| 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 | 44 | Very low | 54.8 | Low | 241 Ų | 241 | 126.6 Ų | 126.6 | 100% | 1.187 | 67% | 0.674 | S | S | * | * | 0 | 111.7 | 0 | -72.7 | 174.1 | 129.7 | 0 | 0 | 107.4 | |||||
| 2 | L | 51.2 | Low | 54.8 | Low | 148 Ų | 148 | 122.9 Ų | 122.9 | 78% | 0.775 | 66% | 0.664 | S | S | * | * | trans | -101.7 | 110.7 | -173.6 | -81.6 | 161.9 | 0 | 0 | 0 | 110 | G4 | L2-G4 PolarHBondContact O-N 3.36Å; L2-G4 VanDerWaalsContact O-N 3.17Å | ||
| 3 | P | 54.5 | Low | 54.9 | Low | 115 Ų | 115 | 121.8 Ų | 121.8 | 75% | 0.747 | 66% | 0.656 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76 | 1.6 | -171.8 | 30 | -34.3 | 0 | 0 | 0 | 114.7 | ||
| 4 | G | 57.3 | Low | 54.9 | Low | 51 Ų | 51 | 121 Ų | 121 | 53% | 0.526 | 65% | 0.65 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -87.2 | -16.6 | -175.8 | 0 | 0 | 0 | 0 | 0 | 115.8 | L2 | L2-G4 PolarHBondContact O-N 3.36Å; L2-G4 VanDerWaalsContact O-N 3.17Å |
| 5 | R | 55.8 | Low | 55.2 | Low | 190 Ų | 190 | 117.9 Ų | 117.9 | 72% | 0.717 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -76.5 | -31.7 | -174.7 | -74.7 | 170.3 | 65.8 | 157.4 | -1.7 | 112.7 | V9 | R5-V9 VanDerWaalsContact O-CG2 3.3Å; R5-V9 WeakPolarHBondContact O-CG2 3.42Å; R5-V9 PolarHBondContact O-N 3.13Å |
| 6 | D | 55 | Low | 55.6 | Low | 115 Ų | 115 | 115.1 Ų | 115.1 | 62% | 0.615 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -75.1 | -29.3 | -176 | -60 | -30.1 | 0 | 0 | 0 | 112.6 | R10 | D6-R10 VanDerWaalsContact O-CG 3.26Å; D6-R10 WeakPolarHBondContact O-CG 3.48Å; D6-R10 PolarHBondContact O-N 3.36Å |
| 7 | A | 56.8 | Low | 56.2 | Low | 58 Ų | 58 | 120.3 Ų | 120.3 | 48% | 0.479 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -70.3 | -43.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | R10 Q11 | A7-R10 PolarHBondContact O-N 3.23Å; A7-Q11 PolarHBondContact O-N 3.4Å |
| 8 | A | 58 | Low | 57 | Low | 59 Ų | 59 | 123.1 Ų | 123.1 | 49% | 0.488 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -65.9 | -39.5 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q11 C12 | A8-Q11 PolarHBondContact O-N 3.49Å; A8-C12 WeakPolarHBondContact O-CB 3.5Å; A8-C12 PolarHBondContact O-N 3.3Å |
| 9 | V | 58 | Low | 58.1 | Low | 84 Ų | 84 | 121.7 Ų | 121.7 | 51% | 0.509 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -66.6 | -40.1 | 177.3 | 174 | 0 | 0 | 0 | 0 | 111.1 | R5 C12 I13 | R5-V9 VanDerWaalsContact O-CG2 3.3Å; R5-V9 WeakPolarHBondContact O-CG2 3.42Å; R5-V9 PolarHBondContact O-N 3.13Å; V9-C12 PolarHBondContact O-N 3.21Å; V9-I13 HydrophobicContact CG1-CD1 3.77Å; V9-I13 HydrophobicContact CG1-CG1 4.45Å; V9-I13 VanDerWaalsContact O-CG1 3.26Å; V9-I13 WeakPolarHBondContact O-CG1 3.3Å; V9-I13 PolarHBondContact O-N 2.98Å |
| 10 | R | 55.9 | Low | 59.3 | Low | 196 Ų | 196 | 119.1 Ų | 119.1 | 74% | 0.74 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -64.8 | -39.3 | 175.7 | -75.4 | 176.5 | 170.6 | -134.7 | -2 | 112.7 | D6 A7 I13 L14 | D6-R10 VanDerWaalsContact O-CG 3.26Å; D6-R10 WeakPolarHBondContact O-CG 3.48Å; D6-R10 PolarHBondContact O-N 3.36Å; A7-R10 PolarHBondContact O-N 3.23Å; R10-I13 PolarHBondContact O-N 3.21Å; R10-L14 WeakPolarHBondContact O-CB 3.3Å; R10-L14 PolarHBondContact O-N 3.35Å |
| 11 | Q | 55.8 | Low | 60.5 | Low | 136 Ų | 136 | 115.7 Ų | 115.7 | 64% | 0.636 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -65.1 | -40.1 | 174.1 | -113.8 | 162.9 | -21.3 | 0 | 0 | 112.1 | A7 A8 L14 T15 | A7-Q11 PolarHBondContact O-N 3.4Å; A8-Q11 PolarHBondContact O-N 3.49Å; Q11-L14 PolarHBondContact O-N 3.25Å; Q11-T15 WeakPolarHBondContact O-CG2 3.45Å; Q11-T15 PolarHBondContact O-N 3.18Å; Q11-T15 PolarHBondContact O-OG1 3.32Å; Q11-T15 VanDerWaalsContact O-OG1 3.11Å |
| 12 | C | 55.3 | Low | 62.6 | Low | 82 Ų | 82 | 107 Ų | 107 | 55% | 0.554 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -66.1 | -39.1 | 176.3 | -170.1 | 0 | 0 | 0 | 0 | 112.9 | A8 V9 T15 S16 | A8-C12 WeakPolarHBondContact O-CB 3.5Å; A8-C12 PolarHBondContact O-N 3.3Å; V9-C12 PolarHBondContact O-N 3.21Å; C12-T15 WeakPolarHBondContact CA-OG1 3.41Å; C12-T15 PolarHBondContact O-OG1 3.19Å; C12-S16 VanDerWaalsContact O-CB 3.23Å; C12-S16 WeakPolarHBondContact O-CB 3.33Å; C12-S16 PolarHBondContact O-N 3Å |
| 13 | I | 56.3 | Low | 64.2 | Low | 108 Ų | 108 | 105.1 Ų | 105.1 | 55% | 0.554 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -71.1 | -37.2 | 175.5 | -64.3 | 165.2 | 0 | 0 | 0 | 110.8 | V9 R10 S16 R17 | V9-I13 HydrophobicContact CG1-CD1 3.77Å; V9-I13 HydrophobicContact CG1-CG1 4.45Å; V9-I13 VanDerWaalsContact O-CG1 3.26Å; V9-I13 WeakPolarHBondContact O-CG1 3.3Å; V9-I13 PolarHBondContact O-N 2.98Å; R10-I13 PolarHBondContact O-N 3.21Å; I13-S16 WeakPolarHBondContact O-CB 3.34Å; I13-S16 PolarHBondContact O-N 3.38Å; I13-R17 PolarHBondContact O-N 3.41Å |
| 14 | L | 54.8 | Low | 65.8 | Low | 111 Ų | 111 | 104 Ų | 104 | 58% | 0.581 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -64.3 | -50.5 | 176 | -153.3 | 86.8 | 0 | 0 | 0 | 110 | R10 Q11 S16 R17 W18 | R10-L14 WeakPolarHBondContact O-CB 3.3Å; R10-L14 PolarHBondContact O-N 3.35Å; Q11-L14 PolarHBondContact O-N 3.25Å; L14-S16 VanDerWaalsContact C-N 3.29Å; L14-S16 PolarHBondContact O-N 3.21Å; L14-R17 PolarHBondContact O-N 3.16Å; L14-R17 VanDerWaalsContact O-N 3.08Å; L14-W18 PolarHBondContact O-N 3.1Å |
| 15 | T | 58.8 | Low | 67.3 | Low | 75 Ų | 75 | 106.5 Ų | 106.5 | 46% | 0.46 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -63 | -34.6 | 176.5 | 56.9 | 0 | 0 | 0 | 0 | 112 | Q11 C12 R17 W18 L19 | Q11-T15 WeakPolarHBondContact O-CG2 3.45Å; Q11-T15 PolarHBondContact O-N 3.18Å; Q11-T15 PolarHBondContact O-OG1 3.32Å; Q11-T15 VanDerWaalsContact O-OG1 3.11Å; C12-T15 WeakPolarHBondContact CA-OG1 3.41Å; C12-T15 PolarHBondContact O-OG1 3.19Å; T15-R17 PolarHBondContact O-N 3.17Å; T15-W18 PolarHBondContact O-N 2.93Å; T15-L19 VanDerWaalsContact O-CB 3.28Å; T15-L19 WeakPolarHBondContact O-CB 3.46Å; T15-L19 WeakPolarHBondContact O-CG 3.26Å; T15-L19 PolarHBondContact O-N 3.09Å |
| 16 | S | 61.3 | Low | 68.7 | Low | 73 Ų | 73 | 103.1 Ų | 103.1 | 51% | 0.51 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -58.9 | -28.3 | 173.6 | -175.7 | 0 | 0 | 0 | 0 | 113.7 | C12 I13 L14 P20 | C12-S16 VanDerWaalsContact O-CB 3.23Å; C12-S16 WeakPolarHBondContact O-CB 3.33Å; C12-S16 PolarHBondContact O-N 3Å; I13-S16 WeakPolarHBondContact O-CB 3.34Å; I13-S16 PolarHBondContact O-N 3.38Å; L14-S16 VanDerWaalsContact C-N 3.29Å; L14-S16 PolarHBondContact O-N 3.21Å; S16-P20 WeakPolarHBondContact O-CD 3.43Å |
| 17 | R | 66.4 | Low | 70.1 | Confident | 203 Ų | 203 | 103.4 Ų | 103.4 | 77% | 0.766 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -84.7 | -27.5 | -179.5 | -143.7 | 162.4 | 80.4 | 163.3 | 5.4 | 112.9 | I13 L14 T15 | I13-R17 PolarHBondContact O-N 3.41Å; L14-R17 PolarHBondContact O-N 3.16Å; L14-R17 VanDerWaalsContact O-N 3.08Å; T15-R17 PolarHBondContact O-N 3.17Å |
| 18 | W | 70.5 | Confident | 71.5 | Confident | 171 Ų | 171 | 106.2 Ų | 106.2 | 65% | 0.648 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -92.8 | -20 | 176.2 | -62.3 | 97.2 | 0 | 0 | 0 | 113.1 | L14 T15 A21 A22 | L14-W18 PolarHBondContact O-N 3.1Å; T15-W18 PolarHBondContact O-N 2.93Å; W18-A21 PolarHBondContact O-N 3.25Å; W18-A22 VanDerWaalsContact O-CB 3.31Å; W18-A22 WeakPolarHBondContact O-CB 3.35Å; W18-A22 PolarHBondContact O-N 3.03Å |
| 19 | L | 78.9 | Confident | 72.7 | Confident | 96 Ų | 96 | 108.7 Ų | 108.7 | 50% | 0.503 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -52 | -50.4 | 173.8 | -90.9 | 166.5 | 0 | 0 | 0 | 113.3 | T15 A21 A22 L23 | T15-L19 VanDerWaalsContact O-CB 3.28Å; T15-L19 WeakPolarHBondContact O-CB 3.46Å; T15-L19 WeakPolarHBondContact O-CG 3.26Å; T15-L19 PolarHBondContact O-N 3.09Å; L19-A21 PolarHBondContact O-N 3.19Å; L19-A22 PolarHBondContact O-N 3.4Å; L19-L23 WeakPolarHBondContact O-CB 3.5Å; L19-L23 WeakPolarHBondContact O-CD1 3.41Å; L19-L23 PolarHBondContact O-N 3.45Å |
| 20 | P | 80.6 | Confident | 73.5 | Confident | 70 Ų | 70 | 107.5 Ų | 107.5 | 46% | 0.455 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -66.5 | -38.6 | 178.4 | 25.2 | -34.1 | 0 | 0 | 0 | 111.9 | S16 L23 T24 | S16-P20 WeakPolarHBondContact O-CD 3.43Å; P20-L23 PolarHBondContact O-N 2.81Å; P20-T24 VanDerWaalsContact O-CG2 3.3Å; P20-T24 WeakPolarHBondContact O-CG2 3.26Å; P20-T24 PolarHBondContact O-N 3.18Å; P20-T24 PolarHBondContact O-OG1 2.94Å; P20-T24 VanDerWaalsContact O-OG1 3.13Å |
| 21 | A | 86.1 | Confident | 74.2 | Confident | 48 Ų | 48 | 100.4 Ų | 100.4 | 40% | 0.397 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -66.3 | -37.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | W18 L19 T24 L25 | W18-A21 PolarHBondContact O-N 3.25Å; L19-A21 PolarHBondContact O-N 3.19Å; A21-T24 WeakPolarHBondContact CA-OG1 3.38Å; A21-T24 PolarHBondContact O-OG1 3.44Å; A21-L25 VanDerWaalsContact O-CB 3.3Å; A21-L25 WeakPolarHBondContact O-CB 3.36Å; A21-L25 PolarHBondContact O-N 3.47Å |
| 22 | A | 86.6 | Confident | 74.9 | Confident | 58 Ų | 58 | 97.4 Ų | 97.4 | 48% | 0.479 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -69 | -41.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | W18 L19 L25 L26 | W18-A22 VanDerWaalsContact O-CB 3.31Å; W18-A22 WeakPolarHBondContact O-CB 3.35Å; W18-A22 PolarHBondContact O-N 3.03Å; L19-A22 PolarHBondContact O-N 3.4Å; A22-L25 PolarHBondContact O-N 3Å; A22-L26 VanDerWaalsContact O-CB 3.29Å; A22-L26 WeakPolarHBondContact O-CB 3.37Å; A22-L26 PolarHBondContact O-N 3.06Å |
| 23 | L | 85.1 | Confident | 75.2 | Confident | 108 Ų | 108 | 100.3 Ų | 100.3 | 57% | 0.565 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -63.1 | -43.6 | 174.9 | -87.3 | 156.3 | 0 | 0 | 0 | 112.1 | L19 P20 L26 L27 | L19-L23 WeakPolarHBondContact O-CB 3.5Å; L19-L23 WeakPolarHBondContact O-CD1 3.41Å; L19-L23 PolarHBondContact O-N 3.45Å; P20-L23 PolarHBondContact O-N 2.81Å; L23-L26 PolarHBondContact O-N 3.37Å; L23-L27 VanDerWaalsContact O-CB 3.31Å; L23-L27 WeakPolarHBondContact O-CB 3.35Å; L23-L27 PolarHBondContact O-N 3.23Å |
| 24 | T | 87.3 | Confident | 75.2 | Confident | 92 Ų | 92 | 98.9 Ų | 98.9 | 56% | 0.564 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -67.4 | -39.5 | 177.5 | 55.1 | 0 | 0 | 0 | 0 | 111.7 | P20 A21 L27 L28 | P20-T24 VanDerWaalsContact O-CG2 3.3Å; P20-T24 WeakPolarHBondContact O-CG2 3.26Å; P20-T24 PolarHBondContact O-N 3.18Å; P20-T24 PolarHBondContact O-OG1 2.94Å; P20-T24 VanDerWaalsContact O-OG1 3.13Å; A21-T24 WeakPolarHBondContact CA-OG1 3.38Å; A21-T24 PolarHBondContact O-OG1 3.44Å; T24-L27 PolarHBondContact O-N 2.92Å; T24-L28 WeakPolarHBondContact O-CB 3.33Å; T24-L28 PolarHBondContact O-N 3.48Å |
| 25 | L | 88.8 | Confident | 75 | Confident | 104 Ų | 104 | 103.6 Ų | 103.6 | 55% | 0.545 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -63.8 | -45.2 | 174.8 | -174.6 | 65.8 | 0 | 0 | 0 | 111.6 | A21 A22 L27 L28 L29 | A21-L25 VanDerWaalsContact O-CB 3.3Å; A21-L25 WeakPolarHBondContact O-CB 3.36Å; A21-L25 PolarHBondContact O-N 3.47Å; A22-L25 PolarHBondContact O-N 3Å; L25-L27 PolarHBondContact O-N 3.47Å; L25-L28 PolarHBondContact O-N 3.26Å; L25-L29 HydrophobicContact CG-CD1 4.02Å; L25-L29 WeakPolarHBondContact O-CB 3.17Å; L25-L29 WeakPolarHBondContact O-CD1 3.36Å; L25-L29 WeakPolarHBondContact O-CG 3.28Å; L25-L29 PolarHBondContact O-N 3.4Å |
| 26 | L | 86.1 | Confident | 74.5 | Confident | 118 Ų | 118 | 103.4 Ų | 103.4 | 62% | 0.618 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -60.8 | -43.9 | 175.8 | -174.7 | 73.8 | 0 | 0 | 0 | 111.6 | A22 L23 L29 S30 | A22-L26 VanDerWaalsContact O-CB 3.29Å; A22-L26 WeakPolarHBondContact O-CB 3.37Å; A22-L26 PolarHBondContact O-N 3.06Å; L23-L26 PolarHBondContact O-N 3.37Å; L26-L29 PolarHBondContact O-N 3.3Å; L26-S30 PolarHBondContact O-N 2.91Å; L26-S30 PolarHBondContact O-OG 2.96Å |
| 27 | L | 85.1 | Confident | 73.9 | Confident | 122 Ų | 122 | 105.5 Ų | 105.5 | 64% | 0.639 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -62.5 | -45 | 176.7 | -170.8 | 72.7 | 0 | 0 | 0 | 110.8 | L23 T24 L25 L29 S30 A31 | L23-L27 VanDerWaalsContact O-CB 3.31Å; L23-L27 WeakPolarHBondContact O-CB 3.35Å; L23-L27 PolarHBondContact O-N 3.23Å; T24-L27 PolarHBondContact O-N 2.92Å; L25-L27 PolarHBondContact O-N 3.47Å; L27-L29 VanDerWaalsContact C-N 3.34Å; L27-L29 PolarHBondContact O-N 2.94Å; L27-S30 WeakPolarHBondContact CA-OG 3.23Å; L27-S30 PolarHBondContact O-N 3.34Å; L27-S30 PolarHBondContact O-OG 3.46Å; L27-A31 WeakPolarHBondContact O-CB 3.34Å; L27-A31 PolarHBondContact O-N 3.21Å |
| 28 | L | 85.6 | Confident | 72.8 | Confident | 117 Ų | 117 | 100.6 Ų | 100.6 | 61% | 0.613 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -63.6 | -39.7 | 178.6 | -165.5 | 72 | 0 | 0 | 0 | 112 | T24 L25 S32 | T24-L28 WeakPolarHBondContact O-CB 3.33Å; T24-L28 PolarHBondContact O-N 3.48Å; L25-L28 PolarHBondContact O-N 3.26Å; L28-S32 WeakPolarHBondContact O-CB 3.33Å; L28-S32 PolarHBondContact O-N 2.89Å; L28-S32 PolarHBondContact O-OG 2.99Å |
| 29 | L | 82.6 | Confident | 71.8 | Confident | 111 Ų | 111 | 98.5 Ų | 98.5 | 58% | 0.581 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -61.5 | -46.9 | 172.6 | -79.4 | 156.8 | 0 | 0 | 0 | 111.4 | L25 L26 L27 A31 S32 F33 | L25-L29 HydrophobicContact CG-CD1 4.02Å; L25-L29 WeakPolarHBondContact O-CB 3.17Å; L25-L29 WeakPolarHBondContact O-CD1 3.36Å; L25-L29 WeakPolarHBondContact O-CG 3.28Å; L25-L29 PolarHBondContact O-N 3.4Å; L26-L29 PolarHBondContact O-N 3.3Å; L27-L29 VanDerWaalsContact C-N 3.34Å; L27-L29 PolarHBondContact O-N 2.94Å; L29-A31 PolarHBondContact O-N 2.92Å; L29-S32 PolarHBondContact O-N 3.43Å; L29-F33 PolarHBondContact O-N 3.37Å |
| 30 | S | 75.8 | Confident | 70.4 | Confident | 59 Ų | 59 | 97 Ų | 97 | 41% | 0.413 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -65.1 | -38.3 | 178.3 | 69.6 | 0 | 0 | 0 | 0 | 113.7 | L26 L27 S32 F33 S34 | L26-S30 PolarHBondContact O-N 2.91Å; L26-S30 PolarHBondContact O-OG 2.96Å; L27-S30 WeakPolarHBondContact CA-OG 3.23Å; L27-S30 PolarHBondContact O-N 3.34Å; L27-S30 PolarHBondContact O-OG 3.46Å; S30-S32 VanDerWaalsContact C-N 3.35Å; S30-F33 PolarHBondContact O-N 3.4Å; S30-S34 WeakPolarHBondContact O-CB 3.12Å; S30-S34 PolarHBondContact O-N 2.8Å; S30-S34 PolarHBondContact O-OG 3.21Å |
| 31 | A | 70.9 | Confident | 68.8 | Low | 47 Ų | 47 | 98.4 Ų | 98.4 | 39% | 0.388 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -70.7 | -33.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | L27 L29 R35 | L27-A31 WeakPolarHBondContact O-CB 3.34Å; L27-A31 PolarHBondContact O-N 3.21Å; L29-A31 PolarHBondContact O-N 2.92Å; A31-R35 PolarHBondContact O-N 2.91Å; A31-R35 VanDerWaalsContact O-N 3.14Å |
| 32 | S | 70.8 | Confident | 67 | Low | 73 Ų | 73 | 103 Ų | 103 | 51% | 0.51 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -69.5 | -39.8 | 175 | -57.3 | 0 | 0 | 0 | 0 | 111.5 | L28 L29 S30 R35 A36 | L28-S32 WeakPolarHBondContact O-CB 3.33Å; L28-S32 PolarHBondContact O-N 2.89Å; L28-S32 PolarHBondContact O-OG 2.99Å; L29-S32 PolarHBondContact O-N 3.43Å; S30-S32 VanDerWaalsContact C-N 3.35Å; S32-R35 PolarHBondContact O-N 2.97Å; S32-A36 PolarHBondContact O-N 3.37Å |
| 33 | F | 60.9 | Low | 65.2 | Low | 143 Ų | 143 | 107.9 Ų | 107.9 | 63% | 0.627 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -67.3 | -37.7 | 174.8 | -149.9 | -97.1 | 0 | 0 | 0 | 112 | L29 S30 R35 A36 Q37 | L29-F33 PolarHBondContact O-N 3.37Å; S30-F33 PolarHBondContact O-N 3.4Å; F33-R35 VanDerWaalsContact C-N 3.27Å; F33-R35 PolarHBondContact O-N 2.9Å; F33-A36 PolarHBondContact O-N 3.01Å; F33-Q37 PolarHBondContact O-N 3.11Å |
| 34 | S | 55.7 | Low | 64 | Low | 78 Ų | 78 | 108.1 Ų | 108.1 | 55% | 0.545 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -65.4 | -26.9 | 173.7 | -62.8 | 0 | 0 | 0 | 0 | 113.3 | S30 S38 | S30-S34 WeakPolarHBondContact O-CB 3.12Å; S30-S34 PolarHBondContact O-N 2.8Å; S30-S34 PolarHBondContact O-OG 3.21Å; S34-S38 PolarHBondContact O-N 3.22Å |
| 35 | R | 51.3 | Low | 62.3 | Low | 209 Ų | 209 | 111.9 Ų | 111.9 | 79% | 0.789 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -74.7 | -25.8 | 175.2 | -80.2 | -173.1 | -176.8 | 179.7 | 2.3 | 113.5 | A31 S32 F33 | A31-R35 PolarHBondContact O-N 2.91Å; A31-R35 VanDerWaalsContact O-N 3.14Å; S32-R35 PolarHBondContact O-N 2.97Å; F33-R35 VanDerWaalsContact C-N 3.27Å; F33-R35 PolarHBondContact O-N 2.9Å |
| 36 | A | 48.9 | Very low | 60.6 | Low | 71 Ų | 71 | 115 Ų | 115 | 59% | 0.587 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -79.1 | -21.3 | 176 | 0 | 0 | 0 | 0 | 0 | 113 | S32 F33 | S32-A36 PolarHBondContact O-N 3.37Å; F33-A36 PolarHBondContact O-N 3.01Å |
| 37 | Q | 47.8 | Very low | 58.9 | Low | 117 Ų | 117 | 115.8 Ų | 115.8 | 55% | 0.547 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -93.9 | -7.7 | 175.1 | -89.8 | 163.8 | -7.4 | 0 | 0 | 114 | F33 T39 T40 | F33-Q37 PolarHBondContact O-N 3.11Å; Q37-T39 PolarHBondContact O-N 2.95Å; Q37-T40 PolarHBondContact O-N 3.49Å |
| 38 | S | 42.7 | Very low | 57.1 | Low | 100 Ų | 100 | 115.2 Ų | 115.2 | 70% | 0.699 | 62% | 0.619 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81 | 12.7 | 177.9 | -162.1 | 0 | 0 | 0 | 0 | 114.3 | S34 | S34-S38 PolarHBondContact O-N 3.22Š|
| 39 | T | 50.8 | Low | 55.4 | Low | 128 Ų | 128 | 116.4 Ų | 116.4 | 79% | 0.785 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -118.5 | 6.4 | 167.2 | 62.6 | 0 | 0 | 0 | 0 | 112.9 | Q37 | Q37-T39 PolarHBondContact O-N 2.95Š|
| 40 | T | 49.2 | Very low | 53.9 | Low | 65 Ų | 65 | 116.6 Ų | 116.6 | 40% | 0.399 | 62% | 0.622 | S | S | . | * | trans | -147.2 | 60.9 | -179.6 | -175.6 | 0 | 0 | 0 | 0 | 109.4 | Q37 E42 | Q37-T40 PolarHBondContact O-N 3.49Å; T40-E42 PolarHBondContact O-N 3.28Å; T40-E42 VanDerWaalsContact O-N 3.15Å; T40-E42 VanDerWaalsContact OG1-CG 3.27Å; T40-E42 WeakPolarHBondContact OG1-CG 3.47Å; T40-E42 PolarHBondContact OG1-OE1 3.01Å | ||
| 41 | V | 46.7 | Very low | 52.7 | Low | 99 Ų | 99 | 119.1 Ų | 119.1 | 60% | 0.6 | 64% | 0.635 | S | S | * | * | trans | -77.1 | 83.2 | 141.5 | -172.9 | 0 | 0 | 0 | 0 | 104.9 | H43 | V41-H43 WeakPolarHBondContact CG1-CD2 3.4Å; V41-H43 VanDerWaalsContact CG1-CE1 3.41Å; V41-H43 WeakPolarHBondContact CG1-CE1 3.36Å; V41-H43 WeakPolarHBondContact CG1-NE2 3.49Å; V41-H43 PolarHBondContact O-N 2.88Å | ||
| 42 | E | 48.9 | Very low | 51.8 | Low | 144 Ų | 144 | 123.9 Ų | 123.9 | 67% | 0.673 | 65% | 0.654 | S | S | * | * | trans | -56.2 | 89.9 | 151.7 | -54 | -58.7 | 125.1 | 0 | 0 | 105.1 | T40 D44 | T40-E42 PolarHBondContact O-N 3.28Å; T40-E42 VanDerWaalsContact O-N 3.15Å; T40-E42 VanDerWaalsContact OG1-CG 3.27Å; T40-E42 WeakPolarHBondContact OG1-CG 3.47Å; T40-E42 PolarHBondContact OG1-OE1 3.01Å; E42-D44 PolarHBondContact O-N 3.41Å | ||
| 43 | H | 48.5 | Very low | 50.9 | Low | 160 Ų | 160 | 126.5 Ų | 126.5 | 74% | 0.741 | 66% | 0.662 | S | S | * | * | trans | -73 | 58.3 | 158 | -77.6 | -62.7 | 0 | 0 | 0 | 107.6 | V41 F45 | V41-H43 WeakPolarHBondContact CG1-CD2 3.4Å; V41-H43 VanDerWaalsContact CG1-CE1 3.41Å; V41-H43 WeakPolarHBondContact CG1-CE1 3.36Å; V41-H43 WeakPolarHBondContact CG1-NE2 3.49Å; V41-H43 PolarHBondContact O-N 2.88Å; H43-F45 PolarHBondContact O-N 3Å | ||
| 44 | D | 60.2 | Low | 50.7 | Low | 114 Ų | 114 | 127.6 Ų | 127.6 | 61% | 0.61 | 66% | 0.662 | S | S | * | * | trans | -76.8 | 106.1 | 159.8 | -163.6 | 12.6 | 0 | 0 | 0 | 105.7 | E42 | E42-D44 PolarHBondContact O-N 3.41Š| ||
| 45 | F | 52.1 | Low | 50.6 | Low | 170 Ų | 170 | 127.3 Ų | 127.3 | 75% | 0.746 | 66% | 0.66 | S | S | * | * | S | Bend | trans | 167.5 | 92.8 | 139.3 | -77.5 | -56.7 | 0 | 0 | 0 | 106.8 | H43 I47 | H43-F45 PolarHBondContact O-N 3Å; F45-I47 PolarHBondContact O-N 3.43Å |
| 46 | H | 51.3 | Low | 51 | Low | 169 Ų | 169 | 124.1 Ų | 124.1 | 78% | 0.782 | 67% | 0.667 | S | S | * | * | trans | 68.7 | 23.7 | 156.5 | -77.1 | -90.4 | 0 | 0 | 0 | 120 | V48 | H46-V48 PolarHBondContact O-N 3.45Š| ||
| 47 | I | 50.4 | Low | 51.6 | Low | 135 Ų | 135 | 128.8 Ų | 128.8 | 69% | 0.692 | 68% | 0.677 | S | S | * | * | trans | -82.1 | 75 | 150.7 | -54.1 | 177.8 | 0 | 0 | 0 | 106.6 | F45 H49 | F45-I47 PolarHBondContact O-N 3.43Å; I47-H49 PolarHBondContact O-N 2.87Å | ||
| 48 | V | 47.6 | Very low | 52.4 | Low | 110 Ų | 110 | 126.3 Ų | 126.3 | 67% | 0.667 | 67% | 0.666 | S | S | * | * | trans | -42.9 | 116.4 | 153.7 | 169.8 | 0 | 0 | 0 | 0 | 105.1 | H46 N50 | H46-V48 PolarHBondContact O-N 3.45Å; V48-N50 PolarHBondContact O-N 3.44Å | ||
| 49 | H | 50.8 | Low | 53.7 | Low | 142 Ų | 142 | 125.4 Ų | 125.4 | 66% | 0.657 | 65% | 0.654 | S | S | * | * | trans | -57.5 | 85.5 | 167.2 | -67.3 | -75.2 | 0 | 0 | 0 | 107.2 | I47 V51 D52 | I47-H49 PolarHBondContact O-N 2.87Å; H49-V51 HydrophobicContact CB-CB 4.32Å; H49-V51 HydrophobicContact CB-CG2 4.28Å; H49-V51 PolarHBondContact O-N 3.19Å; H49-D52 PolarHBondContact O-N 2.9Å | ||
| 50 | N | 50.1 | Low | 54.3 | Low | 115 Ų | 115 | 124.5 Ų | 124.5 | 62% | 0.615 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.9 | 37.1 | 158.3 | -171.6 | 71.4 | 0 | 0 | 0 | 109.2 | V48 D52 N53 | V48-N50 PolarHBondContact O-N 3.44Å; N50-D52 VanDerWaalsContact C-N 3.27Å; N50-N53 WeakPolarHBondContact OD1-CB 3.25Å |
| 51 | V | 51 | Low | 55 | Low | 113 Ų | 113 | 128.4 Ų | 128.4 | 69% | 0.685 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.6 | -12.5 | 163.2 | -179 | 0 | 0 | 0 | 0 | 108.9 | H49 | H49-V51 HydrophobicContact CB-CB 4.32Å; H49-V51 HydrophobicContact CB-CG2 4.28Å; H49-V51 PolarHBondContact O-N 3.19Å |
| 52 | D | 52.1 | Low | 56.1 | Low | 146 Ų | 146 | 130.3 Ų | 130.3 | 78% | 0.781 | 66% | 0.658 | S | S | * | * | S | Bend | trans | -93.5 | -2.1 | 175.6 | -72.6 | -46.9 | 0 | 0 | 0 | 115 | H49 N50 R54 | H49-D52 PolarHBondContact O-N 2.9Å; N50-D52 VanDerWaalsContact C-N 3.27Å; D52-R54 VanDerWaalsContact C-N 3.29Å; D52-R54 PolarHBondContact O-N 3.37Å |
| 53 | N | 51.6 | Low | 56.9 | Low | 128 Ų | 128 | 126.6 Ų | 126.6 | 68% | 0.684 | 64% | 0.638 | S | S | * | * | S | Bend | trans | -95.4 | 18.4 | 176.4 | -146.2 | 32.7 | 0 | 0 | 0 | 113.3 | N50 | N50-N53 WeakPolarHBondContact OD1-CB 3.25Š|
| 54 | R | 57 | Low | 57.8 | Low | 166 Ų | 166 | 124.1 Ų | 124.1 | 63% | 0.626 | 64% | 0.635 | S | S | * | * | S | Bend | trans | -102.9 | 105.8 | 156.9 | -71.7 | -175.4 | -177.9 | 147.4 | 1.9 | 105.9 | D52 P56 I58 | D52-R54 VanDerWaalsContact C-N 3.29Å; D52-R54 PolarHBondContact O-N 3.37Å; R54-P56 VanDerWaalsContact O-N 3.13Å; R54-I58 HydrophobicContact CB-CD1 3.82Å; R54-I58 HydrophobicContact CG-CD1 3.84Å |
| 55 | S | 54.4 | Low | 58.1 | Low | 72 Ų | 72 | 122.4 Ų | 122.4 | 50% | 0.503 | 64% | 0.644 | S | S | . | * | trans | -43.4 | 125.9 | 157.6 | -174.4 | 0 | 0 | 0 | 0 | 107.1 | E57 I58 | S55-E57 PolarHBondContact O-N 3.49Å; S55-I58 WeakPolarHBondContact O-CG1 3.5Å; S55-I58 PolarHBondContact O-N 3.39Å; S55-I58 VanDerWaalsContact O-N 3.12Å | ||
| 56 | P | 58.3 | Low | 58.8 | Low | 142 Ų | 142 | 121.6 Ų | 121.6 | 92% | 0.922 | 64% | 0.636 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.9 | -1.1 | -177.4 | 24.7 | -33.1 | 0 | 0 | 0 | 113 | R54 | R54-P56 VanDerWaalsContact O-N 3.13Š|
| 57 | E | 62 | Low | 59.5 | Low | 170 Ų | 170 | 117 Ų | 117 | 79% | 0.794 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.5 | 14.7 | -178.4 | -152.3 | 178.8 | -165.8 | 0 | 0 | 113.5 | S55 D59 | S55-E57 PolarHBondContact O-N 3.49Å; E57-D59 PolarHBondContact O-N 2.8Å |
| 58 | I | 64.4 | Low | 60.2 | Low | 64 Ų | 64 | 114.4 Ų | 114.4 | 33% | 0.328 | 62% | 0.624 | S | S | . | * | trans | -65.6 | 112.1 | 174.6 | -69.8 | 167.8 | 0 | 0 | 0 | 109.1 | R54 S55 W62 | R54-I58 HydrophobicContact CB-CD1 3.82Å; R54-I58 HydrophobicContact CG-CD1 3.84Å; S55-I58 WeakPolarHBondContact O-CG1 3.5Å; S55-I58 PolarHBondContact O-N 3.39Å; S55-I58 VanDerWaalsContact O-N 3.12Å; I58-W62 HydrophobicContact CG2-CB 3.81Å; I58-W62 HydrophobicContact CG2-CG 3.9Å | ||
| 59 | D | 70.7 | Confident | 61.1 | Low | 81 Ų | 81 | 118.8 Ų | 118.8 | 43% | 0.433 | 63% | 0.629 | S | S | . | * | trans | -47.9 | 126.7 | 174.5 | -177.6 | -10.2 | 0 | 0 | 0 | 110.8 | E57 F61 W62 | E57-D59 PolarHBondContact O-N 2.8Å; D59-F61 PolarHBondContact O-N 3.23Å; D59-F61 WeakPolarHBondContact OD1-CB 3.49Å; D59-F61 VanDerWaalsContact OD1-CD2 3.27Å; D59-F61 WeakPolarHBondContact OD1-CD2 3.34Å; D59-F61 PolarHBondContact OD1-N 3.44Å; D59-W62 WeakPolarHBondContact O-CB 3.31Å; D59-W62 PolarHBondContact O-N 3.08Å | ||
| 60 | P | 62.1 | Low | 61.9 | Low | 109 Ų | 109 | 115.8 Ų | 115.8 | 71% | 0.708 | 62% | 0.622 | S | S | * | * | G | 310 helix | trans | -49.7 | -28 | 172.2 | -27.7 | 34.8 | 0 | 0 | 0 | 114.2 | W62 | P60-W62 VanDerWaalsContact C-N 3.34Š|
| 61 | F | 65.4 | Low | 62.6 | Low | 147 Ų | 147 | 118.1 Ų | 118.1 | 65% | 0.645 | 63% | 0.633 | S | S | * | * | G | 310 helix | trans | -83.8 | -2.6 | 177.9 | -61.3 | -72.1 | 0 | 0 | 0 | 114.6 | D59 Y63 V64 | D59-F61 PolarHBondContact O-N 3.23Å; D59-F61 WeakPolarHBondContact OD1-CB 3.49Å; D59-F61 VanDerWaalsContact OD1-CD2 3.27Å; D59-F61 WeakPolarHBondContact OD1-CD2 3.34Å; D59-F61 PolarHBondContact OD1-N 3.44Å; F61-Y63 PolarHBondContact O-N 3.13Å; F61-V64 HydrophobicContact CB-CG2 4.44Å; F61-V64 HydrophobicContact CD1-CG2 4.02Å; F61-V64 WeakPolarHBondContact O-CB 3.35Å; F61-V64 PolarHBondContact O-N 3.03Å |
| 62 | W | 69.1 | Low | 63.5 | Low | 139 Ų | 139 | 116.1 Ų | 116.1 | 53% | 0.527 | 64% | 0.635 | S | S | . | * | G | 310 helix | trans | -53.7 | -25.8 | 178.8 | -176 | -102.3 | 0 | 0 | 0 | 114.1 | I58 D59 P60 R66 | I58-W62 HydrophobicContact CG2-CB 3.81Å; I58-W62 HydrophobicContact CG2-CG 3.9Å; D59-W62 WeakPolarHBondContact O-CB 3.31Å; D59-W62 PolarHBondContact O-N 3.08Å; P60-W62 VanDerWaalsContact C-N 3.34Å; W62-R66 VanDerWaalsContact CE2-NH1 3.28Å |
| 63 | Y | 65.9 | Low | 64.2 | Low | 66 Ų | 66 | 119.6 Ų | 119.6 | 26% | 0.259 | 64% | 0.637 | S | S | . | * | G | 310 helix | trans | -85.8 | -22.6 | 177.7 | -64.8 | -77.7 | 0 | 0 | 0 | 114.1 | F61 V68 P70 | F61-Y63 PolarHBondContact O-N 3.13Å; Y63-V68 WeakPolarHBondContact CB-O 3.3Å; Y63-P70 HydrophobicContact CG-CG 4.49Å |
| 64 | V | 66.8 | Low | 64.5 | Low | 109 Ų | 109 | 122.9 Ų | 122.9 | 66% | 0.661 | 65% | 0.645 | S | S | * | * | G | 310 helix | trans | -74.9 | -36.5 | -169.4 | -178 | 0 | 0 | 0 | 0 | 111.6 | F61 R66 | F61-V64 HydrophobicContact CB-CG2 4.44Å; F61-V64 HydrophobicContact CD1-CG2 4.02Å; F61-V64 WeakPolarHBondContact O-CB 3.35Å; F61-V64 PolarHBondContact O-N 3.03Å; V64-R66 PolarHBondContact O-N 3.41Å |
| 65 | G | 65.9 | Low | 64.8 | Low | 78 Ų | 78 | 117.4 Ų | 117.4 | 80% | 0.804 | 64% | 0.641 | S | S | * | * | G | 310 helix | trans | -81.3 | -8.3 | 179.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||
| 66 | R | 68.1 | Low | 65.1 | Low | 152 Ų | 152 | 122.7 Ų | 122.7 | 57% | 0.574 | 66% | 0.655 | S | S | * | * | G | 310 helix | trans | -115.2 | 1.7 | -174.1 | -66.4 | -167.9 | 176.5 | 91.1 | -2.9 | 114.4 | W62 V64 V68 | W62-R66 VanDerWaalsContact CE2-NH1 3.28Å; V64-R66 PolarHBondContact O-N 3.41Å; R66-V68 HydrophobicContact CB-CG2 4.42Å; R66-V68 PolarHBondContact O-N 3.03Å |
| 67 | G | 65.4 | Low | 65.4 | Low | 73 Ų | 73 | 127.4 Ų | 127.4 | 75% | 0.753 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 64.7 | 5.6 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||
| 68 | V | 65.8 | Low | 65.1 | Low | 80 Ų | 80 | 125.7 Ų | 125.7 | 49% | 0.485 | 65% | 0.646 | S | S | . | * | trans | -89.3 | 113.9 | 178.4 | -180 | 0 | 0 | 0 | 0 | 107.9 | Y63 R66 | Y63-V68 WeakPolarHBondContact CB-O 3.3Å; R66-V68 HydrophobicContact CB-CG2 4.42Å; R66-V68 PolarHBondContact O-N 3.03Å | ||
| 69 | R | 66.8 | Low | 64.7 | Low | 203 Ų | 203 | 127.1 Ų | 127.1 | 77% | 0.766 | 66% | 0.661 | S | S | * | * | trans | -71.1 | 143.3 | 171.5 | -63.7 | -174.8 | 179.9 | 107.9 | 0.4 | 109.2 | I71 | R69-I71 PolarHBondContact O-N 3Š| ||
| 70 | P | 66.4 | Low | 63.9 | Low | 78 Ų | 78 | 130.8 Ų | 130.8 | 51% | 0.506 | 68% | 0.681 | S | S | . | * | trans | -54.7 | 117.6 | 174.2 | -4.3 | 5.4 | 0 | 0 | 0 | 109.6 | Y63 G72 | Y63-P70 HydrophobicContact CG-CG 4.49Å; P70-G72 PolarHBondContact O-N 3.5Å | ||
| 71 | I | 66.1 | Low | 63.4 | Low | 165 Ų | 165 | 131.8 Ų | 131.8 | 85% | 0.846 | 68% | 0.678 | S | S | * | * | S | Bend | trans | -71.2 | 112.5 | 172.8 | -59.8 | -176.6 | 0 | 0 | 0 | 106.2 | R69 | R69-I71 PolarHBondContact O-N 3Š|
| 72 | G | 68.6 | Low | 62.6 | Low | 70 Ų | 70 | 130 Ų | 130 | 72% | 0.722 | 68% | 0.675 | S | S | * | * | S | Bend | trans | 99.3 | 60.3 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | P70 | P70-G72 PolarHBondContact O-N 3.5Š|
| 73 | R | 66.4 | Low | 61.7 | Low | 220 Ų | 220 | 128.2 Ų | 128.2 | 83% | 0.83 | 69% | 0.69 | S | S | * | * | trans | -159.5 | 56.5 | 134.5 | -158.6 | 175.1 | -179.3 | -91.3 | 4.4 | 110.2 | G75 | R73-G75 PolarHBondContact O-N 3.46Š| ||
| 74 | F | 58.6 | Low | 61.1 | Low | 196 Ų | 196 | 132.7 Ų | 132.7 | 86% | 0.86 | 72% | 0.718 | S | S | * | * | trans | -64.5 | 119.2 | 159 | -92.1 | -83.2 | 0 | 0 | 0 | 106.8 | K76 | F74-K76 PolarHBondContact O-N 3.35Š| ||
| 75 | G | 63.9 | Low | 60.3 | Low | 52 Ų | 52 | 131.3 Ų | 131.3 | 54% | 0.536 | 73% | 0.725 | S | S | . | * | trans | -43.5 | 128.9 | -167.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | R73 R77 | R73-G75 PolarHBondContact O-N 3.46Å; G75-R77 PolarHBondContact O-N 2.98Å | ||
| 76 | K | 60.5 | Low | 60 | Low | 182 Ų | 182 | 131.4 Ų | 131.4 | 79% | 0.791 | 71% | 0.708 | S | S | * | * | trans | -53.2 | 109.9 | 159.8 | -85.4 | -166.9 | 167.4 | -176.5 | 0 | 106.2 | F74 H78 | F74-K76 PolarHBondContact O-N 3.35Å; K76-H78 VanDerWaalsContact C-N 3.28Å; K76-H78 VanDerWaalsContact CB-CD2 3.41Å; K76-H78 WeakPolarHBondContact CB-CD2 3.38Å; K76-H78 WeakPolarHBondContact CB-NE2 3.47Å; K76-H78 PolarHBondContact O-CD2 3.35Å; K76-H78 VanDerWaalsContact O-CD2 3.23Å; K76-H78 PolarHBondContact O-N 2.74Å | ||
| 77 | R | 63.3 | Low | 59.5 | Low | 241 Ų | 241 | 127.5 Ų | 127.5 | 91% | 0.909 | 70% | 0.703 | S | S | * | * | trans | -73.2 | 93.7 | 169.3 | -65.7 | -176.3 | -179 | -166.5 | 0.1 | 105.7 | G75 S79 | G75-R77 PolarHBondContact O-N 2.98Å; R77-S79 PolarHBondContact O-N 2.99Å | ||
| 78 | H | 56.2 | Low | 59.2 | Low | 135 Ų | 135 | 127 Ų | 127 | 63% | 0.625 | 70% | 0.699 | S | S | * | * | trans | -73.4 | 91.2 | 164 | -49 | 176.9 | 0 | 0 | 0 | 103 | K76 N80 | K76-H78 VanDerWaalsContact C-N 3.28Å; K76-H78 VanDerWaalsContact CB-CD2 3.41Å; K76-H78 WeakPolarHBondContact CB-CD2 3.38Å; K76-H78 WeakPolarHBondContact CB-NE2 3.47Å; K76-H78 PolarHBondContact O-CD2 3.35Å; K76-H78 VanDerWaalsContact O-CD2 3.23Å; K76-H78 PolarHBondContact O-N 2.74Å; H78-N80 VanDerWaalsContact C-N 3.26Å; H78-N80 PolarHBondContact O-N 2.93Å | ||
| 79 | S | 57.4 | Low | 59.1 | Low | 93 Ų | 93 | 128.1 Ų | 128.1 | 65% | 0.65 | 70% | 0.7 | S | S | * | * | trans | -62.4 | 104 | 159.1 | 49.1 | 0 | 0 | 0 | 0 | 104.6 | R77 M81 | R77-S79 PolarHBondContact O-N 2.99Å; S79-M81 PolarHBondContact O-N 3.23Å | ||
| 80 | N | 53.3 | Low | 59.3 | Low | 159 Ų | 159 | 122.1 Ų | 122.1 | 85% | 0.85 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -61 | 80.3 | 174.8 | -77.2 | -25.7 | 0 | 0 | 0 | 108.9 | H78 | H78-N80 VanDerWaalsContact C-N 3.26Å; H78-N80 PolarHBondContact O-N 2.93Å |
| 81 | M | 52.3 | Low | 59.7 | Low | 129 Ų | 129 | 122.2 Ų | 122.2 | 64% | 0.635 | 68% | 0.681 | S | S | * | * | trans | -147.9 | 21.3 | 166.5 | -156.6 | 135.8 | 105.1 | 0 | 0 | 111.3 | S79 | S79-M81 PolarHBondContact O-N 3.23Š| ||
| 82 | D | 48.6 | Very low | 60.3 | Low | 110 Ų | 110 | 118.7 Ų | 118.7 | 59% | 0.588 | 67% | 0.667 | S | S | * | * | trans | -103.3 | 72.6 | 167 | -70.4 | -43 | 0 | 0 | 0 | 108.3 | S87 | D82-S87 VanDerWaalsContact OD1-CB 3.22Å; D82-S87 WeakPolarHBondContact OD1-CB 3.3Å; D82-S87 PolarHBondContact OD1-OG 3.47Å | ||
| 83 | A | 49.7 | Very low | 61 | Low | 101 Ų | 101 | 119.3 Ų | 119.3 | 84% | 0.835 | 65% | 0.653 | S | S | * | * | S | Bend | trans | -128.3 | 4.8 | 162.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||
| 84 | L | 52.9 | Low | 61.6 | Low | 161 Ų | 161 | 114.8 Ų | 114.8 | 84% | 0.843 | 64% | 0.636 | S | S | * | * | S | Bend | trans | -148 | 105.6 | 168.4 | -154.1 | 60.4 | 0 | 0 | 0 | 109.3 | N86 | L84-N86 PolarHBondContact O-N 3.38Š|
| 85 | G | 51 | Low | 63.1 | Low | 80 Ų | 80 | 109.2 Ų | 109.2 | 83% | 0.825 | 62% | 0.619 | S | S | * | * | S | Bend | trans | -57.6 | 120.5 | -159.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||
| 86 | N | 57.9 | Low | 64.4 | Low | 80 Ų | 80 | 111.1 Ų | 111.1 | 43% | 0.428 | 62% | 0.616 | S | S | . | * | trans | -169.9 | 48 | 147.1 | -152.7 | 26 | 0 | 0 | 0 | 110.9 | L84 G88 M89 | L84-N86 PolarHBondContact O-N 3.38Å; N86-G88 VanDerWaalsContact C-N 3.26Å; N86-G88 PolarHBondContact O-N 2.71Å; N86-G88 VanDerWaalsContact O-N 3.14Å; N86-M89 PolarHBondContact ND2-SD 2.91Å; N86-M89 PolarHBondContact O-N 3.3Å | ||
| 87 | S | 57.6 | Low | 65.9 | Low | 69 Ų | 69 | 106.6 Ų | 106.6 | 48% | 0.483 | 60% | 0.598 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -65.6 | -20 | -162.9 | -157.1 | 0 | 0 | 0 | 0 | 115 | D82 | D82-S87 VanDerWaalsContact OD1-CB 3.22Å; D82-S87 WeakPolarHBondContact OD1-CB 3.3Å; D82-S87 PolarHBondContact OD1-OG 3.47Å |
| 88 | G | 59.7 | Low | 67.3 | Low | 64 Ų | 64 | 100.9 Ų | 100.9 | 66% | 0.66 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79 | -23.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | N86 | N86-G88 VanDerWaalsContact C-N 3.26Å; N86-G88 PolarHBondContact O-N 2.71Å; N86-G88 VanDerWaalsContact O-N 3.14Å |
| 89 | M | 62.8 | Low | 69.1 | Low | 102 Ų | 102 | 99.7 Ų | 99.7 | 50% | 0.502 | 58% | 0.582 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -101 | -17.1 | -172.9 | -62.1 | -179.8 | 77.2 | 0 | 0 | 113.3 | N86 P91 V92 L93 | N86-M89 PolarHBondContact ND2-SD 2.91Å; N86-M89 PolarHBondContact O-N 3.3Å; M89-P91 VanDerWaalsContact C-CD 3.5Å; M89-V92 WeakPolarHBondContact O-CB 3.45Å; M89-V92 PolarHBondContact O-N 3.42Å; M89-L93 WeakPolarHBondContact O-CG 3.28Å; M89-L93 PolarHBondContact O-N 2.91Å |
| 90 | Q | 72.8 | Confident | 70.8 | Confident | 77 Ų | 77 | 100 Ų | 100 | 36% | 0.36 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -50.1 | -46.5 | 176.8 | -69.9 | -67.2 | -8.3 | 0 | 0 | 114.2 | V92 L93 R94 | Q90-V92 VanDerWaalsContact C-N 3.32Å; Q90-V92 PolarHBondContact O-N 2.9Å; Q90-L93 PolarHBondContact O-N 2.92Å; Q90-R94 VanDerWaalsContact O-CG 3.3Å; Q90-R94 WeakPolarHBondContact O-CG 3.31Å; Q90-R94 PolarHBondContact O-N 3.45Å |
| 91 | P | 74.5 | Confident | 72.7 | Confident | 80 Ų | 80 | 96.7 Ų | 96.7 | 52% | 0.519 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -65.7 | -34.1 | 177.3 | 23.8 | -32.8 | 0 | 0 | 0 | 112.8 | M89 R94 T95 | M89-P91 VanDerWaalsContact C-CD 3.5Å; P91-R94 PolarHBondContact O-N 3.45Å; P91-T95 WeakPolarHBondContact O-CG2 3.34Å; P91-T95 PolarHBondContact O-N 3.5Å; P91-T95 PolarHBondContact O-OG1 3.01Å |
| 92 | V | 77.4 | Confident | 74.6 | Confident | 91 Ų | 91 | 94.2 Ų | 94.2 | 55% | 0.552 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -69.9 | -40.7 | 177.1 | -178.8 | 0 | 0 | 0 | 0 | 110.9 | M89 Q90 T95 L96 | M89-V92 WeakPolarHBondContact O-CB 3.45Å; M89-V92 PolarHBondContact O-N 3.42Å; Q90-V92 VanDerWaalsContact C-N 3.32Å; Q90-V92 PolarHBondContact O-N 2.9Å; V92-T95 WeakPolarHBondContact CA-OG1 3.3Å; V92-T95 PolarHBondContact O-N 3.45Å; V92-T95 PolarHBondContact O-OG1 3Å; V92-L96 WeakPolarHBondContact O-CB 3.29Å; V92-L96 PolarHBondContact O-N 2.9Å |
| 93 | L | 83.1 | Confident | 76.6 | Confident | 84 Ų | 84 | 94.1 Ų | 94.1 | 44% | 0.44 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -66.2 | -38.9 | 176.2 | -65.9 | 177.8 | 0 | 0 | 0 | 111.7 | M89 Q90 L96 E97 | M89-L93 WeakPolarHBondContact O-CG 3.28Å; M89-L93 PolarHBondContact O-N 2.91Å; Q90-L93 PolarHBondContact O-N 2.92Å; L93-L96 PolarHBondContact O-N 3.5Å; L93-E97 VanDerWaalsContact O-CB 3.28Å; L93-E97 WeakPolarHBondContact O-CB 3.49Å; L93-E97 PolarHBondContact O-N 3.24Å |
| 94 | R | 79.9 | Confident | 78.5 | Confident | 124 Ų | 124 | 97 Ų | 97 | 47% | 0.468 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -66.6 | -41.6 | 176.1 | -70.6 | -60.8 | -176 | -174.7 | 2.8 | 113 | Q90 P91 E97 L98 | Q90-R94 VanDerWaalsContact O-CG 3.3Å; Q90-R94 WeakPolarHBondContact O-CG 3.31Å; Q90-R94 PolarHBondContact O-N 3.45Å; P91-R94 PolarHBondContact O-N 3.45Å; R94-E97 WeakPolarHBondContact CD-OE2 3.39Å; R94-E97 IonicContact CZ-OE2 3.7Å; R94-E97 IonicContact NE-OE2 3.97Å; R94-E97 IonicContact NH1-OE1 3.77Å; R94-E97 IonicContact NH1-OE2 2.74Å; R94-E97 PolarHBondContact NH1-OE2 3.35Å; R94-E97 PolarHBondContact O-N 3.03Å; R94-L98 WeakPolarHBondContact O-CB 3Å; R94-L98 VanDerWaalsContact O-CG 3.25Å; R94-L98 WeakPolarHBondContact O-CG 3.42Å; R94-L98 PolarHBondContact O-N 2.87Å |
| 95 | T | 89.8 | Confident | 80.4 | Confident | 80 Ų | 80 | 97 Ų | 97 | 49% | 0.491 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.8 | -40.8 | 176.1 | 48.5 | 0 | 0 | 0 | 0 | 111.4 | P91 V92 L98 L99 | P91-T95 WeakPolarHBondContact O-CG2 3.34Å; P91-T95 PolarHBondContact O-N 3.5Å; P91-T95 PolarHBondContact O-OG1 3.01Å; V92-T95 WeakPolarHBondContact CA-OG1 3.3Å; V92-T95 PolarHBondContact O-N 3.45Å; V92-T95 PolarHBondContact O-OG1 3Å; T95-L98 PolarHBondContact O-N 2.99Å; T95-L99 WeakPolarHBondContact O-CG 3.41Å; T95-L99 PolarHBondContact O-N 3.01Å |
| 96 | L | 91.4 | Very high | 82.1 | Confident | 91 Ų | 91 | 99.6 Ų | 99.6 | 48% | 0.476 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.7 | -43.9 | 174.6 | -173.1 | 66.1 | 0 | 0 | 0 | 112.2 | V92 L93 L98 L99 L100 | V92-L96 WeakPolarHBondContact O-CB 3.29Å; V92-L96 PolarHBondContact O-N 2.9Å; L93-L96 PolarHBondContact O-N 3.5Å; L96-L98 VanDerWaalsContact C-N 3.34Å; L96-L98 PolarHBondContact O-N 2.87Å; L96-L99 PolarHBondContact O-N 2.98Å; L96-L100 HydrophobicContact CG-CD1 4.19Å; L96-L100 WeakPolarHBondContact O-CB 3.45Å; L96-L100 WeakPolarHBondContact O-CG 3.41Å; L96-L100 PolarHBondContact O-N 3.27Å |
| 97 | E | 92.9 | Very high | 83.1 | Confident | 88 Ų | 88 | 100.2 Ų | 100.2 | 41% | 0.411 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -59.1 | -44.5 | 176.4 | -178 | 179.5 | -164.5 | 0 | 0 | 111.4 | L93 R94 L100 N101 | L93-E97 VanDerWaalsContact O-CB 3.28Å; L93-E97 WeakPolarHBondContact O-CB 3.49Å; L93-E97 PolarHBondContact O-N 3.24Å; R94-E97 WeakPolarHBondContact CD-OE2 3.39Å; R94-E97 IonicContact CZ-OE2 3.7Å; R94-E97 IonicContact NE-OE2 3.97Å; R94-E97 IonicContact NH1-OE1 3.77Å; R94-E97 IonicContact NH1-OE2 2.74Å; R94-E97 PolarHBondContact NH1-OE2 3.35Å; R94-E97 PolarHBondContact O-N 3.03Å; E97-L100 PolarHBondContact O-N 3.2Å; E97-N101 WeakPolarHBondContact O-CB 3.49Å; E97-N101 VanDerWaalsContact O-CG 3.26Å; E97-N101 PolarHBondContact O-N 3.35Å; E97-N101 PolarHBondContact O-ND2 3.22Å |
| 98 | L | 92.8 | Very high | 84.2 | Confident | 120 Ų | 120 | 101 Ų | 101 | 63% | 0.628 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -64.4 | -42.3 | 176.5 | -70.9 | 171.3 | 0 | 0 | 0 | 112.2 | R94 T95 L96 N101 S102 | R94-L98 WeakPolarHBondContact O-CB 3Å; R94-L98 VanDerWaalsContact O-CG 3.25Å; R94-L98 WeakPolarHBondContact O-CG 3.42Å; R94-L98 PolarHBondContact O-N 2.87Å; T95-L98 PolarHBondContact O-N 2.99Å; L96-L98 VanDerWaalsContact C-N 3.34Å; L96-L98 PolarHBondContact O-N 2.87Å; L98-N101 PolarHBondContact O-N 3.3Å; L98-S102 WeakPolarHBondContact O-CB 3.38Å; L98-S102 PolarHBondContact O-N 2.66Å |
| 99 | L | 94.2 | Very high | 85 | Confident | 110 Ų | 110 | 103 Ų | 103 | 58% | 0.576 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -63.3 | -45.9 | 177.2 | -75.3 | 171.9 | 0 | 0 | 0 | 111.7 | T95 L96 N101 S102 L103 | T95-L99 WeakPolarHBondContact O-CG 3.41Å; T95-L99 PolarHBondContact O-N 3.01Å; L96-L99 PolarHBondContact O-N 2.98Å; L99-N101 PolarHBondContact O-N 2.92Å; L99-S102 WeakPolarHBondContact O-CB 3.25Å; L99-S102 PolarHBondContact O-N 2.83Å; L99-L103 WeakPolarHBondContact O-CG 3.43Å; L99-L103 PolarHBondContact O-N 3.15Å |
| 100 | L | 92.9 | Very high | 85.7 | Confident | 101 Ų | 101 | 104.1 Ų | 104.1 | 53% | 0.529 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63 | -42.2 | 177.8 | -71.2 | 175 | 0 | 0 | 0 | 111.7 | L96 E97 S102 L103 R104 | L96-L100 HydrophobicContact CG-CD1 4.19Å; L96-L100 WeakPolarHBondContact O-CB 3.45Å; L96-L100 WeakPolarHBondContact O-CG 3.41Å; L96-L100 PolarHBondContact O-N 3.27Å; E97-L100 PolarHBondContact O-N 3.2Å; L100-S102 VanDerWaalsContact C-N 3.32Å; L100-S102 PolarHBondContact O-N 3.36Å; L100-L103 PolarHBondContact O-N 3.42Å; L100-R104 WeakPolarHBondContact O-CB 3.34Å; L100-R104 PolarHBondContact O-N 3.49Å |
| 101 | N | 92.7 | Very high | 85.8 | Confident | 88 Ų | 88 | 107.3 Ų | 107.3 | 47% | 0.471 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -64.3 | -37.2 | 175.5 | -75.4 | -28 | 0 | 0 | 0 | 112.2 | E97 L98 L99 K105 | E97-N101 WeakPolarHBondContact O-CB 3.49Å; E97-N101 VanDerWaalsContact O-CG 3.26Å; E97-N101 PolarHBondContact O-N 3.35Å; E97-N101 PolarHBondContact O-ND2 3.22Å; L98-N101 PolarHBondContact O-N 3.3Å; L99-N101 PolarHBondContact O-N 2.92Å; N101-K105 WeakPolarHBondContact O-CB 3.41Å; N101-K105 PolarHBondContact O-N 2.96Å |
| 102 | S | 91.9 | Very high | 85.7 | Confident | 78 Ų | 78 | 107.7 Ų | 107.7 | 55% | 0.545 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -66.7 | -42 | 175.8 | -169.5 | 0 | 0 | 0 | 0 | 112.2 | L98 L99 L100 K105 K106 | L98-S102 WeakPolarHBondContact O-CB 3.38Å; L98-S102 PolarHBondContact O-N 2.66Å; L99-S102 WeakPolarHBondContact O-CB 3.25Å; L99-S102 PolarHBondContact O-N 2.83Å; L100-S102 VanDerWaalsContact C-N 3.32Å; L100-S102 PolarHBondContact O-N 3.36Å; S102-K105 PolarHBondContact O-N 3.49Å; S102-K106 PolarHBondContact O-N 2.98Å |
| 103 | L | 90.8 | Very high | 85.3 | Confident | 108 Ų | 108 | 108.2 Ų | 108.2 | 57% | 0.565 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -66.1 | -43.8 | 176.6 | -69.6 | 174.4 | 0 | 0 | 0 | 111.4 | L99 L100 K105 K106 E107 | L99-L103 WeakPolarHBondContact O-CG 3.43Å; L99-L103 PolarHBondContact O-N 3.15Å; L100-L103 PolarHBondContact O-N 3.42Å; L103-K105 VanDerWaalsContact C-N 3.33Å; L103-K105 PolarHBondContact O-N 3.03Å; L103-K106 WeakPolarHBondContact O-CB 3.41Å; L103-K106 PolarHBondContact O-N 3.17Å; L103-E107 PolarHBondContact O-N 3.34Å |
| 104 | R | 90 | Very high | 84.4 | Confident | 160 Ų | 160 | 107 Ų | 107 | 60% | 0.604 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -61.8 | -39.1 | 173.9 | 174.2 | 169.9 | -67.5 | -168.8 | 4 | 112.5 | L100 K106 E107 N108 | L100-R104 WeakPolarHBondContact O-CB 3.34Å; L100-R104 PolarHBondContact O-N 3.49Å; R104-K106 VanDerWaalsContact C-N 3.32Å; R104-E107 WeakPolarHBondContact CA-OE1 3.37Å; R104-E107 WeakPolarHBondContact CG-OE1 3.27Å; R104-E107 IonicContact NE-OE1 3.97Å; R104-E107 WeakPolarHBondContact O-CG 3.25Å; R104-E107 PolarHBondContact O-N 3.14Å; R104-N108 PolarHBondContact O-N 3.02Å; R104-N108 PolarHBondContact O-ND2 2.73Å |
| 105 | K | 91.4 | Very high | 83.5 | Confident | 161 Ų | 161 | 103.4 Ų | 103.4 | 70% | 0.7 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -65 | -40.5 | 175.8 | -172.1 | 176.1 | -179.2 | -179.4 | 0 | 111.2 | N101 S102 L103 N108 L109 | N101-K105 WeakPolarHBondContact O-CB 3.41Å; N101-K105 PolarHBondContact O-N 2.96Å; S102-K105 PolarHBondContact O-N 3.49Å; L103-K105 VanDerWaalsContact C-N 3.33Å; L103-K105 PolarHBondContact O-N 3.03Å; K105-N108 PolarHBondContact O-N 2.87Å; K105-L109 WeakPolarHBondContact O-CB 3.45Å; K105-L109 PolarHBondContact O-N 2.91Å |
| 106 | K | 87.1 | Confident | 81.8 | Confident | 136 Ų | 136 | 105.1 Ų | 105.1 | 59% | 0.591 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -62.9 | -44.8 | 176.2 | -179.8 | -178.2 | 163.2 | 179.5 | 0 | 111.9 | S102 L103 R104 N108 L109 E110 | S102-K106 PolarHBondContact O-N 2.98Å; L103-K106 WeakPolarHBondContact O-CB 3.41Å; L103-K106 PolarHBondContact O-N 3.17Å; R104-K106 VanDerWaalsContact C-N 3.32Å; K106-N108 VanDerWaalsContact C-N 3.29Å; K106-N108 PolarHBondContact O-N 3.21Å; K106-L109 PolarHBondContact O-N 3.23Å; K106-E110 WeakPolarHBondContact O-CB 3.22Å; K106-E110 PolarHBondContact O-N 3.14Å |
| 107 | E | 80.4 | Confident | 80.1 | Confident | 93 Ų | 93 | 106.8 Ų | 106.8 | 44% | 0.435 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -64.8 | -34.2 | -179.9 | 92.2 | -160 | 152.4 | 0 | 0 | 112.4 | L103 R104 K111 | L103-E107 PolarHBondContact O-N 3.34Å; R104-E107 WeakPolarHBondContact CA-OE1 3.37Å; R104-E107 WeakPolarHBondContact CG-OE1 3.27Å; R104-E107 IonicContact NE-OE1 3.97Å; R104-E107 WeakPolarHBondContact O-CG 3.25Å; R104-E107 PolarHBondContact O-N 3.14Å; E107-K111 WeakPolarHBondContact O-CG 3.03Å; E107-K111 PolarHBondContact O-N 2.78Å |
| 108 | N | 78.9 | Confident | 78.2 | Confident | 85 Ų | 85 | 108.8 Ų | 108.8 | 46% | 0.455 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -72.3 | -38.6 | 175 | -80.2 | -81.8 | 0 | 0 | 0 | 111.3 | R104 K105 K106 K111 V112 | R104-N108 PolarHBondContact O-N 3.02Å; R104-N108 PolarHBondContact O-ND2 2.73Å; K105-N108 PolarHBondContact O-N 2.87Å; K106-N108 VanDerWaalsContact C-N 3.29Å; K106-N108 PolarHBondContact O-N 3.21Å; N108-K111 PolarHBondContact O-N 3.5Å; N108-V112 WeakPolarHBondContact O-CG2 3.45Å; N108-V112 PolarHBondContact O-N 3.31Å; N108-V112 VanDerWaalsContact O-N 3.1Å |
| 109 | L | 77.4 | Confident | 76.5 | Confident | 105 Ų | 105 | 108.3 Ų | 108.3 | 55% | 0.55 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -64.5 | -41.1 | 176.4 | -171.5 | 65.5 | 0 | 0 | 0 | 111.7 | K105 K106 V112 I113 | K105-L109 WeakPolarHBondContact O-CB 3.45Å; K105-L109 PolarHBondContact O-N 2.91Å; K106-L109 PolarHBondContact O-N 3.23Å; L109-V112 PolarHBondContact O-N 2.98Å; L109-I113 HydrophobicContact CD1-CD1 4.44Å; L109-I113 HydrophobicContact CG-CD1 4.02Å; L109-I113 WeakPolarHBondContact O-CD1 3.27Å; L109-I113 VanDerWaalsContact O-CG1 3.3Å; L109-I113 WeakPolarHBondContact O-CG1 3.46Å; L109-I113 PolarHBondContact O-N 2.74Å; L109-I113 VanDerWaalsContact O-N 3.09Å |
| 110 | E | 78.2 | Confident | 74.9 | Confident | 126 Ų | 126 | 112.8 Ų | 112.8 | 59% | 0.589 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -62.7 | -42.1 | 176.5 | -170.6 | 173.4 | 165.4 | 0 | 0 | 112 | K106 V112 I113 S114 | K106-E110 WeakPolarHBondContact O-CB 3.22Å; K106-E110 PolarHBondContact O-N 3.14Å; E110-V112 PolarHBondContact O-N 2.97Å; E110-I113 PolarHBondContact O-N 2.99Å; E110-S114 PolarHBondContact O-N 2.7Å; E110-S114 PolarHBondContact O-OG 3.3Å |
| 111 | K | 73.5 | Confident | 72.9 | Confident | 145 Ų | 145 | 115.2 Ų | 115.2 | 63% | 0.63 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -65 | -35.8 | 175.1 | -76.4 | 177.9 | 179.7 | 178.4 | 0 | 113.9 | E107 N108 S114 G115 | E107-K111 WeakPolarHBondContact O-CG 3.03Å; E107-K111 PolarHBondContact O-N 2.78Å; N108-K111 PolarHBondContact O-N 3.5Å; K111-S114 PolarHBondContact O-OG 3.48Å; K111-G115 PolarHBondContact O-N 2.85Å; K111-G115 VanDerWaalsContact O-N 3.16Å |
| 112 | V | 73.2 | Confident | 71.3 | Confident | 87 Ų | 87 | 120.4 Ų | 120.4 | 53% | 0.527 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -67.4 | -44 | 176.4 | 171 | 0 | 0 | 0 | 0 | 110 | N108 L109 E110 G115 E116 | N108-V112 WeakPolarHBondContact O-CG2 3.45Å; N108-V112 PolarHBondContact O-N 3.31Å; N108-V112 VanDerWaalsContact O-N 3.1Å; L109-V112 PolarHBondContact O-N 2.98Å; E110-V112 PolarHBondContact O-N 2.97Å; V112-G115 PolarHBondContact O-N 3.45Å; V112-E116 PolarHBondContact O-N 2.88Å |
| 113 | I | 68.9 | Low | 70.3 | Confident | 102 Ų | 102 | 122.5 Ų | 122.5 | 52% | 0.523 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -67 | -42.7 | -179.6 | -65.7 | 165.5 | 0 | 0 | 0 | 111.6 | L109 E110 G115 E116 E117 | L109-I113 HydrophobicContact CD1-CD1 4.44Å; L109-I113 HydrophobicContact CG-CD1 4.02Å; L109-I113 WeakPolarHBondContact O-CD1 3.27Å; L109-I113 VanDerWaalsContact O-CG1 3.3Å; L109-I113 WeakPolarHBondContact O-CG1 3.46Å; L109-I113 PolarHBondContact O-N 2.74Å; L109-I113 VanDerWaalsContact O-N 3.09Å; E110-I113 PolarHBondContact O-N 2.99Å; I113-G115 PolarHBondContact O-N 3.26Å; I113-E116 PolarHBondContact O-N 3.02Å; I113-E117 PolarHBondContact O-N 2.83Å |
| 114 | S | 63.8 | Low | 69.2 | Low | 58 Ų | 58 | 123.3 Ų | 123.3 | 41% | 0.406 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -69.3 | -21 | 176.1 | 67.5 | 0 | 0 | 0 | 0 | 113.6 | E110 K111 N118 | E110-S114 PolarHBondContact O-N 2.7Å; E110-S114 PolarHBondContact O-OG 3.3Å; K111-S114 PolarHBondContact O-OG 3.48Å; S114-N118 PolarHBondContact O-ND2 3.12Å |
| 115 | G | 60.5 | Low | 68 | Low | 49 Ų | 49 | 121.2 Ų | 121.2 | 51% | 0.505 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -77.6 | -28.4 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113 | K111 V112 I113 | K111-G115 PolarHBondContact O-N 2.85Å; K111-G115 VanDerWaalsContact O-N 3.16Å; V112-G115 PolarHBondContact O-N 3.45Å; I113-G115 PolarHBondContact O-N 3.26Å |
| 116 | E | 55.5 | Low | 66.7 | Low | 116 Ų | 116 | 118.9 Ų | 118.9 | 54% | 0.542 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -92.7 | -18.4 | -173.8 | -160.5 | 161.5 | 178.1 | 0 | 0 | 113.3 | V112 I113 N118 V119 | V112-E116 PolarHBondContact O-N 2.88Å; I113-E116 PolarHBondContact O-N 3.02Å; E116-N118 PolarHBondContact O-N 2.83Å; E116-N118 VanDerWaalsContact O-N 3.13Å; E116-V119 PolarHBondContact O-N 3.01Å |
| 117 | E | 54.6 | Low | 65.4 | Low | 127 Ų | 127 | 117.8 Ų | 117.8 | 59% | 0.593 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.4 | -9.3 | 177.3 | 74 | -175.6 | -178.8 | 0 | 0 | 114.7 | I113 | I113-E117 PolarHBondContact O-N 2.83Š|
| 118 | N | 54.3 | Low | 64.4 | Low | 130 Ų | 130 | 119.5 Ų | 119.5 | 70% | 0.695 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.6 | 0.7 | 179.2 | -62.9 | -67 | 0 | 0 | 0 | 114.5 | S114 E116 | S114-N118 PolarHBondContact O-ND2 3.12Å; E116-N118 PolarHBondContact O-N 2.83Å; E116-N118 VanDerWaalsContact O-N 3.13Å |
| 119 | V | 56.6 | Low | 63.3 | Low | 109 Ų | 109 | 121.9 Ų | 121.9 | 66% | 0.661 | 65% | 0.648 | S | S | * | * | S | Bend | trans | -109.8 | -10.4 | -172.5 | -177.8 | 0 | 0 | 0 | 0 | 113.4 | E116 | E116-V119 PolarHBondContact O-N 3.01Š|
| 120 | W | 59.3 | Low | 62.3 | Low | 205 Ų | 205 | 123.2 Ų | 123.2 | 78% | 0.777 | 66% | 0.655 | S | S | * | * | S | Bend | trans | -121.6 | 16.6 | -171.2 | -69.2 | 103.9 | 0 | 0 | 0 | 115.9 | ||
| 121 | L | 52.3 | Low | 60.9 | Low | 151 Ų | 151 | 123 Ų | 123 | 79% | 0.791 | 66% | 0.661 | S | S | * | * | trans | -100.7 | 115.8 | 169 | -66.3 | 171.4 | 0 | 0 | 0 | 108.9 | ||||
| 122 | P | 58.6 | Low | 59.8 | Low | 197 Ų | 197 | 121 Ų | 121 | 100% | 1.279 | 66% | 0.664 | S | S | * | * | trans | -66.8 | 0 | 177.4 | 28.8 | -34.3 | 0 | 0 | 0 | 113 |
Retrieved 122 of 122 residues in 168.4 ms
(Link to these results)