| 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 | 57.6 | Low | 73.3 | Confident | 220 Ų | 220 | 124 Ų | 124 | 100% | 1.084 | 66% | 0.655 | S | S | * | * | 0 | -16.7 | 0 | -71.2 | 180 | -155.2 | 0 | 0 | 114.8 | |||||
| 2 | V | 58.1 | Low | 74.3 | Confident | 124 Ų | 124 | 122 Ų | 122 | 75% | 0.752 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -75.8 | -35.6 | -176.7 | -177.6 | 0 | 0 | 0 | 0 | 113.1 | W4 R5 S6 | V2-W4 VanDerWaalsContact C-N 3.32Å; V2-W4 PolarHBondContact O-N 3.29Å; V2-R5 PolarHBondContact O-N 3.19Å; V2-S6 PolarHBondContact O-N 3.11Å |
| 3 | A | 61.2 | Low | 75.3 | Confident | 77 Ų | 77 | 117 Ų | 117 | 64% | 0.636 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -65.8 | -27.5 | -176.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | S6 A7 | A3-S6 PolarHBondContact O-OG 3.45Å; A3-A7 PolarHBondContact O-N 3.3Å |
| 4 | W | 66.7 | Low | 75.8 | Confident | 196 Ų | 196 | 118.9 Ų | 118.9 | 74% | 0.742 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -75.4 | -32.4 | 179.6 | -164.3 | 17.8 | 0 | 0 | 0 | 112 | V2 F8 | V2-W4 VanDerWaalsContact C-N 3.32Å; V2-W4 PolarHBondContact O-N 3.29Å; W4-F8 AromaticContact CD1-CD2 3.71Å; W4-F8 AromaticContact CD1-CE2 3.87Å; W4-F8 HydrophobicContact CD2-CE2 4.48Å; W4-F8 AromaticContact CE2-CE2 3.64Å; W4-F8 HydrophobicContact CG-CD2 4.4Å; W4-F8 AromaticContact CZ2-CE2 3.98Å; W4-F8 HydrophobicContact CZ2-CE2 3.98Å; W4-F8 AromaticContact NE1-CD2 3.58Å; W4-F8 AromaticContact NE1-CE2 3.23Å; W4-F8 PolarHBondContact O-N 3.26Å |
| 5 | R | 74.1 | Confident | 76.4 | Confident | 196 Ų | 196 | 115.8 Ų | 115.8 | 74% | 0.74 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -70.7 | -36.8 | 177.6 | -63.7 | -175.1 | 125.8 | -170.4 | -1.7 | 111.8 | V2 L9 | V2-R5 PolarHBondContact O-N 3.19Å; R5-L9 VanDerWaalsContact O-CG 3.28Å; R5-L9 WeakPolarHBondContact O-CG 3.34Å; R5-L9 PolarHBondContact O-N 3.38Å; R5-L9 VanDerWaalsContact O-N 3.09Å |
| 6 | S | 76.1 | Confident | 76.6 | Confident | 65 Ų | 65 | 114.4 Ų | 114.4 | 46% | 0.455 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -66.9 | -41.1 | 175.7 | 50.1 | 0 | 0 | 0 | 0 | 112.2 | V2 A3 L9 V10 | V2-S6 PolarHBondContact O-N 3.11Å; A3-S6 PolarHBondContact O-OG 3.45Å; S6-L9 PolarHBondContact O-N 3.11Å; S6-V10 VanDerWaalsContact O-CG2 3.29Å; S6-V10 WeakPolarHBondContact O-CG2 3.24Å; S6-V10 PolarHBondContact O-N 3.43Å |
| 7 | A | 77 | Confident | 76.7 | Confident | 52 Ų | 52 | 110.5 Ų | 110.5 | 43% | 0.43 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -64.3 | -41.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | A3 V10 C11 | A3-A7 PolarHBondContact O-N 3.3Å; A7-V10 PolarHBondContact O-N 2.87Å; A7-C11 PolarHBondContact O-N 3.05Å; A7-C11 PolarHBondContact O-SG 2.95Å |
| 8 | F | 82.3 | Confident | 76.4 | Confident | 131 Ų | 131 | 108.1 Ų | 108.1 | 58% | 0.575 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -64.2 | -41.9 | 175.5 | -101 | -71.9 | 0 | 0 | 0 | 112.9 | W4 C11 L12 | W4-F8 AromaticContact CD1-CD2 3.71Å; W4-F8 AromaticContact CD1-CE2 3.87Å; W4-F8 HydrophobicContact CD2-CE2 4.48Å; W4-F8 AromaticContact CE2-CE2 3.64Å; W4-F8 HydrophobicContact CG-CD2 4.4Å; W4-F8 AromaticContact CZ2-CE2 3.98Å; W4-F8 HydrophobicContact CZ2-CE2 3.98Å; W4-F8 AromaticContact NE1-CD2 3.58Å; W4-F8 AromaticContact NE1-CE2 3.23Å; W4-F8 PolarHBondContact O-N 3.26Å; F8-C11 PolarHBondContact O-N 3.43Å; F8-L12 VanDerWaalsContact O-CB 3.32Å; F8-L12 WeakPolarHBondContact O-CB 3.3Å; F8-L12 PolarHBondContact O-N 3.09Å |
| 9 | L | 84.8 | Confident | 75.9 | Confident | 119 Ų | 119 | 108.5 Ų | 108.5 | 62% | 0.623 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -66.7 | -38.1 | 177.8 | -70.9 | 174.6 | 0 | 0 | 0 | 112.2 | R5 S6 L12 A13 | R5-L9 VanDerWaalsContact O-CG 3.28Å; R5-L9 WeakPolarHBondContact O-CG 3.34Å; R5-L9 PolarHBondContact O-N 3.38Å; R5-L9 VanDerWaalsContact O-N 3.09Å; S6-L9 PolarHBondContact O-N 3.11Å; L9-L12 PolarHBondContact O-N 3.38Å; L9-A13 VanDerWaalsContact O-CB 3.29Å; L9-A13 WeakPolarHBondContact O-CB 3.38Å; L9-A13 PolarHBondContact O-N 2.97Å |
| 10 | V | 85.2 | Confident | 75.4 | Confident | 103 Ų | 103 | 108 Ų | 108 | 62% | 0.624 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -66.3 | -42.9 | 175 | 173.2 | 0 | 0 | 0 | 0 | 111 | S6 A7 A13 F14 | S6-V10 VanDerWaalsContact O-CG2 3.29Å; S6-V10 WeakPolarHBondContact O-CG2 3.24Å; S6-V10 PolarHBondContact O-N 3.43Å; A7-V10 PolarHBondContact O-N 2.87Å; V10-A13 PolarHBondContact O-N 3.13Å; V10-F14 WeakPolarHBondContact O-CB 3.44Å; V10-F14 PolarHBondContact O-N 2.63Å |
| 11 | C | 83 | Confident | 74.4 | Confident | 81 Ų | 81 | 111.2 Ų | 111.2 | 55% | 0.547 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -62.3 | -46 | 174.5 | -76.8 | 0 | 0 | 0 | 0 | 112 | A7 F8 A13 F14 S15 | A7-C11 PolarHBondContact O-N 3.05Å; A7-C11 PolarHBondContact O-SG 2.95Å; F8-C11 PolarHBondContact O-N 3.43Å; C11-A13 VanDerWaalsContact C-N 3.34Å; C11-A13 PolarHBondContact O-N 3.45Å; C11-F14 PolarHBondContact O-N 3.46Å; C11-S15 PolarHBondContact O-N 3Å; C11-S15 PolarHBondContact O-OG 3.32Å |
| 12 | L | 85.8 | Confident | 74.1 | Confident | 100 Ų | 100 | 110.9 Ų | 110.9 | 52% | 0.524 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -62.8 | -42.4 | 179.3 | -160.4 | 169 | 0 | 0 | 0 | 110.8 | F8 L9 S15 L16 | F8-L12 VanDerWaalsContact O-CB 3.32Å; F8-L12 WeakPolarHBondContact O-CB 3.3Å; F8-L12 PolarHBondContact O-N 3.09Å; L9-L12 PolarHBondContact O-N 3.38Å; L12-S15 PolarHBondContact O-N 3.38Å; L12-L16 HydrophobicContact CD2-CD1 3.35Å; L12-L16 HydrophobicContact CD2-CG 3.97Å; L12-L16 WeakPolarHBondContact O-CB 3.41Å; L12-L16 PolarHBondContact O-N 3.02Å |
| 13 | A | 86.7 | Confident | 73.5 | Confident | 57 Ų | 57 | 106.7 Ų | 106.7 | 47% | 0.471 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -63.7 | -40.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | L9 V10 C11 L16 A17 | L9-A13 VanDerWaalsContact O-CB 3.29Å; L9-A13 WeakPolarHBondContact O-CB 3.38Å; L9-A13 PolarHBondContact O-N 2.97Å; V10-A13 PolarHBondContact O-N 3.13Å; C11-A13 VanDerWaalsContact C-N 3.34Å; C11-A13 PolarHBondContact O-N 3.45Å; A13-L16 PolarHBondContact O-N 3.39Å; A13-A17 VanDerWaalsContact O-CB 3.26Å; A13-A17 WeakPolarHBondContact O-CB 3.34Å; A13-A17 PolarHBondContact O-N 2.94Å |
| 14 | F | 82.9 | Confident | 72.8 | Confident | 143 Ų | 143 | 108.1 Ų | 108.1 | 63% | 0.627 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -68.2 | -42 | 176.9 | -168.3 | -97.5 | 0 | 0 | 0 | 111.8 | V10 C11 A17 T18 | V10-F14 WeakPolarHBondContact O-CB 3.44Å; V10-F14 PolarHBondContact O-N 2.63Å; C11-F14 PolarHBondContact O-N 3.46Å; F14-A17 PolarHBondContact O-N 3Å; F14-T18 HydrophobicContact CD1-CG2 4.01Å; F14-T18 HydrophobicContact CE1-CG2 3.69Å; F14-T18 HydrophobicContact CZ-CG2 3.97Å; F14-T18 WeakPolarHBondContact O-CB 3.48Å; F14-T18 WeakPolarHBondContact O-CG2 3.41Å; F14-T18 PolarHBondContact O-N 2.82Å; F14-T18 PolarHBondContact O-OG1 3.09Å |
| 15 | S | 84 | Confident | 71.6 | Confident | 73 Ų | 73 | 101.1 Ų | 101.1 | 51% | 0.51 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -61.8 | -41.8 | 172.3 | -63.5 | 0 | 0 | 0 | 0 | 112.5 | C11 L12 T18 L19 | C11-S15 PolarHBondContact O-N 3Å; C11-S15 PolarHBondContact O-OG 3.32Å; L12-S15 PolarHBondContact O-N 3.38Å; S15-T18 WeakPolarHBondContact CA-OG1 3.39Å; S15-T18 PolarHBondContact O-OG1 2.95Å; S15-T18 VanDerWaalsContact O-OG1 3.08Å; S15-L19 WeakPolarHBondContact O-CB 3.33Å; S15-L19 PolarHBondContact O-N 2.95Å |
| 16 | L | 80.7 | Confident | 70.3 | Confident | 93 Ų | 93 | 97.7 Ų | 97.7 | 49% | 0.487 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -66.9 | -40.9 | 174 | -86.6 | 169.7 | 0 | 0 | 0 | 112.1 | L12 A13 L19 V20 | L12-L16 HydrophobicContact CD2-CD1 3.35Å; L12-L16 HydrophobicContact CD2-CG 3.97Å; L12-L16 WeakPolarHBondContact O-CB 3.41Å; L12-L16 PolarHBondContact O-N 3.02Å; A13-L16 PolarHBondContact O-N 3.39Å; L16-L19 PolarHBondContact O-N 3.27Å; L16-V20 VanDerWaalsContact O-CB 3.31Å; L16-V20 WeakPolarHBondContact O-CB 3.19Å; L16-V20 WeakPolarHBondContact O-CG2 3.3Å; L16-V20 PolarHBondContact O-N 2.89Å |
| 17 | A | 77.3 | Confident | 69 | Low | 48 Ų | 48 | 100.8 Ų | 100.8 | 40% | 0.397 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -66.4 | -46.2 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | A13 F14 L19 V20 Q21 | A13-A17 VanDerWaalsContact O-CB 3.26Å; A13-A17 WeakPolarHBondContact O-CB 3.34Å; A13-A17 PolarHBondContact O-N 2.94Å; F14-A17 PolarHBondContact O-N 3Å; A17-L19 VanDerWaalsContact C-N 3.33Å; A17-L19 PolarHBondContact O-N 2.66Å; A17-V20 PolarHBondContact O-N 3.45Å; A17-Q21 WeakPolarHBondContact O-CB 3.28Å; A17-Q21 PolarHBondContact O-N 2.71Å |
| 18 | T | 71.8 | Confident | 67.7 | Low | 67 Ų | 67 | 104.9 Ų | 104.9 | 41% | 0.411 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -65.2 | -35.9 | 174.7 | 50.7 | 0 | 0 | 0 | 0 | 112.4 | F14 S15 R22 | F14-T18 HydrophobicContact CD1-CG2 4.01Å; F14-T18 HydrophobicContact CE1-CG2 3.69Å; F14-T18 HydrophobicContact CZ-CG2 3.97Å; F14-T18 WeakPolarHBondContact O-CB 3.48Å; F14-T18 WeakPolarHBondContact O-CG2 3.41Å; F14-T18 PolarHBondContact O-N 2.82Å; F14-T18 PolarHBondContact O-OG1 3.09Å; S15-T18 WeakPolarHBondContact CA-OG1 3.39Å; S15-T18 PolarHBondContact O-OG1 2.95Å; S15-T18 VanDerWaalsContact O-OG1 3.08Å; T18-R22 WeakPolarHBondContact O-CB 3.38Å; T18-R22 PolarHBondContact O-N 2.73Å |
| 19 | L | 66.8 | Low | 66.4 | Low | 117 Ų | 117 | 105.4 Ų | 105.4 | 61% | 0.613 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -70.4 | -35.3 | 173.9 | -174.7 | 66 | 0 | 0 | 0 | 111.7 | S15 L16 A17 R22 G23 | S15-L19 WeakPolarHBondContact O-CB 3.33Å; S15-L19 PolarHBondContact O-N 2.95Å; L16-L19 PolarHBondContact O-N 3.27Å; A17-L19 VanDerWaalsContact C-N 3.33Å; A17-L19 PolarHBondContact O-N 2.66Å; L19-R22 CarbonylContact O-C 3.53Å; L19-G23 WeakPolarHBondContact O-CA 2.8Å; L19-G23 PolarHBondContact O-N 3.33Å |
| 20 | V | 65.1 | Low | 64.6 | Low | 98 Ų | 98 | 107.6 Ų | 107.6 | 59% | 0.594 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -73.1 | -39.2 | 175.1 | 165.8 | 0 | 0 | 0 | 0 | 110.8 | L16 A17 R22 G23 S24 | L16-V20 VanDerWaalsContact O-CB 3.31Å; L16-V20 WeakPolarHBondContact O-CB 3.19Å; L16-V20 WeakPolarHBondContact O-CG2 3.3Å; L16-V20 PolarHBondContact O-N 2.89Å; A17-V20 PolarHBondContact O-N 3.45Å; V20-R22 VanDerWaalsContact C-N 3.31Å; V20-R22 PolarHBondContact O-N 2.95Å; V20-G23 PolarHBondContact O-N 3.45Å; V20-S24 VanDerWaalsContact O-CB 3.3Å; V20-S24 WeakPolarHBondContact O-CB 3.26Å; V20-S24 PolarHBondContact O-N 3.42Å |
| 21 | Q | 55 | Low | 63.1 | Low | 176 Ų | 176 | 107.1 Ų | 107.1 | 82% | 0.822 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -72.9 | -25.7 | 179.7 | -153 | 146.6 | -47.2 | 0 | 0 | 112.3 | A17 | A17-Q21 WeakPolarHBondContact O-CB 3.28Å; A17-Q21 PolarHBondContact O-N 2.71Å |
| 22 | R | 51 | Low | 61.6 | Low | 212 Ų | 212 | 110.3 Ų | 110.3 | 80% | 0.8 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -97.9 | -10.7 | 170 | -159.9 | 166.3 | -177.6 | 94.1 | -0.1 | 113.6 | T18 L19 V20 F27 | T18-R22 WeakPolarHBondContact O-CB 3.38Å; T18-R22 PolarHBondContact O-N 2.73Å; L19-R22 CarbonylContact O-C 3.53Å; V20-R22 VanDerWaalsContact C-N 3.31Å; V20-R22 PolarHBondContact O-N 2.95Å; R22-F27 WeakPolarHBondContact O-CE2 3.42Å |
| 23 | G | 46.3 | Very low | 60.1 | Low | 36 Ų | 36 | 111.6 Ų | 111.6 | 37% | 0.371 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -104.5 | -6 | -172.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | L19 V20 G25 | L19-G23 WeakPolarHBondContact O-CA 2.8Å; L19-G23 PolarHBondContact O-N 3.33Å; V20-G23 PolarHBondContact O-N 3.45Å; G23-G25 VanDerWaalsContact C-N 3.29Å |
| 24 | S | 45.9 | Very low | 58.5 | Low | 108 Ų | 108 | 115.2 Ų | 115.2 | 76% | 0.755 | 62% | 0.615 | S | S | * | * | S | Bend | trans | -91.7 | 18.4 | 174.9 | -179.7 | 0 | 0 | 0 | 0 | 112.8 | V20 | V20-S24 VanDerWaalsContact O-CB 3.3Å; V20-S24 WeakPolarHBondContact O-CB 3.26Å; V20-S24 PolarHBondContact O-N 3.42Å |
| 25 | G | 41.8 | Very low | 57.1 | Low | 48 Ų | 48 | 112.3 Ų | 112.3 | 50% | 0.495 | 62% | 0.618 | S | S | . | * | S | Bend | trans | -120.1 | 112.4 | 168.9 | 0 | 0 | 0 | 0 | 0 | 108.7 | G23 F27 | G23-G25 VanDerWaalsContact C-N 3.29Å; G25-F27 VanDerWaalsContact O-CD2 3.23Å; G25-F27 WeakPolarHBondContact O-CD2 2.88Å; G25-F27 WeakPolarHBondContact O-CE2 3.5Å; G25-F27 PolarHBondContact O-N 3.24Å |
| 26 | D | 47.1 | Very low | 55.6 | Low | 124 Ų | 124 | 114.2 Ų | 114.2 | 66% | 0.663 | 63% | 0.626 | S | S | * | * | trans | 8.9 | 89.9 | 169.6 | -75.7 | -29.6 | 0 | 0 | 0 | 116.1 | D28 | D26-D28 VanDerWaalsContact C-N 3.3Š| ||
| 27 | F | 48.5 | Very low | 54 | Low | 131 Ų | 131 | 117.9 Ų | 117.9 | 58% | 0.575 | 64% | 0.638 | S | S | * | * | S | Bend | trans | -90.7 | 5.5 | 162.9 | -78 | -87.2 | 0 | 0 | 0 | 112.6 | R22 G25 F30 | R22-F27 WeakPolarHBondContact O-CE2 3.42Å; G25-F27 VanDerWaalsContact O-CD2 3.23Å; G25-F27 WeakPolarHBondContact O-CD2 2.88Å; G25-F27 WeakPolarHBondContact O-CE2 3.5Å; G25-F27 PolarHBondContact O-N 3.24Å; F27-F30 HydrophobicContact CD1-CD2 4.26Å; F27-F30 HydrophobicContact CD1-CE2 4.39Å |
| 28 | D | 50.3 | Low | 52.6 | Low | 138 Ų | 138 | 124.2 Ų | 124.2 | 74% | 0.738 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.2 | -10.6 | 177.2 | -67 | -45.8 | 0 | 0 | 0 | 113.3 | D26 | D26-D28 VanDerWaalsContact C-N 3.3Š|
| 29 | D | 55.4 | Low | 51.3 | Low | 142 Ų | 142 | 127.4 Ų | 127.4 | 76% | 0.759 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.4 | 5.3 | -177.5 | -104.8 | 4.9 | 0 | 0 | 0 | 114.6 | N31 | D29-N31 VanDerWaalsContact C-N 3.29Å; D29-N31 PolarHBondContact O-N 3.26Å |
| 30 | F | 46.6 | Very low | 50.2 | Low | 165 Ų | 165 | 127.8 Ų | 127.8 | 72% | 0.724 | 69% | 0.691 | S | S | * | * | trans | -93.7 | 39.1 | 173.9 | -69.4 | -75.7 | 0 | 0 | 0 | 113.1 | F27 L32 | F27-F30 HydrophobicContact CD1-CD2 4.26Å; F27-F30 HydrophobicContact CD1-CE2 4.39Å; F30-L32 PolarHBondContact O-N 3.3Å; F30-L32 VanDerWaalsContact O-N 3.13Å | ||
| 31 | N | 53 | Low | 49.1 | Very low | 93 Ų | 93 | 128.9 Ų | 128.9 | 50% | 0.497 | 70% | 0.703 | S | S | . | * | trans | -76.3 | 99.1 | 163.9 | -85.8 | -47.3 | 0 | 0 | 0 | 109.5 | D29 E33 D34 | D29-N31 VanDerWaalsContact C-N 3.29Å; D29-N31 PolarHBondContact O-N 3.26Å; N31-E33 HydrophobicContact CB-CB 4.31Å; N31-E33 HydrophobicContact CB-CG 3.94Å; N31-E33 WeakPolarHBondContact CB-OE2 3.43Å; N31-E33 PolarHBondContact O-N 2.74Å; N31-E33 PolarHBondContact OD1-OE2 2.86Å; N31-D34 PolarHBondContact O-N 2.89Å | ||
| 32 | L | 51.9 | Low | 48.5 | Very low | 147 Ų | 147 | 126.6 Ų | 126.6 | 77% | 0.77 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.2 | 22.1 | 167.7 | -159.3 | 78.3 | 0 | 0 | 0 | 112.8 | F30 | F30-L32 PolarHBondContact O-N 3.3Å; F30-L32 VanDerWaalsContact O-N 3.13Å |
| 33 | E | 53.4 | Low | 48.2 | Very low | 127 Ų | 127 | 125.5 Ų | 125.5 | 59% | 0.593 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.3 | -26.4 | -174.5 | -44 | 174.1 | 125.3 | 0 | 0 | 110.6 | N31 | N31-E33 HydrophobicContact CB-CB 4.31Å; N31-E33 HydrophobicContact CB-CG 3.94Å; N31-E33 WeakPolarHBondContact CB-OE2 3.43Å; N31-E33 PolarHBondContact O-N 2.74Å; N31-E33 PolarHBondContact OD1-OE2 2.86Å |
| 34 | D | 54.6 | Low | 48.1 | Very low | 133 Ų | 133 | 132.9 Ų | 132.9 | 71% | 0.711 | 73% | 0.727 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.5 | -27.3 | 178.6 | -115.2 | 11.5 | 0 | 0 | 0 | 112.5 | N31 V36 K37 | N31-D34 PolarHBondContact O-N 2.89Å; D34-V36 PolarHBondContact O-N 3Å; D34-K37 PolarHBondContact O-N 3.22Å |
| 35 | A | 53.1 | Low | 47.7 | Very low | 83 Ų | 83 | 131.4 Ų | 131.4 | 69% | 0.686 | 72% | 0.715 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.8 | -10.1 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||
| 36 | V | 53.1 | Low | 47.8 | Very low | 113 Ų | 113 | 139.9 Ų | 139.9 | 69% | 0.685 | 73% | 0.732 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.2 | -9.1 | 179.9 | 168.6 | 0 | 0 | 0 | 0 | 112.6 | D34 | D34-V36 PolarHBondContact O-N 3Š|
| 37 | K | 47.3 | Very low | 47.6 | Very low | 169 Ų | 169 | 138.9 Ų | 138.9 | 74% | 0.735 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -95 | -0.4 | -170.5 | -93.5 | 178 | 179.5 | 168.8 | 0 | 117.2 | D34 | D34-K37 PolarHBondContact O-N 3.22Š|
| 38 | E | 47.6 | Very low | 47.4 | Very low | 182 Ų | 182 | 139.6 Ų | 139.6 | 85% | 0.85 | 73% | 0.731 | S | S | * | * | S | Bend | trans | -132.5 | 53.1 | -176.8 | -67.3 | -157.2 | 151.5 | 0 | 0 | 114.7 | ||
| 39 | T | 44.7 | Very low | 47.1 | Very low | 133 Ų | 133 | 139.2 Ų | 139.2 | 82% | 0.816 | 74% | 0.735 | S | S | * | * | trans | -144.3 | 46.9 | 164.7 | 60.6 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 40 | S | 43.4 | Very low | 46.7 | Very low | 125 Ų | 125 | 138 Ų | 138 | 87% | 0.874 | 73% | 0.733 | S | S | * | * | trans | -113.9 | 55.8 | 161.7 | 84.9 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 41 | S | 40.5 | Very low | 46.7 | Very low | 122 Ų | 122 | 135.9 Ų | 135.9 | 85% | 0.853 | 73% | 0.733 | S | S | * | * | trans | -114.8 | 68.2 | 163.7 | -169.7 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 42 | V | 43.6 | Very low | 46 | Very low | 127 Ų | 127 | 138 Ų | 138 | 77% | 0.77 | 75% | 0.749 | S | S | * | * | trans | -136.3 | 102.1 | 172 | 174.9 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 43 | K | 44.8 | Very low | 45.7 | Very low | 190 Ų | 190 | 136.5 Ų | 136.5 | 83% | 0.826 | 75% | 0.746 | S | S | * | * | trans | 17.6 | 109.6 | 148.5 | -70.2 | -179.7 | 173.4 | -178.8 | 0 | 116.4 | P45 | K43-P45 WeakPolarHBondContact O-CD 3.5Š| ||
| 44 | Q | 43.3 | Very low | 45.1 | Very low | 190 Ų | 190 | 135.7 Ų | 135.7 | 89% | 0.888 | 75% | 0.751 | S | S | * | * | trans | -91.8 | 108.1 | 148.6 | -74.5 | -80 | -40.9 | 0 | 0 | 107.5 | ||||
| 45 | P | 38.7 | Very low | 44.5 | Very low | 77 Ų | 77 | 136.3 Ų | 136.3 | 50% | 0.5 | 75% | 0.754 | S | S | . | * | trans | -82.5 | 161.1 | 162 | 29.9 | -20.3 | 0 | 0 | 0 | 109.2 | K43 | K43-P45 WeakPolarHBondContact O-CD 3.5Š| ||
| 46 | W | 43.7 | Very low | 43.8 | Very low | 226 Ų | 226 | 143.9 Ų | 143.9 | 86% | 0.856 | 77% | 0.765 | S | S | * | * | trans | 72.7 | 126.1 | 176.7 | -35.6 | 100.3 | 0 | 0 | 0 | 112.9 | ||||
| 47 | D | 42.5 | Very low | 43 | Very low | 104 Ų | 104 | 144.5 Ų | 144.5 | 56% | 0.556 | 77% | 0.771 | S | S | * | * | cis | 176 | 141.2 | -4.9 | -139.1 | -25 | 0 | 0 | 0 | 104 | ||||
| 48 | H | 43.6 | Very low | 42.7 | Very low | 145 Ų | 145 | 139.3 Ų | 139.3 | 67% | 0.671 | 77% | 0.766 | S | S | * | * | trans | 54.5 | 125.6 | 161.1 | 32.1 | -97.7 | 0 | 0 | 0 | 122.6 | ||||
| 49 | T | 44.3 | Very low | 42.6 | Very low | 131 Ų | 131 | 137.2 Ų | 137.2 | 80% | 0.804 | 77% | 0.765 | S | S | * | * | trans | 78.4 | 119.8 | 136.5 | -53.6 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 50 | T | 47.1 | Very low | 42.4 | Very low | 117 Ų | 117 | 136.8 Ų | 136.8 | 72% | 0.718 | 76% | 0.762 | S | S | * | * | cis | -169.9 | 143.3 | 24.5 | -100.6 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 51 | T | 47.4 | Very low | 42.1 | Very low | 119 Ų | 119 | 142.1 Ų | 142.1 | 73% | 0.73 | 76% | 0.764 | S | S | * | * | trans | -20 | 124.7 | 156.5 | -55.9 | 0 | 0 | 0 | 0 | 116.8 | T53 | T51-T53 PolarHBondContact O-N 2.85Š| ||
| 52 | T | 37.4 | Very low | 42 | Very low | 137 Ų | 137 | 140.3 Ų | 140.3 | 84% | 0.84 | 76% | 0.756 | S | S | * | * | trans | -37.1 | 109.8 | 154 | -57.2 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 53 | T | 45.2 | Very low | 42.1 | Very low | 116 Ų | 116 | 140.2 Ų | 140.2 | 71% | 0.712 | 76% | 0.758 | S | S | * | * | trans | -176.4 | 126 | 136.6 | -169.7 | 0 | 0 | 0 | 0 | 111.3 | T51 | T51-T53 PolarHBondContact O-N 2.85Š| ||
| 54 | T | 40.6 | Very low | 42.1 | Very low | 111 Ų | 111 | 136 Ų | 136 | 68% | 0.681 | 76% | 0.758 | S | S | * | * | trans | 73.1 | 116.9 | 147 | -133.5 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 55 | N | 41.8 | Very low | 42.3 | Very low | 146 Ų | 146 | 135.8 Ų | 135.8 | 78% | 0.781 | 76% | 0.755 | S | S | * | * | trans | 78.2 | 107.2 | 146.5 | -64.1 | -40.7 | 0 | 0 | 0 | 122.6 | ||||
| 56 | R | 38.9 | Very low | 43 | Very low | 242 Ų | 242 | 137.9 Ų | 137.9 | 91% | 0.913 | 77% | 0.768 | S | S | * | * | 107.6 | 133.6 | 125 | -152.1 | 172.8 | -155.7 | 153.2 | 5.4 | 118.1 | |||||
| 57 | P | 36.7 | Very low | 43 | Very low | 126 Ų | 126 | 132.9 Ų | 132.9 | 82% | 0.818 | 77% | 0.765 | S | S | * | * | trans | -105.4 | 159.7 | -167.9 | 40.3 | -32.4 | 0 | 0 | 0 | 114.6 | ||||
| 58 | G | 40.2 | Very low | 43.2 | Very low | 60 Ų | 60 | 131.7 Ų | 131.7 | 62% | 0.619 | 78% | 0.777 | S | S | * | * | trans | 176.3 | 95.3 | 166.3 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 59 | T | 45.6 | Very low | 43.2 | Very low | 137 Ų | 137 | 130.9 Ų | 130.9 | 84% | 0.84 | 79% | 0.788 | S | S | * | * | 63.1 | 113.1 | 103.5 | 57.2 | 0 | 0 | 0 | 0 | 116.1 | |||||
| 60 | T | 40.6 | Very low | 43.5 | Very low | 124 Ų | 124 | 127.5 Ų | 127.5 | 76% | 0.761 | 78% | 0.779 | S | S | * | * | 150.8 | 127.6 | 109 | -59 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 61 | R | 37.9 | Very low | 43.8 | Very low | 238 Ų | 238 | 130.5 Ų | 130.5 | 90% | 0.898 | 79% | 0.79 | S | S | * | * | trans | 81.3 | 108 | 149.7 | -91.7 | 175.9 | 161.7 | -173.2 | -5.9 | 123.1 | ||||
| 62 | A | 38.7 | Very low | 44.5 | Very low | 84 Ų | 84 | 131.3 Ų | 131.3 | 69% | 0.694 | 79% | 0.79 | S | S | * | * | trans | -85.2 | -162.6 | 134 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 63 | P | 45.2 | Very low | 45.8 | Very low | 125 Ų | 125 | 131.7 Ų | 131.7 | 81% | 0.812 | 79% | 0.786 | S | S | * | * | cis | -143.8 | -164.7 | -10.5 | 37.6 | -15 | 0 | 0 | 0 | 114.5 | ||||
| 64 | A | 44 | Very low | 46.6 | Very low | 101 Ų | 101 | 129.6 Ų | 129.6 | 84% | 0.835 | 78% | 0.781 | S | S | * | * | trans | 121.7 | 128.9 | 152.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 65 | K | 48.5 | Very low | 47.6 | Very low | 186 Ų | 186 | 131.8 Ų | 131.8 | 81% | 0.809 | 79% | 0.788 | S | S | * | * | cis | -177.1 | 140.6 | 10.5 | 172.4 | -178.6 | -173.4 | -179.9 | 0 | 107.6 | ||||
| 66 | P | 52.5 | Low | 48.5 | Very low | 120 Ų | 120 | 128.9 Ų | 128.9 | 78% | 0.779 | 78% | 0.784 | S | S | * | * | trans | -106.3 | 149.5 | 158.2 | 35.4 | -25.3 | 0 | 0 | 0 | 110.5 | ||||
| 67 | P | 45 | Very low | 49.5 | Very low | 121 Ų | 121 | 124.8 Ų | 124.8 | 79% | 0.786 | 78% | 0.78 | S | S | * | * | -153.2 | 149.2 | 111.4 | 36.5 | -18.5 | 0 | 0 | 0 | 114 | |||||
| 68 | G | 45.6 | Very low | 50.6 | Low | 79 Ų | 79 | 125.1 Ų | 125.1 | 81% | 0.814 | 78% | 0.775 | S | S | * | * | trans | -179.7 | 84.6 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 69 | S | 44.4 | Very low | 51.2 | Low | 128 Ų | 128 | 128.4 Ų | 128.4 | 90% | 0.895 | 78% | 0.778 | S | S | * | * | trans | -71.5 | 127.2 | 165.9 | 48.1 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 70 | G | 49.7 | Very low | 51.5 | Low | 61 Ų | 61 | 129.2 Ų | 129.2 | 63% | 0.629 | 77% | 0.772 | S | S | * | * | trans | -178 | 83.4 | 172.9 | 0 | 0 | 0 | 0 | 0 | 110.6 | D72 | G70-D72 PolarHBondContact O-N 2.83Š| ||
| 71 | L | 54.1 | Low | 52.1 | Low | 179 Ų | 179 | 130.6 Ų | 130.6 | 94% | 0.937 | 78% | 0.775 | S | S | * | * | trans | -86 | 67.2 | 164.6 | -67.4 | 174.8 | 0 | 0 | 0 | 107.6 | ||||
| 72 | D | 61.7 | Low | 53 | Low | 136 Ų | 136 | 125.4 Ų | 125.4 | 73% | 0.727 | 77% | 0.765 | S | S | * | * | trans | -89.5 | 107.8 | 174.5 | -79.7 | -35.5 | 0 | 0 | 0 | 109.1 | G70 A74 | G70-D72 PolarHBondContact O-N 2.83Å; D72-A74 HydrophobicContact CB-CB 4.49Å; D72-A74 PolarHBondContact O-N 3.48Å; D72-A74 VanDerWaalsContact O-N 3.11Å | ||
| 73 | L | 64.6 | Low | 53.5 | Low | 145 Ų | 145 | 124.5 Ų | 124.5 | 76% | 0.759 | 76% | 0.763 | S | S | * | * | G | 310 helix | trans | -72.4 | 11.4 | 172.6 | -67.3 | 165.9 | 0 | 0 | 0 | 112.6 | D75 A76 | L73-D75 VanDerWaalsContact C-N 3.26Å; L73-D75 PolarHBondContact O-N 3.3Å; L73-A76 PolarHBondContact O-N 2.82Å |
| 74 | A | 61.9 | Low | 53.7 | Low | 73 Ų | 73 | 128.9 Ų | 128.9 | 60% | 0.603 | 76% | 0.764 | S | S | * | * | G | 310 helix | trans | -68.8 | -22.9 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113 | D72 A76 | D72-A74 HydrophobicContact CB-CB 4.49Å; D72-A74 PolarHBondContact O-N 3.48Å; D72-A74 VanDerWaalsContact O-N 3.11Å; A74-A76 VanDerWaalsContact C-N 3.29Å; A74-A76 PolarHBondContact O-N 3.01Å |
| 75 | D | 61.4 | Low | 54 | Low | 156 Ų | 156 | 134.6 Ų | 134.6 | 83% | 0.834 | 76% | 0.764 | S | S | * | * | G | 310 helix | trans | -79.4 | -7.9 | 177.4 | -120.1 | 17.3 | 0 | 0 | 0 | 113.5 | L73 | L73-D75 VanDerWaalsContact C-N 3.26Å; L73-D75 PolarHBondContact O-N 3.3Å |
| 76 | A | 60.9 | Low | 54.2 | Low | 85 Ų | 85 | 135.4 Ų | 135.4 | 70% | 0.702 | 77% | 0.767 | S | S | * | * | G | 310 helix | trans | -91.2 | -5.9 | -178.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | L73 A74 | L73-A76 PolarHBondContact O-N 2.82Å; A74-A76 VanDerWaalsContact C-N 3.29Å; A74-A76 PolarHBondContact O-N 3.01Å |
| 77 | L | 61.1 | Low | 54 | Low | 157 Ų | 157 | 135.6 Ų | 135.6 | 82% | 0.822 | 77% | 0.769 | S | S | * | * | S | Bend | trans | -115.8 | -2.4 | -172.9 | -77.6 | 145.1 | 0 | 0 | 0 | 113.6 | ||
| 78 | D | 58.6 | Low | 53.7 | Low | 133 Ų | 133 | 132.8 Ų | 132.8 | 71% | 0.711 | 76% | 0.762 | S | S | * | * | trans | -113.7 | 115.7 | -176.1 | -143.2 | 27.7 | 0 | 0 | 0 | 111.9 | ||||
| 79 | D | 53.2 | Low | 53.7 | Low | 128 Ų | 128 | 137.4 Ų | 137.4 | 68% | 0.684 | 77% | 0.766 | S | S | * | * | trans | 68.4 | 108.5 | 142.7 | -144 | 20.7 | 0 | 0 | 0 | 120.5 | ||||
| 80 | Q | 53 | Low | 53.6 | Low | 154 Ų | 154 | 135.2 Ų | 135.2 | 72% | 0.72 | 76% | 0.763 | S | S | * | * | 176.3 | 101.3 | 106.4 | -96.9 | 178.8 | -35.3 | 0 | 0 | 111.1 | D82 | Q80-D82 PolarHBondContact O-N 3.13Š| |||
| 81 | D | 52.9 | Low | 53.2 | Low | 154 Ų | 154 | 136.2 Ų | 136.2 | 82% | 0.824 | 77% | 0.774 | S | S | * | * | trans | -79.2 | 88.9 | 166.3 | 178.6 | 22.9 | 0 | 0 | 0 | 110 | ||||
| 82 | D | 55.6 | Low | 52.7 | Low | 129 Ų | 129 | 138.7 Ų | 138.7 | 69% | 0.69 | 77% | 0.771 | S | S | * | * | trans | -131.2 | 73.3 | 176.7 | -70 | -30.3 | 0 | 0 | 0 | 112.6 | Q80 | Q80-D82 PolarHBondContact O-N 3.13Š| ||
| 83 | G | 49.9 | Very low | 51.9 | Low | 64 Ų | 64 | 141.1 Ų | 141.1 | 66% | 0.66 | 78% | 0.778 | S | S | * | * | trans | 77.7 | 134.6 | 132.9 | 0 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 84 | R | 49.6 | Very low | 50.7 | Low | 217 Ų | 217 | 144.5 Ų | 144.5 | 82% | 0.819 | 78% | 0.781 | S | S | * | * | trans | 81.2 | 98.8 | 139.2 | -67 | -176.8 | -175 | -167 | 3.2 | 118.9 | ||||
| 85 | R | 49.3 | Very low | 50.1 | Low | 221 Ų | 221 | 152.9 Ų | 152.9 | 83% | 0.834 | 80% | 0.797 | S | S | * | * | 134 | 115.7 | 107.8 | -82.2 | 164.4 | 176.9 | -167.4 | 0.4 | 113.6 | |||||
| 86 | K | 52.6 | Low | 49.4 | Very low | 204 Ų | 204 | 151.5 Ų | 151.5 | 89% | 0.887 | 79% | 0.789 | S | S | * | * | trans | -83.3 | 144.5 | 169.5 | -159.5 | -179.4 | -167 | 179.5 | 0 | 110.2 | ||||
| 87 | P | 48.5 | Very low | 48.2 | Very low | 124 Ų | 124 | 155.1 Ų | 155.1 | 81% | 0.805 | 79% | 0.791 | S | S | * | * | trans | -114.6 | 133.9 | 150.7 | 26.8 | -12.5 | 0 | 0 | 0 | 110.8 | ||||
| 88 | G | 38.9 | Very low | 47.8 | Very low | 62 Ų | 62 | 154 Ų | 154 | 64% | 0.639 | 79% | 0.791 | S | S | * | * | trans | -103.7 | -176.4 | 169.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 89 | I | 45.3 | Very low | 47.2 | Very low | 175 Ų | 175 | 152.6 Ų | 152.6 | 90% | 0.897 | 79% | 0.787 | S | S | * | * | trans | 101.5 | 98.7 | 163.1 | -55.3 | 164 | 0 | 0 | 0 | 115.8 | ||||
| 90 | G | 43.2 | Very low | 47.3 | Very low | 82 Ų | 82 | 152.9 Ų | 152.9 | 85% | 0.845 | 79% | 0.794 | S | S | * | * | 68.6 | 114.7 | 115.7 | 0 | 0 | 0 | 0 | 0 | 119.9 | |||||
| 91 | G | 40.7 | Very low | 47 | Very low | 83 Ų | 83 | 151.3 Ų | 151.3 | 86% | 0.856 | 80% | 0.795 | S | S | * | * | trans | -177.3 | 91 | 166 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 92 | R | 43.5 | Very low | 46.9 | Very low | 230 Ų | 230 | 150.4 Ų | 150.4 | 87% | 0.868 | 80% | 0.795 | S | S | * | * | trans | -74.2 | 143.2 | 168.6 | 54.3 | -170.2 | 136.9 | -132.6 | -4 | 109.9 | ||||
| 93 | E | 44.8 | Very low | 46.5 | Very low | 188 Ų | 188 | 153.5 Ų | 153.5 | 88% | 0.879 | 80% | 0.802 | S | S | * | * | trans | -175.5 | 139.7 | 139.9 | -100.4 | 159.3 | -141.7 | 0 | 0 | 112.5 | ||||
| 94 | R | 39.9 | Very low | 46.2 | Very low | 216 Ų | 216 | 161.3 Ų | 161.3 | 82% | 0.815 | 81% | 0.812 | S | S | * | * | trans | -85.3 | 146.6 | -169.2 | -67.5 | 169.6 | 164.4 | 172.7 | -6.5 | 111.7 | ||||
| 95 | W | 49 | Very low | 45.8 | Very low | 249 Ų | 249 | 156.6 Ų | 156.6 | 94% | 0.943 | 81% | 0.81 | S | S | * | * | trans | -132.5 | 136.4 | 154 | -78.1 | 91.2 | 0 | 0 | 0 | 110.7 | ||||
| 96 | N | 46 | Very low | 45.9 | Very low | 126 Ų | 126 | 152.9 Ų | 152.9 | 67% | 0.674 | 81% | 0.811 | S | S | * | * | trans | -96.7 | 143.4 | -157.2 | -50.9 | -61.3 | 0 | 0 | 0 | 113.1 | ||||
| 97 | H | 36.2 | Very low | 46 | Very low | 161 Ų | 161 | 148.4 Ų | 148.4 | 75% | 0.745 | 80% | 0.801 | S | S | * | * | trans | 16.8 | 117.9 | 141 | -160.2 | -153.9 | 0 | 0 | 0 | 119.4 | T99 | H97-T99 PolarHBondContact CE1-OG1 3.41Å; H97-T99 PolarHBondContact NE2-OG1 3.3Å | ||
| 98 | V | 52.6 | Low | 45.7 | Very low | 133 Ų | 133 | 149.4 Ų | 149.4 | 81% | 0.806 | 81% | 0.805 | S | S | * | * | trans | -126.3 | 119.1 | 156 | 174.8 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 99 | T | 45.9 | Very low | 45.8 | Very low | 105 Ų | 105 | 157.3 Ų | 157.3 | 64% | 0.644 | 82% | 0.816 | S | S | * | * | trans | -106.5 | 128 | 177.7 | -23.6 | 0 | 0 | 0 | 0 | 108.5 | H97 | H97-T99 PolarHBondContact CE1-OG1 3.41Å; H97-T99 PolarHBondContact NE2-OG1 3.3Å | ||
| 100 | T | 56.6 | Low | 45.7 | Very low | 134 Ų | 134 | 153.2 Ų | 153.2 | 82% | 0.822 | 81% | 0.807 | S | S | * | * | trans | -133.4 | 123.9 | 169.8 | -30.7 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 101 | T | 45.5 | Very low | 46.1 | Very low | 120 Ų | 120 | 155.5 Ų | 155.5 | 74% | 0.736 | 81% | 0.808 | S | S | * | * | trans | -108.3 | 139 | -174.5 | 161.5 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 102 | T | 50.4 | Low | 46.7 | Very low | 135 Ų | 135 | 155.2 Ų | 155.2 | 83% | 0.828 | 80% | 0.797 | S | S | * | * | trans | -164.2 | 114.4 | 151.3 | -83.6 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 103 | K | 48.3 | Very low | 46.7 | Very low | 194 Ų | 194 | 150.2 Ų | 150.2 | 84% | 0.843 | 79% | 0.788 | S | S | * | * | trans | 20.6 | 121.2 | 151.2 | -55.2 | -82.3 | -179.2 | 169 | 0 | 121.2 | ||||
| 104 | R | 43.1 | Very low | 46.9 | Very low | 228 Ų | 228 | 147.6 Ų | 147.6 | 86% | 0.86 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -81.7 | 146 | 167.4 | -97.3 | 178.5 | 168.3 | -115.2 | 1.8 | 113.5 | ||
| 105 | P | 41.5 | Very low | 47 | Very low | 119 Ų | 119 | 145.7 Ų | 145.7 | 77% | 0.773 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -95.9 | 158.9 | 158 | 5.9 | 14.9 | 0 | 0 | 0 | 113.3 | ||
| 106 | V | 52.3 | Low | 47.1 | Very low | 143 Ų | 143 | 135.5 Ų | 135.5 | 87% | 0.867 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 141.8 | -164 | 171.5 | 0 | 0 | 0 | 0 | 116 | ||
| 107 | T | 53.4 | Low | 47.8 | Very low | 110 Ų | 110 | 136.5 Ų | 136.5 | 68% | 0.675 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -86.1 | 135.8 | 176.1 | -82.4 | 0 | 0 | 0 | 0 | 112.7 | ||
| 108 | T | 43.6 | Very low | 49.1 | Very low | 145 Ų | 145 | 135 Ų | 135 | 89% | 0.89 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -100.8 | 136.4 | 159.5 | -54.8 | 0 | 0 | 0 | 0 | 109.4 | ||
| 109 | R | 40.3 | Very low | 49.9 | Very low | 228 Ų | 228 | 138.5 Ų | 138.5 | 86% | 0.86 | 77% | 0.769 | S | S | * | * | trans | -104.7 | 135 | -161.3 | -178.9 | -174.6 | -180 | -165.7 | 0.5 | 113.1 | ||||
| 110 | A | 43.4 | Very low | 51.2 | Low | 88 Ų | 88 | 138.4 Ų | 138.4 | 73% | 0.727 | 77% | 0.765 | S | S | * | * | trans | 175.2 | 157.5 | 139.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 111 | P | 50.4 | Low | 52 | Low | 131 Ų | 131 | 138.4 Ų | 138.4 | 85% | 0.851 | 76% | 0.759 | S | S | * | * | cis | -119.2 | -175.6 | -5.3 | 37.1 | -19.2 | 0 | 0 | 0 | 113.3 | ||||
| 112 | A | 54.5 | Low | 53.3 | Low | 76 Ų | 76 | 135.3 Ų | 135.3 | 63% | 0.628 | 75% | 0.746 | S | S | * | * | trans | -75.5 | 116 | -159.5 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 113 | N | 42.1 | Very low | 54.4 | Low | 126 Ų | 126 | 134.1 Ų | 134.1 | 67% | 0.674 | 73% | 0.734 | S | S | * | * | trans | 39.1 | 95.8 | 132.8 | 45.6 | -89.5 | 0 | 0 | 0 | 120.6 | ||||
| 114 | T | 49.2 | Very low | 55.5 | Low | 132 Ų | 132 | 128.9 Ų | 128.9 | 81% | 0.81 | 73% | 0.727 | S | S | * | * | -143.6 | 56.2 | 123.3 | 5.6 | 0 | 0 | 0 | 0 | 106.4 | |||||
| 115 | L | 43.4 | Very low | 56.9 | Low | 177 Ų | 177 | 125.1 Ų | 125.1 | 93% | 0.927 | 72% | 0.723 | S | S | * | * | trans | -104.8 | 81.2 | -174.5 | -159.7 | 85.9 | 0 | 0 | 0 | 107.7 | ||||
| 116 | G | 50.8 | Low | 58.4 | Low | 34 Ų | 34 | 122.5 Ų | 122.5 | 35% | 0.351 | 70% | 0.703 | S | S | . | * | S | Bend | trans | -169.5 | 117.7 | 171 | 0 | 0 | 0 | 0 | 0 | 106.9 | D118 | G116-D118 PolarHBondContact O-N 3.48Š|
| 117 | N | 60.4 | Low | 59.2 | Low | 147 Ų | 147 | 121.3 Ų | 121.3 | 79% | 0.786 | 69% | 0.692 | S | S | * | * | S | Bend | trans | 72.6 | 4.2 | 159.5 | 38.3 | -74.2 | 0 | 0 | 0 | 119.3 | F119 | N117-F119 VanDerWaalsContact C-N 3.34Å; N117-F119 PolarHBondContact O-N 3Å |
| 118 | D | 64.3 | Low | 59.9 | Low | 129 Ų | 129 | 124.2 Ų | 124.2 | 69% | 0.69 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77 | -14 | 176.7 | -66.8 | 12.2 | 0 | 0 | 0 | 114.8 | G116 | G116-D118 PolarHBondContact O-N 3.48Š|
| 119 | F | 67.9 | Low | 60.9 | Low | 208 Ų | 208 | 122.5 Ų | 122.5 | 91% | 0.912 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.7 | 21.7 | 176.6 | -69.4 | -78.5 | 0 | 0 | 0 | 112.9 | N117 L121 | N117-F119 VanDerWaalsContact C-N 3.34Å; N117-F119 PolarHBondContact O-N 3Å; F119-L121 PolarHBondContact O-N 3.49Å |
| 120 | D | 72.9 | Confident | 61.9 | Low | 102 Ų | 102 | 117.9 Ų | 117.9 | 55% | 0.545 | 67% | 0.668 | S | S | . | * | trans | -87.5 | 109.2 | 177.7 | -163 | -3.9 | 0 | 0 | 0 | 110.8 | A122 | D120-A122 PolarHBondContact O-N 3.17Å; D120-A122 WeakPolarHBondContact OD1-CB 3.24Å; D120-A122 PolarHBondContact OD1-N 2.84Å | ||
| 121 | L | 73.5 | Confident | 62.5 | Low | 134 Ų | 134 | 122.7 Ų | 122.7 | 70% | 0.702 | 67% | 0.667 | S | S | * | * | G | 310 helix | trans | -74.4 | -3.7 | 174.3 | -64 | 171.6 | 0 | 0 | 0 | 112.4 | F119 D123 A124 L125 | F119-L121 PolarHBondContact O-N 3.49Å; L121-D123 PolarHBondContact O-N 3.49Å; L121-A124 PolarHBondContact O-N 2.97Å; L121-A124 VanDerWaalsContact O-N 3.09Å; L121-L125 PolarHBondContact O-N 3.22Å |
| 122 | A | 73 | Confident | 62.8 | Low | 56 Ų | 56 | 123.4 Ų | 123.4 | 46% | 0.463 | 66% | 0.664 | S | S | . | * | G | 310 helix | trans | -59.5 | -31 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | D120 A124 L125 D126 | D120-A122 PolarHBondContact O-N 3.17Å; D120-A122 WeakPolarHBondContact OD1-CB 3.24Å; D120-A122 PolarHBondContact OD1-N 2.84Å; A122-A124 VanDerWaalsContact C-N 3.34Å; A122-L125 PolarHBondContact O-N 3.14Å; A122-D126 PolarHBondContact O-N 2.8Å |
| 123 | D | 73.6 | Confident | 62.8 | Low | 110 Ų | 110 | 125.8 Ų | 125.8 | 59% | 0.588 | 67% | 0.666 | S | S | * | * | G | 310 helix | trans | -74.2 | -25.3 | 177.3 | -163 | 35.7 | 0 | 0 | 0 | 112.6 | L121 | L121-D123 PolarHBondContact O-N 3.49Š|
| 124 | A | 71.2 | Confident | 63.3 | Low | 84 Ų | 84 | 123.8 Ų | 123.8 | 69% | 0.694 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.2 | -18.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | L121 A122 | L121-A124 PolarHBondContact O-N 2.97Å; L121-A124 VanDerWaalsContact O-N 3.09Å; A122-A124 VanDerWaalsContact C-N 3.34Å |
| 125 | L | 73.9 | Confident | 63.5 | Low | 149 Ų | 149 | 128.7 Ų | 128.7 | 78% | 0.78 | 68% | 0.679 | S | S | * | * | S | Bend | trans | -98.1 | -2.6 | 175 | -68.1 | 173.8 | 0 | 0 | 0 | 112.8 | L121 A122 D127 | L121-L125 PolarHBondContact O-N 3.22Å; A122-L125 PolarHBondContact O-N 3.14Å; L125-D127 PolarHBondContact O-N 3.46Å; L125-D127 VanDerWaalsContact O-N 3.14Å |
| 126 | D | 72.3 | Confident | 63.9 | Low | 63 Ų | 63 | 131.4 Ų | 131.4 | 34% | 0.337 | 68% | 0.677 | S | S | . | * | trans | -74 | 101.6 | 173.8 | -169.7 | 16.1 | 0 | 0 | 0 | 109.5 | A122 R128 N129 | A122-D126 PolarHBondContact O-N 2.8Å; D126-R128 PolarHBondContact O-N 2.88Å; D126-R128 VanDerWaalsContact OD1-CB 3.24Å; D126-R128 WeakPolarHBondContact OD1-CB 3.27Å; D126-R128 WeakPolarHBondContact OD1-CD 3.49Å; D126-R128 VanDerWaalsContact OD1-CG 3.25Å; D126-R128 WeakPolarHBondContact OD1-CG 3.19Å; D126-R128 PolarHBondContact OD1-N 3.3Å; D126-N129 WeakPolarHBondContact O-CB 3.29Å; D126-N129 PolarHBondContact O-N 2.85Å | ||
| 127 | D | 68.9 | Low | 64.4 | Low | 119 Ų | 119 | 138.3 Ų | 138.3 | 64% | 0.636 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.2 | -9.4 | 172.3 | 66.8 | -8.4 | 0 | 0 | 0 | 113.1 | L125 D130 | L125-D127 PolarHBondContact O-N 3.46Å; L125-D127 VanDerWaalsContact O-N 3.14Å; D127-D130 WeakPolarHBondContact O-CB 3.23Å |
| 128 | R | 67.5 | Low | 64.1 | Low | 171 Ų | 171 | 136.7 Ų | 136.7 | 65% | 0.645 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.1 | -11.5 | 173.7 | -53.3 | 174.9 | 176.5 | -167.4 | -1 | 113.5 | D126 D130 R131 | D126-R128 PolarHBondContact O-N 2.88Å; D126-R128 VanDerWaalsContact OD1-CB 3.24Å; D126-R128 WeakPolarHBondContact OD1-CB 3.27Å; D126-R128 WeakPolarHBondContact OD1-CD 3.49Å; D126-R128 VanDerWaalsContact OD1-CG 3.25Å; D126-R128 WeakPolarHBondContact OD1-CG 3.19Å; D126-R128 PolarHBondContact OD1-N 3.3Å; R128-D130 VanDerWaalsContact C-N 3.26Å; R128-R131 WeakPolarHBondContact O-CG 3.3Å |
| 129 | N | 64.6 | Low | 63.5 | Low | 108 Ų | 108 | 138.1 Ų | 138.1 | 58% | 0.578 | 70% | 0.701 | S | S | * | * | S | Bend | trans | -80.1 | -13.8 | 168.3 | -163.1 | 35.2 | 0 | 0 | 0 | 111.5 | D126 R131 | D126-N129 WeakPolarHBondContact O-CB 3.29Å; D126-N129 PolarHBondContact O-N 2.85Å; N129-R131 PolarHBondContact O-N 2.94Å |
| 130 | D | 61.6 | Low | 62.7 | Low | 132 Ų | 132 | 133.1 Ų | 133.1 | 71% | 0.706 | 70% | 0.698 | S | S | * | * | trans | -73.3 | 32.8 | 165.3 | -60.4 | -32.3 | 0 | 0 | 0 | 112.1 | D127 R128 D132 | D127-D130 WeakPolarHBondContact O-CB 3.23Å; R128-D130 VanDerWaalsContact C-N 3.26Å; D130-D132 PolarHBondContact O-N 3.44Å | ||
| 131 | R | 56.9 | Low | 61.7 | Low | 188 Ų | 188 | 131.1 Ų | 131.1 | 71% | 0.709 | 70% | 0.702 | S | S | * | * | trans | -69.5 | 77.2 | 165.6 | -83.6 | 174.4 | -177.9 | 143.4 | 3.6 | 108.1 | R128 N129 D133 | R128-R131 WeakPolarHBondContact O-CG 3.3Å; N129-R131 PolarHBondContact O-N 2.94Å; R131-D133 PolarHBondContact O-N 3.39Å | ||
| 132 | D | 56.5 | Low | 60.5 | Low | 146 Ų | 146 | 128.4 Ų | 128.4 | 78% | 0.781 | 71% | 0.706 | S | S | * | * | trans | -56.5 | 89.1 | 146 | -160.3 | 8.3 | 0 | 0 | 0 | 105.6 | D130 G134 | D130-D132 PolarHBondContact O-N 3.44Å; D132-G134 PolarHBondContact O-N 2.9Å | ||
| 133 | D | 54.3 | Low | 59.9 | Low | 126 Ų | 126 | 129.4 Ų | 129.4 | 67% | 0.674 | 72% | 0.722 | S | S | * | * | trans | -49.4 | 105.9 | 175.7 | -61.9 | -39.7 | 0 | 0 | 0 | 106.9 | R131 R135 | R131-D133 PolarHBondContact O-N 3.39Å; D133-R135 PolarHBondContact O-N 2.9Å | ||
| 134 | G | 52.7 | Low | 59.5 | Low | 85 Ų | 85 | 127.1 Ų | 127.1 | 88% | 0.876 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -56 | 67.5 | -169.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | D132 | D132-G134 PolarHBondContact O-N 2.9Š|
| 135 | R | 54 | Low | 59.3 | Low | 235 Ų | 235 | 130.3 Ų | 130.3 | 89% | 0.887 | 72% | 0.723 | S | S | * | * | trans | -137.6 | -5.2 | -173.5 | -97.9 | -170.3 | -170.6 | -140.1 | 2.5 | 114.6 | D133 | D133-R135 PolarHBondContact O-N 2.9Š| ||
| 136 | R | 52.2 | Low | 59.1 | Low | 233 Ų | 233 | 125.9 Ų | 125.9 | 88% | 0.879 | 70% | 0.704 | S | S | * | * | trans | -109.7 | 76 | 159.8 | -99 | -177.3 | 174.2 | -158.6 | -0.8 | 110.2 | ||||
| 137 | K | 59.7 | Low | 59.3 | Low | 179 Ų | 179 | 129.2 Ų | 129.2 | 78% | 0.778 | 72% | 0.722 | S | S | * | * | P | Polyproline II helix | trans | -46.6 | 123 | 156.7 | -159.6 | 157.9 | -177.5 | 178.5 | 0 | 106.6 | I139 | K137-I139 PolarHBondContact O-N 3.32Š|
| 138 | P | 53.7 | Low | 59.6 | Low | 113 Ų | 113 | 130.8 Ų | 130.8 | 73% | 0.734 | 72% | 0.723 | S | S | * | * | P | Polyproline II helix | trans | -53.2 | 122.5 | 165.7 | 22.7 | -30 | 0 | 0 | 0 | 104.5 | A140 | P138-A140 PolarHBondContact O-N 2.68Š|
| 139 | I | 52.9 | Low | 60.1 | Low | 159 Ų | 159 | 126 Ų | 126 | 82% | 0.815 | 71% | 0.71 | S | S | * | * | P | Polyproline II helix | trans | -48 | 117.8 | 178.5 | -67.5 | 173.1 | 0 | 0 | 0 | 104.8 | K137 G141 | K137-I139 PolarHBondContact O-N 3.32Å; I139-G141 PolarHBondContact O-N 2.88Å |
| 140 | A | 50.4 | Low | 60.5 | Low | 103 Ų | 103 | 125.7 Ų | 125.7 | 85% | 0.851 | 71% | 0.708 | S | S | * | * | S | Bend | trans | -67.9 | 63.8 | 174.1 | 0 | 0 | 0 | 0 | 0 | 108.3 | P138 | P138-A140 PolarHBondContact O-N 2.68Š|
| 141 | G | 51.4 | Low | 61.2 | Low | 61 Ų | 61 | 125.4 Ų | 125.4 | 63% | 0.629 | 70% | 0.703 | S | S | * | * | trans | -131.2 | 36.3 | 170.9 | 0 | 0 | 0 | 0 | 0 | 107.9 | I139 G143 | I139-G141 PolarHBondContact O-N 2.88Å; G141-G143 PolarHBondContact O-N 2.99Å | ||
| 142 | G | 50.4 | Low | 61.8 | Low | 77 Ų | 77 | 120.8 Ų | 120.8 | 79% | 0.794 | 69% | 0.692 | S | S | * | * | trans | -62.9 | 86.6 | 172.2 | 0 | 0 | 0 | 0 | 0 | 109.7 | G144 | G142-G144 VanDerWaalsContact C-N 3.32Å; G142-G144 PolarHBondContact O-N 2.86Å | ||
| 143 | G | 59.1 | Low | 62.5 | Low | 76 Ų | 76 | 118.4 Ų | 118.4 | 78% | 0.784 | 68% | 0.678 | S | S | * | * | trans | -70.9 | 95.1 | 156 | 0 | 0 | 0 | 0 | 0 | 106.8 | G141 | G141-G143 PolarHBondContact O-N 2.99Š| ||
| 144 | G | 65.1 | Low | 63.3 | Low | 62 Ų | 62 | 118 Ų | 118 | 64% | 0.639 | 68% | 0.68 | S | S | * | * | trans | -63.5 | 137.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | G142 S146 | G142-G144 VanDerWaalsContact C-N 3.32Å; G142-G144 PolarHBondContact O-N 2.86Å; G144-S146 PolarHBondContact O-N 2.73Å; G144-S146 VanDerWaalsContact O-N 3.09Å | ||
| 145 | F | 66.9 | Low | 64.1 | Low | 152 Ų | 152 | 117.2 Ų | 117.2 | 67% | 0.667 | 67% | 0.672 | S | S | * | * | trans | -57.3 | 111.5 | 163.3 | -117.4 | -91.8 | 0 | 0 | 0 | 107.4 | D149 L150 I153 | F145-D149 HydrophobicContact CD1-CB 3.85Å; F145-D149 HydrophobicContact CE1-CB 3.98Å; F145-L150 HydrophobicContact CE1-CD1 4.32Å; F145-I153 HydrophobicContact CE1-CD1 3.86Å; F145-I153 HydrophobicContact CZ-CD1 3.83Å | ||
| 146 | S | 70.6 | Confident | 64.7 | Low | 56 Ų | 56 | 109.4 Ų | 109.4 | 39% | 0.392 | 67% | 0.665 | S | S | . | * | trans | -90.2 | 153.7 | 169.9 | 74.3 | 0 | 0 | 0 | 0 | 109.3 | G144 K148 D149 | G144-S146 PolarHBondContact O-N 2.73Å; G144-S146 VanDerWaalsContact O-N 3.09Å; S146-K148 PolarHBondContact O-N 3.09Å; S146-D149 WeakPolarHBondContact CA-OD2 3.23Å; S146-D149 WeakPolarHBondContact CB-OD2 3.35Å; S146-D149 PolarHBondContact N-OD2 2.88Å; S146-D149 WeakPolarHBondContact O-CA 3.5Å; S146-D149 VanDerWaalsContact O-CB 3.28Å; S146-D149 WeakPolarHBondContact O-CB 3.47Å; S146-D149 PolarHBondContact O-N 2.89Å; S146-D149 PolarHBondContact OG-OD2 3.21Å | ||
| 147 | D | 75.4 | Confident | 65.3 | Low | 133 Ų | 133 | 99.6 Ų | 99.6 | 71% | 0.711 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -53.5 | -29 | 178.5 | -67.9 | -11.1 | 0 | 0 | 0 | 112.5 | D149 L150 E151 | D147-D149 VanDerWaalsContact C-N 3.3Å; D147-D149 PolarHBondContact O-N 3.47Å; D147-L150 WeakPolarHBondContact O-CA 3.25Å; D147-L150 WeakPolarHBondContact O-CB 3.24Å; D147-L150 PolarHBondContact O-N 3.22Å; D147-E151 WeakPolarHBondContact O-CG 3.32Å; D147-E151 PolarHBondContact O-N 2.96Å |
| 148 | K | 76.2 | Confident | 65.7 | Low | 152 Ų | 152 | 98.3 Ų | 98.3 | 66% | 0.661 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -63.9 | -32.4 | 174.6 | -64.8 | -175.2 | 178 | 64.2 | 0 | 113.4 | S146 L150 E151 D152 | S146-K148 PolarHBondContact O-N 3.09Å; K148-L150 PolarHBondContact O-N 3.28Å; K148-E151 PolarHBondContact O-N 3.33Å; K148-D152 PolarHBondContact O-N 3.49Å |
| 149 | D | 76.8 | Confident | 66.2 | Low | 70 Ų | 70 | 101 Ų | 101 | 37% | 0.374 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -68.3 | -30.4 | 174.3 | -56.1 | -61.9 | 0 | 0 | 0 | 110.3 | F145 S146 D147 I153 | F145-D149 HydrophobicContact CD1-CB 3.85Å; F145-D149 HydrophobicContact CE1-CB 3.98Å; S146-D149 WeakPolarHBondContact CA-OD2 3.23Å; S146-D149 WeakPolarHBondContact CB-OD2 3.35Å; S146-D149 PolarHBondContact N-OD2 2.88Å; S146-D149 WeakPolarHBondContact O-CA 3.5Å; S146-D149 VanDerWaalsContact O-CB 3.28Å; S146-D149 WeakPolarHBondContact O-CB 3.47Å; S146-D149 PolarHBondContact O-N 2.89Å; S146-D149 PolarHBondContact OG-OD2 3.21Å; D147-D149 VanDerWaalsContact C-N 3.3Å; D147-D149 PolarHBondContact O-N 3.47Å; D149-I153 WeakPolarHBondContact O-CD1 3.3Å; D149-I153 VanDerWaalsContact O-CG1 3.23Å; D149-I153 WeakPolarHBondContact O-CG1 3.5Å; D149-I153 PolarHBondContact O-N 3.37Å |
| 150 | L | 73.4 | Confident | 66.8 | Low | 101 Ų | 101 | 100.7 Ų | 100.7 | 53% | 0.529 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -72.9 | -40.4 | 172.7 | -144.5 | 77.8 | 0 | 0 | 0 | 111.4 | F145 D147 K148 D152 I153 V154 | F145-L150 HydrophobicContact CE1-CD1 4.32Å; D147-L150 WeakPolarHBondContact O-CA 3.25Å; D147-L150 WeakPolarHBondContact O-CB 3.24Å; D147-L150 PolarHBondContact O-N 3.22Å; K148-L150 PolarHBondContact O-N 3.28Å; L150-D152 VanDerWaalsContact C-N 3.34Å; L150-D152 PolarHBondContact O-N 3.01Å; L150-I153 PolarHBondContact O-N 3.48Å; L150-V154 VanDerWaalsContact O-CB 3.23Å; L150-V154 WeakPolarHBondContact O-CB 3.31Å; L150-V154 WeakPolarHBondContact O-CG2 3.24Å; L150-V154 PolarHBondContact O-N 3.47Å |
| 151 | E | 76.1 | Confident | 67.6 | Low | 127 Ų | 127 | 99.2 Ų | 99.2 | 59% | 0.593 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -61.6 | -39.1 | 175.3 | -63.2 | 169.6 | -127.8 | 0 | 0 | 112.2 | D147 K148 G155 | D147-E151 WeakPolarHBondContact O-CG 3.32Å; D147-E151 PolarHBondContact O-N 2.96Å; K148-E151 PolarHBondContact O-N 3.33Å; E151-G155 VanDerWaalsContact O-CA 3.24Å; E151-G155 WeakPolarHBondContact O-CA 3.35Å; E151-G155 PolarHBondContact O-N 2.98Å |
| 152 | D | 70.7 | Confident | 68.2 | Low | 90 Ų | 90 | 102 Ų | 102 | 48% | 0.481 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -70.4 | -39.6 | 179.1 | -163.6 | 40.4 | 0 | 0 | 0 | 111.5 | K148 L150 G157 | K148-D152 PolarHBondContact O-N 3.49Å; L150-D152 VanDerWaalsContact C-N 3.34Å; L150-D152 PolarHBondContact O-N 3.01Å; D152-G157 VanDerWaalsContact O-CA 3.27Å; D152-G157 WeakPolarHBondContact O-CA 3.47Å; D152-G157 PolarHBondContact O-N 3.13Å; D152-G157 WeakPolarHBondContact OD1-CA 3.07Å |
| 153 | I | 70 | Confident | 68.8 | Low | 96 Ų | 96 | 108.5 Ų | 108.5 | 49% | 0.492 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -70.7 | -40.2 | 176.5 | -64.8 | 167.7 | 0 | 0 | 0 | 111.7 | F145 D149 L150 | F145-I153 HydrophobicContact CE1-CD1 3.86Å; F145-I153 HydrophobicContact CZ-CD1 3.83Å; D149-I153 WeakPolarHBondContact O-CD1 3.3Å; D149-I153 VanDerWaalsContact O-CG1 3.23Å; D149-I153 WeakPolarHBondContact O-CG1 3.5Å; D149-I153 PolarHBondContact O-N 3.37Å; L150-I153 PolarHBondContact O-N 3.48Å |
| 154 | V | 72.7 | Confident | 68.8 | Low | 118 Ų | 118 | 108 Ų | 108 | 72% | 0.715 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -81 | -30.7 | -179 | 174.1 | 0 | 0 | 0 | 0 | 111.9 | L150 G156 | L150-V154 VanDerWaalsContact O-CB 3.23Å; L150-V154 WeakPolarHBondContact O-CB 3.31Å; L150-V154 WeakPolarHBondContact O-CG2 3.24Å; L150-V154 PolarHBondContact O-N 3.47Å; V154-G156 PolarHBondContact O-N 3.47Å |
| 155 | G | 69.6 | Low | 68.6 | Low | 68 Ų | 68 | 113.7 Ų | 113.7 | 70% | 0.701 | 61% | 0.612 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.4 | 4.4 | -178.2 | 0 | 0 | 0 | 0 | 0 | 115 | E151 G157 | E151-G155 VanDerWaalsContact O-CA 3.24Å; E151-G155 WeakPolarHBondContact O-CA 3.35Å; E151-G155 PolarHBondContact O-N 2.98Å; G155-G157 VanDerWaalsContact C-N 3.31Å |
| 156 | G | 64.6 | Low | 68 | Low | 72 Ų | 72 | 109.7 Ų | 109.7 | 74% | 0.742 | 61% | 0.614 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 74.3 | 23 | -178 | 0 | 0 | 0 | 0 | 0 | 113.4 | V154 | V154-G156 PolarHBondContact O-N 3.47Š|
| 157 | G | 66 | Low | 67.1 | Low | 26 Ų | 26 | 115.3 Ų | 115.3 | 27% | 0.268 | 64% | 0.639 | S | S | . | * | trans | -67.2 | 127.6 | 170.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | D152 G155 Y159 | D152-G157 VanDerWaalsContact O-CA 3.27Å; D152-G157 WeakPolarHBondContact O-CA 3.47Å; D152-G157 PolarHBondContact O-N 3.13Å; D152-G157 WeakPolarHBondContact OD1-CA 3.07Å; G155-G157 VanDerWaalsContact C-N 3.31Å; G157-Y159 VanDerWaalsContact C-N 3.35Å; G157-Y159 PolarHBondContact O-N 3.34Å | ||
| 158 | E | 68.4 | Low | 66.3 | Low | 152 Ų | 152 | 111.5 Ų | 111.5 | 71% | 0.71 | 63% | 0.632 | S | S | * | * | trans | -70.4 | 90.8 | -179 | -167.7 | 173.1 | 152.1 | 0 | 0 | 109.5 | K160 | E158-K160 VanDerWaalsContact CD-CE 3.43Å; E158-K160 HydrophobicContact CG-CG 4.32Å; E158-K160 PolarHBondContact O-N 3.34Å; E158-K160 WeakPolarHBondContact OE1-CE 3.34Å; E158-K160 IonicContact OE1-NZ 3.48Å; E158-K160 PolarHBondContact OE1-NZ 3.07Å | ||
| 159 | Y | 63.5 | Low | 65.1 | Low | 170 Ų | 170 | 116.1 Ų | 116.1 | 67% | 0.667 | 65% | 0.645 | S | S | * | * | trans | -54.9 | 107.1 | 170.7 | 178.7 | -104.4 | 0 | 0 | 0 | 109.4 | G157 P161 | G157-Y159 VanDerWaalsContact C-N 3.35Å; G157-Y159 PolarHBondContact O-N 3.34Å; Y159-P161 HydrophobicContact CD1-CG 4.36Å; Y159-P161 HydrophobicContact CE1-CB 3.86Å; Y159-P161 HydrophobicContact CE1-CG 3.97Å; Y159-P161 VanDerWaalsContact O-CD 3.25Å; Y159-P161 WeakPolarHBondContact O-CD 3.36Å | ||
| 160 | K | 66.3 | Low | 64.2 | Low | 152 Ų | 152 | 123.4 Ų | 123.4 | 66% | 0.661 | 67% | 0.669 | S | S | * | * | trans | -104.3 | 93.5 | 174.7 | -71.2 | -175.1 | -176.2 | -171.4 | 0 | 108.7 | E158 D162 | E158-K160 VanDerWaalsContact CD-CE 3.43Å; E158-K160 HydrophobicContact CG-CG 4.32Å; E158-K160 PolarHBondContact O-N 3.34Å; E158-K160 WeakPolarHBondContact OE1-CE 3.34Å; E158-K160 IonicContact OE1-NZ 3.48Å; E158-K160 PolarHBondContact OE1-NZ 3.07Å; K160-D162 PolarHBondContact O-N 3.32Å | ||
| 161 | P | 66.1 | Low | 63.2 | Low | 73 Ų | 73 | 122.4 Ų | 122.4 | 47% | 0.474 | 68% | 0.683 | S | S | . | * | trans | -59.6 | 130.7 | 170.7 | 25 | -30.7 | 0 | 0 | 0 | 108.2 | Y159 K163 | Y159-P161 HydrophobicContact CD1-CG 4.36Å; Y159-P161 HydrophobicContact CE1-CB 3.86Å; Y159-P161 HydrophobicContact CE1-CG 3.97Å; Y159-P161 VanDerWaalsContact O-CD 3.25Å; Y159-P161 WeakPolarHBondContact O-CD 3.36Å; P161-K163 PolarHBondContact O-N 2.9Å | ||
| 162 | D | 63.9 | Low | 62.1 | Low | 118 Ų | 118 | 120.5 Ų | 120.5 | 63% | 0.631 | 68% | 0.683 | S | S | * | * | trans | -51.4 | 108.2 | 178.4 | -179.9 | 2.1 | 0 | 0 | 0 | 109.6 | K160 G164 | K160-D162 PolarHBondContact O-N 3.32Å; D162-G164 PolarHBondContact O-N 2.96Å; D162-G164 VanDerWaalsContact O-N 3.17Å; D162-G164 PolarHBondContact OD1-N 3.46Å | ||
| 163 | K | 64 | Low | 61.3 | Low | 215 Ų | 215 | 123.7 Ų | 123.7 | 94% | 0.935 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.9 | 5.3 | -179.8 | -77.3 | -175.4 | 178.5 | 178.3 | 0 | 113.2 | P161 | P161-K163 PolarHBondContact O-N 2.9Š|
| 164 | G | 59.5 | Low | 60.5 | Low | 64 Ų | 64 | 125.7 Ų | 125.7 | 66% | 0.66 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -124.8 | 3 | -162.6 | 0 | 0 | 0 | 0 | 0 | 117.9 | D162 | D162-G164 PolarHBondContact O-N 2.96Å; D162-G164 VanDerWaalsContact O-N 3.17Å; D162-G164 PolarHBondContact OD1-N 3.46Å |
| 165 | K | 60.1 | Low | 59.6 | Low | 183 Ų | 183 | 125.1 Ų | 125.1 | 80% | 0.796 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -134 | 27.2 | -166.4 | -123.6 | 170.7 | -175.8 | 179 | 0 | 117.2 | ||
| 166 | G | 54.2 | Low | 58.8 | Low | 67 Ų | 67 | 128.2 Ų | 128.2 | 69% | 0.691 | 71% | 0.713 | S | S | * | * | trans | -144.8 | 82.8 | 171.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | G168 | G166-G168 PolarHBondContact O-N 3.27Š| ||
| 167 | D | 52.6 | Low | 57.8 | Low | 175 Ų | 175 | 127.9 Ų | 127.9 | 94% | 0.936 | 71% | 0.71 | S | S | * | * | trans | -69.2 | 61.7 | 164 | 56.8 | -24.1 | 0 | 0 | 0 | 110.5 | ||||
| 168 | G | 57.1 | Low | 56.6 | Low | 53 Ų | 53 | 131.4 Ų | 131.4 | 55% | 0.546 | 73% | 0.73 | S | S | . | * | S | Bend | trans | -141.5 | 82 | -178.3 | 0 | 0 | 0 | 0 | 0 | 110 | G166 Y170 | G166-G168 PolarHBondContact O-N 3.27Å; G168-Y170 PolarHBondContact O-N 2.58Å |
| 169 | R | 52 | Low | 55.4 | Low | 248 Ų | 248 | 127.4 Ų | 127.4 | 94% | 0.936 | 73% | 0.73 | S | S | * | * | trans | -0.9 | 81.9 | 161 | -64.1 | 178.2 | -170.7 | -109.5 | 0.8 | 115.2 | ||||
| 170 | Y | 56.5 | Low | 54.7 | Low | 223 Ų | 223 | 127.4 Ų | 127.4 | 88% | 0.875 | 74% | 0.738 | S | S | * | * | trans | -147 | 89.5 | 164.8 | -107.8 | -90.1 | 0 | 0 | 0 | 107.9 | G168 S172 | G168-Y170 PolarHBondContact O-N 2.58Å; Y170-S172 PolarHBondContact O-N 2.83Å | ||
| 171 | G | 54.3 | Low | 53.9 | Low | 81 Ų | 81 | 126.8 Ų | 126.8 | 84% | 0.835 | 75% | 0.746 | S | S | * | * | trans | -83.2 | 91.4 | 167.4 | 0 | 0 | 0 | 0 | 0 | 108.5 | N173 | G171-N173 PolarHBondContact O-N 3.43Š| ||
| 172 | S | 52.9 | Low | 53.2 | Low | 86 Ų | 86 | 124.1 Ų | 124.1 | 60% | 0.601 | 73% | 0.73 | S | S | * | * | trans | -80.4 | 94.1 | 165.2 | -142.1 | 0 | 0 | 0 | 0 | 107.2 | Y170 D174 | Y170-S172 PolarHBondContact O-N 2.83Å; S172-D174 VanDerWaalsContact C-N 3.31Å; S172-D174 PolarHBondContact O-N 3.49Å; S172-D174 PolarHBondContact OG-OD1 2.98Å | ||
| 173 | N | 53.9 | Low | 52.7 | Low | 158 Ų | 158 | 125.3 Ų | 125.3 | 85% | 0.845 | 73% | 0.732 | S | S | * | * | trans | -81.7 | 92.8 | 156.1 | -81.8 | -42.2 | 0 | 0 | 0 | 105.4 | G171 D175 | G171-N173 PolarHBondContact O-N 3.43Å; N173-D175 PolarHBondContact O-N 3.37Å | ||
| 174 | D | 52.8 | Low | 52.3 | Low | 137 Ų | 137 | 120.4 Ų | 120.4 | 73% | 0.733 | 72% | 0.722 | S | S | * | * | trans | -73.1 | 76.1 | 170.1 | -59.5 | -33.7 | 0 | 0 | 0 | 107.9 | S172 | S172-D174 VanDerWaalsContact C-N 3.31Å; S172-D174 PolarHBondContact O-N 3.49Å; S172-D174 PolarHBondContact OG-OD1 2.98Å | ||
| 175 | D | 53.7 | Low | 52.4 | Low | 107 Ų | 107 | 119.8 Ų | 119.8 | 57% | 0.572 | 72% | 0.716 | S | S | * | * | trans | -90.9 | 115.1 | 165.9 | -173.3 | 34.9 | 0 | 0 | 0 | 107.8 | N173 G177 | N173-D175 PolarHBondContact O-N 3.37Å; D175-G177 PolarHBondContact O-N 2.87Å | ||
| 176 | P | 52.3 | Low | 52.4 | Low | 133 Ų | 133 | 114.4 Ų | 114.4 | 86% | 0.864 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.1 | 70.5 | 179.3 | 33.9 | -33 | 0 | 0 | 0 | 108.3 | ||
| 177 | G | 44.7 | Very low | 52.7 | Low | 65 Ų | 65 | 116.2 Ų | 116.2 | 67% | 0.67 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -174.8 | -8.7 | -169.7 | 0 | 0 | 0 | 0 | 0 | 119.6 | D175 | D175-G177 PolarHBondContact O-N 2.87Š|
| 178 | S | 38.8 | Very low | 53.6 | Low | 100 Ų | 100 | 110.5 Ų | 110.5 | 70% | 0.699 | 67% | 0.669 | S | S | * | * | S | Bend | trans | -164.6 | 132.8 | 177.1 | 65.4 | 0 | 0 | 0 | 0 | 113.3 | ||
| 179 | G | 44.3 | Very low | 54.8 | Low | 68 Ų | 68 | 109.9 Ų | 109.9 | 70% | 0.701 | 66% | 0.662 | S | S | * | * | trans | 104.1 | 34.7 | 149 | 0 | 0 | 0 | 0 | 0 | 119.9 | V181 | G179-V181 VanDerWaalsContact C-N 3.27Å; G179-V181 PolarHBondContact O-N 2.92Å | ||
| 180 | M | 49.7 | Very low | 56.2 | Low | 170 Ų | 170 | 102 Ų | 102 | 84% | 0.837 | 64% | 0.642 | S | S | * | * | trans | -67.7 | 101.7 | 145.3 | -165.2 | -175.1 | -151.1 | 0 | 0 | 105.6 | A182 | M180-A182 HydrophobicContact CG-CB 4.13Å; M180-A182 PolarHBondContact O-N 3.45Å; M180-A182 HydrophobicContact SD-CB 4.11Å | ||
| 181 | V | 49.4 | Very low | 57.5 | Low | 138 Ų | 138 | 94.3 Ų | 94.3 | 84% | 0.836 | 62% | 0.624 | S | S | * | * | trans | -66.1 | 73.3 | 157.6 | -177.4 | 0 | 0 | 0 | 0 | 105 | G179 E183 | G179-V181 VanDerWaalsContact C-N 3.27Å; G179-V181 PolarHBondContact O-N 2.92Å; V181-E183 PolarHBondContact O-N 3.25Å; V181-E183 VanDerWaalsContact O-N 3.11Å | ||
| 182 | A | 51 | Low | 58.9 | Low | 17 Ų | 17 | 93.8 Ų | 93.8 | 14% | 0.14 | 61% | 0.608 | C | S | . | * | trans | -62.3 | 118.6 | 168.5 | 0 | 0 | 0 | 0 | 0 | 103.8 | M180 I187 | M180-A182 HydrophobicContact CG-CB 4.13Å; M180-A182 PolarHBondContact O-N 3.45Å; M180-A182 HydrophobicContact SD-CB 4.11Å; A182-I187 HydrophobicContact CB-CD1 3.75Å; A182-I187 HydrophobicContact CB-CG1 3.25Å; A182-I187 WeakPolarHBondContact O-CD1 3.04Å | ||
| 183 | E | 52 | Low | 60.4 | Low | 143 Ų | 143 | 92.6 Ų | 92.6 | 67% | 0.668 | 60% | 0.603 | S | S | * | * | trans | -42.6 | 134.9 | 175.1 | -162.6 | 172.9 | 154.1 | 0 | 0 | 107 | V181 G185 T186 I187 | V181-E183 PolarHBondContact O-N 3.25Å; V181-E183 VanDerWaalsContact O-N 3.11Å; E183-G185 CarbonylContact O-C 3.58Å; E183-G185 PolarHBondContact O-N 3.02Å; E183-T186 PolarHBondContact O-N 3.11Å; E183-I187 PolarHBondContact O-N 3.29Å | ||
| 184 | P | 56 | Low | 62.1 | Low | 112 Ų | 112 | 90.3 Ų | 90.3 | 73% | 0.727 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -48.6 | -27.2 | -175.3 | -23.2 | 24.3 | 0 | 0 | 0 | 113 | A188 | P184-A188 WeakPolarHBondContact O-CB 3.37Å; P184-A188 PolarHBondContact O-N 2.95Å |
| 185 | G | 61.6 | Low | 63.8 | Low | 52 Ų | 52 | 86 Ų | 86 | 54% | 0.536 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -68.2 | -36 | 172 | 0 | 0 | 0 | 0 | 0 | 115.8 | E183 G189 | E183-G185 CarbonylContact O-C 3.58Å; E183-G185 PolarHBondContact O-N 3.02Å; G185-G189 PolarHBondContact O-N 3.17Å |
| 186 | T | 60.8 | Low | 65.5 | Low | 70 Ų | 70 | 87.3 Ų | 87.3 | 43% | 0.429 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -74.3 | -40.3 | 179.7 | -36.5 | 0 | 0 | 0 | 0 | 111.8 | E183 G189 V190 | E183-T186 PolarHBondContact O-N 3.11Å; T186-G189 PolarHBondContact O-N 2.98Å; T186-V190 HydrophobicContact CG2-CG2 4.42Å; T186-V190 WeakPolarHBondContact O-CG2 3.25Å; T186-V190 PolarHBondContact O-N 2.88Å |
| 187 | I | 60.1 | Low | 67.2 | Low | 105 Ų | 105 | 83.9 Ų | 83.9 | 54% | 0.538 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -64.6 | -44.8 | 178.1 | -55.1 | 177.3 | 0 | 0 | 0 | 110.1 | A182 E183 A191 | A182-I187 HydrophobicContact CB-CD1 3.75Å; A182-I187 HydrophobicContact CB-CG1 3.25Å; A182-I187 WeakPolarHBondContact O-CD1 3.04Å; E183-I187 PolarHBondContact O-N 3.29Å; I187-A191 WeakPolarHBondContact O-CB 3.27Å; I187-A191 PolarHBondContact O-N 3.24Å; I187-A191 VanDerWaalsContact O-N 3.11Å |
| 188 | A | 72 | Confident | 69.4 | Low | 55 Ų | 55 | 86.3 Ų | 86.3 | 46% | 0.455 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -65.7 | -39.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | P184 S192 | P184-A188 WeakPolarHBondContact O-CB 3.37Å; P184-A188 PolarHBondContact O-N 2.95Å; A188-S192 VanDerWaalsContact O-CB 3.3Å; A188-S192 WeakPolarHBondContact O-CB 3.34Å; A188-S192 PolarHBondContact O-N 2.88Å; A188-S192 PolarHBondContact O-OG 2.96Å |
| 189 | G | 81.5 | Confident | 71.6 | Confident | 39 Ų | 39 | 86.8 Ų | 86.8 | 40% | 0.402 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -63.2 | -49.6 | 178 | 0 | 0 | 0 | 0 | 0 | 112.8 | G185 T186 S192 A193 | G185-G189 PolarHBondContact O-N 3.17Å; T186-G189 PolarHBondContact O-N 2.98Å; G189-S192 PolarHBondContact O-N 2.84Å; G189-A193 WeakPolarHBondContact O-CB 3.45Å; G189-A193 PolarHBondContact O-N 3.35Å |
| 190 | V | 81.4 | Confident | 73.6 | Confident | 84 Ų | 84 | 85.5 Ų | 85.5 | 51% | 0.509 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -65.2 | -41.8 | 179 | 175.7 | 0 | 0 | 0 | 0 | 111.1 | T186 S192 A193 L194 | T186-V190 HydrophobicContact CG2-CG2 4.42Å; T186-V190 WeakPolarHBondContact O-CG2 3.25Å; T186-V190 PolarHBondContact O-N 2.88Å; V190-S192 VanDerWaalsContact C-N 3.32Å; V190-S192 PolarHBondContact O-N 2.7Å; V190-A193 PolarHBondContact O-N 3.27Å; V190-L194 HydrophobicContact CG1-CD1 4.18Å; V190-L194 PolarHBondContact O-N 3.33Å |
| 191 | A | 84.8 | Confident | 75.4 | Confident | 61 Ų | 61 | 80 Ų | 80 | 50% | 0.504 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61.6 | -41 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112 | I187 L194 A195 | I187-A191 WeakPolarHBondContact O-CB 3.27Å; I187-A191 PolarHBondContact O-N 3.24Å; I187-A191 VanDerWaalsContact O-N 3.11Å; A191-L194 PolarHBondContact O-N 3.41Å; A191-A195 PolarHBondContact O-N 3.24Å |
| 192 | S | 84.1 | Confident | 77.1 | Confident | 70 Ų | 70 | 77.6 Ų | 77.6 | 49% | 0.49 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -67.6 | -41.4 | 177.5 | -57.6 | 0 | 0 | 0 | 0 | 112 | A188 G189 V190 A195 M196 | A188-S192 VanDerWaalsContact O-CB 3.3Å; A188-S192 WeakPolarHBondContact O-CB 3.34Å; A188-S192 PolarHBondContact O-N 2.88Å; A188-S192 PolarHBondContact O-OG 2.96Å; G189-S192 PolarHBondContact O-N 2.84Å; V190-S192 VanDerWaalsContact C-N 3.32Å; V190-S192 PolarHBondContact O-N 2.7Å; S192-A195 PolarHBondContact O-N 2.72Å; S192-M196 WeakPolarHBondContact O-CG 3.44Å; S192-M196 PolarHBondContact O-N 2.89Å |
| 193 | A | 84.6 | Confident | 78.3 | Confident | 61 Ų | 61 | 80.5 Ų | 80.5 | 50% | 0.504 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.9 | -42.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | G189 V190 M196 A197 | G189-A193 WeakPolarHBondContact O-CB 3.45Å; G189-A193 PolarHBondContact O-N 3.35Å; V190-A193 PolarHBondContact O-N 3.27Å; A193-M196 PolarHBondContact O-N 2.69Å; A193-A197 VanDerWaalsContact O-CB 3.27Å; A193-A197 WeakPolarHBondContact O-CB 3.32Å; A193-A197 PolarHBondContact O-N 3.37Å |
| 194 | L | 89.7 | Confident | 79.3 | Confident | 110 Ų | 110 | 77.2 Ų | 77.2 | 58% | 0.576 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -62.1 | -43.3 | 174 | -106 | 79.6 | 0 | 0 | 0 | 112 | V190 A191 A197 L198 | V190-L194 HydrophobicContact CG1-CD1 4.18Å; V190-L194 PolarHBondContact O-N 3.33Å; A191-L194 PolarHBondContact O-N 3.41Å; L194-A197 PolarHBondContact O-N 3.28Å; L194-L198 WeakPolarHBondContact O-CG 3.37Å; L194-L198 PolarHBondContact O-N 2.86Å |
| 195 | A | 87.9 | Confident | 80.1 | Confident | 47 Ų | 47 | 78.7 Ų | 78.7 | 39% | 0.388 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.7 | -45.8 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | A191 S192 L198 I199 | A191-A195 PolarHBondContact O-N 3.24Å; S192-A195 PolarHBondContact O-N 2.72Å; A195-L198 PolarHBondContact O-N 3.01Å; A195-I199 WeakPolarHBondContact O-CG1 3.23Å; A195-I199 PolarHBondContact O-N 2.67Å |
| 196 | M | 88.7 | Confident | 80.4 | Confident | 134 Ų | 134 | 80.5 Ų | 80.5 | 66% | 0.66 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -66.3 | -38.1 | 176.8 | -69.5 | -62.3 | 169.7 | 0 | 0 | 112.3 | S192 A193 L198 I199 G200 | S192-M196 WeakPolarHBondContact O-CG 3.44Å; S192-M196 PolarHBondContact O-N 2.89Å; A193-M196 PolarHBondContact O-N 2.69Å; M196-L198 VanDerWaalsContact C-N 3.33Å; M196-L198 PolarHBondContact O-N 3.26Å; M196-I199 PolarHBondContact O-N 2.86Å; M196-I199 HydrophobicContact SD-CD1 4.22Å; M196-G200 PolarHBondContact O-N 3.49Å |
| 197 | A | 89.2 | Confident | 80.6 | Confident | 61 Ų | 61 | 78.7 Ų | 78.7 | 50% | 0.504 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.4 | -41.6 | 175 | 0 | 0 | 0 | 0 | 0 | 111.8 | A193 L194 G200 A201 | A193-A197 VanDerWaalsContact O-CB 3.27Å; A193-A197 WeakPolarHBondContact O-CB 3.32Å; A193-A197 PolarHBondContact O-N 3.37Å; L194-A197 PolarHBondContact O-N 3.28Å; A197-G200 PolarHBondContact O-N 2.86Å; A197-A201 VanDerWaalsContact O-CB 3.31Å; A197-A201 WeakPolarHBondContact O-CB 3.33Å; A197-A201 PolarHBondContact O-N 3.41Å |
| 198 | L | 89.8 | Confident | 80.6 | Confident | 116 Ų | 116 | 81.2 Ų | 81.2 | 61% | 0.607 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -66.5 | -41.8 | 176.2 | -70.2 | 173.5 | 0 | 0 | 0 | 112.1 | L194 A195 M196 G200 A201 V202 | L194-L198 WeakPolarHBondContact O-CG 3.37Å; L194-L198 PolarHBondContact O-N 2.86Å; A195-L198 PolarHBondContact O-N 3.01Å; M196-L198 VanDerWaalsContact C-N 3.33Å; M196-L198 PolarHBondContact O-N 3.26Å; L198-G200 VanDerWaalsContact C-N 3.33Å; L198-G200 PolarHBondContact O-N 2.78Å; L198-A201 PolarHBondContact O-N 2.92Å; L198-V202 VanDerWaalsContact O-CG2 3.3Å; L198-V202 WeakPolarHBondContact O-CG2 3.3Å; L198-V202 PolarHBondContact O-N 3.08Å |
| 199 | I | 84.4 | Confident | 80.2 | Confident | 109 Ų | 109 | 84.1 Ų | 84.1 | 56% | 0.559 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -60.5 | -44.5 | 174.7 | -66.5 | 164.7 | 0 | 0 | 0 | 110.5 | A195 M196 S203 | A195-I199 WeakPolarHBondContact O-CG1 3.23Å; A195-I199 PolarHBondContact O-N 2.67Å; M196-I199 PolarHBondContact O-N 2.86Å; M196-I199 HydrophobicContact SD-CD1 4.22Å; I199-S203 VanDerWaalsContact O-CB 3.24Å; I199-S203 WeakPolarHBondContact O-CB 3.42Å; I199-S203 PolarHBondContact O-N 3.26Å |
| 200 | G | 87.8 | Confident | 79 | Confident | 41 Ų | 41 | 87.8 Ų | 87.8 | 42% | 0.423 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.6 | -41.5 | 176 | 0 | 0 | 0 | 0 | 0 | 113 | M196 A197 L198 S203 S204 | M196-G200 PolarHBondContact O-N 3.49Å; A197-G200 PolarHBondContact O-N 2.86Å; L198-G200 VanDerWaalsContact C-N 3.33Å; L198-G200 PolarHBondContact O-N 2.78Å; G200-S203 PolarHBondContact O-N 3.47Å; G200-S204 VanDerWaalsContact O-CB 3.29Å; G200-S204 WeakPolarHBondContact O-CB 2.95Å; G200-S204 PolarHBondContact O-N 3Å |
| 201 | A | 85.9 | Confident | 77.8 | Confident | 56 Ų | 56 | 93.1 Ų | 93.1 | 46% | 0.463 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -67.5 | -41.9 | 178 | 0 | 0 | 0 | 0 | 0 | 112.4 | A197 L198 S204 Y205 | A197-A201 VanDerWaalsContact O-CB 3.31Å; A197-A201 WeakPolarHBondContact O-CB 3.33Å; A197-A201 PolarHBondContact O-N 3.41Å; L198-A201 PolarHBondContact O-N 2.92Å; A201-S204 WeakPolarHBondContact O-CB 3.3Å; A201-S204 PolarHBondContact O-N 2.73Å; A201-Y205 WeakPolarHBondContact O-CB 3.05Å; A201-Y205 PolarHBondContact O-N 3.11Å |
| 202 | V | 85 | Confident | 76.3 | Confident | 87 Ų | 87 | 98.9 Ų | 98.9 | 53% | 0.527 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -67 | -40.6 | 175.5 | 175.4 | 0 | 0 | 0 | 0 | 110.6 | L198 S204 Y205 I206 | L198-V202 VanDerWaalsContact O-CG2 3.3Å; L198-V202 WeakPolarHBondContact O-CG2 3.3Å; L198-V202 PolarHBondContact O-N 3.08Å; V202-S204 VanDerWaalsContact C-N 3.34Å; V202-S204 PolarHBondContact O-N 3.16Å; V202-Y205 PolarHBondContact O-N 2.81Å; V202-I206 HydrophobicContact CG1-CD1 4.02Å; V202-I206 WeakPolarHBondContact O-CG1 3.43Å; V202-I206 PolarHBondContact O-N 2.89Å |
| 203 | S | 77.3 | Confident | 75 | Confident | 78 Ų | 78 | 100.7 Ų | 100.7 | 55% | 0.545 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -60.8 | -40.9 | 172.1 | -177.8 | 0 | 0 | 0 | 0 | 112.3 | I199 G200 S207 | I199-S203 VanDerWaalsContact O-CB 3.24Å; I199-S203 WeakPolarHBondContact O-CB 3.42Å; I199-S203 PolarHBondContact O-N 3.26Å; G200-S203 PolarHBondContact O-N 3.47Å; S203-S207 PolarHBondContact O-N 3.45Å; S203-S207 VanDerWaalsContact O-N 3.13Å; S203-S207 PolarHBondContact O-OG 2.87Å |
| 204 | S | 72.7 | Confident | 73.3 | Confident | 74 Ų | 74 | 101.5 Ų | 101.5 | 52% | 0.517 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -66.2 | -36.5 | 174.2 | -176.8 | 0 | 0 | 0 | 0 | 112.5 | G200 A201 V202 S207 Y208 | G200-S204 VanDerWaalsContact O-CB 3.29Å; G200-S204 WeakPolarHBondContact O-CB 2.95Å; G200-S204 PolarHBondContact O-N 3Å; A201-S204 WeakPolarHBondContact O-CB 3.3Å; A201-S204 PolarHBondContact O-N 2.73Å; V202-S204 VanDerWaalsContact C-N 3.34Å; V202-S204 PolarHBondContact O-N 3.16Å; S204-S207 VanDerWaalsContact CA-OG 3.3Å; S204-S207 WeakPolarHBondContact CA-OG 3.44Å; S204-S207 PolarHBondContact O-OG 2.77Å; S204-Y208 WeakPolarHBondContact O-CB 3.34Å; S204-Y208 PolarHBondContact O-N 2.83Å |
| 205 | Y | 72.1 | Confident | 71.4 | Confident | 142 Ų | 142 | 104.6 Ų | 104.6 | 56% | 0.557 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -72 | -38.8 | 179.1 | -174.1 | -104.5 | 0 | 0 | 0 | 112.6 | A201 V202 S207 Y208 Q209 | A201-Y205 WeakPolarHBondContact O-CB 3.05Å; A201-Y205 PolarHBondContact O-N 3.11Å; V202-Y205 PolarHBondContact O-N 2.81Å; Y205-S207 VanDerWaalsContact C-N 3.35Å; Y205-Y208 WeakPolarHBondContact O-CB 3.21Å; Y205-Y208 PolarHBondContact O-N 3.49Å; Y205-Q209 HydrophobicContact CD1-CG 4.27Å; Y205-Q209 HydrophobicContact CE1-CG 3.81Å; Y205-Q209 HydrophobicContact CE2-CG 4.39Å; Y205-Q209 PolarHBondContact O-N 2.8Å; Y205-Q209 PolarHBondContact OH-NE2 3.49Å |
| 206 | I | 68.5 | Low | 69.5 | Low | 91 Ų | 91 | 104.7 Ų | 104.7 | 47% | 0.467 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -65.6 | -40.4 | 175.3 | -64.2 | 164.4 | 0 | 0 | 0 | 110.4 | V202 Y208 Q209 Q210 | V202-I206 HydrophobicContact CG1-CD1 4.02Å; V202-I206 WeakPolarHBondContact O-CG1 3.43Å; V202-I206 PolarHBondContact O-N 2.89Å; I206-Y208 VanDerWaalsContact C-N 3.32Å; I206-Y208 PolarHBondContact O-N 3.42Å; I206-Q209 PolarHBondContact O-N 3.34Å; I206-Q210 WeakPolarHBondContact O-CG 3.32Å; I206-Q210 PolarHBondContact O-N 2.86Å; I206-Q210 VanDerWaalsContact O-N 3.13Å |
| 207 | S | 65 | Low | 67.8 | Low | 31 Ų | 31 | 101.9 Ų | 101.9 | 22% | 0.217 | 54% | 0.535 | C | S | . | . | H | α-helix | trans | -66.7 | -31.7 | 174.7 | 52.6 | 0 | 0 | 0 | 0 | 113.1 | S203 S204 Y205 | S203-S207 PolarHBondContact O-N 3.45Å; S203-S207 VanDerWaalsContact O-N 3.13Å; S203-S207 PolarHBondContact O-OG 2.87Å; S204-S207 VanDerWaalsContact CA-OG 3.3Å; S204-S207 WeakPolarHBondContact CA-OG 3.44Å; S204-S207 PolarHBondContact O-OG 2.77Å; Y205-S207 VanDerWaalsContact C-N 3.35Å |
| 208 | Y | 60.3 | Low | 66 | Low | 158 Ų | 158 | 106.2 Ų | 106.2 | 62% | 0.62 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -69.3 | -47.3 | 172.9 | -177.9 | -102.3 | 0 | 0 | 0 | 112.7 | S204 Y205 I206 Q210 K211 | S204-Y208 WeakPolarHBondContact O-CB 3.34Å; S204-Y208 PolarHBondContact O-N 2.83Å; Y205-Y208 WeakPolarHBondContact O-CB 3.21Å; Y205-Y208 PolarHBondContact O-N 3.49Å; I206-Y208 VanDerWaalsContact C-N 3.32Å; I206-Y208 PolarHBondContact O-N 3.42Å; Y208-Q210 VanDerWaalsContact C-N 3.31Å; Y208-Q210 PolarHBondContact O-N 3.22Å; Y208-K211 PolarHBondContact O-N 2.84Å |
| 209 | Q | 63.4 | Low | 64 | Low | 116 Ų | 116 | 107.2 Ų | 107.2 | 54% | 0.542 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -64.2 | -33.6 | -179.3 | -80.6 | -74.1 | -2.1 | 0 | 0 | 112.9 | Y205 I206 K211 | Y205-Q209 HydrophobicContact CD1-CG 4.27Å; Y205-Q209 HydrophobicContact CE1-CG 3.81Å; Y205-Q209 HydrophobicContact CE2-CG 4.39Å; Y205-Q209 PolarHBondContact O-N 2.8Å; Y205-Q209 PolarHBondContact OH-NE2 3.49Å; I206-Q209 PolarHBondContact O-N 3.34Å; Q209-K211 PolarHBondContact O-N 3.09Å; Q209-K211 VanDerWaalsContact O-N 3.09Å |
| 210 | Q | 56.1 | Low | 62.5 | Low | 117 Ų | 117 | 103.4 Ų | 103.4 | 55% | 0.547 | 53% | 0.534 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73 | 3.2 | -177.9 | -77.1 | -165.8 | -7.4 | 0 | 0 | 115 | I206 Y208 K212 | I206-Q210 WeakPolarHBondContact O-CG 3.32Å; I206-Q210 PolarHBondContact O-N 2.86Å; I206-Q210 VanDerWaalsContact O-N 3.13Å; Y208-Q210 VanDerWaalsContact C-N 3.31Å; Y208-Q210 PolarHBondContact O-N 3.22Å; Q210-K212 VanDerWaalsContact O-CB 3.3Å; Q210-K212 WeakPolarHBondContact O-CB 3.41Å; Q210-K212 WeakPolarHBondContact O-CG 3.2Å; Q210-K212 PolarHBondContact O-N 2.94Å |
| 211 | K | 56.7 | Low | 60.7 | Low | 196 Ų | 196 | 106.9 Ų | 106.9 | 85% | 0.852 | 54% | 0.542 | S | S | * | . | S | Bend | trans | 44.8 | 11.8 | 171 | -95.2 | -173.9 | 179.9 | -176.2 | 0 | 116.9 | Y208 Q209 | Y208-K211 PolarHBondContact O-N 2.84Å; Q209-K211 PolarHBondContact O-N 3.09Å; Q209-K211 VanDerWaalsContact O-N 3.09Å |
| 212 | K | 54.1 | Low | 59 | Low | 182 Ų | 182 | 109.7 Ų | 109.7 | 79% | 0.791 | 55% | 0.549 | S | S | * | . | S | Bend | trans | -126.5 | -2.5 | -171.6 | -71.1 | -176.3 | -178.3 | 174.2 | 0 | 113.1 | Q210 | Q210-K212 VanDerWaalsContact O-CB 3.3Å; Q210-K212 WeakPolarHBondContact O-CB 3.41Å; Q210-K212 WeakPolarHBondContact O-CG 3.2Å; Q210-K212 PolarHBondContact O-N 2.94Å |
| 213 | F | 54.9 | Low | 57.3 | Low | 108 Ų | 108 | 107.3 Ų | 107.3 | 47% | 0.474 | 54% | 0.539 | S | S | . | . | S | Bend | trans | -127.5 | 4.2 | 178.7 | -70.6 | -76.1 | 0 | 0 | 0 | 114.9 | F215 S216 | F213-F215 PolarHBondContact O-N 2.92Å; F213-F215 VanDerWaalsContact O-N 3.11Å; F213-S216 PolarHBondContact O-N 3.38Å |
| 214 | C | 50.1 | Low | 55.9 | Low | 78 Ų | 78 | 108.8 Ų | 108.8 | 53% | 0.527 | 54% | 0.54 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74.7 | 12.3 | 175 | -73.5 | 0 | 0 | 0 | 0 | 115.6 | ||
| 215 | F | 50.3 | Low | 54.6 | Low | 174 Ų | 174 | 115.3 Ų | 115.3 | 76% | 0.763 | 56% | 0.555 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -129.5 | -7.1 | 171.4 | -158.1 | -95.8 | 0 | 0 | 0 | 113.6 | F213 | F213-F215 PolarHBondContact O-N 2.92Å; F213-F215 VanDerWaalsContact O-N 3.11Å |
| 216 | S | 47.2 | Very low | 53.7 | Low | 50 Ų | 50 | 114.6 Ų | 114.6 | 35% | 0.35 | 57% | 0.566 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -93.5 | -12.1 | 176.7 | 74.8 | 0 | 0 | 0 | 0 | 113 | F213 Q219 G220 | F213-S216 PolarHBondContact O-N 3.38Å; S216-Q219 CarbonylContact O-C 3.31Å; S216-Q219 VanDerWaalsContact O-C 3.31Å; S216-Q219 WeakPolarHBondContact O-CA 3.43Å; S216-Q219 WeakPolarHBondContact O-CB 3.38Å; S216-Q219 PolarHBondContact O-N 3.46Å; S216-G220 PolarHBondContact O-N 3.35Å |
| 217 | I | 54.1 | Low | 52.9 | Low | 74 Ų | 74 | 118.2 Ų | 118.2 | 38% | 0.379 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -81.6 | -18.1 | -175.1 | -61.9 | 168.8 | 0 | 0 | 0 | 112.2 | Q219 G220 L221 | I217-Q219 PolarHBondContact O-N 3.17Å; I217-G220 PolarHBondContact O-N 3.4Å; I217-L221 HydrophobicContact CG2-CB 4.43Å; I217-L221 HydrophobicContact CG2-CD1 3.8Å; I217-L221 HydrophobicContact CG2-CG 4.36Å; I217-L221 PolarHBondContact O-N 3.45Å |
| 218 | Q | 50.1 | Low | 52 | Low | 152 Ų | 152 | 119.6 Ų | 119.6 | 71% | 0.71 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -76 | -7.8 | 162.9 | -64.5 | -177.1 | 36.3 | 0 | 0 | 112.4 | N222 | Q218-N222 VanDerWaalsContact O-CB 3.24Å; Q218-N222 WeakPolarHBondContact O-CB 3.21Å |
| 219 | Q | 49 | Very low | 51.2 | Low | 138 Ų | 138 | 120.9 Ų | 120.9 | 65% | 0.645 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -102.5 | -26.9 | 160.2 | -72.3 | 175.5 | -17.4 | 0 | 0 | 111.5 | S216 I217 A223 | S216-Q219 CarbonylContact O-C 3.31Å; S216-Q219 VanDerWaalsContact O-C 3.31Å; S216-Q219 WeakPolarHBondContact O-CA 3.43Å; S216-Q219 WeakPolarHBondContact O-CB 3.38Å; S216-Q219 PolarHBondContact O-N 3.46Å; I217-Q219 PolarHBondContact O-N 3.17Å; Q219-A223 VanDerWaalsContact O-CA 3.26Å; Q219-A223 WeakPolarHBondContact O-CA 3.31Å; Q219-A223 WeakPolarHBondContact O-CB 3.43Å; Q219-A223 PolarHBondContact O-N 2.98Å |
| 220 | G | 52.2 | Low | 50.2 | Low | 28 Ų | 28 | 121.4 Ų | 121.4 | 29% | 0.289 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -92.8 | -9.2 | -171.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | S216 I217 | S216-G220 PolarHBondContact O-N 3.35Å; I217-G220 PolarHBondContact O-N 3.4Å |
| 221 | L | 50.5 | Low | 49.7 | Very low | 115 Ų | 115 | 122 Ų | 122 | 60% | 0.602 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.7 | -23.6 | 167.4 | -86.4 | 163.8 | 0 | 0 | 0 | 111.5 | I217 Y225 | I217-L221 HydrophobicContact CG2-CB 4.43Å; I217-L221 HydrophobicContact CG2-CD1 3.8Å; I217-L221 HydrophobicContact CG2-CG 4.36Å; I217-L221 PolarHBondContact O-N 3.45Å; L221-Y225 VanDerWaalsContact O-CB 3.3Å; L221-Y225 WeakPolarHBondContact O-CB 3.26Å; L221-Y225 PolarHBondContact O-N 3.27Å |
| 222 | N | 48.7 | Very low | 48.7 | Very low | 114 Ų | 114 | 120.6 Ų | 120.6 | 61% | 0.61 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.8 | -22.7 | 175.1 | -93.9 | -90.8 | 0 | 0 | 0 | 113.3 | Q218 | Q218-N222 VanDerWaalsContact O-CB 3.24Å; Q218-N222 WeakPolarHBondContact O-CB 3.21Å |
| 223 | A | 49.7 | Very low | 47.9 | Very low | 38 Ų | 38 | 116.1 Ų | 116.1 | 31% | 0.314 | 62% | 0.615 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -85.8 | -29.6 | 164 | 0 | 0 | 0 | 0 | 0 | 111.5 | Q219 Y225 V226 K227 | Q219-A223 VanDerWaalsContact O-CA 3.26Å; Q219-A223 WeakPolarHBondContact O-CA 3.31Å; Q219-A223 WeakPolarHBondContact O-CB 3.43Å; Q219-A223 PolarHBondContact O-N 2.98Å; A223-Y225 VanDerWaalsContact C-N 3.34Å; A223-Y225 PolarHBondContact O-N 3.44Å; A223-V226 PolarHBondContact O-N 3.03Å; A223-K227 WeakPolarHBondContact O-CA 3.28Å; A223-K227 WeakPolarHBondContact O-CB 3.29Å; A223-K227 PolarHBondContact O-N 3.3Å |
| 224 | D | 49 | Very low | 47.2 | Very low | 108 Ų | 108 | 117.4 Ų | 117.4 | 58% | 0.578 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.3 | -20.3 | 178.1 | -71.1 | -10.1 | 0 | 0 | 0 | 113.4 | G228 | D224-G228 WeakPolarHBondContact O-CA 3.29Å; D224-G228 PolarHBondContact O-N 2.86Å |
| 225 | Y | 45.4 | Very low | 46.7 | Very low | 211 Ų | 211 | 119.2 Ų | 119.2 | 83% | 0.827 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.7 | -8.7 | 175.6 | -139.7 | -100.2 | 0 | 0 | 0 | 114.5 | L221 A223 | L221-Y225 VanDerWaalsContact O-CB 3.3Å; L221-Y225 WeakPolarHBondContact O-CB 3.26Å; L221-Y225 PolarHBondContact O-N 3.27Å; A223-Y225 VanDerWaalsContact C-N 3.34Å; A223-Y225 PolarHBondContact O-N 3.44Å |
| 226 | V | 53 | Low | 46.3 | Very low | 128 Ų | 128 | 115.5 Ų | 115.5 | 78% | 0.776 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115 | -3.6 | 175.4 | 171.7 | 0 | 0 | 0 | 0 | 111.4 | A223 | A223-V226 PolarHBondContact O-N 3.03Š|
| 227 | K | 51.2 | Low | 46.1 | Very low | 166 Ų | 166 | 121.2 Ų | 121.2 | 72% | 0.722 | 66% | 0.656 | S | S | * | * | S | Bend | trans | -136.4 | 34.5 | -177.4 | -155.9 | 177.1 | -177.4 | -179.7 | 0 | 111.4 | A223 | A223-K227 WeakPolarHBondContact O-CA 3.28Å; A223-K227 WeakPolarHBondContact O-CB 3.29Å; A223-K227 PolarHBondContact O-N 3.3Å |
| 228 | G | 45.7 | Very low | 45 | Very low | 60 Ų | 60 | 125.3 Ų | 125.3 | 62% | 0.619 | 67% | 0.673 | S | S | * | * | trans | -108.6 | 12.6 | -172.2 | 0 | 0 | 0 | 0 | 0 | 115.6 | D224 N230 | D224-G228 WeakPolarHBondContact O-CA 3.29Å; D224-G228 PolarHBondContact O-N 2.86Å; G228-N230 PolarHBondContact O-N 3.41Å | ||
| 229 | E | 44.8 | Very low | 44.8 | Very low | 186 Ų | 186 | 122.4 Ų | 122.4 | 87% | 0.869 | 67% | 0.667 | S | S | * | * | S | Bend | trans | -82.1 | 16.5 | 175.3 | 64.3 | -179.1 | 143.9 | 0 | 0 | 113.6 | ||
| 230 | N | 42.2 | Very low | 44.2 | Very low | 126 Ų | 126 | 124.6 Ų | 124.6 | 67% | 0.674 | 68% | 0.678 | S | S | * | * | S | Bend | trans | -153.6 | 121.2 | -174.2 | -144.6 | -107.1 | 0 | 0 | 0 | 114.2 | G228 | G228-N230 PolarHBondContact O-N 3.41Š|
| 231 | L | 44.4 | Very low | 43.3 | Very low | 129 Ų | 129 | 129.3 Ų | 129.3 | 68% | 0.675 | 70% | 0.7 | S | S | * | * | trans | 78.1 | 100.7 | 169.8 | -66.8 | 146.9 | 0 | 0 | 0 | 115.5 | ||||
| 232 | E | 36.7 | Very low | 42.7 | Very low | 167 Ų | 167 | 132.6 Ų | 132.6 | 78% | 0.78 | 71% | 0.71 | S | S | * | * | 52.4 | 85.4 | 77.3 | -58.5 | -179 | 132.5 | 0 | 0 | 111.8 | |||||
| 233 | A | 38.1 | Very low | 42 | Very low | 89 Ų | 89 | 138.5 Ų | 138.5 | 74% | 0.736 | 73% | 0.725 | S | S | * | * | trans | -168.6 | 45.5 | 149.8 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 234 | V | 38.9 | Very low | 41.6 | Very low | 134 Ų | 134 | 142.3 Ų | 142.3 | 81% | 0.812 | 75% | 0.75 | S | S | * | * | -32.4 | 78.7 | 83.5 | -174.7 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 235 | V | 39.2 | Very low | 41.3 | Very low | 117 Ų | 117 | 143.4 Ų | 143.4 | 71% | 0.709 | 76% | 0.761 | S | S | * | * | trans | -133 | 91.8 | 151.6 | 169 | 0 | 0 | 0 | 0 | 102.4 | ||||
| 236 | C | 42.2 | Very low | 41.1 | Very low | 96 Ų | 96 | 140.8 Ų | 140.8 | 65% | 0.649 | 76% | 0.76 | S | S | * | * | 50.5 | 114.7 | 87.8 | -65.6 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 237 | E | 42.8 | Very low | 40.2 | Very low | 170 Ų | 170 | 143 Ų | 143 | 79% | 0.794 | 76% | 0.761 | S | S | * | * | 7.1 | 118.4 | 127.5 | -93.2 | -161.8 | 146.8 | 0 | 0 | 116.1 | |||||
| 238 | E | 32.4 | Very low | 39.6 | Very low | 160 Ų | 160 | 139.7 Ų | 139.7 | 75% | 0.748 | 76% | 0.755 | S | S | * | * | 104.2 | 164.9 | 90.5 | -143.1 | -161.8 | 77.7 | 0 | 0 | 111 | |||||
| 239 | P | 44.5 | Very low | 39.4 | Very low | 91 Ų | 91 | 145.5 Ų | 145.5 | 59% | 0.591 | 77% | 0.766 | S | S | * | * | -112.5 | 137.6 | -87.6 | 35.7 | -21.4 | 0 | 0 | 0 | 113.1 | |||||
| 240 | Q | 36.1 | Very low | 39.3 | Very low | 184 Ų | 184 | 141.5 Ų | 141.5 | 86% | 0.86 | 76% | 0.759 | S | S | * | * | trans | -139.7 | 91.5 | 171 | -61.5 | -87.1 | -32.1 | 0 | 0 | 111.4 | ||||
| 241 | V | 33.4 | Very low | 39.3 | Very low | 126 Ų | 126 | 139.8 Ų | 139.8 | 76% | 0.764 | 76% | 0.762 | S | S | * | * | trans | -28.4 | 126.5 | 145.1 | -87.7 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 242 | K | 38.5 | Very low | 39.4 | Very low | 185 Ų | 185 | 142 Ų | 142 | 80% | 0.804 | 77% | 0.769 | S | S | * | * | trans | 154.1 | 89 | 141.5 | -83.9 | 163.3 | -173.1 | -177 | 0 | 111.8 | ||||
| 243 | Y | 34.6 | Very low | 40.1 | Very low | 238 Ų | 238 | 138.5 Ų | 138.5 | 93% | 0.933 | 76% | 0.761 | S | S | * | * | trans | -130.8 | 61.7 | 150.7 | -70.6 | -76.7 | 0 | 0 | 0 | 109.6 | ||||
| 244 | S | 41 | Very low | 40.9 | Very low | 118 Ų | 118 | 140.1 Ų | 140.1 | 83% | 0.825 | 76% | 0.764 | S | S | * | * | trans | -102.1 | 96.6 | 154.9 | -88.4 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 245 | T | 43.2 | Very low | 42.3 | Very low | 131 Ų | 131 | 139.5 Ų | 139.5 | 80% | 0.804 | 76% | 0.763 | S | S | * | * | trans | -153.7 | 86.7 | 155.5 | 8.9 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 246 | L | 40.4 | Very low | 43.5 | Very low | 156 Ų | 156 | 139.6 Ų | 139.6 | 82% | 0.817 | 77% | 0.766 | S | S | * | * | trans | -40.2 | 161.8 | 139.9 | -88.3 | 171.9 | 0 | 0 | 0 | 110.9 | ||||
| 247 | H | 34.7 | Very low | 44.1 | Very low | 174 Ų | 174 | 140.9 Ų | 140.9 | 81% | 0.806 | 77% | 0.773 | S | S | * | * | trans | 78.7 | 113.9 | 168.1 | -100.4 | 81.7 | 0 | 0 | 0 | 113.2 | ||||
| 248 | T | 37.5 | Very low | 44.8 | Very low | 96 Ų | 96 | 141.1 Ų | 141.1 | 59% | 0.589 | 77% | 0.774 | S | S | * | * | 173.5 | 153.3 | 55.6 | -66.9 | 0 | 0 | 0 | 0 | 109.2 | |||||
| 249 | Q | 43 | Very low | 45.9 | Very low | 182 Ų | 182 | 139.3 Ų | 139.3 | 85% | 0.85 | 78% | 0.776 | S | S | * | * | trans | 73.9 | 137.1 | 154.9 | -88.8 | 163.8 | 22.5 | 0 | 0 | 117.2 | ||||
| 250 | S | 41.4 | Very low | 46.6 | Very low | 103 Ų | 103 | 139 Ų | 139 | 72% | 0.72 | 78% | 0.781 | S | S | * | * | cis | -177.9 | 133.9 | 16.4 | 173.7 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 251 | A | 43.2 | Very low | 47.2 | Very low | 90 Ų | 90 | 142 Ų | 142 | 74% | 0.744 | 78% | 0.784 | S | S | * | * | trans | 52.8 | 137.7 | 143.1 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 252 | E | 45.1 | Very low | 48.2 | Very low | 174 Ų | 174 | 147.2 Ų | 147.2 | 81% | 0.813 | 81% | 0.806 | S | S | * | * | cis | 176.7 | -175.2 | 17.9 | -147.3 | -168.1 | 102.2 | 0 | 0 | 106.7 | ||||
| 253 | P | 51.7 | Low | 48.7 | Very low | 94 Ų | 94 | 145.4 Ų | 145.4 | 61% | 0.61 | 81% | 0.806 | S | S | * | * | cis | -122.6 | 174.9 | -35.6 | 15.3 | 9.8 | 0 | 0 | 0 | 113.7 | ||||
| 254 | P | 54.6 | Low | 49.5 | Very low | 123 Ų | 123 | 140.5 Ų | 140.5 | 80% | 0.799 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -99.6 | 150 | -171.7 | 37.5 | -31.3 | 0 | 0 | 0 | 115.5 | ||
| 255 | P | 68 | Low | 50 | Low | 122 Ų | 122 | 141.7 Ų | 141.7 | 79% | 0.792 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -95 | 161.4 | 166 | 33.3 | -30 | 0 | 0 | 0 | 114.3 | ||
| 256 | P | 64.3 | Low | 50.3 | Low | 119 Ų | 119 | 142.4 Ų | 142.4 | 77% | 0.773 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -92.1 | 167 | -137.4 | 35.5 | -38 | 0 | 0 | 0 | 117.4 | ||
| 257 | P | 56.1 | Low | 51 | Low | 122 Ų | 122 | 141.5 Ų | 141.5 | 79% | 0.792 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -92.9 | 140.9 | -179.2 | 36.2 | -29.8 | 0 | 0 | 0 | 112.7 | ||
| 258 | E | 56.8 | Low | 52 | Low | 176 Ų | 176 | 139.3 Ų | 139.3 | 82% | 0.822 | 80% | 0.795 | S | S | * | * | trans | 157.7 | 155.8 | 143.8 | -94.9 | -170 | -174.7 | 0 | 0 | 111.9 | ||||
| 259 | P | 56 | Low | 53.1 | Low | 122 Ų | 122 | 142.4 Ų | 142.4 | 79% | 0.792 | 81% | 0.81 | S | S | * | * | cis | -134.2 | 152.6 | 35.7 | 34.5 | -13.4 | 0 | 0 | 0 | 118.1 | ||||
| 260 | A | 59.5 | Low | 53.9 | Low | 83 Ų | 83 | 139.4 Ų | 139.4 | 69% | 0.686 | 81% | 0.807 | S | S | * | * | trans | -60.2 | 140.2 | 171.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 261 | R | 47.7 | Very low | 54.9 | Low | 247 Ų | 247 | 142.4 Ų | 142.4 | 93% | 0.932 | 81% | 0.814 | S | S | * | * | trans | -65 | 127.2 | 162.9 | -92.6 | -164.8 | -84.7 | -132.4 | -2.7 | 109.5 | ||||
| 262 | I | 55.9 | Low | 56 | Low | 237 Ų | 237 | 147.2 Ų | 147.2 | 100% | 1.215 | 82% | 0.821 | S | S | * | * | trans | -81.4 | 0 | 155 | -50.4 | 173.6 | 0 | 0 | 0 | 107.4 |
Retrieved 262 of 262 residues in 216.1 ms
(Link to these results)