| Chain sequence(s) |
A: QEIVMTQSPGTLSLSPGERATLSCRASQSVSMNYLAWFQQKPGQAPRLLIYGASRRATGIPDRISGSGSGTDFTLTISRLEPADFAVYYCQQYGTSPRTFGQGAKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC
C: QVQLQQSGAEVKTPGASVKVSCKASGYTFTSFGVSWIRQAPGQGLEWIGWISAYNGDTYYAQKFQARVTMTTDTSTTTAYMEMRSLRSDDTAVYYCAREPPLFYSSWSLDNWGQGTLVTVSSGSASAPTLFPLVSCENSPSDTSSVAVGCLAQDFLPDSITFSWKYKNNSDISSTRGFPSVLRGGKYAATSQVLLPSKDVMQGTDEHVVCKVQHPNGNKEKNVPLPVIAELPPKVSVFVPPRDGFFGNPRKSKLICQATGFSPRQIQVSWLREGKQVGSGVTTDQVQAEAKESGPTTYKVTSTLTIKESDWLSQSMFTCRVDHRGLTFQQNASSMCVPDQDTAIRVFAIPPSFASIFLTKSTKLTCLVTDLTTYDSVTISWTRQNGEAVKTHTNISESHPNATFSAVGEASICEDDWNSGERFTCTVTHTDLPSPLKQTISRPKGVALHRPDVYLLPPAREQLNLRESATITCLVTGFSPADVFVQWMQRGQPLSPEKYVTSAPMPEPQAPGRYFAHSILTVSEEEWNTGETYTCVVAHEALPNRVTERTVDKSTGKPTLYNVSLVMSDTAGTCY B: QEIVMTQSPGTLSLSPGERATLSCRASQSVSMNYLAWFQQKPGQAPRLLIYGASRRATGIPDRISGSGSGTDFTLTISRLEPADFAVYYCQQYGTSPRTFGQGAKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC D: QVQLQQSGAEVKTPGASVKVSCKASGYTFTSFGVSWIRQAPGQGLEWIGWISAYNGDTYYAQKFQARVTMTTDTSTTTAYMEMRSLRSDDTAVYYCAREPPLFYSSWSLDNWGQGTLVTVSSGSASAPTLFPLVSCENSPSDTSSVAVGCLAQDFLPDSITFSWKYKNNSDISSTRGFPSVLRGGKYAATSQVLLPSKDVMQGTDEHVVCKVQHPNGNKEKNVPLPVIAELPPKVSVFVPPRDGFFGNPRKSKLICQATGFSPRQIQVSWLREGKQVGSGVTTDQVQAEAKESGPTTYKVTSTLTIKESDWLSQSMFTCRVDHRGLTFQQNASSMCVPDQDTAIRVFAIPPSFASIFLTKSTKLTCLVTDLTTYDSVTISWTRQNGEAVKTHTNISESHPNATFSAVGEASICEDDWNSGERFTCTVTHTDLPSPLKQTISRPKGVALHRPDVYLLPPAREQLNLRESATITCLVTGFSPADVFVQWMQRGQPLSPEKYVTSAPMPEPQAPGRYFAHSILTVSEEEWNTGETYTCVVAHEALPNRVTERTVDKSTGKPTLYNVSLVMSDTAGTCY input PDB |
| Selected Chain(s) | A,C,B,D |
| 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] (00:00:00)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:00)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with all chain(s) selected (00:00:00)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:00)
[INFO] PDB-Info: The input structure is globular. Max score is recommended for pH analysis. (00:00:05)
[INFO] FoldX: Starting FoldX energy minimization (00:00:05)
[INFO] Analysis: Starting Aggrescan4D on folded.pdb (00:20:22)
[INFO] agg3D: Running pKa-ANI on
/STORAGE/DATA/lcbio/aggreskan/8ca802be3e61f7c/tmp/folded.pdb (00:20:22)
[INFO] Main: Simulation completed successfully. (00:28:59)
|
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 | Q | A | -2.0461 | |
| 2 | E | A | -2.3185 | |
| 3 | I | A | 0.0000 | |
| 4 | V | A | 0.5107 | |
| 5 | M | A | 0.0000 | |
| 6 | T | A | -0.6265 | |
| 7 | Q | A | 0.0000 | |
| 8 | S | A | -0.8754 | |
| 9 | P | A | -0.5911 | |
| 10 | G | A | -0.9893 | |
| 11 | T | A | -0.5794 | |
| 12 | L | A | -0.2429 | |
| 13 | S | A | -0.4128 | |
| 14 | L | A | -0.8673 | |
| 15 | S | A | -1.4902 | |
| 16 | P | A | -1.7778 | |
| 17 | G | A | -2.4388 | |
| 18 | E | A | -2.9802 | |
| 19 | R | A | -3.3072 | |
| 20 | A | A | 0.0000 | |
| 21 | T | A | -0.5486 | |
| 22 | L | A | 0.0000 | |
| 23 | S | A | -0.8433 | |
| 24 | C | A | 0.0000 | |
| 25 | R | A | -1.9315 | |
| 26 | A | A | 0.0000 | |
| 27 | S | A | -1.0446 | |
| 28 | Q | A | -1.8081 | |
| 29 | S | A | -1.2136 | |
| 30 | V | A | 0.0000 | |
| 31 | S | A | -0.0154 | |
| 32 | M | A | 0.7194 | |
| 33 | N | A | -0.1874 | |
| 34 | Y | A | 0.2021 | |
| 35 | L | A | 0.0000 | |
| 36 | A | A | 0.0000 | |
| 37 | W | A | 0.0000 | |
| 38 | F | A | 0.0000 | |
| 39 | Q | A | 0.0000 | |
| 40 | Q | A | 0.0000 | |
| 41 | K | A | -1.4292 | |
| 42 | P | A | -1.4661 | |
| 43 | G | A | -1.4694 | |
| 44 | Q | A | -2.1590 | |
| 45 | A | A | -1.5219 | |
| 46 | P | A | 0.0000 | |
| 47 | R | A | -1.9348 | |
| 48 | L | A | 0.0000 | |
| 49 | L | A | 0.0000 | |
| 50 | I | A | 0.0000 | |
| 51 | Y | A | -0.8262 | |
| 52 | G | A | -0.6236 | |
| 53 | A | A | 0.0000 | |
| 54 | S | A | -1.5235 | |
| 55 | R | A | -2.3386 | |
| 56 | R | A | -2.1831 | |
| 57 | A | A | 0.0000 | |
| 58 | T | A | -0.8162 | |
| 59 | G | A | -0.8597 | |
| 60 | I | A | 0.0000 | |
| 61 | P | A | -1.3175 | |
| 62 | D | A | -2.2011 | |
| 63 | R | A | -2.0376 | |
| 64 | I | A | 0.0000 | |
| 65 | S | A | -1.2108 | |
| 66 | G | A | -0.8869 | |
| 67 | S | A | -0.9270 | |
| 68 | G | A | -1.1399 | |
| 69 | S | A | -0.9554 | |
| 70 | G | A | -1.0271 | |
| 71 | T | A | -1.6574 | |
| 72 | D | A | -2.0331 | |
| 73 | F | A | 0.0000 | |
| 74 | T | A | -0.7481 | |
| 75 | L | A | 0.0000 | |
| 76 | T | A | -0.8175 | |
| 77 | I | A | 0.0000 | |
| 78 | S | A | -2.4691 | |
| 79 | R | A | -3.4445 | |
| 80 | L | A | 0.0000 | |
| 81 | E | A | -1.9473 | |
| 82 | P | A | -0.6785 | |
| 83 | A | A | -0.3960 | |
| 84 | D | A | 0.0000 | |
| 85 | F | A | -0.1661 | |
| 86 | A | A | 0.0000 | |
| 87 | V | A | -0.4727 | |
| 88 | Y | A | 0.0000 | |
| 89 | Y | A | 0.0000 | |
| 90 | C | A | 0.0000 | |
| 91 | Q | A | 0.0000 | |
| 92 | Q | A | 0.0000 | |
| 93 | Y | A | 0.0000 | |
| 94 | G | A | -0.0411 | |
| 95 | T | A | -0.4851 | |
| 96 | S | A | -0.5608 | |
| 97 | P | A | -0.8740 | |
| 98 | R | A | -0.3814 | |
| 99 | T | A | 0.0000 | |
| 100 | F | A | 0.0120 | |
| 101 | G | A | 0.0000 | |
| 102 | Q | A | -1.4464 | |
| 103 | G | A | -1.1020 | |
| 104 | A | A | 0.0000 | |
| 105 | K | A | -1.0919 | |
| 106 | V | A | 0.0000 | |
| 107 | E | A | 0.0000 | |
| 108 | I | A | -0.5979 | |
| 109 | K | A | -1.2229 | |
| 110 | R | A | -1.0730 | |
| 111 | T | A | -0.5508 | |
| 112 | V | A | -0.3171 | |
| 113 | A | A | -0.3721 | |
| 114 | A | A | -0.1185 | |
| 115 | P | A | 0.0000 | |
| 116 | S | A | -0.1182 | |
| 117 | V | A | 0.0000 | |
| 118 | F | A | -0.1142 | |
| 119 | I | A | 0.0000 | |
| 120 | F | A | 0.0000 | |
| 121 | P | A | -0.2183 | |
| 122 | P | A | 0.0000 | |
| 123 | S | A | -1.5808 | |
| 124 | D | A | -3.0119 | |
| 125 | E | A | -3.1597 | |
| 126 | Q | A | 0.0000 | |
| 127 | L | A | -2.4328 | |
| 128 | K | A | -2.9685 | |
| 129 | S | A | -1.8511 | |
| 130 | G | A | -1.3841 | |
| 131 | T | A | -1.1028 | |
| 132 | A | A | 0.0000 | |
| 133 | S | A | 0.0000 | |
| 134 | V | A | 0.0000 | |
| 135 | V | A | 0.0000 | |
| 136 | C | A | 0.0000 | |
| 137 | L | A | 0.0000 | |
| 138 | L | A | 0.0000 | |
| 139 | N | A | 0.0000 | |
| 140 | N | A | -1.0228 | |
| 141 | F | A | 0.0000 | |
| 142 | Y | A | 0.0000 | |
| 143 | P | A | -1.7047 | |
| 144 | R | A | -2.8793 | |
| 145 | E | A | -2.9920 | |
| 146 | A | A | -2.1196 | |
| 147 | K | A | -2.3785 | |
| 148 | V | A | -1.1468 | |
| 149 | Q | A | -0.6789 | |
| 150 | W | A | 0.0000 | |
| 151 | K | A | -0.4966 | |
| 152 | V | A | 0.0000 | |
| 153 | D | A | -1.6027 | |
| 154 | N | A | -1.2787 | |
| 155 | A | A | -0.2077 | |
| 156 | L | A | 0.7159 | |
| 157 | Q | A | -0.3027 | |
| 158 | S | A | -0.6842 | |
| 159 | G | A | -1.2889 | |
| 160 | N | A | -1.6544 | |
| 161 | S | A | -1.3418 | |
| 162 | Q | A | -1.1861 | |
| 163 | E | A | -1.3939 | |
| 164 | S | A | -0.7886 | |
| 165 | V | A | -0.8256 | |
| 166 | T | A | -1.2933 | |
| 167 | E | A | -2.2476 | |
| 168 | Q | A | -1.8722 | |
| 169 | D | A | -1.8390 | |
| 170 | S | A | -1.6190 | |
| 171 | K | A | -2.1651 | |
| 172 | D | A | -1.6193 | |
| 173 | S | A | -1.5785 | |
| 174 | T | A | 0.0000 | |
| 175 | Y | A | 0.0000 | |
| 176 | S | A | 0.0000 | |
| 177 | L | A | 0.0000 | |
| 178 | S | A | 0.0000 | |
| 179 | S | A | 0.0000 | |
| 180 | T | A | 0.0000 | |
| 181 | L | A | 0.0000 | |
| 182 | T | A | -0.6934 | |
| 183 | L | A | -0.8849 | |
| 184 | S | A | -1.1315 | |
| 185 | K | A | -2.2832 | |
| 186 | A | A | -1.9597 | |
| 187 | D | A | -2.4873 | |
| 188 | Y | A | 0.0000 | |
| 189 | E | A | -3.5156 | |
| 190 | K | A | -3.4968 | |
| 191 | H | A | -2.5643 | |
| 192 | K | A | -2.2917 | |
| 193 | V | A | -0.8450 | |
| 194 | Y | A | 0.0000 | |
| 195 | A | A | 0.0000 | |
| 196 | C | A | 0.0000 | |
| 197 | E | A | -0.7348 | |
| 198 | V | A | 0.0000 | |
| 199 | T | A | -1.0655 | |
| 200 | H | A | 0.0000 | |
| 201 | Q | A | -1.1034 | |
| 202 | G | A | -0.2424 | |
| 203 | L | A | -0.0784 | |
| 204 | S | A | -0.2877 | |
| 205 | S | A | -0.3329 | |
| 206 | P | A | -0.5704 | |
| 207 | V | A | 0.0072 | |
| 208 | T | A | -0.4464 | |
| 209 | K | A | -0.6672 | |
| 210 | S | A | -0.6857 | |
| 211 | F | A | 0.0000 | |
| 212 | N | A | -1.3680 | |
| 213 | R | A | -1.8665 | |
| 214 | G | A | -1.6638 | |
| 215 | E | A | -2.1948 | |
| 216 | C | A | -0.8608 | |
| 1 | Q | B | -1.9089 | |
| 2 | E | B | -2.0380 | |
| 3 | I | B | 0.0000 | |
| 4 | V | B | 0.6952 | |
| 5 | M | B | 0.0000 | |
| 6 | T | B | -0.4034 | |
| 7 | Q | B | 0.0000 | |
| 8 | S | B | -0.6222 | |
| 9 | P | B | -0.4609 | |
| 10 | G | B | -0.7904 | |
| 11 | T | B | -0.3368 | |
| 12 | L | B | -0.0902 | |
| 13 | S | B | -0.3645 | |
| 14 | L | B | -0.7993 | |
| 15 | S | B | -1.3867 | |
| 16 | P | B | -1.6742 | |
| 17 | G | B | -2.3033 | |
| 18 | E | B | -2.7000 | |
| 19 | R | B | -3.1670 | |
| 20 | A | B | 0.0000 | |
| 21 | T | B | -0.5235 | |
| 22 | L | B | 0.0000 | |
| 23 | S | B | -0.7065 | |
| 24 | C | B | 0.0000 | |
| 25 | R | B | -1.4151 | |
| 26 | A | B | 0.0000 | |
| 27 | S | B | -0.9029 | |
| 28 | Q | B | -1.7325 | |
| 29 | S | B | -1.2124 | |
| 30 | V | B | 0.0000 | |
| 31 | S | B | -0.0198 | |
| 32 | M | B | 0.7008 | |
| 33 | N | B | -0.2701 | |
| 34 | Y | B | 0.1669 | |
| 35 | L | B | 0.0000 | |
| 36 | A | B | 0.0000 | |
| 37 | W | B | 0.0000 | |
| 38 | F | B | 0.0000 | |
| 39 | Q | B | -0.5971 | |
| 40 | Q | B | 0.0000 | |
| 41 | K | B | -1.3144 | |
| 42 | P | B | -1.3322 | |
| 43 | G | B | -1.3656 | |
| 44 | Q | B | -1.9140 | |
| 45 | A | B | -1.3387 | |
| 46 | P | B | 0.0000 | |
| 47 | R | B | -1.5320 | |
| 48 | L | B | 0.0000 | |
| 49 | L | B | 0.0000 | |
| 50 | I | B | 0.0000 | |
| 51 | Y | B | -0.8798 | |
| 52 | G | B | -0.6699 | |
| 53 | A | B | 0.0000 | |
| 54 | S | B | -1.5238 | |
| 55 | R | B | -2.3405 | |
| 56 | R | B | -2.0788 | |
| 57 | A | B | 0.0000 | |
| 58 | T | B | -0.7860 | |
| 59 | G | B | -0.7504 | |
| 60 | I | B | -0.8525 | |
| 61 | P | B | -1.2071 | |
| 62 | D | B | -2.1373 | |
| 63 | R | B | -1.9894 | |
| 64 | I | B | 0.0000 | |
| 65 | S | B | -1.1644 | |
| 66 | G | B | -0.8723 | |
| 67 | S | B | -0.9873 | |
| 68 | G | B | -1.2207 | |
| 69 | S | B | -1.0528 | |
| 70 | G | B | -1.0979 | |
| 71 | T | B | -1.7075 | |
| 72 | D | B | -2.3369 | |
| 73 | F | B | 0.0000 | |
| 74 | T | B | -0.7383 | |
| 75 | L | B | 0.0000 | |
| 76 | T | B | -0.7995 | |
| 77 | I | B | 0.0000 | |
| 78 | S | B | -2.3928 | |
| 79 | R | B | -3.3362 | |
| 80 | L | B | 0.0000 | |
| 81 | E | B | -1.8905 | |
| 82 | P | B | -0.6720 | |
| 83 | A | B | -0.3748 | |
| 84 | D | B | 0.0000 | |
| 85 | F | B | -0.0300 | |
| 86 | A | B | 0.0000 | |
| 87 | V | B | -0.0531 | |
| 88 | Y | B | 0.0000 | |
| 89 | Y | B | 0.0000 | |
| 90 | C | B | 0.0000 | |
| 91 | Q | B | 0.0000 | |
| 92 | Q | B | 0.0000 | |
| 93 | Y | B | 0.0000 | |
| 94 | G | B | -0.0522 | |
| 95 | T | B | -0.4348 | |
| 96 | S | B | -0.5255 | |
| 97 | P | B | 0.0000 | |
| 98 | R | B | -0.3228 | |
| 99 | T | B | 0.0000 | |
| 100 | F | B | 0.0277 | |
| 101 | G | B | 0.0000 | |
| 102 | Q | B | -1.3404 | |
| 103 | G | B | 0.0000 | |
| 104 | A | B | 0.0000 | |
| 105 | K | B | -0.4778 | |
| 106 | V | B | 0.0000 | |
| 107 | E | B | 0.0000 | |
| 108 | I | B | -0.5185 | |
| 109 | K | B | -1.1830 | |
| 110 | R | B | -1.0945 | |
| 111 | T | B | -0.6108 | |
| 112 | V | B | -0.4073 | |
| 113 | A | B | -0.4712 | |
| 114 | A | B | -0.1337 | |
| 115 | P | B | 0.0000 | |
| 116 | S | B | -0.1676 | |
| 117 | V | B | 0.0000 | |
| 118 | F | B | -0.1525 | |
| 119 | I | B | 0.0000 | |
| 120 | F | B | 0.0000 | |
| 121 | P | B | -0.2404 | |
| 122 | P | B | 0.0000 | |
| 123 | S | B | -1.5186 | |
| 124 | D | B | -2.9170 | |
| 125 | E | B | -2.9721 | |
| 126 | Q | B | 0.0000 | |
| 127 | L | B | -2.2356 | |
| 128 | K | B | -2.8442 | |
| 129 | S | B | -1.7472 | |
| 130 | G | B | -1.2231 | |
| 131 | T | B | -1.0250 | |
| 132 | A | B | 0.0000 | |
| 133 | S | B | 0.0000 | |
| 134 | V | B | 0.0000 | |
| 135 | V | B | 0.0000 | |
| 136 | C | B | 0.0000 | |
| 137 | L | B | 0.0000 | |
| 138 | L | B | 0.0000 | |
| 139 | N | B | 0.0000 | |
| 140 | N | B | -1.1585 | |
| 141 | F | B | 0.0000 | |
| 142 | Y | B | 0.0000 | |
| 143 | P | B | -1.8546 | |
| 144 | R | B | -3.1795 | |
| 145 | E | B | -3.1142 | |
| 146 | A | B | -2.1438 | |
| 147 | K | B | -2.3321 | |
| 148 | V | B | -1.0793 | |
| 149 | Q | B | -0.6503 | |
| 150 | W | B | 0.0000 | |
| 151 | K | B | -0.5419 | |
| 152 | V | B | 0.0000 | |
| 153 | D | B | -1.6855 | |
| 154 | N | B | -1.3431 | |
| 155 | A | B | -0.2511 | |
| 156 | L | B | 0.6887 | |
| 157 | Q | B | -0.3170 | |
| 158 | S | B | -0.6789 | |
| 159 | G | B | -1.2723 | |
| 160 | N | B | -1.6071 | |
| 161 | S | B | -1.2981 | |
| 162 | Q | B | -1.1683 | |
| 163 | E | B | -1.2175 | |
| 164 | S | B | -0.6925 | |
| 165 | V | B | -0.7654 | |
| 166 | T | B | 0.0000 | |
| 167 | E | B | -2.2608 | |
| 168 | Q | B | -1.8037 | |
| 169 | D | B | -1.7149 | |
| 170 | S | B | -1.5464 | |
| 171 | K | B | -2.1178 | |
| 172 | D | B | -1.5984 | |
| 173 | S | B | 0.0000 | |
| 174 | T | B | 0.0000 | |
| 175 | Y | B | 0.0000 | |
| 176 | S | B | 0.0000 | |
| 177 | L | B | 0.0000 | |
| 178 | S | B | 0.0000 | |
| 179 | S | B | 0.0000 | |
| 180 | T | B | 0.0000 | |
| 181 | L | B | 0.0000 | |
| 182 | T | B | -0.7097 | |
| 183 | L | B | -0.9155 | |
| 184 | S | B | -1.1322 | |
| 185 | K | B | -2.0845 | |
| 186 | A | B | -1.9509 | |
| 187 | D | B | -2.7824 | |
| 188 | Y | B | 0.0000 | |
| 189 | E | B | -3.2695 | |
| 190 | K | B | -3.4251 | |
| 191 | H | B | -2.4425 | |
| 192 | K | B | -2.1933 | |
| 193 | V | B | -0.8837 | |
| 194 | Y | B | 0.0000 | |
| 195 | A | B | 0.0000 | |
| 196 | C | B | 0.0000 | |
| 197 | E | B | -0.7582 | |
| 198 | V | B | 0.0000 | |
| 199 | T | B | -1.0413 | |
| 200 | H | B | 0.0000 | |
| 201 | Q | B | -1.1391 | |
| 202 | G | B | -0.1715 | |
| 203 | L | B | -0.0335 | |
| 204 | S | B | -0.3073 | |
| 205 | S | B | -0.3486 | |
| 206 | P | B | -0.6146 | |
| 207 | V | B | -0.1317 | |
| 208 | T | B | -0.5516 | |
| 209 | K | B | -0.8006 | |
| 210 | S | B | -0.8185 | |
| 211 | F | B | 0.0000 | |
| 212 | N | B | -1.4002 | |
| 213 | R | B | -1.8324 | |
| 214 | G | B | -1.6479 | |
| 215 | E | B | -2.2090 | |
| 216 | C | B | -0.8126 | |
| 1 | Q | C | -1.4695 | |
| 2 | V | C | -1.1168 | |
| 3 | Q | C | -1.7580 | |
| 4 | L | C | 0.0000 | |
| 5 | Q | C | -1.7946 | |
| 6 | Q | C | 0.0000 | |
| 7 | S | C | -0.9472 | |
| 8 | G | C | -0.8393 | |
| 9 | A | C | -0.4185 | |
| 10 | E | C | -0.7948 | |
| 11 | V | C | -0.2384 | |
| 12 | K | C | -0.8578 | |
| 13 | T | C | -0.8008 | |
| 14 | P | C | -1.5176 | |
| 15 | G | C | -1.4172 | |
| 16 | A | C | -1.0404 | |
| 17 | S | C | -1.5465 | |
| 18 | V | C | 0.0000 | |
| 19 | K | C | -1.5879 | |
| 20 | V | C | 0.0000 | |
| 21 | S | C | -0.7387 | |
| 22 | C | C | 0.0000 | |
| 23 | K | C | -1.5066 | |
| 24 | A | C | 0.0000 | |
| 25 | S | C | -1.0919 | |
| 26 | G | C | -1.0006 | |
| 27 | Y | C | -0.3766 | |
| 28 | T | C | -0.0541 | |
| 29 | F | C | 0.0000 | |
| 30 | T | C | 0.2031 | |
| 31 | S | C | 0.4810 | |
| 32 | F | C | 0.6260 | |
| 33 | G | C | 0.0000 | |
| 34 | V | C | 0.0000 | |
| 35 | S | C | 0.0000 | |
| 36 | W | C | 0.0000 | |
| 37 | I | C | 0.0000 | |
| 38 | R | C | 0.0000 | |
| 39 | Q | C | -0.5632 | |
| 40 | A | C | -0.9610 | |
| 41 | P | C | -1.0508 | |
| 42 | G | C | -1.2233 | |
| 43 | Q | C | -1.8626 | |
| 44 | G | C | -1.3292 | |
| 45 | L | C | 0.0000 | |
| 46 | E | C | -0.7857 | |
| 47 | W | C | 0.0000 | |
| 48 | I | C | 0.0000 | |
| 49 | G | C | 0.0000 | |
| 50 | W | C | 0.1192 | |
| 51 | I | C | 0.0000 | |
| 52 | S | C | 0.0000 | |
| 53 | A | C | 0.0000 | |
| 54 | Y | C | 0.3271 | |
| 55 | N | C | -1.3593 | |
| 56 | G | C | -1.5415 | |
| 57 | D | C | -2.0004 | |
| 58 | T | C | -0.7635 | |
| 59 | Y | C | -0.0116 | |
| 60 | Y | C | -0.5520 | |
| 61 | A | C | -1.4915 | |
| 62 | Q | C | -2.5267 | |
| 63 | K | C | -2.6016 | |
| 64 | F | C | 0.0000 | |
| 65 | Q | C | -1.9691 | |
| 66 | A | C | -1.3707 | |
| 67 | R | C | -1.6828 | |
| 68 | V | C | 0.0000 | |
| 69 | T | C | -0.7523 | |
| 70 | M | C | 0.0000 | |
| 71 | T | C | -0.4680 | |
| 72 | T | C | -0.4889 | |
| 73 | D | C | -0.8593 | |
| 74 | T | C | -0.3484 | |
| 75 | S | C | -0.4703 | |
| 76 | T | C | -0.5661 | |
| 77 | T | C | -0.6084 | |
| 78 | T | C | 0.0000 | |
| 79 | A | C | 0.0000 | |
| 80 | Y | C | -0.4483 | |
| 81 | M | C | 0.0000 | |
| 82 | E | C | -1.4961 | |
| 83 | M | C | 0.0000 | |
| 84 | R | C | -2.2990 | |
| 85 | S | C | -1.5773 | |
| 86 | L | C | 0.0000 | |
| 87 | R | C | -2.7203 | |
| 88 | S | C | -2.0204 | |
| 89 | D | C | -2.4387 | |
| 90 | D | C | 0.0000 | |
| 91 | T | C | -0.9451 | |
| 92 | A | C | 0.0000 | |
| 93 | V | C | 0.3411 | |
| 94 | Y | C | 0.0000 | |
| 95 | Y | C | 0.0000 | |
| 96 | C | C | 0.0000 | |
| 97 | A | C | 0.0000 | |
| 98 | R | C | -0.4277 | |
| 99 | E | C | 0.0000 | |
| 100 | P | C | 0.9186 | |
| 101 | P | C | 0.0000 | |
| 102 | L | C | 2.9135 | |
| 103 | F | C | 3.3016 | |
| 104 | Y | C | 2.7429 | |
| 105 | S | C | 1.8253 | |
| 106 | S | C | 0.8583 | |
| 107 | W | C | 0.7111 | |
| 108 | S | C | 0.0000 | |
| 109 | L | C | 0.0000 | |
| 110 | D | C | -1.1534 | |
| 111 | N | C | -1.1695 | |
| 112 | W | C | 0.0000 | |
| 113 | G | C | 0.0000 | |
| 114 | Q | C | -1.8133 | |
| 115 | G | C | -0.8814 | |
| 116 | T | C | 0.0000 | |
| 117 | L | C | -0.0374 | |
| 118 | V | C | 0.0000 | |
| 119 | T | C | 0.0000 | |
| 120 | V | C | 0.0000 | |
| 121 | S | C | 0.0000 | |
| 122 | S | C | -0.7643 | |
| 123 | G | C | -0.7556 | |
| 124 | S | C | -0.5580 | |
| 125 | A | C | -0.6923 | |
| 126 | S | C | -0.8091 | |
| 127 | A | C | -1.3034 | |
| 128 | P | C | 0.0000 | |
| 129 | T | C | -0.8736 | |
| 130 | L | C | 0.0000 | |
| 131 | F | C | 0.0000 | |
| 132 | P | C | -0.7621 | |
| 133 | L | C | 0.0000 | |
| 134 | V | C | 0.0371 | |
| 135 | S | C | -0.5042 | |
| 136 | C | C | -1.2783 | |
| 137 | E | C | -2.2802 | |
| 138 | N | C | -1.6157 | |
| 139 | S | C | -1.4305 | |
| 140 | P | C | -1.1268 | |
| 141 | S | C | -1.5057 | |
| 142 | D | C | -2.2045 | |
| 143 | T | C | -1.0801 | |
| 144 | S | C | -1.1646 | |
| 145 | S | C | -0.7523 | |
| 146 | V | C | 0.0000 | |
| 147 | A | C | 0.0000 | |
| 148 | V | C | 0.0000 | |
| 149 | G | C | 0.0000 | |
| 150 | C | C | 0.0000 | |
| 151 | L | C | 0.0000 | |
| 152 | A | C | 0.0000 | |
| 153 | Q | C | 0.0000 | |
| 154 | D | C | -1.9186 | |
| 155 | F | C | 0.0000 | |
| 156 | L | C | 0.0000 | |
| 157 | P | C | 0.0000 | |
| 158 | D | C | -0.5370 | |
| 159 | S | C | -0.5163 | |
| 160 | I | C | -0.4309 | |
| 161 | T | C | -0.5944 | |
| 162 | F | C | -0.5579 | |
| 163 | S | C | -1.0195 | |
| 164 | W | C | 0.0000 | |
| 165 | K | C | -2.2965 | |
| 166 | Y | C | -2.5288 | |
| 167 | K | C | -3.4884 | |
| 168 | N | C | -2.9926 | |
| 169 | N | C | -2.9370 | |
| 170 | S | C | -2.3748 | |
| 171 | D | C | -2.6641 | |
| 172 | I | C | 0.0000 | |
| 173 | S | C | -0.8151 | |
| 174 | S | C | -0.4485 | |
| 175 | T | C | -0.4746 | |
| 176 | R | C | -0.5026 | |
| 177 | G | C | -0.4453 | |
| 178 | F | C | 0.0000 | |
| 179 | P | C | -0.6182 | |
| 180 | S | C | -0.0904 | |
| 181 | V | C | 0.2248 | |
| 182 | L | C | 0.4395 | |
| 183 | R | C | -0.4933 | |
| 184 | G | C | -0.8729 | |
| 185 | G | C | -0.7338 | |
| 186 | K | C | -1.0518 | |
| 187 | Y | C | 0.0000 | |
| 188 | A | C | 0.0000 | |
| 189 | A | C | 0.0000 | |
| 190 | T | C | 0.0000 | |
| 191 | S | C | 0.0000 | |
| 192 | Q | C | 0.0000 | |
| 193 | V | C | 0.0000 | |
| 194 | L | C | 0.0825 | |
| 195 | L | C | 0.0000 | |
| 196 | P | C | -0.8539 | |
| 197 | S | C | -1.5652 | |
| 198 | K | C | -2.6619 | |
| 199 | D | C | -1.9273 | |
| 200 | V | C | -1.1722 | |
| 201 | M | C | -1.6380 | |
| 202 | Q | C | -2.1959 | |
| 203 | G | C | -1.8473 | |
| 204 | T | C | -1.5061 | |
| 205 | D | C | -2.1940 | |
| 206 | E | C | -2.2310 | |
| 207 | H | C | -1.9728 | |
| 208 | V | C | 0.0000 | |
| 209 | V | C | -2.0197 | |
| 210 | C | C | 0.0000 | |
| 211 | K | C | -2.2671 | |
| 212 | V | C | 0.0000 | |
| 213 | Q | C | -2.3612 | |
| 214 | H | C | 0.0000 | |
| 215 | P | C | -1.2483 | |
| 216 | N | C | -1.6039 | |
| 217 | G | C | -1.7708 | |
| 218 | N | C | -2.9143 | |
| 219 | K | C | -2.9573 | |
| 220 | E | C | -3.2971 | |
| 221 | K | C | -2.2513 | |
| 222 | N | C | -2.4120 | |
| 223 | V | C | 0.0000 | |
| 224 | P | C | -0.8396 | |
| 225 | L | C | 0.0000 | |
| 226 | P | C | -0.0740 | |
| 227 | V | C | 0.7287 | |
| 228 | I | C | 0.0000 | |
| 229 | A | C | -0.4808 | |
| 230 | E | C | -1.3211 | |
| 231 | L | C | -0.7927 | |
| 232 | P | C | -0.7461 | |
| 233 | P | C | 0.0000 | |
| 234 | K | C | -1.1357 | |
| 235 | V | C | 0.0000 | |
| 236 | S | C | -0.9394 | |
| 237 | V | C | 0.0000 | |
| 238 | F | C | 0.0000 | |
| 239 | V | C | 0.0000 | |
| 240 | P | C | 0.0000 | |
| 241 | P | C | -1.2211 | |
| 242 | R | C | -1.8636 | |
| 243 | D | C | -2.4079 | |
| 244 | G | C | -1.4923 | |
| 245 | F | C | -1.2079 | |
| 246 | F | C | -0.3304 | |
| 247 | G | C | -1.2163 | |
| 248 | N | C | -1.9769 | |
| 249 | P | C | -1.8494 | |
| 250 | R | C | -1.9643 | |
| 251 | K | C | -1.7477 | |
| 252 | S | C | 0.0000 | |
| 253 | K | C | -0.7796 | |
| 254 | L | C | 0.0000 | |
| 255 | I | C | 0.0000 | |
| 256 | C | C | 0.0000 | |
| 257 | Q | C | -0.4744 | |
| 258 | A | C | 0.0000 | |
| 259 | T | C | -0.9469 | |
| 260 | G | C | -0.7331 | |
| 261 | F | C | 0.0000 | |
| 262 | S | C | 0.0000 | |
| 263 | P | C | -1.7072 | |
| 264 | R | C | -2.5230 | |
| 265 | Q | C | -2.3361 | |
| 266 | I | C | -1.5539 | |
| 267 | Q | C | -1.6966 | |
| 268 | V | C | -0.6619 | |
| 269 | S | C | -0.7653 | |
| 270 | W | C | 0.0000 | |
| 271 | L | C | -2.2149 | |
| 272 | R | C | -2.4423 | |
| 273 | E | C | -3.0384 | |
| 274 | G | C | -2.4599 | |
| 275 | K | C | -3.1701 | |
| 276 | Q | C | -2.5470 | |
| 277 | V | C | -1.2739 | |
| 278 | G | C | -0.8389 | |
| 279 | S | C | -0.5020 | |
| 280 | G | C | -0.3339 | |
| 281 | V | C | 0.1474 | |
| 282 | T | C | -0.3554 | |
| 283 | T | C | -0.8275 | |
| 284 | D | C | -1.8414 | |
| 285 | Q | C | -2.0262 | |
| 286 | V | C | -1.9240 | |
| 287 | Q | C | -2.2224 | |
| 288 | A | C | -1.6613 | |
| 289 | E | C | -1.2674 | |
| 290 | A | C | -1.2146 | |
| 291 | K | C | -2.0815 | |
| 292 | E | C | -2.5135 | |
| 293 | S | C | -1.6307 | |
| 294 | G | C | -1.5984 | |
| 295 | P | C | -1.4947 | |
| 296 | T | C | -1.4631 | |
| 297 | T | C | 0.0000 | |
| 298 | Y | C | 0.0000 | |
| 299 | K | C | -1.6613 | |
| 300 | V | C | 0.0000 | |
| 301 | T | C | -0.8475 | |
| 302 | S | C | 0.0000 | |
| 303 | T | C | 0.0000 | |
| 304 | L | C | 0.0000 | |
| 305 | T | C | -0.6324 | |
| 306 | I | C | 0.0000 | |
| 307 | K | C | -1.7280 | |
| 308 | E | C | -1.2543 | |
| 309 | S | C | -0.9858 | |
| 310 | D | C | -0.9494 | |
| 311 | W | C | 0.0000 | |
| 312 | L | C | -0.5550 | |
| 313 | S | C | -0.5679 | |
| 314 | Q | C | -1.0373 | |
| 315 | S | C | 0.0000 | |
| 316 | M | C | -1.0860 | |
| 317 | F | C | 0.0000 | |
| 318 | T | C | 0.0000 | |
| 319 | C | C | 0.0000 | |
| 320 | R | C | -1.6227 | |
| 321 | V | C | 0.0000 | |
| 322 | D | C | -1.1175 | |
| 323 | H | C | 0.0000 | |
| 324 | R | C | -2.3714 | |
| 325 | G | C | -0.6832 | |
| 326 | L | C | 0.5107 | |
| 327 | T | C | -0.2881 | |
| 328 | F | C | -0.4670 | |
| 329 | Q | C | -1.7250 | |
| 330 | Q | C | -1.7435 | |
| 331 | N | C | -2.1757 | |
| 332 | A | C | 0.0000 | |
| 333 | S | C | -0.2285 | |
| 334 | S | C | 0.1065 | |
| 335 | M | C | 0.6601 | |
| 336 | C | C | 0.4261 | |
| 337 | V | C | -0.2391 | |
| 338 | P | C | -1.2122 | |
| 339 | D | C | -2.8674 | |
| 340 | Q | C | -2.9983 | |
| 341 | D | C | -2.8599 | |
| 342 | T | C | -1.6764 | |
| 343 | A | C | -1.7842 | |
| 344 | I | C | 0.0000 | |
| 345 | R | C | -1.1177 | |
| 346 | V | C | 0.0000 | |
| 347 | F | C | 0.9360 | |
| 348 | A | C | 0.7248 | |
| 349 | I | C | 1.0867 | |
| 350 | P | C | 0.2658 | |
| 351 | P | C | -0.1708 | |
| 352 | S | C | -0.0040 | |
| 353 | F | C | 0.0000 | |
| 354 | A | C | 0.0643 | |
| 355 | S | C | 0.0449 | |
| 356 | I | C | -0.3306 | |
| 357 | F | C | 0.0657 | |
| 358 | L | C | 0.8163 | |
| 359 | T | C | -0.2827 | |
| 360 | K | C | -1.2832 | |
| 361 | S | C | -0.8530 | |
| 362 | T | C | 0.0000 | |
| 363 | K | C | -0.8883 | |
| 364 | L | C | 0.0000 | |
| 365 | T | C | 0.1735 | |
| 366 | C | C | 0.0000 | |
| 367 | L | C | 0.8410 | |
| 368 | V | C | 0.0000 | |
| 369 | T | C | -0.0453 | |
| 370 | D | C | -1.0481 | |
| 371 | L | C | 0.0000 | |
| 372 | T | C | -0.4716 | |
| 373 | T | C | -0.3746 | |
| 374 | Y | C | 0.1471 | |
| 375 | D | C | -1.3344 | |
| 376 | S | C | -0.8685 | |
| 377 | V | C | -0.2645 | |
| 378 | T | C | -0.2039 | |
| 379 | I | C | 0.0000 | |
| 380 | S | C | -0.8464 | |
| 381 | W | C | 0.0000 | |
| 382 | T | C | -1.9665 | |
| 383 | R | C | -2.8642 | |
| 384 | Q | C | -3.3071 | |
| 385 | N | C | -3.0821 | |
| 386 | G | C | -2.6785 | |
| 387 | E | C | -2.9599 | |
| 388 | A | C | -1.7344 | |
| 389 | V | C | -1.4023 | |
| 390 | K | C | -2.1235 | |
| 391 | T | C | -1.5960 | |
| 392 | H | C | -1.8191 | |
| 393 | T | C | -1.1239 | |
| 394 | N | C | -1.3004 | |
| 395 | I | C | -0.2404 | |
| 396 | S | C | -0.7921 | |
| 397 | E | C | -1.9661 | |
| 398 | S | C | -1.3593 | |
| 399 | H | C | -1.4565 | |
| 400 | P | C | -1.2628 | |
| 401 | N | C | -1.5437 | |
| 402 | A | C | -1.0227 | |
| 403 | T | C | -0.7471 | |
| 404 | F | C | -0.3170 | |
| 405 | S | C | 0.0000 | |
| 406 | A | C | 0.0000 | |
| 407 | V | C | 0.1131 | |
| 408 | G | C | 0.0000 | |
| 409 | E | C | -1.2025 | |
| 410 | A | C | 0.0000 | |
| 411 | S | C | -0.9006 | |
| 412 | I | C | -0.6924 | |
| 413 | C | C | -0.9039 | |
| 414 | E | C | -1.8207 | |
| 415 | D | C | -2.4988 | |
| 416 | D | C | -2.2366 | |
| 417 | W | C | 0.0000 | |
| 418 | N | C | -2.1424 | |
| 419 | S | C | -1.9225 | |
| 420 | G | C | -1.8823 | |
| 421 | E | C | -2.3489 | |
| 422 | R | C | -2.9165 | |
| 423 | F | C | 0.0000 | |
| 424 | T | C | -1.4387 | |
| 425 | C | C | 0.0000 | |
| 426 | T | C | -0.8329 | |
| 427 | V | C | 0.0000 | |
| 428 | T | C | -0.5284 | |
| 429 | H | C | 0.0000 | |
| 430 | T | C | -1.1009 | |
| 431 | D | C | -1.8374 | |
| 432 | L | C | -0.8348 | |
| 433 | P | C | -0.7894 | |
| 434 | S | C | -0.7025 | |
| 435 | P | C | -0.7571 | |
| 436 | L | C | -0.7761 | |
| 437 | K | C | -1.7657 | |
| 438 | Q | C | -0.9456 | |
| 439 | T | C | -1.0688 | |
| 440 | I | C | -0.4160 | |
| 441 | S | C | -1.4833 | |
| 442 | R | C | -1.6705 | |
| 443 | P | C | -1.2985 | |
| 444 | K | C | -2.0503 | |
| 445 | G | C | -0.8733 | |
| 446 | V | C | 0.1710 | |
| 447 | A | C | 0.2723 | |
| 448 | L | C | 0.0779 | |
| 449 | H | C | -1.2917 | |
| 450 | R | C | -2.4975 | |
| 451 | P | C | 0.0000 | |
| 452 | D | C | -1.4530 | |
| 453 | V | C | 0.0000 | |
| 454 | Y | C | 0.0000 | |
| 455 | L | C | 0.0000 | |
| 456 | L | C | 0.0000 | |
| 457 | P | C | -0.8395 | |
| 458 | P | C | 0.0000 | |
| 459 | A | C | -1.4289 | |
| 460 | R | C | -2.4754 | |
| 461 | E | C | -1.7609 | |
| 462 | Q | C | 0.0000 | |
| 463 | L | C | -1.9717 | |
| 464 | N | C | -1.9914 | |
| 465 | L | C | -0.8732 | |
| 466 | R | C | -2.8596 | |
| 467 | E | C | -2.7713 | |
| 468 | S | C | -1.7188 | |
| 469 | A | C | 0.0000 | |
| 470 | T | C | 0.0000 | |
| 471 | I | C | 0.0000 | |
| 472 | T | C | 0.0000 | |
| 473 | C | C | 0.0000 | |
| 474 | L | C | 0.0000 | |
| 475 | V | C | 0.0000 | |
| 476 | T | C | -0.6922 | |
| 477 | G | C | 0.0000 | |
| 478 | F | C | 0.0000 | |
| 479 | S | C | 0.0000 | |
| 480 | P | C | -0.4925 | |
| 481 | A | C | -0.3955 | |
| 482 | D | C | -0.8653 | |
| 483 | V | C | -0.2416 | |
| 484 | F | C | 0.1762 | |
| 485 | V | C | 0.0000 | |
| 486 | Q | C | -0.0717 | |
| 487 | W | C | 0.0000 | |
| 488 | M | C | -1.0426 | |
| 489 | Q | C | -1.6354 | |
| 490 | R | C | -2.5625 | |
| 491 | G | C | -1.7805 | |
| 492 | Q | C | -2.1084 | |
| 493 | P | C | -1.2330 | |
| 494 | L | C | 0.0000 | |
| 495 | S | C | -1.1638 | |
| 496 | P | C | -1.3207 | |
| 497 | E | C | -2.3643 | |
| 498 | K | C | -1.6400 | |
| 499 | Y | C | -0.8227 | |
| 500 | V | C | -0.3046 | |
| 501 | T | C | 0.1955 | |
| 502 | S | C | 0.0000 | |
| 503 | A | C | 0.0718 | |
| 504 | P | C | -0.0836 | |
| 505 | M | C | 0.0856 | |
| 506 | P | C | -0.5714 | |
| 507 | E | C | -1.1005 | |
| 508 | P | C | -1.5144 | |
| 509 | Q | C | -1.7698 | |
| 510 | A | C | -0.9972 | |
| 511 | P | C | -0.9962 | |
| 512 | G | C | -0.9551 | |
| 513 | R | C | -1.1510 | |
| 514 | Y | C | -0.3182 | |
| 515 | F | C | 0.0000 | |
| 516 | A | C | 0.0000 | |
| 517 | H | C | 0.0000 | |
| 518 | S | C | 0.0000 | |
| 519 | I | C | 0.0000 | |
| 520 | L | C | 0.0000 | |
| 521 | T | C | -0.3180 | |
| 522 | V | C | 0.0000 | |
| 523 | S | C | -1.8174 | |
| 524 | E | C | -2.5681 | |
| 525 | E | C | -3.1363 | |
| 526 | E | C | -2.0837 | |
| 527 | W | C | 0.0000 | |
| 528 | N | C | -2.2291 | |
| 529 | T | C | -1.5469 | |
| 530 | G | C | -1.5104 | |
| 531 | E | C | -1.5777 | |
| 532 | T | C | -1.1661 | |
| 533 | Y | C | 0.0000 | |
| 534 | T | C | -0.3602 | |
| 535 | C | C | 0.0000 | |
| 536 | V | C | 0.0000 | |
| 537 | V | C | 0.0000 | |
| 538 | A | C | 0.0000 | |
| 539 | H | C | 0.0000 | |
| 540 | E | C | -2.0484 | |
| 541 | A | C | -1.6003 | |
| 542 | L | C | 0.0000 | |
| 543 | P | C | -1.5623 | |
| 544 | N | C | -1.7617 | |
| 545 | R | C | -2.0062 | |
| 546 | V | C | -0.6604 | |
| 547 | T | C | -0.1566 | |
| 548 | E | C | 0.0000 | |
| 549 | R | C | 0.3053 | |
| 550 | T | C | 0.0000 | |
| 551 | V | C | 0.0000 | |
| 552 | D | C | -1.5094 | |
| 553 | K | C | -2.0696 | |
| 554 | S | C | -1.3748 | |
| 555 | T | C | -1.2997 | |
| 556 | G | C | -1.5389 | |
| 557 | K | C | -2.3255 | |
| 558 | P | C | -0.8813 | |
| 559 | T | C | 0.2414 | |
| 560 | L | C | 1.7373 | |
| 561 | Y | C | 1.7918 | |
| 562 | N | C | 0.6175 | |
| 563 | V | C | 2.0171 | |
| 564 | S | C | 1.3630 | |
| 565 | L | C | 1.9621 | |
| 566 | V | C | 2.3923 | |
| 567 | M | C | 0.9670 | |
| 568 | S | C | -0.0212 | |
| 569 | D | C | -1.4505 | |
| 570 | T | C | -1.1754 | |
| 571 | A | C | -0.6496 | |
| 572 | G | C | -0.3543 | |
| 573 | T | C | 0.4790 | |
| 574 | C | C | 0.8848 | |
| 575 | Y | C | 1.5972 | |
| 1 | Q | D | -1.4559 | |
| 2 | V | D | -1.1109 | |
| 3 | Q | D | -2.0114 | |
| 4 | L | D | 0.0000 | |
| 5 | Q | D | -1.8781 | |
| 6 | Q | D | 0.0000 | |
| 7 | S | D | -1.0304 | |
| 8 | G | D | -0.9176 | |
| 9 | A | D | -0.5509 | |
| 10 | E | D | -1.1047 | |
| 11 | V | D | -0.4802 | |
| 12 | K | D | -0.9857 | |
| 13 | T | D | -0.8697 | |
| 14 | P | D | -1.6120 | |
| 15 | G | D | -1.4512 | |
| 16 | A | D | -1.0709 | |
| 17 | S | D | -1.6218 | |
| 18 | V | D | 0.0000 | |
| 19 | K | D | -1.9462 | |
| 20 | V | D | 0.0000 | |
| 21 | S | D | -0.8118 | |
| 22 | C | D | 0.0000 | |
| 23 | K | D | -1.5419 | |
| 24 | A | D | 0.0000 | |
| 25 | S | D | -1.1582 | |
| 26 | G | D | -1.0087 | |
| 27 | Y | D | -0.3766 | |
| 28 | T | D | -0.0413 | |
| 29 | F | D | 0.0000 | |
| 30 | T | D | 0.1855 | |
| 31 | S | D | 0.4611 | |
| 32 | F | D | 0.5757 | |
| 33 | G | D | 0.0000 | |
| 34 | V | D | 0.0000 | |
| 35 | S | D | 0.0000 | |
| 36 | W | D | 0.0000 | |
| 37 | I | D | 0.0000 | |
| 38 | R | D | 0.0000 | |
| 39 | Q | D | -0.5691 | |
| 40 | A | D | -0.9687 | |
| 41 | P | D | -1.0357 | |
| 42 | G | D | -1.2283 | |
| 43 | Q | D | -1.8556 | |
| 44 | G | D | -1.2921 | |
| 45 | L | D | 0.0000 | |
| 46 | E | D | -0.7632 | |
| 47 | W | D | 0.0000 | |
| 48 | I | D | 0.0000 | |
| 49 | G | D | 0.0000 | |
| 50 | W | D | -0.0165 | |
| 51 | I | D | 0.0000 | |
| 52 | S | D | 0.0000 | |
| 53 | A | D | 0.0000 | |
| 54 | Y | D | 0.4694 | |
| 55 | N | D | -1.3634 | |
| 56 | G | D | -1.5499 | |
| 57 | D | D | -2.0419 | |
| 58 | T | D | -0.8529 | |
| 59 | Y | D | -0.1783 | |
| 60 | Y | D | -0.6416 | |
| 61 | A | D | -1.4945 | |
| 62 | Q | D | -2.5174 | |
| 63 | K | D | -2.6096 | |
| 64 | F | D | 0.0000 | |
| 65 | Q | D | -2.0156 | |
| 66 | A | D | -1.3891 | |
| 67 | R | D | -1.6919 | |
| 68 | V | D | 0.0000 | |
| 69 | T | D | -0.7904 | |
| 70 | M | D | 0.0000 | |
| 71 | T | D | -0.4606 | |
| 72 | T | D | -0.4848 | |
| 73 | D | D | -0.8604 | |
| 74 | T | D | -0.3545 | |
| 75 | S | D | -0.4727 | |
| 76 | T | D | -0.5641 | |
| 77 | T | D | -0.6071 | |
| 78 | T | D | 0.0000 | |
| 79 | A | D | 0.0000 | |
| 80 | Y | D | -0.5090 | |
| 81 | M | D | 0.0000 | |
| 82 | E | D | -1.5902 | |
| 83 | M | D | 0.0000 | |
| 84 | R | D | -2.3550 | |
| 85 | S | D | -1.6313 | |
| 86 | L | D | 0.0000 | |
| 87 | R | D | -2.9979 | |
| 88 | S | D | -2.1522 | |
| 89 | D | D | -2.5357 | |
| 90 | D | D | 0.0000 | |
| 91 | T | D | -1.0954 | |
| 92 | A | D | 0.0000 | |
| 93 | V | D | 0.3184 | |
| 94 | Y | D | 0.0000 | |
| 95 | Y | D | 0.0000 | |
| 96 | C | D | 0.0000 | |
| 97 | A | D | 0.0000 | |
| 98 | R | D | -0.5402 | |
| 99 | E | D | 0.0000 | |
| 100 | P | D | 0.7589 | |
| 101 | P | D | 0.0000 | |
| 102 | L | D | 2.9199 | |
| 103 | F | D | 3.1252 | |
| 104 | Y | D | 2.3779 | |
| 105 | S | D | 1.6375 | |
| 106 | S | D | 0.7017 | |
| 107 | W | D | 0.5630 | |
| 108 | S | D | 0.0000 | |
| 109 | L | D | 0.0000 | |
| 110 | D | D | -1.3734 | |
| 111 | N | D | -1.3171 | |
| 112 | W | D | 0.0000 | |
| 113 | G | D | 0.0000 | |
| 114 | Q | D | -1.8322 | |
| 115 | G | D | -0.8644 | |
| 116 | T | D | 0.0000 | |
| 117 | L | D | -0.1136 | |
| 118 | V | D | 0.0000 | |
| 119 | T | D | 0.0000 | |
| 120 | V | D | 0.0000 | |
| 121 | S | D | -0.9462 | |
| 122 | S | D | -0.8023 | |
| 123 | G | D | -0.7611 | |
| 124 | S | D | -0.5851 | |
| 125 | A | D | -0.7622 | |
| 126 | S | D | -0.8166 | |
| 127 | A | D | -1.3444 | |
| 128 | P | D | 0.0000 | |
| 129 | T | D | -0.9395 | |
| 130 | L | D | 0.0000 | |
| 131 | F | D | 0.0000 | |
| 132 | P | D | -0.7555 | |
| 133 | L | D | 0.0000 | |
| 134 | V | D | 0.0624 | |
| 135 | S | D | -0.4487 | |
| 136 | C | D | -1.1630 | |
| 137 | E | D | -2.0574 | |
| 138 | N | D | -1.1215 | |
| 139 | S | D | 0.0000 | |
| 140 | P | D | -0.9840 | |
| 141 | S | D | -1.3979 | |
| 142 | D | D | -2.1053 | |
| 143 | T | D | -1.0676 | |
| 144 | S | D | -1.1429 | |
| 145 | S | D | -0.7389 | |
| 146 | V | D | 0.0000 | |
| 147 | A | D | 0.0000 | |
| 148 | V | D | 0.0000 | |
| 149 | G | D | 0.0000 | |
| 150 | C | D | 0.0000 | |
| 151 | L | D | 0.0000 | |
| 152 | A | D | 0.0000 | |
| 153 | Q | D | 0.0000 | |
| 154 | D | D | -1.9738 | |
| 155 | F | D | 0.0000 | |
| 156 | L | D | 0.0000 | |
| 157 | P | D | 0.0000 | |
| 158 | D | D | -0.5431 | |
| 159 | S | D | -0.4966 | |
| 160 | I | D | -0.4219 | |
| 161 | T | D | -0.5899 | |
| 162 | F | D | -0.6029 | |
| 163 | S | D | -1.0701 | |
| 164 | W | D | 0.0000 | |
| 165 | K | D | -2.3526 | |
| 166 | Y | D | -2.5531 | |
| 167 | K | D | -3.5073 | |
| 168 | N | D | -3.0029 | |
| 169 | N | D | -2.9507 | |
| 170 | S | D | -2.3837 | |
| 171 | D | D | -2.6778 | |
| 172 | I | D | 0.0000 | |
| 173 | S | D | -0.8136 | |
| 174 | S | D | -0.4367 | |
| 175 | T | D | -0.4707 | |
| 176 | R | D | -0.4930 | |
| 177 | G | D | -0.4624 | |
| 178 | F | D | 0.0000 | |
| 179 | P | D | -0.6096 | |
| 180 | S | D | -0.1490 | |
| 181 | V | D | 0.1036 | |
| 182 | L | D | 0.2810 | |
| 183 | R | D | -0.5511 | |
| 184 | G | D | -0.8767 | |
| 185 | G | D | -0.7267 | |
| 186 | K | D | -1.0551 | |
| 187 | Y | D | -0.5104 | |
| 188 | A | D | 0.0000 | |
| 189 | A | D | 0.0000 | |
| 190 | T | D | 0.0000 | |
| 191 | S | D | 0.0000 | |
| 192 | Q | D | 0.0000 | |
| 193 | V | D | 0.0000 | |
| 194 | L | D | 0.1064 | |
| 195 | L | D | 0.0000 | |
| 196 | P | D | -0.8413 | |
| 197 | S | D | -1.5411 | |
| 198 | K | D | -2.6447 | |
| 199 | D | D | -1.9134 | |
| 200 | V | D | -1.1772 | |
| 201 | M | D | -1.5368 | |
| 202 | Q | D | -2.0853 | |
| 203 | G | D | -1.8543 | |
| 204 | T | D | -1.5167 | |
| 205 | D | D | -2.2090 | |
| 206 | E | D | -2.2297 | |
| 207 | H | D | -1.8142 | |
| 208 | V | D | 0.0000 | |
| 209 | V | D | -2.0924 | |
| 210 | C | D | 0.0000 | |
| 211 | K | D | -2.4187 | |
| 212 | V | D | 0.0000 | |
| 213 | Q | D | -2.4112 | |
| 214 | H | D | 0.0000 | |
| 215 | P | D | -1.2922 | |
| 216 | N | D | -1.6216 | |
| 217 | G | D | -1.7899 | |
| 218 | N | D | -2.9827 | |
| 219 | K | D | -3.0973 | |
| 220 | E | D | -3.4116 | |
| 221 | K | D | -2.3305 | |
| 222 | N | D | -2.4472 | |
| 223 | V | D | 0.0000 | |
| 224 | P | D | -0.8450 | |
| 225 | L | D | 0.0000 | |
| 226 | P | D | 0.0600 | |
| 227 | V | D | 0.8373 | |
| 228 | I | D | 0.0000 | |
| 229 | A | D | -0.3266 | |
| 230 | E | D | -1.1274 | |
| 231 | L | D | -0.6638 | |
| 232 | P | D | -0.6587 | |
| 233 | P | D | 0.0000 | |
| 234 | K | D | -1.4226 | |
| 235 | V | D | 0.0000 | |
| 236 | S | D | -0.9054 | |
| 237 | V | D | 0.0000 | |
| 238 | F | D | 0.0000 | |
| 239 | V | D | 0.0000 | |
| 240 | P | D | 0.0000 | |
| 241 | P | D | -1.4431 | |
| 242 | R | D | -2.5364 | |
| 243 | D | D | -2.7718 | |
| 244 | G | D | -1.8905 | |
| 245 | F | D | 0.0000 | |
| 246 | F | D | -1.1041 | |
| 247 | G | D | -1.5153 | |
| 248 | N | D | -2.0660 | |
| 249 | P | D | -1.8659 | |
| 250 | R | D | -2.0914 | |
| 251 | K | D | -2.2199 | |
| 252 | S | D | -1.5517 | |
| 253 | K | D | -1.0213 | |
| 254 | L | D | 0.0000 | |
| 255 | I | D | 0.0000 | |
| 256 | C | D | 0.0000 | |
| 257 | Q | D | -0.4883 | |
| 258 | A | D | 0.0000 | |
| 259 | T | D | -0.9008 | |
| 260 | G | D | -0.7451 | |
| 261 | F | D | 0.0000 | |
| 262 | S | D | 0.0000 | |
| 263 | P | D | 0.0000 | |
| 264 | R | D | -2.2463 | |
| 265 | Q | D | -2.1418 | |
| 266 | I | D | -1.3545 | |
| 267 | Q | D | -1.5889 | |
| 268 | V | D | -0.6607 | |
| 269 | S | D | -0.7646 | |
| 270 | W | D | 0.0000 | |
| 271 | L | D | -2.2218 | |
| 272 | R | D | -2.4943 | |
| 273 | E | D | -3.0773 | |
| 274 | G | D | -2.4785 | |
| 275 | K | D | -3.1837 | |
| 276 | Q | D | -2.5509 | |
| 277 | V | D | -1.2821 | |
| 278 | G | D | -0.8404 | |
| 279 | S | D | -0.5057 | |
| 280 | G | D | -0.3587 | |
| 281 | V | D | 0.1197 | |
| 282 | T | D | -0.3206 | |
| 283 | T | D | -0.7398 | |
| 284 | D | D | -1.5636 | |
| 285 | Q | D | -1.7502 | |
| 286 | V | D | -1.5084 | |
| 287 | Q | D | -1.5472 | |
| 288 | A | D | -1.2944 | |
| 289 | E | D | -1.0852 | |
| 290 | A | D | -1.1302 | |
| 291 | K | D | -2.0813 | |
| 292 | E | D | -2.5153 | |
| 293 | S | D | -1.6310 | |
| 294 | G | D | -1.5285 | |
| 295 | P | D | -1.3873 | |
| 296 | T | D | -1.3608 | |
| 297 | T | D | 0.0000 | |
| 298 | Y | D | 0.0000 | |
| 299 | K | D | -1.3412 | |
| 300 | V | D | 0.0000 | |
| 301 | T | D | -0.6893 | |
| 302 | S | D | 0.0000 | |
| 303 | T | D | 0.0000 | |
| 304 | L | D | 0.0000 | |
| 305 | T | D | -0.7566 | |
| 306 | I | D | 0.0000 | |
| 307 | K | D | -1.8768 | |
| 308 | E | D | 0.0000 | |
| 309 | S | D | -1.0445 | |
| 310 | D | D | -1.1586 | |
| 311 | W | D | 0.0000 | |
| 312 | L | D | -0.7744 | |
| 313 | S | D | -0.6678 | |
| 314 | Q | D | -1.1148 | |
| 315 | S | D | 0.0000 | |
| 316 | M | D | -1.1047 | |
| 317 | F | D | 0.0000 | |
| 318 | T | D | 0.0000 | |
| 319 | C | D | 0.0000 | |
| 320 | R | D | -1.6529 | |
| 321 | V | D | 0.0000 | |
| 322 | D | D | -0.9457 | |
| 323 | H | D | 0.0000 | |
| 324 | R | D | -1.5050 | |
| 325 | G | D | -0.3077 | |
| 326 | L | D | 0.6907 | |
| 327 | T | D | -0.2007 | |
| 328 | F | D | -0.5614 | |
| 329 | Q | D | -1.8021 | |
| 330 | Q | D | -1.9014 | |
| 331 | N | D | -2.2542 | |
| 332 | A | D | 0.0000 | |
| 333 | S | D | -0.2809 | |
| 334 | S | D | 0.0000 | |
| 335 | M | D | 0.8708 | |
| 336 | C | D | 0.4748 | |
| 337 | V | D | -0.2996 | |
| 338 | P | D | -1.1241 | |
| 339 | D | D | -2.6514 | |
| 340 | Q | D | -3.0565 | |
| 341 | D | D | -2.9428 | |
| 342 | T | D | -1.7852 | |
| 343 | A | D | -1.8785 | |
| 344 | I | D | 0.0000 | |
| 345 | R | D | -1.0991 | |
| 346 | V | D | 0.0000 | |
| 347 | F | D | 0.9909 | |
| 348 | A | D | 0.7430 | |
| 349 | I | D | 1.1281 | |
| 350 | P | D | 0.3165 | |
| 351 | P | D | -0.1335 | |
| 352 | S | D | 0.0234 | |
| 353 | F | D | 0.0000 | |
| 354 | A | D | 0.1260 | |
| 355 | S | D | 0.1017 | |
| 356 | I | D | -0.2609 | |
| 357 | F | D | 0.1175 | |
| 358 | L | D | 0.9585 | |
| 359 | T | D | -0.2025 | |
| 360 | K | D | -1.3208 | |
| 361 | S | D | -0.8548 | |
| 362 | T | D | 0.0000 | |
| 363 | K | D | -0.8567 | |
| 364 | L | D | 0.0000 | |
| 365 | T | D | 0.1736 | |
| 366 | C | D | 0.0000 | |
| 367 | L | D | 0.8588 | |
| 368 | V | D | 0.0000 | |
| 369 | T | D | -0.0265 | |
| 370 | D | D | -1.0359 | |
| 371 | L | D | 0.0000 | |
| 372 | T | D | -0.4647 | |
| 373 | T | D | -0.3725 | |
| 374 | Y | D | 0.1257 | |
| 375 | D | D | -1.3430 | |
| 376 | S | D | -0.8741 | |
| 377 | V | D | -0.2629 | |
| 378 | T | D | -0.2049 | |
| 379 | I | D | 0.0000 | |
| 380 | S | D | -0.8584 | |
| 381 | W | D | 0.0000 | |
| 382 | T | D | -1.9645 | |
| 383 | R | D | -2.8659 | |
| 384 | Q | D | -3.2851 | |
| 385 | N | D | -3.0850 | |
| 386 | G | D | -2.6766 | |
| 387 | E | D | -2.9771 | |
| 388 | A | D | -1.7484 | |
| 389 | V | D | -1.4196 | |
| 390 | K | D | -2.1347 | |
| 391 | T | D | -1.6288 | |
| 392 | H | D | -1.8591 | |
| 393 | T | D | -1.1594 | |
| 394 | N | D | -1.3167 | |
| 395 | I | D | -0.2289 | |
| 396 | S | D | -0.7870 | |
| 397 | E | D | -1.9564 | |
| 398 | S | D | -1.3488 | |
| 399 | H | D | -1.4257 | |
| 400 | P | D | -1.2530 | |
| 401 | N | D | -1.5276 | |
| 402 | A | D | -1.0110 | |
| 403 | T | D | -0.7317 | |
| 404 | F | D | -0.2967 | |
| 405 | S | D | 0.0000 | |
| 406 | A | D | 0.0000 | |
| 407 | V | D | 0.0839 | |
| 408 | G | D | 0.0000 | |
| 409 | E | D | -1.2896 | |
| 410 | A | D | 0.0000 | |
| 411 | S | D | -0.8772 | |
| 412 | I | D | -0.6445 | |
| 413 | C | D | -0.7835 | |
| 414 | E | D | -1.6693 | |
| 415 | D | D | -2.3508 | |
| 416 | D | D | -2.0177 | |
| 417 | W | D | 0.0000 | |
| 418 | N | D | -1.9106 | |
| 419 | S | D | -1.7684 | |
| 420 | G | D | -1.7501 | |
| 421 | E | D | -2.2577 | |
| 422 | R | D | -2.7491 | |
| 423 | F | D | 0.0000 | |
| 424 | T | D | -1.4589 | |
| 425 | C | D | 0.0000 | |
| 426 | T | D | -0.8811 | |
| 427 | V | D | 0.0000 | |
| 428 | T | D | -0.5191 | |
| 429 | H | D | 0.0000 | |
| 430 | T | D | -1.0905 | |
| 431 | D | D | -1.8204 | |
| 432 | L | D | -0.8129 | |
| 433 | P | D | -0.8050 | |
| 434 | S | D | -0.6387 | |
| 435 | P | D | -0.7500 | |
| 436 | L | D | -0.8398 | |
| 437 | K | D | -1.8523 | |
| 438 | Q | D | -1.1096 | |
| 439 | T | D | -1.0914 | |
| 440 | I | D | -0.3702 | |
| 441 | S | D | -1.3598 | |
| 442 | R | D | -1.4682 | |
| 443 | P | D | -1.2694 | |
| 444 | K | D | -2.0374 | |
| 445 | G | D | -0.8737 | |
| 446 | V | D | 0.1327 | |
| 447 | A | D | 0.3992 | |
| 448 | L | D | 0.3993 | |
| 449 | H | D | -1.0231 | |
| 450 | R | D | -2.3469 | |
| 451 | P | D | 0.0000 | |
| 452 | D | D | -1.1022 | |
| 453 | V | D | 0.0000 | |
| 454 | Y | D | 0.0000 | |
| 455 | L | D | 0.0000 | |
| 456 | L | D | 0.0000 | |
| 457 | P | D | -0.9191 | |
| 458 | P | D | 0.0000 | |
| 459 | A | D | 0.0000 | |
| 460 | R | D | -2.3629 | |
| 461 | E | D | -1.7435 | |
| 462 | Q | D | 0.0000 | |
| 463 | L | D | -1.7873 | |
| 464 | N | D | -1.7051 | |
| 465 | L | D | -0.6833 | |
| 466 | R | D | -2.7453 | |
| 467 | E | D | -2.7114 | |
| 468 | S | D | -1.6649 | |
| 469 | A | D | 0.0000 | |
| 470 | T | D | 0.0000 | |
| 471 | I | D | 0.0000 | |
| 472 | T | D | 0.0000 | |
| 473 | C | D | 0.0000 | |
| 474 | L | D | 0.0000 | |
| 475 | V | D | 0.0000 | |
| 476 | T | D | -0.6073 | |
| 477 | G | D | 0.0000 | |
| 478 | F | D | 0.0000 | |
| 479 | S | D | 0.0000 | |
| 480 | P | D | -0.4357 | |
| 481 | A | D | -0.3857 | |
| 482 | D | D | -0.8270 | |
| 483 | V | D | -0.2326 | |
| 484 | F | D | 0.2112 | |
| 485 | V | D | 0.0000 | |
| 486 | Q | D | -0.0514 | |
| 487 | W | D | 0.0000 | |
| 488 | M | D | -0.9853 | |
| 489 | Q | D | -1.5865 | |
| 490 | R | D | -2.5404 | |
| 491 | G | D | -1.7468 | |
| 492 | Q | D | -2.0416 | |
| 493 | P | D | -1.0935 | |
| 494 | L | D | -0.9880 | |
| 495 | S | D | -1.0890 | |
| 496 | P | D | -1.3092 | |
| 497 | E | D | -2.3974 | |
| 498 | K | D | -1.6911 | |
| 499 | Y | D | -0.8783 | |
| 500 | V | D | -0.4035 | |
| 501 | T | D | 0.1653 | |
| 502 | S | D | 0.0000 | |
| 503 | A | D | 0.0596 | |
| 504 | P | D | -0.1465 | |
| 505 | M | D | -0.0045 | |
| 506 | P | D | -0.6283 | |
| 507 | E | D | -1.0987 | |
| 508 | P | D | -1.4840 | |
| 509 | Q | D | -1.7519 | |
| 510 | A | D | -1.0253 | |
| 511 | P | D | -1.0288 | |
| 512 | G | D | -0.8905 | |
| 513 | R | D | -1.2436 | |
| 514 | Y | D | -0.4417 | |
| 515 | F | D | 0.0000 | |
| 516 | A | D | 0.0000 | |
| 517 | H | D | 0.0000 | |
| 518 | S | D | 0.0000 | |
| 519 | I | D | 0.0000 | |
| 520 | L | D | 0.0000 | |
| 521 | T | D | -0.3456 | |
| 522 | V | D | 0.0000 | |
| 523 | S | D | -1.8001 | |
| 524 | E | D | -2.5157 | |
| 525 | E | D | -3.1201 | |
| 526 | E | D | -2.0538 | |
| 527 | W | D | 0.0000 | |
| 528 | N | D | -2.2331 | |
| 529 | T | D | -1.5417 | |
| 530 | G | D | -1.4984 | |
| 531 | E | D | -1.5689 | |
| 532 | T | D | -1.1616 | |
| 533 | Y | D | 0.0000 | |
| 534 | T | D | -0.1436 | |
| 535 | C | D | 0.0000 | |
| 536 | V | D | 0.0000 | |
| 537 | V | D | 0.0000 | |
| 538 | A | D | 0.0000 | |
| 539 | H | D | 0.0000 | |
| 540 | E | D | -1.8203 | |
| 541 | A | D | -1.4242 | |
| 542 | L | D | 0.0000 | |
| 543 | P | D | -1.5737 | |
| 544 | N | D | -1.8407 | |
| 545 | R | D | -2.0560 | |
| 546 | V | D | -0.7296 | |
| 547 | T | D | -0.0996 | |
| 548 | E | D | 0.0000 | |
| 549 | R | D | 0.5498 | |
| 550 | T | D | 0.0000 | |
| 551 | V | D | 0.0000 | |
| 552 | D | D | -1.5665 | |
| 553 | K | D | -2.1345 | |
| 554 | S | D | -1.4411 | |
| 555 | T | D | -1.4298 | |
| 556 | G | D | -1.8030 | |
| 557 | K | D | -2.4415 | |
| 558 | P | D | -1.0905 | |
| 559 | T | D | 0.2049 | |
| 560 | L | D | 1.6964 | |
| 561 | Y | D | 1.8695 | |
| 562 | N | D | 0.6202 | |
| 563 | V | D | 1.9677 | |
| 564 | S | D | 1.2158 | |
| 565 | L | D | 1.6039 | |
| 566 | V | D | 2.1139 | |
| 567 | M | D | 0.6127 | |
| 568 | S | D | -0.1867 | |
| 569 | D | D | -1.5187 | |
| 570 | T | D | -1.2377 | |
| 571 | A | D | -0.8765 | |
| 572 | G | D | -0.5630 | |
| 573 | T | D | 0.4815 | |
| 574 | C | D | 0.9191 | |
| 575 | Y | D | 1.5986 |
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 | -0.6033 | 5.68 | View | CSV | PDB |
| 4.5 | -0.6574 | 5.68 | View | CSV | PDB |
| 5.0 | -0.7223 | 5.68 | View | CSV | PDB |
| 5.5 | -0.7868 | 5.68 | View | CSV | PDB |
| 6.0 | -0.8391 | 5.68 | View | CSV | PDB |
| 6.5 | -0.8697 | 5.68 | View | CSV | PDB |
| 7.0 | -0.8782 | 5.6799 | View | CSV | PDB |
| 7.5 | -0.872 | 5.6797 | View | CSV | PDB |
| 8.0 | -0.8578 | 5.679 | View | CSV | PDB |
| 8.5 | -0.8372 | 5.6768 | View | CSV | PDB |
| 9.0 | -0.8089 | 5.67 | 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