| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 56.3 | Low | 81.6 | Confident | 231 Ų | 231 | 125.3 Ų | 125.3 | 100% | 1.138 | 62% | 0.624 | S | S | * | * | 0 | 112.4 | 0 | -63.6 | 172.3 | -175.1 | 0 | 0 | 105.8 | |||||
| 2 | D | 81.3 | Confident | 82.4 | Confident | 102 Ų | 102 | 126.8 Ų | 126.8 | 55% | 0.545 | 62% | 0.617 | S | S | . | * | trans | -66.5 | 133.9 | -173.2 | -167.6 | -82.3 | 0 | 0 | 0 | 109.9 | K4 S5 V6 | D2-K4 PolarHBondContact O-N 2.98Å; D2-K4 WeakPolarHBondContact OD1-CA 3.47Å; D2-K4 WeakPolarHBondContact OD1-CB 3.45Å; D2-K4 PolarHBondContact OD1-N 3.19Å; D2-S5 WeakPolarHBondContact O-CB 2.9Å; D2-S5 PolarHBondContact O-N 2.9Å; D2-V6 PolarHBondContact O-N 3.06Å | ||
| 3 | L | 77.8 | Confident | 82.6 | Confident | 147 Ų | 147 | 122.5 Ų | 122.5 | 77% | 0.77 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -55.7 | -26.6 | 180 | -77 | 168.7 | 0 | 0 | 0 | 111.9 | K7 | L3-K7 PolarHBondContact O-N 3.49Å |
| 4 | K | 80.9 | Confident | 82.7 | Confident | 148 Ų | 148 | 121.4 Ų | 121.4 | 64% | 0.643 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -67.8 | -44.4 | 176 | -155.2 | -179.6 | -174.9 | -161.5 | 0 | 111.5 | D2 V6 K7 E8 | D2-K4 PolarHBondContact O-N 2.98Å; D2-K4 WeakPolarHBondContact OD1-CA 3.47Å; D2-K4 WeakPolarHBondContact OD1-CB 3.45Å; D2-K4 PolarHBondContact OD1-N 3.19Å; K4-V6 VanDerWaalsContact C-N 3.31Å; K4-V6 PolarHBondContact O-N 2.98Å; K4-K7 WeakPolarHBondContact O-CB 3.45Å; K4-K7 PolarHBondContact O-N 3.42Å; K4-E8 WeakPolarHBondContact O-CG 3.49Å; K4-E8 PolarHBondContact O-N 3.01Å |
| 5 | S | 83.4 | Confident | 82.7 | Confident | 67 Ų | 67 | 123.3 Ų | 123.3 | 47% | 0.469 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -64.3 | -36 | 176.2 | -50 | 0 | 0 | 0 | 0 | 112.2 | D2 E8 Y9 | D2-S5 WeakPolarHBondContact O-CB 2.9Å; D2-S5 PolarHBondContact O-N 2.9Å; S5-E8 PolarHBondContact O-N 3.49Å; S5-Y9 WeakPolarHBondContact O-CB 3.43Å; S5-Y9 PolarHBondContact O-N 3.26Å |
| 6 | V | 86.5 | Confident | 82.8 | Confident | 58 Ų | 58 | 120.8 Ų | 120.8 | 35% | 0.352 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -67.2 | -43.6 | 176.2 | -177.8 | 0 | 0 | 0 | 0 | 110.6 | D2 K4 E8 Y9 F10 | D2-V6 PolarHBondContact O-N 3.06Å; K4-V6 VanDerWaalsContact C-N 3.31Å; K4-V6 PolarHBondContact O-N 2.98Å; V6-E8 PolarHBondContact O-N 3.45Å; V6-Y9 WeakPolarHBondContact O-CB 3.45Å; V6-Y9 PolarHBondContact O-N 3.38Å; V6-F10 HydrophobicContact CG1-CD2 3.79Å; V6-F10 HydrophobicContact CG1-CE2 3.72Å; V6-F10 VanDerWaalsContact O-CD2 3.31Å; V6-F10 WeakPolarHBondContact O-CD2 3.4Å; V6-F10 PolarHBondContact O-N 3.06Å |
| 7 | K | 85.2 | Confident | 82.9 | Confident | 165 Ų | 165 | 116.9 Ų | 116.9 | 72% | 0.717 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -59.2 | -45.5 | 174.3 | -95.8 | -174.8 | 161.7 | -174.8 | 0 | 112.5 | L3 K4 Y9 F10 A11 | L3-K7 PolarHBondContact O-N 3.49Å; K4-K7 WeakPolarHBondContact O-CB 3.45Å; K4-K7 PolarHBondContact O-N 3.42Å; K7-Y9 VanDerWaalsContact C-N 3.29Å; K7-Y9 PolarHBondContact O-N 2.97Å; K7-F10 PolarHBondContact O-N 2.93Å; K7-A11 WeakPolarHBondContact O-CB 3.5Å; K7-A11 PolarHBondContact O-N 3.31Å |
| 8 | E | 88.6 | Confident | 82.7 | Confident | 125 Ų | 125 | 112.5 Ų | 112.5 | 58% | 0.584 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -62.1 | -39.3 | 177.5 | -72.6 | 178.1 | 147.4 | 0 | 0 | 111.4 | K4 S5 V6 A11 W12 | K4-E8 WeakPolarHBondContact O-CG 3.49Å; K4-E8 PolarHBondContact O-N 3.01Å; S5-E8 PolarHBondContact O-N 3.49Å; V6-E8 PolarHBondContact O-N 3.45Å; E8-A11 PolarHBondContact O-N 3.26Å; E8-W12 WeakPolarHBondContact O-CB 3.31Å; E8-W12 PolarHBondContact O-N 2.92Å |
| 9 | Y | 87.3 | Confident | 82.7 | Confident | 137 Ų | 137 | 111.8 Ų | 111.8 | 54% | 0.537 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64.3 | -44 | 175.1 | -174.3 | -101.9 | 0 | 0 | 0 | 112.8 | S5 V6 K7 W12 L13 | S5-Y9 WeakPolarHBondContact O-CB 3.43Å; S5-Y9 PolarHBondContact O-N 3.26Å; V6-Y9 WeakPolarHBondContact O-CB 3.45Å; V6-Y9 PolarHBondContact O-N 3.38Å; K7-Y9 VanDerWaalsContact C-N 3.29Å; K7-Y9 PolarHBondContact O-N 2.97Å; Y9-W12 HydrophobicContact CE2-CE3 4.38Å; Y9-W12 WeakPolarHBondContact O-CB 3.42Å; Y9-W12 PolarHBondContact O-N 2.92Å; Y9-L13 HydrophobicContact CD1-CD1 4.36Å; Y9-L13 HydrophobicContact CE1-CD1 3.71Å; Y9-L13 HydrophobicContact CE2-CD1 4.18Å; Y9-L13 PolarHBondContact O-N 2.96Å |
| 10 | F | 85 | Confident | 82.6 | Confident | 136 Ų | 136 | 112.7 Ų | 112.7 | 60% | 0.596 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -64.4 | -39.5 | 175.2 | -88.3 | -76.2 | 0 | 0 | 0 | 112.5 | V6 K7 W12 L13 Y14 | V6-F10 HydrophobicContact CG1-CD2 3.79Å; V6-F10 HydrophobicContact CG1-CE2 3.72Å; V6-F10 VanDerWaalsContact O-CD2 3.31Å; V6-F10 WeakPolarHBondContact O-CD2 3.4Å; V6-F10 PolarHBondContact O-N 3.06Å; K7-F10 PolarHBondContact O-N 2.93Å; F10-W12 VanDerWaalsContact C-N 3.31Å; F10-W12 PolarHBondContact O-N 3.5Å; F10-L13 PolarHBondContact O-N 3.23Å; F10-Y14 WeakPolarHBondContact O-CB 3.5Å; F10-Y14 PolarHBondContact O-N 3.37Å |
| 11 | A | 85.4 | Confident | 82.3 | Confident | 62 Ų | 62 | 109.5 Ų | 109.5 | 51% | 0.512 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.9 | -40.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | K7 E8 Y14 Y15 | K7-A11 WeakPolarHBondContact O-CB 3.5Å; K7-A11 PolarHBondContact O-N 3.31Å; E8-A11 PolarHBondContact O-N 3.26Å; A11-Y14 PolarHBondContact O-N 3Å; A11-Y15 PolarHBondContact O-N 2.97Å |
| 12 | W | 91.2 | Very high | 83.2 | Confident | 144 Ų | 144 | 102 Ų | 102 | 55% | 0.545 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.2 | -44.9 | 175.2 | -177.3 | 82.7 | 0 | 0 | 0 | 112.3 | E8 Y9 F10 Y14 Y15 Q16 | E8-W12 WeakPolarHBondContact O-CB 3.31Å; E8-W12 PolarHBondContact O-N 2.92Å; Y9-W12 HydrophobicContact CE2-CE3 4.38Å; Y9-W12 WeakPolarHBondContact O-CB 3.42Å; Y9-W12 PolarHBondContact O-N 2.92Å; F10-W12 VanDerWaalsContact C-N 3.31Å; F10-W12 PolarHBondContact O-N 3.5Å; W12-Y14 VanDerWaalsContact C-N 3.32Å; W12-Y14 PolarHBondContact O-N 3.41Å; W12-Y15 WeakPolarHBondContact O-CB 3.42Å; W12-Y15 PolarHBondContact O-N 3.06Å; W12-Q16 PolarHBondContact O-N 3.29Å |
| 13 | L | 85.3 | Confident | 82.9 | Confident | 70 Ų | 70 | 97.2 Ų | 97.2 | 37% | 0.366 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -59.7 | -42.9 | 175.6 | -123.2 | 76.3 | 0 | 0 | 0 | 112 | Y9 F10 Y15 Q16 Y17 | Y9-L13 HydrophobicContact CD1-CD1 4.36Å; Y9-L13 HydrophobicContact CE1-CD1 3.71Å; Y9-L13 HydrophobicContact CE2-CD1 4.18Å; Y9-L13 PolarHBondContact O-N 2.96Å; F10-L13 PolarHBondContact O-N 3.23Å; L13-Y15 VanDerWaalsContact C-N 3.34Å; L13-Q16 PolarHBondContact O-N 3.27Å; L13-Y17 WeakPolarHBondContact O-CB 3.44Å; L13-Y17 PolarHBondContact O-N 3.32Å |
| 14 | Y | 83.9 | Confident | 82.6 | Confident | 108 Ų | 108 | 93.1 Ų | 93.1 | 42% | 0.424 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -64.2 | -40.7 | 178.2 | -178.6 | -106 | 0 | 0 | 0 | 111.8 | F10 A11 W12 Q16 Y17 Q18 | F10-Y14 WeakPolarHBondContact O-CB 3.5Å; F10-Y14 PolarHBondContact O-N 3.37Å; A11-Y14 PolarHBondContact O-N 3Å; W12-Y14 VanDerWaalsContact C-N 3.32Å; W12-Y14 PolarHBondContact O-N 3.41Å; Y14-Q16 VanDerWaalsContact C-N 3.34Å; Y14-Y17 HydrophobicContact CD2-CD1 4.31Å; Y14-Y17 HydrophobicContact CE2-CD1 4.3Å; Y14-Y17 PolarHBondContact O-N 3.04Å; Y14-Q18 HydrophobicContact CE1-CG 4.15Å; Y14-Q18 VanDerWaalsContact CZ-NE2 3.3Å; Y14-Q18 PolarHBondContact O-N 3.42Å; Y14-Q18 PolarHBondContact OH-NE2 3.29Å |
| 15 | Y | 82.6 | Confident | 82.5 | Confident | 150 Ų | 150 | 91.9 Ų | 91.9 | 59% | 0.588 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -61 | -45.3 | 174.1 | -166.4 | -95.4 | 0 | 0 | 0 | 111.2 | A11 W12 L13 Y17 Q18 I19 | A11-Y15 PolarHBondContact O-N 2.97Å; W12-Y15 WeakPolarHBondContact O-CB 3.42Å; W12-Y15 PolarHBondContact O-N 3.06Å; L13-Y15 VanDerWaalsContact C-N 3.34Å; Y15-Y17 VanDerWaalsContact C-N 3.33Å; Y15-Y17 PolarHBondContact O-N 2.97Å; Y15-Q18 PolarHBondContact O-N 3.44Å; Y15-I19 HydrophobicContact CD1-CG1 4.1Å; Y15-I19 HydrophobicContact CE1-CD1 4.05Å; Y15-I19 HydrophobicContact CE1-CG1 3.91Å; Y15-I19 VanDerWaalsContact O-CG1 3.29Å; Y15-I19 WeakPolarHBondContact O-CG1 3.45Å; Y15-I19 PolarHBondContact O-N 3.33Å; Y15-I19 VanDerWaalsContact O-N 3.11Å |
| 16 | Q | 84.3 | Confident | 82.1 | Confident | 82 Ų | 82 | 91.8 Ų | 91.8 | 38% | 0.383 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -62.5 | -41.1 | 178.4 | -152.4 | -179.1 | 1.3 | 0 | 0 | 112 | W12 L13 Y14 I19 I20 | W12-Q16 PolarHBondContact O-N 3.29Å; L13-Q16 PolarHBondContact O-N 3.27Å; Y14-Q16 VanDerWaalsContact C-N 3.34Å; Q16-I19 PolarHBondContact O-N 3.11Å; Q16-I20 HydrophobicContact CG-CD1 3.91Å; Q16-I20 WeakPolarHBondContact O-CB 3.5Å; Q16-I20 WeakPolarHBondContact O-CD1 3.22Å; Q16-I20 WeakPolarHBondContact O-CG1 3.29Å; Q16-I20 PolarHBondContact O-N 3.37Å |
| 17 | Y | 83.8 | Confident | 81.8 | Confident | 55 Ų | 55 | 94.8 Ų | 94.8 | 22% | 0.216 | 47% | 0.467 | C | S | . | . | H | α-helix | trans | -59.8 | -46.1 | 173.3 | 162.7 | -99.8 | 0 | 0 | 0 | 112.4 | L13 Y14 Y15 I19 I20 S21 L38 | L13-Y17 WeakPolarHBondContact O-CB 3.44Å; L13-Y17 PolarHBondContact O-N 3.32Å; Y14-Y17 HydrophobicContact CD2-CD1 4.31Å; Y14-Y17 HydrophobicContact CE2-CD1 4.3Å; Y14-Y17 PolarHBondContact O-N 3.04Å; Y15-Y17 VanDerWaalsContact C-N 3.33Å; Y15-Y17 PolarHBondContact O-N 2.97Å; Y17-I19 VanDerWaalsContact C-N 3.28Å; Y17-I19 PolarHBondContact O-N 3.34Å; Y17-I20 PolarHBondContact O-N 2.99Å; Y17-S21 PolarHBondContact O-N 3.03Å; Y17-L38 HydrophobicContact CE2-CD1 3.46Å; Y17-L38 VanDerWaalsContact CE2-CD1 3.46Å; Y17-L38 WeakPolarHBondContact OH-CD1 3.44Å |
| 18 | Q | 79.6 | Confident | 81.5 | Confident | 38 Ų | 38 | 92 Ų | 92 | 18% | 0.178 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -58.9 | -39.7 | 177.3 | -80.4 | -172.3 | -7.1 | 0 | 0 | 112.4 | Y14 Y15 C22 C23 A24 | Y14-Q18 HydrophobicContact CE1-CG 4.15Å; Y14-Q18 VanDerWaalsContact CZ-NE2 3.3Å; Y14-Q18 PolarHBondContact O-N 3.42Å; Y14-Q18 PolarHBondContact OH-NE2 3.29Å; Y15-Q18 PolarHBondContact O-N 3.44Å; Q18-C22 CarbonylContact O-C 3.54Å; Q18-C22 PolarHBondContact O-N 2.93Å; Q18-C23 PolarHBondContact O-N 3.35Å; Q18-A24 HydrophobicContact CB-CB 4.43Å; Q18-A24 PolarHBondContact O-N 3.42Å |
| 19 | I | 82.6 | Confident | 81.2 | Confident | 99 Ų | 99 | 93.7 Ų | 93.7 | 51% | 0.508 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -72.4 | -46.4 | 179.2 | -57.5 | -75 | 0 | 0 | 0 | 110.8 | Y15 Q16 Y17 S21 C22 | Y15-I19 HydrophobicContact CD1-CG1 4.1Å; Y15-I19 HydrophobicContact CE1-CD1 4.05Å; Y15-I19 HydrophobicContact CE1-CG1 3.91Å; Y15-I19 VanDerWaalsContact O-CG1 3.29Å; Y15-I19 WeakPolarHBondContact O-CG1 3.45Å; Y15-I19 PolarHBondContact O-N 3.33Å; Y15-I19 VanDerWaalsContact O-N 3.11Å; Q16-I19 PolarHBondContact O-N 3.11Å; Y17-I19 VanDerWaalsContact C-N 3.28Å; Y17-I19 PolarHBondContact O-N 3.34Å; I19-S21 PolarHBondContact O-N 2.91Å; I19-C22 PolarHBondContact O-N 3.22Å; I19-C22 VanDerWaalsContact O-N 3.14Å |
| 20 | I | 81 | Confident | 80.9 | Confident | 129 Ų | 129 | 90.8 Ų | 90.8 | 66% | 0.662 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -64.1 | -41.4 | -177.4 | -69.9 | 164.2 | 0 | 0 | 0 | 111.8 | Q16 Y17 C22 | Q16-I20 HydrophobicContact CG-CD1 3.91Å; Q16-I20 WeakPolarHBondContact O-CB 3.5Å; Q16-I20 WeakPolarHBondContact O-CD1 3.22Å; Q16-I20 WeakPolarHBondContact O-CG1 3.29Å; Q16-I20 PolarHBondContact O-N 3.37Å; Y17-I20 PolarHBondContact O-N 2.99Å; I20-C22 PolarHBondContact O-N 3.39Å |
| 21 | S | 77 | Confident | 80.8 | Confident | 46 Ų | 46 | 86.6 Ų | 86.6 | 32% | 0.322 | 44% | 0.44 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84 | 4.9 | 178.4 | -62.2 | 0 | 0 | 0 | 0 | 113.3 | Y17 I19 C23 | Y17-S21 PolarHBondContact O-N 3.03Å; I19-S21 PolarHBondContact O-N 2.91Å; S21-C23 PolarHBondContact O-N 3.41Å |
| 22 | C | 75 | Confident | 80.5 | Confident | 74 Ų | 74 | 86.7 Ų | 86.7 | 50% | 0.5 | 44% | 0.437 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 53.1 | 17.8 | -171.8 | -158.8 | 0 | 0 | 0 | 0 | 113.6 | Q18 I19 I20 A24 V25 L26 | Q18-C22 CarbonylContact O-C 3.54Å; Q18-C22 PolarHBondContact O-N 2.93Å; I19-C22 PolarHBondContact O-N 3.22Å; I19-C22 VanDerWaalsContact O-N 3.14Å; I20-C22 PolarHBondContact O-N 3.39Å; C22-A24 PolarHBondContact O-N 2.91Å; C22-A24 VanDerWaalsContact O-N 3.16Å; C22-V25 PolarHBondContact O-N 3.01Å; C22-V25 VanDerWaalsContact O-N 3.17Å; C22-L26 WeakPolarHBondContact O-CD1 3.17Å |
| 23 | C | 75.3 | Confident | 80.3 | Confident | 2 Ų | 2 | 84.2 Ų | 84.2 | 1% | 0.014 | 43% | 0.433 | C | S | . | . | G | 310 helix | trans | -68.7 | -19.9 | -171.3 | -147.9 | 0 | 0 | 0 | 0 | 111.9 | Q18 S21 V25 L26 Q31 | Q18-C23 PolarHBondContact O-N 3.35Å; S21-C23 PolarHBondContact O-N 3.41Å; C23-V25 PolarHBondContact O-N 3.17Å; C23-L26 PolarHBondContact O-N 3.32Å; C23-Q31 VanDerWaalsContact SG-CG 3.6Å |
| 24 | A | 71.6 | Confident | 80.2 | Confident | 60 Ų | 60 | 85.3 Ų | 85.3 | 50% | 0.496 | 44% | 0.435 | S | S | . | . | G | 310 helix | trans | -66.5 | -18.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | Q18 C22 | Q18-A24 HydrophobicContact CB-CB 4.43Å; Q18-A24 PolarHBondContact O-N 3.42Å; C22-A24 PolarHBondContact O-N 2.91Å; C22-A24 VanDerWaalsContact O-N 3.16Å |
| 25 | V | 77.3 | Confident | 80.2 | Confident | 123 Ų | 123 | 83.7 Ų | 83.7 | 75% | 0.745 | 43% | 0.433 | S | S | * | . | G | 310 helix | trans | -98.4 | -15.1 | -179.2 | 178.7 | 0 | 0 | 0 | 0 | 112 | C22 C23 | C22-V25 PolarHBondContact O-N 3.01Å; C22-V25 VanDerWaalsContact O-N 3.17Å; C23-V25 PolarHBondContact O-N 3.17Å |
| 26 | L | 76.4 | Confident | 80.5 | Confident | 64 Ų | 64 | 79.7 Ų | 79.7 | 34% | 0.335 | 42% | 0.424 | S | S | . | . | S | Bend | trans | -78.1 | 156.7 | -177.1 | -85.5 | 76.2 | 0 | 0 | 0 | 111.8 | C22 C23 E30 | C22-L26 WeakPolarHBondContact O-CD1 3.17Å; C23-L26 PolarHBondContact O-N 3.32Å; L26-E30 HydrophobicContact CB-CB 4.2Å; L26-E30 HydrophobicContact CD2-CB 3.87Å; L26-E30 HydrophobicContact CG-CB 4.47Å |
| 27 | E | 79.8 | Confident | 80.8 | Confident | 122 Ų | 122 | 80.4 Ų | 80.4 | 57% | 0.57 | 43% | 0.43 | S | S | * | . | trans | -62.4 | 150.6 | 174.3 | -73.1 | -168.8 | 86.5 | 0 | 0 | 111.2 | W29 E30 Q31 | E27-W29 PolarHBondContact O-N 3.05Å; E27-E30 HydrophobicContact CB-CG 4.37Å; E27-E30 PolarHBondContact N-OE2 3.16Å; E27-E30 PolarHBondContact O-N 2.99Å; E27-Q31 PolarHBondContact O-N 3.4Å | ||
| 28 | P | 77.9 | Confident | 81 | Confident | 107 Ų | 107 | 80.3 Ų | 80.3 | 70% | 0.695 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -58 | -28.5 | -175.2 | 21.8 | -34.1 | 0 | 0 | 0 | 113.3 | S32 | P28-S32 PolarHBondContact O-N 3.48Å |
| 29 | W | 83.4 | Confident | 81.5 | Confident | 159 Ų | 159 | 84.4 Ų | 84.4 | 60% | 0.602 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -74.3 | -38.4 | 177.1 | 94.3 | -88.7 | 0 | 0 | 0 | 112.3 | E27 S32 M33 | E27-W29 PolarHBondContact O-N 3.05Å; W29-S32 WeakPolarHBondContact O-CB 2.83Å; W29-S32 PolarHBondContact O-N 3.21Å; W29-M33 HydrophobicContact CE3-CG 3.94Å; W29-M33 HydrophobicContact CZ3-CG 3.76Å; W29-M33 HydrophobicContact CZ3-SD 4.49Å; W29-M33 PolarHBondContact O-N 3.44Å; W29-M33 VanDerWaalsContact O-N 3.14Å |
| 30 | E | 80.3 | Confident | 82 | Confident | 77 Ų | 77 | 83.2 Ų | 83.2 | 36% | 0.36 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -71.5 | -39.1 | 178.4 | -60.2 | -174.9 | 109.4 | 0 | 0 | 111.3 | L26 E27 S32 M33 F34 | L26-E30 HydrophobicContact CB-CB 4.2Å; L26-E30 HydrophobicContact CD2-CB 3.87Å; L26-E30 HydrophobicContact CG-CB 4.47Å; E27-E30 HydrophobicContact CB-CG 4.37Å; E27-E30 PolarHBondContact N-OE2 3.16Å; E27-E30 PolarHBondContact O-N 2.99Å; E30-S32 PolarHBondContact O-N 3.5Å; E30-M33 PolarHBondContact O-N 3.39Å; E30-M33 VanDerWaalsContact O-N 3.14Å; E30-F34 PolarHBondContact O-N 3.45Å |
| 31 | Q | 82.3 | Confident | 82.6 | Confident | 47 Ų | 47 | 81.4 Ų | 81.4 | 22% | 0.22 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -58.1 | -40.5 | 172.3 | 176 | 169.7 | 34.6 | 0 | 0 | 111.2 | C23 E27 F34 N35 | C23-Q31 VanDerWaalsContact SG-CG 3.6Å; E27-Q31 PolarHBondContact O-N 3.4Å; Q31-F34 PolarHBondContact O-N 2.93Å; Q31-N35 WeakPolarHBondContact O-CB 3.36Å; Q31-N35 PolarHBondContact O-N 3.02Å |
| 32 | S | 80.8 | Confident | 83.4 | Confident | 65 Ų | 65 | 83.3 Ų | 83.3 | 46% | 0.455 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -62.8 | -43.9 | 175.2 | -172.7 | 0 | 0 | 0 | 0 | 111.8 | P28 W29 E30 N35 T36 | P28-S32 PolarHBondContact O-N 3.48Å; W29-S32 WeakPolarHBondContact O-CB 2.83Å; W29-S32 PolarHBondContact O-N 3.21Å; E30-S32 PolarHBondContact O-N 3.5Å; S32-N35 PolarHBondContact O-N 2.7Å; S32-T36 WeakPolarHBondContact O-CG2 3.3Å; S32-T36 PolarHBondContact O-N 3.47Å; S32-T36 PolarHBondContact O-OG1 2.92Å |
| 33 | M | 86.1 | Confident | 84.3 | Confident | 92 Ų | 92 | 82.2 Ų | 82.2 | 45% | 0.453 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -61.6 | -46.3 | 177.1 | -71.6 | -72.9 | 90.5 | 0 | 0 | 111.8 | W29 E30 N35 T36 I37 | W29-M33 HydrophobicContact CE3-CG 3.94Å; W29-M33 HydrophobicContact CZ3-CG 3.76Å; W29-M33 HydrophobicContact CZ3-SD 4.49Å; W29-M33 PolarHBondContact O-N 3.44Å; W29-M33 VanDerWaalsContact O-N 3.14Å; E30-M33 PolarHBondContact O-N 3.39Å; E30-M33 VanDerWaalsContact O-N 3.14Å; M33-N35 VanDerWaalsContact C-N 3.33Å; M33-N35 PolarHBondContact O-N 3.14Å; M33-T36 WeakPolarHBondContact CA-OG1 3.4Å; M33-T36 PolarHBondContact O-N 3.14Å; M33-T36 PolarHBondContact O-OG1 3.04Å; M33-I37 WeakPolarHBondContact O-CG1 3.37Å; M33-I37 PolarHBondContact O-N 3.28Å |
| 34 | F | 83.4 | Confident | 85.2 | Confident | 93 Ų | 93 | 87.6 Ų | 87.6 | 41% | 0.408 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -61.9 | -42.2 | -179.7 | -150.3 | -96.9 | 0 | 0 | 0 | 112.1 | E30 Q31 T36 I37 L38 | E30-F34 PolarHBondContact O-N 3.45Å; Q31-F34 PolarHBondContact O-N 2.93Å; F34-T36 PolarHBondContact O-N 3.41Å; F34-I37 PolarHBondContact O-N 3.18Å; F34-L38 HydrophobicContact CD1-CD1 3.62Å; F34-L38 HydrophobicContact CD1-CG 4.48Å; F34-L38 HydrophobicContact CE1-CD1 3.69Å; F34-L38 HydrophobicContact CE1-CG 4.45Å; F34-L38 PolarHBondContact O-N 2.89Å |
| 35 | N | 84.8 | Confident | 86.3 | Confident | 74 Ų | 74 | 88.9 Ų | 88.9 | 40% | 0.396 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -66.9 | -36.9 | 178.6 | -149.5 | 39.8 | 0 | 0 | 0 | 111.8 | Q31 S32 M33 L38 L39 | Q31-N35 WeakPolarHBondContact O-CB 3.36Å; Q31-N35 PolarHBondContact O-N 3.02Å; S32-N35 PolarHBondContact O-N 2.7Å; M33-N35 VanDerWaalsContact C-N 3.33Å; M33-N35 PolarHBondContact O-N 3.14Å; N35-L38 PolarHBondContact O-N 3.14Å; N35-L39 VanDerWaalsContact O-CB 3.3Å; N35-L39 WeakPolarHBondContact O-CB 3.3Å; N35-L39 PolarHBondContact O-N 3.35Å |
| 36 | T | 88.1 | Confident | 87.2 | Confident | 65 Ų | 65 | 87.4 Ų | 87.4 | 40% | 0.399 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -67.1 | -38.5 | 175 | 54.8 | 0 | 0 | 0 | 0 | 113 | S32 M33 F34 L39 T40 | S32-T36 WeakPolarHBondContact O-CG2 3.3Å; S32-T36 PolarHBondContact O-N 3.47Å; S32-T36 PolarHBondContact O-OG1 2.92Å; M33-T36 WeakPolarHBondContact CA-OG1 3.4Å; M33-T36 PolarHBondContact O-N 3.14Å; M33-T36 PolarHBondContact O-OG1 3.04Å; F34-T36 PolarHBondContact O-N 3.41Å; T36-L39 PolarHBondContact O-N 3.42Å; T36-T40 WeakPolarHBondContact O-CB 3.46Å; T36-T40 PolarHBondContact O-N 3.44Å; T36-T40 PolarHBondContact O-OG1 3.41Å |
| 37 | I | 89.6 | Confident | 88.1 | Confident | 97 Ų | 97 | 91.3 Ų | 91.3 | 50% | 0.497 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -64.8 | -47.7 | 175.8 | -67.5 | 166.7 | 0 | 0 | 0 | 109.9 | M33 F34 L39 T40 I41 | M33-I37 WeakPolarHBondContact O-CG1 3.37Å; M33-I37 PolarHBondContact O-N 3.28Å; F34-I37 PolarHBondContact O-N 3.18Å; I37-L39 PolarHBondContact O-N 2.83Å; I37-T40 WeakPolarHBondContact O-CB 3.3Å; I37-T40 PolarHBondContact O-N 3.34Å; I37-T40 VanDerWaalsContact O-N 3.13Å; I37-I41 HydrophobicContact CG2-CD1 3.88Å; I37-I41 HydrophobicContact CG2-CG1 4.48Å; I37-I41 WeakPolarHBondContact O-CG1 3.49Å; I37-I41 PolarHBondContact O-N 2.85Å |
| 38 | L | 88 | Confident | 88.7 | Confident | 54 Ų | 54 | 88.4 Ų | 88.4 | 28% | 0.283 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -61.8 | -42.5 | 177.4 | -83.1 | 162.2 | 0 | 0 | 0 | 112.7 | Y17 F34 N35 T40 I41 V42 | Y17-L38 HydrophobicContact CE2-CD1 3.46Å; Y17-L38 VanDerWaalsContact CE2-CD1 3.46Å; Y17-L38 WeakPolarHBondContact OH-CD1 3.44Å; F34-L38 HydrophobicContact CD1-CD1 3.62Å; F34-L38 HydrophobicContact CD1-CG 4.48Å; F34-L38 HydrophobicContact CE1-CD1 3.69Å; F34-L38 HydrophobicContact CE1-CG 4.45Å; F34-L38 PolarHBondContact O-N 2.89Å; N35-L38 PolarHBondContact O-N 3.14Å; L38-T40 VanDerWaalsContact C-N 3.25Å; L38-T40 PolarHBondContact O-N 2.84Å; L38-I41 PolarHBondContact O-N 3.22Å; L38-V42 WeakPolarHBondContact O-CB 3.23Å; L38-V42 VanDerWaalsContact O-CG2 3.3Å; L38-V42 WeakPolarHBondContact O-CG2 3.22Å; L38-V42 PolarHBondContact O-N 2.87Å |
| 39 | L | 90.9 | Very high | 89.4 | Confident | 123 Ų | 123 | 85.3 Ų | 85.3 | 64% | 0.644 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -61.3 | -38.2 | 175.4 | -174.1 | 136 | 0 | 0 | 0 | 111.3 | N35 T36 I37 A43 | N35-L39 VanDerWaalsContact O-CB 3.3Å; N35-L39 WeakPolarHBondContact O-CB 3.3Å; N35-L39 PolarHBondContact O-N 3.35Å; T36-L39 PolarHBondContact O-N 3.42Å; I37-L39 PolarHBondContact O-N 2.83Å; L39-A43 VanDerWaalsContact O-CB 3.22Å; L39-A43 WeakPolarHBondContact O-CB 3.41Å; L39-A43 PolarHBondContact O-N 3.38Å |
| 40 | T | 92.9 | Very high | 89.8 | Confident | 75 Ų | 75 | 86 Ų | 86 | 46% | 0.46 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -66 | -43.6 | 175.4 | -54.8 | 0 | 0 | 0 | 0 | 111.7 | T36 I37 L38 A43 M44 | T36-T40 WeakPolarHBondContact O-CB 3.46Å; T36-T40 PolarHBondContact O-N 3.44Å; T36-T40 PolarHBondContact O-OG1 3.41Å; I37-T40 WeakPolarHBondContact O-CB 3.3Å; I37-T40 PolarHBondContact O-N 3.34Å; I37-T40 VanDerWaalsContact O-N 3.13Å; L38-T40 VanDerWaalsContact C-N 3.25Å; L38-T40 PolarHBondContact O-N 2.84Å; T40-A43 PolarHBondContact O-N 3.13Å; T40-M44 WeakPolarHBondContact O-CG 3.49Å; T40-M44 PolarHBondContact O-N 3Å |
| 41 | I | 92.8 | Very high | 90.4 | Very high | 90 Ų | 90 | 85.7 Ų | 85.7 | 46% | 0.462 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -61.5 | -48.7 | 176.4 | -66.8 | 164.7 | 0 | 0 | 0 | 110.1 | I37 L38 A43 M44 V45 | I37-I41 HydrophobicContact CG2-CD1 3.88Å; I37-I41 HydrophobicContact CG2-CG1 4.48Å; I37-I41 WeakPolarHBondContact O-CG1 3.49Å; I37-I41 PolarHBondContact O-N 2.85Å; L38-I41 PolarHBondContact O-N 3.22Å; I41-A43 VanDerWaalsContact C-N 3.33Å; I41-A43 PolarHBondContact O-N 2.97Å; I41-M44 PolarHBondContact O-N 3.34Å; I41-V45 HydrophobicContact CG2-CG2 4.48Å; I41-V45 WeakPolarHBondContact O-CG2 3.45Å; I41-V45 PolarHBondContact O-N 3.08Å |
| 42 | V | 93.8 | Very high | 90.7 | Very high | 87 Ų | 87 | 88.9 Ų | 88.9 | 53% | 0.527 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -60.8 | -44.1 | 177.8 | 172.2 | 0 | 0 | 0 | 0 | 110.5 | L38 M44 V45 V46 | L38-V42 WeakPolarHBondContact O-CB 3.23Å; L38-V42 VanDerWaalsContact O-CG2 3.3Å; L38-V42 WeakPolarHBondContact O-CG2 3.22Å; L38-V42 PolarHBondContact O-N 2.87Å; V42-M44 VanDerWaalsContact C-N 3.31Å; V42-M44 PolarHBondContact O-N 2.76Å; V42-V45 PolarHBondContact O-N 3.23Å; V42-V46 HydrophobicContact CG1-CG2 4.29Å; V42-V46 WeakPolarHBondContact O-CB 3.25Å; V42-V46 VanDerWaalsContact O-CG2 3.3Å; V42-V46 WeakPolarHBondContact O-CG2 3.04Å; V42-V46 PolarHBondContact O-N 2.89Å |
| 43 | A | 94.5 | Very high | 91.2 | Very high | 51 Ų | 51 | 90.1 Ų | 90.1 | 42% | 0.421 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -59.8 | -41.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | L39 T40 I41 V46 Y47 | L39-A43 VanDerWaalsContact O-CB 3.22Å; L39-A43 WeakPolarHBondContact O-CB 3.41Å; L39-A43 PolarHBondContact O-N 3.38Å; T40-A43 PolarHBondContact O-N 3.13Å; I41-A43 VanDerWaalsContact C-N 3.33Å; I41-A43 PolarHBondContact O-N 2.97Å; A43-V46 PolarHBondContact O-N 3.45Å; A43-Y47 VanDerWaalsContact O-CB 3.23Å; A43-Y47 WeakPolarHBondContact O-CB 3.35Å; A43-Y47 PolarHBondContact O-N 3.48Å |
| 44 | M | 94.4 | Very high | 91.2 | Very high | 115 Ų | 115 | 88.8 Ų | 88.8 | 57% | 0.567 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -65.7 | -41.4 | 175.6 | -74.7 | -58.8 | 160.7 | 0 | 0 | 112.3 | T40 I41 V42 Y47 T48 | T40-M44 WeakPolarHBondContact O-CG 3.49Å; T40-M44 PolarHBondContact O-N 3Å; I41-M44 PolarHBondContact O-N 3.34Å; V42-M44 VanDerWaalsContact C-N 3.31Å; V42-M44 PolarHBondContact O-N 2.76Å; M44-Y47 PolarHBondContact O-N 3.33Å; M44-T48 WeakPolarHBondContact O-CG2 3.4Å; M44-T48 PolarHBondContact O-N 3.31Å; M44-T48 PolarHBondContact O-OG1 3.38Å |
| 45 | V | 95.7 | Very high | 91.4 | Very high | 87 Ų | 87 | 89.5 Ų | 89.5 | 53% | 0.527 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -64 | -42.5 | 175.7 | 172.6 | 0 | 0 | 0 | 0 | 111.4 | I41 V42 Y47 T48 A49 | I41-V45 HydrophobicContact CG2-CG2 4.48Å; I41-V45 WeakPolarHBondContact O-CG2 3.45Å; I41-V45 PolarHBondContact O-N 3.08Å; V42-V45 PolarHBondContact O-N 3.23Å; V45-Y47 VanDerWaalsContact C-N 3.35Å; V45-T48 PolarHBondContact O-N 2.82Å; V45-T48 PolarHBondContact O-OG1 2.96Å; V45-A49 VanDerWaalsContact O-CB 3.26Å; V45-A49 WeakPolarHBondContact O-CB 3.26Å; V45-A49 PolarHBondContact O-N 2.8Å |
| 46 | V | 95.8 | Very high | 91.5 | Very high | 91 Ų | 91 | 91.5 Ų | 91.5 | 55% | 0.552 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -66.4 | -40.5 | 176.7 | 172.1 | 0 | 0 | 0 | 0 | 110.6 | V42 A43 A49 Y50 | V42-V46 HydrophobicContact CG1-CG2 4.29Å; V42-V46 WeakPolarHBondContact O-CB 3.25Å; V42-V46 VanDerWaalsContact O-CG2 3.3Å; V42-V46 WeakPolarHBondContact O-CG2 3.04Å; V42-V46 PolarHBondContact O-N 2.89Å; A43-V46 PolarHBondContact O-N 3.45Å; V46-A49 PolarHBondContact O-N 3.23Å; V46-Y50 VanDerWaalsContact O-CB 3.3Å; V46-Y50 WeakPolarHBondContact O-CB 3.36Å; V46-Y50 PolarHBondContact O-N 3.48Å |
| 47 | Y | 94.6 | Very high | 91.6 | Very high | 147 Ų | 147 | 93.5 Ų | 93.5 | 58% | 0.576 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -62.1 | -48.1 | 176.3 | 174.6 | -101.3 | 0 | 0 | 0 | 111.5 | A43 M44 V45 Y50 V51 | A43-Y47 VanDerWaalsContact O-CB 3.23Å; A43-Y47 WeakPolarHBondContact O-CB 3.35Å; A43-Y47 PolarHBondContact O-N 3.48Å; M44-Y47 PolarHBondContact O-N 3.33Å; V45-Y47 VanDerWaalsContact C-N 3.35Å; Y47-Y50 PolarHBondContact O-N 2.87Å; Y47-V51 HydrophobicContact CD2-CG2 4.47Å; Y47-V51 HydrophobicContact CE1-CG2 4.15Å; Y47-V51 HydrophobicContact CE2-CG2 4.06Å; Y47-V51 WeakPolarHBondContact O-CG2 3.31Å; Y47-V51 PolarHBondContact O-N 2.95Å |
| 48 | T | 92.6 | Very high | 91.5 | Very high | 61 Ų | 61 | 98 Ų | 98 | 37% | 0.374 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.9 | -47.3 | 176.6 | 57.1 | 0 | 0 | 0 | 0 | 110.6 | M44 V45 Y50 V51 F52 | M44-T48 WeakPolarHBondContact O-CG2 3.4Å; M44-T48 PolarHBondContact O-N 3.31Å; M44-T48 PolarHBondContact O-OG1 3.38Å; V45-T48 PolarHBondContact O-N 2.82Å; V45-T48 PolarHBondContact O-OG1 2.96Å; T48-Y50 VanDerWaalsContact C-N 3.31Å; T48-Y50 PolarHBondContact O-N 3.35Å; T48-V51 PolarHBondContact O-N 2.89Å; T48-V51 VanDerWaalsContact O-N 3.08Å; T48-F52 HydrophobicContact CG2-CE2 4.49Å; T48-F52 WeakPolarHBondContact O-CB 3.4Å; T48-F52 WeakPolarHBondContact O-CD2 3.37Å; T48-F52 PolarHBondContact O-N 3.42Å |
| 49 | A | 92.6 | Very high | 91.4 | Very high | 41 Ų | 41 | 99.9 Ų | 99.9 | 34% | 0.339 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -54.8 | -47 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | V45 V46 V51 F52 I53 | V45-A49 VanDerWaalsContact O-CB 3.26Å; V45-A49 WeakPolarHBondContact O-CB 3.26Å; V45-A49 PolarHBondContact O-N 2.8Å; V46-A49 PolarHBondContact O-N 3.23Å; A49-V51 VanDerWaalsContact C-N 3.32Å; A49-V51 PolarHBondContact O-N 3.22Å; A49-F52 PolarHBondContact O-N 3.43Å; A49-I53 HydrophobicContact CB-CD1 4.27Å; A49-I53 VanDerWaalsContact O-CB 3.31Å; A49-I53 WeakPolarHBondContact O-CB 3.3Å; A49-I53 VanDerWaalsContact O-CD1 3.25Å; A49-I53 WeakPolarHBondContact O-CD1 3.37Å; A49-I53 WeakPolarHBondContact O-CG1 3.32Å; A49-I53 PolarHBondContact O-N 2.88Å |
| 50 | Y | 92.8 | Very high | 91.3 | Very high | 174 Ų | 174 | 96.9 Ų | 96.9 | 68% | 0.682 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -60.9 | -38.5 | 177.4 | 178.7 | -98.1 | 0 | 0 | 0 | 112.8 | V46 Y47 T48 P54 | V46-Y50 VanDerWaalsContact O-CB 3.3Å; V46-Y50 WeakPolarHBondContact O-CB 3.36Å; V46-Y50 PolarHBondContact O-N 3.48Å; Y47-Y50 PolarHBondContact O-N 2.87Å; T48-Y50 VanDerWaalsContact C-N 3.31Å; T48-Y50 PolarHBondContact O-N 3.35Å; Y50-P54 WeakPolarHBondContact O-CD 3.34Å |
| 51 | V | 92.8 | Very high | 91.1 | Very high | 70 Ų | 70 | 102.5 Ų | 102.5 | 42% | 0.424 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -70.9 | -37.8 | 176.8 | 171 | 0 | 0 | 0 | 0 | 111.7 | Y47 T48 A49 P54 | Y47-V51 HydrophobicContact CD2-CG2 4.47Å; Y47-V51 HydrophobicContact CE1-CG2 4.15Å; Y47-V51 HydrophobicContact CE2-CG2 4.06Å; Y47-V51 WeakPolarHBondContact O-CG2 3.31Å; Y47-V51 PolarHBondContact O-N 2.95Å; T48-V51 PolarHBondContact O-N 2.89Å; T48-V51 VanDerWaalsContact O-N 3.08Å; A49-V51 VanDerWaalsContact C-N 3.32Å; A49-V51 PolarHBondContact O-N 3.22Å; V51-P54 WeakPolarHBondContact O-CD 3.11Å; V51-P54 WeakPolarHBondContact O-CG 3.29Å |
| 52 | F | 86.9 | Confident | 90.7 | Very high | 115 Ų | 115 | 103.9 Ų | 103.9 | 50% | 0.504 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -80.5 | -37.1 | -178.3 | -73.4 | -68.4 | 0 | 0 | 0 | 113 | T48 A49 I55 H56 | T48-F52 HydrophobicContact CG2-CE2 4.49Å; T48-F52 WeakPolarHBondContact O-CB 3.4Å; T48-F52 WeakPolarHBondContact O-CD2 3.37Å; T48-F52 PolarHBondContact O-N 3.42Å; A49-F52 PolarHBondContact O-N 3.43Å; F52-I55 VanDerWaalsContact O-CG2 3.24Å; F52-I55 WeakPolarHBondContact O-CG2 2.88Å; F52-I55 PolarHBondContact O-N 2.9Å; F52-I55 VanDerWaalsContact O-N 3.13Å; F52-H56 PolarHBondContact O-CD2 3.2Å; F52-H56 PolarHBondContact O-N 3.43Å; F52-H56 VanDerWaalsContact O-N 3.16Å |
| 53 | I | 91 | Very high | 90.4 | Very high | 90 Ų | 90 | 106.1 Ų | 106.1 | 46% | 0.462 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -50.7 | -47.7 | -179.7 | -74.3 | 161.1 | 0 | 0 | 0 | 114.2 | A49 I55 H56 I57 | A49-I53 HydrophobicContact CB-CD1 4.27Å; A49-I53 VanDerWaalsContact O-CB 3.31Å; A49-I53 WeakPolarHBondContact O-CB 3.3Å; A49-I53 VanDerWaalsContact O-CD1 3.25Å; A49-I53 WeakPolarHBondContact O-CD1 3.37Å; A49-I53 WeakPolarHBondContact O-CG1 3.32Å; A49-I53 PolarHBondContact O-N 2.88Å; I53-I55 VanDerWaalsContact C-N 3.32Å; I53-I55 PolarHBondContact O-N 3.09Å; I53-H56 PolarHBondContact O-N 2.93Å; I53-I57 HydrophobicContact CG2-CD1 3.47Å; I53-I57 VanDerWaalsContact CG2-CD1 3.47Å; I53-I57 HydrophobicContact CG2-CG1 4.25Å; I53-I57 WeakPolarHBondContact O-CG1 3.24Å; I53-I57 PolarHBondContact O-N 3.16Å |
| 54 | P | 86.3 | Confident | 89.8 | Confident | 65 Ų | 65 | 110.5 Ų | 110.5 | 42% | 0.422 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -66 | -32.6 | -178.7 | 24.8 | -34.2 | 0 | 0 | 0 | 112.6 | Y50 V51 R58 | Y50-P54 WeakPolarHBondContact O-CD 3.34Å; V51-P54 WeakPolarHBondContact O-CD 3.11Å; V51-P54 WeakPolarHBondContact O-CG 3.29Å; P54-R58 WeakPolarHBondContact O-CG 2.99Å; P54-R58 PolarHBondContact O-N 3.13Å; P54-R58 VanDerWaalsContact O-N 3.09Å |
| 55 | I | 87.6 | Confident | 89.3 | Confident | 108 Ų | 108 | 108.4 Ų | 108.4 | 55% | 0.554 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -66 | -42.8 | 175.1 | -145.2 | 79.5 | 0 | 0 | 0 | 110.2 | F52 I53 R58 L59 | F52-I55 VanDerWaalsContact O-CG2 3.24Å; F52-I55 WeakPolarHBondContact O-CG2 2.88Å; F52-I55 PolarHBondContact O-N 2.9Å; F52-I55 VanDerWaalsContact O-N 3.13Å; I53-I55 VanDerWaalsContact C-N 3.32Å; I53-I55 PolarHBondContact O-N 3.09Å; I55-R58 PolarHBondContact O-N 2.85Å; I55-L59 PolarHBondContact O-N 2.91Å; I55-L59 VanDerWaalsContact O-N 3.08Å |
| 56 | H | 87.8 | Confident | 88.5 | Confident | 115 Ų | 115 | 111.3 Ų | 111.3 | 53% | 0.532 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -68.5 | -38.4 | -179.7 | -68.4 | -59.7 | 0 | 0 | 0 | 112.1 | F52 I53 L59 A60 | F52-H56 PolarHBondContact O-CD2 3.2Å; F52-H56 PolarHBondContact O-N 3.43Å; F52-H56 VanDerWaalsContact O-N 3.16Å; I53-H56 PolarHBondContact O-N 2.93Å; H56-L59 PolarHBondContact O-N 2.88Å; H56-A60 VanDerWaalsContact O-CB 3.26Å; H56-A60 WeakPolarHBondContact O-CB 3.5Å; H56-A60 PolarHBondContact O-N 3.43Å |
| 57 | I | 89.6 | Confident | 87.9 | Confident | 107 Ų | 107 | 112.5 Ų | 112.5 | 55% | 0.549 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -64.1 | -43.9 | 175.9 | -71.7 | 166.7 | 0 | 0 | 0 | 111.1 | I53 A60 W61 | I53-I57 HydrophobicContact CG2-CD1 3.47Å; I53-I57 VanDerWaalsContact CG2-CD1 3.47Å; I53-I57 HydrophobicContact CG2-CG1 4.25Å; I53-I57 WeakPolarHBondContact O-CG1 3.24Å; I53-I57 PolarHBondContact O-N 3.16Å; I57-A60 PolarHBondContact O-N 3.37Å; I57-W61 VanDerWaalsContact O-CB 3.29Å; I57-W61 WeakPolarHBondContact O-CB 3.28Å; I57-W61 PolarHBondContact O-N 3.03Å |
| 58 | R | 87.6 | Confident | 86.8 | Confident | 192 Ų | 192 | 108.7 Ų | 108.7 | 73% | 0.725 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -59.6 | -48 | 176.8 | -69.1 | -96.5 | -175 | -163.5 | -1.1 | 111 | P54 I55 W61 E62 | P54-R58 WeakPolarHBondContact O-CG 2.99Å; P54-R58 PolarHBondContact O-N 3.13Å; P54-R58 VanDerWaalsContact O-N 3.09Å; I55-R58 PolarHBondContact O-N 2.85Å; R58-W61 PolarHBondContact O-N 3.47Å; R58-E62 WeakPolarHBondContact O-CG 3.5Å; R58-E62 PolarHBondContact O-N 2.84Å |
| 59 | L | 87.4 | Confident | 85.4 | Confident | 94 Ų | 94 | 107.7 Ų | 107.7 | 49% | 0.492 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -63.3 | -46.7 | 179.4 | -135.7 | 79.3 | 0 | 0 | 0 | 111.5 | I55 H56 W61 E62 F63 | I55-L59 PolarHBondContact O-N 2.91Å; I55-L59 VanDerWaalsContact O-N 3.08Å; H56-L59 PolarHBondContact O-N 2.88Å; L59-W61 VanDerWaalsContact C-N 3.29Å; L59-W61 PolarHBondContact O-N 3.28Å; L59-E62 PolarHBondContact O-N 2.86Å; L59-F63 HydrophobicContact CD2-CE2 4.41Å; L59-F63 HydrophobicContact CG-CD2 4.42Å; L59-F63 HydrophobicContact CG-CE2 4.42Å; L59-F63 WeakPolarHBondContact O-CD2 3.24Å; L59-F63 PolarHBondContact O-N 3.38Å |
| 60 | A | 88.4 | Confident | 83.8 | Confident | 60 Ų | 60 | 113.9 Ų | 113.9 | 50% | 0.496 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -59.8 | -40.8 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | H56 I57 F64 | H56-A60 VanDerWaalsContact O-CB 3.26Å; H56-A60 WeakPolarHBondContact O-CB 3.5Å; H56-A60 PolarHBondContact O-N 3.43Å; I57-A60 PolarHBondContact O-N 3.37Å; A60-F64 VanDerWaalsContact O-CB 3.28Å; A60-F64 WeakPolarHBondContact O-CB 3.26Å; A60-F64 PolarHBondContact O-N 2.87Å |
| 61 | W | 87.4 | Confident | 82 | Confident | 193 Ų | 193 | 112.6 Ų | 112.6 | 73% | 0.731 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -63.8 | -46.1 | 175.9 | -174.2 | -90.8 | 0 | 0 | 0 | 112.5 | I57 R58 L59 F64 S65 | I57-W61 VanDerWaalsContact O-CB 3.29Å; I57-W61 WeakPolarHBondContact O-CB 3.28Å; I57-W61 PolarHBondContact O-N 3.03Å; R58-W61 PolarHBondContact O-N 3.47Å; L59-W61 VanDerWaalsContact C-N 3.29Å; L59-W61 PolarHBondContact O-N 3.28Å; W61-F64 PolarHBondContact O-N 3.37Å; W61-S65 VanDerWaalsContact O-CB 3.25Å; W61-S65 WeakPolarHBondContact O-CB 3.25Å; W61-S65 PolarHBondContact O-N 3.26Å |
| 62 | E | 85.6 | Confident | 80.1 | Confident | 118 Ų | 118 | 112.6 Ų | 112.6 | 55% | 0.551 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -64 | -40.9 | 177.5 | -73.4 | -167.2 | 160.1 | 0 | 0 | 112.6 | R58 L59 K66 | R58-E62 WeakPolarHBondContact O-CG 3.5Å; R58-E62 PolarHBondContact O-N 2.84Å; L59-E62 PolarHBondContact O-N 2.86Å; E62-K66 WeakPolarHBondContact O-CB 3.5Å; E62-K66 PolarHBondContact O-N 3.39Å |
| 63 | F | 87.1 | Confident | 78.4 | Confident | 134 Ų | 134 | 111.4 Ų | 111.4 | 59% | 0.588 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -61.8 | -48 | 174 | -96.2 | -79.3 | 0 | 0 | 0 | 111.6 | L59 K66 I67 | L59-F63 HydrophobicContact CD2-CE2 4.41Å; L59-F63 HydrophobicContact CG-CD2 4.42Å; L59-F63 HydrophobicContact CG-CE2 4.42Å; L59-F63 WeakPolarHBondContact O-CD2 3.24Å; L59-F63 PolarHBondContact O-N 3.38Å; F63-K66 PolarHBondContact O-N 3.33Å; F63-I67 WeakPolarHBondContact O-CB 3.45Å; F63-I67 PolarHBondContact O-N 3.08Å |
| 64 | F | 83.1 | Confident | 76.6 | Confident | 144 Ų | 144 | 113.5 Ų | 113.5 | 63% | 0.632 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -66.1 | -41.1 | -178.5 | -164.5 | -95.1 | 0 | 0 | 0 | 111.9 | A60 W61 I67 C68 | A60-F64 VanDerWaalsContact O-CB 3.28Å; A60-F64 WeakPolarHBondContact O-CB 3.26Å; A60-F64 PolarHBondContact O-N 2.87Å; W61-F64 PolarHBondContact O-N 3.37Å; F64-I67 PolarHBondContact O-N 2.92Å; F64-C68 HydrophobicContact CE1-CB 4.49Å; F64-C68 VanDerWaalsContact O-CB 3.24Å; F64-C68 WeakPolarHBondContact O-CB 3.46Å; F64-C68 PolarHBondContact O-N 2.94Å |
| 65 | S | 82.4 | Confident | 74.9 | Confident | 71 Ų | 71 | 115.1 Ų | 115.1 | 50% | 0.497 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -61.5 | -45.7 | 175.2 | 177.1 | 0 | 0 | 0 | 0 | 112 | W61 G69 | W61-S65 VanDerWaalsContact O-CB 3.25Å; W61-S65 WeakPolarHBondContact O-CB 3.25Å; W61-S65 PolarHBondContact O-N 3.26Å; S65-G69 WeakPolarHBondContact O-CA 3.38Å; S65-G69 PolarHBondContact O-N 2.98Å |
| 66 | K | 79.9 | Confident | 72.9 | Confident | 148 Ų | 148 | 119.4 Ų | 119.4 | 64% | 0.643 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -61.4 | -45.6 | 175.5 | -82.3 | -170.1 | 169.3 | 81.4 | 0 | 112.1 | E62 F63 Y70 | E62-K66 WeakPolarHBondContact O-CB 3.5Å; E62-K66 PolarHBondContact O-N 3.39Å; F63-K66 PolarHBondContact O-N 3.33Å; K66-Y70 WeakPolarHBondContact O-CB 3.38Å; K66-Y70 PolarHBondContact O-N 3.37Å |
| 67 | I | 81.9 | Confident | 72.2 | Confident | 115 Ų | 115 | 119.7 Ų | 119.7 | 59% | 0.59 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -64.9 | -46.2 | 179.7 | -84.7 | 160.7 | 0 | 0 | 0 | 112 | F63 F64 Y70 H71 | F63-I67 WeakPolarHBondContact O-CB 3.45Å; F63-I67 PolarHBondContact O-N 3.08Å; F64-I67 PolarHBondContact O-N 2.92Å; I67-Y70 PolarHBondContact O-N 3.24Å; I67-H71 PolarHBondContact O-N 3.24Å |
| 68 | C | 72 | Confident | 71.3 | Confident | 67 Ų | 67 | 120.3 Ų | 120.3 | 45% | 0.453 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -71.9 | -36.1 | -179.1 | -157.8 | 0 | 0 | 0 | 0 | 111.8 | F64 H71 S72 | F64-C68 HydrophobicContact CE1-CB 4.49Å; F64-C68 VanDerWaalsContact O-CB 3.24Å; F64-C68 WeakPolarHBondContact O-CB 3.46Å; F64-C68 PolarHBondContact O-N 2.94Å; C68-H71 PolarHBondContact O-N 3.45Å; C68-S72 PolarHBondContact O-N 3.22Å; C68-S72 PolarHBondContact O-OG 3.47Å |
| 69 | G | 64.5 | Low | 70.4 | Confident | 40 Ų | 40 | 116.3 Ų | 116.3 | 41% | 0.412 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -67.2 | -37.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | S65 S72 S73 | S65-G69 WeakPolarHBondContact O-CA 3.38Å; S65-G69 PolarHBondContact O-N 2.98Å; G69-S72 WeakPolarHBondContact O-CB 3.48Å; G69-S72 PolarHBondContact O-N 3.29Å; G69-S73 PolarHBondContact O-N 2.95Å |
| 70 | Y | 57.3 | Low | 69.4 | Low | 171 Ų | 171 | 117.6 Ų | 117.6 | 67% | 0.671 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -65.2 | -39.8 | 175.2 | -127.5 | -102.3 | 0 | 0 | 0 | 112.2 | K66 I67 S72 S73 I74 | K66-Y70 WeakPolarHBondContact O-CB 3.38Å; K66-Y70 PolarHBondContact O-N 3.37Å; I67-Y70 PolarHBondContact O-N 3.24Å; Y70-S72 PolarHBondContact O-N 3.22Å; Y70-S73 PolarHBondContact O-N 3Å; Y70-I74 HydrophobicContact CD1-CD1 3.93Å; Y70-I74 HydrophobicContact CE1-CD1 4.33Å; Y70-I74 PolarHBondContact O-N 3.33Å |
| 71 | H | 55 | Low | 68.2 | Low | 147 Ų | 147 | 121.3 Ų | 121.3 | 68% | 0.681 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -60.3 | -35.3 | 175 | -166.5 | 103.9 | 0 | 0 | 0 | 112 | I67 C68 S73 | I67-H71 PolarHBondContact O-N 3.24Å; C68-H71 PolarHBondContact O-N 3.45Å; H71-S73 VanDerWaalsContact C-N 3.33Å; H71-S73 PolarHBondContact O-N 3.39Å |
| 72 | S | 53.4 | Low | 66.9 | Low | 71 Ų | 71 | 116.5 Ų | 116.5 | 50% | 0.497 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -70.9 | -25.6 | 179.9 | -50.9 | 0 | 0 | 0 | 0 | 113.6 | C68 G69 Y70 N76 | C68-S72 PolarHBondContact O-N 3.22Å; C68-S72 PolarHBondContact O-OG 3.47Å; G69-S72 WeakPolarHBondContact O-CB 3.48Å; G69-S72 PolarHBondContact O-N 3.29Å; Y70-S72 PolarHBondContact O-N 3.22Å; S72-N76 PolarHBondContact O-ND2 3.02Å |
| 73 | S | 50.7 | Low | 65.6 | Low | 90 Ų | 90 | 116.4 Ų | 116.4 | 63% | 0.629 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -92.8 | -16.7 | -179.6 | -168.7 | 0 | 0 | 0 | 0 | 114.2 | G69 Y70 H71 | G69-S73 PolarHBondContact O-N 2.95Å; Y70-S73 PolarHBondContact O-N 3Å; H71-S73 VanDerWaalsContact C-N 3.33Å; H71-S73 PolarHBondContact O-N 3.39Å |
| 74 | I | 54.6 | Low | 63.9 | Low | 133 Ų | 133 | 115 Ų | 115 | 68% | 0.682 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -87.3 | -16.2 | 175 | -77.7 | 168.6 | 0 | 0 | 0 | 111.9 | Y70 | Y70-I74 HydrophobicContact CD1-CD1 3.93Å; Y70-I74 HydrophobicContact CE1-CD1 4.33Å; Y70-I74 PolarHBondContact O-N 3.33Å |
| 75 | S | 49.4 | Very low | 62.3 | Low | 99 Ų | 99 | 112.6 Ų | 112.6 | 69% | 0.692 | 63% | 0.626 | S | S | * | * | trans | -96.4 | 2.9 | -179.6 | -170.9 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 76 | N | 47 | Very low | 60.5 | Low | 199 Ų | 199 | 116.4 Ų | 116.4 | 100% | 1.064 | 64% | 0.638 | S | S | * | * | trans | -112.3 | 0 | 168.9 | -77.1 | -77.1 | 0 | 0 | 0 | 109.7 | S72 | S72-N76 PolarHBondContact O-ND2 3.02Š|
Retrieved 76 of 76 residues in 21.4 ms
(Link to these results)