| 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 | 56.8 | Low | 82.9 | Confident | 174 Ų | 174 | 78.1 Ų | 78.1 | 86% | 0.857 | 47% | 0.469 | S | S | * | . | 0 | -30.4 | 0 | 67.3 | -176.7 | -77.8 | 0 | 0 | 114.1 | T3 V4 K5 | M1-T3 VanDerWaalsContact C-N 3.32Å; M1-T3 PolarHBondContact O-N 3.1Å; M1-V4 PolarHBondContact O-N 3.24Å; M1-K5 PolarHBondContact O-N 3.45Å | |||
| 2 | A | 65.4 | Low | 83.9 | Confident | 75 Ų | 75 | 84.1 Ų | 84.1 | 62% | 0.62 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -58.5 | -43.4 | 176 | 0 | 0 | 0 | 0 | 0 | 112 | V4 K5 A6 | A2-V4 PolarHBondContact O-N 3.17Å; A2-K5 PolarHBondContact O-N 3.48Å; A2-A6 PolarHBondContact O-N 2.95Å |
| 3 | T | 76.1 | Confident | 84.6 | Confident | 39 Ų | 39 | 79.9 Ų | 79.9 | 24% | 0.239 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -56.9 | -46.6 | 176.9 | -39 | 0 | 0 | 0 | 0 | 112.9 | M1 K5 A6 L7 I123 E127 | M1-T3 VanDerWaalsContact C-N 3.32Å; M1-T3 PolarHBondContact O-N 3.1Å; T3-K5 VanDerWaalsContact C-N 3.28Å; T3-K5 PolarHBondContact O-N 3.08Å; T3-A6 CarbonylContact O-C 3.48Å; T3-A6 WeakPolarHBondContact O-CB 3.27Å; T3-A6 PolarHBondContact O-N 2.93Å; T3-L7 HydrophobicContact CG2-CD1 4Å; T3-L7 HydrophobicContact CG2-CG 4.16Å; T3-L7 WeakPolarHBondContact O-CB 3.26Å; T3-L7 VanDerWaalsContact O-CG 3.32Å; T3-L7 WeakPolarHBondContact O-CG 3.46Å; T3-L7 PolarHBondContact O-N 3.07Å; T3-I123 HydrophobicContact CG2-CG2 4.36Å; T3-E127 VanDerWaalsContact CB-OE1 3.23Å; T3-E127 WeakPolarHBondContact CB-OE1 3.23Å; T3-E127 WeakPolarHBondContact CG2-OE1 3.5Å; T3-E127 PolarHBondContact OG1-OE1 3.38Å |
| 4 | V | 83.8 | Confident | 85.1 | Confident | 91 Ų | 91 | 75.6 Ų | 75.6 | 55% | 0.552 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -59.3 | -42.3 | -179.5 | -178.3 | 0 | 0 | 0 | 0 | 110.9 | M1 A2 L7 I8 | M1-V4 PolarHBondContact O-N 3.24Å; A2-V4 PolarHBondContact O-N 3.17Å; V4-L7 PolarHBondContact O-N 3.46Å; V4-I8 HydrophobicContact CG1-CD1 3.94Å; V4-I8 WeakPolarHBondContact O-CD1 2.99Å; V4-I8 WeakPolarHBondContact O-CG1 3.34Å; V4-I8 PolarHBondContact O-N 3.47Å |
| 5 | K | 86.7 | Confident | 85.8 | Confident | 137 Ų | 137 | 75.3 Ų | 75.3 | 60% | 0.596 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -64.4 | -41.4 | 176 | -65.6 | 174.5 | 177.4 | 175.7 | 0 | 111.6 | M1 A2 T3 I8 G9 | M1-K5 PolarHBondContact O-N 3.45Å; A2-K5 PolarHBondContact O-N 3.48Å; T3-K5 VanDerWaalsContact C-N 3.28Å; T3-K5 PolarHBondContact O-N 3.08Å; K5-I8 PolarHBondContact O-N 2.96Å; K5-G9 PolarHBondContact O-N 3.14Å |
| 6 | A | 86.9 | Confident | 86.4 | Confident | 38 Ų | 38 | 73.3 Ų | 73.3 | 31% | 0.314 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -63.6 | -46.1 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | A2 T3 I8 G9 L10 I123 | A2-A6 PolarHBondContact O-N 2.95Å; T3-A6 CarbonylContact O-C 3.48Å; T3-A6 WeakPolarHBondContact O-CB 3.27Å; T3-A6 PolarHBondContact O-N 2.93Å; A6-I8 VanDerWaalsContact C-N 3.34Å; A6-I8 PolarHBondContact O-N 3.05Å; A6-G9 PolarHBondContact O-N 3.17Å; A6-L10 VanDerWaalsContact O-CB 3.3Å; A6-L10 WeakPolarHBondContact O-CB 3.43Å; A6-L10 PolarHBondContact O-N 3.47Å; A6-I123 HydrophobicContact CB-CD1 3.78Å |
| 7 | L | 88.7 | Confident | 86.8 | Confident | 69 Ų | 69 | 69 Ų | 69 | 36% | 0.361 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -61.9 | -38.1 | 175.9 | -67.6 | 174.4 | 0 | 0 | 0 | 112.5 | T3 V4 L10 A11 Y120 | T3-L7 HydrophobicContact CG2-CD1 4Å; T3-L7 HydrophobicContact CG2-CG 4.16Å; T3-L7 WeakPolarHBondContact O-CB 3.26Å; T3-L7 VanDerWaalsContact O-CG 3.32Å; T3-L7 WeakPolarHBondContact O-CG 3.46Å; T3-L7 PolarHBondContact O-N 3.07Å; V4-L7 PolarHBondContact O-N 3.46Å; L7-L10 HydrophobicContact CD2-CD2 4.36Å; L7-L10 WeakPolarHBondContact O-CB 3.23Å; L7-L10 PolarHBondContact O-N 3.37Å; L7-A11 WeakPolarHBondContact O-CB 3.11Å; L7-A11 PolarHBondContact O-N 2.94Å; L7-Y120 HydrophobicContact CD2-CD2 4.41Å; L7-Y120 HydrophobicContact CD2-CE2 4.37Å |
| 8 | I | 92.1 | Very high | 87 | Confident | 110 Ų | 110 | 70.2 Ų | 70.2 | 56% | 0.564 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -63.6 | -46.4 | 173.8 | -69.1 | 161.9 | 0 | 0 | 0 | 110.6 | V4 K5 A6 L10 A11 F12 | V4-I8 HydrophobicContact CG1-CD1 3.94Å; V4-I8 WeakPolarHBondContact O-CD1 2.99Å; V4-I8 WeakPolarHBondContact O-CG1 3.34Å; V4-I8 PolarHBondContact O-N 3.47Å; K5-I8 PolarHBondContact O-N 2.96Å; A6-I8 VanDerWaalsContact C-N 3.34Å; A6-I8 PolarHBondContact O-N 3.05Å; I8-L10 VanDerWaalsContact C-N 3.27Å; I8-L10 PolarHBondContact O-N 3.1Å; I8-A11 PolarHBondContact O-N 3.31Å; I8-F12 PolarHBondContact O-N 3.28Å |
| 9 | G | 91.3 | Very high | 87.4 | Confident | 42 Ų | 42 | 72.1 Ų | 72.1 | 43% | 0.433 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -61.2 | -38.3 | 176 | 0 | 0 | 0 | 0 | 0 | 112.3 | K5 A6 F12 A13 | K5-G9 PolarHBondContact O-N 3.14Å; A6-G9 PolarHBondContact O-N 3.17Å; G9-F12 PolarHBondContact O-N 3.2Å; G9-A13 WeakPolarHBondContact O-CB 3.12Å; G9-A13 PolarHBondContact O-N 3.01Å |
| 10 | L | 90.5 | Very high | 87.5 | Confident | 24 Ų | 24 | 72 Ų | 72 | 13% | 0.126 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -65.8 | -44.5 | 176.6 | -157.9 | 75.5 | 0 | 0 | 0 | 112.2 | A6 L7 I8 F12 A13 G14 T116 A119 Y120 | A6-L10 VanDerWaalsContact O-CB 3.3Å; A6-L10 WeakPolarHBondContact O-CB 3.43Å; A6-L10 PolarHBondContact O-N 3.47Å; L7-L10 HydrophobicContact CD2-CD2 4.36Å; L7-L10 WeakPolarHBondContact O-CB 3.23Å; L7-L10 PolarHBondContact O-N 3.37Å; I8-L10 VanDerWaalsContact C-N 3.27Å; I8-L10 PolarHBondContact O-N 3.1Å; L10-F12 VanDerWaalsContact C-N 3.35Å; L10-A13 PolarHBondContact O-N 2.79Å; L10-G14 PolarHBondContact O-N 3.19Å; L10-T116 HydrophobicContact CD1-CG2 3.82Å; L10-T116 VanDerWaalsContact CD1-O 3.32Å; L10-T116 WeakPolarHBondContact CD1-O 3.3Å; L10-T116 HydrophobicContact CG-CG2 3.67Å; L10-T116 VanDerWaalsContact O-CG2 3.32Å; L10-T116 WeakPolarHBondContact O-CG2 3.35Å; L10-A119 HydrophobicContact CD1-CB 3.59Å; L10-Y120 HydrophobicContact CD2-CD2 3.63Å; L10-Y120 HydrophobicContact CD2-CG 4.11Å |
| 11 | A | 93.1 | Very high | 87.5 | Confident | 60 Ų | 60 | 68.8 Ų | 68.8 | 50% | 0.496 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -63.3 | -41.9 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | L7 I8 G14 C15 | L7-A11 WeakPolarHBondContact O-CB 3.11Å; L7-A11 PolarHBondContact O-N 2.94Å; I8-A11 PolarHBondContact O-N 3.31Å; A11-G14 PolarHBondContact O-N 2.89Å; A11-C15 WeakPolarHBondContact O-CB 3.01Å; A11-C15 PolarHBondContact O-N 3.24Å; A11-C15 PolarHBondContact O-SG 3.22Å |
| 12 | F | 94.8 | Very high | 89 | Confident | 150 Ų | 150 | 64.7 Ų | 64.7 | 66% | 0.658 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -63 | -45.7 | 175.2 | -174.8 | -99.1 | 0 | 0 | 0 | 111.8 | I8 G9 L10 G14 C15 V16 | I8-F12 PolarHBondContact O-N 3.28Å; G9-F12 PolarHBondContact O-N 3.2Å; L10-F12 VanDerWaalsContact C-N 3.35Å; F12-G14 VanDerWaalsContact C-N 3.35Å; F12-G14 PolarHBondContact O-N 2.93Å; F12-C15 PolarHBondContact O-N 3.06Å; F12-V16 HydrophobicContact CD1-CG2 4.22Å; F12-V16 HydrophobicContact CE1-CG2 3.88Å; F12-V16 HydrophobicContact CZ-CG2 4.15Å; F12-V16 WeakPolarHBondContact O-CG2 3.34Å; F12-V16 PolarHBondContact O-N 2.94Å |
| 13 | A | 93.3 | Very high | 90.1 | Very high | 30 Ų | 30 | 65.1 Ų | 65.1 | 25% | 0.248 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -60.3 | -44.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | G9 L10 C15 V16 G17 V112 | G9-A13 WeakPolarHBondContact O-CB 3.12Å; G9-A13 PolarHBondContact O-N 3.01Å; L10-A13 PolarHBondContact O-N 2.79Å; A13-C15 PolarHBondContact O-N 3.21Å; A13-V16 PolarHBondContact O-N 3.45Å; A13-G17 PolarHBondContact O-N 3.13Å; A13-V112 HydrophobicContact CB-CG1 4.44Å; A13-V112 WeakPolarHBondContact O-CG1 3.34Å |
| 14 | G | 92.2 | Very high | 90.3 | Very high | 19 Ų | 19 | 63.3 Ų | 63.3 | 20% | 0.196 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -58.7 | -46.3 | 175 | 0 | 0 | 0 | 0 | 0 | 112.4 | L10 A11 F12 V16 G17 L18 | L10-G14 PolarHBondContact O-N 3.19Å; A11-G14 PolarHBondContact O-N 2.89Å; F12-G14 VanDerWaalsContact C-N 3.35Å; F12-G14 PolarHBondContact O-N 2.93Å; G14-V16 PolarHBondContact O-N 3.01Å; G14-G17 PolarHBondContact O-N 3.12Å; G14-L18 WeakPolarHBondContact O-CG 3.34Å; G14-L18 PolarHBondContact O-N 3.02Å |
| 15 | C | 95.3 | Very high | 90.2 | Very high | 72 Ų | 72 | 60.6 Ų | 60.6 | 49% | 0.486 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -58.9 | -45.3 | 174.2 | -71.7 | 0 | 0 | 0 | 0 | 111.8 | A11 F12 A13 G17 L18 L19 | A11-C15 WeakPolarHBondContact O-CB 3.01Å; A11-C15 PolarHBondContact O-N 3.24Å; A11-C15 PolarHBondContact O-SG 3.22Å; F12-C15 PolarHBondContact O-N 3.06Å; A13-C15 PolarHBondContact O-N 3.21Å; C15-G17 VanDerWaalsContact C-N 3.33Å; C15-G17 PolarHBondContact O-N 3.24Å; C15-L18 PolarHBondContact O-N 3.34Å; C15-L19 WeakPolarHBondContact O-CB 3.29Å; C15-L19 WeakPolarHBondContact O-CG 3.44Å; C15-L19 PolarHBondContact O-N 2.72Å |
| 16 | V | 95.4 | Very high | 90 | Very high | 42 Ų | 42 | 57.7 Ų | 57.7 | 26% | 0.255 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -59.8 | -43.3 | 176.8 | 170.8 | 0 | 0 | 0 | 0 | 111.3 | F12 A13 G14 L19 F20 | F12-V16 HydrophobicContact CD1-CG2 4.22Å; F12-V16 HydrophobicContact CE1-CG2 3.88Å; F12-V16 HydrophobicContact CZ-CG2 4.15Å; F12-V16 WeakPolarHBondContact O-CG2 3.34Å; F12-V16 PolarHBondContact O-N 2.94Å; A13-V16 PolarHBondContact O-N 3.45Å; G14-V16 PolarHBondContact O-N 3.01Å; V16-L19 PolarHBondContact O-N 3.15Å; V16-F20 HydrophobicContact CG1-CD2 3.91Å; V16-F20 HydrophobicContact CG1-CE2 3.42Å; V16-F20 VanDerWaalsContact CG1-CE2 3.42Å; V16-F20 HydrophobicContact CG1-CZ 4.25Å; V16-F20 WeakPolarHBondContact O-CD2 3.32Å; V16-F20 PolarHBondContact O-N 3.14Å; V16-F20 VanDerWaalsContact O-N 3.07Å |
| 17 | G | 92.6 | Very high | 89.4 | Confident | 1 Ų | 1 | 59.6 Ų | 59.6 | 1% | 0.01 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -61.7 | -44.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | A13 G14 C15 F20 L21 | A13-G17 PolarHBondContact O-N 3.13Å; G14-G17 PolarHBondContact O-N 3.12Å; C15-G17 VanDerWaalsContact C-N 3.33Å; C15-G17 PolarHBondContact O-N 3.24Å; G17-F20 PolarHBondContact O-N 3.21Å; G17-L21 PolarHBondContact O-N 2.95Å; G17-L21 VanDerWaalsContact O-N 3.16Å |
| 18 | L | 91.2 | Very high | 88.1 | Confident | 90 Ų | 90 | 61.1 Ų | 61.1 | 47% | 0.471 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -66.8 | -38 | 176 | -68.3 | 174.6 | 0 | 0 | 0 | 112.1 | G14 C15 F20 L21 V22 | G14-L18 WeakPolarHBondContact O-CG 3.34Å; G14-L18 PolarHBondContact O-N 3.02Å; C15-L18 PolarHBondContact O-N 3.34Å; L18-F20 PolarHBondContact O-N 2.83Å; L18-L21 WeakPolarHBondContact O-CB 3.39Å; L18-L21 PolarHBondContact O-N 3.43Å; L18-V22 WeakPolarHBondContact O-CG2 3.44Å; L18-V22 PolarHBondContact O-N 3.36Å |
| 19 | L | 93.5 | Very high | 86.7 | Confident | 107 Ų | 107 | 62.2 Ų | 62.2 | 56% | 0.56 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -61.5 | -43.4 | 176 | -75 | 173.9 | 0 | 0 | 0 | 111.3 | C15 V16 L21 V22 L23 | C15-L19 WeakPolarHBondContact O-CB 3.29Å; C15-L19 WeakPolarHBondContact O-CG 3.44Å; C15-L19 PolarHBondContact O-N 2.72Å; V16-L19 PolarHBondContact O-N 3.15Å; L19-L21 VanDerWaalsContact C-N 3.31Å; L19-L21 PolarHBondContact O-N 3.32Å; L19-V22 PolarHBondContact O-N 2.99Å; L19-L23 WeakPolarHBondContact O-CB 3.5Å; L19-L23 PolarHBondContact O-N 3Å |
| 20 | F | 89.9 | Confident | 85.4 | Confident | 69 Ų | 69 | 62.6 Ų | 62.6 | 30% | 0.303 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -62.9 | -38.4 | 174.5 | -72.8 | -52 | 0 | 0 | 0 | 112.5 | V16 G17 L18 L23 G24 F105 | V16-F20 HydrophobicContact CG1-CD2 3.91Å; V16-F20 HydrophobicContact CG1-CE2 3.42Å; V16-F20 VanDerWaalsContact CG1-CE2 3.42Å; V16-F20 HydrophobicContact CG1-CZ 4.25Å; V16-F20 WeakPolarHBondContact O-CD2 3.32Å; V16-F20 PolarHBondContact O-N 3.14Å; V16-F20 VanDerWaalsContact O-N 3.07Å; G17-F20 PolarHBondContact O-N 3.21Å; L18-F20 PolarHBondContact O-N 2.83Å; F20-L23 PolarHBondContact O-N 2.72Å; F20-G24 PolarHBondContact O-N 3.28Å; F20-F105 AromaticContact CD1-CD1 3.76Å; F20-F105 HydrophobicContact CD1-CD1 3.76Å; F20-F105 HydrophobicContact CD1-CE1 4.19Å; F20-F105 HydrophobicContact CE1-CD1 4.38Å; F20-F105 HydrophobicContact CE1-CE1 4.43Å |
| 21 | L | 87.5 | Confident | 84.3 | Confident | 5 Ų | 5 | 63.9 Ų | 63.9 | 3% | 0.026 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -64 | -46.7 | 175.9 | -166 | 78.9 | 0 | 0 | 0 | 111.4 | G17 L18 L19 G24 C25 I38 T106 | G17-L21 PolarHBondContact O-N 2.95Å; G17-L21 VanDerWaalsContact O-N 3.16Å; L18-L21 WeakPolarHBondContact O-CB 3.39Å; L18-L21 PolarHBondContact O-N 3.43Å; L19-L21 VanDerWaalsContact C-N 3.31Å; L19-L21 PolarHBondContact O-N 3.32Å; L21-G24 WeakPolarHBondContact O-CA 3.3Å; L21-G24 PolarHBondContact O-N 3.43Å; L21-G24 VanDerWaalsContact O-N 3.13Å; L21-C25 PolarHBondContact O-N 2.98Å; L21-C25 PolarHBondContact O-SG 3.11Å; L21-I38 HydrophobicContact CD2-CD1 3.57Å; L21-I38 HydrophobicContact CD2-CG1 3.4Å; L21-I38 VanDerWaalsContact CD2-CG1 3.4Å; L21-T106 HydrophobicContact CD1-CG2 4.19Å |
| 22 | V | 88.2 | Confident | 83.1 | Confident | 88 Ų | 88 | 69.7 Ų | 69.7 | 53% | 0.533 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -64.2 | -40 | 177.1 | 173.6 | 0 | 0 | 0 | 0 | 110.9 | L18 L19 G24 C25 A26 | L18-V22 WeakPolarHBondContact O-CG2 3.44Å; L18-V22 PolarHBondContact O-N 3.36Å; L19-V22 PolarHBondContact O-N 2.99Å; V22-G24 PolarHBondContact O-N 2.72Å; V22-C25 PolarHBondContact O-N 2.83Å; V22-A26 HydrophobicContact CG1-CB 4.4Å; V22-A26 WeakPolarHBondContact O-CB 3.35Å; V22-A26 PolarHBondContact O-N 3.35Å |
| 23 | L | 87.9 | Confident | 82 | Confident | 85 Ų | 85 | 67.1 Ų | 67.1 | 45% | 0.445 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -58.3 | -40 | 172.9 | -118.4 | 92.5 | 0 | 0 | 0 | 111.5 | L19 F20 C25 L27 F105 | L19-L23 WeakPolarHBondContact O-CB 3.5Å; L19-L23 PolarHBondContact O-N 3Å; F20-L23 PolarHBondContact O-N 2.72Å; L23-C25 PolarHBondContact O-N 3.38Å; L23-L27 PolarHBondContact O-N 2.96Å; L23-F105 HydrophobicContact CD2-CD1 4.3Å; L23-F105 HydrophobicContact CD2-CE1 3.82Å; L23-F105 HydrophobicContact CD2-CE2 4.45Å; L23-F105 HydrophobicContact CD2-CZ 3.9Å |
| 24 | G | 82.3 | Confident | 81 | Confident | 0 Ų | 0 | 65.8 Ų | 65.8 | 0% | 0 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -63.5 | -24.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 114 | F20 L21 V22 Y30 A102 | F20-G24 PolarHBondContact O-N 3.28Å; L21-G24 WeakPolarHBondContact O-CA 3.3Å; L21-G24 PolarHBondContact O-N 3.43Å; L21-G24 VanDerWaalsContact O-N 3.13Å; V22-G24 PolarHBondContact O-N 2.72Å; G24-Y30 VanDerWaalsContact O-CB 3.32Å; G24-Y30 WeakPolarHBondContact O-CB 3.31Å; G24-Y30 WeakPolarHBondContact O-CD1 3.29Å; G24-A102 VanDerWaalsContact O-CB 3.29Å; G24-A102 WeakPolarHBondContact O-CB 3.38Å |
| 25 | C | 80.4 | Confident | 80.2 | Confident | 34 Ų | 34 | 69 Ų | 69 | 23% | 0.23 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -94 | -37.1 | 176.5 | -61.5 | 0 | 0 | 0 | 0 | 113.7 | L21 V22 L23 P34 | L21-C25 PolarHBondContact O-N 2.98Å; L21-C25 PolarHBondContact O-SG 3.11Å; V22-C25 PolarHBondContact O-N 2.83Å; L23-C25 PolarHBondContact O-N 3.38Å; C25-P34 VanDerWaalsContact SG-CG 3.59Å |
| 26 | A | 82.8 | Confident | 79.4 | Confident | 77 Ų | 77 | 70.2 Ų | 70.2 | 64% | 0.636 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -86 | -17.9 | -164.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | V22 | V22-A26 HydrophobicContact CG1-CB 4.4Å; V22-A26 WeakPolarHBondContact O-CB 3.35Å; V22-A26 PolarHBondContact O-N 3.35Å |
| 27 | L | 74 | Confident | 78.9 | Confident | 77 Ų | 77 | 68.2 Ų | 68.2 | 40% | 0.403 | 35% | 0.353 | S | S | . | . | S | Bend | trans | -64.9 | 145.4 | -179.8 | -161.4 | 70 | 0 | 0 | 0 | 108.6 | L23 N29 Y30 | L23-L27 PolarHBondContact O-N 2.96Å; L27-N29 PolarHBondContact O-N 3.42Å; L27-Y30 HydrophobicContact CB-CD2 3.3Å; L27-Y30 HydrophobicContact CB-CE2 3.36Å; L27-Y30 HydrophobicContact CB-CG 4.1Å; L27-Y30 HydrophobicContact CD2-CD2 4.09Å; L27-Y30 HydrophobicContact CD2-CE2 3.19Å; L27-Y30 WeakPolarHBondContact CD2-OH 2.97Å; L27-Y30 HydrophobicContact CG-CD2 3.85Å; L27-Y30 HydrophobicContact CG-CE2 3.38Å; L27-Y30 WeakPolarHBondContact O-CB 3.38Å; L27-Y30 WeakPolarHBondContact O-CD2 3.39Å; L27-Y30 PolarHBondContact O-N 2.85Å |
| 28 | P | 61.2 | Low | 78.5 | Confident | 101 Ų | 101 | 70.6 Ų | 70.6 | 66% | 0.656 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.5 | 134.4 | -179.9 | 22.4 | -31.3 | 0 | 0 | 0 | 110.2 | Y30 | P28-Y30 WeakPolarHBondContact O-CD2 3.37Š|
| 29 | N | 63.8 | Low | 78.2 | Confident | 134 Ų | 134 | 70.2 Ų | 70.2 | 72% | 0.717 | 36% | 0.363 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 84.5 | 7.8 | -168.4 | -52.7 | -75.6 | 0 | 0 | 0 | 116.6 | L27 | L27-N29 PolarHBondContact O-N 3.42Š|
| 30 | Y | 64 | Low | 77.7 | Confident | 49 Ų | 49 | 66.6 Ų | 66.6 | 19% | 0.192 | 34% | 0.343 | C | S | . | . | trans | -102.5 | 137.8 | -179.9 | -65.6 | -89.6 | 0 | 0 | 0 | 111.5 | G24 L27 P28 H99 A102 | G24-Y30 VanDerWaalsContact O-CB 3.32Å; G24-Y30 WeakPolarHBondContact O-CB 3.31Å; G24-Y30 WeakPolarHBondContact O-CD1 3.29Å; L27-Y30 HydrophobicContact CB-CD2 3.3Å; L27-Y30 HydrophobicContact CB-CE2 3.36Å; L27-Y30 HydrophobicContact CB-CG 4.1Å; L27-Y30 HydrophobicContact CD2-CD2 4.09Å; L27-Y30 HydrophobicContact CD2-CE2 3.19Å; L27-Y30 WeakPolarHBondContact CD2-OH 2.97Å; L27-Y30 HydrophobicContact CG-CD2 3.85Å; L27-Y30 HydrophobicContact CG-CE2 3.38Å; L27-Y30 WeakPolarHBondContact O-CB 3.38Å; L27-Y30 WeakPolarHBondContact O-CD2 3.39Å; L27-Y30 PolarHBondContact O-N 2.85Å; P28-Y30 WeakPolarHBondContact O-CD2 3.37Å; Y30-H99 HydrophobicContact CD1-CB 4.42Å; Y30-H99 HydrophobicContact CE1-CB 3.6Å; Y30-A102 HydrophobicContact CD1-CB 3.13Å; Y30-A102 HydrophobicContact CE1-CB 3.08Å; Y30-A102 HydrophobicContact CG-CB 4.29Å | ||
| 31 | N | 67.8 | Low | 77.4 | Confident | 51 Ų | 51 | 64.6 Ų | 64.6 | 27% | 0.273 | 33% | 0.333 | S | S | . | . | trans | -96 | 160.6 | -178.4 | -151.4 | -7.8 | 0 | 0 | 0 | 109.9 | Y33 P34 A97 | N31-Y33 HydrophobicContact CB-CD2 3.75Å; N31-Y33 HydrophobicContact CB-CE2 4.35Å; N31-Y33 VanDerWaalsContact ND2-CD2 3.26Å; N31-Y33 WeakPolarHBondContact ND2-CD2 3.21Å; N31-Y33 WeakPolarHBondContact ND2-CE2 3.49Å; N31-Y33 PolarHBondContact O-N 3.08Å; N31-Y33 VanDerWaalsContact O-N 3.14Å; N31-P34 WeakPolarHBondContact O-CD 2.97Å; N31-A97 VanDerWaalsContact CB-O 3.23Å; N31-A97 WeakPolarHBondContact CB-O 3.34Å | ||
| 32 | W | 67.9 | Low | 77 | Confident | 182 Ų | 182 | 70 Ų | 70 | 69% | 0.689 | 36% | 0.361 | S | S | * | . | S | Bend | trans | -73.4 | 1.2 | -178.6 | 44 | -80.6 | 0 | 0 | 0 | 113.7 | L35 | W32-L35 WeakPolarHBondContact O-CB 3.47Å; W32-L35 PolarHBondContact O-N 3.31Å |
| 33 | Y | 71.5 | Confident | 76.5 | Confident | 97 Ų | 97 | 69.4 Ų | 69.4 | 38% | 0.38 | 35% | 0.354 | S | S | . | . | G | 310 helix | trans | -56.6 | -38.5 | 179.7 | -74.9 | -61.4 | 0 | 0 | 0 | 117.1 | N31 L35 F36 L88 A97 | N31-Y33 HydrophobicContact CB-CD2 3.75Å; N31-Y33 HydrophobicContact CB-CE2 4.35Å; N31-Y33 VanDerWaalsContact ND2-CD2 3.26Å; N31-Y33 WeakPolarHBondContact ND2-CD2 3.21Å; N31-Y33 WeakPolarHBondContact ND2-CE2 3.49Å; N31-Y33 PolarHBondContact O-N 3.08Å; N31-Y33 VanDerWaalsContact O-N 3.14Å; Y33-L35 PolarHBondContact O-N 2.97Å; Y33-L35 VanDerWaalsContact O-N 3.1Å; Y33-F36 WeakPolarHBondContact O-CB 3.42Å; Y33-F36 PolarHBondContact O-N 3.34Å; Y33-L88 HydrophobicContact CD1-CD2 4.11Å; Y33-L88 HydrophobicContact CD2-CD2 4.26Å; Y33-L88 HydrophobicContact CG-CD2 3.88Å; Y33-A97 HydrophobicContact CD2-CB 3.69Å; Y33-A97 HydrophobicContact CE2-CB 3.83Å |
| 34 | P | 71 | Confident | 75.9 | Confident | 1 Ų | 1 | 65.5 Ų | 65.5 | 1% | 0.006 | 33% | 0.334 | C | S | . | . | G | 310 helix | trans | -67.8 | -12.8 | -179.5 | 27.1 | -30.1 | 0 | 0 | 0 | 113 | C25 N31 F36 V37 I98 T106 | C25-P34 VanDerWaalsContact SG-CG 3.59Å; N31-P34 WeakPolarHBondContact O-CD 2.97Å; P34-F36 PolarHBondContact O-N 3.5Å; P34-V37 WeakPolarHBondContact O-CB 3.43Å; P34-V37 VanDerWaalsContact O-CG2 3.29Å; P34-V37 WeakPolarHBondContact O-CG2 3.28Å; P34-V37 PolarHBondContact O-N 2.85Å; P34-I98 HydrophobicContact CB-CD1 3.79Å; P34-I98 HydrophobicContact CG-CD1 3.8Å; P34-T106 HydrophobicContact CB-CG2 3.28Å; P34-T106 HydrophobicContact CG-CG2 3.99Å |
| 35 | L | 76.5 | Confident | 75.4 | Confident | 88 Ų | 88 | 67.8 Ų | 67.8 | 46% | 0.461 | 35% | 0.349 | S | S | . | . | G | 310 helix | trans | -63 | -22.6 | 172.2 | -150.9 | 163.5 | 0 | 0 | 0 | 111.7 | W32 Y33 V37 I38 | W32-L35 WeakPolarHBondContact O-CB 3.47Å; W32-L35 PolarHBondContact O-N 3.31Å; Y33-L35 PolarHBondContact O-N 2.97Å; Y33-L35 VanDerWaalsContact O-N 3.1Å; L35-V37 PolarHBondContact O-N 3.32Å; L35-I38 HydrophobicContact CD2-CB 4.36Å; L35-I38 HydrophobicContact CD2-CD1 3.61Å; L35-I38 HydrophobicContact CD2-CG1 4.14Å; L35-I38 HydrophobicContact CG-CD1 3.83Å; L35-I38 HydrophobicContact CG-CG1 4.46Å; L35-I38 VanDerWaalsContact O-CB 3.31Å; L35-I38 WeakPolarHBondContact O-CB 3.41Å; L35-I38 WeakPolarHBondContact O-CG1 3.46Å; L35-I38 PolarHBondContact O-N 3.23Å |
| 36 | F | 79 | Confident | 75 | Confident | 97 Ų | 97 | 69.5 Ų | 69.5 | 43% | 0.425 | 36% | 0.358 | S | S | . | . | G | 310 helix | trans | -57.3 | -27.2 | 175.5 | -166.8 | -93 | 0 | 0 | 0 | 112.9 | Y33 P34 I38 I39 F40 L84 | Y33-F36 WeakPolarHBondContact O-CB 3.42Å; Y33-F36 PolarHBondContact O-N 3.34Å; P34-F36 PolarHBondContact O-N 3.5Å; F36-I38 PolarHBondContact O-N 3.06Å; F36-I39 HydrophobicContact CD2-CD1 3.73Å; F36-I39 HydrophobicContact CE2-CD1 3.74Å; F36-I39 HydrophobicContact CG-CD1 4.34Å; F36-I39 HydrophobicContact CZ-CD1 4.37Å; F36-I39 WeakPolarHBondContact O-CB 3.27Å; F36-I39 PolarHBondContact O-N 3.2Å; F36-I39 VanDerWaalsContact O-N 3.12Å; F36-F40 HydrophobicContact CD1-CD2 4.38Å; F36-F40 AromaticContact CD1-CE2 3.73Å; F36-F40 HydrophobicContact CD1-CE2 3.73Å; F36-F40 HydrophobicContact CE1-CD2 4.45Å; F36-F40 AromaticContact CE1-CE2 3.54Å; F36-F40 HydrophobicContact CE1-CE2 3.54Å; F36-F40 AromaticContact CE1-CZ 3.95Å; F36-F40 HydrophobicContact CE1-CZ 3.95Å; F36-L84 HydrophobicContact CB-CD2 4.04Å; F36-L84 HydrophobicContact CD1-CD1 3.32Å; F36-L84 HydrophobicContact CD1-CD2 3.81Å; F36-L84 HydrophobicContact CD1-CG 4.21Å; F36-L84 HydrophobicContact CE1-CD1 3.5Å; F36-L84 VanDerWaalsContact CE1-CD1 3.5Å; F36-L84 HydrophobicContact CG-CD1 4.32Å; F36-L84 HydrophobicContact CG-CD2 4.29Å |
| 37 | V | 84.2 | Confident | 74 | Confident | 0 Ų | 0 | 65.9 Ų | 65.9 | 0% | 0 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -59.6 | -30.6 | 175.7 | -178.3 | 0 | 0 | 0 | 0 | 112.2 | P34 L35 I39 F40 Y41 A81 N110 | P34-V37 WeakPolarHBondContact O-CB 3.43Å; P34-V37 VanDerWaalsContact O-CG2 3.29Å; P34-V37 WeakPolarHBondContact O-CG2 3.28Å; P34-V37 PolarHBondContact O-N 2.85Å; L35-V37 PolarHBondContact O-N 3.32Å; V37-I39 PolarHBondContact O-N 2.98Å; V37-F40 WeakPolarHBondContact O-CB 3.43Å; V37-F40 PolarHBondContact O-N 3.2Å; V37-Y41 HydrophobicContact CG1-CD1 4.31Å; V37-Y41 HydrophobicContact CG1-CE1 3.52Å; V37-Y41 HydrophobicContact CG1-CE2 4.17Å; V37-Y41 VanDerWaalsContact CG1-CZ 3.42Å; V37-Y41 WeakPolarHBondContact CG1-OH 3.48Å; V37-Y41 PolarHBondContact O-N 2.87Å; V37-A81 HydrophobicContact CG1-CB 4.33Å; V37-N110 WeakPolarHBondContact CG1-ND2 3.46Å; V37-N110 WeakPolarHBondContact CG1-OD1 3.35Å |
| 38 | I | 84.1 | Confident | 73.6 | Confident | 51 Ų | 51 | 64.8 Ų | 64.8 | 26% | 0.262 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -59.2 | -33.3 | 178 | -59 | -172 | 0 | 0 | 0 | 111.5 | L21 L35 F36 F40 Y41 I42 | L21-I38 HydrophobicContact CD2-CD1 3.57Å; L21-I38 HydrophobicContact CD2-CG1 3.4Å; L21-I38 VanDerWaalsContact CD2-CG1 3.4Å; L35-I38 HydrophobicContact CD2-CB 4.36Å; L35-I38 HydrophobicContact CD2-CD1 3.61Å; L35-I38 HydrophobicContact CD2-CG1 4.14Å; L35-I38 HydrophobicContact CG-CD1 3.83Å; L35-I38 HydrophobicContact CG-CG1 4.46Å; L35-I38 VanDerWaalsContact O-CB 3.31Å; L35-I38 WeakPolarHBondContact O-CB 3.41Å; L35-I38 WeakPolarHBondContact O-CG1 3.46Å; L35-I38 PolarHBondContact O-N 3.23Å; F36-I38 PolarHBondContact O-N 3.06Å; I38-F40 VanDerWaalsContact C-N 3.26Å; I38-F40 PolarHBondContact O-N 3.05Å; I38-Y41 WeakPolarHBondContact O-CB 3.04Å; I38-Y41 PolarHBondContact O-N 3.35Å; I38-I42 HydrophobicContact CG2-CD1 4.25Å; I38-I42 WeakPolarHBondContact O-CG1 3.35Å; I38-I42 PolarHBondContact O-N 3.37Å |
| 39 | I | 84 | Confident | 74 | Confident | 81 Ų | 81 | 63.4 Ų | 63.4 | 42% | 0.415 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -62 | -39.5 | 177.6 | -61.4 | 169.5 | 0 | 0 | 0 | 109.9 | F36 V37 Y41 I42 L43 | F36-I39 HydrophobicContact CD2-CD1 3.73Å; F36-I39 HydrophobicContact CE2-CD1 3.74Å; F36-I39 HydrophobicContact CG-CD1 4.34Å; F36-I39 HydrophobicContact CZ-CD1 4.37Å; F36-I39 WeakPolarHBondContact O-CB 3.27Å; F36-I39 PolarHBondContact O-N 3.2Å; F36-I39 VanDerWaalsContact O-N 3.12Å; V37-I39 PolarHBondContact O-N 2.98Å; I39-Y41 VanDerWaalsContact C-N 3.34Å; I39-Y41 PolarHBondContact O-N 2.81Å; I39-I42 PolarHBondContact O-N 3.29Å; I39-L43 HydrophobicContact CG2-CD1 3.8Å; I39-L43 WeakPolarHBondContact O-CD1 3.41Å; I39-L43 WeakPolarHBondContact O-CG 3.36Å; I39-L43 PolarHBondContact O-N 2.97Å |
| 40 | F | 83.6 | Confident | 74.2 | Confident | 32 Ų | 32 | 60 Ų | 60 | 14% | 0.14 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -68.4 | -31.5 | 174.5 | -66.4 | -71.7 | 0 | 0 | 0 | 112.8 | F36 V37 I38 I42 L43 A44 I77 S80 A81 L84 | F36-F40 HydrophobicContact CD1-CD2 4.38Å; F36-F40 AromaticContact CD1-CE2 3.73Å; F36-F40 HydrophobicContact CD1-CE2 3.73Å; F36-F40 HydrophobicContact CE1-CD2 4.45Å; F36-F40 AromaticContact CE1-CE2 3.54Å; F36-F40 HydrophobicContact CE1-CE2 3.54Å; F36-F40 AromaticContact CE1-CZ 3.95Å; F36-F40 HydrophobicContact CE1-CZ 3.95Å; V37-F40 WeakPolarHBondContact O-CB 3.43Å; V37-F40 PolarHBondContact O-N 3.2Å; I38-F40 VanDerWaalsContact C-N 3.26Å; I38-F40 PolarHBondContact O-N 3.05Å; F40-I42 VanDerWaalsContact C-N 3.32Å; F40-L43 PolarHBondContact O-N 3.19Å; F40-A44 WeakPolarHBondContact O-CB 3.25Å; F40-A44 PolarHBondContact O-N 3.49Å; F40-I77 HydrophobicContact CB-CG2 4.19Å; F40-I77 HydrophobicContact CD1-CG2 4.11Å; F40-S80 WeakPolarHBondContact CD1-OG 3.38Å; F40-S80 WeakPolarHBondContact CE1-OG 3.25Å; F40-S80 WeakPolarHBondContact CZ-OG 3.23Å; F40-A81 HydrophobicContact CB-CB 3.81Å; F40-A81 HydrophobicContact CD2-CB 4.14Å; F40-A81 HydrophobicContact CG-CB 4.04Å; F40-L84 HydrophobicContact CE2-CD1 4.17Å |
| 41 | Y | 84.5 | Confident | 73.9 | Confident | 26 Ų | 26 | 59 Ų | 59 | 10% | 0.102 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -66.6 | -34.8 | 173.6 | -58.6 | -20 | 0 | 0 | 0 | 112.3 | V37 I38 I39 P45 N110 S113 F114 | V37-Y41 HydrophobicContact CG1-CD1 4.31Å; V37-Y41 HydrophobicContact CG1-CE1 3.52Å; V37-Y41 HydrophobicContact CG1-CE2 4.17Å; V37-Y41 VanDerWaalsContact CG1-CZ 3.42Å; V37-Y41 WeakPolarHBondContact CG1-OH 3.48Å; V37-Y41 PolarHBondContact O-N 2.87Å; I38-Y41 WeakPolarHBondContact O-CB 3.04Å; I38-Y41 PolarHBondContact O-N 3.35Å; I39-Y41 VanDerWaalsContact C-N 3.34Å; I39-Y41 PolarHBondContact O-N 2.81Å; Y41-P45 WeakPolarHBondContact O-CD 3.42Å; Y41-N110 WeakPolarHBondContact CE1-OD1 3.32Å; Y41-N110 VanDerWaalsContact OH-CA 3.24Å; Y41-N110 WeakPolarHBondContact OH-CA 3.3Å; Y41-N110 VanDerWaalsContact OH-CG 3.31Å; Y41-N110 PolarHBondContact OH-N 3.32Å; Y41-N110 PolarHBondContact OH-OD1 3.36Å; Y41-S113 WeakPolarHBondContact CE1-OG 3.22Å; Y41-S113 PolarHBondContact OH-OG 3.34Å; Y41-S113 VanDerWaalsContact OH-OG 3.04Å; Y41-F114 HydrophobicContact CD1-CE1 4.3Å; Y41-F114 HydrophobicContact CD1-CZ 4.08Å; Y41-F114 HydrophobicContact CE1-CD2 4.49Å; Y41-F114 AromaticContact CE1-CE2 3.99Å; Y41-F114 HydrophobicContact CE1-CE2 3.99Å; Y41-F114 HydrophobicContact CE1-CZ 4.02Å |
| 42 | I | 78.4 | Confident | 73.6 | Confident | 118 Ų | 118 | 58.4 Ų | 58.4 | 61% | 0.605 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -74.2 | -33.8 | 175 | -61.5 | 169.5 | 0 | 0 | 0 | 111 | I38 I39 F40 P45 | I38-I42 HydrophobicContact CG2-CD1 4.25Å; I38-I42 WeakPolarHBondContact O-CG1 3.35Å; I38-I42 PolarHBondContact O-N 3.37Å; I39-I42 PolarHBondContact O-N 3.29Å; F40-I42 VanDerWaalsContact C-N 3.32Å; I42-P45 VanDerWaalsContact O-CD 3.25Å; I42-P45 WeakPolarHBondContact O-CD 3.45Å; I42-P45 VanDerWaalsContact O-CG 3.28Å; I42-P45 WeakPolarHBondContact O-CG 3.43Å |
| 43 | L | 78.2 | Confident | 73.2 | Confident | 76 Ų | 76 | 58.5 Ų | 58.5 | 40% | 0.398 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -74.2 | -28.1 | 175.3 | -77.5 | 155.1 | 0 | 0 | 0 | 113 | I39 F40 V46 P47 I77 | I39-L43 HydrophobicContact CG2-CD1 3.8Å; I39-L43 WeakPolarHBondContact O-CD1 3.41Å; I39-L43 WeakPolarHBondContact O-CG 3.36Å; I39-L43 PolarHBondContact O-N 2.97Å; F40-L43 PolarHBondContact O-N 3.19Å; L43-V46 VanDerWaalsContact O-CB 3.26Å; L43-V46 WeakPolarHBondContact O-CB 3.36Å; L43-V46 WeakPolarHBondContact O-CG2 3.31Å; L43-V46 PolarHBondContact O-N 3.27Å; L43-V46 VanDerWaalsContact O-N 3.15Å; L43-P47 WeakPolarHBondContact O-CD 3.47Å; L43-I77 HydrophobicContact CB-CD1 4.34Å |
| 44 | A | 75 | Confident | 72.4 | Confident | 4 Ų | 4 | 57.4 Ų | 57.4 | 3% | 0.033 | 30% | 0.298 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -58.7 | -40.2 | -179.2 | 0 | 0 | 0 | 0 | 0 | 116 | F40 V46 P47 L48 I77 F114 I117 | F40-A44 WeakPolarHBondContact O-CB 3.25Å; F40-A44 PolarHBondContact O-N 3.49Å; A44-V46 PolarHBondContact O-N 2.87Å; A44-P47 WeakPolarHBondContact O-CD 3.38Å; A44-P47 VanDerWaalsContact O-CG 3.31Å; A44-P47 WeakPolarHBondContact O-CG 3.48Å; A44-L48 WeakPolarHBondContact O-CD1 3.41Å; A44-I77 HydrophobicContact CB-CG2 4.46Å; A44-F114 HydrophobicContact CB-CE1 4.29Å; A44-I117 HydrophobicContact CB-CD1 4.19Å |
| 45 | P | 70.7 | Confident | 71.6 | Confident | 47 Ų | 47 | 63.3 Ų | 63.3 | 31% | 0.305 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -69.5 | -19.7 | 175 | 24.4 | -34.3 | 0 | 0 | 0 | 113.6 | Y41 I42 L48 T49 F121 | Y41-P45 WeakPolarHBondContact O-CD 3.42Å; I42-P45 VanDerWaalsContact O-CD 3.25Å; I42-P45 WeakPolarHBondContact O-CD 3.45Å; I42-P45 VanDerWaalsContact O-CG 3.28Å; I42-P45 WeakPolarHBondContact O-CG 3.43Å; P45-L48 PolarHBondContact O-N 2.97Å; P45-T49 WeakPolarHBondContact O-CG2 2.95Å; P45-T49 PolarHBondContact O-N 3.27Å; P45-T49 PolarHBondContact O-OG1 3.5Å; P45-F121 HydrophobicContact CB-CE2 4.19Å; P45-F121 HydrophobicContact CB-CZ 3.95Å |
| 46 | V | 72.8 | Confident | 70.5 | Confident | 70 Ų | 70 | 66.7 Ų | 66.7 | 42% | 0.424 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -59.6 | -55 | -179.7 | -177.5 | 0 | 0 | 0 | 0 | 112 | L43 A44 L48 T49 L50 | L43-V46 VanDerWaalsContact O-CB 3.26Å; L43-V46 WeakPolarHBondContact O-CB 3.36Å; L43-V46 WeakPolarHBondContact O-CG2 3.31Å; L43-V46 PolarHBondContact O-N 3.27Å; L43-V46 VanDerWaalsContact O-N 3.15Å; A44-V46 PolarHBondContact O-N 2.87Å; V46-L48 VanDerWaalsContact C-N 3.33Å; V46-L48 PolarHBondContact O-N 3.35Å; V46-T49 PolarHBondContact O-N 3.26Å; V46-T49 PolarHBondContact O-OG1 3.47Å; V46-L50 HydrophobicContact CG1-CD1 4.21Å; V46-L50 VanDerWaalsContact O-CD1 3.31Å; V46-L50 WeakPolarHBondContact O-CD1 3.24Å; V46-L50 PolarHBondContact O-N 2.86Å; V46-L50 VanDerWaalsContact O-N 3.08Å |
| 47 | P | 61.4 | Low | 69.1 | Low | 2 Ų | 2 | 70.2 Ų | 70.2 | 1% | 0.013 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -67.3 | -30.4 | 179.3 | 28.1 | -37.7 | 0 | 0 | 0 | 113.7 | L43 A44 L50 A51 L73 T74 I77 | L43-P47 WeakPolarHBondContact O-CD 3.47Å; A44-P47 WeakPolarHBondContact O-CD 3.38Å; A44-P47 VanDerWaalsContact O-CG 3.31Å; A44-P47 WeakPolarHBondContact O-CG 3.48Å; P47-L50 WeakPolarHBondContact O-CB 3.46Å; P47-L50 PolarHBondContact O-N 3.18Å; P47-A51 PolarHBondContact O-N 2.87Å; P47-L73 HydrophobicContact CB-CD2 4.48Å; P47-T74 WeakPolarHBondContact CB-OG1 3.48Å; P47-T74 HydrophobicContact CG-CG2 4.35Å; P47-T74 VanDerWaalsContact CG-OG1 3.23Å; P47-T74 WeakPolarHBondContact CG-OG1 3.4Å; P47-I77 HydrophobicContact CG-CD1 4.14Å |
| 48 | L | 66.9 | Low | 67.5 | Low | 53 Ų | 53 | 73.1 Ų | 73.1 | 28% | 0.277 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -67.1 | -42.4 | 177.5 | -77.5 | 144.6 | 0 | 0 | 0 | 111.7 | A44 P45 V46 L50 A51 G52 I117 F121 | A44-L48 WeakPolarHBondContact O-CD1 3.41Å; P45-L48 PolarHBondContact O-N 2.97Å; V46-L48 VanDerWaalsContact C-N 3.33Å; V46-L48 PolarHBondContact O-N 3.35Å; L48-L50 VanDerWaalsContact C-N 3.34Å; L48-A51 PolarHBondContact O-N 3.44Å; L48-G52 PolarHBondContact O-N 3.29Å; L48-I117 HydrophobicContact CD1-CG2 4.14Å; L48-F121 HydrophobicContact CB-CD1 3.91Å; L48-F121 HydrophobicContact CB-CD2 4Å; L48-F121 HydrophobicContact CB-CE1 3.54Å; L48-F121 HydrophobicContact CB-CE2 3.64Å; L48-F121 HydrophobicContact CB-CG 4.13Å; L48-F121 HydrophobicContact CB-CZ 3.39Å; L48-F121 HydrophobicContact CD1-CD2 3.44Å; L48-F121 VanDerWaalsContact CD1-CD2 3.44Å; L48-F121 HydrophobicContact CD1-CE2 3.34Å; L48-F121 HydrophobicContact CD1-CG 4.22Å; L48-F121 HydrophobicContact CD1-CZ 4.05Å; L48-F121 HydrophobicContact CD2-CB 4.16Å; L48-F121 HydrophobicContact CD2-CD1 4.28Å; L48-F121 HydrophobicContact CD2-CD2 3.94Å; L48-F121 HydrophobicContact CD2-CE2 4.41Å; L48-F121 HydrophobicContact CD2-CG 3.87Å; L48-F121 HydrophobicContact CG-CD2 3.97Å; L48-F121 HydrophobicContact CG-CE2 3.94Å; L48-F121 HydrophobicContact CG-CG 4.27Å; L48-F121 HydrophobicContact CG-CZ 4.22Å |
| 49 | T | 68.6 | Low | 66 | Low | 73 Ų | 73 | 76.3 Ų | 76.3 | 45% | 0.448 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -68.4 | -33.4 | 173 | 58.8 | 0 | 0 | 0 | 0 | 112.4 | P45 V46 G52 R53 F121 | P45-T49 WeakPolarHBondContact O-CG2 2.95Å; P45-T49 PolarHBondContact O-N 3.27Å; P45-T49 PolarHBondContact O-OG1 3.5Å; V46-T49 PolarHBondContact O-N 3.26Å; V46-T49 PolarHBondContact O-OG1 3.47Å; T49-G52 PolarHBondContact O-N 3.45Å; T49-R53 WeakPolarHBondContact O-CG 3.37Å; T49-R53 PolarHBondContact O-N 3.41Å; T49-R53 VanDerWaalsContact O-N 3.12Å; T49-F121 HydrophobicContact CG2-CE1 4.42Å |
| 50 | L | 66.9 | Low | 64.6 | Low | 63 Ų | 63 | 76.4 Ų | 76.4 | 33% | 0.33 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -58.6 | -47.3 | 172.7 | -103.5 | 68.9 | 0 | 0 | 0 | 110.8 | V46 P47 L48 G52 R53 Y54 | V46-L50 HydrophobicContact CG1-CD1 4.21Å; V46-L50 VanDerWaalsContact O-CD1 3.31Å; V46-L50 WeakPolarHBondContact O-CD1 3.24Å; V46-L50 PolarHBondContact O-N 2.86Å; V46-L50 VanDerWaalsContact O-N 3.08Å; P47-L50 WeakPolarHBondContact O-CB 3.46Å; P47-L50 PolarHBondContact O-N 3.18Å; L48-L50 VanDerWaalsContact C-N 3.34Å; L50-G52 VanDerWaalsContact C-N 3.31Å; L50-G52 PolarHBondContact O-N 2.81Å; L50-R53 PolarHBondContact O-N 3.04Å; L50-Y54 HydrophobicContact CB-CD2 4.23Å; L50-Y54 HydrophobicContact CB-CE2 3.87Å; L50-Y54 HydrophobicContact CD2-CE2 3.98Å; L50-Y54 HydrophobicContact CG-CE2 3.7Å; L50-Y54 WeakPolarHBondContact O-CD2 3.36Å; L50-Y54 PolarHBondContact O-N 3.16Å; L50-Y54 VanDerWaalsContact O-N 3.08Å |
| 51 | A | 59 | Low | 63.3 | Low | 26 Ų | 26 | 78.6 Ų | 78.6 | 22% | 0.215 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -56.3 | -43.8 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | P47 L48 Y54 Q55 | P47-A51 PolarHBondContact O-N 2.87Å; L48-A51 PolarHBondContact O-N 3.44Å; A51-Y54 PolarHBondContact O-N 3.45Å; A51-Q55 PolarHBondContact O-N 2.88Å; A51-Q55 VanDerWaalsContact O-N 3.08Å |
| 52 | G | 60.3 | Low | 62.1 | Low | 40 Ų | 40 | 81.6 Ų | 81.6 | 41% | 0.412 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -64 | -42.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | L48 T49 L50 Y54 Q55 | L48-G52 PolarHBondContact O-N 3.29Å; T49-G52 PolarHBondContact O-N 3.45Å; L50-G52 VanDerWaalsContact C-N 3.31Å; L50-G52 PolarHBondContact O-N 2.81Å; G52-Y54 VanDerWaalsContact C-N 3.28Å; G52-Y54 PolarHBondContact O-N 3.43Å; G52-Q55 PolarHBondContact O-N 3.05Å |
| 53 | R | 60.5 | Low | 61.3 | Low | 183 Ų | 183 | 76.7 Ų | 76.7 | 69% | 0.691 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -65.2 | -31 | 177.5 | -65.6 | -70.2 | -173.5 | -175.5 | -0.6 | 112.8 | T49 L50 | T49-R53 WeakPolarHBondContact O-CG 3.37Å; T49-R53 PolarHBondContact O-N 3.41Å; T49-R53 VanDerWaalsContact O-N 3.12Å; L50-R53 PolarHBondContact O-N 3.04Å |
| 54 | Y | 55.3 | Low | 60.7 | Low | 75 Ų | 75 | 76 Ų | 76 | 29% | 0.294 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -85.1 | -26.4 | -179.1 | -66.4 | -59.4 | 0 | 0 | 0 | 113.6 | L50 A51 G52 E56 R57 A58 C66 | L50-Y54 HydrophobicContact CB-CD2 4.23Å; L50-Y54 HydrophobicContact CB-CE2 3.87Å; L50-Y54 HydrophobicContact CD2-CE2 3.98Å; L50-Y54 HydrophobicContact CG-CE2 3.7Å; L50-Y54 WeakPolarHBondContact O-CD2 3.36Å; L50-Y54 PolarHBondContact O-N 3.16Å; L50-Y54 VanDerWaalsContact O-N 3.08Å; A51-Y54 PolarHBondContact O-N 3.45Å; G52-Y54 VanDerWaalsContact C-N 3.28Å; G52-Y54 PolarHBondContact O-N 3.43Å; Y54-E56 PolarHBondContact O-N 3.07Å; Y54-R57 CarbonylContact O-C 3.24Å; Y54-R57 WeakPolarHBondContact O-CA 3.43Å; Y54-R57 PolarHBondContact O-N 2.89Å; Y54-A58 PolarHBondContact O-N 3.32Å; Y54-A58 VanDerWaalsContact O-N 3.15Å; Y54-C66 WeakPolarHBondContact CE2-SG 3.18Å |
| 55 | Q | 54 | Low | 60.5 | Low | 125 Ų | 125 | 79.7 Ų | 79.7 | 58% | 0.584 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -55.2 | -37 | 166.7 | -103 | -177.8 | -82.5 | 0 | 0 | 111.2 | A51 G52 R57 A58 | A51-Q55 PolarHBondContact O-N 2.88Å; A51-Q55 VanDerWaalsContact O-N 3.08Å; G52-Q55 PolarHBondContact O-N 3.05Å; Q55-R57 PolarHBondContact O-N 3.25Å; Q55-A58 WeakPolarHBondContact O-CB 3.2Å; Q55-A58 PolarHBondContact O-N 3.1Å; Q55-A58 VanDerWaalsContact O-N 3.09Å |
| 56 | E | 52.4 | Low | 60.6 | Low | 158 Ų | 158 | 79.1 Ų | 79.1 | 74% | 0.738 | 47% | 0.465 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.9 | -21.3 | 176.5 | -159.6 | 157.8 | -158.7 | 0 | 0 | 113.2 | Y54 | Y54-E56 PolarHBondContact O-N 3.07Š|
| 57 | R | 50 | Low | 60.7 | Low | 172 Ų | 172 | 79.9 Ų | 79.9 | 65% | 0.649 | 46% | 0.464 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.7 | 2.6 | 172.5 | -69.2 | -175.4 | 175.5 | -165.5 | -0.8 | 113.8 | Y54 Q55 S59 T60 | Y54-R57 CarbonylContact O-C 3.24Å; Y54-R57 WeakPolarHBondContact O-CA 3.43Å; Y54-R57 PolarHBondContact O-N 2.89Å; Q55-R57 PolarHBondContact O-N 3.25Å; R57-S59 PolarHBondContact O-N 3.41Å; R57-T60 PolarHBondContact O-N 2.87Å; R57-T60 VanDerWaalsContact O-N 3.11Å; R57-T60 PolarHBondContact O-OG1 3.15Å |
| 58 | A | 51.3 | Low | 61.5 | Low | 61 Ų | 61 | 84.8 Ų | 84.8 | 50% | 0.504 | 49% | 0.49 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.3 | -1.3 | -174 | 0 | 0 | 0 | 0 | 0 | 115 | Y54 Q55 T60 A63 | Y54-A58 PolarHBondContact O-N 3.32Å; Y54-A58 VanDerWaalsContact O-N 3.15Å; Q55-A58 WeakPolarHBondContact O-CB 3.2Å; Q55-A58 PolarHBondContact O-N 3.1Å; Q55-A58 VanDerWaalsContact O-N 3.09Å; A58-T60 PolarHBondContact O-N 3.38Å; A58-T60 VanDerWaalsContact O-N 3.15Å; A58-A63 HydrophobicContact CB-CB 4.31Å |
| 59 | S | 51.8 | Low | 62.2 | Low | 117 Ų | 117 | 88.3 Ų | 88.3 | 82% | 0.818 | 50% | 0.504 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.6 | -7.4 | 164.8 | 58.4 | 0 | 0 | 0 | 0 | 113.6 | R57 | R57-S59 PolarHBondContact O-N 3.41Š|
| 60 | T | 54.1 | Low | 62.9 | Low | 83 Ų | 83 | 85 Ų | 85 | 51% | 0.509 | 48% | 0.484 | S | S | . | . | S | Bend | trans | -125.1 | 122.4 | 174.6 | 48.4 | 0 | 0 | 0 | 0 | 111.3 | R57 A58 S62 A63 | R57-T60 PolarHBondContact O-N 2.87Å; R57-T60 VanDerWaalsContact O-N 3.11Å; R57-T60 PolarHBondContact O-OG1 3.15Å; A58-T60 PolarHBondContact O-N 3.38Å; A58-T60 VanDerWaalsContact O-N 3.15Å; T60-S62 PolarHBondContact O-N 2.95Å; T60-A63 PolarHBondContact O-N 3.46Å |
| 61 | G | 57.1 | Low | 63.6 | Low | 78 Ų | 78 | 86.8 Ų | 86.8 | 80% | 0.804 | 49% | 0.494 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.4 | -4.2 | -173.3 | 0 | 0 | 0 | 0 | 0 | 117.3 | A63 | G61-A63 PolarHBondContact O-N 3.43Š|
| 62 | S | 59.2 | Low | 65 | Low | 90 Ų | 90 | 92.8 Ų | 92.8 | 63% | 0.629 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -67.3 | -22.3 | 167.3 | -57.8 | 0 | 0 | 0 | 0 | 113.1 | T60 A64 S65 | T60-S62 PolarHBondContact O-N 2.95Å; S62-A64 PolarHBondContact O-N 3.27Å; S62-S65 PolarHBondContact O-N 3.24Å; S62-S65 PolarHBondContact O-OG 3.33Å |
| 63 | A | 61.1 | Low | 66.2 | Low | 15 Ų | 15 | 94.4 Ų | 94.4 | 12% | 0.124 | 51% | 0.514 | C | S | . | . | H | α-helix | trans | -64.4 | -36.1 | -177 | 0 | 0 | 0 | 0 | 0 | 113.7 | A58 T60 G61 S65 C66 Q67 | A58-A63 HydrophobicContact CB-CB 4.31Å; T60-A63 PolarHBondContact O-N 3.46Å; G61-A63 PolarHBondContact O-N 3.43Å; A63-S65 VanDerWaalsContact C-N 3.35Å; A63-S65 PolarHBondContact O-N 3.14Å; A63-C66 PolarHBondContact O-N 2.88Å; A63-Q67 PolarHBondContact O-N 3.42Å |
| 64 | A | 66.7 | Low | 67.4 | Low | 61 Ų | 61 | 86.8 Ų | 86.8 | 50% | 0.504 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -58.6 | -45.3 | -179.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | S62 C66 Q67 D68 | S62-A64 PolarHBondContact O-N 3.27Å; A64-C66 VanDerWaalsContact C-N 3.34Å; A64-C66 PolarHBondContact O-N 3.36Å; A64-Q67 PolarHBondContact O-N 3.11Å; A64-D68 PolarHBondContact O-N 2.96Å; A64-D68 VanDerWaalsContact O-N 3.12Å |
| 65 | S | 71.1 | Confident | 69 | Low | 82 Ų | 82 | 85.6 Ų | 85.6 | 57% | 0.573 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -64.8 | -35.4 | 178.3 | 67.5 | 0 | 0 | 0 | 0 | 113.5 | S62 A63 F69 | S62-S65 PolarHBondContact O-N 3.24Å; S62-S65 PolarHBondContact O-OG 3.33Å; A63-S65 VanDerWaalsContact C-N 3.35Å; A63-S65 PolarHBondContact O-N 3.14Å; S65-F69 PolarHBondContact O-N 2.76Å; S65-F69 VanDerWaalsContact O-N 3.11Å |
| 66 | C | 72.5 | Confident | 70.7 | Confident | 34 Ų | 34 | 81.5 Ų | 81.5 | 23% | 0.23 | 49% | 0.485 | C | S | . | . | H | α-helix | trans | -73 | -33.7 | 178.4 | -171 | 0 | 0 | 0 | 0 | 111.8 | Y54 A63 A64 F69 A70 | Y54-C66 WeakPolarHBondContact CE2-SG 3.18Å; A63-C66 PolarHBondContact O-N 2.88Å; A64-C66 VanDerWaalsContact C-N 3.34Å; A64-C66 PolarHBondContact O-N 3.36Å; C66-F69 PolarHBondContact O-N 2.93Å; C66-A70 PolarHBondContact O-N 3.49Å |
| 67 | Q | 73.9 | Confident | 72.4 | Confident | 86 Ų | 86 | 74.9 Ų | 74.9 | 40% | 0.402 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -64.2 | -46.9 | 174.1 | -178.6 | 179.8 | -35 | 0 | 0 | 110.8 | A63 A64 F69 A70 L71 | A63-Q67 PolarHBondContact O-N 3.42Å; A64-Q67 PolarHBondContact O-N 3.11Å; Q67-F69 VanDerWaalsContact C-N 3.27Å; Q67-F69 PolarHBondContact O-N 3.26Å; Q67-A70 PolarHBondContact O-N 3.44Å; Q67-A70 VanDerWaalsContact O-N 3.14Å; Q67-L71 HydrophobicContact CG-CD1 4.41Å; Q67-L71 WeakPolarHBondContact O-CG 3.24Å; Q67-L71 PolarHBondContact O-N 2.9Å |
| 68 | D | 79.4 | Confident | 74.3 | Confident | 105 Ų | 105 | 69.5 Ų | 69.5 | 56% | 0.561 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -60 | -39.7 | 176.5 | -68.9 | -18.3 | 0 | 0 | 0 | 111.4 | A64 L71 F72 | A64-D68 PolarHBondContact O-N 2.96Å; A64-D68 VanDerWaalsContact O-N 3.12Å; D68-L71 PolarHBondContact O-N 2.75Å; D68-F72 WeakPolarHBondContact O-CB 3.19Å; D68-F72 PolarHBondContact O-N 2.96Å |
| 69 | F | 81.5 | Confident | 76.2 | Confident | 127 Ų | 127 | 70.7 Ų | 70.7 | 56% | 0.557 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -64.8 | -41.1 | 174.8 | -177.6 | -107.1 | 0 | 0 | 0 | 113 | S65 C66 Q67 F72 L73 | S65-F69 PolarHBondContact O-N 2.76Å; S65-F69 VanDerWaalsContact O-N 3.11Å; C66-F69 PolarHBondContact O-N 2.93Å; Q67-F69 VanDerWaalsContact C-N 3.27Å; Q67-F69 PolarHBondContact O-N 3.26Å; F69-F72 PolarHBondContact O-N 3.45Å; F69-L73 WeakPolarHBondContact O-CB 3.4Å; F69-L73 PolarHBondContact O-N 3.39Å |
| 70 | A | 82.2 | Confident | 78 | Confident | 5 Ų | 5 | 66.9 Ų | 66.9 | 4% | 0.041 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -65.5 | -40 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112 | C66 Q67 L73 T74 | C66-A70 PolarHBondContact O-N 3.49Å; Q67-A70 PolarHBondContact O-N 3.44Å; Q67-A70 VanDerWaalsContact O-N 3.14Å; A70-L73 PolarHBondContact O-N 3.14Å; A70-T74 PolarHBondContact O-N 3.41Å; A70-T74 PolarHBondContact O-OG1 3.19Å |
| 71 | L | 82.3 | Confident | 79.6 | Confident | 100 Ų | 100 | 62.9 Ų | 62.9 | 52% | 0.524 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -63.7 | -43.4 | 173.5 | -71 | 173.5 | 0 | 0 | 0 | 111.3 | Q67 D68 L73 T74 A75 | Q67-L71 HydrophobicContact CG-CD1 4.41Å; Q67-L71 WeakPolarHBondContact O-CG 3.24Å; Q67-L71 PolarHBondContact O-N 2.9Å; D68-L71 PolarHBondContact O-N 2.75Å; L71-L73 PolarHBondContact O-N 3.5Å; L71-T74 WeakPolarHBondContact O-CB 3.42Å; L71-T74 PolarHBondContact O-N 3.46Å; L71-A75 PolarHBondContact O-N 2.91Å |
| 72 | F | 87.8 | Confident | 81.1 | Confident | 151 Ų | 151 | 61.5 Ų | 61.5 | 66% | 0.662 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -60.1 | -45.3 | 174.7 | -179.8 | -100.7 | 0 | 0 | 0 | 112 | D68 F69 T74 A75 G76 | D68-F72 WeakPolarHBondContact O-CB 3.19Å; D68-F72 PolarHBondContact O-N 2.96Å; F69-F72 PolarHBondContact O-N 3.45Å; F72-T74 VanDerWaalsContact C-N 3.33Å; F72-T74 PolarHBondContact O-N 2.93Å; F72-A75 PolarHBondContact O-N 2.85Å; F72-G76 PolarHBondContact O-N 2.96Å |
| 73 | L | 86.4 | Confident | 82.6 | Confident | 75 Ų | 75 | 59.8 Ų | 59.8 | 39% | 0.393 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -62.5 | -40.3 | 176.7 | -167.1 | 77.7 | 0 | 0 | 0 | 111.6 | P47 F69 A70 L71 G76 I77 | P47-L73 HydrophobicContact CB-CD2 4.48Å; F69-L73 WeakPolarHBondContact O-CB 3.4Å; F69-L73 PolarHBondContact O-N 3.39Å; A70-L73 PolarHBondContact O-N 3.14Å; L71-L73 PolarHBondContact O-N 3.5Å; L73-G76 PolarHBondContact O-N 2.92Å; L73-I77 HydrophobicContact CG-CD1 4.22Å; L73-I77 VanDerWaalsContact O-CG1 3.31Å; L73-I77 WeakPolarHBondContact O-CG1 3.39Å; L73-I77 PolarHBondContact O-N 3.49Å |
| 74 | T | 85.3 | Confident | 83.8 | Confident | 23 Ų | 23 | 61 Ų | 61 | 14% | 0.141 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -61.2 | -47.7 | 176.2 | -51.9 | 0 | 0 | 0 | 0 | 111 | P47 A70 L71 F72 G76 I77 I78 | P47-T74 WeakPolarHBondContact CB-OG1 3.48Å; P47-T74 HydrophobicContact CG-CG2 4.35Å; P47-T74 VanDerWaalsContact CG-OG1 3.23Å; P47-T74 WeakPolarHBondContact CG-OG1 3.4Å; A70-T74 PolarHBondContact O-N 3.41Å; A70-T74 PolarHBondContact O-OG1 3.19Å; L71-T74 WeakPolarHBondContact O-CB 3.42Å; L71-T74 PolarHBondContact O-N 3.46Å; F72-T74 VanDerWaalsContact C-N 3.33Å; F72-T74 PolarHBondContact O-N 2.93Å; T74-G76 VanDerWaalsContact C-N 3.32Å; T74-G76 PolarHBondContact O-N 2.95Å; T74-I77 PolarHBondContact O-N 2.9Å; T74-I78 HydrophobicContact CG2-CD1 4.09Å; T74-I78 WeakPolarHBondContact O-CG1 3.44Å; T74-I78 PolarHBondContact O-N 3.37Å |
| 75 | A | 88 | Confident | 84.5 | Confident | 50 Ų | 50 | 58.1 Ų | 58.1 | 41% | 0.413 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -60.9 | -42 | 176 | 0 | 0 | 0 | 0 | 0 | 111.4 | L71 F72 I77 I78 V79 | L71-A75 PolarHBondContact O-N 2.91Å; F72-A75 PolarHBondContact O-N 2.85Å; A75-I77 PolarHBondContact O-N 3.19Å; A75-I78 PolarHBondContact O-N 3.31Å; A75-V79 WeakPolarHBondContact O-CB 3.28Å; A75-V79 VanDerWaalsContact O-CG2 3.24Å; A75-V79 WeakPolarHBondContact O-CG2 3.18Å; A75-V79 PolarHBondContact O-N 3.08Å |
| 76 | G | 89.6 | Confident | 85.1 | Confident | 39 Ų | 39 | 57.1 Ų | 57.1 | 40% | 0.402 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -60 | -44.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113 | F72 L73 T74 V79 S80 | F72-G76 PolarHBondContact O-N 2.96Å; L73-G76 PolarHBondContact O-N 2.92Å; T74-G76 VanDerWaalsContact C-N 3.32Å; T74-G76 PolarHBondContact O-N 2.95Å; G76-V79 PolarHBondContact O-N 3.44Å; G76-S80 VanDerWaalsContact O-CB 3.28Å; G76-S80 WeakPolarHBondContact O-CB 3.04Å; G76-S80 PolarHBondContact O-N 2.98Å; G76-S80 PolarHBondContact O-OG 3.3Å |
| 77 | I | 88.4 | Confident | 85.6 | Confident | 19 Ų | 19 | 59.9 Ų | 59.9 | 10% | 0.097 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -61 | -49.1 | 175.8 | -72.6 | 164.9 | 0 | 0 | 0 | 110.4 | F40 L43 A44 P47 L73 T74 A75 S80 A81 | F40-I77 HydrophobicContact CB-CG2 4.19Å; F40-I77 HydrophobicContact CD1-CG2 4.11Å; L43-I77 HydrophobicContact CB-CD1 4.34Å; A44-I77 HydrophobicContact CB-CG2 4.46Å; P47-I77 HydrophobicContact CG-CD1 4.14Å; L73-I77 HydrophobicContact CG-CD1 4.22Å; L73-I77 VanDerWaalsContact O-CG1 3.31Å; L73-I77 WeakPolarHBondContact O-CG1 3.39Å; L73-I77 PolarHBondContact O-N 3.49Å; T74-I77 PolarHBondContact O-N 2.9Å; A75-I77 PolarHBondContact O-N 3.19Å; I77-S80 WeakPolarHBondContact CA-OG 3.31Å; I77-S80 PolarHBondContact O-N 3.04Å; I77-S80 PolarHBondContact O-OG 3.36Å; I77-A81 WeakPolarHBondContact O-CB 3.25Å; I77-A81 PolarHBondContact O-N 3.26Å |
| 78 | I | 90 | Very high | 85.6 | Confident | 59 Ų | 59 | 57.3 Ų | 57.3 | 30% | 0.303 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -59.3 | -52.4 | 178.5 | -67.1 | 168.6 | 0 | 0 | 0 | 109.9 | T74 A75 S80 A81 F82 F114 | T74-I78 HydrophobicContact CG2-CD1 4.09Å; T74-I78 WeakPolarHBondContact O-CG1 3.44Å; T74-I78 PolarHBondContact O-N 3.37Å; A75-I78 PolarHBondContact O-N 3.31Å; I78-S80 VanDerWaalsContact C-N 3.27Å; I78-S80 PolarHBondContact O-N 3.4Å; I78-A81 WeakPolarHBondContact O-CB 3.26Å; I78-A81 PolarHBondContact O-N 2.84Å; I78-A81 VanDerWaalsContact O-N 3.14Å; I78-F82 HydrophobicContact CG2-CD2 3.75Å; I78-F82 HydrophobicContact CG2-CE2 3.7Å; I78-F82 WeakPolarHBondContact O-CD2 3.38Å; I78-F82 PolarHBondContact O-N 3.35Å; I78-F82 VanDerWaalsContact O-N 3.11Å; I78-F114 HydrophobicContact CB-CE1 4.48Å; I78-F114 HydrophobicContact CB-CZ 4.46Å; I78-F114 HydrophobicContact CG1-CD1 3.85Å; I78-F114 HydrophobicContact CG1-CE1 3.73Å; I78-F114 HydrophobicContact CG1-CG 4.42Å; I78-F114 HydrophobicContact CG1-CZ 4.19Å; I78-F114 HydrophobicContact CG2-CD2 4.38Å; I78-F114 HydrophobicContact CG2-CE2 4.38Å |
| 79 | V | 91.2 | Very high | 85.2 | Confident | 86 Ų | 86 | 52.8 Ų | 52.8 | 52% | 0.521 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -59.1 | -39.4 | 179.7 | 171.7 | 0 | 0 | 0 | 0 | 111.3 | A75 G76 F82 S83 | A75-V79 WeakPolarHBondContact O-CB 3.28Å; A75-V79 VanDerWaalsContact O-CG2 3.24Å; A75-V79 WeakPolarHBondContact O-CG2 3.18Å; A75-V79 PolarHBondContact O-N 3.08Å; G76-V79 PolarHBondContact O-N 3.44Å; V79-F82 PolarHBondContact O-N 3.43Å; V79-S83 VanDerWaalsContact O-CB 3.25Å; V79-S83 WeakPolarHBondContact O-CB 3.21Å; V79-S83 PolarHBondContact O-N 3Å; V79-S83 PolarHBondContact O-OG 3.43Å |
| 80 | S | 89.9 | Confident | 84.6 | Confident | 36 Ų | 36 | 56.2 Ų | 56.2 | 25% | 0.252 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -67.7 | -37.5 | 177.9 | 68.9 | 0 | 0 | 0 | 0 | 113 | F40 G76 I77 I78 F82 S83 L84 | F40-S80 WeakPolarHBondContact CD1-OG 3.38Å; F40-S80 WeakPolarHBondContact CE1-OG 3.25Å; F40-S80 WeakPolarHBondContact CZ-OG 3.23Å; G76-S80 VanDerWaalsContact O-CB 3.28Å; G76-S80 WeakPolarHBondContact O-CB 3.04Å; G76-S80 PolarHBondContact O-N 2.98Å; G76-S80 PolarHBondContact O-OG 3.3Å; I77-S80 WeakPolarHBondContact CA-OG 3.31Å; I77-S80 PolarHBondContact O-N 3.04Å; I77-S80 PolarHBondContact O-OG 3.36Å; I78-S80 VanDerWaalsContact C-N 3.27Å; I78-S80 PolarHBondContact O-N 3.4Å; S80-F82 VanDerWaalsContact C-N 3.3Å; S80-F82 PolarHBondContact O-N 3.42Å; S80-S83 PolarHBondContact O-N 2.9Å; S80-L84 WeakPolarHBondContact O-CB 3.4Å; S80-L84 PolarHBondContact O-N 3.47Å |
| 81 | A | 88.2 | Confident | 83.8 | Confident | 0 Ų | 0 | 59.4 Ų | 59.4 | 0% | 0 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -65.3 | -33.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | V37 F40 I77 I78 P85 F114 | V37-A81 HydrophobicContact CG1-CB 4.33Å; F40-A81 HydrophobicContact CB-CB 3.81Å; F40-A81 HydrophobicContact CD2-CB 4.14Å; F40-A81 HydrophobicContact CG-CB 4.04Å; I77-A81 WeakPolarHBondContact O-CB 3.25Å; I77-A81 PolarHBondContact O-N 3.26Å; I78-A81 WeakPolarHBondContact O-CB 3.26Å; I78-A81 PolarHBondContact O-N 2.84Å; I78-A81 VanDerWaalsContact O-N 3.14Å; A81-P85 WeakPolarHBondContact O-CD 3.46Å; A81-P85 WeakPolarHBondContact O-CG 3.03Å; A81-F114 HydrophobicContact CB-CE2 3.62Å; A81-F114 HydrophobicContact CB-CZ 3.46Å; A81-F114 VanDerWaalsContact CB-CZ 3.46Å |
| 82 | F | 89.2 | Confident | 82.4 | Confident | 49 Ų | 49 | 57.5 Ų | 57.5 | 22% | 0.215 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -79.5 | -36.6 | 173.2 | -78.9 | -72.3 | 0 | 0 | 0 | 113.2 | I78 V79 S80 P85 V86 L107 N110 I111 F114 | I78-F82 HydrophobicContact CG2-CD2 3.75Å; I78-F82 HydrophobicContact CG2-CE2 3.7Å; I78-F82 WeakPolarHBondContact O-CD2 3.38Å; I78-F82 PolarHBondContact O-N 3.35Å; I78-F82 VanDerWaalsContact O-N 3.11Å; V79-F82 PolarHBondContact O-N 3.43Å; S80-F82 VanDerWaalsContact C-N 3.3Å; S80-F82 PolarHBondContact O-N 3.42Å; F82-P85 WeakPolarHBondContact O-CD 3.19Å; F82-P85 WeakPolarHBondContact O-CG 3.33Å; F82-V86 WeakPolarHBondContact O-CG2 3.33Å; F82-L107 HydrophobicContact CD1-CD1 3.49Å; F82-L107 VanDerWaalsContact CD1-CD1 3.49Å; F82-L107 HydrophobicContact CD1-CG 4.25Å; F82-L107 HydrophobicContact CE1-CD1 4.01Å; F82-L107 HydrophobicContact CE1-CG 4.27Å; F82-N110 HydrophobicContact CD1-CB 4.08Å; F82-N110 HydrophobicContact CE1-CB 3.48Å; F82-N110 VanDerWaalsContact CE1-CB 3.48Å; F82-N110 HydrophobicContact CE2-CB 4.41Å; F82-N110 HydrophobicContact CZ-CB 3.67Å; F82-I111 HydrophobicContact CE1-CG1 3.8Å; F82-I111 HydrophobicContact CZ-CG1 3.82Å; F82-F114 HydrophobicContact CD2-CD2 4.42Å; F82-F114 HydrophobicContact CD2-CE2 4.24Å; F82-F114 AromaticContact CE2-CD2 3.55Å; F82-F114 HydrophobicContact CE2-CD2 3.55Å; F82-F114 AromaticContact CE2-CE2 3.81Å; F82-F114 HydrophobicContact CE2-CE2 3.81Å; F82-F114 AromaticContact CZ-CD2 3.96Å; F82-F114 HydrophobicContact CZ-CD2 3.96Å; F82-F114 HydrophobicContact CZ-CE2 4.42Å |
| 83 | S | 90 | Very high | 81 | Confident | 54 Ų | 54 | 54.9 Ų | 54.9 | 38% | 0.378 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -72.7 | -37 | -177.2 | -61.3 | 0 | 0 | 0 | 0 | 112.1 | V79 S80 V86 V87 | V79-S83 VanDerWaalsContact O-CB 3.25Å; V79-S83 WeakPolarHBondContact O-CB 3.21Å; V79-S83 PolarHBondContact O-N 3Å; V79-S83 PolarHBondContact O-OG 3.43Å; S80-S83 PolarHBondContact O-N 2.9Å; S83-V86 WeakPolarHBondContact O-CB 3.47Å; S83-V86 PolarHBondContact O-N 2.83Å; S83-V87 VanDerWaalsContact O-CG2 3.3Å; S83-V87 WeakPolarHBondContact O-CG2 3.12Å; S83-V87 PolarHBondContact O-N 3.18Å |
| 84 | L | 85.7 | Confident | 79.5 | Confident | 40 Ų | 40 | 59.2 Ų | 59.2 | 21% | 0.209 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -58.2 | -52.7 | -177.6 | -170.2 | 132.3 | 0 | 0 | 0 | 114 | F36 F40 S80 V86 V87 L88 | F36-L84 HydrophobicContact CB-CD2 4.04Å; F36-L84 HydrophobicContact CD1-CD1 3.32Å; F36-L84 HydrophobicContact CD1-CD2 3.81Å; F36-L84 HydrophobicContact CD1-CG 4.21Å; F36-L84 HydrophobicContact CE1-CD1 3.5Å; F36-L84 VanDerWaalsContact CE1-CD1 3.5Å; F36-L84 HydrophobicContact CG-CD1 4.32Å; F36-L84 HydrophobicContact CG-CD2 4.29Å; F40-L84 HydrophobicContact CE2-CD1 4.17Å; S80-L84 WeakPolarHBondContact O-CB 3.4Å; S80-L84 PolarHBondContact O-N 3.47Å; L84-V86 PolarHBondContact O-N 3.47Å; L84-V87 PolarHBondContact O-N 2.99Å; L84-L88 HydrophobicContact CD2-CD1 3.31Å; L84-L88 HydrophobicContact CG-CD1 3.77Å; L84-L88 WeakPolarHBondContact O-CD1 3.37Å; L84-L88 PolarHBondContact O-N 3.27Å |
| 85 | P | 81.7 | Confident | 78.2 | Confident | 1 Ų | 1 | 61.2 Ų | 61.2 | 1% | 0.006 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -61.4 | -33.3 | 176.5 | 23 | -32.7 | 0 | 0 | 0 | 112.6 | A81 F82 A89 | A81-P85 WeakPolarHBondContact O-CD 3.46Å; A81-P85 WeakPolarHBondContact O-CG 3.03Å; F82-P85 WeakPolarHBondContact O-CD 3.19Å; F82-P85 WeakPolarHBondContact O-CG 3.33Å; P85-A89 WeakPolarHBondContact O-CB 3.29Å; P85-A89 PolarHBondContact O-N 3.47Å |
| 86 | V | 83.8 | Confident | 76.6 | Confident | 60 Ų | 60 | 62.5 Ų | 62.5 | 36% | 0.364 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -68.4 | -39.9 | 176.7 | 177.1 | 0 | 0 | 0 | 0 | 111.5 | F82 S83 L84 A89 R90 | F82-V86 WeakPolarHBondContact O-CG2 3.33Å; S83-V86 WeakPolarHBondContact O-CB 3.47Å; S83-V86 PolarHBondContact O-N 2.83Å; L84-V86 PolarHBondContact O-N 3.47Å; V86-A89 PolarHBondContact O-N 3.23Å; V86-R90 PolarHBondContact O-N 3.25Å |
| 87 | V | 82.6 | Confident | 75.2 | Confident | 93 Ų | 93 | 61.2 Ų | 61.2 | 56% | 0.564 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -69.7 | -40.8 | 176.7 | 173.8 | 0 | 0 | 0 | 0 | 111.1 | S83 L84 A89 R90 S91 | S83-V87 VanDerWaalsContact O-CG2 3.3Å; S83-V87 WeakPolarHBondContact O-CG2 3.12Å; S83-V87 PolarHBondContact O-N 3.18Å; L84-V87 PolarHBondContact O-N 2.99Å; V87-A89 VanDerWaalsContact C-N 3.31Å; V87-A89 PolarHBondContact O-N 3.4Å; V87-R90 PolarHBondContact O-N 2.96Å; V87-R90 VanDerWaalsContact O-N 3.07Å; V87-S91 PolarHBondContact O-N 3.43Å |
| 88 | L | 73.9 | Confident | 74 | Confident | 31 Ų | 31 | 60.4 Ų | 60.4 | 16% | 0.162 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -66.5 | -29.2 | 175.2 | -84.3 | 146.2 | 0 | 0 | 0 | 113.3 | Y33 L84 R90 A97 | Y33-L88 HydrophobicContact CD1-CD2 4.11Å; Y33-L88 HydrophobicContact CD2-CD2 4.26Å; Y33-L88 HydrophobicContact CG-CD2 3.88Å; L84-L88 HydrophobicContact CD2-CD1 3.31Å; L84-L88 HydrophobicContact CG-CD1 3.77Å; L84-L88 WeakPolarHBondContact O-CD1 3.37Å; L84-L88 PolarHBondContact O-N 3.27Å; L88-R90 PolarHBondContact O-N 2.87Å; L88-A97 HydrophobicContact CD2-CB 4.11Å |
| 89 | A | 71.3 | Confident | 73.3 | Confident | 11 Ų | 11 | 61.6 Ų | 61.6 | 9% | 0.091 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -69.2 | -25.1 | 170.7 | 0 | 0 | 0 | 0 | 0 | 113 | P85 V86 V87 I98 W100 C103 | P85-A89 WeakPolarHBondContact O-CB 3.29Å; P85-A89 PolarHBondContact O-N 3.47Å; V86-A89 PolarHBondContact O-N 3.23Å; V87-A89 VanDerWaalsContact C-N 3.31Å; V87-A89 PolarHBondContact O-N 3.4Å; A89-I98 HydrophobicContact CB-CG2 3.74Å; A89-W100 HydrophobicContact CB-CE3 4.43Å; A89-W100 HydrophobicContact CB-CZ3 4.41Å; A89-C103 HydrophobicContact CB-CB 4.06Å |
| 90 | R | 69.7 | Low | 72.5 | Confident | 199 Ų | 199 | 66.3 Ų | 66.3 | 75% | 0.751 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -92.1 | -28.4 | 179.5 | -171.4 | 177.4 | -70.8 | -174.1 | -2 | 113.2 | V86 V87 L88 | V86-R90 PolarHBondContact O-N 3.25Å; V87-R90 PolarHBondContact O-N 2.96Å; V87-R90 VanDerWaalsContact O-N 3.07Å; L88-R90 PolarHBondContact O-N 2.87Å |
| 91 | S | 64.5 | Low | 72.1 | Confident | 72 Ų | 72 | 66.4 Ų | 66.4 | 50% | 0.503 | 38% | 0.378 | S | S | . | . | S | Bend | trans | -133.1 | 130.1 | -173.4 | -170.7 | 0 | 0 | 0 | 0 | 111 | V87 | V87-S91 PolarHBondContact O-N 3.43Š|
| 92 | P | 54.3 | Low | 71.8 | Confident | 60 Ų | 60 | 66.4 Ų | 66.4 | 39% | 0.39 | 38% | 0.378 | S | S | . | . | cis | -96.6 | 137.6 | 14.4 | 18.5 | -5.2 | 0 | 0 | 0 | 114.9 | N94 A95 | P92-N94 PolarHBondContact O-N 3.45Å; P92-N94 VanDerWaalsContact O-N 3.08Å; P92-A95 VanDerWaalsContact CD-O 3.27Å; P92-A95 WeakPolarHBondContact CD-O 3.11Å; P92-A95 WeakPolarHBondContact CG-O 3.33Å; P92-A95 CarbonylContact O-C 3.59Å; P92-A95 VanDerWaalsContact O-C 3.24Å; P92-A95 PolarHBondContact O-N 3.35Å; P92-A95 VanDerWaalsContact O-N 3.1Å | ||
| 93 | A | 56.4 | Low | 71.5 | Confident | 96 Ų | 96 | 64.5 Ų | 64.5 | 79% | 0.793 | 37% | 0.37 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.2 | -21.2 | -179.1 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||
| 94 | N | 56.4 | Low | 71.3 | Confident | 166 Ų | 166 | 64 Ų | 64 | 89% | 0.888 | 37% | 0.373 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.7 | -15.2 | -179.7 | -61.8 | -35.9 | 0 | 0 | 0 | 113.5 | P92 | P92-N94 PolarHBondContact O-N 3.45Å; P92-N94 VanDerWaalsContact O-N 3.08Å |
| 95 | A | 56.7 | Low | 71.5 | Confident | 65 Ų | 65 | 65.3 Ų | 65.3 | 54% | 0.537 | 38% | 0.378 | S | S | . | . | S | Bend | trans | -157.9 | 81.4 | -178.5 | 0 | 0 | 0 | 0 | 0 | 108.3 | P92 A97 | P92-A95 VanDerWaalsContact CD-O 3.27Å; P92-A95 WeakPolarHBondContact CD-O 3.11Å; P92-A95 WeakPolarHBondContact CG-O 3.33Å; P92-A95 CarbonylContact O-C 3.59Å; P92-A95 VanDerWaalsContact O-C 3.24Å; P92-A95 PolarHBondContact O-N 3.35Å; P92-A95 VanDerWaalsContact O-N 3.1Å; A95-A97 PolarHBondContact O-N 3.48Å |
| 96 | P | 55.3 | Low | 71.8 | Confident | 76 Ų | 76 | 65.3 Ų | 65.3 | 49% | 0.494 | 38% | 0.377 | S | S | . | . | trans | -54.2 | 113.5 | -175.7 | 17.7 | -28.9 | 0 | 0 | 0 | 109.7 | I98 | P96-I98 PolarHBondContact O-N 2.66Š| ||
| 97 | A | 60 | Low | 72.1 | Confident | 12 Ų | 12 | 65.5 Ų | 65.5 | 10% | 0.099 | 38% | 0.376 | C | S | . | . | S | Bend | trans | -62.6 | -27.9 | -179.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | N31 Y33 L88 A95 | N31-A97 VanDerWaalsContact CB-O 3.23Å; N31-A97 WeakPolarHBondContact CB-O 3.34Å; Y33-A97 HydrophobicContact CD2-CB 3.69Å; Y33-A97 HydrophobicContact CE2-CB 3.83Å; L88-A97 HydrophobicContact CD2-CB 4.11Å; A95-A97 PolarHBondContact O-N 3.48Å |
| 98 | I | 64.1 | Low | 72.6 | Confident | 2 Ų | 2 | 62.9 Ų | 62.9 | 1% | 0.01 | 36% | 0.364 | C | S | . | . | S | Bend | trans | -136.1 | 134.2 | 177.5 | -124.2 | 178.4 | 0 | 0 | 0 | 109.6 | P34 A89 P96 A102 C103 | P34-I98 HydrophobicContact CB-CD1 3.79Å; P34-I98 HydrophobicContact CG-CD1 3.8Å; A89-I98 HydrophobicContact CB-CG2 3.74Å; P96-I98 PolarHBondContact O-N 2.66Å; I98-A102 HydrophobicContact CD1-CB 4.06Å; I98-A102 HydrophobicContact CG1-CB 3.9Å; I98-C103 HydrophobicContact CG2-CB 4.19Å |
| 99 | H | 74.2 | Confident | 73.4 | Confident | 84 Ų | 84 | 61.4 Ų | 61.4 | 39% | 0.389 | 36% | 0.356 | S | S | . | . | trans | -75.1 | 149.4 | 167 | -74.6 | 75.9 | 0 | 0 | 0 | 109.6 | Y30 G101 A102 C103 | Y30-H99 HydrophobicContact CD1-CB 4.42Å; Y30-H99 HydrophobicContact CE1-CB 3.6Å; H99-G101 PolarHBondContact O-N 2.98Å; H99-A102 PolarHBondContact O-N 3.49Å; H99-C103 PolarHBondContact O-N 2.85Å | ||
| 100 | W | 75.4 | Confident | 74.4 | Confident | 186 Ų | 186 | 60.9 Ų | 60.9 | 71% | 0.705 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -50.2 | -32.6 | 176.8 | -79.3 | 106.1 | 0 | 0 | 0 | 113.5 | A89 C103 G104 | A89-W100 HydrophobicContact CB-CE3 4.43Å; A89-W100 HydrophobicContact CB-CZ3 4.41Å; W100-C103 HydrophobicContact CE3-CB 4.47Å; W100-C103 WeakPolarHBondContact O-CB 3.42Å; W100-C103 PolarHBondContact O-N 3.48Å; W100-G104 PolarHBondContact O-N 2.88Å |
| 101 | G | 80.4 | Confident | 75.5 | Confident | 37 Ų | 37 | 55.4 Ų | 55.4 | 38% | 0.381 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -59.9 | -43.7 | 174.6 | 0 | 0 | 0 | 0 | 0 | 114 | H99 G104 F105 | H99-G101 PolarHBondContact O-N 2.98Å; G101-G104 PolarHBondContact O-N 3.48Å; G101-F105 VanDerWaalsContact O-CD2 3.22Å; G101-F105 WeakPolarHBondContact O-CD2 3.27Å; G101-F105 PolarHBondContact O-N 3.48Å; G101-F105 VanDerWaalsContact O-N 3.08Å |
| 102 | A | 81.4 | Confident | 76.9 | Confident | 0 Ų | 0 | 53.7 Ų | 53.7 | 0% | 0 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -75 | -30.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | G24 Y30 I98 H99 G104 F105 T106 | G24-A102 VanDerWaalsContact O-CB 3.29Å; G24-A102 WeakPolarHBondContact O-CB 3.38Å; Y30-A102 HydrophobicContact CD1-CB 3.13Å; Y30-A102 HydrophobicContact CE1-CB 3.08Å; Y30-A102 HydrophobicContact CG-CB 4.29Å; I98-A102 HydrophobicContact CD1-CB 4.06Å; I98-A102 HydrophobicContact CG1-CB 3.9Å; H99-A102 PolarHBondContact O-N 3.49Å; A102-G104 PolarHBondContact O-N 2.91Å; A102-F105 PolarHBondContact O-N 3.34Å; A102-T106 VanDerWaalsContact O-CB 3.27Å; A102-T106 WeakPolarHBondContact O-CB 3.36Å; A102-T106 WeakPolarHBondContact O-CG2 3.49Å; A102-T106 PolarHBondContact O-N 3.14Å; A102-T106 PolarHBondContact O-OG1 3.29Å |
| 103 | C | 83.8 | Confident | 78.6 | Confident | 9 Ų | 9 | 51.4 Ų | 51.4 | 6% | 0.061 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -55.5 | -42.3 | 168.8 | -170.2 | 0 | 0 | 0 | 0 | 110.2 | A89 I98 H99 W100 T106 L107 | A89-C103 HydrophobicContact CB-CB 4.06Å; I98-C103 HydrophobicContact CG2-CB 4.19Å; H99-C103 PolarHBondContact O-N 2.85Å; W100-C103 HydrophobicContact CE3-CB 4.47Å; W100-C103 WeakPolarHBondContact O-CB 3.42Å; W100-C103 PolarHBondContact O-N 3.48Å; C103-T106 WeakPolarHBondContact CA-OG1 2.88Å; C103-T106 PolarHBondContact O-OG1 3.08Å; C103-L107 VanDerWaalsContact O-CB 3.25Å; C103-L107 WeakPolarHBondContact O-CB 3.31Å; C103-L107 PolarHBondContact O-N 3.45Å |
| 104 | G | 86.9 | Confident | 80.2 | Confident | 43 Ų | 43 | 47.9 Ų | 47.9 | 44% | 0.443 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -62.6 | -50.5 | 175 | 0 | 0 | 0 | 0 | 0 | 113.7 | W100 G101 A102 T106 L107 A108 | W100-G104 PolarHBondContact O-N 2.88Å; G101-G104 PolarHBondContact O-N 3.48Å; A102-G104 PolarHBondContact O-N 2.91Å; G104-T106 VanDerWaalsContact C-N 3.33Å; G104-T106 PolarHBondContact O-N 3.15Å; G104-L107 PolarHBondContact O-N 3.34Å; G104-A108 PolarHBondContact O-N 3.12Å |
| 105 | F | 88.6 | Confident | 81.9 | Confident | 69 Ų | 69 | 45.3 Ų | 45.3 | 30% | 0.303 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -62.3 | -39.4 | 178.8 | -78.6 | -66.1 | 0 | 0 | 0 | 112.9 | F20 L23 G101 A102 A108 G109 | F20-F105 AromaticContact CD1-CD1 3.76Å; F20-F105 HydrophobicContact CD1-CD1 3.76Å; F20-F105 HydrophobicContact CD1-CE1 4.19Å; F20-F105 HydrophobicContact CE1-CD1 4.38Å; F20-F105 HydrophobicContact CE1-CE1 4.43Å; L23-F105 HydrophobicContact CD2-CD1 4.3Å; L23-F105 HydrophobicContact CD2-CE1 3.82Å; L23-F105 HydrophobicContact CD2-CE2 4.45Å; L23-F105 HydrophobicContact CD2-CZ 3.9Å; G101-F105 VanDerWaalsContact O-CD2 3.22Å; G101-F105 WeakPolarHBondContact O-CD2 3.27Å; G101-F105 PolarHBondContact O-N 3.48Å; G101-F105 VanDerWaalsContact O-N 3.08Å; A102-F105 PolarHBondContact O-N 3.34Å; F105-A108 PolarHBondContact O-N 3.08Å; F105-G109 PolarHBondContact O-N 3.21Å |
| 106 | T | 88.1 | Confident | 83.5 | Confident | 0 Ų | 0 | 43.2 Ų | 43.2 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -72.2 | -36.8 | -180 | 56.8 | 0 | 0 | 0 | 0 | 111.2 | L21 P34 A102 C103 G104 G109 N110 | L21-T106 HydrophobicContact CD1-CG2 4.19Å; P34-T106 HydrophobicContact CB-CG2 3.28Å; P34-T106 HydrophobicContact CG-CG2 3.99Å; A102-T106 VanDerWaalsContact O-CB 3.27Å; A102-T106 WeakPolarHBondContact O-CB 3.36Å; A102-T106 WeakPolarHBondContact O-CG2 3.49Å; A102-T106 PolarHBondContact O-N 3.14Å; A102-T106 PolarHBondContact O-OG1 3.29Å; C103-T106 WeakPolarHBondContact CA-OG1 2.88Å; C103-T106 PolarHBondContact O-OG1 3.08Å; G104-T106 VanDerWaalsContact C-N 3.33Å; G104-T106 PolarHBondContact O-N 3.15Å; T106-G109 PolarHBondContact O-N 2.94Å; T106-N110 WeakPolarHBondContact O-CB 3.38Å; T106-N110 PolarHBondContact O-N 3.36Å; T106-N110 PolarHBondContact O-ND2 3.32Å |
| 107 | L | 90.2 | Very high | 85.1 | Confident | 65 Ų | 65 | 41.3 Ų | 41.3 | 34% | 0.34 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -62.2 | -45.6 | 171.7 | -160.1 | 81.6 | 0 | 0 | 0 | 111.4 | F82 C103 G104 N110 I111 | F82-L107 HydrophobicContact CD1-CD1 3.49Å; F82-L107 VanDerWaalsContact CD1-CD1 3.49Å; F82-L107 HydrophobicContact CD1-CG 4.25Å; F82-L107 HydrophobicContact CE1-CD1 4.01Å; F82-L107 HydrophobicContact CE1-CG 4.27Å; C103-L107 VanDerWaalsContact O-CB 3.25Å; C103-L107 WeakPolarHBondContact O-CB 3.31Å; C103-L107 PolarHBondContact O-N 3.45Å; G104-L107 PolarHBondContact O-N 3.34Å; L107-N110 WeakPolarHBondContact O-CB 3.32Å; L107-N110 PolarHBondContact O-N 3.41Å; L107-I111 WeakPolarHBondContact O-CG1 3.41Å; L107-I111 PolarHBondContact O-N 2.96Å |
| 108 | A | 92.9 | Very high | 86.3 | Confident | 37 Ų | 37 | 43.4 Ų | 43.4 | 31% | 0.306 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -62.2 | -44.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | G104 F105 N110 I111 V112 | G104-A108 PolarHBondContact O-N 3.12Å; F105-A108 PolarHBondContact O-N 3.08Å; A108-N110 VanDerWaalsContact C-N 3.34Å; A108-N110 PolarHBondContact O-N 2.85Å; A108-I111 PolarHBondContact O-N 3.42Å; A108-V112 WeakPolarHBondContact O-CG2 3.38Å; A108-V112 PolarHBondContact O-N 3.36Å; A108-V112 VanDerWaalsContact O-N 3.1Å |
| 109 | G | 91.8 | Very high | 87.5 | Confident | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -61.1 | -39 | 175 | 0 | 0 | 0 | 0 | 0 | 113.2 | F105 T106 V112 S113 | F105-G109 PolarHBondContact O-N 3.21Å; T106-G109 PolarHBondContact O-N 2.94Å; G109-V112 PolarHBondContact O-N 3.12Å; G109-S113 WeakPolarHBondContact O-CB 3.38Å; G109-S113 PolarHBondContact O-N 2.78Å; G109-S113 PolarHBondContact O-OG 3.36Å |
| 110 | N | 91.7 | Very high | 88.1 | Confident | 0 Ų | 0 | 45.4 Ų | 45.4 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -60.2 | -47.5 | 173 | -88.7 | -76.1 | 0 | 0 | 0 | 111.9 | V37 Y41 F82 T106 L107 A108 V112 S113 F114 | V37-N110 WeakPolarHBondContact CG1-ND2 3.46Å; V37-N110 WeakPolarHBondContact CG1-OD1 3.35Å; Y41-N110 WeakPolarHBondContact CE1-OD1 3.32Å; Y41-N110 VanDerWaalsContact OH-CA 3.24Å; Y41-N110 WeakPolarHBondContact OH-CA 3.3Å; Y41-N110 VanDerWaalsContact OH-CG 3.31Å; Y41-N110 PolarHBondContact OH-N 3.32Å; Y41-N110 PolarHBondContact OH-OD1 3.36Å; F82-N110 HydrophobicContact CD1-CB 4.08Å; F82-N110 HydrophobicContact CE1-CB 3.48Å; F82-N110 VanDerWaalsContact CE1-CB 3.48Å; F82-N110 HydrophobicContact CE2-CB 4.41Å; F82-N110 HydrophobicContact CZ-CB 3.67Å; T106-N110 WeakPolarHBondContact O-CB 3.38Å; T106-N110 PolarHBondContact O-N 3.36Å; T106-N110 PolarHBondContact O-ND2 3.32Å; L107-N110 WeakPolarHBondContact O-CB 3.32Å; L107-N110 PolarHBondContact O-N 3.41Å; A108-N110 VanDerWaalsContact C-N 3.34Å; A108-N110 PolarHBondContact O-N 2.85Å; N110-V112 PolarHBondContact O-N 3.47Å; N110-S113 WeakPolarHBondContact CA-OG 3.5Å; N110-S113 PolarHBondContact O-N 3.38Å; N110-S113 PolarHBondContact O-OG 3.44Å; N110-F114 HydrophobicContact CB-CD2 4.28Å; N110-F114 HydrophobicContact CB-CE2 4.3Å; N110-F114 WeakPolarHBondContact O-CB 3.4Å; N110-F114 WeakPolarHBondContact O-CD2 3.42Å; N110-F114 PolarHBondContact O-N 2.95Å; N110-F114 WeakPolarHBondContact OD1-CE2 3.32Å |
| 111 | I | 92.6 | Very high | 88.5 | Confident | 84 Ų | 84 | 38.1 Ų | 38.1 | 43% | 0.431 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -58.9 | -49.7 | 178.8 | -65.5 | 166.4 | 0 | 0 | 0 | 110.3 | F82 L107 A108 S113 L115 | F82-I111 HydrophobicContact CE1-CG1 3.8Å; F82-I111 HydrophobicContact CZ-CG1 3.82Å; L107-I111 WeakPolarHBondContact O-CG1 3.41Å; L107-I111 PolarHBondContact O-N 2.96Å; A108-I111 PolarHBondContact O-N 3.42Å; I111-S113 PolarHBondContact O-N 3.47Å; I111-L115 HydrophobicContact CG2-CD1 3.99Å; I111-L115 HydrophobicContact CG2-CG 4.48Å; I111-L115 WeakPolarHBondContact O-CB 3.36Å; I111-L115 VanDerWaalsContact O-CG 3.27Å; I111-L115 WeakPolarHBondContact O-CG 3.18Å; I111-L115 PolarHBondContact O-N 3.41Å |
| 112 | V | 93.8 | Very high | 88.6 | Confident | 36 Ų | 36 | 43.4 Ų | 43.4 | 22% | 0.218 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -64 | -44.2 | -178 | 178.2 | 0 | 0 | 0 | 0 | 111.3 | A13 A108 G109 N110 L115 T116 | A13-V112 HydrophobicContact CB-CG1 4.44Å; A13-V112 WeakPolarHBondContact O-CG1 3.34Å; A108-V112 WeakPolarHBondContact O-CG2 3.38Å; A108-V112 PolarHBondContact O-N 3.36Å; A108-V112 VanDerWaalsContact O-N 3.1Å; G109-V112 PolarHBondContact O-N 3.12Å; N110-V112 PolarHBondContact O-N 3.47Å; V112-L115 PolarHBondContact O-N 2.97Å; V112-T116 WeakPolarHBondContact O-CB 3.38Å; V112-T116 PolarHBondContact O-N 2.92Å; V112-T116 PolarHBondContact O-OG1 3.31Å |
| 113 | S | 91.2 | Very high | 88.6 | Confident | 12 Ų | 12 | 45.1 Ų | 45.1 | 8% | 0.084 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -67.5 | -43.7 | -179.9 | 53.7 | 0 | 0 | 0 | 0 | 112.7 | Y41 G109 N110 I111 L115 T116 I117 | Y41-S113 WeakPolarHBondContact CE1-OG 3.22Å; Y41-S113 PolarHBondContact OH-OG 3.34Å; Y41-S113 VanDerWaalsContact OH-OG 3.04Å; G109-S113 WeakPolarHBondContact O-CB 3.38Å; G109-S113 PolarHBondContact O-N 2.78Å; G109-S113 PolarHBondContact O-OG 3.36Å; N110-S113 WeakPolarHBondContact CA-OG 3.5Å; N110-S113 PolarHBondContact O-N 3.38Å; N110-S113 PolarHBondContact O-OG 3.44Å; I111-S113 PolarHBondContact O-N 3.47Å; S113-L115 PolarHBondContact O-N 2.94Å; S113-T116 WeakPolarHBondContact O-CB 3.44Å; S113-T116 PolarHBondContact O-N 3.34Å; S113-T116 VanDerWaalsContact O-N 3.14Å; S113-I117 VanDerWaalsContact O-CG1 3.29Å; S113-I117 WeakPolarHBondContact O-CG1 3.35Å; S113-I117 PolarHBondContact O-N 3.01Å |
| 114 | F | 89.8 | Confident | 88.3 | Confident | 22 Ų | 22 | 48 Ų | 48 | 10% | 0.096 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -65.4 | -38.7 | 175.6 | -76.8 | -59 | 0 | 0 | 0 | 112.4 | Y41 A44 I78 A81 F82 N110 T116 I117 A118 | Y41-F114 HydrophobicContact CD1-CE1 4.3Å; Y41-F114 HydrophobicContact CD1-CZ 4.08Å; Y41-F114 HydrophobicContact CE1-CD2 4.49Å; Y41-F114 AromaticContact CE1-CE2 3.99Å; Y41-F114 HydrophobicContact CE1-CE2 3.99Å; Y41-F114 HydrophobicContact CE1-CZ 4.02Å; A44-F114 HydrophobicContact CB-CE1 4.29Å; I78-F114 HydrophobicContact CB-CE1 4.48Å; I78-F114 HydrophobicContact CB-CZ 4.46Å; I78-F114 HydrophobicContact CG1-CD1 3.85Å; I78-F114 HydrophobicContact CG1-CE1 3.73Å; I78-F114 HydrophobicContact CG1-CG 4.42Å; I78-F114 HydrophobicContact CG1-CZ 4.19Å; I78-F114 HydrophobicContact CG2-CD2 4.38Å; I78-F114 HydrophobicContact CG2-CE2 4.38Å; A81-F114 HydrophobicContact CB-CE2 3.62Å; A81-F114 HydrophobicContact CB-CZ 3.46Å; A81-F114 VanDerWaalsContact CB-CZ 3.46Å; F82-F114 HydrophobicContact CD2-CD2 4.42Å; F82-F114 HydrophobicContact CD2-CE2 4.24Å; F82-F114 AromaticContact CE2-CD2 3.55Å; F82-F114 HydrophobicContact CE2-CD2 3.55Å; F82-F114 AromaticContact CE2-CE2 3.81Å; F82-F114 HydrophobicContact CE2-CE2 3.81Å; F82-F114 AromaticContact CZ-CD2 3.96Å; F82-F114 HydrophobicContact CZ-CD2 3.96Å; F82-F114 HydrophobicContact CZ-CE2 4.42Å; N110-F114 HydrophobicContact CB-CD2 4.28Å; N110-F114 HydrophobicContact CB-CE2 4.3Å; N110-F114 WeakPolarHBondContact O-CB 3.4Å; N110-F114 WeakPolarHBondContact O-CD2 3.42Å; N110-F114 PolarHBondContact O-N 2.95Å; N110-F114 WeakPolarHBondContact OD1-CE2 3.32Å; F114-T116 VanDerWaalsContact C-N 3.29Å; F114-T116 PolarHBondContact O-N 2.84Å; F114-I117 HydrophobicContact CD1-CD1 4.37Å; F114-I117 PolarHBondContact O-N 3.18Å; F114-A118 WeakPolarHBondContact O-CB 3.4Å; F114-A118 PolarHBondContact O-N 2.96Å |
| 115 | L | 90.4 | Very high | 87.6 | Confident | 112 Ų | 112 | 51.3 Ų | 51.3 | 59% | 0.586 | 27% | 0.265 | S | S | * | . | H | α-helix | trans | -62.5 | -39 | 171.3 | -74.4 | 178.3 | 0 | 0 | 0 | 111.7 | I111 V112 S113 A118 A119 | I111-L115 HydrophobicContact CG2-CD1 3.99Å; I111-L115 HydrophobicContact CG2-CG 4.48Å; I111-L115 WeakPolarHBondContact O-CB 3.36Å; I111-L115 VanDerWaalsContact O-CG 3.27Å; I111-L115 WeakPolarHBondContact O-CG 3.18Å; I111-L115 PolarHBondContact O-N 3.41Å; V112-L115 PolarHBondContact O-N 2.97Å; S113-L115 PolarHBondContact O-N 2.94Å; L115-A118 PolarHBondContact O-N 3.42Å; L115-A119 WeakPolarHBondContact O-CB 3.17Å; L115-A119 PolarHBondContact O-N 3.02Å |
| 116 | T | 91.3 | Very high | 86.6 | Confident | 21 Ų | 21 | 51.9 Ų | 51.9 | 13% | 0.129 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -64.4 | -44.1 | 176.4 | -56.3 | 0 | 0 | 0 | 0 | 110.9 | L10 V112 S113 F114 A119 Y120 | L10-T116 HydrophobicContact CD1-CG2 3.82Å; L10-T116 VanDerWaalsContact CD1-O 3.32Å; L10-T116 WeakPolarHBondContact CD1-O 3.3Å; L10-T116 HydrophobicContact CG-CG2 3.67Å; L10-T116 VanDerWaalsContact O-CG2 3.32Å; L10-T116 WeakPolarHBondContact O-CG2 3.35Å; V112-T116 WeakPolarHBondContact O-CB 3.38Å; V112-T116 PolarHBondContact O-N 2.92Å; V112-T116 PolarHBondContact O-OG1 3.31Å; S113-T116 WeakPolarHBondContact O-CB 3.44Å; S113-T116 PolarHBondContact O-N 3.34Å; S113-T116 VanDerWaalsContact O-N 3.14Å; F114-T116 VanDerWaalsContact C-N 3.29Å; F114-T116 PolarHBondContact O-N 2.84Å; T116-A119 PolarHBondContact O-N 3.11Å; T116-Y120 PolarHBondContact O-N 3.09Å |
| 117 | I | 87.9 | Confident | 85.5 | Confident | 36 Ų | 36 | 54.4 Ų | 54.4 | 19% | 0.185 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -64.4 | -47.5 | 176.9 | -65 | 162.1 | 0 | 0 | 0 | 110.1 | A44 L48 S113 F114 A119 Y120 F121 | A44-I117 HydrophobicContact CB-CD1 4.19Å; L48-I117 HydrophobicContact CD1-CG2 4.14Å; S113-I117 VanDerWaalsContact O-CG1 3.29Å; S113-I117 WeakPolarHBondContact O-CG1 3.35Å; S113-I117 PolarHBondContact O-N 3.01Å; F114-I117 HydrophobicContact CD1-CD1 4.37Å; F114-I117 PolarHBondContact O-N 3.18Å; I117-A119 PolarHBondContact O-N 3.17Å; I117-Y120 WeakPolarHBondContact O-CB 3.2Å; I117-Y120 PolarHBondContact O-N 3.48Å; I117-F121 HydrophobicContact CG2-CD2 4.01Å; I117-F121 HydrophobicContact CG2-CE2 3.9Å; I117-F121 VanDerWaalsContact O-CD2 3.3Å; I117-F121 WeakPolarHBondContact O-CD2 3.44Å; I117-F121 PolarHBondContact O-N 3.21Å |
| 118 | A | 86.3 | Confident | 84 | Confident | 56 Ų | 56 | 57 Ų | 57 | 46% | 0.463 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -61.1 | -44.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112 | F114 L115 Y120 F121 Y122 | F114-A118 WeakPolarHBondContact O-CB 3.4Å; F114-A118 PolarHBondContact O-N 2.96Å; L115-A118 PolarHBondContact O-N 3.42Å; A118-Y120 VanDerWaalsContact C-N 3.32Å; A118-Y120 PolarHBondContact O-N 3.44Å; A118-F121 PolarHBondContact O-N 2.94Å; A118-Y122 WeakPolarHBondContact O-CB 3.08Å; A118-Y122 PolarHBondContact O-N 3.48Å |
| 119 | A | 88.8 | Confident | 82.3 | Confident | 38 Ų | 38 | 58.7 Ų | 58.7 | 31% | 0.314 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -63.7 | -36.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | L10 L115 T116 I117 Y122 I123 | L10-A119 HydrophobicContact CD1-CB 3.59Å; L115-A119 WeakPolarHBondContact O-CB 3.17Å; L115-A119 PolarHBondContact O-N 3.02Å; T116-A119 PolarHBondContact O-N 3.11Å; I117-A119 PolarHBondContact O-N 3.17Å; A119-Y122 PolarHBondContact O-N 3.48Å; A119-I123 WeakPolarHBondContact O-CB 3.32Å; A119-I123 WeakPolarHBondContact O-CD1 3.42Å; A119-I123 WeakPolarHBondContact O-CG1 3.5Å; A119-I123 PolarHBondContact O-N 3.39Å |
| 120 | Y | 87.4 | Confident | 80.6 | Confident | 91 Ų | 91 | 63.3 Ų | 63.3 | 36% | 0.357 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -57 | -52.7 | 174.1 | -179.2 | -110.4 | 0 | 0 | 0 | 111.9 | L7 L10 T116 I117 A118 I123 H124 | L7-Y120 HydrophobicContact CD2-CD2 4.41Å; L7-Y120 HydrophobicContact CD2-CE2 4.37Å; L10-Y120 HydrophobicContact CD2-CD2 3.63Å; L10-Y120 HydrophobicContact CD2-CG 4.11Å; T116-Y120 PolarHBondContact O-N 3.09Å; I117-Y120 WeakPolarHBondContact O-CB 3.2Å; I117-Y120 PolarHBondContact O-N 3.48Å; A118-Y120 VanDerWaalsContact C-N 3.32Å; A118-Y120 PolarHBondContact O-N 3.44Å; Y120-I123 PolarHBondContact O-N 2.8Å; Y120-H124 AromaticContact CE2-CE1 3.63Å; Y120-H124 AromaticContact CE2-ND1 3.64Å; Y120-H124 AromaticContact CZ-CE1 3.63Å; Y120-H124 AromaticContact CZ-ND1 3.71Å; Y120-H124 PolarHBondContact O-N 3.3Å; Y120-H124 PolarHBondContact OH-CE1 3.06Å; Y120-H124 PolarHBondContact OH-NE2 3.15Å |
| 121 | F | 83.2 | Confident | 78.8 | Confident | 32 Ų | 32 | 71.6 Ų | 71.6 | 14% | 0.14 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -66.7 | -39.8 | -178.5 | -79.4 | -75.7 | 0 | 0 | 0 | 111.8 | P45 L48 T49 I117 A118 I123 H124 Q125 | P45-F121 HydrophobicContact CB-CE2 4.19Å; P45-F121 HydrophobicContact CB-CZ 3.95Å; L48-F121 HydrophobicContact CB-CD1 3.91Å; L48-F121 HydrophobicContact CB-CD2 4Å; L48-F121 HydrophobicContact CB-CE1 3.54Å; L48-F121 HydrophobicContact CB-CE2 3.64Å; L48-F121 HydrophobicContact CB-CG 4.13Å; L48-F121 HydrophobicContact CB-CZ 3.39Å; L48-F121 HydrophobicContact CD1-CD2 3.44Å; L48-F121 VanDerWaalsContact CD1-CD2 3.44Å; L48-F121 HydrophobicContact CD1-CE2 3.34Å; L48-F121 HydrophobicContact CD1-CG 4.22Å; L48-F121 HydrophobicContact CD1-CZ 4.05Å; L48-F121 HydrophobicContact CD2-CB 4.16Å; L48-F121 HydrophobicContact CD2-CD1 4.28Å; L48-F121 HydrophobicContact CD2-CD2 3.94Å; L48-F121 HydrophobicContact CD2-CE2 4.41Å; L48-F121 HydrophobicContact CD2-CG 3.87Å; L48-F121 HydrophobicContact CG-CD2 3.97Å; L48-F121 HydrophobicContact CG-CE2 3.94Å; L48-F121 HydrophobicContact CG-CG 4.27Å; L48-F121 HydrophobicContact CG-CZ 4.22Å; T49-F121 HydrophobicContact CG2-CE1 4.42Å; I117-F121 HydrophobicContact CG2-CD2 4.01Å; I117-F121 HydrophobicContact CG2-CE2 3.9Å; I117-F121 VanDerWaalsContact O-CD2 3.3Å; I117-F121 WeakPolarHBondContact O-CD2 3.44Å; I117-F121 PolarHBondContact O-N 3.21Å; A118-F121 PolarHBondContact O-N 2.94Å; F121-I123 PolarHBondContact O-N 3.34Å; F121-H124 PolarHBondContact O-N 3.32Å; F121-Q125 WeakPolarHBondContact O-CB 3.49Å; F121-Q125 VanDerWaalsContact O-CG 3.28Å; F121-Q125 WeakPolarHBondContact O-CG 3.13Å; F121-Q125 PolarHBondContact O-N 3.02Å |
| 122 | Y | 82.2 | Confident | 76.9 | Confident | 148 Ų | 148 | 70.7 Ų | 70.7 | 58% | 0.58 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -58.9 | -46.8 | 174.9 | -175.1 | -88.6 | 0 | 0 | 0 | 111.5 | A118 A119 H124 Q125 D126 | A118-Y122 WeakPolarHBondContact O-CB 3.08Å; A118-Y122 PolarHBondContact O-N 3.48Å; A119-Y122 PolarHBondContact O-N 3.48Å; Y122-H124 PolarHBondContact O-N 3Å; Y122-Q125 PolarHBondContact O-N 3.15Å; Y122-D126 WeakPolarHBondContact CE1-OD2 3.28Å; Y122-D126 PolarHBondContact O-N 3.26Å; Y122-D126 VanDerWaalsContact O-N 3.15Å |
| 123 | I | 82.9 | Confident | 75 | Confident | 36 Ų | 36 | 74.5 Ų | 74.5 | 19% | 0.185 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -63 | -43.2 | 178 | -68.1 | 161.1 | 0 | 0 | 0 | 111.3 | T3 A6 A119 Y120 F121 D126 E127 | T3-I123 HydrophobicContact CG2-CG2 4.36Å; A6-I123 HydrophobicContact CB-CD1 3.78Å; A119-I123 WeakPolarHBondContact O-CB 3.32Å; A119-I123 WeakPolarHBondContact O-CD1 3.42Å; A119-I123 WeakPolarHBondContact O-CG1 3.5Å; A119-I123 PolarHBondContact O-N 3.39Å; Y120-I123 PolarHBondContact O-N 2.8Å; F121-I123 PolarHBondContact O-N 3.34Å; I123-D126 PolarHBondContact O-N 3.43Å; I123-E127 WeakPolarHBondContact O-CG 2.93Å; I123-E127 PolarHBondContact O-N 3.15Å |
| 124 | H | 77 | Confident | 72.8 | Confident | 69 Ų | 69 | 84.4 Ų | 84.4 | 32% | 0.319 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -64.9 | -38.9 | 177.9 | -101.2 | 62.6 | 0 | 0 | 0 | 112.7 | Y120 F121 Y122 D126 E127 D128 | Y120-H124 AromaticContact CE2-CE1 3.63Å; Y120-H124 AromaticContact CE2-ND1 3.64Å; Y120-H124 AromaticContact CZ-CE1 3.63Å; Y120-H124 AromaticContact CZ-ND1 3.71Å; Y120-H124 PolarHBondContact O-N 3.3Å; Y120-H124 PolarHBondContact OH-CE1 3.06Å; Y120-H124 PolarHBondContact OH-NE2 3.15Å; F121-H124 PolarHBondContact O-N 3.32Å; Y122-H124 PolarHBondContact O-N 3Å; H124-D126 VanDerWaalsContact C-N 3.34Å; H124-D126 PolarHBondContact O-N 3.11Å; H124-E127 PolarHBondContact O-N 3.43Å; H124-D128 PolarHBondContact O-N 3.47Å |
| 125 | Q | 72.6 | Confident | 72 | Confident | 114 Ų | 114 | 87.5 Ų | 87.5 | 53% | 0.533 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -63.5 | -39.3 | 177.3 | -74.5 | 178 | -38.5 | 0 | 0 | 112.4 | F121 Y122 E127 S129 | F121-Q125 WeakPolarHBondContact O-CB 3.49Å; F121-Q125 VanDerWaalsContact O-CG 3.28Å; F121-Q125 WeakPolarHBondContact O-CG 3.13Å; F121-Q125 PolarHBondContact O-N 3.02Å; Y122-Q125 PolarHBondContact O-N 3.15Å; Q125-E127 VanDerWaalsContact C-N 3.31Å; Q125-E127 PolarHBondContact O-N 3.34Å; Q125-S129 PolarHBondContact O-N 3.13Å; Q125-S129 VanDerWaalsContact O-N 3.13Å |
| 126 | D | 66 | Low | 71 | Confident | 80 Ų | 80 | 86.2 Ų | 86.2 | 43% | 0.428 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -63.8 | -36.2 | 175 | -79.1 | -22.5 | 0 | 0 | 0 | 111.6 | Y122 I123 H124 S129 N130 | Y122-D126 WeakPolarHBondContact CE1-OD2 3.28Å; Y122-D126 PolarHBondContact O-N 3.26Å; Y122-D126 VanDerWaalsContact O-N 3.15Å; I123-D126 PolarHBondContact O-N 3.43Å; H124-D126 VanDerWaalsContact C-N 3.34Å; H124-D126 PolarHBondContact O-N 3.11Å; D126-S129 PolarHBondContact O-N 3.08Å; D126-S129 PolarHBondContact O-OG 3.47Å; D126-N130 PolarHBondContact O-N 2.58Å; D126-N130 VanDerWaalsContact O-N 3.08Å |
| 127 | E | 65.2 | Low | 69.9 | Low | 54 Ų | 54 | 89.8 Ų | 89.8 | 25% | 0.252 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -65.8 | -48.4 | 177.3 | -67.5 | -163 | 136.2 | 0 | 0 | 112.3 | T3 I123 H124 Q125 S129 N130 Y131 | T3-E127 VanDerWaalsContact CB-OE1 3.23Å; T3-E127 WeakPolarHBondContact CB-OE1 3.23Å; T3-E127 WeakPolarHBondContact CG2-OE1 3.5Å; T3-E127 PolarHBondContact OG1-OE1 3.38Å; I123-E127 WeakPolarHBondContact O-CG 2.93Å; I123-E127 PolarHBondContact O-N 3.15Å; H124-E127 PolarHBondContact O-N 3.43Å; Q125-E127 VanDerWaalsContact C-N 3.31Å; Q125-E127 PolarHBondContact O-N 3.34Å; E127-S129 PolarHBondContact O-N 3.47Å; E127-N130 PolarHBondContact O-N 3.41Å; E127-N130 VanDerWaalsContact O-N 3.15Å; E127-Y131 WeakPolarHBondContact O-CD2 3.33Å; E127-Y131 PolarHBondContact O-N 3.2Å |
| 128 | D | 59.2 | Low | 68.8 | Low | 118 Ų | 118 | 93 Ų | 93 | 63% | 0.631 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -59.4 | -40.1 | 177.8 | -69.4 | -28.2 | 0 | 0 | 0 | 111 | H124 N130 Y131 G132 | H124-D128 PolarHBondContact O-N 3.47Å; D128-N130 PolarHBondContact O-N 3.39Å; D128-Y131 PolarHBondContact O-N 2.78Å; D128-G132 PolarHBondContact O-N 3.47Å; D128-G132 VanDerWaalsContact O-N 3.11Å |
| 129 | S | 57.5 | Low | 67.7 | Low | 73 Ų | 73 | 95.3 Ų | 95.3 | 51% | 0.51 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -65 | -37.6 | 177.9 | 79.9 | 0 | 0 | 0 | 0 | 112.8 | Q125 D126 E127 V133 | Q125-S129 PolarHBondContact O-N 3.13Å; Q125-S129 VanDerWaalsContact O-N 3.13Å; D126-S129 PolarHBondContact O-N 3.08Å; D126-S129 PolarHBondContact O-OG 3.47Å; E127-S129 PolarHBondContact O-N 3.47Å; S129-V133 WeakPolarHBondContact O-CG2 3.13Å |
| 130 | N | 55.5 | Low | 66.3 | Low | 98 Ų | 98 | 99.1 Ų | 99.1 | 52% | 0.524 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -77.3 | -28.3 | 179.8 | -175.7 | 77.2 | 0 | 0 | 0 | 112.7 | D126 E127 D128 F134 | D126-N130 PolarHBondContact O-N 2.58Å; D126-N130 VanDerWaalsContact O-N 3.08Å; E127-N130 PolarHBondContact O-N 3.41Å; E127-N130 VanDerWaalsContact O-N 3.15Å; D128-N130 PolarHBondContact O-N 3.39Å; N130-F134 WeakPolarHBondContact O-CE2 3.11Å |
| 131 | Y | 54.6 | Low | 64.8 | Low | 174 Ų | 174 | 99.7 Ų | 99.7 | 68% | 0.682 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -76.3 | -28.1 | 172.5 | -84 | -81.3 | 0 | 0 | 0 | 112.8 | E127 D128 V133 | E127-Y131 WeakPolarHBondContact O-CD2 3.33Å; E127-Y131 PolarHBondContact O-N 3.2Å; D128-Y131 PolarHBondContact O-N 2.78Å; Y131-V133 VanDerWaalsContact C-N 3.28Å; Y131-V133 PolarHBondContact O-N 3.32Å |
| 132 | G | 52.5 | Low | 63.4 | Low | 64 Ų | 64 | 104.9 Ų | 104.9 | 66% | 0.66 | 54% | 0.536 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.2 | -5.4 | -179.6 | 0 | 0 | 0 | 0 | 0 | 116.3 | D128 | D128-G132 PolarHBondContact O-N 3.47Å; D128-G132 VanDerWaalsContact O-N 3.11Å |
| 133 | V | 54 | Low | 61.9 | Low | 116 Ų | 116 | 101.3 Ų | 101.3 | 70% | 0.703 | 53% | 0.533 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94.4 | 4.1 | -177.9 | -127.3 | 0 | 0 | 0 | 0 | 114.2 | S129 Y131 | S129-V133 WeakPolarHBondContact O-CG2 3.13Å; Y131-V133 VanDerWaalsContact C-N 3.28Å; Y131-V133 PolarHBondContact O-N 3.32Å |
| 134 | F | 45.4 | Very low | 60 | Low | 220 Ų | 220 | 107.3 Ų | 107.3 | 97% | 0.965 | 56% | 0.564 | S | S | * | * | trans | -110 | 0 | 173.3 | -50 | -77.7 | 0 | 0 | 0 | 110.6 | N130 | N130-F134 WeakPolarHBondContact O-CE2 3.11Š|
Retrieved 134 of 134 residues in 216.2 ms
(Link to these results)