| Chain sequence(s) |
A: NMAIIKEFMRFKVHMEGSVNGHEFEIEGEGEGRPYEGTQTAKLKKVTKGGPLPFAWDILSPQFAAASKAYVKHPADIPDYLKLSFPEGFKWERVMNFEDGGVVTVTQDSSLQDGEFIYKVKLRGTNFPSDGPVMQKKTMMGWEASSERMYPEDGALKGEIKQRLKLKDGGHHYDAEVKTTYKAKKPVQLPGAYNVNIKLLDITSHNEDYTIVEQYERAEGRHST
C: QVQLVESGGGLVQQAGGSLRLSCVASGSAPSFFAMAWYRQSPGNERELVAALSSLGSTNYADSVKGRFTISMDNAKNTVYLQMNNNVNAEDTAVYYCAAGDFHSCYARKSCDYWGQGTQVTVS B: NMAIIKEFMRFKVHMEGSVNGHEEFEIEGEGEGRPYEGTQTAKLKVTKGGPLPFAWDILSPQFAAASKAYVKHPADIPDYLKLSFPEGFKWERVMNFEDGGVVTVTQDSSLQDGEFIYKVKLRGTNFPSDGPVMQKKKTMGWEASSERMYPEDGALKGEIKQRRLKLKDGGHHYDAEVKTTYKAKKPVQLPGAYNVNIKKLLDITSHNEDYTIVEQYERAEGRHST D: QVQLVESGGGLVQAGGSLRLSCVASGSAPSFFAMAWYRQSPGNERELVAALSSLGSTNYADSVKGRFTISMDNAKNTVYLQMNNNVNAEDTAVYYCAAGDFHSCYARKSCDYWGQGTQVTVS 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 (00:14:58)
[INFO] Main: Simulation completed successfully. (00:15:04)
|
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 | |
| 4 | N | A | -0.5339 | |
| 5 | M | A | 0.1798 | |
| 6 | A | A | 0.0378 | |
| 7 | I | A | -0.0102 | |
| 8 | I | A | 0.0000 | |
| 9 | K | A | -1.4416 | |
| 10 | E | A | -2.0467 | |
| 11 | F | A | -1.1338 | |
| 12 | M | A | 0.0000 | |
| 13 | R | A | -3.0571 | |
| 14 | F | A | 0.0000 | |
| 15 | K | A | -3.3042 | |
| 16 | V | A | 0.0000 | |
| 17 | H | A | -2.3643 | |
| 18 | M | A | 0.0000 | |
| 19 | E | A | -3.3786 | |
| 20 | G | A | -2.6600 | |
| 21 | S | A | -2.5610 | |
| 22 | V | A | 0.0000 | |
| 23 | N | A | -1.9325 | |
| 24 | G | A | -1.8900 | |
| 25 | H | A | -1.9309 | |
| 26 | E | A | -3.2144 | |
| 27 | F | A | 0.0000 | |
| 28 | E | A | -2.9677 | |
| 29 | I | A | 0.0000 | |
| 30 | E | A | -3.0182 | |
| 31 | G | A | 0.0000 | |
| 32 | E | A | -3.7718 | |
| 33 | G | A | 0.0000 | |
| 34 | E | A | -2.5504 | |
| 35 | G | A | 0.0000 | |
| 36 | R | A | -2.7080 | |
| 37 | P | A | 0.0000 | |
| 38 | Y | A | -1.8223 | |
| 39 | E | A | -3.1374 | |
| 40 | G | A | 0.0000 | |
| 41 | T | A | -2.0881 | |
| 42 | Q | A | 0.0000 | |
| 43 | T | A | -1.5185 | |
| 44 | A | A | 0.0000 | |
| 45 | K | A | -2.5717 | |
| 46 | L | A | 0.0000 | |
| 47 | K | A | -1.9136 | |
| 48 | V | A | 0.0000 | |
| 49 | T | A | -1.8018 | |
| 50 | K | A | -2.9527 | |
| 51 | G | A | -2.0168 | |
| 52 | G | A | -1.6341 | |
| 53 | P | A | -1.1283 | |
| 54 | L | A | 0.0000 | |
| 55 | P | A | -0.9015 | |
| 56 | F | A | 0.0000 | |
| 57 | A | A | 0.0000 | |
| 58 | W | A | 0.0000 | |
| 59 | D | A | 0.0000 | |
| 60 | I | A | 0.0000 | |
| 61 | L | A | 0.0000 | |
| 62 | S | A | 0.0000 | |
| 63 | P | A | -0.2139 | |
| 64 | Q | A | 0.0000 | |
| 65 | F | A | 0.0000 | |
| 69 | S | A | -0.1653 | |
| 70 | K | A | -0.3001 | |
| 71 | A | A | 0.0000 | |
| 72 | Y | A | 0.0000 | |
| 73 | V | A | 0.0000 | |
| 74 | K | A | -2.7234 | |
| 75 | H | A | -1.8335 | |
| 76 | P | A | -1.4379 | |
| 77 | A | A | -1.0084 | |
| 78 | D | A | -2.0602 | |
| 79 | I | A | 0.0000 | |
| 80 | P | A | -0.8150 | |
| 81 | D | A | -0.5927 | |
| 82 | Y | A | 0.0000 | |
| 83 | L | A | 0.0000 | |
| 84 | K | A | 0.0000 | |
| 85 | L | A | 0.0038 | |
| 86 | S | A | 0.0000 | |
| 87 | F | A | 0.0000 | |
| 88 | P | A | -1.0137 | |
| 89 | E | A | -1.3866 | |
| 90 | G | A | 0.0000 | |
| 91 | F | A | 0.0000 | |
| 92 | K | A | -2.1452 | |
| 93 | W | A | 0.0000 | |
| 94 | E | A | -2.1295 | |
| 95 | R | A | 0.0000 | |
| 96 | V | A | 0.0220 | |
| 97 | M | A | 0.0000 | |
| 98 | N | A | -2.1648 | |
| 99 | F | A | 0.0000 | |
| 100 | E | A | -2.8941 | |
| 101 | D | A | -2.1355 | |
| 102 | G | A | -1.5870 | |
| 103 | G | A | 0.0000 | |
| 104 | V | A | -0.8594 | |
| 105 | V | A | 0.0000 | |
| 106 | T | A | -0.7756 | |
| 107 | V | A | 0.0000 | |
| 108 | T | A | -1.8342 | |
| 109 | Q | A | 0.0000 | |
| 110 | D | A | -2.4680 | |
| 111 | S | A | 0.0000 | |
| 112 | S | A | -0.9739 | |
| 113 | L | A | -0.3073 | |
| 114 | Q | A | -0.7188 | |
| 115 | D | A | -0.8372 | |
| 116 | G | A | -0.9367 | |
| 117 | E | A | -1.5187 | |
| 118 | F | A | 0.0000 | |
| 119 | I | A | -1.3721 | |
| 120 | Y | A | 0.0000 | |
| 121 | K | A | -2.5764 | |
| 122 | V | A | 0.0000 | |
| 123 | K | A | -3.2564 | |
| 124 | L | A | 0.0000 | |
| 125 | R | A | -2.6417 | |
| 126 | G | A | 0.0000 | |
| 127 | T | A | -1.3744 | |
| 128 | N | A | -1.5896 | |
| 129 | F | A | 0.0000 | |
| 130 | P | A | -1.5477 | |
| 131 | S | A | -1.6275 | |
| 132 | D | A | -2.3994 | |
| 133 | G | A | -1.8166 | |
| 134 | P | A | -1.9159 | |
| 135 | V | A | 0.0000 | |
| 136 | M | A | -1.6539 | |
| 137 | Q | A | -2.6027 | |
| 138 | K | A | -2.6676 | |
| 139 | K | A | -2.6458 | |
| 140 | T | A | -1.8276 | |
| 141 | M | A | -1.0614 | |
| 142 | G | A | -0.8668 | |
| 143 | W | A | 0.0000 | |
| 144 | E | A | -1.8394 | |
| 145 | A | A | -1.2335 | |
| 146 | S | A | -1.1829 | |
| 147 | S | A | -1.4266 | |
| 148 | E | A | 0.0000 | |
| 149 | R | A | -1.9880 | |
| 150 | M | A | 0.0000 | |
| 151 | Y | A | -0.8784 | |
| 152 | P | A | -1.4936 | |
| 153 | E | A | -2.9129 | |
| 154 | D | A | -3.0461 | |
| 155 | G | A | -2.1726 | |
| 156 | A | A | 0.0000 | |
| 157 | L | A | 0.0000 | |
| 158 | K | A | -1.8300 | |
| 159 | G | A | 0.0000 | |
| 160 | E | A | -2.1347 | |
| 161 | I | A | 0.0000 | |
| 162 | K | A | -3.1924 | |
| 163 | Q | A | 0.0000 | |
| 164 | R | A | -2.2846 | |
| 165 | L | A | 0.0000 | |
| 166 | K | A | -2.2670 | |
| 167 | L | A | -2.4251 | |
| 168 | K | A | -3.2761 | |
| 169 | D | A | -3.1419 | |
| 170 | G | A | -2.3473 | |
| 171 | G | A | -1.8413 | |
| 172 | H | A | -2.0871 | |
| 173 | Y | A | 0.0000 | |
| 174 | D | A | -2.5672 | |
| 175 | A | A | 0.0000 | |
| 176 | E | A | -3.4126 | |
| 177 | V | A | 0.0000 | |
| 178 | K | A | -2.2884 | |
| 179 | T | A | 0.0000 | |
| 180 | T | A | -1.5599 | |
| 181 | Y | A | 0.0000 | |
| 182 | K | A | -2.0116 | |
| 183 | A | A | 0.0000 | |
| 184 | K | A | -1.9573 | |
| 185 | K | A | -1.3204 | |
| 186 | P | A | -0.8501 | |
| 187 | V | A | -0.5503 | |
| 188 | Q | A | -1.0108 | |
| 189 | L | A | -0.6936 | |
| 190 | P | A | 0.0000 | |
| 191 | G | A | -0.8110 | |
| 192 | A | A | -0.8808 | |
| 193 | Y | A | 0.0000 | |
| 194 | N | A | -1.7108 | |
| 195 | V | A | 0.0000 | |
| 196 | N | A | -1.8707 | |
| 197 | I | A | -1.4801 | |
| 198 | K | A | -1.7591 | |
| 199 | L | A | -1.0926 | |
| 200 | D | A | -1.3203 | |
| 201 | I | A | -0.2366 | |
| 202 | T | A | -0.5819 | |
| 203 | S | A | -0.9148 | |
| 204 | H | A | -1.3390 | |
| 205 | N | A | -1.6737 | |
| 206 | E | A | -2.4869 | |
| 207 | D | A | -1.9540 | |
| 208 | Y | A | -1.0106 | |
| 209 | T | A | -0.9071 | |
| 210 | I | A | -0.7583 | |
| 211 | V | A | 0.0000 | |
| 212 | E | A | -1.5195 | |
| 213 | Q | A | 0.0000 | |
| 214 | Y | A | -0.8342 | |
| 215 | E | A | -1.2840 | |
| 216 | R | A | -2.9539 | |
| 217 | A | A | 0.0000 | |
| 218 | E | A | -3.2451 | |
| 219 | G | A | 0.0000 | |
| 220 | R | A | -2.3083 | |
| 221 | H | A | -1.8191 | |
| 222 | S | A | -1.1360 | |
| 223 | T | A | -0.5217 | |
| 4 | N | B | -0.9653 | |
| 5 | M | B | 0.5977 | |
| 6 | A | B | 0.4137 | |
| 7 | I | B | 1.1277 | |
| 8 | I | B | 0.0000 | |
| 9 | K | B | -1.8567 | |
| 10 | E | B | -2.0990 | |
| 11 | F | B | -1.0348 | |
| 12 | M | B | 0.0000 | |
| 13 | R | B | -2.8517 | |
| 14 | F | B | 0.0000 | |
| 15 | K | B | -2.7145 | |
| 16 | V | B | 0.0000 | |
| 17 | H | B | -2.0075 | |
| 18 | M | B | 0.0000 | |
| 19 | E | B | -2.4914 | |
| 20 | G | B | 0.0000 | |
| 21 | S | B | -2.2416 | |
| 22 | V | B | 0.0000 | |
| 23 | N | B | -1.7442 | |
| 24 | G | B | -1.7538 | |
| 25 | H | B | -1.7084 | |
| 26 | E | B | -2.6304 | |
| 27 | F | B | 0.0000 | |
| 28 | E | B | -1.7198 | |
| 29 | I | B | 0.0000 | |
| 30 | E | B | -2.2836 | |
| 31 | G | B | 0.0000 | |
| 32 | E | B | -3.0855 | |
| 33 | G | B | 0.0000 | |
| 34 | E | B | -2.2060 | |
| 35 | G | B | 0.0000 | |
| 36 | R | B | -1.9040 | |
| 37 | P | B | 0.0000 | |
| 38 | Y | B | -1.0062 | |
| 39 | E | B | -1.8071 | |
| 40 | G | B | 0.0000 | |
| 41 | T | B | -1.5114 | |
| 42 | Q | B | 0.0000 | |
| 43 | T | B | -1.2995 | |
| 44 | A | B | 0.0000 | |
| 45 | K | B | -2.1515 | |
| 46 | L | B | 0.0000 | |
| 47 | K | B | -1.4670 | |
| 48 | V | B | 0.0000 | |
| 49 | T | B | -0.9409 | |
| 50 | K | B | -1.4879 | |
| 51 | G | B | 0.0000 | |
| 52 | G | B | 0.0000 | |
| 53 | P | B | -0.5611 | |
| 54 | L | B | 0.0000 | |
| 55 | P | B | -0.5712 | |
| 56 | F | B | 0.0000 | |
| 57 | A | B | 0.0000 | |
| 58 | W | B | 0.0000 | |
| 59 | D | B | 0.0000 | |
| 60 | I | B | 0.0000 | |
| 61 | L | B | 0.0000 | |
| 62 | S | B | 0.0000 | |
| 63 | P | B | -0.2562 | |
| 64 | Q | B | 0.0000 | |
| 65 | F | B | 0.0000 | |
| 69 | S | B | -0.1651 | |
| 70 | K | B | -0.3160 | |
| 71 | A | B | 0.0000 | |
| 72 | Y | B | 0.0000 | |
| 73 | V | B | 0.0000 | |
| 74 | K | B | -2.1074 | |
| 75 | H | B | -1.7404 | |
| 76 | P | B | -1.5436 | |
| 77 | A | B | -1.0529 | |
| 78 | D | B | -2.0203 | |
| 79 | I | B | 0.0000 | |
| 80 | P | B | -0.7436 | |
| 81 | D | B | -0.4365 | |
| 82 | Y | B | 0.0000 | |
| 83 | L | B | 0.0000 | |
| 84 | K | B | 0.0000 | |
| 85 | L | B | 0.8540 | |
| 86 | S | B | 0.0000 | |
| 87 | F | B | 0.0000 | |
| 88 | P | B | -0.6202 | |
| 89 | E | B | -1.6569 | |
| 90 | G | B | 0.0000 | |
| 91 | F | B | 0.0000 | |
| 92 | K | B | -2.1880 | |
| 93 | W | B | 0.0000 | |
| 94 | E | B | -2.2971 | |
| 95 | R | B | 0.0000 | |
| 96 | V | B | -0.0941 | |
| 97 | M | B | 0.0000 | |
| 98 | N | B | -2.2099 | |
| 99 | F | B | 0.0000 | |
| 100 | E | B | -2.8598 | |
| 101 | D | B | -2.1029 | |
| 102 | G | B | -1.5819 | |
| 103 | G | B | 0.0000 | |
| 104 | V | B | -0.8451 | |
| 105 | V | B | 0.0000 | |
| 106 | T | B | -0.8310 | |
| 107 | V | B | 0.0000 | |
| 108 | T | B | -1.9074 | |
| 109 | Q | B | 0.0000 | |
| 110 | D | B | -2.0308 | |
| 111 | S | B | 0.0000 | |
| 112 | S | B | -1.2116 | |
| 113 | L | B | -1.1613 | |
| 114 | Q | B | -2.4011 | |
| 115 | D | B | -2.6348 | |
| 116 | G | B | -2.0250 | |
| 117 | E | B | -2.4766 | |
| 118 | F | B | 0.0000 | |
| 119 | I | B | -1.5069 | |
| 120 | Y | B | 0.0000 | |
| 121 | K | B | -2.5676 | |
| 122 | V | B | 0.0000 | |
| 123 | K | B | -2.9752 | |
| 124 | L | B | 0.0000 | |
| 125 | R | B | -2.4867 | |
| 126 | G | B | 0.0000 | |
| 127 | T | B | -1.2959 | |
| 128 | N | B | -1.5466 | |
| 129 | F | B | 0.0000 | |
| 130 | P | B | -1.4918 | |
| 131 | S | B | -1.5697 | |
| 132 | D | B | -2.3855 | |
| 133 | G | B | -1.6873 | |
| 134 | P | B | -1.5903 | |
| 135 | V | B | 0.0000 | |
| 136 | M | B | -1.4020 | |
| 137 | Q | B | -2.2513 | |
| 138 | K | B | -2.0613 | |
| 139 | K | B | -2.3331 | |
| 140 | T | B | -1.4328 | |
| 141 | M | B | -1.0458 | |
| 142 | G | B | 0.0000 | |
| 143 | W | B | 0.0000 | |
| 144 | E | B | -1.3511 | |
| 145 | A | B | -1.1596 | |
| 146 | S | B | -1.2385 | |
| 147 | S | B | -1.4127 | |
| 148 | E | B | 0.0000 | |
| 149 | R | B | -2.0527 | |
| 150 | M | B | 0.0000 | |
| 151 | Y | B | -0.6614 | |
| 152 | P | B | -1.1830 | |
| 153 | E | B | -2.3845 | |
| 154 | D | B | -2.7094 | |
| 155 | G | B | -1.9845 | |
| 156 | A | B | 0.0000 | |
| 157 | L | B | 0.0000 | |
| 158 | K | B | -1.6892 | |
| 159 | G | B | 0.0000 | |
| 160 | E | B | -2.4822 | |
| 161 | I | B | 0.0000 | |
| 162 | K | B | -3.3316 | |
| 163 | Q | B | 0.0000 | |
| 164 | R | B | -2.1183 | |
| 165 | L | B | 0.0000 | |
| 166 | K | B | 0.0000 | |
| 167 | L | B | -1.7472 | |
| 168 | K | B | -2.4069 | |
| 169 | D | B | -2.7262 | |
| 170 | G | B | -1.9762 | |
| 171 | G | B | -1.4634 | |
| 172 | H | B | -1.5646 | |
| 173 | Y | B | 0.0000 | |
| 174 | D | B | -2.4775 | |
| 175 | A | B | 0.0000 | |
| 176 | E | B | -3.5172 | |
| 177 | V | B | 0.0000 | |
| 178 | K | B | -2.4205 | |
| 179 | T | B | 0.0000 | |
| 180 | T | B | -1.5736 | |
| 181 | Y | B | 0.0000 | |
| 182 | K | B | -1.5842 | |
| 183 | A | B | -1.2406 | |
| 184 | K | B | -1.7152 | |
| 185 | K | B | -1.1575 | |
| 186 | P | B | -0.6818 | |
| 187 | V | B | -0.3422 | |
| 188 | Q | B | -0.9247 | |
| 189 | L | B | -0.5527 | |
| 190 | P | B | 0.0000 | |
| 191 | G | B | -0.8977 | |
| 192 | A | B | -0.7290 | |
| 193 | Y | B | 0.0000 | |
| 194 | N | B | -1.8812 | |
| 195 | V | B | 0.0000 | |
| 196 | N | B | -1.6730 | |
| 197 | I | B | -1.3203 | |
| 198 | K | B | -1.9919 | |
| 199 | L | B | -1.1841 | |
| 200 | D | B | -1.3306 | |
| 201 | I | B | 0.0000 | |
| 202 | T | B | -0.7675 | |
| 203 | S | B | -1.1864 | |
| 204 | H | B | -1.4804 | |
| 205 | N | B | -1.7182 | |
| 206 | E | B | -2.3373 | |
| 207 | D | B | -1.5661 | |
| 208 | Y | B | -0.9022 | |
| 209 | T | B | 0.0000 | |
| 210 | I | B | -0.8526 | |
| 211 | V | B | 0.0000 | |
| 212 | E | B | -1.4209 | |
| 213 | Q | B | 0.0000 | |
| 214 | Y | B | -0.8933 | |
| 215 | E | B | -1.2691 | |
| 216 | R | B | -2.3738 | |
| 217 | A | B | 0.0000 | |
| 218 | E | B | -2.4588 | |
| 219 | G | B | 0.0000 | |
| 220 | R | B | -2.8780 | |
| 221 | H | B | -2.2763 | |
| 222 | S | B | -1.2857 | |
| 223 | T | B | -0.5939 | |
| 1 | Q | C | -1.7689 | |
| 2 | V | C | -1.3971 | |
| 3 | Q | C | -1.2408 | |
| 4 | L | C | 0.0000 | |
| 5 | V | C | 0.6696 | |
| 6 | E | C | 0.0000 | |
| 7 | S | C | -0.4870 | |
| 8 | G | C | -0.9122 | |
| 9 | G | C | -0.6303 | |
| 10 | G | C | 0.0099 | |
| 11 | L | C | 1.0965 | |
| 12 | V | C | 0.0000 | |
| 13 | Q | C | -0.2717 | |
| 14 | A | C | -0.6410 | |
| 15 | G | C | -0.9748 | |
| 16 | G | C | 0.0000 | |
| 17 | S | C | 0.0000 | |
| 18 | L | C | 0.0000 | |
| 19 | R | C | -0.5212 | |
| 20 | L | C | 0.0000 | |
| 21 | S | C | 0.1529 | |
| 22 | C | C | 0.0000 | |
| 23 | V | C | 0.1990 | |
| 24 | A | C | 0.0000 | |
| 25 | S | C | -0.7802 | |
| 26 | G | C | -1.2561 | |
| 27 | S | C | -0.9544 | |
| 28 | A | C | -0.4686 | |
| 29 | P | C | -0.0440 | |
| 30 | S | C | 0.3788 | |
| 31 | F | C | 1.3616 | |
| 32 | F | C | 0.7850 | |
| 33 | A | C | 0.0000 | |
| 34 | M | C | 0.0000 | |
| 35 | A | C | 0.0000 | |
| 36 | W | C | 0.0000 | |
| 37 | Y | C | 0.0000 | |
| 38 | R | C | 0.0000 | |
| 39 | Q | C | -2.1747 | |
| 40 | S | C | -1.8613 | |
| 41 | P | C | -1.2024 | |
| 42 | G | C | -1.8030 | |
| 43 | N | C | -3.0307 | |
| 44 | E | C | -3.6191 | |
| 45 | R | C | -3.0824 | |
| 46 | E | C | -2.6046 | |
| 47 | L | C | -1.0247 | |
| 48 | V | C | 0.0000 | |
| 49 | A | C | 0.0000 | |
| 50 | A | C | 0.0000 | |
| 51 | L | C | 0.0000 | |
| 52 | S | C | 0.0000 | |
| 53 | S | C | 0.8879 | |
| 54 | L | C | 1.5213 | |
| 55 | G | C | 0.1927 | |
| 56 | S | C | -0.2590 | |
| 57 | T | C | -0.6129 | |
| 58 | N | C | -1.5619 | |
| 59 | Y | C | -1.3785 | |
| 60 | A | C | -1.6208 | |
| 61 | D | C | -2.5772 | |
| 62 | S | C | -1.8243 | |
| 63 | V | C | 0.0000 | |
| 64 | K | C | -2.7528 | |
| 65 | G | C | -1.7257 | |
| 66 | R | C | -1.2829 | |
| 67 | F | C | 0.0000 | |
| 68 | T | C | -0.6314 | |
| 69 | I | C | 0.0000 | |
| 70 | S | C | -0.2267 | |
| 71 | M | C | -0.7028 | |
| 72 | D | C | -1.5276 | |
| 73 | N | C | -2.1818 | |
| 74 | A | C | -1.7085 | |
| 75 | K | C | -2.4030 | |
| 76 | N | C | -1.8789 | |
| 77 | T | C | 0.0000 | |
| 78 | V | C | 0.0000 | |
| 79 | Y | C | 0.2108 | |
| 80 | L | C | 0.0000 | |
| 81 | Q | C | -0.3454 | |
| 82 | M | C | 0.0000 | |
| 83 | N | C | -0.9155 | |
| 84 | N | C | -0.9728 | |
| 85 | V | C | 0.0000 | |
| 86 | N | C | -1.3848 | |
| 87 | A | C | -1.2359 | |
| 88 | E | C | -2.0086 | |
| 89 | D | C | 0.0000 | |
| 90 | T | C | -0.7636 | |
| 91 | A | C | 0.0000 | |
| 92 | V | C | -0.4643 | |
| 93 | Y | C | 0.0000 | |
| 94 | Y | C | -0.2831 | |
| 95 | C | C | 0.0000 | |
| 96 | A | C | 0.0000 | |
| 97 | A | C | 0.0000 | |
| 98 | G | C | 0.0000 | |
| 99 | D | C | -0.4457 | |
| 100 | F | C | 0.1309 | |
| 101 | H | C | -1.3423 | |
| 102 | S | C | -1.8579 | |
| 103 | C | C | 0.0000 | |
| 104 | Y | C | -1.0260 | |
| 105 | A | C | -1.5203 | |
| 106 | R | C | -2.8717 | |
| 107 | K | C | -3.0646 | |
| 108 | S | C | -2.1396 | |
| 109 | C | C | -1.6757 | |
| 110 | D | C | -1.9723 | |
| 111 | Y | C | -0.8887 | |
| 112 | W | C | -0.2060 | |
| 113 | G | C | -0.2030 | |
| 114 | Q | C | -0.9962 | |
| 115 | G | C | -0.6046 | |
| 116 | T | C | -0.7903 | |
| 117 | Q | C | -0.9918 | |
| 118 | V | C | 0.0000 | |
| 119 | T | C | -0.1472 | |
| 120 | V | C | 0.0000 | |
| 121 | S | C | -0.1586 | |
| 1 | Q | D | -1.8660 | |
| 2 | V | D | 0.0000 | |
| 3 | Q | D | -1.2801 | |
| 4 | L | D | 0.0000 | |
| 5 | V | D | 0.7128 | |
| 6 | E | D | 0.0000 | |
| 7 | S | D | -0.6521 | |
| 8 | G | D | -1.1138 | |
| 9 | G | D | -0.8607 | |
| 10 | G | D | 0.0784 | |
| 11 | L | D | 0.9085 | |
| 12 | V | D | 0.0000 | |
| 13 | Q | D | -1.3931 | |
| 14 | A | D | -1.6225 | |
| 15 | G | D | -1.7741 | |
| 16 | G | D | -1.4229 | |
| 17 | S | D | -1.5796 | |
| 18 | L | D | -1.2285 | |
| 19 | R | D | -2.1004 | |
| 20 | L | D | 0.0000 | |
| 21 | S | D | -0.2269 | |
| 22 | C | D | 0.0000 | |
| 23 | V | D | 0.2384 | |
| 24 | A | D | 0.0000 | |
| 25 | S | D | -0.8182 | |
| 26 | G | D | -1.2906 | |
| 27 | S | D | -0.9840 | |
| 28 | A | D | -0.4073 | |
| 29 | P | D | 0.0841 | |
| 30 | S | D | 0.7030 | |
| 31 | F | D | 2.0438 | |
| 32 | F | D | 1.1047 | |
| 33 | A | D | 0.0000 | |
| 34 | M | D | 0.0000 | |
| 35 | A | D | 0.0000 | |
| 36 | W | D | 0.0000 | |
| 37 | Y | D | 0.0000 | |
| 38 | R | D | 0.0000 | |
| 39 | Q | D | -2.2049 | |
| 40 | S | D | -1.9024 | |
| 41 | P | D | -1.3459 | |
| 42 | G | D | -1.8257 | |
| 43 | N | D | -3.0657 | |
| 44 | E | D | -3.6350 | |
| 45 | R | D | -3.1359 | |
| 46 | E | D | -2.5155 | |
| 47 | L | D | -0.9724 | |
| 48 | V | D | 0.0000 | |
| 49 | A | D | 0.0000 | |
| 50 | A | D | 0.0000 | |
| 51 | L | D | 0.0000 | |
| 52 | S | D | 0.0000 | |
| 53 | S | D | 1.0437 | |
| 54 | L | D | 1.6172 | |
| 55 | G | D | 0.1754 | |
| 56 | S | D | -0.2284 | |
| 57 | T | D | -0.5961 | |
| 58 | N | D | -1.5432 | |
| 59 | Y | D | -1.3740 | |
| 60 | A | D | -1.5912 | |
| 61 | D | D | -2.5736 | |
| 62 | S | D | -1.8509 | |
| 63 | V | D | 0.0000 | |
| 64 | K | D | -2.7754 | |
| 65 | G | D | -1.9238 | |
| 66 | R | D | -1.7088 | |
| 67 | F | D | 0.0000 | |
| 68 | T | D | -0.9277 | |
| 69 | I | D | 0.0000 | |
| 70 | S | D | -0.2661 | |
| 71 | M | D | -0.8578 | |
| 72 | D | D | -1.6467 | |
| 73 | N | D | -2.3523 | |
| 74 | A | D | -1.8553 | |
| 75 | K | D | -2.6005 | |
| 76 | N | D | -2.2978 | |
| 77 | T | D | 0.0000 | |
| 78 | V | D | 0.0000 | |
| 79 | Y | D | -0.1967 | |
| 80 | L | D | 0.0000 | |
| 81 | Q | D | -1.1468 | |
| 82 | M | D | 0.0000 | |
| 83 | N | D | -1.9653 | |
| 84 | N | D | -2.3214 | |
| 85 | V | D | 0.0000 | |
| 86 | N | D | -2.3837 | |
| 87 | A | D | -1.6173 | |
| 88 | E | D | -2.1795 | |
| 89 | D | D | 0.0000 | |
| 90 | T | D | -0.8418 | |
| 91 | A | D | 0.0000 | |
| 92 | V | D | -0.3955 | |
| 93 | Y | D | 0.0000 | |
| 94 | Y | D | -0.2820 | |
| 95 | C | D | 0.0000 | |
| 96 | A | D | 0.0000 | |
| 97 | A | D | 0.0000 | |
| 98 | G | D | 0.0000 | |
| 99 | D | D | -0.1979 | |
| 100 | F | D | 0.3786 | |
| 101 | H | D | -1.1936 | |
| 102 | S | D | -1.8203 | |
| 103 | C | D | 0.0000 | |
| 104 | Y | D | -0.9236 | |
| 105 | A | D | -1.4975 | |
| 106 | R | D | -2.8498 | |
| 107 | K | D | -3.0311 | |
| 108 | S | D | -2.1165 | |
| 109 | C | D | -1.6651 | |
| 110 | D | D | -1.9981 | |
| 111 | Y | D | -0.9072 | |
| 112 | W | D | -0.2432 | |
| 113 | G | D | -0.2251 | |
| 114 | Q | D | -0.9935 | |
| 115 | G | D | -0.6157 | |
| 116 | T | D | -0.7601 | |
| 117 | Q | D | -0.9541 | |
| 118 | V | D | 0.0000 | |
| 119 | T | D | -0.3147 | |
| 120 | V | D | 0.0000 | |
| 121 | S | D | -0.5684 |
ALA alanine
ARG arginine
ASN asparagine
ASP aspartic acid
CYS cysteine
GLN glutamine
GLU glutamic acid
GLY glycine
HIS histidine
ILE isoleucine
LEU leucine
LYS lysine
MET methionine
PHE phenylalanine
PRO proline
SER serine
THR threonine
TRP tryptophan
TYR tyrosine
VAL valine