| 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 | 58.4 | Low | 67.9 | Low | 215 Ų | 215 | 122 Ų | 122 | 100% | 1.059 | 63% | 0.632 | S | S | * | * | 0 | -49.6 | 0 | -112.2 | 167.7 | 168.4 | 0 | 0 | 112.4 | R3 S4 | M1-R3 PolarHBondContact O-N 3.33Å; M1-S4 WeakPolarHBondContact O-CB 3.29Å; M1-S4 PolarHBondContact O-N 3.13Å | |||
| 2 | T | 61.4 | Low | 68.4 | Low | 108 Ų | 108 | 117.9 Ų | 117.9 | 66% | 0.663 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -55.4 | -42.2 | 180 | 44.4 | 0 | 0 | 0 | 0 | 114.9 | S4 V5 Y6 | T2-S4 VanDerWaalsContact C-N 3.26Å; T2-S4 PolarHBondContact O-N 3.1Å; T2-V5 PolarHBondContact O-N 3.23Å; T2-V5 VanDerWaalsContact O-N 3.1Å; T2-Y6 VanDerWaalsContact O-CD2 3.29Å; T2-Y6 WeakPolarHBondContact O-CD2 3.5Å; T2-Y6 PolarHBondContact O-N 2.92Å; T2-Y6 VanDerWaalsContact O-N 3.13Å |
| 3 | R | 64.4 | Low | 68.9 | Low | 222 Ų | 222 | 119.1 Ų | 119.1 | 84% | 0.838 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -61 | -29.7 | -179.8 | -154.8 | 176.5 | -172.4 | 171.6 | 2 | 114.3 | M1 A7 | M1-R3 PolarHBondContact O-N 3.33Å; R3-A7 PolarHBondContact O-N 3.31Å |
| 4 | S | 70.7 | Confident | 69.3 | Low | 80 Ų | 80 | 118.5 Ų | 118.5 | 56% | 0.559 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -73.4 | -37.1 | 176.3 | -173.2 | 0 | 0 | 0 | 0 | 111.8 | M1 T2 Q8 | M1-S4 WeakPolarHBondContact O-CB 3.29Å; M1-S4 PolarHBondContact O-N 3.13Å; T2-S4 VanDerWaalsContact C-N 3.26Å; T2-S4 PolarHBondContact O-N 3.1Å; S4-Q8 WeakPolarHBondContact O-CB 3.32Å; S4-Q8 PolarHBondContact O-N 3.23Å |
| 5 | V | 68.3 | Low | 69.6 | Low | 80 Ų | 80 | 117.7 Ų | 117.7 | 49% | 0.485 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -69 | -42 | 178.9 | -179.8 | 0 | 0 | 0 | 0 | 110.2 | T2 Q8 L9 | T2-V5 PolarHBondContact O-N 3.23Å; T2-V5 VanDerWaalsContact O-N 3.1Å; V5-Q8 PolarHBondContact O-N 3.25Å; V5-L9 HydrophobicContact CG1-CD1 4.13Å; V5-L9 HydrophobicContact CG1-CG 4.49Å; V5-L9 WeakPolarHBondContact O-CG 3.37Å; V5-L9 PolarHBondContact O-N 3.07Å |
| 6 | Y | 67.2 | Low | 69.8 | Low | 176 Ų | 176 | 115.4 Ų | 115.4 | 69% | 0.69 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -61 | -45.5 | 174.2 | -82 | -75.6 | 0 | 0 | 0 | 112.6 | T2 Q8 L9 D10 | T2-Y6 VanDerWaalsContact O-CD2 3.29Å; T2-Y6 WeakPolarHBondContact O-CD2 3.5Å; T2-Y6 PolarHBondContact O-N 2.92Å; T2-Y6 VanDerWaalsContact O-N 3.13Å; Y6-Q8 VanDerWaalsContact C-N 3.27Å; Y6-Q8 PolarHBondContact O-N 3.04Å; Y6-L9 PolarHBondContact O-N 3.03Å; Y6-D10 WeakPolarHBondContact O-CB 3.45Å; Y6-D10 PolarHBondContact O-N 3.16Å |
| 7 | A | 67 | Low | 70 | Confident | 57 Ų | 57 | 117 Ų | 117 | 47% | 0.471 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -62.3 | -36.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | R3 S11 | R3-A7 PolarHBondContact O-N 3.31Å; A7-S11 PolarHBondContact O-N 3.25Å; A7-S11 PolarHBondContact O-OG 3.06Å |
| 8 | Q | 69.8 | Low | 70.5 | Confident | 127 Ų | 127 | 120 Ų | 120 | 59% | 0.593 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -71.3 | -37 | 178.2 | -169 | 178.4 | -19.5 | 0 | 0 | 112.5 | S4 V5 Y6 S11 V12 | S4-Q8 WeakPolarHBondContact O-CB 3.32Å; S4-Q8 PolarHBondContact O-N 3.23Å; V5-Q8 PolarHBondContact O-N 3.25Å; Y6-Q8 VanDerWaalsContact C-N 3.27Å; Y6-Q8 PolarHBondContact O-N 3.04Å; Q8-S11 WeakPolarHBondContact O-CB 3.4Å; Q8-S11 PolarHBondContact O-N 2.66Å; Q8-V12 WeakPolarHBondContact O-CG2 3.47Å; Q8-V12 PolarHBondContact O-N 3.38Å; Q8-V12 VanDerWaalsContact O-N 3.12Å |
| 9 | L | 72.3 | Confident | 70.9 | Confident | 101 Ų | 101 | 116.2 Ų | 116.2 | 53% | 0.529 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -64.9 | -44.7 | 173.8 | -71.2 | 167.6 | 0 | 0 | 0 | 111.3 | V5 Y6 S11 V12 E13 | V5-L9 HydrophobicContact CG1-CD1 4.13Å; V5-L9 HydrophobicContact CG1-CG 4.49Å; V5-L9 WeakPolarHBondContact O-CG 3.37Å; V5-L9 PolarHBondContact O-N 3.07Å; Y6-L9 PolarHBondContact O-N 3.03Å; L9-S11 PolarHBondContact O-N 3.38Å; L9-V12 PolarHBondContact O-N 3.3Å; L9-E13 WeakPolarHBondContact O-CB 3.32Å; L9-E13 PolarHBondContact O-N 3.23Å |
| 10 | D | 71.8 | Confident | 71.6 | Confident | 104 Ų | 104 | 114.6 Ų | 114.6 | 56% | 0.556 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -59.8 | -36.1 | 176.4 | -149.9 | 25.2 | 0 | 0 | 0 | 111.4 | Y6 L14 | Y6-D10 WeakPolarHBondContact O-CB 3.45Å; Y6-D10 PolarHBondContact O-N 3.16Å; D10-L14 WeakPolarHBondContact O-CB 3.34Å; D10-L14 WeakPolarHBondContact O-CG 3.41Å; D10-L14 PolarHBondContact O-N 3.12Å |
| 11 | S | 75.3 | Confident | 72.2 | Confident | 72 Ų | 72 | 117.6 Ų | 117.6 | 50% | 0.503 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -66.6 | -39.5 | 174.9 | -50.2 | 0 | 0 | 0 | 0 | 112.8 | A7 Q8 L9 L15 | A7-S11 PolarHBondContact O-N 3.25Å; A7-S11 PolarHBondContact O-OG 3.06Å; Q8-S11 WeakPolarHBondContact O-CB 3.4Å; Q8-S11 PolarHBondContact O-N 2.66Å; L9-S11 PolarHBondContact O-N 3.38Å; S11-L15 WeakPolarHBondContact O-CB 3.46Å; S11-L15 PolarHBondContact O-N 2.88Å; S11-L15 VanDerWaalsContact O-N 3.16Å |
| 12 | V | 74.5 | Confident | 73.5 | Confident | 73 Ų | 73 | 114.7 Ų | 114.7 | 44% | 0.442 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -74.2 | -37.9 | 179.7 | 173.6 | 0 | 0 | 0 | 0 | 110.4 | Q8 L9 L15 L16 | Q8-V12 WeakPolarHBondContact O-CG2 3.47Å; Q8-V12 PolarHBondContact O-N 3.38Å; Q8-V12 VanDerWaalsContact O-N 3.12Å; L9-V12 PolarHBondContact O-N 3.3Å; V12-L15 WeakPolarHBondContact O-CB 3.35Å; V12-L15 PolarHBondContact O-N 3.07Å; V12-L16 HydrophobicContact CG1-CD1 4.26Å; V12-L16 HydrophobicContact CG1-CG 4.38Å; V12-L16 WeakPolarHBondContact O-CG 3.3Å; V12-L16 PolarHBondContact O-N 3.08Å |
| 13 | E | 74.9 | Confident | 74.7 | Confident | 133 Ų | 133 | 114.4 Ų | 114.4 | 62% | 0.621 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -64.5 | -44.2 | 177.7 | -163.3 | 152.9 | -171.3 | 0 | 0 | 111.2 | L9 L15 L16 D17 | L9-E13 WeakPolarHBondContact O-CB 3.32Å; L9-E13 PolarHBondContact O-N 3.23Å; E13-L15 VanDerWaalsContact C-N 3.32Å; E13-L15 PolarHBondContact O-N 2.9Å; E13-L16 PolarHBondContact O-N 3.43Å; E13-D17 PolarHBondContact O-N 2.96Å |
| 14 | L | 73.9 | Confident | 75.8 | Confident | 111 Ų | 111 | 108.4 Ų | 108.4 | 58% | 0.581 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -60.5 | -39.4 | 171.2 | -75.8 | 168.2 | 0 | 0 | 0 | 112.9 | D10 D17 E18 | D10-L14 WeakPolarHBondContact O-CB 3.34Å; D10-L14 WeakPolarHBondContact O-CG 3.41Å; D10-L14 PolarHBondContact O-N 3.12Å; L14-D17 PolarHBondContact O-N 3.41Å; L14-E18 PolarHBondContact O-N 2.72Å; L14-E18 VanDerWaalsContact O-N 3.08Å |
| 15 | L | 74.6 | Confident | 76.8 | Confident | 106 Ų | 106 | 107.8 Ų | 107.8 | 56% | 0.555 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -66.9 | -36.6 | 177.6 | -171.2 | 112.7 | 0 | 0 | 0 | 112 | S11 V12 E13 L19 | S11-L15 WeakPolarHBondContact O-CB 3.46Å; S11-L15 PolarHBondContact O-N 2.88Å; S11-L15 VanDerWaalsContact O-N 3.16Å; V12-L15 WeakPolarHBondContact O-CB 3.35Å; V12-L15 PolarHBondContact O-N 3.07Å; E13-L15 VanDerWaalsContact C-N 3.32Å; E13-L15 PolarHBondContact O-N 2.9Å; L15-L19 HydrophobicContact CD2-CD1 4.34Å; L15-L19 VanDerWaalsContact O-CD1 3.3Å; L15-L19 WeakPolarHBondContact O-CD1 3.5Å; L15-L19 PolarHBondContact O-N 3.22Å |
| 16 | L | 72.7 | Confident | 78 | Confident | 81 Ų | 81 | 105.5 Ų | 105.5 | 42% | 0.424 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -73.1 | -33.5 | 176.5 | -70.2 | -178.3 | 0 | 0 | 0 | 112.3 | V12 E13 E18 L19 Y24 | V12-L16 HydrophobicContact CG1-CD1 4.26Å; V12-L16 HydrophobicContact CG1-CG 4.38Å; V12-L16 WeakPolarHBondContact O-CG 3.3Å; V12-L16 PolarHBondContact O-N 3.08Å; E13-L16 PolarHBondContact O-N 3.43Å; L16-E18 VanDerWaalsContact C-N 3.35Å; L16-L19 WeakPolarHBondContact O-CB 3.49Å; L16-L19 PolarHBondContact O-N 3.49Å; L16-Y24 WeakPolarHBondContact CB-OH 3.46Å; L16-Y24 PolarHBondContact O-OH 3.41Å |
| 17 | D | 72.8 | Confident | 79.2 | Confident | 143 Ų | 143 | 100.8 Ų | 100.8 | 77% | 0.765 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -69.1 | -31.2 | 173.9 | -105.2 | -0.2 | 0 | 0 | 0 | 112.6 | E13 L14 L19 | E13-D17 PolarHBondContact O-N 2.96Å; L14-D17 PolarHBondContact O-N 3.41Å; D17-L19 VanDerWaalsContact C-N 3.28Å; D17-L19 PolarHBondContact O-N 3.38Å |
| 18 | E | 78.4 | Confident | 80.5 | Confident | 171 Ų | 171 | 104.3 Ų | 104.3 | 80% | 0.799 | 53% | 0.529 | S | S | * | . | S | Bend | trans | -79.3 | -12 | 177.2 | -167.5 | 163.6 | -168.2 | 0 | 0 | 113 | L14 L16 | L14-E18 PolarHBondContact O-N 2.72Å; L14-E18 VanDerWaalsContact O-N 3.08Å; L16-E18 VanDerWaalsContact C-N 3.35Å |
| 19 | L | 78.8 | Confident | 81.7 | Confident | 47 Ų | 47 | 104.4 Ų | 104.4 | 25% | 0.246 | 53% | 0.528 | C | S | . | . | S | Bend | trans | -77 | 130.9 | -173.3 | -122.3 | 114.8 | 0 | 0 | 0 | 112 | L15 L16 D17 F23 Y24 | L15-L19 HydrophobicContact CD2-CD1 4.34Å; L15-L19 VanDerWaalsContact O-CD1 3.3Å; L15-L19 WeakPolarHBondContact O-CD1 3.5Å; L15-L19 PolarHBondContact O-N 3.22Å; L16-L19 WeakPolarHBondContact O-CB 3.49Å; L16-L19 PolarHBondContact O-N 3.49Å; D17-L19 VanDerWaalsContact C-N 3.28Å; D17-L19 PolarHBondContact O-N 3.38Å; L19-F23 HydrophobicContact CD2-CB 3.62Å; L19-F23 HydrophobicContact CD2-CD1 2.9Å; L19-F23 HydrophobicContact CD2-CD2 3.86Å; L19-F23 HydrophobicContact CD2-CE1 3.28Å; L19-F23 HydrophobicContact CD2-CE2 4.2Å; L19-F23 HydrophobicContact CD2-CG 3.18Å; L19-F23 HydrophobicContact CD2-CZ 3.94Å; L19-F23 HydrophobicContact CG-CD1 4.4Å; L19-Y24 HydrophobicContact CB-CE2 4.15Å |
| 20 | P | 85.2 | Confident | 82.9 | Confident | 85 Ų | 85 | 103.3 Ų | 103.3 | 55% | 0.552 | 53% | 0.525 | S | S | * | . | trans | -66.4 | 142 | -173.6 | 26.1 | -33.8 | 0 | 0 | 0 | 111.3 | M22 F23 | P20-M22 PolarHBondContact O-N 3.14Å; P20-F23 HydrophobicContact CG-CB 4.38Å; P20-F23 VanDerWaalsContact O-CB 3.3Å; P20-F23 WeakPolarHBondContact O-CB 3.49Å; P20-F23 PolarHBondContact O-N 3.42Å | ||
| 21 | Y | 83.1 | Confident | 84 | Confident | 178 Ų | 178 | 103.2 Ų | 103.2 | 70% | 0.698 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -48.6 | -34 | 177.6 | 178.4 | -99.3 | 0 | 0 | 0 | 113.8 | F23 Y24 L25 | Y21-F23 PolarHBondContact O-N 2.77Å; Y21-Y24 PolarHBondContact O-N 3.14Å; Y21-L25 HydrophobicContact CE1-CD2 4.38Å; Y21-L25 PolarHBondContact O-N 2.85Å; Y21-L25 VanDerWaalsContact O-N 3.14Å |
| 22 | M | 86.4 | Confident | 85.1 | Confident | 153 Ų | 153 | 103.2 Ų | 103.2 | 75% | 0.754 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -62.4 | -26.9 | 178.2 | -60.9 | -160.3 | 79.1 | 0 | 0 | 113.6 | P20 G26 | P20-M22 PolarHBondContact O-N 3.14Å; M22-G26 PolarHBondContact O-N 2.98Å |
| 23 | F | 86.5 | Confident | 86.2 | Confident | 102 Ų | 102 | 104.3 Ų | 104.3 | 45% | 0.447 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -71.3 | -45.9 | 176.8 | 179.3 | -92.9 | 0 | 0 | 0 | 111.9 | L19 P20 Y21 L25 G26 L27 | L19-F23 HydrophobicContact CD2-CB 3.62Å; L19-F23 HydrophobicContact CD2-CD1 2.9Å; L19-F23 HydrophobicContact CD2-CD2 3.86Å; L19-F23 HydrophobicContact CD2-CE1 3.28Å; L19-F23 HydrophobicContact CD2-CE2 4.2Å; L19-F23 HydrophobicContact CD2-CG 3.18Å; L19-F23 HydrophobicContact CD2-CZ 3.94Å; L19-F23 HydrophobicContact CG-CD1 4.4Å; P20-F23 HydrophobicContact CG-CB 4.38Å; P20-F23 VanDerWaalsContact O-CB 3.3Å; P20-F23 WeakPolarHBondContact O-CB 3.49Å; P20-F23 PolarHBondContact O-N 3.42Å; Y21-F23 PolarHBondContact O-N 2.77Å; F23-L25 VanDerWaalsContact C-N 3.28Å; F23-L25 PolarHBondContact O-N 2.83Å; F23-G26 CarbonylContact O-C 3.59Å; F23-G26 WeakPolarHBondContact O-CA 3.3Å; F23-G26 PolarHBondContact O-N 2.9Å; F23-G26 VanDerWaalsContact O-N 3.14Å; F23-L27 HydrophobicContact CD1-CD1 3.81Å; F23-L27 HydrophobicContact CD1-CG 4.15Å; F23-L27 HydrophobicContact CE1-CD1 3.3Å; F23-L27 HydrophobicContact CE1-CG 3.85Å; F23-L27 HydrophobicContact CZ-CD1 3.94Å; F23-L27 HydrophobicContact CZ-CD2 4.41Å; F23-L27 HydrophobicContact CZ-CG 4.18Å; F23-L27 PolarHBondContact O-N 3.34Å |
| 24 | Y | 88.7 | Confident | 87.1 | Confident | 97 Ų | 97 | 103 Ų | 103 | 38% | 0.38 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61.9 | -40.3 | 175.6 | -67.2 | -70.8 | 0 | 0 | 0 | 111.5 | L16 L19 Y21 G26 L27 F28 | L16-Y24 WeakPolarHBondContact CB-OH 3.46Å; L16-Y24 PolarHBondContact O-OH 3.41Å; L19-Y24 HydrophobicContact CB-CE2 4.15Å; Y21-Y24 PolarHBondContact O-N 3.14Å; Y24-G26 VanDerWaalsContact C-N 3.34Å; Y24-L27 PolarHBondContact O-N 3.3Å; Y24-F28 WeakPolarHBondContact O-CB 3.48Å; Y24-F28 PolarHBondContact O-N 3.25Å |
| 25 | L | 91.1 | Very high | 88.2 | Confident | 66 Ų | 66 | 102.6 Ų | 102.6 | 35% | 0.346 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63 | -42.8 | 174.4 | -169.7 | 63.2 | 0 | 0 | 0 | 111.2 | Y21 F23 F28 F29 | Y21-L25 HydrophobicContact CE1-CD2 4.38Å; Y21-L25 PolarHBondContact O-N 2.85Å; Y21-L25 VanDerWaalsContact O-N 3.14Å; F23-L25 VanDerWaalsContact C-N 3.28Å; F23-L25 PolarHBondContact O-N 2.83Å; L25-F28 WeakPolarHBondContact O-CB 3.43Å; L25-F28 PolarHBondContact O-N 3.26Å; L25-F29 HydrophobicContact CD1-CD2 4.3Å; L25-F29 HydrophobicContact CD1-CE2 3.81Å; L25-F29 HydrophobicContact CD2-CE2 4.32Å; L25-F29 HydrophobicContact CG-CD2 4.03Å; L25-F29 HydrophobicContact CG-CE2 3.75Å; L25-F29 WeakPolarHBondContact O-CD2 3.26Å; L25-F29 PolarHBondContact O-N 3.02Å |
| 26 | G | 92.3 | Very high | 89.2 | Confident | 33 Ų | 33 | 104 Ų | 104 | 34% | 0.34 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -59.5 | -46.7 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | M22 F23 Y24 F28 F29 V30 | M22-G26 PolarHBondContact O-N 2.98Å; F23-G26 CarbonylContact O-C 3.59Å; F23-G26 WeakPolarHBondContact O-CA 3.3Å; F23-G26 PolarHBondContact O-N 2.9Å; F23-G26 VanDerWaalsContact O-N 3.14Å; Y24-G26 VanDerWaalsContact C-N 3.34Å; G26-F28 VanDerWaalsContact C-N 3.33Å; G26-F28 PolarHBondContact O-N 2.88Å; G26-F29 PolarHBondContact O-N 3.24Å; G26-V30 WeakPolarHBondContact O-CG2 3.38Å; G26-V30 PolarHBondContact O-N 2.91Å |
| 27 | L | 92.9 | Very high | 90.3 | Very high | 76 Ų | 76 | 106 Ų | 106 | 40% | 0.398 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -60.1 | -43.2 | 175.3 | -76.1 | -178.4 | 0 | 0 | 0 | 111.7 | F23 Y24 F29 V30 N31 | F23-L27 HydrophobicContact CD1-CD1 3.81Å; F23-L27 HydrophobicContact CD1-CG 4.15Å; F23-L27 HydrophobicContact CE1-CD1 3.3Å; F23-L27 HydrophobicContact CE1-CG 3.85Å; F23-L27 HydrophobicContact CZ-CD1 3.94Å; F23-L27 HydrophobicContact CZ-CD2 4.41Å; F23-L27 HydrophobicContact CZ-CG 4.18Å; F23-L27 PolarHBondContact O-N 3.34Å; Y24-L27 PolarHBondContact O-N 3.3Å; L27-F29 PolarHBondContact O-N 3.3Å; L27-V30 PolarHBondContact O-N 3.45Å; L27-N31 WeakPolarHBondContact O-CB 3.45Å; L27-N31 PolarHBondContact O-N 3.45Å; L27-N31 PolarHBondContact O-ND2 3.01Å |
| 28 | F | 94.4 | Very high | 91.3 | Very high | 132 Ų | 132 | 102 Ų | 102 | 58% | 0.579 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -57.5 | -49.7 | 175.8 | 174.9 | -98.4 | 0 | 0 | 0 | 111.2 | Y24 L25 G26 V30 N31 V32 | Y24-F28 WeakPolarHBondContact O-CB 3.48Å; Y24-F28 PolarHBondContact O-N 3.25Å; L25-F28 WeakPolarHBondContact O-CB 3.43Å; L25-F28 PolarHBondContact O-N 3.26Å; G26-F28 VanDerWaalsContact C-N 3.33Å; G26-F28 PolarHBondContact O-N 2.88Å; F28-V30 PolarHBondContact O-N 3.45Å; F28-N31 PolarHBondContact O-N 2.94Å; F28-V32 HydrophobicContact CE1-CG2 4.11Å; F28-V32 HydrophobicContact CE2-CG2 4.2Å; F28-V32 HydrophobicContact CZ-CG2 3.94Å; F28-V32 WeakPolarHBondContact O-CG2 3.33Å; F28-V32 PolarHBondContact O-N 3.3Å |
| 29 | F | 95.9 | Very high | 91.9 | Very high | 128 Ų | 128 | 99.5 Ų | 99.5 | 56% | 0.561 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -60.9 | -45 | 177.5 | -82.3 | -67.8 | 0 | 0 | 0 | 112.5 | L25 G26 L27 N31 V32 L33 | L25-F29 HydrophobicContact CD1-CD2 4.3Å; L25-F29 HydrophobicContact CD1-CE2 3.81Å; L25-F29 HydrophobicContact CD2-CE2 4.32Å; L25-F29 HydrophobicContact CG-CD2 4.03Å; L25-F29 HydrophobicContact CG-CE2 3.75Å; L25-F29 WeakPolarHBondContact O-CD2 3.26Å; L25-F29 PolarHBondContact O-N 3.02Å; G26-F29 PolarHBondContact O-N 3.24Å; L27-F29 PolarHBondContact O-N 3.3Å; F29-N31 VanDerWaalsContact C-N 3.34Å; F29-N31 PolarHBondContact O-N 3.47Å; F29-V32 PolarHBondContact O-N 2.91Å; F29-L33 VanDerWaalsContact O-CB 3.29Å; F29-L33 WeakPolarHBondContact O-CB 3.16Å; F29-L33 PolarHBondContact O-N 3.35Å |
| 30 | V | 96.8 | Very high | 92.5 | Very high | 78 Ų | 78 | 99.5 Ų | 99.5 | 47% | 0.473 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.2 | -43 | 178.5 | 171.1 | 0 | 0 | 0 | 0 | 111.2 | G26 L27 F28 L33 I34 | G26-V30 WeakPolarHBondContact O-CG2 3.38Å; G26-V30 PolarHBondContact O-N 2.91Å; L27-V30 PolarHBondContact O-N 3.45Å; F28-V30 PolarHBondContact O-N 3.45Å; V30-L33 WeakPolarHBondContact O-CB 3.48Å; V30-L33 PolarHBondContact O-N 3.05Å; V30-I34 HydrophobicContact CG1-CD1 3.81Å; V30-I34 HydrophobicContact CG1-CG1 4.39Å; V30-I34 VanDerWaalsContact O-CG1 3.26Å; V30-I34 WeakPolarHBondContact O-CG1 3.29Å; V30-I34 PolarHBondContact O-N 3.32Å |
| 31 | N | 94.9 | Very high | 92.6 | Very high | 103 Ų | 103 | 100.9 Ų | 100.9 | 55% | 0.551 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -62.8 | -44.9 | 177.3 | -82.1 | -84.2 | 0 | 0 | 0 | 111.8 | L27 F28 F29 L33 I34 L35 | L27-N31 WeakPolarHBondContact O-CB 3.45Å; L27-N31 PolarHBondContact O-N 3.45Å; L27-N31 PolarHBondContact O-ND2 3.01Å; F28-N31 PolarHBondContact O-N 2.94Å; F29-N31 VanDerWaalsContact C-N 3.34Å; F29-N31 PolarHBondContact O-N 3.47Å; N31-L33 VanDerWaalsContact C-N 3.3Å; N31-L33 PolarHBondContact O-N 3.34Å; N31-I34 PolarHBondContact O-N 2.9Å; N31-L35 PolarHBondContact O-N 3.48Å |
| 32 | V | 97.5 | Very high | 92.6 | Very high | 72 Ų | 72 | 97.3 Ų | 97.3 | 44% | 0.436 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -62 | -40.6 | 174.9 | 173 | 0 | 0 | 0 | 0 | 111 | F28 F29 L35 Y36 | F28-V32 HydrophobicContact CE1-CG2 4.11Å; F28-V32 HydrophobicContact CE2-CG2 4.2Å; F28-V32 HydrophobicContact CZ-CG2 3.94Å; F28-V32 WeakPolarHBondContact O-CG2 3.33Å; F28-V32 PolarHBondContact O-N 3.3Å; F29-V32 PolarHBondContact O-N 2.91Å; V32-L35 PolarHBondContact O-N 3.26Å; V32-Y36 WeakPolarHBondContact O-CB 3.23Å; V32-Y36 PolarHBondContact O-N 2.89Å |
| 33 | L | 97.4 | Very high | 92.7 | Very high | 95 Ų | 95 | 97.2 Ų | 97.2 | 50% | 0.497 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -63.6 | -44.7 | 178.8 | -154.8 | 92 | 0 | 0 | 0 | 111.4 | F29 V30 N31 L35 Y36 Y37 | F29-L33 VanDerWaalsContact O-CB 3.29Å; F29-L33 WeakPolarHBondContact O-CB 3.16Å; F29-L33 PolarHBondContact O-N 3.35Å; V30-L33 WeakPolarHBondContact O-CB 3.48Å; V30-L33 PolarHBondContact O-N 3.05Å; N31-L33 VanDerWaalsContact C-N 3.3Å; N31-L33 PolarHBondContact O-N 3.34Å; L33-L35 VanDerWaalsContact C-N 3.33Å; L33-L35 PolarHBondContact O-N 3.49Å; L33-Y36 WeakPolarHBondContact O-CB 3.5Å; L33-Y36 PolarHBondContact O-N 3Å; L33-Y37 HydrophobicContact CD1-CE2 4.37Å; L33-Y37 HydrophobicContact CD2-CD2 4.13Å; L33-Y37 HydrophobicContact CD2-CE2 3.63Å; L33-Y37 HydrophobicContact CG-CD2 3.9Å; L33-Y37 HydrophobicContact CG-CE2 3.62Å; L33-Y37 WeakPolarHBondContact O-CD2 3.14Å; L33-Y37 PolarHBondContact O-N 3.44Å |
| 34 | I | 95.8 | Very high | 92.6 | Very high | 106 Ų | 106 | 96 Ų | 96 | 54% | 0.544 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -59.8 | -47.1 | 176.3 | -70.5 | 164.1 | 0 | 0 | 0 | 110 | V30 N31 Y36 Y37 A38 | V30-I34 HydrophobicContact CG1-CD1 3.81Å; V30-I34 HydrophobicContact CG1-CG1 4.39Å; V30-I34 VanDerWaalsContact O-CG1 3.26Å; V30-I34 WeakPolarHBondContact O-CG1 3.29Å; V30-I34 PolarHBondContact O-N 3.32Å; N31-I34 PolarHBondContact O-N 2.9Å; I34-Y36 PolarHBondContact O-N 3.25Å; I34-Y37 PolarHBondContact O-N 3.49Å; I34-A38 PolarHBondContact O-N 3.38Å |
| 35 | L | 95.8 | Very high | 92.3 | Very high | 102 Ų | 102 | 95.9 Ų | 95.9 | 53% | 0.534 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -61.2 | -45.7 | 178.3 | -175.2 | 63.1 | 0 | 0 | 0 | 111.4 | N31 V32 L33 Y37 A38 F39 | N31-L35 PolarHBondContact O-N 3.48Å; V32-L35 PolarHBondContact O-N 3.26Å; L33-L35 VanDerWaalsContact C-N 3.33Å; L33-L35 PolarHBondContact O-N 3.49Å; L35-Y37 VanDerWaalsContact C-N 3.34Å; L35-Y37 PolarHBondContact O-N 3.33Å; L35-A38 PolarHBondContact O-N 3.38Å; L35-F39 HydrophobicContact CD1-CD2 4.05Å; L35-F39 HydrophobicContact CD1-CE2 3.53Å; L35-F39 HydrophobicContact CD1-CZ 4.4Å; L35-F39 HydrophobicContact CD2-CE2 4.34Å; L35-F39 HydrophobicContact CG-CD2 4Å; L35-F39 HydrophobicContact CG-CE2 3.73Å; L35-F39 VanDerWaalsContact O-CD2 3.23Å; L35-F39 WeakPolarHBondContact O-CD2 3.37Å; L35-F39 PolarHBondContact O-N 2.83Å; L35-F39 VanDerWaalsContact O-N 3.1Å |
| 36 | Y | 96.6 | Very high | 91.8 | Very high | 137 Ų | 137 | 97 Ų | 97 | 54% | 0.537 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -57.4 | -45.9 | 175.1 | 170.8 | -100.7 | 0 | 0 | 0 | 111.8 | V32 L33 I34 F39 L40 | V32-Y36 WeakPolarHBondContact O-CB 3.23Å; V32-Y36 PolarHBondContact O-N 2.89Å; L33-Y36 WeakPolarHBondContact O-CB 3.5Å; L33-Y36 PolarHBondContact O-N 3Å; I34-Y36 PolarHBondContact O-N 3.25Å; Y36-F39 PolarHBondContact O-N 3.34Å; Y36-L40 HydrophobicContact CE1-CD1 3.71Å; Y36-L40 VanDerWaalsContact O-CB 3.32Å; Y36-L40 WeakPolarHBondContact O-CB 3.25Å; Y36-L40 PolarHBondContact O-N 3.47Å |
| 37 | Y | 95.4 | Very high | 91 | Very high | 122 Ų | 122 | 98.7 Ų | 98.7 | 48% | 0.478 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -67.8 | -34.1 | 178.3 | -81.4 | -62.9 | 0 | 0 | 0 | 113.2 | L33 I34 L35 L40 M41 | L33-Y37 HydrophobicContact CD1-CE2 4.37Å; L33-Y37 HydrophobicContact CD2-CD2 4.13Å; L33-Y37 HydrophobicContact CD2-CE2 3.63Å; L33-Y37 HydrophobicContact CG-CD2 3.9Å; L33-Y37 HydrophobicContact CG-CE2 3.62Å; L33-Y37 WeakPolarHBondContact O-CD2 3.14Å; L33-Y37 PolarHBondContact O-N 3.44Å; I34-Y37 PolarHBondContact O-N 3.49Å; L35-Y37 VanDerWaalsContact C-N 3.34Å; L35-Y37 PolarHBondContact O-N 3.33Å; Y37-L40 PolarHBondContact O-N 3.5Å; Y37-M41 WeakPolarHBondContact O-CB 3.29Å; Y37-M41 VanDerWaalsContact O-CG 3.31Å; Y37-M41 WeakPolarHBondContact O-CG 3.37Å; Y37-M41 PolarHBondContact O-N 3.22Å |
| 38 | A | 92.6 | Very high | 89.9 | Confident | 58 Ų | 58 | 98.5 Ų | 98.5 | 48% | 0.479 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61 | -48.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111 | I34 L35 L40 M41 E42 | I34-A38 PolarHBondContact O-N 3.38Å; L35-A38 PolarHBondContact O-N 3.38Å; A38-L40 VanDerWaalsContact C-N 3.35Å; A38-L40 PolarHBondContact O-N 3.1Å; A38-M41 PolarHBondContact O-N 2.87Å; A38-E42 PolarHBondContact O-N 3.35Å |
| 39 | F | 91.9 | Very high | 88.4 | Confident | 119 Ų | 119 | 94 Ų | 94 | 52% | 0.522 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -65.8 | -35.4 | 174.6 | -76.2 | -63.6 | 0 | 0 | 0 | 113 | L35 Y36 M41 E42 Y43 | L35-F39 HydrophobicContact CD1-CD2 4.05Å; L35-F39 HydrophobicContact CD1-CE2 3.53Å; L35-F39 HydrophobicContact CD1-CZ 4.4Å; L35-F39 HydrophobicContact CD2-CE2 4.34Å; L35-F39 HydrophobicContact CG-CD2 4Å; L35-F39 HydrophobicContact CG-CE2 3.73Å; L35-F39 VanDerWaalsContact O-CD2 3.23Å; L35-F39 WeakPolarHBondContact O-CD2 3.37Å; L35-F39 PolarHBondContact O-N 2.83Å; L35-F39 VanDerWaalsContact O-N 3.1Å; Y36-F39 PolarHBondContact O-N 3.34Å; F39-M41 VanDerWaalsContact C-N 3.35Å; F39-E42 PolarHBondContact O-N 3.32Å; F39-Y43 WeakPolarHBondContact O-CB 3.27Å; F39-Y43 PolarHBondContact O-N 3.46Å |
| 40 | L | 91.6 | Very high | 86.6 | Confident | 48 Ų | 48 | 93.1 Ų | 93.1 | 25% | 0.251 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -65.1 | -40.9 | 176.6 | -174.4 | 150.6 | 0 | 0 | 0 | 111.1 | Y36 Y37 A38 Y43 I44 | Y36-L40 HydrophobicContact CE1-CD1 3.71Å; Y36-L40 VanDerWaalsContact O-CB 3.32Å; Y36-L40 WeakPolarHBondContact O-CB 3.25Å; Y36-L40 PolarHBondContact O-N 3.47Å; Y37-L40 PolarHBondContact O-N 3.5Å; A38-L40 VanDerWaalsContact C-N 3.35Å; A38-L40 PolarHBondContact O-N 3.1Å; L40-Y43 PolarHBondContact O-N 3.47Å; L40-I44 HydrophobicContact CD2-CD1 3.48Å; L40-I44 VanDerWaalsContact CD2-CD1 3.48Å; L40-I44 HydrophobicContact CD2-CG1 4.32Å; L40-I44 HydrophobicContact CG-CD1 4.4Å; L40-I44 WeakPolarHBondContact O-CB 3.44Å; L40-I44 VanDerWaalsContact O-CG1 3.27Å; L40-I44 WeakPolarHBondContact O-CG1 3.42Å; L40-I44 PolarHBondContact O-N 2.78Å |
| 41 | M | 86.7 | Confident | 84.7 | Confident | 113 Ų | 113 | 95.1 Ų | 95.1 | 56% | 0.557 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -65.6 | -46.1 | 174.7 | -72.6 | -61.1 | -62.5 | 0 | 0 | 111.5 | Y37 A38 F39 Y43 I44 V45 | Y37-M41 WeakPolarHBondContact O-CB 3.29Å; Y37-M41 VanDerWaalsContact O-CG 3.31Å; Y37-M41 WeakPolarHBondContact O-CG 3.37Å; Y37-M41 PolarHBondContact O-N 3.22Å; A38-M41 PolarHBondContact O-N 2.87Å; F39-M41 VanDerWaalsContact C-N 3.35Å; M41-Y43 VanDerWaalsContact C-N 3.35Å; M41-Y43 PolarHBondContact O-N 3.44Å; M41-I44 PolarHBondContact O-N 3.44Å; M41-V45 WeakPolarHBondContact O-CB 3.32Å; M41-V45 VanDerWaalsContact O-CG2 3.25Å; M41-V45 WeakPolarHBondContact O-CG2 3.38Å; M41-V45 PolarHBondContact O-N 2.86Å |
| 42 | E | 84.3 | Confident | 82.6 | Confident | 104 Ų | 104 | 97.8 Ų | 97.8 | 49% | 0.486 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -59 | -46.3 | 173.8 | -179.3 | -179 | -167.4 | 0 | 0 | 111.2 | A38 F39 I44 V45 L46 | A38-E42 PolarHBondContact O-N 3.35Å; F39-E42 PolarHBondContact O-N 3.32Å; E42-I44 PolarHBondContact O-N 3.5Å; E42-V45 PolarHBondContact O-N 2.9Å; E42-L46 HydrophobicContact CG-CD1 3.82Å; E42-L46 HydrophobicContact CG-CG 4.24Å; E42-L46 WeakPolarHBondContact O-CB 3.31Å; E42-L46 VanDerWaalsContact O-CG 3.29Å; E42-L46 WeakPolarHBondContact O-CG 3.49Å; E42-L46 PolarHBondContact O-N 2.88Å |
| 43 | Y | 86.6 | Confident | 80.6 | Confident | 150 Ų | 150 | 98.4 Ų | 98.4 | 59% | 0.588 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -58.6 | -46.6 | 176.7 | 174.6 | -94.6 | 0 | 0 | 0 | 111.1 | F39 L40 M41 L46 N47 | F39-Y43 WeakPolarHBondContact O-CB 3.27Å; F39-Y43 PolarHBondContact O-N 3.46Å; L40-Y43 PolarHBondContact O-N 3.47Å; M41-Y43 VanDerWaalsContact C-N 3.35Å; M41-Y43 PolarHBondContact O-N 3.44Å; Y43-L46 PolarHBondContact O-N 3.22Å; Y43-N47 WeakPolarHBondContact CD2-ND2 3.5Å; Y43-N47 WeakPolarHBondContact CE2-ND2 3.46Å; Y43-N47 VanDerWaalsContact CZ-ND2 3.34Å; Y43-N47 VanDerWaalsContact O-CB 3.32Å; Y43-N47 WeakPolarHBondContact O-CB 3.43Å; Y43-N47 PolarHBondContact O-N 2.76Å; Y43-N47 PolarHBondContact O-ND2 2.85Å |
| 44 | I | 84.9 | Confident | 78.5 | Confident | 77 Ų | 77 | 97.1 Ų | 97.1 | 40% | 0.395 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63 | -46.6 | 176.1 | -70.3 | 172.6 | 0 | 0 | 0 | 110.5 | L40 M41 E42 L46 N47 V48 | L40-I44 HydrophobicContact CD2-CD1 3.48Å; L40-I44 VanDerWaalsContact CD2-CD1 3.48Å; L40-I44 HydrophobicContact CD2-CG1 4.32Å; L40-I44 HydrophobicContact CG-CD1 4.4Å; L40-I44 WeakPolarHBondContact O-CB 3.44Å; L40-I44 VanDerWaalsContact O-CG1 3.27Å; L40-I44 WeakPolarHBondContact O-CG1 3.42Å; L40-I44 PolarHBondContact O-N 2.78Å; M41-I44 PolarHBondContact O-N 3.44Å; E42-I44 PolarHBondContact O-N 3.5Å; I44-L46 VanDerWaalsContact C-N 3.31Å; I44-L46 PolarHBondContact O-N 3.18Å; I44-N47 PolarHBondContact O-N 3.32Å; I44-V48 HydrophobicContact CG2-CG2 3.9Å; I44-V48 WeakPolarHBondContact O-CB 3.47Å; I44-V48 VanDerWaalsContact O-CG2 3.22Å; I44-V48 WeakPolarHBondContact O-CG2 3.49Å; I44-V48 PolarHBondContact O-N 3.32Å |
| 45 | V | 81.8 | Confident | 76.5 | Confident | 94 Ų | 94 | 100.4 Ų | 100.4 | 57% | 0.57 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -61.6 | -39.9 | 179.6 | 169 | 0 | 0 | 0 | 0 | 111.4 | M41 E42 G49 | M41-V45 WeakPolarHBondContact O-CB 3.32Å; M41-V45 VanDerWaalsContact O-CG2 3.25Å; M41-V45 WeakPolarHBondContact O-CG2 3.38Å; M41-V45 PolarHBondContact O-N 2.86Å; E42-V45 PolarHBondContact O-N 2.9Å; V45-G49 WeakPolarHBondContact O-CA 3.43Å; V45-G49 PolarHBondContact O-N 3.02Å |
| 46 | L | 81.4 | Confident | 74.5 | Confident | 91 Ų | 91 | 100.9 Ų | 100.9 | 48% | 0.476 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -71.4 | -44.5 | 176.6 | -70.8 | 175.2 | 0 | 0 | 0 | 111.6 | E42 Y43 I44 G49 I50 | E42-L46 HydrophobicContact CG-CD1 3.82Å; E42-L46 HydrophobicContact CG-CG 4.24Å; E42-L46 WeakPolarHBondContact O-CB 3.31Å; E42-L46 VanDerWaalsContact O-CG 3.29Å; E42-L46 WeakPolarHBondContact O-CG 3.49Å; E42-L46 PolarHBondContact O-N 2.88Å; Y43-L46 PolarHBondContact O-N 3.22Å; I44-L46 VanDerWaalsContact C-N 3.31Å; I44-L46 PolarHBondContact O-N 3.18Å; L46-G49 PolarHBondContact O-N 3.46Å; L46-I50 WeakPolarHBondContact O-CB 3.13Å; L46-I50 VanDerWaalsContact O-CD1 3.31Å; L46-I50 WeakPolarHBondContact O-CD1 3.32Å; L46-I50 WeakPolarHBondContact O-CG1 3.5Å; L46-I50 PolarHBondContact O-N 2.94Å |
| 47 | N | 75.9 | Confident | 72.5 | Confident | 67 Ų | 67 | 99.3 Ų | 99.3 | 36% | 0.358 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -70.8 | -41.3 | -179.4 | -76.8 | -97.2 | 0 | 0 | 0 | 111.6 | Y43 I44 V51 | Y43-N47 WeakPolarHBondContact CD2-ND2 3.5Å; Y43-N47 WeakPolarHBondContact CE2-ND2 3.46Å; Y43-N47 VanDerWaalsContact CZ-ND2 3.34Å; Y43-N47 VanDerWaalsContact O-CB 3.32Å; Y43-N47 WeakPolarHBondContact O-CB 3.43Å; Y43-N47 PolarHBondContact O-N 2.76Å; Y43-N47 PolarHBondContact O-ND2 2.85Å; I44-N47 PolarHBondContact O-N 3.32Å; N47-V51 VanDerWaalsContact O-CB 3.3Å; N47-V51 WeakPolarHBondContact O-CB 3.31Å; N47-V51 WeakPolarHBondContact O-CG2 3.06Å; N47-V51 PolarHBondContact O-N 3.02Å |
| 48 | V | 69.6 | Low | 70.7 | Confident | 72 Ų | 72 | 99 Ų | 99 | 44% | 0.436 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -68.5 | -43.1 | 172.6 | 175.1 | 0 | 0 | 0 | 0 | 109.9 | I44 I50 V51 F52 | I44-V48 HydrophobicContact CG2-CG2 3.9Å; I44-V48 WeakPolarHBondContact O-CB 3.47Å; I44-V48 VanDerWaalsContact O-CG2 3.22Å; I44-V48 WeakPolarHBondContact O-CG2 3.49Å; I44-V48 PolarHBondContact O-N 3.32Å; V48-I50 VanDerWaalsContact C-N 3.32Å; V48-I50 PolarHBondContact O-N 3.07Å; V48-V51 CarbonylContact O-C 3.58Å; V48-V51 PolarHBondContact O-N 3.36Å; V48-F52 HydrophobicContact CG1-CD2 3.56Å; V48-F52 HydrophobicContact CG1-CE2 3.96Å; V48-F52 VanDerWaalsContact O-CB 3.26Å; V48-F52 WeakPolarHBondContact O-CB 3.19Å; V48-F52 WeakPolarHBondContact O-CD2 3.17Å; V48-F52 PolarHBondContact O-N 3.18Å |
| 49 | G | 62.5 | Low | 68.8 | Low | 37 Ų | 37 | 102.7 Ų | 102.7 | 38% | 0.381 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -65.7 | -30.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | V45 L46 F52 L53 | V45-G49 WeakPolarHBondContact O-CA 3.43Å; V45-G49 PolarHBondContact O-N 3.02Å; L46-G49 PolarHBondContact O-N 3.46Å; G49-F52 CarbonylContact O-C 3.56Å; G49-L53 WeakPolarHBondContact O-CA 3.21Å; G49-L53 WeakPolarHBondContact O-CG 3.22Å; G49-L53 PolarHBondContact O-N 3.44Å |
| 50 | I | 59.4 | Low | 67.1 | Low | 111 Ų | 111 | 100 Ų | 100 | 57% | 0.569 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -77.2 | -39 | 171.4 | -70.8 | 163.9 | 0 | 0 | 0 | 110.9 | L46 V48 F52 L53 | L46-I50 WeakPolarHBondContact O-CB 3.13Å; L46-I50 VanDerWaalsContact O-CD1 3.31Å; L46-I50 WeakPolarHBondContact O-CD1 3.32Å; L46-I50 WeakPolarHBondContact O-CG1 3.5Å; L46-I50 PolarHBondContact O-N 2.94Å; V48-I50 VanDerWaalsContact C-N 3.32Å; V48-I50 PolarHBondContact O-N 3.07Å; I50-F52 VanDerWaalsContact C-N 3.32Å; I50-L53 PolarHBondContact O-N 2.96Å |
| 51 | V | 55.6 | Low | 65.4 | Low | 120 Ų | 120 | 102.8 Ų | 102.8 | 73% | 0.727 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -72.1 | -27 | 176.6 | 169.4 | 0 | 0 | 0 | 0 | 112.2 | N47 V48 | N47-V51 VanDerWaalsContact O-CB 3.3Å; N47-V51 WeakPolarHBondContact O-CB 3.31Å; N47-V51 WeakPolarHBondContact O-CG2 3.06Å; N47-V51 PolarHBondContact O-N 3.02Å; V48-V51 CarbonylContact O-C 3.58Å; V48-V51 PolarHBondContact O-N 3.36Å |
| 52 | F | 51.2 | Low | 64 | Low | 158 Ų | 158 | 102 Ų | 102 | 69% | 0.693 | 54% | 0.543 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105.2 | 12.7 | 175.2 | -79.4 | -87.5 | 0 | 0 | 0 | 112.9 | V48 G49 I50 P54 | V48-F52 HydrophobicContact CG1-CD2 3.56Å; V48-F52 HydrophobicContact CG1-CE2 3.96Å; V48-F52 VanDerWaalsContact O-CB 3.26Å; V48-F52 WeakPolarHBondContact O-CB 3.19Å; V48-F52 WeakPolarHBondContact O-CD2 3.17Å; V48-F52 PolarHBondContact O-N 3.18Å; G49-F52 CarbonylContact O-C 3.56Å; I50-F52 VanDerWaalsContact C-N 3.32Å; F52-P54 WeakPolarHBondContact O-CD 2.97Å |
| 53 | L | 54.6 | Low | 62.6 | Low | 85 Ų | 85 | 102.3 Ų | 102.3 | 45% | 0.445 | 55% | 0.549 | S | S | . | . | trans | -53.3 | 112.9 | 167.9 | -108.7 | 164.9 | 0 | 0 | 0 | 105.5 | G49 I50 E55 M57 | G49-L53 WeakPolarHBondContact O-CA 3.21Å; G49-L53 WeakPolarHBondContact O-CG 3.22Å; G49-L53 PolarHBondContact O-N 3.44Å; I50-L53 PolarHBondContact O-N 2.96Å; L53-E55 PolarHBondContact O-N 3.38Å; L53-M57 HydrophobicContact CD2-CB 4.23Å; L53-M57 HydrophobicContact CD2-CE 4.46Å; L53-M57 HydrophobicContact CD2-CG 4.32Å; L53-M57 HydrophobicContact CD2-SD 3.46Å; L53-M57 WeakPolarHBondContact CD2-SD 3.32Å | ||
| 54 | P | 53.8 | Low | 61.1 | Low | 69 Ų | 69 | 100.5 Ų | 100.5 | 45% | 0.448 | 55% | 0.548 | S | S | . | . | trans | -66 | 136.3 | -177 | 26.8 | -30.8 | 0 | 0 | 0 | 106.1 | F52 D56 M57 | F52-P54 WeakPolarHBondContact O-CD 2.97Å; P54-D56 HydrophobicContact CB-CB 4.03Å; P54-D56 HydrophobicContact CG-CB 4.35Å; P54-D56 PolarHBondContact O-N 2.91Å; P54-M57 PolarHBondContact O-N 3.44Å | ||
| 55 | E | 54.9 | Low | 59.7 | Low | 175 Ų | 175 | 99 Ų | 99 | 82% | 0.818 | 55% | 0.551 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -49 | -10.3 | 167.8 | -65.7 | 156.3 | 164.8 | 0 | 0 | 111.8 | L53 | L53-E55 PolarHBondContact O-N 3.38Š|
| 56 | D | 53.6 | Low | 58.3 | Low | 111 Ų | 111 | 99.2 Ų | 99.2 | 59% | 0.594 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -72.8 | -17 | 172.2 | -53.9 | -35 | 0 | 0 | 0 | 115.4 | P54 Q59 A60 | P54-D56 HydrophobicContact CB-CB 4.03Å; P54-D56 HydrophobicContact CG-CB 4.35Å; P54-D56 PolarHBondContact O-N 2.91Å; D56-Q59 WeakPolarHBondContact O-CB 3.04Å; D56-Q59 PolarHBondContact O-N 3.34Å; D56-A60 PolarHBondContact O-N 3.1Å |
| 57 | M | 53.3 | Low | 56.7 | Low | 105 Ų | 105 | 101.8 Ų | 101.8 | 52% | 0.517 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -73.8 | -30.6 | 173 | -118.4 | -169.5 | 74.4 | 0 | 0 | 111.8 | L53 P54 Q59 A60 L61 | L53-M57 HydrophobicContact CD2-CB 4.23Å; L53-M57 HydrophobicContact CD2-CE 4.46Å; L53-M57 HydrophobicContact CD2-CG 4.32Å; L53-M57 HydrophobicContact CD2-SD 3.46Å; L53-M57 WeakPolarHBondContact CD2-SD 3.32Å; P54-M57 PolarHBondContact O-N 3.44Å; M57-Q59 VanDerWaalsContact C-N 3.28Å; M57-A60 PolarHBondContact O-N 2.91Å; M57-L61 WeakPolarHBondContact O-CG 3.13Å; M57-L61 PolarHBondContact O-N 2.78Å; M57-L61 VanDerWaalsContact O-N 3.1Å |
| 58 | D | 57.4 | Low | 55.4 | Low | 116 Ų | 116 | 102.7 Ų | 102.7 | 62% | 0.62 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -65 | -37.4 | 169 | -69.6 | -22.8 | 0 | 0 | 0 | 110.1 | L61 V62 | D58-L61 PolarHBondContact O-N 3.41Å; D58-V62 VanDerWaalsContact O-CG2 3.25Å; D58-V62 WeakPolarHBondContact O-CG2 3.26Å; D58-V62 PolarHBondContact O-N 3.46Å |
| 59 | Q | 53.9 | Low | 54.3 | Low | 134 Ų | 134 | 106 Ų | 106 | 63% | 0.626 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -68.9 | -36.7 | 177.1 | -160.9 | 126.8 | -3.3 | 0 | 0 | 113 | D56 M57 V62 D63 | D56-Q59 WeakPolarHBondContact O-CB 3.04Å; D56-Q59 PolarHBondContact O-N 3.34Å; M57-Q59 VanDerWaalsContact C-N 3.28Å; Q59-V62 PolarHBondContact O-N 2.73Å; Q59-D63 PolarHBondContact O-N 3.41Å |
| 60 | A | 57.1 | Low | 53.7 | Low | 63 Ų | 63 | 108.7 Ų | 108.7 | 52% | 0.521 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -68.4 | -33.5 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | D56 M57 L64 | D56-A60 PolarHBondContact O-N 3.1Å; M57-A60 PolarHBondContact O-N 2.91Å; A60-L64 WeakPolarHBondContact O-CB 3.25Å; A60-L64 PolarHBondContact O-N 3.42Å |
| 61 | L | 55.1 | Low | 53.4 | Low | 107 Ų | 107 | 108.5 Ų | 108.5 | 56% | 0.56 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -72.5 | -34.8 | 172.4 | -76.4 | 167.6 | 0 | 0 | 0 | 112.3 | M57 D58 G65 | M57-L61 WeakPolarHBondContact O-CG 3.13Å; M57-L61 PolarHBondContact O-N 2.78Å; M57-L61 VanDerWaalsContact O-N 3.1Å; D58-L61 PolarHBondContact O-N 3.41Å; L61-G65 PolarHBondContact O-N 2.73Å |
| 62 | V | 57.6 | Low | 53.1 | Low | 95 Ų | 95 | 107.1 Ų | 107.1 | 58% | 0.576 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -65.2 | -46.6 | 172.2 | 168.2 | 0 | 0 | 0 | 0 | 111.1 | D58 Q59 L64 G65 V66 | D58-V62 VanDerWaalsContact O-CG2 3.25Å; D58-V62 WeakPolarHBondContact O-CG2 3.26Å; D58-V62 PolarHBondContact O-N 3.46Å; Q59-V62 PolarHBondContact O-N 2.73Å; V62-L64 VanDerWaalsContact C-N 3.28Å; V62-L64 PolarHBondContact O-N 2.76Å; V62-G65 CarbonylContact O-C 3.55Å; V62-G65 WeakPolarHBondContact O-CA 3.16Å; V62-G65 PolarHBondContact O-N 2.83Å; V62-V66 VanDerWaalsContact O-CG2 3.32Å; V62-V66 WeakPolarHBondContact O-CG2 3.36Å; V62-V66 PolarHBondContact O-N 2.79Å |
| 63 | D | 54.8 | Low | 52.8 | Low | 112 Ų | 112 | 106.1 Ų | 106.1 | 60% | 0.599 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -65.3 | -30.5 | 178.4 | -114.6 | 8.9 | 0 | 0 | 0 | 112.7 | Q59 V66 | Q59-D63 PolarHBondContact O-N 3.41Å; D63-V66 PolarHBondContact O-N 2.93Å |
| 64 | L | 54.7 | Low | 52.4 | Low | 111 Ų | 111 | 106.6 Ų | 106.6 | 58% | 0.581 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -73.5 | -32.7 | 172.3 | -164.8 | 67.6 | 0 | 0 | 0 | 112.2 | A60 V62 V66 L67 S68 | A60-L64 WeakPolarHBondContact O-CB 3.25Å; A60-L64 PolarHBondContact O-N 3.42Å; V62-L64 VanDerWaalsContact C-N 3.28Å; V62-L64 PolarHBondContact O-N 2.76Å; L64-V66 VanDerWaalsContact C-N 3.34Å; L64-L67 PolarHBondContact O-N 3.34Å; L64-S68 PolarHBondContact O-OG 2.69Å |
| 65 | G | 55 | Low | 51.6 | Low | 45 Ų | 45 | 113.1 Ų | 113.1 | 46% | 0.464 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -68.2 | -29.1 | 170.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | L61 V62 L67 S68 | L61-G65 PolarHBondContact O-N 2.73Å; V62-G65 CarbonylContact O-C 3.55Å; V62-G65 WeakPolarHBondContact O-CA 3.16Å; V62-G65 PolarHBondContact O-N 2.83Å; G65-L67 VanDerWaalsContact C-N 3.34Å; G65-S68 WeakPolarHBondContact O-CB 3.14Å; G65-S68 PolarHBondContact O-N 2.75Å |
| 66 | V | 52.3 | Low | 51.3 | Low | 100 Ų | 100 | 112 Ų | 112 | 61% | 0.606 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -71.5 | -25.7 | 175.7 | 173 | 0 | 0 | 0 | 0 | 112.5 | V62 D63 L64 S68 | V62-V66 VanDerWaalsContact O-CG2 3.32Å; V62-V66 WeakPolarHBondContact O-CG2 3.36Å; V62-V66 PolarHBondContact O-N 2.79Å; D63-V66 PolarHBondContact O-N 2.93Å; L64-V66 VanDerWaalsContact C-N 3.34Å; V66-S68 PolarHBondContact O-N 3.34Å |
| 67 | L | 48.4 | Very low | 50.9 | Low | 145 Ų | 145 | 113.3 Ų | 113.3 | 76% | 0.759 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78 | -7.6 | 171.7 | -66.7 | 176.3 | 0 | 0 | 0 | 113.4 | L64 G65 D69 | L64-L67 PolarHBondContact O-N 3.34Å; G65-L67 VanDerWaalsContact C-N 3.34Å; L67-D69 VanDerWaalsContact C-N 3.32Å; L67-D69 PolarHBondContact O-N 3.44Å |
| 68 | S | 48.9 | Very low | 50.3 | Low | 86 Ų | 86 | 115.1 Ų | 115.1 | 60% | 0.601 | 67% | 0.67 | S | S | * | * | trans | -93.8 | 63.6 | 174 | -50.4 | 0 | 0 | 0 | 0 | 109.1 | L64 G65 V66 P70 | L64-S68 PolarHBondContact O-OG 2.69Å; G65-S68 WeakPolarHBondContact O-CB 3.14Å; G65-S68 PolarHBondContact O-N 2.75Å; V66-S68 PolarHBondContact O-N 3.34Å; S68-P70 VanDerWaalsContact C-CD 3.46Å; S68-P70 WeakPolarHBondContact O-CD 3.3Å | ||
| 69 | D | 47 | Very low | 49.9 | Very low | 141 Ų | 141 | 114.1 Ų | 114.1 | 75% | 0.754 | 67% | 0.67 | S | S | * | * | trans | -90.7 | 93 | 166 | -166.5 | 15.2 | 0 | 0 | 0 | 107.8 | L67 A71 | L67-D69 VanDerWaalsContact C-N 3.32Å; L67-D69 PolarHBondContact O-N 3.44Å; D69-A71 PolarHBondContact O-N 2.94Å | ||
| 70 | P | 48.5 | Very low | 49.7 | Very low | 94 Ų | 94 | 116.7 Ų | 116.7 | 61% | 0.61 | 68% | 0.682 | S | S | * | * | trans | -77.4 | 104.8 | 165.6 | 33.2 | -31.1 | 0 | 0 | 0 | 106.2 | S68 S72 | S68-P70 VanDerWaalsContact C-CD 3.46Å; S68-P70 WeakPolarHBondContact O-CD 3.3Å; P70-S72 PolarHBondContact O-N 3.23Å | ||
| 71 | A | 52.9 | Low | 49.5 | Very low | 107 Ų | 107 | 120.8 Ų | 120.8 | 88% | 0.884 | 69% | 0.694 | S | S | * | * | trans | -62.1 | 62.8 | 158.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | D69 | D69-A71 PolarHBondContact O-N 2.94Š| ||
| 72 | S | 50.3 | Low | 49.3 | Very low | 90 Ų | 90 | 122.6 Ų | 122.6 | 63% | 0.629 | 71% | 0.705 | S | S | * | * | trans | -146 | 81.1 | 175.2 | 67.2 | 0 | 0 | 0 | 0 | 110.8 | P70 | P70-S72 PolarHBondContact O-N 3.23Š| ||
| 73 | V | 44.9 | Very low | 49.2 | Very low | 138 Ų | 138 | 124.1 Ų | 124.1 | 84% | 0.836 | 71% | 0.714 | S | S | * | * | trans | -49 | 148.6 | 145.1 | 175.2 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 74 | P | 45.3 | Very low | 49.2 | Very low | 94 Ų | 94 | 128.3 Ų | 128.3 | 61% | 0.61 | 73% | 0.727 | S | S | * | * | cis | -129 | 159.6 | 22.8 | 22.1 | 3.8 | 0 | 0 | 0 | 113.4 | ||||
| 75 | Y | 37.4 | Very low | 49.2 | Very low | 207 Ų | 207 | 131.8 Ų | 131.8 | 81% | 0.812 | 74% | 0.74 | S | S | * | * | -168.3 | 139.2 | 73.3 | -101.9 | -90.1 | 0 | 0 | 0 | 108.6 | T77 | Y75-T77 PolarHBondContact O-N 3.14Å; Y75-T77 VanDerWaalsContact O-N 3.14Å | |||
| 76 | D | 49.8 | Very low | 49.3 | Very low | 152 Ų | 152 | 133 Ų | 133 | 81% | 0.813 | 75% | 0.753 | S | S | * | * | trans | -50.2 | 115.4 | 167.3 | -64.5 | -56 | 0 | 0 | 0 | 110.1 | ||||
| 77 | T | 43.5 | Very low | 49.5 | Very low | 138 Ų | 138 | 138.7 Ų | 138.7 | 85% | 0.847 | 77% | 0.765 | S | S | * | * | trans | -115.6 | 85.7 | 157.5 | -27.1 | 0 | 0 | 0 | 0 | 106.4 | Y75 | Y75-T77 PolarHBondContact O-N 3.14Å; Y75-T77 VanDerWaalsContact O-N 3.14Å | ||
| 78 | D | 42.3 | Very low | 49.8 | Very low | 143 Ų | 143 | 139.9 Ų | 139.9 | 77% | 0.765 | 77% | 0.771 | S | S | * | * | trans | -58.7 | 155.2 | 166.6 | -99.1 | -33.1 | 0 | 0 | 0 | 110.6 | ||||
| 79 | P | 47.7 | Very low | 49.6 | Very low | 94 Ų | 94 | 148.5 Ų | 148.5 | 61% | 0.61 | 80% | 0.802 | S | S | * | * | trans | -84.4 | 154.6 | -140.5 | 32.3 | -37.5 | 0 | 0 | 0 | 115.3 | L81 | P79-L81 VanDerWaalsContact C-N 3.3Å; P79-L81 PolarHBondContact O-N 2.8Å | ||
| 80 | E | 50.8 | Low | 49.7 | Very low | 188 Ų | 188 | 148.9 Ų | 148.9 | 88% | 0.879 | 80% | 0.804 | S | S | * | * | S | Bend | trans | -56 | 75.3 | 170 | -62.2 | 176.2 | 135.3 | 0 | 0 | 113.7 | ||
| 81 | L | 52.6 | Low | 49.8 | Very low | 150 Ų | 150 | 151.7 Ų | 151.7 | 79% | 0.785 | 82% | 0.815 | S | S | * | * | trans | -135.7 | 38.6 | 173.7 | -76.1 | -177 | 0 | 0 | 0 | 114.5 | P79 | P79-L81 VanDerWaalsContact C-N 3.3Å; P79-L81 PolarHBondContact O-N 2.8Å | ||
| 82 | D | 49.8 | Very low | 49.6 | Very low | 145 Ų | 145 | 154.2 Ų | 154.2 | 78% | 0.775 | 81% | 0.811 | S | S | * | * | trans | -142.1 | 30.1 | 170.8 | -100.6 | -15.7 | 0 | 0 | 0 | 114.1 | ||||
| 83 | V | 56.7 | Low | 49.5 | Very low | 126 Ų | 126 | 158 Ų | 158 | 76% | 0.764 | 82% | 0.821 | S | S | * | * | S | Bend | trans | -90.6 | -0.3 | -179.6 | 178.2 | 0 | 0 | 0 | 0 | 113.4 | ||
| 84 | F | 53.7 | Low | 49.8 | Very low | 200 Ų | 200 | 159.3 Ų | 159.3 | 88% | 0.877 | 82% | 0.82 | S | S | * | * | S | Bend | trans | -115.9 | 12.6 | -172.4 | -113.6 | -84.6 | 0 | 0 | 0 | 117 | ||
| 85 | E | 55.9 | Low | 50.1 | Low | 184 Ų | 184 | 163.6 Ų | 163.6 | 86% | 0.86 | 83% | 0.834 | S | S | * | * | S | Bend | trans | -124.3 | 51.9 | -178 | -152.6 | 167.7 | -145.8 | 0 | 0 | 113.1 | ||
| 86 | G | 55.9 | Low | 51 | Low | 71 Ų | 71 | 160.5 Ų | 160.5 | 73% | 0.732 | 84% | 0.836 | S | S | * | * | trans | -150.3 | 17.4 | -179.6 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 87 | Y | 57 | Low | 51.1 | Low | 219 Ų | 219 | 161.2 Ų | 161.2 | 86% | 0.859 | 84% | 0.838 | S | S | * | * | S | Bend | trans | -101.8 | 18.8 | -179.4 | -85.9 | -73.5 | 0 | 0 | 0 | 114.4 | ||
| 88 | L | 55.5 | Low | 51.8 | Low | 171 Ų | 171 | 163.1 Ų | 163.1 | 90% | 0.895 | 84% | 0.837 | S | S | * | * | trans | -145.5 | 73.1 | 179.1 | -131.9 | 173.4 | 0 | 0 | 0 | 113.1 | ||||
| 89 | E | 43.5 | Very low | 52.6 | Low | 266 Ų | 266 | 164.9 Ų | 164.9 | 100% | 1.243 | 84% | 0.844 | S | S | * | * | trans | -146.4 | 0 | 141.2 | -160.8 | 156 | -165.2 | 0 | 0 | 111 |
Retrieved 89 of 89 residues in 97.2 ms
(Link to these results)