| Chain sequence(s) |
A: DIQMTQQTTTTSSLSASLGDRVTISCRASQDISSNYLNWYQQKPDGTTVKLLIYYYTSRRLLHSGVTSRFFSGSGSGTDYSLTISNLEEQEDIATYFCQQGNTLPWTFGGGTKVEIKRADAAPTVSIFPPSSSEEQLTSGGASVVCFLNNFYPKDINNVKWKIDGSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEEYERHNSYTCCEATHKTSTSSPIVKSSFNRNE
C: DIQQMTQTTSSLSASLGDRVTISCRASQDISNYLNWYQQKPDGTVKKLLIYYTSRLHSGVTSRFSGSGSGTDYSSLTISNLEEQEDIATYFCQQGNTLPWTFGGGTKVEIKRADAAPTVSIFPPSSEQLTSGGASVVCFLNNFYPKDDINVKWKIDGSERRQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERHNSSYTCCEEATTHKTSSTSSPIVKSSFNRNE B: EVMMLVESGGVLVKPGGSLKLSSCAASGFTFSRYAMSWVRQTPEKRLEWVATISSGGSYSSYYPDSVKGRFTISRDNVKNTTLYLQMSSLRSEDTAMYYCCARDSGGFAYWGQGTLVTVSAAKTTPPSVYPLAPGSSVTLGCCLVKGYFPEPVTVTWNSGSLSSGVHTFPAVLQSDLYTLSSSVTVPSSTWPSQSSVTTCCNVAHPASSTKVDKKIEP D: EVMMLVESGGVLVKPGGSLKLSSCAASGFTFSRYAMSWVRQTPEKRLEWVVATISSGGSYSSYYYPDSVKGRFTISRDNVKNTTLYLQMSSLRSEDTAMYYCCARDSGGFFAAYYWWGQGTLVTVSAAKTTPPSVYPLAPTTGSSVTLGCCLVKGYFPEPVTVTWNSGSLSSGVHTFPAVLQSDLYTLSSSVTTVPSSTWPSQSVTTCNVAHPASSTKVDKKIEP 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 (00:12:34)
[INFO] Main: Simulation completed successfully. (00:12:48)
|
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 | D | A | -2.0307 | |
| 2 | I | A | 0.0000 | |
| 3 | Q | A | -1.9945 | |
| 4 | M | A | 0.0000 | |
| 5 | T | A | -1.2348 | |
| 6 | Q | A | 0.0000 | |
| 7 | T | A | -0.5977 | |
| 8 | T | A | -0.3661 | |
| 9 | S | A | -0.5433 | |
| 10 | S | A | -0.4327 | |
| 11 | L | A | -0.2874 | |
| 12 | S | A | -0.6342 | |
| 13 | A | A | 0.0000 | |
| 14 | S | A | -0.8382 | |
| 15 | L | A | 0.0445 | |
| 16 | G | A | -0.9822 | |
| 17 | D | A | -1.8068 | |
| 18 | R | A | -2.4179 | |
| 19 | V | A | 0.0000 | |
| 20 | T | A | -0.6440 | |
| 21 | I | A | 0.0000 | |
| 22 | S | A | -0.9010 | |
| 23 | C | A | 0.0000 | |
| 24 | R | A | -2.9140 | |
| 25 | A | A | 0.0000 | |
| 26 | S | A | -2.2373 | |
| 27 | Q | A | -2.8296 | |
| 28 | D | A | -2.8338 | |
| 29 | I | A | 0.0000 | |
| 30 | S | A | -0.8687 | |
| 31 | N | A | -0.4179 | |
| 32 | Y | A | 0.4150 | |
| 33 | L | A | 0.0000 | |
| 34 | N | A | 0.0000 | |
| 35 | W | A | 0.0000 | |
| 36 | Y | A | 0.0000 | |
| 37 | Q | A | 0.0000 | |
| 38 | Q | A | 0.0000 | |
| 39 | K | A | -1.5650 | |
| 40 | P | A | -1.7529 | |
| 41 | D | A | -2.3584 | |
| 42 | G | A | -1.6034 | |
| 43 | T | A | -1.2226 | |
| 44 | V | A | 0.0000 | |
| 45 | K | A | -0.6753 | |
| 46 | L | A | 0.0000 | |
| 47 | L | A | 0.0000 | |
| 48 | I | A | 0.0000 | |
| 49 | Y | A | 0.2102 | |
| 50 | Y | A | 0.3624 | |
| 51 | T | A | 0.0000 | |
| 52 | S | A | -0.4847 | |
| 53 | R | A | -1.0485 | |
| 54 | L | A | -0.1352 | |
| 55 | H | A | -0.3750 | |
| 56 | S | A | -0.4178 | |
| 57 | G | A | -0.3976 | |
| 58 | V | A | -0.1003 | |
| 59 | T | A | -0.1521 | |
| 60 | S | A | -0.2692 | |
| 61 | R | A | -0.7570 | |
| 62 | F | A | 0.0000 | |
| 63 | S | A | -0.4669 | |
| 64 | G | A | -0.4152 | |
| 65 | S | A | -0.7392 | |
| 66 | G | A | -0.9864 | |
| 67 | S | A | -1.2049 | |
| 68 | G | A | -1.7313 | |
| 69 | T | A | -2.3187 | |
| 70 | D | A | -2.3321 | |
| 71 | Y | A | 0.0000 | |
| 72 | S | A | -0.7764 | |
| 73 | L | A | 0.0000 | |
| 74 | T | A | -0.6922 | |
| 75 | I | A | 0.0000 | |
| 76 | S | A | -1.4976 | |
| 77 | N | A | -1.5967 | |
| 78 | L | A | 0.0000 | |
| 79 | E | A | -1.2646 | |
| 80 | Q | A | -1.9563 | |
| 81 | E | A | -2.5064 | |
| 82 | D | A | 0.0000 | |
| 83 | I | A | 0.0000 | |
| 84 | A | A | 0.0000 | |
| 85 | T | A | -0.6701 | |
| 86 | Y | A | 0.0000 | |
| 87 | F | A | 0.0000 | |
| 88 | C | A | 0.0000 | |
| 89 | Q | A | 0.0000 | |
| 90 | Q | A | 0.0000 | |
| 91 | G | A | 0.2063 | |
| 92 | N | A | -0.3908 | |
| 93 | T | A | -0.1459 | |
| 94 | L | A | 0.3057 | |
| 95 | P | A | -0.2639 | |
| 96 | W | A | -0.0891 | |
| 97 | T | A | -0.4985 | |
| 98 | F | A | -0.5224 | |
| 99 | G | A | 0.0000 | |
| 100 | G | A | -1.4451 | |
| 101 | G | A | 0.0000 | |
| 102 | T | A | 0.0000 | |
| 103 | K | A | -0.8099 | |
| 104 | V | A | 0.0000 | |
| 105 | E | A | -1.1676 | |
| 106 | I | A | 0.0000 | |
| 107 | K | A | -1.5513 | |
| 108 | R | A | -1.2627 | |
| 109 | A | A | -0.9137 | |
| 110 | D | A | -1.1401 | |
| 111 | A | A | -0.5755 | |
| 112 | A | A | -0.4207 | |
| 113 | P | A | 0.0000 | |
| 114 | T | A | -0.0674 | |
| 115 | V | A | 0.0472 | |
| 116 | S | A | -0.0255 | |
| 117 | I | A | -0.0096 | |
| 118 | F | A | 0.0000 | |
| 119 | P | A | -0.2120 | |
| 120 | P | A | 0.0000 | |
| 121 | S | A | -0.8766 | |
| 122 | S | A | -1.1008 | |
| 123 | E | A | -1.9566 | |
| 124 | Q | A | 0.0000 | |
| 125 | L | A | -1.2014 | |
| 126 | T | A | -0.9272 | |
| 127 | S | A | -0.8885 | |
| 128 | G | A | -1.1627 | |
| 129 | G | A | -1.0444 | |
| 130 | A | A | 0.0000 | |
| 131 | S | A | 0.0000 | |
| 132 | V | A | 0.0000 | |
| 133 | V | A | 0.0000 | |
| 134 | C | A | 0.0000 | |
| 135 | F | A | 0.0000 | |
| 136 | L | A | 0.0000 | |
| 137 | N | A | 0.0000 | |
| 138 | N | A | -0.7288 | |
| 139 | F | A | 0.0000 | |
| 140 | Y | A | 0.0000 | |
| 141 | P | A | -1.6659 | |
| 142 | K | A | -2.1532 | |
| 143 | D | A | -2.6004 | |
| 144 | I | A | -1.6255 | |
| 145 | N | A | -1.5975 | |
| 146 | V | A | -0.6627 | |
| 147 | K | A | -1.5419 | |
| 148 | W | A | 0.0000 | |
| 149 | K | A | -2.3267 | |
| 150 | I | A | 0.0000 | |
| 151 | D | A | -2.9751 | |
| 152 | G | A | -2.1360 | |
| 153 | S | A | -2.2745 | |
| 154 | E | A | -3.1790 | |
| 155 | R | A | -2.6376 | |
| 156 | Q | A | -2.4694 | |
| 157 | N | A | -2.0764 | |
| 158 | G | A | -0.9159 | |
| 159 | V | A | -0.4059 | |
| 160 | L | A | -0.0699 | |
| 161 | N | A | 0.0684 | |
| 162 | S | A | 0.0000 | |
| 163 | W | A | 0.1193 | |
| 164 | T | A | -0.7346 | |
| 165 | D | A | -1.9586 | |
| 166 | Q | A | 0.0000 | |
| 167 | D | A | -2.0959 | |
| 168 | S | A | -2.5231 | |
| 169 | K | A | -2.8305 | |
| 170 | D | A | -2.1385 | |
| 171 | S | A | 0.0000 | |
| 172 | T | A | 0.0000 | |
| 173 | Y | A | 0.0000 | |
| 174 | S | A | 0.0000 | |
| 175 | M | A | 0.0000 | |
| 176 | S | A | 0.0000 | |
| 177 | S | A | 0.0000 | |
| 178 | T | A | 0.0000 | |
| 179 | L | A | 0.0000 | |
| 180 | T | A | -0.2764 | |
| 181 | L | A | 0.0000 | |
| 182 | T | A | -1.4646 | |
| 183 | K | A | -2.4855 | |
| 184 | D | A | -3.3751 | |
| 185 | E | A | -2.6564 | |
| 186 | Y | A | 0.0000 | |
| 187 | E | A | -3.7084 | |
| 188 | R | A | -3.7771 | |
| 189 | H | A | -3.0504 | |
| 190 | N | A | -2.7614 | |
| 191 | S | A | -2.1001 | |
| 192 | Y | A | 0.0000 | |
| 193 | T | A | -1.0684 | |
| 194 | C | A | 0.0000 | |
| 195 | E | A | -0.5707 | |
| 196 | A | A | 0.0000 | |
| 197 | T | A | -1.0779 | |
| 198 | H | A | 0.0000 | |
| 199 | K | A | -2.1555 | |
| 200 | T | A | 0.0000 | |
| 201 | S | A | -0.9887 | |
| 202 | T | A | -0.6390 | |
| 203 | S | A | -0.5216 | |
| 204 | P | A | -0.5695 | |
| 205 | I | A | 0.1177 | |
| 206 | V | A | 0.1646 | |
| 207 | K | A | -0.5081 | |
| 208 | S | A | -0.5322 | |
| 209 | F | A | -1.0333 | |
| 210 | N | A | -2.2159 | |
| 211 | R | A | -2.7164 | |
| 212 | N | A | -2.7543 | |
| 213 | E | A | -2.8358 | |
| 1 | E | B | -1.6602 | |
| 2 | V | B | -0.5066 | |
| 3 | M | B | 0.1188 | |
| 4 | L | B | 0.0000 | |
| 5 | V | B | 0.4384 | |
| 6 | E | B | 0.0000 | |
| 7 | S | B | -0.2635 | |
| 8 | G | B | -0.2176 | |
| 9 | G | B | 0.5734 | |
| 10 | V | B | 1.6166 | |
| 11 | L | B | 0.6183 | |
| 12 | V | B | -0.3618 | |
| 13 | K | B | -2.1874 | |
| 14 | P | B | -1.8900 | |
| 15 | G | B | -1.4816 | |
| 16 | G | B | -1.1544 | |
| 17 | S | B | -1.2513 | |
| 18 | L | B | -0.8997 | |
| 19 | K | B | -1.8856 | |
| 20 | L | B | 0.0000 | |
| 21 | S | B | -0.5201 | |
| 22 | C | B | 0.0000 | |
| 23 | A | B | -0.1084 | |
| 24 | A | B | 0.0000 | |
| 25 | S | B | -0.5416 | |
| 26 | G | B | -0.7900 | |
| 27 | F | B | -0.4672 | |
| 28 | T | B | -0.6856 | |
| 29 | F | B | 0.0000 | |
| 30 | S | B | -1.1530 | |
| 31 | R | B | -2.0018 | |
| 32 | Y | B | -0.9902 | |
| 33 | A | B | -0.5404 | |
| 34 | M | B | 0.0000 | |
| 35 | S | B | 0.0000 | |
| 36 | W | B | 0.0000 | |
| 37 | V | B | 0.0000 | |
| 38 | R | B | 0.0000 | |
| 39 | Q | B | 0.0000 | |
| 40 | T | B | -2.2352 | |
| 41 | P | B | -2.1439 | |
| 42 | E | B | -3.2824 | |
| 43 | K | B | -3.6636 | |
| 44 | R | B | -3.3972 | |
| 45 | L | B | 0.0000 | |
| 46 | E | B | -1.0800 | |
| 47 | W | B | 0.0000 | |
| 48 | V | B | 0.0000 | |
| 49 | A | B | 0.0000 | |
| 50 | T | B | 0.0000 | |
| 51 | I | B | 0.0000 | |
| 52 | S | B | -0.1140 | |
| 53A | S | B | -0.9386 | |
| 54 | G | B | -0.9316 | |
| 55 | G | B | -0.3844 | |
| 56 | S | B | 0.1198 | |
| 57 | Y | B | 1.1494 | |
| 58 | S | B | 0.7973 | |
| 59 | Y | B | 0.6773 | |
| 60 | Y | B | -0.4813 | |
| 61 | P | B | 0.0000 | |
| 62 | D | B | -2.4178 | |
| 63 | S | B | -1.5328 | |
| 64 | V | B | 0.0000 | |
| 65 | K | B | -2.4857 | |
| 66 | G | B | -1.7000 | |
| 67 | R | B | -1.3890 | |
| 68 | F | B | 0.0000 | |
| 69 | T | B | -0.8419 | |
| 70 | I | B | 0.0000 | |
| 71 | S | B | -0.3090 | |
| 72 | R | B | -0.7367 | |
| 73 | D | B | -0.8799 | |
| 74 | N | B | -0.9264 | |
| 75 | V | B | 0.3877 | |
| 76 | K | B | -1.3603 | |
| 77 | N | B | -1.0572 | |
| 78 | T | B | -0.6619 | |
| 79 | L | B | 0.0000 | |
| 80 | Y | B | -0.5480 | |
| 81 | L | B | 0.0000 | |
| 82 | Q | B | -1.5355 | |
| 83 | M | B | 0.0000 | |
| 84A | S | B | -1.0971 | |
| 85B | S | B | -1.1225 | |
| 86C | L | B | 0.0000 | |
| 87 | R | B | -2.5255 | |
| 88 | S | B | -2.0495 | |
| 89 | E | B | -2.3992 | |
| 90 | D | B | 0.0000 | |
| 91 | T | B | -0.6619 | |
| 92 | A | B | 0.0000 | |
| 93 | M | B | -0.0829 | |
| 94 | Y | B | 0.0000 | |
| 95 | Y | B | 0.0000 | |
| 96 | C | B | 0.0000 | |
| 97 | A | B | 0.0000 | |
| 98 | R | B | -0.4959 | |
| 99 | D | B | -0.8418 | |
| 100 | S | B | -0.4638 | |
| 101 | G | B | -0.4656 | |
| 102 | G | B | 0.0000 | |
| 103 | F | B | 0.0000 | |
| 104 | A | B | 0.0000 | |
| 105 | Y | B | -0.1364 | |
| 106 | W | B | 0.0000 | |
| 107 | G | B | 0.0000 | |
| 108 | Q | B | -1.1746 | |
| 109 | G | B | -0.4582 | |
| 110 | T | B | 0.0000 | |
| 111 | L | B | 0.5507 | |
| 112 | V | B | 0.0000 | |
| 113 | T | B | 0.0000 | |
| 114 | V | B | 0.0000 | |
| 115 | S | B | -1.5231 | |
| 116 | A | B | -1.1754 | |
| 117 | A | B | -1.4359 | |
| 118 | K | B | -2.0903 | |
| 119 | T | B | -1.0143 | |
| 120 | T | B | -0.6924 | |
| 121 | P | B | -0.6559 | |
| 122 | P | B | -0.2688 | |
| 123 | S | B | -0.3695 | |
| 124 | V | B | 0.0000 | |
| 125 | Y | B | -0.7759 | |
| 126 | P | B | -1.2022 | |
| 127 | L | B | 0.0000 | |
| 128 | A | B | -0.7182 | |
| 129 | P | B | -0.4258 | |
| 136 | G | B | -1.1909 | |
| 137 | S | B | -1.0809 | |
| 138 | S | B | -0.5518 | |
| 139 | V | B | -0.2550 | |
| 140 | T | B | -0.0021 | |
| 141 | L | B | 0.0000 | |
| 142 | G | B | 0.0000 | |
| 143 | C | B | 0.0000 | |
| 144 | L | B | 0.0000 | |
| 145 | V | B | 0.0000 | |
| 146 | K | B | -0.2208 | |
| 147 | G | B | -0.3314 | |
| 148 | Y | B | 0.0000 | |
| 149 | F | B | 0.0000 | |
| 150 | P | B | 0.0000 | |
| 151 | E | B | 0.0595 | |
| 152 | P | B | -0.1547 | |
| 153 | V | B | -0.2541 | |
| 154 | T | B | -0.2395 | |
| 155 | V | B | -0.1897 | |
| 156 | T | B | -0.3710 | |
| 157 | W | B | 0.0000 | |
| 158 | N | B | -1.0136 | |
| 159 | S | B | -0.7898 | |
| 160 | G | B | -0.5537 | |
| 161 | S | B | -0.4653 | |
| 162 | L | B | -0.1898 | |
| 163 | S | B | -0.3300 | |
| 164 | S | B | -0.2837 | |
| 165 | G | B | -0.1535 | |
| 166 | V | B | 0.2291 | |
| 167 | H | B | -0.0810 | |
| 168 | T | B | 0.0918 | |
| 169 | F | B | 0.0000 | |
| 170 | P | B | -0.1109 | |
| 171 | A | B | 0.2384 | |
| 172 | V | B | 0.4409 | |
| 173 | L | B | 0.2260 | |
| 174 | Q | B | -1.0618 | |
| 175 | S | B | -1.2431 | |
| 176 | D | B | -1.9383 | |
| 177 | L | B | -0.6519 | |
| 178 | Y | B | 0.0376 | |
| 179 | T | B | 0.0000 | |
| 180 | L | B | 0.0000 | |
| 181 | S | B | 0.0000 | |
| 182 | S | B | 0.0000 | |
| 183 | S | B | 0.0000 | |
| 184 | V | B | 0.0000 | |
| 185 | T | B | -0.0919 | |
| 186 | V | B | 0.0000 | |
| 187 | P | B | -0.5817 | |
| 188 | S | B | -0.7383 | |
| 189 | S | B | -0.7311 | |
| 190 | T | B | -0.7976 | |
| 191 | W | B | 0.0000 | |
| 192 | P | B | -1.2324 | |
| 193 | S | B | -1.0021 | |
| 194 | Q | B | -1.4687 | |
| 195 | S | B | -1.3861 | |
| 196 | V | B | 0.0000 | |
| 197 | T | B | -1.4956 | |
| 198 | C | B | 0.0000 | |
| 199 | N | B | -1.3743 | |
| 200 | V | B | 0.0000 | |
| 201 | A | B | -0.8902 | |
| 202 | H | B | 0.0000 | |
| 203 | P | B | -0.4964 | |
| 204 | A | B | 0.0763 | |
| 205 | S | B | -0.5199 | |
| 206 | S | B | -0.6654 | |
| 207 | T | B | -0.8639 | |
| 208 | K | B | -1.8464 | |
| 209 | V | B | -1.2429 | |
| 210 | D | B | -2.3710 | |
| 211 | K | B | -1.9467 | |
| 212 | K | B | -2.4474 | |
| 213 | I | B | 0.0000 | |
| 214 | E | B | -2.4565 | |
| 215 | P | B | -1.3909 | |
| 1 | D | C | -2.0242 | |
| 2 | I | C | 0.0000 | |
| 3 | Q | C | -2.1405 | |
| 4 | M | C | 0.0000 | |
| 5 | T | C | -1.2845 | |
| 6 | Q | C | 0.0000 | |
| 7 | T | C | -0.5904 | |
| 8 | T | C | -0.3729 | |
| 9 | S | C | -0.5857 | |
| 10 | S | C | -0.5131 | |
| 11 | L | C | -0.3799 | |
| 12 | S | C | -0.7893 | |
| 13 | A | C | -1.0237 | |
| 14 | S | C | -1.2449 | |
| 15 | L | C | -0.5989 | |
| 16 | G | C | -1.2809 | |
| 17 | D | C | -1.9783 | |
| 18 | R | C | -2.5674 | |
| 19 | V | C | 0.0000 | |
| 20 | T | C | -0.6444 | |
| 21 | I | C | 0.0000 | |
| 22 | S | C | -0.9272 | |
| 23 | C | C | 0.0000 | |
| 24 | R | C | -2.9496 | |
| 25 | A | C | 0.0000 | |
| 26 | S | C | -2.2501 | |
| 27 | Q | C | -2.7663 | |
| 28 | D | C | -2.8426 | |
| 29 | I | C | 0.0000 | |
| 30 | S | C | -0.9855 | |
| 31 | N | C | -0.6769 | |
| 32 | Y | C | 0.3696 | |
| 33 | L | C | 0.0000 | |
| 34 | N | C | 0.0000 | |
| 35 | W | C | 0.0000 | |
| 36 | Y | C | 0.0000 | |
| 37 | Q | C | 0.0000 | |
| 38 | Q | C | 0.0000 | |
| 39 | K | C | -1.7448 | |
| 40 | P | C | -1.8293 | |
| 41 | D | C | -2.3842 | |
| 42 | G | C | -1.6713 | |
| 43 | T | C | -1.3389 | |
| 44 | V | C | 0.0000 | |
| 45 | K | C | -0.9397 | |
| 46 | L | C | 0.0000 | |
| 47 | L | C | 0.0000 | |
| 48 | I | C | 0.0000 | |
| 49 | Y | C | -0.0604 | |
| 50 | Y | C | 0.1801 | |
| 51 | T | C | 0.0000 | |
| 52 | S | C | -0.8894 | |
| 53 | R | C | -1.5548 | |
| 54 | L | C | -0.4860 | |
| 55 | H | C | -0.5845 | |
| 56 | S | C | -0.5263 | |
| 57 | G | C | -0.4297 | |
| 58 | V | C | -0.2066 | |
| 59 | T | C | -0.1870 | |
| 60 | S | C | -0.3127 | |
| 61 | R | C | -0.7433 | |
| 62 | F | C | 0.0000 | |
| 63 | S | C | -0.5784 | |
| 64 | G | C | -0.5614 | |
| 65 | S | C | -0.8806 | |
| 66 | G | C | -1.0830 | |
| 67 | S | C | -1.3278 | |
| 68 | G | C | -1.8000 | |
| 69 | T | C | -2.3760 | |
| 70 | D | C | -2.4215 | |
| 71 | Y | C | 0.0000 | |
| 72 | S | C | -0.8193 | |
| 73 | L | C | 0.0000 | |
| 74 | T | C | -0.7044 | |
| 75 | I | C | 0.0000 | |
| 76 | S | C | -1.4829 | |
| 77 | N | C | -1.7486 | |
| 78 | L | C | 0.0000 | |
| 79 | E | C | -1.7025 | |
| 80 | Q | C | -2.0749 | |
| 81 | E | C | -2.6469 | |
| 82 | D | C | 0.0000 | |
| 83 | I | C | 0.0000 | |
| 84 | A | C | 0.0000 | |
| 85 | T | C | -0.8016 | |
| 86 | Y | C | 0.0000 | |
| 87 | F | C | 0.0000 | |
| 88 | C | C | 0.0000 | |
| 89 | Q | C | 0.0000 | |
| 90 | Q | C | 0.0000 | |
| 91 | G | C | 0.2283 | |
| 92 | N | C | -0.4022 | |
| 93 | T | C | -0.0910 | |
| 94 | L | C | 0.4292 | |
| 95 | P | C | -0.1452 | |
| 96 | W | C | -0.0560 | |
| 97 | T | C | -0.5061 | |
| 98 | F | C | -0.5432 | |
| 99 | G | C | 0.0000 | |
| 100 | G | C | -1.6802 | |
| 101 | G | C | 0.0000 | |
| 102 | T | C | 0.0000 | |
| 103 | K | C | -1.0218 | |
| 104 | V | C | 0.0000 | |
| 105 | E | C | -1.2042 | |
| 106 | I | C | 0.0000 | |
| 107 | K | C | -1.8655 | |
| 108 | R | C | -1.3719 | |
| 109 | A | C | -0.8827 | |
| 110 | D | C | 0.0000 | |
| 111 | A | C | -0.5243 | |
| 112 | A | C | -0.4537 | |
| 113 | P | C | 0.0000 | |
| 114 | T | C | -0.2295 | |
| 115 | V | C | 0.0000 | |
| 116 | S | C | -0.1142 | |
| 117 | I | C | -0.0574 | |
| 118 | F | C | 0.0000 | |
| 119 | P | C | -0.1940 | |
| 120 | P | C | 0.0000 | |
| 121 | S | C | -0.8833 | |
| 122 | S | C | -1.1064 | |
| 123 | E | C | -1.9532 | |
| 124 | Q | C | 0.0000 | |
| 125 | L | C | -1.1613 | |
| 126 | T | C | -0.9262 | |
| 127 | S | C | -0.9124 | |
| 128 | G | C | -1.2183 | |
| 129 | G | C | -1.0996 | |
| 130 | A | C | 0.0000 | |
| 131 | S | C | 0.0000 | |
| 132 | V | C | 0.0000 | |
| 133 | V | C | 0.0000 | |
| 134 | C | C | 0.0000 | |
| 135 | F | C | 0.0000 | |
| 136 | L | C | 0.0000 | |
| 137 | N | C | 0.0000 | |
| 138 | N | C | -0.7628 | |
| 139 | F | C | 0.0000 | |
| 140 | Y | C | 0.0000 | |
| 141 | P | C | -1.7249 | |
| 142 | K | C | -2.2439 | |
| 143 | D | C | -2.6993 | |
| 144 | I | C | -1.7391 | |
| 145 | N | C | -1.7587 | |
| 146 | V | C | -0.7797 | |
| 147 | K | C | -1.6725 | |
| 148 | W | C | 0.0000 | |
| 149 | K | C | -2.3149 | |
| 150 | I | C | 0.0000 | |
| 151 | D | C | -2.8919 | |
| 152 | G | C | -2.1092 | |
| 153 | S | C | -2.2564 | |
| 154 | E | C | -3.1837 | |
| 155 | R | C | -2.6604 | |
| 156 | Q | C | -2.5577 | |
| 157 | N | C | -2.1467 | |
| 158 | G | C | -1.0317 | |
| 159 | V | C | -0.7286 | |
| 160 | L | C | 0.0000 | |
| 161 | N | C | -0.1304 | |
| 162 | S | C | 0.0000 | |
| 163 | W | C | -0.0053 | |
| 164 | T | C | -0.6972 | |
| 165 | D | C | -1.9926 | |
| 166 | Q | C | 0.0000 | |
| 167 | D | C | -2.3070 | |
| 168 | S | C | -2.4029 | |
| 169 | K | C | -2.9415 | |
| 170 | D | C | -2.2092 | |
| 171 | S | C | 0.0000 | |
| 172 | T | C | 0.0000 | |
| 173 | Y | C | 0.0000 | |
| 174 | S | C | 0.0000 | |
| 175 | M | C | 0.0000 | |
| 176 | S | C | 0.0000 | |
| 177 | S | C | 0.0000 | |
| 178 | T | C | 0.0000 | |
| 179 | L | C | 0.0000 | |
| 180 | T | C | -0.3735 | |
| 181 | L | C | 0.0000 | |
| 182 | T | C | -1.4934 | |
| 183 | K | C | -2.4630 | |
| 184 | D | C | -3.4014 | |
| 185 | E | C | -2.8589 | |
| 186 | Y | C | 0.0000 | |
| 187 | E | C | -3.4679 | |
| 188 | R | C | -3.7339 | |
| 189 | H | C | -3.0723 | |
| 190 | N | C | -2.6777 | |
| 191 | S | C | -1.8460 | |
| 192 | Y | C | 0.0000 | |
| 193 | T | C | -1.1115 | |
| 194 | C | C | 0.0000 | |
| 195 | E | C | -0.6410 | |
| 196 | A | C | 0.0000 | |
| 197 | T | C | -1.1095 | |
| 198 | H | C | 0.0000 | |
| 199 | K | C | -2.1618 | |
| 200 | T | C | 0.0000 | |
| 201 | S | C | -0.9843 | |
| 202 | T | C | -0.6646 | |
| 203 | S | C | -0.4316 | |
| 204 | P | C | -0.5401 | |
| 205 | I | C | 0.1513 | |
| 206 | V | C | 0.1943 | |
| 207 | K | C | -0.5916 | |
| 208 | S | C | -0.5307 | |
| 209 | F | C | -0.9686 | |
| 210 | N | C | -2.0358 | |
| 211 | R | C | -2.6075 | |
| 212 | N | C | -2.7136 | |
| 213 | E | C | -2.7707 | |
| 1 | E | D | -1.6977 | |
| 2 | V | D | -0.5126 | |
| 3 | M | D | 0.1165 | |
| 4 | L | D | 0.0000 | |
| 5 | V | D | 0.5138 | |
| 6 | E | D | 0.0000 | |
| 7 | S | D | -0.2486 | |
| 8 | G | D | -0.2278 | |
| 9 | G | D | 0.5331 | |
| 10 | V | D | 1.5492 | |
| 11 | L | D | 0.4974 | |
| 12 | V | D | 0.0000 | |
| 13 | K | D | -2.2946 | |
| 14 | P | D | -1.9497 | |
| 15 | G | D | -1.5214 | |
| 16 | G | D | -1.2179 | |
| 17 | S | D | -1.2180 | |
| 18 | L | D | -0.8378 | |
| 19 | K | D | -1.7310 | |
| 20 | L | D | 0.0000 | |
| 21 | S | D | -0.4714 | |
| 22 | C | D | 0.0000 | |
| 23 | A | D | -0.0595 | |
| 24 | A | D | 0.0000 | |
| 25 | S | D | -0.5422 | |
| 26 | G | D | -0.7866 | |
| 27 | F | D | -0.4486 | |
| 28 | T | D | -0.6341 | |
| 29 | F | D | 0.0000 | |
| 30 | S | D | -1.1080 | |
| 31 | R | D | -1.9222 | |
| 32 | Y | D | -0.8710 | |
| 33 | A | D | -0.4874 | |
| 34 | M | D | 0.0000 | |
| 35 | S | D | 0.0000 | |
| 36 | W | D | 0.0000 | |
| 37 | V | D | 0.0000 | |
| 38 | R | D | 0.0000 | |
| 39 | Q | D | 0.0000 | |
| 40 | T | D | -2.2437 | |
| 41 | P | D | -2.1805 | |
| 42 | E | D | -3.3519 | |
| 43 | K | D | -3.6830 | |
| 44 | R | D | -3.4737 | |
| 45 | L | D | 0.0000 | |
| 46 | E | D | -1.0804 | |
| 47 | W | D | 0.0000 | |
| 48 | V | D | 0.0000 | |
| 49 | A | D | 0.0000 | |
| 50 | T | D | 0.0000 | |
| 51 | I | D | 0.0000 | |
| 52 | S | D | -0.0687 | |
| 53A | S | D | -0.8966 | |
| 54 | G | D | -0.9107 | |
| 55 | G | D | -0.3657 | |
| 56 | S | D | 0.1226 | |
| 57 | Y | D | 1.1807 | |
| 58 | S | D | 0.8859 | |
| 59 | Y | D | 0.8372 | |
| 60 | Y | D | -0.3889 | |
| 61 | P | D | 0.0000 | |
| 62 | D | D | -2.4292 | |
| 63 | S | D | -1.5549 | |
| 64 | V | D | 0.0000 | |
| 65 | K | D | -2.4929 | |
| 66 | G | D | -1.7056 | |
| 67 | R | D | -1.3248 | |
| 68 | F | D | 0.0000 | |
| 69 | T | D | -0.6733 | |
| 70 | I | D | 0.0000 | |
| 71 | S | D | -0.2261 | |
| 72 | R | D | -0.7326 | |
| 73 | D | D | -0.8623 | |
| 74 | N | D | -0.9336 | |
| 75 | V | D | 0.3858 | |
| 76 | K | D | -1.3978 | |
| 77 | N | D | -1.1628 | |
| 78 | T | D | -0.6975 | |
| 79 | L | D | 0.0000 | |
| 80 | Y | D | -0.4581 | |
| 81 | L | D | 0.0000 | |
| 82 | Q | D | -1.1462 | |
| 83 | M | D | 0.0000 | |
| 84A | S | D | -1.0067 | |
| 85B | S | D | -1.1248 | |
| 86C | L | D | 0.0000 | |
| 87 | R | D | -2.5783 | |
| 88 | S | D | -2.0992 | |
| 89 | E | D | -2.4158 | |
| 90 | D | D | 0.0000 | |
| 91 | T | D | -0.8717 | |
| 92 | A | D | 0.0000 | |
| 93 | M | D | -0.0938 | |
| 94 | Y | D | 0.0000 | |
| 95 | Y | D | 0.0000 | |
| 96 | C | D | 0.0000 | |
| 97 | A | D | 0.0000 | |
| 98 | R | D | -0.2009 | |
| 99 | D | D | -0.6856 | |
| 100 | S | D | -0.2767 | |
| 101 | G | D | -0.2932 | |
| 102 | G | D | 0.0019 | |
| 103 | F | D | 0.0000 | |
| 104 | A | D | 0.0000 | |
| 105 | Y | D | 0.0415 | |
| 106 | W | D | 0.0000 | |
| 107 | G | D | 0.0000 | |
| 108 | Q | D | -1.1872 | |
| 109 | G | D | -0.4359 | |
| 110 | T | D | 0.0000 | |
| 111 | L | D | 0.5292 | |
| 112 | V | D | 0.0000 | |
| 113 | T | D | 0.0000 | |
| 114 | V | D | 0.0000 | |
| 115 | S | D | -1.5839 | |
| 116 | A | D | -1.2085 | |
| 117 | A | D | -1.4566 | |
| 118 | K | D | -2.0916 | |
| 119 | T | D | -1.0307 | |
| 120 | T | D | -0.6859 | |
| 121 | P | D | -0.6674 | |
| 122 | P | D | -0.2819 | |
| 123 | S | D | -0.2027 | |
| 124 | V | D | 0.0000 | |
| 125 | Y | D | -0.7822 | |
| 126 | P | D | -1.1876 | |
| 127 | L | D | 0.0000 | |
| 128 | A | D | -0.6844 | |
| 129 | P | D | -0.4475 | |
| 134 | T | D | -0.1791 | |
| 135 | T | D | -0.3250 | |
| 136 | G | D | -0.8828 | |
| 137 | S | D | -0.8916 | |
| 138 | S | D | -0.4663 | |
| 139 | V | D | -0.1818 | |
| 140 | T | D | 0.0070 | |
| 141 | L | D | 0.0000 | |
| 142 | G | D | 0.0000 | |
| 143 | C | D | 0.0000 | |
| 144 | L | D | 0.0000 | |
| 145 | V | D | 0.0000 | |
| 146 | K | D | -0.2132 | |
| 147 | G | D | -0.3163 | |
| 148 | Y | D | 0.0000 | |
| 149 | F | D | 0.0000 | |
| 150 | P | D | 0.0000 | |
| 151 | E | D | 0.0652 | |
| 152 | P | D | -0.1401 | |
| 153 | V | D | -0.2463 | |
| 154 | T | D | -0.2126 | |
| 155 | V | D | -0.1878 | |
| 156 | T | D | -0.3609 | |
| 157 | W | D | 0.0000 | |
| 158 | N | D | -1.0752 | |
| 159 | S | D | -0.8122 | |
| 160 | G | D | -0.5906 | |
| 161 | S | D | -0.5062 | |
| 162 | L | D | -0.2261 | |
| 163 | S | D | -0.3420 | |
| 164 | S | D | -0.3171 | |
| 165 | G | D | -0.1770 | |
| 166 | V | D | 0.2028 | |
| 167 | H | D | -0.0843 | |
| 168 | T | D | 0.0749 | |
| 169 | F | D | 0.0000 | |
| 170 | P | D | -0.1362 | |
| 171 | A | D | 0.2512 | |
| 172 | V | D | 0.4694 | |
| 173 | L | D | 0.1976 | |
| 174 | Q | D | -0.9314 | |
| 175 | S | D | -1.1691 | |
| 176 | D | D | -1.8828 | |
| 177 | L | D | -0.5759 | |
| 178 | Y | D | 0.0956 | |
| 179 | T | D | 0.0000 | |
| 180 | L | D | 0.0000 | |
| 181 | S | D | 0.0000 | |
| 182 | S | D | 0.0000 | |
| 183 | S | D | 0.0000 | |
| 184 | V | D | 0.0000 | |
| 185 | T | D | -0.0726 | |
| 186 | V | D | 0.0000 | |
| 187 | P | D | -0.4974 | |
| 188 | S | D | -0.6054 | |
| 189 | S | D | -0.6471 | |
| 190 | T | D | -0.7104 | |
| 191 | W | D | -0.9239 | |
| 192 | P | D | -1.1689 | |
| 193 | S | D | -0.9665 | |
| 194 | Q | D | -1.4540 | |
| 195 | S | D | -1.3967 | |
| 196 | V | D | 0.0000 | |
| 197 | T | D | -1.5008 | |
| 198 | C | D | 0.0000 | |
| 199 | N | D | 0.0000 | |
| 200 | V | D | 0.0000 | |
| 201 | A | D | -0.8881 | |
| 202 | H | D | 0.0000 | |
| 203 | P | D | -0.4982 | |
| 204 | A | D | 0.0679 | |
| 205 | S | D | -0.5182 | |
| 206 | S | D | -0.7345 | |
| 207 | T | D | -0.8902 | |
| 208 | K | D | -1.8713 | |
| 209 | V | D | -1.1635 | |
| 210 | D | D | -2.3723 | |
| 211 | K | D | -1.9332 | |
| 212 | K | D | -2.4111 | |
| 213 | I | D | 0.0000 | |
| 214 | E | D | -2.4191 | |
| 215 | P | D | -1.3591 |
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