| Chain sequence(s) |
A: SVIKPEMKIKLRMEGAVNGHKFVIEGEGIGKPYEGTQTLDLTVEEGAPLPFSYDILTPAFYYYNRAFTKYPEDIPDYFKQAFPEGYSWERSMTYEDQGICIATSDITMEGDCFFYEIRFDGTNFPPNGPVMQKKTLKWEPSTEKMYVEDGVLKGDVEMALLLEGGGHYRCDFKTTYKAKKDVRLPDAHEVDHRIEILSHDKDYNKVRLYEHAEARYS
C: ASVIKPEMKIKLRMEGAVNGHKFVIEGEGIGKPYEGTQTLDLTVEEGAPLPFSYDILTPAFYYYNRAFTKYPEDIPDYFKQAFPEGYSWERSMTYEDQGICIATSDITMEGDCFFYEIRFDGTNFPPNGPVMQKKTLKWEPSTEKMYVEDGVLKGDVEMALLLEGGGHYRCDFKTTYKAKKDVRLPDAHEVDHRIEILSHDKDYNKVRLYEHAEARYS B: ASVIKPEMKIKLRMEGAVNGHKFVIEGEGIGKPYEGTQTLDLTVEEGAPLPFSYDILTPAFYYYNRAFTKYPEDIPDYFKQAFPEGYSWERSMTYEDQGICIATSDITMEGDCFFYEIRFDGTNFPPNGPVMQKKTLKWEPSTEKMYVEDGVLKGDVEMALLLEGGGHYRCDFKTTYKAKKDVRLPDAHEVDHRIEILSHDKDYNKVRLYEHAEARYS E: SSSQVQLVESGGGLVQAGGSLRLSCAASGFPVDTQWMHWYRQAPGKEREWVAAISSTGRSTFYADSVKGRFTISRDNAKNTVYLQMNSLKPEDTAVYYCTVYVGNRYRGQGTQVTVSAG D: SVIKPEMKIKLRMEGAVNGHKFVIEGEGIGKPYEGTQTLDLTVEEGAPLPFSYDILTPAFYYYNRAFTKYPEDIPDYFKQAFPEGYSWERSMTYEDQGICIATSDITMEGDCFFYEIRFDGTNFPPNGPVMQKKTLKWEPSTEKMYVEDGVLKGDVEMALLLEGGGHYRCDFKTTYKKAKKDVRLPDAHEVDHRIEILSHDKDYNKVRLYEHAEARYS G: QVQLVESGGGLVQAGGSLRLSCAASGFPVDTQWMHWYRQAPGKEREWVAAISSTGRRSTFYADSVKGRFTISRDNAKNTVYLQMNSLKPEDTAVYYCTVYVGNRYRGQGTQVTVSA F: SSSQVQLVESGGGLVQAGGSLRLSCAASGFPVDTQWMHWYRQAPGKEREWVAAISSTGRSTFYADSVKGRFTISRDNAKNTVYLQMNSLKPEDTAVYYCTVYVGNRYRGQGTQVTVSAG H: QVQLVESGGGLVQAGGSLRLSCAASGFPVDTQWMHWYRQREWVAAISSTGRSTFYADSVKGRFTISRDNAKNTVYLQMNSLKPEDTAVYYCTVYVGNRYRGQGTQVTVS input PDB |
| Selected Chain(s) | A,C,B,E,D,G,F,H |
| 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 (00:27:37)
[INFO] Main: Simulation completed successfully. (00:27:58)
|
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 | |
| 3 | S | A | -0.3189 | |
| 4 | V | A | -0.2209 | |
| 5 | I | A | 0.0000 | |
| 6 | K | A | -2.6309 | |
| 7 | P | A | -1.9139 | |
| 8 | E | A | -2.6879 | |
| 9 | M | A | 0.0000 | |
| 10 | K | A | -2.6681 | |
| 11 | I | A | 0.0000 | |
| 12 | K | A | -1.7241 | |
| 13 | L | A | 0.0000 | |
| 14 | R | A | -1.1909 | |
| 15 | M | A | 0.0000 | |
| 16 | E | A | -1.1639 | |
| 17 | G | A | 0.0000 | |
| 18 | A | A | 0.0000 | |
| 19 | V | A | 0.0000 | |
| 20 | N | A | -0.7991 | |
| 21 | G | A | -0.8751 | |
| 22 | H | A | -0.9973 | |
| 23 | K | A | -1.4820 | |
| 24 | F | A | 0.0000 | |
| 25 | V | A | 0.0000 | |
| 26 | I | A | 0.0000 | |
| 27 | E | A | -1.8929 | |
| 28 | G | A | -1.9672 | |
| 29 | E | A | -2.7718 | |
| 30 | G | A | -1.7135 | |
| 31 | I | A | -1.5185 | |
| 32 | G | A | 0.0000 | |
| 33 | K | A | -1.6491 | |
| 34 | P | A | 0.0000 | |
| 35 | Y | A | -0.5404 | |
| 36 | E | A | -0.8334 | |
| 37 | G | A | 0.0000 | |
| 38 | T | A | 0.0000 | |
| 39 | Q | A | 0.0000 | |
| 40 | T | A | 0.0000 | |
| 41 | L | A | 0.0000 | |
| 42 | D | A | -2.3337 | |
| 43 | L | A | 0.0000 | |
| 44 | T | A | -2.1233 | |
| 45 | V | A | 0.0000 | |
| 46 | E | A | -3.0350 | |
| 47 | E | A | -2.8091 | |
| 48 | G | A | -1.7070 | |
| 49 | A | A | -1.4454 | |
| 50 | P | A | -1.3351 | |
| 51 | L | A | 0.0000 | |
| 52 | P | A | -0.8490 | |
| 53 | F | A | 0.0000 | |
| 54 | S | A | 0.0000 | |
| 55 | Y | A | 0.0000 | |
| 56 | D | A | 0.0000 | |
| 57 | I | A | 0.0000 | |
| 58 | L | A | 0.0000 | |
| 59 | T | A | 0.0000 | |
| 60 | P | A | -0.0694 | |
| 61 | A | A | 0.0000 | |
| 62 | F | A | 0.0000 | |
| 66 | N | A | -0.1673 | |
| 67 | R | A | 0.0000 | |
| 68 | A | A | 0.0000 | |
| 69 | F | A | 0.0000 | |
| 70 | T | A | 0.0000 | |
| 71 | K | A | -1.2773 | |
| 72 | Y | A | -1.2901 | |
| 73 | P | A | -1.7656 | |
| 74 | E | A | -2.8389 | |
| 75 | D | A | -2.7211 | |
| 76 | I | A | 0.0000 | |
| 77 | P | A | -1.6866 | |
| 78 | D | A | -1.2510 | |
| 79 | Y | A | 0.0000 | |
| 80 | F | A | 0.0000 | |
| 81 | K | A | -0.3070 | |
| 82 | Q | A | -1.3173 | |
| 83 | A | A | 0.0000 | |
| 84 | F | A | 0.0000 | |
| 85 | P | A | -0.5108 | |
| 86 | E | A | -0.9724 | |
| 87 | G | A | 0.0000 | |
| 88 | Y | A | 0.0000 | |
| 89 | S | A | -0.5654 | |
| 90 | W | A | 0.0000 | |
| 91 | E | A | 0.0000 | |
| 92 | R | A | 0.0000 | |
| 93 | S | A | 0.0000 | |
| 94 | M | A | 0.0000 | |
| 95 | T | A | -1.9059 | |
| 96 | Y | A | 0.0000 | |
| 97 | E | A | -3.2567 | |
| 98 | D | A | -2.3047 | |
| 99 | Q | A | -2.1628 | |
| 100 | G | A | 0.0000 | |
| 101 | I | A | 0.0000 | |
| 102 | C | A | 0.0000 | |
| 103 | I | A | 0.0000 | |
| 104 | A | A | 0.0000 | |
| 105 | T | A | -0.2684 | |
| 106 | S | A | 0.0000 | |
| 107 | D | A | -0.4720 | |
| 108 | I | A | 0.0000 | |
| 109 | T | A | 0.0000 | |
| 110 | M | A | 0.0000 | |
| 111 | E | A | 0.0000 | |
| 112 | G | A | -1.5352 | |
| 113 | D | A | -2.8064 | |
| 114 | C | A | 0.0000 | |
| 115 | F | A | 0.0000 | |
| 116 | F | A | 0.0000 | |
| 117 | Y | A | 0.0000 | |
| 118 | E | A | 0.0000 | |
| 119 | I | A | 0.0000 | |
| 120 | R | A | -0.5136 | |
| 121 | F | A | 0.0000 | |
| 122 | D | A | 0.0000 | |
| 123 | G | A | 0.0000 | |
| 124 | T | A | 0.0000 | |
| 125 | N | A | -0.8864 | |
| 126 | F | A | 0.0000 | |
| 127 | P | A | -1.2546 | |
| 128 | P | A | -1.3084 | |
| 129 | N | A | -2.0422 | |
| 130 | G | A | -1.3973 | |
| 131 | P | A | -1.6500 | |
| 132 | V | A | 0.0000 | |
| 133 | M | A | -1.3222 | |
| 134 | Q | A | -2.0562 | |
| 135 | K | A | -2.5531 | |
| 136 | K | A | -2.5591 | |
| 137 | T | A | -1.2430 | |
| 138 | L | A | -0.1462 | |
| 139 | K | A | -0.2876 | |
| 140 | W | A | 0.0000 | |
| 141 | E | A | -0.8678 | |
| 142 | P | A | -0.9391 | |
| 143 | S | A | -0.9863 | |
| 144 | T | A | -1.0652 | |
| 145 | E | A | 0.0000 | |
| 146 | K | A | -1.5955 | |
| 147 | M | A | 0.0000 | |
| 148 | Y | A | -0.6475 | |
| 149 | V | A | -0.8945 | |
| 150 | E | A | -2.0956 | |
| 151 | D | A | -2.7556 | |
| 152 | G | A | -1.7698 | |
| 153 | V | A | -1.1280 | |
| 154 | L | A | 0.0000 | |
| 155 | K | A | -1.1873 | |
| 156 | G | A | 0.0000 | |
| 157 | D | A | -1.7004 | |
| 158 | V | A | 0.0000 | |
| 159 | E | A | -3.0379 | |
| 160 | M | A | 0.0000 | |
| 161 | A | A | -1.9515 | |
| 162 | L | A | 0.0000 | |
| 163 | L | A | -0.8329 | |
| 164 | L | A | -1.3564 | |
| 165 | E | A | -2.4884 | |
| 166 | G | A | -1.6803 | |
| 167 | G | A | -1.2599 | |
| 168 | G | A | -1.3479 | |
| 169 | H | A | -1.3435 | |
| 170 | Y | A | 0.0000 | |
| 171 | R | A | -3.3099 | |
| 172 | C | A | 0.0000 | |
| 173 | D | A | -3.1229 | |
| 174 | F | A | 0.0000 | |
| 175 | K | A | -1.7466 | |
| 176 | T | A | 0.0000 | |
| 177 | T | A | -0.6073 | |
| 178 | Y | A | 0.0000 | |
| 179 | K | A | -1.1439 | |
| 180 | A | A | -1.4534 | |
| 181 | K | A | -1.9507 | |
| 182 | K | A | -2.3135 | |
| 183 | D | A | -2.8117 | |
| 184 | V | A | 0.0000 | |
| 185 | R | A | -2.3392 | |
| 186 | L | A | -1.1514 | |
| 187 | P | A | 0.0000 | |
| 188 | D | A | -1.5833 | |
| 189 | A | A | -0.8468 | |
| 190 | H | A | 0.0000 | |
| 191 | E | A | -0.8680 | |
| 192 | V | A | 0.0000 | |
| 193 | D | A | -1.1220 | |
| 194 | H | A | -0.6412 | |
| 195 | R | A | -0.5468 | |
| 196 | I | A | -0.1776 | |
| 197 | E | A | -0.1610 | |
| 198 | I | A | 0.0191 | |
| 199 | L | A | 0.0000 | |
| 200 | S | A | -1.0484 | |
| 201 | H | A | -2.1830 | |
| 202 | D | A | -2.7397 | |
| 203 | K | A | -3.0810 | |
| 204 | D | A | -2.8291 | |
| 205 | Y | A | -2.1522 | |
| 206 | N | A | -2.6283 | |
| 207 | K | A | -3.1362 | |
| 208 | V | A | 0.0000 | |
| 209 | R | A | -1.4489 | |
| 210 | L | A | 0.0000 | |
| 211 | Y | A | 0.0000 | |
| 212 | E | A | 0.0000 | |
| 213 | H | A | 0.0000 | |
| 214 | A | A | 0.0000 | |
| 215 | E | A | -0.9794 | |
| 216 | A | A | 0.0000 | |
| 217 | R | A | -1.0650 | |
| 218 | Y | A | -0.2149 | |
| 219 | S | A | -0.1514 | |
| 2 | A | B | 0.0118 | |
| 3 | S | B | -0.1163 | |
| 4 | V | B | -0.0006 | |
| 5 | I | B | 0.0000 | |
| 6 | K | B | -1.8046 | |
| 7 | P | B | -1.6911 | |
| 8 | E | B | -2.8537 | |
| 9 | M | B | 0.0000 | |
| 10 | K | B | -2.4707 | |
| 11 | I | B | 0.0000 | |
| 12 | K | B | -1.3913 | |
| 13 | L | B | 0.0000 | |
| 14 | R | B | -1.5280 | |
| 15 | M | B | 0.0000 | |
| 16 | E | B | -1.7330 | |
| 17 | G | B | 0.0000 | |
| 18 | A | B | -1.5183 | |
| 19 | V | B | 0.0000 | |
| 20 | N | B | -1.4557 | |
| 21 | G | B | -1.5547 | |
| 22 | H | B | -1.6418 | |
| 23 | K | B | -2.5306 | |
| 24 | F | B | 0.0000 | |
| 25 | V | B | 0.0000 | |
| 26 | I | B | 0.0000 | |
| 27 | E | B | -2.2757 | |
| 28 | G | B | 0.0000 | |
| 29 | E | B | -2.4671 | |
| 30 | G | B | -1.4813 | |
| 31 | I | B | -1.4414 | |
| 32 | G | B | 0.0000 | |
| 33 | K | B | -1.5311 | |
| 34 | P | B | 0.0000 | |
| 35 | Y | B | -0.5608 | |
| 36 | E | B | -1.1762 | |
| 37 | G | B | 0.0000 | |
| 38 | T | B | 0.0000 | |
| 39 | Q | B | 0.0000 | |
| 40 | T | B | 0.0000 | |
| 41 | L | B | 0.0000 | |
| 42 | D | B | -2.2084 | |
| 43 | L | B | 0.0000 | |
| 44 | T | B | -2.1495 | |
| 45 | V | B | 0.0000 | |
| 46 | E | B | -3.2060 | |
| 47 | E | B | -3.2326 | |
| 48 | G | B | -2.0235 | |
| 49 | A | B | -1.5724 | |
| 50 | P | B | -1.3201 | |
| 51 | L | B | -1.0019 | |
| 52 | P | B | -0.8051 | |
| 53 | F | B | 0.0000 | |
| 54 | S | B | 0.0000 | |
| 55 | Y | B | 0.0000 | |
| 56 | D | B | 0.0000 | |
| 57 | I | B | 0.0000 | |
| 58 | L | B | 0.0000 | |
| 59 | T | B | 0.0000 | |
| 60 | P | B | -0.0820 | |
| 61 | A | B | 0.0000 | |
| 62 | F | B | 0.0000 | |
| 66 | N | B | -0.1805 | |
| 67 | R | B | 0.0000 | |
| 68 | A | B | 0.0000 | |
| 69 | F | B | 0.0000 | |
| 70 | T | B | 0.0000 | |
| 71 | K | B | -1.7176 | |
| 72 | Y | B | -1.5174 | |
| 73 | P | B | -1.8185 | |
| 74 | E | B | -2.8496 | |
| 75 | D | B | -2.6924 | |
| 76 | I | B | 0.0000 | |
| 77 | P | B | -1.5468 | |
| 78 | D | B | -1.2960 | |
| 79 | Y | B | 0.0000 | |
| 80 | F | B | 0.0000 | |
| 81 | K | B | -0.3243 | |
| 82 | Q | B | -1.3684 | |
| 83 | A | B | 0.0000 | |
| 84 | F | B | 0.0000 | |
| 85 | P | B | -0.4534 | |
| 86 | E | B | -0.9178 | |
| 87 | G | B | 0.0000 | |
| 88 | Y | B | 0.0000 | |
| 89 | S | B | -1.1714 | |
| 90 | W | B | 0.0000 | |
| 91 | E | B | -2.1077 | |
| 92 | R | B | 0.0000 | |
| 93 | S | B | -0.6592 | |
| 94 | M | B | 0.0000 | |
| 95 | T | B | -1.6694 | |
| 96 | Y | B | 0.0000 | |
| 97 | E | B | -3.1810 | |
| 98 | D | B | -2.2915 | |
| 99 | Q | B | -2.1914 | |
| 100 | G | B | 0.0000 | |
| 101 | I | B | -0.4296 | |
| 102 | C | B | 0.0000 | |
| 103 | I | B | 0.9665 | |
| 104 | A | B | 0.0000 | |
| 105 | T | B | -0.8646 | |
| 106 | S | B | 0.0000 | |
| 107 | D | B | -0.9554 | |
| 108 | I | B | 0.0000 | |
| 109 | T | B | 0.0000 | |
| 110 | M | B | -0.3704 | |
| 111 | E | B | 0.0000 | |
| 112 | G | B | -1.2493 | |
| 113 | D | B | -2.6070 | |
| 114 | C | B | -1.8834 | |
| 115 | F | B | 0.0000 | |
| 116 | F | B | 0.0000 | |
| 117 | Y | B | 0.0000 | |
| 118 | E | B | -1.1111 | |
| 119 | I | B | 0.0000 | |
| 120 | R | B | -0.9900 | |
| 121 | F | B | 0.0000 | |
| 122 | D | B | -0.4515 | |
| 123 | G | B | 0.0000 | |
| 124 | T | B | -0.9065 | |
| 125 | N | B | -1.7355 | |
| 126 | F | B | 0.0000 | |
| 127 | P | B | -1.3427 | |
| 128 | P | B | -1.2717 | |
| 129 | N | B | -1.9145 | |
| 130 | G | B | 0.0000 | |
| 131 | P | B | -1.7386 | |
| 132 | V | B | 0.0000 | |
| 133 | M | B | -1.4049 | |
| 134 | Q | B | -2.3257 | |
| 135 | K | B | -2.7016 | |
| 136 | K | B | -2.5582 | |
| 137 | T | B | -1.3669 | |
| 138 | L | B | -0.4244 | |
| 139 | K | B | -0.3048 | |
| 140 | W | B | 0.0000 | |
| 141 | E | B | -0.9511 | |
| 142 | P | B | -0.9377 | |
| 143 | S | B | -1.0376 | |
| 144 | T | B | -1.3024 | |
| 145 | E | B | 0.0000 | |
| 146 | K | B | -1.7641 | |
| 147 | M | B | 0.0000 | |
| 148 | Y | B | -0.3706 | |
| 149 | V | B | 0.0000 | |
| 150 | E | B | -1.9418 | |
| 151 | D | B | -2.5765 | |
| 152 | G | B | -1.9581 | |
| 153 | V | B | -1.2130 | |
| 154 | L | B | 0.0000 | |
| 155 | K | B | -1.3824 | |
| 156 | G | B | 0.0000 | |
| 157 | D | B | -2.1138 | |
| 158 | V | B | 0.0000 | |
| 159 | E | B | -3.2191 | |
| 160 | M | B | 0.0000 | |
| 161 | A | B | -2.0134 | |
| 162 | L | B | 0.0000 | |
| 163 | L | B | -1.0178 | |
| 164 | L | B | -1.4941 | |
| 165 | E | B | -2.5613 | |
| 166 | G | B | -1.7386 | |
| 167 | G | B | -1.3953 | |
| 168 | G | B | -1.5120 | |
| 169 | H | B | -1.6463 | |
| 170 | Y | B | 0.0000 | |
| 171 | R | B | -3.4007 | |
| 172 | C | B | 0.0000 | |
| 173 | D | B | -3.3934 | |
| 174 | F | B | 0.0000 | |
| 175 | K | B | -2.7432 | |
| 176 | T | B | 0.0000 | |
| 177 | T | B | -1.4262 | |
| 178 | Y | B | 0.0000 | |
| 179 | K | B | -1.9987 | |
| 180 | A | B | -1.7329 | |
| 181 | K | B | -2.0932 | |
| 182 | K | B | -2.4690 | |
| 183 | D | B | -2.9339 | |
| 184 | V | B | 0.0000 | |
| 185 | R | B | -2.2393 | |
| 186 | L | B | -1.0255 | |
| 187 | P | B | 0.0000 | |
| 188 | D | B | -1.1622 | |
| 189 | A | B | -0.6650 | |
| 190 | H | B | 0.0000 | |
| 191 | E | B | -1.1230 | |
| 192 | V | B | 0.0000 | |
| 193 | D | B | -1.5371 | |
| 194 | H | B | -0.9305 | |
| 195 | R | B | -0.7389 | |
| 196 | I | B | -0.1682 | |
| 197 | E | B | 0.0000 | |
| 198 | I | B | 0.1239 | |
| 199 | L | B | 0.0000 | |
| 200 | S | B | -1.0337 | |
| 201 | H | B | -1.9070 | |
| 202 | D | B | -2.3869 | |
| 203 | K | B | -3.0236 | |
| 204 | D | B | -2.9774 | |
| 205 | Y | B | -1.9618 | |
| 206 | N | B | -2.4377 | |
| 207 | K | B | -3.0323 | |
| 208 | V | B | 0.0000 | |
| 209 | R | B | -1.4181 | |
| 210 | L | B | 0.0000 | |
| 211 | Y | B | 0.0000 | |
| 212 | E | B | -0.2237 | |
| 213 | H | B | -0.8288 | |
| 214 | A | B | 0.0000 | |
| 215 | E | B | -1.6745 | |
| 216 | A | B | 0.0000 | |
| 217 | R | B | -1.1181 | |
| 218 | Y | B | -0.1863 | |
| 219 | S | B | -0.1054 | |
| 2 | A | C | -0.0879 | |
| 3 | S | C | -0.2564 | |
| 4 | V | C | -0.1309 | |
| 5 | I | C | 0.0000 | |
| 6 | K | C | -2.5955 | |
| 7 | P | C | -2.2940 | |
| 8 | E | C | -2.9566 | |
| 9 | M | C | 0.0000 | |
| 10 | K | C | -1.7836 | |
| 11 | I | C | 0.0000 | |
| 12 | K | C | -1.3603 | |
| 13 | L | C | 0.0000 | |
| 14 | R | C | -1.4989 | |
| 15 | M | C | 0.0000 | |
| 16 | E | C | -1.3081 | |
| 17 | G | C | 0.0000 | |
| 18 | A | C | 0.0000 | |
| 19 | V | C | 0.0000 | |
| 20 | N | C | -0.5036 | |
| 21 | G | C | -0.6662 | |
| 22 | H | C | -0.7117 | |
| 23 | K | C | -0.7724 | |
| 24 | F | C | 0.0000 | |
| 25 | V | C | -1.2307 | |
| 26 | I | C | 0.0000 | |
| 27 | E | C | -1.7882 | |
| 28 | G | C | -2.1616 | |
| 29 | E | C | -2.4526 | |
| 30 | G | C | -1.0347 | |
| 31 | I | C | -0.4419 | |
| 32 | G | C | 0.0000 | |
| 33 | K | C | -2.0316 | |
| 34 | P | C | 0.0000 | |
| 35 | Y | C | -1.2741 | |
| 36 | E | C | -2.3343 | |
| 37 | G | C | 0.0000 | |
| 38 | T | C | -1.0951 | |
| 39 | Q | C | 0.0000 | |
| 40 | T | C | -0.4155 | |
| 41 | L | C | 0.0000 | |
| 42 | D | C | -2.0938 | |
| 43 | L | C | 0.0000 | |
| 44 | T | C | -2.0907 | |
| 45 | V | C | 0.0000 | |
| 46 | E | C | -2.6157 | |
| 47 | E | C | -1.9265 | |
| 48 | G | C | -1.0885 | |
| 49 | A | C | -1.0890 | |
| 50 | P | C | -1.0877 | |
| 51 | L | C | 0.0000 | |
| 52 | P | C | -0.8499 | |
| 53 | F | C | 0.0000 | |
| 54 | S | C | 0.0000 | |
| 55 | Y | C | 0.0000 | |
| 56 | D | C | 0.0000 | |
| 57 | I | C | 0.0000 | |
| 58 | L | C | 0.0000 | |
| 59 | T | C | 0.0000 | |
| 60 | P | C | -0.1886 | |
| 61 | A | C | 0.0000 | |
| 62 | F | C | 0.0000 | |
| 66 | N | C | -0.1714 | |
| 67 | R | C | 0.0000 | |
| 68 | A | C | 0.0000 | |
| 69 | F | C | 0.0000 | |
| 70 | T | C | 0.0000 | |
| 71 | K | C | -1.8888 | |
| 72 | Y | C | -1.5867 | |
| 73 | P | C | -1.7783 | |
| 74 | E | C | -2.8309 | |
| 75 | D | C | -2.8857 | |
| 76 | I | C | 0.0000 | |
| 77 | P | C | -1.7465 | |
| 78 | D | C | -1.2544 | |
| 79 | Y | C | 0.0000 | |
| 80 | F | C | 0.0000 | |
| 81 | K | C | -0.2937 | |
| 82 | Q | C | -1.1911 | |
| 83 | A | C | 0.0000 | |
| 84 | F | C | 0.0000 | |
| 85 | P | C | -0.5669 | |
| 86 | E | C | -1.0099 | |
| 87 | G | C | 0.0000 | |
| 88 | Y | C | 0.0000 | |
| 89 | S | C | -0.8933 | |
| 90 | W | C | 0.0000 | |
| 91 | E | C | -0.7767 | |
| 92 | R | C | 0.0000 | |
| 93 | S | C | 0.0000 | |
| 94 | M | C | 0.0000 | |
| 95 | T | C | -1.8070 | |
| 96 | Y | C | 0.0000 | |
| 97 | E | C | -3.1080 | |
| 98 | D | C | -2.1021 | |
| 99 | Q | C | -1.7679 | |
| 100 | G | C | 0.0000 | |
| 101 | I | C | 0.0000 | |
| 102 | C | C | 0.0000 | |
| 103 | I | C | 0.0000 | |
| 104 | A | C | 0.0000 | |
| 105 | T | C | -0.3903 | |
| 106 | S | C | 0.0000 | |
| 107 | D | C | -0.6482 | |
| 108 | I | C | 0.0000 | |
| 109 | T | C | 0.0000 | |
| 110 | M | C | -0.3676 | |
| 111 | E | C | 0.0000 | |
| 112 | G | C | -1.2900 | |
| 113 | D | C | -2.5608 | |
| 114 | C | C | 0.0000 | |
| 115 | F | C | 0.0000 | |
| 116 | F | C | 0.0000 | |
| 117 | Y | C | 0.0000 | |
| 118 | E | C | -0.9988 | |
| 119 | I | C | 0.0000 | |
| 120 | R | C | -0.5994 | |
| 121 | F | C | 0.0000 | |
| 122 | D | C | 0.0000 | |
| 123 | G | C | 0.0000 | |
| 124 | T | C | 0.0000 | |
| 125 | N | C | -0.6478 | |
| 126 | F | C | 0.0000 | |
| 127 | P | C | -1.3419 | |
| 128 | P | C | -1.3704 | |
| 129 | N | C | -2.1509 | |
| 130 | G | C | -1.4434 | |
| 131 | P | C | -1.6067 | |
| 132 | V | C | 0.0000 | |
| 133 | M | C | -1.3693 | |
| 134 | Q | C | -2.3208 | |
| 135 | K | C | -2.7100 | |
| 136 | K | C | -2.5321 | |
| 137 | T | C | -1.3599 | |
| 138 | L | C | -0.4843 | |
| 139 | K | C | -1.6406 | |
| 140 | W | C | 0.0000 | |
| 141 | E | C | -1.8632 | |
| 142 | P | C | -1.6732 | |
| 143 | S | C | -1.3387 | |
| 144 | T | C | -1.5166 | |
| 145 | E | C | 0.0000 | |
| 146 | K | C | -1.6929 | |
| 147 | M | C | 0.0000 | |
| 148 | Y | C | -0.6838 | |
| 149 | V | C | -0.9689 | |
| 150 | E | C | -2.4096 | |
| 151 | D | C | -2.8925 | |
| 152 | G | C | -1.9654 | |
| 153 | V | C | -1.4581 | |
| 154 | L | C | 0.0000 | |
| 155 | K | C | -1.2980 | |
| 156 | G | C | 0.0000 | |
| 157 | D | C | -1.8544 | |
| 158 | V | C | 0.0000 | |
| 159 | E | C | -3.1607 | |
| 160 | M | C | 0.0000 | |
| 161 | A | C | 0.0000 | |
| 162 | L | C | 0.0000 | |
| 163 | L | C | -1.0414 | |
| 164 | L | C | -1.4727 | |
| 165 | E | C | -2.5454 | |
| 166 | G | C | -1.7105 | |
| 167 | G | C | -1.3398 | |
| 168 | G | C | -1.4264 | |
| 169 | H | C | -1.4448 | |
| 170 | Y | C | 0.0000 | |
| 171 | R | C | -3.3596 | |
| 172 | C | C | 0.0000 | |
| 173 | D | C | -3.2097 | |
| 174 | F | C | 0.0000 | |
| 175 | K | C | -1.9323 | |
| 176 | T | C | 0.0000 | |
| 177 | T | C | 0.0000 | |
| 178 | Y | C | 0.0000 | |
| 179 | K | C | -1.8797 | |
| 180 | A | C | -1.8588 | |
| 181 | K | C | -2.1809 | |
| 182 | K | C | -2.4111 | |
| 183 | D | C | -2.8784 | |
| 184 | V | C | 0.0000 | |
| 185 | R | C | -2.3416 | |
| 186 | L | C | -1.1628 | |
| 187 | P | C | 0.0000 | |
| 188 | D | C | -1.7515 | |
| 189 | A | C | -0.8195 | |
| 190 | H | C | 0.0000 | |
| 191 | E | C | -1.1651 | |
| 192 | V | C | 0.0000 | |
| 193 | D | C | -1.6171 | |
| 194 | H | C | -1.7603 | |
| 195 | R | C | -2.7162 | |
| 196 | I | C | -1.5939 | |
| 197 | E | C | -1.8112 | |
| 198 | I | C | -0.3403 | |
| 199 | L | C | 0.4006 | |
| 200 | S | C | -0.9844 | |
| 201 | H | C | -2.3701 | |
| 202 | D | C | -2.9775 | |
| 203 | K | C | -3.3015 | |
| 204 | D | C | -3.2007 | |
| 205 | Y | C | -2.3768 | |
| 206 | N | C | -2.5696 | |
| 207 | K | C | -3.3102 | |
| 208 | V | C | 0.0000 | |
| 209 | R | C | -1.8836 | |
| 210 | L | C | 0.0000 | |
| 211 | Y | C | -0.4678 | |
| 212 | E | C | 0.0000 | |
| 213 | H | C | -1.6860 | |
| 214 | A | C | 0.0000 | |
| 215 | E | C | -1.7933 | |
| 216 | A | C | 0.0000 | |
| 217 | R | C | -1.3160 | |
| 218 | Y | C | -0.3155 | |
| 219 | S | C | -0.1523 | |
| 3 | S | D | -0.2982 | |
| 4 | V | D | -0.2093 | |
| 5 | I | D | 0.0000 | |
| 6 | K | D | -2.0629 | |
| 7 | P | D | -1.9891 | |
| 8 | E | D | -2.7695 | |
| 9 | M | D | 0.0000 | |
| 10 | K | D | -2.1582 | |
| 11 | I | D | 0.0000 | |
| 12 | K | D | -1.3743 | |
| 13 | L | D | 0.0000 | |
| 14 | R | D | -1.6335 | |
| 15 | M | D | 0.0000 | |
| 16 | E | D | -2.7548 | |
| 17 | G | D | 0.0000 | |
| 18 | A | D | -1.7585 | |
| 19 | V | D | 0.0000 | |
| 20 | N | D | -1.5236 | |
| 21 | G | D | -1.5665 | |
| 22 | H | D | -1.6284 | |
| 23 | K | D | -2.6788 | |
| 24 | F | D | 0.0000 | |
| 25 | V | D | 0.0000 | |
| 26 | I | D | 0.0000 | |
| 27 | E | D | -2.3258 | |
| 28 | G | D | -2.1732 | |
| 29 | E | D | -2.7563 | |
| 30 | G | D | -1.4079 | |
| 31 | I | D | -0.6378 | |
| 32 | G | D | 0.0000 | |
| 33 | K | D | -2.0398 | |
| 34 | P | D | 0.0000 | |
| 35 | Y | D | -1.2147 | |
| 36 | E | D | -2.3457 | |
| 37 | G | D | 0.0000 | |
| 38 | T | D | -1.1785 | |
| 39 | Q | D | 0.0000 | |
| 40 | T | D | -0.7535 | |
| 41 | L | D | 0.0000 | |
| 42 | D | D | -2.8109 | |
| 43 | L | D | 0.0000 | |
| 44 | T | D | -2.2963 | |
| 45 | V | D | 0.0000 | |
| 46 | E | D | -3.0692 | |
| 47 | E | D | -2.9759 | |
| 48 | G | D | -1.8162 | |
| 49 | A | D | -1.4643 | |
| 50 | P | D | -1.3592 | |
| 51 | L | D | 0.0000 | |
| 52 | P | D | -0.8934 | |
| 53 | F | D | 0.0000 | |
| 54 | S | D | 0.0000 | |
| 55 | Y | D | 0.0000 | |
| 56 | D | D | 0.0000 | |
| 57 | I | D | 0.0000 | |
| 58 | L | D | 0.0000 | |
| 59 | T | D | 0.0000 | |
| 60 | P | D | -0.0337 | |
| 61 | A | D | 0.0000 | |
| 62 | F | D | 0.0000 | |
| 66 | N | D | -0.1964 | |
| 67 | R | D | 0.0000 | |
| 68 | A | D | 0.0000 | |
| 69 | F | D | 0.0000 | |
| 70 | T | D | 0.0000 | |
| 71 | K | D | -1.9904 | |
| 72 | Y | D | -1.5700 | |
| 73 | P | D | -1.7799 | |
| 74 | E | D | -2.8467 | |
| 75 | D | D | -2.7025 | |
| 76 | I | D | 0.0000 | |
| 77 | P | D | -1.6583 | |
| 78 | D | D | -1.2404 | |
| 79 | Y | D | 0.0000 | |
| 80 | F | D | 0.0000 | |
| 81 | K | D | -0.2881 | |
| 82 | Q | D | -1.1575 | |
| 83 | A | D | 0.0000 | |
| 84 | F | D | 0.0000 | |
| 85 | P | D | -0.6349 | |
| 86 | E | D | -0.8828 | |
| 87 | G | D | 0.0000 | |
| 88 | Y | D | 0.0000 | |
| 89 | S | D | -0.9533 | |
| 90 | W | D | 0.0000 | |
| 91 | E | D | -1.6234 | |
| 92 | R | D | 0.0000 | |
| 93 | S | D | -0.1590 | |
| 94 | M | D | 0.0000 | |
| 95 | T | D | -0.4382 | |
| 96 | Y | D | 0.0000 | |
| 97 | E | D | -1.4249 | |
| 98 | D | D | -1.6050 | |
| 99 | Q | D | -1.7045 | |
| 100 | G | D | 0.0000 | |
| 101 | I | D | -0.0327 | |
| 102 | C | D | 0.0000 | |
| 103 | I | D | 1.3931 | |
| 104 | A | D | 0.0000 | |
| 105 | T | D | -0.5663 | |
| 106 | S | D | 0.0000 | |
| 107 | D | D | -0.6757 | |
| 108 | I | D | 0.0000 | |
| 109 | T | D | 0.0000 | |
| 110 | M | D | 0.0000 | |
| 111 | E | D | 0.0000 | |
| 112 | G | D | -1.1607 | |
| 113 | D | D | -2.1957 | |
| 114 | C | D | -1.4636 | |
| 115 | F | D | 0.0000 | |
| 116 | F | D | 0.0000 | |
| 117 | Y | D | 0.0000 | |
| 118 | E | D | 0.0000 | |
| 119 | I | D | 0.0000 | |
| 120 | R | D | -1.0339 | |
| 121 | F | D | 0.0000 | |
| 122 | D | D | -0.6005 | |
| 123 | G | D | 0.0000 | |
| 124 | T | D | -0.9022 | |
| 125 | N | D | -1.7352 | |
| 126 | F | D | 0.0000 | |
| 127 | P | D | -1.3085 | |
| 128 | P | D | -1.2374 | |
| 129 | N | D | -1.7632 | |
| 130 | G | D | 0.0000 | |
| 131 | P | D | -1.7521 | |
| 132 | V | D | 0.0000 | |
| 133 | M | D | -1.3947 | |
| 134 | Q | D | -2.2122 | |
| 135 | K | D | -2.7977 | |
| 136 | K | D | -2.6425 | |
| 137 | T | D | -1.5743 | |
| 138 | L | D | -1.0671 | |
| 139 | K | D | -1.7315 | |
| 140 | W | D | 0.0000 | |
| 141 | E | D | -1.9358 | |
| 142 | P | D | -1.9250 | |
| 143 | S | D | -1.3996 | |
| 144 | T | D | -1.4620 | |
| 145 | E | D | 0.0000 | |
| 146 | K | D | -1.7123 | |
| 147 | M | D | 0.0000 | |
| 148 | Y | D | -0.6950 | |
| 149 | V | D | -0.9802 | |
| 150 | E | D | -2.3708 | |
| 151 | D | D | -2.6680 | |
| 152 | G | D | -1.9103 | |
| 153 | V | D | -1.2622 | |
| 154 | L | D | 0.0000 | |
| 155 | K | D | -1.4212 | |
| 156 | G | D | 0.0000 | |
| 157 | D | D | -1.7295 | |
| 158 | V | D | 0.0000 | |
| 159 | E | D | -2.4628 | |
| 160 | M | D | 0.0000 | |
| 161 | A | D | -1.1617 | |
| 162 | L | D | 0.0000 | |
| 163 | L | D | -1.0167 | |
| 164 | L | D | -1.5775 | |
| 165 | E | D | -2.6235 | |
| 166 | G | D | -1.6651 | |
| 167 | G | D | -1.2514 | |
| 168 | G | D | -1.5642 | |
| 169 | H | D | -1.5629 | |
| 170 | Y | D | 0.0000 | |
| 171 | R | D | -1.5180 | |
| 172 | C | D | 0.0000 | |
| 173 | D | D | -1.7587 | |
| 174 | F | D | 0.0000 | |
| 175 | K | D | -1.7533 | |
| 176 | T | D | 0.0000 | |
| 177 | T | D | -1.2048 | |
| 178 | Y | D | 0.0000 | |
| 179 | K | D | -1.5931 | |
| 180 | A | D | -1.5057 | |
| 181 | K | D | -1.8959 | |
| 182 | K | D | -2.2248 | |
| 183 | D | D | -2.7272 | |
| 184 | V | D | -1.9348 | |
| 185 | R | D | -2.2700 | |
| 186 | L | D | -1.1195 | |
| 187 | P | D | 0.0000 | |
| 188 | D | D | -1.6066 | |
| 189 | A | D | -0.8501 | |
| 190 | H | D | 0.0000 | |
| 191 | E | D | -1.1078 | |
| 192 | V | D | 0.0000 | |
| 193 | D | D | -1.7660 | |
| 194 | H | D | -1.6872 | |
| 195 | R | D | -2.7786 | |
| 196 | I | D | -1.6765 | |
| 197 | E | D | -1.9558 | |
| 198 | I | D | -0.5542 | |
| 199 | L | D | 0.0185 | |
| 200 | S | D | -1.2409 | |
| 201 | H | D | -2.3901 | |
| 202 | D | D | -2.6523 | |
| 203 | K | D | -3.1322 | |
| 204 | D | D | -3.1164 | |
| 205 | Y | D | -2.2884 | |
| 206 | N | D | -2.4525 | |
| 207 | K | D | -3.2356 | |
| 208 | V | D | 0.0000 | |
| 209 | R | D | -2.2744 | |
| 210 | L | D | 0.0000 | |
| 211 | Y | D | -0.7149 | |
| 212 | E | D | -0.9793 | |
| 213 | H | D | -1.7739 | |
| 214 | A | D | 0.0000 | |
| 215 | E | D | -1.8518 | |
| 216 | A | D | 0.0000 | |
| 217 | R | D | -1.2020 | |
| 218 | Y | D | -0.2799 | |
| 219 | S | D | -0.2402 | |
| -2 | S | E | -1.0409 | |
| -1 | S | E | -1.0090 | |
| 0 | S | E | -1.1725 | |
| 1 | Q | E | -1.7919 | |
| 2 | V | E | 0.0000 | |
| 3 | Q | E | -1.2936 | |
| 4 | L | E | 0.0000 | |
| 5 | V | E | -0.0038 | |
| 6 | E | E | 0.0000 | |
| 7 | S | E | -0.8614 | |
| 8 | G | E | -1.3093 | |
| 9 | G | E | -0.8833 | |
| 10 | G | E | 0.0792 | |
| 11 | L | E | 1.0248 | |
| 12 | V | E | 0.0356 | |
| 13 | Q | E | -1.2956 | |
| 14 | A | E | -1.5489 | |
| 15 | G | E | -1.4419 | |
| 16 | G | E | -0.9520 | |
| 17 | S | E | -1.2294 | |
| 18 | L | E | -1.0589 | |
| 19 | R | E | -2.2234 | |
| 20 | L | E | 0.0000 | |
| 21 | S | E | -0.5789 | |
| 22 | C | E | 0.0000 | |
| 23 | A | E | -0.2465 | |
| 24 | A | E | 0.0000 | |
| 25 | S | E | -0.8040 | |
| 26 | G | E | -1.1473 | |
| 27 | F | E | 0.0000 | |
| 28 | P | E | -0.9901 | |
| 29 | V | E | 0.0000 | |
| 30 | D | E | -1.5730 | |
| 31 | T | E | -0.7773 | |
| 32 | Q | E | -0.5067 | |
| 33 | W | E | 0.0000 | |
| 34 | M | E | 0.0000 | |
| 35 | H | E | 0.0000 | |
| 36 | W | E | 0.0000 | |
| 37 | Y | E | 0.0000 | |
| 38 | R | E | 0.0000 | |
| 39 | Q | E | -1.8090 | |
| 40 | A | E | -1.8128 | |
| 41 | P | E | -1.4192 | |
| 42 | G | E | -1.9771 | |
| 43 | K | E | -3.2712 | |
| 44 | E | E | -3.5140 | |
| 45 | R | E | -2.7302 | |
| 46 | E | E | -1.8648 | |
| 47 | W | E | -0.6690 | |
| 48 | V | E | 0.0000 | |
| 49 | A | E | 0.0000 | |
| 50 | A | E | 0.0000 | |
| 51 | I | E | 0.0000 | |
| 52 | S | E | 0.0000 | |
| 53 | S | E | -0.6672 | |
| 54 | T | E | -0.7216 | |
| 55 | G | E | -0.8878 | |
| 56 | R | E | -0.6841 | |
| 57 | S | E | 0.0000 | |
| 58 | T | E | -0.1773 | |
| 59 | F | E | 0.0000 | |
| 60 | Y | E | -0.8253 | |
| 61 | A | E | -1.2968 | |
| 62 | D | E | -2.3971 | |
| 63 | S | E | -1.5729 | |
| 64 | V | E | 0.0000 | |
| 65 | K | E | -2.5841 | |
| 66 | G | E | -1.8144 | |
| 67 | R | E | -1.5064 | |
| 68 | F | E | 0.0000 | |
| 69 | T | E | -0.9115 | |
| 70 | I | E | 0.0000 | |
| 71 | S | E | -0.4786 | |
| 72 | R | E | -1.2906 | |
| 73 | D | E | -1.8590 | |
| 74 | N | E | -2.3642 | |
| 75 | A | E | -1.7075 | |
| 76 | K | E | -2.3212 | |
| 77 | N | E | -1.9593 | |
| 78 | T | E | 0.0000 | |
| 79 | V | E | 0.0000 | |
| 80 | Y | E | -0.6214 | |
| 81 | L | E | 0.0000 | |
| 82 | Q | E | -1.3399 | |
| 83 | M | E | 0.0000 | |
| 84 | N | E | -1.7002 | |
| 85 | S | E | -1.3737 | |
| 86 | L | E | 0.0000 | |
| 87 | K | E | -2.3242 | |
| 88 | P | E | -1.8681 | |
| 89 | E | E | -2.2668 | |
| 90 | D | E | 0.0000 | |
| 91 | T | E | -0.8647 | |
| 92 | A | E | 0.0000 | |
| 93 | V | E | -0.5090 | |
| 94 | Y | E | 0.0000 | |
| 95 | Y | E | 0.0000 | |
| 96 | C | E | 0.0000 | |
| 97 | T | E | 0.0000 | |
| 98 | V | E | 0.0000 | |
| 99 | Y | E | -0.7943 | |
| 100 | V | E | -0.6045 | |
| 101 | G | E | -1.1538 | |
| 102 | N | E | -1.9488 | |
| 103 | R | E | -1.9318 | |
| 104 | Y | E | -1.7998 | |
| 105 | R | E | -2.2471 | |
| 106 | G | E | 0.0000 | |
| 107 | Q | E | -1.6158 | |
| 108 | G | E | -1.0414 | |
| 109 | T | E | -0.8860 | |
| 110 | Q | E | -1.1283 | |
| 111 | V | E | 0.0000 | |
| 112 | T | E | -0.2632 | |
| 113 | V | E | 0.0000 | |
| 114 | S | E | -0.8100 | |
| 115 | A | E | -1.0089 | |
| 116 | G | E | -0.9828 | |
| -2 | S | F | -1.0629 | |
| -1 | S | F | -1.0732 | |
| 0 | S | F | -1.2048 | |
| 1 | Q | F | -1.8343 | |
| 2 | V | F | 0.0000 | |
| 3 | Q | F | -1.5307 | |
| 4 | L | F | 0.0000 | |
| 5 | V | F | -0.1035 | |
| 6 | E | F | 0.0000 | |
| 7 | S | F | -0.8229 | |
| 8 | G | F | -1.2476 | |
| 9 | G | F | -0.8564 | |
| 10 | G | F | 0.1160 | |
| 11 | L | F | 1.0337 | |
| 12 | V | F | -0.0266 | |
| 13 | Q | F | -1.3753 | |
| 14 | A | F | -1.6713 | |
| 15 | G | F | -1.4684 | |
| 16 | G | F | -0.9286 | |
| 17 | S | F | -1.3098 | |
| 18 | L | F | -1.0525 | |
| 19 | R | F | -2.3227 | |
| 20 | L | F | 0.0000 | |
| 21 | S | F | -0.6531 | |
| 22 | C | F | 0.0000 | |
| 23 | A | F | -0.3472 | |
| 24 | A | F | -0.7015 | |
| 25 | S | F | -0.8066 | |
| 26 | G | F | -1.1593 | |
| 27 | F | F | 0.0000 | |
| 28 | P | F | -1.1734 | |
| 29 | V | F | 0.0000 | |
| 30 | D | F | -1.7060 | |
| 31 | T | F | -0.7298 | |
| 32 | Q | F | -0.5644 | |
| 33 | W | F | 0.0000 | |
| 34 | M | F | 0.0000 | |
| 35 | H | F | 0.0000 | |
| 36 | W | F | 0.0000 | |
| 37 | Y | F | 0.0000 | |
| 38 | R | F | 0.0000 | |
| 39 | Q | F | -2.2221 | |
| 40 | A | F | -2.0037 | |
| 41 | P | F | -1.5647 | |
| 42 | G | F | -2.0673 | |
| 43 | K | F | -3.4431 | |
| 44 | E | F | -3.7881 | |
| 45 | R | F | -3.2805 | |
| 46 | E | F | -2.0799 | |
| 47 | W | F | -0.7483 | |
| 48 | V | F | 0.0000 | |
| 49 | A | F | 0.0000 | |
| 50 | A | F | 0.0000 | |
| 51 | I | F | 0.0000 | |
| 52 | S | F | 0.0000 | |
| 53 | S | F | -1.0371 | |
| 54 | T | F | -1.2200 | |
| 55 | G | F | -1.6540 | |
| 56 | R | F | -2.0765 | |
| 57 | S | F | 0.0000 | |
| 58 | T | F | -0.5206 | |
| 59 | F | F | 0.0000 | |
| 60 | Y | F | -0.8472 | |
| 61 | A | F | -1.2933 | |
| 62 | D | F | -2.3883 | |
| 63 | S | F | -1.7448 | |
| 64 | V | F | 0.0000 | |
| 65 | K | F | -2.5561 | |
| 66 | G | F | -1.7550 | |
| 67 | R | F | -1.4404 | |
| 68 | F | F | 0.0000 | |
| 69 | T | F | -1.0156 | |
| 70 | I | F | 0.0000 | |
| 71 | S | F | -0.7080 | |
| 72 | R | F | -1.3343 | |
| 73 | D | F | -1.9068 | |
| 74 | N | F | -2.4664 | |
| 75 | A | F | -1.7520 | |
| 76 | K | F | -2.3661 | |
| 77 | N | F | -1.9787 | |
| 78 | T | F | 0.0000 | |
| 79 | V | F | 0.0000 | |
| 80 | Y | F | -0.7692 | |
| 81 | L | F | 0.0000 | |
| 82 | Q | F | -1.7049 | |
| 83 | M | F | 0.0000 | |
| 84 | N | F | -1.5190 | |
| 85 | S | F | -1.2825 | |
| 86 | L | F | 0.0000 | |
| 87 | K | F | -2.5659 | |
| 88 | P | F | -1.9909 | |
| 89 | E | F | -2.3593 | |
| 90 | D | F | 0.0000 | |
| 91 | T | F | -0.9666 | |
| 92 | A | F | -1.0841 | |
| 93 | V | F | -0.6494 | |
| 94 | Y | F | 0.0000 | |
| 95 | Y | F | 0.0000 | |
| 96 | C | F | 0.0000 | |
| 97 | T | F | 0.0000 | |
| 98 | V | F | 0.0000 | |
| 99 | Y | F | -0.7462 | |
| 100 | V | F | -0.6626 | |
| 101 | G | F | -1.1740 | |
| 102 | N | F | -1.9405 | |
| 103 | R | F | -1.8411 | |
| 104 | Y | F | -1.7176 | |
| 105 | R | F | -2.0300 | |
| 106 | G | F | 0.0000 | |
| 107 | Q | F | -1.5782 | |
| 108 | G | F | -0.9952 | |
| 109 | T | F | -0.8702 | |
| 110 | Q | F | -1.1600 | |
| 111 | V | F | 0.0000 | |
| 112 | T | F | -0.3518 | |
| 113 | V | F | 0.0000 | |
| 114 | S | F | -0.9672 | |
| 115 | A | F | -1.1387 | |
| 116 | G | F | -1.0296 | |
| 1 | Q | G | -1.4488 | |
| 2 | V | G | 0.0000 | |
| 3 | Q | G | -0.9216 | |
| 4 | L | G | 0.0000 | |
| 5 | V | G | 1.1536 | |
| 6 | E | G | 0.0000 | |
| 7 | S | G | -0.4291 | |
| 8 | G | G | -1.2922 | |
| 9 | G | G | -0.7654 | |
| 10 | G | G | 0.0230 | |
| 11 | L | G | 1.1629 | |
| 12 | V | G | 0.2899 | |
| 13 | Q | G | -1.0984 | |
| 14 | A | G | -1.0972 | |
| 15 | G | G | -1.1936 | |
| 16 | G | G | -0.9206 | |
| 17 | S | G | -1.1471 | |
| 18 | L | G | -0.8530 | |
| 19 | R | G | -2.0942 | |
| 20 | L | G | 0.0000 | |
| 21 | S | G | -0.4239 | |
| 22 | C | G | 0.0000 | |
| 23 | A | G | 0.0188 | |
| 24 | A | G | -0.2511 | |
| 25 | S | G | -0.7242 | |
| 26 | G | G | -0.8271 | |
| 27 | F | G | -0.5526 | |
| 28 | P | G | -1.1168 | |
| 29 | V | G | 0.0000 | |
| 30 | D | G | -1.9416 | |
| 31 | T | G | -0.9531 | |
| 32 | Q | G | -0.6154 | |
| 33 | W | G | 0.0000 | |
| 34 | M | G | 0.0000 | |
| 35 | H | G | 0.0000 | |
| 36 | W | G | 0.0000 | |
| 37 | Y | G | 0.0000 | |
| 38 | R | G | 0.0000 | |
| 39 | Q | G | -1.9585 | |
| 40 | A | G | -1.8375 | |
| 41 | P | G | -1.5122 | |
| 42 | G | G | -2.0125 | |
| 43 | K | G | -3.3703 | |
| 44 | E | G | -3.6297 | |
| 45 | R | G | -2.9852 | |
| 46 | E | G | -1.9843 | |
| 47 | W | G | -0.5240 | |
| 48 | V | G | 0.0000 | |
| 49 | A | G | 0.0000 | |
| 50 | A | G | 0.0000 | |
| 51 | I | G | 0.0000 | |
| 52 | S | G | 0.0000 | |
| 53 | S | G | -1.0463 | |
| 54 | T | G | -1.3878 | |
| 55 | G | G | -1.5797 | |
| 56 | R | G | -2.0683 | |
| 57 | S | G | 0.0000 | |
| 58 | T | G | -0.5036 | |
| 59 | F | G | 0.0000 | |
| 60 | Y | G | -0.8858 | |
| 61 | A | G | -1.3788 | |
| 62 | D | G | -2.4496 | |
| 63 | S | G | -1.7893 | |
| 64 | V | G | 0.0000 | |
| 65 | K | G | -2.6001 | |
| 66 | G | G | -1.7451 | |
| 67 | R | G | -1.3292 | |
| 68 | F | G | 0.0000 | |
| 69 | T | G | -0.9240 | |
| 70 | I | G | 0.0000 | |
| 71 | S | G | -0.6776 | |
| 72 | R | G | -1.3466 | |
| 73 | D | G | -2.0159 | |
| 74 | N | G | -2.5811 | |
| 75 | A | G | -1.8168 | |
| 76 | K | G | -2.4262 | |
| 77 | N | G | -2.0008 | |
| 78 | T | G | 0.0000 | |
| 79 | V | G | 0.0000 | |
| 80 | Y | G | 0.0000 | |
| 81 | L | G | 0.0000 | |
| 82 | Q | G | -1.5881 | |
| 83 | M | G | 0.0000 | |
| 84 | N | G | -1.2578 | |
| 85 | S | G | -1.0598 | |
| 86 | L | G | 0.0000 | |
| 87 | K | G | -2.0402 | |
| 88 | P | G | -1.8187 | |
| 89 | E | G | -2.2642 | |
| 90 | D | G | 0.0000 | |
| 91 | T | G | -0.8444 | |
| 92 | A | G | 0.0000 | |
| 93 | V | G | -0.5210 | |
| 94 | Y | G | 0.0000 | |
| 95 | Y | G | 0.0000 | |
| 96 | C | G | 0.0000 | |
| 97 | T | G | 0.0000 | |
| 98 | V | G | 0.0000 | |
| 99 | Y | G | -0.6172 | |
| 100 | V | G | -0.4987 | |
| 101 | G | G | -1.1476 | |
| 102 | N | G | -1.6840 | |
| 103 | R | G | -1.4253 | |
| 104 | Y | G | -0.9584 | |
| 105 | R | G | -1.0617 | |
| 106 | G | G | 0.0000 | |
| 107 | Q | G | -1.1221 | |
| 108 | G | G | 0.0000 | |
| 109 | T | G | -0.6677 | |
| 110 | Q | G | -1.1344 | |
| 111 | V | G | 0.0000 | |
| 112 | T | G | -0.1939 | |
| 113 | V | G | 0.0000 | |
| 114 | S | G | -0.8074 | |
| 115 | A | G | -0.6012 | |
| 1 | Q | H | -1.4901 | |
| 2 | V | H | -1.0452 | |
| 3 | Q | H | -1.3249 | |
| 4 | L | H | 0.0000 | |
| 5 | V | H | 0.6480 | |
| 6 | E | H | 0.0000 | |
| 7 | S | H | -0.6686 | |
| 8 | G | H | -1.3723 | |
| 9 | G | H | -0.8742 | |
| 10 | G | H | 0.0889 | |
| 11 | L | H | 1.0169 | |
| 12 | V | H | 0.0891 | |
| 13 | Q | H | -1.1678 | |
| 14 | A | H | -1.0681 | |
| 15 | G | H | -1.4137 | |
| 16 | G | H | -1.1811 | |
| 17 | S | H | -1.5258 | |
| 18 | L | H | 0.0000 | |
| 19 | R | H | -2.4329 | |
| 20 | L | H | 0.0000 | |
| 21 | S | H | -0.5309 | |
| 22 | C | H | 0.0000 | |
| 23 | A | H | -0.0345 | |
| 24 | A | H | 0.0000 | |
| 25 | S | H | -0.9535 | |
| 26 | G | H | -0.9996 | |
| 27 | F | H | -0.5455 | |
| 28 | P | H | -1.0235 | |
| 29 | V | H | 0.0000 | |
| 30 | D | H | -1.4828 | |
| 31 | T | H | -0.6770 | |
| 32 | Q | H | -0.4356 | |
| 33 | W | H | 0.0000 | |
| 34 | M | H | 0.0000 | |
| 35 | H | H | 0.0000 | |
| 36 | W | H | 0.0000 | |
| 37 | Y | H | -0.9237 | |
| 38 | R | H | 0.0000 | |
| 39 | Q | H | -2.1069 | |
| 45 | R | H | -2.6194 | |
| 46 | E | H | -1.9225 | |
| 47 | W | H | -0.7847 | |
| 48 | V | H | 0.0000 | |
| 49 | A | H | 0.0000 | |
| 50 | A | H | 0.0000 | |
| 51 | I | H | 0.0000 | |
| 52 | S | H | 0.0000 | |
| 53 | S | H | -0.8868 | |
| 54 | T | H | -1.0354 | |
| 55 | G | H | -1.5670 | |
| 56 | R | H | -2.1604 | |
| 57 | S | H | 0.0000 | |
| 58 | T | H | -0.4676 | |
| 59 | F | H | 0.0000 | |
| 60 | Y | H | -0.8196 | |
| 61 | A | H | -1.3538 | |
| 62 | D | H | -2.4497 | |
| 63 | S | H | -1.7648 | |
| 64 | V | H | 0.0000 | |
| 65 | K | H | -2.6183 | |
| 66 | G | H | -1.8253 | |
| 67 | R | H | -1.5787 | |
| 68 | F | H | 0.0000 | |
| 69 | T | H | -0.9256 | |
| 70 | I | H | 0.0000 | |
| 71 | S | H | -0.7467 | |
| 72 | R | H | -1.4577 | |
| 73 | D | H | -2.3907 | |
| 74 | N | H | -2.4103 | |
| 75 | A | H | -1.7934 | |
| 76 | K | H | -2.4702 | |
| 77 | N | H | -2.0428 | |
| 78 | T | H | 0.0000 | |
| 79 | V | H | 0.0000 | |
| 80 | Y | H | 0.0000 | |
| 81 | L | H | 0.0000 | |
| 82 | Q | H | -1.6844 | |
| 83 | M | H | 0.0000 | |
| 84 | N | H | -1.7763 | |
| 85 | S | H | -1.4066 | |
| 86 | L | H | 0.0000 | |
| 87 | K | H | -2.3171 | |
| 88 | P | H | -1.9199 | |
| 89 | E | H | -2.3137 | |
| 90 | D | H | 0.0000 | |
| 91 | T | H | -1.0464 | |
| 92 | A | H | -0.9694 | |
| 93 | V | H | -1.0313 | |
| 94 | Y | H | 0.0000 | |
| 95 | Y | H | 0.0000 | |
| 96 | C | H | 0.0000 | |
| 97 | T | H | 0.0000 | |
| 98 | V | H | 0.0000 | |
| 99 | Y | H | -0.6524 | |
| 100 | V | H | -0.2996 | |
| 101 | G | H | -1.0694 | |
| 102 | N | H | -1.6877 | |
| 103 | R | H | -1.5501 | |
| 104 | Y | H | -1.0230 | |
| 105 | R | H | -1.3578 | |
| 106 | G | H | -0.9152 | |
| 107 | Q | H | -1.2790 | |
| 108 | G | H | -0.8143 | |
| 109 | T | H | -0.6762 | |
| 110 | Q | H | -1.1909 | |
| 111 | V | H | 0.0000 | |
| 112 | T | H | -0.2817 | |
| 113 | V | H | 0.0000 | |
| 114 | S | H | -0.5990 |