| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 47.9 | Very low | 50.6 | Low | 243 Ų | 243 | 138.2 Ų | 138.2 | 100% | 1.197 | 83% | 0.825 | S | S | * | * | 0 | 121.9 | 0 | -90.1 | 163 | 154.4 | 0 | 0 | 105.1 | |||||
| 2 | E | 41.7 | Very low | 51.4 | Low | 195 Ų | 195 | 129.8 Ų | 129.8 | 91% | 0.911 | 79% | 0.788 | S | S | * | * | cis | -148.5 | 164.4 | 49.1 | -74.7 | -176.6 | 88.9 | 0 | 0 | 113.2 | ||||
| 3 | R | 50.8 | Low | 52.8 | Low | 247 Ų | 247 | 123.8 Ų | 123.8 | 93% | 0.932 | 76% | 0.761 | S | S | * | * | trans | -88.4 | 142.2 | -176.4 | -64.8 | 175.4 | -177.1 | 172.9 | 1.1 | 112 | ||||
| 4 | G | 49.4 | Very low | 54.4 | Low | 75 Ų | 75 | 117.2 Ų | 117.2 | 77% | 0.773 | 73% | 0.73 | S | S | * | * | trans | 78 | 163 | 141 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 5 | P | 52 | Low | 56 | Low | 117 Ų | 117 | 112.7 Ų | 112.7 | 76% | 0.76 | 71% | 0.709 | S | S | * | * | cis | -127.6 | 147.1 | 20.6 | 37 | -20 | 0 | 0 | 0 | 116.3 | V7 | P5-V7 HydrophobicContact CB-CG2 4.35Š| ||
| 6 | V | 53.2 | Low | 57.7 | Low | 144 Ų | 144 | 117.5 Ų | 117.5 | 87% | 0.873 | 71% | 0.709 | S | S | * | * | trans | -87.7 | 102.1 | 162.3 | 173.9 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 7 | V | 53.6 | Low | 59.2 | Low | 134 Ų | 134 | 117.2 Ų | 117.2 | 81% | 0.812 | 70% | 0.701 | S | S | * | * | trans | -140.9 | 106 | 169.5 | 179.5 | 0 | 0 | 0 | 0 | 107.7 | P5 | P5-V7 HydrophobicContact CB-CG2 4.35Š| ||
| 8 | G | 51 | Low | 60.8 | Low | 60 Ų | 60 | 120.9 Ų | 120.9 | 62% | 0.619 | 70% | 0.701 | S | S | * | * | S | Bend | trans | 178.8 | -25.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||
| 9 | A | 51.8 | Low | 62.2 | Low | 93 Ų | 93 | 118.1 Ų | 118.1 | 77% | 0.769 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -82.5 | -16.5 | -172.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||
| 10 | G | 50.9 | Low | 63.6 | Low | 64 Ų | 64 | 118.3 Ų | 118.3 | 66% | 0.66 | 69% | 0.69 | S | S | * | * | H | α-helix | trans | -81.8 | -26.8 | -171.5 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||
| 11 | L | 54.3 | Low | 64.9 | Low | 148 Ų | 148 | 117.6 Ų | 117.6 | 78% | 0.775 | 68% | 0.684 | S | S | * | * | H | α-helix | trans | -75.2 | -32.3 | -174.4 | -87.8 | 130 | 0 | 0 | 0 | 113.4 | A15 | L11-A15 PolarHBondContact O-N 3.04Å |
| 12 | G | 60.5 | Low | 67 | Low | 37 Ų | 37 | 107.6 Ų | 107.6 | 38% | 0.381 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -74.9 | -34.2 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114 | A15 R16 | G12-A15 PolarHBondContact O-N 3.38Å; G12-R16 WeakPolarHBondContact O-CG 3.41Å; G12-R16 PolarHBondContact O-N 2.87Å |
| 13 | A | 69.1 | Low | 69.4 | Low | 53 Ų | 53 | 101.8 Ų | 101.8 | 44% | 0.438 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -67.5 | -45.7 | 179.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | A15 R16 I17 | A13-A15 VanDerWaalsContact C-N 3.33Å; A13-A15 PolarHBondContact O-N 3.4Å; A13-R16 PolarHBondContact O-N 2.97Å; A13-I17 WeakPolarHBondContact O-CB 3.23Å; A13-I17 VanDerWaalsContact O-CG1 3.24Å; A13-I17 WeakPolarHBondContact O-CG1 3.48Å; A13-I17 PolarHBondContact O-N 3.19Å |
| 14 | G | 75.6 | Confident | 71.5 | Confident | 31 Ų | 31 | 95.3 Ų | 95.3 | 32% | 0.32 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -65.6 | -31.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | R18 | G14-R18 WeakPolarHBondContact O-CB 3.48Å; G14-R18 WeakPolarHBondContact O-CG 3.48Å; G14-R18 PolarHBondContact O-N 3.25Å; G14-R18 VanDerWaalsContact O-N 3.11Å; G14-R18 PolarHBondContact O-NE 2.94Å |
| 15 | A | 78.9 | Confident | 73.6 | Confident | 50 Ų | 50 | 95 Ų | 95 | 41% | 0.413 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -70.4 | -43.2 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | L11 G12 A13 R18 A19 | L11-A15 PolarHBondContact O-N 3.04Å; G12-A15 PolarHBondContact O-N 3.38Å; A13-A15 VanDerWaalsContact C-N 3.33Å; A13-A15 PolarHBondContact O-N 3.4Å; A15-R18 PolarHBondContact O-N 2.03Å; A15-A19 WeakPolarHBondContact O-CB 3.45Å; A15-A19 PolarHBondContact O-N 3.08Å |
| 16 | R | 82.7 | Confident | 75.5 | Confident | 189 Ų | 189 | 96.8 Ų | 96.8 | 71% | 0.713 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -64 | -42.2 | 174.8 | -73.9 | 179.9 | -164.6 | 178.7 | 5 | 112.3 | G12 A13 A19 L20 | G12-R16 WeakPolarHBondContact O-CG 3.41Å; G12-R16 PolarHBondContact O-N 2.87Å; A13-R16 PolarHBondContact O-N 2.97Å; R16-A19 PolarHBondContact O-N 2.9Å; R16-L20 WeakPolarHBondContact O-CB 2.99Å; R16-L20 VanDerWaalsContact O-CG 3.3Å; R16-L20 WeakPolarHBondContact O-CG 3.42Å; R16-L20 PolarHBondContact O-N 3.42Å |
| 17 | I | 83.8 | Confident | 77.5 | Confident | 112 Ų | 112 | 94 Ų | 94 | 57% | 0.574 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -62.4 | -44.2 | 176.5 | -68 | 165 | 0 | 0 | 0 | 110.5 | A13 A19 L20 L21 | A13-I17 WeakPolarHBondContact O-CB 3.23Å; A13-I17 VanDerWaalsContact O-CG1 3.24Å; A13-I17 WeakPolarHBondContact O-CG1 3.48Å; A13-I17 PolarHBondContact O-N 3.19Å; I17-A19 PolarHBondContact O-N 3.44Å; I17-L20 PolarHBondContact O-N 3.08Å; I17-L21 VanDerWaalsContact O-CB 3.27Å; I17-L21 WeakPolarHBondContact O-CB 2.98Å; I17-L21 PolarHBondContact O-N 3.5Å |
| 18 | R | 87.1 | Confident | 79.3 | Confident | 184 Ų | 184 | 93.1 Ų | 93.1 | 69% | 0.694 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -63.2 | -38.8 | 175.1 | -79.4 | -175.8 | -72.9 | -165.8 | 0.6 | 112.8 | G14 A15 G22 | G14-R18 WeakPolarHBondContact O-CB 3.48Å; G14-R18 WeakPolarHBondContact O-CG 3.48Å; G14-R18 PolarHBondContact O-N 3.25Å; G14-R18 VanDerWaalsContact O-N 3.11Å; G14-R18 PolarHBondContact O-NE 2.94Å; A15-R18 PolarHBondContact O-N 2.03Å; R18-G22 PolarHBondContact O-N 2.88Å |
| 19 | A | 87.9 | Confident | 81.3 | Confident | 67 Ų | 67 | 95.4 Ų | 95.4 | 55% | 0.554 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -67.4 | -43 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | A15 R16 I17 G22 C23 | A15-A19 WeakPolarHBondContact O-CB 3.45Å; A15-A19 PolarHBondContact O-N 3.08Å; R16-A19 PolarHBondContact O-N 2.9Å; I17-A19 PolarHBondContact O-N 3.44Å; A19-G22 PolarHBondContact O-N 2.97Å; A19-C23 WeakPolarHBondContact O-CB 3.49Å; A19-C23 PolarHBondContact O-N 3.48Å |
| 20 | L | 89.3 | Confident | 83.3 | Confident | 122 Ų | 122 | 99.8 Ų | 99.8 | 64% | 0.639 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -64.5 | -44.3 | 175.4 | -73.2 | 171.8 | 0 | 0 | 0 | 111.5 | R16 I17 G22 C23 L24 | R16-L20 WeakPolarHBondContact O-CB 2.99Å; R16-L20 VanDerWaalsContact O-CG 3.3Å; R16-L20 WeakPolarHBondContact O-CG 3.42Å; R16-L20 PolarHBondContact O-N 3.42Å; I17-L20 PolarHBondContact O-N 3.08Å; L20-G22 VanDerWaalsContact C-N 3.35Å; L20-C23 PolarHBondContact O-N 3.39Å; L20-L24 WeakPolarHBondContact O-CB 3.43Å; L20-L24 PolarHBondContact O-N 3.45Å |
| 21 | L | 91.4 | Very high | 85.3 | Confident | 105 Ų | 105 | 99.6 Ų | 99.6 | 55% | 0.55 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -62.2 | -43.7 | 175 | -172.4 | 68.7 | 0 | 0 | 0 | 111 | I17 C23 L24 V25 | I17-L21 VanDerWaalsContact O-CB 3.27Å; I17-L21 WeakPolarHBondContact O-CB 2.98Å; I17-L21 PolarHBondContact O-N 3.5Å; L21-C23 VanDerWaalsContact C-N 3.35Å; L21-C23 PolarHBondContact O-N 3.09Å; L21-L24 PolarHBondContact O-N 3.36Å; L21-V25 WeakPolarHBondContact O-CB 3.25Å; L21-V25 VanDerWaalsContact O-CG2 3.25Å; L21-V25 WeakPolarHBondContact O-CG2 3.31Å; L21-V25 PolarHBondContact O-N 3.47Å |
| 22 | G | 91.4 | Very high | 87.1 | Confident | 32 Ų | 32 | 95 Ų | 95 | 33% | 0.33 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.9 | -39.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113 | R18 A19 L20 K26 | R18-G22 PolarHBondContact O-N 2.88Å; A19-G22 PolarHBondContact O-N 2.97Å; L20-G22 VanDerWaalsContact C-N 3.35Å; G22-K26 VanDerWaalsContact O-CG 3.29Å; G22-K26 WeakPolarHBondContact O-CG 3.43Å; G22-K26 PolarHBondContact O-N 3.33Å |
| 23 | C | 93 | Very high | 88.6 | Confident | 73 Ų | 73 | 96 Ų | 96 | 49% | 0.493 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64.8 | -47.9 | 173.8 | -171.5 | 0 | 0 | 0 | 0 | 111.1 | A19 L20 L21 V25 K26 V27 | A19-C23 WeakPolarHBondContact O-CB 3.49Å; A19-C23 PolarHBondContact O-N 3.48Å; L20-C23 PolarHBondContact O-N 3.39Å; L21-C23 VanDerWaalsContact C-N 3.35Å; L21-C23 PolarHBondContact O-N 3.09Å; C23-V25 PolarHBondContact O-N 2.65Å; C23-K26 WeakPolarHBondContact O-CB 3.4Å; C23-K26 PolarHBondContact O-N 2.93Å; C23-K26 VanDerWaalsContact O-N 3.16Å; C23-V27 WeakPolarHBondContact O-CG2 3.25Å; C23-V27 PolarHBondContact O-N 3.24Å |
| 24 | L | 93.8 | Very high | 89.7 | Confident | 111 Ų | 111 | 95.5 Ų | 95.5 | 58% | 0.581 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -61 | -42.5 | 178.6 | -175.5 | 134 | 0 | 0 | 0 | 111.9 | L20 L21 V27 L28 | L20-L24 WeakPolarHBondContact O-CB 3.43Å; L20-L24 PolarHBondContact O-N 3.45Å; L21-L24 PolarHBondContact O-N 3.36Å; L24-V27 PolarHBondContact O-N 3.03Å; L24-L28 WeakPolarHBondContact O-CB 3.4Å; L24-L28 PolarHBondContact O-N 2.88Å |
| 25 | V | 93.5 | Very high | 90.5 | Very high | 68 Ų | 68 | 99.4 Ų | 99.4 | 41% | 0.412 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -62.3 | -43.3 | 174.7 | 170 | 0 | 0 | 0 | 0 | 111.1 | L21 C23 L28 L29 | L21-V25 WeakPolarHBondContact O-CB 3.25Å; L21-V25 VanDerWaalsContact O-CG2 3.25Å; L21-V25 WeakPolarHBondContact O-CG2 3.31Å; L21-V25 PolarHBondContact O-N 3.47Å; C23-V25 PolarHBondContact O-N 2.65Å; V25-L28 PolarHBondContact O-N 3.32Å; V25-L29 HydrophobicContact CG1-CD1 3.87Å; V25-L29 HydrophobicContact CG1-CG 4.34Å; V25-L29 WeakPolarHBondContact O-CB 3.38Å; V25-L29 VanDerWaalsContact O-CG 3.26Å; V25-L29 WeakPolarHBondContact O-CG 3.35Å; V25-L29 PolarHBondContact O-N 2.92Å |
| 26 | K | 92.9 | Very high | 91.2 | Very high | 156 Ų | 156 | 98.5 Ų | 98.5 | 68% | 0.678 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -62.3 | -44.2 | 176.3 | -75.4 | 174.8 | -177.9 | -178.3 | 0 | 112.1 | G22 C23 L29 W30 | G22-K26 VanDerWaalsContact O-CG 3.29Å; G22-K26 WeakPolarHBondContact O-CG 3.43Å; G22-K26 PolarHBondContact O-N 3.33Å; C23-K26 WeakPolarHBondContact O-CB 3.4Å; C23-K26 PolarHBondContact O-N 2.93Å; C23-K26 VanDerWaalsContact O-N 3.16Å; K26-L29 PolarHBondContact O-N 3.25Å; K26-W30 WeakPolarHBondContact O-CB 3.36Å; K26-W30 PolarHBondContact O-N 3.08Å |
| 27 | V | 93.9 | Very high | 91.7 | Very high | 84 Ų | 84 | 94 Ų | 94 | 51% | 0.509 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.7 | -46.3 | 176.5 | 172.6 | 0 | 0 | 0 | 0 | 110.3 | C23 L24 L29 W30 V31 | C23-V27 WeakPolarHBondContact O-CG2 3.25Å; C23-V27 PolarHBondContact O-N 3.24Å; L24-V27 PolarHBondContact O-N 3.03Å; V27-L29 PolarHBondContact O-N 3.44Å; V27-W30 PolarHBondContact O-N 3.14Å; V27-V31 HydrophobicContact CG1-CG2 4.34Å; V27-V31 WeakPolarHBondContact O-CG2 3.33Å; V27-V31 PolarHBondContact O-N 3.04Å |
| 28 | L | 93.3 | Very high | 92.2 | Very high | 116 Ų | 116 | 95 Ų | 95 | 61% | 0.607 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -60.9 | -43.6 | 178.2 | -173.3 | 69.5 | 0 | 0 | 0 | 111.8 | L24 V25 V31 A32 | L24-L28 WeakPolarHBondContact O-CB 3.4Å; L24-L28 PolarHBondContact O-N 2.88Å; V25-L28 PolarHBondContact O-N 3.32Å; L28-V31 PolarHBondContact O-N 3.1Å; L28-A32 VanDerWaalsContact O-CB 3.25Å; L28-A32 WeakPolarHBondContact O-CB 3.42Å; L28-A32 PolarHBondContact O-N 3.11Å |
| 29 | L | 92.3 | Very high | 92.4 | Very high | 108 Ų | 108 | 87.5 Ų | 87.5 | 57% | 0.565 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -64.7 | -38.8 | 176.3 | -74.3 | 171.7 | 0 | 0 | 0 | 112.2 | V25 K26 V27 S33 | V25-L29 HydrophobicContact CG1-CD1 3.87Å; V25-L29 HydrophobicContact CG1-CG 4.34Å; V25-L29 WeakPolarHBondContact O-CB 3.38Å; V25-L29 VanDerWaalsContact O-CG 3.26Å; V25-L29 WeakPolarHBondContact O-CG 3.35Å; V25-L29 PolarHBondContact O-N 2.92Å; K26-L29 PolarHBondContact O-N 3.25Å; V27-L29 PolarHBondContact O-N 3.44Å; L29-S33 VanDerWaalsContact O-CB 3.31Å; L29-S33 WeakPolarHBondContact O-CB 3.33Å; L29-S33 PolarHBondContact O-N 2.82Å; L29-S33 PolarHBondContact O-OG 3.02Å |
| 30 | W | 93.4 | Very high | 92.7 | Very high | 186 Ų | 186 | 84.3 Ų | 84.3 | 71% | 0.705 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -65.6 | -47.2 | 175.6 | -178 | 86.6 | 0 | 0 | 0 | 111.3 | K26 V27 A32 S33 A34 | K26-W30 WeakPolarHBondContact O-CB 3.36Å; K26-W30 PolarHBondContact O-N 3.08Å; V27-W30 PolarHBondContact O-N 3.14Å; W30-A32 PolarHBondContact O-N 2.83Å; W30-S33 PolarHBondContact O-N 2.99Å; W30-A34 WeakPolarHBondContact O-CB 3.5Å; W30-A34 PolarHBondContact O-N 2.96Å |
| 31 | V | 93.4 | Very high | 92.9 | Very high | 59 Ų | 59 | 81.4 Ų | 81.4 | 36% | 0.358 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -60.9 | -46.4 | 176.1 | 172.3 | 0 | 0 | 0 | 0 | 110.7 | V27 L28 S33 A34 L35 | V27-V31 HydrophobicContact CG1-CG2 4.34Å; V27-V31 WeakPolarHBondContact O-CG2 3.33Å; V27-V31 PolarHBondContact O-N 3.04Å; L28-V31 PolarHBondContact O-N 3.1Å; V31-S33 VanDerWaalsContact C-N 3.3Å; V31-S33 PolarHBondContact O-N 3.22Å; V31-A34 PolarHBondContact O-N 3.43Å; V31-L35 HydrophobicContact CG1-CD1 3.94Å; V31-L35 HydrophobicContact CG1-CG 4.34Å; V31-L35 WeakPolarHBondContact O-CB 3.49Å; V31-L35 WeakPolarHBondContact O-CG 3.49Å; V31-L35 PolarHBondContact O-N 2.9Å |
| 32 | A | 91.5 | Very high | 93 | Very high | 52 Ų | 52 | 79.9 Ų | 79.9 | 43% | 0.43 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -60.3 | -40.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | L28 W30 L36 | L28-A32 VanDerWaalsContact O-CB 3.25Å; L28-A32 WeakPolarHBondContact O-CB 3.42Å; L28-A32 PolarHBondContact O-N 3.11Å; W30-A32 PolarHBondContact O-N 2.83Å; A32-L36 VanDerWaalsContact O-CB 3.29Å; A32-L36 WeakPolarHBondContact O-CB 3.28Å; A32-L36 PolarHBondContact O-N 3.18Å |
| 33 | S | 92.1 | Very high | 93.2 | Very high | 57 Ų | 57 | 79.2 Ų | 79.2 | 40% | 0.399 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -65.7 | -45.9 | 175 | -59.6 | 0 | 0 | 0 | 0 | 111.2 | L29 W30 V31 L35 L36 Y37 | L29-S33 VanDerWaalsContact O-CB 3.31Å; L29-S33 WeakPolarHBondContact O-CB 3.33Å; L29-S33 PolarHBondContact O-N 2.82Å; L29-S33 PolarHBondContact O-OG 3.02Å; W30-S33 PolarHBondContact O-N 2.99Å; V31-S33 VanDerWaalsContact C-N 3.3Å; V31-S33 PolarHBondContact O-N 3.22Å; S33-L35 VanDerWaalsContact C-N 3.34Å; S33-L35 PolarHBondContact O-N 3.21Å; S33-L36 WeakPolarHBondContact O-CB 3.03Å; S33-L36 PolarHBondContact O-N 3.49Å; S33-Y37 WeakPolarHBondContact O-CD2 3.48Å; S33-Y37 PolarHBondContact O-N 3.34Å |
| 34 | A | 92.2 | Very high | 93.2 | Very high | 43 Ų | 43 | 75.7 Ų | 75.7 | 36% | 0.355 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -58.8 | -45.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | W30 V31 Y37 F38 | W30-A34 WeakPolarHBondContact O-CB 3.5Å; W30-A34 PolarHBondContact O-N 2.96Å; V31-A34 PolarHBondContact O-N 3.43Å; A34-Y37 PolarHBondContact O-N 3.24Å; A34-F38 VanDerWaalsContact O-CB 3.26Å; A34-F38 WeakPolarHBondContact O-CB 3.47Å; A34-F38 PolarHBondContact O-N 3.46Å |
| 35 | L | 93.4 | Very high | 93.1 | Very high | 114 Ų | 114 | 78 Ų | 78 | 60% | 0.597 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -64 | -41 | 176.3 | -70.8 | 174.4 | 0 | 0 | 0 | 112.4 | V31 S33 Y37 G39 | V31-L35 HydrophobicContact CG1-CD1 3.94Å; V31-L35 HydrophobicContact CG1-CG 4.34Å; V31-L35 WeakPolarHBondContact O-CB 3.49Å; V31-L35 WeakPolarHBondContact O-CG 3.49Å; V31-L35 PolarHBondContact O-N 2.9Å; S33-L35 VanDerWaalsContact C-N 3.34Å; S33-L35 PolarHBondContact O-N 3.21Å; L35-Y37 VanDerWaalsContact C-N 3.34Å; L35-Y37 PolarHBondContact O-N 3.49Å; L35-G39 WeakPolarHBondContact O-CA 3.28Å; L35-G39 PolarHBondContact O-N 2.88Å |
| 36 | L | 93.9 | Very high | 93.1 | Very high | 30 Ų | 30 | 79.8 Ų | 79.8 | 16% | 0.157 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -60.1 | -46.6 | 175.4 | 178.5 | 71.8 | 0 | 0 | 0 | 110.8 | A32 S33 S40 A216 R219 L220 L223 | A32-L36 VanDerWaalsContact O-CB 3.29Å; A32-L36 WeakPolarHBondContact O-CB 3.28Å; A32-L36 PolarHBondContact O-N 3.18Å; S33-L36 WeakPolarHBondContact O-CB 3.03Å; S33-L36 PolarHBondContact O-N 3.49Å; L36-S40 VanDerWaalsContact O-CB 3.23Å; L36-S40 WeakPolarHBondContact O-CB 3.34Å; L36-S40 PolarHBondContact O-N 3.17Å; L36-S40 PolarHBondContact O-OG 3.05Å; L36-A216 HydrophobicContact CD2-CB 4.03Å; L36-R219 HydrophobicContact CD1-CB 4.29Å; L36-R219 HydrophobicContact CD2-CB 4.34Å; L36-R219 HydrophobicContact CG-CB 4.11Å; L36-L220 HydrophobicContact CD1-CB 4.39Å; L36-L220 HydrophobicContact CD1-CD1 4.4Å; L36-L223 HydrophobicContact CD1-CD1 3.64Å |
| 37 | Y | 93 | Very high | 93 | Very high | 94 Ų | 94 | 73.6 Ų | 73.6 | 37% | 0.369 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -69.3 | -48.3 | -177.2 | -82.2 | -116.9 | 0 | 0 | 0 | 111.2 | S33 A34 L35 S40 E41 R219 | S33-Y37 WeakPolarHBondContact O-CD2 3.48Å; S33-Y37 PolarHBondContact O-N 3.34Å; A34-Y37 PolarHBondContact O-N 3.24Å; L35-Y37 VanDerWaalsContact C-N 3.34Å; L35-Y37 PolarHBondContact O-N 3.49Å; Y37-S40 PolarHBondContact O-OG 3Å; Y37-E41 WeakPolarHBondContact O-CB 3.45Å; Y37-E41 PolarHBondContact O-N 3.27Å; Y37-R219 VanDerWaalsContact CD1-NH2 3.33Å; Y37-R219 PolarHBondContact O-NH1 2.92Å |
| 38 | F | 93.7 | Very high | 92.7 | Very high | 134 Ų | 134 | 70.8 Ų | 70.8 | 59% | 0.588 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -61.3 | -50 | 176.9 | -178.4 | -102.2 | 0 | 0 | 0 | 111.8 | A34 S40 E41 Q42 | A34-F38 VanDerWaalsContact O-CB 3.26Å; A34-F38 WeakPolarHBondContact O-CB 3.47Å; A34-F38 PolarHBondContact O-N 3.46Å; F38-S40 PolarHBondContact O-N 2.86Å; F38-E41 PolarHBondContact O-N 3Å; F38-Q42 HydrophobicContact CD1-CG 4.33Å; F38-Q42 HydrophobicContact CD2-CG 4.3Å; F38-Q42 HydrophobicContact CE1-CG 4.01Å; F38-Q42 HydrophobicContact CE2-CG 3.98Å; F38-Q42 HydrophobicContact CG-CG 4.48Å; F38-Q42 HydrophobicContact CZ-CG 3.82Å; F38-Q42 VanDerWaalsContact O-CG 3.29Å; F38-Q42 WeakPolarHBondContact O-CG 3.47Å; F38-Q42 PolarHBondContact O-N 2.89Å |
| 39 | G | 92.1 | Very high | 92.7 | Very high | 26 Ų | 26 | 67 Ų | 67 | 27% | 0.268 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -61.2 | -43.9 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | L35 A43 | L35-G39 WeakPolarHBondContact O-CA 3.28Å; L35-G39 PolarHBondContact O-N 2.88Å; G39-A43 VanDerWaalsContact O-CB 3.25Å; G39-A43 WeakPolarHBondContact O-CB 3.27Å; G39-A43 PolarHBondContact O-N 3.4Å |
| 40 | S | 93.9 | Very high | 92.4 | Very high | 0 Ų | 0 | 65.9 Ų | 65.9 | 0% | 0 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -64.9 | -39.5 | 177.3 | 57.2 | 0 | 0 | 0 | 0 | 112.7 | L36 Y37 F38 A44 R219 F222 | L36-S40 VanDerWaalsContact O-CB 3.23Å; L36-S40 WeakPolarHBondContact O-CB 3.34Å; L36-S40 PolarHBondContact O-N 3.17Å; L36-S40 PolarHBondContact O-OG 3.05Å; Y37-S40 PolarHBondContact O-OG 3Å; F38-S40 PolarHBondContact O-N 2.86Å; S40-A44 WeakPolarHBondContact O-CB 3.44Å; S40-A44 PolarHBondContact O-N 3.4Å; S40-R219 WeakPolarHBondContact OG-CD 3.5Å; S40-R219 PolarHBondContact OG-NH1 3.35Å; S40-R219 VanDerWaalsContact OG-NH1 3.08Å; S40-F222 WeakPolarHBondContact O-CE1 3.49Å |
| 41 | E | 92.9 | Very high | 92.3 | Very high | 62 Ų | 62 | 61.1 Ų | 61.1 | 29% | 0.29 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -67.6 | -44.5 | 177.5 | -82.9 | 174.7 | -147.7 | 0 | 0 | 112.7 | Y37 F38 A44 R45 L208 R219 | Y37-E41 WeakPolarHBondContact O-CB 3.45Å; Y37-E41 PolarHBondContact O-N 3.27Å; F38-E41 PolarHBondContact O-N 3Å; E41-A44 PolarHBondContact O-N 3.42Å; E41-R45 WeakPolarHBondContact O-CB 3.31Å; E41-R45 VanDerWaalsContact O-CG 3.29Å; E41-R45 WeakPolarHBondContact O-CG 3.4Å; E41-R45 PolarHBondContact O-N 3.43Å; E41-L208 HydrophobicContact CG-CD1 4.04Å; E41-R219 IonicContact OE1-CZ 3.51Å; E41-R219 IonicContact OE1-NH1 3.02Å; E41-R219 PolarHBondContact OE1-NH1 3.24Å; E41-R219 IonicContact OE1-NH2 2.97Å; E41-R219 PolarHBondContact OE1-NH2 3.41Å |
| 42 | Q | 94.4 | Very high | 92.1 | Very high | 73 Ų | 73 | 61.3 Ų | 61.3 | 34% | 0.341 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -65.5 | -45.3 | 178.4 | -63.7 | -59.6 | 93.3 | 0 | 0 | 110.9 | F38 A44 R45 L46 | F38-Q42 HydrophobicContact CD1-CG 4.33Å; F38-Q42 HydrophobicContact CD2-CG 4.3Å; F38-Q42 HydrophobicContact CE1-CG 4.01Å; F38-Q42 HydrophobicContact CE2-CG 3.98Å; F38-Q42 HydrophobicContact CG-CG 4.48Å; F38-Q42 HydrophobicContact CZ-CG 3.82Å; F38-Q42 VanDerWaalsContact O-CG 3.29Å; F38-Q42 WeakPolarHBondContact O-CG 3.47Å; F38-Q42 PolarHBondContact O-N 2.89Å; Q42-A44 VanDerWaalsContact C-N 3.35Å; Q42-A44 PolarHBondContact O-N 2.83Å; Q42-R45 PolarHBondContact O-N 2.86Å; Q42-L46 VanDerWaalsContact O-CG 3.28Å; Q42-L46 WeakPolarHBondContact O-CG 3.38Å; Q42-L46 PolarHBondContact O-N 3.49Å |
| 43 | A | 93.7 | Very high | 92 | Very high | 17 Ų | 17 | 63.1 Ų | 63.1 | 14% | 0.14 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -63.3 | -39.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | G39 L46 L47 F222 L223 V226 | G39-A43 VanDerWaalsContact O-CB 3.25Å; G39-A43 WeakPolarHBondContact O-CB 3.27Å; G39-A43 PolarHBondContact O-N 3.4Å; A43-L46 PolarHBondContact O-N 3.36Å; A43-L47 WeakPolarHBondContact O-CB 3.39Å; A43-L47 PolarHBondContact O-N 3.36Å; A43-F222 HydrophobicContact CB-CE1 3.86Å; A43-F222 HydrophobicContact CB-CZ 4.34Å; A43-L223 HydrophobicContact CB-CD2 4.37Å; A43-V226 HydrophobicContact CB-CG2 4.23Å |
| 44 | A | 93.4 | Very high | 91.8 | Very high | 0 Ų | 0 | 69.3 Ų | 69.3 | 0% | 0 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -60.8 | -50.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | S40 E41 Q42 L46 L47 G48 F204 A205 L208 F222 | S40-A44 WeakPolarHBondContact O-CB 3.44Å; S40-A44 PolarHBondContact O-N 3.4Å; E41-A44 PolarHBondContact O-N 3.42Å; Q42-A44 VanDerWaalsContact C-N 3.35Å; Q42-A44 PolarHBondContact O-N 2.83Å; A44-L46 VanDerWaalsContact C-N 3.32Å; A44-L46 PolarHBondContact O-N 3.1Å; A44-L47 PolarHBondContact O-N 2.98Å; A44-G48 PolarHBondContact O-N 3.01Å; A44-F204 HydrophobicContact CB-CB 4.42Å; A44-F204 HydrophobicContact CB-CD1 3.73Å; A44-F204 HydrophobicContact CB-CE1 4.45Å; A44-F204 HydrophobicContact CB-CG 4.46Å; A44-A205 WeakPolarHBondContact O-CB 3.15Å; A44-L208 HydrophobicContact CB-CD1 3.74Å; A44-F222 HydrophobicContact CB-CE1 4.23Å; A44-F222 HydrophobicContact CB-CZ 4.06Å |
| 45 | R | 92.2 | Very high | 91.9 | Very high | 158 Ų | 158 | 72.3 Ų | 72.3 | 60% | 0.596 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -58.2 | -43.2 | 178.8 | -74.2 | 171.7 | -179.6 | 170.3 | -1.7 | 112.2 | E41 Q42 S49 | E41-R45 WeakPolarHBondContact O-CB 3.31Å; E41-R45 VanDerWaalsContact O-CG 3.29Å; E41-R45 WeakPolarHBondContact O-CG 3.4Å; E41-R45 PolarHBondContact O-N 3.43Å; Q42-R45 PolarHBondContact O-N 2.86Å; R45-S49 PolarHBondContact O-N 3.01Å |
| 46 | L | 93.1 | Very high | 91.9 | Very high | 106 Ų | 106 | 68.5 Ų | 68.5 | 56% | 0.555 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -61.2 | -57.4 | 177.2 | -71.2 | 171.8 | 0 | 0 | 0 | 110.9 | Q42 A43 A44 G48 S49 L52 | Q42-L46 VanDerWaalsContact O-CG 3.28Å; Q42-L46 WeakPolarHBondContact O-CG 3.38Å; Q42-L46 PolarHBondContact O-N 3.49Å; A43-L46 PolarHBondContact O-N 3.36Å; A44-L46 VanDerWaalsContact C-N 3.32Å; A44-L46 PolarHBondContact O-N 3.1Å; L46-G48 VanDerWaalsContact C-N 3.29Å; L46-G48 PolarHBondContact O-N 2.99Å; L46-S49 WeakPolarHBondContact O-CB 3.3Å; L46-S49 PolarHBondContact O-N 3.19Å; L46-S49 VanDerWaalsContact O-N 3.1Å; L46-S49 PolarHBondContact O-OG 3.47Å; L46-L52 VanDerWaalsContact C-CD2 3.43Å; L46-L52 HydrophobicContact CB-CD2 3.92Å; L46-L52 WeakPolarHBondContact O-CD2 3.25Å |
| 47 | L | 90.7 | Very high | 91.8 | Very high | 27 Ų | 27 | 69.6 Ų | 69.6 | 14% | 0.141 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -64.4 | -31.3 | -178.3 | -73 | 171.6 | 0 | 0 | 0 | 113.4 | A43 A44 S49 A201 A202 F222 V226 L229 | A43-L47 WeakPolarHBondContact O-CB 3.39Å; A43-L47 PolarHBondContact O-N 3.36Å; A44-L47 PolarHBondContact O-N 2.98Å; L47-S49 VanDerWaalsContact C-N 3.29Å; L47-S49 PolarHBondContact O-N 3.11Å; L47-A201 HydrophobicContact CD1-CB 4.01Å; L47-A202 WeakPolarHBondContact O-CB 3.16Å; L47-F222 HydrophobicContact CD1-CE2 4.39Å; L47-F222 HydrophobicContact CD1-CZ 4.09Å; L47-V226 HydrophobicContact CD1-CG2 3.88Å; L47-L229 HydrophobicContact CD2-CD2 4.15Å |
| 48 | G | 88.6 | Confident | 91.8 | Very high | 25 Ų | 25 | 67.8 Ų | 67.8 | 26% | 0.258 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -74.3 | -15.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | A44 L46 | A44-G48 PolarHBondContact O-N 3.01Å; L46-G48 VanDerWaalsContact C-N 3.29Å; L46-G48 PolarHBondContact O-N 2.99Å |
| 49 | S | 91.9 | Very high | 91.8 | Very high | 36 Ų | 36 | 67.9 Ų | 67.9 | 25% | 0.252 | 35% | 0.346 | S | S | . | . | trans | -73.2 | 130.7 | -176.2 | 74.6 | 0 | 0 | 0 | 0 | 111.6 | R45 L46 L47 C51 L52 R53 | R45-S49 PolarHBondContact O-N 3.01Å; L46-S49 WeakPolarHBondContact O-CB 3.3Å; L46-S49 PolarHBondContact O-N 3.19Å; L46-S49 VanDerWaalsContact O-N 3.1Å; L46-S49 PolarHBondContact O-OG 3.47Å; L47-S49 VanDerWaalsContact C-N 3.29Å; L47-S49 PolarHBondContact O-N 3.11Å; S49-C51 PolarHBondContact O-N 3.35Å; S49-L52 PolarHBondContact O-N 2.75Å; S49-L52 WeakPolarHBondContact OG-CB 3.48Å; S49-L52 PolarHBondContact OG-N 2.95Å; S49-R53 PolarHBondContact O-N 3.31Å; S49-R53 VanDerWaalsContact O-N 3.1Å | ||
| 50 | P | 87.2 | Confident | 91.9 | Very high | 84 Ų | 84 | 66.9 Ų | 66.9 | 55% | 0.545 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -68.2 | -26.5 | -178.7 | 26.8 | -34.3 | 0 | 0 | 0 | 112.5 | R54 | P50-R54 PolarHBondContact O-N 3.09Å |
| 51 | C | 90.6 | Very high | 91.8 | Very high | 87 Ų | 87 | 69.2 Ų | 69.2 | 59% | 0.588 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -65.7 | -52.6 | 173.9 | -172.3 | 0 | 0 | 0 | 0 | 110.8 | S49 R53 R54 L55 | S49-C51 PolarHBondContact O-N 3.35Å; C51-R53 VanDerWaalsContact C-N 3.3Å; C51-R53 PolarHBondContact O-N 2.89Å; C51-R54 PolarHBondContact O-N 2.96Å; C51-R54 VanDerWaalsContact O-N 3.16Å; C51-L55 PolarHBondContact O-N 2.7Å |
| 52 | L | 89.6 | Confident | 91.9 | Very high | 63 Ų | 63 | 68 Ų | 68 | 33% | 0.33 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -63.2 | -37.3 | -179.8 | -169.2 | 70.9 | 0 | 0 | 0 | 111.6 | L46 S49 R54 L55 Y56 | L46-L52 VanDerWaalsContact C-CD2 3.43Å; L46-L52 HydrophobicContact CB-CD2 3.92Å; L46-L52 WeakPolarHBondContact O-CD2 3.25Å; S49-L52 PolarHBondContact O-N 2.75Å; S49-L52 WeakPolarHBondContact OG-CB 3.48Å; S49-L52 PolarHBondContact OG-N 2.95Å; L52-R54 PolarHBondContact O-N 3.45Å; L52-L55 HydrophobicContact CD1-CD2 4.45Å; L52-L55 CarbonylContact O-C 3.35Å; L52-L55 PolarHBondContact O-N 3.38Å; L52-Y56 VanDerWaalsContact O-CB 3.25Å; L52-Y56 WeakPolarHBondContact O-CB 3.43Å; L52-Y56 PolarHBondContact O-N 2.99Å |
| 53 | R | 88.6 | Confident | 91.8 | Very high | 89 Ų | 89 | 65 Ų | 65 | 34% | 0.336 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -59.2 | -43.9 | 174.5 | -85.4 | 172.7 | 59.7 | -150.2 | 0.5 | 112.7 | S49 C51 Y56 H57 E199 | S49-R53 PolarHBondContact O-N 3.31Å; S49-R53 VanDerWaalsContact O-N 3.1Å; C51-R53 VanDerWaalsContact C-N 3.3Å; C51-R53 PolarHBondContact O-N 2.89Å; R53-Y56 PolarHBondContact O-N 3.08Å; R53-H57 PolarHBondContact O-N 3.14Å; R53-H57 PolarHBondContact O-ND1 3.07Å; R53-E199 IonicContact CZ-OE1 3.36Å; R53-E199 IonicContact CZ-OE2 2.84Å; R53-E199 IonicContact NE-OE1 2.7Å; R53-E199 PolarHBondContact NE-OE1 3.49Å; R53-E199 IonicContact NE-OE2 3.21Å; R53-E199 VanDerWaalsContact NH2-CD 3.33Å; R53-E199 IonicContact NH2-OE1 3.03Å; R53-E199 PolarHBondContact NH2-OE1 2.97Å; R53-E199 IonicContact NH2-OE2 2.94Å; R53-E199 PolarHBondContact NH2-OE2 3.21Å |
| 54 | R | 89.1 | Confident | 91.7 | Very high | 187 Ų | 187 | 64.5 Ų | 64.5 | 71% | 0.706 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -65.7 | -44.5 | 174.8 | -75.4 | -174.2 | -76.6 | -158.9 | 1.1 | 111.5 | P50 C51 L52 Y56 H57 A58 | P50-R54 PolarHBondContact O-N 3.09Å; C51-R54 PolarHBondContact O-N 2.96Å; C51-R54 VanDerWaalsContact O-N 3.16Å; L52-R54 PolarHBondContact O-N 3.45Å; R54-Y56 PolarHBondContact O-N 3.47Å; R54-H57 PolarHBondContact O-N 3.28Å; R54-A58 PolarHBondContact O-N 3.14Å |
| 55 | L | 93.1 | Very high | 91.6 | Very high | 107 Ų | 107 | 68.1 Ų | 68.1 | 56% | 0.56 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -61.9 | -31.7 | 176.5 | -172.6 | 62.6 | 0 | 0 | 0 | 111.9 | C51 L52 A58 W59 | C51-L55 PolarHBondContact O-N 2.7Å; L52-L55 HydrophobicContact CD1-CD2 4.45Å; L52-L55 CarbonylContact O-C 3.35Å; L52-L55 PolarHBondContact O-N 3.38Å; L55-A58 CarbonylContact O-C 3.59Å; L55-A58 PolarHBondContact O-N 3.24Å; L55-W59 WeakPolarHBondContact O-CB 3.43Å; L55-W59 PolarHBondContact O-N 3.09Å |
| 56 | Y | 93.5 | Very high | 91.5 | Very high | 33 Ų | 33 | 66.5 Ų | 66.5 | 13% | 0.129 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -67.4 | -38.1 | -180 | -170.5 | -114.8 | 0 | 0 | 0 | 112.5 | L52 R53 R54 W59 L60 C194 L195 A198 N233 | L52-Y56 VanDerWaalsContact O-CB 3.25Å; L52-Y56 WeakPolarHBondContact O-CB 3.43Å; L52-Y56 PolarHBondContact O-N 2.99Å; R53-Y56 PolarHBondContact O-N 3.08Å; R54-Y56 PolarHBondContact O-N 3.47Å; Y56-W59 AromaticContact CE2-CD1 3.9Å; Y56-W59 WeakPolarHBondContact O-CB 3.43Å; Y56-W59 PolarHBondContact O-N 2.9Å; Y56-L60 HydrophobicContact CD1-CD1 4.08Å; Y56-L60 HydrophobicContact CE1-CD1 3.59Å; Y56-L60 HydrophobicContact CE1-CG 4.16Å; Y56-L60 HydrophobicContact CE2-CG 4.44Å; Y56-L60 WeakPolarHBondContact O-CG 3.12Å; Y56-L60 PolarHBondContact O-N 3.39Å; Y56-C194 HydrophobicContact CE1-CB 4.42Å; Y56-C194 VanDerWaalsContact OH-CB 3.29Å; Y56-C194 WeakPolarHBondContact OH-CB 3.38Å; Y56-L195 HydrophobicContact CD1-CD2 4.44Å; Y56-L195 HydrophobicContact CE1-CD2 4.48Å; Y56-A198 HydrophobicContact CD1-CB 3.96Å; Y56-A198 HydrophobicContact CE1-CB 3.84Å; Y56-N233 PolarHBondContact OH-ND2 3.11Å; Y56-N233 PolarHBondContact OH-OD1 2.65Å |
| 57 | H | 92.4 | Very high | 91.2 | Very high | 53 Ų | 53 | 61.6 Ų | 61.6 | 25% | 0.245 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -64.2 | -44.3 | 172.3 | -68.7 | 79.2 | 0 | 0 | 0 | 111 | R53 R54 W59 L60 A61 W260 | R53-H57 PolarHBondContact O-N 3.14Å; R53-H57 PolarHBondContact O-ND1 3.07Å; R54-H57 PolarHBondContact O-N 3.28Å; H57-W59 VanDerWaalsContact C-N 3.32Å; H57-W59 PolarHBondContact O-N 3.1Å; H57-L60 PolarHBondContact O-N 2.87Å; H57-A61 PolarHBondContact O-N 2.8Å; H57-W260 AromaticContact CE1-CH2 3.71Å; H57-W260 AromaticContact CE1-CZ2 3.95Å; H57-W260 AromaticContact NE2-CE3 3.78Å; H57-W260 AromaticContact NE2-CH2 3.14Å; H57-W260 WeakPolarHBondContact NE2-CH2 3.38Å; H57-W260 AromaticContact NE2-CZ2 3.54Å; H57-W260 AromaticContact NE2-CZ3 3.27Å; H57-W260 VanDerWaalsContact NE2-CZ3 3.27Å; H57-W260 WeakPolarHBondContact NE2-CZ3 3.26Å |
| 58 | A | 92.8 | Very high | 91 | Very high | 56 Ų | 56 | 60.8 Ų | 60.8 | 46% | 0.463 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -63.2 | -38.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | R54 L55 A61 A62 | R54-A58 PolarHBondContact O-N 3.14Å; L55-A58 CarbonylContact O-C 3.59Å; L55-A58 PolarHBondContact O-N 3.24Å; A58-A61 PolarHBondContact O-N 3.45Å; A58-A62 VanDerWaalsContact O-CB 3.27Å; A58-A62 WeakPolarHBondContact O-CB 3.34Å; A58-A62 PolarHBondContact O-N 2.87Å |
| 59 | W | 94 | Very high | 90.9 | Very high | 137 Ų | 137 | 64.3 Ų | 64.3 | 52% | 0.519 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -61 | -50 | 174.6 | 166.5 | -103.4 | 0 | 0 | 0 | 111.7 | L55 Y56 H57 A61 A62 V63 N233 | L55-W59 WeakPolarHBondContact O-CB 3.43Å; L55-W59 PolarHBondContact O-N 3.09Å; Y56-W59 AromaticContact CE2-CD1 3.9Å; Y56-W59 WeakPolarHBondContact O-CB 3.43Å; Y56-W59 PolarHBondContact O-N 2.9Å; H57-W59 VanDerWaalsContact C-N 3.32Å; H57-W59 PolarHBondContact O-N 3.1Å; W59-A61 VanDerWaalsContact C-N 3.33Å; W59-A61 PolarHBondContact O-N 3.32Å; W59-A62 PolarHBondContact O-N 2.85Å; W59-V63 HydrophobicContact CD2-CG2 3.86Å; W59-V63 VanDerWaalsContact CE2-CG2 3.45Å; W59-V63 HydrophobicContact CE3-CG2 4.23Å; W59-V63 HydrophobicContact CG-CG2 4.48Å; W59-V63 HydrophobicContact CH2-CG2 3.9Å; W59-V63 HydrophobicContact CZ2-CG2 3.48Å; W59-V63 VanDerWaalsContact CZ2-CG2 3.48Å; W59-V63 HydrophobicContact CZ3-CG2 4.25Å; W59-V63 WeakPolarHBondContact O-CG2 3.39Å; W59-V63 PolarHBondContact O-N 3.43Å; W59-N233 PolarHBondContact NE1-OD1 3.38Å |
| 60 | L | 94.1 | Very high | 90.5 | Very high | 5 Ų | 5 | 66.3 Ų | 66.3 | 3% | 0.026 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -60.8 | -42.4 | 177.8 | -74.1 | 173.7 | 0 | 0 | 0 | 111.8 | Y56 H57 V63 V64 C194 L195 L236 | Y56-L60 HydrophobicContact CD1-CD1 4.08Å; Y56-L60 HydrophobicContact CE1-CD1 3.59Å; Y56-L60 HydrophobicContact CE1-CG 4.16Å; Y56-L60 HydrophobicContact CE2-CG 4.44Å; Y56-L60 WeakPolarHBondContact O-CG 3.12Å; Y56-L60 PolarHBondContact O-N 3.39Å; H57-L60 PolarHBondContact O-N 2.87Å; L60-V63 PolarHBondContact O-N 3.43Å; L60-V64 WeakPolarHBondContact O-CG2 3.13Å; L60-V64 PolarHBondContact O-N 3.32Å; L60-V64 VanDerWaalsContact O-N 3.11Å; L60-C194 HydrophobicContact CD1-CB 4.27Å; L60-C194 HydrophobicContact CD2-CB 4.3Å; L60-L195 HydrophobicContact CD1-CD2 3.48Å; L60-L195 VanDerWaalsContact CD1-CD2 3.48Å; L60-L195 HydrophobicContact CD1-CG 3.73Å; L60-L236 HydrophobicContact CD2-CD2 3.68Å |
| 61 | A | 93.1 | Very high | 90.3 | Very high | 49 Ų | 49 | 66 Ų | 66 | 41% | 0.405 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -61.6 | -45.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | H57 A58 W59 V63 V64 I65 | H57-A61 PolarHBondContact O-N 2.8Å; A58-A61 PolarHBondContact O-N 3.45Å; W59-A61 VanDerWaalsContact C-N 3.33Å; W59-A61 PolarHBondContact O-N 3.32Å; A61-V63 PolarHBondContact O-N 2.84Å; A61-V64 PolarHBondContact O-N 2.89Å; A61-I65 WeakPolarHBondContact O-CB 3.29Å; A61-I65 VanDerWaalsContact O-CG1 3.27Å; A61-I65 WeakPolarHBondContact O-CG1 3.01Å; A61-I65 PolarHBondContact O-N 3.03Å |
| 62 | A | 93.4 | Very high | 89.8 | Confident | 36 Ų | 36 | 69.4 Ų | 69.4 | 30% | 0.298 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -62.6 | -43 | 178 | 0 | 0 | 0 | 0 | 0 | 112.2 | A58 W59 V64 I65 F66 | A58-A62 VanDerWaalsContact O-CB 3.27Å; A58-A62 WeakPolarHBondContact O-CB 3.34Å; A58-A62 PolarHBondContact O-N 2.87Å; W59-A62 PolarHBondContact O-N 2.85Å; A62-V64 VanDerWaalsContact C-N 3.31Å; A62-V64 PolarHBondContact O-N 3.46Å; A62-I65 PolarHBondContact O-N 2.92Å; A62-F66 HydrophobicContact CB-CD2 4.06Å; A62-F66 HydrophobicContact CB-CE2 4.48Å; A62-F66 WeakPolarHBondContact O-CB 3.28Å; A62-F66 WeakPolarHBondContact O-CD2 3.37Å; A62-F66 PolarHBondContact O-N 3.42Å |
| 63 | V | 92.9 | Very high | 89.5 | Confident | 10 Ų | 10 | 74.1 Ų | 74.1 | 6% | 0.061 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -59.3 | -42.9 | 175.8 | 167.3 | 0 | 0 | 0 | 0 | 110.8 | W59 L60 A61 G67 L236 L237 V240 | W59-V63 HydrophobicContact CD2-CG2 3.86Å; W59-V63 VanDerWaalsContact CE2-CG2 3.45Å; W59-V63 HydrophobicContact CE3-CG2 4.23Å; W59-V63 HydrophobicContact CG-CG2 4.48Å; W59-V63 HydrophobicContact CH2-CG2 3.9Å; W59-V63 HydrophobicContact CZ2-CG2 3.48Å; W59-V63 VanDerWaalsContact CZ2-CG2 3.48Å; W59-V63 HydrophobicContact CZ3-CG2 4.25Å; W59-V63 WeakPolarHBondContact O-CG2 3.39Å; W59-V63 PolarHBondContact O-N 3.43Å; L60-V63 PolarHBondContact O-N 3.43Å; A61-V63 PolarHBondContact O-N 2.84Å; V63-G67 WeakPolarHBondContact O-CA 3.48Å; V63-G67 PolarHBondContact O-N 3.25Å; V63-L236 HydrophobicContact CG1-CD2 4.41Å; V63-L236 HydrophobicContact CG1-CG 4.35Å; V63-L237 HydrophobicContact CG1-CD1 4.15Å; V63-V240 HydrophobicContact CG1-CG2 4.11Å |
| 64 | V | 91.7 | Very high | 88.9 | Confident | 6 Ų | 6 | 72 Ų | 72 | 4% | 0.036 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -74.8 | -39.3 | -177.7 | 174.5 | 0 | 0 | 0 | 0 | 112.5 | L60 A61 A62 P68 T187 L236 V240 V250 A253 | L60-V64 WeakPolarHBondContact O-CG2 3.13Å; L60-V64 PolarHBondContact O-N 3.32Å; L60-V64 VanDerWaalsContact O-N 3.11Å; A61-V64 PolarHBondContact O-N 2.89Å; A62-V64 VanDerWaalsContact C-N 3.31Å; A62-V64 PolarHBondContact O-N 3.46Å; V64-P68 WeakPolarHBondContact O-CD 3.29Å; V64-T187 HydrophobicContact CG2-CG2 4.48Å; V64-L236 HydrophobicContact CG2-CD1 4.46Å; V64-L236 HydrophobicContact CG2-CD2 4.47Å; V64-V240 HydrophobicContact CG2-CG1 4.29Å; V64-V250 HydrophobicContact CG1-CB 4.48Å; V64-V250 HydrophobicContact CG1-CG2 4.12Å; V64-A253 HydrophobicContact CB-CB 4.19Å; V64-A253 HydrophobicContact CG1-CB 3.72Å; V64-A253 HydrophobicContact CG2-CB 3.7Å |
| 65 | I | 91.1 | Very high | 88.2 | Confident | 76 Ų | 76 | 67.6 Ų | 67.6 | 39% | 0.39 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -75.7 | -48.5 | -178.4 | -67 | 166.2 | 0 | 0 | 0 | 111.2 | A61 A62 | A61-I65 WeakPolarHBondContact O-CB 3.29Å; A61-I65 VanDerWaalsContact O-CG1 3.27Å; A61-I65 WeakPolarHBondContact O-CG1 3.01Å; A61-I65 PolarHBondContact O-N 3.03Å; A62-I65 PolarHBondContact O-N 2.92Å |
| 66 | F | 90.3 | Very high | 87.1 | Confident | 125 Ų | 125 | 67.5 Ų | 67.5 | 55% | 0.548 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -96.5 | -18.9 | -174 | -58.6 | -69.5 | 0 | 0 | 0 | 113.7 | A62 P68 L69 | A62-F66 HydrophobicContact CB-CD2 4.06Å; A62-F66 HydrophobicContact CB-CE2 4.48Å; A62-F66 WeakPolarHBondContact O-CB 3.28Å; A62-F66 WeakPolarHBondContact O-CD2 3.37Å; A62-F66 PolarHBondContact O-N 3.42Å; F66-P68 VanDerWaalsContact C-CD 3.45Å; F66-P68 VanDerWaalsContact C-N 3.29Å; F66-L69 HydrophobicContact CB-CD1 4.4Å; F66-L69 HydrophobicContact CD1-CD1 3.87Å; F66-L69 VanDerWaalsContact O-CB 3.25Å; F66-L69 WeakPolarHBondContact O-CB 3.24Å; F66-L69 PolarHBondContact O-N 2.9Å |
| 67 | G | 87.4 | Confident | 85.7 | Confident | 3 Ų | 3 | 76.8 Ų | 76.8 | 3% | 0.031 | 39% | 0.387 | C | S | . | . | G | 310 helix | trans | -52.6 | -39.4 | 178 | 0 | 0 | 0 | 0 | 0 | 114.3 | V63 L69 L70 | V63-G67 WeakPolarHBondContact O-CA 3.48Å; V63-G67 PolarHBondContact O-N 3.25Å; G67-L69 PolarHBondContact O-N 2.97Å; G67-L70 VanDerWaalsContact O-CB 3.29Å; G67-L70 WeakPolarHBondContact O-CB 3.49Å; G67-L70 PolarHBondContact O-N 3.44Å |
| 68 | P | 85.4 | Confident | 84.7 | Confident | 10 Ų | 10 | 76.5 Ų | 76.5 | 7% | 0.065 | 39% | 0.39 | C | S | . | . | G | 310 helix | trans | -61.3 | -23.5 | 173.7 | -29.1 | 40.2 | 0 | 0 | 0 | 114.2 | V64 F66 L70 Q71 Y246 | V64-P68 WeakPolarHBondContact O-CD 3.29Å; F66-P68 VanDerWaalsContact C-CD 3.45Å; F66-P68 VanDerWaalsContact C-N 3.29Å; P68-L70 PolarHBondContact O-N 3Å; P68-Q71 WeakPolarHBondContact O-CB 3.3Å; P68-Q71 VanDerWaalsContact O-CD 3.23Å; P68-Q71 WeakPolarHBondContact O-CG 3.47Å; P68-Q71 PolarHBondContact O-N 2.92Å; P68-Q71 VanDerWaalsContact O-N 3.13Å; P68-Q71 PolarHBondContact O-NE2 3.35Å; P68-Y246 HydrophobicContact CB-CD2 3.82Å; P68-Y246 HydrophobicContact CB-CE2 4.19Å; P68-Y246 HydrophobicContact CG-CD2 3.57Å; P68-Y246 HydrophobicContact CG-CE2 3.76Å |
| 69 | L | 85.9 | Confident | 83.4 | Confident | 99 Ų | 99 | 79.9 Ų | 79.9 | 52% | 0.518 | 40% | 0.398 | S | S | . | . | G | 310 helix | trans | -67.8 | -25.4 | 173.7 | -59.3 | 176.5 | 0 | 0 | 0 | 112.2 | F66 G67 Q71 F72 | F66-L69 HydrophobicContact CB-CD1 4.4Å; F66-L69 HydrophobicContact CD1-CD1 3.87Å; F66-L69 VanDerWaalsContact O-CB 3.25Å; F66-L69 WeakPolarHBondContact O-CB 3.24Å; F66-L69 PolarHBondContact O-N 2.9Å; G67-L69 PolarHBondContact O-N 2.97Å; L69-Q71 PolarHBondContact O-N 3.18Å; L69-F72 HydrophobicContact CD2-CE2 4.5Å; L69-F72 WeakPolarHBondContact O-CD2 3.32Å; L69-F72 PolarHBondContact O-N 3.19Å |
| 70 | L | 84.9 | Confident | 82 | Confident | 78 Ų | 78 | 77 Ų | 77 | 41% | 0.408 | 39% | 0.389 | S | S | . | . | G | 310 helix | trans | -70.2 | -14.9 | 175.3 | -58.6 | 169.7 | 0 | 0 | 0 | 111.8 | G67 P68 F72 H73 V74 L237 I241 | G67-L70 VanDerWaalsContact O-CB 3.29Å; G67-L70 WeakPolarHBondContact O-CB 3.49Å; G67-L70 PolarHBondContact O-N 3.44Å; P68-L70 PolarHBondContact O-N 3Å; L70-F72 PolarHBondContact O-N 3.43Å; L70-H73 PolarHBondContact O-N 3Å; L70-V74 WeakPolarHBondContact O-CG2 3.36Å; L70-V74 PolarHBondContact O-N 3.42Å; L70-L237 HydrophobicContact CD1-CD1 4.13Å; L70-I241 HydrophobicContact CB-CD1 4.13Å; L70-I241 HydrophobicContact CB-CG1 4.1Å; L70-I241 HydrophobicContact CD1-CD1 4.15Å |
| 71 | Q | 81.6 | Confident | 80.2 | Confident | 76 Ų | 76 | 77.9 Ų | 77.9 | 36% | 0.355 | 40% | 0.398 | S | S | . | . | G | 310 helix | trans | -58.2 | -31 | 176.2 | 85.5 | -170.2 | -68.9 | 0 | 0 | 112.3 | P68 L69 H73 | P68-Q71 WeakPolarHBondContact O-CB 3.3Å; P68-Q71 VanDerWaalsContact O-CD 3.23Å; P68-Q71 WeakPolarHBondContact O-CG 3.47Å; P68-Q71 PolarHBondContact O-N 2.92Å; P68-Q71 VanDerWaalsContact O-N 3.13Å; P68-Q71 PolarHBondContact O-NE2 3.35Å; L69-Q71 PolarHBondContact O-N 3.18Å; Q71-H73 VanDerWaalsContact C-N 3.26Å; Q71-H73 PolarHBondContact O-N 3.29Å |
| 72 | F | 81.1 | Confident | 78.7 | Confident | 159 Ų | 159 | 78.4 Ų | 78.4 | 70% | 0.697 | 40% | 0.399 | S | S | * | . | G | 310 helix | trans | -71.4 | -21.1 | 178.7 | -61 | -64.1 | 0 | 0 | 0 | 113.3 | L69 L70 | L69-F72 HydrophobicContact CD2-CE2 4.5Å; L69-F72 WeakPolarHBondContact O-CD2 3.32Å; L69-F72 PolarHBondContact O-N 3.19Å; L70-F72 PolarHBondContact O-N 3.43Å |
| 73 | H | 82.8 | Confident | 76.9 | Confident | 162 Ų | 162 | 83.2 Ų | 83.2 | 75% | 0.75 | 42% | 0.415 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.5 | -16 | -176.6 | -64.4 | 82.6 | 0 | 0 | 0 | 112.6 | L70 Q71 | L70-H73 PolarHBondContact O-N 3Å; Q71-H73 VanDerWaalsContact C-N 3.26Å; Q71-H73 PolarHBondContact O-N 3.29Å |
| 74 | V | 77.1 | Confident | 75.1 | Confident | 45 Ų | 45 | 86 Ų | 86 | 27% | 0.273 | 45% | 0.446 | S | S | . | . | S | Bend | trans | -102.8 | 130.3 | -172.8 | 179.3 | 0 | 0 | 0 | 0 | 110.3 | L70 P76 I241 Y242 | L70-V74 WeakPolarHBondContact O-CG2 3.36Å; L70-V74 PolarHBondContact O-N 3.42Å; V74-P76 WeakPolarHBondContact O-CD 3.48Å; V74-I241 HydrophobicContact CB-CG2 4.14Å; V74-I241 HydrophobicContact CG1-CG2 4.31Å; V74-I241 HydrophobicContact CG2-CG2 4.19Å; V74-Y242 HydrophobicContact CG1-CE1 3.66Å; V74-Y242 WeakPolarHBondContact CG1-OH 3.36Å |
| 75 | N | 74.6 | Confident | 73.9 | Confident | 95 Ų | 95 | 87.4 Ų | 87.4 | 51% | 0.508 | 45% | 0.453 | S | S | . | . | trans | -67.2 | 123 | -180 | -172.9 | -9.7 | 0 | 0 | 0 | 111 | R77 T78 | N75-R77 PolarHBondContact O-N 3.24Å; N75-R77 VanDerWaalsContact O-N 3.11Å; N75-R77 PolarHBondContact OD1-N 3.11Å; N75-T78 HydrophobicContact CB-CG2 4.35Å; N75-T78 WeakPolarHBondContact O-CG2 3.44Å; N75-T78 PolarHBondContact O-N 3.23Å; N75-T78 PolarHBondContact O-OG1 2.98Å | ||
| 76 | P | 68.2 | Low | 72.3 | Confident | 104 Ų | 104 | 90.1 Ų | 90.1 | 68% | 0.675 | 46% | 0.462 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.4 | -5.5 | 179.2 | 27.6 | -35.6 | 0 | 0 | 0 | 114 | V74 T78 A81 | V74-P76 WeakPolarHBondContact O-CD 3.48Å; P76-T78 VanDerWaalsContact C-N 3.34Å; P76-A81 WeakPolarHBondContact O-CB 3.43Å |
| 77 | R | 64.6 | Low | 70.9 | Confident | 228 Ų | 228 | 89.1 Ų | 89.1 | 86% | 0.86 | 46% | 0.458 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.8 | 6.2 | 174.9 | -60.7 | -172 | -175.7 | 175.3 | 1.9 | 114.3 | N75 | N75-R77 PolarHBondContact O-N 3.24Å; N75-R77 VanDerWaalsContact O-N 3.11Å; N75-R77 PolarHBondContact OD1-N 3.11Å |
| 78 | T | 71.4 | Confident | 69.8 | Low | 48 Ų | 48 | 89.3 Ų | 89.3 | 29% | 0.294 | 46% | 0.458 | S | S | . | . | S | Bend | trans | -70.3 | 150.6 | 178.1 | 46.3 | 0 | 0 | 0 | 0 | 111.1 | N75 P76 F80 A81 Y242 | N75-T78 HydrophobicContact CB-CG2 4.35Å; N75-T78 WeakPolarHBondContact O-CG2 3.44Å; N75-T78 PolarHBondContact O-N 3.23Å; N75-T78 PolarHBondContact O-OG1 2.98Å; P76-T78 VanDerWaalsContact C-N 3.34Å; T78-F80 PolarHBondContact O-N 3.28Å; T78-F80 VanDerWaalsContact O-N 3.1Å; T78-A81 VanDerWaalsContact O-CB 3.29Å; T78-A81 WeakPolarHBondContact O-CB 3.5Å; T78-A81 PolarHBondContact O-N 3.39Å; T78-Y242 WeakPolarHBondContact OG1-CE1 3.28Å; T78-Y242 PolarHBondContact OG1-OH 3.03Å |
| 79 | I | 66.8 | Low | 69.1 | Low | 126 Ų | 126 | 91.4 Ų | 91.4 | 65% | 0.646 | 47% | 0.468 | S | S | * | . | G | 310 helix | trans | -50.7 | -39.8 | -179.1 | -65.9 | 171.5 | 0 | 0 | 0 | 110.6 | A81 S82 N85 | I79-A81 VanDerWaalsContact C-N 3.32Å; I79-A81 PolarHBondContact O-N 3.06Å; I79-S82 PolarHBondContact O-OG 3.36Å; I79-N85 WeakPolarHBondContact CG2-ND2 3.27Å; I79-N85 PolarHBondContact O-ND2 3.46Å |
| 80 | F | 63.4 | Low | 68.4 | Low | 76 Ų | 76 | 92.8 Ų | 92.8 | 33% | 0.333 | 47% | 0.47 | S | S | . | . | G | 310 helix | trans | -75.2 | -13.7 | -179.6 | -59.2 | -71.5 | 0 | 0 | 0 | 115.5 | T78 Y242 | T78-F80 PolarHBondContact O-N 3.28Å; T78-F80 VanDerWaalsContact O-N 3.1Å; F80-Y242 HydrophobicContact CB-CD2 4.19Å; F80-Y242 HydrophobicContact CB-CE2 3.59Å |
| 81 | A | 56.8 | Low | 67.9 | Low | 24 Ų | 24 | 91 Ų | 91 | 20% | 0.198 | 46% | 0.459 | C | S | . | . | G | 310 helix | trans | -83.6 | -19.2 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | P76 T78 I79 H83 Y242 | P76-A81 WeakPolarHBondContact O-CB 3.43Å; T78-A81 VanDerWaalsContact O-CB 3.29Å; T78-A81 WeakPolarHBondContact O-CB 3.5Å; T78-A81 PolarHBondContact O-N 3.39Å; I79-A81 VanDerWaalsContact C-N 3.32Å; I79-A81 PolarHBondContact O-N 3.06Å; A81-H83 PolarHBondContact O-N 2.89Å; A81-Y242 HydrophobicContact CB-CD1 3.38Å; A81-Y242 HydrophobicContact CB-CE1 3.47Å; A81-Y242 VanDerWaalsContact CB-CE1 3.47Å; A81-Y242 HydrophobicContact CB-CG 4.15Å |
| 82 | S | 61.6 | Low | 67.8 | Low | 61 Ų | 61 | 87.3 Ų | 87.3 | 43% | 0.427 | 44% | 0.442 | S | S | . | . | trans | -70.2 | 117.8 | -179.4 | 69.4 | 0 | 0 | 0 | 0 | 109.9 | I79 G84 N85 | I79-S82 PolarHBondContact O-OG 3.36Å; S82-G84 PolarHBondContact O-N 3.04Å; S82-N85 WeakPolarHBondContact O-CB 3.43Å; S82-N85 PolarHBondContact O-N 3.44Å; S82-N85 WeakPolarHBondContact OG-CB 3.31Å | ||
| 83 | H | 55.4 | Low | 67.8 | Low | 136 Ų | 136 | 83.9 Ų | 83.9 | 63% | 0.63 | 43% | 0.431 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.5 | -10.8 | -178.4 | -156.2 | -78.9 | 0 | 0 | 0 | 113.1 | A81 I89 F243 | A81-H83 PolarHBondContact O-N 2.89Å; H83-I89 WeakPolarHBondContact O-CD1 3.27Å; H83-F243 AromaticContact CD2-CD1 3.66Å; H83-F243 AromaticContact CD2-CE1 3.52Å; H83-F243 AromaticContact NE2-CD1 3.53Å; H83-F243 AromaticContact NE2-CE1 3.47Å; H83-F243 WeakPolarHBondContact NE2-CE1 3.27Å |
| 84 | G | 56.2 | Low | 68 | Low | 69 Ų | 69 | 78.5 Ų | 78.5 | 71% | 0.711 | 41% | 0.411 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -100.6 | 5.8 | 173.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | S82 F86 | S82-G84 PolarHBondContact O-N 3.04Å; G84-F86 PolarHBondContact O-N 3.21Å |
| 85 | N | 64.9 | Low | 68.7 | Low | 36 Ų | 36 | 76.3 Ų | 76.3 | 19% | 0.193 | 40% | 0.398 | C | S | . | . | trans | -68.6 | 113.4 | -176 | -149.8 | -27.1 | 0 | 0 | 0 | 110.8 | I79 S82 F87 N88 I89 | I79-N85 WeakPolarHBondContact CG2-ND2 3.27Å; I79-N85 PolarHBondContact O-ND2 3.46Å; S82-N85 WeakPolarHBondContact O-CB 3.43Å; S82-N85 PolarHBondContact O-N 3.44Å; S82-N85 WeakPolarHBondContact OG-CB 3.31Å; N85-F87 PolarHBondContact O-N 2.91Å; N85-F87 VanDerWaalsContact O-N 3.11Å; N85-N88 PolarHBondContact O-N 3.25Å; N85-N88 VanDerWaalsContact O-N 3.14Å; N85-I89 PolarHBondContact O-N 2.89Å | ||
| 86 | F | 58.6 | Low | 69.6 | Low | 132 Ų | 132 | 72.7 Ų | 72.7 | 58% | 0.579 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -50.4 | -39 | -179 | -179.7 | -83.1 | 0 | 0 | 0 | 112 | G84 K90 | G84-F86 PolarHBondContact O-N 3.21Å; F86-K90 HydrophobicContact CD1-CB 4.37Å; F86-K90 HydrophobicContact CD1-CD 4.47Å; F86-K90 HydrophobicContact CD1-CG 4.45Å; F86-K90 HydrophobicContact CD2-CD 3.74Å; F86-K90 VanDerWaalsContact CD2-CE 3.47Å; F86-K90 HydrophobicContact CD2-CG 4.07Å; F86-K90 HydrophobicContact CE1-CB 4.29Å; F86-K90 HydrophobicContact CE1-CD 4.08Å; F86-K90 HydrophobicContact CE1-CG 4.44Å; F86-K90 HydrophobicContact CE2-CD 3.33Å; F86-K90 HydrophobicContact CE2-CG 4.14Å; F86-K90 HydrophobicContact CG-CD 4.32Å; F86-K90 HydrophobicContact CG-CG 4.26Å; F86-K90 HydrophobicContact CZ-CD 3.51Å; F86-K90 HydrophobicContact CZ-CG 4.31Å; F86-K90 VanDerWaalsContact O-CB 3.28Å; F86-K90 WeakPolarHBondContact O-CB 3.46Å; F86-K90 PolarHBondContact O-N 3.33Å |
| 87 | F | 60.3 | Low | 70.8 | Confident | 104 Ų | 104 | 69.4 Ų | 69.4 | 46% | 0.456 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -64.7 | -47.1 | -177.3 | -161.7 | -95.3 | 0 | 0 | 0 | 111.6 | N85 F91 | N85-F87 PolarHBondContact O-N 2.91Å; N85-F87 VanDerWaalsContact O-N 3.11Å; F87-F91 HydrophobicContact CZ-CD2 4.5Å; F87-F91 HydrophobicContact CZ-CG 4.41Å; F87-F91 WeakPolarHBondContact O-CB 3.4Å; F87-F91 PolarHBondContact O-N 2.9Å; F87-F91 VanDerWaalsContact O-N 3.12Å |
| 88 | N | 65.4 | Low | 72.2 | Confident | 7 Ų | 7 | 63.3 Ų | 63.3 | 4% | 0.037 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -67.9 | -45.4 | -177.9 | -165.2 | 12.1 | 0 | 0 | 0 | 111.6 | N85 V92 F243 | N85-N88 PolarHBondContact O-N 3.25Å; N85-N88 VanDerWaalsContact O-N 3.14Å; N88-V92 WeakPolarHBondContact O-CB 3.35Å; N88-V92 WeakPolarHBondContact O-CG2 3.47Å; N88-V92 PolarHBondContact O-N 2.91Å; N88-F243 WeakPolarHBondContact ND2-CE2 3.19Å |
| 89 | I | 69 | Low | 73.4 | Confident | 55 Ų | 55 | 61 Ų | 61 | 28% | 0.282 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -75.8 | -51.5 | -175.3 | -65.4 | 171.5 | 0 | 0 | 0 | 111.9 | H83 N85 N93 | H83-I89 WeakPolarHBondContact O-CD1 3.27Å; N85-I89 PolarHBondContact O-N 2.89Å; I89-N93 WeakPolarHBondContact O-CB 3.48Å; I89-N93 VanDerWaalsContact O-CG 3.24Å; I89-N93 PolarHBondContact O-N 3.06Å; I89-N93 PolarHBondContact O-ND2 2.75Å; I89-N93 VanDerWaalsContact O-ND2 3.17Å |
| 90 | K | 71.2 | Confident | 74.7 | Confident | 127 Ų | 127 | 57 Ų | 57 | 55% | 0.552 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -73.3 | -34.7 | -175.4 | -64.3 | -147.9 | -170.4 | 179 | 0 | 112.4 | F86 S94 | F86-K90 HydrophobicContact CD1-CB 4.37Å; F86-K90 HydrophobicContact CD1-CD 4.47Å; F86-K90 HydrophobicContact CD1-CG 4.45Å; F86-K90 HydrophobicContact CD2-CD 3.74Å; F86-K90 VanDerWaalsContact CD2-CE 3.47Å; F86-K90 HydrophobicContact CD2-CG 4.07Å; F86-K90 HydrophobicContact CE1-CB 4.29Å; F86-K90 HydrophobicContact CE1-CD 4.08Å; F86-K90 HydrophobicContact CE1-CG 4.44Å; F86-K90 HydrophobicContact CE2-CD 3.33Å; F86-K90 HydrophobicContact CE2-CG 4.14Å; F86-K90 HydrophobicContact CG-CD 4.32Å; F86-K90 HydrophobicContact CG-CG 4.26Å; F86-K90 HydrophobicContact CZ-CD 3.51Å; F86-K90 HydrophobicContact CZ-CG 4.31Å; F86-K90 VanDerWaalsContact O-CB 3.28Å; F86-K90 WeakPolarHBondContact O-CB 3.46Å; F86-K90 PolarHBondContact O-N 3.33Å; K90-S94 PolarHBondContact O-N 3.25Å |
| 91 | F | 75.8 | Confident | 76.2 | Confident | 40 Ų | 40 | 57.7 Ų | 57.7 | 18% | 0.175 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -73.8 | -39.8 | -179 | -165.5 | -100.7 | 0 | 0 | 0 | 111.9 | F87 N93 S94 A95 W98 L231 W232 L235 | F87-F91 HydrophobicContact CZ-CD2 4.5Å; F87-F91 HydrophobicContact CZ-CG 4.41Å; F87-F91 WeakPolarHBondContact O-CB 3.4Å; F87-F91 PolarHBondContact O-N 2.9Å; F87-F91 VanDerWaalsContact O-N 3.12Å; F91-N93 VanDerWaalsContact C-N 3.33Å; F91-N93 PolarHBondContact O-N 3.43Å; F91-S94 CarbonylContact O-C 3.54Å; F91-S94 WeakPolarHBondContact O-CA 3.25Å; F91-S94 WeakPolarHBondContact O-CB 3.47Å; F91-S94 PolarHBondContact O-N 3.42Å; F91-A95 PolarHBondContact O-N 3.31Å; F91-A95 VanDerWaalsContact O-N 3.12Å; F91-W98 AromaticContact CE2-NE1 3.66Å; F91-L231 HydrophobicContact CE1-CD2 3.51Å; F91-L231 HydrophobicContact CE1-CG 4.18Å; F91-L231 HydrophobicContact CZ-CD2 3.68Å; F91-W232 HydrophobicContact CD1-CH2 4.37Å; F91-W232 AromaticContact CD1-CZ3 3.92Å; F91-W232 HydrophobicContact CD1-CZ3 3.92Å; F91-W232 AromaticContact CE1-CH2 3.72Å; F91-W232 HydrophobicContact CE1-CH2 3.72Å; F91-W232 AromaticContact CE1-CZ3 3.48Å; F91-W232 HydrophobicContact CE1-CZ3 3.48Å; F91-W232 VanDerWaalsContact CE1-CZ3 3.48Å; F91-W232 HydrophobicContact CZ-CH2 4.2Å; F91-W232 HydrophobicContact CZ-CZ3 4.38Å; F91-L235 HydrophobicContact CD1-CD1 3.57Å; F91-L235 HydrophobicContact CE1-CD1 3.77Å |
| 92 | V | 78.6 | Confident | 78.1 | Confident | 0 Ų | 0 | 59.2 Ų | 59.2 | 0% | 0 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -64.2 | -39.6 | 174.7 | 173.2 | 0 | 0 | 0 | 0 | 111.2 | N88 S94 A95 H186 L190 L235 | N88-V92 WeakPolarHBondContact O-CB 3.35Å; N88-V92 WeakPolarHBondContact O-CG2 3.47Å; N88-V92 PolarHBondContact O-N 2.91Å; V92-S94 PolarHBondContact O-N 3.37Å; V92-A95 WeakPolarHBondContact O-CB 3.31Å; V92-A95 PolarHBondContact O-N 3.17Å; V92-H186 HydrophobicContact CG1-CB 3.84Å; V92-L190 HydrophobicContact CG1-CD1 4.04Å; V92-L190 HydrophobicContact CG1-CD2 4.41Å; V92-L190 HydrophobicContact CG1-CG 4.11Å; V92-L190 HydrophobicContact CG2-CD1 4.2Å; V92-L235 HydrophobicContact CG2-CB 4.42Å; V92-L235 HydrophobicContact CG2-CD1 4.38Å |
| 93 | N | 81.4 | Confident | 79.7 | Confident | 86 Ų | 86 | 56.3 Ų | 56.3 | 46% | 0.46 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -62.5 | -25.3 | 173 | -74.3 | -22.3 | 0 | 0 | 0 | 113.1 | I89 F91 H186 | I89-N93 WeakPolarHBondContact O-CB 3.48Å; I89-N93 VanDerWaalsContact O-CG 3.24Å; I89-N93 PolarHBondContact O-N 3.06Å; I89-N93 PolarHBondContact O-ND2 2.75Å; I89-N93 VanDerWaalsContact O-ND2 3.17Å; F91-N93 VanDerWaalsContact C-N 3.33Å; F91-N93 PolarHBondContact O-N 3.43Å; N93-H186 PolarHBondContact OD1-NE2 2.98Å |
| 94 | S | 87.8 | Confident | 81.7 | Confident | 49 Ų | 49 | 50.2 Ų | 50.2 | 34% | 0.343 | 28% | 0.275 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87.4 | -4.8 | 174.8 | -165.2 | 0 | 0 | 0 | 0 | 113.2 | K90 F91 V92 W96 G97 W98 | K90-S94 PolarHBondContact O-N 3.25Å; F91-S94 CarbonylContact O-C 3.54Å; F91-S94 WeakPolarHBondContact O-CA 3.25Å; F91-S94 WeakPolarHBondContact O-CB 3.47Å; F91-S94 PolarHBondContact O-N 3.42Å; V92-S94 PolarHBondContact O-N 3.37Å; S94-W96 VanDerWaalsContact C-N 3.26Å; S94-W96 PolarHBondContact O-N 3.44Å; S94-W96 VanDerWaalsContact O-N 3.15Å; S94-G97 WeakPolarHBondContact O-CA 3.38Å; S94-G97 PolarHBondContact O-N 3.27Å; S94-W98 VanDerWaalsContact O-CD1 3.22Å; S94-W98 PolarHBondContact O-N 3.42Å; S94-W98 PolarHBondContact OG-NE1 3.2Å; S94-W98 VanDerWaalsContact OG-NE1 3.12Å |
| 95 | A | 90.6 | Very high | 83.5 | Confident | 0 Ų | 0 | 48.3 Ų | 48.3 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -56.5 | -38.9 | -172.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | F91 V92 G97 T99 L189 L190 W232 | F91-A95 PolarHBondContact O-N 3.31Å; F91-A95 VanDerWaalsContact O-N 3.12Å; V92-A95 WeakPolarHBondContact O-CB 3.31Å; V92-A95 PolarHBondContact O-N 3.17Å; A95-G97 PolarHBondContact O-N 3.4Å; A95-T99 WeakPolarHBondContact O-CB 3.47Å; A95-T99 PolarHBondContact O-N 2.96Å; A95-T99 PolarHBondContact O-OG1 3.28Å; A95-L189 HydrophobicContact CB-CD2 4.25Å; A95-L190 HydrophobicContact CB-CD2 4.33Å; A95-W232 VanDerWaalsContact CA-CH2 3.42Å; A95-W232 HydrophobicContact CB-CD2 4.43Å; A95-W232 HydrophobicContact CB-CE3 4.06Å; A95-W232 HydrophobicContact CB-CH2 3.59Å; A95-W232 HydrophobicContact CB-CZ2 3.86Å; A95-W232 HydrophobicContact CB-CZ3 3.65Å; A95-W232 WeakPolarHBondContact O-CZ2 3.12Å |
| 96 | W | 93.6 | Very high | 85 | Confident | 18 Ų | 18 | 46.7 Ų | 46.7 | 7% | 0.068 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -63.4 | -40.6 | 175.8 | -174 | -103.9 | 0 | 0 | 0 | 112.8 | S94 T99 C100 L128 G131 A132 W135 L189 F192 L196 | S94-W96 VanDerWaalsContact C-N 3.26Å; S94-W96 PolarHBondContact O-N 3.44Å; S94-W96 VanDerWaalsContact O-N 3.15Å; W96-T99 PolarHBondContact O-N 3.05Å; W96-C100 PolarHBondContact NE1-SG 2.96Å; W96-C100 WeakPolarHBondContact O-CB 3.14Å; W96-C100 PolarHBondContact O-N 2.8Å; W96-C100 PolarHBondContact O-SG 2.59Å; W96-L128 VanDerWaalsContact CZ2-O 3.25Å; W96-L128 WeakPolarHBondContact CZ2-O 3.44Å; W96-G131 VanDerWaalsContact CH2-C 3.44Å; W96-A132 HydrophobicContact CZ2-CB 3.73Å; W96-W135 HydrophobicContact CB-CD2 4.34Å; W96-W135 HydrophobicContact CB-CE3 3.75Å; W96-W135 HydrophobicContact CB-CH2 3.86Å; W96-W135 HydrophobicContact CB-CZ2 4.43Å; W96-W135 HydrophobicContact CB-CZ3 3.5Å; W96-W135 VanDerWaalsContact CB-CZ3 3.5Å; W96-W135 AromaticContact CD1-CE3 3.51Å; W96-W135 AromaticContact CD1-CZ3 3.35Å; W96-W135 AromaticContact CD2-CE3 3.95Å; W96-W135 HydrophobicContact CD2-CE3 3.95Å; W96-W135 HydrophobicContact CD2-CZ3 4.43Å; W96-W135 HydrophobicContact CG-CD2 4.25Å; W96-W135 AromaticContact CG-CE3 3.4Å; W96-W135 HydrophobicContact CG-CE3 3.4Å; W96-W135 HydrophobicContact CG-CH2 4.29Å; W96-W135 AromaticContact CG-CZ3 3.44Å; W96-W135 HydrophobicContact CG-CZ3 3.44Å; W96-W135 VanDerWaalsContact CG-CZ3 3.44Å; W96-L189 HydrophobicContact CB-CD1 4.24Å; W96-L189 HydrophobicContact CE3-CD1 4.25Å; W96-F192 HydrophobicContact CH2-CE1 4.36Å; W96-F192 HydrophobicContact CZ3-CD1 4.2Å; W96-F192 AromaticContact CZ3-CE1 3.9Å; W96-F192 HydrophobicContact CZ3-CE1 3.9Å; W96-L196 HydrophobicContact CH2-CD1 4.08Å; W96-L196 HydrophobicContact CZ3-CD1 4.17Å |
| 97 | G | 93.8 | Very high | 86.7 | Confident | 35 Ų | 35 | 40.7 Ų | 40.7 | 36% | 0.361 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -63.5 | -48.1 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | S94 A95 T99 C100 T101 | S94-G97 WeakPolarHBondContact O-CA 3.38Å; S94-G97 PolarHBondContact O-N 3.27Å; A95-G97 PolarHBondContact O-N 3.4Å; G97-T99 VanDerWaalsContact C-N 3.33Å; G97-T99 PolarHBondContact O-N 3.5Å; G97-C100 PolarHBondContact O-N 3.5Å; G97-T101 PolarHBondContact O-N 2.6Å; G97-T101 PolarHBondContact O-OG1 2.97Å; G97-T101 VanDerWaalsContact O-OG1 3.08Å |
| 98 | W | 94.3 | Very high | 88.4 | Confident | 101 Ų | 101 | 39.5 Ų | 39.5 | 38% | 0.383 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -62.3 | -40.6 | 175.1 | -66 | 111.7 | 0 | 0 | 0 | 112.4 | F91 S94 T101 F102 L228 W232 | F91-W98 AromaticContact CE2-NE1 3.66Å; S94-W98 VanDerWaalsContact O-CD1 3.22Å; S94-W98 PolarHBondContact O-N 3.42Å; S94-W98 PolarHBondContact OG-NE1 3.2Å; S94-W98 VanDerWaalsContact OG-NE1 3.12Å; W98-T101 PolarHBondContact O-N 3.41Å; W98-F102 HydrophobicContact CE3-CD2 4.28Å; W98-F102 AromaticContact CE3-CE2 3.59Å; W98-F102 HydrophobicContact CE3-CE2 3.59Å; W98-F102 HydrophobicContact CE3-CZ 4.36Å; W98-F102 HydrophobicContact CZ3-CE2 4.11Å; W98-F102 HydrophobicContact CZ3-CZ 4.47Å; W98-F102 WeakPolarHBondContact O-CD2 3.48Å; W98-F102 PolarHBondContact O-N 3.43Å; W98-L228 HydrophobicContact CB-CD1 4.26Å; W98-L228 HydrophobicContact CB-CD2 4.32Å; W98-W232 HydrophobicContact CB-CH2 4.18Å; W98-W232 HydrophobicContact CB-CZ2 3.88Å; W98-W232 HydrophobicContact CG-CH2 4.5Å |
| 99 | T | 95.3 | Very high | 89.7 | Confident | 0 Ų | 0 | 41.5 Ų | 41.5 | 0% | 0 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -61.1 | -45.9 | 175.1 | -57.5 | 0 | 0 | 0 | 0 | 110.6 | A95 W96 G97 T101 L103 M197 W232 | A95-T99 WeakPolarHBondContact O-CB 3.47Å; A95-T99 PolarHBondContact O-N 2.96Å; A95-T99 PolarHBondContact O-OG1 3.28Å; W96-T99 PolarHBondContact O-N 3.05Å; G97-T99 VanDerWaalsContact C-N 3.33Å; G97-T99 PolarHBondContact O-N 3.5Å; T99-T101 PolarHBondContact O-N 3.46Å; T99-L103 HydrophobicContact CG2-CB 4.39Å; T99-L103 HydrophobicContact CG2-CD2 4.27Å; T99-L103 WeakPolarHBondContact O-CA 3.27Å; T99-L103 WeakPolarHBondContact O-CB 3.27Å; T99-L103 PolarHBondContact O-N 3.48Å; T99-M197 HydrophobicContact CG2-CG 3.81Å; T99-M197 HydrophobicContact CG2-SD 3.96Å; T99-W232 PolarHBondContact OG1-NE1 2.99Å |
| 100 | C | 95.4 | Very high | 90.9 | Very high | 40 Ų | 40 | 39 Ų | 39 | 27% | 0.27 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -61.3 | -43.5 | 176.5 | -72.4 | 0 | 0 | 0 | 0 | 112.7 | W96 G97 G104 | W96-C100 PolarHBondContact NE1-SG 2.96Å; W96-C100 WeakPolarHBondContact O-CB 3.14Å; W96-C100 PolarHBondContact O-N 2.8Å; W96-C100 PolarHBondContact O-SG 2.59Å; G97-C100 PolarHBondContact O-N 3.5Å; C100-G104 WeakPolarHBondContact O-CA 3.33Å; C100-G104 PolarHBondContact O-N 3.42Å |
| 101 | T | 95.2 | Very high | 91.9 | Very high | 92 Ų | 92 | 33.2 Ų | 33.2 | 56% | 0.564 | 19% | 0.191 | S | C | * | . | H | α-helix | trans | -65.9 | -55.1 | -178.3 | -59.1 | 0 | 0 | 0 | 0 | 111.6 | G97 W98 T99 G105 | G97-T101 PolarHBondContact O-N 2.6Å; G97-T101 PolarHBondContact O-OG1 2.97Å; G97-T101 VanDerWaalsContact O-OG1 3.08Å; W98-T101 PolarHBondContact O-N 3.41Å; T99-T101 PolarHBondContact O-N 3.46Å; T101-G105 PolarHBondContact O-N 3.47Å |
| 102 | F | 95.9 | Very high | 92.6 | Very high | 55 Ų | 55 | 35 Ų | 35 | 24% | 0.241 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -76.2 | -44.1 | -174.9 | -70.4 | -62.2 | 0 | 0 | 0 | 112.2 | W98 F106 L224 N225 L228 | W98-F102 HydrophobicContact CE3-CD2 4.28Å; W98-F102 AromaticContact CE3-CE2 3.59Å; W98-F102 HydrophobicContact CE3-CE2 3.59Å; W98-F102 HydrophobicContact CE3-CZ 4.36Å; W98-F102 HydrophobicContact CZ3-CE2 4.11Å; W98-F102 HydrophobicContact CZ3-CZ 4.47Å; W98-F102 WeakPolarHBondContact O-CD2 3.48Å; W98-F102 PolarHBondContact O-N 3.43Å; F102-F106 WeakPolarHBondContact O-CB 3.49Å; F102-F106 PolarHBondContact O-N 3.01Å; F102-L224 HydrophobicContact CD1-CB 4.12Å; F102-L224 HydrophobicContact CD1-CD1 4.26Å; F102-L224 HydrophobicContact CE1-CB 4.33Å; F102-L224 HydrophobicContact CE1-CD1 3.94Å; F102-N225 VanDerWaalsContact C-ND2 3.3Å; F102-N225 VanDerWaalsContact C-OD1 3.31Å; F102-N225 PolarHBondContact O-ND2 3Å; F102-L228 HydrophobicContact CB-CD2 4.17Å; F102-L228 HydrophobicContact CD2-CD2 3.85Å; F102-L228 HydrophobicContact CG-CD2 4.44Å |
| 103 | L | 96.3 | Very high | 93.2 | Very high | 0 Ų | 0 | 37.2 Ų | 37.2 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -74.5 | -37.8 | -179.2 | -164.3 | 67.3 | 0 | 0 | 0 | 111.5 | T99 F106 V107 L128 L196 M197 E200 N225 | T99-L103 HydrophobicContact CG2-CB 4.39Å; T99-L103 HydrophobicContact CG2-CD2 4.27Å; T99-L103 WeakPolarHBondContact O-CA 3.27Å; T99-L103 WeakPolarHBondContact O-CB 3.27Å; T99-L103 PolarHBondContact O-N 3.48Å; L103-F106 HydrophobicContact CD1-CD1 4.16Å; L103-F106 PolarHBondContact O-N 2.91Å; L103-V107 HydrophobicContact CG-CG2 4.49Å; L103-V107 WeakPolarHBondContact O-CB 3.39Å; L103-V107 WeakPolarHBondContact O-CG2 3.41Å; L103-V107 PolarHBondContact O-N 3.13Å; L103-L128 HydrophobicContact CD2-CD2 4.2Å; L103-L196 HydrophobicContact CD2-CD2 3.16Å; L103-M197 HydrophobicContact CD1-CG 4.44Å; L103-M197 HydrophobicContact CD2-CG 3.91Å; L103-E200 HydrophobicContact CD1-CB 3.8Å; L103-E200 HydrophobicContact CD2-CB 3.97Å; L103-E200 HydrophobicContact CD2-CG 3.86Å; L103-E200 HydrophobicContact CG-CB 4.14Å; L103-E200 HydrophobicContact CG-CG 4.4Å; L103-N225 WeakPolarHBondContact CA-OD1 3.25Å; L103-N225 WeakPolarHBondContact CB-OD1 3.16Å; L103-N225 WeakPolarHBondContact CD1-OD1 3.36Å; L103-N225 PolarHBondContact N-OD1 2.83Å; L103-N225 VanDerWaalsContact N-OD1 3.1Å |
| 104 | G | 95.6 | Very high | 93.5 | Very high | 9 Ų | 9 | 34.4 Ų | 34.4 | 9% | 0.093 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -62.2 | -44.6 | 173 | 0 | 0 | 0 | 0 | 0 | 111.9 | C100 F106 V107 L108 L128 | C100-G104 WeakPolarHBondContact O-CA 3.33Å; C100-G104 PolarHBondContact O-N 3.42Å; G104-F106 VanDerWaalsContact C-N 3.33Å; G104-F106 PolarHBondContact O-N 2.99Å; G104-V107 PolarHBondContact O-N 3.36Å; G104-L108 WeakPolarHBondContact O-CB 3.46Å; G104-L108 PolarHBondContact O-N 3.31Å; G104-L128 VanDerWaalsContact CA-CD1 3.4Å |
| 105 | G | 95.6 | Very high | 93.6 | Very high | 28 Ų | 28 | 33.5 Ų | 33.5 | 29% | 0.289 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -58.9 | -43.2 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | T101 L109 | T101-G105 PolarHBondContact O-N 3.47Å; G105-L109 WeakPolarHBondContact O-CB 3.24Å; G105-L109 VanDerWaalsContact O-CG 3.31Å; G105-L109 WeakPolarHBondContact O-CG 3.32Å; G105-L109 PolarHBondContact O-N 3.26Å |
| 106 | F | 96.1 | Very high | 93.4 | Very high | 2 Ų | 2 | 41.3 Ų | 41.3 | 1% | 0.009 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -62.4 | -52.4 | 175.8 | 169.7 | -104.5 | 0 | 0 | 0 | 112.4 | F102 L103 G104 L108 L109 V110 E200 F204 L218 V221 F222 | F102-F106 WeakPolarHBondContact O-CB 3.49Å; F102-F106 PolarHBondContact O-N 3.01Å; L103-F106 HydrophobicContact CD1-CD1 4.16Å; L103-F106 PolarHBondContact O-N 2.91Å; G104-F106 VanDerWaalsContact C-N 3.33Å; G104-F106 PolarHBondContact O-N 2.99Å; F106-L108 VanDerWaalsContact C-N 3.31Å; F106-L108 PolarHBondContact O-N 2.81Å; F106-L109 PolarHBondContact O-N 3.5Å; F106-V110 HydrophobicContact CD2-CG2 3.81Å; F106-V110 HydrophobicContact CE1-CG2 4.1Å; F106-V110 HydrophobicContact CE2-CG2 3.31Å; F106-V110 HydrophobicContact CG-CG2 4.39Å; F106-V110 HydrophobicContact CZ-CG2 3.47Å; F106-V110 VanDerWaalsContact CZ-CG2 3.47Å; F106-V110 WeakPolarHBondContact O-CG2 3.35Å; F106-V110 PolarHBondContact O-N 3.47Å; F106-E200 WeakPolarHBondContact CE1-O 3.12Å; F106-F204 HydrophobicContact CE2-CB 4.21Å; F106-F204 HydrophobicContact CE2-CD2 4.03Å; F106-F204 HydrophobicContact CE2-CG 4.13Å; F106-F204 HydrophobicContact CZ-CB 3.88Å; F106-F204 HydrophobicContact CZ-CD2 4.35Å; F106-F204 HydrophobicContact CZ-CG 4.29Å; F106-L218 HydrophobicContact CD2-CD1 4Å; F106-L218 HydrophobicContact CE2-CD1 4.17Å; F106-V221 HydrophobicContact CB-CG1 3.89Å; F106-F222 HydrophobicContact CD2-CB 4Å; F106-F222 HydrophobicContact CD2-CD2 4.23Å; F106-F222 HydrophobicContact CE2-CB 3.93Å; F106-F222 AromaticContact CE2-CD2 3.61Å; F106-F222 HydrophobicContact CE2-CD2 3.61Å; F106-F222 HydrophobicContact CE2-CG 4.21Å; F106-F222 AromaticContact CZ-CD2 3.98Å; F106-F222 HydrophobicContact CZ-CD2 3.98Å |
| 107 | V | 94.6 | Very high | 93.2 | Very high | 7 Ų | 7 | 48.8 Ų | 48.8 | 4% | 0.042 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -60.6 | -42.8 | 179.7 | 170.9 | 0 | 0 | 0 | 0 | 110.7 | L103 G104 L109 V111 H124 L125 E200 | L103-V107 HydrophobicContact CG-CG2 4.49Å; L103-V107 WeakPolarHBondContact O-CB 3.39Å; L103-V107 WeakPolarHBondContact O-CG2 3.41Å; L103-V107 PolarHBondContact O-N 3.13Å; G104-V107 PolarHBondContact O-N 3.36Å; V107-L109 PolarHBondContact O-N 3.18Å; V107-V111 HydrophobicContact CG1-CG2 4.13Å; V107-V111 VanDerWaalsContact O-CB 3.32Å; V107-V111 WeakPolarHBondContact O-CB 3.42Å; V107-V111 VanDerWaalsContact O-CG2 3.23Å; V107-V111 WeakPolarHBondContact O-CG2 3.43Å; V107-V111 PolarHBondContact O-N 3.02Å; V107-H124 HydrophobicContact CG1-CB 3.89Å; V107-L125 HydrophobicContact CB-CD2 4.2Å; V107-L125 HydrophobicContact CG1-CD2 4.04Å; V107-L125 HydrophobicContact CG1-CG 4.43Å; V107-E200 HydrophobicContact CG2-CB 4.48Å |
| 108 | L | 94.9 | Very high | 93.1 | Very high | 79 Ų | 79 | 52.3 Ų | 52.3 | 41% | 0.414 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -56.6 | -51.5 | 175.9 | -177.5 | 151.1 | 0 | 0 | 0 | 110.7 | G104 F106 F112 T121 L125 | G104-L108 WeakPolarHBondContact O-CB 3.46Å; G104-L108 PolarHBondContact O-N 3.31Å; F106-L108 VanDerWaalsContact C-N 3.31Å; F106-L108 PolarHBondContact O-N 2.81Å; L108-F112 WeakPolarHBondContact O-CB 3.36Å; L108-F112 PolarHBondContact O-N 3.02Å; L108-T121 HydrophobicContact CG-CG2 4.31Å; L108-L125 HydrophobicContact CB-CD1 4.35Å; L108-L125 HydrophobicContact CB-CD2 4.4Å; L108-L125 HydrophobicContact CD1-CD1 4.24Å |
| 109 | L | 93.6 | Very high | 92.9 | Very high | 49 Ų | 49 | 51.4 Ų | 51.4 | 26% | 0.257 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -66 | -48.7 | -178.5 | -71.6 | 172.9 | 0 | 0 | 0 | 112.2 | G105 F106 V107 V111 L113 L218 V221 | G105-L109 WeakPolarHBondContact O-CB 3.24Å; G105-L109 VanDerWaalsContact O-CG 3.31Å; G105-L109 WeakPolarHBondContact O-CG 3.32Å; G105-L109 PolarHBondContact O-N 3.26Å; F106-L109 PolarHBondContact O-N 3.5Å; V107-L109 PolarHBondContact O-N 3.18Å; L109-V111 PolarHBondContact O-N 3.2Å; L109-L113 WeakPolarHBondContact O-CB 3.44Å; L109-L113 WeakPolarHBondContact O-CD1 3.26Å; L109-L113 WeakPolarHBondContact O-CG 3.21Å; L109-L113 PolarHBondContact O-N 3.44Å; L109-L218 HydrophobicContact CB-CD1 3.8Å; L109-V221 HydrophobicContact CD1-CG2 4.16Å |
| 110 | V | 93.2 | Very high | 92.6 | Very high | 3 Ų | 3 | 53.2 Ų | 53.2 | 2% | 0.018 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -58.3 | -50.3 | -179.7 | 168.8 | 0 | 0 | 0 | 0 | 111.1 | F106 A114 V203 F204 Y207 L218 | F106-V110 HydrophobicContact CD2-CG2 3.81Å; F106-V110 HydrophobicContact CE1-CG2 4.1Å; F106-V110 HydrophobicContact CE2-CG2 3.31Å; F106-V110 HydrophobicContact CG-CG2 4.39Å; F106-V110 HydrophobicContact CZ-CG2 3.47Å; F106-V110 VanDerWaalsContact CZ-CG2 3.47Å; F106-V110 WeakPolarHBondContact O-CG2 3.35Å; F106-V110 PolarHBondContact O-N 3.47Å; V110-A114 VanDerWaalsContact O-CB 3.29Å; V110-A114 WeakPolarHBondContact O-CB 3.31Å; V110-A114 PolarHBondContact O-N 3.31Å; V110-A114 VanDerWaalsContact O-N 3.08Å; V110-V203 HydrophobicContact CG1-CG1 4.34Å; V110-F204 HydrophobicContact CG2-CD2 4.35Å; V110-Y207 HydrophobicContact CG1-CD2 3.8Å; V110-Y207 HydrophobicContact CG1-CE2 4.27Å; V110-Y207 HydrophobicContact CG1-CG 4.49Å; V110-L218 HydrophobicContact CG2-CD1 3.51Å; V110-L218 HydrophobicContact CG2-CD2 4.31Å; V110-L218 HydrophobicContact CG2-CG 4.48Å |
| 111 | V | 92.3 | Very high | 92.4 | Very high | 4 Ų | 4 | 51.8 Ų | 51.8 | 2% | 0.024 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -73.8 | -41.1 | -173.2 | 178.4 | 0 | 0 | 0 | 0 | 111.4 | V107 L109 A114 T115 V120 T121 H124 L281 | V107-V111 HydrophobicContact CG1-CG2 4.13Å; V107-V111 VanDerWaalsContact O-CB 3.32Å; V107-V111 WeakPolarHBondContact O-CB 3.42Å; V107-V111 VanDerWaalsContact O-CG2 3.23Å; V107-V111 WeakPolarHBondContact O-CG2 3.43Å; V107-V111 PolarHBondContact O-N 3.02Å; L109-V111 PolarHBondContact O-N 3.2Å; V111-A114 PolarHBondContact O-N 2.91Å; V111-T115 PolarHBondContact O-N 3.29Å; V111-T115 PolarHBondContact O-OG1 3.49Å; V111-V120 HydrophobicContact CG1-CG1 3.99Å; V111-T121 HydrophobicContact CB-CG2 4.45Å; V111-H124 HydrophobicContact CG2-CB 4.02Å; V111-L281 HydrophobicContact CB-CD2 4.23Å; V111-L281 HydrophobicContact CG1-CD2 4.13Å; V111-L281 HydrophobicContact CG2-CD1 4.1Å; V111-L281 HydrophobicContact CG2-CD2 4.11Å |
| 112 | F | 91.4 | Very high | 92.3 | Very high | 77 Ų | 77 | 49.9 Ų | 49.9 | 34% | 0.338 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -67 | -40.7 | 178.4 | -175 | -104.8 | 0 | 0 | 0 | 112 | L108 R116 T121 | L108-F112 WeakPolarHBondContact O-CB 3.36Å; L108-F112 PolarHBondContact O-N 3.02Å; F112-R116 VanDerWaalsContact O-CA 3.23Å; F112-R116 WeakPolarHBondContact O-CA 3.39Å; F112-R116 WeakPolarHBondContact O-CD 3.44Å; F112-R116 PolarHBondContact O-N 2.91Å; F112-T121 HydrophobicContact CB-CG2 4.49Å |
| 113 | L | 90.5 | Very high | 92.1 | Very high | 48 Ų | 48 | 52.4 Ų | 52.4 | 25% | 0.251 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -68.8 | -35.6 | 177.2 | -70.4 | 170.6 | 0 | 0 | 0 | 112.4 | L109 L218 | L109-L113 WeakPolarHBondContact O-CB 3.44Å; L109-L113 WeakPolarHBondContact O-CD1 3.26Å; L109-L113 WeakPolarHBondContact O-CG 3.21Å; L109-L113 PolarHBondContact O-N 3.44Å; L113-L218 HydrophobicContact CD1-CB 4.5Å; L113-L218 HydrophobicContact CD1-CD2 4.1Å |
| 114 | A | 88.3 | Confident | 91.9 | Very high | 27 Ų | 27 | 52.7 Ų | 52.7 | 22% | 0.223 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -72.3 | -43.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | V110 V111 Y207 L212 L281 | V110-A114 VanDerWaalsContact O-CB 3.29Å; V110-A114 WeakPolarHBondContact O-CB 3.31Å; V110-A114 PolarHBondContact O-N 3.31Å; V110-A114 VanDerWaalsContact O-N 3.08Å; V111-A114 PolarHBondContact O-N 2.91Å; A114-Y207 HydrophobicContact CB-CD2 4.4Å; A114-Y207 HydrophobicContact CB-CE2 3.98Å; A114-L212 HydrophobicContact CB-CD1 4Å; A114-L281 HydrophobicContact CB-CD2 3.5Å; A114-L281 VanDerWaalsContact CB-CD2 3.5Å |
| 115 | T | 88.3 | Confident | 91.8 | Very high | 29 Ų | 29 | 54.4 Ų | 54.4 | 18% | 0.178 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -110.5 | -23.8 | -168.2 | 65.8 | 0 | 0 | 0 | 0 | 114.6 | V111 R117 V120 L281 | V111-T115 PolarHBondContact O-N 3.29Å; V111-T115 PolarHBondContact O-OG1 3.49Å; T115-R117 WeakPolarHBondContact O-CG 3.34Å; T115-R117 PolarHBondContact O-N 3.15Å; T115-R117 PolarHBondContact OG1-N 2.96Å; T115-V120 HydrophobicContact CG2-CG1 4.21Å; T115-L281 HydrophobicContact CG2-CD2 3.81Å; T115-L281 HydrophobicContact CG2-CG 4.43Å |
| 116 | R | 87.5 | Confident | 91.7 | Very high | 164 Ų | 164 | 54.9 Ų | 54.9 | 62% | 0.619 | 29% | 0.287 | S | S | * | . | trans | 56 | 11.6 | -170.5 | -58 | -68.3 | -173.2 | 167.6 | 4.3 | 115 | F112 | F112-R116 VanDerWaalsContact O-CA 3.23Å; F112-R116 WeakPolarHBondContact O-CA 3.39Å; F112-R116 WeakPolarHBondContact O-CD 3.44Å; F112-R116 PolarHBondContact O-N 2.91Å | ||
| 117 | R | 90.1 | Very high | 91.6 | Very high | 176 Ų | 176 | 55 Ų | 55 | 66% | 0.664 | 29% | 0.288 | S | S | * | . | trans | -107.8 | 115.6 | -175.8 | -70.6 | 176.9 | -172.9 | -170.4 | 1.2 | 111.2 | T115 A119 V120 T121 | T115-R117 WeakPolarHBondContact O-CG 3.34Å; T115-R117 PolarHBondContact O-N 3.15Å; T115-R117 PolarHBondContact OG1-N 2.96Å; R117-A119 VanDerWaalsContact C-N 3.31Å; R117-A119 PolarHBondContact O-N 2.97Å; R117-V120 HydrophobicContact CB-CB 4.28Å; R117-V120 HydrophobicContact CB-CG2 3.93Å; R117-V120 PolarHBondContact O-N 2.6Å; R117-T121 PolarHBondContact O-N 2.86Å; R117-T121 VanDerWaalsContact O-N 3.15Å; R117-T121 PolarHBondContact O-OG1 3.26Å | ||
| 118 | V | 91.1 | Very high | 91.6 | Very high | 108 Ų | 108 | 55.6 Ų | 55.6 | 66% | 0.655 | 29% | 0.291 | S | S | * | . | H | α-helix | trans | -59.3 | -40 | -179.2 | -179.2 | 0 | 0 | 0 | 0 | 112.1 | V120 T121 A122 | V118-V120 VanDerWaalsContact C-N 3.31Å; V118-V120 PolarHBondContact O-N 3.26Å; V118-T121 PolarHBondContact O-N 2.89Å; V118-A122 WeakPolarHBondContact O-CB 3.34Å; V118-A122 PolarHBondContact O-N 3.45Å |
| 119 | A | 90.3 | Very high | 91.6 | Very high | 82 Ų | 82 | 56.8 Ų | 56.8 | 68% | 0.678 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -60.8 | -38.8 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | R117 R123 | R117-A119 VanDerWaalsContact C-N 3.31Å; R117-A119 PolarHBondContact O-N 2.97Å; A119-R123 WeakPolarHBondContact O-CB 3.36Å; A119-R123 PolarHBondContact O-N 2.78Å |
| 120 | V | 89.3 | Confident | 91.7 | Very high | 39 Ų | 39 | 55.5 Ų | 55.5 | 24% | 0.236 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -71.4 | -43.5 | 178.1 | -177.8 | 0 | 0 | 0 | 0 | 110 | V111 T115 R117 V118 A122 R123 H124 | V111-V120 HydrophobicContact CG1-CG1 3.99Å; T115-V120 HydrophobicContact CG2-CG1 4.21Å; R117-V120 HydrophobicContact CB-CB 4.28Å; R117-V120 HydrophobicContact CB-CG2 3.93Å; R117-V120 PolarHBondContact O-N 2.6Å; V118-V120 VanDerWaalsContact C-N 3.31Å; V118-V120 PolarHBondContact O-N 3.26Å; V120-A122 PolarHBondContact O-N 3.15Å; V120-R123 WeakPolarHBondContact O-CB 3.48Å; V120-R123 PolarHBondContact O-N 3.21Å; V120-H124 PolarHBondContact O-CD2 3.12Å; V120-H124 PolarHBondContact O-N 3.47Å |
| 121 | T | 91.1 | Very high | 91.7 | Very high | 9 Ų | 9 | 55.4 Ų | 55.4 | 6% | 0.055 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -58.9 | -47.6 | 174.1 | -53.3 | 0 | 0 | 0 | 0 | 112.2 | L108 V111 F112 R117 V118 R123 H124 L125 | L108-T121 HydrophobicContact CG-CG2 4.31Å; V111-T121 HydrophobicContact CB-CG2 4.45Å; F112-T121 HydrophobicContact CB-CG2 4.49Å; R117-T121 PolarHBondContact O-N 2.86Å; R117-T121 VanDerWaalsContact O-N 3.15Å; R117-T121 PolarHBondContact O-OG1 3.26Å; V118-T121 PolarHBondContact O-N 2.89Å; T121-R123 VanDerWaalsContact C-N 3.33Å; T121-R123 PolarHBondContact O-N 2.92Å; T121-H124 PolarHBondContact O-N 3.2Å; T121-L125 HydrophobicContact CG2-CD1 4.06Å; T121-L125 HydrophobicContact CG2-CG 4.48Å; T121-L125 WeakPolarHBondContact O-CG 3Å; T121-L125 PolarHBondContact O-N 3.35Å |
| 122 | A | 91.8 | Very high | 91.9 | Very high | 53 Ų | 53 | 55.8 Ų | 55.8 | 44% | 0.438 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -61.1 | -41.9 | 178 | 0 | 0 | 0 | 0 | 0 | 111.7 | V118 V120 H124 L125 S126 | V118-A122 WeakPolarHBondContact O-CB 3.34Å; V118-A122 PolarHBondContact O-N 3.45Å; V120-A122 PolarHBondContact O-N 3.15Å; A122-H124 PolarHBondContact O-N 3.3Å; A122-L125 PolarHBondContact O-N 3.12Å; A122-S126 PolarHBondContact O-N 2.96Å |
| 123 | R | 91.9 | Very high | 92 | Very high | 107 Ų | 107 | 55 Ų | 55 | 40% | 0.404 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -58.4 | -46.8 | 173.9 | -175.7 | -178.6 | 176.8 | 155.8 | 4 | 111.4 | A119 V120 T121 L125 S126 P271 S273 P274 | A119-R123 WeakPolarHBondContact O-CB 3.36Å; A119-R123 PolarHBondContact O-N 2.78Å; V120-R123 WeakPolarHBondContact O-CB 3.48Å; V120-R123 PolarHBondContact O-N 3.21Å; T121-R123 VanDerWaalsContact C-N 3.33Å; T121-R123 PolarHBondContact O-N 2.92Å; R123-L125 PolarHBondContact O-N 3.12Å; R123-S126 WeakPolarHBondContact O-CB 3.09Å; R123-S126 PolarHBondContact O-N 3.17Å; R123-S126 PolarHBondContact O-OG 3.18Å; R123-P271 PolarHBondContact NH2-O 3.36Å; R123-P271 VanDerWaalsContact NH2-O 3.08Å; R123-S273 PolarHBondContact NE-O 2.87Å; R123-S273 PolarHBondContact NH2-O 2.85Å; R123-P274 VanDerWaalsContact CG-O 3.32Å; R123-P274 WeakPolarHBondContact CG-O 3.21Å; R123-P274 PolarHBondContact NE-O 3.02Å |
| 124 | H | 91.6 | Very high | 92.3 | Very high | 6 Ų | 6 | 54.6 Ų | 54.6 | 3% | 0.028 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -68.5 | -34.1 | 178.1 | -77.2 | -69.8 | 0 | 0 | 0 | 113.6 | V107 V111 V120 T121 A122 S126 R127 H279 | V107-H124 HydrophobicContact CG1-CB 3.89Å; V111-H124 HydrophobicContact CG2-CB 4.02Å; V120-H124 PolarHBondContact O-CD2 3.12Å; V120-H124 PolarHBondContact O-N 3.47Å; T121-H124 PolarHBondContact O-N 3.2Å; A122-H124 PolarHBondContact O-N 3.3Å; H124-S126 VanDerWaalsContact C-N 3.32Å; H124-R127 PolarHBondContact ND1-NH2 3.48Å; H124-R127 WeakPolarHBondContact O-CB 3.42Å; H124-R127 PolarHBondContact O-N 3.03Å; H124-R127 PolarHBondContact O-NE 3.07Å; H124-H279 PolarHBondContact CE1-O 2.87Å; H124-H279 PolarHBondContact NE2-O 2.85Å |
| 125 | L | 93.9 | Very high | 92.5 | Very high | 45 Ų | 45 | 56.5 Ų | 56.5 | 24% | 0.236 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -69.7 | -27.9 | 174.2 | -73.6 | 172.8 | 0 | 0 | 0 | 112.8 | V107 L108 T121 A122 R123 R127 L128 | V107-L125 HydrophobicContact CB-CD2 4.2Å; V107-L125 HydrophobicContact CG1-CD2 4.04Å; V107-L125 HydrophobicContact CG1-CG 4.43Å; L108-L125 HydrophobicContact CB-CD1 4.35Å; L108-L125 HydrophobicContact CB-CD2 4.4Å; L108-L125 HydrophobicContact CD1-CD1 4.24Å; T121-L125 HydrophobicContact CG2-CD1 4.06Å; T121-L125 HydrophobicContact CG2-CG 4.48Å; T121-L125 WeakPolarHBondContact O-CG 3Å; T121-L125 PolarHBondContact O-N 3.35Å; A122-L125 PolarHBondContact O-N 3.12Å; R123-L125 PolarHBondContact O-N 3.12Å; L125-R127 PolarHBondContact O-N 2.77Å; L125-L128 HydrophobicContact CD2-CD1 4.32Å; L125-L128 WeakPolarHBondContact O-CB 3.49Å; L125-L128 PolarHBondContact O-N 2.91Å |
| 126 | S | 94.1 | Very high | 92.8 | Very high | 38 Ų | 38 | 63.3 Ų | 63.3 | 27% | 0.266 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -58.7 | -21 | 175.8 | 77.9 | 0 | 0 | 0 | 0 | 113.1 | A122 R123 H124 L128 V129 V130 P274 | A122-S126 PolarHBondContact O-N 2.96Å; R123-S126 WeakPolarHBondContact O-CB 3.09Å; R123-S126 PolarHBondContact O-N 3.17Å; R123-S126 PolarHBondContact O-OG 3.18Å; H124-S126 VanDerWaalsContact C-N 3.32Å; S126-L128 VanDerWaalsContact C-N 3.27Å; S126-L128 PolarHBondContact O-N 3.3Å; S126-V129 WeakPolarHBondContact O-CA 3.5Å; S126-V129 WeakPolarHBondContact O-CB 3.39Å; S126-V129 PolarHBondContact O-N 3Å; S126-V130 WeakPolarHBondContact O-CG2 3.28Å; S126-V130 PolarHBondContact O-N 3.17Å; S126-P274 WeakPolarHBondContact OG-CG 3.3Å |
| 127 | R | 94.3 | Very high | 93.1 | Very high | 5 Ų | 5 | 57.4 Ų | 57.4 | 2% | 0.019 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -62.5 | -31.5 | 173 | -65.4 | 180 | -69.4 | 157 | 11.1 | 113 | H124 L125 G131 E200 Y268 P274 P277 | H124-R127 PolarHBondContact ND1-NH2 3.48Å; H124-R127 WeakPolarHBondContact O-CB 3.42Å; H124-R127 PolarHBondContact O-N 3.03Å; H124-R127 PolarHBondContact O-NE 3.07Å; L125-R127 PolarHBondContact O-N 2.77Å; R127-G131 PolarHBondContact O-N 3.43Å; R127-E200 IonicContact CZ-OE1 3.88Å; R127-E200 IonicContact CZ-OE2 3.48Å; R127-E200 IonicContact NE-OE1 3Å; R127-E200 PolarHBondContact NE-OE1 2.77Å; R127-E200 IonicContact NH1-OE1 2.67Å; R127-E200 PolarHBondContact NH1-OE1 3.27Å; R127-E200 IonicContact NH1-OE2 3.07Å; R127-E200 PolarHBondContact NH1-OE2 3.31Å; R127-E200 VanDerWaalsContact NH2-CD 3.35Å; R127-E200 IonicContact NH2-OE1 2.77Å; R127-E200 PolarHBondContact NH2-OE1 3.39Å; R127-E200 IonicContact NH2-OE2 3.5Å; R127-E200 PolarHBondContact NH2-OE2 3.02Å; R127-Y268 WeakPolarHBondContact CA-OH 3.39Å; R127-Y268 HydrophobicContact CB-CE2 4.08Å; R127-Y268 WeakPolarHBondContact CB-OH 3.35Å; R127-Y268 HydrophobicContact CG-CD2 4.4Å; R127-Y268 HydrophobicContact CG-CE1 4.2Å; R127-Y268 HydrophobicContact CG-CE2 3.69Å; R127-Y268 PolarHBondContact O-OH 2.89Å; R127-P274 HydrophobicContact CG-CB 3.41Å; R127-P274 VanDerWaalsContact CG-CB 3.41Å; R127-P274 HydrophobicContact CG-CG 4.07Å; R127-P277 VanDerWaalsContact NH1-CA 3.3Å |
| 128 | L | 94.8 | Very high | 93.3 | Very high | 20 Ų | 20 | 49.7 Ų | 49.7 | 11% | 0.105 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -70.1 | -38.9 | 171.5 | -66 | 174.8 | 0 | 0 | 0 | 110.9 | W96 L103 G104 L125 S126 V130 G131 A132 L196 | W96-L128 VanDerWaalsContact CZ2-O 3.25Å; W96-L128 WeakPolarHBondContact CZ2-O 3.44Å; L103-L128 HydrophobicContact CD2-CD2 4.2Å; G104-L128 VanDerWaalsContact CA-CD1 3.4Å; L125-L128 HydrophobicContact CD2-CD1 4.32Å; L125-L128 WeakPolarHBondContact O-CB 3.49Å; L125-L128 PolarHBondContact O-N 2.91Å; S126-L128 VanDerWaalsContact C-N 3.27Å; S126-L128 PolarHBondContact O-N 3.3Å; L128-V130 VanDerWaalsContact C-N 3.32Å; L128-V130 PolarHBondContact O-N 2.84Å; L128-G131 PolarHBondContact O-N 3.24Å; L128-A132 PolarHBondContact O-N 3.29Å; L128-L196 HydrophobicContact CD2-CD2 4.27Å |
| 129 | V | 94.8 | Very high | 93.3 | Very high | 104 Ų | 104 | 45.9 Ų | 45.9 | 63% | 0.63 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -61.9 | -43.9 | 174.8 | -177.6 | 0 | 0 | 0 | 0 | 110.5 | S126 A132 A133 | S126-V129 WeakPolarHBondContact O-CA 3.5Å; S126-V129 WeakPolarHBondContact O-CB 3.39Å; S126-V129 PolarHBondContact O-N 3Å; V129-A132 WeakPolarHBondContact O-CB 3.06Å; V129-A132 PolarHBondContact O-N 3.41Å; V129-A133 PolarHBondContact O-N 3.48Å |
| 130 | V | 94.9 | Very high | 93.4 | Very high | 21 Ų | 21 | 51.2 Ų | 51.2 | 13% | 0.127 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -58.1 | -48.4 | 172.5 | 167.4 | 0 | 0 | 0 | 0 | 111.1 | S126 L128 A132 A133 V134 T263 W267 Y268 P274 | S126-V130 WeakPolarHBondContact O-CG2 3.28Å; S126-V130 PolarHBondContact O-N 3.17Å; L128-V130 VanDerWaalsContact C-N 3.32Å; L128-V130 PolarHBondContact O-N 2.84Å; V130-A132 VanDerWaalsContact C-N 3.28Å; V130-A132 PolarHBondContact O-N 3.45Å; V130-A133 WeakPolarHBondContact O-CB 3.46Å; V130-A133 PolarHBondContact O-N 2.93Å; V130-A133 VanDerWaalsContact O-N 3.1Å; V130-V134 HydrophobicContact CG1-CG2 4.36Å; V130-V134 WeakPolarHBondContact O-CG2 3.47Å; V130-V134 PolarHBondContact O-N 3.27Å; V130-T263 HydrophobicContact CG1-CG2 4.03Å; V130-W267 HydrophobicContact CB-CZ3 4.28Å; V130-W267 HydrophobicContact CG1-CE3 4.14Å; V130-W267 HydrophobicContact CG1-CH2 4.29Å; V130-W267 HydrophobicContact CG1-CZ3 3.43Å; V130-W267 VanDerWaalsContact CG1-CZ3 3.43Å; V130-W267 HydrophobicContact CG2-CH2 3.82Å; V130-W267 HydrophobicContact CG2-CZ3 3.81Å; V130-Y268 HydrophobicContact CG1-CE1 4.34Å; V130-Y268 WeakPolarHBondContact CG1-OH 3.38Å; V130-P274 HydrophobicContact CG2-CG 4.39Å |
| 131 | G | 94.6 | Very high | 93.6 | Very high | 1 Ų | 1 | 51.5 Ų | 51.5 | 1% | 0.01 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -59.6 | -37.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | W96 R127 L128 V134 W135 | W96-G131 VanDerWaalsContact CH2-C 3.44Å; R127-G131 PolarHBondContact O-N 3.43Å; L128-G131 PolarHBondContact O-N 3.24Å; G131-V134 PolarHBondContact O-N 3.11Å; G131-W135 WeakPolarHBondContact O-CB 3.27Å; G131-W135 PolarHBondContact O-N 3.34Å |
| 132 | A | 94.8 | Very high | 93.7 | Very high | 12 Ų | 12 | 51.8 Ų | 51.8 | 10% | 0.099 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -67 | -38.8 | 175 | 0 | 0 | 0 | 0 | 0 | 112 | W96 L128 V129 V130 R136 | W96-A132 HydrophobicContact CZ2-CB 3.73Å; L128-A132 PolarHBondContact O-N 3.29Å; V129-A132 WeakPolarHBondContact O-CB 3.06Å; V129-A132 PolarHBondContact O-N 3.41Å; V130-A132 VanDerWaalsContact C-N 3.28Å; V130-A132 PolarHBondContact O-N 3.45Å; A132-R136 WeakPolarHBondContact O-CG 3.41Å; A132-R136 PolarHBondContact O-N 3.23Å |
| 133 | A | 95.2 | Very high | 93.5 | Very high | 61 Ų | 61 | 53.2 Ų | 53.2 | 50% | 0.504 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -65.1 | -44.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | V129 V130 R136 G137 | V129-A133 PolarHBondContact O-N 3.48Å; V130-A133 WeakPolarHBondContact O-CB 3.46Å; V130-A133 PolarHBondContact O-N 2.93Å; V130-A133 VanDerWaalsContact O-N 3.1Å; A133-R136 PolarHBondContact O-N 3.19Å; A133-G137 PolarHBondContact O-N 2.95Å |
| 134 | V | 95.1 | Very high | 93.4 | Very high | 39 Ų | 39 | 53 Ų | 53 | 24% | 0.236 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -60.1 | -46.5 | 175 | 168.7 | 0 | 0 | 0 | 0 | 111.1 | V130 G131 G137 A138 F192 A259 T263 | V130-V134 HydrophobicContact CG1-CG2 4.36Å; V130-V134 WeakPolarHBondContact O-CG2 3.47Å; V130-V134 PolarHBondContact O-N 3.27Å; G131-V134 PolarHBondContact O-N 3.11Å; V134-G137 PolarHBondContact O-N 3.45Å; V134-A138 WeakPolarHBondContact O-CB 3.38Å; V134-A138 PolarHBondContact O-N 2.89Å; V134-F192 HydrophobicContact CB-CZ 4.28Å; V134-F192 HydrophobicContact CG1-CE1 4.47Å; V134-F192 HydrophobicContact CG1-CE2 4.15Å; V134-F192 HydrophobicContact CG1-CZ 3.96Å; V134-A259 HydrophobicContact CG1-CB 3.73Å; V134-T263 HydrophobicContact CG2-CG2 4.03Å |
| 135 | W | 93.9 | Very high | 93.3 | Very high | 68 Ų | 68 | 55.8 Ų | 55.8 | 26% | 0.258 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -60.6 | -48.5 | 177.4 | 169.5 | 38.2 | 0 | 0 | 0 | 112.3 | W96 G131 G137 A138 G139 F188 L189 | W96-W135 HydrophobicContact CB-CD2 4.34Å; W96-W135 HydrophobicContact CB-CE3 3.75Å; W96-W135 HydrophobicContact CB-CH2 3.86Å; W96-W135 HydrophobicContact CB-CZ2 4.43Å; W96-W135 HydrophobicContact CB-CZ3 3.5Å; W96-W135 VanDerWaalsContact CB-CZ3 3.5Å; W96-W135 AromaticContact CD1-CE3 3.51Å; W96-W135 AromaticContact CD1-CZ3 3.35Å; W96-W135 AromaticContact CD2-CE3 3.95Å; W96-W135 HydrophobicContact CD2-CE3 3.95Å; W96-W135 HydrophobicContact CD2-CZ3 4.43Å; W96-W135 HydrophobicContact CG-CD2 4.25Å; W96-W135 AromaticContact CG-CE3 3.4Å; W96-W135 HydrophobicContact CG-CE3 3.4Å; W96-W135 HydrophobicContact CG-CH2 4.29Å; W96-W135 AromaticContact CG-CZ3 3.44Å; W96-W135 HydrophobicContact CG-CZ3 3.44Å; W96-W135 VanDerWaalsContact CG-CZ3 3.44Å; G131-W135 WeakPolarHBondContact O-CB 3.27Å; G131-W135 PolarHBondContact O-N 3.34Å; W135-G137 VanDerWaalsContact C-N 3.35Å; W135-G137 PolarHBondContact O-N 2.83Å; W135-A138 PolarHBondContact O-N 2.83Å; W135-G139 PolarHBondContact O-N 3.41Å; W135-F188 HydrophobicContact CB-CE1 4.45Å; W135-F188 AromaticContact CD1-CE1 3.88Å; W135-L189 HydrophobicContact CD2-CD1 4.12Å; W135-L189 HydrophobicContact CG-CD1 4Å; W135-L189 HydrophobicContact CZ2-CD2 4.16Å |
| 136 | R | 93.7 | Very high | 93.2 | Very high | 172 Ų | 172 | 55 Ų | 55 | 65% | 0.649 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -63.8 | -40.9 | 177.6 | -73.1 | -168 | -178.8 | 108.1 | -3.4 | 112.1 | A132 A133 G139 R140 | A132-R136 WeakPolarHBondContact O-CG 3.41Å; A132-R136 PolarHBondContact O-N 3.23Å; A133-R136 PolarHBondContact O-N 3.19Å; R136-G139 PolarHBondContact O-N 3.5Å; R136-R140 WeakPolarHBondContact O-CG 3.39Å; R136-R140 PolarHBondContact O-N 3.46Å |
| 137 | G | 94.5 | Very high | 92.9 | Very high | 40 Ų | 40 | 56.4 Ų | 56.4 | 41% | 0.412 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -62 | -47.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | A133 V134 W135 G139 R140 A141 | A133-G137 PolarHBondContact O-N 2.95Å; V134-G137 PolarHBondContact O-N 3.45Å; W135-G137 VanDerWaalsContact C-N 3.35Å; W135-G137 PolarHBondContact O-N 2.83Å; G137-G139 VanDerWaalsContact C-N 3.33Å; G137-G139 PolarHBondContact O-N 3.2Å; G137-R140 PolarHBondContact O-N 2.93Å; G137-A141 PolarHBondContact O-N 3.42Å |
| 138 | A | 93.4 | Very high | 92.5 | Very high | 13 Ų | 13 | 62.4 Ų | 62.4 | 11% | 0.107 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -60.4 | -42.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | V134 W135 R140 A141 F142 F188 | V134-A138 WeakPolarHBondContact O-CB 3.38Å; V134-A138 PolarHBondContact O-N 2.89Å; W135-A138 PolarHBondContact O-N 2.83Å; A138-R140 VanDerWaalsContact C-N 3.33Å; A138-R140 PolarHBondContact O-N 2.89Å; A138-A141 PolarHBondContact O-N 3.2Å; A138-A141 VanDerWaalsContact O-N 3.17Å; A138-F142 HydrophobicContact CB-CE2 4.27Å; A138-F142 HydrophobicContact CB-CZ 4.11Å; A138-F142 WeakPolarHBondContact O-CD1 3.42Å; A138-F142 WeakPolarHBondContact O-CD2 3.34Å; A138-F142 WeakPolarHBondContact O-CG 3.25Å; A138-F142 PolarHBondContact O-N 2.67Å; A138-F188 HydrophobicContact CB-CD1 4.34Å; A138-F188 HydrophobicContact CB-CD2 4.42Å; A138-F188 HydrophobicContact CB-CE1 3.69Å; A138-F188 HydrophobicContact CB-CE2 3.77Å; A138-F188 HydrophobicContact CB-CZ 3.36Å |
| 139 | G | 91.4 | Very high | 92.2 | Very high | 29 Ų | 29 | 64.9 Ų | 64.9 | 30% | 0.299 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -59.2 | -41.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | W135 R136 G137 F142 L143 | W135-G139 PolarHBondContact O-N 3.41Å; R136-G139 PolarHBondContact O-N 3.5Å; G137-G139 VanDerWaalsContact C-N 3.33Å; G137-G139 PolarHBondContact O-N 3.2Å; G139-F142 PolarHBondContact O-N 3.36Å; G139-L143 WeakPolarHBondContact O-CG 3.34Å; G139-L143 PolarHBondContact O-N 2.7Å |
| 140 | R | 92.8 | Very high | 91.8 | Very high | 194 Ų | 194 | 60.5 Ų | 60.5 | 73% | 0.732 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -66.8 | -40.6 | 173.9 | -67.3 | -65.5 | -175.3 | 128.4 | 0.3 | 112.2 | R136 G137 A138 F142 L143 L144 | R136-R140 WeakPolarHBondContact O-CG 3.39Å; R136-R140 PolarHBondContact O-N 3.46Å; G137-R140 PolarHBondContact O-N 2.93Å; A138-R140 VanDerWaalsContact C-N 3.33Å; A138-R140 PolarHBondContact O-N 2.89Å; R140-F142 VanDerWaalsContact C-N 3.33Å; R140-F142 PolarHBondContact O-N 2.84Å; R140-L143 PolarHBondContact O-N 3.45Å; R140-L144 PolarHBondContact O-N 3.46Å |
| 141 | A | 92.8 | Very high | 91.4 | Very high | 44 Ų | 44 | 61.8 Ų | 61.8 | 36% | 0.364 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -63.5 | -38.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | G137 A138 L143 L144 I145 | G137-A141 PolarHBondContact O-N 3.42Å; A138-A141 PolarHBondContact O-N 3.2Å; A138-A141 VanDerWaalsContact O-N 3.17Å; A141-L143 PolarHBondContact O-N 3.08Å; A141-L144 WeakPolarHBondContact O-CB 3.29Å; A141-L144 PolarHBondContact O-N 3.48Å; A141-I145 VanDerWaalsContact O-CG1 3.28Å; A141-I145 WeakPolarHBondContact O-CG1 3.17Å; A141-I145 PolarHBondContact O-N 3.39Å |
| 142 | F | 92.8 | Very high | 90.9 | Very high | 16 Ų | 16 | 61.8 Ų | 61.8 | 7% | 0.07 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -64.3 | -39.2 | 176.6 | -60.4 | -22.2 | 0 | 0 | 0 | 112.5 | A138 G139 R140 I145 E146 V183 F188 V255 | A138-F142 HydrophobicContact CB-CE2 4.27Å; A138-F142 HydrophobicContact CB-CZ 4.11Å; A138-F142 WeakPolarHBondContact O-CD1 3.42Å; A138-F142 WeakPolarHBondContact O-CD2 3.34Å; A138-F142 WeakPolarHBondContact O-CG 3.25Å; A138-F142 PolarHBondContact O-N 2.67Å; G139-F142 PolarHBondContact O-N 3.36Å; R140-F142 VanDerWaalsContact C-N 3.33Å; R140-F142 PolarHBondContact O-N 2.84Å; F142-I145 HydrophobicContact CD1-CD1 4.4Å; F142-I145 PolarHBondContact O-N 3.41Å; F142-E146 PolarHBondContact O-N 3.28Å; F142-V183 HydrophobicContact CB-CB 4.33Å; F142-V183 HydrophobicContact CD1-CB 3.7Å; F142-V183 HydrophobicContact CD1-CG1 3.82Å; F142-V183 HydrophobicContact CD1-CG2 4Å; F142-V183 HydrophobicContact CD2-CB 4.35Å; F142-V183 HydrophobicContact CD2-CG1 4.35Å; F142-V183 HydrophobicContact CE1-CB 4.05Å; F142-V183 HydrophobicContact CE1-CG1 3.61Å; F142-V183 HydrophobicContact CE1-CG2 4.41Å; F142-V183 HydrophobicContact CE2-CG1 4.17Å; F142-V183 HydrophobicContact CG-CB 3.88Å; F142-V183 HydrophobicContact CG-CG1 4.2Å; F142-V183 HydrophobicContact CZ-CG1 3.79Å; F142-F188 HydrophobicContact CE2-CB 3.82Å; F142-F188 HydrophobicContact CE2-CD1 4.02Å; F142-F188 HydrophobicContact CE2-CD2 4.3Å; F142-F188 AromaticContact CE2-CG 3.75Å; F142-F188 HydrophobicContact CE2-CG 3.75Å; F142-F188 HydrophobicContact CZ-CB 3.95Å; F142-F188 HydrophobicContact CZ-CD1 4.39Å; F142-F188 AromaticContact CZ-CD2 3.86Å; F142-F188 HydrophobicContact CZ-CD2 3.86Å; F142-F188 AromaticContact CZ-CG 3.77Å; F142-F188 HydrophobicContact CZ-CG 3.77Å; F142-V255 HydrophobicContact CE1-CB 4.34Å; F142-V255 HydrophobicContact CE1-CG1 3.94Å; F142-V255 HydrophobicContact CE1-CG2 4.28Å; F142-V255 HydrophobicContact CZ-CB 4.28Å; F142-V255 HydrophobicContact CZ-CG1 3.91Å |
| 143 | L | 89.3 | Confident | 90.4 | Very high | 83 Ų | 83 | 63.4 Ų | 63.4 | 44% | 0.435 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -64 | -42.6 | 173.1 | -68.7 | 171.9 | 0 | 0 | 0 | 111.4 | G139 R140 A141 I145 E146 D147 | G139-L143 WeakPolarHBondContact O-CG 3.34Å; G139-L143 PolarHBondContact O-N 2.7Å; R140-L143 PolarHBondContact O-N 3.45Å; A141-L143 PolarHBondContact O-N 3.08Å; L143-I145 VanDerWaalsContact C-N 3.32Å; L143-I145 PolarHBondContact O-N 3.38Å; L143-E146 PolarHBondContact O-N 3.12Å; L143-D147 WeakPolarHBondContact O-CB 3.46Å; L143-D147 VanDerWaalsContact O-CG 3.29Å; L143-D147 PolarHBondContact O-N 3.13Å |
| 144 | L | 89.8 | Confident | 89.8 | Confident | 102 Ų | 102 | 63.8 Ų | 63.8 | 53% | 0.534 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -62 | -40.7 | 175.8 | -177.4 | 66.1 | 0 | 0 | 0 | 111.7 | R140 A141 D147 L148 | R140-L144 PolarHBondContact O-N 3.46Å; A141-L144 WeakPolarHBondContact O-CB 3.29Å; A141-L144 PolarHBondContact O-N 3.48Å; L144-D147 PolarHBondContact O-N 3.29Å; L144-L148 HydrophobicContact CD1-CD1 4.18Å; L144-L148 HydrophobicContact CD1-CG 4.19Å; L144-L148 HydrophobicContact CD2-CD1 4.47Å; L144-L148 HydrophobicContact CG-CD1 3.9Å; L144-L148 HydrophobicContact CG-CG 4.3Å; L144-L148 WeakPolarHBondContact O-CB 3.1Å; L144-L148 VanDerWaalsContact O-CG 3.25Å; L144-L148 WeakPolarHBondContact O-CG 2.99Å; L144-L148 PolarHBondContact O-N 3.23Å |
| 145 | I | 89.4 | Confident | 89 | Confident | 64 Ų | 64 | 65.3 Ų | 65.3 | 33% | 0.328 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -62.6 | -43.7 | 175.9 | -68.7 | 163 | 0 | 0 | 0 | 110.7 | A141 F142 L143 D147 L148 T149 Y181 V183 | A141-I145 VanDerWaalsContact O-CG1 3.28Å; A141-I145 WeakPolarHBondContact O-CG1 3.17Å; A141-I145 PolarHBondContact O-N 3.39Å; F142-I145 HydrophobicContact CD1-CD1 4.4Å; F142-I145 PolarHBondContact O-N 3.41Å; L143-I145 VanDerWaalsContact C-N 3.32Å; L143-I145 PolarHBondContact O-N 3.38Å; I145-D147 VanDerWaalsContact C-N 3.32Å; I145-D147 PolarHBondContact O-N 2.98Å; I145-L148 PolarHBondContact O-N 2.86Å; I145-T149 HydrophobicContact CG2-CG2 4.23Å; I145-T149 WeakPolarHBondContact O-CB 3.31Å; I145-T149 WeakPolarHBondContact O-CG2 3.47Å; I145-T149 PolarHBondContact O-N 3.46Å; I145-T149 PolarHBondContact O-OG1 2.94Å; I145-Y181 HydrophobicContact CG2-CD1 4.18Å; I145-V183 HydrophobicContact CD1-CG2 4.42Å |
| 146 | E | 90.2 | Very high | 88.2 | Confident | 30 Ų | 30 | 65.8 Ų | 65.8 | 14% | 0.14 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -62.4 | -39.3 | 176.5 | -174.8 | -170 | 168.1 | 0 | 0 | 112 | F142 L143 G150 R168 W178 T182 | F142-E146 PolarHBondContact O-N 3.28Å; L143-E146 PolarHBondContact O-N 3.12Å; E146-G150 WeakPolarHBondContact O-CA 3.2Å; E146-G150 PolarHBondContact O-N 2.8Å; E146-G150 VanDerWaalsContact O-N 3.08Å; E146-R168 IonicContact OE1-CZ 3.92Å; E146-R168 IonicContact OE1-NH1 3.65Å; E146-R168 IonicContact OE1-NH2 3.94Å; E146-R168 PolarHBondContact OE1-NH2 3.16Å; E146-R168 IonicContact OE2-NH1 3.62Å; E146-R168 IonicContact OE2-NH2 3.56Å; E146-W178 PolarHBondContact O-NE1 2.71Å; E146-W178 VanDerWaalsContact O-NE1 3.14Å; E146-T182 HydrophobicContact CG-CG2 3.86Å |
| 147 | D | 88.1 | Confident | 87.1 | Confident | 66 Ų | 66 | 64 Ų | 64 | 35% | 0.353 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -73.6 | -31.9 | 178.6 | -68.3 | -15 | 0 | 0 | 0 | 111.9 | L143 L144 I145 R168 W178 | L143-D147 WeakPolarHBondContact O-CB 3.46Å; L143-D147 VanDerWaalsContact O-CG 3.29Å; L143-D147 PolarHBondContact O-N 3.13Å; L144-D147 PolarHBondContact O-N 3.29Å; I145-D147 VanDerWaalsContact C-N 3.32Å; I145-D147 PolarHBondContact O-N 2.98Å; D147-R168 WeakPolarHBondContact OD1-CD 3.48Å; D147-R168 IonicContact OD1-CZ 3.45Å; D147-R168 IonicContact OD1-NE 2.87Å; D147-R168 IonicContact OD1-NH1 3.11Å; D147-R168 PolarHBondContact OD1-NH1 2.74Å; D147-R168 VanDerWaalsContact OD1-NH1 3.11Å; D147-W178 WeakPolarHBondContact O-CZ2 3.06Å |
| 148 | L | 87.4 | Confident | 85.9 | Confident | 132 Ų | 132 | 71.2 Ų | 71.2 | 69% | 0.691 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -81.9 | -32.2 | 178.3 | -71.6 | 175.5 | 0 | 0 | 0 | 113.7 | L144 I145 | L144-L148 HydrophobicContact CD1-CD1 4.18Å; L144-L148 HydrophobicContact CD1-CG 4.19Å; L144-L148 HydrophobicContact CD2-CD1 4.47Å; L144-L148 HydrophobicContact CG-CD1 3.9Å; L144-L148 HydrophobicContact CG-CG 4.3Å; L144-L148 WeakPolarHBondContact O-CB 3.1Å; L144-L148 VanDerWaalsContact O-CG 3.25Å; L144-L148 WeakPolarHBondContact O-CG 2.99Å; L144-L148 PolarHBondContact O-N 3.23Å; I145-L148 PolarHBondContact O-N 2.86Å |
| 149 | T | 88.1 | Confident | 84.8 | Confident | 71 Ų | 71 | 72.4 Ų | 72.4 | 44% | 0.436 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -93.9 | -8 | -178.9 | 58.8 | 0 | 0 | 0 | 0 | 112.9 | I145 Y181 | I145-T149 HydrophobicContact CG2-CG2 4.23Å; I145-T149 WeakPolarHBondContact O-CB 3.31Å; I145-T149 WeakPolarHBondContact O-CG2 3.47Å; I145-T149 PolarHBondContact O-N 3.46Å; I145-T149 PolarHBondContact O-OG1 2.94Å; T149-Y181 WeakPolarHBondContact OG1-CB 3.29Å; T149-Y181 PolarHBondContact OG1-N 3.36Å |
| 150 | G | 85.2 | Confident | 84 | Confident | 12 Ų | 12 | 74.7 Ų | 74.7 | 12% | 0.124 | 41% | 0.405 | C | S | . | . | trans | -80.7 | 155.5 | -173.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | E146 W178 R179 G180 | E146-G150 WeakPolarHBondContact O-CA 3.2Å; E146-G150 PolarHBondContact O-N 2.8Å; E146-G150 VanDerWaalsContact O-N 3.08Å; G150-W178 VanDerWaalsContact CA-CZ2 3.43Å; G150-W178 WeakPolarHBondContact O-CH2 3.39Å; G150-W178 WeakPolarHBondContact O-CZ2 3.35Å; G150-R179 WeakPolarHBondContact CA-O 3.29Å; G150-G180 VanDerWaalsContact CA-CA 3.45Å | ||
| 151 | S | 86.3 | Confident | 83.2 | Confident | 49 Ų | 49 | 69.4 Ų | 69.4 | 34% | 0.343 | 39% | 0.391 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.3 | 154.7 | 169.8 | -48.8 | 0 | 0 | 0 | 0 | 110.2 | F153 L162 R179 | S151-F153 VanDerWaalsContact O-CD2 3.28Å; S151-F153 WeakPolarHBondContact O-CD2 3.49Å; S151-F153 WeakPolarHBondContact O-CE2 3.23Å; S151-L162 VanDerWaalsContact CB-CD1 3.5Å; S151-R179 PolarHBondContact N-O 3.03Å; S151-R179 PolarHBondContact O-N 3.02Å; S151-R179 VanDerWaalsContact O-N 3.1Å |
| 152 | C | 85.7 | Confident | 82.5 | Confident | 0 Ų | 0 | 72.3 Ų | 72.3 | 0% | 0 | 40% | 0.4 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.9 | 128.5 | 178.5 | -168.2 | 0 | 0 | 0 | 0 | 110.5 | H163 L165 C171 H176 W178 | C152-H163 HydrophobicContact CB-CB 4.37Å; C152-H163 PolarHBondContact O-N 3Å; C152-L165 HydrophobicContact CB-CB 4.12Å; C152-C171 WeakPolarHBondContact CA-SG 3.18Å; C152-C171 HydrophobicContact CB-CB 3.71Å; C152-C171 WeakPolarHBondContact CB-SG 3.42Å; C152-C171 VanDerWaalsContact SG-CA 3.56Å; C152-C171 WeakPolarHBondContact SG-CB 3.17Å; C152-C171 CovalentContact SG-SG 2.03Å; C152-C171 PolarHBondContact SG-SG 2.89Å; C152-H176 WeakPolarHBondContact SG-CB 3.32Å; C152-W178 HydrophobicContact CB-CE3 4.26Å; C152-W178 HydrophobicContact CB-CZ3 4.3Å |
| 153 | F | 84.3 | Confident | 81.6 | Confident | 47 Ų | 47 | 75.4 Ų | 75.4 | 21% | 0.206 | 41% | 0.414 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.9 | 124.4 | 178.8 | -65.7 | -84.8 | 0 | 0 | 0 | 111 | S151 L160 L161 L162 H176 Q177 R179 | S151-F153 VanDerWaalsContact O-CD2 3.28Å; S151-F153 WeakPolarHBondContact O-CD2 3.49Å; S151-F153 WeakPolarHBondContact O-CE2 3.23Å; F153-L160 HydrophobicContact CB-CB 4.42Å; F153-L160 HydrophobicContact CB-CD2 3.49Å; F153-L160 VanDerWaalsContact CB-CD2 3.49Å; F153-L160 HydrophobicContact CB-CG 4.05Å; F153-L160 HydrophobicContact CD1-CB 3.99Å; F153-L160 HydrophobicContact CD1-CD2 3.67Å; F153-L160 HydrophobicContact CD1-CG 4.33Å; F153-L160 HydrophobicContact CD2-CD2 4.4Å; F153-L160 HydrophobicContact CE1-CD2 4.46Å; F153-L160 HydrophobicContact CG-CD2 3.6Å; F153-L160 HydrophobicContact CG-CG 4.47Å; F153-L161 WeakPolarHBondContact CA-O 3.45Å; F153-L162 HydrophobicContact CD1-CD1 4.07Å; F153-L162 HydrophobicContact CE1-CB 4.45Å; F153-L162 HydrophobicContact CE1-CD1 3.55Å; F153-L162 HydrophobicContact CE2-CD1 4.39Å; F153-L162 HydrophobicContact CZ-CD1 3.74Å; F153-H176 WeakPolarHBondContact O-CB 3.33Å; F153-Q177 PolarHBondContact N-O 3.44Å; F153-Q177 PolarHBondContact O-N 3.28Å; F153-R179 HydrophobicContact CD2-CB 3.81Å; F153-R179 HydrophobicContact CD2-CG 4.02Å; F153-R179 HydrophobicContact CE2-CB 3.72Å; F153-R179 HydrophobicContact CE2-CG 4.37Å |
| 154 | E | 82.1 | Confident | 80.6 | Confident | 69 Ų | 69 | 80.5 Ų | 80.5 | 32% | 0.322 | 44% | 0.436 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -86 | 125 | 171.9 | -174.4 | 170.2 | -158.7 | 0 | 0 | 109.9 | L156 L161 H176 | E154-L156 HydrophobicContact CB-CD1 4.47Å; E154-L156 HydrophobicContact CG-CD1 3.8Å; E154-L156 PolarHBondContact O-N 3.38Å; E154-L161 HydrophobicContact CB-CB 4.4Å; E154-L161 PolarHBondContact N-O 3.48Å; E154-L161 PolarHBondContact O-N 2.86Å; E154-L161 VanDerWaalsContact O-N 3.08Å; E154-H176 VanDerWaalsContact CD-CE1 3.44Å; E154-H176 WeakPolarHBondContact CG-ND1 3.45Å; E154-H176 IonicContact OE1-CE1 3.48Å; E154-H176 PolarHBondContact OE1-CE1 2.91Å; E154-H176 IonicContact OE2-CE1 3.97Å |
| 155 | P | 77.4 | Confident | 79.6 | Confident | 71 Ų | 71 | 77.8 Ų | 77.8 | 46% | 0.461 | 42% | 0.422 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.1 | 101.9 | 176.9 | 29.9 | -31.2 | 0 | 0 | 0 | 110.4 | ||
| 156 | L | 78.1 | Confident | 78.7 | Confident | 77 Ų | 77 | 79.8 Ų | 79.8 | 40% | 0.403 | 44% | 0.439 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.4 | 153.7 | 169 | -102.7 | 72.9 | 0 | 0 | 0 | 110.6 | E154 Q158 G159 | E154-L156 HydrophobicContact CB-CD1 4.47Å; E154-L156 HydrophobicContact CG-CD1 3.8Å; E154-L156 PolarHBondContact O-N 3.38Å; L156-Q158 PolarHBondContact O-N 3.05Å; L156-G159 CarbonylContact C-O 3.56Å; L156-G159 WeakPolarHBondContact CA-O 3.49Å; L156-G159 WeakPolarHBondContact CB-O 3.37Å; L156-G159 PolarHBondContact N-O 3.41Å; L156-G159 PolarHBondContact O-N 2.77Å |
| 157 | P | 70.4 | Confident | 78.3 | Confident | 135 Ų | 135 | 83 Ų | 83 | 88% | 0.877 | 46% | 0.457 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.8 | -13.4 | 177.6 | 21.9 | -31.1 | 0 | 0 | 0 | 114.3 | ||
| 158 | Q | 70.1 | Confident | 78 | Confident | 191 Ų | 191 | 83.5 Ų | 83.5 | 89% | 0.893 | 45% | 0.454 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -114.1 | 0.8 | -178.1 | -60.7 | 173.5 | -8.1 | 0 | 0 | 113.6 | L156 | L156-Q158 PolarHBondContact O-N 3.05Š|
| 159 | G | 69.6 | Low | 77.9 | Confident | 38 Ų | 38 | 87.6 Ų | 87.6 | 39% | 0.392 | 46% | 0.46 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 158.8 | -174.5 | -177.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | L156 | L156-G159 CarbonylContact C-O 3.56Å; L156-G159 WeakPolarHBondContact CA-O 3.49Å; L156-G159 WeakPolarHBondContact CB-O 3.37Å; L156-G159 PolarHBondContact N-O 3.41Å; L156-G159 PolarHBondContact O-N 2.77Å |
| 160 | L | 75.4 | Confident | 77.7 | Confident | 78 Ų | 78 | 86.9 Ų | 86.9 | 41% | 0.408 | 46% | 0.458 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.4 | 124.8 | 170.6 | -94 | 77.6 | 0 | 0 | 0 | 109.4 | F153 R179 | F153-L160 HydrophobicContact CB-CB 4.42Å; F153-L160 HydrophobicContact CB-CD2 3.49Å; F153-L160 VanDerWaalsContact CB-CD2 3.49Å; F153-L160 HydrophobicContact CB-CG 4.05Å; F153-L160 HydrophobicContact CD1-CB 3.99Å; F153-L160 HydrophobicContact CD1-CD2 3.67Å; F153-L160 HydrophobicContact CD1-CG 4.33Å; F153-L160 HydrophobicContact CD2-CD2 4.4Å; F153-L160 HydrophobicContact CE1-CD2 4.46Å; F153-L160 HydrophobicContact CG-CD2 3.6Å; F153-L160 HydrophobicContact CG-CG 4.47Å; L160-R179 VanDerWaalsContact CD2-CZ 3.48Å |
| 161 | L | 75.5 | Confident | 77.7 | Confident | 83 Ų | 83 | 86.3 Ų | 86.3 | 44% | 0.435 | 45% | 0.452 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.5 | 126.1 | 172 | -161.8 | 157 | 0 | 0 | 0 | 108.7 | F153 E154 | F153-L161 WeakPolarHBondContact CA-O 3.45Å; E154-L161 HydrophobicContact CB-CB 4.4Å; E154-L161 PolarHBondContact N-O 3.48Å; E154-L161 PolarHBondContact O-N 2.86Å; E154-L161 VanDerWaalsContact O-N 3.08Å |
| 162 | L | 77.6 | Confident | 77.8 | Confident | 104 Ų | 104 | 88.4 Ų | 88.4 | 55% | 0.545 | 46% | 0.459 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.7 | 118.9 | 178.2 | -176.7 | 73.6 | 0 | 0 | 0 | 109.5 | S151 F153 | S151-L162 VanDerWaalsContact CB-CD1 3.5Å; F153-L162 HydrophobicContact CD1-CD1 4.07Å; F153-L162 HydrophobicContact CE1-CB 4.45Å; F153-L162 HydrophobicContact CE1-CD1 3.55Å; F153-L162 HydrophobicContact CE2-CD1 4.39Å; F153-L162 HydrophobicContact CZ-CD1 3.74Å |
| 163 | H | 72.9 | Confident | 77.8 | Confident | 82 Ų | 82 | 92.7 Ų | 92.7 | 38% | 0.38 | 50% | 0.495 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107 | 132.6 | 179.8 | -157.2 | 29 | 0 | 0 | 0 | 110.6 | C152 L165 H176 | C152-H163 HydrophobicContact CB-CB 4.37Å; C152-H163 PolarHBondContact O-N 3Å; H163-L165 WeakPolarHBondContact CD2-CD1 2.98Å; H163-L165 PolarHBondContact O-N 3.28Å; H163-H176 AromaticContact CD2-NE2 3.85Å |
| 164 | E | 69.4 | Low | 77.7 | Confident | 189 Ų | 189 | 93.1 Ų | 93.1 | 88% | 0.883 | 51% | 0.507 | S | S | * | . | trans | -77.7 | 35.1 | -177.9 | -62.1 | -159.3 | 165.2 | 0 | 0 | 113.5 | P166 | E164-P166 WeakPolarHBondContact O-CD 3.2Š| ||
| 165 | L | 68.1 | Low | 77.8 | Confident | 46 Ų | 46 | 92.6 Ų | 92.6 | 24% | 0.241 | 52% | 0.52 | C | S | . | . | trans | -73.5 | 122 | 171.4 | -78.1 | 158.8 | 0 | 0 | 0 | 108.9 | C152 H163 D167 | C152-L165 HydrophobicContact CB-CB 4.12Å; H163-L165 WeakPolarHBondContact CD2-CD1 2.98Å; H163-L165 PolarHBondContact O-N 3.28Å; L165-D167 VanDerWaalsContact C-N 3.3Å; L165-D167 PolarHBondContact O-N 2.85Å | ||
| 166 | P | 70.9 | Confident | 78.3 | Confident | 106 Ų | 106 | 90.3 Ų | 90.3 | 69% | 0.688 | 50% | 0.503 | S | S | * | . | trans | -73.5 | -23.3 | -174.5 | 28.1 | -34.3 | 0 | 0 | 0 | 112.9 | E164 | E164-P166 WeakPolarHBondContact O-CD 3.2Š| ||
| 167 | D | 80.8 | Confident | 78.6 | Confident | 98 Ų | 98 | 91 Ų | 91 | 52% | 0.524 | 51% | 0.505 | S | S | . | . | trans | -114.8 | 131 | -170.4 | -78.1 | -49 | 0 | 0 | 0 | 113.2 | L165 R169 S170 C171 | L165-D167 VanDerWaalsContact C-N 3.3Å; L165-D167 PolarHBondContact O-N 2.85Å; D167-R169 VanDerWaalsContact C-N 3.25Å; D167-R169 PolarHBondContact O-N 3.33Å; D167-S170 PolarHBondContact O-N 3.44Å; D167-C171 PolarHBondContact O-N 2.85Å | ||
| 168 | R | 82.9 | Confident | 79.3 | Confident | 75 Ų | 75 | 85.9 Ų | 85.9 | 28% | 0.283 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -53.4 | -41 | 173.1 | 178.8 | 176.9 | -177.9 | 176.9 | 14.9 | 112.9 | E146 D147 C171 L172 W178 | E146-R168 IonicContact OE1-CZ 3.92Å; E146-R168 IonicContact OE1-NH1 3.65Å; E146-R168 IonicContact OE1-NH2 3.94Å; E146-R168 PolarHBondContact OE1-NH2 3.16Å; E146-R168 IonicContact OE2-NH1 3.62Å; E146-R168 IonicContact OE2-NH2 3.56Å; D147-R168 WeakPolarHBondContact OD1-CD 3.48Å; D147-R168 IonicContact OD1-CZ 3.45Å; D147-R168 IonicContact OD1-NE 2.87Å; D147-R168 IonicContact OD1-NH1 3.11Å; D147-R168 PolarHBondContact OD1-NH1 2.74Å; D147-R168 VanDerWaalsContact OD1-NH1 3.11Å; R168-C171 WeakPolarHBondContact O-CB 3.24Å; R168-C171 PolarHBondContact O-N 3.14Å; R168-L172 HydrophobicContact CG-CD1 3.9Å; R168-L172 HydrophobicContact CG-CG 4.37Å; R168-L172 VanDerWaalsContact O-CG 3.31Å; R168-L172 WeakPolarHBondContact O-CG 3.26Å; R168-L172 PolarHBondContact O-N 3.48Å; R168-W178 HydrophobicContact CB-CD2 3.79Å; R168-W178 HydrophobicContact CB-CE3 4.03Å; R168-W178 HydrophobicContact CB-CG 4.19Å; R168-W178 HydrophobicContact CB-CH2 4.45Å; R168-W178 HydrophobicContact CB-CZ2 4.24Å; R168-W178 HydrophobicContact CB-CZ3 4.35Å; R168-W178 HydrophobicContact CG-CB 4.1Å; R168-W178 HydrophobicContact CG-CD2 3.89Å; R168-W178 HydrophobicContact CG-CE3 4.42Å; R168-W178 HydrophobicContact CG-CG 3.73Å |
| 169 | R | 84.6 | Confident | 80 | Confident | 219 Ų | 219 | 83.2 Ų | 83.2 | 83% | 0.826 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -64.4 | -45.3 | -179 | -68.7 | -176.5 | -177.6 | 174.4 | 2.1 | 111.5 | D167 L172 A173 | D167-R169 VanDerWaalsContact C-N 3.25Å; D167-R169 PolarHBondContact O-N 3.33Å; R169-L172 PolarHBondContact O-N 3.34Å; R169-A173 VanDerWaalsContact O-CB 3.25Å; R169-A173 WeakPolarHBondContact O-CB 3.24Å; R169-A173 PolarHBondContact O-N 3Å |
| 170 | S | 84.6 | Confident | 80.7 | Confident | 55 Ų | 55 | 82.4 Ų | 82.4 | 39% | 0.385 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -66 | -39.9 | 178.1 | -53.5 | 0 | 0 | 0 | 0 | 111.1 | D167 A173 A174 | D167-S170 PolarHBondContact O-N 3.44Å; S170-A173 PolarHBondContact O-N 2.94Å; S170-A174 WeakPolarHBondContact O-CB 3.35Å; S170-A174 PolarHBondContact O-N 2.89Å |
| 171 | C | 85.8 | Confident | 81.3 | Confident | 0 Ų | 0 | 81.9 Ų | 81.9 | 0% | 0 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -58.9 | -50.1 | 174 | -177.8 | 0 | 0 | 0 | 0 | 112.6 | C152 D167 R168 A174 G175 H176 W178 | C152-C171 WeakPolarHBondContact CA-SG 3.18Å; C152-C171 HydrophobicContact CB-CB 3.71Å; C152-C171 WeakPolarHBondContact CB-SG 3.42Å; C152-C171 VanDerWaalsContact SG-CA 3.56Å; C152-C171 WeakPolarHBondContact SG-CB 3.17Å; C152-C171 CovalentContact SG-SG 2.03Å; C152-C171 PolarHBondContact SG-SG 2.89Å; D167-C171 PolarHBondContact O-N 2.85Å; R168-C171 WeakPolarHBondContact O-CB 3.24Å; R168-C171 PolarHBondContact O-N 3.14Å; C171-A174 PolarHBondContact O-N 3.43Å; C171-G175 PolarHBondContact O-N 3.43Å; C171-H176 WeakPolarHBondContact O-CB 3.18Å; C171-H176 PolarHBondContact O-N 3.02Å; C171-H176 VanDerWaalsContact O-N 3.08Å; C171-W178 HydrophobicContact CB-CE3 3.88Å; C171-W178 HydrophobicContact CB-CZ3 4.36Å |
| 172 | L | 86.7 | Confident | 81.8 | Confident | 93 Ų | 93 | 80.7 Ų | 80.7 | 49% | 0.487 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -69.2 | -34.6 | 179.3 | -67.1 | 173 | 0 | 0 | 0 | 112.1 | R168 R169 A174 G175 | R168-L172 HydrophobicContact CG-CD1 3.9Å; R168-L172 HydrophobicContact CG-CG 4.37Å; R168-L172 VanDerWaalsContact O-CG 3.31Å; R168-L172 WeakPolarHBondContact O-CG 3.26Å; R168-L172 PolarHBondContact O-N 3.48Å; R169-L172 PolarHBondContact O-N 3.34Å; L172-A174 VanDerWaalsContact C-N 3.28Å; L172-A174 PolarHBondContact O-N 3.42Å; L172-G175 PolarHBondContact O-N 3.22Å; L172-G175 VanDerWaalsContact O-N 3.09Å |
| 173 | A | 86.9 | Confident | 82.5 | Confident | 91 Ų | 91 | 76.4 Ų | 76.4 | 75% | 0.752 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -64.9 | -32.5 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | R169 S170 G175 | R169-A173 VanDerWaalsContact O-CB 3.25Å; R169-A173 WeakPolarHBondContact O-CB 3.24Å; R169-A173 PolarHBondContact O-N 3Å; S170-A173 PolarHBondContact O-N 2.94Å; A173-G175 PolarHBondContact O-N 3.37Å |
| 174 | A | 82.9 | Confident | 83.3 | Confident | 55 Ų | 55 | 73.6 Ų | 73.6 | 46% | 0.455 | 40% | 0.398 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.1 | -0.3 | 174 | 0 | 0 | 0 | 0 | 0 | 113.7 | S170 C171 L172 H176 | S170-A174 WeakPolarHBondContact O-CB 3.35Å; S170-A174 PolarHBondContact O-N 2.89Å; C171-A174 PolarHBondContact O-N 3.43Å; L172-A174 VanDerWaalsContact C-N 3.28Å; L172-A174 PolarHBondContact O-N 3.42Å; A174-H176 VanDerWaalsContact C-N 3.35Å; A174-H176 VanDerWaalsContact CB-CD2 3.48Å; A174-H176 WeakPolarHBondContact CB-CD2 3.39Å |
| 175 | G | 83.4 | Confident | 84.2 | Confident | 59 Ų | 59 | 67.2 Ų | 67.2 | 61% | 0.608 | 37% | 0.374 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 80.6 | 12.3 | -179.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | C171 L172 A173 | C171-G175 PolarHBondContact O-N 3.43Å; L172-G175 PolarHBondContact O-N 3.22Å; L172-G175 VanDerWaalsContact O-N 3.09Å; A173-G175 PolarHBondContact O-N 3.37Å |
| 176 | H | 86.8 | Confident | 85.3 | Confident | 23 Ų | 23 | 66.7 Ų | 66.7 | 11% | 0.106 | 37% | 0.37 | C | S | . | . | P | Polyproline II helix | trans | -88.3 | 167.3 | 178.6 | -54.9 | -41.8 | 0 | 0 | 0 | 112.2 | C152 F153 E154 H163 C171 A174 | C152-H176 WeakPolarHBondContact SG-CB 3.32Å; F153-H176 WeakPolarHBondContact O-CB 3.33Å; E154-H176 VanDerWaalsContact CD-CE1 3.44Å; E154-H176 WeakPolarHBondContact CG-ND1 3.45Å; E154-H176 IonicContact OE1-CE1 3.48Å; E154-H176 PolarHBondContact OE1-CE1 2.91Å; E154-H176 IonicContact OE2-CE1 3.97Å; H163-H176 AromaticContact CD2-NE2 3.85Å; C171-H176 WeakPolarHBondContact O-CB 3.18Å; C171-H176 PolarHBondContact O-N 3.02Å; C171-H176 VanDerWaalsContact O-N 3.08Å; A174-H176 VanDerWaalsContact C-N 3.35Å; A174-H176 VanDerWaalsContact CB-CD2 3.48Å; A174-H176 WeakPolarHBondContact CB-CD2 3.39Å |
| 177 | Q | 85.5 | Confident | 86.3 | Confident | 92 Ų | 92 | 61.6 Ų | 61.6 | 43% | 0.43 | 34% | 0.338 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.2 | 125.1 | 177 | -69.1 | -174.1 | 1.3 | 0 | 0 | 111.3 | F153 | F153-Q177 PolarHBondContact N-O 3.44Å; F153-Q177 PolarHBondContact O-N 3.28Å |
| 178 | W | 85.3 | Confident | 86.9 | Confident | 27 Ų | 27 | 57 Ų | 57 | 10% | 0.102 | 31% | 0.313 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.3 | 126.6 | 169.4 | -171.2 | -98.5 | 0 | 0 | 0 | 110.6 | E146 D147 G150 C152 R168 C171 | E146-W178 PolarHBondContact O-NE1 2.71Å; E146-W178 VanDerWaalsContact O-NE1 3.14Å; D147-W178 WeakPolarHBondContact O-CZ2 3.06Å; G150-W178 VanDerWaalsContact CA-CZ2 3.43Å; G150-W178 WeakPolarHBondContact O-CH2 3.39Å; G150-W178 WeakPolarHBondContact O-CZ2 3.35Å; C152-W178 HydrophobicContact CB-CE3 4.26Å; C152-W178 HydrophobicContact CB-CZ3 4.3Å; R168-W178 HydrophobicContact CB-CD2 3.79Å; R168-W178 HydrophobicContact CB-CE3 4.03Å; R168-W178 HydrophobicContact CB-CG 4.19Å; R168-W178 HydrophobicContact CB-CH2 4.45Å; R168-W178 HydrophobicContact CB-CZ2 4.24Å; R168-W178 HydrophobicContact CB-CZ3 4.35Å; R168-W178 HydrophobicContact CG-CB 4.1Å; R168-W178 HydrophobicContact CG-CD2 3.89Å; R168-W178 HydrophobicContact CG-CE3 4.42Å; R168-W178 HydrophobicContact CG-CG 3.73Å; C171-W178 HydrophobicContact CB-CE3 3.88Å; C171-W178 HydrophobicContact CB-CZ3 4.36Å |
| 179 | R | 85.1 | Confident | 87.5 | Confident | 134 Ų | 134 | 53.6 Ų | 53.6 | 51% | 0.506 | 30% | 0.3 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.2 | 115.1 | 172.2 | -63.2 | -175.9 | 179.6 | 177.8 | 3.4 | 110 | G150 S151 F153 L160 | G150-R179 WeakPolarHBondContact CA-O 3.29Å; S151-R179 PolarHBondContact N-O 3.03Å; S151-R179 PolarHBondContact O-N 3.02Å; S151-R179 VanDerWaalsContact O-N 3.1Å; F153-R179 HydrophobicContact CD2-CB 3.81Å; F153-R179 HydrophobicContact CD2-CG 4.02Å; F153-R179 HydrophobicContact CE2-CB 3.72Å; F153-R179 HydrophobicContact CE2-CG 4.37Å; L160-R179 VanDerWaalsContact CD2-CZ 3.48Å |
| 180 | G | 84.7 | Confident | 87.9 | Confident | 21 Ų | 21 | 43.2 Ų | 43.2 | 22% | 0.216 | 26% | 0.261 | C | S | . | . | trans | -130.7 | 177.4 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | G150 T182 | G150-G180 VanDerWaalsContact CA-CA 3.45Å; G180-T182 PolarHBondContact O-N 2.92Å | ||
| 181 | Y | 86.7 | Confident | 88.4 | Confident | 67 Ų | 67 | 40.6 Ų | 40.6 | 26% | 0.263 | 24% | 0.243 | S | C | . | . | trans | -73.4 | 112.7 | 177.7 | -173.5 | -98.3 | 0 | 0 | 0 | 110.4 | I145 T149 V183 T247 H248 V251 | I145-Y181 HydrophobicContact CG2-CD1 4.18Å; T149-Y181 WeakPolarHBondContact OG1-CB 3.29Å; T149-Y181 PolarHBondContact OG1-N 3.36Å; Y181-V183 HydrophobicContact CD1-CG2 4.09Å; Y181-V183 HydrophobicContact CE1-CG2 3.82Å; Y181-T247 PolarHBondContact OH-O 2.88Å; Y181-H248 AromaticContact CD2-CD2 3.88Å; Y181-H248 AromaticContact CD2-NE2 3.57Å; Y181-H248 AromaticContact CE2-CD2 3.3Å; Y181-H248 WeakPolarHBondContact CE2-CD2 3.46Å; Y181-H248 AromaticContact CE2-NE2 3.48Å; Y181-H248 WeakPolarHBondContact CE2-NE2 3.05Å; Y181-H248 AromaticContact CZ-CD2 3.71Å; Y181-V251 VanDerWaalsContact OH-CG2 3.25Å; Y181-V251 WeakPolarHBondContact OH-CG2 3.08Å | ||
| 182 | T | 87.4 | Confident | 88.9 | Confident | 59 Ų | 59 | 40.7 Ų | 40.7 | 36% | 0.362 | 24% | 0.243 | S | C | . | . | trans | -102.9 | 101.5 | -174.7 | 47.4 | 0 | 0 | 0 | 0 | 111.6 | E146 G180 S184 H248 | E146-T182 HydrophobicContact CG-CG2 3.86Å; G180-T182 PolarHBondContact O-N 2.92Å; T182-S184 PolarHBondContact O-N 2.99Å; T182-H248 VanDerWaalsContact O-CB 3.27Å; T182-H248 WeakPolarHBondContact O-CB 3.39Å; T182-H248 PolarHBondContact O-ND1 3.39Å; T182-H248 PolarHBondContact OG1-CE1 3.49Å; T182-H248 PolarHBondContact OG1-ND1 3.32Å; T182-H248 VanDerWaalsContact OG1-ND1 3.11Å | ||
| 183 | V | 90.3 | Very high | 89.3 | Confident | 13 Ų | 13 | 36.2 Ų | 36.2 | 8% | 0.079 | 22% | 0.22 | C | C | . | . | trans | -64.1 | 136.5 | 175.4 | -176.9 | 0 | 0 | 0 | 0 | 110.6 | F142 I145 Y181 S185 V251 | F142-V183 HydrophobicContact CB-CB 4.33Å; F142-V183 HydrophobicContact CD1-CB 3.7Å; F142-V183 HydrophobicContact CD1-CG1 3.82Å; F142-V183 HydrophobicContact CD1-CG2 4Å; F142-V183 HydrophobicContact CD2-CB 4.35Å; F142-V183 HydrophobicContact CD2-CG1 4.35Å; F142-V183 HydrophobicContact CE1-CB 4.05Å; F142-V183 HydrophobicContact CE1-CG1 3.61Å; F142-V183 HydrophobicContact CE1-CG2 4.41Å; F142-V183 HydrophobicContact CE2-CG1 4.17Å; F142-V183 HydrophobicContact CG-CB 3.88Å; F142-V183 HydrophobicContact CG-CG1 4.2Å; F142-V183 HydrophobicContact CZ-CG1 3.79Å; I145-V183 HydrophobicContact CD1-CG2 4.42Å; Y181-V183 HydrophobicContact CD1-CG2 4.09Å; Y181-V183 HydrophobicContact CE1-CG2 3.82Å; V183-S185 PolarHBondContact O-N 3.45Å; V183-V251 HydrophobicContact CG1-CG1 4.04Å; V183-V251 HydrophobicContact CG2-CG1 4.02Å | ||
| 184 | S | 90.8 | Very high | 89.8 | Confident | 23 Ų | 23 | 31.9 Ų | 31.9 | 16% | 0.161 | 18% | 0.184 | C | C | . | . | trans | -70.1 | 100.8 | 178.8 | 179.9 | 0 | 0 | 0 | 0 | 111.6 | T182 H186 T187 F188 H248 | T182-S184 PolarHBondContact O-N 2.99Å; S184-H186 VanDerWaalsContact C-N 3.3Å; S184-H186 PolarHBondContact O-N 3.46Å; S184-T187 WeakPolarHBondContact CB-OG1 2.86Å; S184-T187 PolarHBondContact O-N 3.34Å; S184-T187 WeakPolarHBondContact OG-CB 3.13Å; S184-T187 PolarHBondContact OG-N 2.98Å; S184-T187 PolarHBondContact OG-OG1 3.25Å; S184-F188 PolarHBondContact O-N 3.27Å; S184-H248 VanDerWaalsContact CB-O 3.27Å; S184-H248 WeakPolarHBondContact CB-O 3.23Å; S184-H248 PolarHBondContact N-O 3.45Å | ||
| 185 | S | 89.1 | Confident | 90.3 | Very high | 55 Ų | 55 | 29.4 Ų | 29.4 | 39% | 0.385 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -63.8 | -33.4 | 176.2 | 62.9 | 0 | 0 | 0 | 0 | 112.8 | V183 L189 | V183-S185 PolarHBondContact O-N 3.45Å; S185-L189 VanDerWaalsContact O-CB 3.31Å; S185-L189 WeakPolarHBondContact O-CB 3.41Å; S185-L189 PolarHBondContact O-N 3.5Å |
| 186 | H | 89.9 | Confident | 90.9 | Very high | 35 Ų | 35 | 26.6 Ų | 26.6 | 16% | 0.162 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -67.6 | -45.5 | 177.7 | -68.4 | -176.5 | 0 | 0 | 0 | 111.6 | V92 N93 S184 L189 L190 T239 | V92-H186 HydrophobicContact CG1-CB 3.84Å; N93-H186 PolarHBondContact OD1-NE2 2.98Å; S184-H186 VanDerWaalsContact C-N 3.3Å; S184-H186 PolarHBondContact O-N 3.46Å; H186-L189 PolarHBondContact O-N 3.08Å; H186-L190 WeakPolarHBondContact O-CB 3.4Å; H186-L190 VanDerWaalsContact O-CG 3.31Å; H186-L190 WeakPolarHBondContact O-CG 3.25Å; H186-L190 PolarHBondContact O-N 3.14Å; H186-T239 HydrophobicContact CB-CG2 4.27Å |
| 187 | T | 91.9 | Very high | 91.3 | Very high | 0 Ų | 0 | 25.6 Ų | 25.6 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -64.9 | -43.6 | 177.3 | -50.6 | 0 | 0 | 0 | 0 | 110.3 | V64 S184 T191 L236 K249 A253 | V64-T187 HydrophobicContact CG2-CG2 4.48Å; S184-T187 WeakPolarHBondContact CB-OG1 2.86Å; S184-T187 PolarHBondContact O-N 3.34Å; S184-T187 WeakPolarHBondContact OG-CB 3.13Å; S184-T187 PolarHBondContact OG-N 2.98Å; S184-T187 PolarHBondContact OG-OG1 3.25Å; T187-T191 WeakPolarHBondContact O-CB 3.34Å; T187-T191 PolarHBondContact O-N 2.69Å; T187-T191 PolarHBondContact O-OG1 3.4Å; T187-L236 HydrophobicContact CG2-CD1 3.8Å; T187-K249 HydrophobicContact CG2-CB 4.3Å; T187-K249 VanDerWaalsContact CG2-O 3.31Å; T187-K249 WeakPolarHBondContact CG2-O 3.39Å; T187-A253 HydrophobicContact CG2-CB 3.91Å |
| 188 | F | 94.3 | Very high | 91.8 | Very high | 1 Ų | 1 | 21.6 Ų | 21.6 | 0% | 0.004 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -53.7 | -54.7 | 171.9 | 164.6 | -94.5 | 0 | 0 | 0 | 112.3 | W135 A138 F142 S184 L190 T191 F192 G252 V255 A259 | W135-F188 HydrophobicContact CB-CE1 4.45Å; W135-F188 AromaticContact CD1-CE1 3.88Å; A138-F188 HydrophobicContact CB-CD1 4.34Å; A138-F188 HydrophobicContact CB-CD2 4.42Å; A138-F188 HydrophobicContact CB-CE1 3.69Å; A138-F188 HydrophobicContact CB-CE2 3.77Å; A138-F188 HydrophobicContact CB-CZ 3.36Å; F142-F188 HydrophobicContact CE2-CB 3.82Å; F142-F188 HydrophobicContact CE2-CD1 4.02Å; F142-F188 HydrophobicContact CE2-CD2 4.3Å; F142-F188 AromaticContact CE2-CG 3.75Å; F142-F188 HydrophobicContact CE2-CG 3.75Å; F142-F188 HydrophobicContact CZ-CB 3.95Å; F142-F188 HydrophobicContact CZ-CD1 4.39Å; F142-F188 AromaticContact CZ-CD2 3.86Å; F142-F188 HydrophobicContact CZ-CD2 3.86Å; F142-F188 AromaticContact CZ-CG 3.77Å; F142-F188 HydrophobicContact CZ-CG 3.77Å; S184-F188 PolarHBondContact O-N 3.27Å; F188-L190 PolarHBondContact O-N 2.74Å; F188-T191 PolarHBondContact O-N 3.11Å; F188-F192 VanDerWaalsContact O-CB 3.26Å; F188-F192 WeakPolarHBondContact O-CB 3.39Å; F188-F192 PolarHBondContact O-N 2.9Å; F188-G252 VanDerWaalsContact CA-O 3.27Å; F188-G252 WeakPolarHBondContact CA-O 3.47Å; F188-G252 WeakPolarHBondContact CB-O 3.29Å; F188-V255 HydrophobicContact CD2-CB 4.13Å; F188-V255 HydrophobicContact CD2-CG1 3.82Å; F188-V255 HydrophobicContact CE2-CG1 3.88Å; F188-A259 HydrophobicContact CE2-CB 4.25Å |
| 189 | L | 94.1 | Very high | 92.2 | Very high | 4 Ų | 4 | 21.2 Ų | 21.2 | 2% | 0.021 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -63.7 | -45.9 | -174 | 178.1 | 59.9 | 0 | 0 | 0 | 111.5 | A95 W96 W135 S185 H186 F192 C193 | A95-L189 HydrophobicContact CB-CD2 4.25Å; W96-L189 HydrophobicContact CB-CD1 4.24Å; W96-L189 HydrophobicContact CE3-CD1 4.25Å; W135-L189 HydrophobicContact CD2-CD1 4.12Å; W135-L189 HydrophobicContact CG-CD1 4Å; W135-L189 HydrophobicContact CZ2-CD2 4.16Å; S185-L189 VanDerWaalsContact O-CB 3.31Å; S185-L189 WeakPolarHBondContact O-CB 3.41Å; S185-L189 PolarHBondContact O-N 3.5Å; H186-L189 PolarHBondContact O-N 3.08Å; L189-F192 PolarHBondContact O-N 3.49Å; L189-C193 WeakPolarHBondContact O-CB 3.44Å; L189-C193 PolarHBondContact O-N 2.88Å; L189-C193 PolarHBondContact O-SG 3.33Å |
| 190 | L | 94.1 | Very high | 92.6 | Very high | 0 Ų | 0 | 15.1 Ų | 15.1 | 0% | 0 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -65.4 | -45.6 | -180 | -70.3 | 169.5 | 0 | 0 | 0 | 111.6 | V92 A95 H186 F188 F192 C193 C194 W232 L235 L236 | V92-L190 HydrophobicContact CG1-CD1 4.04Å; V92-L190 HydrophobicContact CG1-CD2 4.41Å; V92-L190 HydrophobicContact CG1-CG 4.11Å; V92-L190 HydrophobicContact CG2-CD1 4.2Å; A95-L190 HydrophobicContact CB-CD2 4.33Å; H186-L190 WeakPolarHBondContact O-CB 3.4Å; H186-L190 VanDerWaalsContact O-CG 3.31Å; H186-L190 WeakPolarHBondContact O-CG 3.25Å; H186-L190 PolarHBondContact O-N 3.14Å; F188-L190 PolarHBondContact O-N 2.74Å; L190-F192 PolarHBondContact O-N 2.83Å; L190-C193 PolarHBondContact O-N 3.09Å; L190-C194 VanDerWaalsContact O-CB 3.31Å; L190-C194 WeakPolarHBondContact O-CB 3.47Å; L190-C194 PolarHBondContact O-N 2.87Å; L190-C194 PolarHBondContact O-SG 3.25Å; L190-W232 HydrophobicContact CD2-CB 4.28Å; L190-W232 HydrophobicContact CD2-CD2 4.19Å; L190-W232 HydrophobicContact CD2-CE3 3.67Å; L190-W232 HydrophobicContact CD2-CG 4.44Å; L190-W232 HydrophobicContact CD2-CZ3 4.47Å; L190-L235 HydrophobicContact CD1-CB 4.17Å; L190-L235 HydrophobicContact CD2-CB 4.3Å; L190-L236 HydrophobicContact CB-CB 4.27Å; L190-L236 HydrophobicContact CB-CD1 4.18Å; L190-L236 HydrophobicContact CD1-CB 4.36Å |
| 191 | T | 95.3 | Very high | 93.1 | Very high | 1 Ų | 1 | 14.3 Ų | 14.3 | 1% | 0.006 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -60.9 | -45 | 176 | -61.8 | 0 | 0 | 0 | 0 | 111.3 | T187 F188 C194 L195 A253 | T187-T191 WeakPolarHBondContact O-CB 3.34Å; T187-T191 PolarHBondContact O-N 2.69Å; T187-T191 PolarHBondContact O-OG1 3.4Å; F188-T191 PolarHBondContact O-N 3.11Å; T191-C194 PolarHBondContact O-N 3.23Å; T191-L195 HydrophobicContact CG2-CD1 4.21Å; T191-L195 WeakPolarHBondContact O-CG 3.42Å; T191-L195 PolarHBondContact O-N 2.91Å; T191-L195 VanDerWaalsContact O-N 3.13Å; T191-A253 HydrophobicContact CG2-CB 4.43Å |
| 192 | F | 95.6 | Very high | 93.4 | Very high | 1 Ų | 1 | 11.6 Ų | 11.6 | 0% | 0.004 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -62.9 | -47.6 | 178.6 | -177.9 | -112.3 | 0 | 0 | 0 | 112.1 | W96 V134 F188 L189 L190 C194 L195 L196 A259 W260 | W96-F192 HydrophobicContact CH2-CE1 4.36Å; W96-F192 HydrophobicContact CZ3-CD1 4.2Å; W96-F192 AromaticContact CZ3-CE1 3.9Å; W96-F192 HydrophobicContact CZ3-CE1 3.9Å; V134-F192 HydrophobicContact CB-CZ 4.28Å; V134-F192 HydrophobicContact CG1-CE1 4.47Å; V134-F192 HydrophobicContact CG1-CE2 4.15Å; V134-F192 HydrophobicContact CG1-CZ 3.96Å; F188-F192 VanDerWaalsContact O-CB 3.26Å; F188-F192 WeakPolarHBondContact O-CB 3.39Å; F188-F192 PolarHBondContact O-N 2.9Å; L189-F192 PolarHBondContact O-N 3.49Å; L190-F192 PolarHBondContact O-N 2.83Å; F192-C194 PolarHBondContact O-N 2.9Å; F192-L195 PolarHBondContact O-N 2.79Å; F192-L196 HydrophobicContact CE1-CD1 3.91Å; F192-L196 HydrophobicContact CZ-CD1 3.97Å; F192-L196 WeakPolarHBondContact O-CB 3.42Å; F192-L196 PolarHBondContact O-N 2.91Å; F192-A259 HydrophobicContact CD2-CB 4.1Å; F192-A259 HydrophobicContact CE2-CB 4.13Å; F192-W260 HydrophobicContact CD2-CB 4.4Å |
| 193 | C | 95.7 | Very high | 93.6 | Very high | 0 Ų | 0 | 9.3 Ų | 9.3 | 0% | 0 | 6% | 0.058 | C | C | . | . | H | α-helix | trans | -60.3 | -43.7 | 176.5 | -73.2 | 0 | 0 | 0 | 0 | 112.1 | L189 L190 L196 M197 | L189-C193 WeakPolarHBondContact O-CB 3.44Å; L189-C193 PolarHBondContact O-N 2.88Å; L189-C193 PolarHBondContact O-SG 3.33Å; L190-C193 PolarHBondContact O-N 3.09Å; C193-L196 PolarHBondContact O-N 3.3Å; C193-M197 VanDerWaalsContact O-CB 3.26Å; C193-M197 WeakPolarHBondContact O-CB 3.38Å; C193-M197 WeakPolarHBondContact O-CG 3.47Å; C193-M197 PolarHBondContact O-N 3.35Å |
| 194 | C | 96.3 | Very high | 93.8 | Very high | 0 Ų | 0 | 8.7 Ų | 8.7 | 0% | 0 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -56.8 | -50.9 | 177.1 | -82.3 | 0 | 0 | 0 | 0 | 112.6 | Y56 L60 L190 T191 F192 A198 L229 W232 | Y56-C194 HydrophobicContact CE1-CB 4.42Å; Y56-C194 VanDerWaalsContact OH-CB 3.29Å; Y56-C194 WeakPolarHBondContact OH-CB 3.38Å; L60-C194 HydrophobicContact CD1-CB 4.27Å; L60-C194 HydrophobicContact CD2-CB 4.3Å; L190-C194 VanDerWaalsContact O-CB 3.31Å; L190-C194 WeakPolarHBondContact O-CB 3.47Å; L190-C194 PolarHBondContact O-N 2.87Å; L190-C194 PolarHBondContact O-SG 3.25Å; T191-C194 PolarHBondContact O-N 3.23Å; F192-C194 PolarHBondContact O-N 2.9Å; C194-A198 WeakPolarHBondContact O-CB 3.34Å; C194-A198 PolarHBondContact O-N 3.25Å; C194-L229 HydrophobicContact CB-CD1 4.11Å; C194-W232 WeakPolarHBondContact SG-CB 3.29Å |
| 195 | L | 95.4 | Very high | 93.8 | Very high | 2 Ų | 2 | 8.6 Ų | 8.6 | 1% | 0.01 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -65.9 | -44.3 | -179.8 | -70.4 | 173.2 | 0 | 0 | 0 | 112.1 | Y56 L60 T191 F192 A198 E199 T257 W260 | Y56-L195 HydrophobicContact CD1-CD2 4.44Å; Y56-L195 HydrophobicContact CE1-CD2 4.48Å; L60-L195 HydrophobicContact CD1-CD2 3.48Å; L60-L195 VanDerWaalsContact CD1-CD2 3.48Å; L60-L195 HydrophobicContact CD1-CG 3.73Å; T191-L195 HydrophobicContact CG2-CD1 4.21Å; T191-L195 WeakPolarHBondContact O-CG 3.42Å; T191-L195 PolarHBondContact O-N 2.91Å; T191-L195 VanDerWaalsContact O-N 3.13Å; F192-L195 PolarHBondContact O-N 2.79Å; L195-A198 PolarHBondContact O-N 2.92Å; L195-E199 PolarHBondContact O-N 3.16Å; L195-E199 VanDerWaalsContact O-N 3.12Å; L195-T257 HydrophobicContact CD1-CG2 4.3Å; L195-W260 HydrophobicContact CB-CB 4.13Å; L195-W260 VanDerWaalsContact CB-CD1 3.49Å; L195-W260 HydrophobicContact CB-CD2 4.28Å; L195-W260 HydrophobicContact CB-CG 3.69Å; L195-W260 HydrophobicContact CD1-CB 3.8Å; L195-W260 HydrophobicContact CD1-CD2 4.25Å; L195-W260 HydrophobicContact CD1-CG 3.92Å; L195-W260 HydrophobicContact CG-CG 4.37Å |
| 196 | L | 95 | Very high | 93.9 | Very high | 1 Ų | 1 | 11.6 Ų | 11.6 | 1% | 0.005 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -59.1 | -50.2 | 176.9 | -174.4 | 157.1 | 0 | 0 | 0 | 110.8 | W96 L103 L128 F192 C193 A198 E199 E200 Y264 | W96-L196 HydrophobicContact CH2-CD1 4.08Å; W96-L196 HydrophobicContact CZ3-CD1 4.17Å; L103-L196 HydrophobicContact CD2-CD2 3.16Å; L128-L196 HydrophobicContact CD2-CD2 4.27Å; F192-L196 HydrophobicContact CE1-CD1 3.91Å; F192-L196 HydrophobicContact CZ-CD1 3.97Å; F192-L196 WeakPolarHBondContact O-CB 3.42Å; F192-L196 PolarHBondContact O-N 2.91Å; C193-L196 PolarHBondContact O-N 3.3Å; L196-A198 PolarHBondContact O-N 3.44Å; L196-E199 PolarHBondContact O-N 3.35Å; L196-E200 HydrophobicContact CD2-CG 4.25Å; L196-E200 WeakPolarHBondContact O-CG 3.33Å; L196-E200 PolarHBondContact O-N 2.76Å; L196-E200 VanDerWaalsContact O-N 3.08Å; L196-Y264 HydrophobicContact CB-CE2 4.35Å; L196-Y264 HydrophobicContact CD1-CE2 4.25Å; L196-Y264 HydrophobicContact CG-CE2 3.9Å; L196-Y264 WeakPolarHBondContact CG-OH 3.33Å |
| 197 | M | 95.5 | Very high | 93.9 | Very high | 2 Ų | 2 | 10 Ų | 10 | 1% | 0.01 | 5% | 0.053 | C | C | . | . | H | α-helix | trans | -62.8 | -42.1 | 179.2 | -75.3 | 177.3 | 69.9 | 0 | 0 | 112.3 | T99 L103 C193 E199 E200 A201 N225 L228 L229 W232 | T99-M197 HydrophobicContact CG2-CG 3.81Å; T99-M197 HydrophobicContact CG2-SD 3.96Å; L103-M197 HydrophobicContact CD1-CG 4.44Å; L103-M197 HydrophobicContact CD2-CG 3.91Å; C193-M197 VanDerWaalsContact O-CB 3.26Å; C193-M197 WeakPolarHBondContact O-CB 3.38Å; C193-M197 WeakPolarHBondContact O-CG 3.47Å; C193-M197 PolarHBondContact O-N 3.35Å; M197-E199 VanDerWaalsContact C-N 3.34Å; M197-E199 PolarHBondContact O-N 3.1Å; M197-E200 PolarHBondContact O-N 3.36Å; M197-A201 WeakPolarHBondContact O-CB 3.49Å; M197-A201 PolarHBondContact O-N 2.99Å; M197-N225 HydrophobicContact CE-CB 4.35Å; M197-N225 WeakPolarHBondContact CE-O 3.31Å; M197-L228 HydrophobicContact CE-CB 3.86Å; M197-L228 HydrophobicContact CE-CD2 3.76Å; M197-L228 HydrophobicContact CE-CG 3.93Å; M197-L228 HydrophobicContact SD-CD2 4.24Å; M197-L228 HydrophobicContact SD-CG 4.5Å; M197-L229 HydrophobicContact CB-CD1 4.25Å; M197-L229 HydrophobicContact CE-CB 4.03Å; M197-W232 PolarHBondContact SD-NE1 2.74Å |
| 198 | A | 94.9 | Very high | 93.9 | Very high | 8 Ų | 8 | 11.8 Ų | 11.8 | 7% | 0.066 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -61.1 | -42.3 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112 | Y56 C194 L195 L196 A202 | Y56-A198 HydrophobicContact CD1-CB 3.96Å; Y56-A198 HydrophobicContact CE1-CB 3.84Å; C194-A198 WeakPolarHBondContact O-CB 3.34Å; C194-A198 PolarHBondContact O-N 3.25Å; L195-A198 PolarHBondContact O-N 2.92Å; L196-A198 PolarHBondContact O-N 3.44Å; A198-A202 WeakPolarHBondContact O-CB 3.19Å; A198-A202 PolarHBondContact O-N 3.32Å; A198-A202 VanDerWaalsContact O-N 3.13Å |
| 199 | E | 94 | Very high | 93.6 | Very high | 18 Ų | 18 | 15.8 Ų | 15.8 | 8% | 0.084 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -68.7 | -43.5 | 177.7 | -77.5 | -62.2 | 151.8 | 0 | 0 | 113 | R53 L195 L196 M197 W260 Y264 | R53-E199 IonicContact CZ-OE1 3.36Å; R53-E199 IonicContact CZ-OE2 2.84Å; R53-E199 IonicContact NE-OE1 2.7Å; R53-E199 PolarHBondContact NE-OE1 3.49Å; R53-E199 IonicContact NE-OE2 3.21Å; R53-E199 VanDerWaalsContact NH2-CD 3.33Å; R53-E199 IonicContact NH2-OE1 3.03Å; R53-E199 PolarHBondContact NH2-OE1 2.97Å; R53-E199 IonicContact NH2-OE2 2.94Å; R53-E199 PolarHBondContact NH2-OE2 3.21Å; L195-E199 PolarHBondContact O-N 3.16Å; L195-E199 VanDerWaalsContact O-N 3.12Å; L196-E199 PolarHBondContact O-N 3.35Å; M197-E199 VanDerWaalsContact C-N 3.34Å; M197-E199 PolarHBondContact O-N 3.1Å; E199-W260 HydrophobicContact CG-CZ2 3.72Å; E199-Y264 HydrophobicContact CB-CD1 3.89Å; E199-Y264 HydrophobicContact CB-CE1 3.99Å; E199-Y264 HydrophobicContact CG-CD1 4.22Å |
| 200 | E | 94.4 | Very high | 93.3 | Very high | 6 Ų | 6 | 20.4 Ų | 20.4 | 3% | 0.028 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -67.7 | -41.7 | 177.9 | -67.4 | -57.9 | 161.9 | 0 | 0 | 112.1 | L103 F106 V107 R127 L196 M197 A202 V203 Y264 | L103-E200 HydrophobicContact CD1-CB 3.8Å; L103-E200 HydrophobicContact CD2-CB 3.97Å; L103-E200 HydrophobicContact CD2-CG 3.86Å; L103-E200 HydrophobicContact CG-CB 4.14Å; L103-E200 HydrophobicContact CG-CG 4.4Å; F106-E200 WeakPolarHBondContact CE1-O 3.12Å; V107-E200 HydrophobicContact CG2-CB 4.48Å; R127-E200 IonicContact CZ-OE1 3.88Å; R127-E200 IonicContact CZ-OE2 3.48Å; R127-E200 IonicContact NE-OE1 3Å; R127-E200 PolarHBondContact NE-OE1 2.77Å; R127-E200 IonicContact NH1-OE1 2.67Å; R127-E200 PolarHBondContact NH1-OE1 3.27Å; R127-E200 IonicContact NH1-OE2 3.07Å; R127-E200 PolarHBondContact NH1-OE2 3.31Å; R127-E200 VanDerWaalsContact NH2-CD 3.35Å; R127-E200 IonicContact NH2-OE1 2.77Å; R127-E200 PolarHBondContact NH2-OE1 3.39Å; R127-E200 IonicContact NH2-OE2 3.5Å; R127-E200 PolarHBondContact NH2-OE2 3.02Å; L196-E200 HydrophobicContact CD2-CG 4.25Å; L196-E200 WeakPolarHBondContact O-CG 3.33Å; L196-E200 PolarHBondContact O-N 2.76Å; L196-E200 VanDerWaalsContact O-N 3.08Å; M197-E200 PolarHBondContact O-N 3.36Å; E200-A202 VanDerWaalsContact C-N 3.3Å; E200-A202 PolarHBondContact O-N 3.12Å; E200-V203 WeakPolarHBondContact O-CB 3.45Å; E200-V203 WeakPolarHBondContact O-CG2 3.41Å; E200-V203 PolarHBondContact O-N 3.26Å; E200-Y264 HydrophobicContact CG-CE1 4.47Å; E200-Y264 VanDerWaalsContact OE1-CE1 3.24Å; E200-Y264 WeakPolarHBondContact OE1-CE1 3.45Å; E200-Y264 PolarHBondContact OE1-OH 2.9Å |
| 201 | A | 93.6 | Very high | 92.8 | Very high | 4 Ų | 4 | 23.6 Ų | 23.6 | 3% | 0.033 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -66.6 | -31.5 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | L47 M197 V203 F204 F222 | L47-A201 HydrophobicContact CD1-CB 4.01Å; M197-A201 WeakPolarHBondContact O-CB 3.49Å; M197-A201 PolarHBondContact O-N 2.99Å; A201-V203 PolarHBondContact O-N 2.95Å; A201-V203 VanDerWaalsContact O-N 3.12Å; A201-F204 WeakPolarHBondContact O-CB 3.23Å; A201-F204 PolarHBondContact O-N 3.15Å; A201-F222 HydrophobicContact CB-CE2 4.07Å |
| 202 | A | 93.1 | Very high | 92.5 | Very high | 11 Ų | 11 | 25.8 Ų | 25.8 | 9% | 0.091 | 16% | 0.161 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61 | -20.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | L47 A198 E200 F204 A205 | L47-A202 WeakPolarHBondContact O-CB 3.16Å; A198-A202 WeakPolarHBondContact O-CB 3.19Å; A198-A202 PolarHBondContact O-N 3.32Å; A198-A202 VanDerWaalsContact O-N 3.13Å; E200-A202 VanDerWaalsContact C-N 3.3Å; E200-A202 PolarHBondContact O-N 3.12Å; A202-F204 PolarHBondContact O-N 3.32Å; A202-A205 PolarHBondContact O-N 3.4Å |
| 203 | V | 92.7 | Very high | 92 | Very high | 10 Ų | 10 | 30 Ų | 30 | 6% | 0.061 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -60.9 | -29.3 | 174.8 | -179.3 | 0 | 0 | 0 | 0 | 111.5 | V110 E200 A201 A205 K206 Y207 P277 F282 | V110-V203 HydrophobicContact CG1-CG1 4.34Å; E200-V203 WeakPolarHBondContact O-CB 3.45Å; E200-V203 WeakPolarHBondContact O-CG2 3.41Å; E200-V203 PolarHBondContact O-N 3.26Å; A201-V203 PolarHBondContact O-N 2.95Å; A201-V203 VanDerWaalsContact O-N 3.12Å; V203-A205 VanDerWaalsContact C-N 3.3Å; V203-A205 PolarHBondContact O-N 3.41Å; V203-K206 PolarHBondContact O-N 3.13Å; V203-K206 VanDerWaalsContact O-N 3.15Å; V203-Y207 PolarHBondContact O-N 3.05Å; V203-P277 HydrophobicContact CG2-CB 3.31Å; V203-F282 HydrophobicContact CG1-CE2 4.24Å; V203-F282 HydrophobicContact CG1-CZ 4.34Å |
| 204 | F | 93.4 | Very high | 91.6 | Very high | 0 Ų | 0 | 30.7 Ų | 30.7 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -64.2 | -33 | -176.4 | -159.7 | -132.7 | 0 | 0 | 0 | 113.1 | A44 F106 V110 A201 A202 K206 Y207 L208 A214 L218 R219 F222 | A44-F204 HydrophobicContact CB-CB 4.42Å; A44-F204 HydrophobicContact CB-CD1 3.73Å; A44-F204 HydrophobicContact CB-CE1 4.45Å; A44-F204 HydrophobicContact CB-CG 4.46Å; F106-F204 HydrophobicContact CE2-CB 4.21Å; F106-F204 HydrophobicContact CE2-CD2 4.03Å; F106-F204 HydrophobicContact CE2-CG 4.13Å; F106-F204 HydrophobicContact CZ-CB 3.88Å; F106-F204 HydrophobicContact CZ-CD2 4.35Å; F106-F204 HydrophobicContact CZ-CG 4.29Å; V110-F204 HydrophobicContact CG2-CD2 4.35Å; A201-F204 WeakPolarHBondContact O-CB 3.23Å; A201-F204 PolarHBondContact O-N 3.15Å; A202-F204 PolarHBondContact O-N 3.32Å; F204-K206 VanDerWaalsContact C-N 3.33Å; F204-K206 PolarHBondContact O-N 2.92Å; F204-Y207 HydrophobicContact CD2-CD1 4.11Å; F204-Y207 HydrophobicContact CD2-CG 4.33Å; F204-Y207 AromaticContact CE2-CD1 3.87Å; F204-Y207 HydrophobicContact CE2-CD1 3.87Å; F204-Y207 HydrophobicContact CE2-CE1 4.38Å; F204-Y207 WeakPolarHBondContact O-CB 3.38Å; F204-Y207 PolarHBondContact O-N 3.01Å; F204-L208 HydrophobicContact CD1-CD1 3.92Å; F204-L208 HydrophobicContact CD1-CG 4.44Å; F204-L208 HydrophobicContact CE1-CD1 3.67Å; F204-L208 HydrophobicContact CE1-CD2 4.43Å; F204-L208 HydrophobicContact CE1-CG 4.16Å; F204-L208 HydrophobicContact CE2-CD2 4.33Å; F204-L208 HydrophobicContact CE2-CG 4.27Å; F204-L208 HydrophobicContact CG-CD1 4.49Å; F204-L208 HydrophobicContact CZ-CD1 4.06Å; F204-L208 HydrophobicContact CZ-CD2 3.97Å; F204-L208 HydrophobicContact CZ-CG 4.06Å; F204-L208 WeakPolarHBondContact O-CG 3.46Å; F204-L208 PolarHBondContact O-N 3.45Å; F204-A214 HydrophobicContact CE2-CB 4.31Å; F204-A214 HydrophobicContact CZ-CB 4.14Å; F204-L218 HydrophobicContact CE2-CD2 3.73Å; F204-L218 HydrophobicContact CE2-CG 3.92Å; F204-L218 HydrophobicContact CZ-CD2 4.47Å; F204-L218 HydrophobicContact CZ-CG 4.37Å; F204-R219 HydrophobicContact CZ-CG 4.15Å; F204-F222 HydrophobicContact CB-CD2 3.9Å; F204-F222 HydrophobicContact CB-CE2 3.7Å; F204-F222 HydrophobicContact CB-CZ 4.32Å; F204-F222 HydrophobicContact CD1-CB 4.26Å; F204-F222 AromaticContact CD1-CD1 3.59Å; F204-F222 HydrophobicContact CD1-CD1 3.59Å; F204-F222 AromaticContact CD1-CD2 3.61Å; F204-F222 HydrophobicContact CD1-CD2 3.61Å; F204-F222 AromaticContact CD1-CE1 3.73Å; F204-F222 HydrophobicContact CD1-CE1 3.73Å; F204-F222 AromaticContact CD1-CE2 3.75Å; F204-F222 HydrophobicContact CD1-CE2 3.75Å; F204-F222 AromaticContact CD1-CG 3.53Å; F204-F222 HydrophobicContact CD1-CG 3.53Å; F204-F222 AromaticContact CD1-CZ 3.81Å; F204-F222 HydrophobicContact CD1-CZ 3.81Å; F204-F222 HydrophobicContact CE1-CB 4.24Å; F204-F222 AromaticContact CE1-CD1 3.78Å; F204-F222 HydrophobicContact CE1-CD1 3.78Å; F204-F222 HydrophobicContact CE1-CD2 4.4Å; F204-F222 HydrophobicContact CE1-CE1 4.22Å; F204-F222 AromaticContact CE1-CG 3.87Å; F204-F222 HydrophobicContact CE1-CG 3.87Å; F204-F222 AromaticContact CG-CD2 3.89Å; F204-F222 HydrophobicContact CG-CD2 3.89Å; F204-F222 HydrophobicContact CG-CE2 4.06Å; F204-F222 HydrophobicContact CG-CG 4.18Å |
| 205 | A | 91.9 | Very high | 91.3 | Very high | 21 Ų | 21 | 32.3 Ų | 32.3 | 17% | 0.174 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -58.5 | -46.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112 | A44 A202 V203 L208 A209 | A44-A205 WeakPolarHBondContact O-CB 3.15Å; A202-A205 PolarHBondContact O-N 3.4Å; V203-A205 VanDerWaalsContact C-N 3.3Å; V203-A205 PolarHBondContact O-N 3.41Å; A205-L208 PolarHBondContact O-N 2.88Å; A205-A209 WeakPolarHBondContact O-CB 3.17Å; A205-A209 PolarHBondContact O-N 2.97Å |
| 206 | K | 90.7 | Very high | 91 | Very high | 119 Ų | 119 | 34.3 Ų | 34.3 | 52% | 0.517 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -68.2 | -37.8 | 177.6 | -66 | -179.5 | -177.9 | 174.8 | 0 | 111.1 | V203 F204 L208 A209 H210 F282 | V203-K206 PolarHBondContact O-N 3.13Å; V203-K206 VanDerWaalsContact O-N 3.15Å; F204-K206 VanDerWaalsContact C-N 3.33Å; F204-K206 PolarHBondContact O-N 2.92Å; K206-L208 PolarHBondContact O-N 3.39Å; K206-A209 PolarHBondContact O-N 2.75Å; K206-H210 PolarHBondContact O-N 3.2Å; K206-H210 VanDerWaalsContact O-N 3.15Å; K206-H210 PolarHBondContact O-ND1 2.93Å; K206-F282 HydrophobicContact CB-CD2 4.18Å; K206-F282 HydrophobicContact CB-CE1 4.48Å; K206-F282 HydrophobicContact CB-CE2 3.56Å; K206-F282 HydrophobicContact CB-CZ 3.74Å; K206-F282 HydrophobicContact CD-CE2 4.3Å |
| 207 | Y | 90.6 | Very high | 90.9 | Very high | 0 Ų | 0 | 38.6 Ų | 38.6 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -57 | -49 | 175.5 | -176.3 | -84.2 | 0 | 0 | 0 | 111.8 | V110 A114 V203 F204 H210 L212 P213 A214 L218 | V110-Y207 HydrophobicContact CG1-CD2 3.8Å; V110-Y207 HydrophobicContact CG1-CE2 4.27Å; V110-Y207 HydrophobicContact CG1-CG 4.49Å; A114-Y207 HydrophobicContact CB-CD2 4.4Å; A114-Y207 HydrophobicContact CB-CE2 3.98Å; V203-Y207 PolarHBondContact O-N 3.05Å; F204-Y207 HydrophobicContact CD2-CD1 4.11Å; F204-Y207 HydrophobicContact CD2-CG 4.33Å; F204-Y207 AromaticContact CE2-CD1 3.87Å; F204-Y207 HydrophobicContact CE2-CD1 3.87Å; F204-Y207 HydrophobicContact CE2-CE1 4.38Å; F204-Y207 WeakPolarHBondContact O-CB 3.38Å; F204-Y207 PolarHBondContact O-N 3.01Å; Y207-H210 PolarHBondContact O-N 2.85Å; Y207-L212 HydrophobicContact CD1-CB 3.93Å; Y207-L212 HydrophobicContact CD2-CB 4.07Å; Y207-L212 HydrophobicContact CD2-CD1 3.46Å; Y207-L212 VanDerWaalsContact CD2-CD1 3.46Å; Y207-L212 HydrophobicContact CD2-CG 4.43Å; Y207-L212 HydrophobicContact CE1-CB 3.52Å; Y207-L212 HydrophobicContact CE2-CB 3.72Å; Y207-L212 HydrophobicContact CE2-CD1 3.55Å; Y207-L212 HydrophobicContact CE2-CG 4.28Å; Y207-L212 HydrophobicContact CG-CB 4.18Å; Y207-L212 HydrophobicContact CG-CD1 4.06Å; Y207-L212 VanDerWaalsContact CZ-CB 3.41Å; Y207-L212 PolarHBondContact O-N 3.19Å; Y207-P213 PolarHBondContact OH-O 3.39Å; Y207-A214 HydrophobicContact CE1-CB 3.99Å; Y207-L218 HydrophobicContact CE1-CD2 3.91Å |
| 208 | L | 90.6 | Very high | 90.8 | Very high | 38 Ų | 38 | 38.6 Ų | 38.6 | 20% | 0.199 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -67.7 | -38.1 | 177.6 | -67.8 | 171.9 | 0 | 0 | 0 | 112.3 | E41 A44 F204 A205 K206 H210 G211 A214 | E41-L208 HydrophobicContact CG-CD1 4.04Å; A44-L208 HydrophobicContact CB-CD1 3.74Å; F204-L208 HydrophobicContact CD1-CD1 3.92Å; F204-L208 HydrophobicContact CD1-CG 4.44Å; F204-L208 HydrophobicContact CE1-CD1 3.67Å; F204-L208 HydrophobicContact CE1-CD2 4.43Å; F204-L208 HydrophobicContact CE1-CG 4.16Å; F204-L208 HydrophobicContact CE2-CD2 4.33Å; F204-L208 HydrophobicContact CE2-CG 4.27Å; F204-L208 HydrophobicContact CG-CD1 4.49Å; F204-L208 HydrophobicContact CZ-CD1 4.06Å; F204-L208 HydrophobicContact CZ-CD2 3.97Å; F204-L208 HydrophobicContact CZ-CG 4.06Å; F204-L208 WeakPolarHBondContact O-CG 3.46Å; F204-L208 PolarHBondContact O-N 3.45Å; A205-L208 PolarHBondContact O-N 2.88Å; K206-L208 PolarHBondContact O-N 3.39Å; L208-H210 PolarHBondContact O-N 3.46Å; L208-G211 PolarHBondContact O-N 2.97Å; L208-A214 HydrophobicContact CD2-CB 3.66Å |
| 209 | A | 88.8 | Confident | 90.8 | Very high | 85 Ų | 85 | 39 Ų | 39 | 70% | 0.702 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -62.6 | -28.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | A205 K206 G211 | A205-A209 WeakPolarHBondContact O-CB 3.17Å; A205-A209 PolarHBondContact O-N 2.97Å; K206-A209 PolarHBondContact O-N 2.75Å; A209-G211 VanDerWaalsContact C-N 3.27Å; A209-G211 PolarHBondContact O-N 3.46Å |
| 210 | H | 87.9 | Confident | 90.8 | Very high | 102 Ų | 102 | 42.5 Ų | 42.5 | 47% | 0.472 | 28% | 0.275 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84 | 3 | 174.9 | -71.4 | 78 | 0 | 0 | 0 | 113.4 | K206 Y207 L208 L212 F282 | K206-H210 PolarHBondContact O-N 3.2Å; K206-H210 VanDerWaalsContact O-N 3.15Å; K206-H210 PolarHBondContact O-ND1 2.93Å; Y207-H210 PolarHBondContact O-N 2.85Å; L208-H210 PolarHBondContact O-N 3.46Å; H210-L212 HydrophobicContact CB-CG 4.28Å; H210-L212 PolarHBondContact O-N 3.08Å; H210-F282 HydrophobicContact CB-CD1 4.24Å; H210-F282 HydrophobicContact CB-CE1 4.42Å; H210-F282 AromaticContact CD2-CD1 3.93Å; H210-F282 AromaticContact CE1-CD1 3.6Å; H210-F282 AromaticContact CE1-CG 3.67Å; H210-F282 AromaticContact CG-CD1 3.6Å; H210-F282 AromaticContact ND1-CD1 3.39Å; H210-F282 WeakPolarHBondContact ND1-CD1 3.24Å; H210-F282 AromaticContact ND1-CE1 3.79Å; H210-F282 AromaticContact ND1-CG 3.93Å; H210-F282 AromaticContact NE2-CD1 3.93Å; H210-F282 AromaticContact NE2-CG 3.99Å |
| 211 | G | 84.5 | Confident | 90.9 | Very high | 66 Ų | 66 | 43.7 Ų | 43.7 | 68% | 0.68 | 28% | 0.282 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 68.6 | 20.6 | 178.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | L208 A209 | L208-G211 PolarHBondContact O-N 2.97Å; A209-G211 VanDerWaalsContact C-N 3.27Å; A209-G211 PolarHBondContact O-N 3.46Å |
| 212 | L | 87.2 | Confident | 91 | Very high | 47 Ų | 47 | 43.5 Ų | 43.5 | 25% | 0.246 | 28% | 0.28 | C | S | . | . | trans | -67.8 | 146.2 | 179.2 | -68.9 | 171.7 | 0 | 0 | 0 | 110.9 | A114 Y207 H210 A214 F282 | A114-L212 HydrophobicContact CB-CD1 4Å; Y207-L212 HydrophobicContact CD1-CB 3.93Å; Y207-L212 HydrophobicContact CD2-CB 4.07Å; Y207-L212 HydrophobicContact CD2-CD1 3.46Å; Y207-L212 VanDerWaalsContact CD2-CD1 3.46Å; Y207-L212 HydrophobicContact CD2-CG 4.43Å; Y207-L212 HydrophobicContact CE1-CB 3.52Å; Y207-L212 HydrophobicContact CE2-CB 3.72Å; Y207-L212 HydrophobicContact CE2-CD1 3.55Å; Y207-L212 HydrophobicContact CE2-CG 4.28Å; Y207-L212 HydrophobicContact CG-CB 4.18Å; Y207-L212 HydrophobicContact CG-CD1 4.06Å; Y207-L212 VanDerWaalsContact CZ-CB 3.41Å; Y207-L212 PolarHBondContact O-N 3.19Å; H210-L212 HydrophobicContact CB-CG 4.28Å; H210-L212 PolarHBondContact O-N 3.08Å; L212-A214 PolarHBondContact O-N 2.88Å; L212-F282 HydrophobicContact CD1-CE1 3.94Å | ||
| 213 | P | 85.8 | Confident | 91.1 | Very high | 90 Ų | 90 | 44.8 Ų | 44.8 | 58% | 0.584 | 29% | 0.286 | S | S | * | . | trans | -64.4 | 111.8 | -175.5 | 25.4 | -33.8 | 0 | 0 | 0 | 110.6 | Y207 | Y207-P213 PolarHBondContact OH-O 3.39Š| ||
| 214 | A | 88 | Confident | 91.3 | Very high | 14 Ų | 14 | 47.3 Ų | 47.3 | 12% | 0.116 | 30% | 0.298 | C | S | . | . | trans | -109 | 85.4 | 176 | 0 | 0 | 0 | 0 | 0 | 110 | F204 Y207 L208 L212 L218 R219 | F204-A214 HydrophobicContact CE2-CB 4.31Å; F204-A214 HydrophobicContact CZ-CB 4.14Å; Y207-A214 HydrophobicContact CE1-CB 3.99Å; L208-A214 HydrophobicContact CD2-CB 3.66Å; L212-A214 PolarHBondContact O-N 2.88Å; A214-L218 HydrophobicContact CB-CD2 4.35Å; A214-R219 HydrophobicContact CB-CG 4.37Å; A214-R219 PolarHBondContact O-NE 3.5Å; A214-R219 VanDerWaalsContact O-NE 3.11Å | ||
| 215 | G | 89.6 | Confident | 91.4 | Very high | 34 Ų | 34 | 47.4 Ų | 47.4 | 35% | 0.351 | 30% | 0.299 | S | S | . | . | trans | -66 | 166.5 | 176 | 0 | 0 | 0 | 0 | 0 | 113 | P217 L218 R219 | G215-P217 VanDerWaalsContact C-CD 3.43Å; G215-L218 PolarHBondContact O-N 3.38Å; G215-R219 PolarHBondContact O-N 3.23Å | ||
| 216 | A | 89.8 | Confident | 91.7 | Very high | 45 Ų | 45 | 48.4 Ų | 48.4 | 37% | 0.372 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -48.8 | -44.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 115.1 | L36 L218 R219 L220 | L36-A216 HydrophobicContact CD2-CB 4.03Å; A216-L218 PolarHBondContact O-N 2.84Å; A216-R219 PolarHBondContact O-N 3.35Å; A216-L220 WeakPolarHBondContact O-CB 3.35Å; A216-L220 PolarHBondContact O-N 3.41Å |
| 217 | P | 91.9 | Very high | 91.9 | Very high | 90 Ų | 90 | 48.6 Ų | 48.6 | 58% | 0.584 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -64.8 | -38 | -178.3 | 23.7 | -34.3 | 0 | 0 | 0 | 112.9 | G215 L220 V221 | G215-P217 VanDerWaalsContact C-CD 3.43Å; P217-L220 PolarHBondContact O-N 3.22Å; P217-V221 WeakPolarHBondContact O-CG2 3.49Å; P217-V221 PolarHBondContact O-N 3.1Å |
| 218 | L | 93.9 | Very high | 92.1 | Very high | 2 Ų | 2 | 49.1 Ų | 49.1 | 1% | 0.01 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -66.1 | -45.4 | 177.2 | 174.1 | 60.4 | 0 | 0 | 0 | 111.1 | F106 L109 V110 L113 F204 Y207 A214 G215 A216 L220 V221 F222 | F106-L218 HydrophobicContact CD2-CD1 4Å; F106-L218 HydrophobicContact CE2-CD1 4.17Å; L109-L218 HydrophobicContact CB-CD1 3.8Å; V110-L218 HydrophobicContact CG2-CD1 3.51Å; V110-L218 HydrophobicContact CG2-CD2 4.31Å; V110-L218 HydrophobicContact CG2-CG 4.48Å; L113-L218 HydrophobicContact CD1-CB 4.5Å; L113-L218 HydrophobicContact CD1-CD2 4.1Å; F204-L218 HydrophobicContact CE2-CD2 3.73Å; F204-L218 HydrophobicContact CE2-CG 3.92Å; F204-L218 HydrophobicContact CZ-CD2 4.47Å; F204-L218 HydrophobicContact CZ-CG 4.37Å; Y207-L218 HydrophobicContact CE1-CD2 3.91Å; A214-L218 HydrophobicContact CB-CD2 4.35Å; G215-L218 PolarHBondContact O-N 3.38Å; A216-L218 PolarHBondContact O-N 2.84Å; L218-L220 VanDerWaalsContact C-N 3.31Å; L218-L220 PolarHBondContact O-N 2.99Å; L218-V221 PolarHBondContact O-N 3.28Å; L218-F222 WeakPolarHBondContact O-CB 3.39Å; L218-F222 PolarHBondContact O-N 3.21Å |
| 219 | R | 94.5 | Very high | 92.4 | Very high | 17 Ų | 17 | 48 Ų | 48 | 6% | 0.064 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -62.4 | -38.9 | 177.3 | -69.4 | 179.2 | 178.9 | -119.6 | 10.4 | 111.6 | L36 Y37 S40 E41 F204 A214 G215 A216 F222 L223 | L36-R219 HydrophobicContact CD1-CB 4.29Å; L36-R219 HydrophobicContact CD2-CB 4.34Å; L36-R219 HydrophobicContact CG-CB 4.11Å; Y37-R219 VanDerWaalsContact CD1-NH2 3.33Å; Y37-R219 PolarHBondContact O-NH1 2.92Å; S40-R219 WeakPolarHBondContact OG-CD 3.5Å; S40-R219 PolarHBondContact OG-NH1 3.35Å; S40-R219 VanDerWaalsContact OG-NH1 3.08Å; E41-R219 IonicContact OE1-CZ 3.51Å; E41-R219 IonicContact OE1-NH1 3.02Å; E41-R219 PolarHBondContact OE1-NH1 3.24Å; E41-R219 IonicContact OE1-NH2 2.97Å; E41-R219 PolarHBondContact OE1-NH2 3.41Å; F204-R219 HydrophobicContact CZ-CG 4.15Å; A214-R219 HydrophobicContact CB-CG 4.37Å; A214-R219 PolarHBondContact O-NE 3.5Å; A214-R219 VanDerWaalsContact O-NE 3.11Å; G215-R219 PolarHBondContact O-N 3.23Å; A216-R219 PolarHBondContact O-N 3.35Å; R219-F222 PolarHBondContact O-N 3.4Å; R219-L223 WeakPolarHBondContact O-CG 3.35Å; R219-L223 PolarHBondContact O-N 3.37Å |
| 220 | L | 94.6 | Very high | 92.7 | Very high | 92 Ų | 92 | 45.9 Ų | 45.9 | 48% | 0.482 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -64.6 | -50.1 | 176.8 | -177.1 | 66.4 | 0 | 0 | 0 | 111.6 | L36 A216 P217 L218 F222 L223 L224 | L36-L220 HydrophobicContact CD1-CB 4.39Å; L36-L220 HydrophobicContact CD1-CD1 4.4Å; A216-L220 WeakPolarHBondContact O-CB 3.35Å; A216-L220 PolarHBondContact O-N 3.41Å; P217-L220 PolarHBondContact O-N 3.22Å; L218-L220 VanDerWaalsContact C-N 3.31Å; L218-L220 PolarHBondContact O-N 2.99Å; L220-F222 VanDerWaalsContact C-N 3.28Å; L220-F222 PolarHBondContact O-N 2.9Å; L220-L223 PolarHBondContact O-N 3.29Å; L220-L224 HydrophobicContact CG-CD1 4.37Å; L220-L224 WeakPolarHBondContact O-CG 3.43Å; L220-L224 PolarHBondContact O-N 3.23Å |
| 221 | V | 95.8 | Very high | 93 | Very high | 30 Ų | 30 | 43.7 Ų | 43.7 | 18% | 0.182 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -62.8 | -37.5 | 178.1 | 178.6 | 0 | 0 | 0 | 0 | 110.9 | F106 L109 P217 L218 L224 N225 | F106-V221 HydrophobicContact CB-CG1 3.89Å; L109-V221 HydrophobicContact CD1-CG2 4.16Å; P217-V221 WeakPolarHBondContact O-CG2 3.49Å; P217-V221 PolarHBondContact O-N 3.1Å; L218-V221 PolarHBondContact O-N 3.28Å; V221-L224 PolarHBondContact O-N 3.04Å; V221-N225 PolarHBondContact O-N 3.49Å; V221-N225 PolarHBondContact O-ND2 2.89Å |
| 222 | F | 96.3 | Very high | 93.4 | Very high | 0 Ų | 0 | 40.6 Ų | 40.6 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -59.3 | -49.1 | 172.5 | 173.7 | -103.4 | 0 | 0 | 0 | 111.8 | S40 A43 A44 L47 F106 A201 F204 L218 R219 L220 L224 N225 V226 | S40-F222 WeakPolarHBondContact O-CE1 3.49Å; A43-F222 HydrophobicContact CB-CE1 3.86Å; A43-F222 HydrophobicContact CB-CZ 4.34Å; A44-F222 HydrophobicContact CB-CE1 4.23Å; A44-F222 HydrophobicContact CB-CZ 4.06Å; L47-F222 HydrophobicContact CD1-CE2 4.39Å; L47-F222 HydrophobicContact CD1-CZ 4.09Å; F106-F222 HydrophobicContact CD2-CB 4Å; F106-F222 HydrophobicContact CD2-CD2 4.23Å; F106-F222 HydrophobicContact CE2-CB 3.93Å; F106-F222 AromaticContact CE2-CD2 3.61Å; F106-F222 HydrophobicContact CE2-CD2 3.61Å; F106-F222 HydrophobicContact CE2-CG 4.21Å; F106-F222 AromaticContact CZ-CD2 3.98Å; F106-F222 HydrophobicContact CZ-CD2 3.98Å; A201-F222 HydrophobicContact CB-CE2 4.07Å; F204-F222 HydrophobicContact CB-CD2 3.9Å; F204-F222 HydrophobicContact CB-CE2 3.7Å; F204-F222 HydrophobicContact CB-CZ 4.32Å; F204-F222 HydrophobicContact CD1-CB 4.26Å; F204-F222 AromaticContact CD1-CD1 3.59Å; F204-F222 HydrophobicContact CD1-CD1 3.59Å; F204-F222 AromaticContact CD1-CD2 3.61Å; F204-F222 HydrophobicContact CD1-CD2 3.61Å; F204-F222 AromaticContact CD1-CE1 3.73Å; F204-F222 HydrophobicContact CD1-CE1 3.73Å; F204-F222 AromaticContact CD1-CE2 3.75Å; F204-F222 HydrophobicContact CD1-CE2 3.75Å; F204-F222 AromaticContact CD1-CG 3.53Å; F204-F222 HydrophobicContact CD1-CG 3.53Å; F204-F222 AromaticContact CD1-CZ 3.81Å; F204-F222 HydrophobicContact CD1-CZ 3.81Å; F204-F222 HydrophobicContact CE1-CB 4.24Å; F204-F222 AromaticContact CE1-CD1 3.78Å; F204-F222 HydrophobicContact CE1-CD1 3.78Å; F204-F222 HydrophobicContact CE1-CD2 4.4Å; F204-F222 HydrophobicContact CE1-CE1 4.22Å; F204-F222 AromaticContact CE1-CG 3.87Å; F204-F222 HydrophobicContact CE1-CG 3.87Å; F204-F222 AromaticContact CG-CD2 3.89Å; F204-F222 HydrophobicContact CG-CD2 3.89Å; F204-F222 HydrophobicContact CG-CE2 4.06Å; F204-F222 HydrophobicContact CG-CG 4.18Å; L218-F222 WeakPolarHBondContact O-CB 3.39Å; L218-F222 PolarHBondContact O-N 3.21Å; R219-F222 PolarHBondContact O-N 3.4Å; L220-F222 VanDerWaalsContact C-N 3.28Å; L220-F222 PolarHBondContact O-N 2.9Å; F222-L224 VanDerWaalsContact C-N 3.32Å; F222-L224 PolarHBondContact O-N 2.98Å; F222-N225 WeakPolarHBondContact O-CA 3.41Å; F222-N225 WeakPolarHBondContact O-CB 3Å; F222-N225 PolarHBondContact O-N 2.88Å; F222-N225 VanDerWaalsContact O-N 3.07Å; F222-V226 HydrophobicContact CD1-CG2 4.35Å; F222-V226 HydrophobicContact CE1-CG2 3.91Å; F222-V226 HydrophobicContact CE2-CG2 4.32Å; F222-V226 HydrophobicContact CZ-CG2 3.89Å; F222-V226 WeakPolarHBondContact O-CG2 3.36Å; F222-V226 PolarHBondContact O-N 2.84Å |
| 223 | L | 95.7 | Very high | 93.7 | Very high | 39 Ų | 39 | 39.5 Ų | 39.5 | 20% | 0.204 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -63.9 | -36.4 | 177.3 | -71.8 | -176.5 | 0 | 0 | 0 | 112.8 | L36 A43 R219 L220 N225 V226 L227 | L36-L223 HydrophobicContact CD1-CD1 3.64Å; A43-L223 HydrophobicContact CB-CD2 4.37Å; R219-L223 WeakPolarHBondContact O-CG 3.35Å; R219-L223 PolarHBondContact O-N 3.37Å; L220-L223 PolarHBondContact O-N 3.29Å; L223-N225 VanDerWaalsContact C-N 3.26Å; L223-N225 PolarHBondContact O-N 3.04Å; L223-V226 WeakPolarHBondContact O-CB 3.33Å; L223-V226 PolarHBondContact O-N 3.07Å; L223-V226 VanDerWaalsContact O-N 3.11Å; L223-L227 WeakPolarHBondContact O-CG 3.46Å; L223-L227 PolarHBondContact O-N 3.11Å |
| 224 | L | 96.1 | Very high | 94 | Very high | 62 Ų | 62 | 39.6 Ų | 39.6 | 33% | 0.325 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -59.9 | -38.1 | 172.4 | -69.9 | 171.5 | 0 | 0 | 0 | 111.5 | F102 L220 V221 F222 L227 L228 | F102-L224 HydrophobicContact CD1-CB 4.12Å; F102-L224 HydrophobicContact CD1-CD1 4.26Å; F102-L224 HydrophobicContact CE1-CB 4.33Å; F102-L224 HydrophobicContact CE1-CD1 3.94Å; L220-L224 HydrophobicContact CG-CD1 4.37Å; L220-L224 WeakPolarHBondContact O-CG 3.43Å; L220-L224 PolarHBondContact O-N 3.23Å; V221-L224 PolarHBondContact O-N 3.04Å; F222-L224 VanDerWaalsContact C-N 3.32Å; F222-L224 PolarHBondContact O-N 2.98Å; L224-L227 PolarHBondContact O-N 3.24Å; L224-L228 VanDerWaalsContact O-CB 3.25Å; L224-L228 WeakPolarHBondContact O-CB 3.03Å; L224-L228 PolarHBondContact O-N 3.1Å |
| 225 | N | 96.2 | Very high | 94.1 | Very high | 2 Ų | 2 | 39.1 Ų | 39.1 | 1% | 0.011 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -66.5 | -38.7 | 172.6 | -80.5 | -85.2 | 0 | 0 | 0 | 112.6 | F102 L103 M197 V221 F222 L223 L228 L229 | F102-N225 VanDerWaalsContact C-ND2 3.3Å; F102-N225 VanDerWaalsContact C-OD1 3.31Å; F102-N225 PolarHBondContact O-ND2 3Å; L103-N225 WeakPolarHBondContact CA-OD1 3.25Å; L103-N225 WeakPolarHBondContact CB-OD1 3.16Å; L103-N225 WeakPolarHBondContact CD1-OD1 3.36Å; L103-N225 PolarHBondContact N-OD1 2.83Å; L103-N225 VanDerWaalsContact N-OD1 3.1Å; M197-N225 HydrophobicContact CE-CB 4.35Å; M197-N225 WeakPolarHBondContact CE-O 3.31Å; V221-N225 PolarHBondContact O-N 3.49Å; V221-N225 PolarHBondContact O-ND2 2.89Å; F222-N225 WeakPolarHBondContact O-CA 3.41Å; F222-N225 WeakPolarHBondContact O-CB 3Å; F222-N225 PolarHBondContact O-N 2.88Å; F222-N225 VanDerWaalsContact O-N 3.07Å; L223-N225 VanDerWaalsContact C-N 3.26Å; L223-N225 PolarHBondContact O-N 3.04Å; N225-L228 PolarHBondContact O-N 2.87Å; N225-L229 WeakPolarHBondContact O-CB 3.48Å; N225-L229 PolarHBondContact O-N 2.82Å |
| 226 | V | 96.3 | Very high | 94.1 | Very high | 43 Ų | 43 | 37.5 Ų | 37.5 | 26% | 0.261 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -63.6 | -44 | 175.5 | 177.5 | 0 | 0 | 0 | 0 | 110.9 | A43 L47 F222 L223 L229 G230 | A43-V226 HydrophobicContact CB-CG2 4.23Å; L47-V226 HydrophobicContact CD1-CG2 3.88Å; F222-V226 HydrophobicContact CD1-CG2 4.35Å; F222-V226 HydrophobicContact CE1-CG2 3.91Å; F222-V226 HydrophobicContact CE2-CG2 4.32Å; F222-V226 HydrophobicContact CZ-CG2 3.89Å; F222-V226 WeakPolarHBondContact O-CG2 3.36Å; F222-V226 PolarHBondContact O-N 2.84Å; L223-V226 WeakPolarHBondContact O-CB 3.33Å; L223-V226 PolarHBondContact O-N 3.07Å; L223-V226 VanDerWaalsContact O-N 3.11Å; V226-L229 WeakPolarHBondContact O-CB 3.38Å; V226-L229 PolarHBondContact O-N 3.34Å; V226-G230 PolarHBondContact O-N 3.23Å |
| 227 | L | 95.9 | Very high | 94.1 | Very high | 123 Ų | 123 | 37.9 Ų | 37.9 | 64% | 0.644 | 21% | 0.212 | S | C | * | . | H | α-helix | trans | -63.2 | -43.3 | 175.6 | -68.5 | 174.1 | 0 | 0 | 0 | 111.3 | L223 L224 L229 G230 L231 | L223-L227 WeakPolarHBondContact O-CG 3.46Å; L223-L227 PolarHBondContact O-N 3.11Å; L224-L227 PolarHBondContact O-N 3.24Å; L227-L229 VanDerWaalsContact C-N 3.35Å; L227-L229 PolarHBondContact O-N 3.34Å; L227-G230 PolarHBondContact O-N 3.48Å; L227-L231 PolarHBondContact O-N 2.78Å |
| 228 | L | 95.6 | Very high | 93.9 | Very high | 10 Ų | 10 | 34 Ų | 34 | 5% | 0.052 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -63.8 | -39.7 | 176.9 | -172.9 | 70 | 0 | 0 | 0 | 111.9 | W98 F102 M197 L224 N225 L231 W232 | W98-L228 HydrophobicContact CB-CD1 4.26Å; W98-L228 HydrophobicContact CB-CD2 4.32Å; F102-L228 HydrophobicContact CB-CD2 4.17Å; F102-L228 HydrophobicContact CD2-CD2 3.85Å; F102-L228 HydrophobicContact CG-CD2 4.44Å; M197-L228 HydrophobicContact CE-CB 3.86Å; M197-L228 HydrophobicContact CE-CD2 3.76Å; M197-L228 HydrophobicContact CE-CG 3.93Å; M197-L228 HydrophobicContact SD-CD2 4.24Å; M197-L228 HydrophobicContact SD-CG 4.5Å; L224-L228 VanDerWaalsContact O-CB 3.25Å; L224-L228 WeakPolarHBondContact O-CB 3.03Å; L224-L228 PolarHBondContact O-N 3.1Å; N225-L228 PolarHBondContact O-N 2.87Å; L228-L231 HydrophobicContact CD1-CD2 4.35Å; L228-L231 WeakPolarHBondContact O-CB 3.44Å; L228-L231 PolarHBondContact O-N 3.33Å; L228-W232 HydrophobicContact CD1-CD2 4.5Å; L228-W232 HydrophobicContact CD1-CH2 3.88Å; L228-W232 HydrophobicContact CD1-CZ2 3.33Å; L228-W232 HydrophobicContact CD2-CZ2 4.04Å; L228-W232 HydrophobicContact CG-CZ2 3.73Å; L228-W232 VanDerWaalsContact O-CG 3.31Å; L228-W232 PolarHBondContact O-N 2.77Å |
| 229 | L | 96 | Very high | 93.5 | Very high | 14 Ų | 14 | 34 Ų | 34 | 7% | 0.073 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -60.4 | -46.4 | 172.8 | 178.2 | 61.3 | 0 | 0 | 0 | 110.7 | L47 C194 M197 N225 V226 L227 L231 W232 N233 | L47-L229 HydrophobicContact CD2-CD2 4.15Å; C194-L229 HydrophobicContact CB-CD1 4.11Å; M197-L229 HydrophobicContact CB-CD1 4.25Å; M197-L229 HydrophobicContact CE-CB 4.03Å; N225-L229 WeakPolarHBondContact O-CB 3.48Å; N225-L229 PolarHBondContact O-N 2.82Å; V226-L229 WeakPolarHBondContact O-CB 3.38Å; V226-L229 PolarHBondContact O-N 3.34Å; L227-L229 VanDerWaalsContact C-N 3.35Å; L227-L229 PolarHBondContact O-N 3.34Å; L229-L231 VanDerWaalsContact C-N 3.29Å; L229-L231 PolarHBondContact O-N 3.23Å; L229-W232 PolarHBondContact O-N 3.29Å; L229-N233 PolarHBondContact O-N 3.48Å; L229-N233 PolarHBondContact O-ND2 2.82Å |
| 230 | G | 95.3 | Very high | 93.2 | Very high | 42 Ų | 42 | 33.1 Ų | 33.1 | 43% | 0.433 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -57.1 | -43.2 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | V226 L227 W232 N233 F234 | V226-G230 PolarHBondContact O-N 3.23Å; L227-G230 PolarHBondContact O-N 3.48Å; G230-W232 PolarHBondContact O-N 3.49Å; G230-N233 PolarHBondContact O-N 3.38Å; G230-F234 PolarHBondContact O-N 3.1Å |
| 231 | L | 93.3 | Very high | 92.8 | Very high | 56 Ų | 56 | 29.7 Ų | 29.7 | 29% | 0.293 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -62.6 | -41 | 176.3 | -176.6 | 60.9 | 0 | 0 | 0 | 112.4 | F91 L227 L228 L229 F234 L235 | F91-L231 HydrophobicContact CE1-CD2 3.51Å; F91-L231 HydrophobicContact CE1-CG 4.18Å; F91-L231 HydrophobicContact CZ-CD2 3.68Å; L227-L231 PolarHBondContact O-N 2.78Å; L228-L231 HydrophobicContact CD1-CD2 4.35Å; L228-L231 WeakPolarHBondContact O-CB 3.44Å; L228-L231 PolarHBondContact O-N 3.33Å; L229-L231 VanDerWaalsContact C-N 3.29Å; L229-L231 PolarHBondContact O-N 3.23Å; L231-F234 PolarHBondContact O-N 3.34Å; L231-L235 HydrophobicContact CD1-CD1 4.27Å; L231-L235 HydrophobicContact CD1-CG 4.41Å; L231-L235 HydrophobicContact CG-CD1 4.07Å; L231-L235 WeakPolarHBondContact O-CG 3.4Å; L231-L235 PolarHBondContact O-N 3.49Å |
| 232 | W | 94.1 | Very high | 91.8 | Very high | 0 Ų | 0 | 30.3 Ų | 30.3 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -65.6 | -37.8 | 175.1 | -60.9 | 148.8 | 0 | 0 | 0 | 113.1 | F91 A95 W98 T99 L190 C194 M197 L228 L229 G230 F234 L235 L236 | F91-W232 HydrophobicContact CD1-CH2 4.37Å; F91-W232 AromaticContact CD1-CZ3 3.92Å; F91-W232 HydrophobicContact CD1-CZ3 3.92Å; F91-W232 AromaticContact CE1-CH2 3.72Å; F91-W232 HydrophobicContact CE1-CH2 3.72Å; F91-W232 AromaticContact CE1-CZ3 3.48Å; F91-W232 HydrophobicContact CE1-CZ3 3.48Å; F91-W232 VanDerWaalsContact CE1-CZ3 3.48Å; F91-W232 HydrophobicContact CZ-CH2 4.2Å; F91-W232 HydrophobicContact CZ-CZ3 4.38Å; A95-W232 VanDerWaalsContact CA-CH2 3.42Å; A95-W232 HydrophobicContact CB-CD2 4.43Å; A95-W232 HydrophobicContact CB-CE3 4.06Å; A95-W232 HydrophobicContact CB-CH2 3.59Å; A95-W232 HydrophobicContact CB-CZ2 3.86Å; A95-W232 HydrophobicContact CB-CZ3 3.65Å; A95-W232 WeakPolarHBondContact O-CZ2 3.12Å; W98-W232 HydrophobicContact CB-CH2 4.18Å; W98-W232 HydrophobicContact CB-CZ2 3.88Å; W98-W232 HydrophobicContact CG-CH2 4.5Å; T99-W232 PolarHBondContact OG1-NE1 2.99Å; L190-W232 HydrophobicContact CD2-CB 4.28Å; L190-W232 HydrophobicContact CD2-CD2 4.19Å; L190-W232 HydrophobicContact CD2-CE3 3.67Å; L190-W232 HydrophobicContact CD2-CG 4.44Å; L190-W232 HydrophobicContact CD2-CZ3 4.47Å; C194-W232 WeakPolarHBondContact SG-CB 3.29Å; M197-W232 PolarHBondContact SD-NE1 2.74Å; L228-W232 HydrophobicContact CD1-CD2 4.5Å; L228-W232 HydrophobicContact CD1-CH2 3.88Å; L228-W232 HydrophobicContact CD1-CZ2 3.33Å; L228-W232 HydrophobicContact CD2-CZ2 4.04Å; L228-W232 HydrophobicContact CG-CZ2 3.73Å; L228-W232 VanDerWaalsContact O-CG 3.31Å; L228-W232 PolarHBondContact O-N 2.77Å; L229-W232 PolarHBondContact O-N 3.29Å; G230-W232 PolarHBondContact O-N 3.49Å; W232-F234 VanDerWaalsContact C-N 3.34Å; W232-L235 HydrophobicContact CE3-CD1 3.67Å; W232-L235 HydrophobicContact CZ3-CD1 3.62Å; W232-L235 PolarHBondContact O-N 3.15Å; W232-L236 VanDerWaalsContact O-CB 3.24Å; W232-L236 WeakPolarHBondContact O-CB 3.42Å; W232-L236 PolarHBondContact O-N 3.44Å |
| 233 | N | 94.1 | Very high | 90.7 | Very high | 25 Ų | 25 | 32.3 Ų | 32.3 | 13% | 0.134 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -64 | -41.5 | 173.5 | -75.5 | -91.8 | 0 | 0 | 0 | 111.1 | Y56 W59 L229 G230 L236 L237 | Y56-N233 PolarHBondContact OH-ND2 3.11Å; Y56-N233 PolarHBondContact OH-OD1 2.65Å; W59-N233 PolarHBondContact NE1-OD1 3.38Å; L229-N233 PolarHBondContact O-N 3.48Å; L229-N233 PolarHBondContact O-ND2 2.82Å; G230-N233 PolarHBondContact O-N 3.38Å; N233-L236 PolarHBondContact O-N 3.01Å; N233-L237 WeakPolarHBondContact O-CB 3.43Å; N233-L237 PolarHBondContact O-N 3.07Å |
| 234 | F | 91 | Very high | 89.1 | Confident | 92 Ų | 92 | 38 Ų | 38 | 40% | 0.404 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -62.9 | -47.4 | 175.6 | 175.7 | -101.9 | 0 | 0 | 0 | 112 | G230 L231 W232 L236 L237 C238 | G230-F234 PolarHBondContact O-N 3.1Å; L231-F234 PolarHBondContact O-N 3.34Å; W232-F234 VanDerWaalsContact C-N 3.34Å; F234-L236 VanDerWaalsContact C-N 3.32Å; F234-L236 PolarHBondContact O-N 3.11Å; F234-L237 WeakPolarHBondContact O-CB 3.47Å; F234-L237 PolarHBondContact O-N 3.41Å; F234-L237 VanDerWaalsContact O-N 3.16Å; F234-C238 VanDerWaalsContact CZ-SG 3.6Å; F234-C238 PolarHBondContact O-N 3.47Å; F234-C238 PolarHBondContact O-SG 3.01Å; F234-C238 VanDerWaalsContact O-SG 3.37Å |
| 235 | L | 89.6 | Confident | 88.3 | Confident | 3 Ų | 3 | 40.5 Ų | 40.5 | 2% | 0.016 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -66.5 | -34.3 | 178.2 | -71.8 | 169.3 | 0 | 0 | 0 | 112.4 | F91 V92 L190 L231 W232 C238 T239 | F91-L235 HydrophobicContact CD1-CD1 3.57Å; F91-L235 HydrophobicContact CE1-CD1 3.77Å; V92-L235 HydrophobicContact CG2-CB 4.42Å; V92-L235 HydrophobicContact CG2-CD1 4.38Å; L190-L235 HydrophobicContact CD1-CB 4.17Å; L190-L235 HydrophobicContact CD2-CB 4.3Å; L231-L235 HydrophobicContact CD1-CD1 4.27Å; L231-L235 HydrophobicContact CD1-CG 4.41Å; L231-L235 HydrophobicContact CG-CD1 4.07Å; L231-L235 WeakPolarHBondContact O-CG 3.4Å; L231-L235 PolarHBondContact O-N 3.49Å; W232-L235 HydrophobicContact CE3-CD1 3.67Å; W232-L235 HydrophobicContact CZ3-CD1 3.62Å; W232-L235 PolarHBondContact O-N 3.15Å; L235-C238 PolarHBondContact O-N 2.95Å; L235-T239 WeakPolarHBondContact O-CB 3.48Å; L235-T239 PolarHBondContact O-N 2.72Å; L235-T239 PolarHBondContact O-OG1 3.22Å |
| 236 | L | 90.9 | Very high | 87.6 | Confident | 0 Ų | 0 | 45.3 Ų | 45.3 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -61.9 | -46.8 | 171.5 | 179.8 | 63.4 | 0 | 0 | 0 | 110.1 | L60 V63 V64 T187 L190 W232 N233 F234 T239 V240 | L60-L236 HydrophobicContact CD2-CD2 3.68Å; V63-L236 HydrophobicContact CG1-CD2 4.41Å; V63-L236 HydrophobicContact CG1-CG 4.35Å; V64-L236 HydrophobicContact CG2-CD1 4.46Å; V64-L236 HydrophobicContact CG2-CD2 4.47Å; T187-L236 HydrophobicContact CG2-CD1 3.8Å; L190-L236 HydrophobicContact CB-CB 4.27Å; L190-L236 HydrophobicContact CB-CD1 4.18Å; L190-L236 HydrophobicContact CD1-CB 4.36Å; W232-L236 VanDerWaalsContact O-CB 3.24Å; W232-L236 WeakPolarHBondContact O-CB 3.42Å; W232-L236 PolarHBondContact O-N 3.44Å; N233-L236 PolarHBondContact O-N 3.01Å; F234-L236 VanDerWaalsContact C-N 3.32Å; F234-L236 PolarHBondContact O-N 3.11Å; L236-T239 WeakPolarHBondContact O-CB 3.33Å; L236-T239 PolarHBondContact O-N 2.99Å; L236-T239 VanDerWaalsContact O-N 3.14Å; L236-V240 HydrophobicContact CD1-CG1 4.33Å; L236-V240 WeakPolarHBondContact O-CG1 3.35Å; L236-V240 WeakPolarHBondContact O-CG2 3.29Å; L236-V240 PolarHBondContact O-N 3.18Å |
| 237 | L | 89.9 | Confident | 87 | Confident | 53 Ų | 53 | 46.5 Ų | 46.5 | 28% | 0.277 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -58.5 | -48.6 | 176.7 | -175.8 | 62.8 | 0 | 0 | 0 | 111.5 | V63 L70 N233 F234 T239 V240 I241 | V63-L237 HydrophobicContact CG1-CD1 4.15Å; L70-L237 HydrophobicContact CD1-CD1 4.13Å; N233-L237 WeakPolarHBondContact O-CB 3.43Å; N233-L237 PolarHBondContact O-N 3.07Å; F234-L237 WeakPolarHBondContact O-CB 3.47Å; F234-L237 PolarHBondContact O-N 3.41Å; F234-L237 VanDerWaalsContact O-N 3.16Å; L237-T239 VanDerWaalsContact C-N 3.3Å; L237-T239 PolarHBondContact O-N 3.41Å; L237-V240 HydrophobicContact CD1-CG2 4.24Å; L237-V240 WeakPolarHBondContact O-CG2 3.48Å; L237-V240 PolarHBondContact O-N 3.43Å; L237-I241 HydrophobicContact CD1-CD1 3.84Å; L237-I241 HydrophobicContact CD1-CG1 4.28Å; L237-I241 HydrophobicContact CD2-CD1 4.49Å; L237-I241 HydrophobicContact CG-CD1 3.76Å; L237-I241 VanDerWaalsContact O-CG1 3.24Å; L237-I241 WeakPolarHBondContact O-CG1 3.4Å; L237-I241 PolarHBondContact O-N 2.93Å |
| 238 | C | 85.8 | Confident | 86.6 | Confident | 8 Ų | 8 | 42 Ų | 42 | 5% | 0.054 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -58.8 | -42.7 | 174.6 | -65.1 | 0 | 0 | 0 | 0 | 111.7 | F234 L235 V240 I241 Y242 | F234-C238 VanDerWaalsContact CZ-SG 3.6Å; F234-C238 PolarHBondContact O-N 3.47Å; F234-C238 PolarHBondContact O-SG 3.01Å; F234-C238 VanDerWaalsContact O-SG 3.37Å; L235-C238 PolarHBondContact O-N 2.95Å; C238-V240 VanDerWaalsContact C-N 3.33Å; C238-V240 PolarHBondContact O-N 3.02Å; C238-I241 PolarHBondContact O-N 3.46Å; C238-Y242 HydrophobicContact CB-CD2 4.15Å; C238-Y242 HydrophobicContact CB-CE2 4.27Å; C238-Y242 WeakPolarHBondContact O-CD2 3.46Å; C238-Y242 PolarHBondContact O-N 2.88Å |
| 239 | T | 86.7 | Confident | 86.3 | Confident | 2 Ų | 2 | 41.8 Ų | 41.8 | 1% | 0.012 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -62.6 | -40.4 | 178.7 | -58.4 | 0 | 0 | 0 | 0 | 111.3 | H186 L235 L236 L237 F243 K249 | H186-T239 HydrophobicContact CB-CG2 4.27Å; L235-T239 WeakPolarHBondContact O-CB 3.48Å; L235-T239 PolarHBondContact O-N 2.72Å; L235-T239 PolarHBondContact O-OG1 3.22Å; L236-T239 WeakPolarHBondContact O-CB 3.33Å; L236-T239 PolarHBondContact O-N 2.99Å; L236-T239 VanDerWaalsContact O-N 3.14Å; L237-T239 VanDerWaalsContact C-N 3.3Å; L237-T239 PolarHBondContact O-N 3.41Å; T239-F243 HydrophobicContact CG2-CD2 3.93Å; T239-F243 HydrophobicContact CG2-CE2 4.2Å; T239-F243 WeakPolarHBondContact O-CD2 3.36Å; T239-K249 WeakPolarHBondContact O-CE 3.49Å; T239-K249 PolarHBondContact O-NZ 3.4Å |
| 240 | V | 88.1 | Confident | 86.1 | Confident | 0 Ų | 0 | 43.1 Ų | 43.1 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -76.4 | -25.9 | 179.9 | -58.9 | 0 | 0 | 0 | 0 | 113.7 | V63 V64 L236 L237 C238 K249 | V63-V240 HydrophobicContact CG1-CG2 4.11Å; V64-V240 HydrophobicContact CG2-CG1 4.29Å; L236-V240 HydrophobicContact CD1-CG1 4.33Å; L236-V240 WeakPolarHBondContact O-CG1 3.35Å; L236-V240 WeakPolarHBondContact O-CG2 3.29Å; L236-V240 PolarHBondContact O-N 3.18Å; L237-V240 HydrophobicContact CD1-CG2 4.24Å; L237-V240 WeakPolarHBondContact O-CG2 3.48Å; L237-V240 PolarHBondContact O-N 3.43Å; C238-V240 VanDerWaalsContact C-N 3.33Å; C238-V240 PolarHBondContact O-N 3.02Å; V240-K249 HydrophobicContact CG1-CD 4.47Å; V240-K249 PolarHBondContact O-NZ 3.38Å |
| 241 | I | 85.5 | Confident | 86 | Confident | 19 Ų | 19 | 43.6 Ų | 43.6 | 10% | 0.097 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -77.8 | -48.6 | 176.8 | -67.6 | 171.6 | 0 | 0 | 0 | 112 | L70 V74 L237 C238 | L70-I241 HydrophobicContact CB-CD1 4.13Å; L70-I241 HydrophobicContact CB-CG1 4.1Å; L70-I241 HydrophobicContact CD1-CD1 4.15Å; V74-I241 HydrophobicContact CB-CG2 4.14Å; V74-I241 HydrophobicContact CG1-CG2 4.31Å; V74-I241 HydrophobicContact CG2-CG2 4.19Å; L237-I241 HydrophobicContact CD1-CD1 3.84Å; L237-I241 HydrophobicContact CD1-CG1 4.28Å; L237-I241 HydrophobicContact CD2-CD1 4.49Å; L237-I241 HydrophobicContact CG-CD1 3.76Å; L237-I241 VanDerWaalsContact O-CG1 3.24Å; L237-I241 WeakPolarHBondContact O-CG1 3.4Å; L237-I241 PolarHBondContact O-N 2.93Å; C238-I241 PolarHBondContact O-N 3.46Å |
| 242 | Y | 76.1 | Confident | 85.9 | Confident | 44 Ų | 44 | 41 Ų | 41 | 17% | 0.173 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -92.4 | -25.2 | -163.3 | -67 | -64.9 | 0 | 0 | 0 | 116 | V74 T78 F80 A81 C238 | V74-Y242 HydrophobicContact CG1-CE1 3.66Å; V74-Y242 WeakPolarHBondContact CG1-OH 3.36Å; T78-Y242 WeakPolarHBondContact OG1-CE1 3.28Å; T78-Y242 PolarHBondContact OG1-OH 3.03Å; F80-Y242 HydrophobicContact CB-CD2 4.19Å; F80-Y242 HydrophobicContact CB-CE2 3.59Å; A81-Y242 HydrophobicContact CB-CD1 3.38Å; A81-Y242 HydrophobicContact CB-CE1 3.47Å; A81-Y242 VanDerWaalsContact CB-CE1 3.47Å; A81-Y242 HydrophobicContact CB-CG 4.15Å; C238-Y242 HydrophobicContact CB-CD2 4.15Å; C238-Y242 HydrophobicContact CB-CE2 4.27Å; C238-Y242 WeakPolarHBondContact O-CD2 3.46Å; C238-Y242 PolarHBondContact O-N 2.88Å |
| 243 | F | 73.2 | Confident | 85.9 | Confident | 42 Ų | 42 | 41.3 Ų | 41.3 | 18% | 0.184 | 20% | 0.202 | C | C | . | . | trans | -87.3 | 137.7 | -177.3 | -66.3 | -83.7 | 0 | 0 | 0 | 112.3 | H83 N88 T239 Q245 K249 | H83-F243 AromaticContact CD2-CD1 3.66Å; H83-F243 AromaticContact CD2-CE1 3.52Å; H83-F243 AromaticContact NE2-CD1 3.53Å; H83-F243 AromaticContact NE2-CE1 3.47Å; H83-F243 WeakPolarHBondContact NE2-CE1 3.27Å; N88-F243 WeakPolarHBondContact ND2-CE2 3.19Å; T239-F243 HydrophobicContact CG2-CD2 3.93Å; T239-F243 HydrophobicContact CG2-CE2 4.2Å; T239-F243 WeakPolarHBondContact O-CD2 3.36Å; F243-Q245 PolarHBondContact O-N 3.35Å; F243-K249 WeakPolarHBondContact O-CE 3.29Å; F243-K249 PolarHBondContact O-NZ 2.94Å | ||
| 244 | H | 61.6 | Low | 85.9 | Confident | 158 Ų | 158 | 42.9 Ų | 42.9 | 73% | 0.731 | 22% | 0.218 | S | C | * | . | S | Bend | trans | -77.9 | -20.6 | -163.9 | -74.9 | -69.6 | 0 | 0 | 0 | 116.7 | Y246 | H244-Y246 PolarHBondContact O-N 3.42Š|
| 245 | Q | 80.1 | Confident | 86.1 | Confident | 115 Ų | 115 | 40.7 Ų | 40.7 | 54% | 0.537 | 21% | 0.212 | S | C | . | . | trans | -91.1 | 102.7 | -174.8 | -59.8 | -58.8 | -23.2 | 0 | 0 | 112.2 | F243 H248 K249 | F243-Q245 PolarHBondContact O-N 3.35Å; Q245-H248 HydrophobicContact CB-CB 3.99Å; Q245-K249 WeakPolarHBondContact O-CG 3.46Å | ||
| 246 | Y | 80.4 | Confident | 86.3 | Confident | 102 Ų | 102 | 40.6 Ų | 40.6 | 40% | 0.4 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -61.4 | -55.3 | -177.6 | 175.3 | -101.6 | 0 | 0 | 0 | 112.9 | P68 H244 H248 K249 V250 | P68-Y246 HydrophobicContact CB-CD2 3.82Å; P68-Y246 HydrophobicContact CB-CE2 4.19Å; P68-Y246 HydrophobicContact CG-CD2 3.57Å; P68-Y246 HydrophobicContact CG-CE2 3.76Å; H244-Y246 PolarHBondContact O-N 3.42Å; Y246-H248 VanDerWaalsContact C-N 3.28Å; Y246-H248 PolarHBondContact O-N 2.91Å; Y246-K249 WeakPolarHBondContact O-CB 3.25Å; Y246-K249 PolarHBondContact O-N 2.99Å; Y246-K249 VanDerWaalsContact O-N 3.11Å; Y246-V250 HydrophobicContact CD1-CG2 4.25Å; Y246-V250 HydrophobicContact CD2-CG2 4.41Å; Y246-V250 HydrophobicContact CE1-CG2 3.75Å; Y246-V250 HydrophobicContact CE2-CG2 3.91Å; Y246-V250 PolarHBondContact O-N 3.33Å |
| 247 | T | 84.8 | Confident | 86.5 | Confident | 69 Ų | 69 | 43.2 Ų | 43.2 | 42% | 0.423 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -61.5 | -38.2 | -173 | 52.9 | 0 | 0 | 0 | 0 | 111.7 | Y181 K249 V250 V251 | Y181-T247 PolarHBondContact OH-O 2.88Å; T247-K249 PolarHBondContact O-N 3.28Å; T247-V250 PolarHBondContact O-N 3Å; T247-V251 WeakPolarHBondContact O-CG2 3.45Å; T247-V251 PolarHBondContact O-N 3.46Å |
| 248 | H | 87.6 | Confident | 86.7 | Confident | 28 Ų | 28 | 46.4 Ų | 46.4 | 13% | 0.13 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -60.3 | -33.9 | -179.8 | -64.4 | -158.3 | 0 | 0 | 0 | 111.8 | Y181 T182 S184 Q245 Y246 G252 | Y181-H248 AromaticContact CD2-CD2 3.88Å; Y181-H248 AromaticContact CD2-NE2 3.57Å; Y181-H248 AromaticContact CE2-CD2 3.3Å; Y181-H248 WeakPolarHBondContact CE2-CD2 3.46Å; Y181-H248 AromaticContact CE2-NE2 3.48Å; Y181-H248 WeakPolarHBondContact CE2-NE2 3.05Å; Y181-H248 AromaticContact CZ-CD2 3.71Å; T182-H248 VanDerWaalsContact O-CB 3.27Å; T182-H248 WeakPolarHBondContact O-CB 3.39Å; T182-H248 PolarHBondContact O-ND1 3.39Å; T182-H248 PolarHBondContact OG1-CE1 3.49Å; T182-H248 PolarHBondContact OG1-ND1 3.32Å; T182-H248 VanDerWaalsContact OG1-ND1 3.11Å; S184-H248 VanDerWaalsContact CB-O 3.27Å; S184-H248 WeakPolarHBondContact CB-O 3.23Å; S184-H248 PolarHBondContact N-O 3.45Å; Q245-H248 HydrophobicContact CB-CB 3.99Å; Y246-H248 VanDerWaalsContact C-N 3.28Å; Y246-H248 PolarHBondContact O-N 2.91Å; H248-G252 PolarHBondContact O-N 3.38Å |
| 249 | K | 89.2 | Confident | 87.1 | Confident | 5 Ų | 5 | 46.6 Ų | 46.6 | 2% | 0.022 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -77 | -46.3 | 178.4 | -60.5 | 169.3 | -176.5 | -162.9 | 0 | 112 | T187 T239 V240 F243 Q245 Y246 T247 V251 G252 A253 | T187-K249 HydrophobicContact CG2-CB 4.3Å; T187-K249 VanDerWaalsContact CG2-O 3.31Å; T187-K249 WeakPolarHBondContact CG2-O 3.39Å; T239-K249 WeakPolarHBondContact O-CE 3.49Å; T239-K249 PolarHBondContact O-NZ 3.4Å; V240-K249 HydrophobicContact CG1-CD 4.47Å; V240-K249 PolarHBondContact O-NZ 3.38Å; F243-K249 WeakPolarHBondContact O-CE 3.29Å; F243-K249 PolarHBondContact O-NZ 2.94Å; Q245-K249 WeakPolarHBondContact O-CG 3.46Å; Y246-K249 WeakPolarHBondContact O-CB 3.25Å; Y246-K249 PolarHBondContact O-N 2.99Å; Y246-K249 VanDerWaalsContact O-N 3.11Å; T247-K249 PolarHBondContact O-N 3.28Å; K249-V251 VanDerWaalsContact C-N 3.31Å; K249-V251 PolarHBondContact O-N 3.02Å; K249-G252 PolarHBondContact O-N 3.28Å; K249-A253 PolarHBondContact O-N 3.06Å |
| 250 | V | 91.3 | Very high | 87.5 | Confident | 43 Ų | 43 | 47.9 Ų | 47.9 | 26% | 0.261 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -59.6 | -45.8 | 179.3 | 178 | 0 | 0 | 0 | 0 | 110.1 | V64 Y246 T247 A253 A254 | V64-V250 HydrophobicContact CG1-CB 4.48Å; V64-V250 HydrophobicContact CG1-CG2 4.12Å; Y246-V250 HydrophobicContact CD1-CG2 4.25Å; Y246-V250 HydrophobicContact CD2-CG2 4.41Å; Y246-V250 HydrophobicContact CE1-CG2 3.75Å; Y246-V250 HydrophobicContact CE2-CG2 3.91Å; Y246-V250 PolarHBondContact O-N 3.33Å; T247-V250 PolarHBondContact O-N 3Å; V250-A253 PolarHBondContact O-N 3.45Å; V250-A254 WeakPolarHBondContact O-CB 3.26Å; V250-A254 PolarHBondContact O-N 3.11Å |
| 251 | V | 92.3 | Very high | 87.8 | Confident | 52 Ų | 52 | 54.2 Ų | 54.2 | 32% | 0.315 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -62.9 | -43.6 | 176 | 175.1 | 0 | 0 | 0 | 0 | 111.1 | Y181 V183 T247 K249 A253 A254 V255 | Y181-V251 VanDerWaalsContact OH-CG2 3.25Å; Y181-V251 WeakPolarHBondContact OH-CG2 3.08Å; V183-V251 HydrophobicContact CG1-CG1 4.04Å; V183-V251 HydrophobicContact CG2-CG1 4.02Å; T247-V251 WeakPolarHBondContact O-CG2 3.45Å; T247-V251 PolarHBondContact O-N 3.46Å; K249-V251 VanDerWaalsContact C-N 3.31Å; K249-V251 PolarHBondContact O-N 3.02Å; V251-A253 PolarHBondContact O-N 2.9Å; V251-A254 PolarHBondContact O-N 2.96Å; V251-V255 HydrophobicContact CG1-CG2 4.32Å; V251-V255 VanDerWaalsContact O-CG2 3.31Å; V251-V255 WeakPolarHBondContact O-CG2 3.31Å; V251-V255 PolarHBondContact O-N 3.08Å |
| 252 | G | 92.3 | Very high | 88.1 | Confident | 0 Ų | 0 | 57.2 Ų | 57.2 | 0% | 0 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -56.4 | -47.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | F188 H248 K249 V255 G256 | F188-G252 VanDerWaalsContact CA-O 3.27Å; F188-G252 WeakPolarHBondContact CA-O 3.47Å; F188-G252 WeakPolarHBondContact CB-O 3.29Å; H248-G252 PolarHBondContact O-N 3.38Å; K249-G252 PolarHBondContact O-N 3.28Å; G252-V255 PolarHBondContact O-N 3Å; G252-G256 PolarHBondContact O-N 3.33Å |
| 253 | A | 93.7 | Very high | 88.9 | Confident | 8 Ų | 8 | 55.4 Ų | 55.4 | 7% | 0.066 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -65.9 | -38.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | V64 T187 T191 K249 V250 V251 G256 T257 | V64-A253 HydrophobicContact CB-CB 4.19Å; V64-A253 HydrophobicContact CG1-CB 3.72Å; V64-A253 HydrophobicContact CG2-CB 3.7Å; T187-A253 HydrophobicContact CG2-CB 3.91Å; T191-A253 HydrophobicContact CG2-CB 4.43Å; K249-A253 PolarHBondContact O-N 3.06Å; V250-A253 PolarHBondContact O-N 3.45Å; V251-A253 PolarHBondContact O-N 2.9Å; A253-G256 PolarHBondContact O-N 2.96Å; A253-T257 PolarHBondContact O-N 3.2Å; A253-T257 PolarHBondContact O-OG1 2.97Å |
| 254 | A | 93.9 | Very high | 89.7 | Confident | 57 Ų | 57 | 53.9 Ų | 53.9 | 47% | 0.471 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -63.3 | -45.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | V250 V251 G256 T257 F258 | V250-A254 WeakPolarHBondContact O-CB 3.26Å; V250-A254 PolarHBondContact O-N 3.11Å; V251-A254 PolarHBondContact O-N 2.96Å; A254-G256 VanDerWaalsContact C-N 3.3Å; A254-G256 PolarHBondContact O-N 2.7Å; A254-T257 PolarHBondContact O-N 2.9Å; A254-F258 VanDerWaalsContact O-CB 3.3Å; A254-F258 WeakPolarHBondContact O-CB 3.46Å; A254-F258 PolarHBondContact O-N 3.02Å |
| 255 | V | 94.7 | Very high | 90.8 | Very high | 47 Ų | 47 | 47.6 Ų | 47.6 | 29% | 0.285 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -62.4 | -38.3 | 174.6 | 177.2 | 0 | 0 | 0 | 0 | 110.9 | F142 F188 V251 G252 F258 A259 | F142-V255 HydrophobicContact CE1-CB 4.34Å; F142-V255 HydrophobicContact CE1-CG1 3.94Å; F142-V255 HydrophobicContact CE1-CG2 4.28Å; F142-V255 HydrophobicContact CZ-CB 4.28Å; F142-V255 HydrophobicContact CZ-CG1 3.91Å; F188-V255 HydrophobicContact CD2-CB 4.13Å; F188-V255 HydrophobicContact CD2-CG1 3.82Å; F188-V255 HydrophobicContact CE2-CG1 3.88Å; V251-V255 HydrophobicContact CG1-CG2 4.32Å; V251-V255 VanDerWaalsContact O-CG2 3.31Å; V251-V255 WeakPolarHBondContact O-CG2 3.31Å; V251-V255 PolarHBondContact O-N 3.08Å; G252-V255 PolarHBondContact O-N 3Å; V255-F258 PolarHBondContact O-N 2.99Å; V255-A259 VanDerWaalsContact O-CB 3.24Å; V255-A259 WeakPolarHBondContact O-CB 3.46Å; V255-A259 PolarHBondContact O-N 3.43Å |
| 256 | G | 94.3 | Very high | 91.2 | Very high | 0 Ų | 0 | 44.2 Ų | 44.2 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -63.1 | -46.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | G252 A253 A254 A259 W260 | G252-G256 PolarHBondContact O-N 3.33Å; A253-G256 PolarHBondContact O-N 2.96Å; A254-G256 VanDerWaalsContact C-N 3.3Å; A254-G256 PolarHBondContact O-N 2.7Å; G256-A259 PolarHBondContact O-N 2.97Å; G256-W260 PolarHBondContact O-N 2.87Å |
| 257 | T | 94.4 | Very high | 91.7 | Very high | 56 Ų | 56 | 44.5 Ų | 44.5 | 34% | 0.344 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -63.9 | -42.4 | 175.7 | -54.4 | 0 | 0 | 0 | 0 | 111.5 | L195 A253 A254 W260 Y261 | L195-T257 HydrophobicContact CD1-CG2 4.3Å; A253-T257 PolarHBondContact O-N 3.2Å; A253-T257 PolarHBondContact O-OG1 2.97Å; A254-T257 PolarHBondContact O-N 2.9Å; T257-W260 WeakPolarHBondContact O-CB 3.32Å; T257-W260 PolarHBondContact O-N 3.33Å; T257-Y261 PolarHBondContact O-N 3.49Å |
| 258 | F | 94.9 | Very high | 91.9 | Very high | 120 Ų | 120 | 41.4 Ų | 41.4 | 53% | 0.526 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -63.8 | -44.3 | 177 | 179.8 | -110.9 | 0 | 0 | 0 | 111.8 | A254 V255 W260 Y261 L262 | A254-F258 VanDerWaalsContact O-CB 3.3Å; A254-F258 WeakPolarHBondContact O-CB 3.46Å; A254-F258 PolarHBondContact O-N 3.02Å; V255-F258 PolarHBondContact O-N 2.99Å; F258-W260 VanDerWaalsContact C-N 3.29Å; F258-W260 PolarHBondContact O-N 2.92Å; F258-Y261 PolarHBondContact O-N 2.8Å; F258-Y261 VanDerWaalsContact O-N 3.09Å; F258-L262 HydrophobicContact CD1-CD1 3.9Å; F258-L262 HydrophobicContact CD1-CG 4.31Å; F258-L262 HydrophobicContact CE1-CD1 3.36Å; F258-L262 HydrophobicContact CE1-CD2 4.42Å; F258-L262 HydrophobicContact CE1-CG 3.93Å; F258-L262 HydrophobicContact CE2-CD1 4.46Å; F258-L262 HydrophobicContact CE2-CD2 4.15Å; F258-L262 HydrophobicContact CE2-CG 4.15Å; F258-L262 HydrophobicContact CZ-CD1 3.69Å; F258-L262 HydrophobicContact CZ-CD2 3.87Å; F258-L262 HydrophobicContact CZ-CG 3.84Å; F258-L262 WeakPolarHBondContact O-CG 3.33Å; F258-L262 PolarHBondContact O-N 3.4Å |
| 259 | A | 94.7 | Very high | 91.8 | Very high | 11 Ų | 11 | 46.1 Ų | 46.1 | 9% | 0.091 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -60.5 | -39.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | V134 F188 F192 V255 G256 T263 | V134-A259 HydrophobicContact CG1-CB 3.73Å; F188-A259 HydrophobicContact CE2-CB 4.25Å; F192-A259 HydrophobicContact CD2-CB 4.1Å; F192-A259 HydrophobicContact CE2-CB 4.13Å; V255-A259 VanDerWaalsContact O-CB 3.24Å; V255-A259 WeakPolarHBondContact O-CB 3.46Å; V255-A259 PolarHBondContact O-N 3.43Å; G256-A259 PolarHBondContact O-N 2.97Å; A259-T263 WeakPolarHBondContact O-CG2 3.25Å; A259-T263 PolarHBondContact O-N 2.88Å; A259-T263 VanDerWaalsContact O-N 3.14Å; A259-T263 PolarHBondContact O-OG1 2.81Å |
| 260 | W | 94.8 | Very high | 91.7 | Very high | 30 Ų | 30 | 50.5 Ų | 50.5 | 11% | 0.114 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -63.4 | -44.9 | 171.1 | 172.3 | 86.4 | 0 | 0 | 0 | 112 | H57 F192 L195 E199 G256 T257 F258 L262 T263 Y264 | H57-W260 AromaticContact CE1-CH2 3.71Å; H57-W260 AromaticContact CE1-CZ2 3.95Å; H57-W260 AromaticContact NE2-CE3 3.78Å; H57-W260 AromaticContact NE2-CH2 3.14Å; H57-W260 WeakPolarHBondContact NE2-CH2 3.38Å; H57-W260 AromaticContact NE2-CZ2 3.54Å; H57-W260 AromaticContact NE2-CZ3 3.27Å; H57-W260 VanDerWaalsContact NE2-CZ3 3.27Å; H57-W260 WeakPolarHBondContact NE2-CZ3 3.26Å; F192-W260 HydrophobicContact CD2-CB 4.4Å; L195-W260 HydrophobicContact CB-CB 4.13Å; L195-W260 VanDerWaalsContact CB-CD1 3.49Å; L195-W260 HydrophobicContact CB-CD2 4.28Å; L195-W260 HydrophobicContact CB-CG 3.69Å; L195-W260 HydrophobicContact CD1-CB 3.8Å; L195-W260 HydrophobicContact CD1-CD2 4.25Å; L195-W260 HydrophobicContact CD1-CG 3.92Å; L195-W260 HydrophobicContact CG-CG 4.37Å; E199-W260 HydrophobicContact CG-CZ2 3.72Å; G256-W260 PolarHBondContact O-N 2.87Å; T257-W260 WeakPolarHBondContact O-CB 3.32Å; T257-W260 PolarHBondContact O-N 3.33Å; F258-W260 VanDerWaalsContact C-N 3.29Å; F258-W260 PolarHBondContact O-N 2.92Å; W260-L262 PolarHBondContact O-N 2.76Å; W260-T263 WeakPolarHBondContact CA-OG1 3.48Å; W260-T263 PolarHBondContact O-N 3.22Å; W260-T263 PolarHBondContact O-OG1 3.39Å; W260-T263 VanDerWaalsContact O-OG1 3.07Å; W260-Y264 AromaticContact CD1-CD2 3.56Å; W260-Y264 AromaticContact CD1-CG 3.95Å; W260-Y264 HydrophobicContact CG-CD2 4.43Å; W260-Y264 AromaticContact NE1-CD2 3.82Å; W260-Y264 AromaticContact NE1-CG 3.72Å; W260-Y264 PolarHBondContact O-N 3.23Å |
| 261 | Y | 93.6 | Very high | 91.2 | Very high | 133 Ų | 133 | 53.6 Ų | 53.6 | 52% | 0.522 | 29% | 0.285 | S | S | . | . | I | π-helix | trans | -63.1 | -41.8 | 179.1 | -179.1 | -97.3 | 0 | 0 | 0 | 112.2 | T257 F258 T263 G265 S266 | T257-Y261 PolarHBondContact O-N 3.49Å; F258-Y261 PolarHBondContact O-N 2.8Å; F258-Y261 VanDerWaalsContact O-N 3.09Å; Y261-T263 VanDerWaalsContact C-N 3.33Å; Y261-T263 PolarHBondContact O-N 3.22Å; Y261-G265 CarbonylContact O-C 3.33Å; Y261-G265 WeakPolarHBondContact O-CA 3.39Å; Y261-G265 PolarHBondContact O-N 2.89Å; Y261-S266 PolarHBondContact O-N 2.84Å |
| 262 | L | 92.9 | Very high | 90.7 | Very high | 82 Ų | 82 | 61.5 Ų | 61.5 | 43% | 0.429 | 31% | 0.309 | S | S | . | . | I | π-helix | trans | -61.2 | -42 | 175.4 | -73 | -178.4 | 0 | 0 | 0 | 112 | F258 W260 W267 | F258-L262 HydrophobicContact CD1-CD1 3.9Å; F258-L262 HydrophobicContact CD1-CG 4.31Å; F258-L262 HydrophobicContact CE1-CD1 3.36Å; F258-L262 HydrophobicContact CE1-CD2 4.42Å; F258-L262 HydrophobicContact CE1-CG 3.93Å; F258-L262 HydrophobicContact CE2-CD1 4.46Å; F258-L262 HydrophobicContact CE2-CD2 4.15Å; F258-L262 HydrophobicContact CE2-CG 4.15Å; F258-L262 HydrophobicContact CZ-CD1 3.69Å; F258-L262 HydrophobicContact CZ-CD2 3.87Å; F258-L262 HydrophobicContact CZ-CG 3.84Å; F258-L262 WeakPolarHBondContact O-CG 3.33Å; F258-L262 PolarHBondContact O-N 3.4Å; W260-L262 PolarHBondContact O-N 2.76Å; L262-W267 VanDerWaalsContact O-CB 3.28Å; L262-W267 WeakPolarHBondContact O-CB 3.25Å; L262-W267 PolarHBondContact O-N 2.91Å |
| 263 | T | 92.6 | Very high | 90.4 | Very high | 6 Ų | 6 | 61.6 Ų | 61.6 | 4% | 0.037 | 31% | 0.31 | C | S | . | . | I | π-helix | trans | -78.6 | -68.9 | -178.7 | 48.3 | 0 | 0 | 0 | 0 | 111.7 | V130 V134 A259 W260 Y261 W267 Y268 | V130-T263 HydrophobicContact CG1-CG2 4.03Å; V134-T263 HydrophobicContact CG2-CG2 4.03Å; A259-T263 WeakPolarHBondContact O-CG2 3.25Å; A259-T263 PolarHBondContact O-N 2.88Å; A259-T263 VanDerWaalsContact O-N 3.14Å; A259-T263 PolarHBondContact O-OG1 2.81Å; W260-T263 WeakPolarHBondContact CA-OG1 3.48Å; W260-T263 PolarHBondContact O-N 3.22Å; W260-T263 PolarHBondContact O-OG1 3.39Å; W260-T263 VanDerWaalsContact O-OG1 3.07Å; Y261-T263 VanDerWaalsContact C-N 3.33Å; Y261-T263 PolarHBondContact O-N 3.22Å; T263-W267 PolarHBondContact O-N 3.43Å; T263-Y268 WeakPolarHBondContact O-CB 3.29Å; T263-Y268 VanDerWaalsContact O-CG 3.22Å; T263-Y268 PolarHBondContact O-N 3.42Å |
| 264 | Y | 89.1 | Confident | 89.8 | Confident | 9 Ų | 9 | 61.9 Ų | 61.9 | 4% | 0.035 | 31% | 0.311 | C | S | . | . | I | π-helix | trans | -75.5 | -37.1 | -174.3 | -75.7 | -95.2 | 0 | 0 | 0 | 113.5 | L196 E199 E200 W260 Y268 H269 P277 | L196-Y264 HydrophobicContact CB-CE2 4.35Å; L196-Y264 HydrophobicContact CD1-CE2 4.25Å; L196-Y264 HydrophobicContact CG-CE2 3.9Å; L196-Y264 WeakPolarHBondContact CG-OH 3.33Å; E199-Y264 HydrophobicContact CB-CD1 3.89Å; E199-Y264 HydrophobicContact CB-CE1 3.99Å; E199-Y264 HydrophobicContact CG-CD1 4.22Å; E200-Y264 HydrophobicContact CG-CE1 4.47Å; E200-Y264 VanDerWaalsContact OE1-CE1 3.24Å; E200-Y264 WeakPolarHBondContact OE1-CE1 3.45Å; E200-Y264 PolarHBondContact OE1-OH 2.9Å; W260-Y264 AromaticContact CD1-CD2 3.56Å; W260-Y264 AromaticContact CD1-CG 3.95Å; W260-Y264 HydrophobicContact CG-CD2 4.43Å; W260-Y264 AromaticContact NE1-CD2 3.82Å; W260-Y264 AromaticContact NE1-CG 3.72Å; W260-Y264 PolarHBondContact O-N 3.23Å; Y264-Y268 AromaticContact CD1-CD2 3.83Å; Y264-Y268 HydrophobicContact CD1-CD2 3.83Å; Y264-Y268 HydrophobicContact CD1-CE2 4.05Å; Y264-Y268 HydrophobicContact CD2-CD2 4.29Å; Y264-Y268 AromaticContact CD2-CE2 3.97Å; Y264-Y268 HydrophobicContact CD2-CE2 3.97Å; Y264-Y268 AromaticContact CE1-CD2 4Å; Y264-Y268 HydrophobicContact CE1-CD2 4Å; Y264-Y268 AromaticContact CE1-CE2 3.84Å; Y264-Y268 HydrophobicContact CE1-CE2 3.84Å; Y264-Y268 HydrophobicContact CE2-CD2 4.43Å; Y264-Y268 AromaticContact CE2-CE2 3.74Å; Y264-Y268 HydrophobicContact CE2-CE2 3.74Å; Y264-Y268 AromaticContact CG-CD2 3.97Å; Y264-Y268 HydrophobicContact CG-CD2 3.97Å; Y264-Y268 HydrophobicContact CG-CE2 4.09Å; Y264-Y268 AromaticContact CZ-CE2 3.65Å; Y264-H269 PolarHBondContact O-CD2 3.36Å; Y264-H269 PolarHBondContact O-NE2 2.86Å; Y264-P277 HydrophobicContact CD1-CG 3.91Å; Y264-P277 HydrophobicContact CE1-CG 3.8Å |
| 265 | G | 85.4 | Confident | 89.3 | Confident | 27 Ų | 27 | 59.3 Ų | 59.3 | 28% | 0.278 | 29% | 0.291 | S | S | . | . | I | π-helix | trans | -82 | -27.5 | -177 | 0 | 0 | 0 | 0 | 0 | 114.5 | Y261 H269 | Y261-G265 CarbonylContact O-C 3.33Å; Y261-G265 WeakPolarHBondContact O-CA 3.39Å; Y261-G265 PolarHBondContact O-N 2.89Å; G265-H269 PolarHBondContact O-CD2 3.5Å |
| 266 | S | 88.4 | Confident | 88.9 | Confident | 44 Ų | 44 | 58.5 Ų | 58.5 | 31% | 0.308 | 29% | 0.287 | S | S | . | . | I | π-helix | trans | -121.9 | -64.4 | -174.3 | -58.5 | 0 | 0 | 0 | 0 | 112.9 | Y261 Y268 H269 | Y261-S266 PolarHBondContact O-N 2.84Å; S266-Y268 PolarHBondContact O-N 3.21Å; S266-H269 PolarHBondContact O-N 2.86Å |
| 267 | W | 90.4 | Very high | 88.3 | Confident | 108 Ų | 108 | 59.6 Ų | 59.6 | 41% | 0.409 | 29% | 0.294 | S | S | . | . | G | 310 helix | trans | -66.9 | -43.1 | -170 | -177.2 | 27.2 | 0 | 0 | 0 | 112.8 | V130 L262 T263 H269 Q270 S273 | V130-W267 HydrophobicContact CB-CZ3 4.28Å; V130-W267 HydrophobicContact CG1-CE3 4.14Å; V130-W267 HydrophobicContact CG1-CH2 4.29Å; V130-W267 HydrophobicContact CG1-CZ3 3.43Å; V130-W267 VanDerWaalsContact CG1-CZ3 3.43Å; V130-W267 HydrophobicContact CG2-CH2 3.82Å; V130-W267 HydrophobicContact CG2-CZ3 3.81Å; L262-W267 VanDerWaalsContact O-CB 3.28Å; L262-W267 WeakPolarHBondContact O-CB 3.25Å; L262-W267 PolarHBondContact O-N 2.91Å; T263-W267 PolarHBondContact O-N 3.43Å; W267-H269 PolarHBondContact O-N 3.42Å; W267-H269 VanDerWaalsContact O-N 3.09Å; W267-Q270 VanDerWaalsContact O-CB 3.27Å; W267-Q270 WeakPolarHBondContact O-CB 3.27Å; W267-Q270 WeakPolarHBondContact O-CG 3.42Å; W267-Q270 PolarHBondContact O-N 2.9Å; W267-S273 WeakPolarHBondContact O-CB 3.47Å; W267-S273 PolarHBondContact O-OG 3.47Å; W267-S273 VanDerWaalsContact O-OG 3.14Å |
| 268 | Y | 90.3 | Very high | 87.5 | Confident | 3 Ų | 3 | 57.5 Ų | 57.5 | 1% | 0.012 | 28% | 0.284 | C | S | . | . | G | 310 helix | trans | -68 | -9 | -177.7 | -69.3 | -5.1 | 0 | 0 | 0 | 114.5 | R127 V130 T263 Y264 S266 Q270 S273 P274 G275 S276 | R127-Y268 WeakPolarHBondContact CA-OH 3.39Å; R127-Y268 HydrophobicContact CB-CE2 4.08Å; R127-Y268 WeakPolarHBondContact CB-OH 3.35Å; R127-Y268 HydrophobicContact CG-CD2 4.4Å; R127-Y268 HydrophobicContact CG-CE1 4.2Å; R127-Y268 HydrophobicContact CG-CE2 3.69Å; R127-Y268 PolarHBondContact O-OH 2.89Å; V130-Y268 HydrophobicContact CG1-CE1 4.34Å; V130-Y268 WeakPolarHBondContact CG1-OH 3.38Å; T263-Y268 WeakPolarHBondContact O-CB 3.29Å; T263-Y268 VanDerWaalsContact O-CG 3.22Å; T263-Y268 PolarHBondContact O-N 3.42Å; Y264-Y268 AromaticContact CD1-CD2 3.83Å; Y264-Y268 HydrophobicContact CD1-CD2 3.83Å; Y264-Y268 HydrophobicContact CD1-CE2 4.05Å; Y264-Y268 HydrophobicContact CD2-CD2 4.29Å; Y264-Y268 AromaticContact CD2-CE2 3.97Å; Y264-Y268 HydrophobicContact CD2-CE2 3.97Å; Y264-Y268 AromaticContact CE1-CD2 4Å; Y264-Y268 HydrophobicContact CE1-CD2 4Å; Y264-Y268 AromaticContact CE1-CE2 3.84Å; Y264-Y268 HydrophobicContact CE1-CE2 3.84Å; Y264-Y268 HydrophobicContact CE2-CD2 4.43Å; Y264-Y268 AromaticContact CE2-CE2 3.74Å; Y264-Y268 HydrophobicContact CE2-CE2 3.74Å; Y264-Y268 AromaticContact CG-CD2 3.97Å; Y264-Y268 HydrophobicContact CG-CD2 3.97Å; Y264-Y268 HydrophobicContact CG-CE2 4.09Å; Y264-Y268 AromaticContact CZ-CE2 3.65Å; S266-Y268 PolarHBondContact O-N 3.21Å; Y268-Q270 VanDerWaalsContact C-N 3.34Å; Y268-S273 VanDerWaalsContact CA-OG 3.29Å; Y268-S273 WeakPolarHBondContact CA-OG 3.44Å; Y268-S273 PolarHBondContact O-OG 2.85Å; Y268-P274 HydrophobicContact CD1-CG 4.35Å; Y268-P274 HydrophobicContact CE1-CB 4.35Å; Y268-P274 HydrophobicContact CE1-CG 3.9Å; Y268-G275 CarbonylContact O-C 3.46Å; Y268-G275 WeakPolarHBondContact O-CA 3.41Å; Y268-S276 PolarHBondContact O-N 2.95Å |
| 269 | H | 85.4 | Confident | 86.7 | Confident | 128 Ų | 128 | 56.9 Ų | 56.9 | 59% | 0.593 | 28% | 0.282 | S | S | * | . | G | 310 helix | trans | -82.2 | -13.4 | 170.7 | -72.7 | -81.4 | 0 | 0 | 0 | 113.3 | Y264 G265 S266 W267 | Y264-H269 PolarHBondContact O-CD2 3.36Å; Y264-H269 PolarHBondContact O-NE2 2.86Å; G265-H269 PolarHBondContact O-CD2 3.5Å; S266-H269 PolarHBondContact O-N 2.86Å; W267-H269 PolarHBondContact O-N 3.42Å; W267-H269 VanDerWaalsContact O-N 3.09Å |
| 270 | Q | 87 | Confident | 85.7 | Confident | 96 Ų | 96 | 59.4 Ų | 59.4 | 45% | 0.449 | 31% | 0.309 | S | S | . | . | S | Bend | trans | -86.2 | 149.6 | -175.4 | -56.8 | -65 | -30.1 | 0 | 0 | 112.1 | W267 Y268 W272 S273 | W267-Q270 VanDerWaalsContact O-CB 3.27Å; W267-Q270 WeakPolarHBondContact O-CB 3.27Å; W267-Q270 WeakPolarHBondContact O-CG 3.42Å; W267-Q270 PolarHBondContact O-N 2.9Å; Y268-Q270 VanDerWaalsContact C-N 3.34Å; Q270-W272 VanDerWaalsContact CB-NE1 3.28Å; Q270-W272 PolarHBondContact O-N 3.16Å; Q270-S273 VanDerWaalsContact O-CB 3.29Å; Q270-S273 WeakPolarHBondContact O-CB 3.5Å; Q270-S273 PolarHBondContact O-N 3.42Å; Q270-S273 VanDerWaalsContact O-N 3.1Å; Q270-S273 PolarHBondContact O-OG 3.33Å |
| 271 | P | 80.4 | Confident | 84.8 | Confident | 109 Ų | 109 | 58.6 Ų | 58.6 | 71% | 0.708 | 31% | 0.307 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.1 | -39.5 | -170.4 | 22.6 | -33.5 | 0 | 0 | 0 | 115.2 | R123 S273 | R123-P271 PolarHBondContact NH2-O 3.36Å; R123-P271 VanDerWaalsContact NH2-O 3.08Å; P271-S273 VanDerWaalsContact C-N 3.29Å; P271-S273 PolarHBondContact O-N 3.07Å |
| 272 | W | 80.7 | Confident | 84 | Confident | 217 Ų | 217 | 53.8 Ų | 53.8 | 82% | 0.822 | 29% | 0.289 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.2 | -7.4 | 172.1 | 52 | -22.3 | 0 | 0 | 0 | 116.1 | Q270 | Q270-W272 VanDerWaalsContact CB-NE1 3.28Å; Q270-W272 PolarHBondContact O-N 3.16Å |
| 273 | S | 86.7 | Confident | 82.5 | Confident | 3 Ų | 3 | 55.1 Ų | 55.1 | 2% | 0.021 | 30% | 0.302 | C | S | . | . | S | Bend | trans | -83.8 | 170.5 | 179.6 | 78.5 | 0 | 0 | 0 | 0 | 112 | R123 W267 Y268 Q270 P271 G275 | R123-S273 PolarHBondContact NE-O 2.87Å; R123-S273 PolarHBondContact NH2-O 2.85Å; W267-S273 WeakPolarHBondContact O-CB 3.47Å; W267-S273 PolarHBondContact O-OG 3.47Å; W267-S273 VanDerWaalsContact O-OG 3.14Å; Y268-S273 VanDerWaalsContact CA-OG 3.29Å; Y268-S273 WeakPolarHBondContact CA-OG 3.44Å; Y268-S273 PolarHBondContact O-OG 2.85Å; Q270-S273 VanDerWaalsContact O-CB 3.29Å; Q270-S273 WeakPolarHBondContact O-CB 3.5Å; Q270-S273 PolarHBondContact O-N 3.42Å; Q270-S273 VanDerWaalsContact O-N 3.1Å; Q270-S273 PolarHBondContact O-OG 3.33Å; P271-S273 VanDerWaalsContact C-N 3.29Å; P271-S273 PolarHBondContact O-N 3.07Å; S273-G275 PolarHBondContact O-N 3.28Å; S273-G275 PolarHBondContact OG-N 3.37Å; S273-G275 VanDerWaalsContact OG-N 3.11Å |
| 274 | P | 80.9 | Confident | 80.8 | Confident | 13 Ų | 13 | 65.6 Ų | 65.6 | 8% | 0.084 | 34% | 0.341 | C | S | . | . | S | Bend | trans | -54.7 | -19.1 | 169.6 | -27.3 | 36.7 | 0 | 0 | 0 | 114.3 | R123 S126 R127 V130 Y268 | R123-P274 VanDerWaalsContact CG-O 3.32Å; R123-P274 WeakPolarHBondContact CG-O 3.21Å; R123-P274 PolarHBondContact NE-O 3.02Å; S126-P274 WeakPolarHBondContact OG-CG 3.3Å; R127-P274 HydrophobicContact CG-CB 3.41Å; R127-P274 VanDerWaalsContact CG-CB 3.41Å; R127-P274 HydrophobicContact CG-CG 4.07Å; V130-P274 HydrophobicContact CG2-CG 4.39Å; Y268-P274 HydrophobicContact CD1-CG 4.35Å; Y268-P274 HydrophobicContact CE1-CB 4.35Å; Y268-P274 HydrophobicContact CE1-CG 3.9Å |
| 275 | G | 84 | Confident | 78.9 | Confident | 4 Ų | 4 | 70.9 Ų | 70.9 | 4% | 0.041 | 38% | 0.376 | C | S | . | . | trans | 89.6 | 156 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y268 S273 | Y268-G275 CarbonylContact O-C 3.46Å; Y268-G275 WeakPolarHBondContact O-CA 3.41Å; S273-G275 PolarHBondContact O-N 3.28Å; S273-G275 PolarHBondContact OG-N 3.37Å; S273-G275 VanDerWaalsContact OG-N 3.11Å | ||
| 276 | S | 85.3 | Confident | 76.7 | Confident | 29 Ų | 29 | 78.1 Ų | 78.1 | 20% | 0.203 | 40% | 0.403 | C | S | . | . | trans | -69.1 | 156.8 | -177.8 | 61.5 | 0 | 0 | 0 | 0 | 112.6 | Y268 G278 H279 | Y268-S276 PolarHBondContact O-N 2.95Å; S276-G278 PolarHBondContact O-N 3.27Å; S276-H279 WeakPolarHBondContact O-CB 3.39Å; S276-H279 PolarHBondContact O-N 3.47Å | ||
| 277 | P | 82.4 | Confident | 74.4 | Confident | 23 Ų | 23 | 81.2 Ų | 81.2 | 15% | 0.149 | 42% | 0.424 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -55.2 | 123.9 | 175.1 | -20.6 | 29.6 | 0 | 0 | 0 | 111.5 | R127 V203 Y264 | R127-P277 VanDerWaalsContact NH1-CA 3.3Å; V203-P277 HydrophobicContact CG2-CB 3.31Å; Y264-P277 HydrophobicContact CD1-CG 3.91Å; Y264-P277 HydrophobicContact CE1-CG 3.8Å |
| 278 | G | 77.1 | Confident | 72 | Confident | 12 Ų | 12 | 81 Ų | 81 | 12% | 0.124 | 44% | 0.44 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 86.9 | -3.3 | -176.4 | 0 | 0 | 0 | 0 | 0 | 115.4 | S276 G280 L281 | S276-G278 PolarHBondContact O-N 3.27Å; G278-G280 PolarHBondContact O-N 2.85Å; G278-L281 VanDerWaalsContact CA-CD1 3.47Å; G278-L281 PolarHBondContact O-N 3.39Å |
| 279 | H | 78.4 | Confident | 69.7 | Low | 108 Ų | 108 | 91.1 Ų | 91.1 | 50% | 0.5 | 48% | 0.478 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.9 | 129.7 | 178.5 | -166.8 | 88.1 | 0 | 0 | 0 | 111.3 | H124 S276 L281 | H124-H279 PolarHBondContact CE1-O 2.87Å; H124-H279 PolarHBondContact NE2-O 2.85Å; S276-H279 WeakPolarHBondContact O-CB 3.39Å; S276-H279 PolarHBondContact O-N 3.47Å; H279-L281 PolarHBondContact O-N 3.11Å |
| 280 | G | 73.5 | Confident | 67.6 | Low | 63 Ų | 63 | 94.7 Ų | 94.7 | 65% | 0.649 | 49% | 0.492 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 74.9 | -2.2 | -178.5 | 0 | 0 | 0 | 0 | 0 | 115.4 | G278 | G278-G280 PolarHBondContact O-N 2.85Š|
| 281 | L | 76.4 | Confident | 65.4 | Low | 13 Ų | 13 | 97.4 Ų | 97.4 | 7% | 0.068 | 50% | 0.504 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -88.3 | -33.6 | 178.2 | -77.1 | 144.8 | 0 | 0 | 0 | 113.1 | V111 A114 T115 G278 H279 | V111-L281 HydrophobicContact CB-CD2 4.23Å; V111-L281 HydrophobicContact CG1-CD2 4.13Å; V111-L281 HydrophobicContact CG2-CD1 4.1Å; V111-L281 HydrophobicContact CG2-CD2 4.11Å; A114-L281 HydrophobicContact CB-CD2 3.5Å; A114-L281 VanDerWaalsContact CB-CD2 3.5Å; T115-L281 HydrophobicContact CG2-CD2 3.81Å; T115-L281 HydrophobicContact CG2-CG 4.43Å; G278-L281 VanDerWaalsContact CA-CD1 3.47Å; G278-L281 PolarHBondContact O-N 3.39Å; H279-L281 PolarHBondContact O-N 3.11Å |
| 282 | F | 76.8 | Confident | 63.3 | Low | 32 Ų | 32 | 103.6 Ų | 103.6 | 14% | 0.14 | 53% | 0.531 | C | S | . | . | S | Bend | trans | -116.9 | 112.8 | -177.1 | -51.8 | -62.6 | 0 | 0 | 0 | 108.8 | V203 K206 H210 L212 R284 | V203-F282 HydrophobicContact CG1-CE2 4.24Å; V203-F282 HydrophobicContact CG1-CZ 4.34Å; K206-F282 HydrophobicContact CB-CD2 4.18Å; K206-F282 HydrophobicContact CB-CE1 4.48Å; K206-F282 HydrophobicContact CB-CE2 3.56Å; K206-F282 HydrophobicContact CB-CZ 3.74Å; K206-F282 HydrophobicContact CD-CE2 4.3Å; H210-F282 HydrophobicContact CB-CD1 4.24Å; H210-F282 HydrophobicContact CB-CE1 4.42Å; H210-F282 AromaticContact CD2-CD1 3.93Å; H210-F282 AromaticContact CE1-CD1 3.6Å; H210-F282 AromaticContact CE1-CG 3.67Å; H210-F282 AromaticContact CG-CD1 3.6Å; H210-F282 AromaticContact ND1-CD1 3.39Å; H210-F282 WeakPolarHBondContact ND1-CD1 3.24Å; H210-F282 AromaticContact ND1-CE1 3.79Å; H210-F282 AromaticContact ND1-CG 3.93Å; H210-F282 AromaticContact NE2-CD1 3.93Å; H210-F282 AromaticContact NE2-CG 3.99Å; L212-F282 HydrophobicContact CD1-CE1 3.94Å; F282-R284 PolarHBondContact O-N 3.39Å |
| 283 | P | 62.1 | Low | 62.4 | Low | 111 Ų | 111 | 97.9 Ų | 97.9 | 72% | 0.721 | 52% | 0.516 | S | S | * | . | P | Polyproline II helix | trans | -56.1 | 130.8 | 170.1 | -19 | 29.9 | 0 | 0 | 0 | 108.6 | ||
| 284 | R | 56.6 | Low | 61.2 | Low | 226 Ų | 226 | 102.9 Ų | 102.9 | 85% | 0.853 | 54% | 0.542 | S | S | * | . | P | Polyproline II helix | trans | -59.6 | 137.3 | 169.9 | -69.8 | -176.4 | -178.8 | 172.7 | 0.6 | 107.4 | F282 H286 | F282-R284 PolarHBondContact O-N 3.39Å; R284-H286 PolarHBondContact O-N 3.33Å; R284-H286 VanDerWaalsContact O-N 3.09Å |
| 285 | P | 47.6 | Very low | 60.1 | Low | 119 Ų | 119 | 107.9 Ų | 107.9 | 77% | 0.773 | 57% | 0.568 | S | S | * | * | P | Polyproline II helix | trans | -53 | 126 | 166.7 | 21.4 | -28.9 | 0 | 0 | 0 | 107 | S287 | P285-S287 PolarHBondContact O-N 3.02Š|
| 286 | H | 39.5 | Very low | 58.7 | Low | 180 Ų | 180 | 114 Ų | 114 | 83% | 0.833 | 60% | 0.599 | S | S | * | * | trans | -57 | 105.8 | 178.5 | -139.1 | 56 | 0 | 0 | 0 | 106.3 | R284 S288 | R284-H286 PolarHBondContact O-N 3.33Å; R284-H286 VanDerWaalsContact O-N 3.09Å; H286-S288 VanDerWaalsContact C-N 3.27Å; H286-S288 PolarHBondContact O-N 3.31Å | ||
| 287 | S | 41.7 | Very low | 57 | Low | 108 Ų | 108 | 119.3 Ų | 119.3 | 76% | 0.755 | 62% | 0.623 | S | S | * | * | trans | -65 | 101.3 | 164.4 | 56.5 | 0 | 0 | 0 | 0 | 104.4 | P285 R289 | P285-S287 PolarHBondContact O-N 3.02Å; S287-R289 VanDerWaalsContact C-N 3.31Å; S287-R289 PolarHBondContact O-N 3.48Å | ||
| 288 | S | 39.4 | Very low | 55.3 | Low | 105 Ų | 105 | 125.7 Ų | 125.7 | 73% | 0.734 | 66% | 0.655 | S | S | * | * | trans | -49.3 | 105.9 | 167.7 | -81.1 | 0 | 0 | 0 | 0 | 106.7 | H286 K290 | H286-S288 VanDerWaalsContact C-N 3.27Å; H286-S288 PolarHBondContact O-N 3.31Å; S288-K290 VanDerWaalsContact C-N 3.32Å; S288-K290 PolarHBondContact O-N 3.4Å | ||
| 289 | R | 40.8 | Very low | 53.7 | Low | 215 Ų | 215 | 133.9 Ų | 133.9 | 81% | 0.811 | 69% | 0.693 | S | S | * | * | trans | -57.7 | 103.4 | 170 | -152.3 | 179.7 | -164.5 | 177.4 | 2.2 | 103.6 | S287 H291 | S287-R289 VanDerWaalsContact C-N 3.31Å; S287-R289 PolarHBondContact O-N 3.48Å; R289-H291 PolarHBondContact O-N 3.42Å | ||
| 290 | K | 41.4 | Very low | 51.8 | Low | 203 Ų | 203 | 135.8 Ų | 135.8 | 88% | 0.883 | 71% | 0.708 | S | S | * | * | trans | -62.2 | 94.4 | 167 | -81.4 | -174.9 | 176 | -176.3 | 0 | 105.5 | S288 N292 | S288-K290 VanDerWaalsContact C-N 3.32Å; S288-K290 PolarHBondContact O-N 3.4Å; K290-N292 PolarHBondContact O-N 2.91Å | ||
| 291 | H | 41.6 | Very low | 50 | Low | 153 Ų | 153 | 141.9 Ų | 141.9 | 71% | 0.708 | 71% | 0.713 | S | S | * | * | trans | -76.1 | 106.4 | 151.2 | -93.4 | -72.7 | 0 | 0 | 0 | 105.4 | R289 | R289-H291 PolarHBondContact O-N 3.42Š| ||
| 292 | N | 36.4 | Very low | 47.6 | Very low | 238 Ų | 238 | 153.6 Ų | 153.6 | 100% | 1.273 | 77% | 0.771 | S | S | * | * | trans | -158.2 | 0 | 147.4 | -92.3 | -5.4 | 0 | 0 | 0 | 106.2 | K290 | K290-N292 PolarHBondContact O-N 2.91Š|
Retrieved 292 of 292 residues in 1896 ms
(Link to these results)