| Chain sequence(s) |
A: VKQNSPSLSVQEGRISILNCDYTNSMFDYFLWYKKYPAEGPTFLISISSIKDKNEDGRFTVFLNKSAKHLSLHIVPSQPGDSAVYFCAASDNDMRFGAGTRLTVKPI
C: IQRTPKIQVYSRHPAENGKSNFLNCYVSGFHPSDIEVDLLKNGERIEKVEHSDLSFSKDWSFYLLYYTEFTPTEKDEYACRVNHVTLSQPKIVKWDRDMGGGGSGGGGSGGGGSACSHSMKYFFTSVSRPGRGEPRFISVGYVDDTQFVRFDSDAASPRGEPRAPWVEQEGPEYWDRETQKYKRQAQTDRVSLRNLRGYYNQSEAGSHTLQWMCGCDLGPDGRLLRGYDQYAYDGKDYIALNEDLRSWTAADTAAQITQRKWEAAREAEQRRAYLEGTCVEWLRRYLENGKETLQ B: VTQTPKFQVLKTGQSMTLQCAQDMNHNSMYWYRQDPGMGLRLIYYSASEGTTDKGEVPNGYNVSRLNKREFSLRLESAAPSQTSVYFCATKSSLTYEQYFGPGTRLT D: SFEVHVCAC input PDB |
| Selected Chain(s) | A,C,B,D |
| Distance of aggregation | 10 Å |
| FoldX usage | Yes |
| Dynamic mode | No |
| Automated mutations | No |
| Mutated residues | IA15A,IA107A,IA17A,VA9B |
| Energy difference between WT (input) and mutated protein (by FoldX) | 4.46324 kcal/mol
CAUTION: Your mutation/s can destabilize the protein structure |
| Downloads | Download all the data |
| Simulation log |
[INFO] Logger: Verbosity set to: 2 - [INFO] (00:00:01)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:01)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with all chain(s) selected (00:00:01)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:01)
[INFO] FoldX: Starting FoldX energy minimalization (00:00:01)
[INFO] FoldX: Building mutant model (00:04:24)
[INFO] FoldX: Starting FoldX energy minimalization (00:04:59)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:09:06)
[INFO] Main: Simulation completed successfully. (00:09:11)
|
The table below lists A3D score for protein residues. Residues with A3D score > 0.0000 are marked by yellow rows.
| residue index | residue name | chain | Aggrescan3D score | mutation |
|---|---|---|---|---|
| residue index | residue name | chain | Aggrescan3D score | |
| 1 | V | A | -0.8240 | |
| 2 | K | A | -2.1536 | |
| 3 | Q | A | 0.0000 | |
| 4 | N | A | -2.0535 | |
| 5 | S | A | -1.4288 | |
| 6 | P | A | -1.0897 | |
| 7 | S | A | -0.9874 | |
| 8 | L | A | -0.2708 | |
| 9 | S | A | -0.7305 | |
| 10 | V | A | -1.1947 | |
| 11 | Q | A | -2.1727 | |
| 12 | E | A | -2.1448 | |
| 13 | G | A | -1.6263 | |
| 14 | R | A | -2.1941 | |
| 15 | A | A | -0.7849 | mutated: IA15A |
| 16 | S | A | 0.0000 | |
| 17 | A | A | -0.1872 | mutated: IA17A |
| 18 | L | A | 0.0000 | |
| 19 | N | A | -1.3091 | |
| 20 | C | A | 0.0000 | |
| 21 | D | A | -1.7529 | |
| 22 | Y | A | 0.0000 | |
| 23 | T | A | -0.7350 | |
| 24 | N | A | -0.7004 | |
| 25 | S | A | -1.0334 | |
| 26 | M | A | -0.5377 | |
| 27 | F | A | 0.0000 | |
| 28 | D | A | 0.0000 | |
| 29 | Y | A | 0.0000 | |
| 30 | F | A | 0.0000 | |
| 31 | L | A | 0.0000 | |
| 32 | W | A | 0.0000 | |
| 33 | Y | A | 0.0000 | |
| 34 | K | A | 0.0000 | |
| 35 | K | A | -0.4130 | |
| 36 | Y | A | -0.4492 | |
| 37 | P | A | -0.5180 | |
| 38 | A | A | -0.8495 | |
| 39 | E | A | -1.7853 | |
| 40 | G | A | -0.7076 | |
| 41 | P | A | 0.0000 | |
| 42 | T | A | 0.1542 | |
| 43 | F | A | 0.6399 | |
| 44 | L | A | 0.2386 | |
| 45 | I | A | 0.0000 | |
| 46 | S | A | -0.4714 | |
| 47 | I | A | 0.0000 | |
| 48 | S | A | 0.0000 | |
| 49 | S | A | 0.0000 | |
| 50 | I | A | 0.2639 | |
| 51 | K | A | -1.4895 | |
| 52 | D | A | -2.6546 | |
| 53 | K | A | -2.3724 | |
| 54 | N | A | -2.4343 | |
| 55 | E | A | -3.2022 | |
| 56 | D | A | -3.0307 | |
| 57 | G | A | -1.8244 | |
| 58 | R | A | -1.2001 | |
| 59 | F | A | -1.1600 | |
| 60 | T | A | -1.4091 | |
| 61 | V | A | 0.0000 | |
| 62 | F | A | -1.1315 | |
| 63 | L | A | 0.0000 | |
| 64 | N | A | -2.5596 | |
| 65 | K | A | -2.5520 | |
| 66 | S | A | -1.4776 | |
| 67 | A | A | -1.2697 | |
| 68 | K | A | -1.8114 | |
| 69 | H | A | -1.5794 | |
| 70 | L | A | 0.0000 | |
| 71 | S | A | 0.0000 | |
| 72 | L | A | 0.0000 | |
| 73 | H | A | -0.1707 | |
| 74 | I | A | 0.0000 | |
| 75 | V | A | 0.2565 | |
| 76 | P | A | -0.5470 | |
| 77 | S | A | 0.0000 | |
| 78 | Q | A | -1.5145 | |
| 79 | P | A | -1.2907 | |
| 80 | G | A | -0.8741 | |
| 81 | D | A | 0.0000 | |
| 82 | S | A | -0.7565 | |
| 83 | A | A | 0.0000 | |
| 84 | V | A | -0.3526 | |
| 85 | Y | A | 0.0000 | |
| 86 | F | A | 0.0000 | |
| 87 | C | A | 0.0000 | |
| 88 | A | A | 0.0000 | |
| 89 | A | A | 0.0000 | |
| 90 | S | A | 0.0000 | |
| 91 | D | A | -0.8467 | |
| 92 | N | A | -0.8679 | |
| 93 | D | A | -1.1170 | |
| 94 | M | A | 0.0000 | |
| 95 | R | A | -0.8286 | |
| 96 | F | A | 0.0000 | |
| 97 | G | A | 0.0000 | |
| 98 | A | A | -0.8569 | |
| 99 | G | A | 0.0000 | |
| 100 | T | A | 0.0000 | |
| 101 | R | A | -1.6856 | |
| 102 | L | A | 0.0000 | |
| 103 | T | A | -1.0866 | |
| 104 | V | A | 0.0000 | |
| 105 | K | A | -2.3290 | |
| 106 | P | A | -1.4087 | |
| 107 | A | A | -0.9453 | mutated: IA107A |
| 1 | V | B | 0.0412 | |
| 2 | T | B | -0.4087 | |
| 3 | Q | B | 0.0000 | |
| 4 | T | B | -0.6015 | |
| 5 | P | B | -0.6320 | |
| 6 | K | B | -1.1428 | |
| 7 | F | B | 0.6780 | |
| 8 | Q | B | 0.1334 | |
| 9 | A | B | -0.0633 | mutated: VA9B |
| 10 | L | B | -1.0478 | |
| 11 | K | B | -2.1064 | |
| 12 | T | B | -1.4810 | |
| 13 | G | B | -1.8323 | |
| 14 | Q | B | -2.1734 | |
| 15 | S | B | -1.9976 | |
| 16 | M | B | -1.1848 | |
| 17 | T | B | -1.2336 | |
| 18 | L | B | 0.0000 | |
| 19 | Q | B | -1.1159 | |
| 20 | C | B | 0.0000 | |
| 21 | A | B | -1.2304 | |
| 22 | Q | B | 0.0000 | |
| 23 | D | B | -2.5185 | |
| 24 | M | B | -1.3461 | |
| 25 | N | B | -2.3022 | |
| 26 | H | B | -1.4875 | |
| 27 | N | B | 0.0000 | |
| 28 | S | B | 0.0000 | |
| 29 | M | B | 0.0000 | |
| 30 | Y | B | 0.1709 | |
| 31 | W | B | 0.0000 | |
| 32 | Y | B | 0.0000 | |
| 33 | R | B | -0.4098 | |
| 34 | Q | B | -0.5510 | |
| 35 | D | B | -0.5518 | |
| 36 | P | B | -0.4882 | |
| 37 | G | B | -0.5845 | |
| 38 | M | B | -0.3081 | |
| 39 | G | B | 0.0000 | |
| 40 | L | B | 0.0000 | |
| 41 | R | B | -0.8827 | |
| 42 | L | B | 0.0000 | |
| 43 | I | B | 0.0000 | |
| 44 | Y | B | 0.0000 | |
| 45 | Y | B | -0.6039 | |
| 46 | S | B | 0.0000 | |
| 47 | A | B | -0.7513 | |
| 48 | S | B | -1.4602 | |
| 49 | E | B | -2.4134 | |
| 50 | G | B | -1.5477 | |
| 51 | T | B | -1.4664 | |
| 52 | T | B | -1.5382 | |
| 53 | D | B | -2.2082 | |
| 54 | K | B | -2.6949 | |
| 55 | G | B | -1.6029 | |
| 56 | E | B | -0.9875 | |
| 57 | V | B | -0.6370 | |
| 58 | P | B | -1.5584 | |
| 59 | N | B | -1.7194 | |
| 60 | G | B | -1.7143 | |
| 61 | Y | B | 0.0000 | |
| 62 | N | B | -2.4968 | |
| 63 | V | B | 0.0000 | |
| 64 | S | B | -0.5616 | |
| 65 | R | B | 0.0000 | |
| 66 | L | B | 0.3360 | |
| 67 | N | B | -1.2967 | |
| 68 | K | B | -2.5006 | |
| 69 | R | B | -3.0311 | |
| 70 | E | B | -1.6225 | |
| 71 | F | B | 0.0000 | |
| 72 | S | B | 0.0000 | |
| 73 | L | B | 0.0000 | |
| 74 | R | B | -2.5749 | |
| 75 | L | B | 0.0000 | |
| 76 | E | B | -2.9210 | |
| 77 | S | B | -2.0859 | |
| 78 | A | B | 0.0000 | |
| 79 | A | B | -1.0087 | |
| 80 | P | B | -0.6430 | |
| 81 | S | B | -0.4022 | |
| 82 | Q | B | 0.0000 | |
| 83 | T | B | -0.3225 | |
| 84 | S | B | 0.0000 | |
| 85 | V | B | -0.0074 | |
| 86 | Y | B | 0.0000 | |
| 87 | F | B | 0.0000 | |
| 88 | C | B | 0.0000 | |
| 89 | A | B | 0.0000 | |
| 90 | T | B | 0.0000 | |
| 91 | K | B | 0.0000 | |
| 92 | S | B | -0.2018 | |
| 93 | S | B | 0.0000 | |
| 94 | L | B | -0.2978 | |
| 95 | T | B | -0.3277 | |
| 96 | Y | B | 0.0000 | |
| 97 | E | B | -0.0101 | |
| 98 | Q | B | 0.0000 | |
| 99 | Y | B | 0.8565 | |
| 100 | F | B | 0.3341 | |
| 101 | G | B | 0.0000 | |
| 102 | P | B | -0.9408 | |
| 103 | G | B | 0.0000 | |
| 104 | T | B | 0.0000 | |
| 105 | R | B | -0.5928 | |
| 106 | L | B | 0.0000 | |
| 107 | T | B | -0.2201 | |
| 1 | I | C | 0.4812 | |
| 2 | Q | C | -0.3753 | |
| 3 | R | C | -0.4982 | |
| 4 | T | C | -0.5381 | |
| 5 | P | C | 0.0000 | |
| 6 | K | C | -1.6477 | |
| 7 | I | C | -0.9038 | |
| 8 | Q | C | -1.0083 | |
| 9 | V | C | 0.0000 | |
| 10 | Y | C | -0.7955 | |
| 11 | S | C | -1.3042 | |
| 12 | R | C | -2.1508 | |
| 13 | H | C | -1.8447 | |
| 14 | P | C | -1.7838 | |
| 15 | A | C | -2.2644 | |
| 16 | E | C | -3.2007 | |
| 17 | N | C | -2.9977 | |
| 18 | G | C | -2.1507 | |
| 19 | K | C | -2.1890 | |
| 20 | S | C | -1.5364 | |
| 21 | N | C | 0.0000 | |
| 22 | F | C | -0.9858 | |
| 23 | L | C | 0.0000 | |
| 24 | N | C | 0.0000 | |
| 25 | C | C | 0.0000 | |
| 26 | Y | C | 0.3050 | |
| 27 | V | C | 0.0000 | |
| 28 | S | C | -0.3523 | |
| 29 | G | C | -0.8353 | |
| 30 | F | C | 0.0000 | |
| 31 | H | C | 0.0000 | |
| 32 | P | C | -0.4968 | |
| 33 | S | C | -0.9532 | |
| 34 | D | C | -1.8494 | |
| 35 | I | C | -1.3592 | |
| 36 | E | C | -2.3475 | |
| 37 | V | C | 0.0000 | |
| 38 | D | C | -1.9054 | |
| 39 | L | C | 0.0000 | |
| 40 | L | C | -2.8512 | |
| 41 | K | C | -2.9540 | |
| 42 | N | C | -3.4911 | |
| 43 | G | C | -3.0547 | |
| 44 | E | C | -3.6786 | |
| 45 | R | C | -3.8373 | |
| 46 | I | C | -2.6744 | |
| 47 | E | C | -3.3273 | |
| 48 | K | C | -3.1700 | |
| 49 | V | C | -2.4044 | |
| 50 | E | C | -2.7631 | |
| 51 | H | C | -1.5353 | |
| 52 | S | C | -0.7405 | |
| 53 | D | C | -0.6973 | |
| 54 | L | C | -0.0888 | |
| 55 | S | C | 0.0000 | |
| 56 | F | C | 0.0000 | |
| 57 | S | C | -1.2408 | |
| 58 | K | C | -2.3461 | |
| 59 | D | C | -2.5304 | |
| 60 | W | C | 0.0000 | |
| 61 | S | C | 0.0000 | |
| 62 | F | C | 0.0000 | |
| 63 | Y | C | 0.2171 | |
| 64 | L | C | 0.0000 | |
| 65 | L | C | 0.0178 | |
| 66 | Y | C | -0.4084 | |
| 67 | Y | C | -0.9434 | |
| 68 | T | C | 0.0000 | |
| 69 | E | C | -2.2136 | |
| 70 | F | C | 0.0000 | |
| 71 | T | C | -1.3247 | |
| 72 | P | C | 0.0000 | |
| 73 | T | C | -2.6721 | |
| 74 | E | C | -3.4611 | |
| 75 | K | C | -3.3665 | |
| 76 | D | C | -2.9438 | |
| 77 | E | C | -3.7490 | |
| 78 | Y | C | 0.0000 | |
| 79 | A | C | 0.0000 | |
| 80 | C | C | 0.0000 | |
| 81 | R | C | -2.0249 | |
| 82 | V | C | 0.0000 | |
| 83 | N | C | -1.6840 | |
| 84 | H | C | 0.0000 | |
| 85 | V | C | 0.8245 | |
| 86 | T | C | 0.3034 | |
| 87 | L | C | -0.0860 | |
| 88 | S | C | -0.5644 | |
| 89 | Q | C | -1.3222 | |
| 90 | P | C | -1.4569 | |
| 91 | K | C | -1.5145 | |
| 92 | I | C | -0.7061 | |
| 93 | V | C | -0.9586 | |
| 94 | K | C | -2.3945 | |
| 95 | W | C | 0.0000 | |
| 96 | D | C | -2.3961 | |
| 97 | R | C | -2.4349 | |
| 98 | D | C | -2.1448 | |
| 99 | M | C | -0.7123 | |
| 100 | G | C | -1.0633 | |
| 101 | G | C | -1.2352 | |
| 102 | G | C | -1.0442 | |
| 103 | G | C | -1.4423 | |
| 104 | S | C | -1.1574 | |
| 105 | G | C | -1.3166 | |
| 106 | G | C | -1.3547 | |
| 107 | G | C | -1.2012 | |
| 108 | G | C | -1.2056 | |
| 109 | S | C | -1.0620 | |
| 110 | G | C | -1.1997 | |
| 111 | G | C | -1.2244 | |
| 112 | G | C | -1.1248 | |
| 113 | G | C | -0.9292 | |
| 114 | S | C | -0.4272 | |
| 115 | A | C | -0.0873 | |
| 116 | C | C | -0.1602 | |
| 117 | S | C | -0.7481 | |
| 118 | H | C | -0.7458 | |
| 119 | S | C | -0.7241 | |
| 120 | M | C | 0.0000 | |
| 121 | K | C | -0.5164 | |
| 122 | Y | C | 0.0000 | |
| 123 | F | C | 0.1059 | |
| 124 | F | C | 0.0000 | |
| 125 | T | C | 0.0000 | |
| 126 | S | C | 0.0000 | |
| 127 | V | C | 0.0000 | |
| 128 | S | C | 0.0000 | |
| 129 | R | C | -1.7059 | |
| 130 | P | C | -1.6517 | |
| 131 | G | C | -1.8351 | |
| 132 | R | C | -2.4613 | |
| 133 | G | C | -1.7985 | |
| 134 | E | C | -1.4954 | |
| 135 | P | C | 0.0000 | |
| 136 | R | C | -1.4613 | |
| 137 | F | C | 0.0000 | |
| 138 | I | C | 0.0000 | |
| 139 | S | C | 0.0000 | |
| 140 | V | C | 0.0000 | |
| 141 | G | C | 0.0000 | |
| 142 | Y | C | -0.8862 | |
| 143 | V | C | 0.0000 | |
| 144 | D | C | -1.8622 | |
| 145 | D | C | -2.2361 | |
| 146 | T | C | -1.3196 | |
| 147 | Q | C | -1.1711 | |
| 148 | F | C | 0.0000 | |
| 149 | V | C | 0.0000 | |
| 150 | R | C | -1.2669 | |
| 151 | F | C | 0.0000 | |
| 152 | D | C | -1.5037 | |
| 153 | S | C | -1.5046 | |
| 154 | D | C | -1.7782 | |
| 155 | A | C | -1.0353 | |
| 156 | A | C | -0.5845 | |
| 157 | S | C | -0.7818 | |
| 158 | P | C | -1.4474 | |
| 159 | R | C | -2.2386 | |
| 160 | G | C | 0.0000 | |
| 161 | E | C | -1.5064 | |
| 162 | P | C | -1.7604 | |
| 163 | R | C | -1.7931 | |
| 164 | A | C | 0.0000 | |
| 165 | P | C | -1.4539 | |
| 166 | W | C | 0.0000 | |
| 167 | V | C | 0.0000 | |
| 168 | E | C | -2.7780 | |
| 169 | Q | C | -2.3306 | |
| 170 | E | C | 0.0000 | |
| 171 | G | C | -1.7126 | |
| 172 | P | C | -2.2628 | |
| 173 | E | C | -3.0813 | |
| 174 | Y | C | 0.0000 | |
| 175 | W | C | -2.6502 | |
| 176 | D | C | -3.7224 | |
| 177 | R | C | -3.5898 | |
| 178 | E | C | 0.0000 | |
| 179 | T | C | -2.6925 | |
| 180 | Q | C | -2.7042 | |
| 181 | K | C | -2.2956 | |
| 182 | Y | C | 0.0000 | |
| 183 | K | C | -2.4049 | |
| 184 | R | C | -1.8049 | |
| 185 | Q | C | 0.0000 | |
| 186 | A | C | 0.0000 | |
| 187 | Q | C | 0.0000 | |
| 188 | T | C | 0.1065 | |
| 189 | D | C | 0.0000 | |
| 190 | R | C | -0.1042 | |
| 191 | V | C | 0.3856 | |
| 192 | S | C | 0.0000 | |
| 193 | L | C | 0.0000 | |
| 194 | R | C | 0.0000 | |
| 195 | N | C | 0.0000 | |
| 196 | L | C | 0.0000 | |
| 197 | R | C | -0.7564 | |
| 198 | G | C | 0.0000 | |
| 199 | Y | C | 0.0000 | |
| 200 | Y | C | 0.0012 | |
| 201 | N | C | -0.9546 | |
| 202 | Q | C | -1.2054 | |
| 203 | S | C | -1.4671 | |
| 204 | E | C | -2.2540 | |
| 205 | A | C | -1.2271 | |
| 206 | G | C | -1.0854 | |
| 207 | S | C | -0.9440 | |
| 208 | H | C | -0.7148 | |
| 209 | T | C | 0.0000 | |
| 210 | L | C | 0.0000 | |
| 211 | Q | C | 0.0000 | |
| 212 | W | C | 0.0000 | |
| 213 | M | C | 0.0000 | |
| 214 | C | C | 0.0000 | |
| 215 | G | C | 0.0000 | |
| 216 | C | C | 0.0000 | |
| 217 | D | C | 0.0000 | |
| 218 | L | C | 0.0000 | |
| 219 | G | C | 0.0000 | |
| 220 | P | C | -1.3420 | |
| 221 | D | C | -2.4046 | |
| 222 | G | C | -1.9349 | |
| 223 | R | C | -2.8440 | |
| 224 | L | C | -1.2985 | |
| 225 | L | C | -0.7159 | |
| 226 | R | C | -1.4717 | |
| 227 | G | C | 0.0000 | |
| 228 | Y | C | -0.6062 | |
| 229 | D | C | 0.0000 | |
| 230 | Q | C | -0.7795 | |
| 231 | Y | C | 0.0000 | |
| 232 | A | C | 0.0000 | |
| 233 | Y | C | 0.0000 | |
| 234 | D | C | -0.9288 | |
| 235 | G | C | 0.0000 | |
| 236 | K | C | -2.4694 | |
| 237 | D | C | -2.9869 | |
| 238 | Y | C | 0.0000 | |
| 239 | I | C | 0.0000 | |
| 240 | A | C | -0.7872 | |
| 241 | L | C | 0.0000 | |
| 242 | N | C | -2.3781 | |
| 243 | E | C | -3.2463 | |
| 244 | D | C | -3.5092 | |
| 245 | L | C | 0.0000 | |
| 246 | R | C | -3.6484 | |
| 247 | S | C | -2.2795 | |
| 248 | W | C | 0.0000 | |
| 249 | T | C | -0.5922 | |
| 250 | A | C | -0.9003 | |
| 251 | A | C | -1.1950 | |
| 252 | D | C | -1.2208 | |
| 253 | T | C | -0.3473 | |
| 254 | A | C | 0.0000 | |
| 255 | A | C | 0.0000 | |
| 256 | Q | C | -1.1416 | |
| 257 | I | C | -0.6601 | |
| 258 | T | C | 0.0000 | |
| 259 | Q | C | -1.4001 | |
| 260 | R | C | -2.4422 | |
| 261 | K | C | 0.0000 | |
| 262 | W | C | 0.0000 | |
| 263 | E | C | -2.5657 | |
| 264 | A | C | -1.4517 | |
| 265 | A | C | -1.6185 | |
| 266 | R | C | -3.1640 | |
| 267 | E | C | 0.0000 | |
| 268 | A | C | 0.0000 | |
| 269 | E | C | -2.8995 | |
| 270 | Q | C | -2.5141 | |
| 271 | R | C | 0.0000 | |
| 272 | R | C | -2.2032 | |
| 273 | A | C | -1.5631 | |
| 274 | Y | C | 0.0000 | |
| 275 | L | C | 0.0000 | |
| 276 | E | C | -2.4540 | |
| 277 | G | C | -1.4932 | |
| 278 | T | C | -1.2633 | |
| 279 | C | C | 0.0000 | |
| 280 | V | C | 0.0000 | |
| 281 | E | C | -2.7708 | |
| 282 | W | C | -1.5444 | |
| 283 | L | C | 0.0000 | |
| 284 | R | C | -2.7649 | |
| 285 | R | C | -2.9580 | |
| 286 | Y | C | 0.0000 | |
| 287 | L | C | 0.0000 | |
| 288 | E | C | -3.8299 | |
| 289 | N | C | -3.1383 | |
| 290 | G | C | 0.0000 | |
| 291 | K | C | -3.9977 | |
| 292 | E | C | -3.3470 | |
| 293 | T | C | -2.0668 | |
| 294 | L | C | -2.2902 | |
| 295 | Q | C | -2.5894 | |
| 1 | S | D | 0.0000 | |
| 2 | F | D | 0.0000 | |
| 3 | E | D | -0.8870 | |
| 4 | V | D | -0.3029 | |
| 5 | H | D | 0.0000 | |
| 6 | V | D | 1.5827 | |
| 7 | C | D | 0.9252 | |
| 8 | A | D | 0.0000 | |
| 9 | C | D | 0.0000 |