| 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 | 57 | Low | 74.1 | Confident | 207 Ų | 207 | 153.3 Ų | 153.3 | 100% | 1.02 | 77% | 0.77 | S | S | * | * | 0 | -31.7 | 0 | -156.4 | 172 | -80.7 | 0 | 0 | 112.6 | |||||
| 2 | E | 67.3 | Low | 74.7 | Confident | 176 Ų | 176 | 150.1 Ų | 150.1 | 82% | 0.822 | 77% | 0.768 | S | S | * | * | trans | -77.9 | -29.4 | -179.9 | -60.4 | -156.4 | 145.7 | 0 | 0 | 115.4 | E4 A5 | E2-E4 VanDerWaalsContact C-N 3.35Å; E2-E4 PolarHBondContact O-N 3.29Å; E2-A5 PolarHBondContact O-N 2.96Å | ||
| 3 | L | 71.5 | Confident | 75.2 | Confident | 155 Ų | 155 | 142.2 Ų | 142.2 | 81% | 0.812 | 73% | 0.731 | S | S | * | * | G | 310 helix | trans | -72.7 | -23 | 178.1 | -85.6 | 159.4 | 0 | 0 | 0 | 114 | A5 M6 | L3-A5 VanDerWaalsContact C-N 3.29Å; L3-M6 PolarHBondContact O-N 2.7Å |
| 4 | E | 71.3 | Confident | 75.6 | Confident | 171 Ų | 171 | 139.4 Ų | 139.4 | 80% | 0.799 | 72% | 0.719 | S | S | * | * | G | 310 helix | trans | -77 | -17.8 | 178.8 | -68.6 | 178.1 | 137.8 | 0 | 0 | 112.5 | E2 | E2-E4 VanDerWaalsContact C-N 3.35Å; E2-E4 PolarHBondContact O-N 3.29Å |
| 5 | A | 76.9 | Confident | 75.8 | Confident | 83 Ų | 83 | 135.1 Ų | 135.1 | 69% | 0.686 | 70% | 0.703 | S | S | * | * | G | 310 helix | trans | -87.6 | -7.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | E2 L3 T7 | E2-A5 PolarHBondContact O-N 2.96Å; L3-A5 VanDerWaalsContact C-N 3.29Å; A5-T7 PolarHBondContact O-N 2.98Å |
| 6 | M | 78.6 | Confident | 76.4 | Confident | 149 Ų | 149 | 130.6 Ų | 130.6 | 73% | 0.734 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -75.7 | 124.3 | 178.6 | -77.1 | -97.1 | 179.8 | 0 | 0 | 110.4 | L3 | L3-M6 PolarHBondContact O-N 2.7Š|
| 7 | T | 80.6 | Confident | 76.9 | Confident | 133 Ų | 133 | 126.5 Ų | 126.5 | 82% | 0.816 | 67% | 0.673 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 143.9 | 174.1 | 49.9 | 0 | 0 | 0 | 0 | 110.5 | A5 Y9 | A5-T7 PolarHBondContact O-N 2.98Å; T7-Y9 PolarHBondContact O-N 3.5Å |
| 8 | R | 79.4 | Confident | 77.3 | Confident | 244 Ų | 244 | 120.2 Ų | 120.2 | 92% | 0.921 | 64% | 0.639 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 122.8 | -179.4 | -152.6 | 177.2 | -170.2 | 179.4 | 2.6 | 109.3 | T10 | R8-T10 PolarHBondContact O-N 3.43Å; R8-T10 VanDerWaalsContact O-N 3.15Å |
| 9 | Y | 79.1 | Confident | 77.8 | Confident | 200 Ų | 200 | 115.7 Ų | 115.7 | 78% | 0.784 | 62% | 0.617 | S | S | * | * | trans | -67 | 114.2 | 173.5 | -179.8 | -101.8 | 0 | 0 | 0 | 109.3 | T7 | T7-Y9 PolarHBondContact O-N 3.5Š| ||
| 10 | T | 78.2 | Confident | 78.4 | Confident | 114 Ų | 114 | 116.8 Ų | 116.8 | 70% | 0.699 | 62% | 0.617 | S | S | * | * | trans | -102.5 | 142.7 | 166.6 | -177.2 | 0 | 0 | 0 | 0 | 108.3 | R8 | R8-T10 PolarHBondContact O-N 3.43Å; R8-T10 VanDerWaalsContact O-N 3.15Å | ||
| 11 | S | 75.4 | Confident | 78.8 | Confident | 54 Ų | 54 | 114.1 Ų | 114.1 | 38% | 0.378 | 60% | 0.603 | S | S | . | * | trans | -55 | 132.8 | 171.9 | 177.8 | 0 | 0 | 0 | 0 | 109.3 | V13 | S11-V13 WeakPolarHBondContact CB-O 3.37Å; S11-V13 PolarHBondContact O-N 3.23Å; S11-V13 PolarHBondContact OG-N 3.08Å; S11-V13 PolarHBondContact OG-O 3.46Å | ||
| 12 | P | 81.6 | Confident | 80.4 | Confident | 115 Ų | 115 | 104.3 Ų | 104.3 | 75% | 0.747 | 56% | 0.555 | S | S | * | * | S | Bend | trans | -63.9 | -20.2 | 178.8 | 25.6 | -33.9 | 0 | 0 | 0 | 112.4 | ||
| 13 | V | 80.5 | Confident | 81.6 | Confident | 48 Ų | 48 | 100.3 Ų | 100.3 | 29% | 0.291 | 54% | 0.543 | S | S | . | . | S | Bend | trans | -124.2 | 128.6 | 175.4 | -176.9 | 0 | 0 | 0 | 0 | 109 | S11 V17 F18 L21 | S11-V13 WeakPolarHBondContact CB-O 3.37Å; S11-V13 PolarHBondContact O-N 3.23Å; S11-V13 PolarHBondContact OG-N 3.08Å; S11-V13 PolarHBondContact OG-O 3.46Å; V13-V17 HydrophobicContact CG1-CG2 3.41Å; V13-V17 VanDerWaalsContact CG1-CG2 3.41Å; V13-F18 HydrophobicContact CB-CE1 3.84Å; V13-F18 HydrophobicContact CG1-CD1 3.89Å; V13-F18 HydrophobicContact CG1-CE1 3.51Å; V13-L21 HydrophobicContact CG1-CD1 4.2Å |
| 14 | N | 81.1 | Confident | 82.7 | Confident | 103 Ų | 103 | 96.8 Ų | 96.8 | 55% | 0.551 | 53% | 0.527 | S | S | * | . | trans | -67.5 | 129 | 178.6 | -175 | -19.6 | 0 | 0 | 0 | 110.1 | A16 V17 | N14-A16 PolarHBondContact O-N 3.24Å; N14-A16 PolarHBondContact OD1-N 2.92Å; N14-V17 HydrophobicContact CB-CG2 4.42Å; N14-V17 WeakPolarHBondContact O-CG2 3.23Å; N14-V17 PolarHBondContact O-N 2.91Å | ||
| 15 | P | 79.3 | Confident | 83.6 | Confident | 75 Ų | 75 | 90 Ų | 90 | 49% | 0.487 | 50% | 0.496 | S | S | . | . | G | 310 helix | trans | -53.3 | -27.6 | 177.2 | -28.5 | 35.6 | 0 | 0 | 0 | 115.1 | V17 F18 | P15-V17 PolarHBondContact O-N 3.31Å; P15-F18 HydrophobicContact CB-CD2 4.1Å; P15-F18 HydrophobicContact CB-CE2 3.92Å; P15-F18 HydrophobicContact CG-CE2 4.19Å; P15-F18 WeakPolarHBondContact O-CB 3.15Å; P15-F18 PolarHBondContact O-N 2.98Å |
| 16 | A | 84.3 | Confident | 84.4 | Confident | 63 Ų | 63 | 87.4 Ų | 87.4 | 52% | 0.521 | 47% | 0.471 | S | S | . | . | G | 310 helix | trans | -63.3 | -23.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | N14 H20 | N14-A16 PolarHBondContact O-N 3.24Å; N14-A16 PolarHBondContact OD1-N 2.92Å; A16-H20 PolarHBondContact O-ND1 3.27Å |
| 17 | V | 85.8 | Confident | 85.2 | Confident | 61 Ų | 61 | 82.9 Ų | 82.9 | 37% | 0.37 | 46% | 0.457 | S | S | . | . | G | 310 helix | trans | -93.1 | -11 | 179.9 | -59.8 | 0 | 0 | 0 | 0 | 113.7 | V13 N14 P15 H20 L21 | V13-V17 HydrophobicContact CG1-CG2 3.41Å; V13-V17 VanDerWaalsContact CG1-CG2 3.41Å; N14-V17 HydrophobicContact CB-CG2 4.42Å; N14-V17 WeakPolarHBondContact O-CG2 3.23Å; N14-V17 PolarHBondContact O-N 2.91Å; P15-V17 PolarHBondContact O-N 3.31Å; V17-H20 PolarHBondContact O-N 3.32Å; V17-L21 HydrophobicContact CB-CD1 4.44Å; V17-L21 HydrophobicContact CG2-CD1 4.03Å; V17-L21 WeakPolarHBondContact O-CG 3.3Å; V17-L21 PolarHBondContact O-N 3.05Å |
| 18 | F | 83.2 | Confident | 85.8 | Confident | 13 Ų | 13 | 79.5 Ų | 79.5 | 6% | 0.057 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -53 | -52 | 177 | -64.8 | -20.7 | 0 | 0 | 0 | 113.9 | V13 P15 H20 L21 T22 F70 L73 W74 | V13-F18 HydrophobicContact CB-CE1 3.84Å; V13-F18 HydrophobicContact CG1-CD1 3.89Å; V13-F18 HydrophobicContact CG1-CE1 3.51Å; P15-F18 HydrophobicContact CB-CD2 4.1Å; P15-F18 HydrophobicContact CB-CE2 3.92Å; P15-F18 HydrophobicContact CG-CE2 4.19Å; P15-F18 WeakPolarHBondContact O-CB 3.15Å; P15-F18 PolarHBondContact O-N 2.98Å; F18-H20 VanDerWaalsContact C-N 3.31Å; F18-H20 PolarHBondContact O-N 3.37Å; F18-L21 PolarHBondContact O-N 3.43Å; F18-T22 WeakPolarHBondContact O-CB 3.46Å; F18-T22 PolarHBondContact O-N 2.89Å; F18-T22 PolarHBondContact O-OG1 3Å; F18-F70 HydrophobicContact CD1-CD1 4.01Å; F18-F70 HydrophobicContact CD1-CE1 4.22Å; F18-F70 HydrophobicContact CE1-CD1 4.47Å; F18-F70 HydrophobicContact CE1-CE1 4.37Å; F18-L73 HydrophobicContact CD2-CB 4.38Å; F18-L73 HydrophobicContact CE1-CD2 4.4Å; F18-L73 HydrophobicContact CE2-CB 4.38Å; F18-L73 HydrophobicContact CE2-CD2 4.27Å; F18-L73 HydrophobicContact CZ-CD2 3.99Å; F18-W74 HydrophobicContact CB-CB 4.47Å |
| 19 | P | 87.6 | Confident | 86.4 | Confident | 34 Ų | 34 | 67.9 Ų | 67.9 | 22% | 0.221 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -62.1 | -38.3 | -178.3 | 21.8 | -33 | 0 | 0 | 0 | 112.9 | V23 W74 | P19-V23 VanDerWaalsContact O-CG2 3.29Å; P19-V23 WeakPolarHBondContact O-CG2 3.29Å; P19-V23 PolarHBondContact O-N 3.42Å; P19-V23 VanDerWaalsContact O-N 3.1Å; P19-W74 HydrophobicContact CB-CD2 4.27Å; P19-W74 HydrophobicContact CB-CG 4.47Å; P19-W74 HydrophobicContact CB-CZ2 4.31Å |
| 20 | H | 88.6 | Confident | 87.1 | Confident | 137 Ų | 137 | 63.7 Ų | 63.7 | 63% | 0.634 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -65.6 | -46 | 179 | -62.7 | 87.7 | 0 | 0 | 0 | 111.2 | A16 V17 F18 V24 | A16-H20 PolarHBondContact O-ND1 3.27Å; V17-H20 PolarHBondContact O-N 3.32Å; F18-H20 VanDerWaalsContact C-N 3.31Å; F18-H20 PolarHBondContact O-N 3.37Å; H20-V24 WeakPolarHBondContact O-CG2 3.41Å; H20-V24 PolarHBondContact O-N 3.44Å |
| 21 | L | 87.9 | Confident | 87.9 | Confident | 61 Ų | 61 | 63.9 Ų | 63.9 | 32% | 0.319 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -63.5 | -48.4 | 177.1 | -71.2 | 171.4 | 0 | 0 | 0 | 111.1 | V13 V17 F18 V23 V24 L25 F70 | V13-L21 HydrophobicContact CG1-CD1 4.2Å; V17-L21 HydrophobicContact CB-CD1 4.44Å; V17-L21 HydrophobicContact CG2-CD1 4.03Å; V17-L21 WeakPolarHBondContact O-CG 3.3Å; V17-L21 PolarHBondContact O-N 3.05Å; F18-L21 PolarHBondContact O-N 3.43Å; L21-V23 VanDerWaalsContact C-N 3.33Å; L21-V23 PolarHBondContact O-N 3.27Å; L21-V24 PolarHBondContact O-N 3.36Å; L21-L25 HydrophobicContact CB-CD1 4.18Å; L21-L25 HydrophobicContact CD2-CD1 4.28Å; L21-L25 WeakPolarHBondContact O-CB 3.4Å; L21-L25 WeakPolarHBondContact O-CD1 3.2Å; L21-L25 PolarHBondContact O-N 2.92Å; L21-F70 HydrophobicContact CD1-CE1 4.12Å; L21-F70 HydrophobicContact CD1-CZ 4.25Å |
| 22 | T | 90.5 | Very high | 88.6 | Confident | 2 Ų | 2 | 64.3 Ų | 64.3 | 1% | 0.012 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -53 | -50.2 | 178.3 | -60.9 | 0 | 0 | 0 | 0 | 111.8 | F18 V24 L26 F70 L71 | F18-T22 WeakPolarHBondContact O-CB 3.46Å; F18-T22 PolarHBondContact O-N 2.89Å; F18-T22 PolarHBondContact O-OG1 3Å; T22-V24 PolarHBondContact O-N 3.26Å; T22-L26 HydrophobicContact CG2-CD1 3.68Å; T22-L26 HydrophobicContact CG2-CG 4.28Å; T22-L26 WeakPolarHBondContact O-CB 3.16Å; T22-L26 VanDerWaalsContact O-CG 3.29Å; T22-L26 WeakPolarHBondContact O-CG 3.43Å; T22-L26 PolarHBondContact O-N 2.9Å; T22-F70 WeakPolarHBondContact OG1-CB 3.35Å; T22-F70 PolarHBondContact OG1-O 2.92Å; T22-L71 HydrophobicContact CG2-CB 3.71Å; T22-L71 HydrophobicContact CG2-CD1 3.81Å; T22-L71 HydrophobicContact CG2-CG 4.38Å; T22-L71 PolarHBondContact OG1-N 3.03Å |
| 23 | V | 92.4 | Very high | 89.1 | Confident | 92 Ų | 92 | 60.6 Ų | 60.6 | 56% | 0.558 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -64 | -44.4 | -177.4 | 172.6 | 0 | 0 | 0 | 0 | 111.3 | P19 L21 A27 | P19-V23 VanDerWaalsContact O-CG2 3.29Å; P19-V23 WeakPolarHBondContact O-CG2 3.29Å; P19-V23 PolarHBondContact O-N 3.42Å; P19-V23 VanDerWaalsContact O-N 3.1Å; L21-V23 VanDerWaalsContact C-N 3.33Å; L21-V23 PolarHBondContact O-N 3.27Å; V23-A27 WeakPolarHBondContact O-CB 3.24Å; V23-A27 PolarHBondContact O-N 3.3Å |
| 24 | V | 93.6 | Very high | 89.6 | Confident | 81 Ų | 81 | 60.9 Ų | 60.9 | 49% | 0.491 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -65.6 | -48.6 | -179.8 | 172.6 | 0 | 0 | 0 | 0 | 111.2 | H20 L21 T22 A27 I28 | H20-V24 WeakPolarHBondContact O-CG2 3.41Å; H20-V24 PolarHBondContact O-N 3.44Å; L21-V24 PolarHBondContact O-N 3.36Å; T22-V24 PolarHBondContact O-N 3.26Å; V24-A27 PolarHBondContact O-N 2.87Å; V24-I28 HydrophobicContact CG1-CD1 3.87Å; V24-I28 WeakPolarHBondContact O-CG1 3.44Å; V24-I28 PolarHBondContact O-N 3.46Å; V24-I28 VanDerWaalsContact O-N 3.11Å |
| 25 | L | 92.1 | Very high | 90 | Very high | 28 Ų | 28 | 62.4 Ų | 62.4 | 15% | 0.147 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -64.9 | -42.2 | -179.2 | -83.1 | 86.6 | 0 | 0 | 0 | 111.7 | L21 G29 F66 F70 | L21-L25 HydrophobicContact CB-CD1 4.18Å; L21-L25 HydrophobicContact CD2-CD1 4.28Å; L21-L25 WeakPolarHBondContact O-CB 3.4Å; L21-L25 WeakPolarHBondContact O-CD1 3.2Å; L21-L25 PolarHBondContact O-N 2.92Å; L25-G29 PolarHBondContact O-N 3.33Å; L25-F66 HydrophobicContact CD2-CB 3.37Å; L25-F66 HydrophobicContact CD2-CG 4.44Å; L25-F70 HydrophobicContact CD2-CD2 4.32Å; L25-F70 HydrophobicContact CD2-CE2 4.44Å |
| 26 | L | 93.1 | Very high | 90.5 | Very high | 29 Ų | 29 | 61.1 Ų | 61.1 | 15% | 0.152 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -69.1 | -39 | 177.2 | -74.5 | -179 | 0 | 0 | 0 | 112.7 | T22 G29 M30 M64 V68 L71 | T22-L26 HydrophobicContact CG2-CD1 3.68Å; T22-L26 HydrophobicContact CG2-CG 4.28Å; T22-L26 WeakPolarHBondContact O-CB 3.16Å; T22-L26 VanDerWaalsContact O-CG 3.29Å; T22-L26 WeakPolarHBondContact O-CG 3.43Å; T22-L26 PolarHBondContact O-N 2.9Å; L26-G29 PolarHBondContact O-N 3.48Å; L26-M30 HydrophobicContact CB-CE 4.08Å; L26-M30 VanDerWaalsContact O-CB 3.29Å; L26-M30 WeakPolarHBondContact O-CB 3.26Å; L26-M30 WeakPolarHBondContact O-CG 3.33Å; L26-M30 PolarHBondContact O-N 2.87Å; L26-M64 HydrophobicContact CD2-SD 4.16Å; L26-V68 HydrophobicContact CD2-CG2 4.21Å; L26-L71 HydrophobicContact CD1-CB 4.46Å; L26-L71 HydrophobicContact CD1-CD1 4.47Å; L26-L71 HydrophobicContact CD1-CD2 4.33Å |
| 27 | A | 94.4 | Very high | 90.7 | Very high | 53 Ų | 53 | 64 Ų | 64 | 44% | 0.438 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -62.4 | -46.4 | 178 | 0 | 0 | 0 | 0 | 0 | 111.3 | V23 V24 F31 | V23-A27 WeakPolarHBondContact O-CB 3.24Å; V23-A27 PolarHBondContact O-N 3.3Å; V24-A27 PolarHBondContact O-N 2.87Å; A27-F31 WeakPolarHBondContact O-CB 3.45Å; A27-F31 PolarHBondContact O-N 3.18Å |
| 28 | I | 93.6 | Very high | 90.9 | Very high | 63 Ų | 63 | 65.5 Ų | 65.5 | 32% | 0.323 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -66.2 | -44.5 | 177 | -64.5 | 170.4 | 0 | 0 | 0 | 110.4 | V24 F31 F32 F63 | V24-I28 HydrophobicContact CG1-CD1 3.87Å; V24-I28 WeakPolarHBondContact O-CG1 3.44Å; V24-I28 PolarHBondContact O-N 3.46Å; V24-I28 VanDerWaalsContact O-N 3.11Å; I28-F31 WeakPolarHBondContact O-CB 3.29Å; I28-F31 PolarHBondContact O-N 3.5Å; I28-F32 HydrophobicContact CG2-CD2 3.66Å; I28-F32 HydrophobicContact CG2-CE2 3.52Å; I28-F32 VanDerWaalsContact O-CD2 3.24Å; I28-F32 WeakPolarHBondContact O-CD2 3.32Å; I28-F32 PolarHBondContact O-N 3.45Å; I28-F63 HydrophobicContact CG2-CD1 4.2Å; I28-F63 HydrophobicContact CG2-CD2 4.31Å; I28-F63 HydrophobicContact CG2-CE1 4.42Å; I28-F63 HydrophobicContact CG2-CG 4.16Å |
| 29 | G | 92.9 | Very high | 91.1 | Very high | 0 Ų | 0 | 66.6 Ų | 66.6 | 0% | 0 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -57.7 | -50.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | L25 L26 F31 F32 T33 M64 | L25-G29 PolarHBondContact O-N 3.33Å; L26-G29 PolarHBondContact O-N 3.48Å; G29-F31 VanDerWaalsContact C-N 3.3Å; G29-F31 PolarHBondContact O-N 3.26Å; G29-F32 PolarHBondContact O-N 2.88Å; G29-T33 PolarHBondContact O-N 3.08Å; G29-T33 PolarHBondContact O-OG1 2.98Å; G29-M64 VanDerWaalsContact C-SD 3.59Å |
| 30 | M | 93.9 | Very high | 90.9 | Very high | 112 Ų | 112 | 68.1 Ų | 68.1 | 55% | 0.552 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -58.8 | -40.8 | 176.6 | -82.1 | -171.3 | -85.8 | 0 | 0 | 112.3 | L26 T33 A34 M64 | L26-M30 HydrophobicContact CB-CE 4.08Å; L26-M30 VanDerWaalsContact O-CB 3.29Å; L26-M30 WeakPolarHBondContact O-CB 3.26Å; L26-M30 WeakPolarHBondContact O-CG 3.33Å; L26-M30 PolarHBondContact O-N 2.87Å; M30-T33 PolarHBondContact O-N 2.69Å; M30-A34 WeakPolarHBondContact O-CB 3.44Å; M30-A34 PolarHBondContact O-N 2.77Å; M30-M64 VanDerWaalsContact CA-CE 3.44Å; M30-M64 HydrophobicContact CB-CE 4.09Å; M30-M64 HydrophobicContact CG-CE 3.51Å; M30-M64 HydrophobicContact CG-SD 4.31Å |
| 31 | F | 93.8 | Very high | 90.9 | Very high | 117 Ų | 117 | 67.7 Ų | 67.7 | 51% | 0.513 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -60.7 | -49.2 | 176.4 | 177.5 | -98.1 | 0 | 0 | 0 | 112.1 | A27 I28 G29 A34 W35 | A27-F31 WeakPolarHBondContact O-CB 3.45Å; A27-F31 PolarHBondContact O-N 3.18Å; I28-F31 WeakPolarHBondContact O-CB 3.29Å; I28-F31 PolarHBondContact O-N 3.5Å; G29-F31 VanDerWaalsContact C-N 3.3Å; G29-F31 PolarHBondContact O-N 3.26Å; F31-A34 PolarHBondContact O-N 3.11Å; F31-W35 AromaticContact CE1-CE3 3.82Å; F31-W35 HydrophobicContact CE1-CE3 3.82Å; F31-W35 HydrophobicContact CE1-CZ3 4.25Å; F31-W35 AromaticContact CZ-CE3 3.64Å; F31-W35 HydrophobicContact CZ-CE3 3.64Å; F31-W35 AromaticContact CZ-CZ3 3.88Å; F31-W35 HydrophobicContact CZ-CZ3 3.88Å; F31-W35 WeakPolarHBondContact O-CB 3.21Å; F31-W35 PolarHBondContact O-N 2.89Å |
| 32 | F | 90.3 | Very high | 90.6 | Very high | 64 Ų | 64 | 69.7 Ų | 69.7 | 28% | 0.281 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -67.8 | -35.3 | 178.7 | -77.7 | -69.6 | 0 | 0 | 0 | 112.8 | I28 G29 W35 F36 V59 A60 | I28-F32 HydrophobicContact CG2-CD2 3.66Å; I28-F32 HydrophobicContact CG2-CE2 3.52Å; I28-F32 VanDerWaalsContact O-CD2 3.24Å; I28-F32 WeakPolarHBondContact O-CD2 3.32Å; I28-F32 PolarHBondContact O-N 3.45Å; G29-F32 PolarHBondContact O-N 2.88Å; F32-W35 PolarHBondContact O-N 2.81Å; F32-F36 WeakPolarHBondContact O-CB 3.41Å; F32-F36 PolarHBondContact O-N 2.91Å; F32-V59 HydrophobicContact CD2-CG1 4.17Å; F32-V59 HydrophobicContact CE2-CG1 4.16Å; F32-V59 HydrophobicContact CG-CG1 4.38Å; F32-V59 HydrophobicContact CZ-CG1 4.36Å; F32-A60 HydrophobicContact CB-CB 3.77Å |
| 33 | T | 91.8 | Very high | 89.8 | Confident | 37 Ų | 37 | 70.6 Ų | 70.6 | 23% | 0.227 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -64.8 | -43.9 | 173.8 | -59.1 | 0 | 0 | 0 | 0 | 111.7 | G29 M30 W35 F36 F37 M64 | G29-T33 PolarHBondContact O-N 3.08Å; G29-T33 PolarHBondContact O-OG1 2.98Å; M30-T33 PolarHBondContact O-N 2.69Å; T33-W35 VanDerWaalsContact C-N 3.35Å; T33-F36 WeakPolarHBondContact O-CB 3.49Å; T33-F36 PolarHBondContact O-N 3.24Å; T33-F37 HydrophobicContact CG2-CD2 3.92Å; T33-F37 HydrophobicContact CG2-CE2 3.54Å; T33-F37 WeakPolarHBondContact O-CD2 3.33Å; T33-F37 PolarHBondContact O-N 3.43Å; T33-F37 VanDerWaalsContact O-N 3.08Å; T33-M64 WeakPolarHBondContact OG1-CE 3.39Å |
| 34 | A | 92.3 | Very high | 88.8 | Confident | 53 Ų | 53 | 70.2 Ų | 70.2 | 44% | 0.438 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -62.8 | -43.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | M30 F31 F36 F37 V38 | M30-A34 WeakPolarHBondContact O-CB 3.44Å; M30-A34 PolarHBondContact O-N 2.77Å; F31-A34 PolarHBondContact O-N 3.11Å; A34-F36 VanDerWaalsContact C-N 3.33Å; A34-F36 PolarHBondContact O-N 3.22Å; A34-F37 PolarHBondContact O-N 3Å; A34-V38 WeakPolarHBondContact O-CG2 3.46Å; A34-V38 PolarHBondContact O-N 3.06Å |
| 35 | W | 89.1 | Confident | 87.4 | Confident | 135 Ų | 135 | 75.5 Ų | 75.5 | 51% | 0.511 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -58.2 | -45.8 | 174.8 | -170.9 | -59 | 0 | 0 | 0 | 111.6 | F31 F32 T33 F37 V38 Y39 | F31-W35 AromaticContact CE1-CE3 3.82Å; F31-W35 HydrophobicContact CE1-CE3 3.82Å; F31-W35 HydrophobicContact CE1-CZ3 4.25Å; F31-W35 AromaticContact CZ-CE3 3.64Å; F31-W35 HydrophobicContact CZ-CE3 3.64Å; F31-W35 AromaticContact CZ-CZ3 3.88Å; F31-W35 HydrophobicContact CZ-CZ3 3.88Å; F31-W35 WeakPolarHBondContact O-CB 3.21Å; F31-W35 PolarHBondContact O-N 2.89Å; F32-W35 PolarHBondContact O-N 2.81Å; T33-W35 VanDerWaalsContact C-N 3.35Å; W35-F37 VanDerWaalsContact C-N 3.35Å; W35-F37 PolarHBondContact O-N 3.03Å; W35-V38 PolarHBondContact O-N 2.96Å; W35-Y39 WeakPolarHBondContact O-CB 3.43Å; W35-Y39 PolarHBondContact O-N 2.79Å |
| 36 | F | 88.9 | Confident | 85.9 | Confident | 48 Ų | 48 | 84.2 Ų | 84.2 | 21% | 0.211 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -57.7 | -46.5 | 177.5 | 176.9 | -101.3 | 0 | 0 | 0 | 111.6 | F32 T33 A34 Y39 E40 E53 I56 | F32-F36 WeakPolarHBondContact O-CB 3.41Å; F32-F36 PolarHBondContact O-N 2.91Å; T33-F36 WeakPolarHBondContact O-CB 3.49Å; T33-F36 PolarHBondContact O-N 3.24Å; A34-F36 VanDerWaalsContact C-N 3.33Å; A34-F36 PolarHBondContact O-N 3.22Å; F36-Y39 PolarHBondContact O-N 3.46Å; F36-E40 PolarHBondContact O-N 3.41Å; F36-E53 HydrophobicContact CE2-CB 4.22Å; F36-I56 HydrophobicContact CB-CG2 4.03Å; F36-I56 HydrophobicContact CD2-CG2 4.46Å |
| 37 | F | 89.1 | Confident | 84.8 | Confident | 124 Ų | 124 | 87 Ų | 87 | 54% | 0.544 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -64.1 | -41.6 | 177.1 | -75.3 | -56.7 | 0 | 0 | 0 | 112.9 | T33 A34 W35 Y39 E40 V41 | T33-F37 HydrophobicContact CG2-CD2 3.92Å; T33-F37 HydrophobicContact CG2-CE2 3.54Å; T33-F37 WeakPolarHBondContact O-CD2 3.33Å; T33-F37 PolarHBondContact O-N 3.43Å; T33-F37 VanDerWaalsContact O-N 3.08Å; A34-F37 PolarHBondContact O-N 3Å; W35-F37 VanDerWaalsContact C-N 3.35Å; W35-F37 PolarHBondContact O-N 3.03Å; F37-Y39 VanDerWaalsContact C-N 3.3Å; F37-Y39 PolarHBondContact O-N 3.13Å; F37-E40 PolarHBondContact O-N 3.05Å; F37-V41 VanDerWaalsContact O-CG2 3.3Å; F37-V41 WeakPolarHBondContact O-CG2 3.46Å; F37-V41 PolarHBondContact O-N 2.88Å |
| 38 | V | 89.9 | Confident | 83.5 | Confident | 93 Ų | 93 | 89.7 Ų | 89.7 | 56% | 0.564 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -62.4 | -41.1 | 175.5 | 171.8 | 0 | 0 | 0 | 0 | 110.8 | A34 W35 V41 T42 | A34-V38 WeakPolarHBondContact O-CG2 3.46Å; A34-V38 PolarHBondContact O-N 3.06Å; W35-V38 PolarHBondContact O-N 2.96Å; V38-V41 PolarHBondContact O-N 3.5Å; V38-T42 VanDerWaalsContact O-CB 3.23Å; V38-T42 WeakPolarHBondContact O-CB 3.34Å; V38-T42 PolarHBondContact O-N 3.31Å; V38-T42 PolarHBondContact O-OG1 3.33Å |
| 39 | Y | 86.6 | Confident | 82.8 | Confident | 36 Ų | 36 | 90.3 Ų | 90.3 | 14% | 0.141 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -63.1 | -45.1 | 176.7 | -174.5 | -93.9 | 0 | 0 | 0 | 111.6 | W35 F36 F37 V41 T42 S43 K52 E53 | W35-Y39 WeakPolarHBondContact O-CB 3.43Å; W35-Y39 PolarHBondContact O-N 2.79Å; F36-Y39 PolarHBondContact O-N 3.46Å; F37-Y39 VanDerWaalsContact C-N 3.3Å; F37-Y39 PolarHBondContact O-N 3.13Å; Y39-V41 PolarHBondContact O-N 3.44Å; Y39-T42 PolarHBondContact O-N 3.1Å; Y39-S43 WeakPolarHBondContact O-CB 3.26Å; Y39-S43 PolarHBondContact O-N 2.89Å; Y39-K52 HydrophobicContact CE2-CD 4.12Å; Y39-E53 HydrophobicContact CD1-CG 3.79Å; Y39-E53 HydrophobicContact CE1-CG 3.42Å; Y39-E53 VanDerWaalsContact CE1-CG 3.42Å |
| 40 | E | 84.9 | Confident | 82.3 | Confident | 66 Ų | 66 | 95.3 Ų | 95.3 | 31% | 0.308 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -63.7 | -40.5 | 179.4 | -171.5 | 67.7 | -168.3 | 0 | 0 | 112.3 | F36 F37 R48 | F36-E40 PolarHBondContact O-N 3.41Å; F37-E40 PolarHBondContact O-N 3.05Å; E40-R48 VanDerWaalsContact CD-NH2 3.32Å; E40-R48 IonicContact OE1-CZ 3.55Å; E40-R48 IonicContact OE1-NH1 3.52Å; E40-R48 PolarHBondContact OE1-NH1 3.32Å; E40-R48 IonicContact OE1-NH2 2.77Å; E40-R48 PolarHBondContact OE1-NH2 3.41Å; E40-R48 IonicContact OE2-CZ 3.13Å; E40-R48 IonicContact OE2-NH1 2.69Å; E40-R48 IonicContact OE2-NH2 2.87Å; E40-R48 PolarHBondContact OE2-NH2 3.3Å |
| 41 | V | 87.1 | Confident | 81.9 | Confident | 127 Ų | 127 | 99.2 Ų | 99.2 | 77% | 0.77 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -76.2 | -31 | -179.1 | 174.7 | 0 | 0 | 0 | 0 | 112.2 | F37 V38 Y39 | F37-V41 VanDerWaalsContact O-CG2 3.3Å; F37-V41 WeakPolarHBondContact O-CG2 3.46Å; F37-V41 PolarHBondContact O-N 2.88Å; V38-V41 PolarHBondContact O-N 3.5Å; Y39-V41 PolarHBondContact O-N 3.44Å |
| 42 | T | 83.1 | Confident | 81.4 | Confident | 103 Ų | 103 | 98.5 Ų | 98.5 | 63% | 0.632 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -90.8 | -27.6 | -176.1 | -48 | 0 | 0 | 0 | 0 | 112.5 | V38 Y39 | V38-T42 VanDerWaalsContact O-CB 3.23Å; V38-T42 WeakPolarHBondContact O-CB 3.34Å; V38-T42 PolarHBondContact O-N 3.31Å; V38-T42 PolarHBondContact O-OG1 3.33Å; Y39-T42 PolarHBondContact O-N 3.1Å |
| 43 | S | 73.8 | Confident | 81.3 | Confident | 21 Ų | 21 | 96.2 Ų | 96.2 | 15% | 0.147 | 47% | 0.473 | C | S | . | . | trans | -79.7 | 127.4 | -174.2 | -154.6 | 0 | 0 | 0 | 0 | 111.7 | Y39 T47 | Y39-S43 WeakPolarHBondContact O-CB 3.26Å; Y39-S43 PolarHBondContact O-N 2.89Å; S43-T47 PolarHBondContact OG-O 2.91Å; S43-T47 PolarHBondContact OG-OG1 2.91Å; S43-T47 VanDerWaalsContact OG-OG1 3.08Å | ||
| 44 | T | 71.3 | Confident | 81.2 | Confident | 84 Ų | 84 | 99.6 Ų | 99.6 | 52% | 0.515 | 49% | 0.489 | S | S | . | . | trans | -89.5 | 165.2 | 178.5 | 69.5 | 0 | 0 | 0 | 0 | 110.7 | Y46 T47 R48 | T44-Y46 PolarHBondContact O-N 2.93Å; T44-T47 PolarHBondContact N-OG1 3.41Å; T44-T47 PolarHBondContact O-N 3.28Å; T44-T47 PolarHBondContact O-OG1 2.93Å; T44-T47 PolarHBondContact OG1-OG1 2.91Å; T44-R48 PolarHBondContact O-N 3.02Å | ||
| 45 | K | 62.9 | Low | 81.1 | Confident | 192 Ų | 192 | 102.5 Ų | 102.5 | 84% | 0.835 | 50% | 0.497 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.7 | -24.9 | -176.1 | -165.5 | 179.6 | -178.6 | -176.3 | 0 | 114.7 | ||
| 46 | Y | 61.7 | Low | 81.2 | Confident | 212 Ų | 212 | 97.1 Ų | 97.1 | 83% | 0.831 | 48% | 0.478 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94 | -12.5 | -176.8 | -62.6 | -80.6 | 0 | 0 | 0 | 114.3 | T44 | T44-Y46 PolarHBondContact O-N 2.93Š|
| 47 | T | 69 | Low | 81.2 | Confident | 87 Ų | 87 | 96.6 Ų | 96.6 | 53% | 0.534 | 48% | 0.48 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -116.2 | 4.1 | -177.8 | 57.1 | 0 | 0 | 0 | 0 | 112.9 | S43 T44 | S43-T47 PolarHBondContact OG-O 2.91Å; S43-T47 PolarHBondContact OG-OG1 2.91Å; S43-T47 VanDerWaalsContact OG-OG1 3.08Å; T44-T47 PolarHBondContact N-OG1 3.41Å; T44-T47 PolarHBondContact O-N 3.28Å; T44-T47 PolarHBondContact O-OG1 2.93Å; T44-T47 PolarHBondContact OG1-OG1 2.91Å |
| 48 | R | 67.3 | Low | 81.4 | Confident | 110 Ų | 110 | 95.1 Ų | 95.1 | 42% | 0.415 | 48% | 0.477 | S | S | . | . | trans | -76.1 | 131.7 | 177.4 | -82 | -174.8 | 75.7 | 149.2 | 2.9 | 111 | E40 T44 E53 | E40-R48 VanDerWaalsContact CD-NH2 3.32Å; E40-R48 IonicContact OE1-CZ 3.55Å; E40-R48 IonicContact OE1-NH1 3.52Å; E40-R48 PolarHBondContact OE1-NH1 3.32Å; E40-R48 IonicContact OE1-NH2 2.77Å; E40-R48 PolarHBondContact OE1-NH2 3.41Å; E40-R48 IonicContact OE2-CZ 3.13Å; E40-R48 IonicContact OE2-NH1 2.69Å; E40-R48 IonicContact OE2-NH2 2.87Å; E40-R48 PolarHBondContact OE2-NH2 3.3Å; T44-R48 PolarHBondContact O-N 3.02Å; R48-E53 WeakPolarHBondContact CG-OE1 3.45Å; R48-E53 IonicContact CZ-OE1 3.43Å; R48-E53 IonicContact CZ-OE2 3.55Å; R48-E53 IonicContact NE-OE1 3.69Å; R48-E53 PolarHBondContact NE-OE1 3.02Å; R48-E53 IonicContact NE-OE2 2.88Å; R48-E53 IonicContact NH2-OE1 2.98Å; R48-E53 IonicContact NH2-OE2 3.52Å; R48-E53 PolarHBondContact NH2-OE2 3.44Å | ||
| 49 | D | 79.4 | Confident | 81.6 | Confident | 76 Ų | 76 | 92.4 Ų | 92.4 | 41% | 0.406 | 46% | 0.461 | S | S | . | . | trans | -126.8 | 109.9 | 174.1 | -172.7 | -15.1 | 0 | 0 | 0 | 107.9 | Y51 K52 E53 | D49-Y51 PolarHBondContact O-N 3.16Å; D49-Y51 WeakPolarHBondContact OD1-CB 3.3Å; D49-Y51 WeakPolarHBondContact OD1-CD2 3.34Å; D49-Y51 PolarHBondContact OD1-N 3.5Å; D49-K52 HydrophobicContact CB-CB 4.25Å; D49-K52 PolarHBondContact O-N 3.38Å; D49-E53 WeakPolarHBondContact O-CG 2.99Å; D49-E53 PolarHBondContact O-N 2.89Å; D49-E53 VanDerWaalsContact O-N 3.13Å | ||
| 50 | V | 82.6 | Confident | 81.8 | Confident | 104 Ų | 104 | 91 Ų | 91 | 63% | 0.63 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -62.2 | -31.9 | -177.5 | 180 | 0 | 0 | 0 | 0 | 111 | E53 L54 | V50-E53 PolarHBondContact O-N 3.42Å; V50-L54 VanDerWaalsContact O-CB 3.25Å; V50-L54 WeakPolarHBondContact O-CB 3.3Å; V50-L54 PolarHBondContact O-N 3.43Å |
| 51 | Y | 85.1 | Confident | 82.3 | Confident | 194 Ų | 194 | 91.4 Ų | 91.4 | 76% | 0.761 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -65.9 | -42.3 | 178.8 | -68.4 | -80.2 | 0 | 0 | 0 | 111.3 | D49 L55 | D49-Y51 PolarHBondContact O-N 3.16Å; D49-Y51 WeakPolarHBondContact OD1-CB 3.3Å; D49-Y51 WeakPolarHBondContact OD1-CD2 3.34Å; D49-Y51 PolarHBondContact OD1-N 3.5Å; Y51-L55 WeakPolarHBondContact O-CB 3.25Å; Y51-L55 PolarHBondContact O-N 3.01Å |
| 52 | K | 84.1 | Confident | 82.7 | Confident | 102 Ų | 102 | 89.7 Ų | 89.7 | 44% | 0.443 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -68.2 | -41.9 | 178.1 | -173.6 | 175.8 | 178 | -179.1 | 0 | 111.7 | Y39 D49 L55 I56 | Y39-K52 HydrophobicContact CE2-CD 4.12Å; D49-K52 HydrophobicContact CB-CB 4.25Å; D49-K52 PolarHBondContact O-N 3.38Å; K52-L55 PolarHBondContact O-N 3.06Å; K52-I56 HydrophobicContact CG-CD1 3.88Å; K52-I56 VanDerWaalsContact O-CG1 3.26Å; K52-I56 WeakPolarHBondContact O-CG1 3.13Å; K52-I56 PolarHBondContact O-N 3.49Å |
| 53 | E | 87.8 | Confident | 83.1 | Confident | 16 Ų | 16 | 88.4 Ų | 88.4 | 8% | 0.075 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -60.5 | -46.4 | 175.8 | -71.1 | 170.5 | -160.2 | 0 | 0 | 111.5 | F36 Y39 R48 D49 V50 I56 S57 | F36-E53 HydrophobicContact CE2-CB 4.22Å; Y39-E53 HydrophobicContact CD1-CG 3.79Å; Y39-E53 HydrophobicContact CE1-CG 3.42Å; Y39-E53 VanDerWaalsContact CE1-CG 3.42Å; R48-E53 WeakPolarHBondContact CG-OE1 3.45Å; R48-E53 IonicContact CZ-OE1 3.43Å; R48-E53 IonicContact CZ-OE2 3.55Å; R48-E53 IonicContact NE-OE1 3.69Å; R48-E53 PolarHBondContact NE-OE1 3.02Å; R48-E53 IonicContact NE-OE2 2.88Å; R48-E53 IonicContact NH2-OE1 2.98Å; R48-E53 IonicContact NH2-OE2 3.52Å; R48-E53 PolarHBondContact NH2-OE2 3.44Å; D49-E53 WeakPolarHBondContact O-CG 2.99Å; D49-E53 PolarHBondContact O-N 2.89Å; D49-E53 VanDerWaalsContact O-N 3.13Å; V50-E53 PolarHBondContact O-N 3.42Å; E53-I56 PolarHBondContact O-N 2.96Å; E53-S57 WeakPolarHBondContact O-CB 3.45Å; E53-S57 PolarHBondContact O-N 3.37Å; E53-S57 PolarHBondContact O-OG 3.44Å |
| 54 | L | 89.5 | Confident | 84.1 | Confident | 108 Ų | 108 | 89.7 Ų | 89.7 | 57% | 0.565 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -65.8 | -40.8 | -179.9 | -169.9 | 65.5 | 0 | 0 | 0 | 111.6 | V50 S57 L58 | V50-L54 VanDerWaalsContact O-CB 3.25Å; V50-L54 WeakPolarHBondContact O-CB 3.3Å; V50-L54 PolarHBondContact O-N 3.43Å; L54-S57 WeakPolarHBondContact CA-OG 3.29Å; L54-S57 PolarHBondContact O-OG 2.88Å; L54-S57 VanDerWaalsContact O-OG 3.06Å; L54-L58 WeakPolarHBondContact O-CB 3.25Å; L54-L58 PolarHBondContact O-N 3.06Å |
| 55 | L | 90.3 | Very high | 85.1 | Confident | 115 Ų | 115 | 87.8 Ų | 87.8 | 60% | 0.602 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -66 | -45.9 | 179.5 | -152.4 | 164.2 | 0 | 0 | 0 | 111.1 | Y51 K52 L58 V59 | Y51-L55 WeakPolarHBondContact O-CB 3.25Å; Y51-L55 PolarHBondContact O-N 3.01Å; K52-L55 PolarHBondContact O-N 3.06Å; L55-L58 PolarHBondContact O-N 2.92Å; L55-V59 HydrophobicContact CD2-CG2 4.01Å; L55-V59 VanDerWaalsContact O-CG2 3.3Å; L55-V59 WeakPolarHBondContact O-CG2 3.39Å; L55-V59 PolarHBondContact O-N 3.33Å |
| 56 | I | 90 | Very high | 86.5 | Confident | 22 Ų | 22 | 84 Ų | 84 | 11% | 0.113 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -65.1 | -44.4 | 178.9 | -63.6 | 168.1 | 0 | 0 | 0 | 110.7 | F36 K52 E53 V59 A60 | F36-I56 HydrophobicContact CB-CG2 4.03Å; F36-I56 HydrophobicContact CD2-CG2 4.46Å; K52-I56 HydrophobicContact CG-CD1 3.88Å; K52-I56 VanDerWaalsContact O-CG1 3.26Å; K52-I56 WeakPolarHBondContact O-CG1 3.13Å; K52-I56 PolarHBondContact O-N 3.49Å; E53-I56 PolarHBondContact O-N 2.96Å; I56-V59 PolarHBondContact O-N 3.29Å; I56-A60 VanDerWaalsContact O-CB 3.32Å; I56-A60 WeakPolarHBondContact O-CB 3.29Å; I56-A60 PolarHBondContact O-N 3.16Å |
| 57 | S | 90.4 | Very high | 87.9 | Confident | 36 Ų | 36 | 73.9 Ų | 73.9 | 25% | 0.252 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -68 | -34.4 | 179 | 58.5 | 0 | 0 | 0 | 0 | 113 | E53 L54 A60 S61 | E53-S57 WeakPolarHBondContact O-CB 3.45Å; E53-S57 PolarHBondContact O-N 3.37Å; E53-S57 PolarHBondContact O-OG 3.44Å; L54-S57 WeakPolarHBondContact CA-OG 3.29Å; L54-S57 PolarHBondContact O-OG 2.88Å; L54-S57 VanDerWaalsContact O-OG 3.06Å; S57-A60 PolarHBondContact O-N 3.46Å; S57-S61 WeakPolarHBondContact O-CB 3.16Å; S57-S61 PolarHBondContact O-N 3.48Å; S57-S61 PolarHBondContact O-OG 2.88Å; S57-S61 VanDerWaalsContact O-OG 3.11Å |
| 58 | L | 93.3 | Very high | 89 | Confident | 93 Ų | 93 | 73.2 Ų | 73.2 | 49% | 0.487 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -66.2 | -46.5 | 174.4 | -172.8 | 151.5 | 0 | 0 | 0 | 111 | L54 L55 S61 L62 | L54-L58 WeakPolarHBondContact O-CB 3.25Å; L54-L58 PolarHBondContact O-N 3.06Å; L55-L58 PolarHBondContact O-N 2.92Å; L58-S61 PolarHBondContact O-N 3.24Å; L58-S61 PolarHBondContact O-OG 3.37Å; L58-L62 HydrophobicContact CD2-CD1 3.69Å; L58-L62 PolarHBondContact O-N 3.48Å |
| 59 | V | 92.6 | Very high | 90.2 | Very high | 37 Ų | 37 | 72.2 Ų | 72.2 | 22% | 0.224 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -61.6 | -47.1 | 175.7 | 173 | 0 | 0 | 0 | 0 | 110.3 | F32 L55 I56 S61 L62 F63 | F32-V59 HydrophobicContact CD2-CG1 4.17Å; F32-V59 HydrophobicContact CE2-CG1 4.16Å; F32-V59 HydrophobicContact CG-CG1 4.38Å; F32-V59 HydrophobicContact CZ-CG1 4.36Å; L55-V59 HydrophobicContact CD2-CG2 4.01Å; L55-V59 VanDerWaalsContact O-CG2 3.3Å; L55-V59 WeakPolarHBondContact O-CG2 3.39Å; L55-V59 PolarHBondContact O-N 3.33Å; I56-V59 PolarHBondContact O-N 3.29Å; V59-S61 PolarHBondContact O-N 2.95Å; V59-L62 PolarHBondContact O-N 3.31Å; V59-F63 HydrophobicContact CG1-CD2 3.75Å; V59-F63 HydrophobicContact CG1-CE2 3.76Å; V59-F63 VanDerWaalsContact O-CD2 3.26Å; V59-F63 WeakPolarHBondContact O-CD2 3.29Å; V59-F63 PolarHBondContact O-N 3.25Å; V59-F63 VanDerWaalsContact O-N 3.16Å |
| 60 | A | 92.8 | Very high | 90.5 | Very high | 5 Ų | 5 | 70.3 Ų | 70.3 | 4% | 0.041 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -58.1 | -46.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | F32 I56 S57 L62 F63 M64 | F32-A60 HydrophobicContact CB-CB 3.77Å; I56-A60 VanDerWaalsContact O-CB 3.32Å; I56-A60 WeakPolarHBondContact O-CB 3.29Å; I56-A60 PolarHBondContact O-N 3.16Å; S57-A60 PolarHBondContact O-N 3.46Å; A60-L62 PolarHBondContact O-N 2.84Å; A60-F63 PolarHBondContact O-N 2.96Å; A60-M64 VanDerWaalsContact O-CB 3.3Å; A60-M64 WeakPolarHBondContact O-CB 3.41Å; A60-M64 VanDerWaalsContact O-CG 3.25Å; A60-M64 WeakPolarHBondContact O-CG 3.41Å; A60-M64 PolarHBondContact O-N 3.07Å |
| 61 | S | 94.6 | Very high | 90.9 | Very high | 76 Ų | 76 | 68.2 Ų | 68.2 | 53% | 0.531 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -67.3 | -36.1 | -177.6 | 64.9 | 0 | 0 | 0 | 0 | 112.9 | S57 L58 V59 G65 | S57-S61 WeakPolarHBondContact O-CB 3.16Å; S57-S61 PolarHBondContact O-N 3.48Å; S57-S61 PolarHBondContact O-OG 2.88Å; S57-S61 VanDerWaalsContact O-OG 3.11Å; L58-S61 PolarHBondContact O-N 3.24Å; L58-S61 PolarHBondContact O-OG 3.37Å; V59-S61 PolarHBondContact O-N 2.95Å; S61-G65 PolarHBondContact O-N 3.28Å |
| 62 | L | 94.8 | Very high | 91.1 | Very high | 90 Ų | 90 | 62 Ų | 62 | 47% | 0.471 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -62.1 | -54.2 | 173 | -79.3 | 169.5 | 0 | 0 | 0 | 111.3 | L58 V59 A60 M64 G65 F66 | L58-L62 HydrophobicContact CD2-CD1 3.69Å; L58-L62 PolarHBondContact O-N 3.48Å; V59-L62 PolarHBondContact O-N 3.31Å; A60-L62 PolarHBondContact O-N 2.84Å; L62-M64 VanDerWaalsContact C-N 3.33Å; L62-M64 PolarHBondContact O-N 3.02Å; L62-G65 PolarHBondContact O-N 3.11Å; L62-F66 HydrophobicContact CD2-CE2 4.12Å; L62-F66 WeakPolarHBondContact O-CD2 3.01Å; L62-F66 PolarHBondContact O-N 2.88Å |
| 63 | F | 92.9 | Very high | 91.3 | Very high | 77 Ų | 77 | 58.7 Ų | 58.7 | 34% | 0.338 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -63.3 | -39.7 | -178.2 | -80.1 | -74.4 | 0 | 0 | 0 | 112.4 | I28 V59 A60 G67 | I28-F63 HydrophobicContact CG2-CD1 4.2Å; I28-F63 HydrophobicContact CG2-CD2 4.31Å; I28-F63 HydrophobicContact CG2-CE1 4.42Å; I28-F63 HydrophobicContact CG2-CG 4.16Å; V59-F63 HydrophobicContact CG1-CD2 3.75Å; V59-F63 HydrophobicContact CG1-CE2 3.76Å; V59-F63 VanDerWaalsContact O-CD2 3.26Å; V59-F63 WeakPolarHBondContact O-CD2 3.29Å; V59-F63 PolarHBondContact O-N 3.25Å; V59-F63 VanDerWaalsContact O-N 3.16Å; A60-F63 PolarHBondContact O-N 2.96Å; F63-G67 PolarHBondContact O-N 2.97Å |
| 64 | M | 93.8 | Very high | 91.2 | Very high | 47 Ų | 47 | 64.6 Ų | 64.6 | 23% | 0.232 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -67 | -42.4 | 174.6 | -73.4 | -64 | -139.5 | 0 | 0 | 112.7 | L26 G29 M30 T33 A60 L62 G67 V68 | L26-M64 HydrophobicContact CD2-SD 4.16Å; G29-M64 VanDerWaalsContact C-SD 3.59Å; M30-M64 VanDerWaalsContact CA-CE 3.44Å; M30-M64 HydrophobicContact CB-CE 4.09Å; M30-M64 HydrophobicContact CG-CE 3.51Å; M30-M64 HydrophobicContact CG-SD 4.31Å; T33-M64 WeakPolarHBondContact OG1-CE 3.39Å; A60-M64 VanDerWaalsContact O-CB 3.3Å; A60-M64 WeakPolarHBondContact O-CB 3.41Å; A60-M64 VanDerWaalsContact O-CG 3.25Å; A60-M64 WeakPolarHBondContact O-CG 3.41Å; A60-M64 PolarHBondContact O-N 3.07Å; L62-M64 VanDerWaalsContact C-N 3.33Å; L62-M64 PolarHBondContact O-N 3.02Å; M64-G67 PolarHBondContact O-N 3.24Å; M64-V68 WeakPolarHBondContact O-CB 3.48Å; M64-V68 VanDerWaalsContact O-CG2 3.29Å; M64-V68 WeakPolarHBondContact O-CG2 3.33Å; M64-V68 PolarHBondContact O-N 3.03Å |
| 65 | G | 93 | Very high | 91.1 | Very high | 44 Ų | 44 | 64.3 Ų | 64.3 | 45% | 0.454 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -60.8 | -50.1 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | S61 L62 V68 L69 | S61-G65 PolarHBondContact O-N 3.28Å; L62-G65 PolarHBondContact O-N 3.11Å; G65-V68 PolarHBondContact O-N 3.26Å; G65-L69 PolarHBondContact O-N 3.19Å; G65-L69 VanDerWaalsContact O-N 3.09Å |
| 66 | F | 91.3 | Very high | 90.8 | Very high | 112 Ų | 112 | 60.7 Ų | 60.7 | 49% | 0.491 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -65.7 | -39.9 | 175.1 | -75.2 | -69.8 | 0 | 0 | 0 | 112.1 | L25 L62 V68 L69 F70 | L25-F66 HydrophobicContact CD2-CB 3.37Å; L25-F66 HydrophobicContact CD2-CG 4.44Å; L62-F66 HydrophobicContact CD2-CE2 4.12Å; L62-F66 WeakPolarHBondContact O-CD2 3.01Å; L62-F66 PolarHBondContact O-N 2.88Å; F66-V68 PolarHBondContact O-N 3.37Å; F66-L69 PolarHBondContact O-N 2.89Å; F66-F70 WeakPolarHBondContact O-CD2 3.42Å; F66-F70 PolarHBondContact O-N 3.13Å |
| 67 | G | 92.1 | Very high | 90.6 | Very high | 0 Ų | 0 | 63.9 Ų | 63.9 | 0% | 0 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -60.2 | -42.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | F63 M64 F70 L71 | F63-G67 PolarHBondContact O-N 2.97Å; M64-G67 PolarHBondContact O-N 3.24Å; G67-F70 PolarHBondContact O-N 2.94Å; G67-L71 WeakPolarHBondContact O-CB 3.49Å; G67-L71 PolarHBondContact O-N 3.27Å |
| 68 | V | 92.6 | Very high | 90.1 | Very high | 74 Ų | 74 | 70.8 Ų | 70.8 | 45% | 0.448 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -69.3 | -36.6 | 176.8 | 172.8 | 0 | 0 | 0 | 0 | 111.6 | L26 M64 G65 F66 L71 L72 | L26-V68 HydrophobicContact CD2-CG2 4.21Å; M64-V68 WeakPolarHBondContact O-CB 3.48Å; M64-V68 VanDerWaalsContact O-CG2 3.29Å; M64-V68 WeakPolarHBondContact O-CG2 3.33Å; M64-V68 PolarHBondContact O-N 3.03Å; G65-V68 PolarHBondContact O-N 3.26Å; F66-V68 PolarHBondContact O-N 3.37Å; V68-L71 WeakPolarHBondContact O-CB 3.2Å; V68-L71 PolarHBondContact O-N 3.09Å; V68-L72 PolarHBondContact O-N 3.44Å |
| 69 | L | 90.8 | Very high | 89.3 | Confident | 88 Ų | 88 | 74.2 Ų | 74.2 | 46% | 0.461 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -58.8 | -52.9 | 173.7 | -174.2 | 152.1 | 0 | 0 | 0 | 110.4 | G65 F66 L71 L72 L73 | G65-L69 PolarHBondContact O-N 3.19Å; G65-L69 VanDerWaalsContact O-N 3.09Å; F66-L69 PolarHBondContact O-N 2.89Å; L69-L71 VanDerWaalsContact C-N 3.27Å; L69-L71 PolarHBondContact O-N 2.96Å; L69-L72 PolarHBondContact O-N 3.15Å; L69-L72 VanDerWaalsContact O-N 3.13Å; L69-L73 HydrophobicContact CD2-CD1 3.52Å; L69-L73 HydrophobicContact CG-CD1 4.02Å; L69-L73 WeakPolarHBondContact O-CD1 3.21Å; L69-L73 PolarHBondContact O-N 3.07Å; L69-L73 VanDerWaalsContact O-N 3.07Å |
| 70 | F | 87.1 | Confident | 89.2 | Confident | 36 Ų | 36 | 76.1 Ų | 76.1 | 16% | 0.158 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -65 | -30.4 | 178.3 | -75 | -71.4 | 0 | 0 | 0 | 113 | F18 L21 T22 L25 F66 G67 W74 | F18-F70 HydrophobicContact CD1-CD1 4.01Å; F18-F70 HydrophobicContact CD1-CE1 4.22Å; F18-F70 HydrophobicContact CE1-CD1 4.47Å; F18-F70 HydrophobicContact CE1-CE1 4.37Å; L21-F70 HydrophobicContact CD1-CE1 4.12Å; L21-F70 HydrophobicContact CD1-CZ 4.25Å; T22-F70 WeakPolarHBondContact OG1-CB 3.35Å; T22-F70 PolarHBondContact OG1-O 2.92Å; L25-F70 HydrophobicContact CD2-CD2 4.32Å; L25-F70 HydrophobicContact CD2-CE2 4.44Å; F66-F70 WeakPolarHBondContact O-CD2 3.42Å; F66-F70 PolarHBondContact O-N 3.13Å; G67-F70 PolarHBondContact O-N 2.94Å; F70-W74 VanDerWaalsContact O-CB 3.29Å; F70-W74 WeakPolarHBondContact O-CB 3.01Å; F70-W74 PolarHBondContact O-N 3.31Å |
| 71 | L | 89.4 | Confident | 89 | Confident | 60 Ų | 60 | 79.8 Ų | 79.8 | 31% | 0.314 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -61.5 | -46.1 | 171.6 | -177.3 | 69.1 | 0 | 0 | 0 | 111.4 | T22 L26 G67 V68 L69 W74 V75 | T22-L71 HydrophobicContact CG2-CB 3.71Å; T22-L71 HydrophobicContact CG2-CD1 3.81Å; T22-L71 HydrophobicContact CG2-CG 4.38Å; T22-L71 PolarHBondContact OG1-N 3.03Å; L26-L71 HydrophobicContact CD1-CB 4.46Å; L26-L71 HydrophobicContact CD1-CD1 4.47Å; L26-L71 HydrophobicContact CD1-CD2 4.33Å; G67-L71 WeakPolarHBondContact O-CB 3.49Å; G67-L71 PolarHBondContact O-N 3.27Å; V68-L71 WeakPolarHBondContact O-CB 3.2Å; V68-L71 PolarHBondContact O-N 3.09Å; L69-L71 VanDerWaalsContact C-N 3.27Å; L69-L71 PolarHBondContact O-N 2.96Å; L71-W74 HydrophobicContact CD1-CE3 3.95Å; L71-W74 HydrophobicContact CD1-CZ3 4.3Å; L71-W74 PolarHBondContact O-N 2.7Å; L71-V75 WeakPolarHBondContact O-CG2 3.37Å; L71-V75 PolarHBondContact O-N 3.24Å |
| 72 | L | 89.8 | Confident | 88.6 | Confident | 63 Ų | 63 | 80 Ų | 80 | 33% | 0.33 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -62.7 | -45.3 | 178.1 | -117.9 | 71.9 | 0 | 0 | 0 | 111.6 | V68 L69 W74 V75 G76 I77 V79 | V68-L72 PolarHBondContact O-N 3.44Å; L69-L72 PolarHBondContact O-N 3.15Å; L69-L72 VanDerWaalsContact O-N 3.13Å; L72-W74 VanDerWaalsContact C-N 3.26Å; L72-W74 PolarHBondContact O-N 3.45Å; L72-V75 PolarHBondContact O-N 3.15Å; L72-G76 PolarHBondContact O-N 3.49Å; L72-I77 CarbonylContact C-O 3.35Å; L72-I77 HydrophobicContact CB-CB 4.47Å; L72-I77 HydrophobicContact CD2-CB 4.37Å; L72-I77 HydrophobicContact CD2-CG2 4.03Å; L72-I77 HydrophobicContact CG-CB 4.07Å; L72-I77 HydrophobicContact CG-CD1 4.24Å; L72-I77 HydrophobicContact CG-CG2 4.28Å; L72-I77 PolarHBondContact O-N 3.47Å; L72-V79 HydrophobicContact CD2-CG2 3.63Å |
| 73 | L | 87.8 | Confident | 88.3 | Confident | 33 Ų | 33 | 79.4 Ų | 79.4 | 17% | 0.173 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -60.6 | -38.1 | 174.6 | -83.6 | 83.1 | 0 | 0 | 0 | 111.5 | F18 L69 G76 | F18-L73 HydrophobicContact CD2-CB 4.38Å; F18-L73 HydrophobicContact CE1-CD2 4.4Å; F18-L73 HydrophobicContact CE2-CB 4.38Å; F18-L73 HydrophobicContact CE2-CD2 4.27Å; F18-L73 HydrophobicContact CZ-CD2 3.99Å; L69-L73 HydrophobicContact CD2-CD1 3.52Å; L69-L73 HydrophobicContact CG-CD1 4.02Å; L69-L73 WeakPolarHBondContact O-CD1 3.21Å; L69-L73 PolarHBondContact O-N 3.07Å; L69-L73 VanDerWaalsContact O-N 3.07Å; L73-G76 PolarHBondContact O-N 3.27Å; L73-G76 VanDerWaalsContact O-N 3.15Å |
| 74 | W | 85.7 | Confident | 88 | Confident | 140 Ų | 140 | 79.6 Ų | 79.6 | 53% | 0.53 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -68.6 | -36.5 | 178.5 | -179.3 | 40 | 0 | 0 | 0 | 112.9 | F18 P19 F70 L71 L72 G76 | F18-W74 HydrophobicContact CB-CB 4.47Å; P19-W74 HydrophobicContact CB-CD2 4.27Å; P19-W74 HydrophobicContact CB-CG 4.47Å; P19-W74 HydrophobicContact CB-CZ2 4.31Å; F70-W74 VanDerWaalsContact O-CB 3.29Å; F70-W74 WeakPolarHBondContact O-CB 3.01Å; F70-W74 PolarHBondContact O-N 3.31Å; L71-W74 HydrophobicContact CD1-CE3 3.95Å; L71-W74 HydrophobicContact CD1-CZ3 4.3Å; L71-W74 PolarHBondContact O-N 2.7Å; L72-W74 VanDerWaalsContact C-N 3.26Å; L72-W74 PolarHBondContact O-N 3.45Å; W74-G76 PolarHBondContact O-N 3.18Å |
| 75 | V | 87.7 | Confident | 87.6 | Confident | 102 Ų | 102 | 81.7 Ų | 81.7 | 62% | 0.618 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -69.3 | -10.6 | 173.2 | 173.8 | 0 | 0 | 0 | 0 | 112 | L71 L72 I77 | L71-V75 WeakPolarHBondContact O-CG2 3.37Å; L71-V75 PolarHBondContact O-N 3.24Å; L72-V75 PolarHBondContact O-N 3.15Å; V75-I77 HydrophobicContact CG1-CD1 4.38Å; V75-I77 HydrophobicContact CG1-CG1 4.38Å |
| 76 | G | 84.1 | Confident | 87.2 | Confident | 40 Ų | 40 | 84.4 Ų | 84.4 | 41% | 0.412 | 44% | 0.436 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 92.5 | 12 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | L72 L73 W74 Y78 | L72-G76 PolarHBondContact O-N 3.49Å; L73-G76 PolarHBondContact O-N 3.27Å; L73-G76 VanDerWaalsContact O-N 3.15Å; W74-G76 PolarHBondContact O-N 3.18Å; G76-Y78 WeakPolarHBondContact O-CD2 3.4Å; G76-Y78 PolarHBondContact O-N 3.47Å |
| 77 | I | 86.4 | Confident | 86.9 | Confident | 88 Ų | 88 | 82.3 Ų | 82.3 | 45% | 0.451 | 43% | 0.431 | S | S | . | . | trans | -89.4 | 98.3 | 171 | -54.5 | 175.9 | 0 | 0 | 0 | 107.2 | L72 V75 V79 | L72-I77 CarbonylContact C-O 3.35Å; L72-I77 HydrophobicContact CB-CB 4.47Å; L72-I77 HydrophobicContact CD2-CB 4.37Å; L72-I77 HydrophobicContact CD2-CG2 4.03Å; L72-I77 HydrophobicContact CG-CB 4.07Å; L72-I77 HydrophobicContact CG-CD1 4.24Å; L72-I77 HydrophobicContact CG-CG2 4.28Å; L72-I77 PolarHBondContact O-N 3.47Å; V75-I77 HydrophobicContact CG1-CD1 4.38Å; V75-I77 HydrophobicContact CG1-CG1 4.38Å; I77-V79 HydrophobicContact CG2-CG2 4.06Å; I77-V79 PolarHBondContact O-N 3.48Å | ||
| 78 | Y | 80.6 | Confident | 86.5 | Confident | 181 Ų | 181 | 89.2 Ų | 89.2 | 71% | 0.71 | 47% | 0.467 | S | S | * | . | trans | -81.9 | 102.1 | 175 | -56.9 | -81.6 | 0 | 0 | 0 | 108.8 | G76 | G76-Y78 WeakPolarHBondContact O-CD2 3.4Å; G76-Y78 PolarHBondContact O-N 3.47Å | ||
| 79 | V | 75.9 | Confident | 85.9 | Confident | 165 Ų | 165 | 90.5 Ų | 90.5 | 100% | 1 | 47% | 0.469 | S | S | * | . | trans | -87.2 | 0 | 174.5 | 175 | 0 | 0 | 0 | 0 | 110.7 | L72 I77 | L72-V79 HydrophobicContact CD2-CG2 3.63Å; I77-V79 HydrophobicContact CG2-CG2 4.06Å; I77-V79 PolarHBondContact O-N 3.48Å |
Retrieved 79 of 79 residues in 45.4 ms
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