| 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 | 57.2 | Low | 81.9 | Confident | 241 Ų | 241 | 74 Ų | 74 | 100% | 1.187 | 40% | 0.399 | S | S | * | . | 0 | 124.3 | 0 | -71.3 | -178 | -85.2 | 0 | 0 | 106.5 | |||||
| 2 | A | 70 | Confident | 82.4 | Confident | 51 Ų | 51 | 68.1 Ų | 68.1 | 42% | 0.421 | 37% | 0.368 | S | S | . | . | trans | -61 | 138.1 | 178.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | E6 L7 | A2-E6 WeakPolarHBondContact CA-OE2 3.43Å; A2-L7 HydrophobicContact CB-CD2 3.97Å; A2-L7 HydrophobicContact CB-CG 4.01Å | ||
| 3 | S | 83 | Confident | 82.9 | Confident | 40 Ų | 40 | 63.3 Ų | 63.3 | 28% | 0.28 | 34% | 0.343 | S | S | . | . | trans | -70.6 | 153 | 179.1 | 62.8 | 0 | 0 | 0 | 0 | 110.6 | S5 E6 L7 | S3-S5 WeakPolarHBondContact CB-OG 3.43Å; S3-S5 PolarHBondContact O-N 3.31Å; S3-S5 VanDerWaalsContact O-N 3.16Å; S3-S5 PolarHBondContact OG-OG 2.92Å; S3-E6 PolarHBondContact N-OE2 3.4Å; S3-E6 VanDerWaalsContact N-OE2 3.15Å; S3-E6 WeakPolarHBondContact O-CB 3.35Å; S3-E6 PolarHBondContact O-N 2.91Å; S3-E6 VanDerWaalsContact OG-CG 3.25Å; S3-E6 WeakPolarHBondContact OG-CG 3.35Å; S3-E6 PolarHBondContact OG-N 3.08Å; S3-E6 PolarHBondContact OG-OE1 3.26Å; S3-L7 PolarHBondContact O-N 3.41Å | ||
| 4 | V | 84.9 | Confident | 83.1 | Confident | 107 Ų | 107 | 62.6 Ų | 62.6 | 65% | 0.648 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -58.3 | -31.3 | 178.1 | -179.7 | 0 | 0 | 0 | 0 | 111.1 | A8 V37 | V4-A8 WeakPolarHBondContact O-CB 3.42Å; V4-A8 PolarHBondContact O-N 3.46Å; V4-V37 HydrophobicContact CG1-CG1 4.35Å |
| 5 | S | 83.4 | Confident | 83.6 | Confident | 30 Ų | 30 | 63.8 Ų | 63.8 | 21% | 0.21 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -61 | -47.7 | 171.1 | 31.9 | 0 | 0 | 0 | 0 | 113.3 | S3 C9 | S3-S5 WeakPolarHBondContact CB-OG 3.43Å; S3-S5 PolarHBondContact O-N 3.31Å; S3-S5 VanDerWaalsContact O-N 3.16Å; S3-S5 PolarHBondContact OG-OG 2.92Å; S5-C9 PolarHBondContact O-N 3.24Å; S5-C9 VanDerWaalsContact O-N 3.14Å; S5-C9 PolarHBondContact O-SG 3.22Å |
| 6 | E | 83.2 | Confident | 83.9 | Confident | 56 Ų | 56 | 60.5 Ų | 60.5 | 26% | 0.262 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -64.5 | -46.3 | 176.6 | -75.4 | 153.5 | -140.4 | 0 | 0 | 110.9 | A2 S3 A8 C9 I10 W43 | A2-E6 WeakPolarHBondContact CA-OE2 3.43Å; S3-E6 PolarHBondContact N-OE2 3.4Å; S3-E6 VanDerWaalsContact N-OE2 3.15Å; S3-E6 WeakPolarHBondContact O-CB 3.35Å; S3-E6 PolarHBondContact O-N 2.91Å; S3-E6 VanDerWaalsContact OG-CG 3.25Å; S3-E6 WeakPolarHBondContact OG-CG 3.35Å; S3-E6 PolarHBondContact OG-N 3.08Å; S3-E6 PolarHBondContact OG-OE1 3.26Å; E6-A8 PolarHBondContact O-N 2.97Å; E6-C9 PolarHBondContact O-N 3.43Å; E6-I10 HydrophobicContact CB-CD1 4.49Å; E6-I10 WeakPolarHBondContact O-CB 3.37Å; E6-I10 WeakPolarHBondContact O-CD1 3.24Å; E6-I10 WeakPolarHBondContact O-CG1 3.46Å; E6-I10 PolarHBondContact O-N 2.97Å; E6-W43 HydrophobicContact CG-CD2 4.38Å; E6-W43 HydrophobicContact CG-CE3 4.04Å; E6-W43 HydrophobicContact CG-CH2 3.31Å; E6-W43 HydrophobicContact CG-CZ2 3.74Å; E6-W43 HydrophobicContact CG-CZ3 3.49Å; E6-W43 VanDerWaalsContact CG-CZ3 3.49Å; E6-W43 VanDerWaalsContact OE1-CH2 3.31Å; E6-W43 WeakPolarHBondContact OE1-CH2 3.21Å |
| 7 | L | 86.8 | Confident | 84 | Confident | 63 Ų | 63 | 60.9 Ų | 60.9 | 33% | 0.33 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -59.4 | -48.4 | -179.4 | -71.9 | 175.1 | 0 | 0 | 0 | 111.4 | A2 S3 C9 I10 Y11 | A2-L7 HydrophobicContact CB-CD2 3.97Å; A2-L7 HydrophobicContact CB-CG 4.01Å; S3-L7 PolarHBondContact O-N 3.41Å; L7-C9 VanDerWaalsContact C-N 3.31Å; L7-C9 PolarHBondContact O-N 3.17Å; L7-I10 PolarHBondContact O-N 3.25Å; L7-Y11 HydrophobicContact CB-CD2 4.26Å; L7-Y11 HydrophobicContact CB-CE2 3.97Å; L7-Y11 HydrophobicContact CD2-CE2 4.25Å; L7-Y11 WeakPolarHBondContact O-CD2 2.94Å; L7-Y11 PolarHBondContact O-N 2.93Å |
| 8 | A | 88.2 | Confident | 84.2 | Confident | 20 Ų | 20 | 64.2 Ų | 64.2 | 17% | 0.165 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -64.5 | -35.8 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | V4 E6 S12 V37 I39 | V4-A8 WeakPolarHBondContact O-CB 3.42Å; V4-A8 PolarHBondContact O-N 3.46Å; E6-A8 PolarHBondContact O-N 2.97Å; A8-S12 VanDerWaalsContact O-CB 3.28Å; A8-S12 WeakPolarHBondContact O-CB 3.46Å; A8-S12 PolarHBondContact O-N 2.96Å; A8-S12 PolarHBondContact O-OG 3.4Å; A8-V37 HydrophobicContact CB-CG1 4.22Å; A8-I39 HydrophobicContact CB-CD1 3.35Å; A8-I39 HydrophobicContact CB-CG1 4.5Å |
| 9 | C | 88.1 | Confident | 84.3 | Confident | 0 Ų | 0 | 66.5 Ų | 66.5 | 0% | 0 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -65.2 | -44.2 | 171.5 | -74.4 | 0 | 0 | 0 | 0 | 112.5 | S5 E6 L7 S12 A13 W43 F47 | S5-C9 PolarHBondContact O-N 3.24Å; S5-C9 VanDerWaalsContact O-N 3.14Å; S5-C9 PolarHBondContact O-SG 3.22Å; E6-C9 PolarHBondContact O-N 3.43Å; L7-C9 VanDerWaalsContact C-N 3.31Å; L7-C9 PolarHBondContact O-N 3.17Å; C9-S12 WeakPolarHBondContact CA-OG 3.45Å; C9-S12 PolarHBondContact O-N 3.29Å; C9-S12 PolarHBondContact O-OG 2.85Å; C9-A13 WeakPolarHBondContact O-CB 3.28Å; C9-A13 PolarHBondContact O-N 2.95Å; C9-W43 WeakPolarHBondContact SG-CB 3.11Å; C9-F47 HydrophobicContact CB-CD2 3.49Å; C9-F47 VanDerWaalsContact CB-CD2 3.49Å; C9-F47 HydrophobicContact CB-CE2 3.46Å; C9-F47 VanDerWaalsContact CB-CE2 3.46Å; C9-F47 HydrophobicContact CB-CG 4.26Å; C9-F47 HydrophobicContact CB-CZ 4.21Å |
| 10 | I | 88.1 | Confident | 84.2 | Confident | 67 Ų | 67 | 72.5 Ų | 72.5 | 34% | 0.344 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -61.8 | -48.9 | 177.7 | -67.7 | 161.7 | 0 | 0 | 0 | 110.7 | E6 L7 S12 A13 L14 F47 | E6-I10 HydrophobicContact CB-CD1 4.49Å; E6-I10 WeakPolarHBondContact O-CB 3.37Å; E6-I10 WeakPolarHBondContact O-CD1 3.24Å; E6-I10 WeakPolarHBondContact O-CG1 3.46Å; E6-I10 PolarHBondContact O-N 2.97Å; L7-I10 PolarHBondContact O-N 3.25Å; I10-S12 VanDerWaalsContact C-N 3.35Å; I10-S12 PolarHBondContact O-N 3.36Å; I10-A13 PolarHBondContact O-N 3.23Å; I10-L14 HydrophobicContact CG2-CD1 4.15Å; I10-L14 WeakPolarHBondContact O-CG 3.35Å; I10-L14 PolarHBondContact O-N 3Å; I10-F47 HydrophobicContact CD1-CZ 4.41Å; I10-F47 HydrophobicContact CG1-CE1 3.82Å; I10-F47 HydrophobicContact CG1-CZ 3.69Å |
| 11 | Y | 87.4 | Confident | 84.1 | Confident | 139 Ų | 139 | 71.5 Ų | 71.5 | 55% | 0.545 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -63.3 | -41 | 177.9 | -68.5 | -57.6 | 0 | 0 | 0 | 112 | L7 A13 L14 I15 | L7-Y11 HydrophobicContact CB-CD2 4.26Å; L7-Y11 HydrophobicContact CB-CE2 3.97Å; L7-Y11 HydrophobicContact CD2-CE2 4.25Å; L7-Y11 WeakPolarHBondContact O-CD2 2.94Å; L7-Y11 PolarHBondContact O-N 2.93Å; Y11-A13 VanDerWaalsContact C-N 3.31Å; Y11-A13 PolarHBondContact O-N 2.9Å; Y11-L14 PolarHBondContact O-N 3.46Å; Y11-I15 WeakPolarHBondContact O-CD1 3.34Å; Y11-I15 VanDerWaalsContact O-CG1 3.24Å; Y11-I15 WeakPolarHBondContact O-CG1 3.28Å; Y11-I15 PolarHBondContact O-N 3.43Å |
| 12 | S | 88.8 | Confident | 85.3 | Confident | 3 Ų | 3 | 64.7 Ų | 64.7 | 2% | 0.021 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -64.2 | -35.8 | 175.7 | 64.1 | 0 | 0 | 0 | 0 | 112.7 | A8 C9 I10 L16 L28 | A8-S12 VanDerWaalsContact O-CB 3.28Å; A8-S12 WeakPolarHBondContact O-CB 3.46Å; A8-S12 PolarHBondContact O-N 2.96Å; A8-S12 PolarHBondContact O-OG 3.4Å; C9-S12 WeakPolarHBondContact CA-OG 3.45Å; C9-S12 PolarHBondContact O-N 3.29Å; C9-S12 PolarHBondContact O-OG 2.85Å; I10-S12 VanDerWaalsContact C-N 3.35Å; I10-S12 PolarHBondContact O-N 3.36Å; S12-L16 VanDerWaalsContact O-CG 3.28Å; S12-L16 WeakPolarHBondContact O-CG 3.39Å; S12-L16 PolarHBondContact O-N 3.2Å; S12-L16 VanDerWaalsContact O-N 3.15Å; S12-L28 WeakPolarHBondContact OG-CD2 3.39Å |
| 13 | A | 87.9 | Confident | 86 | Confident | 6 Ų | 6 | 63.7 Ų | 63.7 | 5% | 0.05 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -68.5 | -39 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | C9 I10 Y11 L16 H17 V23 L28 L51 | C9-A13 WeakPolarHBondContact O-CB 3.28Å; C9-A13 PolarHBondContact O-N 2.95Å; I10-A13 PolarHBondContact O-N 3.23Å; Y11-A13 VanDerWaalsContact C-N 3.31Å; Y11-A13 PolarHBondContact O-N 2.9Å; A13-L16 PolarHBondContact O-N 2.77Å; A13-H17 WeakPolarHBondContact O-CB 3.39Å; A13-H17 PolarHBondContact O-N 2.96Å; A13-V23 HydrophobicContact CB-CG1 4.47Å; A13-L28 HydrophobicContact CB-CD2 4.26Å; A13-L51 HydrophobicContact CB-CD1 3.52Å |
| 14 | L | 86.9 | Confident | 86.2 | Confident | 54 Ų | 54 | 64.1 Ų | 64.1 | 28% | 0.283 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -65.5 | -44.2 | 175.5 | -69.7 | 173.6 | 0 | 0 | 0 | 111.9 | I10 Y11 L16 H17 D18 I56 I60 | I10-L14 HydrophobicContact CG2-CD1 4.15Å; I10-L14 WeakPolarHBondContact O-CG 3.35Å; I10-L14 PolarHBondContact O-N 3Å; Y11-L14 PolarHBondContact O-N 3.46Å; L14-L16 VanDerWaalsContact C-N 3.31Å; L14-L16 PolarHBondContact O-N 3.16Å; L14-H17 WeakPolarHBondContact O-CB 3.13Å; L14-H17 PolarHBondContact O-N 3.15Å; L14-H17 VanDerWaalsContact O-N 3.14Å; L14-D18 PolarHBondContact O-N 3.14Å; L14-I56 HydrophobicContact CD2-CG2 3.9Å; L14-I60 HydrophobicContact CD2-CD1 3.78Å |
| 15 | I | 89.6 | Confident | 86.3 | Confident | 80 Ų | 80 | 62.4 Ų | 62.4 | 41% | 0.41 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -58.2 | -46.4 | 176.3 | -68.2 | 162.3 | 0 | 0 | 0 | 110.6 | Y11 H17 D18 D19 L31 | Y11-I15 WeakPolarHBondContact O-CD1 3.34Å; Y11-I15 VanDerWaalsContact O-CG1 3.24Å; Y11-I15 WeakPolarHBondContact O-CG1 3.28Å; Y11-I15 PolarHBondContact O-N 3.43Å; I15-H17 VanDerWaalsContact C-N 3.29Å; I15-H17 PolarHBondContact O-N 2.99Å; I15-D18 PolarHBondContact O-N 3.22Å; I15-D19 PolarHBondContact O-N 2.96Å; I15-D19 VanDerWaalsContact O-N 3.07Å; I15-L31 HydrophobicContact CB-CD1 4.5Å; I15-L31 HydrophobicContact CG2-CD1 4.34Å |
| 16 | L | 88.3 | Confident | 86.6 | Confident | 11 Ų | 11 | 66.9 Ų | 66.9 | 6% | 0.058 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -64.7 | -35.8 | 178.7 | -69.5 | 173.9 | 0 | 0 | 0 | 112.2 | S12 A13 L14 E20 V21 V23 K27 L28 L31 | S12-L16 VanDerWaalsContact O-CG 3.28Å; S12-L16 WeakPolarHBondContact O-CG 3.39Å; S12-L16 PolarHBondContact O-N 3.2Å; S12-L16 VanDerWaalsContact O-N 3.15Å; A13-L16 PolarHBondContact O-N 2.77Å; L14-L16 VanDerWaalsContact C-N 3.31Å; L14-L16 PolarHBondContact O-N 3.16Å; L16-E20 PolarHBondContact O-N 3.05Å; L16-V21 CarbonylContact C-O 3.57Å; L16-V21 HydrophobicContact CD2-CB 4.14Å; L16-V21 HydrophobicContact CD2-CG1 3.94Å; L16-V21 PolarHBondContact O-N 3.45Å; L16-V23 HydrophobicContact CB-CG2 4.07Å; L16-V23 HydrophobicContact CD1-CG1 4.45Å; L16-K27 HydrophobicContact CD1-CB 3.81Å; L16-K27 HydrophobicContact CD2-CB 4Å; L16-K27 HydrophobicContact CD2-CD 4.17Å; L16-L28 HydrophobicContact CD1-CD2 3.7Å; L16-L28 HydrophobicContact CD1-CG 4.05Å; L16-L31 HydrophobicContact CD1-CD1 4.15Å; L16-L31 HydrophobicContact CD2-CD1 3.91Å; L16-L31 HydrophobicContact CG-CD1 3.73Å |
| 17 | H | 85.8 | Confident | 86.8 | Confident | 67 Ų | 67 | 67.3 Ų | 67.3 | 31% | 0.31 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -67.4 | -43.1 | 175.1 | -179.6 | -89.6 | 0 | 0 | 0 | 112.3 | A13 L14 I15 D19 E20 I56 | A13-H17 WeakPolarHBondContact O-CB 3.39Å; A13-H17 PolarHBondContact O-N 2.96Å; L14-H17 WeakPolarHBondContact O-CB 3.13Å; L14-H17 PolarHBondContact O-N 3.15Å; L14-H17 VanDerWaalsContact O-N 3.14Å; I15-H17 VanDerWaalsContact C-N 3.29Å; I15-H17 PolarHBondContact O-N 2.99Å; H17-D19 VanDerWaalsContact C-N 3.27Å; H17-D19 PolarHBondContact O-N 3.44Å; H17-E20 PolarHBondContact O-N 3.36Å; H17-I56 HydrophobicContact CB-CD1 3.96Å; H17-I56 HydrophobicContact CB-CG2 4.48Å |
| 18 | D | 88.1 | Confident | 86.9 | Confident | 120 Ų | 120 | 64.3 Ų | 64.3 | 64% | 0.642 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -63.9 | -33.3 | 178.4 | -70.7 | -11.3 | 0 | 0 | 0 | 112.1 | L14 I15 E20 | L14-D18 PolarHBondContact O-N 3.14Å; I15-D18 PolarHBondContact O-N 3.22Å; D18-E20 VanDerWaalsContact C-N 3.25Å; D18-E20 PolarHBondContact O-N 3.46Å |
| 19 | D | 86.5 | Confident | 86.9 | Confident | 109 Ų | 109 | 66 Ų | 66 | 58% | 0.583 | 34% | 0.336 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.4 | 3.6 | 175.2 | -69.5 | -25.2 | 0 | 0 | 0 | 113.4 | I15 H17 V21 | I15-D19 PolarHBondContact O-N 2.96Å; I15-D19 VanDerWaalsContact O-N 3.07Å; H17-D19 VanDerWaalsContact C-N 3.27Å; H17-D19 PolarHBondContact O-N 3.44Å; D19-V21 HydrophobicContact CB-CB 4.42Å; D19-V21 HydrophobicContact CB-CG2 3.8Å; D19-V21 WeakPolarHBondContact O-CG2 3.49Å; D19-V21 PolarHBondContact O-N 2.82Å; D19-V21 VanDerWaalsContact O-N 3.13Å |
| 20 | E | 81.2 | Confident | 87 | Confident | 185 Ų | 185 | 68.7 Ų | 68.7 | 86% | 0.864 | 36% | 0.358 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.5 | 24.4 | -173.3 | -56.9 | -178.4 | 167.5 | 0 | 0 | 113.5 | L16 H17 D18 | L16-E20 PolarHBondContact O-N 3.05Å; H17-E20 PolarHBondContact O-N 3.36Å; D18-E20 VanDerWaalsContact C-N 3.25Å; D18-E20 PolarHBondContact O-N 3.46Å |
| 21 | V | 82 | Confident | 87 | Confident | 53 Ų | 53 | 68.1 Ų | 68.1 | 32% | 0.321 | 36% | 0.356 | S | S | . | . | trans | -92.8 | 129.6 | -178.4 | 178.5 | 0 | 0 | 0 | 0 | 109.5 | L16 D19 V23 K27 | L16-V21 CarbonylContact C-O 3.57Å; L16-V21 HydrophobicContact CD2-CB 4.14Å; L16-V21 HydrophobicContact CD2-CG1 3.94Å; L16-V21 PolarHBondContact O-N 3.45Å; D19-V21 HydrophobicContact CB-CB 4.42Å; D19-V21 HydrophobicContact CB-CG2 3.8Å; D19-V21 WeakPolarHBondContact O-CG2 3.49Å; D19-V21 PolarHBondContact O-N 2.82Å; D19-V21 VanDerWaalsContact O-N 3.13Å; V21-V23 PolarHBondContact O-N 3.5Å; V21-K27 HydrophobicContact CG1-CD 3.46Å; V21-K27 VanDerWaalsContact CG1-CD 3.46Å | ||
| 22 | T | 83.3 | Confident | 87.1 | Confident | 97 Ų | 97 | 62 Ų | 62 | 60% | 0.595 | 33% | 0.333 | S | S | * | . | trans | -54.2 | 127.3 | 178.3 | 54.6 | 0 | 0 | 0 | 0 | 112 | T24 K27 | T22-T24 PolarHBondContact O-N 3.16Å; T22-K27 WeakPolarHBondContact O-CD 3.49Å; T22-K27 PolarHBondContact O-NZ 3.4Å; T22-K27 PolarHBondContact OG1-NZ 3.07Å | ||
| 23 | V | 84.4 | Confident | 87.1 | Confident | 30 Ų | 30 | 69 Ų | 69 | 18% | 0.182 | 36% | 0.363 | C | S | . | . | trans | -71.5 | 98.3 | 178.9 | -176.9 | 0 | 0 | 0 | 0 | 109.2 | A13 L16 V21 L28 L51 I56 | A13-V23 HydrophobicContact CB-CG1 4.47Å; L16-V23 HydrophobicContact CB-CG2 4.07Å; L16-V23 HydrophobicContact CD1-CG1 4.45Å; V21-V23 PolarHBondContact O-N 3.5Å; V23-L28 HydrophobicContact CG1-CD1 3.84Å; V23-L28 HydrophobicContact CG1-CD2 4.08Å; V23-L28 HydrophobicContact CG1-CG 4.12Å; V23-L51 HydrophobicContact CG1-CD1 4.04Å; V23-I56 HydrophobicContact CG2-CD1 4.49Å | ||
| 24 | T | 86.6 | Confident | 87.2 | Confident | 49 Ų | 49 | 72.5 Ų | 72.5 | 30% | 0.301 | 39% | 0.391 | S | S | . | . | trans | -118.6 | 155.4 | 177.6 | 63.4 | 0 | 0 | 0 | 0 | 111.2 | T22 D26 K27 L28 | T22-T24 PolarHBondContact O-N 3.16Å; T24-D26 VanDerWaalsContact C-N 3.27Å; T24-D26 PolarHBondContact O-N 3.41Å; T24-K27 PolarHBondContact O-N 2.89Å; T24-K27 VanDerWaalsContact O-N 3.16Å; T24-K27 WeakPolarHBondContact OG1-CD 3.5Å; T24-K27 WeakPolarHBondContact OG1-CG 3.23Å; T24-L28 WeakPolarHBondContact O-CG 3.37Å; T24-L28 PolarHBondContact O-N 3.44Å | ||
| 25 | E | 88.4 | Confident | 87.2 | Confident | 72 Ų | 72 | 72.9 Ų | 72.9 | 34% | 0.336 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -56.1 | -42.4 | -177.9 | -58.7 | -177.4 | -178.7 | 0 | 0 | 112.1 | K27 L28 M29 S45 S48 | E25-K27 VanDerWaalsContact C-N 3.33Å; E25-K27 PolarHBondContact O-N 3.04Å; E25-L28 PolarHBondContact O-N 3.31Å; E25-M29 HydrophobicContact CB-CE 4Å; E25-M29 WeakPolarHBondContact O-CB 3.37Å; E25-M29 WeakPolarHBondContact O-CE 3.36Å; E25-M29 WeakPolarHBondContact O-CG 3.48Å; E25-M29 PolarHBondContact O-N 2.87Å; E25-S45 WeakPolarHBondContact OE1-CA 3.12Å; E25-S45 WeakPolarHBondContact OE1-CB 3.25Å; E25-S48 VanDerWaalsContact CG-OG 3.29Å; E25-S48 WeakPolarHBondContact CG-OG 3.21Å; E25-S48 PolarHBondContact OE1-OG 3.5Å; E25-S48 VanDerWaalsContact OE1-OG 3.12Å |
| 26 | D | 88.3 | Confident | 87 | Confident | 123 Ų | 123 | 76.2 Ų | 76.2 | 66% | 0.658 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -62.6 | -39.3 | -179.5 | -63.3 | -37.9 | 0 | 0 | 0 | 112.6 | T24 A30 | T24-D26 VanDerWaalsContact C-N 3.27Å; T24-D26 PolarHBondContact O-N 3.41Å; D26-A30 WeakPolarHBondContact O-CB 3.44Å; D26-A30 PolarHBondContact O-N 3.05Å |
| 27 | K | 89 | Confident | 86.9 | Confident | 65 Ų | 65 | 77.8 Ų | 77.8 | 28% | 0.283 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -76.1 | -40.6 | -178.8 | -65.7 | 177.4 | -165.1 | 163.4 | 0 | 111.5 | L16 V21 T22 T24 E25 M29 A30 L31 | L16-K27 HydrophobicContact CD1-CB 3.81Å; L16-K27 HydrophobicContact CD2-CB 4Å; L16-K27 HydrophobicContact CD2-CD 4.17Å; V21-K27 HydrophobicContact CG1-CD 3.46Å; V21-K27 VanDerWaalsContact CG1-CD 3.46Å; T22-K27 WeakPolarHBondContact O-CD 3.49Å; T22-K27 PolarHBondContact O-NZ 3.4Å; T22-K27 PolarHBondContact OG1-NZ 3.07Å; T24-K27 PolarHBondContact O-N 2.89Å; T24-K27 VanDerWaalsContact O-N 3.16Å; T24-K27 WeakPolarHBondContact OG1-CD 3.5Å; T24-K27 WeakPolarHBondContact OG1-CG 3.23Å; E25-K27 VanDerWaalsContact C-N 3.33Å; E25-K27 PolarHBondContact O-N 3.04Å; K27-M29 VanDerWaalsContact C-N 3.33Å; K27-M29 PolarHBondContact O-N 2.98Å; K27-A30 PolarHBondContact O-N 3.41Å; K27-L31 WeakPolarHBondContact O-CG 3.49Å; K27-L31 PolarHBondContact O-N 3.4Å |
| 28 | L | 88.8 | Confident | 86.7 | Confident | 0 Ų | 0 | 81.3 Ų | 81.3 | 0% | 0 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -57.9 | -49.5 | 171.4 | -67.4 | 172.6 | 0 | 0 | 0 | 109.8 | S12 A13 L16 V23 T24 E25 A30 L31 I32 P44 F47 | S12-L28 WeakPolarHBondContact OG-CD2 3.39Å; A13-L28 HydrophobicContact CB-CD2 4.26Å; L16-L28 HydrophobicContact CD1-CD2 3.7Å; L16-L28 HydrophobicContact CD1-CG 4.05Å; V23-L28 HydrophobicContact CG1-CD1 3.84Å; V23-L28 HydrophobicContact CG1-CD2 4.08Å; V23-L28 HydrophobicContact CG1-CG 4.12Å; T24-L28 WeakPolarHBondContact O-CG 3.37Å; T24-L28 PolarHBondContact O-N 3.44Å; E25-L28 PolarHBondContact O-N 3.31Å; L28-A30 VanDerWaalsContact C-N 3.32Å; L28-A30 PolarHBondContact O-N 3.14Å; L28-L31 PolarHBondContact O-N 2.96Å; L28-I32 HydrophobicContact CB-CD1 4.48Å; L28-I32 WeakPolarHBondContact O-CB 3.34Å; L28-I32 VanDerWaalsContact O-CD1 3.25Å; L28-I32 WeakPolarHBondContact O-CD1 3.49Å; L28-I32 WeakPolarHBondContact O-CG1 3.42Å; L28-I32 PolarHBondContact O-N 3.45Å; L28-P44 HydrophobicContact CB-CB 4.09Å; L28-P44 HydrophobicContact CD1-CB 4.31Å; L28-F47 HydrophobicContact CD1-CB 4.18Å |
| 29 | M | 88.3 | Confident | 86.4 | Confident | 57 Ų | 57 | 77 Ų | 77 | 28% | 0.281 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -61.6 | -36.7 | 176.6 | -77.6 | -169.9 | -89 | 0 | 0 | 113.2 | E25 K27 K33 P44 | E25-M29 HydrophobicContact CB-CE 4Å; E25-M29 WeakPolarHBondContact O-CB 3.37Å; E25-M29 WeakPolarHBondContact O-CE 3.36Å; E25-M29 WeakPolarHBondContact O-CG 3.48Å; E25-M29 PolarHBondContact O-N 2.87Å; K27-M29 VanDerWaalsContact C-N 3.33Å; K27-M29 PolarHBondContact O-N 2.98Å; M29-K33 WeakPolarHBondContact O-CB 3.2Å; M29-K33 WeakPolarHBondContact O-CG 3.31Å; M29-K33 PolarHBondContact O-N 3.15Å; M29-P44 HydrophobicContact CG-CB 4.21Å; M29-P44 HydrophobicContact CG-CG 4.06Å |
| 30 | A | 89.9 | Confident | 86.3 | Confident | 56 Ų | 56 | 77.8 Ų | 77.8 | 46% | 0.463 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -64.3 | -44.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | D26 K27 L28 K33 A34 | D26-A30 WeakPolarHBondContact O-CB 3.44Å; D26-A30 PolarHBondContact O-N 3.05Å; K27-A30 PolarHBondContact O-N 3.41Å; L28-A30 VanDerWaalsContact C-N 3.32Å; L28-A30 PolarHBondContact O-N 3.14Å; A30-K33 PolarHBondContact O-N 3.13Å; A30-A34 WeakPolarHBondContact O-CB 3.25Å; A30-A34 PolarHBondContact O-N 2.86Å |
| 31 | L | 88.2 | Confident | 86.5 | Confident | 54 Ų | 54 | 73.4 Ų | 73.4 | 28% | 0.283 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -65.9 | -42.2 | 177 | -69.8 | 175.8 | 0 | 0 | 0 | 111.9 | I15 L16 K27 L28 K33 A34 A35 | I15-L31 HydrophobicContact CB-CD1 4.5Å; I15-L31 HydrophobicContact CG2-CD1 4.34Å; L16-L31 HydrophobicContact CD1-CD1 4.15Å; L16-L31 HydrophobicContact CD2-CD1 3.91Å; L16-L31 HydrophobicContact CG-CD1 3.73Å; K27-L31 WeakPolarHBondContact O-CG 3.49Å; K27-L31 PolarHBondContact O-N 3.4Å; L28-L31 PolarHBondContact O-N 2.96Å; L31-K33 VanDerWaalsContact C-N 3.34Å; L31-K33 PolarHBondContact O-N 3.22Å; L31-A34 PolarHBondContact O-N 3.39Å; L31-A35 WeakPolarHBondContact O-CB 3.41Å; L31-A35 PolarHBondContact O-N 3.47Å |
| 32 | I | 88.8 | Confident | 86.7 | Confident | 12 Ų | 12 | 76.3 Ų | 76.3 | 6% | 0.062 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -62.7 | -42.3 | 177.7 | -68.5 | 161.3 | 0 | 0 | 0 | 111 | L28 A35 N36 V37 I39 P44 | L28-I32 HydrophobicContact CB-CD1 4.48Å; L28-I32 WeakPolarHBondContact O-CB 3.34Å; L28-I32 VanDerWaalsContact O-CD1 3.25Å; L28-I32 WeakPolarHBondContact O-CD1 3.49Å; L28-I32 WeakPolarHBondContact O-CG1 3.42Å; L28-I32 PolarHBondContact O-N 3.45Å; I32-A35 PolarHBondContact O-N 2.92Å; I32-N36 PolarHBondContact O-N 2.75Å; I32-V37 HydrophobicContact CG2-CB 4.41Å; I32-V37 WeakPolarHBondContact CG2-O 3.38Å; I32-V37 PolarHBondContact O-N 3.34Å; I32-V37 VanDerWaalsContact O-N 3.17Å; I32-I39 HydrophobicContact CB-CD1 4.16Å; I32-I39 HydrophobicContact CD1-CD1 3.68Å; I32-I39 HydrophobicContact CG1-CD1 3.58Å; I32-I39 HydrophobicContact CG2-CB 4.02Å; I32-I39 HydrophobicContact CG2-CD1 3.48Å; I32-I39 VanDerWaalsContact CG2-CD1 3.48Å; I32-I39 HydrophobicContact CG2-CG1 3.59Å; I32-P44 HydrophobicContact CD1-CG 3.84Å |
| 33 | K | 88.4 | Confident | 86.9 | Confident | 150 Ų | 150 | 74.3 Ų | 74.3 | 65% | 0.652 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -65.4 | -41.1 | 174.2 | -74.7 | 171.7 | -176 | 173.6 | 0 | 111.9 | M29 A30 L31 A35 N36 | M29-K33 WeakPolarHBondContact O-CB 3.2Å; M29-K33 WeakPolarHBondContact O-CG 3.31Å; M29-K33 PolarHBondContact O-N 3.15Å; A30-K33 PolarHBondContact O-N 3.13Å; L31-K33 VanDerWaalsContact C-N 3.34Å; L31-K33 PolarHBondContact O-N 3.22Å; K33-A35 VanDerWaalsContact C-N 3.25Å; K33-A35 PolarHBondContact O-N 2.85Å; K33-N36 PolarHBondContact O-N 3.2Å; K33-N36 VanDerWaalsContact O-N 3.08Å |
| 34 | A | 90.3 | Very high | 87.1 | Confident | 78 Ų | 78 | 73 Ų | 73 | 65% | 0.645 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -62.9 | -34.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | A30 L31 N36 | A30-A34 WeakPolarHBondContact O-CB 3.25Å; A30-A34 PolarHBondContact O-N 2.86Å; L31-A34 PolarHBondContact O-N 3.39Å; A34-N36 PolarHBondContact O-N 3.01Å |
| 35 | A | 87.8 | Confident | 87.1 | Confident | 63 Ų | 63 | 72 Ų | 72 | 52% | 0.521 | 40% | 0.399 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.2 | -3.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | L31 I32 K33 V37 | L31-A35 WeakPolarHBondContact O-CB 3.41Å; L31-A35 PolarHBondContact O-N 3.47Å; I32-A35 PolarHBondContact O-N 2.92Å; K33-A35 VanDerWaalsContact C-N 3.25Å; K33-A35 PolarHBondContact O-N 2.85Å; A35-V37 HydrophobicContact CB-CG2 3.97Å; A35-V37 PolarHBondContact O-N 2.87Å |
| 36 | N | 85.7 | Confident | 87.1 | Confident | 150 Ų | 150 | 71.7 Ų | 71.7 | 80% | 0.802 | 40% | 0.399 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.4 | 32 | -174.5 | -60.2 | -60.3 | 0 | 0 | 0 | 113.8 | I32 K33 A34 | I32-N36 PolarHBondContact O-N 2.75Å; K33-N36 PolarHBondContact O-N 3.2Å; K33-N36 VanDerWaalsContact O-N 3.08Å; A34-N36 PolarHBondContact O-N 3.01Å |
| 37 | V | 85.9 | Confident | 87 | Confident | 44 Ų | 44 | 67.5 Ų | 67.5 | 27% | 0.267 | 38% | 0.375 | S | S | . | . | trans | -98.9 | 130.7 | 177.8 | -174 | 0 | 0 | 0 | 0 | 109.4 | V4 A8 I32 A35 I39 | V4-V37 HydrophobicContact CG1-CG1 4.35Å; A8-V37 HydrophobicContact CB-CG1 4.22Å; I32-V37 HydrophobicContact CG2-CB 4.41Å; I32-V37 WeakPolarHBondContact CG2-O 3.38Å; I32-V37 PolarHBondContact O-N 3.34Å; I32-V37 VanDerWaalsContact O-N 3.17Å; A35-V37 HydrophobicContact CB-CG2 3.97Å; A35-V37 PolarHBondContact O-N 2.87Å; V37-I39 HydrophobicContact CB-CD1 4.46Å; V37-I39 HydrophobicContact CB-CG1 4.3Å; V37-I39 HydrophobicContact CG1-CD1 4.01Å; V37-I39 HydrophobicContact CG1-CG1 3.66Å; V37-I39 PolarHBondContact O-N 2.92Å | ||
| 38 | T | 80.1 | Confident | 86.9 | Confident | 141 Ų | 141 | 65.2 Ų | 65.2 | 87% | 0.865 | 37% | 0.368 | S | S | * | . | trans | -85.2 | 109.4 | 173.4 | 52.8 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 39 | I | 83.1 | Confident | 86.8 | Confident | 29 Ų | 29 | 72.2 Ų | 72.2 | 15% | 0.149 | 40% | 0.398 | C | S | . | . | trans | -123.2 | 141.9 | 178.2 | -49.1 | -179.4 | 0 | 0 | 0 | 108.8 | A8 I32 V37 W43 | A8-I39 HydrophobicContact CB-CD1 3.35Å; A8-I39 HydrophobicContact CB-CG1 4.5Å; I32-I39 HydrophobicContact CB-CD1 4.16Å; I32-I39 HydrophobicContact CD1-CD1 3.68Å; I32-I39 HydrophobicContact CG1-CD1 3.58Å; I32-I39 HydrophobicContact CG2-CB 4.02Å; I32-I39 HydrophobicContact CG2-CD1 3.48Å; I32-I39 VanDerWaalsContact CG2-CD1 3.48Å; I32-I39 HydrophobicContact CG2-CG1 3.59Å; V37-I39 HydrophobicContact CB-CD1 4.46Å; V37-I39 HydrophobicContact CB-CG1 4.3Å; V37-I39 HydrophobicContact CG1-CD1 4.01Å; V37-I39 HydrophobicContact CG1-CG1 3.66Å; V37-I39 PolarHBondContact O-N 2.92Å; I39-W43 HydrophobicContact CG2-CB 3.95Å; I39-W43 HydrophobicContact CG2-CG 4.16Å | ||
| 40 | E | 84.8 | Confident | 86.6 | Confident | 126 Ų | 126 | 71.7 Ų | 71.7 | 59% | 0.589 | 40% | 0.402 | S | S | * | . | trans | -66.6 | 135.6 | 176.2 | -164 | 174 | -174.3 | 0 | 0 | 110.3 | F42 W43 P44 | E40-F42 HydrophobicContact CG-CB 4.14Å; E40-F42 PolarHBondContact O-N 3.05Å; E40-W43 PolarHBondContact O-N 3.29Å; E40-P44 VanDerWaalsContact O-CD 3.23Å; E40-P44 WeakPolarHBondContact O-CD 3.29Å | ||
| 41 | P | 83.9 | Confident | 86.3 | Confident | 93 Ų | 93 | 70.7 Ų | 70.7 | 60% | 0.604 | 39% | 0.389 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.2 | -15.8 | -178.9 | 23.6 | -34.7 | 0 | 0 | 0 | 113.6 | W43 P44 S45 | P41-W43 VanDerWaalsContact C-N 3.29Å; P41-W43 PolarHBondContact O-N 2.98Å; P41-P44 WeakPolarHBondContact O-CD 3.47Å; P41-S45 PolarHBondContact O-N 3.12Å |
| 42 | F | 86.8 | Confident | 86 | Confident | 114 Ų | 114 | 72.3 Ų | 72.3 | 50% | 0.5 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -54.1 | -44.8 | 170.7 | -179.9 | -106.3 | 0 | 0 | 0 | 112.2 | E40 S45 L46 | E40-F42 HydrophobicContact CG-CB 4.14Å; E40-F42 PolarHBondContact O-N 3.05Å; F42-S45 PolarHBondContact O-N 3.02Å; F42-S45 PolarHBondContact O-OG 3Å; F42-L46 HydrophobicContact CE1-CD1 3.73Å; F42-L46 HydrophobicContact CZ-CD1 3.87Å; F42-L46 WeakPolarHBondContact O-CB 3.36Å; F42-L46 PolarHBondContact O-N 2.78Å |
| 43 | W | 87.8 | Confident | 85.5 | Confident | 55 Ų | 55 | 77 Ų | 77 | 21% | 0.208 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -67.9 | -52.3 | -173.7 | -66.4 | 102.5 | 0 | 0 | 0 | 113.5 | E6 C9 I39 E40 P41 S45 L46 F47 | E6-W43 HydrophobicContact CG-CD2 4.38Å; E6-W43 HydrophobicContact CG-CE3 4.04Å; E6-W43 HydrophobicContact CG-CH2 3.31Å; E6-W43 HydrophobicContact CG-CZ2 3.74Å; E6-W43 HydrophobicContact CG-CZ3 3.49Å; E6-W43 VanDerWaalsContact CG-CZ3 3.49Å; E6-W43 VanDerWaalsContact OE1-CH2 3.31Å; E6-W43 WeakPolarHBondContact OE1-CH2 3.21Å; C9-W43 WeakPolarHBondContact SG-CB 3.11Å; I39-W43 HydrophobicContact CG2-CB 3.95Å; I39-W43 HydrophobicContact CG2-CG 4.16Å; E40-W43 PolarHBondContact O-N 3.29Å; P41-W43 VanDerWaalsContact C-N 3.29Å; P41-W43 PolarHBondContact O-N 2.98Å; W43-S45 PolarHBondContact O-N 3.36Å; W43-L46 PolarHBondContact O-N 2.94Å; W43-F47 HydrophobicContact CB-CD2 4.49Å; W43-F47 HydrophobicContact CE3-CD2 4.38Å; W43-F47 AromaticContact CE3-CE2 3.75Å; W43-F47 HydrophobicContact CE3-CE2 3.75Å; W43-F47 HydrophobicContact CZ3-CE2 4.36Å; W43-F47 VanDerWaalsContact O-CD2 3.28Å; W43-F47 WeakPolarHBondContact O-CD2 3.45Å; W43-F47 PolarHBondContact O-N 3.05Å |
| 44 | P | 87.6 | Confident | 85.1 | Confident | 3 Ų | 3 | 72.3 Ų | 72.3 | 2% | 0.019 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -54 | -37.4 | 174.8 | -27.4 | 35.2 | 0 | 0 | 0 | 113.4 | L28 M29 I32 E40 P41 S48 | L28-P44 HydrophobicContact CB-CB 4.09Å; L28-P44 HydrophobicContact CD1-CB 4.31Å; M29-P44 HydrophobicContact CG-CB 4.21Å; M29-P44 HydrophobicContact CG-CG 4.06Å; I32-P44 HydrophobicContact CD1-CG 3.84Å; E40-P44 VanDerWaalsContact O-CD 3.23Å; E40-P44 WeakPolarHBondContact O-CD 3.29Å; P41-P44 WeakPolarHBondContact O-CD 3.47Å; P44-S48 WeakPolarHBondContact O-CB 3.28Å; P44-S48 PolarHBondContact O-N 3.18Å; P44-S48 PolarHBondContact O-OG 3.41Å |
| 45 | S | 88.1 | Confident | 84.7 | Confident | 27 Ų | 27 | 73.4 Ų | 73.4 | 19% | 0.189 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -71.7 | -30.7 | 178.7 | 82.9 | 0 | 0 | 0 | 0 | 114 | E25 P41 F42 W43 S48 K49 | E25-S45 WeakPolarHBondContact OE1-CA 3.12Å; E25-S45 WeakPolarHBondContact OE1-CB 3.25Å; P41-S45 PolarHBondContact O-N 3.12Å; F42-S45 PolarHBondContact O-N 3.02Å; F42-S45 PolarHBondContact O-OG 3Å; W43-S45 PolarHBondContact O-N 3.36Å; S45-S48 PolarHBondContact O-OG 2.86Å; S45-K49 WeakPolarHBondContact O-CD 3.31Å; S45-K49 WeakPolarHBondContact O-CG 3.22Å |
| 46 | L | 88.1 | Confident | 84.3 | Confident | 66 Ų | 66 | 71.2 Ų | 71.2 | 35% | 0.346 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -72.6 | -49.1 | 174.6 | -173.4 | 163.7 | 0 | 0 | 0 | 109.4 | F42 W43 S48 K49 A50 | F42-L46 HydrophobicContact CE1-CD1 3.73Å; F42-L46 HydrophobicContact CZ-CD1 3.87Å; F42-L46 WeakPolarHBondContact O-CB 3.36Å; F42-L46 PolarHBondContact O-N 2.78Å; W43-L46 PolarHBondContact O-N 2.94Å; L46-S48 PolarHBondContact O-N 2.97Å; L46-K49 PolarHBondContact O-N 3.36Å; L46-A50 HydrophobicContact CD2-CB 4.25Å; L46-A50 VanDerWaalsContact O-CB 3.31Å; L46-A50 WeakPolarHBondContact O-CB 3.3Å; L46-A50 PolarHBondContact O-N 3.46Å |
| 47 | F | 85.1 | Confident | 84 | Confident | 34 Ų | 34 | 65.2 Ų | 65.2 | 15% | 0.149 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -65.7 | -37.4 | -177.9 | -83.1 | -79.6 | 0 | 0 | 0 | 112.6 | C9 I10 L28 W43 K49 A50 L51 | C9-F47 HydrophobicContact CB-CD2 3.49Å; C9-F47 VanDerWaalsContact CB-CD2 3.49Å; C9-F47 HydrophobicContact CB-CE2 3.46Å; C9-F47 VanDerWaalsContact CB-CE2 3.46Å; C9-F47 HydrophobicContact CB-CG 4.26Å; C9-F47 HydrophobicContact CB-CZ 4.21Å; I10-F47 HydrophobicContact CD1-CZ 4.41Å; I10-F47 HydrophobicContact CG1-CE1 3.82Å; I10-F47 HydrophobicContact CG1-CZ 3.69Å; L28-F47 HydrophobicContact CD1-CB 4.18Å; W43-F47 HydrophobicContact CB-CD2 4.49Å; W43-F47 HydrophobicContact CE3-CD2 4.38Å; W43-F47 AromaticContact CE3-CE2 3.75Å; W43-F47 HydrophobicContact CE3-CE2 3.75Å; W43-F47 HydrophobicContact CZ3-CE2 4.36Å; W43-F47 VanDerWaalsContact O-CD2 3.28Å; W43-F47 WeakPolarHBondContact O-CD2 3.45Å; W43-F47 PolarHBondContact O-N 3.05Å; F47-K49 VanDerWaalsContact C-N 3.3Å; F47-K49 PolarHBondContact O-N 3.46Å; F47-A50 PolarHBondContact O-N 3.47Å; F47-L51 HydrophobicContact CB-CD1 4.38Å; F47-L51 HydrophobicContact CD1-CD1 4.12Å; F47-L51 WeakPolarHBondContact O-CB 3.49Å; F47-L51 WeakPolarHBondContact O-CG 3.4Å; F47-L51 PolarHBondContact O-N 3.39Å |
| 48 | S | 87.1 | Confident | 83.7 | Confident | 18 Ų | 18 | 64.3 Ų | 64.3 | 13% | 0.126 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -60 | -40.1 | 175 | 68.2 | 0 | 0 | 0 | 0 | 112.2 | E25 P44 S45 L46 A52 | E25-S48 VanDerWaalsContact CG-OG 3.29Å; E25-S48 WeakPolarHBondContact CG-OG 3.21Å; E25-S48 PolarHBondContact OE1-OG 3.5Å; E25-S48 VanDerWaalsContact OE1-OG 3.12Å; P44-S48 WeakPolarHBondContact O-CB 3.28Å; P44-S48 PolarHBondContact O-N 3.18Å; P44-S48 PolarHBondContact O-OG 3.41Å; S45-S48 PolarHBondContact O-OG 2.86Å; L46-S48 PolarHBondContact O-N 2.97Å; S48-A52 PolarHBondContact O-N 3.5Å |
| 49 | K | 87.6 | Confident | 83.7 | Confident | 146 Ų | 146 | 62 Ų | 62 | 64% | 0.635 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -77.6 | -42.8 | 179.5 | -68.7 | 171.5 | -172.5 | 166.4 | 0 | 112.4 | S45 L46 F47 L51 A52 | S45-K49 WeakPolarHBondContact O-CD 3.31Å; S45-K49 WeakPolarHBondContact O-CG 3.22Å; L46-K49 PolarHBondContact O-N 3.36Å; F47-K49 VanDerWaalsContact C-N 3.3Å; F47-K49 PolarHBondContact O-N 3.46Å; K49-L51 VanDerWaalsContact C-N 3.33Å; K49-L51 PolarHBondContact O-N 3.25Å; K49-A52 PolarHBondContact O-N 3.37Å |
| 50 | A | 84.9 | Confident | 83.5 | Confident | 46 Ų | 46 | 65 Ų | 65 | 38% | 0.38 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -66.2 | -37.6 | -179 | 0 | 0 | 0 | 0 | 0 | 111.6 | L46 F47 V54 | L46-A50 HydrophobicContact CD2-CB 4.25Å; L46-A50 VanDerWaalsContact O-CB 3.31Å; L46-A50 WeakPolarHBondContact O-CB 3.3Å; L46-A50 PolarHBondContact O-N 3.46Å; F47-A50 PolarHBondContact O-N 3.47Å; A50-V54 WeakPolarHBondContact O-CG2 3.37Å |
| 51 | L | 81.8 | Confident | 83.1 | Confident | 36 Ų | 36 | 64.3 Ų | 64.3 | 19% | 0.188 | 38% | 0.377 | C | S | . | . | G | 310 helix | trans | -85.5 | -7.2 | -177.1 | -61.4 | 174.2 | 0 | 0 | 0 | 113.8 | A13 V23 F47 K49 S53 V54 I56 | A13-L51 HydrophobicContact CB-CD1 3.52Å; V23-L51 HydrophobicContact CG1-CD1 4.04Å; F47-L51 HydrophobicContact CB-CD1 4.38Å; F47-L51 HydrophobicContact CD1-CD1 4.12Å; F47-L51 WeakPolarHBondContact O-CB 3.49Å; F47-L51 WeakPolarHBondContact O-CG 3.4Å; F47-L51 PolarHBondContact O-N 3.39Å; K49-L51 VanDerWaalsContact C-N 3.33Å; K49-L51 PolarHBondContact O-N 3.25Å; L51-S53 VanDerWaalsContact C-N 3.25Å; L51-S53 PolarHBondContact O-N 3.15Å; L51-V54 HydrophobicContact CD2-CB 4.44Å; L51-V54 HydrophobicContact CD2-CG1 4.33Å; L51-V54 PolarHBondContact O-N 3.45Å; L51-I56 HydrophobicContact CB-CD1 4.49Å; L51-I56 HydrophobicContact CD1-CD1 4.23Å; L51-I56 HydrophobicContact CD2-CD1 4.11Å; L51-I56 HydrophobicContact CD2-CG1 4.01Å |
| 52 | A | 81.9 | Confident | 82.7 | Confident | 88 Ų | 88 | 64 Ų | 64 | 73% | 0.727 | 37% | 0.37 | S | S | * | . | G | 310 helix | trans | -63.8 | -29.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | S48 K49 | S48-A52 PolarHBondContact O-N 3.5Å; K49-A52 PolarHBondContact O-N 3.37Å |
| 53 | S | 79.5 | Confident | 81.7 | Confident | 111 Ų | 111 | 64.6 Ų | 64.6 | 78% | 0.776 | 38% | 0.383 | S | S | * | . | G | 310 helix | trans | -114.8 | 10.7 | -178.4 | 65.4 | 0 | 0 | 0 | 0 | 113.4 | L51 | L51-S53 VanDerWaalsContact C-N 3.25Å; L51-S53 PolarHBondContact O-N 3.15Å |
| 54 | V | 79.9 | Confident | 80.3 | Confident | 51 Ų | 51 | 66 Ų | 66 | 31% | 0.309 | 41% | 0.414 | S | S | . | . | trans | -117.1 | 124 | -170.4 | 169.9 | 0 | 0 | 0 | 0 | 109.5 | A50 L51 I56 L59 | A50-V54 WeakPolarHBondContact O-CG2 3.37Å; L51-V54 HydrophobicContact CD2-CB 4.44Å; L51-V54 HydrophobicContact CD2-CG1 4.33Å; L51-V54 PolarHBondContact O-N 3.45Å; V54-I56 PolarHBondContact O-N 3.01Å; V54-L59 HydrophobicContact CG1-CD1 3.11Å; V54-L59 HydrophobicContact CG1-CG 3.86Å | ||
| 55 | D | 80.7 | Confident | 78.9 | Confident | 101 Ų | 101 | 69 Ų | 69 | 54% | 0.54 | 44% | 0.44 | S | S | . | . | trans | -81.9 | 98.4 | 172.3 | -176.8 | -2.2 | 0 | 0 | 0 | 109.7 | G57 S58 L59 | D55-G57 VanDerWaalsContact C-N 3.27Å; D55-G57 PolarHBondContact O-N 3.28Å; D55-G57 PolarHBondContact OD1-N 3.04Å; D55-S58 WeakPolarHBondContact CB-OG 3.11Å; D55-S58 PolarHBondContact O-N 3.24Å; D55-S58 PolarHBondContact O-OG 3.42Å; D55-S58 PolarHBondContact OD1-N 3.39Å; D55-L59 PolarHBondContact O-N 3.06Å | ||
| 56 | I | 79.4 | Confident | 77 | Confident | 17 Ų | 17 | 71.2 Ų | 71.2 | 9% | 0.087 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -61.1 | -36.9 | -175.7 | -57.7 | 170.5 | 0 | 0 | 0 | 110.7 | L14 H17 V23 L51 V54 L59 I60 | L14-I56 HydrophobicContact CD2-CG2 3.9Å; H17-I56 HydrophobicContact CB-CD1 3.96Å; H17-I56 HydrophobicContact CB-CG2 4.48Å; V23-I56 HydrophobicContact CG2-CD1 4.49Å; L51-I56 HydrophobicContact CB-CD1 4.49Å; L51-I56 HydrophobicContact CD1-CD1 4.23Å; L51-I56 HydrophobicContact CD2-CD1 4.11Å; L51-I56 HydrophobicContact CD2-CG1 4.01Å; V54-I56 PolarHBondContact O-N 3.01Å; I56-L59 PolarHBondContact O-N 3.21Å; I56-I60 HydrophobicContact CG2-CD1 3.92Å; I56-I60 HydrophobicContact CG2-CG1 4.46Å; I56-I60 VanDerWaalsContact O-CG1 3.3Å; I56-I60 WeakPolarHBondContact O-CG1 3.26Å; I56-I60 PolarHBondContact O-N 3.24Å |
| 57 | G | 79.5 | Confident | 75.6 | Confident | 24 Ų | 24 | 72.4 Ų | 72.4 | 25% | 0.247 | 49% | 0.494 | C | S | . | . | H | α-helix | trans | -63.7 | -43.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | D55 L59 I60 C61 | D55-G57 VanDerWaalsContact C-N 3.27Å; D55-G57 PolarHBondContact O-N 3.28Å; D55-G57 PolarHBondContact OD1-N 3.04Å; G57-L59 VanDerWaalsContact C-N 3.32Å; G57-L59 PolarHBondContact O-N 3.31Å; G57-I60 PolarHBondContact O-N 3.45Å; G57-C61 PolarHBondContact O-N 3.44Å; G57-C61 VanDerWaalsContact O-N 3.15Å; G57-C61 PolarHBondContact O-SG 3.31Å; G57-C61 VanDerWaalsContact O-SG 3.37Å |
| 58 | S | 80.3 | Confident | 73.9 | Confident | 25 Ų | 25 | 74 Ų | 74 | 18% | 0.175 | 52% | 0.521 | C | S | . | . | H | α-helix | trans | -64.9 | -36 | 175.7 | 80.7 | 0 | 0 | 0 | 0 | 112.5 | D55 N62 | D55-S58 WeakPolarHBondContact CB-OG 3.11Å; D55-S58 PolarHBondContact O-N 3.24Å; D55-S58 PolarHBondContact O-OG 3.42Å; D55-S58 PolarHBondContact OD1-N 3.39Å; S58-N62 VanDerWaalsContact O-CB 3.26Å; S58-N62 WeakPolarHBondContact O-CB 3.11Å; S58-N62 PolarHBondContact O-N 3.28Å; S58-N62 VanDerWaalsContact O-N 3.09Å; S58-N62 PolarHBondContact O-ND2 3.09Å |
| 59 | L | 79.9 | Confident | 72.1 | Confident | 93 Ų | 93 | 76.4 Ų | 76.4 | 49% | 0.487 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -66.8 | -43.5 | 177.8 | -76.6 | -173.4 | 0 | 0 | 0 | 111.8 | V54 D55 I56 G57 C61 N62 V63 | V54-L59 HydrophobicContact CG1-CD1 3.11Å; V54-L59 HydrophobicContact CG1-CG 3.86Å; D55-L59 PolarHBondContact O-N 3.06Å; I56-L59 PolarHBondContact O-N 3.21Å; G57-L59 VanDerWaalsContact C-N 3.32Å; G57-L59 PolarHBondContact O-N 3.31Å; L59-C61 VanDerWaalsContact C-N 3.34Å; L59-N62 CarbonylContact O-C 3.5Å; L59-N62 PolarHBondContact O-N 3.37Å; L59-V63 WeakPolarHBondContact O-CG2 3.49Å; L59-V63 PolarHBondContact O-N 2.9Å |
| 60 | I | 78.8 | Confident | 70.3 | Confident | 92 Ų | 92 | 73.3 Ų | 73.3 | 47% | 0.472 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -63.3 | -42.9 | 178.8 | -66.5 | 165 | 0 | 0 | 0 | 110.5 | L14 I56 G57 N62 | L14-I60 HydrophobicContact CD2-CD1 3.78Å; I56-I60 HydrophobicContact CG2-CD1 3.92Å; I56-I60 HydrophobicContact CG2-CG1 4.46Å; I56-I60 VanDerWaalsContact O-CG1 3.3Å; I56-I60 WeakPolarHBondContact O-CG1 3.26Å; I56-I60 PolarHBondContact O-N 3.24Å; G57-I60 PolarHBondContact O-N 3.45Å; I60-N62 VanDerWaalsContact C-N 3.27Å; I60-N62 PolarHBondContact O-N 2.76Å |
| 61 | C | 77.5 | Confident | 68.7 | Low | 110 Ų | 110 | 77 Ų | 77 | 74% | 0.743 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -69.8 | -23.6 | 179.4 | -69.4 | 0 | 0 | 0 | 0 | 113.5 | G57 L59 | G57-C61 PolarHBondContact O-N 3.44Å; G57-C61 VanDerWaalsContact O-N 3.15Å; G57-C61 PolarHBondContact O-SG 3.31Å; G57-C61 VanDerWaalsContact O-SG 3.37Å; L59-C61 VanDerWaalsContact C-N 3.34Å |
| 62 | N | 75.5 | Confident | 67.2 | Low | 86 Ų | 86 | 80.5 Ų | 80.5 | 46% | 0.46 | 60% | 0.597 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -114.3 | 18.6 | -175.8 | -65 | -39.5 | 0 | 0 | 0 | 113.4 | S58 L59 I60 G64 A65 | S58-N62 VanDerWaalsContact O-CB 3.26Å; S58-N62 WeakPolarHBondContact O-CB 3.11Å; S58-N62 PolarHBondContact O-N 3.28Å; S58-N62 VanDerWaalsContact O-N 3.09Å; S58-N62 PolarHBondContact O-ND2 3.09Å; L59-N62 CarbonylContact O-C 3.5Å; L59-N62 PolarHBondContact O-N 3.37Å; I60-N62 VanDerWaalsContact C-N 3.27Å; I60-N62 PolarHBondContact O-N 2.76Å; N62-G64 PolarHBondContact O-N 3.46Å; N62-A65 HydrophobicContact CB-CB 4.27Å; N62-A65 PolarHBondContact O-N 3.06Å |
| 63 | V | 63.8 | Low | 65.7 | Low | 128 Ų | 128 | 80.9 Ų | 80.9 | 78% | 0.776 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57 | 106.7 | 177.4 | 176.9 | 0 | 0 | 0 | 0 | 109.4 | L59 | L59-V63 WeakPolarHBondContact O-CG2 3.49Å; L59-V63 PolarHBondContact O-N 2.9Å |
| 64 | G | 59.9 | Low | 64.2 | Low | 84 Ų | 84 | 79.6 Ų | 79.6 | 87% | 0.866 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 112.5 | -12.3 | -178.3 | 0 | 0 | 0 | 0 | 0 | 115.3 | N62 | N62-G64 PolarHBondContact O-N 3.46Š|
| 65 | A | 56.9 | Low | 62.1 | Low | 67 Ų | 67 | 80.9 Ų | 80.9 | 55% | 0.554 | 63% | 0.629 | S | S | * | * | S | Bend | trans | -83.9 | 114.4 | 165 | 0 | 0 | 0 | 0 | 0 | 108 | N62 | N62-A65 HydrophobicContact CB-CB 4.27Å; N62-A65 PolarHBondContact O-N 3.06Å |
| 66 | G | 48.9 | Very low | 59.9 | Low | 73 Ų | 73 | 81 Ų | 81 | 75% | 0.753 | 64% | 0.644 | S | S | * | * | trans | -48.1 | 143.5 | 179 | 0 | 0 | 0 | 0 | 0 | 112.4 | G68 | G66-G68 PolarHBondContact O-N 2.88Š| ||
| 67 | G | 58.2 | Low | 57.8 | Low | 90 Ų | 90 | 84.7 Ų | 84.7 | 93% | 0.928 | 68% | 0.677 | S | S | * | * | S | Bend | trans | -39.1 | 124.5 | -167.4 | 0 | 0 | 0 | 0 | 0 | 115 | ||
| 68 | G | 50.5 | Low | 56.1 | Low | 69 Ų | 69 | 89.6 Ų | 89.6 | 71% | 0.711 | 70% | 0.704 | S | S | * | * | trans | 163.5 | 51.9 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113 | G66 A70 | G66-G68 PolarHBondContact O-N 2.88Å; G68-A70 PolarHBondContact O-N 3.44Å | ||
| 69 | A | 48.9 | Very low | 54.2 | Low | 68 Ų | 68 | 93 Ų | 93 | 56% | 0.562 | 73% | 0.733 | S | S | * | * | trans | -73.7 | 79.4 | 157.5 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 70 | A | 49.4 | Very low | 51.9 | Low | 80 Ų | 80 | 93.4 Ų | 93.4 | 66% | 0.661 | 75% | 0.75 | S | S | * | * | trans | -63.9 | 138.8 | 165.1 | 0 | 0 | 0 | 0 | 0 | 108.1 | G68 A72 | G68-A70 PolarHBondContact O-N 3.44Å; A70-A72 PolarHBondContact O-N 2.88Å | ||
| 71 | P | 52.3 | Low | 49.7 | Very low | 125 Ų | 125 | 96.4 Ų | 96.4 | 81% | 0.812 | 77% | 0.767 | S | S | * | * | trans | -59.5 | 117.6 | 177.5 | 22.4 | -30.7 | 0 | 0 | 0 | 109.5 | A73 | P71-A73 VanDerWaalsContact C-N 3.28Å; P71-A73 PolarHBondContact O-N 2.93Å | ||
| 72 | A | 50.3 | Low | 47.7 | Very low | 109 Ų | 109 | 94.9 Ų | 94.9 | 90% | 0.901 | 76% | 0.763 | S | S | * | * | trans | -73.5 | 83 | 173.7 | 0 | 0 | 0 | 0 | 0 | 109.5 | A70 G74 | A70-A72 PolarHBondContact O-N 2.88Å; A72-G74 PolarHBondContact O-N 3.48Å | ||
| 73 | A | 49.6 | Very low | 46.1 | Very low | 95 Ų | 95 | 96.5 Ų | 96.5 | 79% | 0.785 | 78% | 0.778 | S | S | * | * | trans | -85.7 | 103.2 | 164.1 | 0 | 0 | 0 | 0 | 0 | 108.6 | P71 | P71-A73 VanDerWaalsContact C-N 3.28Å; P71-A73 PolarHBondContact O-N 2.93Å | ||
| 74 | G | 47.6 | Very low | 44.7 | Very low | 84 Ų | 84 | 95.1 Ų | 95.1 | 87% | 0.866 | 78% | 0.78 | S | S | * | * | trans | -65.4 | 143.5 | 170 | 0 | 0 | 0 | 0 | 0 | 112.2 | A72 | A72-G74 PolarHBondContact O-N 3.48Š| ||
| 75 | G | 36.3 | Very low | 43.4 | Very low | 79 Ų | 79 | 100.3 Ų | 100.3 | 81% | 0.814 | 78% | 0.779 | S | S | * | * | trans | -179.8 | 96.3 | 172.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 76 | A | 35 | Very low | 42.2 | Very low | 104 Ų | 104 | 105.1 Ų | 105.1 | 86% | 0.86 | 79% | 0.79 | S | S | * | * | trans | -67.8 | 129.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 77 | A | 34.3 | Very low | 41.4 | Very low | 94 Ų | 94 | 110.2 Ų | 110.2 | 78% | 0.777 | 79% | 0.794 | S | S | * | * | trans | 46.5 | 149.8 | 143 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 78 | P | 44.6 | Very low | 40.2 | Very low | 126 Ų | 126 | 114.4 Ų | 114.4 | 82% | 0.818 | 79% | 0.789 | S | S | * | * | cis | -138.4 | 173.4 | 32.8 | 36.8 | -15.3 | 0 | 0 | 0 | 117.5 | ||||
| 79 | A | 39.2 | Very low | 39.6 | Very low | 96 Ų | 96 | 120 Ų | 120 | 79% | 0.793 | 79% | 0.794 | S | S | * | * | trans | -51.8 | 148.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 80 | A | 32.6 | Very low | 38.9 | Very low | 102 Ų | 102 | 125.1 Ų | 125.1 | 84% | 0.843 | 80% | 0.804 | S | S | * | * | trans | -138.4 | 109.9 | 150.3 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 81 | D | 32.8 | Very low | 38.2 | Very low | 156 Ų | 156 | 128.8 Ų | 128.8 | 83% | 0.834 | 81% | 0.807 | S | S | * | * | trans | -35.3 | 123.5 | 158.5 | -108.8 | -112 | 0 | 0 | 0 | 112.6 | ||||
| 82 | A | 34.4 | Very low | 37.5 | Very low | 78 Ų | 78 | 132.6 Ų | 132.6 | 65% | 0.645 | 81% | 0.814 | S | S | * | * | 101.5 | 159 | 92.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 83 | P | 42.7 | Very low | 37.1 | Very low | 120 Ų | 120 | 136.5 Ų | 136.5 | 78% | 0.779 | 81% | 0.811 | S | S | * | * | cis | -135.4 | 162.8 | -21.8 | 31.9 | -10.9 | 0 | 0 | 0 | 116.5 | ||||
| 84 | A | 34 | Very low | 36.5 | Very low | 99 Ų | 99 | 140.2 Ų | 140.2 | 82% | 0.818 | 81% | 0.809 | S | S | * | * | trans | 34.6 | 129.8 | 138.1 | 0 | 0 | 0 | 0 | 0 | 124.6 | ||||
| 85 | K | 33.7 | Very low | 35.9 | Very low | 193 Ų | 193 | 144.5 Ų | 144.5 | 84% | 0.839 | 81% | 0.807 | S | S | * | * | trans | -156.8 | 101.1 | 133.4 | -116 | -180 | 178.2 | -177.8 | 0 | 108.5 | ||||
| 86 | E | 31.1 | Very low | 35.7 | Very low | 167 Ų | 167 | 149.7 Ų | 149.7 | 78% | 0.78 | 81% | 0.809 | S | S | * | * | 48.3 | 101 | 109.3 | -81.7 | 177.4 | 170 | 0 | 0 | 113.6 | |||||
| 87 | E | 31.3 | Very low | 35.8 | Very low | 181 Ų | 181 | 150.4 Ų | 150.4 | 85% | 0.846 | 81% | 0.808 | S | S | * | * | 69.7 | 111.2 | 95.9 | -86.3 | -164.3 | 162.5 | 0 | 0 | 113.8 | |||||
| 88 | E | 32.8 | Very low | 36.2 | Very low | 178 Ų | 178 | 155.3 Ų | 155.3 | 83% | 0.832 | 82% | 0.815 | S | S | * | * | 174.9 | 145.5 | 125.2 | -99.8 | -169 | 167.7 | 0 | 0 | 113.6 | |||||
| 89 | K | 39.6 | Very low | 36 | Very low | 186 Ų | 186 | 158.2 Ų | 158.2 | 81% | 0.809 | 82% | 0.818 | S | S | * | * | trans | 74.9 | 99.5 | 165.6 | -72.4 | 175.7 | 175.1 | 174 | 0 | 117.3 | ||||
| 90 | K | 34 | Very low | 36.2 | Very low | 176 Ų | 176 | 157.1 Ų | 157.1 | 77% | 0.765 | 82% | 0.816 | S | S | * | * | 65.8 | 110.3 | 57.9 | -148.5 | -171.2 | -165.8 | -149.7 | 0 | 113.6 | |||||
| 91 | E | 33.5 | Very low | 37.1 | Very low | 157 Ų | 157 | 158.3 Ų | 158.3 | 73% | 0.734 | 82% | 0.818 | S | S | * | * | trans | 47.3 | 106.4 | 146.5 | -65.6 | 171.6 | 147.3 | 0 | 0 | 118.9 | ||||
| 92 | E | 38.2 | Very low | 38.2 | Very low | 204 Ų | 204 | 158.6 Ų | 158.6 | 95% | 0.953 | 82% | 0.819 | S | S | * | * | trans | -143.4 | 102.4 | 136.6 | -116.9 | 170.2 | -164.7 | 0 | 0 | 109 | ||||
| 93 | K | 41.2 | Very low | 39.2 | Very low | 192 Ų | 192 | 162.7 Ų | 162.7 | 84% | 0.835 | 83% | 0.83 | S | S | * | * | trans | -91 | 141.6 | 167.3 | -173.6 | 179.9 | -174 | 175.4 | 0 | 105.7 | ||||
| 94 | K | 37.2 | Very low | 40.1 | Very low | 173 Ų | 173 | 164.4 Ų | 164.4 | 75% | 0.752 | 83% | 0.833 | S | S | * | * | trans | 94.3 | 137.3 | 152.9 | -117.7 | 179.1 | 180 | -165.9 | 0 | 118 | ||||
| 95 | E | 35.3 | Very low | 41.6 | Very low | 174 Ų | 174 | 169 Ų | 169 | 81% | 0.813 | 84% | 0.84 | S | S | * | * | trans | 83 | 115.9 | 166.9 | -60.8 | 163.8 | -163.4 | 0 | 0 | 112 | ||||
| 96 | E | 32.3 | Very low | 43 | Very low | 187 Ų | 187 | 162.5 Ų | 162.5 | 87% | 0.874 | 83% | 0.827 | S | S | * | * | cis | -175.7 | 121.9 | 50 | -173.6 | 176.5 | -159 | 0 | 0 | 109.3 | ||||
| 97 | S | 36.3 | Very low | 44.4 | Very low | 119 Ų | 119 | 164.5 Ų | 164.5 | 83% | 0.832 | 83% | 0.834 | S | S | * | * | trans | 174.3 | 84.6 | 146.6 | -89.3 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 98 | E | 44.1 | Very low | 46.1 | Very low | 198 Ų | 198 | 158.9 Ų | 158.9 | 93% | 0.925 | 83% | 0.825 | S | S | * | * | trans | -79.4 | 105.4 | 154.9 | -167.9 | -177.6 | 170.2 | 0 | 0 | 106.2 | ||||
| 99 | E | 40.2 | Very low | 47.7 | Very low | 187 Ų | 187 | 157.7 Ų | 157.7 | 87% | 0.874 | 82% | 0.823 | S | S | * | * | trans | -152.3 | 84.8 | 165.6 | -118.8 | 177.9 | -170 | 0 | 0 | 110.3 | ||||
| 100 | G | 42.7 | Very low | 48.8 | Very low | 73 Ų | 73 | 158.3 Ų | 158.3 | 75% | 0.753 | 83% | 0.826 | S | S | * | * | S | Bend | trans | 57.2 | 93.8 | 143.4 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||
| 101 | S | 51.6 | Low | 49.9 | Very low | 126 Ų | 126 | 160.7 Ų | 160.7 | 88% | 0.881 | 85% | 0.847 | S | S | * | * | trans | 178.3 | 83 | 136 | -88.7 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 102 | D | 56.2 | Low | 50.7 | Low | 162 Ų | 162 | 160.9 Ų | 160.9 | 87% | 0.866 | 85% | 0.853 | S | S | * | * | S | Bend | trans | -144.1 | 38.5 | 171.2 | -155.4 | 35.7 | 0 | 0 | 0 | 111.8 | ||
| 103 | D | 56.4 | Low | 51.4 | Low | 164 Ų | 164 | 158.6 Ų | 158.6 | 88% | 0.877 | 85% | 0.848 | S | S | * | * | S | Bend | trans | -152.4 | 16.5 | 173.2 | -128.3 | -61.8 | 0 | 0 | 0 | 114 | ||
| 104 | D | 61.3 | Low | 51.9 | Low | 156 Ų | 156 | 156.8 Ų | 156.8 | 83% | 0.834 | 85% | 0.848 | S | S | * | * | trans | -145.8 | 35.3 | 179 | -144.4 | -36.8 | 0 | 0 | 0 | 112.9 | ||||
| 105 | M | 65.6 | Low | 52.8 | Low | 197 Ų | 197 | 155.8 Ų | 155.8 | 97% | 0.97 | 85% | 0.854 | S | S | * | * | S | Bend | trans | -118.9 | 66.2 | 158.9 | -79.4 | -163.7 | -179.7 | 0 | 0 | 109.7 | F107 | M105-F107 PolarHBondContact O-N 2.94Š|
| 106 | G | 62.6 | Low | 53.9 | Low | 55 Ų | 55 | 154.7 Ų | 154.7 | 57% | 0.567 | 86% | 0.857 | S | S | * | * | trans | 71.6 | 38.7 | 138.3 | 0 | 0 | 0 | 0 | 0 | 116.8 | G108 L109 | G106-G108 PolarHBondContact O-N 3.05Å; G106-L109 PolarHBondContact O-N 3.38Å | ||
| 107 | F | 60.2 | Low | 55.3 | Low | 210 Ų | 210 | 152.5 Ų | 152.5 | 92% | 0.921 | 86% | 0.856 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.5 | 43.8 | 157.8 | -145.3 | -90.3 | 0 | 0 | 0 | 111.6 | M105 | M105-F107 PolarHBondContact O-N 2.94Š|
| 108 | G | 66.5 | Low | 56.7 | Low | 63 Ų | 63 | 154.9 Ų | 154.9 | 65% | 0.649 | 86% | 0.857 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -125.6 | 17.6 | 168.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | G106 F110 | G106-G108 PolarHBondContact O-N 3.05Å; G108-F110 PolarHBondContact O-N 3.37Å |
| 109 | L | 66.3 | Low | 57.7 | Low | 153 Ų | 153 | 151.6 Ų | 151.6 | 80% | 0.801 | 85% | 0.852 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.1 | 28.7 | 172.7 | -166.7 | 57.8 | 0 | 0 | 0 | 112.2 | G106 | G106-L109 PolarHBondContact O-N 3.38Š|
| 110 | F | 63.6 | Low | 59.1 | Low | 199 Ų | 199 | 148.7 Ų | 148.7 | 87% | 0.873 | 85% | 0.85 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -133.3 | 43.7 | 167.6 | -78.9 | -77.5 | 0 | 0 | 0 | 110.2 | G108 | G108-F110 PolarHBondContact O-N 3.37Š|
| 111 | D | 56.7 | Low | 60.6 | Low | 226 Ų | 226 | 155.5 Ų | 155.5 | 100% | 1.209 | 86% | 0.859 | S | S | * | * | trans | -122.8 | 0 | 147.6 | -163.6 | 62.3 | 0 | 0 | 0 | 109.2 |
Retrieved 111 of 111 residues in 168.9 ms
(Link to these results)