| 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 | 59.5 | Low | 78.4 | Confident | 221 Ų | 221 | 121.8 Ų | 121.8 | 100% | 1.089 | 61% | 0.611 | S | S | * | * | 0 | -34.7 | 0 | -75.3 | -159.5 | -77.5 | 0 | 0 | 113.1 | K3 N4 | M1-K3 PolarHBondContact O-N 3.4Å; M1-N4 PolarHBondContact O-N 3.33Å | |||
| 2 | E | 69.9 | Low | 79.1 | Confident | 163 Ų | 163 | 118.7 Ų | 118.7 | 76% | 0.762 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -61.8 | -35.5 | -174.6 | -64.4 | 177.2 | 163.5 | 0 | 0 | 115.5 | N4 Y5 L6 | E2-N4 VanDerWaalsContact C-N 3.3Å; E2-N4 PolarHBondContact O-N 3.39Å; E2-Y5 PolarHBondContact O-N 3.16Å; E2-L6 PolarHBondContact O-N 3.45Å |
| 3 | K | 72.8 | Confident | 79.9 | Confident | 174 Ų | 174 | 117.2 Ų | 117.2 | 76% | 0.757 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -61.6 | -36.1 | -178.6 | -65.3 | -174.7 | 179.7 | 179.8 | 0 | 113 | M1 Y5 V7 | M1-K3 PolarHBondContact O-N 3.4Å; K3-Y5 VanDerWaalsContact C-N 3.35Å; K3-V7 WeakPolarHBondContact O-CG2 3.41Å; K3-V7 PolarHBondContact O-N 3.49Å |
| 4 | N | 75.9 | Confident | 80.4 | Confident | 110 Ų | 110 | 116.1 Ų | 116.1 | 59% | 0.588 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -72.8 | -30.8 | -178.7 | -66.7 | 0.5 | 0 | 0 | 0 | 112 | M1 E2 S8 | M1-N4 PolarHBondContact O-N 3.33Å; E2-N4 VanDerWaalsContact C-N 3.3Å; E2-N4 PolarHBondContact O-N 3.39Å; N4-S8 WeakPolarHBondContact O-CB 3.28Å; N4-S8 PolarHBondContact O-N 3.2Å |
| 5 | Y | 79.9 | Confident | 80.7 | Confident | 167 Ų | 167 | 117.5 Ų | 117.5 | 66% | 0.655 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -69 | -44.9 | 177.8 | -169.7 | -98.7 | 0 | 0 | 0 | 111.4 | E2 K3 V7 S8 C9 | E2-Y5 PolarHBondContact O-N 3.16Å; K3-Y5 VanDerWaalsContact C-N 3.35Å; Y5-V7 VanDerWaalsContact C-N 3.32Å; Y5-V7 PolarHBondContact O-N 3.28Å; Y5-S8 PolarHBondContact O-N 2.81Å; Y5-C9 WeakPolarHBondContact CE1-SG 3.18Å; Y5-C9 PolarHBondContact O-N 2.86Å; Y5-C9 PolarHBondContact O-SG 3.29Å; Y5-C9 VanDerWaalsContact O-SG 3.37Å |
| 6 | L | 83 | Confident | 80.9 | Confident | 126 Ų | 126 | 114.6 Ų | 114.6 | 66% | 0.66 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -61 | -41.4 | 176.4 | -70.1 | 173.9 | 0 | 0 | 0 | 112.1 | E2 C9 L10 | E2-L6 PolarHBondContact O-N 3.45Å; L6-C9 PolarHBondContact O-N 3.01Å; L6-L10 WeakPolarHBondContact O-CB 3.48Å; L6-L10 PolarHBondContact O-N 2.98Å |
| 7 | V | 80 | Confident | 81 | Confident | 65 Ų | 65 | 113 Ų | 113 | 39% | 0.394 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -63.5 | -45.2 | 175.9 | 173.9 | 0 | 0 | 0 | 0 | 110.7 | K3 Y5 C9 L10 I11 L102 | K3-V7 WeakPolarHBondContact O-CG2 3.41Å; K3-V7 PolarHBondContact O-N 3.49Å; Y5-V7 VanDerWaalsContact C-N 3.32Å; Y5-V7 PolarHBondContact O-N 3.28Å; V7-C9 PolarHBondContact O-N 2.89Å; V7-L10 PolarHBondContact O-N 3.08Å; V7-I11 HydrophobicContact CG1-CD1 3.85Å; V7-I11 WeakPolarHBondContact O-CD1 3.42Å; V7-I11 VanDerWaalsContact O-CG1 3.26Å; V7-I11 WeakPolarHBondContact O-CG1 3.39Å; V7-I11 PolarHBondContact O-N 3.15Å; V7-L102 HydrophobicContact CG1-CD2 4.38Å |
| 8 | S | 81.9 | Confident | 81 | Confident | 65 Ų | 65 | 113.1 Ų | 113.1 | 46% | 0.455 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -60.7 | -45.5 | 176.6 | -176.8 | 0 | 0 | 0 | 0 | 112.1 | N4 Y5 L10 I11 V12 | N4-S8 WeakPolarHBondContact O-CB 3.28Å; N4-S8 PolarHBondContact O-N 3.2Å; Y5-S8 PolarHBondContact O-N 2.81Å; S8-L10 PolarHBondContact O-N 3.3Å; S8-I11 PolarHBondContact O-N 3.37Å; S8-V12 WeakPolarHBondContact O-CG2 3.41Å; S8-V12 PolarHBondContact O-N 2.73Å; S8-V12 VanDerWaalsContact O-N 3.09Å |
| 9 | C | 85.4 | Confident | 80.9 | Confident | 44 Ų | 44 | 110.4 Ų | 110.4 | 30% | 0.297 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -60.8 | -44 | 175.7 | -71.5 | 0 | 0 | 0 | 0 | 112.2 | Y5 L6 V7 I11 V12 I13 | Y5-C9 WeakPolarHBondContact CE1-SG 3.18Å; Y5-C9 PolarHBondContact O-N 2.86Å; Y5-C9 PolarHBondContact O-SG 3.29Å; Y5-C9 VanDerWaalsContact O-SG 3.37Å; L6-C9 PolarHBondContact O-N 3.01Å; V7-C9 PolarHBondContact O-N 2.89Å; C9-I11 VanDerWaalsContact C-N 3.32Å; C9-I11 PolarHBondContact O-N 2.75Å; C9-V12 PolarHBondContact O-N 2.82Å; C9-I13 VanDerWaalsContact O-CG1 3.27Å; C9-I13 WeakPolarHBondContact O-CG1 3.27Å; C9-I13 PolarHBondContact O-N 3.3Å |
| 10 | L | 87.5 | Confident | 80.6 | Confident | 109 Ų | 109 | 111.7 Ų | 111.7 | 57% | 0.571 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -61.2 | -42 | 178.4 | -165.6 | 83.6 | 0 | 0 | 0 | 111.3 | L6 V7 S8 I13 L14 | L6-L10 WeakPolarHBondContact O-CB 3.48Å; L6-L10 PolarHBondContact O-N 2.98Å; V7-L10 PolarHBondContact O-N 3.08Å; S8-L10 PolarHBondContact O-N 3.3Å; L10-I13 PolarHBondContact O-N 3.45Å; L10-L14 HydrophobicContact CD2-CD1 4.44Å; L10-L14 HydrophobicContact CG-CD1 4.26Å; L10-L14 WeakPolarHBondContact O-CB 3.34Å; L10-L14 VanDerWaalsContact O-CG 3.3Å; L10-L14 WeakPolarHBondContact O-CG 3.38Å; L10-L14 PolarHBondContact O-N 2.77Å |
| 11 | I | 86.2 | Confident | 80 | Confident | 96 Ų | 96 | 112.6 Ų | 112.6 | 49% | 0.492 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -62.3 | -45 | 177.8 | -68.7 | 164.5 | 0 | 0 | 0 | 111 | V7 S8 C9 L14 F15 | V7-I11 HydrophobicContact CG1-CD1 3.85Å; V7-I11 WeakPolarHBondContact O-CD1 3.42Å; V7-I11 VanDerWaalsContact O-CG1 3.26Å; V7-I11 WeakPolarHBondContact O-CG1 3.39Å; V7-I11 PolarHBondContact O-N 3.15Å; S8-I11 PolarHBondContact O-N 3.37Å; C9-I11 VanDerWaalsContact C-N 3.32Å; C9-I11 PolarHBondContact O-N 2.75Å; I11-L14 PolarHBondContact O-N 2.99Å; I11-F15 WeakPolarHBondContact O-CB 3.29Å; I11-F15 PolarHBondContact O-N 3.33Å |
| 12 | V | 87.5 | Confident | 80.3 | Confident | 84 Ų | 84 | 106.6 Ų | 106.6 | 51% | 0.509 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -63.2 | -44 | 178.4 | 174.3 | 0 | 0 | 0 | 0 | 111 | S8 C9 L14 F15 V16 | S8-V12 WeakPolarHBondContact O-CG2 3.41Å; S8-V12 PolarHBondContact O-N 2.73Å; S8-V12 VanDerWaalsContact O-N 3.09Å; C9-V12 PolarHBondContact O-N 2.82Å; V12-L14 PolarHBondContact O-N 2.92Å; V12-F15 PolarHBondContact O-N 2.96Å; V12-V16 WeakPolarHBondContact O-CG2 3.38Å; V12-V16 PolarHBondContact O-N 3.49Å |
| 13 | I | 88.9 | Confident | 79.9 | Confident | 100 Ų | 100 | 101.8 Ų | 101.8 | 51% | 0.513 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -61.3 | -46.7 | 178 | -68.3 | 164.9 | 0 | 0 | 0 | 110.7 | C9 L10 F15 V16 L17 | C9-I13 VanDerWaalsContact O-CG1 3.27Å; C9-I13 WeakPolarHBondContact O-CG1 3.27Å; C9-I13 PolarHBondContact O-N 3.3Å; L10-I13 PolarHBondContact O-N 3.45Å; I13-F15 VanDerWaalsContact C-N 3.31Å; I13-F15 PolarHBondContact O-N 3.04Å; I13-V16 PolarHBondContact O-N 3.47Å; I13-L17 HydrophobicContact CG2-CD1 3.95Å; I13-L17 HydrophobicContact CG2-CG 4.49Å; I13-L17 WeakPolarHBondContact O-CG 3.25Å; I13-L17 PolarHBondContact O-N 3.39Å |
| 14 | L | 87.6 | Confident | 79 | Confident | 101 Ų | 101 | 98 Ų | 98 | 53% | 0.529 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -63.2 | -37.9 | 177.9 | -71.6 | 172.7 | 0 | 0 | 0 | 112.1 | L10 I11 V12 F18 | L10-L14 HydrophobicContact CD2-CD1 4.44Å; L10-L14 HydrophobicContact CG-CD1 4.26Å; L10-L14 WeakPolarHBondContact O-CB 3.34Å; L10-L14 VanDerWaalsContact O-CG 3.3Å; L10-L14 WeakPolarHBondContact O-CG 3.38Å; L10-L14 PolarHBondContact O-N 2.77Å; I11-L14 PolarHBondContact O-N 2.99Å; V12-L14 PolarHBondContact O-N 2.92Å; L14-F18 VanDerWaalsContact O-CB 3.27Å; L14-F18 WeakPolarHBondContact O-CB 3.39Å; L14-F18 PolarHBondContact O-N 3.26Å |
| 15 | F | 84.6 | Confident | 77.8 | Confident | 137 Ų | 137 | 95.6 Ų | 95.6 | 60% | 0.601 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -64.2 | -46.6 | 176.5 | -175.7 | -98.2 | 0 | 0 | 0 | 111.8 | I11 V12 I13 F18 T19 | I11-F15 WeakPolarHBondContact O-CB 3.29Å; I11-F15 PolarHBondContact O-N 3.33Å; V12-F15 PolarHBondContact O-N 2.96Å; I13-F15 VanDerWaalsContact C-N 3.31Å; I13-F15 PolarHBondContact O-N 3.04Å; F15-F18 PolarHBondContact O-N 2.98Å; F15-T19 HydrophobicContact CD1-CG2 4.23Å; F15-T19 HydrophobicContact CE1-CG2 3.85Å; F15-T19 HydrophobicContact CE2-CG2 4.45Å; F15-T19 HydrophobicContact CZ-CG2 3.98Å; F15-T19 WeakPolarHBondContact O-CG2 3.27Å; F15-T19 PolarHBondContact O-N 3.5Å; F15-T19 PolarHBondContact O-OG1 3.3Å |
| 16 | V | 83.7 | Confident | 76.6 | Confident | 71 Ų | 71 | 96.9 Ų | 96.9 | 43% | 0.43 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -60.5 | -48.7 | 177.1 | 173 | 0 | 0 | 0 | 0 | 110.7 | V12 I13 F18 T19 E20 | V12-V16 WeakPolarHBondContact O-CG2 3.38Å; V12-V16 PolarHBondContact O-N 3.49Å; I13-V16 PolarHBondContact O-N 3.47Å; V16-F18 VanDerWaalsContact C-N 3.31Å; V16-F18 PolarHBondContact O-N 3.06Å; V16-T19 WeakPolarHBondContact CA-OG1 3.34Å; V16-T19 PolarHBondContact O-N 3.45Å; V16-T19 VanDerWaalsContact O-N 3.15Å; V16-T19 PolarHBondContact O-OG1 3.37Å; V16-E20 PolarHBondContact O-N 2.99Å |
| 17 | L | 83.3 | Confident | 75.1 | Confident | 88 Ų | 88 | 95.7 Ų | 95.7 | 46% | 0.461 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -59.2 | -42.8 | 177.2 | -71.5 | 172.3 | 0 | 0 | 0 | 111.8 | I13 E20 I21 | I13-L17 HydrophobicContact CG2-CD1 3.95Å; I13-L17 HydrophobicContact CG2-CG 4.49Å; I13-L17 WeakPolarHBondContact O-CG 3.25Å; I13-L17 PolarHBondContact O-N 3.39Å; L17-E20 PolarHBondContact O-N 3.43Å; L17-I21 WeakPolarHBondContact O-CB 3.42Å; L17-I21 WeakPolarHBondContact O-CD1 3.17Å; L17-I21 WeakPolarHBondContact O-CG1 3.4Å; L17-I21 PolarHBondContact O-N 3.36Å |
| 18 | F | 79.8 | Confident | 73.7 | Confident | 114 Ų | 114 | 98.1 Ų | 98.1 | 50% | 0.5 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -63.3 | -42.8 | 176.5 | -173.7 | -97.4 | 0 | 0 | 0 | 111.6 | L14 F15 V16 E20 I21 N22 | L14-F18 VanDerWaalsContact O-CB 3.27Å; L14-F18 WeakPolarHBondContact O-CB 3.39Å; L14-F18 PolarHBondContact O-N 3.26Å; F15-F18 PolarHBondContact O-N 2.98Å; V16-F18 VanDerWaalsContact C-N 3.31Å; V16-F18 PolarHBondContact O-N 3.06Å; F18-E20 VanDerWaalsContact C-N 3.3Å; F18-E20 PolarHBondContact O-N 2.99Å; F18-I21 PolarHBondContact O-N 3.43Å; F18-N22 VanDerWaalsContact CD1-ND2 3.25Å; F18-N22 WeakPolarHBondContact CD1-ND2 3.07Å; F18-N22 VanDerWaalsContact CD2-ND2 3.34Å; F18-N22 WeakPolarHBondContact CD2-ND2 3.19Å; F18-N22 WeakPolarHBondContact CE1-ND2 3.3Å; F18-N22 WeakPolarHBondContact CE2-ND2 3.14Å; F18-N22 WeakPolarHBondContact CG-ND2 3.42Å; F18-N22 WeakPolarHBondContact CZ-ND2 3.41Å; F18-N22 WeakPolarHBondContact O-CB 3.38Å; F18-N22 PolarHBondContact O-N 2.93Å; F18-N22 PolarHBondContact O-ND2 3.27Å |
| 19 | T | 78.9 | Confident | 72.2 | Confident | 63 Ų | 63 | 102.9 Ų | 102.9 | 39% | 0.387 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -66.1 | -32.9 | 176.8 | 54.9 | 0 | 0 | 0 | 0 | 112.7 | F15 V16 G23 | F15-T19 HydrophobicContact CD1-CG2 4.23Å; F15-T19 HydrophobicContact CE1-CG2 3.85Å; F15-T19 HydrophobicContact CE2-CG2 4.45Å; F15-T19 HydrophobicContact CZ-CG2 3.98Å; F15-T19 WeakPolarHBondContact O-CG2 3.27Å; F15-T19 PolarHBondContact O-N 3.5Å; F15-T19 PolarHBondContact O-OG1 3.3Å; V16-T19 WeakPolarHBondContact CA-OG1 3.34Å; V16-T19 PolarHBondContact O-N 3.45Å; V16-T19 VanDerWaalsContact O-N 3.15Å; V16-T19 PolarHBondContact O-OG1 3.37Å; T19-G23 VanDerWaalsContact O-CA 3.28Å; T19-G23 WeakPolarHBondContact O-CA 3.1Å; T19-G23 PolarHBondContact O-N 2.9Å |
| 20 | E | 75 | Confident | 70.6 | Confident | 136 Ų | 136 | 108.1 Ų | 108.1 | 64% | 0.636 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -74 | -40.9 | 178.7 | -167 | 153.9 | -173.4 | 0 | 0 | 111.5 | V16 L17 F18 S24 | V16-E20 PolarHBondContact O-N 2.99Å; L17-E20 PolarHBondContact O-N 3.43Å; F18-E20 VanDerWaalsContact C-N 3.3Å; F18-E20 PolarHBondContact O-N 2.99Å; E20-S24 PolarHBondContact O-N 3.4Å |
| 21 | I | 69.3 | Low | 69.1 | Low | 130 Ų | 130 | 109.1 Ų | 109.1 | 67% | 0.667 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -64.5 | -42.9 | 175.2 | -65.2 | 163.1 | 0 | 0 | 0 | 111 | L17 F18 | L17-I21 WeakPolarHBondContact O-CB 3.42Å; L17-I21 WeakPolarHBondContact O-CD1 3.17Å; L17-I21 WeakPolarHBondContact O-CG1 3.4Å; L17-I21 PolarHBondContact O-N 3.36Å; F18-I21 PolarHBondContact O-N 3.43Å |
| 22 | N | 65.9 | Low | 67.9 | Low | 95 Ų | 95 | 113.8 Ų | 113.8 | 51% | 0.508 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -83 | -26.3 | -179.4 | -68 | -69.4 | 0 | 0 | 0 | 113.5 | F18 S24 | F18-N22 VanDerWaalsContact CD1-ND2 3.25Å; F18-N22 WeakPolarHBondContact CD1-ND2 3.07Å; F18-N22 VanDerWaalsContact CD2-ND2 3.34Å; F18-N22 WeakPolarHBondContact CD2-ND2 3.19Å; F18-N22 WeakPolarHBondContact CE1-ND2 3.3Å; F18-N22 WeakPolarHBondContact CE2-ND2 3.14Å; F18-N22 WeakPolarHBondContact CG-ND2 3.42Å; F18-N22 WeakPolarHBondContact CZ-ND2 3.41Å; F18-N22 WeakPolarHBondContact O-CB 3.38Å; F18-N22 PolarHBondContact O-N 2.93Å; F18-N22 PolarHBondContact O-ND2 3.27Å; N22-S24 VanDerWaalsContact C-N 3.34Å |
| 23 | G | 60.6 | Low | 66.3 | Low | 62 Ų | 62 | 114.9 Ų | 114.9 | 64% | 0.639 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -78.2 | -16.6 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | T19 G25 | T19-G23 VanDerWaalsContact O-CA 3.28Å; T19-G23 WeakPolarHBondContact O-CA 3.1Å; T19-G23 PolarHBondContact O-N 2.9Å; G23-G25 PolarHBondContact O-N 2.96Å |
| 24 | S | 54.5 | Low | 65 | Low | 94 Ų | 94 | 119.7 Ų | 119.7 | 66% | 0.657 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.6 | 29.5 | 173.1 | -169.7 | 0 | 0 | 0 | 0 | 113.2 | E20 N22 K26 | E20-S24 PolarHBondContact O-N 3.4Å; N22-S24 VanDerWaalsContact C-N 3.34Å; S24-K26 PolarHBondContact O-N 2.88Å; S24-K26 VanDerWaalsContact O-N 3.08Å |
| 25 | G | 50 | Low | 63.3 | Low | 61 Ų | 61 | 121.9 Ų | 121.9 | 63% | 0.629 | 65% | 0.653 | S | S | * | * | trans | -78.6 | 47.9 | 163.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | G23 S27 | G23-G25 PolarHBondContact O-N 2.96Å; G25-S27 VanDerWaalsContact C-N 3.29Å; G25-S27 PolarHBondContact O-N 2.75Å | ||
| 26 | K | 55.5 | Low | 61.9 | Low | 194 Ų | 194 | 123.5 Ų | 123.5 | 84% | 0.843 | 67% | 0.667 | S | S | * | * | trans | -70.5 | 96.8 | 164.3 | -76.8 | -178 | -179.8 | 174.4 | 0 | 106.3 | S24 | S24-K26 PolarHBondContact O-N 2.88Å; S24-K26 VanDerWaalsContact O-N 3.08Å | ||
| 27 | S | 52 | Low | 60.5 | Low | 101 Ų | 101 | 127.6 Ų | 127.6 | 71% | 0.706 | 69% | 0.685 | S | S | * | * | trans | -38.5 | 132.1 | 172 | -63.2 | 0 | 0 | 0 | 0 | 109.9 | G25 M29 | G25-S27 VanDerWaalsContact C-N 3.29Å; G25-S27 PolarHBondContact O-N 2.75Å; S27-M29 PolarHBondContact O-N 3.29Å | ||
| 28 | P | 50.7 | Low | 59.4 | Low | 115 Ų | 115 | 128.9 Ų | 128.9 | 75% | 0.747 | 70% | 0.699 | S | S | * | * | trans | -56.5 | 114 | 165.6 | 24.9 | -30.4 | 0 | 0 | 0 | 105.7 | L30 | P28-L30 PolarHBondContact O-N 3.28Š| ||
| 29 | M | 49.9 | Very low | 58.4 | Low | 165 Ų | 165 | 132.1 Ų | 132.1 | 81% | 0.813 | 72% | 0.716 | S | S | * | * | trans | -56.8 | 94.2 | 166.2 | -178.8 | 174.1 | 174.4 | 0 | 0 | 105.2 | S27 I31 | S27-M29 PolarHBondContact O-N 3.29Å; M29-I31 HydrophobicContact CE-CG1 4.49Å; M29-I31 HydrophobicContact CG-CG1 4.2Å; M29-I31 PolarHBondContact O-N 2.89Å | ||
| 30 | L | 51 | Low | 57 | Low | 154 Ų | 154 | 138.2 Ų | 138.2 | 81% | 0.806 | 74% | 0.739 | S | S | * | * | trans | -67.2 | 84.3 | 169.9 | -112.4 | 166.5 | 0 | 0 | 0 | 105.2 | P28 R32 | P28-L30 PolarHBondContact O-N 3.28Å; L30-R32 PolarHBondContact O-N 2.9Å | ||
| 31 | I | 56.4 | Low | 56 | Low | 131 Ų | 131 | 137.4 Ų | 137.4 | 67% | 0.672 | 74% | 0.744 | S | S | * | * | trans | -55.1 | 107.8 | 163 | -65.9 | 170.2 | 0 | 0 | 0 | 104.6 | M29 P33 | M29-I31 HydrophobicContact CE-CG1 4.49Å; M29-I31 HydrophobicContact CG-CG1 4.2Å; M29-I31 PolarHBondContact O-N 2.89Å; I31-P33 WeakPolarHBondContact O-CD 3.41Å | ||
| 32 | R | 60.7 | Low | 55 | Low | 194 Ų | 194 | 136.6 Ų | 136.6 | 73% | 0.732 | 75% | 0.745 | S | S | * | * | trans | -67.5 | 124.5 | 174.2 | -70 | -170.8 | -168.6 | -167.7 | 4.8 | 107.3 | L30 Y34 | L30-R32 PolarHBondContact O-N 2.9Å; R32-Y34 PolarHBondContact O-N 3.38Å | ||
| 33 | P | 54.3 | Low | 54.2 | Low | 107 Ų | 107 | 137.9 Ų | 137.9 | 70% | 0.695 | 76% | 0.757 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.3 | 47.4 | 180 | 31.8 | -33.6 | 0 | 0 | 0 | 112.4 | I31 | I31-P33 WeakPolarHBondContact O-CD 3.41Š|
| 34 | Y | 61.2 | Low | 53.7 | Low | 201 Ų | 201 | 143.5 Ų | 143.5 | 79% | 0.788 | 77% | 0.766 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -134.3 | 4.6 | 179 | -66.8 | -70 | 0 | 0 | 0 | 115.1 | R32 L36 | R32-Y34 PolarHBondContact O-N 3.38Å; Y34-L36 VanDerWaalsContact C-N 3.3Å; Y34-L36 PolarHBondContact O-N 3.37Å |
| 35 | D | 53.2 | Low | 53.7 | Low | 147 Ų | 147 | 145.1 Ų | 145.1 | 79% | 0.786 | 77% | 0.773 | S | S | * | * | trans | -90.1 | 15.4 | 176.2 | -65.9 | -31.9 | 0 | 0 | 0 | 113.6 | ||||
| 36 | L | 54.5 | Low | 53.7 | Low | 171 Ų | 171 | 147.1 Ų | 147.1 | 90% | 0.895 | 77% | 0.773 | S | S | * | * | trans | -102.3 | 63.4 | 172.6 | -65.1 | 174.3 | 0 | 0 | 0 | 110.4 | Y34 | Y34-L36 VanDerWaalsContact C-N 3.3Å; Y34-L36 PolarHBondContact O-N 3.37Å | ||
| 37 | L | 55.1 | Low | 53.2 | Low | 156 Ų | 156 | 143.9 Ų | 143.9 | 82% | 0.817 | 77% | 0.772 | S | S | * | * | trans | -80.5 | 126.1 | 161 | -161.4 | 81.9 | 0 | 0 | 0 | 107.2 | E39 | L37-E39 PolarHBondContact O-N 3.46Å; L37-E39 VanDerWaalsContact O-N 3.16Å | ||
| 38 | P | 59.2 | Low | 53.4 | Low | 116 Ų | 116 | 145.9 Ų | 145.9 | 75% | 0.753 | 77% | 0.773 | S | S | * | * | trans | -69.6 | 115.3 | -174.3 | 26.4 | -31.3 | 0 | 0 | 0 | 109.9 | E40 | P38-E40 PolarHBondContact O-N 3.39Š| ||
| 39 | E | 57.9 | Low | 52.8 | Low | 182 Ų | 182 | 146.1 Ų | 146.1 | 85% | 0.85 | 77% | 0.772 | S | S | * | * | trans | -61.8 | 127.4 | 166.3 | -84.5 | -159.2 | 148.5 | 0 | 0 | 109.5 | L37 T41 | L37-E39 PolarHBondContact O-N 3.46Å; L37-E39 VanDerWaalsContact O-N 3.16Å; E39-T41 PolarHBondContact O-N 3.25Å | ||
| 40 | E | 50 | Low | 52.6 | Low | 190 Ų | 190 | 144.2 Ų | 144.2 | 89% | 0.888 | 77% | 0.77 | S | S | * | * | trans | -49.9 | 132 | 171.8 | -60.2 | -173.7 | 124.4 | 0 | 0 | 111.4 | P38 | P38-E40 PolarHBondContact O-N 3.39Š| ||
| 41 | T | 53.8 | Low | 52.3 | Low | 119 Ų | 119 | 145.4 Ų | 145.4 | 73% | 0.73 | 77% | 0.772 | S | S | * | * | trans | -155.4 | 115 | 155.8 | 5.6 | 0 | 0 | 0 | 0 | 109.1 | E39 | E39-T41 PolarHBondContact O-N 3.25Š| ||
| 42 | T | 48.9 | Very low | 51.8 | Low | 114 Ų | 114 | 148 Ų | 148 | 70% | 0.699 | 78% | 0.781 | S | S | * | * | trans | 65.3 | 117 | 133.5 | -33.7 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 43 | T | 48.3 | Very low | 50.9 | Low | 122 Ų | 122 | 144.2 Ų | 144.2 | 75% | 0.748 | 78% | 0.784 | S | S | * | * | 176.8 | 151.4 | 62.4 | -21 | 0 | 0 | 0 | 0 | 107.3 | |||||
| 44 | E | 50.6 | Low | 50.3 | Low | 179 Ų | 179 | 148.1 Ų | 148.1 | 84% | 0.836 | 79% | 0.793 | S | S | * | * | trans | -37.3 | 143.7 | 167.1 | -63.9 | 174.3 | 104.6 | 0 | 0 | 114.3 | ||||
| 45 | T | 54 | Low | 49.8 | Very low | 129 Ų | 129 | 149.7 Ų | 149.7 | 79% | 0.791 | 80% | 0.798 | S | S | * | * | 171.5 | 122.8 | 125 | -72.8 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 46 | T | 51.4 | Low | 49.3 | Very low | 102 Ų | 102 | 148.2 Ų | 148.2 | 63% | 0.626 | 80% | 0.796 | S | S | * | * | trans | 75.8 | 122.9 | 161.1 | 4.7 | 0 | 0 | 0 | 0 | 120.5 | I48 | T46-I48 HydrophobicContact CG2-CD1 4.29Å; T46-I48 HydrophobicContact CG2-CG1 4.01Å | ||
| 47 | P | 44 | Very low | 48.6 | Very low | 127 Ų | 127 | 150 Ų | 150 | 83% | 0.825 | 80% | 0.797 | S | S | * | * | trans | -88.1 | 113.6 | 156.5 | 33.4 | -23 | 0 | 0 | 0 | 108.6 | ||||
| 48 | I | 55.8 | Low | 48.1 | Very low | 143 Ų | 143 | 151.5 Ų | 151.5 | 73% | 0.733 | 80% | 0.8 | S | S | * | * | trans | -119.6 | 114.1 | 165.9 | -51.7 | -177.4 | 0 | 0 | 0 | 108.1 | T46 | T46-I48 HydrophobicContact CG2-CD1 4.29Å; T46-I48 HydrophobicContact CG2-CG1 4.01Å | ||
| 49 | T | 39.4 | Very low | 47.4 | Very low | 119 Ų | 119 | 155.2 Ų | 155.2 | 73% | 0.73 | 81% | 0.807 | S | S | * | * | trans | -41 | 129.9 | 166.6 | -42.2 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 50 | T | 46 | Very low | 46.8 | Very low | 125 Ų | 125 | 152.1 Ų | 152.1 | 77% | 0.767 | 81% | 0.806 | S | S | * | * | trans | -148.5 | 90.2 | 149.9 | -53.5 | 0 | 0 | 0 | 0 | 107.6 | E52 | T50-E52 PolarHBondContact O-N 3.46Š| ||
| 51 | E | 42.9 | Very low | 46.6 | Very low | 180 Ų | 180 | 153 Ų | 153 | 84% | 0.841 | 81% | 0.81 | S | S | * | * | trans | -61.7 | 116.9 | 149.7 | -71.5 | -169.8 | 141.4 | 0 | 0 | 106.8 | ||||
| 52 | E | 46.1 | Very low | 46.5 | Very low | 185 Ų | 185 | 156 Ų | 156 | 86% | 0.864 | 82% | 0.815 | S | S | * | * | trans | 170 | 105 | 147.7 | -98.8 | -174.1 | 150.9 | 0 | 0 | 107.8 | T50 | T50-E52 PolarHBondContact O-N 3.46Š| ||
| 53 | S | 42.4 | Very low | 46.4 | Very low | 115 Ų | 115 | 154.9 Ų | 154.9 | 80% | 0.804 | 81% | 0.81 | S | S | * | * | 169.2 | 89.7 | 124.3 | -168.5 | 0 | 0 | 0 | 0 | 108.7 | R55 | S53-R55 PolarHBondContact O-N 3.32Š| |||
| 54 | Q | 41.6 | Very low | 46.3 | Very low | 189 Ų | 189 | 158.2 Ų | 158.2 | 88% | 0.883 | 82% | 0.815 | S | S | * | * | trans | -53.9 | 120.1 | 156 | -65.6 | 171 | -24.6 | 0 | 0 | 109.3 | ||||
| 55 | R | 50.4 | Low | 46.3 | Very low | 234 Ų | 234 | 157.3 Ų | 157.3 | 88% | 0.883 | 81% | 0.811 | S | S | * | * | trans | -165.2 | 133.5 | 133.9 | -109.6 | -171.1 | -100.7 | -172.3 | -3.3 | 110.5 | S53 | S53-R55 PolarHBondContact O-N 3.32Š| ||
| 56 | P | 42.2 | Very low | 46.1 | Very low | 115 Ų | 115 | 160.9 Ų | 160.9 | 75% | 0.747 | 82% | 0.818 | S | S | * | * | trans | -81 | 131.6 | -169.4 | 33.1 | -31.7 | 0 | 0 | 0 | 111.3 | E58 | P56-E58 PolarHBondContact O-N 2.94Š| ||
| 57 | F | 40.7 | Very low | 46 | Very low | 208 Ų | 208 | 160.1 Ų | 160.1 | 91% | 0.912 | 82% | 0.817 | S | S | * | * | S | Bend | 21.5 | 86.5 | 126.7 | -135.1 | -92.3 | 0 | 0 | 0 | 116.2 | |||
| 58 | E | 43.7 | Very low | 46.4 | Very low | 188 Ų | 188 | 162.2 Ų | 162.2 | 88% | 0.879 | 82% | 0.816 | S | S | * | * | trans | 176.4 | 74.4 | 161.7 | -104.1 | 164.7 | -155.1 | 0 | 0 | 110.8 | P56 | P56-E58 PolarHBondContact O-N 2.94Š| ||
| 59 | E | 45.1 | Very low | 46.2 | Very low | 194 Ų | 194 | 164.2 Ų | 164.2 | 91% | 0.907 | 82% | 0.822 | S | S | * | * | S | Bend | trans | -178.4 | 92.5 | 157.5 | -111.6 | 179.5 | 152 | 0 | 0 | 109.9 | ||
| 60 | S | 46.5 | Very low | 46.6 | Very low | 118 Ų | 118 | 162.6 Ų | 162.6 | 83% | 0.825 | 81% | 0.814 | S | S | * | * | trans | 167.5 | 24.1 | 147.9 | 62 | 0 | 0 | 0 | 0 | 113.8 | Q62 | S60-Q62 VanDerWaalsContact C-N 3.3Å; S60-Q62 PolarHBondContact O-N 3.47Å | ||
| 61 | Q | 45.1 | Very low | 46.7 | Very low | 209 Ų | 209 | 165.2 Ų | 165.2 | 98% | 0.977 | 82% | 0.815 | S | S | * | * | trans | -81 | 81.4 | 157.6 | -75.6 | -157.2 | 29.3 | 0 | 0 | 109.1 | ||||
| 62 | Q | 52 | Low | 47.2 | Very low | 180 Ų | 180 | 164.4 Ų | 164.4 | 84% | 0.841 | 81% | 0.811 | S | S | * | * | trans | -132.9 | 134.6 | 160.7 | -124.6 | 178.2 | -16.3 | 0 | 0 | 108.1 | S60 | S60-Q62 VanDerWaalsContact C-N 3.3Å; S60-Q62 PolarHBondContact O-N 3.47Å | ||
| 63 | P | 46.4 | Very low | 47.4 | Very low | 92 Ų | 92 | 162.9 Ų | 162.9 | 60% | 0.597 | 80% | 0.804 | S | S | * | * | trans | -83 | 141.3 | -133.3 | 31.5 | -35 | 0 | 0 | 0 | 112.7 | E65 | P63-E65 HydrophobicContact CB-CB 4.37Å; P63-E65 HydrophobicContact CB-CG 4.13Å; P63-E65 PolarHBondContact O-N 3.31Å | ||
| 64 | F | 45.7 | Very low | 47.9 | Very low | 192 Ų | 192 | 160.4 Ų | 160.4 | 84% | 0.842 | 79% | 0.786 | S | S | * | * | trans | -68.5 | 54.5 | 170.2 | -149.1 | -93.2 | 0 | 0 | 0 | 110.6 | ||||
| 65 | E | 50.5 | Low | 48.4 | Very low | 160 Ų | 160 | 158 Ų | 158 | 75% | 0.748 | 78% | 0.775 | S | S | * | * | trans | -110.9 | -4.6 | -173.9 | -83.1 | -174.5 | 171 | 0 | 0 | 114.4 | P63 | P63-E65 HydrophobicContact CB-CB 4.37Å; P63-E65 HydrophobicContact CB-CG 4.13Å; P63-E65 PolarHBondContact O-N 3.31Å | ||
| 66 | E | 49.8 | Very low | 48.5 | Very low | 204 Ų | 204 | 153.9 Ų | 153.9 | 95% | 0.953 | 77% | 0.766 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.4 | 1.2 | 178.6 | -96.1 | -172.6 | 141.9 | 0 | 0 | 115.2 | ||
| 67 | S | 50.4 | Low | 49.2 | Very low | 85 Ų | 85 | 152 Ų | 152 | 59% | 0.594 | 75% | 0.754 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.9 | 17.2 | -176.9 | 64.5 | 0 | 0 | 0 | 0 | 115.5 | ||
| 68 | Q | 51.8 | Low | 50 | Low | 172 Ų | 172 | 147.1 Ų | 147.1 | 80% | 0.804 | 74% | 0.737 | S | S | * | * | trans | -110.9 | 16.2 | -175.5 | -78.4 | -152.3 | 45.4 | 0 | 0 | 117 | ||||
| 69 | Q | 51.5 | Low | 50.8 | Low | 185 Ų | 185 | 142.1 Ų | 142.1 | 86% | 0.864 | 72% | 0.719 | S | S | * | * | S | Bend | trans | -141.4 | 127.4 | 171.4 | -90.6 | 177.7 | -36.4 | 0 | 0 | 111.2 | ||
| 70 | P | 48.1 | Very low | 51.7 | Low | 85 Ų | 85 | 138.5 Ų | 138.5 | 55% | 0.552 | 71% | 0.705 | S | S | * | * | cis | -124.3 | 107.1 | 9.7 | 34.7 | -14.7 | 0 | 0 | 0 | 112.3 | E72 | P70-E72 HydrophobicContact CB-CB 4.5Å; P70-E72 PolarHBondContact O-N 3.43Å | ||
| 71 | F | 48.5 | Very low | 53.1 | Low | 180 Ų | 180 | 137.2 Ų | 137.2 | 79% | 0.789 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72 | 14.1 | 161.8 | -134.9 | -92.1 | 0 | 0 | 0 | 112.2 | S74 | F71-S74 WeakPolarHBondContact CD1-OG 3.3Å; F71-S74 PolarHBondContact O-OG 3.21Å; F71-S74 VanDerWaalsContact O-OG 3.06Å |
| 72 | E | 52.4 | Low | 54.8 | Low | 162 Ų | 162 | 132.7 Ų | 132.7 | 76% | 0.757 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.8 | -20.6 | 179.7 | -70.4 | -168.6 | 156.1 | 0 | 0 | 113.5 | P70 S74 Q75 | P70-E72 HydrophobicContact CB-CB 4.5Å; P70-E72 PolarHBondContact O-N 3.43Å; E72-S74 VanDerWaalsContact C-N 3.31Å; E72-S74 PolarHBondContact O-N 3.5Å; E72-Q75 PolarHBondContact O-N 2.97Å |
| 73 | E | 51.8 | Low | 56.3 | Low | 154 Ų | 154 | 129 Ų | 129 | 72% | 0.72 | 65% | 0.653 | S | S | * | * | G | 310 helix | trans | -72.1 | -25.1 | 175.3 | -83.1 | -168.7 | 138.7 | 0 | 0 | 112.9 | Q75 | E73-Q75 VanDerWaalsContact C-N 3.28Å; E73-Q75 PolarHBondContact O-N 2.86Å |
| 74 | S | 52.4 | Low | 57.9 | Low | 63 Ų | 63 | 129.2 Ų | 129.2 | 44% | 0.441 | 65% | 0.647 | S | S | . | * | G | 310 helix | trans | -77 | -5 | 178 | 43.5 | 0 | 0 | 0 | 0 | 115.1 | F71 E72 P77 | F71-S74 WeakPolarHBondContact CD1-OG 3.3Å; F71-S74 PolarHBondContact O-OG 3.21Å; F71-S74 VanDerWaalsContact O-OG 3.06Å; E72-S74 VanDerWaalsContact C-N 3.31Å; E72-S74 PolarHBondContact O-N 3.5Å; S74-P77 VanDerWaalsContact O-CD 3.29Å; S74-P77 WeakPolarHBondContact O-CD 3.5Å; S74-P77 WeakPolarHBondContact O-CG 3.26Å |
| 75 | Q | 52.4 | Low | 59.8 | Low | 139 Ų | 139 | 125 Ų | 125 | 65% | 0.65 | 63% | 0.633 | S | S | * | * | G | 310 helix | trans | -95.3 | -15.8 | 175.2 | -72.4 | -153.5 | 51.8 | 0 | 0 | 114.5 | E72 E73 L78 | E72-Q75 PolarHBondContact O-N 2.97Å; E73-Q75 VanDerWaalsContact C-N 3.28Å; E73-Q75 PolarHBondContact O-N 2.86Å; Q75-L78 PolarHBondContact O-N 3.41Å |
| 76 | Q | 52.7 | Low | 61.6 | Low | 147 Ų | 147 | 123.9 Ų | 123.9 | 69% | 0.687 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -63.1 | -31.7 | 172.2 | -94.2 | -179.3 | 10.4 | 0 | 0 | 116.5 | L78 T79 L80 | Q76-L78 PolarHBondContact O-N 3.09Å; Q76-T79 PolarHBondContact O-N 3.02Å; Q76-L80 PolarHBondContact O-N 2.82Å |
| 77 | P | 55.5 | Low | 63.5 | Low | 75 Ų | 75 | 118.9 Ų | 118.9 | 49% | 0.487 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -67.4 | -22.8 | -179.3 | 25.6 | -33.5 | 0 | 0 | 0 | 112.6 | S74 N81 | S74-P77 VanDerWaalsContact O-CD 3.29Å; S74-P77 WeakPolarHBondContact O-CD 3.5Å; S74-P77 WeakPolarHBondContact O-CG 3.26Å; P77-N81 WeakPolarHBondContact O-CB 3.47Å; P77-N81 PolarHBondContact O-N 3.23Å |
| 78 | L | 58.3 | Low | 65.3 | Low | 106 Ų | 106 | 118.9 Ų | 118.9 | 56% | 0.555 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -68.1 | -44.8 | 178.6 | -65.5 | 178.6 | 0 | 0 | 0 | 111.2 | Q75 Q76 L80 N81 E82 | Q75-L78 PolarHBondContact O-N 3.41Å; Q76-L78 PolarHBondContact O-N 3.09Å; L78-L80 PolarHBondContact O-N 3.39Å; L78-N81 PolarHBondContact O-N 3.31Å; L78-E82 WeakPolarHBondContact O-CB 3.23Å; L78-E82 WeakPolarHBondContact O-CG 3.22Å; L78-E82 PolarHBondContact O-N 3.27Å |
| 79 | T | 59.7 | Low | 67.1 | Low | 82 Ų | 82 | 118.4 Ų | 118.4 | 50% | 0.503 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -65.2 | -40.2 | 178.5 | -40.3 | 0 | 0 | 0 | 0 | 111.7 | Q76 E82 I83 | Q76-T79 PolarHBondContact O-N 3.02Å; T79-E82 PolarHBondContact O-N 3.3Å; T79-I83 HydrophobicContact CG2-CD1 4.38Å; T79-I83 VanDerWaalsContact O-CG1 3.3Å; T79-I83 WeakPolarHBondContact O-CG1 3.35Å; T79-I83 PolarHBondContact O-N 2.84Å |
| 80 | L | 63.8 | Low | 69 | Low | 119 Ų | 119 | 116.6 Ų | 116.6 | 62% | 0.623 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -67.9 | -40.9 | 176.6 | -169.1 | 134.4 | 0 | 0 | 0 | 111.2 | Q76 L78 I83 M84 | Q76-L80 PolarHBondContact O-N 2.82Å; L78-L80 PolarHBondContact O-N 3.39Å; L80-I83 PolarHBondContact O-N 3.04Å; L80-M84 HydrophobicContact CD2-CG 4.03Å; L80-M84 VanDerWaalsContact O-CB 3.3Å; L80-M84 WeakPolarHBondContact O-CB 3.47Å; L80-M84 WeakPolarHBondContact O-CG 3.38Å; L80-M84 PolarHBondContact O-N 3.45Å |
| 81 | N | 76.1 | Confident | 70.9 | Confident | 91 Ų | 91 | 117.2 Ų | 117.2 | 49% | 0.487 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -64.7 | -39 | 176.1 | -162 | 14.2 | 0 | 0 | 0 | 111.6 | P77 L78 M84 L85 | P77-N81 WeakPolarHBondContact O-CB 3.47Å; P77-N81 PolarHBondContact O-N 3.23Å; L78-N81 PolarHBondContact O-N 3.31Å; N81-M84 PolarHBondContact O-N 3.33Å; N81-L85 WeakPolarHBondContact O-CB 3.48Å; N81-L85 WeakPolarHBondContact O-CD1 3.32Å; N81-L85 PolarHBondContact O-N 3.38Å; N81-L85 VanDerWaalsContact OD1-CD1 3.22Å; N81-L85 WeakPolarHBondContact OD1-CD1 3.37Å |
| 82 | E | 81.3 | Confident | 72.9 | Confident | 114 Ų | 114 | 115.3 Ų | 115.3 | 53% | 0.533 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -63.7 | -44.5 | 174.6 | -77.9 | -173.7 | -173.6 | 0 | 0 | 112.9 | L78 T79 L85 K86 | L78-E82 WeakPolarHBondContact O-CB 3.23Å; L78-E82 WeakPolarHBondContact O-CG 3.22Å; L78-E82 PolarHBondContact O-N 3.27Å; T79-E82 PolarHBondContact O-N 3.3Å; E82-L85 PolarHBondContact O-N 3.27Å; E82-K86 WeakPolarHBondContact O-CB 3.38Å; E82-K86 WeakPolarHBondContact O-CG 3.41Å; E82-K86 PolarHBondContact O-N 2.87Å |
| 83 | I | 82.7 | Confident | 74.8 | Confident | 102 Ų | 102 | 109.8 Ų | 109.8 | 52% | 0.523 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -63.7 | -44.7 | 176.3 | -67.2 | 166.5 | 0 | 0 | 0 | 109.9 | T79 L80 K86 L87 | T79-I83 HydrophobicContact CG2-CD1 4.38Å; T79-I83 VanDerWaalsContact O-CG1 3.3Å; T79-I83 WeakPolarHBondContact O-CG1 3.35Å; T79-I83 PolarHBondContact O-N 2.84Å; L80-I83 PolarHBondContact O-N 3.04Å; I83-K86 PolarHBondContact O-N 2.92Å; I83-L87 PolarHBondContact O-N 3.36Å |
| 84 | M | 80.6 | Confident | 76.6 | Confident | 97 Ų | 97 | 107.4 Ų | 107.4 | 48% | 0.478 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -60.4 | -47.5 | 177 | -75.2 | -70.8 | -71.5 | 0 | 0 | 111.7 | L80 N81 K86 L87 I88 | L80-M84 HydrophobicContact CD2-CG 4.03Å; L80-M84 VanDerWaalsContact O-CB 3.3Å; L80-M84 WeakPolarHBondContact O-CB 3.47Å; L80-M84 WeakPolarHBondContact O-CG 3.38Å; L80-M84 PolarHBondContact O-N 3.45Å; N81-M84 PolarHBondContact O-N 3.33Å; M84-K86 VanDerWaalsContact C-N 3.34Å; M84-K86 PolarHBondContact O-N 3.28Å; M84-L87 WeakPolarHBondContact O-CB 3.47Å; M84-L87 PolarHBondContact O-N 2.85Å; M84-L87 VanDerWaalsContact O-N 3.14Å; M84-I88 WeakPolarHBondContact O-CB 3.39Å; M84-I88 VanDerWaalsContact O-CG1 3.23Å; M84-I88 WeakPolarHBondContact O-CG1 3.46Å; M84-I88 PolarHBondContact O-N 3.31Å |
| 85 | L | 84.9 | Confident | 78.2 | Confident | 103 Ų | 103 | 109.3 Ų | 109.3 | 54% | 0.539 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -59.2 | -44.2 | 175.8 | -105.3 | 77.7 | 0 | 0 | 0 | 111.8 | N81 E82 L87 I88 Y89 | N81-L85 WeakPolarHBondContact O-CB 3.48Å; N81-L85 WeakPolarHBondContact O-CD1 3.32Å; N81-L85 PolarHBondContact O-N 3.38Å; N81-L85 VanDerWaalsContact OD1-CD1 3.22Å; N81-L85 WeakPolarHBondContact OD1-CD1 3.37Å; E82-L85 PolarHBondContact O-N 3.27Å; L85-L87 VanDerWaalsContact C-N 3.29Å; L85-L87 PolarHBondContact O-N 3.42Å; L85-I88 PolarHBondContact O-N 3Å; L85-Y89 WeakPolarHBondContact O-CB 3.3Å; L85-Y89 PolarHBondContact O-N 3.44Å |
| 86 | K | 89.8 | Confident | 79.9 | Confident | 136 Ų | 136 | 105.9 Ų | 105.9 | 59% | 0.591 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -60.8 | -39.7 | 176.1 | -76.7 | 172.9 | -179.5 | 167.4 | 0 | 111.5 | E82 I83 M84 K90 | E82-K86 WeakPolarHBondContact O-CB 3.38Å; E82-K86 WeakPolarHBondContact O-CG 3.41Å; E82-K86 PolarHBondContact O-N 2.87Å; I83-K86 PolarHBondContact O-N 2.92Å; M84-K86 VanDerWaalsContact C-N 3.34Å; M84-K86 PolarHBondContact O-N 3.28Å; K86-K90 WeakPolarHBondContact O-CG 3.5Å; K86-K90 PolarHBondContact O-N 3.49Å; K86-K90 VanDerWaalsContact O-N 3.11Å |
| 87 | L | 88.4 | Confident | 81.5 | Confident | 100 Ų | 100 | 106 Ų | 106 | 52% | 0.524 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -68.5 | -45.1 | 178.2 | -145.7 | 105.8 | 0 | 0 | 0 | 111.4 | I83 M84 L85 Y89 K90 L91 | I83-L87 PolarHBondContact O-N 3.36Å; M84-L87 WeakPolarHBondContact O-CB 3.47Å; M84-L87 PolarHBondContact O-N 2.85Å; M84-L87 VanDerWaalsContact O-N 3.14Å; L85-L87 VanDerWaalsContact C-N 3.29Å; L85-L87 PolarHBondContact O-N 3.42Å; L87-Y89 PolarHBondContact O-N 3.14Å; L87-K90 PolarHBondContact O-N 2.94Å; L87-L91 HydrophobicContact CD2-CD1 4.07Å; L87-L91 HydrophobicContact CG-CD1 4.48Å; L87-L91 PolarHBondContact O-N 3.42Å |
| 88 | I | 88.5 | Confident | 82.8 | Confident | 85 Ų | 85 | 107.4 Ų | 107.4 | 44% | 0.436 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -59.4 | -47.3 | 176.8 | -69.8 | 163.7 | 0 | 0 | 0 | 110.3 | M84 L85 K90 L91 W92 | M84-I88 WeakPolarHBondContact O-CB 3.39Å; M84-I88 VanDerWaalsContact O-CG1 3.23Å; M84-I88 WeakPolarHBondContact O-CG1 3.46Å; M84-I88 PolarHBondContact O-N 3.31Å; L85-I88 PolarHBondContact O-N 3Å; I88-K90 VanDerWaalsContact C-N 3.34Å; I88-K90 PolarHBondContact O-N 2.89Å; I88-L91 PolarHBondContact O-N 3.49Å; I88-W92 WeakPolarHBondContact O-CB 3.33Å; I88-W92 PolarHBondContact O-N 2.94Å |
| 89 | Y | 89.8 | Confident | 84.1 | Confident | 162 Ų | 162 | 110.7 Ų | 110.7 | 64% | 0.635 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -63 | -40.2 | 179 | -170.5 | -92.9 | 0 | 0 | 0 | 112.1 | L85 L87 W92 A93 | L85-Y89 WeakPolarHBondContact O-CB 3.3Å; L85-Y89 PolarHBondContact O-N 3.44Å; L87-Y89 PolarHBondContact O-N 3.14Å; Y89-W92 HydrophobicContact CE2-CE3 4.46Å; Y89-W92 PolarHBondContact O-N 3.08Å; Y89-A93 WeakPolarHBondContact O-CB 3.37Å; Y89-A93 PolarHBondContact O-N 3.2Å |
| 90 | K | 92 | Very high | 85.4 | Confident | 147 Ų | 147 | 115.2 Ų | 115.2 | 64% | 0.639 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -63.1 | -45.4 | 174 | -79.4 | -178.2 | 176.5 | -176.5 | 0 | 112.3 | K86 L87 I88 W92 A93 I94 | K86-K90 WeakPolarHBondContact O-CG 3.5Å; K86-K90 PolarHBondContact O-N 3.49Å; K86-K90 VanDerWaalsContact O-N 3.11Å; L87-K90 PolarHBondContact O-N 2.94Å; I88-K90 VanDerWaalsContact C-N 3.34Å; I88-K90 PolarHBondContact O-N 2.89Å; K90-W92 VanDerWaalsContact C-N 3.33Å; K90-W92 PolarHBondContact O-N 3.32Å; K90-A93 PolarHBondContact O-N 3.48Å; K90-I94 WeakPolarHBondContact O-CG1 3.35Å; K90-I94 PolarHBondContact O-N 3.41Å; K90-I94 VanDerWaalsContact O-N 3.08Å |
| 91 | L | 87.2 | Confident | 86.3 | Confident | 97 Ų | 97 | 116.1 Ų | 116.1 | 51% | 0.508 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -60.6 | -44.4 | 175.9 | -106.4 | 113.7 | 0 | 0 | 0 | 111.4 | L87 I88 A93 I94 L95 | L87-L91 HydrophobicContact CD2-CD1 4.07Å; L87-L91 HydrophobicContact CG-CD1 4.48Å; L87-L91 PolarHBondContact O-N 3.42Å; I88-L91 PolarHBondContact O-N 3.49Å; L91-A93 VanDerWaalsContact C-N 3.34Å; L91-A93 PolarHBondContact O-N 2.93Å; L91-I94 PolarHBondContact O-N 3.22Å; L91-L95 PolarHBondContact O-N 3.45Å |
| 92 | W | 91.6 | Very high | 86.6 | Confident | 140 Ų | 140 | 119.4 Ų | 119.4 | 53% | 0.53 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -60.7 | -42.1 | 177.6 | -174.6 | 80.1 | 0 | 0 | 0 | 111.9 | I88 Y89 K90 I94 L95 Q96 | I88-W92 WeakPolarHBondContact O-CB 3.33Å; I88-W92 PolarHBondContact O-N 2.94Å; Y89-W92 HydrophobicContact CE2-CE3 4.46Å; Y89-W92 PolarHBondContact O-N 3.08Å; K90-W92 VanDerWaalsContact C-N 3.33Å; K90-W92 PolarHBondContact O-N 3.32Å; W92-I94 PolarHBondContact O-N 3.33Å; W92-L95 WeakPolarHBondContact O-CB 3.41Å; W92-L95 PolarHBondContact O-N 3.5Å; W92-Q96 HydrophobicContact CD2-CG 4.15Å; W92-Q96 HydrophobicContact CE3-CG 4.31Å; W92-Q96 HydrophobicContact CH2-CG 4.19Å; W92-Q96 HydrophobicContact CZ2-CG 4.02Å; W92-Q96 HydrophobicContact CZ3-CG 4.33Å; W92-Q96 WeakPolarHBondContact O-CG 3.33Å; W92-Q96 PolarHBondContact O-N 3.11Å |
| 93 | A | 91 | Very high | 86.8 | Confident | 47 Ų | 47 | 119.7 Ų | 119.7 | 39% | 0.388 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -62.9 | -40 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | Y89 K90 L91 Q96 Y97 | Y89-A93 WeakPolarHBondContact O-CB 3.37Å; Y89-A93 PolarHBondContact O-N 3.2Å; K90-A93 PolarHBondContact O-N 3.48Å; L91-A93 VanDerWaalsContact C-N 3.34Å; L91-A93 PolarHBondContact O-N 2.93Å; A93-Q96 PolarHBondContact O-N 3.19Å; A93-Y97 PolarHBondContact O-N 3.46Å |
| 94 | I | 89.7 | Confident | 87 | Confident | 103 Ų | 103 | 120.6 Ų | 120.6 | 53% | 0.528 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -65.4 | -43.5 | 175.9 | -66.3 | 164.7 | 0 | 0 | 0 | 110.6 | K90 L91 W92 Q96 Y97 L98 | K90-I94 WeakPolarHBondContact O-CG1 3.35Å; K90-I94 PolarHBondContact O-N 3.41Å; K90-I94 VanDerWaalsContact O-N 3.08Å; L91-I94 PolarHBondContact O-N 3.22Å; W92-I94 PolarHBondContact O-N 3.33Å; I94-Q96 VanDerWaalsContact C-N 3.35Å; I94-Q96 PolarHBondContact O-N 3.44Å; I94-Y97 PolarHBondContact O-N 2.92Å; I94-L98 HydrophobicContact CG2-CD1 3.96Å; I94-L98 HydrophobicContact CG2-CG 4.34Å; I94-L98 WeakPolarHBondContact O-CG 3.41Å; I94-L98 PolarHBondContact O-N 3.48Å |
| 95 | L | 85.7 | Confident | 87.4 | Confident | 104 Ų | 104 | 121.9 Ų | 121.9 | 55% | 0.545 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -59.2 | -44.5 | 175.2 | -82.6 | 154.6 | 0 | 0 | 0 | 111.8 | L91 W92 Y97 L98 W99 | L91-L95 PolarHBondContact O-N 3.45Å; W92-L95 WeakPolarHBondContact O-CB 3.41Å; W92-L95 PolarHBondContact O-N 3.5Å; L95-Y97 VanDerWaalsContact C-N 3.34Å; L95-Y97 PolarHBondContact O-N 3.48Å; L95-L98 PolarHBondContact O-N 3.19Å; L95-W99 WeakPolarHBondContact O-CB 3.5Å; L95-W99 PolarHBondContact O-N 3.42Å |
| 96 | Q | 88.2 | Confident | 87.6 | Confident | 67 Ų | 67 | 123 Ų | 123 | 31% | 0.313 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -61 | -41.4 | 174.6 | -72.9 | -70.3 | -42.6 | 0 | 0 | 112 | W92 A93 I94 K100 | W92-Q96 HydrophobicContact CD2-CG 4.15Å; W92-Q96 HydrophobicContact CE3-CG 4.31Å; W92-Q96 HydrophobicContact CH2-CG 4.19Å; W92-Q96 HydrophobicContact CZ2-CG 4.02Å; W92-Q96 HydrophobicContact CZ3-CG 4.33Å; W92-Q96 WeakPolarHBondContact O-CG 3.33Å; W92-Q96 PolarHBondContact O-N 3.11Å; A93-Q96 PolarHBondContact O-N 3.19Å; I94-Q96 VanDerWaalsContact C-N 3.35Å; I94-Q96 PolarHBondContact O-N 3.44Å; Q96-K100 PolarHBondContact O-N 3.08Å; Q96-K100 VanDerWaalsContact O-N 3.08Å |
| 97 | Y | 86.8 | Confident | 87.4 | Confident | 149 Ų | 149 | 122.2 Ų | 122.2 | 58% | 0.584 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -65.6 | -45.3 | 176.9 | -178 | -97.4 | 0 | 0 | 0 | 112.2 | A93 I94 L95 W99 K100 M101 | A93-Y97 PolarHBondContact O-N 3.46Å; I94-Y97 PolarHBondContact O-N 2.92Å; L95-Y97 VanDerWaalsContact C-N 3.34Å; L95-Y97 PolarHBondContact O-N 3.48Å; Y97-W99 VanDerWaalsContact C-N 3.34Å; Y97-W99 PolarHBondContact O-N 2.97Å; Y97-K100 PolarHBondContact O-N 3.39Å; Y97-M101 HydrophobicContact CD1-CG 4.4Å; Y97-M101 HydrophobicContact CE1-CG 3.98Å; Y97-M101 WeakPolarHBondContact O-CG 3.45Å; Y97-M101 PolarHBondContact O-N 2.87Å |
| 98 | L | 82.4 | Confident | 87.3 | Confident | 104 Ų | 104 | 123.7 Ų | 123.7 | 55% | 0.545 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -62.3 | -41.6 | 176.8 | -72.9 | 171.7 | 0 | 0 | 0 | 111.7 | I94 L95 K100 M101 L102 | I94-L98 HydrophobicContact CG2-CD1 3.96Å; I94-L98 HydrophobicContact CG2-CG 4.34Å; I94-L98 WeakPolarHBondContact O-CG 3.41Å; I94-L98 PolarHBondContact O-N 3.48Å; L95-L98 PolarHBondContact O-N 3.19Å; L98-K100 VanDerWaalsContact C-N 3.32Å; L98-K100 PolarHBondContact O-N 2.99Å; L98-M101 PolarHBondContact O-N 3.47Å; L98-L102 PolarHBondContact O-N 3.23Å |
| 99 | W | 85.7 | Confident | 87.3 | Confident | 176 Ų | 176 | 126.4 Ų | 126.4 | 67% | 0.667 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -63.1 | -37.7 | 175.8 | -175.3 | 19.8 | 0 | 0 | 0 | 112.2 | L95 Y97 M101 L102 | L95-W99 WeakPolarHBondContact O-CB 3.5Å; L95-W99 PolarHBondContact O-N 3.42Å; Y97-W99 VanDerWaalsContact C-N 3.34Å; Y97-W99 PolarHBondContact O-N 2.97Å; W99-M101 VanDerWaalsContact C-N 3.28Å; W99-M101 PolarHBondContact O-N 3.4Å; W99-L102 PolarHBondContact O-N 3.2Å |
| 100 | K | 87.4 | Confident | 87.1 | Confident | 177 Ų | 177 | 123.7 Ų | 123.7 | 77% | 0.77 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -68.1 | -23.8 | 175.4 | -79.3 | -172.8 | 174.3 | -172.4 | 0 | 114.3 | Q96 Y97 L98 | Q96-K100 PolarHBondContact O-N 3.08Å; Q96-K100 VanDerWaalsContact O-N 3.08Å; Y97-K100 PolarHBondContact O-N 3.39Å; L98-K100 VanDerWaalsContact C-N 3.32Å; L98-K100 PolarHBondContact O-N 2.99Å |
| 101 | M | 82.1 | Confident | 86.7 | Confident | 138 Ų | 138 | 121.8 Ų | 121.8 | 68% | 0.68 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -89.9 | -16.2 | -180 | -69.7 | -71.4 | -75.8 | 0 | 0 | 113.1 | Y97 L98 W99 | Y97-M101 HydrophobicContact CD1-CG 4.4Å; Y97-M101 HydrophobicContact CE1-CG 3.98Å; Y97-M101 WeakPolarHBondContact O-CG 3.45Å; Y97-M101 PolarHBondContact O-N 2.87Å; L98-M101 PolarHBondContact O-N 3.47Å; W99-M101 VanDerWaalsContact C-N 3.28Å; W99-M101 PolarHBondContact O-N 3.4Å |
| 102 | L | 82.2 | Confident | 86.6 | Confident | 159 Ų | 159 | 124 Ų | 124 | 83% | 0.832 | 58% | 0.58 | S | S | * | * | trans | -90.6 | 0 | 177.9 | -167.7 | 77.3 | 0 | 0 | 0 | 111.1 | V7 L98 W99 | V7-L102 HydrophobicContact CG1-CD2 4.38Å; L98-L102 PolarHBondContact O-N 3.23Å; W99-L102 PolarHBondContact O-N 3.2Å |
Retrieved 102 of 102 residues in 140.5 ms
(Link to these results)