| 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 | 83.9 | Confident | 80.4 | Confident | 92 Ų | 92 | 84.4 Ų | 84.4 | 45% | 0.453 | 41% | 0.405 | S | S | . | . | 0 | -54.8 | 0 | -62.1 | -44.4 | 178.2 | 0 | 0 | 113.4 | V3 F4 S5 L20 F23 | M1-V3 VanDerWaalsContact C-N 3.34Å; M1-V3 PolarHBondContact O-N 3.24Å; M1-F4 PolarHBondContact O-N 3.38Å; M1-F4 HydrophobicContact SD-CD2 4.31Å; M1-S5 PolarHBondContact O-N 2.96Å; M1-S5 PolarHBondContact O-OG 3.01Å; M1-L20 HydrophobicContact CB-CG 4.39Å; M1-L20 HydrophobicContact SD-CD1 3.98Å; M1-L20 HydrophobicContact SD-CG 4.22Å; M1-F23 HydrophobicContact CE-CD1 4.4Å; M1-F23 HydrophobicContact CE-CE1 4.3Å | |||
| 2 | R | 85.4 | Confident | 80.2 | Confident | 132 Ų | 132 | 81.2 Ų | 81.2 | 50% | 0.498 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -53.3 | -45.6 | 178.4 | -70.2 | -173.2 | -179.3 | -177.6 | 1.7 | 114.3 | F4 S5 S6 | R2-F4 PolarHBondContact O-N 2.83Å; R2-S5 WeakPolarHBondContact CA-OG 3.38Å; R2-S5 PolarHBondContact O-N 3.48Å; R2-S5 PolarHBondContact O-OG 2.94Å; R2-S6 PolarHBondContact O-N 2.97Å; R2-S6 PolarHBondContact O-OG 3.42Å; R2-S6 VanDerWaalsContact O-OG 3.07Å |
| 3 | V | 86.5 | Confident | 80.5 | Confident | 19 Ų | 19 | 81 Ų | 81 | 12% | 0.115 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -59.3 | -45.2 | 175.9 | 172.3 | 0 | 0 | 0 | 0 | 111.8 | M1 S5 S6 A7 N88 Y89 L92 | M1-V3 VanDerWaalsContact C-N 3.34Å; M1-V3 PolarHBondContact O-N 3.24Å; V3-S5 VanDerWaalsContact C-N 3.35Å; V3-S5 PolarHBondContact O-N 2.91Å; V3-S6 CarbonylContact O-C 3.59Å; V3-S6 PolarHBondContact O-N 3.25Å; V3-S6 PolarHBondContact O-OG 3.02Å; V3-A7 WeakPolarHBondContact O-CB 3.49Å; V3-A7 PolarHBondContact O-N 3.24Å; V3-N88 HydrophobicContact CG2-CB 3.98Å; V3-N88 WeakPolarHBondContact CG2-O 3.44Å; V3-Y89 HydrophobicContact CG1-CD1 3.9Å; V3-Y89 HydrophobicContact CG1-CE1 3.35Å; V3-Y89 HydrophobicContact CG1-CE2 4.18Å; V3-Y89 HydrophobicContact CG2-CD1 4.4Å; V3-L92 HydrophobicContact CG2-CB 4.04Å; V3-L92 HydrophobicContact CG2-CD2 3.98Å |
| 4 | F | 84.8 | Confident | 80.5 | Confident | 122 Ų | 122 | 82.3 Ų | 82.3 | 54% | 0.535 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -64 | -37.6 | 177.4 | -68.8 | -60.6 | 0 | 0 | 0 | 112.5 | M1 R2 S6 I10 L20 | M1-F4 PolarHBondContact O-N 3.38Å; M1-F4 HydrophobicContact SD-CD2 4.31Å; R2-F4 PolarHBondContact O-N 2.83Å; F4-S6 VanDerWaalsContact C-N 3.32Å; F4-S6 PolarHBondContact O-N 3.2Å; F4-I10 HydrophobicContact CB-CD1 4.5Å; F4-I10 HydrophobicContact CD1-CD1 3.92Å; F4-L20 HydrophobicContact CB-CD2 3.7Å |
| 5 | S | 82.6 | Confident | 80.9 | Confident | 8 Ų | 8 | 82.5 Ų | 82.5 | 6% | 0.056 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -70.7 | -27.5 | 177.1 | 55.3 | 0 | 0 | 0 | 0 | 113.3 | M1 R2 V3 R17 I21 | M1-S5 PolarHBondContact O-N 2.96Å; M1-S5 PolarHBondContact O-OG 3.01Å; R2-S5 WeakPolarHBondContact CA-OG 3.38Å; R2-S5 PolarHBondContact O-N 3.48Å; R2-S5 PolarHBondContact O-OG 2.94Å; V3-S5 VanDerWaalsContact C-N 3.35Å; V3-S5 PolarHBondContact O-N 2.91Å; S5-R17 WeakPolarHBondContact O-CD 3.44Å; S5-I21 VanDerWaalsContact OG-CG1 3.26Å; S5-I21 WeakPolarHBondContact OG-CG1 3.5Å |
| 6 | S | 81.7 | Confident | 81.3 | Confident | 22 Ų | 22 | 78.6 Ų | 78.6 | 15% | 0.154 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -98.8 | -3.5 | -179.3 | 66.2 | 0 | 0 | 0 | 0 | 113.5 | R2 V3 F4 P8 V85 N88 | R2-S6 PolarHBondContact O-N 2.97Å; R2-S6 PolarHBondContact O-OG 3.42Å; R2-S6 VanDerWaalsContact O-OG 3.07Å; V3-S6 CarbonylContact O-C 3.59Å; V3-S6 PolarHBondContact O-N 3.25Å; V3-S6 PolarHBondContact O-OG 3.02Å; F4-S6 VanDerWaalsContact C-N 3.32Å; F4-S6 PolarHBondContact O-N 3.2Å; S6-P8 WeakPolarHBondContact O-CD 3.35Å; S6-V85 WeakPolarHBondContact O-CG2 3.36Å; S6-N88 PolarHBondContact OG-ND2 3.43Å |
| 7 | A | 79.5 | Confident | 81.6 | Confident | 7 Ų | 7 | 79.6 Ų | 79.6 | 6% | 0.058 | 42% | 0.415 | C | S | . | . | trans | -68 | 121.7 | -177 | 0 | 0 | 0 | 0 | 0 | 110.1 | V3 Y9 I10 | V3-A7 WeakPolarHBondContact O-CB 3.49Å; V3-A7 PolarHBondContact O-N 3.24Å; A7-Y9 PolarHBondContact O-N 3.33Å; A7-I10 HydrophobicContact CB-CB 4.49Å; A7-I10 HydrophobicContact CB-CD1 3.83Å; A7-I10 HydrophobicContact CB-CG1 3.86Å; A7-I10 PolarHBondContact O-N 3.04Å | ||
| 8 | P | 73.1 | Confident | 82 | Confident | 81 Ų | 81 | 81.3 Ų | 81.3 | 53% | 0.526 | 42% | 0.424 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.7 | -25.7 | -175.3 | 24.6 | -33.3 | 0 | 0 | 0 | 112.9 | S6 I10 | S6-P8 WeakPolarHBondContact O-CD 3.35Å; P8-I10 VanDerWaalsContact C-N 3.34Å |
| 9 | Y | 74.8 | Confident | 82.5 | Confident | 213 Ų | 213 | 83.3 Ų | 83.3 | 84% | 0.835 | 43% | 0.434 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.7 | -9.4 | -177.3 | -51.7 | -69.4 | 0 | 0 | 0 | 114.2 | A7 | A7-Y9 PolarHBondContact O-N 3.33Š|
| 10 | I | 75.5 | Confident | 82.9 | Confident | 63 Ų | 63 | 81.3 Ų | 81.3 | 32% | 0.323 | 42% | 0.424 | S | S | . | . | S | Bend | trans | -102.5 | 108.7 | -177.7 | -48.6 | -178.5 | 0 | 0 | 0 | 108.8 | F4 A7 P8 I12 | F4-I10 HydrophobicContact CB-CD1 4.5Å; F4-I10 HydrophobicContact CD1-CD1 3.92Å; A7-I10 HydrophobicContact CB-CB 4.49Å; A7-I10 HydrophobicContact CB-CD1 3.83Å; A7-I10 HydrophobicContact CB-CG1 3.86Å; A7-I10 PolarHBondContact O-N 3.04Å; P8-I10 VanDerWaalsContact C-N 3.34Å; I10-I12 HydrophobicContact CB-CD1 4.21Å; I10-I12 HydrophobicContact CG2-CD1 3.55Å; I10-I12 HydrophobicContact CG2-CG1 3.66Å; I10-I12 PolarHBondContact O-N 3.35Å |
| 11 | N | 76.5 | Confident | 83.2 | Confident | 169 Ų | 169 | 80 Ų | 80 | 90% | 0.904 | 42% | 0.417 | S | S | * | . | trans | -71.9 | 76.3 | 176.5 | -98.6 | -11.1 | 0 | 0 | 0 | 111.2 | ||||
| 12 | I | 78.4 | Confident | 83.6 | Confident | 46 Ų | 46 | 78.9 Ų | 78.9 | 24% | 0.236 | 42% | 0.415 | C | S | . | . | trans | -102.2 | 131.6 | 170.2 | -61 | 155.3 | 0 | 0 | 0 | 108.7 | I10 R17 L20 | I10-I12 HydrophobicContact CB-CD1 4.21Å; I10-I12 HydrophobicContact CG2-CD1 3.55Å; I10-I12 HydrophobicContact CG2-CG1 3.66Å; I10-I12 PolarHBondContact O-N 3.35Å; I12-R17 HydrophobicContact CB-CG 3.9Å; I12-R17 HydrophobicContact CG2-CB 4.47Å; I12-R17 HydrophobicContact CG2-CG 3.73Å; I12-R17 VanDerWaalsContact CG2-N 3.32Å; I12-R17 PolarHBondContact O-NE 3.07Å; I12-L20 HydrophobicContact CD1-CD2 4.49Å | ||
| 13 | S | 84.1 | Confident | 84 | Confident | 79 Ų | 79 | 77.9 Ų | 77.9 | 55% | 0.552 | 42% | 0.415 | S | S | * | . | trans | -58.8 | 152.1 | 172.7 | 64.2 | 0 | 0 | 0 | 0 | 111.8 | P15 G16 R17 | S13-P15 VanDerWaalsContact C-CD 3.5Å; S13-P15 VanDerWaalsContact C-N 3.33Å; S13-G16 WeakPolarHBondContact O-CA 3.31Å; S13-G16 PolarHBondContact O-N 2.72Å; S13-G16 PolarHBondContact OG-N 3.47Å; S13-R17 PolarHBondContact O-N 3.3Å | ||
| 14 | S | 80.9 | Confident | 84.2 | Confident | 99 Ų | 99 | 77.8 Ų | 77.8 | 69% | 0.692 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -52.3 | -43.2 | -179.8 | -50.3 | 0 | 0 | 0 | 0 | 113.7 | R17 L18 | S14-R17 PolarHBondContact O-N 3.46Å; S14-L18 PolarHBondContact O-N 3.07Å |
| 15 | P | 86.2 | Confident | 84.5 | Confident | 85 Ų | 85 | 76.6 Ų | 76.6 | 55% | 0.552 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -64.1 | -39.1 | 173.4 | -21.6 | 34.1 | 0 | 0 | 0 | 113.2 | S13 R17 L18 I19 | S13-P15 VanDerWaalsContact C-CD 3.5Å; S13-P15 VanDerWaalsContact C-N 3.33Å; P15-R17 VanDerWaalsContact C-N 3.31Å; P15-R17 PolarHBondContact O-N 2.98Å; P15-L18 WeakPolarHBondContact O-CB 3.45Å; P15-L18 PolarHBondContact O-N 3.26Å; P15-I19 WeakPolarHBondContact O-CG1 3.26Å; P15-I19 PolarHBondContact O-N 3.04Å |
| 16 | G | 87 | Confident | 85 | Confident | 20 Ų | 20 | 79.5 Ų | 79.5 | 21% | 0.206 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -63.3 | -36.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | S13 I19 L20 | S13-G16 WeakPolarHBondContact O-CA 3.31Å; S13-G16 PolarHBondContact O-N 2.72Å; S13-G16 PolarHBondContact OG-N 3.47Å; G16-I19 PolarHBondContact O-N 3.45Å; G16-L20 PolarHBondContact O-N 3.24Å |
| 17 | R | 86.7 | Confident | 85.5 | Confident | 96 Ų | 96 | 82.6 Ų | 82.6 | 36% | 0.362 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -64.2 | -43.6 | 175.2 | -65.5 | -179.7 | -172.9 | -161.1 | -5.6 | 110.8 | S5 I12 S13 S14 P15 L20 I21 | S5-R17 WeakPolarHBondContact O-CD 3.44Å; I12-R17 HydrophobicContact CB-CG 3.9Å; I12-R17 HydrophobicContact CG2-CB 4.47Å; I12-R17 HydrophobicContact CG2-CG 3.73Å; I12-R17 VanDerWaalsContact CG2-N 3.32Å; I12-R17 PolarHBondContact O-NE 3.07Å; S13-R17 PolarHBondContact O-N 3.3Å; S14-R17 PolarHBondContact O-N 3.46Å; P15-R17 VanDerWaalsContact C-N 3.31Å; P15-R17 PolarHBondContact O-N 2.98Å; R17-L20 PolarHBondContact O-N 3.31Å; R17-I21 VanDerWaalsContact O-CG1 3.31Å; R17-I21 WeakPolarHBondContact O-CG1 3.42Å; R17-I21 PolarHBondContact O-N 3.07Å |
| 18 | L | 87.8 | Confident | 86.1 | Confident | 111 Ų | 111 | 85.1 Ų | 85.1 | 58% | 0.581 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -61.7 | -47.6 | 176.3 | -175.2 | 64.7 | 0 | 0 | 0 | 111.4 | S14 P15 L20 I21 V22 | S14-L18 PolarHBondContact O-N 3.07Å; P15-L18 WeakPolarHBondContact O-CB 3.45Å; P15-L18 PolarHBondContact O-N 3.26Å; L18-L20 VanDerWaalsContact C-N 3.28Å; L18-L20 PolarHBondContact O-N 3.25Å; L18-I21 PolarHBondContact O-N 3.31Å; L18-I21 VanDerWaalsContact O-N 3.15Å; L18-V22 HydrophobicContact CD1-CG2 4.35Å; L18-V22 HydrophobicContact CG-CG2 4.39Å; L18-V22 WeakPolarHBondContact O-CG2 3.41Å; L18-V22 PolarHBondContact O-N 3.48Å |
| 19 | I | 91.4 | Very high | 86.9 | Confident | 119 Ų | 119 | 84.1 Ų | 84.1 | 61% | 0.61 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -57.2 | -43.3 | 177.1 | -68.1 | 165.8 | 0 | 0 | 0 | 110.7 | P15 G16 I21 V22 F23 | P15-I19 WeakPolarHBondContact O-CG1 3.26Å; P15-I19 PolarHBondContact O-N 3.04Å; G16-I19 PolarHBondContact O-N 3.45Å; I19-I21 PolarHBondContact O-N 3.37Å; I19-V22 PolarHBondContact O-N 3.46Å; I19-F23 WeakPolarHBondContact O-CB 3.47Å; I19-F23 PolarHBondContact O-N 3.13Å |
| 20 | L | 90.4 | Very high | 87.6 | Confident | 43 Ų | 43 | 81 Ų | 81 | 23% | 0.225 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -64.9 | -39.4 | 178.9 | -162.5 | 79.1 | 0 | 0 | 0 | 112.5 | M1 F4 I12 G16 R17 L18 G24 | M1-L20 HydrophobicContact CB-CG 4.39Å; M1-L20 HydrophobicContact SD-CD1 3.98Å; M1-L20 HydrophobicContact SD-CG 4.22Å; F4-L20 HydrophobicContact CB-CD2 3.7Å; I12-L20 HydrophobicContact CD1-CD2 4.49Å; G16-L20 PolarHBondContact O-N 3.24Å; R17-L20 PolarHBondContact O-N 3.31Å; L18-L20 VanDerWaalsContact C-N 3.28Å; L18-L20 PolarHBondContact O-N 3.25Å; L20-G24 PolarHBondContact O-N 3.42Å |
| 21 | I | 90.4 | Very high | 88.3 | Confident | 53 Ų | 53 | 80.2 Ų | 80.2 | 27% | 0.272 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -65.4 | -49.1 | 176.2 | -68.6 | 166.2 | 0 | 0 | 0 | 110.2 | S5 R17 L18 I19 G24 Q25 | S5-I21 VanDerWaalsContact OG-CG1 3.26Å; S5-I21 WeakPolarHBondContact OG-CG1 3.5Å; R17-I21 VanDerWaalsContact O-CG1 3.31Å; R17-I21 WeakPolarHBondContact O-CG1 3.42Å; R17-I21 PolarHBondContact O-N 3.07Å; L18-I21 PolarHBondContact O-N 3.31Å; L18-I21 VanDerWaalsContact O-N 3.15Å; I19-I21 PolarHBondContact O-N 3.37Å; I21-G24 PolarHBondContact O-N 2.83Å; I21-Q25 WeakPolarHBondContact O-CG 3.35Å; I21-Q25 PolarHBondContact O-N 3.34Å |
| 22 | V | 92 | Very high | 88.9 | Confident | 69 Ų | 69 | 76.1 Ų | 76.1 | 42% | 0.418 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -61.4 | -46.5 | 179.6 | 171.7 | 0 | 0 | 0 | 0 | 110.4 | L18 I19 G24 Q25 V26 | L18-V22 HydrophobicContact CD1-CG2 4.35Å; L18-V22 HydrophobicContact CG-CG2 4.39Å; L18-V22 WeakPolarHBondContact O-CG2 3.41Å; L18-V22 PolarHBondContact O-N 3.48Å; I19-V22 PolarHBondContact O-N 3.46Å; V22-G24 VanDerWaalsContact C-N 3.31Å; V22-G24 PolarHBondContact O-N 3.04Å; V22-Q25 WeakPolarHBondContact O-CB 3.2Å; V22-Q25 PolarHBondContact O-N 3.44Å; V22-Q25 VanDerWaalsContact O-N 3.11Å; V22-V26 WeakPolarHBondContact O-CG2 3.43Å; V22-V26 PolarHBondContact O-N 3.18Å |
| 23 | F | 92.9 | Very high | 89.2 | Confident | 112 Ų | 112 | 76.6 Ų | 76.6 | 49% | 0.491 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -58.8 | -43 | 176.2 | -176.9 | -111.6 | 0 | 0 | 0 | 112.1 | M1 I19 Q25 V26 I27 | M1-F23 HydrophobicContact CE-CD1 4.4Å; M1-F23 HydrophobicContact CE-CE1 4.3Å; I19-F23 WeakPolarHBondContact O-CB 3.47Å; I19-F23 PolarHBondContact O-N 3.13Å; F23-Q25 PolarHBondContact O-N 3.26Å; F23-V26 PolarHBondContact O-N 3.2Å; F23-I27 HydrophobicContact CD1-CD1 3.93Å; F23-I27 HydrophobicContact CE1-CD1 3.47Å; F23-I27 VanDerWaalsContact CE1-CD1 3.47Å; F23-I27 HydrophobicContact CE2-CD1 4.37Å; F23-I27 HydrophobicContact CZ-CD1 3.72Å; F23-I27 HydrophobicContact CZ-CG1 4.46Å; F23-I27 WeakPolarHBondContact O-CG1 3.44Å; F23-I27 PolarHBondContact O-N 2.88Å; F23-I27 VanDerWaalsContact O-N 3.1Å |
| 24 | G | 91.7 | Very high | 89.3 | Confident | 16 Ų | 16 | 80.3 Ų | 80.3 | 17% | 0.165 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -62.3 | -39.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | L20 I21 V22 A28 | L20-G24 PolarHBondContact O-N 3.42Å; I21-G24 PolarHBondContact O-N 2.83Å; V22-G24 VanDerWaalsContact C-N 3.31Å; V22-G24 PolarHBondContact O-N 3.04Å; G24-A28 WeakPolarHBondContact O-CB 3.48Å; G24-A28 PolarHBondContact O-N 2.84Å |
| 25 | Q | 91.2 | Very high | 89.5 | Confident | 98 Ų | 98 | 79.4 Ų | 79.4 | 46% | 0.458 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -66.5 | -40 | 175.6 | -74.4 | 175.1 | -18.4 | 0 | 0 | 111.9 | I21 V22 F23 A28 S29 | I21-Q25 WeakPolarHBondContact O-CG 3.35Å; I21-Q25 PolarHBondContact O-N 3.34Å; V22-Q25 WeakPolarHBondContact O-CB 3.2Å; V22-Q25 PolarHBondContact O-N 3.44Å; V22-Q25 VanDerWaalsContact O-N 3.11Å; F23-Q25 PolarHBondContact O-N 3.26Å; Q25-A28 PolarHBondContact O-N 3.41Å; Q25-S29 PolarHBondContact O-N 3.34Å |
| 26 | V | 93.4 | Very high | 89.4 | Confident | 68 Ų | 68 | 78 Ų | 78 | 41% | 0.412 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -60.4 | -47.6 | 175.9 | 171.3 | 0 | 0 | 0 | 0 | 110.6 | V22 F23 A28 S29 F30 | V22-V26 WeakPolarHBondContact O-CG2 3.43Å; V22-V26 PolarHBondContact O-N 3.18Å; F23-V26 PolarHBondContact O-N 3.2Å; V26-A28 VanDerWaalsContact C-N 3.34Å; V26-A28 PolarHBondContact O-N 2.89Å; V26-S29 PolarHBondContact O-N 3.48Å; V26-S29 PolarHBondContact O-OG 3.01Å; V26-F30 HydrophobicContact CG1-CD2 4.29Å; V26-F30 HydrophobicContact CG1-CE2 3.8Å; V26-F30 VanDerWaalsContact O-CD2 3.24Å; V26-F30 WeakPolarHBondContact O-CD2 3.43Å; V26-F30 PolarHBondContact O-N 3.23Å |
| 27 | I | 92.4 | Very high | 89.1 | Confident | 87 Ų | 87 | 81.2 Ų | 81.2 | 45% | 0.446 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -59.8 | -45 | 175.8 | -66.3 | 169.3 | 0 | 0 | 0 | 111.1 | F23 S29 F30 | F23-I27 HydrophobicContact CD1-CD1 3.93Å; F23-I27 HydrophobicContact CE1-CD1 3.47Å; F23-I27 VanDerWaalsContact CE1-CD1 3.47Å; F23-I27 HydrophobicContact CE2-CD1 4.37Å; F23-I27 HydrophobicContact CZ-CD1 3.72Å; F23-I27 HydrophobicContact CZ-CG1 4.46Å; F23-I27 WeakPolarHBondContact O-CG1 3.44Å; F23-I27 PolarHBondContact O-N 2.88Å; F23-I27 VanDerWaalsContact O-N 3.1Å; I27-S29 VanDerWaalsContact C-N 3.28Å; I27-S29 PolarHBondContact O-N 3.04Å; I27-F30 PolarHBondContact O-N 2.98Å |
| 28 | A | 90.5 | Very high | 89 | Confident | 61 Ų | 61 | 79.6 Ų | 79.6 | 50% | 0.504 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -63 | -34.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | G24 Q25 V26 F30 A31 Q32 | G24-A28 WeakPolarHBondContact O-CB 3.48Å; G24-A28 PolarHBondContact O-N 2.84Å; Q25-A28 PolarHBondContact O-N 3.41Å; V26-A28 VanDerWaalsContact C-N 3.34Å; V26-A28 PolarHBondContact O-N 2.89Å; A28-F30 VanDerWaalsContact C-N 3.33Å; A28-F30 PolarHBondContact O-N 3.42Å; A28-A31 WeakPolarHBondContact O-CB 3.48Å; A28-A31 PolarHBondContact O-N 3.38Å; A28-A31 VanDerWaalsContact O-N 3.1Å; A28-Q32 PolarHBondContact O-N 2.74Å |
| 29 | S | 89.9 | Confident | 88.9 | Confident | 59 Ų | 59 | 75.4 Ų | 75.4 | 41% | 0.413 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -65.6 | -33.4 | 177.7 | 73.2 | 0 | 0 | 0 | 0 | 113 | Q25 V26 I27 A31 Q32 P33 | Q25-S29 PolarHBondContact O-N 3.34Å; V26-S29 PolarHBondContact O-N 3.48Å; V26-S29 PolarHBondContact O-OG 3.01Å; I27-S29 VanDerWaalsContact C-N 3.28Å; I27-S29 PolarHBondContact O-N 3.04Å; S29-A31 PolarHBondContact O-N 3.15Å; S29-Q32 PolarHBondContact O-N 2.74Å; S29-P33 WeakPolarHBondContact O-CD 3.21Å |
| 30 | F | 90.8 | Very high | 88.4 | Confident | 148 Ų | 148 | 72.4 Ų | 72.4 | 65% | 0.649 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -66.2 | -27.1 | 172.6 | -76.1 | -71 | 0 | 0 | 0 | 112.8 | V26 I27 A28 F34 | V26-F30 HydrophobicContact CG1-CD2 4.29Å; V26-F30 HydrophobicContact CG1-CE2 3.8Å; V26-F30 VanDerWaalsContact O-CD2 3.24Å; V26-F30 WeakPolarHBondContact O-CD2 3.43Å; V26-F30 PolarHBondContact O-N 3.23Å; I27-F30 PolarHBondContact O-N 2.98Å; A28-F30 VanDerWaalsContact C-N 3.33Å; A28-F30 PolarHBondContact O-N 3.42Å; F30-F34 WeakPolarHBondContact O-CD2 3.34Å; F30-F34 VanDerWaalsContact O-CE2 3.26Å; F30-F34 WeakPolarHBondContact O-CE2 3.07Å |
| 31 | A | 89.6 | Confident | 87.9 | Confident | 47 Ų | 47 | 73.3 Ų | 73.3 | 39% | 0.388 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -77.9 | -29.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | A28 S29 F34 C35 | A28-A31 WeakPolarHBondContact O-CB 3.48Å; A28-A31 PolarHBondContact O-N 3.38Å; A28-A31 VanDerWaalsContact O-N 3.1Å; S29-A31 PolarHBondContact O-N 3.15Å; A31-F34 WeakPolarHBondContact O-CB 3.47Å; A31-F34 PolarHBondContact O-N 3.26Å; A31-F34 VanDerWaalsContact O-N 3.09Å; A31-C35 PolarHBondContact O-N 2.97Å; A31-C35 VanDerWaalsContact O-N 3.12Å |
| 32 | Q | 88.7 | Confident | 87.5 | Confident | 83 Ų | 83 | 74.7 Ų | 74.7 | 39% | 0.388 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -55.7 | -45.9 | -173.6 | -177.8 | -176.8 | 9.7 | 0 | 0 | 114.1 | A28 S29 F34 C35 L36 | A28-Q32 PolarHBondContact O-N 2.74Å; S29-Q32 PolarHBondContact O-N 2.74Å; Q32-F34 VanDerWaalsContact C-N 3.32Å; Q32-F34 PolarHBondContact O-N 3.5Å; Q32-C35 PolarHBondContact O-N 3.43Å; Q32-L36 HydrophobicContact CG-CD1 4.08Å; Q32-L36 HydrophobicContact CG-CG 4.45Å; Q32-L36 WeakPolarHBondContact O-CG 3.45Å; Q32-L36 PolarHBondContact O-N 2.86Å |
| 33 | P | 84.6 | Confident | 87 | Confident | 55 Ų | 55 | 71.6 Ų | 71.6 | 36% | 0.357 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -58.2 | -42.3 | 175.6 | -25.4 | 34.4 | 0 | 0 | 0 | 112.7 | S29 C35 L36 F37 | S29-P33 WeakPolarHBondContact O-CD 3.21Å; P33-C35 VanDerWaalsContact C-N 3.35Å; P33-C35 PolarHBondContact O-N 3.27Å; P33-L36 PolarHBondContact O-N 2.94Å; P33-F37 HydrophobicContact CB-CD2 4.08Å; P33-F37 HydrophobicContact CB-CE2 3.96Å; P33-F37 WeakPolarHBondContact O-CB 3.43Å; P33-F37 WeakPolarHBondContact O-CD2 3.48Å; P33-F37 WeakPolarHBondContact O-CG 3.32Å; P33-F37 PolarHBondContact O-N 3.46Å |
| 34 | F | 85.9 | Confident | 86.2 | Confident | 157 Ų | 157 | 69.2 Ų | 69.2 | 69% | 0.689 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -63.1 | -43 | 179.2 | -62.5 | -80.7 | 0 | 0 | 0 | 111.2 | F30 A31 Q32 S38 | F30-F34 WeakPolarHBondContact O-CD2 3.34Å; F30-F34 VanDerWaalsContact O-CE2 3.26Å; F30-F34 WeakPolarHBondContact O-CE2 3.07Å; A31-F34 WeakPolarHBondContact O-CB 3.47Å; A31-F34 PolarHBondContact O-N 3.26Å; A31-F34 VanDerWaalsContact O-N 3.09Å; Q32-F34 VanDerWaalsContact C-N 3.32Å; Q32-F34 PolarHBondContact O-N 3.5Å; F34-S38 WeakPolarHBondContact O-CB 3.07Å; F34-S38 PolarHBondContact O-N 2.89Å; F34-S38 PolarHBondContact O-OG 3.25Å |
| 35 | C | 85.9 | Confident | 85.5 | Confident | 81 Ų | 81 | 70.7 Ų | 70.7 | 55% | 0.547 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -61.7 | -45.2 | 175.7 | -64.3 | 0 | 0 | 0 | 0 | 111.7 | A31 Q32 P33 S38 | A31-C35 PolarHBondContact O-N 2.97Å; A31-C35 VanDerWaalsContact O-N 3.12Å; Q32-C35 PolarHBondContact O-N 3.43Å; P33-C35 VanDerWaalsContact C-N 3.35Å; P33-C35 PolarHBondContact O-N 3.27Å; C35-S38 PolarHBondContact O-OG 3.41Å |
| 36 | L | 84.7 | Confident | 85.1 | Confident | 56 Ų | 56 | 70.9 Ų | 70.9 | 29% | 0.293 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -67.9 | -45.4 | -179.5 | -70.7 | 176.4 | 0 | 0 | 0 | 113 | Q32 P33 S38 T39 N63 | Q32-L36 HydrophobicContact CG-CD1 4.08Å; Q32-L36 HydrophobicContact CG-CG 4.45Å; Q32-L36 WeakPolarHBondContact O-CG 3.45Å; Q32-L36 PolarHBondContact O-N 2.86Å; P33-L36 PolarHBondContact O-N 2.94Å; L36-S38 VanDerWaalsContact C-N 3.33Å; L36-T39 PolarHBondContact O-OG1 2.9Å; L36-N63 WeakPolarHBondContact CD2-ND2 3.27Å |
| 37 | F | 81.4 | Confident | 84.5 | Confident | 87 Ų | 87 | 71.2 Ų | 71.2 | 38% | 0.382 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -77 | -22.1 | -179.6 | -63.5 | -57.6 | 0 | 0 | 0 | 112.6 | P33 T39 T40 S41 S286 | P33-F37 HydrophobicContact CB-CD2 4.08Å; P33-F37 HydrophobicContact CB-CE2 3.96Å; P33-F37 WeakPolarHBondContact O-CB 3.43Å; P33-F37 WeakPolarHBondContact O-CD2 3.48Å; P33-F37 WeakPolarHBondContact O-CG 3.32Å; P33-F37 PolarHBondContact O-N 3.46Å; F37-T39 PolarHBondContact O-N 3.22Å; F37-T40 PolarHBondContact O-N 3.44Å; F37-T40 PolarHBondContact O-OG1 2.92Å; F37-S41 PolarHBondContact O-N 3.32Å; F37-S41 VanDerWaalsContact O-N 3.09Å; F37-S286 WeakPolarHBondContact CE1-OG 3.3Å; F37-S286 WeakPolarHBondContact CZ-OG 3.37Å |
| 38 | S | 84.4 | Confident | 83.9 | Confident | 62 Ų | 62 | 69 Ų | 69 | 43% | 0.434 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -59.5 | -31.4 | 177.1 | 70 | 0 | 0 | 0 | 0 | 113 | F34 C35 L36 S41 L42 | F34-S38 WeakPolarHBondContact O-CB 3.07Å; F34-S38 PolarHBondContact O-N 2.89Å; F34-S38 PolarHBondContact O-OG 3.25Å; C35-S38 PolarHBondContact O-OG 3.41Å; L36-S38 VanDerWaalsContact C-N 3.33Å; S38-S41 PolarHBondContact O-N 2.96Å; S38-L42 WeakPolarHBondContact O-CB 3.49Å; S38-L42 PolarHBondContact O-N 3.38Å |
| 39 | T | 85.3 | Confident | 83.1 | Confident | 22 Ų | 22 | 70 Ų | 70 | 14% | 0.135 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -65.7 | -45.8 | 179.2 | 62.3 | 0 | 0 | 0 | 0 | 111.4 | L36 F37 L42 A43 N56 A59 | L36-T39 PolarHBondContact O-OG1 2.9Å; F37-T39 PolarHBondContact O-N 3.22Å; T39-L42 PolarHBondContact O-N 3.08Å; T39-A43 WeakPolarHBondContact O-CB 3.4Å; T39-A43 PolarHBondContact O-N 3.44Å; T39-N56 PolarHBondContact OG1-OD1 2.84Å; T39-A59 HydrophobicContact CG2-CB 3.71Å |
| 40 | T | 80.8 | Confident | 82.4 | Confident | 56 Ų | 56 | 73.2 Ų | 73.2 | 34% | 0.344 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -64.8 | -44.5 | 177 | 61.2 | 0 | 0 | 0 | 0 | 111.6 | F37 L42 A43 C44 N56 | F37-T40 PolarHBondContact O-N 3.44Å; F37-T40 PolarHBondContact O-OG1 2.92Å; T40-L42 PolarHBondContact O-N 3.48Å; T40-A43 PolarHBondContact O-N 3.26Å; T40-C44 PolarHBondContact O-N 2.91Å; T40-C44 PolarHBondContact O-SG 3.03Å; T40-C44 VanDerWaalsContact O-SG 3.41Å; T40-N56 WeakPolarHBondContact CA-OD1 3.48Å; T40-N56 VanDerWaalsContact CG2-OD1 3.31Å; T40-N56 WeakPolarHBondContact CG2-OD1 3.07Å; T40-N56 PolarHBondContact N-OD1 3.42Å |
| 41 | S | 79.3 | Confident | 81.9 | Confident | 62 Ų | 62 | 70.6 Ų | 70.6 | 43% | 0.434 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -63.8 | -43 | 177.9 | -165.6 | 0 | 0 | 0 | 0 | 111.4 | F37 S38 C44 D45 | F37-S41 PolarHBondContact O-N 3.32Å; F37-S41 VanDerWaalsContact O-N 3.09Å; S38-S41 PolarHBondContact O-N 2.96Å; S41-C44 PolarHBondContact O-N 3.11Å; S41-D45 WeakPolarHBondContact O-CB 3.43Å; S41-D45 PolarHBondContact O-N 2.93Å |
| 42 | L | 82.8 | Confident | 81.3 | Confident | 83 Ų | 83 | 70.9 Ų | 70.9 | 44% | 0.435 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -60.3 | -47.1 | 176.7 | -178.9 | 72.1 | 0 | 0 | 0 | 110.8 | S38 T39 T40 C44 D45 W46 | S38-L42 WeakPolarHBondContact O-CB 3.49Å; S38-L42 PolarHBondContact O-N 3.38Å; T39-L42 PolarHBondContact O-N 3.08Å; T40-L42 PolarHBondContact O-N 3.48Å; L42-C44 PolarHBondContact O-N 3.11Å; L42-D45 PolarHBondContact O-N 3.41Å; L42-W46 HydrophobicContact CD1-CB 4.49Å; L42-W46 HydrophobicContact CD1-CG 4Å; L42-W46 WeakPolarHBondContact O-CB 3.37Å; L42-W46 PolarHBondContact O-N 3.42Å |
| 43 | A | 80.6 | Confident | 80.5 | Confident | 3 Ų | 3 | 71.9 Ų | 71.9 | 3% | 0.025 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -58.1 | -47.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | T39 T40 F47 A55 N56 | T39-A43 WeakPolarHBondContact O-CB 3.4Å; T39-A43 PolarHBondContact O-N 3.44Å; T40-A43 PolarHBondContact O-N 3.26Å; A43-F47 WeakPolarHBondContact O-CB 3.45Å; A43-F47 PolarHBondContact O-N 3.25Å; A43-F47 VanDerWaalsContact O-N 3.14Å; A43-A55 HydrophobicContact CB-CB 4.23Å; A43-N56 HydrophobicContact CB-CB 3.83Å |
| 44 | C | 75.3 | Confident | 80.3 | Confident | 62 Ų | 62 | 73.3 Ų | 73.3 | 42% | 0.419 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -66.4 | -42.1 | -179.9 | -69.9 | 0 | 0 | 0 | 0 | 113.7 | T40 S41 L42 R52 | T40-C44 PolarHBondContact O-N 2.91Å; T40-C44 PolarHBondContact O-SG 3.03Å; T40-C44 VanDerWaalsContact O-SG 3.41Å; S41-C44 PolarHBondContact O-N 3.11Å; L42-C44 PolarHBondContact O-N 3.11Å; C44-R52 PolarHBondContact O-NE 3.37Å; C44-R52 PolarHBondContact O-NH2 3.48Å |
| 45 | D | 78.5 | Confident | 80.2 | Confident | 47 Ų | 47 | 66.5 Ų | 66.5 | 25% | 0.251 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -80.3 | -32 | -173.3 | -76.8 | -29.7 | 0 | 0 | 0 | 112.9 | S41 L42 P111 P115 | S41-D45 WeakPolarHBondContact O-CB 3.43Å; S41-D45 PolarHBondContact O-N 2.93Å; L42-D45 PolarHBondContact O-N 3.41Å; D45-P111 WeakPolarHBondContact O-CD 3.45Å; D45-P111 WeakPolarHBondContact O-CG 3.12Å; D45-P115 WeakPolarHBondContact O-CG 3.37Å |
| 46 | W | 82.4 | Confident | 80 | Confident | 103 Ų | 103 | 64.4 Ų | 64.4 | 39% | 0.39 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -107.1 | -21.6 | -171.4 | -72.6 | 72.9 | 0 | 0 | 0 | 115 | L42 R108 G109 P111 | L42-W46 HydrophobicContact CD1-CB 4.49Å; L42-W46 HydrophobicContact CD1-CG 4Å; L42-W46 WeakPolarHBondContact O-CB 3.37Å; L42-W46 PolarHBondContact O-N 3.42Å; W46-R108 HydrophobicContact CH2-CB 4.34Å; W46-R108 HydrophobicContact CZ2-CB 4.35Å; W46-R108 WeakPolarHBondContact CZ2-O 3.47Å; W46-G109 PolarHBondContact NE1-O 2.94Å; W46-P111 HydrophobicContact CD2-CB 4.24Å; W46-P111 HydrophobicContact CD2-CG 4.39Å; W46-P111 HydrophobicContact CE3-CB 3.94Å; W46-P111 HydrophobicContact CZ3-CB 4.15Å |
| 47 | F | 81.2 | Confident | 79.9 | Confident | 75 Ų | 75 | 65.3 Ų | 65.3 | 33% | 0.329 | 36% | 0.358 | S | S | . | . | S | Bend | trans | -113.2 | 143.5 | -175.3 | -64 | -94.6 | 0 | 0 | 0 | 112.3 | A43 Q51 R52 A55 P115 | A43-F47 WeakPolarHBondContact O-CB 3.45Å; A43-F47 PolarHBondContact O-N 3.25Å; A43-F47 VanDerWaalsContact O-N 3.14Å; F47-Q51 HydrophobicContact CB-CB 4.31Å; F47-Q51 HydrophobicContact CD1-CB 4.44Å; F47-R52 HydrophobicContact CB-CG 4.43Å; F47-R52 WeakPolarHBondContact O-CG 3.16Å; F47-R52 PolarHBondContact O-NE 3.26Å; F47-A55 HydrophobicContact CB-CB 4.32Å; F47-A55 HydrophobicContact CD1-CB 3.94Å; F47-A55 HydrophobicContact CD2-CB 3.62Å; F47-A55 HydrophobicContact CE1-CB 4.12Å; F47-A55 HydrophobicContact CE2-CB 3.8Å; F47-A55 HydrophobicContact CG-CB 3.68Å; F47-A55 HydrophobicContact CZ-CB 4.04Å; F47-P115 WeakPolarHBondContact O-CB 3.45Å |
| 48 | P | 78.9 | Confident | 80.1 | Confident | 41 Ų | 41 | 66.5 Ų | 66.5 | 27% | 0.266 | 37% | 0.367 | S | S | . | . | trans | -65.5 | 155.3 | 174 | 30.2 | -36 | 0 | 0 | 0 | 110.7 | N50 Q51 R52 | P48-N50 WeakPolarHBondContact CB-OD1 3.49Å; P48-N50 WeakPolarHBondContact CG-OD1 3.26Å; P48-N50 PolarHBondContact O-N 3.38Å; P48-Q51 HydrophobicContact CG-CB 4.13Å; P48-Q51 HydrophobicContact CG-CG 4.1Å; P48-Q51 PolarHBondContact O-N 3.1Å; P48-R52 WeakPolarHBondContact O-CG 3.32Å; P48-R52 PolarHBondContact O-N 3.4Å; P48-R52 VanDerWaalsContact O-N 3.16Å | ||
| 49 | D | 73.7 | Confident | 80.2 | Confident | 81 Ų | 81 | 65.2 Ų | 65.2 | 43% | 0.433 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -49.3 | -38.2 | -171.9 | -73.7 | -59.6 | 0 | 0 | 0 | 114.4 | Q51 R52 S116 | D49-Q51 VanDerWaalsContact C-N 3.29Å; D49-Q51 PolarHBondContact O-N 3.33Å; D49-R52 IonicContact OD1-CZ 3.6Å; D49-R52 IonicContact OD1-NE 3.08Å; D49-R52 PolarHBondContact OD1-NE 3.08Å; D49-R52 IonicContact OD1-NH1 3.45Å; D49-R52 PolarHBondContact OD1-NH1 3.33Å; D49-R52 IonicContact OD1-NH2 3.62Å; D49-S116 WeakPolarHBondContact OD2-CB 3.38Å; D49-S116 PolarHBondContact OD2-OG 3.46Å |
| 50 | N | 76.4 | Confident | 80.1 | Confident | 126 Ų | 126 | 66.5 Ų | 66.5 | 67% | 0.674 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -71.2 | -16 | 178.6 | 66.1 | -40.6 | 0 | 0 | 0 | 114.8 | P48 | P48-N50 WeakPolarHBondContact CB-OD1 3.49Å; P48-N50 WeakPolarHBondContact CG-OD1 3.26Å; P48-N50 PolarHBondContact O-N 3.38Å |
| 51 | Q | 80 | Confident | 80.4 | Confident | 94 Ų | 94 | 67 Ų | 67 | 44% | 0.439 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -113.1 | -9.7 | -178.3 | -65.7 | 179.6 | -3.9 | 0 | 0 | 113.3 | F47 P48 D49 T53 T54 A55 | F47-Q51 HydrophobicContact CB-CB 4.31Å; F47-Q51 HydrophobicContact CD1-CB 4.44Å; P48-Q51 HydrophobicContact CG-CB 4.13Å; P48-Q51 HydrophobicContact CG-CG 4.1Å; P48-Q51 PolarHBondContact O-N 3.1Å; D49-Q51 VanDerWaalsContact C-N 3.29Å; D49-Q51 PolarHBondContact O-N 3.33Å; Q51-T53 PolarHBondContact O-N 3.48Å; Q51-T54 PolarHBondContact O-N 2.91Å; Q51-A55 WeakPolarHBondContact O-CB 3.47Å; Q51-A55 PolarHBondContact O-N 3.14Å |
| 52 | R | 77.5 | Confident | 80.9 | Confident | 52 Ų | 52 | 66.2 Ų | 66.2 | 20% | 0.196 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -55.9 | -47.9 | -177.2 | -68.3 | -176.1 | 174.9 | 173.4 | -8.3 | 112.4 | C44 F47 P48 D49 T54 A55 N56 | C44-R52 PolarHBondContact O-NE 3.37Å; C44-R52 PolarHBondContact O-NH2 3.48Å; F47-R52 HydrophobicContact CB-CG 4.43Å; F47-R52 WeakPolarHBondContact O-CG 3.16Å; F47-R52 PolarHBondContact O-NE 3.26Å; P48-R52 WeakPolarHBondContact O-CG 3.32Å; P48-R52 PolarHBondContact O-N 3.4Å; P48-R52 VanDerWaalsContact O-N 3.16Å; D49-R52 IonicContact OD1-CZ 3.6Å; D49-R52 IonicContact OD1-NE 3.08Å; D49-R52 PolarHBondContact OD1-NE 3.08Å; D49-R52 IonicContact OD1-NH1 3.45Å; D49-R52 PolarHBondContact OD1-NH1 3.33Å; D49-R52 IonicContact OD1-NH2 3.62Å; R52-T54 PolarHBondContact O-N 3.15Å; R52-A55 PolarHBondContact O-N 3.44Å; R52-N56 WeakPolarHBondContact O-CB 3.35Å; R52-N56 PolarHBondContact O-N 3.44Å |
| 53 | T | 71.9 | Confident | 81.1 | Confident | 105 Ų | 105 | 66 Ų | 66 | 64% | 0.644 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -60.6 | -48.4 | -179.5 | -51.5 | 0 | 0 | 0 | 0 | 111 | Q51 A55 N56 T57 | Q51-T53 PolarHBondContact O-N 3.48Å; T53-A55 PolarHBondContact O-N 3.36Å; T53-N56 PolarHBondContact O-N 3.46Å; T53-T57 WeakPolarHBondContact O-CB 3.38Å; T53-T57 PolarHBondContact O-N 2.88Å; T53-T57 PolarHBondContact O-OG1 2.99Å |
| 54 | T | 80.2 | Confident | 81.5 | Confident | 84 Ų | 84 | 66.9 Ų | 66.9 | 52% | 0.515 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -62.9 | -44.4 | 179 | -52.6 | 0 | 0 | 0 | 0 | 112 | Q51 R52 T57 I58 | Q51-T54 PolarHBondContact O-N 2.91Å; R52-T54 PolarHBondContact O-N 3.15Å; T54-T57 PolarHBondContact O-N 3.33Å; T54-I58 HydrophobicContact CG2-CD1 3.89Å; T54-I58 VanDerWaalsContact O-CG1 3.31Å; T54-I58 WeakPolarHBondContact O-CG1 3.37Å; T54-I58 PolarHBondContact O-N 3.08Å |
| 55 | A | 82.8 | Confident | 82.2 | Confident | 15 Ų | 15 | 66.8 Ų | 66.8 | 12% | 0.124 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -61.8 | -44.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | A43 F47 Q51 R52 T53 I58 A59 | A43-A55 HydrophobicContact CB-CB 4.23Å; F47-A55 HydrophobicContact CB-CB 4.32Å; F47-A55 HydrophobicContact CD1-CB 3.94Å; F47-A55 HydrophobicContact CD2-CB 3.62Å; F47-A55 HydrophobicContact CE1-CB 4.12Å; F47-A55 HydrophobicContact CE2-CB 3.8Å; F47-A55 HydrophobicContact CG-CB 3.68Å; F47-A55 HydrophobicContact CZ-CB 4.04Å; Q51-A55 WeakPolarHBondContact O-CB 3.47Å; Q51-A55 PolarHBondContact O-N 3.14Å; R52-A55 PolarHBondContact O-N 3.44Å; T53-A55 PolarHBondContact O-N 3.36Å; A55-I58 PolarHBondContact O-N 2.88Å; A55-A59 VanDerWaalsContact O-CB 3.32Å; A55-A59 WeakPolarHBondContact O-CB 3.47Å; A55-A59 PolarHBondContact O-N 2.96Å |
| 56 | N | 81.5 | Confident | 82.8 | Confident | 37 Ų | 37 | 66.6 Ų | 66.6 | 20% | 0.198 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -62.4 | -43.2 | 176.4 | -175.7 | 52.2 | 0 | 0 | 0 | 111.8 | T39 T40 A43 R52 T53 A59 S60 | T39-N56 PolarHBondContact OG1-OD1 2.84Å; T40-N56 WeakPolarHBondContact CA-OD1 3.48Å; T40-N56 VanDerWaalsContact CG2-OD1 3.31Å; T40-N56 WeakPolarHBondContact CG2-OD1 3.07Å; T40-N56 PolarHBondContact N-OD1 3.42Å; A43-N56 HydrophobicContact CB-CB 3.83Å; R52-N56 WeakPolarHBondContact O-CB 3.35Å; R52-N56 PolarHBondContact O-N 3.44Å; T53-N56 PolarHBondContact O-N 3.46Å; N56-A59 PolarHBondContact O-N 3.08Å; N56-S60 VanDerWaalsContact O-CB 3.27Å; N56-S60 WeakPolarHBondContact O-CB 3.16Å; N56-S60 PolarHBondContact O-N 3.33Å; N56-S60 PolarHBondContact O-OG 3.14Å |
| 57 | T | 82.1 | Confident | 83.2 | Confident | 74 Ų | 74 | 65.2 Ų | 65.2 | 45% | 0.454 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -60.6 | -51.4 | 176.6 | -62.1 | 0 | 0 | 0 | 0 | 110.9 | T53 T54 A59 S60 L61 | T53-T57 WeakPolarHBondContact O-CB 3.38Å; T53-T57 PolarHBondContact O-N 2.88Å; T53-T57 PolarHBondContact O-OG1 2.99Å; T54-T57 PolarHBondContact O-N 3.33Å; T57-A59 VanDerWaalsContact C-N 3.33Å; T57-A59 PolarHBondContact O-N 3.36Å; T57-S60 PolarHBondContact O-N 2.93Å; T57-L61 WeakPolarHBondContact O-CG 3.27Å; T57-L61 PolarHBondContact O-N 3.39Å |
| 58 | I | 86.6 | Confident | 83.7 | Confident | 112 Ų | 112 | 63.2 Ų | 63.2 | 57% | 0.574 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -59.9 | -44 | 179.4 | -67.1 | 167 | 0 | 0 | 0 | 111.2 | T54 A55 S60 L61 | T54-I58 HydrophobicContact CG2-CD1 3.89Å; T54-I58 VanDerWaalsContact O-CG1 3.31Å; T54-I58 WeakPolarHBondContact O-CG1 3.37Å; T54-I58 PolarHBondContact O-N 3.08Å; A55-I58 PolarHBondContact O-N 2.88Å; I58-S60 VanDerWaalsContact C-N 3.35Å; I58-S60 PolarHBondContact O-N 3.49Å; I58-L61 WeakPolarHBondContact O-CB 3.35Å; I58-L61 PolarHBondContact O-N 2.91Å |
| 59 | A | 86.8 | Confident | 84.3 | Confident | 35 Ų | 35 | 65.1 Ų | 65.1 | 29% | 0.289 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -64.9 | -40.1 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | T39 A55 N56 T57 L61 G62 | T39-A59 HydrophobicContact CG2-CB 3.71Å; A55-A59 VanDerWaalsContact O-CB 3.32Å; A55-A59 WeakPolarHBondContact O-CB 3.47Å; A55-A59 PolarHBondContact O-N 2.96Å; N56-A59 PolarHBondContact O-N 3.08Å; T57-A59 VanDerWaalsContact C-N 3.33Å; T57-A59 PolarHBondContact O-N 3.36Å; A59-L61 VanDerWaalsContact C-N 3.35Å; A59-G62 PolarHBondContact O-N 3.27Å; A59-G62 VanDerWaalsContact O-N 3.15Å |
| 60 | S | 83.8 | Confident | 85.1 | Confident | 49 Ų | 49 | 62.9 Ų | 62.9 | 34% | 0.343 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -69.3 | -31.1 | 178.5 | -58.6 | 0 | 0 | 0 | 0 | 112.7 | N56 T57 I58 G62 N63 | N56-S60 VanDerWaalsContact O-CB 3.27Å; N56-S60 WeakPolarHBondContact O-CB 3.16Å; N56-S60 PolarHBondContact O-N 3.33Å; N56-S60 PolarHBondContact O-OG 3.14Å; T57-S60 PolarHBondContact O-N 2.93Å; I58-S60 VanDerWaalsContact C-N 3.35Å; I58-S60 PolarHBondContact O-N 3.49Å; S60-G62 PolarHBondContact O-N 3.38Å; S60-N63 PolarHBondContact O-N 2.8Å; S60-N63 VanDerWaalsContact O-N 3.14Å |
| 61 | L | 86.6 | Confident | 85.8 | Confident | 68 Ų | 68 | 58 Ų | 58 | 36% | 0.356 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -58.2 | -26.7 | 171.3 | -71.3 | 176.3 | 0 | 0 | 0 | 112.4 | T57 I58 A59 N63 S64 V65 L203 | T57-L61 WeakPolarHBondContact O-CG 3.27Å; T57-L61 PolarHBondContact O-N 3.39Å; I58-L61 WeakPolarHBondContact O-CB 3.35Å; I58-L61 PolarHBondContact O-N 2.91Å; A59-L61 VanDerWaalsContact C-N 3.35Å; L61-N63 PolarHBondContact O-N 2.76Å; L61-S64 PolarHBondContact O-N 2.83Å; L61-S64 VanDerWaalsContact O-N 3.14Å; L61-V65 VanDerWaalsContact O-CG2 3.32Å; L61-V65 WeakPolarHBondContact O-CG2 3.25Å; L61-V65 PolarHBondContact O-N 3.32Å; L61-L203 HydrophobicContact CD2-CD1 4.39Å; L61-L203 HydrophobicContact CD2-CD2 3.38Å; L61-L203 HydrophobicContact CD2-CG 4.41Å |
| 62 | G | 88.9 | Confident | 86.3 | Confident | 45 Ų | 45 | 54.9 Ų | 54.9 | 46% | 0.464 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -54.9 | -34.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | A59 S60 G66 | A59-G62 PolarHBondContact O-N 3.27Å; A59-G62 VanDerWaalsContact O-N 3.15Å; S60-G62 PolarHBondContact O-N 3.38Å; G62-G66 PolarHBondContact O-N 3.12Å |
| 63 | N | 88.3 | Confident | 86.9 | Confident | 78 Ų | 78 | 58.5 Ų | 58.5 | 42% | 0.417 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -66.1 | -53.1 | 175.1 | -173.7 | -10.3 | 0 | 0 | 0 | 110.9 | L36 S60 L61 V65 G66 I67 | L36-N63 WeakPolarHBondContact CD2-ND2 3.27Å; S60-N63 PolarHBondContact O-N 2.8Å; S60-N63 VanDerWaalsContact O-N 3.14Å; L61-N63 PolarHBondContact O-N 2.76Å; N63-V65 VanDerWaalsContact C-N 3.28Å; N63-V65 PolarHBondContact O-N 3.45Å; N63-G66 WeakPolarHBondContact O-CA 3.05Å; N63-G66 PolarHBondContact O-N 3.35Å; N63-I67 WeakPolarHBondContact O-CG1 3.17Å; N63-I67 PolarHBondContact O-N 3.3Å |
| 64 | S | 88.3 | Confident | 87.8 | Confident | 22 Ų | 22 | 54.6 Ų | 54.6 | 15% | 0.154 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -59 | -39.9 | 178.7 | -55 | 0 | 0 | 0 | 0 | 112.3 | L61 I67 L68 | L61-S64 PolarHBondContact O-N 2.83Å; L61-S64 VanDerWaalsContact O-N 3.14Å; S64-I67 PolarHBondContact O-N 3.44Å; S64-L68 WeakPolarHBondContact O-CB 3.2Å; S64-L68 PolarHBondContact O-N 2.9Å |
| 65 | V | 90.9 | Very high | 88.1 | Confident | 60 Ų | 60 | 50.8 Ų | 50.8 | 36% | 0.364 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -66 | -39.1 | 175.6 | 173.9 | 0 | 0 | 0 | 0 | 111.2 | L61 N63 I67 L68 L69 | L61-V65 VanDerWaalsContact O-CG2 3.32Å; L61-V65 WeakPolarHBondContact O-CG2 3.25Å; L61-V65 PolarHBondContact O-N 3.32Å; N63-V65 VanDerWaalsContact C-N 3.28Å; N63-V65 PolarHBondContact O-N 3.45Å; V65-I67 PolarHBondContact O-N 2.65Å; V65-L68 WeakPolarHBondContact O-CB 3.24Å; V65-L68 PolarHBondContact O-N 3.28Å; V65-L69 HydrophobicContact CG1-CD1 4.06Å; V65-L69 HydrophobicContact CG1-CG 4.29Å; V65-L69 VanDerWaalsContact O-CG 3.31Å; V65-L69 WeakPolarHBondContact O-CG 3.09Å; V65-L69 PolarHBondContact O-N 3.23Å |
| 66 | G | 90.5 | Very high | 88.4 | Confident | 43 Ų | 43 | 54.4 Ų | 54.4 | 44% | 0.443 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -59 | -45.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | G62 N63 L69 G70 | G62-G66 PolarHBondContact O-N 3.12Å; N63-G66 WeakPolarHBondContact O-CA 3.05Å; N63-G66 PolarHBondContact O-N 3.35Å; G66-L69 PolarHBondContact O-N 2.92Å; G66-G70 PolarHBondContact O-N 2.84Å |
| 67 | I | 90.1 | Very high | 88.8 | Confident | 74 Ų | 74 | 57.7 Ų | 57.7 | 38% | 0.379 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -65.3 | -43 | 176.4 | -57.5 | 171.4 | 0 | 0 | 0 | 110.6 | N63 S64 V65 L69 G70 N71 I199 | N63-I67 WeakPolarHBondContact O-CG1 3.17Å; N63-I67 PolarHBondContact O-N 3.3Å; S64-I67 PolarHBondContact O-N 3.44Å; V65-I67 PolarHBondContact O-N 2.65Å; I67-L69 PolarHBondContact O-N 3.3Å; I67-G70 PolarHBondContact O-N 3.37Å; I67-N71 PolarHBondContact O-N 3.46Å; I67-I199 HydrophobicContact CB-CD1 4.03Å; I67-I199 HydrophobicContact CG2-CD1 3.54Å |
| 68 | L | 93.1 | Very high | 89 | Confident | 33 Ų | 33 | 55.8 Ų | 55.8 | 17% | 0.173 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -55.1 | -51.3 | 175.2 | 170.6 | 64.5 | 0 | 0 | 0 | 111.5 | S64 V65 G70 N71 A72 S196 I199 V200 | S64-L68 WeakPolarHBondContact O-CB 3.2Å; S64-L68 PolarHBondContact O-N 2.9Å; V65-L68 WeakPolarHBondContact O-CB 3.24Å; V65-L68 PolarHBondContact O-N 3.28Å; L68-G70 VanDerWaalsContact C-N 3.29Å; L68-G70 PolarHBondContact O-N 3.39Å; L68-N71 PolarHBondContact O-N 2.05Å; L68-A72 WeakPolarHBondContact O-CB 3.47Å; L68-A72 PolarHBondContact O-N 3.48Å; L68-S196 VanDerWaalsContact CD1-O 3.22Å; L68-S196 WeakPolarHBondContact CD1-O 3.21Å; L68-I199 HydrophobicContact CB-CB 4.44Å; L68-I199 HydrophobicContact CB-CD1 4.28Å; L68-I199 HydrophobicContact CB-CG2 4.08Å; L68-I199 HydrophobicContact CD1-CB 4.43Å; L68-V200 HydrophobicContact CD1-CG2 3.76Å; L68-V200 HydrophobicContact CD2-CG2 3.95Å |
| 69 | L | 91.3 | Very high | 88.9 | Confident | 80 Ų | 80 | 58.1 Ų | 58.1 | 42% | 0.419 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -65.3 | -35 | 178.9 | -65.6 | 174.6 | 0 | 0 | 0 | 111.5 | V65 G66 I67 A72 F73 | V65-L69 HydrophobicContact CG1-CD1 4.06Å; V65-L69 HydrophobicContact CG1-CG 4.29Å; V65-L69 VanDerWaalsContact O-CG 3.31Å; V65-L69 WeakPolarHBondContact O-CG 3.09Å; V65-L69 PolarHBondContact O-N 3.23Å; G66-L69 PolarHBondContact O-N 2.92Å; I67-L69 PolarHBondContact O-N 3.3Å; L69-A72 PolarHBondContact O-N 3.18Å; L69-F73 HydrophobicContact CB-CD2 3.9Å; L69-F73 HydrophobicContact CB-CE2 4.06Å; L69-F73 HydrophobicContact CD2-CD2 4.16Å; L69-F73 HydrophobicContact CD2-CE2 3.49Å; L69-F73 VanDerWaalsContact CD2-CE2 3.49Å; L69-F73 HydrophobicContact CD2-CZ 4.34Å; L69-F73 HydrophobicContact CG-CE2 4.23Å; L69-F73 WeakPolarHBondContact O-CB 3.42Å; L69-F73 VanDerWaalsContact O-CD2 3.24Å; L69-F73 WeakPolarHBondContact O-CD2 3.42Å; L69-F73 PolarHBondContact O-N 2.86Å |
| 70 | G | 90.6 | Very high | 88.7 | Confident | 34 Ų | 34 | 59.4 Ų | 59.4 | 35% | 0.351 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -59.1 | -49.7 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | G66 I67 L68 A72 A74 | G66-G70 PolarHBondContact O-N 2.84Å; I67-G70 PolarHBondContact O-N 3.37Å; L68-G70 VanDerWaalsContact C-N 3.29Å; L68-G70 PolarHBondContact O-N 3.39Å; G70-A72 VanDerWaalsContact C-N 3.32Å; G70-A72 PolarHBondContact O-N 3.41Å; G70-A74 WeakPolarHBondContact O-CB 3.45Å; G70-A74 PolarHBondContact O-N 3.46Å; G70-A74 VanDerWaalsContact O-N 3.08Å |
| 71 | N | 89.7 | Confident | 88.5 | Confident | 24 Ų | 24 | 61.7 Ų | 61.7 | 13% | 0.128 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -66.4 | -32.1 | 177.7 | -78.1 | -24.2 | 0 | 0 | 0 | 112.9 | I67 L68 P75 G192 S196 | I67-N71 PolarHBondContact O-N 3.46Å; L68-N71 PolarHBondContact O-N 2.05Å; N71-P75 WeakPolarHBondContact O-CD 3.38Å; N71-P75 WeakPolarHBondContact O-CG 3.11Å; N71-G192 CarbonylContact O-C 3.53Å; N71-G192 WeakPolarHBondContact O-CA 3.45Å; N71-S196 WeakPolarHBondContact CB-OG 3.34Å |
| 72 | A | 91.7 | Very high | 88.3 | Confident | 29 Ų | 29 | 61.8 Ų | 61.8 | 24% | 0.24 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -80.4 | -45 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | L68 L69 G70 N76 S196 | L68-A72 WeakPolarHBondContact O-CB 3.47Å; L68-A72 PolarHBondContact O-N 3.48Å; L69-A72 PolarHBondContact O-N 3.18Å; G70-A72 VanDerWaalsContact C-N 3.32Å; G70-A72 PolarHBondContact O-N 3.41Å; A72-N76 PolarHBondContact O-ND2 3.15Å; A72-S196 WeakPolarHBondContact CA-OG 3.26Å; A72-S196 WeakPolarHBondContact CB-OG 3.17Å; A72-S196 PolarHBondContact N-OG 2.99Å; A72-S196 VanDerWaalsContact N-OG 3.14Å |
| 73 | F | 90.5 | Very high | 88.1 | Confident | 127 Ų | 127 | 61.7 Ų | 61.7 | 56% | 0.557 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -87 | -41.5 | -172.7 | -71.9 | -60.5 | 0 | 0 | 0 | 113.4 | L69 N76 Y77 | L69-F73 HydrophobicContact CB-CD2 3.9Å; L69-F73 HydrophobicContact CB-CE2 4.06Å; L69-F73 HydrophobicContact CD2-CD2 4.16Å; L69-F73 HydrophobicContact CD2-CE2 3.49Å; L69-F73 VanDerWaalsContact CD2-CE2 3.49Å; L69-F73 HydrophobicContact CD2-CZ 4.34Å; L69-F73 HydrophobicContact CG-CE2 4.23Å; L69-F73 WeakPolarHBondContact O-CB 3.42Å; L69-F73 VanDerWaalsContact O-CD2 3.24Å; L69-F73 WeakPolarHBondContact O-CD2 3.42Å; L69-F73 PolarHBondContact O-N 2.86Å; F73-N76 PolarHBondContact O-N 3.3Å; F73-Y77 WeakPolarHBondContact O-CB 3.17Å; F73-Y77 PolarHBondContact O-N 3.42Å |
| 74 | A | 89 | Confident | 88.1 | Confident | 24 Ų | 24 | 61.8 Ų | 61.8 | 20% | 0.198 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -59.1 | -47.3 | -172.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | G70 N76 Y77 V78 F87 | G70-A74 WeakPolarHBondContact O-CB 3.45Å; G70-A74 PolarHBondContact O-N 3.46Å; G70-A74 VanDerWaalsContact O-N 3.08Å; A74-N76 VanDerWaalsContact C-N 3.34Å; A74-N76 PolarHBondContact O-N 2.87Å; A74-Y77 PolarHBondContact O-N 3.36Å; A74-V78 WeakPolarHBondContact O-CB 3.31Å; A74-V78 WeakPolarHBondContact O-CG2 3.24Å; A74-V78 PolarHBondContact O-N 3.21Å; A74-F87 HydrophobicContact CB-CE1 4.13Å; A74-F87 HydrophobicContact CB-CE2 4.07Å; A74-F87 HydrophobicContact CB-CZ 3.59Å |
| 75 | P | 87.8 | Confident | 88 | Confident | 4 Ų | 4 | 62.5 Ų | 62.5 | 3% | 0.026 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -75.5 | -22.7 | -177.6 | -19 | 37 | 0 | 0 | 0 | 113.7 | N71 N188 | N71-P75 WeakPolarHBondContact O-CD 3.38Å; N71-P75 WeakPolarHBondContact O-CG 3.11Å; P75-N188 HydrophobicContact CB-CB 4.25Å; P75-N188 WeakPolarHBondContact CB-O 3.14Å |
| 76 | N | 88.8 | Confident | 87.9 | Confident | 90 Ų | 90 | 62.2 Ų | 62.2 | 48% | 0.481 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -79.6 | -32.1 | 176.9 | -77.4 | -34 | 0 | 0 | 0 | 112.1 | A72 F73 A74 Q189 | A72-N76 PolarHBondContact O-ND2 3.15Å; F73-N76 PolarHBondContact O-N 3.3Å; A74-N76 VanDerWaalsContact C-N 3.34Å; A74-N76 PolarHBondContact O-N 2.87Å; N76-Q189 WeakPolarHBondContact OD1-CG 3.19Å |
| 77 | Y | 89 | Confident | 87.9 | Confident | 107 Ų | 107 | 62.6 Ų | 62.6 | 42% | 0.42 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -88.4 | -44.5 | 179.5 | -169.9 | -91.9 | 0 | 0 | 0 | 112.8 | F73 A74 K79 F87 I90 | F73-Y77 WeakPolarHBondContact O-CB 3.17Å; F73-Y77 PolarHBondContact O-N 3.42Å; A74-Y77 PolarHBondContact O-N 3.36Å; Y77-K79 PolarHBondContact O-N 3.08Å; Y77-F87 HydrophobicContact CD1-CB 3.97Å; Y77-F87 AromaticContact CD1-CD2 3.85Å; Y77-F87 HydrophobicContact CD1-CD2 3.85Å; Y77-F87 HydrophobicContact CD1-CG 4.38Å; Y77-F87 HydrophobicContact CE1-CB 4.14Å; Y77-F87 HydrophobicContact CG-CD2 4.37Å; Y77-I90 HydrophobicContact CD1-CD1 4.49Å; Y77-I90 HydrophobicContact CD2-CD1 4.47Å; Y77-I90 HydrophobicContact CE1-CD1 3.8Å; Y77-I90 HydrophobicContact CE2-CD1 3.78Å; Y77-I90 WeakPolarHBondContact OH-CD1 3.4Å |
| 78 | V | 87.7 | Confident | 88 | Confident | 34 Ų | 34 | 59.8 Ų | 59.8 | 21% | 0.206 | 34% | 0.335 | C | S | . | . | trans | -86.8 | 95.2 | -175.8 | -176.8 | 0 | 0 | 0 | 0 | 109.8 | A74 D83 I84 F87 | A74-V78 WeakPolarHBondContact O-CB 3.31Å; A74-V78 WeakPolarHBondContact O-CG2 3.24Å; A74-V78 PolarHBondContact O-N 3.21Å; V78-D83 HydrophobicContact CG1-CB 4.42Å; V78-I84 HydrophobicContact CG1-CG1 3.69Å; V78-F87 HydrophobicContact CG2-CB 3.72Å; V78-F87 HydrophobicContact CG2-CD1 4.21Å; V78-F87 HydrophobicContact CG2-CD2 4.09Å; V78-F87 HydrophobicContact CG2-CG 3.74Å | ||
| 79 | K | 84.4 | Confident | 87.9 | Confident | 161 Ų | 161 | 63.8 Ų | 63.8 | 70% | 0.7 | 35% | 0.349 | S | S | * | . | trans | -99.7 | -32.2 | 178 | -63.3 | 179.9 | -177.5 | 177.4 | 0 | 112 | Y77 D83 | Y77-K79 PolarHBondContact O-N 3.08Å; K79-D83 PolarHBondContact N-OD2 2.6Å | ||
| 80 | S | 81.4 | Confident | 87.9 | Confident | 61 Ų | 61 | 63.5 Ų | 63.5 | 43% | 0.427 | 35% | 0.347 | S | S | . | . | S | Bend | trans | -127.1 | 163.6 | 178.4 | -174.4 | 0 | 0 | 0 | 0 | 111.6 | S82 D83 | S80-S82 PolarHBondContact O-N 3.1Å; S80-D83 PolarHBondContact N-OD2 3.08Å; S80-D83 WeakPolarHBondContact O-CB 3.5Å; S80-D83 PolarHBondContact O-N 3.45Å |
| 81 | S | 79.2 | Confident | 87.9 | Confident | 97 Ų | 97 | 63.6 Ų | 63.6 | 68% | 0.678 | 34% | 0.343 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.9 | -27.6 | 176.8 | 57.4 | 0 | 0 | 0 | 0 | 113 | D83 I84 | S81-D83 VanDerWaalsContact C-N 3.29Å; S81-D83 PolarHBondContact O-N 3.09Å; S81-I84 WeakPolarHBondContact O-CB 3.37Å; S81-I84 PolarHBondContact O-N 3.12Å |
| 82 | S | 82.6 | Confident | 88 | Confident | 70 Ų | 70 | 66.9 Ų | 66.9 | 49% | 0.49 | 36% | 0.359 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.4 | -33.7 | 172.9 | 52.6 | 0 | 0 | 0 | 0 | 113 | S80 I84 V85 | S80-S82 PolarHBondContact O-N 3.1Å; S82-I84 PolarHBondContact O-N 2.92Å; S82-V85 PolarHBondContact O-N 3.26Å |
| 83 | D | 86.3 | Confident | 88 | Confident | 44 Ų | 44 | 67.1 Ų | 67.1 | 24% | 0.235 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -74.3 | -19.7 | -173.8 | -54 | -23.5 | 0 | 0 | 0 | 111.7 | V78 K79 S80 S81 V85 S86 F87 | V78-D83 HydrophobicContact CG1-CB 4.42Å; K79-D83 PolarHBondContact N-OD2 2.6Å; S80-D83 PolarHBondContact N-OD2 3.08Å; S80-D83 WeakPolarHBondContact O-CB 3.5Å; S80-D83 PolarHBondContact O-N 3.45Å; S81-D83 VanDerWaalsContact C-N 3.29Å; S81-D83 PolarHBondContact O-N 3.09Å; D83-V85 PolarHBondContact O-N 3.45Å; D83-S86 PolarHBondContact O-N 3.4Å; D83-F87 WeakPolarHBondContact O-CB 3.37Å; D83-F87 PolarHBondContact O-N 3.25Å |
| 84 | I | 86.5 | Confident | 88.1 | Confident | 80 Ų | 80 | 66.2 Ų | 66.2 | 41% | 0.41 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -58.2 | -38.3 | 176.2 | -60.3 | 174.3 | 0 | 0 | 0 | 110.5 | V78 S81 S82 F87 N88 | V78-I84 HydrophobicContact CG1-CG1 3.69Å; S81-I84 WeakPolarHBondContact O-CB 3.37Å; S81-I84 PolarHBondContact O-N 3.12Å; S82-I84 PolarHBondContact O-N 2.92Å; I84-F87 PolarHBondContact O-N 3.07Å; I84-N88 WeakPolarHBondContact O-CB 3.49Å; I84-N88 VanDerWaalsContact O-CG 3.3Å; I84-N88 PolarHBondContact O-N 2.88Å; I84-N88 PolarHBondContact O-ND2 2.97Å |
| 85 | V | 87.7 | Confident | 88.1 | Confident | 36 Ų | 36 | 69.1 Ų | 69.1 | 22% | 0.218 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -64.9 | -51.5 | 178.9 | -175.9 | 0 | 0 | 0 | 0 | 109.9 | S6 S82 D83 F87 N88 Y89 | S6-V85 WeakPolarHBondContact O-CG2 3.36Å; S82-V85 PolarHBondContact O-N 3.26Å; D83-V85 PolarHBondContact O-N 3.45Å; V85-F87 VanDerWaalsContact C-N 3.32Å; V85-F87 PolarHBondContact O-N 3.37Å; V85-N88 WeakPolarHBondContact O-CB 3.18Å; V85-N88 PolarHBondContact O-N 2.88Å; V85-Y89 HydrophobicContact CG1-CD2 4.09Å; V85-Y89 HydrophobicContact CG1-CE2 3.74Å; V85-Y89 WeakPolarHBondContact O-CD2 3.2Å; V85-Y89 PolarHBondContact O-N 3.42Å; V85-Y89 VanDerWaalsContact O-N 3.13Å |
| 86 | S | 89 | Confident | 88.3 | Confident | 54 Ų | 54 | 70.6 Ų | 70.6 | 38% | 0.378 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -60 | -41.9 | 177.5 | -58.6 | 0 | 0 | 0 | 0 | 111.8 | D83 N88 Y89 I90 | D83-S86 PolarHBondContact O-N 3.4Å; S86-N88 PolarHBondContact O-N 3.29Å; S86-Y89 PolarHBondContact O-N 2.83Å; S86-I90 WeakPolarHBondContact O-CG1 3.44Å; S86-I90 PolarHBondContact O-N 3.38Å |
| 87 | F | 90.4 | Very high | 88.5 | Confident | 51 Ų | 51 | 70.9 Ų | 70.9 | 22% | 0.224 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -63 | -40.1 | 176.4 | -174.4 | -103.7 | 0 | 0 | 0 | 112.3 | A74 Y77 V78 D83 I84 V85 Y89 I90 S91 | A74-F87 HydrophobicContact CB-CE1 4.13Å; A74-F87 HydrophobicContact CB-CE2 4.07Å; A74-F87 HydrophobicContact CB-CZ 3.59Å; Y77-F87 HydrophobicContact CD1-CB 3.97Å; Y77-F87 AromaticContact CD1-CD2 3.85Å; Y77-F87 HydrophobicContact CD1-CD2 3.85Å; Y77-F87 HydrophobicContact CD1-CG 4.38Å; Y77-F87 HydrophobicContact CE1-CB 4.14Å; Y77-F87 HydrophobicContact CG-CD2 4.37Å; V78-F87 HydrophobicContact CG2-CB 3.72Å; V78-F87 HydrophobicContact CG2-CD1 4.21Å; V78-F87 HydrophobicContact CG2-CD2 4.09Å; V78-F87 HydrophobicContact CG2-CG 3.74Å; D83-F87 WeakPolarHBondContact O-CB 3.37Å; D83-F87 PolarHBondContact O-N 3.25Å; I84-F87 PolarHBondContact O-N 3.07Å; V85-F87 VanDerWaalsContact C-N 3.32Å; V85-F87 PolarHBondContact O-N 3.37Å; F87-Y89 VanDerWaalsContact C-N 3.32Å; F87-Y89 PolarHBondContact O-N 3.38Å; F87-I90 PolarHBondContact O-N 3.19Å; F87-S91 WeakPolarHBondContact O-CB 2.91Å; F87-S91 PolarHBondContact O-N 3.14Å |
| 88 | N | 90.7 | Very high | 88.5 | Confident | 16 Ų | 16 | 71.3 Ų | 71.3 | 9% | 0.086 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -62 | -39.1 | 174.3 | -78.1 | -26.6 | 0 | 0 | 0 | 111.8 | V3 S6 I84 V85 S86 S91 L92 | V3-N88 HydrophobicContact CG2-CB 3.98Å; V3-N88 WeakPolarHBondContact CG2-O 3.44Å; S6-N88 PolarHBondContact OG-ND2 3.43Å; I84-N88 WeakPolarHBondContact O-CB 3.49Å; I84-N88 VanDerWaalsContact O-CG 3.3Å; I84-N88 PolarHBondContact O-N 2.88Å; I84-N88 PolarHBondContact O-ND2 2.97Å; V85-N88 WeakPolarHBondContact O-CB 3.18Å; V85-N88 PolarHBondContact O-N 2.88Å; S86-N88 PolarHBondContact O-N 3.29Å; N88-S91 WeakPolarHBondContact CA-OG 3.25Å; N88-S91 PolarHBondContact O-N 3.45Å; N88-S91 PolarHBondContact O-OG 2.91Å; N88-L92 PolarHBondContact O-N 3.04Å |
| 89 | Y | 91.3 | Very high | 88.7 | Confident | 117 Ų | 117 | 75.8 Ų | 75.8 | 46% | 0.459 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -65.9 | -41.9 | 174 | -78.9 | -73.6 | 0 | 0 | 0 | 112.6 | V3 V85 S86 F87 S91 L92 G93 | V3-Y89 HydrophobicContact CG1-CD1 3.9Å; V3-Y89 HydrophobicContact CG1-CE1 3.35Å; V3-Y89 HydrophobicContact CG1-CE2 4.18Å; V3-Y89 HydrophobicContact CG2-CD1 4.4Å; V85-Y89 HydrophobicContact CG1-CD2 4.09Å; V85-Y89 HydrophobicContact CG1-CE2 3.74Å; V85-Y89 WeakPolarHBondContact O-CD2 3.2Å; V85-Y89 PolarHBondContact O-N 3.42Å; V85-Y89 VanDerWaalsContact O-N 3.13Å; S86-Y89 PolarHBondContact O-N 2.83Å; F87-Y89 VanDerWaalsContact C-N 3.32Å; F87-Y89 PolarHBondContact O-N 3.38Å; Y89-S91 VanDerWaalsContact C-N 3.33Å; Y89-S91 PolarHBondContact O-N 2.75Å; Y89-L92 PolarHBondContact O-N 2.94Å; Y89-G93 PolarHBondContact O-N 3.46Å |
| 90 | I | 91.8 | Very high | 89 | Confident | 73 Ų | 73 | 73.5 Ų | 73.5 | 37% | 0.374 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -60 | -46.3 | 174.2 | -67.8 | 168 | 0 | 0 | 0 | 110.2 | Y77 S86 F87 L92 G93 L94 | Y77-I90 HydrophobicContact CD1-CD1 4.49Å; Y77-I90 HydrophobicContact CD2-CD1 4.47Å; Y77-I90 HydrophobicContact CE1-CD1 3.8Å; Y77-I90 HydrophobicContact CE2-CD1 3.78Å; Y77-I90 WeakPolarHBondContact OH-CD1 3.4Å; S86-I90 WeakPolarHBondContact O-CG1 3.44Å; S86-I90 PolarHBondContact O-N 3.38Å; F87-I90 PolarHBondContact O-N 3.19Å; I90-L92 VanDerWaalsContact C-N 3.3Å; I90-L92 PolarHBondContact O-N 3.19Å; I90-G93 PolarHBondContact O-N 2.78Å; I90-G93 VanDerWaalsContact O-N 3.11Å; I90-L94 HydrophobicContact CG2-CD1 4.42Å; I90-L94 PolarHBondContact O-N 3.27Å |
| 91 | S | 89.8 | Confident | 89.4 | Confident | 37 Ų | 37 | 75.3 Ų | 75.3 | 26% | 0.259 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -61.6 | -38.4 | 178.3 | 77.1 | 0 | 0 | 0 | 0 | 112.3 | F87 N88 Y89 L94 V95 | F87-S91 WeakPolarHBondContact O-CB 2.91Å; F87-S91 PolarHBondContact O-N 3.14Å; N88-S91 WeakPolarHBondContact CA-OG 3.25Å; N88-S91 PolarHBondContact O-N 3.45Å; N88-S91 PolarHBondContact O-OG 2.91Å; Y89-S91 VanDerWaalsContact C-N 3.33Å; Y89-S91 PolarHBondContact O-N 2.75Å; S91-L94 PolarHBondContact O-N 3.47Å; S91-V95 WeakPolarHBondContact O-CG2 3.39Å; S91-V95 PolarHBondContact O-N 3.14Å; S91-V95 VanDerWaalsContact O-N 3.08Å |
| 92 | L | 91.7 | Very high | 89.7 | Confident | 92 Ų | 92 | 73.9 Ų | 73.9 | 48% | 0.482 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -64.3 | -42.4 | 173.9 | 178.2 | 64.3 | 0 | 0 | 0 | 111.1 | V3 N88 Y89 I90 V95 A96 | V3-L92 HydrophobicContact CG2-CB 4.04Å; V3-L92 HydrophobicContact CG2-CD2 3.98Å; N88-L92 PolarHBondContact O-N 3.04Å; Y89-L92 PolarHBondContact O-N 2.94Å; I90-L92 VanDerWaalsContact C-N 3.3Å; I90-L92 PolarHBondContact O-N 3.19Å; L92-V95 PolarHBondContact O-N 3.48Å; L92-A96 VanDerWaalsContact O-CB 3.27Å; L92-A96 WeakPolarHBondContact O-CB 3.39Å; L92-A96 PolarHBondContact O-N 3.46Å |
| 93 | G | 93.1 | Very high | 89.9 | Confident | 35 Ų | 35 | 74.8 Ų | 74.8 | 36% | 0.361 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -58.6 | -46.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y89 I90 A96 V97 | Y89-G93 PolarHBondContact O-N 3.46Å; I90-G93 PolarHBondContact O-N 2.78Å; I90-G93 VanDerWaalsContact O-N 3.11Å; G93-A96 PolarHBondContact O-N 3.46Å; G93-V97 VanDerWaalsContact O-CG2 3.3Å; G93-V97 WeakPolarHBondContact O-CG2 3.41Å; G93-V97 PolarHBondContact O-N 2.97Å |
| 94 | L | 91.2 | Very high | 89.9 | Confident | 107 Ų | 107 | 78.7 Ų | 78.7 | 56% | 0.56 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -60.7 | -46.5 | 176.9 | -68.6 | 174.9 | 0 | 0 | 0 | 112.2 | I90 S91 V97 Q98 | I90-L94 HydrophobicContact CG2-CD1 4.42Å; I90-L94 PolarHBondContact O-N 3.27Å; S91-L94 PolarHBondContact O-N 3.47Å; L94-V97 PolarHBondContact O-N 3.31Å; L94-Q98 VanDerWaalsContact O-CG 3.26Å; L94-Q98 WeakPolarHBondContact O-CG 3.24Å; L94-Q98 PolarHBondContact O-N 2.99Å |
| 95 | V | 89.8 | Confident | 89.8 | Confident | 86 Ų | 86 | 80.9 Ų | 80.9 | 52% | 0.521 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -65.6 | -39.4 | 177.8 | 173.6 | 0 | 0 | 0 | 0 | 111.3 | S91 L92 Q98 F99 | S91-V95 WeakPolarHBondContact O-CG2 3.39Å; S91-V95 PolarHBondContact O-N 3.14Å; S91-V95 VanDerWaalsContact O-N 3.08Å; L92-V95 PolarHBondContact O-N 3.48Å; V95-Q98 PolarHBondContact O-N 3.43Å; V95-F99 WeakPolarHBondContact O-CB 3.36Å; V95-F99 PolarHBondContact O-N 3.04Å |
| 96 | A | 92.7 | Very high | 89.4 | Confident | 35 Ų | 35 | 84.1 Ų | 84.1 | 29% | 0.289 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -63.9 | -45.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | L92 G93 Q98 F99 F100 | L92-A96 VanDerWaalsContact O-CB 3.27Å; L92-A96 WeakPolarHBondContact O-CB 3.39Å; L92-A96 PolarHBondContact O-N 3.46Å; G93-A96 PolarHBondContact O-N 3.46Å; A96-Q98 VanDerWaalsContact C-N 3.33Å; A96-Q98 PolarHBondContact O-N 3.11Å; A96-F99 WeakPolarHBondContact O-CB 3.29Å; A96-F99 PolarHBondContact O-N 3.38Å; A96-F100 WeakPolarHBondContact O-CD2 3.36Å; A96-F100 PolarHBondContact O-N 3.26Å |
| 97 | V | 93.2 | Very high | 88.7 | Confident | 96 Ų | 96 | 90.8 Ų | 90.8 | 58% | 0.582 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -58.4 | -46.4 | 175.1 | 170 | 0 | 0 | 0 | 0 | 110.5 | G93 L94 F99 F100 L101 | G93-V97 VanDerWaalsContact O-CG2 3.3Å; G93-V97 WeakPolarHBondContact O-CG2 3.41Å; G93-V97 PolarHBondContact O-N 2.97Å; L94-V97 PolarHBondContact O-N 3.31Å; V97-F99 PolarHBondContact O-N 2.92Å; V97-F100 PolarHBondContact O-N 3.44Å; V97-L101 WeakPolarHBondContact O-CB 3.29Å; V97-L101 PolarHBondContact O-N 3.24Å |
| 98 | Q | 89 | Confident | 87.9 | Confident | 115 Ų | 115 | 95.6 Ų | 95.6 | 54% | 0.537 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -59.8 | -44.7 | 176.3 | -71.5 | 166.1 | -8.8 | 0 | 0 | 112 | L94 V95 A96 L101 S102 | L94-Q98 VanDerWaalsContact O-CG 3.26Å; L94-Q98 WeakPolarHBondContact O-CG 3.24Å; L94-Q98 PolarHBondContact O-N 2.99Å; V95-Q98 PolarHBondContact O-N 3.43Å; A96-Q98 VanDerWaalsContact C-N 3.33Å; A96-Q98 PolarHBondContact O-N 3.11Å; Q98-L101 WeakPolarHBondContact O-CB 3.49Å; Q98-L101 PolarHBondContact O-N 2.7Å; Q98-S102 PolarHBondContact O-N 2.98Å; Q98-S102 PolarHBondContact O-OG 3.3Å; Q98-S102 VanDerWaalsContact O-OG 3.08Å |
| 99 | F | 90 | Very high | 86.9 | Confident | 128 Ų | 128 | 97.9 Ų | 97.9 | 56% | 0.561 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -60.2 | -48.2 | 177.5 | 175.7 | -104.4 | 0 | 0 | 0 | 112.2 | V95 A96 V97 S102 I103 | V95-F99 WeakPolarHBondContact O-CB 3.36Å; V95-F99 PolarHBondContact O-N 3.04Å; A96-F99 WeakPolarHBondContact O-CB 3.29Å; A96-F99 PolarHBondContact O-N 3.38Å; V97-F99 PolarHBondContact O-N 2.92Å; F99-S102 PolarHBondContact O-N 2.84Å; F99-I103 HydrophobicContact CD1-CD1 3.93Å; F99-I103 HydrophobicContact CE1-CD1 3.4Å; F99-I103 VanDerWaalsContact CE1-CD1 3.4Å; F99-I103 HydrophobicContact CE2-CD1 4.09Å; F99-I103 HydrophobicContact CG-CD1 4.48Å; F99-I103 HydrophobicContact CZ-CD1 3.51Å; F99-I103 WeakPolarHBondContact O-CG1 3.29Å; F99-I103 PolarHBondContact O-N 2.9Å; F99-I103 VanDerWaalsContact O-N 3.08Å |
| 100 | F | 91.8 | Very high | 85.9 | Confident | 114 Ų | 114 | 97.5 Ų | 97.5 | 50% | 0.5 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.7 | -42.6 | 176.3 | -74.9 | -65.2 | 0 | 0 | 0 | 111.7 | A96 V97 S102 I103 F104 | A96-F100 WeakPolarHBondContact O-CD2 3.36Å; A96-F100 PolarHBondContact O-N 3.26Å; V97-F100 PolarHBondContact O-N 3.44Å; F100-S102 VanDerWaalsContact C-N 3.3Å; F100-S102 PolarHBondContact O-N 2.77Å; F100-I103 PolarHBondContact O-N 3.19Å; F100-I103 VanDerWaalsContact O-N 3.14Å; F100-F104 HydrophobicContact CB-CD2 4.28Å; F100-F104 HydrophobicContact CB-CE2 4.24Å; F100-F104 HydrophobicContact CD1-CE2 4.17Å; F100-F104 WeakPolarHBondContact O-CD2 3.41Å; F100-F104 PolarHBondContact O-N 2.88Å |
| 101 | L | 89.2 | Confident | 84.8 | Confident | 98 Ų | 98 | 95.4 Ų | 95.4 | 51% | 0.513 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -57.2 | -45.1 | 176.4 | -167.7 | 72.7 | 0 | 0 | 0 | 110.8 | V97 Q98 I103 F104 L105 | V97-L101 WeakPolarHBondContact O-CB 3.29Å; V97-L101 PolarHBondContact O-N 3.24Å; Q98-L101 WeakPolarHBondContact O-CB 3.49Å; Q98-L101 PolarHBondContact O-N 2.7Å; L101-I103 PolarHBondContact O-N 2.84Å; L101-F104 PolarHBondContact O-N 3.3Å; L101-L105 HydrophobicContact CB-CD1 4.43Å; L101-L105 HydrophobicContact CD1-CD1 3.15Å; L101-L105 HydrophobicContact CD2-CD1 4.29Å; L101-L105 HydrophobicContact CG-CD1 3.33Å; L101-L105 WeakPolarHBondContact O-CB 3.29Å; L101-L105 WeakPolarHBondContact O-CD1 3.41Å; L101-L105 PolarHBondContact O-N 3.43Å |
| 102 | S | 86.1 | Confident | 83.4 | Confident | 68 Ų | 68 | 100 Ų | 100 | 48% | 0.476 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60.8 | -43.2 | 175 | -63.5 | 0 | 0 | 0 | 0 | 112.4 | Q98 F99 F100 V106 | Q98-S102 PolarHBondContact O-N 2.98Å; Q98-S102 PolarHBondContact O-OG 3.3Å; Q98-S102 VanDerWaalsContact O-OG 3.08Å; F99-S102 PolarHBondContact O-N 2.84Å; F100-S102 VanDerWaalsContact C-N 3.3Å; F100-S102 PolarHBondContact O-N 2.77Å; S102-V106 WeakPolarHBondContact O-CA 3.28Å; S102-V106 WeakPolarHBondContact O-CB 3Å; S102-V106 WeakPolarHBondContact O-CG2 3.49Å; S102-V106 PolarHBondContact O-N 3.45Å |
| 103 | I | 86.3 | Confident | 82 | Confident | 88 Ų | 88 | 100.8 Ų | 100.8 | 45% | 0.451 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63.1 | -43.4 | 177 | -69.7 | 170.1 | 0 | 0 | 0 | 111.5 | F99 F100 L101 | F99-I103 HydrophobicContact CD1-CD1 3.93Å; F99-I103 HydrophobicContact CE1-CD1 3.4Å; F99-I103 VanDerWaalsContact CE1-CD1 3.4Å; F99-I103 HydrophobicContact CE2-CD1 4.09Å; F99-I103 HydrophobicContact CG-CD1 4.48Å; F99-I103 HydrophobicContact CZ-CD1 3.51Å; F99-I103 WeakPolarHBondContact O-CG1 3.29Å; F99-I103 PolarHBondContact O-N 2.9Å; F99-I103 VanDerWaalsContact O-N 3.08Å; F100-I103 PolarHBondContact O-N 3.19Å; F100-I103 VanDerWaalsContact O-N 3.14Å; L101-I103 PolarHBondContact O-N 2.84Å |
| 104 | F | 87.3 | Confident | 80.6 | Confident | 126 Ų | 126 | 102.7 Ų | 102.7 | 55% | 0.553 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -79 | -36.5 | -173.9 | -73.6 | -65 | 0 | 0 | 0 | 113.5 | F100 L101 R107 | F100-F104 HydrophobicContact CB-CD2 4.28Å; F100-F104 HydrophobicContact CB-CE2 4.24Å; F100-F104 HydrophobicContact CD1-CE2 4.17Å; F100-F104 WeakPolarHBondContact O-CD2 3.41Å; F100-F104 PolarHBondContact O-N 2.88Å; L101-F104 PolarHBondContact O-N 3.3Å; F104-R107 PolarHBondContact O-NE 3.44Å; F104-R107 VanDerWaalsContact O-NE 3.12Å |
| 105 | L | 84 | Confident | 79.2 | Confident | 127 Ų | 127 | 99.1 Ų | 99.1 | 67% | 0.665 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -87.8 | -41.3 | -179.7 | -78.5 | 137.6 | 0 | 0 | 0 | 113 | L101 R107 | L101-L105 HydrophobicContact CB-CD1 4.43Å; L101-L105 HydrophobicContact CD1-CD1 3.15Å; L101-L105 HydrophobicContact CD2-CD1 4.29Å; L101-L105 HydrophobicContact CG-CD1 3.33Å; L101-L105 WeakPolarHBondContact O-CB 3.29Å; L101-L105 WeakPolarHBondContact O-CD1 3.41Å; L101-L105 PolarHBondContact O-N 3.43Å; L105-R107 VanDerWaalsContact C-N 3.32Å; L105-R107 PolarHBondContact O-N 2.98Å |
| 106 | V | 78.5 | Confident | 77.7 | Confident | 103 Ų | 103 | 96.3 Ų | 96.3 | 62% | 0.624 | 51% | 0.505 | S | S | * | . | trans | -88.5 | 72.9 | -176.3 | -168.6 | 0 | 0 | 0 | 0 | 109.7 | S102 | S102-V106 WeakPolarHBondContact O-CA 3.28Å; S102-V106 WeakPolarHBondContact O-CB 3Å; S102-V106 WeakPolarHBondContact O-CG2 3.49Å; S102-V106 PolarHBondContact O-N 3.45Å | ||
| 107 | R | 75.3 | Confident | 76 | Confident | 194 Ų | 194 | 103.7 Ų | 103.7 | 73% | 0.732 | 53% | 0.527 | S | S | * | . | trans | -87.9 | -13.6 | -179.6 | -68.8 | -174.4 | -179.8 | 157.7 | -0.3 | 114.6 | F104 L105 | F104-R107 PolarHBondContact O-NE 3.44Å; F104-R107 VanDerWaalsContact O-NE 3.12Å; L105-R107 VanDerWaalsContact C-N 3.32Å; L105-R107 PolarHBondContact O-N 2.98Å | ||
| 108 | R | 72.6 | Confident | 74.4 | Confident | 152 Ų | 152 | 103.9 Ų | 103.9 | 57% | 0.574 | 53% | 0.528 | S | S | * | . | trans | -133.3 | 139.6 | -177.1 | -62.7 | -171.8 | -179.4 | -164.7 | 2.4 | 109.1 | W46 | W46-R108 HydrophobicContact CH2-CB 4.34Å; W46-R108 HydrophobicContact CZ2-CB 4.35Å; W46-R108 WeakPolarHBondContact CZ2-O 3.47Å | ||
| 109 | G | 69.6 | Low | 72.9 | Confident | 64 Ų | 64 | 99 Ų | 99 | 66% | 0.66 | 51% | 0.508 | S | S | * | . | S | Bend | trans | -75.7 | -28.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | W46 | W46-G109 PolarHBondContact NE1-O 2.94Š|
| 110 | K | 70.6 | Confident | 71.4 | Confident | 109 Ų | 109 | 95.8 Ų | 95.8 | 47% | 0.474 | 50% | 0.499 | S | S | . | . | S | Bend | trans | -135.1 | 149.5 | -178 | -65.7 | -173.5 | 176.8 | -170.4 | 0 | 110.9 | ||
| 111 | P | 68.5 | Low | 69.9 | Low | 30 Ų | 30 | 93.1 Ų | 93.1 | 20% | 0.195 | 49% | 0.492 | C | S | . | . | trans | -62.8 | 157.9 | 173.5 | 29.5 | -36.5 | 0 | 0 | 0 | 111.1 | D45 W46 | D45-P111 WeakPolarHBondContact O-CD 3.45Å; D45-P111 WeakPolarHBondContact O-CG 3.12Å; W46-P111 HydrophobicContact CD2-CB 4.24Å; W46-P111 HydrophobicContact CD2-CG 4.39Å; W46-P111 HydrophobicContact CE3-CB 3.94Å; W46-P111 HydrophobicContact CZ3-CB 4.15Å | ||
| 112 | I | 60.2 | Low | 68.6 | Low | 134 Ų | 134 | 91 Ų | 91 | 69% | 0.687 | 49% | 0.488 | S | S | * | . | S | Bend | trans | -66.6 | -42.4 | 179.7 | -58.1 | 177 | 0 | 0 | 0 | 110.6 | ||
| 113 | T | 64 | Low | 67.4 | Low | 108 Ų | 108 | 90.2 Ų | 90.2 | 66% | 0.663 | 48% | 0.478 | S | S | * | . | S | Bend | trans | -102.1 | 124.7 | 175.6 | 43.5 | 0 | 0 | 0 | 0 | 108.9 | ||
| 114 | P | 62.9 | Low | 66.1 | Low | 75 Ų | 75 | 88.2 Ų | 88.2 | 49% | 0.487 | 48% | 0.475 | S | S | . | . | trans | -61.3 | 142.9 | 178.4 | 23.6 | -31 | 0 | 0 | 0 | 110.8 | S116 T120 | P114-S116 VanDerWaalsContact C-N 3.34Å; P114-S116 PolarHBondContact O-N 3.38Å; P114-T120 WeakPolarHBondContact CB-OG1 3.32Å; P114-T120 WeakPolarHBondContact CG-OG1 3.36Å | ||
| 115 | P | 60.6 | Low | 64.7 | Low | 32 Ų | 32 | 87 Ų | 87 | 21% | 0.208 | 47% | 0.474 | C | S | . | . | S | Bend | trans | -70.2 | -25.4 | -171.6 | 26.1 | -35.1 | 0 | 0 | 0 | 114.1 | D45 F47 A119 | D45-P115 WeakPolarHBondContact O-CG 3.37Å; F47-P115 WeakPolarHBondContact O-CB 3.45Å; P115-A119 HydrophobicContact CG-CB 4.15Å |
| 116 | S | 59.4 | Low | 63.4 | Low | 26 Ų | 26 | 90.8 Ų | 90.8 | 18% | 0.182 | 48% | 0.479 | C | S | . | . | trans | -156.3 | 156.9 | 173.9 | 72.3 | 0 | 0 | 0 | 0 | 112.2 | D49 P114 V118 A119 T120 | D49-S116 WeakPolarHBondContact OD2-CB 3.38Å; D49-S116 PolarHBondContact OD2-OG 3.46Å; P114-S116 VanDerWaalsContact C-N 3.34Å; P114-S116 PolarHBondContact O-N 3.38Å; S116-V118 VanDerWaalsContact C-N 3.26Å; S116-V118 PolarHBondContact O-N 2.98Å; S116-A119 WeakPolarHBondContact O-CB 3.26Å; S116-A119 PolarHBondContact O-N 2.86Å; S116-A119 VanDerWaalsContact O-N 3.13Å; S116-A119 PolarHBondContact OG-N 2.87Å; S116-T120 PolarHBondContact O-N 2.9Å; S116-T120 VanDerWaalsContact O-N 3.11Å; S116-T120 PolarHBondContact O-OG1 2.71Å | ||
| 117 | Y | 57.6 | Low | 62.2 | Low | 190 Ų | 190 | 94.9 Ų | 94.9 | 75% | 0.745 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -56.7 | -40 | 175.3 | 179.9 | -99.8 | 0 | 0 | 0 | 111.8 | A119 T120 V121 | Y117-A119 VanDerWaalsContact C-N 3.34Å; Y117-A119 PolarHBondContact O-N 3.28Å; Y117-T120 WeakPolarHBondContact O-CA 3.19Å; Y117-T120 WeakPolarHBondContact O-CB 3.27Å; Y117-T120 PolarHBondContact O-N 3.35Å; Y117-T120 VanDerWaalsContact O-N 3.1Å; Y117-V121 HydrophobicContact CD1-CG2 4.16Å; Y117-V121 HydrophobicContact CE1-CG2 3.8Å; Y117-V121 WeakPolarHBondContact O-CG2 3.31Å; Y117-V121 PolarHBondContact O-N 3.06Å |
| 118 | V | 59.5 | Low | 61.3 | Low | 100 Ų | 100 | 91 Ų | 91 | 61% | 0.606 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -62.3 | -40.3 | 176.8 | -177.6 | 0 | 0 | 0 | 0 | 111.4 | S116 T120 V121 A122 | S116-V118 VanDerWaalsContact C-N 3.26Å; S116-V118 PolarHBondContact O-N 2.98Å; V118-T120 VanDerWaalsContact C-N 3.32Å; V118-T120 PolarHBondContact O-N 3.26Å; V118-V121 PolarHBondContact O-N 2.84Å; V118-A122 WeakPolarHBondContact O-CB 3.4Å; V118-A122 PolarHBondContact O-N 3.47Å |
| 119 | A | 58.1 | Low | 60.4 | Low | 13 Ų | 13 | 89.5 Ų | 89.5 | 11% | 0.107 | 49% | 0.485 | C | S | . | . | H | α-helix | trans | -63.5 | -39 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | P115 S116 Y117 A122 I123 | P115-A119 HydrophobicContact CG-CB 4.15Å; S116-A119 WeakPolarHBondContact O-CB 3.26Å; S116-A119 PolarHBondContact O-N 2.86Å; S116-A119 VanDerWaalsContact O-N 3.13Å; S116-A119 PolarHBondContact OG-N 2.87Å; Y117-A119 VanDerWaalsContact C-N 3.34Å; Y117-A119 PolarHBondContact O-N 3.28Å; A119-A122 PolarHBondContact O-N 3.36Å; A119-I123 WeakPolarHBondContact O-CB 3.11Å; A119-I123 WeakPolarHBondContact O-CD1 3.49Å; A119-I123 WeakPolarHBondContact O-CG1 3.49Å; A119-I123 PolarHBondContact O-N 3.04Å |
| 120 | T | 57.6 | Low | 59.5 | Low | 60 Ų | 60 | 89.8 Ų | 89.8 | 37% | 0.368 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -61.5 | -45.4 | 174.1 | -52.4 | 0 | 0 | 0 | 0 | 111.6 | P114 S116 Y117 V118 I123 A124 | P114-T120 WeakPolarHBondContact CB-OG1 3.32Å; P114-T120 WeakPolarHBondContact CG-OG1 3.36Å; S116-T120 PolarHBondContact O-N 2.9Å; S116-T120 VanDerWaalsContact O-N 3.11Å; S116-T120 PolarHBondContact O-OG1 2.71Å; Y117-T120 WeakPolarHBondContact O-CA 3.19Å; Y117-T120 WeakPolarHBondContact O-CB 3.27Å; Y117-T120 PolarHBondContact O-N 3.35Å; Y117-T120 VanDerWaalsContact O-N 3.1Å; V118-T120 VanDerWaalsContact C-N 3.32Å; V118-T120 PolarHBondContact O-N 3.26Å; T120-I123 PolarHBondContact O-N 3.31Å; T120-A124 WeakPolarHBondContact O-CB 3.33Å; T120-A124 PolarHBondContact O-N 3.18Å |
| 121 | V | 60.1 | Low | 58.5 | Low | 59 Ų | 59 | 91.8 Ų | 91.8 | 36% | 0.358 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.2 | -42.6 | 176.4 | 178.3 | 0 | 0 | 0 | 0 | 111.3 | Y117 V118 I123 A124 N125 | Y117-V121 HydrophobicContact CD1-CG2 4.16Å; Y117-V121 HydrophobicContact CE1-CG2 3.8Å; Y117-V121 WeakPolarHBondContact O-CG2 3.31Å; Y117-V121 PolarHBondContact O-N 3.06Å; V118-V121 PolarHBondContact O-N 2.84Å; V121-I123 PolarHBondContact O-N 3.47Å; V121-A124 PolarHBondContact O-N 2.93Å; V121-N125 WeakPolarHBondContact O-CB 3.49Å; V121-N125 PolarHBondContact O-N 3.37Å |
| 122 | A | 61.4 | Low | 57.5 | Low | 52 Ų | 52 | 99.9 Ų | 99.9 | 43% | 0.43 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64 | -39.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | V118 A119 R126 | V118-A122 WeakPolarHBondContact O-CB 3.4Å; V118-A122 PolarHBondContact O-N 3.47Å; A119-A122 PolarHBondContact O-N 3.36Å; A122-R126 WeakPolarHBondContact O-CB 3.42Å; A122-R126 PolarHBondContact O-N 3.18Å |
| 123 | I | 61.7 | Low | 57 | Low | 52 Ų | 52 | 102.4 Ų | 102.4 | 27% | 0.267 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -66.7 | -42.6 | 174.1 | -69 | 165.5 | 0 | 0 | 0 | 110.6 | A119 T120 V121 R126 R127 | A119-I123 WeakPolarHBondContact O-CB 3.11Å; A119-I123 WeakPolarHBondContact O-CD1 3.49Å; A119-I123 WeakPolarHBondContact O-CG1 3.49Å; A119-I123 PolarHBondContact O-N 3.04Å; T120-I123 PolarHBondContact O-N 3.31Å; V121-I123 PolarHBondContact O-N 3.47Å; I123-R126 PolarHBondContact O-N 3.38Å; I123-R127 WeakPolarHBondContact O-CB 3.49Å; I123-R127 PolarHBondContact O-N 2.92Å |
| 124 | A | 59.6 | Low | 56.3 | Low | 47 Ų | 47 | 107 Ų | 107 | 39% | 0.388 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -61.2 | -48.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111 | T120 V121 R126 R127 V128 | T120-A124 WeakPolarHBondContact O-CB 3.33Å; T120-A124 PolarHBondContact O-N 3.18Å; V121-A124 PolarHBondContact O-N 2.93Å; A124-R126 PolarHBondContact O-N 3.48Å; A124-R127 PolarHBondContact O-N 2.72Å; A124-R127 VanDerWaalsContact O-N 3.16Å; A124-V128 WeakPolarHBondContact O-CG2 3.37Å; A124-V128 PolarHBondContact O-N 3.37Å |
| 125 | N | 57.6 | Low | 55.9 | Low | 100 Ų | 100 | 106.4 Ų | 106.4 | 54% | 0.535 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -61.3 | -41.3 | 176.2 | -74.9 | -14.9 | 0 | 0 | 0 | 112.3 | V121 N129 | V121-N125 WeakPolarHBondContact O-CB 3.49Å; V121-N125 PolarHBondContact O-N 3.37Å; N125-N129 PolarHBondContact O-N 3.41Å |
| 126 | R | 56.4 | Low | 56.1 | Low | 206 Ų | 206 | 109.8 Ų | 109.8 | 78% | 0.777 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -64.5 | -40.5 | 173.2 | -89.1 | -167.8 | -173.5 | 178.8 | 4.9 | 112.6 | A122 I123 A124 N129 S130 | A122-R126 WeakPolarHBondContact O-CB 3.42Å; A122-R126 PolarHBondContact O-N 3.18Å; I123-R126 PolarHBondContact O-N 3.38Å; A124-R126 PolarHBondContact O-N 3.48Å; R126-N129 PolarHBondContact O-N 2.86Å; R126-S130 WeakPolarHBondContact O-CB 3.47Å; R126-S130 PolarHBondContact O-N 3.21Å |
| 127 | R | 52.9 | Low | 56.7 | Low | 190 Ų | 190 | 114.5 Ų | 114.5 | 72% | 0.717 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -64.1 | -42.2 | 177.7 | -105.4 | -176.4 | -172.9 | 162.9 | 2.4 | 112 | I123 A124 N129 S130 | I123-R127 WeakPolarHBondContact O-CB 3.49Å; I123-R127 PolarHBondContact O-N 2.92Å; A124-R127 PolarHBondContact O-N 2.72Å; A124-R127 VanDerWaalsContact O-N 3.16Å; R127-N129 VanDerWaalsContact C-N 3.29Å; R127-N129 PolarHBondContact O-N 3.24Å; R127-S130 PolarHBondContact O-N 3.14Å; R127-S130 VanDerWaalsContact O-N 3.17Å |
| 128 | V | 56.1 | Low | 57.5 | Low | 111 Ų | 111 | 110.9 Ų | 110.9 | 67% | 0.673 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -60.1 | -41.1 | 175.8 | 173.4 | 0 | 0 | 0 | 0 | 110.7 | A124 | A124-V128 WeakPolarHBondContact O-CG2 3.37Å; A124-V128 PolarHBondContact O-N 3.37Å |
| 129 | N | 53.5 | Low | 58.1 | Low | 122 Ų | 122 | 109.1 Ų | 109.1 | 65% | 0.652 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -76.3 | -21.5 | 176 | -79.4 | -10.3 | 0 | 0 | 0 | 114.6 | N125 R126 R127 N131 I135 | N125-N129 PolarHBondContact O-N 3.41Å; R126-N129 PolarHBondContact O-N 2.86Å; R127-N129 VanDerWaalsContact C-N 3.29Å; R127-N129 PolarHBondContact O-N 3.24Å; N129-N131 VanDerWaalsContact C-N 3.26Å; N129-N131 PolarHBondContact O-N 2.97Å; N129-I135 WeakPolarHBondContact O-CD1 3.45Å |
| 130 | S | 51.6 | Low | 59 | Low | 69 Ų | 69 | 112.6 Ų | 112.6 | 48% | 0.483 | 58% | 0.576 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -71.7 | -13.1 | -175.7 | -170.1 | 0 | 0 | 0 | 0 | 114.3 | R126 R127 R132 | R126-S130 WeakPolarHBondContact O-CB 3.47Å; R126-S130 PolarHBondContact O-N 3.21Å; R127-S130 PolarHBondContact O-N 3.14Å; R127-S130 VanDerWaalsContact O-N 3.17Å; S130-R132 PolarHBondContact O-N 2.9Å |
| 131 | N | 48.6 | Very low | 60.2 | Low | 152 Ų | 152 | 112.1 Ų | 112.1 | 81% | 0.813 | 57% | 0.574 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.5 | -4.7 | 178.7 | -87.5 | -3.6 | 0 | 0 | 0 | 114.1 | N129 H133 | N129-N131 VanDerWaalsContact C-N 3.26Å; N129-N131 PolarHBondContact O-N 2.97Å; N131-H133 PolarHBondContact O-N 3.29Å |
| 132 | R | 49.3 | Very low | 61 | Low | 200 Ų | 200 | 112.4 Ų | 112.4 | 76% | 0.755 | 57% | 0.574 | S | S | * | * | trans | -90.7 | 88.5 | 168.4 | -82.2 | -170.8 | 166.4 | -162.2 | -2.8 | 110.6 | S130 F134 I135 | S130-R132 PolarHBondContact O-N 2.9Å; R132-F134 PolarHBondContact O-N 2.87Å; R132-I135 HydrophobicContact CB-CD1 3.75Å; R132-I135 HydrophobicContact CB-CG1 3.97Å; R132-I135 VanDerWaalsContact O-CB 3.24Å; R132-I135 WeakPolarHBondContact O-CB 3.38Å; R132-I135 WeakPolarHBondContact O-CD1 3.39Å; R132-I135 WeakPolarHBondContact O-CG1 3.42Å; R132-I135 PolarHBondContact O-N 2.91Å | ||
| 133 | H | 49.3 | Very low | 61.8 | Low | 187 Ų | 187 | 114.4 Ų | 114.4 | 87% | 0.866 | 57% | 0.573 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.2 | -3.1 | 174.7 | -106.7 | 61.2 | 0 | 0 | 0 | 115.2 | N131 I135 | N131-H133 PolarHBondContact O-N 3.29Å; H133-I135 PolarHBondContact O-N 2.85Å |
| 134 | F | 49.5 | Very low | 62.9 | Low | 203 Ų | 203 | 116.8 Ų | 116.8 | 89% | 0.89 | 59% | 0.586 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.8 | 12 | 171.3 | -112.2 | -92.3 | 0 | 0 | 0 | 114.3 | R132 | R132-F134 PolarHBondContact O-N 2.87Š|
| 135 | I | 54.2 | Low | 64 | Low | 64 Ų | 64 | 120.8 Ų | 120.8 | 33% | 0.328 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -82.5 | -18.1 | -165.7 | -83.2 | 170.6 | 0 | 0 | 0 | 115.3 | N129 R132 H133 L137 H138 S139 | N129-I135 WeakPolarHBondContact O-CD1 3.45Å; R132-I135 HydrophobicContact CB-CD1 3.75Å; R132-I135 HydrophobicContact CB-CG1 3.97Å; R132-I135 VanDerWaalsContact O-CB 3.24Å; R132-I135 WeakPolarHBondContact O-CB 3.38Å; R132-I135 WeakPolarHBondContact O-CD1 3.39Å; R132-I135 WeakPolarHBondContact O-CG1 3.42Å; R132-I135 PolarHBondContact O-N 2.91Å; H133-I135 PolarHBondContact O-N 2.85Å; I135-L137 PolarHBondContact O-N 3.16Å; I135-H138 PolarHBondContact O-N 2.8Å; I135-S139 WeakPolarHBondContact O-CA 3.22Å; I135-S139 WeakPolarHBondContact O-CB 3.48Å; I135-S139 PolarHBondContact O-N 3.2Å |
| 136 | S | 65.2 | Low | 65.2 | Low | 102 Ų | 102 | 117.4 Ų | 117.4 | 71% | 0.713 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -57.2 | -53.5 | -172.9 | 165.8 | 0 | 0 | 0 | 0 | 112.8 | L140 | S136-L140 VanDerWaalsContact O-CB 3.27Å; S136-L140 WeakPolarHBondContact O-CB 3.34Å; S136-L140 PolarHBondContact O-N 3.36Å |
| 137 | L | 71.9 | Confident | 66.5 | Low | 126 Ų | 126 | 109.2 Ų | 109.2 | 66% | 0.66 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -73.7 | -40.8 | -177.1 | -168.5 | 64.8 | 0 | 0 | 0 | 111.8 | I135 L140 C141 | I135-L137 PolarHBondContact O-N 3.16Å; L137-L140 PolarHBondContact O-N 3.13Å; L137-C141 WeakPolarHBondContact O-CB 3.12Å; L137-C141 PolarHBondContact O-N 3.46Å; L137-C141 PolarHBondContact O-SG 3.38Å |
| 138 | H | 72.7 | Confident | 68.2 | Low | 113 Ų | 113 | 102.3 Ų | 102.3 | 52% | 0.523 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -65.4 | -44.9 | 178.8 | -175.3 | 57.9 | 0 | 0 | 0 | 112 | I135 L140 C141 D142 | I135-H138 PolarHBondContact O-N 2.8Å; H138-L140 VanDerWaalsContact C-N 3.3Å; H138-L140 PolarHBondContact O-N 3.43Å; H138-C141 CarbonylContact O-C 3.45Å; H138-C141 WeakPolarHBondContact O-CB 3.37Å; H138-C141 PolarHBondContact O-N 3.17Å; H138-C141 VanDerWaalsContact O-N 3.16Å; H138-D142 IonicContact CD2-OD2 2.98Å; H138-D142 PolarHBondContact CD2-OD2 2.97Å; H138-D142 IonicContact CE1-OD1 3.27Å; H138-D142 IonicContact CE1-OD2 3.2Å; H138-D142 PolarHBondContact CE1-OD2 3.14Å; H138-D142 IonicContact CG-OD2 3.99Å; H138-D142 IonicContact ND1-OD1 2.92Å; H138-D142 IonicContact ND1-OD2 3.46Å; H138-D142 IonicContact NE2-OD2 3.93Å; H138-D142 PolarHBondContact NE2-OD2 3.18Å; H138-D142 VanDerWaalsContact O-CG 3.29Å; H138-D142 PolarHBondContact O-N 3.5Å |
| 139 | S | 72.2 | Confident | 69.5 | Low | 63 Ų | 63 | 99.9 Ų | 99.9 | 44% | 0.441 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64 | -36.1 | 174.6 | -179.1 | 0 | 0 | 0 | 0 | 112 | I135 D142 F143 | I135-S139 WeakPolarHBondContact O-CA 3.22Å; I135-S139 WeakPolarHBondContact O-CB 3.48Å; I135-S139 PolarHBondContact O-N 3.2Å; S139-D142 PolarHBondContact O-N 3.01Å; S139-F143 WeakPolarHBondContact O-CB 3.4Å; S139-F143 PolarHBondContact O-N 3.28Å |
| 140 | L | 78.1 | Confident | 71 | Confident | 87 Ų | 87 | 94.3 Ų | 94.3 | 46% | 0.455 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.5 | -44.5 | 173.1 | -174.4 | 71.9 | 0 | 0 | 0 | 110.2 | S136 L137 H138 D142 F143 L144 | S136-L140 VanDerWaalsContact O-CB 3.27Å; S136-L140 WeakPolarHBondContact O-CB 3.34Å; S136-L140 PolarHBondContact O-N 3.36Å; L137-L140 PolarHBondContact O-N 3.13Å; H138-L140 VanDerWaalsContact C-N 3.3Å; H138-L140 PolarHBondContact O-N 3.43Å; L140-D142 VanDerWaalsContact C-N 3.35Å; L140-D142 PolarHBondContact O-N 3.06Å; L140-F143 PolarHBondContact O-N 3.29Å; L140-L144 HydrophobicContact CG-CD1 4.17Å; L140-L144 HydrophobicContact CG-CG 4.49Å; L140-L144 WeakPolarHBondContact O-CB 3.31Å; L140-L144 WeakPolarHBondContact O-CG 3.45Å; L140-L144 PolarHBondContact O-N 2.98Å |
| 141 | C | 81.4 | Confident | 72.7 | Confident | 50 Ų | 50 | 93.8 Ų | 93.8 | 34% | 0.338 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -61.1 | -41.8 | 175.4 | -71.1 | 0 | 0 | 0 | 0 | 112.1 | L137 H138 L144 K145 | L137-C141 WeakPolarHBondContact O-CB 3.12Å; L137-C141 PolarHBondContact O-N 3.46Å; L137-C141 PolarHBondContact O-SG 3.38Å; H138-C141 CarbonylContact O-C 3.45Å; H138-C141 WeakPolarHBondContact O-CB 3.37Å; H138-C141 PolarHBondContact O-N 3.17Å; H138-C141 VanDerWaalsContact O-N 3.16Å; C141-L144 PolarHBondContact O-N 3.44Å; C141-K145 WeakPolarHBondContact O-CB 3.27Å; C141-K145 WeakPolarHBondContact O-CG 3.35Å; C141-K145 PolarHBondContact O-N 3.2Å |
| 142 | D | 77.9 | Confident | 74.6 | Confident | 64 Ų | 64 | 95 Ų | 95 | 34% | 0.342 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -69.5 | -38.6 | 178.2 | -67.9 | -18.4 | 0 | 0 | 0 | 111.6 | H138 S139 L140 K145 A146 | H138-D142 IonicContact CD2-OD2 2.98Å; H138-D142 PolarHBondContact CD2-OD2 2.97Å; H138-D142 IonicContact CE1-OD1 3.27Å; H138-D142 IonicContact CE1-OD2 3.2Å; H138-D142 PolarHBondContact CE1-OD2 3.14Å; H138-D142 IonicContact CG-OD2 3.99Å; H138-D142 IonicContact ND1-OD1 2.92Å; H138-D142 IonicContact ND1-OD2 3.46Å; H138-D142 IonicContact NE2-OD2 3.93Å; H138-D142 PolarHBondContact NE2-OD2 3.18Å; H138-D142 VanDerWaalsContact O-CG 3.29Å; H138-D142 PolarHBondContact O-N 3.5Å; S139-D142 PolarHBondContact O-N 3.01Å; L140-D142 VanDerWaalsContact C-N 3.35Å; L140-D142 PolarHBondContact O-N 3.06Å; D142-K145 PolarHBondContact O-N 3.4Å; D142-K145 IonicContact OD1-NZ 3.94Å; D142-A146 PolarHBondContact O-N 3.36Å |
| 143 | F | 79.1 | Confident | 76.4 | Confident | 94 Ų | 94 | 87.3 Ų | 87.3 | 41% | 0.412 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -60 | -47.8 | 170.5 | 178 | -106.1 | 0 | 0 | 0 | 111.3 | S139 L140 K145 A146 F147 I283 | S139-F143 WeakPolarHBondContact O-CB 3.4Å; S139-F143 PolarHBondContact O-N 3.28Å; L140-F143 PolarHBondContact O-N 3.29Å; F143-K145 PolarHBondContact O-N 3.28Å; F143-A146 WeakPolarHBondContact O-CB 3.4Å; F143-A146 PolarHBondContact O-N 3.02Å; F143-A146 VanDerWaalsContact O-N 3.13Å; F143-F147 AromaticContact CD1-CE2 3.9Å; F143-F147 HydrophobicContact CD1-CE2 3.9Å; F143-F147 HydrophobicContact CD2-CE2 4.43Å; F143-F147 HydrophobicContact CE1-CD2 4.47Å; F143-F147 AromaticContact CE1-CE2 3.42Å; F143-F147 HydrophobicContact CE1-CE2 3.42Å; F143-F147 VanDerWaalsContact CE1-CE2 3.42Å; F143-F147 HydrophobicContact CE1-CZ 4.03Å; F143-F147 HydrophobicContact CE2-CE2 4Å; F143-F147 HydrophobicContact CG-CE2 4.4Å; F143-F147 AromaticContact CZ-CE2 3.48Å; F143-F147 HydrophobicContact CZ-CE2 3.48Å; F143-F147 VanDerWaalsContact CZ-CE2 3.48Å; F143-F147 AromaticContact CZ-CZ 3.84Å; F143-F147 HydrophobicContact CZ-CZ 3.84Å; F143-F147 VanDerWaalsContact O-CD2 3.29Å; F143-F147 WeakPolarHBondContact O-CD2 3.45Å; F143-I283 HydrophobicContact CD2-CD1 4.17Å; F143-I283 HydrophobicContact CD2-CG1 4.31Å; F143-I283 HydrophobicContact CE2-CD1 4.21Å; F143-I283 HydrophobicContact CE2-CG1 3.83Å |
| 144 | L | 83.5 | Confident | 78.4 | Confident | 102 Ų | 102 | 85.5 Ų | 85.5 | 53% | 0.534 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -64 | -39.4 | 176.9 | -70.8 | 173.3 | 0 | 0 | 0 | 112.1 | L140 C141 A146 F147 | L140-L144 HydrophobicContact CG-CD1 4.17Å; L140-L144 HydrophobicContact CG-CG 4.49Å; L140-L144 WeakPolarHBondContact O-CB 3.31Å; L140-L144 WeakPolarHBondContact O-CG 3.45Å; L140-L144 PolarHBondContact O-N 2.98Å; C141-L144 PolarHBondContact O-N 3.44Å; L144-A146 PolarHBondContact O-N 2.81Å; L144-F147 WeakPolarHBondContact O-CB 3.49Å; L144-F147 PolarHBondContact O-N 3.11Å; L144-F147 VanDerWaalsContact O-N 3.1Å |
| 145 | K | 83.6 | Confident | 80.3 | Confident | 131 Ų | 131 | 76.1 Ų | 76.1 | 57% | 0.57 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -62.3 | -33 | 173.8 | -76 | 169.6 | -171.9 | 169.5 | 0 | 111.7 | C141 D142 F143 F147 A148 P149 | C141-K145 WeakPolarHBondContact O-CB 3.27Å; C141-K145 WeakPolarHBondContact O-CG 3.35Å; C141-K145 PolarHBondContact O-N 3.2Å; D142-K145 PolarHBondContact O-N 3.4Å; D142-K145 IonicContact OD1-NZ 3.94Å; F143-K145 PolarHBondContact O-N 3.28Å; K145-F147 PolarHBondContact O-N 3.01Å; K145-A148 WeakPolarHBondContact O-CB 3.23Å; K145-A148 PolarHBondContact O-N 3.03Å; K145-P149 VanDerWaalsContact O-CD 3.27Å; K145-P149 WeakPolarHBondContact O-CD 3.42Å |
| 146 | A | 82 | Confident | 82.1 | Confident | 29 Ų | 29 | 73 Ų | 73 | 24% | 0.24 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -69.6 | -13.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | D142 F143 L144 P149 I283 | D142-A146 PolarHBondContact O-N 3.36Å; F143-A146 WeakPolarHBondContact O-CB 3.4Å; F143-A146 PolarHBondContact O-N 3.02Å; F143-A146 VanDerWaalsContact O-N 3.13Å; L144-A146 PolarHBondContact O-N 2.81Å; A146-P149 WeakPolarHBondContact O-CD 3.11Å; A146-I283 HydrophobicContact CB-CD1 3.48Å; A146-I283 VanDerWaalsContact CB-CD1 3.48Å |
| 147 | F | 84.7 | Confident | 83.4 | Confident | 35 Ų | 35 | 73.7 Ų | 73.7 | 15% | 0.154 | 37% | 0.372 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.7 | -19.9 | 167.3 | -77.8 | -97.9 | 0 | 0 | 0 | 113.3 | F143 L144 K145 P150 L151 I283 F287 | F143-F147 AromaticContact CD1-CE2 3.9Å; F143-F147 HydrophobicContact CD1-CE2 3.9Å; F143-F147 HydrophobicContact CD2-CE2 4.43Å; F143-F147 HydrophobicContact CE1-CD2 4.47Å; F143-F147 AromaticContact CE1-CE2 3.42Å; F143-F147 HydrophobicContact CE1-CE2 3.42Å; F143-F147 VanDerWaalsContact CE1-CE2 3.42Å; F143-F147 HydrophobicContact CE1-CZ 4.03Å; F143-F147 HydrophobicContact CE2-CE2 4Å; F143-F147 HydrophobicContact CG-CE2 4.4Å; F143-F147 AromaticContact CZ-CE2 3.48Å; F143-F147 HydrophobicContact CZ-CE2 3.48Å; F143-F147 VanDerWaalsContact CZ-CE2 3.48Å; F143-F147 AromaticContact CZ-CZ 3.84Å; F143-F147 HydrophobicContact CZ-CZ 3.84Å; F143-F147 VanDerWaalsContact O-CD2 3.29Å; F143-F147 WeakPolarHBondContact O-CD2 3.45Å; L144-F147 WeakPolarHBondContact O-CB 3.49Å; L144-F147 PolarHBondContact O-N 3.11Å; L144-F147 VanDerWaalsContact O-N 3.1Å; K145-F147 PolarHBondContact O-N 3.01Å; F147-P150 WeakPolarHBondContact O-CD 3.4Å; F147-L151 WeakPolarHBondContact O-CD1 3.24Å; F147-L151 VanDerWaalsContact O-CG 3.25Å; F147-L151 WeakPolarHBondContact O-CG 3.4Å; F147-I283 HydrophobicContact CD1-CG2 3.94Å; F147-I283 HydrophobicContact CD2-CG2 3.94Å; F147-I283 HydrophobicContact CE1-CG2 3.86Å; F147-I283 HydrophobicContact CE2-CG2 3.83Å; F147-I283 HydrophobicContact CG-CG2 3.98Å; F147-I283 HydrophobicContact CZ-CG2 3.81Å; F147-F287 AromaticContact CD1-CD2 3.96Å; F147-F287 HydrophobicContact CD1-CD2 3.96Å; F147-F287 HydrophobicContact CE1-CB 4.3Å; F147-F287 HydrophobicContact CE1-CD2 4.26Å |
| 148 | A | 86.9 | Confident | 84.4 | Confident | 44 Ų | 44 | 68.4 Ų | 68.4 | 36% | 0.364 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -68.8 | -41.7 | -176 | 0 | 0 | 0 | 0 | 0 | 114.2 | K145 L151 K152 | K145-A148 WeakPolarHBondContact O-CB 3.23Å; K145-A148 PolarHBondContact O-N 3.03Å; A148-L151 PolarHBondContact O-N 3.36Å; A148-K152 PolarHBondContact O-N 3.4Å |
| 149 | P | 84.6 | Confident | 85.4 | Confident | 61 Ų | 61 | 63 Ų | 63 | 40% | 0.396 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -61.2 | -44.9 | -178 | -20.3 | 29.7 | 0 | 0 | 0 | 114.9 | K145 A146 L151 K152 V279 | K145-P149 VanDerWaalsContact O-CD 3.27Å; K145-P149 WeakPolarHBondContact O-CD 3.42Å; A146-P149 WeakPolarHBondContact O-CD 3.11Å; P149-L151 VanDerWaalsContact C-N 3.27Å; P149-L151 PolarHBondContact O-N 3.18Å; P149-K152 PolarHBondContact O-N 3.23Å; P149-V279 HydrophobicContact CB-CG2 4.04Å; P149-V279 HydrophobicContact CG-CG2 4.22Å |
| 150 | P | 84.7 | Confident | 86.4 | Confident | 4 Ų | 4 | 60.2 Ų | 60.2 | 3% | 0.026 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -56.9 | -40.6 | 175.1 | -26.6 | 35.8 | 0 | 0 | 0 | 112.7 | F147 K152 L153 F156 T276 V279 T284 | F147-P150 WeakPolarHBondContact O-CD 3.4Å; P150-K152 PolarHBondContact O-N 3.29Å; P150-L153 WeakPolarHBondContact O-CB 3.08Å; P150-L153 PolarHBondContact O-N 2.9Å; P150-L153 VanDerWaalsContact O-N 3.07Å; P150-F156 HydrophobicContact CB-CD1 3.76Å; P150-F156 HydrophobicContact CB-CD2 4.25Å; P150-F156 HydrophobicContact CB-CE1 3.53Å; P150-F156 HydrophobicContact CB-CE2 4.08Å; P150-F156 HydrophobicContact CB-CG 4.12Å; P150-F156 HydrophobicContact CB-CZ 3.71Å; P150-F156 WeakPolarHBondContact O-CB 2.98Å; P150-F156 VanDerWaalsContact O-CD1 3.26Å; P150-F156 WeakPolarHBondContact O-CD1 3.47Å; P150-F156 WeakPolarHBondContact O-CG 3.48Å; P150-T276 HydrophobicContact CB-CG2 3.77Å; P150-T276 HydrophobicContact CG-CG2 3.95Å; P150-V279 HydrophobicContact CG-CB 4.47Å; P150-V279 HydrophobicContact CG-CG1 4.11Å; P150-V279 HydrophobicContact CG-CG2 4.15Å; P150-T284 HydrophobicContact CG-CG2 4.32Å |
| 151 | L | 87.8 | Confident | 87.2 | Confident | 59 Ų | 59 | 59.2 Ų | 59.2 | 31% | 0.309 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -66.2 | -20.1 | -178.4 | -61.8 | 171.9 | 0 | 0 | 0 | 114 | F147 A148 P149 L153 W157 F287 | F147-L151 WeakPolarHBondContact O-CD1 3.24Å; F147-L151 VanDerWaalsContact O-CG 3.25Å; F147-L151 WeakPolarHBondContact O-CG 3.4Å; A148-L151 PolarHBondContact O-N 3.36Å; P149-L151 VanDerWaalsContact C-N 3.27Å; P149-L151 PolarHBondContact O-N 3.18Å; L151-L153 VanDerWaalsContact C-N 3.28Å; L151-W157 HydrophobicContact CB-CZ2 4.42Å; L151-W157 HydrophobicContact CD2-CH2 3.86Å; L151-W157 HydrophobicContact CD2-CZ2 3.48Å; L151-W157 VanDerWaalsContact CD2-CZ2 3.48Å; L151-W157 HydrophobicContact CG-CZ2 4.5Å; L151-W157 PolarHBondContact O-NE1 3.29Å; L151-F287 HydrophobicContact CD2-CE1 4.12Å; L151-F287 HydrophobicContact CD2-CE2 3.58Å; L151-F287 HydrophobicContact CD2-CZ 3.32Å |
| 152 | K | 87.6 | Confident | 87.8 | Confident | 178 Ų | 178 | 57 Ų | 57 | 77% | 0.774 | 28% | 0.279 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.4 | -16.6 | 176.2 | -65.5 | -178.3 | -177.2 | -175.6 | 0 | 112.5 | A148 P149 P150 | A148-K152 PolarHBondContact O-N 3.4Å; P149-K152 PolarHBondContact O-N 3.23Å; P150-K152 PolarHBondContact O-N 3.29Å |
| 153 | L | 88.3 | Confident | 88.5 | Confident | 37 Ų | 37 | 54 Ų | 54 | 19% | 0.194 | 26% | 0.263 | C | S | . | . | trans | -87.2 | 115.8 | -178.8 | -62.4 | 173.7 | 0 | 0 | 0 | 109.7 | P150 L151 G155 F156 W157 A275 T276 | P150-L153 WeakPolarHBondContact O-CB 3.08Å; P150-L153 PolarHBondContact O-N 2.9Å; P150-L153 VanDerWaalsContact O-N 3.07Å; L151-L153 VanDerWaalsContact C-N 3.28Å; L153-G155 VanDerWaalsContact C-N 3.31Å; L153-G155 PolarHBondContact O-N 2.96Å; L153-F156 HydrophobicContact CB-CB 3.74Å; L153-F156 WeakPolarHBondContact O-CB 2.9Å; L153-F156 PolarHBondContact O-N 2.78Å; L153-W157 PolarHBondContact O-N 2.75Å; L153-A275 WeakPolarHBondContact CD1-O 3.46Å; L153-T276 HydrophobicContact CD1-CG2 4.28Å | ||
| 154 | Y | 89.5 | Confident | 89.3 | Confident | 149 Ų | 149 | 49.5 Ų | 49.5 | 58% | 0.584 | 24% | 0.243 | S | C | * | . | H | α-helix | trans | -55.7 | -45.5 | 175.6 | 175.6 | -98.6 | 0 | 0 | 0 | 112.3 | F156 W157 I158 | Y154-F156 PolarHBondContact O-N 2.97Å; Y154-W157 WeakPolarHBondContact O-CB 3.21Å; Y154-W157 PolarHBondContact O-N 3.28Å; Y154-W157 VanDerWaalsContact O-N 3.12Å; Y154-I158 HydrophobicContact CD1-CG1 4.32Å; Y154-I158 HydrophobicContact CE1-CD1 4.19Å; Y154-I158 HydrophobicContact CE1-CG1 3.82Å; Y154-I158 PolarHBondContact O-N 2.91Å |
| 155 | G | 89.8 | Confident | 89.8 | Confident | 6 Ų | 6 | 44.7 Ų | 44.7 | 6% | 0.062 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -61.7 | -28.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | L153 I158 I159 | L153-G155 VanDerWaalsContact C-N 3.31Å; L153-G155 PolarHBondContact O-N 2.96Å; G155-I158 PolarHBondContact O-N 3.37Å; G155-I159 PolarHBondContact O-N 3.44Å |
| 156 | F | 92.1 | Very high | 90.2 | Very high | 0 Ų | 0 | 38.7 Ų | 38.7 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -67.4 | -36.5 | 176.3 | -176.5 | -102.3 | 0 | 0 | 0 | 111.9 | P150 L153 Y154 I159 T160 A272 T276 T284 F287 | P150-F156 HydrophobicContact CB-CD1 3.76Å; P150-F156 HydrophobicContact CB-CD2 4.25Å; P150-F156 HydrophobicContact CB-CE1 3.53Å; P150-F156 HydrophobicContact CB-CE2 4.08Å; P150-F156 HydrophobicContact CB-CG 4.12Å; P150-F156 HydrophobicContact CB-CZ 3.71Å; P150-F156 WeakPolarHBondContact O-CB 2.98Å; P150-F156 VanDerWaalsContact O-CD1 3.26Å; P150-F156 WeakPolarHBondContact O-CD1 3.47Å; P150-F156 WeakPolarHBondContact O-CG 3.48Å; L153-F156 HydrophobicContact CB-CB 3.74Å; L153-F156 WeakPolarHBondContact O-CB 2.9Å; L153-F156 PolarHBondContact O-N 2.78Å; Y154-F156 PolarHBondContact O-N 2.97Å; F156-I159 HydrophobicContact CD2-CD1 3.88Å; F156-I159 HydrophobicContact CD2-CG1 4.3Å; F156-I159 HydrophobicContact CE2-CD1 4.43Å; F156-I159 WeakPolarHBondContact O-CG1 3.04Å; F156-T160 VanDerWaalsContact O-CB 3.29Å; F156-T160 WeakPolarHBondContact O-CB 3.42Å; F156-T160 PolarHBondContact O-N 3.31Å; F156-T160 PolarHBondContact O-OG1 3.11Å; F156-A272 HydrophobicContact CE2-CB 4.27Å; F156-T276 HydrophobicContact CD2-CG2 3.75Å; F156-T276 HydrophobicContact CE2-CG2 3.93Å; F156-T284 HydrophobicContact CE2-CG2 4.18Å; F156-F287 HydrophobicContact CD1-CD1 4.47Å; F156-F287 HydrophobicContact CD1-CE1 4.31Å; F156-F287 AromaticContact CE1-CD1 3.28Å; F156-F287 HydrophobicContact CE1-CD1 3.28Å; F156-F287 AromaticContact CE1-CE1 3.43Å; F156-F287 HydrophobicContact CE1-CE1 3.43Å; F156-F287 VanDerWaalsContact CE1-CE1 3.43Å; F156-F287 HydrophobicContact CE1-CG 4.03Å; F156-F287 HydrophobicContact CE1-CZ 4.33Å; F156-F287 HydrophobicContact CZ-CB 4.23Å; F156-F287 AromaticContact CZ-CD1 3.44Å; F156-F287 HydrophobicContact CZ-CD1 3.44Å; F156-F287 VanDerWaalsContact CZ-CD1 3.44Å; F156-F287 HydrophobicContact CZ-CE1 4.08Å; F156-F287 HydrophobicContact CZ-CG 4.04Å |
| 157 | W | 93.1 | Very high | 90.7 | Very high | 115 Ų | 115 | 38.6 Ų | 38.6 | 44% | 0.436 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -65.2 | -42.2 | 172.7 | -75.6 | 103.4 | 0 | 0 | 0 | 112.2 | L151 L153 Y154 T160 I161 F287 | L151-W157 HydrophobicContact CB-CZ2 4.42Å; L151-W157 HydrophobicContact CD2-CH2 3.86Å; L151-W157 HydrophobicContact CD2-CZ2 3.48Å; L151-W157 VanDerWaalsContact CD2-CZ2 3.48Å; L151-W157 HydrophobicContact CG-CZ2 4.5Å; L151-W157 PolarHBondContact O-NE1 3.29Å; L153-W157 PolarHBondContact O-N 2.75Å; Y154-W157 WeakPolarHBondContact O-CB 3.21Å; Y154-W157 PolarHBondContact O-N 3.28Å; Y154-W157 VanDerWaalsContact O-N 3.12Å; W157-T160 PolarHBondContact O-N 2.8Å; W157-I161 WeakPolarHBondContact O-CG1 3.32Å; W157-I161 PolarHBondContact O-N 3.05Å; W157-F287 HydrophobicContact CH2-CZ 4.34Å; W157-F287 HydrophobicContact CZ3-CZ 4.36Å |
| 158 | I | 93 | Very high | 91.2 | Very high | 15 Ų | 15 | 37 Ų | 37 | 8% | 0.077 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -60.2 | -51.6 | 177.3 | -60 | -57.9 | 0 | 0 | 0 | 110.8 | Y154 G155 T160 I161 T162 V346 Q347 L351 | Y154-I158 HydrophobicContact CD1-CG1 4.32Å; Y154-I158 HydrophobicContact CE1-CD1 4.19Å; Y154-I158 HydrophobicContact CE1-CG1 3.82Å; Y154-I158 PolarHBondContact O-N 2.91Å; G155-I158 PolarHBondContact O-N 3.37Å; I158-T160 VanDerWaalsContact C-N 3.29Å; I158-T160 PolarHBondContact O-N 3.18Å; I158-I161 PolarHBondContact O-N 3.2Å; I158-T162 HydrophobicContact CG2-CG2 4.36Å; I158-T162 WeakPolarHBondContact O-CG2 3.32Å; I158-T162 PolarHBondContact O-N 3.27Å; I158-T162 PolarHBondContact O-OG1 2.83Å; I158-T162 VanDerWaalsContact O-OG1 3.13Å; I158-V346 HydrophobicContact CD1-CG1 4.18Å; I158-Q347 HydrophobicContact CG2-CB 4.45Å; I158-Q347 HydrophobicContact CG2-CG 4.36Å; I158-L351 HydrophobicContact CB-CD1 4.36Å; I158-L351 HydrophobicContact CG2-CB 4.41Å; I158-L351 HydrophobicContact CG2-CD1 4.04Å |
| 159 | I | 93.3 | Very high | 91.5 | Very high | 0 Ų | 0 | 35.1 Ų | 35.1 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -62.8 | -38 | 178 | 66 | 179 | 0 | 0 | 0 | 111.6 | G155 F156 T162 F163 L223 L271 A272 L351 L353 | G155-I159 PolarHBondContact O-N 3.44Å; F156-I159 HydrophobicContact CD2-CD1 3.88Å; F156-I159 HydrophobicContact CD2-CG1 4.3Å; F156-I159 HydrophobicContact CE2-CD1 4.43Å; F156-I159 WeakPolarHBondContact O-CG1 3.04Å; I159-T162 PolarHBondContact O-N 2.8Å; I159-T162 PolarHBondContact O-OG1 2.92Å; I159-F163 WeakPolarHBondContact O-CB 3.39Å; I159-F163 PolarHBondContact O-N 2.98Å; I159-L223 HydrophobicContact CG2-CD2 4.4Å; I159-L271 HydrophobicContact CG2-CD2 4.12Å; I159-A272 HydrophobicContact CD1-CB 3.89Å; I159-L351 HydrophobicContact CG2-CD1 3.27Å; I159-L351 HydrophobicContact CG2-CD2 4.45Å; I159-L351 HydrophobicContact CG2-CG 4.48Å; I159-L353 HydrophobicContact CD1-CD2 4.14Å; I159-L353 HydrophobicContact CG2-CD1 3.8Å |
| 160 | T | 94.3 | Very high | 91.9 | Very high | 4 Ų | 4 | 33.8 Ų | 33.8 | 3% | 0.025 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -62.4 | -49.5 | -179.4 | -62.1 | 0 | 0 | 0 | 0 | 110.1 | F156 W157 I158 S164 F287 L288 S291 | F156-T160 VanDerWaalsContact O-CB 3.29Å; F156-T160 WeakPolarHBondContact O-CB 3.42Å; F156-T160 PolarHBondContact O-N 3.31Å; F156-T160 PolarHBondContact O-OG1 3.11Å; W157-T160 PolarHBondContact O-N 2.8Å; I158-T160 VanDerWaalsContact C-N 3.29Å; I158-T160 PolarHBondContact O-N 3.18Å; T160-S164 WeakPolarHBondContact O-CB 3.29Å; T160-S164 PolarHBondContact O-N 3.29Å; T160-S164 PolarHBondContact O-OG 2.96Å; T160-F287 HydrophobicContact CG2-CD1 3.97Å; T160-F287 HydrophobicContact CG2-CE1 3.62Å; T160-L288 HydrophobicContact CG2-CD2 4.19Å; T160-S291 VanDerWaalsContact CG2-CB 3.43Å; T160-S291 VanDerWaalsContact CG2-OG 3.24Å; T160-S291 WeakPolarHBondContact CG2-OG 3.48Å |
| 161 | I | 94.6 | Very high | 92.3 | Very high | 67 Ų | 67 | 36 Ų | 36 | 34% | 0.344 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -64.5 | -44 | -178.5 | -68.6 | 168.3 | 0 | 0 | 0 | 110.4 | W157 I158 S165 L343 | W157-I161 WeakPolarHBondContact O-CG1 3.32Å; W157-I161 PolarHBondContact O-N 3.05Å; I158-I161 PolarHBondContact O-N 3.2Å; I161-S165 WeakPolarHBondContact O-CB 3.39Å; I161-S165 PolarHBondContact O-N 2.77Å; I161-S165 PolarHBondContact O-OG 3.23Å; I161-L343 HydrophobicContact CG2-CD1 4.2Å; I161-L343 HydrophobicContact CG2-CD2 3.77Å |
| 162 | T | 93.7 | Very high | 92.5 | Very high | 3 Ų | 3 | 33.3 Ų | 33.3 | 2% | 0.018 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -73.9 | -40.7 | -175.5 | 64.5 | 0 | 0 | 0 | 0 | 112.3 | I158 I159 S165 C166 F227 L343 Q347 | I158-T162 HydrophobicContact CG2-CG2 4.36Å; I158-T162 WeakPolarHBondContact O-CG2 3.32Å; I158-T162 PolarHBondContact O-N 3.27Å; I158-T162 PolarHBondContact O-OG1 2.83Å; I158-T162 VanDerWaalsContact O-OG1 3.13Å; I159-T162 PolarHBondContact O-N 2.8Å; I159-T162 PolarHBondContact O-OG1 2.92Å; T162-S165 PolarHBondContact O-N 3.09Å; T162-C166 WeakPolarHBondContact O-CB 3.48Å; T162-C166 PolarHBondContact O-N 3.24Å; T162-F227 HydrophobicContact CG2-CE1 3.92Å; T162-F227 HydrophobicContact CG2-CZ 4.28Å; T162-L343 HydrophobicContact CG2-CB 4.48Å; T162-Q347 HydrophobicContact CG2-CB 3.82Å; T162-Q347 HydrophobicContact CG2-CG 4.18Å; T162-Q347 VanDerWaalsContact CG2-OE1 3.26Å; T162-Q347 PolarHBondContact OG1-OE1 3.43Å |
| 163 | F | 93.2 | Very high | 92.8 | Very high | 1 Ų | 1 | 25.2 Ų | 25.2 | 0% | 0.004 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -58 | -53.3 | 170.4 | 172.9 | -94.5 | 0 | 0 | 0 | 111.5 | I159 S165 C166 I167 F265 C268 L269 L288 I289 | I159-F163 WeakPolarHBondContact O-CB 3.39Å; I159-F163 PolarHBondContact O-N 2.98Å; F163-S165 VanDerWaalsContact C-N 3.27Å; F163-S165 PolarHBondContact O-N 3.27Å; F163-C166 PolarHBondContact O-N 3.13Å; F163-I167 HydrophobicContact CD1-CD1 3.64Å; F163-I167 HydrophobicContact CD2-CD1 3.52Å; F163-I167 HydrophobicContact CE1-CD1 3.26Å; F163-I167 HydrophobicContact CE2-CD1 3.23Å; F163-I167 HydrophobicContact CG-CD1 3.76Å; F163-I167 HydrophobicContact CZ-CD1 3.09Å; F163-I167 PolarHBondContact O-N 2.92Å; F163-F265 AromaticContact CE2-CD2 3.56Å; F163-F265 HydrophobicContact CE2-CD2 3.56Å; F163-F265 HydrophobicContact CE2-CE2 4.12Å; F163-F265 HydrophobicContact CE2-CG 4.32Å; F163-F265 AromaticContact CZ-CD2 3.59Å; F163-F265 HydrophobicContact CZ-CD2 3.59Å; F163-F265 AromaticContact CZ-CE2 3.71Å; F163-F265 HydrophobicContact CZ-CE2 3.71Å; F163-C268 HydrophobicContact CB-CB 4.41Å; F163-C268 VanDerWaalsContact CB-SG 3.58Å; F163-C268 HydrophobicContact CD2-CB 3.38Å; F163-C268 VanDerWaalsContact CD2-SG 3.5Å; F163-C268 HydrophobicContact CE2-CB 3.93Å; F163-C268 HydrophobicContact CG-CB 4.25Å; F163-L269 HydrophobicContact CE2-CD2 4.24Å; F163-L269 HydrophobicContact CZ-CD2 4.05Å; F163-L288 HydrophobicContact CB-CD2 4.47Å; F163-L288 HydrophobicContact CD1-CB 3.81Å; F163-L288 HydrophobicContact CD1-CD2 4.05Å; F163-L288 HydrophobicContact CD1-CG 4.37Å; F163-L288 HydrophobicContact CE1-CB 3.52Å; F163-L288 HydrophobicContact CE1-CG 4.43Å; F163-L288 HydrophobicContact CG-CD2 4.35Å; F163-L288 HydrophobicContact CZ-CB 4.1Å; F163-I289 HydrophobicContact CE1-CD1 4.45Å; F163-I289 HydrophobicContact CZ-CD1 4.32Å |
| 164 | S | 95.2 | Very high | 93 | Very high | 0 Ų | 0 | 25 Ų | 25 | 0% | 0 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -64.7 | -34.4 | -176.6 | -60.5 | 0 | 0 | 0 | 0 | 111.4 | T160 G168 L288 S291 N292 I295 | T160-S164 WeakPolarHBondContact O-CB 3.29Å; T160-S164 PolarHBondContact O-N 3.29Å; T160-S164 PolarHBondContact O-OG 2.96Å; S164-G168 VanDerWaalsContact O-CA 3.29Å; S164-G168 WeakPolarHBondContact O-CA 3.37Å; S164-G168 PolarHBondContact O-N 2.65Å; S164-L288 PolarHBondContact OG-O 2.88Å; S164-S291 WeakPolarHBondContact OG-CB 3.49Å; S164-N292 PolarHBondContact O-OD1 3.13Å; S164-N292 PolarHBondContact OG-N 3.11Å; S164-N292 VanDerWaalsContact OG-N 3.12Å; S164-I295 VanDerWaalsContact CB-CD1 3.42Å |
| 165 | S | 93.7 | Very high | 93.1 | Very high | 1 Ų | 1 | 20.4 Ų | 20.4 | 1% | 0.007 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -73.2 | -37.4 | 176.1 | -57.8 | 0 | 0 | 0 | 0 | 112.4 | I161 T162 F163 Y169 L343 | I161-S165 WeakPolarHBondContact O-CB 3.39Å; I161-S165 PolarHBondContact O-N 2.77Å; I161-S165 PolarHBondContact O-OG 3.23Å; T162-S165 PolarHBondContact O-N 3.09Å; F163-S165 VanDerWaalsContact C-N 3.27Å; F163-S165 PolarHBondContact O-N 3.27Å; S165-Y169 WeakPolarHBondContact O-CB 3.49Å; S165-Y169 PolarHBondContact O-N 3.32Å; S165-L343 VanDerWaalsContact CB-CD1 3.43Å; S165-L343 WeakPolarHBondContact OG-CD1 3.12Å |
| 166 | C | 93.1 | Very high | 93.2 | Very high | 5 Ų | 5 | 20.3 Ų | 20.3 | 3% | 0.034 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -65.8 | -50.9 | 176.8 | -176.8 | 0 | 0 | 0 | 0 | 111.8 | T162 F163 G168 Y169 F170 F227 Q264 M340 | T162-C166 WeakPolarHBondContact O-CB 3.48Å; T162-C166 PolarHBondContact O-N 3.24Å; F163-C166 PolarHBondContact O-N 3.13Å; C166-G168 VanDerWaalsContact C-N 3.29Å; C166-G168 PolarHBondContact O-N 3.13Å; C166-Y169 WeakPolarHBondContact O-CB 3.49Å; C166-Y169 PolarHBondContact O-N 3.46Å; C166-F170 PolarHBondContact O-N 3.45Å; C166-F227 HydrophobicContact CB-CD2 4.28Å; C166-F227 HydrophobicContact CB-CE2 3.95Å; C166-Q264 PolarHBondContact SG-OE1 2.64Å; C166-M340 HydrophobicContact CB-CE 4.25Å |
| 167 | I | 92.3 | Very high | 93.2 | Very high | 27 Ų | 27 | 20.9 Ų | 20.9 | 14% | 0.138 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -71.1 | -33.1 | 179.2 | -60.9 | 156.2 | 0 | 0 | 0 | 110.2 | F163 F170 T171 F265 N292 | F163-I167 HydrophobicContact CD1-CD1 3.64Å; F163-I167 HydrophobicContact CD2-CD1 3.52Å; F163-I167 HydrophobicContact CE1-CD1 3.26Å; F163-I167 HydrophobicContact CE2-CD1 3.23Å; F163-I167 HydrophobicContact CG-CD1 3.76Å; F163-I167 HydrophobicContact CZ-CD1 3.09Å; F163-I167 PolarHBondContact O-N 2.92Å; I167-F170 PolarHBondContact O-N 3.48Å; I167-T171 WeakPolarHBondContact O-CB 3.3Å; I167-T171 PolarHBondContact O-N 3.1Å; I167-T171 PolarHBondContact O-OG1 3.23Å; I167-F265 HydrophobicContact CD1-CD2 3.58Å; I167-F265 HydrophobicContact CD1-CE2 4.26Å; I167-F265 HydrophobicContact CG1-CD2 4.37Å; I167-N292 VanDerWaalsContact C-OD1 3.27Å; I167-N292 VanDerWaalsContact CB-OD1 3.23Å; I167-N292 WeakPolarHBondContact CB-OD1 3.33Å; I167-N292 WeakPolarHBondContact CG2-OD1 3.39Å |
| 168 | G | 93.9 | Very high | 93.1 | Very high | 0 Ų | 0 | 18.9 Ų | 18.9 | 0% | 0 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -59 | -51.7 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | S164 C166 F170 T171 V172 N292 S296 | S164-G168 VanDerWaalsContact O-CA 3.29Å; S164-G168 WeakPolarHBondContact O-CA 3.37Å; S164-G168 PolarHBondContact O-N 2.65Å; C166-G168 VanDerWaalsContact C-N 3.29Å; C166-G168 PolarHBondContact O-N 3.13Å; G168-F170 VanDerWaalsContact C-N 3.35Å; G168-F170 PolarHBondContact O-N 2.99Å; G168-T171 WeakPolarHBondContact O-CB 3.48Å; G168-T171 PolarHBondContact O-N 3.23Å; G168-V172 VanDerWaalsContact O-CG2 3.23Å; G168-V172 WeakPolarHBondContact O-CG2 3.33Å; G168-V172 PolarHBondContact O-N 3.36Å; G168-N292 PolarHBondContact N-OD1 3.31Å; G168-S296 WeakPolarHBondContact CA-OG 3.46Å |
| 169 | Y | 94.2 | Very high | 93 | Very high | 6 Ų | 6 | 22.1 Ų | 22.1 | 2% | 0.024 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -55.3 | -48.5 | 172.9 | 172.6 | -95.7 | 0 | 0 | 0 | 111.7 | S165 C166 T171 V172 L173 S234 L257 H333 L336 | S165-Y169 WeakPolarHBondContact O-CB 3.49Å; S165-Y169 PolarHBondContact O-N 3.32Å; C166-Y169 WeakPolarHBondContact O-CB 3.49Å; C166-Y169 PolarHBondContact O-N 3.46Å; Y169-T171 VanDerWaalsContact C-N 3.3Å; Y169-T171 PolarHBondContact O-N 3.47Å; Y169-V172 PolarHBondContact O-N 3.25Å; Y169-L173 HydrophobicContact CE1-CD2 4.34Å; Y169-L173 VanDerWaalsContact O-CB 3.32Å; Y169-L173 WeakPolarHBondContact O-CB 3.32Å; Y169-L173 PolarHBondContact O-N 2.81Å; Y169-S234 VanDerWaalsContact OH-CB 3.31Å; Y169-S234 WeakPolarHBondContact OH-CB 3.49Å; Y169-L257 HydrophobicContact CD1-CD1 4.3Å; Y169-L257 HydrophobicContact CD1-CD2 4.48Å; Y169-L257 HydrophobicContact CE1-CD1 3.75Å; Y169-L257 HydrophobicContact CE1-CD2 3.66Å; Y169-L257 HydrophobicContact CE1-CG 4.33Å; Y169-H333 AromaticContact CE2-NE2 3.87Å; Y169-H333 AromaticContact CZ-NE2 3.78Å; Y169-H333 PolarHBondContact OH-CE1 3.08Å; Y169-H333 PolarHBondContact OH-NE2 3.3Å; Y169-L336 HydrophobicContact CD2-CD2 3.49Å; Y169-L336 VanDerWaalsContact CD2-CD2 3.49Å; Y169-L336 HydrophobicContact CD2-CG 3.83Å; Y169-L336 HydrophobicContact CE2-CD2 3.98Å; Y169-L336 HydrophobicContact CE2-CG 4.33Å |
| 170 | F | 92.4 | Very high | 92.9 | Very high | 33 Ų | 33 | 22.3 Ų | 22.3 | 15% | 0.145 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -60.8 | -39.3 | 178.2 | -178.2 | -100.5 | 0 | 0 | 0 | 112.7 | C166 I167 G168 S174 T198 I199 F262 | C166-F170 PolarHBondContact O-N 3.45Å; I167-F170 PolarHBondContact O-N 3.48Å; G168-F170 VanDerWaalsContact C-N 3.35Å; G168-F170 PolarHBondContact O-N 2.99Å; F170-S174 WeakPolarHBondContact CE1-OG 3.45Å; F170-S174 WeakPolarHBondContact CZ-OG 3.42Å; F170-S174 VanDerWaalsContact O-CB 3.26Å; F170-S174 WeakPolarHBondContact O-CB 3.47Å; F170-S174 PolarHBondContact O-N 3.43Å; F170-S174 PolarHBondContact O-OG 2.85Å; F170-T198 HydrophobicContact CE2-CG2 3.61Å; F170-T198 HydrophobicContact CZ-CG2 4.33Å; F170-I199 HydrophobicContact CZ-CG1 4.15Å; F170-F262 AromaticContact CE1-CE2 3.81Å; F170-F262 HydrophobicContact CE1-CE2 3.81Å; F170-F262 AromaticContact CE1-CZ 3.84Å; F170-F262 HydrophobicContact CE1-CZ 3.84Å; F170-F262 AromaticContact CE2-CE2 3.98Å; F170-F262 HydrophobicContact CE2-CE2 3.98Å; F170-F262 AromaticContact CZ-CE2 3.46Å; F170-F262 HydrophobicContact CZ-CE2 3.46Å; F170-F262 VanDerWaalsContact CZ-CE2 3.46Å; F170-F262 AromaticContact CZ-CZ 3.88Å; F170-F262 HydrophobicContact CZ-CZ 3.88Å |
| 171 | T | 92.3 | Very high | 92.8 | Very high | 51 Ų | 51 | 22.2 Ų | 22.2 | 31% | 0.313 | 12% | 0.123 | S | C | . | . | H | α-helix | trans | -66.9 | -44 | 178.4 | -58.9 | 0 | 0 | 0 | 0 | 110.8 | I167 G168 Y169 S174 A175 | I167-T171 WeakPolarHBondContact O-CB 3.3Å; I167-T171 PolarHBondContact O-N 3.1Å; I167-T171 PolarHBondContact O-OG1 3.23Å; G168-T171 WeakPolarHBondContact O-CB 3.48Å; G168-T171 PolarHBondContact O-N 3.23Å; Y169-T171 VanDerWaalsContact C-N 3.3Å; Y169-T171 PolarHBondContact O-N 3.47Å; T171-S174 PolarHBondContact O-N 2.99Å; T171-A175 VanDerWaalsContact O-CB 3.29Å; T171-A175 WeakPolarHBondContact O-CB 3.37Å; T171-A175 PolarHBondContact O-N 3.36Å |
| 172 | V | 94 | Very high | 92.6 | Very high | 2 Ų | 2 | 19.5 Ų | 19.5 | 1% | 0.012 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -64 | -47.9 | 176.2 | 174.8 | 0 | 0 | 0 | 0 | 110.5 | G168 Y169 S174 A175 L176 M299 L300 L303 | G168-V172 VanDerWaalsContact O-CG2 3.23Å; G168-V172 WeakPolarHBondContact O-CG2 3.33Å; G168-V172 PolarHBondContact O-N 3.36Å; Y169-V172 PolarHBondContact O-N 3.25Å; V172-S174 VanDerWaalsContact C-N 3.33Å; V172-S174 PolarHBondContact O-N 3.49Å; V172-A175 PolarHBondContact O-N 2.95Å; V172-L176 HydrophobicContact CG1-CD1 3.96Å; V172-L176 WeakPolarHBondContact O-CB 3.43Å; V172-L176 PolarHBondContact O-N 3.34Å; V172-M299 HydrophobicContact CG2-CB 3.72Å; V172-L300 HydrophobicContact CG2-CB 3.96Å; V172-L303 HydrophobicContact CG1-CB 4.42Å; V172-L303 HydrophobicContact CG1-CD2 3.77Å |
| 173 | L | 93.3 | Very high | 92.3 | Very high | 8 Ų | 8 | 20.1 Ų | 20.1 | 4% | 0.042 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -59 | -46.8 | 177.1 | -170.5 | 78.6 | 0 | 0 | 0 | 110.2 | Y169 A175 L176 L177 I180 L237 L254 L257 | Y169-L173 HydrophobicContact CE1-CD2 4.34Å; Y169-L173 VanDerWaalsContact O-CB 3.32Å; Y169-L173 WeakPolarHBondContact O-CB 3.32Å; Y169-L173 PolarHBondContact O-N 2.81Å; L173-A175 VanDerWaalsContact C-N 3.34Å; L173-A175 PolarHBondContact O-N 2.95Å; L173-L176 CarbonylContact O-C 3.58Å; L173-L176 PolarHBondContact O-N 3.49Å; L173-L177 VanDerWaalsContact O-CA 3.27Å; L173-L177 WeakPolarHBondContact O-CA 3.41Å; L173-L177 WeakPolarHBondContact O-CB 3.48Å; L173-L177 PolarHBondContact O-N 3.18Å; L173-I180 HydrophobicContact CD1-CD1 4.08Å; L173-L237 HydrophobicContact CD1-CD2 3.94Å; L173-L237 HydrophobicContact CD2-CD2 4.15Å; L173-L254 HydrophobicContact CD2-CD2 3.63Å; L173-L257 HydrophobicContact CD2-CD2 3.36Å |
| 174 | S | 91.1 | Very high | 92 | Very high | 31 Ų | 31 | 21.8 Ų | 21.8 | 22% | 0.217 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -62.3 | -39.9 | 177.9 | -63.4 | 0 | 0 | 0 | 0 | 112.5 | F170 T171 V172 | F170-S174 WeakPolarHBondContact CE1-OG 3.45Å; F170-S174 WeakPolarHBondContact CZ-OG 3.42Å; F170-S174 VanDerWaalsContact O-CB 3.26Å; F170-S174 WeakPolarHBondContact O-CB 3.47Å; F170-S174 PolarHBondContact O-N 3.43Å; F170-S174 PolarHBondContact O-OG 2.85Å; T171-S174 PolarHBondContact O-N 2.99Å; V172-S174 VanDerWaalsContact C-N 3.33Å; V172-S174 PolarHBondContact O-N 3.49Å |
| 175 | A | 91.7 | Very high | 91.6 | Very high | 54 Ų | 54 | 23.1 Ų | 23.1 | 45% | 0.446 | 14% | 0.135 | S | C | . | . | H | α-helix | trans | -70.1 | -35 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | T171 V172 L173 Q179 L300 | T171-A175 VanDerWaalsContact O-CB 3.29Å; T171-A175 WeakPolarHBondContact O-CB 3.37Å; T171-A175 PolarHBondContact O-N 3.36Å; V172-A175 PolarHBondContact O-N 2.95Å; L173-A175 VanDerWaalsContact C-N 3.34Å; L173-A175 PolarHBondContact O-N 2.95Å; A175-Q179 PolarHBondContact O-OE1 3.14Å; A175-L300 HydrophobicContact CB-CD1 4.04Å |
| 176 | L | 92.3 | Very high | 91.5 | Very high | 4 Ų | 4 | 23.5 Ų | 23.5 | 2% | 0.021 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -106.2 | 1.1 | -173.1 | -60.3 | 177 | 0 | 0 | 0 | 114.4 | V172 L173 Q178 Q179 I180 L300 L303 Q304 F329 | V172-L176 HydrophobicContact CG1-CD1 3.96Å; V172-L176 WeakPolarHBondContact O-CB 3.43Å; V172-L176 PolarHBondContact O-N 3.34Å; L173-L176 CarbonylContact O-C 3.58Å; L173-L176 PolarHBondContact O-N 3.49Å; L176-Q178 VanDerWaalsContact C-N 3.27Å; L176-Q178 PolarHBondContact O-N 3.38Å; L176-Q179 VanDerWaalsContact CA-OE1 3.25Å; L176-Q179 VanDerWaalsContact CD2-OE1 3.28Å; L176-Q179 PolarHBondContact O-N 3.44Å; L176-I180 HydrophobicContact CB-CD1 4.03Å; L176-I180 HydrophobicContact CB-CG1 4.28Å; L176-I180 VanDerWaalsContact O-CG1 3.29Å; L176-I180 WeakPolarHBondContact O-CG1 3.44Å; L176-I180 PolarHBondContact O-N 2.88Å; L176-L300 HydrophobicContact CD1-CG 4.48Å; L176-L303 HydrophobicContact CD1-CB 4.49Å; L176-L303 HydrophobicContact CD1-CD2 3.69Å; L176-Q304 HydrophobicContact CD1-CG 4.11Å; L176-Q304 HydrophobicContact CD2-CG 4.41Å; L176-F329 HydrophobicContact CD1-CE1 4.15Å |
| 177 | L | 93.1 | Very high | 91.4 | Very high | 11 Ų | 11 | 25.6 Ų | 25.6 | 6% | 0.058 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -55.6 | -43.1 | -172 | -171.2 | 58.5 | 0 | 0 | 0 | 112.3 | L173 I180 L181 A191 C194 L254 | L173-L177 VanDerWaalsContact O-CA 3.27Å; L173-L177 WeakPolarHBondContact O-CA 3.41Å; L173-L177 WeakPolarHBondContact O-CB 3.48Å; L173-L177 PolarHBondContact O-N 3.18Å; L177-I180 PolarHBondContact O-N 2.93Å; L177-L181 HydrophobicContact CD1-CD1 3.81Å; L177-L181 HydrophobicContact CD1-CG 4.18Å; L177-L181 HydrophobicContact CG-CD1 3.93Å; L177-L181 WeakPolarHBondContact O-CB 3.5Å; L177-L181 VanDerWaalsContact O-CG 3.32Å; L177-L181 WeakPolarHBondContact O-CG 3.32Å; L177-L181 PolarHBondContact O-N 3.38Å; L177-A191 VanDerWaalsContact CD2-O 3.31Å; L177-A191 WeakPolarHBondContact CD2-O 3.37Å; L177-C194 HydrophobicContact CD2-CB 4.15Å; L177-L254 HydrophobicContact CD1-CD1 4.19Å |
| 178 | Q | 91.1 | Very high | 91.3 | Very high | 74 Ų | 74 | 27 Ų | 27 | 35% | 0.346 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -65.3 | -42.6 | 178.2 | -66.9 | 174.4 | 20.1 | 0 | 0 | 111.5 | L176 L181 C182 A191 | L176-Q178 VanDerWaalsContact C-N 3.27Å; L176-Q178 PolarHBondContact O-N 3.38Å; Q178-L181 PolarHBondContact O-N 3.5Å; Q178-C182 WeakPolarHBondContact O-CB 3.13Å; Q178-C182 PolarHBondContact O-N 3.15Å; Q178-C182 PolarHBondContact O-SG 2.92Å; Q178-A191 HydrophobicContact CB-CB 4.37Å; Q178-A191 HydrophobicContact CG-CB 3.84Å |
| 179 | Q | 90.3 | Very high | 91.1 | Very high | 83 Ų | 83 | 30.5 Ų | 30.5 | 39% | 0.388 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -67.5 | -39.8 | 176.6 | -69.3 | 119 | -32.4 | 0 | 0 | 112.2 | A175 L176 L181 C182 T183 F329 | A175-Q179 PolarHBondContact O-OE1 3.14Å; L176-Q179 VanDerWaalsContact CA-OE1 3.25Å; L176-Q179 VanDerWaalsContact CD2-OE1 3.28Å; L176-Q179 PolarHBondContact O-N 3.44Å; Q179-L181 VanDerWaalsContact C-N 3.33Å; Q179-L181 PolarHBondContact O-N 3.19Å; Q179-C182 PolarHBondContact O-SG 3.17Å; Q179-C182 VanDerWaalsContact O-SG 3.41Å; Q179-T183 WeakPolarHBondContact O-CG2 3.44Å; Q179-F329 HydrophobicContact CB-CE2 3.84Å; Q179-F329 HydrophobicContact CB-CZ 4.4Å |
| 180 | I | 91.8 | Very high | 91.1 | Very high | 4 Ų | 4 | 31.4 Ų | 31.4 | 2% | 0.021 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -62.9 | -41.5 | 177.4 | -66.2 | 165.7 | 0 | 0 | 0 | 110.7 | L173 L176 L177 T183 L241 F329 | L173-I180 HydrophobicContact CD1-CD1 4.08Å; L176-I180 HydrophobicContact CB-CD1 4.03Å; L176-I180 HydrophobicContact CB-CG1 4.28Å; L176-I180 VanDerWaalsContact O-CG1 3.29Å; L176-I180 WeakPolarHBondContact O-CG1 3.44Å; L176-I180 PolarHBondContact O-N 2.88Å; L177-I180 PolarHBondContact O-N 2.93Å; I180-T183 PolarHBondContact O-OG1 2.85Å; I180-L241 HydrophobicContact CG2-CD1 3.8Å; I180-L241 HydrophobicContact CG2-CD2 3.99Å; I180-F329 HydrophobicContact CG1-CB 3.75Å; I180-F329 HydrophobicContact CG1-CD2 4.11Å; I180-F329 HydrophobicContact CG1-CG 3.9Å |
| 181 | L | 91.8 | Very high | 91.2 | Very high | 1 Ų | 1 | 30 Ų | 30 | 1% | 0.005 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -84.9 | -30.4 | -175.9 | -68.2 | 178.3 | 0 | 0 | 0 | 113.1 | L177 Q178 Q179 T183 K184 G185 Y186 F190 A191 C194 L241 I250 | L177-L181 HydrophobicContact CD1-CD1 3.81Å; L177-L181 HydrophobicContact CD1-CG 4.18Å; L177-L181 HydrophobicContact CG-CD1 3.93Å; L177-L181 WeakPolarHBondContact O-CB 3.5Å; L177-L181 VanDerWaalsContact O-CG 3.32Å; L177-L181 WeakPolarHBondContact O-CG 3.32Å; L177-L181 PolarHBondContact O-N 3.38Å; Q178-L181 PolarHBondContact O-N 3.5Å; Q179-L181 VanDerWaalsContact C-N 3.33Å; Q179-L181 PolarHBondContact O-N 3.19Å; L181-T183 VanDerWaalsContact C-N 3.3Å; L181-T183 PolarHBondContact O-N 3.29Å; L181-K184 PolarHBondContact O-N 2.98Å; L181-K184 VanDerWaalsContact O-N 3.15Å; L181-G185 PolarHBondContact O-N 3.22Å; L181-Y186 HydrophobicContact CB-CD2 4.12Å; L181-Y186 HydrophobicContact CD2-CD2 3.77Å; L181-Y186 HydrophobicContact CD2-CE2 4.21Å; L181-Y186 WeakPolarHBondContact O-CB 3.28Å; L181-Y186 WeakPolarHBondContact O-CD2 3.43Å; L181-Y186 PolarHBondContact O-N 3.44Å; L181-Y186 VanDerWaalsContact O-N 3.08Å; L181-F190 HydrophobicContact CD1-CD1 4.27Å; L181-F190 HydrophobicContact CD1-CE1 4.33Å; L181-A191 HydrophobicContact CB-CB 4.23Å; L181-A191 HydrophobicContact CD1-CB 3.71Å; L181-C194 HydrophobicContact CD1-CB 4.49Å; L181-L241 HydrophobicContact CD2-CD2 4.05Å; L181-I250 HydrophobicContact CD2-CD1 4.08Å; L181-I250 HydrophobicContact CD2-CG2 4.08Å |
| 182 | C | 89.3 | Confident | 91.2 | Very high | 10 Ų | 10 | 27.7 Ų | 27.7 | 7% | 0.068 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -67.8 | -31.8 | 179.5 | 78.3 | 0 | 0 | 0 | 0 | 112.6 | Q178 Q179 K184 G185 T319 C320 | Q178-C182 WeakPolarHBondContact O-CB 3.13Å; Q178-C182 PolarHBondContact O-N 3.15Å; Q178-C182 PolarHBondContact O-SG 2.92Å; Q179-C182 PolarHBondContact O-SG 3.17Å; Q179-C182 VanDerWaalsContact O-SG 3.41Å; C182-K184 PolarHBondContact O-N 3.44Å; C182-G185 PolarHBondContact O-N 3.38Å; C182-G185 VanDerWaalsContact O-N 3.08Å; C182-T319 WeakPolarHBondContact CA-OG1 3.32Å; C182-T319 PolarHBondContact O-N 3.38Å; C182-T319 VanDerWaalsContact O-N 3.14Å; C182-T319 PolarHBondContact O-OG1 3.08Å; C182-C320 HydrophobicContact CB-CB 3.98Å; C182-C320 WeakPolarHBondContact CB-SG 3.49Å; C182-C320 VanDerWaalsContact SG-CA 3.55Å; C182-C320 WeakPolarHBondContact SG-CB 3.46Å; C182-C320 CovalentContact SG-SG 2.05Å; C182-C320 PolarHBondContact SG-SG 3.43Å |
| 183 | T | 87.5 | Confident | 91.3 | Very high | 16 Ų | 16 | 32.7 Ų | 32.7 | 10% | 0.098 | 18% | 0.181 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -67.4 | -22 | 176.1 | 61.4 | 0 | 0 | 0 | 0 | 112 | Q179 I180 L181 C320 I326 R327 | Q179-T183 WeakPolarHBondContact O-CG2 3.44Å; I180-T183 PolarHBondContact O-OG1 2.85Å; L181-T183 VanDerWaalsContact C-N 3.3Å; L181-T183 PolarHBondContact O-N 3.29Å; T183-C320 PolarHBondContact N-SG 2.84Å; T183-C320 VanDerWaalsContact N-SG 3.36Å; T183-I326 HydrophobicContact CG2-CG2 3.57Å; T183-R327 WeakPolarHBondContact CG2-O 3.29Å |
| 184 | K | 87.3 | Confident | 91.4 | Very high | 37 Ų | 37 | 32.3 Ų | 32.3 | 16% | 0.161 | 18% | 0.18 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -94.6 | 7.9 | 175.2 | -53.4 | -54.4 | 179.6 | -172 | 0 | 113.2 | L181 C182 Y186 L241 D328 S330 | L181-K184 PolarHBondContact O-N 2.98Å; L181-K184 VanDerWaalsContact O-N 3.15Å; C182-K184 PolarHBondContact O-N 3.44Å; K184-Y186 HydrophobicContact CB-CD2 3.8Å; K184-Y186 HydrophobicContact CB-CE2 3.74Å; K184-L241 VanDerWaalsContact CE-O 3.29Å; K184-L241 WeakPolarHBondContact CE-O 3.37Å; K184-D328 VanDerWaalsContact NZ-CG 3.3Å; K184-D328 IonicContact NZ-OD1 2.82Å; K184-D328 PolarHBondContact NZ-OD1 3.1Å; K184-D328 IonicContact NZ-OD2 3.48Å; K184-D328 PolarHBondContact NZ-OD2 2.87Å; K184-S330 WeakPolarHBondContact CE-OG 3.4Å; K184-S330 PolarHBondContact NZ-OG 2.96Å |
| 185 | G | 87.1 | Confident | 91.6 | Very high | 28 Ų | 28 | 31 Ų | 31 | 29% | 0.289 | 17% | 0.171 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 82.4 | 11.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | L181 C182 T319 | L181-G185 PolarHBondContact O-N 3.22Å; C182-G185 PolarHBondContact O-N 3.38Å; C182-G185 VanDerWaalsContact O-N 3.08Å; G185-T319 WeakPolarHBondContact O-CG2 3.39Å |
| 186 | Y | 91.1 | Very high | 91.7 | Very high | 9 Ų | 9 | 29 Ų | 29 | 4% | 0.035 | 15% | 0.154 | C | C | . | . | trans | -84.1 | 146.5 | 177.3 | -63.1 | -63.6 | 0 | 0 | 0 | 112.4 | L181 K184 F190 Q246 Q247 I250 T319 | L181-Y186 HydrophobicContact CB-CD2 4.12Å; L181-Y186 HydrophobicContact CD2-CD2 3.77Å; L181-Y186 HydrophobicContact CD2-CE2 4.21Å; L181-Y186 WeakPolarHBondContact O-CB 3.28Å; L181-Y186 WeakPolarHBondContact O-CD2 3.43Å; L181-Y186 PolarHBondContact O-N 3.44Å; L181-Y186 VanDerWaalsContact O-N 3.08Å; K184-Y186 HydrophobicContact CB-CD2 3.8Å; K184-Y186 HydrophobicContact CB-CE2 3.74Å; Y186-F190 AromaticContact CD1-CD1 3.97Å; Y186-F190 HydrophobicContact CD1-CD1 3.97Å; Y186-F190 HydrophobicContact CD1-CE1 4.06Å; Y186-F190 HydrophobicContact CE1-CE1 4.48Å; Y186-F190 AromaticContact CG-CD1 3.9Å; Y186-F190 HydrophobicContact CG-CD1 3.9Å; Y186-F190 HydrophobicContact CG-CE1 4.12Å; Y186-Q246 PolarHBondContact OH-N 3.25Å; Y186-Q247 HydrophobicContact CD1-CG 3.84Å; Y186-Q247 HydrophobicContact CE1-CB 4.48Å; Y186-Q247 HydrophobicContact CE1-CG 3.34Å; Y186-I250 HydrophobicContact CD2-CD1 4.23Å; Y186-I250 HydrophobicContact CE2-CD1 3.33Å; Y186-I250 WeakPolarHBondContact OH-CD1 3.16Å; Y186-T319 PolarHBondContact O-OG1 3.38Å | ||
| 187 | S | 90.9 | Very high | 91.9 | Very high | 49 Ų | 49 | 31 Ų | 31 | 34% | 0.343 | 16% | 0.164 | S | C | . | . | trans | -71.5 | 154.8 | 179.7 | 72.9 | 0 | 0 | 0 | 0 | 112.5 | Q189 F190 A191 | S187-Q189 VanDerWaalsContact CB-OE1 3.28Å; S187-Q189 PolarHBondContact O-N 3.13Å; S187-Q189 PolarHBondContact OG-OE1 3.46Å; S187-F190 PolarHBondContact O-N 3.46Å; S187-F190 VanDerWaalsContact O-N 3.14Å; S187-F190 PolarHBondContact OG-N 2.81Å; S187-A191 PolarHBondContact O-N 3.43Å; S187-A191 VanDerWaalsContact O-N 3.07Å | ||
| 188 | N | 90 | Very high | 92 | Very high | 55 Ų | 55 | 30.7 Ų | 30.7 | 29% | 0.294 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -60.5 | -32.3 | 173.9 | -69.5 | -23.5 | 0 | 0 | 0 | 111.8 | P75 A191 G192 | P75-N188 HydrophobicContact CB-CB 4.25Å; P75-N188 WeakPolarHBondContact CB-O 3.14Å; N188-A191 PolarHBondContact O-N 3.45Å; N188-G192 PolarHBondContact O-N 2.83Å |
| 189 | Q | 91.6 | Very high | 92.1 | Very high | 75 Ų | 75 | 27.2 Ų | 27.2 | 35% | 0.35 | 15% | 0.146 | S | C | . | . | H | α-helix | trans | -65.3 | -41.1 | 176 | -61 | 83.7 | 7.1 | 0 | 0 | 111.6 | N76 S187 G192 F193 | N76-Q189 WeakPolarHBondContact OD1-CG 3.19Å; S187-Q189 VanDerWaalsContact CB-OE1 3.28Å; S187-Q189 PolarHBondContact O-N 3.13Å; S187-Q189 PolarHBondContact OG-OE1 3.46Å; Q189-G192 PolarHBondContact O-N 3.31Å; Q189-F193 WeakPolarHBondContact O-CB 3.49Å; Q189-F193 PolarHBondContact O-N 3.35Å |
| 190 | F | 94 | Very high | 92.4 | Very high | 25 Ų | 25 | 26.4 Ų | 26.4 | 11% | 0.11 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -63.9 | -44.8 | 175 | 178.3 | -104.4 | 0 | 0 | 0 | 111.1 | L181 Y186 S187 G192 F193 C194 Q247 I250 | L181-F190 HydrophobicContact CD1-CD1 4.27Å; L181-F190 HydrophobicContact CD1-CE1 4.33Å; Y186-F190 AromaticContact CD1-CD1 3.97Å; Y186-F190 HydrophobicContact CD1-CD1 3.97Å; Y186-F190 HydrophobicContact CD1-CE1 4.06Å; Y186-F190 HydrophobicContact CE1-CE1 4.48Å; Y186-F190 AromaticContact CG-CD1 3.9Å; Y186-F190 HydrophobicContact CG-CD1 3.9Å; Y186-F190 HydrophobicContact CG-CE1 4.12Å; S187-F190 PolarHBondContact O-N 3.46Å; S187-F190 VanDerWaalsContact O-N 3.14Å; S187-F190 PolarHBondContact OG-N 2.81Å; F190-G192 VanDerWaalsContact C-N 3.33Å; F190-G192 PolarHBondContact O-N 2.82Å; F190-F193 WeakPolarHBondContact O-CB 3.34Å; F190-F193 PolarHBondContact O-N 3.16Å; F190-C194 VanDerWaalsContact CE1-SG 3.59Å; F190-C194 WeakPolarHBondContact CZ-SG 3.42Å; F190-C194 WeakPolarHBondContact O-CB 3.29Å; F190-C194 PolarHBondContact O-N 3.5Å; F190-C194 PolarHBondContact O-SG 3.42Å; F190-C194 VanDerWaalsContact O-SG 3.37Å; F190-Q247 HydrophobicContact CE1-CG 4.43Å; F190-Q247 HydrophobicContact CE2-CB 3.87Å; F190-Q247 HydrophobicContact CE2-CG 4.19Å; F190-Q247 HydrophobicContact CZ-CB 3.77Å; F190-Q247 HydrophobicContact CZ-CG 4.06Å; F190-Q247 WeakPolarHBondContact CZ-O 3.43Å; F190-I250 HydrophobicContact CE1-CG2 4.34Å |
| 191 | A | 93.2 | Very high | 92.5 | Very high | 2 Ų | 2 | 27 Ų | 27 | 2% | 0.017 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -60.1 | -41.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | L177 Q178 L181 S187 N188 C194 G195 | L177-A191 VanDerWaalsContact CD2-O 3.31Å; L177-A191 WeakPolarHBondContact CD2-O 3.37Å; Q178-A191 HydrophobicContact CB-CB 4.37Å; Q178-A191 HydrophobicContact CG-CB 3.84Å; L181-A191 HydrophobicContact CB-CB 4.23Å; L181-A191 HydrophobicContact CD1-CB 3.71Å; S187-A191 PolarHBondContact O-N 3.43Å; S187-A191 VanDerWaalsContact O-N 3.07Å; N188-A191 PolarHBondContact O-N 3.45Å; A191-C194 WeakPolarHBondContact O-CB 3.4Å; A191-C194 PolarHBondContact O-N 3.34Å; A191-G195 PolarHBondContact O-N 3.5Å |
| 192 | G | 93.7 | Very high | 92.6 | Very high | 3 Ų | 3 | 27 Ų | 27 | 3% | 0.031 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -62 | -44.8 | 173.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | N71 N188 Q189 F190 G195 S196 | N71-G192 CarbonylContact O-C 3.53Å; N71-G192 WeakPolarHBondContact O-CA 3.45Å; N188-G192 PolarHBondContact O-N 2.83Å; Q189-G192 PolarHBondContact O-N 3.31Å; F190-G192 VanDerWaalsContact C-N 3.33Å; F190-G192 PolarHBondContact O-N 2.82Å; G192-G195 PolarHBondContact O-N 2.99Å; G192-S196 WeakPolarHBondContact O-CB 3.22Å; G192-S196 PolarHBondContact O-N 3.35Å; G192-S196 PolarHBondContact O-OG 3.38Å |
| 193 | F | 95 | Very high | 92.7 | Very high | 108 Ų | 108 | 28.9 Ų | 28.9 | 47% | 0.474 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -58.9 | -48.4 | 174.2 | 172.6 | -100.4 | 0 | 0 | 0 | 111.4 | Q189 F190 G195 S196 I197 T251 | Q189-F193 WeakPolarHBondContact O-CB 3.49Å; Q189-F193 PolarHBondContact O-N 3.35Å; F190-F193 WeakPolarHBondContact O-CB 3.34Å; F190-F193 PolarHBondContact O-N 3.16Å; F193-G195 PolarHBondContact O-N 2.9Å; F193-S196 WeakPolarHBondContact O-CB 3.13Å; F193-S196 PolarHBondContact O-N 3.48Å; F193-I197 HydrophobicContact CE1-CD1 4.23Å; F193-I197 HydrophobicContact CE1-CG2 4.45Å; F193-I197 HydrophobicContact CE2-CD1 4.21Å; F193-I197 HydrophobicContact CZ-CD1 3.63Å; F193-I197 WeakPolarHBondContact O-CG2 3.39Å; F193-I197 PolarHBondContact O-N 3.46Å; F193-T251 HydrophobicContact CE1-CG2 4.03Å |
| 194 | C | 95.7 | Very high | 93 | Very high | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -57.3 | -48.4 | 175.8 | -79 | 0 | 0 | 0 | 0 | 112.3 | L177 L181 F190 A191 S196 I197 T198 L254 | L177-C194 HydrophobicContact CD2-CB 4.15Å; L181-C194 HydrophobicContact CD1-CB 4.49Å; F190-C194 VanDerWaalsContact CE1-SG 3.59Å; F190-C194 WeakPolarHBondContact CZ-SG 3.42Å; F190-C194 WeakPolarHBondContact O-CB 3.29Å; F190-C194 PolarHBondContact O-N 3.5Å; F190-C194 PolarHBondContact O-SG 3.42Å; F190-C194 VanDerWaalsContact O-SG 3.37Å; A191-C194 WeakPolarHBondContact O-CB 3.4Å; A191-C194 PolarHBondContact O-N 3.34Å; C194-S196 VanDerWaalsContact C-N 3.27Å; C194-S196 PolarHBondContact O-N 3.24Å; C194-I197 WeakPolarHBondContact O-CG2 3.24Å; C194-T198 WeakPolarHBondContact O-CB 3.04Å; C194-T198 PolarHBondContact O-N 2.79Å; C194-T198 VanDerWaalsContact O-N 3.13Å; C194-T198 PolarHBondContact O-OG1 2.88Å; C194-L254 HydrophobicContact CB-CD1 3.52Å |
| 195 | G | 94.6 | Very high | 93.3 | Very high | 3 Ų | 3 | 32.2 Ų | 32.2 | 3% | 0.031 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -62.9 | -35.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | A191 G192 F193 I199 | A191-G195 PolarHBondContact O-N 3.5Å; G192-G195 PolarHBondContact O-N 2.99Å; F193-G195 PolarHBondContact O-N 2.9Å; G195-I199 WeakPolarHBondContact O-CG1 3.35Å |
| 196 | S | 95.1 | Very high | 93.4 | Very high | 13 Ų | 13 | 31.9 Ų | 31.9 | 9% | 0.091 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -71.1 | -51.1 | 179.2 | -58.3 | 0 | 0 | 0 | 0 | 112.2 | L68 N71 A72 G192 F193 C194 T198 I199 V200 | L68-S196 VanDerWaalsContact CD1-O 3.22Å; L68-S196 WeakPolarHBondContact CD1-O 3.21Å; N71-S196 WeakPolarHBondContact CB-OG 3.34Å; A72-S196 WeakPolarHBondContact CA-OG 3.26Å; A72-S196 WeakPolarHBondContact CB-OG 3.17Å; A72-S196 PolarHBondContact N-OG 2.99Å; A72-S196 VanDerWaalsContact N-OG 3.14Å; G192-S196 WeakPolarHBondContact O-CB 3.22Å; G192-S196 PolarHBondContact O-N 3.35Å; G192-S196 PolarHBondContact O-OG 3.38Å; F193-S196 WeakPolarHBondContact O-CB 3.13Å; F193-S196 PolarHBondContact O-N 3.48Å; C194-S196 VanDerWaalsContact C-N 3.27Å; C194-S196 PolarHBondContact O-N 3.24Å; S196-T198 PolarHBondContact O-N 2.98Å; S196-I199 PolarHBondContact O-N 3.38Å; S196-I199 VanDerWaalsContact O-N 3.1Å; S196-V200 PolarHBondContact O-N 2.88Å; S196-V200 VanDerWaalsContact O-N 3.08Å |
| 197 | I | 95.7 | Very high | 93.3 | Very high | 46 Ų | 46 | 33.2 Ų | 33.2 | 24% | 0.236 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -65.6 | -30.1 | -177.3 | -159.7 | 158.4 | 0 | 0 | 0 | 111.9 | F193 C194 I199 V200 A201 T251 I255 | F193-I197 HydrophobicContact CE1-CD1 4.23Å; F193-I197 HydrophobicContact CE1-CG2 4.45Å; F193-I197 HydrophobicContact CE2-CD1 4.21Å; F193-I197 HydrophobicContact CZ-CD1 3.63Å; F193-I197 WeakPolarHBondContact O-CG2 3.39Å; F193-I197 PolarHBondContact O-N 3.46Å; C194-I197 WeakPolarHBondContact O-CG2 3.24Å; I197-I199 VanDerWaalsContact C-N 3.34Å; I197-I199 PolarHBondContact O-N 3.35Å; I197-V200 PolarHBondContact O-N 3.35Å; I197-A201 VanDerWaalsContact O-CB 3.28Å; I197-A201 WeakPolarHBondContact O-CB 3.33Å; I197-A201 PolarHBondContact O-N 2.89Å; I197-T251 HydrophobicContact CG2-CG2 4.17Å; I197-I255 HydrophobicContact CD1-CD1 3.95Å; I197-I255 HydrophobicContact CD1-CG1 4.46Å; I197-I255 HydrophobicContact CG1-CD1 4.06Å; I197-I255 HydrophobicContact CG1-CG1 4.04Å; I197-I255 HydrophobicContact CG2-CD1 4.44Å; I197-I255 HydrophobicContact CG2-CG1 4Å |
| 198 | T | 95.3 | Very high | 93.3 | Very high | 4 Ų | 4 | 34.9 Ų | 34.9 | 3% | 0.025 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -59.1 | -45.1 | 172.7 | -57.4 | 0 | 0 | 0 | 0 | 111.9 | F170 C194 S196 G202 L254 | F170-T198 HydrophobicContact CE2-CG2 3.61Å; F170-T198 HydrophobicContact CZ-CG2 4.33Å; C194-T198 WeakPolarHBondContact O-CB 3.04Å; C194-T198 PolarHBondContact O-N 2.79Å; C194-T198 VanDerWaalsContact O-N 3.13Å; C194-T198 PolarHBondContact O-OG1 2.88Å; S196-T198 PolarHBondContact O-N 2.98Å; T198-G202 PolarHBondContact O-N 3.47Å; T198-L254 WeakPolarHBondContact CG2-O 3.34Å; T198-L254 WeakPolarHBondContact OG1-CB 3.43Å |
| 199 | I | 93.8 | Very high | 93.4 | Very high | 1 Ų | 1 | 33.7 Ų | 33.7 | 1% | 0.005 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -69 | -44.2 | 179.4 | -62.8 | 164.7 | 0 | 0 | 0 | 109.9 | I67 L68 F170 G195 S196 I197 A201 G202 L203 F262 | I67-I199 HydrophobicContact CB-CD1 4.03Å; I67-I199 HydrophobicContact CG2-CD1 3.54Å; L68-I199 HydrophobicContact CB-CB 4.44Å; L68-I199 HydrophobicContact CB-CD1 4.28Å; L68-I199 HydrophobicContact CB-CG2 4.08Å; L68-I199 HydrophobicContact CD1-CB 4.43Å; F170-I199 HydrophobicContact CZ-CG1 4.15Å; G195-I199 WeakPolarHBondContact O-CG1 3.35Å; S196-I199 PolarHBondContact O-N 3.38Å; S196-I199 VanDerWaalsContact O-N 3.1Å; I197-I199 VanDerWaalsContact C-N 3.34Å; I197-I199 PolarHBondContact O-N 3.35Å; I199-A201 VanDerWaalsContact C-N 3.34Å; I199-A201 PolarHBondContact O-N 3.26Å; I199-G202 PolarHBondContact O-N 2.95Å; I199-L203 HydrophobicContact CG2-CD1 4.3Å; I199-L203 HydrophobicContact CG2-CG 4.34Å; I199-L203 WeakPolarHBondContact O-CG 3.08Å; I199-L203 PolarHBondContact O-N 2.88Å; I199-F262 HydrophobicContact CB-CE2 4.5Å; I199-F262 HydrophobicContact CB-CZ 4.38Å; I199-F262 HydrophobicContact CG1-CE2 4.25Å; I199-F262 HydrophobicContact CG1-CZ 4.09Å; I199-F262 HydrophobicContact CG2-CZ 4.07Å |
| 200 | V | 95.1 | Very high | 93.3 | Very high | 65 Ų | 65 | 31.8 Ų | 31.8 | 39% | 0.394 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -57.9 | -47.3 | 176.4 | 174.8 | 0 | 0 | 0 | 0 | 111 | L68 S196 I197 G202 L203 V204 | L68-V200 HydrophobicContact CD1-CG2 3.76Å; L68-V200 HydrophobicContact CD2-CG2 3.95Å; S196-V200 PolarHBondContact O-N 2.88Å; S196-V200 VanDerWaalsContact O-N 3.08Å; I197-V200 PolarHBondContact O-N 3.35Å; V200-G202 VanDerWaalsContact C-N 3.3Å; V200-G202 PolarHBondContact O-N 3.29Å; V200-L203 PolarHBondContact O-N 2.94Å; V200-V204 HydrophobicContact CG1-CG2 4.39Å; V200-V204 WeakPolarHBondContact O-CG2 3.21Å; V200-V204 PolarHBondContact O-N 2.95Å |
| 201 | A | 95.7 | Very high | 93.1 | Very high | 18 Ų | 18 | 35.6 Ų | 35.6 | 15% | 0.149 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -58.9 | -42.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | I197 I199 V204 A205 I255 | I197-A201 VanDerWaalsContact O-CB 3.28Å; I197-A201 WeakPolarHBondContact O-CB 3.33Å; I197-A201 PolarHBondContact O-N 2.89Å; I199-A201 VanDerWaalsContact C-N 3.34Å; I199-A201 PolarHBondContact O-N 3.26Å; A201-V204 PolarHBondContact O-N 3.47Å; A201-A205 VanDerWaalsContact O-CB 3.22Å; A201-A205 WeakPolarHBondContact O-CB 3.5Å; A201-A205 PolarHBondContact O-N 3.02Å; A201-I255 HydrophobicContact CB-CB 4.3Å; A201-I255 HydrophobicContact CB-CG1 4.46Å; A201-I255 HydrophobicContact CB-CG2 3.82Å |
| 202 | G | 93.3 | Very high | 93 | Very high | 0 Ų | 0 | 40.8 Ų | 40.8 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -60.5 | -47.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | T198 I199 V200 V204 A205 A206 G258 | T198-G202 PolarHBondContact O-N 3.47Å; I199-G202 PolarHBondContact O-N 2.95Å; V200-G202 VanDerWaalsContact C-N 3.3Å; V200-G202 PolarHBondContact O-N 3.29Å; G202-V204 PolarHBondContact O-N 3.18Å; G202-A205 PolarHBondContact O-N 3.39Å; G202-A206 WeakPolarHBondContact O-CB 3.23Å; G202-A206 PolarHBondContact O-N 2.93Å; G202-G258 WeakPolarHBondContact CA-O 3.39Å |
| 203 | L | 91.1 | Very high | 92.8 | Very high | 50 Ų | 50 | 40.6 Ų | 40.6 | 26% | 0.262 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -63.9 | -40.8 | 178.5 | -67.1 | -175 | 0 | 0 | 0 | 112.3 | L61 I199 V200 F262 | L61-L203 HydrophobicContact CD2-CD1 4.39Å; L61-L203 HydrophobicContact CD2-CD2 3.38Å; L61-L203 HydrophobicContact CD2-CG 4.41Å; I199-L203 HydrophobicContact CG2-CD1 4.3Å; I199-L203 HydrophobicContact CG2-CG 4.34Å; I199-L203 WeakPolarHBondContact O-CG 3.08Å; I199-L203 PolarHBondContact O-N 2.88Å; V200-L203 PolarHBondContact O-N 2.94Å; L203-F262 HydrophobicContact CD2-CD1 4.48Å |
| 204 | V | 93.1 | Very high | 92.4 | Very high | 103 Ų | 103 | 40.4 Ų | 40.4 | 62% | 0.624 | 24% | 0.243 | S | C | * | . | H | α-helix | trans | -69.7 | -41.5 | 178.6 | 172.7 | 0 | 0 | 0 | 0 | 111.3 | V200 A201 G202 P208 | V200-V204 HydrophobicContact CG1-CG2 4.39Å; V200-V204 WeakPolarHBondContact O-CG2 3.21Å; V200-V204 PolarHBondContact O-N 2.95Å; A201-V204 PolarHBondContact O-N 3.47Å; G202-V204 PolarHBondContact O-N 3.18Å; V204-P208 WeakPolarHBondContact O-CD 3.29Å |
| 205 | A | 93.3 | Very high | 92.1 | Very high | 19 Ų | 19 | 50.9 Ų | 50.9 | 16% | 0.157 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -72 | -30.2 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | A201 G202 G207 P208 I209 A259 | A201-A205 VanDerWaalsContact O-CB 3.22Å; A201-A205 WeakPolarHBondContact O-CB 3.5Å; A201-A205 PolarHBondContact O-N 3.02Å; G202-A205 PolarHBondContact O-N 3.39Å; A205-G207 PolarHBondContact O-N 3.12Å; A205-P208 WeakPolarHBondContact O-CD 3.48Å; A205-I209 PolarHBondContact O-N 3.48Å; A205-A259 HydrophobicContact CB-CB 3.6Å; A205-A259 WeakPolarHBondContact CB-O 3.25Å |
| 206 | A | 90.2 | Very high | 91.9 | Very high | 22 Ų | 22 | 53 Ų | 53 | 18% | 0.182 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -58.8 | -34.6 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | G202 A210 S263 | G202-A206 WeakPolarHBondContact O-CB 3.23Å; G202-A206 PolarHBondContact O-N 2.93Å; A206-A210 VanDerWaalsContact O-CB 3.24Å; A206-A210 WeakPolarHBondContact O-CB 3.22Å; A206-A210 PolarHBondContact O-N 2.98Å; A206-S263 WeakPolarHBondContact CA-OG 3.23Å; A206-S263 PolarHBondContact N-OG 3.31Å |
| 207 | G | 88.5 | Confident | 91.5 | Very high | 36 Ų | 36 | 53.3 Ų | 53.3 | 37% | 0.371 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -64.3 | -62.2 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | A205 I209 A210 L211 | A205-G207 PolarHBondContact O-N 3.12Å; G207-I209 VanDerWaalsContact C-N 3.28Å; G207-I209 PolarHBondContact O-N 2.84Å; G207-A210 PolarHBondContact O-N 2.93Å; G207-L211 WeakPolarHBondContact O-CG 3.46Å; G207-L211 PolarHBondContact O-N 3.33Å |
| 208 | P | 91.8 | Very high | 91.2 | Very high | 84 Ų | 84 | 57.3 Ų | 57.3 | 55% | 0.545 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -57.1 | -37.7 | 178.5 | -27.3 | 35.3 | 0 | 0 | 0 | 113.8 | V204 A205 L211 F212 | V204-P208 WeakPolarHBondContact O-CD 3.29Å; A205-P208 WeakPolarHBondContact O-CD 3.48Å; P208-L211 PolarHBondContact O-N 3.4Å; P208-F212 WeakPolarHBondContact O-CB 3.21Å; P208-F212 PolarHBondContact O-N 3.32Å |
| 209 | I | 92.1 | Very high | 91 | Very high | 31 Ų | 31 | 57.1 Ų | 57.1 | 16% | 0.159 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -69 | -42 | 178.7 | -70.2 | 169.5 | 0 | 0 | 0 | 111 | A205 G207 F212 V213 T222 T226 F260 S263 L267 | A205-I209 PolarHBondContact O-N 3.48Å; G207-I209 VanDerWaalsContact C-N 3.28Å; G207-I209 PolarHBondContact O-N 2.84Å; I209-F212 WeakPolarHBondContact O-CB 3.48Å; I209-F212 PolarHBondContact O-N 3.49Å; I209-V213 WeakPolarHBondContact O-CG2 3.2Å; I209-V213 PolarHBondContact O-N 3Å; I209-T222 HydrophobicContact CG2-CG2 4.02Å; I209-T226 HydrophobicContact CD1-CG2 4.36Å; I209-T226 HydrophobicContact CG2-CG2 4.28Å; I209-F260 HydrophobicContact CD1-CD1 4.32Å; I209-F260 HydrophobicContact CD1-CE1 4.4Å; I209-S263 VanDerWaalsContact CD1-OG 3.27Å; I209-S263 WeakPolarHBondContact CD1-OG 3.31Å; I209-L267 HydrophobicContact CG2-CD1 3.83Å; I209-L267 HydrophobicContact CG2-CG 4.45Å |
| 210 | A | 88.2 | Confident | 90.9 | Very high | 34 Ų | 34 | 57.7 Ų | 57.7 | 28% | 0.281 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -59.4 | -48.1 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | A206 G207 F212 V213 D214 | A206-A210 VanDerWaalsContact O-CB 3.24Å; A206-A210 WeakPolarHBondContact O-CB 3.22Å; A206-A210 PolarHBondContact O-N 2.98Å; G207-A210 PolarHBondContact O-N 2.93Å; A210-F212 VanDerWaalsContact C-N 3.27Å; A210-F212 PolarHBondContact O-N 3.38Å; A210-V213 PolarHBondContact O-N 2.85Å; A210-V213 VanDerWaalsContact O-N 3.08Å; A210-D214 VanDerWaalsContact O-CG 3.28Å; A210-D214 PolarHBondContact O-N 3.34Å |
| 211 | L | 90.1 | Very high | 90.8 | Very high | 105 Ų | 105 | 59 Ų | 59 | 55% | 0.55 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -60.2 | -35.4 | 177.2 | -68.5 | 175.5 | 0 | 0 | 0 | 113.1 | G207 P208 R215 | G207-L211 WeakPolarHBondContact O-CG 3.46Å; G207-L211 PolarHBondContact O-N 3.33Å; P208-L211 PolarHBondContact O-N 3.4Å; L211-R215 WeakPolarHBondContact O-CB 3.31Å; L211-R215 WeakPolarHBondContact O-CG 3.23Å; L211-R215 PolarHBondContact O-N 3.39Å |
| 212 | F | 90.7 | Very high | 90.7 | Very high | 111 Ų | 111 | 58.7 Ų | 58.7 | 49% | 0.487 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -65.6 | -43 | 175.2 | 175.6 | -94.1 | 0 | 0 | 0 | 111.6 | P208 I209 A210 R215 T216 T222 | P208-F212 WeakPolarHBondContact O-CB 3.21Å; P208-F212 PolarHBondContact O-N 3.32Å; I209-F212 WeakPolarHBondContact O-CB 3.48Å; I209-F212 PolarHBondContact O-N 3.49Å; A210-F212 VanDerWaalsContact C-N 3.27Å; A210-F212 PolarHBondContact O-N 3.38Å; F212-R215 PolarHBondContact O-N 2.88Å; F212-T216 HydrophobicContact CD2-CG2 4.13Å; F212-T216 HydrophobicContact CE1-CG2 4.17Å; F212-T216 HydrophobicContact CE2-CG2 3.76Å; F212-T216 HydrophobicContact CG-CG2 4.5Å; F212-T216 HydrophobicContact CZ-CG2 3.78Å; F212-T216 WeakPolarHBondContact O-CB 3.49Å; F212-T216 WeakPolarHBondContact O-CG2 3.45Å; F212-T216 PolarHBondContact O-N 3.22Å; F212-T216 PolarHBondContact O-OG1 2.9Å; F212-T222 HydrophobicContact CD1-CG2 4.43Å |
| 213 | V | 91.2 | Very high | 90.7 | Very high | 0 Ų | 0 | 58.7 Ų | 58.7 | 0% | 0 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -69.9 | -41.1 | 178.9 | 172.7 | 0 | 0 | 0 | 0 | 111.7 | I209 A210 R215 T216 G217 L219 T222 L267 | I209-V213 WeakPolarHBondContact O-CG2 3.2Å; I209-V213 PolarHBondContact O-N 3Å; A210-V213 PolarHBondContact O-N 2.85Å; A210-V213 VanDerWaalsContact O-N 3.08Å; V213-R215 PolarHBondContact O-N 3.33Å; V213-T216 PolarHBondContact O-N 3.22Å; V213-G217 WeakPolarHBondContact O-CA 3.35Å; V213-G217 PolarHBondContact O-N 2.96Å; V213-L219 HydrophobicContact CG1-CB 3.94Å; V213-L219 HydrophobicContact CG1-CD1 3.71Å; V213-L219 HydrophobicContact CG1-CG 4.41Å; V213-T222 HydrophobicContact CG2-CG2 3.55Å; V213-T222 WeakPolarHBondContact CG2-OG1 3.37Å; V213-L267 HydrophobicContact CB-CD2 4.1Å; V213-L267 HydrophobicContact CG1-CD2 4.2Å; V213-L267 HydrophobicContact CG2-CD2 3.68Å |
| 214 | D | 86.4 | Confident | 90.9 | Very high | 104 Ų | 104 | 57.4 Ų | 57.4 | 56% | 0.556 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -57.9 | -38.7 | 175.6 | -71.1 | -24.9 | 0 | 0 | 0 | 111.5 | A210 | A210-D214 VanDerWaalsContact O-CG 3.28Å; A210-D214 PolarHBondContact O-N 3.34Å |
| 215 | R | 89.5 | Confident | 91 | Very high | 219 Ų | 219 | 57.1 Ų | 57.1 | 83% | 0.826 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -79.8 | -41.2 | -179.6 | -74.1 | -178.2 | 177 | -175.8 | 0.1 | 114 | L211 F212 V213 | L211-R215 WeakPolarHBondContact O-CB 3.31Å; L211-R215 WeakPolarHBondContact O-CG 3.23Å; L211-R215 PolarHBondContact O-N 3.39Å; F212-R215 PolarHBondContact O-N 2.88Å; V213-R215 PolarHBondContact O-N 3.33Å |
| 216 | T | 90 | Very high | 91 | Very high | 49 Ų | 49 | 56.4 Ų | 56.4 | 30% | 0.301 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -88.5 | -23 | -174.6 | 58.9 | 0 | 0 | 0 | 0 | 113 | F212 V213 F218 | F212-T216 HydrophobicContact CD2-CG2 4.13Å; F212-T216 HydrophobicContact CE1-CG2 4.17Å; F212-T216 HydrophobicContact CE2-CG2 3.76Å; F212-T216 HydrophobicContact CG-CG2 4.5Å; F212-T216 HydrophobicContact CZ-CG2 3.78Å; F212-T216 WeakPolarHBondContact O-CB 3.49Å; F212-T216 WeakPolarHBondContact O-CG2 3.45Å; F212-T216 PolarHBondContact O-N 3.22Å; F212-T216 PolarHBondContact O-OG1 2.9Å; V213-T216 PolarHBondContact O-N 3.22Å; T216-F218 HydrophobicContact CG2-CD2 4.46Å; T216-F218 PolarHBondContact O-N 3.12Å |
| 217 | G | 85.5 | Confident | 91.2 | Very high | 19 Ų | 19 | 55.4 Ų | 55.4 | 20% | 0.196 | 29% | 0.287 | C | S | . | . | trans | 71.9 | -2.3 | -174 | 0 | 0 | 0 | 0 | 0 | 114.6 | V213 L219 R358 | V213-G217 WeakPolarHBondContact O-CA 3.35Å; V213-G217 PolarHBondContact O-N 2.96Å; G217-L219 VanDerWaalsContact C-N 3.28Å; G217-L219 PolarHBondContact O-N 3.17Å; G217-R358 PolarHBondContact O-NH1 3.09Å | ||
| 218 | F | 90.3 | Very high | 91.5 | Very high | 130 Ų | 130 | 55.4 Ų | 55.4 | 57% | 0.57 | 28% | 0.282 | S | S | * | . | trans | -83.8 | 53.7 | -173.1 | -62 | -45.1 | 0 | 0 | 0 | 114.1 | T216 I220 E221 T222 | T216-F218 HydrophobicContact CG2-CD2 4.46Å; T216-F218 PolarHBondContact O-N 3.12Å; F218-I220 PolarHBondContact O-N 2.89Å; F218-E221 HydrophobicContact CB-CB 4.38Å; F218-E221 PolarHBondContact O-N 2.9Å; F218-T222 PolarHBondContact O-N 3.14Å; F218-T222 PolarHBondContact O-OG1 3.43Å; F218-T222 VanDerWaalsContact O-OG1 3.08Å | ||
| 219 | L | 90.2 | Very high | 91.7 | Very high | 0 Ų | 0 | 53.7 Ų | 53.7 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -56.8 | -47.1 | -174.9 | -179.8 | 60.5 | 0 | 0 | 0 | 113.5 | V213 G217 L223 L267 E270 L271 Y355 | V213-L219 HydrophobicContact CG1-CB 3.94Å; V213-L219 HydrophobicContact CG1-CD1 3.71Å; V213-L219 HydrophobicContact CG1-CG 4.41Å; G217-L219 VanDerWaalsContact C-N 3.28Å; G217-L219 PolarHBondContact O-N 3.17Å; L219-L223 WeakPolarHBondContact O-CB 3.3Å; L219-L223 PolarHBondContact O-N 3.32Å; L219-L267 HydrophobicContact CD1-CB 4.15Å; L219-L267 HydrophobicContact CD1-CD2 3.79Å; L219-E270 HydrophobicContact CD1-CB 4.46Å; L219-E270 HydrophobicContact CD2-CB 4.35Å; L219-E270 HydrophobicContact CD2-CG 4.04Å; L219-L271 HydrophobicContact CD2-CB 3.79Å; L219-L271 HydrophobicContact CD2-CD1 3.92Å; L219-L271 HydrophobicContact CD2-CG 4.46Å; L219-L271 HydrophobicContact CG-CB 4.02Å; L219-L271 HydrophobicContact CG-CD1 4.19Å; L219-Y355 HydrophobicContact CB-CE1 4.09Å; L219-Y355 HydrophobicContact CD2-CE1 4.45Å |
| 220 | I | 92.5 | Very high | 91.9 | Very high | 12 Ų | 12 | 52.4 Ų | 52.4 | 6% | 0.062 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -63.5 | -44.3 | 180 | -67.5 | 169.7 | 0 | 0 | 0 | 111.6 | F218 L223 K224 L271 L351 L353 Y355 | F218-I220 PolarHBondContact O-N 2.89Å; I220-L223 PolarHBondContact O-N 3.18Å; I220-K224 HydrophobicContact CG2-CD 4.37Å; I220-K224 WeakPolarHBondContact O-CG 3.36Å; I220-K224 PolarHBondContact O-N 2.94Å; I220-L271 HydrophobicContact CD1-CD1 4.25Å; I220-L271 HydrophobicContact CG1-CD1 3.58Å; I220-L271 HydrophobicContact CG1-CD2 3.98Å; I220-L271 HydrophobicContact CG1-CG 4.46Å; I220-L351 HydrophobicContact CG2-CD2 4.05Å; I220-L351 HydrophobicContact CG2-CG 4.25Å; I220-L353 HydrophobicContact CD1-CB 4.42Å; I220-L353 VanDerWaalsContact CD1-O 3.3Å; I220-L353 WeakPolarHBondContact CD1-O 3.48Å; I220-Y355 HydrophobicContact CD1-CE2 3.71Å; I220-Y355 HydrophobicContact CG1-CE2 4.39Å; I220-Y355 WeakPolarHBondContact CG1-OH 3.47Å; I220-Y355 PolarHBondContact N-OH 2.62Å |
| 221 | E | 93.5 | Very high | 92.2 | Very high | 92 Ų | 92 | 51 Ų | 51 | 43% | 0.43 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -71.5 | -41 | -176.4 | -57.7 | -50.4 | 134.8 | 0 | 0 | 111.1 | F218 L223 K224 I225 | F218-E221 HydrophobicContact CB-CB 4.38Å; F218-E221 PolarHBondContact O-N 2.9Å; E221-L223 VanDerWaalsContact C-N 3.3Å; E221-L223 PolarHBondContact O-N 2.96Å; E221-K224 PolarHBondContact O-N 3.16Å; E221-K224 IonicContact OE1-NZ 3.87Å; E221-K224 PolarHBondContact OE1-NZ 2.87Å; E221-K224 WeakPolarHBondContact OE2-CD 3.29Å; E221-K224 IonicContact OE2-NZ 2.6Å; E221-K224 PolarHBondContact OE2-NZ 3.44Å; E221-I225 VanDerWaalsContact O-CG1 3.31Å; E221-I225 WeakPolarHBondContact O-CG1 3.38Å; E221-I225 PolarHBondContact O-N 3.38Å |
| 222 | T | 93.4 | Very high | 92.5 | Very high | 12 Ų | 12 | 50.1 Ų | 50.1 | 7% | 0.074 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -62.6 | -37.7 | 172.4 | -53 | 0 | 0 | 0 | 0 | 111.6 | I209 F212 V213 F218 I225 T226 L267 | I209-T222 HydrophobicContact CG2-CG2 4.02Å; F212-T222 HydrophobicContact CD1-CG2 4.43Å; V213-T222 HydrophobicContact CG2-CG2 3.55Å; V213-T222 WeakPolarHBondContact CG2-OG1 3.37Å; F218-T222 PolarHBondContact O-N 3.14Å; F218-T222 PolarHBondContact O-OG1 3.43Å; F218-T222 VanDerWaalsContact O-OG1 3.08Å; T222-I225 PolarHBondContact O-N 2.94Å; T222-T226 HydrophobicContact CG2-CG2 4.07Å; T222-T226 WeakPolarHBondContact O-CB 3.37Å; T222-T226 VanDerWaalsContact O-CG2 3.27Å; T222-T226 WeakPolarHBondContact O-CG2 3.45Å; T222-T226 PolarHBondContact O-N 3.02Å; T222-T226 PolarHBondContact O-OG1 3.41Å; T222-L267 HydrophobicContact CG2-CD1 3.8Å |
| 223 | L | 93.7 | Very high | 92.7 | Very high | 1 Ų | 1 | 45 Ų | 45 | 1% | 0.005 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -63.6 | -41.9 | 175.2 | -174 | 69.9 | 0 | 0 | 0 | 112.4 | I159 L219 I220 E221 T226 F227 Q264 L267 C268 L271 L351 | I159-L223 HydrophobicContact CG2-CD2 4.4Å; L219-L223 WeakPolarHBondContact O-CB 3.3Å; L219-L223 PolarHBondContact O-N 3.32Å; I220-L223 PolarHBondContact O-N 3.18Å; E221-L223 VanDerWaalsContact C-N 3.3Å; E221-L223 PolarHBondContact O-N 2.96Å; L223-T226 WeakPolarHBondContact CA-OG1 3.31Å; L223-T226 PolarHBondContact O-OG1 2.9Å; L223-T226 VanDerWaalsContact O-OG1 3.1Å; L223-F227 WeakPolarHBondContact O-CB 3.33Å; L223-F227 PolarHBondContact O-N 3.38Å; L223-F227 VanDerWaalsContact O-N 3.07Å; L223-Q264 HydrophobicContact CD1-CG 3.8Å; L223-L267 HydrophobicContact CD1-CB 3.84Å; L223-C268 HydrophobicContact CD1-CB 4.11Å; L223-L271 HydrophobicContact CD2-CD2 3.42Å; L223-L271 VanDerWaalsContact CD2-CD2 3.42Å; L223-L351 HydrophobicContact CD2-CD2 4.19Å |
| 224 | K | 94.4 | Very high | 92.9 | Very high | 22 Ų | 22 | 45 Ų | 45 | 10% | 0.096 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -62.3 | -44.6 | 175.6 | -70.1 | 168.2 | -177.2 | 166.6 | 0 | 111.8 | I220 E221 S228 L348 L351 | I220-K224 HydrophobicContact CG2-CD 4.37Å; I220-K224 WeakPolarHBondContact O-CG 3.36Å; I220-K224 PolarHBondContact O-N 2.94Å; E221-K224 PolarHBondContact O-N 3.16Å; E221-K224 IonicContact OE1-NZ 3.87Å; E221-K224 PolarHBondContact OE1-NZ 2.87Å; E221-K224 WeakPolarHBondContact OE2-CD 3.29Å; E221-K224 IonicContact OE2-NZ 2.6Å; E221-K224 PolarHBondContact OE2-NZ 3.44Å; K224-S228 WeakPolarHBondContact O-CB 3.27Å; K224-S228 PolarHBondContact O-N 2.86Å; K224-S228 PolarHBondContact O-OG 2.83Å; K224-L348 HydrophobicContact CB-CD1 4.07Å; K224-L348 HydrophobicContact CD-CD1 4.37Å; K224-L351 WeakPolarHBondContact CE-O 3.33Å; K224-L351 HydrophobicContact CG-CD2 3.96Å |
| 225 | I | 94.7 | Very high | 93.4 | Very high | 98 Ų | 98 | 42.2 Ų | 42.2 | 50% | 0.503 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -66.3 | -51 | -179.5 | -67.1 | 166.4 | 0 | 0 | 0 | 110.3 | E221 T222 F227 S228 L229 | E221-I225 VanDerWaalsContact O-CG1 3.31Å; E221-I225 WeakPolarHBondContact O-CG1 3.38Å; E221-I225 PolarHBondContact O-N 3.38Å; T222-I225 PolarHBondContact O-N 2.94Å; I225-F227 VanDerWaalsContact C-N 3.31Å; I225-F227 PolarHBondContact O-N 3.36Å; I225-S228 PolarHBondContact O-N 3.41Å; I225-S228 VanDerWaalsContact O-N 3.14Å; I225-L229 HydrophobicContact CG2-CD1 3.7Å; I225-L229 HydrophobicContact CG2-CG 4.2Å; I225-L229 VanDerWaalsContact O-CG 3.31Å; I225-L229 WeakPolarHBondContact O-CG 3.46Å; I225-L229 PolarHBondContact O-N 3.34Å |
| 226 | T | 94.2 | Very high | 93.7 | Very high | 3 Ų | 3 | 34.1 Ų | 34.1 | 2% | 0.018 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -59.6 | -41 | -179.6 | 49.6 | 0 | 0 | 0 | 0 | 112 | I209 T222 L223 L229 S230 F260 L267 | I209-T226 HydrophobicContact CD1-CG2 4.36Å; I209-T226 HydrophobicContact CG2-CG2 4.28Å; T222-T226 HydrophobicContact CG2-CG2 4.07Å; T222-T226 WeakPolarHBondContact O-CB 3.37Å; T222-T226 VanDerWaalsContact O-CG2 3.27Å; T222-T226 WeakPolarHBondContact O-CG2 3.45Å; T222-T226 PolarHBondContact O-N 3.02Å; T222-T226 PolarHBondContact O-OG1 3.41Å; L223-T226 WeakPolarHBondContact CA-OG1 3.31Å; L223-T226 PolarHBondContact O-OG1 2.9Å; L223-T226 VanDerWaalsContact O-OG1 3.1Å; T226-L229 PolarHBondContact O-N 3.4Å; T226-S230 WeakPolarHBondContact O-CB 3.18Å; T226-S230 PolarHBondContact O-N 3.49Å; T226-F260 HydrophobicContact CG2-CD1 4.31Å; T226-L267 HydrophobicContact CG2-CD1 4.11Å |
| 227 | F | 94.5 | Very high | 94 | Very high | 1 Ų | 1 | 32 Ų | 32 | 0% | 0.004 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -63.2 | -46.8 | 174.2 | -176.2 | -132.8 | 0 | 0 | 0 | 112.1 | T162 C166 L223 I225 L229 S230 V231 M340 L343 Q347 | T162-F227 HydrophobicContact CG2-CE1 3.92Å; T162-F227 HydrophobicContact CG2-CZ 4.28Å; C166-F227 HydrophobicContact CB-CD2 4.28Å; C166-F227 HydrophobicContact CB-CE2 3.95Å; L223-F227 WeakPolarHBondContact O-CB 3.33Å; L223-F227 PolarHBondContact O-N 3.38Å; L223-F227 VanDerWaalsContact O-N 3.07Å; I225-F227 VanDerWaalsContact C-N 3.31Å; I225-F227 PolarHBondContact O-N 3.36Å; F227-L229 VanDerWaalsContact C-N 3.31Å; F227-L229 PolarHBondContact O-N 2.89Å; F227-S230 WeakPolarHBondContact O-CB 3.36Å; F227-S230 PolarHBondContact O-N 2.91Å; F227-V231 HydrophobicContact CD2-CG2 4.16Å; F227-V231 HydrophobicContact CE2-CG2 3.94Å; F227-V231 HydrophobicContact CZ-CG2 4.2Å; F227-V231 WeakPolarHBondContact O-CG2 3.33Å; F227-V231 PolarHBondContact O-N 3.38Å; F227-M340 HydrophobicContact CE2-CE 3.65Å; F227-M340 HydrophobicContact CZ-CE 4Å; F227-L343 HydrophobicContact CE1-CB 4.26Å; F227-L343 HydrophobicContact CZ-CB 4.1Å; F227-Q347 HydrophobicContact CD1-CB 4.12Å; F227-Q347 HydrophobicContact CD1-CG 4.43Å; F227-Q347 HydrophobicContact CE1-CB 4.22Å; F227-Q347 VanDerWaalsContact CE1-OE1 3.29Å |
| 228 | S | 95.3 | Very high | 94.4 | Very high | 37 Ų | 37 | 31.3 Ų | 31.3 | 26% | 0.259 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -61.3 | -40.1 | 179.5 | -56.6 | 0 | 0 | 0 | 0 | 112.1 | K224 I225 V231 L232 | K224-S228 WeakPolarHBondContact O-CB 3.27Å; K224-S228 PolarHBondContact O-N 2.86Å; K224-S228 PolarHBondContact O-OG 2.83Å; I225-S228 PolarHBondContact O-N 3.41Å; I225-S228 VanDerWaalsContact O-N 3.14Å; S228-V231 PolarHBondContact O-N 3.34Å; S228-L232 PolarHBondContact O-N 2.93Å |
| 229 | L | 95.9 | Very high | 94.6 | Very high | 47 Ų | 47 | 29.4 Ų | 29.4 | 25% | 0.246 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -69.9 | -36.8 | 176.3 | -64.2 | 173.6 | 0 | 0 | 0 | 112.1 | I225 T226 F227 L232 G233 W256 F260 | I225-L229 HydrophobicContact CG2-CD1 3.7Å; I225-L229 HydrophobicContact CG2-CG 4.2Å; I225-L229 VanDerWaalsContact O-CG 3.31Å; I225-L229 WeakPolarHBondContact O-CG 3.46Å; I225-L229 PolarHBondContact O-N 3.34Å; T226-L229 PolarHBondContact O-N 3.4Å; F227-L229 VanDerWaalsContact C-N 3.31Å; F227-L229 PolarHBondContact O-N 2.89Å; L229-L232 PolarHBondContact O-N 3.28Å; L229-G233 PolarHBondContact O-N 3.41Å; L229-W256 HydrophobicContact CB-CZ2 4.38Å; L229-W256 HydrophobicContact CD2-CZ2 3.98Å; L229-W256 PolarHBondContact O-NE1 3.02Å; L229-F260 HydrophobicContact CB-CB 4.35Å; L229-F260 HydrophobicContact CB-CD1 4.01Å; L229-F260 HydrophobicContact CB-CD2 3.82Å; L229-F260 HydrophobicContact CB-CE1 4.29Å; L229-F260 HydrophobicContact CB-CE2 4.13Å; L229-F260 HydrophobicContact CB-CG 3.77Å; L229-F260 HydrophobicContact CB-CZ 4.35Å; L229-F260 HydrophobicContact CD1-CD1 3.9Å; L229-F260 HydrophobicContact CD1-CE1 3.47Å; L229-F260 VanDerWaalsContact CD1-CE1 3.47Å; L229-F260 HydrophobicContact CD1-CE2 4.28Å; L229-F260 HydrophobicContact CD1-CG 4.46Å; L229-F260 HydrophobicContact CD1-CZ 3.7Å |
| 230 | S | 95.2 | Very high | 94.8 | Very high | 4 Ų | 4 | 30 Ų | 30 | 3% | 0.028 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -61.8 | -45.6 | 173.4 | -175.6 | 0 | 0 | 0 | 0 | 111.1 | T226 F227 L232 G233 S234 L257 | T226-S230 WeakPolarHBondContact O-CB 3.18Å; T226-S230 PolarHBondContact O-N 3.49Å; F227-S230 WeakPolarHBondContact O-CB 3.36Å; F227-S230 PolarHBondContact O-N 2.91Å; S230-L232 PolarHBondContact O-N 2.85Å; S230-G233 PolarHBondContact O-N 3.34Å; S230-G233 VanDerWaalsContact O-N 3.17Å; S230-S234 PolarHBondContact O-N 2.89Å; S230-L257 WeakPolarHBondContact O-CD1 3.41Å |
| 231 | V | 95.8 | Very high | 94.8 | Very high | 4 Ų | 4 | 29.7 Ų | 29.7 | 2% | 0.024 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -63.6 | -41.6 | 176 | 176 | 0 | 0 | 0 | 0 | 111.4 | F227 S228 G233 S234 V235 M340 V341 | F227-V231 HydrophobicContact CD2-CG2 4.16Å; F227-V231 HydrophobicContact CE2-CG2 3.94Å; F227-V231 HydrophobicContact CZ-CG2 4.2Å; F227-V231 WeakPolarHBondContact O-CG2 3.33Å; F227-V231 PolarHBondContact O-N 3.38Å; S228-V231 PolarHBondContact O-N 3.34Å; V231-G233 VanDerWaalsContact C-N 3.27Å; V231-G233 PolarHBondContact O-N 2.91Å; V231-S234 WeakPolarHBondContact O-CB 3.34Å; V231-S234 PolarHBondContact O-N 3.3Å; V231-S234 PolarHBondContact O-OG 3.03Å; V231-V235 HydrophobicContact CG1-CG2 4.38Å; V231-V235 WeakPolarHBondContact O-CG2 3.47Å; V231-V235 PolarHBondContact O-N 2.76Å; V231-M340 HydrophobicContact CG1-CB 4.16Å; V231-M340 HydrophobicContact CG2-CB 4.06Å; V231-M340 HydrophobicContact CG2-CE 4.32Å; V231-V341 HydrophobicContact CG1-CB 4.31Å; V231-V341 HydrophobicContact CG1-CG2 3.51Å |
| 232 | L | 95.9 | Very high | 94.5 | Very high | 88 Ų | 88 | 31.6 Ų | 31.6 | 46% | 0.461 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -55.9 | -44 | 173.7 | -179.2 | 62.4 | 0 | 0 | 0 | 111.5 | S228 L229 S230 S234 V235 C236 | S228-L232 PolarHBondContact O-N 2.93Å; L229-L232 PolarHBondContact O-N 3.28Å; S230-L232 PolarHBondContact O-N 2.85Å; L232-S234 VanDerWaalsContact C-N 3.34Å; L232-S234 PolarHBondContact O-N 3.48Å; L232-V235 PolarHBondContact O-N 2.9Å; L232-C236 WeakPolarHBondContact O-CB 3.29Å; L232-C236 PolarHBondContact O-N 3.45Å; L232-C236 PolarHBondContact O-SG 2.88Å |
| 233 | G | 95.2 | Very high | 94.3 | Very high | 2 Ų | 2 | 37 Ų | 37 | 2% | 0.021 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -59 | -41.8 | 173.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | L229 S230 V231 C236 L237 | L229-G233 PolarHBondContact O-N 3.41Å; S230-G233 PolarHBondContact O-N 3.34Å; S230-G233 VanDerWaalsContact O-N 3.17Å; V231-G233 VanDerWaalsContact C-N 3.27Å; V231-G233 PolarHBondContact O-N 2.91Å; G233-C236 PolarHBondContact O-N 3.39Å; G233-L237 WeakPolarHBondContact O-CB 3.39Å; G233-L237 PolarHBondContact O-N 3.37Å |
| 234 | S | 95.2 | Very high | 93.8 | Very high | 2 Ų | 2 | 43 Ų | 43 | 1% | 0.014 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -64 | -41.3 | 176.4 | 76.5 | 0 | 0 | 0 | 0 | 112.6 | Y169 S230 V231 L232 L237 S238 C337 | Y169-S234 VanDerWaalsContact OH-CB 3.31Å; Y169-S234 WeakPolarHBondContact OH-CB 3.49Å; S230-S234 PolarHBondContact O-N 2.89Å; V231-S234 WeakPolarHBondContact O-CB 3.34Å; V231-S234 PolarHBondContact O-N 3.3Å; V231-S234 PolarHBondContact O-OG 3.03Å; L232-S234 VanDerWaalsContact C-N 3.34Å; L232-S234 PolarHBondContact O-N 3.48Å; S234-L237 PolarHBondContact O-N 3.41Å; S234-S238 WeakPolarHBondContact O-CB 3.46Å; S234-S238 PolarHBondContact O-N 3.46Å; S234-C337 VanDerWaalsContact C-SG 3.6Å; S234-C337 PolarHBondContact O-SG 2.89Å; S234-C337 VanDerWaalsContact O-SG 3.33Å |
| 235 | V | 96.2 | Very high | 93.4 | Very high | 44 Ų | 44 | 48.1 Ų | 48.1 | 27% | 0.267 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -67 | -46.1 | 178.1 | 173.2 | 0 | 0 | 0 | 0 | 110.2 | V231 L232 L237 S238 I239 C337 V341 | V231-V235 HydrophobicContact CG1-CG2 4.38Å; V231-V235 WeakPolarHBondContact O-CG2 3.47Å; V231-V235 PolarHBondContact O-N 2.76Å; L232-V235 PolarHBondContact O-N 2.9Å; V235-L237 VanDerWaalsContact C-N 3.34Å; V235-L237 PolarHBondContact O-N 3.33Å; V235-S238 WeakPolarHBondContact O-CB 3.27Å; V235-S238 PolarHBondContact O-N 3.28Å; V235-S238 VanDerWaalsContact O-N 3.12Å; V235-I239 HydrophobicContact CG1-CD1 4Å; V235-I239 WeakPolarHBondContact O-CG1 3.33Å; V235-I239 PolarHBondContact O-N 3.49Å; V235-C337 HydrophobicContact CG2-CB 4.16Å; V235-V341 HydrophobicContact CG2-CG2 3.68Å |
| 236 | C | 95.8 | Very high | 93.2 | Very high | 49 Ų | 49 | 46.6 Ų | 46.6 | 33% | 0.331 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -58.4 | -46.2 | 174.8 | -70 | 0 | 0 | 0 | 0 | 111.3 | L232 G233 S238 I239 V240 | L232-C236 WeakPolarHBondContact O-CB 3.29Å; L232-C236 PolarHBondContact O-N 3.45Å; L232-C236 PolarHBondContact O-SG 2.88Å; G233-C236 PolarHBondContact O-N 3.39Å; C236-S238 VanDerWaalsContact C-N 3.29Å; C236-S238 PolarHBondContact O-N 3.04Å; C236-I239 PolarHBondContact O-N 3.4Å; C236-V240 WeakPolarHBondContact O-CB 3.46Å; C236-V240 VanDerWaalsContact O-CG2 3.23Å; C236-V240 WeakPolarHBondContact O-CG2 3.18Å; C236-V240 PolarHBondContact O-N 3.46Å |
| 237 | L | 96.3 | Very high | 93.1 | Very high | 5 Ų | 5 | 50.8 Ų | 50.8 | 3% | 0.026 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -56.8 | -46.3 | 174 | 179.4 | 62.8 | 0 | 0 | 0 | 110.9 | L173 G233 S234 V235 I239 V240 L241 I250 C253 L254 | L173-L237 HydrophobicContact CD1-CD2 3.94Å; L173-L237 HydrophobicContact CD2-CD2 4.15Å; G233-L237 WeakPolarHBondContact O-CB 3.39Å; G233-L237 PolarHBondContact O-N 3.37Å; S234-L237 PolarHBondContact O-N 3.41Å; V235-L237 VanDerWaalsContact C-N 3.34Å; V235-L237 PolarHBondContact O-N 3.33Å; L237-I239 VanDerWaalsContact C-N 3.28Å; L237-I239 PolarHBondContact O-N 2.92Å; L237-V240 PolarHBondContact O-N 2.98Å; L237-L241 HydrophobicContact CD1-CG 4.34Å; L237-L241 HydrophobicContact CG-CD1 4.24Å; L237-L241 HydrophobicContact CG-CG 4.47Å; L237-L241 VanDerWaalsContact O-CG 3.29Å; L237-L241 WeakPolarHBondContact O-CG 3.33Å; L237-L241 PolarHBondContact O-N 3.05Å; L237-I250 HydrophobicContact CD1-CG2 4.13Å; L237-C253 HydrophobicContact CB-CB 3.88Å; L237-C253 HydrophobicContact CD1-CB 4.19Å; L237-L254 HydrophobicContact CD1-CD2 4.46Å; L237-L254 HydrophobicContact CD1-CG 4.27Å; L237-L254 HydrophobicContact CD2-CD2 3.71Å; L237-L254 HydrophobicContact CD2-CG 4.38Å |
| 238 | S | 94.2 | Very high | 93.2 | Very high | 4 Ų | 4 | 56.7 Ų | 56.7 | 3% | 0.028 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -59.5 | -39.7 | -179.9 | -158.6 | 0 | 0 | 0 | 0 | 112.6 | S234 V235 C236 H333 M334 | S234-S238 WeakPolarHBondContact O-CB 3.46Å; S234-S238 PolarHBondContact O-N 3.46Å; V235-S238 WeakPolarHBondContact O-CB 3.27Å; V235-S238 PolarHBondContact O-N 3.28Å; V235-S238 VanDerWaalsContact O-N 3.12Å; C236-S238 VanDerWaalsContact C-N 3.29Å; C236-S238 PolarHBondContact O-N 3.04Å; S238-H333 WeakPolarHBondContact CA-ND1 3.4Å; S238-H333 WeakPolarHBondContact CB-ND1 3.43Å; S238-H333 PolarHBondContact OG-ND1 3.44Å; S238-M334 WeakPolarHBondContact OG-CA 3.23Å; S238-M334 WeakPolarHBondContact OG-CG 3.34Å; S238-M334 PolarHBondContact OG-N 3.01Å |
| 239 | I | 94.8 | Very high | 93.2 | Very high | 90 Ų | 90 | 58.7 Ų | 58.7 | 46% | 0.462 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -69.8 | -46.1 | 176.9 | -66.8 | 165.2 | 0 | 0 | 0 | 110.2 | V235 C236 L237 L241 W242 F243 | V235-I239 HydrophobicContact CG1-CD1 4Å; V235-I239 WeakPolarHBondContact O-CG1 3.33Å; V235-I239 PolarHBondContact O-N 3.49Å; C236-I239 PolarHBondContact O-N 3.4Å; L237-I239 VanDerWaalsContact C-N 3.28Å; L237-I239 PolarHBondContact O-N 2.92Å; I239-L241 PolarHBondContact O-N 3.14Å; I239-W242 WeakPolarHBondContact O-CB 3.42Å; I239-W242 PolarHBondContact O-N 2.92Å; I239-F243 HydrophobicContact CG2-CD2 4.44Å; I239-F243 HydrophobicContact CG2-CE2 3.85Å; I239-F243 WeakPolarHBondContact O-CD2 3.22Å |
| 240 | V | 94.2 | Very high | 93.3 | Very high | 12 Ų | 12 | 56.5 Ų | 56.5 | 7% | 0.073 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -61.4 | -34.4 | -178.6 | 172.5 | 0 | 0 | 0 | 0 | 111.7 | C236 L237 W242 F243 Q246 L249 I250 | C236-V240 WeakPolarHBondContact O-CB 3.46Å; C236-V240 VanDerWaalsContact O-CG2 3.23Å; C236-V240 WeakPolarHBondContact O-CG2 3.18Å; C236-V240 PolarHBondContact O-N 3.46Å; L237-V240 PolarHBondContact O-N 2.98Å; V240-W242 PolarHBondContact O-N 3.42Å; V240-W242 VanDerWaalsContact O-N 3.11Å; V240-F243 PolarHBondContact O-N 3.49Å; V240-Q246 HydrophobicContact CG1-CB 3.67Å; V240-Q246 HydrophobicContact CG1-CG 4.37Å; V240-L249 HydrophobicContact CG1-CB 3.77Å; V240-L249 HydrophobicContact CG2-CB 4.02Å; V240-L249 HydrophobicContact CG2-CD2 4.06Å; V240-I250 HydrophobicContact CG1-CD1 4.48Å; V240-I250 HydrophobicContact CG1-CG1 3.52Å |
| 241 | L | 91.6 | Very high | 93.3 | Very high | 6 Ų | 6 | 57.1 Ų | 57.1 | 3% | 0.031 | 28% | 0.284 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -62.7 | -13.9 | 176.2 | -72.7 | 172.3 | 0 | 0 | 0 | 114.3 | I180 L181 K184 L237 I239 I250 | I180-L241 HydrophobicContact CG2-CD1 3.8Å; I180-L241 HydrophobicContact CG2-CD2 3.99Å; L181-L241 HydrophobicContact CD2-CD2 4.05Å; K184-L241 VanDerWaalsContact CE-O 3.29Å; K184-L241 WeakPolarHBondContact CE-O 3.37Å; L237-L241 HydrophobicContact CD1-CG 4.34Å; L237-L241 HydrophobicContact CG-CD1 4.24Å; L237-L241 HydrophobicContact CG-CG 4.47Å; L237-L241 VanDerWaalsContact O-CG 3.29Å; L237-L241 WeakPolarHBondContact O-CG 3.33Å; L237-L241 PolarHBondContact O-N 3.05Å; I239-L241 PolarHBondContact O-N 3.14Å; L241-I250 HydrophobicContact CD2-CD1 4.41Å |
| 242 | W | 88.8 | Confident | 93.4 | Very high | 132 Ų | 132 | 61.5 Ų | 61.5 | 50% | 0.5 | 31% | 0.307 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.9 | -20.4 | 171.8 | -74 | 86.9 | 0 | 0 | 0 | 113.3 | I239 V240 M334 | I239-W242 WeakPolarHBondContact O-CB 3.42Å; I239-W242 PolarHBondContact O-N 2.92Å; V240-W242 PolarHBondContact O-N 3.42Å; V240-W242 VanDerWaalsContact O-N 3.11Å; W242-M334 HydrophobicContact CH2-CE 4.47Å; W242-M334 HydrophobicContact CZ2-CE 3.42Å; W242-M334 VanDerWaalsContact CZ2-CE 3.42Å; W242-M334 HydrophobicContact CZ2-SD 4.08Å; W242-M334 PolarHBondContact NE1-SD 2.96Å |
| 243 | F | 88.3 | Confident | 93.5 | Very high | 125 Ų | 125 | 58 Ų | 58 | 55% | 0.548 | 29% | 0.289 | S | S | . | . | S | Bend | trans | -96.8 | 135.8 | -179 | -65.4 | -80 | 0 | 0 | 0 | 110.9 | I239 V240 Q246 | I239-F243 HydrophobicContact CG2-CD2 4.44Å; I239-F243 HydrophobicContact CG2-CE2 3.85Å; I239-F243 WeakPolarHBondContact O-CD2 3.22Å; V240-F243 PolarHBondContact O-N 3.49Å; F243-Q246 HydrophobicContact CB-CG 3.67Å |
| 244 | H | 83.2 | Confident | 93.5 | Very high | 129 Ų | 129 | 57.9 Ų | 57.9 | 60% | 0.597 | 29% | 0.288 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.5 | 148.9 | -178.6 | -55.4 | 111.5 | 0 | 0 | 0 | 112.6 | Q246 I316 | H244-Q246 VanDerWaalsContact C-N 3.3Å; H244-Q246 WeakPolarHBondContact O-CG 3.33Å; H244-Q246 PolarHBondContact O-N 2.89Å; H244-Q246 PolarHBondContact O-NE2 3.37Å; H244-Q246 VanDerWaalsContact O-NE2 3.13Å; H244-I316 WeakPolarHBondContact CD2-CD1 3.31Å; H244-I316 WeakPolarHBondContact NE2-CD1 3.27Å |
| 245 | N | 85.9 | Confident | 93.6 | Very high | 128 Ų | 128 | 60.7 Ų | 60.7 | 68% | 0.684 | 30% | 0.302 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.5 | 34.1 | 171.9 | -159.7 | 24.5 | 0 | 0 | 0 | 115.6 | Q247 | N245-Q247 PolarHBondContact O-N 3.28Š|
| 246 | Q | 90.9 | Very high | 93.7 | Very high | 66 Ų | 66 | 63.4 Ų | 63.4 | 31% | 0.308 | 31% | 0.308 | S | S | . | . | trans | -94.1 | 47.9 | -180 | -61.2 | -53.9 | -38.3 | 0 | 0 | 114.3 | Y186 V240 F243 H244 I248 L249 I250 | Y186-Q246 PolarHBondContact OH-N 3.25Å; V240-Q246 HydrophobicContact CG1-CB 3.67Å; V240-Q246 HydrophobicContact CG1-CG 4.37Å; F243-Q246 HydrophobicContact CB-CG 3.67Å; H244-Q246 VanDerWaalsContact C-N 3.3Å; H244-Q246 WeakPolarHBondContact O-CG 3.33Å; H244-Q246 PolarHBondContact O-N 2.89Å; H244-Q246 PolarHBondContact O-NE2 3.37Å; H244-Q246 VanDerWaalsContact O-NE2 3.13Å; Q246-I248 VanDerWaalsContact C-N 3.3Å; Q246-I248 PolarHBondContact O-N 2.9Å; Q246-L249 HydrophobicContact CB-CB 4.27Å; Q246-L249 PolarHBondContact O-N 3.38Å; Q246-I250 VanDerWaalsContact O-CG1 3.3Å; Q246-I250 WeakPolarHBondContact O-CG1 3.49Å; Q246-I250 PolarHBondContact O-N 3.34Å | ||
| 247 | Q | 93 | Very high | 93.7 | Very high | 91 Ų | 91 | 61.3 Ų | 61.3 | 43% | 0.425 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -54.1 | -43.9 | -175.6 | -67.8 | -175.3 | -6.3 | 0 | 0 | 113.4 | Y186 F190 N245 T251 | Y186-Q247 HydrophobicContact CD1-CG 3.84Å; Y186-Q247 HydrophobicContact CE1-CB 4.48Å; Y186-Q247 HydrophobicContact CE1-CG 3.34Å; F190-Q247 HydrophobicContact CE1-CG 4.43Å; F190-Q247 HydrophobicContact CE2-CB 3.87Å; F190-Q247 HydrophobicContact CE2-CG 4.19Å; F190-Q247 HydrophobicContact CZ-CB 3.77Å; F190-Q247 HydrophobicContact CZ-CG 4.06Å; F190-Q247 WeakPolarHBondContact CZ-O 3.43Å; N245-Q247 PolarHBondContact O-N 3.28Å; Q247-T251 WeakPolarHBondContact O-CB 3.39Å; Q247-T251 PolarHBondContact O-N 3.43Å; Q247-T251 VanDerWaalsContact O-N 3.08Å; Q247-T251 PolarHBondContact O-OG1 3.4Å |
| 248 | I | 95.6 | Very high | 93.5 | Very high | 126 Ų | 126 | 61 Ų | 61 | 65% | 0.646 | 29% | 0.292 | S | S | * | . | H | α-helix | trans | -66.3 | -48.2 | -177.9 | -61.8 | 171.9 | 0 | 0 | 0 | 110.3 | Q246 I250 T251 I252 | Q246-I248 VanDerWaalsContact C-N 3.3Å; Q246-I248 PolarHBondContact O-N 2.9Å; I248-I250 PolarHBondContact O-N 3.45Å; I248-T251 WeakPolarHBondContact O-CB 3.4Å; I248-T251 PolarHBondContact O-N 3.26Å; I248-I252 HydrophobicContact CG2-CD1 3.8Å; I248-I252 HydrophobicContact CG2-CG1 4.46Å; I248-I252 WeakPolarHBondContact O-CG1 3.44Å; I248-I252 PolarHBondContact O-N 3.2Å |
| 249 | L | 96.2 | Very high | 93.6 | Very high | 78 Ų | 78 | 61.6 Ų | 61.6 | 41% | 0.408 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -65 | -40.3 | -179.2 | -86.7 | 68.5 | 0 | 0 | 0 | 111.8 | V240 Q246 T251 I252 C253 | V240-L249 HydrophobicContact CG1-CB 3.77Å; V240-L249 HydrophobicContact CG2-CB 4.02Å; V240-L249 HydrophobicContact CG2-CD2 4.06Å; Q246-L249 HydrophobicContact CB-CB 4.27Å; Q246-L249 PolarHBondContact O-N 3.38Å; L249-T251 VanDerWaalsContact C-N 3.3Å; L249-T251 PolarHBondContact O-N 3.07Å; L249-I252 PolarHBondContact O-N 3.45Å; L249-C253 PolarHBondContact O-N 3.37Å; L249-C253 PolarHBondContact O-SG 2.82Å |
| 250 | I | 96.4 | Very high | 93.6 | Very high | 1 Ų | 1 | 59 Ų | 59 | 1% | 0.005 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -58 | -47.6 | 174.8 | -68.7 | 171.4 | 0 | 0 | 0 | 109.9 | L181 Y186 F190 L237 V240 L241 Q246 I248 I252 C253 L254 | L181-I250 HydrophobicContact CD2-CD1 4.08Å; L181-I250 HydrophobicContact CD2-CG2 4.08Å; Y186-I250 HydrophobicContact CD2-CD1 4.23Å; Y186-I250 HydrophobicContact CE2-CD1 3.33Å; Y186-I250 WeakPolarHBondContact OH-CD1 3.16Å; F190-I250 HydrophobicContact CE1-CG2 4.34Å; L237-I250 HydrophobicContact CD1-CG2 4.13Å; V240-I250 HydrophobicContact CG1-CD1 4.48Å; V240-I250 HydrophobicContact CG1-CG1 3.52Å; L241-I250 HydrophobicContact CD2-CD1 4.41Å; Q246-I250 VanDerWaalsContact O-CG1 3.3Å; Q246-I250 WeakPolarHBondContact O-CG1 3.49Å; Q246-I250 PolarHBondContact O-N 3.34Å; I248-I250 PolarHBondContact O-N 3.45Å; I250-I252 PolarHBondContact O-N 3.49Å; I250-C253 PolarHBondContact O-N 2.95Å; I250-L254 HydrophobicContact CG2-CD1 3.9Å; I250-L254 HydrophobicContact CG2-CG 4.49Å; I250-L254 WeakPolarHBondContact O-CB 3.44Å; I250-L254 WeakPolarHBondContact O-CG 3.2Å; I250-L254 PolarHBondContact O-N 3.38Å |
| 251 | T | 96.7 | Very high | 93.4 | Very high | 18 Ų | 18 | 59 Ų | 59 | 11% | 0.11 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -61.5 | -44.2 | 179.4 | -55.4 | 0 | 0 | 0 | 0 | 111.4 | F193 I197 Q247 I248 L249 L254 I255 | F193-T251 HydrophobicContact CE1-CG2 4.03Å; I197-T251 HydrophobicContact CG2-CG2 4.17Å; Q247-T251 WeakPolarHBondContact O-CB 3.39Å; Q247-T251 PolarHBondContact O-N 3.43Å; Q247-T251 VanDerWaalsContact O-N 3.08Å; Q247-T251 PolarHBondContact O-OG1 3.4Å; I248-T251 WeakPolarHBondContact O-CB 3.4Å; I248-T251 PolarHBondContact O-N 3.26Å; L249-T251 VanDerWaalsContact C-N 3.3Å; L249-T251 PolarHBondContact O-N 3.07Å; T251-L254 PolarHBondContact O-N 3.48Å; T251-I255 HydrophobicContact CG2-CD1 3.94Å; T251-I255 HydrophobicContact CG2-CG1 4.49Å; T251-I255 WeakPolarHBondContact O-CB 3.31Å; T251-I255 VanDerWaalsContact O-CG1 3.29Å; T251-I255 WeakPolarHBondContact O-CG1 3.47Å; T251-I255 PolarHBondContact O-N 3.3Å |
| 252 | I | 97.7 | Very high | 93.3 | Very high | 96 Ų | 96 | 60.2 Ų | 60.2 | 49% | 0.492 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -62.3 | -45.7 | 177.4 | -68.9 | 168.3 | 0 | 0 | 0 | 111 | I248 L249 I250 L254 I255 W256 | I248-I252 HydrophobicContact CG2-CD1 3.8Å; I248-I252 HydrophobicContact CG2-CG1 4.46Å; I248-I252 WeakPolarHBondContact O-CG1 3.44Å; I248-I252 PolarHBondContact O-N 3.2Å; L249-I252 PolarHBondContact O-N 3.45Å; I250-I252 PolarHBondContact O-N 3.49Å; I252-L254 VanDerWaalsContact C-N 3.28Å; I252-L254 PolarHBondContact O-N 2.99Å; I252-I255 PolarHBondContact O-N 3.1Å; I252-W256 WeakPolarHBondContact O-CB 3.36Å; I252-W256 PolarHBondContact O-N 3.36Å |
| 253 | C | 96.9 | Very high | 93.4 | Very high | 13 Ų | 13 | 54 Ų | 54 | 9% | 0.088 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -62.4 | -38.6 | 179.3 | -65.2 | 0 | 0 | 0 | 0 | 111.6 | L237 L249 I250 W256 L257 | L237-C253 HydrophobicContact CB-CB 3.88Å; L237-C253 HydrophobicContact CD1-CB 4.19Å; L249-C253 PolarHBondContact O-N 3.37Å; L249-C253 PolarHBondContact O-SG 2.82Å; I250-C253 PolarHBondContact O-N 2.95Å; C253-W256 PolarHBondContact O-N 3.13Å; C253-L257 VanDerWaalsContact O-CB 3.29Å; C253-L257 WeakPolarHBondContact O-CB 3.27Å; C253-L257 PolarHBondContact O-N 2.95Å |
| 254 | L | 96.6 | Very high | 93.5 | Very high | 1 Ų | 1 | 48.2 Ų | 48.2 | 1% | 0.005 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -70.1 | -43.2 | 177.1 | -75.7 | 177.2 | 0 | 0 | 0 | 112.5 | L173 L177 C194 T198 L237 I250 T251 I252 W256 L257 G258 | L173-L254 HydrophobicContact CD2-CD2 3.63Å; L177-L254 HydrophobicContact CD1-CD1 4.19Å; C194-L254 HydrophobicContact CB-CD1 3.52Å; T198-L254 WeakPolarHBondContact CG2-O 3.34Å; T198-L254 WeakPolarHBondContact OG1-CB 3.43Å; L237-L254 HydrophobicContact CD1-CD2 4.46Å; L237-L254 HydrophobicContact CD1-CG 4.27Å; L237-L254 HydrophobicContact CD2-CD2 3.71Å; L237-L254 HydrophobicContact CD2-CG 4.38Å; I250-L254 HydrophobicContact CG2-CD1 3.9Å; I250-L254 HydrophobicContact CG2-CG 4.49Å; I250-L254 WeakPolarHBondContact O-CB 3.44Å; I250-L254 WeakPolarHBondContact O-CG 3.2Å; I250-L254 PolarHBondContact O-N 3.38Å; T251-L254 PolarHBondContact O-N 3.48Å; I252-L254 VanDerWaalsContact C-N 3.28Å; I252-L254 PolarHBondContact O-N 2.99Å; L254-W256 VanDerWaalsContact C-N 3.29Å; L254-W256 PolarHBondContact O-N 3.05Å; L254-L257 HydrophobicContact CD2-CD2 4.42Å; L254-L257 PolarHBondContact O-N 3.39Å; L254-G258 PolarHBondContact O-N 2.66Å |
| 255 | I | 97.2 | Very high | 93.8 | Very high | 61 Ų | 61 | 45.6 Ų | 45.6 | 31% | 0.313 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -56.8 | -46.6 | 172 | -73.5 | 169.7 | 0 | 0 | 0 | 110.5 | I197 A201 T251 I252 G258 A259 | I197-I255 HydrophobicContact CD1-CD1 3.95Å; I197-I255 HydrophobicContact CD1-CG1 4.46Å; I197-I255 HydrophobicContact CG1-CD1 4.06Å; I197-I255 HydrophobicContact CG1-CG1 4.04Å; I197-I255 HydrophobicContact CG2-CD1 4.44Å; I197-I255 HydrophobicContact CG2-CG1 4Å; A201-I255 HydrophobicContact CB-CB 4.3Å; A201-I255 HydrophobicContact CB-CG1 4.46Å; A201-I255 HydrophobicContact CB-CG2 3.82Å; T251-I255 HydrophobicContact CG2-CD1 3.94Å; T251-I255 HydrophobicContact CG2-CG1 4.49Å; T251-I255 WeakPolarHBondContact O-CB 3.31Å; T251-I255 VanDerWaalsContact O-CG1 3.29Å; T251-I255 WeakPolarHBondContact O-CG1 3.47Å; T251-I255 PolarHBondContact O-N 3.3Å; I252-I255 PolarHBondContact O-N 3.1Å; I255-G258 PolarHBondContact O-N 2.92Å; I255-A259 WeakPolarHBondContact O-CB 3.39Å; I255-A259 PolarHBondContact O-N 3.48Å |
| 256 | W | 97 | Very high | 93.8 | Very high | 101 Ų | 101 | 42.2 Ų | 42.2 | 38% | 0.383 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -61.1 | -49.9 | 178.5 | -176.4 | -80.4 | 0 | 0 | 0 | 111.8 | L229 I252 C253 L254 G258 A259 F260 | L229-W256 HydrophobicContact CB-CZ2 4.38Å; L229-W256 HydrophobicContact CD2-CZ2 3.98Å; L229-W256 PolarHBondContact O-NE1 3.02Å; I252-W256 WeakPolarHBondContact O-CB 3.36Å; I252-W256 PolarHBondContact O-N 3.36Å; C253-W256 PolarHBondContact O-N 3.13Å; L254-W256 VanDerWaalsContact C-N 3.29Å; L254-W256 PolarHBondContact O-N 3.05Å; W256-G258 VanDerWaalsContact C-N 3.32Å; W256-G258 PolarHBondContact O-N 2.68Å; W256-A259 PolarHBondContact O-N 2.87Å; W256-F260 AromaticContact CD1-CD2 3.83Å; W256-F260 HydrophobicContact CD2-CD2 4.03Å; W256-F260 AromaticContact CD2-CE2 3.61Å; W256-F260 HydrophobicContact CD2-CE2 3.61Å; W256-F260 AromaticContact CE2-CD2 3.74Å; W256-F260 AromaticContact CE2-CE2 3.37Å; W256-F260 AromaticContact CE3-CE2 3.94Å; W256-F260 HydrophobicContact CE3-CE2 3.94Å; W256-F260 HydrophobicContact CG-CD2 4.12Å; W256-F260 HydrophobicContact CG-CE2 4.16Å; W256-F260 AromaticContact CH2-CE2 3.89Å; W256-F260 HydrophobicContact CH2-CE2 3.89Å; W256-F260 HydrophobicContact CH2-CZ 4.32Å; W256-F260 HydrophobicContact CZ2-CD2 4.27Å; W256-F260 AromaticContact CZ2-CE2 3.55Å; W256-F260 HydrophobicContact CZ2-CE2 3.55Å; W256-F260 HydrophobicContact CZ2-CZ 4.23Å; W256-F260 HydrophobicContact CZ3-CE2 4.07Å; W256-F260 AromaticContact NE1-CD2 3.6Å; W256-F260 AromaticContact NE1-CE2 3.75Å; W256-F260 VanDerWaalsContact O-CD2 3.26Å; W256-F260 WeakPolarHBondContact O-CD2 3.38Å; W256-F260 PolarHBondContact O-N 3.29Å |
| 257 | L | 95.2 | Very high | 93.8 | Very high | 4 Ų | 4 | 39.3 Ų | 39.3 | 2% | 0.021 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -57.1 | -46 | 176.4 | 178.4 | 74.8 | 0 | 0 | 0 | 111.4 | Y169 L173 S230 C253 L254 G261 | Y169-L257 HydrophobicContact CD1-CD1 4.3Å; Y169-L257 HydrophobicContact CD1-CD2 4.48Å; Y169-L257 HydrophobicContact CE1-CD1 3.75Å; Y169-L257 HydrophobicContact CE1-CD2 3.66Å; Y169-L257 HydrophobicContact CE1-CG 4.33Å; L173-L257 HydrophobicContact CD2-CD2 3.36Å; S230-L257 WeakPolarHBondContact O-CD1 3.41Å; C253-L257 VanDerWaalsContact O-CB 3.29Å; C253-L257 WeakPolarHBondContact O-CB 3.27Å; C253-L257 PolarHBondContact O-N 2.95Å; L254-L257 HydrophobicContact CD2-CD2 4.42Å; L254-L257 PolarHBondContact O-N 3.39Å; L257-G261 WeakPolarHBondContact O-CA 3.34Å; L257-G261 PolarHBondContact O-N 2.71Å |
| 258 | G | 94.1 | Very high | 93.8 | Very high | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -61.9 | -49.2 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | G202 L254 I255 W256 F260 G261 F262 | G202-G258 WeakPolarHBondContact CA-O 3.39Å; L254-G258 PolarHBondContact O-N 2.66Å; I255-G258 PolarHBondContact O-N 2.92Å; W256-G258 VanDerWaalsContact C-N 3.32Å; W256-G258 PolarHBondContact O-N 2.68Å; G258-F260 PolarHBondContact O-N 3.03Å; G258-G261 PolarHBondContact O-N 3.46Å; G258-F262 WeakPolarHBondContact O-CD2 3.29Å; G258-F262 PolarHBondContact O-N 3.33Å |
| 259 | A | 95 | Very high | 93.5 | Very high | 15 Ų | 15 | 30.3 Ų | 30.3 | 12% | 0.124 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -54.4 | -51.2 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | A205 I255 W256 S263 | A205-A259 HydrophobicContact CB-CB 3.6Å; A205-A259 WeakPolarHBondContact CB-O 3.25Å; I255-A259 WeakPolarHBondContact O-CB 3.39Å; I255-A259 PolarHBondContact O-N 3.48Å; W256-A259 PolarHBondContact O-N 2.87Å; A259-S263 WeakPolarHBondContact O-CB 3.18Å; A259-S263 PolarHBondContact O-OG 3.16Å |
| 260 | F | 94.7 | Very high | 93.1 | Very high | 37 Ų | 37 | 29.6 Ų | 29.6 | 16% | 0.162 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -81.4 | -31.6 | -178.2 | -65.5 | -66.6 | 0 | 0 | 0 | 113.2 | I209 T226 L229 W256 G258 Q264 | I209-F260 HydrophobicContact CD1-CD1 4.32Å; I209-F260 HydrophobicContact CD1-CE1 4.4Å; T226-F260 HydrophobicContact CG2-CD1 4.31Å; L229-F260 HydrophobicContact CB-CB 4.35Å; L229-F260 HydrophobicContact CB-CD1 4.01Å; L229-F260 HydrophobicContact CB-CD2 3.82Å; L229-F260 HydrophobicContact CB-CE1 4.29Å; L229-F260 HydrophobicContact CB-CE2 4.13Å; L229-F260 HydrophobicContact CB-CG 3.77Å; L229-F260 HydrophobicContact CB-CZ 4.35Å; L229-F260 HydrophobicContact CD1-CD1 3.9Å; L229-F260 HydrophobicContact CD1-CE1 3.47Å; L229-F260 VanDerWaalsContact CD1-CE1 3.47Å; L229-F260 HydrophobicContact CD1-CE2 4.28Å; L229-F260 HydrophobicContact CD1-CG 4.46Å; L229-F260 HydrophobicContact CD1-CZ 3.7Å; W256-F260 AromaticContact CD1-CD2 3.83Å; W256-F260 HydrophobicContact CD2-CD2 4.03Å; W256-F260 AromaticContact CD2-CE2 3.61Å; W256-F260 HydrophobicContact CD2-CE2 3.61Å; W256-F260 AromaticContact CE2-CD2 3.74Å; W256-F260 AromaticContact CE2-CE2 3.37Å; W256-F260 AromaticContact CE3-CE2 3.94Å; W256-F260 HydrophobicContact CE3-CE2 3.94Å; W256-F260 HydrophobicContact CG-CD2 4.12Å; W256-F260 HydrophobicContact CG-CE2 4.16Å; W256-F260 AromaticContact CH2-CE2 3.89Å; W256-F260 HydrophobicContact CH2-CE2 3.89Å; W256-F260 HydrophobicContact CH2-CZ 4.32Å; W256-F260 HydrophobicContact CZ2-CD2 4.27Å; W256-F260 AromaticContact CZ2-CE2 3.55Å; W256-F260 HydrophobicContact CZ2-CE2 3.55Å; W256-F260 HydrophobicContact CZ2-CZ 4.23Å; W256-F260 HydrophobicContact CZ3-CE2 4.07Å; W256-F260 AromaticContact NE1-CD2 3.6Å; W256-F260 AromaticContact NE1-CE2 3.75Å; W256-F260 VanDerWaalsContact O-CD2 3.26Å; W256-F260 WeakPolarHBondContact O-CD2 3.38Å; W256-F260 PolarHBondContact O-N 3.29Å; G258-F260 PolarHBondContact O-N 3.03Å; F260-Q264 WeakPolarHBondContact O-CB 3.42Å; F260-Q264 PolarHBondContact O-N 2.86Å |
| 261 | G | 91.2 | Very high | 92.9 | Very high | 11 Ų | 11 | 29.5 Ų | 29.5 | 11% | 0.113 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -68.5 | -46.9 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | L257 G258 S263 Q264 F265 | L257-G261 WeakPolarHBondContact O-CA 3.34Å; L257-G261 PolarHBondContact O-N 2.71Å; G258-G261 PolarHBondContact O-N 3.46Å; G261-S263 VanDerWaalsContact C-N 3.33Å; G261-S263 PolarHBondContact O-N 3.07Å; G261-Q264 WeakPolarHBondContact O-CB 3.4Å; G261-Q264 PolarHBondContact O-N 3.46Å; G261-F265 PolarHBondContact O-N 2.96Å |
| 262 | F | 88.9 | Confident | 92.6 | Very high | 32 Ų | 32 | 28.7 Ų | 28.7 | 14% | 0.14 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -68.4 | -34.2 | 176.2 | -86.1 | -92.8 | 0 | 0 | 0 | 112.4 | F170 I199 L203 G258 Q264 F265 | F170-F262 AromaticContact CE1-CE2 3.81Å; F170-F262 HydrophobicContact CE1-CE2 3.81Å; F170-F262 AromaticContact CE1-CZ 3.84Å; F170-F262 HydrophobicContact CE1-CZ 3.84Å; F170-F262 AromaticContact CE2-CE2 3.98Å; F170-F262 HydrophobicContact CE2-CE2 3.98Å; F170-F262 AromaticContact CZ-CE2 3.46Å; F170-F262 HydrophobicContact CZ-CE2 3.46Å; F170-F262 VanDerWaalsContact CZ-CE2 3.46Å; F170-F262 AromaticContact CZ-CZ 3.88Å; F170-F262 HydrophobicContact CZ-CZ 3.88Å; I199-F262 HydrophobicContact CB-CE2 4.5Å; I199-F262 HydrophobicContact CB-CZ 4.38Å; I199-F262 HydrophobicContact CG1-CE2 4.25Å; I199-F262 HydrophobicContact CG1-CZ 4.09Å; I199-F262 HydrophobicContact CG2-CZ 4.07Å; L203-F262 HydrophobicContact CD2-CD1 4.48Å; G258-F262 WeakPolarHBondContact O-CD2 3.29Å; G258-F262 PolarHBondContact O-N 3.33Å; F262-Q264 VanDerWaalsContact C-N 3.34Å; F262-F265 WeakPolarHBondContact O-CB 3.48Å; F262-F265 PolarHBondContact O-N 3.27Å |
| 263 | S | 90.5 | Very high | 92.1 | Very high | 1 Ų | 1 | 24.6 Ų | 24.6 | 1% | 0.007 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -65.6 | -40.9 | 176.2 | -58.1 | 0 | 0 | 0 | 0 | 111.2 | A206 I209 A259 G261 F265 S266 L267 | A206-S263 WeakPolarHBondContact CA-OG 3.23Å; A206-S263 PolarHBondContact N-OG 3.31Å; I209-S263 VanDerWaalsContact CD1-OG 3.27Å; I209-S263 WeakPolarHBondContact CD1-OG 3.31Å; A259-S263 WeakPolarHBondContact O-CB 3.18Å; A259-S263 PolarHBondContact O-OG 3.16Å; G261-S263 VanDerWaalsContact C-N 3.33Å; G261-S263 PolarHBondContact O-N 3.07Å; S263-F265 VanDerWaalsContact C-N 3.26Å; S263-F265 PolarHBondContact O-N 2.95Å; S263-S266 PolarHBondContact O-N 3.05Å; S263-L267 VanDerWaalsContact O-CG 3.32Å; S263-L267 WeakPolarHBondContact O-CG 3.21Å; S263-L267 PolarHBondContact O-N 3.43Å |
| 264 | Q | 90.1 | Very high | 91.7 | Very high | 3 Ų | 3 | 24.4 Ų | 24.4 | 1% | 0.014 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -59.2 | -36.3 | 174.4 | 178 | -178 | -18.6 | 0 | 0 | 112.8 | C166 L223 F260 G261 F262 L267 C268 | C166-Q264 PolarHBondContact SG-OE1 2.64Å; L223-Q264 HydrophobicContact CD1-CG 3.8Å; F260-Q264 WeakPolarHBondContact O-CB 3.42Å; F260-Q264 PolarHBondContact O-N 2.86Å; G261-Q264 WeakPolarHBondContact O-CB 3.4Å; G261-Q264 PolarHBondContact O-N 3.46Å; F262-Q264 VanDerWaalsContact C-N 3.34Å; Q264-L267 PolarHBondContact O-N 3.2Å; Q264-C268 VanDerWaalsContact O-CB 3.3Å; Q264-C268 WeakPolarHBondContact O-CB 3Å; Q264-C268 PolarHBondContact O-N 2.98Å |
| 265 | F | 89.4 | Confident | 91.3 | Very high | 74 Ų | 74 | 24.3 Ų | 24.3 | 33% | 0.325 | 12% | 0.124 | S | C | . | . | H | α-helix | trans | -54.6 | -56.2 | 176.6 | 173.7 | -99.7 | 0 | 0 | 0 | 111.1 | F163 I167 G261 F262 S263 L267 C268 L269 I289 | F163-F265 AromaticContact CE2-CD2 3.56Å; F163-F265 HydrophobicContact CE2-CD2 3.56Å; F163-F265 HydrophobicContact CE2-CE2 4.12Å; F163-F265 HydrophobicContact CE2-CG 4.32Å; F163-F265 AromaticContact CZ-CD2 3.59Å; F163-F265 HydrophobicContact CZ-CD2 3.59Å; F163-F265 AromaticContact CZ-CE2 3.71Å; F163-F265 HydrophobicContact CZ-CE2 3.71Å; I167-F265 HydrophobicContact CD1-CD2 3.58Å; I167-F265 HydrophobicContact CD1-CE2 4.26Å; I167-F265 HydrophobicContact CG1-CD2 4.37Å; G261-F265 PolarHBondContact O-N 2.96Å; F262-F265 WeakPolarHBondContact O-CB 3.48Å; F262-F265 PolarHBondContact O-N 3.27Å; S263-F265 VanDerWaalsContact C-N 3.26Å; S263-F265 PolarHBondContact O-N 2.95Å; F265-L267 PolarHBondContact O-N 3.48Å; F265-C268 PolarHBondContact O-N 3.37Å; F265-L269 HydrophobicContact CD1-CD1 4.34Å; F265-L269 HydrophobicContact CE1-CD1 3.73Å; F265-L269 HydrophobicContact CE2-CD1 4.26Å; F265-L269 HydrophobicContact CZ-CD1 3.69Å; F265-L269 WeakPolarHBondContact O-CG 3.39Å; F265-L269 PolarHBondContact O-N 3.46Å; F265-I289 HydrophobicContact CE2-CD1 3.88Å; F265-I289 HydrophobicContact CZ-CD1 4.41Å |
| 266 | S | 86.8 | Confident | 90.9 | Very high | 58 Ų | 58 | 21.7 Ų | 21.7 | 41% | 0.406 | 11% | 0.11 | S | C | . | . | H | α-helix | trans | -62.5 | -45.6 | -178.2 | -56.2 | 0 | 0 | 0 | 0 | 112.2 | S263 C268 L269 E270 | S263-S266 PolarHBondContact O-N 3.05Å; S266-C268 VanDerWaalsContact C-N 3.3Å; S266-C268 PolarHBondContact O-N 2.92Å; S266-L269 PolarHBondContact O-N 3.46Å; S266-E270 PolarHBondContact O-N 3.34Å; S266-E270 VanDerWaalsContact O-N 3.17Å |
| 267 | L | 91.1 | Very high | 90.4 | Very high | 4 Ų | 4 | 21.7 Ų | 21.7 | 2% | 0.021 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -63.1 | -36.4 | -179 | -65.7 | 178 | 0 | 0 | 0 | 112.6 | I209 V213 L219 T222 L223 T226 S263 Q264 F265 L271 | I209-L267 HydrophobicContact CG2-CD1 3.83Å; I209-L267 HydrophobicContact CG2-CG 4.45Å; V213-L267 HydrophobicContact CB-CD2 4.1Å; V213-L267 HydrophobicContact CG1-CD2 4.2Å; V213-L267 HydrophobicContact CG2-CD2 3.68Å; L219-L267 HydrophobicContact CD1-CB 4.15Å; L219-L267 HydrophobicContact CD1-CD2 3.79Å; T222-L267 HydrophobicContact CG2-CD1 3.8Å; L223-L267 HydrophobicContact CD1-CB 3.84Å; T226-L267 HydrophobicContact CG2-CD1 4.11Å; S263-L267 VanDerWaalsContact O-CG 3.32Å; S263-L267 WeakPolarHBondContact O-CG 3.21Å; S263-L267 PolarHBondContact O-N 3.43Å; Q264-L267 PolarHBondContact O-N 3.2Å; F265-L267 PolarHBondContact O-N 3.48Å; L267-L271 WeakPolarHBondContact O-CB 3.41Å; L267-L271 PolarHBondContact O-N 3.01Å |
| 268 | C | 91.9 | Very high | 89.8 | Confident | 1 Ų | 1 | 26.7 Ų | 26.7 | 1% | 0.007 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -70.9 | -39.1 | 179.5 | -172.3 | 0 | 0 | 0 | 0 | 112.1 | F163 L223 Q264 F265 S266 E270 L271 A272 | F163-C268 HydrophobicContact CB-CB 4.41Å; F163-C268 VanDerWaalsContact CB-SG 3.58Å; F163-C268 HydrophobicContact CD2-CB 3.38Å; F163-C268 VanDerWaalsContact CD2-SG 3.5Å; F163-C268 HydrophobicContact CE2-CB 3.93Å; F163-C268 HydrophobicContact CG-CB 4.25Å; L223-C268 HydrophobicContact CD1-CB 4.11Å; Q264-C268 VanDerWaalsContact O-CB 3.3Å; Q264-C268 WeakPolarHBondContact O-CB 3Å; Q264-C268 PolarHBondContact O-N 2.98Å; F265-C268 PolarHBondContact O-N 3.37Å; S266-C268 VanDerWaalsContact C-N 3.3Å; S266-C268 PolarHBondContact O-N 2.92Å; C268-E270 VanDerWaalsContact C-N 3.32Å; C268-E270 PolarHBondContact O-N 3.49Å; C268-L271 PolarHBondContact O-N 3.41Å; C268-A272 VanDerWaalsContact O-CB 3.23Å; C268-A272 WeakPolarHBondContact O-CB 3.45Å; C268-A272 PolarHBondContact O-N 2.94Å |
| 269 | L | 90.2 | Very high | 89.4 | Confident | 27 Ų | 27 | 27.6 Ų | 27.6 | 14% | 0.141 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -60.7 | -44.9 | 175.5 | -65.6 | -173.9 | 0 | 0 | 0 | 111.1 | F163 F265 S266 A272 A273 T285 L288 | F163-L269 HydrophobicContact CE2-CD2 4.24Å; F163-L269 HydrophobicContact CZ-CD2 4.05Å; F265-L269 HydrophobicContact CD1-CD1 4.34Å; F265-L269 HydrophobicContact CE1-CD1 3.73Å; F265-L269 HydrophobicContact CE2-CD1 4.26Å; F265-L269 HydrophobicContact CZ-CD1 3.69Å; F265-L269 WeakPolarHBondContact O-CG 3.39Å; F265-L269 PolarHBondContact O-N 3.46Å; S266-L269 PolarHBondContact O-N 3.46Å; L269-A272 PolarHBondContact O-N 3.14Å; L269-A273 WeakPolarHBondContact O-CB 3.38Å; L269-A273 PolarHBondContact O-N 3.44Å; L269-T285 HydrophobicContact CD1-CG2 4.31Å; L269-T285 HydrophobicContact CD2-CG2 3.86Å; L269-L288 HydrophobicContact CD2-CD1 3.7Å |
| 270 | E | 87.9 | Confident | 88.7 | Confident | 63 Ų | 63 | 30.1 Ų | 30.1 | 29% | 0.294 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -62.2 | -47.9 | 176.5 | -169.3 | -176 | 157.5 | 0 | 0 | 111.4 | L219 S266 C268 A272 A273 E274 | L219-E270 HydrophobicContact CD1-CB 4.46Å; L219-E270 HydrophobicContact CD2-CB 4.35Å; L219-E270 HydrophobicContact CD2-CG 4.04Å; S266-E270 PolarHBondContact O-N 3.34Å; S266-E270 VanDerWaalsContact O-N 3.17Å; C268-E270 VanDerWaalsContact C-N 3.32Å; C268-E270 PolarHBondContact O-N 3.49Å; E270-A272 VanDerWaalsContact C-N 3.31Å; E270-A272 PolarHBondContact O-N 2.84Å; E270-A273 PolarHBondContact O-N 3.25Å; E270-E274 VanDerWaalsContact O-CB 3.23Å; E270-E274 WeakPolarHBondContact O-CB 3.46Å; E270-E274 PolarHBondContact O-N 3.37Å |
| 271 | L | 90.9 | Very high | 88.1 | Confident | 0 Ų | 0 | 33.2 Ų | 33.2 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -63.9 | -37.7 | 179.7 | -178.3 | 61.1 | 0 | 0 | 0 | 112 | I159 L219 I220 L223 L267 C268 E274 A275 L353 | I159-L271 HydrophobicContact CG2-CD2 4.12Å; L219-L271 HydrophobicContact CD2-CB 3.79Å; L219-L271 HydrophobicContact CD2-CD1 3.92Å; L219-L271 HydrophobicContact CD2-CG 4.46Å; L219-L271 HydrophobicContact CG-CB 4.02Å; L219-L271 HydrophobicContact CG-CD1 4.19Å; I220-L271 HydrophobicContact CD1-CD1 4.25Å; I220-L271 HydrophobicContact CG1-CD1 3.58Å; I220-L271 HydrophobicContact CG1-CD2 3.98Å; I220-L271 HydrophobicContact CG1-CG 4.46Å; L223-L271 HydrophobicContact CD2-CD2 3.42Å; L223-L271 VanDerWaalsContact CD2-CD2 3.42Å; L267-L271 WeakPolarHBondContact O-CB 3.41Å; L267-L271 PolarHBondContact O-N 3.01Å; C268-L271 PolarHBondContact O-N 3.41Å; L271-E274 PolarHBondContact O-N 3.49Å; L271-A275 VanDerWaalsContact O-CB 3.31Å; L271-A275 WeakPolarHBondContact O-CB 3.39Å; L271-A275 PolarHBondContact O-N 2.97Å; L271-L353 HydrophobicContact CD2-CD1 4.38Å |
| 272 | A | 91.3 | Very high | 87.5 | Confident | 0 Ų | 0 | 34.9 Ų | 34.9 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -63.9 | -48.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | F156 I159 C268 L269 E270 E274 A275 T276 L288 | F156-A272 HydrophobicContact CE2-CB 4.27Å; I159-A272 HydrophobicContact CD1-CB 3.89Å; C268-A272 VanDerWaalsContact O-CB 3.23Å; C268-A272 WeakPolarHBondContact O-CB 3.45Å; C268-A272 PolarHBondContact O-N 2.94Å; L269-A272 PolarHBondContact O-N 3.14Å; E270-A272 VanDerWaalsContact C-N 3.31Å; E270-A272 PolarHBondContact O-N 2.84Å; A272-E274 VanDerWaalsContact C-N 3.31Å; A272-E274 PolarHBondContact O-N 3.33Å; A272-A275 PolarHBondContact O-N 2.98Å; A272-T276 WeakPolarHBondContact O-CB 3.48Å; A272-T276 WeakPolarHBondContact O-CG2 3.38Å; A272-T276 PolarHBondContact O-N 3.49Å; A272-T276 VanDerWaalsContact O-N 3.11Å; A272-T276 PolarHBondContact O-OG1 3.5Å; A272-L288 HydrophobicContact CB-CD1 3.69Å |
| 273 | A | 87.5 | Confident | 87.3 | Confident | 10 Ų | 10 | 34 Ų | 34 | 8% | 0.083 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -60.8 | -40.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | L269 E270 Y277 E281 | L269-A273 WeakPolarHBondContact O-CB 3.38Å; L269-A273 PolarHBondContact O-N 3.44Å; E270-A273 PolarHBondContact O-N 3.25Å; A273-Y277 PolarHBondContact O-N 3.3Å; A273-E281 HydrophobicContact CB-CB 4.29Å; A273-E281 HydrophobicContact CB-CG 4.01Å |
| 274 | E | 87.8 | Confident | 87.2 | Confident | 9 Ų | 9 | 34 Ų | 34 | 4% | 0.042 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -63.3 | -44.3 | 178.4 | -177.2 | 63.1 | -140.8 | 0 | 0 | 112.3 | E270 L271 A272 Y355 K356 R357 R358 | E270-E274 VanDerWaalsContact O-CB 3.23Å; E270-E274 WeakPolarHBondContact O-CB 3.46Å; E270-E274 PolarHBondContact O-N 3.37Å; L271-E274 PolarHBondContact O-N 3.49Å; A272-E274 VanDerWaalsContact C-N 3.31Å; A272-E274 PolarHBondContact O-N 3.33Å; E274-Y355 HydrophobicContact CG-CD1 3.63Å; E274-Y355 HydrophobicContact CG-CE1 4.43Å; E274-Y355 HydrophobicContact CG-CG 4.45Å; E274-Y355 VanDerWaalsContact OE1-C 3.3Å; E274-K356 PolarHBondContact O-N 3.27Å; E274-R357 PolarHBondContact O-N 3.33Å; E274-R357 WeakPolarHBondContact OE1-CB 3.29Å; E274-R357 PolarHBondContact OE1-N 3.27Å; E274-R357 WeakPolarHBondContact OE2-CB 3.49Å; E274-R358 WeakPolarHBondContact OE1-CB 3.3Å; E274-R358 VanDerWaalsContact OE1-CG 3.29Å; E274-R358 WeakPolarHBondContact OE1-CG 3.41Å; E274-R358 PolarHBondContact OE1-N 3.26Å |
| 275 | A | 89.6 | Confident | 87 | Confident | 0 Ų | 0 | 35.1 Ų | 35.1 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -81.6 | -23.7 | -175 | 0 | 0 | 0 | 0 | 0 | 114.5 | L153 L271 A272 L353 P354 K356 | L153-A275 WeakPolarHBondContact CD1-O 3.46Å; L271-A275 VanDerWaalsContact O-CB 3.31Å; L271-A275 WeakPolarHBondContact O-CB 3.39Å; L271-A275 PolarHBondContact O-N 2.97Å; A272-A275 PolarHBondContact O-N 2.98Å; A275-L353 HydrophobicContact CB-CB 3.91Å; A275-L353 HydrophobicContact CB-CD2 3.3Å; A275-L353 HydrophobicContact CB-CG 4.2Å; A275-P354 WeakPolarHBondContact CA-O 3.49Å; A275-K356 VanDerWaalsContact O-CD 3.31Å; A275-K356 WeakPolarHBondContact O-CD 3.36Å; A275-K356 WeakPolarHBondContact O-CE 3.4Å |
| 276 | T | 88.7 | Confident | 86.9 | Confident | 5 Ų | 5 | 32.3 Ų | 32.3 | 3% | 0.031 | 19% | 0.187 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -99.3 | 2.7 | -177.6 | 63.6 | 0 | 0 | 0 | 0 | 114.1 | P150 L153 F156 A272 V279 T284 | P150-T276 HydrophobicContact CB-CG2 3.77Å; P150-T276 HydrophobicContact CG-CG2 3.95Å; L153-T276 HydrophobicContact CD1-CG2 4.28Å; F156-T276 HydrophobicContact CD2-CG2 3.75Å; F156-T276 HydrophobicContact CE2-CG2 3.93Å; A272-T276 WeakPolarHBondContact O-CB 3.48Å; A272-T276 WeakPolarHBondContact O-CG2 3.38Å; A272-T276 PolarHBondContact O-N 3.49Å; A272-T276 VanDerWaalsContact O-N 3.11Å; A272-T276 PolarHBondContact O-OG1 3.5Å; T276-V279 WeakPolarHBondContact O-CB 3.32Å; T276-V279 WeakPolarHBondContact O-CG2 3.42Å; T276-V279 PolarHBondContact O-N 3.25Å; T276-T284 HydrophobicContact CG2-CG2 3.61Å; T276-T284 WeakPolarHBondContact OG1-CG2 3.26Å |
| 277 | Y | 84.9 | Confident | 87 | Confident | 102 Ų | 102 | 31.1 Ų | 31.1 | 40% | 0.4 | 17% | 0.174 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -50.5 | 136.4 | 177 | -174.3 | -94 | 0 | 0 | 0 | 111.3 | A273 R357 C360 | A273-Y277 PolarHBondContact O-N 3.3Å; Y277-R357 HydrophobicContact CD2-CB 4.23Å; Y277-R357 HydrophobicContact CD2-CG 4.26Å; Y277-R357 HydrophobicContact CG-CB 4.05Å; Y277-C360 HydrophobicContact CD1-CB 4.13Å; Y277-C360 HydrophobicContact CE1-CB 3.76Å; Y277-C360 VanDerWaalsContact CE1-SG 3.54Å |
| 278 | P | 84.3 | Confident | 87.1 | Confident | 108 Ų | 108 | 30.9 Ų | 30.9 | 70% | 0.701 | 17% | 0.173 | S | C | * | . | T | Hydrogen-bonded Turn | cis | -94 | 25.8 | 9.3 | 38.6 | -37.1 | 0 | 0 | 0 | 115.4 | ||
| 279 | V | 84.8 | Confident | 87 | Confident | 20 Ų | 20 | 32.9 Ų | 32.9 | 12% | 0.121 | 18% | 0.183 | C | C | . | . | S | Bend | trans | -65.9 | 139.6 | 173.8 | -180 | 0 | 0 | 0 | 0 | 109.8 | P149 P150 T276 E281 I283 T284 | P149-V279 HydrophobicContact CB-CG2 4.04Å; P149-V279 HydrophobicContact CG-CG2 4.22Å; P150-V279 HydrophobicContact CG-CB 4.47Å; P150-V279 HydrophobicContact CG-CG1 4.11Å; P150-V279 HydrophobicContact CG-CG2 4.15Å; T276-V279 WeakPolarHBondContact O-CB 3.32Å; T276-V279 WeakPolarHBondContact O-CG2 3.42Å; T276-V279 PolarHBondContact O-N 3.25Å; V279-E281 PolarHBondContact O-N 3.46Å; V279-I283 HydrophobicContact CG1-CB 3.95Å; V279-I283 HydrophobicContact CG1-CD1 4.25Å; V279-I283 HydrophobicContact CG1-CG2 3.98Å; V279-T284 HydrophobicContact CG1-CG2 4.47Å |
| 280 | S | 80.9 | Confident | 87.1 | Confident | 67 Ų | 67 | 35.9 Ų | 35.9 | 47% | 0.469 | 20% | 0.198 | S | C | . | . | trans | -58.2 | 133.6 | 177 | 179.3 | 0 | 0 | 0 | 0 | 111.5 | A282 I283 T284 | S280-A282 PolarHBondContact O-N 3.17Å; S280-A282 VanDerWaalsContact O-N 3.14Å; S280-A282 PolarHBondContact OG-N 3.38Å; S280-I283 WeakPolarHBondContact O-CB 3.45Å; S280-I283 PolarHBondContact O-N 2.93Å; S280-T284 PolarHBondContact O-N 3.43Å | ||
| 281 | E | 80.7 | Confident | 87.3 | Confident | 103 Ų | 103 | 33.9 Ų | 33.9 | 48% | 0.481 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -54.3 | -30.5 | 175.3 | 179.6 | 178.5 | 170.8 | 0 | 0 | 113.2 | A273 V279 I283 T284 T285 | A273-E281 HydrophobicContact CB-CB 4.29Å; A273-E281 HydrophobicContact CB-CG 4.01Å; V279-E281 PolarHBondContact O-N 3.46Å; E281-I283 VanDerWaalsContact C-N 3.29Å; E281-I283 PolarHBondContact O-N 2.82Å; E281-T284 PolarHBondContact O-OG1 3.17Å; E281-T285 VanDerWaalsContact O-CB 3.27Å; E281-T285 WeakPolarHBondContact O-CB 3.33Å; E281-T285 PolarHBondContact O-N 2.94Å; E281-T285 PolarHBondContact O-OG1 3.04Å |
| 282 | A | 79.6 | Confident | 87.5 | Confident | 46 Ų | 46 | 34.2 Ų | 34.2 | 38% | 0.38 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -63.7 | -36.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | S280 S286 | S280-A282 PolarHBondContact O-N 3.17Å; S280-A282 VanDerWaalsContact O-N 3.14Å; S280-A282 PolarHBondContact OG-N 3.38Å; A282-S286 VanDerWaalsContact O-CB 3.23Å; A282-S286 WeakPolarHBondContact O-CB 3.41Å; A282-S286 PolarHBondContact O-N 3.19Å; A282-S286 PolarHBondContact O-OG 3.34Å |
| 283 | I | 84.8 | Confident | 87.6 | Confident | 13 Ų | 13 | 38.2 Ų | 38.2 | 7% | 0.067 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -71.3 | -46.5 | -178.6 | -65.5 | 176.3 | 0 | 0 | 0 | 110.2 | F143 A146 F147 V279 S280 E281 S286 F287 | F143-I283 HydrophobicContact CD2-CD1 4.17Å; F143-I283 HydrophobicContact CD2-CG1 4.31Å; F143-I283 HydrophobicContact CE2-CD1 4.21Å; F143-I283 HydrophobicContact CE2-CG1 3.83Å; A146-I283 HydrophobicContact CB-CD1 3.48Å; A146-I283 VanDerWaalsContact CB-CD1 3.48Å; F147-I283 HydrophobicContact CD1-CG2 3.94Å; F147-I283 HydrophobicContact CD2-CG2 3.94Å; F147-I283 HydrophobicContact CE1-CG2 3.86Å; F147-I283 HydrophobicContact CE2-CG2 3.83Å; F147-I283 HydrophobicContact CG-CG2 3.98Å; F147-I283 HydrophobicContact CZ-CG2 3.81Å; V279-I283 HydrophobicContact CG1-CB 3.95Å; V279-I283 HydrophobicContact CG1-CD1 4.25Å; V279-I283 HydrophobicContact CG1-CG2 3.98Å; S280-I283 WeakPolarHBondContact O-CB 3.45Å; S280-I283 PolarHBondContact O-N 2.93Å; E281-I283 VanDerWaalsContact C-N 3.29Å; E281-I283 PolarHBondContact O-N 2.82Å; I283-S286 WeakPolarHBondContact O-CB 3.24Å; I283-S286 PolarHBondContact O-N 3.04Å; I283-F287 PolarHBondContact O-N 3.03Å |
| 284 | T | 87.1 | Confident | 87.9 | Confident | 1 Ų | 1 | 42.6 Ų | 42.6 | 1% | 0.006 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -64.9 | -45.5 | 178.3 | 46.7 | 0 | 0 | 0 | 0 | 112.4 | P150 F156 T276 V279 S280 E281 S286 F287 L288 | P150-T284 HydrophobicContact CG-CG2 4.32Å; F156-T284 HydrophobicContact CE2-CG2 4.18Å; T276-T284 HydrophobicContact CG2-CG2 3.61Å; T276-T284 WeakPolarHBondContact OG1-CG2 3.26Å; V279-T284 HydrophobicContact CG1-CG2 4.47Å; S280-T284 PolarHBondContact O-N 3.43Å; E281-T284 PolarHBondContact O-OG1 3.17Å; T284-S286 VanDerWaalsContact C-N 3.3Å; T284-S286 PolarHBondContact O-N 3.29Å; T284-F287 WeakPolarHBondContact O-CB 3.41Å; T284-F287 PolarHBondContact O-N 3.17Å; T284-L288 WeakPolarHBondContact O-CG 3.27Å; T284-L288 PolarHBondContact O-N 3.2Å |
| 285 | T | 87.2 | Confident | 88.2 | Confident | 27 Ų | 27 | 44 Ų | 44 | 17% | 0.166 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -59.1 | -44.7 | 174.9 | -59 | 0 | 0 | 0 | 0 | 110.6 | L269 E281 F287 L288 I289 | L269-T285 HydrophobicContact CD1-CG2 4.31Å; L269-T285 HydrophobicContact CD2-CG2 3.86Å; E281-T285 VanDerWaalsContact O-CB 3.27Å; E281-T285 WeakPolarHBondContact O-CB 3.33Å; E281-T285 PolarHBondContact O-N 2.94Å; E281-T285 PolarHBondContact O-OG1 3.04Å; T285-F287 VanDerWaalsContact C-N 3.32Å; T285-F287 PolarHBondContact O-N 2.71Å; T285-L288 PolarHBondContact O-N 2.84Å; T285-I289 HydrophobicContact CG2-CG1 4.32Å; T285-I289 VanDerWaalsContact O-CG1 3.3Å; T285-I289 WeakPolarHBondContact O-CG1 3.36Å; T285-I289 PolarHBondContact O-N 3.31Å |
| 286 | S | 87.4 | Confident | 88.4 | Confident | 15 Ų | 15 | 44.5 Ų | 44.5 | 11% | 0.105 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -58.8 | -44.5 | 176.3 | -61.9 | 0 | 0 | 0 | 0 | 111.8 | F37 A282 I283 T284 L288 I289 I290 | F37-S286 WeakPolarHBondContact CE1-OG 3.3Å; F37-S286 WeakPolarHBondContact CZ-OG 3.37Å; A282-S286 VanDerWaalsContact O-CB 3.23Å; A282-S286 WeakPolarHBondContact O-CB 3.41Å; A282-S286 PolarHBondContact O-N 3.19Å; A282-S286 PolarHBondContact O-OG 3.34Å; I283-S286 WeakPolarHBondContact O-CB 3.24Å; I283-S286 PolarHBondContact O-N 3.04Å; T284-S286 VanDerWaalsContact C-N 3.3Å; T284-S286 PolarHBondContact O-N 3.29Å; S286-L288 VanDerWaalsContact C-N 3.35Å; S286-L288 PolarHBondContact O-N 3.38Å; S286-I289 PolarHBondContact O-N 3.48Å; S286-I290 WeakPolarHBondContact O-CB 3.38Å; S286-I290 WeakPolarHBondContact O-CD1 3.49Å; S286-I290 WeakPolarHBondContact O-CG1 3.33Å; S286-I290 PolarHBondContact O-N 3.01Å |
| 287 | F | 89.1 | Confident | 88.6 | Confident | 32 Ų | 32 | 50.4 Ų | 50.4 | 14% | 0.14 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -61.4 | -44.3 | 179.5 | -171 | -95.1 | 0 | 0 | 0 | 112 | F147 L151 F156 W157 T160 I283 T284 T285 S291 | F147-F287 AromaticContact CD1-CD2 3.96Å; F147-F287 HydrophobicContact CD1-CD2 3.96Å; F147-F287 HydrophobicContact CE1-CB 4.3Å; F147-F287 HydrophobicContact CE1-CD2 4.26Å; L151-F287 HydrophobicContact CD2-CE1 4.12Å; L151-F287 HydrophobicContact CD2-CE2 3.58Å; L151-F287 HydrophobicContact CD2-CZ 3.32Å; F156-F287 HydrophobicContact CD1-CD1 4.47Å; F156-F287 HydrophobicContact CD1-CE1 4.31Å; F156-F287 AromaticContact CE1-CD1 3.28Å; F156-F287 HydrophobicContact CE1-CD1 3.28Å; F156-F287 AromaticContact CE1-CE1 3.43Å; F156-F287 HydrophobicContact CE1-CE1 3.43Å; F156-F287 VanDerWaalsContact CE1-CE1 3.43Å; F156-F287 HydrophobicContact CE1-CG 4.03Å; F156-F287 HydrophobicContact CE1-CZ 4.33Å; F156-F287 HydrophobicContact CZ-CB 4.23Å; F156-F287 AromaticContact CZ-CD1 3.44Å; F156-F287 HydrophobicContact CZ-CD1 3.44Å; F156-F287 VanDerWaalsContact CZ-CD1 3.44Å; F156-F287 HydrophobicContact CZ-CE1 4.08Å; F156-F287 HydrophobicContact CZ-CG 4.04Å; W157-F287 HydrophobicContact CH2-CZ 4.34Å; W157-F287 HydrophobicContact CZ3-CZ 4.36Å; T160-F287 HydrophobicContact CG2-CD1 3.97Å; T160-F287 HydrophobicContact CG2-CE1 3.62Å; I283-F287 PolarHBondContact O-N 3.03Å; T284-F287 WeakPolarHBondContact O-CB 3.41Å; T284-F287 PolarHBondContact O-N 3.17Å; T285-F287 VanDerWaalsContact C-N 3.32Å; T285-F287 PolarHBondContact O-N 2.71Å; F287-S291 WeakPolarHBondContact O-CB 3.42Å; F287-S291 PolarHBondContact O-N 3.25Å; F287-S291 PolarHBondContact O-OG 3.1Å |
| 288 | L | 91.8 | Very high | 89.1 | Confident | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -62.7 | -45.4 | 176.9 | -71.8 | 179.4 | 0 | 0 | 0 | 111.9 | T160 F163 S164 L269 A272 T284 T285 S286 S291 N292 | T160-L288 HydrophobicContact CG2-CD2 4.19Å; F163-L288 HydrophobicContact CB-CD2 4.47Å; F163-L288 HydrophobicContact CD1-CB 3.81Å; F163-L288 HydrophobicContact CD1-CD2 4.05Å; F163-L288 HydrophobicContact CD1-CG 4.37Å; F163-L288 HydrophobicContact CE1-CB 3.52Å; F163-L288 HydrophobicContact CE1-CG 4.43Å; F163-L288 HydrophobicContact CG-CD2 4.35Å; F163-L288 HydrophobicContact CZ-CB 4.1Å; S164-L288 PolarHBondContact OG-O 2.88Å; L269-L288 HydrophobicContact CD2-CD1 3.7Å; A272-L288 HydrophobicContact CB-CD1 3.69Å; T284-L288 WeakPolarHBondContact O-CG 3.27Å; T284-L288 PolarHBondContact O-N 3.2Å; T285-L288 PolarHBondContact O-N 2.84Å; S286-L288 VanDerWaalsContact C-N 3.35Å; S286-L288 PolarHBondContact O-N 3.38Å; L288-S291 PolarHBondContact O-N 2.96Å; L288-N292 WeakPolarHBondContact O-CB 3.02Å; L288-N292 PolarHBondContact O-N 3.35Å |
| 289 | I | 90.6 | Very high | 89.6 | Confident | 42 Ų | 42 | 45.4 Ų | 45.4 | 22% | 0.215 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -67.9 | -41 | 179.2 | -63.5 | -62.2 | 0 | 0 | 0 | 111.9 | F163 F265 T285 S286 S291 N292 Q293 | F163-I289 HydrophobicContact CE1-CD1 4.45Å; F163-I289 HydrophobicContact CZ-CD1 4.32Å; F265-I289 HydrophobicContact CE2-CD1 3.88Å; F265-I289 HydrophobicContact CZ-CD1 4.41Å; T285-I289 HydrophobicContact CG2-CG1 4.32Å; T285-I289 VanDerWaalsContact O-CG1 3.3Å; T285-I289 WeakPolarHBondContact O-CG1 3.36Å; T285-I289 PolarHBondContact O-N 3.31Å; S286-I289 PolarHBondContact O-N 3.48Å; I289-S291 VanDerWaalsContact C-N 3.33Å; I289-S291 PolarHBondContact O-N 3.3Å; I289-N292 WeakPolarHBondContact O-CB 3.42Å; I289-N292 PolarHBondContact O-N 2.99Å; I289-Q293 WeakPolarHBondContact O-CG 3.35Å; I289-Q293 PolarHBondContact O-N 2.99Å |
| 290 | I | 91.5 | Very high | 90 | Very high | 91 Ų | 91 | 46.7 Ų | 46.7 | 47% | 0.467 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -61.5 | -45.7 | 175.8 | -70.6 | 165.1 | 0 | 0 | 0 | 110.1 | S286 N292 Q293 I294 | S286-I290 WeakPolarHBondContact O-CB 3.38Å; S286-I290 WeakPolarHBondContact O-CD1 3.49Å; S286-I290 WeakPolarHBondContact O-CG1 3.33Å; S286-I290 PolarHBondContact O-N 3.01Å; I290-N292 VanDerWaalsContact C-N 3.31Å; I290-N292 PolarHBondContact O-N 3.39Å; I290-Q293 PolarHBondContact O-N 3.29Å; I290-I294 HydrophobicContact CG2-CD1 4.03Å; I290-I294 WeakPolarHBondContact O-CG1 3.48Å; I290-I294 PolarHBondContact O-N 3.48Å |
| 291 | S | 93.6 | Very high | 90.6 | Very high | 21 Ų | 21 | 46.4 Ų | 46.4 | 15% | 0.147 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -61.1 | -41.7 | 177.9 | -59.8 | 0 | 0 | 0 | 0 | 111.4 | T160 S164 F287 L288 I289 I294 I295 | T160-S291 VanDerWaalsContact CG2-CB 3.43Å; T160-S291 VanDerWaalsContact CG2-OG 3.24Å; T160-S291 WeakPolarHBondContact CG2-OG 3.48Å; S164-S291 WeakPolarHBondContact OG-CB 3.49Å; F287-S291 WeakPolarHBondContact O-CB 3.42Å; F287-S291 PolarHBondContact O-N 3.25Å; F287-S291 PolarHBondContact O-OG 3.1Å; L288-S291 PolarHBondContact O-N 2.96Å; I289-S291 VanDerWaalsContact C-N 3.33Å; I289-S291 PolarHBondContact O-N 3.3Å; S291-I294 PolarHBondContact O-N 3.16Å; S291-I295 WeakPolarHBondContact O-CG1 3.38Å; S291-I295 PolarHBondContact O-N 2.83Å |
| 292 | N | 93.9 | Very high | 91.2 | Very high | 6 Ų | 6 | 45.3 Ų | 45.3 | 3% | 0.032 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -57 | -51.6 | 172.1 | 170.8 | 62 | 0 | 0 | 0 | 111.9 | S164 I167 G168 L288 I289 I290 I294 I295 S296 | S164-N292 PolarHBondContact O-OD1 3.13Å; S164-N292 PolarHBondContact OG-N 3.11Å; S164-N292 VanDerWaalsContact OG-N 3.12Å; I167-N292 VanDerWaalsContact C-OD1 3.27Å; I167-N292 VanDerWaalsContact CB-OD1 3.23Å; I167-N292 WeakPolarHBondContact CB-OD1 3.33Å; I167-N292 WeakPolarHBondContact CG2-OD1 3.39Å; G168-N292 PolarHBondContact N-OD1 3.31Å; L288-N292 WeakPolarHBondContact O-CB 3.02Å; L288-N292 PolarHBondContact O-N 3.35Å; I289-N292 WeakPolarHBondContact O-CB 3.42Å; I289-N292 PolarHBondContact O-N 2.99Å; I290-N292 VanDerWaalsContact C-N 3.31Å; I290-N292 PolarHBondContact O-N 3.39Å; N292-I294 VanDerWaalsContact C-N 3.27Å; N292-I294 PolarHBondContact O-N 3.36Å; N292-I295 PolarHBondContact O-N 3.05Å; N292-I295 VanDerWaalsContact O-N 3.11Å; N292-S296 PolarHBondContact O-N 2.86Å; N292-S296 PolarHBondContact O-OG 3.44Å |
| 293 | Q | 92.9 | Very high | 91.8 | Very high | 85 Ų | 85 | 43.4 Ų | 43.4 | 40% | 0.397 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -59.5 | -38.2 | -178.8 | -68.1 | -62.1 | 103 | 0 | 0 | 112.3 | I289 I290 L297 | I289-Q293 WeakPolarHBondContact O-CG 3.35Å; I289-Q293 PolarHBondContact O-N 2.99Å; I290-Q293 PolarHBondContact O-N 3.29Å; Q293-L297 VanDerWaalsContact O-CB 3.24Å; Q293-L297 WeakPolarHBondContact O-CB 3.33Å; Q293-L297 PolarHBondContact O-N 2.6Å |
| 294 | I | 94.4 | Very high | 92.1 | Very high | 101 Ų | 101 | 46.4 Ų | 46.4 | 52% | 0.518 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -64.7 | -47.5 | 175.4 | -66.2 | 167.9 | 0 | 0 | 0 | 110.5 | I290 S291 N292 L297 V298 | I290-I294 HydrophobicContact CG2-CD1 4.03Å; I290-I294 WeakPolarHBondContact O-CG1 3.48Å; I290-I294 PolarHBondContact O-N 3.48Å; S291-I294 PolarHBondContact O-N 3.16Å; N292-I294 VanDerWaalsContact C-N 3.27Å; N292-I294 PolarHBondContact O-N 3.36Å; I294-L297 WeakPolarHBondContact O-CB 3.32Å; I294-L297 PolarHBondContact O-N 3.43Å; I294-V298 WeakPolarHBondContact O-CG2 3.21Å; I294-V298 PolarHBondContact O-N 3.35Å; I294-V298 VanDerWaalsContact O-N 3.13Å |
| 295 | I | 94.4 | Very high | 92.3 | Very high | 39 Ų | 39 | 54.7 Ų | 54.7 | 20% | 0.2 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -65 | -43.3 | 179.4 | -66.7 | -171.1 | 0 | 0 | 0 | 111.1 | S164 S291 N292 L297 V298 M299 | S164-I295 VanDerWaalsContact CB-CD1 3.42Å; S291-I295 WeakPolarHBondContact O-CG1 3.38Å; S291-I295 PolarHBondContact O-N 2.83Å; N292-I295 PolarHBondContact O-N 3.05Å; N292-I295 VanDerWaalsContact O-N 3.11Å; I295-L297 VanDerWaalsContact C-N 3.3Å; I295-L297 PolarHBondContact O-N 3.2Å; I295-V298 PolarHBondContact O-N 3.29Å; I295-V298 VanDerWaalsContact O-N 3.16Å; I295-M299 HydrophobicContact CG2-CE 3.47Å; I295-M299 VanDerWaalsContact CG2-CE 3.47Å; I295-M299 HydrophobicContact CG2-CG 3.87Å; I295-M299 HydrophobicContact CG2-SD 3.55Å; I295-M299 VanDerWaalsContact CG2-SD 3.55Å; I295-M299 WeakPolarHBondContact O-CB 3.45Å; I295-M299 WeakPolarHBondContact O-CG 3.26Å; I295-M299 PolarHBondContact O-N 3.31Å |
| 296 | S | 94 | Very high | 92.4 | Very high | 11 Ų | 11 | 56.9 Ų | 56.9 | 8% | 0.077 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -57.6 | -42.9 | 173.7 | -56.9 | 0 | 0 | 0 | 0 | 112.2 | G168 N292 V298 M299 L300 | G168-S296 WeakPolarHBondContact CA-OG 3.46Å; N292-S296 PolarHBondContact O-N 2.86Å; N292-S296 PolarHBondContact O-OG 3.44Å; S296-V298 PolarHBondContact O-N 3.07Å; S296-M299 PolarHBondContact O-N 3.3Å; S296-L300 WeakPolarHBondContact O-CB 3.32Å; S296-L300 PolarHBondContact O-N 3.2Å |
| 297 | L | 93.4 | Very high | 92.5 | Very high | 128 Ų | 128 | 56.4 Ų | 56.4 | 67% | 0.67 | 30% | 0.298 | S | S | * | . | H | α-helix | trans | -64 | -29.4 | 179.2 | -179.8 | 64.1 | 0 | 0 | 0 | 112.3 | Q293 I294 I295 P301 | Q293-L297 VanDerWaalsContact O-CB 3.24Å; Q293-L297 WeakPolarHBondContact O-CB 3.33Å; Q293-L297 PolarHBondContact O-N 2.6Å; I294-L297 WeakPolarHBondContact O-CB 3.32Å; I294-L297 PolarHBondContact O-N 3.43Å; I295-L297 VanDerWaalsContact C-N 3.3Å; I295-L297 PolarHBondContact O-N 3.2Å; L297-P301 WeakPolarHBondContact O-CD 3.18Å; L297-P301 VanDerWaalsContact O-CG 3.25Å; L297-P301 WeakPolarHBondContact O-CG 3.47Å |
| 298 | V | 94.6 | Very high | 92.4 | Very high | 90 Ų | 90 | 58.1 Ų | 58.1 | 55% | 0.545 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -85.2 | -46.3 | 175.4 | 175.6 | 0 | 0 | 0 | 0 | 111.3 | I294 I295 S296 L300 P301 V302 | I294-V298 WeakPolarHBondContact O-CG2 3.21Å; I294-V298 PolarHBondContact O-N 3.35Å; I294-V298 VanDerWaalsContact O-N 3.13Å; I295-V298 PolarHBondContact O-N 3.29Å; I295-V298 VanDerWaalsContact O-N 3.16Å; S296-V298 PolarHBondContact O-N 3.07Å; V298-L300 PolarHBondContact O-N 3.03Å; V298-P301 WeakPolarHBondContact O-CD 3.48Å; V298-V302 HydrophobicContact CG1-CG2 4.19Å; V298-V302 WeakPolarHBondContact O-CB 3.21Å; V298-V302 WeakPolarHBondContact O-CG2 2.96Å; V298-V302 PolarHBondContact O-N 2.95Å |
| 299 | M | 94 | Very high | 92 | Very high | 15 Ų | 15 | 62.8 Ų | 62.8 | 7% | 0.074 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -64.1 | -39.1 | -176.3 | -74.4 | -178 | 168.9 | 0 | 0 | 112.6 | V172 I295 S296 V302 L303 L336 F339 M340 | V172-M299 HydrophobicContact CG2-CB 3.72Å; I295-M299 HydrophobicContact CG2-CE 3.47Å; I295-M299 VanDerWaalsContact CG2-CE 3.47Å; I295-M299 HydrophobicContact CG2-CG 3.87Å; I295-M299 HydrophobicContact CG2-SD 3.55Å; I295-M299 VanDerWaalsContact CG2-SD 3.55Å; I295-M299 WeakPolarHBondContact O-CB 3.45Å; I295-M299 WeakPolarHBondContact O-CG 3.26Å; I295-M299 PolarHBondContact O-N 3.31Å; S296-M299 PolarHBondContact O-N 3.3Å; M299-V302 PolarHBondContact O-N 3.13Å; M299-L303 WeakPolarHBondContact O-CB 3.4Å; M299-L303 PolarHBondContact O-N 3.26Å; M299-L336 HydrophobicContact CE-CD1 3.93Å; M299-L336 HydrophobicContact CG-CD1 4.16Å; M299-L336 HydrophobicContact SD-CD1 3.96Å; M299-F339 HydrophobicContact CE-CD1 3.9Å; M299-F339 HydrophobicContact CE-CE1 3.59Å; M299-M340 HydrophobicContact CE-SD 4.46Å |
| 300 | L | 94.3 | Very high | 91.3 | Very high | 48 Ų | 48 | 62.2 Ų | 62.2 | 25% | 0.251 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -63 | -55.1 | -177 | -173.4 | 160.8 | 0 | 0 | 0 | 112 | V172 A175 L176 S296 V298 V302 L303 Q304 | V172-L300 HydrophobicContact CG2-CB 3.96Å; A175-L300 HydrophobicContact CB-CD1 4.04Å; L176-L300 HydrophobicContact CD1-CG 4.48Å; S296-L300 WeakPolarHBondContact O-CB 3.32Å; S296-L300 PolarHBondContact O-N 3.2Å; V298-L300 PolarHBondContact O-N 3.03Å; L300-V302 VanDerWaalsContact C-N 3.34Å; L300-V302 PolarHBondContact O-N 3.38Å; L300-L303 PolarHBondContact O-N 2.88Å; L300-Q304 HydrophobicContact CD2-CG 4.36Å; L300-Q304 WeakPolarHBondContact O-CG 3.48Å; L300-Q304 PolarHBondContact O-N 3.45Å; L300-Q304 VanDerWaalsContact O-N 3.11Å |
| 301 | P | 92.7 | Very high | 90.2 | Very high | 61 Ų | 61 | 63.4 Ų | 63.4 | 40% | 0.396 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -66.6 | -33.9 | 177.8 | -21.3 | 35.1 | 0 | 0 | 0 | 112.9 | L297 V298 L303 Q304 F305 | L297-P301 WeakPolarHBondContact O-CD 3.18Å; L297-P301 VanDerWaalsContact O-CG 3.25Å; L297-P301 WeakPolarHBondContact O-CG 3.47Å; V298-P301 WeakPolarHBondContact O-CD 3.48Å; P301-L303 VanDerWaalsContact C-N 3.32Å; P301-L303 PolarHBondContact O-N 3.29Å; P301-Q304 PolarHBondContact O-N 3.12Å; P301-F305 WeakPolarHBondContact O-CB 3.41Å; P301-F305 PolarHBondContact O-N 3.42Å |
| 302 | V | 93.4 | Very high | 88.5 | Confident | 80 Ų | 80 | 70.4 Ų | 70.4 | 49% | 0.485 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -59.5 | -46 | 174.9 | 167.9 | 0 | 0 | 0 | 0 | 110.3 | V298 M299 L300 Q304 F305 T306 | V298-V302 HydrophobicContact CG1-CG2 4.19Å; V298-V302 WeakPolarHBondContact O-CB 3.21Å; V298-V302 WeakPolarHBondContact O-CG2 2.96Å; V298-V302 PolarHBondContact O-N 2.95Å; M299-V302 PolarHBondContact O-N 3.13Å; L300-V302 VanDerWaalsContact C-N 3.34Å; L300-V302 PolarHBondContact O-N 3.38Å; V302-Q304 VanDerWaalsContact C-N 3.35Å; V302-Q304 PolarHBondContact O-N 3.29Å; V302-F305 PolarHBondContact O-N 3.37Å; V302-T306 HydrophobicContact CG1-CG2 4.39Å; V302-T306 WeakPolarHBondContact O-CB 3.21Å; V302-T306 VanDerWaalsContact O-CG2 3.31Å; V302-T306 WeakPolarHBondContact O-CG2 3.23Å; V302-T306 PolarHBondContact O-N 3.01Å; V302-T306 PolarHBondContact O-OG1 3.48Å |
| 303 | L | 92.8 | Very high | 86.4 | Confident | 6 Ų | 6 | 75.2 Ų | 75.2 | 3% | 0.031 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -62.8 | -42 | 177.6 | -160.9 | 80.5 | 0 | 0 | 0 | 111.6 | V172 L176 M299 L300 P301 T306 A307 F329 P332 L336 | V172-L303 HydrophobicContact CG1-CB 4.42Å; V172-L303 HydrophobicContact CG1-CD2 3.77Å; L176-L303 HydrophobicContact CD1-CB 4.49Å; L176-L303 HydrophobicContact CD1-CD2 3.69Å; M299-L303 WeakPolarHBondContact O-CB 3.4Å; M299-L303 PolarHBondContact O-N 3.26Å; L300-L303 PolarHBondContact O-N 2.88Å; P301-L303 VanDerWaalsContact C-N 3.32Å; P301-L303 PolarHBondContact O-N 3.29Å; L303-T306 PolarHBondContact O-OG1 2.84Å; L303-A307 WeakPolarHBondContact O-CB 3.33Å; L303-A307 PolarHBondContact O-N 3.37Å; L303-F329 HydrophobicContact CD2-CD1 3.91Å; L303-F329 HydrophobicContact CD2-CE1 4.47Å; L303-F329 HydrophobicContact CG-CD1 4.01Å; L303-P332 VanDerWaalsContact CD1-C 3.49Å; L303-P332 HydrophobicContact CD1-CB 3.41Å; L303-P332 VanDerWaalsContact CD1-CB 3.41Å; L303-P332 HydrophobicContact CG-CB 3.94Å; L303-L336 HydrophobicContact CD1-CB 4.42Å; L303-L336 HydrophobicContact CD1-CD2 4.24Å |
| 304 | Q | 91.2 | Very high | 84.6 | Confident | 75 Ų | 75 | 74.8 Ų | 74.8 | 35% | 0.35 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -68.2 | -41.5 | 178.2 | -70.4 | 179.3 | -34.4 | 0 | 0 | 113 | L176 L300 P301 V302 A307 R327 F329 | L176-Q304 HydrophobicContact CD1-CG 4.11Å; L176-Q304 HydrophobicContact CD2-CG 4.41Å; L300-Q304 HydrophobicContact CD2-CG 4.36Å; L300-Q304 WeakPolarHBondContact O-CG 3.48Å; L300-Q304 PolarHBondContact O-N 3.45Å; L300-Q304 VanDerWaalsContact O-N 3.11Å; P301-Q304 PolarHBondContact O-N 3.12Å; V302-Q304 VanDerWaalsContact C-N 3.35Å; V302-Q304 PolarHBondContact O-N 3.29Å; Q304-A307 PolarHBondContact O-N 2.96Å; Q304-R327 PolarHBondContact O-NH1 3.36Å; Q304-F329 HydrophobicContact CG-CE1 4.33Å |
| 305 | F | 90.2 | Very high | 82.8 | Confident | 175 Ų | 175 | 79.7 Ų | 79.7 | 77% | 0.768 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -70.2 | -39.3 | -177.9 | -177.9 | -96.3 | 0 | 0 | 0 | 112 | P301 V302 A307 | P301-F305 WeakPolarHBondContact O-CB 3.41Å; P301-F305 PolarHBondContact O-N 3.42Å; V302-F305 PolarHBondContact O-N 3.37Å; F305-A307 VanDerWaalsContact C-N 3.29Å |
| 306 | T | 91 | Very high | 81.3 | Confident | 73 Ų | 73 | 80 Ų | 80 | 45% | 0.448 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -78 | -13 | 178.6 | 55.9 | 0 | 0 | 0 | 0 | 113.4 | V302 L303 P308 P332 | V302-T306 HydrophobicContact CG1-CG2 4.39Å; V302-T306 WeakPolarHBondContact O-CB 3.21Å; V302-T306 VanDerWaalsContact O-CG2 3.31Å; V302-T306 WeakPolarHBondContact O-CG2 3.23Å; V302-T306 PolarHBondContact O-N 3.01Å; V302-T306 PolarHBondContact O-OG1 3.48Å; L303-T306 PolarHBondContact O-OG1 2.84Å; T306-P308 VanDerWaalsContact O-CD 3.29Å; T306-P308 WeakPolarHBondContact O-CD 3.49Å; T306-P332 WeakPolarHBondContact OG1-CB 3.36Å |
| 307 | A | 88.9 | Confident | 80.1 | Confident | 5 Ų | 5 | 86.9 Ų | 86.9 | 4% | 0.041 | 48% | 0.475 | C | S | . | . | trans | -71.4 | 115.8 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | L303 Q304 F305 R327 F329 P332 | L303-A307 WeakPolarHBondContact O-CB 3.33Å; L303-A307 PolarHBondContact O-N 3.37Å; Q304-A307 PolarHBondContact O-N 2.96Å; F305-A307 VanDerWaalsContact C-N 3.29Å; A307-R327 HydrophobicContact CB-CB 3.87Å; A307-F329 HydrophobicContact CB-CD1 3.93Å; A307-F329 HydrophobicContact CB-CE1 3.93Å; A307-F329 HydrophobicContact CB-CG 4.45Å; A307-F329 HydrophobicContact CB-CZ 4.43Å; A307-P332 VanDerWaalsContact CA-CG 3.43Å; A307-P332 HydrophobicContact CB-CG 3.87Å | ||
| 308 | P | 86.8 | Confident | 79.1 | Confident | 68 Ų | 68 | 82.8 Ų | 82.8 | 44% | 0.442 | 46% | 0.458 | S | S | . | . | P | Polyproline II helix | trans | -66.9 | 157.7 | 175.3 | 29.1 | -36.5 | 0 | 0 | 0 | 111.3 | T306 A310 R327 D328 | T306-P308 VanDerWaalsContact O-CD 3.29Å; T306-P308 WeakPolarHBondContact O-CD 3.49Å; P308-A310 PolarHBondContact O-N 2.77Å; P308-R327 CarbonylContact O-C 3.59Å; P308-R327 VanDerWaalsContact O-CA 3.27Å; P308-R327 WeakPolarHBondContact O-CA 3.39Å; P308-D328 WeakPolarHBondContact CD-O 3.28Å; P308-D328 PolarHBondContact O-N 2.88Å |
| 309 | L | 83.2 | Confident | 78.3 | Confident | 98 Ų | 98 | 81.3 Ų | 81.3 | 51% | 0.513 | 45% | 0.449 | S | S | . | . | B | Isolated β-bridge | trans | -59.6 | 135.4 | 166.8 | -71.1 | 165.8 | 0 | 0 | 0 | 109 | N311 D325 | L309-N311 PolarHBondContact O-N 2.93Å; L309-D325 HydrophobicContact CD2-CB 4.01Å |
| 310 | A | 75.5 | Confident | 77.6 | Confident | 30 Ų | 30 | 81.9 Ų | 81.9 | 25% | 0.248 | 45% | 0.454 | C | S | . | . | P | Polyproline II helix | trans | -65 | 125.5 | 174 | 0 | 0 | 0 | 0 | 0 | 108.2 | P308 N312 I326 | P308-A310 PolarHBondContact O-N 2.77Å; A310-N312 PolarHBondContact O-N 3.46Å; A310-I326 HydrophobicContact CB-CB 4.15Å; A310-I326 HydrophobicContact CB-CG2 3.85Å; A310-I326 WeakPolarHBondContact CB-O 3.36Å; A310-I326 PolarHBondContact N-O 3.07Å |
| 311 | N | 68 | Low | 76.5 | Confident | 116 Ų | 116 | 81.8 Ų | 81.8 | 62% | 0.62 | 47% | 0.465 | S | S | * | . | P | Polyproline II helix | trans | -70.2 | 122.7 | 177 | -73.5 | -14.4 | 0 | 0 | 0 | 109.3 | L309 S313 T314 | L309-N311 PolarHBondContact O-N 2.93Å; N311-S313 PolarHBondContact O-N 2.86Å; N311-T314 PolarHBondContact O-N 3.43Å; N311-T314 PolarHBondContact O-OG1 3.43Å |
| 312 | N | 58.3 | Low | 75.1 | Confident | 169 Ų | 169 | 85.4 Ų | 85.4 | 90% | 0.904 | 49% | 0.488 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.6 | -9 | 173.8 | -74.6 | -10.7 | 0 | 0 | 0 | 114.1 | A310 T314 | A310-N312 PolarHBondContact O-N 3.46Å; N312-T314 VanDerWaalsContact C-N 3.29Å; N312-T314 PolarHBondContact O-N 2.89Å |
| 313 | S | 51.5 | Low | 73.6 | Confident | 106 Ų | 106 | 87.5 Ų | 87.5 | 74% | 0.741 | 50% | 0.496 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.3 | -2.9 | 178.5 | 62.1 | 0 | 0 | 0 | 0 | 114.3 | N311 | N311-S313 PolarHBondContact O-N 2.86Š|
| 314 | T | 54.4 | Low | 71.9 | Confident | 77 Ų | 77 | 96.4 Ų | 96.4 | 47% | 0.472 | 54% | 0.538 | S | S | . | . | S | Bend | trans | -76.7 | 133.6 | 174.1 | 55.1 | 0 | 0 | 0 | 0 | 110.3 | N311 N312 I316 | N311-T314 PolarHBondContact O-N 3.43Å; N311-T314 PolarHBondContact O-OG1 3.43Å; N312-T314 VanDerWaalsContact C-N 3.29Å; N312-T314 PolarHBondContact O-N 2.89Å; T314-I316 PolarHBondContact O-N 3Å |
| 315 | E | 56.7 | Low | 71 | Confident | 204 Ų | 204 | 98.1 Ų | 98.1 | 95% | 0.953 | 55% | 0.549 | S | S | * | . | S | Bend | trans | -54.7 | -5.3 | 173.9 | -71.8 | 179.2 | 150.3 | 0 | 0 | 114.9 | ||
| 316 | I | 62.7 | Low | 70.5 | Confident | 46 Ų | 46 | 91.3 Ų | 91.3 | 24% | 0.236 | 52% | 0.521 | C | S | . | . | trans | -91.9 | 120.4 | -174.7 | -49.2 | 171.1 | 0 | 0 | 0 | 109.7 | H244 T314 S318 | H244-I316 WeakPolarHBondContact CD2-CD1 3.31Å; H244-I316 WeakPolarHBondContact NE2-CD1 3.27Å; T314-I316 PolarHBondContact O-N 3Å; I316-S318 PolarHBondContact O-N 3.27Å; I316-S318 VanDerWaalsContact O-N 3.15Å | ||
| 317 | I | 68.3 | Low | 70.2 | Confident | 154 Ų | 154 | 92.5 Ų | 92.5 | 79% | 0.79 | 52% | 0.517 | S | S | * | . | trans | -72.7 | 106.1 | 165 | -56.5 | 171.8 | 0 | 0 | 0 | 107.2 | T319 | I317-T319 PolarHBondContact O-N 3.4Š| ||
| 318 | S | 71.6 | Confident | 70.1 | Confident | 43 Ų | 43 | 94.2 Ų | 94.2 | 30% | 0.301 | 53% | 0.526 | S | S | . | . | trans | -58 | 133.3 | 172.1 | 58.8 | 0 | 0 | 0 | 0 | 109.9 | I316 I326 | I316-S318 PolarHBondContact O-N 3.27Å; I316-S318 VanDerWaalsContact O-N 3.15Å; S318-I326 WeakPolarHBondContact OG-CD1 3.31Å | ||
| 319 | T | 79.2 | Confident | 70.2 | Confident | 59 Ų | 59 | 91.6 Ų | 91.6 | 36% | 0.362 | 51% | 0.507 | S | S | . | . | trans | -87 | 4.4 | 173.9 | 49 | 0 | 0 | 0 | 0 | 112.3 | C182 G185 Y186 I317 | C182-T319 WeakPolarHBondContact CA-OG1 3.32Å; C182-T319 PolarHBondContact O-N 3.38Å; C182-T319 VanDerWaalsContact O-N 3.14Å; C182-T319 PolarHBondContact O-OG1 3.08Å; G185-T319 WeakPolarHBondContact O-CG2 3.39Å; Y186-T319 PolarHBondContact O-OG1 3.38Å; I317-T319 PolarHBondContact O-N 3.4Å | ||
| 320 | C | 79.8 | Confident | 70.4 | Confident | 27 Ų | 27 | 87 Ų | 87 | 18% | 0.182 | 48% | 0.483 | C | S | . | . | S | Bend | trans | -60.2 | 153.3 | 176.4 | -54 | 0 | 0 | 0 | 0 | 110.3 | C182 T183 I326 | C182-C320 HydrophobicContact CB-CB 3.98Å; C182-C320 WeakPolarHBondContact CB-SG 3.49Å; C182-C320 VanDerWaalsContact SG-CA 3.55Å; C182-C320 WeakPolarHBondContact SG-CB 3.46Å; C182-C320 CovalentContact SG-SG 2.05Å; C182-C320 PolarHBondContact SG-SG 3.43Å; T183-C320 PolarHBondContact N-SG 2.84Å; T183-C320 VanDerWaalsContact N-SG 3.36Å; C320-I326 HydrophobicContact CB-CD1 4.01Å; C320-I326 HydrophobicContact CB-CG1 4.24Å |
| 321 | G | 70.1 | Confident | 71.1 | Confident | 46 Ų | 46 | 87.9 Ų | 87.9 | 47% | 0.474 | 49% | 0.491 | S | S | . | . | trans | -57.7 | 177.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | N323 | G321-N323 PolarHBondContact O-N 3.36Š| ||
| 322 | P | 62.7 | Low | 72.2 | Confident | 137 Ų | 137 | 83 Ų | 83 | 89% | 0.89 | 47% | 0.465 | S | S | * | . | S | Bend | trans | -69.4 | 22.8 | -169.8 | 30.8 | -37.6 | 0 | 0 | 0 | 115.5 | ||
| 323 | N | 62.6 | Low | 73.8 | Confident | 123 Ų | 123 | 75 Ų | 75 | 66% | 0.658 | 42% | 0.422 | S | S | * | . | trans | -75.3 | 130.8 | 178.2 | -66 | -15.5 | 0 | 0 | 0 | 110 | G321 D325 I326 | G321-N323 PolarHBondContact O-N 3.36Å; N323-D325 VanDerWaalsContact C-N 3.28Å; N323-D325 PolarHBondContact O-N 3.49Å; N323-I326 WeakPolarHBondContact O-CG1 3.44Å | ||
| 324 | E | 57.7 | Low | 75.8 | Confident | 193 Ų | 193 | 73.8 Ų | 73.8 | 90% | 0.902 | 41% | 0.406 | S | S | * | . | S | Bend | trans | -67.1 | -28.7 | 175.7 | -69 | 176.1 | 170.7 | 0 | 0 | 112.2 | I326 | E324-I326 PolarHBondContact O-N 2.96Š|
| 325 | D | 71.4 | Confident | 77.6 | Confident | 111 Ų | 111 | 72.3 Ų | 72.3 | 59% | 0.594 | 41% | 0.406 | S | S | * | . | trans | -94.5 | 61.3 | -176.9 | -64.8 | -29.3 | 0 | 0 | 0 | 113.1 | L309 N323 R327 | L309-D325 HydrophobicContact CD2-CB 4.01Å; N323-D325 VanDerWaalsContact C-N 3.28Å; N323-D325 PolarHBondContact O-N 3.49Å; D325-R327 PolarHBondContact O-N 3.36Å | ||
| 326 | I | 79.8 | Confident | 79.3 | Confident | 33 Ų | 33 | 63.5 Ų | 63.5 | 17% | 0.169 | 37% | 0.366 | C | S | . | . | trans | -68.7 | 127.1 | 172.3 | -57.6 | 179.3 | 0 | 0 | 0 | 108.2 | T183 A310 S318 C320 N323 E324 | T183-I326 HydrophobicContact CG2-CG2 3.57Å; A310-I326 HydrophobicContact CB-CB 4.15Å; A310-I326 HydrophobicContact CB-CG2 3.85Å; A310-I326 WeakPolarHBondContact CB-O 3.36Å; A310-I326 PolarHBondContact N-O 3.07Å; S318-I326 WeakPolarHBondContact OG-CD1 3.31Å; C320-I326 HydrophobicContact CB-CD1 4.01Å; C320-I326 HydrophobicContact CB-CG1 4.24Å; N323-I326 WeakPolarHBondContact O-CG1 3.44Å; E324-I326 PolarHBondContact O-N 2.96Å | ||
| 327 | R | 84.9 | Confident | 80.8 | Confident | 97 Ų | 97 | 61.5 Ų | 61.5 | 37% | 0.366 | 36% | 0.356 | S | S | . | . | B | Isolated β-bridge | trans | -111 | 133.1 | -178.6 | -64.7 | -171.4 | -179.1 | -133.8 | -7.3 | 111.7 | T183 Q304 A307 P308 D325 F329 | T183-R327 WeakPolarHBondContact CG2-O 3.29Å; Q304-R327 PolarHBondContact O-NH1 3.36Å; A307-R327 HydrophobicContact CB-CB 3.87Å; P308-R327 CarbonylContact O-C 3.59Å; P308-R327 VanDerWaalsContact O-CA 3.27Å; P308-R327 WeakPolarHBondContact O-CA 3.39Å; D325-R327 PolarHBondContact O-N 3.36Å; R327-F329 HydrophobicContact CB-CE2 4.16Å; R327-F329 HydrophobicContact CB-CZ 4.33Å; R327-F329 VanDerWaalsContact O-CD2 3.25Å; R327-F329 WeakPolarHBondContact O-CD2 3.19Å; R327-F329 WeakPolarHBondContact O-CE2 3.31Å |
| 328 | D | 86.4 | Confident | 82 | Confident | 42 Ų | 42 | 57.2 Ų | 57.2 | 23% | 0.225 | 34% | 0.343 | C | S | . | . | trans | -85.9 | 123.1 | 174 | -168 | 0.1 | 0 | 0 | 0 | 111 | K184 P308 S330 | K184-D328 VanDerWaalsContact NZ-CG 3.3Å; K184-D328 IonicContact NZ-OD1 2.82Å; K184-D328 PolarHBondContact NZ-OD1 3.1Å; K184-D328 IonicContact NZ-OD2 3.48Å; K184-D328 PolarHBondContact NZ-OD2 2.87Å; P308-D328 WeakPolarHBondContact CD-O 3.28Å; P308-D328 PolarHBondContact O-N 2.88Å; D328-S330 PolarHBondContact OD1-N 2.78Å; D328-S330 PolarHBondContact OD1-OG 3.45Å | ||
| 329 | F | 89.5 | Confident | 83.1 | Confident | 12 Ų | 12 | 59.4 Ų | 59.4 | 5% | 0.053 | 35% | 0.347 | C | S | . | . | trans | -94.5 | -4.9 | -177.5 | -68.8 | -86.7 | 0 | 0 | 0 | 113.3 | L176 Q179 I180 L303 Q304 A307 R327 A331 P332 H333 | L176-F329 HydrophobicContact CD1-CE1 4.15Å; Q179-F329 HydrophobicContact CB-CE2 3.84Å; Q179-F329 HydrophobicContact CB-CZ 4.4Å; I180-F329 HydrophobicContact CG1-CB 3.75Å; I180-F329 HydrophobicContact CG1-CD2 4.11Å; I180-F329 HydrophobicContact CG1-CG 3.9Å; L303-F329 HydrophobicContact CD2-CD1 3.91Å; L303-F329 HydrophobicContact CD2-CE1 4.47Å; L303-F329 HydrophobicContact CG-CD1 4.01Å; Q304-F329 HydrophobicContact CG-CE1 4.33Å; A307-F329 HydrophobicContact CB-CD1 3.93Å; A307-F329 HydrophobicContact CB-CE1 3.93Å; A307-F329 HydrophobicContact CB-CG 4.45Å; A307-F329 HydrophobicContact CB-CZ 4.43Å; R327-F329 HydrophobicContact CB-CE2 4.16Å; R327-F329 HydrophobicContact CB-CZ 4.33Å; R327-F329 VanDerWaalsContact O-CD2 3.25Å; R327-F329 WeakPolarHBondContact O-CD2 3.19Å; R327-F329 WeakPolarHBondContact O-CE2 3.31Å; F329-A331 PolarHBondContact O-N 3.38Å; F329-P332 WeakPolarHBondContact O-CD 3.31Å; F329-H333 WeakPolarHBondContact O-CB 2.95Å; F329-H333 PolarHBondContact O-N 3.06Å | ||
| 330 | S | 88 | Confident | 83.8 | Confident | 2 Ų | 2 | 56.8 Ų | 56.8 | 1% | 0.014 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -55.8 | -47.2 | -176.1 | -74.7 | 0 | 0 | 0 | 0 | 113.7 | K184 D328 M334 | K184-S330 WeakPolarHBondContact CE-OG 3.4Å; K184-S330 PolarHBondContact NZ-OG 2.96Å; D328-S330 PolarHBondContact OD1-N 2.78Å; D328-S330 PolarHBondContact OD1-OG 3.45Å; S330-M334 PolarHBondContact O-N 2.89Å |
| 331 | A | 89 | Confident | 84.5 | Confident | 48 Ų | 48 | 58 Ų | 58 | 40% | 0.397 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -71 | -49.2 | 180 | 0 | 0 | 0 | 0 | 0 | 113.5 | F329 H333 M334 G335 | F329-A331 PolarHBondContact O-N 3.38Å; A331-H333 PolarHBondContact O-N 3.14Å; A331-M334 WeakPolarHBondContact O-CB 3.49Å; A331-M334 PolarHBondContact O-N 3.06Å; A331-G335 PolarHBondContact O-N 3.08Å; A331-G335 VanDerWaalsContact O-N 3.14Å |
| 332 | P | 91.2 | Very high | 85.7 | Confident | 13 Ų | 13 | 60.7 Ų | 60.7 | 8% | 0.084 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -53.1 | -41.2 | 171.2 | -29 | 33.4 | 0 | 0 | 0 | 113.8 | L303 T306 A307 F329 M334 G335 L336 | L303-P332 VanDerWaalsContact CD1-C 3.49Å; L303-P332 HydrophobicContact CD1-CB 3.41Å; L303-P332 VanDerWaalsContact CD1-CB 3.41Å; L303-P332 HydrophobicContact CG-CB 3.94Å; T306-P332 WeakPolarHBondContact OG1-CB 3.36Å; A307-P332 VanDerWaalsContact CA-CG 3.43Å; A307-P332 HydrophobicContact CB-CG 3.87Å; F329-P332 WeakPolarHBondContact O-CD 3.31Å; P332-M334 PolarHBondContact O-N 3.27Å; P332-G335 PolarHBondContact O-N 2.87Å; P332-L336 PolarHBondContact O-N 3.22Å |
| 333 | H | 92.8 | Very high | 87.2 | Confident | 2 Ų | 2 | 55.1 Ų | 55.1 | 1% | 0.009 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -64.1 | -40.9 | 180 | -174.7 | -83.6 | 0 | 0 | 0 | 111.5 | Y169 S238 F329 A331 G335 L336 C337 | Y169-H333 AromaticContact CE2-NE2 3.87Å; Y169-H333 AromaticContact CZ-NE2 3.78Å; Y169-H333 PolarHBondContact OH-CE1 3.08Å; Y169-H333 PolarHBondContact OH-NE2 3.3Å; S238-H333 WeakPolarHBondContact CA-ND1 3.4Å; S238-H333 WeakPolarHBondContact CB-ND1 3.43Å; S238-H333 PolarHBondContact OG-ND1 3.44Å; F329-H333 WeakPolarHBondContact O-CB 2.95Å; F329-H333 PolarHBondContact O-N 3.06Å; A331-H333 PolarHBondContact O-N 3.14Å; H333-G335 VanDerWaalsContact C-N 3.33Å; H333-G335 PolarHBondContact O-N 3.02Å; H333-L336 PolarHBondContact O-N 2.99Å; H333-C337 VanDerWaalsContact CE1-SG 3.58Å; H333-C337 PolarHBondContact O-N 3.48Å; H333-C337 PolarHBondContact O-SG 3.27Å; H333-C337 VanDerWaalsContact O-SG 3.35Å |
| 334 | M | 92.4 | Very high | 88.7 | Confident | 80 Ų | 80 | 49.9 Ų | 49.9 | 39% | 0.394 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -60.6 | -42.2 | 172.1 | -73.8 | -169 | -49.7 | 0 | 0 | 112.3 | S238 W242 S330 A331 P332 L336 C337 A338 | S238-M334 WeakPolarHBondContact OG-CA 3.23Å; S238-M334 WeakPolarHBondContact OG-CG 3.34Å; S238-M334 PolarHBondContact OG-N 3.01Å; W242-M334 HydrophobicContact CH2-CE 4.47Å; W242-M334 HydrophobicContact CZ2-CE 3.42Å; W242-M334 VanDerWaalsContact CZ2-CE 3.42Å; W242-M334 HydrophobicContact CZ2-SD 4.08Å; W242-M334 PolarHBondContact NE1-SD 2.96Å; S330-M334 PolarHBondContact O-N 2.89Å; A331-M334 WeakPolarHBondContact O-CB 3.49Å; A331-M334 PolarHBondContact O-N 3.06Å; P332-M334 PolarHBondContact O-N 3.27Å; M334-L336 VanDerWaalsContact C-N 3.31Å; M334-L336 PolarHBondContact O-N 2.63Å; M334-C337 PolarHBondContact O-N 3.49Å; M334-A338 PolarHBondContact O-N 3.46Å |
| 335 | G | 92.6 | Very high | 90.5 | Very high | 46 Ų | 46 | 44.6 Ų | 44.6 | 47% | 0.474 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -59.9 | -41.7 | 176 | 0 | 0 | 0 | 0 | 0 | 112.2 | A331 P332 H333 A338 F339 | A331-G335 PolarHBondContact O-N 3.08Å; A331-G335 VanDerWaalsContact O-N 3.14Å; P332-G335 PolarHBondContact O-N 2.87Å; H333-G335 VanDerWaalsContact C-N 3.33Å; H333-G335 PolarHBondContact O-N 3.02Å; G335-A338 PolarHBondContact O-N 3.23Å; G335-F339 PolarHBondContact O-N 3.36Å; G335-F339 VanDerWaalsContact O-N 3.13Å |
| 336 | L | 92.9 | Very high | 91.5 | Very high | 20 Ų | 20 | 41.8 Ų | 41.8 | 11% | 0.105 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -66.2 | -41.6 | 175.2 | -172.3 | 60.1 | 0 | 0 | 0 | 111.9 | Y169 M299 L303 P332 H333 M334 A338 F339 M340 | Y169-L336 HydrophobicContact CD2-CD2 3.49Å; Y169-L336 VanDerWaalsContact CD2-CD2 3.49Å; Y169-L336 HydrophobicContact CD2-CG 3.83Å; Y169-L336 HydrophobicContact CE2-CD2 3.98Å; Y169-L336 HydrophobicContact CE2-CG 4.33Å; M299-L336 HydrophobicContact CE-CD1 3.93Å; M299-L336 HydrophobicContact CG-CD1 4.16Å; M299-L336 HydrophobicContact SD-CD1 3.96Å; L303-L336 HydrophobicContact CD1-CB 4.42Å; L303-L336 HydrophobicContact CD1-CD2 4.24Å; P332-L336 PolarHBondContact O-N 3.22Å; H333-L336 PolarHBondContact O-N 2.99Å; M334-L336 VanDerWaalsContact C-N 3.31Å; M334-L336 PolarHBondContact O-N 2.63Å; L336-A338 VanDerWaalsContact C-N 3.34Å; L336-A338 PolarHBondContact O-N 3.4Å; L336-F339 WeakPolarHBondContact O-CB 3.43Å; L336-F339 PolarHBondContact O-N 2.91Å; L336-M340 WeakPolarHBondContact O-CG 3.34Å; L336-M340 PolarHBondContact O-N 3.45Å |
| 337 | C | 93.9 | Very high | 92.1 | Very high | 4 Ų | 4 | 40.2 Ų | 40.2 | 3% | 0.027 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -61.4 | -40.6 | 173.6 | -71.6 | 0 | 0 | 0 | 0 | 112.2 | S234 V235 H333 M334 F339 M340 V341 | S234-C337 VanDerWaalsContact C-SG 3.6Å; S234-C337 PolarHBondContact O-SG 2.89Å; S234-C337 VanDerWaalsContact O-SG 3.33Å; V235-C337 HydrophobicContact CG2-CB 4.16Å; H333-C337 VanDerWaalsContact CE1-SG 3.58Å; H333-C337 PolarHBondContact O-N 3.48Å; H333-C337 PolarHBondContact O-SG 3.27Å; H333-C337 VanDerWaalsContact O-SG 3.35Å; M334-C337 PolarHBondContact O-N 3.49Å; C337-F339 VanDerWaalsContact C-N 3.31Å; C337-F339 PolarHBondContact O-N 3.11Å; C337-M340 PolarHBondContact O-N 3.3Å; C337-M340 VanDerWaalsContact O-N 3.16Å; C337-V341 VanDerWaalsContact O-CG2 3.31Å; C337-V341 WeakPolarHBondContact O-CG2 3.31Å; C337-V341 PolarHBondContact O-N 3.26Å |
| 338 | A | 94.3 | Very high | 92.4 | Very high | 63 Ų | 63 | 39.4 Ų | 39.4 | 52% | 0.521 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -61.1 | -41.1 | 176 | 0 | 0 | 0 | 0 | 0 | 111.8 | M334 G335 L336 V341 L342 | M334-A338 PolarHBondContact O-N 3.46Å; G335-A338 PolarHBondContact O-N 3.23Å; L336-A338 VanDerWaalsContact C-N 3.34Å; L336-A338 PolarHBondContact O-N 3.4Å; A338-V341 PolarHBondContact O-N 3.2Å; A338-L342 PolarHBondContact O-N 3.23Å; A338-L342 VanDerWaalsContact O-N 3.07Å |
| 339 | F | 93.3 | Very high | 92.7 | Very high | 90 Ų | 90 | 44.8 Ų | 44.8 | 40% | 0.395 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -61.7 | -43.8 | 172.7 | 176.3 | -106.3 | 0 | 0 | 0 | 112.1 | M299 G335 L336 C337 V341 L342 L343 | M299-F339 HydrophobicContact CE-CD1 3.9Å; M299-F339 HydrophobicContact CE-CE1 3.59Å; G335-F339 PolarHBondContact O-N 3.36Å; G335-F339 VanDerWaalsContact O-N 3.13Å; L336-F339 WeakPolarHBondContact O-CB 3.43Å; L336-F339 PolarHBondContact O-N 2.91Å; C337-F339 VanDerWaalsContact C-N 3.31Å; C337-F339 PolarHBondContact O-N 3.11Å; F339-V341 PolarHBondContact O-N 3.33Å; F339-L342 PolarHBondContact O-N 2.78Å; F339-L343 HydrophobicContact CD1-CD1 4.08Å; F339-L343 HydrophobicContact CE1-CD1 3.45Å; F339-L343 VanDerWaalsContact CE1-CD1 3.45Å; F339-L343 HydrophobicContact CE1-CG 4.23Å; F339-L343 HydrophobicContact CE2-CD1 4.4Å; F339-L343 HydrophobicContact CE2-CG 4.42Å; F339-L343 HydrophobicContact CZ-CD1 3.64Å; F339-L343 HydrophobicContact CZ-CD2 4.4Å; F339-L343 HydrophobicContact CZ-CG 4.12Å; F339-L343 PolarHBondContact O-N 3.24Å |
| 340 | M | 94.3 | Very high | 92.7 | Very high | 4 Ų | 4 | 46.4 Ų | 46.4 | 2% | 0.02 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -64.3 | -38.2 | 177.3 | -67.9 | -57.7 | -67.3 | 0 | 0 | 112.9 | C166 F227 V231 M299 L336 C337 L343 S344 | C166-M340 HydrophobicContact CB-CE 4.25Å; F227-M340 HydrophobicContact CE2-CE 3.65Å; F227-M340 HydrophobicContact CZ-CE 4Å; V231-M340 HydrophobicContact CG1-CB 4.16Å; V231-M340 HydrophobicContact CG2-CB 4.06Å; V231-M340 HydrophobicContact CG2-CE 4.32Å; M299-M340 HydrophobicContact CE-SD 4.46Å; L336-M340 WeakPolarHBondContact O-CG 3.34Å; L336-M340 PolarHBondContact O-N 3.45Å; C337-M340 PolarHBondContact O-N 3.3Å; C337-M340 VanDerWaalsContact O-N 3.16Å; M340-L343 PolarHBondContact O-N 3.03Å; M340-L343 HydrophobicContact SD-CD1 4.42Å; M340-S344 PolarHBondContact O-N 3.39Å |
| 341 | V | 95.6 | Very high | 92.8 | Very high | 51 Ų | 51 | 46.4 Ų | 46.4 | 31% | 0.309 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -63.5 | -42.3 | 174.5 | 170.7 | 0 | 0 | 0 | 0 | 111.4 | V231 V235 C337 A338 F339 L343 S344 I345 | V231-V341 HydrophobicContact CG1-CB 4.31Å; V231-V341 HydrophobicContact CG1-CG2 3.51Å; V235-V341 HydrophobicContact CG2-CG2 3.68Å; C337-V341 VanDerWaalsContact O-CG2 3.31Å; C337-V341 WeakPolarHBondContact O-CG2 3.31Å; C337-V341 PolarHBondContact O-N 3.26Å; A338-V341 PolarHBondContact O-N 3.2Å; F339-V341 PolarHBondContact O-N 3.33Å; V341-L343 VanDerWaalsContact C-N 3.31Å; V341-L343 PolarHBondContact O-N 3.36Å; V341-S344 WeakPolarHBondContact CA-OG 3.44Å; V341-S344 PolarHBondContact O-N 3.26Å; V341-S344 PolarHBondContact O-OG 2.96Å; V341-I345 HydrophobicContact CG1-CD1 3.97Å; V341-I345 VanDerWaalsContact O-CG1 3.32Å; V341-I345 WeakPolarHBondContact O-CG1 3.48Å; V341-I345 PolarHBondContact O-N 3.33Å |
| 342 | L | 95.4 | Very high | 92.7 | Very high | 104 Ų | 104 | 52.2 Ų | 52.2 | 55% | 0.545 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -60.2 | -44.9 | 175 | -179.5 | 64.3 | 0 | 0 | 0 | 110.8 | A338 F339 S344 I345 V346 | A338-L342 PolarHBondContact O-N 3.23Å; A338-L342 VanDerWaalsContact O-N 3.07Å; F339-L342 PolarHBondContact O-N 2.78Å; L342-S344 PolarHBondContact O-N 2.77Å; L342-I345 PolarHBondContact O-N 2.97Å; L342-V346 VanDerWaalsContact O-CG2 3.31Å; L342-V346 WeakPolarHBondContact O-CG2 3.34Å; L342-V346 PolarHBondContact O-N 3.41Å |
| 343 | L | 94.2 | Very high | 92.5 | Very high | 20 Ų | 20 | 52.3 Ų | 52.3 | 11% | 0.105 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -64.3 | -37.8 | 176.9 | -70 | -178.2 | 0 | 0 | 0 | 112.7 | I161 T162 S165 F227 F339 M340 V341 V346 Q347 | I161-L343 HydrophobicContact CG2-CD1 4.2Å; I161-L343 HydrophobicContact CG2-CD2 3.77Å; T162-L343 HydrophobicContact CG2-CB 4.48Å; S165-L343 VanDerWaalsContact CB-CD1 3.43Å; S165-L343 WeakPolarHBondContact OG-CD1 3.12Å; F227-L343 HydrophobicContact CE1-CB 4.26Å; F227-L343 HydrophobicContact CZ-CB 4.1Å; F339-L343 HydrophobicContact CD1-CD1 4.08Å; F339-L343 HydrophobicContact CE1-CD1 3.45Å; F339-L343 VanDerWaalsContact CE1-CD1 3.45Å; F339-L343 HydrophobicContact CE1-CG 4.23Å; F339-L343 HydrophobicContact CE2-CD1 4.4Å; F339-L343 HydrophobicContact CE2-CG 4.42Å; F339-L343 HydrophobicContact CZ-CD1 3.64Å; F339-L343 HydrophobicContact CZ-CD2 4.4Å; F339-L343 HydrophobicContact CZ-CG 4.12Å; F339-L343 PolarHBondContact O-N 3.24Å; M340-L343 PolarHBondContact O-N 3.03Å; M340-L343 HydrophobicContact SD-CD1 4.42Å; V341-L343 VanDerWaalsContact C-N 3.31Å; V341-L343 PolarHBondContact O-N 3.36Å; L343-V346 PolarHBondContact O-N 3.22Å; L343-Q347 WeakPolarHBondContact O-CB 3.29Å; L343-Q347 PolarHBondContact O-N 3.02Å |
| 344 | S | 93.5 | Very high | 92 | Very high | 13 Ų | 13 | 54.7 Ų | 54.7 | 9% | 0.091 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -65.8 | -40.3 | 177.2 | 68.6 | 0 | 0 | 0 | 0 | 112 | M340 V341 L342 Q347 L348 | M340-S344 PolarHBondContact O-N 3.39Å; V341-S344 WeakPolarHBondContact CA-OG 3.44Å; V341-S344 PolarHBondContact O-N 3.26Å; V341-S344 PolarHBondContact O-OG 2.96Å; L342-S344 PolarHBondContact O-N 2.77Å; S344-Q347 PolarHBondContact O-N 2.77Å; S344-L348 VanDerWaalsContact O-CB 3.28Å; S344-L348 WeakPolarHBondContact O-CB 3.46Å; S344-L348 PolarHBondContact O-N 3.01Å |
| 345 | I | 94.6 | Very high | 91.7 | Very high | 81 Ų | 81 | 53.6 Ų | 53.6 | 42% | 0.415 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -62.1 | -49.7 | 173.6 | -68.7 | 167.6 | 0 | 0 | 0 | 110.1 | V341 L342 Q347 L348 F349 | V341-I345 HydrophobicContact CG1-CD1 3.97Å; V341-I345 VanDerWaalsContact O-CG1 3.32Å; V341-I345 WeakPolarHBondContact O-CG1 3.48Å; V341-I345 PolarHBondContact O-N 3.33Å; L342-I345 PolarHBondContact O-N 2.97Å; I345-Q347 VanDerWaalsContact C-N 3.34Å; I345-Q347 PolarHBondContact O-N 2.96Å; I345-L348 PolarHBondContact O-N 3.08Å; I345-F349 HydrophobicContact CG2-CD2 3.88Å; I345-F349 HydrophobicContact CG2-CE2 3.94Å; I345-F349 WeakPolarHBondContact O-CD2 3.49Å; I345-F349 PolarHBondContact O-N 2.96Å |
| 346 | V | 92.9 | Very high | 91.3 | Very high | 52 Ų | 52 | 54.8 Ų | 54.8 | 32% | 0.315 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -58.2 | -46.6 | 178.1 | 171.1 | 0 | 0 | 0 | 0 | 110.9 | I158 L342 L343 L348 F349 T350 | I158-V346 HydrophobicContact CD1-CG1 4.18Å; L342-V346 VanDerWaalsContact O-CG2 3.31Å; L342-V346 WeakPolarHBondContact O-CG2 3.34Å; L342-V346 PolarHBondContact O-N 3.41Å; L343-V346 PolarHBondContact O-N 3.22Å; V346-L348 PolarHBondContact O-N 2.81Å; V346-F349 PolarHBondContact O-N 3.3Å; V346-T350 HydrophobicContact CG1-CG2 4.27Å; V346-T350 VanDerWaalsContact O-CB 3.29Å; V346-T350 WeakPolarHBondContact O-CB 3.35Å; V346-T350 WeakPolarHBondContact O-CG2 3.42Å; V346-T350 PolarHBondContact O-N 3.43Å; V346-T350 PolarHBondContact O-OG1 3.26Å |
| 347 | Q | 92.3 | Very high | 90.9 | Very high | 0 Ų | 0 | 59 Ų | 59 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -60.9 | -47.1 | 177.6 | -171.8 | 179.4 | -39.2 | 0 | 0 | 111.5 | I158 T162 F227 L343 S344 I345 F349 L351 | I158-Q347 HydrophobicContact CG2-CB 4.45Å; I158-Q347 HydrophobicContact CG2-CG 4.36Å; T162-Q347 HydrophobicContact CG2-CB 3.82Å; T162-Q347 HydrophobicContact CG2-CG 4.18Å; T162-Q347 VanDerWaalsContact CG2-OE1 3.26Å; T162-Q347 PolarHBondContact OG1-OE1 3.43Å; F227-Q347 HydrophobicContact CD1-CB 4.12Å; F227-Q347 HydrophobicContact CD1-CG 4.43Å; F227-Q347 HydrophobicContact CE1-CB 4.22Å; F227-Q347 VanDerWaalsContact CE1-OE1 3.29Å; L343-Q347 WeakPolarHBondContact O-CB 3.29Å; L343-Q347 PolarHBondContact O-N 3.02Å; S344-Q347 PolarHBondContact O-N 2.77Å; I345-Q347 VanDerWaalsContact C-N 3.34Å; I345-Q347 PolarHBondContact O-N 2.96Å; Q347-F349 VanDerWaalsContact C-N 3.26Å; Q347-F349 PolarHBondContact O-N 3.2Å; Q347-L351 HydrophobicContact CG-CB 3.94Å; Q347-L351 HydrophobicContact CG-CD2 3.82Å; Q347-L351 HydrophobicContact CG-CG 4.36Å; Q347-L351 WeakPolarHBondContact O-CB 3.45Å; Q347-L351 PolarHBondContact O-N 2.82Å |
| 348 | L | 92.1 | Very high | 90.4 | Very high | 80 Ų | 80 | 62.6 Ų | 62.6 | 42% | 0.419 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -56.5 | -42.3 | -176.1 | -173 | 67 | 0 | 0 | 0 | 111.7 | K224 S344 I345 V346 | K224-L348 HydrophobicContact CB-CD1 4.07Å; K224-L348 HydrophobicContact CD-CD1 4.37Å; S344-L348 VanDerWaalsContact O-CB 3.28Å; S344-L348 WeakPolarHBondContact O-CB 3.46Å; S344-L348 PolarHBondContact O-N 3.01Å; I345-L348 PolarHBondContact O-N 3.08Å; V346-L348 PolarHBondContact O-N 2.81Å |
| 349 | F | 91.3 | Very high | 89.8 | Confident | 156 Ų | 156 | 65 Ų | 65 | 68% | 0.684 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -89.6 | -33.5 | -176.6 | -69 | -67.4 | 0 | 0 | 0 | 114.6 | I345 V346 Q347 | I345-F349 HydrophobicContact CG2-CD2 3.88Å; I345-F349 HydrophobicContact CG2-CE2 3.94Å; I345-F349 WeakPolarHBondContact O-CD2 3.49Å; I345-F349 PolarHBondContact O-N 2.96Å; V346-F349 PolarHBondContact O-N 3.3Å; Q347-F349 VanDerWaalsContact C-N 3.26Å; Q347-F349 PolarHBondContact O-N 3.2Å |
| 350 | T | 90.8 | Very high | 89.2 | Confident | 45 Ų | 45 | 62.5 Ų | 62.5 | 28% | 0.276 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -102 | -15.8 | -170.4 | 70.4 | 0 | 0 | 0 | 0 | 114 | V346 K352 | V346-T350 HydrophobicContact CG1-CG2 4.27Å; V346-T350 VanDerWaalsContact O-CB 3.29Å; V346-T350 WeakPolarHBondContact O-CB 3.35Å; V346-T350 WeakPolarHBondContact O-CG2 3.42Å; V346-T350 PolarHBondContact O-N 3.43Å; V346-T350 PolarHBondContact O-OG1 3.26Å; T350-K352 PolarHBondContact O-N 3Å |
| 351 | L | 89.6 | Confident | 88.5 | Confident | 2 Ų | 2 | 67.1 Ų | 67.1 | 1% | 0.01 | 33% | 0.328 | C | S | . | . | trans | -71.6 | 104 | -176 | -175.3 | 69.8 | 0 | 0 | 0 | 111.2 | I158 I159 I220 L223 K224 Q347 L353 | I158-L351 HydrophobicContact CB-CD1 4.36Å; I158-L351 HydrophobicContact CG2-CB 4.41Å; I158-L351 HydrophobicContact CG2-CD1 4.04Å; I159-L351 HydrophobicContact CG2-CD1 3.27Å; I159-L351 HydrophobicContact CG2-CD2 4.45Å; I159-L351 HydrophobicContact CG2-CG 4.48Å; I220-L351 HydrophobicContact CG2-CD2 4.05Å; I220-L351 HydrophobicContact CG2-CG 4.25Å; L223-L351 HydrophobicContact CD2-CD2 4.19Å; K224-L351 WeakPolarHBondContact CE-O 3.33Å; K224-L351 HydrophobicContact CG-CD2 3.96Å; Q347-L351 HydrophobicContact CG-CB 3.94Å; Q347-L351 HydrophobicContact CG-CD2 3.82Å; Q347-L351 HydrophobicContact CG-CG 4.36Å; Q347-L351 WeakPolarHBondContact O-CB 3.45Å; Q347-L351 PolarHBondContact O-N 2.82Å; L351-L353 HydrophobicContact CD1-CD1 3.22Å; L351-L353 HydrophobicContact CG-CD1 4.04Å | ||
| 352 | K | 86.8 | Confident | 87.8 | Confident | 171 Ų | 171 | 69.5 Ų | 69.5 | 74% | 0.743 | 34% | 0.339 | S | S | * | . | trans | -133.8 | 122 | 168 | -65.1 | -177.3 | 179.4 | -179.2 | 0 | 108.1 | T350 | T350-K352 PolarHBondContact O-N 3Š| ||
| 353 | L | 86.4 | Confident | 86.9 | Confident | 14 Ų | 14 | 67.7 Ų | 67.7 | 7% | 0.073 | 34% | 0.335 | C | S | . | . | trans | -131.5 | 145.7 | 171 | -74.2 | 98.4 | 0 | 0 | 0 | 110.1 | I159 I220 L271 A275 L351 | I159-L353 HydrophobicContact CD1-CD2 4.14Å; I159-L353 HydrophobicContact CG2-CD1 3.8Å; I220-L353 HydrophobicContact CD1-CB 4.42Å; I220-L353 VanDerWaalsContact CD1-O 3.3Å; I220-L353 WeakPolarHBondContact CD1-O 3.48Å; L271-L353 HydrophobicContact CD2-CD1 4.38Å; A275-L353 HydrophobicContact CB-CB 3.91Å; A275-L353 HydrophobicContact CB-CD2 3.3Å; A275-L353 HydrophobicContact CB-CG 4.2Å; L351-L353 HydrophobicContact CD1-CD1 3.22Å; L351-L353 HydrophobicContact CG-CD1 4.04Å | ||
| 354 | P | 83.2 | Confident | 86 | Confident | 53 Ų | 53 | 70.2 Ų | 70.2 | 34% | 0.344 | 35% | 0.351 | S | S | . | . | trans | -74 | 149.8 | 172.3 | 30.8 | -34.2 | 0 | 0 | 0 | 111.4 | A275 K356 | A275-P354 WeakPolarHBondContact CA-O 3.49Å; P354-K356 VanDerWaalsContact C-N 3.34Å; P354-K356 HydrophobicContact CB-CG 4.08Å; P354-K356 HydrophobicContact CG-CD 4.46Å; P354-K356 HydrophobicContact CG-CG 3.94Å; P354-K356 PolarHBondContact O-N 3.27Å | ||
| 355 | Y | 85.7 | Confident | 85 | Confident | 56 Ų | 56 | 74.2 Ų | 74.2 | 22% | 0.22 | 37% | 0.374 | C | S | . | . | trans | -91.9 | 64 | 173.9 | -70.8 | -83.4 | 0 | 0 | 0 | 110.4 | L219 I220 E274 R357 R358 E359 | L219-Y355 HydrophobicContact CB-CE1 4.09Å; L219-Y355 HydrophobicContact CD2-CE1 4.45Å; I220-Y355 HydrophobicContact CD1-CE2 3.71Å; I220-Y355 HydrophobicContact CG1-CE2 4.39Å; I220-Y355 WeakPolarHBondContact CG1-OH 3.47Å; I220-Y355 PolarHBondContact N-OH 2.62Å; E274-Y355 HydrophobicContact CG-CD1 3.63Å; E274-Y355 HydrophobicContact CG-CE1 4.43Å; E274-Y355 HydrophobicContact CG-CG 4.45Å; E274-Y355 VanDerWaalsContact OE1-C 3.3Å; Y355-R357 VanDerWaalsContact C-N 3.32Å; Y355-R357 PolarHBondContact O-N 3.33Å; Y355-R358 PolarHBondContact O-N 3.27Å; Y355-E359 WeakPolarHBondContact O-CB 3.3Å; Y355-E359 VanDerWaalsContact O-CG 3.29Å; Y355-E359 WeakPolarHBondContact O-CG 3.37Å; Y355-E359 PolarHBondContact O-N 2.98Å | ||
| 356 | K | 84.1 | Confident | 84 | Confident | 71 Ų | 71 | 76.1 Ų | 76.1 | 31% | 0.309 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -62.1 | -36.3 | -169.3 | -68.4 | -171.2 | -174.2 | 171 | 0 | 113.5 | E274 A275 P354 C360 | E274-K356 PolarHBondContact O-N 3.27Å; A275-K356 VanDerWaalsContact O-CD 3.31Å; A275-K356 WeakPolarHBondContact O-CD 3.36Å; A275-K356 WeakPolarHBondContact O-CE 3.4Å; P354-K356 VanDerWaalsContact C-N 3.34Å; P354-K356 HydrophobicContact CB-CG 4.08Å; P354-K356 HydrophobicContact CG-CD 4.46Å; P354-K356 HydrophobicContact CG-CG 3.94Å; P354-K356 PolarHBondContact O-N 3.27Å; K356-C360 WeakPolarHBondContact O-CB 3.44Å; K356-C360 PolarHBondContact O-N 2.96Å |
| 357 | R | 83.6 | Confident | 83 | Confident | 110 Ų | 110 | 76.4 Ų | 76.4 | 42% | 0.415 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -69.8 | -44.5 | -179.4 | 176.5 | -173 | -177.1 | -179.4 | 1.7 | 110.7 | E274 Y277 Y355 C360 L361 | E274-R357 PolarHBondContact O-N 3.33Å; E274-R357 WeakPolarHBondContact OE1-CB 3.29Å; E274-R357 PolarHBondContact OE1-N 3.27Å; E274-R357 WeakPolarHBondContact OE2-CB 3.49Å; Y277-R357 HydrophobicContact CD2-CB 4.23Å; Y277-R357 HydrophobicContact CD2-CG 4.26Å; Y277-R357 HydrophobicContact CG-CB 4.05Å; Y355-R357 VanDerWaalsContact C-N 3.32Å; Y355-R357 PolarHBondContact O-N 3.33Å; R357-C360 PolarHBondContact O-N 3.21Å; R357-L361 HydrophobicContact CG-CD1 4.28Å; R357-L361 WeakPolarHBondContact O-CG 3.43Å; R357-L361 PolarHBondContact O-N 3.22Å |
| 358 | R | 84.1 | Confident | 81.9 | Confident | 79 Ų | 79 | 80.8 Ų | 80.8 | 30% | 0.298 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -62.6 | -42.5 | 173.9 | -72.3 | 174.6 | -175.3 | -172.7 | 1.7 | 112 | G217 E274 Y355 C360 L361 N362 | G217-R358 PolarHBondContact O-NH1 3.09Å; E274-R358 WeakPolarHBondContact OE1-CB 3.3Å; E274-R358 VanDerWaalsContact OE1-CG 3.29Å; E274-R358 WeakPolarHBondContact OE1-CG 3.41Å; E274-R358 PolarHBondContact OE1-N 3.26Å; Y355-R358 PolarHBondContact O-N 3.27Å; R358-C360 VanDerWaalsContact C-N 3.33Å; R358-C360 PolarHBondContact O-N 3.43Å; R358-L361 PolarHBondContact O-N 2.96Å; R358-N362 WeakPolarHBondContact O-CB 3.42Å; R358-N362 VanDerWaalsContact O-CG 3.29Å; R358-N362 PolarHBondContact O-N 2.94Å |
| 359 | E | 82.7 | Confident | 80.8 | Confident | 113 Ų | 113 | 78.8 Ų | 78.8 | 53% | 0.528 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -58.8 | -44.5 | 174.6 | -73.5 | 166.9 | -166.4 | 0 | 0 | 111.5 | Y355 N362 S363 | Y355-E359 WeakPolarHBondContact O-CB 3.3Å; Y355-E359 VanDerWaalsContact O-CG 3.29Å; Y355-E359 WeakPolarHBondContact O-CG 3.37Å; Y355-E359 PolarHBondContact O-N 2.98Å; E359-N362 PolarHBondContact O-N 2.66Å; E359-S363 PolarHBondContact O-N 3.23Å |
| 360 | C | 80.5 | Confident | 79.8 | Confident | 38 Ų | 38 | 73.6 Ų | 73.6 | 26% | 0.257 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -63.7 | -47 | 176.3 | -177.2 | 0 | 0 | 0 | 0 | 111.9 | Y277 K356 R357 R358 N362 S363 V364 | Y277-C360 HydrophobicContact CD1-CB 4.13Å; Y277-C360 HydrophobicContact CE1-CB 3.76Å; Y277-C360 VanDerWaalsContact CE1-SG 3.54Å; K356-C360 WeakPolarHBondContact O-CB 3.44Å; K356-C360 PolarHBondContact O-N 2.96Å; R357-C360 PolarHBondContact O-N 3.21Å; R358-C360 VanDerWaalsContact C-N 3.33Å; R358-C360 PolarHBondContact O-N 3.43Å; C360-N362 VanDerWaalsContact C-N 3.34Å; C360-N362 PolarHBondContact O-N 3.46Å; C360-S363 PolarHBondContact O-N 3.32Å; C360-S363 PolarHBondContact O-OG 2.91Å; C360-V364 WeakPolarHBondContact O-CG2 3.23Å; C360-V364 PolarHBondContact O-N 2.91Å; C360-V364 VanDerWaalsContact O-N 3.09Å |
| 361 | L | 79.8 | Confident | 78.9 | Confident | 100 Ų | 100 | 75.4 Ų | 75.4 | 52% | 0.524 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -60.5 | -43.4 | 177.9 | -72.4 | 170.5 | 0 | 0 | 0 | 111.9 | R357 R358 S363 V364 V365 | R357-L361 HydrophobicContact CG-CD1 4.28Å; R357-L361 WeakPolarHBondContact O-CG 3.43Å; R357-L361 PolarHBondContact O-N 3.22Å; R358-L361 PolarHBondContact O-N 2.96Å; L361-S363 VanDerWaalsContact C-N 3.34Å; L361-S363 PolarHBondContact O-N 3.06Å; L361-V364 PolarHBondContact O-N 3.45Å; L361-V365 WeakPolarHBondContact O-CG2 3.38Å; L361-V365 PolarHBondContact O-N 3.42Å |
| 362 | N | 80 | Confident | 78 | Confident | 102 Ų | 102 | 79.3 Ų | 79.3 | 55% | 0.545 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -63.1 | -39.9 | 176.8 | -72.8 | -12.4 | 0 | 0 | 0 | 111.8 | R358 E359 C360 V364 V365 I366 | R358-N362 WeakPolarHBondContact O-CB 3.42Å; R358-N362 VanDerWaalsContact O-CG 3.29Å; R358-N362 PolarHBondContact O-N 2.94Å; E359-N362 PolarHBondContact O-N 2.66Å; C360-N362 VanDerWaalsContact C-N 3.34Å; C360-N362 PolarHBondContact O-N 3.46Å; N362-V364 VanDerWaalsContact C-N 3.31Å; N362-V364 PolarHBondContact O-N 3.47Å; N362-V365 PolarHBondContact O-N 3.36Å; N362-I366 WeakPolarHBondContact O-CB 3.37Å; N362-I366 WeakPolarHBondContact O-CD1 3.48Å; N362-I366 VanDerWaalsContact O-CG1 3.23Å; N362-I366 WeakPolarHBondContact O-CG1 3.46Å; N362-I366 PolarHBondContact O-N 3.48Å |
| 363 | S | 76.7 | Confident | 77.2 | Confident | 66 Ų | 66 | 73.8 Ų | 73.8 | 46% | 0.462 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -63 | -36.4 | 176.2 | 72.4 | 0 | 0 | 0 | 0 | 112.8 | E359 C360 L361 S367 | E359-S363 PolarHBondContact O-N 3.23Å; C360-S363 PolarHBondContact O-N 3.32Å; C360-S363 PolarHBondContact O-OG 2.91Å; L361-S363 VanDerWaalsContact C-N 3.34Å; L361-S363 PolarHBondContact O-N 3.06Å; S363-S367 WeakPolarHBondContact O-CB 3.38Å; S363-S367 PolarHBondContact O-N 3.01Å |
| 364 | V | 74.5 | Confident | 76.4 | Confident | 73 Ų | 73 | 77.3 Ų | 77.3 | 44% | 0.442 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -70.4 | -44 | 176.2 | 173.9 | 0 | 0 | 0 | 0 | 110.9 | C360 L361 N362 I366 S367 I368 | C360-V364 WeakPolarHBondContact O-CG2 3.23Å; C360-V364 PolarHBondContact O-N 2.91Å; C360-V364 VanDerWaalsContact O-N 3.09Å; L361-V364 PolarHBondContact O-N 3.45Å; N362-V364 VanDerWaalsContact C-N 3.31Å; N362-V364 PolarHBondContact O-N 3.47Å; V364-I366 VanDerWaalsContact C-N 3.34Å; V364-I366 PolarHBondContact O-N 2.93Å; V364-S367 PolarHBondContact O-N 2.86Å; V364-I368 HydrophobicContact CG1-CD1 3.85Å; V364-I368 HydrophobicContact CG1-CG1 4.46Å; V364-I368 WeakPolarHBondContact O-CG1 3.36Å; V364-I368 PolarHBondContact O-N 2.86Å |
| 365 | V | 72.5 | Confident | 75.8 | Confident | 96 Ų | 96 | 79 Ų | 79 | 58% | 0.582 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -62.3 | -42.3 | 177.3 | 173 | 0 | 0 | 0 | 0 | 111.1 | L361 N362 S367 I368 G369 | L361-V365 WeakPolarHBondContact O-CG2 3.38Å; L361-V365 PolarHBondContact O-N 3.42Å; N362-V365 PolarHBondContact O-N 3.36Å; V365-S367 VanDerWaalsContact C-N 3.33Å; V365-S367 PolarHBondContact O-N 3.34Å; V365-I368 PolarHBondContact O-N 3.17Å; V365-G369 PolarHBondContact O-N 3.2Å |
| 366 | I | 73.3 | Confident | 75 | Confident | 121 Ų | 121 | 82.3 Ų | 82.3 | 62% | 0.621 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -61.6 | -42.9 | 175 | -68.6 | 163.3 | 0 | 0 | 0 | 110.6 | N362 V364 G369 S370 | N362-I366 WeakPolarHBondContact O-CB 3.37Å; N362-I366 WeakPolarHBondContact O-CD1 3.48Å; N362-I366 VanDerWaalsContact O-CG1 3.23Å; N362-I366 WeakPolarHBondContact O-CG1 3.46Å; N362-I366 PolarHBondContact O-N 3.48Å; V364-I366 VanDerWaalsContact C-N 3.34Å; V364-I366 PolarHBondContact O-N 2.93Å; I366-G369 PolarHBondContact O-N 3.48Å; I366-S370 WeakPolarHBondContact O-CB 3.44Å; I366-S370 PolarHBondContact O-N 2.93Å; I366-S370 PolarHBondContact O-OG 2.9Å |
| 367 | S | 72.2 | Confident | 74.3 | Confident | 59 Ų | 59 | 82.7 Ų | 82.7 | 41% | 0.413 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -65.8 | -37.7 | 178.5 | -176.1 | 0 | 0 | 0 | 0 | 113.1 | S363 V364 V365 S370 N371 | S363-S367 WeakPolarHBondContact O-CB 3.38Å; S363-S367 PolarHBondContact O-N 3.01Å; V364-S367 PolarHBondContact O-N 2.86Å; V365-S367 VanDerWaalsContact C-N 3.33Å; V365-S367 PolarHBondContact O-N 3.34Å; S367-S370 WeakPolarHBondContact CA-OG 3.45Å; S367-S370 PolarHBondContact O-OG 3Å; S367-N371 WeakPolarHBondContact O-CB 3.44Å; S367-N371 PolarHBondContact O-N 3.43Å; S367-N371 PolarHBondContact O-OD1 3.36Å |
| 368 | I | 69.9 | Low | 73.6 | Confident | 91 Ų | 91 | 81.4 Ų | 81.4 | 47% | 0.467 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -69.4 | -45.1 | 174.8 | -66.3 | 167 | 0 | 0 | 0 | 110.2 | V364 V365 S370 N371 N372 | V364-I368 HydrophobicContact CG1-CD1 3.85Å; V364-I368 HydrophobicContact CG1-CG1 4.46Å; V364-I368 WeakPolarHBondContact O-CG1 3.36Å; V364-I368 PolarHBondContact O-N 2.86Å; V365-I368 PolarHBondContact O-N 3.17Å; I368-S370 VanDerWaalsContact C-N 3.33Å; I368-S370 PolarHBondContact O-N 2.84Å; I368-N371 PolarHBondContact O-N 3.39Å; I368-N372 PolarHBondContact O-N 2.95Å |
| 369 | G | 69.4 | Low | 73 | Confident | 39 Ų | 39 | 82.6 Ų | 82.6 | 40% | 0.402 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -58.9 | -43.6 | 176 | 0 | 0 | 0 | 0 | 0 | 112.2 | V365 I366 N372 S373 | V365-G369 PolarHBondContact O-N 3.2Å; I366-G369 PolarHBondContact O-N 3.48Å; G369-N372 PolarHBondContact O-N 3.24Å; G369-S373 PolarHBondContact O-N 3.26Å; G369-S373 PolarHBondContact O-OG 3.05Å |
| 370 | S | 70.2 | Confident | 72.3 | Confident | 46 Ų | 46 | 83.7 Ų | 83.7 | 32% | 0.322 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -64.9 | -40.6 | 176.1 | 60.7 | 0 | 0 | 0 | 0 | 112.5 | I366 S367 I368 S373 I374 | I366-S370 WeakPolarHBondContact O-CB 3.44Å; I366-S370 PolarHBondContact O-N 2.93Å; I366-S370 PolarHBondContact O-OG 2.9Å; S367-S370 WeakPolarHBondContact CA-OG 3.45Å; S367-S370 PolarHBondContact O-OG 3Å; I368-S370 VanDerWaalsContact C-N 3.33Å; I368-S370 PolarHBondContact O-N 2.84Å; S370-S373 WeakPolarHBondContact CA-OG 3.33Å; S370-S373 PolarHBondContact O-N 3.38Å; S370-S373 PolarHBondContact O-OG 3.4Å; S370-I374 WeakPolarHBondContact O-CD1 3.27Å; S370-I374 VanDerWaalsContact O-CG1 3.23Å; S370-I374 WeakPolarHBondContact O-CG1 3.47Å; S370-I374 PolarHBondContact O-N 3.38Å |
| 371 | N | 70.9 | Confident | 71.7 | Confident | 83 Ų | 83 | 86.2 Ų | 86.2 | 44% | 0.444 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -66.6 | -39.2 | 177.6 | -74.4 | -3.2 | 0 | 0 | 0 | 111.5 | S367 I368 I374 N375 | S367-N371 WeakPolarHBondContact O-CB 3.44Å; S367-N371 PolarHBondContact O-N 3.43Å; S367-N371 PolarHBondContact O-OD1 3.36Å; I368-N371 PolarHBondContact O-N 3.39Å; N371-I374 PolarHBondContact O-N 2.93Å; N371-N375 PolarHBondContact O-N 2.78Å; N371-N375 PolarHBondContact O-ND2 3.44Å |
| 372 | N | 71.7 | Confident | 70.8 | Confident | 85 Ų | 85 | 87.6 Ų | 87.6 | 46% | 0.455 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -64.5 | -43.3 | 174.4 | -72.1 | -0.9 | 0 | 0 | 0 | 111.3 | I368 G369 I374 N375 E376 | I368-N372 PolarHBondContact O-N 2.95Å; G369-N372 PolarHBondContact O-N 3.24Å; N372-I374 VanDerWaalsContact C-N 3.34Å; N372-I374 PolarHBondContact O-N 3.18Å; N372-N375 PolarHBondContact O-N 3.03Å; N372-E376 WeakPolarHBondContact O-CG 3.44Å; N372-E376 PolarHBondContact O-N 3.44Å |
| 373 | S | 69.7 | Low | 70.2 | Confident | 54 Ų | 54 | 88.7 Ų | 88.7 | 38% | 0.378 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -65.2 | -34.4 | 175.9 | 58.8 | 0 | 0 | 0 | 0 | 113.4 | G369 S370 N375 V377 | G369-S373 PolarHBondContact O-N 3.26Å; G369-S373 PolarHBondContact O-OG 3.05Å; S370-S373 WeakPolarHBondContact CA-OG 3.33Å; S370-S373 PolarHBondContact O-N 3.38Å; S370-S373 PolarHBondContact O-OG 3.4Å; S373-N375 VanDerWaalsContact C-N 3.34Å; S373-V377 VanDerWaalsContact O-CG2 3.27Å; S373-V377 WeakPolarHBondContact O-CG2 3.45Å; S373-V377 PolarHBondContact O-N 2.88Å |
| 374 | I | 70.3 | Confident | 69.7 | Low | 88 Ų | 88 | 92.6 Ų | 92.6 | 45% | 0.451 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67.5 | -39.2 | 174.7 | -70.3 | 162.4 | 0 | 0 | 0 | 110.3 | S370 N371 N372 N378 | S370-I374 WeakPolarHBondContact O-CD1 3.27Å; S370-I374 VanDerWaalsContact O-CG1 3.23Å; S370-I374 WeakPolarHBondContact O-CG1 3.47Å; S370-I374 PolarHBondContact O-N 3.38Å; N371-I374 PolarHBondContact O-N 2.93Å; N372-I374 VanDerWaalsContact C-N 3.34Å; N372-I374 PolarHBondContact O-N 3.18Å; I374-N378 WeakPolarHBondContact O-CB 3.23Å; I374-N378 PolarHBondContact O-N 3.21Å; I374-N378 PolarHBondContact O-ND2 3.18Å |
| 375 | N | 70 | Confident | 69.3 | Low | 89 Ų | 89 | 95.8 Ų | 95.8 | 48% | 0.476 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -67.1 | -43.2 | 175.9 | -67.3 | -15.6 | 0 | 0 | 0 | 111.4 | N371 N372 S373 V377 N378 D379 | N371-N375 PolarHBondContact O-N 2.78Å; N371-N375 PolarHBondContact O-ND2 3.44Å; N372-N375 PolarHBondContact O-N 3.03Å; S373-N375 VanDerWaalsContact C-N 3.34Å; N375-V377 PolarHBondContact O-N 3.3Å; N375-N378 PolarHBondContact O-N 2.88Å; N375-D379 VanDerWaalsContact O-CG 3.28Å; N375-D379 PolarHBondContact O-N 3.45Å |
| 376 | E | 68.4 | Low | 68.5 | Low | 126 Ų | 126 | 100.4 Ų | 100.4 | 59% | 0.589 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -60 | -43.2 | 175.4 | -75 | 172 | -179.6 | 0 | 0 | 112 | N372 N378 D379 E380 | N372-E376 WeakPolarHBondContact O-CG 3.44Å; N372-E376 PolarHBondContact O-N 3.44Å; E376-N378 VanDerWaalsContact C-N 3.34Å; E376-N378 PolarHBondContact O-N 3.24Å; E376-D379 PolarHBondContact O-N 2.95Å; E376-E380 PolarHBondContact O-N 3.01Å |
| 377 | V | 69.7 | Low | 68.3 | Low | 78 Ų | 78 | 99.4 Ų | 99.4 | 47% | 0.473 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -65.4 | -37.1 | 175.7 | 171.4 | 0 | 0 | 0 | 0 | 111.9 | S373 N375 I381 | S373-V377 VanDerWaalsContact O-CG2 3.27Å; S373-V377 WeakPolarHBondContact O-CG2 3.45Å; S373-V377 PolarHBondContact O-N 2.88Å; N375-V377 PolarHBondContact O-N 3.3Å; V377-I381 HydrophobicContact CG1-CD1 3.97Å; V377-I381 WeakPolarHBondContact O-CD1 3.44Å; V377-I381 VanDerWaalsContact O-CG1 3.25Å; V377-I381 WeakPolarHBondContact O-CG1 3.34Å; V377-I381 PolarHBondContact O-N 3.13Å; V377-I381 VanDerWaalsContact O-N 3.13Å |
| 378 | N | 69.2 | Low | 68.1 | Low | 84 Ų | 84 | 101.5 Ų | 101.5 | 45% | 0.449 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -69.4 | -35.6 | 176.3 | -70.3 | -24.6 | 0 | 0 | 0 | 112 | I374 N375 E376 Q382 | I374-N378 WeakPolarHBondContact O-CB 3.23Å; I374-N378 PolarHBondContact O-N 3.21Å; I374-N378 PolarHBondContact O-ND2 3.18Å; N375-N378 PolarHBondContact O-N 2.88Å; E376-N378 VanDerWaalsContact C-N 3.34Å; E376-N378 PolarHBondContact O-N 3.24Å; N378-Q382 PolarHBondContact O-N 3.48Å |
| 379 | D | 71.2 | Confident | 68 | Low | 104 Ų | 104 | 102.1 Ų | 102.1 | 56% | 0.556 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -69.2 | -42.2 | 176.4 | -69.2 | -20.8 | 0 | 0 | 0 | 110.8 | N375 E376 I381 Q382 D383 | N375-D379 VanDerWaalsContact O-CG 3.28Å; N375-D379 PolarHBondContact O-N 3.45Å; E376-D379 PolarHBondContact O-N 2.95Å; D379-I381 PolarHBondContact O-N 3.47Å; D379-Q382 PolarHBondContact O-N 3.28Å; D379-Q382 VanDerWaalsContact O-N 3.16Å; D379-D383 PolarHBondContact O-N 3.05Å |
| 380 | E | 67.7 | Low | 67.9 | Low | 135 Ų | 135 | 105.8 Ų | 105.8 | 63% | 0.631 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -62.2 | -40.6 | 174.7 | -76.7 | -177.5 | 172.4 | 0 | 0 | 112.9 | E376 Q382 D383 D384 | E376-E380 PolarHBondContact O-N 3.01Å; E380-Q382 PolarHBondContact O-N 3.2Å; E380-D383 PolarHBondContact O-N 3.36Å; E380-D384 PolarHBondContact O-N 3.16Å |
| 381 | I | 67.7 | Low | 67.8 | Low | 92 Ų | 92 | 109.5 Ų | 109.5 | 47% | 0.472 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -64.5 | -31.8 | 176.3 | -69.6 | 166.2 | 0 | 0 | 0 | 111.2 | V377 D379 L385 | V377-I381 HydrophobicContact CG1-CD1 3.97Å; V377-I381 WeakPolarHBondContact O-CD1 3.44Å; V377-I381 VanDerWaalsContact O-CG1 3.25Å; V377-I381 WeakPolarHBondContact O-CG1 3.34Å; V377-I381 PolarHBondContact O-N 3.13Å; V377-I381 VanDerWaalsContact O-N 3.13Å; D379-I381 PolarHBondContact O-N 3.47Å; I381-L385 HydrophobicContact CG2-CD1 4.12Å; I381-L385 WeakPolarHBondContact O-CD1 3.25Å; I381-L385 WeakPolarHBondContact O-CG 3.45Å |
| 382 | Q | 60.7 | Low | 67.6 | Low | 129 Ų | 129 | 111.3 Ų | 111.3 | 60% | 0.603 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -77.8 | -35.3 | -179.7 | -167.3 | 151.7 | -26.8 | 0 | 0 | 112.2 | N378 D379 E380 D384 L385 | N378-Q382 PolarHBondContact O-N 3.48Å; D379-Q382 PolarHBondContact O-N 3.28Å; D379-Q382 VanDerWaalsContact O-N 3.16Å; E380-Q382 PolarHBondContact O-N 3.2Å; Q382-D384 VanDerWaalsContact C-N 3.34Å; Q382-L385 PolarHBondContact O-N 3.4Å |
| 383 | D | 67.9 | Low | 67.3 | Low | 125 Ų | 125 | 113.1 Ų | 113.1 | 67% | 0.668 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -68.1 | -29.1 | 173.4 | -79.9 | -15.4 | 0 | 0 | 0 | 113.1 | D379 E380 L385 | D379-D383 PolarHBondContact O-N 3.05Å; E380-D383 PolarHBondContact O-N 3.36Å; D383-L385 VanDerWaalsContact C-N 3.29Å |
| 384 | D | 67 | Low | 67.1 | Low | 148 Ų | 148 | 117.7 Ų | 117.7 | 79% | 0.791 | 61% | 0.609 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77 | -12.2 | 174.8 | -89.3 | -13.5 | 0 | 0 | 0 | 113.6 | E380 Q382 | E380-D384 PolarHBondContact O-N 3.16Å; Q382-D384 VanDerWaalsContact C-N 3.34Å |
| 385 | L | 65.6 | Low | 66.8 | Low | 139 Ų | 139 | 120.2 Ų | 120.2 | 73% | 0.728 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.1 | -15.7 | -178 | -81.9 | 164 | 0 | 0 | 0 | 114.1 | I381 Q382 D383 | I381-L385 HydrophobicContact CG2-CD1 4.12Å; I381-L385 WeakPolarHBondContact O-CD1 3.25Å; I381-L385 WeakPolarHBondContact O-CG 3.45Å; Q382-L385 PolarHBondContact O-N 3.4Å; D383-L385 VanDerWaalsContact C-N 3.29Å |
| 386 | D | 56.5 | Low | 66.5 | Low | 193 Ų | 193 | 123 Ų | 123 | 100% | 1.032 | 64% | 0.636 | S | S | * | * | trans | -94.2 | 0 | 175.5 | -76.6 | -15.8 | 0 | 0 | 0 | 111.7 |
Retrieved 386 of 386 residues in 399.6 ms
(Link to these results)