| Chain sequence(s) |
A: IRLYMFQSGTLKCKTNNIKMNADPAPYEIPVPWYLITHPKGNVVIDGGNAVECATDPEGHWGGITTVYWPDMTPEQGVEAQLQKLGIAKDSVRYVLQSHLHLDHTGAIGRFPKATHIVQRNEYEYAFTPDWFAAGGYIRKDFDKPGLKWQFLNADLHETVEVLDGGEGTIRMFYTPGHAPGHQSFLVSLPSAEKYLLAVDAAYTVDHWEEKALPGFLASTVDTVRSVQKLRALAEHEEAHVVTGHDPDAWPSFKQAPAYYD
C: IRLYMFQSGTLKCKTNNIKMNADPAPYEIPVPWYLITHPKGNVVIDGGNAVECATDPEGHWGGITTVYWPDMTPEQGVEAQLQKLGIAKDSVRYVLQSHLHLDHTGAIGRFPKATHIVQRNEYEYAFTPDWFAAGGYIRKDFDKPGLKWQFLNADLHETVEVLDGGEGTIRMFYTPGHAPGHQSFLVSLPSAEKYLLAVDAAYTVDHWEEKALPGFLASTVDTVRSVQKLRALAEHEEAHVVTGHDPDAWPSFKQAPAYYD B: IRLYMFQSGTLKCKTNNIKMNADPAPYEIPVPWYLITHPKGNVVIDGGNAVECATDPEGHWGGITTVYWPDMTPEQGVEAQLQKLGIAKDSVRYVLQSHLHLDHTGAIGRFPKATHIVQRNEYEYAFTPDWFAAGGYIRKDFDKPGLKWQFLNADLHETVEVLDGGEGTIRMFYTPGHAPGHQSFLVSLPSAEKYLLAVDAAYTVDHWEEKALPGFLASTVDTVRSVQKLRALAEHEEAHVVTGHDPDAWPSFKQAPAYYD E: IRLYMFQSGTLKCKTNNIKMNADPAPYEIPVPWYLITHPKGNVVIDGGNAVECATDPEGHWGGITTVYWPDMTPEQGVEAQLQKLGIAKDSVRYVLQSHLHLDHTGAIGRFPKATHIVQRNEYEYAFTPDWFAAGGYIRKDFDKPGLKWQFLNADLHETVEVLDGGEGTIRMFYTPGHAPGHQSFLVSLPSAEKYLLAVDAAYTVDHWEEKALPGFLASTVDTVRSVQKLRALAEHEEAHVVTGHDPDAWPSFKQAPAYYD D: IRLYMFQSGTLKCKTNNIKMNADPAPYEIPVPWYLITHPKGNVVIDGGNAVECATDPEGHWGGITTVYWPDMTPEQGVEAQLQKLGIAKDSVRYVLQSHLHLDHTGAIGRFPKATHIVQRNEYEYAFTPDWFAAGGYIRKDFDKPGLKWQFLNADLHETVEVLDGGEGTIRMFYTPGHAPGHQSFLVSLPSAEKYLLAVDAAYTVDHWEEKALPGFLASTVDTVRSVQKLRALAEHEEAHVVTGHDPDAWPSFKQAPAYYD F: IRLYMFQSGTLKCKTNNIKMNADPAPYEIPVPWYLITHPKGNVVIDGGNAVECATDPEGHWGGITTVYWPDMTPEQGVEAQLQKLGIAKDSVRYVLQSHLHLDHTGAIGRFPKATHIVQRNEYEYAFTPDWFAAGGYIRKDFDKPGLKWQFLNADLHETVEVLDGGEGTIRMFYTPGHAPGHQSFLVSLPSAEKYLLAVDAAYTVDHWEEKALPGFLASTVDTVRSVQKLRALAEHEEAHVVTGHDPDAWPSFKQAPAYYD input PDB |
| Selected Chain(s) | A,B,C,D,E,F |
| Distance of aggregation | 10 Å |
| FoldX usage | Yes |
| pH calculations | Yes |
| alphaCutter usage | No |
| Dynamic mode | No |
| Automated mutations | No |
| Downloads | Download all the data |
| Simulation log |
[INFO] Logger: Verbosity set to: 2 - [INFO] (00:00:02)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:02)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with all chain(s) selected (00:00:02)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:02)
[INFO] PDB-Info: The input structure is globular. Max score is recommended for pH analysis. (00:00:07)
[INFO] FoldX: Starting FoldX energy minimization (00:00:07)
[INFO] Analysis: Starting Aggrescan4D on folded.pdb (00:27:07)
[INFO] agg3D: Running pKa-ANI on
/STORAGE/DATA/lcbio/aggreskan/4f7b86401aa420b/tmp/folded.pdb (00:27:07)
[INFO] Main: Simulation completed successfully. (00:40:20)
|
The table below lists A4D score for protein residues. Residues with A4D score > 0.0000 are marked by yellow rows.
| residue index | residue name | chain | Aggrescan4D score | mutation |
|---|---|---|---|---|
| 1 | I | A | -0.7339 | |
| 2 | R | A | -1.3563 | |
| 3 | L | A | 0.0000 | |
| 4 | Y | A | 0.0000 | |
| 5 | M | A | 0.0000 | |
| 6 | F | A | 0.0000 | |
| 7 | Q | A | -0.5938 | |
| 8 | S | A | 0.0000 | |
| 9 | G | A | 0.0000 | |
| 10 | T | A | -0.8418 | |
| 11 | L | A | 0.0000 | |
| 12 | K | A | -1.6048 | |
| 13 | C | A | -0.9156 | |
| 14 | K | A | -1.6253 | |
| 15 | T | A | -1.4326 | |
| 16 | N | A | -1.7432 | |
| 17 | N | A | -0.8425 | |
| 18 | I | A | 0.0000 | |
| 19 | K | A | -1.1157 | |
| 20 | M | A | -0.9876 | |
| 21 | N | A | -2.0580 | |
| 22 | A | A | -1.8428 | |
| 23 | D | A | -2.6211 | |
| 24 | P | A | -1.9872 | |
| 25 | A | A | -0.9491 | |
| 26 | P | A | -0.9716 | |
| 27 | Y | A | -1.1542 | |
| 28 | E | A | -1.8593 | |
| 29 | I | A | 0.0000 | |
| 30 | P | A | 0.0000 | |
| 31 | V | A | 0.0000 | |
| 32 | P | A | 0.0000 | |
| 33 | W | A | 0.0000 | |
| 34 | Y | A | 0.0000 | |
| 35 | L | A | 0.0000 | |
| 36 | I | A | 0.0000 | |
| 37 | T | A | -0.8122 | |
| 38 | H | A | -0.9716 | |
| 39 | P | A | -1.1289 | |
| 40 | K | A | -2.0609 | |
| 41 | G | A | -1.6282 | |
| 42 | N | A | -1.0765 | |
| 43 | V | A | 0.0000 | |
| 44 | V | A | 0.0000 | |
| 45 | I | A | 0.0000 | |
| 46 | D | A | 0.0000 | |
| 47 | G | A | 0.0000 | |
| 48 | G | A | 0.0000 | |
| 49 | N | A | 0.0000 | |
| 50 | A | A | 0.0000 | |
| 51 | V | A | -0.6176 | |
| 52 | E | A | -1.2905 | |
| 53 | C | A | 0.0000 | |
| 54 | A | A | -1.0878 | |
| 55 | T | A | -1.3109 | |
| 56 | D | A | -2.5427 | |
| 57 | P | A | -2.0732 | |
| 58 | E | A | -2.7307 | |
| 59 | G | A | -2.1284 | |
| 60 | H | A | -1.9412 | |
| 61 | W | A | 0.0000 | |
| 62 | G | A | -1.4226 | |
| 63 | G | A | -0.8075 | |
| 64 | I | A | -0.0041 | |
| 65 | T | A | 0.0000 | |
| 66 | T | A | 0.0171 | |
| 67 | V | A | 0.5197 | |
| 68 | Y | A | 0.0166 | |
| 69 | W | A | -0.3108 | |
| 70 | P | A | 0.0000 | |
| 71 | D | A | -1.1138 | |
| 72 | M | A | -0.7365 | |
| 73 | T | A | -0.9067 | |
| 74 | P | A | -1.1706 | |
| 75 | E | A | -2.2741 | |
| 76 | Q | A | -1.3941 | |
| 77 | G | A | 0.0000 | |
| 78 | V | A | 0.0000 | |
| 79 | E | A | -1.3636 | |
| 80 | A | A | -1.6930 | |
| 81 | Q | A | -1.7719 | |
| 82 | L | A | 0.0000 | |
| 83 | Q | A | -2.4759 | |
| 84 | K | A | -2.5763 | |
| 85 | L | A | -1.1990 | |
| 86 | G | A | -1.3379 | |
| 87 | I | A | -1.1148 | |
| 88 | A | A | -1.4117 | |
| 89 | K | A | -2.3908 | |
| 90 | D | A | -2.6681 | |
| 91 | S | A | -1.8189 | |
| 92 | V | A | 0.0000 | |
| 93 | R | A | -1.6859 | |
| 94 | Y | A | 0.0000 | |
| 95 | V | A | 0.0000 | |
| 96 | L | A | 0.0000 | |
| 97 | Q | A | 0.0000 | |
| 98 | S | A | 0.0000 | |
| 99 | H | A | 0.0000 | |
| 100 | L | A | 0.0000 | |
| 101 | H | A | 0.0000 | |
| 102 | L | A | 0.0000 | |
| 103 | D | A | 0.0000 | |
| 104 | H | A | 0.0000 | |
| 105 | T | A | 0.0000 | |
| 106 | G | A | 0.0000 | |
| 107 | A | A | 0.0000 | |
| 108 | I | A | 0.0000 | |
| 109 | G | A | -1.0378 | |
| 110 | R | A | -0.9948 | |
| 111 | F | A | 0.0000 | |
| 112 | P | A | -2.0726 | |
| 113 | K | A | -2.8446 | |
| 114 | A | A | 0.0000 | |
| 115 | T | A | 0.0000 | |
| 116 | H | A | 0.0000 | |
| 117 | I | A | 0.0000 | |
| 118 | V | A | 0.0000 | |
| 119 | Q | A | 0.0000 | |
| 120 | R | A | 0.0000 | |
| 121 | N | A | -1.0980 | |
| 122 | E | A | 0.0000 | |
| 123 | Y | A | 0.0000 | |
| 124 | E | A | -0.5433 | |
| 125 | Y | A | 0.0000 | |
| 126 | A | A | 0.0000 | |
| 127 | F | A | 0.0000 | |
| 128 | T | A | 0.0000 | |
| 129 | P | A | 0.0213 | |
| 130 | D | A | 0.0000 | |
| 131 | W | A | 0.2811 | |
| 132 | F | A | 0.2157 | |
| 133 | A | A | 0.0000 | |
| 134 | A | A | 0.0752 | |
| 135 | G | A | -0.1477 | |
| 136 | G | A | -0.1719 | |
| 137 | Y | A | 0.0000 | |
| 138 | I | A | 0.0000 | |
| 139 | R | A | -1.6535 | |
| 140 | K | A | -2.2485 | |
| 141 | D | A | 0.0000 | |
| 142 | F | A | 0.0000 | |
| 143 | D | A | -1.6182 | |
| 144 | K | A | -1.4136 | |
| 145 | P | A | -1.0028 | |
| 146 | G | A | -1.0821 | |
| 147 | L | A | -1.3486 | |
| 148 | K | A | -1.9919 | |
| 149 | W | A | -0.6391 | |
| 150 | Q | A | -0.4016 | |
| 151 | F | A | -0.0995 | |
| 152 | L | A | 0.0000 | |
| 153 | N | A | -1.5793 | |
| 154 | A | A | 0.0000 | |
| 155 | D | A | -2.1118 | |
| 156 | L | A | -0.3600 | |
| 157 | H | A | -1.0411 | |
| 158 | E | A | -1.4390 | |
| 159 | T | A | -0.4369 | |
| 160 | V | A | 0.6943 | |
| 161 | E | A | 0.1437 | |
| 162 | V | A | 0.0747 | |
| 163 | L | A | 0.0000 | |
| 164 | D | A | 0.0000 | |
| 165 | G | A | -1.1349 | |
| 166 | G | A | -1.7825 | |
| 167 | E | A | -2.0514 | |
| 168 | G | A | -1.1069 | |
| 169 | T | A | -0.7707 | |
| 170 | I | A | 0.0000 | |
| 171 | R | A | -0.2933 | |
| 172 | M | A | 0.0000 | |
| 173 | F | A | 0.0000 | |
| 174 | Y | A | 0.0000 | |
| 175 | T | A | 0.0000 | |
| 176 | P | A | 0.0000 | |
| 177 | G | A | 0.0000 | |
| 178 | H | A | 0.0000 | |
| 179 | A | A | 0.0000 | |
| 180 | P | A | -0.5533 | |
| 181 | G | A | 0.0000 | |
| 182 | H | A | 0.0000 | |
| 183 | Q | A | 0.0000 | |
| 184 | S | A | 0.0000 | |
| 185 | F | A | 0.0000 | |
| 186 | L | A | 0.0000 | |
| 187 | V | A | 0.0000 | |
| 188 | S | A | -1.2081 | |
| 189 | L | A | 0.0000 | |
| 190 | P | A | -1.2070 | |
| 191 | S | A | -1.3234 | |
| 192 | A | A | -1.1078 | |
| 193 | E | A | -2.2966 | |
| 194 | K | A | -1.8033 | |
| 195 | Y | A | 0.0000 | |
| 196 | L | A | 0.0000 | |
| 197 | L | A | 0.0000 | |
| 198 | A | A | 0.0000 | |
| 199 | V | A | 0.0000 | |
| 200 | D | A | 0.0000 | |
| 201 | A | A | 0.0000 | |
| 202 | A | A | 0.0000 | |
| 203 | Y | A | 0.0000 | |
| 204 | T | A | 0.0000 | |
| 205 | V | A | -0.0722 | |
| 206 | D | A | -1.1521 | |
| 207 | H | A | 0.0000 | |
| 208 | W | A | -0.7697 | |
| 209 | E | A | -1.7895 | |
| 210 | E | A | -1.5576 | |
| 211 | K | A | -2.1388 | |
| 212 | A | A | -1.2461 | |
| 213 | L | A | -0.4699 | |
| 214 | P | A | 0.0000 | |
| 215 | G | A | 0.0000 | |
| 216 | F | A | 0.2212 | |
| 217 | L | A | 0.0000 | |
| 218 | A | A | 0.0000 | |
| 219 | S | A | -0.3203 | |
| 220 | T | A | 0.0000 | |
| 221 | V | A | -0.2565 | |
| 222 | D | A | -0.9689 | |
| 223 | T | A | 0.0000 | |
| 224 | V | A | 0.0000 | |
| 225 | R | A | -1.0524 | |
| 226 | S | A | 0.0000 | |
| 227 | V | A | 0.0000 | |
| 228 | Q | A | -1.2755 | |
| 229 | K | A | -1.1148 | |
| 230 | L | A | 0.0000 | |
| 231 | R | A | -1.3541 | |
| 232 | A | A | -1.2056 | |
| 233 | L | A | -1.0413 | |
| 234 | A | A | 0.0000 | |
| 235 | E | A | -2.0907 | |
| 236 | H | A | -1.5244 | |
| 237 | E | A | -2.0682 | |
| 238 | E | A | -2.8387 | |
| 239 | A | A | -1.9854 | |
| 240 | H | A | -1.4540 | |
| 241 | V | A | -0.3594 | |
| 242 | V | A | 0.0000 | |
| 243 | T | A | 0.0000 | |
| 244 | G | A | 0.0000 | |
| 245 | H | A | 0.0000 | |
| 246 | D | A | 0.0000 | |
| 247 | P | A | -1.1180 | |
| 248 | D | A | -1.7544 | |
| 249 | A | A | -0.7420 | |
| 250 | W | A | -0.8140 | |
| 251 | P | A | -1.1008 | |
| 252 | S | A | -0.9462 | |
| 253 | F | A | -0.8136 | |
| 254 | K | A | -1.7503 | |
| 255 | Q | A | -1.8295 | |
| 256 | A | A | 0.0000 | |
| 257 | P | A | -0.8535 | |
| 258 | A | A | -0.6856 | |
| 259 | Y | A | -0.7809 | |
| 260 | Y | A | -1.3754 | |
| 261 | D | A | -2.2685 | |
| 1 | I | B | -0.8455 | |
| 2 | R | B | -1.2759 | |
| 3 | L | B | 0.0000 | |
| 4 | Y | B | 0.0000 | |
| 5 | M | B | 0.0000 | |
| 6 | F | B | 0.0000 | |
| 7 | Q | B | -0.5885 | |
| 8 | S | B | 0.0000 | |
| 9 | G | B | 0.0000 | |
| 10 | T | B | -0.8816 | |
| 11 | L | B | 0.0000 | |
| 12 | K | B | -1.5720 | |
| 13 | C | B | -0.9021 | |
| 14 | K | B | -1.7720 | |
| 15 | T | B | -1.4986 | |
| 16 | N | B | -1.8385 | |
| 17 | N | B | -0.9491 | |
| 18 | I | B | 0.0000 | |
| 19 | K | B | -1.1480 | |
| 20 | M | B | -1.0101 | |
| 21 | N | B | -2.0410 | |
| 22 | A | B | -1.8780 | |
| 23 | D | B | -2.6523 | |
| 24 | P | B | -2.0597 | |
| 25 | A | B | -0.9889 | |
| 26 | P | B | -0.9886 | |
| 27 | Y | B | -1.0882 | |
| 28 | E | B | -1.6071 | |
| 29 | I | B | 0.0000 | |
| 30 | P | B | 0.0000 | |
| 31 | V | B | 0.0000 | |
| 32 | P | B | 0.0000 | |
| 33 | W | B | 0.0000 | |
| 34 | Y | B | 0.0000 | |
| 35 | L | B | 0.0000 | |
| 36 | I | B | 0.0000 | |
| 37 | T | B | -0.7845 | |
| 38 | H | B | -0.9734 | |
| 39 | P | B | -1.1311 | |
| 40 | K | B | -2.0265 | |
| 41 | G | B | -1.6613 | |
| 42 | N | B | -1.1249 | |
| 43 | V | B | 0.0000 | |
| 44 | V | B | 0.0000 | |
| 45 | I | B | 0.0000 | |
| 46 | D | B | 0.0000 | |
| 47 | G | B | 0.0000 | |
| 48 | G | B | 0.0000 | |
| 49 | N | B | 0.0000 | |
| 50 | A | B | 0.0000 | |
| 51 | V | B | -0.7861 | |
| 52 | E | B | -1.4016 | |
| 53 | C | B | 0.0000 | |
| 54 | A | B | -1.2674 | |
| 55 | T | B | -1.3589 | |
| 56 | D | B | -2.5632 | |
| 57 | P | B | -2.1248 | |
| 58 | E | B | -2.7197 | |
| 59 | G | B | -2.1431 | |
| 60 | H | B | -1.9620 | |
| 61 | W | B | 0.0000 | |
| 62 | G | B | -1.4210 | |
| 63 | G | B | -0.8018 | |
| 64 | I | B | 0.0350 | |
| 65 | T | B | 0.0000 | |
| 66 | T | B | 0.0513 | |
| 67 | V | B | 0.5218 | |
| 68 | Y | B | 0.0545 | |
| 69 | W | B | -0.2336 | |
| 70 | P | B | 0.0000 | |
| 71 | D | B | -1.4341 | |
| 72 | M | B | 0.0000 | |
| 73 | T | B | -1.1422 | |
| 74 | P | B | -1.3446 | |
| 75 | E | B | -2.5321 | |
| 76 | Q | B | -1.6238 | |
| 77 | G | B | 0.0000 | |
| 78 | V | B | 0.0000 | |
| 79 | E | B | -1.6689 | |
| 80 | A | B | -1.8684 | |
| 81 | Q | B | -1.8717 | |
| 82 | L | B | 0.0000 | |
| 83 | Q | B | -2.5700 | |
| 84 | K | B | -2.6001 | |
| 85 | L | B | -1.1660 | |
| 86 | G | B | -1.3245 | |
| 87 | I | B | -1.1806 | |
| 88 | A | B | -1.5879 | |
| 89 | K | B | -2.7659 | |
| 90 | D | B | -2.9898 | |
| 91 | S | B | -1.9953 | |
| 92 | V | B | 0.0000 | |
| 93 | R | B | -1.7638 | |
| 94 | Y | B | 0.0000 | |
| 95 | V | B | 0.0000 | |
| 96 | L | B | 0.0000 | |
| 97 | Q | B | 0.0000 | |
| 98 | S | B | 0.0000 | |
| 99 | H | B | 0.0000 | |
| 100 | L | B | 0.0000 | |
| 101 | H | B | 0.0000 | |
| 102 | L | B | 0.0000 | |
| 103 | D | B | 0.0000 | |
| 104 | H | B | 0.0000 | |
| 105 | T | B | 0.0000 | |
| 106 | G | B | 0.0000 | |
| 107 | A | B | 0.0000 | |
| 108 | I | B | 0.0000 | |
| 109 | G | B | -1.0350 | |
| 110 | R | B | -1.1048 | |
| 111 | F | B | 0.0000 | |
| 112 | P | B | -2.1809 | |
| 113 | K | B | -2.9492 | |
| 114 | A | B | 0.0000 | |
| 115 | T | B | 0.0000 | |
| 116 | H | B | 0.0000 | |
| 117 | I | B | 0.0000 | |
| 118 | V | B | 0.0000 | |
| 119 | Q | B | 0.0000 | |
| 120 | R | B | 0.0000 | |
| 121 | N | B | -1.0764 | |
| 122 | E | B | 0.0000 | |
| 123 | Y | B | 0.0000 | |
| 124 | E | B | -0.5398 | |
| 125 | Y | B | 0.0000 | |
| 126 | A | B | 0.0000 | |
| 127 | F | B | 0.0000 | |
| 128 | T | B | 0.0000 | |
| 129 | P | B | 0.0321 | |
| 130 | D | B | 0.0000 | |
| 131 | W | B | 0.3070 | |
| 132 | F | B | 0.2380 | |
| 133 | A | B | 0.0000 | |
| 134 | A | B | 0.1007 | |
| 135 | G | B | -0.1148 | |
| 136 | G | B | 0.0000 | |
| 137 | Y | B | 0.0000 | |
| 138 | I | B | 0.0000 | |
| 139 | R | B | -1.6456 | |
| 140 | K | B | -2.2488 | |
| 141 | D | B | 0.0000 | |
| 142 | F | B | 0.0000 | |
| 143 | D | B | -1.6266 | |
| 144 | K | B | -1.4164 | |
| 145 | P | B | -1.0039 | |
| 146 | G | B | -1.0802 | |
| 147 | L | B | -1.3451 | |
| 148 | K | B | -1.9875 | |
| 149 | W | B | -0.6066 | |
| 150 | Q | B | -0.3796 | |
| 151 | F | B | -0.0260 | |
| 152 | L | B | 0.0000 | |
| 153 | N | B | -1.5154 | |
| 154 | A | B | 0.0000 | |
| 155 | D | B | -2.1002 | |
| 156 | L | B | -0.3543 | |
| 157 | H | B | -0.9866 | |
| 158 | E | B | -1.4250 | |
| 159 | T | B | -0.5359 | |
| 160 | V | B | 0.4263 | |
| 161 | E | B | -0.0727 | |
| 162 | V | B | -0.0662 | |
| 163 | L | B | 0.0000 | |
| 164 | D | B | 0.0000 | |
| 165 | G | B | -1.1503 | |
| 166 | G | B | -1.7614 | |
| 167 | E | B | -2.0687 | |
| 168 | G | B | -1.1567 | |
| 169 | T | B | -0.8068 | |
| 170 | I | B | 0.0000 | |
| 171 | R | B | -0.4629 | |
| 172 | M | B | 0.0000 | |
| 173 | F | B | 0.0000 | |
| 174 | Y | B | 0.0000 | |
| 175 | T | B | 0.0000 | |
| 176 | P | B | -0.7697 | |
| 177 | G | B | 0.0000 | |
| 178 | H | B | 0.0000 | |
| 179 | A | B | 0.0000 | |
| 180 | P | B | -0.5689 | |
| 181 | G | B | 0.0000 | |
| 182 | H | B | 0.0000 | |
| 183 | Q | B | 0.0000 | |
| 184 | S | B | 0.0000 | |
| 185 | F | B | 0.0000 | |
| 186 | L | B | 0.0000 | |
| 187 | V | B | 0.0000 | |
| 188 | S | B | -1.2536 | |
| 189 | L | B | 0.0000 | |
| 190 | P | B | -1.1752 | |
| 191 | S | B | -1.3085 | |
| 192 | A | B | -1.1526 | |
| 193 | E | B | -2.3956 | |
| 194 | K | B | -1.8544 | |
| 195 | Y | B | 0.0000 | |
| 196 | L | B | 0.0000 | |
| 197 | L | B | 0.0000 | |
| 198 | A | B | 0.0000 | |
| 199 | V | B | 0.0000 | |
| 200 | D | B | 0.0000 | |
| 201 | A | B | 0.0000 | |
| 202 | A | B | 0.0000 | |
| 203 | Y | B | 0.0000 | |
| 204 | T | B | 0.0000 | |
| 205 | V | B | -0.1456 | |
| 206 | D | B | -1.1691 | |
| 207 | H | B | 0.0000 | |
| 208 | W | B | -0.9152 | |
| 209 | E | B | -2.1579 | |
| 210 | E | B | -1.7181 | |
| 211 | K | B | -2.2288 | |
| 212 | A | B | -1.2851 | |
| 213 | L | B | -0.4642 | |
| 214 | P | B | 0.0000 | |
| 215 | G | B | -0.5089 | |
| 216 | F | B | 0.1869 | |
| 217 | L | B | 0.0000 | |
| 218 | A | B | 0.0000 | |
| 219 | S | B | -0.3357 | |
| 220 | T | B | 0.0000 | |
| 221 | V | B | -0.2855 | |
| 222 | D | B | -1.0244 | |
| 223 | T | B | 0.0000 | |
| 224 | V | B | 0.0000 | |
| 225 | R | B | -0.9723 | |
| 226 | S | B | 0.0000 | |
| 227 | V | B | 0.0000 | |
| 228 | Q | B | -1.1578 | |
| 229 | K | B | -0.9332 | |
| 230 | L | B | 0.0000 | |
| 231 | R | B | -1.3009 | |
| 232 | A | B | -1.1212 | |
| 233 | L | B | -0.9833 | |
| 234 | A | B | 0.0000 | |
| 235 | E | B | -2.0556 | |
| 236 | H | B | -1.5267 | |
| 237 | E | B | -2.0493 | |
| 238 | E | B | -2.7938 | |
| 239 | A | B | -1.9960 | |
| 240 | H | B | -1.4418 | |
| 241 | V | B | -0.3475 | |
| 242 | V | B | 0.0000 | |
| 243 | T | B | 0.0000 | |
| 244 | G | B | 0.0000 | |
| 245 | H | B | 0.0000 | |
| 246 | D | B | 0.0000 | |
| 247 | P | B | -1.0482 | |
| 248 | D | B | -1.7546 | |
| 249 | A | B | -0.7457 | |
| 250 | W | B | -0.8019 | |
| 251 | P | B | -1.0867 | |
| 252 | S | B | -0.9303 | |
| 253 | F | B | -0.7866 | |
| 254 | K | B | -1.6872 | |
| 255 | Q | B | -1.8006 | |
| 256 | A | B | 0.0000 | |
| 257 | P | B | -0.8487 | |
| 258 | A | B | -0.6903 | |
| 259 | Y | B | -0.7589 | |
| 260 | Y | B | -1.2885 | |
| 261 | D | B | -2.0936 | |
| 1 | I | C | -0.7148 | |
| 2 | R | C | -1.3600 | |
| 3 | L | C | 0.0000 | |
| 4 | Y | C | 0.0000 | |
| 5 | M | C | 0.0000 | |
| 6 | F | C | 0.0000 | |
| 7 | Q | C | -0.5441 | |
| 8 | S | C | 0.0000 | |
| 9 | G | C | 0.0000 | |
| 10 | T | C | -0.9075 | |
| 11 | L | C | 0.0000 | |
| 12 | K | C | -1.6042 | |
| 13 | C | C | -0.8490 | |
| 14 | K | C | -1.6471 | |
| 15 | T | C | -1.4269 | |
| 16 | N | C | -1.7880 | |
| 17 | N | C | -0.8638 | |
| 18 | I | C | 0.0000 | |
| 19 | K | C | -1.1125 | |
| 20 | M | C | -0.9830 | |
| 21 | N | C | -1.9734 | |
| 22 | A | C | -1.7375 | |
| 23 | D | C | -2.6387 | |
| 24 | P | C | -2.0268 | |
| 25 | A | C | -0.9428 | |
| 26 | P | C | -0.9368 | |
| 27 | Y | C | -1.0230 | |
| 28 | E | C | -1.5574 | |
| 29 | I | C | 0.0000 | |
| 30 | P | C | 0.0000 | |
| 31 | V | C | 0.0000 | |
| 32 | P | C | 0.0000 | |
| 33 | W | C | 0.0000 | |
| 34 | Y | C | 0.0000 | |
| 35 | L | C | 0.0000 | |
| 36 | I | C | 0.0000 | |
| 37 | T | C | -0.7983 | |
| 38 | H | C | -0.9605 | |
| 39 | P | C | -1.1232 | |
| 40 | K | C | -2.0543 | |
| 41 | G | C | -1.6186 | |
| 42 | N | C | -1.0935 | |
| 43 | V | C | 0.0000 | |
| 44 | V | C | 0.0000 | |
| 45 | I | C | 0.0000 | |
| 46 | D | C | 0.0000 | |
| 47 | G | C | 0.0000 | |
| 48 | G | C | 0.0000 | |
| 49 | N | C | 0.0000 | |
| 50 | A | C | 0.0000 | |
| 51 | V | C | -0.6228 | |
| 52 | E | C | -1.3061 | |
| 53 | C | C | 0.0000 | |
| 54 | A | C | -1.1907 | |
| 55 | T | C | -1.3193 | |
| 56 | D | C | -2.5545 | |
| 57 | P | C | -2.1284 | |
| 58 | E | C | -2.7289 | |
| 59 | G | C | -2.1601 | |
| 60 | H | C | -1.9471 | |
| 61 | W | C | 0.0000 | |
| 62 | G | C | -1.4315 | |
| 63 | G | C | -0.8118 | |
| 64 | I | C | 0.0168 | |
| 65 | T | C | 0.0000 | |
| 66 | T | C | 0.0354 | |
| 67 | V | C | 0.3930 | |
| 68 | Y | C | 0.0328 | |
| 69 | W | C | -0.2969 | |
| 70 | P | C | 0.0000 | |
| 71 | D | C | -1.5514 | |
| 72 | M | C | -0.9609 | |
| 73 | T | C | -1.0040 | |
| 74 | P | C | -1.1652 | |
| 75 | E | C | -2.2608 | |
| 76 | Q | C | -1.4302 | |
| 77 | G | C | 0.0000 | |
| 78 | V | C | 0.0000 | |
| 79 | E | C | -1.4271 | |
| 80 | A | C | -1.6948 | |
| 81 | Q | C | -1.7659 | |
| 82 | L | C | 0.0000 | |
| 83 | Q | C | -2.5174 | |
| 84 | K | C | -2.5705 | |
| 85 | L | C | -1.1907 | |
| 86 | G | C | -1.3533 | |
| 87 | I | C | -1.1537 | |
| 88 | A | C | -1.5350 | |
| 89 | K | C | -2.6783 | |
| 90 | D | C | -2.8070 | |
| 91 | S | C | -1.9010 | |
| 92 | V | C | 0.0000 | |
| 93 | R | C | -1.6954 | |
| 94 | Y | C | 0.0000 | |
| 95 | V | C | 0.0000 | |
| 96 | L | C | 0.0000 | |
| 97 | Q | C | 0.0000 | |
| 98 | S | C | 0.0000 | |
| 99 | H | C | 0.0000 | |
| 100 | L | C | 0.0000 | |
| 101 | H | C | 0.0000 | |
| 102 | L | C | 0.0000 | |
| 103 | D | C | 0.0000 | |
| 104 | H | C | 0.0000 | |
| 105 | T | C | 0.0000 | |
| 106 | G | C | 0.0000 | |
| 107 | A | C | 0.0000 | |
| 108 | I | C | 0.0000 | |
| 109 | G | C | -1.0296 | |
| 110 | R | C | -1.0436 | |
| 111 | F | C | 0.0000 | |
| 112 | P | C | -2.1325 | |
| 113 | K | C | -2.8853 | |
| 114 | A | C | 0.0000 | |
| 115 | T | C | 0.0000 | |
| 116 | H | C | 0.0000 | |
| 117 | I | C | 0.0000 | |
| 118 | V | C | 0.0000 | |
| 119 | Q | C | 0.0000 | |
| 120 | R | C | 0.0000 | |
| 121 | N | C | -1.0821 | |
| 122 | E | C | 0.0000 | |
| 123 | Y | C | 0.0000 | |
| 124 | E | C | -0.5312 | |
| 125 | Y | C | 0.0000 | |
| 126 | A | C | 0.0000 | |
| 127 | F | C | 0.0000 | |
| 128 | T | C | 0.0000 | |
| 129 | P | C | 0.0138 | |
| 130 | D | C | 0.0000 | |
| 131 | W | C | 0.2319 | |
| 132 | F | C | 0.1849 | |
| 133 | A | C | 0.0000 | |
| 134 | A | C | 0.0613 | |
| 135 | G | C | -0.1539 | |
| 136 | G | C | -0.1708 | |
| 137 | Y | C | 0.0000 | |
| 138 | I | C | 0.0000 | |
| 139 | R | C | -1.6370 | |
| 140 | K | C | -2.2385 | |
| 141 | D | C | 0.0000 | |
| 142 | F | C | 0.0000 | |
| 143 | D | C | -1.6106 | |
| 144 | K | C | -1.4108 | |
| 145 | P | C | -1.0029 | |
| 146 | G | C | -1.0799 | |
| 147 | L | C | -1.3437 | |
| 148 | K | C | -1.9868 | |
| 149 | W | C | -0.6343 | |
| 150 | Q | C | -0.4153 | |
| 151 | F | C | -0.1011 | |
| 152 | L | C | 0.0000 | |
| 153 | N | C | -1.4697 | |
| 154 | A | C | 0.0000 | |
| 155 | D | C | -1.9283 | |
| 156 | L | C | -0.0477 | |
| 157 | H | C | -0.9582 | |
| 158 | E | C | -1.5000 | |
| 159 | T | C | -0.5740 | |
| 160 | V | C | 0.3747 | |
| 161 | E | C | -0.1498 | |
| 162 | V | C | -0.0661 | |
| 163 | L | C | 0.0000 | |
| 164 | D | C | 0.0000 | |
| 165 | G | C | -1.1300 | |
| 166 | G | C | -1.7923 | |
| 167 | E | C | -2.0585 | |
| 168 | G | C | -1.1503 | |
| 169 | T | C | -0.7812 | |
| 170 | I | C | 0.0000 | |
| 171 | R | C | -0.4375 | |
| 172 | M | C | 0.0000 | |
| 173 | F | C | 0.0000 | |
| 174 | Y | C | 0.0000 | |
| 175 | T | C | 0.0000 | |
| 176 | P | C | 0.0000 | |
| 177 | G | C | 0.0000 | |
| 178 | H | C | 0.0000 | |
| 179 | A | C | 0.0000 | |
| 180 | P | C | -0.5503 | |
| 181 | G | C | 0.0000 | |
| 182 | H | C | 0.0000 | |
| 183 | Q | C | 0.0000 | |
| 184 | S | C | 0.0000 | |
| 185 | F | C | 0.0000 | |
| 186 | L | C | 0.0000 | |
| 187 | V | C | 0.0000 | |
| 188 | S | C | -1.2607 | |
| 189 | L | C | 0.0000 | |
| 190 | P | C | -1.2387 | |
| 191 | S | C | -1.3808 | |
| 192 | A | C | -1.1924 | |
| 193 | E | C | -2.4575 | |
| 194 | K | C | -1.8460 | |
| 195 | Y | C | 0.0000 | |
| 196 | L | C | 0.0000 | |
| 197 | L | C | 0.0000 | |
| 198 | A | C | 0.0000 | |
| 199 | V | C | 0.0000 | |
| 200 | D | C | 0.0000 | |
| 201 | A | C | 0.0000 | |
| 202 | A | C | 0.0000 | |
| 203 | Y | C | 0.0000 | |
| 204 | T | C | 0.0000 | |
| 205 | V | C | -0.1469 | |
| 206 | D | C | -1.1519 | |
| 207 | H | C | 0.0000 | |
| 208 | W | C | -0.9220 | |
| 209 | E | C | -2.1346 | |
| 210 | E | C | -1.7878 | |
| 211 | K | C | -2.2487 | |
| 212 | A | C | -1.2934 | |
| 213 | L | C | -0.4729 | |
| 214 | P | C | 0.0000 | |
| 215 | G | C | 0.0000 | |
| 216 | F | C | 0.2290 | |
| 217 | L | C | 0.0000 | |
| 218 | A | C | 0.0000 | |
| 219 | S | C | -0.3162 | |
| 220 | T | C | 0.0000 | |
| 221 | V | C | -0.2398 | |
| 222 | D | C | -0.9395 | |
| 223 | T | C | 0.0000 | |
| 224 | V | C | 0.0000 | |
| 225 | R | C | -0.9698 | |
| 226 | S | C | 0.0000 | |
| 227 | V | C | 0.0000 | |
| 228 | Q | C | -1.2259 | |
| 229 | K | C | -1.0382 | |
| 230 | L | C | 0.0000 | |
| 231 | R | C | -1.3501 | |
| 232 | A | C | -1.1597 | |
| 233 | L | C | -0.9964 | |
| 234 | A | C | 0.0000 | |
| 235 | E | C | -2.0570 | |
| 236 | H | C | -1.4990 | |
| 237 | E | C | -2.0170 | |
| 238 | E | C | -2.8233 | |
| 239 | A | C | -1.9802 | |
| 240 | H | C | -1.4418 | |
| 241 | V | C | -0.3541 | |
| 242 | V | C | 0.0000 | |
| 243 | T | C | 0.0000 | |
| 244 | G | C | 0.0000 | |
| 245 | H | C | 0.0000 | |
| 246 | D | C | 0.0000 | |
| 247 | P | C | -1.0453 | |
| 248 | D | C | -1.7627 | |
| 249 | A | C | -0.7522 | |
| 250 | W | C | -0.8209 | |
| 251 | P | C | -1.1118 | |
| 252 | S | C | -0.9592 | |
| 253 | F | C | -0.8395 | |
| 254 | K | C | -1.7966 | |
| 255 | Q | C | -1.8455 | |
| 256 | A | C | 0.0000 | |
| 257 | P | C | -0.8670 | |
| 258 | A | C | -0.7111 | |
| 259 | Y | C | -0.8124 | |
| 260 | Y | C | -1.4063 | |
| 261 | D | C | -2.2970 | |
| 1 | I | D | -0.5718 | |
| 2 | R | D | -1.1167 | |
| 3 | L | D | 0.0000 | |
| 4 | Y | D | 0.0000 | |
| 5 | M | D | 0.0000 | |
| 6 | F | D | 0.0000 | |
| 7 | Q | D | -0.5463 | |
| 8 | S | D | 0.0000 | |
| 9 | G | D | 0.0000 | |
| 10 | T | D | -0.8514 | |
| 11 | L | D | 0.0000 | |
| 12 | K | D | -1.5268 | |
| 13 | C | D | -0.8370 | |
| 14 | K | D | -1.6596 | |
| 15 | T | D | -1.4282 | |
| 16 | N | D | -1.7935 | |
| 17 | N | D | -0.8711 | |
| 18 | I | D | 0.0000 | |
| 19 | K | D | -1.2089 | |
| 20 | M | D | -0.9635 | |
| 21 | N | D | -1.9642 | |
| 22 | A | D | -1.7348 | |
| 23 | D | D | -2.6410 | |
| 24 | P | D | -2.0317 | |
| 25 | A | D | -0.9507 | |
| 26 | P | D | -0.9305 | |
| 27 | Y | D | -1.0070 | |
| 28 | E | D | -1.5451 | |
| 29 | I | D | 0.0000 | |
| 30 | P | D | 0.0000 | |
| 31 | V | D | 0.0000 | |
| 32 | P | D | 0.0000 | |
| 33 | W | D | 0.0000 | |
| 34 | Y | D | 0.0000 | |
| 35 | L | D | 0.0000 | |
| 36 | I | D | 0.0000 | |
| 37 | T | D | -0.7368 | |
| 38 | H | D | -0.9555 | |
| 39 | P | D | -1.1257 | |
| 40 | K | D | -2.0543 | |
| 41 | G | D | -1.6290 | |
| 42 | N | D | -1.1008 | |
| 43 | V | D | 0.0000 | |
| 44 | V | D | 0.0000 | |
| 45 | I | D | 0.0000 | |
| 46 | D | D | 0.0000 | |
| 47 | G | D | 0.0000 | |
| 48 | G | D | 0.0000 | |
| 49 | N | D | 0.0000 | |
| 50 | A | D | 0.0000 | |
| 51 | V | D | -0.5830 | |
| 52 | E | D | -1.3152 | |
| 53 | C | D | 0.0000 | |
| 54 | A | D | -1.1480 | |
| 55 | T | D | -1.3295 | |
| 56 | D | D | -2.5714 | |
| 57 | P | D | -2.1142 | |
| 58 | E | D | -2.7298 | |
| 59 | G | D | -2.1645 | |
| 60 | H | D | -1.9501 | |
| 61 | W | D | 0.0000 | |
| 62 | G | D | -1.4172 | |
| 63 | G | D | -0.8064 | |
| 64 | I | D | 0.0201 | |
| 65 | T | D | 0.0000 | |
| 66 | T | D | 0.0409 | |
| 67 | V | D | 0.3892 | |
| 68 | Y | D | 0.0554 | |
| 69 | W | D | -0.2377 | |
| 70 | P | D | 0.0000 | |
| 71 | D | D | -1.3977 | |
| 72 | M | D | -0.8711 | |
| 73 | T | D | -0.9389 | |
| 74 | P | D | -1.1093 | |
| 75 | E | D | -2.1491 | |
| 76 | Q | D | -1.3519 | |
| 77 | G | D | 0.0000 | |
| 78 | V | D | 0.0000 | |
| 79 | E | D | -1.3976 | |
| 80 | A | D | -1.6530 | |
| 81 | Q | D | -1.7458 | |
| 82 | L | D | 0.0000 | |
| 83 | Q | D | -2.5121 | |
| 84 | K | D | -2.5574 | |
| 85 | L | D | -1.1888 | |
| 86 | G | D | -1.3576 | |
| 87 | I | D | -1.1633 | |
| 88 | A | D | -1.5719 | |
| 89 | K | D | -2.7496 | |
| 90 | D | D | -2.8796 | |
| 91 | S | D | -1.9390 | |
| 92 | V | D | 0.0000 | |
| 93 | R | D | -1.7132 | |
| 94 | Y | D | 0.0000 | |
| 95 | V | D | 0.0000 | |
| 96 | L | D | 0.0000 | |
| 97 | Q | D | 0.0000 | |
| 98 | S | D | 0.0000 | |
| 99 | H | D | 0.0000 | |
| 100 | L | D | 0.0000 | |
| 101 | H | D | 0.0000 | |
| 102 | L | D | 0.0000 | |
| 103 | D | D | 0.0000 | |
| 104 | H | D | 0.0000 | |
| 105 | T | D | 0.0000 | |
| 106 | G | D | 0.0000 | |
| 107 | A | D | 0.0000 | |
| 108 | I | D | 0.0000 | |
| 109 | G | D | -1.0354 | |
| 110 | R | D | -1.0559 | |
| 111 | F | D | 0.0000 | |
| 112 | P | D | -2.1570 | |
| 113 | K | D | -2.9107 | |
| 114 | A | D | 0.0000 | |
| 115 | T | D | 0.0000 | |
| 116 | H | D | 0.0000 | |
| 117 | I | D | 0.0000 | |
| 118 | V | D | 0.0000 | |
| 119 | Q | D | 0.0000 | |
| 120 | R | D | 0.0000 | |
| 121 | N | D | -1.0873 | |
| 122 | E | D | 0.0000 | |
| 123 | Y | D | 0.0000 | |
| 124 | E | D | -0.5365 | |
| 125 | Y | D | 0.0000 | |
| 126 | A | D | 0.0000 | |
| 127 | F | D | 0.0000 | |
| 128 | T | D | 0.0000 | |
| 129 | P | D | 0.0220 | |
| 130 | D | D | 0.0000 | |
| 131 | W | D | 0.2660 | |
| 132 | F | D | 0.1915 | |
| 133 | A | D | 0.0000 | |
| 134 | A | D | 0.0762 | |
| 135 | G | D | -0.1441 | |
| 136 | G | D | -0.1715 | |
| 137 | Y | D | 0.0000 | |
| 138 | I | D | 0.0000 | |
| 139 | R | D | -1.6389 | |
| 140 | K | D | -2.2394 | |
| 141 | D | D | 0.0000 | |
| 142 | F | D | 0.0000 | |
| 143 | D | D | -1.6072 | |
| 144 | K | D | -1.4075 | |
| 145 | P | D | -0.9999 | |
| 146 | G | D | -1.0811 | |
| 147 | L | D | -1.3451 | |
| 148 | K | D | -1.9896 | |
| 149 | W | D | -0.6257 | |
| 150 | Q | D | -0.3987 | |
| 151 | F | D | -0.0918 | |
| 152 | L | D | 0.0000 | |
| 153 | N | D | -1.4898 | |
| 154 | A | D | 0.0000 | |
| 155 | D | D | -2.0095 | |
| 156 | L | D | -0.1431 | |
| 157 | H | D | -0.9912 | |
| 158 | E | D | -1.6738 | |
| 159 | T | D | -0.5987 | |
| 160 | V | D | 0.5247 | |
| 161 | E | D | 0.1298 | |
| 162 | V | D | 0.2007 | |
| 163 | L | D | 0.0000 | |
| 164 | D | D | 0.0000 | |
| 165 | G | D | -1.1176 | |
| 166 | G | D | -1.7442 | |
| 167 | E | D | -2.0345 | |
| 168 | G | D | -1.0704 | |
| 169 | T | D | -0.7530 | |
| 170 | I | D | 0.0000 | |
| 171 | R | D | -0.3043 | |
| 172 | M | D | 0.0000 | |
| 173 | F | D | 0.0000 | |
| 174 | Y | D | 0.0000 | |
| 175 | T | D | 0.0000 | |
| 176 | P | D | -0.8095 | |
| 177 | G | D | 0.0000 | |
| 178 | H | D | 0.0000 | |
| 179 | A | D | 0.0000 | |
| 180 | P | D | -0.5725 | |
| 181 | G | D | 0.0000 | |
| 182 | H | D | 0.0000 | |
| 183 | Q | D | 0.0000 | |
| 184 | S | D | 0.0000 | |
| 185 | F | D | 0.0000 | |
| 186 | L | D | 0.0000 | |
| 187 | V | D | 0.0000 | |
| 188 | S | D | -1.1761 | |
| 189 | L | D | 0.0000 | |
| 190 | P | D | -1.0680 | |
| 191 | S | D | -1.1122 | |
| 192 | A | D | -1.0723 | |
| 193 | E | D | -2.2686 | |
| 194 | K | D | -1.7725 | |
| 195 | Y | D | 0.0000 | |
| 196 | L | D | 0.0000 | |
| 197 | L | D | 0.0000 | |
| 198 | A | D | 0.0000 | |
| 199 | V | D | 0.0000 | |
| 200 | D | D | 0.0000 | |
| 201 | A | D | 0.0000 | |
| 202 | A | D | 0.0000 | |
| 203 | Y | D | 0.0000 | |
| 204 | T | D | 0.0000 | |
| 205 | V | D | -0.5718 | |
| 206 | D | D | -1.9243 | |
| 207 | H | D | 0.0000 | |
| 208 | W | D | -1.0282 | |
| 209 | E | D | -2.0624 | |
| 210 | E | D | -1.7685 | |
| 211 | K | D | -2.4169 | |
| 212 | A | D | -1.4797 | |
| 213 | L | D | -0.5819 | |
| 214 | P | D | 0.0000 | |
| 215 | G | D | 0.0000 | |
| 216 | F | D | 0.2565 | |
| 217 | L | D | 0.0000 | |
| 218 | A | D | 0.0000 | |
| 219 | S | D | -0.3316 | |
| 220 | T | D | 0.0000 | |
| 221 | V | D | -0.2856 | |
| 222 | D | D | -1.0201 | |
| 223 | T | D | 0.0000 | |
| 224 | V | D | 0.0000 | |
| 225 | R | D | -0.9688 | |
| 226 | S | D | 0.0000 | |
| 227 | V | D | 0.0000 | |
| 228 | Q | D | -1.0953 | |
| 229 | K | D | -1.1124 | |
| 230 | L | D | 0.0000 | |
| 231 | R | D | -1.3349 | |
| 232 | A | D | -1.2522 | |
| 233 | L | D | -1.0311 | |
| 234 | A | D | 0.0000 | |
| 235 | E | D | -2.2596 | |
| 236 | H | D | -1.6561 | |
| 237 | E | D | -2.1248 | |
| 238 | E | D | -2.9063 | |
| 239 | A | D | -2.0294 | |
| 240 | H | D | -1.4604 | |
| 241 | V | D | -0.3857 | |
| 242 | V | D | 0.0000 | |
| 243 | T | D | 0.0000 | |
| 244 | G | D | 0.0000 | |
| 245 | H | D | 0.0000 | |
| 246 | D | D | 0.0000 | |
| 247 | P | D | -1.0969 | |
| 248 | D | D | -1.8102 | |
| 249 | A | D | -0.8275 | |
| 250 | W | D | 0.0000 | |
| 251 | P | D | -1.1577 | |
| 252 | S | D | -0.9850 | |
| 253 | F | D | -0.8527 | |
| 254 | K | D | -1.7750 | |
| 255 | Q | D | -1.8419 | |
| 256 | A | D | 0.0000 | |
| 257 | P | D | -0.8715 | |
| 258 | A | D | -0.7055 | |
| 259 | Y | D | -0.6978 | |
| 260 | Y | D | -1.1370 | |
| 261 | D | D | -1.7800 | |
| 1 | I | E | -0.7107 | |
| 2 | R | E | -1.3502 | |
| 3 | L | E | 0.0000 | |
| 4 | Y | E | 0.0000 | |
| 5 | M | E | 0.0000 | |
| 6 | F | E | 0.0000 | |
| 7 | Q | E | -0.5662 | |
| 8 | S | E | 0.0000 | |
| 9 | G | E | 0.0000 | |
| 10 | T | E | -0.9048 | |
| 11 | L | E | 0.0000 | |
| 12 | K | E | -1.7084 | |
| 13 | C | E | -1.0807 | |
| 14 | K | E | -2.0719 | |
| 15 | T | E | -1.6503 | |
| 16 | N | E | -1.9666 | |
| 17 | N | E | -1.0161 | |
| 18 | I | E | 0.0000 | |
| 19 | K | E | -1.2392 | |
| 20 | M | E | -1.0365 | |
| 21 | N | E | -2.0255 | |
| 22 | A | E | -1.8148 | |
| 23 | D | E | -2.6988 | |
| 24 | P | E | -2.1514 | |
| 25 | A | E | -1.0940 | |
| 26 | P | E | -1.1172 | |
| 27 | Y | E | -1.2235 | |
| 28 | E | E | -1.6834 | |
| 29 | I | E | 0.0000 | |
| 30 | P | E | 0.0000 | |
| 31 | V | E | 0.0000 | |
| 32 | P | E | 0.0000 | |
| 33 | W | E | 0.0000 | |
| 34 | Y | E | 0.0000 | |
| 35 | L | E | 0.0000 | |
| 36 | I | E | 0.0000 | |
| 37 | T | E | -0.7959 | |
| 38 | H | E | -0.9602 | |
| 39 | P | E | -1.1243 | |
| 40 | K | E | -2.0515 | |
| 41 | G | E | -1.6088 | |
| 42 | N | E | -1.1158 | |
| 43 | V | E | 0.0000 | |
| 44 | V | E | 0.0000 | |
| 45 | I | E | 0.0000 | |
| 46 | D | E | 0.0000 | |
| 47 | G | E | 0.0000 | |
| 48 | G | E | 0.0000 | |
| 49 | N | E | 0.0000 | |
| 50 | A | E | 0.0000 | |
| 51 | V | E | -0.6733 | |
| 52 | E | E | -1.3205 | |
| 53 | C | E | 0.0000 | |
| 54 | A | E | -1.2415 | |
| 55 | T | E | -1.3543 | |
| 56 | D | E | -2.5602 | |
| 57 | P | E | -2.1177 | |
| 58 | E | E | -2.7208 | |
| 59 | G | E | -2.1386 | |
| 60 | H | E | -1.9456 | |
| 61 | W | E | 0.0000 | |
| 62 | G | E | -1.4278 | |
| 63 | G | E | -0.8088 | |
| 64 | I | E | 0.0176 | |
| 65 | T | E | 0.0000 | |
| 66 | T | E | 0.0365 | |
| 67 | V | E | 0.3231 | |
| 68 | Y | E | -0.0243 | |
| 69 | W | E | -0.2756 | |
| 70 | P | E | 0.0000 | |
| 71 | D | E | -1.4537 | |
| 72 | M | E | 0.0000 | |
| 73 | T | E | -1.1215 | |
| 74 | P | E | -1.3446 | |
| 75 | E | E | -2.4899 | |
| 76 | Q | E | -1.5175 | |
| 77 | G | E | 0.0000 | |
| 78 | V | E | 0.0000 | |
| 79 | E | E | -1.5802 | |
| 80 | A | E | -1.7815 | |
| 81 | Q | E | -1.8193 | |
| 82 | L | E | 0.0000 | |
| 83 | Q | E | -2.5953 | |
| 84 | K | E | -2.5872 | |
| 85 | L | E | -1.1611 | |
| 86 | G | E | -1.3681 | |
| 87 | I | E | -1.2122 | |
| 88 | A | E | -1.6593 | |
| 89 | K | E | -2.9536 | |
| 90 | D | E | -2.8844 | |
| 91 | S | E | -1.9612 | |
| 92 | V | E | 0.0000 | |
| 93 | R | E | -1.7130 | |
| 94 | Y | E | 0.0000 | |
| 95 | V | E | 0.0000 | |
| 96 | L | E | 0.0000 | |
| 97 | Q | E | 0.0000 | |
| 98 | S | E | 0.0000 | |
| 99 | H | E | 0.0000 | |
| 100 | L | E | 0.0000 | |
| 101 | H | E | 0.0000 | |
| 102 | L | E | 0.0000 | |
| 103 | D | E | 0.0000 | |
| 104 | H | E | 0.0000 | |
| 105 | T | E | 0.0000 | |
| 106 | G | E | 0.0000 | |
| 107 | A | E | 0.0000 | |
| 108 | I | E | 0.0000 | |
| 109 | G | E | -1.0348 | |
| 110 | R | E | -1.1103 | |
| 111 | F | E | 0.0000 | |
| 112 | P | E | -2.1781 | |
| 113 | K | E | -2.9148 | |
| 114 | A | E | 0.0000 | |
| 115 | T | E | 0.0000 | |
| 116 | H | E | 0.0000 | |
| 117 | I | E | 0.0000 | |
| 118 | V | E | 0.0000 | |
| 119 | Q | E | 0.0000 | |
| 120 | R | E | -0.8331 | |
| 121 | N | E | -1.1670 | |
| 122 | E | E | 0.0000 | |
| 123 | Y | E | 0.0000 | |
| 124 | E | E | -0.5880 | |
| 125 | Y | E | 0.0000 | |
| 126 | A | E | 0.0000 | |
| 127 | F | E | 0.0000 | |
| 128 | T | E | 0.0000 | |
| 129 | P | E | 0.0120 | |
| 130 | D | E | 0.0000 | |
| 131 | W | E | 0.2314 | |
| 132 | F | E | 0.1915 | |
| 133 | A | E | 0.0000 | |
| 134 | A | E | 0.0620 | |
| 135 | G | E | -0.1510 | |
| 136 | G | E | -0.1715 | |
| 137 | Y | E | 0.0000 | |
| 138 | I | E | 0.0000 | |
| 139 | R | E | -1.6474 | |
| 140 | K | E | -2.2457 | |
| 141 | D | E | 0.0000 | |
| 142 | F | E | 0.0000 | |
| 143 | D | E | -1.6144 | |
| 144 | K | E | -1.4118 | |
| 145 | P | E | -1.0017 | |
| 146 | G | E | -1.0840 | |
| 147 | L | E | -1.3483 | |
| 148 | K | E | -1.9931 | |
| 149 | W | E | -0.6508 | |
| 150 | Q | E | -0.3880 | |
| 151 | F | E | -0.1241 | |
| 152 | L | E | -0.6586 | |
| 153 | N | E | -1.4207 | |
| 154 | A | E | 0.0000 | |
| 155 | D | E | -1.8426 | |
| 156 | L | E | 0.1789 | |
| 157 | H | E | -0.9161 | |
| 158 | E | E | -1.5404 | |
| 159 | T | E | -0.3456 | |
| 160 | V | E | 0.8887 | |
| 161 | E | E | 0.2401 | |
| 162 | V | E | 0.1273 | |
| 163 | L | E | 0.0000 | |
| 164 | D | E | 0.0000 | |
| 165 | G | E | -1.1339 | |
| 166 | G | E | -1.5455 | |
| 167 | E | E | -2.0384 | |
| 168 | G | E | 0.0000 | |
| 169 | T | E | -0.8019 | |
| 170 | I | E | 0.0000 | |
| 171 | R | E | -0.4574 | |
| 172 | M | E | 0.0000 | |
| 173 | F | E | 0.0000 | |
| 174 | Y | E | 0.0000 | |
| 175 | T | E | 0.0000 | |
| 176 | P | E | -0.8245 | |
| 177 | G | E | 0.0000 | |
| 178 | H | E | 0.0000 | |
| 179 | A | E | 0.0000 | |
| 180 | P | E | -0.5908 | |
| 181 | G | E | 0.0000 | |
| 182 | H | E | 0.0000 | |
| 183 | Q | E | 0.0000 | |
| 184 | S | E | 0.0000 | |
| 185 | F | E | 0.0000 | |
| 186 | L | E | 0.0000 | |
| 187 | V | E | 0.0000 | |
| 188 | S | E | -1.2885 | |
| 189 | L | E | 0.0000 | |
| 190 | P | E | -1.2045 | |
| 191 | S | E | -1.3219 | |
| 192 | A | E | -1.1176 | |
| 193 | E | E | -2.3219 | |
| 194 | K | E | -1.8703 | |
| 195 | Y | E | 0.0000 | |
| 196 | L | E | 0.0000 | |
| 197 | L | E | 0.0000 | |
| 198 | A | E | 0.0000 | |
| 199 | V | E | 0.0000 | |
| 200 | D | E | 0.0000 | |
| 201 | A | E | 0.0000 | |
| 202 | A | E | 0.0000 | |
| 203 | Y | E | 0.0000 | |
| 204 | T | E | 0.0000 | |
| 205 | V | E | -0.1770 | |
| 206 | D | E | -1.2950 | |
| 207 | H | E | 0.0000 | |
| 208 | W | E | -0.8952 | |
| 209 | E | E | -1.9717 | |
| 210 | E | E | -1.6738 | |
| 211 | K | E | -2.2385 | |
| 212 | A | E | -1.3646 | |
| 213 | L | E | 0.0000 | |
| 214 | P | E | 0.0000 | |
| 215 | G | E | 0.0000 | |
| 216 | F | E | 0.2160 | |
| 217 | L | E | 0.0000 | |
| 218 | A | E | 0.0000 | |
| 219 | S | E | -0.3389 | |
| 220 | T | E | 0.0000 | |
| 221 | V | E | -0.2779 | |
| 222 | D | E | -1.0347 | |
| 223 | T | E | 0.0000 | |
| 224 | V | E | 0.0000 | |
| 225 | R | E | -1.0002 | |
| 226 | S | E | 0.0000 | |
| 227 | V | E | 0.0000 | |
| 228 | Q | E | -1.2089 | |
| 229 | K | E | -0.9822 | |
| 230 | L | E | 0.0000 | |
| 231 | R | E | -1.5415 | |
| 232 | A | E | -1.4145 | |
| 233 | L | E | -1.1886 | |
| 234 | A | E | 0.0000 | |
| 235 | E | E | -2.8577 | |
| 236 | H | E | -1.9157 | |
| 237 | E | E | -2.4241 | |
| 238 | E | E | -3.1568 | |
| 239 | A | E | -2.1965 | |
| 240 | H | E | -1.5316 | |
| 241 | V | E | -0.4385 | |
| 242 | V | E | 0.0000 | |
| 243 | T | E | 0.0000 | |
| 244 | G | E | 0.0000 | |
| 245 | H | E | 0.0000 | |
| 246 | D | E | 0.0000 | |
| 247 | P | E | -1.0558 | |
| 248 | D | E | -1.7616 | |
| 249 | A | E | -0.7504 | |
| 250 | W | E | -0.7967 | |
| 251 | P | E | -1.0779 | |
| 252 | S | E | -0.9173 | |
| 253 | F | E | -0.7527 | |
| 254 | K | E | -1.6223 | |
| 255 | Q | E | -1.7654 | |
| 256 | A | E | 0.0000 | |
| 257 | P | E | -0.8369 | |
| 258 | A | E | -0.6636 | |
| 259 | Y | E | -0.7715 | |
| 260 | Y | E | -1.3475 | |
| 261 | D | E | -2.2624 | |
| 1 | I | F | -0.7112 | |
| 2 | R | F | -1.3355 | |
| 3 | L | F | 0.0000 | |
| 4 | Y | F | 0.0000 | |
| 5 | M | F | 0.0000 | |
| 6 | F | F | 0.0000 | |
| 7 | Q | F | -0.5857 | |
| 8 | S | F | 0.0000 | |
| 9 | G | F | 0.0000 | |
| 10 | T | F | -0.9177 | |
| 11 | L | F | 0.0000 | |
| 12 | K | F | -1.7005 | |
| 13 | C | F | 0.0000 | |
| 14 | K | F | -1.9550 | |
| 15 | T | F | -1.5820 | |
| 16 | N | F | -1.8900 | |
| 17 | N | F | -0.9592 | |
| 18 | I | F | 0.0000 | |
| 19 | K | F | -1.1468 | |
| 20 | M | F | -0.9810 | |
| 21 | N | F | -2.0129 | |
| 22 | A | F | -1.7707 | |
| 23 | D | F | -2.6712 | |
| 24 | P | F | -2.0990 | |
| 25 | A | F | -1.0458 | |
| 26 | P | F | -1.0735 | |
| 27 | Y | F | -1.1862 | |
| 28 | E | F | -1.7247 | |
| 29 | I | F | 0.0000 | |
| 30 | P | F | 0.0000 | |
| 31 | V | F | 0.0000 | |
| 32 | P | F | 0.0000 | |
| 33 | W | F | 0.0000 | |
| 34 | Y | F | 0.0000 | |
| 35 | L | F | 0.0000 | |
| 36 | I | F | 0.0000 | |
| 37 | T | F | -0.7973 | |
| 38 | H | F | -0.9658 | |
| 39 | P | F | -1.1269 | |
| 40 | K | F | -2.0555 | |
| 41 | G | F | -1.6239 | |
| 42 | N | F | -1.0608 | |
| 43 | V | F | 0.0000 | |
| 44 | V | F | 0.0000 | |
| 45 | I | F | 0.0000 | |
| 46 | D | F | 0.0000 | |
| 47 | G | F | 0.0000 | |
| 48 | G | F | 0.0000 | |
| 49 | N | F | 0.0000 | |
| 50 | A | F | 0.0000 | |
| 51 | V | F | -0.7049 | |
| 52 | E | F | -1.3512 | |
| 53 | C | F | 0.0000 | |
| 54 | A | F | -1.2784 | |
| 55 | T | F | -1.3810 | |
| 56 | D | F | -2.6064 | |
| 57 | P | F | -2.1425 | |
| 58 | E | F | -2.7422 | |
| 59 | G | F | -2.1745 | |
| 60 | H | F | -1.9574 | |
| 61 | W | F | 0.0000 | |
| 62 | G | F | -1.4289 | |
| 63 | G | F | -0.8078 | |
| 64 | I | F | 0.0227 | |
| 65 | T | F | 0.0000 | |
| 66 | T | F | 0.0292 | |
| 67 | V | F | 0.3313 | |
| 68 | Y | F | -0.0218 | |
| 69 | W | F | -0.2946 | |
| 70 | P | F | 0.0000 | |
| 71 | D | F | -1.4662 | |
| 72 | M | F | 0.0000 | |
| 73 | T | F | -1.1815 | |
| 74 | P | F | -1.3747 | |
| 75 | E | F | -2.5307 | |
| 76 | Q | F | -1.6071 | |
| 77 | G | F | 0.0000 | |
| 78 | V | F | 0.0000 | |
| 79 | E | F | -1.4106 | |
| 80 | A | F | -1.7682 | |
| 81 | Q | F | -1.8289 | |
| 82 | L | F | 0.0000 | |
| 83 | Q | F | -2.4829 | |
| 84 | K | F | -2.5965 | |
| 85 | L | F | -1.1924 | |
| 86 | G | F | -1.3176 | |
| 87 | I | F | -1.0673 | |
| 88 | A | F | -1.3737 | |
| 89 | K | F | -2.3652 | |
| 90 | D | F | -2.6443 | |
| 91 | S | F | -1.7966 | |
| 92 | V | F | 0.0000 | |
| 93 | R | F | -1.6677 | |
| 94 | Y | F | 0.0000 | |
| 95 | V | F | 0.0000 | |
| 96 | L | F | 0.0000 | |
| 97 | Q | F | 0.0000 | |
| 98 | S | F | 0.0000 | |
| 99 | H | F | 0.0000 | |
| 100 | L | F | 0.0000 | |
| 101 | H | F | 0.0000 | |
| 102 | L | F | 0.0000 | |
| 103 | D | F | 0.0000 | |
| 104 | H | F | 0.0000 | |
| 105 | T | F | 0.0000 | |
| 106 | G | F | 0.0000 | |
| 107 | A | F | 0.0000 | |
| 108 | I | F | 0.0000 | |
| 109 | G | F | -1.0492 | |
| 110 | R | F | -1.0227 | |
| 111 | F | F | 0.0000 | |
| 112 | P | F | -2.0737 | |
| 113 | K | F | -2.8377 | |
| 114 | A | F | 0.0000 | |
| 115 | T | F | 0.0000 | |
| 116 | H | F | 0.0000 | |
| 117 | I | F | 0.0000 | |
| 118 | V | F | 0.0000 | |
| 119 | Q | F | 0.0000 | |
| 120 | R | F | 0.0000 | |
| 121 | N | F | -1.0704 | |
| 122 | E | F | 0.0000 | |
| 123 | Y | F | 0.0000 | |
| 124 | E | F | -0.5184 | |
| 125 | Y | F | 0.0000 | |
| 126 | A | F | 0.0000 | |
| 127 | F | F | 0.0000 | |
| 128 | T | F | 0.0000 | |
| 129 | P | F | 0.0253 | |
| 130 | D | F | 0.0000 | |
| 131 | W | F | 0.2860 | |
| 132 | F | F | 0.1838 | |
| 133 | A | F | 0.0000 | |
| 134 | A | F | 0.0729 | |
| 135 | G | F | -0.1495 | |
| 136 | G | F | -0.1780 | |
| 137 | Y | F | 0.0000 | |
| 138 | I | F | 0.0000 | |
| 139 | R | F | -1.6550 | |
| 140 | K | F | -2.2485 | |
| 141 | D | F | 0.0000 | |
| 142 | F | F | 0.0000 | |
| 143 | D | F | -1.6266 | |
| 144 | K | F | -1.4190 | |
| 145 | P | F | -1.0044 | |
| 146 | G | F | -1.0805 | |
| 147 | L | F | -1.3471 | |
| 148 | K | F | -1.9801 | |
| 149 | W | F | -0.6018 | |
| 150 | Q | F | -0.3538 | |
| 151 | F | F | -0.0383 | |
| 152 | L | F | -0.6337 | |
| 153 | N | F | -1.4311 | |
| 154 | A | F | 0.0000 | |
| 155 | D | F | -1.7441 | |
| 156 | L | F | 0.3011 | |
| 157 | H | F | -0.8473 | |
| 158 | E | F | -1.3938 | |
| 159 | T | F | -0.2611 | |
| 160 | V | F | 0.9729 | |
| 161 | E | F | 0.4347 | |
| 162 | V | F | 0.3185 | |
| 163 | L | F | 0.0000 | |
| 164 | D | F | 0.0000 | |
| 165 | G | F | -1.1206 | |
| 166 | G | F | -1.7323 | |
| 167 | E | F | -2.0206 | |
| 168 | G | F | 0.0000 | |
| 169 | T | F | -0.7794 | |
| 170 | I | F | 0.0000 | |
| 171 | R | F | -0.3263 | |
| 172 | M | F | 0.0000 | |
| 173 | F | F | 0.0000 | |
| 174 | Y | F | 0.0000 | |
| 175 | T | F | 0.0000 | |
| 176 | P | F | -0.8030 | |
| 177 | G | F | 0.0000 | |
| 178 | H | F | 0.0000 | |
| 179 | A | F | 0.0000 | |
| 180 | P | F | -0.5654 | |
| 181 | G | F | 0.0000 | |
| 182 | H | F | 0.0000 | |
| 183 | Q | F | 0.0000 | |
| 184 | S | F | 0.0000 | |
| 185 | F | F | 0.0000 | |
| 186 | L | F | 0.0000 | |
| 187 | V | F | 0.0000 | |
| 188 | S | F | -1.1653 | |
| 189 | L | F | 0.0000 | |
| 190 | P | F | -1.1185 | |
| 191 | S | F | -1.1771 | |
| 192 | A | F | -0.9055 | |
| 193 | E | F | -1.8496 | |
| 194 | K | F | -1.6218 | |
| 195 | Y | F | 0.0000 | |
| 196 | L | F | 0.0000 | |
| 197 | L | F | 0.0000 | |
| 198 | A | F | 0.0000 | |
| 199 | V | F | 0.0000 | |
| 200 | D | F | 0.0000 | |
| 201 | A | F | 0.0000 | |
| 202 | A | F | 0.0000 | |
| 203 | Y | F | 0.0000 | |
| 204 | T | F | 0.0000 | |
| 205 | V | F | -0.2226 | |
| 206 | D | F | -1.2617 | |
| 207 | H | F | 0.0000 | |
| 208 | W | F | -0.9589 | |
| 209 | E | F | -2.1852 | |
| 210 | E | F | -1.7884 | |
| 211 | K | F | -2.2750 | |
| 212 | A | F | -1.3120 | |
| 213 | L | F | -0.4719 | |
| 214 | P | F | 0.0000 | |
| 215 | G | F | 0.0000 | |
| 216 | F | F | 0.2474 | |
| 217 | L | F | 0.0000 | |
| 218 | A | F | 0.0000 | |
| 219 | S | F | -0.3376 | |
| 220 | T | F | 0.0000 | |
| 221 | V | F | -0.2788 | |
| 222 | D | F | -1.0184 | |
| 223 | T | F | 0.0000 | |
| 224 | V | F | 0.0000 | |
| 225 | R | F | -0.9684 | |
| 226 | S | F | 0.0000 | |
| 227 | V | F | 0.0000 | |
| 228 | Q | F | -1.1957 | |
| 229 | K | F | -0.9576 | |
| 230 | L | F | 0.0000 | |
| 231 | R | F | -1.3817 | |
| 232 | A | F | -1.1919 | |
| 233 | L | F | -1.0325 | |
| 234 | A | F | 0.0000 | |
| 235 | E | F | -2.2040 | |
| 236 | H | F | -1.5839 | |
| 237 | E | F | -2.0616 | |
| 238 | E | F | -2.7952 | |
| 239 | A | F | -1.8712 | |
| 240 | H | F | -1.2431 | |
| 241 | V | F | -0.2665 | |
| 242 | V | F | 0.0000 | |
| 243 | T | F | 0.0000 | |
| 244 | G | F | 0.0000 | |
| 245 | H | F | 0.0000 | |
| 246 | D | F | 0.0000 | |
| 247 | P | F | -1.0987 | |
| 248 | D | F | -1.7960 | |
| 249 | A | F | -0.7894 | |
| 250 | W | F | 0.0000 | |
| 251 | P | F | -1.1343 | |
| 252 | S | F | -0.9470 | |
| 253 | F | F | -0.7688 | |
| 254 | K | F | -1.7805 | |
| 255 | Q | F | -1.8394 | |
| 256 | A | F | 0.0000 | |
| 257 | P | F | -0.8629 | |
| 258 | A | F | -0.6828 | |
| 259 | Y | F | -0.7660 | |
| 260 | Y | F | -1.2910 | |
| 261 | D | F | -2.1778 |
Calculations for various pH values
This page contains details and comparisons for all models calculated at different pH points.
Please find suggestions on interpreting the results below. More details can be found in the Tutorial.
The input structure is globular. Max score is recommended for pH analysis.
pH |
Average A4D Score |
Max A4D Score |
|||
| 4.0 | -0.3487 | 1.4038 | View | CSV | PDB |
| 4.5 | -0.4125 | 1.3983 | View | CSV | PDB |
| 5.0 | -0.4886 | 1.3904 | View | CSV | PDB |
| 5.5 | -0.5641 | 1.3843 | View | CSV | PDB |
| 6.0 | -0.6252 | 1.3871 | View | CSV | PDB |
| 6.5 | -0.6607 | 1.407 | View | CSV | PDB |
| 7.0 | -0.6696 | 1.4453 | View | CSV | PDB |
| 7.5 | -0.6609 | 1.4959 | View | CSV | PDB |
| 8.0 | -0.6425 | 1.5523 | View | CSV | PDB |
| 8.5 | -0.6162 | 1.6412 | View | CSV | PDB |
| 9.0 | -0.5802 | 1.7666 | View | CSV | PDB |
ALA alanine
ARG arginine
ASN asparagine
ASP aspartic acid
CYS cysteine
GLN glutamine
GLU glutamic acid
GLY glycine
HIS histidine
ILE isoleucine
LEU leucine
LYS lysine
MET methionine
PHE phenylalanine
PRO proline
SER serine
THR threonine
TRP tryptophan
TYR tyrosine
VAL valine