| Chain sequence(s) |
A: VLSPADKTNVKAAWGKVGAHAGEYGAEALERMFLSFPTTKTYFPHFDLSHGSAQVKGHGKKVADALTNAVAHVDDMPNALSALSDLHAHKLRVDPVNFKLLSHCLLVTLAAHLPAEFTPAVHASLDKFLASVSTVLTSKYR
C: VLSPADKTNVKAAWGKVGAHAGEYGAEALERMFLSFPTTKTYFPHFDLSHGSAQVKGHGKKVADALTNAVAHVDDMPNALSALSDLHAHKLRVDPVNFKLLSHCLLVTLAAHLPAEFTPAVHASLDKFLASVSTVLTSKYR B: VHLTPEEKTAVNALWGKVNVDAVGGEALGRLLVVYPWTQRFFESFGDLSSPDAVMGNPKVKAHGKKVLGAFSDGLAHLDNLKGTFSQLSELHCDKLHVDPENFRLLGNVLVCVLARNFGKEFTPQMQAAYQKVVAGVANALAHKYH D: VHLTPEEKTAVNALWGKVNVDAVGGEALGRLLVVYPWTQRFFESFGDLSSPDAVMGNPKVKAHGKKVLGAFSDGLAHLDNLKGTFSQLSELHCDKLHVDPENFRLLGNVLVCVLARNFGKEFTPQMQAAYQKVVAGVANALAHKYH 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] (00:00:01)
[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] Analysis: Starting Aggrescan3D on folded.pdb (00:17:53)
[INFO] Main: Simulation completed successfully. (00:18:00)
|
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 | 0.1310 | |
| 2 | L | A | 0.0000 | |
| 3 | S | A | 0.0000 | |
| 4 | P | A | -0.6827 | |
| 5 | A | A | -0.6135 | |
| 6 | D | A | 0.0000 | |
| 7 | K | A | -0.9954 | |
| 8 | T | A | -0.7324 | |
| 9 | N | A | -0.7503 | |
| 10 | V | A | 0.0000 | |
| 11 | K | A | -1.5339 | |
| 12 | A | A | -1.2531 | |
| 13 | A | A | 0.0000 | |
| 14 | W | A | 0.0000 | |
| 15 | G | A | -1.6708 | |
| 16 | K | A | -2.0996 | |
| 17 | V | A | 0.0000 | |
| 18 | G | A | -1.2187 | |
| 19 | A | A | -1.0212 | |
| 20 | H | A | -1.9188 | |
| 21 | A | A | 0.0000 | |
| 22 | G | A | -2.6181 | |
| 23 | E | A | -2.5245 | |
| 24 | Y | A | 0.0000 | |
| 25 | G | A | 0.0000 | |
| 26 | A | A | 0.0000 | |
| 27 | E | A | -1.1867 | |
| 28 | A | A | 0.0000 | |
| 29 | L | A | 0.0000 | |
| 30 | E | A | -0.6913 | |
| 31 | R | A | 0.0000 | |
| 32 | M | A | 0.0000 | |
| 33 | F | A | 0.0000 | |
| 34 | L | A | 0.3743 | |
| 35 | S | A | 0.1690 | |
| 36 | F | A | 0.2825 | |
| 37 | P | A | -0.0926 | |
| 38 | T | A | -0.4118 | |
| 39 | T | A | 0.0000 | |
| 40 | K | A | -0.5079 | |
| 41 | T | A | -0.4273 | |
| 42 | Y | A | 0.0128 | |
| 43 | F | A | -0.3477 | |
| 44 | P | A | -0.8332 | |
| 45 | H | A | -1.3041 | |
| 46 | F | A | -1.2384 | |
| 47 | D | A | -2.1278 | |
| 48 | L | A | -1.3508 | |
| 49 | S | A | -1.1971 | |
| 50 | H | A | -1.5928 | |
| 51 | G | A | -1.5555 | |
| 52 | S | A | 0.0000 | |
| 53 | A | A | -1.2808 | |
| 54 | Q | A | -1.5169 | |
| 55 | V | A | 0.0000 | |
| 56 | K | A | -2.7169 | |
| 57 | G | A | -2.1584 | |
| 58 | H | A | -2.0068 | |
| 59 | G | A | 0.0000 | |
| 60 | K | A | -3.4339 | |
| 61 | K | A | -2.9327 | |
| 62 | V | A | -1.4250 | |
| 63 | A | A | 0.0000 | |
| 64 | D | A | -2.1929 | |
| 65 | A | A | -1.2319 | |
| 66 | L | A | 0.0000 | |
| 67 | T | A | -1.1908 | |
| 68 | N | A | -1.1186 | |
| 69 | A | A | 0.0000 | |
| 70 | V | A | 0.0000 | |
| 71 | A | A | -1.1726 | |
| 72 | H | A | -2.0562 | |
| 73 | V | A | -1.8369 | |
| 74 | D | A | -2.9212 | |
| 75 | D | A | -3.0996 | |
| 76 | M | A | 0.0000 | |
| 77 | P | A | -1.5038 | |
| 78 | N | A | -2.2954 | |
| 79 | A | A | -1.4757 | |
| 80 | L | A | 0.0000 | |
| 81 | S | A | -0.9695 | |
| 82 | A | A | -0.4089 | |
| 83 | L | A | -0.2056 | |
| 84 | S | A | 0.0000 | |
| 85 | D | A | -2.1153 | |
| 86 | L | A | -0.7552 | |
| 87 | H | A | -0.8410 | |
| 88 | A | A | 0.0000 | |
| 89 | H | A | -2.2421 | |
| 90 | K | A | -2.1871 | |
| 91 | L | A | -0.8311 | |
| 92 | R | A | -0.9024 | |
| 93 | V | A | -0.1362 | |
| 94 | D | A | 0.0000 | |
| 95 | P | A | -0.2253 | |
| 96 | V | A | -0.4327 | |
| 97 | N | A | -0.2362 | |
| 98 | F | A | -0.3729 | |
| 99 | K | A | -1.3361 | |
| 100 | L | A | -0.2730 | |
| 101 | L | A | -0.0014 | |
| 102 | S | A | -0.4143 | |
| 103 | H | A | 0.0000 | |
| 104 | C | A | 0.0000 | |
| 105 | L | A | 0.0000 | |
| 106 | L | A | 0.0000 | |
| 107 | V | A | 0.0000 | |
| 108 | T | A | 0.0000 | |
| 109 | L | A | 0.0000 | |
| 110 | A | A | 0.0000 | |
| 111 | A | A | 0.0000 | |
| 112 | H | A | -0.7902 | |
| 113 | L | A | -0.5417 | |
| 114 | P | A | -0.6095 | |
| 115 | A | A | -0.4134 | |
| 116 | E | A | -0.9497 | |
| 117 | F | A | 0.0000 | |
| 118 | T | A | -0.4644 | |
| 119 | P | A | -0.3669 | |
| 120 | A | A | -0.3746 | |
| 121 | V | A | -0.2771 | |
| 122 | H | A | 0.0000 | |
| 123 | A | A | -0.1276 | |
| 124 | S | A | 0.0000 | |
| 125 | L | A | 0.0000 | |
| 126 | D | A | -0.5561 | |
| 127 | K | A | -0.3448 | |
| 128 | F | A | 0.0000 | |
| 129 | L | A | 0.0000 | |
| 130 | A | A | -0.4379 | |
| 131 | S | A | 0.0149 | |
| 132 | V | A | 0.0000 | |
| 133 | S | A | 0.0000 | |
| 134 | T | A | 0.0352 | |
| 135 | V | A | 0.0000 | |
| 136 | L | A | 0.0000 | |
| 137 | T | A | -0.2423 | |
| 138 | S | A | 0.0000 | |
| 139 | K | A | -1.5744 | |
| 140 | Y | A | -1.3923 | |
| 141 | R | A | -2.2620 | |
| 1 | V | B | -0.9847 | |
| 2 | H | B | -1.4527 | |
| 3 | L | B | 0.0000 | |
| 4 | T | B | -1.2407 | |
| 5 | P | B | -1.5925 | |
| 6 | E | B | -2.4009 | |
| 7 | E | B | -1.9254 | |
| 8 | K | B | -1.9015 | |
| 9 | T | B | -1.4637 | |
| 10 | A | B | -1.2591 | |
| 11 | V | B | 0.0000 | |
| 12 | N | B | -1.6360 | |
| 13 | A | B | -1.0392 | |
| 14 | L | B | 0.0000 | |
| 15 | W | B | -0.9727 | |
| 16 | G | B | -1.4498 | |
| 17 | K | B | -2.0245 | |
| 18 | V | B | 0.0000 | |
| 19 | N | B | -1.6341 | |
| 20 | V | B | -0.4616 | |
| 21 | D | B | -1.9749 | |
| 22 | A | B | -1.1814 | |
| 23 | V | B | 0.0000 | |
| 24 | G | B | 0.0000 | |
| 25 | G | B | 0.0000 | |
| 26 | E | B | -0.7533 | |
| 27 | A | B | 0.0000 | |
| 28 | L | B | 0.0000 | |
| 29 | G | B | 0.0000 | |
| 30 | R | B | 0.0000 | |
| 31 | L | B | 0.0000 | |
| 32 | L | B | 0.0000 | |
| 33 | V | B | 0.0000 | |
| 34 | V | B | 0.0000 | |
| 35 | Y | B | 0.1594 | |
| 36 | P | B | -0.2390 | |
| 37 | W | B | -0.1436 | |
| 38 | T | B | 0.0000 | |
| 39 | Q | B | 0.0000 | |
| 40 | R | B | -0.8298 | |
| 41 | F | B | 0.1716 | |
| 42 | F | B | -0.8101 | |
| 43 | E | B | -2.1018 | |
| 44 | S | B | -1.3801 | |
| 45 | F | B | -1.4159 | |
| 46 | G | B | -1.9840 | |
| 47 | D | B | -2.3466 | |
| 48 | L | B | 0.0000 | |
| 49 | S | B | -1.2296 | |
| 50 | S | B | -1.0816 | |
| 51 | P | B | -1.0480 | |
| 52 | D | B | -1.9722 | |
| 53 | A | B | -1.6124 | |
| 54 | V | B | 0.0000 | |
| 55 | M | B | -1.1632 | |
| 56 | G | B | -1.4363 | |
| 57 | N | B | -1.7155 | |
| 58 | P | B | -1.4498 | |
| 59 | K | B | -1.9711 | |
| 60 | V | B | 0.0000 | |
| 61 | K | B | -2.6218 | |
| 62 | A | B | -2.1926 | |
| 63 | H | B | -1.9292 | |
| 64 | G | B | 0.0000 | |
| 65 | K | B | -2.4210 | |
| 66 | K | B | -2.4129 | |
| 67 | V | B | -1.0297 | |
| 68 | L | B | 0.0000 | |
| 69 | G | B | -1.2501 | |
| 70 | A | B | -1.1145 | |
| 71 | F | B | 0.0000 | |
| 72 | S | B | -1.1402 | |
| 73 | D | B | -1.8702 | |
| 74 | G | B | 0.0000 | |
| 75 | L | B | 0.0000 | |
| 76 | A | B | -1.4162 | |
| 77 | H | B | -2.1603 | |
| 78 | L | B | 0.0000 | |
| 79 | D | B | -2.9618 | |
| 80 | N | B | -2.8123 | |
| 81 | L | B | 0.0000 | |
| 82 | K | B | -2.0239 | |
| 83 | G | B | -1.7362 | |
| 84 | T | B | -1.6124 | |
| 85 | F | B | 0.0000 | |
| 86 | S | B | -1.5794 | |
| 87 | Q | B | -1.6184 | |
| 88 | L | B | -1.0295 | |
| 89 | S | B | 0.0000 | |
| 90 | E | B | -2.4572 | |
| 91 | L | B | -1.3781 | |
| 92 | H | B | -1.3374 | |
| 93 | C | B | 0.0000 | |
| 94 | D | B | -2.9769 | |
| 95 | K | B | -2.4222 | |
| 96 | L | B | -0.7893 | |
| 97 | H | B | -1.2743 | |
| 98 | V | B | 0.0000 | |
| 99 | D | B | -0.8740 | |
| 100 | P | B | -1.2200 | |
| 101 | E | B | -1.8796 | |
| 102 | N | B | 0.0000 | |
| 103 | F | B | 0.0000 | |
| 104 | R | B | -2.2280 | |
| 105 | L | B | -0.9927 | |
| 106 | L | B | -0.4636 | |
| 107 | G | B | 0.0000 | |
| 108 | N | B | -0.6227 | |
| 109 | V | B | 0.0000 | |
| 110 | L | B | 0.0000 | |
| 111 | V | B | 0.0000 | |
| 112 | C | B | 0.0000 | |
| 113 | V | B | 0.0000 | |
| 114 | L | B | 0.0000 | |
| 115 | A | B | 0.0000 | |
| 116 | R | B | -1.1478 | |
| 117 | N | B | -1.4979 | |
| 118 | F | B | -1.4115 | |
| 119 | G | B | -1.6578 | |
| 120 | K | B | -2.5569 | |
| 121 | E | B | -2.4221 | |
| 122 | F | B | 0.0000 | |
| 123 | T | B | -1.2732 | |
| 124 | P | B | -0.9074 | |
| 125 | Q | B | -1.0545 | |
| 126 | M | B | -0.7762 | |
| 127 | Q | B | 0.0000 | |
| 128 | A | B | 0.0000 | |
| 129 | A | B | 0.0000 | |
| 130 | Y | B | 0.0000 | |
| 131 | Q | B | 0.0000 | |
| 132 | K | B | -0.8743 | |
| 133 | V | B | 0.0000 | |
| 134 | V | B | 0.0000 | |
| 135 | A | B | -0.8086 | |
| 136 | G | B | -1.0240 | |
| 137 | V | B | 0.0000 | |
| 138 | A | B | 0.0000 | |
| 139 | N | B | -1.0264 | |
| 140 | A | B | 0.0000 | |
| 141 | L | B | -0.8468 | |
| 142 | A | B | 0.0000 | |
| 143 | H | B | -1.4286 | |
| 144 | K | B | -2.1179 | |
| 145 | Y | B | -0.8614 | |
| 146 | H | B | -0.7715 | |
| 1 | V | C | 0.1353 | |
| 2 | L | C | 0.0000 | |
| 3 | S | C | 0.0000 | |
| 4 | P | C | -0.7446 | |
| 5 | A | C | -0.5700 | |
| 6 | D | C | 0.0000 | |
| 7 | K | C | -1.0170 | |
| 8 | T | C | -0.6927 | |
| 9 | N | C | -0.7468 | |
| 10 | V | C | 0.0000 | |
| 11 | K | C | -1.4992 | |
| 12 | A | C | -1.2962 | |
| 13 | A | C | 0.0000 | |
| 14 | W | C | 0.0000 | |
| 15 | G | C | -1.7902 | |
| 16 | K | C | -2.3449 | |
| 17 | V | C | 0.0000 | |
| 18 | G | C | -1.3085 | |
| 19 | A | C | -1.0850 | |
| 20 | H | C | -1.7207 | |
| 21 | A | C | 0.0000 | |
| 22 | G | C | -2.1384 | |
| 23 | E | C | -1.8826 | |
| 24 | Y | C | 0.0000 | |
| 25 | G | C | 0.0000 | |
| 26 | A | C | 0.0000 | |
| 27 | E | C | -0.9822 | |
| 28 | A | C | 0.0000 | |
| 29 | L | C | 0.0000 | |
| 30 | E | C | -1.0488 | |
| 31 | R | C | 0.0000 | |
| 32 | M | C | 0.0000 | |
| 33 | F | C | 0.0000 | |
| 34 | L | C | -0.0285 | |
| 35 | S | C | -0.0603 | |
| 36 | F | C | 0.1323 | |
| 37 | P | C | -0.1544 | |
| 38 | T | C | -0.4513 | |
| 39 | T | C | 0.0000 | |
| 40 | K | C | -0.5131 | |
| 41 | T | C | -0.3841 | |
| 42 | Y | C | 0.0653 | |
| 43 | F | C | -0.2842 | |
| 44 | P | C | -0.7842 | |
| 45 | H | C | -1.2796 | |
| 46 | F | C | -1.0784 | |
| 47 | D | C | -2.1441 | |
| 48 | L | C | -1.3688 | |
| 49 | S | C | -1.1212 | |
| 50 | H | C | -1.6606 | |
| 51 | G | C | -1.7439 | |
| 52 | S | C | -1.5733 | |
| 53 | A | C | -1.2386 | |
| 54 | Q | C | -1.7853 | |
| 55 | V | C | 0.0000 | |
| 56 | K | C | -2.6115 | |
| 57 | G | C | -2.0356 | |
| 58 | H | C | -1.9654 | |
| 59 | G | C | 0.0000 | |
| 60 | K | C | -2.9437 | |
| 61 | K | C | -2.6819 | |
| 62 | V | C | -1.4448 | |
| 63 | A | C | 0.0000 | |
| 64 | D | C | -1.8954 | |
| 65 | A | C | -1.1769 | |
| 66 | L | C | 0.0000 | |
| 67 | T | C | -1.2785 | |
| 68 | N | C | -1.3899 | |
| 69 | A | C | 0.0000 | |
| 70 | V | C | 0.0000 | |
| 71 | A | C | -1.3800 | |
| 72 | H | C | -2.2169 | |
| 73 | V | C | -1.9051 | |
| 74 | D | C | -2.8458 | |
| 75 | D | C | -3.1074 | |
| 76 | M | C | 0.0000 | |
| 77 | P | C | -1.5990 | |
| 78 | N | C | -2.0608 | |
| 79 | A | C | -1.5929 | |
| 80 | L | C | 0.0000 | |
| 81 | S | C | -0.8269 | |
| 82 | A | C | -0.1686 | |
| 83 | L | C | -0.0813 | |
| 84 | S | C | 0.0000 | |
| 85 | D | C | -1.2648 | |
| 86 | L | C | -0.4540 | |
| 87 | H | C | -0.6063 | |
| 88 | A | C | 0.0000 | |
| 89 | H | C | -1.9395 | |
| 90 | K | C | -1.9509 | |
| 91 | L | C | -0.7469 | |
| 92 | R | C | -0.7809 | |
| 93 | V | C | -0.1372 | |
| 94 | D | C | 0.0000 | |
| 95 | P | C | -0.3325 | |
| 96 | V | C | -0.4070 | |
| 97 | N | C | -0.2290 | |
| 98 | F | C | -0.3843 | |
| 99 | K | C | -1.3531 | |
| 100 | L | C | -0.3264 | |
| 101 | L | C | -0.0495 | |
| 102 | S | C | -0.4065 | |
| 103 | H | C | 0.0000 | |
| 104 | C | C | 0.0000 | |
| 105 | L | C | 0.0000 | |
| 106 | L | C | 0.0000 | |
| 107 | V | C | 0.0000 | |
| 108 | T | C | 0.0000 | |
| 109 | L | C | 0.0000 | |
| 110 | A | C | 0.0000 | |
| 111 | A | C | -1.1200 | |
| 112 | H | C | -0.8639 | |
| 113 | L | C | -0.5271 | |
| 114 | P | C | -0.5436 | |
| 115 | A | C | -0.3463 | |
| 116 | E | C | -0.8954 | |
| 117 | F | C | 0.0000 | |
| 118 | T | C | -0.2227 | |
| 119 | P | C | -0.2674 | |
| 120 | A | C | -0.2694 | |
| 121 | V | C | -0.1957 | |
| 122 | H | C | 0.0000 | |
| 123 | A | C | -0.0875 | |
| 124 | S | C | 0.0000 | |
| 125 | L | C | 0.0000 | |
| 126 | D | C | -0.5797 | |
| 127 | K | C | -0.3654 | |
| 128 | F | C | 0.0000 | |
| 129 | L | C | 0.0000 | |
| 130 | A | C | -0.4182 | |
| 131 | S | C | 0.0314 | |
| 132 | V | C | 0.0000 | |
| 133 | S | C | -0.3118 | |
| 134 | T | C | -0.0198 | |
| 135 | V | C | 0.0000 | |
| 136 | L | C | 0.0000 | |
| 137 | T | C | -0.1212 | |
| 138 | S | C | 0.0000 | |
| 139 | K | C | -1.3090 | |
| 140 | Y | C | -1.2557 | |
| 141 | R | C | -2.1130 | |
| 1 | V | D | -0.6046 | |
| 2 | H | D | -1.2165 | |
| 3 | L | D | 0.0000 | |
| 4 | T | D | -1.3156 | |
| 5 | P | D | -1.6615 | |
| 6 | E | D | -2.3663 | |
| 7 | E | D | -2.1364 | |
| 8 | K | D | -2.1111 | |
| 9 | T | D | -1.6156 | |
| 10 | A | D | -1.3704 | |
| 11 | V | D | 0.0000 | |
| 12 | N | D | -1.7768 | |
| 13 | A | D | -1.1801 | |
| 14 | L | D | 0.0000 | |
| 15 | W | D | -1.1571 | |
| 16 | G | D | -1.6379 | |
| 17 | K | D | -2.1706 | |
| 18 | V | D | -1.6407 | |
| 19 | N | D | -2.1364 | |
| 20 | V | D | -1.8058 | |
| 21 | D | D | -2.6233 | |
| 22 | A | D | -1.4926 | |
| 23 | V | D | 0.0000 | |
| 24 | G | D | 0.0000 | |
| 25 | G | D | 0.0000 | |
| 26 | E | D | -0.7313 | |
| 27 | A | D | 0.0000 | |
| 28 | L | D | 0.0000 | |
| 29 | G | D | 0.0000 | |
| 30 | R | D | 0.0000 | |
| 31 | L | D | 0.0000 | |
| 32 | L | D | 0.0000 | |
| 33 | V | D | 0.0210 | |
| 34 | V | D | 0.0000 | |
| 35 | Y | D | 0.1878 | |
| 36 | P | D | -0.1960 | |
| 37 | W | D | -0.1409 | |
| 38 | T | D | 0.0000 | |
| 39 | Q | D | 0.0000 | |
| 40 | R | D | -0.7896 | |
| 41 | F | D | 0.1012 | |
| 42 | F | D | -0.8511 | |
| 43 | E | D | -2.0858 | |
| 44 | S | D | -1.3951 | |
| 45 | F | D | -1.4170 | |
| 46 | G | D | -1.9973 | |
| 47 | D | D | -2.7254 | |
| 48 | L | D | 0.0000 | |
| 49 | S | D | -1.2430 | |
| 50 | S | D | -1.0908 | |
| 51 | P | D | -1.0328 | |
| 52 | D | D | -2.1279 | |
| 53 | A | D | -1.6245 | |
| 54 | V | D | 0.0000 | |
| 55 | M | D | -1.0716 | |
| 56 | G | D | -1.5717 | |
| 57 | N | D | 0.0000 | |
| 58 | P | D | -1.6184 | |
| 59 | K | D | -2.2060 | |
| 60 | V | D | 0.0000 | |
| 61 | K | D | -2.5434 | |
| 62 | A | D | -2.1056 | |
| 63 | H | D | -2.1165 | |
| 64 | G | D | 0.0000 | |
| 65 | K | D | -2.6844 | |
| 66 | K | D | -2.4668 | |
| 67 | V | D | -1.0503 | |
| 68 | L | D | 0.0000 | |
| 69 | G | D | -1.3255 | |
| 70 | A | D | -0.9884 | |
| 71 | F | D | 0.0000 | |
| 72 | S | D | -1.1143 | |
| 73 | D | D | -1.4763 | |
| 74 | G | D | 0.0000 | |
| 75 | L | D | 0.0000 | |
| 76 | A | D | -1.2041 | |
| 77 | H | D | -1.8790 | |
| 78 | L | D | -1.7055 | |
| 79 | D | D | -2.6724 | |
| 80 | N | D | -2.5820 | |
| 81 | L | D | 0.0000 | |
| 82 | K | D | -1.7686 | |
| 83 | G | D | -1.7774 | |
| 84 | T | D | -1.5532 | |
| 85 | F | D | 0.0000 | |
| 86 | S | D | -1.3739 | |
| 87 | Q | D | -1.7482 | |
| 88 | L | D | -0.8045 | |
| 89 | S | D | 0.0000 | |
| 90 | E | D | -2.7900 | |
| 91 | L | D | -1.6302 | |
| 92 | H | D | -1.2818 | |
| 93 | C | D | -1.6682 | |
| 94 | D | D | -2.9227 | |
| 95 | K | D | -2.5281 | |
| 96 | L | D | -0.7733 | |
| 97 | H | D | -1.2137 | |
| 98 | V | D | -0.5688 | |
| 99 | D | D | -0.7326 | |
| 100 | P | D | -1.1704 | |
| 101 | E | D | -1.5615 | |
| 102 | N | D | 0.0000 | |
| 103 | F | D | 0.0000 | |
| 104 | R | D | -1.2243 | |
| 105 | L | D | -0.5342 | |
| 106 | L | D | -0.1903 | |
| 107 | G | D | 0.0000 | |
| 108 | N | D | -0.3888 | |
| 109 | V | D | 0.0000 | |
| 110 | L | D | 0.0000 | |
| 111 | V | D | 0.0000 | |
| 112 | C | D | 0.0000 | |
| 113 | V | D | 0.0000 | |
| 114 | L | D | 0.0000 | |
| 115 | A | D | 0.0000 | |
| 116 | R | D | -1.1644 | |
| 117 | N | D | -1.3170 | |
| 118 | F | D | -1.4354 | |
| 119 | G | D | -1.7614 | |
| 120 | K | D | -2.7514 | |
| 121 | E | D | -2.8124 | |
| 122 | F | D | 0.0000 | |
| 123 | T | D | -1.4545 | |
| 124 | P | D | 0.0000 | |
| 125 | Q | D | -1.3177 | |
| 126 | M | D | -0.9188 | |
| 127 | Q | D | 0.0000 | |
| 128 | A | D | 0.0000 | |
| 129 | A | D | 0.0000 | |
| 130 | Y | D | 0.0000 | |
| 131 | Q | D | 0.0000 | |
| 132 | K | D | -0.7987 | |
| 133 | V | D | 0.0000 | |
| 134 | V | D | 0.0000 | |
| 135 | A | D | -0.4405 | |
| 136 | G | D | -0.5642 | |
| 137 | V | D | 0.0000 | |
| 138 | A | D | 0.0000 | |
| 139 | N | D | -0.6953 | |
| 140 | A | D | 0.0000 | |
| 141 | L | D | -0.7310 | |
| 142 | A | D | 0.0000 | |
| 143 | H | D | -0.8953 | |
| 144 | K | D | -0.9432 | |
| 145 | Y | D | 0.1326 | |
| 146 | H | D | -1.0089 |
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