| Chain sequence(s) |
A: EVQLVESGGGLVQPGRSLRLSCAASGFTFDDYAMHWVRQAPGKGLEWVSAITWNSGHIDYADSVEGRFTISRDNAKNSLYLQMNSLRAEDTAVYYCAKVSYLSTASSLDYWGQGTLVTVSSASTKGPSVFPLTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSTQTYICNVNHKPSNT
C: EVQLVESGGGLVQPGRSLRLSCAASGFTFDDYAMHWVRQAPGKGLEWVSAITWNSGHIDYADSVEGRFTISRDNAKNSLYLQMNSLRAEDTAVYYCAKVSYLSTASSLDYWGQGTLVTVSSASTKGPSVFPLAPGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVE B: DIQMTQSPSSLSASVGDRVTITCRASQGIRNYLAWYQQKPGKAPKLLIYAASTLQSGVPSRFSGSGSGTDFTLTISSLQPEDVATYYCQRYNRAPYTFGQGTKVEIKRTVAAPSVFI E: EVQLVESGGGLVQPGRSLRLSCAASGFTFDDYAMHWVRQAPGKGLEWVSAITWNSGHHIDYADSVEGRFTISRDNAKNSLYLQMNSLRAEDTAVYYCAKVSYLSTASSLDYWGQGTLVTVSSASTKGPKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYS D: DIQMTQSPSSLSASVGDRVTITCRASQGIRNYLAWYQQKPGKAPKLLIYAASTLQSGVPSRFSGSGSGTDFTLTISSLQPEDVATYYCQRYNRAPYTFGQGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNR F: DIQMTQSPSSLSASVGDRVTITCRASQGIRNYLAWYQQKPGKAPKLLIYAASTLQSGVPSRFSGSGSGTDFTLTISSLQPEDVATYYCQRYNRAPYTFGQGTKVEIKRTSVTEQDSKDSTYSLS H: EVQLVESGGGLVQPGRSLRLSCAASGFTFDDYAMHWVRQAPGKGLEWVSAITWNSGHIDYADSVEGRFTISRDNAKNSLYLQMNSLRAEDTAVYYCAKVSYLSTASSLDYWGQGTLVTVSSASTKGPSVFPLAPGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKV L: IQMTQSPSSLSASVGDRVTITCRASQGIRNYLAWYQQKPGKAPKLLIYAASTLQSGVPSRFSGSGSGTDFTLTISSLQPEDVATYYCQRYNRAPYTFGQGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRG input PDB |
| Selected Chain(s) | A,C,B,E,D,F,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 (00:15:49)
[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 | |
| 2 | I | L | 1.1329 | |
| 3 | Q | L | -0.8763 | |
| 4 | M | L | 0.0000 | |
| 5 | T | L | -1.3902 | |
| 6 | Q | L | 0.0000 | |
| 7 | S | L | -0.7741 | |
| 8 | P | L | -0.5850 | |
| 9 | S | L | -0.8129 | |
| 10 | S | L | -0.6514 | |
| 11 | L | L | -0.3287 | |
| 12 | S | L | -0.7562 | |
| 13 | A | L | -1.0083 | |
| 14 | S | L | -1.2155 | |
| 15 | V | L | -0.8066 | |
| 16 | G | L | -1.0138 | |
| 17 | D | L | -1.8828 | |
| 18 | R | L | -2.2542 | |
| 19 | V | L | 0.0000 | |
| 20 | T | L | -0.6338 | |
| 21 | I | L | 0.0000 | |
| 22 | T | L | -0.8543 | |
| 23 | C | L | 0.0000 | |
| 24 | R | L | -2.7862 | |
| 25 | A | L | 0.0000 | |
| 26 | S | L | -1.2226 | |
| 27 | Q | L | -1.8715 | |
| 28 | G | L | -2.1431 | |
| 29 | I | L | 0.0000 | |
| 30 | R | L | -2.6424 | |
| 31 | N | L | -1.5805 | |
| 32 | Y | L | -0.9379 | |
| 33 | L | L | 0.0000 | |
| 34 | A | L | 0.0000 | |
| 35 | W | L | 0.0000 | |
| 36 | Y | L | 0.0000 | |
| 37 | Q | L | 0.0000 | |
| 38 | Q | L | -1.2539 | |
| 39 | K | L | -1.7906 | |
| 40 | P | L | -1.6128 | |
| 41 | G | L | -1.8416 | |
| 42 | K | L | -2.5333 | |
| 43 | A | L | -1.6607 | |
| 44 | P | L | 0.0000 | |
| 45 | K | L | -1.6033 | |
| 46 | L | L | 0.0000 | |
| 47 | L | L | 0.0000 | |
| 48 | I | L | 0.0000 | |
| 49 | Y | L | 0.1111 | |
| 50 | A | L | -0.3382 | |
| 51 | A | L | 0.0000 | |
| 52 | S | L | -0.3082 | |
| 53 | T | L | -0.0219 | |
| 54 | L | L | 0.2042 | |
| 55 | Q | L | -0.3613 | |
| 56 | S | L | -0.3702 | |
| 57 | G | L | -0.3349 | |
| 58 | V | L | 0.0000 | |
| 59 | P | L | -0.1243 | |
| 60 | S | L | -0.3625 | |
| 61 | R | L | 0.0000 | |
| 62 | F | L | 0.0000 | |
| 63 | S | L | -0.2202 | |
| 64 | G | L | -0.2690 | |
| 65 | S | L | -0.6957 | |
| 66 | G | L | -1.3584 | |
| 67 | S | L | -1.5439 | |
| 68 | G | L | -2.0661 | |
| 69 | T | L | -2.2216 | |
| 70 | D | L | -2.3717 | |
| 71 | F | L | 0.0000 | |
| 72 | T | L | -0.7391 | |
| 73 | L | L | 0.0000 | |
| 74 | T | L | -0.5371 | |
| 75 | I | L | 0.0000 | |
| 76 | S | L | -1.1076 | |
| 77 | S | L | 0.0000 | |
| 78 | L | L | 0.0000 | |
| 79 | Q | L | 0.0000 | |
| 80 | P | L | -1.4606 | |
| 81 | E | L | -1.5220 | |
| 82 | D | L | 0.0000 | |
| 83 | V | L | 0.0000 | |
| 84 | A | L | 0.0000 | |
| 85 | T | L | -0.7757 | |
| 86 | Y | L | 0.0000 | |
| 87 | Y | L | 0.0000 | |
| 88 | C | L | 0.0000 | |
| 89 | Q | L | 0.0000 | |
| 90 | R | L | 0.0000 | |
| 91 | Y | L | 0.0000 | |
| 92 | N | L | -1.6476 | |
| 93 | R | L | -2.0733 | |
| 94 | A | L | -0.7301 | |
| 95 | P | L | -0.6677 | |
| 96 | Y | L | 0.0000 | |
| 97 | T | L | -0.4251 | |
| 98 | F | L | 0.0000 | |
| 99 | G | L | 0.0000 | |
| 100 | Q | L | -1.8933 | |
| 101 | G | L | 0.0000 | |
| 102 | T | L | 0.0000 | |
| 103 | K | L | -1.1714 | |
| 104 | V | L | 0.0000 | |
| 105 | E | L | -0.9925 | |
| 106 | I | L | 0.0000 | |
| 107 | K | L | -1.5377 | |
| 108 | R | L | -1.1286 | |
| 109 | T | L | -0.2037 | |
| 110 | V | L | 0.1056 | |
| 111 | A | L | -0.0144 | |
| 112 | A | L | -0.2003 | |
| 113 | P | L | 0.0000 | |
| 114 | S | L | -0.1373 | |
| 115 | V | L | 0.0000 | |
| 116 | F | L | 0.0156 | |
| 117 | I | L | 0.0213 | |
| 118 | F | L | 0.0000 | |
| 119 | P | L | -0.7494 | |
| 120 | P | L | 0.0000 | |
| 121 | S | L | -1.6188 | |
| 122 | D | L | -2.9157 | |
| 123 | E | L | -2.9275 | |
| 124 | Q | L | 0.0000 | |
| 125 | L | L | -2.2493 | |
| 126 | K | L | -2.8179 | |
| 127 | S | L | -1.8021 | |
| 128 | G | L | -1.2758 | |
| 129 | T | L | -0.9154 | |
| 130 | A | L | 0.0000 | |
| 131 | S | L | 0.0000 | |
| 132 | V | L | 0.0000 | |
| 133 | V | L | 0.0000 | |
| 134 | C | L | 0.0000 | |
| 135 | L | L | 0.0000 | |
| 136 | L | L | 0.0000 | |
| 137 | N | L | 0.0000 | |
| 138 | N | L | -0.9657 | |
| 139 | F | L | 0.0000 | |
| 140 | Y | L | -1.0302 | |
| 141 | P | L | -1.4482 | |
| 142 | R | L | -2.3635 | |
| 143 | E | L | -2.9619 | |
| 144 | A | L | -2.1513 | |
| 145 | K | L | -2.1392 | |
| 146 | V | L | -0.9243 | |
| 147 | Q | L | -0.3853 | |
| 148 | W | L | 0.0000 | |
| 149 | K | L | -0.5615 | |
| 150 | V | L | 0.0000 | |
| 151 | D | L | -2.1114 | |
| 152 | N | L | -1.6595 | |
| 153 | A | L | -0.3730 | |
| 154 | L | L | 0.7078 | |
| 155 | Q | L | -0.4276 | |
| 156 | S | L | -0.6993 | |
| 157 | G | L | -1.3478 | |
| 158 | N | L | -1.7566 | |
| 159 | S | L | -1.4251 | |
| 160 | Q | L | -1.3061 | |
| 161 | E | L | -1.3290 | |
| 162 | S | L | -0.6609 | |
| 163 | V | L | -0.4767 | |
| 164 | T | L | -1.0165 | |
| 165 | E | L | -2.1705 | |
| 166 | Q | L | 0.0000 | |
| 167 | D | L | -2.0994 | |
| 168 | S | L | -2.1278 | |
| 169 | K | L | -2.6497 | |
| 170 | D | L | -2.4064 | |
| 171 | S | L | 0.0000 | |
| 172 | T | L | 0.0000 | |
| 173 | Y | L | 0.0000 | |
| 174 | S | L | 0.0000 | |
| 175 | L | L | 0.0000 | |
| 176 | S | L | 0.0000 | |
| 177 | S | L | 0.0000 | |
| 178 | T | L | -0.6840 | |
| 179 | L | L | 0.0000 | |
| 180 | T | L | -0.5778 | |
| 181 | L | L | -0.6943 | |
| 182 | S | L | -1.1291 | |
| 183 | K | L | -2.3761 | |
| 184 | A | L | -1.9506 | |
| 185 | D | L | -2.6882 | |
| 186 | Y | L | 0.0000 | |
| 187 | E | L | -4.0382 | |
| 188 | K | L | -3.8144 | |
| 189 | H | L | -3.6204 | |
| 190 | K | L | -3.8261 | |
| 191 | V | L | -2.0420 | |
| 192 | Y | L | 0.0000 | |
| 193 | A | L | 0.0000 | |
| 194 | C | L | 0.0000 | |
| 195 | E | L | -0.5590 | |
| 196 | V | L | 0.0000 | |
| 197 | T | L | -1.0958 | |
| 198 | H | L | 0.0000 | |
| 199 | Q | L | -1.7412 | |
| 200 | G | L | -0.5282 | |
| 201 | L | L | -0.2866 | |
| 202 | S | L | -0.4796 | |
| 203 | S | L | -0.4038 | |
| 204 | P | L | -0.4379 | |
| 205 | V | L | 0.1047 | |
| 206 | T | L | -0.4314 | |
| 207 | K | L | -0.8039 | |
| 208 | S | L | -0.6709 | |
| 209 | F | L | -1.2396 | |
| 210 | N | L | -2.6030 | |
| 211 | R | L | -3.4459 | |
| 212 | G | L | -3.4930 | |
| 1 | E | H | -1.5104 | |
| 2 | V | H | -0.0969 | |
| 3 | Q | H | -0.5399 | |
| 4 | L | H | 0.0000 | |
| 5 | V | H | 0.6912 | |
| 6 | E | H | 0.0000 | |
| 7 | S | H | -0.3764 | |
| 8 | G | H | -1.0185 | |
| 9 | G | H | -0.5892 | |
| 10 | G | H | -0.3609 | |
| 11 | L | H | 0.0032 | |
| 12 | V | H | 0.0000 | |
| 13 | Q | H | -1.1231 | |
| 14 | P | H | -1.0893 | |
| 15 | G | H | 0.0000 | |
| 16 | R | H | -1.5941 | |
| 17 | S | H | 0.0000 | |
| 18 | L | H | -1.3786 | |
| 19 | R | H | -2.2409 | |
| 20 | L | H | 0.0000 | |
| 21 | S | H | -0.5739 | |
| 22 | C | H | 0.0000 | |
| 23 | A | H | -0.2368 | |
| 24 | A | H | 0.0000 | |
| 25 | S | H | -0.3896 | |
| 26 | G | H | -0.5822 | |
| 27 | F | H | -0.4700 | |
| 28 | T | H | -1.0703 | |
| 29 | F | H | 0.0000 | |
| 30 | D | H | -2.9324 | |
| 31 | D | H | -1.7233 | |
| 32 | Y | H | -0.2084 | |
| 33 | A | H | 0.0000 | |
| 34 | M | H | 0.0000 | |
| 35 | H | H | 0.0000 | |
| 36 | W | H | 0.0000 | |
| 37 | V | H | 0.0000 | |
| 38 | R | H | 0.0000 | |
| 39 | Q | H | -0.7991 | |
| 40 | A | H | -1.2527 | |
| 41 | P | H | -1.1986 | |
| 42 | G | H | -1.4842 | |
| 43 | K | H | -2.3893 | |
| 44 | G | H | -1.6976 | |
| 45 | L | H | 0.0000 | |
| 46 | E | H | -1.2587 | |
| 47 | W | H | 0.0000 | |
| 48 | V | H | 0.0000 | |
| 49 | S | H | 0.0000 | |
| 50 | A | H | 0.0000 | |
| 51 | I | H | 0.0000 | |
| 52 | T | H | -0.6809 | |
| 53 | W | H | -1.0384 | |
| 54 | N | H | -1.9994 | |
| 55 | S | H | -1.1278 | |
| 56 | G | H | -1.1700 | |
| 57 | H | H | -1.0813 | |
| 58 | I | H | -0.0456 | |
| 59 | D | H | -0.8532 | |
| 60 | Y | H | -0.9028 | |
| 61 | A | H | -1.5262 | |
| 62 | D | H | -2.5059 | |
| 63 | S | H | -1.5863 | |
| 64 | V | H | 0.0000 | |
| 65 | E | H | -2.7173 | |
| 66 | G | H | -1.8044 | |
| 67 | R | H | -1.2214 | |
| 68 | F | H | 0.0000 | |
| 69 | T | H | -0.7459 | |
| 70 | I | H | 0.0000 | |
| 71 | S | H | -0.4517 | |
| 72 | R | H | -1.2811 | |
| 73 | D | H | -1.9617 | |
| 74 | N | H | -2.2599 | |
| 75 | A | H | -1.5828 | |
| 76 | K | H | -2.4039 | |
| 77 | N | H | -2.0052 | |
| 78 | S | H | 0.0000 | |
| 79 | L | H | 0.0000 | |
| 80 | Y | H | 0.0000 | |
| 81 | L | H | 0.0000 | |
| 82 | Q | H | -1.4255 | |
| 83 | M | H | 0.0000 | |
| 84 | N | H | -1.3397 | |
| 85 | S | H | 0.0000 | |
| 86 | L | H | 0.0000 | |
| 87 | R | H | -1.7335 | |
| 88 | A | H | -1.4076 | |
| 89 | E | H | -2.1133 | |
| 90 | D | H | 0.0000 | |
| 91 | T | H | -0.7761 | |
| 92 | A | H | 0.0000 | |
| 93 | V | H | 0.2638 | |
| 94 | Y | H | 0.0000 | |
| 95 | Y | H | 0.0000 | |
| 96 | C | H | 0.0000 | |
| 97 | A | H | 0.0000 | |
| 98 | K | H | 0.0000 | |
| 99 | V | H | 0.0000 | |
| 100 | S | H | 0.8743 | |
| 101 | Y | H | 1.8510 | |
| 102 | L | H | 1.9895 | |
| 103 | S | H | 0.9838 | |
| 104 | T | H | 0.1466 | |
| 105 | A | H | -0.0832 | |
| 106 | S | H | 0.0000 | |
| 107 | S | H | 0.0000 | |
| 108 | L | H | 0.0000 | |
| 109 | D | H | -0.3594 | |
| 110 | Y | H | -0.1598 | |
| 111 | W | H | 0.0000 | |
| 112 | G | H | 0.0000 | |
| 113 | Q | H | -1.3283 | |
| 114 | G | H | 0.0000 | |
| 115 | T | H | -0.0705 | |
| 116 | L | H | 0.0545 | |
| 117 | V | H | 0.0000 | |
| 118 | T | H | -0.3710 | |
| 119 | V | H | 0.0000 | |
| 120 | S | H | -0.6381 | |
| 121 | S | H | -0.4433 | |
| 122 | A | H | -0.4524 | |
| 123 | S | H | -0.6965 | |
| 124 | T | H | -1.0908 | |
| 125 | K | H | -1.9430 | |
| 126 | G | H | -1.8492 | |
| 127 | P | H | -0.8957 | |
| 128 | S | H | -0.4908 | |
| 129 | V | H | 0.0000 | |
| 130 | F | H | 0.0000 | |
| 131 | P | H | -0.6822 | |
| 132 | L | H | 0.0000 | |
| 133 | A | H | 0.0528 | |
| 134 | P | H | -0.0381 | |
| 142 | G | H | -0.6113 | |
| 143 | T | H | -0.4406 | |
| 144 | A | H | 0.0000 | |
| 145 | A | H | 0.0000 | |
| 146 | L | H | 0.0000 | |
| 147 | G | H | 0.0000 | |
| 148 | C | H | 0.0000 | |
| 149 | L | H | 0.0000 | |
| 150 | V | H | 0.0000 | |
| 151 | K | H | 0.0000 | |
| 152 | D | H | -0.6502 | |
| 153 | Y | H | 0.0000 | |
| 154 | F | H | 0.0000 | |
| 155 | P | H | 0.0000 | |
| 156 | E | H | -0.4974 | |
| 157 | P | H | -0.7302 | |
| 158 | V | H | -0.7280 | |
| 159 | T | H | -0.4193 | |
| 160 | V | H | -0.4113 | |
| 161 | S | H | -0.4345 | |
| 162 | W | H | 0.0000 | |
| 163 | N | H | -0.8096 | |
| 164 | S | H | -0.7006 | |
| 165 | G | H | -0.5451 | |
| 166 | A | H | -0.2835 | |
| 167 | L | H | 0.0109 | |
| 168 | T | H | -0.1208 | |
| 169 | S | H | -0.1425 | |
| 170 | G | H | -0.0917 | |
| 171 | V | H | 0.2683 | |
| 172 | H | H | -0.0751 | |
| 173 | T | H | 0.0349 | |
| 174 | F | H | 0.0000 | |
| 175 | P | H | -0.1773 | |
| 176 | A | H | 0.3379 | |
| 177 | V | H | 0.6285 | |
| 178 | L | H | 1.3556 | |
| 179 | Q | H | 0.3301 | |
| 180 | S | H | -0.0580 | |
| 181 | S | H | -0.2376 | |
| 182 | G | H | 0.0237 | |
| 183 | L | H | -0.0170 | |
| 184 | Y | H | 0.4264 | |
| 185 | S | H | 0.0000 | |
| 186 | L | H | 0.0000 | |
| 187 | S | H | 0.0000 | |
| 188 | S | H | 0.0000 | |
| 189 | V | H | 0.0000 | |
| 190 | V | H | 0.0000 | |
| 191 | T | H | -0.0669 | |
| 192 | V | H | 0.0000 | |
| 193 | P | H | -0.3715 | |
| 194 | S | H | -0.4049 | |
| 195 | S | H | -0.3955 | |
| 196 | S | H | 0.0000 | |
| 197 | L | H | 0.1485 | |
| 198 | G | H | -0.3409 | |
| 199 | T | H | -0.2868 | |
| 200 | Q | H | -0.3221 | |
| 201 | T | H | -0.3445 | |
| 202 | Y | H | 0.0000 | |
| 203 | I | H | -0.9783 | |
| 204 | C | H | 0.0000 | |
| 205 | N | H | -1.6484 | |
| 206 | V | H | 0.0000 | |
| 207 | N | H | -2.0287 | |
| 208 | H | H | 0.0000 | |
| 209 | K | H | -2.8223 | |
| 210 | P | H | -1.7245 | |
| 211 | S | H | -2.0527 | |
| 212 | N | H | -2.7250 | |
| 213 | T | H | -2.0318 | |
| 214 | K | H | -2.7348 | |
| 215 | V | H | -1.7573 | |
| 216 | D | H | -2.6514 | |
| 217 | K | H | -1.9204 | |
| 218 | K | H | -1.9736 | |
| 219 | V | H | -0.4417 | |
| 1 | D | B | -2.3101 | |
| 2 | I | B | 0.0000 | |
| 3 | Q | B | -2.3771 | |
| 4 | M | B | 0.0000 | |
| 5 | T | B | -1.5273 | |
| 6 | Q | B | 0.0000 | |
| 7 | S | B | -0.8032 | |
| 8 | P | B | -0.6375 | |
| 9 | S | B | -0.8965 | |
| 10 | S | B | -0.9770 | |
| 11 | L | B | -0.8614 | |
| 12 | S | B | -1.2403 | |
| 13 | A | B | -1.1707 | |
| 14 | S | B | -0.9721 | |
| 15 | V | B | 0.3465 | |
| 16 | G | B | -0.4876 | |
| 17 | D | B | -1.2984 | |
| 18 | R | B | -2.0521 | |
| 19 | V | B | -0.9991 | |
| 20 | T | B | -0.5534 | |
| 21 | I | B | 0.0000 | |
| 22 | T | B | -0.7334 | |
| 23 | C | B | 0.0000 | |
| 24 | R | B | -2.6874 | |
| 25 | A | B | 0.0000 | |
| 26 | S | B | -2.0521 | |
| 27 | Q | B | -2.3845 | |
| 28 | G | B | -1.8734 | |
| 29 | I | B | 0.0000 | |
| 30 | R | B | -2.5133 | |
| 31 | N | B | -1.6228 | |
| 32 | Y | B | -0.7433 | |
| 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 | -2.0213 | |
| 40 | P | B | -1.4897 | |
| 41 | G | B | -1.9430 | |
| 42 | K | B | -2.7272 | |
| 43 | A | B | -1.7187 | |
| 44 | P | B | 0.0000 | |
| 45 | K | B | -1.4858 | |
| 46 | L | B | 0.0000 | |
| 47 | L | B | 0.0000 | |
| 48 | I | B | 0.0000 | |
| 49 | Y | B | 0.1529 | |
| 50 | A | B | -0.3077 | |
| 51 | A | B | 0.0000 | |
| 52 | S | B | -0.3263 | |
| 53 | T | B | 0.0100 | |
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| 55 | Q | B | -0.3618 | |
| 56 | S | B | -0.4481 | |
| 57 | G | B | -0.6097 | |
| 58 | V | B | 0.0000 | |
| 59 | P | B | -0.5352 | |
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| 62 | F | B | 0.0000 | |
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| 64 | G | B | -0.2723 | |
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| 67 | S | B | -1.5241 | |
| 68 | G | B | -1.9386 | |
| 69 | T | B | -2.0432 | |
| 70 | D | B | -2.1694 | |
| 71 | F | B | 0.0000 | |
| 72 | T | B | -0.6521 | |
| 73 | L | B | 0.0000 | |
| 74 | T | B | -0.5980 | |
| 75 | I | B | 0.0000 | |
| 76 | S | B | -1.2112 | |
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| 78 | L | B | 0.0000 | |
| 79 | Q | B | -0.6670 | |
| 80 | P | B | -1.0374 | |
| 81 | E | B | -2.0683 | |
| 82 | D | B | 0.0000 | |
| 83 | V | B | -0.8961 | |
| 84 | A | B | 0.0000 | |
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| 88 | C | B | 0.0000 | |
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| 90 | R | B | 0.0000 | |
| 91 | Y | B | 0.0000 | |
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| 93 | R | B | -1.9740 | |
| 94 | A | B | -0.9889 | |
| 95 | P | B | -1.0674 | |
| 96 | Y | B | 0.0000 | |
| 97 | T | B | -0.7972 | |
| 98 | F | B | 0.0000 | |
| 99 | G | B | 0.0000 | |
| 100 | Q | B | -1.9123 | |
| 101 | G | B | 0.0000 | |
| 102 | T | B | 0.0000 | |
| 103 | K | B | -1.6889 | |
| 104 | V | B | 0.0000 | |
| 105 | E | B | -2.1564 | |
| 106 | I | B | -1.2513 | |
| 107 | K | B | -2.1712 | |
| 108 | R | B | -2.0328 | |
| 109 | T | B | -0.3583 | |
| 110 | V | B | 1.0742 | |
| 111 | A | B | 0.5734 | |
| 112 | A | B | 0.5154 | |
| 113 | P | B | 0.5350 | |
| 114 | S | B | 0.9812 | |
| 115 | V | B | 2.9839 | |
| 116 | F | B | 3.7204 | |
| 117 | I | B | 3.5639 | |
| 1 | E | A | -1.9797 | |
| 2 | V | A | -0.9150 | |
| 3 | Q | A | -0.7668 | |
| 4 | L | A | 0.0000 | |
| 5 | V | A | 1.2796 | |
| 6 | E | A | 0.0000 | |
| 7 | S | A | 0.0180 | |
| 8 | G | A | -0.6431 | |
| 9 | G | A | -0.4532 | |
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| 11 | L | A | -0.2111 | |
| 12 | V | A | 0.0000 | |
| 13 | Q | A | -1.2414 | |
| 14 | P | A | -1.4537 | |
| 15 | G | A | -1.5449 | |
| 16 | R | A | -2.0043 | |
| 17 | S | A | 0.0000 | |
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| 19 | R | A | -0.7863 | |
| 20 | L | A | 0.0000 | |
| 21 | S | A | 0.0572 | |
| 22 | C | A | 0.0000 | |
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| 25 | S | A | -0.6593 | |
| 26 | G | A | -1.0126 | |
| 27 | F | A | -0.6394 | |
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| 29 | F | A | 0.0000 | |
| 30 | D | A | -2.6670 | |
| 31 | D | A | -1.2916 | |
| 32 | Y | A | -0.1641 | |
| 33 | A | A | 0.0000 | |
| 34 | M | A | 0.0000 | |
| 35 | H | A | 0.0000 | |
| 36 | W | A | 0.0000 | |
| 37 | V | A | 0.0000 | |
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| 39 | Q | A | -0.8578 | |
| 40 | A | A | -1.2315 | |
| 41 | P | A | -0.9548 | |
| 42 | G | A | -1.5475 | |
| 43 | K | A | -2.3917 | |
| 44 | G | A | -1.7619 | |
| 45 | L | A | 0.0000 | |
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| 47 | W | A | 0.0000 | |
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| 50 | A | A | 0.0000 | |
| 51 | I | A | 0.0000 | |
| 52 | T | A | -0.7259 | |
| 53 | W | A | -1.0861 | |
| 54 | N | A | -1.9424 | |
| 55 | S | A | -1.0586 | |
| 56 | G | A | -1.1218 | |
| 57 | H | A | -1.0752 | |
| 58 | I | A | -0.0772 | |
| 59 | D | A | -0.9913 | |
| 60 | Y | A | -1.0388 | |
| 61 | A | A | -1.5584 | |
| 62 | D | A | -2.5535 | |
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| 64 | V | A | 0.0000 | |
| 65 | E | A | -2.7755 | |
| 66 | G | A | -1.7964 | |
| 67 | R | A | -1.0595 | |
| 68 | F | A | 0.0000 | |
| 69 | T | A | -0.4182 | |
| 70 | I | A | 0.0000 | |
| 71 | S | A | -0.2967 | |
| 72 | R | A | -1.1334 | |
| 73 | D | A | -1.7292 | |
| 74 | N | A | -2.1173 | |
| 75 | A | A | -1.5116 | |
| 76 | K | A | -2.3263 | |
| 77 | N | A | -1.9144 | |
| 78 | S | A | -1.0066 | |
| 79 | L | A | 0.0000 | |
| 80 | Y | A | -0.0760 | |
| 81 | L | A | 0.0000 | |
| 82 | Q | A | 0.0000 | |
| 83 | M | A | 0.0000 | |
| 84 | N | A | -1.2057 | |
| 85 | S | A | -1.2602 | |
| 86 | L | A | 0.0000 | |
| 87 | R | A | -2.4537 | |
| 88 | A | A | -1.7422 | |
| 89 | E | A | -2.2881 | |
| 90 | D | A | 0.0000 | |
| 91 | T | A | -0.8013 | |
| 92 | A | A | 0.0000 | |
| 93 | V | A | 0.0823 | |
| 94 | Y | A | 0.0000 | |
| 95 | Y | A | 0.0000 | |
| 96 | C | A | 0.0000 | |
| 97 | A | A | 0.0000 | |
| 98 | K | A | 0.0000 | |
| 99 | V | A | 0.0000 | |
| 100 | S | A | 0.8526 | |
| 101 | Y | A | 1.6289 | |
| 102 | L | A | 1.4629 | |
| 103 | S | A | 0.7245 | |
| 104 | T | A | 0.0112 | |
| 105 | A | A | -0.0899 | |
| 106 | S | A | 0.0000 | |
| 107 | S | A | 0.0000 | |
| 108 | L | A | 0.0000 | |
| 109 | D | A | -0.0153 | |
| 110 | Y | A | 0.3395 | |
| 111 | W | A | 0.0000 | |
| 112 | G | A | 0.0000 | |
| 113 | Q | A | -1.3507 | |
| 114 | G | A | 0.0000 | |
| 115 | T | A | 0.0350 | |
| 116 | L | A | 0.0839 | |
| 117 | V | A | 0.0000 | |
| 118 | T | A | -0.4340 | |
| 119 | V | A | 0.0000 | |
| 120 | S | A | -0.5486 | |
| 121 | S | A | -0.5118 | |
| 122 | A | A | -0.4507 | |
| 123 | S | A | -0.6765 | |
| 124 | T | A | -1.0337 | |
| 125 | K | A | -2.1427 | |
| 126 | G | A | -1.7859 | |
| 127 | P | A | -0.7864 | |
| 128 | S | A | -0.0756 | |
| 129 | V | A | 1.0557 | |
| 130 | F | A | 1.6018 | |
| 131 | P | A | 1.4809 | |
| 132 | L | A | 2.3217 | |
| 143 | T | A | -0.2486 | |
| 144 | A | A | 0.1121 | |
| 145 | A | A | 1.0161 | |
| 146 | L | A | 1.3036 | |
| 147 | G | A | 0.0000 | |
| 148 | C | A | 0.0000 | |
| 149 | L | A | 1.1728 | |
| 150 | V | A | 0.0000 | |
| 151 | K | A | -0.5451 | |
| 152 | D | A | -0.5824 | |
| 153 | Y | A | 0.0000 | |
| 154 | F | A | 0.0000 | |
| 155 | P | A | 0.0000 | |
| 156 | E | A | -0.6221 | |
| 157 | P | A | -0.8119 | |
| 158 | V | A | 0.0000 | |
| 159 | T | A | -0.9031 | |
| 160 | V | A | 0.0000 | |
| 161 | S | A | -0.5260 | |
| 162 | W | A | 0.0000 | |
| 163 | N | A | -0.1777 | |
| 164 | S | A | -0.4475 | |
| 165 | G | A | -0.7308 | |
| 166 | A | A | -0.1997 | |
| 167 | L | A | 0.1325 | |
| 168 | T | A | -0.1143 | |
| 169 | S | A | -0.2879 | |
| 170 | G | A | -0.3268 | |
| 171 | V | A | 0.2416 | |
| 172 | H | A | -0.2214 | |
| 173 | T | A | 0.2352 | |
| 174 | F | A | 0.9005 | |
| 175 | P | A | 0.5029 | |
| 176 | A | A | 1.1494 | |
| 177 | V | A | 2.2861 | |
| 178 | L | A | 1.7571 | |
| 179 | Q | A | 0.1572 | |
| 180 | S | A | -0.1370 | |
| 181 | S | A | -0.3277 | |
| 182 | G | A | 0.1666 | |
| 183 | L | A | 0.0486 | |
| 184 | Y | A | 0.7490 | |
| 185 | S | A | 0.4859 | |
| 186 | L | A | 0.0000 | |
| 187 | S | A | 0.6290 | |
| 188 | S | A | 0.0000 | |
| 189 | V | A | 0.9139 | |
| 190 | V | A | 0.0000 | |
| 191 | T | A | -0.0673 | |
| 192 | V | A | 0.0000 | |
| 193 | P | A | -0.5122 | |
| 194 | S | A | -0.3594 | |
| 199 | T | A | -0.6319 | |
| 200 | Q | A | -1.0380 | |
| 201 | T | A | -0.2264 | |
| 202 | Y | A | 0.5637 | |
| 203 | I | A | 1.1674 | |
| 204 | C | A | 0.6536 | |
| 205 | N | A | -0.8983 | |
| 206 | V | A | -0.6252 | |
| 207 | N | A | -2.1113 | |
| 208 | H | A | 0.0000 | |
| 209 | K | A | -2.6434 | |
| 210 | P | A | -1.8933 | |
| 211 | S | A | -1.9503 | |
| 212 | N | A | -2.3835 | |
| 213 | T | A | -1.4167 | |
| 1 | D | D | -1.9835 | |
| 2 | I | D | -1.1032 | |
| 3 | Q | D | -1.9204 | |
| 4 | M | D | 0.0000 | |
| 5 | T | D | -1.5265 | |
| 6 | Q | D | 0.0000 | |
| 7 | S | D | 0.0000 | |
| 8 | P | D | 0.0000 | |
| 9 | S | D | -1.2843 | |
| 10 | S | D | -1.0711 | |
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| 12 | S | D | -1.2218 | |
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| 15 | V | D | -0.6543 | |
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| 17 | D | D | -1.9561 | |
| 18 | R | D | -2.3671 | |
| 19 | V | D | 0.0000 | |
| 20 | T | D | -0.6122 | |
| 21 | I | D | 0.0000 | |
| 22 | T | D | -0.8316 | |
| 23 | C | D | 0.0000 | |
| 24 | R | D | -2.7871 | |
| 25 | A | D | 0.0000 | |
| 26 | S | D | -1.9945 | |
| 27 | Q | D | -2.4514 | |
| 28 | G | D | -2.1727 | |
| 29 | I | D | 0.0000 | |
| 30 | R | D | -2.7774 | |
| 31 | N | D | -1.8865 | |
| 32 | Y | D | -0.8797 | |
| 33 | L | D | 0.0000 | |
| 34 | A | D | 0.0000 | |
| 35 | W | D | 0.0000 | |
| 36 | Y | D | 0.0000 | |
| 37 | Q | D | 0.0000 | |
| 38 | Q | D | 0.0000 | |
| 39 | K | D | -1.7793 | |
| 40 | P | D | -1.5622 | |
| 41 | G | D | -1.7729 | |
| 42 | K | D | -2.3446 | |
| 43 | A | D | -1.4693 | |
| 44 | P | D | 0.0000 | |
| 45 | K | D | -1.0979 | |
| 46 | L | D | 0.0000 | |
| 47 | L | D | 0.0000 | |
| 48 | I | D | 0.0000 | |
| 49 | Y | D | 0.0782 | |
| 50 | A | D | -0.3473 | |
| 51 | A | D | 0.0000 | |
| 52 | S | D | -0.3490 | |
| 53 | T | D | -0.0148 | |
| 54 | L | D | 0.1399 | |
| 55 | Q | D | -0.3363 | |
| 56 | S | D | -0.3801 | |
| 57 | G | D | -0.3183 | |
| 58 | V | D | 0.0000 | |
| 59 | P | D | -0.1053 | |
| 60 | S | D | -0.1449 | |
| 61 | R | D | 0.0000 | |
| 62 | F | D | 0.0000 | |
| 63 | S | D | -0.2592 | |
| 64 | G | D | -0.2956 | |
| 65 | S | D | -0.7813 | |
| 66 | G | D | -1.3376 | |
| 67 | S | D | -1.8080 | |
| 68 | G | D | -2.2474 | |
| 69 | T | D | -2.4055 | |
| 70 | D | D | -2.7121 | |
| 71 | F | D | 0.0000 | |
| 72 | T | D | -0.7819 | |
| 73 | L | D | 0.0000 | |
| 74 | T | D | -0.5425 | |
| 75 | I | D | 0.0000 | |
| 76 | S | D | -1.1865 | |
| 77 | S | D | 0.0000 | |
| 78 | L | D | 0.0000 | |
| 79 | Q | D | -0.8386 | |
| 80 | P | D | -1.9448 | |
| 81 | E | D | -2.0694 | |
| 82 | D | D | 0.0000 | |
| 83 | V | D | 0.0000 | |
| 84 | A | D | 0.0000 | |
| 85 | T | D | 0.0000 | |
| 86 | Y | D | 0.0000 | |
| 87 | Y | D | 0.0000 | |
| 88 | C | D | 0.0000 | |
| 89 | Q | D | 0.0000 | |
| 90 | R | D | 0.0000 | |
| 91 | Y | D | 0.0000 | |
| 92 | N | D | -1.4126 | |
| 93 | R | D | -1.8986 | |
| 94 | A | D | -0.9197 | |
| 95 | P | D | -0.9345 | |
| 96 | Y | D | 0.0000 | |
| 97 | T | D | -0.6078 | |
| 98 | F | D | 0.0000 | |
| 99 | G | D | 0.0000 | |
| 100 | Q | D | -1.4866 | |
| 101 | G | D | 0.0000 | |
| 102 | T | D | 0.0000 | |
| 103 | K | D | -2.1099 | |
| 104 | V | D | 0.0000 | |
| 105 | E | D | -1.8956 | |
| 106 | I | D | 0.0000 | |
| 107 | K | D | -1.8973 | |
| 108 | R | D | -1.3342 | |
| 109 | T | D | -0.1799 | |
| 110 | V | D | 0.3472 | |
| 111 | A | D | 0.1410 | |
| 112 | A | D | -0.1241 | |
| 113 | P | D | 0.0000 | |
| 114 | S | D | -0.0756 | |
| 115 | V | D | 0.1047 | |
| 116 | F | D | 0.2066 | |
| 117 | I | D | 0.1428 | |
| 118 | F | D | 0.0000 | |
| 119 | P | D | -0.7503 | |
| 120 | P | D | -0.6170 | |
| 121 | S | D | -1.4499 | |
| 122 | D | D | -2.7754 | |
| 123 | E | D | -2.7055 | |
| 124 | Q | D | 0.0000 | |
| 125 | L | D | -2.1564 | |
| 126 | K | D | -2.7581 | |
| 127 | S | D | -1.8067 | |
| 128 | G | D | -1.2221 | |
| 129 | T | D | -0.9650 | |
| 130 | A | D | 0.0000 | |
| 131 | S | D | 0.0000 | |
| 132 | V | D | 0.0000 | |
| 133 | V | D | 0.0000 | |
| 134 | C | D | 0.0000 | |
| 135 | L | D | 0.0000 | |
| 136 | L | D | 0.0000 | |
| 137 | N | D | 0.0000 | |
| 138 | N | D | -1.1805 | |
| 139 | F | D | 0.0000 | |
| 140 | Y | D | -1.2026 | |
| 141 | P | D | -1.6365 | |
| 142 | R | D | -2.6330 | |
| 143 | E | D | -2.9940 | |
| 144 | A | D | -2.0971 | |
| 145 | K | D | -1.8541 | |
| 146 | V | D | -1.0025 | |
| 147 | Q | D | -0.3076 | |
| 148 | W | D | 0.0000 | |
| 149 | K | D | -0.5283 | |
| 150 | V | D | 0.0000 | |
| 151 | D | D | -1.9019 | |
| 152 | N | D | -1.6027 | |
| 153 | A | D | -0.3472 | |
| 154 | L | D | 0.7190 | |
| 155 | Q | D | -0.4180 | |
| 156 | S | D | -0.7083 | |
| 157 | G | D | -1.3918 | |
| 158 | N | D | -1.7966 | |
| 159 | S | D | -1.6391 | |
| 160 | Q | D | -1.7278 | |
| 161 | E | D | -2.0366 | |
| 162 | S | D | -0.9258 | |
| 163 | V | D | -0.9011 | |
| 164 | T | D | -1.2250 | |
| 165 | E | D | -2.3546 | |
| 166 | Q | D | 0.0000 | |
| 167 | D | D | -2.5247 | |
| 168 | S | D | -2.5288 | |
| 169 | K | D | -3.1138 | |
| 170 | D | D | -3.1156 | |
| 171 | S | D | 0.0000 | |
| 172 | T | D | 0.0000 | |
| 173 | Y | D | 0.0000 | |
| 174 | S | D | 0.0000 | |
| 175 | L | D | 0.0000 | |
| 176 | S | D | 0.0000 | |
| 177 | S | D | 0.0000 | |
| 178 | T | D | -0.8387 | |
| 179 | L | D | 0.0000 | |
| 180 | T | D | -0.5782 | |
| 181 | L | D | -0.8258 | |
| 182 | S | D | -1.0033 | |
| 183 | K | D | -2.0352 | |
| 184 | A | D | -1.7728 | |
| 185 | D | D | -2.4914 | |
| 186 | Y | D | 0.0000 | |
| 187 | E | D | -3.7563 | |
| 188 | K | D | -3.6971 | |
| 189 | H | D | -3.3240 | |
| 190 | K | D | -3.7392 | |
| 191 | V | D | -2.0739 | |
| 192 | Y | D | 0.0000 | |
| 193 | A | D | 0.0000 | |
| 194 | C | D | 0.0000 | |
| 195 | E | D | -0.4384 | |
| 196 | V | D | 0.0000 | |
| 197 | T | D | -1.0023 | |
| 198 | H | D | 0.0000 | |
| 199 | Q | D | -1.6816 | |
| 200 | G | D | -0.4431 | |
| 201 | L | D | -0.2494 | |
| 202 | S | D | -0.4703 | |
| 203 | S | D | -0.4175 | |
| 204 | P | D | -0.4438 | |
| 205 | V | D | 0.0601 | |
| 206 | T | D | -0.3750 | |
| 207 | K | D | -0.7131 | |
| 208 | S | D | -0.8398 | |
| 209 | F | D | -1.2573 | |
| 210 | N | D | -2.9002 | |
| 211 | R | D | -3.6011 | |
| 1 | E | C | -2.1629 | |
| 2 | V | C | -1.3740 | |
| 3 | Q | C | -1.2892 | |
| 4 | L | C | 0.0000 | |
| 5 | V | C | 1.1987 | |
| 6 | E | C | 0.0000 | |
| 7 | S | C | -0.1365 | |
| 8 | G | C | -0.8579 | |
| 9 | G | C | -0.5301 | |
| 10 | G | C | -0.3270 | |
| 11 | L | C | -0.0982 | |
| 12 | V | C | 0.0000 | |
| 13 | Q | C | -1.8519 | |
| 14 | P | C | -1.9066 | |
| 15 | G | C | -2.1279 | |
| 16 | R | C | -2.7561 | |
| 17 | S | C | -2.1728 | |
| 18 | L | C | -1.5742 | |
| 19 | R | C | -2.1425 | |
| 20 | L | C | 0.0000 | |
| 21 | S | C | -0.3470 | |
| 22 | C | C | 0.0000 | |
| 23 | A | C | 0.0128 | |
| 24 | A | C | 0.0000 | |
| 25 | S | C | -0.8009 | |
| 26 | G | C | -1.3806 | |
| 27 | F | C | -0.7869 | |
| 28 | T | C | -0.7010 | |
| 29 | F | C | 0.0000 | |
| 30 | D | C | -2.0410 | |
| 31 | D | C | -1.0257 | |
| 32 | Y | C | 0.0353 | |
| 33 | A | C | 0.0000 | |
| 34 | M | C | 0.0000 | |
| 35 | H | C | 0.0000 | |
| 36 | W | C | 0.0000 | |
| 37 | V | C | 0.0000 | |
| 38 | R | C | 0.0000 | |
| 39 | Q | C | -0.7880 | |
| 40 | A | C | -1.2227 | |
| 41 | P | C | -0.9490 | |
| 42 | G | C | -1.4975 | |
| 43 | K | C | -2.3334 | |
| 44 | G | C | -1.6010 | |
| 45 | L | C | 0.0000 | |
| 46 | E | C | -1.1020 | |
| 47 | W | C | 0.0000 | |
| 48 | V | C | 0.0000 | |
| 49 | S | C | 0.0000 | |
| 50 | A | C | 0.0000 | |
| 51 | I | C | 0.0000 | |
| 52 | T | C | 0.0000 | |
| 53 | W | C | -0.9246 | |
| 54 | N | C | -1.8471 | |
| 55 | S | C | -1.1042 | |
| 56 | G | C | -1.1740 | |
| 57 | H | C | -1.1389 | |
| 58 | I | C | -0.1827 | |
| 59 | D | C | -1.1187 | |
| 60 | Y | C | -1.1073 | |
| 61 | A | C | 0.0000 | |
| 62 | D | C | -2.5394 | |
| 63 | S | C | -1.7768 | |
| 64 | V | C | 0.0000 | |
| 65 | E | C | -2.8295 | |
| 66 | G | C | -1.8820 | |
| 67 | R | C | -1.5335 | |
| 68 | F | C | 0.0000 | |
| 69 | T | C | -0.9220 | |
| 70 | I | C | 0.0000 | |
| 71 | S | C | -0.3731 | |
| 72 | R | C | -1.0575 | |
| 73 | D | C | -1.6061 | |
| 74 | N | C | -1.8733 | |
| 75 | A | C | -1.3631 | |
| 76 | K | C | -2.2013 | |
| 77 | N | C | -1.6846 | |
| 78 | S | C | 0.0000 | |
| 79 | L | C | 0.0000 | |
| 80 | Y | C | -0.5933 | |
| 81 | L | C | 0.0000 | |
| 82 | Q | C | -1.4067 | |
| 83 | M | C | 0.0000 | |
| 84 | N | C | -2.1113 | |
| 85 | S | C | -1.8409 | |
| 86 | L | C | 0.0000 | |
| 87 | R | C | -2.8734 | |
| 88 | A | C | -1.8527 | |
| 89 | E | C | -2.3472 | |
| 90 | D | C | 0.0000 | |
| 91 | T | C | -0.8376 | |
| 92 | A | C | 0.0000 | |
| 93 | V | C | 0.1855 | |
| 94 | Y | C | 0.0000 | |
| 95 | Y | C | 0.0000 | |
| 96 | C | C | 0.0000 | |
| 97 | A | C | 0.0000 | |
| 98 | K | C | 0.0000 | |
| 99 | V | C | 0.0000 | |
| 100 | S | C | 0.0000 | |
| 101 | Y | C | 1.7193 | |
| 102 | L | C | 1.6225 | |
| 103 | S | C | 0.8443 | |
| 104 | T | C | 0.0809 | |
| 105 | A | C | -0.0218 | |
| 106 | S | C | 0.0000 | |
| 107 | S | C | 0.0000 | |
| 108 | L | C | 0.0000 | |
| 109 | D | C | -0.0939 | |
| 110 | Y | C | 0.0775 | |
| 111 | W | C | 0.0000 | |
| 112 | G | C | 0.0000 | |
| 113 | Q | C | -1.3182 | |
| 114 | G | C | 0.0000 | |
| 115 | T | C | 0.0068 | |
| 116 | L | C | 0.0018 | |
| 117 | V | C | 0.0000 | |
| 118 | T | C | -0.5176 | |
| 119 | V | C | 0.0000 | |
| 120 | S | C | -0.6953 | |
| 121 | S | C | -0.5492 | |
| 122 | A | C | -0.4354 | |
| 123 | S | C | -0.6353 | |
| 124 | T | C | -0.8494 | |
| 125 | K | C | -1.6465 | |
| 126 | G | C | -1.6394 | |
| 127 | P | C | -0.7427 | |
| 128 | S | C | -0.4912 | |
| 129 | V | C | 0.0000 | |
| 130 | F | C | 0.0000 | |
| 131 | P | C | -1.0648 | |
| 132 | L | C | 0.0000 | |
| 133 | A | C | -0.7885 | |
| 134 | P | C | -0.4728 | |
| 142 | G | C | -0.5950 | |
| 143 | T | C | -0.4218 | |
| 144 | A | C | -0.1696 | |
| 145 | A | C | 0.0000 | |
| 146 | L | C | 0.0000 | |
| 147 | G | C | 0.0000 | |
| 148 | C | C | 0.0000 | |
| 149 | L | C | 0.0000 | |
| 150 | V | C | 0.0000 | |
| 151 | K | C | 0.0000 | |
| 152 | D | C | -0.5040 | |
| 153 | Y | C | 0.0000 | |
| 154 | F | C | 0.0000 | |
| 155 | P | C | 0.0000 | |
| 156 | E | C | -0.4683 | |
| 157 | P | C | -0.7036 | |
| 158 | V | C | -0.7261 | |
| 159 | T | C | -0.6431 | |
| 160 | V | C | 0.0000 | |
| 161 | S | C | -0.4304 | |
| 162 | W | C | 0.0000 | |
| 163 | N | C | -0.6001 | |
| 164 | S | C | -0.6474 | |
| 165 | G | C | -0.6080 | |
| 166 | A | C | -0.2957 | |
| 167 | L | C | -0.0189 | |
| 168 | T | C | -0.1897 | |
| 169 | S | C | -0.1810 | |
| 170 | G | C | -0.1133 | |
| 171 | V | C | 0.1904 | |
| 172 | H | C | -0.1098 | |
| 173 | T | C | -0.0456 | |
| 174 | F | C | 0.0000 | |
| 175 | P | C | -0.3226 | |
| 176 | A | C | 0.2416 | |
| 177 | V | C | 0.4858 | |
| 178 | L | C | 1.2877 | |
| 179 | Q | C | 0.3335 | |
| 180 | S | C | -0.0181 | |
| 181 | S | C | -0.1969 | |
| 182 | G | C | 0.0673 | |
| 183 | L | C | 0.0665 | |
| 184 | Y | C | 0.4919 | |
| 185 | S | C | 0.0000 | |
| 186 | L | C | 0.0000 | |
| 187 | S | C | 0.0000 | |
| 188 | S | C | 0.0000 | |
| 189 | V | C | 0.0000 | |
| 190 | V | C | 0.0000 | |
| 191 | T | C | -0.0874 | |
| 192 | V | C | 0.0000 | |
| 193 | P | C | -0.3390 | |
| 194 | S | C | -0.3669 | |
| 195 | S | C | -0.4224 | |
| 196 | S | C | 0.0000 | |
| 197 | L | C | -0.2432 | |
| 198 | G | C | -0.6233 | |
| 199 | T | C | -0.3548 | |
| 200 | Q | C | -0.5368 | |
| 201 | T | C | -0.7018 | |
| 202 | Y | C | 0.0000 | |
| 203 | I | C | -0.9154 | |
| 204 | C | C | 0.0000 | |
| 205 | N | C | -1.3236 | |
| 206 | V | C | 0.0000 | |
| 207 | N | C | -1.8749 | |
| 208 | H | C | 0.0000 | |
| 209 | K | C | -2.7713 | |
| 210 | P | C | -1.7197 | |
| 211 | S | C | -1.9513 | |
| 212 | N | C | -2.6184 | |
| 213 | T | C | -1.9797 | |
| 214 | K | C | -2.5709 | |
| 215 | V | C | -1.3442 | |
| 216 | D | C | -2.0977 | |
| 217 | K | C | -1.8783 | |
| 218 | K | C | -2.1748 | |
| 219 | V | C | 0.0000 | |
| 220 | E | C | -2.1897 | |
| 1 | D | F | -1.9004 | |
| 2 | I | F | -1.0677 | |
| 3 | Q | F | -1.2039 | |
| 4 | M | F | 0.0000 | |
| 5 | T | F | -0.9688 | |
| 6 | Q | F | 0.0000 | |
| 7 | S | F | -0.5438 | |
| 8 | P | F | -0.4859 | |
| 9 | S | F | -0.8817 | |
| 10 | S | F | -0.9210 | |
| 11 | L | F | -0.7626 | |
| 12 | S | F | -1.2125 | |
| 13 | A | F | 0.0000 | |
| 14 | S | F | -1.0001 | |
| 15 | V | F | -0.0545 | |
| 16 | G | F | -0.5657 | |
| 17 | D | F | -1.3057 | |
| 18 | R | F | -1.9888 | |
| 19 | V | F | -0.7915 | |
| 20 | T | F | -0.3829 | |
| 21 | I | F | 0.0000 | |
| 22 | T | F | -0.7353 | |
| 23 | C | F | 0.0000 | |
| 24 | R | F | -1.9974 | |
| 25 | A | F | 0.0000 | |
| 26 | S | F | -1.3166 | |
| 27 | Q | F | -1.8155 | |
| 28 | G | F | -1.8579 | |
| 29 | I | F | 0.0000 | |
| 30 | R | F | -2.5470 | |
| 31 | N | F | -1.4887 | |
| 32 | Y | F | -0.7402 | |
| 33 | L | F | 0.0000 | |
| 34 | A | F | 0.0000 | |
| 35 | W | F | 0.0000 | |
| 36 | Y | F | 0.0000 | |
| 37 | Q | F | 0.0000 | |
| 38 | Q | F | 0.0000 | |
| 39 | K | F | -2.4537 | |
| 40 | P | F | -1.7822 | |
| 41 | G | F | -1.6487 | |
| 42 | K | F | -2.4955 | |
| 43 | A | F | -1.7924 | |
| 44 | P | F | 0.0000 | |
| 45 | K | F | -1.9836 | |
| 46 | L | F | 0.0000 | |
| 47 | L | F | 0.0000 | |
| 48 | I | F | 0.0000 | |
| 49 | Y | F | 0.1751 | |
| 50 | A | F | -0.2343 | |
| 51 | A | F | 0.0000 | |
| 52 | S | F | -0.2407 | |
| 53 | T | F | 0.0348 | |
| 54 | L | F | 0.2443 | |
| 55 | Q | F | -0.3461 | |
| 56 | S | F | -0.3781 | |
| 57 | G | F | -0.5090 | |
| 58 | V | F | -0.2110 | |
| 59 | P | F | -0.3538 | |
| 60 | S | F | -0.4182 | |
| 61 | R | F | -0.7195 | |
| 62 | F | F | 0.0000 | |
| 63 | S | F | -0.2809 | |
| 64 | G | F | -0.2687 | |
| 65 | S | F | -0.8080 | |
| 66 | G | F | -1.5482 | |
| 67 | S | F | -1.8877 | |
| 68 | G | F | -2.0854 | |
| 69 | T | F | -2.1963 | |
| 70 | D | F | -2.8222 | |
| 71 | F | F | 0.0000 | |
| 72 | T | F | -0.7894 | |
| 73 | L | F | 0.0000 | |
| 74 | T | F | -0.4610 | |
| 75 | I | F | 0.0000 | |
| 76 | S | F | -1.2667 | |
| 77 | S | F | -0.9681 | |
| 78 | L | F | 0.0000 | |
| 79 | Q | F | -1.0580 | |
| 80 | P | F | -1.7580 | |
| 81 | E | F | -2.5602 | |
| 82 | D | F | 0.0000 | |
| 83 | V | F | 0.0000 | |
| 84 | A | F | 0.0000 | |
| 85 | T | F | -1.1442 | |
| 86 | Y | F | 0.0000 | |
| 87 | Y | F | 0.0000 | |
| 88 | C | F | 0.0000 | |
| 89 | Q | F | 0.0000 | |
| 90 | R | F | 0.0000 | |
| 91 | Y | F | 0.0000 | |
| 92 | N | F | -1.5333 | |
| 93 | R | F | -2.0767 | |
| 94 | A | F | 0.0000 | |
| 95 | P | F | -1.1611 | |
| 96 | Y | F | 0.0000 | |
| 97 | T | F | -0.5677 | |
| 98 | F | F | 0.0000 | |
| 99 | G | F | 0.0000 | |
| 100 | Q | F | -1.6866 | |
| 101 | G | F | -1.3415 | |
| 102 | T | F | 0.0000 | |
| 103 | K | F | -1.8207 | |
| 104 | V | F | 0.0000 | |
| 105 | E | F | -2.0579 | |
| 106 | I | F | 0.0000 | |
| 107 | K | F | -2.5997 | |
| 108 | R | F | -2.7110 | |
| 109 | T | F | -1.3452 | |
| 162 | S | F | 1.4738 | |
| 163 | V | F | 2.4594 | |
| 164 | T | F | 0.7935 | |
| 165 | E | F | -1.0038 | |
| 166 | Q | F | -1.1064 | |
| 167 | D | F | -1.8963 | |
| 168 | S | F | -2.4439 | |
| 169 | K | F | -2.7609 | |
| 170 | D | F | -1.9720 | |
| 171 | S | F | -2.2715 | |
| 172 | T | F | -1.0719 | |
| 173 | Y | F | 1.0630 | |
| 174 | S | F | 1.4303 | |
| 175 | L | F | 2.3317 | |
| 176 | S | F | 1.1114 | |
| 1 | E | E | -2.1842 | |
| 2 | V | E | -1.3236 | |
| 3 | Q | E | -1.3127 | |
| 4 | L | E | 0.0000 | |
| 5 | V | E | 1.0368 | |
| 6 | E | E | 0.0992 | |
| 7 | S | E | -0.2703 | |
| 8 | G | E | -0.8960 | |
| 9 | G | E | -0.4958 | |
| 10 | G | E | -0.1079 | |
| 11 | L | E | -0.0574 | |
| 12 | V | E | 0.0000 | |
| 13 | Q | E | -1.9859 | |
| 14 | P | E | -2.0340 | |
| 15 | G | E | -2.2588 | |
| 16 | R | E | -2.8766 | |
| 17 | S | E | -2.1268 | |
| 18 | L | E | -1.5063 | |
| 19 | R | E | -1.9274 | |
| 20 | L | E | 0.0000 | |
| 21 | S | E | -0.3893 | |
| 22 | C | E | 0.0000 | |
| 23 | A | E | -0.1870 | |
| 24 | A | E | 0.0000 | |
| 25 | S | E | -0.8853 | |
| 26 | G | E | -1.3084 | |
| 27 | F | E | -0.8227 | |
| 28 | T | E | -1.0070 | |
| 29 | F | E | 0.0000 | |
| 30 | D | E | -2.8225 | |
| 31 | D | E | -1.4591 | |
| 32 | Y | E | -0.1582 | |
| 33 | A | E | 0.0000 | |
| 34 | M | E | 0.0000 | |
| 35 | H | E | 0.0000 | |
| 36 | W | E | 0.0000 | |
| 37 | V | E | 0.0000 | |
| 38 | R | E | 0.0000 | |
| 39 | Q | E | -0.8298 | |
| 40 | A | E | -1.2174 | |
| 41 | P | E | -1.0173 | |
| 42 | G | E | -1.5092 | |
| 43 | K | E | -2.4110 | |
| 44 | G | E | -1.7520 | |
| 45 | L | E | 0.0000 | |
| 46 | E | E | -1.2274 | |
| 47 | W | E | 0.0000 | |
| 48 | V | E | 0.0000 | |
| 49 | S | E | 0.0000 | |
| 50 | A | E | 0.0000 | |
| 51 | I | E | 0.0000 | |
| 52 | T | E | 0.0000 | |
| 53 | W | E | -0.9686 | |
| 54 | N | E | -1.9953 | |
| 55 | S | E | -1.1614 | |
| 56 | G | E | -1.1985 | |
| 57 | H | E | -1.2180 | |
| 58 | I | E | -0.2600 | |
| 59 | D | E | -1.0454 | |
| 60 | Y | E | -0.9087 | |
| 61 | A | E | -1.4286 | |
| 62 | D | E | -2.5045 | |
| 63 | S | E | -1.6859 | |
| 64 | V | E | 0.0000 | |
| 65 | E | E | -2.7342 | |
| 66 | G | E | -1.8114 | |
| 67 | R | E | -1.3879 | |
| 68 | F | E | 0.0000 | |
| 69 | T | E | -0.8765 | |
| 70 | I | E | 0.0000 | |
| 71 | S | E | -0.4260 | |
| 72 | R | E | -1.1617 | |
| 73 | D | E | -1.7444 | |
| 74 | N | E | -2.1876 | |
| 75 | A | E | -1.5358 | |
| 76 | K | E | -2.3779 | |
| 77 | N | E | -2.0321 | |
| 78 | S | E | 0.0000 | |
| 79 | L | E | 0.0000 | |
| 80 | Y | E | -0.5837 | |
| 81 | L | E | 0.0000 | |
| 82 | Q | E | -1.5959 | |
| 83 | M | E | 0.0000 | |
| 84 | N | E | -2.2453 | |
| 85 | S | E | -1.7850 | |
| 86 | L | E | 0.0000 | |
| 87 | R | E | -2.5009 | |
| 88 | A | E | -1.6923 | |
| 89 | E | E | -2.2348 | |
| 90 | D | E | 0.0000 | |
| 91 | T | E | -0.8186 | |
| 92 | A | E | 0.0000 | |
| 93 | V | E | 0.1898 | |
| 94 | Y | E | 0.0000 | |
| 95 | Y | E | 0.0000 | |
| 96 | C | E | 0.0000 | |
| 97 | A | E | 0.0000 | |
| 98 | K | E | 0.0000 | |
| 99 | V | E | 0.0000 | |
| 100 | S | E | 0.0000 | |
| 101 | Y | E | 1.8845 | |
| 102 | L | E | 1.9998 | |
| 103 | S | E | 1.0214 | |
| 104 | T | E | 0.2401 | |
| 105 | A | E | -0.0933 | |
| 106 | S | E | 0.0000 | |
| 107 | S | E | 0.0000 | |
| 108 | L | E | 0.0000 | |
| 109 | D | E | -0.1831 | |
| 110 | Y | E | -0.1704 | |
| 111 | W | E | 0.0000 | |
| 112 | G | E | 0.0000 | |
| 113 | Q | E | -1.3465 | |
| 114 | G | E | -0.5746 | |
| 115 | T | E | -0.1016 | |
| 116 | L | E | -0.0400 | |
| 117 | V | E | 0.0000 | |
| 118 | T | E | 0.0000 | |
| 119 | V | E | 0.0000 | |
| 120 | S | E | -0.6353 | |
| 121 | S | E | -0.6584 | |
| 122 | A | E | -0.5539 | |
| 123 | S | E | -0.7968 | |
| 124 | T | E | -1.1056 | |
| 125 | K | E | -2.2013 | |
| 126 | G | E | -1.8316 | |
| 127 | P | E | -1.6228 | |
| 151 | K | E | -2.0669 | |
| 152 | D | E | -2.0393 | |
| 153 | Y | E | 0.0000 | |
| 154 | F | E | 0.0000 | |
| 155 | P | E | -0.6824 | |
| 156 | E | E | -0.5150 | |
| 157 | P | E | 0.0838 | |
| 158 | V | E | 0.9829 | |
| 159 | T | E | 1.2867 | |
| 160 | V | E | 2.1602 | |
| 161 | S | E | 1.0555 | |
| 162 | W | E | 1.1066 | |
| 163 | N | E | -0.4881 | |
| 164 | S | E | -0.3804 | |
| 165 | G | E | -0.4693 | |
| 166 | A | E | 0.0637 | |
| 167 | L | E | 0.8723 | |
| 168 | T | E | 0.2323 | |
| 169 | S | E | -0.1006 | |
| 170 | G | E | -0.3643 | |
| 171 | V | E | 0.2039 | |
| 172 | H | E | -0.1114 | |
| 173 | T | E | 0.6080 | |
| 174 | F | E | 1.5835 | |
| 175 | P | E | 1.1011 | |
| 176 | A | E | 1.1643 | |
| 177 | V | E | 1.8535 | |
| 178 | L | E | 1.7862 | |
| 179 | Q | E | 0.4360 | |
| 180 | S | E | 0.1323 | |
| 181 | S | E | -0.2463 | |
| 182 | G | E | -0.2387 | |
| 183 | L | E | -0.5922 | |
| 184 | Y | E | 0.0907 | |
| 185 | S | E | -0.2313 |