| 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 | H | 34.4 | Very low | 32.4 | Very low | 246 Ų | 246 | 144.4 Ų | 144.4 | 100% | 1.139 | 79% | 0.786 | S | S | * | * | 0 | 27.8 | 0 | -125.5 | -74.7 | 0 | 0 | 0 | 112.8 | |||||
| 2 | S | 33.6 | Very low | 33.1 | Very low | 105 Ų | 105 | 137.8 Ų | 137.8 | 73% | 0.734 | 76% | 0.759 | S | S | * | * | trans | -123.8 | 24.2 | -170.6 | -46.4 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 3 | V | 27.9 | Very low | 34.3 | Very low | 128 Ų | 128 | 138.4 Ų | 138.4 | 78% | 0.776 | 76% | 0.756 | S | S | * | * | trans | -114.1 | -8.6 | -174.6 | -177.4 | 0 | 0 | 0 | 0 | 112.2 | L5 | V3-L5 PolarHBondContact O-N 3.33Š| ||
| 4 | L | 26.3 | Very low | 35.3 | Very low | 151 Ų | 151 | 134.9 Ų | 134.9 | 79% | 0.791 | 74% | 0.743 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.1 | 13.2 | 175.2 | -140 | 80.5 | 0 | 0 | 0 | 113.7 | L7 | L4-L7 HydrophobicContact CD1-CD1 4.48Š|
| 5 | L | 28.8 | Very low | 36.6 | Very low | 160 Ų | 160 | 128.5 Ų | 128.5 | 84% | 0.838 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99 | -2 | 177.7 | -95.4 | 154.9 | 0 | 0 | 0 | 113.4 | V3 | V3-L5 PolarHBondContact O-N 3.33Š|
| 6 | C | 29.2 | Very low | 37.9 | Very low | 120 Ų | 120 | 124.5 Ų | 124.5 | 81% | 0.811 | 69% | 0.688 | S | S | * | * | S | Bend | trans | -100.1 | 3 | 178.8 | -131.7 | 0 | 0 | 0 | 0 | 113.8 | ||
| 7 | L | 27.2 | Very low | 39.2 | Very low | 141 Ų | 141 | 123.6 Ų | 123.6 | 74% | 0.738 | 68% | 0.68 | S | S | * | * | trans | -103.6 | 6.9 | -173.7 | -82 | 168.4 | 0 | 0 | 0 | 115.1 | L4 G9 | L4-L7 HydrophobicContact CD1-CD1 4.48Å; L7-G9 PolarHBondContact O-N 2.97Å | ||
| 8 | V | 34.1 | Very low | 40.5 | Very low | 145 Ų | 145 | 124.6 Ų | 124.6 | 88% | 0.879 | 68% | 0.681 | S | S | * | * | S | Bend | trans | -96.9 | 73.5 | 169.4 | -172.2 | 0 | 0 | 0 | 0 | 109.6 | ||
| 9 | G | 36.6 | Very low | 42.4 | Very low | 57 Ų | 57 | 119.2 Ų | 119.2 | 59% | 0.588 | 66% | 0.658 | S | S | * | * | trans | 79.3 | 73.6 | 140.1 | 0 | 0 | 0 | 0 | 0 | 117.1 | L7 K11 | L7-G9 PolarHBondContact O-N 2.97Å; G9-K11 PolarHBondContact O-N 2.97Å | ||
| 10 | Y | 35.9 | Very low | 44.1 | Very low | 237 Ų | 237 | 115 Ų | 115 | 93% | 0.929 | 64% | 0.635 | S | S | * | * | trans | -63.7 | 76.4 | 144.4 | -139.1 | -91.1 | 0 | 0 | 0 | 107.5 | S12 | Y10-S12 PolarHBondContact O-N 3.49Š| ||
| 11 | K | 42 | Very low | 45.9 | Very low | 98 Ų | 98 | 112.1 Ų | 112.1 | 43% | 0.426 | 63% | 0.626 | S | S | . | * | trans | -57.8 | 123.7 | 166.6 | -93.8 | -172.8 | -172.6 | 173 | 0 | 105.6 | G9 M13 S15 I16 E281 | G9-K11 PolarHBondContact O-N 2.97Å; K11-M13 PolarHBondContact O-N 3.35Å; K11-S15 WeakPolarHBondContact CB-OG 3.41Å; K11-I16 HydrophobicContact CB-CD1 3.89Å; K11-I16 HydrophobicContact CB-CG1 3.56Å; K11-I16 HydrophobicContact CD-CG1 4.11Å; K11-I16 WeakPolarHBondContact O-CD1 3.47Å; K11-E281 VanDerWaalsContact NZ-CD 3.33Å; K11-E281 IonicContact NZ-OE1 3Å; K11-E281 PolarHBondContact NZ-OE1 3.24Å; K11-E281 IonicContact NZ-OE2 2.92Å; K11-E281 PolarHBondContact NZ-OE2 3Å | ||
| 12 | S | 40.6 | Very low | 48.4 | Very low | 65 Ų | 65 | 106.2 Ų | 106.2 | 46% | 0.455 | 60% | 0.598 | S | S | . | * | trans | -54 | 135.5 | 176 | 58.1 | 0 | 0 | 0 | 0 | 108.9 | Y10 S15 I16 | Y10-S12 PolarHBondContact O-N 3.49Å; S12-S15 PolarHBondContact N-OG 2.95Å; S12-S15 WeakPolarHBondContact O-CA 3.39Å; S12-S15 WeakPolarHBondContact O-CB 3.46Å; S12-S15 PolarHBondContact O-N 3.21Å; S12-S15 PolarHBondContact O-OG 2.63Å; S12-S15 PolarHBondContact OG-OG 2.97Å; S12-I16 PolarHBondContact O-N 3.49Å | ||
| 13 | M | 48.8 | Very low | 50.9 | Low | 146 Ų | 146 | 101.2 Ų | 101.2 | 72% | 0.719 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -40.3 | -43.8 | 177.3 | -164.8 | 98.7 | 109 | 0 | 0 | 113.6 | K11 S15 I16 I17 | K11-M13 PolarHBondContact O-N 3.35Å; M13-S15 PolarHBondContact O-N 3.14Å; M13-I16 PolarHBondContact O-N 2.88Å; M13-I17 HydrophobicContact CG-CD1 3.96Å; M13-I17 VanDerWaalsContact O-CG1 3.3Å; M13-I17 WeakPolarHBondContact O-CG1 3.27Å; M13-I17 PolarHBondContact O-N 3.14Å |
| 14 | P | 48.5 | Very low | 53.7 | Low | 90 Ų | 90 | 97 Ų | 97 | 58% | 0.584 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -61.8 | -34.9 | 174.6 | 17.7 | -29.9 | 0 | 0 | 0 | 115 | I17 M18 | P14-I17 PolarHBondContact O-N 3.36Å; P14-M18 WeakPolarHBondContact O-CB 3.46Å; P14-M18 PolarHBondContact O-N 2.83Å |
| 15 | S | 55.3 | Low | 56.7 | Low | 39 Ų | 39 | 93.9 Ų | 93.9 | 27% | 0.273 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -69.6 | -31.4 | 176 | 69.6 | 0 | 0 | 0 | 0 | 113.3 | K11 S12 M13 G19 | K11-S15 WeakPolarHBondContact CB-OG 3.41Å; S12-S15 PolarHBondContact N-OG 2.95Å; S12-S15 WeakPolarHBondContact O-CA 3.39Å; S12-S15 WeakPolarHBondContact O-CB 3.46Å; S12-S15 PolarHBondContact O-N 3.21Å; S12-S15 PolarHBondContact O-OG 2.63Å; S12-S15 PolarHBondContact OG-OG 2.97Å; M13-S15 PolarHBondContact O-N 3.14Å; S15-G19 PolarHBondContact O-N 3.09Å; S15-G19 VanDerWaalsContact O-N 3.08Å |
| 16 | I | 57.1 | Low | 59.6 | Low | 64 Ų | 64 | 88 Ų | 88 | 33% | 0.328 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -73.1 | -42.8 | 175.3 | -57.8 | 178.5 | 0 | 0 | 0 | 110.5 | K11 S12 M13 G19 T20 | K11-I16 HydrophobicContact CB-CD1 3.89Å; K11-I16 HydrophobicContact CB-CG1 3.56Å; K11-I16 HydrophobicContact CD-CG1 4.11Å; K11-I16 WeakPolarHBondContact O-CD1 3.47Å; S12-I16 PolarHBondContact O-N 3.49Å; M13-I16 PolarHBondContact O-N 2.88Å; I16-G19 PolarHBondContact O-N 2.95Å; I16-T20 WeakPolarHBondContact O-CB 3.25Å; I16-T20 PolarHBondContact O-N 3.3Å; I16-T20 PolarHBondContact O-OG1 3Å |
| 17 | I | 60.8 | Low | 62.4 | Low | 109 Ų | 109 | 82.3 Ų | 82.3 | 56% | 0.559 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -63.3 | -44 | 177.4 | -67 | 165.5 | 0 | 0 | 0 | 110.3 | M13 P14 T20 A21 | M13-I17 HydrophobicContact CG-CD1 3.96Å; M13-I17 VanDerWaalsContact O-CG1 3.3Å; M13-I17 WeakPolarHBondContact O-CG1 3.27Å; M13-I17 PolarHBondContact O-N 3.14Å; P14-I17 PolarHBondContact O-N 3.36Å; I17-T20 PolarHBondContact O-N 3.07Å; I17-A21 WeakPolarHBondContact O-CB 3.46Å; I17-A21 PolarHBondContact O-N 2.96Å |
| 18 | M | 62.6 | Low | 65.4 | Low | 142 Ų | 142 | 78.2 Ų | 78.2 | 70% | 0.7 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -64.5 | -41.1 | 177.5 | -166.2 | 171.9 | 71.7 | 0 | 0 | 112 | P14 F22 | P14-M18 WeakPolarHBondContact O-CB 3.46Å; P14-M18 PolarHBondContact O-N 2.83Å; M18-F22 VanDerWaalsContact O-CB 3.23Å; M18-F22 WeakPolarHBondContact O-CB 3.39Å; M18-F22 PolarHBondContact O-N 3.28Å |
| 19 | G | 75.2 | Confident | 68.1 | Low | 22 Ų | 22 | 75.4 Ų | 75.4 | 23% | 0.227 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -64.9 | -37.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | S15 I16 A23 | S15-G19 PolarHBondContact O-N 3.09Å; S15-G19 VanDerWaalsContact O-N 3.08Å; I16-G19 PolarHBondContact O-N 2.95Å; G19-A23 WeakPolarHBondContact O-CB 3.49Å; G19-A23 PolarHBondContact O-N 3.32Å |
| 20 | T | 77 | Confident | 70.8 | Confident | 34 Ų | 34 | 72.8 Ų | 72.8 | 21% | 0.209 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -69.9 | -48.2 | 178 | -59.4 | 0 | 0 | 0 | 0 | 111.8 | I16 I17 F22 A23 V24 C282 | I16-T20 WeakPolarHBondContact O-CB 3.25Å; I16-T20 PolarHBondContact O-N 3.3Å; I16-T20 PolarHBondContact O-OG1 3Å; I17-T20 PolarHBondContact O-N 3.07Å; T20-F22 VanDerWaalsContact C-N 3.29Å; T20-F22 PolarHBondContact O-N 2.8Å; T20-A23 PolarHBondContact O-N 3.49Å; T20-V24 WeakPolarHBondContact O-CG2 3.42Å; T20-V24 PolarHBondContact O-N 2.84Å; T20-C282 WeakPolarHBondContact CG2-SG 3.44Å |
| 21 | A | 82.2 | Confident | 73.3 | Confident | 55 Ų | 55 | 61.8 Ų | 61.8 | 46% | 0.455 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -59.6 | -43.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | I17 A23 V24 V25 | I17-A21 WeakPolarHBondContact O-CB 3.46Å; I17-A21 PolarHBondContact O-N 2.96Å; A21-A23 PolarHBondContact O-N 2.88Å; A21-V24 PolarHBondContact O-N 3.27Å; A21-V25 WeakPolarHBondContact O-CG2 3.32Å; A21-V25 PolarHBondContact O-N 3.38Å |
| 22 | F | 86.2 | Confident | 75.5 | Confident | 122 Ų | 122 | 58.3 Ų | 58.3 | 54% | 0.535 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -59.1 | -45.9 | 174.2 | 179.7 | -108.8 | 0 | 0 | 0 | 112.3 | M18 T20 V24 V25 L26 | M18-F22 VanDerWaalsContact O-CB 3.23Å; M18-F22 WeakPolarHBondContact O-CB 3.39Å; M18-F22 PolarHBondContact O-N 3.28Å; T20-F22 VanDerWaalsContact C-N 3.29Å; T20-F22 PolarHBondContact O-N 2.8Å; F22-V24 PolarHBondContact O-N 3.35Å; F22-V25 PolarHBondContact O-N 3.08Å; F22-L26 HydrophobicContact CD1-CD1 3.86Å; F22-L26 HydrophobicContact CD1-CG 4.36Å; F22-L26 HydrophobicContact CE1-CD1 3.35Å; F22-L26 HydrophobicContact CE1-CG 4.03Å; F22-L26 HydrophobicContact CE2-CD1 4.4Å; F22-L26 HydrophobicContact CE2-CD2 4.22Å; F22-L26 HydrophobicContact CE2-CG 4.24Å; F22-L26 HydrophobicContact CZ-CD1 3.66Å; F22-L26 HydrophobicContact CZ-CD2 4Å; F22-L26 HydrophobicContact CZ-CG 3.96Å; F22-L26 WeakPolarHBondContact O-CG 3.27Å; F22-L26 PolarHBondContact O-N 2.96Å |
| 23 | A | 85.8 | Confident | 77.9 | Confident | 0 Ų | 0 | 57.5 Ų | 57.5 | 0% | 0 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -60.9 | -42.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | G19 T20 A21 L26 V27 I277 L278 | G19-A23 WeakPolarHBondContact O-CB 3.49Å; G19-A23 PolarHBondContact O-N 3.32Å; T20-A23 PolarHBondContact O-N 3.49Å; A21-A23 PolarHBondContact O-N 2.88Å; A23-L26 PolarHBondContact O-N 3.19Å; A23-V27 VanDerWaalsContact O-CG2 3.29Å; A23-V27 WeakPolarHBondContact O-CG2 3.32Å; A23-V27 PolarHBondContact O-N 3.38Å; A23-I277 HydrophobicContact CB-CB 4.12Å; A23-I277 HydrophobicContact CB-CG2 3.73Å; A23-L278 HydrophobicContact CB-CB 4.33Å; A23-L278 HydrophobicContact CB-CD1 4.17Å |
| 24 | V | 87.5 | Confident | 80 | Confident | 41 Ų | 41 | 51.2 Ų | 51.2 | 25% | 0.248 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -61.4 | -46.6 | 176 | 174.2 | 0 | 0 | 0 | 0 | 110.8 | T20 A21 F22 L26 V27 F28 L278 V290 | T20-V24 WeakPolarHBondContact O-CG2 3.42Å; T20-V24 PolarHBondContact O-N 2.84Å; A21-V24 PolarHBondContact O-N 3.27Å; F22-V24 PolarHBondContact O-N 3.35Å; V24-L26 PolarHBondContact O-N 3.37Å; V24-V27 PolarHBondContact O-N 3.03Å; V24-F28 HydrophobicContact CG1-CD2 3.79Å; V24-F28 HydrophobicContact CG1-CE2 3.9Å; V24-F28 WeakPolarHBondContact O-CD2 3.24Å; V24-F28 PolarHBondContact O-N 3.37Å; V24-L278 HydrophobicContact CG2-CD1 3.98Å; V24-V290 HydrophobicContact CG1-CG1 4.43Å; V24-V290 HydrophobicContact CG2-CG1 4.44Å; V24-V290 HydrophobicContact CG2-CG2 3.95Å |
| 25 | V | 89.1 | Confident | 81.8 | Confident | 85 Ų | 85 | 48.7 Ų | 48.7 | 52% | 0.515 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -59.6 | -46.1 | 177.1 | 171.5 | 0 | 0 | 0 | 0 | 111 | A21 F22 V27 F28 V29 | A21-V25 WeakPolarHBondContact O-CG2 3.32Å; A21-V25 PolarHBondContact O-N 3.38Å; F22-V25 PolarHBondContact O-N 3.08Å; V25-V27 VanDerWaalsContact C-N 3.29Å; V25-V27 PolarHBondContact O-N 2.9Å; V25-F28 PolarHBondContact O-N 3.14Å; V25-V29 HydrophobicContact CG1-CG2 4.01Å; V25-V29 WeakPolarHBondContact O-CB 3.27Å; V25-V29 WeakPolarHBondContact O-CG2 3.34Å; V25-V29 PolarHBondContact O-N 3.39Å |
| 26 | L | 89.5 | Confident | 83.3 | Confident | 37 Ų | 37 | 48.3 Ų | 48.3 | 19% | 0.194 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -59.4 | -39.5 | 176.5 | -71 | -179.8 | 0 | 0 | 0 | 112.5 | F22 A23 V24 G30 V270 I277 | F22-L26 HydrophobicContact CD1-CD1 3.86Å; F22-L26 HydrophobicContact CD1-CG 4.36Å; F22-L26 HydrophobicContact CE1-CD1 3.35Å; F22-L26 HydrophobicContact CE1-CG 4.03Å; F22-L26 HydrophobicContact CE2-CD1 4.4Å; F22-L26 HydrophobicContact CE2-CD2 4.22Å; F22-L26 HydrophobicContact CE2-CG 4.24Å; F22-L26 HydrophobicContact CZ-CD1 3.66Å; F22-L26 HydrophobicContact CZ-CD2 4Å; F22-L26 HydrophobicContact CZ-CG 3.96Å; F22-L26 WeakPolarHBondContact O-CG 3.27Å; F22-L26 PolarHBondContact O-N 2.96Å; A23-L26 PolarHBondContact O-N 3.19Å; V24-L26 PolarHBondContact O-N 3.37Å; L26-G30 WeakPolarHBondContact O-CA 3.27Å; L26-G30 PolarHBondContact O-N 3Å; L26-V270 HydrophobicContact CB-CG1 4.37Å; L26-V270 HydrophobicContact CD2-CG1 3.89Å; L26-I277 HydrophobicContact CD1-CD1 4.22Å |
| 27 | V | 89.3 | Confident | 84.9 | Confident | 0 Ų | 0 | 45.5 Ų | 45.5 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -65.5 | -46.8 | 177.5 | 172.1 | 0 | 0 | 0 | 0 | 111.1 | A23 V24 V25 C31 V275 V290 R294 | A23-V27 VanDerWaalsContact O-CG2 3.29Å; A23-V27 WeakPolarHBondContact O-CG2 3.32Å; A23-V27 PolarHBondContact O-N 3.38Å; V24-V27 PolarHBondContact O-N 3.03Å; V25-V27 VanDerWaalsContact C-N 3.29Å; V25-V27 PolarHBondContact O-N 2.9Å; V27-C31 WeakPolarHBondContact O-CB 3.34Å; V27-C31 PolarHBondContact O-N 3.22Å; V27-C31 PolarHBondContact O-SG 3.25Å; V27-V275 HydrophobicContact CG1-CG2 4.3Å; V27-V275 HydrophobicContact CG2-CG2 3.88Å; V27-V275 VanDerWaalsContact CG2-N 3.34Å; V27-V290 HydrophobicContact CB-CG1 4.23Å; V27-V290 HydrophobicContact CG1-CG1 3.89Å; V27-R294 HydrophobicContact CG1-CB 4.38Å; V27-R294 HydrophobicContact CG1-CG 4.15Å |
| 28 | F | 90.3 | Very high | 86.3 | Confident | 55 Ų | 55 | 43 Ų | 43 | 24% | 0.241 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -68.9 | -50.2 | -180 | -85.3 | -83.2 | 0 | 0 | 0 | 111.8 | V24 V25 C32 V290 L293 R294 V297 | V24-F28 HydrophobicContact CG1-CD2 3.79Å; V24-F28 HydrophobicContact CG1-CE2 3.9Å; V24-F28 WeakPolarHBondContact O-CD2 3.24Å; V24-F28 PolarHBondContact O-N 3.37Å; V25-F28 PolarHBondContact O-N 3.14Å; F28-C32 WeakPolarHBondContact O-CB 3.12Å; F28-C32 PolarHBondContact O-N 3.43Å; F28-C32 PolarHBondContact O-SG 3.38Å; F28-V290 HydrophobicContact CE2-CG1 4.09Å; F28-L293 HydrophobicContact CZ-CB 3.86Å; F28-R294 HydrophobicContact CD1-CB 4.47Å; F28-R294 HydrophobicContact CE1-CB 4.15Å; F28-R294 HydrophobicContact CZ-CB 4.36Å; F28-V297 HydrophobicContact CE1-CB 4.21Å; F28-V297 HydrophobicContact CE1-CG2 4.02Å |
| 29 | V | 90.6 | Very high | 87.3 | Confident | 86 Ų | 86 | 37 Ų | 37 | 52% | 0.521 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -61.7 | -54.2 | 179.2 | 174.7 | 0 | 0 | 0 | 0 | 110.3 | V25 C31 S33 | V25-V29 HydrophobicContact CG1-CG2 4.01Å; V25-V29 WeakPolarHBondContact O-CB 3.27Å; V25-V29 WeakPolarHBondContact O-CG2 3.34Å; V25-V29 PolarHBondContact O-N 3.39Å; V29-C31 PolarHBondContact O-N 2.91Å; V29-S33 WeakPolarHBondContact O-CB 3.43Å; V29-S33 PolarHBondContact O-N 3.05Å; V29-S33 PolarHBondContact O-OG 2.82Å |
| 30 | G | 91.8 | Very high | 88 | Confident | 1 Ų | 1 | 38.3 Ų | 38.3 | 1% | 0.01 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -60.9 | -51 | -177.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | L26 N34 T267 | L26-G30 WeakPolarHBondContact O-CA 3.27Å; L26-G30 PolarHBondContact O-N 3Å; G30-N34 VanDerWaalsContact O-CB 3.25Å; G30-N34 WeakPolarHBondContact O-CB 3.37Å; G30-N34 PolarHBondContact O-N 3.07Å; G30-T267 CarbonylContact C-O 3.49Å; G30-T267 WeakPolarHBondContact O-CB 3.45Å |
| 31 | C | 89.1 | Confident | 88.6 | Confident | 6 Ų | 6 | 36.7 Ų | 36.7 | 4% | 0.041 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -78 | -34.9 | -173.1 | -48.2 | 0 | 0 | 0 | 0 | 112.9 | V27 V29 N34 V35 C271 R294 | V27-C31 WeakPolarHBondContact O-CB 3.34Å; V27-C31 PolarHBondContact O-N 3.22Å; V27-C31 PolarHBondContact O-SG 3.25Å; V29-C31 PolarHBondContact O-N 2.91Å; C31-N34 PolarHBondContact O-N 3.06Å; C31-V35 WeakPolarHBondContact O-CG2 3.44Å; C31-V35 PolarHBondContact O-N 3.41Å; C31-V35 VanDerWaalsContact O-N 3.09Å; C31-C271 HydrophobicContact CB-CB 3.93Å; C31-C271 WeakPolarHBondContact CB-SG 3.29Å; C31-C271 VanDerWaalsContact SG-CA 3.55Å; C31-C271 WeakPolarHBondContact SG-CB 3.39Å; C31-C271 CovalentContact SG-SG 2.01Å; C31-C271 PolarHBondContact SG-SG 3.41Å; C31-R294 VanDerWaalsContact CB-CD 3.41Å; C31-R294 HydrophobicContact CB-CG 3.85Å; C31-R294 WeakPolarHBondContact SG-CD 3.44Å; C31-R294 PolarHBondContact SG-NH1 3.49Å |
| 32 | C | 87.9 | Confident | 88.7 | Confident | 25 Ų | 25 | 36.1 Ų | 36.1 | 17% | 0.169 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -67.8 | -46.1 | 175.2 | -65.2 | 0 | 0 | 0 | 0 | 110.4 | F28 N34 V35 V36 | F28-C32 WeakPolarHBondContact O-CB 3.12Å; F28-C32 PolarHBondContact O-N 3.43Å; F28-C32 PolarHBondContact O-SG 3.38Å; C32-N34 VanDerWaalsContact C-N 3.26Å; C32-N34 PolarHBondContact O-N 3.49Å; C32-V35 PolarHBondContact O-N 2.94Å; C32-V35 VanDerWaalsContact O-N 3.15Å; C32-V36 WeakPolarHBondContact O-CG2 3.48Å; C32-V36 PolarHBondContact O-N 3.43Å |
| 33 | S | 91.4 | Very high | 88.6 | Confident | 49 Ų | 49 | 36.2 Ų | 36.2 | 34% | 0.343 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -62.7 | -33 | 175.5 | -61.9 | 0 | 0 | 0 | 0 | 112.7 | V29 V36 S37 | V29-S33 WeakPolarHBondContact O-CB 3.43Å; V29-S33 PolarHBondContact O-N 3.05Å; V29-S33 PolarHBondContact O-OG 2.82Å; S33-V36 PolarHBondContact O-N 3.27Å; S33-S37 PolarHBondContact O-N 3Å; S33-S37 PolarHBondContact O-OG 2.85Å |
| 34 | N | 92.2 | Very high | 88.7 | Confident | 14 Ų | 14 | 41.9 Ų | 41.9 | 8% | 0.075 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -62.3 | -45.7 | 172.4 | -178.6 | -96.6 | 0 | 0 | 0 | 112 | G30 C31 C32 V36 S37 L38 N264 T267 Q268 | G30-N34 VanDerWaalsContact O-CB 3.25Å; G30-N34 WeakPolarHBondContact O-CB 3.37Å; G30-N34 PolarHBondContact O-N 3.07Å; C31-N34 PolarHBondContact O-N 3.06Å; C32-N34 VanDerWaalsContact C-N 3.26Å; C32-N34 PolarHBondContact O-N 3.49Å; N34-V36 VanDerWaalsContact C-N 3.34Å; N34-V36 PolarHBondContact O-N 2.73Å; N34-S37 WeakPolarHBondContact CA-OG 3.48Å; N34-S37 PolarHBondContact O-N 3.35Å; N34-S37 PolarHBondContact O-OG 3.47Å; N34-L38 VanDerWaalsContact O-CB 3.32Å; N34-L38 WeakPolarHBondContact O-CB 3.4Å; N34-L38 PolarHBondContact O-N 3.5Å; N34-N264 VanDerWaalsContact ND2-CG 3.31Å; N34-N264 PolarHBondContact ND2-ND2 2.81Å; N34-N264 VanDerWaalsContact ND2-ND2 3.16Å; N34-N264 PolarHBondContact ND2-O 3.33Å; N34-N264 PolarHBondContact ND2-OD1 3.17Å; N34-N264 PolarHBondContact O-ND2 3.12Å; N34-T267 VanDerWaalsContact CA-OG1 3.29Å; N34-T267 WeakPolarHBondContact CA-OG1 3.45Å; N34-T267 WeakPolarHBondContact CB-OG1 3.29Å; N34-Q268 WeakPolarHBondContact ND2-CB 3.4Å; N34-Q268 PolarHBondContact ND2-OE1 3.16Å; N34-Q268 PolarHBondContact OD1-OE1 3.08Å |
| 35 | V | 86.2 | Confident | 88.6 | Confident | 36 Ų | 36 | 41.8 Ų | 41.8 | 22% | 0.218 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -62.4 | -42.1 | 176.7 | 170.7 | 0 | 0 | 0 | 0 | 111.2 | C31 C32 L38 E39 | C31-V35 WeakPolarHBondContact O-CG2 3.44Å; C31-V35 PolarHBondContact O-N 3.41Å; C31-V35 VanDerWaalsContact O-N 3.09Å; C32-V35 PolarHBondContact O-N 2.94Å; C32-V35 VanDerWaalsContact O-N 3.15Å; V35-L38 PolarHBondContact O-N 3.2Å; V35-E39 WeakPolarHBondContact O-CB 3.16Å; V35-E39 PolarHBondContact O-N 2.83Å |
| 36 | V | 87.9 | Confident | 88.4 | Confident | 32 Ų | 32 | 42.6 Ų | 42.6 | 19% | 0.194 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -61.1 | -49.9 | 177.7 | 176 | 0 | 0 | 0 | 0 | 111.7 | C32 S33 N34 L38 E39 L40 F301 F306 | C32-V36 WeakPolarHBondContact O-CG2 3.48Å; C32-V36 PolarHBondContact O-N 3.43Å; S33-V36 PolarHBondContact O-N 3.27Å; N34-V36 VanDerWaalsContact C-N 3.34Å; N34-V36 PolarHBondContact O-N 2.73Å; V36-L38 VanDerWaalsContact C-N 3.31Å; V36-L38 PolarHBondContact O-N 2.98Å; V36-E39 PolarHBondContact O-N 3.11Å; V36-L40 HydrophobicContact CG1-CD1 4.31Å; V36-L40 WeakPolarHBondContact O-CG 3.41Å; V36-L40 PolarHBondContact O-N 2.89Å; V36-F301 HydrophobicContact CB-CE1 4.42Å; V36-F301 HydrophobicContact CG1-CE1 4.41Å; V36-F301 HydrophobicContact CG2-CD1 3.59Å; V36-F301 HydrophobicContact CG2-CE1 3.22Å; V36-F301 HydrophobicContact CG2-CZ 3.98Å; V36-F306 HydrophobicContact CG1-CZ 4.14Å |
| 37 | S | 91.1 | Very high | 88 | Confident | 4 Ų | 4 | 42.8 Ų | 42.8 | 3% | 0.028 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -64.6 | -35.4 | 178.2 | 51.4 | 0 | 0 | 0 | 0 | 112.5 | S33 N34 L41 N264 | S33-S37 PolarHBondContact O-N 3Å; S33-S37 PolarHBondContact O-OG 2.85Å; N34-S37 WeakPolarHBondContact CA-OG 3.48Å; N34-S37 PolarHBondContact O-N 3.35Å; N34-S37 PolarHBondContact O-OG 3.47Å; S37-L41 WeakPolarHBondContact O-CD1 3.13Å; S37-L41 WeakPolarHBondContact O-CG 3.37Å; S37-L41 PolarHBondContact O-N 2.75Å; S37-L41 VanDerWaalsContact O-N 3.17Å; S37-N264 WeakPolarHBondContact OG-CA 3.36Å; S37-N264 WeakPolarHBondContact OG-CB 3.43Å; S37-N264 PolarHBondContact OG-ND2 3.46Å |
| 38 | L | 89 | Confident | 87.9 | Confident | 56 Ų | 56 | 42.8 Ų | 42.8 | 29% | 0.293 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -64.2 | -45.5 | 174.7 | -179.7 | 64.3 | 0 | 0 | 0 | 111.5 | N34 V35 V36 L40 L41 V42 V52 N264 | N34-L38 VanDerWaalsContact O-CB 3.32Å; N34-L38 WeakPolarHBondContact O-CB 3.4Å; N34-L38 PolarHBondContact O-N 3.5Å; V35-L38 PolarHBondContact O-N 3.2Å; V36-L38 VanDerWaalsContact C-N 3.31Å; V36-L38 PolarHBondContact O-N 2.98Å; L38-L40 VanDerWaalsContact C-N 3.35Å; L38-L40 PolarHBondContact O-N 3.3Å; L38-L41 WeakPolarHBondContact O-CB 3.2Å; L38-L41 PolarHBondContact O-N 2.93Å; L38-V42 HydrophobicContact CD1-CG2 4.11Å; L38-V42 HydrophobicContact CG-CG2 4.34Å; L38-V42 WeakPolarHBondContact O-CG2 3.39Å; L38-V42 PolarHBondContact O-N 3.21Å; L38-V52 HydrophobicContact CD1-CB 4.45Å; L38-V52 HydrophobicContact CD1-CG1 4Å; L38-V52 HydrophobicContact CD1-CG2 4.4Å; L38-N264 PolarHBondContact N-ND2 3.48Å |
| 39 | E | 85 | Confident | 87.7 | Confident | 17 Ų | 17 | 41 Ų | 41 | 8% | 0.079 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -64.3 | -40.3 | 179.6 | -171.5 | 89.7 | -175 | 0 | 0 | 111.2 | V35 V36 L41 V42 R43 F306 N308 | V35-E39 WeakPolarHBondContact O-CB 3.16Å; V35-E39 PolarHBondContact O-N 2.83Å; V36-E39 PolarHBondContact O-N 3.11Å; E39-L41 VanDerWaalsContact C-N 3.3Å; E39-L41 PolarHBondContact O-N 2.77Å; E39-V42 PolarHBondContact O-N 3.42Å; E39-R43 HydrophobicContact CG-CG 4.4Å; E39-R43 WeakPolarHBondContact O-CB 3.31Å; E39-R43 VanDerWaalsContact O-CG 3.26Å; E39-R43 WeakPolarHBondContact O-CG 3.24Å; E39-R43 PolarHBondContact O-N 3.29Å; E39-R43 IonicContact OE1-NE 3.46Å; E39-R43 PolarHBondContact OE1-NE 3.34Å; E39-F306 HydrophobicContact CB-CD1 4.43Å; E39-F306 HydrophobicContact CB-CD2 4.28Å; E39-F306 HydrophobicContact CB-CE1 3.9Å; E39-F306 HydrophobicContact CB-CE2 3.74Å; E39-F306 HydrophobicContact CB-CZ 3.52Å; E39-F306 HydrophobicContact CG-CB 4.38Å; E39-F306 HydrophobicContact CG-CD1 3.56Å; E39-F306 HydrophobicContact CG-CD2 3.69Å; E39-F306 HydrophobicContact CG-CE1 3.52Å; E39-F306 HydrophobicContact CG-CE2 3.65Å; E39-F306 HydrophobicContact CG-CG 3.62Å; E39-F306 HydrophobicContact CG-CZ 3.56Å; E39-N308 PolarHBondContact OE1-ND2 3.04Å |
| 40 | L | 88.8 | Confident | 87.6 | Confident | 50 Ų | 50 | 37.9 Ų | 37.9 | 26% | 0.262 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -58.9 | -41 | 174.2 | -70.7 | 171.8 | 0 | 0 | 0 | 112 | V36 L38 E44 Y260 F306 | V36-L40 HydrophobicContact CG1-CD1 4.31Å; V36-L40 WeakPolarHBondContact O-CG 3.41Å; V36-L40 PolarHBondContact O-N 2.89Å; L38-L40 VanDerWaalsContact C-N 3.35Å; L38-L40 PolarHBondContact O-N 3.3Å; L40-E44 PolarHBondContact O-N 3.15Å; L40-Y260 HydrophobicContact CB-CD2 4.01Å; L40-Y260 HydrophobicContact CB-CE2 4.05Å; L40-Y260 HydrophobicContact CD1-CD1 4.45Å; L40-Y260 HydrophobicContact CD1-CE1 4.13Å; L40-Y260 HydrophobicContact CD1-CE2 4.36Å; L40-F306 HydrophobicContact CD2-CE1 4Å; L40-F306 HydrophobicContact CG-CE1 4.28Å; L40-F306 HydrophobicContact CG-CZ 4.38Å |
| 41 | L | 90.2 | Very high | 87.7 | Confident | 0 Ų | 0 | 38.1 Ų | 38.1 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -67.6 | -48.1 | 176.7 | -71.8 | 162.3 | 0 | 0 | 0 | 112.1 | S37 L38 E39 R43 E44 F45 V52 F239 M257 N264 | S37-L41 WeakPolarHBondContact O-CD1 3.13Å; S37-L41 WeakPolarHBondContact O-CG 3.37Å; S37-L41 PolarHBondContact O-N 2.75Å; S37-L41 VanDerWaalsContact O-N 3.17Å; L38-L41 WeakPolarHBondContact O-CB 3.2Å; L38-L41 PolarHBondContact O-N 2.93Å; E39-L41 VanDerWaalsContact C-N 3.3Å; E39-L41 PolarHBondContact O-N 2.77Å; L41-R43 VanDerWaalsContact C-N 3.3Å; L41-R43 PolarHBondContact O-N 3.09Å; L41-E44 PolarHBondContact O-N 3.17Å; L41-F45 PolarHBondContact O-N 3.34Å; L41-V52 HydrophobicContact CD1-CG2 3.77Å; L41-F239 HydrophobicContact CD2-CE2 3.96Å; L41-F239 HydrophobicContact CD2-CZ 3.71Å; L41-M257 HydrophobicContact CD2-CB 4.42Å; L41-M257 HydrophobicContact CD2-SD 4.08Å; L41-N264 HydrophobicContact CD1-CB 4.24Å |
| 42 | V | 84.6 | Confident | 87.9 | Confident | 43 Ų | 43 | 37.9 Ų | 37.9 | 26% | 0.261 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -68 | -30.5 | -176.2 | 171.7 | 0 | 0 | 0 | 0 | 112.1 | L38 E39 F45 P46 | L38-V42 HydrophobicContact CD1-CG2 4.11Å; L38-V42 HydrophobicContact CG-CG2 4.34Å; L38-V42 WeakPolarHBondContact O-CG2 3.39Å; L38-V42 PolarHBondContact O-N 3.21Å; E39-V42 PolarHBondContact O-N 3.42Å; V42-F45 CarbonylContact O-C 3.5Å; V42-P46 WeakPolarHBondContact O-CA 3.44Å |
| 43 | R | 84 | Confident | 88 | Confident | 123 Ų | 123 | 37.9 Ų | 37.9 | 46% | 0.464 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -67.3 | -42.2 | 175.8 | -80.7 | 179 | 168.7 | -128.2 | -26.7 | 113 | E39 L41 F306 | E39-R43 HydrophobicContact CG-CG 4.4Å; E39-R43 WeakPolarHBondContact O-CB 3.31Å; E39-R43 VanDerWaalsContact O-CG 3.26Å; E39-R43 WeakPolarHBondContact O-CG 3.24Å; E39-R43 PolarHBondContact O-N 3.29Å; E39-R43 IonicContact OE1-NE 3.46Å; E39-R43 PolarHBondContact OE1-NE 3.34Å; L41-R43 VanDerWaalsContact C-N 3.3Å; L41-R43 PolarHBondContact O-N 3.09Å; R43-F306 VanDerWaalsContact CZ-CB 3.4Å; R43-F306 VanDerWaalsContact CZ-O 3.3Å; R43-F306 PolarHBondContact NH1-O 3.29Å; R43-F306 VanDerWaalsContact NH2-CB 3.35Å; R43-F306 PolarHBondContact NH2-O 2.87Å |
| 44 | E | 86.9 | Confident | 88.1 | Confident | 119 Ų | 119 | 38.9 Ų | 38.9 | 56% | 0.556 | 21% | 0.213 | S | C | * | . | H | α-helix | trans | -76.3 | -45.8 | 179.2 | -161.9 | 78.5 | 176.1 | 0 | 0 | 111 | L40 L41 M257 | L40-E44 PolarHBondContact O-N 3.15Å; L41-E44 PolarHBondContact O-N 3.17Å; E44-M257 HydrophobicContact CB-CE 3.85Å; E44-M257 HydrophobicContact CB-SD 3.93Å; E44-M257 HydrophobicContact CG-CE 3.61Å; E44-M257 HydrophobicContact CG-SD 4.08Å |
| 45 | F | 86.8 | Confident | 88.3 | Confident | 39 Ų | 39 | 39.3 Ų | 39.3 | 17% | 0.171 | 22% | 0.218 | C | C | . | . | S | Bend | trans | -128.1 | 86.6 | -177.3 | -66 | -70.5 | 0 | 0 | 0 | 111 | L41 V42 G47 C48 L238 F239 M257 | L41-F45 PolarHBondContact O-N 3.34Å; V42-F45 CarbonylContact O-C 3.5Å; F45-G47 PolarHBondContact O-N 3.47Å; F45-C48 HydrophobicContact CB-CB 4.26Å; F45-C48 VanDerWaalsContact O-CB 3.28Å; F45-C48 WeakPolarHBondContact O-CB 3.34Å; F45-C48 PolarHBondContact O-N 3.48Å; F45-C48 VanDerWaalsContact O-N 3.16Å; F45-C48 PolarHBondContact O-SG 3.46Å; F45-C48 VanDerWaalsContact O-SG 3.39Å; F45-L238 HydrophobicContact CD1-CB 3.95Å; F45-L238 HydrophobicContact CD1-CD1 3.9Å; F45-L238 HydrophobicContact CD1-CG 4.35Å; F45-L238 HydrophobicContact CE1-CB 3.7Å; F45-L238 HydrophobicContact CE1-CD1 4.21Å; F45-L238 HydrophobicContact CE1-CD2 4.05Å; F45-L238 HydrophobicContact CE1-CG 4.2Å; F45-L238 HydrophobicContact CZ-CB 4.12Å; F45-F239 HydrophobicContact CB-CE1 4.15Å; F45-F239 AromaticContact CD2-CD1 3.95Å; F45-F239 HydrophobicContact CD2-CD1 3.95Å; F45-F239 AromaticContact CD2-CE1 3.77Å; F45-F239 HydrophobicContact CD2-CE1 3.77Å; F45-F239 HydrophobicContact CE2-CD1 4.34Å; F45-F239 HydrophobicContact CG-CD1 4.48Å; F45-F239 HydrophobicContact CG-CE1 4.16Å; F45-M257 HydrophobicContact CD2-CG 3.86Å; F45-M257 HydrophobicContact CD2-SD 3.87Å; F45-M257 HydrophobicContact CE2-CG 3.57Å; F45-M257 HydrophobicContact CE2-SD 3.99Å |
| 46 | P | 83.2 | Confident | 88.7 | Confident | 102 Ų | 102 | 38.4 Ų | 38.4 | 66% | 0.662 | 21% | 0.212 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -55.6 | 131.7 | 174.2 | -24.9 | 34.2 | 0 | 0 | 0 | 111.1 | V42 | V42-P46 WeakPolarHBondContact O-CA 3.44Š|
| 47 | G | 81.3 | Confident | 89 | Confident | 42 Ų | 42 | 37.5 Ų | 37.5 | 43% | 0.433 | 21% | 0.205 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 92.9 | -1.1 | -177.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | F45 G49 H235 | F45-G47 PolarHBondContact O-N 3.47Å; G47-G49 PolarHBondContact O-N 3.05Å; G47-H235 PolarHBondContact O-CE1 3.29Å |
| 48 | C | 87.5 | Confident | 89.2 | Confident | 0 Ų | 0 | 39.4 Ų | 39.4 | 0% | 0 | 22% | 0.217 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -67.8 | -3.1 | 176.1 | 76.5 | 0 | 0 | 0 | 0 | 114.2 | F45 N50 I51 V52 H235 F239 | F45-C48 HydrophobicContact CB-CB 4.26Å; F45-C48 VanDerWaalsContact O-CB 3.28Å; F45-C48 WeakPolarHBondContact O-CB 3.34Å; F45-C48 PolarHBondContact O-N 3.48Å; F45-C48 VanDerWaalsContact O-N 3.16Å; F45-C48 PolarHBondContact O-SG 3.46Å; F45-C48 VanDerWaalsContact O-SG 3.39Å; C48-N50 PolarHBondContact O-N 3.37Å; C48-N50 VanDerWaalsContact O-N 3.1Å; C48-I51 HydrophobicContact CB-CG2 4.06Å; C48-I51 WeakPolarHBondContact O-CG2 3.42Å; C48-I51 PolarHBondContact O-N 2.81Å; C48-V52 WeakPolarHBondContact O-CG2 3.18Å; C48-V52 PolarHBondContact O-N 3.25Å; C48-V52 VanDerWaalsContact O-N 3.15Å; C48-H235 VanDerWaalsContact CA-CD2 3.48Å; C48-H235 WeakPolarHBondContact CA-CD2 3.33Å; C48-H235 VanDerWaalsContact CB-CD2 3.49Å; C48-H235 WeakPolarHBondContact CB-CD2 3.5Å; C48-H235 PolarHBondContact N-NE2 3.28Å; C48-F239 HydrophobicContact CB-CE1 4.16Å; C48-F239 HydrophobicContact CB-CZ 3.95Å |
| 49 | G | 87 | Confident | 89.5 | Confident | 17 Ų | 17 | 40.7 Ų | 40.7 | 18% | 0.175 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -55.9 | -30.2 | -177.6 | 0 | 0 | 0 | 0 | 0 | 114 | G47 T53 | G47-G49 PolarHBondContact O-N 3.05Å; G49-T53 WeakPolarHBondContact O-CB 3.48Å; G49-T53 PolarHBondContact O-N 3.41Å; G49-T53 PolarHBondContact O-OG1 3.37Å |
| 50 | N | 88.6 | Confident | 89.8 | Confident | 21 Ų | 21 | 40 Ų | 40 | 11% | 0.112 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -69.2 | -45.6 | 178.2 | -63.5 | -36.8 | 0 | 0 | 0 | 112.4 | C48 V52 T53 F54 N98 L228 N231 I232 | C48-N50 PolarHBondContact O-N 3.37Å; C48-N50 VanDerWaalsContact O-N 3.1Å; N50-V52 VanDerWaalsContact C-N 3.34Å; N50-T53 PolarHBondContact O-N 3.3Å; N50-F54 VanDerWaalsContact O-CB 3.24Å; N50-F54 WeakPolarHBondContact O-CB 3.27Å; N50-F54 PolarHBondContact O-N 2.83Å; N50-N98 PolarHBondContact OD1-ND2 2.9Å; N50-N98 VanDerWaalsContact OD1-ND2 3.08Å; N50-L228 HydrophobicContact CB-CD1 4.49Å; N50-N231 WeakPolarHBondContact CB-OD1 3.34Å; N50-N231 PolarHBondContact ND2-OD1 3.05Å; N50-I232 HydrophobicContact CB-CG1 4.1Å |
| 51 | I | 92.6 | Very high | 90.1 | Very high | 5 Ų | 5 | 37.9 Ų | 37.9 | 3% | 0.026 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -66.2 | -38.1 | 176.9 | -176.9 | 171.1 | 0 | 0 | 0 | 111.1 | C48 F54 A55 I232 H235 C236 F239 W258 L261 | C48-I51 HydrophobicContact CB-CG2 4.06Å; C48-I51 WeakPolarHBondContact O-CG2 3.42Å; C48-I51 PolarHBondContact O-N 2.81Å; I51-F54 PolarHBondContact O-N 2.94Å; I51-A55 WeakPolarHBondContact O-CB 3.46Å; I51-A55 PolarHBondContact O-N 3.18Å; I51-I232 HydrophobicContact CB-CG2 4.14Å; I51-I232 HydrophobicContact CD1-CG2 4.46Å; I51-I232 HydrophobicContact CG1-CG2 4.12Å; I51-H235 HydrophobicContact CB-CB 4.42Å; I51-H235 HydrophobicContact CD1-CB 4.4Å; I51-H235 HydrophobicContact CG2-CB 3.8Å; I51-C236 HydrophobicContact CD1-CB 4.5Å; I51-C236 WeakPolarHBondContact CD1-SG 3.32Å; I51-F239 HydrophobicContact CD1-CD2 4.39Å; I51-F239 HydrophobicContact CD1-CE2 4.43Å; I51-F239 HydrophobicContact CG2-CE2 4.29Å; I51-F239 HydrophobicContact CG2-CZ 4.18Å; I51-W258 HydrophobicContact CD1-CH2 4.41Å; I51-L261 HydrophobicContact CG1-CD2 4.47Å |
| 52 | V | 93.4 | Very high | 90.3 | Very high | 1 Ų | 1 | 42.7 Ų | 42.7 | 1% | 0.006 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -61.8 | -51.4 | 176.2 | 177.9 | 0 | 0 | 0 | 0 | 111 | L38 L41 C48 N50 F54 A55 Q56 L261 N264 | L38-V52 HydrophobicContact CD1-CB 4.45Å; L38-V52 HydrophobicContact CD1-CG1 4Å; L38-V52 HydrophobicContact CD1-CG2 4.4Å; L41-V52 HydrophobicContact CD1-CG2 3.77Å; C48-V52 WeakPolarHBondContact O-CG2 3.18Å; C48-V52 PolarHBondContact O-N 3.25Å; C48-V52 VanDerWaalsContact O-N 3.15Å; N50-V52 VanDerWaalsContact C-N 3.34Å; V52-F54 VanDerWaalsContact C-N 3.33Å; V52-F54 PolarHBondContact O-N 3.46Å; V52-A55 PolarHBondContact O-N 3.09Å; V52-Q56 VanDerWaalsContact O-CG 3.31Å; V52-Q56 WeakPolarHBondContact O-CG 3.46Å; V52-Q56 PolarHBondContact O-N 3.4Å; V52-L261 HydrophobicContact CB-CD1 4.21Å; V52-L261 HydrophobicContact CG1-CD1 4.38Å; V52-L261 HydrophobicContact CG2-CD1 3.89Å; V52-N264 WeakPolarHBondContact CG1-OD1 3.34Å |
| 53 | T | 90.8 | Very high | 90.7 | Very high | 25 Ų | 25 | 42.7 Ų | 42.7 | 15% | 0.153 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -63.8 | -41.2 | -179.7 | -50.7 | 0 | 0 | 0 | 0 | 110.9 | G49 N50 Q56 F57 F225 | G49-T53 WeakPolarHBondContact O-CB 3.48Å; G49-T53 PolarHBondContact O-N 3.41Å; G49-T53 PolarHBondContact O-OG1 3.37Å; N50-T53 PolarHBondContact O-N 3.3Å; T53-Q56 PolarHBondContact O-N 2.97Å; T53-F57 HydrophobicContact CG2-CD1 3.79Å; T53-F57 HydrophobicContact CG2-CE1 3.53Å; T53-F57 HydrophobicContact CG2-CZ 4.07Å; T53-F57 WeakPolarHBondContact O-CB 3.24Å; T53-F57 WeakPolarHBondContact O-CD1 3.39Å; T53-F57 WeakPolarHBondContact O-CG 3.22Å; T53-F57 PolarHBondContact O-N 3.38Å; T53-F225 HydrophobicContact CG2-CE1 4.29Å; T53-F225 HydrophobicContact CG2-CZ 3.84Å |
| 54 | F | 93.8 | Very high | 91.1 | Very high | 71 Ų | 71 | 37 Ų | 37 | 31% | 0.311 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -58.1 | -50 | 175.5 | 173.5 | -105.7 | 0 | 0 | 0 | 111.7 | N50 I51 V52 Q56 F57 V58 L222 F225 I232 | N50-F54 VanDerWaalsContact O-CB 3.24Å; N50-F54 WeakPolarHBondContact O-CB 3.27Å; N50-F54 PolarHBondContact O-N 2.83Å; I51-F54 PolarHBondContact O-N 2.94Å; V52-F54 VanDerWaalsContact C-N 3.33Å; V52-F54 PolarHBondContact O-N 3.46Å; F54-Q56 VanDerWaalsContact C-N 3.35Å; F54-Q56 PolarHBondContact O-N 3.46Å; F54-F57 PolarHBondContact O-N 3.44Å; F54-F57 VanDerWaalsContact O-N 3.15Å; F54-V58 HydrophobicContact CD1-CG2 4.43Å; F54-V58 HydrophobicContact CD2-CG2 4.17Å; F54-V58 HydrophobicContact CE1-CG2 4.02Å; F54-V58 HydrophobicContact CE2-CG2 3.74Å; F54-V58 HydrophobicContact CZ-CG2 3.65Å; F54-V58 WeakPolarHBondContact O-CG2 3.05Å; F54-V58 PolarHBondContact O-N 2.96Å; F54-L222 HydrophobicContact CD2-CD2 4.29Å; F54-L222 HydrophobicContact CE2-CD2 4.23Å; F54-F225 HydrophobicContact CB-CD1 3.84Å; F54-F225 HydrophobicContact CB-CE1 3.97Å; F54-F225 HydrophobicContact CB-CG 4.32Å; F54-F225 HydrophobicContact CD2-CB 3.83Å; F54-F225 HydrophobicContact CD2-CD1 4.2Å; F54-F225 HydrophobicContact CD2-CD2 4.21Å; F54-F225 AromaticContact CD2-CG 3.83Å; F54-F225 HydrophobicContact CD2-CG 3.83Å; F54-F225 HydrophobicContact CE2-CB 4.39Å; F54-F225 HydrophobicContact CG-CD1 4.48Å; F54-I232 HydrophobicContact CB-CD1 4.11Å; F54-I232 HydrophobicContact CD1-CG2 4.46Å; F54-I232 HydrophobicContact CG-CD1 4.21Å |
| 55 | A | 95.5 | Very high | 91.4 | Very high | 22 Ų | 22 | 35.2 Ų | 35.2 | 18% | 0.182 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -61.7 | -41.6 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | I51 V52 F57 F59 L261 V265 | I51-A55 WeakPolarHBondContact O-CB 3.46Å; I51-A55 PolarHBondContact O-N 3.18Å; V52-A55 PolarHBondContact O-N 3.09Å; A55-F57 VanDerWaalsContact C-N 3.34Å; A55-F57 PolarHBondContact O-N 3.02Å; A55-F59 WeakPolarHBondContact O-CB 3.13Å; A55-F59 PolarHBondContact O-N 3.29Å; A55-L261 HydrophobicContact CB-CD1 4Å; A55-L261 HydrophobicContact CB-CD2 4.28Å; A55-L261 HydrophobicContact CB-CG 4.35Å; A55-V265 HydrophobicContact CB-CG2 3.77Å |
| 56 | Q | 95.1 | Very high | 91.7 | Very high | 18 Ų | 18 | 36.9 Ų | 36.9 | 8% | 0.084 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -59.8 | -44.5 | 173.9 | -69.8 | 175 | 0.6 | 0 | 0 | 111.6 | V52 T53 F54 F59 I60 N264 V265 Q268 | V52-Q56 VanDerWaalsContact O-CG 3.31Å; V52-Q56 WeakPolarHBondContact O-CG 3.46Å; V52-Q56 PolarHBondContact O-N 3.4Å; T53-Q56 PolarHBondContact O-N 2.97Å; F54-Q56 VanDerWaalsContact C-N 3.35Å; F54-Q56 PolarHBondContact O-N 3.46Å; Q56-F59 PolarHBondContact O-N 3.33Å; Q56-I60 WeakPolarHBondContact O-CD1 3.37Å; Q56-I60 VanDerWaalsContact O-CG1 3.26Å; Q56-I60 WeakPolarHBondContact O-CG1 3.39Å; Q56-I60 PolarHBondContact O-N 2.91Å; Q56-N264 PolarHBondContact NE2-OD1 3.4Å; Q56-V265 HydrophobicContact CG-CG2 4.21Å; Q56-Q268 HydrophobicContact CB-CG 4.35Å; Q56-Q268 HydrophobicContact CG-CB 4.06Å; Q56-Q268 HydrophobicContact CG-CG 3.92Å |
| 57 | F | 93.4 | Very high | 92 | Very high | 12 Ų | 12 | 39 Ų | 39 | 5% | 0.053 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -68.3 | -42.9 | -176.9 | -82.9 | 40.5 | 0 | 0 | 0 | 111.2 | T53 F54 A55 F59 I60 A61 F90 H218 P221 L222 F225 | T53-F57 HydrophobicContact CG2-CD1 3.79Å; T53-F57 HydrophobicContact CG2-CE1 3.53Å; T53-F57 HydrophobicContact CG2-CZ 4.07Å; T53-F57 WeakPolarHBondContact O-CB 3.24Å; T53-F57 WeakPolarHBondContact O-CD1 3.39Å; T53-F57 WeakPolarHBondContact O-CG 3.22Å; T53-F57 PolarHBondContact O-N 3.38Å; F54-F57 PolarHBondContact O-N 3.44Å; F54-F57 VanDerWaalsContact O-N 3.15Å; A55-F57 VanDerWaalsContact C-N 3.34Å; A55-F57 PolarHBondContact O-N 3.02Å; F57-F59 PolarHBondContact O-N 3Å; F57-I60 PolarHBondContact O-N 3.49Å; F57-A61 WeakPolarHBondContact O-CB 3.18Å; F57-A61 PolarHBondContact O-N 3.24Å; F57-F90 HydrophobicContact CE1-CE1 4.48Å; F57-F90 HydrophobicContact CE1-CZ 4.35Å; F57-F90 HydrophobicContact CE2-CD1 4.26Å; F57-F90 AromaticContact CE2-CE1 3.57Å; F57-F90 HydrophobicContact CE2-CE1 3.57Å; F57-F90 HydrophobicContact CE2-CZ 4.19Å; F57-F90 HydrophobicContact CZ-CD1 4.29Å; F57-F90 AromaticContact CZ-CE1 3.32Å; F57-F90 HydrophobicContact CZ-CE1 3.32Å; F57-F90 HydrophobicContact CZ-CE2 4.49Å; F57-F90 AromaticContact CZ-CZ 3.45Å; F57-F90 HydrophobicContact CZ-CZ 3.45Å; F57-F90 VanDerWaalsContact CZ-CZ 3.45Å; F57-H218 AromaticContact CD1-CD2 3.68Å; F57-H218 HydrophobicContact CD2-CB 4.45Å; F57-H218 AromaticContact CE1-CD2 3.71Å; F57-H218 HydrophobicContact CG-CB 4.46Å; F57-H218 AromaticContact CG-CD2 3.97Å; F57-P221 HydrophobicContact CD2-CB 4.03Å; F57-P221 HydrophobicContact CD2-CG 3.98Å; F57-P221 HydrophobicContact CE2-CB 3.94Å; F57-P221 HydrophobicContact CE2-CG 3.73Å; F57-L222 HydrophobicContact CB-CD2 3.79Å; F57-F225 AromaticContact CD2-CE2 3.78Å; F57-F225 HydrophobicContact CD2-CE2 3.78Å; F57-F225 HydrophobicContact CD2-CZ 4.18Å; F57-F225 HydrophobicContact CE2-CE2 4.31Å; F57-F225 HydrophobicContact CG-CE2 4.24Å; F57-F225 HydrophobicContact CG-CZ 4.39Å |
| 58 | V | 95.6 | Very high | 92.4 | Very high | 44 Ų | 44 | 38.4 Ų | 38.4 | 27% | 0.267 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -58.6 | -48.7 | 174.6 | 170 | 0 | 0 | 0 | 0 | 110.4 | F54 I60 A61 L62 L222 | F54-V58 HydrophobicContact CD1-CG2 4.43Å; F54-V58 HydrophobicContact CD2-CG2 4.17Å; F54-V58 HydrophobicContact CE1-CG2 4.02Å; F54-V58 HydrophobicContact CE2-CG2 3.74Å; F54-V58 HydrophobicContact CZ-CG2 3.65Å; F54-V58 WeakPolarHBondContact O-CG2 3.05Å; F54-V58 PolarHBondContact O-N 2.96Å; V58-I60 PolarHBondContact O-N 3.18Å; V58-A61 PolarHBondContact O-N 3.18Å; V58-L62 HydrophobicContact CG1-CD1 3.77Å; V58-L62 HydrophobicContact CG1-CG 4.28Å; V58-L62 WeakPolarHBondContact O-CB 3.36Å; V58-L62 VanDerWaalsContact O-CG 3.24Å; V58-L62 WeakPolarHBondContact O-CG 3.29Å; V58-L62 PolarHBondContact O-N 3.34Å; V58-L222 HydrophobicContact CG2-CD2 3.69Å |
| 59 | F | 95.6 | Very high | 92.5 | Very high | 83 Ų | 83 | 38.8 Ų | 38.8 | 36% | 0.364 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -60.9 | -47.7 | -179.1 | -175.1 | -94.4 | 0 | 0 | 0 | 112.4 | A55 Q56 F57 L62 E63 V265 Y269 | A55-F59 WeakPolarHBondContact O-CB 3.13Å; A55-F59 PolarHBondContact O-N 3.29Å; Q56-F59 PolarHBondContact O-N 3.33Å; F57-F59 PolarHBondContact O-N 3Å; F59-L62 PolarHBondContact O-N 3.43Å; F59-E63 PolarHBondContact O-N 2.82Å; F59-V265 HydrophobicContact CB-CG1 3.55Å; F59-V265 HydrophobicContact CD1-CG1 4.04Å; F59-V265 HydrophobicContact CD2-CG1 4.05Å; F59-V265 HydrophobicContact CG-CG1 3.6Å; F59-Y269 HydrophobicContact CD1-CD2 4.3Å; F59-Y269 HydrophobicContact CD1-CG 4.27Å; F59-Y269 AromaticContact CE1-CD1 3.95Å; F59-Y269 HydrophobicContact CE1-CD1 3.95Å; F59-Y269 AromaticContact CE1-CD2 3.83Å; F59-Y269 HydrophobicContact CE1-CD2 3.83Å; F59-Y269 HydrophobicContact CE1-CE1 4.45Å; F59-Y269 HydrophobicContact CE1-CE2 4.37Å; F59-Y269 AromaticContact CE1-CG 3.59Å; F59-Y269 HydrophobicContact CE1-CG 3.59Å |
| 60 | I | 92.4 | Very high | 92.7 | Very high | 3 Ų | 3 | 44.5 Ų | 44.5 | 2% | 0.015 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -67.2 | -39.1 | 179.8 | -64 | 161.3 | 0 | 0 | 0 | 111.1 | Q56 F57 V58 E63 G64 L214 H218 I272 | Q56-I60 WeakPolarHBondContact O-CD1 3.37Å; Q56-I60 VanDerWaalsContact O-CG1 3.26Å; Q56-I60 WeakPolarHBondContact O-CG1 3.39Å; Q56-I60 PolarHBondContact O-N 2.91Å; F57-I60 PolarHBondContact O-N 3.49Å; V58-I60 PolarHBondContact O-N 3.18Å; I60-E63 PolarHBondContact O-N 2.92Å; I60-G64 PolarHBondContact O-N 3.29Å; I60-L214 HydrophobicContact CG2-CD1 4.18Å; I60-L214 HydrophobicContact CG2-CD2 4.28Å; I60-L214 HydrophobicContact CG2-CG 3.89Å; I60-H218 HydrophobicContact CB-CB 4.15Å; I60-H218 HydrophobicContact CG2-CB 3.9Å; I60-I272 HydrophobicContact CD1-CD1 3.38Å; I60-I272 HydrophobicContact CG1-CD1 4.43Å |
| 61 | A | 94.4 | Very high | 92.8 | Very high | 6 Ų | 6 | 49.9 Ų | 49.9 | 5% | 0.05 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -65.3 | -42.2 | 177 | 0 | 0 | 0 | 0 | 0 | 111.7 | F57 V58 G64 F65 F215 C219 L222 | F57-A61 WeakPolarHBondContact O-CB 3.18Å; F57-A61 PolarHBondContact O-N 3.24Å; V58-A61 PolarHBondContact O-N 3.18Å; A61-G64 PolarHBondContact O-N 3.46Å; A61-F65 VanDerWaalsContact O-CB 3.24Å; A61-F65 WeakPolarHBondContact O-CB 3.45Å; A61-F65 PolarHBondContact O-N 2.65Å; A61-F215 WeakPolarHBondContact O-CD2 3.09Å; A61-F215 WeakPolarHBondContact O-CE2 3.14Å; A61-C219 HydrophobicContact CB-CB 3.96Å; A61-L222 HydrophobicContact CB-CD1 3.94Å |
| 62 | L | 94.8 | Very high | 92.6 | Very high | 100 Ų | 100 | 52.1 Ų | 52.1 | 52% | 0.524 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -62.9 | -45.2 | 176.5 | -73.4 | 172.4 | 0 | 0 | 0 | 111.6 | V58 F59 F65 I66 | V58-L62 HydrophobicContact CG1-CD1 3.77Å; V58-L62 HydrophobicContact CG1-CG 4.28Å; V58-L62 WeakPolarHBondContact O-CB 3.36Å; V58-L62 VanDerWaalsContact O-CG 3.24Å; V58-L62 WeakPolarHBondContact O-CG 3.29Å; V58-L62 PolarHBondContact O-N 3.34Å; F59-L62 PolarHBondContact O-N 3.43Å; L62-F65 PolarHBondContact O-N 3.25Å; L62-I66 WeakPolarHBondContact O-CG1 3.45Å; L62-I66 PolarHBondContact O-N 3.19Å; L62-I66 VanDerWaalsContact O-N 3.07Å |
| 63 | E | 93.3 | Very high | 92.4 | Very high | 43 Ų | 43 | 62.4 Ų | 62.4 | 20% | 0.201 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -60.1 | -49.3 | 176 | -168 | -88 | -172.4 | 0 | 0 | 111.2 | F59 I60 F65 I66 F67 Y269 | F59-E63 PolarHBondContact O-N 2.82Å; I60-E63 PolarHBondContact O-N 2.92Å; E63-F65 VanDerWaalsContact C-N 3.3Å; E63-F65 PolarHBondContact O-N 3Å; E63-I66 PolarHBondContact O-N 3.39Å; E63-F67 HydrophobicContact CG-CD2 3.8Å; E63-F67 HydrophobicContact CG-CE2 4.19Å; E63-F67 VanDerWaalsContact O-CD2 3.31Å; E63-F67 WeakPolarHBondContact O-CD2 3.37Å; E63-F67 PolarHBondContact O-N 3.25Å; E63-Y269 HydrophobicContact CG-CE2 3.93Å; E63-Y269 PolarHBondContact OE1-OH 3.35Å |
| 64 | G | 90.8 | Very high | 92.4 | Very high | 3 Ų | 3 | 65.6 Ų | 65.6 | 3% | 0.031 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -65.4 | -32.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | I60 A61 E68 T69 F215 | I60-G64 PolarHBondContact O-N 3.29Å; A61-G64 PolarHBondContact O-N 3.46Å; G64-E68 WeakPolarHBondContact O-CA 3.4Å; G64-E68 VanDerWaalsContact O-CB 3.27Å; G64-E68 WeakPolarHBondContact O-CB 3.48Å; G64-E68 PolarHBondContact O-N 2.91Å; G64-T69 PolarHBondContact O-N 3.35Å; G64-F215 VanDerWaalsContact C-CD2 3.46Å |
| 65 | F | 93.6 | Very high | 92.2 | Very high | 83 Ų | 83 | 71.1 Ų | 71.1 | 36% | 0.364 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -64.1 | -45.1 | 175.8 | -175.6 | -113.8 | 0 | 0 | 0 | 111.2 | A61 L62 E63 T69 K70 F71 F215 | A61-F65 VanDerWaalsContact O-CB 3.24Å; A61-F65 WeakPolarHBondContact O-CB 3.45Å; A61-F65 PolarHBondContact O-N 2.65Å; L62-F65 PolarHBondContact O-N 3.25Å; E63-F65 VanDerWaalsContact C-N 3.3Å; E63-F65 PolarHBondContact O-N 3Å; F65-T69 WeakPolarHBondContact CA-OG1 3.41Å; F65-T69 WeakPolarHBondContact CD2-OG1 3.4Å; F65-T69 PolarHBondContact O-OG1 2.9Å; F65-K70 PolarHBondContact O-N 3.39Å; F65-F71 HydrophobicContact CD1-CD1 4.18Å; F65-F71 HydrophobicContact CE1-CB 4.33Å; F65-F71 AromaticContact CE1-CD1 3.67Å; F65-F71 HydrophobicContact CE1-CD1 3.67Å; F65-F71 HydrophobicContact CE1-CE1 4.46Å; F65-F71 HydrophobicContact CE1-CG 4.4Å; F65-F71 HydrophobicContact CZ-CB 4.24Å; F65-F71 HydrophobicContact CZ-CD1 4.38Å; F65-F71 PolarHBondContact O-N 2.91Å; F65-F215 HydrophobicContact CB-CE2 3.81Å; F65-F215 HydrophobicContact CB-CZ 4.46Å; F65-F215 HydrophobicContact CD2-CE2 4.4Å; F65-F215 HydrophobicContact CD2-CZ 4.24Å |
| 66 | I | 93 | Very high | 92 | Very high | 74 Ų | 74 | 72.5 Ų | 72.5 | 38% | 0.379 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -72.3 | -53.3 | -179.1 | -64.2 | 166.4 | 0 | 0 | 0 | 110.7 | L62 E63 F71 | L62-I66 WeakPolarHBondContact O-CG1 3.45Å; L62-I66 PolarHBondContact O-N 3.19Å; L62-I66 VanDerWaalsContact O-N 3.07Å; E63-I66 PolarHBondContact O-N 3.39Å; I66-F71 HydrophobicContact CG1-CE1 4.22Å; I66-F71 HydrophobicContact CG1-CZ 4.22Å; I66-F71 HydrophobicContact CG2-CE2 4.47Å; I66-F71 HydrophobicContact CG2-CZ 4.2Å |
| 67 | F | 90.3 | Very high | 91.8 | Very high | 147 Ų | 147 | 73.8 Ų | 73.8 | 65% | 0.645 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -92.2 | -33 | -167.3 | -65.2 | -70.8 | 0 | 0 | 0 | 114.3 | E63 | E63-F67 HydrophobicContact CG-CD2 3.8Å; E63-F67 HydrophobicContact CG-CE2 4.19Å; E63-F67 VanDerWaalsContact O-CD2 3.31Å; E63-F67 WeakPolarHBondContact O-CD2 3.37Å; E63-F67 PolarHBondContact O-N 3.25Å |
| 68 | E | 90.2 | Very high | 91.7 | Very high | 28 Ų | 28 | 73.2 Ų | 73.2 | 13% | 0.131 | 36% | 0.356 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -95.7 | -51.4 | -176.3 | -178.5 | 59.8 | -155.6 | 0 | 0 | 112 | G64 K70 K74 K211 | G64-E68 WeakPolarHBondContact O-CA 3.4Å; G64-E68 VanDerWaalsContact O-CB 3.27Å; G64-E68 WeakPolarHBondContact O-CB 3.48Å; G64-E68 PolarHBondContact O-N 2.91Å; E68-K70 VanDerWaalsContact C-N 3.32Å; E68-K74 VanDerWaalsContact O-CD 3.25Å; E68-K74 WeakPolarHBondContact O-CD 3.48Å; E68-K74 IonicContact OE1-NZ 2.63Å; E68-K74 PolarHBondContact OE1-NZ 3.05Å; E68-K211 HydrophobicContact CG-CB 3.89Å; E68-K211 WeakPolarHBondContact OE2-CB 3.4Å; E68-K211 WeakPolarHBondContact OE2-CD 3.29Å |
| 69 | T | 89.5 | Confident | 91.6 | Very high | 8 Ų | 8 | 73.8 Ų | 73.8 | 5% | 0.049 | 36% | 0.36 | C | S | . | . | S | Bend | trans | -83.1 | -10 | -178.7 | 73.5 | 0 | 0 | 0 | 0 | 113.7 | G64 F65 F71 G72 R73 K74 F215 | G64-T69 PolarHBondContact O-N 3.35Å; F65-T69 WeakPolarHBondContact CA-OG1 3.41Å; F65-T69 WeakPolarHBondContact CD2-OG1 3.4Å; F65-T69 PolarHBondContact O-OG1 2.9Å; T69-F71 PolarHBondContact O-N 3.06Å; T69-G72 CarbonylContact O-C 3.47Å; T69-G72 PolarHBondContact O-N 3.31Å; T69-G72 VanDerWaalsContact O-N 3.14Å; T69-G72 PolarHBondContact OG1-N 2.95Å; T69-R73 PolarHBondContact O-N 3.42Å; T69-K74 PolarHBondContact O-N 3.15Å; T69-F215 HydrophobicContact CG2-CD1 3.38Å; T69-F215 HydrophobicContact CG2-CD2 4.41Å; T69-F215 HydrophobicContact CG2-CE1 3.39Å; T69-F215 HydrophobicContact CG2-CE2 4.4Å; T69-F215 HydrophobicContact CG2-CG 3.91Å; T69-F215 HydrophobicContact CG2-CZ 3.92Å |
| 70 | K | 90.4 | Very high | 91.4 | Very high | 138 Ų | 138 | 72.4 Ų | 72.4 | 60% | 0.6 | 36% | 0.359 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.8 | 54.5 | -175.7 | -60.6 | -176.7 | 178 | -177.3 | 0 | 111.3 | F65 E68 G72 R73 | F65-K70 PolarHBondContact O-N 3.39Å; E68-K70 VanDerWaalsContact C-N 3.32Å; K70-G72 VanDerWaalsContact C-N 3.34Å; K70-G72 PolarHBondContact O-N 2.9Å; K70-R73 HydrophobicContact CB-CB 4.4Å; K70-R73 WeakPolarHBondContact O-CB 3.43Å; K70-R73 VanDerWaalsContact O-CG 3.27Å; K70-R73 WeakPolarHBondContact O-CG 3.49Å; K70-R73 PolarHBondContact O-N 3.18Å |
| 71 | F | 90.7 | Very high | 91.4 | Very high | 134 Ų | 134 | 76.4 Ų | 76.4 | 59% | 0.588 | 39% | 0.387 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 58.8 | 42.4 | -174.6 | -55.9 | -89.2 | 0 | 0 | 0 | 112.8 | F65 I66 T69 R73 | F65-F71 HydrophobicContact CD1-CD1 4.18Å; F65-F71 HydrophobicContact CE1-CB 4.33Å; F65-F71 AromaticContact CE1-CD1 3.67Å; F65-F71 HydrophobicContact CE1-CD1 3.67Å; F65-F71 HydrophobicContact CE1-CE1 4.46Å; F65-F71 HydrophobicContact CE1-CG 4.4Å; F65-F71 HydrophobicContact CZ-CB 4.24Å; F65-F71 HydrophobicContact CZ-CD1 4.38Å; F65-F71 PolarHBondContact O-N 2.91Å; I66-F71 HydrophobicContact CG1-CE1 4.22Å; I66-F71 HydrophobicContact CG1-CZ 4.22Å; I66-F71 HydrophobicContact CG2-CE2 4.47Å; I66-F71 HydrophobicContact CG2-CZ 4.2Å; T69-F71 PolarHBondContact O-N 3.06Å; F71-R73 VanDerWaalsContact C-N 3.29Å; F71-R73 PolarHBondContact O-N 3.48Å |
| 72 | G | 88.3 | Confident | 91.4 | Very high | 52 Ų | 52 | 77.5 Ų | 77.5 | 54% | 0.536 | 39% | 0.392 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 75.3 | 6.2 | 179.3 | 0 | 0 | 0 | 0 | 0 | 115.9 | T69 K70 | T69-G72 CarbonylContact O-C 3.47Å; T69-G72 PolarHBondContact O-N 3.31Å; T69-G72 VanDerWaalsContact O-N 3.14Å; T69-G72 PolarHBondContact OG1-N 2.95Å; K70-G72 VanDerWaalsContact C-N 3.34Å; K70-G72 PolarHBondContact O-N 2.9Å |
| 73 | R | 88.8 | Confident | 91.3 | Very high | 217 Ų | 217 | 72.8 Ų | 72.8 | 82% | 0.819 | 37% | 0.367 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.5 | -26.9 | 178.8 | -65.7 | 178.3 | 179.4 | -175.8 | 0.6 | 113.1 | T69 K70 F71 | T69-R73 PolarHBondContact O-N 3.42Å; K70-R73 HydrophobicContact CB-CB 4.4Å; K70-R73 WeakPolarHBondContact O-CB 3.43Å; K70-R73 VanDerWaalsContact O-CG 3.27Å; K70-R73 WeakPolarHBondContact O-CG 3.49Å; K70-R73 PolarHBondContact O-N 3.18Å; F71-R73 VanDerWaalsContact C-N 3.29Å; F71-R73 PolarHBondContact O-N 3.48Å |
| 74 | K | 90.6 | Very high | 91.3 | Very high | 91 Ų | 91 | 74 Ų | 74 | 40% | 0.396 | 38% | 0.378 | S | S | . | . | S | Bend | trans | -84.3 | 123.3 | 178.3 | -172.7 | -176.8 | 177 | -178 | 0 | 109.9 | E68 T69 | E68-K74 VanDerWaalsContact O-CD 3.25Å; E68-K74 WeakPolarHBondContact O-CD 3.48Å; E68-K74 IonicContact OE1-NZ 2.63Å; E68-K74 PolarHBondContact OE1-NZ 3.05Å; T69-K74 PolarHBondContact O-N 3.15Å |
| 75 | K | 89.2 | Confident | 91.4 | Very high | 188 Ų | 188 | 77.4 Ų | 77.4 | 82% | 0.817 | 39% | 0.394 | S | S | * | . | P | Polyproline II helix | trans | -73.1 | 140.9 | 173.3 | -67.3 | -173.3 | 178.8 | -177.6 | 0 | 110.6 | ||
| 76 | P | 91.4 | Very high | 91.2 | Very high | 50 Ų | 50 | 73.7 Ų | 73.7 | 33% | 0.325 | 38% | 0.378 | S | S | . | . | P | Polyproline II helix | trans | -68.6 | 140.1 | 177.8 | 27.9 | -33.5 | 0 | 0 | 0 | 111.2 | V80 E212 Y216 | P76-V80 HydrophobicContact CG-CG2 3.95Å; P76-E212 WeakPolarHBondContact CA-OE1 3.46Å; P76-E212 WeakPolarHBondContact CB-OE1 3.16Å; P76-Y216 HydrophobicContact CB-CE2 3.74Å |
| 77 | A | 90.8 | Very high | 91.1 | Very high | 45 Ų | 45 | 70.7 Ų | 70.7 | 37% | 0.372 | 36% | 0.363 | S | S | . | . | S | Bend | trans | -75.8 | -32.2 | 171.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | H209 E212 | A77-H209 WeakPolarHBondContact CB-NE2 3.26Å; A77-E212 VanDerWaalsContact N-CD 3.28Å; A77-E212 PolarHBondContact N-OE1 2.72Å; A77-E212 PolarHBondContact N-OE2 3.36Å |
| 78 | I | 91.6 | Very high | 91.1 | Very high | 0 Ų | 0 | 67.7 Ų | 67.7 | 0% | 0 | 36% | 0.357 | C | S | . | . | S | Bend | trans | -100.8 | 131 | 177.2 | -66 | 176 | 0 | 0 | 0 | 109.5 | V80 N82 Y83 L202 Y203 Y206 H209 E212 | I78-V80 PolarHBondContact O-N 2.94Å; I78-N82 HydrophobicContact CG2-CB 4.18Å; I78-Y83 HydrophobicContact CB-CE2 3.63Å; I78-Y83 WeakPolarHBondContact CD1-OH 3.44Å; I78-Y83 HydrophobicContact CG2-CD2 4.23Å; I78-Y83 HydrophobicContact CG2-CE1 4.5Å; I78-Y83 HydrophobicContact CG2-CE2 3.74Å; I78-L202 HydrophobicContact CD1-CD2 4.3Å; I78-L202 HydrophobicContact CD1-CG 4.27Å; I78-L202 HydrophobicContact CG2-CD1 3.99Å; I78-L202 HydrophobicContact CG2-CD2 3.75Å; I78-L202 HydrophobicContact CG2-CG 4Å; I78-Y203 HydrophobicContact CD1-CD1 4.43Å; I78-Y203 HydrophobicContact CD1-CE1 4.44Å; I78-Y206 HydrophobicContact CG1-CD2 4.44Å; I78-Y206 HydrophobicContact CG1-CG 3.95Å; I78-H209 HydrophobicContact CD1-CB 4.48Å; I78-E212 PolarHBondContact N-OE1 2.98Å |
| 79 | P | 93.3 | Very high | 91.2 | Very high | 56 Ų | 56 | 67.7 Ų | 67.7 | 36% | 0.364 | 36% | 0.357 | S | S | . | . | trans | -54.9 | 130 | 177.1 | -26 | 33.2 | 0 | 0 | 0 | 112.2 | S81 N82 Y206 | P79-S81 PolarHBondContact O-N 3.02Å; P79-S81 VanDerWaalsContact O-N 3.09Å; P79-N82 WeakPolarHBondContact O-CB 3.37Å; P79-N82 PolarHBondContact O-N 3.41Å; P79-Y206 VanDerWaalsContact CD-CE1 3.44Å; P79-Y206 HydrophobicContact CG-CE1 3.99Å | ||
| 80 | V | 92.3 | Very high | 91.1 | Very high | 54 Ų | 54 | 70.3 Ų | 70.3 | 33% | 0.327 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -56.5 | -31.5 | -176.3 | 179.5 | 0 | 0 | 0 | 0 | 112.3 | P76 I78 N82 Y83 V84 Y216 L220 | P76-V80 HydrophobicContact CG-CG2 3.95Å; I78-V80 PolarHBondContact O-N 2.94Å; V80-N82 PolarHBondContact O-N 3.35Å; V80-Y83 WeakPolarHBondContact O-CA 3.27Å; V80-Y83 WeakPolarHBondContact O-CB 3.47Å; V80-Y83 PolarHBondContact O-N 2.86Å; V80-V84 HydrophobicContact CG1-CG2 4.29Å; V80-V84 WeakPolarHBondContact O-CG2 3.33Å; V80-V84 PolarHBondContact O-N 3.4Å; V80-Y216 HydrophobicContact CG2-CE1 4.03Å; V80-L220 HydrophobicContact CG1-CD1 4.06Å; V80-L220 HydrophobicContact CG1-CD2 4.3Å |
| 81 | S | 92.8 | Very high | 90.8 | Very high | 87 Ų | 87 | 65.5 Ų | 65.5 | 61% | 0.608 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -55.6 | -35.6 | 175.4 | -48.1 | 0 | 0 | 0 | 0 | 113.2 | P79 V84 I85 | P79-S81 PolarHBondContact O-N 3.02Å; P79-S81 VanDerWaalsContact O-N 3.09Å; S81-V84 PolarHBondContact O-N 3.29Å; S81-I85 WeakPolarHBondContact O-CG1 3.45Å; S81-I85 PolarHBondContact O-N 3.43Å; S81-I85 VanDerWaalsContact O-N 3.14Å |
| 82 | N | 93.4 | Very high | 90.7 | Very high | 30 Ų | 30 | 61.4 Ų | 61.4 | 16% | 0.16 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -69.2 | -39.4 | 176.2 | -67 | -46.3 | 0 | 0 | 0 | 111.3 | I78 P79 V80 V84 I85 M86 F198 L202 | I78-N82 HydrophobicContact CG2-CB 4.18Å; P79-N82 WeakPolarHBondContact O-CB 3.37Å; P79-N82 PolarHBondContact O-N 3.41Å; V80-N82 PolarHBondContact O-N 3.35Å; N82-V84 VanDerWaalsContact C-N 3.34Å; N82-I85 PolarHBondContact O-N 3.17Å; N82-M86 PolarHBondContact O-N 3.04Å; N82-M86 VanDerWaalsContact O-N 3.07Å; N82-F198 HydrophobicContact CB-CE1 4.38Å; N82-F198 HydrophobicContact CB-CZ 4.25Å; N82-F198 WeakPolarHBondContact O-CE1 3.49Å; N82-L202 HydrophobicContact CB-CD1 3.63Å; N82-L202 HydrophobicContact CB-CD2 3.98Å; N82-L202 HydrophobicContact CB-CG 4.49Å |
| 83 | Y | 92.9 | Very high | 90.7 | Very high | 1 Ų | 1 | 59.6 Ų | 59.6 | 0% | 0.004 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -65.3 | -38.5 | 173.7 | -68.8 | -60.3 | 0 | 0 | 0 | 111.9 | I78 V80 I85 M86 V87 A213 Y216 | I78-Y83 HydrophobicContact CB-CE2 3.63Å; I78-Y83 WeakPolarHBondContact CD1-OH 3.44Å; I78-Y83 HydrophobicContact CG2-CD2 4.23Å; I78-Y83 HydrophobicContact CG2-CE1 4.5Å; I78-Y83 HydrophobicContact CG2-CE2 3.74Å; V80-Y83 WeakPolarHBondContact O-CA 3.27Å; V80-Y83 WeakPolarHBondContact O-CB 3.47Å; V80-Y83 PolarHBondContact O-N 2.86Å; Y83-I85 VanDerWaalsContact C-N 3.34Å; Y83-I85 PolarHBondContact O-N 3.03Å; Y83-M86 WeakPolarHBondContact O-CB 3.36Å; Y83-M86 PolarHBondContact O-N 2.92Å; Y83-V87 VanDerWaalsContact O-CB 3.29Å; Y83-V87 WeakPolarHBondContact O-CB 3.45Å; Y83-V87 WeakPolarHBondContact O-CG2 3.49Å; Y83-V87 PolarHBondContact O-N 3.01Å; Y83-A213 HydrophobicContact CE1-CB 3.95Å; Y83-A213 WeakPolarHBondContact OH-CA 3.23Å; Y83-A213 PolarHBondContact OH-N 3.26Å; Y83-Y216 HydrophobicContact CD2-CD1 4.41Å; Y83-Y216 AromaticContact CD2-CD2 3.91Å; Y83-Y216 HydrophobicContact CD2-CD2 3.91Å; Y83-Y216 AromaticContact CD2-CG 3.75Å; Y83-Y216 HydrophobicContact CD2-CG 3.75Å; Y83-Y216 AromaticContact CE2-CD2 3.63Å; Y83-Y216 HydrophobicContact CE2-CD2 3.63Å; Y83-Y216 HydrophobicContact CE2-CE2 4.36Å; Y83-Y216 AromaticContact CE2-CG 3.95Å; Y83-Y216 HydrophobicContact CE2-CG 3.95Å; Y83-Y216 HydrophobicContact CG-CG 4.23Å |
| 84 | V | 92.9 | Very high | 90.5 | Very high | 69 Ų | 69 | 50.3 Ų | 50.3 | 42% | 0.418 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -58.9 | -45.5 | 175.1 | 172.8 | 0 | 0 | 0 | 0 | 110.9 | V80 S81 N82 M86 V87 T88 L220 | V80-V84 HydrophobicContact CG1-CG2 4.29Å; V80-V84 WeakPolarHBondContact O-CG2 3.33Å; V80-V84 PolarHBondContact O-N 3.4Å; S81-V84 PolarHBondContact O-N 3.29Å; N82-V84 VanDerWaalsContact C-N 3.34Å; V84-M86 VanDerWaalsContact C-N 3.34Å; V84-M86 PolarHBondContact O-N 3.32Å; V84-V87 PolarHBondContact O-N 3.42Å; V84-T88 PolarHBondContact O-N 3.23Å; V84-T88 PolarHBondContact O-OG1 3.01Å; V84-T88 VanDerWaalsContact O-OG1 3.05Å; V84-L220 HydrophobicContact CG2-CD1 4.19Å |
| 85 | I | 92.9 | Very high | 90.1 | Very high | 73 Ų | 73 | 48.6 Ų | 48.6 | 37% | 0.374 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -58.8 | -47.2 | 175.4 | -66.2 | 166.3 | 0 | 0 | 0 | 110.8 | S81 N82 Y83 V87 T88 M89 F198 | S81-I85 WeakPolarHBondContact O-CG1 3.45Å; S81-I85 PolarHBondContact O-N 3.43Å; S81-I85 VanDerWaalsContact O-N 3.14Å; N82-I85 PolarHBondContact O-N 3.17Å; Y83-I85 VanDerWaalsContact C-N 3.34Å; Y83-I85 PolarHBondContact O-N 3.03Å; I85-V87 VanDerWaalsContact C-N 3.3Å; I85-V87 PolarHBondContact O-N 3.16Å; I85-T88 PolarHBondContact O-N 2.96Å; I85-M89 HydrophobicContact CG2-CE 3.68Å; I85-M89 HydrophobicContact CG2-SD 4.46Å; I85-M89 WeakPolarHBondContact O-CG 3.39Å; I85-M89 PolarHBondContact O-N 3.26Å; I85-M89 VanDerWaalsContact O-N 3.09Å; I85-F198 HydrophobicContact CB-CE1 4.18Å; I85-F198 HydrophobicContact CB-CZ 4.23Å; I85-F198 HydrophobicContact CD1-CZ 4.23Å; I85-F198 HydrophobicContact CG2-CD1 4.46Å; I85-F198 HydrophobicContact CG2-CE1 4.02Å; I85-F198 HydrophobicContact CG2-CE2 4.49Å; I85-F198 HydrophobicContact CG2-CZ 4.03Å |
| 86 | M | 90.4 | Very high | 90.1 | Very high | 5 Ų | 5 | 41.2 Ų | 41.2 | 3% | 0.025 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -61.3 | -40.5 | -179.7 | -162.5 | -179.5 | 138.2 | 0 | 0 | 111.9 | N82 Y83 V84 M89 F90 M195 F198 Q199 N217 | N82-M86 PolarHBondContact O-N 3.04Å; N82-M86 VanDerWaalsContact O-N 3.07Å; Y83-M86 WeakPolarHBondContact O-CB 3.36Å; Y83-M86 PolarHBondContact O-N 2.92Å; V84-M86 VanDerWaalsContact C-N 3.34Å; V84-M86 PolarHBondContact O-N 3.32Å; M86-M89 PolarHBondContact O-N 3.12Å; M86-F90 WeakPolarHBondContact O-CB 3.26Å; M86-F90 PolarHBondContact O-N 3.47Å; M86-M195 HydrophobicContact CE-CE 3.6Å; M86-M195 HydrophobicContact CG-CE 3.86Å; M86-M195 HydrophobicContact CG-CG 4.04Å; M86-F198 HydrophobicContact CB-CD1 4.47Å; M86-F198 HydrophobicContact CB-CE1 4.5Å; M86-Q199 HydrophobicContact CE-CG 4.41Å; M86-Q199 HydrophobicContact SD-CB 4.44Å; M86-Q199 HydrophobicContact SD-CG 4.29Å; M86-N217 HydrophobicContact CE-CB 4.45Å; M86-N217 WeakPolarHBondContact CE-ND2 3.12Å; M86-N217 WeakPolarHBondContact CE-OD1 3.36Å; M86-N217 PolarHBondContact SD-OD1 3.44Å; M86-N217 VanDerWaalsContact SD-OD1 3.37Å |
| 87 | V | 90.2 | Very high | 89.8 | Confident | 12 Ų | 12 | 40 Ų | 40 | 7% | 0.073 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -70.6 | -40.5 | 179.3 | 161.9 | 0 | 0 | 0 | 0 | 111.9 | Y83 V84 I85 M89 F90 F91 L220 P221 | Y83-V87 VanDerWaalsContact O-CB 3.29Å; Y83-V87 WeakPolarHBondContact O-CB 3.45Å; Y83-V87 WeakPolarHBondContact O-CG2 3.49Å; Y83-V87 PolarHBondContact O-N 3.01Å; V84-V87 PolarHBondContact O-N 3.42Å; I85-V87 VanDerWaalsContact C-N 3.3Å; I85-V87 PolarHBondContact O-N 3.16Å; V87-M89 VanDerWaalsContact C-N 3.32Å; V87-M89 PolarHBondContact O-N 3.44Å; V87-F90 PolarHBondContact O-N 2.87Å; V87-F91 WeakPolarHBondContact O-CB 3.43Å; V87-F91 PolarHBondContact O-N 2.81Å; V87-L220 HydrophobicContact CG1-CB 4.29Å; V87-L220 HydrophobicContact CG2-CB 4.02Å; V87-P221 HydrophobicContact CB-CG 4.3Å; V87-P221 HydrophobicContact CG1-CB 3.82Å; V87-P221 HydrophobicContact CG1-CG 3.56Å; V87-P221 HydrophobicContact CG2-CG 3.89Å |
| 88 | T | 91 | Very high | 89.3 | Confident | 83 Ų | 83 | 40.4 Ų | 40.4 | 51% | 0.509 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -61.2 | -43.1 | 174 | -61.8 | 0 | 0 | 0 | 0 | 111 | V84 I85 T92 | V84-T88 PolarHBondContact O-N 3.23Å; V84-T88 PolarHBondContact O-OG1 3.01Å; V84-T88 VanDerWaalsContact O-OG1 3.05Å; I85-T88 PolarHBondContact O-N 2.96Å; T88-T92 WeakPolarHBondContact O-CB 3.45Å; T88-T92 PolarHBondContact O-N 3.43Å; T88-T92 PolarHBondContact O-OG1 3.28Å |
| 89 | M | 91.3 | Very high | 88.8 | Confident | 29 Ų | 29 | 46.5 Ų | 46.5 | 14% | 0.143 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -62.2 | -47 | 174.3 | -67 | 178.5 | -176.9 | 0 | 0 | 111.3 | I85 M86 V87 T92 V93 M191 R194 M195 | I85-M89 HydrophobicContact CG2-CE 3.68Å; I85-M89 HydrophobicContact CG2-SD 4.46Å; I85-M89 WeakPolarHBondContact O-CG 3.39Å; I85-M89 PolarHBondContact O-N 3.26Å; I85-M89 VanDerWaalsContact O-N 3.09Å; M86-M89 PolarHBondContact O-N 3.12Å; V87-M89 VanDerWaalsContact C-N 3.32Å; V87-M89 PolarHBondContact O-N 3.44Å; M89-T92 PolarHBondContact O-N 2.91Å; M89-V93 WeakPolarHBondContact O-CB 3.35Å; M89-V93 VanDerWaalsContact O-CG2 3.25Å; M89-V93 WeakPolarHBondContact O-CG2 3.43Å; M89-V93 PolarHBondContact O-N 3.19Å; M89-M191 HydrophobicContact CB-CE 4.22Å; M89-M191 HydrophobicContact CG-CE 3.88Å; M89-R194 HydrophobicContact CE-CG 4.23Å; M89-R194 HydrophobicContact SD-CG 4.35Å; M89-M195 HydrophobicContact CB-CB 4.07Å; M89-M195 HydrophobicContact CB-CG 4.22Å; M89-M195 HydrophobicContact SD-CB 4.1Å |
| 90 | F | 87.2 | Confident | 88.4 | Confident | 62 Ų | 62 | 43.8 Ų | 43.8 | 27% | 0.272 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -58.2 | -49.5 | 177.4 | 174.5 | -95.4 | 0 | 0 | 0 | 112.3 | F57 M86 V87 T92 V93 S94 M195 | F57-F90 HydrophobicContact CE1-CE1 4.48Å; F57-F90 HydrophobicContact CE1-CZ 4.35Å; F57-F90 HydrophobicContact CE2-CD1 4.26Å; F57-F90 AromaticContact CE2-CE1 3.57Å; F57-F90 HydrophobicContact CE2-CE1 3.57Å; F57-F90 HydrophobicContact CE2-CZ 4.19Å; F57-F90 HydrophobicContact CZ-CD1 4.29Å; F57-F90 AromaticContact CZ-CE1 3.32Å; F57-F90 HydrophobicContact CZ-CE1 3.32Å; F57-F90 HydrophobicContact CZ-CE2 4.49Å; F57-F90 AromaticContact CZ-CZ 3.45Å; F57-F90 HydrophobicContact CZ-CZ 3.45Å; F57-F90 VanDerWaalsContact CZ-CZ 3.45Å; M86-F90 WeakPolarHBondContact O-CB 3.26Å; M86-F90 PolarHBondContact O-N 3.47Å; V87-F90 PolarHBondContact O-N 2.87Å; F90-T92 PolarHBondContact O-N 3.41Å; F90-V93 PolarHBondContact O-N 3.29Å; F90-S94 WeakPolarHBondContact O-CB 3.24Å; F90-S94 PolarHBondContact O-N 2.91Å; F90-M195 HydrophobicContact CB-CE 3.72Å; F90-M195 HydrophobicContact CB-SD 3.87Å; F90-M195 HydrophobicContact CD2-CE 4.11Å; F90-M195 HydrophobicContact CD2-SD 4.45Å; F90-M195 HydrophobicContact CG-CE 4.33Å |
| 91 | F | 85.2 | Confident | 87.5 | Confident | 38 Ų | 38 | 43.8 Ų | 43.8 | 17% | 0.167 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -62.2 | -44.2 | -178.8 | -171.8 | -97.2 | 0 | 0 | 0 | 111.1 | V87 V93 S94 V95 G224 L227 L228 | V87-F91 WeakPolarHBondContact O-CB 3.43Å; V87-F91 PolarHBondContact O-N 2.81Å; F91-V93 PolarHBondContact O-N 2.65Å; F91-S94 PolarHBondContact O-N 2.75Å; F91-S94 VanDerWaalsContact O-N 3.16Å; F91-V95 HydrophobicContact CD1-CG2 3.96Å; F91-V95 HydrophobicContact CE1-CG2 3.6Å; F91-V95 HydrophobicContact CE2-CG2 4.38Å; F91-V95 HydrophobicContact CG-CG2 4.5Å; F91-V95 HydrophobicContact CZ-CG2 3.83Å; F91-V95 WeakPolarHBondContact O-CG2 3.07Å; F91-V95 PolarHBondContact O-N 2.91Å; F91-G224 VanDerWaalsContact CZ-O 3.26Å; F91-G224 WeakPolarHBondContact CZ-O 3.49Å; F91-L227 HydrophobicContact CE1-CD1 4.17Å; F91-L227 HydrophobicContact CZ-CD1 4.39Å; F91-L228 HydrophobicContact CE2-CD1 4.12Å; F91-L228 HydrophobicContact CZ-CD1 4.14Å; F91-L228 HydrophobicContact CZ-CG 4.41Å |
| 92 | T | 89.3 | Confident | 86.8 | Confident | 47 Ų | 47 | 44.2 Ų | 44.2 | 29% | 0.288 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -57.1 | -48.5 | 174.1 | -56.6 | 0 | 0 | 0 | 0 | 111.3 | T88 M89 F90 S94 V95 I96 F187 | T88-T92 WeakPolarHBondContact O-CB 3.45Å; T88-T92 PolarHBondContact O-N 3.43Å; T88-T92 PolarHBondContact O-OG1 3.28Å; M89-T92 PolarHBondContact O-N 2.91Å; F90-T92 PolarHBondContact O-N 3.41Å; T92-S94 VanDerWaalsContact C-N 3.33Å; T92-S94 PolarHBondContact O-N 3.16Å; T92-V95 PolarHBondContact O-N 3.18Å; T92-I96 HydrophobicContact CG2-CD1 3.79Å; T92-I96 WeakPolarHBondContact O-CB 3.26Å; T92-I96 VanDerWaalsContact O-CG1 3.27Å; T92-I96 WeakPolarHBondContact O-CG1 3.43Å; T92-I96 PolarHBondContact O-N 3.31Å; T92-F187 HydrophobicContact CG2-CE1 4.13Å |
| 93 | V | 88 | Confident | 86.2 | Confident | 14 Ų | 14 | 43.3 Ų | 43.3 | 9% | 0.085 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -61.1 | -41.8 | 176.7 | 169.8 | 0 | 0 | 0 | 0 | 111.1 | M89 F90 F91 N97 M191 | M89-V93 WeakPolarHBondContact O-CB 3.35Å; M89-V93 VanDerWaalsContact O-CG2 3.25Å; M89-V93 WeakPolarHBondContact O-CG2 3.43Å; M89-V93 PolarHBondContact O-N 3.19Å; F90-V93 PolarHBondContact O-N 3.29Å; F91-V93 PolarHBondContact O-N 2.65Å; V93-N97 WeakPolarHBondContact CG1-ND2 3.2Å; V93-N97 VanDerWaalsContact O-CB 3.25Å; V93-N97 WeakPolarHBondContact O-CB 3.43Å; V93-N97 PolarHBondContact O-N 3.45Å; V93-N97 PolarHBondContact O-ND2 2.96Å; V93-M191 HydrophobicContact CG2-CB 3.49Å; V93-M191 VanDerWaalsContact CG2-CB 3.49Å |
| 94 | S | 83.6 | Confident | 85.1 | Confident | 23 Ų | 23 | 48.6 Ų | 48.6 | 16% | 0.161 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -65.5 | -48.2 | -179.8 | -168 | 0 | 0 | 0 | 0 | 111.8 | F90 F91 T92 N97 N98 | F90-S94 WeakPolarHBondContact O-CB 3.24Å; F90-S94 PolarHBondContact O-N 2.91Å; F91-S94 PolarHBondContact O-N 2.75Å; F91-S94 VanDerWaalsContact O-N 3.16Å; T92-S94 VanDerWaalsContact C-N 3.33Å; T92-S94 PolarHBondContact O-N 3.16Å; S94-N97 PolarHBondContact O-N 3.32Å; S94-N98 WeakPolarHBondContact O-CB 3.39Å; S94-N98 VanDerWaalsContact O-CG 3.25Å; S94-N98 PolarHBondContact O-N 2.79Å |
| 95 | V | 83 | Confident | 84.1 | Confident | 54 Ų | 54 | 45.7 Ų | 45.7 | 33% | 0.327 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -61.5 | -47.2 | 179.5 | 170.9 | 0 | 0 | 0 | 0 | 110.6 | F91 T92 N98 Y99 | F91-V95 HydrophobicContact CD1-CG2 3.96Å; F91-V95 HydrophobicContact CE1-CG2 3.6Å; F91-V95 HydrophobicContact CE2-CG2 4.38Å; F91-V95 HydrophobicContact CG-CG2 4.5Å; F91-V95 HydrophobicContact CZ-CG2 3.83Å; F91-V95 WeakPolarHBondContact O-CG2 3.07Å; F91-V95 PolarHBondContact O-N 2.91Å; T92-V95 PolarHBondContact O-N 3.18Å; V95-N98 PolarHBondContact O-N 3.07Å; V95-Y99 WeakPolarHBondContact O-CB 3.41Å; V95-Y99 PolarHBondContact O-N 3.42Å |
| 96 | I | 88.3 | Confident | 82.9 | Confident | 33 Ų | 33 | 44.3 Ų | 44.3 | 17% | 0.169 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -66.3 | -41.7 | -179.6 | -65.6 | 174.1 | 0 | 0 | 0 | 111.2 | T92 N98 Y99 A100 M184 F187 A188 | T92-I96 HydrophobicContact CG2-CD1 3.79Å; T92-I96 WeakPolarHBondContact O-CB 3.26Å; T92-I96 VanDerWaalsContact O-CG1 3.27Å; T92-I96 WeakPolarHBondContact O-CG1 3.43Å; T92-I96 PolarHBondContact O-N 3.31Å; I96-N98 PolarHBondContact O-N 3.08Å; I96-Y99 PolarHBondContact O-N 2.78Å; I96-A100 VanDerWaalsContact O-CB 3.32Å; I96-A100 WeakPolarHBondContact O-CB 3.38Å; I96-A100 PolarHBondContact O-N 3.31Å; I96-M184 HydrophobicContact CG2-CB 3.83Å; I96-M184 HydrophobicContact CG2-CE 3.93Å; I96-M184 HydrophobicContact CG2-CG 4.38Å; I96-M184 WeakPolarHBondContact CG2-O 3.25Å; I96-M184 WeakPolarHBondContact O-CE 3.29Å; I96-F187 HydrophobicContact CD1-CD1 3.34Å; I96-F187 HydrophobicContact CD1-CE1 3.29Å; I96-A188 HydrophobicContact CB-CB 4.43Å; I96-A188 HydrophobicContact CG2-CB 4.01Å |
| 97 | N | 85.6 | Confident | 81.8 | Confident | 26 Ų | 26 | 46.8 Ų | 46.8 | 14% | 0.139 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -63.8 | -39.8 | 176.8 | -85 | -58.4 | 0 | 0 | 0 | 112.6 | V93 S94 H110 | V93-N97 WeakPolarHBondContact CG1-ND2 3.2Å; V93-N97 VanDerWaalsContact O-CB 3.25Å; V93-N97 WeakPolarHBondContact O-CB 3.43Å; V93-N97 PolarHBondContact O-N 3.45Å; V93-N97 PolarHBondContact O-ND2 2.96Å; S94-N97 PolarHBondContact O-N 3.32Å; N97-H110 PolarHBondContact O-NE2 3.19Å; N97-H110 PolarHBondContact OD1-NE2 3.18Å |
| 98 | N | 79.3 | Confident | 80.7 | Confident | 52 Ų | 52 | 46.6 Ų | 46.6 | 28% | 0.278 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -69.3 | -42.7 | 178.2 | -71.9 | -7 | 0 | 0 | 0 | 110.7 | N50 S94 V95 I96 A100 L101 | N50-N98 PolarHBondContact OD1-ND2 2.9Å; N50-N98 VanDerWaalsContact OD1-ND2 3.08Å; S94-N98 WeakPolarHBondContact O-CB 3.39Å; S94-N98 VanDerWaalsContact O-CG 3.25Å; S94-N98 PolarHBondContact O-N 2.79Å; V95-N98 PolarHBondContact O-N 3.07Å; I96-N98 PolarHBondContact O-N 3.08Å; N98-A100 VanDerWaalsContact C-N 3.33Å; N98-A100 PolarHBondContact O-N 2.99Å; N98-L101 PolarHBondContact O-N 3.5Å |
| 99 | Y | 81.8 | Confident | 79.8 | Confident | 128 Ų | 128 | 42.8 Ų | 42.8 | 50% | 0.502 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -69.1 | -30.8 | 179.3 | -165.4 | -118.6 | 0 | 0 | 0 | 112.4 | V95 I96 L101 N102 F103 M184 | V95-Y99 WeakPolarHBondContact O-CB 3.41Å; V95-Y99 PolarHBondContact O-N 3.42Å; I96-Y99 PolarHBondContact O-N 2.78Å; Y99-L101 PolarHBondContact O-N 2.92Å; Y99-N102 WeakPolarHBondContact CD2-ND2 3.43Å; Y99-N102 WeakPolarHBondContact O-CB 3.25Å; Y99-N102 PolarHBondContact O-N 3.03Å; Y99-N102 VanDerWaalsContact O-N 3.09Å; Y99-F103 AromaticContact CD1-CE2 3.67Å; Y99-F103 HydrophobicContact CD1-CE2 3.67Å; Y99-F103 HydrophobicContact CD1-CZ 4.16Å; Y99-F103 AromaticContact CE1-CE2 3.6Å; Y99-F103 HydrophobicContact CE1-CE2 3.6Å; Y99-F103 AromaticContact CE1-CZ 3.64Å; Y99-F103 HydrophobicContact CE1-CZ 3.64Å; Y99-F103 HydrophobicContact CG-CE2 4.37Å; Y99-F103 VanDerWaalsContact O-CD2 3.31Å; Y99-F103 WeakPolarHBondContact O-CD2 3.46Å; Y99-F103 WeakPolarHBondContact O-CE2 3.43Å; Y99-M184 HydrophobicContact CD1-CE 3.44Å; Y99-M184 VanDerWaalsContact CD1-CE 3.44Å; Y99-M184 HydrophobicContact CD1-SD 4.08Å; Y99-M184 HydrophobicContact CE1-CE 4.46Å; Y99-M184 HydrophobicContact CG-CE 4.05Å |
| 100 | A | 84.7 | Confident | 79.1 | Confident | 0 Ų | 0 | 42.3 Ų | 42.3 | 0% | 0 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -59.6 | -27.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | I96 N98 N102 F103 I105 M184 L185 | I96-A100 VanDerWaalsContact O-CB 3.32Å; I96-A100 WeakPolarHBondContact O-CB 3.38Å; I96-A100 PolarHBondContact O-N 3.31Å; N98-A100 VanDerWaalsContact C-N 3.33Å; N98-A100 PolarHBondContact O-N 2.99Å; A100-N102 PolarHBondContact O-N 3.36Å; A100-F103 PolarHBondContact O-N 3.05Å; A100-F103 VanDerWaalsContact O-N 3.16Å; A100-I105 HydrophobicContact CB-CD1 4.38Å; A100-I105 WeakPolarHBondContact O-CD1 3.48Å; A100-M184 HydrophobicContact CB-CB 4.37Å; A100-M184 HydrophobicContact CB-CE 4.17Å; A100-L185 HydrophobicContact CB-CD2 3.62Å; A100-L185 HydrophobicContact CB-CG 4Å |
| 101 | L | 74.1 | Confident | 78.4 | Confident | 54 Ų | 54 | 42 Ų | 42 | 28% | 0.283 | 22% | 0.223 | S | C | . | . | G | 310 helix | trans | -65.9 | -24.9 | 177.6 | -63.9 | 176.5 | 0 | 0 | 0 | 112.9 | N98 Y99 F103 M107 H110 | N98-L101 PolarHBondContact O-N 3.5Å; Y99-L101 PolarHBondContact O-N 2.92Å; L101-F103 PolarHBondContact O-N 2.98Å; L101-M107 HydrophobicContact CD1-SD 3.71Å; L101-M107 HydrophobicContact CD2-SD 3.43Å; L101-M107 WeakPolarHBondContact CD2-SD 3.41Å; L101-M107 HydrophobicContact CG-SD 4.22Å; L101-H110 HydrophobicContact CD2-CB 4.25Å |
| 102 | N | 77.5 | Confident | 78 | Confident | 96 Ų | 96 | 40.4 Ų | 40.4 | 51% | 0.513 | 22% | 0.216 | S | C | . | . | G | 310 helix | trans | -70.1 | -10.1 | 176.7 | -62.9 | -23.2 | 0 | 0 | 0 | 112.8 | Y99 A100 N104 Y177 | Y99-N102 WeakPolarHBondContact CD2-ND2 3.43Å; Y99-N102 WeakPolarHBondContact O-CB 3.25Å; Y99-N102 PolarHBondContact O-N 3.03Å; Y99-N102 VanDerWaalsContact O-N 3.09Å; A100-N102 PolarHBondContact O-N 3.36Å; N102-N104 VanDerWaalsContact C-N 3.33Å; N102-N104 PolarHBondContact O-N 3.08Å; N102-Y177 WeakPolarHBondContact O-CE1 3.35Å |
| 103 | F | 80.4 | Confident | 77.6 | Confident | 11 Ų | 11 | 39 Ų | 39 | 5% | 0.048 | 21% | 0.206 | C | C | . | . | G | 310 helix | trans | -96.2 | 33.5 | -178.3 | -62.7 | -92.3 | 0 | 0 | 0 | 112.9 | Y99 A100 L101 I105 Y177 I180 M184 | Y99-F103 AromaticContact CD1-CE2 3.67Å; Y99-F103 HydrophobicContact CD1-CE2 3.67Å; Y99-F103 HydrophobicContact CD1-CZ 4.16Å; Y99-F103 AromaticContact CE1-CE2 3.6Å; Y99-F103 HydrophobicContact CE1-CE2 3.6Å; Y99-F103 AromaticContact CE1-CZ 3.64Å; Y99-F103 HydrophobicContact CE1-CZ 3.64Å; Y99-F103 HydrophobicContact CG-CE2 4.37Å; Y99-F103 VanDerWaalsContact O-CD2 3.31Å; Y99-F103 WeakPolarHBondContact O-CD2 3.46Å; Y99-F103 WeakPolarHBondContact O-CE2 3.43Å; A100-F103 PolarHBondContact O-N 3.05Å; A100-F103 VanDerWaalsContact O-N 3.16Å; L101-F103 PolarHBondContact O-N 2.98Å; F103-I105 PolarHBondContact O-N 2.86Å; F103-Y177 HydrophobicContact CB-CD1 4.38Å; F103-Y177 HydrophobicContact CB-CE1 4.3Å; F103-Y177 AromaticContact CD1-CD1 3.87Å; F103-Y177 HydrophobicContact CD1-CD1 3.87Å; F103-Y177 AromaticContact CD1-CD2 3.96Å; F103-Y177 HydrophobicContact CD1-CD2 3.96Å; F103-Y177 AromaticContact CD1-CE1 3.67Å; F103-Y177 HydrophobicContact CD1-CE1 3.67Å; F103-Y177 AromaticContact CD1-CE2 3.75Å; F103-Y177 HydrophobicContact CD1-CE2 3.75Å; F103-Y177 HydrophobicContact CD1-CG 4.01Å; F103-Y177 AromaticContact CD1-CZ 3.59Å; F103-Y177 VanDerWaalsContact CD1-O 3.26Å; F103-Y177 WeakPolarHBondContact CD1-O 3.38Å; F103-Y177 HydrophobicContact CE1-CD2 4.11Å; F103-Y177 HydrophobicContact CE1-CE1 4.34Å; F103-Y177 AromaticContact CE1-CE2 3.65Å; F103-Y177 HydrophobicContact CE1-CE2 3.65Å; F103-Y177 AromaticContact CE1-CZ 3.78Å; F103-Y177 HydrophobicContact CG-CE1 4.19Å; F103-I180 HydrophobicContact CD1-CB 4.21Å; F103-I180 HydrophobicContact CD1-CG2 4.09Å; F103-I180 HydrophobicContact CE1-CB 4.13Å; F103-I180 HydrophobicContact CE1-CG2 3.59Å; F103-I180 HydrophobicContact CZ-CG2 4Å; F103-M184 HydrophobicContact CD2-SD 4.02Å; F103-M184 HydrophobicContact CE2-CE 4.02Å; F103-M184 HydrophobicContact CE2-SD 3.4Å; F103-M184 WeakPolarHBondContact CE2-SD 3.23Å; F103-M184 HydrophobicContact CZ-SD 3.8Å |
| 104 | N | 70.4 | Confident | 77.1 | Confident | 111 Ų | 111 | 46 Ų | 46 | 59% | 0.594 | 23% | 0.23 | S | C | * | . | S | Bend | trans | 55.1 | 31.7 | -179 | -63.9 | -42.5 | 0 | 0 | 0 | 113.8 | N102 | N102-N104 VanDerWaalsContact C-N 3.33Å; N102-N104 PolarHBondContact O-N 3.08Å |
| 105 | I | 71.4 | Confident | 76.8 | Confident | 8 Ų | 8 | 46.6 Ų | 46.6 | 4% | 0.041 | 24% | 0.235 | C | C | . | . | trans | -85.8 | 116.6 | 173.7 | -68.7 | 166.6 | 0 | 0 | 0 | 108.3 | A100 F103 L109 H110 I182 L185 | A100-I105 HydrophobicContact CB-CD1 4.38Å; A100-I105 WeakPolarHBondContact O-CD1 3.48Å; F103-I105 PolarHBondContact O-N 2.86Å; I105-L109 HydrophobicContact CG2-CB 4.23Å; I105-L109 HydrophobicContact CG2-CD2 4.22Å; I105-L109 HydrophobicContact CG2-CG 4.38Å; I105-H110 HydrophobicContact CG2-CB 4.19Å; I105-I182 HydrophobicContact CD1-CD1 4.48Å; I105-L185 HydrophobicContact CD1-CD1 3.75Å; I105-L185 HydrophobicContact CD1-CG 4.14Å; I105-L185 HydrophobicContact CG2-CD1 4.12Å | ||
| 106 | A | 67.6 | Low | 76.8 | Confident | 45 Ų | 45 | 44.2 Ų | 44.2 | 37% | 0.372 | 22% | 0.222 | S | C | . | . | trans | -61.7 | 140.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111 | P108 L109 H110 | A106-P108 VanDerWaalsContact C-CD 3.46Å; A106-P108 VanDerWaalsContact C-N 3.32Å; A106-L109 WeakPolarHBondContact O-CA 3.3Å; A106-L109 WeakPolarHBondContact O-CB 3.44Å; A106-L109 PolarHBondContact O-N 3.27Å; A106-H110 PolarHBondContact O-N 3.36Å | ||
| 107 | M | 68.6 | Low | 76.5 | Confident | 56 Ų | 56 | 43.7 Ų | 43.7 | 28% | 0.276 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -52.1 | -40.7 | 178.6 | -69.5 | -62.6 | -68.4 | 0 | 0 | 113.8 | L101 L109 H110 M111 | L101-M107 HydrophobicContact CD1-SD 3.71Å; L101-M107 HydrophobicContact CD2-SD 3.43Å; L101-M107 WeakPolarHBondContact CD2-SD 3.41Å; L101-M107 HydrophobicContact CG-SD 4.22Å; M107-L109 PolarHBondContact O-N 2.83Å; M107-H110 WeakPolarHBondContact O-CB 3.23Å; M107-H110 PolarHBondContact O-N 3.46Å; M107-M111 WeakPolarHBondContact O-CG 3.38Å; M107-M111 PolarHBondContact O-N 2.97Å |
| 108 | P | 65.9 | Low | 76.2 | Confident | 9 Ų | 9 | 43.9 Ų | 43.9 | 6% | 0.058 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -61.3 | -40.3 | 174.1 | -24.7 | 35.6 | 0 | 0 | 0 | 113.3 | A106 M111 I112 N308 F310 | A106-P108 VanDerWaalsContact C-CD 3.46Å; A106-P108 VanDerWaalsContact C-N 3.32Å; P108-M111 PolarHBondContact O-N 3.02Å; P108-I112 WeakPolarHBondContact O-CD1 3.45Å; P108-I112 VanDerWaalsContact O-CG1 3.29Å; P108-I112 WeakPolarHBondContact O-CG1 3.34Å; P108-I112 PolarHBondContact O-N 3.26Å; P108-N308 HydrophobicContact CG-CB 4.4Å; P108-F310 HydrophobicContact CB-CD2 4.09Å; P108-F310 HydrophobicContact CB-CE2 3.98Å; P108-F310 HydrophobicContact CG-CD2 4.4Å |
| 109 | L | 73.1 | Confident | 76.6 | Confident | 2 Ų | 2 | 42.7 Ų | 42.7 | 1% | 0.01 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -64.3 | -41.7 | 177.3 | -175.7 | 65.2 | 0 | 0 | 0 | 111 | I105 A106 M107 M111 I112 F113 C151 W178 I182 | I105-L109 HydrophobicContact CG2-CB 4.23Å; I105-L109 HydrophobicContact CG2-CD2 4.22Å; I105-L109 HydrophobicContact CG2-CG 4.38Å; A106-L109 WeakPolarHBondContact O-CA 3.3Å; A106-L109 WeakPolarHBondContact O-CB 3.44Å; A106-L109 PolarHBondContact O-N 3.27Å; M107-L109 PolarHBondContact O-N 2.83Å; L109-M111 PolarHBondContact O-N 3.39Å; L109-I112 PolarHBondContact O-N 2.89Å; L109-F113 HydrophobicContact CD1-CD2 3.98Å; L109-F113 HydrophobicContact CD1-CE2 3.91Å; L109-F113 HydrophobicContact CG-CD2 4.04Å; L109-F113 HydrophobicContact CG-CE2 4.18Å; L109-F113 WeakPolarHBondContact O-CD2 3.37Å; L109-F113 PolarHBondContact O-N 3.35Å; L109-C151 HydrophobicContact CD1-CB 4.47Å; L109-W178 HydrophobicContact CD2-CZ2 4.22Å; L109-I182 HydrophobicContact CD2-CD1 4.18Å |
| 110 | H | 76.8 | Confident | 76.7 | Confident | 19 Ų | 19 | 37 Ų | 37 | 9% | 0.088 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -56.4 | -47.4 | 172.6 | -174.7 | -79.9 | 0 | 0 | 0 | 112 | N97 L101 I105 A106 M107 I112 F113 R114 L185 | N97-H110 PolarHBondContact O-NE2 3.19Å; N97-H110 PolarHBondContact OD1-NE2 3.18Å; L101-H110 HydrophobicContact CD2-CB 4.25Å; I105-H110 HydrophobicContact CG2-CB 4.19Å; A106-H110 PolarHBondContact O-N 3.36Å; M107-H110 WeakPolarHBondContact O-CB 3.23Å; M107-H110 PolarHBondContact O-N 3.46Å; H110-I112 VanDerWaalsContact C-N 3.34Å; H110-I112 PolarHBondContact O-N 3.45Å; H110-F113 PolarHBondContact O-N 2.97Å; H110-R114 WeakPolarHBondContact O-CB 3.39Å; H110-R114 PolarHBondContact O-N 3.39Å; H110-L185 VanDerWaalsContact CD2-CD2 3.45Å; H110-L185 WeakPolarHBondContact CD2-CD2 3.36Å |
| 111 | M | 71.6 | Confident | 76.7 | Confident | 56 Ų | 56 | 39 Ų | 39 | 28% | 0.276 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -64.3 | -36.6 | 177.8 | -67.2 | -171.3 | -158.2 | 0 | 0 | 112.8 | M107 P108 L109 R114 S115 L299 | M107-M111 WeakPolarHBondContact O-CG 3.38Å; M107-M111 PolarHBondContact O-N 2.97Å; P108-M111 PolarHBondContact O-N 3.02Å; L109-M111 PolarHBondContact O-N 3.39Å; M111-R114 WeakPolarHBondContact O-CB 3.23Å; M111-R114 PolarHBondContact O-N 3.21Å; M111-S115 PolarHBondContact O-N 3.48Å; M111-S115 PolarHBondContact O-OG 3.44Å; M111-L299 HydrophobicContact SD-CD1 3.8Å |
| 112 | I | 76.8 | Confident | 77.3 | Confident | 4 Ų | 4 | 36.4 Ų | 36.4 | 2% | 0.021 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -66.1 | -49 | 175.8 | -71.8 | 157.4 | 0 | 0 | 0 | 110.5 | P108 L109 H110 R114 S115 I148 C151 V321 | P108-I112 WeakPolarHBondContact O-CD1 3.45Å; P108-I112 VanDerWaalsContact O-CG1 3.29Å; P108-I112 WeakPolarHBondContact O-CG1 3.34Å; P108-I112 PolarHBondContact O-N 3.26Å; L109-I112 PolarHBondContact O-N 2.89Å; H110-I112 VanDerWaalsContact C-N 3.34Å; H110-I112 PolarHBondContact O-N 3.45Å; I112-R114 VanDerWaalsContact C-N 3.26Å; I112-R114 PolarHBondContact O-N 3.44Å; I112-S115 VanDerWaalsContact O-CB 3.29Å; I112-S115 WeakPolarHBondContact O-CB 3.43Å; I112-S115 PolarHBondContact O-N 3.29Å; I112-I148 HydrophobicContact CG2-CB 4.27Å; I112-I148 HydrophobicContact CG2-CG1 3.8Å; I112-C151 HydrophobicContact CD1-CB 3.72Å; I112-C151 VanDerWaalsContact CD1-SG 3.55Å; I112-C151 HydrophobicContact CG2-CB 4.16Å; I112-V321 HydrophobicContact CG2-CG2 4.4Å |
| 113 | F | 81.6 | Confident | 77.8 | Confident | 19 Ų | 19 | 35.7 Ų | 35.7 | 8% | 0.083 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -57 | -41.7 | 174.7 | -96.6 | -90.6 | 0 | 0 | 0 | 111.5 | L109 H110 S115 G116 I148 T152 I182 L185 L189 | L109-F113 HydrophobicContact CD1-CD2 3.98Å; L109-F113 HydrophobicContact CD1-CE2 3.91Å; L109-F113 HydrophobicContact CG-CD2 4.04Å; L109-F113 HydrophobicContact CG-CE2 4.18Å; L109-F113 WeakPolarHBondContact O-CD2 3.37Å; L109-F113 PolarHBondContact O-N 3.35Å; H110-F113 PolarHBondContact O-N 2.97Å; F113-S115 PolarHBondContact O-N 3.42Å; F113-S115 VanDerWaalsContact O-N 3.12Å; F113-G116 WeakPolarHBondContact O-CA 3.42Å; F113-G116 PolarHBondContact O-N 2.85Å; F113-I148 HydrophobicContact CD2-CG2 4.38Å; F113-I148 HydrophobicContact CE1-CG2 4.28Å; F113-I148 HydrophobicContact CE2-CG2 4.16Å; F113-I148 HydrophobicContact CZ-CG2 4.09Å; F113-T152 HydrophobicContact CE2-CG2 4.29Å; F113-T152 VanDerWaalsContact CE2-OG1 3.26Å; F113-T152 WeakPolarHBondContact CE2-OG1 3.43Å; F113-T152 HydrophobicContact CZ-CG2 4.31Å; F113-I182 HydrophobicContact CE1-CG2 4.05Å; F113-I182 HydrophobicContact CE2-CD1 3.73Å; F113-I182 HydrophobicContact CZ-CD1 3.86Å; F113-I182 HydrophobicContact CZ-CG2 3.79Å; F113-L185 HydrophobicContact CB-CD1 4.11Å; F113-L185 HydrophobicContact CD1-CB 4.35Å; F113-L185 HydrophobicContact CD2-CD1 4.33Å; F113-L185 HydrophobicContact CG-CD1 4.12Å; F113-L189 HydrophobicContact CB-CD1 4.39Å; F113-L189 HydrophobicContact CD1-CD1 3.99Å; F113-L189 VanDerWaalsContact O-CD1 3.23Å; F113-L189 WeakPolarHBondContact O-CD1 3.26Å; F113-L189 WeakPolarHBondContact O-CD2 3.41Å |
| 114 | R | 76.8 | Confident | 78 | Confident | 159 Ų | 159 | 36.6 Ų | 36.6 | 60% | 0.6 | 19% | 0.192 | S | C | * | . | H | α-helix | trans | -55.8 | -29.5 | 175.9 | -161 | 173.9 | -178.6 | 171.8 | 2.5 | 113.5 | H110 M111 I112 G116 S117 | H110-R114 WeakPolarHBondContact O-CB 3.39Å; H110-R114 PolarHBondContact O-N 3.39Å; M111-R114 WeakPolarHBondContact O-CB 3.23Å; M111-R114 PolarHBondContact O-N 3.21Å; I112-R114 VanDerWaalsContact C-N 3.26Å; I112-R114 PolarHBondContact O-N 3.44Å; R114-G116 VanDerWaalsContact C-N 3.26Å; R114-G116 PolarHBondContact O-N 2.87Å; R114-S117 PolarHBondContact O-N 2.88Å; R114-S117 PolarHBondContact O-OG 3.32Å |
| 115 | S | 78 | Confident | 78.6 | Confident | 36 Ų | 36 | 31.3 Ų | 31.3 | 25% | 0.252 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -72.4 | -19.9 | 174.9 | -55.6 | 0 | 0 | 0 | 0 | 112.8 | M111 I112 F113 S117 L118 | M111-S115 PolarHBondContact O-N 3.48Å; M111-S115 PolarHBondContact O-OG 3.44Å; I112-S115 VanDerWaalsContact O-CB 3.29Å; I112-S115 WeakPolarHBondContact O-CB 3.43Å; I112-S115 PolarHBondContact O-N 3.29Å; F113-S115 PolarHBondContact O-N 3.42Å; F113-S115 VanDerWaalsContact O-N 3.12Å; S115-S117 PolarHBondContact O-N 2.92Å; S115-L118 PolarHBondContact O-N 3.5Å |
| 116 | G | 81.7 | Confident | 79.4 | Confident | 5 Ų | 5 | 33.8 Ų | 33.8 | 5% | 0.052 | 18% | 0.176 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -65.4 | -8.3 | 171.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | F113 R114 L118 I119 A120 | F113-G116 WeakPolarHBondContact O-CA 3.42Å; F113-G116 PolarHBondContact O-N 2.85Å; R114-G116 VanDerWaalsContact C-N 3.26Å; R114-G116 PolarHBondContact O-N 2.87Å; G116-L118 PolarHBondContact O-N 3.32Å; G116-L118 VanDerWaalsContact O-N 3.11Å; G116-I119 WeakPolarHBondContact O-CB 3.3Å; G116-I119 PolarHBondContact O-N 3.4Å; G116-A120 PolarHBondContact O-N 3.18Å |
| 117 | S | 82.2 | Confident | 80.4 | Confident | 22 Ų | 22 | 36.5 Ų | 36.5 | 15% | 0.154 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -58.1 | -26 | 173.9 | 68.8 | 0 | 0 | 0 | 0 | 112.7 | R114 S115 I119 A120 N121 | R114-S117 PolarHBondContact O-N 2.88Å; R114-S117 PolarHBondContact O-OG 3.32Å; S115-S117 PolarHBondContact O-N 2.92Å; S117-I119 VanDerWaalsContact C-N 3.34Å; S117-A120 PolarHBondContact O-N 3.49Å; S117-N121 VanDerWaalsContact O-CB 3.23Å; S117-N121 WeakPolarHBondContact O-CB 3.43Å; S117-N121 PolarHBondContact O-N 3.11Å; S117-N121 PolarHBondContact O-ND2 2.94Å |
| 118 | L | 80.9 | Confident | 81.3 | Confident | 30 Ų | 30 | 37.4 Ų | 37.4 | 16% | 0.157 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -63.8 | -40.6 | 175.3 | -59.5 | 174.4 | 0 | 0 | 0 | 111.9 | S115 G116 M122 T325 Y328 | S115-L118 PolarHBondContact O-N 3.5Å; G116-L118 PolarHBondContact O-N 3.32Å; G116-L118 VanDerWaalsContact O-N 3.11Å; L118-M122 PolarHBondContact O-N 3.03Å; L118-T325 HydrophobicContact CD1-CG2 3.68Å; L118-Y328 HydrophobicContact CB-CD1 4.41Å; L118-Y328 HydrophobicContact CB-CE1 4.43Å; L118-Y328 HydrophobicContact CD1-CD1 4.24Å; L118-Y328 HydrophobicContact CD1-CG 4.39Å; L118-Y328 HydrophobicContact CD2-CD1 3.8Å; L118-Y328 HydrophobicContact CD2-CE1 3.78Å; L118-Y328 HydrophobicContact CG-CD1 4.37Å |
| 119 | I | 85.8 | Confident | 82 | Confident | 27 Ų | 27 | 39.3 Ų | 39.3 | 14% | 0.138 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -65 | -51.6 | 177.2 | -55.8 | 166.9 | 0 | 0 | 0 | 108.9 | G116 S117 N121 M122 I123 I141 V144 S145 I148 | G116-I119 WeakPolarHBondContact O-CB 3.3Å; G116-I119 PolarHBondContact O-N 3.4Å; S117-I119 VanDerWaalsContact C-N 3.34Å; I119-N121 VanDerWaalsContact C-N 3.34Å; I119-N121 PolarHBondContact O-N 3.33Å; I119-M122 PolarHBondContact O-N 3.37Å; I119-I123 HydrophobicContact CG2-CD1 3.78Å; I119-I123 HydrophobicContact CG2-CG1 4.45Å; I119-I123 WeakPolarHBondContact O-CG1 3.35Å; I119-I123 PolarHBondContact O-N 2.95Å; I119-I141 HydrophobicContact CG1-CG1 4.29Å; I119-I141 HydrophobicContact CG1-CG2 4.16Å; I119-I141 HydrophobicContact CG2-CG2 4Å; I119-V144 HydrophobicContact CD1-CB 4.18Å; I119-V144 HydrophobicContact CD1-CG1 3.75Å; I119-V144 HydrophobicContact CG1-CB 4.38Å; I119-V144 HydrophobicContact CG1-CG1 4.11Å; I119-S145 VanDerWaalsContact CD1-OG 3.26Å; I119-S145 WeakPolarHBondContact CD1-OG 3.34Å; I119-I148 HydrophobicContact CD1-CD1 4.22Å |
| 120 | A | 84.8 | Confident | 82.6 | Confident | 7 Ų | 7 | 47 Ų | 47 | 6% | 0.058 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -58.4 | -43.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | G116 S117 M122 I123 L124 L190 A193 | G116-A120 PolarHBondContact O-N 3.18Å; S117-A120 PolarHBondContact O-N 3.49Å; A120-M122 PolarHBondContact O-N 3.45Å; A120-I123 PolarHBondContact O-N 3.27Å; A120-L124 WeakPolarHBondContact O-CB 3.34Å; A120-L124 WeakPolarHBondContact O-CG 3.45Å; A120-L124 PolarHBondContact O-N 2.71Å; A120-L190 HydrophobicContact CB-CD2 4.01Å; A120-A193 HydrophobicContact CB-CB 3.53Å |
| 121 | N | 85.5 | Confident | 82.8 | Confident | 42 Ų | 42 | 49.2 Ų | 49.2 | 23% | 0.225 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -60.2 | -44.6 | 176.3 | -84.1 | -36.7 | 0 | 0 | 0 | 112.4 | S117 I119 G125 A193 | S117-N121 VanDerWaalsContact O-CB 3.23Å; S117-N121 WeakPolarHBondContact O-CB 3.43Å; S117-N121 PolarHBondContact O-N 3.11Å; S117-N121 PolarHBondContact O-ND2 2.94Å; I119-N121 VanDerWaalsContact C-N 3.34Å; I119-N121 PolarHBondContact O-N 3.33Å; N121-G125 WeakPolarHBondContact O-CA 3.3Å; N121-G125 PolarHBondContact O-N 3.08Å; N121-A193 HydrophobicContact CB-CB 4.4Å; N121-A193 WeakPolarHBondContact OD1-CA 3.45Å; N121-A193 WeakPolarHBondContact OD1-CB 3.44Å; N121-A193 PolarHBondContact OD1-O 2.95Å |
| 122 | M | 86.1 | Confident | 83.5 | Confident | 1 Ų | 1 | 58.2 Ų | 58.2 | 1% | 0.005 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -67.7 | -46.4 | 179.6 | -178.6 | 158.1 | 150.4 | 0 | 0 | 111.3 | L118 I119 A120 G125 I126 Y133 K137 Y138 I141 Y328 | L118-M122 PolarHBondContact O-N 3.03Å; I119-M122 PolarHBondContact O-N 3.37Å; A120-M122 PolarHBondContact O-N 3.45Å; M122-G125 PolarHBondContact O-N 2.92Å; M122-I126 HydrophobicContact CE-CD1 4.24Å; M122-I126 HydrophobicContact CG-CD1 4.23Å; M122-I126 WeakPolarHBondContact O-CG1 3.37Å; M122-I126 PolarHBondContact O-N 2.75Å; M122-Y133 HydrophobicContact CE-CD2 3.99Å; M122-Y133 HydrophobicContact CE-CG 3.94Å; M122-Y133 HydrophobicContact CG-CD1 4.32Å; M122-Y133 HydrophobicContact CG-CD2 3.68Å; M122-Y133 HydrophobicContact CG-CE1 4.32Å; M122-Y133 HydrophobicContact CG-CE2 3.7Å; M122-Y133 HydrophobicContact CG-CG 4.01Å; M122-Y133 HydrophobicContact SD-CD1 4.07Å; M122-Y133 HydrophobicContact SD-CD2 4Å; M122-Y133 HydrophobicContact SD-CG 3.75Å; M122-K137 HydrophobicContact CE-CB 4.34Å; M122-K137 HydrophobicContact SD-CB 3.83Å; M122-Y138 HydrophobicContact CE-CD1 3.37Å; M122-Y138 HydrophobicContact CE-CD2 4Å; M122-Y138 HydrophobicContact CE-CE1 3.25Å; M122-Y138 HydrophobicContact CE-CE2 3.91Å; M122-Y138 HydrophobicContact CE-CG 3.75Å; M122-I141 HydrophobicContact CB-CD1 3.71Å; M122-I141 HydrophobicContact CE-CD1 3.74Å; M122-I141 HydrophobicContact CG-CD1 3.69Å; M122-I141 HydrophobicContact SD-CD1 3.28Å; M122-I141 WeakPolarHBondContact SD-CD1 3.41Å; M122-I141 HydrophobicContact SD-CG1 4.2Å; M122-Y328 HydrophobicContact CB-CE2 4.33Å; M122-Y328 HydrophobicContact SD-CE2 4.1Å |
| 123 | I | 87.1 | Confident | 83.9 | Confident | 81 Ų | 81 | 60.5 Ų | 60.5 | 42% | 0.415 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -57.7 | -52.9 | 177.5 | -68.3 | 171.7 | 0 | 0 | 0 | 110.4 | I119 A120 G125 I126 I127 | I119-I123 HydrophobicContact CG2-CD1 3.78Å; I119-I123 HydrophobicContact CG2-CG1 4.45Å; I119-I123 WeakPolarHBondContact O-CG1 3.35Å; I119-I123 PolarHBondContact O-N 2.95Å; A120-I123 PolarHBondContact O-N 3.27Å; I123-G125 VanDerWaalsContact C-N 3.28Å; I123-G125 PolarHBondContact O-N 3.3Å; I123-I126 PolarHBondContact O-N 2.89Å; I123-I126 VanDerWaalsContact O-N 3.17Å; I123-I127 HydrophobicContact CG2-CD1 3.76Å; I123-I127 WeakPolarHBondContact O-CG1 3.31Å; I123-I127 PolarHBondContact O-N 3.42Å |
| 124 | L | 84.9 | Confident | 84.2 | Confident | 30 Ų | 30 | 62 Ų | 62 | 16% | 0.157 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -65.1 | -33.2 | 178.6 | -74.6 | 161.6 | 0 | 0 | 0 | 111.8 | A120 I127 I128 L190 A193 R194 I197 | A120-L124 WeakPolarHBondContact O-CB 3.34Å; A120-L124 WeakPolarHBondContact O-CG 3.45Å; A120-L124 PolarHBondContact O-N 2.71Å; L124-I127 PolarHBondContact O-N 3.26Å; L124-I128 HydrophobicContact CB-CD1 4.34Å; L124-I128 HydrophobicContact CD2-CD1 3.81Å; L124-I128 HydrophobicContact CD2-CG1 4.45Å; L124-I128 VanDerWaalsContact O-CB 3.23Å; L124-I128 WeakPolarHBondContact O-CB 3.3Å; L124-I128 WeakPolarHBondContact O-CG1 3.22Å; L124-I128 PolarHBondContact O-N 3.45Å; L124-L190 HydrophobicContact CD1-CD2 4.42Å; L124-A193 HydrophobicContact CD1-CB 3.73Å; L124-R194 HydrophobicContact CD1-CB 4.42Å; L124-I197 HydrophobicContact CB-CD1 3.32Å |
| 125 | G | 83.9 | Confident | 84.6 | Confident | 0 Ų | 0 | 58.3 Ų | 58.3 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -66.5 | -34.1 | 174 | 0 | 0 | 0 | 0 | 0 | 113.4 | N121 M122 I123 L129 K130 K131 | N121-G125 WeakPolarHBondContact O-CA 3.3Å; N121-G125 PolarHBondContact O-N 3.08Å; M122-G125 PolarHBondContact O-N 2.92Å; I123-G125 VanDerWaalsContact C-N 3.28Å; I123-G125 PolarHBondContact O-N 3.3Å; G125-L129 CarbonylContact O-C 3.56Å; G125-L129 WeakPolarHBondContact O-CA 3.48Å; G125-L129 VanDerWaalsContact O-CB 3.3Å; G125-L129 WeakPolarHBondContact O-CB 3.27Å; G125-L129 PolarHBondContact O-N 2.93Å; G125-K130 PolarHBondContact O-N 3.48Å; G125-K131 PolarHBondContact O-N 2.96Å |
| 126 | I | 86.8 | Confident | 84.9 | Confident | 60 Ų | 60 | 59.2 Ų | 59.2 | 31% | 0.308 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -69.7 | -44.6 | 171.5 | -64.5 | 168.6 | 0 | 0 | 0 | 109.9 | M122 I123 K130 Y133 Y138 | M122-I126 HydrophobicContact CE-CD1 4.24Å; M122-I126 HydrophobicContact CG-CD1 4.23Å; M122-I126 WeakPolarHBondContact O-CG1 3.37Å; M122-I126 PolarHBondContact O-N 2.75Å; I123-I126 PolarHBondContact O-N 2.89Å; I123-I126 VanDerWaalsContact O-N 3.17Å; I126-K130 VanDerWaalsContact O-CA 3.23Å; I126-K130 WeakPolarHBondContact O-CA 3.38Å; I126-K130 PolarHBondContact O-N 2.98Å; I126-Y133 HydrophobicContact CD1-CD2 4.15Å; I126-Y133 HydrophobicContact CD1-CE2 4.4Å; I126-Y133 HydrophobicContact CG1-CD2 3.76Å; I126-Y133 HydrophobicContact CG1-CE2 3.64Å; I126-Y138 HydrophobicContact CD1-CE1 4.44Å |
| 127 | I | 89.8 | Confident | 85.1 | Confident | 101 Ų | 101 | 60.3 Ų | 60.3 | 52% | 0.518 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -71.1 | -51.6 | -174.3 | -66.5 | 170.4 | 0 | 0 | 0 | 111.7 | I123 L124 K130 | I123-I127 HydrophobicContact CG2-CD1 3.76Å; I123-I127 WeakPolarHBondContact O-CG1 3.31Å; I123-I127 PolarHBondContact O-N 3.42Å; L124-I127 PolarHBondContact O-N 3.26Å; I127-K130 WeakPolarHBondContact O-CE 3.39Å; I127-K130 PolarHBondContact O-NZ 3.37Å; I127-K130 VanDerWaalsContact O-NZ 3.08Å |
| 128 | I | 86.4 | Confident | 85.4 | Confident | 76 Ų | 76 | 64.8 Ų | 64.8 | 39% | 0.39 | 32% | 0.321 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.5 | -52.4 | -171.2 | -59.7 | 177.5 | 0 | 0 | 0 | 111.2 | L124 | L124-I128 HydrophobicContact CB-CD1 4.34Å; L124-I128 HydrophobicContact CD2-CD1 3.81Å; L124-I128 HydrophobicContact CD2-CG1 4.45Å; L124-I128 VanDerWaalsContact O-CB 3.23Å; L124-I128 WeakPolarHBondContact O-CB 3.3Å; L124-I128 WeakPolarHBondContact O-CG1 3.22Å; L124-I128 PolarHBondContact O-N 3.45Å |
| 129 | L | 81.8 | Confident | 85.9 | Confident | 48 Ų | 48 | 68 Ų | 68 | 25% | 0.251 | 34% | 0.338 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.2 | -4.4 | -175.6 | -69.3 | 146 | 0 | 0 | 0 | 112.9 | G125 K131 I197 | G125-L129 CarbonylContact O-C 3.56Å; G125-L129 WeakPolarHBondContact O-CA 3.48Å; G125-L129 VanDerWaalsContact O-CB 3.3Å; G125-L129 WeakPolarHBondContact O-CB 3.27Å; G125-L129 PolarHBondContact O-N 2.93Å; L129-K131 HydrophobicContact CB-CD 4.1Å; L129-K131 HydrophobicContact CB-CG 3.87Å; L129-K131 HydrophobicContact CD1-CD 4.24Å; L129-K131 PolarHBondContact O-N 3.47Å; L129-K131 VanDerWaalsContact O-N 3.07Å; L129-I197 HydrophobicContact CD1-CB 4.4Å; L129-I197 HydrophobicContact CD1-CD1 4.49Å; L129-I197 HydrophobicContact CD1-CG1 4.11Å; L129-I197 HydrophobicContact CD1-CG2 3.6Å; L129-I197 HydrophobicContact CG-CG2 4.15Å |
| 130 | K | 86.2 | Confident | 86.1 | Confident | 164 Ų | 164 | 66.7 Ų | 66.7 | 71% | 0.713 | 33% | 0.331 | S | S | * | . | trans | 52.3 | 28.5 | -175.5 | -56.8 | -59.2 | -174 | -163.9 | 0 | 113.7 | G125 I126 I127 | G125-K130 PolarHBondContact O-N 3.48Å; I126-K130 VanDerWaalsContact O-CA 3.23Å; I126-K130 WeakPolarHBondContact O-CA 3.38Å; I126-K130 PolarHBondContact O-N 2.98Å; I127-K130 WeakPolarHBondContact O-CE 3.39Å; I127-K130 PolarHBondContact O-NZ 3.37Å; I127-K130 VanDerWaalsContact O-NZ 3.08Å | ||
| 131 | K | 81.1 | Confident | 86.3 | Confident | 65 Ų | 65 | 67.7 Ų | 67.7 | 28% | 0.283 | 34% | 0.335 | S | S | . | . | trans | -70.8 | 145.5 | 179.8 | -75.1 | 178.8 | 177.6 | -179.5 | 0 | 111 | G125 L129 Y133 E200 | G125-K131 PolarHBondContact O-N 2.96Å; L129-K131 HydrophobicContact CB-CD 4.1Å; L129-K131 HydrophobicContact CB-CG 3.87Å; L129-K131 HydrophobicContact CD1-CD 4.24Å; L129-K131 PolarHBondContact O-N 3.47Å; L129-K131 VanDerWaalsContact O-N 3.07Å; K131-Y133 HydrophobicContact CB-CE2 3.87Å; K131-E200 IonicContact NZ-OE1 3.56Å; K131-E200 PolarHBondContact NZ-OE1 2.62Å; K131-E200 IonicContact NZ-OE2 2.93Å; K131-E200 PolarHBondContact NZ-OE2 2.93Å | ||
| 132 | R | 84.8 | Confident | 86.5 | Confident | 245 Ų | 245 | 69.8 Ų | 69.8 | 93% | 0.925 | 35% | 0.349 | S | S | * | . | trans | -105.9 | 137.4 | 168.4 | -64.1 | -173.9 | 179 | -169.7 | -0.1 | 109.3 | ||||
| 133 | Y | 85.1 | Confident | 86.8 | Confident | 52 Ų | 52 | 72 Ų | 72 | 20% | 0.204 | 36% | 0.361 | C | S | . | . | trans | -113.5 | 155.3 | -177.5 | -64.8 | -89.3 | 0 | 0 | 0 | 110.9 | M122 I126 K131 K137 Y138 | M122-Y133 HydrophobicContact CE-CD2 3.99Å; M122-Y133 HydrophobicContact CE-CG 3.94Å; M122-Y133 HydrophobicContact CG-CD1 4.32Å; M122-Y133 HydrophobicContact CG-CD2 3.68Å; M122-Y133 HydrophobicContact CG-CE1 4.32Å; M122-Y133 HydrophobicContact CG-CE2 3.7Å; M122-Y133 HydrophobicContact CG-CG 4.01Å; M122-Y133 HydrophobicContact SD-CD1 4.07Å; M122-Y133 HydrophobicContact SD-CD2 4Å; M122-Y133 HydrophobicContact SD-CG 3.75Å; I126-Y133 HydrophobicContact CD1-CD2 4.15Å; I126-Y133 HydrophobicContact CD1-CE2 4.4Å; I126-Y133 HydrophobicContact CG1-CD2 3.76Å; I126-Y133 HydrophobicContact CG1-CE2 3.64Å; K131-Y133 HydrophobicContact CB-CE2 3.87Å; Y133-K137 HydrophobicContact CD1-CG 4.34Å; Y133-Y138 WeakPolarHBondContact O-CE2 3.21Å | ||
| 134 | S | 87.6 | Confident | 86.9 | Confident | 50 Ų | 50 | 68.2 Ų | 68.2 | 35% | 0.35 | 34% | 0.342 | S | S | . | . | trans | -71.6 | 157.4 | 176.8 | 60.8 | 0 | 0 | 0 | 0 | 111.8 | S136 K137 Y138 E330 | S134-S136 PolarHBondContact O-N 2.8Å; S134-K137 WeakPolarHBondContact O-CB 3.37Å; S134-K137 PolarHBondContact O-N 3.2Å; S134-K137 WeakPolarHBondContact OG-CG 3.48Å; S134-Y138 WeakPolarHBondContact O-CD2 3.49Å; S134-Y138 PolarHBondContact O-N 3.26Å; S134-E330 PolarHBondContact OG-OE1 3.39Å | ||
| 135 | A | 86.4 | Confident | 87.1 | Confident | 82 Ų | 82 | 69.1 Ų | 69.1 | 68% | 0.678 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -55.5 | -35 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | K137 Y138 L139 | A135-K137 VanDerWaalsContact C-N 3.28Å; A135-K137 PolarHBondContact O-N 2.99Å; A135-Y138 PolarHBondContact O-N 3.15Å; A135-L139 PolarHBondContact O-N 3.45Å |
| 136 | S | 84.9 | Confident | 87.4 | Confident | 56 Ų | 56 | 72.2 Ų | 72.2 | 39% | 0.392 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -59.9 | -34.9 | 175.5 | -54.7 | 0 | 0 | 0 | 0 | 112.8 | S134 L139 S140 | S134-S136 PolarHBondContact O-N 2.8Å; S136-L139 PolarHBondContact O-N 2.92Å; S136-S140 WeakPolarHBondContact O-CB 3.19Å; S136-S140 PolarHBondContact O-N 2.97Å; S136-S140 PolarHBondContact O-OG 3.21Å |
| 137 | K | 85.5 | Confident | 87.6 | Confident | 28 Ų | 28 | 69.3 Ų | 69.3 | 12% | 0.122 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -70 | -36.9 | 177 | -56.1 | -75.5 | 179 | 177.3 | 0 | 111.6 | M122 Y133 S134 A135 S140 I141 Y328 E330 | M122-K137 HydrophobicContact CE-CB 4.34Å; M122-K137 HydrophobicContact SD-CB 3.83Å; Y133-K137 HydrophobicContact CD1-CG 4.34Å; S134-K137 WeakPolarHBondContact O-CB 3.37Å; S134-K137 PolarHBondContact O-N 3.2Å; S134-K137 WeakPolarHBondContact OG-CG 3.48Å; A135-K137 VanDerWaalsContact C-N 3.28Å; A135-K137 PolarHBondContact O-N 2.99Å; K137-S140 VanDerWaalsContact O-CB 3.31Å; K137-S140 WeakPolarHBondContact O-CB 3.27Å; K137-S140 PolarHBondContact O-N 3.15Å; K137-I141 PolarHBondContact O-N 2.95Å; K137-I141 VanDerWaalsContact O-N 3.08Å; K137-Y328 HydrophobicContact CB-CD2 4.4Å; K137-Y328 HydrophobicContact CB-CE2 4.49Å; K137-Y328 HydrophobicContact CD-CD2 3.94Å; K137-Y328 HydrophobicContact CD-CE2 4.11Å; K137-Y328 HydrophobicContact CD-CG 4.32Å; K137-Y328 WeakPolarHBondContact CD-O 3.37Å; K137-Y328 WeakPolarHBondContact CE-O 3.28Å; K137-Y328 PolarHBondContact NZ-O 3.44Å; K137-E330 WeakPolarHBondContact CE-OE1 3.41Å; K137-E330 WeakPolarHBondContact CE-OE2 3.25Å; K137-E330 IonicContact NZ-OE1 2.65Å; K137-E330 IonicContact NZ-OE2 2.91Å; K137-E330 PolarHBondContact NZ-OE2 2.8Å |
| 138 | Y | 88.9 | Confident | 87.4 | Confident | 115 Ų | 115 | 65.4 Ų | 65.4 | 45% | 0.451 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -66 | -45 | 173.9 | -70.2 | -79.9 | 0 | 0 | 0 | 111.7 | M122 I126 Y133 S134 A135 S140 I141 V142 | M122-Y138 HydrophobicContact CE-CD1 3.37Å; M122-Y138 HydrophobicContact CE-CD2 4Å; M122-Y138 HydrophobicContact CE-CE1 3.25Å; M122-Y138 HydrophobicContact CE-CE2 3.91Å; M122-Y138 HydrophobicContact CE-CG 3.75Å; I126-Y138 HydrophobicContact CD1-CE1 4.44Å; Y133-Y138 WeakPolarHBondContact O-CE2 3.21Å; S134-Y138 WeakPolarHBondContact O-CD2 3.49Å; S134-Y138 PolarHBondContact O-N 3.26Å; A135-Y138 PolarHBondContact O-N 3.15Å; Y138-S140 PolarHBondContact O-N 2.73Å; Y138-I141 PolarHBondContact O-N 2.7Å; Y138-I141 VanDerWaalsContact O-N 3.16Å; Y138-V142 PolarHBondContact O-N 3.17Å; Y138-V142 VanDerWaalsContact O-N 3.12Å |
| 139 | L | 90.9 | Very high | 87.6 | Confident | 97 Ų | 97 | 68.1 Ų | 68.1 | 51% | 0.508 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -58.7 | -39.1 | 173.4 | 178.8 | 59 | 0 | 0 | 0 | 111.6 | A135 S136 I141 V142 L143 L327 | A135-L139 PolarHBondContact O-N 3.45Å; S136-L139 PolarHBondContact O-N 2.92Å; L139-I141 VanDerWaalsContact C-N 3.35Å; L139-I141 PolarHBondContact O-N 3.06Å; L139-V142 PolarHBondContact O-N 3.47Å; L139-L143 HydrophobicContact CG-CD1 4.43Å; L139-L143 WeakPolarHBondContact O-CG 3.23Å; L139-L143 PolarHBondContact O-N 3.39Å; L139-L327 HydrophobicContact CB-CD2 4.04Å; L139-L327 HydrophobicContact CD2-CD2 3.8Å; L139-L327 HydrophobicContact CG-CD2 3.76Å |
| 140 | S | 88.5 | Confident | 87.9 | Confident | 0 Ų | 0 | 67.8 Ų | 67.8 | 0% | 0 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -60.7 | -42.5 | 176.2 | -55.3 | 0 | 0 | 0 | 0 | 112.7 | S136 K137 Y138 V142 L143 V144 G324 L327 Y328 | S136-S140 WeakPolarHBondContact O-CB 3.19Å; S136-S140 PolarHBondContact O-N 2.97Å; S136-S140 PolarHBondContact O-OG 3.21Å; K137-S140 VanDerWaalsContact O-CB 3.31Å; K137-S140 WeakPolarHBondContact O-CB 3.27Å; K137-S140 PolarHBondContact O-N 3.15Å; Y138-S140 PolarHBondContact O-N 2.73Å; S140-V142 VanDerWaalsContact C-N 3.34Å; S140-L143 PolarHBondContact O-N 3.48Å; S140-V144 WeakPolarHBondContact O-CG2 3.48Å; S140-V144 PolarHBondContact O-N 3.44Å; S140-G324 VanDerWaalsContact CB-O 3.27Å; S140-G324 WeakPolarHBondContact CB-O 3.26Å; S140-L327 VanDerWaalsContact OG-CB 3.29Å; S140-L327 WeakPolarHBondContact OG-CB 3.44Å; S140-L327 WeakPolarHBondContact OG-CD2 3.18Å; S140-L327 WeakPolarHBondContact OG-CG 3.4Å; S140-Y328 WeakPolarHBondContact OG-CA 3.43Å; S140-Y328 PolarHBondContact OG-N 2.98Å |
| 141 | I | 88.9 | Confident | 87.8 | Confident | 29 Ų | 29 | 60 Ų | 60 | 15% | 0.149 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -62.1 | -43.2 | 175.5 | -74.6 | 179.4 | 0 | 0 | 0 | 111 | I119 M122 K137 Y138 L139 L143 V144 S145 | I119-I141 HydrophobicContact CG1-CG1 4.29Å; I119-I141 HydrophobicContact CG1-CG2 4.16Å; I119-I141 HydrophobicContact CG2-CG2 4Å; M122-I141 HydrophobicContact CB-CD1 3.71Å; M122-I141 HydrophobicContact CE-CD1 3.74Å; M122-I141 HydrophobicContact CG-CD1 3.69Å; M122-I141 HydrophobicContact SD-CD1 3.28Å; M122-I141 WeakPolarHBondContact SD-CD1 3.41Å; M122-I141 HydrophobicContact SD-CG1 4.2Å; K137-I141 PolarHBondContact O-N 2.95Å; K137-I141 VanDerWaalsContact O-N 3.08Å; Y138-I141 PolarHBondContact O-N 2.7Å; Y138-I141 VanDerWaalsContact O-N 3.16Å; L139-I141 VanDerWaalsContact C-N 3.35Å; L139-I141 PolarHBondContact O-N 3.06Å; I141-L143 VanDerWaalsContact C-N 3.3Å; I141-L143 PolarHBondContact O-N 3.1Å; I141-V144 PolarHBondContact O-N 3.08Å; I141-S145 VanDerWaalsContact O-CB 3.26Å; I141-S145 WeakPolarHBondContact O-CB 3.05Å; I141-S145 PolarHBondContact O-N 3.41Å; I141-S145 PolarHBondContact O-OG 3Å |
| 142 | V | 91.4 | Very high | 88 | Confident | 86 Ų | 86 | 58 Ų | 58 | 52% | 0.521 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -60.5 | -42.6 | 177.9 | 174 | 0 | 0 | 0 | 0 | 111 | Y138 L139 S140 T146 | Y138-V142 PolarHBondContact O-N 3.17Å; Y138-V142 VanDerWaalsContact O-N 3.12Å; L139-V142 PolarHBondContact O-N 3.47Å; S140-V142 VanDerWaalsContact C-N 3.34Å; V142-T146 WeakPolarHBondContact O-CB 3.33Å; V142-T146 PolarHBondContact O-N 3.44Å; V142-T146 PolarHBondContact O-OG1 3.39Å |
| 143 | L | 91.3 | Very high | 87.9 | Confident | 47 Ų | 47 | 49.5 Ų | 49.5 | 25% | 0.246 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -64 | -51.8 | 176 | -69.3 | 170.9 | 0 | 0 | 0 | 111.5 | L139 S140 I141 S145 T146 G147 V320 I323 L327 | L139-L143 HydrophobicContact CG-CD1 4.43Å; L139-L143 WeakPolarHBondContact O-CG 3.23Å; L139-L143 PolarHBondContact O-N 3.39Å; S140-L143 PolarHBondContact O-N 3.48Å; I141-L143 VanDerWaalsContact C-N 3.3Å; I141-L143 PolarHBondContact O-N 3.1Å; L143-S145 VanDerWaalsContact C-N 3.32Å; L143-S145 PolarHBondContact O-N 2.96Å; L143-T146 PolarHBondContact O-N 2.81Å; L143-G147 PolarHBondContact O-N 2.86Å; L143-V320 HydrophobicContact CB-CG1 4.2Å; L143-V320 HydrophobicContact CD2-CG1 4.07Å; L143-V320 VanDerWaalsContact O-CG1 3.25Å; L143-V320 WeakPolarHBondContact O-CG1 3.45Å; L143-I323 HydrophobicContact CD1-CG2 4.31Å; L143-L327 HydrophobicContact CD1-CD2 4.15Å |
| 144 | V | 88.8 | Confident | 87.8 | Confident | 2 Ų | 2 | 48.5 Ų | 48.5 | 1% | 0.012 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -59.5 | -43.9 | 179.6 | 176.1 | 0 | 0 | 0 | 0 | 111 | I119 S140 I141 G147 I148 V321 | I119-V144 HydrophobicContact CD1-CB 4.18Å; I119-V144 HydrophobicContact CD1-CG1 3.75Å; I119-V144 HydrophobicContact CG1-CB 4.38Å; I119-V144 HydrophobicContact CG1-CG1 4.11Å; S140-V144 WeakPolarHBondContact O-CG2 3.48Å; S140-V144 PolarHBondContact O-N 3.44Å; I141-V144 PolarHBondContact O-N 3.08Å; V144-G147 PolarHBondContact O-N 3.49Å; V144-I148 HydrophobicContact CG1-CD1 3.77Å; V144-I148 HydrophobicContact CG1-CG1 4.4Å; V144-I148 VanDerWaalsContact O-CG1 3.28Å; V144-I148 WeakPolarHBondContact O-CG1 3.48Å; V144-I148 PolarHBondContact O-N 3.44Å; V144-V321 HydrophobicContact CG1-CG1 4.41Å |
| 145 | S | 89.4 | Confident | 87.3 | Confident | 49 Ų | 49 | 46.5 Ų | 46.5 | 34% | 0.343 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -61.2 | -46.2 | 176.4 | -64.4 | 0 | 0 | 0 | 0 | 112.1 | I119 I141 L143 G147 I148 F149 | I119-S145 VanDerWaalsContact CD1-OG 3.26Å; I119-S145 WeakPolarHBondContact CD1-OG 3.34Å; I141-S145 VanDerWaalsContact O-CB 3.26Å; I141-S145 WeakPolarHBondContact O-CB 3.05Å; I141-S145 PolarHBondContact O-N 3.41Å; I141-S145 PolarHBondContact O-OG 3Å; L143-S145 VanDerWaalsContact C-N 3.32Å; L143-S145 PolarHBondContact O-N 2.96Å; S145-G147 PolarHBondContact O-N 2.95Å; S145-I148 PolarHBondContact O-N 3.06Å; S145-F149 VanDerWaalsContact O-CB 3.3Å; S145-F149 WeakPolarHBondContact O-CB 3.34Å; S145-F149 PolarHBondContact O-N 3.06Å |
| 146 | T | 91.3 | Very high | 86.9 | Confident | 64 Ų | 64 | 43.7 Ų | 43.7 | 39% | 0.393 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -60.6 | -45.4 | 177.2 | -58.8 | 0 | 0 | 0 | 0 | 111.4 | V142 L143 F149 I150 | V142-T146 WeakPolarHBondContact O-CB 3.33Å; V142-T146 PolarHBondContact O-N 3.44Å; V142-T146 PolarHBondContact O-OG1 3.39Å; L143-T146 PolarHBondContact O-N 2.81Å; T146-F149 PolarHBondContact O-N 2.9Å; T146-I150 HydrophobicContact CG2-CD1 3.92Å; T146-I150 HydrophobicContact CG2-CG1 4.46Å; T146-I150 WeakPolarHBondContact O-CG1 3.36Å; T146-I150 PolarHBondContact O-N 2.98Å |
| 147 | G | 89.5 | Confident | 86.6 | Confident | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -65.2 | -42 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | L143 V144 S145 F149 I150 C151 G317 | L143-G147 PolarHBondContact O-N 2.86Å; V144-G147 PolarHBondContact O-N 3.49Å; S145-G147 PolarHBondContact O-N 2.95Å; G147-F149 VanDerWaalsContact C-N 3.33Å; G147-F149 PolarHBondContact O-N 3.39Å; G147-I150 PolarHBondContact O-N 3.3Å; G147-C151 PolarHBondContact O-N 3.33Å; G147-C151 VanDerWaalsContact O-N 3.14Å; G147-C151 PolarHBondContact O-SG 3.4Å; G147-G317 WeakPolarHBondContact CA-O 3.3Å |
| 148 | I | 87.6 | Confident | 85.9 | Confident | 18 Ų | 18 | 48.3 Ų | 48.3 | 9% | 0.092 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -60.9 | -44.7 | 172.8 | -67.2 | 167.9 | 0 | 0 | 0 | 110.1 | I112 F113 I119 V144 S145 C151 T152 V321 | I112-I148 HydrophobicContact CG2-CB 4.27Å; I112-I148 HydrophobicContact CG2-CG1 3.8Å; F113-I148 HydrophobicContact CD2-CG2 4.38Å; F113-I148 HydrophobicContact CE1-CG2 4.28Å; F113-I148 HydrophobicContact CE2-CG2 4.16Å; F113-I148 HydrophobicContact CZ-CG2 4.09Å; I119-I148 HydrophobicContact CD1-CD1 4.22Å; V144-I148 HydrophobicContact CG1-CD1 3.77Å; V144-I148 HydrophobicContact CG1-CG1 4.4Å; V144-I148 VanDerWaalsContact O-CG1 3.28Å; V144-I148 WeakPolarHBondContact O-CG1 3.48Å; V144-I148 PolarHBondContact O-N 3.44Å; S145-I148 PolarHBondContact O-N 3.06Å; I148-C151 PolarHBondContact O-N 2.92Å; I148-T152 VanDerWaalsContact O-CB 3.28Å; I148-T152 WeakPolarHBondContact O-CB 3.31Å; I148-T152 PolarHBondContact O-N 3.05Å; I148-T152 PolarHBondContact O-OG1 2.98Å; I148-V321 HydrophobicContact CG1-CG2 4.12Å |
| 149 | F | 89.2 | Confident | 84.9 | Confident | 134 Ų | 134 | 44.4 Ų | 44.4 | 59% | 0.588 | 24% | 0.236 | S | C | * | . | H | α-helix | trans | -61.8 | -46.4 | -179.7 | -177.1 | -104.9 | 0 | 0 | 0 | 112.5 | S145 T146 G147 C151 T152 I153 | S145-F149 VanDerWaalsContact O-CB 3.3Å; S145-F149 WeakPolarHBondContact O-CB 3.34Å; S145-F149 PolarHBondContact O-N 3.06Å; T146-F149 PolarHBondContact O-N 2.9Å; G147-F149 VanDerWaalsContact C-N 3.33Å; G147-F149 PolarHBondContact O-N 3.39Å; F149-C151 PolarHBondContact O-N 3.14Å; F149-T152 PolarHBondContact O-N 3.21Å; F149-I153 HydrophobicContact CD1-CD1 3.95Å; F149-I153 HydrophobicContact CD2-CD1 4.47Å; F149-I153 HydrophobicContact CE1-CD1 3.33Å; F149-I153 HydrophobicContact CE1-CG1 4.42Å; F149-I153 HydrophobicContact CE2-CD1 3.92Å; F149-I153 HydrophobicContact CE2-CG1 4.41Å; F149-I153 HydrophobicContact CG-CD1 4.5Å; F149-I153 HydrophobicContact CZ-CD1 3.33Å; F149-I153 HydrophobicContact CZ-CG1 4.28Å; F149-I153 PolarHBondContact O-N 3.17Å |
| 150 | I | 89.3 | Confident | 83.8 | Confident | 41 Ų | 41 | 45.9 Ų | 45.9 | 21% | 0.21 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -56.9 | -51.9 | 175.9 | -69.1 | 167.5 | 0 | 0 | 0 | 110.3 | T146 G147 T152 I153 M154 W313 | T146-I150 HydrophobicContact CG2-CD1 3.92Å; T146-I150 HydrophobicContact CG2-CG1 4.46Å; T146-I150 WeakPolarHBondContact O-CG1 3.36Å; T146-I150 PolarHBondContact O-N 2.98Å; G147-I150 PolarHBondContact O-N 3.3Å; I150-T152 VanDerWaalsContact C-N 3.31Å; I150-T152 PolarHBondContact O-N 3.49Å; I150-I153 PolarHBondContact O-N 3.19Å; I150-M154 VanDerWaalsContact O-CG 3.31Å; I150-M154 WeakPolarHBondContact O-CG 3.38Å; I150-M154 PolarHBondContact O-N 2.88Å; I150-M154 VanDerWaalsContact O-N 3.13Å; I150-W313 HydrophobicContact CG2-CE3 4.44Å |
| 151 | C | 83.9 | Confident | 82.8 | Confident | 0 Ų | 0 | 51 Ų | 51 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -62.5 | -39.9 | -179.9 | -69.2 | 0 | 0 | 0 | 0 | 112.1 | L109 I112 G147 I148 F149 M154 S155 | L109-C151 HydrophobicContact CD1-CB 4.47Å; I112-C151 HydrophobicContact CD1-CB 3.72Å; I112-C151 VanDerWaalsContact CD1-SG 3.55Å; I112-C151 HydrophobicContact CG2-CB 4.16Å; G147-C151 PolarHBondContact O-N 3.33Å; G147-C151 VanDerWaalsContact O-N 3.14Å; G147-C151 PolarHBondContact O-SG 3.4Å; I148-C151 PolarHBondContact O-N 2.92Å; F149-C151 PolarHBondContact O-N 3.14Å; C151-M154 PolarHBondContact O-N 2.81Å; C151-S155 WeakPolarHBondContact O-CB 3.36Å; C151-S155 PolarHBondContact O-N 2.86Å; C151-S155 PolarHBondContact O-OG 2.9Å; C151-S155 VanDerWaalsContact O-OG 3.1Å |
| 152 | T | 83.8 | Confident | 81.5 | Confident | 22 Ų | 22 | 55.6 Ų | 55.6 | 14% | 0.135 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -63 | -45.5 | 179.8 | -57.8 | 0 | 0 | 0 | 0 | 111.7 | F113 I148 F149 I150 M154 S155 A156 W178 | F113-T152 HydrophobicContact CE2-CG2 4.29Å; F113-T152 VanDerWaalsContact CE2-OG1 3.26Å; F113-T152 WeakPolarHBondContact CE2-OG1 3.43Å; F113-T152 HydrophobicContact CZ-CG2 4.31Å; I148-T152 VanDerWaalsContact O-CB 3.28Å; I148-T152 WeakPolarHBondContact O-CB 3.31Å; I148-T152 PolarHBondContact O-N 3.05Å; I148-T152 PolarHBondContact O-OG1 2.98Å; F149-T152 PolarHBondContact O-N 3.21Å; I150-T152 VanDerWaalsContact C-N 3.31Å; I150-T152 PolarHBondContact O-N 3.49Å; T152-M154 VanDerWaalsContact C-N 3.33Å; T152-M154 PolarHBondContact O-N 2.92Å; T152-S155 PolarHBondContact O-N 3.45Å; T152-A156 WeakPolarHBondContact O-CB 3.37Å; T152-A156 PolarHBondContact O-N 3.11Å; T152-W178 HydrophobicContact CG2-CH2 3.65Å; T152-W178 HydrophobicContact CG2-CZ2 3.99Å |
| 153 | I | 83.7 | Confident | 80 | Confident | 67 Ų | 67 | 52.9 Ų | 52.9 | 34% | 0.344 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -62.6 | -41.7 | 176.6 | -74.7 | -179.7 | 0 | 0 | 0 | 111.2 | F149 I150 A156 K157 | F149-I153 HydrophobicContact CD1-CD1 3.95Å; F149-I153 HydrophobicContact CD2-CD1 4.47Å; F149-I153 HydrophobicContact CE1-CD1 3.33Å; F149-I153 HydrophobicContact CE1-CG1 4.42Å; F149-I153 HydrophobicContact CE2-CD1 3.92Å; F149-I153 HydrophobicContact CE2-CG1 4.41Å; F149-I153 HydrophobicContact CG-CD1 4.5Å; F149-I153 HydrophobicContact CZ-CD1 3.33Å; F149-I153 HydrophobicContact CZ-CG1 4.28Å; F149-I153 PolarHBondContact O-N 3.17Å; I150-I153 PolarHBondContact O-N 3.19Å; I153-A156 PolarHBondContact O-N 3.06Å; I153-K157 HydrophobicContact CG2-CD 4.46Å; I153-K157 WeakPolarHBondContact O-CG 3.11Å; I153-K157 PolarHBondContact O-N 3.09Å |
| 154 | M | 83 | Confident | 78.4 | Confident | 32 Ų | 32 | 54.3 Ų | 54.3 | 16% | 0.158 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -67.9 | -39.5 | -178.9 | -68.4 | -57 | -48.5 | 0 | 0 | 112.4 | I150 C151 T152 K157 Q158 W313 | I150-M154 VanDerWaalsContact O-CG 3.31Å; I150-M154 WeakPolarHBondContact O-CG 3.38Å; I150-M154 PolarHBondContact O-N 2.88Å; I150-M154 VanDerWaalsContact O-N 3.13Å; C151-M154 PolarHBondContact O-N 2.81Å; T152-M154 VanDerWaalsContact C-N 3.33Å; T152-M154 PolarHBondContact O-N 2.92Å; M154-K157 PolarHBondContact O-N 2.88Å; M154-K157 HydrophobicContact SD-CD 4.49Å; M154-Q158 PolarHBondContact O-N 3.35Å; M154-W313 HydrophobicContact CE-CB 4.02Å; M154-W313 HydrophobicContact CE-CG 4.07Å; M154-W313 HydrophobicContact CG-CB 3.47Å; M154-W313 VanDerWaalsContact CG-CB 3.47Å; M154-W313 HydrophobicContact CG-CG 4.16Å; M154-W313 HydrophobicContact SD-CB 3.77Å; M154-W313 HydrophobicContact SD-CG 3.8Å |
| 155 | S | 78.1 | Confident | 77 | Confident | 8 Ų | 8 | 62.3 Ų | 62.3 | 6% | 0.056 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -65.3 | -40.1 | 171.9 | -62.1 | 0 | 0 | 0 | 0 | 111.7 | C151 T152 K157 Q158 V159 H314 | C151-S155 WeakPolarHBondContact O-CB 3.36Å; C151-S155 PolarHBondContact O-N 2.86Å; C151-S155 PolarHBondContact O-OG 2.9Å; C151-S155 VanDerWaalsContact O-OG 3.1Å; T152-S155 PolarHBondContact O-N 3.45Å; S155-K157 VanDerWaalsContact C-N 3.33Å; S155-K157 PolarHBondContact O-N 3.38Å; S155-Q158 PolarHBondContact O-N 3.19Å; S155-V159 PolarHBondContact O-N 3.09Å; S155-V159 VanDerWaalsContact O-N 3.16Å; S155-H314 PolarHBondContact OG-NE2 3.36Å; S155-H314 VanDerWaalsContact OG-NE2 3.1Å |
| 156 | A | 76.9 | Confident | 75.6 | Confident | 22 Ų | 22 | 61.8 Ų | 61.8 | 18% | 0.182 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -61.7 | -39.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | T152 I153 V159 H160 W178 | T152-A156 WeakPolarHBondContact O-CB 3.37Å; T152-A156 PolarHBondContact O-N 3.11Å; I153-A156 PolarHBondContact O-N 3.06Å; A156-V159 PolarHBondContact O-N 3.27Å; A156-H160 PolarHBondContact O-N 3.41Å; A156-W178 HydrophobicContact CB-CH2 3.67Å; A156-W178 HydrophobicContact CB-CZ2 4.07Å; A156-W178 HydrophobicContact CB-CZ3 4.04Å |
| 157 | K | 77.9 | Confident | 74.5 | Confident | 118 Ų | 118 | 61.9 Ų | 61.9 | 51% | 0.513 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -63 | -42.5 | 175.1 | -75 | -177.4 | 175.3 | -171.7 | 0 | 112.4 | I153 M154 S155 V159 H160 D161 | I153-K157 HydrophobicContact CG2-CD 4.46Å; I153-K157 WeakPolarHBondContact O-CG 3.11Å; I153-K157 PolarHBondContact O-N 3.09Å; M154-K157 PolarHBondContact O-N 2.88Å; M154-K157 HydrophobicContact SD-CD 4.49Å; S155-K157 VanDerWaalsContact C-N 3.33Å; S155-K157 PolarHBondContact O-N 3.38Å; K157-V159 VanDerWaalsContact C-N 3.31Å; K157-V159 PolarHBondContact O-N 3.44Å; K157-H160 WeakPolarHBondContact O-CB 3.18Å; K157-H160 PolarHBondContact O-N 2.93Å; K157-H160 VanDerWaalsContact O-N 3.12Å; K157-D161 VanDerWaalsContact O-CG 3.3Å; K157-D161 PolarHBondContact O-N 3.16Å |
| 158 | Q | 71.9 | Confident | 73.6 | Confident | 64 Ų | 64 | 71.6 Ų | 71.6 | 30% | 0.299 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -61.1 | -39.2 | 176.2 | -72.7 | 177.5 | -52.1 | 0 | 0 | 112.4 | M154 S155 H160 V162 H314 | M154-Q158 PolarHBondContact O-N 3.35Å; S155-Q158 PolarHBondContact O-N 3.19Å; Q158-H160 VanDerWaalsContact C-N 3.34Å; Q158-V162 WeakPolarHBondContact O-CG2 3.46Å; Q158-V162 PolarHBondContact O-N 3.09Å; Q158-H314 PolarHBondContact OE1-CE1 2.92Å |
| 159 | V | 68.3 | Low | 72.9 | Confident | 33 Ų | 33 | 77.1 Ų | 77.1 | 20% | 0.2 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -64.4 | -41.6 | 174.4 | 175.9 | 0 | 0 | 0 | 0 | 110.8 | S155 A156 K157 S163 | S155-V159 PolarHBondContact O-N 3.09Å; S155-V159 VanDerWaalsContact O-N 3.16Å; A156-V159 PolarHBondContact O-N 3.27Å; K157-V159 VanDerWaalsContact C-N 3.31Å; K157-V159 PolarHBondContact O-N 3.44Å; V159-S163 WeakPolarHBondContact O-CB 3.39Å; V159-S163 PolarHBondContact O-N 2.98Å; V159-S163 VanDerWaalsContact O-N 3.13Å; V159-S163 PolarHBondContact O-OG 3.19Å |
| 160 | H | 68 | Low | 72.2 | Confident | 127 Ų | 127 | 76.4 Ų | 76.4 | 59% | 0.588 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -66.3 | -41.9 | 178.9 | -172.8 | -83.5 | 0 | 0 | 0 | 112.7 | A156 K157 Q158 V162 S163 S164 | A156-H160 PolarHBondContact O-N 3.41Å; K157-H160 WeakPolarHBondContact O-CB 3.18Å; K157-H160 PolarHBondContact O-N 2.93Å; K157-H160 VanDerWaalsContact O-N 3.12Å; Q158-H160 VanDerWaalsContact C-N 3.34Å; H160-V162 VanDerWaalsContact C-N 3.34Å; H160-V162 PolarHBondContact O-N 3.48Å; H160-S163 CarbonylContact O-C 3.57Å; H160-S163 PolarHBondContact O-N 2.92Å; H160-S163 VanDerWaalsContact O-N 3.08Å; H160-S164 PolarHBondContact O-N 3.28Å |
| 161 | D | 66.3 | Low | 71.5 | Confident | 109 Ų | 109 | 75.4 Ų | 75.4 | 58% | 0.583 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -66.3 | -33.9 | 179.4 | -67.1 | -21 | 0 | 0 | 0 | 112.3 | K157 S163 S164 | K157-D161 VanDerWaalsContact O-CG 3.3Å; K157-D161 PolarHBondContact O-N 3.16Å; D161-S163 VanDerWaalsContact C-N 3.31Å; D161-S164 PolarHBondContact O-OG 3.3Å |
| 162 | V | 62.5 | Low | 71.2 | Confident | 125 Ų | 125 | 80.8 Ų | 80.8 | 76% | 0.758 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -71.7 | -29.5 | 172.2 | 175.3 | 0 | 0 | 0 | 0 | 111.5 | Q158 H160 | Q158-V162 WeakPolarHBondContact O-CG2 3.46Å; Q158-V162 PolarHBondContact O-N 3.09Å; H160-V162 VanDerWaalsContact C-N 3.34Å; H160-V162 PolarHBondContact O-N 3.48Å |
| 163 | S | 59.9 | Low | 71.2 | Confident | 29 Ų | 29 | 87.5 Ų | 87.5 | 20% | 0.203 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -85.3 | -13.5 | -177.8 | -52.8 | 0 | 0 | 0 | 0 | 113.6 | V159 H160 D161 D165 G166 | V159-S163 WeakPolarHBondContact O-CB 3.39Å; V159-S163 PolarHBondContact O-N 2.98Å; V159-S163 VanDerWaalsContact O-N 3.13Å; V159-S163 PolarHBondContact O-OG 3.19Å; H160-S163 CarbonylContact O-C 3.57Å; H160-S163 PolarHBondContact O-N 2.92Å; H160-S163 VanDerWaalsContact O-N 3.08Å; D161-S163 VanDerWaalsContact C-N 3.31Å; S163-D165 VanDerWaalsContact C-N 3.29Å; S163-D165 PolarHBondContact O-N 3.5Å; S163-G166 PolarHBondContact O-N 3.48Å |
| 164 | S | 57.2 | Low | 70.9 | Confident | 77 Ų | 77 | 85.6 Ų | 85.6 | 54% | 0.538 | 46% | 0.456 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.4 | -10.7 | -175.6 | 57.4 | 0 | 0 | 0 | 0 | 115.1 | H160 D161 | H160-S164 PolarHBondContact O-N 3.28Å; D161-S164 PolarHBondContact O-OG 3.3Å |
| 165 | D | 58.7 | Low | 70.8 | Confident | 170 Ų | 170 | 88.3 Ų | 88.3 | 91% | 0.909 | 47% | 0.467 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.9 | -5.2 | 169.3 | -102.4 | -5.2 | 0 | 0 | 0 | 112.8 | S163 | S163-D165 VanDerWaalsContact C-N 3.29Å; S163-D165 PolarHBondContact O-N 3.5Å |
| 166 | G | 60.5 | Low | 71.2 | Confident | 38 Ų | 38 | 92.3 Ų | 92.3 | 39% | 0.392 | 49% | 0.486 | S | S | . | . | S | Bend | trans | -106.3 | 176.6 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | S163 | S163-G166 PolarHBondContact O-N 3.48Š|
| 167 | S | 67.9 | Low | 71.5 | Confident | 65 Ų | 65 | 95.9 Ų | 95.9 | 46% | 0.455 | 50% | 0.495 | S | S | . | . | trans | -64.3 | 149.6 | 174.3 | 63.2 | 0 | 0 | 0 | 0 | 111.8 | E169 Q170 G171 | S167-E169 PolarHBondContact O-N 3.11Å; S167-Q170 WeakPolarHBondContact O-CB 3.36Å; S167-Q170 PolarHBondContact O-N 2.71Å; S167-Q170 WeakPolarHBondContact OG-CG 3.39Å; S167-Q170 PolarHBondContact OG-OE1 3.32Å; S167-G171 PolarHBondContact O-N 3.45Å | ||
| 168 | K | 70.1 | Confident | 71.8 | Confident | 205 Ų | 205 | 91 Ų | 91 | 89% | 0.891 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -53.1 | -31.4 | 179.9 | -74.3 | -178.1 | 178.3 | 175.4 | 0 | 113.7 | L172 | K168-L172 PolarHBondContact O-N 3.16Å |
| 169 | E | 73.2 | Confident | 72.5 | Confident | 133 Ų | 133 | 91.8 Ų | 91.8 | 62% | 0.621 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -67.8 | -44.2 | 176.4 | -63.9 | -141.8 | 162.6 | 0 | 0 | 111.9 | S167 G171 L172 Y173 | S167-E169 PolarHBondContact O-N 3.11Å; E169-G171 VanDerWaalsContact C-N 3.29Å; E169-G171 PolarHBondContact O-N 3.02Å; E169-L172 PolarHBondContact O-N 2.92Å; E169-L172 VanDerWaalsContact O-N 3.14Å; E169-Y173 HydrophobicContact CB-CD2 4.42Å; E169-Y173 HydrophobicContact CB-CE2 4.22Å; E169-Y173 WeakPolarHBondContact O-CD2 3.25Å; E169-Y173 PolarHBondContact O-N 3.5Å |
| 170 | Q | 74.6 | Confident | 73.5 | Confident | 119 Ų | 119 | 94.5 Ų | 94.5 | 56% | 0.556 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -59.8 | -38.7 | 177.3 | -74.9 | 164.8 | -36.7 | 0 | 0 | 112.2 | S167 Y173 A174 | S167-Q170 WeakPolarHBondContact O-CB 3.36Å; S167-Q170 PolarHBondContact O-N 2.71Å; S167-Q170 WeakPolarHBondContact OG-CG 3.39Å; S167-Q170 PolarHBondContact OG-OE1 3.32Å; Q170-Y173 PolarHBondContact O-N 3.45Å; Q170-A174 WeakPolarHBondContact O-CB 3.43Å; Q170-A174 PolarHBondContact O-N 3.35Å |
| 171 | G | 74.8 | Confident | 74.5 | Confident | 21 Ų | 21 | 88.4 Ų | 88.4 | 22% | 0.216 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -63.8 | -40.2 | 175 | 0 | 0 | 0 | 0 | 0 | 113.4 | S167 E169 A174 F175 | S167-G171 PolarHBondContact O-N 3.45Å; E169-G171 VanDerWaalsContact C-N 3.29Å; E169-G171 PolarHBondContact O-N 3.02Å; G171-A174 PolarHBondContact O-N 3.43Å; G171-F175 WeakPolarHBondContact O-CB 3.49Å; G171-F175 PolarHBondContact O-N 2.91Å |
| 172 | L | 78.5 | Confident | 75.6 | Confident | 112 Ų | 112 | 84.2 Ų | 84.2 | 59% | 0.586 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -66.7 | -43.9 | 176.4 | -164.7 | 82.7 | 0 | 0 | 0 | 111.6 | K168 E169 F175 M176 | K168-L172 PolarHBondContact O-N 3.16Å; E169-L172 PolarHBondContact O-N 2.92Å; E169-L172 VanDerWaalsContact O-N 3.14Å; L172-F175 PolarHBondContact O-N 3.24Å; L172-M176 WeakPolarHBondContact O-CG 3.29Å; L172-M176 PolarHBondContact O-N 3.47Å |
| 173 | Y | 82.7 | Confident | 76.9 | Confident | 163 Ų | 163 | 81.1 Ų | 81.1 | 64% | 0.639 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -61.1 | -45.3 | 175.7 | -76 | -70.5 | 0 | 0 | 0 | 111.7 | E169 Q170 F175 M176 Y177 | E169-Y173 HydrophobicContact CB-CD2 4.42Å; E169-Y173 HydrophobicContact CB-CE2 4.22Å; E169-Y173 WeakPolarHBondContact O-CD2 3.25Å; E169-Y173 PolarHBondContact O-N 3.5Å; Q170-Y173 PolarHBondContact O-N 3.45Å; Y173-F175 VanDerWaalsContact C-N 3.35Å; Y173-F175 PolarHBondContact O-N 3.2Å; Y173-M176 PolarHBondContact O-N 2.88Å; Y173-Y177 WeakPolarHBondContact O-CB 3.26Å; Y173-Y177 PolarHBondContact O-N 2.84Å |
| 174 | A | 78.7 | Confident | 78.4 | Confident | 27 Ų | 27 | 81.2 Ų | 81.2 | 22% | 0.223 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -61 | -42.4 | 178 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q170 G171 Y177 W178 | Q170-A174 WeakPolarHBondContact O-CB 3.43Å; Q170-A174 PolarHBondContact O-N 3.35Å; G171-A174 PolarHBondContact O-N 3.43Å; A174-Y177 PolarHBondContact O-N 3.01Å; A174-W178 WeakPolarHBondContact O-CB 3.18Å; A174-W178 PolarHBondContact O-N 2.99Å |
| 175 | F | 80.7 | Confident | 79.9 | Confident | 89 Ų | 89 | 77.7 Ų | 77.7 | 39% | 0.39 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -65.8 | -43.9 | 176.8 | 179.1 | -99.7 | 0 | 0 | 0 | 112.6 | G171 L172 Y173 Y177 W178 L179 | G171-F175 WeakPolarHBondContact O-CB 3.49Å; G171-F175 PolarHBondContact O-N 2.91Å; L172-F175 PolarHBondContact O-N 3.24Å; Y173-F175 VanDerWaalsContact C-N 3.35Å; Y173-F175 PolarHBondContact O-N 3.2Å; F175-Y177 VanDerWaalsContact C-N 3.34Å; F175-W178 HydrophobicContact CD2-CE3 4.31Å; F175-W178 HydrophobicContact CE2-CE3 4.16Å; F175-W178 HydrophobicContact CE2-CZ3 4.09Å; F175-W178 PolarHBondContact O-N 2.67Å; F175-L179 PolarHBondContact O-N 2.87Å |
| 176 | M | 85.1 | Confident | 81.4 | Confident | 92 Ų | 92 | 72.6 Ų | 72.6 | 45% | 0.453 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -64.8 | -39.5 | 176.8 | -71.2 | -62.3 | 152.4 | 0 | 0 | 112 | L172 Y173 L179 I180 | L172-M176 WeakPolarHBondContact O-CG 3.29Å; L172-M176 PolarHBondContact O-N 3.47Å; Y173-M176 PolarHBondContact O-N 2.88Å; M176-L179 PolarHBondContact O-N 2.89Å; M176-L179 HydrophobicContact SD-CD2 4.37Å; M176-I180 WeakPolarHBondContact O-CG1 3.28Å; M176-I180 PolarHBondContact O-N 2.85Å; M176-I180 VanDerWaalsContact O-N 3.13Å |
| 177 | Y | 83.5 | Confident | 82.9 | Confident | 98 Ų | 98 | 75.4 Ų | 75.4 | 38% | 0.384 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -61.8 | -44.2 | 175.1 | -163.2 | -108.4 | 0 | 0 | 0 | 111.4 | N102 F103 Y173 A174 F175 L179 I180 G181 | N102-Y177 WeakPolarHBondContact O-CE1 3.35Å; F103-Y177 HydrophobicContact CB-CD1 4.38Å; F103-Y177 HydrophobicContact CB-CE1 4.3Å; F103-Y177 AromaticContact CD1-CD1 3.87Å; F103-Y177 HydrophobicContact CD1-CD1 3.87Å; F103-Y177 AromaticContact CD1-CD2 3.96Å; F103-Y177 HydrophobicContact CD1-CD2 3.96Å; F103-Y177 AromaticContact CD1-CE1 3.67Å; F103-Y177 HydrophobicContact CD1-CE1 3.67Å; F103-Y177 AromaticContact CD1-CE2 3.75Å; F103-Y177 HydrophobicContact CD1-CE2 3.75Å; F103-Y177 HydrophobicContact CD1-CG 4.01Å; F103-Y177 AromaticContact CD1-CZ 3.59Å; F103-Y177 VanDerWaalsContact CD1-O 3.26Å; F103-Y177 WeakPolarHBondContact CD1-O 3.38Å; F103-Y177 HydrophobicContact CE1-CD2 4.11Å; F103-Y177 HydrophobicContact CE1-CE1 4.34Å; F103-Y177 AromaticContact CE1-CE2 3.65Å; F103-Y177 HydrophobicContact CE1-CE2 3.65Å; F103-Y177 AromaticContact CE1-CZ 3.78Å; F103-Y177 HydrophobicContact CG-CE1 4.19Å; Y173-Y177 WeakPolarHBondContact O-CB 3.26Å; Y173-Y177 PolarHBondContact O-N 2.84Å; A174-Y177 PolarHBondContact O-N 3.01Å; F175-Y177 VanDerWaalsContact C-N 3.34Å; Y177-L179 PolarHBondContact O-N 2.97Å; Y177-I180 PolarHBondContact O-N 3.27Å; Y177-G181 PolarHBondContact O-N 3.35Å |
| 178 | W | 84.8 | Confident | 84.1 | Confident | 15 Ų | 15 | 72.4 Ų | 72.4 | 6% | 0.057 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -62.5 | -40.6 | 174.1 | 177.6 | 80.8 | 0 | 0 | 0 | 112.7 | L109 T152 A156 A174 F175 I180 G181 I182 | L109-W178 HydrophobicContact CD2-CZ2 4.22Å; T152-W178 HydrophobicContact CG2-CH2 3.65Å; T152-W178 HydrophobicContact CG2-CZ2 3.99Å; A156-W178 HydrophobicContact CB-CH2 3.67Å; A156-W178 HydrophobicContact CB-CZ2 4.07Å; A156-W178 HydrophobicContact CB-CZ3 4.04Å; A174-W178 WeakPolarHBondContact O-CB 3.18Å; A174-W178 PolarHBondContact O-N 2.99Å; F175-W178 HydrophobicContact CD2-CE3 4.31Å; F175-W178 HydrophobicContact CE2-CE3 4.16Å; F175-W178 HydrophobicContact CE2-CZ3 4.09Å; F175-W178 PolarHBondContact O-N 2.67Å; W178-I180 VanDerWaalsContact C-N 3.31Å; W178-I180 PolarHBondContact O-N 2.98Å; W178-G181 WeakPolarHBondContact O-CA 3.23Å; W178-G181 PolarHBondContact O-N 3.18Å; W178-I182 HydrophobicContact CD2-CG1 4.13Å; W178-I182 HydrophobicContact CE3-CG1 4.26Å; W178-I182 HydrophobicContact CH2-CD1 4.29Å; W178-I182 HydrophobicContact CH2-CG1 3.99Å; W178-I182 HydrophobicContact CZ2-CD1 3.77Å; W178-I182 HydrophobicContact CZ2-CG1 3.84Å; W178-I182 HydrophobicContact CZ3-CG1 4.19Å; W178-I182 PolarHBondContact O-N 3.36Å; W178-I182 VanDerWaalsContact O-N 3.11Å |
| 179 | L | 86.6 | Confident | 85 | Confident | 81 Ų | 81 | 63.7 Ų | 63.7 | 42% | 0.424 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -62.2 | -36.3 | 178.6 | -172.7 | 65.5 | 0 | 0 | 0 | 112.6 | F175 M176 Y177 G181 I182 A183 | F175-L179 PolarHBondContact O-N 2.87Å; M176-L179 PolarHBondContact O-N 2.89Å; M176-L179 HydrophobicContact SD-CD2 4.37Å; Y177-L179 PolarHBondContact O-N 2.97Å; L179-G181 VanDerWaalsContact C-N 3.31Å; L179-G181 PolarHBondContact O-N 2.99Å; L179-I182 PolarHBondContact O-N 2.85Å; L179-A183 PolarHBondContact O-N 3.07Å |
| 180 | I | 90.2 | Very high | 85.9 | Confident | 89 Ų | 89 | 61.1 Ų | 61.1 | 46% | 0.456 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -59.8 | -43.8 | 173.1 | -67.6 | 166.5 | 0 | 0 | 0 | 110.4 | F103 M176 Y177 W178 I182 A183 M184 | F103-I180 HydrophobicContact CD1-CB 4.21Å; F103-I180 HydrophobicContact CD1-CG2 4.09Å; F103-I180 HydrophobicContact CE1-CB 4.13Å; F103-I180 HydrophobicContact CE1-CG2 3.59Å; F103-I180 HydrophobicContact CZ-CG2 4Å; M176-I180 WeakPolarHBondContact O-CG1 3.28Å; M176-I180 PolarHBondContact O-N 2.85Å; M176-I180 VanDerWaalsContact O-N 3.13Å; Y177-I180 PolarHBondContact O-N 3.27Å; W178-I180 VanDerWaalsContact C-N 3.31Å; W178-I180 PolarHBondContact O-N 2.98Å; I180-I182 VanDerWaalsContact C-N 3.34Å; I180-I182 PolarHBondContact O-N 2.97Å; I180-A183 PolarHBondContact O-N 3.43Å; I180-M184 HydrophobicContact CG2-SD 4.3Å; I180-M184 WeakPolarHBondContact O-CG 3.4Å; I180-M184 PolarHBondContact O-N 2.87Å |
| 181 | G | 88.7 | Confident | 86.6 | Confident | 0 Ų | 0 | 57.6 Ų | 57.6 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -57.7 | -44.2 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y177 W178 L179 M184 L185 | Y177-G181 PolarHBondContact O-N 3.35Å; W178-G181 WeakPolarHBondContact O-CA 3.23Å; W178-G181 PolarHBondContact O-N 3.18Å; L179-G181 VanDerWaalsContact C-N 3.31Å; L179-G181 PolarHBondContact O-N 2.99Å; G181-M184 WeakPolarHBondContact O-CB 3.43Å; G181-M184 PolarHBondContact O-N 3.46Å; G181-L185 WeakPolarHBondContact O-CG 3.4Å; G181-L185 PolarHBondContact O-N 2.96Å |
| 182 | I | 88 | Confident | 87.3 | Confident | 20 Ų | 20 | 58.9 Ų | 58.9 | 10% | 0.103 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -63.9 | -41.1 | 176.9 | -61.1 | -61 | 0 | 0 | 0 | 111.7 | I105 L109 F113 W178 L179 I180 L185 T186 | I105-I182 HydrophobicContact CD1-CD1 4.48Å; L109-I182 HydrophobicContact CD2-CD1 4.18Å; F113-I182 HydrophobicContact CE1-CG2 4.05Å; F113-I182 HydrophobicContact CE2-CD1 3.73Å; F113-I182 HydrophobicContact CZ-CD1 3.86Å; F113-I182 HydrophobicContact CZ-CG2 3.79Å; W178-I182 HydrophobicContact CD2-CG1 4.13Å; W178-I182 HydrophobicContact CE3-CG1 4.26Å; W178-I182 HydrophobicContact CH2-CD1 4.29Å; W178-I182 HydrophobicContact CH2-CG1 3.99Å; W178-I182 HydrophobicContact CZ2-CD1 3.77Å; W178-I182 HydrophobicContact CZ2-CG1 3.84Å; W178-I182 HydrophobicContact CZ3-CG1 4.19Å; W178-I182 PolarHBondContact O-N 3.36Å; W178-I182 VanDerWaalsContact O-N 3.11Å; L179-I182 PolarHBondContact O-N 2.85Å; I180-I182 VanDerWaalsContact C-N 3.34Å; I180-I182 PolarHBondContact O-N 2.97Å; I182-L185 PolarHBondContact O-N 2.01Å; I182-T186 WeakPolarHBondContact O-CB 3.41Å; I182-T186 PolarHBondContact O-N 3.3Å; I182-T186 PolarHBondContact O-OG1 3Å |
| 183 | A | 90.9 | Very high | 87.7 | Confident | 61 Ų | 61 | 53.6 Ų | 53.6 | 50% | 0.504 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -62.8 | -42.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | L179 I180 T186 F187 | L179-A183 PolarHBondContact O-N 3.07Å; I180-A183 PolarHBondContact O-N 3.43Å; A183-T186 PolarHBondContact O-N 3.26Å; A183-F187 PolarHBondContact O-N 3.45Å |
| 184 | M | 90.9 | Very high | 88.1 | Confident | 31 Ų | 31 | 49.6 Ų | 49.6 | 15% | 0.153 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -60.5 | -46.3 | 174.6 | -75.8 | 177 | 58.9 | 0 | 0 | 112.5 | I96 Y99 A100 F103 I180 G181 T186 F187 A188 | I96-M184 HydrophobicContact CG2-CB 3.83Å; I96-M184 HydrophobicContact CG2-CE 3.93Å; I96-M184 HydrophobicContact CG2-CG 4.38Å; I96-M184 WeakPolarHBondContact CG2-O 3.25Å; I96-M184 WeakPolarHBondContact O-CE 3.29Å; Y99-M184 HydrophobicContact CD1-CE 3.44Å; Y99-M184 VanDerWaalsContact CD1-CE 3.44Å; Y99-M184 HydrophobicContact CD1-SD 4.08Å; Y99-M184 HydrophobicContact CE1-CE 4.46Å; Y99-M184 HydrophobicContact CG-CE 4.05Å; A100-M184 HydrophobicContact CB-CB 4.37Å; A100-M184 HydrophobicContact CB-CE 4.17Å; F103-M184 HydrophobicContact CD2-SD 4.02Å; F103-M184 HydrophobicContact CE2-CE 4.02Å; F103-M184 HydrophobicContact CE2-SD 3.4Å; F103-M184 WeakPolarHBondContact CE2-SD 3.23Å; F103-M184 HydrophobicContact CZ-SD 3.8Å; I180-M184 HydrophobicContact CG2-SD 4.3Å; I180-M184 WeakPolarHBondContact O-CG 3.4Å; I180-M184 PolarHBondContact O-N 2.87Å; G181-M184 WeakPolarHBondContact O-CB 3.43Å; G181-M184 PolarHBondContact O-N 3.46Å; M184-T186 VanDerWaalsContact C-N 3.31Å; M184-T186 PolarHBondContact O-N 3.21Å; M184-F187 PolarHBondContact O-N 3.16Å; M184-A188 WeakPolarHBondContact O-CB 3.38Å; M184-A188 PolarHBondContact O-N 3.25Å |
| 185 | L | 89.6 | Confident | 88.6 | Confident | 3 Ų | 3 | 49.5 Ų | 49.5 | 2% | 0.016 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -60.3 | -42.9 | 175.5 | -70.5 | -176.9 | 0 | 0 | 0 | 111.4 | A100 I105 H110 F113 G181 I182 F187 A188 L189 | A100-L185 HydrophobicContact CB-CD2 3.62Å; A100-L185 HydrophobicContact CB-CG 4Å; I105-L185 HydrophobicContact CD1-CD1 3.75Å; I105-L185 HydrophobicContact CD1-CG 4.14Å; I105-L185 HydrophobicContact CG2-CD1 4.12Å; H110-L185 VanDerWaalsContact CD2-CD2 3.45Å; H110-L185 WeakPolarHBondContact CD2-CD2 3.36Å; F113-L185 HydrophobicContact CB-CD1 4.11Å; F113-L185 HydrophobicContact CD1-CB 4.35Å; F113-L185 HydrophobicContact CD2-CD1 4.33Å; F113-L185 HydrophobicContact CG-CD1 4.12Å; G181-L185 WeakPolarHBondContact O-CG 3.4Å; G181-L185 PolarHBondContact O-N 2.96Å; I182-L185 PolarHBondContact O-N 2.01Å; L185-F187 PolarHBondContact O-N 3.01Å; L185-A188 PolarHBondContact O-N 3.23Å; L185-L189 VanDerWaalsContact O-CG 3.25Å; L185-L189 WeakPolarHBondContact O-CG 3.21Å; L185-L189 PolarHBondContact O-N 3.16Å |
| 186 | T | 90.1 | Very high | 88.8 | Confident | 63 Ų | 63 | 46.8 Ų | 46.8 | 39% | 0.387 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -60.9 | -44.1 | 178.2 | -56.9 | 0 | 0 | 0 | 0 | 111.8 | I182 A183 M184 L189 L190 | I182-T186 WeakPolarHBondContact O-CB 3.41Å; I182-T186 PolarHBondContact O-N 3.3Å; I182-T186 PolarHBondContact O-OG1 3Å; A183-T186 PolarHBondContact O-N 3.26Å; M184-T186 VanDerWaalsContact C-N 3.31Å; M184-T186 PolarHBondContact O-N 3.21Å; T186-L189 WeakPolarHBondContact O-CB 3.32Å; T186-L189 PolarHBondContact O-N 3.05Å; T186-L190 PolarHBondContact O-N 3.1Å; T186-L190 VanDerWaalsContact O-N 3.14Å |
| 187 | F | 92.3 | Very high | 88.9 | Confident | 96 Ų | 96 | 42.7 Ų | 42.7 | 42% | 0.421 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -61.7 | -46.1 | 173.9 | 176.5 | -93 | 0 | 0 | 0 | 111.9 | T92 I96 A183 M184 L185 L189 L190 M191 | T92-F187 HydrophobicContact CG2-CE1 4.13Å; I96-F187 HydrophobicContact CD1-CD1 3.34Å; I96-F187 HydrophobicContact CD1-CE1 3.29Å; A183-F187 PolarHBondContact O-N 3.45Å; M184-F187 PolarHBondContact O-N 3.16Å; L185-F187 PolarHBondContact O-N 3.01Å; F187-L189 PolarHBondContact O-N 3.46Å; F187-L190 PolarHBondContact O-N 3.5Å; F187-M191 HydrophobicContact CD1-CG 4.18Å; F187-M191 HydrophobicContact CE1-CG 3.6Å; F187-M191 HydrophobicContact CE2-CG 4.1Å; F187-M191 HydrophobicContact CZ-CG 3.57Å; F187-M191 HydrophobicContact CZ-SD 4.22Å; F187-M191 PolarHBondContact O-N 3.36Å |
| 188 | A | 91.3 | Very high | 89.1 | Confident | 2 Ų | 2 | 39.6 Ų | 39.6 | 2% | 0.017 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -60.3 | -35 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | I96 M184 L185 S192 | I96-A188 HydrophobicContact CB-CB 4.43Å; I96-A188 HydrophobicContact CG2-CB 4.01Å; M184-A188 WeakPolarHBondContact O-CB 3.38Å; M184-A188 PolarHBondContact O-N 3.25Å; L185-A188 PolarHBondContact O-N 3.23Å; A188-S192 WeakPolarHBondContact O-CB 3.15Å; A188-S192 PolarHBondContact O-N 2.97Å |
| 189 | L | 90 | Very high | 89.2 | Confident | 22 Ų | 22 | 41.7 Ų | 41.7 | 12% | 0.115 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -65 | -45.9 | 174.5 | -69.4 | 171.4 | 0 | 0 | 0 | 112.6 | F113 L185 T186 F187 S192 A193 | F113-L189 HydrophobicContact CB-CD1 4.39Å; F113-L189 HydrophobicContact CD1-CD1 3.99Å; F113-L189 VanDerWaalsContact O-CD1 3.23Å; F113-L189 WeakPolarHBondContact O-CD1 3.26Å; F113-L189 WeakPolarHBondContact O-CD2 3.41Å; L185-L189 VanDerWaalsContact O-CG 3.25Å; L185-L189 WeakPolarHBondContact O-CG 3.21Å; L185-L189 PolarHBondContact O-N 3.16Å; T186-L189 WeakPolarHBondContact O-CB 3.32Å; T186-L189 PolarHBondContact O-N 3.05Å; F187-L189 PolarHBondContact O-N 3.46Å; L189-S192 PolarHBondContact O-N 3.46Å; L189-A193 WeakPolarHBondContact O-CB 3.12Å; L189-A193 PolarHBondContact O-N 2.89Å |
| 190 | L | 91 | Very high | 89.1 | Confident | 79 Ų | 79 | 41.3 Ų | 41.3 | 41% | 0.414 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -63.7 | -43.2 | 177.9 | -69.8 | 173.2 | 0 | 0 | 0 | 111.4 | A120 L124 T186 F187 A193 R194 | A120-L190 HydrophobicContact CB-CD2 4.01Å; L124-L190 HydrophobicContact CD1-CD2 4.42Å; T186-L190 PolarHBondContact O-N 3.1Å; T186-L190 VanDerWaalsContact O-N 3.14Å; F187-L190 PolarHBondContact O-N 3.5Å; L190-A193 PolarHBondContact O-N 2.71Å; L190-R194 WeakPolarHBondContact O-CB 2.99Å; L190-R194 PolarHBondContact O-N 3.45Å |
| 191 | M | 90.8 | Very high | 88.9 | Confident | 45 Ų | 45 | 39.8 Ų | 39.8 | 22% | 0.222 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -65 | -41.8 | 176 | -77.2 | -62.1 | -70 | 0 | 0 | 112.3 | M89 V93 F187 A193 R194 M195 | M89-M191 HydrophobicContact CB-CE 4.22Å; M89-M191 HydrophobicContact CG-CE 3.88Å; V93-M191 HydrophobicContact CG2-CB 3.49Å; V93-M191 VanDerWaalsContact CG2-CB 3.49Å; F187-M191 HydrophobicContact CD1-CG 4.18Å; F187-M191 HydrophobicContact CE1-CG 3.6Å; F187-M191 HydrophobicContact CE2-CG 4.1Å; F187-M191 HydrophobicContact CZ-CG 3.57Å; F187-M191 HydrophobicContact CZ-SD 4.22Å; F187-M191 PolarHBondContact O-N 3.36Å; M191-A193 VanDerWaalsContact C-N 3.32Å; M191-A193 PolarHBondContact O-N 2.97Å; M191-R194 PolarHBondContact O-N 3.41Å; M191-M195 WeakPolarHBondContact O-CB 3.12Å; M191-M195 PolarHBondContact O-N 2.86Å |
| 192 | S | 88.6 | Confident | 88.9 | Confident | 49 Ų | 49 | 40 Ų | 40 | 34% | 0.343 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -61.1 | -41.1 | 174.7 | -176.2 | 0 | 0 | 0 | 0 | 111.8 | A188 L189 M195 G196 | A188-S192 WeakPolarHBondContact O-CB 3.15Å; A188-S192 PolarHBondContact O-N 2.97Å; L189-S192 PolarHBondContact O-N 3.46Å; S192-M195 PolarHBondContact O-N 3.34Å; S192-G196 PolarHBondContact O-N 3.39Å |
| 193 | A | 88.1 | Confident | 88.8 | Confident | 0 Ų | 0 | 41.4 Ų | 41.4 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -67.1 | -42 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | A120 N121 L124 L189 L190 M191 M195 G196 I197 | A120-A193 HydrophobicContact CB-CB 3.53Å; N121-A193 HydrophobicContact CB-CB 4.4Å; N121-A193 WeakPolarHBondContact OD1-CA 3.45Å; N121-A193 WeakPolarHBondContact OD1-CB 3.44Å; N121-A193 PolarHBondContact OD1-O 2.95Å; L124-A193 HydrophobicContact CD1-CB 3.73Å; L189-A193 WeakPolarHBondContact O-CB 3.12Å; L189-A193 PolarHBondContact O-N 2.89Å; L190-A193 PolarHBondContact O-N 2.71Å; M191-A193 VanDerWaalsContact C-N 3.32Å; M191-A193 PolarHBondContact O-N 2.97Å; A193-M195 VanDerWaalsContact C-N 3.32Å; A193-M195 PolarHBondContact O-N 2.91Å; A193-G196 PolarHBondContact O-N 3.47Å; A193-I197 PolarHBondContact O-N 3.37Å |
| 194 | R | 90.1 | Very high | 88.5 | Confident | 79 Ų | 79 | 44.5 Ų | 44.5 | 30% | 0.298 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -60.1 | -42.5 | 175.1 | 179.1 | 62.3 | -174.1 | 108.6 | -6 | 111.9 | M89 L124 L190 M191 I197 F198 | M89-R194 HydrophobicContact CE-CG 4.23Å; M89-R194 HydrophobicContact SD-CG 4.35Å; L124-R194 HydrophobicContact CD1-CB 4.42Å; L190-R194 WeakPolarHBondContact O-CB 2.99Å; L190-R194 PolarHBondContact O-N 3.45Å; M191-R194 PolarHBondContact O-N 3.41Å; R194-I197 PolarHBondContact O-N 3.19Å; R194-F198 WeakPolarHBondContact O-CB 3.32Å; R194-F198 PolarHBondContact O-N 3.11Å |
| 195 | M | 89.3 | Confident | 88.5 | Confident | 25 Ų | 25 | 49.2 Ų | 49.2 | 12% | 0.123 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -60.3 | -45 | 174.5 | -178.7 | -170.1 | 166.9 | 0 | 0 | 111 | M86 M89 F90 M191 S192 A193 F198 Q199 | M86-M195 HydrophobicContact CE-CE 3.6Å; M86-M195 HydrophobicContact CG-CE 3.86Å; M86-M195 HydrophobicContact CG-CG 4.04Å; M89-M195 HydrophobicContact CB-CB 4.07Å; M89-M195 HydrophobicContact CB-CG 4.22Å; M89-M195 HydrophobicContact SD-CB 4.1Å; F90-M195 HydrophobicContact CB-CE 3.72Å; F90-M195 HydrophobicContact CB-SD 3.87Å; F90-M195 HydrophobicContact CD2-CE 4.11Å; F90-M195 HydrophobicContact CD2-SD 4.45Å; F90-M195 HydrophobicContact CG-CE 4.33Å; M191-M195 WeakPolarHBondContact O-CB 3.12Å; M191-M195 PolarHBondContact O-N 2.86Å; S192-M195 PolarHBondContact O-N 3.34Å; A193-M195 VanDerWaalsContact C-N 3.32Å; A193-M195 PolarHBondContact O-N 2.91Å; M195-F198 PolarHBondContact O-N 3.42Å; M195-Q199 WeakPolarHBondContact O-CB 3.38Å; M195-Q199 PolarHBondContact O-N 3.49Å |
| 196 | G | 86 | Confident | 88.5 | Confident | 33 Ų | 33 | 52.5 Ų | 52.5 | 34% | 0.34 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -60.4 | -44.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | S192 A193 Q199 E200 | S192-G196 PolarHBondContact O-N 3.39Å; A193-G196 PolarHBondContact O-N 3.47Å; G196-Q199 PolarHBondContact O-N 3.29Å; G196-E200 PolarHBondContact O-N 3.26Å |
| 197 | I | 85.8 | Confident | 88.3 | Confident | 5 Ų | 5 | 50.9 Ų | 50.9 | 3% | 0.026 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -63.6 | -43.3 | 175.4 | -72.9 | 166.9 | 0 | 0 | 0 | 111.2 | L124 L129 A193 R194 Q199 E200 T201 | L124-I197 HydrophobicContact CB-CD1 3.32Å; L129-I197 HydrophobicContact CD1-CB 4.4Å; L129-I197 HydrophobicContact CD1-CD1 4.49Å; L129-I197 HydrophobicContact CD1-CG1 4.11Å; L129-I197 HydrophobicContact CD1-CG2 3.6Å; L129-I197 HydrophobicContact CG-CG2 4.15Å; A193-I197 PolarHBondContact O-N 3.37Å; R194-I197 PolarHBondContact O-N 3.19Å; I197-Q199 VanDerWaalsContact C-N 3.3Å; I197-Q199 PolarHBondContact O-N 3.39Å; I197-E200 PolarHBondContact O-N 3.47Å; I197-T201 PolarHBondContact O-N 3.23Å; I197-T201 PolarHBondContact O-OG1 2.97Å |
| 198 | F | 89.1 | Confident | 87.8 | Confident | 33 Ų | 33 | 53.9 Ų | 53.9 | 15% | 0.145 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -60 | -43 | 176.8 | -175.6 | -106.4 | 0 | 0 | 0 | 111.4 | N82 I85 M86 R194 M195 E200 T201 L202 | N82-F198 HydrophobicContact CB-CE1 4.38Å; N82-F198 HydrophobicContact CB-CZ 4.25Å; N82-F198 WeakPolarHBondContact O-CE1 3.49Å; I85-F198 HydrophobicContact CB-CE1 4.18Å; I85-F198 HydrophobicContact CB-CZ 4.23Å; I85-F198 HydrophobicContact CD1-CZ 4.23Å; I85-F198 HydrophobicContact CG2-CD1 4.46Å; I85-F198 HydrophobicContact CG2-CE1 4.02Å; I85-F198 HydrophobicContact CG2-CE2 4.49Å; I85-F198 HydrophobicContact CG2-CZ 4.03Å; M86-F198 HydrophobicContact CB-CD1 4.47Å; M86-F198 HydrophobicContact CB-CE1 4.5Å; R194-F198 WeakPolarHBondContact O-CB 3.32Å; R194-F198 PolarHBondContact O-N 3.11Å; M195-F198 PolarHBondContact O-N 3.42Å; F198-E200 PolarHBondContact O-N 3.38Å; F198-T201 PolarHBondContact O-N 2.9Å; F198-L202 WeakPolarHBondContact O-CB 3.45Å; F198-L202 PolarHBondContact O-N 3.37Å |
| 199 | Q | 86.6 | Confident | 87.5 | Confident | 60 Ų | 60 | 57 Ų | 57 | 28% | 0.28 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -63.1 | -39.5 | 175.2 | -170.6 | -176.7 | -50.2 | 0 | 0 | 112.2 | M86 M195 G196 I197 L202 Y203 | M86-Q199 HydrophobicContact CE-CG 4.41Å; M86-Q199 HydrophobicContact SD-CB 4.44Å; M86-Q199 HydrophobicContact SD-CG 4.29Å; M195-Q199 WeakPolarHBondContact O-CB 3.38Å; M195-Q199 PolarHBondContact O-N 3.49Å; G196-Q199 PolarHBondContact O-N 3.29Å; I197-Q199 VanDerWaalsContact C-N 3.3Å; I197-Q199 PolarHBondContact O-N 3.39Å; Q199-L202 PolarHBondContact O-N 3.32Å; Q199-Y203 HydrophobicContact CG-CD2 4.15Å; Q199-Y203 HydrophobicContact CG-CE1 4.3Å; Q199-Y203 HydrophobicContact CG-CE2 3.62Å; Q199-Y203 VanDerWaalsContact NE2-CE2 3.31Å; Q199-Y203 PolarHBondContact NE2-OH 3.45Å; Q199-Y203 PolarHBondContact O-N 3.3Å |
| 200 | E | 83.3 | Confident | 87.1 | Confident | 73 Ų | 73 | 57.6 Ų | 57.6 | 34% | 0.341 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -61.7 | -49 | 175.4 | -168.1 | -170.6 | 166.7 | 0 | 0 | 111.4 | K131 G196 I197 F198 L202 Y203 Q204 | K131-E200 IonicContact NZ-OE1 3.56Å; K131-E200 PolarHBondContact NZ-OE1 2.62Å; K131-E200 IonicContact NZ-OE2 2.93Å; K131-E200 PolarHBondContact NZ-OE2 2.93Å; G196-E200 PolarHBondContact O-N 3.26Å; I197-E200 PolarHBondContact O-N 3.47Å; F198-E200 PolarHBondContact O-N 3.38Å; E200-L202 VanDerWaalsContact C-N 3.29Å; E200-L202 PolarHBondContact O-N 3.44Å; E200-Y203 PolarHBondContact O-N 3.2Å; E200-Q204 WeakPolarHBondContact O-CG 3.49Å; E200-Q204 PolarHBondContact O-N 3.5Å; E200-Q204 PolarHBondContact OE1-NE2 3.01Å |
| 201 | T | 85.9 | Confident | 86.8 | Confident | 57 Ų | 57 | 59.5 Ų | 59.5 | 35% | 0.35 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -59.9 | -41.1 | 177.5 | -55.8 | 0 | 0 | 0 | 0 | 111.6 | I197 F198 Q204 Q205 | I197-T201 PolarHBondContact O-N 3.23Å; I197-T201 PolarHBondContact O-OG1 2.97Å; F198-T201 PolarHBondContact O-N 2.9Å; T201-Q204 PolarHBondContact O-N 3.25Å; T201-Q205 PolarHBondContact O-N 3.11Å |
| 202 | L | 88.7 | Confident | 86.8 | Confident | 5 Ų | 5 | 57.8 Ų | 57.8 | 3% | 0.026 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -64.1 | -42.8 | 179.2 | -164.6 | 68.7 | 0 | 0 | 0 | 111.9 | I78 N82 F198 Q199 E200 Q204 Q205 Y206 | I78-L202 HydrophobicContact CD1-CD2 4.3Å; I78-L202 HydrophobicContact CD1-CG 4.27Å; I78-L202 HydrophobicContact CG2-CD1 3.99Å; I78-L202 HydrophobicContact CG2-CD2 3.75Å; I78-L202 HydrophobicContact CG2-CG 4Å; N82-L202 HydrophobicContact CB-CD1 3.63Å; N82-L202 HydrophobicContact CB-CD2 3.98Å; N82-L202 HydrophobicContact CB-CG 4.49Å; F198-L202 WeakPolarHBondContact O-CB 3.45Å; F198-L202 PolarHBondContact O-N 3.37Å; Q199-L202 PolarHBondContact O-N 3.32Å; E200-L202 VanDerWaalsContact C-N 3.29Å; E200-L202 PolarHBondContact O-N 3.44Å; L202-Q204 VanDerWaalsContact C-N 3.33Å; L202-Q204 PolarHBondContact O-N 2.93Å; L202-Q205 PolarHBondContact O-N 2.89Å; L202-Y206 HydrophobicContact CD1-CD2 3.57Å; L202-Y206 HydrophobicContact CD1-CE2 3.61Å; L202-Y206 HydrophobicContact CG-CD2 4.12Å; L202-Y206 WeakPolarHBondContact O-CD2 3.48Å; L202-Y206 PolarHBondContact O-N 3.19Å |
| 203 | Y | 86 | Confident | 86.8 | Confident | 48 Ų | 48 | 55.5 Ų | 55.5 | 19% | 0.188 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -70.6 | -27.3 | 176.7 | -68.2 | -17 | 0 | 0 | 0 | 113.5 | I78 Q199 E200 G207 K208 A213 | I78-Y203 HydrophobicContact CD1-CD1 4.43Å; I78-Y203 HydrophobicContact CD1-CE1 4.44Å; Q199-Y203 HydrophobicContact CG-CD2 4.15Å; Q199-Y203 HydrophobicContact CG-CE1 4.3Å; Q199-Y203 HydrophobicContact CG-CE2 3.62Å; Q199-Y203 VanDerWaalsContact NE2-CE2 3.31Å; Q199-Y203 PolarHBondContact NE2-OH 3.45Å; Q199-Y203 PolarHBondContact O-N 3.3Å; E200-Y203 PolarHBondContact O-N 3.2Å; Y203-G207 CarbonylContact O-C 3.34Å; Y203-G207 WeakPolarHBondContact O-CA 3Å; Y203-G207 PolarHBondContact O-N 3.49Å; Y203-K208 HydrophobicContact CG-CG 4.5Å; Y203-A213 HydrophobicContact CE1-CB 4.43Å |
| 204 | Q | 85.3 | Confident | 86.8 | Confident | 126 Ų | 126 | 57.4 Ų | 57.4 | 59% | 0.589 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -68.8 | -37.9 | 170.6 | -72.4 | 175.6 | 1.8 | 0 | 0 | 111.5 | E200 T201 L202 | E200-Q204 WeakPolarHBondContact O-CG 3.49Å; E200-Q204 PolarHBondContact O-N 3.5Å; E200-Q204 PolarHBondContact OE1-NE2 3.01Å; T201-Q204 PolarHBondContact O-N 3.25Å; L202-Q204 VanDerWaalsContact C-N 3.33Å; L202-Q204 PolarHBondContact O-N 2.93Å |
| 205 | Q | 90.1 | Very high | 86.9 | Confident | 130 Ų | 130 | 54.2 Ų | 54.2 | 61% | 0.607 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -78.9 | -45.1 | -177.4 | -176.1 | 176.8 | 2.8 | 0 | 0 | 113.4 | T201 L202 | T201-Q205 PolarHBondContact O-N 3.11Å; L202-Q205 PolarHBondContact O-N 2.89Å |
| 206 | Y | 89.7 | Confident | 87.1 | Confident | 72 Ų | 72 | 54.4 Ų | 54.4 | 28% | 0.282 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -107.9 | -5.1 | -172 | -64.1 | -85.5 | 0 | 0 | 0 | 113.6 | I78 P79 L202 H209 | I78-Y206 HydrophobicContact CG1-CD2 4.44Å; I78-Y206 HydrophobicContact CG1-CG 3.95Å; P79-Y206 VanDerWaalsContact CD-CE1 3.44Å; P79-Y206 HydrophobicContact CG-CE1 3.99Å; L202-Y206 HydrophobicContact CD1-CD2 3.57Å; L202-Y206 HydrophobicContact CD1-CE2 3.61Å; L202-Y206 HydrophobicContact CG-CD2 4.12Å; L202-Y206 WeakPolarHBondContact O-CD2 3.48Å; L202-Y206 PolarHBondContact O-N 3.19Å; Y206-H209 PolarHBondContact O-CD2 2.94Å; Y206-H209 PolarHBondContact O-NE2 2.97Å; Y206-H209 VanDerWaalsContact O-NE2 3.14Å |
| 207 | G | 86.3 | Confident | 87.2 | Confident | 30 Ų | 30 | 54 Ų | 54 | 31% | 0.309 | 26% | 0.26 | S | S | . | . | trans | 81.6 | 176.5 | -172.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | Y203 H209 | Y203-G207 CarbonylContact O-C 3.34Å; Y203-G207 WeakPolarHBondContact O-CA 3Å; Y203-G207 PolarHBondContact O-N 3.49Å; G207-H209 PolarHBondContact O-N 2.97Å | ||
| 208 | K | 81.6 | Confident | 87.5 | Confident | 158 Ų | 158 | 55 Ų | 55 | 69% | 0.687 | 26% | 0.264 | S | S | * | . | trans | -90.2 | 99 | -176 | -68 | -178.7 | -178.6 | 176.5 | 0 | 110.8 | Y203 | Y203-K208 HydrophobicContact CG-CG 4.5Š| ||
| 209 | H | 86.1 | Confident | 87.7 | Confident | 69 Ų | 69 | 55.4 Ų | 55.4 | 32% | 0.319 | 27% | 0.271 | S | S | . | . | trans | -104 | 65.2 | 173.2 | -65.5 | -77.8 | 0 | 0 | 0 | 110.9 | A77 I78 Y206 G207 K211 E212 A213 | A77-H209 WeakPolarHBondContact CB-NE2 3.26Å; I78-H209 HydrophobicContact CD1-CB 4.48Å; Y206-H209 PolarHBondContact O-CD2 2.94Å; Y206-H209 PolarHBondContact O-NE2 2.97Å; Y206-H209 VanDerWaalsContact O-NE2 3.14Å; G207-H209 PolarHBondContact O-N 2.97Å; H209-K211 PolarHBondContact O-N 3.27Å; H209-E212 HydrophobicContact CB-CB 4.05Å; H209-E212 PolarHBondContact O-N 3.46Å; H209-A213 VanDerWaalsContact O-CB 3.27Å; H209-A213 WeakPolarHBondContact O-CB 3.28Å; H209-A213 PolarHBondContact O-N 3.38Å | ||
| 210 | S | 81.4 | Confident | 88.1 | Confident | 33 Ų | 33 | 55 Ų | 55 | 23% | 0.231 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -62.8 | -35.7 | -166.2 | -56.3 | 0 | 0 | 0 | 0 | 114.7 | L214 | S210-L214 WeakPolarHBondContact O-CB 2.86Å; S210-L214 PolarHBondContact O-N 2.94Å |
| 211 | K | 84.8 | Confident | 88.5 | Confident | 120 Ų | 120 | 51.6 Ų | 51.6 | 52% | 0.522 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -73.7 | -44 | 178.1 | -66.9 | -171.5 | 178.6 | -177.5 | 0 | 112 | E68 H209 A213 L214 F215 F276 | E68-K211 HydrophobicContact CG-CB 3.89Å; E68-K211 WeakPolarHBondContact OE2-CB 3.4Å; E68-K211 WeakPolarHBondContact OE2-CD 3.29Å; H209-K211 PolarHBondContact O-N 3.27Å; K211-A213 VanDerWaalsContact C-N 3.35Å; K211-L214 WeakPolarHBondContact O-CB 3.34Å; K211-L214 PolarHBondContact O-N 2.95Å; K211-F215 PolarHBondContact O-N 2.97Å; K211-F276 HydrophobicContact CD-CZ 4.47Å; K211-F276 HydrophobicContact CG-CE1 4.41Å; K211-F276 HydrophobicContact CG-CE2 3.79Å; K211-F276 HydrophobicContact CG-CZ 3.54Å |
| 212 | E | 90.5 | Very high | 88.7 | Confident | 8 Ų | 8 | 50.9 Ų | 50.9 | 4% | 0.037 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -58.5 | -48.4 | 173.1 | -179 | -179.1 | 130.9 | 0 | 0 | 110.6 | P76 A77 I78 H209 L214 F215 Y216 | P76-E212 WeakPolarHBondContact CA-OE1 3.46Å; P76-E212 WeakPolarHBondContact CB-OE1 3.16Å; A77-E212 VanDerWaalsContact N-CD 3.28Å; A77-E212 PolarHBondContact N-OE1 2.72Å; A77-E212 PolarHBondContact N-OE2 3.36Å; I78-E212 PolarHBondContact N-OE1 2.98Å; H209-E212 HydrophobicContact CB-CB 4.05Å; H209-E212 PolarHBondContact O-N 3.46Å; E212-L214 VanDerWaalsContact C-N 3.3Å; E212-L214 PolarHBondContact O-N 2.88Å; E212-F215 PolarHBondContact O-N 3.47Å; E212-Y216 HydrophobicContact CG-CD2 3.67Å; E212-Y216 HydrophobicContact CG-CE2 3.66Å; E212-Y216 WeakPolarHBondContact O-CD2 3.42Å; E212-Y216 PolarHBondContact O-N 2.98Å |
| 213 | A | 87.8 | Confident | 88.9 | Confident | 2 Ų | 2 | 54.6 Ų | 54.6 | 2% | 0.017 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -60.7 | -39.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | Y83 Y203 H209 K211 N217 | Y83-A213 HydrophobicContact CE1-CB 3.95Å; Y83-A213 WeakPolarHBondContact OH-CA 3.23Å; Y83-A213 PolarHBondContact OH-N 3.26Å; Y203-A213 HydrophobicContact CE1-CB 4.43Å; H209-A213 VanDerWaalsContact O-CB 3.27Å; H209-A213 WeakPolarHBondContact O-CB 3.28Å; H209-A213 PolarHBondContact O-N 3.38Å; K211-A213 VanDerWaalsContact C-N 3.35Å; A213-N217 WeakPolarHBondContact O-CB 3.49Å; A213-N217 PolarHBondContact O-N 3.43Å; A213-N217 PolarHBondContact O-ND2 2.9Å |
| 214 | L | 88 | Confident | 89 | Confident | 39 Ų | 39 | 53.3 Ų | 53.3 | 20% | 0.204 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -60.5 | -46.7 | 175.5 | -175 | 68.3 | 0 | 0 | 0 | 111 | I60 S210 K211 E212 H218 I272 | I60-L214 HydrophobicContact CG2-CD1 4.18Å; I60-L214 HydrophobicContact CG2-CD2 4.28Å; I60-L214 HydrophobicContact CG2-CG 3.89Å; S210-L214 WeakPolarHBondContact O-CB 2.86Å; S210-L214 PolarHBondContact O-N 2.94Å; K211-L214 WeakPolarHBondContact O-CB 3.34Å; K211-L214 PolarHBondContact O-N 2.95Å; E212-L214 VanDerWaalsContact C-N 3.3Å; E212-L214 PolarHBondContact O-N 2.88Å; L214-H218 VanDerWaalsContact CD1-CE1 3.45Å; L214-H218 WeakPolarHBondContact CD1-CE1 3.32Å; L214-H218 PolarHBondContact O-N 2.98Å; L214-H218 PolarHBondContact O-ND1 2.99Å; L214-I272 HydrophobicContact CD1-CG2 3.62Å; L214-I272 HydrophobicContact CD2-CG2 3.89Å; L214-I272 HydrophobicContact CG-CG2 4.44Å |
| 215 | F | 92.4 | Very high | 89.2 | Confident | 12 Ų | 12 | 47.7 Ų | 47.7 | 5% | 0.053 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -60.6 | -57.1 | 177.1 | 169.6 | -105.6 | 0 | 0 | 0 | 112.3 | A61 G64 F65 T69 K211 E212 N217 H218 C219 | A61-F215 WeakPolarHBondContact O-CD2 3.09Å; A61-F215 WeakPolarHBondContact O-CE2 3.14Å; G64-F215 VanDerWaalsContact C-CD2 3.46Å; F65-F215 HydrophobicContact CB-CE2 3.81Å; F65-F215 HydrophobicContact CB-CZ 4.46Å; F65-F215 HydrophobicContact CD2-CE2 4.4Å; F65-F215 HydrophobicContact CD2-CZ 4.24Å; T69-F215 HydrophobicContact CG2-CD1 3.38Å; T69-F215 HydrophobicContact CG2-CD2 4.41Å; T69-F215 HydrophobicContact CG2-CE1 3.39Å; T69-F215 HydrophobicContact CG2-CE2 4.4Å; T69-F215 HydrophobicContact CG2-CG 3.91Å; T69-F215 HydrophobicContact CG2-CZ 3.92Å; K211-F215 PolarHBondContact O-N 2.97Å; E212-F215 PolarHBondContact O-N 3.47Å; F215-N217 VanDerWaalsContact C-N 3.33Å; F215-N217 PolarHBondContact O-N 3.34Å; F215-H218 PolarHBondContact O-N 3.02Å; F215-H218 VanDerWaalsContact O-N 3.11Å; F215-C219 HydrophobicContact CD2-CB 4.17Å; F215-C219 HydrophobicContact CE1-CB 4.27Å; F215-C219 HydrophobicContact CE2-CB 3.72Å; F215-C219 HydrophobicContact CZ-CB 3.79Å; F215-C219 VanDerWaalsContact O-CB 3.27Å; F215-C219 WeakPolarHBondContact O-CB 3.33Å; F215-C219 PolarHBondContact O-N 3.2Å |
| 216 | Y | 92.9 | Very high | 89.2 | Confident | 30 Ų | 30 | 47.8 Ų | 47.8 | 12% | 0.118 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -64.7 | -36.3 | -174 | -79 | -71.6 | 0 | 0 | 0 | 112.9 | P76 V80 Y83 E212 H218 L220 | P76-Y216 HydrophobicContact CB-CE2 3.74Å; V80-Y216 HydrophobicContact CG2-CE1 4.03Å; Y83-Y216 HydrophobicContact CD2-CD1 4.41Å; Y83-Y216 AromaticContact CD2-CD2 3.91Å; Y83-Y216 HydrophobicContact CD2-CD2 3.91Å; Y83-Y216 AromaticContact CD2-CG 3.75Å; Y83-Y216 HydrophobicContact CD2-CG 3.75Å; Y83-Y216 AromaticContact CE2-CD2 3.63Å; Y83-Y216 HydrophobicContact CE2-CD2 3.63Å; Y83-Y216 HydrophobicContact CE2-CE2 4.36Å; Y83-Y216 AromaticContact CE2-CG 3.95Å; Y83-Y216 HydrophobicContact CE2-CG 3.95Å; Y83-Y216 HydrophobicContact CG-CG 4.23Å; E212-Y216 HydrophobicContact CG-CD2 3.67Å; E212-Y216 HydrophobicContact CG-CE2 3.66Å; E212-Y216 WeakPolarHBondContact O-CD2 3.42Å; E212-Y216 PolarHBondContact O-N 2.98Å; Y216-H218 PolarHBondContact O-N 3.49Å; Y216-L220 HydrophobicContact CD1-CD1 4.02Å; Y216-L220 HydrophobicContact CD1-CD2 4.44Å; Y216-L220 HydrophobicContact CD1-CG 4.11Å; Y216-L220 WeakPolarHBondContact O-CB 3.47Å; Y216-L220 WeakPolarHBondContact O-CG 3.32Å; Y216-L220 PolarHBondContact O-N 3.17Å; Y216-L220 VanDerWaalsContact O-N 3.08Å |
| 217 | N | 89.8 | Confident | 89.2 | Confident | 24 Ų | 24 | 51.3 Ų | 51.3 | 13% | 0.128 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -69.7 | -16 | 177.8 | -71.7 | -44.6 | 0 | 0 | 0 | 114.1 | M86 A213 F215 P221 | M86-N217 HydrophobicContact CE-CB 4.45Å; M86-N217 WeakPolarHBondContact CE-ND2 3.12Å; M86-N217 WeakPolarHBondContact CE-OD1 3.36Å; M86-N217 PolarHBondContact SD-OD1 3.44Å; M86-N217 VanDerWaalsContact SD-OD1 3.37Å; A213-N217 WeakPolarHBondContact O-CB 3.49Å; A213-N217 PolarHBondContact O-N 3.43Å; A213-N217 PolarHBondContact O-ND2 2.9Å; F215-N217 VanDerWaalsContact C-N 3.33Å; F215-N217 PolarHBondContact O-N 3.34Å; N217-P221 WeakPolarHBondContact O-CD 3.46Å; N217-P221 WeakPolarHBondContact O-CG 3.14Å |
| 218 | H | 91.4 | Very high | 89.2 | Confident | 26 Ų | 26 | 51.5 Ų | 51.5 | 12% | 0.12 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -107 | -28.2 | 176 | -66.3 | 78.7 | 0 | 0 | 0 | 112.5 | F57 I60 L214 F215 Y216 L222 | F57-H218 AromaticContact CD1-CD2 3.68Å; F57-H218 HydrophobicContact CD2-CB 4.45Å; F57-H218 AromaticContact CE1-CD2 3.71Å; F57-H218 HydrophobicContact CG-CB 4.46Å; F57-H218 AromaticContact CG-CD2 3.97Å; I60-H218 HydrophobicContact CB-CB 4.15Å; I60-H218 HydrophobicContact CG2-CB 3.9Å; L214-H218 VanDerWaalsContact CD1-CE1 3.45Å; L214-H218 WeakPolarHBondContact CD1-CE1 3.32Å; L214-H218 PolarHBondContact O-N 2.98Å; L214-H218 PolarHBondContact O-ND1 2.99Å; F215-H218 PolarHBondContact O-N 3.02Å; F215-H218 VanDerWaalsContact O-N 3.11Å; Y216-H218 PolarHBondContact O-N 3.49Å; H218-L222 WeakPolarHBondContact O-CG 3.43Å |
| 219 | C | 94.3 | Very high | 89.7 | Confident | 41 Ų | 41 | 45.9 Ų | 45.9 | 28% | 0.277 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -78.2 | -48 | 178.8 | -174.3 | 0 | 0 | 0 | 0 | 112.8 | A61 F215 P221 L222 | A61-C219 HydrophobicContact CB-CB 3.96Å; F215-C219 HydrophobicContact CD2-CB 4.17Å; F215-C219 HydrophobicContact CE1-CB 4.27Å; F215-C219 HydrophobicContact CE2-CB 3.72Å; F215-C219 HydrophobicContact CZ-CB 3.79Å; F215-C219 VanDerWaalsContact O-CB 3.27Å; F215-C219 WeakPolarHBondContact O-CB 3.33Å; F215-C219 PolarHBondContact O-N 3.2Å; C219-P221 VanDerWaalsContact C-CD 3.48Å; C219-L222 WeakPolarHBondContact O-CB 3.39Å; C219-L222 WeakPolarHBondContact O-CG 3.42Å; C219-L222 PolarHBondContact O-N 2.95Å |
| 220 | L | 93.6 | Very high | 90 | Very high | 52 Ų | 52 | 47.6 Ų | 47.6 | 27% | 0.272 | 27% | 0.267 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.7 | -28.8 | -175.7 | -64.6 | 174.9 | 0 | 0 | 0 | 115 | V80 V84 V87 Y216 L222 P223 | V80-L220 HydrophobicContact CG1-CD1 4.06Å; V80-L220 HydrophobicContact CG1-CD2 4.3Å; V84-L220 HydrophobicContact CG2-CD1 4.19Å; V87-L220 HydrophobicContact CG1-CB 4.29Å; V87-L220 HydrophobicContact CG2-CB 4.02Å; Y216-L220 HydrophobicContact CD1-CD1 4.02Å; Y216-L220 HydrophobicContact CD1-CD2 4.44Å; Y216-L220 HydrophobicContact CD1-CG 4.11Å; Y216-L220 WeakPolarHBondContact O-CB 3.47Å; Y216-L220 WeakPolarHBondContact O-CG 3.32Å; Y216-L220 PolarHBondContact O-N 3.17Å; Y216-L220 VanDerWaalsContact O-N 3.08Å; L220-L222 VanDerWaalsContact C-N 3.28Å; L220-L222 PolarHBondContact O-N 3.12Å; L220-P223 VanDerWaalsContact O-CD 3.27Å; L220-P223 WeakPolarHBondContact O-CD 3.39Å |
| 221 | P | 91.1 | Very high | 90.4 | Very high | 2 Ų | 2 | 48.6 Ų | 48.6 | 1% | 0.013 | 27% | 0.27 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -70.7 | -17.5 | 172.4 | -12.1 | 20.5 | 0 | 0 | 0 | 114.4 | F57 V87 N217 C219 G224 F225 | F57-P221 HydrophobicContact CD2-CB 4.03Å; F57-P221 HydrophobicContact CD2-CG 3.98Å; F57-P221 HydrophobicContact CE2-CB 3.94Å; F57-P221 HydrophobicContact CE2-CG 3.73Å; V87-P221 HydrophobicContact CB-CG 4.3Å; V87-P221 HydrophobicContact CG1-CB 3.82Å; V87-P221 HydrophobicContact CG1-CG 3.56Å; V87-P221 HydrophobicContact CG2-CG 3.89Å; N217-P221 WeakPolarHBondContact O-CD 3.46Å; N217-P221 WeakPolarHBondContact O-CG 3.14Å; C219-P221 VanDerWaalsContact C-CD 3.48Å; P221-G224 WeakPolarHBondContact O-CA 3.4Å; P221-G224 PolarHBondContact O-N 3.48Å; P221-F225 HydrophobicContact CB-CE2 4.32Å; P221-F225 WeakPolarHBondContact O-CD2 3.25Å; P221-F225 PolarHBondContact O-N 3.29Å |
| 222 | L | 92.1 | Very high | 90.8 | Very high | 41 Ų | 41 | 43.7 Ų | 43.7 | 22% | 0.215 | 25% | 0.249 | C | C | . | . | G | 310 helix | trans | -53.6 | -44.6 | -174.1 | -69.1 | 175 | 0 | 0 | 0 | 113.8 | F54 F57 V58 A61 H218 C219 L220 G224 F225 | F54-L222 HydrophobicContact CD2-CD2 4.29Å; F54-L222 HydrophobicContact CE2-CD2 4.23Å; F57-L222 HydrophobicContact CB-CD2 3.79Å; V58-L222 HydrophobicContact CG2-CD2 3.69Å; A61-L222 HydrophobicContact CB-CD1 3.94Å; H218-L222 WeakPolarHBondContact O-CG 3.43Å; C219-L222 WeakPolarHBondContact O-CB 3.39Å; C219-L222 WeakPolarHBondContact O-CG 3.42Å; C219-L222 PolarHBondContact O-N 2.95Å; L220-L222 VanDerWaalsContact C-N 3.28Å; L220-L222 PolarHBondContact O-N 3.12Å; L222-G224 PolarHBondContact O-N 3.37Å; L222-F225 WeakPolarHBondContact O-CB 3.28Å; L222-F225 PolarHBondContact O-N 3.46Å; L222-F225 VanDerWaalsContact O-N 3.15Å |
| 223 | P | 92.1 | Very high | 91 | Very high | 84 Ų | 84 | 50.4 Ų | 50.4 | 55% | 0.545 | 28% | 0.275 | S | S | . | . | G | 310 helix | trans | -61.3 | -30.2 | 174.3 | -23.1 | 35.5 | 0 | 0 | 0 | 113.4 | L220 F225 L226 | L220-P223 VanDerWaalsContact O-CD 3.27Å; L220-P223 WeakPolarHBondContact O-CD 3.39Å; P223-F225 PolarHBondContact O-N 3.3Å; P223-L226 WeakPolarHBondContact O-CB 3.44Å; P223-L226 VanDerWaalsContact O-CG 3.24Å; P223-L226 WeakPolarHBondContact O-CG 3.18Å; P223-L226 PolarHBondContact O-N 3.24Å; P223-L226 VanDerWaalsContact O-N 3.09Å |
| 224 | G | 87.5 | Confident | 91.3 | Very high | 21 Ų | 21 | 54.1 Ų | 54.1 | 22% | 0.216 | 30% | 0.295 | C | S | . | . | G | 310 helix | trans | -64.4 | -27.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | F91 P221 L222 L226 L227 | F91-G224 VanDerWaalsContact CZ-O 3.26Å; F91-G224 WeakPolarHBondContact CZ-O 3.49Å; P221-G224 WeakPolarHBondContact O-CA 3.4Å; P221-G224 PolarHBondContact O-N 3.48Å; L222-G224 PolarHBondContact O-N 3.37Å; G224-L226 PolarHBondContact O-N 3.17Å; G224-L227 WeakPolarHBondContact O-CB 3.38Å; G224-L227 PolarHBondContact O-N 2.93Å; G224-L227 VanDerWaalsContact O-N 3.12Å |
| 225 | F | 89.3 | Confident | 91.5 | Very high | 8 Ų | 8 | 52.9 Ų | 52.9 | 4% | 0.035 | 29% | 0.288 | C | S | . | . | G | 310 helix | trans | -66.5 | -12.9 | 174.3 | -73.6 | -89 | 0 | 0 | 0 | 113.3 | T53 F54 F57 P221 L222 P223 L227 L228 A229 I232 | T53-F225 HydrophobicContact CG2-CE1 4.29Å; T53-F225 HydrophobicContact CG2-CZ 3.84Å; F54-F225 HydrophobicContact CB-CD1 3.84Å; F54-F225 HydrophobicContact CB-CE1 3.97Å; F54-F225 HydrophobicContact CB-CG 4.32Å; F54-F225 HydrophobicContact CD2-CB 3.83Å; F54-F225 HydrophobicContact CD2-CD1 4.2Å; F54-F225 HydrophobicContact CD2-CD2 4.21Å; F54-F225 AromaticContact CD2-CG 3.83Å; F54-F225 HydrophobicContact CD2-CG 3.83Å; F54-F225 HydrophobicContact CE2-CB 4.39Å; F54-F225 HydrophobicContact CG-CD1 4.48Å; F57-F225 AromaticContact CD2-CE2 3.78Å; F57-F225 HydrophobicContact CD2-CE2 3.78Å; F57-F225 HydrophobicContact CD2-CZ 4.18Å; F57-F225 HydrophobicContact CE2-CE2 4.31Å; F57-F225 HydrophobicContact CG-CE2 4.24Å; F57-F225 HydrophobicContact CG-CZ 4.39Å; P221-F225 HydrophobicContact CB-CE2 4.32Å; P221-F225 WeakPolarHBondContact O-CD2 3.25Å; P221-F225 PolarHBondContact O-N 3.29Å; L222-F225 WeakPolarHBondContact O-CB 3.28Å; L222-F225 PolarHBondContact O-N 3.46Å; L222-F225 VanDerWaalsContact O-N 3.15Å; P223-F225 PolarHBondContact O-N 3.3Å; F225-L227 PolarHBondContact O-N 3.41Å; F225-L228 HydrophobicContact CD1-CD1 4.12Å; F225-L228 HydrophobicContact CE1-CD1 4.49Å; F225-L228 CarbonylContact O-C 3.44Å; F225-L228 WeakPolarHBondContact O-CA 3.4Å; F225-L228 PolarHBondContact O-N 3.5Å; F225-A229 PolarHBondContact O-N 2.94Å; F225-I232 HydrophobicContact CB-CD1 4.12Å; F225-I232 HydrophobicContact CD1-CD1 4.02Å |
| 226 | L | 90.3 | Very high | 91.6 | Very high | 132 Ų | 132 | 53.9 Ų | 53.9 | 69% | 0.691 | 30% | 0.296 | S | S | * | . | G | 310 helix | trans | -60.1 | -32.5 | 170.3 | -65.3 | 174.1 | 0 | 0 | 0 | 111.9 | P223 G224 L228 A229 | P223-L226 WeakPolarHBondContact O-CB 3.44Å; P223-L226 VanDerWaalsContact O-CG 3.24Å; P223-L226 WeakPolarHBondContact O-CG 3.18Å; P223-L226 PolarHBondContact O-N 3.24Å; P223-L226 VanDerWaalsContact O-N 3.09Å; G224-L226 PolarHBondContact O-N 3.17Å; L226-L228 PolarHBondContact O-N 3.4Å; L226-A229 WeakPolarHBondContact O-CB 3.14Å; L226-A229 PolarHBondContact O-N 3.31Å; L226-A229 VanDerWaalsContact O-N 3.17Å |
| 227 | L | 89.3 | Confident | 91.7 | Very high | 145 Ų | 145 | 55.4 Ų | 55.4 | 76% | 0.759 | 31% | 0.306 | S | S | * | . | G | 310 helix | trans | -66.2 | -20.7 | 173.7 | -59.9 | 176.8 | 0 | 0 | 0 | 112.7 | F91 G224 F225 | F91-L227 HydrophobicContact CE1-CD1 4.17Å; F91-L227 HydrophobicContact CZ-CD1 4.39Å; G224-L227 WeakPolarHBondContact O-CB 3.38Å; G224-L227 PolarHBondContact O-N 2.93Å; G224-L227 VanDerWaalsContact O-N 3.12Å; F225-L227 PolarHBondContact O-N 3.41Å |
| 228 | L | 88.1 | Confident | 91.9 | Very high | 34 Ų | 34 | 57.1 Ų | 57.1 | 18% | 0.178 | 32% | 0.315 | C | S | . | . | G | 310 helix | trans | -106.6 | 6 | 179.6 | -56.2 | 172.9 | 0 | 0 | 0 | 111.5 | N50 F91 F225 L226 T230 N231 I232 | N50-L228 HydrophobicContact CB-CD1 4.49Å; F91-L228 HydrophobicContact CE2-CD1 4.12Å; F91-L228 HydrophobicContact CZ-CD1 4.14Å; F91-L228 HydrophobicContact CZ-CG 4.41Å; F225-L228 HydrophobicContact CD1-CD1 4.12Å; F225-L228 HydrophobicContact CE1-CD1 4.49Å; F225-L228 CarbonylContact O-C 3.44Å; F225-L228 WeakPolarHBondContact O-CA 3.4Å; F225-L228 PolarHBondContact O-N 3.5Å; L226-L228 PolarHBondContact O-N 3.4Å; L228-T230 VanDerWaalsContact C-N 3.33Å; L228-T230 PolarHBondContact O-N 3.44Å; L228-N231 PolarHBondContact O-N 3.33Å; L228-N231 VanDerWaalsContact O-N 3.1Å; L228-I232 HydrophobicContact CB-CD1 4.22Å; L228-I232 WeakPolarHBondContact O-CG1 3.37Å; L228-I232 PolarHBondContact O-N 3.46Å |
| 229 | A | 90.7 | Very high | 92 | Very high | 41 Ų | 41 | 55.9 Ų | 55.9 | 34% | 0.339 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -59.4 | -40.6 | -170.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | F225 L226 N231 I232 Y233 | F225-A229 PolarHBondContact O-N 2.94Å; L226-A229 WeakPolarHBondContact O-CB 3.14Å; L226-A229 PolarHBondContact O-N 3.31Å; L226-A229 VanDerWaalsContact O-N 3.17Å; A229-N231 VanDerWaalsContact C-N 3.34Å; A229-N231 PolarHBondContact O-N 2.93Å; A229-I232 PolarHBondContact O-N 3.03Å; A229-Y233 VanDerWaalsContact O-CB 3.27Å; A229-Y233 WeakPolarHBondContact O-CB 3.46Å; A229-Y233 PolarHBondContact O-N 3.09Å |
| 230 | T | 92.1 | Very high | 92 | Very high | 105 Ų | 105 | 58.6 Ų | 58.6 | 64% | 0.644 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -59.9 | -44.8 | 177.4 | -49.5 | 0 | 0 | 0 | 0 | 111.5 | L228 Y233 N234 | L228-T230 VanDerWaalsContact C-N 3.33Å; L228-T230 PolarHBondContact O-N 3.44Å; T230-Y233 PolarHBondContact O-N 2.76Å; T230-N234 WeakPolarHBondContact O-CB 3.48Å; T230-N234 PolarHBondContact O-N 3.47Å; T230-N234 PolarHBondContact O-ND2 2.9Å; T230-N234 PolarHBondContact O-OD1 2.99Å |
| 231 | N | 89.6 | Confident | 91.9 | Very high | 53 Ų | 53 | 63 Ų | 63 | 28% | 0.283 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -66.8 | -41.6 | 178.1 | 177.4 | -95.8 | 0 | 0 | 0 | 111.5 | N50 L228 A229 H235 | N50-N231 WeakPolarHBondContact CB-OD1 3.34Å; N50-N231 PolarHBondContact ND2-OD1 3.05Å; L228-N231 PolarHBondContact O-N 3.33Å; L228-N231 VanDerWaalsContact O-N 3.1Å; A229-N231 VanDerWaalsContact C-N 3.34Å; A229-N231 PolarHBondContact O-N 2.93Å; N231-H235 PolarHBondContact ND2-CE1 3.48Å; N231-H235 PolarHBondContact O-N 2.9Å; N231-H235 VanDerWaalsContact O-N 3.15Å; N231-H235 PolarHBondContact O-ND1 3.43Å |
| 232 | I | 93.3 | Very high | 91.9 | Very high | 17 Ų | 17 | 63.4 Ų | 63.4 | 9% | 0.087 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -61.4 | -48.3 | 176.3 | -65.9 | 166.6 | 0 | 0 | 0 | 110.3 | N50 I51 F54 F225 L228 A229 N234 H235 C236 | N50-I232 HydrophobicContact CB-CG1 4.1Å; I51-I232 HydrophobicContact CB-CG2 4.14Å; I51-I232 HydrophobicContact CD1-CG2 4.46Å; I51-I232 HydrophobicContact CG1-CG2 4.12Å; F54-I232 HydrophobicContact CB-CD1 4.11Å; F54-I232 HydrophobicContact CD1-CG2 4.46Å; F54-I232 HydrophobicContact CG-CD1 4.21Å; F225-I232 HydrophobicContact CB-CD1 4.12Å; F225-I232 HydrophobicContact CD1-CD1 4.02Å; L228-I232 HydrophobicContact CB-CD1 4.22Å; L228-I232 WeakPolarHBondContact O-CG1 3.37Å; L228-I232 PolarHBondContact O-N 3.46Å; A229-I232 PolarHBondContact O-N 3.03Å; I232-N234 PolarHBondContact O-N 3.45Å; I232-H235 PolarHBondContact O-N 3.15Å; I232-C236 PolarHBondContact O-N 3.5Å; I232-C236 PolarHBondContact O-SG 2.89Å; I232-C236 VanDerWaalsContact O-SG 3.33Å |
| 233 | Y | 95.1 | Very high | 91.7 | Very high | 150 Ų | 150 | 66.5 Ų | 66.5 | 59% | 0.588 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -61.6 | -44.1 | -179.7 | -179.6 | -101.9 | 0 | 0 | 0 | 112.3 | A229 T230 H235 C236 I237 | A229-Y233 VanDerWaalsContact O-CB 3.27Å; A229-Y233 WeakPolarHBondContact O-CB 3.46Å; A229-Y233 PolarHBondContact O-N 3.09Å; T230-Y233 PolarHBondContact O-N 2.76Å; Y233-H235 VanDerWaalsContact C-N 3.29Å; Y233-H235 PolarHBondContact O-N 2.91Å; Y233-C236 VanDerWaalsContact O-CB 3.3Å; Y233-C236 WeakPolarHBondContact O-CB 3.35Å; Y233-C236 PolarHBondContact O-N 3.41Å; Y233-C236 VanDerWaalsContact O-N 3.08Å; Y233-I237 HydrophobicContact CD1-CD1 3.99Å; Y233-I237 HydrophobicContact CE1-CD1 3.41Å; Y233-I237 VanDerWaalsContact CE1-CD1 3.41Å; Y233-I237 HydrophobicContact CE1-CG1 4.26Å; Y233-I237 PolarHBondContact O-N 3.32Å; Y233-I237 VanDerWaalsContact O-N 3.11Å |
| 234 | N | 94 | Very high | 91.4 | Very high | 80 Ų | 80 | 67.1 Ų | 67.1 | 43% | 0.428 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -59.6 | -41.3 | 176 | -69.2 | -10.6 | 0 | 0 | 0 | 111.5 | T230 I232 I237 L238 | T230-N234 WeakPolarHBondContact O-CB 3.48Å; T230-N234 PolarHBondContact O-N 3.47Å; T230-N234 PolarHBondContact O-ND2 2.9Å; T230-N234 PolarHBondContact O-OD1 2.99Å; I232-N234 PolarHBondContact O-N 3.45Å; N234-I237 PolarHBondContact O-N 3.39Å; N234-L238 WeakPolarHBondContact O-CG 3.47Å; N234-L238 PolarHBondContact O-N 3.21Å |
| 235 | H | 93.1 | Very high | 91.2 | Very high | 12 Ų | 12 | 68.9 Ų | 68.9 | 6% | 0.056 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -70.2 | -29.7 | 175.6 | -73.4 | 87 | 0 | 0 | 0 | 113 | G47 C48 I51 N231 I232 Y233 I237 L238 F239 | G47-H235 PolarHBondContact O-CE1 3.29Å; C48-H235 VanDerWaalsContact CA-CD2 3.48Å; C48-H235 WeakPolarHBondContact CA-CD2 3.33Å; C48-H235 VanDerWaalsContact CB-CD2 3.49Å; C48-H235 WeakPolarHBondContact CB-CD2 3.5Å; C48-H235 PolarHBondContact N-NE2 3.28Å; I51-H235 HydrophobicContact CB-CB 4.42Å; I51-H235 HydrophobicContact CD1-CB 4.4Å; I51-H235 HydrophobicContact CG2-CB 3.8Å; N231-H235 PolarHBondContact ND2-CE1 3.48Å; N231-H235 PolarHBondContact O-N 2.9Å; N231-H235 VanDerWaalsContact O-N 3.15Å; N231-H235 PolarHBondContact O-ND1 3.43Å; I232-H235 PolarHBondContact O-N 3.15Å; Y233-H235 VanDerWaalsContact C-N 3.29Å; Y233-H235 PolarHBondContact O-N 2.91Å; H235-I237 VanDerWaalsContact C-N 3.32Å; H235-I237 PolarHBondContact O-N 3.34Å; H235-L238 PolarHBondContact O-N 3.12Å; H235-F239 VanDerWaalsContact O-CB 3.32Å; H235-F239 WeakPolarHBondContact O-CB 3.38Å; H235-F239 WeakPolarHBondContact O-CD1 3.08Å; H235-F239 VanDerWaalsContact O-CG 3.26Å; H235-F239 WeakPolarHBondContact O-CG 3.18Å; H235-F239 PolarHBondContact O-N 3.42Å |
| 236 | C | 94.4 | Very high | 90.9 | Very high | 33 Ų | 33 | 73.6 Ų | 73.6 | 22% | 0.223 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -60.2 | -42.9 | 170.3 | -67 | 0 | 0 | 0 | 0 | 111.4 | I51 I232 Y233 F239 N240 W258 | I51-C236 HydrophobicContact CD1-CB 4.5Å; I51-C236 WeakPolarHBondContact CD1-SG 3.32Å; I232-C236 PolarHBondContact O-N 3.5Å; I232-C236 PolarHBondContact O-SG 2.89Å; I232-C236 VanDerWaalsContact O-SG 3.33Å; Y233-C236 VanDerWaalsContact O-CB 3.3Å; Y233-C236 WeakPolarHBondContact O-CB 3.35Å; Y233-C236 PolarHBondContact O-N 3.41Å; Y233-C236 VanDerWaalsContact O-N 3.08Å; C236-F239 PolarHBondContact O-N 3.43Å; C236-N240 PolarHBondContact O-N 3.06Å; C236-N240 VanDerWaalsContact O-N 3.11Å; C236-N240 PolarHBondContact O-ND2 2.84Å; C236-N240 PolarHBondContact O-OD1 3.42Å; C236-W258 HydrophobicContact CB-CZ2 4.39Å |
| 237 | I | 95.3 | Very high | 90.4 | Very high | 63 Ų | 63 | 69.2 Ų | 69.2 | 32% | 0.323 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -63.2 | -51.3 | 176.8 | -64.4 | 171.2 | 0 | 0 | 0 | 109.9 | Y233 N234 H235 F239 N240 E241 | Y233-I237 HydrophobicContact CD1-CD1 3.99Å; Y233-I237 HydrophobicContact CE1-CD1 3.41Å; Y233-I237 VanDerWaalsContact CE1-CD1 3.41Å; Y233-I237 HydrophobicContact CE1-CG1 4.26Å; Y233-I237 PolarHBondContact O-N 3.32Å; Y233-I237 VanDerWaalsContact O-N 3.11Å; N234-I237 PolarHBondContact O-N 3.39Å; H235-I237 VanDerWaalsContact C-N 3.32Å; H235-I237 PolarHBondContact O-N 3.34Å; I237-F239 VanDerWaalsContact C-N 3.26Å; I237-F239 PolarHBondContact O-N 3.46Å; I237-N240 WeakPolarHBondContact O-CB 3.15Å; I237-N240 PolarHBondContact O-N 3.07Å; I237-E241 PolarHBondContact O-N 3.32Å |
| 238 | L | 93.2 | Very high | 89.5 | Confident | 60 Ų | 60 | 68 Ų | 68 | 31% | 0.314 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -58.1 | -38.2 | 178.6 | -67.9 | 171.6 | 0 | 0 | 0 | 112.4 | F45 N234 H235 N240 E241 S242 | F45-L238 HydrophobicContact CD1-CB 3.95Å; F45-L238 HydrophobicContact CD1-CD1 3.9Å; F45-L238 HydrophobicContact CD1-CG 4.35Å; F45-L238 HydrophobicContact CE1-CB 3.7Å; F45-L238 HydrophobicContact CE1-CD1 4.21Å; F45-L238 HydrophobicContact CE1-CD2 4.05Å; F45-L238 HydrophobicContact CE1-CG 4.2Å; F45-L238 HydrophobicContact CZ-CB 4.12Å; N234-L238 WeakPolarHBondContact O-CG 3.47Å; N234-L238 PolarHBondContact O-N 3.21Å; H235-L238 PolarHBondContact O-N 3.12Å; L238-N240 VanDerWaalsContact C-N 3.33Å; L238-N240 PolarHBondContact O-N 2.95Å; L238-E241 PolarHBondContact O-N 3.29Å; L238-S242 PolarHBondContact O-N 3.47Å |
| 239 | F | 94.2 | Very high | 88.9 | Confident | 0 Ų | 0 | 73.1 Ų | 73.1 | 0% | 0 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -68.3 | -33.3 | 177.5 | -77.9 | 18.8 | 0 | 0 | 0 | 112 | L41 F45 C48 I51 H235 C236 I237 E241 S242 P255 M257 W258 L261 | L41-F239 HydrophobicContact CD2-CE2 3.96Å; L41-F239 HydrophobicContact CD2-CZ 3.71Å; F45-F239 HydrophobicContact CB-CE1 4.15Å; F45-F239 AromaticContact CD2-CD1 3.95Å; F45-F239 HydrophobicContact CD2-CD1 3.95Å; F45-F239 AromaticContact CD2-CE1 3.77Å; F45-F239 HydrophobicContact CD2-CE1 3.77Å; F45-F239 HydrophobicContact CE2-CD1 4.34Å; F45-F239 HydrophobicContact CG-CD1 4.48Å; F45-F239 HydrophobicContact CG-CE1 4.16Å; C48-F239 HydrophobicContact CB-CE1 4.16Å; C48-F239 HydrophobicContact CB-CZ 3.95Å; I51-F239 HydrophobicContact CD1-CD2 4.39Å; I51-F239 HydrophobicContact CD1-CE2 4.43Å; I51-F239 HydrophobicContact CG2-CE2 4.29Å; I51-F239 HydrophobicContact CG2-CZ 4.18Å; H235-F239 VanDerWaalsContact O-CB 3.32Å; H235-F239 WeakPolarHBondContact O-CB 3.38Å; H235-F239 WeakPolarHBondContact O-CD1 3.08Å; H235-F239 VanDerWaalsContact O-CG 3.26Å; H235-F239 WeakPolarHBondContact O-CG 3.18Å; H235-F239 PolarHBondContact O-N 3.42Å; C236-F239 PolarHBondContact O-N 3.43Å; I237-F239 VanDerWaalsContact C-N 3.26Å; I237-F239 PolarHBondContact O-N 3.46Å; F239-E241 VanDerWaalsContact C-N 3.29Å; F239-E241 PolarHBondContact O-N 3.27Å; F239-S242 WeakPolarHBondContact O-CB 3.44Å; F239-S242 PolarHBondContact O-N 3.4Å; F239-S242 PolarHBondContact O-OG 2.84Å; F239-P255 WeakPolarHBondContact O-CB 3.37Å; F239-M257 HydrophobicContact CB-CB 3.91Å; F239-M257 HydrophobicContact CD1-CB 3.67Å; F239-M257 HydrophobicContact CD1-CG 4.01Å; F239-M257 HydrophobicContact CD2-CB 3.77Å; F239-M257 HydrophobicContact CE1-CB 4.08Å; F239-M257 HydrophobicContact CE1-CG 4.32Å; F239-M257 HydrophobicContact CE2-CB 4.16Å; F239-M257 HydrophobicContact CG-CB 3.5Å; F239-M257 HydrophobicContact CG-CG 4.33Å; F239-M257 HydrophobicContact CZ-CB 4.31Å; F239-W258 HydrophobicContact CB-CD2 4.5Å; F239-W258 HydrophobicContact CB-CZ2 4.36Å; F239-W258 HydrophobicContact CD2-CD2 4.5Å; F239-L261 HydrophobicContact CE2-CB 4.34Å; F239-L261 HydrophobicContact CE2-CD2 4.29Å |
| 240 | N | 92.9 | Very high | 88.2 | Confident | 98 Ų | 98 | 75.5 Ų | 75.5 | 52% | 0.524 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -67.7 | -30.3 | 174.9 | -68.6 | -19.2 | 0 | 0 | 0 | 112.7 | C236 I237 L238 S242 W258 | C236-N240 PolarHBondContact O-N 3.06Å; C236-N240 VanDerWaalsContact O-N 3.11Å; C236-N240 PolarHBondContact O-ND2 2.84Å; C236-N240 PolarHBondContact O-OD1 3.42Å; I237-N240 WeakPolarHBondContact O-CB 3.15Å; I237-N240 PolarHBondContact O-N 3.07Å; L238-N240 VanDerWaalsContact C-N 3.33Å; L238-N240 PolarHBondContact O-N 2.95Å; N240-S242 VanDerWaalsContact C-N 3.28Å; N240-W258 PolarHBondContact OD1-NE1 2.9Å |
| 241 | E | 91.7 | Very high | 87.5 | Confident | 143 Ų | 143 | 73.3 Ų | 73.3 | 67% | 0.668 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -79.4 | -10.7 | 177.8 | -66.5 | 176.3 | 175.7 | 0 | 0 | 113 | I237 L238 F239 | I237-E241 PolarHBondContact O-N 3.32Å; L238-E241 PolarHBondContact O-N 3.29Å; F239-E241 VanDerWaalsContact C-N 3.29Å; F239-E241 PolarHBondContact O-N 3.27Å |
| 242 | S | 90.8 | Very high | 87.2 | Confident | 12 Ų | 12 | 76 Ų | 76 | 8% | 0.084 | 43% | 0.432 | C | S | . | . | S | Bend | trans | -66.3 | 152.1 | 179.8 | 70.7 | 0 | 0 | 0 | 0 | 112.7 | L238 F239 N240 P244 P255 T256 M257 | L238-S242 PolarHBondContact O-N 3.47Å; F239-S242 WeakPolarHBondContact O-CB 3.44Å; F239-S242 PolarHBondContact O-N 3.4Å; F239-S242 PolarHBondContact O-OG 2.84Å; N240-S242 VanDerWaalsContact C-N 3.28Å; S242-P244 WeakPolarHBondContact O-CD 3.46Å; S242-P255 WeakPolarHBondContact OG-CB 3.46Å; S242-T256 PolarHBondContact OG-N 3.43Å; S242-M257 PolarHBondContact OG-N 3.46Å |
| 243 | T | 87.9 | Confident | 86.7 | Confident | 106 Ų | 106 | 80 Ų | 80 | 65% | 0.65 | 46% | 0.456 | S | S | * | . | P | Polyproline II helix | trans | -54.8 | 125.3 | -176.7 | 48.3 | 0 | 0 | 0 | 0 | 111.1 | T256 | T243-T256 PolarHBondContact O-N 2.95Å; T243-T256 PolarHBondContact O-OG1 2.96Å |
| 244 | P | 86.6 | Confident | 86.3 | Confident | 96 Ų | 96 | 74.7 Ų | 74.7 | 62% | 0.623 | 44% | 0.438 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -68.3 | 135.3 | 176.1 | -21 | 33.2 | 0 | 0 | 0 | 111.3 | S242 | S242-P244 WeakPolarHBondContact O-CD 3.46Å |
| 245 | V | 84.3 | Confident | 86.2 | Confident | 59 Ų | 59 | 72.3 Ų | 72.3 | 36% | 0.358 | 43% | 0.427 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.4 | 132.4 | 172.1 | 171 | 0 | 0 | 0 | 0 | 108.8 | L247 T253 M254 T256 | V245-L247 PolarHBondContact O-N 2.87Å; V245-T253 WeakPolarHBondContact O-CA 3.33Å; V245-M254 PolarHBondContact N-O 3.36Å; V245-M254 PolarHBondContact O-N 3.49Å; V245-M254 VanDerWaalsContact O-N 3.09Å; V245-T256 WeakPolarHBondContact CG2-OG1 3.38Å |
| 246 | L | 82.1 | Confident | 86.1 | Confident | 107 Ų | 107 | 72.3 Ų | 72.3 | 56% | 0.56 | 43% | 0.428 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -75.2 | 119.6 | 172 | -171.6 | 81.3 | 0 | 0 | 0 | 108.6 | P248 T253 | L246-P248 WeakPolarHBondContact O-CD 3.43Å; L246-T253 HydrophobicContact CD1-CG2 3.71Å |
| 247 | L | 80.2 | Confident | 86 | Confident | 40 Ų | 40 | 71.1 Ų | 71.1 | 21% | 0.209 | 42% | 0.419 | C | S | . | . | trans | -78.9 | 107.6 | 171 | -69.7 | 178.7 | 0 | 0 | 0 | 109.4 | V245 V249 V250 G251 L252 M254 L259 | V245-L247 PolarHBondContact O-N 2.87Å; L247-V249 PolarHBondContact O-N 3.02Å; L247-V250 HydrophobicContact CB-CB 4.46Å; L247-V250 PolarHBondContact O-N 2.93Å; L247-V250 VanDerWaalsContact O-N 3.11Å; L247-G251 PolarHBondContact O-N 3.22Å; L247-L252 PolarHBondContact N-O 3.28Å; L247-M254 HydrophobicContact CD1-CG 4.16Å; L247-M254 HydrophobicContact CD1-SD 3.57Å; L247-M254 VanDerWaalsContact CD1-SD 3.57Å; L247-M254 HydrophobicContact CG-CG 4.34Å; L247-M254 HydrophobicContact CG-SD 4.27Å; L247-L259 HydrophobicContact CD2-CD1 4.14Å; L247-L259 HydrophobicContact CD2-CD2 3.99Å | ||
| 248 | P | 70.4 | Confident | 85.9 | Confident | 120 Ų | 120 | 71.9 Ų | 71.9 | 78% | 0.779 | 42% | 0.418 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.2 | -26.1 | -171.1 | -21.4 | 33.9 | 0 | 0 | 0 | 113.2 | L246 | L246-P248 WeakPolarHBondContact O-CD 3.43Š|
| 249 | V | 74.4 | Confident | 85.9 | Confident | 141 Ų | 141 | 70.7 Ų | 70.7 | 86% | 0.855 | 41% | 0.411 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.2 | -25.9 | -176.7 | -176 | 0 | 0 | 0 | 0 | 112.5 | L247 | L247-V249 PolarHBondContact O-N 3.02Š|
| 250 | V | 76.2 | Confident | 85.9 | Confident | 91 Ų | 91 | 73.9 Ų | 73.9 | 55% | 0.552 | 42% | 0.424 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -119.3 | -9.7 | -171.1 | -157.1 | 0 | 0 | 0 | 0 | 112.2 | L247 L252 | L247-V250 HydrophobicContact CB-CB 4.46Å; L247-V250 PolarHBondContact O-N 2.93Å; L247-V250 VanDerWaalsContact O-N 3.11Å; V250-L252 HydrophobicContact CB-CD1 4.36Å; V250-L252 HydrophobicContact CG1-CD1 3.58Å; V250-L252 HydrophobicContact CG1-CG 4.18Å; V250-L252 PolarHBondContact O-N 3.01Å; V250-L252 VanDerWaalsContact O-N 3.09Å |
| 251 | G | 78.1 | Confident | 86 | Confident | 59 Ų | 59 | 69.7 Ų | 69.7 | 61% | 0.608 | 40% | 0.402 | S | S | * | . | trans | 64.7 | 9.6 | -177.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | L247 | L247-G251 PolarHBondContact O-N 3.22Š| ||
| 252 | L | 82.4 | Confident | 86.2 | Confident | 110 Ų | 110 | 67.3 Ų | 67.3 | 58% | 0.576 | 39% | 0.393 | S | S | * | . | trans | -94.3 | 133.6 | -179.9 | -75.8 | 164.3 | 0 | 0 | 0 | 110.2 | L247 V250 | L247-L252 PolarHBondContact N-O 3.28Å; V250-L252 HydrophobicContact CB-CD1 4.36Å; V250-L252 HydrophobicContact CG1-CD1 3.58Å; V250-L252 HydrophobicContact CG1-CG 4.18Å; V250-L252 PolarHBondContact O-N 3.01Å; V250-L252 VanDerWaalsContact O-N 3.09Å | ||
| 253 | T | 82.9 | Confident | 86.3 | Confident | 99 Ų | 99 | 70.1 Ų | 70.1 | 61% | 0.607 | 41% | 0.406 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -87.8 | 122 | 167.3 | 50.1 | 0 | 0 | 0 | 0 | 109.2 | V245 L246 | V245-T253 WeakPolarHBondContact O-CA 3.33Å; L246-T253 HydrophobicContact CD1-CG2 3.71Å |
| 254 | M | 86.6 | Confident | 86.7 | Confident | 39 Ų | 39 | 65 Ų | 65 | 19% | 0.192 | 38% | 0.375 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.7 | 146.2 | 173.1 | 69.3 | -179.1 | -56.8 | 0 | 0 | 110.9 | V245 L247 T256 W258 L259 | V245-M254 PolarHBondContact N-O 3.36Å; V245-M254 PolarHBondContact O-N 3.49Å; V245-M254 VanDerWaalsContact O-N 3.09Å; L247-M254 HydrophobicContact CD1-CG 4.16Å; L247-M254 HydrophobicContact CD1-SD 3.57Å; L247-M254 VanDerWaalsContact CD1-SD 3.57Å; L247-M254 HydrophobicContact CG-CG 4.34Å; L247-M254 HydrophobicContact CG-SD 4.27Å; M254-T256 PolarHBondContact O-N 3.45Å; M254-W258 HydrophobicContact CE-CB 3.79Å; M254-L259 HydrophobicContact CE-CB 4.07Å; M254-L259 HydrophobicContact CG-CB 4.32Å; M254-L259 HydrophobicContact SD-CB 3.94Å; M254-L259 HydrophobicContact SD-CD1 3.91Å; M254-L259 HydrophobicContact SD-CG 4.45Å |
| 255 | P | 91.9 | Very high | 87.2 | Confident | 30 Ų | 30 | 61.1 Ų | 61.1 | 20% | 0.195 | 35% | 0.349 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -60.5 | 138.2 | 175.8 | -18.6 | 30.5 | 0 | 0 | 0 | 110.9 | F239 S242 M257 W258 L259 | F239-P255 WeakPolarHBondContact O-CB 3.37Å; S242-P255 WeakPolarHBondContact OG-CB 3.46Å; P255-M257 PolarHBondContact O-N 3Å; P255-M257 VanDerWaalsContact O-N 3.16Å; P255-W258 PolarHBondContact O-N 3.39Å; P255-W258 VanDerWaalsContact O-N 3.09Å; P255-L259 PolarHBondContact O-N 3.46Å |
| 256 | T | 90.9 | Very high | 87.7 | Confident | 13 Ų | 13 | 61.7 Ų | 61.7 | 8% | 0.08 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -55.3 | -37.6 | -172.7 | -58.8 | 0 | 0 | 0 | 0 | 112.6 | S242 T243 V245 M254 W258 L259 Y260 | S242-T256 PolarHBondContact OG-N 3.43Å; T243-T256 PolarHBondContact O-N 2.95Å; T243-T256 PolarHBondContact O-OG1 2.96Å; V245-T256 WeakPolarHBondContact CG2-OG1 3.38Å; M254-T256 PolarHBondContact O-N 3.45Å; T256-W258 PolarHBondContact O-N 3.31Å; T256-L259 WeakPolarHBondContact O-CB 3.45Å; T256-L259 PolarHBondContact O-N 2.94Å; T256-L259 VanDerWaalsContact O-N 3.16Å; T256-Y260 HydrophobicContact CG2-CD2 4.14Å; T256-Y260 HydrophobicContact CG2-CE1 4.16Å; T256-Y260 HydrophobicContact CG2-CE2 3.6Å; T256-Y260 PolarHBondContact O-N 3.42Å |
| 257 | M | 92.7 | Very high | 88.3 | Confident | 8 Ų | 8 | 57.5 Ų | 57.5 | 4% | 0.039 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -67.7 | -35.3 | -178.5 | -64.1 | -58.5 | 127.4 | 0 | 0 | 113.1 | L41 E44 F45 F239 S242 P255 L259 Y260 L261 | L41-M257 HydrophobicContact CD2-CB 4.42Å; L41-M257 HydrophobicContact CD2-SD 4.08Å; E44-M257 HydrophobicContact CB-CE 3.85Å; E44-M257 HydrophobicContact CB-SD 3.93Å; E44-M257 HydrophobicContact CG-CE 3.61Å; E44-M257 HydrophobicContact CG-SD 4.08Å; F45-M257 HydrophobicContact CD2-CG 3.86Å; F45-M257 HydrophobicContact CD2-SD 3.87Å; F45-M257 HydrophobicContact CE2-CG 3.57Å; F45-M257 HydrophobicContact CE2-SD 3.99Å; F239-M257 HydrophobicContact CB-CB 3.91Å; F239-M257 HydrophobicContact CD1-CB 3.67Å; F239-M257 HydrophobicContact CD1-CG 4.01Å; F239-M257 HydrophobicContact CD2-CB 3.77Å; F239-M257 HydrophobicContact CE1-CB 4.08Å; F239-M257 HydrophobicContact CE1-CG 4.32Å; F239-M257 HydrophobicContact CE2-CB 4.16Å; F239-M257 HydrophobicContact CG-CB 3.5Å; F239-M257 HydrophobicContact CG-CG 4.33Å; F239-M257 HydrophobicContact CZ-CB 4.31Å; S242-M257 PolarHBondContact OG-N 3.46Å; P255-M257 PolarHBondContact O-N 3Å; P255-M257 VanDerWaalsContact O-N 3.16Å; M257-L259 VanDerWaalsContact C-N 3.28Å; M257-L259 PolarHBondContact O-N 3.32Å; M257-Y260 HydrophobicContact CE-CD2 4.08Å; M257-Y260 HydrophobicContact CE-CE2 4.08Å; M257-Y260 PolarHBondContact O-N 3.31Å; M257-Y260 HydrophobicContact SD-CD2 4.21Å; M257-L261 WeakPolarHBondContact O-CB 3.37Å; M257-L261 PolarHBondContact O-N 3Å |
| 258 | W | 94.3 | Very high | 88.9 | Confident | 79 Ų | 79 | 57.4 Ų | 57.4 | 30% | 0.299 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -66.3 | -33.7 | 173.8 | -74.9 | 110.2 | 0 | 0 | 0 | 111.8 | I51 C236 F239 N240 M254 P255 T256 L261 L262 | I51-W258 HydrophobicContact CD1-CH2 4.41Å; C236-W258 HydrophobicContact CB-CZ2 4.39Å; F239-W258 HydrophobicContact CB-CD2 4.5Å; F239-W258 HydrophobicContact CB-CZ2 4.36Å; F239-W258 HydrophobicContact CD2-CD2 4.5Å; N240-W258 PolarHBondContact OD1-NE1 2.9Å; M254-W258 HydrophobicContact CE-CB 3.79Å; P255-W258 PolarHBondContact O-N 3.39Å; P255-W258 VanDerWaalsContact O-N 3.09Å; T256-W258 PolarHBondContact O-N 3.31Å; W258-L261 HydrophobicContact CE3-CD2 3.73Å; W258-L261 HydrophobicContact CZ3-CD2 3.62Å; W258-L261 PolarHBondContact O-N 3.09Å; W258-L262 WeakPolarHBondContact O-CB 3.43Å; W258-L262 PolarHBondContact O-N 3.19Å |
| 259 | L | 92.4 | Very high | 89.9 | Confident | 34 Ų | 34 | 52.9 Ų | 52.9 | 18% | 0.178 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -66.9 | -46.2 | 174.4 | 179.5 | 62.1 | 0 | 0 | 0 | 111.1 | L247 M254 P255 T256 M257 L261 L262 I263 | L247-L259 HydrophobicContact CD2-CD1 4.14Å; L247-L259 HydrophobicContact CD2-CD2 3.99Å; M254-L259 HydrophobicContact CE-CB 4.07Å; M254-L259 HydrophobicContact CG-CB 4.32Å; M254-L259 HydrophobicContact SD-CB 3.94Å; M254-L259 HydrophobicContact SD-CD1 3.91Å; M254-L259 HydrophobicContact SD-CG 4.45Å; P255-L259 PolarHBondContact O-N 3.46Å; T256-L259 WeakPolarHBondContact O-CB 3.45Å; T256-L259 PolarHBondContact O-N 2.94Å; T256-L259 VanDerWaalsContact O-N 3.16Å; M257-L259 VanDerWaalsContact C-N 3.28Å; M257-L259 PolarHBondContact O-N 3.32Å; L259-L261 VanDerWaalsContact C-N 3.33Å; L259-L261 PolarHBondContact O-N 2.93Å; L259-L262 PolarHBondContact O-N 3.26Å; L259-I263 HydrophobicContact CD1-CD1 4.27Å; L259-I263 HydrophobicContact CD1-CG1 4.49Å; L259-I263 HydrophobicContact CG-CD1 4.06Å; L259-I263 VanDerWaalsContact O-CG1 3.31Å; L259-I263 WeakPolarHBondContact O-CG1 3.19Å; L259-I263 PolarHBondContact O-N 2.8Å |
| 260 | Y | 93.8 | Very high | 90.7 | Very high | 68 Ų | 68 | 48 Ų | 48 | 27% | 0.267 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -62.7 | -39.5 | 175.3 | -67 | -20.8 | 0 | 0 | 0 | 112.4 | L40 T256 M257 I263 N264 | L40-Y260 HydrophobicContact CB-CD2 4.01Å; L40-Y260 HydrophobicContact CB-CE2 4.05Å; L40-Y260 HydrophobicContact CD1-CD1 4.45Å; L40-Y260 HydrophobicContact CD1-CE1 4.13Å; L40-Y260 HydrophobicContact CD1-CE2 4.36Å; T256-Y260 HydrophobicContact CG2-CD2 4.14Å; T256-Y260 HydrophobicContact CG2-CE1 4.16Å; T256-Y260 HydrophobicContact CG2-CE2 3.6Å; T256-Y260 PolarHBondContact O-N 3.42Å; M257-Y260 HydrophobicContact CE-CD2 4.08Å; M257-Y260 HydrophobicContact CE-CE2 4.08Å; M257-Y260 PolarHBondContact O-N 3.31Å; M257-Y260 HydrophobicContact SD-CD2 4.21Å; Y260-I263 HydrophobicContact CD1-CD1 4.48Å; Y260-I263 PolarHBondContact O-N 3.25Å; Y260-N264 VanDerWaalsContact O-CB 3.25Å; Y260-N264 WeakPolarHBondContact O-CB 3.42Å; Y260-N264 PolarHBondContact O-N 3.37Å |
| 261 | L | 95.8 | Very high | 91.5 | Very high | 10 Ų | 10 | 44.1 Ų | 44.1 | 5% | 0.052 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -61.5 | -44.6 | 173.6 | -179.1 | 63.8 | 0 | 0 | 0 | 111.4 | I51 V52 A55 F239 M257 W258 L259 N264 V265 | I51-L261 HydrophobicContact CG1-CD2 4.47Å; V52-L261 HydrophobicContact CB-CD1 4.21Å; V52-L261 HydrophobicContact CG1-CD1 4.38Å; V52-L261 HydrophobicContact CG2-CD1 3.89Å; A55-L261 HydrophobicContact CB-CD1 4Å; A55-L261 HydrophobicContact CB-CD2 4.28Å; A55-L261 HydrophobicContact CB-CG 4.35Å; F239-L261 HydrophobicContact CE2-CB 4.34Å; F239-L261 HydrophobicContact CE2-CD2 4.29Å; M257-L261 WeakPolarHBondContact O-CB 3.37Å; M257-L261 PolarHBondContact O-N 3Å; W258-L261 HydrophobicContact CE3-CD2 3.73Å; W258-L261 HydrophobicContact CZ3-CD2 3.62Å; W258-L261 PolarHBondContact O-N 3.09Å; L259-L261 VanDerWaalsContact C-N 3.33Å; L259-L261 PolarHBondContact O-N 2.93Å; L261-N264 WeakPolarHBondContact O-CB 3.27Å; L261-N264 PolarHBondContact O-N 3.47Å; L261-V265 HydrophobicContact CD1-CG2 4.43Å; L261-V265 WeakPolarHBondContact O-CG2 3.35Å; L261-V265 PolarHBondContact O-N 3.35Å |
| 262 | L | 94.4 | Very high | 91.9 | Very high | 93 Ų | 93 | 42.7 Ų | 42.7 | 49% | 0.487 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -61.3 | -48.5 | 177.1 | 179.3 | 65.1 | 0 | 0 | 0 | 111.4 | W258 L259 N264 V265 V266 | W258-L262 WeakPolarHBondContact O-CB 3.43Å; W258-L262 PolarHBondContact O-N 3.19Å; L259-L262 PolarHBondContact O-N 3.26Å; L262-N264 PolarHBondContact O-N 3.44Å; L262-V265 PolarHBondContact O-N 2.88Å; L262-V266 HydrophobicContact CD1-CG2 4.33Å; L262-V266 WeakPolarHBondContact O-CG2 3.41Å; L262-V266 PolarHBondContact O-N 3.24Å |
| 263 | I | 94.6 | Very high | 92 | Very high | 70 Ų | 70 | 43.2 Ų | 43.2 | 36% | 0.359 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -56.9 | -43.5 | 175.1 | -68.4 | 166.4 | 0 | 0 | 0 | 109.6 | L259 Y260 V266 T267 | L259-I263 HydrophobicContact CD1-CD1 4.27Å; L259-I263 HydrophobicContact CD1-CG1 4.49Å; L259-I263 HydrophobicContact CG-CD1 4.06Å; L259-I263 VanDerWaalsContact O-CG1 3.31Å; L259-I263 WeakPolarHBondContact O-CG1 3.19Å; L259-I263 PolarHBondContact O-N 2.8Å; Y260-I263 HydrophobicContact CD1-CD1 4.48Å; Y260-I263 PolarHBondContact O-N 3.25Å; I263-V266 PolarHBondContact O-N 2.88Å; I263-T267 HydrophobicContact CG2-CG2 4.08Å; I263-T267 VanDerWaalsContact O-CB 3.28Å; I263-T267 WeakPolarHBondContact O-CB 3.39Å; I263-T267 WeakPolarHBondContact O-CG2 3.41Å; I263-T267 PolarHBondContact O-N 3Å; I263-T267 PolarHBondContact O-OG1 2.92Å |
| 264 | N | 95.8 | Very high | 92.3 | Very high | 0 Ų | 0 | 38.5 Ų | 38.5 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -61.9 | -46.8 | 179.4 | -169.2 | -86.7 | 0 | 0 | 0 | 112.2 | N34 S37 L38 L41 V52 Q56 Y260 L261 L262 T267 Q268 | N34-N264 VanDerWaalsContact ND2-CG 3.31Å; N34-N264 PolarHBondContact ND2-ND2 2.81Å; N34-N264 VanDerWaalsContact ND2-ND2 3.16Å; N34-N264 PolarHBondContact ND2-O 3.33Å; N34-N264 PolarHBondContact ND2-OD1 3.17Å; N34-N264 PolarHBondContact O-ND2 3.12Å; S37-N264 WeakPolarHBondContact OG-CA 3.36Å; S37-N264 WeakPolarHBondContact OG-CB 3.43Å; S37-N264 PolarHBondContact OG-ND2 3.46Å; L38-N264 PolarHBondContact N-ND2 3.48Å; L41-N264 HydrophobicContact CD1-CB 4.24Å; V52-N264 WeakPolarHBondContact CG1-OD1 3.34Å; Q56-N264 PolarHBondContact NE2-OD1 3.4Å; Y260-N264 VanDerWaalsContact O-CB 3.25Å; Y260-N264 WeakPolarHBondContact O-CB 3.42Å; Y260-N264 PolarHBondContact O-N 3.37Å; L261-N264 WeakPolarHBondContact O-CB 3.27Å; L261-N264 PolarHBondContact O-N 3.47Å; L262-N264 PolarHBondContact O-N 3.44Å; N264-T267 WeakPolarHBondContact CA-OG1 3.34Å; N264-T267 PolarHBondContact O-OG1 2.65Å; N264-Q268 VanDerWaalsContact O-CB 3.26Å; N264-Q268 WeakPolarHBondContact O-CB 3.46Å; N264-Q268 PolarHBondContact O-N 3.16Å |
| 265 | V | 96.2 | Very high | 92.3 | Very high | 13 Ų | 13 | 38.3 Ų | 38.3 | 8% | 0.079 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -63.2 | -45.6 | 178.1 | 171.9 | 0 | 0 | 0 | 0 | 111.6 | A55 Q56 F59 L261 L262 Q268 Y269 | A55-V265 HydrophobicContact CB-CG2 3.77Å; Q56-V265 HydrophobicContact CG-CG2 4.21Å; F59-V265 HydrophobicContact CB-CG1 3.55Å; F59-V265 HydrophobicContact CD1-CG1 4.04Å; F59-V265 HydrophobicContact CD2-CG1 4.05Å; F59-V265 HydrophobicContact CG-CG1 3.6Å; L261-V265 HydrophobicContact CD1-CG2 4.43Å; L261-V265 WeakPolarHBondContact O-CG2 3.35Å; L261-V265 PolarHBondContact O-N 3.35Å; L262-V265 PolarHBondContact O-N 2.88Å; V265-Q268 PolarHBondContact O-N 2.86Å; V265-Y269 PolarHBondContact O-N 3.43Å |
| 266 | V | 94.8 | Very high | 91.8 | Very high | 71 Ų | 71 | 39.3 Ų | 39.3 | 43% | 0.43 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -64.1 | -47.7 | 179.4 | 171.9 | 0 | 0 | 0 | 0 | 111 | L262 I263 Q268 Y269 V270 | L262-V266 HydrophobicContact CD1-CG2 4.33Å; L262-V266 WeakPolarHBondContact O-CG2 3.41Å; L262-V266 PolarHBondContact O-N 3.24Å; I263-V266 PolarHBondContact O-N 2.88Å; V266-Q268 VanDerWaalsContact C-N 3.32Å; V266-Q268 PolarHBondContact O-N 3.32Å; V266-Y269 PolarHBondContact O-N 2.91Å; V266-V270 WeakPolarHBondContact O-CG2 3.21Å; V266-V270 PolarHBondContact O-N 2.96Å |
| 267 | T | 94.7 | Very high | 91.4 | Very high | 19 Ų | 19 | 41.2 Ų | 41.2 | 12% | 0.117 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -65.6 | -35.1 | 179.1 | 54.2 | 0 | 0 | 0 | 0 | 111.9 | G30 N34 I263 N264 V270 C271 | G30-T267 CarbonylContact C-O 3.49Å; G30-T267 WeakPolarHBondContact O-CB 3.45Å; N34-T267 VanDerWaalsContact CA-OG1 3.29Å; N34-T267 WeakPolarHBondContact CA-OG1 3.45Å; N34-T267 WeakPolarHBondContact CB-OG1 3.29Å; I263-T267 HydrophobicContact CG2-CG2 4.08Å; I263-T267 VanDerWaalsContact O-CB 3.28Å; I263-T267 WeakPolarHBondContact O-CB 3.39Å; I263-T267 WeakPolarHBondContact O-CG2 3.41Å; I263-T267 PolarHBondContact O-N 3Å; I263-T267 PolarHBondContact O-OG1 2.92Å; N264-T267 WeakPolarHBondContact CA-OG1 3.34Å; N264-T267 PolarHBondContact O-OG1 2.65Å; T267-V270 PolarHBondContact O-N 3.33Å; T267-C271 VanDerWaalsContact O-CB 3.23Å; T267-C271 WeakPolarHBondContact O-CB 3.45Å; T267-C271 PolarHBondContact O-N 3.49Å |
| 268 | Q | 93.4 | Very high | 90.8 | Very high | 38 Ų | 38 | 40.8 Ų | 40.8 | 18% | 0.178 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -61.5 | -45 | 172.1 | -175.6 | 65.2 | -1.1 | 0 | 0 | 111.5 | N34 Q56 N264 V265 V266 C271 I272 | N34-Q268 WeakPolarHBondContact ND2-CB 3.4Å; N34-Q268 PolarHBondContact ND2-OE1 3.16Å; N34-Q268 PolarHBondContact OD1-OE1 3.08Å; Q56-Q268 HydrophobicContact CB-CG 4.35Å; Q56-Q268 HydrophobicContact CG-CB 4.06Å; Q56-Q268 HydrophobicContact CG-CG 3.92Å; N264-Q268 VanDerWaalsContact O-CB 3.26Å; N264-Q268 WeakPolarHBondContact O-CB 3.46Å; N264-Q268 PolarHBondContact O-N 3.16Å; V265-Q268 PolarHBondContact O-N 2.86Å; V266-Q268 VanDerWaalsContact C-N 3.32Å; V266-Q268 PolarHBondContact O-N 3.32Å; Q268-C271 WeakPolarHBondContact O-CB 3.41Å; Q268-C271 PolarHBondContact O-N 3.03Å; Q268-I272 HydrophobicContact CG-CD1 3.96Å; Q268-I272 WeakPolarHBondContact O-CG1 3.38Å; Q268-I272 PolarHBondContact O-N 3.45Å |
| 269 | Y | 91.6 | Very high | 90.1 | Very high | 25 Ų | 25 | 40 Ų | 40 | 10% | 0.098 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -63.2 | -45.2 | 177.4 | 177.2 | -113.9 | 0 | 0 | 0 | 111.8 | F59 E63 V265 V266 C271 I272 R273 | F59-Y269 HydrophobicContact CD1-CD2 4.3Å; F59-Y269 HydrophobicContact CD1-CG 4.27Å; F59-Y269 AromaticContact CE1-CD1 3.95Å; F59-Y269 HydrophobicContact CE1-CD1 3.95Å; F59-Y269 AromaticContact CE1-CD2 3.83Å; F59-Y269 HydrophobicContact CE1-CD2 3.83Å; F59-Y269 HydrophobicContact CE1-CE1 4.45Å; F59-Y269 HydrophobicContact CE1-CE2 4.37Å; F59-Y269 AromaticContact CE1-CG 3.59Å; F59-Y269 HydrophobicContact CE1-CG 3.59Å; E63-Y269 HydrophobicContact CG-CE2 3.93Å; E63-Y269 PolarHBondContact OE1-OH 3.35Å; V265-Y269 PolarHBondContact O-N 3.43Å; V266-Y269 PolarHBondContact O-N 2.91Å; Y269-C271 VanDerWaalsContact C-N 3.32Å; Y269-C271 PolarHBondContact O-N 3.17Å; Y269-I272 PolarHBondContact O-N 3.32Å; Y269-R273 HydrophobicContact CD2-CG 4.25Å; Y269-R273 HydrophobicContact CE1-CG 4.26Å; Y269-R273 HydrophobicContact CE2-CG 3.88Å; Y269-R273 VanDerWaalsContact CZ-CD 3.43Å; Y269-R273 VanDerWaalsContact CZ-CZ 3.5Å; Y269-R273 WeakPolarHBondContact O-CB 3.4Å; Y269-R273 WeakPolarHBondContact O-CG 3.31Å; Y269-R273 PolarHBondContact O-N 3.48Å; Y269-R273 WeakPolarHBondContact OH-CD 3.27Å; Y269-R273 VanDerWaalsContact OH-CZ 3.28Å; Y269-R273 PolarHBondContact OH-NE 3.32Å; Y269-R273 PolarHBondContact OH-NH1 3.23Å |
| 270 | V | 91.6 | Very high | 89.3 | Confident | 40 Ų | 40 | 42.2 Ų | 42.2 | 24% | 0.242 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -58.3 | -45.4 | 174.8 | 172.8 | 0 | 0 | 0 | 0 | 111 | L26 V266 T267 R273 G274 | L26-V270 HydrophobicContact CB-CG1 4.37Å; L26-V270 HydrophobicContact CD2-CG1 3.89Å; V266-V270 WeakPolarHBondContact O-CG2 3.21Å; V266-V270 PolarHBondContact O-N 2.96Å; T267-V270 PolarHBondContact O-N 3.33Å; V270-R273 PolarHBondContact O-N 3.36Å; V270-G274 PolarHBondContact O-N 2.95Å |
| 271 | C | 92.1 | Very high | 88.4 | Confident | 9 Ų | 9 | 42.5 Ų | 42.5 | 6% | 0.061 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -56.2 | -52.7 | 176.1 | 172.8 | 0 | 0 | 0 | 0 | 111.6 | C31 T267 Q268 Y269 R273 G274 V275 | C31-C271 HydrophobicContact CB-CB 3.93Å; C31-C271 WeakPolarHBondContact CB-SG 3.29Å; C31-C271 VanDerWaalsContact SG-CA 3.55Å; C31-C271 WeakPolarHBondContact SG-CB 3.39Å; C31-C271 CovalentContact SG-SG 2.01Å; C31-C271 PolarHBondContact SG-SG 3.41Å; T267-C271 VanDerWaalsContact O-CB 3.23Å; T267-C271 WeakPolarHBondContact O-CB 3.45Å; T267-C271 PolarHBondContact O-N 3.49Å; Q268-C271 WeakPolarHBondContact O-CB 3.41Å; Q268-C271 PolarHBondContact O-N 3.03Å; Y269-C271 VanDerWaalsContact C-N 3.32Å; Y269-C271 PolarHBondContact O-N 3.17Å; C271-R273 PolarHBondContact O-N 3.13Å; C271-G274 PolarHBondContact O-N 3.43Å; C271-V275 WeakPolarHBondContact O-CG2 3.15Å; C271-V275 PolarHBondContact O-N 3.33Å |
| 272 | I | 87.4 | Confident | 87.4 | Confident | 28 Ų | 28 | 42.8 Ų | 42.8 | 14% | 0.144 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -63.3 | -44.4 | -178.8 | -70.5 | 171.2 | 0 | 0 | 0 | 110.9 | I60 L214 Q268 Y269 G274 V275 F276 | I60-I272 HydrophobicContact CD1-CD1 3.38Å; I60-I272 HydrophobicContact CG1-CD1 4.43Å; L214-I272 HydrophobicContact CD1-CG2 3.62Å; L214-I272 HydrophobicContact CD2-CG2 3.89Å; L214-I272 HydrophobicContact CG-CG2 4.44Å; Q268-I272 HydrophobicContact CG-CD1 3.96Å; Q268-I272 WeakPolarHBondContact O-CG1 3.38Å; Q268-I272 PolarHBondContact O-N 3.45Å; Y269-I272 PolarHBondContact O-N 3.32Å; I272-G274 VanDerWaalsContact C-N 3.35Å; I272-G274 PolarHBondContact O-N 3.22Å; I272-V275 PolarHBondContact O-N 3.07Å; I272-F276 WeakPolarHBondContact O-CB 3.44Å; I272-F276 PolarHBondContact O-N 2.94Å |
| 273 | R | 84.8 | Confident | 86.6 | Confident | 122 Ų | 122 | 42.7 Ų | 42.7 | 46% | 0.46 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -62.4 | -41.9 | 176.3 | -73.1 | -146.2 | -67 | -164.5 | 4.1 | 112.1 | Y269 V270 C271 F276 I277 | Y269-R273 HydrophobicContact CD2-CG 4.25Å; Y269-R273 HydrophobicContact CE1-CG 4.26Å; Y269-R273 HydrophobicContact CE2-CG 3.88Å; Y269-R273 VanDerWaalsContact CZ-CD 3.43Å; Y269-R273 VanDerWaalsContact CZ-CZ 3.5Å; Y269-R273 WeakPolarHBondContact O-CB 3.4Å; Y269-R273 WeakPolarHBondContact O-CG 3.31Å; Y269-R273 PolarHBondContact O-N 3.48Å; Y269-R273 WeakPolarHBondContact OH-CD 3.27Å; Y269-R273 VanDerWaalsContact OH-CZ 3.28Å; Y269-R273 PolarHBondContact OH-NE 3.32Å; Y269-R273 PolarHBondContact OH-NH1 3.23Å; V270-R273 PolarHBondContact O-N 3.36Å; C271-R273 PolarHBondContact O-N 3.13Å; R273-F276 WeakPolarHBondContact O-CB 3.4Å; R273-F276 PolarHBondContact O-N 3.37Å; R273-I277 VanDerWaalsContact O-CG1 3.27Å; R273-I277 WeakPolarHBondContact O-CG1 3.26Å; R273-I277 PolarHBondContact O-N 2.87Å |
| 274 | G | 87.6 | Confident | 85.4 | Confident | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -58.2 | -48.3 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | V270 C271 I272 F276 I277 L278 | V270-G274 PolarHBondContact O-N 2.95Å; C271-G274 PolarHBondContact O-N 3.43Å; I272-G274 VanDerWaalsContact C-N 3.35Å; I272-G274 PolarHBondContact O-N 3.22Å; G274-F276 VanDerWaalsContact C-N 3.29Å; G274-F276 PolarHBondContact O-N 3.11Å; G274-I277 PolarHBondContact O-N 2.9Å; G274-L278 WeakPolarHBondContact O-CB 3.45Å; G274-L278 PolarHBondContact O-N 2.85Å |
| 275 | V | 87.3 | Confident | 84.1 | Confident | 34 Ų | 34 | 46.3 Ų | 46.3 | 21% | 0.206 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -62.6 | -39.1 | 177.6 | 174.6 | 0 | 0 | 0 | 0 | 111.1 | V27 C271 I272 L278 T279 V291 R294 | V27-V275 HydrophobicContact CG1-CG2 4.3Å; V27-V275 HydrophobicContact CG2-CG2 3.88Å; V27-V275 VanDerWaalsContact CG2-N 3.34Å; C271-V275 WeakPolarHBondContact O-CG2 3.15Å; C271-V275 PolarHBondContact O-N 3.33Å; I272-V275 PolarHBondContact O-N 3.07Å; V275-L278 PolarHBondContact O-N 3.12Å; V275-T279 WeakPolarHBondContact O-CB 3.46Å; V275-T279 PolarHBondContact O-N 3.33Å; V275-T279 PolarHBondContact O-OG1 3.48Å; V275-V291 HydrophobicContact CG1-CG2 4.46Å; V275-V291 HydrophobicContact CG2-CG2 4.35Å; V275-R294 VanDerWaalsContact CG2-NH1 3.27Å |
| 276 | F | 82.6 | Confident | 83 | Confident | 52 Ų | 52 | 48.1 Ų | 48.1 | 23% | 0.228 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -62.6 | -52.1 | 177.6 | -177.3 | -82.7 | 0 | 0 | 0 | 111.6 | K211 I272 R273 G274 L278 T279 T280 | K211-F276 HydrophobicContact CD-CZ 4.47Å; K211-F276 HydrophobicContact CG-CE1 4.41Å; K211-F276 HydrophobicContact CG-CE2 3.79Å; K211-F276 HydrophobicContact CG-CZ 3.54Å; I272-F276 WeakPolarHBondContact O-CB 3.44Å; I272-F276 PolarHBondContact O-N 2.94Å; R273-F276 WeakPolarHBondContact O-CB 3.4Å; R273-F276 PolarHBondContact O-N 3.37Å; G274-F276 VanDerWaalsContact C-N 3.29Å; G274-F276 PolarHBondContact O-N 3.11Å; F276-L278 PolarHBondContact O-N 3.36Å; F276-T279 WeakPolarHBondContact O-CA 3.45Å; F276-T279 WeakPolarHBondContact O-CB 3.23Å; F276-T279 PolarHBondContact O-N 3.44Å; F276-T280 HydrophobicContact CD1-CG2 4.22Å; F276-T280 HydrophobicContact CE1-CG2 3.77Å; F276-T280 HydrophobicContact CZ-CG2 4.16Å; F276-T280 PolarHBondContact O-N 3.47Å; F276-T280 PolarHBondContact O-OG1 3.44Å |
| 277 | I | 81.2 | Confident | 82.2 | Confident | 52 Ų | 52 | 45.5 Ų | 45.5 | 27% | 0.267 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -58.3 | -42.6 | 177.9 | -65 | 164.2 | 0 | 0 | 0 | 109.7 | A23 L26 R273 G274 T279 T280 E281 | A23-I277 HydrophobicContact CB-CB 4.12Å; A23-I277 HydrophobicContact CB-CG2 3.73Å; L26-I277 HydrophobicContact CD1-CD1 4.22Å; R273-I277 VanDerWaalsContact O-CG1 3.27Å; R273-I277 WeakPolarHBondContact O-CG1 3.26Å; R273-I277 PolarHBondContact O-N 2.87Å; G274-I277 PolarHBondContact O-N 2.9Å; I277-T279 VanDerWaalsContact C-N 3.29Å; I277-T279 PolarHBondContact O-N 3.34Å; I277-T280 WeakPolarHBondContact CA-OG1 3.34Å; I277-T280 PolarHBondContact O-N 3.45Å; I277-T280 PolarHBondContact O-OG1 3.18Å; I277-E281 HydrophobicContact CG2-CG 4Å; I277-E281 WeakPolarHBondContact O-CB 3.43Å; I277-E281 WeakPolarHBondContact O-CG 3.38Å; I277-E281 PolarHBondContact O-N 3.25Å |
| 278 | L | 81.5 | Confident | 81.3 | Confident | 0 Ų | 0 | 47.4 Ų | 47.4 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -61.3 | -40.2 | 176.6 | -163.4 | 71.4 | 0 | 0 | 0 | 111.5 | A23 V24 G274 V275 F276 T280 C282 V287 V290 | A23-L278 HydrophobicContact CB-CB 4.33Å; A23-L278 HydrophobicContact CB-CD1 4.17Å; V24-L278 HydrophobicContact CG2-CD1 3.98Å; G274-L278 WeakPolarHBondContact O-CB 3.45Å; G274-L278 PolarHBondContact O-N 2.85Å; V275-L278 PolarHBondContact O-N 3.12Å; F276-L278 PolarHBondContact O-N 3.36Å; L278-T280 VanDerWaalsContact C-N 3.28Å; L278-T280 PolarHBondContact O-N 2.88Å; L278-C282 HydrophobicContact CD1-CB 4.25Å; L278-C282 HydrophobicContact CG-CB 4.43Å; L278-C282 WeakPolarHBondContact O-CA 3.31Å; L278-C282 WeakPolarHBondContact O-CB 3.47Å; L278-C282 PolarHBondContact O-N 3.46Å; L278-V287 HydrophobicContact CB-CG2 4.49Å; L278-V287 HydrophobicContact CD2-CB 4.36Å; L278-V287 HydrophobicContact CD2-CG1 4.37Å; L278-V287 HydrophobicContact CD2-CG2 4.42Å; L278-V287 HydrophobicContact CG-CB 4.49Å; L278-V287 HydrophobicContact CG-CG2 4.01Å; L278-V287 VanDerWaalsContact O-CG2 3.3Å; L278-V287 WeakPolarHBondContact O-CG2 3.26Å; L278-V290 HydrophobicContact CD2-CB 3.59Å; L278-V290 HydrophobicContact CD2-CG1 3.66Å; L278-V290 HydrophobicContact CD2-CG2 3.95Å |
| 279 | T | 78.1 | Confident | 80.5 | Confident | 63 Ų | 63 | 47.4 Ų | 47.4 | 39% | 0.387 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -67.5 | -28.1 | 178.4 | -55.3 | 0 | 0 | 0 | 0 | 112.9 | V275 F276 I277 | V275-T279 WeakPolarHBondContact O-CB 3.46Å; V275-T279 PolarHBondContact O-N 3.33Å; V275-T279 PolarHBondContact O-OG1 3.48Å; F276-T279 WeakPolarHBondContact O-CA 3.45Å; F276-T279 WeakPolarHBondContact O-CB 3.23Å; F276-T279 PolarHBondContact O-N 3.44Å; I277-T279 VanDerWaalsContact C-N 3.29Å; I277-T279 PolarHBondContact O-N 3.34Å |
| 280 | T | 75.7 | Confident | 80.1 | Confident | 80 Ų | 80 | 46.8 Ų | 46.8 | 49% | 0.491 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -88.8 | -32.3 | 179.2 | 53.9 | 0 | 0 | 0 | 0 | 113.4 | F276 I277 L278 | F276-T280 HydrophobicContact CD1-CG2 4.22Å; F276-T280 HydrophobicContact CE1-CG2 3.77Å; F276-T280 HydrophobicContact CZ-CG2 4.16Å; F276-T280 PolarHBondContact O-N 3.47Å; F276-T280 PolarHBondContact O-OG1 3.44Å; I277-T280 WeakPolarHBondContact CA-OG1 3.34Å; I277-T280 PolarHBondContact O-N 3.45Å; I277-T280 PolarHBondContact O-OG1 3.18Å; L278-T280 VanDerWaalsContact C-N 3.28Å; L278-T280 PolarHBondContact O-N 2.88Å |
| 281 | E | 76.1 | Confident | 79.7 | Confident | 73 Ų | 73 | 46.1 Ų | 46.1 | 34% | 0.341 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -99.9 | -19.7 | -173.7 | -59.1 | -76.5 | 154.2 | 0 | 0 | 112.8 | K11 I277 | K11-E281 VanDerWaalsContact NZ-CD 3.33Å; K11-E281 IonicContact NZ-OE1 3Å; K11-E281 PolarHBondContact NZ-OE1 3.24Å; K11-E281 IonicContact NZ-OE2 2.92Å; K11-E281 PolarHBondContact NZ-OE2 3Å; I277-E281 HydrophobicContact CG2-CG 4Å; I277-E281 WeakPolarHBondContact O-CB 3.43Å; I277-E281 WeakPolarHBondContact O-CG 3.38Å; I277-E281 PolarHBondContact O-N 3.25Å |
| 282 | C | 74.6 | Confident | 79.2 | Confident | 16 Ų | 16 | 46.5 Ų | 46.5 | 11% | 0.108 | 26% | 0.26 | C | S | . | . | S | Bend | trans | -117.3 | 155.2 | -177.7 | -64.4 | 0 | 0 | 0 | 0 | 113.2 | T20 L278 T286 V287 | T20-C282 WeakPolarHBondContact CG2-SG 3.44Å; L278-C282 HydrophobicContact CD1-CB 4.25Å; L278-C282 HydrophobicContact CG-CB 4.43Å; L278-C282 WeakPolarHBondContact O-CA 3.31Å; L278-C282 WeakPolarHBondContact O-CB 3.47Å; L278-C282 PolarHBondContact O-N 3.46Å; C282-T286 HydrophobicContact CB-CG2 4.03Å; C282-V287 HydrophobicContact CB-CG2 4.31Å |
| 283 | P | 77.3 | Confident | 79 | Confident | 91 Ų | 91 | 48 Ų | 48 | 59% | 0.591 | 27% | 0.268 | S | S | * | . | trans | -55.9 | 148.4 | 166 | -22.7 | 33.6 | 0 | 0 | 0 | 111.6 | L285 T286 V287 | P283-L285 PolarHBondContact O-N 2.91Å; P283-T286 PolarHBondContact O-N 3.2Å; P283-V287 WeakPolarHBondContact O-CG2 3.42Å; P283-V287 PolarHBondContact O-N 3.2Å | ||
| 284 | S | 68.8 | Low | 79.1 | Confident | 96 Ų | 96 | 44 Ų | 44 | 67% | 0.671 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -53.9 | -31 | 179.3 | 53.5 | 0 | 0 | 0 | 0 | 113.4 | V287 T288 | S284-V287 PolarHBondContact O-N 3.31Å; S284-T288 WeakPolarHBondContact O-CB 3.26Å; S284-T288 PolarHBondContact O-N 2.96Å; S284-T288 PolarHBondContact O-OG1 2.83Å |
| 285 | L | 68.2 | Low | 78.7 | Confident | 51 Ų | 51 | 49.3 Ų | 49.3 | 27% | 0.267 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -61.5 | -50.3 | 175.1 | -179.9 | 66.8 | 0 | 0 | 0 | 112.3 | P283 V287 T288 L289 T329 V331 S334 | P283-L285 PolarHBondContact O-N 2.91Å; L285-V287 VanDerWaalsContact C-N 3.31Å; L285-V287 PolarHBondContact O-N 3.44Å; L285-T288 PolarHBondContact O-N 3.03Å; L285-L289 PolarHBondContact O-N 3.17Å; L285-T329 WeakPolarHBondContact CD1-O 3.33Å; L285-V331 HydrophobicContact CD1-CG2 3.93Å; L285-S334 WeakPolarHBondContact CD2-OG 3.33Å |
| 286 | T | 73.6 | Confident | 78.5 | Confident | 51 Ų | 51 | 50.1 Ų | 50.1 | 31% | 0.313 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -61.8 | -41.4 | 178.5 | -54.7 | 0 | 0 | 0 | 0 | 110.9 | C282 P283 T288 L289 V290 | C282-T286 HydrophobicContact CB-CG2 4.03Å; P283-T286 PolarHBondContact O-N 3.2Å; T286-T288 VanDerWaalsContact C-N 3.32Å; T286-T288 PolarHBondContact O-N 2.9Å; T286-L289 PolarHBondContact O-N 3.19Å; T286-V290 HydrophobicContact CG2-CG2 4.49Å; T286-V290 VanDerWaalsContact O-CG2 3.32Å; T286-V290 WeakPolarHBondContact O-CG2 3.32Å; T286-V290 PolarHBondContact O-N 2.95Å |
| 287 | V | 79.1 | Confident | 78.6 | Confident | 16 Ų | 16 | 50.7 Ų | 50.7 | 10% | 0.097 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -58 | -48.9 | 175 | -179.1 | 0 | 0 | 0 | 0 | 110.5 | L278 C282 P283 S284 L285 L289 V290 V291 | L278-V287 HydrophobicContact CB-CG2 4.49Å; L278-V287 HydrophobicContact CD2-CB 4.36Å; L278-V287 HydrophobicContact CD2-CG1 4.37Å; L278-V287 HydrophobicContact CD2-CG2 4.42Å; L278-V287 HydrophobicContact CG-CB 4.49Å; L278-V287 HydrophobicContact CG-CG2 4.01Å; L278-V287 VanDerWaalsContact O-CG2 3.3Å; L278-V287 WeakPolarHBondContact O-CG2 3.26Å; C282-V287 HydrophobicContact CB-CG2 4.31Å; P283-V287 WeakPolarHBondContact O-CG2 3.42Å; P283-V287 PolarHBondContact O-N 3.2Å; S284-V287 PolarHBondContact O-N 3.31Å; L285-V287 VanDerWaalsContact C-N 3.31Å; L285-V287 PolarHBondContact O-N 3.44Å; V287-L289 VanDerWaalsContact C-N 3.34Å; V287-L289 PolarHBondContact O-N 3.06Å; V287-V290 PolarHBondContact O-N 3.24Å; V287-V291 HydrophobicContact CG1-CG2 4.43Å; V287-V291 WeakPolarHBondContact O-CB 3.43Å; V287-V291 VanDerWaalsContact O-CG2 3.26Å; V287-V291 WeakPolarHBondContact O-CG2 3.43Å; V287-V291 PolarHBondContact O-N 3.45Å |
| 288 | T | 74.9 | Confident | 78.5 | Confident | 58 Ų | 58 | 48.7 Ų | 48.7 | 36% | 0.356 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -64.6 | -40.3 | -177.9 | -54.9 | 0 | 0 | 0 | 0 | 111.3 | S284 L285 T286 T292 T329 | S284-T288 WeakPolarHBondContact O-CB 3.26Å; S284-T288 PolarHBondContact O-N 2.96Å; S284-T288 PolarHBondContact O-OG1 2.83Å; L285-T288 PolarHBondContact O-N 3.03Å; T286-T288 VanDerWaalsContact C-N 3.32Å; T286-T288 PolarHBondContact O-N 2.9Å; T288-T292 VanDerWaalsContact O-CB 3.29Å; T288-T292 WeakPolarHBondContact O-CB 3.35Å; T288-T292 PolarHBondContact O-N 3.45Å; T288-T292 PolarHBondContact O-OG1 3.48Å; T288-T329 HydrophobicContact CG2-CG2 3.32Å |
| 289 | L | 77 | Confident | 78.4 | Confident | 39 Ų | 39 | 49.6 Ų | 49.6 | 20% | 0.204 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -60.3 | -55 | 174.7 | 177.5 | 56.7 | 0 | 0 | 0 | 111.5 | L285 T286 V287 V291 T292 L293 L326 V331 | L285-L289 PolarHBondContact O-N 3.17Å; T286-L289 PolarHBondContact O-N 3.19Å; V287-L289 VanDerWaalsContact C-N 3.34Å; V287-L289 PolarHBondContact O-N 3.06Å; L289-V291 VanDerWaalsContact C-N 3.31Å; L289-V291 PolarHBondContact O-N 2.93Å; L289-T292 WeakPolarHBondContact O-CB 3.28Å; L289-T292 PolarHBondContact O-N 2.9Å; L289-T292 VanDerWaalsContact O-N 3.07Å; L289-L293 HydrophobicContact CD1-CD1 3.89Å; L289-L293 HydrophobicContact CD1-CD2 4.36Å; L289-L293 HydrophobicContact CD1-CG 3.87Å; L289-L293 HydrophobicContact CG-CD1 3.97Å; L289-L293 HydrophobicContact CG-CG 4.33Å; L289-L293 WeakPolarHBondContact O-CG 3.47Å; L289-L293 PolarHBondContact O-N 3.17Å; L289-L326 HydrophobicContact CD1-CD2 3.8Å; L289-V331 HydrophobicContact CB-CG2 3.99Å; L289-V331 HydrophobicContact CD1-CB 4.36Å; L289-V331 HydrophobicContact CD1-CG1 3.63Å; L289-V331 HydrophobicContact CD1-CG2 3.91Å; L289-V331 HydrophobicContact CD2-CG1 3.95Å; L289-V331 HydrophobicContact CG-CG1 4.3Å; L289-V331 HydrophobicContact CG-CG2 4.39Å |
| 290 | V | 83 | Confident | 78.6 | Confident | 11 Ų | 11 | 48.9 Ų | 48.9 | 7% | 0.067 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -59.8 | -43.2 | -177.8 | 170.9 | 0 | 0 | 0 | 0 | 111 | V24 V27 F28 L278 T286 V287 T292 L293 R294 | V24-V290 HydrophobicContact CG1-CG1 4.43Å; V24-V290 HydrophobicContact CG2-CG1 4.44Å; V24-V290 HydrophobicContact CG2-CG2 3.95Å; V27-V290 HydrophobicContact CB-CG1 4.23Å; V27-V290 HydrophobicContact CG1-CG1 3.89Å; F28-V290 HydrophobicContact CE2-CG1 4.09Å; L278-V290 HydrophobicContact CD2-CB 3.59Å; L278-V290 HydrophobicContact CD2-CG1 3.66Å; L278-V290 HydrophobicContact CD2-CG2 3.95Å; T286-V290 HydrophobicContact CG2-CG2 4.49Å; T286-V290 VanDerWaalsContact O-CG2 3.32Å; T286-V290 WeakPolarHBondContact O-CG2 3.32Å; T286-V290 PolarHBondContact O-N 2.95Å; V287-V290 PolarHBondContact O-N 3.24Å; V290-T292 VanDerWaalsContact C-N 3.32Å; V290-T292 PolarHBondContact O-N 2.95Å; V290-L293 PolarHBondContact O-N 3.3Å; V290-R294 WeakPolarHBondContact O-CB 3.46Å; V290-R294 PolarHBondContact O-N 3.44Å |
| 291 | V | 82.9 | Confident | 78.9 | Confident | 26 Ų | 26 | 49 Ų | 49 | 16% | 0.158 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -64.6 | -36.9 | 176.7 | 171 | 0 | 0 | 0 | 0 | 111.8 | V275 V287 L289 K295 | V275-V291 HydrophobicContact CG1-CG2 4.46Å; V275-V291 HydrophobicContact CG2-CG2 4.35Å; V287-V291 HydrophobicContact CG1-CG2 4.43Å; V287-V291 WeakPolarHBondContact O-CB 3.43Å; V287-V291 VanDerWaalsContact O-CG2 3.26Å; V287-V291 WeakPolarHBondContact O-CG2 3.43Å; V287-V291 PolarHBondContact O-N 3.45Å; L289-V291 VanDerWaalsContact C-N 3.31Å; L289-V291 PolarHBondContact O-N 2.93Å; V291-K295 WeakPolarHBondContact O-CG 3.49Å; V291-K295 PolarHBondContact O-N 3.22Å; V291-K295 VanDerWaalsContact O-N 3.12Å |
| 292 | T | 81.4 | Confident | 78.9 | Confident | 17 Ų | 17 | 45.6 Ų | 45.6 | 10% | 0.104 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -68.3 | -49.4 | 176.9 | -60.6 | 0 | 0 | 0 | 0 | 111.3 | T288 L289 V290 R294 K295 F296 F322 T325 L326 | T288-T292 VanDerWaalsContact O-CB 3.29Å; T288-T292 WeakPolarHBondContact O-CB 3.35Å; T288-T292 PolarHBondContact O-N 3.45Å; T288-T292 PolarHBondContact O-OG1 3.48Å; L289-T292 WeakPolarHBondContact O-CB 3.28Å; L289-T292 PolarHBondContact O-N 2.9Å; L289-T292 VanDerWaalsContact O-N 3.07Å; V290-T292 VanDerWaalsContact C-N 3.32Å; V290-T292 PolarHBondContact O-N 2.95Å; T292-R294 VanDerWaalsContact C-N 3.3Å; T292-R294 PolarHBondContact O-N 2.66Å; T292-K295 PolarHBondContact O-N 2.94Å; T292-F296 PolarHBondContact O-N 3.43Å; T292-F322 HydrophobicContact CG2-CD2 4.37Å; T292-F322 HydrophobicContact CG2-CE2 4.06Å; T292-T325 HydrophobicContact CG2-CG2 3.59Å; T292-L326 HydrophobicContact CG2-CD2 4.27Å |
| 293 | L | 82.8 | Confident | 79 | Confident | 60 Ų | 60 | 45.3 Ų | 45.3 | 31% | 0.314 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -58.3 | -44.6 | 177.1 | -69.4 | 178.4 | 0 | 0 | 0 | 111.2 | F28 L289 V290 K295 F296 V297 F322 | F28-L293 HydrophobicContact CZ-CB 3.86Å; L289-L293 HydrophobicContact CD1-CD1 3.89Å; L289-L293 HydrophobicContact CD1-CD2 4.36Å; L289-L293 HydrophobicContact CD1-CG 3.87Å; L289-L293 HydrophobicContact CG-CD1 3.97Å; L289-L293 HydrophobicContact CG-CG 4.33Å; L289-L293 WeakPolarHBondContact O-CG 3.47Å; L289-L293 PolarHBondContact O-N 3.17Å; V290-L293 PolarHBondContact O-N 3.3Å; L293-K295 PolarHBondContact O-N 3.37Å; L293-F296 WeakPolarHBondContact O-CB 3.49Å; L293-F296 PolarHBondContact O-N 2.85Å; L293-V297 WeakPolarHBondContact O-CG2 3.32Å; L293-V297 PolarHBondContact O-N 2.9Å; L293-F322 HydrophobicContact CD2-CE2 4.31Å; L293-F322 HydrophobicContact CD2-CZ 3.76Å |
| 294 | R | 86.6 | Confident | 79.2 | Confident | 38 Ų | 38 | 45.9 Ų | 45.9 | 14% | 0.143 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -56.8 | -47.8 | 175.2 | 176.8 | -161.1 | 92.3 | -178.4 | -3.1 | 113 | V27 F28 C31 V275 V290 T292 F296 V297 S298 | V27-R294 HydrophobicContact CG1-CB 4.38Å; V27-R294 HydrophobicContact CG1-CG 4.15Å; F28-R294 HydrophobicContact CD1-CB 4.47Å; F28-R294 HydrophobicContact CE1-CB 4.15Å; F28-R294 HydrophobicContact CZ-CB 4.36Å; C31-R294 VanDerWaalsContact CB-CD 3.41Å; C31-R294 HydrophobicContact CB-CG 3.85Å; C31-R294 WeakPolarHBondContact SG-CD 3.44Å; C31-R294 PolarHBondContact SG-NH1 3.49Å; V275-R294 VanDerWaalsContact CG2-NH1 3.27Å; V290-R294 WeakPolarHBondContact O-CB 3.46Å; V290-R294 PolarHBondContact O-N 3.44Å; T292-R294 VanDerWaalsContact C-N 3.3Å; T292-R294 PolarHBondContact O-N 2.66Å; R294-F296 VanDerWaalsContact C-N 3.28Å; R294-F296 PolarHBondContact O-N 3.42Å; R294-V297 PolarHBondContact O-N 2.96Å; R294-S298 WeakPolarHBondContact O-CB 3.48Å; R294-S298 PolarHBondContact O-N 2.92Å; R294-S298 PolarHBondContact O-OG 2.94Å |
| 295 | K | 80.8 | Confident | 79.7 | Confident | 111 Ų | 111 | 48.1 Ų | 48.1 | 48% | 0.483 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -59.3 | -42.7 | 177.1 | -75.7 | 176.4 | 179.3 | -177.2 | 0 | 111 | V291 T292 L293 S298 L299 | V291-K295 WeakPolarHBondContact O-CG 3.49Å; V291-K295 PolarHBondContact O-N 3.22Å; V291-K295 VanDerWaalsContact O-N 3.12Å; T292-K295 PolarHBondContact O-N 2.94Å; L293-K295 PolarHBondContact O-N 3.37Å; K295-S298 PolarHBondContact O-N 3.22Å; K295-L299 WeakPolarHBondContact O-CB 3.39Å; K295-L299 PolarHBondContact O-N 3.26Å |
| 296 | F | 82.5 | Confident | 80 | Confident | 51 Ų | 51 | 46 Ų | 46 | 22% | 0.224 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -66.5 | -46.2 | 178.8 | -176.9 | -109.2 | 0 | 0 | 0 | 112.6 | T292 L293 R294 S298 L299 I300 T318 F322 | T292-F296 PolarHBondContact O-N 3.43Å; L293-F296 WeakPolarHBondContact O-CB 3.49Å; L293-F296 PolarHBondContact O-N 2.85Å; R294-F296 VanDerWaalsContact C-N 3.28Å; R294-F296 PolarHBondContact O-N 3.42Å; F296-S298 VanDerWaalsContact C-N 3.32Å; F296-S298 PolarHBondContact O-N 3.48Å; F296-L299 WeakPolarHBondContact O-CB 3.49Å; F296-L299 PolarHBondContact O-N 3.33Å; F296-I300 HydrophobicContact CD1-CD1 3.8Å; F296-I300 HydrophobicContact CE1-CD1 3.29Å; F296-I300 HydrophobicContact CE1-CG1 4.32Å; F296-I300 HydrophobicContact CE2-CD1 4.25Å; F296-I300 HydrophobicContact CG-CD1 4.48Å; F296-I300 HydrophobicContact CZ-CD1 3.56Å; F296-I300 HydrophobicContact CZ-CG1 4.3Å; F296-I300 WeakPolarHBondContact O-CG1 3.4Å; F296-I300 PolarHBondContact O-N 3.37Å; F296-T318 HydrophobicContact CE2-CG2 4.21Å; F296-F322 HydrophobicContact CB-CD2 3.67Å; F296-F322 HydrophobicContact CB-CE2 3.4Å; F296-F322 VanDerWaalsContact CB-CE2 3.4Å; F296-F322 HydrophobicContact CB-CZ 4.25Å; F296-F322 HydrophobicContact CD1-CD2 4.23Å; F296-F322 HydrophobicContact CD1-CE1 4.3Å; F296-F322 AromaticContact CD1-CE2 3.85Å; F296-F322 HydrophobicContact CD1-CE2 3.85Å; F296-F322 AromaticContact CD1-CZ 3.87Å; F296-F322 HydrophobicContact CD1-CZ 3.87Å; F296-F322 HydrophobicContact CD2-CB 4.09Å; F296-F322 HydrophobicContact CD2-CD1 4.41Å; F296-F322 AromaticContact CD2-CD2 3.49Å; F296-F322 HydrophobicContact CD2-CD2 3.49Å; F296-F322 VanDerWaalsContact CD2-CD2 3.49Å; F296-F322 AromaticContact CD2-CE2 3.94Å; F296-F322 HydrophobicContact CD2-CE2 3.94Å; F296-F322 AromaticContact CD2-CG 3.74Å; F296-F322 HydrophobicContact CD2-CG 3.74Å; F296-F322 HydrophobicContact CE1-CE1 4.3Å; F296-F322 HydrophobicContact CE1-CZ 4.31Å; F296-F322 HydrophobicContact CE2-CB 4.07Å; F296-F322 HydrophobicContact CE2-CD1 4.27Å; F296-F322 HydrophobicContact CE2-CD2 4.13Å; F296-F322 AromaticContact CE2-CG 3.9Å; F296-F322 HydrophobicContact CE2-CG 3.9Å; F296-F322 AromaticContact CG-CD2 3.54Å; F296-F322 HydrophobicContact CG-CD2 3.54Å; F296-F322 AromaticContact CG-CE2 3.46Å; F296-F322 HydrophobicContact CG-CE2 3.46Å; F296-F322 VanDerWaalsContact CG-CE2 3.46Å; F296-F322 HydrophobicContact CG-CG 4.12Å; F296-F322 AromaticContact CG-CZ 3.98Å; F296-F322 HydrophobicContact CG-CZ 3.98Å; F296-F322 HydrophobicContact CZ-CD1 4.32Å; F296-F322 HydrophobicContact CZ-CG 4.4Å |
| 297 | V | 84.6 | Confident | 80.1 | Confident | 64 Ų | 64 | 51 Ų | 51 | 39% | 0.388 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -61.7 | -41.8 | 175.3 | 170.5 | 0 | 0 | 0 | 0 | 111.1 | F28 L293 R294 L299 I300 F301 | F28-V297 HydrophobicContact CE1-CB 4.21Å; F28-V297 HydrophobicContact CE1-CG2 4.02Å; L293-V297 WeakPolarHBondContact O-CG2 3.32Å; L293-V297 PolarHBondContact O-N 2.9Å; R294-V297 PolarHBondContact O-N 2.96Å; V297-L299 VanDerWaalsContact C-N 3.32Å; V297-L299 PolarHBondContact O-N 3.37Å; V297-I300 PolarHBondContact O-N 3.42Å; V297-F301 WeakPolarHBondContact O-CB 3.5Å; V297-F301 PolarHBondContact O-N 3.03Å |
| 298 | S | 80.1 | Confident | 79.6 | Confident | 11 Ų | 11 | 51.6 Ų | 51.6 | 8% | 0.077 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -62.8 | -39.3 | 176.3 | -56.6 | 0 | 0 | 0 | 0 | 111.7 | R294 K295 F296 S302 | R294-S298 WeakPolarHBondContact O-CB 3.48Å; R294-S298 PolarHBondContact O-N 2.92Å; R294-S298 PolarHBondContact O-OG 2.94Å; K295-S298 PolarHBondContact O-N 3.22Å; F296-S298 VanDerWaalsContact C-N 3.32Å; F296-S298 PolarHBondContact O-N 3.48Å; S298-S302 VanDerWaalsContact O-CB 3.28Å; S298-S302 WeakPolarHBondContact O-CB 3.37Å; S298-S302 PolarHBondContact O-N 2.75Å |
| 299 | L | 79.2 | Confident | 79.3 | Confident | 19 Ų | 19 | 53 Ų | 53 | 10% | 0.099 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -65.2 | -47.2 | 175.2 | 177.7 | 66.4 | 0 | 0 | 0 | 111.5 | M111 K295 F296 V297 F301 S302 I303 T318 | M111-L299 HydrophobicContact SD-CD1 3.8Å; K295-L299 WeakPolarHBondContact O-CB 3.39Å; K295-L299 PolarHBondContact O-N 3.26Å; F296-L299 WeakPolarHBondContact O-CB 3.49Å; F296-L299 PolarHBondContact O-N 3.33Å; V297-L299 VanDerWaalsContact C-N 3.32Å; V297-L299 PolarHBondContact O-N 3.37Å; L299-F301 VanDerWaalsContact C-N 3.33Å; L299-F301 PolarHBondContact O-N 2.99Å; L299-S302 WeakPolarHBondContact O-CB 3.29Å; L299-S302 PolarHBondContact O-N 3.35Å; L299-I303 HydrophobicContact CD1-CD1 4.01Å; L299-I303 HydrophobicContact CD1-CG1 4.37Å; L299-I303 HydrophobicContact CG-CD1 3.89Å; L299-I303 WeakPolarHBondContact O-CG1 3.4Å; L299-I303 PolarHBondContact O-N 3.22Å; L299-T318 HydrophobicContact CD2-CG2 3.6Å |
| 300 | I | 82.3 | Confident | 79.1 | Confident | 47 Ų | 47 | 52.7 Ų | 52.7 | 24% | 0.241 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -58.9 | -47.4 | 176.8 | -71.4 | 175.6 | 0 | 0 | 0 | 110.3 | F296 V297 S302 I303 L304 W315 | F296-I300 HydrophobicContact CD1-CD1 3.8Å; F296-I300 HydrophobicContact CE1-CD1 3.29Å; F296-I300 HydrophobicContact CE1-CG1 4.32Å; F296-I300 HydrophobicContact CE2-CD1 4.25Å; F296-I300 HydrophobicContact CG-CD1 4.48Å; F296-I300 HydrophobicContact CZ-CD1 3.56Å; F296-I300 HydrophobicContact CZ-CG1 4.3Å; F296-I300 WeakPolarHBondContact O-CG1 3.4Å; F296-I300 PolarHBondContact O-N 3.37Å; V297-I300 PolarHBondContact O-N 3.42Å; I300-S302 VanDerWaalsContact C-N 3.31Å; I300-S302 PolarHBondContact O-N 2.98Å; I300-I303 PolarHBondContact O-N 3.49Å; I300-L304 HydrophobicContact CG2-CD1 3.6Å; I300-L304 HydrophobicContact CG2-CG 4.14Å; I300-L304 WeakPolarHBondContact O-CB 3.42Å; I300-L304 WeakPolarHBondContact O-CG 3.26Å; I300-L304 PolarHBondContact O-N 2.87Å; I300-W315 HydrophobicContact CG1-CH2 4.18Å; I300-W315 HydrophobicContact CG1-CZ3 4.14Å |
| 301 | F | 81.7 | Confident | 79.1 | Confident | 83 Ų | 83 | 54.2 Ų | 54.2 | 36% | 0.364 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -60 | -44.2 | 177 | -171.8 | -84 | 0 | 0 | 0 | 111 | V36 V297 L299 I303 L304 Y305 F306 | V36-F301 HydrophobicContact CB-CE1 4.42Å; V36-F301 HydrophobicContact CG1-CE1 4.41Å; V36-F301 HydrophobicContact CG2-CD1 3.59Å; V36-F301 HydrophobicContact CG2-CE1 3.22Å; V36-F301 HydrophobicContact CG2-CZ 3.98Å; V297-F301 WeakPolarHBondContact O-CB 3.5Å; V297-F301 PolarHBondContact O-N 3.03Å; L299-F301 VanDerWaalsContact C-N 3.33Å; L299-F301 PolarHBondContact O-N 2.99Å; F301-I303 VanDerWaalsContact C-N 3.31Å; F301-I303 PolarHBondContact O-N 3.47Å; F301-L304 PolarHBondContact O-N 2.9Å; F301-Y305 AromaticContact CE1-CD1 3.91Å; F301-Y305 HydrophobicContact CE1-CD1 3.91Å; F301-Y305 HydrophobicContact CE1-CD2 4.25Å; F301-Y305 AromaticContact CE1-CG 3.64Å; F301-Y305 HydrophobicContact CE1-CG 3.64Å; F301-Y305 HydrophobicContact CE2-CD2 4.49Å; F301-Y305 HydrophobicContact CZ-CD1 4.23Å; F301-Y305 AromaticContact CZ-CD2 3.78Å; F301-Y305 HydrophobicContact CZ-CD2 3.78Å; F301-Y305 HydrophobicContact CZ-CE2 4.45Å; F301-Y305 AromaticContact CZ-CG 3.65Å; F301-Y305 HydrophobicContact CZ-CG 3.65Å; F301-Y305 VanDerWaalsContact O-CB 3.22Å; F301-Y305 WeakPolarHBondContact O-CB 3.28Å; F301-Y305 PolarHBondContact O-N 3.4Å; F301-F306 HydrophobicContact CD1-CE2 4.33Å; F301-F306 HydrophobicContact CE1-CE2 4.07Å |
| 302 | S | 75.2 | Confident | 79.3 | Confident | 2 Ų | 2 | 56.6 Ų | 56.6 | 1% | 0.014 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -59.2 | -39.4 | 176.2 | 177.7 | 0 | 0 | 0 | 0 | 112.4 | S298 L299 I300 F306 N308 | S298-S302 VanDerWaalsContact O-CB 3.28Å; S298-S302 WeakPolarHBondContact O-CB 3.37Å; S298-S302 PolarHBondContact O-N 2.75Å; L299-S302 WeakPolarHBondContact O-CB 3.29Å; L299-S302 PolarHBondContact O-N 3.35Å; I300-S302 VanDerWaalsContact C-N 3.31Å; I300-S302 PolarHBondContact O-N 2.98Å; S302-F306 VanDerWaalsContact O-CB 3.29Å; S302-F306 WeakPolarHBondContact O-CB 3.25Å; S302-F306 PolarHBondContact O-N 3.39Å; S302-N308 PolarHBondContact O-ND2 2.91Å; S302-N308 VanDerWaalsContact O-ND2 3.17Å |
| 303 | I | 77.6 | Confident | 79.5 | Confident | 10 Ų | 10 | 62.8 Ų | 62.8 | 5% | 0.051 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -71.7 | -49.3 | 178 | -65.6 | 160.6 | 0 | 0 | 0 | 110.9 | L299 I300 F301 Q307 N308 F310 W315 | L299-I303 HydrophobicContact CD1-CD1 4.01Å; L299-I303 HydrophobicContact CD1-CG1 4.37Å; L299-I303 HydrophobicContact CG-CD1 3.89Å; L299-I303 WeakPolarHBondContact O-CG1 3.4Å; L299-I303 PolarHBondContact O-N 3.22Å; I300-I303 PolarHBondContact O-N 3.49Å; F301-I303 VanDerWaalsContact C-N 3.31Å; F301-I303 PolarHBondContact O-N 3.47Å; I303-Q307 WeakPolarHBondContact O-CA 3.46Å; I303-Q307 PolarHBondContact O-N 3.45Å; I303-N308 PolarHBondContact O-N 3.17Å; I303-F310 HydrophobicContact CD1-CD1 4.1Å; I303-F310 HydrophobicContact CD1-CD2 3.7Å; I303-F310 HydrophobicContact CD1-CE1 3.86Å; I303-F310 HydrophobicContact CD1-CE2 3.49Å; I303-F310 VanDerWaalsContact CD1-CE2 3.49Å; I303-F310 HydrophobicContact CD1-CG 3.98Å; I303-F310 HydrophobicContact CD1-CZ 3.54Å; I303-F310 HydrophobicContact CG1-CD2 3.98Å; I303-F310 HydrophobicContact CG1-CE2 4.21Å; I303-F310 HydrophobicContact CG1-CG 4.24Å; I303-F310 HydrophobicContact CG2-CB 3.79Å; I303-F310 HydrophobicContact CG2-CD1 4.32Å; I303-F310 HydrophobicContact CG2-CG 4.01Å; I303-W315 HydrophobicContact CD1-CH2 4.45Å; I303-W315 HydrophobicContact CG2-CZ2 4Å |
| 304 | L | 80.9 | Confident | 79.4 | Confident | 102 Ų | 102 | 60.1 Ų | 60.1 | 53% | 0.534 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -74.5 | -45.2 | -172 | -65.2 | 180 | 0 | 0 | 0 | 113.3 | I300 F301 Q307 | I300-L304 HydrophobicContact CG2-CD1 3.6Å; I300-L304 HydrophobicContact CG2-CG 4.14Å; I300-L304 WeakPolarHBondContact O-CB 3.42Å; I300-L304 WeakPolarHBondContact O-CG 3.26Å; I300-L304 PolarHBondContact O-N 2.87Å; F301-L304 PolarHBondContact O-N 2.9Å; L304-Q307 PolarHBondContact O-NE2 2.66Å |
| 305 | Y | 80.2 | Confident | 79.4 | Confident | 144 Ų | 144 | 62.9 Ų | 62.9 | 57% | 0.565 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -75.5 | -41.5 | -175.6 | -177 | -96.3 | 0 | 0 | 0 | 111.5 | F301 | F301-Y305 AromaticContact CE1-CD1 3.91Å; F301-Y305 HydrophobicContact CE1-CD1 3.91Å; F301-Y305 HydrophobicContact CE1-CD2 4.25Å; F301-Y305 AromaticContact CE1-CG 3.64Å; F301-Y305 HydrophobicContact CE1-CG 3.64Å; F301-Y305 HydrophobicContact CE2-CD2 4.49Å; F301-Y305 HydrophobicContact CZ-CD1 4.23Å; F301-Y305 AromaticContact CZ-CD2 3.78Å; F301-Y305 HydrophobicContact CZ-CD2 3.78Å; F301-Y305 HydrophobicContact CZ-CE2 4.45Å; F301-Y305 AromaticContact CZ-CG 3.65Å; F301-Y305 HydrophobicContact CZ-CG 3.65Å; F301-Y305 VanDerWaalsContact O-CB 3.22Å; F301-Y305 WeakPolarHBondContact O-CB 3.28Å; F301-Y305 PolarHBondContact O-N 3.4Å |
| 306 | F | 73.7 | Confident | 79.9 | Confident | 6 Ų | 6 | 60.9 Ų | 60.9 | 3% | 0.026 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -94.4 | -3 | -174.1 | -67.2 | -77.7 | 0 | 0 | 0 | 112.8 | V36 E39 L40 R43 F301 S302 N308 | V36-F306 HydrophobicContact CG1-CZ 4.14Å; E39-F306 HydrophobicContact CB-CD1 4.43Å; E39-F306 HydrophobicContact CB-CD2 4.28Å; E39-F306 HydrophobicContact CB-CE1 3.9Å; E39-F306 HydrophobicContact CB-CE2 3.74Å; E39-F306 HydrophobicContact CB-CZ 3.52Å; E39-F306 HydrophobicContact CG-CB 4.38Å; E39-F306 HydrophobicContact CG-CD1 3.56Å; E39-F306 HydrophobicContact CG-CD2 3.69Å; E39-F306 HydrophobicContact CG-CE1 3.52Å; E39-F306 HydrophobicContact CG-CE2 3.65Å; E39-F306 HydrophobicContact CG-CG 3.62Å; E39-F306 HydrophobicContact CG-CZ 3.56Å; L40-F306 HydrophobicContact CD2-CE1 4Å; L40-F306 HydrophobicContact CG-CE1 4.28Å; L40-F306 HydrophobicContact CG-CZ 4.38Å; R43-F306 VanDerWaalsContact CZ-CB 3.4Å; R43-F306 VanDerWaalsContact CZ-O 3.3Å; R43-F306 PolarHBondContact NH1-O 3.29Å; R43-F306 VanDerWaalsContact NH2-CB 3.35Å; R43-F306 PolarHBondContact NH2-O 2.87Å; F301-F306 HydrophobicContact CD1-CE2 4.33Å; F301-F306 HydrophobicContact CE1-CE2 4.07Å; S302-F306 VanDerWaalsContact O-CB 3.29Å; S302-F306 WeakPolarHBondContact O-CB 3.25Å; S302-F306 PolarHBondContact O-N 3.39Å; F306-N308 VanDerWaalsContact C-N 3.25Å; F306-N308 PolarHBondContact O-N 3.29Å |
| 307 | Q | 75.4 | Confident | 80.2 | Confident | 156 Ų | 156 | 58.4 Ų | 58.4 | 73% | 0.729 | 30% | 0.295 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.9 | 38.6 | 175 | -59 | -70.7 | -42.2 | 0 | 0 | 112.5 | I303 L304 | I303-Q307 WeakPolarHBondContact O-CA 3.46Å; I303-Q307 PolarHBondContact O-N 3.45Å; L304-Q307 PolarHBondContact O-NE2 2.66Å |
| 308 | N | 69.3 | Low | 80.2 | Confident | 28 Ų | 28 | 55.7 Ų | 55.7 | 15% | 0.15 | 28% | 0.279 | C | S | . | . | trans | -64.6 | 140.1 | 177.2 | -79.6 | -60 | 0 | 0 | 0 | 110.1 | E39 P108 S302 I303 F306 F310 | E39-N308 PolarHBondContact OE1-ND2 3.04Å; P108-N308 HydrophobicContact CG-CB 4.4Å; S302-N308 PolarHBondContact O-ND2 2.91Å; S302-N308 VanDerWaalsContact O-ND2 3.17Å; I303-N308 PolarHBondContact O-N 3.17Å; F306-N308 VanDerWaalsContact C-N 3.25Å; F306-N308 PolarHBondContact O-N 3.29Å; N308-F310 PolarHBondContact O-N 3.47Å | ||
| 309 | P | 67.6 | Low | 80.6 | Confident | 89 Ų | 89 | 57.2 Ų | 57.2 | 58% | 0.578 | 29% | 0.292 | S | S | * | . | trans | -62.2 | 112.5 | -175.9 | 24.6 | -33.3 | 0 | 0 | 0 | 110.3 | ||||
| 310 | F | 73.3 | Confident | 81.2 | Confident | 32 Ų | 32 | 57.8 Ų | 57.8 | 14% | 0.14 | 30% | 0.296 | C | S | . | . | trans | -143.5 | 106 | -172.8 | -154 | -94.5 | 0 | 0 | 0 | 110.7 | P108 I303 N308 H314 W315 T318 | P108-F310 HydrophobicContact CB-CD2 4.09Å; P108-F310 HydrophobicContact CB-CE2 3.98Å; P108-F310 HydrophobicContact CG-CD2 4.4Å; I303-F310 HydrophobicContact CD1-CD1 4.1Å; I303-F310 HydrophobicContact CD1-CD2 3.7Å; I303-F310 HydrophobicContact CD1-CE1 3.86Å; I303-F310 HydrophobicContact CD1-CE2 3.49Å; I303-F310 VanDerWaalsContact CD1-CE2 3.49Å; I303-F310 HydrophobicContact CD1-CG 3.98Å; I303-F310 HydrophobicContact CD1-CZ 3.54Å; I303-F310 HydrophobicContact CG1-CD2 3.98Å; I303-F310 HydrophobicContact CG1-CE2 4.21Å; I303-F310 HydrophobicContact CG1-CG 4.24Å; I303-F310 HydrophobicContact CG2-CB 3.79Å; I303-F310 HydrophobicContact CG2-CD1 4.32Å; I303-F310 HydrophobicContact CG2-CG 4.01Å; N308-F310 PolarHBondContact O-N 3.47Å; F310-H314 HydrophobicContact CD1-CB 3.63Å; F310-H314 HydrophobicContact CD2-CB 3.78Å; F310-H314 HydrophobicContact CE1-CB 3.49Å; F310-H314 VanDerWaalsContact CE1-CB 3.49Å; F310-H314 HydrophobicContact CE2-CB 3.61Å; F310-H314 HydrophobicContact CG-CB 3.81Å; F310-H314 HydrophobicContact CZ-CB 3.49Å; F310-H314 VanDerWaalsContact CZ-CB 3.49Å; F310-H314 WeakPolarHBondContact CZ-O 3.26Å; F310-W315 AromaticContact CD1-CD1 3.49Å; F310-W315 VanDerWaalsContact CD1-CD1 3.49Å; F310-W315 AromaticContact CD1-CD2 3.98Å; F310-W315 HydrophobicContact CD1-CD2 3.98Å; F310-W315 AromaticContact CD1-CE2 3.71Å; F310-W315 AromaticContact CD1-CG 3.85Å; F310-W315 HydrophobicContact CD1-CG 3.85Å; F310-W315 HydrophobicContact CD1-CZ2 4.39Å; F310-W315 AromaticContact CD1-NE1 3.41Å; F310-W315 HydrophobicContact CE1-CB 4.15Å; F310-W315 AromaticContact CE1-CD1 3.73Å; F310-W315 AromaticContact CE1-CD2 3.59Å; F310-W315 HydrophobicContact CE1-CD2 3.59Å; F310-W315 AromaticContact CE1-CE2 3.77Å; F310-W315 HydrophobicContact CE1-CE3 4.16Å; F310-W315 AromaticContact CE1-CG 3.57Å; F310-W315 HydrophobicContact CE1-CG 3.57Å; F310-W315 HydrophobicContact CE1-CZ2 4.45Å; F310-W315 AromaticContact CE1-NE1 3.85Å; F310-T318 WeakPolarHBondContact CZ-OG1 3.29Å | ||
| 311 | T | 83.2 | Confident | 81.5 | Confident | 42 Ų | 42 | 56 Ų | 56 | 26% | 0.258 | 29% | 0.287 | S | S | . | . | trans | -78.7 | 164.3 | -177.4 | 72.8 | 0 | 0 | 0 | 0 | 111.8 | W313 H314 W315 | T311-W313 PolarHBondContact O-N 2.89Å; T311-W313 VanDerWaalsContact O-N 3.13Å; T311-H314 PolarHBondContact N-ND1 3.49Å; T311-H314 WeakPolarHBondContact O-CB 3.32Å; T311-H314 PolarHBondContact O-N 3.26Å; T311-H314 PolarHBondContact OG1-ND1 2.9Å; T311-W315 PolarHBondContact O-N 3.1Å | ||
| 312 | A | 86.1 | Confident | 81.7 | Confident | 76 Ų | 76 | 53.7 Ų | 53.7 | 63% | 0.628 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -53.5 | -34 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | W315 V316 | A312-W315 WeakPolarHBondContact O-CB 3.46Å; A312-W315 PolarHBondContact O-N 2.91Å; A312-V316 PolarHBondContact O-N 3.2Å; A312-V316 VanDerWaalsContact O-N 3.11Å |
| 313 | W | 85.4 | Confident | 82.4 | Confident | 148 Ų | 148 | 58.2 Ų | 58.2 | 56% | 0.561 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -70.9 | -31.4 | 176.6 | -70.1 | 109.2 | 0 | 0 | 0 | 113.7 | I150 M154 T311 W315 V316 G317 | I150-W313 HydrophobicContact CG2-CE3 4.44Å; M154-W313 HydrophobicContact CE-CB 4.02Å; M154-W313 HydrophobicContact CE-CG 4.07Å; M154-W313 HydrophobicContact CG-CB 3.47Å; M154-W313 VanDerWaalsContact CG-CB 3.47Å; M154-W313 HydrophobicContact CG-CG 4.16Å; M154-W313 HydrophobicContact SD-CB 3.77Å; M154-W313 HydrophobicContact SD-CG 3.8Å; T311-W313 PolarHBondContact O-N 2.89Å; T311-W313 VanDerWaalsContact O-N 3.13Å; W313-W315 VanDerWaalsContact C-N 3.28Å; W313-W315 PolarHBondContact O-N 3.38Å; W313-V316 PolarHBondContact O-N 2.75Å; W313-G317 PolarHBondContact O-N 2.88Å |
| 314 | H | 82.5 | Confident | 82.9 | Confident | 4 Ų | 4 | 57.8 Ų | 57.8 | 2% | 0.019 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -65.9 | -34 | 171.6 | -67.8 | 96.4 | 0 | 0 | 0 | 111.1 | S155 Q158 F310 T311 T318 | S155-H314 PolarHBondContact OG-NE2 3.36Å; S155-H314 VanDerWaalsContact OG-NE2 3.1Å; Q158-H314 PolarHBondContact OE1-CE1 2.92Å; F310-H314 HydrophobicContact CD1-CB 3.63Å; F310-H314 HydrophobicContact CD2-CB 3.78Å; F310-H314 HydrophobicContact CE1-CB 3.49Å; F310-H314 VanDerWaalsContact CE1-CB 3.49Å; F310-H314 HydrophobicContact CE2-CB 3.61Å; F310-H314 HydrophobicContact CG-CB 3.81Å; F310-H314 HydrophobicContact CZ-CB 3.49Å; F310-H314 VanDerWaalsContact CZ-CB 3.49Å; F310-H314 WeakPolarHBondContact CZ-O 3.26Å; T311-H314 PolarHBondContact N-ND1 3.49Å; T311-H314 WeakPolarHBondContact O-CB 3.32Å; T311-H314 PolarHBondContact O-N 3.26Å; T311-H314 PolarHBondContact OG1-ND1 2.9Å; H314-T318 WeakPolarHBondContact O-CB 3.36Å; H314-T318 PolarHBondContact O-N 3.28Å; H314-T318 PolarHBondContact O-OG1 3.42Å |
| 315 | W | 86.2 | Confident | 83.1 | Confident | 96 Ų | 96 | 53.6 Ų | 53.6 | 36% | 0.364 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -64.3 | -45.9 | 172.6 | -78.7 | 108 | 0 | 0 | 0 | 112 | I300 I303 F310 T311 A312 W313 T318 A319 | I300-W315 HydrophobicContact CG1-CH2 4.18Å; I300-W315 HydrophobicContact CG1-CZ3 4.14Å; I303-W315 HydrophobicContact CD1-CH2 4.45Å; I303-W315 HydrophobicContact CG2-CZ2 4Å; F310-W315 AromaticContact CD1-CD1 3.49Å; F310-W315 VanDerWaalsContact CD1-CD1 3.49Å; F310-W315 AromaticContact CD1-CD2 3.98Å; F310-W315 HydrophobicContact CD1-CD2 3.98Å; F310-W315 AromaticContact CD1-CE2 3.71Å; F310-W315 AromaticContact CD1-CG 3.85Å; F310-W315 HydrophobicContact CD1-CG 3.85Å; F310-W315 HydrophobicContact CD1-CZ2 4.39Å; F310-W315 AromaticContact CD1-NE1 3.41Å; F310-W315 HydrophobicContact CE1-CB 4.15Å; F310-W315 AromaticContact CE1-CD1 3.73Å; F310-W315 AromaticContact CE1-CD2 3.59Å; F310-W315 HydrophobicContact CE1-CD2 3.59Å; F310-W315 AromaticContact CE1-CE2 3.77Å; F310-W315 HydrophobicContact CE1-CE3 4.16Å; F310-W315 AromaticContact CE1-CG 3.57Å; F310-W315 HydrophobicContact CE1-CG 3.57Å; F310-W315 HydrophobicContact CE1-CZ2 4.45Å; F310-W315 AromaticContact CE1-NE1 3.85Å; T311-W315 PolarHBondContact O-N 3.1Å; A312-W315 WeakPolarHBondContact O-CB 3.46Å; A312-W315 PolarHBondContact O-N 2.91Å; W313-W315 VanDerWaalsContact C-N 3.28Å; W313-W315 PolarHBondContact O-N 3.38Å; W315-T318 PolarHBondContact O-N 3.44Å; W315-A319 WeakPolarHBondContact O-CB 3.22Å; W315-A319 PolarHBondContact O-N 3.16Å |
| 316 | V | 90.4 | Very high | 83.4 | Confident | 68 Ų | 68 | 48.3 Ų | 48.3 | 41% | 0.412 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -59.3 | -52 | 176 | 174.8 | 0 | 0 | 0 | 0 | 110.5 | A312 W313 T318 A319 V320 | A312-V316 PolarHBondContact O-N 3.2Å; A312-V316 VanDerWaalsContact O-N 3.11Å; W313-V316 PolarHBondContact O-N 2.75Å; V316-T318 VanDerWaalsContact C-N 3.33Å; V316-T318 PolarHBondContact O-N 3.01Å; V316-A319 PolarHBondContact O-N 3.1Å; V316-V320 VanDerWaalsContact O-CG2 3.29Å; V316-V320 WeakPolarHBondContact O-CG2 3.34Å; V316-V320 PolarHBondContact O-N 3.43Å |
| 317 | G | 88.3 | Confident | 84 | Confident | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -60.2 | -42.2 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | G147 W313 V320 V321 | G147-G317 WeakPolarHBondContact CA-O 3.3Å; W313-G317 PolarHBondContact O-N 2.88Å; G317-V320 PolarHBondContact O-N 3.46Å; G317-V321 WeakPolarHBondContact O-CG2 3.37Å; G317-V321 PolarHBondContact O-N 3.27Å |
| 318 | T | 85.4 | Confident | 84.3 | Confident | 7 Ų | 7 | 44.2 Ų | 44.2 | 4% | 0.043 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -64.7 | -41.5 | 177.4 | -61 | 0 | 0 | 0 | 0 | 112.5 | F296 L299 F310 H314 W315 V316 V320 V321 F322 | F296-T318 HydrophobicContact CE2-CG2 4.21Å; L299-T318 HydrophobicContact CD2-CG2 3.6Å; F310-T318 WeakPolarHBondContact CZ-OG1 3.29Å; H314-T318 WeakPolarHBondContact O-CB 3.36Å; H314-T318 PolarHBondContact O-N 3.28Å; H314-T318 PolarHBondContact O-OG1 3.42Å; W315-T318 PolarHBondContact O-N 3.44Å; V316-T318 VanDerWaalsContact C-N 3.33Å; V316-T318 PolarHBondContact O-N 3.01Å; T318-V320 VanDerWaalsContact C-N 3.34Å; T318-V320 PolarHBondContact O-N 3.28Å; T318-V321 PolarHBondContact O-N 2.9Å; T318-F322 WeakPolarHBondContact O-CB 3.21Å; T318-F322 PolarHBondContact O-N 3.26Å |
| 319 | A | 88.9 | Confident | 84.6 | Confident | 43 Ų | 43 | 43.6 Ų | 43.6 | 36% | 0.355 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -61.6 | -43.1 | 175 | 0 | 0 | 0 | 0 | 0 | 111.3 | W315 V316 F322 I323 | W315-A319 WeakPolarHBondContact O-CB 3.22Å; W315-A319 PolarHBondContact O-N 3.16Å; V316-A319 PolarHBondContact O-N 3.1Å; A319-F322 PolarHBondContact O-N 2.86Å; A319-I323 VanDerWaalsContact O-CG1 3.26Å; A319-I323 WeakPolarHBondContact O-CG1 3.36Å; A319-I323 PolarHBondContact O-N 3.14Å |
| 320 | V | 91 | Very high | 85 | Confident | 31 Ų | 31 | 42.8 Ų | 42.8 | 19% | 0.188 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -64 | -44.3 | 176.9 | 179.2 | 0 | 0 | 0 | 0 | 111.3 | L143 V316 G317 T318 F322 I323 G324 | L143-V320 HydrophobicContact CB-CG1 4.2Å; L143-V320 HydrophobicContact CD2-CG1 4.07Å; L143-V320 VanDerWaalsContact O-CG1 3.25Å; L143-V320 WeakPolarHBondContact O-CG1 3.45Å; V316-V320 VanDerWaalsContact O-CG2 3.29Å; V316-V320 WeakPolarHBondContact O-CG2 3.34Å; V316-V320 PolarHBondContact O-N 3.43Å; G317-V320 PolarHBondContact O-N 3.46Å; T318-V320 VanDerWaalsContact C-N 3.34Å; T318-V320 PolarHBondContact O-N 3.28Å; V320-F322 VanDerWaalsContact C-N 3.32Å; V320-F322 PolarHBondContact O-N 2.93Å; V320-I323 PolarHBondContact O-N 3.48Å; V320-G324 PolarHBondContact O-N 3.13Å |
| 321 | V | 88.3 | Confident | 84.8 | Confident | 8 Ų | 8 | 41.6 Ų | 41.6 | 5% | 0.048 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -60 | -43 | 174.7 | 171.6 | 0 | 0 | 0 | 0 | 111.3 | I112 V144 I148 G317 T318 G324 T325 | I112-V321 HydrophobicContact CG2-CG2 4.4Å; V144-V321 HydrophobicContact CG1-CG1 4.41Å; I148-V321 HydrophobicContact CG1-CG2 4.12Å; G317-V321 WeakPolarHBondContact O-CG2 3.37Å; G317-V321 PolarHBondContact O-N 3.27Å; T318-V321 PolarHBondContact O-N 2.9Å; V321-G324 PolarHBondContact O-N 3.4Å; V321-T325 WeakPolarHBondContact O-CB 3.29Å; V321-T325 PolarHBondContact O-N 2.93Å; V321-T325 PolarHBondContact O-OG1 2.95Å |
| 322 | F | 87.4 | Confident | 84 | Confident | 36 Ų | 36 | 47 Ų | 47 | 16% | 0.158 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -65.9 | -46.5 | -179.4 | -179 | -107 | 0 | 0 | 0 | 111.9 | T292 L293 F296 T318 A319 V320 G324 T325 L326 | T292-F322 HydrophobicContact CG2-CD2 4.37Å; T292-F322 HydrophobicContact CG2-CE2 4.06Å; L293-F322 HydrophobicContact CD2-CE2 4.31Å; L293-F322 HydrophobicContact CD2-CZ 3.76Å; F296-F322 HydrophobicContact CB-CD2 3.67Å; F296-F322 HydrophobicContact CB-CE2 3.4Å; F296-F322 VanDerWaalsContact CB-CE2 3.4Å; F296-F322 HydrophobicContact CB-CZ 4.25Å; F296-F322 HydrophobicContact CD1-CD2 4.23Å; F296-F322 HydrophobicContact CD1-CE1 4.3Å; F296-F322 AromaticContact CD1-CE2 3.85Å; F296-F322 HydrophobicContact CD1-CE2 3.85Å; F296-F322 AromaticContact CD1-CZ 3.87Å; F296-F322 HydrophobicContact CD1-CZ 3.87Å; F296-F322 HydrophobicContact CD2-CB 4.09Å; F296-F322 HydrophobicContact CD2-CD1 4.41Å; F296-F322 AromaticContact CD2-CD2 3.49Å; F296-F322 HydrophobicContact CD2-CD2 3.49Å; F296-F322 VanDerWaalsContact CD2-CD2 3.49Å; F296-F322 AromaticContact CD2-CE2 3.94Å; F296-F322 HydrophobicContact CD2-CE2 3.94Å; F296-F322 AromaticContact CD2-CG 3.74Å; F296-F322 HydrophobicContact CD2-CG 3.74Å; F296-F322 HydrophobicContact CE1-CE1 4.3Å; F296-F322 HydrophobicContact CE1-CZ 4.31Å; F296-F322 HydrophobicContact CE2-CB 4.07Å; F296-F322 HydrophobicContact CE2-CD1 4.27Å; F296-F322 HydrophobicContact CE2-CD2 4.13Å; F296-F322 AromaticContact CE2-CG 3.9Å; F296-F322 HydrophobicContact CE2-CG 3.9Å; F296-F322 AromaticContact CG-CD2 3.54Å; F296-F322 HydrophobicContact CG-CD2 3.54Å; F296-F322 AromaticContact CG-CE2 3.46Å; F296-F322 HydrophobicContact CG-CE2 3.46Å; F296-F322 VanDerWaalsContact CG-CE2 3.46Å; F296-F322 HydrophobicContact CG-CG 4.12Å; F296-F322 AromaticContact CG-CZ 3.98Å; F296-F322 HydrophobicContact CG-CZ 3.98Å; F296-F322 HydrophobicContact CZ-CD1 4.32Å; F296-F322 HydrophobicContact CZ-CG 4.4Å; T318-F322 WeakPolarHBondContact O-CB 3.21Å; T318-F322 PolarHBondContact O-N 3.26Å; A319-F322 PolarHBondContact O-N 2.86Å; V320-F322 VanDerWaalsContact C-N 3.32Å; V320-F322 PolarHBondContact O-N 2.93Å; F322-G324 PolarHBondContact O-N 3.3Å; F322-T325 WeakPolarHBondContact O-CB 3.43Å; F322-T325 PolarHBondContact O-N 3.38Å; F322-T325 VanDerWaalsContact O-N 3.17Å; F322-L326 HydrophobicContact CD1-CD1 4.04Å; F322-L326 HydrophobicContact CE1-CD1 3.5Å; F322-L326 VanDerWaalsContact CE1-CD1 3.5Å; F322-L326 HydrophobicContact CE1-CG 4.23Å; F322-L326 HydrophobicContact CZ-CD1 3.81Å; F322-L326 HydrophobicContact CZ-CD2 4.42Å; F322-L326 HydrophobicContact CZ-CG 4.21Å; F322-L326 PolarHBondContact O-N 3.5Å |
| 323 | I | 88.8 | Confident | 83.1 | Confident | 97 Ų | 97 | 46.4 Ų | 46.4 | 50% | 0.497 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -60.5 | -46.2 | 174.9 | -67.4 | 165.2 | 0 | 0 | 0 | 110.5 | L143 A319 V320 T325 L326 L327 | L143-I323 HydrophobicContact CD1-CG2 4.31Å; A319-I323 VanDerWaalsContact O-CG1 3.26Å; A319-I323 WeakPolarHBondContact O-CG1 3.36Å; A319-I323 PolarHBondContact O-N 3.14Å; V320-I323 PolarHBondContact O-N 3.48Å; I323-T325 VanDerWaalsContact C-N 3.27Å; I323-T325 PolarHBondContact O-N 3.5Å; I323-L326 PolarHBondContact O-N 3.39Å; I323-L327 PolarHBondContact O-N 3.45Å |
| 324 | G | 89 | Confident | 82.2 | Confident | 0 Ų | 0 | 41.5 Ų | 41.5 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -58.2 | -39.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | S140 V320 V321 F322 L327 Y328 | S140-G324 VanDerWaalsContact CB-O 3.27Å; S140-G324 WeakPolarHBondContact CB-O 3.26Å; V320-G324 PolarHBondContact O-N 3.13Å; V321-G324 PolarHBondContact O-N 3.4Å; F322-G324 PolarHBondContact O-N 3.3Å; G324-L327 PolarHBondContact O-N 3.41Å; G324-Y328 WeakPolarHBondContact O-CB 3.49Å; G324-Y328 PolarHBondContact O-N 3.49Å |
| 325 | T | 85.6 | Confident | 81.4 | Confident | 15 Ų | 15 | 45.9 Ų | 45.9 | 9% | 0.092 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -67.3 | -42.2 | 176.4 | -58.8 | 0 | 0 | 0 | 0 | 112.3 | L118 T292 V321 F322 I323 L327 Y328 T329 | L118-T325 HydrophobicContact CD1-CG2 3.68Å; T292-T325 HydrophobicContact CG2-CG2 3.59Å; V321-T325 WeakPolarHBondContact O-CB 3.29Å; V321-T325 PolarHBondContact O-N 2.93Å; V321-T325 PolarHBondContact O-OG1 2.95Å; F322-T325 WeakPolarHBondContact O-CB 3.43Å; F322-T325 PolarHBondContact O-N 3.38Å; F322-T325 VanDerWaalsContact O-N 3.17Å; I323-T325 VanDerWaalsContact C-N 3.27Å; I323-T325 PolarHBondContact O-N 3.5Å; T325-L327 VanDerWaalsContact C-N 3.33Å; T325-L327 PolarHBondContact O-N 2.91Å; T325-Y328 PolarHBondContact O-N 3.27Å; T325-T329 WeakPolarHBondContact O-CB 3.31Å; T325-T329 VanDerWaalsContact O-CG2 3.23Å; T325-T329 WeakPolarHBondContact O-CG2 3.34Å; T325-T329 PolarHBondContact O-N 3.49Å; T325-T329 PolarHBondContact O-OG1 3.29Å |
| 326 | L | 85.1 | Confident | 80.4 | Confident | 33 Ų | 33 | 45.2 Ų | 45.2 | 17% | 0.173 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -64.2 | -38.2 | 175.6 | -71.1 | -179.8 | 0 | 0 | 0 | 112.3 | L289 T292 F322 I323 T329 E330 V331 | L289-L326 HydrophobicContact CD1-CD2 3.8Å; T292-L326 HydrophobicContact CG2-CD2 4.27Å; F322-L326 HydrophobicContact CD1-CD1 4.04Å; F322-L326 HydrophobicContact CE1-CD1 3.5Å; F322-L326 VanDerWaalsContact CE1-CD1 3.5Å; F322-L326 HydrophobicContact CE1-CG 4.23Å; F322-L326 HydrophobicContact CZ-CD1 3.81Å; F322-L326 HydrophobicContact CZ-CD2 4.42Å; F322-L326 HydrophobicContact CZ-CG 4.21Å; F322-L326 PolarHBondContact O-N 3.5Å; I323-L326 PolarHBondContact O-N 3.39Å; L326-T329 WeakPolarHBondContact CA-OG1 3.38Å; L326-T329 PolarHBondContact O-N 3.05Å; L326-T329 PolarHBondContact O-OG1 3.34Å; L326-E330 PolarHBondContact O-N 2.79Å; L326-V331 HydrophobicContact CD2-CG1 4.48Å; L326-V331 PolarHBondContact O-N 3.43Å |
| 327 | L | 86.4 | Confident | 79.4 | Confident | 42 Ų | 42 | 45 Ų | 45 | 22% | 0.22 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -67.1 | -42.4 | 173.9 | -173.5 | 67.6 | 0 | 0 | 0 | 111 | L139 S140 L143 I323 G324 T325 T329 E330 | L139-L327 HydrophobicContact CB-CD2 4.04Å; L139-L327 HydrophobicContact CD2-CD2 3.8Å; L139-L327 HydrophobicContact CG-CD2 3.76Å; S140-L327 VanDerWaalsContact OG-CB 3.29Å; S140-L327 WeakPolarHBondContact OG-CB 3.44Å; S140-L327 WeakPolarHBondContact OG-CD2 3.18Å; S140-L327 WeakPolarHBondContact OG-CG 3.4Å; L143-L327 HydrophobicContact CD1-CD2 4.15Å; I323-L327 PolarHBondContact O-N 3.45Å; G324-L327 PolarHBondContact O-N 3.41Å; T325-L327 VanDerWaalsContact C-N 3.33Å; T325-L327 PolarHBondContact O-N 2.91Å; L327-T329 PolarHBondContact O-N 3.01Å; L327-E330 PolarHBondContact O-N 3.05Å |
| 328 | Y | 82.3 | Confident | 78.4 | Confident | 34 Ų | 34 | 48.2 Ų | 48.2 | 13% | 0.133 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -61.1 | -34.9 | 179.3 | -177.8 | -93.8 | 0 | 0 | 0 | 110.7 | L118 M122 K137 S140 G324 T325 E330 | L118-Y328 HydrophobicContact CB-CD1 4.41Å; L118-Y328 HydrophobicContact CB-CE1 4.43Å; L118-Y328 HydrophobicContact CD1-CD1 4.24Å; L118-Y328 HydrophobicContact CD1-CG 4.39Å; L118-Y328 HydrophobicContact CD2-CD1 3.8Å; L118-Y328 HydrophobicContact CD2-CE1 3.78Å; L118-Y328 HydrophobicContact CG-CD1 4.37Å; M122-Y328 HydrophobicContact CB-CE2 4.33Å; M122-Y328 HydrophobicContact SD-CE2 4.1Å; K137-Y328 HydrophobicContact CB-CD2 4.4Å; K137-Y328 HydrophobicContact CB-CE2 4.49Å; K137-Y328 HydrophobicContact CD-CD2 3.94Å; K137-Y328 HydrophobicContact CD-CE2 4.11Å; K137-Y328 HydrophobicContact CD-CG 4.32Å; K137-Y328 WeakPolarHBondContact CD-O 3.37Å; K137-Y328 WeakPolarHBondContact CE-O 3.28Å; K137-Y328 PolarHBondContact NZ-O 3.44Å; S140-Y328 WeakPolarHBondContact OG-CA 3.43Å; S140-Y328 PolarHBondContact OG-N 2.98Å; G324-Y328 WeakPolarHBondContact O-CB 3.49Å; G324-Y328 PolarHBondContact O-N 3.49Å; T325-Y328 PolarHBondContact O-N 3.27Å; Y328-E330 PolarHBondContact O-N 3.02Å |
| 329 | T | 76.1 | Confident | 77.5 | Confident | 14 Ų | 14 | 53.8 Ų | 53.8 | 9% | 0.086 | 30% | 0.298 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -82.9 | 0.5 | -178.2 | 52.6 | 0 | 0 | 0 | 0 | 112.4 | L285 T288 T325 L326 L327 V331 | L285-T329 WeakPolarHBondContact CD1-O 3.33Å; T288-T329 HydrophobicContact CG2-CG2 3.32Å; T325-T329 WeakPolarHBondContact O-CB 3.31Å; T325-T329 VanDerWaalsContact O-CG2 3.23Å; T325-T329 WeakPolarHBondContact O-CG2 3.34Å; T325-T329 PolarHBondContact O-N 3.49Å; T325-T329 PolarHBondContact O-OG1 3.29Å; L326-T329 WeakPolarHBondContact CA-OG1 3.38Å; L326-T329 PolarHBondContact O-N 3.05Å; L326-T329 PolarHBondContact O-OG1 3.34Å; L327-T329 PolarHBondContact O-N 3.01Å; T329-V331 PolarHBondContact O-N 3.14Å; T329-V331 VanDerWaalsContact O-N 3.11Å; T329-V331 WeakPolarHBondContact OG1-CG2 3.02Å |
| 330 | E | 76.1 | Confident | 76.5 | Confident | 72 Ų | 72 | 60.8 Ų | 60.8 | 34% | 0.336 | 32% | 0.315 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 53.7 | 26 | -177.7 | -73.1 | 165.7 | 163 | 0 | 0 | 113.1 | S134 K137 L326 L327 Y328 W332 S333 S334 | S134-E330 PolarHBondContact OG-OE1 3.39Å; K137-E330 WeakPolarHBondContact CE-OE1 3.41Å; K137-E330 WeakPolarHBondContact CE-OE2 3.25Å; K137-E330 IonicContact NZ-OE1 2.65Å; K137-E330 IonicContact NZ-OE2 2.91Å; K137-E330 PolarHBondContact NZ-OE2 2.8Å; L326-E330 PolarHBondContact O-N 2.79Å; L327-E330 PolarHBondContact O-N 3.05Å; Y328-E330 PolarHBondContact O-N 3.02Å; E330-W332 VanDerWaalsContact C-N 3.33Å; E330-S333 PolarHBondContact O-OG 3.29Å; E330-S334 WeakPolarHBondContact O-CB 3.35Å; E330-S334 PolarHBondContact O-N 3.49Å; E330-S334 PolarHBondContact O-OG 2.94Å |
| 331 | V | 69.2 | Low | 74.9 | Confident | 7 Ų | 7 | 61.1 Ų | 61.1 | 4% | 0.042 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -63.8 | -44.6 | 177.4 | 166.7 | 0 | 0 | 0 | 0 | 109.6 | L285 L289 L326 T329 S334 M335 | L285-V331 HydrophobicContact CD1-CG2 3.93Å; L289-V331 HydrophobicContact CB-CG2 3.99Å; L289-V331 HydrophobicContact CD1-CB 4.36Å; L289-V331 HydrophobicContact CD1-CG1 3.63Å; L289-V331 HydrophobicContact CD1-CG2 3.91Å; L289-V331 HydrophobicContact CD2-CG1 3.95Å; L289-V331 HydrophobicContact CG-CG1 4.3Å; L289-V331 HydrophobicContact CG-CG2 4.39Å; L326-V331 HydrophobicContact CD2-CG1 4.48Å; L326-V331 PolarHBondContact O-N 3.43Å; T329-V331 PolarHBondContact O-N 3.14Å; T329-V331 VanDerWaalsContact O-N 3.11Å; T329-V331 WeakPolarHBondContact OG1-CG2 3.02Å; V331-S334 PolarHBondContact O-N 2.81Å; V331-M335 HydrophobicContact CG1-CG 4.18Å; V331-M335 HydrophobicContact CG1-SD 3.72Å; V331-M335 WeakPolarHBondContact O-CB 3.35Å; V331-M335 WeakPolarHBondContact O-CG 3.36Å; V331-M335 PolarHBondContact O-N 3.35Å |
| 332 | W | 64.8 | Low | 73.3 | Confident | 156 Ų | 156 | 63.5 Ų | 63.5 | 59% | 0.591 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -64.1 | -45.5 | -174.5 | -168 | -93.9 | 0 | 0 | 0 | 112.9 | E330 S334 M335 Q336 | E330-W332 VanDerWaalsContact C-N 3.33Å; W332-S334 VanDerWaalsContact C-N 3.3Å; W332-S334 PolarHBondContact O-N 3.24Å; W332-M335 PolarHBondContact O-N 3.13Å; W332-Q336 WeakPolarHBondContact O-CB 3.47Å; W332-Q336 WeakPolarHBondContact O-CG 3.46Å; W332-Q336 PolarHBondContact O-N 3.11Å |
| 333 | S | 68.6 | Low | 71.4 | Confident | 63 Ų | 63 | 63.3 Ų | 63.3 | 44% | 0.441 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -63.8 | -37.4 | 177.4 | 48.6 | 0 | 0 | 0 | 0 | 111.9 | E330 A337 | E330-S333 PolarHBondContact O-OG 3.29Å; S333-A337 WeakPolarHBondContact O-CB 3.5Å; S333-A337 PolarHBondContact O-N 3.39Å |
| 334 | S | 66.6 | Low | 69.6 | Low | 46 Ų | 46 | 63 Ų | 63 | 32% | 0.322 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -74.4 | -37.9 | 179 | -54.9 | 0 | 0 | 0 | 0 | 112.7 | L285 E330 V331 W332 A337 A338 | L285-S334 WeakPolarHBondContact CD2-OG 3.33Å; E330-S334 WeakPolarHBondContact O-CB 3.35Å; E330-S334 PolarHBondContact O-N 3.49Å; E330-S334 PolarHBondContact O-OG 2.94Å; V331-S334 PolarHBondContact O-N 2.81Å; W332-S334 VanDerWaalsContact C-N 3.3Å; W332-S334 PolarHBondContact O-N 3.24Å; S334-A337 PolarHBondContact O-N 3.26Å; S334-A338 WeakPolarHBondContact O-CB 3.4Å; S334-A338 PolarHBondContact O-N 2.95Å |
| 335 | M | 64.5 | Low | 67.7 | Low | 95 Ų | 95 | 71.1 Ų | 71.1 | 47% | 0.468 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -63 | -43.9 | 171.3 | -77 | -179.5 | 66.4 | 0 | 0 | 111.2 | V331 W332 A337 A338 L339 | V331-M335 HydrophobicContact CG1-CG 4.18Å; V331-M335 HydrophobicContact CG1-SD 3.72Å; V331-M335 WeakPolarHBondContact O-CB 3.35Å; V331-M335 WeakPolarHBondContact O-CG 3.36Å; V331-M335 PolarHBondContact O-N 3.35Å; W332-M335 PolarHBondContact O-N 3.13Å; M335-A337 VanDerWaalsContact C-N 3.32Å; M335-A337 PolarHBondContact O-N 3.23Å; M335-A338 PolarHBondContact O-N 2.88Å; M335-L339 WeakPolarHBondContact O-CB 3.44Å; M335-L339 WeakPolarHBondContact O-CG 3.45Å; M335-L339 PolarHBondContact O-N 2.95Å |
| 336 | Q | 66.6 | Low | 65.9 | Low | 83 Ų | 83 | 78 Ų | 78 | 39% | 0.388 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -61.8 | -39.8 | 174.2 | -76.2 | -177.8 | -26.1 | 0 | 0 | 112 | W332 R340 | W332-Q336 WeakPolarHBondContact O-CB 3.47Å; W332-Q336 WeakPolarHBondContact O-CG 3.46Å; W332-Q336 PolarHBondContact O-N 3.11Å; Q336-R340 WeakPolarHBondContact O-CB 3.41Å; Q336-R340 VanDerWaalsContact O-CG 3.27Å; Q336-R340 WeakPolarHBondContact O-CG 3.34Å; Q336-R340 PolarHBondContact O-N 3.34Å |
| 337 | A | 69.3 | Low | 64.2 | Low | 63 Ų | 63 | 85.7 Ų | 85.7 | 52% | 0.521 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -64.4 | -42 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | S333 S334 M335 R340 G341 | S333-A337 WeakPolarHBondContact O-CB 3.5Å; S333-A337 PolarHBondContact O-N 3.39Å; S334-A337 PolarHBondContact O-N 3.26Å; M335-A337 VanDerWaalsContact C-N 3.32Å; M335-A337 PolarHBondContact O-N 3.23Å; A337-R340 PolarHBondContact O-N 3.21Å; A337-G341 PolarHBondContact O-N 3.08Å |
| 338 | A | 67 | Low | 62.3 | Low | 67 Ų | 67 | 92.4 Ų | 92.4 | 55% | 0.554 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -65 | -44.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | S334 M335 G341 A342 | S334-A338 WeakPolarHBondContact O-CB 3.4Å; S334-A338 PolarHBondContact O-N 2.95Å; M335-A338 PolarHBondContact O-N 2.88Å; A338-G341 PolarHBondContact O-N 3.12Å; A338-A342 PolarHBondContact O-N 3.44Å |
| 339 | L | 66.8 | Low | 60.3 | Low | 124 Ų | 124 | 97.9 Ų | 97.9 | 65% | 0.649 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -63.8 | -41.1 | 176.5 | -73.2 | 166.1 | 0 | 0 | 0 | 111.9 | M335 A342 G343 | M335-L339 WeakPolarHBondContact O-CB 3.44Å; M335-L339 WeakPolarHBondContact O-CG 3.45Å; M335-L339 PolarHBondContact O-N 2.95Å; L339-A342 PolarHBondContact O-N 3.04Å; L339-G343 PolarHBondContact O-N 3.05Å |
| 340 | R | 67.8 | Low | 59.5 | Low | 190 Ų | 190 | 102.1 Ų | 102.1 | 72% | 0.717 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -67.6 | -37.1 | 174.6 | -74 | 177.4 | 179.2 | -179.6 | 0.7 | 112.3 | Q336 A337 G343 V344 | Q336-R340 WeakPolarHBondContact O-CB 3.41Å; Q336-R340 VanDerWaalsContact O-CG 3.27Å; Q336-R340 WeakPolarHBondContact O-CG 3.34Å; Q336-R340 PolarHBondContact O-N 3.34Å; A337-R340 PolarHBondContact O-N 3.21Å; R340-G343 PolarHBondContact O-N 3.46Å; R340-V344 WeakPolarHBondContact O-CG2 3.46Å; R340-V344 PolarHBondContact O-N 2.67Å |
| 341 | G | 56.7 | Low | 58.6 | Low | 39 Ų | 39 | 103.7 Ų | 103.7 | 40% | 0.402 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -67.6 | -34.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | A337 A338 K345 | A337-G341 PolarHBondContact O-N 3.08Å; A338-G341 PolarHBondContact O-N 3.12Å; G341-K345 PolarHBondContact O-N 3.13Å |
| 342 | A | 54.5 | Low | 58 | Low | 58 Ų | 58 | 109.1 Ų | 109.1 | 48% | 0.479 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -66 | -44.5 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | A338 L339 V344 K345 E346 | A338-A342 PolarHBondContact O-N 3.44Å; L339-A342 PolarHBondContact O-N 3.04Å; A342-V344 VanDerWaalsContact C-N 3.28Å; A342-V344 PolarHBondContact O-N 2.96Å; A342-K345 PolarHBondContact O-N 2.97Å; A342-E346 PolarHBondContact O-N 3.31Å; A342-E346 VanDerWaalsContact O-N 3.12Å |
| 343 | G | 47.8 | Very low | 57.6 | Low | 32 Ų | 32 | 106.3 Ų | 106.3 | 33% | 0.33 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -66.8 | -22.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 115 | L339 R340 K347 | L339-G343 PolarHBondContact O-N 3.05Å; R340-G343 PolarHBondContact O-N 3.46Å; G343-K347 PolarHBondContact O-N 3.38Å |
| 344 | V | 51.9 | Low | 56.9 | Low | 89 Ų | 89 | 109 Ų | 109 | 54% | 0.539 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -79.8 | -31.1 | 174 | 174.9 | 0 | 0 | 0 | 0 | 112 | R340 A342 | R340-V344 WeakPolarHBondContact O-CG2 3.46Å; R340-V344 PolarHBondContact O-N 2.67Å; A342-V344 VanDerWaalsContact C-N 3.28Å; A342-V344 PolarHBondContact O-N 2.96Å |
| 345 | K | 48.3 | Very low | 56.3 | Low | 171 Ų | 171 | 113.2 Ų | 113.2 | 74% | 0.743 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -72 | -36.3 | 173.3 | -80.1 | -173 | 174.5 | -175.8 | 0 | 111.9 | G341 A342 K348 A349 | G341-K345 PolarHBondContact O-N 3.13Å; A342-K345 PolarHBondContact O-N 2.97Å; K345-K348 PolarHBondContact O-N 2.93Å; K345-A349 PolarHBondContact O-N 3.18Å |
| 346 | E | 48.4 | Very low | 55.7 | Low | 159 Ų | 159 | 114.5 Ų | 114.5 | 74% | 0.743 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -71.7 | -29 | 178.7 | -157 | 171 | -161.6 | 0 | 0 | 112.7 | A342 K348 | A342-E346 PolarHBondContact O-N 3.31Å; A342-E346 VanDerWaalsContact O-N 3.12Å; E346-K348 VanDerWaalsContact C-N 3.31Å; E346-K348 PolarHBondContact O-N 3.02Å |
| 347 | K | 47.9 | Very low | 54.9 | Low | 195 Ų | 195 | 116.9 Ų | 116.9 | 85% | 0.848 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79 | -6.6 | 172.9 | -80.4 | -172.3 | 175.6 | -173.9 | 0 | 115.1 | G343 | G343-K347 PolarHBondContact O-N 3.38Š|
| 348 | K | 46.4 | Very low | 53.7 | Low | 184 Ų | 184 | 121.4 Ų | 121.4 | 80% | 0.8 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.4 | 3.3 | 179.8 | -79 | -169.8 | 174.6 | -171.9 | 0 | 113.2 | K345 E346 | K345-K348 PolarHBondContact O-N 2.93Å; E346-K348 VanDerWaalsContact C-N 3.31Å; E346-K348 PolarHBondContact O-N 3.02Å |
| 349 | A | 40.3 | Very low | 52.4 | Low | 149 Ų | 149 | 126.4 Ų | 126.4 | 100% | 1.231 | 68% | 0.68 | S | S | * | * | trans | -98.7 | 0 | 178.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | K345 | K345-A349 PolarHBondContact O-N 3.18Š|
Retrieved 349 of 349 residues in 163.9 ms
(Link to these results)