| Chain sequence(s) |
A: MRYFKEEVAGMKYGIYFAYWTKEWFADYKKYMDKVSALGFDVLEISCAALRDVYTTKEQLIELREYAKEKGLVLTAGYGPTKAENLCSEDPEAVRRAMTFFKDLLPKLQLMDIHILGGGLYSYWPVDFTINNDKQGDRARAVRNLRELSKTAEECDVVLGMEVLNRYEGYILNTCEEAIDFVDEIGSSHVKIMLDTFHMNIEETNMADAIRKAGDRLGHLHLGEQNRLVPGKGSLPWAEIGQALRDINYQGAAVMEPFVMQGGTIGSEIKVWRDMVPDLSEEALDRDAKGALEFCRHVFGI
C: MRYFKEEVAGMKYGIYFAYWTKEWFADYKKYMDKVSALGFDVLEISCAALRDVYTTKEQLIELREYAKEKGLVLTAGYGPTKAENLCSEDPEAVRRAMTFFKDLLPKLQLMDIHILGGGLYSYWPVDFTINNDKQGDRARAVRNLRELSKTAEECDVVLGMEVLNRYEGYILNTCEEAIDFVDEIGSSHVKIMLDTFHMNIEETNMADAIRKAGDRLGHLHLGEQNRLVPGKGSLPWAEIGQALRDINYQGAAVMEPFVMQGGTIGSEIKVWRDMVPDLSEEALDRDAKGALEFCRHVFGI B: MRYFKEEVAGMKYGIYFAYWTKEWFADYKKYMDKVSALGFDVLEISCAALRDVYTTKEQLIELREYAKEKGLVLTAGYGPTKAENLCSEDPEAVRRAMTFFKDLLPKLQLMDIHILGGGLYSYWPVDFTINNDKQGDRARAVRNLRELSKTAEECDVVLGMEVLNRYEGYILNTCEEAIDFVDEIGSSHVKIMLDTFHMNIEETNMADAIRKAGDRLGHLHLGEQNRLVPGKGSLPWAEIGQALRDINYQGAAVMEPFVMQGGTIGSEIKVWRDMVPDLSEEALDRDAKGALEFCRHVFGI D: MRYFKEEVAGMKYGIYFAYWTKEWFADYKKYMDKVSALGFDVLEISCAALRDVYTTKEQLIELREYAKEKGLVLTAGYGPTKAENLCSEDPEAVRRAMTFFKDLLPKLQLMDIHILGGGLYSYWPVDFTINNDKQGDRARAVRNLRELSKTAEECDVVLGMEVLNRYEGYILNTCEEAIDFVDEIGSSHVKIMLDTFHMNIEETNMADAIRKAGDRLGHLHLGEQNRLVPGKGSLPWAEIGQALRDINYQGAAVMEPFVMQGGTIGSEIKVWRDMVPDLSEEALDRDAKGALEFCRHVFGI input PDB |
| Selected Chain(s) | A,B,C,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 (00:00:03)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:45:58)
[INFO] Main: Simulation completed successfully. (00:46:40)
|
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 | M | A | 0.7995 | |
| 2 | R | A | -0.3496 | |
| 3 | Y | A | 0.8619 | |
| 4 | F | A | 0.5042 | |
| 5 | K | A | -1.7247 | |
| 6 | E | A | -2.2294 | |
| 7 | E | A | -2.0005 | |
| 8 | V | A | 0.0454 | |
| 9 | A | A | -0.1431 | |
| 10 | G | A | -0.3716 | |
| 11 | M | A | 0.0000 | |
| 12 | K | A | -0.2561 | |
| 13 | Y | A | 0.0000 | |
| 14 | G | A | 0.0000 | |
| 15 | I | A | 0.0000 | |
| 16 | Y | A | 0.0000 | |
| 17 | F | A | 0.0000 | |
| 18 | A | A | 0.0000 | |
| 19 | Y | A | 0.0000 | |
| 20 | W | A | 0.0000 | |
| 21 | T | A | -0.5368 | |
| 22 | K | A | -1.4735 | |
| 23 | E | A | -0.6236 | |
| 24 | W | A | 0.4856 | |
| 25 | F | A | 1.0012 | |
| 26 | A | A | -0.3910 | |
| 27 | D | A | -1.9772 | |
| 28 | Y | A | 0.0000 | |
| 29 | K | A | -2.3599 | |
| 30 | K | A | -2.7013 | |
| 31 | Y | A | 0.0000 | |
| 32 | M | A | 0.0000 | |
| 33 | D | A | -1.7359 | |
| 34 | K | A | -1.1891 | |
| 35 | V | A | 0.0000 | |
| 36 | S | A | -0.7573 | |
| 37 | A | A | -0.4706 | |
| 38 | L | A | -0.7227 | |
| 39 | G | A | -0.5190 | |
| 40 | F | A | 0.0000 | |
| 41 | D | A | -0.3340 | |
| 42 | V | A | 0.0000 | |
| 43 | L | A | 0.0000 | |
| 44 | E | A | 0.0000 | |
| 45 | I | A | 0.0000 | |
| 46 | S | A | 0.0000 | |
| 47 | C | A | 0.0000 | |
| 48 | A | A | -0.1925 | |
| 49 | A | A | 0.0000 | |
| 50 | L | A | 0.0000 | |
| 51 | R | A | -1.5957 | |
| 52 | D | A | -1.7574 | |
| 53 | V | A | -0.4324 | |
| 54 | Y | A | 0.0000 | |
| 55 | T | A | -1.4559 | |
| 56 | T | A | -1.9972 | |
| 57 | K | A | -2.8716 | |
| 58 | E | A | -3.1838 | |
| 59 | Q | A | -2.3826 | |
| 60 | L | A | 0.0000 | |
| 61 | I | A | -1.8517 | |
| 62 | E | A | -2.8745 | |
| 63 | L | A | 0.0000 | |
| 64 | R | A | -2.0218 | |
| 65 | E | A | -2.6821 | |
| 66 | Y | A | -2.3192 | |
| 67 | A | A | 0.0000 | |
| 68 | K | A | -3.2781 | |
| 69 | E | A | -3.3072 | |
| 70 | K | A | -2.5339 | |
| 71 | G | A | -1.8276 | |
| 72 | L | A | 0.0000 | |
| 73 | V | A | 0.5879 | |
| 74 | L | A | 0.0000 | |
| 75 | T | A | 0.0000 | |
| 76 | A | A | 0.0000 | |
| 77 | G | A | 0.0000 | |
| 78 | Y | A | 0.0000 | |
| 79 | G | A | -0.4000 | |
| 80 | P | A | 0.0000 | |
| 81 | T | A | -0.9247 | |
| 82 | K | A | -1.7968 | |
| 83 | A | A | -1.4905 | |
| 84 | E | A | -1.5460 | |
| 85 | N | A | 0.0000 | |
| 86 | L | A | 0.0000 | |
| 87 | C | A | 0.0000 | |
| 88 | S | A | -2.1976 | |
| 89 | E | A | -2.7690 | |
| 90 | D | A | -2.6601 | |
| 91 | P | A | -2.2647 | |
| 92 | E | A | -2.4887 | |
| 93 | A | A | 0.0000 | |
| 94 | V | A | -1.9984 | |
| 95 | R | A | -2.7183 | |
| 96 | R | A | -2.0533 | |
| 97 | A | A | 0.0000 | |
| 98 | M | A | -1.6636 | |
| 99 | T | A | -1.5464 | |
| 100 | F | A | -1.3574 | |
| 101 | F | A | 0.0000 | |
| 102 | K | A | -2.1725 | |
| 103 | D | A | -2.3515 | |
| 104 | L | A | 0.0000 | |
| 105 | L | A | 0.0000 | |
| 106 | P | A | -1.7469 | |
| 107 | K | A | -1.4752 | |
| 108 | L | A | 0.0000 | |
| 109 | Q | A | -1.7592 | |
| 110 | L | A | -0.7941 | |
| 111 | M | A | 0.0000 | |
| 112 | D | A | -1.4888 | |
| 113 | I | A | 0.0000 | |
| 114 | H | A | -0.9001 | |
| 115 | I | A | -0.3605 | |
| 116 | L | A | 0.0000 | |
| 117 | G | A | 0.0000 | |
| 118 | G | A | 0.0000 | |
| 119 | G | A | 0.0000 | |
| 120 | L | A | 0.0000 | |
| 121 | Y | A | 0.0000 | |
| 122 | S | A | 0.0000 | |
| 123 | Y | A | 0.0000 | |
| 124 | W | A | -0.3727 | |
| 125 | P | A | -0.3455 | |
| 126 | V | A | -0.0431 | |
| 127 | D | A | -0.0606 | |
| 128 | F | A | 0.3978 | |
| 129 | T | A | 0.5125 | |
| 130 | I | A | 0.8109 | |
| 131 | N | A | -0.9839 | |
| 132 | N | A | -1.3335 | |
| 133 | D | A | -2.4359 | |
| 134 | K | A | -1.9180 | |
| 135 | Q | A | -1.9790 | |
| 136 | G | A | -1.6922 | |
| 137 | D | A | 0.0000 | |
| 138 | R | A | -1.3759 | |
| 139 | A | A | -1.2921 | |
| 140 | R | A | -1.6927 | |
| 141 | A | A | 0.0000 | |
| 142 | V | A | 0.0000 | |
| 143 | R | A | -3.1628 | |
| 144 | N | A | -2.4143 | |
| 145 | L | A | 0.0000 | |
| 146 | R | A | -3.6228 | |
| 147 | E | A | -3.4355 | |
| 148 | L | A | 0.0000 | |
| 149 | S | A | 0.0000 | |
| 150 | K | A | -3.6423 | |
| 151 | T | A | -2.9983 | |
| 152 | A | A | 0.0000 | |
| 153 | E | A | -3.0771 | |
| 154 | E | A | -3.3630 | |
| 155 | C | A | 0.0000 | |
| 156 | D | A | -3.0786 | |
| 157 | V | A | 0.0000 | |
| 158 | V | A | -0.5364 | |
| 159 | L | A | 0.0000 | |
| 160 | G | A | 0.0000 | |
| 161 | M | A | 0.0000 | |
| 162 | E | A | -0.2559 | |
| 163 | V | A | 0.0000 | |
| 164 | L | A | 0.0000 | |
| 165 | N | A | 0.0000 | |
| 166 | R | A | 0.0000 | |
| 167 | Y | A | 0.0000 | |
| 168 | E | A | 0.0000 | |
| 169 | G | A | 0.0000 | |
| 170 | Y | A | 0.0000 | |
| 171 | I | A | 0.0000 | |
| 172 | L | A | 0.0000 | |
| 173 | N | A | 0.0000 | |
| 174 | T | A | 0.0000 | |
| 175 | C | A | 0.0000 | |
| 176 | E | A | -2.3995 | |
| 177 | E | A | -1.5240 | |
| 178 | A | A | 0.0000 | |
| 179 | I | A | -2.3679 | |
| 180 | D | A | -3.1996 | |
| 181 | F | A | 0.0000 | |
| 182 | V | A | 0.0000 | |
| 183 | D | A | -3.3039 | |
| 184 | E | A | -3.5698 | |
| 185 | I | A | 0.0000 | |
| 186 | G | A | -2.1831 | |
| 187 | S | A | -1.6420 | |
| 188 | S | A | -1.2110 | |
| 189 | H | A | -1.4286 | |
| 190 | V | A | 0.0000 | |
| 191 | K | A | -1.0744 | |
| 192 | I | A | 0.0000 | |
| 193 | M | A | 0.0000 | |
| 194 | L | A | 0.0000 | |
| 195 | D | A | 0.0000 | |
| 196 | T | A | 0.0000 | |
| 197 | F | A | 0.0000 | |
| 198 | H | A | 0.0000 | |
| 199 | M | A | 0.0000 | |
| 200 | N | A | -0.1578 | |
| 201 | I | A | 0.0000 | |
| 202 | E | A | 0.0000 | |
| 203 | E | A | 0.0000 | |
| 204 | T | A | -0.1972 | |
| 205 | N | A | 0.0000 | |
| 206 | M | A | 0.0000 | |
| 207 | A | A | 0.0000 | |
| 208 | D | A | -0.9728 | |
| 209 | A | A | 0.0000 | |
| 210 | I | A | 0.0000 | |
| 211 | R | A | -1.8337 | |
| 212 | K | A | -2.4529 | |
| 213 | A | A | 0.0000 | |
| 214 | G | A | -2.0119 | |
| 215 | D | A | -2.7059 | |
| 216 | R | A | -2.0574 | |
| 217 | L | A | 0.0000 | |
| 218 | G | A | -0.8510 | |
| 219 | H | A | 0.0000 | |
| 220 | L | A | 0.0000 | |
| 221 | H | A | 0.0000 | |
| 222 | L | A | 0.0000 | |
| 223 | G | A | 0.0000 | |
| 224 | E | A | 0.0000 | |
| 225 | Q | A | 0.0000 | |
| 226 | N | A | 0.0000 | |
| 227 | R | A | 0.0000 | |
| 228 | L | A | 0.0000 | |
| 229 | V | A | 0.0000 | |
| 230 | P | A | 0.0000 | |
| 231 | G | A | 0.0000 | |
| 232 | K | A | -0.5986 | |
| 233 | G | A | -0.3624 | |
| 234 | S | A | -0.3318 | |
| 235 | L | A | 0.0000 | |
| 236 | P | A | -0.2822 | |
| 237 | W | A | 0.0000 | |
| 238 | A | A | -0.2854 | |
| 239 | E | A | -0.4582 | |
| 240 | I | A | 0.0000 | |
| 241 | G | A | 0.0000 | |
| 242 | Q | A | -0.8935 | |
| 243 | A | A | 0.0000 | |
| 244 | L | A | 0.0000 | |
| 245 | R | A | -1.6272 | |
| 246 | D | A | -1.6017 | |
| 247 | I | A | -1.9247 | |
| 248 | N | A | -2.2179 | |
| 249 | Y | A | 0.0000 | |
| 250 | Q | A | -1.8157 | |
| 251 | G | A | -0.9294 | |
| 252 | A | A | 0.0000 | |
| 253 | A | A | 0.0000 | |
| 254 | V | A | 0.0000 | |
| 255 | M | A | 0.0000 | |
| 256 | E | A | -0.1839 | |
| 257 | P | A | 0.0000 | |
| 258 | F | A | 0.0000 | |
| 259 | V | A | 0.0000 | |
| 260 | M | A | -0.6526 | |
| 261 | Q | A | -1.1837 | |
| 262 | G | A | -1.2522 | |
| 263 | G | A | -1.2667 | |
| 264 | T | A | -0.9481 | |
| 265 | I | A | 0.0000 | |
| 266 | G | A | 0.0000 | |
| 267 | S | A | -0.9135 | |
| 268 | E | A | -0.5226 | |
| 269 | I | A | 0.0000 | |
| 270 | K | A | -0.3971 | |
| 271 | V | A | 0.0000 | |
| 272 | W | A | -0.4429 | |
| 273 | R | A | -0.8857 | |
| 274 | D | A | -1.2162 | |
| 275 | M | A | -0.5164 | |
| 276 | V | A | -0.5105 | |
| 277 | P | A | -0.9438 | |
| 278 | D | A | -1.9702 | |
| 279 | L | A | -1.2349 | |
| 280 | S | A | -2.0600 | |
| 281 | E | A | -3.2231 | |
| 282 | E | A | -3.4986 | |
| 283 | A | A | -2.6917 | |
| 284 | L | A | 0.0000 | |
| 285 | D | A | -2.5808 | |
| 286 | R | A | -3.1151 | |
| 287 | D | A | -2.1309 | |
| 288 | A | A | 0.0000 | |
| 289 | K | A | -1.6353 | |
| 290 | G | A | 0.0000 | |
| 291 | A | A | 0.0000 | |
| 292 | L | A | 0.0000 | |
| 293 | E | A | -1.2007 | |
| 294 | F | A | 0.0000 | |
| 295 | C | A | 0.0000 | |
| 296 | R | A | -0.8381 | |
| 297 | H | A | 0.0000 | |
| 298 | V | A | 0.0000 | |
| 299 | F | A | 0.0000 | |
| 300 | G | A | -0.5048 | |
| 301 | I | A | -0.2221 | |
| 1 | M | B | 0.7914 | |
| 2 | R | B | -0.3527 | |
| 3 | Y | B | 0.8627 | |
| 4 | F | B | 0.5062 | |
| 5 | K | B | -1.7296 | |
| 6 | E | B | -2.2345 | |
| 7 | E | B | -1.9883 | |
| 8 | V | B | 0.0618 | |
| 9 | A | B | -0.1352 | |
| 10 | G | B | -0.3595 | |
| 11 | M | B | 0.0000 | |
| 12 | K | B | -0.2260 | |
| 13 | Y | B | 0.0000 | |
| 14 | G | B | 0.0000 | |
| 15 | I | B | 0.0000 | |
| 16 | Y | B | 0.0000 | |
| 17 | F | B | 0.0000 | |
| 18 | A | B | 0.0000 | |
| 19 | Y | B | 0.0000 | |
| 20 | W | B | 0.0000 | |
| 21 | T | B | -0.5480 | |
| 22 | K | B | -1.4824 | |
| 23 | E | B | -0.6660 | |
| 24 | W | B | 0.4371 | |
| 25 | F | B | 1.0354 | |
| 26 | A | B | -0.3848 | |
| 27 | D | B | -1.9437 | |
| 28 | Y | B | 0.0000 | |
| 29 | K | B | -2.3369 | |
| 30 | K | B | -2.7643 | |
| 31 | Y | B | 0.0000 | |
| 32 | M | B | 0.0000 | |
| 33 | D | B | -1.7738 | |
| 34 | K | B | -1.2158 | |
| 35 | V | B | 0.0000 | |
| 36 | S | B | -0.7684 | |
| 37 | A | B | -0.4867 | |
| 38 | L | B | -0.7506 | |
| 39 | G | B | -0.5271 | |
| 40 | F | B | 0.0000 | |
| 41 | D | B | -0.3441 | |
| 42 | V | B | 0.0000 | |
| 43 | L | B | 0.0000 | |
| 44 | E | B | 0.0000 | |
| 45 | I | B | 0.0000 | |
| 46 | S | B | 0.0000 | |
| 47 | C | B | 0.0000 | |
| 48 | A | B | -0.0260 | |
| 49 | A | B | 0.0000 | |
| 50 | L | B | 0.0000 | |
| 51 | R | B | -1.1657 | |
| 52 | D | B | -1.4478 | |
| 53 | V | B | -0.0481 | |
| 54 | Y | B | -0.8691 | |
| 55 | T | B | -1.2117 | |
| 56 | T | B | -1.8789 | |
| 57 | K | B | -2.8443 | |
| 58 | E | B | -3.1783 | |
| 59 | Q | B | -2.2497 | |
| 60 | L | B | 0.0000 | |
| 61 | I | B | -1.9686 | |
| 62 | E | B | -2.8228 | |
| 63 | L | B | 0.0000 | |
| 64 | R | B | -2.1937 | |
| 65 | E | B | -2.5369 | |
| 66 | Y | B | -2.1829 | |
| 67 | A | B | 0.0000 | |
| 68 | K | B | -3.3030 | |
| 69 | E | B | -3.2302 | |
| 70 | K | B | -2.5098 | |
| 71 | G | B | -1.8159 | |
| 72 | L | B | 0.0000 | |
| 73 | V | B | 0.3512 | |
| 74 | L | B | 0.0000 | |
| 75 | T | B | 0.0000 | |
| 76 | A | B | 0.0000 | |
| 77 | G | B | 0.0000 | |
| 78 | Y | B | 0.0576 | |
| 79 | G | B | -0.3069 | |
| 80 | P | B | 0.0000 | |
| 81 | T | B | -0.9106 | |
| 82 | K | B | -1.8068 | |
| 83 | A | B | -1.4961 | |
| 84 | E | B | -1.5567 | |
| 85 | N | B | 0.0000 | |
| 86 | L | B | 0.0000 | |
| 87 | C | B | 0.0000 | |
| 88 | S | B | -2.2365 | |
| 89 | E | B | -2.8076 | |
| 90 | D | B | -2.6542 | |
| 91 | P | B | -2.2641 | |
| 92 | E | B | -2.4914 | |
| 93 | A | B | 0.0000 | |
| 94 | V | B | -2.0001 | |
| 95 | R | B | -2.7196 | |
| 96 | R | B | -2.0935 | |
| 97 | A | B | 0.0000 | |
| 98 | M | B | -1.7614 | |
| 99 | T | B | -1.6631 | |
| 100 | F | B | -1.4174 | |
| 101 | F | B | 0.0000 | |
| 102 | K | B | -2.5175 | |
| 103 | D | B | -2.5105 | |
| 104 | L | B | 0.0000 | |
| 105 | L | B | 0.0000 | |
| 106 | P | B | -1.8758 | |
| 107 | K | B | -1.6031 | |
| 108 | L | B | 0.0000 | |
| 109 | Q | B | -2.0229 | |
| 110 | L | B | -1.0326 | |
| 111 | M | B | 0.0000 | |
| 112 | D | B | -2.3638 | |
| 113 | I | B | 0.0000 | |
| 114 | H | B | -1.1163 | |
| 115 | I | B | -0.4490 | |
| 116 | L | B | 0.0000 | |
| 117 | G | B | 0.0000 | |
| 118 | G | B | 0.0000 | |
| 119 | G | B | 0.0000 | |
| 120 | L | B | 0.0000 | |
| 121 | Y | B | 0.0000 | |
| 122 | S | B | 0.0000 | |
| 123 | Y | B | 0.0000 | |
| 124 | W | B | -0.3730 | |
| 125 | P | B | -0.3727 | |
| 126 | V | B | -0.0727 | |
| 127 | D | B | -0.1221 | |
| 128 | F | B | 0.3965 | |
| 129 | T | B | 0.4285 | |
| 130 | I | B | 0.5592 | |
| 131 | N | B | -1.1692 | |
| 132 | N | B | -1.5524 | |
| 133 | D | B | -2.8073 | |
| 134 | K | B | -2.1036 | |
| 135 | Q | B | -2.0786 | |
| 136 | G | B | -1.8004 | |
| 137 | D | B | 0.0000 | |
| 138 | R | B | -1.4312 | |
| 139 | A | B | -1.5092 | |
| 140 | R | B | -1.7283 | |
| 141 | A | B | 0.0000 | |
| 142 | V | B | 0.0000 | |
| 143 | R | B | -3.1897 | |
| 144 | N | B | -2.4368 | |
| 145 | L | B | 0.0000 | |
| 146 | R | B | -3.6989 | |
| 147 | E | B | -3.4731 | |
| 148 | L | B | 0.0000 | |
| 149 | S | B | 0.0000 | |
| 150 | K | B | -3.6841 | |
| 151 | T | B | -3.0792 | |
| 152 | A | B | 0.0000 | |
| 153 | E | B | -3.0440 | |
| 154 | E | B | -3.3423 | |
| 155 | C | B | 0.0000 | |
| 156 | D | B | -3.1506 | |
| 157 | V | B | 0.0000 | |
| 158 | V | B | -0.5215 | |
| 159 | L | B | 0.0000 | |
| 160 | G | B | 0.0000 | |
| 161 | M | B | 0.0000 | |
| 162 | E | B | -0.2547 | |
| 163 | V | B | 0.0000 | |
| 164 | L | B | 0.0000 | |
| 165 | N | B | 0.0000 | |
| 166 | R | B | 0.0000 | |
| 167 | Y | B | 0.0000 | |
| 168 | E | B | 0.0000 | |
| 169 | G | B | 0.0000 | |
| 170 | Y | B | 0.0000 | |
| 171 | I | B | 0.0000 | |
| 172 | L | B | 0.0000 | |
| 173 | N | B | 0.0000 | |
| 174 | T | B | 0.0000 | |
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| 4 | F | C | 0.4860 | |
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| 6 | E | C | -2.2197 | |
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| 10 | G | C | -0.3484 | |
| 11 | M | C | 0.0000 | |
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| 13 | Y | C | 0.0000 | |
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| 20 | W | C | 0.0000 | |
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| 22 | K | C | -1.5057 | |
| 23 | E | C | -0.6144 | |
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| 31 | Y | C | 0.0000 | |
| 32 | M | C | 0.0000 | |
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| 35 | V | C | 0.0000 | |
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| 50 | L | C | 0.0000 | |
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| 53 | V | C | -0.3757 | |
| 54 | Y | C | 0.0000 | |
| 55 | T | C | -1.3769 | |
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| 57 | K | C | -2.8762 | |
| 58 | E | C | -3.1888 | |
| 59 | Q | C | -2.3302 | |
| 60 | L | C | 0.0000 | |
| 61 | I | C | -1.9497 | |
| 62 | E | C | -2.8467 | |
| 63 | L | C | 0.0000 | |
| 64 | R | C | -2.0356 | |
| 65 | E | C | -2.6230 | |
| 66 | Y | C | -2.2297 | |
| 67 | A | C | 0.0000 | |
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| 70 | K | C | -2.4776 | |
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| 72 | L | C | 0.0000 | |
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| 78 | Y | C | 0.0000 | |
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| 80 | P | C | 0.0000 | |
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| 83 | A | C | -1.4890 | |
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| 85 | N | C | 0.0000 | |
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| 90 | D | C | -2.6417 | |
| 91 | P | C | -2.2660 | |
| 92 | E | C | -2.5100 | |
| 93 | A | C | 0.0000 | |
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| 95 | R | C | -2.7222 | |
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| 97 | A | C | 0.0000 | |
| 98 | M | C | -1.7608 | |
| 99 | T | C | -1.6593 | |
| 100 | F | C | -1.4262 | |
| 101 | F | C | 0.0000 | |
| 102 | K | C | -2.5168 | |
| 103 | D | C | -2.5128 | |
| 104 | L | C | 0.0000 | |
| 105 | L | C | 0.0000 | |
| 106 | P | C | -1.8368 | |
| 107 | K | C | -1.5576 | |
| 108 | L | C | 0.0000 | |
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| 110 | L | C | -0.8742 | |
| 111 | M | C | 0.0000 | |
| 112 | D | C | -1.8733 | |
| 113 | I | C | 0.0000 | |
| 114 | H | C | -1.0035 | |
| 115 | I | C | -0.4074 | |
| 116 | L | C | 0.0000 | |
| 117 | G | C | 0.0000 | |
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| 120 | L | C | 0.0000 | |
| 121 | Y | C | 0.0000 | |
| 122 | S | C | 0.0000 | |
| 123 | Y | C | 0.0000 | |
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| 125 | P | C | -0.3399 | |
| 126 | V | C | -0.0566 | |
| 127 | D | C | -0.1076 | |
| 128 | F | C | 0.4305 | |
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| 130 | I | C | 0.6213 | |
| 131 | N | C | -1.0744 | |
| 132 | N | C | -1.3830 | |
| 133 | D | C | -2.4542 | |
| 134 | K | C | -1.8961 | |
| 135 | Q | C | -1.9834 | |
| 136 | G | C | -1.6954 | |
| 137 | D | C | 0.0000 | |
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| 139 | A | C | -1.4813 | |
| 140 | R | C | -1.7060 | |
| 141 | A | C | 0.0000 | |
| 142 | V | C | 0.0000 | |
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| 144 | N | C | -2.4118 | |
| 145 | L | C | 0.0000 | |
| 146 | R | C | -3.6035 | |
| 147 | E | C | -3.4255 | |
| 148 | L | C | 0.0000 | |
| 149 | S | C | 0.0000 | |
| 150 | K | C | -3.6831 | |
| 151 | T | C | -3.0860 | |
| 152 | A | C | 0.0000 | |
| 153 | E | C | -3.0965 | |
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| 155 | C | C | 0.0000 | |
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| 159 | L | C | 0.0000 | |
| 160 | G | C | 0.0000 | |
| 161 | M | C | 0.0000 | |
| 162 | E | C | -0.2529 | |
| 163 | V | C | 0.0000 | |
| 164 | L | C | 0.0000 | |
| 165 | N | C | 0.0000 | |
| 166 | R | C | 0.0000 | |
| 167 | Y | C | 0.0000 | |
| 168 | E | C | 0.0000 | |
| 169 | G | C | 0.0000 | |
| 170 | Y | C | 0.0000 | |
| 171 | I | C | 0.0000 | |
| 172 | L | C | 0.0000 | |
| 173 | N | C | 0.0000 | |
| 174 | T | C | 0.0000 | |
| 175 | C | C | 0.0000 | |
| 176 | E | C | -2.5485 | |
| 177 | E | C | -1.5884 | |
| 178 | A | C | 0.0000 | |
| 179 | I | C | -2.4195 | |
| 180 | D | C | -3.2395 | |
| 181 | F | C | 0.0000 | |
| 182 | V | C | 0.0000 | |
| 183 | D | C | -3.2909 | |
| 184 | E | C | -3.5573 | |
| 185 | I | C | 0.0000 | |
| 186 | G | C | -2.1737 | |
| 187 | S | C | -1.6405 | |
| 188 | S | C | -1.2190 | |
| 189 | H | C | -1.4390 | |
| 190 | V | C | 0.0000 | |
| 191 | K | C | -1.0827 | |
| 192 | I | C | 0.0000 | |
| 193 | M | C | 0.0000 | |
| 194 | L | C | 0.0000 | |
| 195 | D | C | 0.0000 | |
| 196 | T | C | 0.0000 | |
| 197 | F | C | 0.0000 | |
| 198 | H | C | 0.0000 | |
| 199 | M | C | 0.0000 | |
| 200 | N | C | 0.0000 | |
| 201 | I | C | 0.0000 | |
| 202 | E | C | 0.0000 | |
| 203 | E | C | 0.0000 | |
| 204 | T | C | -0.1737 | |
| 205 | N | C | 0.0000 | |
| 206 | M | C | 0.0000 | |
| 207 | A | C | 0.0000 | |
| 208 | D | C | -0.9603 | |
| 209 | A | C | 0.0000 | |
| 210 | I | C | 0.0000 | |
| 211 | R | C | -1.8161 | |
| 212 | K | C | -2.4081 | |
| 213 | A | C | 0.0000 | |
| 214 | G | C | -1.9964 | |
| 215 | D | C | -2.6942 | |
| 216 | R | C | -2.0628 | |
| 217 | L | C | 0.0000 | |
| 218 | G | C | -0.8478 | |
| 219 | H | C | 0.0000 | |
| 220 | L | C | 0.0000 | |
| 221 | H | C | 0.0000 | |
| 222 | L | C | 0.0000 | |
| 223 | G | C | 0.0000 | |
| 224 | E | C | 0.0000 | |
| 225 | Q | C | 0.0000 | |
| 226 | N | C | 0.0000 | |
| 227 | R | C | 0.0000 | |
| 228 | L | C | 0.0000 | |
| 229 | V | C | 0.0000 | |
| 230 | P | C | 0.0000 | |
| 231 | G | C | 0.0000 | |
| 232 | K | C | -0.6111 | |
| 233 | G | C | -0.3642 | |
| 234 | S | C | -0.3295 | |
| 235 | L | C | 0.0000 | |
| 236 | P | C | -0.2617 | |
| 237 | W | C | 0.0000 | |
| 238 | A | C | -0.2941 | |
| 239 | E | C | -0.4753 | |
| 240 | I | C | 0.0000 | |
| 241 | G | C | 0.0000 | |
| 242 | Q | C | -0.9366 | |
| 243 | A | C | 0.0000 | |
| 244 | L | C | 0.0000 | |
| 245 | R | C | -1.7172 | |
| 246 | D | C | -1.6804 | |
| 247 | I | C | -1.9489 | |
| 248 | N | C | -2.2414 | |
| 249 | Y | C | 0.0000 | |
| 250 | Q | C | -1.7551 | |
| 251 | G | C | -0.8941 | |
| 252 | A | C | 0.0000 | |
| 253 | A | C | 0.0000 | |
| 254 | V | C | 0.0000 | |
| 255 | M | C | 0.0000 | |
| 256 | E | C | -0.1810 | |
| 257 | P | C | 0.0000 | |
| 258 | F | C | 0.0000 | |
| 259 | V | C | 0.0000 | |
| 260 | M | C | -1.0952 | |
| 261 | Q | C | -1.8847 | |
| 262 | G | C | -1.5476 | |
| 263 | G | C | -1.3593 | |
| 264 | T | C | -0.9966 | |
| 265 | I | C | 0.0000 | |
| 266 | G | C | 0.0000 | |
| 267 | S | C | -1.0052 | |
| 268 | E | C | -0.5321 | |
| 269 | I | C | 0.0000 | |
| 270 | K | C | -0.4674 | |
| 271 | V | C | 0.0000 | |
| 272 | W | C | -0.5997 | |
| 273 | R | C | -1.1839 | |
| 274 | D | C | -1.9590 | |
| 275 | M | C | -0.8885 | |
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| 277 | P | C | -1.1109 | |
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| 280 | S | C | -2.0857 | |
| 281 | E | C | -3.2377 | |
| 282 | E | C | -3.5099 | |
| 283 | A | C | -2.7190 | |
| 284 | L | C | 0.0000 | |
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| 286 | R | C | -3.1666 | |
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| 290 | G | C | -1.5837 | |
| 291 | A | C | 0.0000 | |
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| 293 | E | C | -1.2198 | |
| 294 | F | C | 0.0000 | |
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| 297 | H | C | 0.0000 | |
| 298 | V | C | 0.0000 | |
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| 1 | M | D | 0.7915 | |
| 2 | R | D | -0.3384 | |
| 3 | Y | D | 0.8560 | |
| 4 | F | D | 0.4895 | |
| 5 | K | D | -1.7276 | |
| 6 | E | D | -2.2209 | |
| 7 | E | D | -2.0013 | |
| 8 | V | D | 0.0589 | |
| 9 | A | D | -0.1468 | |
| 10 | G | D | -0.3646 | |
| 11 | M | D | 0.0000 | |
| 12 | K | D | -0.2377 | |
| 13 | Y | D | 0.0000 | |
| 14 | G | D | 0.0000 | |
| 15 | I | D | 0.0000 | |
| 16 | Y | D | 0.0000 | |
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| 18 | A | D | 0.0000 | |
| 19 | Y | D | 0.0000 | |
| 20 | W | D | 0.0000 | |
| 21 | T | D | -0.7700 | |
| 22 | K | D | -1.9355 | |
| 23 | E | D | -0.6442 | |
| 24 | W | D | 0.4140 | |
| 25 | F | D | 0.8828 | |
| 26 | A | D | -0.4564 | |
| 27 | D | D | -1.9605 | |
| 28 | Y | D | 0.0000 | |
| 29 | K | D | -2.2836 | |
| 30 | K | D | -2.6579 | |
| 31 | Y | D | 0.0000 | |
| 32 | M | D | 0.0000 | |
| 33 | D | D | -1.7132 | |
| 34 | K | D | -1.1646 | |
| 35 | V | D | 0.0000 | |
| 36 | S | D | -0.7520 | |
| 37 | A | D | -0.4904 | |
| 38 | L | D | -0.7821 | |
| 39 | G | D | -0.5356 | |
| 40 | F | D | 0.0000 | |
| 41 | D | D | -0.3209 | |
| 42 | V | D | 0.0000 | |
| 43 | L | D | 0.0000 | |
| 44 | E | D | 0.0000 | |
| 45 | I | D | 0.0000 | |
| 46 | S | D | 0.0000 | |
| 47 | C | D | 0.0000 | |
| 48 | A | D | -0.1800 | |
| 49 | A | D | 0.0000 | |
| 50 | L | D | 0.0000 | |
| 51 | R | D | -1.5639 | |
| 52 | D | D | -1.7279 | |
| 53 | V | D | -0.3711 | |
| 54 | Y | D | -1.1102 | |
| 55 | T | D | -1.3673 | |
| 56 | T | D | -1.9549 | |
| 57 | K | D | -2.8585 | |
| 58 | E | D | -3.1897 | |
| 59 | Q | D | -2.3210 | |
| 60 | L | D | 0.0000 | |
| 61 | I | D | -1.9766 | |
| 62 | E | D | -2.9201 | |
| 63 | L | D | 0.0000 | |
| 64 | R | D | -2.0606 | |
| 65 | E | D | -2.7149 | |
| 66 | Y | D | -2.3153 | |
| 67 | A | D | 0.0000 | |
| 68 | K | D | -3.2767 | |
| 69 | E | D | -3.3015 | |
| 70 | K | D | -2.5226 | |
| 71 | G | D | -1.8266 | |
| 72 | L | D | 0.0000 | |
| 73 | V | D | 0.5742 | |
| 74 | L | D | 0.0000 | |
| 75 | T | D | 0.0000 | |
| 76 | A | D | 0.0000 | |
| 77 | G | D | 0.0000 | |
| 78 | Y | D | 0.0000 | |
| 79 | G | D | -0.3717 | |
| 80 | P | D | 0.0000 | |
| 81 | T | D | -0.9244 | |
| 82 | K | D | -1.7958 | |
| 83 | A | D | -1.4813 | |
| 84 | E | D | -1.5500 | |
| 85 | N | D | 0.0000 | |
| 86 | L | D | 0.0000 | |
| 87 | C | D | 0.0000 | |
| 88 | S | D | -2.1959 | |
| 89 | E | D | -2.7615 | |
| 90 | D | D | -2.6307 | |
| 91 | P | D | -2.2514 | |
| 92 | E | D | -2.4932 | |
| 93 | A | D | 0.0000 | |
| 94 | V | D | -2.0098 | |
| 95 | R | D | -2.7362 | |
| 96 | R | D | -2.0870 | |
| 97 | A | D | 0.0000 | |
| 98 | M | D | 0.0000 | |
| 99 | T | D | -1.7062 | |
| 100 | F | D | -1.4923 | |
| 101 | F | D | 0.0000 | |
| 102 | K | D | -2.5426 | |
| 103 | D | D | -2.5314 | |
| 104 | L | D | 0.0000 | |
| 105 | L | D | 0.0000 | |
| 106 | P | D | -1.7922 | |
| 107 | K | D | -1.4931 | |
| 108 | L | D | 0.0000 | |
| 109 | Q | D | -1.7287 | |
| 110 | L | D | -0.7508 | |
| 111 | M | D | 0.0000 | |
| 112 | D | D | -1.4964 | |
| 113 | I | D | 0.0000 | |
| 114 | H | D | -0.9023 | |
| 115 | I | D | -0.3645 | |
| 116 | L | D | 0.0000 | |
| 117 | G | D | 0.0000 | |
| 118 | G | D | 0.0000 | |
| 119 | G | D | 0.0000 | |
| 120 | L | D | 0.0000 | |
| 121 | Y | D | 0.0000 | |
| 122 | S | D | 0.0000 | |
| 123 | Y | D | 0.0000 | |
| 124 | W | D | -0.3779 | |
| 125 | P | D | -0.3407 | |
| 126 | V | D | -0.0174 | |
| 127 | D | D | 0.0045 | |
| 128 | F | D | 0.4971 | |
| 129 | T | D | 0.6015 | |
| 130 | I | D | 0.9613 | |
| 131 | N | D | -0.9194 | |
| 132 | N | D | -1.3135 | |
| 133 | D | D | -2.4649 | |
| 134 | K | D | -1.9354 | |
| 135 | Q | D | -1.9909 | |
| 136 | G | D | -1.7082 | |
| 137 | D | D | 0.0000 | |
| 138 | R | D | -1.3877 | |
| 139 | A | D | -1.3017 | |
| 140 | R | D | -1.7220 | |
| 141 | A | D | 0.0000 | |
| 142 | V | D | 0.0000 | |
| 143 | R | D | -3.1367 | |
| 144 | N | D | -2.4057 | |
| 145 | L | D | 0.0000 | |
| 146 | R | D | -3.5328 | |
| 147 | E | D | -3.4074 | |
| 148 | L | D | 0.0000 | |
| 149 | S | D | 0.0000 | |
| 150 | K | D | -3.6622 | |
| 151 | T | D | -3.0732 | |
| 152 | A | D | 0.0000 | |
| 153 | E | D | -3.0839 | |
| 154 | E | D | -3.3707 | |
| 155 | C | D | 0.0000 | |
| 156 | D | D | -3.1103 | |
| 157 | V | D | 0.0000 | |
| 158 | V | D | -0.5377 | |
| 159 | L | D | 0.0000 | |
| 160 | G | D | 0.0000 | |
| 161 | M | D | 0.0000 | |
| 162 | E | D | 0.0000 | |
| 163 | V | D | 0.0000 | |
| 164 | L | D | 0.0000 | |
| 165 | N | D | 0.0000 | |
| 166 | R | D | 0.0000 | |
| 167 | Y | D | 0.0000 | |
| 168 | E | D | 0.0000 | |
| 169 | G | D | 0.0000 | |
| 170 | Y | D | 0.0000 | |
| 171 | I | D | 0.0000 | |
| 172 | L | D | 0.0000 | |
| 173 | N | D | 0.0000 | |
| 174 | T | D | 0.0000 | |
| 175 | C | D | 0.0000 | |
| 176 | E | D | -2.5724 | |
| 177 | E | D | -1.6205 | |
| 178 | A | D | 0.0000 | |
| 179 | I | D | -2.4429 | |
| 180 | D | D | -3.2549 | |
| 181 | F | D | 0.0000 | |
| 182 | V | D | 0.0000 | |
| 183 | D | D | -3.2948 | |
| 184 | E | D | -3.5550 | |
| 185 | I | D | 0.0000 | |
| 186 | G | D | -2.1619 | |
| 187 | S | D | -1.6213 | |
| 188 | S | D | -1.2133 | |
| 189 | H | D | -1.4317 | |
| 190 | V | D | 0.0000 | |
| 191 | K | D | -1.0457 | |
| 192 | I | D | 0.0000 | |
| 193 | M | D | 0.0000 | |
| 194 | L | D | 0.0000 | |
| 195 | D | D | 0.0000 | |
| 196 | T | D | 0.0000 | |
| 197 | F | D | 0.0000 | |
| 198 | H | D | 0.0000 | |
| 199 | M | D | 0.0000 | |
| 200 | N | D | 0.0000 | |
| 201 | I | D | 0.0000 | |
| 202 | E | D | 0.0000 | |
| 203 | E | D | 0.0000 | |
| 204 | T | D | -0.1814 | |
| 205 | N | D | 0.0000 | |
| 206 | M | D | 0.0000 | |
| 207 | A | D | 0.0000 | |
| 208 | D | D | -0.9673 | |
| 209 | A | D | 0.0000 | |
| 210 | I | D | 0.0000 | |
| 211 | R | D | -1.8270 | |
| 212 | K | D | -2.4649 | |
| 213 | A | D | 0.0000 | |
| 214 | G | D | -2.0113 | |
| 215 | D | D | -2.7107 | |
| 216 | R | D | -2.0679 | |
| 217 | L | D | 0.0000 | |
| 218 | G | D | -0.8315 | |
| 219 | H | D | 0.0000 | |
| 220 | L | D | 0.0000 | |
| 221 | H | D | 0.0000 | |
| 222 | L | D | 0.0000 | |
| 223 | G | D | 0.0000 | |
| 224 | E | D | 0.0000 | |
| 225 | Q | D | 0.0000 | |
| 226 | N | D | 0.0000 | |
| 227 | R | D | 0.0000 | |
| 228 | L | D | 0.0000 | |
| 229 | V | D | 0.0000 | |
| 230 | P | D | 0.0000 | |
| 231 | G | D | 0.0000 | |
| 232 | K | D | -0.5764 | |
| 233 | G | D | -0.3424 | |
| 234 | S | D | -0.3135 | |
| 235 | L | D | 0.0000 | |
| 236 | P | D | -0.2666 | |
| 237 | W | D | 0.0000 | |
| 238 | A | D | -0.2935 | |
| 239 | E | D | -0.4581 | |
| 240 | I | D | 0.0000 | |
| 241 | G | D | 0.0000 | |
| 242 | Q | D | -0.8831 | |
| 243 | A | D | 0.0000 | |
| 244 | L | D | 0.0000 | |
| 245 | R | D | -1.6020 | |
| 246 | D | D | -1.5649 | |
| 247 | I | D | -1.9118 | |
| 248 | N | D | -2.2058 | |
| 249 | Y | D | 0.0000 | |
| 250 | Q | D | -1.8104 | |
| 251 | G | D | -0.9260 | |
| 252 | A | D | 0.0000 | |
| 253 | A | D | 0.0000 | |
| 254 | V | D | 0.0000 | |
| 255 | M | D | 0.0000 | |
| 256 | E | D | 0.0000 | |
| 257 | P | D | 0.0000 | |
| 258 | F | D | 0.0000 | |
| 259 | V | D | 0.0000 | |
| 260 | M | D | -1.1597 | |
| 261 | Q | D | -2.0233 | |
| 262 | G | D | -1.6448 | |
| 263 | G | D | -1.3718 | |
| 264 | T | D | -1.0165 | |
| 265 | I | D | 0.0000 | |
| 266 | G | D | 0.0000 | |
| 267 | S | D | -1.0422 | |
| 268 | E | D | -0.5037 | |
| 269 | I | D | 0.0000 | |
| 270 | K | D | -0.4615 | |
| 271 | V | D | 0.0000 | |
| 272 | W | D | -0.6102 | |
| 273 | R | D | -1.1494 | |
| 274 | D | D | -1.9032 | |
| 275 | M | D | -0.8588 | |
| 276 | V | D | -0.6828 | |
| 277 | P | D | -1.0989 | |
| 278 | D | D | -2.0888 | |
| 279 | L | D | -1.3706 | |
| 280 | S | D | -2.0683 | |
| 281 | E | D | -3.2284 | |
| 282 | E | D | -3.5034 | |
| 283 | A | D | -2.7227 | |
| 284 | L | D | 0.0000 | |
| 285 | D | D | -2.6566 | |
| 286 | R | D | -3.2024 | |
| 287 | D | D | -2.1964 | |
| 288 | A | D | 0.0000 | |
| 289 | K | D | -1.8529 | |
| 290 | G | D | -1.5611 | |
| 291 | A | D | 0.0000 | |
| 292 | L | D | 0.0000 | |
| 293 | E | D | -1.1629 | |
| 294 | F | D | 0.0000 | |
| 295 | C | D | 0.0000 | |
| 296 | R | D | -0.7744 | |
| 297 | H | D | 0.0000 | |
| 298 | V | D | 0.0000 | |
| 299 | F | D | 0.0000 | |
| 300 | G | D | -0.4916 | |
| 301 | I | D | -0.1903 |