| 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 | 54.7 | Low | 76.6 | Confident | 237 Ų | 237 | 108.8 Ų | 108.8 | 100% | 1.167 | 60% | 0.604 | S | S | * | * | 0 | 102.9 | 0 | -164 | 142.2 | 81.1 | 0 | 0 | 105.8 | S3 | M1-S3 PolarHBondContact O-N 3.27Š| |||
| 2 | D | 63.4 | Low | 77.5 | Confident | 123 Ų | 123 | 110.3 Ų | 110.3 | 66% | 0.658 | 60% | 0.6 | S | S | * | * | trans | -63.9 | 122.1 | -168.4 | -82.7 | -35.7 | 0 | 0 | 0 | 110.8 | S4 H5 A6 | D2-S4 PolarHBondContact O-N 3.45Å; D2-S4 VanDerWaalsContact O-N 3.15Å; D2-H5 HydrophobicContact CB-CB 4.44Å; D2-H5 WeakPolarHBondContact O-CB 3.29Å; D2-H5 PolarHBondContact O-N 3.35Å; D2-A6 PolarHBondContact O-N 3.31Å | ||
| 3 | S | 71.3 | Confident | 78.2 | Confident | 90 Ų | 90 | 110 Ų | 110 | 63% | 0.629 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -51 | -35.4 | 174.1 | 41.3 | 0 | 0 | 0 | 0 | 111.7 | M1 H5 A6 T7 | M1-S3 PolarHBondContact O-N 3.27Å; S3-H5 VanDerWaalsContact C-N 3.3Å; S3-H5 PolarHBondContact O-N 2.93Å; S3-A6 PolarHBondContact O-N 3.4Å; S3-T7 PolarHBondContact O-N 2.98Å; S3-T7 PolarHBondContact O-OG1 2.87Å |
| 4 | S | 78.3 | Confident | 78.9 | Confident | 83 Ų | 83 | 110.1 Ų | 110.1 | 58% | 0.58 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -58.5 | -37.1 | 173.8 | -59 | 0 | 0 | 0 | 0 | 113.6 | D2 R8 | D2-S4 PolarHBondContact O-N 3.45Å; D2-S4 VanDerWaalsContact O-N 3.15Å; S4-R8 WeakPolarHBondContact O-CG 3.47Å; S4-R8 PolarHBondContact O-N 3.35Å; S4-R8 VanDerWaalsContact O-N 3.16Å |
| 5 | H | 74.6 | Confident | 79.5 | Confident | 136 Ų | 136 | 108.7 Ų | 108.7 | 63% | 0.63 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -73.2 | -43.5 | 179.3 | -134.7 | -73.1 | 0 | 0 | 0 | 110.7 | D2 S3 R8 T9 | D2-H5 HydrophobicContact CB-CB 4.44Å; D2-H5 WeakPolarHBondContact O-CB 3.29Å; D2-H5 PolarHBondContact O-N 3.35Å; S3-H5 VanDerWaalsContact C-N 3.3Å; S3-H5 PolarHBondContact O-N 2.93Å; H5-R8 PolarHBondContact O-N 3.05Å; H5-T9 WeakPolarHBondContact O-CB 3.39Å; H5-T9 PolarHBondContact O-N 3.31Å; H5-T9 PolarHBondContact O-OG1 2.92Å; H5-T9 VanDerWaalsContact O-OG1 3.05Å |
| 6 | A | 78 | Confident | 79.8 | Confident | 53 Ų | 53 | 107.2 Ų | 107.2 | 44% | 0.438 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -60.6 | -45.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | D2 S3 R8 T9 C10 | D2-A6 PolarHBondContact O-N 3.31Å; S3-A6 PolarHBondContact O-N 3.4Å; A6-R8 PolarHBondContact O-N 3.15Å; A6-T9 PolarHBondContact O-N 2.96Å; A6-C10 PolarHBondContact O-N 3.3Å; A6-C10 PolarHBondContact O-SG 3.45Å; A6-C10 VanDerWaalsContact O-SG 3.33Å |
| 7 | T | 79.4 | Confident | 80 | Confident | 89 Ų | 89 | 104.2 Ų | 104.2 | 55% | 0.546 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -61.8 | -45.7 | 178.2 | -53 | 0 | 0 | 0 | 0 | 111.8 | S3 C10 V11 | S3-T7 PolarHBondContact O-N 2.98Å; S3-T7 PolarHBondContact O-OG1 2.87Å; T7-C10 PolarHBondContact O-N 3.4Å; T7-V11 WeakPolarHBondContact O-CG2 3.43Å; T7-V11 PolarHBondContact O-N 3.29Å |
| 8 | R | 82.8 | Confident | 80.1 | Confident | 173 Ų | 173 | 105 Ų | 105 | 65% | 0.653 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -61.5 | -46.5 | 177.3 | -73.6 | 174.8 | 89 | 165.3 | 5.7 | 111.2 | S4 H5 A6 C10 V11 F12 | S4-R8 WeakPolarHBondContact O-CG 3.47Å; S4-R8 PolarHBondContact O-N 3.35Å; S4-R8 VanDerWaalsContact O-N 3.16Å; H5-R8 PolarHBondContact O-N 3.05Å; A6-R8 PolarHBondContact O-N 3.15Å; R8-C10 PolarHBondContact O-N 3Å; R8-V11 PolarHBondContact O-N 3.33Å; R8-F12 HydrophobicContact CB-CE2 4.36Å; R8-F12 WeakPolarHBondContact O-CD2 3.03Å; R8-F12 PolarHBondContact O-N 3.5Å |
| 9 | T | 86.1 | Confident | 80 | Confident | 67 Ų | 67 | 106.6 Ų | 106.6 | 41% | 0.411 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -59.3 | -44.8 | 177.4 | -62 | 0 | 0 | 0 | 0 | 111.8 | H5 A6 V11 F12 I13 | H5-T9 WeakPolarHBondContact O-CB 3.39Å; H5-T9 PolarHBondContact O-N 3.31Å; H5-T9 PolarHBondContact O-OG1 2.92Å; H5-T9 VanDerWaalsContact O-OG1 3.05Å; A6-T9 PolarHBondContact O-N 2.96Å; T9-V11 PolarHBondContact O-N 2.94Å; T9-F12 PolarHBondContact O-N 2.92Å; T9-I13 HydrophobicContact CG2-CD1 3.9Å; T9-I13 VanDerWaalsContact O-CG1 3.29Å; T9-I13 WeakPolarHBondContact O-CG1 3.38Å; T9-I13 PolarHBondContact O-N 3.35Å |
| 10 | C | 85.8 | Confident | 79.7 | Confident | 73 Ų | 73 | 105.6 Ų | 105.6 | 49% | 0.493 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -61.5 | -42.8 | 176.4 | -71.6 | 0 | 0 | 0 | 0 | 112.6 | A6 T7 R8 I13 L14 | A6-C10 PolarHBondContact O-N 3.3Å; A6-C10 PolarHBondContact O-SG 3.45Å; A6-C10 VanDerWaalsContact O-SG 3.33Å; T7-C10 PolarHBondContact O-N 3.4Å; R8-C10 PolarHBondContact O-N 3Å; C10-I13 PolarHBondContact O-N 3.26Å; C10-L14 WeakPolarHBondContact O-CG 3.29Å; C10-L14 PolarHBondContact O-N 3.31Å |
| 11 | V | 88.4 | Confident | 79.4 | Confident | 73 Ų | 73 | 102.7 Ų | 102.7 | 44% | 0.442 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -61.6 | -44.9 | 177 | 171.4 | 0 | 0 | 0 | 0 | 110.9 | T7 R8 T9 I13 L14 L15 | T7-V11 WeakPolarHBondContact O-CG2 3.43Å; T7-V11 PolarHBondContact O-N 3.29Å; R8-V11 PolarHBondContact O-N 3.33Å; T9-V11 PolarHBondContact O-N 2.94Å; V11-I13 VanDerWaalsContact C-N 3.35Å; V11-I13 PolarHBondContact O-N 3.16Å; V11-L14 PolarHBondContact O-N 2.99Å; V11-L15 HydrophobicContact CG1-CD1 3.88Å; V11-L15 HydrophobicContact CG1-CG 4.33Å; V11-L15 WeakPolarHBondContact O-CB 3.33Å; V11-L15 VanDerWaalsContact O-CG 3.29Å; V11-L15 WeakPolarHBondContact O-CG 3.28Å; V11-L15 PolarHBondContact O-N 3.35Å |
| 12 | F | 87.3 | Confident | 79.8 | Confident | 126 Ų | 126 | 97.6 Ų | 97.6 | 55% | 0.553 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -61.7 | -41.4 | 176.2 | -75 | -63.9 | 0 | 0 | 0 | 112.4 | R8 T9 L14 L15 V16 | R8-F12 HydrophobicContact CB-CE2 4.36Å; R8-F12 WeakPolarHBondContact O-CD2 3.03Å; R8-F12 PolarHBondContact O-N 3.5Å; T9-F12 PolarHBondContact O-N 2.92Å; F12-L14 PolarHBondContact O-N 3.32Å; F12-L15 PolarHBondContact O-N 3Å; F12-V16 VanDerWaalsContact O-CG2 3.28Å; F12-V16 WeakPolarHBondContact O-CG2 3.45Å; F12-V16 PolarHBondContact O-N 3.47Å |
| 13 | I | 87.4 | Confident | 79.8 | Confident | 107 Ų | 107 | 94.9 Ų | 94.9 | 55% | 0.549 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -61.6 | -44.8 | 177 | -68.4 | 166 | 0 | 0 | 0 | 111 | T9 C10 V11 V16 A17 | T9-I13 HydrophobicContact CG2-CD1 3.9Å; T9-I13 VanDerWaalsContact O-CG1 3.29Å; T9-I13 WeakPolarHBondContact O-CG1 3.38Å; T9-I13 PolarHBondContact O-N 3.35Å; C10-I13 PolarHBondContact O-N 3.26Å; V11-I13 VanDerWaalsContact C-N 3.35Å; V11-I13 PolarHBondContact O-N 3.16Å; I13-V16 PolarHBondContact O-N 3.5Å; I13-A17 WeakPolarHBondContact O-CB 3.33Å; I13-A17 PolarHBondContact O-N 3.42Å |
| 14 | L | 88.1 | Confident | 79.5 | Confident | 112 Ų | 112 | 94.5 Ų | 94.5 | 59% | 0.586 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -65.1 | -40.7 | 177.8 | -69.9 | 172.2 | 0 | 0 | 0 | 112.1 | C10 V11 F12 A17 L18 | C10-L14 WeakPolarHBondContact O-CG 3.29Å; C10-L14 PolarHBondContact O-N 3.31Å; V11-L14 PolarHBondContact O-N 2.99Å; F12-L14 PolarHBondContact O-N 3.32Å; L14-A17 PolarHBondContact O-N 2.92Å; L14-L18 WeakPolarHBondContact O-CG 3.24Å; L14-L18 PolarHBondContact O-N 3.35Å |
| 15 | L | 86.8 | Confident | 79.1 | Confident | 88 Ų | 88 | 96.9 Ų | 96.9 | 46% | 0.461 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -63.1 | -43.9 | 175.9 | -72.8 | 171.7 | 0 | 0 | 0 | 111.6 | V11 F12 A17 L18 L19 | V11-L15 HydrophobicContact CG1-CD1 3.88Å; V11-L15 HydrophobicContact CG1-CG 4.33Å; V11-L15 WeakPolarHBondContact O-CB 3.33Å; V11-L15 VanDerWaalsContact O-CG 3.29Å; V11-L15 WeakPolarHBondContact O-CG 3.28Å; V11-L15 PolarHBondContact O-N 3.35Å; F12-L15 PolarHBondContact O-N 3Å; L15-A17 VanDerWaalsContact C-N 3.34Å; L15-L18 PolarHBondContact O-N 2.92Å; L15-L19 WeakPolarHBondContact O-CB 3.48Å; L15-L19 VanDerWaalsContact O-CG 3.24Å; L15-L19 WeakPolarHBondContact O-CG 3.41Å; L15-L19 PolarHBondContact O-N 3.01Å |
| 16 | V | 84.9 | Confident | 79.6 | Confident | 85 Ų | 85 | 91.2 Ų | 91.2 | 52% | 0.515 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -62.2 | -43.5 | 175 | 172.2 | 0 | 0 | 0 | 0 | 110.5 | F12 I13 L18 L19 C20 | F12-V16 VanDerWaalsContact O-CG2 3.28Å; F12-V16 WeakPolarHBondContact O-CG2 3.45Å; F12-V16 PolarHBondContact O-N 3.47Å; I13-V16 PolarHBondContact O-N 3.5Å; V16-L18 PolarHBondContact O-N 3.21Å; V16-L19 PolarHBondContact O-N 3.37Å; V16-C20 WeakPolarHBondContact O-CB 3.43Å; V16-C20 PolarHBondContact O-N 3.44Å; V16-C20 PolarHBondContact O-SG 3.19Å |
| 17 | A | 82.8 | Confident | 80.3 | Confident | 57 Ų | 57 | 89.3 Ų | 89.3 | 47% | 0.471 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61.7 | -41 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | I13 L14 L15 C20 A21 | I13-A17 WeakPolarHBondContact O-CB 3.33Å; I13-A17 PolarHBondContact O-N 3.42Å; L14-A17 PolarHBondContact O-N 2.92Å; L15-A17 VanDerWaalsContact C-N 3.34Å; A17-C20 PolarHBondContact O-N 2.95Å; A17-A21 WeakPolarHBondContact O-CB 3.36Å; A17-A21 PolarHBondContact O-N 3.22Å |
| 18 | L | 81.8 | Confident | 80.9 | Confident | 118 Ų | 118 | 88.1 Ų | 88.1 | 62% | 0.618 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -66.2 | -45.2 | 176.2 | -74.4 | 164.8 | 0 | 0 | 0 | 111.9 | L14 L15 V16 C20 A21 E22 | L14-L18 WeakPolarHBondContact O-CG 3.24Å; L14-L18 PolarHBondContact O-N 3.35Å; L15-L18 PolarHBondContact O-N 2.92Å; V16-L18 PolarHBondContact O-N 3.21Å; L18-C20 VanDerWaalsContact C-N 3.26Å; L18-C20 PolarHBondContact O-N 3.36Å; L18-A21 PolarHBondContact O-N 3.37Å; L18-A21 VanDerWaalsContact O-N 3.11Å; L18-E22 PolarHBondContact O-N 3.04Å |
| 19 | L | 77.9 | Confident | 81.5 | Confident | 136 Ų | 136 | 79.9 Ų | 79.9 | 71% | 0.712 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -63.2 | -33.5 | 176.6 | -69.8 | 167.9 | 0 | 0 | 0 | 112.1 | L15 V16 | L15-L19 WeakPolarHBondContact O-CB 3.48Å; L15-L19 VanDerWaalsContact O-CG 3.24Å; L15-L19 WeakPolarHBondContact O-CG 3.41Å; L15-L19 PolarHBondContact O-N 3.01Å; V16-L19 PolarHBondContact O-N 3.37Å |
| 20 | C | 74.7 | Confident | 82 | Confident | 85 Ų | 85 | 79.8 Ų | 79.8 | 57% | 0.574 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -75.6 | -28.1 | 173.9 | -68 | 0 | 0 | 0 | 0 | 113.2 | V16 A17 L18 | V16-C20 WeakPolarHBondContact O-CB 3.43Å; V16-C20 PolarHBondContact O-N 3.44Å; V16-C20 PolarHBondContact O-SG 3.19Å; A17-C20 PolarHBondContact O-N 2.95Å; L18-C20 VanDerWaalsContact C-N 3.26Å; L18-C20 PolarHBondContact O-N 3.36Å |
| 21 | A | 72.9 | Confident | 82.4 | Confident | 45 Ų | 45 | 77.6 Ų | 77.6 | 37% | 0.372 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -70.9 | -37.4 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | A17 L18 G23 A24 Q25 | A17-A21 WeakPolarHBondContact O-CB 3.36Å; A17-A21 PolarHBondContact O-N 3.22Å; L18-A21 PolarHBondContact O-N 3.37Å; L18-A21 VanDerWaalsContact O-N 3.11Å; A21-G23 VanDerWaalsContact C-N 3.32Å; A21-G23 PolarHBondContact O-N 3.25Å; A21-A24 PolarHBondContact O-N 3.24Å; A21-Q25 PolarHBondContact O-N 2.96Å |
| 22 | E | 63.8 | Low | 82.8 | Confident | 130 Ų | 130 | 75.3 Ų | 75.3 | 61% | 0.607 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -54.2 | -48.5 | 176.8 | -161.2 | 77.1 | -126.5 | 0 | 0 | 111.2 | L18 A24 Q25 | L18-E22 PolarHBondContact O-N 3.04Å; E22-A24 PolarHBondContact O-N 3.11Å; E22-Q25 PolarHBondContact O-N 2.93Å |
| 23 | G | 62.7 | Low | 83.1 | Confident | 66 Ų | 66 | 75.6 Ų | 75.6 | 68% | 0.68 | 44% | 0.442 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.6 | -12.9 | 178.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | A21 | A21-G23 VanDerWaalsContact C-N 3.32Å; A21-G23 PolarHBondContact O-N 3.25Å |
| 24 | A | 64.5 | Low | 83.2 | Confident | 82 Ų | 82 | 72.5 Ų | 72.5 | 68% | 0.678 | 44% | 0.437 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.5 | -17 | 179 | 0 | 0 | 0 | 0 | 0 | 113 | A21 E22 G26 | A21-A24 PolarHBondContact O-N 3.24Å; E22-A24 PolarHBondContact O-N 3.11Å; A24-G26 PolarHBondContact O-N 3.2Å |
| 25 | Q | 71.7 | Confident | 83.4 | Confident | 133 Ų | 133 | 68.7 Ų | 68.7 | 62% | 0.621 | 42% | 0.418 | S | S | * | . | S | Bend | trans | -77.7 | 100.7 | 170.5 | -65.2 | -175.2 | 94.3 | 0 | 0 | 105.9 | A21 E22 | A21-Q25 PolarHBondContact O-N 2.96Å; E22-Q25 PolarHBondContact O-N 2.93Å |
| 26 | G | 84.6 | Confident | 83.6 | Confident | 17 Ų | 17 | 67.8 Ų | 67.8 | 18% | 0.175 | 42% | 0.417 | C | S | . | . | P | Polyproline II helix | trans | -51.2 | 154.2 | -176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | A24 E28 T45 | A24-G26 PolarHBondContact O-N 3.2Å; G26-E28 PolarHBondContact O-N 3.41Å; G26-T45 WeakPolarHBondContact O-CG2 3.38Å |
| 27 | L | 91.2 | Very high | 83.8 | Confident | 14 Ų | 14 | 65 Ų | 65 | 7% | 0.073 | 40% | 0.4 | C | S | . | . | P | Polyproline II helix | trans | -47.3 | 124.9 | -178.1 | -175.4 | 68.4 | 0 | 0 | 0 | 112.3 | C46 G51 E101 D102 | L27-C46 HydrophobicContact CB-CB 4.4Å; L27-C46 VanDerWaalsContact O-CB 3.23Å; L27-C46 WeakPolarHBondContact O-CB 3.48Å; L27-C46 PolarHBondContact O-N 3.45Å; L27-C46 PolarHBondContact O-SG 3.38Å; L27-G51 WeakPolarHBondContact CD2-O 2.92Å; L27-E101 VanDerWaalsContact CD1-C 3.46Å; L27-D102 WeakPolarHBondContact CA-OD1 3.23Å |
| 28 | E | 93.4 | Very high | 84 | Confident | 63 Ų | 63 | 70.1 Ų | 70.1 | 29% | 0.294 | 41% | 0.414 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.3 | 131.5 | 172.6 | -161.2 | -176.2 | -177.3 | 0 | 0 | 110.4 | G26 T43 M44 D102 L103 | G26-E28 PolarHBondContact O-N 3.41Å; E28-T43 WeakPolarHBondContact OE1-CB 3.01Å; E28-T43 PolarHBondContact OE1-OG1 3.23Å; E28-M44 WeakPolarHBondContact CA-O 3.28Å; E28-D102 HydrophobicContact CB-CB 4.38Å; E28-D102 PolarHBondContact N-OD1 3.42Å; E28-D102 CarbonylContact O-C 3.55Å; E28-D102 WeakPolarHBondContact O-CA 3.42Å; E28-L103 HydrophobicContact CB-CD2 4.09Å; E28-L103 HydrophobicContact CB-CG 4.5Å; E28-L103 HydrophobicContact CG-CD2 3.7Å; E28-L103 HydrophobicContact CG-CG 4.49Å; E28-L103 PolarHBondContact O-N 3.22Å |
| 29 | C | 95.2 | Very high | 84.4 | Confident | 0 Ų | 0 | 67.1 Ų | 67.1 | 0% | 0 | 40% | 0.4 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.8 | 155.1 | 178.3 | -57.1 | 0 | 0 | 0 | 0 | 111.6 | T43 M44 C46 C53 | C29-T43 CarbonylContact O-C 3.55Å; C29-T43 WeakPolarHBondContact O-CA 3.11Å; C29-M44 PolarHBondContact N-O 2.8Å; C29-M44 PolarHBondContact O-N 3.25Å; C29-C46 PolarHBondContact SG-SG 2.87Å; C29-C53 HydrophobicContact CB-CB 3.76Å; C29-C53 WeakPolarHBondContact CB-SG 3.46Å; C29-C53 WeakPolarHBondContact SG-CA 3.41Å; C29-C53 WeakPolarHBondContact SG-CB 3.47Å; C29-C53 CovalentContact SG-SG 2.02Å; C29-C53 PolarHBondContact SG-SG 3.23Å |
| 30 | Y | 96.2 | Very high | 85.1 | Confident | 65 Ų | 65 | 66 Ų | 66 | 26% | 0.255 | 40% | 0.404 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -68.4 | 141.3 | 162.1 | -68.8 | -80.2 | 0 | 0 | 0 | 110.3 | C41 K42 T43 N72 L103 N105 A106 | Y30-C41 HydrophobicContact CD1-CB 4.49Å; Y30-C41 WeakPolarHBondContact CD1-O 3.08Å; Y30-K42 CarbonylContact C-O 3.57Å; Y30-T43 HydrophobicContact CD1-CG2 3.65Å; Y30-T43 HydrophobicContact CE1-CG2 3.44Å; Y30-T43 VanDerWaalsContact CE1-CG2 3.44Å; Y30-T43 HydrophobicContact CG-CG2 4.34Å; Y30-N72 VanDerWaalsContact O-CB 3.22Å; Y30-N72 WeakPolarHBondContact O-CB 3.4Å; Y30-L103 HydrophobicContact CD2-CB 4.37Å; Y30-L103 HydrophobicContact CD2-CD2 4.34Å; Y30-L103 HydrophobicContact CE2-CB 3.78Å; Y30-L103 HydrophobicContact CE2-CD2 4.1Å; Y30-L103 HydrophobicContact CE2-CG 4.43Å; Y30-N105 WeakPolarHBondContact CB-OD1 3.24Å; Y30-N105 WeakPolarHBondContact CD2-OD1 2.94Å; Y30-N105 PolarHBondContact N-OD1 3.47Å; Y30-N105 PolarHBondContact O-ND2 3.44Å; Y30-A106 HydrophobicContact CD2-CB 4Å; Y30-A106 HydrophobicContact CE2-CB 3.42Å; Y30-A106 VanDerWaalsContact CE2-CB 3.42Å |
| 31 | C | 94.9 | Very high | 86 | Confident | 28 Ų | 28 | 62.8 Ų | 62.8 | 19% | 0.189 | 38% | 0.382 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -138 | 127.8 | -177.7 | -78.3 | 0 | 0 | 0 | 0 | 113.1 | K42 M44 N72 | C31-K42 PolarHBondContact N-O 2.75Å; C31-K42 PolarHBondContact O-N 3.29Å; C31-M44 HydrophobicContact CB-CG 3.96Å; C31-M44 HydrophobicContact CB-SD 3.72Å; C31-M44 VanDerWaalsContact SG-CG 3.51Å; C31-M44 PolarHBondContact SG-SD 2.91Å; C31-N72 CarbonylContact C-O 3.56Å; C31-N72 VanDerWaalsContact CA-O 3.24Å; C31-N72 WeakPolarHBondContact CA-O 3.09Å |
| 32 | C | 95.8 | Very high | 87.1 | Confident | 24 Ų | 24 | 69 Ų | 69 | 16% | 0.162 | 40% | 0.401 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -169.6 | 159.7 | 179.2 | 51.3 | 0 | 0 | 0 | 0 | 109.4 | V35 C41 S71 N72 | C32-V35 HydrophobicContact CB-CG1 4.23Å; C32-V35 HydrophobicContact CB-CG2 3.96Å; C32-C41 HydrophobicContact CB-CB 3.58Å; C32-C41 WeakPolarHBondContact CB-SG 3.45Å; C32-C41 WeakPolarHBondContact SG-CB 3Å; C32-C41 CovalentContact SG-SG 2.02Å; C32-C41 PolarHBondContact SG-SG 3.34Å; C32-S71 CarbonylContact O-C 3.57Å; C32-S71 VanDerWaalsContact O-CA 3.31Å; C32-S71 WeakPolarHBondContact O-CA 3.29Å; C32-N72 PolarHBondContact N-O 2.85Å; C32-N72 PolarHBondContact O-N 3.47Å |
| 33 | L | 93.6 | Very high | 88.6 | Confident | 133 Ų | 133 | 65.2 Ų | 65.2 | 70% | 0.696 | 39% | 0.387 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -132 | 124.8 | -176.8 | -171.1 | 74 | 0 | 0 | 0 | 110.7 | V35 L73 | L33-V35 PolarHBondContact O-N 2.79Å; L33-L73 HydrophobicContact CD1-CD2 4.41Å |
| 34 | G | 90.1 | Very high | 90.1 | Very high | 42 Ų | 42 | 66.6 Ų | 66.6 | 43% | 0.433 | 38% | 0.377 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 56.5 | 32.4 | 171.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | K70 S71 | G34-K70 WeakPolarHBondContact CA-O 3.31Å; G34-K70 PolarHBondContact N-O 2.77Å; G34-K70 VanDerWaalsContact N-O 3.11Å; G34-S71 PolarHBondContact N-OG 3.46Å |
| 35 | V | 91.9 | Very high | 91.5 | Very high | 31 Ų | 31 | 67 Ų | 67 | 19% | 0.188 | 37% | 0.371 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.1 | 154.2 | -178.8 | -60.5 | 0 | 0 | 0 | 0 | 110.6 | C32 L33 T39 V69 K70 | C32-V35 HydrophobicContact CB-CG1 4.23Å; C32-V35 HydrophobicContact CB-CG2 3.96Å; L33-V35 PolarHBondContact O-N 2.79Å; V35-T39 HydrophobicContact CB-CG2 3.96Å; V35-T39 HydrophobicContact CG1-CG2 4.35Å; V35-T39 HydrophobicContact CG2-CG2 4.12Å; V35-V69 CarbonylContact O-C 3.48Å; V35-V69 VanDerWaalsContact O-CA 3.24Å; V35-V69 WeakPolarHBondContact O-CA 3.24Å; V35-K70 HydrophobicContact CG2-CG 3.98Å; V35-K70 PolarHBondContact N-O 2.91Å; V35-K70 PolarHBondContact O-N 2.94Å |
| 36 | P | 90.5 | Very high | 92.5 | Very high | 69 Ų | 69 | 61 Ų | 61 | 45% | 0.448 | 34% | 0.343 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -52.7 | 145.9 | 171.1 | -25.7 | 33.9 | 0 | 0 | 0 | 112 | E38 T39 | P36-E38 PolarHBondContact O-N 2.83Å; P36-E38 VanDerWaalsContact O-N 3.08Å; P36-T39 WeakPolarHBondContact CD-OG1 3.38Å; P36-T39 WeakPolarHBondContact O-CB 3.45Å; P36-T39 PolarHBondContact O-N 3.49Å; P36-T39 PolarHBondContact O-OG1 3.06Å |
| 37 | L | 89.1 | Confident | 92.7 | Very high | 27 Ų | 27 | 65 Ų | 65 | 14% | 0.141 | 37% | 0.366 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -50.9 | -37.7 | -176.9 | -75.2 | 175.9 | 0 | 0 | 0 | 114.4 | T39 E57 K68 K70 | L37-T39 PolarHBondContact O-N 2.03Å; L37-E57 HydrophobicContact CD2-CG 3.89Å; L37-K68 HydrophobicContact CD1-CB 3.39Å; L37-K68 HydrophobicContact CD1-CD 3.8Å; L37-K68 HydrophobicContact CD1-CG 4.25Å; L37-K68 HydrophobicContact CG-CB 3.81Å; L37-K68 PolarHBondContact N-O 2.89Å; L37-K70 HydrophobicContact CD2-CB 3.89Å; L37-K70 HydrophobicContact CD2-CD 4.27Å; L37-K70 HydrophobicContact CD2-CG 4.28Å; L37-K70 WeakPolarHBondContact O-CE 3.22Å; L37-K70 PolarHBondContact O-NZ 3.05Å |
| 38 | E | 87.5 | Confident | 92.3 | Very high | 164 Ų | 164 | 69.9 Ų | 69.9 | 77% | 0.766 | 39% | 0.385 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.7 | -9.1 | -179.2 | -56.8 | -52.8 | 138.9 | 0 | 0 | 113.7 | P36 S40 | P36-E38 PolarHBondContact O-N 2.83Å; P36-E38 VanDerWaalsContact O-N 3.08Å; E38-S40 PolarHBondContact O-N 2.02Å |
| 39 | T | 90.7 | Very high | 91.4 | Very high | 55 Ų | 55 | 70.7 Ų | 70.7 | 34% | 0.337 | 40% | 0.397 | S | S | . | . | P | Polyproline II helix | trans | -73.3 | 127.2 | -178.5 | -59.1 | 0 | 0 | 0 | 0 | 109.9 | V35 P36 L37 K70 | V35-T39 HydrophobicContact CB-CG2 3.96Å; V35-T39 HydrophobicContact CG1-CG2 4.35Å; V35-T39 HydrophobicContact CG2-CG2 4.12Å; P36-T39 WeakPolarHBondContact CD-OG1 3.38Å; P36-T39 WeakPolarHBondContact O-CB 3.45Å; P36-T39 PolarHBondContact O-N 3.49Å; P36-T39 PolarHBondContact O-OG1 3.06Å; L37-T39 PolarHBondContact O-N 2.03Å; T39-K70 WeakPolarHBondContact O-CE 3.42Å; T39-K70 PolarHBondContact O-NZ 3.18Å |
| 40 | S | 91.9 | Very high | 90.5 | Very high | 112 Ų | 112 | 77.2 Ų | 77.2 | 78% | 0.783 | 43% | 0.432 | S | S | * | . | P | Polyproline II helix | trans | -71.4 | 139 | 173.6 | -45.4 | 0 | 0 | 0 | 0 | 110.5 | E38 | E38-S40 PolarHBondContact O-N 2.02Š|
| 41 | C | 94.4 | Very high | 90.2 | Very high | 19 Ų | 19 | 74.2 Ų | 74.2 | 13% | 0.128 | 42% | 0.421 | C | S | . | . | P | Polyproline II helix | trans | -103.2 | 153.9 | 179.3 | -56.5 | 0 | 0 | 0 | 0 | 109.9 | Y30 C32 | Y30-C41 HydrophobicContact CD1-CB 4.49Å; Y30-C41 WeakPolarHBondContact CD1-O 3.08Å; C32-C41 HydrophobicContact CB-CB 3.58Å; C32-C41 WeakPolarHBondContact CB-SG 3.45Å; C32-C41 WeakPolarHBondContact SG-CB 3Å; C32-C41 CovalentContact SG-SG 2.02Å; C32-C41 PolarHBondContact SG-SG 3.34Å |
| 42 | K | 95.8 | Very high | 90.2 | Very high | 174 Ų | 174 | 74.9 Ų | 74.9 | 76% | 0.757 | 42% | 0.421 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -83.9 | 146.1 | 177.7 | -171.6 | 178.1 | 175.7 | -178.4 | 0 | 109.3 | Y30 C31 | Y30-K42 CarbonylContact C-O 3.57Å; C31-K42 PolarHBondContact N-O 2.75Å; C31-K42 PolarHBondContact O-N 3.29Å |
| 43 | T | 95.1 | Very high | 90.1 | Very high | 52 Ų | 52 | 73.7 Ų | 73.7 | 32% | 0.319 | 41% | 0.413 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.7 | 151.2 | 173.6 | 69.7 | 0 | 0 | 0 | 0 | 111.5 | E28 C29 Y30 L103 | E28-T43 WeakPolarHBondContact OE1-CB 3.01Å; E28-T43 PolarHBondContact OE1-OG1 3.23Å; C29-T43 CarbonylContact O-C 3.55Å; C29-T43 WeakPolarHBondContact O-CA 3.11Å; Y30-T43 HydrophobicContact CD1-CG2 3.65Å; Y30-T43 HydrophobicContact CE1-CG2 3.44Å; Y30-T43 VanDerWaalsContact CE1-CG2 3.44Å; Y30-T43 HydrophobicContact CG-CG2 4.34Å; T43-L103 HydrophobicContact CG2-CD2 3.48Å; T43-L103 VanDerWaalsContact CG2-CD2 3.48Å |
| 44 | M | 93.2 | Very high | 90.2 | Very high | 95 Ų | 95 | 67.4 Ų | 67.4 | 47% | 0.468 | 38% | 0.38 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -151.7 | 149.9 | 168.5 | 71.3 | -178.3 | -55.1 | 0 | 0 | 111.7 | E28 C29 C31 | E28-M44 WeakPolarHBondContact CA-O 3.28Å; C29-M44 PolarHBondContact N-O 2.8Å; C29-M44 PolarHBondContact O-N 3.25Å; C31-M44 HydrophobicContact CB-CG 3.96Å; C31-M44 HydrophobicContact CB-SD 3.72Å; C31-M44 VanDerWaalsContact SG-CG 3.51Å; C31-M44 PolarHBondContact SG-SD 2.91Å |
| 45 | T | 93.8 | Very high | 90.4 | Very high | 89 Ų | 89 | 65.8 Ų | 65.8 | 55% | 0.546 | 36% | 0.362 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.8 | 123.5 | 168 | -51.2 | 0 | 0 | 0 | 0 | 109.7 | G26 | G26-T45 WeakPolarHBondContact O-CG2 3.38Å |
| 46 | C | 93.2 | Very high | 90.3 | Very high | 7 Ų | 7 | 65.6 Ų | 65.6 | 5% | 0.047 | 36% | 0.359 | C | S | . | . | trans | -68.5 | 144.2 | 177.6 | -61.6 | 0 | 0 | 0 | 0 | 111 | L27 C29 Y48 C74 | L27-C46 HydrophobicContact CB-CB 4.4Å; L27-C46 VanDerWaalsContact O-CB 3.23Å; L27-C46 WeakPolarHBondContact O-CB 3.48Å; L27-C46 PolarHBondContact O-N 3.45Å; L27-C46 PolarHBondContact O-SG 3.38Å; C29-C46 PolarHBondContact SG-SG 2.87Å; C46-Y48 PolarHBondContact O-N 2.74Å; C46-C74 WeakPolarHBondContact CA-SG 3.41Å; C46-C74 HydrophobicContact CB-CB 3.66Å; C46-C74 WeakPolarHBondContact CB-SG 3.34Å; C46-C74 WeakPolarHBondContact SG-CB 3.01Å; C46-C74 CovalentContact SG-SG 2.03Å; C46-C74 PolarHBondContact SG-SG 3.34Å | ||
| 47 | P | 89.2 | Confident | 90.2 | Very high | 102 Ų | 102 | 63.6 Ų | 63.6 | 66% | 0.662 | 34% | 0.344 | S | S | * | . | S | Bend | trans | -72.2 | -8.2 | 177.1 | 29.9 | -34.9 | 0 | 0 | 0 | 113.4 | ||
| 48 | Y | 83.4 | Confident | 90.1 | Very high | 117 Ų | 117 | 65.3 Ų | 65.3 | 46% | 0.459 | 35% | 0.351 | S | S | . | . | trans | -116.7 | 116.8 | -178 | -45.9 | -69 | 0 | 0 | 0 | 109.1 | C46 D50 G51 P76 | C46-Y48 PolarHBondContact O-N 2.74Å; Y48-D50 VanDerWaalsContact C-N 3.32Å; Y48-D50 PolarHBondContact O-N 2.78Å; Y48-G51 PolarHBondContact O-N 3.47Å; Y48-P76 HydrophobicContact CD1-CB 4.37Å; Y48-P76 HydrophobicContact CD2-CB 4.04Å; Y48-P76 HydrophobicContact CD2-CG 4.48Å; Y48-P76 HydrophobicContact CE2-CB 4.23Å; Y48-P76 HydrophobicContact CE2-CG 4.22Å; Y48-P76 HydrophobicContact CG-CB 4.11Å | ||
| 49 | S | 74 | Confident | 90 | Very high | 80 Ų | 80 | 61.6 Ų | 61.6 | 56% | 0.559 | 33% | 0.333 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.1 | -37.9 | 178.9 | 54.2 | 0 | 0 | 0 | 0 | 112.5 | G51 | S49-G51 VanDerWaalsContact C-N 3.27Å; S49-G51 PolarHBondContact O-N 3.43Å |
| 50 | D | 76.2 | Confident | 89.3 | Confident | 136 Ų | 136 | 61.6 Ų | 61.6 | 73% | 0.727 | 33% | 0.333 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93 | 21.7 | 178.1 | -60 | -30.9 | 0 | 0 | 0 | 112.8 | Y48 | Y48-D50 VanDerWaalsContact C-N 3.32Å; Y48-D50 PolarHBondContact O-N 2.78Å |
| 51 | G | 89.4 | Confident | 88.5 | Confident | 2 Ų | 2 | 61.3 Ų | 61.3 | 2% | 0.021 | 32% | 0.322 | C | S | . | . | trans | -70.8 | -175.9 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | L27 Y48 S49 L75 | L27-G51 WeakPolarHBondContact CD2-O 2.92Å; Y48-G51 PolarHBondContact O-N 3.47Å; S49-G51 VanDerWaalsContact C-N 3.27Å; S49-G51 PolarHBondContact O-N 3.43Å; G51-L75 CarbonylContact C-O 3.54Å; G51-L75 WeakPolarHBondContact CA-O 3.16Å | ||
| 52 | F | 94.8 | Very high | 87.6 | Confident | 42 Ų | 42 | 63.7 Ų | 63.7 | 18% | 0.184 | 34% | 0.335 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.9 | 137.5 | 173.9 | -64.9 | -101.3 | 0 | 0 | 0 | 109 | V54 L75 C78 C98 C99 K100 | F52-V54 HydrophobicContact CB-CG2 3.86Å; F52-V54 PolarHBondContact O-N 2.02Å; F52-L75 PolarHBondContact N-O 2.84Å; F52-L75 PolarHBondContact O-N 2.84Å; F52-C78 HydrophobicContact CD1-CB 3.98Å; F52-C78 HydrophobicContact CE1-CB 3.93Å; F52-C78 HydrophobicContact CG-CB 4.23Å; F52-C78 HydrophobicContact CZ-CB 4.2Å; F52-C98 HydrophobicContact CB-CB 4.47Å; F52-C98 HydrophobicContact CD1-CB 3.9Å; F52-C99 WeakPolarHBondContact CA-O 3Å; F52-K100 HydrophobicContact CD1-CD 4.37Å; F52-K100 HydrophobicContact CD1-CG 3.74Å; F52-K100 HydrophobicContact CE1-CD 4.07Å; F52-K100 HydrophobicContact CE1-CG 3.9Å; F52-K100 HydrophobicContact CG-CG 4.4Å; F52-K100 HydrophobicContact CZ-CD 4.42Å |
| 53 | C | 95.3 | Very high | 86.7 | Confident | 0 Ų | 0 | 62.1 Ų | 62.1 | 0% | 0 | 34% | 0.336 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.6 | 119.4 | 156.3 | -56.1 | 0 | 0 | 0 | 0 | 107.4 | C29 C98 C99 C104 N105 | C29-C53 HydrophobicContact CB-CB 3.76Å; C29-C53 WeakPolarHBondContact CB-SG 3.46Å; C29-C53 WeakPolarHBondContact SG-CA 3.41Å; C29-C53 WeakPolarHBondContact SG-CB 3.47Å; C29-C53 CovalentContact SG-SG 2.02Å; C29-C53 PolarHBondContact SG-SG 3.23Å; C53-C98 WeakPolarHBondContact O-CA 3.22Å; C53-C99 PolarHBondContact N-O 3.17Å; C53-C99 PolarHBondContact O-N 3.42Å; C53-C104 VanDerWaalsContact CB-SG 3.58Å; C53-N105 HydrophobicContact CB-CB 3.77Å |
| 54 | V | 94.5 | Very high | 85.8 | Confident | 0 Ų | 0 | 65 Ų | 65 | 0% | 0 | 36% | 0.358 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.8 | 137 | -177.9 | -178.9 | 0 | 0 | 0 | 0 | 109.4 | F52 Q56 N72 L73 L75 P79 T96 F97 | F52-V54 HydrophobicContact CB-CG2 3.86Å; F52-V54 PolarHBondContact O-N 2.02Å; V54-Q56 HydrophobicContact CG1-CG 4.24Å; V54-N72 CarbonylContact O-C 3.5Å; V54-N72 VanDerWaalsContact O-CA 3.24Å; V54-N72 WeakPolarHBondContact O-CA 2.95Å; V54-L73 PolarHBondContact N-O 3.27Å; V54-L73 PolarHBondContact O-N 2.96Å; V54-L75 HydrophobicContact CB-CD1 4.24Å; V54-L75 HydrophobicContact CG1-CD1 4.3Å; V54-L75 HydrophobicContact CG2-CB 3.99Å; V54-L75 HydrophobicContact CG2-CD1 4Å; V54-L75 HydrophobicContact CG2-CG 4.25Å; V54-P79 HydrophobicContact CG1-CG 4.19Å; V54-T96 HydrophobicContact CG1-CG2 3.95Å; V54-F97 CarbonylContact C-O 3.58Å; V54-F97 VanDerWaalsContact CA-O 3.31Å; V54-F97 WeakPolarHBondContact CA-O 3.4Å |
| 55 | T | 93.7 | Very high | 85.2 | Confident | 9 Ų | 9 | 67 Ų | 67 | 6% | 0.055 | 37% | 0.366 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.9 | 125.6 | 168.6 | -61.2 | 0 | 0 | 0 | 0 | 108.1 | E57 S71 N72 T96 F97 N105 | T55-E57 HydrophobicContact CG2-CG 4.3Å; T55-S71 CarbonylContact C-O 3.58Å; T55-S71 WeakPolarHBondContact CA-O 3.46Å; T55-N72 WeakPolarHBondContact CG2-OD1 3.38Å; T55-N72 PolarHBondContact OG1-OD1 2.92Å; T55-T96 CarbonylContact O-C 3.47Å; T55-T96 WeakPolarHBondContact O-CA 3.5Å; T55-F97 PolarHBondContact N-O 2.72Å; T55-F97 PolarHBondContact O-N 2.86Å; T55-N105 WeakPolarHBondContact OG1-CB 3.38Å |
| 56 | Q | 90.6 | Very high | 84.6 | Confident | 27 Ų | 27 | 66.4 Ų | 66.4 | 13% | 0.126 | 36% | 0.362 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115 | 128.3 | 170.2 | -72.5 | 176.9 | -10.9 | 0 | 0 | 108.8 | V54 K70 S71 N81 V94 K95 T96 | V54-Q56 HydrophobicContact CG1-CG 4.24Å; Q56-K70 CarbonylContact O-C 3.56Å; Q56-K70 WeakPolarHBondContact O-CA 3.43Å; Q56-S71 PolarHBondContact N-O 2.02Å; Q56-S71 PolarHBondContact O-N 3.01Å; Q56-N81 PolarHBondContact NE2-ND2 2.85Å; Q56-V94 HydrophobicContact CB-CG1 4.48Å; Q56-K95 CarbonylContact C-O 3.58Å; Q56-K95 VanDerWaalsContact CA-O 3.3Å; Q56-K95 WeakPolarHBondContact CA-O 3.17Å; Q56-T96 HydrophobicContact CG-CG2 4.21Å |
| 57 | E | 89.3 | Confident | 84.1 | Confident | 27 Ų | 27 | 69.5 Ų | 69.5 | 13% | 0.126 | 38% | 0.377 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.5 | 132.3 | 172.2 | -64.2 | -173 | 176.1 | 0 | 0 | 109.6 | L37 T55 V69 K70 V94 K95 L109 | L37-E57 HydrophobicContact CD2-CG 3.89Å; T55-E57 HydrophobicContact CG2-CG 4.3Å; E57-V69 WeakPolarHBondContact CA-O 3.24Å; E57-K70 HydrophobicContact CG-CB 4.32Å; E57-V94 WeakPolarHBondContact O-CA 3.11Å; E57-K95 PolarHBondContact N-O 3.43Å; E57-K95 PolarHBondContact O-N 3.04Å; E57-L109 HydrophobicContact CG-CD1 4.42Å; E57-L109 WeakPolarHBondContact OE1-CD1 3.37Å |
| 58 | E | 86 | Confident | 84.1 | Confident | 62 Ų | 62 | 70 Ų | 70 | 29% | 0.29 | 37% | 0.369 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.1 | 145.3 | -176.6 | -51.9 | -177.7 | 172.9 | 0 | 0 | 109.9 | K68 V69 V92 V94 | E58-K68 WeakPolarHBondContact O-CA 3.46Å; E58-V69 HydrophobicContact CB-CG2 3.88Å; E58-V69 PolarHBondContact N-O 2.82Å; E58-V69 PolarHBondContact O-N 2.95Å; E58-V92 HydrophobicContact CB-CG1 4.12Å; E58-V94 HydrophobicContact CG-CG1 4.18Å; E58-V94 HydrophobicContact CG-CG2 4.1Å |
| 59 | E | 84.5 | Confident | 84.4 | Confident | 86 Ų | 86 | 65.3 Ų | 65.3 | 40% | 0.402 | 35% | 0.353 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.8 | 113.3 | 174.5 | -170.1 | 170.9 | 148.4 | 0 | 0 | 109.7 | T66 K68 | E59-T66 HydrophobicContact CG-CG2 3.25Å; E59-T66 WeakPolarHBondContact OE1-CG2 3.03Å; E59-K68 HydrophobicContact CG-CG 4.47Å |
| 60 | V | 76.2 | Confident | 85.2 | Confident | 55 Ų | 55 | 62.3 Ų | 62.3 | 33% | 0.333 | 33% | 0.33 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.8 | 132.1 | -177 | -173.7 | 0 | 0 | 0 | 0 | 109.3 | V62 I67 V69 | V60-V62 HydrophobicContact CG1-CG2 4.09Å; V60-I67 PolarHBondContact N-O 2.95Å; V60-I67 PolarHBondContact O-N 3.05Å; V60-V69 HydrophobicContact CG2-CG2 3.91Å |
| 61 | I | 76.6 | Confident | 86 | Confident | 107 Ų | 107 | 56.2 Ų | 56.2 | 55% | 0.549 | 30% | 0.297 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.7 | 116.1 | 177.1 | -53.1 | 176.1 | 0 | 0 | 0 | 108.7 | ||
| 62 | V | 74.4 | Confident | 86.3 | Confident | 68 Ų | 68 | 56.4 Ų | 56.4 | 41% | 0.412 | 30% | 0.298 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.2 | 120.4 | 176.1 | -176.6 | 0 | 0 | 0 | 0 | 108.4 | V60 S64 H65 I67 | V60-V62 HydrophobicContact CG1-CG2 4.09Å; V62-S64 VanDerWaalsContact C-N 3.3Å; V62-S64 PolarHBondContact O-N 2.01Å; V62-H65 PolarHBondContact N-O 3.17Å; V62-H65 WeakPolarHBondContact O-CA 3.19Å; V62-H65 WeakPolarHBondContact O-CB 3.31Å; V62-H65 PolarHBondContact O-N 2.96Å; V62-H65 VanDerWaalsContact O-O 3.12Å; V62-I67 HydrophobicContact CB-CD1 4Å; V62-I67 HydrophobicContact CG2-CD1 4.09Å |
| 63 | D | 77.5 | Confident | 86.3 | Confident | 142 Ų | 142 | 56.7 Ų | 56.7 | 76% | 0.759 | 30% | 0.301 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48.6 | 47.9 | 178.5 | -62.9 | -26.3 | 0 | 0 | 0 | 113.6 | H65 | D63-H65 PolarHBondContact O-N 2.96Å; D63-H65 VanDerWaalsContact O-N 3.11Å |
| 64 | S | 76.1 | Confident | 86.3 | Confident | 113 Ų | 113 | 57.7 Ų | 57.7 | 79% | 0.79 | 31% | 0.308 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 63.4 | 3.6 | -175.4 | 49 | 0 | 0 | 0 | 0 | 116.5 | V62 | V62-S64 VanDerWaalsContact C-N 3.3Å; V62-S64 PolarHBondContact O-N 2.01Å |
| 65 | H | 81 | Confident | 86.3 | Confident | 136 Ų | 136 | 60 Ų | 60 | 63% | 0.63 | 32% | 0.32 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -97.1 | 128.3 | 168 | -62 | 139.4 | 0 | 0 | 0 | 110.7 | V62 D63 I67 | V62-H65 PolarHBondContact N-O 3.17Å; V62-H65 WeakPolarHBondContact O-CA 3.19Å; V62-H65 WeakPolarHBondContact O-CB 3.31Å; V62-H65 PolarHBondContact O-N 2.96Å; V62-H65 VanDerWaalsContact O-O 3.12Å; D63-H65 PolarHBondContact O-N 2.96Å; D63-H65 VanDerWaalsContact O-N 3.11Å; H65-I67 PolarHBondContact O-N 3.27Å |
| 66 | T | 80 | Confident | 86.3 | Confident | 77 Ų | 77 | 62.7 Ų | 62.7 | 47% | 0.472 | 34% | 0.337 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.3 | 120.5 | 168.2 | -68.9 | 0 | 0 | 0 | 0 | 109.5 | E59 | E59-T66 HydrophobicContact CG-CG2 3.25Å; E59-T66 WeakPolarHBondContact OE1-CG2 3.03Å |
| 67 | I | 84 | Confident | 86.3 | Confident | 71 Ų | 71 | 67 Ų | 67 | 36% | 0.364 | 36% | 0.361 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.9 | 126.9 | 173.6 | -54.5 | 176.2 | 0 | 0 | 0 | 107.9 | V60 V62 H65 V69 | V60-I67 PolarHBondContact N-O 2.95Å; V60-I67 PolarHBondContact O-N 3.05Å; V62-I67 HydrophobicContact CB-CD1 4Å; V62-I67 HydrophobicContact CG2-CD1 4.09Å; H65-I67 PolarHBondContact O-N 3.27Å; I67-V69 HydrophobicContact CG2-CG1 4.22Å |
| 68 | K | 87.8 | Confident | 86.5 | Confident | 112 Ų | 112 | 68.2 Ų | 68.2 | 49% | 0.487 | 37% | 0.371 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90 | 127.1 | 171.2 | -64.6 | -175.7 | 177.8 | -175.5 | 0 | 109.8 | L37 E58 E59 | L37-K68 HydrophobicContact CD1-CB 3.39Å; L37-K68 HydrophobicContact CD1-CD 3.8Å; L37-K68 HydrophobicContact CD1-CG 4.25Å; L37-K68 HydrophobicContact CG-CB 3.81Å; L37-K68 PolarHBondContact N-O 2.89Å; E58-K68 WeakPolarHBondContact O-CA 3.46Å; E59-K68 HydrophobicContact CG-CG 4.47Å |
| 69 | V | 90.1 | Very high | 86.6 | Confident | 20 Ų | 20 | 66.5 Ų | 66.5 | 12% | 0.121 | 37% | 0.366 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.3 | 155.5 | 177.3 | -60.3 | 0 | 0 | 0 | 0 | 109.9 | V35 E57 E58 V60 I67 | V35-V69 CarbonylContact O-C 3.48Å; V35-V69 VanDerWaalsContact O-CA 3.24Å; V35-V69 WeakPolarHBondContact O-CA 3.24Å; E57-V69 WeakPolarHBondContact CA-O 3.24Å; E58-V69 HydrophobicContact CB-CG2 3.88Å; E58-V69 PolarHBondContact N-O 2.82Å; E58-V69 PolarHBondContact O-N 2.95Å; V60-V69 HydrophobicContact CG2-CG2 3.91Å; I67-V69 HydrophobicContact CG2-CG1 4.22Å |
| 70 | K | 91.4 | Very high | 86.3 | Confident | 17 Ų | 17 | 69 Ų | 69 | 7% | 0.074 | 39% | 0.387 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.8 | 153.8 | 171.8 | 63.3 | 179.5 | -174.4 | -167.9 | 0 | 112.3 | G34 V35 L37 T39 Q56 E57 | G34-K70 WeakPolarHBondContact CA-O 3.31Å; G34-K70 PolarHBondContact N-O 2.77Å; G34-K70 VanDerWaalsContact N-O 3.11Å; V35-K70 HydrophobicContact CG2-CG 3.98Å; V35-K70 PolarHBondContact N-O 2.91Å; V35-K70 PolarHBondContact O-N 2.94Å; L37-K70 HydrophobicContact CD2-CB 3.89Å; L37-K70 HydrophobicContact CD2-CD 4.27Å; L37-K70 HydrophobicContact CD2-CG 4.28Å; L37-K70 WeakPolarHBondContact O-CE 3.22Å; L37-K70 PolarHBondContact O-NZ 3.05Å; T39-K70 WeakPolarHBondContact O-CE 3.42Å; T39-K70 PolarHBondContact O-NZ 3.18Å; Q56-K70 CarbonylContact O-C 3.56Å; Q56-K70 WeakPolarHBondContact O-CA 3.43Å; E57-K70 HydrophobicContact CG-CB 4.32Å |
| 71 | S | 93.3 | Very high | 85.8 | Confident | 7 Ų | 7 | 69 Ų | 69 | 5% | 0.049 | 39% | 0.385 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.9 | 124.1 | 168.5 | -60.9 | 0 | 0 | 0 | 0 | 108.6 | C32 G34 T55 Q56 | C32-S71 CarbonylContact O-C 3.57Å; C32-S71 VanDerWaalsContact O-CA 3.31Å; C32-S71 WeakPolarHBondContact O-CA 3.29Å; G34-S71 PolarHBondContact N-OG 3.46Å; T55-S71 CarbonylContact C-O 3.58Å; T55-S71 WeakPolarHBondContact CA-O 3.46Å; Q56-S71 PolarHBondContact N-O 2.02Å; Q56-S71 PolarHBondContact O-N 3.01Å |
| 72 | N | 95.1 | Very high | 84.9 | Confident | 6 Ų | 6 | 67.9 Ų | 67.9 | 3% | 0.032 | 39% | 0.385 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.9 | 131.3 | 171.8 | -71.2 | 15.1 | 0 | 0 | 0 | 108.4 | Y30 C31 C32 V54 T55 N105 | Y30-N72 VanDerWaalsContact O-CB 3.22Å; Y30-N72 WeakPolarHBondContact O-CB 3.4Å; C31-N72 CarbonylContact C-O 3.56Å; C31-N72 VanDerWaalsContact CA-O 3.24Å; C31-N72 WeakPolarHBondContact CA-O 3.09Å; C32-N72 PolarHBondContact N-O 2.85Å; C32-N72 PolarHBondContact O-N 3.47Å; V54-N72 CarbonylContact O-C 3.5Å; V54-N72 VanDerWaalsContact O-CA 3.24Å; V54-N72 WeakPolarHBondContact O-CA 2.95Å; T55-N72 WeakPolarHBondContact CG2-OD1 3.38Å; T55-N72 PolarHBondContact OG1-OD1 2.92Å; N72-N105 PolarHBondContact ND2-O 3.39Å |
| 73 | L | 94.5 | Very high | 84.2 | Confident | 48 Ų | 48 | 71.5 Ų | 71.5 | 25% | 0.251 | 40% | 0.397 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -143.2 | 151.2 | -168.3 | -61.4 | 168.1 | 0 | 0 | 0 | 111.6 | L33 V54 L75 | L33-L73 HydrophobicContact CD1-CD2 4.41Å; V54-L73 PolarHBondContact N-O 3.27Å; V54-L73 PolarHBondContact O-N 2.96Å; L73-L75 HydrophobicContact CB-CG 4.21Å; L73-L75 HydrophobicContact CD1-CD1 4.5Å |
| 74 | C | 94.9 | Very high | 83.1 | Confident | 21 Ų | 21 | 68.6 Ų | 68.6 | 14% | 0.142 | 39% | 0.385 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.2 | 118.9 | 160.1 | -72.3 | 0 | 0 | 0 | 0 | 109.1 | C46 | C46-C74 WeakPolarHBondContact CA-SG 3.41Å; C46-C74 HydrophobicContact CB-CB 3.66Å; C46-C74 WeakPolarHBondContact CB-SG 3.34Å; C46-C74 WeakPolarHBondContact SG-CB 3.01Å; C46-C74 CovalentContact SG-SG 2.03Å; C46-C74 PolarHBondContact SG-SG 3.34Å |
| 75 | L | 94.6 | Very high | 82.3 | Confident | 50 Ų | 50 | 66 Ų | 66 | 26% | 0.262 | 36% | 0.364 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129 | 146.7 | 175.5 | -67.8 | 178.1 | 0 | 0 | 0 | 111.5 | G51 F52 V54 L73 I77 P79 | G51-L75 CarbonylContact C-O 3.54Å; G51-L75 WeakPolarHBondContact CA-O 3.16Å; F52-L75 PolarHBondContact N-O 2.84Å; F52-L75 PolarHBondContact O-N 2.84Å; V54-L75 HydrophobicContact CB-CD1 4.24Å; V54-L75 HydrophobicContact CG1-CD1 4.3Å; V54-L75 HydrophobicContact CG2-CB 3.99Å; V54-L75 HydrophobicContact CG2-CD1 4Å; V54-L75 HydrophobicContact CG2-CG 4.25Å; L73-L75 HydrophobicContact CB-CG 4.21Å; L73-L75 HydrophobicContact CD1-CD1 4.5Å; L75-I77 VanDerWaalsContact CB-O 3.29Å; L75-I77 WeakPolarHBondContact CB-O 3.35Å; L75-I77 PolarHBondContact O-N 3.4Å; L75-P79 HydrophobicContact CD1-CG 3.93Å |
| 76 | P | 93.5 | Very high | 81 | Confident | 64 Ų | 64 | 67.4 Ų | 67.4 | 42% | 0.416 | 37% | 0.371 | S | S | . | . | S | Bend | trans | -71.2 | -16.5 | 176.6 | 30.2 | -35 | 0 | 0 | 0 | 112.6 | Y48 | Y48-P76 HydrophobicContact CD1-CB 4.37Å; Y48-P76 HydrophobicContact CD2-CB 4.04Å; Y48-P76 HydrophobicContact CD2-CG 4.48Å; Y48-P76 HydrophobicContact CE2-CB 4.23Å; Y48-P76 HydrophobicContact CE2-CG 4.22Å; Y48-P76 HydrophobicContact CG-CB 4.11Å |
| 77 | I | 92.5 | Very high | 80 | Confident | 119 Ų | 119 | 70.4 Ų | 70.4 | 61% | 0.61 | 38% | 0.378 | S | S | * | . | S | Bend | trans | -137.3 | 151.8 | 179.6 | 60.3 | 173.7 | 0 | 0 | 0 | 109.5 | L75 P79 | L75-I77 VanDerWaalsContact CB-O 3.29Å; L75-I77 WeakPolarHBondContact CB-O 3.35Å; L75-I77 PolarHBondContact O-N 3.4Å; I77-P79 VanDerWaalsContact O-CD 3.31Å; I77-P79 WeakPolarHBondContact O-CD 3.31Å |
| 78 | C | 92.8 | Very high | 78.7 | Confident | 52 Ų | 52 | 74.7 Ų | 74.7 | 35% | 0.351 | 40% | 0.401 | S | S | . | . | trans | -80 | 113.6 | 167.6 | 178.6 | 0 | 0 | 0 | 0 | 109.4 | F52 T80 C98 | F52-C78 HydrophobicContact CD1-CB 3.98Å; F52-C78 HydrophobicContact CE1-CB 3.93Å; F52-C78 HydrophobicContact CG-CB 4.23Å; F52-C78 HydrophobicContact CZ-CB 4.2Å; C78-T80 PolarHBondContact O-N 2.91Å; C78-C98 WeakPolarHBondContact CA-SG 3.37Å; C78-C98 HydrophobicContact CB-CB 3.54Å; C78-C98 WeakPolarHBondContact CB-SG 3.3Å; C78-C98 WeakPolarHBondContact SG-CB 3.15Å; C78-C98 CovalentContact SG-SG 2.02Å; C78-C98 PolarHBondContact SG-SG 3.34Å | ||
| 79 | P | 87.2 | Confident | 77.2 | Confident | 26 Ų | 26 | 72.4 Ų | 72.4 | 17% | 0.169 | 41% | 0.409 | C | S | . | . | trans | -68.2 | 133.4 | -179.1 | 23.2 | -26.4 | 0 | 0 | 0 | 111 | V54 L75 I77 N81 T96 | V54-P79 HydrophobicContact CG1-CG 4.19Å; L75-P79 HydrophobicContact CD1-CG 3.93Å; I77-P79 VanDerWaalsContact O-CD 3.31Å; I77-P79 WeakPolarHBondContact O-CD 3.31Å; P79-N81 PolarHBondContact O-N 3.3Å; P79-T96 HydrophobicContact CG-CG2 3.99Å | ||
| 80 | T | 79.5 | Confident | 75.8 | Confident | 138 Ų | 138 | 76.2 Ų | 76.2 | 85% | 0.847 | 43% | 0.428 | S | S | * | . | trans | -93.6 | 82.1 | 168.2 | -48.7 | 0 | 0 | 0 | 0 | 107.5 | C78 | C78-T80 PolarHBondContact O-N 2.91Š| ||
| 81 | N | 64.9 | Low | 74.4 | Confident | 54 Ų | 54 | 79 Ų | 79 | 29% | 0.289 | 46% | 0.455 | S | S | . | . | trans | -72 | 141.1 | 172 | -64.6 | -13.2 | 0 | 0 | 0 | 108.2 | Q56 P79 E83 T96 | Q56-N81 PolarHBondContact NE2-ND2 2.85Å; P79-N81 PolarHBondContact O-N 3.3Å; N81-E83 PolarHBondContact O-N 2.82Å; N81-T96 PolarHBondContact ND2-OG1 3.44Å | ||
| 82 | P | 58.8 | Low | 73.3 | Confident | 85 Ų | 85 | 79.6 Ų | 79.6 | 55% | 0.552 | 46% | 0.458 | S | S | * | . | trans | -58.6 | 134.4 | 159.5 | 26.9 | -30.7 | 0 | 0 | 0 | 107.3 | T84 | P82-T84 CarbonylContact O-C 3.52Å; P82-T84 PolarHBondContact O-N 3.42Å | ||
| 83 | E | 58.7 | Low | 72.3 | Confident | 144 Ų | 144 | 82.4 Ų | 82.4 | 67% | 0.673 | 47% | 0.473 | S | S | * | . | S | Bend | trans | -52.5 | -21.6 | -178.6 | -69.9 | -162 | 167.2 | 0 | 0 | 112.6 | N81 N93 V94 | N81-E83 PolarHBondContact O-N 2.82Å; E83-N93 CarbonylContact O-C 3.57Å; E83-N93 VanDerWaalsContact O-CA 3.22Å; E83-N93 WeakPolarHBondContact O-CA 3.43Å; E83-V94 PolarHBondContact O-N 2.97Å |
| 84 | T | 55.3 | Low | 71.7 | Confident | 81 Ų | 81 | 80.6 Ų | 80.6 | 50% | 0.497 | 46% | 0.464 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.6 | 114.4 | 175.3 | -41.9 | 0 | 0 | 0 | 0 | 109.5 | P82 A91 V92 | P82-T84 CarbonylContact O-C 3.52Å; P82-T84 PolarHBondContact O-N 3.42Å; T84-A91 HydrophobicContact CG2-CB 3.46Å; T84-A91 VanDerWaalsContact CG2-CB 3.46Å; T84-V92 WeakPolarHBondContact CA-O 3.5Å |
| 85 | T | 58.7 | Low | 71.4 | Confident | 59 Ų | 59 | 84.9 Ų | 84.9 | 36% | 0.362 | 48% | 0.48 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.3 | 133.9 | 170.9 | -54.3 | 0 | 0 | 0 | 0 | 108.4 | F87 V92 | T85-F87 PolarHBondContact O-N 3.31Å; T85-V92 PolarHBondContact N-O 3.46Å; T85-V92 PolarHBondContact O-N 3.11Å |
| 86 | E | 54.6 | Low | 71.2 | Confident | 164 Ų | 164 | 84.3 Ų | 84.3 | 77% | 0.766 | 48% | 0.478 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -75.8 | 109.7 | 174.8 | -69.3 | -175.1 | 173.6 | 0 | 0 | 109.3 | N90 | E86-N90 WeakPolarHBondContact CA-O 3.49Å |
| 87 | F | 57.2 | Low | 71.1 | Confident | 141 Ų | 141 | 85.4 Ų | 85.4 | 62% | 0.618 | 48% | 0.477 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -111.5 | 118.8 | 170.6 | -168.3 | -98.6 | 0 | 0 | 0 | 108.5 | T85 G89 N90 V92 | T85-F87 PolarHBondContact O-N 3.31Å; F87-G89 PolarHBondContact O-N 3.45Å; F87-N90 PolarHBondContact N-O 3.5Å; F87-N90 PolarHBondContact O-N 3.32Å; F87-V92 HydrophobicContact CB-CG2 3.75Å |
| 88 | L | 57.1 | Low | 71.2 | Confident | 161 Ų | 161 | 81.6 Ų | 81.6 | 84% | 0.843 | 46% | 0.461 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54 | 32.6 | -177.4 | -67.5 | 164.3 | 0 | 0 | 0 | 114.2 | N90 | L88-N90 VanDerWaalsContact C-N 3.29Å; L88-N90 PolarHBondContact O-N 3.42Å |
| 89 | G | 55.9 | Low | 71.3 | Confident | 64 Ų | 64 | 81 Ų | 81 | 66% | 0.66 | 46% | 0.456 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 82.8 | -0.3 | 179.3 | 0 | 0 | 0 | 0 | 0 | 115 | F87 | F87-G89 PolarHBondContact O-N 3.45Š|
| 90 | N | 61.6 | Low | 71.5 | Confident | 100 Ų | 100 | 85.9 Ų | 85.9 | 54% | 0.535 | 48% | 0.475 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.4 | 136.4 | 172.6 | -72.8 | 11.5 | 0 | 0 | 0 | 110.2 | E86 F87 L88 V92 | E86-N90 WeakPolarHBondContact CA-O 3.49Å; F87-N90 PolarHBondContact N-O 3.5Å; F87-N90 PolarHBondContact O-N 3.32Å; L88-N90 VanDerWaalsContact C-N 3.29Å; L88-N90 PolarHBondContact O-N 3.42Å; N90-V92 PolarHBondContact O-N 3.48Å |
| 91 | A | 61.2 | Low | 72.1 | Confident | 76 Ų | 76 | 86.5 Ų | 86.5 | 63% | 0.628 | 47% | 0.468 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -64.9 | 110.5 | 169.8 | 0 | 0 | 0 | 0 | 0 | 109.4 | T84 | T84-A91 HydrophobicContact CG2-CB 3.46Å; T84-A91 VanDerWaalsContact CG2-CB 3.46Å |
| 92 | V | 70.2 | Confident | 73.4 | Confident | 18 Ų | 18 | 88.1 Ų | 88.1 | 11% | 0.109 | 48% | 0.477 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.2 | 123 | 173 | 179.8 | 0 | 0 | 0 | 0 | 108 | E58 T84 T85 F87 N90 V94 | E58-V92 HydrophobicContact CB-CG1 4.12Å; T84-V92 WeakPolarHBondContact CA-O 3.5Å; T85-V92 PolarHBondContact N-O 3.46Å; T85-V92 PolarHBondContact O-N 3.11Å; F87-V92 HydrophobicContact CB-CG2 3.75Å; N90-V92 PolarHBondContact O-N 3.48Å; V92-V94 HydrophobicContact CG1-CG2 4.05Å; V92-V94 PolarHBondContact O-N 2.78Å |
| 93 | N | 74.4 | Confident | 75 | Confident | 66 Ų | 66 | 86.6 Ų | 86.6 | 35% | 0.353 | 46% | 0.464 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.6 | 118.4 | 171.2 | -170 | -77.5 | 0 | 0 | 0 | 108.5 | E83 K95 | E83-N93 CarbonylContact O-C 3.57Å; E83-N93 VanDerWaalsContact O-CA 3.22Å; E83-N93 WeakPolarHBondContact O-CA 3.43Å; N93-K95 WeakPolarHBondContact OD1-CG 3.21Å |
| 94 | V | 82.5 | Confident | 76.7 | Confident | 10 Ų | 10 | 81.6 Ų | 81.6 | 6% | 0.061 | 45% | 0.445 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.8 | 110.7 | 178.8 | -175.6 | 0 | 0 | 0 | 0 | 108.4 | Q56 E57 E58 E83 V92 | Q56-V94 HydrophobicContact CB-CG1 4.48Å; E57-V94 WeakPolarHBondContact O-CA 3.11Å; E58-V94 HydrophobicContact CG-CG1 4.18Å; E58-V94 HydrophobicContact CG-CG2 4.1Å; E83-V94 PolarHBondContact O-N 2.97Å; V92-V94 HydrophobicContact CG1-CG2 4.05Å; V92-V94 PolarHBondContact O-N 2.78Å |
| 95 | K | 87.6 | Confident | 78.5 | Confident | 111 Ų | 111 | 78 Ų | 78 | 48% | 0.483 | 42% | 0.422 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.4 | 126.3 | 172.8 | -57.9 | -174.1 | 176.7 | -179.2 | 0 | 109.5 | Q56 E57 N93 F97 | Q56-K95 CarbonylContact C-O 3.58Å; Q56-K95 VanDerWaalsContact CA-O 3.3Å; Q56-K95 WeakPolarHBondContact CA-O 3.17Å; E57-K95 PolarHBondContact N-O 3.43Å; E57-K95 PolarHBondContact O-N 3.04Å; N93-K95 WeakPolarHBondContact OD1-CG 3.21Å; K95-F97 HydrophobicContact CB-CE2 3.63Å; K95-F97 HydrophobicContact CB-CZ 4.34Å |
| 96 | T | 90.8 | Very high | 79.9 | Confident | 37 Ų | 37 | 78 Ų | 78 | 23% | 0.227 | 43% | 0.429 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116 | 130.5 | -179.2 | -57 | 0 | 0 | 0 | 0 | 110.3 | V54 T55 Q56 P79 N81 | V54-T96 HydrophobicContact CG1-CG2 3.95Å; T55-T96 CarbonylContact O-C 3.47Å; T55-T96 WeakPolarHBondContact O-CA 3.5Å; Q56-T96 HydrophobicContact CG-CG2 4.21Å; P79-T96 HydrophobicContact CG-CG2 3.99Å; N81-T96 PolarHBondContact ND2-OG1 3.44Å |
| 97 | F | 92.4 | Very high | 80.6 | Confident | 87 Ų | 87 | 73.6 Ų | 73.6 | 38% | 0.382 | 42% | 0.42 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.5 | 138.6 | 175.2 | -61.4 | -92.9 | 0 | 0 | 0 | 109.2 | V54 T55 K95 L109 | V54-F97 CarbonylContact C-O 3.58Å; V54-F97 VanDerWaalsContact CA-O 3.31Å; V54-F97 WeakPolarHBondContact CA-O 3.4Å; T55-F97 PolarHBondContact N-O 2.72Å; T55-F97 PolarHBondContact O-N 2.86Å; K95-F97 HydrophobicContact CB-CE2 3.63Å; K95-F97 HydrophobicContact CB-CZ 4.34Å; F97-L109 HydrophobicContact CD1-CD2 3.59Å; F97-L109 HydrophobicContact CD2-CD1 3.45Å; F97-L109 VanDerWaalsContact CD2-CD1 3.45Å; F97-L109 HydrophobicContact CD2-CD2 3.88Å; F97-L109 HydrophobicContact CD2-CG 4.13Å; F97-L109 HydrophobicContact CE1-CD1 4.17Å; F97-L109 HydrophobicContact CE1-CD2 3.42Å; F97-L109 VanDerWaalsContact CE1-CD2 3.42Å; F97-L109 HydrophobicContact CE1-CG 4.41Å; F97-L109 HydrophobicContact CE2-CD1 2.93Å; F97-L109 HydrophobicContact CE2-CD2 3.76Å; F97-L109 HydrophobicContact CE2-CG 3.9Å; F97-L109 HydrophobicContact CG-CD1 4.27Å; F97-L109 HydrophobicContact CG-CD2 3.82Å; F97-L109 HydrophobicContact CZ-CD1 3.35Å; F97-L109 HydrophobicContact CZ-CD2 3.51Å; F97-L109 HydrophobicContact CZ-CG 4.02Å |
| 98 | C | 94.1 | Very high | 80.7 | Confident | 40 Ų | 40 | 68.9 Ų | 68.9 | 27% | 0.27 | 40% | 0.403 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.8 | 138 | -178.2 | -55 | 0 | 0 | 0 | 0 | 109.9 | F52 C53 C78 | F52-C98 HydrophobicContact CB-CB 4.47Å; F52-C98 HydrophobicContact CD1-CB 3.9Å; C53-C98 WeakPolarHBondContact O-CA 3.22Å; C78-C98 WeakPolarHBondContact CA-SG 3.37Å; C78-C98 HydrophobicContact CB-CB 3.54Å; C78-C98 WeakPolarHBondContact CB-SG 3.3Å; C78-C98 WeakPolarHBondContact SG-CB 3.15Å; C78-C98 CovalentContact SG-SG 2.02Å; C78-C98 PolarHBondContact SG-SG 3.34Å |
| 99 | C | 94.2 | Very high | 80.3 | Confident | 39 Ų | 39 | 64.6 Ų | 64.6 | 26% | 0.264 | 38% | 0.38 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -146.2 | 166.6 | 175.9 | 55.5 | 0 | 0 | 0 | 0 | 110.1 | F52 C53 C104 | F52-C99 WeakPolarHBondContact CA-O 3Å; C53-C99 PolarHBondContact N-O 3.17Å; C53-C99 PolarHBondContact O-N 3.42Å; C99-C104 HydrophobicContact CB-CB 3.78Å; C99-C104 WeakPolarHBondContact CB-SG 3.45Å; C99-C104 WeakPolarHBondContact SG-CB 3.42Å; C99-C104 CovalentContact SG-SG 2.01Å; C99-C104 PolarHBondContact SG-SG 2.91Å |
| 100 | K | 92.3 | Very high | 79.6 | Confident | 129 Ų | 129 | 67 Ų | 67 | 56% | 0.561 | 38% | 0.382 | S | S | * | . | trans | -128.9 | 22.7 | -170.2 | -64.4 | -167.6 | 173.1 | -160.9 | 0 | 113.7 | F52 | F52-K100 HydrophobicContact CD1-CD 4.37Å; F52-K100 HydrophobicContact CD1-CG 3.74Å; F52-K100 HydrophobicContact CE1-CD 4.07Å; F52-K100 HydrophobicContact CE1-CG 3.9Å; F52-K100 HydrophobicContact CG-CG 4.4Å; F52-K100 HydrophobicContact CZ-CD 4.42Å | ||
| 101 | E | 90.9 | Very high | 78.6 | Confident | 151 Ų | 151 | 71.9 Ų | 71.9 | 71% | 0.706 | 40% | 0.402 | S | S | * | . | S | Bend | trans | -114.3 | 152.9 | 177 | -68.3 | 174.4 | -172.7 | 0 | 0 | 109 | L27 L103 C104 | L27-E101 VanDerWaalsContact CD1-C 3.46Å; E101-L103 PolarHBondContact O-N 3.04Å; E101-C104 HydrophobicContact CB-CB 3.95Å; E101-C104 WeakPolarHBondContact O-CB 3.47Å; E101-C104 PolarHBondContact O-N 2.97Å; E101-C104 VanDerWaalsContact O-N 3.17Å; E101-C104 PolarHBondContact O-SG 3.17Å |
| 102 | D | 92.1 | Very high | 77.5 | Confident | 88 Ų | 88 | 70.7 Ų | 70.7 | 47% | 0.471 | 40% | 0.397 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.1 | 132.3 | 179.4 | -71.1 | -26.9 | 0 | 0 | 0 | 110.8 | L27 E28 C104 | L27-D102 WeakPolarHBondContact CA-OD1 3.23Å; E28-D102 HydrophobicContact CB-CB 4.38Å; E28-D102 PolarHBondContact N-OD1 3.42Å; E28-D102 CarbonylContact O-C 3.55Å; E28-D102 WeakPolarHBondContact O-CA 3.42Å; D102-C104 PolarHBondContact O-N 3.47Å |
| 103 | L | 93.4 | Very high | 76.1 | Confident | 53 Ų | 53 | 74.8 Ų | 74.8 | 28% | 0.277 | 43% | 0.427 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 57.6 | 16.8 | 176.4 | -53.6 | -178.3 | 0 | 0 | 0 | 113.6 | E28 Y30 T43 E101 N105 A106 | E28-L103 HydrophobicContact CB-CD2 4.09Å; E28-L103 HydrophobicContact CB-CG 4.5Å; E28-L103 HydrophobicContact CG-CD2 3.7Å; E28-L103 HydrophobicContact CG-CG 4.49Å; E28-L103 PolarHBondContact O-N 3.22Å; Y30-L103 HydrophobicContact CD2-CB 4.37Å; Y30-L103 HydrophobicContact CD2-CD2 4.34Å; Y30-L103 HydrophobicContact CE2-CB 3.78Å; Y30-L103 HydrophobicContact CE2-CD2 4.1Å; Y30-L103 HydrophobicContact CE2-CG 4.43Å; T43-L103 HydrophobicContact CG2-CD2 3.48Å; T43-L103 VanDerWaalsContact CG2-CD2 3.48Å; E101-L103 PolarHBondContact O-N 3.04Å; L103-N105 PolarHBondContact O-N 2.89Å; L103-A106 WeakPolarHBondContact O-CB 3.39Å; L103-A106 PolarHBondContact O-N 2.97Å |
| 104 | C | 93.5 | Very high | 74.9 | Confident | 39 Ų | 39 | 77.8 Ų | 77.8 | 26% | 0.264 | 45% | 0.448 | S | S | . | . | G | 310 helix | trans | -63.6 | -18.3 | -175 | 65.4 | 0 | 0 | 0 | 0 | 113.7 | C53 C99 E101 D102 A106 | C53-C104 VanDerWaalsContact CB-SG 3.58Å; C99-C104 HydrophobicContact CB-CB 3.78Å; C99-C104 WeakPolarHBondContact CB-SG 3.45Å; C99-C104 WeakPolarHBondContact SG-CB 3.42Å; C99-C104 CovalentContact SG-SG 2.01Å; C99-C104 PolarHBondContact SG-SG 2.91Å; E101-C104 HydrophobicContact CB-CB 3.95Å; E101-C104 WeakPolarHBondContact O-CB 3.47Å; E101-C104 PolarHBondContact O-N 2.97Å; E101-C104 VanDerWaalsContact O-N 3.17Å; E101-C104 PolarHBondContact O-SG 3.17Å; D102-C104 PolarHBondContact O-N 3.47Å; C104-A106 VanDerWaalsContact C-N 3.27Å; C104-A106 PolarHBondContact O-N 3.07Å |
| 105 | N | 93.7 | Very high | 73.5 | Confident | 5 Ų | 5 | 88.6 Ų | 88.6 | 3% | 0.027 | 49% | 0.487 | C | S | . | . | G | 310 helix | trans | -88.9 | 21.5 | 175.8 | 71.5 | -22.8 | 0 | 0 | 0 | 113.8 | Y30 C53 T55 N72 L103 A107 | Y30-N105 WeakPolarHBondContact CB-OD1 3.24Å; Y30-N105 WeakPolarHBondContact CD2-OD1 2.94Å; Y30-N105 PolarHBondContact N-OD1 3.47Å; Y30-N105 PolarHBondContact O-ND2 3.44Å; C53-N105 HydrophobicContact CB-CB 3.77Å; T55-N105 WeakPolarHBondContact OG1-CB 3.38Å; N72-N105 PolarHBondContact ND2-O 3.39Å; L103-N105 PolarHBondContact O-N 2.89Å; N105-A107 VanDerWaalsContact C-N 3.28Å; N105-A107 PolarHBondContact O-N 3.49Å |
| 106 | A | 88.2 | Confident | 71.8 | Confident | 60 Ų | 60 | 88.6 Ų | 88.6 | 50% | 0.496 | 50% | 0.497 | S | S | . | . | G | 310 helix | trans | -61.9 | -33.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | Y30 L103 C104 | Y30-A106 HydrophobicContact CD2-CB 4Å; Y30-A106 HydrophobicContact CE2-CB 3.42Å; Y30-A106 VanDerWaalsContact CE2-CB 3.42Å; L103-A106 WeakPolarHBondContact O-CB 3.39Å; L103-A106 PolarHBondContact O-N 2.97Å; C104-A106 VanDerWaalsContact C-N 3.27Å; C104-A106 PolarHBondContact O-N 3.07Å |
| 107 | A | 70.1 | Confident | 69.9 | Low | 70 Ų | 70 | 93.8 Ų | 93.8 | 58% | 0.579 | 52% | 0.52 | S | S | * | . | trans | -83.4 | 127.3 | -167.5 | 0 | 0 | 0 | 0 | 0 | 112 | N105 | N105-A107 VanDerWaalsContact C-N 3.28Å; N105-A107 PolarHBondContact O-N 3.49Å | ||
| 108 | V | 57.6 | Low | 68.1 | Low | 43 Ų | 43 | 93 Ų | 93 | 26% | 0.261 | 53% | 0.53 | S | S | . | . | trans | -59.7 | 137.1 | 145.4 | 176.2 | 0 | 0 | 0 | 0 | 105.7 | T110 | V108-T110 PolarHBondContact O-N 3.45Š| ||
| 109 | L | 48.6 | Very low | 66.1 | Low | 70 Ų | 70 | 93 Ų | 93 | 37% | 0.366 | 54% | 0.537 | S | S | . | . | trans | -68.9 | 65.5 | 179 | -60 | 148.1 | 0 | 0 | 0 | 110.7 | E57 F97 E111 | E57-L109 HydrophobicContact CG-CD1 4.42Å; E57-L109 WeakPolarHBondContact OE1-CD1 3.37Å; F97-L109 HydrophobicContact CD1-CD2 3.59Å; F97-L109 HydrophobicContact CD2-CD1 3.45Å; F97-L109 VanDerWaalsContact CD2-CD1 3.45Å; F97-L109 HydrophobicContact CD2-CD2 3.88Å; F97-L109 HydrophobicContact CD2-CG 4.13Å; F97-L109 HydrophobicContact CE1-CD1 4.17Å; F97-L109 HydrophobicContact CE1-CD2 3.42Å; F97-L109 VanDerWaalsContact CE1-CD2 3.42Å; F97-L109 HydrophobicContact CE1-CG 4.41Å; F97-L109 HydrophobicContact CE2-CD1 2.93Å; F97-L109 HydrophobicContact CE2-CD2 3.76Å; F97-L109 HydrophobicContact CE2-CG 3.9Å; F97-L109 HydrophobicContact CG-CD1 4.27Å; F97-L109 HydrophobicContact CG-CD2 3.82Å; F97-L109 HydrophobicContact CZ-CD1 3.35Å; F97-L109 HydrophobicContact CZ-CD2 3.51Å; F97-L109 HydrophobicContact CZ-CG 4.02Å; L109-E111 PolarHBondContact O-N 3.2Å | ||
| 110 | T | 42.5 | Very low | 64.3 | Low | 116 Ų | 116 | 95.6 Ų | 95.6 | 71% | 0.712 | 55% | 0.551 | S | S | * | * | trans | -78.6 | 89.8 | 159.3 | -40.1 | 0 | 0 | 0 | 0 | 104.5 | V108 G112 | V108-T110 PolarHBondContact O-N 3.45Å; T110-G112 VanDerWaalsContact C-N 3.33Å; T110-G112 WeakPolarHBondContact O-CA 3.48Å; T110-G112 PolarHBondContact O-N 2.85Å | ||
| 111 | E | 40.9 | Very low | 62.7 | Low | 201 Ų | 201 | 95 Ų | 95 | 94% | 0.939 | 55% | 0.553 | S | S | * | * | S | Bend | trans | -36.7 | 94.3 | 167.6 | -161.4 | 178.3 | -177.3 | 0 | 0 | 109.9 | L109 | L109-E111 PolarHBondContact O-N 3.2Š|
| 112 | G | 37 | Very low | 61.2 | Low | 52 Ų | 52 | 94 Ų | 94 | 54% | 0.536 | 55% | 0.552 | S | S | . | * | trans | 175.9 | 68.3 | -159.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | T110 T114 | T110-G112 VanDerWaalsContact C-N 3.33Å; T110-G112 WeakPolarHBondContact O-CA 3.48Å; T110-G112 PolarHBondContact O-N 2.85Å; G112-T114 PolarHBondContact O-N 2.87Å | ||
| 113 | S | 41.6 | Very low | 59.5 | Low | 104 Ų | 104 | 98 Ų | 98 | 73% | 0.727 | 57% | 0.565 | S | S | * | * | trans | -40.7 | 95.4 | 170 | 160.9 | 0 | 0 | 0 | 0 | 112.5 | W115 | S113-W115 VanDerWaalsContact C-N 3.27Å; S113-W115 PolarHBondContact O-N 3.35Å | ||
| 114 | T | 48.6 | Very low | 57.9 | Low | 129 Ų | 129 | 99.1 Ų | 99.1 | 79% | 0.791 | 58% | 0.578 | S | S | * | * | trans | -93.6 | 43 | 167.2 | 49.4 | 0 | 0 | 0 | 0 | 111 | G112 T116 | G112-T114 PolarHBondContact O-N 2.87Å; T114-T116 VanDerWaalsContact C-N 3.3Å; T114-T116 PolarHBondContact O-N 3.43Å | ||
| 115 | W | 53.8 | Low | 56.1 | Low | 237 Ų | 237 | 102.5 Ų | 102.5 | 90% | 0.898 | 59% | 0.592 | S | S | * | * | trans | -84 | 9.5 | 173 | -88 | -2.4 | 0 | 0 | 0 | 115 | S113 | S113-W115 VanDerWaalsContact C-N 3.27Å; S113-W115 PolarHBondContact O-N 3.35Å | ||
| 116 | T | 50.9 | Low | 54.5 | Low | 111 Ų | 111 | 104.3 Ų | 104.3 | 68% | 0.681 | 61% | 0.612 | S | S | * | * | trans | -89.5 | -1.7 | -173.4 | 29.9 | 0 | 0 | 0 | 0 | 116.8 | T114 | T114-T116 VanDerWaalsContact C-N 3.3Å; T114-T116 PolarHBondContact O-N 3.43Å | ||
| 117 | M | 51.5 | Low | 53.1 | Low | 145 Ų | 145 | 105.2 Ų | 105.2 | 71% | 0.714 | 62% | 0.615 | S | S | * | * | S | Bend | trans | -88 | -20.2 | -177.1 | -65.1 | -63.3 | -70.3 | 0 | 0 | 115 | G119 | M117-G119 VanDerWaalsContact C-N 3.34Å; M117-G119 PolarHBondContact O-N 2.86Å |
| 118 | A | 54.4 | Low | 52.6 | Low | 72 Ų | 72 | 106.2 Ų | 106.2 | 60% | 0.595 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -70.4 | -30 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | V120 | A118-V120 PolarHBondContact O-N 3.08Å |
| 119 | G | 51.9 | Low | 52.5 | Low | 40 Ų | 40 | 110.6 Ų | 110.6 | 41% | 0.412 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -68.7 | -33 | -179 | 0 | 0 | 0 | 0 | 0 | 114.1 | M117 F123 | M117-G119 VanDerWaalsContact C-N 3.34Å; M117-G119 PolarHBondContact O-N 2.86Å; G119-F123 WeakPolarHBondContact O-CD2 3.48Å |
| 120 | V | 57.1 | Low | 52.9 | Low | 92 Ų | 92 | 113.7 Ų | 113.7 | 56% | 0.558 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -74.5 | -32.2 | -173.1 | -178.1 | 0 | 0 | 0 | 0 | 112 | A118 S124 | A118-V120 PolarHBondContact O-N 3.08Å; V120-S124 PolarHBondContact O-OG 3.25Å |
| 121 | I | 59.3 | Low | 53.6 | Low | 116 Ų | 116 | 115.8 Ų | 115.8 | 60% | 0.595 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -73.9 | -37.7 | -178.8 | -56.7 | 179.1 | 0 | 0 | 0 | 111 | F123 S124 | I121-F123 PolarHBondContact O-N 3.06Å; I121-S124 PolarHBondContact O-N 2.67Å |
| 122 | L | 57.9 | Low | 54.4 | Low | 132 Ų | 132 | 111.8 Ų | 111.8 | 69% | 0.691 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -67 | -35.5 | -179.1 | -74.9 | 167.7 | 0 | 0 | 0 | 113.2 | S124 | L122-S124 VanDerWaalsContact C-N 3.32Å; L122-S124 PolarHBondContact O-N 2.86Å |
| 123 | F | 56.8 | Low | 55.3 | Low | 171 Ų | 171 | 116.8 Ų | 116.8 | 75% | 0.75 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -69.6 | -28.7 | 177.3 | -86.9 | -78 | 0 | 0 | 0 | 113.3 | G119 I121 | G119-F123 WeakPolarHBondContact O-CD2 3.48Å; I121-F123 PolarHBondContact O-N 3.06Å |
| 124 | S | 59.4 | Low | 55.9 | Low | 77 Ų | 77 | 122.4 Ų | 122.4 | 54% | 0.538 | 67% | 0.672 | S | S | . | * | H | α-helix | trans | -72.8 | -33 | -176.8 | -58 | 0 | 0 | 0 | 0 | 112.6 | V120 I121 L122 | V120-S124 PolarHBondContact O-OG 3.25Å; I121-S124 PolarHBondContact O-N 2.67Å; L122-S124 VanDerWaalsContact C-N 3.32Å; L122-S124 PolarHBondContact O-N 2.86Å |
| 125 | L | 57.3 | Low | 56.3 | Low | 110 Ų | 110 | 122.1 Ų | 122.1 | 58% | 0.576 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -78.7 | -28.7 | -180 | -73.3 | 159.9 | 0 | 0 | 0 | 113 | S127 | L125-S127 PolarHBondContact O-N 2.78Å |
| 126 | G | 58.9 | Low | 56.4 | Low | 42 Ų | 42 | 116.1 Ų | 116.1 | 43% | 0.433 | 65% | 0.654 | S | S | . | * | H | α-helix | trans | -66.1 | -35.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | L130 | G126-L130 PolarHBondContact O-N 2.8Å |
| 127 | S | 59 | Low | 56.7 | Low | 79 Ų | 79 | 116.3 Ų | 116.3 | 55% | 0.552 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -72.1 | -31.2 | -179.2 | -64.9 | 0 | 0 | 0 | 0 | 113.7 | L125 | L125-S127 PolarHBondContact O-N 2.78Å |
| 128 | V | 59.4 | Low | 57 | Low | 91 Ų | 91 | 114.6 Ų | 114.6 | 55% | 0.552 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -74 | -37.4 | 178.9 | -177.3 | 0 | 0 | 0 | 0 | 111.1 | Q131 T132 | V128-Q131 PolarHBondContact O-N 2.88Å; V128-T132 PolarHBondContact O-OG1 3.11Å |
| 129 | H | 56.4 | Low | 57.2 | Low | 136 Ų | 136 | 117.3 Ų | 117.3 | 63% | 0.63 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -69.8 | -33.1 | 179.3 | -92.1 | -75.5 | 0 | 0 | 0 | 113.5 | T132 | H129-T132 PolarHBondContact O-N 3.23Å |
| 130 | L | 56.6 | Low | 57.5 | Low | 135 Ų | 135 | 122.5 Ų | 122.5 | 71% | 0.707 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -70.4 | -32 | 177.9 | -116.5 | 78.4 | 0 | 0 | 0 | 113.1 | G126 T132 L133 | G126-L130 PolarHBondContact O-N 2.8Å; L130-T132 PolarHBondContact O-N 2.85Å; L130-L133 PolarHBondContact O-N 3.48Å |
| 131 | Q | 57.8 | Low | 57.5 | Low | 160 Ų | 160 | 124.6 Ų | 124.6 | 75% | 0.748 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -71.2 | -14.2 | 178.8 | -75.3 | -178.8 | -9.7 | 0 | 0 | 113.8 | V128 | V128-Q131 PolarHBondContact O-N 2.88Å |
| 132 | T | 57.4 | Low | 57.4 | Low | 116 Ų | 116 | 125.3 Ų | 125.3 | 71% | 0.712 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93 | -8.7 | 178.4 | -41.1 | 0 | 0 | 0 | 0 | 112.5 | V128 H129 L130 | V128-T132 PolarHBondContact O-OG1 3.11Å; H129-T132 PolarHBondContact O-N 3.23Å; L130-T132 PolarHBondContact O-N 2.85Å |
| 133 | L | 56.4 | Low | 57.4 | Low | 158 Ų | 158 | 124.8 Ų | 124.8 | 83% | 0.827 | 68% | 0.682 | S | S | * | * | trans | -109.3 | -0.2 | -176.7 | -87 | 157.4 | 0 | 0 | 0 | 114.1 | L130 | L130-L133 PolarHBondContact O-N 3.48Š| ||
| 134 | L | 53 | Low | 57.4 | Low | 222 Ų | 222 | 120.5 Ų | 120.5 | 100% | 1.162 | 68% | 0.676 | S | S | * | * | trans | -107.2 | 0 | 172.5 | -154.7 | 96.4 | 0 | 0 | 0 | 110.2 |
Retrieved 134 of 134 residues in 220.1 ms
(Link to these results)