| Chain sequence(s) |
A: NSDLGTWQMDCTHLEGKIVIVAVHVASGFIEAEVIPQETGRQTALFLLKLAGRWPITHLHTDNGANFASQEVKMVAWWAGIEHTFGEAMNHHLKNQIDRIREQANSVETIVLMAVHCMNHKRRGGIGDMTPAERLINMITTEQEIQFQ
X: KNSKFKNFRVYYREGRDQLWKGPGELLWKGEGAVLLKVGTDIKVVPRRKAKIIKD C: NSDLGTWQMDCTHLEGKIVIVAVHVASGFIEAEVIPQETGRQTALFLLKLAGRWPITHLHTDNGANFASQEVKMVAWWAGIEHTFGVEAMNHHLKNQIDRIREQANSVETIVLMAVHCMNHKRRGGIGDMTPAERLINMITTE B: NSDLGTWQMDCTHLEGKIVIVAVHVASGFIEAEVIPQETGRQTALFLLKLAGRWPITHLHTDNGANFASQEVKMVAWWAGIEHTFGEAMNHHLKNQIDRIREQANSVETIVLMAVHCMNHKRRGGIGDMTPAERLINMITTE D: NSDLGTWQMDCTHLEGKIVIVAVHVASGFIEAEVIPQETGRQTALFLLKLAGRWPITHLHTDNGANFASQEVKMVAWWAGIEHTFGEAMNHHLKNQIDRIREQANSVETIVLMAVHCMNHKRRGGIGDMTPAERLINMITTE input PDB |
| Selected Chain(s) | A,X,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 (00:16:04)
[INFO] Main: Simulation completed successfully. (00:16:12)
|
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 | |
| 55 | N | A | -2.5507 | |
| 56 | S | A | 0.0000 | |
| 57 | D | A | -1.5287 | |
| 58 | L | A | -0.5990 | |
| 59 | G | A | 0.0000 | |
| 60 | T | A | 0.0000 | |
| 61 | W | A | 0.0000 | |
| 62 | Q | A | -0.9634 | |
| 63 | M | A | 0.0000 | |
| 64 | D | A | -1.5624 | |
| 65 | C | A | -0.9837 | |
| 66 | T | A | -0.9156 | |
| 67 | H | A | -1.7142 | |
| 68 | L | A | -1.5979 | |
| 69 | E | A | -2.3371 | |
| 70 | G | A | -1.7976 | |
| 71 | K | A | -2.0642 | |
| 72 | I | A | -1.5526 | |
| 73 | V | A | 0.0000 | |
| 74 | I | A | 0.0000 | |
| 75 | V | A | 0.0000 | |
| 76 | A | A | 0.0000 | |
| 77 | V | A | -0.2059 | |
| 78 | H | A | 0.0000 | |
| 79 | V | A | -0.0442 | |
| 80 | A | A | 0.0000 | |
| 81 | S | A | -0.0411 | |
| 82 | G | A | 0.0000 | |
| 83 | F | A | 0.0000 | |
| 84 | I | A | 0.0000 | |
| 85 | E | A | 0.0000 | |
| 86 | A | A | 0.0000 | |
| 87 | E | A | -0.3833 | |
| 88 | V | A | -0.7391 | |
| 89 | I | A | 0.0000 | |
| 90 | P | A | -1.2769 | |
| 91 | Q | A | -2.3525 | |
| 92 | E | A | -2.6797 | |
| 93 | T | A | -1.6837 | |
| 94 | G | A | 0.0000 | |
| 95 | R | A | -1.6260 | |
| 96 | Q | A | -1.3094 | |
| 97 | T | A | 0.0000 | |
| 98 | A | A | 0.0000 | |
| 99 | L | A | -0.3936 | |
| 100 | F | A | 0.0000 | |
| 101 | L | A | 0.0000 | |
| 102 | L | A | 0.0000 | |
| 103 | K | A | -0.3170 | |
| 104 | L | A | 0.0000 | |
| 105 | A | A | 0.0000 | |
| 106 | G | A | 0.0000 | |
| 107 | R | A | 0.0000 | |
| 108 | W | A | 0.0000 | |
| 109 | P | A | -0.2019 | |
| 110 | I | A | 0.0000 | |
| 111 | T | A | -0.7302 | |
| 112 | H | A | -1.2073 | |
| 113 | L | A | 0.0000 | |
| 114 | H | A | -1.2765 | |
| 115 | T | A | 0.0000 | |
| 116 | D | A | -2.3950 | |
| 117 | N | A | -1.8276 | |
| 118 | G | A | -1.0411 | |
| 119 | A | A | -0.6976 | |
| 120 | N | A | 0.0000 | |
| 121 | F | A | 0.0000 | |
| 122 | A | A | -1.1106 | |
| 123 | S | A | -1.5503 | |
| 124 | Q | A | -2.3312 | |
| 125 | E | A | -2.1602 | |
| 126 | V | A | 0.0000 | |
| 127 | K | A | -2.2310 | |
| 128 | M | A | -0.8778 | |
| 129 | V | A | 0.0000 | |
| 130 | A | A | 0.0000 | |
| 131 | W | A | 0.3232 | |
| 132 | W | A | 0.3046 | |
| 133 | A | A | 0.0567 | |
| 134 | G | A | -0.4327 | |
| 135 | I | A | 0.0000 | |
| 136 | E | A | -2.0733 | |
| 137 | H | A | -1.2847 | |
| 138 | T | A | -0.6279 | |
| 139 | F | A | -0.1325 | |
| 140 | G | A | -1.0707 | |
| 152 | E | A | -2.3192 | |
| 153 | A | A | -1.2828 | |
| 154 | M | A | -0.7217 | |
| 155 | N | A | -1.4709 | |
| 156 | H | A | -1.8828 | |
| 157 | H | A | -1.6563 | |
| 158 | L | A | 0.0000 | |
| 159 | K | A | -2.0356 | |
| 160 | N | A | -1.9702 | |
| 161 | Q | A | 0.0000 | |
| 162 | I | A | 0.0000 | |
| 163 | D | A | -3.4509 | |
| 164 | R | A | -3.2606 | |
| 165 | I | A | -2.4619 | |
| 166 | R | A | -2.9686 | |
| 167 | E | A | -3.2712 | |
| 168 | Q | A | -2.4418 | |
| 169 | A | A | -1.7449 | |
| 170 | N | A | -2.0889 | |
| 171 | S | A | -1.6110 | |
| 172 | V | A | 0.0000 | |
| 173 | E | A | -1.1181 | |
| 174 | T | A | -0.9802 | |
| 175 | I | A | 0.0000 | |
| 176 | V | A | 0.0000 | |
| 177 | L | A | 0.0000 | |
| 178 | M | A | 0.0000 | |
| 179 | A | A | 0.0000 | |
| 180 | V | A | 0.0000 | |
| 181 | H | A | -0.4923 | |
| 182 | C | A | -0.6156 | |
| 183 | M | A | 0.0000 | |
| 184 | N | A | 0.0000 | |
| 185 | H | A | -1.8765 | |
| 186 | K | A | -3.0479 | |
| 187 | R | A | -3.9198 | |
| 188 | R | A | -3.1530 | |
| 189 | G | A | -1.8558 | |
| 190 | G | A | -0.7863 | |
| 191 | I | A | 1.2087 | |
| 192 | G | A | -0.7023 | |
| 193 | D | A | -1.9981 | |
| 194 | M | A | -1.9083 | |
| 195 | T | A | 0.0000 | |
| 196 | P | A | 0.0000 | |
| 197 | A | A | 0.0000 | |
| 198 | E | A | -1.7336 | |
| 199 | R | A | -1.0772 | |
| 200 | L | A | 0.0000 | |
| 201 | I | A | 0.0000 | |
| 202 | N | A | -0.8857 | |
| 203 | M | A | 0.0000 | |
| 204 | I | A | 0.0000 | |
| 205 | T | A | 0.0000 | |
| 206 | T | A | 0.0000 | |
| 207 | E | A | -1.2364 | |
| 208 | Q | A | -0.9888 | |
| 209 | E | A | -0.5404 | |
| 210 | I | A | 0.0828 | |
| 211 | Q | A | 0.1635 | |
| 212 | F | A | 1.2000 | |
| 213 | Q | A | -0.9340 | |
| 55 | N | B | -1.7426 | |
| 56 | S | B | -1.3879 | |
| 57 | D | B | -1.9403 | |
| 58 | L | B | -0.9159 | |
| 59 | G | B | 0.0000 | |
| 60 | T | B | 0.0000 | |
| 61 | W | B | 0.0000 | |
| 62 | Q | B | -0.5718 | |
| 63 | M | B | 0.0000 | |
| 64 | D | B | -0.9096 | |
| 65 | C | B | -0.6274 | |
| 66 | T | B | -1.0848 | |
| 67 | H | B | -1.9099 | |
| 68 | L | B | -1.7823 | |
| 69 | E | B | -2.5314 | |
| 70 | G | B | -2.1529 | |
| 71 | K | B | -2.5011 | |
| 72 | I | B | -1.8590 | |
| 73 | V | B | 0.0000 | |
| 74 | I | B | 0.0000 | |
| 75 | V | B | 0.0000 | |
| 76 | A | B | 0.0000 | |
| 77 | V | B | 0.0000 | |
| 78 | H | B | 0.0000 | |
| 79 | V | B | 0.1425 | |
| 80 | A | B | -0.4492 | |
| 81 | S | B | 0.0000 | |
| 82 | G | B | 0.1266 | |
| 83 | F | B | 0.0000 | |
| 84 | I | B | 0.0000 | |
| 85 | E | B | 0.0000 | |
| 86 | A | B | 0.0000 | |
| 87 | E | B | -0.4075 | |
| 88 | V | B | -0.6719 | |
| 89 | I | B | 0.0000 | |
| 90 | P | B | -1.4405 | |
| 91 | Q | B | -2.5106 | |
| 92 | E | B | -2.7173 | |
| 93 | T | B | -1.8039 | |
| 94 | G | B | -1.5884 | |
| 95 | R | B | -1.7755 | |
| 96 | Q | B | -1.4233 | |
| 97 | T | B | 0.0000 | |
| 98 | A | B | 0.0000 | |
| 99 | L | B | -0.5055 | |
| 100 | F | B | 0.0000 | |
| 101 | L | B | 0.0000 | |
| 102 | L | B | 0.0000 | |
| 103 | K | B | -0.4110 | |
| 104 | L | B | 0.0000 | |
| 105 | A | B | 0.0000 | |
| 106 | G | B | 0.0000 | |
| 107 | R | B | -0.4687 | |
| 108 | W | B | 0.0000 | |
| 109 | P | B | -0.0735 | |
| 110 | I | B | -0.2311 | |
| 111 | T | B | -0.8178 | |
| 112 | H | B | -1.1943 | |
| 113 | L | B | 0.0000 | |
| 114 | H | B | -0.8931 | |
| 115 | T | B | -1.6058 | |
| 116 | D | B | -2.7369 | |
| 117 | N | B | -2.3744 | |
| 118 | G | B | -1.3772 | |
| 119 | A | B | -1.0362 | |
| 120 | N | B | -1.5083 | |
| 121 | F | B | -1.2205 | |
| 122 | A | B | -0.8975 | |
| 123 | S | B | 0.0000 | |
| 124 | Q | B | -1.6338 | |
| 125 | E | B | -1.3245 | |
| 126 | V | B | 0.0000 | |
| 127 | K | B | -0.9132 | |
| 128 | M | B | -0.0400 | |
| 129 | V | B | 0.0000 | |
| 130 | A | B | 0.0000 | |
| 131 | W | B | 0.8794 | |
| 132 | W | B | 0.5743 | |
| 133 | A | B | 0.2537 | |
| 134 | G | B | -0.1859 | |
| 135 | I | B | 0.0000 | |
| 136 | E | B | -1.6591 | |
| 137 | H | B | -1.6640 | |
| 138 | T | B | -0.2737 | |
| 139 | F | B | 1.3921 | |
| 140 | G | B | -0.3027 | |
| 152 | E | B | -2.1253 | |
| 153 | A | B | -1.2827 | |
| 154 | M | B | -1.0571 | |
| 155 | N | B | 0.0000 | |
| 156 | H | B | -2.1118 | |
| 157 | H | B | -1.8985 | |
| 158 | L | B | 0.0000 | |
| 159 | K | B | -2.2786 | |
| 160 | N | B | -2.9085 | |
| 161 | Q | B | 0.0000 | |
| 162 | I | B | 0.0000 | |
| 163 | D | B | -3.6161 | |
| 164 | R | B | -3.5426 | |
| 165 | I | B | -2.3764 | |
| 166 | R | B | -3.1603 | |
| 167 | E | B | -3.4100 | |
| 168 | Q | B | -2.5520 | |
| 169 | A | B | -1.8128 | |
| 170 | N | B | -2.0872 | |
| 171 | S | B | -1.5302 | |
| 172 | V | B | 0.0000 | |
| 173 | E | B | -0.7033 | |
| 174 | T | B | 0.0000 | |
| 175 | I | B | 0.0000 | |
| 176 | V | B | 0.0000 | |
| 177 | L | B | 0.0000 | |
| 178 | M | B | 0.0000 | |
| 179 | A | B | 0.0000 | |
| 180 | V | B | 0.0000 | |
| 181 | H | B | -0.3844 | |
| 182 | C | B | -0.4880 | |
| 183 | M | B | 0.0000 | |
| 184 | N | B | 0.0000 | |
| 185 | H | B | -1.8083 | |
| 186 | K | B | -2.5196 | |
| 187 | R | B | -3.8316 | |
| 188 | R | B | -3.7001 | |
| 189 | G | B | -2.2773 | |
| 190 | G | B | -0.6614 | |
| 191 | I | B | 0.0736 | |
| 192 | G | B | -1.0230 | |
| 193 | D | B | -2.9892 | |
| 194 | M | B | -1.9278 | |
| 195 | T | B | 0.0000 | |
| 196 | P | B | 0.0000 | |
| 197 | A | B | 0.0000 | |
| 198 | E | B | -1.1471 | |
| 199 | R | B | -0.7747 | |
| 200 | L | B | 0.0000 | |
| 201 | I | B | 0.0000 | |
| 202 | N | B | -0.4141 | |
| 203 | M | B | -0.3835 | |
| 204 | I | B | -0.4127 | |
| 205 | T | B | -0.7181 | |
| 206 | T | B | -1.0579 | |
| 207 | E | B | -1.8148 | |
| 55 | N | C | -1.6181 | |
| 56 | S | C | -1.4053 | |
| 57 | D | C | -2.2377 | |
| 58 | L | C | -0.6360 | |
| 59 | G | C | 0.0000 | |
| 60 | T | C | -0.8203 | |
| 61 | W | C | 0.0000 | |
| 62 | Q | C | -0.5860 | |
| 63 | M | C | 0.0000 | |
| 64 | D | C | -1.0685 | |
| 65 | C | C | -0.5498 | |
| 66 | T | C | 0.0000 | |
| 67 | H | C | -1.7352 | |
| 68 | L | C | -1.6648 | |
| 69 | E | C | -2.3842 | |
| 70 | G | C | -1.9207 | |
| 71 | K | C | -2.0442 | |
| 72 | I | C | -1.3025 | |
| 73 | V | C | 0.0000 | |
| 74 | I | C | 0.0000 | |
| 75 | V | C | 0.0000 | |
| 76 | A | C | 0.0000 | |
| 77 | V | C | 0.0000 | |
| 78 | H | C | 0.0000 | |
| 79 | V | C | 0.2184 | |
| 80 | A | C | -0.5708 | |
| 81 | S | C | 0.0000 | |
| 82 | G | C | 0.0000 | |
| 83 | F | C | 0.0000 | |
| 84 | I | C | 0.0000 | |
| 85 | E | C | 0.0000 | |
| 86 | A | C | 0.0000 | |
| 87 | E | C | -0.1487 | |
| 88 | V | C | -0.4245 | |
| 89 | I | C | 0.0000 | |
| 90 | P | C | -1.1240 | |
| 91 | Q | C | -1.8417 | |
| 92 | E | C | -1.6816 | |
| 93 | T | C | -1.3272 | |
| 94 | G | C | -1.5473 | |
| 95 | R | C | -1.5534 | |
| 96 | Q | C | -1.1081 | |
| 97 | T | C | 0.0000 | |
| 98 | A | C | 0.0000 | |
| 99 | L | C | 0.0000 | |
| 100 | F | C | 0.0000 | |
| 101 | L | C | 0.0000 | |
| 102 | L | C | 0.0000 | |
| 103 | K | C | -0.4342 | |
| 104 | L | C | 0.0000 | |
| 105 | A | C | 0.0000 | |
| 106 | G | C | 0.0000 | |
| 107 | R | C | 0.0000 | |
| 108 | W | C | 0.0000 | |
| 109 | P | C | -0.2583 | |
| 110 | I | C | 0.0000 | |
| 111 | T | C | -0.8749 | |
| 112 | H | C | 0.0000 | |
| 113 | L | C | 0.0000 | |
| 114 | H | C | -0.9782 | |
| 115 | T | C | 0.0000 | |
| 116 | D | C | -2.5577 | |
| 117 | N | C | -2.2189 | |
| 118 | G | C | -1.3763 | |
| 119 | A | C | -1.2905 | |
| 120 | N | C | 0.0000 | |
| 121 | F | C | -1.2125 | |
| 122 | A | C | -1.2152 | |
| 123 | S | C | 0.0000 | |
| 124 | Q | C | -2.4863 | |
| 125 | E | C | -2.7099 | |
| 126 | V | C | 0.0000 | |
| 127 | K | C | -2.2885 | |
| 128 | M | C | -0.9792 | |
| 129 | V | C | 0.0000 | |
| 130 | A | C | -0.6729 | |
| 131 | W | C | 0.2086 | |
| 132 | W | C | 0.4547 | |
| 133 | A | C | 0.0619 | |
| 134 | G | C | -0.3747 | |
| 135 | I | C | 0.0000 | |
| 136 | E | C | -2.1327 | |
| 137 | H | C | -1.1255 | |
| 138 | T | C | 0.1668 | |
| 139 | F | C | 1.5838 | |
| 140 | G | C | 0.6207 | |
| 151 | V | C | 1.3271 | |
| 152 | E | C | 0.0162 | |
| 153 | A | C | -0.6975 | |
| 154 | M | C | -0.8593 | |
| 155 | N | C | -1.3295 | |
| 156 | H | C | -2.0666 | |
| 157 | H | C | -2.2012 | |
| 158 | L | C | 0.0000 | |
| 159 | K | C | -2.4838 | |
| 160 | N | C | -2.7998 | |
| 161 | Q | C | -2.3404 | |
| 162 | I | C | 0.0000 | |
| 163 | D | C | -4.0445 | |
| 164 | R | C | -3.7190 | |
| 165 | I | C | -3.0022 | |
| 166 | R | C | -4.0842 | |
| 167 | E | C | -3.7782 | |
| 168 | Q | C | -2.8558 | |
| 169 | A | C | -1.9546 | |
| 170 | N | C | -2.1501 | |
| 171 | S | C | -1.1642 | |
| 172 | V | C | -1.0642 | |
| 173 | E | C | -0.4904 | |
| 174 | T | C | 0.0000 | |
| 175 | I | C | 0.0000 | |
| 176 | V | C | 0.0000 | |
| 177 | L | C | 0.0000 | |
| 178 | M | C | 0.0000 | |
| 179 | A | C | 0.0000 | |
| 180 | V | C | 0.0000 | |
| 181 | H | C | -0.4623 | |
| 182 | C | C | -0.5910 | |
| 183 | M | C | -1.0814 | |
| 184 | N | C | 0.0000 | |
| 185 | H | C | -1.5752 | |
| 186 | K | C | -2.9815 | |
| 187 | R | C | -3.3831 | |
| 188 | R | C | -3.1535 | |
| 189 | G | C | 0.0000 | |
| 190 | G | C | -1.0858 | |
| 191 | I | C | -0.6790 | |
| 192 | G | C | -1.3434 | |
| 193 | D | C | -2.4597 | |
| 194 | M | C | -2.2645 | |
| 195 | T | C | 0.0000 | |
| 196 | P | C | 0.0000 | |
| 197 | A | C | -0.9500 | |
| 198 | E | C | -1.4837 | |
| 199 | R | C | -1.0486 | |
| 200 | L | C | 0.0000 | |
| 201 | I | C | 0.0000 | |
| 202 | N | C | -1.7155 | |
| 203 | M | C | -0.9626 | |
| 204 | I | C | -0.8053 | |
| 205 | T | C | -1.0087 | |
| 206 | T | C | -1.1751 | |
| 207 | E | C | -1.8771 | |
| 55 | N | D | -1.6552 | |
| 56 | S | D | -1.4685 | |
| 57 | D | D | -1.9478 | |
| 58 | L | D | -0.8589 | |
| 59 | G | D | 0.0000 | |
| 60 | T | D | 0.0000 | |
| 61 | W | D | 0.0000 | |
| 62 | Q | D | -1.1100 | |
| 63 | M | D | 0.0000 | |
| 64 | D | D | -2.1807 | |
| 65 | C | D | -1.1638 | |
| 66 | T | D | -1.3002 | |
| 67 | H | D | -1.8503 | |
| 68 | L | D | 0.0000 | |
| 69 | E | D | -2.5283 | |
| 70 | G | D | -1.9344 | |
| 71 | K | D | -2.1218 | |
| 72 | I | D | -1.4909 | |
| 73 | V | D | 0.0000 | |
| 74 | I | D | 0.0000 | |
| 75 | V | D | 0.0000 | |
| 76 | A | D | 0.0000 | |
| 77 | V | D | 0.0000 | |
| 78 | H | D | 0.0000 | |
| 79 | V | D | -0.3015 | |
| 80 | A | D | -0.5601 | |
| 81 | S | D | -0.4283 | |
| 82 | G | D | -0.0829 | |
| 83 | F | D | 0.0000 | |
| 84 | I | D | 0.0000 | |
| 85 | E | D | 0.0000 | |
| 86 | A | D | -0.2470 | |
| 87 | E | D | -0.2356 | |
| 88 | V | D | -0.5708 | |
| 89 | I | D | 0.0000 | |
| 90 | P | D | -1.1250 | |
| 91 | Q | D | -2.0011 | |
| 92 | E | D | -1.9463 | |
| 93 | T | D | -1.3961 | |
| 94 | G | D | -1.3734 | |
| 95 | R | D | -1.6676 | |
| 96 | Q | D | -1.1646 | |
| 97 | T | D | 0.0000 | |
| 98 | A | D | 0.0000 | |
| 99 | L | D | -0.3124 | |
| 100 | F | D | 0.0000 | |
| 101 | L | D | 0.0000 | |
| 102 | L | D | 0.0000 | |
| 103 | K | D | -0.2786 | |
| 104 | L | D | 0.0000 | |
| 105 | A | D | 0.0000 | |
| 106 | G | D | 0.0000 | |
| 107 | R | D | 0.0000 | |
| 108 | W | D | 0.0000 | |
| 109 | P | D | -0.0770 | |
| 110 | I | D | 0.0000 | |
| 111 | T | D | -1.0015 | |
| 112 | H | D | -1.4941 | |
| 113 | L | D | 0.0000 | |
| 114 | H | D | -1.3923 | |
| 115 | T | D | 0.0000 | |
| 116 | D | D | -2.4861 | |
| 117 | N | D | -2.1745 | |
| 118 | G | D | -1.4204 | |
| 119 | A | D | -1.2315 | |
| 120 | N | D | -1.6410 | |
| 121 | F | D | 0.0000 | |
| 122 | A | D | -0.9099 | |
| 123 | S | D | -1.2128 | |
| 124 | Q | D | -1.5552 | |
| 125 | E | D | -1.0672 | |
| 126 | V | D | 0.0000 | |
| 127 | K | D | -0.8188 | |
| 128 | M | D | 0.5133 | |
| 129 | V | D | 0.0000 | |
| 130 | A | D | 0.0000 | |
| 131 | W | D | 0.7878 | |
| 132 | W | D | 0.7210 | |
| 133 | A | D | 0.0563 | |
| 134 | G | D | -0.6218 | |
| 135 | I | D | 0.0000 | |
| 136 | E | D | -2.2940 | |
| 137 | H | D | -1.3652 | |
| 138 | T | D | -0.4729 | |
| 139 | F | D | 0.7705 | |
| 140 | G | D | -0.5561 | |
| 152 | E | D | -2.0210 | |
| 153 | A | D | -1.3403 | |
| 154 | M | D | -1.3662 | |
| 155 | N | D | -1.7862 | |
| 156 | H | D | -2.1728 | |
| 157 | H | D | -2.1054 | |
| 158 | L | D | 0.0000 | |
| 159 | K | D | -2.8019 | |
| 160 | N | D | -3.0650 | |
| 161 | Q | D | 0.0000 | |
| 162 | I | D | 0.0000 | |
| 163 | D | D | -3.5293 | |
| 164 | R | D | -3.3083 | |
| 165 | I | D | -2.0319 | |
| 166 | R | D | -2.7326 | |
| 167 | E | D | -2.9761 | |
| 168 | Q | D | -2.0309 | |
| 169 | A | D | -1.5049 | |
| 170 | N | D | -1.9225 | |
| 171 | S | D | -0.9353 | |
| 172 | V | D | -0.9926 | |
| 173 | E | D | -0.9106 | |
| 174 | T | D | -0.7746 | |
| 175 | I | D | 0.0000 | |
| 176 | V | D | 0.0000 | |
| 177 | L | D | 0.0000 | |
| 178 | M | D | 0.0000 | |
| 179 | A | D | 0.0000 | |
| 180 | V | D | 0.0000 | |
| 181 | H | D | -0.4281 | |
| 182 | C | D | -0.6597 | |
| 183 | M | D | 0.0000 | |
| 184 | N | D | 0.0000 | |
| 185 | H | D | -1.8017 | |
| 186 | K | D | -3.1158 | |
| 187 | R | D | -4.1869 | |
| 188 | R | D | -3.5925 | |
| 189 | G | D | -1.7041 | |
| 190 | G | D | -0.5080 | |
| 191 | I | D | 1.0401 | |
| 192 | G | D | -1.0565 | |
| 193 | D | D | -2.8257 | |
| 194 | M | D | -1.9644 | |
| 195 | T | D | -2.4709 | |
| 196 | P | D | -1.6893 | |
| 197 | A | D | 0.0000 | |
| 198 | E | D | -1.5005 | |
| 199 | R | D | -1.1641 | |
| 200 | L | D | 0.0000 | |
| 201 | I | D | 0.0000 | |
| 202 | N | D | -0.9245 | |
| 203 | M | D | -0.7987 | |
| 204 | I | D | -0.7518 | |
| 205 | T | D | -1.2362 | |
| 206 | T | D | -0.9032 | |
| 207 | E | D | -2.1297 | |
| 216 | K | X | -3.2560 | |
| 217 | N | X | -2.8330 | |
| 218 | S | X | -2.0515 | |
| 219 | K | X | -2.3314 | |
| 220 | F | X | -1.7053 | |
| 221 | K | X | -2.8755 | |
| 222 | N | X | -2.9896 | |
| 223 | F | X | 0.0000 | |
| 224 | R | X | -1.9336 | |
| 225 | V | X | 0.0000 | |
| 226 | Y | X | 0.0000 | |
| 227 | Y | X | -0.7383 | |
| 228 | R | X | -2.2589 | |
| 229 | E | X | -3.5927 | |
| 230 | G | X | -3.3616 | |
| 231 | R | X | -3.4015 | |
| 232 | D | X | -3.1954 | |
| 233 | Q | X | -1.9181 | |
| 234 | L | X | 0.1155 | |
| 235 | W | X | 0.5501 | |
| 236 | K | X | -0.7486 | |
| 237 | G | X | -0.3593 | |
| 238 | P | X | -0.6557 | |
| 239 | G | X | 0.0000 | |
| 240 | E | X | -1.3650 | |
| 241 | L | X | -0.5981 | |
| 242 | L | X | -0.3874 | |
| 243 | W | X | -0.6549 | |
| 244 | K | X | -1.9428 | |
| 245 | G | X | -2.1640 | |
| 246 | E | X | -2.7376 | |
| 247 | G | X | -1.9208 | |
| 248 | A | X | -1.2800 | |
| 249 | V | X | 0.0000 | |
| 250 | L | X | 0.7541 | |
| 251 | L | X | 0.0000 | |
| 252 | K | X | -0.6913 | |
| 253 | V | X | -0.6618 | |
| 254 | G | X | -0.8526 | |
| 255 | T | X | -1.0018 | |
| 256 | D | X | -1.2842 | |
| 257 | I | X | 0.4447 | |
| 258 | K | X | 0.6141 | |
| 259 | V | X | 1.4900 | |
| 260 | V | X | 0.0000 | |
| 261 | P | X | -1.3785 | |
| 262 | R | X | -2.3640 | |
| 263 | R | X | -3.3670 | |
| 264 | K | X | -2.8404 | |
| 265 | A | X | 0.0000 | |
| 266 | K | X | -0.8338 | |
| 267 | I | X | -0.3597 | |
| 268 | I | X | 0.0000 | |
| 269 | K | X | -2.1106 | |
| 270 | D | X | -2.7316 |
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