| 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 | 47.2 | Very low | 51.9 | Low | 220 Ų | 220 | 163.5 Ų | 163.5 | 100% | 1.084 | 78% | 0.776 | S | S | * | * | 0 | -23.6 | 0 | -77.6 | 173.2 | 76.4 | 0 | 0 | 115.4 | K3 L4 | M1-K3 VanDerWaalsContact C-N 3.27Å; M1-K3 PolarHBondContact O-N 3.45Å; M1-L4 PolarHBondContact O-N 3.22Å | |||
| 2 | K | 47.5 | Very low | 53.4 | Low | 189 Ų | 189 | 155.7 Ų | 155.7 | 82% | 0.822 | 74% | 0.739 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.4 | -19.2 | 178.9 | -113.5 | 176.5 | 177.7 | -178.4 | 0 | 116.1 | ||
| 3 | K | 47.8 | Very low | 55.5 | Low | 204 Ų | 204 | 148.3 Ų | 148.3 | 89% | 0.887 | 71% | 0.714 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.1 | -12 | -179.1 | -83.7 | -169.1 | 174 | -169.2 | 0 | 115.4 | M1 | M1-K3 VanDerWaalsContact C-N 3.27Å; M1-K3 PolarHBondContact O-N 3.45Å |
| 4 | L | 47.7 | Very low | 57.4 | Low | 151 Ų | 151 | 144.5 Ų | 144.5 | 79% | 0.791 | 71% | 0.707 | S | S | * | * | S | Bend | trans | -90.1 | -13 | 174.1 | -144.5 | 81.8 | 0 | 0 | 0 | 112.6 | M1 I6 | M1-L4 PolarHBondContact O-N 3.22Å; L4-I6 VanDerWaalsContact C-N 3.35Å |
| 5 | L | 49 | Very low | 59.4 | Low | 119 Ų | 119 | 141.9 Ų | 141.9 | 62% | 0.623 | 70% | 0.703 | S | S | * | * | S | Bend | trans | -83.6 | -8.6 | -173.5 | -95.1 | 157.3 | 0 | 0 | 0 | 114.4 | ||
| 6 | I | 50.6 | Low | 61.2 | Low | 122 Ų | 122 | 136.7 Ų | 136.7 | 63% | 0.626 | 68% | 0.681 | S | S | * | * | trans | -103.7 | 70.1 | 167.8 | -49.3 | 171.6 | 0 | 0 | 0 | 104.7 | L4 E8 | L4-I6 VanDerWaalsContact C-N 3.35Å; I6-E8 HydrophobicContact CG2-CB 4.03Å; I6-E8 HydrophobicContact CG2-CG 3.74Å; I6-E8 PolarHBondContact O-N 2.75Å | ||
| 7 | L | 51.2 | Low | 62.6 | Low | 139 Ų | 139 | 130.8 Ų | 130.8 | 73% | 0.728 | 66% | 0.656 | S | S | * | * | trans | -64.9 | 79.7 | 148.9 | -79.2 | 174.6 | 0 | 0 | 0 | 104.6 | R9 | L7-R9 PolarHBondContact O-N 2.75Å; L7-R9 VanDerWaalsContact O-N 3.14Å | ||
| 8 | E | 53.9 | Low | 64.1 | Low | 161 Ų | 161 | 132.1 Ų | 132.1 | 75% | 0.752 | 66% | 0.656 | S | S | * | * | trans | -46.2 | 119.4 | 174.1 | -129.1 | 165.7 | -151 | 0 | 0 | 105 | I6 K10 | I6-E8 HydrophobicContact CG2-CB 4.03Å; I6-E8 HydrophobicContact CG2-CG 3.74Å; I6-E8 PolarHBondContact O-N 2.75Å; E8-K10 VanDerWaalsContact C-N 3.31Å; E8-K10 PolarHBondContact O-N 3.14Å | ||
| 9 | R | 57.3 | Low | 65.6 | Low | 211 Ų | 211 | 130.5 Ų | 130.5 | 80% | 0.796 | 65% | 0.65 | S | S | * | * | trans | -38.3 | 103.2 | 165.6 | 176.5 | -168.3 | -169 | -150.2 | 7.1 | 106.4 | L7 P11 | L7-R9 PolarHBondContact O-N 2.75Å; L7-R9 VanDerWaalsContact O-N 3.14Å; R9-P11 WeakPolarHBondContact O-CD 3.02Å | ||
| 10 | K | 56.3 | Low | 67 | Low | 189 Ų | 189 | 126.3 Ų | 126.3 | 82% | 0.822 | 63% | 0.628 | S | S | * | * | trans | -67.8 | 107.9 | 166.7 | -169.2 | 175.2 | -175.8 | 173.9 | 0 | 102.6 | E8 E12 | E8-K10 VanDerWaalsContact C-N 3.31Å; E8-K10 PolarHBondContact O-N 3.14Å; K10-E12 PolarHBondContact O-N 3Å | ||
| 11 | P | 62.5 | Low | 68.3 | Low | 94 Ų | 94 | 124.3 Ų | 124.3 | 61% | 0.61 | 62% | 0.618 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 124.4 | -179.4 | 22.9 | -31.9 | 0 | 0 | 0 | 106.2 | R9 S13 | R9-P11 WeakPolarHBondContact O-CD 3.02Å; P11-S13 PolarHBondContact O-N 2.87Å |
| 12 | E | 70 | Confident | 70.5 | Confident | 69 Ų | 69 | 117.6 Ų | 117.6 | 32% | 0.322 | 59% | 0.593 | S | S | . | * | P | Polyproline II helix | trans | -52.2 | 133 | 177.4 | -72.2 | 174.9 | -169.3 | 0 | 0 | 107.2 | K10 C17 S100 V102 | K10-E12 PolarHBondContact O-N 3Å; E12-C17 WeakPolarHBondContact CB-SG 3.33Å; E12-C17 PolarHBondContact OE2-SG 3.1Å; E12-C17 VanDerWaalsContact OE2-SG 3.33Å; E12-S100 PolarHBondContact OE1-OG 3.32Å; E12-V102 VanDerWaalsContact CD-CG2 3.41Å; E12-V102 HydrophobicContact CG-CG2 4.5Å; E12-V102 WeakPolarHBondContact OE1-CG2 3.26Å; E12-V102 WeakPolarHBondContact OE2-CG2 3.16Å |
| 13 | S | 80.1 | Confident | 72.8 | Confident | 60 Ų | 60 | 111.3 Ų | 111.3 | 42% | 0.42 | 57% | 0.568 | S | S | . | * | P | Polyproline II helix | trans | -53.3 | 137 | -180 | 164.9 | 0 | 0 | 0 | 0 | 108.6 | P11 T15 V16 C17 | P11-S13 PolarHBondContact O-N 2.87Å; S13-T15 PolarHBondContact O-N 2.59Å; S13-V16 WeakPolarHBondContact O-CA 3.36Å; S13-V16 WeakPolarHBondContact O-CB 3.34Å; S13-V16 PolarHBondContact O-N 3.46Å; S13-C17 PolarHBondContact O-N 2.68Å |
| 14 | P | 82.4 | Confident | 75 | Confident | 95 Ų | 95 | 103.6 Ų | 103.6 | 62% | 0.617 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -55.7 | -29.5 | -177.5 | 20.1 | -31.9 | 0 | 0 | 0 | 112.2 | K18 | P14-K18 WeakPolarHBondContact O-CG 3.37Å; P14-K18 PolarHBondContact O-N 3.01Å; P14-K18 VanDerWaalsContact O-N 3.1Å |
| 15 | T | 88.2 | Confident | 77.3 | Confident | 105 Ų | 105 | 100.6 Ų | 100.6 | 64% | 0.644 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -67.1 | -42.4 | 173.2 | -50 | 0 | 0 | 0 | 0 | 112.2 | S13 K18 L19 | S13-T15 PolarHBondContact O-N 2.59Å; T15-K18 PolarHBondContact O-N 3.33Å; T15-L19 PolarHBondContact O-N 3.22Å; T15-L19 VanDerWaalsContact O-N 3.1Å |
| 16 | V | 88.2 | Confident | 79.6 | Confident | 59 Ų | 59 | 99.6 Ų | 99.6 | 36% | 0.358 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.7 | -46.4 | 177 | 175.9 | 0 | 0 | 0 | 0 | 109.9 | S13 K18 L19 F20 V102 | S13-V16 WeakPolarHBondContact O-CA 3.36Å; S13-V16 WeakPolarHBondContact O-CB 3.34Å; S13-V16 PolarHBondContact O-N 3.46Å; V16-K18 VanDerWaalsContact C-N 3.34Å; V16-K18 PolarHBondContact O-N 3.27Å; V16-L19 PolarHBondContact O-N 3.35Å; V16-F20 HydrophobicContact CG1-CD2 3.6Å; V16-F20 HydrophobicContact CG1-CE2 3.81Å; V16-F20 WeakPolarHBondContact O-CD2 3.36Å; V16-F20 PolarHBondContact O-N 3.1Å; V16-V102 HydrophobicContact CG1-CG2 4.21Å |
| 17 | C | 84.6 | Confident | 81.7 | Confident | 37 Ų | 37 | 94.8 Ų | 94.8 | 25% | 0.25 | 50% | 0.495 | C | S | . | . | H | α-helix | trans | -57 | -47.1 | 176.3 | -69.2 | 0 | 0 | 0 | 0 | 111.8 | E12 S13 L19 F20 I21 | E12-C17 WeakPolarHBondContact CB-SG 3.33Å; E12-C17 PolarHBondContact OE2-SG 3.1Å; E12-C17 VanDerWaalsContact OE2-SG 3.33Å; S13-C17 PolarHBondContact O-N 2.68Å; C17-L19 VanDerWaalsContact C-N 3.35Å; C17-L19 PolarHBondContact O-N 3.25Å; C17-F20 PolarHBondContact O-N 3.38Å; C17-I21 WeakPolarHBondContact O-CB 3.39Å; C17-I21 WeakPolarHBondContact O-CD1 3.44Å; C17-I21 WeakPolarHBondContact O-CG1 3.34Å; C17-I21 PolarHBondContact O-N 3.46Å |
| 18 | K | 89.7 | Confident | 83.7 | Confident | 153 Ų | 153 | 89.5 Ų | 89.5 | 67% | 0.665 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -59.9 | -44.3 | 178.9 | -76.1 | 177.7 | -177.6 | -177.3 | 0 | 112.3 | P14 T15 V16 S22 | P14-K18 WeakPolarHBondContact O-CG 3.37Å; P14-K18 PolarHBondContact O-N 3.01Å; P14-K18 VanDerWaalsContact O-N 3.1Å; T15-K18 PolarHBondContact O-N 3.33Å; V16-K18 VanDerWaalsContact C-N 3.34Å; V16-K18 PolarHBondContact O-N 3.27Å; K18-S22 PolarHBondContact O-N 3.24Å; K18-S22 PolarHBondContact O-OG 3.38Å |
| 19 | L | 93 | Very high | 85.8 | Confident | 102 Ų | 102 | 85.6 Ų | 85.6 | 53% | 0.534 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -62.2 | -50.1 | 177.5 | 178 | 62 | 0 | 0 | 0 | 111.3 | T15 V16 C17 I21 S22 L23 | T15-L19 PolarHBondContact O-N 3.22Å; T15-L19 VanDerWaalsContact O-N 3.1Å; V16-L19 PolarHBondContact O-N 3.35Å; C17-L19 VanDerWaalsContact C-N 3.35Å; C17-L19 PolarHBondContact O-N 3.25Å; L19-I21 PolarHBondContact O-N 2.95Å; L19-S22 WeakPolarHBondContact O-CB 3.31Å; L19-S22 PolarHBondContact O-N 3.06Å; L19-L23 HydrophobicContact CD1-CD1 4.31Å; L19-L23 HydrophobicContact CD1-CG 4.4Å; L19-L23 HydrophobicContact CG-CD1 4.07Å; L19-L23 WeakPolarHBondContact O-CG 3.1Å; L19-L23 PolarHBondContact O-N 2.96Å |
| 20 | F | 93.1 | Very high | 87.5 | Confident | 46 Ų | 46 | 82.4 Ų | 82.4 | 20% | 0.202 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -72.7 | -25 | -177 | -84.1 | -89.1 | 0 | 0 | 0 | 113.7 | V16 C17 L23 Q24 P101 V102 F105 | V16-F20 HydrophobicContact CG1-CD2 3.6Å; V16-F20 HydrophobicContact CG1-CE2 3.81Å; V16-F20 WeakPolarHBondContact O-CD2 3.36Å; V16-F20 PolarHBondContact O-N 3.1Å; C17-F20 PolarHBondContact O-N 3.38Å; F20-L23 HydrophobicContact CD1-CD1 4.37Å; F20-Q24 WeakPolarHBondContact O-CA 3.5Å; F20-Q24 WeakPolarHBondContact O-CB 3.38Å; F20-Q24 PolarHBondContact O-N 2.91Å; F20-P101 HydrophobicContact CB-CB 4.38Å; F20-V102 HydrophobicContact CB-CB 4.47Å; F20-V102 HydrophobicContact CB-CG2 3.67Å; F20-V102 HydrophobicContact CD1-CB 4.15Å; F20-V102 HydrophobicContact CD1-CG1 4.18Å; F20-V102 HydrophobicContact CD1-CG2 3.99Å; F20-V102 HydrophobicContact CD2-CG2 3.71Å; F20-V102 HydrophobicContact CE1-CG1 4.03Å; F20-V102 HydrophobicContact CE2-CG2 4.27Å; F20-V102 HydrophobicContact CG-CB 4.19Å; F20-V102 HydrophobicContact CG-CG1 4.47Å; F20-V102 HydrophobicContact CG-CG2 3.52Å; F20-V102 HydrophobicContact CZ-CG1 4.21Å; F20-F105 HydrophobicContact CD1-CB 4.02Å; F20-F105 HydrophobicContact CD1-CD1 4.1Å; F20-F105 HydrophobicContact CD1-CG 4.19Å; F20-F105 HydrophobicContact CE1-CB 4.44Å; F20-F105 AromaticContact CE1-CD1 3.76Å; F20-F105 HydrophobicContact CE1-CD1 3.76Å; F20-F105 HydrophobicContact CE1-CE1 4.42Å; F20-F105 HydrophobicContact CE1-CG 4.32Å |
| 21 | I | 94.3 | Very high | 89.2 | Confident | 85 Ų | 85 | 74.2 Ų | 74.2 | 44% | 0.436 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -61.6 | -48.6 | 168.5 | -73.3 | 163.5 | 0 | 0 | 0 | 109.6 | C17 L19 L23 Q24 V25 P101 | C17-I21 WeakPolarHBondContact O-CB 3.39Å; C17-I21 WeakPolarHBondContact O-CD1 3.44Å; C17-I21 WeakPolarHBondContact O-CG1 3.34Å; C17-I21 PolarHBondContact O-N 3.46Å; L19-I21 PolarHBondContact O-N 2.95Å; I21-L23 PolarHBondContact O-N 3.02Å; I21-Q24 PolarHBondContact O-N 3.33Å; I21-V25 WeakPolarHBondContact O-CG2 3.31Å; I21-V25 PolarHBondContact O-N 2.8Å; I21-P101 HydrophobicContact CG1-CB 3.89Å; I21-P101 HydrophobicContact CG1-CG 3.68Å |
| 22 | S | 93.7 | Very high | 90.6 | Very high | 80 Ų | 80 | 73.4 Ų | 73.4 | 56% | 0.559 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -61.9 | -44.7 | 177.7 | -59.7 | 0 | 0 | 0 | 0 | 112 | K18 L19 Q24 V25 L26 | K18-S22 PolarHBondContact O-N 3.24Å; K18-S22 PolarHBondContact O-OG 3.38Å; L19-S22 WeakPolarHBondContact O-CB 3.31Å; L19-S22 PolarHBondContact O-N 3.06Å; S22-Q24 VanDerWaalsContact C-N 3.34Å; S22-V25 PolarHBondContact O-N 3.39Å; S22-L26 WeakPolarHBondContact O-CB 3.34Å; S22-L26 PolarHBondContact O-N 2.76Å |
| 23 | L | 95.1 | Very high | 91.7 | Very high | 56 Ų | 56 | 78.5 Ų | 78.5 | 29% | 0.293 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -65.1 | -37.7 | 176.3 | -66.2 | 176.9 | 0 | 0 | 0 | 112.3 | L19 F20 I21 L26 S27 F105 | L19-L23 HydrophobicContact CD1-CD1 4.31Å; L19-L23 HydrophobicContact CD1-CG 4.4Å; L19-L23 HydrophobicContact CG-CD1 4.07Å; L19-L23 WeakPolarHBondContact O-CG 3.1Å; L19-L23 PolarHBondContact O-N 2.96Å; F20-L23 HydrophobicContact CD1-CD1 4.37Å; I21-L23 PolarHBondContact O-N 3.02Å; L23-L26 PolarHBondContact O-N 3.22Å; L23-S27 VanDerWaalsContact O-CB 3.31Å; L23-S27 WeakPolarHBondContact O-CB 3.4Å; L23-S27 PolarHBondContact O-N 3.11Å; L23-S27 PolarHBondContact O-OG 3.02Å; L23-F105 HydrophobicContact CB-CD2 3.77Å; L23-F105 HydrophobicContact CB-CE2 3.88Å; L23-F105 HydrophobicContact CB-CG 4.37Å |
| 24 | Q | 95 | Very high | 92.3 | Very high | 42 Ų | 42 | 78.9 Ų | 78.9 | 20% | 0.196 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -67.3 | -44.4 | 178.1 | 177.2 | 56.6 | 16.4 | 0 | 0 | 111.1 | F20 I21 S22 L26 S27 A28 P101 G104 | F20-Q24 WeakPolarHBondContact O-CA 3.5Å; F20-Q24 WeakPolarHBondContact O-CB 3.38Å; F20-Q24 PolarHBondContact O-N 2.91Å; I21-Q24 PolarHBondContact O-N 3.33Å; S22-Q24 VanDerWaalsContact C-N 3.34Å; Q24-L26 VanDerWaalsContact C-N 3.34Å; Q24-L26 PolarHBondContact O-N 2.84Å; Q24-S27 WeakPolarHBondContact CA-OG 3.4Å; Q24-S27 PolarHBondContact O-OG 2.83Å; Q24-S27 VanDerWaalsContact O-OG 3.05Å; Q24-A28 WeakPolarHBondContact O-CB 3.37Å; Q24-A28 PolarHBondContact O-N 3.07Å; Q24-P101 HydrophobicContact CB-CB 4.35Å; Q24-G104 PolarHBondContact OE1-O 2.83Å |
| 25 | V | 96.2 | Very high | 92.6 | Very high | 89 Ų | 89 | 76.4 Ų | 76.4 | 54% | 0.539 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -60.5 | -47.5 | 175.8 | 171.3 | 0 | 0 | 0 | 0 | 110 | I21 S22 A28 C29 | I21-V25 WeakPolarHBondContact O-CG2 3.31Å; I21-V25 PolarHBondContact O-N 2.8Å; S22-V25 PolarHBondContact O-N 3.39Å; V25-A28 PolarHBondContact O-N 2.91Å; V25-C29 PolarHBondContact O-N 3.18Å; V25-C29 PolarHBondContact O-SG 3.17Å |
| 26 | L | 96 | Very high | 92.7 | Very high | 98 Ų | 98 | 72.8 Ų | 72.8 | 51% | 0.513 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -61.2 | -50.8 | 179.7 | -175.8 | 64.6 | 0 | 0 | 0 | 112.2 | S22 L23 Q24 C29 F30 | S22-L26 WeakPolarHBondContact O-CB 3.34Å; S22-L26 PolarHBondContact O-N 2.76Å; L23-L26 PolarHBondContact O-N 3.22Å; Q24-L26 VanDerWaalsContact C-N 3.34Å; Q24-L26 PolarHBondContact O-N 2.84Å; L26-C29 WeakPolarHBondContact O-CB 3.19Å; L26-C29 PolarHBondContact O-N 3.27Å; L26-F30 HydrophobicContact CD1-CD2 4.14Å; L26-F30 HydrophobicContact CD1-CE2 3.62Å; L26-F30 HydrophobicContact CG-CD2 4.16Å; L26-F30 HydrophobicContact CG-CE2 3.95Å; L26-F30 VanDerWaalsContact O-CD2 3.27Å; L26-F30 WeakPolarHBondContact O-CD2 3.44Å; L26-F30 PolarHBondContact O-N 2.81Å |
| 27 | S | 94.2 | Very high | 92.8 | Very high | 21 Ų | 21 | 72.3 Ų | 72.3 | 15% | 0.147 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -63.3 | -41.1 | 178.7 | 56.9 | 0 | 0 | 0 | 0 | 112 | L23 Q24 C29 F30 A31 | L23-S27 VanDerWaalsContact O-CB 3.31Å; L23-S27 WeakPolarHBondContact O-CB 3.4Å; L23-S27 PolarHBondContact O-N 3.11Å; L23-S27 PolarHBondContact O-OG 3.02Å; Q24-S27 WeakPolarHBondContact CA-OG 3.4Å; Q24-S27 PolarHBondContact O-OG 2.83Å; Q24-S27 VanDerWaalsContact O-OG 3.05Å; S27-C29 VanDerWaalsContact C-N 3.33Å; S27-C29 PolarHBondContact O-N 3.05Å; S27-F30 PolarHBondContact O-N 3.44Å; S27-A31 WeakPolarHBondContact O-CB 3.38Å; S27-A31 PolarHBondContact O-N 3.05Å |
| 28 | A | 94.8 | Very high | 93.1 | Very high | 27 Ų | 27 | 73.5 Ų | 73.5 | 22% | 0.223 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -62.2 | -38.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q24 V25 S32 | Q24-A28 WeakPolarHBondContact O-CB 3.37Å; Q24-A28 PolarHBondContact O-N 3.07Å; V25-A28 PolarHBondContact O-N 2.91Å; A28-S32 WeakPolarHBondContact O-CB 3.47Å; A28-S32 PolarHBondContact O-N 3.39Å; A28-S32 PolarHBondContact O-OG 3.43Å |
| 29 | C | 96.4 | Very high | 93.1 | Very high | 79 Ų | 79 | 67.6 Ų | 67.6 | 53% | 0.534 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -61.7 | -50 | 174.7 | -72.4 | 0 | 0 | 0 | 0 | 111.8 | V25 L26 S27 S32 F33 | V25-C29 PolarHBondContact O-N 3.18Å; V25-C29 PolarHBondContact O-SG 3.17Å; L26-C29 WeakPolarHBondContact O-CB 3.19Å; L26-C29 PolarHBondContact O-N 3.27Å; S27-C29 VanDerWaalsContact C-N 3.33Å; S27-C29 PolarHBondContact O-N 3.05Å; C29-S32 PolarHBondContact O-N 2.77Å; C29-F33 WeakPolarHBondContact O-CB 3.16Å; C29-F33 PolarHBondContact O-N 3.21Å |
| 30 | F | 93.9 | Very high | 93.1 | Very high | 144 Ų | 144 | 63.9 Ų | 63.9 | 63% | 0.632 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -63.9 | -44.7 | 177.8 | -78.2 | -67.9 | 0 | 0 | 0 | 112.1 | L26 S27 S32 F33 A34 | L26-F30 HydrophobicContact CD1-CD2 4.14Å; L26-F30 HydrophobicContact CD1-CE2 3.62Å; L26-F30 HydrophobicContact CG-CD2 4.16Å; L26-F30 HydrophobicContact CG-CE2 3.95Å; L26-F30 VanDerWaalsContact O-CD2 3.27Å; L26-F30 WeakPolarHBondContact O-CD2 3.44Å; L26-F30 PolarHBondContact O-N 2.81Å; S27-F30 PolarHBondContact O-N 3.44Å; F30-S32 VanDerWaalsContact C-N 3.34Å; F30-S32 PolarHBondContact O-N 3.15Å; F30-F33 PolarHBondContact O-N 2.83Å; F30-A34 WeakPolarHBondContact O-CB 3.4Å; F30-A34 PolarHBondContact O-N 2.82Å |
| 31 | A | 92.4 | Very high | 93 | Very high | 18 Ų | 18 | 65 Ų | 65 | 15% | 0.149 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -62.4 | -42 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | S27 H35 E108 | S27-A31 WeakPolarHBondContact O-CB 3.38Å; S27-A31 PolarHBondContact O-N 3.05Å; A31-H35 WeakPolarHBondContact O-CB 3.42Å; A31-H35 PolarHBondContact O-N 3.22Å; A31-E108 HydrophobicContact CB-CG 4.48Å; A31-E108 WeakPolarHBondContact CB-OE2 3.15Å |
| 32 | S | 92.2 | Very high | 92.8 | Very high | 77 Ų | 77 | 65.6 Ų | 65.6 | 54% | 0.538 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -66.9 | -39 | 177.8 | -59.5 | 0 | 0 | 0 | 0 | 111.8 | A28 C29 F30 G36 | A28-S32 WeakPolarHBondContact O-CB 3.47Å; A28-S32 PolarHBondContact O-N 3.39Å; A28-S32 PolarHBondContact O-OG 3.43Å; C29-S32 PolarHBondContact O-N 2.77Å; F30-S32 VanDerWaalsContact C-N 3.34Å; F30-S32 PolarHBondContact O-N 3.15Å; S32-G36 PolarHBondContact O-N 3.5Å |
| 33 | F | 93.1 | Very high | 92.7 | Very high | 176 Ų | 176 | 64.5 Ų | 64.5 | 77% | 0.772 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -64.5 | -49.7 | 175.9 | -176.3 | -96.2 | 0 | 0 | 0 | 111.8 | C29 F30 G37 | C29-F33 WeakPolarHBondContact O-CB 3.16Å; C29-F33 PolarHBondContact O-N 3.21Å; F30-F33 PolarHBondContact O-N 2.83Å; F33-G37 PolarHBondContact O-N 3.23Å; F33-G37 VanDerWaalsContact O-N 3.07Å |
| 34 | A | 91.5 | Very high | 92.6 | Very high | 67 Ų | 67 | 62.4 Ų | 62.4 | 55% | 0.554 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -64.7 | -42.3 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | F30 N38 | F30-A34 WeakPolarHBondContact O-CB 3.4Å; F30-A34 PolarHBondContact O-N 2.82Å; A34-N38 PolarHBondContact O-N 3.09Å |
| 35 | H | 88.7 | Confident | 92.4 | Very high | 44 Ų | 44 | 63 Ų | 63 | 20% | 0.204 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -68.2 | -45.4 | 179.3 | -165.6 | 62.6 | 0 | 0 | 0 | 111.3 | A31 G37 N38 D39 T127 | A31-H35 WeakPolarHBondContact O-CB 3.42Å; A31-H35 PolarHBondContact O-N 3.22Å; H35-G37 PolarHBondContact O-N 3.12Å; H35-N38 WeakPolarHBondContact O-CB 3.33Å; H35-N38 PolarHBondContact O-N 2.95Å; H35-N38 VanDerWaalsContact O-N 3.15Å; H35-D39 IonicContact CD2-OD2 3.06Å; H35-D39 IonicContact CE1-OD1 3.92Å; H35-D39 IonicContact NE2-OD2 2.83Å; H35-D39 WeakPolarHBondContact O-CB 3.48Å; H35-D39 PolarHBondContact O-N 3.48Å; H35-T127 PolarHBondContact CE1-OG1 3.45Å; H35-T127 PolarHBondContact ND1-OG1 3.39Å; H35-T127 VanDerWaalsContact ND1-OG1 3.13Å |
| 36 | G | 91.3 | Very high | 92.1 | Very high | 28 Ų | 28 | 62.9 Ų | 62.9 | 29% | 0.289 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -60.8 | -41.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113 | S32 N38 D39 V40 | S32-G36 PolarHBondContact O-N 3.5Å; G36-N38 VanDerWaalsContact C-N 3.34Å; G36-N38 PolarHBondContact O-N 2.99Å; G36-D39 PolarHBondContact O-N 3.05Å; G36-V40 WeakPolarHBondContact O-CG2 3.27Å; G36-V40 PolarHBondContact O-N 2.85Å |
| 37 | G | 89.9 | Confident | 91.9 | Very high | 49 Ų | 49 | 61.5 Ų | 61.5 | 51% | 0.505 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -62.5 | -39.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113 | F33 H35 S41 | F33-G37 PolarHBondContact O-N 3.23Å; F33-G37 VanDerWaalsContact O-N 3.07Å; H35-G37 PolarHBondContact O-N 3.12Å; G37-S41 WeakPolarHBondContact O-CB 3.49Å; G37-S41 PolarHBondContact O-N 3.42Å |
| 38 | N | 89.9 | Confident | 91.7 | Very high | 63 Ų | 63 | 61.2 Ų | 61.2 | 34% | 0.337 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -65 | -46.2 | 175.3 | -171.4 | -104.5 | 0 | 0 | 0 | 111.6 | A34 H35 G36 S41 N42 | A34-N38 PolarHBondContact O-N 3.09Å; H35-N38 WeakPolarHBondContact O-CB 3.33Å; H35-N38 PolarHBondContact O-N 2.95Å; H35-N38 VanDerWaalsContact O-N 3.15Å; G36-N38 VanDerWaalsContact C-N 3.34Å; G36-N38 PolarHBondContact O-N 2.99Å; N38-S41 WeakPolarHBondContact O-CB 3.21Å; N38-S41 PolarHBondContact O-N 2.99Å; N38-N42 PolarHBondContact O-N 2.95Å; N38-N42 PolarHBondContact O-ND2 3.38Å; N38-N42 PolarHBondContact OD1-ND2 3.47Å |
| 39 | D | 91.6 | Very high | 91.5 | Very high | 28 Ų | 28 | 61.7 Ų | 61.7 | 15% | 0.15 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -65.3 | -44.2 | -176.8 | -81.8 | 6.9 | 0 | 0 | 0 | 112.5 | H35 G36 S41 N42 A43 M77 | H35-D39 IonicContact CD2-OD2 3.06Å; H35-D39 IonicContact CE1-OD1 3.92Å; H35-D39 IonicContact NE2-OD2 2.83Å; H35-D39 WeakPolarHBondContact O-CB 3.48Å; H35-D39 PolarHBondContact O-N 3.48Å; G36-D39 PolarHBondContact O-N 3.05Å; D39-S41 VanDerWaalsContact C-N 3.32Å; D39-S41 PolarHBondContact O-N 3.2Å; D39-N42 PolarHBondContact O-N 3.21Å; D39-A43 WeakPolarHBondContact O-CB 3.4Å; D39-A43 PolarHBondContact O-N 2.76Å; D39-M77 HydrophobicContact CB-CE 3.67Å |
| 40 | V | 92.6 | Very high | 91.2 | Very high | 24 Ų | 24 | 63.4 Ų | 63.4 | 15% | 0.145 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -62 | -42.2 | 175.4 | 172.7 | 0 | 0 | 0 | 0 | 111 | G36 A43 I44 A74 M77 | G36-V40 WeakPolarHBondContact O-CG2 3.27Å; G36-V40 PolarHBondContact O-N 2.85Å; V40-A43 PolarHBondContact O-N 2.84Å; V40-I44 WeakPolarHBondContact O-CB 3.46Å; V40-I44 WeakPolarHBondContact O-CG2 3.32Å; V40-I44 PolarHBondContact O-N 2.91Å; V40-A74 HydrophobicContact CG1-CB 4.32Å; V40-A74 HydrophobicContact CG2-CB 4.2Å; V40-M77 HydrophobicContact CG2-CB 4.44Å; V40-M77 HydrophobicContact CG2-CG 4.19Å |
| 41 | S | 90.1 | Very high | 91 | Very high | 71 Ų | 71 | 60.1 Ų | 60.1 | 50% | 0.497 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -61.7 | -46.5 | 177.5 | -172.9 | 0 | 0 | 0 | 0 | 111.7 | G37 N38 D39 A43 I44 A45 | G37-S41 WeakPolarHBondContact O-CB 3.49Å; G37-S41 PolarHBondContact O-N 3.42Å; N38-S41 WeakPolarHBondContact O-CB 3.21Å; N38-S41 PolarHBondContact O-N 2.99Å; D39-S41 VanDerWaalsContact C-N 3.32Å; D39-S41 PolarHBondContact O-N 3.2Å; S41-A43 PolarHBondContact O-N 3.35Å; S41-I44 PolarHBondContact O-N 3.42Å; S41-A45 WeakPolarHBondContact O-CB 3.37Å; S41-A45 PolarHBondContact O-N 3.1Å; S41-A45 VanDerWaalsContact O-N 3.09Å |
| 42 | N | 89.7 | Confident | 90.7 | Very high | 97 Ų | 97 | 59.9 Ų | 59.9 | 52% | 0.519 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -64.8 | -39.8 | 178.5 | -66.9 | -24.3 | 0 | 0 | 0 | 112 | N38 D39 | N38-N42 PolarHBondContact O-N 2.95Å; N38-N42 PolarHBondContact O-ND2 3.38Å; N38-N42 PolarHBondContact OD1-ND2 3.47Å; D39-N42 PolarHBondContact O-N 3.21Å |
| 43 | A | 91.5 | Very high | 90.5 | Very high | 57 Ų | 57 | 59.2 Ų | 59.2 | 47% | 0.471 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -68.7 | -38.4 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | D39 V40 S41 M77 | D39-A43 WeakPolarHBondContact O-CB 3.4Å; D39-A43 PolarHBondContact O-N 2.76Å; V40-A43 PolarHBondContact O-N 2.84Å; S41-A43 PolarHBondContact O-N 3.35Å; A43-M77 HydrophobicContact CB-SD 4.3Å |
| 44 | I | 93.9 | Very high | 90.3 | Very high | 11 Ų | 11 | 59.8 Ų | 59.8 | 6% | 0.056 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -87 | -20.7 | -175.2 | -152.7 | 67.7 | 0 | 0 | 0 | 113.3 | V40 S41 L47 V48 L69 Y72 | V40-I44 WeakPolarHBondContact O-CB 3.46Å; V40-I44 WeakPolarHBondContact O-CG2 3.32Å; V40-I44 PolarHBondContact O-N 2.91Å; S41-I44 PolarHBondContact O-N 3.42Å; I44-L47 HydrophobicContact CD1-CB 4.24Å; I44-L47 HydrophobicContact CD1-CD2 3.71Å; I44-L47 HydrophobicContact CD1-CG 4.5Å; I44-L47 WeakPolarHBondContact O-CB 3.48Å; I44-L47 PolarHBondContact O-N 3.22Å; I44-V48 HydrophobicContact CG1-CG2 4.04Å; I44-V48 HydrophobicContact CG2-CG2 4.02Å; I44-V48 WeakPolarHBondContact O-CG2 3.05Å; I44-V48 PolarHBondContact O-N 3.24Å; I44-L69 VanDerWaalsContact CD1-O 3.23Å; I44-L69 WeakPolarHBondContact CD1-O 3.44Å; I44-L69 HydrophobicContact CG1-CB 4.18Å; I44-L69 WeakPolarHBondContact CG1-O 3.05Å; I44-Y72 HydrophobicContact CD1-CD1 3.99Å |
| 45 | A | 90.2 | Very high | 90 | Very high | 54 Ų | 54 | 64.1 Ų | 64.1 | 45% | 0.446 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -50.9 | -44.2 | -174.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | S41 L47 V48 G49 | S41-A45 WeakPolarHBondContact O-CB 3.37Å; S41-A45 PolarHBondContact O-N 3.1Å; S41-A45 VanDerWaalsContact O-N 3.09Å; A45-L47 PolarHBondContact O-N 3.32Å; A45-V48 PolarHBondContact O-N 3.48Å; A45-G49 PolarHBondContact O-N 2.88Å |
| 46 | P | 90.8 | Very high | 89.7 | Confident | 87 Ų | 87 | 65.4 Ų | 65.4 | 57% | 0.565 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -62.6 | -42.1 | 175.4 | -22.8 | 34.8 | 0 | 0 | 0 | 113 | V48 G49 I50 | P46-V48 VanDerWaalsContact C-N 3.34Å; P46-V48 PolarHBondContact O-N 2.89Å; P46-G49 PolarHBondContact O-N 3.46Å; P46-I50 WeakPolarHBondContact O-CG1 3.49Å; P46-I50 PolarHBondContact O-N 3.11Å |
| 47 | L | 91.4 | Very high | 89.2 | Confident | 69 Ų | 69 | 67.4 Ų | 67.4 | 36% | 0.361 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -65.7 | -39.3 | 178.7 | -176.9 | 61.9 | 0 | 0 | 0 | 111.5 | I44 A45 G49 I50 W51 L69 Y72 | I44-L47 HydrophobicContact CD1-CB 4.24Å; I44-L47 HydrophobicContact CD1-CD2 3.71Å; I44-L47 HydrophobicContact CD1-CG 4.5Å; I44-L47 WeakPolarHBondContact O-CB 3.48Å; I44-L47 PolarHBondContact O-N 3.22Å; A45-L47 PolarHBondContact O-N 3.32Å; L47-G49 VanDerWaalsContact C-N 3.34Å; L47-I50 PolarHBondContact O-N 3.44Å; L47-W51 WeakPolarHBondContact O-CB 3.26Å; L47-W51 PolarHBondContact O-N 2.86Å; L47-L69 HydrophobicContact CB-CD2 4.43Å; L47-L69 HydrophobicContact CD2-CD2 3.87Å; L47-L69 HydrophobicContact CG-CD2 3.71Å; L47-Y72 HydrophobicContact CD2-CD1 4.01Å; L47-Y72 HydrophobicContact CD2-CE1 4.05Å |
| 48 | V | 90.7 | Very high | 88.5 | Confident | 16 Ų | 16 | 67.4 Ų | 67.4 | 10% | 0.097 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -61.9 | -43.5 | 173.9 | 177.3 | 0 | 0 | 0 | 0 | 110.6 | I44 A45 P46 I50 W51 V52 T65 L69 | I44-V48 HydrophobicContact CG1-CG2 4.04Å; I44-V48 HydrophobicContact CG2-CG2 4.02Å; I44-V48 WeakPolarHBondContact O-CG2 3.05Å; I44-V48 PolarHBondContact O-N 3.24Å; A45-V48 PolarHBondContact O-N 3.48Å; P46-V48 VanDerWaalsContact C-N 3.34Å; P46-V48 PolarHBondContact O-N 2.89Å; V48-I50 VanDerWaalsContact C-N 3.35Å; V48-I50 PolarHBondContact O-N 2.84Å; V48-W51 PolarHBondContact O-N 3.37Å; V48-V52 HydrophobicContact CG1-CG2 4.19Å; V48-V52 WeakPolarHBondContact O-CG2 3.41Å; V48-V52 PolarHBondContact O-N 3.32Å; V48-T65 HydrophobicContact CB-CG2 4.45Å; V48-T65 HydrophobicContact CG1-CG2 4.09Å; V48-T65 HydrophobicContact CG2-CG2 3.44Å; V48-T65 VanDerWaalsContact CG2-CG2 3.44Å; V48-L69 HydrophobicContact CG2-CD2 4.06Å |
| 49 | G | 89.1 | Confident | 87.6 | Confident | 36 Ų | 36 | 70.4 Ų | 70.4 | 37% | 0.371 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -58.6 | -43.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113 | A45 P46 L47 T53 | A45-G49 PolarHBondContact O-N 2.88Å; P46-G49 PolarHBondContact O-N 3.46Å; L47-G49 VanDerWaalsContact C-N 3.34Å; G49-T53 WeakPolarHBondContact O-CB 3.38Å; G49-T53 PolarHBondContact O-N 3.48Å; G49-T53 VanDerWaalsContact O-N 3.09Å; G49-T53 PolarHBondContact O-OG1 3.29Å |
| 50 | I | 90.3 | Very high | 86.4 | Confident | 116 Ų | 116 | 72 Ų | 72 | 60% | 0.595 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -63.9 | -46 | 175.1 | -65.5 | 166.1 | 0 | 0 | 0 | 110.7 | P46 L47 V48 T53 Y54 | P46-I50 WeakPolarHBondContact O-CG1 3.49Å; P46-I50 PolarHBondContact O-N 3.11Å; L47-I50 PolarHBondContact O-N 3.44Å; V48-I50 VanDerWaalsContact C-N 3.35Å; V48-I50 PolarHBondContact O-N 2.84Å; I50-T53 PolarHBondContact O-N 3.25Å; I50-Y54 WeakPolarHBondContact O-CB 3.13Å; I50-Y54 PolarHBondContact O-N 3.46Å |
| 51 | W | 89.4 | Confident | 84.9 | Confident | 74 Ų | 74 | 74.7 Ų | 74.7 | 28% | 0.28 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -62.2 | -46.1 | -178.1 | 179 | -100 | 0 | 0 | 0 | 112.9 | L47 V48 Y54 R55 W68 L69 | L47-W51 WeakPolarHBondContact O-CB 3.26Å; L47-W51 PolarHBondContact O-N 2.86Å; V48-W51 PolarHBondContact O-N 3.37Å; W51-Y54 PolarHBondContact O-N 3.5Å; W51-R55 VanDerWaalsContact CE2-CD 3.46Å; W51-R55 HydrophobicContact CZ2-CG 4.22Å; W51-R55 VanDerWaalsContact NE1-CD 3.29Å; W51-R55 PolarHBondContact O-N 3.31Å; W51-W68 HydrophobicContact CD2-CZ2 4.1Å; W51-W68 AromaticContact CE2-CZ2 3.83Å; W51-W68 HydrophobicContact CE3-CH2 4.34Å; W51-W68 HydrophobicContact CE3-CZ2 4.2Å; W51-W68 HydrophobicContact CH2-CH2 4.42Å; W51-W68 AromaticContact CH2-CZ2 3.81Å; W51-W68 HydrophobicContact CH2-CZ2 3.81Å; W51-W68 AromaticContact CZ2-CZ2 3.69Å; W51-W68 HydrophobicContact CZ2-CZ2 3.69Å; W51-W68 HydrophobicContact CZ3-CH2 4.27Å; W51-W68 HydrophobicContact CZ3-CZ2 4.06Å; W51-L69 HydrophobicContact CB-CD2 4.29Å; W51-L69 HydrophobicContact CD2-CD1 4.37Å; W51-L69 HydrophobicContact CG-CD1 4.09Å; W51-L69 HydrophobicContact CG-CD2 4.5Å |
| 52 | V | 87.2 | Confident | 83.7 | Confident | 13 Ų | 13 | 80.2 Ų | 80.2 | 8% | 0.079 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -63.8 | -45 | 177.3 | 171.8 | 0 | 0 | 0 | 0 | 110.3 | V48 Y54 R55 D56 | V48-V52 HydrophobicContact CG1-CG2 4.19Å; V48-V52 WeakPolarHBondContact O-CG2 3.41Å; V48-V52 PolarHBondContact O-N 3.32Å; V52-Y54 VanDerWaalsContact C-N 3.3Å; V52-Y54 PolarHBondContact O-N 2.96Å; V52-R55 PolarHBondContact O-N 2.96Å; V52-D56 PolarHBondContact O-N 3.23Å |
| 53 | T | 88.1 | Confident | 82.8 | Confident | 63 Ų | 63 | 81.7 Ų | 81.7 | 39% | 0.387 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -61.1 | -40.7 | 177.4 | -55 | 0 | 0 | 0 | 0 | 111.7 | G49 I50 G57 | G49-T53 WeakPolarHBondContact O-CB 3.38Å; G49-T53 PolarHBondContact O-N 3.48Å; G49-T53 VanDerWaalsContact O-N 3.09Å; G49-T53 PolarHBondContact O-OG1 3.29Å; I50-T53 PolarHBondContact O-N 3.25Å; T53-G57 VanDerWaalsContact O-CA 3.31Å; T53-G57 WeakPolarHBondContact O-CA 3.48Å; T53-G57 PolarHBondContact O-N 3.28Å; T53-G57 VanDerWaalsContact O-N 3.12Å |
| 54 | Y | 88 | Confident | 82.2 | Confident | 189 Ų | 189 | 83.4 Ų | 83.4 | 74% | 0.741 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -67 | -39.2 | 177.7 | 175.4 | -101.2 | 0 | 0 | 0 | 112.8 | I50 W51 V52 | I50-Y54 WeakPolarHBondContact O-CB 3.13Å; I50-Y54 PolarHBondContact O-N 3.46Å; W51-Y54 PolarHBondContact O-N 3.5Å; V52-Y54 VanDerWaalsContact C-N 3.3Å; V52-Y54 PolarHBondContact O-N 2.96Å |
| 55 | R | 85.9 | Confident | 81.6 | Confident | 158 Ų | 158 | 85.7 Ų | 85.7 | 60% | 0.596 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -79.4 | -48.9 | -178.1 | -80.1 | -168.2 | 65.4 | 99.5 | 0.6 | 113.8 | W51 V52 | W51-R55 VanDerWaalsContact CE2-CD 3.46Å; W51-R55 HydrophobicContact CZ2-CG 4.22Å; W51-R55 VanDerWaalsContact NE1-CD 3.29Å; W51-R55 PolarHBondContact O-N 3.31Å; V52-R55 PolarHBondContact O-N 2.96Å |
| 56 | D | 83 | Confident | 81.5 | Confident | 70 Ų | 70 | 84.9 Ų | 84.9 | 37% | 0.374 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -100.6 | -7.3 | -167.2 | -57.7 | -27 | 0 | 0 | 0 | 112.1 | V52 S58 | V52-D56 PolarHBondContact O-N 3.23Å; D56-S58 PolarHBondContact O-N 2.93Å |
| 57 | G | 79.9 | Confident | 81.6 | Confident | 70 Ų | 70 | 86.8 Ų | 86.8 | 72% | 0.722 | 49% | 0.488 | S | S | * | . | S | Bend | trans | 62.3 | 10.4 | -173.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | T53 | T53-G57 VanDerWaalsContact O-CA 3.31Å; T53-G57 WeakPolarHBondContact O-CA 3.48Å; T53-G57 PolarHBondContact O-N 3.28Å; T53-G57 VanDerWaalsContact O-N 3.12Å |
| 58 | S | 75.3 | Confident | 81.6 | Confident | 50 Ų | 50 | 89.8 Ų | 89.8 | 35% | 0.35 | 49% | 0.494 | S | S | . | . | S | Bend | trans | -132.3 | 146.9 | -177.2 | 92.6 | 0 | 0 | 0 | 0 | 110.1 | D56 S60 | D56-S58 PolarHBondContact O-N 2.93Å; S58-S60 PolarHBondContact O-N 3.5Å; S58-S60 PolarHBondContact OG-N 2.84Å |
| 59 | V | 71.9 | Confident | 81.7 | Confident | 126 Ų | 126 | 89.1 Ų | 89.1 | 76% | 0.764 | 49% | 0.49 | S | S | * | . | trans | -81.8 | 2.7 | 176.5 | -162.9 | 0 | 0 | 0 | 0 | 111.1 | A61 | V59-A61 PolarHBondContact O-N 3.24Š| ||
| 60 | S | 64.6 | Low | 81.9 | Confident | 62 Ų | 62 | 91.8 Ų | 91.8 | 43% | 0.434 | 49% | 0.494 | S | S | . | . | trans | -79.3 | 98.2 | -175.2 | -149 | 0 | 0 | 0 | 0 | 109.6 | S58 K62 | S58-S60 PolarHBondContact O-N 3.5Å; S58-S60 PolarHBondContact OG-N 2.84Å; S60-K62 PolarHBondContact O-N 2.88Å | ||
| 61 | A | 61.9 | Low | 82.1 | Confident | 80 Ų | 80 | 91.2 Ų | 91.2 | 66% | 0.661 | 49% | 0.492 | S | S | * | . | trans | -68.7 | 52.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | V59 E63 | V59-A61 PolarHBondContact O-N 3.24Å; A61-E63 VanDerWaalsContact C-N 3.32Å | ||
| 62 | K | 64.1 | Low | 82.3 | Confident | 186 Ų | 186 | 94.9 Ų | 94.9 | 81% | 0.809 | 51% | 0.506 | S | S | * | . | trans | -76 | -25 | 174.8 | -74.6 | -172.1 | 179.9 | -178.7 | 0 | 111.9 | S60 | S60-K62 PolarHBondContact O-N 2.88Š| ||
| 63 | E | 70.9 | Confident | 82.7 | Confident | 129 Ų | 129 | 94.6 Ų | 94.6 | 60% | 0.603 | 51% | 0.506 | S | S | * | . | S | Bend | trans | -84.8 | 145.8 | 177.6 | -66.3 | -159.3 | 167 | 0 | 0 | 112.1 | A61 | A61-E63 VanDerWaalsContact C-N 3.32Š|
| 64 | A | 78.8 | Confident | 83.1 | Confident | 92 Ų | 92 | 93.2 Ų | 93.2 | 76% | 0.76 | 50% | 0.501 | S | S | * | . | P | Polyproline II helix | trans | -63.7 | 140.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 110.5 | P66 | A64-P66 WeakPolarHBondContact O-CD 3.5Š|
| 65 | T | 82.8 | Confident | 83.4 | Confident | 59 Ų | 59 | 89.9 Ų | 89.9 | 36% | 0.362 | 50% | 0.495 | S | S | . | . | P | Polyproline II helix | trans | -54.6 | 124.9 | 175 | -56.2 | 0 | 0 | 0 | 0 | 110.7 | V48 I67 M70 | V48-T65 HydrophobicContact CB-CG2 4.45Å; V48-T65 HydrophobicContact CG1-CG2 4.09Å; V48-T65 HydrophobicContact CG2-CG2 3.44Å; V48-T65 VanDerWaalsContact CG2-CG2 3.44Å; T65-I67 PolarHBondContact O-N 3.44Å; T65-M70 HydrophobicContact CG2-CG 3.83Å; T65-M70 HydrophobicContact CG2-SD 4.43Å |
| 66 | P | 88.3 | Confident | 83.9 | Confident | 38 Ų | 38 | 84.4 Ų | 84.4 | 25% | 0.247 | 49% | 0.488 | C | S | . | . | P | Polyproline II helix | trans | -61.6 | 135 | 179.3 | -20.1 | 28.7 | 0 | 0 | 0 | 111.9 | A64 W68 L69 M70 | A64-P66 WeakPolarHBondContact O-CD 3.5Å; P66-W68 PolarHBondContact O-N 3.35Å; P66-L69 HydrophobicContact CB-CD1 3.73Å; P66-L69 HydrophobicContact CG-CD1 3.65Å; P66-L69 WeakPolarHBondContact O-CB 3.07Å; P66-L69 PolarHBondContact O-N 3.39Å; P66-M70 PolarHBondContact O-N 3.43Å |
| 67 | I | 91.2 | Very high | 84.4 | Confident | 127 Ų | 127 | 83.5 Ų | 83.5 | 65% | 0.651 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -58.5 | -36.5 | -175 | -62.3 | 172.5 | 0 | 0 | 0 | 111.9 | T65 L69 M70 L71 | T65-I67 PolarHBondContact O-N 3.44Å; I67-L69 VanDerWaalsContact C-N 3.3Å; I67-L69 PolarHBondContact O-N 3.24Å; I67-M70 WeakPolarHBondContact O-CB 3.46Å; I67-M70 PolarHBondContact O-N 3.22Å; I67-M70 VanDerWaalsContact O-N 3.11Å; I67-L71 HydrophobicContact CG2-CD1 4.2Å; I67-L71 HydrophobicContact CG2-CG 4.25Å; I67-L71 WeakPolarHBondContact O-CG 3.39Å; I67-L71 PolarHBondContact O-N 3.44Å |
| 68 | W | 92.9 | Very high | 85.1 | Confident | 132 Ų | 132 | 84.1 Ų | 84.1 | 50% | 0.5 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -65 | -32.3 | -179.8 | 72.6 | -97.4 | 0 | 0 | 0 | 112.7 | W51 P66 L71 Y72 | W51-W68 HydrophobicContact CD2-CZ2 4.1Å; W51-W68 AromaticContact CE2-CZ2 3.83Å; W51-W68 HydrophobicContact CE3-CH2 4.34Å; W51-W68 HydrophobicContact CE3-CZ2 4.2Å; W51-W68 HydrophobicContact CH2-CH2 4.42Å; W51-W68 AromaticContact CH2-CZ2 3.81Å; W51-W68 HydrophobicContact CH2-CZ2 3.81Å; W51-W68 AromaticContact CZ2-CZ2 3.69Å; W51-W68 HydrophobicContact CZ2-CZ2 3.69Å; W51-W68 HydrophobicContact CZ3-CH2 4.27Å; W51-W68 HydrophobicContact CZ3-CZ2 4.06Å; P66-W68 PolarHBondContact O-N 3.35Å; W68-L71 PolarHBondContact O-N 2.94Å; W68-Y72 WeakPolarHBondContact O-CB 3.31Å; W68-Y72 PolarHBondContact O-N 2.78Å |
| 69 | L | 92.9 | Very high | 86.1 | Confident | 1 Ų | 1 | 86 Ų | 86 | 1% | 0.005 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -67.4 | -41.1 | 172.3 | -84.9 | 110.5 | 0 | 0 | 0 | 110.6 | I44 L47 V48 W51 P66 I67 L71 Y72 G73 | I44-L69 VanDerWaalsContact CD1-O 3.23Å; I44-L69 WeakPolarHBondContact CD1-O 3.44Å; I44-L69 HydrophobicContact CG1-CB 4.18Å; I44-L69 WeakPolarHBondContact CG1-O 3.05Å; L47-L69 HydrophobicContact CB-CD2 4.43Å; L47-L69 HydrophobicContact CD2-CD2 3.87Å; L47-L69 HydrophobicContact CG-CD2 3.71Å; V48-L69 HydrophobicContact CG2-CD2 4.06Å; W51-L69 HydrophobicContact CB-CD2 4.29Å; W51-L69 HydrophobicContact CD2-CD1 4.37Å; W51-L69 HydrophobicContact CG-CD1 4.09Å; W51-L69 HydrophobicContact CG-CD2 4.5Å; P66-L69 HydrophobicContact CB-CD1 3.73Å; P66-L69 HydrophobicContact CG-CD1 3.65Å; P66-L69 WeakPolarHBondContact O-CB 3.07Å; P66-L69 PolarHBondContact O-N 3.39Å; I67-L69 VanDerWaalsContact C-N 3.3Å; I67-L69 PolarHBondContact O-N 3.24Å; L69-L71 VanDerWaalsContact C-N 3.33Å; L69-L71 PolarHBondContact O-N 2.91Å; L69-Y72 WeakPolarHBondContact O-CB 3.4Å; L69-Y72 PolarHBondContact O-N 2.96Å; L69-G73 PolarHBondContact O-N 2.85Å |
| 70 | M | 91.8 | Very high | 87.2 | Confident | 92 Ų | 92 | 81.6 Ų | 81.6 | 45% | 0.453 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -62.6 | -41.7 | 175.7 | -60.7 | -177.9 | 68 | 0 | 0 | 111.5 | T65 P66 I67 Y72 G73 A74 | T65-M70 HydrophobicContact CG2-CG 3.83Å; T65-M70 HydrophobicContact CG2-SD 4.43Å; P66-M70 PolarHBondContact O-N 3.43Å; I67-M70 WeakPolarHBondContact O-CB 3.46Å; I67-M70 PolarHBondContact O-N 3.22Å; I67-M70 VanDerWaalsContact O-N 3.11Å; M70-Y72 VanDerWaalsContact C-N 3.35Å; M70-G73 PolarHBondContact O-N 3.24Å; M70-A74 WeakPolarHBondContact O-CB 3.37Å; M70-A74 PolarHBondContact O-N 3.05Å |
| 71 | L | 94.7 | Very high | 88.5 | Confident | 104 Ų | 104 | 84.1 Ų | 84.1 | 55% | 0.545 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -63.5 | -40.4 | 174.6 | -70.3 | 175.9 | 0 | 0 | 0 | 111.8 | I67 W68 L69 A74 L75 | I67-L71 HydrophobicContact CG2-CD1 4.2Å; I67-L71 HydrophobicContact CG2-CG 4.25Å; I67-L71 WeakPolarHBondContact O-CG 3.39Å; I67-L71 PolarHBondContact O-N 3.44Å; W68-L71 PolarHBondContact O-N 2.94Å; L69-L71 VanDerWaalsContact C-N 3.33Å; L69-L71 PolarHBondContact O-N 2.91Å; L71-A74 PolarHBondContact O-N 3.43Å; L71-L75 WeakPolarHBondContact O-CB 3.44Å; L71-L75 VanDerWaalsContact O-CG 3.3Å; L71-L75 WeakPolarHBondContact O-CG 3.49Å; L71-L75 PolarHBondContact O-N 3.02Å |
| 72 | Y | 95.1 | Very high | 90 | Very high | 151 Ų | 151 | 91.3 Ų | 91.3 | 59% | 0.592 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -59.5 | -48.4 | 174.1 | 176.6 | -93.9 | 0 | 0 | 0 | 111.5 | I44 L47 W68 L69 M70 L75 G76 | I44-Y72 HydrophobicContact CD1-CD1 3.99Å; L47-Y72 HydrophobicContact CD2-CD1 4.01Å; L47-Y72 HydrophobicContact CD2-CE1 4.05Å; W68-Y72 WeakPolarHBondContact O-CB 3.31Å; W68-Y72 PolarHBondContact O-N 2.78Å; L69-Y72 WeakPolarHBondContact O-CB 3.4Å; L69-Y72 PolarHBondContact O-N 2.96Å; M70-Y72 VanDerWaalsContact C-N 3.35Å; Y72-L75 PolarHBondContact O-N 3.47Å; Y72-G76 PolarHBondContact O-N 2.8Å |
| 73 | G | 95.1 | Very high | 91.6 | Very high | 7 Ų | 7 | 86.1 Ų | 86.1 | 7% | 0.072 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -60.7 | -45.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | L69 M70 L75 G76 M77 | L69-G73 PolarHBondContact O-N 2.85Å; M70-G73 PolarHBondContact O-N 3.24Å; G73-L75 PolarHBondContact O-N 3.2Å; G73-G76 PolarHBondContact O-N 3.35Å; G73-M77 WeakPolarHBondContact O-CB 3.23Å; G73-M77 VanDerWaalsContact O-CG 3.29Å; G73-M77 WeakPolarHBondContact O-CG 3.22Å; G73-M77 PolarHBondContact O-N 3.47Å |
| 74 | A | 95.1 | Very high | 92.7 | Very high | 34 Ų | 34 | 85.1 Ų | 85.1 | 28% | 0.281 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -60.9 | -45.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | V40 M70 L71 M77 C78 | V40-A74 HydrophobicContact CG1-CB 4.32Å; V40-A74 HydrophobicContact CG2-CB 4.2Å; M70-A74 WeakPolarHBondContact O-CB 3.37Å; M70-A74 PolarHBondContact O-N 3.05Å; L71-A74 PolarHBondContact O-N 3.43Å; A74-M77 PolarHBondContact O-N 2.83Å; A74-C78 PolarHBondContact O-N 2.91Å; A74-C78 PolarHBondContact O-SG 3.39Å |
| 75 | L | 96 | Very high | 93.3 | Very high | 119 Ų | 119 | 81 Ų | 81 | 62% | 0.623 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -64 | -44.4 | 176.5 | -73.2 | 173 | 0 | 0 | 0 | 111.7 | L71 Y72 G73 M77 C78 V79 | L71-L75 WeakPolarHBondContact O-CB 3.44Å; L71-L75 VanDerWaalsContact O-CG 3.3Å; L71-L75 WeakPolarHBondContact O-CG 3.49Å; L71-L75 PolarHBondContact O-N 3.02Å; Y72-L75 PolarHBondContact O-N 3.47Å; G73-L75 PolarHBondContact O-N 3.2Å; L75-M77 VanDerWaalsContact C-N 3.31Å; L75-M77 PolarHBondContact O-N 3.41Å; L75-C78 PolarHBondContact O-N 2.82Å; L75-V79 WeakPolarHBondContact O-CG2 3.43Å; L75-V79 PolarHBondContact O-N 3.49Å |
| 76 | G | 95.8 | Very high | 93.9 | Very high | 43 Ų | 43 | 83.4 Ų | 83.4 | 44% | 0.443 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -58 | -43.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y72 G73 V79 G80 | Y72-G76 PolarHBondContact O-N 2.8Å; G73-G76 PolarHBondContact O-N 3.35Å; G76-V79 PolarHBondContact O-N 2.96Å; G76-G80 PolarHBondContact O-N 3.05Å |
| 77 | M | 93.3 | Very high | 94.1 | Very high | 52 Ų | 52 | 85.7 Ų | 85.7 | 26% | 0.256 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -64.7 | -44.2 | 175.4 | -70.8 | -63.2 | -87 | 0 | 0 | 112.1 | D39 V40 A43 G73 A74 L75 V79 G80 F81 | D39-M77 HydrophobicContact CB-CE 3.67Å; V40-M77 HydrophobicContact CG2-CB 4.44Å; V40-M77 HydrophobicContact CG2-CG 4.19Å; A43-M77 HydrophobicContact CB-SD 4.3Å; G73-M77 WeakPolarHBondContact O-CB 3.23Å; G73-M77 VanDerWaalsContact O-CG 3.29Å; G73-M77 WeakPolarHBondContact O-CG 3.22Å; G73-M77 PolarHBondContact O-N 3.47Å; A74-M77 PolarHBondContact O-N 2.83Å; L75-M77 VanDerWaalsContact C-N 3.31Å; L75-M77 PolarHBondContact O-N 3.41Å; M77-V79 VanDerWaalsContact C-N 3.32Å; M77-V79 PolarHBondContact O-N 3.21Å; M77-G80 PolarHBondContact O-N 2.75Å; M77-F81 HydrophobicContact CB-CD2 4.5Å; M77-F81 HydrophobicContact CB-CE2 4.45Å; M77-F81 HydrophobicContact CE-CE2 4.1Å; M77-F81 HydrophobicContact CE-CZ 4.38Å; M77-F81 WeakPolarHBondContact O-CD2 3.34Å; M77-F81 PolarHBondContact O-N 3.26Å |
| 78 | C | 94.9 | Very high | 94.1 | Very high | 82 Ų | 82 | 84 Ų | 84 | 55% | 0.554 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -57.6 | -44.2 | 175.3 | -72.6 | 0 | 0 | 0 | 0 | 112.2 | A74 L75 F81 W82 | A74-C78 PolarHBondContact O-N 2.91Å; A74-C78 PolarHBondContact O-SG 3.39Å; L75-C78 PolarHBondContact O-N 2.82Å; C78-F81 PolarHBondContact O-N 2.8Å; C78-W82 PolarHBondContact O-N 3.47Å |
| 79 | V | 96.5 | Very high | 94 | Very high | 91 Ų | 91 | 83.7 Ų | 83.7 | 55% | 0.552 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -65.6 | -43.1 | 176.8 | 173.7 | 0 | 0 | 0 | 0 | 110.9 | L75 G76 M77 F81 W82 T83 | L75-V79 WeakPolarHBondContact O-CG2 3.43Å; L75-V79 PolarHBondContact O-N 3.49Å; G76-V79 PolarHBondContact O-N 2.96Å; M77-V79 VanDerWaalsContact C-N 3.32Å; M77-V79 PolarHBondContact O-N 3.21Å; V79-F81 PolarHBondContact O-N 2.87Å; V79-W82 PolarHBondContact O-N 2.97Å; V79-T83 HydrophobicContact CG1-CG2 4.44Å; V79-T83 WeakPolarHBondContact O-CB 3.42Å; V79-T83 WeakPolarHBondContact O-CG2 3.5Å; V79-T83 PolarHBondContact O-N 3.23Å; V79-T83 PolarHBondContact O-OG1 2.96Å |
| 80 | G | 94.3 | Very high | 94 | Very high | 33 Ų | 33 | 88.9 Ų | 88.9 | 34% | 0.34 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -59.4 | -43.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | G76 M77 T83 L84 G85 | G76-G80 PolarHBondContact O-N 3.05Å; M77-G80 PolarHBondContact O-N 2.75Å; G80-T83 PolarHBondContact O-N 3.05Å; G80-T83 PolarHBondContact O-OG1 3.48Å; G80-L84 PolarHBondContact O-N 2.98Å; G80-G85 PolarHBondContact O-N 3.35Å |
| 81 | F | 91.8 | Very high | 93.9 | Very high | 114 Ų | 114 | 87.2 Ų | 87.2 | 50% | 0.5 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -67.1 | -40.3 | 176.8 | -79.9 | -58.7 | 0 | 0 | 0 | 112.9 | M77 C78 V79 T83 G85 | M77-F81 HydrophobicContact CB-CD2 4.5Å; M77-F81 HydrophobicContact CB-CE2 4.45Å; M77-F81 HydrophobicContact CE-CE2 4.1Å; M77-F81 HydrophobicContact CE-CZ 4.38Å; M77-F81 WeakPolarHBondContact O-CD2 3.34Å; M77-F81 PolarHBondContact O-N 3.26Å; C78-F81 PolarHBondContact O-N 2.8Å; V79-F81 PolarHBondContact O-N 2.87Å; F81-T83 VanDerWaalsContact C-N 3.34Å; F81-G85 WeakPolarHBondContact O-CA 3.29Å; F81-G85 PolarHBondContact O-N 2.85Å |
| 82 | W | 94.5 | Very high | 93.7 | Very high | 231 Ų | 231 | 84 Ų | 84 | 88% | 0.875 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -61.1 | -47 | 175.4 | -166.6 | -34.5 | 0 | 0 | 0 | 110.5 | C78 V79 | C78-W82 PolarHBondContact O-N 3.47Å; V79-W82 PolarHBondContact O-N 2.97Å |
| 83 | T | 96.3 | Very high | 93.2 | Very high | 77 Ų | 77 | 78 Ų | 78 | 47% | 0.472 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -78.7 | -42.6 | -172.4 | 52.3 | 0 | 0 | 0 | 0 | 113.8 | V79 G80 F81 | V79-T83 HydrophobicContact CG1-CG2 4.44Å; V79-T83 WeakPolarHBondContact O-CB 3.42Å; V79-T83 WeakPolarHBondContact O-CG2 3.5Å; V79-T83 PolarHBondContact O-N 3.23Å; V79-T83 PolarHBondContact O-OG1 2.96Å; G80-T83 PolarHBondContact O-N 3.05Å; G80-T83 PolarHBondContact O-OG1 3.48Å; F81-T83 VanDerWaalsContact C-N 3.34Å |
| 84 | L | 94.9 | Very high | 92.8 | Very high | 109 Ų | 109 | 84.2 Ų | 84.2 | 57% | 0.571 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -123.7 | -11.9 | -170 | -61.9 | 173.1 | 0 | 0 | 0 | 113.5 | G80 H86 L87 | G80-L84 PolarHBondContact O-N 2.98Å; L84-H86 VanDerWaalsContact C-N 3.26Å; L84-H86 PolarHBondContact O-N 3.29Å; L84-L87 HydrophobicContact CD2-CD1 4.18Å; L84-L87 WeakPolarHBondContact O-CB 3.48Å; L84-L87 PolarHBondContact O-N 3.42Å; L84-L87 VanDerWaalsContact O-N 3.12Å |
| 85 | G | 92.2 | Very high | 92.4 | Very high | 5 Ų | 5 | 83.5 Ų | 83.5 | 5% | 0.052 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -61.6 | -31.7 | -174.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | G80 F81 L87 V88 I89 | G80-G85 PolarHBondContact O-N 3.35Å; F81-G85 WeakPolarHBondContact O-CA 3.29Å; F81-G85 PolarHBondContact O-N 2.85Å; G85-L87 PolarHBondContact O-N 3.09Å; G85-V88 PolarHBondContact O-N 3.22Å; G85-V88 VanDerWaalsContact O-N 3.09Å; G85-I89 WeakPolarHBondContact O-CG1 3.35Å; G85-I89 PolarHBondContact O-N 3.35Å |
| 86 | H | 94.1 | Very high | 92.1 | Very high | 109 Ų | 109 | 77.9 Ų | 77.9 | 51% | 0.505 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -58.1 | -32.3 | 176.9 | 73.1 | 120.1 | 0 | 0 | 0 | 113.2 | L84 I89 Q90 | L84-H86 VanDerWaalsContact C-N 3.26Å; L84-H86 PolarHBondContact O-N 3.29Å; H86-I89 PolarHBondContact O-N 3.2Å; H86-Q90 WeakPolarHBondContact O-CB 3.37Å; H86-Q90 PolarHBondContact O-N 3.12Å |
| 87 | L | 93.2 | Very high | 91.8 | Very high | 87 Ų | 87 | 75.9 Ų | 75.9 | 46% | 0.455 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -66.3 | -39.7 | 177.5 | -56.6 | 177.1 | 0 | 0 | 0 | 111.6 | L84 G85 T91 | L84-L87 HydrophobicContact CD2-CD1 4.18Å; L84-L87 WeakPolarHBondContact O-CB 3.48Å; L84-L87 PolarHBondContact O-N 3.42Å; L84-L87 VanDerWaalsContact O-N 3.12Å; G85-L87 PolarHBondContact O-N 3.09Å; L87-T91 WeakPolarHBondContact O-CB 3.43Å; L87-T91 PolarHBondContact O-N 3.42Å; L87-T91 PolarHBondContact O-OG1 2.84Å |
| 88 | V | 90.7 | Very high | 91.5 | Very high | 92 Ų | 92 | 78.2 Ų | 78.2 | 56% | 0.558 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -72.4 | -44.7 | 178.5 | -177.3 | 0 | 0 | 0 | 0 | 110.3 | G85 Q90 T91 V92 | G85-V88 PolarHBondContact O-N 3.22Å; G85-V88 VanDerWaalsContact O-N 3.09Å; V88-Q90 VanDerWaalsContact C-N 3.3Å; V88-Q90 PolarHBondContact O-N 2.63Å; V88-T91 PolarHBondContact O-N 3.14Å; V88-V92 HydrophobicContact CG1-CG2 4.32Å; V88-V92 WeakPolarHBondContact O-CG2 3.38Å; V88-V92 PolarHBondContact O-N 3.37Å |
| 89 | I | 92 | Very high | 91.3 | Very high | 124 Ų | 124 | 77.1 Ų | 77.1 | 64% | 0.636 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -59.1 | -43.8 | 177.8 | -65.6 | 165.8 | 0 | 0 | 0 | 110.3 | G85 H86 G93 | G85-I89 WeakPolarHBondContact O-CG1 3.35Å; G85-I89 PolarHBondContact O-N 3.35Å; H86-I89 PolarHBondContact O-N 3.2Å; I89-G93 VanDerWaalsContact O-CA 3.31Å; I89-G93 WeakPolarHBondContact O-CA 3.46Å; I89-G93 PolarHBondContact O-N 3.13Å |
| 90 | Q | 91 | Very high | 91 | Very high | 110 Ų | 110 | 73.8 Ų | 73.8 | 51% | 0.514 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -64.8 | -44.6 | 176.4 | -169.8 | 176.1 | 23.9 | 0 | 0 | 111.5 | H86 V88 V92 E94 G95 | H86-Q90 WeakPolarHBondContact O-CB 3.37Å; H86-Q90 PolarHBondContact O-N 3.12Å; V88-Q90 VanDerWaalsContact C-N 3.3Å; V88-Q90 PolarHBondContact O-N 2.63Å; Q90-V92 PolarHBondContact O-N 3.38Å; Q90-E94 CarbonylContact O-C 3.58Å; Q90-E94 PolarHBondContact O-N 2.95Å; Q90-G95 PolarHBondContact O-N 3.39Å |
| 91 | T | 90.2 | Very high | 90.8 | Very high | 57 Ų | 57 | 74.3 Ų | 74.3 | 35% | 0.35 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -63.1 | -41.7 | -179.1 | -59.4 | 0 | 0 | 0 | 0 | 112.3 | L87 V88 G95 L96 T152 I156 | L87-T91 WeakPolarHBondContact O-CB 3.43Å; L87-T91 PolarHBondContact O-N 3.42Å; L87-T91 PolarHBondContact O-OG1 2.84Å; V88-T91 PolarHBondContact O-N 3.14Å; T91-G95 CarbonylContact O-C 3.5Å; T91-G95 WeakPolarHBondContact O-CA 3.44Å; T91-G95 PolarHBondContact O-N 2.6Å; T91-L96 PolarHBondContact O-N 2.91Å; T91-T152 HydrophobicContact CG2-CG2 3.73Å; T91-I156 HydrophobicContact CG2-CD1 4.26Å; T91-I156 HydrophobicContact CG2-CG1 4.42Å |
| 92 | V | 90.1 | Very high | 90.7 | Very high | 37 Ų | 37 | 70.4 Ų | 70.4 | 22% | 0.224 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -85.2 | -46.9 | -177.9 | 179.9 | 0 | 0 | 0 | 0 | 111.5 | V88 Q90 I132 V135 | V88-V92 HydrophobicContact CG1-CG2 4.32Å; V88-V92 WeakPolarHBondContact O-CG2 3.38Å; V88-V92 PolarHBondContact O-N 3.37Å; Q90-V92 PolarHBondContact O-N 3.38Å; V92-I132 HydrophobicContact CG1-CD1 4.05Å; V92-I132 HydrophobicContact CG2-CD1 3.73Å; V92-V135 HydrophobicContact CG1-CG2 4.25Å |
| 93 | G | 85.6 | Confident | 90.6 | Very high | 24 Ų | 24 | 59.8 Ų | 59.8 | 25% | 0.247 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -76.6 | -32.3 | -171.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | I89 | I89-G93 VanDerWaalsContact O-CA 3.31Å; I89-G93 WeakPolarHBondContact O-CA 3.46Å; I89-G93 PolarHBondContact O-N 3.13Å |
| 94 | E | 86 | Confident | 90.5 | Very high | 139 Ų | 139 | 56.2 Ų | 56.2 | 65% | 0.65 | 31% | 0.307 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -123.7 | -22.9 | -179.7 | -64.8 | -178.1 | 172.3 | 0 | 0 | 112.8 | Q90 R149 | Q90-E94 CarbonylContact O-C 3.58Å; Q90-E94 PolarHBondContact O-N 2.95Å; E94-R149 PolarHBondContact O-NH1 3.25Å; E94-R149 PolarHBondContact O-NH2 3.06Å |
| 95 | G | 86.7 | Confident | 90.5 | Very high | 19 Ų | 19 | 53.2 Ų | 53.2 | 20% | 0.196 | 29% | 0.289 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -98.2 | -15.5 | -170.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | Q90 T91 R149 T152 | Q90-G95 PolarHBondContact O-N 3.39Å; T91-G95 CarbonylContact O-C 3.5Å; T91-G95 WeakPolarHBondContact O-CA 3.44Å; T91-G95 PolarHBondContact O-N 2.6Å; G95-R149 VanDerWaalsContact C-CZ 3.46Å; G95-R149 VanDerWaalsContact C-NE 3.26Å; G95-R149 VanDerWaalsContact CA-NH2 3.34Å; G95-R149 PolarHBondContact O-NE 3.48Å; G95-R149 PolarHBondContact O-NH2 3.37Å; G95-T152 VanDerWaalsContact O-CB 3.31Å; G95-T152 WeakPolarHBondContact O-CB 3.27Å; G95-T152 WeakPolarHBondContact O-CG2 3.39Å; G95-T152 PolarHBondContact O-OG1 2.91Å |
| 96 | L | 89.7 | Confident | 90.6 | Very high | 0 Ų | 0 | 56.1 Ų | 56.1 | 0% | 0 | 31% | 0.306 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -103.2 | -50.9 | 175.5 | -177.9 | 57.1 | 0 | 0 | 0 | 113.2 | T91 I132 V135 V148 R149 L153 I156 | T91-L96 PolarHBondContact O-N 2.91Å; L96-I132 HydrophobicContact CD2-CD1 4.38Å; L96-I132 HydrophobicContact CD2-CG2 4.15Å; L96-V135 HydrophobicContact CB-CG1 4.36Å; L96-V135 HydrophobicContact CD2-CB 4.07Å; L96-V135 HydrophobicContact CD2-CG1 3.6Å; L96-V135 HydrophobicContact CG-CG1 3.94Å; L96-V148 HydrophobicContact CD1-CG1 3.91Å; L96-R149 PolarHBondContact O-N 3.27Å; L96-R149 PolarHBondContact O-NH2 3.44Å; L96-L153 HydrophobicContact CD1-CB 3.71Å; L96-L153 HydrophobicContact CD1-CD1 4.16Å; L96-L153 HydrophobicContact CD1-CG 4.46Å; L96-L153 HydrophobicContact CD2-CD1 4.4Å; L96-I156 HydrophobicContact CD2-CD1 4.29Å |
| 97 | T | 90.7 | Very high | 90.6 | Very high | 1 Ų | 1 | 51.3 Ų | 51.3 | 1% | 0.006 | 28% | 0.284 | C | S | . | . | S | Bend | trans | -147.8 | 159.5 | 170.3 | -168.1 | 0 | 0 | 0 | 0 | 108.3 | I99 V135 D146 | T97-I99 HydrophobicContact CG2-CG1 3.94Å; T97-V135 HydrophobicContact CG2-CG1 3.36Å; T97-D146 PolarHBondContact OG1-O 2.96Å; T97-D146 VanDerWaalsContact OG1-O 3.07Å |
| 98 | E | 87.1 | Confident | 90.7 | Very high | 102 Ų | 102 | 48.9 Ų | 48.9 | 48% | 0.477 | 27% | 0.27 | S | S | . | . | trans | -74.8 | 126.3 | 170 | -170.2 | -179 | 157.8 | 0 | 0 | 110.1 | ||||
| 99 | I | 89.7 | Confident | 91 | Very high | 58 Ų | 58 | 48.7 Ų | 48.7 | 30% | 0.297 | 27% | 0.265 | S | S | . | . | trans | -106.6 | 106.1 | -177.6 | -55 | -173.3 | 0 | 0 | 0 | 110.3 | T97 I107 | T97-I99 HydrophobicContact CG2-CG1 3.94Å; I99-I107 HydrophobicContact CD1-CD1 4.07Å; I99-I107 HydrophobicContact CG1-CD1 4.19Å; I99-I107 HydrophobicContact CG2-CD1 4.35Å | ||
| 100 | S | 89.5 | Confident | 91.2 | Very high | 22 Ų | 22 | 44 Ų | 44 | 15% | 0.154 | 25% | 0.247 | C | C | . | . | trans | -83.9 | 160.9 | 163.8 | 73 | 0 | 0 | 0 | 0 | 111.2 | E12 V102 S103 G104 R142 | E12-S100 PolarHBondContact OE1-OG 3.32Å; S100-V102 VanDerWaalsContact C-N 3.27Å; S100-V102 PolarHBondContact O-N 2.87Å; S100-S103 PolarHBondContact N-OG 2.93Å; S100-S103 CarbonylContact O-C 3.53Å; S100-S103 PolarHBondContact O-N 2.9Å; S100-S103 PolarHBondContact O-OG 3.39Å; S100-S103 PolarHBondContact OG-N 2.71Å; S100-S103 PolarHBondContact OG-OG 2.84Å; S100-G104 PolarHBondContact O-N 2.92Å; S100-R142 PolarHBondContact OG-NH1 3.09Å | ||
| 101 | P | 90.4 | Very high | 91.4 | Very high | 43 Ų | 43 | 38.9 Ų | 38.9 | 28% | 0.279 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -52.8 | -40 | 178.4 | -28.3 | 35.6 | 0 | 0 | 0 | 114.1 | F20 I21 Q24 G104 F105 | F20-P101 HydrophobicContact CB-CB 4.38Å; I21-P101 HydrophobicContact CG1-CB 3.89Å; I21-P101 HydrophobicContact CG1-CG 3.68Å; Q24-P101 HydrophobicContact CB-CB 4.35Å; P101-G104 PolarHBondContact O-N 3.5Å; P101-F105 WeakPolarHBondContact O-CB 3.32Å; P101-F105 PolarHBondContact O-N 2.91Å |
| 102 | V | 91 | Very high | 91.6 | Very high | 33 Ų | 33 | 38.3 Ų | 38.3 | 20% | 0.2 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -63.8 | -47.9 | 176.2 | 179.1 | 0 | 0 | 0 | 0 | 111.3 | E12 V16 F20 S100 F105 T106 | E12-V102 VanDerWaalsContact CD-CG2 3.41Å; E12-V102 HydrophobicContact CG-CG2 4.5Å; E12-V102 WeakPolarHBondContact OE1-CG2 3.26Å; E12-V102 WeakPolarHBondContact OE2-CG2 3.16Å; V16-V102 HydrophobicContact CG1-CG2 4.21Å; F20-V102 HydrophobicContact CB-CB 4.47Å; F20-V102 HydrophobicContact CB-CG2 3.67Å; F20-V102 HydrophobicContact CD1-CB 4.15Å; F20-V102 HydrophobicContact CD1-CG1 4.18Å; F20-V102 HydrophobicContact CD1-CG2 3.99Å; F20-V102 HydrophobicContact CD2-CG2 3.71Å; F20-V102 HydrophobicContact CE1-CG1 4.03Å; F20-V102 HydrophobicContact CE2-CG2 4.27Å; F20-V102 HydrophobicContact CG-CB 4.19Å; F20-V102 HydrophobicContact CG-CG1 4.47Å; F20-V102 HydrophobicContact CG-CG2 3.52Å; F20-V102 HydrophobicContact CZ-CG1 4.21Å; S100-V102 VanDerWaalsContact C-N 3.27Å; S100-V102 PolarHBondContact O-N 2.87Å; V102-F105 PolarHBondContact O-N 3.39Å; V102-T106 PolarHBondContact O-N 2.65Å; V102-T106 PolarHBondContact O-OG1 2.81Å |
| 103 | S | 91.5 | Very high | 91.9 | Very high | 7 Ų | 7 | 39.8 Ų | 39.8 | 5% | 0.049 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -68.3 | -37 | 178.5 | 57.4 | 0 | 0 | 0 | 0 | 112.3 | S100 F105 T106 I107 R142 | S100-S103 PolarHBondContact N-OG 2.93Å; S100-S103 CarbonylContact O-C 3.53Å; S100-S103 PolarHBondContact O-N 2.9Å; S100-S103 PolarHBondContact O-OG 3.39Å; S100-S103 PolarHBondContact OG-N 2.71Å; S100-S103 PolarHBondContact OG-OG 2.84Å; S103-F105 VanDerWaalsContact C-N 3.31Å; S103-F105 PolarHBondContact O-N 3.39Å; S103-T106 WeakPolarHBondContact O-CB 3.41Å; S103-T106 PolarHBondContact O-N 2.79Å; S103-I107 WeakPolarHBondContact O-CB 3.38Å; S103-I107 WeakPolarHBondContact O-CD1 3.28Å; S103-I107 WeakPolarHBondContact O-CG1 3.25Å; S103-I107 PolarHBondContact O-N 3.41Å; S103-R142 PolarHBondContact OG-NH1 3.48Å; S103-R142 VanDerWaalsContact OG-NH1 3.15Å |
| 104 | G | 93.4 | Very high | 92.4 | Very high | 3 Ų | 3 | 41.9 Ų | 41.9 | 3% | 0.031 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -58.9 | -44.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | Q24 S100 P101 T106 I107 E108 | Q24-G104 PolarHBondContact OE1-O 2.83Å; S100-G104 PolarHBondContact O-N 2.92Å; P101-G104 PolarHBondContact O-N 3.5Å; G104-T106 VanDerWaalsContact C-N 3.31Å; G104-T106 PolarHBondContact O-N 3.06Å; G104-I107 WeakPolarHBondContact O-CB 3.24Å; G104-I107 PolarHBondContact O-N 2.86Å; G104-E108 PolarHBondContact O-N 3.48Å |
| 105 | F | 94.7 | Very high | 92.8 | Very high | 45 Ų | 45 | 36.9 Ų | 36.9 | 20% | 0.197 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -66.3 | -41.2 | 179.8 | 177.3 | -97.4 | 0 | 0 | 0 | 110.4 | F20 L23 P101 V102 S103 I107 E108 M109 | F20-F105 HydrophobicContact CD1-CB 4.02Å; F20-F105 HydrophobicContact CD1-CD1 4.1Å; F20-F105 HydrophobicContact CD1-CG 4.19Å; F20-F105 HydrophobicContact CE1-CB 4.44Å; F20-F105 AromaticContact CE1-CD1 3.76Å; F20-F105 HydrophobicContact CE1-CD1 3.76Å; F20-F105 HydrophobicContact CE1-CE1 4.42Å; F20-F105 HydrophobicContact CE1-CG 4.32Å; L23-F105 HydrophobicContact CB-CD2 3.77Å; L23-F105 HydrophobicContact CB-CE2 3.88Å; L23-F105 HydrophobicContact CB-CG 4.37Å; P101-F105 WeakPolarHBondContact O-CB 3.32Å; P101-F105 PolarHBondContact O-N 2.91Å; V102-F105 PolarHBondContact O-N 3.39Å; S103-F105 VanDerWaalsContact C-N 3.31Å; S103-F105 PolarHBondContact O-N 3.39Å; F105-I107 VanDerWaalsContact C-N 3.34Å; F105-E108 PolarHBondContact O-N 3.24Å; F105-M109 HydrophobicContact CE1-CE 4.32Å; F105-M109 HydrophobicContact CE2-CE 4.15Å; F105-M109 HydrophobicContact CZ-CE 3.69Å; F105-M109 VanDerWaalsContact O-CB 3.28Å; F105-M109 WeakPolarHBondContact O-CB 3.49Å; F105-M109 PolarHBondContact O-N 3.42Å |
| 106 | T | 94.7 | Very high | 93.1 | Very high | 67 Ų | 67 | 41.4 Ų | 41.4 | 41% | 0.411 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -63.1 | -41 | 175.7 | -54.8 | 0 | 0 | 0 | 0 | 111.6 | V102 S103 G104 M109 G110 V138 | V102-T106 PolarHBondContact O-N 2.65Å; V102-T106 PolarHBondContact O-OG1 2.81Å; S103-T106 WeakPolarHBondContact O-CB 3.41Å; S103-T106 PolarHBondContact O-N 2.79Å; G104-T106 VanDerWaalsContact C-N 3.31Å; G104-T106 PolarHBondContact O-N 3.06Å; T106-M109 PolarHBondContact O-N 3.48Å; T106-G110 PolarHBondContact O-N 3.39Å; T106-V138 HydrophobicContact CG2-CG2 3.9Å |
| 107 | I | 95.6 | Very high | 93.4 | Very high | 8 Ų | 8 | 48.1 Ų | 48.1 | 4% | 0.041 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -62.4 | -50.8 | 178.3 | -74.4 | 162.5 | 0 | 0 | 0 | 110.1 | I99 S103 G104 F105 G110 A111 S134 V135 V138 | I99-I107 HydrophobicContact CD1-CD1 4.07Å; I99-I107 HydrophobicContact CG1-CD1 4.19Å; I99-I107 HydrophobicContact CG2-CD1 4.35Å; S103-I107 WeakPolarHBondContact O-CB 3.38Å; S103-I107 WeakPolarHBondContact O-CD1 3.28Å; S103-I107 WeakPolarHBondContact O-CG1 3.25Å; S103-I107 PolarHBondContact O-N 3.41Å; G104-I107 WeakPolarHBondContact O-CB 3.24Å; G104-I107 PolarHBondContact O-N 2.86Å; F105-I107 VanDerWaalsContact C-N 3.34Å; I107-G110 PolarHBondContact O-N 3.32Å; I107-A111 WeakPolarHBondContact O-CB 3.18Å; I107-A111 PolarHBondContact O-N 3.43Å; I107-S134 VanDerWaalsContact CA-OG 3.32Å; I107-S134 WeakPolarHBondContact CA-OG 3.44Å; I107-S134 WeakPolarHBondContact O-CB 3.38Å; I107-S134 PolarHBondContact O-OG 2.93Å; I107-V135 HydrophobicContact CD1-CB 4.41Å; I107-V135 HydrophobicContact CD1-CG1 4.45Å; I107-V135 HydrophobicContact CD1-CG2 4.1Å; I107-V135 HydrophobicContact CG1-CG2 4.41Å; I107-V135 HydrophobicContact CG2-CG2 3.54Å; I107-V138 HydrophobicContact CD1-CB 4.39Å; I107-V138 HydrophobicContact CD1-CG1 4.41Å; I107-V138 HydrophobicContact CG1-CB 3.88Å; I107-V138 HydrophobicContact CG1-CG1 4.23Å; I107-V138 HydrophobicContact CG1-CG2 3.75Å |
| 108 | E | 94.9 | Very high | 93.6 | Very high | 35 Ų | 35 | 48.3 Ų | 48.3 | 16% | 0.164 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -64 | -43 | 179.6 | -73.2 | -67.9 | 174.3 | 0 | 0 | 111.2 | A31 G104 F105 A111 A112 K131 | A31-E108 HydrophobicContact CB-CG 4.48Å; A31-E108 WeakPolarHBondContact CB-OE2 3.15Å; G104-E108 PolarHBondContact O-N 3.48Å; F105-E108 PolarHBondContact O-N 3.24Å; E108-A111 PolarHBondContact O-N 3.34Å; E108-A112 VanDerWaalsContact O-CB 3.25Å; E108-A112 WeakPolarHBondContact O-CB 3.29Å; E108-A112 PolarHBondContact O-N 2.93Å; E108-K131 IonicContact OE1-NZ 3.25Å; E108-K131 PolarHBondContact OE1-NZ 3.15Å; E108-K131 VanDerWaalsContact OE2-CE 3.24Å; E108-K131 WeakPolarHBondContact OE2-CE 3.39Å; E108-K131 IonicContact OE2-NZ 3.67Å; E108-K131 PolarHBondContact OE2-NZ 3.41Å |
| 109 | M | 95.4 | Very high | 93.8 | Very high | 89 Ų | 89 | 46.9 Ų | 46.9 | 44% | 0.438 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -63.3 | -45.1 | 176.4 | -169.2 | 59.3 | 59.3 | 0 | 0 | 111.8 | F105 T106 A111 A112 C113 | F105-M109 HydrophobicContact CE1-CE 4.32Å; F105-M109 HydrophobicContact CE2-CE 4.15Å; F105-M109 HydrophobicContact CZ-CE 3.69Å; F105-M109 VanDerWaalsContact O-CB 3.28Å; F105-M109 WeakPolarHBondContact O-CB 3.49Å; F105-M109 PolarHBondContact O-N 3.42Å; T106-M109 PolarHBondContact O-N 3.48Å; M109-A111 PolarHBondContact O-N 2.93Å; M109-A112 PolarHBondContact O-N 3.39Å; M109-C113 WeakPolarHBondContact O-CB 3.14Å; M109-C113 PolarHBondContact O-N 3.27Å; M109-C113 PolarHBondContact O-SG 3.34Å |
| 110 | G | 96.5 | Very high | 94 | Very high | 25 Ų | 25 | 53.1 Ų | 53.1 | 26% | 0.258 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -60 | -46.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | T106 I107 C113 T114 | T106-G110 PolarHBondContact O-N 3.39Å; I107-G110 PolarHBondContact O-N 3.32Å; G110-C113 PolarHBondContact O-N 3.37Å; G110-T114 PolarHBondContact O-N 2.92Å; G110-T114 PolarHBondContact O-OG1 3.16Å |
| 111 | A | 96.3 | Very high | 94.3 | Very high | 3 Ų | 3 | 57 Ų | 57 | 3% | 0.025 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -63 | -44.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | I107 E108 M109 T114 V115 C130 K131 | I107-A111 WeakPolarHBondContact O-CB 3.18Å; I107-A111 PolarHBondContact O-N 3.43Å; E108-A111 PolarHBondContact O-N 3.34Å; M109-A111 PolarHBondContact O-N 2.93Å; A111-T114 PolarHBondContact O-N 3.49Å; A111-V115 VanDerWaalsContact O-CG2 3.31Å; A111-V115 WeakPolarHBondContact O-CG2 3.19Å; A111-V115 PolarHBondContact O-N 2.89Å; A111-C130 HydrophobicContact CB-CB 4.32Å; A111-K131 HydrophobicContact CB-CB 4.43Å; A111-K131 HydrophobicContact CB-CG 3.81Å |
| 112 | A | 94.9 | Very high | 94.3 | Very high | 44 Ų | 44 | 58 Ų | 58 | 36% | 0.364 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -61.4 | -45.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | E108 M109 T114 V115 L116 | E108-A112 VanDerWaalsContact O-CB 3.25Å; E108-A112 WeakPolarHBondContact O-CB 3.29Å; E108-A112 PolarHBondContact O-N 2.93Å; M109-A112 PolarHBondContact O-N 3.39Å; A112-T114 PolarHBondContact O-N 3.19Å; A112-V115 PolarHBondContact O-N 3.36Å; A112-L116 WeakPolarHBondContact O-CB 3.27Å; A112-L116 VanDerWaalsContact O-CG 3.27Å; A112-L116 WeakPolarHBondContact O-CG 3.41Å; A112-L116 PolarHBondContact O-N 3.36Å |
| 113 | C | 95.7 | Very high | 94.3 | Very high | 69 Ų | 69 | 61.2 Ų | 61.2 | 47% | 0.466 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -58.9 | -45.3 | 174.9 | -74.2 | 0 | 0 | 0 | 0 | 111.8 | M109 G110 L116 F117 | M109-C113 WeakPolarHBondContact O-CB 3.14Å; M109-C113 PolarHBondContact O-N 3.27Å; M109-C113 PolarHBondContact O-SG 3.34Å; G110-C113 PolarHBondContact O-N 3.37Å; C113-L116 PolarHBondContact O-N 2.95Å; C113-F117 VanDerWaalsContact O-CB 3.29Å; C113-F117 WeakPolarHBondContact O-CB 3.46Å; C113-F117 PolarHBondContact O-N 2.9Å |
| 114 | T | 95.7 | Very high | 94.1 | Very high | 67 Ų | 67 | 67.4 Ų | 67.4 | 41% | 0.411 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -61.7 | -45 | 176.6 | -56.4 | 0 | 0 | 0 | 0 | 111.8 | G110 A111 A112 F117 A118 I125 C130 | G110-T114 PolarHBondContact O-N 2.92Å; G110-T114 PolarHBondContact O-OG1 3.16Å; A111-T114 PolarHBondContact O-N 3.49Å; A112-T114 PolarHBondContact O-N 3.19Å; T114-F117 PolarHBondContact O-N 3.49Å; T114-A118 WeakPolarHBondContact O-CB 3.45Å; T114-A118 PolarHBondContact O-N 3.28Å; T114-I125 HydrophobicContact CG2-CD1 4.34Å; T114-C130 HydrophobicContact CG2-CB 4.46Å |
| 115 | V | 94.1 | Very high | 94 | Very high | 34 Ų | 34 | 71 Ų | 71 | 21% | 0.206 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -62.6 | -44.9 | 177.7 | 171.1 | 0 | 0 | 0 | 0 | 111 | A111 A112 A118 S119 T127 C130 | A111-V115 VanDerWaalsContact O-CG2 3.31Å; A111-V115 WeakPolarHBondContact O-CG2 3.19Å; A111-V115 PolarHBondContact O-N 2.89Å; A112-V115 PolarHBondContact O-N 3.36Å; V115-A118 PolarHBondContact O-N 3.47Å; V115-S119 VanDerWaalsContact O-CB 3.23Å; V115-S119 WeakPolarHBondContact O-CB 3.49Å; V115-S119 PolarHBondContact O-N 3.4Å; V115-S119 PolarHBondContact O-OG 3.19Å; V115-T127 HydrophobicContact CG1-CG2 4.48Å; V115-T127 HydrophobicContact CG2-CG2 4.14Å; V115-C130 HydrophobicContact CG2-CB 3.82Å |
| 116 | L | 93.4 | Very high | 93.8 | Very high | 115 Ų | 115 | 71.1 Ų | 71.1 | 60% | 0.602 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -64.1 | -42.8 | 178.7 | -73.7 | 173.4 | 0 | 0 | 0 | 111.6 | A112 C113 S119 K120 | A112-L116 WeakPolarHBondContact O-CB 3.27Å; A112-L116 VanDerWaalsContact O-CG 3.27Å; A112-L116 WeakPolarHBondContact O-CG 3.41Å; A112-L116 PolarHBondContact O-N 3.36Å; C113-L116 PolarHBondContact O-N 2.95Å; L116-S119 PolarHBondContact O-N 3.34Å; L116-K120 WeakPolarHBondContact O-CB 2.95Å; L116-K120 WeakPolarHBondContact O-CG 3.3Å; L116-K120 PolarHBondContact O-N 3.15Å |
| 117 | F | 95.7 | Very high | 93.4 | Very high | 141 Ų | 141 | 69.2 Ų | 69.2 | 62% | 0.618 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -62.8 | -48.4 | 177.5 | -175.1 | -100.4 | 0 | 0 | 0 | 111.6 | C113 T114 S119 K120 L121 | C113-F117 VanDerWaalsContact O-CB 3.29Å; C113-F117 WeakPolarHBondContact O-CB 3.46Å; C113-F117 PolarHBondContact O-N 2.9Å; T114-F117 PolarHBondContact O-N 3.49Å; F117-S119 VanDerWaalsContact C-N 3.35Å; F117-S119 PolarHBondContact O-N 3.25Å; F117-K120 PolarHBondContact O-N 3.03Å; F117-L121 HydrophobicContact CD1-CD1 3.95Å; F117-L121 HydrophobicContact CE1-CD1 3.43Å; F117-L121 VanDerWaalsContact CE1-CD1 3.43Å; F117-L121 HydrophobicContact CE1-CG 4.49Å; F117-L121 HydrophobicContact CZ-CD1 3.83Å; F117-L121 PolarHBondContact O-N 2.99Å |
| 118 | A | 94.9 | Very high | 93.2 | Very high | 4 Ų | 4 | 71.2 Ų | 71.2 | 3% | 0.033 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -62.2 | -41.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | T114 V115 K120 L121 G122 M123 I125 | T114-A118 WeakPolarHBondContact O-CB 3.45Å; T114-A118 PolarHBondContact O-N 3.28Å; V115-A118 PolarHBondContact O-N 3.47Å; A118-K120 VanDerWaalsContact C-N 3.31Å; A118-K120 PolarHBondContact O-N 2.92Å; A118-L121 CarbonylContact O-C 3.01Å; A118-L121 PolarHBondContact O-N 3.49Å; A118-L121 VanDerWaalsContact O-N 3.08Å; A118-G122 PolarHBondContact O-N 3.31Å; A118-G122 VanDerWaalsContact O-N 3.16Å; A118-M123 HydrophobicContact CB-CE 4.49Å; A118-M123 PolarHBondContact O-N 3.39Å; A118-I125 HydrophobicContact CB-CB 4.04Å; A118-I125 HydrophobicContact CB-CD1 4.14Å; A118-I125 HydrophobicContact CB-CG2 3.61Å |
| 119 | S | 91.8 | Very high | 93.1 | Very high | 73 Ų | 73 | 73.9 Ų | 73.9 | 51% | 0.51 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -60.2 | -39.9 | 175.9 | -61.7 | 0 | 0 | 0 | 0 | 111.9 | V115 L116 F117 L121 G122 | V115-S119 VanDerWaalsContact O-CB 3.23Å; V115-S119 WeakPolarHBondContact O-CB 3.49Å; V115-S119 PolarHBondContact O-N 3.4Å; V115-S119 PolarHBondContact O-OG 3.19Å; L116-S119 PolarHBondContact O-N 3.34Å; F117-S119 VanDerWaalsContact C-N 3.35Å; F117-S119 PolarHBondContact O-N 3.25Å; S119-L121 VanDerWaalsContact C-N 3.27Å; S119-L121 PolarHBondContact O-N 3.29Å; S119-G122 PolarHBondContact O-N 3.41Å |
| 120 | K | 93.7 | Very high | 93.1 | Very high | 188 Ų | 188 | 70.1 Ų | 70.1 | 82% | 0.817 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -65.8 | -30.2 | 175.6 | -78.5 | -62.9 | -166.2 | -177.5 | 0 | 113.1 | L116 F117 A118 | L116-K120 WeakPolarHBondContact O-CB 2.95Å; L116-K120 WeakPolarHBondContact O-CG 3.3Å; L116-K120 PolarHBondContact O-N 3.15Å; F117-K120 PolarHBondContact O-N 3.03Å; A118-K120 VanDerWaalsContact C-N 3.31Å; A118-K120 PolarHBondContact O-N 2.92Å |
| 121 | L | 95.2 | Very high | 93 | Very high | 103 Ų | 103 | 70.9 Ų | 70.9 | 54% | 0.539 | 41% | 0.405 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.3 | 0.3 | 173.9 | -65.1 | 175 | 0 | 0 | 0 | 112.8 | F117 A118 S119 M123 | F117-L121 HydrophobicContact CD1-CD1 3.95Å; F117-L121 HydrophobicContact CE1-CD1 3.43Å; F117-L121 VanDerWaalsContact CE1-CD1 3.43Å; F117-L121 HydrophobicContact CE1-CG 4.49Å; F117-L121 HydrophobicContact CZ-CD1 3.83Å; F117-L121 PolarHBondContact O-N 2.99Å; A118-L121 CarbonylContact O-C 3.01Å; A118-L121 PolarHBondContact O-N 3.49Å; A118-L121 VanDerWaalsContact O-N 3.08Å; S119-L121 VanDerWaalsContact C-N 3.27Å; S119-L121 PolarHBondContact O-N 3.29Å; L121-M123 HydrophobicContact CB-CE 3.84Å; L121-M123 HydrophobicContact CB-CG 4.12Å; L121-M123 HydrophobicContact CD1-CE 3.49Å; L121-M123 VanDerWaalsContact CD1-CE 3.49Å; L121-M123 HydrophobicContact CG-CE 4.31Å; L121-M123 PolarHBondContact O-N 3.49Å |
| 122 | G | 91.2 | Very high | 92.9 | Very high | 64 Ų | 64 | 71.3 Ų | 71.3 | 66% | 0.66 | 41% | 0.407 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 68.1 | 16 | -177.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | A118 S119 | A118-G122 PolarHBondContact O-N 3.31Å; A118-G122 VanDerWaalsContact O-N 3.16Å; S119-G122 PolarHBondContact O-N 3.41Å |
| 123 | M | 90.3 | Very high | 93 | Very high | 101 Ų | 101 | 71.2 Ų | 71.2 | 50% | 0.498 | 41% | 0.41 | S | S | . | . | trans | -86 | 124.9 | -178.4 | -67.4 | -170.3 | -63.6 | 0 | 0 | 110.1 | A118 L121 I125 | A118-M123 HydrophobicContact CB-CE 4.49Å; A118-M123 PolarHBondContact O-N 3.39Å; L121-M123 HydrophobicContact CB-CE 3.84Å; L121-M123 HydrophobicContact CB-CG 4.12Å; L121-M123 HydrophobicContact CD1-CE 3.49Å; L121-M123 VanDerWaalsContact CD1-CE 3.49Å; L121-M123 HydrophobicContact CG-CE 4.31Å; L121-M123 PolarHBondContact O-N 3.49Å; M123-I125 PolarHBondContact O-N 2.99Å | ||
| 124 | P | 88.2 | Confident | 93 | Very high | 137 Ų | 137 | 68.6 Ų | 68.6 | 89% | 0.89 | 39% | 0.393 | S | S | * | . | trans | -67.7 | 119 | 171.6 | 28.4 | -32.3 | 0 | 0 | 0 | 108.8 | ||||
| 125 | I | 91.3 | Very high | 93 | Very high | 78 Ų | 78 | 65.6 Ų | 65.6 | 40% | 0.4 | 37% | 0.374 | S | S | . | . | trans | -129.1 | 145.7 | 177 | -161.4 | 163.3 | 0 | 0 | 0 | 110.5 | T114 A118 M123 C130 | T114-I125 HydrophobicContact CG2-CD1 4.34Å; A118-I125 HydrophobicContact CB-CB 4.04Å; A118-I125 HydrophobicContact CB-CD1 4.14Å; A118-I125 HydrophobicContact CB-CG2 3.61Å; M123-I125 PolarHBondContact O-N 2.99Å; I125-C130 VanDerWaalsContact CD1-SG 3.5Å | ||
| 126 | S | 89.4 | Confident | 93 | Very high | 49 Ų | 49 | 64.3 Ų | 64.3 | 34% | 0.343 | 37% | 0.368 | S | S | . | . | trans | -80 | 126.3 | 174.5 | 172.3 | 0 | 0 | 0 | 0 | 110.7 | T128 H129 C130 | S126-T128 VanDerWaalsContact C-N 3.27Å; S126-T128 PolarHBondContact O-N 3.13Å; S126-T128 PolarHBondContact OG-N 3.34Å; S126-H129 PolarHBondContact O-N 2.97Å; S126-C130 PolarHBondContact O-N 2.92Å; S126-C130 VanDerWaalsContact O-N 3.15Å; S126-C130 PolarHBondContact O-SG 2.88Å; S126-C130 VanDerWaalsContact O-SG 3.34Å | ||
| 127 | T | 88.2 | Confident | 93 | Very high | 27 Ų | 27 | 61 Ų | 61 | 17% | 0.166 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -62 | -36.5 | 175.4 | 60.3 | 0 | 0 | 0 | 0 | 111.5 | H35 V115 H129 C130 K131 | H35-T127 PolarHBondContact CE1-OG1 3.45Å; H35-T127 PolarHBondContact ND1-OG1 3.39Å; H35-T127 VanDerWaalsContact ND1-OG1 3.13Å; V115-T127 HydrophobicContact CG1-CG2 4.48Å; V115-T127 HydrophobicContact CG2-CG2 4.14Å; T127-H129 PolarHBondContact O-N 3.36Å; T127-C130 WeakPolarHBondContact O-CB 3.46Å; T127-C130 PolarHBondContact O-N 3.36Å; T127-K131 WeakPolarHBondContact O-CG 3.15Å; T127-K131 PolarHBondContact O-N 3.48Å |
| 128 | T | 90.3 | Very high | 92.9 | Very high | 50 Ų | 50 | 55.4 Ų | 55.4 | 31% | 0.307 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -61.5 | -44.1 | 177.1 | -52 | 0 | 0 | 0 | 0 | 111.8 | S126 K131 I132 | S126-T128 VanDerWaalsContact C-N 3.27Å; S126-T128 PolarHBondContact O-N 3.13Å; S126-T128 PolarHBondContact OG-N 3.34Å; T128-K131 PolarHBondContact O-N 3.29Å; T128-I132 WeakPolarHBondContact O-CG1 3.33Å; T128-I132 PolarHBondContact O-N 2.86Å |
| 129 | H | 93 | Very high | 92.8 | Very high | 91 Ų | 91 | 55.2 Ų | 55.2 | 42% | 0.421 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -65.5 | -40.9 | 176.4 | -70.5 | 179.1 | 0 | 0 | 0 | 111.6 | S126 T127 K131 G133 W160 | S126-H129 PolarHBondContact O-N 2.97Å; T127-H129 PolarHBondContact O-N 3.36Å; H129-K131 VanDerWaalsContact C-N 3.34Å; H129-K131 PolarHBondContact O-N 3.46Å; H129-G133 PolarHBondContact O-N 2.84Å; H129-W160 AromaticContact CD2-CD2 3.89Å; H129-W160 AromaticContact CD2-CE2 3.7Å; H129-W160 AromaticContact CD2-CE3 3.82Å; H129-W160 AromaticContact CD2-CH2 3.43Å; H129-W160 VanDerWaalsContact CD2-CH2 3.43Å; H129-W160 WeakPolarHBondContact CD2-CH2 3.42Å; H129-W160 AromaticContact CD2-CZ2 3.48Å; H129-W160 VanDerWaalsContact CD2-CZ2 3.48Å; H129-W160 WeakPolarHBondContact CD2-CZ2 3.42Å; H129-W160 AromaticContact CD2-CZ3 3.61Å; H129-W160 AromaticContact NE2-CD2 3.38Å; H129-W160 AromaticContact NE2-CE2 3.62Å; H129-W160 AromaticContact NE2-CE3 3.42Å; H129-W160 AromaticContact NE2-CG 3.94Å; H129-W160 AromaticContact NE2-CH2 3.95Å; H129-W160 AromaticContact NE2-CZ2 3.9Å; H129-W160 AromaticContact NE2-CZ3 3.72Å |
| 130 | C | 94.9 | Very high | 92.7 | Very high | 9 Ų | 9 | 57 Ų | 57 | 6% | 0.061 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -59.9 | -44.3 | 174.4 | -64.9 | 0 | 0 | 0 | 0 | 111.7 | A111 T114 V115 I125 S126 T127 S134 | A111-C130 HydrophobicContact CB-CB 4.32Å; T114-C130 HydrophobicContact CG2-CB 4.46Å; V115-C130 HydrophobicContact CG2-CB 3.82Å; I125-C130 VanDerWaalsContact CD1-SG 3.5Å; S126-C130 PolarHBondContact O-N 2.92Å; S126-C130 VanDerWaalsContact O-N 3.15Å; S126-C130 PolarHBondContact O-SG 2.88Å; S126-C130 VanDerWaalsContact O-SG 3.34Å; T127-C130 WeakPolarHBondContact O-CB 3.46Å; T127-C130 PolarHBondContact O-N 3.36Å; C130-S134 VanDerWaalsContact O-CB 3.26Å; C130-S134 WeakPolarHBondContact O-CB 3.49Å; C130-S134 PolarHBondContact O-N 3.38Å |
| 131 | K | 94.1 | Very high | 92.5 | Very high | 41 Ų | 41 | 54.4 Ų | 54.4 | 18% | 0.178 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -63.4 | -53.4 | 177 | -73.4 | -164.8 | 179.7 | -155 | 0 | 111.9 | E108 A111 T127 T128 H129 G133 S134 V135 | E108-K131 IonicContact OE1-NZ 3.25Å; E108-K131 PolarHBondContact OE1-NZ 3.15Å; E108-K131 VanDerWaalsContact OE2-CE 3.24Å; E108-K131 WeakPolarHBondContact OE2-CE 3.39Å; E108-K131 IonicContact OE2-NZ 3.67Å; E108-K131 PolarHBondContact OE2-NZ 3.41Å; A111-K131 HydrophobicContact CB-CB 4.43Å; A111-K131 HydrophobicContact CB-CG 3.81Å; T127-K131 WeakPolarHBondContact O-CG 3.15Å; T127-K131 PolarHBondContact O-N 3.48Å; T128-K131 PolarHBondContact O-N 3.29Å; H129-K131 VanDerWaalsContact C-N 3.34Å; H129-K131 PolarHBondContact O-N 3.46Å; K131-G133 VanDerWaalsContact C-N 3.31Å; K131-G133 PolarHBondContact O-N 2.87Å; K131-S134 WeakPolarHBondContact O-CB 3.31Å; K131-S134 PolarHBondContact O-N 3.34Å; K131-S134 VanDerWaalsContact O-N 3.13Å; K131-V135 VanDerWaalsContact O-CG2 3.26Å; K131-V135 WeakPolarHBondContact O-CG2 3.01Å; K131-V135 PolarHBondContact O-N 2.82Å |
| 132 | I | 95.6 | Very high | 91.8 | Very high | 13 Ų | 13 | 52.8 Ų | 52.8 | 7% | 0.067 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -61.6 | -39.6 | 179.7 | -64.6 | -63.6 | 0 | 0 | 0 | 111.7 | V92 L96 T128 V135 A136 L153 I156 W160 | V92-I132 HydrophobicContact CG1-CD1 4.05Å; V92-I132 HydrophobicContact CG2-CD1 3.73Å; L96-I132 HydrophobicContact CD2-CD1 4.38Å; L96-I132 HydrophobicContact CD2-CG2 4.15Å; T128-I132 WeakPolarHBondContact O-CG1 3.33Å; T128-I132 PolarHBondContact O-N 2.86Å; I132-V135 PolarHBondContact O-N 3.18Å; I132-A136 WeakPolarHBondContact O-CB 3.46Å; I132-A136 PolarHBondContact O-N 3.07Å; I132-L153 HydrophobicContact CG2-CD1 3.76Å; I132-I156 HydrophobicContact CG2-CG2 4.47Å; I132-W160 HydrophobicContact CB-CH2 4Å; I132-W160 HydrophobicContact CB-CZ2 4.29Å; I132-W160 HydrophobicContact CG1-CH2 4.26Å; I132-W160 HydrophobicContact CG1-CZ2 4.02Å; I132-W160 HydrophobicContact CG2-CH2 3.84Å; I132-W160 HydrophobicContact CG2-CZ2 4.35Å |
| 133 | G | 95.7 | Very high | 90.6 | Very high | 41 Ų | 41 | 52 Ų | 52 | 42% | 0.423 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -62.3 | -41.9 | 174 | 0 | 0 | 0 | 0 | 0 | 112.5 | H129 K131 A136 A137 | H129-G133 PolarHBondContact O-N 2.84Å; K131-G133 VanDerWaalsContact C-N 3.31Å; K131-G133 PolarHBondContact O-N 2.87Å; G133-A136 PolarHBondContact O-N 2.98Å; G133-A137 WeakPolarHBondContact O-CB 3.44Å; G133-A137 PolarHBondContact O-N 3.4Å |
| 134 | S | 96 | Very high | 89.3 | Confident | 14 Ų | 14 | 58 Ų | 58 | 10% | 0.098 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -65.2 | -42.8 | 175.3 | -169.3 | 0 | 0 | 0 | 0 | 112.1 | I107 C130 K131 A136 A137 V138 | I107-S134 VanDerWaalsContact CA-OG 3.32Å; I107-S134 WeakPolarHBondContact CA-OG 3.44Å; I107-S134 WeakPolarHBondContact O-CB 3.38Å; I107-S134 PolarHBondContact O-OG 2.93Å; C130-S134 VanDerWaalsContact O-CB 3.26Å; C130-S134 WeakPolarHBondContact O-CB 3.49Å; C130-S134 PolarHBondContact O-N 3.38Å; K131-S134 WeakPolarHBondContact O-CB 3.31Å; K131-S134 PolarHBondContact O-N 3.34Å; K131-S134 VanDerWaalsContact O-N 3.13Å; S134-A136 VanDerWaalsContact C-N 3.33Å; S134-A136 PolarHBondContact O-N 2.92Å; S134-A137 PolarHBondContact O-N 2.89Å; S134-V138 WeakPolarHBondContact O-CG2 3.32Å; S134-V138 PolarHBondContact O-N 3.29Å |
| 135 | V | 95 | Very high | 88.2 | Confident | 4 Ų | 4 | 56.8 Ų | 56.8 | 2% | 0.024 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -56.7 | -48.2 | 172.8 | 178.8 | 0 | 0 | 0 | 0 | 110.5 | V92 L96 T97 I107 K131 I132 G139 | V92-V135 HydrophobicContact CG1-CG2 4.25Å; L96-V135 HydrophobicContact CB-CG1 4.36Å; L96-V135 HydrophobicContact CD2-CB 4.07Å; L96-V135 HydrophobicContact CD2-CG1 3.6Å; L96-V135 HydrophobicContact CG-CG1 3.94Å; T97-V135 HydrophobicContact CG2-CG1 3.36Å; I107-V135 HydrophobicContact CD1-CB 4.41Å; I107-V135 HydrophobicContact CD1-CG1 4.45Å; I107-V135 HydrophobicContact CD1-CG2 4.1Å; I107-V135 HydrophobicContact CG1-CG2 4.41Å; I107-V135 HydrophobicContact CG2-CG2 3.54Å; K131-V135 VanDerWaalsContact O-CG2 3.26Å; K131-V135 WeakPolarHBondContact O-CG2 3.01Å; K131-V135 PolarHBondContact O-N 2.82Å; I132-V135 PolarHBondContact O-N 3.18Å; V135-G139 PolarHBondContact O-N 2.95Å |
| 136 | A | 94.6 | Very high | 87.1 | Confident | 8 Ų | 8 | 55.2 Ų | 55.2 | 7% | 0.066 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -64.1 | -42.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | I132 G133 S134 G139 M140 V148 L153 | I132-A136 WeakPolarHBondContact O-CB 3.46Å; I132-A136 PolarHBondContact O-N 3.07Å; G133-A136 PolarHBondContact O-N 2.98Å; S134-A136 VanDerWaalsContact C-N 3.33Å; S134-A136 PolarHBondContact O-N 2.92Å; A136-G139 PolarHBondContact O-N 3.46Å; A136-M140 VanDerWaalsContact O-CG 3.32Å; A136-M140 WeakPolarHBondContact O-CG 3.42Å; A136-M140 PolarHBondContact O-N 3.11Å; A136-V148 HydrophobicContact CB-CG1 4.47Å; A136-V148 HydrophobicContact CB-CG2 4.28Å; A136-V148 WeakPolarHBondContact O-CG2 3.4Å; A136-L153 HydrophobicContact CB-CD2 4.23Å |
| 137 | A | 94.5 | Very high | 86.9 | Confident | 45 Ų | 45 | 53.6 Ų | 53.6 | 37% | 0.372 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -60.7 | -48.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | G133 S134 G139 M140 V141 | G133-A137 WeakPolarHBondContact O-CB 3.44Å; G133-A137 PolarHBondContact O-N 3.4Å; S134-A137 PolarHBondContact O-N 2.89Å; A137-G139 PolarHBondContact O-N 3.39Å; A137-M140 HydrophobicContact CB-CE 4.46Å; A137-M140 PolarHBondContact O-N 3.25Å; A137-V141 PolarHBondContact O-N 2.86Å |
| 138 | V | 93.4 | Very high | 87.1 | Confident | 23 Ų | 23 | 52.9 Ų | 52.9 | 14% | 0.139 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -63.5 | -42.4 | 176.5 | 172.4 | 0 | 0 | 0 | 0 | 110.9 | T106 I107 S134 M140 V141 R142 | T106-V138 HydrophobicContact CG2-CG2 3.9Å; I107-V138 HydrophobicContact CD1-CB 4.39Å; I107-V138 HydrophobicContact CD1-CG1 4.41Å; I107-V138 HydrophobicContact CG1-CB 3.88Å; I107-V138 HydrophobicContact CG1-CG1 4.23Å; I107-V138 HydrophobicContact CG1-CG2 3.75Å; S134-V138 WeakPolarHBondContact O-CG2 3.32Å; S134-V138 PolarHBondContact O-N 3.29Å; V138-M140 VanDerWaalsContact C-N 3.31Å; V138-M140 PolarHBondContact O-N 2.99Å; V138-V141 PolarHBondContact O-N 2.69Å; V138-R142 WeakPolarHBondContact O-CG 3.38Å; V138-R142 PolarHBondContact O-N 3.48Å |
| 139 | G | 91.5 | Very high | 87.2 | Confident | 0 Ų | 0 | 55.3 Ų | 55.3 | 0% | 0 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -61.6 | -34.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | V135 A136 A137 V141 R142 G147 | V135-G139 PolarHBondContact O-N 2.95Å; A136-G139 PolarHBondContact O-N 3.46Å; A137-G139 PolarHBondContact O-N 3.39Å; G139-V141 PolarHBondContact O-N 2.97Å; G139-R142 PolarHBondContact O-N 2.92Å; G139-G147 WeakPolarHBondContact O-CA 3.45Å |
| 140 | M | 91.1 | Very high | 87.1 | Confident | 112 Ų | 112 | 58.4 Ų | 58.4 | 55% | 0.552 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -69.3 | -32 | 178.2 | -76.9 | -173 | -67.3 | 0 | 0 | 113.1 | A136 A137 V138 V148 W150 | A136-M140 VanDerWaalsContact O-CG 3.32Å; A136-M140 WeakPolarHBondContact O-CG 3.42Å; A136-M140 PolarHBondContact O-N 3.11Å; A137-M140 HydrophobicContact CB-CE 4.46Å; A137-M140 PolarHBondContact O-N 3.25Å; V138-M140 VanDerWaalsContact C-N 3.31Å; V138-M140 PolarHBondContact O-N 2.99Å; M140-V148 HydrophobicContact CG-CG2 3.79Å; M140-W150 HydrophobicContact CG-CH2 4.14Å; M140-W150 HydrophobicContact CG-CZ2 4Å; M140-W150 HydrophobicContact SD-CH2 3.69Å; M140-W150 HydrophobicContact SD-CZ2 4.03Å |
| 141 | V | 88.7 | Confident | 87.1 | Confident | 133 Ų | 133 | 63.3 Ų | 63.3 | 81% | 0.806 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -80.5 | -21.8 | 178.7 | 178.2 | 0 | 0 | 0 | 0 | 111.5 | A137 V138 G139 | A137-V141 PolarHBondContact O-N 2.86Å; V138-V141 PolarHBondContact O-N 2.69Å; G139-V141 PolarHBondContact O-N 2.97Å |
| 142 | R | 81 | Confident | 87.1 | Confident | 69 Ų | 69 | 62.8 Ų | 62.8 | 26% | 0.26 | 33% | 0.332 | S | S | . | . | S | Bend | trans | -75.5 | 162.7 | 176.6 | -72.7 | 179.9 | 69.7 | 130.7 | 5.4 | 112.2 | S100 S103 V138 G139 D146 | S100-R142 PolarHBondContact OG-NH1 3.09Å; S103-R142 PolarHBondContact OG-NH1 3.48Å; S103-R142 VanDerWaalsContact OG-NH1 3.15Å; V138-R142 WeakPolarHBondContact O-CG 3.38Å; V138-R142 PolarHBondContact O-N 3.48Å; G139-R142 PolarHBondContact O-N 2.92Å; R142-D146 IonicContact NH2-OD2 3.7Å; R142-D146 PolarHBondContact NH2-OD2 3.3Å |
| 143 | S | 65.2 | Low | 87.1 | Confident | 47 Ų | 47 | 63.5 Ų | 63.5 | 33% | 0.329 | 34% | 0.336 | S | S | . | . | trans | -57.4 | 151 | -179 | -173.7 | 0 | 0 | 0 | 0 | 112.1 | S145 D146 G147 | S143-S145 PolarHBondContact O-N 3.4Å; S143-D146 CarbonylContact O-C 3.44Å; S143-D146 PolarHBondContact O-N 3.03Å; S143-G147 PolarHBondContact O-N 3.49Å; S143-G147 VanDerWaalsContact O-N 3.1Å | ||
| 144 | R | 64.1 | Low | 87.1 | Confident | 227 Ų | 227 | 68.4 Ų | 68.4 | 86% | 0.857 | 34% | 0.342 | S | S | * | . | G | 310 helix | trans | -55.3 | -27.2 | -172.1 | -173.5 | 168.7 | 171.5 | 126.3 | -4 | 114.5 | ||
| 145 | S | 64.5 | Low | 87.1 | Confident | 111 Ų | 111 | 71.8 Ų | 71.8 | 78% | 0.776 | 36% | 0.359 | S | S | * | . | G | 310 helix | trans | -72.6 | -32.1 | 176.3 | -164.8 | 0 | 0 | 0 | 0 | 113 | S143 | S143-S145 PolarHBondContact O-N 3.4Š|
| 146 | D | 68.8 | Low | 87 | Confident | 45 Ų | 45 | 72.6 Ų | 72.6 | 24% | 0.241 | 36% | 0.363 | C | S | . | . | G | 310 helix | trans | -107.4 | 18 | -178.3 | -52.8 | -7.7 | 0 | 0 | 0 | 110.8 | T97 R142 S143 | T97-D146 PolarHBondContact OG1-O 2.96Å; T97-D146 VanDerWaalsContact OG1-O 3.07Å; R142-D146 IonicContact NH2-OD2 3.7Å; R142-D146 PolarHBondContact NH2-OD2 3.3Å; S143-D146 CarbonylContact O-C 3.44Å; S143-D146 PolarHBondContact O-N 3.03Å |
| 147 | G | 84.5 | Confident | 87.1 | Confident | 16 Ų | 16 | 75.1 Ų | 75.1 | 17% | 0.165 | 38% | 0.377 | C | S | . | . | S | Bend | trans | -71.1 | 179 | -176.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | G139 S143 R149 | G139-G147 WeakPolarHBondContact O-CA 3.45Å; S143-G147 PolarHBondContact O-N 3.49Å; S143-G147 VanDerWaalsContact O-N 3.1Å; G147-R149 PolarHBondContact O-N 3.37Å |
| 148 | V | 91.8 | Very high | 87.1 | Confident | 12 Ų | 12 | 76.8 Ų | 76.8 | 7% | 0.073 | 38% | 0.379 | C | S | . | . | trans | -65.3 | 126.5 | 175.7 | -175.9 | 0 | 0 | 0 | 0 | 111 | L96 A136 M140 W150 L153 | L96-V148 HydrophobicContact CD1-CG1 3.91Å; A136-V148 HydrophobicContact CB-CG1 4.47Å; A136-V148 HydrophobicContact CB-CG2 4.28Å; A136-V148 WeakPolarHBondContact O-CG2 3.4Å; M140-V148 HydrophobicContact CG-CG2 3.79Å; V148-W150 HydrophobicContact CB-CZ2 4.3Å; V148-W150 HydrophobicContact CG1-CD2 4.27Å; V148-W150 HydrophobicContact CG1-CE3 4.35Å; V148-W150 VanDerWaalsContact O-CD1 3.29Å; V148-W150 PolarHBondContact O-N 2.88Å; V148-W150 VanDerWaalsContact O-N 3.11Å; V148-L153 HydrophobicContact CG1-CB 4.39Å; V148-L153 HydrophobicContact CG1-CD2 4.13Å | ||
| 149 | R | 92.6 | Very high | 87.1 | Confident | 101 Ų | 101 | 78.3 Ų | 78.3 | 38% | 0.381 | 39% | 0.391 | S | S | . | . | trans | -77.8 | 93 | 166.3 | -75.3 | 180 | -66.5 | -93.7 | -19.3 | 110.2 | E94 G95 L96 G147 I151 T152 L153 | E94-R149 PolarHBondContact O-NH1 3.25Å; E94-R149 PolarHBondContact O-NH2 3.06Å; G95-R149 VanDerWaalsContact C-CZ 3.46Å; G95-R149 VanDerWaalsContact C-NE 3.26Å; G95-R149 VanDerWaalsContact CA-NH2 3.34Å; G95-R149 PolarHBondContact O-NE 3.48Å; G95-R149 PolarHBondContact O-NH2 3.37Å; L96-R149 PolarHBondContact O-N 3.27Å; L96-R149 PolarHBondContact O-NH2 3.44Å; G147-R149 PolarHBondContact O-N 3.37Å; R149-I151 VanDerWaalsContact C-N 3.25Å; R149-I151 PolarHBondContact O-N 3.19Å; R149-T152 WeakPolarHBondContact O-CB 3.29Å; R149-T152 PolarHBondContact O-N 3.25Å; R149-L153 PolarHBondContact O-N 3.11Å | ||
| 150 | W | 92.5 | Very high | 87.2 | Confident | 155 Ų | 155 | 81.9 Ų | 81.9 | 59% | 0.587 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -58.6 | -31.1 | -176.8 | -64.5 | 103.8 | 0 | 0 | 0 | 114.5 | M140 V148 L153 R154 | M140-W150 HydrophobicContact CG-CH2 4.14Å; M140-W150 HydrophobicContact CG-CZ2 4Å; M140-W150 HydrophobicContact SD-CH2 3.69Å; M140-W150 HydrophobicContact SD-CZ2 4.03Å; V148-W150 HydrophobicContact CB-CZ2 4.3Å; V148-W150 HydrophobicContact CG1-CD2 4.27Å; V148-W150 HydrophobicContact CG1-CE3 4.35Å; V148-W150 VanDerWaalsContact O-CD1 3.29Å; V148-W150 PolarHBondContact O-N 2.88Å; V148-W150 VanDerWaalsContact O-N 3.11Å; W150-L153 HydrophobicContact CE3-CD2 3.8Å; W150-L153 HydrophobicContact CZ3-CD2 3.68Å; W150-L153 PolarHBondContact O-N 3.46Å; W150-R154 WeakPolarHBondContact O-CB 3.4Å; W150-R154 PolarHBondContact O-N 3.16Å |
| 151 | I | 94.3 | Very high | 87.3 | Confident | 113 Ų | 113 | 82.2 Ų | 82.2 | 58% | 0.579 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -65.3 | -45.4 | 175.5 | -65.4 | 167.6 | 0 | 0 | 0 | 110.1 | R149 R154 N155 | R149-I151 VanDerWaalsContact C-N 3.25Å; R149-I151 PolarHBondContact O-N 3.19Å; I151-R154 PolarHBondContact O-N 3.22Å; I151-N155 PolarHBondContact O-N 3.4Å; I151-N155 PolarHBondContact O-OD1 3.43Å |
| 152 | T | 93.2 | Very high | 87.5 | Confident | 30 Ų | 30 | 79.5 Ų | 79.5 | 18% | 0.184 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -62.7 | -47.3 | 175.8 | -47.4 | 0 | 0 | 0 | 0 | 110.7 | T91 G95 R149 R154 N155 I156 | T91-T152 HydrophobicContact CG2-CG2 3.73Å; G95-T152 VanDerWaalsContact O-CB 3.31Å; G95-T152 WeakPolarHBondContact O-CB 3.27Å; G95-T152 WeakPolarHBondContact O-CG2 3.39Å; G95-T152 PolarHBondContact O-OG1 2.91Å; R149-T152 WeakPolarHBondContact O-CB 3.29Å; R149-T152 PolarHBondContact O-N 3.25Å; T152-R154 VanDerWaalsContact C-N 3.3Å; T152-R154 PolarHBondContact O-N 3.08Å; T152-N155 PolarHBondContact O-N 3.21Å; T152-N155 VanDerWaalsContact O-N 3.11Å; T152-I156 HydrophobicContact CG2-CD1 4.22Å; T152-I156 WeakPolarHBondContact O-CG1 3.46Å; T152-I156 PolarHBondContact O-N 3.36Å |
| 153 | L | 95.4 | Very high | 87.9 | Confident | 27 Ų | 27 | 80.3 Ų | 80.3 | 14% | 0.141 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -57.6 | -45.6 | 177.6 | -174.4 | 60.7 | 0 | 0 | 0 | 111.5 | L96 I132 A136 V148 R149 W150 N155 I156 V157 | L96-L153 HydrophobicContact CD1-CB 3.71Å; L96-L153 HydrophobicContact CD1-CD1 4.16Å; L96-L153 HydrophobicContact CD1-CG 4.46Å; L96-L153 HydrophobicContact CD2-CD1 4.4Å; I132-L153 HydrophobicContact CG2-CD1 3.76Å; A136-L153 HydrophobicContact CB-CD2 4.23Å; V148-L153 HydrophobicContact CG1-CB 4.39Å; V148-L153 HydrophobicContact CG1-CD2 4.13Å; R149-L153 PolarHBondContact O-N 3.11Å; W150-L153 HydrophobicContact CE3-CD2 3.8Å; W150-L153 HydrophobicContact CZ3-CD2 3.68Å; W150-L153 PolarHBondContact O-N 3.46Å; L153-N155 VanDerWaalsContact C-N 3.32Å; L153-N155 PolarHBondContact O-N 2.91Å; L153-I156 WeakPolarHBondContact O-CB 3.23Å; L153-I156 PolarHBondContact O-N 3.4Å; L153-V157 WeakPolarHBondContact O-CG2 3.46Å; L153-V157 PolarHBondContact O-N 2.84Å |
| 154 | R | 95.9 | Very high | 89 | Confident | 144 Ų | 144 | 83.3 Ų | 83.3 | 54% | 0.543 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -59.2 | -44 | 176.1 | -178.1 | -170.7 | 66.6 | -175.8 | 0.7 | 111.3 | W150 I151 T152 I156 V157 I158 | W150-R154 WeakPolarHBondContact O-CB 3.4Å; W150-R154 PolarHBondContact O-N 3.16Å; I151-R154 PolarHBondContact O-N 3.22Å; T152-R154 VanDerWaalsContact C-N 3.3Å; T152-R154 PolarHBondContact O-N 3.08Å; R154-I156 VanDerWaalsContact C-N 3.31Å; R154-I156 PolarHBondContact O-N 2.99Å; R154-V157 PolarHBondContact O-N 3.46Å; R154-I158 HydrophobicContact CG-CD1 3.81Å; R154-I158 HydrophobicContact CG-CG1 4.38Å; R154-I158 WeakPolarHBondContact O-CB 3.44Å; R154-I158 VanDerWaalsContact O-CG1 3.27Å; R154-I158 WeakPolarHBondContact O-CG1 3.49Å; R154-I158 PolarHBondContact O-N 3.18Å |
| 155 | N | 95.8 | Very high | 90.2 | Very high | 85 Ų | 85 | 75.6 Ų | 75.6 | 46% | 0.455 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -64.3 | -37.2 | 178.8 | -67.1 | -6.1 | 0 | 0 | 0 | 111.8 | I151 T152 L153 I158 S159 | I151-N155 PolarHBondContact O-N 3.4Å; I151-N155 PolarHBondContact O-OD1 3.43Å; T152-N155 PolarHBondContact O-N 3.21Å; T152-N155 VanDerWaalsContact O-N 3.11Å; L153-N155 VanDerWaalsContact C-N 3.32Å; L153-N155 PolarHBondContact O-N 2.91Å; N155-I158 PolarHBondContact O-N 2.89Å; N155-S159 WeakPolarHBondContact O-CB 3.38Å; N155-S159 PolarHBondContact O-N 3.37Å |
| 156 | I | 94.4 | Very high | 91.4 | Very high | 21 Ų | 21 | 75.6 Ų | 75.6 | 11% | 0.108 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -62 | -48.9 | 172.9 | -65.8 | 164.8 | 0 | 0 | 0 | 110 | T91 L96 I132 T152 L153 R154 I158 S159 W160 | T91-I156 HydrophobicContact CG2-CD1 4.26Å; T91-I156 HydrophobicContact CG2-CG1 4.42Å; L96-I156 HydrophobicContact CD2-CD1 4.29Å; I132-I156 HydrophobicContact CG2-CG2 4.47Å; T152-I156 HydrophobicContact CG2-CD1 4.22Å; T152-I156 WeakPolarHBondContact O-CG1 3.46Å; T152-I156 PolarHBondContact O-N 3.36Å; L153-I156 WeakPolarHBondContact O-CB 3.23Å; L153-I156 PolarHBondContact O-N 3.4Å; R154-I156 VanDerWaalsContact C-N 3.31Å; R154-I156 PolarHBondContact O-N 2.99Å; I156-I158 VanDerWaalsContact C-N 3.35Å; I156-I158 PolarHBondContact O-N 3.24Å; I156-S159 WeakPolarHBondContact O-CB 3.23Å; I156-S159 PolarHBondContact O-N 3.49Å; I156-S159 VanDerWaalsContact O-N 3.09Å; I156-S159 PolarHBondContact O-OG 3.41Å; I156-W160 HydrophobicContact CG2-CD2 4.24Å; I156-W160 HydrophobicContact CG2-CH2 3.79Å; I156-W160 HydrophobicContact CG2-CZ2 3.32Å; I156-W160 HydrophobicContact CG2-CZ3 4.4Å; I156-W160 PolarHBondContact O-N 3.29Å; I156-W160 VanDerWaalsContact O-N 3.14Å |
| 157 | V | 95.4 | Very high | 92 | Very high | 61 Ų | 61 | 77.2 Ų | 77.2 | 37% | 0.37 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -61.3 | -43.4 | 178.4 | 173.7 | 0 | 0 | 0 | 0 | 111.6 | L153 R154 S159 W160 L161 | L153-V157 WeakPolarHBondContact O-CG2 3.46Å; L153-V157 PolarHBondContact O-N 2.84Å; R154-V157 PolarHBondContact O-N 3.46Å; V157-S159 VanDerWaalsContact C-N 3.29Å; V157-S159 PolarHBondContact O-N 3.37Å; V157-W160 HydrophobicContact CB-CE3 4.44Å; V157-W160 HydrophobicContact CG2-CE3 4.16Å; V157-W160 HydrophobicContact CG2-CZ3 3.95Å; V157-W160 PolarHBondContact O-N 3.06Å; V157-L161 HydrophobicContact CG1-CD1 4.41Å; V157-L161 WeakPolarHBondContact O-CG 3.46Å; V157-L161 PolarHBondContact O-N 3.06Å; V157-L161 VanDerWaalsContact O-N 3.12Å |
| 158 | I | 95.9 | Very high | 91.6 | Very high | 80 Ų | 80 | 79 Ų | 79 | 41% | 0.41 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -60.6 | -40.9 | 175 | -69.5 | 168.6 | 0 | 0 | 0 | 110.3 | R154 N155 I156 W160 L161 V162 | R154-I158 HydrophobicContact CG-CD1 3.81Å; R154-I158 HydrophobicContact CG-CG1 4.38Å; R154-I158 WeakPolarHBondContact O-CB 3.44Å; R154-I158 VanDerWaalsContact O-CG1 3.27Å; R154-I158 WeakPolarHBondContact O-CG1 3.49Å; R154-I158 PolarHBondContact O-N 3.18Å; N155-I158 PolarHBondContact O-N 2.89Å; I156-I158 VanDerWaalsContact C-N 3.35Å; I156-I158 PolarHBondContact O-N 3.24Å; I158-W160 VanDerWaalsContact C-N 3.29Å; I158-W160 PolarHBondContact O-N 2.98Å; I158-L161 PolarHBondContact O-N 2.9Å; I158-V162 HydrophobicContact CG2-CG2 3.9Å; I158-V162 WeakPolarHBondContact O-CB 3.49Å; I158-V162 VanDerWaalsContact O-CG2 3.29Å; I158-V162 WeakPolarHBondContact O-CG2 3.35Å; I158-V162 PolarHBondContact O-N 3.42Å |
| 159 | S | 93.3 | Very high | 89.8 | Confident | 55 Ų | 55 | 86.4 Ų | 86.4 | 39% | 0.385 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -60.1 | -39.1 | 177.9 | 75.7 | 0 | 0 | 0 | 0 | 112.1 | N155 I156 V157 T163 | N155-S159 WeakPolarHBondContact O-CB 3.38Å; N155-S159 PolarHBondContact O-N 3.37Å; I156-S159 WeakPolarHBondContact O-CB 3.23Å; I156-S159 PolarHBondContact O-N 3.49Å; I156-S159 VanDerWaalsContact O-N 3.09Å; I156-S159 PolarHBondContact O-OG 3.41Å; V157-S159 VanDerWaalsContact C-N 3.29Å; V157-S159 PolarHBondContact O-N 3.37Å; S159-T163 WeakPolarHBondContact O-CB 3.35Å; S159-T163 PolarHBondContact O-N 2.74Å; S159-T163 PolarHBondContact O-OG1 3.09Å |
| 160 | W | 92 | Very high | 87.6 | Confident | 75 Ų | 75 | 96.2 Ų | 96.2 | 28% | 0.284 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65.6 | -44.4 | 175.9 | -59.5 | -30.1 | 0 | 0 | 0 | 112 | H129 I132 I156 V157 I158 T163 | H129-W160 AromaticContact CD2-CD2 3.89Å; H129-W160 AromaticContact CD2-CE2 3.7Å; H129-W160 AromaticContact CD2-CE3 3.82Å; H129-W160 AromaticContact CD2-CH2 3.43Å; H129-W160 VanDerWaalsContact CD2-CH2 3.43Å; H129-W160 WeakPolarHBondContact CD2-CH2 3.42Å; H129-W160 AromaticContact CD2-CZ2 3.48Å; H129-W160 VanDerWaalsContact CD2-CZ2 3.48Å; H129-W160 WeakPolarHBondContact CD2-CZ2 3.42Å; H129-W160 AromaticContact CD2-CZ3 3.61Å; H129-W160 AromaticContact NE2-CD2 3.38Å; H129-W160 AromaticContact NE2-CE2 3.62Å; H129-W160 AromaticContact NE2-CE3 3.42Å; H129-W160 AromaticContact NE2-CG 3.94Å; H129-W160 AromaticContact NE2-CH2 3.95Å; H129-W160 AromaticContact NE2-CZ2 3.9Å; H129-W160 AromaticContact NE2-CZ3 3.72Å; I132-W160 HydrophobicContact CB-CH2 4Å; I132-W160 HydrophobicContact CB-CZ2 4.29Å; I132-W160 HydrophobicContact CG1-CH2 4.26Å; I132-W160 HydrophobicContact CG1-CZ2 4.02Å; I132-W160 HydrophobicContact CG2-CH2 3.84Å; I132-W160 HydrophobicContact CG2-CZ2 4.35Å; I156-W160 HydrophobicContact CG2-CD2 4.24Å; I156-W160 HydrophobicContact CG2-CH2 3.79Å; I156-W160 HydrophobicContact CG2-CZ2 3.32Å; I156-W160 HydrophobicContact CG2-CZ3 4.4Å; I156-W160 PolarHBondContact O-N 3.29Å; I156-W160 VanDerWaalsContact O-N 3.14Å; V157-W160 HydrophobicContact CB-CE3 4.44Å; V157-W160 HydrophobicContact CG2-CE3 4.16Å; V157-W160 HydrophobicContact CG2-CZ3 3.95Å; V157-W160 PolarHBondContact O-N 3.06Å; I158-W160 VanDerWaalsContact C-N 3.29Å; I158-W160 PolarHBondContact O-N 2.98Å; W160-T163 PolarHBondContact O-N 3.12Å |
| 161 | L | 93.3 | Very high | 87.4 | Confident | 119 Ų | 119 | 93.3 Ų | 93.3 | 62% | 0.623 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -65.6 | -39.5 | 178.8 | -67 | 177.8 | 0 | 0 | 0 | 112.4 | V157 I158 P165 | V157-L161 HydrophobicContact CG1-CD1 4.41Å; V157-L161 WeakPolarHBondContact O-CG 3.46Å; V157-L161 PolarHBondContact O-N 3.06Å; V157-L161 VanDerWaalsContact O-N 3.12Å; I158-L161 PolarHBondContact O-N 2.9Å; L161-P165 WeakPolarHBondContact O-CD 3.47Å |
| 162 | V | 93.9 | Very high | 87 | Confident | 76 Ų | 76 | 92.3 Ų | 92.3 | 46% | 0.461 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -73.1 | -30.7 | 178.5 | 171.7 | 0 | 0 | 0 | 0 | 111.7 | I158 V164 P165 V166 | I158-V162 HydrophobicContact CG2-CG2 3.9Å; I158-V162 WeakPolarHBondContact O-CB 3.49Å; I158-V162 VanDerWaalsContact O-CG2 3.29Å; I158-V162 WeakPolarHBondContact O-CG2 3.35Å; I158-V162 PolarHBondContact O-N 3.42Å; V162-V164 VanDerWaalsContact C-N 3.28Å; V162-V164 PolarHBondContact O-N 3.37Å; V162-P165 VanDerWaalsContact O-CD 3.23Å; V162-P165 WeakPolarHBondContact O-CD 3.39Å; V162-P165 WeakPolarHBondContact O-CG 3.43Å; V162-V166 HydrophobicContact CG1-CG2 3.94Å; V162-V166 WeakPolarHBondContact O-CB 3.37Å; V162-V166 WeakPolarHBondContact O-CG2 3.33Å; V162-V166 PolarHBondContact O-N 3.35Å |
| 163 | T | 89.2 | Confident | 86.7 | Confident | 86 Ų | 86 | 95.7 Ų | 95.7 | 53% | 0.528 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.2 | -36.7 | 179.3 | -61.9 | 0 | 0 | 0 | 0 | 111.7 | S159 W160 A167 | S159-T163 WeakPolarHBondContact O-CB 3.35Å; S159-T163 PolarHBondContact O-N 2.74Å; S159-T163 PolarHBondContact O-OG1 3.09Å; W160-T163 PolarHBondContact O-N 3.12Å; T163-A167 WeakPolarHBondContact O-CB 3.31Å; T163-A167 PolarHBondContact O-N 2.76Å |
| 164 | V | 88.2 | Confident | 86.2 | Confident | 110 Ų | 110 | 99.8 Ų | 99.8 | 67% | 0.667 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -60 | -58.2 | -179.2 | 177.8 | 0 | 0 | 0 | 0 | 113.5 | V162 V166 A167 G168 | V162-V164 VanDerWaalsContact C-N 3.28Å; V162-V164 PolarHBondContact O-N 3.37Å; V164-V166 PolarHBondContact O-N 3.04Å; V164-A167 PolarHBondContact O-N 3.4Å; V164-G168 PolarHBondContact O-N 2.88Å |
| 165 | P | 88.9 | Confident | 85.6 | Confident | 65 Ų | 65 | 97 Ų | 97 | 42% | 0.422 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -64.6 | -39.6 | 179.1 | 24.6 | -33.1 | 0 | 0 | 0 | 111.9 | L161 V162 A167 G168 E169 | L161-P165 WeakPolarHBondContact O-CD 3.47Å; V162-P165 VanDerWaalsContact O-CD 3.23Å; V162-P165 WeakPolarHBondContact O-CD 3.39Å; V162-P165 WeakPolarHBondContact O-CG 3.43Å; P165-A167 VanDerWaalsContact C-N 3.29Å; P165-A167 PolarHBondContact O-N 3.25Å; P165-G168 PolarHBondContact O-N 2.98Å; P165-G168 VanDerWaalsContact O-N 3.16Å; P165-E169 WeakPolarHBondContact O-CG 3.38Å; P165-E169 PolarHBondContact O-N 3.36Å |
| 166 | V | 89.6 | Confident | 84.9 | Confident | 111 Ų | 111 | 97.8 Ų | 97.8 | 67% | 0.673 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -64.1 | -36.2 | 179.4 | 174.2 | 0 | 0 | 0 | 0 | 111.7 | V162 V164 | V162-V166 HydrophobicContact CG1-CG2 3.94Å; V162-V166 WeakPolarHBondContact O-CB 3.37Å; V162-V166 WeakPolarHBondContact O-CG2 3.33Å; V162-V166 PolarHBondContact O-N 3.35Å; V164-V166 PolarHBondContact O-N 3.04Å |
| 167 | A | 82.4 | Confident | 84.2 | Confident | 79 Ų | 79 | 103.3 Ų | 103.3 | 65% | 0.653 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -77.9 | -26.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | T163 V164 P165 | T163-A167 WeakPolarHBondContact O-CB 3.31Å; T163-A167 PolarHBondContact O-N 2.76Å; V164-A167 PolarHBondContact O-N 3.4Å; P165-A167 VanDerWaalsContact C-N 3.29Å; P165-A167 PolarHBondContact O-N 3.25Å |
| 168 | G | 74.8 | Confident | 83.3 | Confident | 55 Ų | 55 | 106.5 Ų | 106.5 | 57% | 0.567 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -91.2 | -12.8 | -173.6 | 0 | 0 | 0 | 0 | 0 | 116.3 | V164 P165 R170 | V164-G168 PolarHBondContact O-N 2.88Å; P165-G168 PolarHBondContact O-N 2.98Å; P165-G168 VanDerWaalsContact O-N 3.16Å; G168-R170 VanDerWaalsContact C-N 3.26Å; G168-R170 PolarHBondContact O-N 3.05Å; G168-R170 VanDerWaalsContact O-N 3.11Å |
| 169 | E | 55.5 | Low | 82.3 | Confident | 166 Ų | 166 | 108.8 Ų | 108.8 | 78% | 0.776 | 60% | 0.6 | S | S | * | * | trans | -81 | 27.8 | -172.8 | -82.8 | -168.2 | 178.9 | 0 | 0 | 116.2 | P165 | P165-E169 WeakPolarHBondContact O-CG 3.38Å; P165-E169 PolarHBondContact O-N 3.36Å | ||
| 170 | R | 46.7 | Very low | 81.3 | Confident | 308 Ų | 308 | 113.6 Ų | 113.6 | 100% | 1.162 | 62% | 0.62 | S | S | * | * | trans | -142.1 | 0 | 167.9 | -69.1 | -171.5 | -174.8 | 165.8 | 2.5 | 112 | G168 | G168-R170 VanDerWaalsContact C-N 3.26Å; G168-R170 PolarHBondContact O-N 3.05Å; G168-R170 VanDerWaalsContact O-N 3.11Å |
Retrieved 170 of 170 residues in 119.6 ms
(Link to these results)