| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 37.3 | Very low | 34.6 | Very low | 238 Ų | 238 | 160 Ų | 160 | 100% | 1.172 | 84% | 0.843 | S | S | * | * | 0 | 128.8 | 0 | -73.4 | 161.2 | 160.3 | 0 | 0 | 107.6 | S3 | M1-S3 PolarHBondContact O-N 3.06Š| |||
| 2 | N | 35.4 | Very low | 34.4 | Very low | 174 Ų | 174 | 156.5 Ų | 156.5 | 93% | 0.93 | 84% | 0.836 | S | S | * | * | trans | -82.2 | 94.7 | 179.2 | -96.7 | 2.7 | 0 | 0 | 0 | 110.4 | G4 | N2-G4 VanDerWaalsContact C-N 3.3Å; N2-G4 PolarHBondContact O-N 3.38Å | ||
| 3 | S | 39 | Very low | 34.1 | Very low | 111 Ų | 111 | 156.1 Ų | 156.1 | 78% | 0.776 | 83% | 0.834 | S | S | * | * | trans | -73.1 | 84.1 | 167.4 | 53.6 | 0 | 0 | 0 | 0 | 109.5 | M1 M5 | M1-S3 PolarHBondContact O-N 3.06Å; S3-M5 PolarHBondContact O-N 3.02Å; S3-M5 VanDerWaalsContact O-N 3.11Å | ||
| 4 | G | 36.1 | Very low | 33.9 | Very low | 66 Ų | 66 | 155.5 Ų | 155.5 | 68% | 0.68 | 83% | 0.829 | S | S | * | * | trans | -61.9 | 112.4 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | N2 R6 | N2-G4 VanDerWaalsContact C-N 3.3Å; N2-G4 PolarHBondContact O-N 3.38Å; G4-R6 PolarHBondContact O-N 3.37Å | ||
| 5 | M | 36.6 | Very low | 33.9 | Very low | 188 Ų | 188 | 154.9 Ų | 154.9 | 93% | 0.926 | 82% | 0.824 | S | S | * | * | trans | -61.8 | 105.5 | 169.5 | -72.4 | -175 | -78.5 | 0 | 0 | 108.6 | S3 Y7 | S3-M5 PolarHBondContact O-N 3.02Å; S3-M5 VanDerWaalsContact O-N 3.11Å; M5-Y7 PolarHBondContact O-N 2.95Å | ||
| 6 | R | 36.1 | Very low | 34.1 | Very low | 234 Ų | 234 | 152.6 Ų | 152.6 | 88% | 0.883 | 81% | 0.81 | S | S | * | * | trans | -65.3 | 126.5 | 167.2 | -76.4 | -173 | 175 | -177.2 | -1.1 | 107.8 | G4 V8 | G4-R6 PolarHBondContact O-N 3.37Å; R6-V8 PolarHBondContact O-N 2.68Å | ||
| 7 | Y | 32.6 | Very low | 34.9 | Very low | 215 Ų | 215 | 147.8 Ų | 147.8 | 84% | 0.843 | 78% | 0.784 | S | S | * | * | trans | -54.1 | 130.3 | 167.8 | -124.7 | -109.8 | 0 | 0 | 0 | 108.4 | M5 | M5-Y7 PolarHBondContact O-N 2.95Š| ||
| 8 | V | 35.1 | Very low | 35.3 | Very low | 130 Ų | 130 | 148.1 Ų | 148.1 | 79% | 0.788 | 78% | 0.781 | S | S | * | * | trans | -87.4 | 111.5 | 167.4 | 177.5 | 0 | 0 | 0 | 0 | 105.6 | R6 | R6-V8 PolarHBondContact O-N 2.68Š| ||
| 9 | D | 30.4 | Very low | 35.9 | Very low | 135 Ų | 135 | 144.9 Ų | 144.9 | 72% | 0.722 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 131.5 | 175.9 | -67 | -50.8 | 0 | 0 | 0 | 109.2 | L11 | D9-L11 PolarHBondContact O-N 3.04Š|
| 10 | P | 33.9 | Very low | 36.5 | Very low | 111 Ų | 111 | 139.5 Ų | 139.5 | 72% | 0.721 | 73% | 0.733 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 141.1 | -177.6 | 25.7 | -33.6 | 0 | 0 | 0 | 110.2 | ||
| 11 | L | 28.1 | Very low | 36.9 | Very low | 158 Ų | 158 | 138.3 Ų | 138.3 | 83% | 0.827 | 72% | 0.724 | S | S | * | * | P | Polyproline II helix | trans | -47.2 | 132.3 | 178 | -71.4 | 161.9 | 0 | 0 | 0 | 110.3 | D9 N13 | D9-L11 PolarHBondContact O-N 3.04Å; L11-N13 PolarHBondContact O-N 3.43Å |
| 12 | P | 32.4 | Very low | 37.5 | Very low | 118 Ų | 118 | 131.6 Ų | 131.6 | 77% | 0.766 | 70% | 0.696 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 126.8 | 180 | 24.5 | -33.4 | 0 | 0 | 0 | 109.2 | I14 | P12-I14 PolarHBondContact O-N 3.06Š|
| 13 | N | 30.7 | Very low | 38.3 | Very low | 151 Ų | 151 | 124 Ų | 124 | 81% | 0.807 | 66% | 0.656 | S | S | * | * | P | Polyproline II helix | trans | -53.4 | 138.1 | -175 | -93.7 | -21.9 | 0 | 0 | 0 | 111.1 | L11 I15 | L11-N13 PolarHBondContact O-N 3.43Å; N13-I15 PolarHBondContact O-N 3.06Å |
| 14 | I | 30.7 | Very low | 39.2 | Very low | 148 Ų | 148 | 120 Ų | 120 | 76% | 0.759 | 63% | 0.626 | S | S | * | * | trans | -73.6 | 76.6 | 179.5 | -57.2 | 171.8 | 0 | 0 | 0 | 108.4 | P12 I16 | P12-I14 PolarHBondContact O-N 3.06Å; I14-I16 HydrophobicContact CG2-CD1 3.9Å; I14-I16 HydrophobicContact CG2-CG1 3.83Å; I14-I16 PolarHBondContact O-N 3.23Å | ||
| 15 | I | 33.8 | Very low | 39.9 | Very low | 147 Ų | 147 | 122.1 Ų | 122.1 | 75% | 0.754 | 62% | 0.621 | S | S | * | * | trans | -77.6 | 80.5 | 163.2 | -53.2 | 179.5 | 0 | 0 | 0 | 106.2 | N13 D17 | N13-I15 PolarHBondContact O-N 3.06Å; I15-D17 PolarHBondContact O-N 3.37Å | ||
| 16 | I | 37.7 | Very low | 41 | Very low | 118 Ų | 118 | 115.6 Ų | 115.6 | 61% | 0.605 | 59% | 0.594 | S | S | * | * | trans | -59 | 126.4 | 151.4 | -70.5 | 157.8 | 0 | 0 | 0 | 105.1 | I14 E18 | I14-I16 HydrophobicContact CG2-CD1 3.9Å; I14-I16 HydrophobicContact CG2-CG1 3.83Å; I14-I16 PolarHBondContact O-N 3.23Å; I16-E18 VanDerWaalsContact C-N 3.28Å; I16-E18 PolarHBondContact O-N 2.96Å | ||
| 17 | D | 46.6 | Very low | 42.1 | Very low | 70 Ų | 70 | 105 Ų | 105 | 37% | 0.374 | 55% | 0.554 | S | S | . | * | trans | -76.8 | 80.4 | -168.2 | -173.4 | -4 | 0 | 0 | 0 | 111.4 | I15 Q19 N20 E21 | I15-D17 PolarHBondContact O-N 3.37Å; D17-Q19 PolarHBondContact O-N 3.41Å; D17-Q19 WeakPolarHBondContact OD1-CB 3.45Å; D17-Q19 PolarHBondContact OD1-N 3.39Å; D17-N20 HydrophobicContact CB-CB 4.09Å; D17-N20 WeakPolarHBondContact O-CB 3.35Å; D17-N20 PolarHBondContact O-N 3.02Å; D17-N20 PolarHBondContact OD1-N 2.71Å; D17-N20 PolarHBondContact OD2-ND2 3.18Å; D17-E21 PolarHBondContact O-N 3.01Å | ||
| 18 | E | 43 | Very low | 43.3 | Very low | 153 Ų | 153 | 98.3 Ų | 98.3 | 72% | 0.715 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -56.4 | -26.8 | 175.8 | -166.6 | 173.7 | -147.2 | 0 | 0 | 111.8 | I16 E21 V22 | I16-E18 VanDerWaalsContact C-N 3.28Å; I16-E18 PolarHBondContact O-N 2.96Å; E18-E21 PolarHBondContact O-N 3.18Å; E18-V22 WeakPolarHBondContact O-CG2 3.36Å; E18-V22 PolarHBondContact O-N 3.31Å; E18-V22 VanDerWaalsContact O-N 3.08Å |
| 19 | Q | 46.5 | Very low | 44.6 | Very low | 89 Ų | 89 | 95.8 Ų | 95.8 | 42% | 0.416 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -72.5 | -36 | 175.9 | -54.7 | -175.2 | -10.3 | 0 | 0 | 111.6 | D17 T23 I110 | D17-Q19 PolarHBondContact O-N 3.41Å; D17-Q19 WeakPolarHBondContact OD1-CB 3.45Å; D17-Q19 PolarHBondContact OD1-N 3.39Å; Q19-T23 VanDerWaalsContact O-CB 3.26Å; Q19-T23 WeakPolarHBondContact O-CB 3.42Å; Q19-T23 PolarHBondContact O-N 3.23Å; Q19-T23 PolarHBondContact O-OG1 2.84Å; Q19-I110 HydrophobicContact CB-CD1 4.16Å; Q19-I110 HydrophobicContact CG-CD1 4.36Å |
| 20 | N | 47.8 | Very low | 46 | Very low | 35 Ų | 35 | 89.9 Ų | 89.9 | 19% | 0.187 | 49% | 0.491 | C | S | . | . | H | α-helix | trans | -63.5 | -42.5 | 169.9 | -113.4 | -60.5 | 0 | 0 | 0 | 111.4 | D17 T23 V24 P158 | D17-N20 HydrophobicContact CB-CB 4.09Å; D17-N20 WeakPolarHBondContact O-CB 3.35Å; D17-N20 PolarHBondContact O-N 3.02Å; D17-N20 PolarHBondContact OD1-N 2.71Å; D17-N20 PolarHBondContact OD2-ND2 3.18Å; N20-T23 PolarHBondContact O-N 3.4Å; N20-V24 WeakPolarHBondContact O-CB 3.48Å; N20-V24 WeakPolarHBondContact O-CG2 3.13Å; N20-V24 PolarHBondContact O-N 2.93Å; N20-P158 WeakPolarHBondContact OD1-CB 3.1Å |
| 21 | E | 45.4 | Very low | 47.5 | Very low | 116 Ų | 116 | 85.4 Ų | 85.4 | 54% | 0.542 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -63.4 | -47.9 | 178.6 | -66.5 | -160.1 | 165 | 0 | 0 | 112.5 | D17 E18 T23 V24 I25 | D17-E21 PolarHBondContact O-N 3.01Å; E18-E21 PolarHBondContact O-N 3.18Å; E21-T23 VanDerWaalsContact C-N 3.31Å; E21-T23 PolarHBondContact O-N 2.79Å; E21-V24 PolarHBondContact O-N 3.01Å; E21-V24 VanDerWaalsContact O-N 3.14Å; E21-I25 VanDerWaalsContact O-CG1 3.32Å; E21-I25 WeakPolarHBondContact O-CG1 3.47Å; E21-I25 PolarHBondContact O-N 3.01Å |
| 22 | V | 48.8 | Very low | 49.1 | Very low | 97 Ų | 97 | 80.2 Ų | 80.2 | 59% | 0.588 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -59.1 | -43.6 | 175.5 | 173 | 0 | 0 | 0 | 0 | 111.3 | E18 V24 I25 S26 | E18-V22 WeakPolarHBondContact O-CG2 3.36Å; E18-V22 PolarHBondContact O-N 3.31Å; E18-V22 VanDerWaalsContact O-N 3.08Å; V22-V24 VanDerWaalsContact C-N 3.3Å; V22-V24 PolarHBondContact O-N 3.05Å; V22-I25 PolarHBondContact O-N 2.87Å; V22-S26 PolarHBondContact O-N 3.18Å; V22-S26 VanDerWaalsContact O-N 3.16Å |
| 23 | T | 53.8 | Low | 50.6 | Low | 15 Ų | 15 | 80.5 Ų | 80.5 | 9% | 0.092 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -63.9 | -35.2 | 177.9 | -59.6 | 0 | 0 | 0 | 0 | 111.8 | Q19 N20 E21 S26 R27 P158 | Q19-T23 VanDerWaalsContact O-CB 3.26Å; Q19-T23 WeakPolarHBondContact O-CB 3.42Å; Q19-T23 PolarHBondContact O-N 3.23Å; Q19-T23 PolarHBondContact O-OG1 2.84Å; N20-T23 PolarHBondContact O-N 3.4Å; E21-T23 VanDerWaalsContact C-N 3.31Å; E21-T23 PolarHBondContact O-N 2.79Å; T23-S26 PolarHBondContact O-OG 3.2Å; T23-R27 VanDerWaalsContact O-CD 3.29Å; T23-R27 WeakPolarHBondContact O-CD 3.46Å; T23-R27 WeakPolarHBondContact O-CG 3.02Å; T23-R27 PolarHBondContact O-NE 2.99Å; T23-R27 VanDerWaalsContact O-NE 3.17Å; T23-P158 HydrophobicContact CG2-CG 4.15Å |
| 24 | V | 56.3 | Low | 52.3 | Low | 25 Ų | 25 | 73.5 Ų | 73.5 | 15% | 0.152 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -71.4 | -46.3 | 175 | 158.5 | 0 | 0 | 0 | 0 | 112.7 | N20 E21 V22 S26 R27 L28 Q265 | N20-V24 WeakPolarHBondContact O-CB 3.48Å; N20-V24 WeakPolarHBondContact O-CG2 3.13Å; N20-V24 PolarHBondContact O-N 2.93Å; E21-V24 PolarHBondContact O-N 3.01Å; E21-V24 VanDerWaalsContact O-N 3.14Å; V22-V24 VanDerWaalsContact C-N 3.3Å; V22-V24 PolarHBondContact O-N 3.05Å; V24-S26 VanDerWaalsContact C-N 3.3Å; V24-S26 PolarHBondContact O-N 2.83Å; V24-R27 WeakPolarHBondContact O-CB 3.24Å; V24-R27 PolarHBondContact O-N 3.23Å; V24-R27 VanDerWaalsContact O-N 3.14Å; V24-L28 HydrophobicContact CG1-CD1 4.23Å; V24-L28 PolarHBondContact O-N 2.88Å; V24-Q265 HydrophobicContact CG2-CG 4.47Å |
| 25 | I | 52.1 | Low | 53.9 | Low | 111 Ų | 111 | 66.6 Ų | 66.6 | 57% | 0.569 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -60.1 | -42 | -178.8 | -69.6 | 164.2 | 0 | 0 | 0 | 110.8 | E21 V22 R27 L28 S29 | E21-I25 VanDerWaalsContact O-CG1 3.32Å; E21-I25 WeakPolarHBondContact O-CG1 3.47Å; E21-I25 PolarHBondContact O-N 3.01Å; V22-I25 PolarHBondContact O-N 2.87Å; I25-R27 PolarHBondContact O-N 2.99Å; I25-L28 PolarHBondContact O-N 3.08Å; I25-S29 PolarHBondContact O-N 3.1Å |
| 26 | S | 58.2 | Low | 55.5 | Low | 52 Ų | 52 | 64.4 Ų | 64.4 | 36% | 0.364 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -55 | -41 | 177.4 | 72.9 | 0 | 0 | 0 | 0 | 112.4 | V22 T23 V24 S29 | V22-S26 PolarHBondContact O-N 3.18Å; V22-S26 VanDerWaalsContact O-N 3.16Å; T23-S26 PolarHBondContact O-OG 3.2Å; V24-S26 VanDerWaalsContact C-N 3.3Å; V24-S26 PolarHBondContact O-N 2.83Å; S26-S29 PolarHBondContact O-N 2.9Å; S26-S29 PolarHBondContact O-OG 3.37Å |
| 27 | R | 59 | Low | 56.8 | Low | 12 Ų | 12 | 60 Ų | 60 | 5% | 0.045 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -69 | -46.8 | -178.5 | -63.8 | 161.4 | -169.5 | -133.7 | -10.5 | 111.3 | T23 V24 I25 S29 G30 F31 E113 T154 P158 L261 | T23-R27 VanDerWaalsContact O-CD 3.29Å; T23-R27 WeakPolarHBondContact O-CD 3.46Å; T23-R27 WeakPolarHBondContact O-CG 3.02Å; T23-R27 PolarHBondContact O-NE 2.99Å; T23-R27 VanDerWaalsContact O-NE 3.17Å; V24-R27 WeakPolarHBondContact O-CB 3.24Å; V24-R27 PolarHBondContact O-N 3.23Å; V24-R27 VanDerWaalsContact O-N 3.14Å; I25-R27 PolarHBondContact O-N 2.99Å; R27-S29 PolarHBondContact O-N 3.43Å; R27-S29 VanDerWaalsContact O-N 3.14Å; R27-G30 PolarHBondContact O-N 2.73Å; R27-F31 HydrophobicContact CB-CD2 4.5Å; R27-F31 HydrophobicContact CB-CE2 4.16Å; R27-F31 WeakPolarHBondContact O-CD2 3.43Å; R27-F31 PolarHBondContact O-N 3.17Å; R27-E113 IonicContact CZ-OE2 3.84Å; R27-E113 IonicContact NH2-OE2 2.67Å; R27-E113 PolarHBondContact NH2-OE2 3.45Å; R27-T154 PolarHBondContact NH1-O 3.28Å; R27-T154 PolarHBondContact NH2-O 3.14Å; R27-P158 VanDerWaalsContact NH1-CD 3.31Å; R27-P158 VanDerWaalsContact NH1-CG 3.33Å; R27-L261 HydrophobicContact CB-CD2 4.28Å |
| 28 | L | 58 | Low | 57.6 | Low | 74 Ų | 74 | 57.1 Ų | 57.1 | 39% | 0.387 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -55.2 | -32.8 | 178.4 | -66.8 | 175 | 0 | 0 | 0 | 112.2 | V24 I25 F31 A32 | V24-L28 HydrophobicContact CG1-CD1 4.23Å; V24-L28 PolarHBondContact O-N 2.88Å; I25-L28 PolarHBondContact O-N 3.08Å; L28-F31 PolarHBondContact O-N 3.32Å; L28-A32 PolarHBondContact O-N 2.97Å |
| 29 | S | 62.9 | Low | 58.6 | Low | 77 Ų | 77 | 51.5 Ų | 51.5 | 54% | 0.538 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -63.6 | -40.5 | 175.6 | 81.9 | 0 | 0 | 0 | 0 | 113.5 | I25 S26 R27 F31 A32 Y33 | I25-S29 PolarHBondContact O-N 3.1Å; S26-S29 PolarHBondContact O-N 2.9Å; S26-S29 PolarHBondContact O-OG 3.37Å; R27-S29 PolarHBondContact O-N 3.43Å; R27-S29 VanDerWaalsContact O-N 3.14Å; S29-F31 VanDerWaalsContact C-N 3.3Å; S29-F31 PolarHBondContact O-N 2.99Å; S29-A32 PolarHBondContact O-N 2.85Å; S29-Y33 PolarHBondContact O-N 3.07Å |
| 30 | G | 59.1 | Low | 59.4 | Low | 10 Ų | 10 | 52.2 Ų | 52.2 | 10% | 0.103 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -64 | -34.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | R27 Y33 F34 | R27-G30 PolarHBondContact O-N 2.73Å; G30-Y33 PolarHBondContact O-N 3.01Å; G30-F34 WeakPolarHBondContact O-CB 3.4Å; G30-F34 PolarHBondContact O-N 3.11Å |
| 31 | F | 66.2 | Low | 60 | Low | 18 Ų | 18 | 51.6 Ų | 51.6 | 8% | 0.079 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -76 | -31.7 | 176.4 | -63.7 | -70.8 | 0 | 0 | 0 | 113.1 | R27 L28 S29 F34 S35 V155 T254 M258 L261 | R27-F31 HydrophobicContact CB-CD2 4.5Å; R27-F31 HydrophobicContact CB-CE2 4.16Å; R27-F31 WeakPolarHBondContact O-CD2 3.43Å; R27-F31 PolarHBondContact O-N 3.17Å; L28-F31 PolarHBondContact O-N 3.32Å; S29-F31 VanDerWaalsContact C-N 3.3Å; S29-F31 PolarHBondContact O-N 2.99Å; F31-F34 PolarHBondContact O-N 3.01Å; F31-S35 PolarHBondContact O-N 3.45Å; F31-S35 VanDerWaalsContact O-N 3.08Å; F31-V155 HydrophobicContact CZ-CG2 4.27Å; F31-T254 HydrophobicContact CD1-CG2 3.95Å; F31-T254 HydrophobicContact CE1-CG2 3.87Å; F31-M258 HydrophobicContact CB-CE 3.6Å; F31-M258 HydrophobicContact CB-CG 3.99Å; F31-M258 HydrophobicContact CB-SD 3.63Å; F31-M258 HydrophobicContact CD1-CB 4.27Å; F31-M258 HydrophobicContact CD1-CE 2.33Å; F31-M258 HydrophobicContact CD1-CG 2.75Å; F31-M258 HydrophobicContact CD1-SD 2.48Å; F31-M258 WeakPolarHBondContact CD1-SD 3.46Å; F31-M258 HydrophobicContact CD2-CE 2.34Å; F31-M258 HydrophobicContact CD2-CG 3.99Å; F31-M258 HydrophobicContact CD2-SD 2.46Å; F31-M258 WeakPolarHBondContact CD2-SD 3.4Å; F31-M258 HydrophobicContact CE1-CB 4.46Å; F31-M258 HydrophobicContact CE1-CE 2.34Å; F31-M258 HydrophobicContact CE1-CG 3.07Å; F31-M258 HydrophobicContact CE1-SD 2.47Å; F31-M258 WeakPolarHBondContact CE1-SD 3.36Å; F31-M258 HydrophobicContact CE2-CE 2.34Å; F31-M258 HydrophobicContact CE2-CG 4.23Å; F31-M258 HydrophobicContact CE2-SD 2.46Å; F31-M258 WeakPolarHBondContact CE2-SD 3.48Å; F31-M258 HydrophobicContact CG-CE 2.34Å; F31-M258 HydrophobicContact CG-CG 3.28Å; F31-M258 HydrophobicContact CG-SD 2.46Å; F31-M258 WeakPolarHBondContact CG-SD 3.08Å; F31-M258 HydrophobicContact CZ-CE 2.35Å; F31-M258 HydrophobicContact CZ-CG 3.83Å; F31-M258 HydrophobicContact CZ-SD 2.47Å; F31-M258 WeakPolarHBondContact CZ-SD 3.47Å; F31-L261 HydrophobicContact CD2-CD2 4.35Å; F31-L261 HydrophobicContact CE2-CD2 3.58Å |
| 32 | A | 62.8 | Low | 60.7 | Low | 49 Ų | 49 | 46.8 Ų | 46.8 | 41% | 0.405 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -63.6 | -42.3 | 167.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | L28 S29 S35 Q36 | L28-A32 PolarHBondContact O-N 2.97Å; S29-A32 PolarHBondContact O-N 2.85Å; A32-S35 WeakPolarHBondContact O-CB 3.16Å; A32-S35 PolarHBondContact O-N 2.78Å; A32-Q36 PolarHBondContact O-N 2.78Å; A32-Q36 VanDerWaalsContact O-N 3.13Å |
| 33 | Y | 63.6 | Low | 61.1 | Low | 123 Ų | 123 | 46.7 Ų | 46.7 | 48% | 0.482 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -63.9 | -42.2 | 174.8 | -170.9 | -98.4 | 0 | 0 | 0 | 112.5 | S29 G30 S35 Q36 L37 V125 | S29-Y33 PolarHBondContact O-N 3.07Å; G30-Y33 PolarHBondContact O-N 3.01Å; Y33-S35 VanDerWaalsContact C-N 3.3Å; Y33-S35 PolarHBondContact O-N 2.86Å; Y33-Q36 PolarHBondContact O-N 3.33Å; Y33-L37 HydrophobicContact CE1-CD1 4.11Å; Y33-L37 PolarHBondContact O-N 3.14Å; Y33-V125 HydrophobicContact CD1-CG2 4.36Å; Y33-V125 HydrophobicContact CE1-CG2 3.88Å |
| 34 | F | 66.5 | Low | 61.4 | Low | 4 Ų | 4 | 53.7 Ų | 53.7 | 2% | 0.018 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -56.5 | -41.6 | 172.7 | 170.9 | -99 | 0 | 0 | 0 | 112.4 | G30 F31 L37 M38 L124 L128 L251 T254 V255 | G30-F34 WeakPolarHBondContact O-CB 3.4Å; G30-F34 PolarHBondContact O-N 3.11Å; F31-F34 PolarHBondContact O-N 3.01Å; F34-L37 PolarHBondContact O-N 3.13Å; F34-M38 HydrophobicContact CE1-CG 4.31Å; F34-M38 HydrophobicContact CZ-CG 4.23Å; F34-M38 PolarHBondContact O-N 2.93Å; F34-L124 HydrophobicContact CB-CD2 4.45Å; F34-L124 HydrophobicContact CD2-CD1 4.15Å; F34-L124 HydrophobicContact CD2-CD2 3.95Å; F34-L124 HydrophobicContact CD2-CG 4.34Å; F34-L124 HydrophobicContact CE2-CD1 4.23Å; F34-L128 HydrophobicContact CD2-CD1 3.85Å; F34-L128 HydrophobicContact CE2-CD1 4.05Å; F34-L251 HydrophobicContact CE2-CD2 3.58Å; F34-L251 HydrophobicContact CZ-CD2 3.54Å; F34-T254 HydrophobicContact CD1-CG2 3.93Å; F34-T254 HydrophobicContact CD2-CG2 3.87Å; F34-T254 HydrophobicContact CE1-CG2 3.8Å; F34-T254 HydrophobicContact CE2-CG2 3.71Å; F34-T254 HydrophobicContact CG-CG2 3.96Å; F34-T254 HydrophobicContact CZ-CG2 3.67Å; F34-V255 HydrophobicContact CE1-CG2 3.88Å; F34-V255 HydrophobicContact CZ-CG2 4.49Å |
| 35 | S | 64.2 | Low | 61.2 | Low | 4 Ų | 4 | 54.2 Ų | 54.2 | 3% | 0.028 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -61.9 | -45.8 | 175 | -170.8 | 0 | 0 | 0 | 0 | 112.1 | F31 A32 Y33 L37 M38 L39 | F31-S35 PolarHBondContact O-N 3.45Å; F31-S35 VanDerWaalsContact O-N 3.08Å; A32-S35 WeakPolarHBondContact O-CB 3.16Å; A32-S35 PolarHBondContact O-N 2.78Å; Y33-S35 VanDerWaalsContact C-N 3.3Å; Y33-S35 PolarHBondContact O-N 2.86Å; S35-L37 VanDerWaalsContact C-N 3.32Å; S35-L37 PolarHBondContact O-N 2.78Å; S35-M38 WeakPolarHBondContact O-CB 3.21Å; S35-M38 PolarHBondContact O-N 3.47Å; S35-L39 WeakPolarHBondContact O-CG 3.29Å; S35-L39 PolarHBondContact O-N 3.49Å |
| 36 | Q | 66.3 | Low | 61.4 | Low | 100 Ų | 100 | 50.3 Ų | 50.3 | 47% | 0.467 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -61.9 | -38.9 | 174.2 | -65.9 | -176.7 | 6 | 0 | 0 | 112.4 | A32 Y33 M38 L39 N40 | A32-Q36 PolarHBondContact O-N 2.78Å; A32-Q36 VanDerWaalsContact O-N 3.13Å; Y33-Q36 PolarHBondContact O-N 3.33Å; Q36-M38 VanDerWaalsContact C-N 3.31Å; Q36-M38 PolarHBondContact O-N 3.33Å; Q36-L39 PolarHBondContact O-N 3.39Å; Q36-N40 PolarHBondContact O-N 3.4Å; Q36-N40 VanDerWaalsContact O-N 3.16Å; Q36-N40 PolarHBondContact O-ND2 2.9Å |
| 37 | L | 64.8 | Low | 61.1 | Low | 25 Ų | 25 | 57.9 Ų | 57.9 | 13% | 0.131 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -67.9 | -31.5 | 178 | -147.7 | 79.9 | 0 | 0 | 0 | 112.2 | Y33 F34 S35 N40 T41 L128 | Y33-L37 HydrophobicContact CE1-CD1 4.11Å; Y33-L37 PolarHBondContact O-N 3.14Å; F34-L37 PolarHBondContact O-N 3.13Å; S35-L37 VanDerWaalsContact C-N 3.32Å; S35-L37 PolarHBondContact O-N 2.78Å; L37-N40 PolarHBondContact O-N 2.95Å; L37-T41 VanDerWaalsContact O-CB 3.28Å; L37-T41 WeakPolarHBondContact O-CB 3.31Å; L37-T41 PolarHBondContact O-N 3.25Å; L37-T41 PolarHBondContact O-OG1 2.89Å; L37-L128 HydrophobicContact CD2-CB 3.58Å; L37-L128 HydrophobicContact CD2-CD1 3.61Å; L37-L128 HydrophobicContact CD2-CG 4.2Å |
| 38 | M | 64.4 | Low | 60.8 | Low | 10 Ų | 10 | 64 Ų | 64 | 5% | 0.049 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -62.4 | -46.5 | 171.9 | -89.9 | -67.1 | -72 | 0 | 0 | 112.4 | F34 S35 Q36 N40 T41 E42 V228 I240 L251 | F34-M38 HydrophobicContact CE1-CG 4.31Å; F34-M38 HydrophobicContact CZ-CG 4.23Å; F34-M38 PolarHBondContact O-N 2.93Å; S35-M38 WeakPolarHBondContact O-CB 3.21Å; S35-M38 PolarHBondContact O-N 3.47Å; Q36-M38 VanDerWaalsContact C-N 3.31Å; Q36-M38 PolarHBondContact O-N 3.33Å; M38-N40 PolarHBondContact O-N 2.86Å; M38-T41 WeakPolarHBondContact O-CB 3.48Å; M38-T41 PolarHBondContact O-N 2.92Å; M38-T41 VanDerWaalsContact O-N 3.17Å; M38-E42 PolarHBondContact O-N 3.17Å; M38-V228 HydrophobicContact CE-CG2 4.18Å; M38-I240 HydrophobicContact CE-CD1 4Å; M38-L251 HydrophobicContact CE-CD1 3.98Å; M38-L251 HydrophobicContact CG-CD2 4.14Å; M38-L251 HydrophobicContact SD-CD1 3.54Å; M38-L251 VanDerWaalsContact SD-CD1 3.54Å; M38-L251 HydrophobicContact SD-CD2 3.37Å; M38-L251 WeakPolarHBondContact SD-CD2 3.19Å; M38-L251 HydrophobicContact SD-CG 4.04Å |
| 39 | L | 64.2 | Low | 60.4 | Low | 35 Ų | 35 | 61.8 Ų | 61.8 | 18% | 0.183 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -59 | -45.9 | 175.7 | -56.9 | 170 | 0 | 0 | 0 | 111.8 | S35 Q36 T41 E42 N43 L193 L200 | S35-L39 WeakPolarHBondContact O-CG 3.29Å; S35-L39 PolarHBondContact O-N 3.49Å; Q36-L39 PolarHBondContact O-N 3.39Å; L39-T41 VanDerWaalsContact C-N 3.29Å; L39-T41 PolarHBondContact O-N 2.71Å; L39-E42 PolarHBondContact O-N 3.44Å; L39-N43 PolarHBondContact O-N 3Å; L39-N43 PolarHBondContact O-ND2 3.31Å; L39-L193 HydrophobicContact CD2-CD1 3.96Å; L39-L193 HydrophobicContact CD2-CD2 3.76Å; L39-L193 HydrophobicContact CD2-CG 3.95Å; L39-L200 HydrophobicContact CD1-CD1 3.76Å; L39-L200 HydrophobicContact CD1-CD2 4.27Å; L39-L200 HydrophobicContact CD2-CD1 3.77Å; L39-L200 HydrophobicContact CG-CD1 4.24Å |
| 40 | N | 63.2 | Low | 59.9 | Low | 104 Ų | 104 | 65.1 Ų | 65.1 | 56% | 0.556 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -66.7 | -31.7 | 177.9 | -76.5 | -33.7 | 0 | 0 | 0 | 112.4 | Q36 L37 M38 K44 | Q36-N40 PolarHBondContact O-N 3.4Å; Q36-N40 VanDerWaalsContact O-N 3.16Å; Q36-N40 PolarHBondContact O-ND2 2.9Å; L37-N40 PolarHBondContact O-N 2.95Å; M38-N40 PolarHBondContact O-N 2.86Å; N40-K44 PolarHBondContact O-N 3.34Å |
| 41 | T | 61.1 | Low | 59.6 | Low | 22 Ų | 22 | 72.4 Ų | 72.4 | 14% | 0.135 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -70.1 | -42.5 | 174.4 | -60.9 | 0 | 0 | 0 | 0 | 111 | L37 M38 L39 K44 I45 I240 | L37-T41 VanDerWaalsContact O-CB 3.28Å; L37-T41 WeakPolarHBondContact O-CB 3.31Å; L37-T41 PolarHBondContact O-N 3.25Å; L37-T41 PolarHBondContact O-OG1 2.89Å; M38-T41 WeakPolarHBondContact O-CB 3.48Å; M38-T41 PolarHBondContact O-N 2.92Å; M38-T41 VanDerWaalsContact O-N 3.17Å; L39-T41 VanDerWaalsContact C-N 3.29Å; L39-T41 PolarHBondContact O-N 2.71Å; T41-K44 PolarHBondContact O-N 3.05Å; T41-I45 HydrophobicContact CG2-CD1 3.63Å; T41-I45 HydrophobicContact CG2-CG1 4.4Å; T41-I45 WeakPolarHBondContact O-CB 3.35Å; T41-I45 WeakPolarHBondContact O-CG1 3.44Å; T41-I45 PolarHBondContact O-N 3.33Å; T41-I240 HydrophobicContact CG2-CG2 4.24Å |
| 42 | E | 58.7 | Low | 58.7 | Low | 16 Ų | 16 | 74.8 Ų | 74.8 | 8% | 0.075 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -60.9 | -51 | 173.8 | -170.8 | 171.7 | 146.7 | 0 | 0 | 111.7 | M38 L39 K44 I45 S46 L193 I240 | M38-E42 PolarHBondContact O-N 3.17Å; L39-E42 PolarHBondContact O-N 3.44Å; E42-K44 PolarHBondContact O-N 2.91Å; E42-I45 PolarHBondContact O-N 3.41Å; E42-S46 VanDerWaalsContact CG-OG 3.23Å; E42-S46 WeakPolarHBondContact CG-OG 3.4Å; E42-S46 WeakPolarHBondContact O-CB 3.49Å; E42-S46 PolarHBondContact O-N 3.14Å; E42-S46 PolarHBondContact O-OG 3Å; E42-L193 WeakPolarHBondContact OE2-CD1 3.22Å; E42-L193 WeakPolarHBondContact OE2-CD2 3.46Å; E42-I240 HydrophobicContact CB-CD1 4.02Å; E42-I240 HydrophobicContact CB-CG1 4.31Å; E42-I240 HydrophobicContact CB-CG2 4.23Å; E42-I240 HydrophobicContact CG-CD1 4.12Å; E42-I240 HydrophobicContact CG-CG1 4.05Å; E42-I240 WeakPolarHBondContact OE2-CD1 2.94Å |
| 43 | N | 58.6 | Low | 58.1 | Low | 94 Ų | 94 | 79.2 Ų | 79.2 | 50% | 0.503 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -55.7 | -27.9 | -179.7 | -80.3 | -43.5 | 0 | 0 | 0 | 113.3 | L39 | L39-N43 PolarHBondContact O-N 3Å; L39-N43 PolarHBondContact O-ND2 3.31Å |
| 44 | K | 58.2 | Low | 57.4 | Low | 162 Ų | 162 | 80.9 Ų | 80.9 | 70% | 0.704 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -88.4 | -24.4 | 177.3 | -162.2 | 170.4 | -173.3 | 173.3 | 0 | 113.7 | N40 T41 E42 | N40-K44 PolarHBondContact O-N 3.34Å; T41-K44 PolarHBondContact O-N 3.05Å; E42-K44 PolarHBondContact O-N 2.91Å |
| 45 | I | 54 | Low | 56.6 | Low | 37 Ų | 37 | 86.9 Ų | 86.9 | 19% | 0.19 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -97.7 | -37.5 | -178.3 | -66.7 | 178.5 | 0 | 0 | 0 | 112.4 | T41 E42 R47 K48 L49 I240 | T41-I45 HydrophobicContact CG2-CD1 3.63Å; T41-I45 HydrophobicContact CG2-CG1 4.4Å; T41-I45 WeakPolarHBondContact O-CB 3.35Å; T41-I45 WeakPolarHBondContact O-CG1 3.44Å; T41-I45 PolarHBondContact O-N 3.33Å; E42-I45 PolarHBondContact O-N 3.41Å; I45-R47 PolarHBondContact O-N 3.28Å; I45-K48 CarbonylContact O-C 3.44Å; I45-K48 WeakPolarHBondContact O-CA 3.43Å; I45-K48 WeakPolarHBondContact O-CB 3.41Å; I45-K48 PolarHBondContact O-N 3.12Å; I45-L49 HydrophobicContact CG2-CD1 3.94Å; I45-L49 HydrophobicContact CG2-CG 3.91Å; I45-L49 PolarHBondContact O-N 3.48Å; I45-I240 HydrophobicContact CD1-CG2 4.27Å; I45-I240 VanDerWaalsContact CD1-O 3.29Å; I45-I240 WeakPolarHBondContact CD1-O 3.46Å |
| 46 | S | 55.3 | Low | 56 | Low | 29 Ų | 29 | 92.4 Ų | 92.4 | 20% | 0.203 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -59.2 | -30.9 | 175.6 | -68.4 | 0 | 0 | 0 | 0 | 112.3 | E42 K48 L50 | E42-S46 VanDerWaalsContact CG-OG 3.23Å; E42-S46 WeakPolarHBondContact CG-OG 3.4Å; E42-S46 WeakPolarHBondContact O-CB 3.49Å; E42-S46 PolarHBondContact O-N 3.14Å; E42-S46 PolarHBondContact O-OG 3Å; S46-K48 VanDerWaalsContact C-N 3.28Å; S46-K48 PolarHBondContact O-N 2.96Å; S46-L50 PolarHBondContact O-N 3.37Å |
| 47 | R | 52.9 | Low | 55.7 | Low | 210 Ų | 210 | 93.4 Ų | 93.4 | 79% | 0.792 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -64.3 | -25.9 | 169.3 | -69.7 | -175.8 | -176.5 | -165.5 | 1.2 | 114.2 | I45 | I45-R47 PolarHBondContact O-N 3.28Å |
| 48 | K | 51.7 | Low | 55.9 | Low | 141 Ų | 141 | 95.9 Ų | 95.9 | 61% | 0.613 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -94.7 | -27.8 | 177.1 | -66.1 | -164.6 | 170.2 | -152 | 0 | 113.6 | I45 S46 L50 E51 K52 | I45-K48 CarbonylContact O-C 3.44Å; I45-K48 WeakPolarHBondContact O-CA 3.43Å; I45-K48 WeakPolarHBondContact O-CB 3.41Å; I45-K48 PolarHBondContact O-N 3.12Å; S46-K48 VanDerWaalsContact C-N 3.28Å; S46-K48 PolarHBondContact O-N 2.96Å; K48-L50 VanDerWaalsContact C-N 3.32Å; K48-E51 WeakPolarHBondContact O-CB 3.17Å; K48-E51 PolarHBondContact O-N 2.91Å; K48-K52 PolarHBondContact O-N 2.97Å |
| 49 | L | 50.5 | Low | 56.4 | Low | 27 Ų | 27 | 98.9 Ų | 98.9 | 14% | 0.141 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -68.7 | -35 | 175.5 | -69.4 | 173.9 | 0 | 0 | 0 | 111.3 | I45 E51 K52 | I45-L49 HydrophobicContact CG2-CD1 3.94Å; I45-L49 HydrophobicContact CG2-CG 3.91Å; I45-L49 PolarHBondContact O-N 3.48Å; L49-E51 PolarHBondContact O-N 3.3Å; L49-K52 CarbonylContact O-C 3.52Å; L49-K52 PolarHBondContact O-N 2.97Å |
| 50 | L | 51.4 | Low | 57.4 | Low | 148 Ų | 148 | 105.6 Ų | 105.6 | 78% | 0.775 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.6 | -12.7 | 173.5 | -155 | 137.6 | 0 | 0 | 0 | 113.2 | S46 K48 | S46-L50 PolarHBondContact O-N 3.37Å; K48-L50 VanDerWaalsContact C-N 3.32Å |
| 51 | E | 52.1 | Low | 58.5 | Low | 163 Ų | 163 | 101.2 Ų | 101.2 | 76% | 0.762 | 48% | 0.483 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.1 | -8.4 | 176.3 | -167.5 | 177.1 | -135.7 | 0 | 0 | 112.2 | K48 L49 | K48-E51 WeakPolarHBondContact O-CB 3.17Å; K48-E51 PolarHBondContact O-N 2.91Å; L49-E51 PolarHBondContact O-N 3.3Å |
| 52 | K | 48.3 | Very low | 59.6 | Low | 67 Ų | 67 | 104.7 Ų | 104.7 | 29% | 0.291 | 49% | 0.493 | S | S | . | . | trans | -127.8 | 46.7 | -174.1 | -160 | -151.3 | 175.8 | -154.5 | 0 | 112.3 | K48 L49 F55 H236 D243 | K48-K52 PolarHBondContact O-N 2.97Å; L49-K52 CarbonylContact O-C 3.52Å; L49-K52 PolarHBondContact O-N 2.97Å; K52-F55 HydrophobicContact CD-CD2 4.36Å; K52-F55 HydrophobicContact CG-CD2 3.98Å; K52-F55 HydrophobicContact CG-CE2 4.2Å; K52-H236 PolarHBondContact O-CE1 3.42Å; K52-H236 VanDerWaalsContact O-CE1 3.32Å; K52-D243 IonicContact NZ-OD2 3.64Å; K52-D243 PolarHBondContact NZ-OD2 3.34Å | ||
| 53 | E | 49.7 | Very low | 61 | Low | 142 Ų | 142 | 109.5 Ų | 109.5 | 66% | 0.664 | 51% | 0.514 | S | S | * | . | trans | -64.6 | 160.3 | 168.3 | -63.3 | -162.2 | 147.5 | 0 | 0 | 111.6 | ||||
| 54 | I | 49.4 | Very low | 62.6 | Low | 159 Ų | 159 | 109.1 Ų | 109.1 | 82% | 0.815 | 51% | 0.509 | S | S | * | . | trans | 60.1 | 54.8 | 170.9 | -28.4 | -179.4 | 0 | 0 | 0 | 116.2 | ||||
| 55 | F | 48.9 | Very low | 64.2 | Low | 130 Ų | 130 | 101.4 Ų | 101.4 | 57% | 0.57 | 48% | 0.476 | S | S | * | . | trans | -114.3 | 133.5 | 155.4 | -80.9 | -87.9 | 0 | 0 | 0 | 111.5 | K52 | K52-F55 HydrophobicContact CD-CD2 4.36Å; K52-F55 HydrophobicContact CG-CD2 3.98Å; K52-F55 HydrophobicContact CG-CE2 4.2Å | ||
| 56 | P | 53.2 | Low | 66 | Low | 120 Ų | 120 | 103.6 Ų | 103.6 | 78% | 0.779 | 49% | 0.487 | S | S | * | . | trans | -69.4 | 146.2 | -179.6 | 28.6 | -34.5 | 0 | 0 | 0 | 111.7 | D58 | P56-D58 PolarHBondContact O-N 3.49Š| ||
| 57 | F | 58.8 | Low | 67.9 | Low | 121 Ų | 121 | 106.6 Ų | 106.6 | 53% | 0.531 | 50% | 0.504 | S | S | . | . | trans | -64.6 | 113.1 | -179.1 | 176.6 | -92.9 | 0 | 0 | 0 | 111.8 | P59 W62 | F57-P59 VanDerWaalsContact O-CD 3.29Å; F57-P59 WeakPolarHBondContact O-CD 3.22Å; F57-W62 AromaticContact CE1-CD1 3.48Å; F57-W62 VanDerWaalsContact CE1-CD1 3.48Å; F57-W62 AromaticContact CE1-NE1 3.89Å; F57-W62 HydrophobicContact CZ-CB 4.37Å; F57-W62 AromaticContact CZ-CD1 3.45Å; F57-W62 VanDerWaalsContact CZ-CD1 3.45Å; F57-W62 HydrophobicContact CZ-CG 4.18Å | ||
| 58 | D | 69.7 | Low | 69.9 | Low | 77 Ų | 77 | 97.3 Ų | 97.3 | 41% | 0.412 | 47% | 0.47 | S | S | . | . | trans | -75 | 116 | 172.9 | -173.4 | -10.6 | 0 | 0 | 0 | 110.6 | P56 R60 Y61 | P56-D58 PolarHBondContact O-N 3.49Å; D58-R60 PolarHBondContact O-N 2.79Å; D58-R60 WeakPolarHBondContact OD1-CB 3.29Å; D58-R60 WeakPolarHBondContact OD1-CD 3.45Å; D58-R60 WeakPolarHBondContact OD1-CG 3.36Å; D58-R60 PolarHBondContact OD1-N 3.45Å; D58-R60 WeakPolarHBondContact OD2-CD 3.23Å; D58-Y61 PolarHBondContact O-N 2.94Å | ||
| 59 | P | 75.3 | Confident | 72 | Confident | 72 Ų | 72 | 90.9 Ų | 90.9 | 47% | 0.468 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -67.4 | -2.3 | 176.9 | 30.5 | -37.1 | 0 | 0 | 0 | 114.2 | F57 W62 K63 | F57-P59 VanDerWaalsContact O-CD 3.29Å; F57-P59 WeakPolarHBondContact O-CD 3.22Å; P59-W62 PolarHBondContact O-NE1 3.37Å; P59-W62 VanDerWaalsContact O-NE1 3.14Å; P59-K63 WeakPolarHBondContact O-CD 3.44Å; P59-K63 WeakPolarHBondContact O-CG 3.48Å |
| 60 | R | 83.5 | Confident | 74.1 | Confident | 177 Ų | 177 | 91 Ų | 91 | 67% | 0.668 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -76.6 | -35.2 | 171.1 | -62 | 165.5 | -179.7 | 179.6 | -0.9 | 112.2 | D58 K63 Q64 | D58-R60 PolarHBondContact O-N 2.79Å; D58-R60 WeakPolarHBondContact OD1-CB 3.29Å; D58-R60 WeakPolarHBondContact OD1-CD 3.45Å; D58-R60 WeakPolarHBondContact OD1-CG 3.36Å; D58-R60 PolarHBondContact OD1-N 3.45Å; D58-R60 WeakPolarHBondContact OD2-CD 3.23Å; R60-K63 PolarHBondContact O-N 3.35Å; R60-Q64 WeakPolarHBondContact O-CG 3.39Å; R60-Q64 PolarHBondContact O-N 3.2Å |
| 61 | Y | 86.9 | Confident | 76.3 | Confident | 11 Ų | 11 | 87.7 Ų | 87.7 | 4% | 0.043 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -57.2 | -55.6 | -177.5 | 162 | -91.6 | 0 | 0 | 0 | 111.8 | D58 K63 Q64 V65 T232 R239 G242 A248 | D58-Y61 PolarHBondContact O-N 2.94Å; Y61-K63 VanDerWaalsContact C-N 3.28Å; Y61-K63 PolarHBondContact O-N 3.25Å; Y61-Q64 PolarHBondContact O-N 3.5Å; Y61-Q64 VanDerWaalsContact O-N 3.12Å; Y61-V65 HydrophobicContact CD2-CG2 4.31Å; Y61-V65 HydrophobicContact CE1-CG2 4.26Å; Y61-V65 HydrophobicContact CE2-CG2 3.97Å; Y61-V65 WeakPolarHBondContact O-CG2 3.25Å; Y61-V65 PolarHBondContact O-N 3.49Å; Y61-T232 WeakPolarHBondContact CE1-O 3.4Å; Y61-T232 PolarHBondContact OH-O 2.88Å; Y61-R239 VanDerWaalsContact CE1-NH2 3.31Å; Y61-G242 VanDerWaalsContact CE2-O 3.31Å; Y61-G242 WeakPolarHBondContact CE2-O 3.02Å; Y61-A248 HydrophobicContact CE2-CB 4.39Å; Y61-A248 WeakPolarHBondContact OH-CB 3.38Å |
| 62 | W | 84.1 | Confident | 78.5 | Confident | 96 Ų | 96 | 79.9 Ų | 79.9 | 36% | 0.364 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -66.4 | -32.7 | -175.1 | 68.5 | -94.5 | 0 | 0 | 0 | 112.1 | F57 P59 V65 L66 | F57-W62 AromaticContact CE1-CD1 3.48Å; F57-W62 VanDerWaalsContact CE1-CD1 3.48Å; F57-W62 AromaticContact CE1-NE1 3.89Å; F57-W62 HydrophobicContact CZ-CB 4.37Å; F57-W62 AromaticContact CZ-CD1 3.45Å; F57-W62 VanDerWaalsContact CZ-CD1 3.45Å; F57-W62 HydrophobicContact CZ-CG 4.18Å; P59-W62 PolarHBondContact O-NE1 3.37Å; P59-W62 VanDerWaalsContact O-NE1 3.14Å; W62-V65 PolarHBondContact O-N 2.92Å; W62-L66 HydrophobicContact CE3-CD1 3.8Å; W62-L66 HydrophobicContact CZ3-CD1 4.05Å; W62-L66 WeakPolarHBondContact O-CG 3.34Å; W62-L66 PolarHBondContact O-N 2.96Å |
| 63 | K | 89 | Confident | 80.8 | Confident | 116 Ų | 116 | 78.1 Ų | 78.1 | 50% | 0.504 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -64.9 | -44 | 173.1 | -66.9 | -178.1 | -179 | -173.1 | 0 | 111.5 | P59 R60 Y61 L66 V67 | P59-K63 WeakPolarHBondContact O-CD 3.44Å; P59-K63 WeakPolarHBondContact O-CG 3.48Å; R60-K63 PolarHBondContact O-N 3.35Å; Y61-K63 VanDerWaalsContact C-N 3.28Å; Y61-K63 PolarHBondContact O-N 3.25Å; K63-L66 PolarHBondContact O-N 2.88Å; K63-V67 VanDerWaalsContact O-CB 3.32Å; K63-V67 WeakPolarHBondContact O-CB 3.43Å; K63-V67 VanDerWaalsContact O-CG2 3.23Å; K63-V67 WeakPolarHBondContact O-CG2 3.28Å; K63-V67 PolarHBondContact O-N 3.21Å |
| 64 | Q | 91 | Very high | 83.1 | Confident | 86 Ų | 86 | 76.3 Ų | 76.3 | 40% | 0.402 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -63.4 | -42.2 | 176 | -74 | 172.1 | -20.2 | 0 | 0 | 112 | R60 Y61 L68 Y245 | R60-Q64 WeakPolarHBondContact O-CG 3.39Å; R60-Q64 PolarHBondContact O-N 3.2Å; Y61-Q64 PolarHBondContact O-N 3.5Å; Y61-Q64 VanDerWaalsContact O-N 3.12Å; Q64-L68 WeakPolarHBondContact O-CB 3.49Å; Q64-L68 WeakPolarHBondContact O-CG 3.4Å; Q64-L68 PolarHBondContact O-N 3.38Å; Q64-Y245 HydrophobicContact CB-CD2 4.27Å; Q64-Y245 HydrophobicContact CB-CG 4.11Å |
| 65 | V | 92.3 | Very high | 85.3 | Confident | 0 Ų | 0 | 71.1 Ų | 71.1 | 0% | 0 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -61.6 | -50.2 | 175.7 | 176.9 | 0 | 0 | 0 | 0 | 111.3 | Y61 W62 L68 L69 F233 A248 L252 | Y61-V65 HydrophobicContact CD2-CG2 4.31Å; Y61-V65 HydrophobicContact CE1-CG2 4.26Å; Y61-V65 HydrophobicContact CE2-CG2 3.97Å; Y61-V65 WeakPolarHBondContact O-CG2 3.25Å; Y61-V65 PolarHBondContact O-N 3.49Å; W62-V65 PolarHBondContact O-N 2.92Å; V65-L68 PolarHBondContact O-N 2.93Å; V65-L69 WeakPolarHBondContact O-CB 3.32Å; V65-L69 PolarHBondContact O-N 3.04Å; V65-F233 HydrophobicContact CG1-CE1 4.18Å; V65-F233 HydrophobicContact CG1-CZ 3.87Å; V65-A248 HydrophobicContact CG1-CB 3.98Å; V65-A248 HydrophobicContact CG2-CB 3.65Å; V65-L252 HydrophobicContact CG1-CD1 3.55Å |
| 66 | L | 92.9 | Very high | 87.6 | Confident | 83 Ų | 83 | 64.9 Ų | 64.9 | 44% | 0.435 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -68.4 | -35 | -179.3 | -68.8 | -177.4 | 0 | 0 | 0 | 113.3 | W62 K63 G70 F233 | W62-L66 HydrophobicContact CE3-CD1 3.8Å; W62-L66 HydrophobicContact CZ3-CD1 4.05Å; W62-L66 WeakPolarHBondContact O-CG 3.34Å; W62-L66 PolarHBondContact O-N 2.96Å; K63-L66 PolarHBondContact O-N 2.88Å; L66-G70 PolarHBondContact O-N 3.2Å; L66-F233 HydrophobicContact CD2-CE1 4.23Å; L66-F233 HydrophobicContact CD2-CZ 3.71Å; L66-F233 HydrophobicContact CG-CE1 4.39Å; L66-F233 HydrophobicContact CG-CZ 4.33Å |
| 67 | V | 94.6 | Very high | 89.6 | Confident | 92 Ų | 92 | 61.3 Ų | 61.3 | 56% | 0.558 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -67.9 | -45.7 | 176 | 167.6 | 0 | 0 | 0 | 0 | 111.1 | K63 G70 I71 | K63-V67 VanDerWaalsContact O-CB 3.32Å; K63-V67 WeakPolarHBondContact O-CB 3.43Å; K63-V67 VanDerWaalsContact O-CG2 3.23Å; K63-V67 WeakPolarHBondContact O-CG2 3.28Å; K63-V67 PolarHBondContact O-N 3.21Å; V67-G70 PolarHBondContact O-N 3.19Å; V67-I71 HydrophobicContact CG1-CD1 4.04Å; V67-I71 WeakPolarHBondContact O-CD1 3.49Å; V67-I71 VanDerWaalsContact O-CG1 3.3Å; V67-I71 WeakPolarHBondContact O-CG1 3.24Å; V67-I71 PolarHBondContact O-N 3.28Å |
| 68 | L | 94.2 | Very high | 91.4 | Very high | 15 Ų | 15 | 57.6 Ų | 57.6 | 8% | 0.079 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -62.6 | -50.4 | 175.9 | -73.2 | 170.7 | 0 | 0 | 0 | 110.8 | Q64 V65 G70 I71 Q72 I141 L144 M145 Y245 S249 | Q64-L68 WeakPolarHBondContact O-CB 3.49Å; Q64-L68 WeakPolarHBondContact O-CG 3.4Å; Q64-L68 PolarHBondContact O-N 3.38Å; V65-L68 PolarHBondContact O-N 2.93Å; L68-G70 VanDerWaalsContact C-N 3.28Å; L68-G70 PolarHBondContact O-N 3.18Å; L68-I71 WeakPolarHBondContact O-CB 3.29Å; L68-I71 PolarHBondContact O-N 3.06Å; L68-I71 VanDerWaalsContact O-N 3.08Å; L68-Q72 VanDerWaalsContact O-CG 3.31Å; L68-Q72 WeakPolarHBondContact O-CG 3.23Å; L68-Q72 PolarHBondContact O-N 3.37Å; L68-I141 HydrophobicContact CD2-CG1 4.4Å; L68-I141 HydrophobicContact CD2-CG2 4.49Å; L68-L144 HydrophobicContact CB-CD2 4.39Å; L68-L144 HydrophobicContact CD1-CD2 4.12Å; L68-L144 HydrophobicContact CD2-CD2 4.38Å; L68-M145 HydrophobicContact CD2-CE 3.95Å; L68-Y245 HydrophobicContact CD1-CD2 3.61Å; L68-Y245 HydrophobicContact CD1-CE2 3.96Å; L68-S249 VanDerWaalsContact CB-OG 3.24Å; L68-S249 WeakPolarHBondContact CB-OG 3.4Å |
| 69 | L | 95.4 | Very high | 92.6 | Very high | 7 Ų | 7 | 55.4 Ų | 55.4 | 4% | 0.037 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -59.2 | -39 | 178.5 | -176.2 | 62.6 | 0 | 0 | 0 | 112.2 | V65 Q72 I73 F178 S249 L252 | V65-L69 WeakPolarHBondContact O-CB 3.32Å; V65-L69 PolarHBondContact O-N 3.04Å; L69-Q72 PolarHBondContact O-N 2.92Å; L69-I73 HydrophobicContact CG-CD1 4.08Å; L69-I73 WeakPolarHBondContact O-CB 3.39Å; L69-I73 WeakPolarHBondContact O-CD1 3.41Å; L69-I73 VanDerWaalsContact O-CG1 3.27Å; L69-I73 WeakPolarHBondContact O-CG1 3.4Å; L69-I73 PolarHBondContact O-N 2.94Å; L69-F178 HydrophobicContact CD2-CE1 3.91Å; L69-F178 HydrophobicContact CD2-CZ 3.99Å; L69-S249 PolarHBondContact N-OG 3.24Å; L69-S249 VanDerWaalsContact N-OG 3.14Å; L69-L252 HydrophobicContact CD1-CB 4.02Å; L69-L252 HydrophobicContact CD2-CB 3.84Å; L69-L252 HydrophobicContact CD2-CD1 4.09Å; L69-L252 HydrophobicContact CD2-CG 4.43Å |
| 70 | G | 96.2 | Very high | 93.5 | Very high | 29 Ų | 29 | 52 Ų | 52 | 30% | 0.299 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -61.8 | -43 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113 | L66 V67 L68 Q72 I73 V74 | L66-G70 PolarHBondContact O-N 3.2Å; V67-G70 PolarHBondContact O-N 3.19Å; L68-G70 VanDerWaalsContact C-N 3.28Å; L68-G70 PolarHBondContact O-N 3.18Å; G70-Q72 VanDerWaalsContact C-N 3.35Å; G70-I73 PolarHBondContact O-N 3.22Å; G70-V74 WeakPolarHBondContact O-CG2 3.24Å; G70-V74 PolarHBondContact O-N 3.25Å |
| 71 | I | 97 | Very high | 93.9 | Very high | 78 Ų | 78 | 45.9 Ų | 45.9 | 40% | 0.4 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -63.3 | -42.7 | 172.8 | -64.1 | 160.5 | 0 | 0 | 0 | 110.3 | V67 L68 I73 V74 L75 M145 | V67-I71 HydrophobicContact CG1-CD1 4.04Å; V67-I71 WeakPolarHBondContact O-CD1 3.49Å; V67-I71 VanDerWaalsContact O-CG1 3.3Å; V67-I71 WeakPolarHBondContact O-CG1 3.24Å; V67-I71 PolarHBondContact O-N 3.28Å; L68-I71 WeakPolarHBondContact O-CB 3.29Å; L68-I71 PolarHBondContact O-N 3.06Å; L68-I71 VanDerWaalsContact O-N 3.08Å; I71-I73 PolarHBondContact O-N 3.47Å; I71-V74 PolarHBondContact O-N 2.95Å; I71-L75 WeakPolarHBondContact O-CB 3.4Å; I71-L75 PolarHBondContact O-N 3.45Å; I71-M145 HydrophobicContact CB-CE 4.05Å; I71-M145 HydrophobicContact CD1-CE 4.38Å; I71-M145 HydrophobicContact CG2-CE 3.54Å; I71-M145 HydrophobicContact CG2-SD 3.87Å |
| 72 | Q | 97.6 | Very high | 94.2 | Very high | 0 Ų | 0 | 46.8 Ų | 46.8 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -63.5 | -39.5 | 178.7 | -63.7 | 177.6 | -81.5 | 0 | 0 | 112.2 | L68 L69 G70 S76 T148 S249 Y253 | L68-Q72 VanDerWaalsContact O-CG 3.31Å; L68-Q72 WeakPolarHBondContact O-CG 3.23Å; L68-Q72 PolarHBondContact O-N 3.37Å; L69-Q72 PolarHBondContact O-N 2.92Å; G70-Q72 VanDerWaalsContact C-N 3.35Å; Q72-S76 WeakPolarHBondContact O-CB 3.49Å; Q72-S76 PolarHBondContact O-N 2.98Å; Q72-S76 PolarHBondContact O-OG 3.19Å; Q72-T148 HydrophobicContact CB-CG2 4.08Å; Q72-T148 HydrophobicContact CG-CG2 4.31Å; Q72-T148 VanDerWaalsContact CG-OG1 3.27Å; Q72-T148 WeakPolarHBondContact CG-OG1 3.49Å; Q72-T148 PolarHBondContact NE2-OG1 3.2Å; Q72-S249 PolarHBondContact OE1-O 3.28Å; Q72-S249 PolarHBondContact OE1-OG 3.42Å; Q72-Y253 HydrophobicContact CB-CD2 3.55Å; Q72-Y253 HydrophobicContact CB-CE2 3.91Å; Q72-Y253 HydrophobicContact CB-CG 4.14Å; Q72-Y253 HydrophobicContact CG-CD2 4.42Å |
| 73 | I | 97.2 | Very high | 94.5 | Very high | 29 Ų | 29 | 43.7 Ų | 43.7 | 15% | 0.149 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -60.9 | -53.5 | 173.2 | -74 | 161.8 | 0 | 0 | 0 | 110.9 | L69 G70 I71 L75 S76 I77 L175 M256 | L69-I73 HydrophobicContact CG-CD1 4.08Å; L69-I73 WeakPolarHBondContact O-CB 3.39Å; L69-I73 WeakPolarHBondContact O-CD1 3.41Å; L69-I73 VanDerWaalsContact O-CG1 3.27Å; L69-I73 WeakPolarHBondContact O-CG1 3.4Å; L69-I73 PolarHBondContact O-N 2.94Å; G70-I73 PolarHBondContact O-N 3.22Å; I71-I73 PolarHBondContact O-N 3.47Å; I73-L75 VanDerWaalsContact C-N 3.3Å; I73-L75 PolarHBondContact O-N 3.05Å; I73-S76 PolarHBondContact O-N 3.46Å; I73-I77 HydrophobicContact CG2-CD1 3.69Å; I73-I77 WeakPolarHBondContact O-CG1 3.12Å; I73-I77 PolarHBondContact O-N 3.49Å; I73-L175 HydrophobicContact CD1-CD2 4.12Å; I73-L175 HydrophobicContact CG1-CD2 4.36Å; I73-L175 HydrophobicContact CG2-CD2 3.93Å; I73-M256 HydrophobicContact CD1-SD 3.91Å; I73-M256 HydrophobicContact CG1-CE 3.75Å; I73-M256 HydrophobicContact CG1-SD 3.47Å; I73-M256 WeakPolarHBondContact CG1-SD 3.39Å |
| 74 | V | 97.4 | Very high | 94.3 | Very high | 105 Ų | 105 | 39 Ų | 39 | 64% | 0.636 | 24% | 0.235 | S | C | * | . | H | α-helix | trans | -62.1 | -39.7 | -178.4 | 171.2 | 0 | 0 | 0 | 0 | 111.1 | G70 I71 G78 | G70-V74 WeakPolarHBondContact O-CG2 3.24Å; G70-V74 PolarHBondContact O-N 3.25Å; I71-V74 PolarHBondContact O-N 2.95Å; V74-G78 PolarHBondContact O-N 3.35Å |
| 75 | L | 96.8 | Very high | 94.1 | Very high | 49 Ų | 49 | 38.7 Ų | 38.7 | 26% | 0.257 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -65.6 | -43.6 | 177.3 | -173.3 | 52.5 | 0 | 0 | 0 | 111.9 | I71 I73 G78 I79 M145 T148 M149 | I71-L75 WeakPolarHBondContact O-CB 3.4Å; I71-L75 PolarHBondContact O-N 3.45Å; I73-L75 VanDerWaalsContact C-N 3.3Å; I73-L75 PolarHBondContact O-N 3.05Å; L75-G78 PolarHBondContact O-N 2.89Å; L75-I79 HydrophobicContact CD1-CD1 4.01Å; L75-I79 HydrophobicContact CD1-CG1 4.42Å; L75-I79 HydrophobicContact CG-CD1 4.06Å; L75-I79 VanDerWaalsContact O-CG1 3.31Å; L75-I79 WeakPolarHBondContact O-CG1 3.28Å; L75-I79 PolarHBondContact O-N 3.38Å; L75-M145 HydrophobicContact CD2-SD 4.27Å; L75-T148 HydrophobicContact CB-CG2 4.17Å; L75-T148 HydrophobicContact CD2-CG2 3.84Å; L75-T148 HydrophobicContact CG-CG2 4.07Å; L75-M149 HydrophobicContact CD1-CG 4.35Å; L75-M149 HydrophobicContact CD2-CG 3.68Å; L75-M149 HydrophobicContact CD2-SD 4.47Å; L75-M149 HydrophobicContact CG-CG 4.14Å |
| 76 | S | 96.9 | Very high | 93.7 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -64.7 | -44.3 | 174.8 | -75.6 | 0 | 0 | 0 | 0 | 113.4 | Q72 I73 G78 I79 T80 S152 W171 Y253 | Q72-S76 WeakPolarHBondContact O-CB 3.49Å; Q72-S76 PolarHBondContact O-N 2.98Å; Q72-S76 PolarHBondContact O-OG 3.19Å; I73-S76 PolarHBondContact O-N 3.46Å; S76-G78 VanDerWaalsContact C-N 3.32Å; S76-G78 PolarHBondContact O-N 3.41Å; S76-I79 PolarHBondContact O-N 3.02Å; S76-T80 WeakPolarHBondContact O-CB 3.28Å; S76-T80 PolarHBondContact O-N 3.49Å; S76-T80 PolarHBondContact O-OG1 2.96Å; S76-T80 VanDerWaalsContact O-OG1 3.11Å; S76-S152 WeakPolarHBondContact CA-OG 3.48Å; S76-S152 PolarHBondContact OG-OG 2.86Å; S76-W171 VanDerWaalsContact CB-CH2 3.48Å; S76-Y253 WeakPolarHBondContact OG-CE2 3.35Å; S76-Y253 PolarHBondContact OG-OH 3.37Å |
| 77 | I | 96 | Very high | 93.1 | Very high | 44 Ų | 44 | 42.2 Ų | 42.2 | 23% | 0.226 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -60.2 | -45.9 | 175.3 | -67.6 | 165.6 | 0 | 0 | 0 | 109.8 | I73 I79 T80 L81 W171 L175 | I73-I77 HydrophobicContact CG2-CD1 3.69Å; I73-I77 WeakPolarHBondContact O-CG1 3.12Å; I73-I77 PolarHBondContact O-N 3.49Å; I77-I79 PolarHBondContact O-N 3.42Å; I77-T80 PolarHBondContact O-N 2.87Å; I77-L81 HydrophobicContact CG2-CD1 3.74Å; I77-L81 HydrophobicContact CG2-CG 4.29Å; I77-L81 WeakPolarHBondContact O-CB 3.37Å; I77-L81 VanDerWaalsContact O-CG 3.29Å; I77-L81 WeakPolarHBondContact O-CG 3.17Å; I77-L81 PolarHBondContact O-N 3.47Å; I77-W171 HydrophobicContact CD1-CD2 4.31Å; I77-W171 HydrophobicContact CD1-CE3 4.26Å; I77-W171 HydrophobicContact CG1-CD2 3.52Å; I77-W171 HydrophobicContact CG1-CE3 3.79Å; I77-W171 HydrophobicContact CG1-CG 3.97Å; I77-W171 HydrophobicContact CG1-CH2 4.25Å; I77-W171 HydrophobicContact CG1-CZ2 3.99Å; I77-W171 HydrophobicContact CG1-CZ3 4.15Å; I77-L175 HydrophobicContact CD1-CD1 4.32Å |
| 78 | G | 95.9 | Very high | 92.2 | Very high | 44 Ų | 44 | 46.1 Ų | 46.1 | 45% | 0.454 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -58.8 | -43.3 | 177 | 0 | 0 | 0 | 0 | 0 | 113.3 | V74 L75 S76 G82 | V74-G78 PolarHBondContact O-N 3.35Å; L75-G78 PolarHBondContact O-N 2.89Å; S76-G78 VanDerWaalsContact C-N 3.32Å; S76-G78 PolarHBondContact O-N 3.41Å; G78-G82 PolarHBondContact O-N 3.16Å |
| 79 | I | 95.5 | Very high | 91.3 | Very high | 30 Ų | 30 | 51.5 Ų | 51.5 | 15% | 0.154 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -67.4 | -49.5 | 177 | -70.9 | 165.7 | 0 | 0 | 0 | 110.9 | L75 S76 I77 L81 G82 L83 M149 | L75-I79 HydrophobicContact CD1-CD1 4.01Å; L75-I79 HydrophobicContact CD1-CG1 4.42Å; L75-I79 HydrophobicContact CG-CD1 4.06Å; L75-I79 VanDerWaalsContact O-CG1 3.31Å; L75-I79 WeakPolarHBondContact O-CG1 3.28Å; L75-I79 PolarHBondContact O-N 3.38Å; S76-I79 PolarHBondContact O-N 3.02Å; I77-I79 PolarHBondContact O-N 3.42Å; I79-L81 VanDerWaalsContact C-N 3.33Å; I79-L81 PolarHBondContact O-N 2.87Å; I79-G82 PolarHBondContact O-N 3.23Å; I79-L83 HydrophobicContact CG2-CD1 3.72Å; I79-L83 HydrophobicContact CG2-CG 4.29Å; I79-L83 WeakPolarHBondContact O-CB 3.37Å; I79-L83 VanDerWaalsContact O-CG 3.26Å; I79-L83 WeakPolarHBondContact O-CG 3.42Å; I79-L83 PolarHBondContact O-N 2.67Å; I79-M149 HydrophobicContact CD1-CB 4.12Å; I79-M149 HydrophobicContact CD1-CG 4.06Å |
| 80 | T | 93.5 | Very high | 90.2 | Very high | 2 Ų | 2 | 57.4 Ų | 57.4 | 1% | 0.012 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -59.2 | -42 | 179.3 | -62.4 | 0 | 0 | 0 | 0 | 112.3 | S76 I77 T84 A156 K167 W260 | S76-T80 WeakPolarHBondContact O-CB 3.28Å; S76-T80 PolarHBondContact O-N 3.49Å; S76-T80 PolarHBondContact O-OG1 2.96Å; S76-T80 VanDerWaalsContact O-OG1 3.11Å; I77-T80 PolarHBondContact O-N 2.87Å; T80-T84 PolarHBondContact O-N 2.85Å; T80-T84 PolarHBondContact O-OG1 2.83Å; T80-A156 HydrophobicContact CG2-CB 4.23Å; T80-A156 WeakPolarHBondContact OG1-CB 3.31Å; T80-K167 HydrophobicContact CG2-CB 4.46Å; T80-K167 HydrophobicContact CG2-CD 4.13Å; T80-W260 HydrophobicContact CG2-CH2 3.86Å; T80-W260 HydrophobicContact CG2-CZ2 3.7Å |
| 81 | L | 92.5 | Very high | 88.8 | Confident | 48 Ų | 48 | 65.2 Ų | 65.2 | 25% | 0.251 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -73.3 | -41.9 | 177.1 | -64.1 | 179.1 | 0 | 0 | 0 | 111.7 | I77 I79 L83 T84 V85 I164 I168 | I77-L81 HydrophobicContact CG2-CD1 3.74Å; I77-L81 HydrophobicContact CG2-CG 4.29Å; I77-L81 WeakPolarHBondContact O-CB 3.37Å; I77-L81 VanDerWaalsContact O-CG 3.29Å; I77-L81 WeakPolarHBondContact O-CG 3.17Å; I77-L81 PolarHBondContact O-N 3.47Å; I79-L81 VanDerWaalsContact C-N 3.33Å; I79-L81 PolarHBondContact O-N 2.87Å; L81-L83 PolarHBondContact O-N 2.92Å; L81-T84 WeakPolarHBondContact O-CA 3.25Å; L81-T84 VanDerWaalsContact O-CB 3.27Å; L81-T84 WeakPolarHBondContact O-CB 3.39Å; L81-T84 PolarHBondContact O-N 3.33Å; L81-T84 VanDerWaalsContact O-N 3.08Å; L81-V85 PolarHBondContact O-N 2.94Å; L81-I164 HydrophobicContact CD2-CD1 4.07Å; L81-I164 HydrophobicContact CD2-CG1 3.86Å; L81-I168 HydrophobicContact CD2-CG1 4.22Å |
| 82 | G | 92.1 | Very high | 87.1 | Confident | 30 Ų | 30 | 68.7 Ų | 68.7 | 31% | 0.309 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -59.8 | -44.4 | 177 | 0 | 0 | 0 | 0 | 0 | 113.1 | G78 I79 T84 V85 I86 | G78-G82 PolarHBondContact O-N 3.16Å; I79-G82 PolarHBondContact O-N 3.23Å; G82-T84 VanDerWaalsContact C-N 3.26Å; G82-T84 PolarHBondContact O-N 3.08Å; G82-V85 PolarHBondContact O-N 3.31Å; G82-I86 WeakPolarHBondContact O-CG1 3.44Å; G82-I86 PolarHBondContact O-N 3.14Å |
| 83 | L | 90 | Very high | 85.2 | Confident | 31 Ų | 31 | 70.8 Ų | 70.8 | 16% | 0.162 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -60.4 | -35.6 | 173.6 | -69.7 | 166.9 | 0 | 0 | 0 | 112.3 | I79 L81 I86 Q87 L153 A156 L157 T160 | I79-L83 HydrophobicContact CG2-CD1 3.72Å; I79-L83 HydrophobicContact CG2-CG 4.29Å; I79-L83 WeakPolarHBondContact O-CB 3.37Å; I79-L83 VanDerWaalsContact O-CG 3.26Å; I79-L83 WeakPolarHBondContact O-CG 3.42Å; I79-L83 PolarHBondContact O-N 2.67Å; L81-L83 PolarHBondContact O-N 2.92Å; L83-I86 PolarHBondContact O-N 2.94Å; L83-Q87 PolarHBondContact O-N 2.66Å; L83-L153 HydrophobicContact CD1-CD1 3.77Å; L83-L153 HydrophobicContact CD2-CD1 3.77Å; L83-L153 HydrophobicContact CG-CD1 4.34Å; L83-A156 HydrophobicContact CD1-CB 3.92Å; L83-L157 HydrophobicContact CD2-CD2 4.35Å; L83-T160 HydrophobicContact CB-CG2 4.06Å |
| 84 | T | 86.1 | Confident | 83.3 | Confident | 18 Ų | 18 | 74.2 Ų | 74.2 | 11% | 0.11 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -65.6 | -42.6 | 175.9 | -52 | 0 | 0 | 0 | 0 | 111.5 | T80 L81 G82 Q87 Y88 I164 K167 | T80-T84 PolarHBondContact O-N 2.85Å; T80-T84 PolarHBondContact O-OG1 2.83Å; L81-T84 WeakPolarHBondContact O-CA 3.25Å; L81-T84 VanDerWaalsContact O-CB 3.27Å; L81-T84 WeakPolarHBondContact O-CB 3.39Å; L81-T84 PolarHBondContact O-N 3.33Å; L81-T84 VanDerWaalsContact O-N 3.08Å; G82-T84 VanDerWaalsContact C-N 3.26Å; G82-T84 PolarHBondContact O-N 3.08Å; T84-Q87 PolarHBondContact O-N 3.24Å; T84-Y88 PolarHBondContact O-N 3.46Å; T84-Y88 VanDerWaalsContact O-N 3.08Å; T84-I164 HydrophobicContact CG2-CB 4.23Å; T84-K167 WeakPolarHBondContact OG1-CD 3.23Å; T84-K167 PolarHBondContact OG1-NZ 3.46Å |
| 85 | V | 86.7 | Confident | 81.3 | Confident | 78 Ų | 78 | 73.1 Ų | 73.1 | 47% | 0.473 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -65.4 | -43.1 | 175.2 | 177 | 0 | 0 | 0 | 0 | 111 | L81 G82 Q87 Y88 M89 | L81-V85 PolarHBondContact O-N 2.94Å; G82-V85 PolarHBondContact O-N 3.31Å; V85-Q87 VanDerWaalsContact C-N 3.34Å; V85-Q87 PolarHBondContact O-N 3.44Å; V85-Y88 PolarHBondContact O-N 3.02Å; V85-M89 HydrophobicContact CG1-CG 4.48Å; V85-M89 HydrophobicContact CG1-SD 4.27Å; V85-M89 WeakPolarHBondContact O-CG 3.38Å; V85-M89 PolarHBondContact O-N 3.37Å |
| 86 | I | 84.4 | Confident | 79.3 | Confident | 92 Ų | 92 | 75 Ų | 75 | 47% | 0.472 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -60.7 | -41.6 | 178 | -68.9 | 164.4 | 0 | 0 | 0 | 111.4 | G82 L83 M89 K90 | G82-I86 WeakPolarHBondContact O-CG1 3.44Å; G82-I86 PolarHBondContact O-N 3.14Å; L83-I86 PolarHBondContact O-N 2.94Å; I86-M89 PolarHBondContact O-N 3.03Å; I86-K90 WeakPolarHBondContact O-CG 3.43Å; I86-K90 PolarHBondContact O-N 2.84Å |
| 87 | Q | 78.9 | Confident | 77.3 | Confident | 65 Ų | 65 | 81.7 Ų | 81.7 | 30% | 0.304 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -68 | -40.2 | 176 | -166.1 | -172.5 | 14.7 | 0 | 0 | 112.1 | L83 T84 V85 M89 K90 F91 T160 S161 | L83-Q87 PolarHBondContact O-N 2.66Å; T84-Q87 PolarHBondContact O-N 3.24Å; V85-Q87 VanDerWaalsContact C-N 3.34Å; V85-Q87 PolarHBondContact O-N 3.44Å; Q87-M89 VanDerWaalsContact C-N 3.31Å; Q87-M89 PolarHBondContact O-N 3.31Å; Q87-K90 PolarHBondContact O-N 3.01Å; Q87-K90 VanDerWaalsContact O-N 3.15Å; Q87-F91 PolarHBondContact O-N 2.93Å; Q87-T160 PolarHBondContact OE1-O 2.99Å; Q87-T160 PolarHBondContact OE1-OG1 3.33Å; Q87-S161 PolarHBondContact NE2-OG 3.01Å; Q87-S161 VanDerWaalsContact OE1-N 3.13Å |
| 88 | Y | 77.1 | Confident | 75.1 | Confident | 175 Ų | 175 | 90.5 Ų | 90.5 | 69% | 0.686 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -59 | -43.1 | 175.2 | -174 | -96.3 | 0 | 0 | 0 | 111.7 | T84 V85 F91 H92 | T84-Y88 PolarHBondContact O-N 3.46Å; T84-Y88 VanDerWaalsContact O-N 3.08Å; V85-Y88 PolarHBondContact O-N 3.02Å; Y88-F91 PolarHBondContact O-N 3.28Å; Y88-H92 PolarHBondContact O-N 2.84Å |
| 89 | M | 75.2 | Confident | 73 | Confident | 128 Ų | 128 | 94.8 Ų | 94.8 | 63% | 0.631 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -65.3 | -36.4 | 174.3 | -68.2 | -177.5 | 75.9 | 0 | 0 | 113.2 | V85 I86 Q87 S93 | V85-M89 HydrophobicContact CG1-CG 4.48Å; V85-M89 HydrophobicContact CG1-SD 4.27Å; V85-M89 WeakPolarHBondContact O-CG 3.38Å; V85-M89 PolarHBondContact O-N 3.37Å; I86-M89 PolarHBondContact O-N 3.03Å; Q87-M89 VanDerWaalsContact C-N 3.31Å; Q87-M89 PolarHBondContact O-N 3.31Å; M89-S93 WeakPolarHBondContact O-CB 3.4Å; M89-S93 PolarHBondContact O-N 3.41Å |
| 90 | K | 72 | Confident | 70.9 | Confident | 131 Ų | 131 | 99.1 Ų | 99.1 | 57% | 0.57 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -64.1 | -48.1 | 173.3 | -76.5 | -178.5 | 177.6 | -175.2 | 0 | 111.5 | I86 Q87 H92 S93 I96 | I86-K90 WeakPolarHBondContact O-CG 3.43Å; I86-K90 PolarHBondContact O-N 2.84Å; Q87-K90 PolarHBondContact O-N 3.01Å; Q87-K90 VanDerWaalsContact O-N 3.15Å; K90-H92 VanDerWaalsContact C-N 3.32Å; K90-H92 PolarHBondContact O-N 3.29Å; K90-S93 PolarHBondContact O-N 2.97Å; K90-S93 VanDerWaalsContact O-N 3.08Å; K90-I96 HydrophobicContact CG-CD1 4.43Å |
| 91 | F | 66.4 | Low | 69 | Low | 192 Ų | 192 | 102.7 Ų | 102.7 | 84% | 0.842 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -65.6 | -32.7 | -178.3 | -170.3 | -96.4 | 0 | 0 | 0 | 112.9 | Q87 Y88 S93 | Q87-F91 PolarHBondContact O-N 2.93Å; Y88-F91 PolarHBondContact O-N 3.28Å; F91-S93 VanDerWaalsContact C-N 3.33Å |
| 92 | H | 62.1 | Low | 67.2 | Low | 152 Ų | 152 | 110.8 Ų | 110.8 | 70% | 0.704 | 57% | 0.569 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.2 | -1.1 | 174.5 | -162.3 | 69.7 | 0 | 0 | 0 | 114.1 | Y88 K90 P94 | Y88-H92 PolarHBondContact O-N 2.84Å; K90-H92 VanDerWaalsContact C-N 3.32Å; K90-H92 PolarHBondContact O-N 3.29Å; H92-P94 WeakPolarHBondContact O-CD 3.49Å |
| 93 | S | 56.4 | Low | 65.3 | Low | 44 Ų | 44 | 114.5 Ų | 114.5 | 31% | 0.308 | 58% | 0.581 | S | S | . | * | trans | -106.3 | 93.4 | 177.1 | -172.1 | 0 | 0 | 0 | 0 | 110.9 | M89 K90 F91 S95 | M89-S93 WeakPolarHBondContact O-CB 3.4Å; M89-S93 PolarHBondContact O-N 3.41Å; K90-S93 PolarHBondContact O-N 2.97Å; K90-S93 VanDerWaalsContact O-N 3.08Å; F91-S93 VanDerWaalsContact C-N 3.33Å; S93-S95 PolarHBondContact O-N 2.85Å; S93-S95 PolarHBondContact OG-OG 2.86Å | ||
| 94 | P | 56.6 | Low | 63.8 | Low | 101 Ų | 101 | 117.7 Ų | 117.7 | 66% | 0.656 | 60% | 0.598 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.1 | 10.2 | -178.3 | 30.6 | -38.1 | 0 | 0 | 0 | 114.3 | H92 | H92-P94 WeakPolarHBondContact O-CD 3.49Š|
| 95 | S | 56.6 | Low | 62.8 | Low | 81 Ų | 81 | 122.5 Ų | 122.5 | 57% | 0.566 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76 | -29.5 | -177.7 | -43.9 | 0 | 0 | 0 | 0 | 113 | S93 | S93-S95 PolarHBondContact O-N 2.85Å; S93-S95 PolarHBondContact OG-OG 2.86Å |
| 96 | I | 54.7 | Low | 61.9 | Low | 89 Ų | 89 | 120.3 Ų | 120.3 | 46% | 0.456 | 61% | 0.61 | S | S | . | * | S | Bend | trans | -85.8 | -40.1 | -167.4 | -58.7 | -179.9 | 0 | 0 | 0 | 111.8 | K90 R98 I99 | K90-I96 HydrophobicContact CG-CD1 4.43Å; I96-R98 PolarHBondContact O-N 2.97Å; I96-I99 PolarHBondContact O-N 3.09Å |
| 97 | D | 54.4 | Low | 61.2 | Low | 140 Ų | 140 | 121.2 Ų | 121.2 | 75% | 0.749 | 62% | 0.616 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61 | -19 | -175.9 | -68.2 | -6 | 0 | 0 | 0 | 114.5 | ||
| 98 | R | 50.5 | Low | 61.1 | Low | 229 Ų | 229 | 122 Ų | 122 | 86% | 0.864 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.8 | -11.2 | -174.1 | -75.2 | -174.6 | 69.4 | 157.7 | 0.4 | 115.6 | I96 | I96-R98 PolarHBondContact O-N 2.97Š|
| 99 | I | 52.1 | Low | 61.1 | Low | 134 Ų | 134 | 117.3 Ų | 117.3 | 69% | 0.687 | 61% | 0.611 | S | S | * | * | S | Bend | trans | -91.1 | -43.2 | -166.1 | -63 | -177.2 | 0 | 0 | 0 | 113.6 | I96 | I96-I99 PolarHBondContact O-N 3.09Š|
| 100 | N | 51 | Low | 61.4 | Low | 121 Ų | 121 | 113.8 Ų | 113.8 | 65% | 0.647 | 59% | 0.594 | S | S | * | * | S | Bend | trans | -122.8 | 104.9 | -175.6 | -73.2 | -31.2 | 0 | 0 | 0 | 111.6 | K102 | N100-K102 PolarHBondContact O-N 2.86Š|
| 101 | G | 52.4 | Low | 62 | Low | 78 Ų | 78 | 110.7 Ų | 110.7 | 80% | 0.804 | 59% | 0.587 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.2 | 119.9 | -177.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | L103 | G101-L103 PolarHBondContact O-N 3.01Š|
| 102 | K | 55.1 | Low | 62.9 | Low | 217 Ų | 217 | 105.8 Ų | 105.8 | 94% | 0.943 | 57% | 0.573 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 56.4 | 14.4 | 170.6 | -63.5 | -169.5 | 176.7 | -173.6 | 0 | 117.3 | N100 D104 | N100-K102 PolarHBondContact O-N 2.86Å; K102-D104 VanDerWaalsContact C-N 3.35Å; K102-D104 PolarHBondContact O-N 2.77Å |
| 103 | L | 51.9 | Low | 64 | Low | 109 Ų | 109 | 99.2 Ų | 99.2 | 57% | 0.571 | 54% | 0.542 | S | S | * | . | trans | -73.7 | 97.1 | 160.7 | -170.8 | 75.9 | 0 | 0 | 0 | 107.5 | G101 I105 V108 | G101-L103 PolarHBondContact O-N 3.01Å; L103-I105 PolarHBondContact O-N 2.89Å; L103-I105 VanDerWaalsContact O-N 3.12Å; L103-V108 HydrophobicContact CD2-CG2 4.25Å | ||
| 104 | D | 59.2 | Low | 65.4 | Low | 97 Ų | 97 | 99.6 Ų | 99.6 | 52% | 0.519 | 54% | 0.543 | S | S | . | . | trans | -59 | 116.3 | -178.6 | -163.3 | -31.3 | 0 | 0 | 0 | 109.9 | K102 S106 L107 | K102-D104 VanDerWaalsContact C-N 3.35Å; K102-D104 PolarHBondContact O-N 2.77Å; D104-S106 PolarHBondContact O-N 2.92Å; D104-S106 VanDerWaalsContact O-N 3.17Å; D104-S106 WeakPolarHBondContact OD1-CB 3.31Å; D104-S106 PolarHBondContact OD1-N 3.16Å; D104-S106 PolarHBondContact OD1-OG 3.1Å; D104-L107 HydrophobicContact CB-CD1 4.23Å; D104-L107 HydrophobicContact CB-CG 4.47Å; D104-L107 WeakPolarHBondContact O-CB 3.49Å; D104-L107 PolarHBondContact O-N 3.4Å; D104-L107 VanDerWaalsContact O-N 3.1Å | ||
| 105 | I | 64.5 | Low | 67.1 | Low | 119 Ų | 119 | 98.8 Ų | 98.8 | 61% | 0.61 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -65.8 | -23 | -170.9 | -61 | 175.7 | 0 | 0 | 0 | 110.7 | L103 L107 V108 L109 | L103-I105 PolarHBondContact O-N 2.89Å; L103-I105 VanDerWaalsContact O-N 3.12Å; I105-L107 PolarHBondContact O-N 2.94Å; I105-V108 PolarHBondContact O-N 3.49Å; I105-L109 PolarHBondContact O-N 3.43Å; I105-L109 VanDerWaalsContact O-N 3.12Å |
| 106 | S | 67.4 | Low | 68.7 | Low | 33 Ų | 33 | 96.3 Ų | 96.3 | 23% | 0.231 | 52% | 0.517 | C | S | . | . | H | α-helix | trans | -55.2 | -45.3 | 171.4 | 60.1 | 0 | 0 | 0 | 0 | 112.8 | D104 V108 L109 I110 | D104-S106 PolarHBondContact O-N 2.92Å; D104-S106 VanDerWaalsContact O-N 3.17Å; D104-S106 WeakPolarHBondContact OD1-CB 3.31Å; D104-S106 PolarHBondContact OD1-N 3.16Å; D104-S106 PolarHBondContact OD1-OG 3.1Å; S106-V108 PolarHBondContact O-N 2.86Å; S106-L109 PolarHBondContact O-N 2.78Å; S106-I110 WeakPolarHBondContact O-CG1 3.48Å; S106-I110 PolarHBondContact O-N 2.97Å; S106-I110 VanDerWaalsContact O-N 3.1Å |
| 107 | L | 71.7 | Confident | 70.4 | Confident | 111 Ų | 111 | 92.9 Ų | 92.9 | 58% | 0.581 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -62.4 | -25.8 | -177.8 | -74 | 170.5 | 0 | 0 | 0 | 113.3 | D104 I105 P111 | D104-L107 HydrophobicContact CB-CD1 4.23Å; D104-L107 HydrophobicContact CB-CG 4.47Å; D104-L107 WeakPolarHBondContact O-CB 3.49Å; D104-L107 PolarHBondContact O-N 3.4Å; D104-L107 VanDerWaalsContact O-N 3.1Å; I105-L107 PolarHBondContact O-N 2.94Å; L107-P111 WeakPolarHBondContact O-CD 3.33Å; L107-P111 WeakPolarHBondContact O-CG 3.21Å |
| 108 | V | 75.8 | Confident | 72.1 | Confident | 80 Ų | 80 | 92 Ų | 92 | 49% | 0.485 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -90.9 | -28.8 | 176.2 | -175.8 | 0 | 0 | 0 | 0 | 111.5 | L103 I105 S106 P111 V112 | L103-V108 HydrophobicContact CD2-CG2 4.25Å; I105-V108 PolarHBondContact O-N 3.49Å; S106-V108 PolarHBondContact O-N 2.86Å; V108-P111 WeakPolarHBondContact O-CD 3.3Å; V108-P111 WeakPolarHBondContact O-CG 3.5Å; V108-V112 WeakPolarHBondContact O-CG2 3.38Å |
| 109 | L | 77.4 | Confident | 74.1 | Confident | 78 Ų | 78 | 85.4 Ų | 85.4 | 41% | 0.408 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -72.9 | -43.2 | -179.4 | -174.8 | 60.3 | 0 | 0 | 0 | 112.7 | I105 S106 V112 E113 | I105-L109 PolarHBondContact O-N 3.43Å; I105-L109 VanDerWaalsContact O-N 3.12Å; S106-L109 PolarHBondContact O-N 2.78Å; L109-V112 WeakPolarHBondContact O-CB 3.27Å; L109-V112 PolarHBondContact O-N 2.93Å; L109-V112 VanDerWaalsContact O-N 3.11Å; L109-E113 HydrophobicContact CD1-CG 4.26Å; L109-E113 HydrophobicContact CG-CG 4.36Å; L109-E113 PolarHBondContact O-N 3.27Å |
| 110 | I | 81.6 | Confident | 76.1 | Confident | 53 Ų | 53 | 79.2 Ų | 79.2 | 27% | 0.272 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -54.7 | -50.7 | -179.5 | -65.7 | 162.4 | 0 | 0 | 0 | 113.7 | Q19 S106 V112 E113 T114 | Q19-I110 HydrophobicContact CB-CD1 4.16Å; Q19-I110 HydrophobicContact CG-CD1 4.36Å; S106-I110 WeakPolarHBondContact O-CG1 3.48Å; S106-I110 PolarHBondContact O-N 2.97Å; S106-I110 VanDerWaalsContact O-N 3.1Å; I110-V112 VanDerWaalsContact C-N 3.28Å; I110-V112 PolarHBondContact O-N 3.15Å; I110-E113 PolarHBondContact O-N 3.33Å; I110-T114 WeakPolarHBondContact O-CG2 3.4Å; I110-T114 PolarHBondContact O-N 3.15Å; I110-T114 PolarHBondContact O-OG1 3.43Å |
| 111 | P | 84.7 | Confident | 78 | Confident | 66 Ų | 66 | 75.6 Ų | 75.6 | 43% | 0.429 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -66.3 | -29 | 177.7 | 25 | -34 | 0 | 0 | 0 | 112.8 | L107 V108 T114 V115 | L107-P111 WeakPolarHBondContact O-CD 3.33Å; L107-P111 WeakPolarHBondContact O-CG 3.21Å; V108-P111 WeakPolarHBondContact O-CD 3.3Å; V108-P111 WeakPolarHBondContact O-CG 3.5Å; P111-T114 WeakPolarHBondContact CA-OG1 3.31Å; P111-T114 PolarHBondContact O-OG1 3.01Å; P111-V115 WeakPolarHBondContact O-CB 3.33Å; P111-V115 VanDerWaalsContact O-CG2 3.26Å; P111-V115 WeakPolarHBondContact O-CG2 3.38Å; P111-V115 PolarHBondContact O-N 3.26Å; P111-V115 VanDerWaalsContact O-N 3.15Å |
| 112 | V | 85.2 | Confident | 79.8 | Confident | 90 Ų | 90 | 73.9 Ų | 73.9 | 55% | 0.545 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -70.3 | -43.6 | 174.8 | 174.7 | 0 | 0 | 0 | 0 | 110.9 | V108 L109 I110 L116 | V108-V112 WeakPolarHBondContact O-CG2 3.38Å; L109-V112 WeakPolarHBondContact O-CB 3.27Å; L109-V112 PolarHBondContact O-N 2.93Å; L109-V112 VanDerWaalsContact O-N 3.11Å; I110-V112 VanDerWaalsContact C-N 3.28Å; I110-V112 PolarHBondContact O-N 3.15Å; V112-L116 WeakPolarHBondContact O-CB 3.36Å; V112-L116 PolarHBondContact O-N 3.23Å |
| 113 | E | 85.4 | Confident | 81.6 | Confident | 13 Ų | 13 | 64.6 Ų | 64.6 | 6% | 0.061 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -66.1 | -39.7 | 177.7 | -76.5 | -163 | -135.2 | 0 | 0 | 113.3 | R27 L109 I110 L116 A117 L157 P158 | R27-E113 IonicContact CZ-OE2 3.84Å; R27-E113 IonicContact NH2-OE2 2.67Å; R27-E113 PolarHBondContact NH2-OE2 3.45Å; L109-E113 HydrophobicContact CD1-CG 4.26Å; L109-E113 HydrophobicContact CG-CG 4.36Å; L109-E113 PolarHBondContact O-N 3.27Å; I110-E113 PolarHBondContact O-N 3.33Å; E113-L116 PolarHBondContact O-N 3.48Å; E113-A117 WeakPolarHBondContact O-CB 3.47Å; E113-A117 PolarHBondContact O-N 3.37Å; E113-L157 HydrophobicContact CG-CB 4.33Å; E113-L157 HydrophobicContact CG-CD1 3.9Å; E113-L157 WeakPolarHBondContact OE2-CB 3.08Å; E113-P158 WeakPolarHBondContact OE2-CD 3.37Å; E113-P158 WeakPolarHBondContact OE2-CG 3.19Å |
| 114 | T | 86 | Confident | 83.5 | Confident | 53 Ų | 53 | 59.7 Ų | 59.7 | 33% | 0.325 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -68.6 | -41.5 | 177.9 | 50.3 | 0 | 0 | 0 | 0 | 112 | I110 P111 L116 A117 I118 | I110-T114 WeakPolarHBondContact O-CG2 3.4Å; I110-T114 PolarHBondContact O-N 3.15Å; I110-T114 PolarHBondContact O-OG1 3.43Å; P111-T114 WeakPolarHBondContact CA-OG1 3.31Å; P111-T114 PolarHBondContact O-OG1 3.01Å; T114-L116 VanDerWaalsContact C-N 3.34Å; T114-L116 PolarHBondContact O-N 3.33Å; T114-A117 PolarHBondContact O-N 2.99Å; T114-I118 WeakPolarHBondContact O-CD1 3.39Å; T114-I118 VanDerWaalsContact O-CG1 3.28Å; T114-I118 WeakPolarHBondContact O-CG1 3.2Å; T114-I118 PolarHBondContact O-N 3.31Å |
| 115 | V | 90.5 | Very high | 85 | Confident | 83 Ų | 83 | 57.2 Ų | 57.2 | 50% | 0.503 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -61.3 | -41.8 | 171.7 | 168.9 | 0 | 0 | 0 | 0 | 111.4 | P111 A117 I118 I119 | P111-V115 WeakPolarHBondContact O-CB 3.33Å; P111-V115 VanDerWaalsContact O-CG2 3.26Å; P111-V115 WeakPolarHBondContact O-CG2 3.38Å; P111-V115 PolarHBondContact O-N 3.26Å; P111-V115 VanDerWaalsContact O-N 3.15Å; V115-A117 PolarHBondContact O-N 3.34Å; V115-I118 PolarHBondContact O-N 2.88Å; V115-I119 HydrophobicContact CG1-CD1 3.85Å; V115-I119 VanDerWaalsContact O-CG1 3.31Å; V115-I119 WeakPolarHBondContact O-CG1 3.28Å; V115-I119 PolarHBondContact O-N 3.15Å |
| 116 | L | 91.5 | Very high | 86.2 | Confident | 30 Ų | 30 | 56.4 Ų | 56.4 | 16% | 0.157 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -62.4 | -41.7 | 177.3 | -165.9 | 75.1 | 0 | 0 | 0 | 112.1 | V112 E113 T114 I119 N120 L150 L153 T154 L157 | V112-L116 WeakPolarHBondContact O-CB 3.36Å; V112-L116 PolarHBondContact O-N 3.23Å; E113-L116 PolarHBondContact O-N 3.48Å; T114-L116 VanDerWaalsContact C-N 3.34Å; T114-L116 PolarHBondContact O-N 3.33Å; L116-I119 PolarHBondContact O-N 2.95Å; L116-N120 WeakPolarHBondContact O-CB 3.38Å; L116-N120 PolarHBondContact O-N 3.47Å; L116-L150 HydrophobicContact CD1-CD2 3.52Å; L116-L150 HydrophobicContact CG-CD2 4.24Å; L116-L153 HydrophobicContact CD2-CB 4.18Å; L116-L153 HydrophobicContact CD2-CD2 3.69Å; L116-L153 HydrophobicContact CD2-CG 3.64Å; L116-T154 WeakPolarHBondContact CD2-OG1 3.44Å; L116-T154 WeakPolarHBondContact CG-OG1 3.24Å; L116-L157 HydrophobicContact CD2-CD1 4.33Å |
| 117 | A | 90.1 | Very high | 87.3 | Confident | 16 Ų | 16 | 54.9 Ų | 54.9 | 13% | 0.132 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -62.4 | -45.8 | 175 | 0 | 0 | 0 | 0 | 0 | 112.2 | E113 T114 V115 I119 N120 D121 T154 | E113-A117 WeakPolarHBondContact O-CB 3.47Å; E113-A117 PolarHBondContact O-N 3.37Å; T114-A117 PolarHBondContact O-N 2.99Å; V115-A117 PolarHBondContact O-N 3.34Å; A117-I119 VanDerWaalsContact C-N 3.31Å; A117-I119 PolarHBondContact O-N 3.03Å; A117-N120 WeakPolarHBondContact O-CB 3.28Å; A117-N120 PolarHBondContact O-N 3.47Å; A117-N120 VanDerWaalsContact O-N 3.15Å; A117-D121 PolarHBondContact O-N 3.39Å; A117-T154 HydrophobicContact CB-CG2 3.82Å |
| 118 | I | 90.9 | Very high | 88 | Confident | 123 Ų | 123 | 50.2 Ų | 50.2 | 63% | 0.631 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -60.7 | -40.5 | 178 | -67.7 | 162 | 0 | 0 | 0 | 111.2 | T114 V115 G122 | T114-I118 WeakPolarHBondContact O-CD1 3.39Å; T114-I118 VanDerWaalsContact O-CG1 3.28Å; T114-I118 WeakPolarHBondContact O-CG1 3.2Å; T114-I118 PolarHBondContact O-N 3.31Å; V115-I118 PolarHBondContact O-N 2.88Å; I118-G122 PolarHBondContact O-N 2.98Å |
| 119 | I | 92.8 | Very high | 88.6 | Confident | 89 Ų | 89 | 51.3 Ų | 51.3 | 46% | 0.456 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -65.2 | -43.4 | 175.6 | -67 | 164.9 | 0 | 0 | 0 | 110.9 | V115 L116 A117 G122 I123 L150 | V115-I119 HydrophobicContact CG1-CD1 3.85Å; V115-I119 VanDerWaalsContact O-CG1 3.31Å; V115-I119 WeakPolarHBondContact O-CG1 3.28Å; V115-I119 PolarHBondContact O-N 3.15Å; L116-I119 PolarHBondContact O-N 2.95Å; A117-I119 VanDerWaalsContact C-N 3.31Å; A117-I119 PolarHBondContact O-N 3.03Å; I119-G122 PolarHBondContact O-N 3.01Å; I119-I123 HydrophobicContact CG2-CD1 4.08Å; I119-I123 WeakPolarHBondContact O-CG1 3.21Å; I119-I123 PolarHBondContact O-N 3.13Å; I119-L150 HydrophobicContact CG2-CD1 4.15Å |
| 120 | N | 93.1 | Very high | 89 | Confident | 5 Ų | 5 | 48.9 Ų | 48.9 | 3% | 0.027 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -60.8 | -47.2 | 178.5 | -174.9 | 69.4 | 0 | 0 | 0 | 112.4 | L116 A117 G122 I123 L124 Y147 L150 T151 | L116-N120 WeakPolarHBondContact O-CB 3.38Å; L116-N120 PolarHBondContact O-N 3.47Å; A117-N120 WeakPolarHBondContact O-CB 3.28Å; A117-N120 PolarHBondContact O-N 3.47Å; A117-N120 VanDerWaalsContact O-N 3.15Å; N120-G122 VanDerWaalsContact C-N 3.34Å; N120-I123 PolarHBondContact O-N 3.26Å; N120-L124 PolarHBondContact O-N 2.91Å; N120-Y147 WeakPolarHBondContact ND2-CE2 3.35Å; N120-Y147 VanDerWaalsContact OD1-CD2 3.28Å; N120-Y147 WeakPolarHBondContact OD1-CD2 3.27Å; N120-Y147 WeakPolarHBondContact OD1-CE2 3.49Å; N120-Y147 PolarHBondContact OD1-O 2.93Å; N120-Y147 VanDerWaalsContact OD1-O 3.1Å; N120-L150 HydrophobicContact CB-CB 4.08Å; N120-L150 VanDerWaalsContact OD1-CB 3.28Å; N120-L150 WeakPolarHBondContact OD1-CB 3.42Å; N120-T151 VanDerWaalsContact CG-OG1 3.31Å; N120-T151 PolarHBondContact ND2-OG1 3.03Å; N120-T151 PolarHBondContact OD1-N 3.48Å; N120-T151 PolarHBondContact OD1-OG1 3.38Å |
| 121 | D | 90.6 | Very high | 89.2 | Confident | 44 Ų | 44 | 49.6 Ų | 49.6 | 24% | 0.235 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -71 | -31.9 | -179.8 | -70.2 | -2.7 | 0 | 0 | 0 | 111.4 | A117 I123 L124 V125 | A117-D121 PolarHBondContact O-N 3.39Å; D121-I123 VanDerWaalsContact C-N 3.34Å; D121-I123 PolarHBondContact O-N 3.44Å; D121-L124 WeakPolarHBondContact O-CB 3.5Å; D121-L124 PolarHBondContact O-N 3.26Å; D121-V125 WeakPolarHBondContact O-CG2 3.41Å; D121-V125 PolarHBondContact O-N 3.38Å |
| 122 | G | 91.4 | Very high | 89.3 | Confident | 42 Ų | 42 | 50.6 Ų | 50.6 | 43% | 0.433 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -58.7 | -42.2 | 168.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | I118 I119 N120 F126 | I118-G122 PolarHBondContact O-N 2.98Å; I119-G122 PolarHBondContact O-N 3.01Å; N120-G122 VanDerWaalsContact C-N 3.34Å; G122-F126 VanDerWaalsContact O-CB 3.25Å; G122-F126 WeakPolarHBondContact O-CB 3.15Å; G122-F126 PolarHBondContact O-N 3.08Å |
| 123 | I | 92.1 | Very high | 89.4 | Confident | 23 Ų | 23 | 47.6 Ų | 47.6 | 12% | 0.118 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -69.7 | -38.6 | 175.7 | -64.9 | 160.9 | 0 | 0 | 0 | 111.1 | I119 N120 D121 F126 L127 L146 L150 | I119-I123 HydrophobicContact CG2-CD1 4.08Å; I119-I123 WeakPolarHBondContact O-CG1 3.21Å; I119-I123 PolarHBondContact O-N 3.13Å; N120-I123 PolarHBondContact O-N 3.26Å; D121-I123 VanDerWaalsContact C-N 3.34Å; D121-I123 PolarHBondContact O-N 3.44Å; I123-F126 PolarHBondContact O-N 2.9Å; I123-L127 HydrophobicContact CG2-CD1 4.07Å; I123-L127 HydrophobicContact CG2-CG 4.4Å; I123-L127 WeakPolarHBondContact O-CB 3.28Å; I123-L127 WeakPolarHBondContact O-CG 3.46Å; I123-L127 PolarHBondContact O-N 3.46Å; I123-L146 HydrophobicContact CD1-CD2 3.92Å; I123-L146 HydrophobicContact CD1-CG 4.11Å; I123-L150 HydrophobicContact CD1-CD1 3.39Å |
| 124 | L | 91.6 | Very high | 89.5 | Confident | 5 Ų | 5 | 47.3 Ų | 47.3 | 3% | 0.026 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -58.2 | -52.4 | 174.3 | -179 | 56.8 | 0 | 0 | 0 | 111.3 | F34 N120 D121 F126 L127 L128 Y147 L250 T254 | F34-L124 HydrophobicContact CB-CD2 4.45Å; F34-L124 HydrophobicContact CD2-CD1 4.15Å; F34-L124 HydrophobicContact CD2-CD2 3.95Å; F34-L124 HydrophobicContact CD2-CG 4.34Å; F34-L124 HydrophobicContact CE2-CD1 4.23Å; N120-L124 PolarHBondContact O-N 2.91Å; D121-L124 WeakPolarHBondContact O-CB 3.5Å; D121-L124 PolarHBondContact O-N 3.26Å; L124-F126 PolarHBondContact O-N 3.36Å; L124-L127 PolarHBondContact O-N 3.02Å; L124-L128 HydrophobicContact CD1-CD1 3.68Å; L124-L128 HydrophobicContact CD1-CG 4.24Å; L124-L128 HydrophobicContact CG-CD1 3.82Å; L124-L128 WeakPolarHBondContact O-CB 3.41Å; L124-L128 VanDerWaalsContact O-CG 3.23Å; L124-L128 WeakPolarHBondContact O-CG 3.38Å; L124-L128 PolarHBondContact O-N 3.28Å; L124-Y147 HydrophobicContact CB-CD2 4.18Å; L124-Y147 HydrophobicContact CB-CE2 3.66Å; L124-Y147 HydrophobicContact CD1-CE1 4.22Å; L124-Y147 HydrophobicContact CD1-CE2 4.05Å; L124-Y147 HydrophobicContact CD2-CE2 4.28Å; L124-Y147 HydrophobicContact CG-CE2 4.2Å; L124-L250 HydrophobicContact CD1-CD1 3.94Å; L124-L250 HydrophobicContact CD1-CD2 4.22Å; L124-L250 HydrophobicContact CD1-CG 4.13Å; L124-T254 HydrophobicContact CD2-CG2 4.43Å |
| 125 | V | 90.2 | Very high | 89.5 | Confident | 46 Ų | 46 | 52.7 Ų | 52.7 | 28% | 0.279 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -63.9 | -41.6 | 178.2 | 174.8 | 0 | 0 | 0 | 0 | 111 | Y33 D121 L127 L128 V129 | Y33-V125 HydrophobicContact CD1-CG2 4.36Å; Y33-V125 HydrophobicContact CE1-CG2 3.88Å; D121-V125 WeakPolarHBondContact O-CG2 3.41Å; D121-V125 PolarHBondContact O-N 3.38Å; V125-L127 PolarHBondContact O-N 2.95Å; V125-L128 PolarHBondContact O-N 2.89Å; V125-V129 HydrophobicContact CG1-CG2 4.21Å; V125-V129 WeakPolarHBondContact O-CB 3.41Å; V125-V129 WeakPolarHBondContact O-CG2 3.49Å; V125-V129 PolarHBondContact O-N 3.39Å |
| 126 | F | 90.8 | Very high | 89.3 | Confident | 102 Ų | 102 | 54.9 Ų | 54.9 | 45% | 0.447 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -60.1 | -45.1 | 175.7 | -179.6 | -111.3 | 0 | 0 | 0 | 112.2 | G122 I123 L124 S130 V133 L143 | G122-F126 VanDerWaalsContact O-CB 3.25Å; G122-F126 WeakPolarHBondContact O-CB 3.15Å; G122-F126 PolarHBondContact O-N 3.08Å; I123-F126 PolarHBondContact O-N 2.9Å; L124-F126 PolarHBondContact O-N 3.36Å; F126-S130 WeakPolarHBondContact O-CA 3.39Å; F126-S130 WeakPolarHBondContact O-CB 3.49Å; F126-S130 PolarHBondContact O-N 3.42Å; F126-V133 HydrophobicContact CE1-CB 4.46Å; F126-V133 HydrophobicContact CE1-CG1 4.09Å; F126-V133 HydrophobicContact CE1-CG2 4.24Å; F126-V133 HydrophobicContact CZ-CG2 3.94Å; F126-L143 HydrophobicContact CD1-CD1 4.38Å; F126-L143 HydrophobicContact CE1-CD1 3.96Å |
| 127 | L | 89.8 | Confident | 89 | Confident | 0 Ų | 0 | 57.6 Ų | 57.6 | 0% | 0 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -64.7 | -40.1 | 175.1 | -78 | 172.8 | 0 | 0 | 0 | 112.2 | I123 L124 V125 R134 L143 L250 | I123-L127 HydrophobicContact CG2-CD1 4.07Å; I123-L127 HydrophobicContact CG2-CG 4.4Å; I123-L127 WeakPolarHBondContact O-CB 3.28Å; I123-L127 WeakPolarHBondContact O-CG 3.46Å; I123-L127 PolarHBondContact O-N 3.46Å; L124-L127 PolarHBondContact O-N 3.02Å; V125-L127 PolarHBondContact O-N 2.95Å; L127-R134 HydrophobicContact CD2-CG 4.32Å; L127-R134 WeakPolarHBondContact O-CD 3.4Å; L127-R134 WeakPolarHBondContact O-CG 3.34Å; L127-R134 PolarHBondContact O-NH1 3.48Å; L127-L143 HydrophobicContact CD1-CB 4.41Å; L127-L143 HydrophobicContact CD2-CB 3.9Å; L127-L143 HydrophobicContact CD2-CD1 4.3Å; L127-L143 HydrophobicContact CG-CB 4.43Å; L127-L250 HydrophobicContact CB-CD2 3.73Å; L127-L250 HydrophobicContact CD1-CD1 4.07Å; L127-L250 HydrophobicContact CD1-CD2 4.25Å |
| 128 | L | 87.3 | Confident | 89.1 | Confident | 13 Ų | 13 | 60.9 Ų | 60.9 | 7% | 0.068 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -70.9 | -35.8 | -178.9 | -69.8 | 168.7 | 0 | 0 | 0 | 112.7 | F34 L37 L124 V125 R134 L247 L250 L251 | F34-L128 HydrophobicContact CD2-CD1 3.85Å; F34-L128 HydrophobicContact CE2-CD1 4.05Å; L37-L128 HydrophobicContact CD2-CB 3.58Å; L37-L128 HydrophobicContact CD2-CD1 3.61Å; L37-L128 HydrophobicContact CD2-CG 4.2Å; L124-L128 HydrophobicContact CD1-CD1 3.68Å; L124-L128 HydrophobicContact CD1-CG 4.24Å; L124-L128 HydrophobicContact CG-CD1 3.82Å; L124-L128 WeakPolarHBondContact O-CB 3.41Å; L124-L128 VanDerWaalsContact O-CG 3.23Å; L124-L128 WeakPolarHBondContact O-CG 3.38Å; L124-L128 PolarHBondContact O-N 3.28Å; V125-L128 PolarHBondContact O-N 2.89Å; L128-R134 VanDerWaalsContact C-NH1 3.34Å; L128-R134 PolarHBondContact O-NH1 3.49Å; L128-L247 HydrophobicContact CD2-CD1 3.55Å; L128-L250 HydrophobicContact CD2-CD2 3.85Å; L128-L250 HydrophobicContact CG-CD2 4.04Å; L128-L251 HydrophobicContact CD2-CD2 3.83Å |
| 129 | V | 87.4 | Confident | 89.1 | Confident | 103 Ų | 103 | 58.5 Ų | 58.5 | 62% | 0.624 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -80.1 | -43.2 | 175.3 | 177 | 0 | 0 | 0 | 0 | 112.1 | V125 T131 | V125-V129 HydrophobicContact CG1-CG2 4.21Å; V125-V129 WeakPolarHBondContact O-CB 3.41Å; V125-V129 WeakPolarHBondContact O-CG2 3.49Å; V125-V129 PolarHBondContact O-N 3.39Å; V129-T131 PolarHBondContact O-N 3.05Å |
| 130 | S | 87 | Confident | 89 | Confident | 27 Ų | 27 | 54.2 Ų | 54.2 | 19% | 0.189 | 30% | 0.303 | C | S | . | . | trans | -86.3 | 74.2 | -168.3 | -162.4 | 0 | 0 | 0 | 0 | 113.9 | F126 T132 V133 R134 | F126-S130 WeakPolarHBondContact O-CA 3.39Å; F126-S130 WeakPolarHBondContact O-CB 3.49Å; F126-S130 PolarHBondContact O-N 3.42Å; S130-T132 PolarHBondContact O-N 2.85Å; S130-V133 PolarHBondContact O-N 2.74Å; S130-V133 VanDerWaalsContact OG-CG2 3.24Å; S130-V133 WeakPolarHBondContact OG-CG2 3.46Å; S130-R134 PolarHBondContact O-N 3.34Å | ||
| 131 | T | 85.2 | Confident | 89 | Confident | 68 Ų | 68 | 56.8 Ų | 56.8 | 42% | 0.417 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -47.2 | -41 | 170.2 | 50.6 | 0 | 0 | 0 | 0 | 113.3 | V129 V133 R134 R135 | V129-T131 PolarHBondContact O-N 3.05Å; T131-V133 VanDerWaalsContact C-N 3.29Å; T131-V133 PolarHBondContact O-N 3.4Å; T131-R134 PolarHBondContact O-N 3.07Å; T131-R135 WeakPolarHBondContact O-CG 3.5Å; T131-R135 PolarHBondContact O-N 2.69Å |
| 132 | T | 87.1 | Confident | 89.2 | Confident | 88 Ų | 88 | 59.1 Ų | 59.1 | 54% | 0.54 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -63.5 | -33.1 | -179.9 | -59.2 | 0 | 0 | 0 | 0 | 112.4 | S130 K136 | S130-T132 PolarHBondContact O-N 2.85Å; T132-K136 WeakPolarHBondContact O-CG 3.31Å |
| 133 | V | 86.3 | Confident | 89.3 | Confident | 26 Ų | 26 | 58.6 Ų | 58.6 | 16% | 0.158 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -82.1 | -44.2 | 178 | 172.2 | 0 | 0 | 0 | 0 | 110.7 | F126 S130 T131 R135 K136 V139 L143 | F126-V133 HydrophobicContact CE1-CB 4.46Å; F126-V133 HydrophobicContact CE1-CG1 4.09Å; F126-V133 HydrophobicContact CE1-CG2 4.24Å; F126-V133 HydrophobicContact CZ-CG2 3.94Å; S130-V133 PolarHBondContact O-N 2.74Å; S130-V133 VanDerWaalsContact OG-CG2 3.24Å; S130-V133 WeakPolarHBondContact OG-CG2 3.46Å; T131-V133 VanDerWaalsContact C-N 3.29Å; T131-V133 PolarHBondContact O-N 3.4Å; V133-R135 PolarHBondContact O-N 3.05Å; V133-K136 PolarHBondContact O-N 2.79Å; V133-V139 HydrophobicContact CG1-CG1 4.06Å; V133-L143 HydrophobicContact CG1-CD1 3.34Å |
| 134 | R | 88.1 | Confident | 89.4 | Confident | 8 Ų | 8 | 57.5 Ų | 57.5 | 3% | 0.03 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -55.1 | -27 | 175.9 | -68.6 | -158.7 | -55.4 | -101.7 | 10.4 | 114.4 | L127 L128 S130 T131 N140 D244 | L127-R134 HydrophobicContact CD2-CG 4.32Å; L127-R134 WeakPolarHBondContact O-CD 3.4Å; L127-R134 WeakPolarHBondContact O-CG 3.34Å; L127-R134 PolarHBondContact O-NH1 3.48Å; L128-R134 VanDerWaalsContact C-NH1 3.34Å; L128-R134 PolarHBondContact O-NH1 3.49Å; S130-R134 PolarHBondContact O-N 3.34Å; T131-R134 PolarHBondContact O-N 3.07Å; R134-N140 WeakPolarHBondContact O-CB 3.44Å; R134-N140 PolarHBondContact O-ND2 3.03Å; R134-D244 IonicContact NE-OD2 3.24Å; R134-D244 IonicContact NH2-OD2 3.95Å; R134-D244 PolarHBondContact NH2-OD2 3.04Å |
| 135 | R | 85.2 | Confident | 89.6 | Confident | 166 Ų | 166 | 58.9 Ų | 58.9 | 63% | 0.626 | 32% | 0.32 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.7 | -9.1 | -178.9 | -68.6 | 179.5 | -179.5 | -165.2 | -1.7 | 114.4 | T131 V133 D244 | T131-R135 WeakPolarHBondContact O-CG 3.5Å; T131-R135 PolarHBondContact O-N 2.69Å; V133-R135 PolarHBondContact O-N 3.05Å; R135-D244 WeakPolarHBondContact CG-OD1 3.27Å; R135-D244 IonicContact CZ-OD1 3.02Å; R135-D244 VanDerWaalsContact CZ-OD1 3.24Å; R135-D244 IonicContact CZ-OD2 2.96Å; R135-D244 IonicContact NE-OD1 3.59Å; R135-D244 PolarHBondContact NE-OD1 2.84Å; R135-D244 IonicContact NE-OD2 3.39Å; R135-D244 PolarHBondContact NE-OD2 2.62Å; R135-D244 VanDerWaalsContact NH2-CG 3.29Å; R135-D244 IonicContact NH2-OD1 2.71Å; R135-D244 PolarHBondContact NH2-OD1 3.03Å; R135-D244 IonicContact NH2-OD2 3.41Å; R135-D244 PolarHBondContact NH2-OD2 3.03Å |
| 136 | K | 87.4 | Confident | 89.9 | Confident | 128 Ų | 128 | 60.4 Ų | 60.4 | 56% | 0.557 | 33% | 0.326 | S | S | * | . | S | Bend | trans | -95.8 | 102.1 | 179.5 | -76.7 | 179.6 | 179 | -172.6 | 0 | 111.1 | T132 V133 V139 N140 | T132-K136 WeakPolarHBondContact O-CG 3.31Å; V133-K136 PolarHBondContact O-N 2.79Å; K136-V139 WeakPolarHBondContact O-CB 3.35Å; K136-V139 PolarHBondContact O-N 2.91Å; K136-N140 PolarHBondContact O-N 3.27Å; K136-N140 PolarHBondContact O-OD1 2.85Å |
| 137 | C | 85.1 | Confident | 90.1 | Very high | 88 Ų | 88 | 55.5 Ų | 55.5 | 60% | 0.595 | 30% | 0.304 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.1 | 140.6 | 166.2 | -169.6 | 0 | 0 | 0 | 0 | 110 | N140 | C137-N140 WeakPolarHBondContact CA-OD1 3.26Š|
| 138 | P | 90.9 | Very high | 90.4 | Very high | 84 Ų | 84 | 55.5 Ų | 55.5 | 55% | 0.545 | 30% | 0.304 | S | S | . | . | T | Hydrogen-bonded Turn | cis | -88.4 | -1.2 | -4 | 36.7 | -36.1 | 0 | 0 | 0 | 114.2 | N140 I141 V142 | P138-N140 PolarHBondContact O-N 3.36Å; P138-N140 VanDerWaalsContact O-N 3.17Å; P138-I141 PolarHBondContact O-N 2.99Å; P138-V142 PolarHBondContact O-N 2.95Å |
| 139 | V | 91.6 | Very high | 90.8 | Very high | 73 Ų | 73 | 59.4 Ų | 59.4 | 44% | 0.442 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -54.6 | -38 | -174.5 | -172.6 | 0 | 0 | 0 | 0 | 112.2 | V133 K136 V142 L143 | V133-V139 HydrophobicContact CG1-CG1 4.06Å; K136-V139 WeakPolarHBondContact O-CB 3.35Å; K136-V139 PolarHBondContact O-N 2.91Å; V139-V142 PolarHBondContact O-N 3.42Å; V139-L143 HydrophobicContact CG1-CD1 3.97Å; V139-L143 WeakPolarHBondContact O-CB 3.49Å; V139-L143 WeakPolarHBondContact O-CG 3.43Å; V139-L143 PolarHBondContact O-N 2.87Å |
| 140 | N | 90.8 | Very high | 91.2 | Very high | 0 Ų | 0 | 55.6 Ų | 55.6 | 0% | 0 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -61.1 | -44.7 | 175.3 | 66.6 | -18.3 | 0 | 0 | 0 | 113.3 | R134 K136 C137 P138 L144 Y245 C246 | R134-N140 WeakPolarHBondContact O-CB 3.44Å; R134-N140 PolarHBondContact O-ND2 3.03Å; K136-N140 PolarHBondContact O-N 3.27Å; K136-N140 PolarHBondContact O-OD1 2.85Å; C137-N140 WeakPolarHBondContact CA-OD1 3.26Å; P138-N140 PolarHBondContact O-N 3.36Å; P138-N140 VanDerWaalsContact O-N 3.17Å; N140-L144 VanDerWaalsContact O-CB 3.22Å; N140-L144 WeakPolarHBondContact O-CB 3.46Å; N140-L144 PolarHBondContact O-N 3.12Å; N140-Y245 PolarHBondContact ND2-OH 2.68Å; N140-Y245 VanDerWaalsContact ND2-OH 3.08Å; N140-C246 HydrophobicContact CB-CB 4.47Å |
| 141 | I | 93.5 | Very high | 91.5 | Very high | 59 Ų | 59 | 54.4 Ų | 54.4 | 30% | 0.303 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -68.1 | -43.4 | 176.9 | -63.2 | 167.4 | 0 | 0 | 0 | 110 | L68 P138 L143 L144 M145 | L68-I141 HydrophobicContact CD2-CG1 4.4Å; L68-I141 HydrophobicContact CD2-CG2 4.49Å; P138-I141 PolarHBondContact O-N 2.99Å; I141-L143 PolarHBondContact O-N 3.46Å; I141-L144 PolarHBondContact O-N 3.08Å; I141-M145 HydrophobicContact CG2-CE 4.26Å; I141-M145 HydrophobicContact CG2-CG 4.22Å; I141-M145 VanDerWaalsContact O-CG 3.29Å; I141-M145 WeakPolarHBondContact O-CG 3.21Å; I141-M145 PolarHBondContact O-N 3.45Å |
| 142 | V | 94.4 | Very high | 92 | Very high | 93 Ų | 93 | 51.1 Ų | 51.1 | 56% | 0.564 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -59.9 | -46.4 | 179.1 | 174.7 | 0 | 0 | 0 | 0 | 111.3 | P138 V139 M145 L146 | P138-V142 PolarHBondContact O-N 2.95Å; V139-V142 PolarHBondContact O-N 3.42Å; V142-M145 PolarHBondContact O-N 2.94Å; V142-L146 WeakPolarHBondContact O-CB 3.28Å; V142-L146 PolarHBondContact O-N 3.46Å |
| 143 | L | 93.8 | Very high | 92.2 | Very high | 30 Ų | 30 | 49.5 Ų | 49.5 | 16% | 0.157 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -69.6 | -35.1 | 176.9 | -73.4 | 168.3 | 0 | 0 | 0 | 113 | F126 L127 V133 V139 I141 L146 Y147 | F126-L143 HydrophobicContact CD1-CD1 4.38Å; F126-L143 HydrophobicContact CE1-CD1 3.96Å; L127-L143 HydrophobicContact CD1-CB 4.41Å; L127-L143 HydrophobicContact CD2-CB 3.9Å; L127-L143 HydrophobicContact CD2-CD1 4.3Å; L127-L143 HydrophobicContact CG-CB 4.43Å; V133-L143 HydrophobicContact CG1-CD1 3.34Å; V139-L143 HydrophobicContact CG1-CD1 3.97Å; V139-L143 WeakPolarHBondContact O-CB 3.49Å; V139-L143 WeakPolarHBondContact O-CG 3.43Å; V139-L143 PolarHBondContact O-N 2.87Å; I141-L143 PolarHBondContact O-N 3.46Å; L143-L146 HydrophobicContact CD2-CD2 4.46Å; L143-L146 PolarHBondContact O-N 3.33Å; L143-Y147 WeakPolarHBondContact O-CB 3.42Å; L143-Y147 PolarHBondContact O-N 3.34Å |
| 144 | L | 94.4 | Very high | 92.4 | Very high | 0 Ų | 0 | 48.6 Ų | 48.6 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -65.3 | -41.6 | 175.5 | -175 | 66.9 | 0 | 0 | 0 | 111.5 | L68 N140 I141 T148 L250 | L68-L144 HydrophobicContact CB-CD2 4.39Å; L68-L144 HydrophobicContact CD1-CD2 4.12Å; L68-L144 HydrophobicContact CD2-CD2 4.38Å; N140-L144 VanDerWaalsContact O-CB 3.22Å; N140-L144 WeakPolarHBondContact O-CB 3.46Å; N140-L144 PolarHBondContact O-N 3.12Å; I141-L144 PolarHBondContact O-N 3.08Å; L144-T148 WeakPolarHBondContact O-CB 3.36Å; L144-T148 PolarHBondContact O-N 3.09Å; L144-T148 PolarHBondContact O-OG1 3.39Å; L144-L250 HydrophobicContact CD1-CB 3.88Å; L144-L250 HydrophobicContact CD1-CD1 3.89Å |
| 145 | M | 96.3 | Very high | 92.5 | Very high | 35 Ų | 35 | 48.4 Ų | 48.4 | 17% | 0.172 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -69.3 | -40.1 | 175.2 | -64.8 | -59.3 | 167.9 | 0 | 0 | 111.7 | L68 I71 L75 I141 V142 T148 M149 | L68-M145 HydrophobicContact CD2-CE 3.95Å; I71-M145 HydrophobicContact CB-CE 4.05Å; I71-M145 HydrophobicContact CD1-CE 4.38Å; I71-M145 HydrophobicContact CG2-CE 3.54Å; I71-M145 HydrophobicContact CG2-SD 3.87Å; L75-M145 HydrophobicContact CD2-SD 4.27Å; I141-M145 HydrophobicContact CG2-CE 4.26Å; I141-M145 HydrophobicContact CG2-CG 4.22Å; I141-M145 VanDerWaalsContact O-CG 3.29Å; I141-M145 WeakPolarHBondContact O-CG 3.21Å; I141-M145 PolarHBondContact O-N 3.45Å; V142-M145 PolarHBondContact O-N 2.94Å; M145-T148 PolarHBondContact O-N 3.17Å; M145-M149 WeakPolarHBondContact O-CG 3.45Å; M145-M149 PolarHBondContact O-N 3.34Å |
| 146 | L | 95.1 | Very high | 92.7 | Very high | 77 Ų | 77 | 40.6 Ų | 40.6 | 40% | 0.403 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -60.6 | -47.6 | 174 | -179.4 | 62.7 | 0 | 0 | 0 | 111.6 | I123 V142 L143 T148 M149 L150 | I123-L146 HydrophobicContact CD1-CD2 3.92Å; I123-L146 HydrophobicContact CD1-CG 4.11Å; V142-L146 WeakPolarHBondContact O-CB 3.28Å; V142-L146 PolarHBondContact O-N 3.46Å; L143-L146 HydrophobicContact CD2-CD2 4.46Å; L143-L146 PolarHBondContact O-N 3.33Å; L146-T148 VanDerWaalsContact C-N 3.32Å; L146-T148 PolarHBondContact O-N 2.85Å; L146-M149 PolarHBondContact O-N 3.36Å; L146-L150 HydrophobicContact CD1-CD1 3.94Å; L146-L150 HydrophobicContact CD1-CG 4.21Å; L146-L150 HydrophobicContact CG-CD1 3.9Å; L146-L150 WeakPolarHBondContact O-CB 3.31Å; L146-L150 VanDerWaalsContact O-CG 3.28Å; L146-L150 WeakPolarHBondContact O-CG 3.41Å; L146-L150 PolarHBondContact O-N 2.93Å |
| 147 | Y | 95.8 | Very high | 92.7 | Very high | 0 Ų | 0 | 36 Ų | 36 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -58.5 | -43.3 | 173.2 | 173.2 | -109.5 | 0 | 0 | 0 | 111.8 | N120 L124 L143 T151 L250 Y253 T254 | N120-Y147 WeakPolarHBondContact ND2-CE2 3.35Å; N120-Y147 VanDerWaalsContact OD1-CD2 3.28Å; N120-Y147 WeakPolarHBondContact OD1-CD2 3.27Å; N120-Y147 WeakPolarHBondContact OD1-CE2 3.49Å; N120-Y147 PolarHBondContact OD1-O 2.93Å; N120-Y147 VanDerWaalsContact OD1-O 3.1Å; L124-Y147 HydrophobicContact CB-CD2 4.18Å; L124-Y147 HydrophobicContact CB-CE2 3.66Å; L124-Y147 HydrophobicContact CD1-CE1 4.22Å; L124-Y147 HydrophobicContact CD1-CE2 4.05Å; L124-Y147 HydrophobicContact CD2-CE2 4.28Å; L124-Y147 HydrophobicContact CG-CE2 4.2Å; L143-Y147 WeakPolarHBondContact O-CB 3.42Å; L143-Y147 PolarHBondContact O-N 3.34Å; Y147-T151 WeakPolarHBondContact CE2-OG1 3.47Å; Y147-T151 VanDerWaalsContact CZ-OG1 3.24Å; Y147-T151 WeakPolarHBondContact O-CB 3.5Å; Y147-T151 PolarHBondContact O-N 3.49Å; Y147-T151 PolarHBondContact O-OG1 3.27Å; Y147-L250 HydrophobicContact CD1-CD1 3.29Å; Y147-L250 HydrophobicContact CE1-CD1 3.36Å; Y147-L250 HydrophobicContact CG-CD1 4.11Å; Y147-Y253 HydrophobicContact CD1-CD1 4.2Å; Y147-Y253 HydrophobicContact CD1-CE1 4.24Å; Y147-Y253 AromaticContact CE1-CD1 3.77Å; Y147-Y253 HydrophobicContact CE1-CD1 3.77Å; Y147-Y253 AromaticContact CE1-CE1 3.93Å; Y147-Y253 HydrophobicContact CE1-CE1 3.93Å; Y147-T254 WeakPolarHBondContact CE1-OG1 3.47Å; Y147-T254 PolarHBondContact OH-OG1 2.85Å |
| 148 | T | 96.6 | Very high | 92.7 | Very high | 0 Ų | 0 | 32.6 Ų | 32.6 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -58.2 | -57.1 | 174 | -78.8 | 0 | 0 | 0 | 0 | 111 | Q72 L75 L144 M145 L146 L150 T151 S152 Y253 | Q72-T148 HydrophobicContact CB-CG2 4.08Å; Q72-T148 HydrophobicContact CG-CG2 4.31Å; Q72-T148 VanDerWaalsContact CG-OG1 3.27Å; Q72-T148 WeakPolarHBondContact CG-OG1 3.49Å; Q72-T148 PolarHBondContact NE2-OG1 3.2Å; L75-T148 HydrophobicContact CB-CG2 4.17Å; L75-T148 HydrophobicContact CD2-CG2 3.84Å; L75-T148 HydrophobicContact CG-CG2 4.07Å; L144-T148 WeakPolarHBondContact O-CB 3.36Å; L144-T148 PolarHBondContact O-N 3.09Å; L144-T148 PolarHBondContact O-OG1 3.39Å; M145-T148 PolarHBondContact O-N 3.17Å; L146-T148 VanDerWaalsContact C-N 3.32Å; L146-T148 PolarHBondContact O-N 2.85Å; T148-L150 VanDerWaalsContact C-N 3.31Å; T148-L150 PolarHBondContact O-N 3.49Å; T148-T151 CarbonylContact O-C 3.57Å; T148-T151 PolarHBondContact O-N 3.45Å; T148-T151 VanDerWaalsContact O-N 3.09Å; T148-S152 PolarHBondContact O-N 3.3Å; T148-S152 PolarHBondContact O-OG 3.26Å; T148-Y253 HydrophobicContact CG2-CE1 4.44Å; T148-Y253 HydrophobicContact CG2-CE2 4.06Å; T148-Y253 PolarHBondContact O-OH 3.14Å; T148-Y253 VanDerWaalsContact O-OH 3.12Å; T148-Y253 WeakPolarHBondContact OG1-CE1 3.4Å |
| 149 | M | 95.6 | Very high | 92.5 | Very high | 95 Ų | 95 | 28.7 Ų | 28.7 | 47% | 0.468 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -57.2 | -42.3 | -176.8 | -67.1 | 179.5 | 79.1 | 0 | 0 | 112.7 | L75 I79 M145 L146 L153 | L75-M149 HydrophobicContact CD1-CG 4.35Å; L75-M149 HydrophobicContact CD2-CG 3.68Å; L75-M149 HydrophobicContact CD2-SD 4.47Å; L75-M149 HydrophobicContact CG-CG 4.14Å; I79-M149 HydrophobicContact CD1-CB 4.12Å; I79-M149 HydrophobicContact CD1-CG 4.06Å; M145-M149 WeakPolarHBondContact O-CG 3.45Å; M145-M149 PolarHBondContact O-N 3.34Å; L146-M149 PolarHBondContact O-N 3.36Å; M149-L153 WeakPolarHBondContact O-CB 3.49Å; M149-L153 PolarHBondContact O-N 3.33Å |
| 150 | L | 94.9 | Very high | 92.1 | Very high | 23 Ų | 23 | 26.4 Ų | 26.4 | 12% | 0.12 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -66.8 | -44.7 | 176.3 | -69 | 170.8 | 0 | 0 | 0 | 111.5 | L116 I119 N120 I123 L146 T148 L153 T154 | L116-L150 HydrophobicContact CD1-CD2 3.52Å; L116-L150 HydrophobicContact CG-CD2 4.24Å; I119-L150 HydrophobicContact CG2-CD1 4.15Å; N120-L150 HydrophobicContact CB-CB 4.08Å; N120-L150 VanDerWaalsContact OD1-CB 3.28Å; N120-L150 WeakPolarHBondContact OD1-CB 3.42Å; I123-L150 HydrophobicContact CD1-CD1 3.39Å; L146-L150 HydrophobicContact CD1-CD1 3.94Å; L146-L150 HydrophobicContact CD1-CG 4.21Å; L146-L150 HydrophobicContact CG-CD1 3.9Å; L146-L150 WeakPolarHBondContact O-CB 3.31Å; L146-L150 VanDerWaalsContact O-CG 3.28Å; L146-L150 WeakPolarHBondContact O-CG 3.41Å; L146-L150 PolarHBondContact O-N 2.93Å; T148-L150 VanDerWaalsContact C-N 3.31Å; T148-L150 PolarHBondContact O-N 3.49Å; L150-L153 PolarHBondContact O-N 3.11Å; L150-T154 WeakPolarHBondContact O-CB 3.43Å; L150-T154 PolarHBondContact O-N 3.3Å; L150-T154 PolarHBondContact O-OG1 3.21Å |
| 151 | T | 94.1 | Very high | 91.6 | Very high | 1 Ų | 1 | 30.9 Ų | 30.9 | 1% | 0.006 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -61.1 | -46.4 | 174.9 | -62.9 | 0 | 0 | 0 | 0 | 110.8 | N120 Y147 T148 L153 V155 Y253 M257 | N120-T151 VanDerWaalsContact CG-OG1 3.31Å; N120-T151 PolarHBondContact ND2-OG1 3.03Å; N120-T151 PolarHBondContact OD1-N 3.48Å; N120-T151 PolarHBondContact OD1-OG1 3.38Å; Y147-T151 WeakPolarHBondContact CE2-OG1 3.47Å; Y147-T151 VanDerWaalsContact CZ-OG1 3.24Å; Y147-T151 WeakPolarHBondContact O-CB 3.5Å; Y147-T151 PolarHBondContact O-N 3.49Å; Y147-T151 PolarHBondContact O-OG1 3.27Å; T148-T151 CarbonylContact O-C 3.57Å; T148-T151 PolarHBondContact O-N 3.45Å; T148-T151 VanDerWaalsContact O-N 3.09Å; T151-L153 VanDerWaalsContact C-N 3.34Å; T151-L153 PolarHBondContact O-N 3.38Å; T151-V155 HydrophobicContact CG2-CG2 4.02Å; T151-V155 WeakPolarHBondContact O-CB 3.36Å; T151-V155 WeakPolarHBondContact O-CG2 3.38Å; T151-V155 PolarHBondContact O-N 2.95Å; T151-Y253 HydrophobicContact CG2-CE1 3.91Å; T151-M257 HydrophobicContact CG2-CB 4.06Å; T151-M257 HydrophobicContact CG2-CE 4.33Å; T151-M257 HydrophobicContact CG2-CG 3.9Å |
| 152 | S | 94.5 | Very high | 91.2 | Very high | 0 Ų | 0 | 28.9 Ų | 28.9 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -59.4 | -45.9 | 177.5 | -40.7 | 0 | 0 | 0 | 0 | 111 | S76 T148 A156 Y253 | S76-S152 WeakPolarHBondContact CA-OG 3.48Å; S76-S152 PolarHBondContact OG-OG 2.86Å; T148-S152 PolarHBondContact O-N 3.3Å; T148-S152 PolarHBondContact O-OG 3.26Å; S152-A156 WeakPolarHBondContact O-CB 3.09Å; S152-A156 PolarHBondContact O-N 3.01Å; S152-Y253 PolarHBondContact OG-OH 2.91Å |
| 153 | L | 92.3 | Very high | 90.9 | Very high | 54 Ų | 54 | 31.8 Ų | 31.8 | 28% | 0.283 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -66.1 | -55.6 | -178.4 | -178.7 | 58.6 | 0 | 0 | 0 | 111 | L83 L116 M149 L150 T151 V155 A156 L157 | L83-L153 HydrophobicContact CD1-CD1 3.77Å; L83-L153 HydrophobicContact CD2-CD1 3.77Å; L83-L153 HydrophobicContact CG-CD1 4.34Å; L116-L153 HydrophobicContact CD2-CB 4.18Å; L116-L153 HydrophobicContact CD2-CD2 3.69Å; L116-L153 HydrophobicContact CD2-CG 3.64Å; M149-L153 WeakPolarHBondContact O-CB 3.49Å; M149-L153 PolarHBondContact O-N 3.33Å; L150-L153 PolarHBondContact O-N 3.11Å; T151-L153 VanDerWaalsContact C-N 3.34Å; T151-L153 PolarHBondContact O-N 3.38Å; L153-V155 PolarHBondContact O-N 3.18Å; L153-A156 PolarHBondContact O-N 3.02Å; L153-L157 HydrophobicContact CD1-CD1 3.8Å; L153-L157 HydrophobicContact CD1-CD2 4.33Å; L153-L157 HydrophobicContact CD1-CG 3.94Å; L153-L157 HydrophobicContact CG-CD1 3.91Å; L153-L157 HydrophobicContact CG-CG 4.47Å; L153-L157 WeakPolarHBondContact O-CB 3.3Å; L153-L157 WeakPolarHBondContact O-CD1 3.19Å; L153-L157 WeakPolarHBondContact O-CG 3.29Å; L153-L157 PolarHBondContact O-N 3.24Å; L153-L157 VanDerWaalsContact O-N 3.09Å |
| 154 | T | 90.3 | Very high | 90.7 | Very high | 6 Ų | 6 | 33.8 Ų | 33.8 | 4% | 0.037 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -53.3 | -56 | 175.1 | -64.6 | 0 | 0 | 0 | 0 | 110.4 | R27 L116 A117 L150 A156 L157 | R27-T154 PolarHBondContact NH1-O 3.28Å; R27-T154 PolarHBondContact NH2-O 3.14Å; L116-T154 WeakPolarHBondContact CD2-OG1 3.44Å; L116-T154 WeakPolarHBondContact CG-OG1 3.24Å; A117-T154 HydrophobicContact CB-CG2 3.82Å; L150-T154 WeakPolarHBondContact O-CB 3.43Å; L150-T154 PolarHBondContact O-N 3.3Å; L150-T154 PolarHBondContact O-OG1 3.21Å; T154-A156 VanDerWaalsContact C-N 3.34Å; T154-A156 PolarHBondContact O-N 3.38Å; T154-L157 PolarHBondContact O-N 3.01Å |
| 155 | V | 90 | Very high | 90.5 | Very high | 4 Ų | 4 | 38.5 Ų | 38.5 | 2% | 0.024 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -62.8 | -36.8 | -174.4 | 169.9 | 0 | 0 | 0 | 0 | 112.2 | F31 T151 L153 F159 M257 W260 L261 | F31-V155 HydrophobicContact CZ-CG2 4.27Å; T151-V155 HydrophobicContact CG2-CG2 4.02Å; T151-V155 WeakPolarHBondContact O-CB 3.36Å; T151-V155 WeakPolarHBondContact O-CG2 3.38Å; T151-V155 PolarHBondContact O-N 2.95Å; L153-V155 PolarHBondContact O-N 3.18Å; V155-F159 WeakPolarHBondContact O-CD2 3.48Å; V155-F159 VanDerWaalsContact O-CE2 3.27Å; V155-F159 WeakPolarHBondContact O-CE2 3.22Å; V155-M257 HydrophobicContact CB-CE 3.97Å; V155-M257 HydrophobicContact CG1-CE 3.79Å; V155-M257 HydrophobicContact CG2-CE 4.39Å; V155-W260 HydrophobicContact CG1-CE3 3.51Å; V155-W260 HydrophobicContact CG1-CZ3 3.69Å; V155-L261 HydrophobicContact CG1-CB 4.1Å; V155-L261 HydrophobicContact CG1-CD1 4.25Å |
| 156 | A | 90.4 | Very high | 90.1 | Very high | 3 Ų | 3 | 40.4 Ų | 40.4 | 3% | 0.025 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -83.6 | -22.2 | -177.3 | 0 | 0 | 0 | 0 | 0 | 115.3 | T80 L83 S152 L153 T154 F159 T160 | T80-A156 HydrophobicContact CG2-CB 4.23Å; T80-A156 WeakPolarHBondContact OG1-CB 3.31Å; L83-A156 HydrophobicContact CD1-CB 3.92Å; S152-A156 WeakPolarHBondContact O-CB 3.09Å; S152-A156 PolarHBondContact O-N 3.01Å; L153-A156 PolarHBondContact O-N 3.02Å; T154-A156 VanDerWaalsContact C-N 3.34Å; T154-A156 PolarHBondContact O-N 3.38Å; A156-F159 PolarHBondContact O-N 3.14Å; A156-T160 PolarHBondContact O-N 3.25Å |
| 157 | L | 87.6 | Confident | 89.9 | Confident | 30 Ų | 30 | 36.9 Ų | 36.9 | 16% | 0.157 | 18% | 0.183 | C | C | . | . | S | Bend | trans | -59.2 | -48.3 | -170.2 | -88.8 | 166.8 | 0 | 0 | 0 | 115.2 | L83 E113 L116 L153 T154 F159 T160 | L83-L157 HydrophobicContact CD2-CD2 4.35Å; E113-L157 HydrophobicContact CG-CB 4.33Å; E113-L157 HydrophobicContact CG-CD1 3.9Å; E113-L157 WeakPolarHBondContact OE2-CB 3.08Å; L116-L157 HydrophobicContact CD2-CD1 4.33Å; L153-L157 HydrophobicContact CD1-CD1 3.8Å; L153-L157 HydrophobicContact CD1-CD2 4.33Å; L153-L157 HydrophobicContact CD1-CG 3.94Å; L153-L157 HydrophobicContact CG-CD1 3.91Å; L153-L157 HydrophobicContact CG-CG 4.47Å; L153-L157 WeakPolarHBondContact O-CB 3.3Å; L153-L157 WeakPolarHBondContact O-CD1 3.19Å; L153-L157 WeakPolarHBondContact O-CG 3.29Å; L153-L157 PolarHBondContact O-N 3.24Å; L153-L157 VanDerWaalsContact O-N 3.09Å; T154-L157 PolarHBondContact O-N 3.01Å; L157-F159 PolarHBondContact O-N 3.27Å; L157-T160 HydrophobicContact CD2-CG2 4.42Å; L157-T160 WeakPolarHBondContact O-CB 3.39Å; L157-T160 WeakPolarHBondContact O-CG2 3.34Å; L157-T160 PolarHBondContact O-N 3.22Å; L157-T160 VanDerWaalsContact O-N 3.09Å; L157-T160 PolarHBondContact O-OG1 2.98Å; L157-T160 VanDerWaalsContact O-OG1 3.05Å |
| 158 | P | 84.8 | Confident | 89.8 | Confident | 17 Ų | 17 | 41.3 Ų | 41.3 | 11% | 0.11 | 21% | 0.206 | C | C | . | . | G | 310 helix | trans | -64.4 | -27.6 | 179.1 | -22.6 | 34 | 0 | 0 | 0 | 113 | N20 T23 R27 E113 T160 | N20-P158 WeakPolarHBondContact OD1-CB 3.1Å; T23-P158 HydrophobicContact CG2-CG 4.15Å; R27-P158 VanDerWaalsContact NH1-CD 3.31Å; R27-P158 VanDerWaalsContact NH1-CG 3.33Å; E113-P158 WeakPolarHBondContact OE2-CD 3.37Å; E113-P158 WeakPolarHBondContact OE2-CG 3.19Å; P158-T160 VanDerWaalsContact C-N 3.29Å; P158-T160 PolarHBondContact O-N 3.48Å |
| 159 | F | 86.1 | Confident | 89.6 | Confident | 2 Ų | 2 | 45.6 Ų | 45.6 | 1% | 0.009 | 23% | 0.227 | C | C | . | . | G | 310 helix | trans | -85.8 | 5 | -179.8 | -51.4 | -72.8 | 0 | 0 | 0 | 112.8 | V155 A156 L157 S161 L162 K167 W260 L261 V264 Q265 | V155-F159 WeakPolarHBondContact O-CD2 3.48Å; V155-F159 VanDerWaalsContact O-CE2 3.27Å; V155-F159 WeakPolarHBondContact O-CE2 3.22Å; A156-F159 PolarHBondContact O-N 3.14Å; L157-F159 PolarHBondContact O-N 3.27Å; F159-S161 PolarHBondContact O-N 3.3Å; F159-L162 HydrophobicContact CB-CD1 4.14Å; F159-L162 HydrophobicContact CD1-CD1 4.03Å; F159-L162 WeakPolarHBondContact O-CB 3.37Å; F159-L162 PolarHBondContact O-N 3.4Å; F159-L162 VanDerWaalsContact O-N 3.1Å; F159-K167 WeakPolarHBondContact O-CE 2.46Å; F159-K167 PolarHBondContact O-NZ 2.94Å; F159-W260 HydrophobicContact CD2-CH2 4.42Å; F159-W260 HydrophobicContact CD2-CZ3 4.1Å; F159-L261 HydrophobicContact CE2-CD1 3.47Å; F159-L261 VanDerWaalsContact CE2-CD1 3.47Å; F159-L261 HydrophobicContact CZ-CD1 3.68Å; F159-V264 HydrophobicContact CB-CG2 4.19Å; F159-V264 HydrophobicContact CD1-CB 4.4Å; F159-V264 HydrophobicContact CD1-CG1 3.74Å; F159-V264 HydrophobicContact CD1-CG2 3.85Å; F159-V264 HydrophobicContact CD2-CG1 3.75Å; F159-V264 HydrophobicContact CE1-CG1 3.76Å; F159-V264 HydrophobicContact CE2-CG1 3.77Å; F159-V264 HydrophobicContact CG-CG1 3.75Å; F159-V264 HydrophobicContact CG-CG2 3.96Å; F159-V264 HydrophobicContact CZ-CG1 3.79Å; F159-Q265 HydrophobicContact CE1-CG 3.89Å; F159-Q265 HydrophobicContact CZ-CG 3.66Å |
| 160 | T | 83.1 | Confident | 89.4 | Confident | 26 Ų | 26 | 41.1 Ų | 41.1 | 16% | 0.16 | 21% | 0.205 | C | C | . | . | G | 310 helix | trans | -54.2 | -42 | 178.6 | 53.4 | 0 | 0 | 0 | 0 | 111.2 | L83 Q87 A156 L157 P158 L162 K167 | L83-T160 HydrophobicContact CB-CG2 4.06Å; Q87-T160 PolarHBondContact OE1-O 2.99Å; Q87-T160 PolarHBondContact OE1-OG1 3.33Å; A156-T160 PolarHBondContact O-N 3.25Å; L157-T160 HydrophobicContact CD2-CG2 4.42Å; L157-T160 WeakPolarHBondContact O-CB 3.39Å; L157-T160 WeakPolarHBondContact O-CG2 3.34Å; L157-T160 PolarHBondContact O-N 3.22Å; L157-T160 VanDerWaalsContact O-N 3.09Å; L157-T160 PolarHBondContact O-OG1 2.98Å; L157-T160 VanDerWaalsContact O-OG1 3.05Å; P158-T160 VanDerWaalsContact C-N 3.29Å; P158-T160 PolarHBondContact O-N 3.48Å; T160-L162 PolarHBondContact O-N 2.67Å; T160-L162 VanDerWaalsContact O-N 3.15Å; T160-K167 PolarHBondContact O-NZ 2.7Å |
| 161 | S | 81.2 | Confident | 89.4 | Confident | 93 Ų | 93 | 40.4 Ų | 40.4 | 65% | 0.65 | 20% | 0.201 | S | C | * | . | G | 310 helix | trans | -69.9 | -8.6 | -177.6 | -56.6 | 0 | 0 | 0 | 0 | 115.1 | Q87 F159 | Q87-S161 PolarHBondContact NE2-OG 3.01Å; Q87-S161 VanDerWaalsContact OE1-N 3.13Å; F159-S161 PolarHBondContact O-N 3.3Å |
| 162 | L | 85 | Confident | 89.4 | Confident | 18 Ų | 18 | 43.1 Ų | 43.1 | 9% | 0.094 | 22% | 0.223 | C | C | . | . | S | Bend | trans | -71 | 144.8 | 170.5 | -71.5 | 178.7 | 0 | 0 | 0 | 111.5 | F159 T160 K167 V264 Q268 I271 | F159-L162 HydrophobicContact CB-CD1 4.14Å; F159-L162 HydrophobicContact CD1-CD1 4.03Å; F159-L162 WeakPolarHBondContact O-CB 3.37Å; F159-L162 PolarHBondContact O-N 3.4Å; F159-L162 VanDerWaalsContact O-N 3.1Å; T160-L162 PolarHBondContact O-N 2.67Å; T160-L162 VanDerWaalsContact O-N 3.15Å; L162-K167 HydrophobicContact CB-CG 4.49Å; L162-K167 WeakPolarHBondContact O-CE 2.47Å; L162-K167 PolarHBondContact O-NZ 3.1Å; L162-V264 HydrophobicContact CD1-CG2 3.46Å; L162-V264 VanDerWaalsContact CD1-CG2 3.46Å; L162-Q268 HydrophobicContact CD1-CB 4.22Å; L162-Q268 HydrophobicContact CD2-CB 4.1Å; L162-Q268 HydrophobicContact CD2-CG 4.01Å; L162-I271 HydrophobicContact CD2-CD1 4.33Å |
| 163 | R | 86.9 | Confident | 89.3 | Confident | 154 Ų | 154 | 46.1 Ų | 46.1 | 58% | 0.581 | 24% | 0.242 | S | C | * | . | trans | -58.7 | 144.4 | 170.3 | -68.5 | 170.1 | 61.2 | 166.6 | -0.7 | 110.9 | E165 W166 | R163-E165 IonicContact CZ-OE1 3.25Å; R163-E165 VanDerWaalsContact CZ-OE1 3.25Å; R163-E165 IonicContact CZ-OE2 3.45Å; R163-E165 IonicContact NE-OE1 2.86Å; R163-E165 PolarHBondContact NE-OE1 3.16Å; R163-E165 IonicContact NE-OE2 3.67Å; R163-E165 IonicContact NH2-OE1 2.82Å; R163-E165 PolarHBondContact NH2-OE1 2.71Å; R163-E165 IonicContact NH2-OE2 2.74Å; R163-E165 PolarHBondContact NH2-OE2 3.41Å; R163-E165 PolarHBondContact O-N 3.41Å; R163-W166 PolarHBondContact O-N 2.88Å; R163-W166 VanDerWaalsContact O-N 3.14Å | ||
| 164 | I | 89.6 | Confident | 89.3 | Confident | 72 Ų | 72 | 43.6 Ų | 43.6 | 37% | 0.369 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -57 | -35 | -177.5 | -167 | 170 | 0 | 0 | 0 | 113 | L81 T84 W166 K167 I168 | L81-I164 HydrophobicContact CD2-CD1 4.07Å; L81-I164 HydrophobicContact CD2-CG1 3.86Å; T84-I164 HydrophobicContact CG2-CB 4.23Å; I164-W166 VanDerWaalsContact C-N 3.34Å; I164-W166 PolarHBondContact O-N 3.32Å; I164-K167 PolarHBondContact O-N 3.32Å; I164-K167 VanDerWaalsContact O-N 3.14Å; I164-I168 HydrophobicContact CG1-CD1 3.98Å; I164-I168 HydrophobicContact CG1-CG1 4.4Å; I164-I168 WeakPolarHBondContact O-CG1 2.48Å; I164-I168 PolarHBondContact O-N 3.08Å |
| 165 | E | 89.7 | Confident | 89.4 | Confident | 98 Ų | 98 | 45.7 Ų | 45.7 | 46% | 0.458 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -53.1 | -48 | 175.8 | -63.6 | 142.1 | -101.1 | 0 | 0 | 112.2 | R163 K167 I168 M169 | R163-E165 IonicContact CZ-OE1 3.25Å; R163-E165 VanDerWaalsContact CZ-OE1 3.25Å; R163-E165 IonicContact CZ-OE2 3.45Å; R163-E165 IonicContact NE-OE1 2.86Å; R163-E165 PolarHBondContact NE-OE1 3.16Å; R163-E165 IonicContact NE-OE2 3.67Å; R163-E165 IonicContact NH2-OE1 2.82Å; R163-E165 PolarHBondContact NH2-OE1 2.71Å; R163-E165 IonicContact NH2-OE2 2.74Å; R163-E165 PolarHBondContact NH2-OE2 3.41Å; R163-E165 PolarHBondContact O-N 3.41Å; E165-K167 VanDerWaalsContact C-N 3.32Å; E165-K167 PolarHBondContact O-N 3.31Å; E165-I168 PolarHBondContact O-N 2.85Å; E165-M169 WeakPolarHBondContact O-CB 2.47Å; E165-M169 PolarHBondContact O-N 3.31Å |
| 166 | W | 89.6 | Confident | 89.5 | Confident | 76 Ų | 76 | 51.9 Ų | 51.9 | 29% | 0.288 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -70.1 | -28.6 | -178.8 | -58.6 | 120.4 | 0 | 0 | 0 | 112.6 | R163 I164 M169 A170 L267 I271 | R163-W166 PolarHBondContact O-N 2.88Å; R163-W166 VanDerWaalsContact O-N 3.14Å; I164-W166 VanDerWaalsContact C-N 3.34Å; I164-W166 PolarHBondContact O-N 3.32Å; W166-M169 HydrophobicContact CE3-SD 3.86Å; W166-M169 HydrophobicContact CZ3-SD 3.82Å; W166-A170 WeakPolarHBondContact O-CB 2.46Å; W166-A170 PolarHBondContact O-N 3.46Å; W166-L267 HydrophobicContact CE3-CD2 4.38Å; W166-I271 HydrophobicContact CB-CD1 4.17Å; W166-I271 VanDerWaalsContact CD1-CD1 3.49Å; W166-I271 HydrophobicContact CD2-CD1 3.52Å; W166-I271 HydrophobicContact CD2-CG1 4.18Å; W166-I271 HydrophobicContact CE3-CD1 4.18Å; W166-I271 HydrophobicContact CG-CD1 3.49Å; W166-I271 VanDerWaalsContact CG-CD1 3.49Å; W166-I271 HydrophobicContact CZ2-CD1 4.3Å; W166-I271 HydrophobicContact CZ2-CG1 4.08Å |
| 167 | K | 90.6 | Very high | 89.4 | Confident | 3 Ų | 3 | 52.6 Ų | 52.6 | 1% | 0.013 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -73.5 | -40 | 175 | -61.5 | 175.8 | -167.7 | 177.1 | 0 | 111.8 | T80 T84 F159 T160 L162 I164 E165 A170 W171 | T80-K167 HydrophobicContact CG2-CB 4.46Å; T80-K167 HydrophobicContact CG2-CD 4.13Å; T84-K167 WeakPolarHBondContact OG1-CD 3.23Å; T84-K167 PolarHBondContact OG1-NZ 3.46Å; F159-K167 WeakPolarHBondContact O-CE 2.46Å; F159-K167 PolarHBondContact O-NZ 2.94Å; T160-K167 PolarHBondContact O-NZ 2.7Å; L162-K167 HydrophobicContact CB-CG 4.49Å; L162-K167 WeakPolarHBondContact O-CE 2.47Å; L162-K167 PolarHBondContact O-NZ 3.1Å; I164-K167 PolarHBondContact O-N 3.32Å; I164-K167 VanDerWaalsContact O-N 3.14Å; E165-K167 VanDerWaalsContact C-N 3.32Å; E165-K167 PolarHBondContact O-N 3.31Å; K167-A170 PolarHBondContact O-N 3.42Å; K167-W171 VanDerWaalsContact O-CD1 3.22Å; K167-W171 PolarHBondContact O-N 3.15Å |
| 168 | I | 93 | Very high | 89.5 | Confident | 93 Ų | 93 | 51.7 Ų | 51.7 | 48% | 0.477 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -65.5 | -42.7 | 173.8 | -66.4 | 169.4 | 0 | 0 | 0 | 109.5 | L81 I164 E165 W171 A172 | L81-I168 HydrophobicContact CD2-CG1 4.22Å; I164-I168 HydrophobicContact CG1-CD1 3.98Å; I164-I168 HydrophobicContact CG1-CG1 4.4Å; I164-I168 WeakPolarHBondContact O-CG1 2.48Å; I164-I168 PolarHBondContact O-N 3.08Å; E165-I168 PolarHBondContact O-N 2.85Å; I168-W171 PolarHBondContact O-N 3.46Å; I168-A172 WeakPolarHBondContact O-CB 3.46Å; I168-A172 PolarHBondContact O-N 2.94Å |
| 169 | M | 91.6 | Very high | 89.7 | Confident | 90 Ų | 90 | 54.6 Ų | 54.6 | 44% | 0.443 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -60.6 | -45.6 | 173 | -174.1 | 177.6 | -179.8 | 0 | 0 | 112 | E165 W166 W171 A172 V173 L267 | E165-M169 WeakPolarHBondContact O-CB 2.47Å; E165-M169 PolarHBondContact O-N 3.31Å; W166-M169 HydrophobicContact CE3-SD 3.86Å; W166-M169 HydrophobicContact CZ3-SD 3.82Å; M169-W171 PolarHBondContact O-N 2.9Å; M169-A172 PolarHBondContact O-N 3.19Å; M169-V173 HydrophobicContact CG-CG2 4.48Å; M169-V173 WeakPolarHBondContact O-CG2 2.46Å; M169-V173 PolarHBondContact O-N 3.27Å; M169-L267 HydrophobicContact CE-CD2 4.43Å; M169-L267 HydrophobicContact SD-CD2 4.24Å |
| 170 | A | 92.5 | Very high | 89.7 | Confident | 0 Ų | 0 | 56.6 Ų | 56.6 | 0% | 0 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -57 | -51.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | W166 K167 A172 V173 T174 I263 V264 L267 | W166-A170 WeakPolarHBondContact O-CB 2.46Å; W166-A170 PolarHBondContact O-N 3.46Å; K167-A170 PolarHBondContact O-N 3.42Å; A170-A172 VanDerWaalsContact C-N 3.35Å; A170-A172 PolarHBondContact O-N 3.35Å; A170-V173 PolarHBondContact O-N 3.38Å; A170-T174 PolarHBondContact O-N 3.05Å; A170-T174 PolarHBondContact O-OG1 3.11Å; A170-I263 HydrophobicContact CB-CG2 3.96Å; A170-V264 HydrophobicContact CB-CB 4.1Å; A170-V264 HydrophobicContact CB-CG2 4.37Å; A170-L267 HydrophobicContact CB-CD1 3.85Å |
| 171 | W | 94.5 | Very high | 89.8 | Confident | 9 Ų | 9 | 58 Ų | 58 | 3% | 0.034 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -58 | -42.5 | 176.1 | -84.3 | 118 | 0 | 0 | 0 | 113.2 | S76 I77 K167 I168 M169 T174 L175 M256 M257 W260 | S76-W171 VanDerWaalsContact CB-CH2 3.48Å; I77-W171 HydrophobicContact CD1-CD2 4.31Å; I77-W171 HydrophobicContact CD1-CE3 4.26Å; I77-W171 HydrophobicContact CG1-CD2 3.52Å; I77-W171 HydrophobicContact CG1-CE3 3.79Å; I77-W171 HydrophobicContact CG1-CG 3.97Å; I77-W171 HydrophobicContact CG1-CH2 4.25Å; I77-W171 HydrophobicContact CG1-CZ2 3.99Å; I77-W171 HydrophobicContact CG1-CZ3 4.15Å; K167-W171 VanDerWaalsContact O-CD1 3.22Å; K167-W171 PolarHBondContact O-N 3.15Å; I168-W171 PolarHBondContact O-N 3.46Å; M169-W171 PolarHBondContact O-N 2.9Å; W171-T174 PolarHBondContact O-N 3.4Å; W171-L175 WeakPolarHBondContact O-CB 3.48Å; W171-L175 VanDerWaalsContact O-CG 3.26Å; W171-L175 WeakPolarHBondContact O-CG 3.44Å; W171-L175 PolarHBondContact O-N 3.32Å; W171-M256 HydrophobicContact CH2-CE 4.4Å; W171-M256 HydrophobicContact CZ3-CE 4.08Å; W171-M257 HydrophobicContact CH2-CE 4.43Å; W171-M257 HydrophobicContact CH2-SD 3.81Å; W171-W260 AromaticContact CD1-NE1 3.41Å; W171-W260 AromaticContact CD2-CD1 3.46Å; W171-W260 VanDerWaalsContact CD2-CD1 3.46Å; W171-W260 HydrophobicContact CD2-CG 4.4Å; W171-W260 AromaticContact CD2-NE1 3.28Å; W171-W260 VanDerWaalsContact CD2-NE1 3.28Å; W171-W260 AromaticContact CE2-CD1 3.73Å; W171-W260 AromaticContact CE2-CE2 3.78Å; W171-W260 AromaticContact CE2-NE1 3.31Å; W171-W260 VanDerWaalsContact CE2-NE1 3.31Å; W171-W260 AromaticContact CE3-CD1 3.61Å; W171-W260 HydrophobicContact CE3-CG 4.42Å; W171-W260 AromaticContact CE3-NE1 3.95Å; W171-W260 AromaticContact CG-CD1 3.89Å; W171-W260 AromaticContact CG-NE1 3.35Å; W171-W260 VanDerWaalsContact CG-NE1 3.35Å; W171-W260 HydrophobicContact CH2-CG 4.33Å; W171-W260 HydrophobicContact CZ2-CD2 4.36Å; W171-W260 HydrophobicContact CZ2-CG 4.33Å; W171-W260 AromaticContact CZ2-NE1 3.98Å; W171-W260 AromaticContact CZ3-CD1 3.98Å; W171-W260 HydrophobicContact CZ3-CG 4.39Å; W171-W260 AromaticContact NE1-CE2 3.71Å; W171-W260 AromaticContact NE1-CZ2 3.88Å; W171-W260 AromaticContact NE1-NE1 3.39Å |
| 172 | A | 93.6 | Very high | 89.8 | Confident | 58 Ų | 58 | 54 Ų | 54 | 48% | 0.479 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -64.2 | -43.6 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | I168 M169 A170 L176 | I168-A172 WeakPolarHBondContact O-CB 3.46Å; I168-A172 PolarHBondContact O-N 2.94Å; M169-A172 PolarHBondContact O-N 3.19Å; A170-A172 VanDerWaalsContact C-N 3.35Å; A170-A172 PolarHBondContact O-N 3.35Å; A172-L176 WeakPolarHBondContact O-CB 3.45Å; A172-L176 PolarHBondContact O-N 2.99Å; A172-L176 VanDerWaalsContact O-N 3.14Å |
| 173 | V | 92.1 | Very high | 89.8 | Confident | 63 Ų | 63 | 58.2 Ų | 58.2 | 38% | 0.382 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -66.5 | -44.5 | 176.6 | 178.2 | 0 | 0 | 0 | 0 | 110.7 | M169 A170 L176 S177 I263 | M169-V173 HydrophobicContact CG-CG2 4.48Å; M169-V173 WeakPolarHBondContact O-CG2 2.46Å; M169-V173 PolarHBondContact O-N 3.27Å; A170-V173 PolarHBondContact O-N 3.38Å; V173-L176 PolarHBondContact O-N 2.84Å; V173-S177 PolarHBondContact O-N 3.36Å; V173-S177 PolarHBondContact O-OG 2.95Å; V173-I263 HydrophobicContact CB-CD1 4.36Å; V173-I263 HydrophobicContact CB-CG2 4.3Å; V173-I263 HydrophobicContact CG1-CD1 3.8Å; V173-I263 HydrophobicContact CG1-CG1 4.44Å; V173-I263 HydrophobicContact CG1-CG2 4.39Å |
| 174 | T | 92.5 | Very high | 89.6 | Confident | 0 Ų | 0 | 55.3 Ų | 55.3 | 0% | 0 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -63.1 | -42.5 | 178 | -54.9 | 0 | 0 | 0 | 0 | 112.6 | A170 W171 L176 S177 F178 M256 D259 W260 I263 | A170-T174 PolarHBondContact O-N 3.05Å; A170-T174 PolarHBondContact O-OG1 3.11Å; W171-T174 PolarHBondContact O-N 3.4Å; T174-L176 VanDerWaalsContact C-N 3.31Å; T174-L176 PolarHBondContact O-N 3.36Å; T174-S177 WeakPolarHBondContact CA-OG 3.43Å; T174-S177 PolarHBondContact O-OG 2.92Å; T174-F178 WeakPolarHBondContact O-CB 3.21Å; T174-F178 PolarHBondContact O-N 3.45Å; T174-M256 HydrophobicContact CG2-CG 4.02Å; T174-M256 WeakPolarHBondContact CG2-O 3.37Å; T174-D259 HydrophobicContact CG2-CB 4.27Å; T174-W260 HydrophobicContact CG2-CB 4.01Å; T174-W260 VanDerWaalsContact OG1-CA 3.29Å; T174-W260 WeakPolarHBondContact OG1-CA 3.39Å; T174-I263 WeakPolarHBondContact OG1-CD1 3.4Å |
| 175 | L | 93.3 | Very high | 89 | Confident | 51 Ų | 51 | 51.9 Ų | 51.9 | 27% | 0.267 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -66.4 | -37.2 | 178.7 | -71.4 | 170.6 | 0 | 0 | 0 | 111.1 | I73 I77 W171 V179 M256 | I73-L175 HydrophobicContact CD1-CD2 4.12Å; I73-L175 HydrophobicContact CG1-CD2 4.36Å; I73-L175 HydrophobicContact CG2-CD2 3.93Å; I77-L175 HydrophobicContact CD1-CD1 4.32Å; W171-L175 WeakPolarHBondContact O-CB 3.48Å; W171-L175 VanDerWaalsContact O-CG 3.26Å; W171-L175 WeakPolarHBondContact O-CG 3.44Å; W171-L175 PolarHBondContact O-N 3.32Å; L175-V179 WeakPolarHBondContact O-CB 2.97Å; L175-V179 VanDerWaalsContact O-CG2 3.23Å; L175-V179 WeakPolarHBondContact O-CG2 3.47Å; L175-V179 PolarHBondContact O-N 3.11Å; L175-M256 HydrophobicContact CD2-SD 4.4Å |
| 176 | L | 92.1 | Very high | 88.6 | Confident | 133 Ų | 133 | 48.7 Ų | 48.7 | 70% | 0.696 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -68.6 | -46.6 | 176.1 | -176.1 | 61.7 | 0 | 0 | 0 | 112.3 | A172 V173 T174 A180 | A172-L176 WeakPolarHBondContact O-CB 3.45Å; A172-L176 PolarHBondContact O-N 2.99Å; A172-L176 VanDerWaalsContact O-N 3.14Å; V173-L176 PolarHBondContact O-N 2.84Å; T174-L176 VanDerWaalsContact C-N 3.31Å; T174-L176 PolarHBondContact O-N 3.36Å; L176-A180 VanDerWaalsContact O-CB 3.29Å; L176-A180 WeakPolarHBondContact O-CB 3.49Å; L176-A180 PolarHBondContact O-N 3.2Å; L176-A180 VanDerWaalsContact O-N 3.11Å |
| 177 | S | 88 | Confident | 88.1 | Confident | 19 Ų | 19 | 49.2 Ų | 49.2 | 13% | 0.133 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -61.7 | -53.7 | 175.5 | 61.7 | 0 | 0 | 0 | 0 | 110.3 | V173 T174 V179 A180 F181 D259 | V173-S177 PolarHBondContact O-N 3.36Å; V173-S177 PolarHBondContact O-OG 2.95Å; T174-S177 WeakPolarHBondContact CA-OG 3.43Å; T174-S177 PolarHBondContact O-OG 2.92Å; S177-V179 PolarHBondContact O-N 3.36Å; S177-A180 PolarHBondContact O-N 3.34Å; S177-A180 VanDerWaalsContact O-N 3.15Å; S177-F181 WeakPolarHBondContact O-CD2 3.39Å; S177-F181 PolarHBondContact O-N 2.94Å; S177-D259 PolarHBondContact OG-OD2 2.86Å |
| 178 | F | 89 | Confident | 87.4 | Confident | 10 Ų | 10 | 51.8 Ų | 51.8 | 4% | 0.044 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -57.9 | -45.7 | -176.5 | 177.4 | -101.4 | 0 | 0 | 0 | 112.6 | L69 T174 T182 M225 L252 M256 | L69-F178 HydrophobicContact CD2-CE1 3.91Å; L69-F178 HydrophobicContact CD2-CZ 3.99Å; T174-F178 WeakPolarHBondContact O-CB 3.21Å; T174-F178 PolarHBondContact O-N 3.45Å; F178-T182 WeakPolarHBondContact CE2-OG1 3.49Å; F178-T182 WeakPolarHBondContact O-CB 3.49Å; F178-T182 PolarHBondContact O-N 2.93Å; F178-T182 PolarHBondContact O-OG1 2.73Å; F178-M225 HydrophobicContact CB-CE 4.15Å; F178-M225 HydrophobicContact CD2-CE 4.33Å; F178-L252 HydrophobicContact CE2-CD2 4.19Å; F178-L252 WeakPolarHBondContact CE2-O 3.22Å; F178-L252 HydrophobicContact CZ-CB 4.03Å; F178-L252 HydrophobicContact CZ-CD2 3.74Å; F178-L252 HydrophobicContact CZ-CG 4.49Å; F178-M256 HydrophobicContact CB-CG 4.21Å; F178-M256 HydrophobicContact CD1-CB 4.5Å; F178-M256 HydrophobicContact CD1-CG 4.16Å; F178-M256 HydrophobicContact CD1-SD 4.35Å; F178-M256 HydrophobicContact CD2-CB 3.64Å; F178-M256 HydrophobicContact CD2-CG 3.97Å; F178-M256 HydrophobicContact CE2-CB 3.75Å; F178-M256 HydrophobicContact CE2-CG 4.41Å; F178-M256 HydrophobicContact CG-CB 4.04Å; F178-M256 HydrophobicContact CG-CG 3.83Å; F178-M256 HydrophobicContact CZ-CB 4.23Å |
| 179 | V | 89.2 | Confident | 86.2 | Confident | 79 Ų | 79 | 57.8 Ų | 57.8 | 48% | 0.479 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -64.5 | -46.2 | 176.4 | 170.5 | 0 | 0 | 0 | 0 | 110.9 | L175 S177 L183 | L175-V179 WeakPolarHBondContact O-CB 2.97Å; L175-V179 VanDerWaalsContact O-CG2 3.23Å; L175-V179 WeakPolarHBondContact O-CG2 3.47Å; L175-V179 PolarHBondContact O-N 3.11Å; S177-V179 PolarHBondContact O-N 3.36Å; V179-L183 HydrophobicContact CG1-CD1 3.76Å; V179-L183 HydrophobicContact CG1-CG 4.46Å; V179-L183 WeakPolarHBondContact O-CB 3.48Å; V179-L183 VanDerWaalsContact O-CG 3.25Å; V179-L183 WeakPolarHBondContact O-CG 3.26Å; V179-L183 PolarHBondContact O-N 3.43Å |
| 180 | A | 87.1 | Confident | 85.1 | Confident | 43 Ų | 43 | 59.1 Ų | 59.1 | 36% | 0.355 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -61 | -52.6 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | L176 S177 L183 L184 | L176-A180 VanDerWaalsContact O-CB 3.29Å; L176-A180 WeakPolarHBondContact O-CB 3.49Å; L176-A180 PolarHBondContact O-N 3.2Å; L176-A180 VanDerWaalsContact O-N 3.11Å; S177-A180 PolarHBondContact O-N 3.34Å; S177-A180 VanDerWaalsContact O-N 3.15Å; A180-L183 PolarHBondContact O-N 2.67Å; A180-L184 WeakPolarHBondContact O-CB 3.14Å; A180-L184 VanDerWaalsContact O-CG 3.25Å; A180-L184 WeakPolarHBondContact O-CG 3.47Å; A180-L184 PolarHBondContact O-N 2.92Å |
| 181 | F | 84.7 | Confident | 83.7 | Confident | 55 Ų | 55 | 64 Ų | 64 | 24% | 0.241 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -73.3 | -30.2 | -177.4 | -69 | -73.5 | 0 | 0 | 0 | 113.1 | S177 L184 G185 L222 M225 L226 | S177-F181 WeakPolarHBondContact O-CD2 3.39Å; S177-F181 PolarHBondContact O-N 2.94Å; F181-L184 HydrophobicContact CD1-CD1 4.2Å; F181-L184 HydrophobicContact CE1-CD1 4.45Å; F181-G185 PolarHBondContact O-N 3.4Å; F181-L222 HydrophobicContact CD1-CD2 4.32Å; F181-L222 HydrophobicContact CD2-CD2 3.51Å; F181-L222 HydrophobicContact CE1-CD1 4.12Å; F181-L222 HydrophobicContact CE1-CD2 4.18Å; F181-L222 HydrophobicContact CE1-CG 4.48Å; F181-L222 HydrophobicContact CE2-CD1 4.27Å; F181-L222 HydrophobicContact CE2-CD2 3.36Å; F181-L222 HydrophobicContact CE2-CG 4.37Å; F181-L222 HydrophobicContact CG-CD2 4.03Å; F181-L222 HydrophobicContact CZ-CD1 3.79Å; F181-L222 HydrophobicContact CZ-CD2 3.73Å; F181-L222 HydrophobicContact CZ-CG 4.27Å; F181-M225 HydrophobicContact CB-CB 3.65Å; F181-M225 HydrophobicContact CB-CG 4.33Å; F181-M225 HydrophobicContact CB-SD 3.65Å; F181-M225 HydrophobicContact CD2-SD 4.04Å; F181-M225 HydrophobicContact CG-SD 4.19Å; F181-L226 HydrophobicContact CD1-CD2 4.19Å; F181-L226 HydrophobicContact CD1-CG 4.32Å; F181-L226 WeakPolarHBondContact O-CD2 3.4Å |
| 182 | T | 81.9 | Confident | 82.2 | Confident | 10 Ų | 10 | 64.5 Ų | 64.5 | 6% | 0.061 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -66.4 | -42.3 | 172.3 | -59.6 | 0 | 0 | 0 | 0 | 111.2 | F178 G185 A186 F233 L252 | F178-T182 WeakPolarHBondContact CE2-OG1 3.49Å; F178-T182 WeakPolarHBondContact O-CB 3.49Å; F178-T182 PolarHBondContact O-N 2.93Å; F178-T182 PolarHBondContact O-OG1 2.73Å; T182-G185 PolarHBondContact O-N 2.97Å; T182-A186 WeakPolarHBondContact O-CB 3.34Å; T182-A186 PolarHBondContact O-N 3.25Å; T182-F233 HydrophobicContact CG2-CD2 3.82Å; T182-F233 HydrophobicContact CG2-CE2 3.82Å; T182-L252 HydrophobicContact CG2-CD2 3.78Å |
| 183 | L | 84.6 | Confident | 80.9 | Confident | 107 Ų | 107 | 62.5 Ų | 62.5 | 56% | 0.56 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -68.9 | -39.2 | 176.6 | -71.2 | 172.8 | 0 | 0 | 0 | 112.5 | V179 A180 A186 S187 | V179-L183 HydrophobicContact CG1-CD1 3.76Å; V179-L183 HydrophobicContact CG1-CG 4.46Å; V179-L183 WeakPolarHBondContact O-CB 3.48Å; V179-L183 VanDerWaalsContact O-CG 3.25Å; V179-L183 WeakPolarHBondContact O-CG 3.26Å; V179-L183 PolarHBondContact O-N 3.43Å; A180-L183 PolarHBondContact O-N 2.67Å; L183-A186 PolarHBondContact O-N 3.43Å; L183-S187 WeakPolarHBondContact O-CB 3.25Å; L183-S187 PolarHBondContact O-N 3.47Å; L183-S187 PolarHBondContact O-OG 2.8Å |
| 184 | L | 82.9 | Confident | 79.4 | Confident | 92 Ų | 92 | 65 Ų | 65 | 48% | 0.482 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -62.1 | -45.4 | 172.1 | -72.2 | 168.3 | 0 | 0 | 0 | 111 | A180 F181 A186 S187 I188 L226 | A180-L184 WeakPolarHBondContact O-CB 3.14Å; A180-L184 VanDerWaalsContact O-CG 3.25Å; A180-L184 WeakPolarHBondContact O-CG 3.47Å; A180-L184 PolarHBondContact O-N 2.92Å; F181-L184 HydrophobicContact CD1-CD1 4.2Å; F181-L184 HydrophobicContact CE1-CD1 4.45Å; L184-A186 PolarHBondContact O-N 3.16Å; L184-S187 WeakPolarHBondContact O-CB 3.37Å; L184-S187 PolarHBondContact O-N 3.46Å; L184-I188 WeakPolarHBondContact O-CD1 3.32Å; L184-I188 VanDerWaalsContact O-CG1 3.29Å; L184-I188 WeakPolarHBondContact O-CG1 3.4Å; L184-I188 PolarHBondContact O-N 3.32Å; L184-I188 VanDerWaalsContact O-N 3.08Å; L184-L226 HydrophobicContact CB-CD2 3.75Å |
| 185 | G | 77.2 | Confident | 77.8 | Confident | 0 Ų | 0 | 68.8 Ų | 68.8 | 0% | 0 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -59 | -45.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | F181 T182 S187 I188 L226 | F181-G185 PolarHBondContact O-N 3.4Å; T182-G185 PolarHBondContact O-N 2.97Å; G185-S187 PolarHBondContact O-N 3.13Å; G185-I188 PolarHBondContact O-N 3.02Å; G185-L226 VanDerWaalsContact CA-O 3.3Å; G185-L226 WeakPolarHBondContact CA-O 3.23Å |
| 186 | A | 79.8 | Confident | 76.2 | Confident | 31 Ų | 31 | 67 Ų | 67 | 26% | 0.256 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -63.5 | -28.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | T182 L183 L184 F233 | T182-A186 WeakPolarHBondContact O-CB 3.34Å; T182-A186 PolarHBondContact O-N 3.25Å; L183-A186 PolarHBondContact O-N 3.43Å; L184-A186 PolarHBondContact O-N 3.16Å; A186-F233 HydrophobicContact CB-CB 3.78Å |
| 187 | S | 80.2 | Confident | 74.4 | Confident | 87 Ų | 87 | 64 Ų | 64 | 61% | 0.608 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -82.7 | -22.4 | -180 | -58.6 | 0 | 0 | 0 | 0 | 113.7 | L183 L184 G185 R189 | L183-S187 WeakPolarHBondContact O-CB 3.25Å; L183-S187 PolarHBondContact O-N 3.47Å; L183-S187 PolarHBondContact O-OG 2.8Å; L184-S187 WeakPolarHBondContact O-CB 3.37Å; L184-S187 PolarHBondContact O-N 3.46Å; G185-S187 PolarHBondContact O-N 3.13Å; S187-R189 PolarHBondContact O-N 3.36Å |
| 188 | I | 76.7 | Confident | 72.8 | Confident | 57 Ų | 57 | 72.6 Ų | 72.6 | 29% | 0.292 | 36% | 0.358 | S | S | . | . | trans | -75.2 | 125.2 | -176.6 | -72.4 | 160.5 | 0 | 0 | 0 | 110.9 | L184 G185 I190 L192 L226 Q230 | L184-I188 WeakPolarHBondContact O-CD1 3.32Å; L184-I188 VanDerWaalsContact O-CG1 3.29Å; L184-I188 WeakPolarHBondContact O-CG1 3.4Å; L184-I188 PolarHBondContact O-N 3.32Å; L184-I188 VanDerWaalsContact O-N 3.08Å; G185-I188 PolarHBondContact O-N 3.02Å; I188-I190 HydrophobicContact CG2-CB 4.38Å; I188-I190 WeakPolarHBondContact CG2-O 3.26Å; I188-L192 HydrophobicContact CB-CD1 4.45Å; I188-L192 HydrophobicContact CD1-CD1 4.07Å; I188-L192 HydrophobicContact CD1-CD2 4.48Å; I188-L192 HydrophobicContact CG2-CD1 4.19Å; I188-L192 HydrophobicContact CG2-CD2 4.01Å; I188-L192 HydrophobicContact CG2-CG 3.94Å; I188-L226 HydrophobicContact CD1-CD2 4.02Å; I188-Q230 PolarHBondContact O-NE2 3.28Å | ||
| 189 | R | 67.5 | Low | 71.2 | Confident | 220 Ų | 220 | 77.1 Ų | 77.1 | 83% | 0.83 | 38% | 0.378 | S | S | * | . | trans | -89.5 | -8.5 | -176.2 | -60.4 | -177.7 | -178.9 | -179.1 | 0.8 | 114.7 | S187 | S187-R189 PolarHBondContact O-N 3.36Š| ||
| 190 | I | 66.8 | Low | 69.4 | Low | 118 Ų | 118 | 75 Ų | 75 | 61% | 0.605 | 36% | 0.364 | S | S | * | . | S | Bend | trans | -96.9 | 137.5 | -179.7 | -59 | 171.4 | 0 | 0 | 0 | 108.4 | I188 L192 Q230 | I188-I190 HydrophobicContact CG2-CB 4.38Å; I188-I190 WeakPolarHBondContact CG2-O 3.26Å; I190-L192 PolarHBondContact O-N 2.86Å; I190-Q230 PolarHBondContact O-NE2 3.22Å; I190-Q230 PolarHBondContact O-OE1 2.9Å |
| 191 | R | 64 | Low | 68 | Low | 101 Ų | 101 | 77.2 Ų | 77.2 | 38% | 0.381 | 37% | 0.373 | S | S | . | . | trans | -66 | 99.8 | 178.1 | -72.4 | -173.2 | 170.4 | 169.9 | -4 | 111.3 | L193 Y194 D237 F238 | R191-L193 VanDerWaalsContact C-N 3.29Å; R191-L193 PolarHBondContact O-N 2.8Å; R191-Y194 HydrophobicContact CB-CD2 3.94Å; R191-Y194 PolarHBondContact O-N 3.05Å; R191-D237 PolarHBondContact NH2-O 2.94Å; R191-F238 HydrophobicContact CG-CD1 3.56Å; R191-F238 HydrophobicContact CG-CE1 3.48Å; R191-F238 VanDerWaalsContact CG-CE1 3.48Å; R191-F238 HydrophobicContact CG-CG 4.43Å; R191-F238 HydrophobicContact CG-CZ 4.28Å; R191-F238 VanDerWaalsContact NE-CD1 3.26Å; R191-F238 VanDerWaalsContact NE-CE1 3.3Å | ||
| 192 | L | 63.7 | Low | 66.7 | Low | 21 Ų | 21 | 78.5 Ų | 78.5 | 11% | 0.11 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -63.7 | -32.5 | -175 | -72.8 | 173.5 | 0 | 0 | 0 | 113.1 | I188 I190 Y194 T195 N196 L226 I227 | I188-L192 HydrophobicContact CB-CD1 4.45Å; I188-L192 HydrophobicContact CD1-CD1 4.07Å; I188-L192 HydrophobicContact CD1-CD2 4.48Å; I188-L192 HydrophobicContact CG2-CD1 4.19Å; I188-L192 HydrophobicContact CG2-CD2 4.01Å; I188-L192 HydrophobicContact CG2-CG 3.94Å; I190-L192 PolarHBondContact O-N 2.86Å; L192-Y194 VanDerWaalsContact C-N 3.31Å; L192-Y194 PolarHBondContact O-N 3.3Å; L192-T195 PolarHBondContact O-N 3.47Å; L192-N196 VanDerWaalsContact O-CB 3.31Å; L192-N196 WeakPolarHBondContact O-CB 3.44Å; L192-N196 VanDerWaalsContact O-CG 3.27Å; L192-N196 PolarHBondContact O-N 3.11Å; L192-N196 PolarHBondContact O-ND2 3.38Å; L192-L226 HydrophobicContact CD1-CB 3.64Å; L192-I227 HydrophobicContact CB-CG1 4.03Å |
| 193 | L | 65.3 | Low | 65.4 | Low | 15 Ų | 15 | 80 Ų | 80 | 8% | 0.079 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -60.8 | -38.9 | -176.6 | -156.6 | 111.4 | 0 | 0 | 0 | 112.7 | L39 E42 R191 L197 I227 | L39-L193 HydrophobicContact CD2-CD1 3.96Å; L39-L193 HydrophobicContact CD2-CD2 3.76Å; L39-L193 HydrophobicContact CD2-CG 3.95Å; E42-L193 WeakPolarHBondContact OE2-CD1 3.22Å; E42-L193 WeakPolarHBondContact OE2-CD2 3.46Å; R191-L193 VanDerWaalsContact C-N 3.29Å; R191-L193 PolarHBondContact O-N 2.8Å; L193-L197 WeakPolarHBondContact O-CB 3.44Å; L193-L197 PolarHBondContact O-N 3.12Å; L193-L197 VanDerWaalsContact O-N 3.15Å; L193-I227 HydrophobicContact CD1-CD1 4.43Å; L193-I227 HydrophobicContact CD1-CG2 3.78Å |
| 194 | Y | 61.7 | Low | 63.9 | Low | 116 Ų | 116 | 79.8 Ų | 79.8 | 46% | 0.455 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -74.6 | -36.5 | 177.4 | -70.8 | -82.2 | 0 | 0 | 0 | 112.6 | R191 L192 L197 | R191-Y194 HydrophobicContact CB-CD2 3.94Å; R191-Y194 PolarHBondContact O-N 3.05Å; L192-Y194 VanDerWaalsContact C-N 3.31Å; L192-Y194 PolarHBondContact O-N 3.3Å; Y194-L197 HydrophobicContact CD1-CD1 4.41Å |
| 195 | T | 58.9 | Low | 62.5 | Low | 79 Ų | 79 | 80.2 Ų | 80.2 | 49% | 0.485 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -68.2 | -41.5 | 176.3 | -53.3 | 0 | 0 | 0 | 0 | 111.6 | L192 | L192-T195 PolarHBondContact O-N 3.47Å |
| 196 | N | 59.3 | Low | 61.1 | Low | 15 Ų | 15 | 83.7 Ų | 83.7 | 8% | 0.08 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -86.3 | -5.7 | -175.3 | -61.7 | -25.3 | 0 | 0 | 0 | 113.5 | L192 W198 F199 L200 T223 I227 | L192-N196 VanDerWaalsContact O-CB 3.31Å; L192-N196 WeakPolarHBondContact O-CB 3.44Å; L192-N196 VanDerWaalsContact O-CG 3.27Å; L192-N196 PolarHBondContact O-N 3.11Å; L192-N196 PolarHBondContact O-ND2 3.38Å; N196-W198 PolarHBondContact O-N 3.4Å; N196-F199 PolarHBondContact O-N 3.45Å; N196-L200 PolarHBondContact O-N 3.1Å; N196-T223 HydrophobicContact CB-CG2 3.9Å; N196-T223 WeakPolarHBondContact ND2-CG2 3.14Å; N196-I227 HydrophobicContact CB-CD1 4.47Å |
| 197 | L | 54.6 | Low | 59.5 | Low | 70 Ų | 70 | 90.4 Ų | 90.4 | 37% | 0.366 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -57.4 | -34.2 | -178.4 | -135.9 | 159 | 0 | 0 | 0 | 112.5 | L193 Y194 F199 L200 V201 | L193-L197 WeakPolarHBondContact O-CB 3.44Å; L193-L197 PolarHBondContact O-N 3.12Å; L193-L197 VanDerWaalsContact O-N 3.15Å; Y194-L197 HydrophobicContact CD1-CD1 4.41Å; L197-F199 VanDerWaalsContact C-N 3.31Å; L197-F199 PolarHBondContact O-N 2.67Å; L197-L200 PolarHBondContact O-N 3.17Å; L197-V201 PolarHBondContact O-N 2.88Å |
| 198 | W | 55 | Low | 57.9 | Low | 199 Ų | 199 | 93.2 Ų | 93.2 | 75% | 0.754 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -59 | -37.2 | 174 | -63.9 | 103.3 | 0 | 0 | 0 | 113.4 | N196 V201 I202 | N196-W198 PolarHBondContact O-N 3.4Å; W198-V201 PolarHBondContact O-N 2.82Å; W198-I202 WeakPolarHBondContact O-CG1 3.49Å; W198-I202 PolarHBondContact O-N 3.37Å |
| 199 | F | 53.4 | Low | 56.8 | Low | 105 Ų | 105 | 93.1 Ų | 93.1 | 46% | 0.461 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -76.5 | -25.9 | 179.7 | -73.3 | -77.6 | 0 | 0 | 0 | 113.2 | N196 L197 V201 I202 S203 Y219 | N196-F199 PolarHBondContact O-N 3.45Å; L197-F199 VanDerWaalsContact C-N 3.31Å; L197-F199 PolarHBondContact O-N 2.67Å; F199-V201 VanDerWaalsContact C-N 3.32Å; F199-I202 HydrophobicContact CD1-CD1 4.02Å; F199-I202 HydrophobicContact CE1-CD1 4.29Å; F199-I202 PolarHBondContact O-N 3.14Å; F199-S203 WeakPolarHBondContact O-CB 3Å; F199-S203 PolarHBondContact O-N 3.36Å; F199-Y219 HydrophobicContact CD1-CE1 4.37Å; F199-Y219 HydrophobicContact CD2-CE1 4.16Å; F199-Y219 HydrophobicContact CE2-CE1 4.42Å; F199-Y219 HydrophobicContact CG-CE1 4.14Å |
| 200 | L | 52.6 | Low | 56.3 | Low | 33 Ų | 33 | 89.8 Ų | 89.8 | 17% | 0.173 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -64.9 | -38 | 171.6 | -99.1 | 153.6 | 0 | 0 | 0 | 111.6 | L39 N196 L197 S203 F220 | L39-L200 HydrophobicContact CD1-CD1 3.76Å; L39-L200 HydrophobicContact CD1-CD2 4.27Å; L39-L200 HydrophobicContact CD2-CD1 3.77Å; L39-L200 HydrophobicContact CG-CD1 4.24Å; N196-L200 PolarHBondContact O-N 3.1Å; L197-L200 PolarHBondContact O-N 3.17Å; L200-S203 PolarHBondContact O-N 3.17Å; L200-S203 PolarHBondContact O-OG 2.74Å; L200-F220 HydrophobicContact CD2-CE2 4.2Å |
| 201 | V | 56.7 | Low | 55.6 | Low | 91 Ų | 91 | 90.4 Ų | 90.4 | 55% | 0.552 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -62.1 | -48.9 | 171.8 | -177.6 | 0 | 0 | 0 | 0 | 110.5 | L197 W198 F199 S203 T204 | L197-V201 PolarHBondContact O-N 2.88Å; W198-V201 PolarHBondContact O-N 2.82Å; F199-V201 VanDerWaalsContact C-N 3.32Å; V201-S203 VanDerWaalsContact C-N 3.29Å; V201-S203 PolarHBondContact O-N 3.1Å; V201-T204 PolarHBondContact O-N 3.39Å; V201-T204 VanDerWaalsContact O-N 3.1Å; V201-T204 PolarHBondContact O-OG1 3.06Å |
| 202 | I | 57.2 | Low | 55.2 | Low | 81 Ų | 81 | 88.7 Ų | 88.7 | 42% | 0.415 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -59 | -39.2 | 178.3 | -63.7 | 166.8 | 0 | 0 | 0 | 111.8 | W198 F199 T204 T205 | W198-I202 WeakPolarHBondContact O-CG1 3.49Å; W198-I202 PolarHBondContact O-N 3.37Å; F199-I202 HydrophobicContact CD1-CD1 4.02Å; F199-I202 HydrophobicContact CE1-CD1 4.29Å; F199-I202 PolarHBondContact O-N 3.14Å; I202-T204 PolarHBondContact O-N 3.35Å; I202-T204 VanDerWaalsContact O-N 3.08Å; I202-T205 PolarHBondContact O-N 3.4Å; I202-T205 PolarHBondContact O-OG1 3.08Å |
| 203 | S | 54.6 | Low | 55.1 | Low | 43 Ų | 43 | 89.9 Ų | 89.9 | 30% | 0.301 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -61.6 | -19.1 | 179.2 | 74.3 | 0 | 0 | 0 | 0 | 114.1 | F199 L200 V201 T205 | F199-S203 WeakPolarHBondContact O-CB 3Å; F199-S203 PolarHBondContact O-N 3.36Å; L200-S203 PolarHBondContact O-N 3.17Å; L200-S203 PolarHBondContact O-OG 2.74Å; V201-S203 VanDerWaalsContact C-N 3.29Å; V201-S203 PolarHBondContact O-N 3.1Å; S203-T205 VanDerWaalsContact C-N 3.33Å |
| 204 | T | 54.2 | Low | 54.9 | Low | 102 Ų | 102 | 93 Ų | 93 | 63% | 0.626 | 50% | 0.497 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.7 | -7.4 | 175 | 66.1 | 0 | 0 | 0 | 0 | 113.8 | V201 I202 | V201-T204 PolarHBondContact O-N 3.39Å; V201-T204 VanDerWaalsContact O-N 3.1Å; V201-T204 PolarHBondContact O-OG1 3.06Å; I202-T204 PolarHBondContact O-N 3.35Å; I202-T204 VanDerWaalsContact O-N 3.08Å |
| 205 | T | 54.1 | Low | 55 | Low | 101 Ų | 101 | 94.9 Ų | 94.9 | 62% | 0.62 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -110.1 | 6.6 | -176.1 | 61.9 | 0 | 0 | 0 | 0 | 114.2 | I202 S203 L207 | I202-T205 PolarHBondContact O-N 3.4Å; I202-T205 PolarHBondContact O-OG1 3.08Å; S203-T205 VanDerWaalsContact C-N 3.33Å; T205-L207 PolarHBondContact O-N 2.87Å |
| 206 | E | 47.3 | Very low | 55.4 | Low | 73 Ų | 73 | 93.1 Ų | 93.1 | 34% | 0.341 | 50% | 0.497 | S | S | . | . | trans | -79.1 | 81.4 | -173 | -59.3 | -144.2 | 141.8 | 0 | 0 | 113.4 | V216 | E206-V216 WeakPolarHBondContact OE1-CG2 3.17Š| ||
| 207 | L | 45.1 | Very low | 56 | Low | 171 Ų | 171 | 94.3 Ų | 94.3 | 90% | 0.895 | 51% | 0.506 | S | S | * | . | trans | -113.7 | 14.5 | 164.2 | -120.7 | 176.6 | 0 | 0 | 0 | 112.6 | T205 | T205-L207 PolarHBondContact O-N 2.87Š| ||
| 208 | I | 47.8 | Very low | 56.9 | Low | 147 Ų | 147 | 93.9 Ų | 93.9 | 75% | 0.754 | 50% | 0.502 | S | S | * | . | S | Bend | trans | -125.4 | 124.7 | -175.4 | -59.4 | -179.4 | 0 | 0 | 0 | 110.6 | ||
| 209 | A | 52.7 | Low | 57.8 | Low | 54 Ų | 54 | 89.5 Ų | 89.5 | 45% | 0.446 | 49% | 0.486 | S | S | . | . | trans | 62.2 | 106.9 | 172.5 | 0 | 0 | 0 | 0 | 0 | 117.1 | I211 V212 A213 | A209-I211 PolarHBondContact O-N 2.94Å; A209-V212 HydrophobicContact CB-CB 4.32Å; A209-V212 HydrophobicContact CB-CG2 3.87Å; A209-V212 WeakPolarHBondContact O-CB 3.25Å; A209-V212 PolarHBondContact O-N 2.85Å; A209-A213 PolarHBondContact O-N 3.14Å | ||
| 210 | I | 57.4 | Low | 59 | Low | 150 Ų | 150 | 87 Ų | 87 | 77% | 0.769 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -50 | -33.5 | 170.7 | -64.2 | 163 | 0 | 0 | 0 | 112.5 | A213 V214 | I210-A213 PolarHBondContact O-N 3.31Å; I210-V214 PolarHBondContact O-N 3.47Å |
| 211 | I | 51.8 | Low | 60.2 | Low | 131 Ų | 131 | 86.1 Ų | 86.1 | 67% | 0.672 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -65.7 | -40.8 | 176.7 | -62.7 | 170.1 | 0 | 0 | 0 | 111.5 | A209 F215 | A209-I211 PolarHBondContact O-N 2.94Å; I211-F215 HydrophobicContact CG2-CD2 4.42Å; I211-F215 HydrophobicContact CG2-CE2 4.35Å; I211-F215 WeakPolarHBondContact O-CD2 3.45Å |
| 212 | V | 56.6 | Low | 61.5 | Low | 66 Ų | 66 | 83.5 Ų | 83.5 | 40% | 0.4 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -66.4 | -45.6 | 176.9 | 177.2 | 0 | 0 | 0 | 0 | 109.8 | A209 V214 F215 V216 | A209-V212 HydrophobicContact CB-CB 4.32Å; A209-V212 HydrophobicContact CB-CG2 3.87Å; A209-V212 WeakPolarHBondContact O-CB 3.25Å; A209-V212 PolarHBondContact O-N 2.85Å; V212-V214 VanDerWaalsContact C-N 3.26Å; V212-V214 PolarHBondContact O-N 2.95Å; V212-F215 PolarHBondContact O-N 3.22Å; V212-V216 HydrophobicContact CG1-CG2 3.79Å; V212-V216 WeakPolarHBondContact O-CG2 3.29Å; V212-V216 PolarHBondContact O-N 3.41Å |
| 213 | A | 60.7 | Low | 62.7 | Low | 45 Ų | 45 | 80.2 Ų | 80.2 | 37% | 0.372 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -55.7 | -35.6 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | A209 I210 S217 | A209-A213 PolarHBondContact O-N 3.14Å; I210-A213 PolarHBondContact O-N 3.31Å; A213-S217 WeakPolarHBondContact O-CB 3.33Å; A213-S217 PolarHBondContact O-N 3.05Å |
| 214 | V | 62.2 | Low | 64 | Low | 81 Ų | 81 | 79 Ų | 79 | 49% | 0.491 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -66.7 | -47.5 | 174.9 | 174.2 | 0 | 0 | 0 | 0 | 111.6 | I210 V212 Q218 | I210-V214 PolarHBondContact O-N 3.47Å; V212-V214 VanDerWaalsContact C-N 3.26Å; V212-V214 PolarHBondContact O-N 2.95Å; V214-Q218 PolarHBondContact O-N 3.47Å; V214-Q218 VanDerWaalsContact O-N 3.13Å |
| 215 | F | 63.4 | Low | 65.4 | Low | 155 Ų | 155 | 74.2 Ų | 74.2 | 68% | 0.68 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -66.7 | -40.7 | 178.4 | -79.8 | -72.6 | 0 | 0 | 0 | 112.2 | I211 V212 Q218 Y219 | I211-F215 HydrophobicContact CG2-CD2 4.42Å; I211-F215 HydrophobicContact CG2-CE2 4.35Å; I211-F215 WeakPolarHBondContact O-CD2 3.45Å; V212-F215 PolarHBondContact O-N 3.22Å; F215-Q218 PolarHBondContact O-N 3.08Å; F215-Y219 WeakPolarHBondContact O-CB 3.22Å; F215-Y219 PolarHBondContact O-N 3.08Å |
| 216 | V | 66.4 | Low | 66.9 | Low | 43 Ų | 43 | 71 Ų | 71 | 26% | 0.261 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -72.6 | -39.2 | -179.9 | 175.4 | 0 | 0 | 0 | 0 | 111.2 | E206 V212 Q218 Y219 F220 | E206-V216 WeakPolarHBondContact OE1-CG2 3.17Å; V212-V216 HydrophobicContact CG1-CG2 3.79Å; V212-V216 WeakPolarHBondContact O-CG2 3.29Å; V212-V216 PolarHBondContact O-N 3.41Å; V216-Q218 VanDerWaalsContact C-N 3.3Å; V216-Q218 PolarHBondContact O-N 3.43Å; V216-Y219 PolarHBondContact O-N 3.36Å; V216-F220 WeakPolarHBondContact O-CB 3.3Å; V216-F220 PolarHBondContact O-N 2.77Å |
| 217 | S | 71.7 | Confident | 68.6 | Low | 40 Ų | 40 | 68.1 Ų | 68.1 | 28% | 0.28 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -54.8 | -44.2 | 168.8 | 167.9 | 0 | 0 | 0 | 0 | 112.1 | A213 R221 | A213-S217 WeakPolarHBondContact O-CB 3.33Å; A213-S217 PolarHBondContact O-N 3.05Å; S217-R221 PolarHBondContact O-N 3.39Å; S217-R221 VanDerWaalsContact O-N 3.13Å; S217-R221 PolarHBondContact O-NE 2.95Å; S217-R221 VanDerWaalsContact O-NE 3.16Å; S217-R221 PolarHBondContact OG-NE 3.5Å; S217-R221 PolarHBondContact OG-NH2 3.39Å |
| 218 | Q | 73.2 | Confident | 70.5 | Confident | 61 Ų | 61 | 60.1 Ų | 60.1 | 29% | 0.285 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -67.2 | -49.5 | 177.2 | -169.8 | 61.7 | 58.3 | 0 | 0 | 111.6 | V214 F215 V216 F220 R221 L222 | V214-Q218 PolarHBondContact O-N 3.47Å; V214-Q218 VanDerWaalsContact O-N 3.13Å; F215-Q218 PolarHBondContact O-N 3.08Å; V216-Q218 VanDerWaalsContact C-N 3.3Å; V216-Q218 PolarHBondContact O-N 3.43Å; Q218-F220 VanDerWaalsContact C-N 3.32Å; Q218-F220 PolarHBondContact O-N 2.79Å; Q218-R221 VanDerWaalsContact CA-NH2 3.28Å; Q218-R221 PolarHBondContact O-N 3.27Å; Q218-R221 VanDerWaalsContact OE1-CZ 3.26Å; Q218-L222 WeakPolarHBondContact O-CG 3.45Å; Q218-L222 PolarHBondContact O-N 2.97Å; Q218-L222 VanDerWaalsContact O-N 3.11Å |
| 219 | Y | 74.9 | Confident | 72.1 | Confident | 106 Ų | 106 | 53.1 Ų | 53.1 | 42% | 0.416 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -61 | -39.3 | 179 | -178.5 | -101.5 | 0 | 0 | 0 | 112.7 | F199 F215 V216 L222 T223 | F199-Y219 HydrophobicContact CD1-CE1 4.37Å; F199-Y219 HydrophobicContact CD2-CE1 4.16Å; F199-Y219 HydrophobicContact CE2-CE1 4.42Å; F199-Y219 HydrophobicContact CG-CE1 4.14Å; F215-Y219 WeakPolarHBondContact O-CB 3.22Å; F215-Y219 PolarHBondContact O-N 3.08Å; V216-Y219 PolarHBondContact O-N 3.36Å; Y219-L222 PolarHBondContact O-N 2.88Å; Y219-T223 WeakPolarHBondContact O-CB 3.48Å; Y219-T223 PolarHBondContact O-N 3.28Å; Y219-T223 PolarHBondContact O-OG1 2.91Å |
| 220 | F | 78.4 | Confident | 73.5 | Confident | 54 Ų | 54 | 51 Ų | 51 | 24% | 0.237 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -65.3 | -44.8 | 177.9 | -179.1 | -105.1 | 0 | 0 | 0 | 112.2 | L200 V216 Q218 T223 L224 | L200-F220 HydrophobicContact CD2-CE2 4.2Å; V216-F220 WeakPolarHBondContact O-CB 3.3Å; V216-F220 PolarHBondContact O-N 2.77Å; Q218-F220 VanDerWaalsContact C-N 3.32Å; Q218-F220 PolarHBondContact O-N 2.79Å; F220-T223 WeakPolarHBondContact O-CB 3.27Å; F220-T223 PolarHBondContact O-N 3.4Å; F220-L224 HydrophobicContact CD1-CD1 3.94Å; F220-L224 HydrophobicContact CE1-CD1 3.51Å; F220-L224 HydrophobicContact CE1-CG 4.31Å; F220-L224 HydrophobicContact CZ-CD1 3.92Å; F220-L224 HydrophobicContact CZ-CG 4.37Å; F220-L224 WeakPolarHBondContact O-CG 3.29Å; F220-L224 PolarHBondContact O-N 3.46Å |
| 221 | R | 78.8 | Confident | 74.5 | Confident | 13 Ų | 13 | 44 Ų | 44 | 5% | 0.049 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -60.6 | -46 | 174.3 | -80 | 177.9 | -74.5 | 122.5 | -3 | 112.3 | S217 Q218 T223 L224 M225 D259 T262 | S217-R221 PolarHBondContact O-N 3.39Å; S217-R221 VanDerWaalsContact O-N 3.13Å; S217-R221 PolarHBondContact O-NE 2.95Å; S217-R221 VanDerWaalsContact O-NE 3.16Å; S217-R221 PolarHBondContact OG-NE 3.5Å; S217-R221 PolarHBondContact OG-NH2 3.39Å; Q218-R221 VanDerWaalsContact CA-NH2 3.28Å; Q218-R221 PolarHBondContact O-N 3.27Å; Q218-R221 VanDerWaalsContact OE1-CZ 3.26Å; R221-T223 VanDerWaalsContact C-N 3.32Å; R221-T223 PolarHBondContact O-N 2.9Å; R221-L224 PolarHBondContact O-N 3.21Å; R221-M225 PolarHBondContact O-N 2.87Å; R221-D259 IonicContact CZ-OD1 3.78Å; R221-D259 IonicContact NH1-OD1 2.73Å; R221-D259 PolarHBondContact NH1-OD1 3.36Å; R221-T262 VanDerWaalsContact CZ-CB 3.48Å; R221-T262 VanDerWaalsContact NH2-CG2 3.27Å |
| 222 | L | 83 | Confident | 76 | Confident | 36 Ų | 36 | 37.8 Ų | 37.8 | 19% | 0.188 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -63.3 | -40.3 | 176.4 | -61.9 | -173.8 | 0 | 0 | 0 | 111.7 | F181 Q218 Y219 M225 L226 | F181-L222 HydrophobicContact CD1-CD2 4.32Å; F181-L222 HydrophobicContact CD2-CD2 3.51Å; F181-L222 HydrophobicContact CE1-CD1 4.12Å; F181-L222 HydrophobicContact CE1-CD2 4.18Å; F181-L222 HydrophobicContact CE1-CG 4.48Å; F181-L222 HydrophobicContact CE2-CD1 4.27Å; F181-L222 HydrophobicContact CE2-CD2 3.36Å; F181-L222 HydrophobicContact CE2-CG 4.37Å; F181-L222 HydrophobicContact CG-CD2 4.03Å; F181-L222 HydrophobicContact CZ-CD1 3.79Å; F181-L222 HydrophobicContact CZ-CD2 3.73Å; F181-L222 HydrophobicContact CZ-CG 4.27Å; Q218-L222 WeakPolarHBondContact O-CG 3.45Å; Q218-L222 PolarHBondContact O-N 2.97Å; Q218-L222 VanDerWaalsContact O-N 3.11Å; Y219-L222 PolarHBondContact O-N 2.88Å; L222-M225 HydrophobicContact CD2-SD 4.44Å; L222-M225 PolarHBondContact O-N 2.96Å; L222-L226 VanDerWaalsContact O-CG 3.3Å; L222-L226 WeakPolarHBondContact O-CG 3.39Å; L222-L226 PolarHBondContact O-N 2.66Å |
| 223 | T | 82.2 | Confident | 77.2 | Confident | 13 Ų | 13 | 37.2 Ų | 37.2 | 8% | 0.08 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -60.6 | -43.9 | 174.3 | -68.4 | 0 | 0 | 0 | 0 | 111.9 | N196 Y219 F220 R221 L226 I227 | N196-T223 HydrophobicContact CB-CG2 3.9Å; N196-T223 WeakPolarHBondContact ND2-CG2 3.14Å; Y219-T223 WeakPolarHBondContact O-CB 3.48Å; Y219-T223 PolarHBondContact O-N 3.28Å; Y219-T223 PolarHBondContact O-OG1 2.91Å; F220-T223 WeakPolarHBondContact O-CB 3.27Å; F220-T223 PolarHBondContact O-N 3.4Å; R221-T223 VanDerWaalsContact C-N 3.32Å; R221-T223 PolarHBondContact O-N 2.9Å; T223-L226 PolarHBondContact O-N 3.22Å; T223-I227 HydrophobicContact CG2-CD1 3.71Å; T223-I227 HydrophobicContact CG2-CG1 4.49Å; T223-I227 WeakPolarHBondContact O-CB 3.37Å; T223-I227 VanDerWaalsContact O-CG1 3.27Å; T223-I227 WeakPolarHBondContact O-CG1 3.13Å; T223-I227 PolarHBondContact O-N 3.01Å |
| 224 | L | 82.7 | Confident | 77.8 | Confident | 17 Ų | 17 | 35.5 Ų | 35.5 | 9% | 0.089 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -63.5 | -39.7 | 174.9 | -76.3 | 176 | 0 | 0 | 0 | 112.5 | F220 R221 I227 V228 V255 | F220-L224 HydrophobicContact CD1-CD1 3.94Å; F220-L224 HydrophobicContact CE1-CD1 3.51Å; F220-L224 HydrophobicContact CE1-CG 4.31Å; F220-L224 HydrophobicContact CZ-CD1 3.92Å; F220-L224 HydrophobicContact CZ-CG 4.37Å; F220-L224 WeakPolarHBondContact O-CG 3.29Å; F220-L224 PolarHBondContact O-N 3.46Å; R221-L224 PolarHBondContact O-N 3.21Å; L224-I227 PolarHBondContact O-N 3.15Å; L224-V228 WeakPolarHBondContact O-CB 3.48Å; L224-V228 WeakPolarHBondContact O-CG2 3.41Å; L224-V228 PolarHBondContact O-N 2.88Å; L224-V255 HydrophobicContact CB-CG1 3.98Å; L224-V255 HydrophobicContact CB-CG2 4.2Å |
| 225 | M | 83.4 | Confident | 78.1 | Confident | 2 Ų | 2 | 40.2 Ų | 40.2 | 1% | 0.01 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -61.7 | -46.7 | 174.4 | -71 | -175.4 | -179.5 | 0 | 0 | 112 | F178 F181 R221 L222 I227 V228 G229 V255 D259 | F178-M225 HydrophobicContact CB-CE 4.15Å; F178-M225 HydrophobicContact CD2-CE 4.33Å; F181-M225 HydrophobicContact CB-CB 3.65Å; F181-M225 HydrophobicContact CB-CG 4.33Å; F181-M225 HydrophobicContact CB-SD 3.65Å; F181-M225 HydrophobicContact CD2-SD 4.04Å; F181-M225 HydrophobicContact CG-SD 4.19Å; R221-M225 PolarHBondContact O-N 2.87Å; L222-M225 HydrophobicContact CD2-SD 4.44Å; L222-M225 PolarHBondContact O-N 2.96Å; M225-I227 PolarHBondContact O-N 3.32Å; M225-V228 PolarHBondContact O-N 3.02Å; M225-G229 PolarHBondContact O-N 2.97Å; M225-V255 HydrophobicContact CB-CG1 4.41Å; M225-V255 HydrophobicContact CG-CG1 3.66Å; M225-D259 HydrophobicContact CE-CB 3.26Å; M225-D259 WeakPolarHBondContact CE-OD2 3.26Å |
| 226 | L | 84.5 | Confident | 78.1 | Confident | 32 Ų | 32 | 35.1 Ų | 35.1 | 17% | 0.168 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -62.9 | -43 | 179.1 | -66.3 | 163.8 | 0 | 0 | 0 | 111.1 | F181 L184 G185 I188 L192 L222 T223 Q230 | F181-L226 HydrophobicContact CD1-CD2 4.19Å; F181-L226 HydrophobicContact CD1-CG 4.32Å; F181-L226 WeakPolarHBondContact O-CD2 3.4Å; L184-L226 HydrophobicContact CB-CD2 3.75Å; G185-L226 VanDerWaalsContact CA-O 3.3Å; G185-L226 WeakPolarHBondContact CA-O 3.23Å; I188-L226 HydrophobicContact CD1-CD2 4.02Å; L192-L226 HydrophobicContact CD1-CB 3.64Å; L222-L226 VanDerWaalsContact O-CG 3.3Å; L222-L226 WeakPolarHBondContact O-CG 3.39Å; L222-L226 PolarHBondContact O-N 2.66Å; T223-L226 PolarHBondContact O-N 3.22Å; L226-Q230 WeakPolarHBondContact O-CB 3.32Å; L226-Q230 PolarHBondContact O-N 2.68Å |
| 227 | I | 83.4 | Confident | 77.7 | Confident | 14 Ų | 14 | 36.6 Ų | 36.6 | 7% | 0.072 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -62.7 | -48.9 | 175.5 | -74.2 | 168.9 | 0 | 0 | 0 | 111.3 | L192 L193 N196 T223 L224 M225 Q230 A231 | L192-I227 HydrophobicContact CB-CG1 4.03Å; L193-I227 HydrophobicContact CD1-CD1 4.43Å; L193-I227 HydrophobicContact CD1-CG2 3.78Å; N196-I227 HydrophobicContact CB-CD1 4.47Å; T223-I227 HydrophobicContact CG2-CD1 3.71Å; T223-I227 HydrophobicContact CG2-CG1 4.49Å; T223-I227 WeakPolarHBondContact O-CB 3.37Å; T223-I227 VanDerWaalsContact O-CG1 3.27Å; T223-I227 WeakPolarHBondContact O-CG1 3.13Å; T223-I227 PolarHBondContact O-N 3.01Å; L224-I227 PolarHBondContact O-N 3.15Å; M225-I227 PolarHBondContact O-N 3.32Å; I227-Q230 PolarHBondContact O-N 3.1Å; I227-A231 VanDerWaalsContact O-CB 3.25Å; I227-A231 WeakPolarHBondContact O-CB 3.4Å; I227-A231 PolarHBondContact O-N 3.3Å |
| 228 | V | 84.5 | Confident | 77.1 | Confident | 2 Ų | 2 | 37 Ų | 37 | 1% | 0.012 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -69.8 | -35.9 | -178.6 | 171.9 | 0 | 0 | 0 | 0 | 111.6 | M38 L224 M225 A231 T232 L251 L252 V255 | M38-V228 HydrophobicContact CE-CG2 4.18Å; L224-V228 WeakPolarHBondContact O-CB 3.48Å; L224-V228 WeakPolarHBondContact O-CG2 3.41Å; L224-V228 PolarHBondContact O-N 2.88Å; M225-V228 PolarHBondContact O-N 3.02Å; V228-A231 PolarHBondContact O-N 3.4Å; V228-T232 HydrophobicContact CG1-CG2 4.09Å; V228-T232 WeakPolarHBondContact O-CB 3.29Å; V228-T232 WeakPolarHBondContact O-CG2 3.4Å; V228-T232 PolarHBondContact O-N 3.04Å; V228-T232 PolarHBondContact O-OG1 3.05Å; V228-L251 HydrophobicContact CG1-CB 3.95Å; V228-L252 HydrophobicContact CG1-CD2 3.77Å; V228-L252 HydrophobicContact CG1-CG 3.88Å; V228-V255 HydrophobicContact CB-CG2 4.46Å; V228-V255 HydrophobicContact CG2-CG2 3.78Å |
| 229 | G | 81.9 | Confident | 76.8 | Confident | 0 Ų | 0 | 34.6 Ų | 34.6 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -58.8 | -46.2 | 170.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | M225 F233 G234 | M225-G229 PolarHBondContact O-N 2.97Å; G229-F233 PolarHBondContact O-N 3.45Å; G229-G234 PolarHBondContact O-N 3.06Å |
| 230 | Q | 81.6 | Confident | 76.3 | Confident | 11 Ų | 11 | 29.7 Ų | 29.7 | 5% | 0.051 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -63 | -44.3 | 173.7 | -174.3 | 167.7 | 62.3 | 0 | 0 | 112.1 | I188 I190 L226 I227 T232 G234 F238 | I188-Q230 PolarHBondContact O-NE2 3.28Å; I190-Q230 PolarHBondContact O-NE2 3.22Å; I190-Q230 PolarHBondContact O-OE1 2.9Å; L226-Q230 WeakPolarHBondContact O-CB 3.32Å; L226-Q230 PolarHBondContact O-N 2.68Å; I227-Q230 PolarHBondContact O-N 3.1Å; Q230-T232 VanDerWaalsContact C-N 3.29Å; Q230-T232 PolarHBondContact O-N 3.43Å; Q230-G234 VanDerWaalsContact O-CA 3.24Å; Q230-G234 WeakPolarHBondContact O-CA 3.4Å; Q230-G234 PolarHBondContact O-N 3.09Å; Q230-F238 HydrophobicContact CG-CB 4.21Å |
| 231 | A | 80 | Confident | 75.5 | Confident | 2 Ų | 2 | 27.2 Ų | 27.2 | 2% | 0.017 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -69.3 | -20.1 | -177.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | I227 V228 R239 I240 A241 | I227-A231 VanDerWaalsContact O-CB 3.25Å; I227-A231 WeakPolarHBondContact O-CB 3.4Å; I227-A231 PolarHBondContact O-N 3.3Å; V228-A231 PolarHBondContact O-N 3.4Å; A231-R239 CarbonylContact O-C 3.57Å; A231-R239 VanDerWaalsContact O-CA 3.31Å; A231-R239 WeakPolarHBondContact O-CA 3.39Å; A231-I240 HydrophobicContact CB-CB 4.02Å; A231-I240 HydrophobicContact CB-CD1 3.48Å; A231-I240 VanDerWaalsContact CB-CD1 3.48Å; A231-I240 HydrophobicContact CB-CG1 3.69Å; A231-I240 PolarHBondContact O-N 2.87Å; A231-A241 PolarHBondContact O-N 3.24Å |
| 232 | T | 83.2 | Confident | 75.1 | Confident | 0 Ų | 0 | 27.4 Ų | 27.4 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -111.5 | -39.3 | -175.4 | 56.1 | 0 | 0 | 0 | 0 | 113.6 | Y61 V228 Q230 A241 A248 L252 | Y61-T232 WeakPolarHBondContact CE1-O 3.4Å; Y61-T232 PolarHBondContact OH-O 2.88Å; V228-T232 HydrophobicContact CG1-CG2 4.09Å; V228-T232 WeakPolarHBondContact O-CB 3.29Å; V228-T232 WeakPolarHBondContact O-CG2 3.4Å; V228-T232 PolarHBondContact O-N 3.04Å; V228-T232 PolarHBondContact O-OG1 3.05Å; Q230-T232 VanDerWaalsContact C-N 3.29Å; Q230-T232 PolarHBondContact O-N 3.43Å; T232-A241 HydrophobicContact CG2-CB 4.33Å; T232-A248 HydrophobicContact CG2-CB 3.67Å; T232-L252 HydrophobicContact CG2-CD1 4.14Å; T232-L252 HydrophobicContact CG2-CG 4.11Å |
| 233 | F | 81.9 | Confident | 74.7 | Confident | 55 Ų | 55 | 30 Ų | 30 | 24% | 0.241 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -116.7 | -8.4 | -177 | -60.9 | -67.7 | 0 | 0 | 0 | 114.4 | V65 L66 T182 A186 G229 L252 | V65-F233 HydrophobicContact CG1-CE1 4.18Å; V65-F233 HydrophobicContact CG1-CZ 3.87Å; L66-F233 HydrophobicContact CD2-CE1 4.23Å; L66-F233 HydrophobicContact CD2-CZ 3.71Å; L66-F233 HydrophobicContact CG-CE1 4.39Å; L66-F233 HydrophobicContact CG-CZ 4.33Å; T182-F233 HydrophobicContact CG2-CD2 3.82Å; T182-F233 HydrophobicContact CG2-CE2 3.82Å; A186-F233 HydrophobicContact CB-CB 3.78Å; G229-F233 PolarHBondContact O-N 3.45Å; F233-L252 HydrophobicContact CD2-CD1 4.47Å; F233-L252 HydrophobicContact CE2-CD1 3.49Å; F233-L252 VanDerWaalsContact CE2-CD1 3.49Å; F233-L252 HydrophobicContact CE2-CD2 3.93Å; F233-L252 HydrophobicContact CE2-CG 4.38Å; F233-L252 HydrophobicContact CZ-CD1 3.71Å |
| 234 | G | 73.7 | Confident | 74.8 | Confident | 9 Ų | 9 | 30.1 Ų | 30.1 | 9% | 0.093 | 15% | 0.147 | C | C | . | . | S | Bend | trans | -67.5 | -174.7 | 178.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | G229 Q230 R239 | G229-G234 PolarHBondContact O-N 3.06Å; Q230-G234 VanDerWaalsContact O-CA 3.24Å; Q230-G234 WeakPolarHBondContact O-CA 3.4Å; Q230-G234 PolarHBondContact O-N 3.09Å; G234-R239 WeakPolarHBondContact O-CD 3.29Å; G234-R239 WeakPolarHBondContact O-CG 3.48Å |
| 235 | R | 67 | Low | 75.1 | Confident | 179 Ų | 179 | 31.8 Ų | 31.8 | 68% | 0.675 | 15% | 0.152 | S | C | * | . | trans | -59.6 | 150.2 | 178.1 | -156 | 172.5 | -173.5 | 150.2 | 4.8 | 110.9 | D237 F238 R239 | R235-D237 VanDerWaalsContact CD-OD2 3.24Å; R235-D237 WeakPolarHBondContact CD-OD2 3.27Å; R235-D237 WeakPolarHBondContact CG-OD2 3.38Å; R235-D237 IonicContact NE-OD2 2.68Å; R235-D237 PolarHBondContact O-N 3.32Å; R235-D237 VanDerWaalsContact O-N 3.13Å; R235-F238 HydrophobicContact CB-CD2 3.9Å; R235-F238 HydrophobicContact CB-CE2 4.2Å; R235-F238 PolarHBondContact O-N 3.4Å; R235-R239 PolarHBondContact O-N 2.89Å | ||
| 236 | H | 63.2 | Low | 75.4 | Confident | 48 Ų | 48 | 31.8 Ų | 31.8 | 22% | 0.222 | 15% | 0.152 | C | C | . | . | G | 310 helix | trans | -47.8 | -45.5 | -175.6 | -174.6 | -88.9 | 0 | 0 | 0 | 112.5 | K52 F238 R239 | K52-H236 PolarHBondContact O-CE1 3.42Å; K52-H236 VanDerWaalsContact O-CE1 3.32Å; H236-F238 PolarHBondContact O-N 3.19Å; H236-R239 PolarHBondContact O-N 3.04Å; H236-R239 VanDerWaalsContact O-N 3.11Å |
| 237 | D | 59.1 | Low | 75.6 | Confident | 75 Ų | 75 | 30.3 Ų | 30.3 | 40% | 0.401 | 14% | 0.144 | S | C | . | . | G | 310 helix | trans | -63.7 | -5.1 | -179.4 | -15.7 | -49.1 | 0 | 0 | 0 | 114.9 | R191 R235 | R191-D237 PolarHBondContact NH2-O 2.94Å; R235-D237 VanDerWaalsContact CD-OD2 3.24Å; R235-D237 WeakPolarHBondContact CD-OD2 3.27Å; R235-D237 WeakPolarHBondContact CG-OD2 3.38Å; R235-D237 IonicContact NE-OD2 2.68Å; R235-D237 PolarHBondContact O-N 3.32Å; R235-D237 VanDerWaalsContact O-N 3.13Å |
| 238 | F | 58.6 | Low | 76 | Confident | 48 Ų | 48 | 29.6 Ų | 29.6 | 21% | 0.211 | 14% | 0.141 | C | C | . | . | G | 310 helix | trans | -126.6 | -5.1 | 179.2 | -50 | -39.6 | 0 | 0 | 0 | 113.6 | R191 Q230 R235 H236 I240 | R191-F238 HydrophobicContact CG-CD1 3.56Å; R191-F238 HydrophobicContact CG-CE1 3.48Å; R191-F238 VanDerWaalsContact CG-CE1 3.48Å; R191-F238 HydrophobicContact CG-CG 4.43Å; R191-F238 HydrophobicContact CG-CZ 4.28Å; R191-F238 VanDerWaalsContact NE-CD1 3.26Å; R191-F238 VanDerWaalsContact NE-CE1 3.3Å; Q230-F238 HydrophobicContact CG-CB 4.21Å; R235-F238 HydrophobicContact CB-CD2 3.9Å; R235-F238 HydrophobicContact CB-CE2 4.2Å; R235-F238 PolarHBondContact O-N 3.4Å; H236-F238 PolarHBondContact O-N 3.19Å; F238-I240 PolarHBondContact O-N 3.3Å |
| 239 | R | 66.6 | Low | 76.4 | Confident | 10 Ų | 10 | 29.5 Ų | 29.5 | 4% | 0.038 | 14% | 0.14 | C | C | . | . | trans | -81.1 | 87.5 | -174.2 | -92 | 175.4 | 54.3 | -159.5 | -7.1 | 112.2 | Y61 A231 G234 R235 H236 A241 G242 | Y61-R239 VanDerWaalsContact CE1-NH2 3.31Å; A231-R239 CarbonylContact O-C 3.57Å; A231-R239 VanDerWaalsContact O-CA 3.31Å; A231-R239 WeakPolarHBondContact O-CA 3.39Å; G234-R239 WeakPolarHBondContact O-CD 3.29Å; G234-R239 WeakPolarHBondContact O-CG 3.48Å; R235-R239 PolarHBondContact O-N 2.89Å; H236-R239 PolarHBondContact O-N 3.04Å; H236-R239 VanDerWaalsContact O-N 3.11Å; R239-A241 PolarHBondContact O-N 3.3Å; R239-A241 VanDerWaalsContact O-N 3.14Å; R239-G242 PolarHBondContact NH2-O 2.74Å; R239-G242 PolarHBondContact O-N 3.17Å | ||
| 240 | I | 63.8 | Low | 76.9 | Confident | 4 Ų | 4 | 29.5 Ų | 29.5 | 2% | 0.021 | 14% | 0.14 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -51.7 | -34.5 | 173.2 | -44.3 | 171.6 | 0 | 0 | 0 | 111.8 | M38 T41 E42 I45 A231 F238 G242 | M38-I240 HydrophobicContact CE-CD1 4Å; T41-I240 HydrophobicContact CG2-CG2 4.24Å; E42-I240 HydrophobicContact CB-CD1 4.02Å; E42-I240 HydrophobicContact CB-CG1 4.31Å; E42-I240 HydrophobicContact CB-CG2 4.23Å; E42-I240 HydrophobicContact CG-CD1 4.12Å; E42-I240 HydrophobicContact CG-CG1 4.05Å; E42-I240 WeakPolarHBondContact OE2-CD1 2.94Å; I45-I240 HydrophobicContact CD1-CG2 4.27Å; I45-I240 VanDerWaalsContact CD1-O 3.29Å; I45-I240 WeakPolarHBondContact CD1-O 3.46Å; A231-I240 HydrophobicContact CB-CB 4.02Å; A231-I240 HydrophobicContact CB-CD1 3.48Å; A231-I240 VanDerWaalsContact CB-CD1 3.48Å; A231-I240 HydrophobicContact CB-CG1 3.69Å; A231-I240 PolarHBondContact O-N 2.87Å; F238-I240 PolarHBondContact O-N 3.3Å; I240-G242 PolarHBondContact O-N 3.12Å |
| 241 | A | 62.5 | Low | 77.4 | Confident | 2 Ų | 2 | 29 Ų | 29 | 2% | 0.017 | 14% | 0.138 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -69.1 | -19 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | A231 T232 R239 D243 D244 A248 | A231-A241 PolarHBondContact O-N 3.24Å; T232-A241 HydrophobicContact CG2-CB 4.33Å; R239-A241 PolarHBondContact O-N 3.3Å; R239-A241 VanDerWaalsContact O-N 3.14Å; A241-D243 PolarHBondContact O-N 3.13Å; A241-D244 WeakPolarHBondContact O-CB 3.21Å; A241-D244 PolarHBondContact O-N 2.87Å; A241-A248 HydrophobicContact CB-CB 3.82Å |
| 242 | G | 70.6 | Confident | 78 | Confident | 17 Ų | 17 | 29 Ų | 29 | 18% | 0.175 | 14% | 0.137 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 50.8 | -132.9 | -171.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | Y61 R239 I240 | Y61-G242 VanDerWaalsContact CE2-O 3.31Å; Y61-G242 WeakPolarHBondContact CE2-O 3.02Å; R239-G242 PolarHBondContact NH2-O 2.74Å; R239-G242 PolarHBondContact O-N 3.17Å; I240-G242 PolarHBondContact O-N 3.12Å |
| 243 | D | 74 | Confident | 78.6 | Confident | 89 Ų | 89 | 29 Ų | 29 | 48% | 0.476 | 14% | 0.137 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -88.2 | -0.8 | 176.2 | -50.3 | -54.8 | 0 | 0 | 0 | 113.3 | K52 A241 Y245 | K52-D243 IonicContact NZ-OD2 3.64Å; K52-D243 PolarHBondContact NZ-OD2 3.34Å; A241-D243 PolarHBondContact O-N 3.13Å; D243-Y245 VanDerWaalsContact C-N 3.34Å; D243-Y245 PolarHBondContact O-N 3.02Å |
| 244 | D | 84.5 | Confident | 79.1 | Confident | 17 Ų | 17 | 26.3 Ų | 26.3 | 9% | 0.091 | 13% | 0.126 | C | C | . | . | trans | -76.6 | 79 | -177.7 | -73.3 | -24.2 | 0 | 0 | 0 | 110.9 | R134 R135 A241 C246 L247 A248 | R134-D244 IonicContact NE-OD2 3.24Å; R134-D244 IonicContact NH2-OD2 3.95Å; R134-D244 PolarHBondContact NH2-OD2 3.04Å; R135-D244 WeakPolarHBondContact CG-OD1 3.27Å; R135-D244 IonicContact CZ-OD1 3.02Å; R135-D244 VanDerWaalsContact CZ-OD1 3.24Å; R135-D244 IonicContact CZ-OD2 2.96Å; R135-D244 IonicContact NE-OD1 3.59Å; R135-D244 PolarHBondContact NE-OD1 2.84Å; R135-D244 IonicContact NE-OD2 3.39Å; R135-D244 PolarHBondContact NE-OD2 2.62Å; R135-D244 VanDerWaalsContact NH2-CG 3.29Å; R135-D244 IonicContact NH2-OD1 2.71Å; R135-D244 PolarHBondContact NH2-OD1 3.03Å; R135-D244 IonicContact NH2-OD2 3.41Å; R135-D244 PolarHBondContact NH2-OD2 3.03Å; A241-D244 WeakPolarHBondContact O-CB 3.21Å; A241-D244 PolarHBondContact O-N 2.87Å; D244-C246 PolarHBondContact O-N 3.26Å; D244-C246 VanDerWaalsContact O-N 3.1Å; D244-L247 HydrophobicContact CB-CB 3.79Å; D244-L247 WeakPolarHBondContact O-CA 3.49Å; D244-L247 WeakPolarHBondContact O-CB 3.33Å; D244-L247 PolarHBondContact O-N 3.3Å; D244-A248 PolarHBondContact O-N 3.05Å; D244-A248 VanDerWaalsContact O-N 3.07Å | ||
| 245 | Y | 89 | Confident | 80 | Confident | 51 Ų | 51 | 26.2 Ų | 26.2 | 20% | 0.2 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -51.4 | -35.3 | 177.7 | 62.6 | -95.2 | 0 | 0 | 0 | 113.3 | Q64 L68 N140 D243 L247 A248 S249 | Q64-Y245 HydrophobicContact CB-CD2 4.27Å; Q64-Y245 HydrophobicContact CB-CG 4.11Å; L68-Y245 HydrophobicContact CD1-CD2 3.61Å; L68-Y245 HydrophobicContact CD1-CE2 3.96Å; N140-Y245 PolarHBondContact ND2-OH 2.68Å; N140-Y245 VanDerWaalsContact ND2-OH 3.08Å; D243-Y245 VanDerWaalsContact C-N 3.34Å; D243-Y245 PolarHBondContact O-N 3.02Å; Y245-L247 VanDerWaalsContact C-N 3.34Å; Y245-L247 PolarHBondContact O-N 3.23Å; Y245-A248 PolarHBondContact O-N 3.2Å; Y245-S249 WeakPolarHBondContact O-CB 3.48Å; Y245-S249 PolarHBondContact O-N 3.38Å |
| 246 | C | 89.6 | Confident | 81.2 | Confident | 2 Ų | 2 | 17.7 Ų | 17.7 | 1% | 0.014 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -65.8 | -34 | 175.9 | -178.7 | 0 | 0 | 0 | 0 | 112.5 | N140 D244 L250 | N140-C246 HydrophobicContact CB-CB 4.47Å; D244-C246 PolarHBondContact O-N 3.26Å; D244-C246 VanDerWaalsContact O-N 3.1Å; C246-L250 VanDerWaalsContact O-CB 3.28Å; C246-L250 WeakPolarHBondContact O-CB 3.4Å; C246-L250 PolarHBondContact O-N 3.46Å |
| 247 | L | 89.8 | Confident | 82.6 | Confident | 1 Ų | 1 | 15.4 Ų | 15.4 | 1% | 0.005 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -71.3 | -47.4 | 173.5 | 178.9 | 60.1 | 0 | 0 | 0 | 110 | L128 D244 Y245 S249 L250 L251 | L128-L247 HydrophobicContact CD2-CD1 3.55Å; D244-L247 HydrophobicContact CB-CB 3.79Å; D244-L247 WeakPolarHBondContact O-CA 3.49Å; D244-L247 WeakPolarHBondContact O-CB 3.33Å; D244-L247 PolarHBondContact O-N 3.3Å; Y245-L247 VanDerWaalsContact C-N 3.34Å; Y245-L247 PolarHBondContact O-N 3.23Å; L247-S249 PolarHBondContact O-N 3.18Å; L247-L250 WeakPolarHBondContact O-CB 3.38Å; L247-L250 PolarHBondContact O-N 3.4Å; L247-L251 HydrophobicContact CD1-CD1 4.02Å; L247-L251 HydrophobicContact CD1-CD2 4.21Å; L247-L251 HydrophobicContact CD1-CG 3.95Å; L247-L251 HydrophobicContact CG-CD1 3.96Å; L247-L251 HydrophobicContact CG-CG 4.29Å; L247-L251 VanDerWaalsContact O-CG 3.28Å; L247-L251 WeakPolarHBondContact O-CG 3.33Å; L247-L251 PolarHBondContact O-N 3.18Å |
| 248 | A | 90.7 | Very high | 84.1 | Confident | 0 Ų | 0 | 12.7 Ų | 12.7 | 0% | 0 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -56.9 | -47 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y61 V65 T232 A241 D244 Y245 L250 L251 L252 | Y61-A248 HydrophobicContact CE2-CB 4.39Å; Y61-A248 WeakPolarHBondContact OH-CB 3.38Å; V65-A248 HydrophobicContact CG1-CB 3.98Å; V65-A248 HydrophobicContact CG2-CB 3.65Å; T232-A248 HydrophobicContact CG2-CB 3.67Å; A241-A248 HydrophobicContact CB-CB 3.82Å; D244-A248 PolarHBondContact O-N 3.05Å; D244-A248 VanDerWaalsContact O-N 3.07Å; Y245-A248 PolarHBondContact O-N 3.2Å; A248-L250 PolarHBondContact O-N 3.06Å; A248-L251 PolarHBondContact O-N 3.46Å; A248-L252 WeakPolarHBondContact O-CB 3.17Å; A248-L252 WeakPolarHBondContact O-CD1 3.42Å; A248-L252 WeakPolarHBondContact O-CG 3.33Å; A248-L252 PolarHBondContact O-N 2.99Å |
| 249 | S | 93.2 | Very high | 85.6 | Confident | 0 Ų | 0 | 10.4 Ų | 10.4 | 0% | 0 | 6% | 0.056 | C | C | . | . | H | α-helix | trans | -62.5 | -42.5 | 177.4 | -152.5 | 0 | 0 | 0 | 0 | 112.2 | L68 L69 Q72 Y245 L247 Y253 | L68-S249 VanDerWaalsContact CB-OG 3.24Å; L68-S249 WeakPolarHBondContact CB-OG 3.4Å; L69-S249 PolarHBondContact N-OG 3.24Å; L69-S249 VanDerWaalsContact N-OG 3.14Å; Q72-S249 PolarHBondContact OE1-O 3.28Å; Q72-S249 PolarHBondContact OE1-OG 3.42Å; Y245-S249 WeakPolarHBondContact O-CB 3.48Å; Y245-S249 PolarHBondContact O-N 3.38Å; L247-S249 PolarHBondContact O-N 3.18Å; S249-Y253 WeakPolarHBondContact O-CB 3.13Å; S249-Y253 PolarHBondContact O-N 3.14Å |
| 250 | L | 93.2 | Very high | 86.7 | Confident | 0 Ų | 0 | 10 Ų | 10 | 0% | 0 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -57.3 | -50.8 | 175.2 | -179.5 | 67.2 | 0 | 0 | 0 | 111.5 | L124 L127 L128 L144 Y147 C246 L247 A248 Y253 T254 | L124-L250 HydrophobicContact CD1-CD1 3.94Å; L124-L250 HydrophobicContact CD1-CD2 4.22Å; L124-L250 HydrophobicContact CD1-CG 4.13Å; L127-L250 HydrophobicContact CB-CD2 3.73Å; L127-L250 HydrophobicContact CD1-CD1 4.07Å; L127-L250 HydrophobicContact CD1-CD2 4.25Å; L128-L250 HydrophobicContact CD2-CD2 3.85Å; L128-L250 HydrophobicContact CG-CD2 4.04Å; L144-L250 HydrophobicContact CD1-CB 3.88Å; L144-L250 HydrophobicContact CD1-CD1 3.89Å; Y147-L250 HydrophobicContact CD1-CD1 3.29Å; Y147-L250 HydrophobicContact CE1-CD1 3.36Å; Y147-L250 HydrophobicContact CG-CD1 4.11Å; C246-L250 VanDerWaalsContact O-CB 3.28Å; C246-L250 WeakPolarHBondContact O-CB 3.4Å; C246-L250 PolarHBondContact O-N 3.46Å; L247-L250 WeakPolarHBondContact O-CB 3.38Å; L247-L250 PolarHBondContact O-N 3.4Å; A248-L250 PolarHBondContact O-N 3.06Å; L250-Y253 PolarHBondContact O-N 3.37Å; L250-T254 WeakPolarHBondContact O-CB 3.43Å; L250-T254 PolarHBondContact O-N 2.89Å; L250-T254 PolarHBondContact O-OG1 2.85Å |
| 251 | L | 91.5 | Very high | 88 | Confident | 1 Ų | 1 | 9.8 Ų | 9.8 | 1% | 0.005 | 5% | 0.053 | C | C | . | . | H | α-helix | trans | -65.2 | -44.4 | -177.4 | -63.1 | 177.2 | 0 | 0 | 0 | 112.6 | F34 M38 L128 V228 L247 A248 T254 V255 | F34-L251 HydrophobicContact CE2-CD2 3.58Å; F34-L251 HydrophobicContact CZ-CD2 3.54Å; M38-L251 HydrophobicContact CE-CD1 3.98Å; M38-L251 HydrophobicContact CG-CD2 4.14Å; M38-L251 HydrophobicContact SD-CD1 3.54Å; M38-L251 VanDerWaalsContact SD-CD1 3.54Å; M38-L251 HydrophobicContact SD-CD2 3.37Å; M38-L251 WeakPolarHBondContact SD-CD2 3.19Å; M38-L251 HydrophobicContact SD-CG 4.04Å; L128-L251 HydrophobicContact CD2-CD2 3.83Å; V228-L251 HydrophobicContact CG1-CB 3.95Å; L247-L251 HydrophobicContact CD1-CD1 4.02Å; L247-L251 HydrophobicContact CD1-CD2 4.21Å; L247-L251 HydrophobicContact CD1-CG 3.95Å; L247-L251 HydrophobicContact CG-CD1 3.96Å; L247-L251 HydrophobicContact CG-CG 4.29Å; L247-L251 VanDerWaalsContact O-CG 3.28Å; L247-L251 WeakPolarHBondContact O-CG 3.33Å; L247-L251 PolarHBondContact O-N 3.18Å; A248-L251 PolarHBondContact O-N 3.46Å; L251-T254 PolarHBondContact O-N 3.22Å; L251-V255 PolarHBondContact O-N 3.36Å; L251-V255 VanDerWaalsContact O-N 3.16Å |
| 252 | L | 93 | Very high | 89.1 | Confident | 0 Ų | 0 | 10.1 Ų | 10.1 | 0% | 0 | 6% | 0.055 | C | C | . | . | H | α-helix | trans | -61 | -48.1 | 176.8 | -77.6 | 162.1 | 0 | 0 | 0 | 111.2 | V65 L69 F178 T182 V228 T232 F233 A248 M256 | V65-L252 HydrophobicContact CG1-CD1 3.55Å; L69-L252 HydrophobicContact CD1-CB 4.02Å; L69-L252 HydrophobicContact CD2-CB 3.84Å; L69-L252 HydrophobicContact CD2-CD1 4.09Å; L69-L252 HydrophobicContact CD2-CG 4.43Å; F178-L252 HydrophobicContact CE2-CD2 4.19Å; F178-L252 WeakPolarHBondContact CE2-O 3.22Å; F178-L252 HydrophobicContact CZ-CB 4.03Å; F178-L252 HydrophobicContact CZ-CD2 3.74Å; F178-L252 HydrophobicContact CZ-CG 4.49Å; T182-L252 HydrophobicContact CG2-CD2 3.78Å; V228-L252 HydrophobicContact CG1-CD2 3.77Å; V228-L252 HydrophobicContact CG1-CG 3.88Å; T232-L252 HydrophobicContact CG2-CD1 4.14Å; T232-L252 HydrophobicContact CG2-CG 4.11Å; F233-L252 HydrophobicContact CD2-CD1 4.47Å; F233-L252 HydrophobicContact CE2-CD1 3.49Å; F233-L252 VanDerWaalsContact CE2-CD1 3.49Å; F233-L252 HydrophobicContact CE2-CD2 3.93Å; F233-L252 HydrophobicContact CE2-CG 4.38Å; F233-L252 HydrophobicContact CZ-CD1 3.71Å; A248-L252 WeakPolarHBondContact O-CB 3.17Å; A248-L252 WeakPolarHBondContact O-CD1 3.42Å; A248-L252 WeakPolarHBondContact O-CG 3.33Å; A248-L252 PolarHBondContact O-N 2.99Å; L252-M256 WeakPolarHBondContact O-CB 3.32Å; L252-M256 PolarHBondContact O-N 3.43Å |
| 253 | Y | 95.2 | Very high | 89.9 | Confident | 0 Ų | 0 | 10.1 Ų | 10.1 | 0% | 0 | 5% | 0.051 | C | C | . | . | H | α-helix | trans | -63 | -45 | 178 | 174.6 | -102.6 | 0 | 0 | 0 | 112.3 | Q72 S76 Y147 T148 T151 S152 S249 L250 V255 M256 M257 | Q72-Y253 HydrophobicContact CB-CD2 3.55Å; Q72-Y253 HydrophobicContact CB-CE2 3.91Å; Q72-Y253 HydrophobicContact CB-CG 4.14Å; Q72-Y253 HydrophobicContact CG-CD2 4.42Å; S76-Y253 WeakPolarHBondContact OG-CE2 3.35Å; S76-Y253 PolarHBondContact OG-OH 3.37Å; Y147-Y253 HydrophobicContact CD1-CD1 4.2Å; Y147-Y253 HydrophobicContact CD1-CE1 4.24Å; Y147-Y253 AromaticContact CE1-CD1 3.77Å; Y147-Y253 HydrophobicContact CE1-CD1 3.77Å; Y147-Y253 AromaticContact CE1-CE1 3.93Å; Y147-Y253 HydrophobicContact CE1-CE1 3.93Å; T148-Y253 HydrophobicContact CG2-CE1 4.44Å; T148-Y253 HydrophobicContact CG2-CE2 4.06Å; T148-Y253 PolarHBondContact O-OH 3.14Å; T148-Y253 VanDerWaalsContact O-OH 3.12Å; T148-Y253 WeakPolarHBondContact OG1-CE1 3.4Å; T151-Y253 HydrophobicContact CG2-CE1 3.91Å; S152-Y253 PolarHBondContact OG-OH 2.91Å; S249-Y253 WeakPolarHBondContact O-CB 3.13Å; S249-Y253 PolarHBondContact O-N 3.14Å; L250-Y253 PolarHBondContact O-N 3.37Å; Y253-V255 PolarHBondContact O-N 2.82Å; Y253-M256 HydrophobicContact CD2-CE 3.8Å; Y253-M256 HydrophobicContact CE2-CE 4.05Å; Y253-M256 PolarHBondContact O-N 3.4Å; Y253-M257 HydrophobicContact CD1-CG 4.3Å; Y253-M257 HydrophobicContact CD2-CG 4.05Å; Y253-M257 HydrophobicContact CE1-CG 3.81Å; Y253-M257 HydrophobicContact CE2-CG 3.53Å; Y253-M257 HydrophobicContact CE2-SD 3.69Å; Y253-M257 HydrophobicContact CG-CG 4.41Å; Y253-M257 WeakPolarHBondContact O-CG 3.34Å; Y253-M257 PolarHBondContact O-N 3.15Å |
| 254 | T | 92.8 | Very high | 90.6 | Very high | 0 Ų | 0 | 5.9 Ų | 5.9 | 0% | 0 | 3% | 0.028 | C | C | . | . | H | α-helix | trans | -60.4 | -47.3 | 179.5 | -59.6 | 0 | 0 | 0 | 0 | 111.4 | F31 F34 L124 Y147 L250 L251 M256 M257 M258 | F31-T254 HydrophobicContact CD1-CG2 3.95Å; F31-T254 HydrophobicContact CE1-CG2 3.87Å; F34-T254 HydrophobicContact CD1-CG2 3.93Å; F34-T254 HydrophobicContact CD2-CG2 3.87Å; F34-T254 HydrophobicContact CE1-CG2 3.8Å; F34-T254 HydrophobicContact CE2-CG2 3.71Å; F34-T254 HydrophobicContact CG-CG2 3.96Å; F34-T254 HydrophobicContact CZ-CG2 3.67Å; L124-T254 HydrophobicContact CD2-CG2 4.43Å; Y147-T254 WeakPolarHBondContact CE1-OG1 3.47Å; Y147-T254 PolarHBondContact OH-OG1 2.85Å; L250-T254 WeakPolarHBondContact O-CB 3.43Å; L250-T254 PolarHBondContact O-N 2.89Å; L250-T254 PolarHBondContact O-OG1 2.85Å; L251-T254 PolarHBondContact O-N 3.22Å; T254-M256 PolarHBondContact O-N 2.92Å; T254-M257 PolarHBondContact O-N 3Å; T254-M258 WeakPolarHBondContact O-CG 3.27Å; T254-M258 PolarHBondContact O-N 3.2Å |
| 255 | V | 91.7 | Very high | 90.8 | Very high | 6 Ų | 6 | 6.5 Ų | 6.5 | 4% | 0.036 | 3% | 0.031 | C | C | . | . | H | α-helix | trans | -67.1 | -37.1 | 178.1 | 175.7 | 0 | 0 | 0 | 0 | 112.3 | F34 L224 M225 V228 L251 Y253 M258 D259 | F34-V255 HydrophobicContact CE1-CG2 3.88Å; F34-V255 HydrophobicContact CZ-CG2 4.49Å; L224-V255 HydrophobicContact CB-CG1 3.98Å; L224-V255 HydrophobicContact CB-CG2 4.2Å; M225-V255 HydrophobicContact CB-CG1 4.41Å; M225-V255 HydrophobicContact CG-CG1 3.66Å; V228-V255 HydrophobicContact CB-CG2 4.46Å; V228-V255 HydrophobicContact CG2-CG2 3.78Å; L251-V255 PolarHBondContact O-N 3.36Å; L251-V255 VanDerWaalsContact O-N 3.16Å; Y253-V255 PolarHBondContact O-N 2.82Å; V255-M258 PolarHBondContact O-N 2.93Å; V255-D259 PolarHBondContact O-N 3.08Å |
| 256 | M | 93.3 | Very high | 90.6 | Very high | 0 Ų | 0 | 7.2 Ų | 7.2 | 0% | 0 | 4% | 0.038 | C | C | . | . | H | α-helix | trans | -61 | -45.3 | 174.3 | -174.3 | -163.5 | 71.7 | 0 | 0 | 112.1 | I73 W171 T174 L175 F178 L252 Y253 T254 M258 D259 W260 | I73-M256 HydrophobicContact CD1-SD 3.91Å; I73-M256 HydrophobicContact CG1-CE 3.75Å; I73-M256 HydrophobicContact CG1-SD 3.47Å; I73-M256 WeakPolarHBondContact CG1-SD 3.39Å; W171-M256 HydrophobicContact CH2-CE 4.4Å; W171-M256 HydrophobicContact CZ3-CE 4.08Å; T174-M256 HydrophobicContact CG2-CG 4.02Å; T174-M256 WeakPolarHBondContact CG2-O 3.37Å; L175-M256 HydrophobicContact CD2-SD 4.4Å; F178-M256 HydrophobicContact CB-CG 4.21Å; F178-M256 HydrophobicContact CD1-CB 4.5Å; F178-M256 HydrophobicContact CD1-CG 4.16Å; F178-M256 HydrophobicContact CD1-SD 4.35Å; F178-M256 HydrophobicContact CD2-CB 3.64Å; F178-M256 HydrophobicContact CD2-CG 3.97Å; F178-M256 HydrophobicContact CE2-CB 3.75Å; F178-M256 HydrophobicContact CE2-CG 4.41Å; F178-M256 HydrophobicContact CG-CB 4.04Å; F178-M256 HydrophobicContact CG-CG 3.83Å; F178-M256 HydrophobicContact CZ-CB 4.23Å; L252-M256 WeakPolarHBondContact O-CB 3.32Å; L252-M256 PolarHBondContact O-N 3.43Å; Y253-M256 HydrophobicContact CD2-CE 3.8Å; Y253-M256 HydrophobicContact CE2-CE 4.05Å; Y253-M256 PolarHBondContact O-N 3.4Å; T254-M256 PolarHBondContact O-N 2.92Å; M256-M258 PolarHBondContact O-N 3.38Å; M256-D259 PolarHBondContact O-N 2.96Å; M256-W260 PolarHBondContact O-N 2.89Å |
| 257 | M | 93 | Very high | 90.4 | Very high | 0 Ų | 0 | 8.2 Ų | 8.2 | 0% | 0 | 4% | 0.043 | C | C | . | . | H | α-helix | trans | -65.2 | -28.2 | 178.9 | -70.3 | -57.7 | -58.6 | 0 | 0 | 112.6 | T151 V155 W171 Y253 T254 L261 | T151-M257 HydrophobicContact CG2-CB 4.06Å; T151-M257 HydrophobicContact CG2-CE 4.33Å; T151-M257 HydrophobicContact CG2-CG 3.9Å; V155-M257 HydrophobicContact CB-CE 3.97Å; V155-M257 HydrophobicContact CG1-CE 3.79Å; V155-M257 HydrophobicContact CG2-CE 4.39Å; W171-M257 HydrophobicContact CH2-CE 4.43Å; W171-M257 HydrophobicContact CH2-SD 3.81Å; Y253-M257 HydrophobicContact CD1-CG 4.3Å; Y253-M257 HydrophobicContact CD2-CG 4.05Å; Y253-M257 HydrophobicContact CE1-CG 3.81Å; Y253-M257 HydrophobicContact CE2-CG 3.53Å; Y253-M257 HydrophobicContact CE2-SD 3.69Å; Y253-M257 HydrophobicContact CG-CG 4.41Å; Y253-M257 WeakPolarHBondContact O-CG 3.34Å; Y253-M257 PolarHBondContact O-N 3.15Å; T254-M257 PolarHBondContact O-N 3Å; M257-L261 WeakPolarHBondContact O-CB 3.33Å; M257-L261 PolarHBondContact O-N 3.06Å |
| 258 | M | 89.4 | Confident | 90.2 | Very high | 18 Ų | 18 | 10 Ų | 10 | 9% | 0.089 | 5% | 0.051 | C | C | . | . | H | α-helix | trans | -71.3 | -39.2 | 173.8 | -66.1 | -50.9 | -178.7 | 0 | 0 | 113.1 | F31 T254 V255 M256 W260 L261 T262 | F31-M258 HydrophobicContact CB-CE 3.6Å; F31-M258 HydrophobicContact CB-CG 3.99Å; F31-M258 HydrophobicContact CB-SD 3.63Å; F31-M258 HydrophobicContact CD1-CB 4.27Å; F31-M258 HydrophobicContact CD1-CE 2.33Å; F31-M258 HydrophobicContact CD1-CG 2.75Å; F31-M258 HydrophobicContact CD1-SD 2.48Å; F31-M258 WeakPolarHBondContact CD1-SD 3.46Å; F31-M258 HydrophobicContact CD2-CE 2.34Å; F31-M258 HydrophobicContact CD2-CG 3.99Å; F31-M258 HydrophobicContact CD2-SD 2.46Å; F31-M258 WeakPolarHBondContact CD2-SD 3.4Å; F31-M258 HydrophobicContact CE1-CB 4.46Å; F31-M258 HydrophobicContact CE1-CE 2.34Å; F31-M258 HydrophobicContact CE1-CG 3.07Å; F31-M258 HydrophobicContact CE1-SD 2.47Å; F31-M258 WeakPolarHBondContact CE1-SD 3.36Å; F31-M258 HydrophobicContact CE2-CE 2.34Å; F31-M258 HydrophobicContact CE2-CG 4.23Å; F31-M258 HydrophobicContact CE2-SD 2.46Å; F31-M258 WeakPolarHBondContact CE2-SD 3.48Å; F31-M258 HydrophobicContact CG-CE 2.34Å; F31-M258 HydrophobicContact CG-CG 3.28Å; F31-M258 HydrophobicContact CG-SD 2.46Å; F31-M258 WeakPolarHBondContact CG-SD 3.08Å; F31-M258 HydrophobicContact CZ-CE 2.35Å; F31-M258 HydrophobicContact CZ-CG 3.83Å; F31-M258 HydrophobicContact CZ-SD 2.47Å; F31-M258 WeakPolarHBondContact CZ-SD 3.47Å; T254-M258 WeakPolarHBondContact O-CG 3.27Å; T254-M258 PolarHBondContact O-N 3.2Å; V255-M258 PolarHBondContact O-N 2.93Å; M256-M258 PolarHBondContact O-N 3.38Å; M258-W260 VanDerWaalsContact C-N 3.35Å; M258-L261 PolarHBondContact O-N 2.88Å; M258-L261 HydrophobicContact SD-CD2 4.25Å; M258-T262 PolarHBondContact O-N 3.47Å; M258-T262 PolarHBondContact O-OG1 2.94Å |
| 259 | D | 89.3 | Confident | 89.9 | Confident | 1 Ų | 1 | 17.8 Ų | 17.8 | 1% | 0.005 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -70.6 | -34.2 | 173.9 | -159.3 | 52.6 | 0 | 0 | 0 | 111.5 | T174 S177 R221 M225 V255 M256 I263 | T174-D259 HydrophobicContact CG2-CB 4.27Å; S177-D259 PolarHBondContact OG-OD2 2.86Å; R221-D259 IonicContact CZ-OD1 3.78Å; R221-D259 IonicContact NH1-OD1 2.73Å; R221-D259 PolarHBondContact NH1-OD1 3.36Å; M225-D259 HydrophobicContact CE-CB 3.26Å; M225-D259 WeakPolarHBondContact CE-OD2 3.26Å; V255-D259 PolarHBondContact O-N 3.08Å; M256-D259 PolarHBondContact O-N 2.96Å; D259-I263 VanDerWaalsContact O-CB 3.22Å; D259-I263 WeakPolarHBondContact O-CB 3.43Å; D259-I263 WeakPolarHBondContact O-CD1 3.22Å; D259-I263 WeakPolarHBondContact O-CG1 3.43Å; D259-I263 PolarHBondContact O-N 2.97Å; D259-I263 WeakPolarHBondContact OD2-CD1 3.34Å |
| 260 | W | 91 | Very high | 89.4 | Confident | 0 Ų | 0 | 23.8 Ų | 23.8 | 0% | 0 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -58.9 | -50.7 | 168.8 | -167.5 | 81.6 | 0 | 0 | 0 | 112.1 | T80 V155 F159 W171 T174 M256 M258 T262 I263 V264 | T80-W260 HydrophobicContact CG2-CH2 3.86Å; T80-W260 HydrophobicContact CG2-CZ2 3.7Å; V155-W260 HydrophobicContact CG1-CE3 3.51Å; V155-W260 HydrophobicContact CG1-CZ3 3.69Å; F159-W260 HydrophobicContact CD2-CH2 4.42Å; F159-W260 HydrophobicContact CD2-CZ3 4.1Å; W171-W260 AromaticContact CD1-NE1 3.41Å; W171-W260 AromaticContact CD2-CD1 3.46Å; W171-W260 VanDerWaalsContact CD2-CD1 3.46Å; W171-W260 HydrophobicContact CD2-CG 4.4Å; W171-W260 AromaticContact CD2-NE1 3.28Å; W171-W260 VanDerWaalsContact CD2-NE1 3.28Å; W171-W260 AromaticContact CE2-CD1 3.73Å; W171-W260 AromaticContact CE2-CE2 3.78Å; W171-W260 AromaticContact CE2-NE1 3.31Å; W171-W260 VanDerWaalsContact CE2-NE1 3.31Å; W171-W260 AromaticContact CE3-CD1 3.61Å; W171-W260 HydrophobicContact CE3-CG 4.42Å; W171-W260 AromaticContact CE3-NE1 3.95Å; W171-W260 AromaticContact CG-CD1 3.89Å; W171-W260 AromaticContact CG-NE1 3.35Å; W171-W260 VanDerWaalsContact CG-NE1 3.35Å; W171-W260 HydrophobicContact CH2-CG 4.33Å; W171-W260 HydrophobicContact CZ2-CD2 4.36Å; W171-W260 HydrophobicContact CZ2-CG 4.33Å; W171-W260 AromaticContact CZ2-NE1 3.98Å; W171-W260 AromaticContact CZ3-CD1 3.98Å; W171-W260 HydrophobicContact CZ3-CG 4.39Å; W171-W260 AromaticContact NE1-CE2 3.71Å; W171-W260 AromaticContact NE1-CZ2 3.88Å; W171-W260 AromaticContact NE1-NE1 3.39Å; T174-W260 HydrophobicContact CG2-CB 4.01Å; T174-W260 VanDerWaalsContact OG1-CA 3.29Å; T174-W260 WeakPolarHBondContact OG1-CA 3.39Å; M256-W260 PolarHBondContact O-N 2.89Å; M258-W260 VanDerWaalsContact C-N 3.35Å; W260-T262 PolarHBondContact O-N 2.83Å; W260-I263 PolarHBondContact O-N 3.39Å; W260-V264 HydrophobicContact CD2-CG1 4.42Å; W260-V264 HydrophobicContact CE3-CG1 3.9Å; W260-V264 HydrophobicContact CH2-CB 4.29Å; W260-V264 HydrophobicContact CH2-CG1 3.96Å; W260-V264 HydrophobicContact CH2-CG2 4.24Å; W260-V264 HydrophobicContact CZ2-CB 4.34Å; W260-V264 HydrophobicContact CZ2-CG1 4.44Å; W260-V264 HydrophobicContact CZ2-CG2 4.33Å; W260-V264 HydrophobicContact CZ3-CB 4.4Å; W260-V264 HydrophobicContact CZ3-CG1 3.65Å; W260-V264 WeakPolarHBondContact O-CG1 3.43Å; W260-V264 PolarHBondContact O-N 3.38Å |
| 261 | L | 90 | Very high | 89 | Confident | 0 Ų | 0 | 24.8 Ų | 24.8 | 0% | 0 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -55.4 | -48.5 | 179.3 | 176.3 | 58.1 | 0 | 0 | 0 | 111.3 | R27 F31 V155 F159 M257 M258 V264 Q265 | R27-L261 HydrophobicContact CB-CD2 4.28Å; F31-L261 HydrophobicContact CD2-CD2 4.35Å; F31-L261 HydrophobicContact CE2-CD2 3.58Å; V155-L261 HydrophobicContact CG1-CB 4.1Å; V155-L261 HydrophobicContact CG1-CD1 4.25Å; F159-L261 HydrophobicContact CE2-CD1 3.47Å; F159-L261 VanDerWaalsContact CE2-CD1 3.47Å; F159-L261 HydrophobicContact CZ-CD1 3.68Å; M257-L261 WeakPolarHBondContact O-CB 3.33Å; M257-L261 PolarHBondContact O-N 3.06Å; M258-L261 PolarHBondContact O-N 2.88Å; M258-L261 HydrophobicContact SD-CD2 4.25Å; L261-V264 VanDerWaalsContact O-CG1 3.27Å; L261-V264 WeakPolarHBondContact O-CG1 3.43Å; L261-Q265 HydrophobicContact CD1-CG 4.39Å; L261-Q265 VanDerWaalsContact CD1-NE2 3.32Å; L261-Q265 WeakPolarHBondContact O-CB 3.36Å; L261-Q265 VanDerWaalsContact O-CD 3.27Å; L261-Q265 WeakPolarHBondContact O-CG 3.49Å; L261-Q265 PolarHBondContact O-N 3.34Å; L261-Q265 PolarHBondContact O-OE1 2.82Å |
| 262 | T | 86.4 | Confident | 88.5 | Confident | 9 Ų | 9 | 28.3 Ų | 28.3 | 6% | 0.055 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -77.8 | -28.6 | -179 | -47.9 | 0 | 0 | 0 | 0 | 113.7 | R221 M258 W260 N266 | R221-T262 VanDerWaalsContact CZ-CB 3.48Å; R221-T262 VanDerWaalsContact NH2-CG2 3.27Å; M258-T262 PolarHBondContact O-N 3.47Å; M258-T262 PolarHBondContact O-OG1 2.94Å; W260-T262 PolarHBondContact O-N 2.83Å; T262-N266 VanDerWaalsContact O-CB 3.32Å; T262-N266 WeakPolarHBondContact O-CB 3.49Å; T262-N266 PolarHBondContact O-N 2.86Å; T262-N266 PolarHBondContact O-ND2 2.74Å |
| 263 | I | 87.6 | Confident | 88 | Confident | 18 Ų | 18 | 31.1 Ų | 31.1 | 9% | 0.092 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -64.9 | -45.3 | 170.8 | -74.5 | 164.4 | 0 | 0 | 0 | 110.6 | A170 V173 T174 D259 W260 N266 L267 | A170-I263 HydrophobicContact CB-CG2 3.96Å; V173-I263 HydrophobicContact CB-CD1 4.36Å; V173-I263 HydrophobicContact CB-CG2 4.3Å; V173-I263 HydrophobicContact CG1-CD1 3.8Å; V173-I263 HydrophobicContact CG1-CG1 4.44Å; V173-I263 HydrophobicContact CG1-CG2 4.39Å; T174-I263 WeakPolarHBondContact OG1-CD1 3.4Å; D259-I263 VanDerWaalsContact O-CB 3.22Å; D259-I263 WeakPolarHBondContact O-CB 3.43Å; D259-I263 WeakPolarHBondContact O-CD1 3.22Å; D259-I263 WeakPolarHBondContact O-CG1 3.43Å; D259-I263 PolarHBondContact O-N 2.97Å; D259-I263 WeakPolarHBondContact OD2-CD1 3.34Å; W260-I263 PolarHBondContact O-N 3.39Å; I263-N266 PolarHBondContact O-N 2.88Å; I263-L267 HydrophobicContact CG2-CD1 3.95Å; I263-L267 WeakPolarHBondContact O-CB 3.33Å; I263-L267 WeakPolarHBondContact O-CG 3.46Å; I263-L267 PolarHBondContact O-N 2.99Å |
| 264 | V | 89.2 | Confident | 87.3 | Confident | 0 Ų | 0 | 34 Ų | 34 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -69.2 | -34.7 | 179.5 | 74.8 | 0 | 0 | 0 | 0 | 112.2 | F159 L162 A170 W260 L261 L267 Q268 | F159-V264 HydrophobicContact CB-CG2 4.19Å; F159-V264 HydrophobicContact CD1-CB 4.4Å; F159-V264 HydrophobicContact CD1-CG1 3.74Å; F159-V264 HydrophobicContact CD1-CG2 3.85Å; F159-V264 HydrophobicContact CD2-CG1 3.75Å; F159-V264 HydrophobicContact CE1-CG1 3.76Å; F159-V264 HydrophobicContact CE2-CG1 3.77Å; F159-V264 HydrophobicContact CG-CG1 3.75Å; F159-V264 HydrophobicContact CG-CG2 3.96Å; F159-V264 HydrophobicContact CZ-CG1 3.79Å; L162-V264 HydrophobicContact CD1-CG2 3.46Å; L162-V264 VanDerWaalsContact CD1-CG2 3.46Å; A170-V264 HydrophobicContact CB-CB 4.1Å; A170-V264 HydrophobicContact CB-CG2 4.37Å; W260-V264 HydrophobicContact CD2-CG1 4.42Å; W260-V264 HydrophobicContact CE3-CG1 3.9Å; W260-V264 HydrophobicContact CH2-CB 4.29Å; W260-V264 HydrophobicContact CH2-CG1 3.96Å; W260-V264 HydrophobicContact CH2-CG2 4.24Å; W260-V264 HydrophobicContact CZ2-CB 4.34Å; W260-V264 HydrophobicContact CZ2-CG1 4.44Å; W260-V264 HydrophobicContact CZ2-CG2 4.33Å; W260-V264 HydrophobicContact CZ3-CB 4.4Å; W260-V264 HydrophobicContact CZ3-CG1 3.65Å; W260-V264 WeakPolarHBondContact O-CG1 3.43Å; W260-V264 PolarHBondContact O-N 3.38Å; L261-V264 VanDerWaalsContact O-CG1 3.27Å; L261-V264 WeakPolarHBondContact O-CG1 3.43Å; V264-L267 PolarHBondContact O-N 3.22Å; V264-Q268 WeakPolarHBondContact O-CB 3.47Å; V264-Q268 PolarHBondContact O-N 3.1Å |
| 265 | Q | 87.2 | Confident | 86.5 | Confident | 30 Ų | 30 | 38.3 Ų | 38.3 | 14% | 0.14 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -60.6 | -50.3 | 169.7 | -74.1 | 162.6 | -12.2 | 0 | 0 | 112.1 | V24 F159 L261 L267 Q268 Y269 | V24-Q265 HydrophobicContact CG2-CG 4.47Å; F159-Q265 HydrophobicContact CE1-CG 3.89Å; F159-Q265 HydrophobicContact CZ-CG 3.66Å; L261-Q265 HydrophobicContact CD1-CG 4.39Å; L261-Q265 VanDerWaalsContact CD1-NE2 3.32Å; L261-Q265 WeakPolarHBondContact O-CB 3.36Å; L261-Q265 VanDerWaalsContact O-CD 3.27Å; L261-Q265 WeakPolarHBondContact O-CG 3.49Å; L261-Q265 PolarHBondContact O-N 3.34Å; L261-Q265 PolarHBondContact O-OE1 2.82Å; Q265-L267 VanDerWaalsContact C-N 3.29Å; Q265-L267 PolarHBondContact O-N 3.44Å; Q265-Q268 PolarHBondContact O-N 3.02Å; Q265-Y269 WeakPolarHBondContact O-CB 3.34Å; Q265-Y269 PolarHBondContact O-N 3.48Å |
| 266 | N | 85.4 | Confident | 85.6 | Confident | 65 Ų | 65 | 42.1 Ų | 42.1 | 35% | 0.348 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -61.5 | -38.6 | 179.3 | -74.6 | -18 | 0 | 0 | 0 | 111.7 | T262 I263 F270 | T262-N266 VanDerWaalsContact O-CB 3.32Å; T262-N266 WeakPolarHBondContact O-CB 3.49Å; T262-N266 PolarHBondContact O-N 2.86Å; T262-N266 PolarHBondContact O-ND2 2.74Å; I263-N266 PolarHBondContact O-N 2.88Å; N266-F270 WeakPolarHBondContact O-CB 3.45Å; N266-F270 PolarHBondContact O-N 2.74Å |
| 267 | L | 86.1 | Confident | 84.6 | Confident | 24 Ų | 24 | 49.3 Ų | 49.3 | 13% | 0.126 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -64.6 | -47.6 | 173.2 | -73.3 | 167.5 | 0 | 0 | 0 | 111.6 | W166 M169 A170 I263 V264 Q265 Y269 F270 I271 | W166-L267 HydrophobicContact CE3-CD2 4.38Å; M169-L267 HydrophobicContact CE-CD2 4.43Å; M169-L267 HydrophobicContact SD-CD2 4.24Å; A170-L267 HydrophobicContact CB-CD1 3.85Å; I263-L267 HydrophobicContact CG2-CD1 3.95Å; I263-L267 WeakPolarHBondContact O-CB 3.33Å; I263-L267 WeakPolarHBondContact O-CG 3.46Å; I263-L267 PolarHBondContact O-N 2.99Å; V264-L267 PolarHBondContact O-N 3.22Å; Q265-L267 VanDerWaalsContact C-N 3.29Å; Q265-L267 PolarHBondContact O-N 3.44Å; L267-Y269 PolarHBondContact O-N 2.82Å; L267-F270 PolarHBondContact O-N 3.14Å; L267-I271 WeakPolarHBondContact O-CB 3.41Å; L267-I271 VanDerWaalsContact O-CD1 3.24Å; L267-I271 WeakPolarHBondContact O-CD1 3.28Å; L267-I271 WeakPolarHBondContact O-CG1 3.33Å; L267-I271 PolarHBondContact O-N 3Å |
| 268 | Q | 85.4 | Confident | 83.3 | Confident | 37 Ų | 37 | 52.3 Ų | 52.3 | 17% | 0.173 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -58.6 | -45.8 | 176.8 | -176.8 | 170 | 0.6 | 0 | 0 | 112.1 | L162 V264 Q265 F270 I271 N272 | L162-Q268 HydrophobicContact CD1-CB 4.22Å; L162-Q268 HydrophobicContact CD2-CB 4.1Å; L162-Q268 HydrophobicContact CD2-CG 4.01Å; V264-Q268 WeakPolarHBondContact O-CB 3.47Å; V264-Q268 PolarHBondContact O-N 3.1Å; Q265-Q268 PolarHBondContact O-N 3.02Å; Q268-F270 PolarHBondContact O-N 2.79Å; Q268-I271 PolarHBondContact O-N 2.92Å; Q268-N272 WeakPolarHBondContact O-CB 3.37Å; Q268-N272 PolarHBondContact O-N 3.2Å; Q268-N272 PolarHBondContact O-OD1 3.4Å |
| 269 | Y | 84.9 | Confident | 81.9 | Confident | 164 Ų | 164 | 58 Ų | 58 | 64% | 0.643 | 28% | 0.283 | S | S | * | . | H | α-helix | trans | -60.9 | -43.3 | 175.9 | -178.4 | -100.7 | 0 | 0 | 0 | 111.9 | Q265 L267 N273 | Q265-Y269 WeakPolarHBondContact O-CB 3.34Å; Q265-Y269 PolarHBondContact O-N 3.48Å; L267-Y269 PolarHBondContact O-N 2.82Å; Y269-N273 WeakPolarHBondContact CD1-ND2 3.48Å; Y269-N273 WeakPolarHBondContact CD2-ND2 3.15Å; Y269-N273 VanDerWaalsContact CE1-ND2 3.28Å; Y269-N273 WeakPolarHBondContact CE1-ND2 3.38Å; Y269-N273 VanDerWaalsContact CE2-ND2 3.28Å; Y269-N273 WeakPolarHBondContact CE2-ND2 3.38Å; Y269-N273 WeakPolarHBondContact O-CB 3.24Å; Y269-N273 PolarHBondContact O-N 2.74Å; Y269-N273 VanDerWaalsContact O-N 3.1Å; Y269-N273 PolarHBondContact O-ND2 2.97Å |
| 270 | F | 82.6 | Confident | 80.8 | Confident | 127 Ų | 127 | 62 Ų | 62 | 56% | 0.557 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -63.9 | -43.7 | 176.3 | 178.7 | -96.3 | 0 | 0 | 0 | 112.5 | N266 L267 Q268 T274 | N266-F270 WeakPolarHBondContact O-CB 3.45Å; N266-F270 PolarHBondContact O-N 2.74Å; L267-F270 PolarHBondContact O-N 3.14Å; Q268-F270 PolarHBondContact O-N 2.79Å; F270-T274 WeakPolarHBondContact O-CB 3.47Å; F270-T274 PolarHBondContact O-N 3.41Å; F270-T274 PolarHBondContact O-OG1 3.4Å |
| 271 | I | 83.3 | Confident | 79.4 | Confident | 21 Ų | 21 | 64.3 Ų | 64.3 | 11% | 0.108 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -62.1 | -52.1 | 178.5 | -67.4 | 156 | 0 | 0 | 0 | 110.3 | L162 W166 L267 Q268 N273 T274 L275 | L162-I271 HydrophobicContact CD2-CD1 4.33Å; W166-I271 HydrophobicContact CB-CD1 4.17Å; W166-I271 VanDerWaalsContact CD1-CD1 3.49Å; W166-I271 HydrophobicContact CD2-CD1 3.52Å; W166-I271 HydrophobicContact CD2-CG1 4.18Å; W166-I271 HydrophobicContact CE3-CD1 4.18Å; W166-I271 HydrophobicContact CG-CD1 3.49Å; W166-I271 VanDerWaalsContact CG-CD1 3.49Å; W166-I271 HydrophobicContact CZ2-CD1 4.3Å; W166-I271 HydrophobicContact CZ2-CG1 4.08Å; L267-I271 WeakPolarHBondContact O-CB 3.41Å; L267-I271 VanDerWaalsContact O-CD1 3.24Å; L267-I271 WeakPolarHBondContact O-CD1 3.28Å; L267-I271 WeakPolarHBondContact O-CG1 3.33Å; L267-I271 PolarHBondContact O-N 3Å; Q268-I271 PolarHBondContact O-N 2.92Å; I271-N273 PolarHBondContact O-N 3.41Å; I271-T274 PolarHBondContact O-N 3.26Å; I271-T274 VanDerWaalsContact O-N 3.14Å; I271-L275 HydrophobicContact CG2-CD1 3.8Å; I271-L275 HydrophobicContact CG2-CG 4.38Å; I271-L275 WeakPolarHBondContact O-CG 3.44Å; I271-L275 PolarHBondContact O-N 3.04Å |
| 272 | N | 82.4 | Confident | 78 | Confident | 75 Ų | 75 | 68.5 Ų | 68.5 | 40% | 0.401 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -59 | -46.8 | -178.6 | -70.2 | -0.2 | 0 | 0 | 0 | 111.3 | Q268 T274 L275 N276 | Q268-N272 WeakPolarHBondContact O-CB 3.37Å; Q268-N272 PolarHBondContact O-N 3.2Å; Q268-N272 PolarHBondContact O-OD1 3.4Å; N272-T274 VanDerWaalsContact C-N 3.32Å; N272-T274 PolarHBondContact O-N 3.42Å; N272-L275 PolarHBondContact O-N 3.06Å; N272-N276 WeakPolarHBondContact O-CB 3.32Å; N272-N276 PolarHBondContact O-N 3.29Å; N272-N276 PolarHBondContact O-OD1 3.45Å |
| 273 | N | 82.2 | Confident | 76.8 | Confident | 58 Ų | 58 | 71.2 Ų | 71.2 | 31% | 0.31 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -66.2 | -31.7 | 177.6 | -77.1 | -57.4 | 0 | 0 | 0 | 113.6 | Y269 I271 K277 | Y269-N273 WeakPolarHBondContact CD1-ND2 3.48Å; Y269-N273 WeakPolarHBondContact CD2-ND2 3.15Å; Y269-N273 VanDerWaalsContact CE1-ND2 3.28Å; Y269-N273 WeakPolarHBondContact CE1-ND2 3.38Å; Y269-N273 VanDerWaalsContact CE2-ND2 3.28Å; Y269-N273 WeakPolarHBondContact CE2-ND2 3.38Å; Y269-N273 WeakPolarHBondContact O-CB 3.24Å; Y269-N273 PolarHBondContact O-N 2.74Å; Y269-N273 VanDerWaalsContact O-N 3.1Å; Y269-N273 PolarHBondContact O-ND2 2.97Å; I271-N273 PolarHBondContact O-N 3.41Å; N273-K277 WeakPolarHBondContact O-CG 3.28Å; N273-K277 PolarHBondContact O-N 3.48Å |
| 274 | T | 80.7 | Confident | 75.6 | Confident | 62 Ų | 62 | 72.9 Ų | 72.9 | 38% | 0.38 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -71.4 | -45.8 | 176.1 | -58.7 | 0 | 0 | 0 | 0 | 110.9 | F270 I271 N272 K277 T278 | F270-T274 WeakPolarHBondContact O-CB 3.47Å; F270-T274 PolarHBondContact O-N 3.41Å; F270-T274 PolarHBondContact O-OG1 3.4Å; I271-T274 PolarHBondContact O-N 3.26Å; I271-T274 VanDerWaalsContact O-N 3.14Å; N272-T274 VanDerWaalsContact C-N 3.32Å; N272-T274 PolarHBondContact O-N 3.42Å; T274-K277 PolarHBondContact O-N 3.29Å; T274-T278 PolarHBondContact O-N 2.93Å |
| 275 | L | 75.6 | Confident | 74.1 | Confident | 90 Ų | 90 | 79 Ų | 79 | 47% | 0.471 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -60.6 | -47.3 | 176.9 | -69 | 171.9 | 0 | 0 | 0 | 111.6 | I271 N272 K277 T278 Q279 | I271-L275 HydrophobicContact CG2-CD1 3.8Å; I271-L275 HydrophobicContact CG2-CG 4.38Å; I271-L275 WeakPolarHBondContact O-CG 3.44Å; I271-L275 PolarHBondContact O-N 3.04Å; N272-L275 PolarHBondContact O-N 3.06Å; L275-K277 VanDerWaalsContact C-N 3.28Å; L275-K277 PolarHBondContact O-N 3.27Å; L275-T278 PolarHBondContact O-N 3.09Å; L275-T278 PolarHBondContact O-OG1 3.33Å; L275-Q279 PolarHBondContact O-N 3.08Å |
| 276 | N | 73.7 | Confident | 73 | Confident | 85 Ų | 85 | 81.9 Ų | 81.9 | 46% | 0.455 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -59.4 | -37.2 | 178.2 | -68.4 | -5.3 | 0 | 0 | 0 | 112.4 | N272 Q279 T280 | N272-N276 WeakPolarHBondContact O-CB 3.32Å; N272-N276 PolarHBondContact O-N 3.29Å; N272-N276 PolarHBondContact O-OD1 3.45Å; N276-Q279 PolarHBondContact O-N 2.94Å; N276-T280 PolarHBondContact O-N 2.93Å; N276-T280 VanDerWaalsContact O-N 3.13Å; N276-T280 PolarHBondContact O-OG1 3.06Å |
| 277 | K | 70.6 | Confident | 71.9 | Confident | 151 Ų | 151 | 82 Ų | 82 | 66% | 0.657 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -66.3 | -40.7 | 173.3 | -75.1 | 176 | -177.6 | -179.2 | 0 | 112.4 | N273 T274 L275 T280 S281 | N273-K277 WeakPolarHBondContact O-CG 3.28Å; N273-K277 PolarHBondContact O-N 3.48Å; T274-K277 PolarHBondContact O-N 3.29Å; L275-K277 VanDerWaalsContact C-N 3.28Å; L275-K277 PolarHBondContact O-N 3.27Å; K277-T280 WeakPolarHBondContact CA-OG1 3.39Å; K277-T280 PolarHBondContact O-N 2.86Å; K277-T280 PolarHBondContact O-OG1 3.13Å; K277-T280 VanDerWaalsContact O-OG1 3.06Å; K277-S281 PolarHBondContact O-N 3.5Å; K277-S281 PolarHBondContact O-OG 3.48Å |
| 278 | T | 66.1 | Low | 71 | Confident | 64 Ų | 64 | 88 Ų | 88 | 39% | 0.393 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -67.9 | -33.5 | 176.3 | 59.5 | 0 | 0 | 0 | 0 | 113.4 | T274 L275 S281 N282 | T274-T278 PolarHBondContact O-N 2.93Å; L275-T278 PolarHBondContact O-N 3.09Å; L275-T278 PolarHBondContact O-OG1 3.33Å; T278-S281 WeakPolarHBondContact CA-OG 3.44Å; T278-S281 PolarHBondContact O-OG 3.28Å; T278-N282 WeakPolarHBondContact O-CB 3.34Å; T278-N282 PolarHBondContact O-N 2.77Å; T278-N282 VanDerWaalsContact O-N 3.08Å; T278-N282 PolarHBondContact O-ND2 3.38Å; T278-N282 PolarHBondContact O-OD1 3.47Å; T278-N282 VanDerWaalsContact O-OD1 3.09Å |
| 279 | Q | 61.4 | Low | 70 | Confident | 136 Ų | 136 | 93 Ų | 93 | 64% | 0.636 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -68.5 | -42.7 | 175.2 | -70 | -175.5 | 0.2 | 0 | 0 | 111.7 | L275 N276 N282 S283 | L275-Q279 PolarHBondContact O-N 3.08Å; N276-Q279 PolarHBondContact O-N 2.94Å; Q279-N282 PolarHBondContact O-N 3.17Å; Q279-S283 PolarHBondContact O-N 2.72Å; Q279-S283 PolarHBondContact O-OG 2.95Å |
| 280 | T | 65.2 | Low | 69.2 | Low | 87 Ų | 87 | 89 Ų | 89 | 53% | 0.534 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -71.3 | -32.7 | 178.1 | 48 | 0 | 0 | 0 | 0 | 113.5 | N276 K277 S283 S284 | N276-T280 PolarHBondContact O-N 2.93Å; N276-T280 VanDerWaalsContact O-N 3.13Å; N276-T280 PolarHBondContact O-OG1 3.06Å; K277-T280 WeakPolarHBondContact CA-OG1 3.39Å; K277-T280 PolarHBondContact O-N 2.86Å; K277-T280 PolarHBondContact O-OG1 3.13Å; K277-T280 VanDerWaalsContact O-OG1 3.06Å; T280-S283 PolarHBondContact O-OG 3.03Å; T280-S284 WeakPolarHBondContact O-CB 3.35Å; T280-S284 PolarHBondContact O-N 3.33Å; T280-S284 VanDerWaalsContact O-N 3.17Å; T280-S284 PolarHBondContact O-OG 2.95Å |
| 281 | S | 60.8 | Low | 68.5 | Low | 47 Ų | 47 | 88.1 Ų | 88.1 | 33% | 0.329 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -64.9 | -43 | 168.9 | 62.9 | 0 | 0 | 0 | 0 | 111.7 | K277 T278 S284 Q285 | K277-S281 PolarHBondContact O-N 3.5Å; K277-S281 PolarHBondContact O-OG 3.48Å; T278-S281 WeakPolarHBondContact CA-OG 3.44Å; T278-S281 PolarHBondContact O-OG 3.28Å; S281-S284 PolarHBondContact O-OG 2.97Å; S281-Q285 WeakPolarHBondContact O-CB 3.38Å; S281-Q285 WeakPolarHBondContact O-CG 3.44Å; S281-Q285 PolarHBondContact O-N 3.15Å |
| 282 | N | 61.4 | Low | 67.9 | Low | 88 Ų | 88 | 94 Ų | 94 | 47% | 0.471 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -71.7 | -41.9 | -176.8 | -65.5 | 5.5 | 0 | 0 | 0 | 111.8 | T278 Q279 S284 Q285 V286 | T278-N282 WeakPolarHBondContact O-CB 3.34Å; T278-N282 PolarHBondContact O-N 2.77Å; T278-N282 VanDerWaalsContact O-N 3.08Å; T278-N282 PolarHBondContact O-ND2 3.38Å; T278-N282 PolarHBondContact O-OD1 3.47Å; T278-N282 VanDerWaalsContact O-OD1 3.09Å; Q279-N282 PolarHBondContact O-N 3.17Å; N282-S284 VanDerWaalsContact C-N 3.34Å; N282-S284 PolarHBondContact O-N 3.35Å; N282-Q285 PolarHBondContact O-N 2.96Å; N282-V286 WeakPolarHBondContact O-CG2 3.42Å; N282-V286 PolarHBondContact O-N 3.36Å |
| 283 | S | 61 | Low | 67.1 | Low | 67 Ų | 67 | 93.6 Ų | 93.6 | 47% | 0.469 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -65.5 | -36.6 | 176.6 | 62 | 0 | 0 | 0 | 0 | 112.6 | Q279 T280 S287 | Q279-S283 PolarHBondContact O-N 2.72Å; Q279-S283 PolarHBondContact O-OG 2.95Å; T280-S283 PolarHBondContact O-OG 3.03Å; S283-S287 WeakPolarHBondContact O-CB 3.46Å; S283-S287 PolarHBondContact O-N 3.03Å; S283-S287 PolarHBondContact O-OG 3.3Å |
| 284 | S | 62.6 | Low | 66.2 | Low | 53 Ų | 53 | 95.3 Ų | 95.3 | 37% | 0.371 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -70.6 | -40.6 | 175 | 59 | 0 | 0 | 0 | 0 | 112.1 | T280 S281 N282 S287 F288 | T280-S284 WeakPolarHBondContact O-CB 3.35Å; T280-S284 PolarHBondContact O-N 3.33Å; T280-S284 VanDerWaalsContact O-N 3.17Å; T280-S284 PolarHBondContact O-OG 2.95Å; S281-S284 PolarHBondContact O-OG 2.97Å; N282-S284 VanDerWaalsContact C-N 3.34Å; N282-S284 PolarHBondContact O-N 3.35Å; S284-S287 WeakPolarHBondContact O-CB 3.21Å; S284-S287 PolarHBondContact O-N 3.47Å; S284-F288 WeakPolarHBondContact O-CD2 3.37Å; S284-F288 PolarHBondContact O-N 3.27Å |
| 285 | Q | 57 | Low | 65.3 | Low | 127 Ų | 127 | 100.3 Ų | 100.3 | 59% | 0.593 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -59.8 | -49 | 172.4 | -79 | -176 | -22.2 | 0 | 0 | 112.4 | S281 N282 S287 F288 E289 | S281-Q285 WeakPolarHBondContact O-CB 3.38Å; S281-Q285 WeakPolarHBondContact O-CG 3.44Å; S281-Q285 PolarHBondContact O-N 3.15Å; N282-Q285 PolarHBondContact O-N 2.96Å; Q285-S287 VanDerWaalsContact C-N 3.27Å; Q285-S287 PolarHBondContact O-N 2.98Å; Q285-F288 PolarHBondContact O-N 2.93Å; Q285-F288 VanDerWaalsContact O-N 3.08Å; Q285-E289 PolarHBondContact O-N 2.9Å |
| 286 | V | 65.3 | Low | 64.4 | Low | 92 Ų | 92 | 102.6 Ų | 102.6 | 56% | 0.558 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -58.6 | -40.3 | 175.9 | 171.1 | 0 | 0 | 0 | 0 | 111.2 | N282 F288 E289 V290 | N282-V286 WeakPolarHBondContact O-CG2 3.42Å; N282-V286 PolarHBondContact O-N 3.36Å; V286-F288 PolarHBondContact O-N 3Å; V286-E289 PolarHBondContact O-N 3.08Å; V286-V290 WeakPolarHBondContact O-CG2 3.28Å; V286-V290 PolarHBondContact O-N 3Å |
| 287 | S | 61.1 | Low | 63.6 | Low | 68 Ų | 68 | 105 Ų | 105 | 48% | 0.476 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -62.7 | -40.5 | 175.5 | -57.3 | 0 | 0 | 0 | 0 | 112.4 | S283 S284 Q285 L291 | S283-S287 WeakPolarHBondContact O-CB 3.46Å; S283-S287 PolarHBondContact O-N 3.03Å; S283-S287 PolarHBondContact O-OG 3.3Å; S284-S287 WeakPolarHBondContact O-CB 3.21Å; S284-S287 PolarHBondContact O-N 3.47Å; Q285-S287 VanDerWaalsContact C-N 3.27Å; Q285-S287 PolarHBondContact O-N 2.98Å; S287-L291 WeakPolarHBondContact O-CB 3.38Å; S287-L291 VanDerWaalsContact O-CG 3.3Å; S287-L291 WeakPolarHBondContact O-CG 3.3Å; S287-L291 PolarHBondContact O-N 3.11Å |
| 288 | F | 66.9 | Low | 62.7 | Low | 148 Ų | 148 | 107.9 Ų | 107.9 | 65% | 0.649 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -67.3 | -37.6 | 174.7 | -83.5 | -66 | 0 | 0 | 0 | 112.9 | S284 Q285 V286 L291 K292 | S284-F288 WeakPolarHBondContact O-CD2 3.37Å; S284-F288 PolarHBondContact O-N 3.27Å; Q285-F288 PolarHBondContact O-N 2.93Å; Q285-F288 VanDerWaalsContact O-N 3.08Å; V286-F288 PolarHBondContact O-N 3Å; F288-L291 PolarHBondContact O-N 2.99Å; F288-K292 VanDerWaalsContact O-CB 3.28Å; F288-K292 WeakPolarHBondContact O-CB 3.45Å; F288-K292 PolarHBondContact O-N 3.48Å |
| 289 | E | 64.4 | Low | 62.5 | Low | 144 Ų | 144 | 110.1 Ų | 110.1 | 67% | 0.673 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -67.9 | -41.2 | 176 | -66.3 | -146 | 130.1 | 0 | 0 | 112.4 | Q285 V286 K292 S293 | Q285-E289 PolarHBondContact O-N 2.9Å; V286-E289 PolarHBondContact O-N 3.08Å; E289-K292 PolarHBondContact O-N 2.83Å; E289-S293 WeakPolarHBondContact O-CB 3.42Å; E289-S293 PolarHBondContact O-N 3.24Å |
| 290 | V | 68.7 | Low | 62.5 | Low | 80 Ų | 80 | 108.7 Ų | 108.7 | 49% | 0.485 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -61.5 | -44.7 | 173.5 | 171.4 | 0 | 0 | 0 | 0 | 111.2 | V286 K292 S293 N294 | V286-V290 WeakPolarHBondContact O-CG2 3.28Å; V286-V290 PolarHBondContact O-N 3Å; V290-K292 VanDerWaalsContact C-N 3.33Å; V290-K292 PolarHBondContact O-N 3.43Å; V290-S293 PolarHBondContact O-N 3.21Å; V290-N294 PolarHBondContact O-N 3.06Å |
| 291 | L | 67.7 | Low | 62.4 | Low | 107 Ų | 107 | 109.9 Ų | 109.9 | 56% | 0.56 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -63.7 | -36.5 | 175.4 | -74.4 | 169.7 | 0 | 0 | 0 | 112.7 | S287 F288 K295 | S287-L291 WeakPolarHBondContact O-CB 3.38Å; S287-L291 VanDerWaalsContact O-CG 3.3Å; S287-L291 WeakPolarHBondContact O-CG 3.3Å; S287-L291 PolarHBondContact O-N 3.11Å; F288-L291 PolarHBondContact O-N 2.99Å; L291-K295 PolarHBondContact O-N 3.34Å |
| 292 | K | 70.3 | Confident | 62.5 | Low | 145 Ų | 145 | 113.6 Ų | 113.6 | 63% | 0.63 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -70 | -39.5 | 176.1 | -173.2 | -179.8 | 177.2 | -172.8 | 0 | 111.9 | F288 E289 V290 K295 L296 | F288-K292 VanDerWaalsContact O-CB 3.28Å; F288-K292 WeakPolarHBondContact O-CB 3.45Å; F288-K292 PolarHBondContact O-N 3.48Å; E289-K292 PolarHBondContact O-N 2.83Å; V290-K292 VanDerWaalsContact C-N 3.33Å; V290-K292 PolarHBondContact O-N 3.43Å; K292-K295 PolarHBondContact O-N 3.36Å; K292-L296 PolarHBondContact O-N 3.45Å |
| 293 | S | 66.7 | Low | 62.6 | Low | 67 Ų | 67 | 115.3 Ų | 115.3 | 47% | 0.469 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -66.2 | -43.3 | 176.5 | -174.3 | 0 | 0 | 0 | 0 | 111.7 | E289 V290 K295 L296 | E289-S293 WeakPolarHBondContact O-CB 3.42Å; E289-S293 PolarHBondContact O-N 3.24Å; V290-S293 PolarHBondContact O-N 3.21Å; S293-K295 VanDerWaalsContact C-N 3.28Å; S293-K295 PolarHBondContact O-N 3.2Å; S293-L296 PolarHBondContact O-N 3.36Å |
| 294 | N | 62 | Low | 62.7 | Low | 93 Ų | 93 | 118.5 Ų | 118.5 | 50% | 0.497 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -63.6 | -32.1 | 175.2 | -75.1 | -13.3 | 0 | 0 | 0 | 112.9 | V290 L296 L297 | V290-N294 PolarHBondContact O-N 3.06Å; N294-L296 PolarHBondContact O-N 3.35Å; N294-L297 PolarHBondContact O-N 3.31Å |
| 295 | K | 61.8 | Low | 62.7 | Low | 168 Ų | 168 | 123.1 Ų | 123.1 | 73% | 0.73 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.8 | -5.7 | 173.6 | -81.8 | -167.3 | 174.2 | -170.3 | 0 | 115.1 | L291 K292 S293 | L291-K295 PolarHBondContact O-N 3.34Å; K292-K295 PolarHBondContact O-N 3.36Å; S293-K295 VanDerWaalsContact C-N 3.28Å; S293-K295 PolarHBondContact O-N 3.2Å |
| 296 | L | 58.7 | Low | 63.1 | Low | 138 Ų | 138 | 122.8 Ų | 122.8 | 72% | 0.723 | 64% | 0.636 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103 | 6.1 | 172.7 | -69.9 | 168.5 | 0 | 0 | 0 | 112.4 | K292 S293 N294 | K292-L296 PolarHBondContact O-N 3.45Å; S293-L296 PolarHBondContact O-N 3.36Å; N294-L296 PolarHBondContact O-N 3.35Å |
| 297 | L | 55.6 | Low | 62.9 | Low | 134 Ų | 134 | 125.4 Ų | 125.4 | 70% | 0.702 | 64% | 0.642 | S | S | * | * | trans | -116.7 | 16.9 | 177.9 | -63.8 | 173.9 | 0 | 0 | 0 | 112.3 | N294 | N294-L297 PolarHBondContact O-N 3.31Š| ||
| 298 | L | 50.9 | Low | 63.1 | Low | 213 Ų | 213 | 130.6 Ų | 130.6 | 100% | 1.115 | 66% | 0.658 | S | S | * | * | trans | -130.6 | 0 | 176.3 | -67.8 | 175.2 | 0 | 0 | 0 | 109.5 |
Retrieved 298 of 298 residues in 618.3 ms
(Link to these results)