| Chain sequence(s) |
A: IRLYMFQSGTLKCKTNNIKMNADPAPYEIPVPWYLITHPKGNVVIDGGNAVECATDPEGHWGGITTVYWPDMTPEQGVEAQLQKLGIAKDSVRYVLQSHLHLDHTGAIGRFPKATHIVQRNEYEYAFTPDWFAAGGYIRKDFDKPGLKWQFLNADLHETVYTLDGGEGTIRMFYTPGHAPGHQSFLVSLPSAEKYLLAVDAAYTVDHWEEKALPGFLASTVDTVRSVQKLRALAEHEEAHVVTGHDPDAWPSFKQAPAYYD
C: IRLYMFQSGTLKCKTNNIKMNADPAPYEIPVPWYLITHPKGNVVIDGGNAVECATDPEGHWGGITTVYWPDMTPEQGVEAQLQKLGIAKDSVRYVLQSHLHLDHTGAIGRFPKATHIVQRNEYEYAFTPDWFAAGGYIRKDFDKPGLKWQFLNADLHETVYTLDGGEGTIRMFYTPGHAPGHQSFLVSLPSAEKYLLAVDAAYTVDHWEEKALPGFLASTVDTVRSVQKLRALAEHEEAHVVTGHDPDAWPSFKQAPAYYD B: IRLYMFQSGTLKCKTNNIKMNADPAPYEIPVPWYLITHPKGNVVIDGGNAVECATDPEGHWGGITTVYWPDMTPEQGVEAQLQKLGIAKDSVRYVLQSHLHLDHTGAIGRFPKATHIVQRNEYEYAFTPDWFAAGGYIRKDFDKPGLKWQFLNADLHETVYTLDGGEGTIRMFYTPGHAPGHQSFLVSLPSAEKYLLAVDAAYTVDHWEEKALPGFLASTVDTVRSVQKLRALAEHEEAHVVTGHDPDAWPSFKQAPAYYD E: IRLYMFQSGTLKCKTNNIKMNADPAPYEIPVPWYLITHPKGNVVIDGGNAVECATDPEGHWGGITTVYWPDMTPEQGVEAQLQKLGIAKDSVRYVLQSHLHLDHTGAIGRFPKATHIVQRNEYEYAFTPDWFAAGGYIRKDFDKPGLKWQFLNADLHETVYTLDGGEGTIRMFYTPGHAPGHQSFLVSLPSAEKYLLAVDAAYTVDHWEEKALPGFLASTVDTVRSVQKLRALAEHEEAHVVTGHDPDAWPSFKQAPAYYD D: IRLYMFQSGTLKCKTNNIKMNADPAPYEIPVPWYLITHPKGNVVIDGGNAVECATDPEGHWGGITTVYWPDMTPEQGVEAQLQKLGIAKDSVRYVLQSHLHLDHTGAIGRFPKATHIVQRNEYEYAFTPDWFAAGGYIRKDFDKPGLKWQFLNADLHETVYTLDGGEGTIRMFYTPGHAPGHQSFLVSLPSAEKYLLAVDAAYTVDHWEEKALPGFLASTVDTVRSVQKLRALAEHEEAHVVTGHDPDAWPSFKQAPAYYD F: IRLYMFQSGTLKCKTNNIKMNADPAPYEIPVPWYLITHPKGNVVIDGGNAVECATDPEGHWGGITTVYWPDMTPEQGVEAQLQKLGIAKDSVRYVLQSHLHLDHTGAIGRFPKATHIVQRNEYEYAFTPDWFAAGGYIRKDFDKPGLKWQFLNADLHETVYTLDGGEGTIRMFYTPGHAPGHQSFLVSLPSAEKYLLAVDAAYTVDHWEEKALPGFLASTVDTVRSVQKLRALAEHEEAHVVTGHDPDAWPSFKQAPAYYD 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] (00:00:01)
[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] PDB-Info: The input structure is globular. Max score is recommended for pH analysis. (00:00:08)
[INFO] FoldX: Starting FoldX energy minimization (00:00:08)
[INFO] Analysis: Starting Aggrescan4D on folded.pdb (00:37:36)
[INFO] agg3D: Running pKa-ANI on
/STORAGE/DATA/lcbio/aggreskan/8a6ff88a516a55d/tmp/folded.pdb (00:37:36)
[INFO] Main: Simulation completed successfully. (01:06:04)
|
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 | -1.0466 | |
| 2 | R | A | -1.2774 | |
| 3 | L | A | 0.0000 | |
| 4 | Y | A | 0.0000 | |
| 5 | M | A | 0.0000 | |
| 6 | F | A | 0.0000 | |
| 7 | Q | A | -0.5524 | |
| 8 | S | A | 0.0000 | |
| 9 | G | A | 0.0000 | |
| 10 | T | A | -0.7725 | |
| 11 | L | A | 0.0000 | |
| 12 | K | A | -1.4658 | |
| 13 | C | A | -0.9509 | |
| 14 | K | A | -1.7759 | |
| 15 | T | A | -1.5012 | |
| 16 | N | A | 0.0000 | |
| 17 | N | A | -0.6548 | |
| 18 | I | A | 0.0000 | |
| 19 | K | A | -0.9555 | |
| 20 | M | A | -0.3288 | |
| 21 | N | A | -1.1157 | |
| 22 | A | A | -1.4943 | |
| 23 | D | A | -2.4769 | |
| 24 | P | A | -1.7570 | |
| 25 | A | A | -1.0009 | |
| 26 | P | A | -1.2734 | |
| 27 | Y | A | -1.2023 | |
| 28 | E | A | -1.8209 | |
| 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 | -0.7356 | |
| 38 | H | A | -1.2069 | |
| 39 | P | A | -1.1245 | |
| 40 | K | A | -1.9787 | |
| 41 | G | A | -1.5712 | |
| 42 | N | A | 0.0000 | |
| 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 | -0.5667 | |
| 52 | E | A | -1.2827 | |
| 53 | C | A | 0.0000 | |
| 54 | A | A | -1.0498 | |
| 55 | T | A | -1.3259 | |
| 56 | D | A | -2.5919 | |
| 57 | P | A | -2.1004 | |
| 58 | E | A | -2.7611 | |
| 59 | G | A | -2.1803 | |
| 60 | H | A | -1.9429 | |
| 61 | W | A | 0.0000 | |
| 62 | G | A | -1.4303 | |
| 63 | G | A | -0.7505 | |
| 64 | I | A | 0.0334 | |
| 65 | T | A | -0.2890 | |
| 66 | T | A | 0.0784 | |
| 67 | V | A | 0.5596 | |
| 68 | Y | A | 0.0422 | |
| 69 | W | A | -0.2604 | |
| 70 | P | A | 0.0000 | |
| 71 | D | A | -1.0434 | |
| 72 | M | A | -0.6811 | |
| 73 | T | A | -0.8396 | |
| 74 | P | A | -1.0640 | |
| 75 | E | A | -2.0932 | |
| 76 | Q | A | -1.2716 | |
| 77 | G | A | 0.0000 | |
| 78 | V | A | 0.0000 | |
| 79 | E | A | -1.5656 | |
| 80 | A | A | -1.6640 | |
| 81 | Q | A | -1.7391 | |
| 82 | L | A | 0.0000 | |
| 83 | Q | A | -2.5690 | |
| 84 | K | A | -2.5366 | |
| 85 | L | A | -1.1378 | |
| 86 | G | A | -1.3311 | |
| 87 | I | A | -1.2104 | |
| 88 | A | A | -1.7083 | |
| 89 | K | A | -3.0601 | |
| 90 | D | A | -2.9813 | |
| 91 | S | A | -2.0327 | |
| 92 | V | A | 0.0000 | |
| 93 | R | A | -1.6547 | |
| 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 | -1.0887 | |
| 110 | R | A | -1.1180 | |
| 111 | F | A | 0.0000 | |
| 112 | P | A | -2.1958 | |
| 113 | K | A | -2.9122 | |
| 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 | -0.3503 | |
| 121 | N | A | -0.5935 | |
| 122 | E | A | 0.0000 | |
| 123 | Y | A | -0.0966 | |
| 124 | E | A | -0.5349 | |
| 125 | Y | A | 0.0000 | |
| 126 | A | A | 0.0000 | |
| 127 | F | A | 0.0000 | |
| 128 | T | A | -0.2383 | |
| 129 | P | A | -0.0562 | |
| 130 | D | A | -0.1045 | |
| 131 | W | A | 0.3069 | |
| 132 | F | A | 0.2264 | |
| 133 | A | A | 0.0000 | |
| 134 | A | A | 0.0885 | |
| 135 | G | A | -0.0920 | |
| 136 | G | A | -0.1609 | |
| 137 | Y | A | 0.0000 | |
| 138 | I | A | 0.0000 | |
| 139 | R | A | -1.7758 | |
| 140 | K | A | -2.3683 | |
| 141 | D | A | 0.0000 | |
| 142 | F | A | 0.0000 | |
| 143 | D | A | -2.0334 | |
| 144 | K | A | -1.6116 | |
| 145 | P | A | -1.0947 | |
| 146 | G | A | -1.1208 | |
| 147 | L | A | -1.3972 | |
| 148 | K | A | -2.0511 | |
| 149 | W | A | -0.6659 | |
| 150 | Q | A | -0.3927 | |
| 151 | F | A | 0.3301 | |
| 152 | L | A | 0.3261 | |
| 153 | N | A | -0.1184 | |
| 154 | A | A | 0.0000 | |
| 155 | D | A | -0.0939 | |
| 156 | L | A | 0.9080 | |
| 157 | H | A | 0.0000 | |
| 158 | E | A | 0.0335 | |
| 159 | T | A | 0.5070 | |
| 160 | V | A | 0.8102 | |
| 161 | Y | A | 0.2318 | |
| 162 | T | A | -0.5222 | |
| 163 | L | A | 0.0000 | |
| 164 | D | A | -2.4740 | |
| 165 | G | A | -2.0677 | |
| 166 | G | A | -1.9436 | |
| 167 | E | A | -2.4041 | |
| 168 | G | A | -2.0448 | |
| 169 | T | A | -1.5331 | |
| 170 | I | A | 0.0000 | |
| 171 | R | A | -0.8838 | |
| 172 | M | A | 0.0000 | |
| 173 | F | A | 0.0000 | |
| 174 | Y | A | 0.1100 | |
| 175 | T | A | 0.0000 | |
| 176 | P | A | -0.3607 | |
| 177 | G | A | 0.0000 | |
| 178 | H | A | 0.0000 | |
| 179 | A | A | 0.0000 | |
| 180 | P | A | -0.3366 | |
| 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 | -1.4412 | |
| 189 | L | A | 0.0000 | |
| 190 | P | A | -1.6869 | |
| 191 | S | A | -1.3009 | |
| 192 | A | A | -1.1759 | |
| 193 | E | A | -2.0236 | |
| 194 | K | A | -1.6031 | |
| 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 | -0.1737 | |
| 206 | D | A | -1.2516 | |
| 207 | H | A | 0.0000 | |
| 208 | W | A | -0.8709 | |
| 209 | E | A | -1.9738 | |
| 210 | E | A | -1.6426 | |
| 211 | K | A | -2.2474 | |
| 212 | A | A | -1.1073 | |
| 213 | L | A | -0.2498 | |
| 214 | P | A | 0.0000 | |
| 215 | G | A | 0.0000 | |
| 216 | F | A | 0.3356 | |
| 217 | L | A | 0.0000 | |
| 218 | A | A | 0.0000 | |
| 219 | S | A | -0.2772 | |
| 220 | T | A | 0.0000 | |
| 221 | V | A | -0.2598 | |
| 222 | D | A | -0.9630 | |
| 223 | T | A | 0.0000 | |
| 224 | V | A | 0.0000 | |
| 225 | R | A | -1.0525 | |
| 226 | S | A | 0.0000 | |
| 227 | V | A | 0.0000 | |
| 228 | Q | A | -1.5372 | |
| 229 | K | A | -0.8787 | |
| 230 | L | A | 0.0000 | |
| 231 | R | A | -1.3004 | |
| 232 | A | A | -1.1093 | |
| 233 | L | A | -0.8668 | |
| 234 | A | A | 0.0000 | |
| 235 | E | A | -1.4630 | |
| 236 | H | A | -1.4330 | |
| 237 | E | A | -1.9058 | |
| 238 | E | A | -2.4722 | |
| 239 | A | A | -1.6819 | |
| 240 | H | A | -1.1201 | |
| 241 | V | A | -0.1383 | |
| 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 | -1.1494 | |
| 248 | D | A | -1.7951 | |
| 249 | A | A | -0.7893 | |
| 250 | W | A | 0.0000 | |
| 251 | P | A | -1.0830 | |
| 252 | S | A | -0.8745 | |
| 253 | F | A | -0.6184 | |
| 254 | K | A | -1.4878 | |
| 255 | Q | A | -1.6978 | |
| 256 | A | A | -0.9740 | |
| 257 | P | A | -0.7656 | |
| 258 | A | A | -0.6119 | |
| 259 | Y | A | -0.6628 | |
| 260 | Y | A | -1.2284 | |
| 261 | D | A | -2.1640 | |
| 1 | I | B | -1.0360 | |
| 2 | R | B | -1.2707 | |
| 3 | L | B | 0.0000 | |
| 4 | Y | B | 0.0000 | |
| 5 | M | B | 0.0000 | |
| 6 | F | B | 0.0000 | |
| 7 | Q | B | -0.5630 | |
| 8 | S | B | 0.0000 | |
| 9 | G | B | 0.0000 | |
| 10 | T | B | -1.0170 | |
| 11 | L | B | 0.0000 | |
| 12 | K | B | -1.8110 | |
| 13 | C | B | -1.0771 | |
| 14 | K | B | -1.8063 | |
| 15 | T | B | -1.4998 | |
| 16 | N | B | 0.0000 | |
| 17 | N | B | -0.6121 | |
| 18 | I | B | 0.0000 | |
| 19 | K | B | -0.8178 | |
| 20 | M | B | -0.2675 | |
| 21 | N | B | -1.0988 | |
| 22 | A | B | -1.4534 | |
| 23 | D | B | -2.4555 | |
| 24 | P | B | -1.7318 | |
| 25 | A | B | -0.9874 | |
| 26 | P | B | -1.3327 | |
| 27 | Y | B | -1.3080 | |
| 28 | E | B | -2.1290 | |
| 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 | -0.7410 | |
| 38 | H | B | -1.2203 | |
| 39 | P | B | -1.1289 | |
| 40 | K | B | -1.9908 | |
| 41 | G | B | -1.5872 | |
| 42 | N | B | 0.0000 | |
| 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 | -0.6466 | |
| 52 | E | B | -1.3609 | |
| 53 | C | B | 0.0000 | |
| 54 | A | B | -1.1755 | |
| 55 | T | B | -1.3514 | |
| 56 | D | B | -2.6127 | |
| 57 | P | B | -2.1737 | |
| 58 | E | B | -2.7608 | |
| 59 | G | B | -2.1848 | |
| 60 | H | B | -1.9535 | |
| 61 | W | B | 0.0000 | |
| 62 | G | B | -1.4284 | |
| 63 | G | B | -0.7452 | |
| 64 | I | B | 0.0446 | |
| 65 | T | B | 0.0000 | |
| 66 | T | B | 0.0593 | |
| 67 | V | B | 0.5282 | |
| 68 | Y | B | -0.0473 | |
| 69 | W | B | -0.4417 | |
| 70 | P | B | 0.0000 | |
| 71 | D | B | -1.5579 | |
| 72 | M | B | -0.9114 | |
| 73 | T | B | -0.9326 | |
| 74 | P | B | -1.0684 | |
| 75 | E | B | -2.0541 | |
| 76 | Q | B | -1.3274 | |
| 77 | G | B | 0.0000 | |
| 78 | V | B | 0.0000 | |
| 79 | E | B | -1.4702 | |
| 80 | A | B | -1.6735 | |
| 81 | Q | B | -1.8124 | |
| 82 | L | B | 0.0000 | |
| 83 | Q | B | -2.5261 | |
| 84 | K | B | -2.5721 | |
| 85 | L | B | -1.1996 | |
| 86 | G | B | -1.3216 | |
| 87 | I | B | -1.1252 | |
| 88 | A | B | -1.5193 | |
| 89 | K | B | -2.6832 | |
| 90 | D | B | -2.7874 | |
| 91 | S | B | -1.9169 | |
| 92 | V | B | 0.0000 | |
| 93 | R | B | -1.6570 | |
| 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 | -1.0045 | |
| 110 | R | B | -1.0645 | |
| 111 | F | B | 0.0000 | |
| 112 | P | B | -2.0472 | |
| 113 | K | B | -2.7659 | |
| 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 | -0.4952 | |
| 122 | E | B | 0.0000 | |
| 123 | Y | B | -0.0911 | |
| 124 | E | B | -0.4821 | |
| 125 | Y | B | 0.0000 | |
| 126 | A | B | 0.0000 | |
| 127 | F | B | 0.0000 | |
| 128 | T | B | -0.2267 | |
| 129 | P | B | -0.0569 | |
| 130 | D | B | -0.0884 | |
| 131 | W | B | 0.3539 | |
| 132 | F | B | 0.2214 | |
| 133 | A | B | 0.0000 | |
| 134 | A | B | 0.0979 | |
| 135 | G | B | -0.0736 | |
| 136 | G | B | 0.0000 | |
| 137 | Y | B | 0.0000 | |
| 138 | I | B | 0.0000 | |
| 139 | R | B | -1.7521 | |
| 140 | K | B | -2.3493 | |
| 141 | D | B | 0.0000 | |
| 142 | F | B | 0.0000 | |
| 143 | D | B | -1.9503 | |
| 144 | K | B | -1.5897 | |
| 145 | P | B | -1.0077 | |
| 146 | G | B | -0.9652 | |
| 147 | L | B | -1.0829 | |
| 148 | K | B | -1.4245 | |
| 149 | W | B | -0.4092 | |
| 150 | Q | B | -0.3693 | |
| 151 | F | B | 0.1233 | |
| 152 | L | B | 0.2913 | |
| 153 | N | B | -0.0603 | |
| 154 | A | B | 0.0000 | |
| 155 | D | B | 0.0469 | |
| 156 | L | B | 1.3488 | |
| 157 | H | B | 0.0000 | |
| 158 | E | B | 0.1679 | |
| 159 | T | B | 0.5944 | |
| 160 | V | B | 1.0089 | |
| 161 | Y | B | 0.4173 | |
| 162 | T | B | -0.2838 | |
| 163 | L | B | 0.0000 | |
| 164 | D | B | -2.3553 | |
| 165 | G | B | -2.0803 | |
| 166 | G | B | -1.9506 | |
| 167 | E | B | -2.4070 | |
| 168 | G | B | -2.0444 | |
| 169 | T | B | -1.3874 | |
| 170 | I | B | 0.0000 | |
| 171 | R | B | -0.2715 | |
| 172 | M | B | 0.0000 | |
| 173 | F | B | 0.0000 | |
| 174 | Y | B | 0.0874 | |
| 175 | T | B | 0.0000 | |
| 176 | P | B | -0.4346 | |
| 177 | G | B | 0.0000 | |
| 178 | H | B | 0.0000 | |
| 179 | A | B | 0.0000 | |
| 180 | P | B | -0.3361 | |
| 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 | -1.3405 | |
| 189 | L | B | 0.0000 | |
| 190 | P | B | -1.6844 | |
| 191 | S | B | -1.3049 | |
| 192 | A | B | -1.1842 | |
| 193 | E | B | -2.0290 | |
| 194 | K | B | -1.6436 | |
| 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 | -0.1754 | |
| 206 | D | B | -1.2744 | |
| 207 | H | B | 0.0000 | |
| 208 | W | B | -0.9750 | |
| 209 | E | B | -2.2804 | |
| 210 | E | B | -1.8522 | |
| 211 | K | B | -2.3502 | |
| 212 | A | B | -1.1250 | |
| 213 | L | B | -0.2100 | |
| 214 | P | B | 0.0000 | |
| 215 | G | B | 0.0000 | |
| 216 | F | B | 0.3525 | |
| 217 | L | B | 0.0000 | |
| 218 | A | B | 0.0000 | |
| 219 | S | B | -0.2885 | |
| 220 | T | B | 0.0000 | |
| 221 | V | B | -0.3649 | |
| 222 | D | B | -1.0826 | |
| 223 | T | B | 0.0000 | |
| 224 | V | B | 0.0000 | |
| 225 | R | B | -1.1818 | |
| 226 | S | B | 0.0000 | |
| 227 | V | B | 0.0000 | |
| 228 | Q | B | -1.4577 | |
| 229 | K | B | -0.8307 | |
| 230 | L | B | 0.0000 | |
| 231 | R | B | -1.4359 | |
| 232 | A | B | -1.3088 | |
| 233 | L | B | -1.0410 | |
| 234 | A | B | 0.0000 | |
| 235 | E | B | -2.2456 | |
| 236 | H | B | -1.7399 | |
| 237 | E | B | -2.0418 | |
| 238 | E | B | -2.7196 | |
| 239 | A | B | -1.8495 | |
| 240 | H | B | -1.2403 | |
| 241 | V | B | -0.2335 | |
| 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 | -1.1780 | |
| 248 | D | B | -1.7857 | |
| 249 | A | B | -0.7748 | |
| 250 | W | B | 0.0000 | |
| 251 | P | B | -1.1211 | |
| 252 | S | B | -0.9216 | |
| 253 | F | B | -0.7197 | |
| 254 | K | B | -1.7117 | |
| 255 | Q | B | -1.8070 | |
| 256 | A | B | 0.0000 | |
| 257 | P | B | -0.8223 | |
| 258 | A | B | -0.6748 | |
| 259 | Y | B | -0.7124 | |
| 260 | Y | B | -1.2655 | |
| 261 | D | B | -2.1633 | |
| 1 | I | C | -1.0517 | |
| 2 | R | C | -1.2686 | |
| 3 | L | C | 0.0000 | |
| 4 | Y | C | 0.0000 | |
| 5 | M | C | 0.0000 | |
| 6 | F | C | 0.0000 | |
| 7 | Q | C | -0.5227 | |
| 8 | S | C | 0.0000 | |
| 9 | G | C | 0.0000 | |
| 10 | T | C | -0.8537 | |
| 11 | L | C | 0.0000 | |
| 12 | K | C | -1.5905 | |
| 13 | C | C | -0.9921 | |
| 14 | K | C | -1.8020 | |
| 15 | T | C | -1.5426 | |
| 16 | N | C | 0.0000 | |
| 17 | N | C | -0.5997 | |
| 18 | I | C | 0.0000 | |
| 19 | K | C | -0.9810 | |
| 20 | M | C | -0.3014 | |
| 21 | N | C | -1.1024 | |
| 22 | A | C | -1.5042 | |
| 23 | D | C | -2.4816 | |
| 24 | P | C | -1.7599 | |
| 25 | A | C | -0.9937 | |
| 26 | P | C | -1.3306 | |
| 27 | Y | C | -1.3285 | |
| 28 | E | C | -2.0980 | |
| 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 | -0.7460 | |
| 38 | H | C | -1.2078 | |
| 39 | P | C | -1.1253 | |
| 40 | K | C | -2.0218 | |
| 41 | G | C | -1.5925 | |
| 42 | N | C | 0.0000 | |
| 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 | -0.5130 | |
| 52 | E | C | -1.1981 | |
| 53 | C | C | 0.0000 | |
| 54 | A | C | -1.0518 | |
| 55 | T | C | -1.3135 | |
| 56 | D | C | -2.6040 | |
| 57 | P | C | -2.1056 | |
| 58 | E | C | -2.7682 | |
| 59 | G | C | -2.1855 | |
| 60 | H | C | -1.9339 | |
| 61 | W | C | 0.0000 | |
| 62 | G | C | -1.4417 | |
| 63 | G | C | -0.7290 | |
| 64 | I | C | 0.0815 | |
| 65 | T | C | 0.0000 | |
| 66 | T | C | 0.1453 | |
| 67 | V | C | 0.7073 | |
| 68 | Y | C | 0.0707 | |
| 69 | W | C | -0.2881 | |
| 70 | P | C | 0.0000 | |
| 71 | D | C | -1.1299 | |
| 72 | M | C | -0.7079 | |
| 73 | T | C | -0.8742 | |
| 74 | P | C | -1.0881 | |
| 75 | E | C | -2.1824 | |
| 76 | Q | C | -1.3133 | |
| 77 | G | C | 0.0000 | |
| 78 | V | C | 0.0000 | |
| 79 | E | C | -1.3796 | |
| 80 | A | C | -1.6556 | |
| 81 | Q | C | -1.7439 | |
| 82 | L | C | 0.0000 | |
| 83 | Q | C | -2.4557 | |
| 84 | K | C | -2.5481 | |
| 85 | L | C | -1.1495 | |
| 86 | G | C | -1.2784 | |
| 87 | I | C | -1.1045 | |
| 88 | A | C | -1.4536 | |
| 89 | K | C | -2.4849 | |
| 90 | D | C | -2.8757 | |
| 91 | S | C | -1.9243 | |
| 92 | V | C | 0.0000 | |
| 93 | R | C | -1.5976 | |
| 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 | -1.1196 | |
| 110 | R | C | -1.0177 | |
| 111 | F | C | 0.0000 | |
| 112 | P | C | -2.1078 | |
| 113 | K | C | -2.8623 | |
| 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 | -0.7542 | |
| 122 | E | C | 0.0000 | |
| 123 | Y | C | -0.0869 | |
| 124 | E | C | -0.4633 | |
| 125 | Y | C | -0.2378 | |
| 126 | A | C | 0.0000 | |
| 127 | F | C | 0.0000 | |
| 128 | T | C | 0.0000 | |
| 129 | P | C | -0.0156 | |
| 130 | D | C | -0.0122 | |
| 131 | W | C | 0.3784 | |
| 132 | F | C | 0.2567 | |
| 133 | A | C | 0.0000 | |
| 134 | A | C | 0.1053 | |
| 135 | G | C | -0.0766 | |
| 136 | G | C | -0.1633 | |
| 137 | Y | C | 0.0000 | |
| 138 | I | C | 0.0000 | |
| 139 | R | C | -1.8942 | |
| 140 | K | C | -2.5096 | |
| 141 | D | C | 0.0000 | |
| 142 | F | C | 0.0000 | |
| 143 | D | C | -2.3408 | |
| 144 | K | C | -2.2332 | |
| 145 | P | C | -1.3943 | |
| 146 | G | C | -1.2695 | |
| 147 | L | C | -1.5700 | |
| 148 | K | C | -2.0523 | |
| 149 | W | C | -0.7171 | |
| 150 | Q | C | -0.4720 | |
| 151 | F | C | 0.1413 | |
| 152 | L | C | 0.1209 | |
| 153 | N | C | -0.4480 | |
| 154 | A | C | 0.0000 | |
| 155 | D | C | -0.8156 | |
| 156 | L | C | 0.9038 | |
| 157 | H | C | 0.0000 | |
| 158 | E | C | -0.1056 | |
| 159 | T | C | 0.4123 | |
| 160 | V | C | 0.9356 | |
| 161 | Y | C | 0.3727 | |
| 162 | T | C | -0.3140 | |
| 163 | L | C | 0.0000 | |
| 164 | D | C | -2.3778 | |
| 165 | G | C | -2.0644 | |
| 166 | G | C | -2.1134 | |
| 167 | E | C | -2.4082 | |
| 168 | G | C | -2.0455 | |
| 169 | T | C | -1.4110 | |
| 170 | I | C | 0.0000 | |
| 171 | R | C | -0.3535 | |
| 172 | M | C | 0.0000 | |
| 173 | F | C | 0.0000 | |
| 174 | Y | C | 0.0000 | |
| 175 | T | C | 0.0000 | |
| 176 | P | C | -0.6033 | |
| 177 | G | C | 0.0000 | |
| 178 | H | C | 0.0000 | |
| 179 | A | C | 0.0000 | |
| 180 | P | C | -0.4435 | |
| 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 | -1.3421 | |
| 189 | L | C | 0.0000 | |
| 190 | P | C | -1.6983 | |
| 191 | S | C | -1.3184 | |
| 192 | A | C | -1.1951 | |
| 193 | E | C | -2.0311 | |
| 194 | K | C | -1.6058 | |
| 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 | -0.0930 | |
| 206 | D | C | -1.2089 | |
| 207 | H | C | 0.0000 | |
| 208 | W | C | -0.8039 | |
| 209 | E | C | -1.8548 | |
| 210 | E | C | -1.5531 | |
| 211 | K | C | -2.2108 | |
| 212 | A | C | -1.0961 | |
| 213 | L | C | -0.2644 | |
| 214 | P | C | 0.0000 | |
| 215 | G | C | 0.0000 | |
| 216 | F | C | 0.3570 | |
| 217 | L | C | 0.0000 | |
| 218 | A | C | 0.0000 | |
| 219 | S | C | -0.2926 | |
| 220 | T | C | 0.0000 | |
| 221 | V | C | -0.3918 | |
| 222 | D | C | -1.1418 | |
| 223 | T | C | 0.0000 | |
| 224 | V | C | 0.0000 | |
| 225 | R | C | -1.3419 | |
| 226 | S | C | 0.0000 | |
| 227 | V | C | 0.0000 | |
| 228 | Q | C | -1.5634 | |
| 229 | K | C | -1.0181 | |
| 230 | L | C | 0.0000 | |
| 231 | R | C | -1.3278 | |
| 232 | A | C | 0.0000 | |
| 233 | L | C | -0.7843 | |
| 234 | A | C | 0.0000 | |
| 235 | E | C | -1.3067 | |
| 236 | H | C | -1.2553 | |
| 237 | E | C | 0.0000 | |
| 238 | E | C | -2.3105 | |
| 239 | A | C | -1.5940 | |
| 240 | H | C | -1.0897 | |
| 241 | V | C | -0.1524 | |
| 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 | -1.1912 | |
| 248 | D | C | -1.7849 | |
| 249 | A | C | -0.7751 | |
| 250 | W | C | 0.0000 | |
| 251 | P | C | -1.1192 | |
| 252 | S | C | -0.9206 | |
| 253 | F | C | -0.7089 | |
| 254 | K | C | -1.6686 | |
| 255 | Q | C | -1.7725 | |
| 256 | A | C | -0.9992 | |
| 257 | P | C | -0.7760 | |
| 258 | A | C | -0.6323 | |
| 259 | Y | C | -0.6522 | |
| 260 | Y | C | -1.2658 | |
| 261 | D | C | -2.1723 | |
| 1 | I | D | -1.0359 | |
| 2 | R | D | -1.2596 | |
| 3 | L | D | 0.0000 | |
| 4 | Y | D | 0.0000 | |
| 5 | M | D | 0.0000 | |
| 6 | F | D | 0.0000 | |
| 7 | Q | D | -0.5632 | |
| 8 | S | D | 0.0000 | |
| 9 | G | D | 0.0000 | |
| 10 | T | D | -0.9904 | |
| 11 | L | D | 0.0000 | |
| 12 | K | D | -1.7193 | |
| 13 | C | D | -1.0268 | |
| 14 | K | D | -1.8240 | |
| 15 | T | D | -1.5304 | |
| 16 | N | D | 0.0000 | |
| 17 | N | D | -0.6559 | |
| 18 | I | D | 0.0000 | |
| 19 | K | D | -0.9583 | |
| 20 | M | D | -0.2913 | |
| 21 | N | D | -1.1269 | |
| 22 | A | D | -1.4980 | |
| 23 | D | D | -2.4824 | |
| 24 | P | D | -1.7645 | |
| 25 | A | D | -0.9996 | |
| 26 | P | D | -1.3151 | |
| 27 | Y | D | -1.2708 | |
| 28 | E | D | -2.0022 | |
| 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 | -0.7385 | |
| 38 | H | D | -1.2143 | |
| 39 | P | D | -1.1210 | |
| 40 | K | D | -1.9929 | |
| 41 | G | D | -1.5983 | |
| 42 | N | D | 0.0000 | |
| 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 | -0.6253 | |
| 52 | E | D | -1.3529 | |
| 53 | C | D | 0.0000 | |
| 54 | A | D | -1.2153 | |
| 55 | T | D | -1.3482 | |
| 56 | D | D | -2.6136 | |
| 57 | P | D | -2.1812 | |
| 58 | E | D | -2.7672 | |
| 59 | G | D | -2.1947 | |
| 60 | H | D | -1.9631 | |
| 61 | W | D | 0.0000 | |
| 62 | G | D | -1.4332 | |
| 63 | G | D | -0.7476 | |
| 64 | I | D | 0.0438 | |
| 65 | T | D | 0.0000 | |
| 66 | T | D | 0.0698 | |
| 67 | V | D | 0.5440 | |
| 68 | Y | D | -0.0421 | |
| 69 | W | D | -0.4065 | |
| 70 | P | D | 0.0000 | |
| 71 | D | D | -1.5727 | |
| 72 | M | D | -0.9770 | |
| 73 | T | D | -1.0377 | |
| 74 | P | D | -1.1908 | |
| 75 | E | D | -2.3334 | |
| 76 | Q | D | -1.4427 | |
| 77 | G | D | 0.0000 | |
| 78 | V | D | 0.0000 | |
| 79 | E | D | -1.4922 | |
| 80 | A | D | -1.7004 | |
| 81 | Q | D | -1.7793 | |
| 82 | L | D | 0.0000 | |
| 83 | Q | D | -2.5627 | |
| 84 | K | D | -2.5744 | |
| 85 | L | D | -1.1747 | |
| 86 | G | D | -1.3377 | |
| 87 | I | D | -1.1750 | |
| 88 | A | D | -1.6445 | |
| 89 | K | D | -2.9499 | |
| 90 | D | D | -2.9296 | |
| 91 | S | D | -2.0157 | |
| 92 | V | D | 0.0000 | |
| 93 | R | D | -1.7360 | |
| 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 | -1.0706 | |
| 110 | R | D | -1.0910 | |
| 111 | F | D | 0.0000 | |
| 112 | P | D | -2.1590 | |
| 113 | K | D | -2.8842 | |
| 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 | -0.3717 | |
| 121 | N | D | -0.6348 | |
| 122 | E | D | 0.0000 | |
| 123 | Y | D | -0.1310 | |
| 124 | E | D | -0.5101 | |
| 125 | Y | D | 0.0000 | |
| 126 | A | D | 0.0000 | |
| 127 | F | D | 0.0000 | |
| 128 | T | D | 0.0000 | |
| 129 | P | D | -0.0303 | |
| 130 | D | D | -0.0966 | |
| 131 | W | D | 0.3752 | |
| 132 | F | D | 0.2352 | |
| 133 | A | D | 0.0000 | |
| 134 | A | D | 0.1174 | |
| 135 | G | D | -0.0662 | |
| 136 | G | D | 0.0000 | |
| 137 | Y | D | 0.0000 | |
| 138 | I | D | 0.0000 | |
| 139 | R | D | -1.7621 | |
| 140 | K | D | -2.3658 | |
| 141 | D | D | 0.0000 | |
| 142 | F | D | 0.0000 | |
| 143 | D | D | -2.0025 | |
| 144 | K | D | -1.6570 | |
| 145 | P | D | -1.0880 | |
| 146 | G | D | -1.0739 | |
| 147 | L | D | -1.2904 | |
| 148 | K | D | -1.8319 | |
| 149 | W | D | -0.5552 | |
| 150 | Q | D | -0.3242 | |
| 151 | F | D | 0.3482 | |
| 152 | L | D | 0.3293 | |
| 153 | N | D | -0.1446 | |
| 154 | A | D | 0.0000 | |
| 155 | D | D | -0.0677 | |
| 156 | L | D | 1.0101 | |
| 157 | H | D | 0.0000 | |
| 158 | E | D | 0.1137 | |
| 159 | T | D | 0.5160 | |
| 160 | V | D | 0.9875 | |
| 161 | Y | D | 0.4062 | |
| 162 | T | D | -0.3026 | |
| 163 | L | D | 0.0000 | |
| 164 | D | D | -2.3944 | |
| 165 | G | D | -2.0755 | |
| 166 | G | D | -1.9455 | |
| 167 | E | D | -2.4021 | |
| 168 | G | D | -2.0470 | |
| 169 | T | D | -1.4019 | |
| 170 | I | D | 0.0000 | |
| 171 | R | D | -0.3317 | |
| 172 | M | D | 0.0000 | |
| 173 | F | D | 0.0000 | |
| 174 | Y | D | 0.1050 | |
| 175 | T | D | 0.0000 | |
| 176 | P | D | -0.3684 | |
| 177 | G | D | 0.0000 | |
| 178 | H | D | 0.0000 | |
| 179 | A | D | 0.0000 | |
| 180 | P | D | -0.3624 | |
| 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 | -1.3548 | |
| 189 | L | D | 0.0000 | |
| 190 | P | D | -1.6892 | |
| 191 | S | D | -1.3138 | |
| 192 | A | D | -1.1981 | |
| 193 | E | D | -2.0626 | |
| 194 | K | D | -1.6310 | |
| 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 | -0.1648 | |
| 206 | D | D | -1.2292 | |
| 207 | H | D | 0.0000 | |
| 208 | W | D | -0.8191 | |
| 209 | E | D | -1.8932 | |
| 210 | E | D | -1.5799 | |
| 211 | K | D | -2.2213 | |
| 212 | A | D | -1.0893 | |
| 213 | L | D | -0.2380 | |
| 214 | P | D | 0.0000 | |
| 215 | G | D | 0.0000 | |
| 216 | F | D | 0.3131 | |
| 217 | L | D | 0.0000 | |
| 218 | A | D | 0.0000 | |
| 219 | S | D | -0.2867 | |
| 220 | T | D | 0.0000 | |
| 221 | V | D | -0.1687 | |
| 222 | D | D | -0.9599 | |
| 223 | T | D | 0.0000 | |
| 224 | V | D | 0.0000 | |
| 225 | R | D | -0.9201 | |
| 226 | S | D | 0.0000 | |
| 227 | V | D | 0.0000 | |
| 228 | Q | D | -1.3079 | |
| 229 | K | D | -0.8339 | |
| 230 | L | D | 0.0000 | |
| 231 | R | D | -1.2501 | |
| 232 | A | D | -1.0683 | |
| 233 | L | D | -0.8631 | |
| 234 | A | D | 0.0000 | |
| 235 | E | D | -1.5941 | |
| 236 | H | D | -1.4417 | |
| 237 | E | D | -1.8611 | |
| 238 | E | D | -2.4927 | |
| 239 | A | D | -1.7051 | |
| 240 | H | D | -1.1441 | |
| 241 | V | D | -0.1594 | |
| 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 | -1.1287 | |
| 248 | D | D | -1.7627 | |
| 249 | A | D | -0.7329 | |
| 250 | W | D | -0.8641 | |
| 251 | P | D | -1.0615 | |
| 252 | S | D | -0.8787 | |
| 253 | F | D | -0.6730 | |
| 254 | K | D | -1.6528 | |
| 255 | Q | D | -1.7762 | |
| 256 | A | D | 0.0000 | |
| 257 | P | D | -0.8040 | |
| 258 | A | D | -0.6596 | |
| 259 | Y | D | -0.6992 | |
| 260 | Y | D | -1.2618 | |
| 261 | D | D | -2.1648 | |
| 1 | I | E | -1.0414 | |
| 2 | R | E | -1.2943 | |
| 3 | L | E | 0.0000 | |
| 4 | Y | E | 0.0000 | |
| 5 | M | E | 0.0000 | |
| 6 | F | E | 0.0000 | |
| 7 | Q | E | -0.6077 | |
| 8 | S | E | 0.0000 | |
| 9 | G | E | 0.0000 | |
| 10 | T | E | -0.9688 | |
| 11 | L | E | 0.0000 | |
| 12 | K | E | -1.7011 | |
| 13 | C | E | -0.9738 | |
| 14 | K | E | -1.7841 | |
| 15 | T | E | -1.5212 | |
| 16 | N | E | 0.0000 | |
| 17 | N | E | -0.6023 | |
| 18 | I | E | 0.0000 | |
| 19 | K | E | -1.0150 | |
| 20 | M | E | -0.3110 | |
| 21 | N | E | -1.1355 | |
| 22 | A | E | -1.5253 | |
| 23 | D | E | -2.4993 | |
| 24 | P | E | -1.7668 | |
| 25 | A | E | -0.9893 | |
| 26 | P | E | -1.2904 | |
| 27 | Y | E | -1.2086 | |
| 28 | E | E | -1.9024 | |
| 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 | -0.7413 | |
| 38 | H | E | -1.2056 | |
| 39 | P | E | -1.1213 | |
| 40 | K | E | -1.9795 | |
| 41 | G | E | -1.5712 | |
| 42 | N | E | 0.0000 | |
| 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 | -0.7844 | |
| 52 | E | E | -1.6332 | |
| 53 | C | E | 0.0000 | |
| 54 | A | E | -1.2942 | |
| 55 | T | E | -1.4367 | |
| 56 | D | E | -2.6843 | |
| 57 | P | E | -2.2131 | |
| 58 | E | E | -2.7666 | |
| 59 | G | E | -2.1863 | |
| 60 | H | E | 0.0000 | |
| 61 | W | E | 0.0000 | |
| 62 | G | E | -1.4121 | |
| 63 | G | E | -0.7142 | |
| 64 | I | E | 0.0841 | |
| 65 | T | E | 0.0000 | |
| 66 | T | E | 0.1349 | |
| 67 | V | E | 0.6841 | |
| 68 | Y | E | 0.0258 | |
| 69 | W | E | -0.3595 | |
| 70 | P | E | 0.0000 | |
| 71 | D | E | -1.5389 | |
| 72 | M | E | -0.9916 | |
| 73 | T | E | -1.0410 | |
| 74 | P | E | -1.2081 | |
| 75 | E | E | -2.2352 | |
| 76 | Q | E | -1.4532 | |
| 77 | G | E | 0.0000 | |
| 78 | V | E | 0.0000 | |
| 79 | E | E | -1.5706 | |
| 80 | A | E | -1.7016 | |
| 81 | Q | E | -1.7690 | |
| 82 | L | E | 0.0000 | |
| 83 | Q | E | -2.5727 | |
| 84 | K | E | -2.5447 | |
| 85 | L | E | -1.1383 | |
| 86 | G | E | -1.3331 | |
| 87 | I | E | -1.2102 | |
| 88 | A | E | -1.7181 | |
| 89 | K | E | -3.0898 | |
| 90 | D | E | -3.0080 | |
| 91 | S | E | -2.0494 | |
| 92 | V | E | 0.0000 | |
| 93 | R | E | -1.6725 | |
| 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 | -0.9793 | |
| 110 | R | E | -1.1348 | |
| 111 | F | E | 0.0000 | |
| 112 | P | E | -2.0920 | |
| 113 | K | E | -2.7810 | |
| 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 | -0.5559 | |
| 121 | N | E | -0.6243 | |
| 122 | E | E | 0.0000 | |
| 123 | Y | E | -0.2108 | |
| 124 | E | E | -0.6342 | |
| 125 | Y | E | 0.0000 | |
| 126 | A | E | 0.0000 | |
| 127 | F | E | 0.0000 | |
| 128 | T | E | 0.0000 | |
| 129 | P | E | -0.0882 | |
| 130 | D | E | -0.1073 | |
| 131 | W | E | 0.3499 | |
| 132 | F | E | 0.2358 | |
| 133 | A | E | 0.0000 | |
| 134 | A | E | 0.0937 | |
| 135 | G | E | -0.0781 | |
| 136 | G | E | -0.1716 | |
| 137 | Y | E | 0.0000 | |
| 138 | I | E | 0.0000 | |
| 139 | R | E | -1.7576 | |
| 140 | K | E | -2.3471 | |
| 141 | D | E | 0.0000 | |
| 142 | F | E | 0.0000 | |
| 143 | D | E | -1.9949 | |
| 144 | K | E | -1.6562 | |
| 145 | P | E | -1.0058 | |
| 146 | G | E | -0.9123 | |
| 147 | L | E | -0.9580 | |
| 148 | K | E | -1.1285 | |
| 149 | W | E | -0.3228 | |
| 150 | Q | E | -0.3579 | |
| 151 | F | E | -0.0138 | |
| 152 | L | E | 0.0492 | |
| 153 | N | E | -0.3454 | |
| 154 | A | E | 0.0000 | |
| 155 | D | E | -1.0012 | |
| 156 | L | E | 0.8854 | |
| 157 | H | E | 0.0000 | |
| 158 | E | E | -0.2249 | |
| 159 | T | E | 0.3770 | |
| 160 | V | E | 0.7076 | |
| 161 | Y | E | 0.1641 | |
| 162 | T | E | -0.5751 | |
| 163 | L | E | 0.0000 | |
| 164 | D | E | -2.4799 | |
| 165 | G | E | -2.0694 | |
| 166 | G | E | -1.9483 | |
| 167 | E | E | -2.4074 | |
| 168 | G | E | -2.0431 | |
| 169 | T | E | -1.5662 | |
| 170 | I | E | 0.0000 | |
| 171 | R | E | -0.9860 | |
| 172 | M | E | 0.0000 | |
| 173 | F | E | 0.1381 | |
| 174 | Y | E | 0.0000 | |
| 175 | T | E | 0.0000 | |
| 176 | P | E | -0.5586 | |
| 177 | G | E | 0.0000 | |
| 178 | H | E | 0.0000 | |
| 179 | A | E | 0.0000 | |
| 180 | P | E | -0.4792 | |
| 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 | -1.4781 | |
| 189 | L | E | 0.0000 | |
| 190 | P | E | -1.6824 | |
| 191 | S | E | -1.2973 | |
| 192 | A | E | -1.1795 | |
| 193 | E | E | -2.0424 | |
| 194 | K | E | -1.6568 | |
| 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 | -0.0936 | |
| 206 | D | E | -1.1767 | |
| 207 | H | E | 0.0000 | |
| 208 | W | E | -0.7807 | |
| 209 | E | E | -1.7990 | |
| 210 | E | E | -1.5561 | |
| 211 | K | E | -2.1958 | |
| 212 | A | E | -1.0914 | |
| 213 | L | E | -0.2599 | |
| 214 | P | E | 0.0000 | |
| 215 | G | E | 0.0000 | |
| 216 | F | E | 0.3742 | |
| 217 | L | E | 0.0000 | |
| 218 | A | E | 0.0000 | |
| 219 | S | E | -0.2707 | |
| 220 | T | E | 0.0000 | |
| 221 | V | E | -0.2298 | |
| 222 | D | E | -0.9646 | |
| 223 | T | E | 0.0000 | |
| 224 | V | E | 0.0000 | |
| 225 | R | E | -1.0615 | |
| 226 | S | E | 0.0000 | |
| 227 | V | E | 0.0000 | |
| 228 | Q | E | -1.6035 | |
| 229 | K | E | -0.9616 | |
| 230 | L | E | 0.0000 | |
| 231 | R | E | -1.4732 | |
| 232 | A | E | -1.3989 | |
| 233 | L | E | -1.0916 | |
| 234 | A | E | 0.0000 | |
| 235 | E | E | -2.1568 | |
| 236 | H | E | -1.7514 | |
| 237 | E | E | -2.1695 | |
| 238 | E | E | -2.7450 | |
| 239 | A | E | -1.8690 | |
| 240 | H | E | -1.2282 | |
| 241 | V | E | -0.2151 | |
| 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 | -1.1303 | |
| 248 | D | E | -1.7887 | |
| 249 | A | E | -0.7786 | |
| 250 | W | E | 0.0000 | |
| 251 | P | E | -1.1315 | |
| 252 | S | E | -0.9356 | |
| 253 | F | E | -0.7522 | |
| 254 | K | E | -1.7755 | |
| 255 | Q | E | -1.8473 | |
| 256 | A | E | 0.0000 | |
| 257 | P | E | -0.8150 | |
| 258 | A | E | -0.7060 | |
| 259 | Y | E | -0.7586 | |
| 260 | Y | E | -1.2966 | |
| 261 | D | E | -2.1756 | |
| 1 | I | F | -1.0455 | |
| 2 | R | F | -1.2773 | |
| 3 | L | F | 0.0000 | |
| 4 | Y | F | 0.0000 | |
| 5 | M | F | 0.0000 | |
| 6 | F | F | 0.0000 | |
| 7 | Q | F | -0.5613 | |
| 8 | S | F | 0.0000 | |
| 9 | G | F | 0.0000 | |
| 10 | T | F | -0.8776 | |
| 11 | L | F | 0.0000 | |
| 12 | K | F | -1.5608 | |
| 13 | C | F | 0.0000 | |
| 14 | K | F | -1.2706 | |
| 15 | T | F | -1.2244 | |
| 16 | N | F | 0.0000 | |
| 17 | N | F | -0.4668 | |
| 18 | I | F | 0.0000 | |
| 19 | K | F | -0.7558 | |
| 20 | M | F | -0.2832 | |
| 21 | N | F | -1.1167 | |
| 22 | A | F | -1.3971 | |
| 23 | D | F | -2.3999 | |
| 24 | P | F | -1.6183 | |
| 25 | A | F | -0.8298 | |
| 26 | P | F | -1.0955 | |
| 27 | Y | F | -1.0992 | |
| 28 | E | F | -1.9987 | |
| 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 | -0.7464 | |
| 38 | H | F | -1.2179 | |
| 39 | P | F | -1.1215 | |
| 40 | K | F | -1.9912 | |
| 41 | G | F | -1.5943 | |
| 42 | N | F | 0.0000 | |
| 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 | -0.6175 | |
| 52 | E | F | -1.2494 | |
| 53 | C | F | 0.0000 | |
| 54 | A | F | -1.0999 | |
| 55 | T | F | -1.3122 | |
| 56 | D | F | -2.5785 | |
| 57 | P | F | -2.0944 | |
| 58 | E | F | -2.7578 | |
| 59 | G | F | -2.1770 | |
| 60 | H | F | -1.9335 | |
| 61 | W | F | 0.0000 | |
| 62 | G | F | -1.4340 | |
| 63 | G | F | -0.8038 | |
| 64 | I | F | -0.0694 | |
| 65 | T | F | 0.0000 | |
| 66 | T | F | -0.0712 | |
| 67 | V | F | 0.3908 | |
| 68 | Y | F | 0.0000 | |
| 69 | W | F | -0.4334 | |
| 70 | P | F | 0.0000 | |
| 71 | D | F | -1.1399 | |
| 72 | M | F | -0.7644 | |
| 73 | T | F | -0.9623 | |
| 74 | P | F | -1.2122 | |
| 75 | E | F | -2.4074 | |
| 76 | Q | F | -1.4966 | |
| 77 | G | F | 0.0000 | |
| 78 | V | F | 0.0000 | |
| 79 | E | F | -1.5584 | |
| 80 | A | F | -1.7474 | |
| 81 | Q | F | -1.8128 | |
| 82 | L | F | 0.0000 | |
| 83 | Q | F | -2.5773 | |
| 84 | K | F | -2.5649 | |
| 85 | L | F | -1.1344 | |
| 86 | G | F | -1.3277 | |
| 87 | I | F | -1.1899 | |
| 88 | A | F | -1.6797 | |
| 89 | K | F | -3.0221 | |
| 90 | D | F | -2.9607 | |
| 91 | S | F | -2.0349 | |
| 92 | V | F | 0.0000 | |
| 93 | R | F | -1.7283 | |
| 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 | -1.1020 | |
| 110 | R | F | -1.1057 | |
| 111 | F | F | 0.0000 | |
| 112 | P | F | -2.2000 | |
| 113 | K | F | -2.9275 | |
| 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 | -0.3359 | |
| 121 | N | F | -0.5307 | |
| 122 | E | F | 0.0000 | |
| 123 | Y | F | -0.1057 | |
| 124 | E | F | -0.5617 | |
| 125 | Y | F | 0.0000 | |
| 126 | A | F | 0.0000 | |
| 127 | F | F | 0.0000 | |
| 128 | T | F | -0.2329 | |
| 129 | P | F | -0.0272 | |
| 130 | D | F | -0.0146 | |
| 131 | W | F | 0.4421 | |
| 132 | F | F | 0.2955 | |
| 133 | A | F | 0.0000 | |
| 134 | A | F | 0.1317 | |
| 135 | G | F | -0.0840 | |
| 136 | G | F | 0.0000 | |
| 137 | Y | F | 0.0000 | |
| 138 | I | F | 0.0000 | |
| 139 | R | F | -1.7708 | |
| 140 | K | F | -2.3724 | |
| 141 | D | F | 0.0000 | |
| 142 | F | F | 0.0000 | |
| 143 | D | F | -2.0366 | |
| 144 | K | F | -1.6540 | |
| 145 | P | F | -1.1156 | |
| 146 | G | F | -1.1304 | |
| 147 | L | F | -1.4102 | |
| 148 | K | F | -2.0297 | |
| 149 | W | F | -0.6199 | |
| 150 | Q | F | -0.3508 | |
| 151 | F | F | 0.3624 | |
| 152 | L | F | 0.0000 | |
| 153 | N | F | -0.1664 | |
| 154 | A | F | 0.0000 | |
| 155 | D | F | -0.0189 | |
| 156 | L | F | 1.2461 | |
| 157 | H | F | 0.0000 | |
| 158 | E | F | 0.0259 | |
| 159 | T | F | 0.5091 | |
| 160 | V | F | 0.9396 | |
| 161 | Y | F | 0.3657 | |
| 162 | T | F | -0.3095 | |
| 163 | L | F | 0.0000 | |
| 164 | D | F | -2.3796 | |
| 165 | G | F | -2.0729 | |
| 166 | G | F | -1.9488 | |
| 167 | E | F | -2.4034 | |
| 168 | G | F | -2.0418 | |
| 169 | T | F | -1.4022 | |
| 170 | I | F | 0.0000 | |
| 171 | R | F | -0.3445 | |
| 172 | M | F | 0.0000 | |
| 173 | F | F | 0.0000 | |
| 174 | Y | F | 0.0558 | |
| 175 | T | F | 0.0000 | |
| 176 | P | F | -0.4110 | |
| 177 | G | F | 0.0000 | |
| 178 | H | F | 0.0000 | |
| 179 | A | F | 0.0000 | |
| 180 | P | F | -0.3220 | |
| 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 | -1.3454 | |
| 189 | L | F | 0.0000 | |
| 190 | P | F | -1.6798 | |
| 191 | S | F | -1.2989 | |
| 192 | A | F | -1.1765 | |
| 193 | E | F | -2.0100 | |
| 194 | K | F | -1.5858 | |
| 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 | -0.1516 | |
| 206 | D | F | -1.1659 | |
| 207 | H | F | 0.0000 | |
| 208 | W | F | -0.9176 | |
| 209 | E | F | -2.1614 | |
| 210 | E | F | -1.7327 | |
| 211 | K | F | -2.2723 | |
| 212 | A | F | -1.0823 | |
| 213 | L | F | -0.1990 | |
| 214 | P | F | 0.0000 | |
| 215 | G | F | 0.0000 | |
| 216 | F | F | 0.3589 | |
| 217 | L | F | 0.0000 | |
| 218 | A | F | 0.0000 | |
| 219 | S | F | -0.2860 | |
| 220 | T | F | 0.0000 | |
| 221 | V | F | -0.3632 | |
| 222 | D | F | -1.0877 | |
| 223 | T | F | 0.0000 | |
| 224 | V | F | 0.0000 | |
| 225 | R | F | -1.2702 | |
| 226 | S | F | 0.0000 | |
| 227 | V | F | 0.0000 | |
| 228 | Q | F | -1.6147 | |
| 229 | K | F | -0.9626 | |
| 230 | L | F | 0.0000 | |
| 231 | R | F | -1.4546 | |
| 232 | A | F | -1.3513 | |
| 233 | L | F | -1.0387 | |
| 234 | A | F | 0.0000 | |
| 235 | E | F | -2.1216 | |
| 236 | H | F | -1.6782 | |
| 237 | E | F | -2.0144 | |
| 238 | E | F | -2.6649 | |
| 239 | A | F | -1.7848 | |
| 240 | H | F | -1.1593 | |
| 241 | V | F | -0.1949 | |
| 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 | -1.1601 | |
| 248 | D | F | -1.7587 | |
| 249 | A | F | -0.7271 | |
| 250 | W | F | -0.8468 | |
| 251 | P | F | -1.0415 | |
| 252 | S | F | -0.8555 | |
| 253 | F | F | -0.6263 | |
| 254 | K | F | -1.5557 | |
| 255 | Q | F | -1.7249 | |
| 256 | A | F | -0.9933 | |
| 257 | P | F | -0.7781 | |
| 258 | A | F | -0.6373 | |
| 259 | Y | F | -0.6855 | |
| 260 | Y | F | -1.2479 | |
| 261 | D | F | -2.1643 |
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 | -0.2963 | 2.2895 | View | CSV | PDB |
| 4.5 | -0.36 | 2.1742 | View | CSV | PDB |
| 5.0 | -0.4359 | 2.0418 | View | CSV | PDB |
| 5.5 | -0.5121 | 1.9026 | View | CSV | PDB |
| 6.0 | -0.5756 | 1.7926 | View | CSV | PDB |
| 6.5 | -0.6143 | 1.7629 | View | CSV | PDB |
| 7.0 | -0.6267 | 1.7365 | View | CSV | PDB |
| 7.5 | -0.6214 | 1.713 | View | CSV | PDB |
| 8.0 | -0.6062 | 1.6914 | View | CSV | PDB |
| 8.5 | -0.5828 | 1.6928 | View | CSV | PDB |
| 9.0 | -0.5492 | 1.8135 | 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