| 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 | 48.2 | Very low | 65.9 | Low | 205 Ų | 205 | 118.6 Ų | 118.6 | 100% | 1.01 | 60% | 0.604 | S | S | * | * | 0 | -24.4 | 0 | -86.3 | 176 | 155.2 | 0 | 0 | 115.2 | |||||
| 2 | Y | 51.1 | Low | 66.9 | Low | 212 Ų | 212 | 117.9 Ų | 117.9 | 83% | 0.831 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -67.5 | -35 | -178.8 | -95.5 | -95.8 | 0 | 0 | 0 | 115 | I4 K5 H6 | Y2-I4 PolarHBondContact O-N 3.33Å; Y2-K5 PolarHBondContact O-N 3.27Å; Y2-H6 PolarHBondContact O-N 3.25Å |
| 3 | G | 55.6 | Low | 67.7 | Low | 50 Ų | 50 | 113 Ų | 113 | 52% | 0.515 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -64.3 | -37.9 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | H6 Q7 | G3-H6 PolarHBondContact O-N 3.02Å; G3-Q7 WeakPolarHBondContact O-CG 3.17Å; G3-Q7 PolarHBondContact O-N 3.34Å |
| 4 | I | 65.6 | Low | 68.6 | Low | 114 Ų | 114 | 111.6 Ų | 111.6 | 59% | 0.585 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -67 | -43.2 | -179.1 | -57.7 | 172 | 0 | 0 | 0 | 110.4 | Y2 H6 Q7 V8 | Y2-I4 PolarHBondContact O-N 3.33Å; I4-H6 VanDerWaalsContact C-N 3.33Å; I4-H6 PolarHBondContact O-N 2.84Å; I4-Q7 PolarHBondContact O-N 3.47Å; I4-V8 HydrophobicContact CG2-CG2 4.25Å; I4-V8 WeakPolarHBondContact O-CB 3.43Å; I4-V8 VanDerWaalsContact O-CG2 3.23Å; I4-V8 WeakPolarHBondContact O-CG2 3Å; I4-V8 PolarHBondContact O-N 2.99Å |
| 5 | K | 65.5 | Low | 69.3 | Low | 149 Ų | 149 | 110 Ų | 110 | 65% | 0.648 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -60.5 | -43.2 | 177.7 | -69.2 | -173.3 | 177.4 | -175.4 | 0 | 111.4 | Y2 V8 I9 | Y2-K5 PolarHBondContact O-N 3.27Å; K5-V8 PolarHBondContact O-N 3.29Å; K5-I9 WeakPolarHBondContact O-CB 3.36Å; K5-I9 WeakPolarHBondContact O-CD1 3.34Å; K5-I9 WeakPolarHBondContact O-CG1 3.28Å; K5-I9 PolarHBondContact O-N 2.76Å |
| 6 | H | 64.9 | Low | 70 | Confident | 122 Ų | 122 | 109.3 Ų | 109.3 | 57% | 0.565 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -68.2 | -38.2 | 179.9 | -150.9 | -96.5 | 0 | 0 | 0 | 112.3 | Y2 G3 I4 G10 | Y2-H6 PolarHBondContact O-N 3.25Å; G3-H6 PolarHBondContact O-N 3.02Å; I4-H6 VanDerWaalsContact C-N 3.33Å; I4-H6 PolarHBondContact O-N 2.84Å; H6-G10 PolarHBondContact O-N 2.82Å |
| 7 | Q | 72.1 | Confident | 70.7 | Confident | 145 Ų | 145 | 108.2 Ų | 108.2 | 68% | 0.678 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -64.8 | -43 | 173.3 | -75.1 | 179.3 | -47.3 | 0 | 0 | 112.2 | G3 I4 G10 L11 | G3-Q7 WeakPolarHBondContact O-CG 3.17Å; G3-Q7 PolarHBondContact O-N 3.34Å; I4-Q7 PolarHBondContact O-N 3.47Å; Q7-G10 PolarHBondContact O-N 3.18Å; Q7-L11 WeakPolarHBondContact O-CB 3.17Å; Q7-L11 PolarHBondContact O-N 3.5Å |
| 8 | V | 72.9 | Confident | 71 | Confident | 76 Ų | 76 | 107.7 Ų | 107.7 | 46% | 0.461 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -63.6 | -43.7 | 177.3 | 171.8 | 0 | 0 | 0 | 0 | 111 | I4 K5 L11 L12 | I4-V8 HydrophobicContact CG2-CG2 4.25Å; I4-V8 WeakPolarHBondContact O-CB 3.43Å; I4-V8 VanDerWaalsContact O-CG2 3.23Å; I4-V8 WeakPolarHBondContact O-CG2 3Å; I4-V8 PolarHBondContact O-N 2.99Å; K5-V8 PolarHBondContact O-N 3.29Å; V8-L11 PolarHBondContact O-N 3.42Å; V8-L12 HydrophobicContact CG1-CD1 3.91Å; V8-L12 WeakPolarHBondContact O-CB 3.19Å; V8-L12 WeakPolarHBondContact O-CG 3.41Å; V8-L12 PolarHBondContact O-N 3.45Å |
| 9 | I | 76.2 | Confident | 71.6 | Confident | 93 Ų | 93 | 109.4 Ų | 109.4 | 48% | 0.477 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -62.4 | -46.2 | 175.7 | -67.5 | 162.4 | 0 | 0 | 0 | 110.3 | K5 L11 L12 I13 | K5-I9 WeakPolarHBondContact O-CB 3.36Å; K5-I9 WeakPolarHBondContact O-CD1 3.34Å; K5-I9 WeakPolarHBondContact O-CG1 3.28Å; K5-I9 PolarHBondContact O-N 2.76Å; I9-L11 VanDerWaalsContact C-N 3.32Å; I9-L11 PolarHBondContact O-N 3.3Å; I9-L12 PolarHBondContact O-N 3.15Å; I9-I13 HydrophobicContact CG2-CD1 3.62Å; I9-I13 HydrophobicContact CG2-CG1 4.39Å; I9-I13 WeakPolarHBondContact O-CB 3.36Å; I9-I13 WeakPolarHBondContact O-CD1 3.15Å; I9-I13 WeakPolarHBondContact O-CG1 3.49Å; I9-I13 PolarHBondContact O-N 2.8Å |
| 10 | G | 76.5 | Confident | 71.9 | Confident | 29 Ų | 29 | 105.2 Ų | 105.2 | 30% | 0.299 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -59.8 | -40.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113 | H6 Q7 I13 N14 | H6-G10 PolarHBondContact O-N 2.82Å; Q7-G10 PolarHBondContact O-N 3.18Å; G10-I13 PolarHBondContact O-N 3.32Å; G10-N14 WeakPolarHBondContact O-CB 3.3Å; G10-N14 VanDerWaalsContact O-CG 3.3Å; G10-N14 PolarHBondContact O-N 2.75Å |
| 11 | L | 76.4 | Confident | 72.3 | Confident | 110 Ų | 110 | 106 Ų | 106 | 58% | 0.576 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -66.8 | -44.7 | 176.8 | -164.6 | 81 | 0 | 0 | 0 | 111.8 | Q7 V8 I9 I13 N14 N15 | Q7-L11 WeakPolarHBondContact O-CB 3.17Å; Q7-L11 PolarHBondContact O-N 3.5Å; V8-L11 PolarHBondContact O-N 3.42Å; I9-L11 VanDerWaalsContact C-N 3.32Å; I9-L11 PolarHBondContact O-N 3.3Å; L11-I13 VanDerWaalsContact C-N 3.3Å; L11-I13 PolarHBondContact O-N 2.79Å; L11-N14 PolarHBondContact O-N 2.95Å; L11-N15 WeakPolarHBondContact O-CB 3.38Å; L11-N15 VanDerWaalsContact O-CG 3.25Å; L11-N15 PolarHBondContact O-N 3.32Å |
| 12 | L | 77.8 | Confident | 73.6 | Confident | 110 Ų | 110 | 100.9 Ų | 100.9 | 58% | 0.576 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -59.8 | -42.8 | 176.2 | -77.7 | 164 | 0 | 0 | 0 | 111.2 | V8 I9 N15 L16 | V8-L12 HydrophobicContact CG1-CD1 3.91Å; V8-L12 WeakPolarHBondContact O-CB 3.19Å; V8-L12 WeakPolarHBondContact O-CG 3.41Å; V8-L12 PolarHBondContact O-N 3.45Å; I9-L12 PolarHBondContact O-N 3.15Å; L12-N15 PolarHBondContact O-N 3.02Å; L12-L16 WeakPolarHBondContact O-CB 3.48Å; L12-L16 PolarHBondContact O-N 2.81Å |
| 13 | I | 77.4 | Confident | 74.8 | Confident | 54 Ų | 54 | 95.9 Ų | 95.9 | 28% | 0.277 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -65.8 | -45.9 | 177.4 | -67.1 | 166 | 0 | 0 | 0 | 110.7 | I9 G10 L11 N15 L16 I17 Y53 | I9-I13 HydrophobicContact CG2-CD1 3.62Å; I9-I13 HydrophobicContact CG2-CG1 4.39Å; I9-I13 WeakPolarHBondContact O-CB 3.36Å; I9-I13 WeakPolarHBondContact O-CD1 3.15Å; I9-I13 WeakPolarHBondContact O-CG1 3.49Å; I9-I13 PolarHBondContact O-N 2.8Å; G10-I13 PolarHBondContact O-N 3.32Å; L11-I13 VanDerWaalsContact C-N 3.3Å; L11-I13 PolarHBondContact O-N 2.79Å; I13-N15 VanDerWaalsContact C-N 3.3Å; I13-N15 PolarHBondContact O-N 2.91Å; I13-L16 WeakPolarHBondContact O-CB 3.23Å; I13-L16 PolarHBondContact O-N 3.41Å; I13-L16 VanDerWaalsContact O-N 3.1Å; I13-I17 HydrophobicContact CG2-CD1 3.84Å; I13-I17 HydrophobicContact CG2-CG1 4.4Å; I13-I17 WeakPolarHBondContact O-CG1 3.47Å; I13-I17 PolarHBondContact O-N 3.38Å; I13-Y53 HydrophobicContact CD1-CE2 4.47Å; I13-Y53 HydrophobicContact CG2-CE2 4.4Å |
| 14 | N | 80.2 | Confident | 75.5 | Confident | 94 Ų | 94 | 94.5 Ų | 94.5 | 50% | 0.503 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -60.5 | -40.8 | 177 | -77.4 | -14.4 | 0 | 0 | 0 | 111.9 | G10 L11 L16 I17 L18 | G10-N14 WeakPolarHBondContact O-CB 3.3Å; G10-N14 VanDerWaalsContact O-CG 3.3Å; G10-N14 PolarHBondContact O-N 2.75Å; L11-N14 PolarHBondContact O-N 2.95Å; N14-L16 VanDerWaalsContact C-N 3.32Å; N14-L16 PolarHBondContact O-N 3.41Å; N14-I17 PolarHBondContact O-N 2.97Å; N14-L18 WeakPolarHBondContact O-CB 3.27Å; N14-L18 WeakPolarHBondContact O-CG 3.33Å; N14-L18 PolarHBondContact O-N 3.39Å |
| 15 | N | 79 | Confident | 75.8 | Confident | 87 Ų | 87 | 94.5 Ų | 94.5 | 47% | 0.465 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -64.6 | -38.1 | 175.2 | -71.9 | -11.3 | 0 | 0 | 0 | 111.8 | L11 L12 I13 L18 F19 | L11-N15 WeakPolarHBondContact O-CB 3.38Å; L11-N15 VanDerWaalsContact O-CG 3.25Å; L11-N15 PolarHBondContact O-N 3.32Å; L12-N15 PolarHBondContact O-N 3.02Å; I13-N15 VanDerWaalsContact C-N 3.3Å; I13-N15 PolarHBondContact O-N 2.91Å; N15-L18 PolarHBondContact O-N 2.91Å; N15-F19 VanDerWaalsContact O-CB 3.26Å; N15-F19 WeakPolarHBondContact O-CB 3.4Å; N15-F19 PolarHBondContact O-N 2.78Å |
| 16 | L | 81.3 | Confident | 76.1 | Confident | 98 Ų | 98 | 91.9 Ų | 91.9 | 51% | 0.513 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -66.2 | -41.3 | 176 | -158.1 | 78.9 | 0 | 0 | 0 | 111.5 | L12 I13 N14 F19 A20 | L12-L16 WeakPolarHBondContact O-CB 3.48Å; L12-L16 PolarHBondContact O-N 2.81Å; I13-L16 WeakPolarHBondContact O-CB 3.23Å; I13-L16 PolarHBondContact O-N 3.41Å; I13-L16 VanDerWaalsContact O-N 3.1Å; N14-L16 VanDerWaalsContact C-N 3.32Å; N14-L16 PolarHBondContact O-N 3.41Å; L16-F19 PolarHBondContact O-N 2.85Å; L16-A20 VanDerWaalsContact O-CB 3.24Å; L16-A20 WeakPolarHBondContact O-CB 3.21Å; L16-A20 PolarHBondContact O-N 2.94Å |
| 17 | I | 81.3 | Confident | 76.1 | Confident | 91 Ų | 91 | 88.5 Ų | 88.5 | 47% | 0.467 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -64.5 | -46.5 | 175.7 | -67.2 | 167 | 0 | 0 | 0 | 110.3 | I13 N14 A20 H21 | I13-I17 HydrophobicContact CG2-CD1 3.84Å; I13-I17 HydrophobicContact CG2-CG1 4.4Å; I13-I17 WeakPolarHBondContact O-CG1 3.47Å; I13-I17 PolarHBondContact O-N 3.38Å; N14-I17 PolarHBondContact O-N 2.97Å; I17-A20 PolarHBondContact O-N 2.92Å; I17-H21 VanDerWaalsContact O-CB 3.29Å; I17-H21 WeakPolarHBondContact O-CB 3.43Å; I17-H21 PolarHBondContact O-N 3.24Å |
| 18 | L | 77 | Confident | 75.7 | Confident | 99 Ų | 99 | 83 Ų | 83 | 52% | 0.518 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -61 | -46 | 177 | -77.7 | 169.1 | 0 | 0 | 0 | 111.2 | N14 N15 A20 H21 I22 | N14-L18 WeakPolarHBondContact O-CB 3.27Å; N14-L18 WeakPolarHBondContact O-CG 3.33Å; N14-L18 PolarHBondContact O-N 3.39Å; N15-L18 PolarHBondContact O-N 2.91Å; L18-A20 VanDerWaalsContact C-N 3.34Å; L18-A20 PolarHBondContact O-N 3.46Å; L18-H21 PolarHBondContact O-N 3.4Å; L18-I22 WeakPolarHBondContact O-CB 3.43Å; L18-I22 VanDerWaalsContact O-CG1 3.24Å; L18-I22 WeakPolarHBondContact O-CG1 3.47Å; L18-I22 PolarHBondContact O-N 2.82Å |
| 19 | F | 81.2 | Confident | 75.3 | Confident | 140 Ų | 140 | 84.8 Ų | 84.8 | 61% | 0.614 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -59.3 | -47.2 | 176.5 | 179 | -98.4 | 0 | 0 | 0 | 111.3 | N15 L16 H21 I22 F23 | N15-F19 VanDerWaalsContact O-CB 3.26Å; N15-F19 WeakPolarHBondContact O-CB 3.4Å; N15-F19 PolarHBondContact O-N 2.78Å; L16-F19 PolarHBondContact O-N 2.85Å; F19-H21 VanDerWaalsContact C-N 3.34Å; F19-H21 PolarHBondContact O-N 3.4Å; F19-I22 PolarHBondContact O-N 2.87Å; F19-F23 VanDerWaalsContact O-CB 3.29Å; F19-F23 WeakPolarHBondContact O-CB 3.49Å; F19-F23 PolarHBondContact O-N 3.33Å |
| 20 | A | 78.4 | Confident | 74.3 | Confident | 26 Ų | 26 | 86.7 Ų | 86.7 | 22% | 0.215 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -64.1 | -40.1 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | L16 I17 L18 F23 C24 F46 | L16-A20 VanDerWaalsContact O-CB 3.24Å; L16-A20 WeakPolarHBondContact O-CB 3.21Å; L16-A20 PolarHBondContact O-N 2.94Å; I17-A20 PolarHBondContact O-N 2.92Å; L18-A20 VanDerWaalsContact C-N 3.34Å; L18-A20 PolarHBondContact O-N 3.46Å; A20-F23 PolarHBondContact O-N 3.3Å; A20-C24 WeakPolarHBondContact O-CB 3.41Å; A20-C24 PolarHBondContact O-N 2.95Å; A20-C24 PolarHBondContact O-SG 3.33Å; A20-F46 HydrophobicContact CB-CE1 3.44Å; A20-F46 VanDerWaalsContact CB-CE1 3.44Å; A20-F46 HydrophobicContact CB-CZ 3.53Å |
| 21 | H | 79.4 | Confident | 73.1 | Confident | 123 Ų | 123 | 85.7 Ų | 85.7 | 57% | 0.569 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -65.6 | -44.3 | 177.2 | -169.3 | -127.1 | 0 | 0 | 0 | 111.9 | I17 L18 F19 C24 L25 | I17-H21 VanDerWaalsContact O-CB 3.29Å; I17-H21 WeakPolarHBondContact O-CB 3.43Å; I17-H21 PolarHBondContact O-N 3.24Å; L18-H21 PolarHBondContact O-N 3.4Å; F19-H21 VanDerWaalsContact C-N 3.34Å; F19-H21 PolarHBondContact O-N 3.4Å; H21-C24 PolarHBondContact O-N 2.91Å; H21-L25 WeakPolarHBondContact O-CB 3.4Å; H21-L25 PolarHBondContact O-N 3.33Å |
| 22 | I | 76.4 | Confident | 72 | Confident | 96 Ų | 96 | 88 Ų | 88 | 49% | 0.492 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -62.8 | -45.4 | 174.8 | -67.6 | 164.6 | 0 | 0 | 0 | 110.4 | L18 F19 C24 L25 N26 | L18-I22 WeakPolarHBondContact O-CB 3.43Å; L18-I22 VanDerWaalsContact O-CG1 3.24Å; L18-I22 WeakPolarHBondContact O-CG1 3.47Å; L18-I22 PolarHBondContact O-N 2.82Å; F19-I22 PolarHBondContact O-N 2.87Å; I22-C24 PolarHBondContact O-N 2.99Å; I22-L25 PolarHBondContact O-N 3.32Å; I22-N26 WeakPolarHBondContact O-CB 3.35Å; I22-N26 PolarHBondContact O-N 3.46Å |
| 23 | F | 76.9 | Confident | 71 | Confident | 108 Ų | 108 | 90.7 Ų | 90.7 | 47% | 0.474 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -57.7 | -41.1 | 176.5 | -179 | -99.7 | 0 | 0 | 0 | 111.1 | F19 A20 N26 L27 | F19-F23 VanDerWaalsContact O-CB 3.29Å; F19-F23 WeakPolarHBondContact O-CB 3.49Å; F19-F23 PolarHBondContact O-N 3.33Å; A20-F23 PolarHBondContact O-N 3.3Å; F23-N26 PolarHBondContact O-N 2.81Å; F23-L27 HydrophobicContact CE1-CD2 4.23Å; F23-L27 VanDerWaalsContact O-CB 3.3Å; F23-L27 WeakPolarHBondContact O-CB 3.45Å; F23-L27 PolarHBondContact O-N 3.42Å |
| 24 | C | 69.3 | Low | 69.8 | Low | 21 Ų | 21 | 94.3 Ų | 94.3 | 14% | 0.142 | 48% | 0.481 | C | S | . | . | H | α-helix | trans | -79.3 | -29.1 | -178.7 | -64.9 | 0 | 0 | 0 | 0 | 113.3 | A20 H21 I22 L27 A28 L42 F46 | A20-C24 WeakPolarHBondContact O-CB 3.41Å; A20-C24 PolarHBondContact O-N 2.95Å; A20-C24 PolarHBondContact O-SG 3.33Å; H21-C24 PolarHBondContact O-N 2.91Å; I22-C24 PolarHBondContact O-N 2.99Å; C24-L27 PolarHBondContact O-N 3.26Å; C24-A28 WeakPolarHBondContact O-CA 3.34Å; C24-A28 WeakPolarHBondContact O-CB 3.41Å; C24-A28 PolarHBondContact O-N 2.9Å; C24-L42 HydrophobicContact CB-CD1 4Å; C24-L42 VanDerWaalsContact SG-CD1 3.58Å; C24-F46 HydrophobicContact CB-CE2 4.01Å; C24-F46 HydrophobicContact CB-CZ 4.33Å; C24-F46 WeakPolarHBondContact SG-CE2 3.43Å; C24-F46 VanDerWaalsContact SG-CZ 3.57Å |
| 25 | L | 72.6 | Confident | 68.5 | Low | 113 Ų | 113 | 94.5 Ų | 94.5 | 59% | 0.592 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -67.2 | -43.7 | 169.5 | -171.5 | 70.3 | 0 | 0 | 0 | 110.6 | H21 I22 A28 N29 | H21-L25 WeakPolarHBondContact O-CB 3.4Å; H21-L25 PolarHBondContact O-N 3.33Å; I22-L25 PolarHBondContact O-N 3.32Å; L25-A28 PolarHBondContact O-N 3.31Å; L25-N29 WeakPolarHBondContact O-CB 3.48Å; L25-N29 PolarHBondContact O-N 2.81Å |
| 26 | N | 70.7 | Confident | 67.3 | Low | 95 Ų | 95 | 97.7 Ų | 97.7 | 51% | 0.508 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.5 | -44.7 | 173.5 | -78.3 | -20.3 | 0 | 0 | 0 | 110.8 | I22 F23 A28 N29 M30 | I22-N26 WeakPolarHBondContact O-CB 3.35Å; I22-N26 PolarHBondContact O-N 3.46Å; F23-N26 PolarHBondContact O-N 2.81Å; N26-A28 VanDerWaalsContact C-N 3.32Å; N26-A28 PolarHBondContact O-N 2.87Å; N26-N29 PolarHBondContact O-N 3.38Å; N26-M30 WeakPolarHBondContact O-CB 3.47Å; N26-M30 WeakPolarHBondContact O-CG 3.43Å; N26-M30 PolarHBondContact O-N 3.1Å |
| 27 | L | 65.5 | Low | 66.3 | Low | 51 Ų | 51 | 100.5 Ų | 100.5 | 27% | 0.267 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -67.8 | -33.7 | 177.1 | -159.8 | 65.6 | 0 | 0 | 0 | 111.5 | F23 C24 M30 S31 V38 L42 | F23-L27 HydrophobicContact CE1-CD2 4.23Å; F23-L27 VanDerWaalsContact O-CB 3.3Å; F23-L27 WeakPolarHBondContact O-CB 3.45Å; F23-L27 PolarHBondContact O-N 3.42Å; C24-L27 PolarHBondContact O-N 3.26Å; L27-M30 CarbonylContact O-C 3.54Å; L27-M30 PolarHBondContact O-N 3.44Å; L27-S31 WeakPolarHBondContact O-CA 3.35Å; L27-S31 WeakPolarHBondContact O-CB 3.41Å; L27-S31 PolarHBondContact O-N 2.86Å; L27-S31 PolarHBondContact O-OG 3.19Å; L27-V38 HydrophobicContact CD1-CG1 4.44Å; L27-V38 HydrophobicContact CD2-CG1 3.27Å; L27-V38 HydrophobicContact CG-CG1 3.74Å; L27-L42 HydrophobicContact CB-CD1 4.04Å; L27-L42 HydrophobicContact CD2-CD1 3.4Å; L27-L42 HydrophobicContact CD2-CD2 4.13Å; L27-L42 HydrophobicContact CD2-CG 3.95Å; L27-L42 HydrophobicContact CG-CD1 4.14Å |
| 28 | A | 64.2 | Low | 65.2 | Low | 30 Ų | 30 | 98.6 Ų | 98.6 | 25% | 0.248 | 50% | 0.498 | C | S | . | . | H | α-helix | trans | -67 | -38.6 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | C24 L25 N26 S31 K32 | C24-A28 WeakPolarHBondContact O-CA 3.34Å; C24-A28 WeakPolarHBondContact O-CB 3.41Å; C24-A28 PolarHBondContact O-N 2.9Å; L25-A28 PolarHBondContact O-N 3.31Å; N26-A28 VanDerWaalsContact C-N 3.32Å; N26-A28 PolarHBondContact O-N 2.87Å; A28-S31 VanDerWaalsContact CA-OG 3.26Å; A28-S31 WeakPolarHBondContact CA-OG 3.42Å; A28-S31 CarbonylContact O-C 3.49Å; A28-S31 PolarHBondContact O-N 2.96Å; A28-S31 PolarHBondContact O-OG 3.42Å; A28-K32 PolarHBondContact O-N 2.97Å |
| 29 | N | 62.8 | Low | 64.3 | Low | 112 Ų | 112 | 100.4 Ų | 100.4 | 60% | 0.599 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -67.7 | -39.4 | 174.8 | -165.8 | 55.4 | 0 | 0 | 0 | 111.4 | L25 N26 | L25-N29 WeakPolarHBondContact O-CB 3.48Å; L25-N29 PolarHBondContact O-N 2.81Å; N26-N29 PolarHBondContact O-N 3.38Å |
| 30 | M | 56.2 | Low | 63.1 | Low | 133 Ų | 133 | 100.8 Ų | 100.8 | 66% | 0.655 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -70.9 | -34.7 | 171.6 | -64.3 | -67.1 | -80.3 | 0 | 0 | 111.6 | N26 L27 K32 M33 | N26-M30 WeakPolarHBondContact O-CB 3.47Å; N26-M30 WeakPolarHBondContact O-CG 3.43Å; N26-M30 PolarHBondContact O-N 3.1Å; L27-M30 CarbonylContact O-C 3.54Å; L27-M30 PolarHBondContact O-N 3.44Å; M30-K32 VanDerWaalsContact C-N 3.34Å; M30-M33 VanDerWaalsContact O-CB 3.3Å; M30-M33 WeakPolarHBondContact O-CB 3.43Å; M30-M33 PolarHBondContact O-N 2.95Å; M30-M33 VanDerWaalsContact O-N 3.07Å |
| 31 | S | 51 | Low | 62.2 | Low | 8 Ų | 8 | 108.5 Ų | 108.5 | 6% | 0.056 | 52% | 0.521 | C | S | . | . | H | α-helix | trans | -81.9 | -10.3 | -179.4 | 79.8 | 0 | 0 | 0 | 0 | 112.6 | L27 A28 M33 L34 D35 | L27-S31 WeakPolarHBondContact O-CA 3.35Å; L27-S31 WeakPolarHBondContact O-CB 3.41Å; L27-S31 PolarHBondContact O-N 2.86Å; L27-S31 PolarHBondContact O-OG 3.19Å; A28-S31 VanDerWaalsContact CA-OG 3.26Å; A28-S31 WeakPolarHBondContact CA-OG 3.42Å; A28-S31 CarbonylContact O-C 3.49Å; A28-S31 PolarHBondContact O-N 2.96Å; A28-S31 PolarHBondContact O-OG 3.42Å; S31-M33 PolarHBondContact O-N 3.47Å; S31-L34 CarbonylContact O-C 3.15Å; S31-L34 WeakPolarHBondContact O-CA 3.34Å; S31-L34 PolarHBondContact O-N 3.5Å; S31-D35 WeakPolarHBondContact O-CA 3.24Å; S31-D35 WeakPolarHBondContact O-CB 3.4Å; S31-D35 PolarHBondContact O-N 3.11Å |
| 32 | K | 54.3 | Low | 61.2 | Low | 158 Ų | 158 | 103.8 Ų | 103.8 | 69% | 0.687 | 50% | 0.5 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.1 | -13.6 | 157.7 | -86 | -176.4 | 175.1 | 170.5 | 0 | 112.5 | A28 M30 D35 | A28-K32 PolarHBondContact O-N 2.97Å; M30-K32 VanDerWaalsContact C-N 3.34Å; K32-D35 VanDerWaalsContact CA-OD2 3.26Å; K32-D35 WeakPolarHBondContact CA-OD2 3.26Å |
| 33 | M | 55.3 | Low | 60.4 | Low | 168 Ų | 168 | 102.4 Ų | 102.4 | 83% | 0.828 | 50% | 0.496 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.5 | -7.4 | 167.2 | -56.8 | -127.8 | -65.5 | 0 | 0 | 114.8 | M30 S31 | M30-M33 VanDerWaalsContact O-CB 3.3Å; M30-M33 WeakPolarHBondContact O-CB 3.43Å; M30-M33 PolarHBondContact O-N 2.95Å; M30-M33 VanDerWaalsContact O-N 3.07Å; S31-M33 PolarHBondContact O-N 3.47Å |
| 34 | L | 53.1 | Low | 59.7 | Low | 130 Ų | 130 | 102 Ų | 102 | 68% | 0.681 | 50% | 0.495 | S | S | * | . | S | Bend | trans | -141.7 | 47.8 | -175.4 | -84.7 | 119.7 | 0 | 0 | 0 | 112 | S31 H36 | S31-L34 CarbonylContact O-C 3.15Å; S31-L34 WeakPolarHBondContact O-CA 3.34Å; S31-L34 PolarHBondContact O-N 3.5Å; L34-H36 PolarHBondContact O-N 2.91Å |
| 35 | D | 51.8 | Low | 59.3 | Low | 98 Ų | 98 | 106.9 Ų | 106.9 | 52% | 0.524 | 52% | 0.52 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.9 | 35.4 | -140.2 | -138.6 | -34.2 | 0 | 0 | 0 | 120.8 | S31 K32 | S31-D35 WeakPolarHBondContact O-CA 3.24Å; S31-D35 WeakPolarHBondContact O-CB 3.4Å; S31-D35 PolarHBondContact O-N 3.11Å; K32-D35 VanDerWaalsContact CA-OD2 3.26Å; K32-D35 WeakPolarHBondContact CA-OD2 3.26Å |
| 36 | H | 55 | Low | 58.7 | Low | 154 Ų | 154 | 105.2 Ų | 105.2 | 71% | 0.713 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -155.9 | -47.1 | 167.2 | -132.8 | 50.3 | 0 | 0 | 0 | 116.4 | L34 V38 Y40 | L34-H36 PolarHBondContact O-N 2.91Å; H36-V38 PolarHBondContact O-N 3.37Å; H36-Y40 PolarHBondContact O-N 2.98Å |
| 37 | M | 59.6 | Low | 58.2 | Low | 156 Ų | 156 | 105.3 Ų | 105.3 | 77% | 0.768 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -70.3 | -36.8 | -169.1 | -64.2 | -137.7 | -142.3 | 0 | 0 | 113 | R41 | M37-R41 PolarHBondContact O-N 3.46Å |
| 38 | V | 57.7 | Low | 57.8 | Low | 51 Ų | 51 | 107.5 Ų | 107.5 | 31% | 0.309 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -71.2 | -43.1 | -177 | 179.3 | 0 | 0 | 0 | 0 | 110.8 | L27 H36 Y40 R41 L42 | L27-V38 HydrophobicContact CD1-CG1 4.44Å; L27-V38 HydrophobicContact CD2-CG1 3.27Å; L27-V38 HydrophobicContact CG-CG1 3.74Å; H36-V38 PolarHBondContact O-N 3.37Å; V38-Y40 PolarHBondContact O-N 2.88Å; V38-R41 PolarHBondContact O-N 3.49Å; V38-L42 WeakPolarHBondContact O-CG 3.29Å; V38-L42 PolarHBondContact O-N 3.47Å |
| 39 | Y | 58.1 | Low | 57.2 | Low | 137 Ų | 137 | 110.4 Ų | 110.4 | 54% | 0.537 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -58.8 | -47.4 | 177.1 | 179.2 | -98.8 | 0 | 0 | 0 | 111.7 | R41 L42 V43 | Y39-R41 PolarHBondContact O-N 3.33Å; Y39-L42 PolarHBondContact O-N 2.8Å; Y39-V43 HydrophobicContact CD1-CG2 4.21Å; Y39-V43 HydrophobicContact CE1-CG2 3.75Å; Y39-V43 HydrophobicContact CE2-CG2 4.12Å; Y39-V43 WeakPolarHBondContact O-CG2 3.24Å; Y39-V43 PolarHBondContact O-N 3.26Å |
| 40 | Y | 57.6 | Low | 56.6 | Low | 149 Ų | 149 | 112.5 Ų | 112.5 | 58% | 0.584 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -62.5 | -43.5 | 180 | -170.1 | -95.7 | 0 | 0 | 0 | 112.6 | H36 V38 L42 V43 Q44 | H36-Y40 PolarHBondContact O-N 2.98Å; V38-Y40 PolarHBondContact O-N 2.88Å; Y40-L42 VanDerWaalsContact C-N 3.31Å; Y40-L42 PolarHBondContact O-N 2.86Å; Y40-V43 PolarHBondContact O-N 3.04Å; Y40-Q44 HydrophobicContact CD1-CG 4.27Å; Y40-Q44 VanDerWaalsContact CE1-CD 3.43Å; Y40-Q44 HydrophobicContact CE1-CG 3.98Å; Y40-Q44 VanDerWaalsContact CE1-NE2 3.31Å; Y40-Q44 WeakPolarHBondContact O-CG 3.46Å; Y40-Q44 PolarHBondContact O-N 3.49Å |
| 41 | R | 59.5 | Low | 56.6 | Low | 187 Ų | 187 | 110.9 Ų | 110.9 | 71% | 0.706 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -62 | -38.6 | 175.6 | -78.7 | -173 | -178.5 | -143.4 | 1.4 | 112.4 | M37 V38 Y39 Q44 L45 | M37-R41 PolarHBondContact O-N 3.46Å; V38-R41 PolarHBondContact O-N 3.49Å; Y39-R41 PolarHBondContact O-N 3.33Å; R41-Q44 PolarHBondContact O-N 2.86Å; R41-L45 PolarHBondContact O-N 2.97Å |
| 42 | L | 56.9 | Low | 56.7 | Low | 25 Ų | 25 | 114.9 Ų | 114.9 | 13% | 0.131 | 55% | 0.549 | C | S | . | . | H | α-helix | trans | -65.7 | -47.7 | 176 | -77.7 | -179.5 | 0 | 0 | 0 | 112.1 | C24 L27 V38 Y39 Y40 Q44 L45 F46 | C24-L42 HydrophobicContact CB-CD1 4Å; C24-L42 VanDerWaalsContact SG-CD1 3.58Å; L27-L42 HydrophobicContact CB-CD1 4.04Å; L27-L42 HydrophobicContact CD2-CD1 3.4Å; L27-L42 HydrophobicContact CD2-CD2 4.13Å; L27-L42 HydrophobicContact CD2-CG 3.95Å; L27-L42 HydrophobicContact CG-CD1 4.14Å; V38-L42 WeakPolarHBondContact O-CG 3.29Å; V38-L42 PolarHBondContact O-N 3.47Å; Y39-L42 PolarHBondContact O-N 2.8Å; Y40-L42 VanDerWaalsContact C-N 3.31Å; Y40-L42 PolarHBondContact O-N 2.86Å; L42-Q44 PolarHBondContact O-N 3.03Å; L42-L45 WeakPolarHBondContact O-CB 3.47Å; L42-L45 PolarHBondContact O-N 3.42Å; L42-F46 VanDerWaalsContact O-CD2 3.24Å; L42-F46 WeakPolarHBondContact O-CD2 3.36Å; L42-F46 PolarHBondContact O-N 3.21Å |
| 43 | V | 60.7 | Low | 56.4 | Low | 67 Ų | 67 | 113.1 Ų | 113.1 | 41% | 0.406 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -58.1 | -40.4 | 177.9 | 172.6 | 0 | 0 | 0 | 0 | 110.7 | Y39 Y40 F46 N47 | Y39-V43 HydrophobicContact CD1-CG2 4.21Å; Y39-V43 HydrophobicContact CE1-CG2 3.75Å; Y39-V43 HydrophobicContact CE2-CG2 4.12Å; Y39-V43 WeakPolarHBondContact O-CG2 3.24Å; Y39-V43 PolarHBondContact O-N 3.26Å; Y40-V43 PolarHBondContact O-N 3.04Å; V43-F46 PolarHBondContact O-N 3.03Å; V43-N47 WeakPolarHBondContact O-CB 3.24Å; V43-N47 PolarHBondContact O-N 3Å |
| 44 | Q | 61.5 | Low | 56.2 | Low | 99 Ų | 99 | 108.3 Ų | 108.3 | 46% | 0.463 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.4 | -44 | 173.4 | -75.7 | -172.4 | -39.1 | 0 | 0 | 112.5 | Y40 R41 L42 F46 N47 V48 | Y40-Q44 HydrophobicContact CD1-CG 4.27Å; Y40-Q44 VanDerWaalsContact CE1-CD 3.43Å; Y40-Q44 HydrophobicContact CE1-CG 3.98Å; Y40-Q44 VanDerWaalsContact CE1-NE2 3.31Å; Y40-Q44 WeakPolarHBondContact O-CG 3.46Å; Y40-Q44 PolarHBondContact O-N 3.49Å; R41-Q44 PolarHBondContact O-N 2.86Å; L42-Q44 PolarHBondContact O-N 3.03Å; Q44-F46 VanDerWaalsContact C-N 3.32Å; Q44-F46 PolarHBondContact O-N 3.32Å; Q44-N47 PolarHBondContact O-N 3.36Å; Q44-V48 WeakPolarHBondContact O-CG2 3.24Å; Q44-V48 PolarHBondContact O-N 3.11Å |
| 45 | L | 61.2 | Low | 56 | Low | 124 Ų | 124 | 106.4 Ų | 106.4 | 65% | 0.649 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -59.7 | -42.8 | 177.7 | -159.5 | 93 | 0 | 0 | 0 | 111.5 | R41 L42 V48 H49 | R41-L45 PolarHBondContact O-N 2.97Å; L42-L45 WeakPolarHBondContact O-CB 3.47Å; L42-L45 PolarHBondContact O-N 3.42Å; L45-V48 PolarHBondContact O-N 3.47Å; L45-H49 PolarHBondContact O-N 3.25Å |
| 46 | F | 60.6 | Low | 55.9 | Low | 77 Ų | 77 | 105.5 Ų | 105.5 | 34% | 0.338 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -68 | -37.9 | 174.7 | -79.6 | -76.9 | 0 | 0 | 0 | 113.4 | A20 C24 L42 V43 Q44 V48 H49 K50 | A20-F46 HydrophobicContact CB-CE1 3.44Å; A20-F46 VanDerWaalsContact CB-CE1 3.44Å; A20-F46 HydrophobicContact CB-CZ 3.53Å; C24-F46 HydrophobicContact CB-CE2 4.01Å; C24-F46 HydrophobicContact CB-CZ 4.33Å; C24-F46 WeakPolarHBondContact SG-CE2 3.43Å; C24-F46 VanDerWaalsContact SG-CZ 3.57Å; L42-F46 VanDerWaalsContact O-CD2 3.24Å; L42-F46 WeakPolarHBondContact O-CD2 3.36Å; L42-F46 PolarHBondContact O-N 3.21Å; V43-F46 PolarHBondContact O-N 3.03Å; Q44-F46 VanDerWaalsContact C-N 3.32Å; Q44-F46 PolarHBondContact O-N 3.32Å; F46-V48 VanDerWaalsContact C-N 3.29Å; F46-V48 PolarHBondContact O-N 3.32Å; F46-H49 CarbonylContact O-C 3.55Å; F46-H49 WeakPolarHBondContact O-CA 3.29Å; F46-H49 WeakPolarHBondContact O-CB 3.36Å; F46-H49 PolarHBondContact O-N 2.92Å; F46-H49 VanDerWaalsContact O-N 3.11Å; F46-K50 PolarHBondContact O-N 3.33Å |
| 47 | N | 60.6 | Low | 55.2 | Low | 98 Ų | 98 | 99.9 Ų | 99.9 | 52% | 0.524 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -65.7 | -38.3 | 179.4 | -156.4 | 45.4 | 0 | 0 | 0 | 110.7 | V43 Q44 H49 K50 L51 | V43-N47 WeakPolarHBondContact O-CB 3.24Å; V43-N47 PolarHBondContact O-N 3Å; Q44-N47 PolarHBondContact O-N 3.36Å; N47-H49 VanDerWaalsContact C-N 3.34Å; N47-K50 PolarHBondContact O-N 3.45Å; N47-L51 PolarHBondContact O-N 2.84Å |
| 48 | V | 57.2 | Low | 54.5 | Low | 97 Ų | 97 | 96.7 Ų | 96.7 | 59% | 0.588 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -62.8 | -41.3 | 169.7 | 174.6 | 0 | 0 | 0 | 0 | 110.7 | Q44 L45 F46 K50 L51 L52 | Q44-V48 WeakPolarHBondContact O-CG2 3.24Å; Q44-V48 PolarHBondContact O-N 3.11Å; L45-V48 PolarHBondContact O-N 3.47Å; F46-V48 VanDerWaalsContact C-N 3.29Å; F46-V48 PolarHBondContact O-N 3.32Å; V48-K50 VanDerWaalsContact C-N 3.34Å; V48-K50 PolarHBondContact O-N 3.42Å; V48-L51 WeakPolarHBondContact O-CB 3.41Å; V48-L51 PolarHBondContact O-N 3.39Å; V48-L52 WeakPolarHBondContact O-CB 3.47Å; V48-L52 PolarHBondContact O-N 2.81Å |
| 49 | H | 50.1 | Low | 53.8 | Low | 91 Ų | 91 | 98.9 Ų | 98.9 | 42% | 0.421 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.3 | -39.6 | 176.2 | -158 | 119.5 | 0 | 0 | 0 | 112.1 | L45 F46 N47 L51 L52 Y53 | L45-H49 PolarHBondContact O-N 3.25Å; F46-H49 CarbonylContact O-C 3.55Å; F46-H49 WeakPolarHBondContact O-CA 3.29Å; F46-H49 WeakPolarHBondContact O-CB 3.36Å; F46-H49 PolarHBondContact O-N 2.92Å; F46-H49 VanDerWaalsContact O-N 3.11Å; N47-H49 VanDerWaalsContact C-N 3.34Å; H49-L51 VanDerWaalsContact C-N 3.34Å; H49-L52 PolarHBondContact O-N 3.46Å; H49-Y53 WeakPolarHBondContact O-CB 3.48Å; H49-Y53 PolarHBondContact O-N 3.43Å |
| 50 | K | 51.3 | Low | 52.9 | Low | 155 Ų | 155 | 101.4 Ų | 101.4 | 67% | 0.674 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -65.6 | -37.8 | 175.6 | -168.3 | -178.4 | -178.8 | -177.9 | 0 | 111.8 | F46 N47 V48 Y53 S54 | F46-K50 PolarHBondContact O-N 3.33Å; N47-K50 PolarHBondContact O-N 3.45Å; V48-K50 VanDerWaalsContact C-N 3.34Å; V48-K50 PolarHBondContact O-N 3.42Å; K50-Y53 WeakPolarHBondContact O-CB 3.26Å; K50-Y53 PolarHBondContact O-N 3.3Å; K50-S54 PolarHBondContact O-N 3.21Å |
| 51 | L | 56.2 | Low | 51.8 | Low | 99 Ų | 99 | 100.3 Ų | 100.3 | 52% | 0.518 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.2 | -49.6 | 171 | -105 | 141.8 | 0 | 0 | 0 | 111.2 | N47 V48 H49 Y53 S54 D55 | N47-L51 PolarHBondContact O-N 2.84Å; V48-L51 WeakPolarHBondContact O-CB 3.41Å; V48-L51 PolarHBondContact O-N 3.39Å; H49-L51 VanDerWaalsContact C-N 3.34Å; L51-Y53 PolarHBondContact O-N 3.37Å; L51-S54 CarbonylContact O-C 3.56Å; L51-S54 WeakPolarHBondContact O-CA 3.3Å; L51-S54 WeakPolarHBondContact O-CB 3.09Å; L51-S54 PolarHBondContact O-N 3.46Å; L51-D55 PolarHBondContact O-N 2.72Å |
| 52 | L | 52.1 | Low | 50.7 | Low | 93 Ų | 93 | 96.2 Ų | 96.2 | 49% | 0.487 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -58.3 | -36.3 | 175.9 | -169.8 | 70.1 | 0 | 0 | 0 | 111.3 | V48 H49 D55 I56 | V48-L52 WeakPolarHBondContact O-CB 3.47Å; V48-L52 PolarHBondContact O-N 2.81Å; H49-L52 PolarHBondContact O-N 3.46Å; L52-D55 PolarHBondContact O-N 3.47Å; L52-I56 HydrophobicContact CD1-CD1 4.32Å; L52-I56 HydrophobicContact CD1-CG1 4.49Å; L52-I56 HydrophobicContact CD2-CD1 4.19Å; L52-I56 HydrophobicContact CG-CD1 3.75Å; L52-I56 HydrophobicContact CG-CG1 4.28Å; L52-I56 VanDerWaalsContact O-CB 3.27Å; L52-I56 WeakPolarHBondContact O-CB 3.36Å; L52-I56 WeakPolarHBondContact O-CG1 2.97Å; L52-I56 PolarHBondContact O-N 3.49Å |
| 53 | Y | 47.5 | Very low | 49.8 | Very low | 120 Ų | 120 | 104 Ų | 104 | 47% | 0.471 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -65.7 | -41.9 | 172.5 | -174.5 | -93.3 | 0 | 0 | 0 | 112.1 | I13 H49 K50 L51 D55 C57 | I13-Y53 HydrophobicContact CD1-CE2 4.47Å; I13-Y53 HydrophobicContact CG2-CE2 4.4Å; H49-Y53 WeakPolarHBondContact O-CB 3.48Å; H49-Y53 PolarHBondContact O-N 3.43Å; K50-Y53 WeakPolarHBondContact O-CB 3.26Å; K50-Y53 PolarHBondContact O-N 3.3Å; L51-Y53 PolarHBondContact O-N 3.37Å; Y53-D55 VanDerWaalsContact C-N 3.35Å; Y53-C57 VanDerWaalsContact CE1-SG 3.53Å; Y53-C57 WeakPolarHBondContact O-CB 3.45Å; Y53-C57 PolarHBondContact O-N 3.49Å |
| 54 | S | 51.3 | Low | 48.4 | Very low | 67 Ų | 67 | 105.8 Ų | 105.8 | 47% | 0.469 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -61.7 | -43.1 | 173.2 | -166.5 | 0 | 0 | 0 | 0 | 111.5 | K50 L51 C58 | K50-S54 PolarHBondContact O-N 3.21Å; L51-S54 CarbonylContact O-C 3.56Å; L51-S54 WeakPolarHBondContact O-CA 3.3Å; L51-S54 WeakPolarHBondContact O-CB 3.09Å; L51-S54 PolarHBondContact O-N 3.46Å; S54-C58 WeakPolarHBondContact O-CB 3.36Å; S54-C58 PolarHBondContact O-N 2.87Å; S54-C58 PolarHBondContact O-SG 3.28Å |
| 55 | D | 49.4 | Very low | 47.3 | Very low | 91 Ų | 91 | 105.3 Ų | 105.3 | 49% | 0.487 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -68.5 | -44 | 178.2 | -86 | -69.5 | 0 | 0 | 0 | 112.4 | L51 L52 Y53 C58 C59 | L51-D55 PolarHBondContact O-N 2.72Å; L52-D55 PolarHBondContact O-N 3.47Å; Y53-D55 VanDerWaalsContact C-N 3.35Å; D55-C58 PolarHBondContact O-N 3.29Å; D55-C59 WeakPolarHBondContact O-CB 3.4Å; D55-C59 PolarHBondContact O-N 2.82Å; D55-C59 PolarHBondContact O-SG 3.02Å |
| 56 | I | 49 | Very low | 46 | Very low | 78 Ų | 78 | 107.7 Ų | 107.7 | 40% | 0.4 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -66.5 | -46.1 | 176.3 | -68.7 | 171.4 | 0 | 0 | 0 | 109.5 | L52 C58 C59 Y60 | L52-I56 HydrophobicContact CD1-CD1 4.32Å; L52-I56 HydrophobicContact CD1-CG1 4.49Å; L52-I56 HydrophobicContact CD2-CD1 4.19Å; L52-I56 HydrophobicContact CG-CD1 3.75Å; L52-I56 HydrophobicContact CG-CG1 4.28Å; L52-I56 VanDerWaalsContact O-CB 3.27Å; L52-I56 WeakPolarHBondContact O-CB 3.36Å; L52-I56 WeakPolarHBondContact O-CG1 2.97Å; L52-I56 PolarHBondContact O-N 3.49Å; I56-C58 VanDerWaalsContact C-N 3.31Å; I56-C58 PolarHBondContact O-N 2.79Å; I56-C59 PolarHBondContact O-N 3.01Å; I56-Y60 HydrophobicContact CG2-CD2 3.49Å; I56-Y60 VanDerWaalsContact CG2-CD2 3.49Å; I56-Y60 HydrophobicContact CG2-CE2 3.82Å; I56-Y60 HydrophobicContact CG2-CG 4.5Å; I56-Y60 VanDerWaalsContact O-CB 3.3Å; I56-Y60 WeakPolarHBondContact O-CB 3.05Å; I56-Y60 WeakPolarHBondContact O-CD2 3.35Å; I56-Y60 PolarHBondContact O-N 2.75Å |
| 57 | C | 41.2 | Very low | 44.7 | Very low | 36 Ų | 36 | 115.8 Ų | 115.8 | 24% | 0.243 | 57% | 0.57 | C | S | . | * | H | α-helix | trans | -62.7 | -37.3 | 174.4 | -79.5 | 0 | 0 | 0 | 0 | 111.7 | Y53 Y60 Y61 | Y53-C57 VanDerWaalsContact CE1-SG 3.53Å; Y53-C57 WeakPolarHBondContact O-CB 3.45Å; Y53-C57 PolarHBondContact O-N 3.49Å; C57-Y60 PolarHBondContact O-N 3.01Å; C57-Y61 VanDerWaalsContact O-CB 3.28Å; C57-Y61 WeakPolarHBondContact O-CB 3.21Å; C57-Y61 WeakPolarHBondContact O-CD2 3.48Å; C57-Y61 PolarHBondContact O-N 3.16Å |
| 58 | C | 44 | Very low | 43.6 | Very low | 89 Ų | 89 | 118.3 Ų | 118.3 | 60% | 0.601 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -67.5 | -33.5 | 173.2 | -82 | 0 | 0 | 0 | 0 | 113 | S54 D55 I56 Y61 | S54-C58 WeakPolarHBondContact O-CB 3.36Å; S54-C58 PolarHBondContact O-N 2.87Å; S54-C58 PolarHBondContact O-SG 3.28Å; D55-C58 PolarHBondContact O-N 3.29Å; I56-C58 VanDerWaalsContact C-N 3.31Å; I56-C58 PolarHBondContact O-N 2.79Å; C58-Y61 VanDerWaalsContact O-O 3.1Å |
| 59 | C | 43.4 | Very low | 42.6 | Very low | 98 Ų | 98 | 119.2 Ų | 119.2 | 66% | 0.662 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -77 | -34.5 | 175.1 | -68.8 | 0 | 0 | 0 | 0 | 112.9 | D55 I56 | D55-C59 WeakPolarHBondContact O-CB 3.4Å; D55-C59 PolarHBondContact O-N 2.82Å; D55-C59 PolarHBondContact O-SG 3.02Å; I56-C59 PolarHBondContact O-N 3.01Å |
| 60 | Y | 40.1 | Very low | 41.8 | Very low | 189 Ų | 189 | 118.1 Ų | 118.1 | 74% | 0.741 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -88.6 | -17.7 | -179.2 | -87.2 | -91.1 | 0 | 0 | 0 | 113.8 | I56 C57 P62 | I56-Y60 HydrophobicContact CG2-CD2 3.49Å; I56-Y60 VanDerWaalsContact CG2-CD2 3.49Å; I56-Y60 HydrophobicContact CG2-CE2 3.82Å; I56-Y60 HydrophobicContact CG2-CG 4.5Å; I56-Y60 VanDerWaalsContact O-CB 3.3Å; I56-Y60 WeakPolarHBondContact O-CB 3.05Å; I56-Y60 WeakPolarHBondContact O-CD2 3.35Å; I56-Y60 PolarHBondContact O-N 2.75Å; C57-Y60 PolarHBondContact O-N 3.01Å; Y60-P62 WeakPolarHBondContact O-CD 3.26Å |
| 61 | Y | 33.7 | Very low | 41.1 | Very low | 127 Ų | 127 | 114.7 Ų | 114.7 | 50% | 0.498 | 59% | 0.588 | S | S | . | * | S | Bend | trans | -96.1 | 81.7 | 158.8 | -78.4 | -97.4 | 0 | 0 | 0 | 108 | C57 C58 Q63 | C57-Y61 VanDerWaalsContact O-CB 3.28Å; C57-Y61 WeakPolarHBondContact O-CB 3.21Å; C57-Y61 WeakPolarHBondContact O-CD2 3.48Å; C57-Y61 PolarHBondContact O-N 3.16Å; C58-Y61 VanDerWaalsContact O-O 3.1Å; Y61-Q63 PolarHBondContact O-N 2.64Å |
| 62 | P | 36.5 | Very low | 40.1 | Very low | 100 Ų | 100 | 117.4 Ų | 117.4 | 65% | 0.649 | 60% | 0.602 | S | S | * | * | trans | -54.1 | 123.8 | 159 | 26.4 | -31.3 | 0 | 0 | 0 | 105.7 | Y60 Q64 | Y60-P62 WeakPolarHBondContact O-CD 3.26Å; P62-Q64 PolarHBondContact O-N 3.24Å | ||
| 63 | Q | 38 | Very low | 39.1 | Very low | 189 Ų | 189 | 117.5 Ų | 117.5 | 88% | 0.883 | 61% | 0.611 | S | S | * | * | trans | -26.5 | 99.9 | 175.4 | -64.5 | 167.9 | -3.5 | 0 | 0 | 110.6 | Y61 P65 | Y61-Q63 PolarHBondContact O-N 2.64Å; Q63-P65 WeakPolarHBondContact O-CD 3.3Å | ||
| 64 | Q | 32.2 | Very low | 38.7 | Very low | 104 Ų | 104 | 120.1 Ų | 120.1 | 49% | 0.486 | 63% | 0.627 | S | S | . | * | trans | -66.7 | 125.7 | 168.9 | -61 | -169 | 14.1 | 0 | 0 | 105.7 | P62 W66 | P62-Q64 PolarHBondContact O-N 3.24Å; Q64-W66 HydrophobicContact CB-CG 4.38Å; Q64-W66 VanDerWaalsContact CB-NE1 3.29Å; Q64-W66 PolarHBondContact O-N 3.32Å | ||
| 65 | P | 37.8 | Very low | 38.1 | Very low | 89 Ų | 89 | 128.1 Ų | 128.1 | 58% | 0.578 | 66% | 0.663 | S | S | * | * | G | 310 helix | trans | -72.3 | 32.1 | -172.1 | 28.7 | -34.3 | 0 | 0 | 0 | 113.7 | Q63 R67 Q68 | Q63-P65 WeakPolarHBondContact O-CD 3.3Å; P65-R67 PolarHBondContact O-N 3.41Å; P65-Q68 PolarHBondContact O-N 2.86Å |
| 66 | W | 34.2 | Very low | 37.6 | Very low | 174 Ų | 174 | 130 Ų | 130 | 66% | 0.659 | 67% | 0.672 | S | S | * | * | G | 310 helix | trans | -67.2 | -16.8 | 168.6 | -46.7 | 110.7 | 0 | 0 | 0 | 112.2 | Q64 Q68 I69 | Q64-W66 HydrophobicContact CB-CG 4.38Å; Q64-W66 VanDerWaalsContact CB-NE1 3.29Å; Q64-W66 PolarHBondContact O-N 3.32Å; W66-Q68 PolarHBondContact O-N 3.26Å; W66-I69 HydrophobicContact CE3-CD1 3.77Å; W66-I69 HydrophobicContact CZ3-CD1 3.98Å; W66-I69 PolarHBondContact O-N 2.83Å |
| 67 | R | 32.7 | Very low | 37 | Very low | 247 Ų | 247 | 132.7 Ų | 132.7 | 93% | 0.932 | 69% | 0.687 | S | S | * | * | G | 310 helix | trans | -67.2 | -8.8 | 166.6 | -79.7 | -158.9 | -168.8 | -137.2 | 5.7 | 113.8 | P65 | P65-R67 PolarHBondContact O-N 3.41Š|
| 68 | Q | 37.9 | Very low | 36.7 | Very low | 152 Ų | 152 | 138.1 Ų | 138.1 | 71% | 0.71 | 71% | 0.711 | S | S | * | * | G | 310 helix | trans | -101.1 | -10 | 172.2 | -77.1 | -170.3 | -35.8 | 0 | 0 | 114.9 | P65 W66 | P65-Q68 PolarHBondContact O-N 2.86Å; W66-Q68 PolarHBondContact O-N 3.26Å |
| 69 | I | 36.6 | Very low | 36.3 | Very low | 115 Ų | 115 | 140.9 Ų | 140.9 | 59% | 0.59 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.9 | -19.1 | 179.5 | -60.6 | 167.5 | 0 | 0 | 0 | 112.1 | W66 S71 | W66-I69 HydrophobicContact CE3-CD1 3.77Å; W66-I69 HydrophobicContact CZ3-CD1 3.98Å; W66-I69 PolarHBondContact O-N 2.83Å; I69-S71 VanDerWaalsContact C-N 3.26Å; I69-S71 PolarHBondContact O-N 3.07Å |
| 70 | G | 33.7 | Very low | 35.9 | Very low | 68 Ų | 68 | 143.6 Ų | 143.6 | 70% | 0.701 | 72% | 0.721 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.7 | -3.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||
| 71 | S | 35.6 | Very low | 35.6 | Very low | 84 Ų | 84 | 140.6 Ų | 140.6 | 59% | 0.587 | 72% | 0.72 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.4 | 9.1 | -179 | -172.2 | 0 | 0 | 0 | 0 | 114 | I69 | I69-S71 VanDerWaalsContact C-N 3.26Å; I69-S71 PolarHBondContact O-N 3.07Å |
| 72 | L | 34.9 | Very low | 35.7 | Very low | 155 Ų | 155 | 141.6 Ų | 141.6 | 81% | 0.812 | 74% | 0.736 | S | S | * | * | S | Bend | trans | -111.4 | 15.2 | 175.2 | -86.5 | 166 | 0 | 0 | 0 | 114 | ||
| 73 | S | 31.6 | Very low | 35.7 | Very low | 95 Ų | 95 | 144.8 Ų | 144.8 | 66% | 0.664 | 74% | 0.742 | S | S | * | * | trans | -107.2 | 55.9 | 160.6 | 59.2 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 74 | Q | 39.4 | Very low | 35.5 | Very low | 175 Ų | 175 | 141.1 Ų | 141.1 | 82% | 0.818 | 73% | 0.731 | S | S | * | * | trans | -121 | 28.3 | 164.3 | -86.3 | -158.8 | -60.6 | 0 | 0 | 112 | ||||
| 75 | L | 39.2 | Very low | 35.8 | Very low | 235 Ų | 235 | 144.5 Ų | 144.5 | 100% | 1.23 | 75% | 0.753 | S | S | * | * | trans | -130.6 | 0 | 161.5 | -75.1 | 167.9 | 0 | 0 | 0 | 108.3 |
Retrieved 75 of 75 residues in 155.2 ms
(Link to these results)