried |
| 107 | S | L | 0.0259 | Aggregation-prone |
| 108 | N | L | -0.4009 | Soluble |
| 109 | S | L | -0.0802 | Soluble |
| 114 | W | L | 0.5479 | Aggregation-prone |
| 115 | P | L | -0.1887 | Soluble |
| 116 | H | L | -0.0907 | Soluble |
| 117 | T | L | -0.2716 | Soluble |
| 118 | F | L | 0.0000 | Buried |
| 119 | G | L | 0.0000 | Buried |
| 120 | Q | L | -1.1029 | Soluble |
| 121 | G | L | 0.0000 | Buried |
| 122 | T | L | 0.0000 | Buried |
| 123 | K | L | -0.3647 | Soluble |
| 124 | V | L | 0.0000 | Buried |
| 125 | E | L | 0.0000 | Buried |
| 126 | I | L | -0.3924 | Soluble |
| 127 | K | L | -1.1174 | Soluble |
| 128 | R | L | -0.9003 | Soluble |
| 129 | T | L | -0.0930 | Soluble |
| 130 | V | L | 0.5429 | Aggregation-prone |
| 131 | A | L | 0.1899 | Aggregation-prone |
| 132 | A | L | -0.0314 | Soluble |
| 133 | P | L | -0.0254 | Soluble |
| 135 | V | L | 0.2518 | Aggregation-prone |
| 136 | F | L | 0.3343 | Aggregation-prone |
| 137 | I | L | 0.2268 | Aggregation-prone |
| 138 | F | L | 0.0000 | Buried |
| 139 | P | L | -0.4486 | Soluble |
| 140 | P | L | -0.8505 | Soluble |
| 141 | S | L | -1.6194 | Soluble |
| 142 | D | L | -2.9284 | Soluble |
| 143 | E | L | -2.9685 | Soluble |
| 144 | Q | L | 0.0000 | Buried |
| 145 | L | L | -2.2791 | Soluble |
| 146 | K | L | -2.8542 | Soluble |
| 147 | S | L | -1.7758 | Soluble |
| 148 | G | L | -1.2791 | Soluble |
| 149 | T | L | -1.1389 | 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 | -0.2721 | Soluble |
| 158 | N | L | -0.6696 | Soluble |
| 159 | F | L | 0.0000 | Buried |
| 160 | Y | L | 0.0000 | Buried |
| 161 | P | L | -1.0052 | Soluble |
| 162 | R | L | -1.3108 | Soluble |
| 163 | E | L | -2.5215 | Soluble |
| 164 | A | L | -1.9059 | Soluble |
| 165 | K | L | -1.9740 | Soluble |
| 166 | V | L | -0.9771 | Soluble |
| 167 | Q | L | -0.4347 | Soluble |
| 168 | W | L | 0.0000 | Buried |
| 169 | K | L | -0.5851 | Soluble |
| 170 | V | L | 0.0000 | Buried |
| 171 | D | L | -1.8773 | Soluble |
| 172 | N | L | -1.3752 | Soluble |
| 173 | A | L | -0.2807 | Soluble |
| 174 | L | L | 0.7236 | Aggregation-prone |
| 175 | Q | L | -0.3184 | Soluble |
| 176 | S | L | -0.6502 | Soluble |
| 177 | G | L | -1.2981 | Soluble |
| 178 | N | L | -1.6460 | Soluble |
| 179 | S | L | -1.5507 | Soluble |
| 180 | Q | L | -1.6098 | Soluble |
| 181 | E | L | -1.7996 | Soluble |
| 183 | V | L | 0.2468 | Aggregation-prone |
| 184 | T | L | -0.5982 | Soluble |
| 185 | E | L | -1.8897 | Soluble |
| 186 | Q | L | -1.5485 | Soluble |
| 187 | D | L | -1.9225 | Soluble |
| 188 | S | L | -1.6697 | Soluble |
| 189 | K | L | -2.2208 | Soluble |
| 190 | D | L | -1.6126 | Soluble |
| 191 | S | L | -1.5711 | 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 | -0.3715 | Soluble |
| 197 | S | L | 0.0000 | Buried |
| 198 | T | L | -0.8352 | Soluble |
| 199 | L | L | 0.0000 | Buried |
| 200 | T | L | -0.7571 | Soluble |
| 201 | L | L | -1.0728 | Soluble |
| 202 | S | L | -1.3390 | Soluble |
| 203 | K | L | -2.3865 | Soluble |
| 204 | A | L | -2.1842 | Soluble |
| 205 | D | L | -3.1094 | Soluble |
| 206 | Y | L | 0.0000 | Buried |
| 207 | E | L | -3.7040 | Soluble |
| 208 | K | L | -3.7416 | Soluble |
| 209 | H | L | -2.9918 | Soluble |
| 210 | K | L | -3.1546 | Soluble |
| 211 | V | L | -1.6103 | Soluble |
| 212 | Y | L | 0.0000 | Buried |
| 213 | A | L | 0.0000 | Buried |
| 214 | C | L | 0.0000 | Buried |
| 215 | E | L | -0.6394 | Soluble |
| 216 | V | L | 0.0000 | Buried |
| 217 | T | L | -1.1063 | Soluble |
| 218 | H | L | 0.0000 | Buried |
| 219 | Q | L | -1.3707 | Soluble |
| 220 | G | L | -0.3183 | Soluble |
| 221 | L | L | -0.0679 | Soluble |
| 222 | S | L | -0.3765 | Soluble |
| 223 | S | L | -0.3749 | Soluble |
| 224 | P | L | -0.4896 | Soluble |
| 225 | V | L | 0.1711 | Aggregation-prone |
| 226 | T | L | -0.2534 | Soluble |
| 227 | K | L | -0.3385 | Soluble |
| 228 | S | L | -0.3493 | Soluble |
| 229 | F | L | -1.0008 | Soluble |
| 230 | N | L | -2.1843 | Soluble |
| 231 | R | L | -2.6894 | Soluble |
| 232 | G | L | -2.3336 | Soluble |
| 233 | E | L | -2.6344 | 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 | -0.6578 | 2.7881 | CSV PDB |
| 4.5 | -0.7023 | 2.7249 | CSV PDB |
| 5.0 | -0.7568 | 2.6415 | CSV PDB |
| 5.5 | -0.8112 | 2.5538 | CSV PDB |
| 6.0 | -0.8539 | 2.475 | CSV PDB |
| 6.5 | -0.8749 | 2.4159 | CSV PDB |
| 7.0 | -0.872 | 2.3824 | CSV PDB |
| 7.5 | -0.8519 | 2.3681 | CSV PDB |
| 8.0 | -0.8219 | 2.363 | CSV PDB |
| 8.5 | -0.7851 | 2.3612 | CSV PDB |
| 9.0 | -0.7421 | 2.3604 | CSV PDB |