| Chain sequence(s) |
A: VQLLESGGGLVQPGGSLRLSCAASGFNFGYSYMSWVRQAPGKGLEWVSSIGSTSSHTYYADSVKGRFTISRDNSKNTLYLQMNSLRAEDTAVYYCARVYSSPGIDYWGQGTLVTVSS
C: DPCSNCPAGTFCDNNRNQICSPCPPNSFSSAGGQRTCDICRQCKGVFRTRKECSSTSNAECDCTPGFHCLGAGCSMCEQDCKQGQELTKKGCKDCSFGTFNDQKRGICRPWTDCSLDGKSVLVQGTKERDVVCGPG B: SDIQMTQSPSSLSASVGDRVTITCRASQSIGSTLNWYQQKPGKAPKLLIYGASSLQSGVPSRFSGSGSGTDFTLTISSLQPEDFATYYCQQYYTWVPFTFGQGTKLEIK D: DPCSNCPAGTFCDNNRNQICSPCPPNSFSSAGGQRTCDICRQCKGVFRTRKECSSTSNAECDCTPGFHCLGAGCSMCEQDCKQGQELTKKGCKDCSFGTFNDQKRGICRPWTDCSLDGKSVLVQGTKERDVVCGPG H: EVQLLESGGGLVQPGGSLRLSCAASGFNFGYSYMSWVRQAPGKGLEWVSSIGSTSSHTYYADSVKGRFTISRDNSKNTLYLQMNSLRAEDTAVYYCARVYSSPGIDYWGQGTLVTVSS L: SDIQMTQSPSSLSASVGDRVTITCRASQSIGSTLNWYQQKPGKAPKLLIYGASSLQSGVPSRFSGSGSGTDFTLTISSLQPEDFATYYCQQYYTWVPFTFGQGTKLEIK input PDB |
| Selected Chain(s) | A,C,B,D,H,L |
| 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 (00:07:23)
[INFO] Main: Simulation completed successfully. (00:07:29)
|
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 | |
| 2 | V | A | 0.9773 | |
| 3 | Q | A | -0.1319 | |
| 4 | L | A | 0.0000 | |
| 5 | L | A | 0.1900 | |
| 6 | E | A | 0.0000 | |
| 7 | S | A | -0.4186 | |
| 8 | G | A | -0.7395 | |
| 9 | G | A | 0.0923 | |
| 10 | G | A | 0.8636 | |
| 11 | L | A | 1.4458 | |
| 12 | V | A | 0.0088 | |
| 13 | Q | A | -1.2999 | |
| 14 | P | A | -1.6142 | |
| 15 | G | A | -1.4716 | |
| 16 | G | A | -1.0819 | |
| 17 | S | A | -1.2854 | |
| 18 | L | A | -0.7976 | |
| 19 | R | A | -1.7245 | |
| 20 | L | A | 0.0000 | |
| 21 | S | A | -0.4179 | |
| 22 | C | A | 0.0000 | |
| 23 | A | A | -0.3214 | |
| 24 | A | A | 0.0000 | |
| 25 | S | A | -0.4811 | |
| 26 | G | A | -0.0968 | |
| 27 | F | A | 0.1573 | |
| 28 | N | A | -0.2206 | |
| 29 | F | A | 0.0000 | |
| 30 | G | A | -0.1135 | |
| 31 | Y | A | 1.0644 | |
| 32 | S | A | 0.0000 | |
| 33 | Y | A | 0.0000 | |
| 34 | M | A | 0.0000 | |
| 35 | S | A | 0.0000 | |
| 36 | W | A | 0.0000 | |
| 37 | V | A | 0.0000 | |
| 38 | R | A | 0.0000 | |
| 39 | Q | A | -0.8691 | |
| 40 | A | A | -1.1065 | |
| 41 | P | A | -0.8742 | |
| 42 | G | A | -1.4638 | |
| 43 | K | A | -2.4334 | |
| 44 | G | A | -1.6944 | |
| 45 | L | A | 0.0000 | |
| 46 | E | A | -1.7044 | |
| 47 | W | A | 0.0000 | |
| 48 | V | A | 0.0000 | |
| 49 | S | A | 0.0000 | |
| 50 | S | A | 0.0000 | |
| 51 | I | A | 0.0000 | |
| 52 | G | A | -0.3931 | |
| 53 | S | A | 0.0035 | |
| 54 | T | A | -0.2654 | |
| 55 | S | A | -0.6462 | |
| 56 | S | A | -0.7285 | |
| 57 | H | A | -1.0385 | |
| 58 | T | A | -0.4206 | |
| 59 | Y | A | -0.3077 | |
| 60 | Y | A | -0.6818 | |
| 61 | A | A | -1.3853 | |
| 62 | D | A | -2.3592 | |
| 63 | S | A | -1.7616 | |
| 64 | V | A | 0.0000 | |
| 65 | K | A | -2.4709 | |
| 66 | G | A | -1.6580 | |
| 67 | R | A | 0.0000 | |
| 68 | F | A | 0.0000 | |
| 69 | T | A | -0.7472 | |
| 70 | I | A | 0.0000 | |
| 71 | S | A | -0.4858 | |
| 72 | R | A | -0.9747 | |
| 73 | D | A | -1.5529 | |
| 74 | N | A | -1.7055 | |
| 75 | S | A | -1.6707 | |
| 76 | K | A | -2.4163 | |
| 77 | N | A | -1.9430 | |
| 78 | T | A | -1.1005 | |
| 79 | L | A | 0.0000 | |
| 80 | Y | A | -0.4547 | |
| 81 | L | A | 0.0000 | |
| 82 | Q | A | -1.0762 | |
| 83 | M | A | 0.0000 | |
| 84 | N | A | -1.6037 | |
| 85 | S | A | -1.3627 | |
| 86 | L | A | 0.0000 | |
| 87 | R | A | -2.2787 | |
| 88 | A | A | -1.7431 | |
| 89 | E | A | -2.2353 | |
| 90 | D | A | 0.0000 | |
| 91 | T | A | -0.3941 | |
| 92 | A | A | 0.0000 | |
| 93 | V | A | 0.5546 | |
| 94 | Y | A | 0.0000 | |
| 95 | Y | A | 0.0000 | |
| 96 | C | A | 0.0000 | |
| 97 | A | A | 0.0000 | |
| 98 | R | A | 0.0000 | |
| 99 | V | A | 0.0000 | |
| 100 | Y | A | 0.8297 | |
| 101 | S | A | 0.1902 | |
| 102 | S | A | -0.0515 | |
| 103 | P | A | 0.0000 | |
| 104 | G | A | 0.0000 | |
| 105 | I | A | 0.0000 | |
| 106 | D | A | -0.1741 | |
| 107 | Y | A | 0.5529 | |
| 108 | W | A | -0.0545 | |
| 109 | G | A | 0.0000 | |
| 110 | Q | A | -1.5004 | |
| 111 | G | A | 0.0000 | |
| 112 | T | A | 0.3037 | |
| 113 | L | A | 1.3084 | |
| 114 | V | A | 0.0000 | |
| 115 | T | A | 0.3682 | |
| 116 | V | A | 0.0000 | |
| 117 | S | A | -0.4035 | |
| 118 | S | A | -0.8977 | |
| 2 | S | B | -0.7491 | |
| 3 | D | B | -1.1142 | |
| 4 | I | B | 0.0000 | |
| 5 | Q | B | -1.8197 | |
| 6 | M | B | 0.0000 | |
| 7 | T | B | -1.2981 | |
| 8 | Q | B | 0.0000 | |
| 9 | S | B | -0.5489 | |
| 10 | P | B | -0.5812 | |
| 11 | S | B | -0.8603 | |
| 12 | S | B | -1.0737 | |
| 13 | L | B | -0.6337 | |
| 14 | S | B | -0.6329 | |
| 15 | A | B | -0.3663 | |
| 16 | S | B | -0.1307 | |
| 17 | V | B | 0.3660 | |
| 18 | G | B | -0.9309 | |
| 19 | D | B | -1.9344 | |
| 20 | R | B | -2.4911 | |
| 21 | V | B | 0.0000 | |
| 22 | T | B | -0.5063 | |
| 23 | I | B | 0.0000 | |
| 24 | T | B | -0.8426 | |
| 25 | C | B | 0.0000 | |
| 26 | R | B | -2.3128 | |
| 27 | A | B | 0.0000 | |
| 28 | S | B | -1.4273 | |
| 29 | Q | B | -1.0787 | |
| 30 | S | B | -0.8932 | |
| 31 | I | B | 0.0000 | |
| 32 | G | B | -0.6346 | |
| 33 | S | B | 0.0000 | |
| 34 | T | B | 0.0000 | |
| 35 | L | B | 0.0000 | |
| 36 | N | B | 0.0000 | |
| 37 | W | B | 0.0000 | |
| 38 | Y | B | 0.0000 | |
| 39 | Q | B | 0.0000 | |
| 40 | Q | B | -1.5049 | |
| 41 | K | B | -1.9805 | |
| 42 | P | B | -1.2953 | |
| 43 | G | B | -1.7284 | |
| 44 | K | B | -2.6827 | |
| 45 | A | B | -1.6913 | |
| 46 | P | B | 0.0000 | |
| 47 | K | B | -1.9217 | |
| 48 | L | B | 0.0000 | |
| 49 | L | B | 0.0000 | |
| 50 | I | B | 0.0000 | |
| 51 | Y | B | 0.1352 | |
| 52 | G | B | -0.1166 | |
| 53 | A | B | 0.0000 | |
| 54 | S | B | -0.3570 | |
| 55 | S | B | -0.2135 | |
| 56 | L | B | 0.1742 | |
| 57 | Q | B | -0.3887 | |
| 58 | S | B | -0.4094 | |
| 59 | G | B | -0.5029 | |
| 60 | V | B | -0.3998 | |
| 61 | P | B | -0.3534 | |
| 62 | S | B | -0.4329 | |
| 63 | R | B | -0.9262 | |
| 64 | F | B | 0.0000 | |
| 65 | S | B | -0.3558 | |
| 66 | G | B | -0.3169 | |
| 67 | S | B | -0.7367 | |
| 68 | G | B | -1.1665 | |
| 69 | S | B | -0.9812 | |
| 70 | G | B | -1.1325 | |
| 71 | T | B | -1.6424 | |
| 72 | D | B | -2.5210 | |
| 73 | F | B | 0.0000 | |
| 74 | T | B | -0.8208 | |
| 75 | L | B | 0.0000 | |
| 76 | T | B | -0.6720 | |
| 77 | I | B | 0.0000 | |
| 78 | S | B | -1.5411 | |
| 79 | S | B | -1.2715 | |
| 80 | L | B | 0.0000 | |
| 81 | Q | B | -1.1549 | |
| 82 | P | B | -0.7609 | |
| 83 | E | B | -1.9100 | |
| 84 | D | B | 0.0000 | |
| 85 | F | B | -0.6934 | |
| 86 | A | B | 0.0000 | |
| 87 | T | B | -1.1330 | |
| 88 | Y | B | 0.0000 | |
| 89 | Y | B | 0.0000 | |
| 90 | C | B | 0.0000 | |
| 91 | Q | B | 0.0000 | |
| 92 | Q | B | 0.0000 | |
| 93 | Y | B | 0.0000 | |
| 94 | Y | B | 0.0000 | |
| 95 | T | B | 0.0000 | |
| 96 | W | B | 0.0000 | |
| 97 | V | B | 0.0601 | |
| 98 | P | B | -0.2824 | |
| 99 | F | B | 0.0000 | |
| 100 | T | B | -0.6460 | |
| 101 | F | B | -0.5775 | |
| 102 | G | B | 0.0000 | |
| 103 | Q | B | -1.7666 | |
| 104 | G | B | 0.0000 | |
| 105 | T | B | 0.0000 | |
| 106 | K | B | -1.9791 | |
| 107 | L | B | 0.0000 | |
| 108 | E | B | -1.1143 | |
| 109 | I | B | 0.7313 | |
| 110 | K | B | -0.8952 | |
| 26 | D | C | -2.0957 | |
| 27 | P | C | -1.0969 | |
| 28 | C | C | -1.3125 | |
| 29 | S | C | -1.5076 | |
| 30 | N | C | -1.6448 | |
| 31 | C | C | 0.0000 | |
| 32 | P | C | -0.8271 | |
| 33 | A | C | -0.5193 | |
| 34 | G | C | 0.0000 | |
| 35 | T | C | -0.2896 | |
| 36 | F | C | -0.6030 | |
| 37 | C | C | -1.1705 | |
| 38 | D | C | -1.9115 | |
| 39 | N | C | -2.7217 | |
| 40 | N | C | -3.0981 | |
| 41 | R | C | -3.4029 | |
| 42 | N | C | -2.6701 | |
| 43 | Q | C | -1.7641 | |
| 44 | I | C | -0.1542 | |
| 45 | C | C | -0.7347 | |
| 46 | S | C | -0.2388 | |
| 47 | P | C | -0.2549 | |
| 48 | C | C | -0.2876 | |
| 49 | P | C | -0.5971 | |
| 50 | P | C | -0.9201 | |
| 51 | N | C | -1.4031 | |
| 52 | S | C | -0.7168 | |
| 53 | F | C | -0.3427 | |
| 54 | S | C | 0.0000 | |
| 55 | S | C | -0.4911 | |
| 56 | A | C | -0.3932 | |
| 57 | G | C | -1.1878 | |
| 58 | G | C | -1.5024 | |
| 59 | Q | C | -1.5806 | |
| 60 | R | C | -2.2542 | |
| 61 | T | C | -1.0334 | |
| 62 | C | C | -0.6047 | |
| 63 | D | C | -0.6297 | |
| 64 | I | C | -0.3511 | |
| 65 | C | C | 0.0000 | |
| 66 | R | C | 0.0000 | |
| 67 | Q | C | -0.7132 | |
| 68 | C | C | -1.0719 | |
| 69 | K | C | -0.7130 | |
| 70 | G | C | -0.3396 | |
| 71 | V | C | -0.0710 | |
| 72 | F | C | 0.0000 | |
| 73 | R | C | -1.1960 | |
| 74 | T | C | -1.6829 | |
| 75 | R | C | -2.0407 | |
| 76 | K | C | -3.1929 | |
| 77 | E | C | -2.9225 | |
| 78 | C | C | -1.7617 | |
| 79 | S | C | -1.1176 | |
| 80 | S | C | -0.5587 | |
| 81 | T | C | -0.3222 | |
| 82 | S | C | -0.8952 | |
| 83 | N | C | -1.3336 | |
| 84 | A | C | 0.0000 | |
| 85 | E | C | -2.0746 | |
| 86 | C | C | 0.0000 | |
| 87 | D | C | 0.0000 | |
| 88 | C | C | 0.0000 | |
| 89 | T | C | -0.2446 | |
| 90 | P | C | -0.1407 | |
| 91 | G | C | -0.3645 | |
| 92 | F | C | -0.2801 | |
| 93 | H | C | 0.0000 | |
| 94 | C | C | 0.0559 | |
| 95 | L | C | -0.6482 | |
| 96 | G | C | -1.0857 | |
| 97 | A | C | -0.5936 | |
| 98 | G | C | -0.6682 | |
| 99 | C | C | 0.0000 | |
| 100 | S | C | 0.0000 | |
| 101 | M | C | -0.0629 | |
| 102 | C | C | 0.0000 | |
| 103 | E | C | -0.6360 | |
| 104 | Q | C | -1.4320 | |
| 105 | D | C | -1.3915 | |
| 106 | C | C | 0.0000 | |
| 107 | K | C | -3.1815 | |
| 108 | Q | C | -2.9862 | |
| 109 | G | C | 0.0000 | |
| 110 | Q | C | -2.6355 | |
| 111 | E | C | -1.6866 | |
| 112 | L | C | 0.0000 | |
| 113 | T | C | -1.7459 | |
| 114 | K | C | -2.6704 | |
| 115 | K | C | -2.6934 | |
| 116 | G | C | 0.0000 | |
| 117 | C | C | -1.9181 | |
| 118 | K | C | -2.5141 | |
| 119 | D | C | -2.7556 | |
| 120 | C | C | 0.0000 | |
| 121 | S | C | -0.1652 | |
| 122 | F | C | 1.3490 | |
| 123 | G | C | 0.1359 | |
| 124 | T | C | -0.5951 | |
| 125 | F | C | 0.0000 | |
| 126 | N | C | 0.0000 | |
| 127 | D | C | -2.4387 | |
| 128 | Q | C | -2.1949 | |
| 129 | K | C | -2.3048 | |
| 130 | R | C | 0.0000 | |
| 131 | G | C | 0.0000 | |
| 132 | I | C | -0.1778 | |
| 133 | C | C | -0.5954 | |
| 134 | R | C | -0.5950 | |
| 135 | P | C | -0.5107 | |
| 136 | W | C | -0.8677 | |
| 137 | T | C | -0.6300 | |
| 138 | D | C | -1.5892 | |
| 139 | C | C | 0.0000 | |
| 140 | S | C | -1.0361 | |
| 141 | L | C | -0.3383 | |
| 142 | D | C | -2.0650 | |
| 143 | G | C | -1.7984 | |
| 144 | K | C | -1.3911 | |
| 145 | S | C | 0.3224 | |
| 146 | V | C | 2.1553 | |
| 147 | L | C | 2.9629 | |
| 148 | V | C | 2.5340 | |
| 149 | Q | C | 0.2423 | |
| 150 | G | C | -0.6617 | |
| 151 | T | C | -1.5097 | |
| 152 | K | C | -2.3162 | |
| 153 | E | C | -3.2001 | |
| 154 | R | C | -3.0465 | |
| 155 | D | C | -1.7950 | |
| 156 | V | C | 0.0000 | |
| 157 | V | C | 1.9589 | |
| 158 | C | C | 1.1518 | |
| 159 | G | C | 0.8462 | |
| 160 | P | C | -0.7354 | |
| 161 | G | C | -0.9223 | |
| 26 | D | D | -1.9332 | |
| 27 | P | D | -1.0752 | |
| 28 | C | D | -1.2447 | |
| 29 | S | D | -1.4921 | |
| 30 | N | D | -1.6314 | |
| 31 | C | D | 0.0000 | |
| 32 | P | D | -0.8266 | |
| 33 | A | D | -0.5176 | |
| 34 | G | D | 0.0000 | |
| 35 | T | D | -0.2313 | |
| 36 | F | D | -0.4944 | |
| 37 | C | D | -1.0098 | |
| 38 | D | D | -1.7159 | |
| 39 | N | D | -2.6319 | |
| 40 | N | D | -3.0468 | |
| 41 | R | D | -3.3901 | |
| 42 | N | D | -2.6642 | |
| 43 | Q | D | -1.7602 | |
| 44 | I | D | -0.1748 | |
| 45 | C | D | -0.5326 | |
| 46 | S | D | -0.1920 | |
| 47 | P | D | -0.2187 | |
| 48 | C | D | -0.2912 | |
| 49 | P | D | -0.6053 | |
| 50 | P | D | -0.9213 | |
| 51 | N | D | -1.4309 | |
| 52 | S | D | -0.7507 | |
| 53 | F | D | -0.3629 | |
| 54 | S | D | 0.0000 | |
| 55 | S | D | -0.4704 | |
| 56 | A | D | -0.3869 | |
| 57 | G | D | -1.2121 | |
| 58 | G | D | -1.4773 | |
| 59 | Q | D | -1.4837 | |
| 60 | R | D | -2.1685 | |
| 61 | T | D | -0.9794 | |
| 62 | C | D | -0.6058 | |
| 63 | D | D | -0.6844 | |
| 64 | I | D | -0.3982 | |
| 65 | C | D | 0.0000 | |
| 66 | R | D | -0.8584 | |
| 67 | Q | D | -0.9008 | |
| 68 | C | D | 0.0000 | |
| 69 | K | D | -0.9693 | |
| 70 | G | D | -0.4383 | |
| 71 | V | D | 0.0000 | |
| 72 | F | D | 0.0000 | |
| 73 | R | D | -2.3167 | |
| 74 | T | D | -2.7415 | |
| 75 | R | D | -3.5177 | |
| 76 | K | D | -3.6994 | |
| 77 | E | D | -3.1271 | |
| 78 | C | D | -1.8364 | |
| 79 | S | D | -1.0641 | |
| 80 | S | D | -0.5399 | |
| 81 | T | D | -0.2773 | |
| 82 | S | D | -0.8048 | |
| 83 | N | D | -1.2273 | |
| 84 | A | D | 0.0000 | |
| 85 | E | D | -2.6368 | |
| 86 | C | D | 0.0000 | |
| 87 | D | D | -2.2613 | |
| 88 | C | D | 0.0000 | |
| 89 | T | D | -0.7983 | |
| 90 | P | D | -0.6956 | |
| 91 | G | D | -0.6631 | |
| 92 | F | D | -0.6147 | |
| 93 | H | D | -0.3869 | |
| 94 | C | D | -0.5366 | |
| 95 | L | D | -0.6026 | |
| 96 | G | D | -0.7835 | |
| 97 | A | D | -0.5021 | |
| 98 | G | D | -0.6735 | |
| 99 | C | D | 0.0000 | |
| 100 | S | D | 0.0000 | |
| 101 | M | D | -0.0134 | |
| 102 | C | D | 0.0000 | |
| 103 | E | D | -0.8246 | |
| 104 | Q | D | -1.5324 | |
| 105 | D | D | -1.7758 | |
| 106 | C | D | 0.0000 | |
| 107 | K | D | -3.8079 | |
| 108 | Q | D | -3.3233 | |
| 109 | G | D | 0.0000 | |
| 110 | Q | D | -2.9008 | |
| 111 | E | D | -1.6300 | |
| 112 | L | D | -0.9517 | |
| 113 | T | D | -1.2857 | |
| 114 | K | D | -2.3258 | |
| 115 | K | D | -2.5822 | |
| 116 | G | D | -1.6245 | |
| 117 | C | D | -2.1966 | |
| 118 | K | D | -2.9273 | |
| 119 | D | D | -2.9373 | |
| 120 | C | D | -1.3754 | |
| 121 | S | D | -0.4510 | |
| 122 | F | D | 1.3159 | |
| 123 | G | D | -0.0619 | |
| 124 | T | D | -0.6856 | |
| 125 | F | D | 0.0000 | |
| 126 | N | D | 0.0000 | |
| 127 | D | D | -2.7744 | |
| 128 | Q | D | -3.2231 | |
| 129 | K | D | -3.9458 | |
| 130 | R | D | -3.2229 | |
| 131 | G | D | -1.5295 | |
| 132 | I | D | 0.6169 | |
| 133 | C | D | -0.3749 | |
| 134 | R | D | -1.2566 | |
| 135 | P | D | -0.8026 | |
| 136 | W | D | -1.1052 | |
| 137 | T | D | -0.8081 | |
| 138 | D | D | -1.6327 | |
| 139 | C | D | 0.0000 | |
| 140 | S | D | -0.7918 | |
| 141 | L | D | -0.2052 | |
| 142 | D | D | -2.0480 | |
| 143 | G | D | -1.7203 | |
| 144 | K | D | -1.1651 | |
| 145 | S | D | 0.5291 | |
| 146 | V | D | 2.4323 | |
| 147 | L | D | 3.1150 | |
| 148 | V | D | 2.6600 | |
| 149 | Q | D | 0.3601 | |
| 150 | G | D | -0.4467 | |
| 151 | T | D | -1.3733 | |
| 152 | K | D | -2.2413 | |
| 153 | E | D | -3.1020 | |
| 154 | R | D | -2.6645 | |
| 155 | D | D | -1.6916 | |
| 156 | V | D | 0.0000 | |
| 157 | V | D | 2.1181 | |
| 158 | C | D | 1.2433 | |
| 159 | G | D | 1.0006 | |
| 160 | P | D | -0.6376 | |
| 161 | G | D | -0.8077 | |
| 1 | E | H | -2.0172 | |
| 2 | V | H | -1.1146 | |
| 3 | Q | H | -1.3653 | |
| 4 | L | H | 0.0000 | |
| 5 | L | H | -0.0608 | |
| 6 | E | H | 0.0000 | |
| 7 | S | H | 0.0000 | |
| 8 | G | H | 0.0000 | |
| 9 | G | H | 0.0000 | |
| 10 | G | H | 0.2574 | |
| 11 | L | H | -0.0848 | |
| 12 | V | H | -0.7144 | |
| 13 | Q | H | -1.6327 | |
| 14 | P | H | -1.5761 | |
| 15 | G | H | -1.3621 | |
| 16 | G | H | -1.0980 | |
| 17 | S | H | -1.2157 | |
| 18 | L | H | -0.6546 | |
| 19 | R | H | -1.2853 | |
| 20 | L | H | 0.0000 | |
| 21 | S | H | -0.1875 | |
| 22 | C | H | 0.0000 | |
| 23 | A | H | -0.4927 | |
| 24 | A | H | 0.0000 | |
| 25 | S | H | -1.3965 | |
| 26 | G | H | -1.3967 | |
| 27 | F | H | -0.8890 | |
| 28 | N | H | -1.1921 | |
| 29 | F | H | 0.0000 | |
| 30 | G | H | -0.7367 | |
| 31 | Y | H | 0.0769 | |
| 32 | S | H | 0.0000 | |
| 33 | Y | H | 0.0000 | |
| 34 | M | H | 0.0000 | |
| 35 | S | H | 0.0000 | |
| 36 | W | H | 0.0000 | |
| 37 | V | H | 0.0000 | |
| 38 | R | H | 0.0000 | |
| 39 | Q | H | 0.0000 | |
| 40 | A | H | -1.0770 | |
| 41 | P | H | 0.0000 | |
| 42 | G | H | -1.4279 | |
| 43 | K | H | -2.3226 | |
| 44 | G | H | -1.6457 | |
| 45 | L | H | 0.0000 | |
| 46 | E | H | -1.7501 | |
| 47 | W | H | 0.0000 | |
| 48 | V | H | 0.0000 | |
| 49 | S | H | 0.0000 | |
| 50 | S | H | 0.0000 | |
| 51 | I | H | 0.0000 | |
| 52 | G | H | -0.4550 | |
| 53 | S | H | -0.3701 | |
| 54 | T | H | -0.3409 | |
| 55 | S | H | -0.7315 | |
| 56 | S | H | -0.6521 | |
| 57 | H | H | -0.8468 | |
| 58 | T | H | -0.3452 | |
| 59 | Y | H | -0.2521 | |
| 60 | Y | H | -0.6908 | |
| 61 | A | H | -1.3597 | |
| 62 | D | H | -2.3347 | |
| 63 | S | H | -1.7454 | |
| 64 | V | H | 0.0000 | |
| 65 | K | H | -2.5358 | |
| 66 | G | H | -1.7854 | |
| 67 | R | H | -1.6143 | |
| 68 | F | H | 0.0000 | |
| 69 | T | H | -0.8367 | |
| 70 | I | H | 0.0000 | |
| 71 | S | H | -0.5131 | |
| 72 | R | H | -0.9831 | |
| 73 | D | H | -1.5780 | |
| 74 | N | H | -1.9030 | |
| 75 | S | H | -1.7043 | |
| 76 | K | H | -2.4365 | |
| 77 | N | H | -2.0801 | |
| 78 | T | H | -1.1749 | |
| 79 | L | H | 0.0000 | |
| 80 | Y | H | -0.2965 | |
| 81 | L | H | 0.0000 | |
| 82 | Q | H | -1.1736 | |
| 83 | M | H | 0.0000 | |
| 84 | N | H | -1.7518 | |
| 85 | S | H | -1.3659 | |
| 86 | L | H | 0.0000 | |
| 87 | R | H | -2.1577 | |
| 88 | A | H | -1.6367 | |
| 89 | E | H | -2.1585 | |
| 90 | D | H | 0.0000 | |
| 91 | T | H | -0.6449 | |
| 92 | A | H | 0.0000 | |
| 93 | V | H | 0.0000 | |
| 94 | Y | H | 0.0000 | |
| 95 | Y | H | 0.0000 | |
| 96 | C | H | 0.0000 | |
| 97 | A | H | 0.0000 | |
| 98 | R | H | 0.0000 | |
| 99 | V | H | 0.0000 | |
| 100 | Y | H | 0.3133 | |
| 101 | S | H | -0.0374 | |
| 102 | S | H | -0.1752 | |
| 103 | P | H | 0.0000 | |
| 104 | G | H | 0.0000 | |
| 105 | I | H | 0.0000 | |
| 106 | D | H | -0.2818 | |
| 107 | Y | H | 0.1605 | |
| 108 | W | H | -0.2904 | |
| 109 | G | H | 0.0000 | |
| 110 | Q | H | -0.8927 | |
| 111 | G | H | 0.0000 | |
| 112 | T | H | 0.0000 | |
| 113 | L | H | 0.0000 | |
| 114 | V | H | 0.0000 | |
| 115 | T | H | 0.0000 | |
| 116 | V | H | 0.0000 | |
| 117 | S | H | -0.8104 | |
| 118 | S | H | -0.4935 | |
| 2 | S | L | -0.6856 | |
| 3 | D | L | -0.9472 | |
| 4 | I | L | 0.0000 | |
| 5 | Q | L | -1.8017 | |
| 6 | M | L | 0.0000 | |
| 7 | T | L | -1.3754 | |
| 8 | Q | L | 0.0000 | |
| 9 | S | L | -0.6514 | |
| 10 | P | L | -0.6456 | |
| 11 | S | L | -0.9637 | |
| 12 | S | L | -1.0468 | |
| 13 | L | L | -0.5490 | |
| 14 | S | L | -0.5463 | |
| 15 | A | L | 0.0000 | |
| 16 | S | L | -0.0918 | |
| 17 | V | L | 0.5219 | |
| 18 | G | L | -0.7176 | |
| 19 | D | L | -1.5136 | |
| 20 | R | L | -2.2679 | |
| 21 | V | L | 0.0000 | |
| 22 | T | L | -0.5711 | |
| 23 | I | L | 0.0000 | |
| 24 | T | L | -0.8188 | |
| 25 | C | L | 0.0000 | |
| 26 | R | L | -2.4598 | |
| 27 | A | L | 0.0000 | |
| 28 | S | L | -1.4014 | |
| 29 | Q | L | -1.0505 | |
| 30 | S | L | -0.8563 | |
| 31 | I | L | 0.0000 | |
| 32 | G | L | -0.5966 | |
| 33 | S | L | -0.4368 | |
| 34 | T | L | 0.0000 | |
| 35 | L | L | 0.0000 | |
| 36 | N | L | 0.0000 | |
| 37 | W | L | 0.0000 | |
| 38 | Y | L | 0.0000 | |
| 39 | Q | L | 0.0000 | |
| 40 | Q | L | 0.0000 | |
| 41 | K | L | -1.7183 | |
| 42 | P | L | -1.3237 | |
| 43 | G | L | -1.7670 | |
| 44 | K | L | -2.4257 | |
| 45 | A | L | -1.3644 | |
| 46 | P | L | 0.0000 | |
| 47 | K | L | -1.6707 | |
| 48 | L | L | 0.0000 | |
| 49 | L | L | 0.0000 | |
| 50 | I | L | 0.0000 | |
| 51 | Y | L | 0.1802 | |
| 52 | G | L | 0.0000 | |
| 53 | A | L | 0.0000 | |
| 54 | S | L | -0.2765 | |
| 55 | S | L | 0.0007 | |
| 56 | L | L | 0.1950 | |
| 57 | Q | L | -0.4326 | |
| 58 | S | L | -0.4485 | |
| 59 | G | L | -0.5197 | |
| 60 | V | L | -0.3834 | |
| 61 | P | L | -0.3583 | |
| 62 | S | L | -0.4413 | |
| 63 | R | L | -0.9860 | |
| 64 | F | L | 0.0000 | |
| 65 | S | L | -0.2936 | |
| 66 | G | L | -0.2403 | |
| 67 | S | L | -0.5870 | |
| 68 | G | L | -1.0564 | |
| 69 | S | L | -0.8388 | |
| 70 | G | L | -1.0219 | |
| 71 | T | L | -1.4906 | |
| 72 | D | L | -2.1217 | |
| 73 | F | L | 0.0000 | |
| 74 | T | L | -0.7261 | |
| 75 | L | L | 0.0000 | |
| 76 | T | L | -0.6294 | |
| 77 | I | L | 0.0000 | |
| 78 | S | L | -1.6112 | |
| 79 | S | L | -1.2411 | |
| 80 | L | L | 0.0000 | |
| 81 | Q | L | -1.0134 | |
| 82 | P | L | -0.7584 | |
| 83 | E | L | -1.9283 | |
| 84 | D | L | 0.0000 | |
| 85 | F | L | -0.5530 | |
| 86 | A | L | 0.0000 | |
| 87 | T | L | -1.1236 | |
| 88 | Y | L | 0.0000 | |
| 89 | Y | L | 0.0000 | |
| 90 | C | L | 0.0000 | |
| 91 | Q | L | 0.0000 | |
| 92 | Q | L | 0.0000 | |
| 93 | Y | L | 0.0000 | |
| 94 | Y | L | 0.0000 | |
| 95 | T | L | 0.0000 | |
| 96 | W | L | 0.0000 | |
| 97 | V | L | 0.1215 | |
| 98 | P | L | -0.2329 | |
| 99 | F | L | 0.0000 | |
| 100 | T | L | -0.6432 | |
| 101 | F | L | -0.5988 | |
| 102 | G | L | 0.0000 | |
| 103 | Q | L | -1.8032 | |
| 104 | G | L | 0.0000 | |
| 105 | T | L | 0.0000 | |
| 106 | K | L | -2.1082 | |
| 107 | L | L | 0.0000 | |
| 108 | E | L | -0.4403 | |
| 109 | I | L | 1.0760 | |
| 110 | K | L | -0.6774 |
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