| 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 | T | 65.1 | Low | 83.3 | Confident | 157 Ų | 157 | 113.4 Ų | 113.4 | 96% | 0.963 | 60% | 0.596 | S | S | * | * | 0 | -59.4 | 0 | 39.2 | 0 | 0 | 0 | 0 | 111 | S3 R4 D5 | T1-S3 PolarHBondContact O-N 3.04Å; T1-S3 VanDerWaalsContact O-N 3.17Å; T1-R4 WeakPolarHBondContact O-CB 3.19Å; T1-R4 PolarHBondContact O-N 2.93Å; T1-D5 PolarHBondContact O-N 2.97Å | |||
| 2 | M | 74.5 | Confident | 83.8 | Confident | 167 Ų | 167 | 110.8 Ų | 110.8 | 82% | 0.823 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -48.6 | -44.9 | -179.5 | -89 | -156.6 | 166.8 | 0 | 0 | 117 | R4 D5 Y6 | M2-R4 PolarHBondContact O-N 3.25Å; M2-D5 PolarHBondContact O-N 3.46Å; M2-Y6 PolarHBondContact O-N 3.49Å; M2-Y6 VanDerWaalsContact O-N 3.09Å |
| 3 | S | 80.1 | Confident | 84.5 | Confident | 96 Ų | 96 | 111.8 Ų | 111.8 | 67% | 0.671 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -64.2 | -28.5 | 179.8 | 174.8 | 0 | 0 | 0 | 0 | 113.4 | T1 S7 | T1-S3 PolarHBondContact O-N 3.04Å; T1-S3 VanDerWaalsContact O-N 3.17Å; S3-S7 PolarHBondContact O-N 2.95Å; S3-S7 PolarHBondContact O-OG 3.07Å |
| 4 | R | 83.2 | Confident | 85 | Confident | 188 Ų | 188 | 113 Ų | 113 | 71% | 0.709 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -77.4 | -40 | -179.7 | -152 | 173.8 | 93 | 122.6 | 1.4 | 110.9 | T1 M2 Y6 S7 L8 | T1-R4 WeakPolarHBondContact O-CB 3.19Å; T1-R4 PolarHBondContact O-N 2.93Å; M2-R4 PolarHBondContact O-N 3.25Å; R4-Y6 VanDerWaalsContact C-N 3.33Å; R4-S7 PolarHBondContact O-N 3.05Å; R4-L8 WeakPolarHBondContact O-CG 3.38Å; R4-L8 PolarHBondContact O-N 3.19Å |
| 5 | D | 83.8 | Confident | 85.5 | Confident | 82 Ų | 82 | 111.7 Ų | 111.7 | 44% | 0.439 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -68.1 | -35.8 | 178.4 | -54.9 | -37.2 | 0 | 0 | 0 | 111.2 | T1 M2 L8 N9 | T1-D5 PolarHBondContact O-N 2.97Å; M2-D5 PolarHBondContact O-N 3.46Å; D5-L8 PolarHBondContact O-N 3.23Å; D5-N9 PolarHBondContact O-N 3.41Å; D5-N9 PolarHBondContact O-ND2 3.43Å |
| 6 | Y | 85.4 | Confident | 85.8 | Confident | 159 Ų | 159 | 111.1 Ų | 111.1 | 62% | 0.624 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -63.3 | -47.5 | 173.3 | -174.7 | -103.9 | 0 | 0 | 0 | 112.4 | M2 R4 L8 N9 L10 | M2-Y6 PolarHBondContact O-N 3.49Å; M2-Y6 VanDerWaalsContact O-N 3.09Å; R4-Y6 VanDerWaalsContact C-N 3.33Å; Y6-L8 VanDerWaalsContact C-N 3.31Å; Y6-L8 PolarHBondContact O-N 2.92Å; Y6-N9 PolarHBondContact O-N 3.35Å; Y6-L10 HydrophobicContact CD1-CD1 3.75Å; Y6-L10 HydrophobicContact CE1-CD1 3.28Å; Y6-L10 HydrophobicContact CE1-CG 4.29Å; Y6-L10 PolarHBondContact O-N 2.96Å |
| 7 | S | 85.5 | Confident | 86.1 | Confident | 68 Ų | 68 | 108.5 Ų | 108.5 | 48% | 0.476 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -63 | -36.2 | 177 | -61.5 | 0 | 0 | 0 | 0 | 112.8 | S3 R4 S11 | S3-S7 PolarHBondContact O-N 2.95Å; S3-S7 PolarHBondContact O-OG 3.07Å; R4-S7 PolarHBondContact O-N 3.05Å; S7-S11 WeakPolarHBondContact O-CB 3.41Å; S7-S11 PolarHBondContact O-N 3.47Å; S7-S11 VanDerWaalsContact O-N 3.07Å |
| 8 | L | 87.3 | Confident | 86.3 | Confident | 94 Ų | 94 | 109.3 Ų | 109.3 | 49% | 0.492 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -65.9 | -44.1 | 174.8 | -72.6 | 171.6 | 0 | 0 | 0 | 111.8 | R4 D5 Y6 L10 S11 V12 | R4-L8 WeakPolarHBondContact O-CG 3.38Å; R4-L8 PolarHBondContact O-N 3.19Å; D5-L8 PolarHBondContact O-N 3.23Å; Y6-L8 VanDerWaalsContact C-N 3.31Å; Y6-L8 PolarHBondContact O-N 2.92Å; L8-L10 PolarHBondContact O-N 3.44Å; L8-S11 PolarHBondContact O-N 2.86Å; L8-V12 WeakPolarHBondContact O-CB 3.5Å; L8-V12 VanDerWaalsContact O-CG2 3.28Å; L8-V12 WeakPolarHBondContact O-CG2 3.4Å; L8-V12 PolarHBondContact O-N 3.11Å |
| 9 | N | 89.4 | Confident | 86.5 | Confident | 99 Ų | 99 | 113.4 Ų | 113.4 | 53% | 0.529 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -61.9 | -42.9 | 177.4 | -83.4 | -74.4 | 0 | 0 | 0 | 112.1 | D5 Y6 V12 Q13 | D5-N9 PolarHBondContact O-N 3.41Å; D5-N9 PolarHBondContact O-ND2 3.43Å; Y6-N9 PolarHBondContact O-N 3.35Å; N9-V12 PolarHBondContact O-N 3.05Å; N9-Q13 WeakPolarHBondContact O-CB 3.27Å; N9-Q13 VanDerWaalsContact O-CG 3.31Å; N9-Q13 WeakPolarHBondContact O-CG 3.28Å; N9-Q13 PolarHBondContact O-N 2.84Å |
| 10 | L | 89.3 | Confident | 86.6 | Confident | 73 Ų | 73 | 111.8 Ų | 111.8 | 38% | 0.382 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -60.9 | -46.6 | 175.2 | -82.8 | 165.6 | 0 | 0 | 0 | 112.2 | Y6 L8 V12 Q13 Q14 | Y6-L10 HydrophobicContact CD1-CD1 3.75Å; Y6-L10 HydrophobicContact CE1-CD1 3.28Å; Y6-L10 HydrophobicContact CE1-CG 4.29Å; Y6-L10 PolarHBondContact O-N 2.96Å; L8-L10 PolarHBondContact O-N 3.44Å; L10-V12 PolarHBondContact O-N 3.47Å; L10-Q13 PolarHBondContact O-N 3.31Å; L10-Q14 PolarHBondContact O-N 2.95Å |
| 11 | S | 92.5 | Very high | 86.6 | Confident | 64 Ų | 64 | 112.2 Ų | 112.2 | 45% | 0.448 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -62 | -43.8 | 178.9 | 179.8 | 0 | 0 | 0 | 0 | 112.1 | S7 L8 Q14 V15 | S7-S11 WeakPolarHBondContact O-CB 3.41Å; S7-S11 PolarHBondContact O-N 3.47Å; S7-S11 VanDerWaalsContact O-N 3.07Å; L8-S11 PolarHBondContact O-N 2.86Å; S11-Q14 WeakPolarHBondContact O-CB 3.3Å; S11-Q14 PolarHBondContact O-N 2.75Å; S11-V15 WeakPolarHBondContact O-CG2 3.37Å; S11-V15 PolarHBondContact O-N 3.36Å |
| 12 | V | 89.9 | Confident | 87.4 | Confident | 82 Ų | 82 | 106 Ų | 106 | 50% | 0.497 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -62 | -44.9 | 176.1 | 170.6 | 0 | 0 | 0 | 0 | 110.7 | L8 N9 L10 Q14 V15 L16 | L8-V12 WeakPolarHBondContact O-CB 3.5Å; L8-V12 VanDerWaalsContact O-CG2 3.28Å; L8-V12 WeakPolarHBondContact O-CG2 3.4Å; L8-V12 PolarHBondContact O-N 3.11Å; N9-V12 PolarHBondContact O-N 3.05Å; L10-V12 PolarHBondContact O-N 3.47Å; V12-Q14 VanDerWaalsContact C-N 3.29Å; V12-Q14 PolarHBondContact O-N 2.95Å; V12-V15 PolarHBondContact O-N 3.45Å; V12-L16 HydrophobicContact CG1-CD1 3.81Å; V12-L16 HydrophobicContact CG1-CG 4.33Å; V12-L16 WeakPolarHBondContact O-CB 3.21Å; V12-L16 VanDerWaalsContact O-CG 3.27Å; V12-L16 WeakPolarHBondContact O-CG 3.36Å; V12-L16 PolarHBondContact O-N 3.31Å |
| 13 | Q | 91.9 | Very high | 87.8 | Confident | 125 Ų | 125 | 99.7 Ų | 99.7 | 58% | 0.584 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -60.5 | -38.8 | 174.8 | -76.2 | -178.8 | -12.7 | 0 | 0 | 112.2 | N9 L10 L16 S17 | N9-Q13 WeakPolarHBondContact O-CB 3.27Å; N9-Q13 VanDerWaalsContact O-CG 3.31Å; N9-Q13 WeakPolarHBondContact O-CG 3.28Å; N9-Q13 PolarHBondContact O-N 2.84Å; L10-Q13 PolarHBondContact O-N 3.31Å; Q13-L16 PolarHBondContact O-N 3.43Å; Q13-S17 VanDerWaalsContact O-CB 3.25Å; Q13-S17 WeakPolarHBondContact O-CB 3.35Å; Q13-S17 PolarHBondContact O-N 3.27Å; Q13-S17 PolarHBondContact O-OG 3.23Å |
| 14 | Q | 92.8 | Very high | 87.8 | Confident | 128 Ų | 128 | 98 Ų | 98 | 60% | 0.598 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -63.9 | -47.1 | 177.3 | -127.5 | 169.8 | -49.4 | 0 | 0 | 111.5 | L10 S11 V12 S17 L18 | L10-Q14 PolarHBondContact O-N 2.95Å; S11-Q14 WeakPolarHBondContact O-CB 3.3Å; S11-Q14 PolarHBondContact O-N 2.75Å; V12-Q14 VanDerWaalsContact C-N 3.29Å; V12-Q14 PolarHBondContact O-N 2.95Å; Q14-S17 WeakPolarHBondContact CA-OG 3.23Å; Q14-S17 PolarHBondContact O-N 3.09Å; Q14-S17 PolarHBondContact O-OG 3Å; Q14-L18 WeakPolarHBondContact O-CG 3.42Å; Q14-L18 PolarHBondContact O-N 3.35Å |
| 15 | V | 91.4 | Very high | 87.6 | Confident | 94 Ų | 94 | 92 Ų | 92 | 57% | 0.57 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -62.9 | -43.8 | 177 | 174.2 | 0 | 0 | 0 | 0 | 111.1 | S11 V12 L18 W19 | S11-V15 WeakPolarHBondContact O-CG2 3.37Å; S11-V15 PolarHBondContact O-N 3.36Å; V12-V15 PolarHBondContact O-N 3.45Å; V15-L18 PolarHBondContact O-N 2.91Å; V15-W19 WeakPolarHBondContact O-CB 3.41Å; V15-W19 PolarHBondContact O-N 2.88Å |
| 16 | L | 91.3 | Very high | 87.6 | Confident | 101 Ų | 101 | 95.6 Ų | 95.6 | 53% | 0.529 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.5 | -42.9 | 175.8 | -71.8 | 172 | 0 | 0 | 0 | 111.5 | V12 Q13 L18 W19 V20 | V12-L16 HydrophobicContact CG1-CD1 3.81Å; V12-L16 HydrophobicContact CG1-CG 4.33Å; V12-L16 WeakPolarHBondContact O-CB 3.21Å; V12-L16 VanDerWaalsContact O-CG 3.27Å; V12-L16 WeakPolarHBondContact O-CG 3.36Å; V12-L16 PolarHBondContact O-N 3.31Å; Q13-L16 PolarHBondContact O-N 3.43Å; L16-L18 PolarHBondContact O-N 3.39Å; L16-W19 PolarHBondContact O-N 3.5Å; L16-V20 WeakPolarHBondContact O-CG2 3.41Å; L16-V20 PolarHBondContact O-N 3.01Å |
| 17 | S | 90 | Very high | 87.4 | Confident | 67 Ų | 67 | 93.3 Ų | 93.3 | 47% | 0.469 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.1 | -41.3 | 178.1 | 75.1 | 0 | 0 | 0 | 0 | 111.9 | Q13 Q14 W19 V20 H21 | Q13-S17 VanDerWaalsContact O-CB 3.25Å; Q13-S17 WeakPolarHBondContact O-CB 3.35Å; Q13-S17 PolarHBondContact O-N 3.27Å; Q13-S17 PolarHBondContact O-OG 3.23Å; Q14-S17 WeakPolarHBondContact CA-OG 3.23Å; Q14-S17 PolarHBondContact O-N 3.09Å; Q14-S17 PolarHBondContact O-OG 3Å; S17-W19 VanDerWaalsContact C-N 3.34Å; S17-W19 PolarHBondContact O-N 3.05Å; S17-V20 PolarHBondContact O-N 2.94Å; S17-H21 WeakPolarHBondContact O-CB 3.43Å; S17-H21 PolarHBondContact O-N 2.96Å |
| 18 | L | 90 | Very high | 87.3 | Confident | 124 Ų | 124 | 95.7 Ų | 95.7 | 65% | 0.649 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -65 | -38.8 | 175.7 | -75.5 | 169.8 | 0 | 0 | 0 | 111.7 | Q14 V15 L16 G22 | Q14-L18 WeakPolarHBondContact O-CG 3.42Å; Q14-L18 PolarHBondContact O-N 3.35Å; V15-L18 PolarHBondContact O-N 2.91Å; L16-L18 PolarHBondContact O-N 3.39Å; L18-G22 PolarHBondContact O-N 2.93Å |
| 19 | W | 90.3 | Very high | 87.2 | Confident | 187 Ų | 187 | 92.3 Ų | 92.3 | 71% | 0.708 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -66 | -49.1 | 177 | -175.8 | 88.4 | 0 | 0 | 0 | 111.6 | V15 L16 S17 H21 G22 A23 | V15-W19 WeakPolarHBondContact O-CB 3.41Å; V15-W19 PolarHBondContact O-N 2.88Å; L16-W19 PolarHBondContact O-N 3.5Å; S17-W19 VanDerWaalsContact C-N 3.34Å; S17-W19 PolarHBondContact O-N 3.05Å; W19-H21 PolarHBondContact O-N 2.8Å; W19-G22 PolarHBondContact O-N 3.03Å; W19-A23 PolarHBondContact O-N 2.9Å |
| 20 | V | 88.1 | Confident | 87.2 | Confident | 80 Ų | 80 | 89.7 Ų | 89.7 | 49% | 0.485 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -61 | -45.8 | 177.1 | 171.9 | 0 | 0 | 0 | 0 | 110.7 | L16 S17 G22 A23 T24 | L16-V20 WeakPolarHBondContact O-CG2 3.41Å; L16-V20 PolarHBondContact O-N 3.01Å; S17-V20 PolarHBondContact O-N 2.94Å; V20-G22 VanDerWaalsContact C-N 3.34Å; V20-G22 PolarHBondContact O-N 2.79Å; V20-A23 PolarHBondContact O-N 3.48Å; V20-T24 PolarHBondContact O-N 2.86Å; V20-T24 PolarHBondContact O-OG1 2.64Å |
| 21 | H | 85.8 | Confident | 87.3 | Confident | 121 Ų | 121 | 91.4 Ų | 91.4 | 56% | 0.56 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -63.2 | -42.2 | 178 | -159.4 | 78 | 0 | 0 | 0 | 111.1 | S17 W19 A23 T24 L25 | S17-H21 WeakPolarHBondContact O-CB 3.43Å; S17-H21 PolarHBondContact O-N 2.96Å; W19-H21 PolarHBondContact O-N 2.8Å; H21-A23 PolarHBondContact O-N 3.49Å; H21-T24 PolarHBondContact O-N 3.5Å; H21-L25 WeakPolarHBondContact O-CB 3.39Å; H21-L25 WeakPolarHBondContact O-CG 3.3Å; H21-L25 PolarHBondContact O-N 2.85Å |
| 22 | G | 82.4 | Confident | 87.5 | Confident | 28 Ų | 28 | 89.4 Ų | 89.4 | 29% | 0.289 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -63.1 | -39.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 114 | L18 W19 V20 K26 | L18-G22 PolarHBondContact O-N 2.93Å; W19-G22 PolarHBondContact O-N 3.03Å; V20-G22 VanDerWaalsContact C-N 3.34Å; V20-G22 PolarHBondContact O-N 2.79Å; G22-K26 WeakPolarHBondContact O-CG 3.34Å; G22-K26 PolarHBondContact O-N 3.29Å; G22-K26 VanDerWaalsContact O-N 3.15Å |
| 23 | A | 83.1 | Confident | 87.8 | Confident | 34 Ų | 34 | 88.4 Ų | 88.4 | 28% | 0.281 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -64.5 | -50.4 | 175 | 0 | 0 | 0 | 0 | 0 | 111 | W19 V20 H21 L25 K26 D27 | W19-A23 PolarHBondContact O-N 2.9Å; V20-A23 PolarHBondContact O-N 3.48Å; H21-A23 PolarHBondContact O-N 3.49Å; A23-L25 VanDerWaalsContact C-N 3.29Å; A23-L25 PolarHBondContact O-N 2.88Å; A23-K26 WeakPolarHBondContact O-CB 3.44Å; A23-K26 PolarHBondContact O-N 2.98Å; A23-D27 PolarHBondContact O-N 3.33Å; A23-D27 VanDerWaalsContact O-N 3.07Å |
| 24 | T | 80 | Confident | 88 | Confident | 60 Ų | 60 | 88 Ų | 88 | 37% | 0.368 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -58.6 | -41 | 179.1 | -44.6 | 0 | 0 | 0 | 0 | 111.8 | V20 H21 K26 D27 F28 | V20-T24 PolarHBondContact O-N 2.86Å; V20-T24 PolarHBondContact O-OG1 2.64Å; H21-T24 PolarHBondContact O-N 3.5Å; T24-K26 PolarHBondContact O-N 3.36Å; T24-D27 PolarHBondContact O-N 3.4Å; T24-F28 HydrophobicContact CG2-CD2 3.89Å; T24-F28 HydrophobicContact CG2-CE2 3.38Å; T24-F28 HydrophobicContact CG2-CZ 4.05Å; T24-F28 VanDerWaalsContact O-CD2 3.27Å; T24-F28 WeakPolarHBondContact O-CD2 3.24Å; T24-F28 PolarHBondContact O-N 2.75Å; T24-F28 VanDerWaalsContact O-N 3.09Å |
| 25 | L | 79.6 | Confident | 88.2 | Confident | 63 Ų | 63 | 87.4 Ų | 87.4 | 33% | 0.33 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -65.2 | -37.8 | 176.6 | -73.5 | 173.8 | 0 | 0 | 0 | 112.7 | H21 A23 T29 R96 | H21-L25 WeakPolarHBondContact O-CB 3.39Å; H21-L25 WeakPolarHBondContact O-CG 3.3Å; H21-L25 PolarHBondContact O-N 2.85Å; A23-L25 VanDerWaalsContact C-N 3.29Å; A23-L25 PolarHBondContact O-N 2.88Å; L25-T29 VanDerWaalsContact O-CB 3.31Å; L25-T29 WeakPolarHBondContact O-CB 3.34Å; L25-T29 PolarHBondContact O-N 3.1Å; L25-T29 PolarHBondContact O-OG1 3.27Å; L25-R96 HydrophobicContact CD2-CG 4.25Å |
| 26 | K | 82.7 | Confident | 88.5 | Confident | 156 Ų | 156 | 82.9 Ų | 82.9 | 68% | 0.678 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -64.8 | -43.5 | 176.5 | -77.3 | 175.2 | 178.8 | 178 | 0 | 110.8 | G22 A23 T24 T29 A30 | G22-K26 WeakPolarHBondContact O-CG 3.34Å; G22-K26 PolarHBondContact O-N 3.29Å; G22-K26 VanDerWaalsContact O-N 3.15Å; A23-K26 WeakPolarHBondContact O-CB 3.44Å; A23-K26 PolarHBondContact O-N 2.98Å; T24-K26 PolarHBondContact O-N 3.36Å; K26-T29 PolarHBondContact O-N 2.98Å; K26-A30 WeakPolarHBondContact O-CB 3.39Å; K26-A30 PolarHBondContact O-N 3.05Å |
| 27 | D | 82.5 | Confident | 88.8 | Confident | 112 Ų | 112 | 79.5 Ų | 79.5 | 60% | 0.599 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -64.9 | -48.6 | -178.8 | -66 | -23.1 | 0 | 0 | 0 | 111.6 | A23 T24 T29 A30 E31 | A23-D27 PolarHBondContact O-N 3.33Å; A23-D27 VanDerWaalsContact O-N 3.07Å; T24-D27 PolarHBondContact O-N 3.4Å; D27-T29 PolarHBondContact O-N 3.32Å; D27-A30 WeakPolarHBondContact O-CB 3.48Å; D27-A30 PolarHBondContact O-N 2.99Å; D27-E31 PolarHBondContact O-N 3.21Å |
| 28 | F | 82.6 | Confident | 89.1 | Confident | 117 Ų | 117 | 79.2 Ų | 79.2 | 51% | 0.513 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -62.7 | -43.3 | 176.3 | -70.1 | -43.9 | 0 | 0 | 0 | 112.8 | T24 A30 E31 M32 | T24-F28 HydrophobicContact CG2-CD2 3.89Å; T24-F28 HydrophobicContact CG2-CE2 3.38Å; T24-F28 HydrophobicContact CG2-CZ 4.05Å; T24-F28 VanDerWaalsContact O-CD2 3.27Å; T24-F28 WeakPolarHBondContact O-CD2 3.24Å; T24-F28 PolarHBondContact O-N 2.75Å; T24-F28 VanDerWaalsContact O-N 3.09Å; F28-A30 VanDerWaalsContact C-N 3.27Å; F28-A30 PolarHBondContact O-N 3.4Å; F28-E31 PolarHBondContact O-N 2.93Å; F28-M32 WeakPolarHBondContact O-CB 3.32Å; F28-M32 WeakPolarHBondContact O-CG 3.2Å; F28-M32 PolarHBondContact O-N 3.48Å |
| 29 | T | 85.4 | Confident | 89.5 | Confident | 24 Ų | 24 | 77.4 Ų | 77.4 | 15% | 0.147 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -61.4 | -43.5 | 177.3 | -52.9 | 0 | 0 | 0 | 0 | 110 | L25 K26 D27 M32 W33 A92 R96 | L25-T29 VanDerWaalsContact O-CB 3.31Å; L25-T29 WeakPolarHBondContact O-CB 3.34Å; L25-T29 PolarHBondContact O-N 3.1Å; L25-T29 PolarHBondContact O-OG1 3.27Å; K26-T29 PolarHBondContact O-N 2.98Å; D27-T29 PolarHBondContact O-N 3.32Å; T29-M32 PolarHBondContact O-N 2.84Å; T29-W33 PolarHBondContact O-N 3.27Å; T29-W33 VanDerWaalsContact O-N 3.07Å; T29-A92 HydrophobicContact CG2-CB 4.07Å; T29-R96 VanDerWaalsContact OG1-CD 3.31Å; T29-R96 WeakPolarHBondContact OG1-CD 3.23Å |
| 30 | A | 89.4 | Confident | 89.8 | Confident | 44 Ų | 44 | 68.8 Ų | 68.8 | 36% | 0.364 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -58.7 | -47.1 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | K26 D27 F28 W33 Y34 | K26-A30 WeakPolarHBondContact O-CB 3.39Å; K26-A30 PolarHBondContact O-N 3.05Å; D27-A30 WeakPolarHBondContact O-CB 3.48Å; D27-A30 PolarHBondContact O-N 2.99Å; F28-A30 VanDerWaalsContact C-N 3.27Å; F28-A30 PolarHBondContact O-N 3.4Å; A30-W33 VanDerWaalsContact CA-CD1 3.42Å; A30-W33 PolarHBondContact O-NE1 3.42Å; A30-Y34 VanDerWaalsContact O-CB 3.24Å; A30-Y34 WeakPolarHBondContact O-CB 3.43Å; A30-Y34 PolarHBondContact O-N 3.19Å |
| 31 | E | 92.3 | Very high | 90.3 | Very high | 109 Ų | 109 | 67.5 Ų | 67.5 | 51% | 0.509 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -62 | -46.1 | 177.5 | -172.4 | 177.3 | 166.3 | 0 | 0 | 111.6 | D27 F28 Y34 W35 | D27-E31 PolarHBondContact O-N 3.21Å; F28-E31 PolarHBondContact O-N 2.93Å; E31-Y34 WeakPolarHBondContact O-CB 3.23Å; E31-Y34 PolarHBondContact O-N 3.33Å; E31-W35 PolarHBondContact O-N 3.49Å; E31-W35 VanDerWaalsContact O-N 3.1Å |
| 32 | M | 95.4 | Very high | 90.8 | Very high | 21 Ų | 21 | 68 Ų | 68 | 10% | 0.103 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -67.9 | -47 | -175 | -68.9 | 168.3 | 62.7 | 0 | 0 | 113.5 | F28 T29 Y34 W35 V36 A92 Y95 M102 | F28-M32 WeakPolarHBondContact O-CB 3.32Å; F28-M32 WeakPolarHBondContact O-CG 3.2Å; F28-M32 PolarHBondContact O-N 3.48Å; T29-M32 PolarHBondContact O-N 2.84Å; M32-Y34 PolarHBondContact O-N 2.78Å; M32-W35 PolarHBondContact O-N 3.38Å; M32-V36 WeakPolarHBondContact O-CG2 3.38Å; M32-V36 PolarHBondContact O-N 2.87Å; M32-A92 HydrophobicContact CB-CB 3.91Å; M32-Y95 HydrophobicContact CE-CD1 3.78Å; M32-Y95 HydrophobicContact CE-CG 3.66Å; M32-M102 HydrophobicContact CE-CB 3.63Å; M32-M102 HydrophobicContact CE-CE 4.28Å; M32-M102 HydrophobicContact CG-CB 4.18Å |
| 33 | W | 95.9 | Very high | 91.5 | Very high | 62 Ų | 62 | 67.4 Ų | 67.4 | 24% | 0.235 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -66.8 | -32.2 | 179.2 | 82.4 | -94.1 | 0 | 0 | 0 | 111 | T29 A30 F37 V85 S88 K89 A92 | T29-W33 PolarHBondContact O-N 3.27Å; T29-W33 VanDerWaalsContact O-N 3.07Å; A30-W33 VanDerWaalsContact CA-CD1 3.42Å; A30-W33 PolarHBondContact O-NE1 3.42Å; W33-F37 HydrophobicContact CE3-CB 4.08Å; W33-F37 HydrophobicContact CZ3-CB 4.2Å; W33-F37 HydrophobicContact CZ3-CD1 4.37Å; W33-F37 HydrophobicContact CZ3-CG 4.16Å; W33-F37 WeakPolarHBondContact O-CB 3.45Å; W33-F37 PolarHBondContact O-N 3.46Å; W33-V85 HydrophobicContact CZ3-CG1 4.1Å; W33-S88 WeakPolarHBondContact CB-O 3.29Å; W33-S88 WeakPolarHBondContact O-CB 3.36Å; W33-K89 HydrophobicContact CB-CG 4.14Å; W33-K89 HydrophobicContact CD2-CG 3.79Å; W33-K89 HydrophobicContact CE3-CG 3.94Å; W33-K89 HydrophobicContact CG-CG 3.86Å; W33-A92 HydrophobicContact CB-CB 3.61Å |
| 34 | Y | 96.1 | Very high | 92.1 | Very high | 115 Ų | 115 | 66 Ų | 66 | 45% | 0.451 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -63.2 | -46.3 | 177 | 178.5 | -99.3 | 0 | 0 | 0 | 111.4 | A30 E31 M32 V36 F37 L38 | A30-Y34 VanDerWaalsContact O-CB 3.24Å; A30-Y34 WeakPolarHBondContact O-CB 3.43Å; A30-Y34 PolarHBondContact O-N 3.19Å; E31-Y34 WeakPolarHBondContact O-CB 3.23Å; E31-Y34 PolarHBondContact O-N 3.33Å; M32-Y34 PolarHBondContact O-N 2.78Å; Y34-V36 PolarHBondContact O-N 3.26Å; Y34-F37 PolarHBondContact O-N 3.37Å; Y34-L38 HydrophobicContact CE1-CD2 4.2Å; Y34-L38 VanDerWaalsContact O-CB 3.31Å; Y34-L38 WeakPolarHBondContact O-CB 3.1Å; Y34-L38 PolarHBondContact O-N 2.99Å |
| 35 | W | 97.3 | Very high | 92.9 | Very high | 116 Ų | 116 | 68 Ų | 68 | 44% | 0.439 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -62.5 | -44 | 178.1 | -75.7 | 118.1 | 0 | 0 | 0 | 113.1 | E31 M32 F37 L38 W39 A107 | E31-W35 PolarHBondContact O-N 3.49Å; E31-W35 VanDerWaalsContact O-N 3.1Å; M32-W35 PolarHBondContact O-N 3.38Å; W35-F37 VanDerWaalsContact C-N 3.35Å; W35-L38 HydrophobicContact CE3-CD2 4.13Å; W35-L38 HydrophobicContact CZ3-CD2 3.99Å; W35-L38 PolarHBondContact O-N 3.45Å; W35-W39 PolarHBondContact O-N 2.92Å; W35-A107 HydrophobicContact CB-CB 3.91Å |
| 36 | V | 97.9 | Very high | 93.7 | Very high | 0 Ų | 0 | 72 Ų | 72 | 0% | 0 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -61 | -47.1 | 175.2 | 178.4 | 0 | 0 | 0 | 0 | 110.7 | M32 Y34 L38 W39 C40 S88 V91 M102 A107 F110 G111 | M32-V36 WeakPolarHBondContact O-CG2 3.38Å; M32-V36 PolarHBondContact O-N 2.87Å; Y34-V36 PolarHBondContact O-N 3.26Å; V36-L38 VanDerWaalsContact C-N 3.32Å; V36-L38 PolarHBondContact O-N 2.95Å; V36-W39 PolarHBondContact O-N 3.08Å; V36-C40 PolarHBondContact O-N 3.22Å; V36-S88 WeakPolarHBondContact CG1-OG 3.42Å; V36-V91 HydrophobicContact CG2-CG1 4.42Å; V36-M102 HydrophobicContact CG2-CE 3.76Å; V36-M102 HydrophobicContact CG2-SD 3.44Å; V36-M102 WeakPolarHBondContact CG2-SD 3.39Å; V36-A107 HydrophobicContact CG2-CB 4.23Å; V36-F110 HydrophobicContact CG1-CB 3.72Å; V36-F110 HydrophobicContact CG2-CB 4.26Å; V36-G111 WeakPolarHBondContact O-CA 3.39Å |
| 37 | F | 97.4 | Very high | 94.3 | Very high | 30 Ų | 30 | 67.2 Ų | 67.2 | 13% | 0.132 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -61.8 | -40.4 | 179.7 | 172 | -104.2 | 0 | 0 | 0 | 111.9 | W33 Y34 W35 C40 L41 L81 A84 V85 S88 | W33-F37 HydrophobicContact CE3-CB 4.08Å; W33-F37 HydrophobicContact CZ3-CB 4.2Å; W33-F37 HydrophobicContact CZ3-CD1 4.37Å; W33-F37 HydrophobicContact CZ3-CG 4.16Å; W33-F37 WeakPolarHBondContact O-CB 3.45Å; W33-F37 PolarHBondContact O-N 3.46Å; Y34-F37 PolarHBondContact O-N 3.37Å; W35-F37 VanDerWaalsContact C-N 3.35Å; F37-C40 WeakPolarHBondContact O-CB 3.28Å; F37-C40 PolarHBondContact O-N 3.19Å; F37-L41 HydrophobicContact CE1-CD2 4.37Å; F37-L41 WeakPolarHBondContact O-CB 3.31Å; F37-L41 PolarHBondContact O-N 3.05Å; F37-L81 HydrophobicContact CE2-CD1 3.49Å; F37-L81 VanDerWaalsContact CE2-CD1 3.49Å; F37-L81 HydrophobicContact CE2-CG 4.19Å; F37-L81 HydrophobicContact CZ-CD1 3.51Å; F37-L81 HydrophobicContact CZ-CG 4.25Å; F37-A84 HydrophobicContact CD2-CB 4.22Å; F37-A84 HydrophobicContact CE2-CB 4.4Å; F37-V85 HydrophobicContact CD2-CG2 3.79Å; F37-V85 HydrophobicContact CE2-CB 4.43Å; F37-V85 HydrophobicContact CE2-CG2 3.31Å; F37-V85 HydrophobicContact CZ-CG2 3.91Å; F37-S88 WeakPolarHBondContact CA-OG 3.41Å; F37-S88 PolarHBondContact N-OG 2.81Å |
| 38 | L | 97.3 | Very high | 94.9 | Very high | 61 Ų | 61 | 63.9 Ų | 63.9 | 32% | 0.319 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -64.2 | -43.5 | -179.1 | -171.2 | 66.8 | 0 | 0 | 0 | 111.7 | Y34 W35 V36 L41 F42 | Y34-L38 HydrophobicContact CE1-CD2 4.2Å; Y34-L38 VanDerWaalsContact O-CB 3.31Å; Y34-L38 WeakPolarHBondContact O-CB 3.1Å; Y34-L38 PolarHBondContact O-N 2.99Å; W35-L38 HydrophobicContact CE3-CD2 4.13Å; W35-L38 HydrophobicContact CZ3-CD2 3.99Å; W35-L38 PolarHBondContact O-N 3.45Å; V36-L38 VanDerWaalsContact C-N 3.32Å; V36-L38 PolarHBondContact O-N 2.95Å; L38-L41 PolarHBondContact O-N 3.41Å; L38-F42 WeakPolarHBondContact O-CB 3.44Å; L38-F42 PolarHBondContact O-N 2.91Å |
| 39 | W | 98 | Very high | 95.5 | Very high | 85 Ų | 85 | 60.2 Ų | 60.2 | 32% | 0.322 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -64.8 | -40.6 | 174.5 | -75.6 | 117.2 | 0 | 0 | 0 | 112.1 | W35 V36 F42 S43 L108 | W35-W39 PolarHBondContact O-N 2.92Å; V36-W39 PolarHBondContact O-N 3.08Å; W39-F42 PolarHBondContact O-N 3.28Å; W39-S43 PolarHBondContact O-N 2.93Å; W39-S43 PolarHBondContact O-OG 2.91Å; W39-L108 HydrophobicContact CD2-CB 4.09Å; W39-L108 HydrophobicContact CD2-CD1 4.21Å; W39-L108 HydrophobicContact CD2-CG 4.13Å; W39-L108 HydrophobicContact CE3-CD1 4.15Å; W39-L108 HydrophobicContact CE3-CG 4.3Å; W39-L108 HydrophobicContact CG-CB 4.11Å; W39-L108 HydrophobicContact CG-CG 4.48Å; W39-L108 HydrophobicContact CH2-CD1 3.99Å; W39-L108 HydrophobicContact CZ2-CD1 4.03Å; W39-L108 HydrophobicContact CZ3-CD1 4.05Å |
| 40 | C | 97.4 | Very high | 96 | Very high | 6 Ų | 6 | 61.6 Ų | 61.6 | 4% | 0.041 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -62.4 | -42.8 | 173.9 | -171.3 | 0 | 0 | 0 | 0 | 112.2 | V36 F37 S43 S44 A84 G111 Q114 T115 | V36-C40 PolarHBondContact O-N 3.22Å; F37-C40 WeakPolarHBondContact O-CB 3.28Å; F37-C40 PolarHBondContact O-N 3.19Å; C40-S43 PolarHBondContact O-OG 2.82Å; C40-S43 VanDerWaalsContact O-OG 3.1Å; C40-S44 WeakPolarHBondContact O-CB 3.44Å; C40-S44 PolarHBondContact O-N 2.88Å; C40-A84 HydrophobicContact CB-CB 4.31Å; C40-A84 WeakPolarHBondContact SG-CB 3.45Å; C40-G111 WeakPolarHBondContact CA-O 3.4Å; C40-G111 WeakPolarHBondContact CB-O 3.32Å; C40-Q114 PolarHBondContact SG-OE1 3.17Å; C40-Q114 VanDerWaalsContact SG-OE1 3.33Å; C40-T115 PolarHBondContact O-OG1 2.89Å |
| 41 | L | 97 | Very high | 96.2 | Very high | 53 Ų | 53 | 61.4 Ų | 61.4 | 28% | 0.277 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -60.9 | -47.3 | 176.9 | 174.1 | 63.7 | 0 | 0 | 0 | 110.7 | F37 L38 S44 L45 F77 L81 | F37-L41 HydrophobicContact CE1-CD2 4.37Å; F37-L41 WeakPolarHBondContact O-CB 3.31Å; F37-L41 PolarHBondContact O-N 3.05Å; L38-L41 PolarHBondContact O-N 3.41Å; L41-S44 PolarHBondContact O-N 3.49Å; L41-L45 VanDerWaalsContact O-CB 3.24Å; L41-L45 WeakPolarHBondContact O-CB 3.41Å; L41-L45 PolarHBondContact O-N 3.43Å; L41-F77 HydrophobicContact CD1-CE2 4.4Å; L41-F77 HydrophobicContact CD1-CZ 3.74Å; L41-L81 HydrophobicContact CD1-CD1 3.71Å |
| 42 | F | 97.3 | Very high | 96.3 | Very high | 132 Ų | 132 | 56.5 Ų | 56.5 | 58% | 0.579 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -61.7 | -49.8 | 178.8 | -179.9 | -101 | 0 | 0 | 0 | 111.9 | L38 W39 S44 L45 F46 | L38-F42 WeakPolarHBondContact O-CB 3.44Å; L38-F42 PolarHBondContact O-N 2.91Å; W39-F42 PolarHBondContact O-N 3.28Å; F42-S44 PolarHBondContact O-N 3.35Å; F42-L45 PolarHBondContact O-N 2.94Å; F42-F46 PolarHBondContact O-N 3.38Å |
| 43 | S | 97.6 | Very high | 96.3 | Very high | 15 Ų | 15 | 60.9 Ų | 60.9 | 11% | 0.105 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -65.3 | -40.4 | 178.6 | 53.3 | 0 | 0 | 0 | 0 | 112.5 | W39 C40 F46 V47 T115 | W39-S43 PolarHBondContact O-N 2.93Å; W39-S43 PolarHBondContact O-OG 2.91Å; C40-S43 PolarHBondContact O-OG 2.82Å; C40-S43 VanDerWaalsContact O-OG 3.1Å; S43-F46 PolarHBondContact O-N 3.28Å; S43-V47 WeakPolarHBondContact O-CG2 3.48Å; S43-V47 PolarHBondContact O-N 3.41Å; S43-T115 WeakPolarHBondContact OG-CB 3.29Å; S43-T115 PolarHBondContact OG-OG1 3.49Å |
| 44 | S | 96 | Very high | 96.3 | Very high | 5 Ų | 5 | 63 Ų | 63 | 4% | 0.035 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -65.1 | -41 | 177.6 | -178.6 | 0 | 0 | 0 | 0 | 111.7 | C40 L41 F42 F46 V47 H48 | C40-S44 WeakPolarHBondContact O-CB 3.44Å; C40-S44 PolarHBondContact O-N 2.88Å; L41-S44 PolarHBondContact O-N 3.49Å; F42-S44 PolarHBondContact O-N 3.35Å; S44-F46 VanDerWaalsContact C-N 3.33Å; S44-V47 PolarHBondContact O-N 3.26Å; S44-H48 WeakPolarHBondContact O-CB 3.35Å; S44-H48 PolarHBondContact O-N 2.95Å; S44-H48 PolarHBondContact O-ND1 3.32Å; S44-H48 PolarHBondContact OG-CE1 3Å; S44-H48 PolarHBondContact OG-ND1 3.48Å |
| 45 | L | 96.1 | Very high | 96.2 | Very high | 101 Ų | 101 | 60.2 Ų | 60.2 | 53% | 0.529 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -63.4 | -41.2 | 175.6 | -176.6 | 65.8 | 0 | 0 | 0 | 111.1 | L41 F42 G49 F77 | L41-L45 VanDerWaalsContact O-CB 3.24Å; L41-L45 WeakPolarHBondContact O-CB 3.41Å; L41-L45 PolarHBondContact O-N 3.43Å; F42-L45 PolarHBondContact O-N 2.94Å; L45-G49 VanDerWaalsContact O-CA 3.3Å; L45-G49 WeakPolarHBondContact O-CA 3.31Å; L45-G49 PolarHBondContact O-N 3.32Å; L45-F77 HydrophobicContact CB-CE2 4.28Å; L45-F77 HydrophobicContact CD1-CE2 4.41Å; L45-F77 HydrophobicContact CD1-CZ 4.3Å |
| 46 | F | 96.6 | Very high | 96 | Very high | 148 Ų | 148 | 57.1 Ų | 57.1 | 65% | 0.649 | 31% | 0.311 | S | S | * | . | H | α-helix | trans | -60.5 | -48.6 | 175.3 | -176.5 | -96.9 | 0 | 0 | 0 | 111.6 | F42 S43 S44 A50 | F42-F46 PolarHBondContact O-N 3.38Å; S43-F46 PolarHBondContact O-N 3.28Å; S44-F46 VanDerWaalsContact C-N 3.33Å; F46-A50 VanDerWaalsContact O-CB 3.27Å; F46-A50 WeakPolarHBondContact O-CB 3.38Å; F46-A50 PolarHBondContact O-N 3.26Å |
| 47 | V | 95.4 | Very high | 95.9 | Very high | 56 Ų | 56 | 60.3 Ų | 60.3 | 34% | 0.339 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -67.2 | -50.9 | -178.7 | 172.3 | 0 | 0 | 0 | 0 | 112 | S43 S44 G49 A50 G51 T115 I119 | S43-V47 WeakPolarHBondContact O-CG2 3.48Å; S43-V47 PolarHBondContact O-N 3.41Å; S44-V47 PolarHBondContact O-N 3.26Å; V47-G49 VanDerWaalsContact C-N 3.32Å; V47-G49 PolarHBondContact O-N 3.27Å; V47-A50 PolarHBondContact O-N 2.99Å; V47-G51 PolarHBondContact O-N 3.41Å; V47-T115 HydrophobicContact CG2-CG2 4.14Å; V47-I119 HydrophobicContact CB-CD1 4.38Å; V47-I119 HydrophobicContact CG1-CD1 3.75Å; V47-I119 HydrophobicContact CG1-CG1 4.25Å; V47-I119 HydrophobicContact CG2-CD1 3.94Å |
| 48 | H | 94.4 | Very high | 95.7 | Very high | 42 Ų | 42 | 65.3 Ų | 65.3 | 19% | 0.194 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -67.2 | -34.8 | 179.3 | -73.9 | 83.4 | 0 | 0 | 0 | 111.7 | S44 G52 V73 G76 F77 S80 | S44-H48 WeakPolarHBondContact O-CB 3.35Å; S44-H48 PolarHBondContact O-N 2.95Å; S44-H48 PolarHBondContact O-ND1 3.32Å; S44-H48 PolarHBondContact OG-CE1 3Å; S44-H48 PolarHBondContact OG-ND1 3.48Å; H48-G52 WeakPolarHBondContact O-CA 3.33Å; H48-G52 PolarHBondContact O-N 2.92Å; H48-V73 HydrophobicContact CB-CG1 4.25Å; H48-G76 VanDerWaalsContact NE2-C 3.35Å; H48-F77 HydrophobicContact CB-CB 4.42Å; H48-F77 HydrophobicContact CB-CD2 4.09Å; H48-F77 AromaticContact CG-CD2 3.92Å; H48-F77 AromaticContact ND1-CD2 3.91Å; H48-F77 PolarHBondContact NE2-N 2.99Å; H48-S80 PolarHBondContact CE1-OG 2.88Å |
| 49 | G | 95.4 | Very high | 95.5 | Very high | 39 Ų | 39 | 65.2 Ų | 65.2 | 40% | 0.402 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -65.3 | -49.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112 | L45 V47 L53 | L45-G49 VanDerWaalsContact O-CA 3.3Å; L45-G49 WeakPolarHBondContact O-CA 3.31Å; L45-G49 PolarHBondContact O-N 3.32Å; V47-G49 VanDerWaalsContact C-N 3.32Å; V47-G49 PolarHBondContact O-N 3.27Å; G49-L53 WeakPolarHBondContact O-CB 3.34Å; G49-L53 PolarHBondContact O-N 3.16Å |
| 50 | A | 96.3 | Very high | 95.1 | Very high | 53 Ų | 53 | 67 Ų | 67 | 44% | 0.438 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -63.7 | -48.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | F46 V47 L53 L54 | F46-A50 VanDerWaalsContact O-CB 3.27Å; F46-A50 WeakPolarHBondContact O-CB 3.38Å; F46-A50 PolarHBondContact O-N 3.26Å; V47-A50 PolarHBondContact O-N 2.99Å; A50-L53 PolarHBondContact O-N 3.45Å; A50-L54 WeakPolarHBondContact O-CB 3.34Å; A50-L54 PolarHBondContact O-N 3.28Å |
| 51 | G | 94.3 | Very high | 94.9 | Very high | 41 Ų | 41 | 77.7 Ų | 77.7 | 42% | 0.423 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -64.4 | -41.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | V47 L54 M55 | V47-G51 PolarHBondContact O-N 3.41Å; G51-L54 PolarHBondContact O-N 3.42Å; G51-M55 WeakPolarHBondContact O-CB 3.34Å; G51-M55 PolarHBondContact O-N 2.9Å |
| 52 | G | 94.3 | Very high | 94.7 | Very high | 6 Ų | 6 | 81.1 Ų | 81.1 | 6% | 0.062 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -65.7 | -43.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | H48 M55 L56 | H48-G52 WeakPolarHBondContact O-CA 3.33Å; H48-G52 PolarHBondContact O-N 2.92Å; G52-M55 PolarHBondContact O-N 2.99Å; G52-L56 WeakPolarHBondContact O-CB 3.43Å; G52-L56 VanDerWaalsContact O-CG 3.23Å; G52-L56 WeakPolarHBondContact O-CG 3.39Å; G52-L56 PolarHBondContact O-N 3.47Å |
| 53 | L | 95.4 | Very high | 94.1 | Very high | 112 Ų | 112 | 83.3 Ų | 83.3 | 59% | 0.586 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -62.2 | -46.3 | 175.3 | 179.6 | 62 | 0 | 0 | 0 | 111.4 | G49 A50 M55 L56 V57 | G49-L53 WeakPolarHBondContact O-CB 3.34Å; G49-L53 PolarHBondContact O-N 3.16Å; A50-L53 PolarHBondContact O-N 3.45Å; L53-M55 VanDerWaalsContact C-N 3.3Å; L53-M55 PolarHBondContact O-N 3.42Å; L53-L56 WeakPolarHBondContact O-CB 3.47Å; L53-L56 PolarHBondContact O-N 3.34Å; L53-V57 HydrophobicContact CD1-CG2 4.43Å; L53-V57 WeakPolarHBondContact O-CG2 3.34Å; L53-V57 PolarHBondContact O-N 2.94Å |
| 54 | L | 95.7 | Very high | 93.9 | Very high | 107 Ų | 107 | 90.2 Ų | 90.2 | 56% | 0.56 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -56 | -48.4 | 175.5 | 176.6 | 62.1 | 0 | 0 | 0 | 110.6 | A50 G51 L56 V57 M58 | A50-L54 WeakPolarHBondContact O-CB 3.34Å; A50-L54 PolarHBondContact O-N 3.28Å; G51-L54 PolarHBondContact O-N 3.42Å; L54-L56 VanDerWaalsContact C-N 3.34Å; L54-L56 PolarHBondContact O-N 3.36Å; L54-V57 PolarHBondContact O-N 3.19Å; L54-M58 HydrophobicContact CD1-CE 4.01Å; L54-M58 HydrophobicContact CD1-CG 4.31Å; L54-M58 VanDerWaalsContact O-CG 3.28Å; L54-M58 WeakPolarHBondContact O-CG 3.46Å; L54-M58 PolarHBondContact O-N 3.32Å |
| 55 | M | 93.6 | Very high | 93.6 | Very high | 57 Ų | 57 | 90.5 Ų | 90.5 | 28% | 0.281 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -65.6 | -37 | -179.6 | -164.9 | 156.2 | 102 | 0 | 0 | 112.3 | G51 G52 L53 M58 L59 T69 L72 | G51-M55 WeakPolarHBondContact O-CB 3.34Å; G51-M55 PolarHBondContact O-N 2.9Å; G52-M55 PolarHBondContact O-N 2.99Å; L53-M55 VanDerWaalsContact C-N 3.3Å; L53-M55 PolarHBondContact O-N 3.42Å; M55-M58 PolarHBondContact O-N 3.26Å; M55-L59 HydrophobicContact CG-CD1 3.89Å; M55-L59 WeakPolarHBondContact O-CB 3.34Å; M55-L59 PolarHBondContact O-N 3.5Å; M55-T69 HydrophobicContact CB-CG2 3.74Å; M55-T69 VanDerWaalsContact CE-CA 3.46Å; M55-T69 HydrophobicContact CE-CG2 3.65Å; M55-T69 HydrophobicContact CG-CG2 3.77Å; M55-L72 HydrophobicContact CE-CB 4.34Å; M55-L72 HydrophobicContact CE-CD2 4.15Å |
| 56 | L | 93.6 | Very high | 93.4 | Very high | 50 Ų | 50 | 91.9 Ų | 91.9 | 26% | 0.262 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -62.8 | -43.2 | 173.6 | -75.3 | 172.7 | 0 | 0 | 0 | 111.9 | G52 L53 L54 L59 Q60 R66 T69 L70 | G52-L56 WeakPolarHBondContact O-CB 3.43Å; G52-L56 VanDerWaalsContact O-CG 3.23Å; G52-L56 WeakPolarHBondContact O-CG 3.39Å; G52-L56 PolarHBondContact O-N 3.47Å; L53-L56 WeakPolarHBondContact O-CB 3.47Å; L53-L56 PolarHBondContact O-N 3.34Å; L54-L56 VanDerWaalsContact C-N 3.34Å; L54-L56 PolarHBondContact O-N 3.36Å; L56-L59 CarbonylContact O-C 3.59Å; L56-L59 PolarHBondContact O-N 3.22Å; L56-Q60 WeakPolarHBondContact O-CA 3.45Å; L56-Q60 WeakPolarHBondContact O-CB 3.33Å; L56-Q60 PolarHBondContact O-N 3.13Å; L56-R66 HydrophobicContact CD2-CG 3.85Å; L56-T69 HydrophobicContact CD2-CG2 3.72Å; L56-T69 HydrophobicContact CG-CG2 3.73Å; L56-L70 HydrophobicContact CD1-CD2 4.36Å; L56-L70 HydrophobicContact CD2-CD2 4.17Å; L56-L70 HydrophobicContact CD2-CG 4.29Å |
| 57 | V | 94.8 | Very high | 93.2 | Very high | 67 Ų | 67 | 89.3 Ų | 89.3 | 41% | 0.406 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -64.5 | -42.5 | 176.3 | 171.9 | 0 | 0 | 0 | 0 | 110.7 | L53 L54 L59 Q60 | L53-V57 HydrophobicContact CD1-CG2 4.43Å; L53-V57 WeakPolarHBondContact O-CG2 3.34Å; L53-V57 PolarHBondContact O-N 2.94Å; L54-V57 PolarHBondContact O-N 3.19Å; V57-L59 PolarHBondContact O-N 3.37Å; V57-Q60 VanDerWaalsContact O-CD 3.29Å; V57-Q60 WeakPolarHBondContact O-CG 3.46Å; V57-Q60 PolarHBondContact O-NE2 3.1Å |
| 58 | M | 93.9 | Very high | 93 | Very high | 135 Ų | 135 | 91.3 Ų | 91.3 | 67% | 0.665 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -67 | -35.9 | 179.3 | -68.3 | -62.9 | 133 | 0 | 0 | 112.6 | L54 M55 | L54-M58 HydrophobicContact CD1-CE 4.01Å; L54-M58 HydrophobicContact CD1-CG 4.31Å; L54-M58 VanDerWaalsContact O-CG 3.28Å; L54-M58 WeakPolarHBondContact O-CG 3.46Å; L54-M58 PolarHBondContact O-N 3.32Å; M55-M58 PolarHBondContact O-N 3.26Å |
| 59 | L | 92.8 | Very high | 92.9 | Very high | 59 Ų | 59 | 89.3 Ų | 89.3 | 31% | 0.309 | 44% | 0.443 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -101.4 | 13.6 | -177.7 | -67.7 | 167.3 | 0 | 0 | 0 | 113.9 | M55 L56 V57 R61 H62 T69 | M55-L59 HydrophobicContact CG-CD1 3.89Å; M55-L59 WeakPolarHBondContact O-CB 3.34Å; M55-L59 PolarHBondContact O-N 3.5Å; L56-L59 CarbonylContact O-C 3.59Å; L56-L59 PolarHBondContact O-N 3.22Å; V57-L59 PolarHBondContact O-N 3.37Å; L59-R61 PolarHBondContact O-N 3.43Å; L59-R61 VanDerWaalsContact O-N 3.11Å; L59-H62 PolarHBondContact O-N 3.37Å; L59-T69 WeakPolarHBondContact CD1-OG1 3.24Å |
| 60 | Q | 90.2 | Very high | 92.8 | Very high | 122 Ų | 122 | 92 Ų | 92 | 57% | 0.57 | 45% | 0.447 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.4 | -30.2 | -173.9 | 66.4 | -173.7 | -44.7 | 0 | 0 | 114.1 | L56 V57 H62 | L56-Q60 WeakPolarHBondContact O-CA 3.45Å; L56-Q60 WeakPolarHBondContact O-CB 3.33Å; L56-Q60 PolarHBondContact O-N 3.13Å; V57-Q60 VanDerWaalsContact O-CD 3.29Å; V57-Q60 WeakPolarHBondContact O-CG 3.46Å; V57-Q60 PolarHBondContact O-NE2 3.1Å; Q60-H62 VanDerWaalsContact C-N 3.33Å |
| 61 | R | 92.2 | Very high | 92.7 | Very high | 231 Ų | 231 | 93.3 Ų | 93.3 | 87% | 0.872 | 45% | 0.449 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.6 | -13.8 | -179.1 | -67 | -170.8 | 177.5 | -175.3 | 0 | 113.7 | L59 | L59-R61 PolarHBondContact O-N 3.43Å; L59-R61 VanDerWaalsContact O-N 3.11Å |
| 62 | H | 92.4 | Very high | 92.6 | Very high | 125 Ų | 125 | 96.6 Ų | 96.6 | 58% | 0.579 | 46% | 0.457 | S | S | * | . | trans | -112.6 | 113.1 | -177.1 | -65.4 | -79.5 | 0 | 0 | 0 | 111 | L59 Q60 W64 G65 R66 | L59-H62 PolarHBondContact O-N 3.37Å; Q60-H62 VanDerWaalsContact C-N 3.33Å; H62-W64 PolarHBondContact O-N 2.82Å; H62-G65 PolarHBondContact O-N 3.42Å; H62-R66 PolarHBondContact O-N 3.3Å | ||
| 63 | R | 86.3 | Confident | 92.6 | Very high | 178 Ų | 178 | 97.9 Ų | 97.9 | 67% | 0.672 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -52.4 | -41.5 | 179.2 | 66.9 | 176.1 | -124.4 | 177.8 | 2.9 | 113.1 | L67 | R63-L67 PolarHBondContact O-N 2.95Å |
| 64 | W | 92.6 | Very high | 92.5 | Very high | 160 Ų | 160 | 95.5 Ų | 95.5 | 61% | 0.606 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -76.2 | -36.5 | 179.3 | -71 | 111.7 | 0 | 0 | 0 | 112.2 | H62 R66 L67 I68 | H62-W64 PolarHBondContact O-N 2.82Å; W64-R66 VanDerWaalsContact C-N 3.33Å; W64-R66 PolarHBondContact O-N 3.33Å; W64-L67 PolarHBondContact O-N 3.23Å; W64-I68 VanDerWaalsContact O-CG1 3.3Å; W64-I68 WeakPolarHBondContact O-CG1 3.46Å; W64-I68 PolarHBondContact O-N 3.26Å |
| 65 | G | 89.1 | Confident | 92.4 | Very high | 11 Ų | 11 | 94.7 Ų | 94.7 | 11% | 0.113 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -61.2 | -41.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | H62 T69 | H62-G65 PolarHBondContact O-N 3.42Å; G65-T69 WeakPolarHBondContact O-CB 3.43Å; G65-T69 PolarHBondContact O-N 3.02Å; G65-T69 PolarHBondContact O-OG1 3.44Å |
| 66 | R | 91.4 | Very high | 92.3 | Very high | 131 Ų | 131 | 93.3 Ų | 93.3 | 49% | 0.494 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -62.6 | -43.7 | 173.9 | 177.5 | 166 | 36.5 | 168.9 | -9 | 112.8 | L56 H62 W64 T69 L70 | L56-R66 HydrophobicContact CD2-CG 3.85Å; H62-R66 PolarHBondContact O-N 3.3Å; W64-R66 VanDerWaalsContact C-N 3.33Å; W64-R66 PolarHBondContact O-N 3.33Å; R66-T69 WeakPolarHBondContact O-CB 3.5Å; R66-T69 PolarHBondContact O-N 3.22Å; R66-L70 WeakPolarHBondContact O-CG 3.46Å; R66-L70 PolarHBondContact O-N 2.92Å; R66-L70 VanDerWaalsContact O-N 3.09Å |
| 67 | L | 92.4 | Very high | 92.3 | Very high | 94 Ų | 94 | 92.9 Ų | 92.9 | 49% | 0.492 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -65.8 | -44.6 | 178.8 | -171 | 141.4 | 0 | 0 | 0 | 111.6 | R63 W64 T69 L70 V71 | R63-L67 PolarHBondContact O-N 2.95Å; W64-L67 PolarHBondContact O-N 3.23Å; L67-T69 VanDerWaalsContact C-N 3.25Å; L67-T69 PolarHBondContact O-N 3.46Å; L67-L70 PolarHBondContact O-N 3.26Å; L67-V71 HydrophobicContact CD2-CG2 4.26Å; L67-V71 WeakPolarHBondContact O-CG2 3.26Å; L67-V71 PolarHBondContact O-N 3.38Å |
| 68 | I | 91.7 | Very high | 92.3 | Very high | 97 Ų | 97 | 94.9 Ų | 94.9 | 50% | 0.497 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -59.4 | -39.7 | 175 | -68.2 | 166.1 | 0 | 0 | 0 | 110.8 | W64 V71 L72 | W64-I68 VanDerWaalsContact O-CG1 3.3Å; W64-I68 WeakPolarHBondContact O-CG1 3.46Å; W64-I68 PolarHBondContact O-N 3.26Å; I68-V71 PolarHBondContact O-N 2.79Å; I68-L72 VanDerWaalsContact O-CB 3.32Å; I68-L72 WeakPolarHBondContact O-CB 3.3Å; I68-L72 PolarHBondContact O-N 3.5Å |
| 69 | T | 92.6 | Very high | 92.2 | Very high | 1 Ų | 1 | 91.2 Ų | 91.2 | 1% | 0.006 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -60.3 | -49.6 | 176.8 | -59.7 | 0 | 0 | 0 | 0 | 112.2 | M55 L56 L59 G65 R66 L67 V71 L72 V73 | M55-T69 HydrophobicContact CB-CG2 3.74Å; M55-T69 VanDerWaalsContact CE-CA 3.46Å; M55-T69 HydrophobicContact CE-CG2 3.65Å; M55-T69 HydrophobicContact CG-CG2 3.77Å; L56-T69 HydrophobicContact CD2-CG2 3.72Å; L56-T69 HydrophobicContact CG-CG2 3.73Å; L59-T69 WeakPolarHBondContact CD1-OG1 3.24Å; G65-T69 WeakPolarHBondContact O-CB 3.43Å; G65-T69 PolarHBondContact O-N 3.02Å; G65-T69 PolarHBondContact O-OG1 3.44Å; R66-T69 WeakPolarHBondContact O-CB 3.5Å; R66-T69 PolarHBondContact O-N 3.22Å; L67-T69 VanDerWaalsContact C-N 3.25Å; L67-T69 PolarHBondContact O-N 3.46Å; T69-V71 VanDerWaalsContact C-N 3.3Å; T69-V71 PolarHBondContact O-N 3.41Å; T69-L72 PolarHBondContact O-N 3.26Å; T69-V73 HydrophobicContact CG2-CG2 4.24Å; T69-V73 WeakPolarHBondContact O-CB 3.45Å; T69-V73 VanDerWaalsContact O-CG2 3.23Å; T69-V73 WeakPolarHBondContact O-CG2 3.16Å; T69-V73 PolarHBondContact O-N 3.01Å |
| 70 | L | 93.3 | Very high | 92.1 | Very high | 94 Ų | 94 | 89.6 Ų | 89.6 | 49% | 0.492 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -59.9 | -43.1 | 178.4 | -67.7 | 172.9 | 0 | 0 | 0 | 111.2 | L56 R66 L67 S74 | L56-L70 HydrophobicContact CD1-CD2 4.36Å; L56-L70 HydrophobicContact CD2-CD2 4.17Å; L56-L70 HydrophobicContact CD2-CG 4.29Å; R66-L70 WeakPolarHBondContact O-CG 3.46Å; R66-L70 PolarHBondContact O-N 2.92Å; R66-L70 VanDerWaalsContact O-N 3.09Å; L67-L70 PolarHBondContact O-N 3.26Å; L70-S74 WeakPolarHBondContact O-CB 3.44Å; L70-S74 PolarHBondContact O-N 2.97Å; L70-S74 PolarHBondContact O-OG 3.04Å |
| 71 | V | 94.8 | Very high | 92.2 | Very high | 81 Ų | 81 | 86 Ų | 86 | 49% | 0.491 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -63.9 | -50.4 | 178 | 173.1 | 0 | 0 | 0 | 0 | 111.1 | L67 I68 T69 V73 S74 V75 | L67-V71 HydrophobicContact CD2-CG2 4.26Å; L67-V71 WeakPolarHBondContact O-CG2 3.26Å; L67-V71 PolarHBondContact O-N 3.38Å; I68-V71 PolarHBondContact O-N 2.79Å; T69-V71 VanDerWaalsContact C-N 3.3Å; T69-V71 PolarHBondContact O-N 3.41Å; V71-V73 PolarHBondContact O-N 2.87Å; V71-S74 PolarHBondContact O-N 3.44Å; V71-V75 HydrophobicContact CG1-CG2 4.27Å; V71-V75 WeakPolarHBondContact O-CB 3.18Å; V71-V75 VanDerWaalsContact O-CG2 3.29Å; V71-V75 WeakPolarHBondContact O-CG2 3.5Å; V71-V75 PolarHBondContact O-N 3.41Å |
| 72 | L | 92.1 | Very high | 92.3 | Very high | 110 Ų | 110 | 78.4 Ų | 78.4 | 58% | 0.576 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -66 | -42.6 | -174.4 | -166.6 | 136.8 | 0 | 0 | 0 | 112.1 | M55 I68 T69 G76 | M55-L72 HydrophobicContact CE-CB 4.34Å; M55-L72 HydrophobicContact CE-CD2 4.15Å; I68-L72 VanDerWaalsContact O-CB 3.32Å; I68-L72 WeakPolarHBondContact O-CB 3.3Å; I68-L72 PolarHBondContact O-N 3.5Å; T69-L72 PolarHBondContact O-N 3.26Å; L72-G76 PolarHBondContact O-N 2.92Å |
| 73 | V | 93.6 | Very high | 92.4 | Very high | 34 Ų | 34 | 73.9 Ų | 73.9 | 21% | 0.206 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -64.8 | -43 | 175.5 | 175 | 0 | 0 | 0 | 0 | 110.6 | H48 T69 V71 G76 F77 | H48-V73 HydrophobicContact CB-CG1 4.25Å; T69-V73 HydrophobicContact CG2-CG2 4.24Å; T69-V73 WeakPolarHBondContact O-CB 3.45Å; T69-V73 VanDerWaalsContact O-CG2 3.23Å; T69-V73 WeakPolarHBondContact O-CG2 3.16Å; T69-V73 PolarHBondContact O-N 3.01Å; V71-V73 PolarHBondContact O-N 2.87Å; V73-G76 PolarHBondContact O-N 2.9Å; V73-F77 VanDerWaalsContact O-CB 3.23Å; V73-F77 WeakPolarHBondContact O-CB 3.31Å; V73-F77 PolarHBondContact O-N 2.88Å |
| 74 | S | 93.4 | Very high | 92.7 | Very high | 61 Ų | 61 | 65.8 Ų | 65.8 | 43% | 0.427 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -65.3 | -45.9 | 179.7 | -59.2 | 0 | 0 | 0 | 0 | 112 | L70 V71 F77 L78 | L70-S74 WeakPolarHBondContact O-CB 3.44Å; L70-S74 PolarHBondContact O-N 2.97Å; L70-S74 PolarHBondContact O-OG 3.04Å; V71-S74 PolarHBondContact O-N 3.44Å; S74-F77 PolarHBondContact O-N 3.44Å; S74-L78 WeakPolarHBondContact O-CB 3.42Å; S74-L78 VanDerWaalsContact O-CG 3.29Å; S74-L78 WeakPolarHBondContact O-CG 3.45Å; S74-L78 PolarHBondContact O-N 3.42Å |
| 75 | V | 94.5 | Very high | 92.9 | Very high | 91 Ų | 91 | 60.2 Ų | 60.2 | 55% | 0.552 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -64.2 | -44.8 | 178.2 | 171.7 | 0 | 0 | 0 | 0 | 110.7 | V71 F77 L78 A79 | V71-V75 HydrophobicContact CG1-CG2 4.27Å; V71-V75 WeakPolarHBondContact O-CB 3.18Å; V71-V75 VanDerWaalsContact O-CG2 3.29Å; V71-V75 WeakPolarHBondContact O-CG2 3.5Å; V71-V75 PolarHBondContact O-N 3.41Å; V75-F77 VanDerWaalsContact C-N 3.34Å; V75-F77 PolarHBondContact O-N 3.25Å; V75-L78 PolarHBondContact O-N 3.25Å; V75-A79 VanDerWaalsContact O-CB 3.31Å; V75-A79 WeakPolarHBondContact O-CB 3.5Å; V75-A79 PolarHBondContact O-N 3.4Å |
| 76 | G | 91.6 | Very high | 93.3 | Very high | 27 Ų | 27 | 65.4 Ų | 65.4 | 28% | 0.278 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -60.3 | -42.7 | 176 | 0 | 0 | 0 | 0 | 0 | 112.6 | H48 L72 V73 S80 | H48-G76 VanDerWaalsContact NE2-C 3.35Å; L72-G76 PolarHBondContact O-N 2.92Å; V73-G76 PolarHBondContact O-N 2.9Å; G76-S80 WeakPolarHBondContact O-CB 3.31Å; G76-S80 PolarHBondContact O-N 2.97Å; G76-S80 PolarHBondContact O-OG 3.29Å |
| 77 | F | 93.4 | Very high | 93.6 | Very high | 42 Ų | 42 | 62.2 Ų | 62.2 | 18% | 0.184 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -66.2 | -45.4 | 178 | -178.3 | -109.5 | 0 | 0 | 0 | 112.2 | L41 L45 H48 V73 S74 V75 S80 L81 | L41-F77 HydrophobicContact CD1-CE2 4.4Å; L41-F77 HydrophobicContact CD1-CZ 3.74Å; L45-F77 HydrophobicContact CB-CE2 4.28Å; L45-F77 HydrophobicContact CD1-CE2 4.41Å; L45-F77 HydrophobicContact CD1-CZ 4.3Å; H48-F77 HydrophobicContact CB-CB 4.42Å; H48-F77 HydrophobicContact CB-CD2 4.09Å; H48-F77 AromaticContact CG-CD2 3.92Å; H48-F77 AromaticContact ND1-CD2 3.91Å; H48-F77 PolarHBondContact NE2-N 2.99Å; V73-F77 VanDerWaalsContact O-CB 3.23Å; V73-F77 WeakPolarHBondContact O-CB 3.31Å; V73-F77 PolarHBondContact O-N 2.88Å; S74-F77 PolarHBondContact O-N 3.44Å; V75-F77 VanDerWaalsContact C-N 3.34Å; V75-F77 PolarHBondContact O-N 3.25Å; F77-S80 WeakPolarHBondContact O-CB 3.48Å; F77-S80 PolarHBondContact O-N 3.38Å; F77-L81 WeakPolarHBondContact O-CB 3.23Å; F77-L81 PolarHBondContact O-N 2.67Å |
| 78 | L | 94.1 | Very high | 93.8 | Very high | 108 Ų | 108 | 57.8 Ų | 57.8 | 57% | 0.565 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -64.5 | -41.3 | 177.7 | -73.8 | 169.8 | 0 | 0 | 0 | 112.2 | S74 V75 S80 L81 S82 | S74-L78 WeakPolarHBondContact O-CB 3.42Å; S74-L78 VanDerWaalsContact O-CG 3.29Å; S74-L78 WeakPolarHBondContact O-CG 3.45Å; S74-L78 PolarHBondContact O-N 3.42Å; V75-L78 PolarHBondContact O-N 3.25Å; L78-S80 VanDerWaalsContact C-N 3.33Å; L78-L81 PolarHBondContact O-N 3.38Å; L78-S82 PolarHBondContact O-N 3.44Å; L78-S82 PolarHBondContact O-OG 3.04Å |
| 79 | A | 91.1 | Very high | 94 | Very high | 59 Ų | 59 | 58.4 Ų | 58.4 | 49% | 0.488 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -59.4 | -46.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | V75 L81 S82 G83 | V75-A79 VanDerWaalsContact O-CB 3.31Å; V75-A79 WeakPolarHBondContact O-CB 3.5Å; V75-A79 PolarHBondContact O-N 3.4Å; A79-L81 VanDerWaalsContact C-N 3.32Å; A79-L81 PolarHBondContact O-N 2.93Å; A79-S82 PolarHBondContact O-N 2.8Å; A79-S82 PolarHBondContact O-OG 3.14Å; A79-G83 PolarHBondContact O-N 3.09Å |
| 80 | S | 91.6 | Very high | 94.2 | Very high | 25 Ų | 25 | 60.9 Ų | 60.9 | 18% | 0.175 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -60 | -42 | 176 | -57.2 | 0 | 0 | 0 | 0 | 111.9 | H48 G76 F77 L78 G83 A84 | H48-S80 PolarHBondContact CE1-OG 2.88Å; G76-S80 WeakPolarHBondContact O-CB 3.31Å; G76-S80 PolarHBondContact O-N 2.97Å; G76-S80 PolarHBondContact O-OG 3.29Å; F77-S80 WeakPolarHBondContact O-CB 3.48Å; F77-S80 PolarHBondContact O-N 3.38Å; L78-S80 VanDerWaalsContact C-N 3.33Å; S80-G83 PolarHBondContact O-N 3.02Å; S80-A84 VanDerWaalsContact O-CB 3.3Å; S80-A84 WeakPolarHBondContact O-CB 3.15Å; S80-A84 PolarHBondContact O-N 3.33Å |
| 81 | L | 93.1 | Very high | 94.4 | Very high | 46 Ų | 46 | 57.4 Ų | 57.4 | 24% | 0.241 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -64.2 | -45.3 | -179.1 | -166.4 | 68.2 | 0 | 0 | 0 | 112.2 | F37 L41 F77 L78 A79 G83 A84 V85 | F37-L81 HydrophobicContact CE2-CD1 3.49Å; F37-L81 VanDerWaalsContact CE2-CD1 3.49Å; F37-L81 HydrophobicContact CE2-CG 4.19Å; F37-L81 HydrophobicContact CZ-CD1 3.51Å; F37-L81 HydrophobicContact CZ-CG 4.25Å; L41-L81 HydrophobicContact CD1-CD1 3.71Å; F77-L81 WeakPolarHBondContact O-CB 3.23Å; F77-L81 PolarHBondContact O-N 2.67Å; L78-L81 PolarHBondContact O-N 3.38Å; A79-L81 VanDerWaalsContact C-N 3.32Å; A79-L81 PolarHBondContact O-N 2.93Å; L81-G83 PolarHBondContact O-N 3.4Å; L81-A84 WeakPolarHBondContact O-CB 3.44Å; L81-A84 PolarHBondContact O-N 3.19Å; L81-V85 WeakPolarHBondContact O-CG2 3.37Å; L81-V85 PolarHBondContact O-N 2.85Å |
| 82 | S | 94.3 | Very high | 94.4 | Very high | 72 Ų | 72 | 53.5 Ų | 53.5 | 50% | 0.503 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -60.1 | -45.2 | 178.4 | 66 | 0 | 0 | 0 | 0 | 112.1 | L78 A79 V85 I86 | L78-S82 PolarHBondContact O-N 3.44Å; L78-S82 PolarHBondContact O-OG 3.04Å; A79-S82 PolarHBondContact O-N 2.8Å; A79-S82 PolarHBondContact O-OG 3.14Å; S82-V85 PolarHBondContact O-N 3.44Å; S82-I86 WeakPolarHBondContact O-CG1 3.48Å; S82-I86 PolarHBondContact O-N 3.07Å |
| 83 | G | 92.9 | Very high | 94.4 | Very high | 30 Ų | 30 | 50.5 Ų | 50.5 | 31% | 0.309 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -64.6 | -38.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | A79 S80 L81 I86 T87 | A79-G83 PolarHBondContact O-N 3.09Å; S80-G83 PolarHBondContact O-N 3.02Å; L81-G83 PolarHBondContact O-N 3.4Å; G83-I86 PolarHBondContact O-N 3.23Å; G83-T87 WeakPolarHBondContact O-CB 3.46Å; G83-T87 PolarHBondContact O-N 3.12Å; G83-T87 PolarHBondContact O-OG1 3.47Å |
| 84 | A | 94.4 | Very high | 94.5 | Very high | 7 Ų | 7 | 53.5 Ų | 53.5 | 6% | 0.058 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -63.8 | -41.1 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | F37 C40 S80 L81 S88 | F37-A84 HydrophobicContact CD2-CB 4.22Å; F37-A84 HydrophobicContact CE2-CB 4.4Å; C40-A84 HydrophobicContact CB-CB 4.31Å; C40-A84 WeakPolarHBondContact SG-CB 3.45Å; S80-A84 VanDerWaalsContact O-CB 3.3Å; S80-A84 WeakPolarHBondContact O-CB 3.15Å; S80-A84 PolarHBondContact O-N 3.33Å; L81-A84 WeakPolarHBondContact O-CB 3.44Å; L81-A84 PolarHBondContact O-N 3.19Å; A84-S88 WeakPolarHBondContact O-CB 3.48Å; A84-S88 PolarHBondContact O-N 2.89Å; A84-S88 PolarHBondContact O-OG 3.4Å |
| 85 | V | 96.7 | Very high | 94.6 | Very high | 43 Ų | 43 | 52.2 Ų | 52.2 | 26% | 0.261 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -60.3 | -48.6 | 176 | 173.3 | 0 | 0 | 0 | 0 | 110.7 | W33 F37 L81 S82 K89 | W33-V85 HydrophobicContact CZ3-CG1 4.1Å; F37-V85 HydrophobicContact CD2-CG2 3.79Å; F37-V85 HydrophobicContact CE2-CB 4.43Å; F37-V85 HydrophobicContact CE2-CG2 3.31Å; F37-V85 HydrophobicContact CZ-CG2 3.91Å; L81-V85 WeakPolarHBondContact O-CG2 3.37Å; L81-V85 PolarHBondContact O-N 2.85Å; S82-V85 PolarHBondContact O-N 3.44Å; V85-K89 HydrophobicContact CG1-CD 4.49Å; V85-K89 WeakPolarHBondContact O-CG 3.49Å; V85-K89 PolarHBondContact O-N 3.41Å; V85-K89 VanDerWaalsContact O-N 3.12Å |
| 86 | I | 96.8 | Very high | 94.4 | Very high | 121 Ų | 121 | 53.3 Ų | 53.3 | 62% | 0.621 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -63.4 | -48.9 | -177.7 | -63.1 | 168.3 | 0 | 0 | 0 | 110 | S82 G83 S88 K89 A90 | S82-I86 WeakPolarHBondContact O-CG1 3.48Å; S82-I86 PolarHBondContact O-N 3.07Å; G83-I86 PolarHBondContact O-N 3.23Å; I86-S88 PolarHBondContact O-N 2.93Å; I86-K89 PolarHBondContact O-N 3.35Å; I86-A90 PolarHBondContact O-N 2.89Å |
| 87 | T | 96.7 | Very high | 94.3 | Very high | 64 Ų | 64 | 57.6 Ų | 57.6 | 39% | 0.393 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -66.5 | -39.2 | -177.1 | -51.3 | 0 | 0 | 0 | 0 | 111.4 | G83 K89 A90 V91 Q114 | G83-T87 WeakPolarHBondContact O-CB 3.46Å; G83-T87 PolarHBondContact O-N 3.12Å; G83-T87 PolarHBondContact O-OG1 3.47Å; T87-K89 PolarHBondContact O-N 3.35Å; T87-A90 WeakPolarHBondContact O-CB 3.38Å; T87-A90 PolarHBondContact O-N 3.47Å; T87-A90 VanDerWaalsContact O-N 3.15Å; T87-V91 WeakPolarHBondContact O-CG2 3.45Å; T87-V91 PolarHBondContact O-N 3.04Å; T87-Q114 HydrophobicContact CG2-CG 4Å |
| 88 | S | 97.2 | Very high | 94.2 | Very high | 0 Ų | 0 | 58.4 Ų | 58.4 | 0% | 0 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -64.8 | -40.9 | 177.7 | -58.5 | 0 | 0 | 0 | 0 | 112.2 | W33 V36 F37 A84 I86 A90 V91 A92 Q114 | W33-S88 WeakPolarHBondContact CB-O 3.29Å; W33-S88 WeakPolarHBondContact O-CB 3.36Å; V36-S88 WeakPolarHBondContact CG1-OG 3.42Å; F37-S88 WeakPolarHBondContact CA-OG 3.41Å; F37-S88 PolarHBondContact N-OG 2.81Å; A84-S88 WeakPolarHBondContact O-CB 3.48Å; A84-S88 PolarHBondContact O-N 2.89Å; A84-S88 PolarHBondContact O-OG 3.4Å; I86-S88 PolarHBondContact O-N 2.93Å; S88-A90 VanDerWaalsContact C-N 3.31Å; S88-A90 PolarHBondContact O-N 3.38Å; S88-V91 PolarHBondContact O-N 3.47Å; S88-A92 PolarHBondContact O-N 2.92Å; S88-Q114 PolarHBondContact OG-NE2 3.48Å; S88-Q114 PolarHBondContact OG-OE1 3.07Å |
| 89 | K | 96.5 | Very high | 94 | Very high | 110 Ų | 110 | 56.7 Ų | 56.7 | 48% | 0.478 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -62.6 | -38.6 | 172.2 | -75 | -176.7 | 169.8 | -172.8 | 0 | 112 | W33 V85 I86 T87 C93 | W33-K89 HydrophobicContact CB-CG 4.14Å; W33-K89 HydrophobicContact CD2-CG 3.79Å; W33-K89 HydrophobicContact CE3-CG 3.94Å; W33-K89 HydrophobicContact CG-CG 3.86Å; V85-K89 HydrophobicContact CG1-CD 4.49Å; V85-K89 WeakPolarHBondContact O-CG 3.49Å; V85-K89 PolarHBondContact O-N 3.41Å; V85-K89 VanDerWaalsContact O-N 3.12Å; I86-K89 PolarHBondContact O-N 3.35Å; T87-K89 PolarHBondContact O-N 3.35Å; K89-C93 WeakPolarHBondContact O-CB 3.17Å; K89-C93 PolarHBondContact O-N 2.97Å |
| 90 | A | 96.6 | Very high | 93.9 | Very high | 54 Ų | 54 | 60.7 Ų | 60.7 | 45% | 0.446 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -63.7 | -46 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | I86 T87 S88 A92 C93 V94 | I86-A90 PolarHBondContact O-N 2.89Å; T87-A90 WeakPolarHBondContact O-CB 3.38Å; T87-A90 PolarHBondContact O-N 3.47Å; T87-A90 VanDerWaalsContact O-N 3.15Å; S88-A90 VanDerWaalsContact C-N 3.31Å; S88-A90 PolarHBondContact O-N 3.38Å; A90-A92 PolarHBondContact O-N 3.36Å; A90-C93 WeakPolarHBondContact O-CB 3.44Å; A90-C93 PolarHBondContact O-N 3.45Å; A90-V94 WeakPolarHBondContact O-CG2 3.18Å; A90-V94 PolarHBondContact O-N 3.04Å |
| 91 | V | 96.6 | Very high | 93.8 | Very high | 20 Ų | 20 | 62.7 Ų | 62.7 | 12% | 0.121 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -59.1 | -47.8 | 176.4 | 176.6 | 0 | 0 | 0 | 0 | 111.1 | V36 T87 S88 C93 V94 Y95 M102 F110 | V36-V91 HydrophobicContact CG2-CG1 4.42Å; T87-V91 WeakPolarHBondContact O-CG2 3.45Å; T87-V91 PolarHBondContact O-N 3.04Å; S88-V91 PolarHBondContact O-N 3.47Å; V91-C93 VanDerWaalsContact C-N 3.3Å; V91-C93 PolarHBondContact O-N 3.17Å; V91-V94 PolarHBondContact O-N 3.39Å; V91-V94 VanDerWaalsContact O-N 3.17Å; V91-Y95 HydrophobicContact CG1-CD2 4.09Å; V91-Y95 HydrophobicContact CG1-CE2 4.22Å; V91-Y95 PolarHBondContact O-N 3.19Å; V91-M102 HydrophobicContact CG1-CE 3.58Å; V91-F110 HydrophobicContact CG1-CD1 4.09Å; V91-F110 HydrophobicContact CG1-CD2 3.93Å; V91-F110 HydrophobicContact CG1-CE1 4.29Å; V91-F110 HydrophobicContact CG1-CE2 4.16Å; V91-F110 HydrophobicContact CG1-CG 3.92Å; V91-F110 HydrophobicContact CG1-CZ 4.33Å; V91-F110 HydrophobicContact CG2-CD1 4.06Å; V91-F110 HydrophobicContact CG2-CE1 4.46Å; V91-F110 HydrophobicContact CG2-CG 4.46Å |
| 92 | A | 95.8 | Very high | 93.8 | Very high | 0 Ų | 0 | 62 Ų | 62 | 0% | 0 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -62.2 | -37.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | T29 M32 W33 S88 A90 Y95 R96 | T29-A92 HydrophobicContact CG2-CB 4.07Å; M32-A92 HydrophobicContact CB-CB 3.91Å; W33-A92 HydrophobicContact CB-CB 3.61Å; S88-A92 PolarHBondContact O-N 2.92Å; A90-A92 PolarHBondContact O-N 3.36Å; A92-Y95 PolarHBondContact O-N 3.15Å; A92-R96 VanDerWaalsContact O-CB 3.3Å; A92-R96 WeakPolarHBondContact O-CB 3.49Å; A92-R96 PolarHBondContact O-N 3.48Å |
| 93 | C | 92.8 | Very high | 93.9 | Very high | 47 Ų | 47 | 61 Ų | 61 | 32% | 0.318 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -61.4 | -42.6 | 174.2 | -173.6 | 0 | 0 | 0 | 0 | 111.9 | K89 A90 V91 R96 V97 | K89-C93 WeakPolarHBondContact O-CB 3.17Å; K89-C93 PolarHBondContact O-N 2.97Å; A90-C93 WeakPolarHBondContact O-CB 3.44Å; A90-C93 PolarHBondContact O-N 3.45Å; V91-C93 VanDerWaalsContact C-N 3.3Å; V91-C93 PolarHBondContact O-N 3.17Å; C93-R96 WeakPolarHBondContact O-CB 3.3Å; C93-R96 PolarHBondContact O-N 3.38Å; C93-R96 PolarHBondContact SG-NH2 2.65Å; C93-R96 VanDerWaalsContact SG-NH2 3.4Å; C93-V97 WeakPolarHBondContact O-CG2 3.41Å; C93-V97 PolarHBondContact O-N 2.93Å |
| 94 | V | 95.2 | Very high | 94 | Very high | 97 Ų | 97 | 64.7 Ų | 64.7 | 59% | 0.588 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -62.8 | -48.6 | 177.4 | 170.9 | 0 | 0 | 0 | 0 | 110.9 | A90 V91 R96 V97 A98 | A90-V94 WeakPolarHBondContact O-CG2 3.18Å; A90-V94 PolarHBondContact O-N 3.04Å; V91-V94 PolarHBondContact O-N 3.39Å; V91-V94 VanDerWaalsContact O-N 3.17Å; V94-R96 VanDerWaalsContact C-N 3.3Å; V94-R96 PolarHBondContact O-N 3.5Å; V94-V97 PolarHBondContact O-N 3.02Å; V94-A98 WeakPolarHBondContact O-CB 3.37Å; V94-A98 PolarHBondContact O-N 2.73Å |
| 95 | Y | 94.1 | Very high | 94.1 | Very high | 34 Ų | 34 | 70.6 Ų | 70.6 | 13% | 0.133 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -60.4 | -41.1 | 176.7 | -94.8 | -103.5 | 0 | 0 | 0 | 112.3 | M32 V91 A92 A98 G99 K100 M102 E106 F110 | M32-Y95 HydrophobicContact CE-CD1 3.78Å; M32-Y95 HydrophobicContact CE-CG 3.66Å; V91-Y95 HydrophobicContact CG1-CD2 4.09Å; V91-Y95 HydrophobicContact CG1-CE2 4.22Å; V91-Y95 PolarHBondContact O-N 3.19Å; A92-Y95 PolarHBondContact O-N 3.15Å; Y95-A98 CarbonylContact O-C 3.48Å; Y95-A98 PolarHBondContact O-N 3.46Å; Y95-G99 PolarHBondContact O-N 3.34Å; Y95-G99 VanDerWaalsContact O-N 3.07Å; Y95-K100 HydrophobicContact CD1-CB 3.93Å; Y95-K100 WeakPolarHBondContact CD1-O 3.43Å; Y95-K100 HydrophobicContact CE1-CB 4.4Å; Y95-K100 PolarHBondContact O-N 3.41Å; Y95-M102 HydrophobicContact CD1-CB 3.97Å; Y95-M102 HydrophobicContact CD1-CE 4.29Å; Y95-M102 HydrophobicContact CD2-CE 3.55Å; Y95-M102 HydrophobicContact CE1-CB 3.92Å; Y95-M102 HydrophobicContact CE1-CE 4.3Å; Y95-M102 HydrophobicContact CE1-CG 4.19Å; Y95-M102 HydrophobicContact CE2-CE 3.57Å; Y95-M102 HydrophobicContact CG-CE 3.94Å; Y95-E106 PolarHBondContact OH-OE2 3.07Å; Y95-F110 HydrophobicContact CE2-CD2 4.5Å; Y95-F110 AromaticContact CE2-CE2 3.71Å; Y95-F110 HydrophobicContact CE2-CE2 3.71Å; Y95-F110 HydrophobicContact CE2-CZ 4.22Å |
| 96 | R | 90.1 | Very high | 94.1 | Very high | 114 Ų | 114 | 72.6 Ų | 72.6 | 43% | 0.43 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -58 | -50.2 | 173.9 | 178.6 | -167.3 | 70.5 | 165.7 | -1 | 111.3 | L25 T29 A92 C93 V94 A98 G99 | L25-R96 HydrophobicContact CD2-CG 4.25Å; T29-R96 VanDerWaalsContact OG1-CD 3.31Å; T29-R96 WeakPolarHBondContact OG1-CD 3.23Å; A92-R96 VanDerWaalsContact O-CB 3.3Å; A92-R96 WeakPolarHBondContact O-CB 3.49Å; A92-R96 PolarHBondContact O-N 3.48Å; C93-R96 WeakPolarHBondContact O-CB 3.3Å; C93-R96 PolarHBondContact O-N 3.38Å; C93-R96 PolarHBondContact SG-NH2 2.65Å; C93-R96 VanDerWaalsContact SG-NH2 3.4Å; V94-R96 VanDerWaalsContact C-N 3.3Å; V94-R96 PolarHBondContact O-N 3.5Å; R96-A98 PolarHBondContact O-N 3.04Å; R96-G99 PolarHBondContact O-N 3.29Å |
| 97 | V | 90.9 | Very high | 94.1 | Very high | 116 Ų | 116 | 66.9 Ų | 66.9 | 70% | 0.703 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -63.3 | -33 | 179.1 | 171 | 0 | 0 | 0 | 0 | 111.1 | C93 V94 G99 | C93-V97 WeakPolarHBondContact O-CG2 3.41Å; C93-V97 PolarHBondContact O-N 2.93Å; V94-V97 PolarHBondContact O-N 3.02Å; V97-G99 PolarHBondContact O-N 2.95Å |
| 98 | A | 91.6 | Very high | 94.2 | Very high | 60 Ų | 60 | 66.5 Ų | 66.5 | 50% | 0.496 | 40% | 0.402 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.1 | -4 | 174.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | V94 Y95 R96 K100 | V94-A98 WeakPolarHBondContact O-CB 3.37Å; V94-A98 PolarHBondContact O-N 2.73Å; Y95-A98 CarbonylContact O-C 3.48Å; Y95-A98 PolarHBondContact O-N 3.46Å; R96-A98 PolarHBondContact O-N 3.04Å; A98-K100 HydrophobicContact CB-CG 4.5Å; A98-K100 PolarHBondContact O-N 3.04Å |
| 99 | G | 88.3 | Confident | 94.2 | Very high | 72 Ų | 72 | 70.9 Ų | 70.9 | 74% | 0.742 | 43% | 0.428 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 62.6 | 22.8 | -176.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | Y95 R96 V97 | Y95-G99 PolarHBondContact O-N 3.34Å; Y95-G99 VanDerWaalsContact O-N 3.07Å; R96-G99 PolarHBondContact O-N 3.29Å; V97-G99 PolarHBondContact O-N 2.95Å |
| 100 | K | 89.4 | Confident | 94.3 | Very high | 142 Ų | 142 | 69.2 Ų | 69.2 | 62% | 0.617 | 42% | 0.421 | S | S | * | . | trans | -104.6 | 134.2 | -177.2 | -76.8 | -163 | 162.6 | 82.4 | 0 | 111.4 | Y95 A98 | Y95-K100 HydrophobicContact CD1-CB 3.93Å; Y95-K100 WeakPolarHBondContact CD1-O 3.43Å; Y95-K100 HydrophobicContact CE1-CB 4.4Å; Y95-K100 PolarHBondContact O-N 3.41Å; A98-K100 HydrophobicContact CB-CG 4.5Å; A98-K100 PolarHBondContact O-N 3.04Å | ||
| 101 | G | 89.8 | Confident | 94.3 | Very high | 67 Ų | 67 | 66.6 Ų | 66.6 | 69% | 0.691 | 40% | 0.4 | S | S | * | . | P | Polyproline II helix | trans | -71.2 | 153.5 | 161.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||
| 102 | M | 94.2 | Very high | 94.4 | Very high | 31 Ų | 31 | 68.3 Ų | 68.3 | 15% | 0.153 | 41% | 0.41 | C | S | . | . | P | Polyproline II helix | trans | -102 | 124.2 | 178.6 | -177.8 | -179.9 | -74.1 | 0 | 0 | 110.3 | M32 V36 V91 Y95 E106 A107 F110 | M32-M102 HydrophobicContact CE-CB 3.63Å; M32-M102 HydrophobicContact CE-CE 4.28Å; M32-M102 HydrophobicContact CG-CB 4.18Å; V36-M102 HydrophobicContact CG2-CE 3.76Å; V36-M102 HydrophobicContact CG2-SD 3.44Å; V36-M102 WeakPolarHBondContact CG2-SD 3.39Å; V91-M102 HydrophobicContact CG1-CE 3.58Å; Y95-M102 HydrophobicContact CD1-CB 3.97Å; Y95-M102 HydrophobicContact CD1-CE 4.29Å; Y95-M102 HydrophobicContact CD2-CE 3.55Å; Y95-M102 HydrophobicContact CE1-CB 3.92Å; Y95-M102 HydrophobicContact CE1-CE 4.3Å; Y95-M102 HydrophobicContact CE1-CG 4.19Å; Y95-M102 HydrophobicContact CE2-CE 3.57Å; Y95-M102 HydrophobicContact CG-CE 3.94Å; M102-E106 HydrophobicContact CG-CB 3.85Å; M102-A107 HydrophobicContact CG-CB 4.26Å; M102-A107 HydrophobicContact SD-CB 3.68Å; M102-F110 HydrophobicContact CE-CD2 4.37Å |
| 103 | A | 95.2 | Very high | 94.5 | Very high | 53 Ų | 53 | 69.6 Ų | 69.6 | 44% | 0.438 | 42% | 0.423 | S | S | . | . | P | Polyproline II helix | trans | -72.1 | 152.7 | 172.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | L105 E106 A107 | A103-L105 VanDerWaalsContact C-N 3.27Å; A103-L105 PolarHBondContact O-N 2.91Å; A103-E106 HydrophobicContact CB-CG 4.18Å; A103-E106 WeakPolarHBondContact O-CB 3.27Å; A103-E106 PolarHBondContact O-N 3Å; A103-E106 VanDerWaalsContact O-N 3.08Å; A103-A107 PolarHBondContact O-N 3.49Å |
| 104 | P | 94.3 | Very high | 94.6 | Very high | 107 Ų | 107 | 68.4 Ų | 68.4 | 70% | 0.695 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -57.8 | -35.6 | -179.5 | -27.3 | 35.3 | 0 | 0 | 0 | 114.3 | A107 L108 | P104-A107 PolarHBondContact O-N 3.4Å; P104-L108 PolarHBondContact O-N 3.36Å |
| 105 | L | 96.9 | Very high | 94.7 | Very high | 131 Ų | 131 | 64.3 Ų | 64.3 | 69% | 0.686 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -67.6 | -37.7 | 177.2 | -74.3 | 171.5 | 0 | 0 | 0 | 112.4 | A103 A107 L108 V109 | A103-L105 VanDerWaalsContact C-N 3.27Å; A103-L105 PolarHBondContact O-N 2.91Å; L105-A107 VanDerWaalsContact C-N 3.33Å; L105-L108 WeakPolarHBondContact O-CB 3.41Å; L105-L108 PolarHBondContact O-N 3.15Å; L105-V109 WeakPolarHBondContact O-CG2 3.31Å; L105-V109 PolarHBondContact O-N 3.25Å |
| 106 | E | 97.1 | Very high | 94.8 | Very high | 84 Ų | 84 | 65.2 Ų | 65.2 | 39% | 0.393 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -61.5 | -46 | 174.2 | -65.9 | -70.7 | 130.4 | 0 | 0 | 110 | Y95 M102 A103 L108 V109 F110 | Y95-E106 PolarHBondContact OH-OE2 3.07Å; M102-E106 HydrophobicContact CG-CB 3.85Å; A103-E106 HydrophobicContact CB-CG 4.18Å; A103-E106 WeakPolarHBondContact O-CB 3.27Å; A103-E106 PolarHBondContact O-N 3Å; A103-E106 VanDerWaalsContact O-N 3.08Å; E106-L108 VanDerWaalsContact C-N 3.28Å; E106-L108 PolarHBondContact O-N 3.21Å; E106-V109 PolarHBondContact O-N 2.92Å; E106-F110 WeakPolarHBondContact O-CD2 3.31Å; E106-F110 PolarHBondContact O-N 3.01Å |
| 107 | A | 97.2 | Very high | 95.1 | Very high | 2 Ų | 2 | 64.8 Ų | 64.8 | 2% | 0.017 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -59 | -41.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | W35 V36 M102 A103 P104 L105 G111 | W35-A107 HydrophobicContact CB-CB 3.91Å; V36-A107 HydrophobicContact CG2-CB 4.23Å; M102-A107 HydrophobicContact CG-CB 4.26Å; M102-A107 HydrophobicContact SD-CB 3.68Å; A103-A107 PolarHBondContact O-N 3.49Å; P104-A107 PolarHBondContact O-N 3.4Å; L105-A107 VanDerWaalsContact C-N 3.33Å; A107-G111 PolarHBondContact O-N 2.87Å |
| 108 | L | 97.9 | Very high | 95.2 | Very high | 56 Ų | 56 | 61.5 Ų | 61.5 | 29% | 0.293 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -61.8 | -49 | 174.8 | -179.6 | 152.2 | 0 | 0 | 0 | 111.6 | W39 P104 L105 E106 F110 G111 V112 | W39-L108 HydrophobicContact CD2-CB 4.09Å; W39-L108 HydrophobicContact CD2-CD1 4.21Å; W39-L108 HydrophobicContact CD2-CG 4.13Å; W39-L108 HydrophobicContact CE3-CD1 4.15Å; W39-L108 HydrophobicContact CE3-CG 4.3Å; W39-L108 HydrophobicContact CG-CB 4.11Å; W39-L108 HydrophobicContact CG-CG 4.48Å; W39-L108 HydrophobicContact CH2-CD1 3.99Å; W39-L108 HydrophobicContact CZ2-CD1 4.03Å; W39-L108 HydrophobicContact CZ3-CD1 4.05Å; P104-L108 PolarHBondContact O-N 3.36Å; L105-L108 WeakPolarHBondContact O-CB 3.41Å; L105-L108 PolarHBondContact O-N 3.15Å; E106-L108 VanDerWaalsContact C-N 3.28Å; E106-L108 PolarHBondContact O-N 3.21Å; L108-F110 PolarHBondContact O-N 2.9Å; L108-G111 PolarHBondContact O-N 3.48Å; L108-V112 HydrophobicContact CD2-CG2 4.31Å; L108-V112 HydrophobicContact CG-CG2 4.37Å; L108-V112 WeakPolarHBondContact O-CB 3.32Å; L108-V112 WeakPolarHBondContact O-CG2 3.43Å; L108-V112 PolarHBondContact O-N 3.22Å |
| 109 | V | 98.3 | Very high | 95.2 | Very high | 92 Ų | 92 | 61.1 Ų | 61.1 | 56% | 0.558 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -61.9 | -45 | -179.8 | 170.7 | 0 | 0 | 0 | 0 | 111 | L105 E106 G113 | L105-V109 WeakPolarHBondContact O-CG2 3.31Å; L105-V109 PolarHBondContact O-N 3.25Å; E106-V109 PolarHBondContact O-N 2.92Å; V109-G113 WeakPolarHBondContact O-CA 3.37Å; V109-G113 PolarHBondContact O-N 3.4Å |
| 110 | F | 97.8 | Very high | 95.5 | Very high | 74 Ų | 74 | 62.6 Ų | 62.6 | 33% | 0.325 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -64.7 | -42.2 | 176 | -78.5 | -67.1 | 0 | 0 | 0 | 112.2 | V36 V91 Y95 M102 E106 L108 Q114 | V36-F110 HydrophobicContact CG1-CB 3.72Å; V36-F110 HydrophobicContact CG2-CB 4.26Å; V91-F110 HydrophobicContact CG1-CD1 4.09Å; V91-F110 HydrophobicContact CG1-CD2 3.93Å; V91-F110 HydrophobicContact CG1-CE1 4.29Å; V91-F110 HydrophobicContact CG1-CE2 4.16Å; V91-F110 HydrophobicContact CG1-CG 3.92Å; V91-F110 HydrophobicContact CG1-CZ 4.33Å; V91-F110 HydrophobicContact CG2-CD1 4.06Å; V91-F110 HydrophobicContact CG2-CE1 4.46Å; V91-F110 HydrophobicContact CG2-CG 4.46Å; Y95-F110 HydrophobicContact CE2-CD2 4.5Å; Y95-F110 AromaticContact CE2-CE2 3.71Å; Y95-F110 HydrophobicContact CE2-CE2 3.71Å; Y95-F110 HydrophobicContact CE2-CZ 4.22Å; M102-F110 HydrophobicContact CE-CD2 4.37Å; E106-F110 WeakPolarHBondContact O-CD2 3.31Å; E106-F110 PolarHBondContact O-N 3.01Å; L108-F110 PolarHBondContact O-N 2.9Å; F110-Q114 VanDerWaalsContact O-CG 3.31Å; F110-Q114 WeakPolarHBondContact O-CG 3.44Å; F110-Q114 PolarHBondContact O-N 2.79Å |
| 111 | G | 97.4 | Very high | 95.6 | Very high | 0 Ų | 0 | 61.3 Ų | 61.3 | 0% | 0 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -64.7 | -53.3 | -180 | 0 | 0 | 0 | 0 | 0 | 112.7 | V36 C40 A107 L108 G113 Q114 T115 | V36-G111 WeakPolarHBondContact O-CA 3.39Å; C40-G111 WeakPolarHBondContact CA-O 3.4Å; C40-G111 WeakPolarHBondContact CB-O 3.32Å; A107-G111 PolarHBondContact O-N 2.87Å; L108-G111 PolarHBondContact O-N 3.48Å; G111-G113 VanDerWaalsContact C-N 3.29Å; G111-G113 PolarHBondContact O-N 3.26Å; G111-Q114 PolarHBondContact O-N 3.29Å; G111-T115 PolarHBondContact O-N 3.48Å |
| 112 | V | 97.9 | Very high | 95.6 | Very high | 56 Ų | 56 | 60.4 Ų | 60.4 | 34% | 0.339 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -64.9 | -36.5 | 177.2 | 177.2 | 0 | 0 | 0 | 0 | 111.1 | L108 Q114 T115 S116 | L108-V112 HydrophobicContact CD2-CG2 4.31Å; L108-V112 HydrophobicContact CG-CG2 4.37Å; L108-V112 WeakPolarHBondContact O-CB 3.32Å; L108-V112 WeakPolarHBondContact O-CG2 3.43Å; L108-V112 PolarHBondContact O-N 3.22Å; V112-Q114 PolarHBondContact O-N 2.92Å; V112-T115 PolarHBondContact O-N 3.49Å; V112-S116 PolarHBondContact O-N 2.84Å; V112-S116 PolarHBondContact O-OG 2.94Å |
| 113 | G | 97.3 | Very high | 95.3 | Very high | 26 Ų | 26 | 65.7 Ų | 65.7 | 27% | 0.268 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -60.4 | -42.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | V109 G111 T115 S116 L117 | V109-G113 WeakPolarHBondContact O-CA 3.37Å; V109-G113 PolarHBondContact O-N 3.4Å; G111-G113 VanDerWaalsContact C-N 3.29Å; G111-G113 PolarHBondContact O-N 3.26Å; G113-T115 PolarHBondContact O-N 3.24Å; G113-S116 PolarHBondContact O-N 3.35Å; G113-L117 WeakPolarHBondContact O-CB 3.18Å; G113-L117 WeakPolarHBondContact O-CG 3.18Å; G113-L117 PolarHBondContact O-N 3.47Å |
| 114 | Q | 96.8 | Very high | 95.1 | Very high | 23 Ų | 23 | 66.4 Ų | 66.4 | 11% | 0.107 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -59.2 | -44.6 | 174.5 | -75.4 | 174.8 | 19.5 | 0 | 0 | 112.1 | C40 T87 S88 F110 G111 V112 S118 | C40-Q114 PolarHBondContact SG-OE1 3.17Å; C40-Q114 VanDerWaalsContact SG-OE1 3.33Å; T87-Q114 HydrophobicContact CG2-CG 4Å; S88-Q114 PolarHBondContact OG-NE2 3.48Å; S88-Q114 PolarHBondContact OG-OE1 3.07Å; F110-Q114 VanDerWaalsContact O-CG 3.31Å; F110-Q114 WeakPolarHBondContact O-CG 3.44Å; F110-Q114 PolarHBondContact O-N 2.79Å; G111-Q114 PolarHBondContact O-N 3.29Å; V112-Q114 PolarHBondContact O-N 2.92Å; Q114-S118 WeakPolarHBondContact O-CB 3.27Å; Q114-S118 PolarHBondContact O-N 2.91Å |
| 115 | T | 96.8 | Very high | 94.8 | Very high | 10 Ų | 10 | 69.2 Ų | 69.2 | 6% | 0.061 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -63.1 | -45.5 | 177 | -62.6 | 0 | 0 | 0 | 0 | 110.8 | C40 S43 V47 G111 V112 G113 L117 S118 I119 | C40-T115 PolarHBondContact O-OG1 2.89Å; S43-T115 WeakPolarHBondContact OG-CB 3.29Å; S43-T115 PolarHBondContact OG-OG1 3.49Å; V47-T115 HydrophobicContact CG2-CG2 4.14Å; G111-T115 PolarHBondContact O-N 3.48Å; V112-T115 PolarHBondContact O-N 3.49Å; G113-T115 PolarHBondContact O-N 3.24Å; T115-L117 PolarHBondContact O-N 3.44Å; T115-S118 WeakPolarHBondContact O-CB 3.41Å; T115-S118 PolarHBondContact O-N 3.39Å; T115-I119 HydrophobicContact CG2-CD1 4Å; T115-I119 VanDerWaalsContact O-CG1 3.28Å; T115-I119 WeakPolarHBondContact O-CG1 3.25Å; T115-I119 PolarHBondContact O-N 2.98Å |
| 116 | S | 96.1 | Very high | 94.4 | Very high | 53 Ų | 53 | 66.9 Ų | 66.9 | 37% | 0.371 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -61.5 | -45.6 | 179.8 | -55.9 | 0 | 0 | 0 | 0 | 112 | V112 G113 I119 I120 | V112-S116 PolarHBondContact O-N 2.84Å; V112-S116 PolarHBondContact O-OG 2.94Å; G113-S116 PolarHBondContact O-N 3.35Å; S116-I119 PolarHBondContact O-N 2.72Å; S116-I120 VanDerWaalsContact O-CG1 3.31Å; S116-I120 WeakPolarHBondContact O-CG1 3.39Å; S116-I120 PolarHBondContact O-N 3.38Å |
| 117 | L | 95.4 | Very high | 93.6 | Very high | 105 Ų | 105 | 69.1 Ų | 69.1 | 55% | 0.55 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -63.9 | -41.5 | 175.9 | -72.3 | 172.9 | 0 | 0 | 0 | 111.9 | G113 T115 I119 I120 I121 | G113-L117 WeakPolarHBondContact O-CB 3.18Å; G113-L117 WeakPolarHBondContact O-CG 3.18Å; G113-L117 PolarHBondContact O-N 3.47Å; T115-L117 PolarHBondContact O-N 3.44Å; L117-I119 VanDerWaalsContact C-N 3.3Å; L117-I119 PolarHBondContact O-N 3.19Å; L117-I120 PolarHBondContact O-N 3.33Å; L117-I121 WeakPolarHBondContact O-CB 3.31Å; L117-I121 WeakPolarHBondContact O-CD1 3.5Å; L117-I121 VanDerWaalsContact O-CG1 3.23Å; L117-I121 WeakPolarHBondContact O-CG1 3.28Å; L117-I121 PolarHBondContact O-N 2.99Å |
| 118 | S | 93.4 | Very high | 93 | Very high | 47 Ų | 47 | 73 Ų | 73 | 33% | 0.329 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -59.1 | -43 | 176 | -178.2 | 0 | 0 | 0 | 0 | 111.6 | Q114 T115 S122 | Q114-S118 WeakPolarHBondContact O-CB 3.27Å; Q114-S118 PolarHBondContact O-N 2.91Å; T115-S118 WeakPolarHBondContact O-CB 3.41Å; T115-S118 PolarHBondContact O-N 3.39Å; S118-S122 VanDerWaalsContact O-CB 3.26Å; S118-S122 WeakPolarHBondContact O-CB 3.49Å; S118-S122 PolarHBondContact O-N 3.06Å |
| 119 | I | 92.4 | Very high | 92.6 | Very high | 53 Ų | 53 | 75.8 Ų | 75.8 | 27% | 0.272 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -61.3 | -51.5 | 175.1 | -67 | 163 | 0 | 0 | 0 | 110.5 | V47 T115 S116 L117 I121 S122 F123 | V47-I119 HydrophobicContact CB-CD1 4.38Å; V47-I119 HydrophobicContact CG1-CD1 3.75Å; V47-I119 HydrophobicContact CG1-CG1 4.25Å; V47-I119 HydrophobicContact CG2-CD1 3.94Å; T115-I119 HydrophobicContact CG2-CD1 4Å; T115-I119 VanDerWaalsContact O-CG1 3.28Å; T115-I119 WeakPolarHBondContact O-CG1 3.25Å; T115-I119 PolarHBondContact O-N 2.98Å; S116-I119 PolarHBondContact O-N 2.72Å; L117-I119 VanDerWaalsContact C-N 3.3Å; L117-I119 PolarHBondContact O-N 3.19Å; I119-I121 PolarHBondContact O-N 2.89Å; I119-S122 PolarHBondContact O-N 3.29Å; I119-S122 VanDerWaalsContact O-N 3.16Å; I119-F123 HydrophobicContact CG2-CD2 3.58Å; I119-F123 HydrophobicContact CG2-CE2 3.64Å; I119-F123 WeakPolarHBondContact O-CD2 3.49Å; I119-F123 PolarHBondContact O-N 2.93Å |
| 120 | I | 94.1 | Very high | 91.5 | Very high | 102 Ų | 102 | 80.4 Ų | 80.4 | 52% | 0.523 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -56.5 | -49.8 | 180 | -69 | 164.4 | 0 | 0 | 0 | 110.5 | S116 L117 S122 F123 S124 | S116-I120 VanDerWaalsContact O-CG1 3.31Å; S116-I120 WeakPolarHBondContact O-CG1 3.39Å; S116-I120 PolarHBondContact O-N 3.38Å; L117-I120 PolarHBondContact O-N 3.33Å; I120-S122 VanDerWaalsContact C-N 3.32Å; I120-S122 PolarHBondContact O-N 3.48Å; I120-F123 PolarHBondContact O-N 3.26Å; I120-S124 WeakPolarHBondContact O-CB 3.45Å; I120-S124 PolarHBondContact O-N 3.07Å; I120-S124 PolarHBondContact O-OG 2.81Å |
| 121 | I | 91.8 | Very high | 91.2 | Very high | 116 Ų | 116 | 80.8 Ų | 80.8 | 60% | 0.595 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -61.3 | -42.6 | 178.9 | -67.4 | 164.7 | 0 | 0 | 0 | 110.7 | L117 I119 S124 R125 | L117-I121 WeakPolarHBondContact O-CB 3.31Å; L117-I121 WeakPolarHBondContact O-CD1 3.5Å; L117-I121 VanDerWaalsContact O-CG1 3.23Å; L117-I121 WeakPolarHBondContact O-CG1 3.28Å; L117-I121 PolarHBondContact O-N 2.99Å; I119-I121 PolarHBondContact O-N 2.89Å; I121-S124 PolarHBondContact O-N 3.48Å; I121-R125 WeakPolarHBondContact O-CB 3.44Å; I121-R125 PolarHBondContact O-N 3.03Å |
| 122 | S | 89.1 | Confident | 90.9 | Very high | 48 Ų | 48 | 85 Ų | 85 | 34% | 0.336 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -62.9 | -44.3 | 179.5 | -171.2 | 0 | 0 | 0 | 0 | 112 | S118 I119 I120 R125 I126 | S118-S122 VanDerWaalsContact O-CB 3.26Å; S118-S122 WeakPolarHBondContact O-CB 3.49Å; S118-S122 PolarHBondContact O-N 3.06Å; I119-S122 PolarHBondContact O-N 3.29Å; I119-S122 VanDerWaalsContact O-N 3.16Å; I120-S122 VanDerWaalsContact C-N 3.32Å; I120-S122 PolarHBondContact O-N 3.48Å; S122-R125 PolarHBondContact O-N 3.45Å; S122-I126 WeakPolarHBondContact O-CG1 3.42Å; S122-I126 PolarHBondContact O-N 3.44Å |
| 123 | F | 87.4 | Confident | 90.5 | Very high | 142 Ų | 142 | 86.6 Ų | 86.6 | 62% | 0.623 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -65.1 | -45.3 | 175.5 | -86.9 | -73.5 | 0 | 0 | 0 | 112.2 | I119 I120 R125 I126 L127 | I119-F123 HydrophobicContact CG2-CD2 3.58Å; I119-F123 HydrophobicContact CG2-CE2 3.64Å; I119-F123 WeakPolarHBondContact O-CD2 3.49Å; I119-F123 PolarHBondContact O-N 2.93Å; I120-F123 PolarHBondContact O-N 3.26Å; F123-R125 VanDerWaalsContact C-N 3.26Å; F123-R125 PolarHBondContact O-N 3.4Å; F123-I126 PolarHBondContact O-N 3.33Å; F123-L127 PolarHBondContact O-N 3.09Å |
| 124 | S | 92 | Very high | 90.1 | Very high | 67 Ų | 67 | 90.2 Ų | 90.2 | 47% | 0.469 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -58.4 | -38.6 | 177 | -64.7 | 0 | 0 | 0 | 0 | 112.2 | I120 I121 L127 A128 | I120-S124 WeakPolarHBondContact O-CB 3.45Å; I120-S124 PolarHBondContact O-N 3.07Å; I120-S124 PolarHBondContact O-OG 2.81Å; I121-S124 PolarHBondContact O-N 3.48Å; S124-L127 PolarHBondContact O-N 3.37Å; S124-A128 WeakPolarHBondContact O-CB 3.46Å; S124-A128 PolarHBondContact O-N 3.36Å |
| 125 | R | 88.7 | Confident | 89.6 | Confident | 167 Ų | 167 | 94.4 Ų | 94.4 | 63% | 0.63 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -64.3 | -46 | 176.8 | -174.3 | -178.5 | 65.7 | -169.8 | -2.5 | 111.9 | I121 S122 F123 L127 A128 T129 | I121-R125 WeakPolarHBondContact O-CB 3.44Å; I121-R125 PolarHBondContact O-N 3.03Å; S122-R125 PolarHBondContact O-N 3.45Å; F123-R125 VanDerWaalsContact C-N 3.26Å; F123-R125 PolarHBondContact O-N 3.4Å; R125-L127 VanDerWaalsContact C-N 3.33Å; R125-A128 PolarHBondContact O-N 3.29Å; R125-T129 WeakPolarHBondContact O-CG2 3.32Å; R125-T129 PolarHBondContact O-N 2.96Å; R125-T129 PolarHBondContact O-OG1 2.97Å; R125-T129 VanDerWaalsContact O-OG1 3.14Å |
| 126 | I | 86.8 | Confident | 89.2 | Confident | 81 Ų | 81 | 100 Ų | 100 | 42% | 0.415 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -60.8 | -47 | 178.5 | -66.5 | 166 | 0 | 0 | 0 | 109.7 | S122 F123 A128 T129 L130 | S122-I126 WeakPolarHBondContact O-CG1 3.42Å; S122-I126 PolarHBondContact O-N 3.44Å; F123-I126 PolarHBondContact O-N 3.33Å; I126-A128 VanDerWaalsContact C-N 3.29Å; I126-A128 PolarHBondContact O-N 3.05Å; I126-T129 PolarHBondContact O-N 3.16Å; I126-T129 VanDerWaalsContact O-N 3.13Å; I126-T129 PolarHBondContact O-OG1 3.4Å; I126-L130 HydrophobicContact CG2-CD1 3.82Å; I126-L130 HydrophobicContact CG2-CG 4.43Å; I126-L130 WeakPolarHBondContact O-CG 3.49Å; I126-L130 PolarHBondContact O-N 3.32Å |
| 127 | L | 81.4 | Confident | 88.7 | Confident | 132 Ų | 132 | 103.4 Ų | 103.4 | 69% | 0.691 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -60.5 | -37.1 | 178.5 | -176.6 | 62.7 | 0 | 0 | 0 | 112.6 | F123 S124 R125 T129 | F123-L127 PolarHBondContact O-N 3.09Å; S124-L127 PolarHBondContact O-N 3.37Å; R125-L127 VanDerWaalsContact C-N 3.33Å; L127-T129 VanDerWaalsContact C-N 3.28Å; L127-T129 PolarHBondContact O-N 3.17Å |
| 128 | A | 85.1 | Confident | 88.1 | Confident | 84 Ų | 84 | 103.2 Ų | 103.2 | 69% | 0.694 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -72.9 | -18.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114 | S124 R125 I126 | S124-A128 WeakPolarHBondContact O-CB 3.46Å; S124-A128 PolarHBondContact O-N 3.36Å; R125-A128 PolarHBondContact O-N 3.29Å; I126-A128 VanDerWaalsContact C-N 3.29Å; I126-A128 PolarHBondContact O-N 3.05Å |
| 129 | T | 87.8 | Confident | 87.7 | Confident | 113 Ų | 113 | 107.9 Ų | 107.9 | 69% | 0.693 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -102.7 | -4.9 | -178.7 | 54.3 | 0 | 0 | 0 | 0 | 114.3 | R125 I126 L127 | R125-T129 WeakPolarHBondContact O-CG2 3.32Å; R125-T129 PolarHBondContact O-N 2.96Å; R125-T129 PolarHBondContact O-OG1 2.97Å; R125-T129 VanDerWaalsContact O-OG1 3.14Å; I126-T129 PolarHBondContact O-N 3.16Å; I126-T129 VanDerWaalsContact O-N 3.13Å; I126-T129 PolarHBondContact O-OG1 3.4Å; L127-T129 VanDerWaalsContact C-N 3.28Å; L127-T129 PolarHBondContact O-N 3.17Å |
| 130 | L | 75.9 | Confident | 87.3 | Confident | 190 Ų | 190 | 112.9 Ų | 112.9 | 100% | 0.995 | 61% | 0.606 | S | S | * | * | trans | -93.4 | 0 | 173.5 | -74.9 | 169.6 | 0 | 0 | 0 | 109.9 | I126 | I126-L130 HydrophobicContact CG2-CD1 3.82Å; I126-L130 HydrophobicContact CG2-CG 4.43Å; I126-L130 WeakPolarHBondContact O-CG 3.49Å; I126-L130 PolarHBondContact O-N 3.32Å |
Retrieved 130 of 130 residues in 176.5 ms
(Link to these results)