| Chain sequence(s) |
A: PVQLVQSGAEVKKPGASVKVSCKASGFSLSSYGVSWVRQAPGQGLEWMGAISYDGITYYASWAKSRVTMTRDTSTSTVYMELSSLRSEDTAVYYCARGDYYDDYVYVYALDIWGQGTLVTVSSASTKGPSVFPLAPCSRSTSESTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSSLSSVVTVPSSSLGTKTYTCNVDHKPSNTKVDKRVESK
C: SCDVQLYIKRQSEHSILAGDPFELECPVKYCANRPHVTWCKLNGTTCVKLEDRQTSWKEEKNISFFILHFEPVLPNDNGSYRCSANFQSNNLIESHSTTLYV B: EIVLTQSPGTLSLSPGERATLSCQASQSISTALAWYQQKPGQAPRLLIYAASTLASGIPDRFSGSGSGTDFTLTISRLEPEDFAVYYCQQGYSSSNLDNVFGGGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHHQGLSSPVTKSFNRGEC input PDB |
| Selected Chain(s) | A,C,B |
| 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 (00:00:00)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:04:56)
[INFO] Main: Simulation completed successfully. (00:05:00)
|
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 | P | A | -0.1689 | |
| 2 | V | A | 0.3152 | |
| 3 | Q | A | -0.3316 | |
| 4 | L | A | 0.0000 | |
| 5 | V | A | 0.1598 | |
| 6 | Q | A | 0.0000 | |
| 7 | S | A | -0.5383 | |
| 8 | G | A | -0.4056 | |
| 9 | A | A | -0.0638 | |
| 10 | E | A | -0.3121 | |
| 11 | V | A | 0.0806 | |
| 12 | K | A | -1.3711 | |
| 13 | K | A | -2.3560 | |
| 14 | P | A | -2.2297 | |
| 15 | G | A | -1.5702 | |
| 16 | A | A | -1.2544 | |
| 17 | S | A | -1.3241 | |
| 18 | V | A | 0.0000 | |
| 19 | K | A | -1.9771 | |
| 20 | V | A | 0.0000 | |
| 21 | S | A | -0.5627 | |
| 22 | C | A | 0.0000 | |
| 23 | K | A | -0.7372 | |
| 24 | A | A | 0.0000 | |
| 25 | S | A | -0.3386 | |
| 26 | G | A | -0.2854 | |
| 27 | F | A | 0.0386 | |
| 28 | S | A | -0.0902 | |
| 29 | L | A | 0.0000 | |
| 30 | S | A | -0.4309 | |
| 31 | S | A | -0.2512 | |
| 32 | Y | A | 0.0932 | |
| 33 | G | A | 0.0000 | |
| 34 | V | A | 0.0000 | |
| 35 | S | A | 0.0000 | |
| 36 | W | A | 0.0000 | |
| 37 | V | A | 0.0000 | |
| 38 | R | A | -0.4735 | |
| 39 | Q | A | -0.7398 | |
| 40 | A | A | -1.0350 | |
| 41 | P | A | -0.8552 | |
| 42 | G | A | -1.2924 | |
| 43 | Q | A | -1.8104 | |
| 44 | G | A | -1.2467 | |
| 45 | L | A | 0.0000 | |
| 46 | E | A | -1.2634 | |
| 47 | W | A | 0.0000 | |
| 48 | M | A | 0.0000 | |
| 49 | G | A | 0.0000 | |
| 50 | A | A | 0.0000 | |
| 51 | I | A | 0.0000 | |
| 52 | S | A | 0.0000 | |
| 53 | Y | A | 0.0000 | |
| 54 | D | A | -0.3929 | |
| 55 | G | A | -0.5194 | |
| 56 | I | A | 0.0000 | |
| 57 | T | A | -0.0183 | |
| 58 | Y | A | -0.2013 | |
| 59 | Y | A | -0.7166 | |
| 60 | A | A | 0.0000 | |
| 61 | S | A | -1.3813 | |
| 62 | W | A | -0.8273 | |
| 63 | A | A | 0.0000 | |
| 64 | K | A | -1.8358 | |
| 65 | S | A | -1.0840 | |
| 66 | R | A | -0.9176 | |
| 67 | V | A | 0.0000 | |
| 68 | T | A | -0.7411 | |
| 69 | M | A | 0.0000 | |
| 70 | T | A | -0.4053 | |
| 71 | R | A | -0.8955 | |
| 72 | D | A | -1.2665 | |
| 73 | T | A | -0.8163 | |
| 74 | S | A | -0.6522 | |
| 75 | T | A | -0.6621 | |
| 76 | S | A | -0.7690 | |
| 77 | T | A | 0.0000 | |
| 78 | V | A | 0.0000 | |
| 79 | Y | A | -0.5982 | |
| 80 | M | A | 0.0000 | |
| 81 | E | A | -1.3272 | |
| 82 | L | A | 0.0000 | |
| 83 | S | A | -1.0222 | |
| 84 | S | A | -1.1291 | |
| 85 | L | A | 0.0000 | |
| 86 | R | A | -2.8278 | |
| 87 | S | A | -2.2549 | |
| 88 | E | A | -2.4239 | |
| 89 | D | A | 0.0000 | |
| 90 | T | A | -0.8308 | |
| 91 | A | A | 0.0000 | |
| 92 | V | A | 0.2049 | |
| 93 | Y | A | 0.0000 | |
| 94 | Y | A | 0.0000 | |
| 95 | C | A | 0.0000 | |
| 96 | A | A | 0.0000 | |
| 97 | R | A | 0.0000 | |
| 98 | G | A | 0.0000 | |
| 99 | D | A | -0.2399 | |
| 100 | Y | A | -0.2353 | |
| 101 | Y | A | -0.1906 | |
| 102 | D | A | -1.1230 | |
| 103 | D | A | -2.0413 | |
| 104 | Y | A | -0.7010 | |
| 105 | V | A | -0.1658 | |
| 106 | Y | A | -0.1640 | |
| 107 | V | A | 0.0000 | |
| 108 | Y | A | 0.0000 | |
| 109 | A | A | 0.0000 | |
| 110 | L | A | 0.0000 | |
| 111 | D | A | -0.5119 | |
| 112 | I | A | -0.0813 | |
| 113 | W | A | -0.2502 | |
| 114 | G | A | 0.0000 | |
| 115 | Q | A | -1.1295 | |
| 116 | G | A | -0.6004 | |
| 117 | T | A | 0.0000 | |
| 118 | L | A | 0.2329 | |
| 119 | V | A | 0.0000 | |
| 120 | T | A | 0.0000 | |
| 121 | V | A | 0.0000 | |
| 122 | S | A | -1.3529 | |
| 123 | S | A | -1.1425 | |
| 124 | A | A | -0.6702 | |
| 125 | S | A | -0.7440 | |
| 126 | T | A | -0.8296 | |
| 127 | K | A | -1.5505 | |
| 128 | G | A | -1.5609 | |
| 129 | P | A | -0.7769 | |
| 130 | S | A | -0.6021 | |
| 131 | V | A | 0.0000 | |
| 132 | F | A | 0.0000 | |
| 133 | P | A | -1.3042 | |
| 134 | L | A | 0.0000 | |
| 135 | A | A | -0.9243 | |
| 136 | P | A | -0.7867 | |
| 137 | C | A | -0.9736 | |
| 138 | S | A | -1.3225 | |
| 139 | R | A | -2.2084 | |
| 140 | S | A | -1.5558 | |
| 141 | T | A | -1.1522 | |
| 142 | S | A | -1.2378 | |
| 143 | E | A | -1.9876 | |
| 144 | S | A | -1.0826 | |
| 145 | T | A | -0.9241 | |
| 146 | A | A | 0.0000 | |
| 147 | A | A | 0.0000 | |
| 148 | L | A | 0.0000 | |
| 149 | G | A | 0.0000 | |
| 150 | C | A | 0.0000 | |
| 151 | L | A | 0.0000 | |
| 152 | V | A | 0.0000 | |
| 153 | K | A | 0.0000 | |
| 154 | D | A | -0.4992 | |
| 155 | Y | A | 0.0000 | |
| 156 | F | A | 0.0000 | |
| 157 | P | A | 0.0000 | |
| 158 | E | A | -0.4878 | |
| 159 | P | A | -0.8256 | |
| 160 | V | A | -0.7997 | |
| 161 | T | A | -0.6643 | |
| 162 | V | A | -0.4280 | |
| 163 | S | A | -0.5391 | |
| 164 | W | A | 0.0000 | |
| 165 | N | A | -1.0440 | |
| 166 | S | A | -0.8016 | |
| 167 | G | A | -0.6136 | |
| 168 | A | A | -0.2792 | |
| 169 | L | A | -0.1105 | |
| 170 | T | A | -0.2084 | |
| 171 | S | A | -0.1972 | |
| 172 | G | A | -0.2820 | |
| 173 | V | A | 0.1458 | |
| 174 | H | A | -0.3288 | |
| 175 | T | A | 0.0079 | |
| 176 | F | A | 0.0000 | |
| 177 | P | A | -0.5317 | |
| 178 | A | A | 0.0276 | |
| 179 | V | A | 0.2896 | |
| 180 | L | A | 1.0877 | |
| 181 | Q | A | 0.2341 | |
| 182 | S | A | -0.0740 | |
| 183 | S | A | -0.2210 | |
| 184 | G | A | 0.0150 | |
| 185 | L | A | -0.0718 | |
| 186 | Y | A | 0.0000 | |
| 187 | S | A | 0.0000 | |
| 188 | L | A | 0.0000 | |
| 189 | S | A | 0.0000 | |
| 190 | S | A | 0.0000 | |
| 191 | V | A | 0.0000 | |
| 192 | V | A | 0.0000 | |
| 193 | T | A | -0.1196 | |
| 194 | V | A | 0.0000 | |
| 195 | P | A | -0.6681 | |
| 196 | S | A | -1.0035 | |
| 197 | S | A | -0.7251 | |
| 198 | S | A | -0.7078 | |
| 199 | L | A | -0.8726 | |
| 200 | G | A | -1.0446 | |
| 201 | T | A | -0.8532 | |
| 202 | K | A | -1.5516 | |
| 203 | T | A | -1.4237 | |
| 204 | Y | A | 0.0000 | |
| 205 | T | A | -1.9277 | |
| 206 | C | A | 0.0000 | |
| 207 | N | A | -1.8145 | |
| 208 | V | A | 0.0000 | |
| 209 | D | A | -2.1135 | |
| 210 | H | A | 0.0000 | |
| 211 | K | A | -2.7653 | |
| 212 | P | A | -1.5862 | |
| 213 | S | A | -1.9119 | |
| 214 | N | A | -2.6045 | |
| 215 | T | A | -2.1857 | |
| 216 | K | A | -2.7899 | |
| 217 | V | A | -1.9373 | |
| 218 | D | A | -2.8782 | |
| 219 | K | A | -2.4113 | |
| 220 | R | A | -2.9738 | |
| 221 | V | A | 0.0000 | |
| 222 | E | A | -2.9569 | |
| 223 | S | A | -1.9971 | |
| 224 | K | A | -2.2498 | |
| 1 | E | B | -2.2257 | |
| 2 | I | B | 0.0000 | |
| 3 | V | B | 0.5163 | |
| 4 | L | B | 0.0000 | |
| 5 | T | B | -0.1659 | |
| 6 | Q | B | -0.4979 | |
| 7 | S | B | -0.6771 | |
| 8 | P | B | -0.5825 | |
| 9 | G | B | -0.8020 | |
| 10 | T | B | -0.4836 | |
| 11 | L | B | -0.2905 | |
| 12 | S | B | -0.4602 | |
| 13 | L | B | -0.9643 | |
| 14 | S | B | -1.3964 | |
| 15 | P | B | -2.0770 | |
| 16 | G | B | -2.4163 | |
| 17 | E | B | -3.3969 | |
| 18 | R | B | -3.4236 | |
| 19 | A | B | 0.0000 | |
| 20 | T | B | -0.5454 | |
| 21 | L | B | 0.0000 | |
| 22 | S | B | -0.6908 | |
| 23 | C | B | 0.0000 | |
| 24 | Q | B | -1.0598 | |
| 25 | A | B | 0.0000 | |
| 26 | S | B | -0.4191 | |
| 27 | Q | B | -0.8332 | |
| 28 | S | B | -0.7914 | |
| 29 | I | B | 0.0000 | |
| 30 | S | B | -0.4755 | |
| 31 | T | B | -0.3782 | |
| 32 | A | B | 0.0000 | |
| 33 | L | B | 0.0000 | |
| 34 | A | B | 0.0000 | |
| 35 | W | B | 0.0000 | |
| 36 | Y | B | 0.0000 | |
| 37 | Q | B | 0.0000 | |
| 38 | Q | B | 0.0000 | |
| 39 | K | B | -1.5159 | |
| 40 | P | B | -1.4508 | |
| 41 | G | B | -1.3229 | |
| 42 | Q | B | -2.0413 | |
| 43 | A | B | -1.2865 | |
| 44 | P | B | 0.0000 | |
| 45 | R | B | -1.2270 | |
| 46 | L | B | 0.0000 | |
| 47 | L | B | 0.0000 | |
| 48 | I | B | 0.0000 | |
| 49 | Y | B | 0.3038 | |
| 50 | A | B | 0.0496 | |
| 51 | A | B | 0.0000 | |
| 52 | S | B | -0.2125 | |
| 53 | T | B | 0.1806 | |
| 54 | L | B | 0.2111 | |
| 55 | A | B | -0.1815 | |
| 56 | S | B | -0.3111 | |
| 57 | G | B | -0.5976 | |
| 58 | I | B | -0.5291 | |
| 59 | P | B | -0.9834 | |
| 60 | D | B | -2.0958 | |
| 61 | R | B | -2.0057 | |
| 62 | F | B | 0.0000 | |
| 63 | S | B | -0.6967 | |
| 64 | G | B | -0.2663 | |
| 65 | S | B | -0.7448 | |
| 66 | G | B | -1.0393 | |
| 67 | S | B | -0.8920 | |
| 68 | G | B | -0.8755 | |
| 69 | T | B | -1.2803 | |
| 70 | D | B | -2.1831 | |
| 71 | F | B | 0.0000 | |
| 72 | T | B | -0.7228 | |
| 73 | L | B | 0.0000 | |
| 74 | T | B | -0.8389 | |
| 75 | I | B | 0.0000 | |
| 76 | S | B | -2.6944 | |
| 77 | R | B | -3.6167 | |
| 78 | L | B | 0.0000 | |
| 79 | E | B | -2.6468 | |
| 80 | P | B | -1.7586 | |
| 81 | E | B | -2.2849 | |
| 82 | D | B | 0.0000 | |
| 83 | F | B | -0.6857 | |
| 84 | A | B | 0.0000 | |
| 85 | V | B | -0.1007 | |
| 86 | Y | B | 0.0000 | |
| 87 | Y | B | 0.0000 | |
| 88 | C | B | 0.0000 | |
| 89 | Q | B | 0.0000 | |
| 90 | Q | B | 0.0000 | |
| 91 | G | B | 0.0000 | |
| 92 | Y | B | 0.0000 | |
| 93 | S | B | 0.0000 | |
| 94 | S | B | -0.4300 | |
| 95 | S | B | -0.8889 | |
| 96 | N | B | -2.0702 | |
| 97 | L | B | 0.0000 | |
| 98 | D | B | -2.0838 | |
| 99 | N | B | -1.2760 | |
| 100 | V | B | 0.0000 | |
| 101 | F | B | 0.0000 | |
| 102 | G | B | 0.0000 | |
| 103 | G | B | -0.8006 | |
| 104 | G | B | -0.7077 | |
| 105 | T | B | 0.0000 | |
| 106 | K | B | -0.5871 | |
| 107 | V | B | 0.0000 | |
| 108 | E | B | 0.0000 | |
| 109 | I | B | -0.6076 | |
| 110 | K | B | -1.2425 | |
| 111 | R | B | -0.9567 | |
| 112 | T | B | -0.1070 | |
| 113 | V | B | 0.2337 | |
| 114 | A | B | 0.0595 | |
| 115 | A | B | -0.1726 | |
| 116 | P | B | 0.0000 | |
| 117 | S | B | -0.1584 | |
| 118 | V | B | 0.0000 | |
| 119 | F | B | -0.2519 | |
| 120 | I | B | 0.0000 | |
| 121 | F | B | 0.0000 | |
| 122 | P | B | -0.3956 | |
| 123 | P | B | -0.8044 | |
| 124 | S | B | -1.6575 | |
| 125 | D | B | -3.0221 | |
| 126 | E | B | -3.1878 | |
| 127 | Q | B | 0.0000 | |
| 128 | L | B | -2.1530 | |
| 129 | K | B | -2.9181 | |
| 130 | S | B | -1.8106 | |
| 131 | G | B | -1.3318 | |
| 132 | T | B | -0.9893 | |
| 133 | A | B | 0.0000 | |
| 134 | S | B | 0.0000 | |
| 135 | V | B | 0.0000 | |
| 136 | V | B | 0.0000 | |
| 137 | C | B | 0.0000 | |
| 138 | L | B | 0.0000 | |
| 139 | L | B | 0.0000 | |
| 140 | N | B | 0.0000 | |
| 141 | N | B | -0.8692 | |
| 142 | F | B | 0.0000 | |
| 143 | Y | B | 0.0000 | |
| 144 | P | B | -1.7241 | |
| 145 | R | B | -2.9617 | |
| 146 | E | B | -3.1863 | |
| 147 | A | B | -2.2794 | |
| 148 | K | B | -2.4365 | |
| 149 | V | B | -1.0825 | |
| 150 | Q | B | -0.6076 | |
| 151 | W | B | 0.0000 | |
| 152 | K | B | -0.3451 | |
| 153 | V | B | 0.0000 | |
| 154 | D | B | -1.4781 | |
| 155 | N | B | -1.1127 | |
| 156 | A | B | -0.0920 | |
| 157 | L | B | 0.7661 | |
| 158 | Q | B | -0.0865 | |
| 159 | S | B | -0.3961 | |
| 160 | G | B | -0.8696 | |
| 161 | N | B | -0.7182 | |
| 162 | S | B | -1.1217 | |
| 163 | Q | B | -1.4236 | |
| 164 | E | B | -1.9976 | |
| 165 | S | B | 0.0000 | |
| 166 | V | B | -0.9330 | |
| 167 | T | B | -1.2196 | |
| 168 | E | B | -2.2894 | |
| 169 | Q | B | -1.8564 | |
| 170 | D | B | -1.9179 | |
| 171 | S | B | -1.8848 | |
| 172 | K | B | -2.1870 | |
| 173 | D | B | -1.5931 | |
| 174 | S | B | -1.5801 | |
| 175 | T | B | 0.0000 | |
| 176 | Y | B | 0.0000 | |
| 177 | S | B | 0.0000 | |
| 178 | L | B | 0.0000 | |
| 179 | S | B | 0.0000 | |
| 180 | S | B | 0.0000 | |
| 181 | T | B | -0.6654 | |
| 182 | L | B | 0.0000 | |
| 183 | T | B | -0.3094 | |
| 184 | L | B | -0.4328 | |
| 185 | S | B | -0.8811 | |
| 186 | K | B | -2.0207 | |
| 187 | A | B | -1.6649 | |
| 188 | D | B | -2.0189 | |
| 189 | Y | B | 0.0000 | |
| 190 | E | B | -3.5322 | |
| 191 | K | B | -3.4368 | |
| 192 | H | B | -2.7691 | |
| 193 | K | B | -3.1535 | |
| 194 | V | B | -1.5378 | |
| 195 | Y | B | 0.0000 | |
| 196 | A | B | 0.0000 | |
| 197 | C | B | 0.0000 | |
| 198 | E | B | -0.7003 | |
| 199 | V | B | 0.0000 | |
| 200 | T | B | -1.2379 | |
| 201 | H | B | 0.0000 | |
| 202 | Q | B | -1.7858 | |
| 203 | G | B | -0.4733 | |
| 204 | L | B | -0.2774 | |
| 205 | S | B | -0.4740 | |
| 206 | S | B | -0.4177 | |
| 207 | P | B | -0.5811 | |
| 208 | V | B | 0.0094 | |
| 209 | T | B | -0.4802 | |
| 210 | K | B | -0.7722 | |
| 211 | S | B | -0.7244 | |
| 212 | F | B | 0.0000 | |
| 213 | N | B | -2.0770 | |
| 214 | R | B | -2.4564 | |
| 215 | G | B | -1.9524 | |
| 216 | E | B | -2.2608 | |
| 217 | C | B | -0.8729 | |
| 33 | S | C | 0.0869 | |
| 34 | C | C | 0.2081 | |
| 35 | D | C | -0.3200 | |
| 36 | V | C | 0.0000 | |
| 37 | Q | C | -0.0406 | |
| 38 | L | C | 0.0000 | |
| 39 | Y | C | -0.1355 | |
| 40 | I | C | 0.0000 | |
| 41 | K | C | -1.9405 | |
| 42 | R | C | -2.0387 | |
| 43 | Q | C | -2.2718 | |
| 44 | S | C | -1.9253 | |
| 45 | E | C | -2.3469 | |
| 46 | H | C | -0.9994 | |
| 47 | S | C | 0.0137 | |
| 48 | I | C | 0.7298 | |
| 49 | L | C | 1.5536 | |
| 50 | A | C | 0.2471 | |
| 51 | G | C | -0.9967 | |
| 52 | D | C | -1.8787 | |
| 53 | P | C | -1.8605 | |
| 54 | F | C | -1.6754 | |
| 55 | E | C | -2.5966 | |
| 56 | L | C | 0.0000 | |
| 57 | E | C | -2.0630 | |
| 58 | C | C | 0.0000 | |
| 59 | P | C | -0.6426 | |
| 60 | V | C | 0.0000 | |
| 61 | K | C | -0.3116 | |
| 62 | Y | C | -0.2942 | |
| 63 | C | C | -0.0209 | |
| 64 | A | C | -0.5736 | |
| 65 | N | C | -1.6713 | |
| 66 | R | C | -1.5924 | |
| 67 | P | C | 0.0000 | |
| 68 | H | C | -1.5062 | |
| 69 | V | C | 0.0000 | |
| 70 | T | C | -0.9235 | |
| 71 | W | C | 0.0000 | |
| 72 | C | C | 0.0000 | |
| 73 | K | C | -0.6301 | |
| 74 | L | C | -0.6411 | |
| 75 | N | C | -1.1930 | |
| 76 | G | C | -0.9962 | |
| 77 | T | C | -0.4721 | |
| 78 | T | C | -0.4052 | |
| 79 | C | C | -0.1857 | |
| 80 | V | C | -0.0141 | |
| 81 | K | C | -1.3737 | |
| 82 | L | C | -1.5897 | |
| 83 | E | C | -3.0932 | |
| 84 | D | C | -3.1584 | |
| 85 | R | C | -2.7550 | |
| 86 | Q | C | -2.6079 | |
| 87 | T | C | -1.2544 | |
| 88 | S | C | -1.1706 | |
| 89 | W | C | -1.2403 | |
| 90 | K | C | -2.5037 | |
| 91 | E | C | -3.3344 | |
| 92 | E | C | -3.1902 | |
| 93 | K | C | -3.0600 | |
| 94 | N | C | -2.3660 | |
| 95 | I | C | -1.6048 | |
| 96 | S | C | 0.0000 | |
| 97 | F | C | -1.2107 | |
| 98 | F | C | 0.0000 | |
| 99 | I | C | 0.0000 | |
| 100 | L | C | 0.0000 | |
| 101 | H | C | -2.0513 | |
| 102 | F | C | 0.0000 | |
| 103 | E | C | -2.7927 | |
| 104 | P | C | -1.9290 | |
| 105 | V | C | 0.0000 | |
| 106 | L | C | -0.1503 | |
| 107 | P | C | -0.2507 | |
| 108 | N | C | -1.4294 | |
| 109 | D | C | -0.9660 | |
| 110 | N | C | -1.1929 | |
| 111 | G | C | -0.9176 | |
| 112 | S | C | -0.7548 | |
| 113 | Y | C | 0.0000 | |
| 114 | R | C | 0.0000 | |
| 115 | C | C | 0.0000 | |
| 116 | S | C | 0.0000 | |
| 117 | A | C | 0.0000 | |
| 118 | N | C | -1.3083 | |
| 119 | F | C | -0.6743 | |
| 120 | Q | C | -1.4254 | |
| 121 | S | C | -1.3143 | |
| 122 | N | C | 0.0000 | |
| 123 | L | C | -0.3450 | |
| 124 | I | C | 0.0000 | |
| 125 | E | C | -0.1995 | |
| 126 | S | C | 0.0000 | |
| 127 | H | C | 0.0000 | |
| 128 | S | C | 0.0000 | |
| 129 | T | C | 0.0000 | |
| 130 | T | C | -1.1022 | |
| 131 | L | C | 0.0000 | |
| 132 | Y | C | 0.3997 | |
| 133 | V | C | 1.1001 |