| Chain sequence(s) |
A: ASKGEELFTGVVPILVELDGDVNGHKFSVSGEGEGDATYGKLTLKFICTTGKLPVPWPTLVTTFAAAVQCFARYPDHMKQHDFFKSAMPEGYVQERTIFFKDDGNYKTRAEVKFEGDTLVNRIELKGIDFKEDGNILGHKLEYNYNSHNVYIMADKQKNGIKVNFKIRHNIEDGSVHLADHYQQNTPIGDGPVLLPDNHYLSTQSALSKDPNEKRDHMVLLEFVTAAGITH
C: DVQLVESGGGLVQPGGSLRLSCEASGGAFSTVAMGWFRQAPGKEREFVGAITWTAGSTYYADSAKGRFTISRDNAKNTVHLQMNSLKPEDTAVYYCAQRVRGFFGPLRTTPSWYEYWGQGTQVTVSG B: ASKGEELFTGVVPILVELDGDVNGHKFSVSGEGEGDATYGKLTLKFICTTGKLPVPWPTLVTTFAAAVQCFARYPDHMKQHDFFKSAMPEGYVQERTIFFKDDGNYKTRAEVKFEGDTLVNRIELKGIDFKEDGNILGHKLEYNYNSHNVYIMADKQKNGIKVNFKIRHNIEDGSVHLADHYQQNTPIGDGPVLLPDNHYLSTQSALSKDPNEKRDHMVLLEFVTAAGITH D: DVQLVESGGGLVQPGGSLRLSCEASGGAFSTVAMGWFRQAPGKEREFVGAITWTAGSTYYADSAKGRFTISRDKNTVHLQMNSLKPEDTAVYYCAQRVRGFFGPLRTTPSWYEYWGQGTQVTVSGLE input PDB |
| Selected Chain(s) | A,C,B,D |
| Distance of aggregation | 10 Å |
| FoldX usage | Yes |
| Dynamic mode | No |
| Automated mutations | No |
| Downloads | Download all the data |
| Simulation log |
[INFO] Logger: Verbosity set to: 2 - [INFO] (00:00:00)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:00)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with all chain(s) selected (00:00:00)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:00)
[INFO] FoldX: Starting FoldX energy minimalization (00:00:01)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:12:26)
[INFO] Main: Simulation completed successfully. (00:12:34)
|
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 | A | A | -0.6249 | |
| 2 | S | A | -1.5770 | |
| 3 | K | A | -2.6144 | |
| 4 | G | A | 0.0000 | |
| 5 | E | A | -2.2638 | |
| 6 | E | A | -2.6937 | |
| 7 | L | A | -1.1098 | |
| 8 | F | A | 0.0000 | |
| 9 | T | A | -0.4345 | |
| 10 | G | A | 0.3591 | |
| 11 | V | A | 1.1883 | |
| 12 | V | A | 0.0000 | |
| 13 | P | A | -0.7884 | |
| 14 | I | A | 0.0000 | |
| 15 | L | A | -1.0544 | |
| 16 | V | A | 0.0000 | |
| 17 | E | A | -2.0920 | |
| 18 | L | A | 0.0000 | |
| 19 | D | A | -3.4984 | |
| 20 | G | A | -2.8741 | |
| 21 | D | A | -2.5938 | |
| 22 | V | A | 0.0000 | |
| 23 | N | A | -1.8160 | |
| 24 | G | A | -1.5476 | |
| 25 | H | A | -2.0284 | |
| 26 | K | A | -2.8528 | |
| 27 | F | A | 0.0000 | |
| 28 | S | A | -1.7263 | |
| 29 | V | A | 0.0000 | |
| 30 | S | A | -0.9646 | |
| 31 | G | A | 0.0000 | |
| 32 | E | A | -2.0936 | |
| 33 | G | A | -1.5839 | |
| 34 | E | A | -1.2903 | |
| 35 | G | A | 0.0000 | |
| 36 | D | A | -0.1733 | |
| 37 | A | A | 0.0000 | |
| 38 | T | A | -0.0373 | |
| 39 | Y | A | -0.4567 | |
| 40 | G | A | 0.0000 | |
| 41 | K | A | -0.7414 | |
| 42 | L | A | 0.0000 | |
| 43 | T | A | -1.0053 | |
| 44 | L | A | 0.0000 | |
| 45 | K | A | -1.1220 | |
| 46 | F | A | 0.0000 | |
| 47 | I | A | -0.6702 | |
| 48 | C | A | 0.0000 | |
| 49 | T | A | -0.6010 | |
| 50 | T | A | -1.1025 | |
| 51 | G | A | -1.4655 | |
| 52 | K | A | -2.1723 | |
| 53 | L | A | 0.0000 | |
| 54 | P | A | -1.1561 | |
| 55 | V | A | 0.0000 | |
| 56 | P | A | 0.0000 | |
| 57 | W | A | 0.0000 | |
| 58 | P | A | 0.0000 | |
| 59 | T | A | 0.0000 | |
| 60 | L | A | 0.0000 | |
| 61 | V | A | 0.0000 | |
| 62 | T | A | -0.0246 | |
| 63 | T | A | 0.0000 | |
| 64 | F | A | 0.0000 | |
| 68 | V | A | 0.0000 | |
| 69 | Q | A | -0.1671 | |
| 70 | C | A | 0.0000 | |
| 71 | F | A | 0.0000 | |
| 72 | A | A | 0.0000 | |
| 73 | R | A | -0.6986 | |
| 74 | Y | A | 0.0000 | |
| 75 | P | A | -1.6116 | |
| 76 | D | A | -2.6808 | |
| 77 | H | A | -2.2619 | |
| 78 | M | A | 0.0000 | |
| 79 | K | A | -2.6174 | |
| 80 | Q | A | -2.2167 | |
| 81 | H | A | -1.4060 | |
| 82 | D | A | 0.0000 | |
| 83 | F | A | 0.0000 | |
| 84 | F | A | 0.0000 | |
| 85 | K | A | 0.0000 | |
| 86 | S | A | -1.0496 | |
| 87 | A | A | 0.0000 | |
| 88 | M | A | 0.0000 | |
| 89 | P | A | -1.6398 | |
| 90 | E | A | -1.9191 | |
| 91 | G | A | 0.0000 | |
| 92 | Y | A | 0.0000 | |
| 93 | V | A | -0.9254 | |
| 94 | Q | A | 0.0000 | |
| 95 | E | A | -2.5509 | |
| 96 | R | A | 0.0000 | |
| 97 | T | A | -1.1754 | |
| 98 | I | A | 0.0000 | |
| 99 | F | A | -0.8719 | |
| 100 | F | A | 0.0000 | |
| 101 | K | A | -2.5219 | |
| 102 | D | A | -3.1106 | |
| 103 | D | A | -2.6351 | |
| 104 | G | A | 0.0000 | |
| 105 | N | A | -1.2112 | |
| 106 | Y | A | 0.0000 | |
| 107 | K | A | -2.4581 | |
| 108 | T | A | 0.0000 | |
| 109 | R | A | -3.7831 | |
| 110 | A | A | 0.0000 | |
| 111 | E | A | -2.3169 | |
| 112 | V | A | 0.0000 | |
| 113 | K | A | -1.5488 | |
| 114 | F | A | -1.6981 | |
| 115 | E | A | -2.6105 | |
| 116 | G | A | -2.2153 | |
| 117 | D | A | -2.4615 | |
| 118 | T | A | -1.6251 | |
| 119 | L | A | 0.0000 | |
| 120 | V | A | 0.0000 | |
| 121 | N | A | 0.0000 | |
| 122 | R | A | -3.3075 | |
| 123 | I | A | 0.0000 | |
| 124 | E | A | -4.3242 | |
| 125 | L | A | 0.0000 | |
| 126 | K | A | -3.0062 | |
| 127 | G | A | 0.0000 | |
| 128 | I | A | -0.9937 | |
| 129 | D | A | -2.2176 | |
| 130 | F | A | 0.0000 | |
| 131 | K | A | -3.8404 | |
| 132 | E | A | -3.9020 | |
| 133 | D | A | -3.6117 | |
| 134 | G | A | -2.9615 | |
| 135 | N | A | -2.5389 | |
| 136 | I | A | 0.0000 | |
| 137 | L | A | -1.9888 | |
| 138 | G | A | -2.3505 | |
| 139 | H | A | -2.2509 | |
| 140 | K | A | -2.7288 | |
| 141 | L | A | 0.0000 | |
| 142 | E | A | -1.2653 | |
| 143 | Y | A | -0.4127 | |
| 144 | N | A | 0.0000 | |
| 145 | Y | A | 0.0000 | |
| 146 | N | A | 0.0000 | |
| 147 | S | A | 0.0000 | |
| 148 | H | A | 0.0000 | |
| 149 | N | A | -0.2323 | |
| 150 | V | A | 0.0000 | |
| 151 | Y | A | 0.0005 | |
| 152 | I | A | 0.0000 | |
| 153 | M | A | 0.0000 | |
| 154 | A | A | -1.5473 | |
| 155 | D | A | 0.0000 | |
| 156 | K | A | -3.0772 | |
| 157 | Q | A | -3.2195 | |
| 158 | K | A | -3.2485 | |
| 159 | N | A | -2.7181 | |
| 160 | G | A | 0.0000 | |
| 161 | I | A | 0.0000 | |
| 162 | K | A | -0.8869 | |
| 163 | V | A | 0.0000 | |
| 164 | N | A | 0.0000 | |
| 165 | F | A | 0.0000 | |
| 166 | K | A | -0.5768 | |
| 167 | I | A | 0.0000 | |
| 168 | R | A | -0.1426 | |
| 169 | H | A | 0.0000 | |
| 170 | N | A | -0.7739 | |
| 171 | I | A | 0.0000 | |
| 172 | E | A | -3.3861 | |
| 173 | D | A | -3.2184 | |
| 174 | G | A | -1.8420 | |
| 175 | S | A | -0.7912 | |
| 176 | V | A | 0.3967 | |
| 177 | H | A | 0.0000 | |
| 178 | L | A | -0.2377 | |
| 179 | A | A | 0.0000 | |
| 180 | D | A | -0.6268 | |
| 181 | H | A | 0.0000 | |
| 182 | Y | A | 0.0000 | |
| 183 | Q | A | 0.0000 | |
| 184 | Q | A | -1.0539 | |
| 185 | N | A | 0.0000 | |
| 186 | T | A | -0.7060 | |
| 187 | P | A | -0.7709 | |
| 188 | I | A | -0.2004 | |
| 189 | G | A | -1.1860 | |
| 190 | D | A | -2.1972 | |
| 191 | G | A | -1.4387 | |
| 192 | P | A | -0.8166 | |
| 193 | V | A | -0.3138 | |
| 194 | L | A | -0.1812 | |
| 195 | L | A | -0.4030 | |
| 196 | P | A | 0.0000 | |
| 197 | D | A | -2.1451 | |
| 198 | N | A | -1.5226 | |
| 199 | H | A | 0.0000 | |
| 200 | Y | A | 0.0190 | |
| 201 | L | A | 0.0000 | |
| 202 | S | A | -0.0765 | |
| 203 | T | A | -0.1039 | |
| 204 | Q | A | 0.0000 | |
| 205 | S | A | 0.0000 | |
| 206 | A | A | 0.0000 | |
| 207 | L | A | 0.0000 | |
| 208 | S | A | -0.5217 | |
| 209 | K | A | -1.4671 | |
| 210 | D | A | -1.6258 | |
| 211 | P | A | -1.6066 | |
| 212 | N | A | -2.3517 | |
| 213 | E | A | -2.7028 | |
| 214 | K | A | -2.9542 | |
| 215 | R | A | -2.7721 | |
| 216 | D | A | -2.0094 | |
| 217 | H | A | 0.0000 | |
| 218 | M | A | 0.0000 | |
| 219 | V | A | -0.4170 | |
| 220 | L | A | 0.0000 | |
| 221 | L | A | 0.0000 | |
| 222 | E | A | -0.4629 | |
| 223 | F | A | 0.0000 | |
| 224 | V | A | 0.0000 | |
| 225 | T | A | -0.2376 | |
| 226 | A | A | 0.0000 | |
| 227 | A | A | -0.1598 | |
| 228 | G | A | -0.4752 | |
| 229 | I | A | -0.4571 | |
| 230 | T | A | -0.5154 | |
| 231 | H | A | -1.0687 | |
| 1 | A | B | -0.6249 | |
| 2 | S | B | -1.5738 | |
| 3 | K | B | -2.6172 | |
| 4 | G | B | 0.0000 | |
| 5 | E | B | -2.2774 | |
| 6 | E | B | -2.6848 | |
| 7 | L | B | -1.1028 | |
| 8 | F | B | 0.0000 | |
| 9 | T | B | -0.3922 | |
| 10 | G | B | 0.4062 | |
| 11 | V | B | 1.1613 | |
| 12 | V | B | 0.0000 | |
| 13 | P | B | -0.9367 | |
| 14 | I | B | 0.0000 | |
| 15 | L | B | -1.1126 | |
| 16 | V | B | 0.0000 | |
| 17 | E | B | -2.0772 | |
| 18 | L | B | 0.0000 | |
| 19 | D | B | -3.4629 | |
| 20 | G | B | -2.7983 | |
| 21 | D | B | -2.5702 | |
| 22 | V | B | 0.0000 | |
| 23 | N | B | -1.9348 | |
| 24 | G | B | -1.5915 | |
| 25 | H | B | -2.0530 | |
| 26 | K | B | -2.8474 | |
| 27 | F | B | 0.0000 | |
| 28 | S | B | -1.7747 | |
| 29 | V | B | 0.0000 | |
| 30 | S | B | -1.0775 | |
| 31 | G | B | 0.0000 | |
| 32 | E | B | -2.2137 | |
| 33 | G | B | -1.7480 | |
| 34 | E | B | -1.5204 | |
| 35 | G | B | 0.0000 | |
| 36 | D | B | -0.0331 | |
| 37 | A | B | 0.0000 | |
| 38 | T | B | 0.1238 | |
| 39 | Y | B | -0.2011 | |
| 40 | G | B | 0.0000 | |
| 41 | K | B | -0.5021 | |
| 42 | L | B | 0.0000 | |
| 43 | T | B | -1.0362 | |
| 44 | L | B | 0.0000 | |
| 45 | K | B | -1.2390 | |
| 46 | F | B | 0.0000 | |
| 47 | I | B | -1.1364 | |
| 48 | C | B | 0.0000 | |
| 49 | T | B | -0.8145 | |
| 50 | T | B | -1.1910 | |
| 51 | G | B | -1.6658 | |
| 52 | K | B | -2.2879 | |
| 53 | L | B | -1.1853 | |
| 54 | P | B | -1.1243 | |
| 55 | V | B | 0.0000 | |
| 56 | P | B | 0.0000 | |
| 57 | W | B | 0.0000 | |
| 58 | P | B | 0.0000 | |
| 59 | T | B | 0.0000 | |
| 60 | L | B | 0.0000 | |
| 61 | V | B | 0.0000 | |
| 62 | T | B | -0.0243 | |
| 63 | T | B | 0.0000 | |
| 64 | F | B | 0.0000 | |
| 68 | V | B | 0.0000 | |
| 69 | Q | B | -0.1665 | |
| 70 | C | B | 0.0000 | |
| 71 | F | B | 0.0000 | |
| 72 | A | B | 0.0000 | |
| 73 | R | B | -0.5570 | |
| 74 | Y | B | -1.0784 | |
| 75 | P | B | -1.6196 | |
| 76 | D | B | -2.7430 | |
| 77 | H | B | -2.3561 | |
| 78 | M | B | 0.0000 | |
| 79 | K | B | -2.8118 | |
| 80 | Q | B | -2.3095 | |
| 81 | H | B | -1.4382 | |
| 82 | D | B | 0.0000 | |
| 83 | F | B | 0.0000 | |
| 84 | F | B | 0.0000 | |
| 85 | K | B | 0.0000 | |
| 86 | S | B | -1.0331 | |
| 87 | A | B | 0.0000 | |
| 88 | M | B | 0.0000 | |
| 89 | P | B | -1.6663 | |
| 90 | E | B | -2.0000 | |
| 91 | G | B | 0.0000 | |
| 92 | Y | B | 0.0000 | |
| 93 | V | B | -0.9704 | |
| 94 | Q | B | 0.0000 | |
| 95 | E | B | -2.5800 | |
| 96 | R | B | 0.0000 | |
| 97 | T | B | -1.0811 | |
| 98 | I | B | 0.0000 | |
| 99 | F | B | -0.7480 | |
| 100 | F | B | 0.0000 | |
| 101 | K | B | -2.1873 | |
| 102 | D | B | -2.9571 | |
| 103 | D | B | -2.5619 | |
| 104 | G | B | 0.0000 | |
| 105 | N | B | -1.1571 | |
| 106 | Y | B | 0.0000 | |
| 107 | K | B | -2.1906 | |
| 108 | T | B | 0.0000 | |
| 109 | R | B | -3.7474 | |
| 110 | A | B | 0.0000 | |
| 111 | E | B | -2.3537 | |
| 112 | V | B | 0.0000 | |
| 113 | K | B | -1.5522 | |
| 114 | F | B | -1.6987 | |
| 115 | E | B | -2.6090 | |
| 116 | G | B | -2.2096 | |
| 117 | D | B | -2.4693 | |
| 118 | T | B | -1.6734 | |
| 119 | L | B | 0.0000 | |
| 120 | V | B | 0.0000 | |
| 121 | N | B | 0.0000 | |
| 122 | R | B | -3.2942 | |
| 123 | I | B | 0.0000 | |
| 124 | E | B | -4.2509 | |
| 125 | L | B | 0.0000 | |
| 126 | K | B | -2.7616 | |
| 127 | G | B | 0.0000 | |
| 128 | I | B | -1.1841 | |
| 129 | D | B | -2.6499 | |
| 130 | F | B | 0.0000 | |
| 131 | K | B | -3.9187 | |
| 132 | E | B | -3.9485 | |
| 133 | D | B | -3.5502 | |
| 134 | G | B | -2.7997 | |
| 135 | N | B | -2.1902 | |
| 136 | I | B | 0.0000 | |
| 137 | L | B | -1.9166 | |
| 138 | G | B | -2.2698 | |
| 139 | H | B | -2.0647 | |
| 140 | K | B | -2.2587 | |
| 141 | L | B | 0.0000 | |
| 142 | E | B | -1.2259 | |
| 143 | Y | B | -0.4015 | |
| 144 | N | B | 0.0000 | |
| 145 | Y | B | 0.0000 | |
| 146 | N | B | 0.0000 | |
| 147 | S | B | 0.0000 | |
| 148 | H | B | -0.5732 | |
| 149 | N | B | -0.3221 | |
| 150 | V | B | 0.0000 | |
| 151 | Y | B | -0.0512 | |
| 152 | I | B | 0.0000 | |
| 153 | M | B | 0.0000 | |
| 154 | A | B | -1.5884 | |
| 155 | D | B | -2.1511 | |
| 156 | K | B | -3.0988 | |
| 157 | Q | B | -3.1809 | |
| 158 | K | B | -3.0790 | |
| 159 | N | B | -2.6270 | |
| 160 | G | B | 0.0000 | |
| 161 | I | B | 0.0000 | |
| 162 | K | B | -0.8916 | |
| 163 | V | B | 0.0000 | |
| 164 | N | B | 0.0000 | |
| 165 | F | B | 0.0000 | |
| 166 | K | B | -0.8878 | |
| 167 | I | B | 0.0000 | |
| 168 | R | B | -1.3317 | |
| 169 | H | B | 0.0000 | |
| 170 | N | B | 0.0000 | |
| 171 | I | B | 0.0000 | |
| 172 | E | B | -3.0973 | |
| 173 | D | B | -3.0546 | |
| 174 | G | B | -1.9267 | |
| 175 | S | B | -0.8890 | |
| 176 | V | B | 0.0531 | |
| 177 | H | B | 0.0000 | |
| 178 | L | B | -0.7191 | |
| 179 | A | B | 0.0000 | |
| 180 | D | B | -0.7465 | |
| 181 | H | B | 0.0000 | |
| 182 | Y | B | 0.0000 | |
| 183 | Q | B | 0.0000 | |
| 184 | Q | B | -1.1228 | |
| 185 | N | B | 0.0000 | |
| 186 | T | B | -0.7091 | |
| 187 | P | B | -0.7859 | |
| 188 | I | B | -0.3153 | |
| 189 | G | B | -1.2498 | |
| 190 | D | B | -2.2290 | |
| 191 | G | B | -1.4676 | |
| 192 | P | B | -0.7710 | |
| 193 | V | B | -0.1871 | |
| 194 | L | B | -0.1182 | |
| 195 | L | B | -0.3635 | |
| 196 | P | B | 0.0000 | |
| 197 | D | B | -2.1237 | |
| 198 | N | B | -1.4572 | |
| 199 | H | B | 0.0000 | |
| 200 | Y | B | -0.0606 | |
| 201 | L | B | 0.0000 | |
| 202 | S | B | -0.0692 | |
| 203 | T | B | -0.1010 | |
| 204 | Q | B | 0.0000 | |
| 205 | S | B | 0.0000 | |
| 206 | A | B | 0.0000 | |
| 207 | L | B | 0.0000 | |
| 208 | S | B | 0.0000 | |
| 209 | K | B | -1.2567 | |
| 210 | D | B | -1.4606 | |
| 211 | P | B | -1.4769 | |
| 212 | N | B | -2.2531 | |
| 213 | E | B | -2.5728 | |
| 214 | K | B | -3.0957 | |
| 215 | R | B | -3.2791 | |
| 216 | D | B | -2.2350 | |
| 217 | H | B | -1.4579 | |
| 218 | M | B | 0.0000 | |
| 219 | V | B | -0.4990 | |
| 220 | L | B | 0.0000 | |
| 221 | L | B | 0.0000 | |
| 222 | E | B | -0.3415 | |
| 223 | F | B | -0.2467 | |
| 224 | V | B | 0.0000 | |
| 225 | T | B | -0.1741 | |
| 226 | A | B | 0.0000 | |
| 227 | A | B | -0.2155 | |
| 228 | G | B | -0.5933 | |
| 229 | I | B | -0.6225 | |
| 230 | T | B | -0.7404 | |
| 231 | H | B | -1.0777 | |
| 1 | D | C | -2.2246 | |
| 2 | V | C | -1.1898 | |
| 3 | Q | C | -1.4764 | |
| 4 | L | C | 0.0000 | |
| 5 | V | C | 0.7890 | |
| 6 | E | C | 0.0000 | |
| 7 | S | C | -0.1268 | |
| 8 | G | C | -0.3962 | |
| 9 | G | C | 0.0000 | |
| 10 | G | C | 0.0000 | |
| 11 | L | C | 0.0000 | |
| 12 | V | C | 0.0000 | |
| 13 | Q | C | -1.3486 | |
| 14 | P | C | -1.7097 | |
| 15 | G | C | -1.4552 | |
| 16 | G | C | -1.1649 | |
| 17 | S | C | -1.2362 | |
| 18 | L | C | 0.0000 | |
| 19 | R | C | -0.6797 | |
| 20 | L | C | 0.0000 | |
| 21 | S | C | -0.2877 | |
| 22 | C | C | 0.0000 | |
| 23 | E | C | -1.2177 | |
| 24 | A | C | 0.0000 | |
| 25 | S | C | -1.2616 | |
| 26 | G | C | -1.2257 | |
| 27 | G | C | -0.8161 | |
| 28 | A | C | 0.3595 | |
| 29 | F | C | 1.4303 | |
| 30 | S | C | 0.3217 | |
| 31 | T | C | 0.0000 | |
| 32 | V | C | 0.0968 | |
| 33 | A | C | 0.0000 | |
| 34 | M | C | 0.0000 | |
| 35 | G | C | 0.0000 | |
| 36 | W | C | 0.0000 | |
| 37 | F | C | 0.0000 | |
| 38 | R | C | -1.2218 | |
| 39 | Q | C | -1.9053 | |
| 40 | A | C | -1.8156 | |
| 41 | P | C | -1.4145 | |
| 42 | G | C | -1.9506 | |
| 43 | K | C | -3.3374 | |
| 44 | E | C | -3.6048 | |
| 45 | R | C | -2.8747 | |
| 46 | E | C | -2.2185 | |
| 47 | F | C | -1.1455 | |
| 48 | V | C | 0.0000 | |
| 49 | G | C | 0.0000 | |
| 50 | A | C | 0.0000 | |
| 51 | I | C | 0.0000 | |
| 52 | T | C | 0.0000 | |
| 53 | W | C | -0.0733 | |
| 54 | T | C | 0.0490 | |
| 55 | A | C | 0.0077 | |
| 56 | G | C | -0.1934 | |
| 57 | S | C | -0.0616 | |
| 58 | T | C | 0.1665 | |
| 59 | Y | C | -0.1343 | |
| 60 | Y | C | -0.5057 | |
| 61 | A | C | -1.1942 | |
| 62 | D | C | -2.2863 | |
| 63 | S | C | -1.5581 | |
| 64 | A | C | 0.0000 | |
| 65 | K | C | -2.4631 | |
| 66 | G | C | -1.8711 | |
| 67 | R | C | -1.6540 | |
| 68 | F | C | 0.0000 | |
| 69 | T | C | -0.7955 | |
| 70 | I | C | 0.0000 | |
| 71 | S | C | -0.8595 | |
| 72 | R | C | -1.8307 | |
| 73 | D | C | -2.2278 | |
| 74 | N | C | -2.3064 | |
| 75 | A | C | -1.6164 | |
| 76 | K | C | -2.1617 | |
| 77 | N | C | -1.8258 | |
| 78 | T | C | 0.0000 | |
| 79 | V | C | 0.0000 | |
| 80 | H | C | 0.0000 | |
| 81 | L | C | 0.0000 | |
| 82 | Q | C | -0.8569 | |
| 83 | M | C | 0.0000 | |
| 84 | N | C | -1.9859 | |
| 85 | S | C | -1.5361 | |
| 86 | L | C | 0.0000 | |
| 87 | K | C | -2.5463 | |
| 88 | P | C | -2.0434 | |
| 89 | E | C | -2.3668 | |
| 90 | D | C | 0.0000 | |
| 91 | T | C | -1.0859 | |
| 92 | A | C | 0.0000 | |
| 93 | V | C | -0.1554 | |
| 94 | Y | C | 0.0000 | |
| 95 | Y | C | -0.1698 | |
| 96 | C | C | 0.0000 | |
| 97 | A | C | 0.0000 | |
| 98 | Q | C | 0.0000 | |
| 99 | R | C | -0.2779 | |
| 100 | V | C | -0.2739 | |
| 101 | R | C | -1.5311 | |
| 102 | G | C | -0.5703 | |
| 103 | F | C | 0.6827 | |
| 104 | F | C | 1.9249 | |
| 105 | G | C | 0.3150 | |
| 106 | P | C | -0.3957 | |
| 107 | L | C | 0.0000 | |
| 108 | R | C | -1.8695 | |
| 109 | T | C | -0.9961 | |
| 110 | T | C | -0.8636 | |
| 111 | P | C | -0.6581 | |
| 112 | S | C | -0.4810 | |
| 113 | W | C | -0.6473 | |
| 114 | Y | C | 0.0000 | |
| 115 | E | C | -0.3361 | |
| 116 | Y | C | 0.2970 | |
| 117 | W | C | 0.2246 | |
| 118 | G | C | -0.2461 | |
| 119 | Q | C | -1.0422 | |
| 120 | G | C | 0.0000 | |
| 121 | T | C | 0.0000 | |
| 122 | Q | C | -0.7597 | |
| 123 | V | C | 0.0000 | |
| 124 | T | C | -0.7176 | |
| 125 | V | C | 0.0000 | |
| 126 | S | C | -1.1083 | |
| 127 | G | C | -0.9873 | |
| 1 | D | D | -1.9162 | |
| 2 | V | D | -1.0257 | |
| 3 | Q | D | -1.5280 | |
| 4 | L | D | 0.0000 | |
| 5 | V | D | 0.1681 | |
| 6 | E | D | -0.3380 | |
| 7 | S | D | -0.3817 | |
| 8 | G | D | 0.0000 | |
| 9 | G | D | 0.0000 | |
| 10 | G | D | 0.0000 | |
| 11 | L | D | 0.0000 | |
| 12 | V | D | 0.0000 | |
| 13 | Q | D | -1.2330 | |
| 14 | P | D | -1.4742 | |
| 15 | G | D | -1.3468 | |
| 16 | G | D | -1.0571 | |
| 17 | S | D | -1.2138 | |
| 18 | L | D | 0.0000 | |
| 19 | R | D | -0.6992 | |
| 20 | L | D | 0.0000 | |
| 21 | S | D | -0.4862 | |
| 22 | C | D | 0.0000 | |
| 23 | E | D | -1.7918 | |
| 24 | A | D | 0.0000 | |
| 25 | S | D | -1.3789 | |
| 26 | G | D | -1.3187 | |
| 27 | G | D | -0.7183 | |
| 28 | A | D | 0.4355 | |
| 29 | F | D | 1.3731 | |
| 30 | S | D | 0.3681 | |
| 31 | T | D | 0.0000 | |
| 32 | V | D | 0.0737 | |
| 33 | A | D | 0.0000 | |
| 34 | M | D | 0.0000 | |
| 35 | G | D | 0.0000 | |
| 36 | W | D | 0.0000 | |
| 37 | F | D | 0.0000 | |
| 38 | R | D | -1.2501 | |
| 39 | Q | D | -1.9219 | |
| 40 | A | D | -1.8447 | |
| 41 | P | D | -1.4232 | |
| 42 | G | D | -1.9506 | |
| 43 | K | D | -3.3365 | |
| 44 | E | D | -3.6021 | |
| 45 | R | D | -2.8737 | |
| 46 | E | D | -2.2106 | |
| 47 | F | D | -1.1425 | |
| 48 | V | D | 0.0000 | |
| 49 | G | D | 0.0000 | |
| 50 | A | D | 0.0000 | |
| 51 | I | D | 0.0000 | |
| 52 | T | D | 0.0000 | |
| 53 | W | D | 0.0000 | |
| 54 | T | D | -0.0676 | |
| 55 | A | D | -0.1074 | |
| 56 | G | D | -0.4235 | |
| 57 | S | D | -0.1482 | |
| 58 | T | D | 0.1356 | |
| 59 | Y | D | -0.1222 | |
| 60 | Y | D | -0.4938 | |
| 61 | A | D | -1.1920 | |
| 62 | D | D | -2.2856 | |
| 63 | S | D | -1.5553 | |
| 64 | A | D | 0.0000 | |
| 65 | K | D | -2.4487 | |
| 66 | G | D | -1.8527 | |
| 67 | R | D | -1.6491 | |
| 68 | F | D | 0.0000 | |
| 69 | T | D | -0.8138 | |
| 70 | I | D | 0.0000 | |
| 71 | S | D | -1.1152 | |
| 72 | R | D | -2.4839 | |
| 73 | D | D | -3.2677 | |
| 76 | K | D | -2.9032 | |
| 77 | N | D | -2.2804 | |
| 78 | T | D | -2.0932 | |
| 79 | V | D | 0.0000 | |
| 80 | H | D | 0.0000 | |
| 81 | L | D | 0.0000 | |
| 82 | Q | D | -1.0059 | |
| 83 | M | D | 0.0000 | |
| 84 | N | D | -1.9768 | |
| 85 | S | D | -1.4536 | |
| 86 | L | D | 0.0000 | |
| 87 | K | D | -2.3229 | |
| 88 | P | D | -1.9444 | |
| 89 | E | D | -2.3172 | |
| 90 | D | D | 0.0000 | |
| 91 | T | D | -1.0864 | |
| 92 | A | D | 0.0000 | |
| 93 | V | D | -0.2611 | |
| 94 | Y | D | 0.0000 | |
| 95 | Y | D | -0.2660 | |
| 96 | C | D | 0.0000 | |
| 97 | A | D | 0.0000 | |
| 98 | Q | D | 0.0000 | |
| 99 | R | D | -0.4089 | |
| 100 | V | D | 0.0000 | |
| 101 | R | D | -1.2119 | |
| 102 | G | D | -0.3864 | |
| 103 | F | D | 0.7620 | |
| 104 | F | D | 1.9345 | |
| 105 | G | D | 0.3319 | |
| 106 | P | D | -0.3838 | |
| 107 | L | D | 0.0000 | |
| 108 | R | D | -1.8891 | |
| 109 | T | D | -1.0161 | |
| 110 | T | D | -0.8971 | |
| 111 | P | D | -0.7441 | |
| 112 | S | D | -0.6066 | |
| 113 | W | D | 0.0000 | |
| 114 | Y | D | 0.0000 | |
| 115 | E | D | -0.6491 | |
| 116 | Y | D | 0.0482 | |
| 117 | W | D | 0.0684 | |
| 118 | G | D | 0.0000 | |
| 119 | Q | D | -1.1600 | |
| 120 | G | D | 0.0000 | |
| 121 | T | D | 0.0000 | |
| 122 | Q | D | -0.9263 | |
| 123 | V | D | 0.0000 | |
| 124 | T | D | -0.7187 | |
| 125 | V | D | 0.0000 | |
| 126 | S | D | -1.1598 | |
| 127 | G | D | -1.2145 | |
| 128 | L | D | -1.4712 | |
| 129 | E | D | -2.1618 |