| 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 | 36.6 | Very low | 52.9 | Low | 242 Ų | 242 | 115.7 Ų | 115.7 | 100% | 1.192 | 68% | 0.678 | S | S | * | * | 0 | 106.1 | 0 | -71.3 | 149.5 | 108.5 | 0 | 0 | 106.8 | N3 | M1-N3 PolarHBondContact O-N 3.06Š| |||
| 2 | G | 43.8 | Very low | 53.7 | Low | 80 Ų | 80 | 115.2 Ų | 115.2 | 83% | 0.825 | 67% | 0.669 | S | S | * | * | trans | -80.5 | 101.8 | -171.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | C4 | G2-C4 PolarHBondContact O-N 3.17Š| ||
| 3 | N | 43.9 | Very low | 54.1 | Low | 155 Ų | 155 | 107.8 Ų | 107.8 | 83% | 0.829 | 63% | 0.628 | S | S | * | * | trans | -64.1 | 123.6 | 170.2 | -91.7 | -0.1 | 0 | 0 | 0 | 109.1 | M1 Q5 | M1-N3 PolarHBondContact O-N 3.06Å; N3-Q5 PolarHBondContact O-N 3.32Å | ||
| 4 | C | 48.7 | Very low | 54.5 | Low | 125 Ų | 125 | 105.1 Ų | 105.1 | 85% | 0.845 | 61% | 0.609 | S | S | * | * | trans | -54.9 | 98.2 | 178 | -66.1 | 0 | 0 | 0 | 0 | 111.4 | G2 A6 | G2-C4 PolarHBondContact O-N 3.17Å; C4-A6 PolarHBondContact O-N 3.42Å; C4-A6 VanDerWaalsContact O-N 3.1Å | ||
| 5 | Q | 57.7 | Low | 55 | Low | 133 Ų | 133 | 102.7 Ų | 102.7 | 62% | 0.621 | 61% | 0.606 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.6 | 23 | 175.1 | -154.3 | 163 | -13.2 | 0 | 0 | 112.2 | N3 G7 H8 N9 | N3-Q5 PolarHBondContact O-N 3.32Å; Q5-G7 VanDerWaalsContact C-N 3.32Å; Q5-G7 PolarHBondContact O-N 2.85Å; Q5-H8 HydrophobicContact CG-CB 3.74Å; Q5-H8 PolarHBondContact O-N 2.76Å; Q5-N9 PolarHBondContact O-N 3.2Å |
| 6 | A | 55.3 | Low | 55.8 | Low | 71 Ų | 71 | 105.3 Ų | 105.3 | 59% | 0.587 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -64.1 | -37.2 | -179.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | C4 H8 L10 | C4-A6 PolarHBondContact O-N 3.42Å; C4-A6 VanDerWaalsContact O-N 3.1Å; A6-H8 PolarHBondContact O-N 3.16Å; A6-L10 WeakPolarHBondContact O-CB 3.26Å; A6-L10 PolarHBondContact O-N 3.36Å; A6-L10 VanDerWaalsContact O-N 3.1Å |
| 7 | G | 56.7 | Low | 56.4 | Low | 52 Ų | 52 | 104 Ų | 104 | 54% | 0.536 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -67.1 | -33 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | Q5 H11 | Q5-G7 VanDerWaalsContact C-N 3.32Å; Q5-G7 PolarHBondContact O-N 2.85Å; G7-H11 WeakPolarHBondContact O-CB 3.4Å; G7-H11 PolarHBondContact O-N 3.27Å |
| 8 | H | 58.1 | Low | 57.3 | Low | 130 Ų | 130 | 102.8 Ų | 102.8 | 60% | 0.602 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -75.8 | -38.6 | -178.7 | -131.1 | 92.5 | 0 | 0 | 0 | 111.8 | Q5 A6 H11 L12 | Q5-H8 HydrophobicContact CG-CB 3.74Å; Q5-H8 PolarHBondContact O-N 2.76Å; A6-H8 PolarHBondContact O-N 3.16Å; H8-H11 PolarHBondContact O-N 3.4Å; H8-L12 PolarHBondContact O-N 2.95Å |
| 9 | N | 56.2 | Low | 58.4 | Low | 61 Ų | 61 | 102.5 Ų | 102.5 | 33% | 0.326 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -68.7 | -35.3 | 174.2 | -71.4 | -26.7 | 0 | 0 | 0 | 112 | Q5 L12 C13 | Q5-N9 PolarHBondContact O-N 3.2Å; N9-L12 PolarHBondContact O-N 2.9Å; N9-C13 WeakPolarHBondContact O-CB 3.31Å; N9-C13 PolarHBondContact O-N 3Å |
| 10 | L | 61.3 | Low | 59.2 | Low | 96 Ų | 96 | 101.1 Ų | 101.1 | 50% | 0.503 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -62.2 | -49.4 | 171.6 | -166.8 | 77 | 0 | 0 | 0 | 110.1 | A6 L12 C13 L14 | A6-L10 WeakPolarHBondContact O-CB 3.26Å; A6-L10 PolarHBondContact O-N 3.36Å; A6-L10 VanDerWaalsContact O-N 3.1Å; L10-L12 VanDerWaalsContact C-N 3.31Å; L10-L12 PolarHBondContact O-N 3.31Å; L10-C13 PolarHBondContact O-N 2.96Å; L10-L14 HydrophobicContact CD2-CD1 4.16Å; L10-L14 HydrophobicContact CG-CD1 3.86Å; L10-L14 HydrophobicContact CG-CG 4.2Å; L10-L14 VanDerWaalsContact O-CB 3.3Å; L10-L14 WeakPolarHBondContact O-CB 3.48Å; L10-L14 WeakPolarHBondContact O-CG 3.36Å; L10-L14 PolarHBondContact O-N 3.32Å |
| 11 | H | 64 | Low | 60 | Low | 128 Ų | 128 | 97.6 Ų | 97.6 | 59% | 0.593 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -58.7 | -40.5 | 177.7 | -171.8 | -87.7 | 0 | 0 | 0 | 112.9 | G7 H8 L14 A15 | G7-H11 WeakPolarHBondContact O-CB 3.4Å; G7-H11 PolarHBondContact O-N 3.27Å; H8-H11 PolarHBondContact O-N 3.4Å; H11-L14 PolarHBondContact O-N 3.33Å; H11-A15 WeakPolarHBondContact O-CB 3.41Å; H11-A15 PolarHBondContact O-N 3.04Å |
| 12 | L | 62.3 | Low | 62.2 | Low | 109 Ų | 109 | 89.4 Ų | 89.4 | 57% | 0.571 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -67 | -41.4 | 177.8 | -154.4 | 82.1 | 0 | 0 | 0 | 112.1 | H8 N9 L10 A15 H16 | H8-L12 PolarHBondContact O-N 2.95Å; N9-L12 PolarHBondContact O-N 2.9Å; L10-L12 VanDerWaalsContact C-N 3.31Å; L10-L12 PolarHBondContact O-N 3.31Å; L12-A15 PolarHBondContact O-N 2.9Å; L12-H16 PolarHBondContact O-N 2.93Å; L12-H16 VanDerWaalsContact O-N 3.15Å |
| 13 | C | 59.1 | Low | 64.1 | Low | 20 Ų | 20 | 87.8 Ų | 87.8 | 14% | 0.135 | 51% | 0.51 | C | S | . | . | H | α-helix | trans | -69 | -36.6 | 175.8 | -169 | 0 | 0 | 0 | 0 | 112.1 | N9 L10 A15 H17 F227 | N9-C13 WeakPolarHBondContact O-CB 3.31Å; N9-C13 PolarHBondContact O-N 3Å; L10-C13 PolarHBondContact O-N 2.96Å; C13-A15 VanDerWaalsContact C-N 3.33Å; C13-H17 PolarHBondContact O-N 3.26Å; C13-F227 HydrophobicContact CB-CD2 4.42Å; C13-F227 VanDerWaalsContact SG-CD2 3.58Å; C13-F227 WeakPolarHBondContact SG-CE2 3.27Å |
| 14 | L | 58.8 | Low | 66.1 | Low | 70 Ų | 70 | 81.4 Ų | 81.4 | 37% | 0.366 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -64.9 | -37 | 174.4 | -70.2 | 167.9 | 0 | 0 | 0 | 111.1 | L10 H11 V21 | L10-L14 HydrophobicContact CD2-CD1 4.16Å; L10-L14 HydrophobicContact CG-CD1 3.86Å; L10-L14 HydrophobicContact CG-CG 4.2Å; L10-L14 VanDerWaalsContact O-CB 3.3Å; L10-L14 WeakPolarHBondContact O-CB 3.48Å; L10-L14 WeakPolarHBondContact O-CG 3.36Å; L10-L14 PolarHBondContact O-N 3.32Å; H11-L14 PolarHBondContact O-N 3.33Å; L14-V21 HydrophobicContact CB-CG2 3.91Å; L14-V21 HydrophobicContact CD2-CB 3.85Å; L14-V21 HydrophobicContact CD2-CG1 3.43Å; L14-V21 VanDerWaalsContact CD2-CG1 3.43Å; L14-V21 HydrophobicContact CD2-CG2 3.29Å; L14-V21 HydrophobicContact CG-CG2 4.15Å; L14-V21 WeakPolarHBondContact O-CG2 3.41Å |
| 15 | A | 62.8 | Low | 67.8 | Low | 68 Ų | 68 | 79.9 Ų | 79.9 | 56% | 0.562 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -74.2 | -32.2 | 179 | 0 | 0 | 0 | 0 | 0 | 113.6 | H11 L12 C13 | H11-A15 WeakPolarHBondContact O-CB 3.41Å; H11-A15 PolarHBondContact O-N 3.04Å; L12-A15 PolarHBondContact O-N 2.9Å; C13-A15 VanDerWaalsContact C-N 3.33Å |
| 16 | H | 66.8 | Low | 69.3 | Low | 145 Ų | 145 | 78.8 Ų | 78.8 | 67% | 0.671 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -89.4 | -19.6 | -177.7 | -100.6 | 70.2 | 0 | 0 | 0 | 114.7 | L12 | L12-H16 PolarHBondContact O-N 2.93Å; L12-H16 VanDerWaalsContact O-N 3.15Å |
| 17 | H | 67 | Low | 71 | Confident | 83 Ų | 83 | 77.2 Ų | 77.2 | 38% | 0.384 | 44% | 0.438 | S | S | . | . | trans | -131.1 | 68.7 | -177.4 | -62.9 | -64.9 | 0 | 0 | 0 | 112.7 | C13 L20 V21 | C13-H17 PolarHBondContact O-N 3.26Å; H17-L20 HydrophobicContact CB-CB 4.13Å; H17-L20 PolarHBondContact O-N 3.28Å; H17-V21 WeakPolarHBondContact O-CG2 3.28Å; H17-V21 PolarHBondContact O-N 3.45Å | ||
| 18 | P | 71.4 | Confident | 72.6 | Confident | 83 Ų | 83 | 78.1 Ų | 78.1 | 54% | 0.539 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -50.1 | -40.9 | -179.9 | 16.5 | -26.9 | 0 | 0 | 0 | 115.4 | L20 V21 C22 | P18-L20 VanDerWaalsContact C-N 3.3Å; P18-L20 PolarHBondContact O-N 2.89Å; P18-V21 PolarHBondContact O-N 3.07Å; P18-C22 PolarHBondContact O-N 2.04Å; P18-C22 PolarHBondContact O-SG 2.82Å; P18-C22 VanDerWaalsContact O-SG 3.36Å |
| 19 | P | 79.4 | Confident | 74.3 | Confident | 97 Ų | 97 | 77.3 Ų | 77.3 | 63% | 0.63 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -67.2 | -30.9 | -179.4 | 26.5 | -36.2 | 0 | 0 | 0 | 113.1 | C22 A23 | P19-C22 PolarHBondContact O-N 3.4Å; P19-A23 WeakPolarHBondContact O-CB 3.38Å; P19-A23 PolarHBondContact O-N 2.93Å |
| 20 | L | 74.8 | Confident | 76.1 | Confident | 74 Ų | 74 | 78.8 Ų | 78.8 | 39% | 0.387 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -71.6 | -38.6 | -178.8 | -164.6 | 149.2 | 0 | 0 | 0 | 110.5 | H17 P18 A23 T24 T223 | H17-L20 HydrophobicContact CB-CB 4.13Å; H17-L20 PolarHBondContact O-N 3.28Å; P18-L20 VanDerWaalsContact C-N 3.3Å; P18-L20 PolarHBondContact O-N 2.89Å; L20-A23 PolarHBondContact O-N 3.19Å; L20-T24 HydrophobicContact CD2-CG2 4.02Å; L20-T24 WeakPolarHBondContact O-CG2 3.4Å; L20-T24 PolarHBondContact O-N 3.15Å; L20-T24 PolarHBondContact O-OG1 3.18Å; L20-T223 HydrophobicContact CD1-CG2 4.29Å; L20-T223 HydrophobicContact CD2-CG2 4.2Å |
| 21 | V | 75.7 | Confident | 77.6 | Confident | 27 Ų | 27 | 74.2 Ų | 74.2 | 16% | 0.164 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -60.7 | -48.1 | 172.8 | -174.8 | 0 | 0 | 0 | 0 | 111.5 | L14 H17 P18 A23 T24 L25 | L14-V21 HydrophobicContact CB-CG2 3.91Å; L14-V21 HydrophobicContact CD2-CB 3.85Å; L14-V21 HydrophobicContact CD2-CG1 3.43Å; L14-V21 VanDerWaalsContact CD2-CG1 3.43Å; L14-V21 HydrophobicContact CD2-CG2 3.29Å; L14-V21 HydrophobicContact CG-CG2 4.15Å; L14-V21 WeakPolarHBondContact O-CG2 3.41Å; H17-V21 WeakPolarHBondContact O-CG2 3.28Å; H17-V21 PolarHBondContact O-N 3.45Å; P18-V21 PolarHBondContact O-N 3.07Å; V21-A23 VanDerWaalsContact C-N 3.31Å; V21-A23 PolarHBondContact O-N 2.79Å; V21-T24 PolarHBondContact O-N 3.26Å; V21-T24 PolarHBondContact O-OG1 2.79Å; V21-L25 HydrophobicContact CG1-CD1 3.97Å; V21-L25 HydrophobicContact CG1-CG 4.42Å; V21-L25 WeakPolarHBondContact O-CB 3.23Å; V21-L25 WeakPolarHBondContact O-CG 3.44Å; V21-L25 PolarHBondContact O-N 3.35Å |
| 22 | C | 82.3 | Confident | 79 | Confident | 70 Ų | 70 | 72.5 Ų | 72.5 | 47% | 0.473 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -61.1 | -44.2 | 178.6 | -67 | 0 | 0 | 0 | 0 | 110.6 | P18 P19 L25 I26 | P18-C22 PolarHBondContact O-N 2.04Å; P18-C22 PolarHBondContact O-SG 2.82Å; P18-C22 VanDerWaalsContact O-SG 3.36Å; P19-C22 PolarHBondContact O-N 3.4Å; C22-L25 PolarHBondContact O-N 3.06Å; C22-I26 WeakPolarHBondContact O-CB 3.39Å; C22-I26 WeakPolarHBondContact O-CD1 3.37Å; C22-I26 WeakPolarHBondContact O-CG1 3.06Å; C22-I26 PolarHBondContact O-N 2.79Å |
| 23 | A | 84.4 | Confident | 80.5 | Confident | 46 Ų | 46 | 70.4 Ų | 70.4 | 38% | 0.38 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -61.7 | -45.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | P19 L20 V21 I26 L27 | P19-A23 WeakPolarHBondContact O-CB 3.38Å; P19-A23 PolarHBondContact O-N 2.93Å; L20-A23 PolarHBondContact O-N 3.19Å; V21-A23 VanDerWaalsContact C-N 3.31Å; V21-A23 PolarHBondContact O-N 2.79Å; A23-I26 PolarHBondContact O-N 3.43Å; A23-L27 WeakPolarHBondContact O-CB 3.41Å; A23-L27 VanDerWaalsContact O-CG 3.23Å; A23-L27 WeakPolarHBondContact O-CG 3Å; A23-L27 PolarHBondContact O-N 3.24Å |
| 24 | T | 84.4 | Confident | 82.1 | Confident | 21 Ų | 21 | 69.9 Ų | 69.9 | 13% | 0.129 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -66 | -41.4 | 178.8 | 55.4 | 0 | 0 | 0 | 0 | 111.9 | L20 V21 L27 L28 | L20-T24 HydrophobicContact CD2-CG2 4.02Å; L20-T24 WeakPolarHBondContact O-CG2 3.4Å; L20-T24 PolarHBondContact O-N 3.15Å; L20-T24 PolarHBondContact O-OG1 3.18Å; V21-T24 PolarHBondContact O-N 3.26Å; V21-T24 PolarHBondContact O-OG1 2.79Å; T24-L27 PolarHBondContact O-N 2.88Å; T24-L28 VanDerWaalsContact O-CB 3.29Å; T24-L28 WeakPolarHBondContact O-CB 3.46Å; T24-L28 PolarHBondContact O-N 3.03Å |
| 25 | L | 85.7 | Confident | 83.6 | Confident | 94 Ų | 94 | 69.2 Ų | 69.2 | 49% | 0.492 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -62.8 | -43.5 | 175.1 | -72.4 | 174.5 | 0 | 0 | 0 | 112 | V21 C22 L28 L29 | V21-L25 HydrophobicContact CG1-CD1 3.97Å; V21-L25 HydrophobicContact CG1-CG 4.42Å; V21-L25 WeakPolarHBondContact O-CB 3.23Å; V21-L25 WeakPolarHBondContact O-CG 3.44Å; V21-L25 PolarHBondContact O-N 3.35Å; C22-L25 PolarHBondContact O-N 3.06Å; L25-L28 PolarHBondContact O-N 3.05Å; L25-L29 WeakPolarHBondContact O-CB 3.47Å; L25-L29 VanDerWaalsContact O-CG 3.26Å; L25-L29 WeakPolarHBondContact O-CG 3.36Å; L25-L29 PolarHBondContact O-N 3.33Å |
| 26 | I | 88.8 | Confident | 85 | Confident | 110 Ų | 110 | 68 Ų | 68 | 56% | 0.564 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -62.2 | -46.6 | 176.9 | -69.6 | 163.8 | 0 | 0 | 0 | 110.5 | C22 A23 L28 L29 L30 | C22-I26 WeakPolarHBondContact O-CB 3.39Å; C22-I26 WeakPolarHBondContact O-CD1 3.37Å; C22-I26 WeakPolarHBondContact O-CG1 3.06Å; C22-I26 PolarHBondContact O-N 2.79Å; A23-I26 PolarHBondContact O-N 3.43Å; I26-L28 VanDerWaalsContact C-N 3.33Å; I26-L28 PolarHBondContact O-N 2.86Å; I26-L29 PolarHBondContact O-N 3.38Å; I26-L30 VanDerWaalsContact O-CB 3.25Å; I26-L30 WeakPolarHBondContact O-CB 3.05Å; I26-L30 PolarHBondContact O-N 2.9Å |
| 27 | L | 90 | Very high | 86.1 | Confident | 37 Ų | 37 | 65.5 Ų | 65.5 | 19% | 0.194 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -63.5 | -39.6 | 178.7 | -70.2 | 170.8 | 0 | 0 | 0 | 111.9 | A23 T24 G31 L212 F215 C216 L219 | A23-L27 WeakPolarHBondContact O-CB 3.41Å; A23-L27 VanDerWaalsContact O-CG 3.23Å; A23-L27 WeakPolarHBondContact O-CG 3Å; A23-L27 PolarHBondContact O-N 3.24Å; T24-L27 PolarHBondContact O-N 2.88Å; L27-G31 PolarHBondContact O-N 3.46Å; L27-L212 HydrophobicContact CD2-CD2 3.88Å; L27-F215 HydrophobicContact CD1-CD1 4.18Å; L27-F215 HydrophobicContact CD1-CE1 4.34Å; L27-C216 HydrophobicContact CB-CB 4.38Å; L27-L219 HydrophobicContact CD1-CD1 4.14Å |
| 28 | L | 91.6 | Very high | 87 | Confident | 71 Ų | 71 | 61.6 Ų | 61.6 | 37% | 0.372 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -64.6 | -48.4 | 176.4 | -173 | 113 | 0 | 0 | 0 | 111.4 | T24 L25 I26 G31 L32 L213 | T24-L28 VanDerWaalsContact O-CB 3.29Å; T24-L28 WeakPolarHBondContact O-CB 3.46Å; T24-L28 PolarHBondContact O-N 3.03Å; L25-L28 PolarHBondContact O-N 3.05Å; I26-L28 VanDerWaalsContact C-N 3.33Å; I26-L28 PolarHBondContact O-N 2.86Å; L28-G31 PolarHBondContact O-N 3.11Å; L28-L32 HydrophobicContact CD2-CD1 3.93Å; L28-L32 HydrophobicContact CG-CD1 4.16Å; L28-L32 WeakPolarHBondContact O-CB 3.16Å; L28-L32 VanDerWaalsContact O-CG 3.29Å; L28-L32 WeakPolarHBondContact O-CG 3.37Å; L28-L32 PolarHBondContact O-N 3.33Å; L28-L213 HydrophobicContact CD1-CD2 4.35Å; L28-L213 HydrophobicContact CG-CD2 4.38Å |
| 29 | L | 93.5 | Very high | 87.7 | Confident | 114 Ų | 114 | 60.4 Ų | 60.4 | 60% | 0.597 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -62.4 | -43.5 | 177.4 | -71.3 | 172.3 | 0 | 0 | 0 | 111.5 | L25 I26 L32 S33 | L25-L29 WeakPolarHBondContact O-CB 3.47Å; L25-L29 VanDerWaalsContact O-CG 3.26Å; L25-L29 WeakPolarHBondContact O-CG 3.36Å; L25-L29 PolarHBondContact O-N 3.33Å; I26-L29 PolarHBondContact O-N 3.38Å; L29-L32 PolarHBondContact O-N 2.92Å; L29-S33 VanDerWaalsContact O-CB 3.27Å; L29-S33 WeakPolarHBondContact O-CB 3.47Å; L29-S33 PolarHBondContact O-N 3.5Å; L29-S33 PolarHBondContact O-OG 3.45Å |
| 30 | L | 93.9 | Very high | 88 | Confident | 92 Ų | 92 | 60.6 Ų | 60.6 | 48% | 0.482 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -63.8 | -44.4 | 177.4 | -168.7 | 65.2 | 0 | 0 | 0 | 110.7 | I26 S33 G34 L212 | I26-L30 VanDerWaalsContact O-CB 3.25Å; I26-L30 WeakPolarHBondContact O-CB 3.05Å; I26-L30 PolarHBondContact O-N 2.9Å; L30-S33 WeakPolarHBondContact CA-OG 3.29Å; L30-S33 PolarHBondContact O-N 2.83Å; L30-S33 PolarHBondContact O-OG 2.87Å; L30-G34 PolarHBondContact O-N 3.37Å; L30-L212 HydrophobicContact CB-CD1 4.09Å; L30-L212 HydrophobicContact CD2-CD1 3.62Å; L30-L212 HydrophobicContact CG-CD1 3.69Å |
| 31 | G | 92.9 | Very high | 88.4 | Confident | 0 Ų | 0 | 57.8 Ų | 57.8 | 0% | 0 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -60.2 | -48.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | L27 L28 G34 L35 | L27-G31 PolarHBondContact O-N 3.46Å; L28-G31 PolarHBondContact O-N 3.11Å; G31-G34 PolarHBondContact O-N 2.89Å; G31-L35 WeakPolarHBondContact O-CG 3.38Å; G31-L35 PolarHBondContact O-N 2.84Å |
| 32 | L | 94.2 | Very high | 88.6 | Confident | 91 Ų | 91 | 58.6 Ų | 58.6 | 48% | 0.476 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -63.9 | -40 | 176.8 | -70.7 | 174 | 0 | 0 | 0 | 112.4 | L28 L29 L35 G36 L213 | L28-L32 HydrophobicContact CD2-CD1 3.93Å; L28-L32 HydrophobicContact CG-CD1 4.16Å; L28-L32 WeakPolarHBondContact O-CB 3.16Å; L28-L32 VanDerWaalsContact O-CG 3.29Å; L28-L32 WeakPolarHBondContact O-CG 3.37Å; L28-L32 PolarHBondContact O-N 3.33Å; L29-L32 PolarHBondContact O-N 2.92Å; L32-L35 PolarHBondContact O-N 3.31Å; L32-G36 PolarHBondContact O-N 3.18Å; L32-L213 HydrophobicContact CD2-CD1 4.37Å; L32-L213 HydrophobicContact CD2-CD2 4.47Å; L32-L213 HydrophobicContact CG-CD2 4.31Å |
| 33 | S | 93.7 | Very high | 88.5 | Confident | 65 Ų | 65 | 60 Ų | 60 | 46% | 0.455 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -64.6 | -41.3 | 176.5 | 73 | 0 | 0 | 0 | 0 | 111.8 | L29 L30 G36 L37 | L29-S33 VanDerWaalsContact O-CB 3.27Å; L29-S33 WeakPolarHBondContact O-CB 3.47Å; L29-S33 PolarHBondContact O-N 3.5Å; L29-S33 PolarHBondContact O-OG 3.45Å; L30-S33 WeakPolarHBondContact CA-OG 3.29Å; L30-S33 PolarHBondContact O-N 2.83Å; L30-S33 PolarHBondContact O-OG 2.87Å; S33-G36 PolarHBondContact O-N 3.43Å; S33-L37 VanDerWaalsContact O-CB 3.24Å; S33-L37 WeakPolarHBondContact O-CB 3.46Å; S33-L37 PolarHBondContact O-N 3.08Å |
| 34 | G | 91 | Very high | 87.7 | Confident | 9 Ų | 9 | 62.2 Ų | 62.2 | 9% | 0.093 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -64.6 | -41.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | L30 G31 G38 | L30-G34 PolarHBondContact O-N 3.37Å; G31-G34 PolarHBondContact O-N 2.89Å; G34-G38 WeakPolarHBondContact O-CA 3.46Å; G34-G38 PolarHBondContact O-N 2.93Å |
| 35 | L | 92.1 | Very high | 86.6 | Confident | 56 Ų | 56 | 67.7 Ų | 67.7 | 29% | 0.293 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -64.4 | -47.1 | 174 | -74.7 | -172.4 | 0 | 0 | 0 | 112.3 | G31 L32 S39 L206 L213 | G31-L35 WeakPolarHBondContact O-CG 3.38Å; G31-L35 PolarHBondContact O-N 2.84Å; L32-L35 PolarHBondContact O-N 3.31Å; L35-S39 WeakPolarHBondContact O-CB 3.28Å; L35-S39 PolarHBondContact O-N 3.13Å; L35-L206 HydrophobicContact CD2-CD2 3.81Å; L35-L206 WeakPolarHBondContact O-CD2 3.48Å; L35-L213 HydrophobicContact CD1-CD1 3.29Å; L35-L213 HydrophobicContact CG-CD1 4.06Å |
| 36 | G | 91.6 | Very high | 84.9 | Confident | 44 Ų | 44 | 69.5 Ų | 69.5 | 45% | 0.454 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -63.2 | -48.4 | -179.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | L32 S33 F40 | L32-G36 PolarHBondContact O-N 3.18Å; S33-G36 PolarHBondContact O-N 3.43Å; G36-F40 VanDerWaalsContact O-CB 3.25Å; G36-F40 WeakPolarHBondContact O-CB 3.31Å; G36-F40 PolarHBondContact O-N 3.04Å |
| 37 | L | 88.7 | Confident | 83.2 | Confident | 92 Ų | 92 | 66.6 Ų | 66.6 | 48% | 0.482 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -67.6 | -44.7 | 178.3 | -172.2 | 66.4 | 0 | 0 | 0 | 111.5 | S33 S39 F40 L41 L205 | S33-L37 VanDerWaalsContact O-CB 3.24Å; S33-L37 WeakPolarHBondContact O-CB 3.46Å; S33-L37 PolarHBondContact O-N 3.08Å; L37-S39 VanDerWaalsContact C-N 3.35Å; L37-S39 PolarHBondContact O-N 3.47Å; L37-F40 PolarHBondContact O-N 3.31Å; L37-L41 HydrophobicContact CG-CD1 4.3Å; L37-L41 WeakPolarHBondContact O-CB 3.25Å; L37-L41 WeakPolarHBondContact O-CG 3.41Å; L37-L41 PolarHBondContact O-N 3.33Å; L37-L205 HydrophobicContact CD2-CD1 3.89Å; L37-L205 HydrophobicContact CD2-CD2 4.5Å; L37-L205 HydrophobicContact CG-CD1 4.09Å |
| 38 | G | 87.5 | Confident | 81.4 | Confident | 0 Ų | 0 | 67.2 Ų | 67.2 | 0% | 0 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -61.1 | -42.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | G34 L42 | G34-G38 WeakPolarHBondContact O-CA 3.46Å; G34-G38 PolarHBondContact O-N 2.93Å; G38-L42 WeakPolarHBondContact O-CG 3.44Å; G38-L42 PolarHBondContact O-N 3.09Å; G38-L42 VanDerWaalsContact O-N 3.07Å |
| 39 | S | 86.3 | Confident | 79.4 | Confident | 58 Ų | 58 | 72 Ų | 72 | 41% | 0.406 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -66.5 | -44.6 | 174.2 | 179.8 | 0 | 0 | 0 | 0 | 111.5 | L35 L37 L41 L42 T43 | L35-S39 WeakPolarHBondContact O-CB 3.28Å; L35-S39 PolarHBondContact O-N 3.13Å; L37-S39 VanDerWaalsContact C-N 3.35Å; L37-S39 PolarHBondContact O-N 3.47Å; S39-L41 VanDerWaalsContact C-N 3.32Å; S39-L41 PolarHBondContact O-N 2.83Å; S39-L42 PolarHBondContact O-N 2.75Å; S39-T43 WeakPolarHBondContact O-CB 3.46Å; S39-T43 PolarHBondContact O-N 2.87Å; S39-T43 PolarHBondContact O-OG1 2.93Å |
| 40 | F | 85.8 | Confident | 77.3 | Confident | 101 Ų | 101 | 67.3 Ų | 67.3 | 44% | 0.443 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -57.5 | -46 | 177.2 | 179.1 | -98.6 | 0 | 0 | 0 | 111.6 | G36 L37 T43 H44 L48 | G36-F40 VanDerWaalsContact O-CB 3.25Å; G36-F40 WeakPolarHBondContact O-CB 3.31Å; G36-F40 PolarHBondContact O-N 3.04Å; L37-F40 PolarHBondContact O-N 3.31Å; F40-T43 PolarHBondContact O-N 2.86Å; F40-H44 AromaticContact CD2-CD2 3.43Å; F40-H44 VanDerWaalsContact CD2-CD2 3.43Å; F40-H44 WeakPolarHBondContact CD2-CD2 3.29Å; F40-H44 AromaticContact CE2-CD2 3.28Å; F40-H44 WeakPolarHBondContact CE2-CD2 3.4Å; F40-H44 AromaticContact CE2-CG 3.94Å; F40-H44 AromaticContact CE2-NE2 3.71Å; F40-H44 HydrophobicContact CZ-CB 4.4Å; F40-H44 AromaticContact CZ-CD2 3.99Å; F40-H44 WeakPolarHBondContact O-CB 3.17Å; F40-H44 PolarHBondContact O-N 2.83Å; F40-L48 HydrophobicContact CD1-CD1 4.1Å; F40-L48 HydrophobicContact CD1-CD2 4.5Å; F40-L48 HydrophobicContact CE1-CD1 3.78Å; F40-L48 HydrophobicContact CE1-CD2 4.07Å; F40-L48 HydrophobicContact CE1-CG 4.12Å |
| 41 | L | 82.4 | Confident | 75.4 | Confident | 16 Ų | 16 | 68.5 Ų | 68.5 | 8% | 0.084 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -58.1 | -50.7 | 175.2 | -69.2 | 170.6 | 0 | 0 | 0 | 111 | L37 S39 T43 H44 R45 L48 L198 L205 | L37-L41 HydrophobicContact CG-CD1 4.3Å; L37-L41 WeakPolarHBondContact O-CB 3.25Å; L37-L41 WeakPolarHBondContact O-CG 3.41Å; L37-L41 PolarHBondContact O-N 3.33Å; S39-L41 VanDerWaalsContact C-N 3.32Å; S39-L41 PolarHBondContact O-N 2.83Å; L41-T43 PolarHBondContact O-N 2.83Å; L41-H44 CarbonylContact O-C 3.6Å; L41-H44 PolarHBondContact O-N 3.06Å; L41-R45 PolarHBondContact O-N 3.24Å; L41-L48 HydrophobicContact CD2-CD1 3.83Å; L41-L48 HydrophobicContact CD2-CD2 3.39Å; L41-L48 HydrophobicContact CD2-CG 4.15Å; L41-L198 HydrophobicContact CB-CD2 3.91Å; L41-L198 HydrophobicContact CB-CG 4.45Å; L41-L198 HydrophobicContact CD2-CD1 4.33Å; L41-L198 HydrophobicContact CD2-CG 4.3Å; L41-L198 WeakPolarHBondContact O-CD2 3.23Å; L41-L205 HydrophobicContact CD1-CD1 3.52Å |
| 42 | L | 80.6 | Confident | 73.6 | Confident | 43 Ų | 43 | 74.6 Ų | 74.6 | 23% | 0.225 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -68.5 | -32.1 | -176.6 | -71.3 | 166.2 | 0 | 0 | 0 | 113.8 | G38 S39 R45 A199 L206 | G38-L42 WeakPolarHBondContact O-CG 3.44Å; G38-L42 PolarHBondContact O-N 3.09Å; G38-L42 VanDerWaalsContact O-N 3.07Å; S39-L42 PolarHBondContact O-N 2.75Å; L42-R45 WeakPolarHBondContact O-CG 3.35Å; L42-A199 HydrophobicContact CD2-CB 4.41Å; L42-L206 HydrophobicContact CD1-CD1 3.31Å; L42-L206 HydrophobicContact CD1-CG 4.03Å |
| 43 | T | 79 | Confident | 71.6 | Confident | 101 Ų | 101 | 71.5 Ų | 71.5 | 62% | 0.62 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -78.7 | -41.1 | 177.7 | -52.5 | 0 | 0 | 0 | 0 | 111.4 | S39 F40 L41 R45 | S39-T43 WeakPolarHBondContact O-CB 3.46Å; S39-T43 PolarHBondContact O-N 2.87Å; S39-T43 PolarHBondContact O-OG1 2.93Å; F40-T43 PolarHBondContact O-N 2.86Å; L41-T43 PolarHBondContact O-N 2.83Å; T43-R45 VanDerWaalsContact C-N 3.33Å; T43-R45 PolarHBondContact O-N 3.08Å |
| 44 | H | 68.2 | Low | 70 | Confident | 92 Ų | 92 | 71 Ų | 71 | 43% | 0.426 | 40% | 0.396 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95.8 | 41.5 | 178.7 | -70.1 | -84 | 0 | 0 | 0 | 112.7 | F40 L41 T46 G47 L48 | F40-H44 AromaticContact CD2-CD2 3.43Å; F40-H44 VanDerWaalsContact CD2-CD2 3.43Å; F40-H44 WeakPolarHBondContact CD2-CD2 3.29Å; F40-H44 AromaticContact CE2-CD2 3.28Å; F40-H44 WeakPolarHBondContact CE2-CD2 3.4Å; F40-H44 AromaticContact CE2-CG 3.94Å; F40-H44 AromaticContact CE2-NE2 3.71Å; F40-H44 HydrophobicContact CZ-CB 4.4Å; F40-H44 AromaticContact CZ-CD2 3.99Å; F40-H44 WeakPolarHBondContact O-CB 3.17Å; F40-H44 PolarHBondContact O-N 2.83Å; L41-H44 CarbonylContact O-C 3.6Å; L41-H44 PolarHBondContact O-N 3.06Å; H44-T46 PolarHBondContact O-N 2.76Å; H44-G47 PolarHBondContact O-N 3.17Å; H44-L48 HydrophobicContact CB-CD1 3.84Å; H44-L48 WeakPolarHBondContact O-CD1 3.3Å |
| 45 | R | 61.7 | Low | 68.5 | Low | 136 Ų | 136 | 78.2 Ų | 78.2 | 51% | 0.513 | 43% | 0.427 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -50.5 | -28.1 | 176.9 | -90.3 | 178.6 | -178.9 | 160.2 | 3 | 114.1 | L41 L42 T43 L198 | L41-R45 PolarHBondContact O-N 3.24Å; L42-R45 WeakPolarHBondContact O-CG 3.35Å; T43-R45 VanDerWaalsContact C-N 3.33Å; T43-R45 PolarHBondContact O-N 3.08Å; R45-L198 HydrophobicContact CG-CD2 4.05Å |
| 46 | T | 50.3 | Low | 67.5 | Low | 132 Ų | 132 | 80.3 Ų | 80.3 | 81% | 0.81 | 44% | 0.438 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.3 | -2.5 | -176 | 51.7 | 0 | 0 | 0 | 0 | 114.1 | H44 | H44-T46 PolarHBondContact O-N 2.76Š|
| 47 | G | 52.5 | Low | 66.5 | Low | 49 Ų | 49 | 78.2 Ų | 78.2 | 51% | 0.505 | 42% | 0.417 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -119.4 | -11.9 | -169.5 | 0 | 0 | 0 | 0 | 0 | 116.9 | H44 R49 | H44-G47 PolarHBondContact O-N 3.17Å; G47-R49 PolarHBondContact O-N 3.09Å |
| 48 | L | 52.6 | Low | 65.6 | Low | 50 Ų | 50 | 76.7 Ų | 76.7 | 26% | 0.262 | 41% | 0.411 | S | S | . | . | trans | -90.2 | 111 | -175.9 | -82.1 | 113.4 | 0 | 0 | 0 | 112.1 | F40 L41 H44 L198 | F40-L48 HydrophobicContact CD1-CD1 4.1Å; F40-L48 HydrophobicContact CD1-CD2 4.5Å; F40-L48 HydrophobicContact CE1-CD1 3.78Å; F40-L48 HydrophobicContact CE1-CD2 4.07Å; F40-L48 HydrophobicContact CE1-CG 4.12Å; L41-L48 HydrophobicContact CD2-CD1 3.83Å; L41-L48 HydrophobicContact CD2-CD2 3.39Å; L41-L48 HydrophobicContact CD2-CG 4.15Å; H44-L48 HydrophobicContact CB-CD1 3.84Å; H44-L48 WeakPolarHBondContact O-CD1 3.3Å; L48-L198 HydrophobicContact CB-CD1 3.72Å; L48-L198 HydrophobicContact CD1-CD1 4.36Å | ||
| 49 | R | 49.7 | Very low | 64.8 | Low | 170 Ų | 170 | 79.1 Ų | 79.1 | 64% | 0.642 | 43% | 0.428 | S | S | * | . | B | Isolated β-bridge | trans | -82 | 129.9 | -176.4 | -67.3 | 173.1 | 173.2 | 145.4 | 2 | 110.7 | G47 T190 | G47-R49 PolarHBondContact O-N 3.09Å; R49-T190 HydrophobicContact CB-CG2 3.88Å; R49-T190 HydrophobicContact CG-CG2 3.93Å |
| 50 | S | 48.4 | Very low | 64.4 | Low | 16 Ų | 16 | 77 Ų | 77 | 11% | 0.112 | 41% | 0.412 | C | S | . | . | trans | -73.6 | 128.6 | 169.5 | -170.3 | 0 | 0 | 0 | 0 | 109.9 | D52 K191 | S50-D52 PolarHBondContact O-N 2.97Å; S50-K191 WeakPolarHBondContact CB-O 3.4Å | ||
| 51 | P | 54 | Low | 63.9 | Low | 118 Ų | 118 | 72.4 Ų | 72.4 | 77% | 0.766 | 39% | 0.391 | S | S | * | . | S | Bend | trans | -72.6 | -6.2 | 177.6 | 29.4 | -33.9 | 0 | 0 | 0 | 113.8 | I53 | P51-I53 VanDerWaalsContact C-N 3.3Å; P51-I53 PolarHBondContact O-N 3.2Å |
| 52 | D | 54.6 | Low | 63.6 | Low | 128 Ų | 128 | 78.6 Ų | 78.6 | 68% | 0.684 | 41% | 0.414 | S | S | * | . | trans | -87.7 | 54.7 | -172.2 | -68.7 | -28.6 | 0 | 0 | 0 | 113.9 | S50 | S50-D52 PolarHBondContact O-N 2.97Š| ||
| 53 | I | 53.5 | Low | 63.3 | Low | 26 Ų | 26 | 77.8 Ų | 77.8 | 13% | 0.133 | 41% | 0.412 | C | S | . | . | trans | -109.8 | 122.4 | 165.3 | -68.2 | 151.2 | 0 | 0 | 0 | 108.9 | P51 Q55 W57 V58 L189 T190 | P51-I53 VanDerWaalsContact C-N 3.3Å; P51-I53 PolarHBondContact O-N 3.2Å; I53-Q55 PolarHBondContact O-N 3.03Å; I53-W57 HydrophobicContact CG2-CB 3.58Å; I53-V58 HydrophobicContact CB-CG2 4.36Å; I53-V58 HydrophobicContact CG2-CG2 3.76Å; I53-L189 WeakPolarHBondContact CD1-O 3.45Å; I53-T190 HydrophobicContact CD1-CG2 3.96Å | ||
| 54 | P | 59.8 | Low | 63.2 | Low | 55 Ų | 55 | 73 Ų | 73 | 36% | 0.357 | 38% | 0.383 | S | S | . | . | trans | -61.1 | 136 | 175.4 | 24.8 | -29.9 | 0 | 0 | 0 | 108.7 | D56 W57 S154 | P54-D56 PolarHBondContact O-N 3.48Å; P54-W57 PolarHBondContact O-N 3.4Å; P54-S154 VanDerWaalsContact CG-OG 3.25Å; P54-S154 WeakPolarHBondContact CG-OG 3.36Å | ||
| 55 | Q | 60 | Low | 63.4 | Low | 159 Ų | 159 | 70 Ų | 70 | 74% | 0.743 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -49 | -25.1 | -174.8 | -166.8 | 168.3 | -57.4 | 0 | 0 | 113.7 | I53 V58 S59 | I53-Q55 PolarHBondContact O-N 3.03Å; Q55-V58 PolarHBondContact O-N 3.49Å; Q55-S59 WeakPolarHBondContact O-CB 3.34Å; Q55-S59 PolarHBondContact O-N 2.73Å; Q55-S59 PolarHBondContact O-OG 2.86Å |
| 56 | D | 69.4 | Low | 63.8 | Low | 101 Ų | 101 | 71.1 Ų | 71.1 | 54% | 0.54 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -61.3 | -45 | 176.2 | -59.4 | -10.3 | 0 | 0 | 0 | 112.7 | P54 S59 F60 P152 | P54-D56 PolarHBondContact O-N 3.48Å; D56-S59 PolarHBondContact O-N 3.24Å; D56-F60 VanDerWaalsContact O-CB 3.29Å; D56-F60 WeakPolarHBondContact O-CB 3.49Å; D56-F60 PolarHBondContact O-N 2.75Å; D56-P152 HydrophobicContact CB-CB 4.27Å; D56-P152 HydrophobicContact CB-CG 4.46Å |
| 57 | W | 72.5 | Confident | 65 | Low | 0 Ų | 0 | 65.6 Ų | 65.6 | 0% | 0 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -68.1 | -41.7 | 177.9 | -86.6 | 120.1 | 0 | 0 | 0 | 111.7 | I53 P54 S59 F60 L61 V86 P152 S154 Q155 P156 P157 | I53-W57 HydrophobicContact CG2-CB 3.58Å; P54-W57 PolarHBondContact O-N 3.4Å; W57-S59 VanDerWaalsContact C-N 3.26Å; W57-S59 PolarHBondContact O-N 2.8Å; W57-F60 AromaticContact CE3-CD1 3.91Å; W57-F60 HydrophobicContact CE3-CD1 3.91Å; W57-F60 AromaticContact CZ3-CD1 3.7Å; W57-F60 HydrophobicContact CZ3-CD1 3.7Å; W57-F60 AromaticContact CZ3-CE1 3.96Å; W57-F60 HydrophobicContact CZ3-CE1 3.96Å; W57-F60 PolarHBondContact O-N 2.77Å; W57-L61 HydrophobicContact CE3-CD1 4.41Å; W57-L61 HydrophobicContact CE3-CD2 4.4Å; W57-L61 HydrophobicContact CE3-CG 4.25Å; W57-L61 WeakPolarHBondContact O-CB 3.47Å; W57-L61 WeakPolarHBondContact O-CD1 3.49Å; W57-L61 WeakPolarHBondContact O-CG 3.42Å; W57-L61 PolarHBondContact O-N 2.77Å; W57-V86 HydrophobicContact CH2-CB 4.25Å; W57-V86 HydrophobicContact CH2-CG1 3.52Å; W57-V86 HydrophobicContact CZ2-CG1 3.77Å; W57-P152 HydrophobicContact CD2-CB 3.98Å; W57-P152 HydrophobicContact CD2-CG 3.86Å; W57-P152 HydrophobicContact CE3-CG 4.02Å; W57-P152 HydrophobicContact CG-CB 4.29Å; W57-P152 HydrophobicContact CG-CG 4.36Å; W57-P152 HydrophobicContact CH2-CB 4.5Å; W57-P152 HydrophobicContact CH2-CG 4.25Å; W57-P152 HydrophobicContact CZ2-CB 3.91Å; W57-P152 HydrophobicContact CZ2-CG 4.14Å; W57-P152 HydrophobicContact CZ3-CG 4.22Å; W57-S154 PolarHBondContact NE1-O 2.85Å; W57-S154 PolarHBondContact NE1-OG 3.34Å; W57-S154 VanDerWaalsContact NE1-OG 3.09Å; W57-Q155 PolarHBondContact NE1-O 3.07Å; W57-P156 HydrophobicContact CH2-CB 3.99Å; W57-P156 HydrophobicContact CZ2-CB 3.69Å; W57-P157 HydrophobicContact CG-CG 4.46Å |
| 58 | V | 68.1 | Low | 65.9 | Low | 60 Ų | 60 | 67 Ų | 67 | 36% | 0.364 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -59.8 | -42.4 | 176.6 | 177.9 | 0 | 0 | 0 | 0 | 110.5 | I53 Q55 R62 | I53-V58 HydrophobicContact CB-CG2 4.36Å; I53-V58 HydrophobicContact CG2-CG2 3.76Å; Q55-V58 PolarHBondContact O-N 3.49Å; V58-R62 VanDerWaalsContact O-CB 3.28Å; V58-R62 WeakPolarHBondContact O-CB 3.45Å; V58-R62 PolarHBondContact O-N 3.13Å; V58-R62 VanDerWaalsContact O-N 3.11Å |
| 59 | S | 71.5 | Confident | 66.9 | Low | 51 Ų | 51 | 64.7 Ų | 64.7 | 36% | 0.357 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -67.9 | -46.2 | 178.6 | -56.8 | 0 | 0 | 0 | 0 | 111.6 | Q55 D56 W57 R62 S63 | Q55-S59 WeakPolarHBondContact O-CB 3.34Å; Q55-S59 PolarHBondContact O-N 2.73Å; Q55-S59 PolarHBondContact O-OG 2.86Å; D56-S59 PolarHBondContact O-N 3.24Å; W57-S59 VanDerWaalsContact C-N 3.26Å; W57-S59 PolarHBondContact O-N 2.8Å; S59-R62 PolarHBondContact O-N 2.82Å; S59-S63 PolarHBondContact O-N 3.01Å; S59-S63 PolarHBondContact O-OG 3.25Å |
| 60 | F | 78 | Confident | 67.9 | Low | 13 Ų | 13 | 59.4 Ų | 59.4 | 6% | 0.057 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -58.8 | -49 | 177.7 | 179 | -97.1 | 0 | 0 | 0 | 112.4 | D56 W57 R62 S63 F64 M115 F144 L151 P152 | D56-F60 VanDerWaalsContact O-CB 3.29Å; D56-F60 WeakPolarHBondContact O-CB 3.49Å; D56-F60 PolarHBondContact O-N 2.75Å; W57-F60 AromaticContact CE3-CD1 3.91Å; W57-F60 HydrophobicContact CE3-CD1 3.91Å; W57-F60 AromaticContact CZ3-CD1 3.7Å; W57-F60 HydrophobicContact CZ3-CD1 3.7Å; W57-F60 AromaticContact CZ3-CE1 3.96Å; W57-F60 HydrophobicContact CZ3-CE1 3.96Å; W57-F60 PolarHBondContact O-N 2.77Å; F60-R62 PolarHBondContact O-N 2.61Å; F60-S63 PolarHBondContact O-N 3.18Å; F60-F64 WeakPolarHBondContact O-CB 3.4Å; F60-F64 PolarHBondContact O-N 3.39Å; F60-M115 HydrophobicContact CE2-SD 3.99Å; F60-M115 HydrophobicContact CZ-SD 4.43Å; F60-F144 HydrophobicContact CE1-CD1 4.19Å; F60-F144 HydrophobicContact CE1-CE1 4.05Å; F60-F144 HydrophobicContact CE1-CE2 4.39Å; F60-F144 HydrophobicContact CE1-CG 4.41Å; F60-F144 HydrophobicContact CE1-CZ 4.16Å; F60-F144 AromaticContact CZ-CD1 3.75Å; F60-F144 HydrophobicContact CZ-CD1 3.75Å; F60-F144 AromaticContact CZ-CE1 3.94Å; F60-F144 HydrophobicContact CZ-CE1 3.94Å; F60-F144 HydrophobicContact CZ-CG 4.13Å; F60-F144 HydrophobicContact CZ-CZ 4.49Å; F60-L151 HydrophobicContact CE2-CD2 3.7Å; F60-L151 HydrophobicContact CZ-CD2 3.75Å; F60-P152 HydrophobicContact CB-CG 4.13Å; F60-P152 HydrophobicContact CG-CG 4.27Å |
| 61 | L | 75.6 | Confident | 68.9 | Low | 4 Ų | 4 | 59.8 Ų | 59.8 | 2% | 0.021 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -71.9 | -31.5 | -176.5 | -64.3 | 168.7 | 0 | 0 | 0 | 112.8 | W57 F64 G65 L88 L187 L189 | W57-L61 HydrophobicContact CE3-CD1 4.41Å; W57-L61 HydrophobicContact CE3-CD2 4.4Å; W57-L61 HydrophobicContact CE3-CG 4.25Å; W57-L61 WeakPolarHBondContact O-CB 3.47Å; W57-L61 WeakPolarHBondContact O-CD1 3.49Å; W57-L61 WeakPolarHBondContact O-CG 3.42Å; W57-L61 PolarHBondContact O-N 2.77Å; L61-F64 PolarHBondContact O-N 3.01Å; L61-G65 PolarHBondContact O-N 2.94Å; L61-L88 HydrophobicContact CD2-CD2 3.73Å; L61-L187 HydrophobicContact CB-CD2 4.07Å; L61-L187 HydrophobicContact CD2-CD2 3.66Å; L61-L187 HydrophobicContact CG-CD2 4.33Å; L61-L189 HydrophobicContact CD1-CB 3.55Å; L61-L189 HydrophobicContact CD1-CD1 3.56Å; L61-L189 HydrophobicContact CD1-CD2 4.4Å; L61-L189 HydrophobicContact CD1-CG 4.02Å; L61-L189 HydrophobicContact CD2-CD1 3.9Å; L61-L189 HydrophobicContact CG-CD1 4.29Å |
| 62 | R | 74.8 | Confident | 69.4 | Low | 146 Ų | 146 | 59.3 Ų | 59.3 | 55% | 0.551 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -61.2 | -47.5 | 171.6 | -176.2 | -175.3 | -61.7 | 109.5 | -2.3 | 111 | V58 S59 F60 F64 G65 | V58-R62 VanDerWaalsContact O-CB 3.28Å; V58-R62 WeakPolarHBondContact O-CB 3.45Å; V58-R62 PolarHBondContact O-N 3.13Å; V58-R62 VanDerWaalsContact O-N 3.11Å; S59-R62 PolarHBondContact O-N 2.82Å; F60-R62 PolarHBondContact O-N 2.61Å; R62-F64 VanDerWaalsContact C-N 3.32Å; R62-G65 PolarHBondContact O-N 2.97Å |
| 63 | S | 74.6 | Confident | 69.5 | Low | 27 Ų | 27 | 60 Ų | 60 | 19% | 0.189 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -63 | -41.5 | 175.3 | -57.8 | 0 | 0 | 0 | 0 | 111.3 | S59 F60 G65 Q66 M115 | S59-S63 PolarHBondContact O-N 3.01Å; S59-S63 PolarHBondContact O-OG 3.25Å; F60-S63 PolarHBondContact O-N 3.18Å; S63-G65 PolarHBondContact O-N 3.42Å; S63-Q66 PolarHBondContact O-N 3.2Å; S63-M115 VanDerWaalsContact CB-C 3.43Å; S63-M115 WeakPolarHBondContact CB-O 3.48Å; S63-M115 PolarHBondContact OG-O 3.42Å |
| 64 | F | 78.4 | Confident | 69.3 | Low | 1 Ų | 1 | 60.9 Ų | 60.9 | 0% | 0.004 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -62.5 | -40.2 | 178.7 | -178.5 | -104.8 | 0 | 0 | 0 | 113.1 | F60 L61 R62 Q66 L67 L69 I128 L142 F144 V181 L187 | F60-F64 WeakPolarHBondContact O-CB 3.4Å; F60-F64 PolarHBondContact O-N 3.39Å; L61-F64 PolarHBondContact O-N 3.01Å; R62-F64 VanDerWaalsContact C-N 3.32Å; F64-Q66 PolarHBondContact O-N 3.07Å; F64-Q66 VanDerWaalsContact O-N 3.13Å; F64-L67 HydrophobicContact CD2-CD1 3.96Å; F64-L67 WeakPolarHBondContact O-CB 2.82Å; F64-L67 PolarHBondContact O-N 2.88Å; F64-L67 VanDerWaalsContact O-N 3.07Å; F64-L69 HydrophobicContact CE2-CD1 4.27Å; F64-L69 HydrophobicContact CE2-CD2 4.41Å; F64-L69 HydrophobicContact CZ-CD1 4.17Å; F64-I128 HydrophobicContact CE2-CD1 3.92Å; F64-I128 HydrophobicContact CE2-CG1 4.49Å; F64-I128 HydrophobicContact CE2-CG2 4.37Å; F64-L142 HydrophobicContact CE1-CD1 3.76Å; F64-L142 HydrophobicContact CZ-CD1 3.82Å; F64-F144 HydrophobicContact CD1-CZ 4.43Å; F64-F144 AromaticContact CD2-CE1 3.68Å; F64-F144 HydrophobicContact CD2-CE1 3.68Å; F64-F144 HydrophobicContact CD2-CZ 4.08Å; F64-F144 HydrophobicContact CE1-CZ 4.18Å; F64-F144 AromaticContact CE2-CE1 3.51Å; F64-F144 HydrophobicContact CE2-CE1 3.51Å; F64-F144 AromaticContact CE2-CZ 3.83Å; F64-F144 HydrophobicContact CE2-CZ 3.83Å; F64-F144 HydrophobicContact CG-CE1 4.36Å; F64-F144 HydrophobicContact CG-CZ 4.38Å; F64-F144 HydrophobicContact CZ-CE1 4.05Å; F64-F144 AromaticContact CZ-CZ 3.88Å; F64-F144 HydrophobicContact CZ-CZ 3.88Å; F64-V181 HydrophobicContact CD1-CG1 4.03Å; F64-V181 HydrophobicContact CE1-CB 4.45Å; F64-V181 HydrophobicContact CE1-CG1 3.62Å; F64-V181 HydrophobicContact CE1-CG2 4.23Å; F64-V181 HydrophobicContact CZ-CG1 4.26Å; F64-V181 HydrophobicContact CZ-CG2 4.03Å; F64-L187 HydrophobicContact CD1-CD1 4.18Å; F64-L187 HydrophobicContact CD1-CD2 4.03Å; F64-L187 HydrophobicContact CE1-CD1 4.34Å |
| 65 | G | 71.5 | Confident | 68.6 | Low | 28 Ų | 28 | 63.7 Ų | 63.7 | 29% | 0.289 | 35% | 0.348 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.3 | -1.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 115 | L61 R62 S63 | L61-G65 PolarHBondContact O-N 2.94Å; R62-G65 PolarHBondContact O-N 2.97Å; S63-G65 PolarHBondContact O-N 3.42Å |
| 66 | Q | 71 | Confident | 68 | Low | 159 Ų | 159 | 57.9 Ų | 57.9 | 74% | 0.743 | 32% | 0.324 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105.5 | 0.6 | 172.6 | -66.1 | -179.3 | -21.4 | 0 | 0 | 112.4 | S63 F64 | S63-Q66 PolarHBondContact O-N 3.2Å; F64-Q66 PolarHBondContact O-N 3.07Å; F64-Q66 VanDerWaalsContact O-N 3.13Å |
| 67 | L | 73.7 | Confident | 66.7 | Low | 17 Ų | 17 | 59.7 Ų | 59.7 | 9% | 0.089 | 34% | 0.338 | C | S | . | . | trans | -88.9 | 145.6 | -176.6 | -68.4 | 172.5 | 0 | 0 | 0 | 112.7 | F64 L69 V110 Q114 M115 V181 | F64-L67 HydrophobicContact CD2-CD1 3.96Å; F64-L67 WeakPolarHBondContact O-CB 2.82Å; F64-L67 PolarHBondContact O-N 2.88Å; F64-L67 VanDerWaalsContact O-N 3.07Å; L67-L69 HydrophobicContact CB-CD2 4.46Å; L67-V110 HydrophobicContact CD1-CG1 3.83Å; L67-V110 HydrophobicContact CD1-CG2 4.48Å; L67-V110 HydrophobicContact CD2-CG1 4.03Å; L67-Q114 HydrophobicContact CD2-CB 3.76Å; L67-Q114 WeakPolarHBondContact CD2-O 3.22Å; L67-M115 HydrophobicContact CD1-CE 4.41Å; L67-M115 HydrophobicContact CD1-CG 4.03Å; L67-V181 PolarHBondContact O-N 3.29Å | ||
| 68 | T | 71.2 | Confident | 65.5 | Low | 79 Ų | 79 | 61.9 Ų | 61.9 | 49% | 0.485 | 36% | 0.361 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.5 | 119.5 | 163.2 | -44.2 | 0 | 0 | 0 | 0 | 108.3 | C178 | T68-C178 HydrophobicContact CG2-CB 3.49Å; T68-C178 VanDerWaalsContact CG2-CB 3.49Å |
| 69 | L | 73.8 | Confident | 64.8 | Low | 0 Ų | 0 | 69 Ų | 69 | 0% | 0 | 39% | 0.387 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.1 | 109.8 | -179.3 | -59.1 | 179.8 | 0 | 0 | 0 | 109.5 | F64 L67 F106 A108 V110 I128 C178 V179 V181 | F64-L69 HydrophobicContact CE2-CD1 4.27Å; F64-L69 HydrophobicContact CE2-CD2 4.41Å; F64-L69 HydrophobicContact CZ-CD1 4.17Å; L67-L69 HydrophobicContact CB-CD2 4.46Å; L69-F106 HydrophobicContact CB-CE1 3.73Å; L69-F106 HydrophobicContact CB-CZ 3.7Å; L69-F106 HydrophobicContact CD1-CE1 3.94Å; L69-F106 HydrophobicContact CG-CE1 4.47Å; L69-A108 HydrophobicContact CB-CB 3.92Å; L69-A108 HydrophobicContact CD2-CB 4.18Å; L69-V110 HydrophobicContact CD2-CG2 3.73Å; L69-I128 HydrophobicContact CD1-CG2 4.3Å; L69-I128 HydrophobicContact CD2-CD1 3.52Å; L69-C178 CarbonylContact O-C 3.55Å; L69-C178 WeakPolarHBondContact O-CA 3.47Å; L69-V179 PolarHBondContact N-O 3.31Å; L69-V179 PolarHBondContact O-N 3.28Å; L69-V181 HydrophobicContact CD1-CG2 3.54Å; L69-V181 HydrophobicContact CG-CG2 3.74Å |
| 70 | C | 71.9 | Confident | 64.4 | Low | 59 Ų | 59 | 70 Ų | 70 | 40% | 0.399 | 38% | 0.383 | S | S | . | . | trans | -91.9 | 135.5 | 173.8 | -59.4 | 0 | 0 | 0 | 0 | 110.3 | A108 C178 | C70-A108 WeakPolarHBondContact O-CB 3.35Å; C70-C178 HydrophobicContact CB-CB 4Å; C70-C178 WeakPolarHBondContact CB-SG 2.94Å; C70-C178 WeakPolarHBondContact SG-CB 3.25Å; C70-C178 CovalentContact SG-SG 2.04Å; C70-C178 PolarHBondContact SG-SG 2.96Å | ||
| 71 | P | 68.3 | Low | 63.6 | Low | 25 Ų | 25 | 80.4 Ų | 80.4 | 16% | 0.162 | 42% | 0.422 | C | S | . | . | trans | -61.3 | 140.7 | 175.3 | 25.4 | -31.9 | 0 | 0 | 0 | 110 | N73 F106 G175 | P71-N73 PolarHBondContact O-N 2.84Å; P71-F106 HydrophobicContact CB-CE2 4.24Å; P71-G175 WeakPolarHBondContact CG-O 3.21Å | ||
| 72 | R | 65.1 | Low | 63 | Low | 107 Ų | 107 | 80.8 Ų | 80.8 | 40% | 0.404 | 43% | 0.427 | S | S | . | . | trans | -72.8 | 112 | 178.7 | -174.9 | 168.6 | -179.4 | 167.9 | -2.6 | 110.1 | G74 V76 | R72-G74 VanDerWaalsContact C-N 3.27Å; R72-G74 PolarHBondContact O-N 3.26Å; R72-V76 VanDerWaalsContact NH1-CG2 3.27Å | ||
| 73 | N | 56.8 | Low | 62.7 | Low | 143 Ų | 143 | 78.2 Ų | 78.2 | 77% | 0.765 | 43% | 0.431 | S | S | * | . | S | Bend | trans | -70.3 | 83.6 | 167.3 | -76 | -8 | 0 | 0 | 0 | 109.5 | P71 | P71-N73 PolarHBondContact O-N 2.84Š|
| 74 | G | 49.8 | Very low | 62.9 | Low | 44 Ų | 44 | 79.8 Ų | 79.8 | 45% | 0.454 | 44% | 0.435 | S | S | . | . | S | Bend | trans | 151.7 | 138.4 | 172.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | R72 V76 | R72-G74 VanDerWaalsContact C-N 3.27Å; R72-G74 PolarHBondContact O-N 3.26Å; G74-V76 PolarHBondContact O-N 2.04Å |
| 75 | T | 44.5 | Very low | 62.9 | Low | 114 Ų | 114 | 83 Ų | 83 | 70% | 0.699 | 46% | 0.455 | S | S | * | . | trans | -60.6 | 118.7 | 166.4 | 36.6 | 0 | 0 | 0 | 0 | 109.2 | T77 | T75-T77 VanDerWaalsContact C-N 3.27Å; T75-T77 PolarHBondContact O-N 3.48Å | ||
| 76 | V | 47.8 | Very low | 63.3 | Low | 38 Ų | 38 | 82.2 Ų | 82.2 | 23% | 0.23 | 44% | 0.444 | C | S | . | . | trans | -75.3 | 86.6 | 171.4 | -166 | 0 | 0 | 0 | 0 | 107.7 | R72 G74 G78 | R72-V76 VanDerWaalsContact NH1-CG2 3.27Å; G74-V76 PolarHBondContact O-N 2.04Å; V76-G78 PolarHBondContact O-N 2.88Å | ||
| 77 | T | 42 | Very low | 63.7 | Low | 138 Ų | 138 | 75.2 Ų | 75.2 | 85% | 0.847 | 42% | 0.415 | S | S | * | . | trans | -79.1 | 12.9 | 172.9 | 47.3 | 0 | 0 | 0 | 0 | 112.8 | T75 | T75-T77 VanDerWaalsContact C-N 3.27Å; T75-T77 PolarHBondContact O-N 3.48Å | ||
| 78 | G | 48 | Very low | 63.9 | Low | 46 Ų | 46 | 74.4 Ų | 74.4 | 47% | 0.474 | 41% | 0.411 | S | S | . | . | S | Bend | trans | -109.4 | 133.9 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | V76 W80 | V76-G78 PolarHBondContact O-N 2.88Å; G78-W80 PolarHBondContact O-N 2.75Å |
| 79 | K | 51.7 | Low | 64.1 | Low | 210 Ų | 210 | 73.8 Ų | 73.8 | 91% | 0.913 | 40% | 0.404 | S | S | * | . | trans | -53.5 | 107.9 | 169.5 | -165.2 | 175.6 | -175 | 178.3 | 0 | 108.5 | R81 | K79-R81 PolarHBondContact O-N 3.42Š| ||
| 80 | W | 64.3 | Low | 63.9 | Low | 73 Ų | 73 | 74.7 Ų | 74.7 | 28% | 0.277 | 41% | 0.409 | S | S | . | . | trans | -58.7 | 129.2 | 179.4 | 179 | -106.4 | 0 | 0 | 0 | 109.4 | G78 G82 T109 L125 L127 S145 | G78-W80 PolarHBondContact O-N 2.75Å; W80-G82 VanDerWaalsContact C-N 3.34Å; W80-G82 VanDerWaalsContact CD1-N 3.29Å; W80-T109 HydrophobicContact CZ3-CG2 4.43Å; W80-L125 HydrophobicContact CH2-CB 3.75Å; W80-L125 HydrophobicContact CZ3-CB 4.4Å; W80-L127 HydrophobicContact CD2-CB 3.93Å; W80-L127 HydrophobicContact CD2-CD2 3.95Å; W80-L127 VanDerWaalsContact CE2-CB 3.43Å; W80-L127 HydrophobicContact CE3-CB 4.25Å; W80-L127 HydrophobicContact CE3-CD2 4.42Å; W80-L127 HydrophobicContact CG-CD2 3.99Å; W80-L127 HydrophobicContact CH2-CB 3.72Å; W80-L127 HydrophobicContact CZ2-CB 3.36Å; W80-L127 VanDerWaalsContact CZ2-N 3.3Å; W80-L127 HydrophobicContact CZ3-CB 4.15Å; W80-S145 VanDerWaalsContact CZ2-O 3.28Å; W80-S145 WeakPolarHBondContact CZ2-O 3.38Å; W80-S145 PolarHBondContact NE1-O 3.21Å; W80-S145 PolarHBondContact NE1-OG 3.48Å | ||
| 81 | R | 60.5 | Low | 63.4 | Low | 231 Ų | 231 | 77.7 Ų | 77.7 | 87% | 0.872 | 43% | 0.426 | S | S | * | . | trans | -83.3 | -7.5 | -173.4 | -103.1 | -171.8 | -98.3 | -154.3 | -4 | 113.9 | K79 S83 | K79-R81 PolarHBondContact O-N 3.42Å; R81-S83 PolarHBondContact O-N 3.3Å; R81-S83 VanDerWaalsContact O-N 3.15Å | ||
| 82 | G | 62.9 | Low | 63.1 | Low | 11 Ų | 11 | 77.7 Ų | 77.7 | 11% | 0.113 | 43% | 0.425 | C | S | . | . | trans | -73.7 | 104.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111 | W80 S145 A146 | W80-G82 VanDerWaalsContact C-N 3.34Å; W80-G82 VanDerWaalsContact CD1-N 3.29Å; G82-S145 PolarHBondContact O-OG 2.89Å; G82-S145 VanDerWaalsContact O-OG 3.05Å; G82-A146 CarbonylContact C-O 3.56Å; G82-A146 VanDerWaalsContact CA-C 3.45Å; G82-A146 WeakPolarHBondContact CA-O 3.42Å | ||
| 83 | S | 69.9 | Low | 62.7 | Low | 92 Ų | 92 | 78.6 Ų | 78.6 | 64% | 0.643 | 44% | 0.438 | S | S | * | . | trans | -81.4 | -18.6 | 174.7 | 55.1 | 0 | 0 | 0 | 0 | 112.9 | R81 P148 | R81-S83 PolarHBondContact O-N 3.3Å; R81-S83 VanDerWaalsContact O-N 3.15Å; S83-P148 WeakPolarHBondContact OG-CD 3.42Å; S83-P148 WeakPolarHBondContact OG-CG 3.27Å | ||
| 84 | H | 77.5 | Confident | 62.8 | Low | 60 Ų | 60 | 73 Ų | 73 | 28% | 0.278 | 41% | 0.406 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.7 | 115.7 | -179.1 | -166 | -92.5 | 0 | 0 | 0 | 110 | V86 S145 A146 P148 | H84-V86 VanDerWaalsContact CE1-CG2 3.44Å; H84-V86 WeakPolarHBondContact CE1-CG2 3.1Å; H84-S145 WeakPolarHBondContact O-CA 3.26Å; H84-A146 PolarHBondContact N-O 3.37Å; H84-A146 PolarHBondContact O-N 3.43Å; H84-P148 HydrophobicContact CB-CG 4.46Å |
| 85 | V | 78.2 | Confident | 63 | Low | 70 Ų | 70 | 73.6 Ų | 73.6 | 42% | 0.424 | 41% | 0.413 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116 | 129.9 | -179.8 | -176.8 | 0 | 0 | 0 | 0 | 109.3 | Y143 F144 A165 | V85-Y143 HydrophobicContact CG1-CD1 4.17Å; V85-F144 CarbonylContact C-O 3.54Å; V85-F144 VanDerWaalsContact CA-O 3.29Å; V85-F144 WeakPolarHBondContact CA-O 3.03Å; V85-A165 HydrophobicContact CG1-CB 4.41Å |
| 86 | V | 79.7 | Confident | 63 | Low | 10 Ų | 10 | 75.8 Ų | 75.8 | 6% | 0.061 | 42% | 0.42 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.4 | 124.3 | 172.4 | -171.8 | 0 | 0 | 0 | 0 | 109.7 | W57 H84 Y143 F144 L151 P156 | W57-V86 HydrophobicContact CH2-CB 4.25Å; W57-V86 HydrophobicContact CH2-CG1 3.52Å; W57-V86 HydrophobicContact CZ2-CG1 3.77Å; H84-V86 VanDerWaalsContact CE1-CG2 3.44Å; H84-V86 WeakPolarHBondContact CE1-CG2 3.1Å; V86-Y143 CarbonylContact O-C 3.52Å; V86-Y143 WeakPolarHBondContact O-CA 3.41Å; V86-F144 PolarHBondContact N-O 3.05Å; V86-F144 PolarHBondContact O-N 2.87Å; V86-L151 HydrophobicContact CG2-CB 4.33Å; V86-L151 HydrophobicContact CG2-CD1 4.12Å; V86-P156 HydrophobicContact CG1-CB 3.68Å; V86-P156 HydrophobicContact CG1-CG 3.56Å |
| 87 | G | 80.1 | Confident | 63.2 | Low | 12 Ų | 12 | 74.9 Ų | 74.9 | 12% | 0.124 | 42% | 0.419 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.7 | 133.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | L142 P156 S159 C160 | G87-L142 CarbonylContact C-O 3.57Å; G87-L142 WeakPolarHBondContact CA-O 3.35Å; G87-P156 WeakPolarHBondContact O-CG 3.37Å; G87-S159 WeakPolarHBondContact O-CA 3.28Å; G87-C160 PolarHBondContact O-N 3.31Å |
| 88 | L | 78.8 | Confident | 63.4 | Low | 0 Ų | 0 | 74.7 Ų | 74.7 | 0% | 0 | 42% | 0.42 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.9 | 119 | -176.4 | -161 | 72.5 | 0 | 0 | 0 | 110.7 | L61 L142 F144 P156 I158 C160 L189 | L61-L88 HydrophobicContact CD2-CD2 3.73Å; L88-L142 HydrophobicContact CB-CB 4.31Å; L88-L142 PolarHBondContact N-O 3.11Å; L88-L142 PolarHBondContact O-N 2.81Å; L88-F144 HydrophobicContact CB-CE2 3.99Å; L88-F144 HydrophobicContact CD2-CE2 4.11Å; L88-P156 HydrophobicContact CD1-CB 3.84Å; L88-I158 WeakPolarHBondContact CA-O 3.23Å; L88-C160 VanDerWaalsContact C-SG 3.53Å; L88-L189 HydrophobicContact CD1-CD2 3.07Å; L88-L189 HydrophobicContact CD1-CG 4.46Å; L88-L189 HydrophobicContact CD2-CD1 3.78Å; L88-L189 HydrophobicContact CD2-CD2 3.65Å; L88-L189 HydrophobicContact CD2-CG 4.38Å; L88-L189 HydrophobicContact CG-CD1 4.47Å; L88-L189 HydrophobicContact CG-CD2 3.47Å; L88-L189 VanDerWaalsContact CG-CD2 3.47Å |
| 89 | L | 74.4 | Confident | 63.7 | Low | 67 Ų | 67 | 76.4 Ų | 76.4 | 35% | 0.351 | 42% | 0.418 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.6 | 130.2 | 174.1 | -169.3 | 68.8 | 0 | 0 | 0 | 110.2 | I158 | L89-I158 HydrophobicContact CB-CB 4.14Å; L89-I158 HydrophobicContact CB-CG2 3.56Å; L89-I158 HydrophobicContact CD2-CG2 3.92Å; L89-I158 HydrophobicContact CG-CG2 4.36Å; L89-I158 PolarHBondContact N-O 2.91Å |
| 90 | T | 68.8 | Low | 63.7 | Low | 18 Ų | 18 | 76.2 Ų | 76.2 | 11% | 0.11 | 41% | 0.412 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.2 | 160.6 | 179.1 | -174.2 | 0 | 0 | 0 | 0 | 111.7 | L92 T140 L142 | T90-L92 VanDerWaalsContact C-N 3.32Å; T90-L92 HydrophobicContact CG2-CB 3.92Å; T90-L92 HydrophobicContact CG2-CD1 3.93Å; T90-L92 HydrophobicContact CG2-CG 3.93Å; T90-T140 HydrophobicContact CG2-CG2 4.41Å; T90-T140 VanDerWaalsContact CG2-O 3.25Å; T90-T140 WeakPolarHBondContact CG2-O 3.46Å; T90-T140 PolarHBondContact N-O 3.26Å; T90-T140 PolarHBondContact O-N 3.42Å; T90-T140 VanDerWaalsContact O-O 3.13Å; T90-L142 HydrophobicContact CG2-CD1 3.64Å; T90-L142 HydrophobicContact CG2-CG 3.69Å |
| 91 | T | 62.5 | Low | 63.1 | Low | 123 Ų | 123 | 80.1 Ų | 80.1 | 76% | 0.755 | 44% | 0.438 | S | S | * | . | trans | -90.2 | 9.2 | 177.5 | 53.5 | 0 | 0 | 0 | 0 | 113.1 | N93 | T91-N93 PolarHBondContact O-N 2.98Š| ||
| 92 | L | 61.5 | Low | 62.9 | Low | 25 Ų | 25 | 76 Ų | 76 | 13% | 0.131 | 43% | 0.426 | C | S | . | . | trans | -63 | 120.9 | 178.4 | -67.4 | 173.9 | 0 | 0 | 0 | 110.8 | T90 F94 T140 L142 V181 | T90-L92 VanDerWaalsContact C-N 3.32Å; T90-L92 HydrophobicContact CG2-CB 3.92Å; T90-L92 HydrophobicContact CG2-CD1 3.93Å; T90-L92 HydrophobicContact CG2-CG 3.93Å; L92-F94 HydrophobicContact CB-CD2 4.32Å; L92-F94 HydrophobicContact CB-CE2 3.68Å; L92-F94 HydrophobicContact CB-CZ 4.2Å; L92-F94 HydrophobicContact CD1-CE2 4.24Å; L92-F94 HydrophobicContact CD1-CZ 4.08Å; L92-T140 WeakPolarHBondContact O-CB 3.25Å; L92-T140 PolarHBondContact O-OG1 2.85Å; L92-L142 HydrophobicContact CD1-CD1 4.03Å; L92-V181 HydrophobicContact CD1-CG1 4.13Å | ||
| 93 | N | 57.8 | Low | 62.8 | Low | 126 Ų | 126 | 79.1 Ų | 79.1 | 67% | 0.674 | 44% | 0.444 | S | S | * | . | trans | -94 | 113.6 | 172.6 | -98.3 | -36.6 | 0 | 0 | 0 | 110.2 | T91 G95 | T91-N93 PolarHBondContact O-N 2.98Å; N93-G95 VanDerWaalsContact C-N 3.35Å; N93-G95 PolarHBondContact O-N 2.95Å | ||
| 94 | F | 58.9 | Low | 62.6 | Low | 24 Ų | 24 | 77.6 Ų | 77.6 | 11% | 0.105 | 42% | 0.424 | C | S | . | . | trans | -90.2 | 72.7 | 174.5 | -66.5 | -89.6 | 0 | 0 | 0 | 110.3 | L92 F106 A130 V132 T140 L142 V179 | L92-F94 HydrophobicContact CB-CD2 4.32Å; L92-F94 HydrophobicContact CB-CE2 3.68Å; L92-F94 HydrophobicContact CB-CZ 4.2Å; L92-F94 HydrophobicContact CD1-CE2 4.24Å; L92-F94 HydrophobicContact CD1-CZ 4.08Å; F94-F106 HydrophobicContact CE1-CD1 4.21Å; F94-A130 HydrophobicContact CD2-CB 4.21Å; F94-A130 HydrophobicContact CE2-CB 3.71Å; F94-A130 HydrophobicContact CZ-CB 3.94Å; F94-V132 HydrophobicContact CB-CG2 4.31Å; F94-V132 HydrophobicContact CD2-CG2 4.44Å; F94-T140 HydrophobicContact CD2-CG2 3.8Å; F94-T140 HydrophobicContact CE2-CG2 3.67Å; F94-L142 HydrophobicContact CZ-CD2 4.43Å; F94-V179 HydrophobicContact CD1-CG1 4.47Å; F94-V179 HydrophobicContact CE1-CG1 4.18Å | ||
| 95 | G | 52.3 | Low | 62.2 | Low | 57 Ų | 57 | 75.7 Ų | 75.7 | 59% | 0.588 | 42% | 0.416 | S | S | * | . | trans | 92.2 | 127.9 | 162.4 | 0 | 0 | 0 | 0 | 0 | 117.4 | N93 G97 | N93-G95 VanDerWaalsContact C-N 3.35Å; N93-G95 PolarHBondContact O-N 2.95Å; G95-G97 PolarHBondContact O-N 2.87Å | ||
| 96 | D | 46.4 | Very low | 62 | Low | 160 Ų | 160 | 72.8 Ų | 72.8 | 86% | 0.856 | 40% | 0.398 | S | S | * | . | trans | -77.3 | 55.4 | 172.5 | -86.6 | -42.5 | 0 | 0 | 0 | 112.7 | ||||
| 97 | G | 49.9 | Very low | 61.9 | Low | 20 Ų | 20 | 74.1 Ų | 74.1 | 21% | 0.206 | 40% | 0.404 | C | S | . | . | trans | -91.3 | 151.7 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | G95 D99 | G95-G97 PolarHBondContact O-N 2.87Å; G97-D99 PolarHBondContact O-N 3.23Å | ||
| 98 | P | 48.1 | Very low | 61.8 | Low | 134 Ų | 134 | 73.6 Ų | 73.6 | 87% | 0.87 | 40% | 0.398 | S | S | * | . | S | Bend | trans | -62.9 | -7.6 | -178.3 | 24 | -33.2 | 0 | 0 | 0 | 115.2 | R100 | P98-R100 PolarHBondContact O-N 2.89Š|
| 99 | D | 52.8 | Low | 62 | Low | 81 Ų | 81 | 75.9 Ų | 75.9 | 43% | 0.433 | 41% | 0.412 | S | S | . | . | trans | -92.7 | 54.1 | 177 | -55.5 | -60.4 | 0 | 0 | 0 | 113.1 | G97 N101 K102 R104 | G97-D99 PolarHBondContact O-N 3.23Å; D99-N101 PolarHBondContact O-N 2.87Å; D99-K102 PolarHBondContact O-N 3.33Å; D99-R104 IonicContact OD2-NH2 3.39Å; D99-R104 PolarHBondContact OD2-NH2 3.42Å | ||
| 100 | R | 52.8 | Low | 62.5 | Low | 206 Ų | 206 | 73 Ų | 73 | 78% | 0.777 | 40% | 0.397 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.8 | -19.5 | 176 | -84.3 | -174.2 | 164.7 | -168.8 | -3.6 | 114.2 | P98 | P98-R100 PolarHBondContact O-N 2.89Š|
| 101 | N | 51.9 | Low | 63.2 | Low | 156 Ų | 156 | 75 Ų | 75 | 83% | 0.834 | 41% | 0.407 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.1 | 5.2 | -173.3 | -70.1 | -3 | 0 | 0 | 0 | 114.5 | D99 | D99-N101 PolarHBondContact O-N 2.87Š|
| 102 | K | 56.5 | Low | 64.2 | Low | 143 Ų | 143 | 69.1 Ų | 69.1 | 62% | 0.622 | 37% | 0.371 | S | S | * | . | S | Bend | trans | -115.4 | 132.3 | 178.7 | -68.9 | -179 | -179.2 | 169.2 | 0 | 110.4 | D99 R104 | D99-K102 PolarHBondContact O-N 3.33Å; K102-R104 PolarHBondContact O-N 3.08Å |
| 103 | T | 60.7 | Low | 65.2 | Low | 77 Ų | 77 | 70.9 Ų | 70.9 | 47% | 0.472 | 39% | 0.385 | S | S | . | . | trans | -60.2 | 119.4 | 167 | 45.4 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 104 | R | 65.1 | Low | 66.3 | Low | 61 Ų | 61 | 70.4 Ų | 70.4 | 23% | 0.23 | 38% | 0.379 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.7 | 130.2 | 178.3 | -71.2 | -176 | 176.2 | -170 | -8.1 | 109 | D99 K102 V132 M174 | D99-R104 IonicContact OD2-NH2 3.39Å; D99-R104 PolarHBondContact OD2-NH2 3.42Å; K102-R104 PolarHBondContact O-N 3.08Å; R104-V132 HydrophobicContact CB-CG2 4.4Å; R104-V132 PolarHBondContact O-N 2.93Å; R104-M174 HydrophobicContact CB-CE 4.16Å; R104-M174 HydrophobicContact CG-CE 4.49Å |
| 105 | T | 69.7 | Low | 67.1 | Low | 19 Ų | 19 | 69.4 Ų | 69.4 | 12% | 0.117 | 38% | 0.375 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112 | 123 | 174.6 | 51.5 | 0 | 0 | 0 | 0 | 108.9 | A130 R131 A168 | T105-A130 CarbonylContact C-O 3.55Å; T105-A130 VanDerWaalsContact CA-O 3.3Å; T105-A130 WeakPolarHBondContact CA-O 3.41Å; T105-R131 HydrophobicContact CG2-CG 4.3Å; T105-A168 HydrophobicContact CG2-CB 4.34Å |
| 106 | F | 72.7 | Confident | 68.3 | Low | 9 Ų | 9 | 69 Ų | 69 | 4% | 0.039 | 37% | 0.37 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.2 | 133.8 | 172.8 | 168.3 | -92.8 | 0 | 0 | 0 | 108.2 | L69 P71 F94 A108 T129 A130 | L69-F106 HydrophobicContact CB-CE1 3.73Å; L69-F106 HydrophobicContact CB-CZ 3.7Å; L69-F106 HydrophobicContact CD1-CE1 3.94Å; L69-F106 HydrophobicContact CG-CE1 4.47Å; P71-F106 HydrophobicContact CB-CE2 4.24Å; F94-F106 HydrophobicContact CE1-CD1 4.21Å; F106-A108 HydrophobicContact CE1-CB 3.78Å; F106-A108 HydrophobicContact CZ-CB 3.94Å; F106-T129 CarbonylContact O-C 3.27Å; F106-T129 WeakPolarHBondContact O-CA 3.28Å; F106-A130 HydrophobicContact CB-CB 4.11Å; F106-A130 HydrophobicContact CD1-CB 4.19Å; F106-A130 PolarHBondContact N-O 3.37Å; F106-A130 PolarHBondContact O-N 3.24Å |
| 107 | Q | 77.3 | Confident | 69.8 | Low | 39 Ų | 39 | 63.2 Ų | 63.2 | 18% | 0.182 | 34% | 0.339 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.5 | 131.4 | 178.7 | -69 | -173.9 | 11.1 | 0 | 0 | 111 | I128 T129 L170 | Q107-I128 VanDerWaalsContact CA-O 3.31Å; Q107-I128 WeakPolarHBondContact CA-O 3.36Å; Q107-T129 HydrophobicContact CG-CG2 4.03Å; Q107-L170 VanDerWaalsContact OE1-CD2 3.27Å |
| 108 | A | 79.8 | Confident | 71.3 | Confident | 1 Ų | 1 | 71.2 Ų | 71.2 | 1% | 0.008 | 37% | 0.368 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.6 | 149 | 174.6 | 0 | 0 | 0 | 0 | 0 | 109.9 | L69 C70 F106 I128 | L69-A108 HydrophobicContact CB-CB 3.92Å; L69-A108 HydrophobicContact CD2-CB 4.18Å; C70-A108 WeakPolarHBondContact O-CB 3.35Å; F106-A108 HydrophobicContact CE1-CB 3.78Å; F106-A108 HydrophobicContact CZ-CB 3.94Å; A108-I128 PolarHBondContact N-O 2.75Å; A108-I128 PolarHBondContact O-N 3.4Å |
| 109 | T | 82.2 | Confident | 72.9 | Confident | 47 Ų | 47 | 68 Ų | 68 | 29% | 0.288 | 36% | 0.359 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.2 | 129 | 172.8 | 48.2 | 0 | 0 | 0 | 0 | 109.4 | W80 L127 | W80-T109 HydrophobicContact CZ3-CG2 4.43Å; T109-L127 HydrophobicContact CG2-CD1 3.81Å |
| 110 | V | 84 | Confident | 74.3 | Confident | 6 Ų | 6 | 69.4 Ų | 69.4 | 4% | 0.036 | 38% | 0.375 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.4 | 143.6 | -176.8 | 171 | 0 | 0 | 0 | 0 | 108.9 | L67 L69 Q114 M115 V126 I128 | L67-V110 HydrophobicContact CD1-CG1 3.83Å; L67-V110 HydrophobicContact CD1-CG2 4.48Å; L67-V110 HydrophobicContact CD2-CG1 4.03Å; L69-V110 HydrophobicContact CD2-CG2 3.73Å; V110-Q114 HydrophobicContact CG1-CB 3.81Å; V110-M115 HydrophobicContact CB-CE 3.55Å; V110-M115 HydrophobicContact CG1-CE 3.54Å; V110-M115 HydrophobicContact CG1-CG 3.91Å; V110-M115 HydrophobicContact CG2-CE 4.46Å; V110-V126 PolarHBondContact N-O 3.46Å; V110-V126 PolarHBondContact O-N 2.86Å; V110-I128 HydrophobicContact CB-CD1 4.09Å; V110-I128 HydrophobicContact CG2-CD1 3.68Å |
| 111 | L | 85.4 | Confident | 75.6 | Confident | 61 Ų | 61 | 61.1 Ų | 61.1 | 32% | 0.319 | 35% | 0.349 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.3 | 142.7 | 177.4 | -160.9 | 70.9 | 0 | 0 | 0 | 110.4 | S113 Q114 M115 L125 | L111-S113 WeakPolarHBondContact CD2-OG 3.23Å; L111-S113 PolarHBondContact O-N 3.46Å; L111-S113 VanDerWaalsContact O-N 3.16Å; L111-Q114 HydrophobicContact CB-CG 4.27Å; L111-Q114 WeakPolarHBondContact O-CA 3.08Å; L111-Q114 VanDerWaalsContact O-CB 3.31Å; L111-Q114 WeakPolarHBondContact O-CB 3.24Å; L111-Q114 PolarHBondContact O-N 2.86Å; L111-M115 PolarHBondContact O-N 2.9Å; L111-L125 HydrophobicContact CD1-CD2 3.78Å; L111-L125 HydrophobicContact CD1-CG 4.35Å |
| 112 | G | 82.5 | Confident | 76.9 | Confident | 0 Ų | 0 | 54.8 Ų | 54.8 | 0% | 0 | 32% | 0.318 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -55.1 | -35.7 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | Q114 M115 G116 L117 A122 Q124 | G112-Q114 PolarHBondContact O-N 2.86Å; G112-M115 CarbonylContact O-C 3.47Å; G112-M115 WeakPolarHBondContact O-CA 3.46Å; G112-M115 WeakPolarHBondContact O-CB 3.35Å; G112-M115 PolarHBondContact O-N 2.9Å; G112-G116 PolarHBondContact O-N 3.39Å; G112-L117 VanDerWaalsContact O-CB 3.23Å; G112-L117 WeakPolarHBondContact O-CB 3.25Å; G112-L117 WeakPolarHBondContact O-CG 3.47Å; G112-L117 PolarHBondContact O-N 3.28Å; G112-A122 CarbonylContact C-O 3.59Å; G112-Q124 PolarHBondContact N-O 2.99Å |
| 113 | S | 81.9 | Confident | 78.2 | Confident | 62 Ų | 62 | 50.7 Ų | 50.7 | 43% | 0.434 | 32% | 0.317 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.6 | -33.3 | 175.1 | 66.8 | 0 | 0 | 0 | 0 | 113 | L111 M115 G116 A122 | L111-S113 WeakPolarHBondContact CD2-OG 3.23Å; L111-S113 PolarHBondContact O-N 3.46Å; L111-S113 VanDerWaalsContact O-N 3.16Å; S113-M115 VanDerWaalsContact C-N 3.29Å; S113-G116 PolarHBondContact O-N 3.27Å; S113-A122 PolarHBondContact N-O 3.39Å |
| 114 | Q | 81.4 | Confident | 79.4 | Confident | 115 Ų | 115 | 50.7 Ų | 50.7 | 54% | 0.537 | 31% | 0.311 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.5 | -26.1 | 176 | -60.5 | 174.4 | -28.4 | 0 | 0 | 111 | L67 V110 L111 G112 G116 | L67-Q114 HydrophobicContact CD2-CB 3.76Å; L67-Q114 WeakPolarHBondContact CD2-O 3.22Å; V110-Q114 HydrophobicContact CG1-CB 3.81Å; L111-Q114 HydrophobicContact CB-CG 4.27Å; L111-Q114 WeakPolarHBondContact O-CA 3.08Å; L111-Q114 VanDerWaalsContact O-CB 3.31Å; L111-Q114 WeakPolarHBondContact O-CB 3.24Å; L111-Q114 PolarHBondContact O-N 2.86Å; G112-Q114 PolarHBondContact O-N 2.86Å; Q114-G116 PolarHBondContact O-N 3.5Å |
| 115 | M | 76.7 | Confident | 80.3 | Confident | 3 Ų | 3 | 51.9 Ų | 51.9 | 2% | 0.015 | 32% | 0.322 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -82.8 | 8.8 | 170.9 | -62.3 | -170.4 | -173.6 | 0 | 0 | 113.4 | F60 S63 L67 V110 L111 G112 S113 L117 V126 I128 | F60-M115 HydrophobicContact CE2-SD 3.99Å; F60-M115 HydrophobicContact CZ-SD 4.43Å; S63-M115 VanDerWaalsContact CB-C 3.43Å; S63-M115 WeakPolarHBondContact CB-O 3.48Å; S63-M115 PolarHBondContact OG-O 3.42Å; L67-M115 HydrophobicContact CD1-CE 4.41Å; L67-M115 HydrophobicContact CD1-CG 4.03Å; V110-M115 HydrophobicContact CB-CE 3.55Å; V110-M115 HydrophobicContact CG1-CE 3.54Å; V110-M115 HydrophobicContact CG1-CG 3.91Å; V110-M115 HydrophobicContact CG2-CE 4.46Å; L111-M115 PolarHBondContact O-N 2.9Å; G112-M115 CarbonylContact O-C 3.47Å; G112-M115 WeakPolarHBondContact O-CA 3.46Å; G112-M115 WeakPolarHBondContact O-CB 3.35Å; G112-M115 PolarHBondContact O-N 2.9Å; S113-M115 VanDerWaalsContact C-N 3.29Å; M115-L117 VanDerWaalsContact C-N 3.26Å; M115-L117 HydrophobicContact CB-CG 4.29Å; M115-L117 PolarHBondContact O-N 3.38Å; M115-V126 HydrophobicContact CE-CB 3.44Å; M115-V126 VanDerWaalsContact CE-CB 3.44Å; M115-V126 HydrophobicContact CE-CG1 3.64Å; M115-V126 HydrophobicContact CE-CG2 3.97Å; M115-V126 HydrophobicContact SD-CB 3.9Å; M115-V126 HydrophobicContact SD-CG1 4.06Å; M115-V126 HydrophobicContact SD-CG2 3.75Å; M115-I128 HydrophobicContact CE-CD1 3.78Å; M115-I128 HydrophobicContact CE-CG1 4.29Å |
| 116 | G | 75.7 | Confident | 81 | Confident | 48 Ų | 48 | 51 Ų | 51 | 50% | 0.495 | 32% | 0.316 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 74.6 | 12.5 | -178.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | G112 S113 Q114 | G112-G116 PolarHBondContact O-N 3.39Å; S113-G116 PolarHBondContact O-N 3.27Å; Q114-G116 PolarHBondContact O-N 3.5Å |
| 117 | L | 78.8 | Confident | 81.6 | Confident | 40 Ų | 40 | 51.6 Ų | 51.6 | 21% | 0.209 | 32% | 0.32 | C | S | . | . | trans | -72.2 | 140.9 | 173.7 | -54.2 | 179.3 | 0 | 0 | 0 | 110.2 | G112 M115 A122 I150 | G112-L117 VanDerWaalsContact O-CB 3.23Å; G112-L117 WeakPolarHBondContact O-CB 3.25Å; G112-L117 WeakPolarHBondContact O-CG 3.47Å; G112-L117 PolarHBondContact O-N 3.28Å; M115-L117 VanDerWaalsContact C-N 3.26Å; M115-L117 HydrophobicContact CB-CG 4.29Å; M115-L117 PolarHBondContact O-N 3.38Å; L117-A122 WeakPolarHBondContact O-CB 3Å; L117-I150 HydrophobicContact CD1-CG2 3.35Å | ||
| 118 | K | 80.6 | Confident | 81.9 | Confident | 188 Ų | 188 | 49.7 Ų | 49.7 | 82% | 0.817 | 31% | 0.311 | S | S | * | . | trans | -114.8 | 162.3 | -180 | -65.1 | -176.7 | 178.9 | 179.8 | 0 | 110.9 | ||||
| 119 | G | 82.9 | Confident | 81.9 | Confident | 65 Ų | 65 | 50.6 Ų | 50.6 | 67% | 0.67 | 32% | 0.316 | S | S | * | . | G | 310 helix | trans | 70.8 | -144.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | S121 A122 | G119-S121 PolarHBondContact O-N 2.86Å; G119-A122 VanDerWaalsContact O-CB 3.26Å; G119-A122 WeakPolarHBondContact O-CB 3.43Å; G119-A122 PolarHBondContact O-N 3.46Å |
| 120 | S | 81.5 | Confident | 81.6 | Confident | 111 Ų | 111 | 48.4 Ų | 48.4 | 78% | 0.776 | 30% | 0.303 | S | S | * | . | G | 310 helix | trans | -59.8 | -25.2 | -179.2 | 52.9 | 0 | 0 | 0 | 0 | 113.7 | A122 | S120-A122 VanDerWaalsContact C-N 3.33Š|
| 121 | S | 79.8 | Confident | 81.2 | Confident | 32 Ų | 32 | 51.2 Ų | 51.2 | 22% | 0.224 | 31% | 0.313 | C | S | . | . | G | 310 helix | trans | -77.8 | -16.3 | 178.3 | -54.8 | 0 | 0 | 0 | 0 | 113.3 | G119 G123 Q124 | G119-S121 PolarHBondContact O-N 2.86Å; S121-G123 VanDerWaalsContact C-N 3.32Å; S121-G123 PolarHBondContact O-N 2.92Å; S121-Q124 PolarHBondContact O-N 3.36Å |
| 122 | A | 80.7 | Confident | 80.5 | Confident | 23 Ų | 23 | 49.9 Ų | 49.9 | 19% | 0.19 | 31% | 0.307 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66.7 | -32.1 | -178.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | G112 S113 L117 G119 S120 Q124 | G112-A122 CarbonylContact C-O 3.59Å; S113-A122 PolarHBondContact N-O 3.39Å; L117-A122 WeakPolarHBondContact O-CB 3Å; G119-A122 VanDerWaalsContact O-CB 3.26Å; G119-A122 WeakPolarHBondContact O-CB 3.43Å; G119-A122 PolarHBondContact O-N 3.46Å; S120-A122 VanDerWaalsContact C-N 3.33Å; A122-Q124 VanDerWaalsContact C-N 3.35Å |
| 123 | G | 83.2 | Confident | 79.6 | Confident | 57 Ų | 57 | 51.8 Ų | 51.8 | 59% | 0.588 | 32% | 0.319 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.2 | 0.4 | 179.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | S121 | S121-G123 VanDerWaalsContact C-N 3.32Å; S121-G123 PolarHBondContact O-N 2.92Å |
| 124 | Q | 85.1 | Confident | 78.5 | Confident | 77 Ų | 77 | 53.1 Ų | 53.1 | 36% | 0.36 | 32% | 0.324 | S | S | . | . | trans | -85.8 | 147.3 | -176.4 | -65.1 | -71.4 | -21.2 | 0 | 0 | 111.2 | G112 S121 A122 I150 | G112-Q124 PolarHBondContact N-O 2.99Å; S121-Q124 PolarHBondContact O-N 3.36Å; A122-Q124 VanDerWaalsContact C-N 3.35Å; Q124-I150 HydrophobicContact CB-CD1 3.29Å; Q124-I150 HydrophobicContact CB-CG1 4.4Å; Q124-I150 HydrophobicContact CG-CD1 3.64Å | ||
| 125 | L | 84.4 | Confident | 77.4 | Confident | 87 Ų | 87 | 54.4 Ų | 54.4 | 46% | 0.455 | 33% | 0.33 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.9 | 139.3 | 177.7 | -68.2 | 166.8 | 0 | 0 | 0 | 110.6 | W80 L111 | W80-L125 HydrophobicContact CH2-CB 3.75Å; W80-L125 HydrophobicContact CZ3-CB 4.4Å; L111-L125 HydrophobicContact CD1-CD2 3.78Å; L111-L125 HydrophobicContact CD1-CG 4.35Å |
| 126 | V | 84.2 | Confident | 76.2 | Confident | 0 Ų | 0 | 66.9 Ų | 66.9 | 0% | 0 | 38% | 0.377 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.3 | 124.5 | 172.5 | -178.2 | 0 | 0 | 0 | 0 | 108.3 | V110 M115 I128 F144 A146 I150 L151 | V110-V126 PolarHBondContact N-O 3.46Å; V110-V126 PolarHBondContact O-N 2.86Å; M115-V126 HydrophobicContact CE-CB 3.44Å; M115-V126 VanDerWaalsContact CE-CB 3.44Å; M115-V126 HydrophobicContact CE-CG1 3.64Å; M115-V126 HydrophobicContact CE-CG2 3.97Å; M115-V126 HydrophobicContact SD-CB 3.9Å; M115-V126 HydrophobicContact SD-CG1 4.06Å; M115-V126 HydrophobicContact SD-CG2 3.75Å; V126-I128 HydrophobicContact CG1-CG1 4.5Å; V126-F144 HydrophobicContact CG1-CB 4.49Å; V126-F144 HydrophobicContact CG1-CD1 4.44Å; V126-A146 HydrophobicContact CB-CB 4.48Å; V126-A146 HydrophobicContact CG1-CB 4.3Å; V126-A146 HydrophobicContact CG2-CB 3.96Å; V126-I150 HydrophobicContact CG2-CG2 3.91Å; V126-L151 HydrophobicContact CG1-CD2 4.49Å |
| 127 | L | 85.1 | Confident | 75 | Confident | 21 Ų | 21 | 70.1 Ų | 70.1 | 11% | 0.11 | 39% | 0.388 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.3 | 125 | 174.6 | 176.7 | 67.4 | 0 | 0 | 0 | 108.5 | W80 T109 F144 S145 | W80-L127 HydrophobicContact CD2-CB 3.93Å; W80-L127 HydrophobicContact CD2-CD2 3.95Å; W80-L127 VanDerWaalsContact CE2-CB 3.43Å; W80-L127 HydrophobicContact CE3-CB 4.25Å; W80-L127 HydrophobicContact CE3-CD2 4.42Å; W80-L127 HydrophobicContact CG-CD2 3.99Å; W80-L127 HydrophobicContact CH2-CB 3.72Å; W80-L127 HydrophobicContact CZ2-CB 3.36Å; W80-L127 VanDerWaalsContact CZ2-N 3.3Å; W80-L127 HydrophobicContact CZ3-CB 4.15Å; T109-L127 HydrophobicContact CG2-CD1 3.81Å; L127-F144 WeakPolarHBondContact O-CA 3.39Å; L127-S145 PolarHBondContact N-O 3.39Å; L127-S145 PolarHBondContact O-N 2.85Å |
| 128 | I | 83.1 | Confident | 74 | Confident | 0 Ų | 0 | 71.8 Ų | 71.8 | 0% | 0 | 41% | 0.407 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.4 | 120.5 | 177.3 | -59.3 | 155.4 | 0 | 0 | 0 | 107 | F64 L69 Q107 A108 V110 M115 V126 L142 Y143 F144 | F64-I128 HydrophobicContact CE2-CD1 3.92Å; F64-I128 HydrophobicContact CE2-CG1 4.49Å; F64-I128 HydrophobicContact CE2-CG2 4.37Å; L69-I128 HydrophobicContact CD1-CG2 4.3Å; L69-I128 HydrophobicContact CD2-CD1 3.52Å; Q107-I128 VanDerWaalsContact CA-O 3.31Å; Q107-I128 WeakPolarHBondContact CA-O 3.36Å; A108-I128 PolarHBondContact N-O 2.75Å; A108-I128 PolarHBondContact O-N 3.4Å; V110-I128 HydrophobicContact CB-CD1 4.09Å; V110-I128 HydrophobicContact CG2-CD1 3.68Å; M115-I128 HydrophobicContact CE-CD1 3.78Å; M115-I128 HydrophobicContact CE-CG1 4.29Å; V126-I128 HydrophobicContact CG1-CG1 4.5Å; I128-L142 HydrophobicContact CG2-CD2 4.29Å; I128-Y143 CarbonylContact C-O 3.53Å; I128-Y143 WeakPolarHBondContact CA-O 3.01Å; I128-F144 HydrophobicContact CG1-CD1 3.87Å; I128-F144 HydrophobicContact CG1-CE1 3.98Å; I128-F144 HydrophobicContact CG2-CE1 4.3Å |
| 129 | T | 80 | Confident | 73.2 | Confident | 19 Ų | 19 | 63.4 Ų | 63.4 | 12% | 0.117 | 37% | 0.374 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118 | 110.6 | 176.9 | -58 | 0 | 0 | 0 | 0 | 108.7 | F106 Q107 L142 Y143 | F106-T129 CarbonylContact O-C 3.27Å; F106-T129 WeakPolarHBondContact O-CA 3.28Å; Q107-T129 HydrophobicContact CG-CG2 4.03Å; T129-L142 CarbonylContact O-C 3.47Å; T129-L142 WeakPolarHBondContact O-CA 3.37Å; T129-Y143 PolarHBondContact N-O 2.91Å; T129-Y143 PolarHBondContact O-N 3.34Å |
| 130 | A | 77.2 | Confident | 72.7 | Confident | 1 Ų | 1 | 60.3 Ų | 60.3 | 1% | 0.008 | 34% | 0.342 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.1 | 130.2 | 169.5 | 0 | 0 | 0 | 0 | 0 | 109.8 | F94 T105 F106 T140 C141 L142 | F94-A130 HydrophobicContact CD2-CB 4.21Å; F94-A130 HydrophobicContact CE2-CB 3.71Å; F94-A130 HydrophobicContact CZ-CB 3.94Å; T105-A130 CarbonylContact C-O 3.55Å; T105-A130 VanDerWaalsContact CA-O 3.3Å; T105-A130 WeakPolarHBondContact CA-O 3.41Å; F106-A130 HydrophobicContact CB-CB 4.11Å; F106-A130 HydrophobicContact CD1-CB 4.19Å; F106-A130 PolarHBondContact N-O 3.37Å; F106-A130 PolarHBondContact O-N 3.24Å; A130-T140 HydrophobicContact CB-CG2 4.02Å; A130-C141 CarbonylContact C-O 3.53Å; A130-C141 WeakPolarHBondContact CA-O 3.16Å; A130-L142 HydrophobicContact CB-CD2 3.47Å; A130-L142 VanDerWaalsContact CB-CD2 3.47Å |
| 131 | R | 74.7 | Confident | 72.5 | Confident | 66 Ų | 66 | 55.5 Ų | 55.5 | 25% | 0.249 | 31% | 0.308 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.9 | 115.4 | 175 | -174.4 | 174.3 | 179.3 | 167.7 | -4.3 | 109 | T105 C141 Y143 G164 | T105-R131 HydrophobicContact CG2-CG 4.3Å; R131-C141 PolarHBondContact N-O 2.93Å; R131-C141 PolarHBondContact O-N 2.86Å; R131-Y143 HydrophobicContact CB-CE2 4.17Å; R131-G164 VanDerWaalsContact NH1-CA 3.33Å; R131-G164 PolarHBondContact NH1-O 3.39Å |
| 132 | V | 71.1 | Confident | 72.5 | Confident | 32 Ų | 32 | 54 Ų | 54 | 19% | 0.194 | 30% | 0.298 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.8 | 117.7 | 174.5 | -173 | 0 | 0 | 0 | 0 | 107.7 | F94 R104 T140 | F94-V132 HydrophobicContact CB-CG2 4.31Å; F94-V132 HydrophobicContact CD2-CG2 4.44Å; R104-V132 HydrophobicContact CB-CG2 4.4Å; R104-V132 PolarHBondContact O-N 2.93Å; V132-T140 HydrophobicContact CG2-CG2 4.29Å |
| 133 | T | 63.9 | Low | 72.5 | Confident | 41 Ų | 41 | 53.9 Ų | 53.9 | 25% | 0.252 | 29% | 0.293 | S | S | . | . | trans | -87.7 | 139.5 | 173.8 | 61.5 | 0 | 0 | 0 | 0 | 109.4 | E135 G139 | T133-E135 PolarHBondContact O-N 3.42Å; T133-G139 PolarHBondContact N-O 2.97Å; T133-G139 PolarHBondContact OG1-O 3.25Å | ||
| 134 | T | 59.4 | Low | 72.6 | Confident | 89 Ų | 89 | 51.2 Ų | 51.2 | 55% | 0.546 | 27% | 0.265 | S | S | . | . | trans | -84.8 | 18.4 | 177.2 | 53.9 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 135 | E | 57.3 | Low | 72.6 | Confident | 142 Ų | 142 | 48 Ų | 48 | 66% | 0.664 | 25% | 0.251 | S | S | * | . | S | Bend | trans | -75 | 157.3 | -178.8 | -71.3 | -171.5 | 165.3 | 0 | 0 | 111.2 | T133 T137 | T133-E135 PolarHBondContact O-N 3.42Å; E135-T137 CarbonylContact O-C 3.48Å; E135-T137 VanDerWaalsContact O-C 3.27Å; E135-T137 PolarHBondContact O-N 2.93Å |
| 136 | R | 51.2 | Low | 72.5 | Confident | 266 Ų | 266 | 43.9 Ų | 43.9 | 100% | 1.004 | 23% | 0.23 | S | C | * | . | S | Bend | trans | -52 | -22.2 | -171.1 | -79.1 | -178.6 | -179.5 | 166.3 | 1.1 | 114.6 | ||
| 137 | T | 51.3 | Low | 72.5 | Confident | 115 Ų | 115 | 46.5 Ų | 46.5 | 71% | 0.706 | 25% | 0.245 | S | C | * | . | S | Bend | trans | -105.3 | 105.4 | 167.8 | 40.4 | 0 | 0 | 0 | 0 | 108.4 | E135 G139 | E135-T137 CarbonylContact O-C 3.48Å; E135-T137 VanDerWaalsContact O-C 3.27Å; E135-T137 PolarHBondContact O-N 2.93Å; T137-G139 PolarHBondContact O-N 3.42Å |
| 138 | A | 56.7 | Low | 72.1 | Confident | 75 Ų | 75 | 49 Ų | 49 | 62% | 0.62 | 26% | 0.263 | S | S | * | . | trans | -65.5 | 77.8 | -178.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 139 | G | 64.4 | Low | 71.7 | Confident | 12 Ų | 12 | 52 Ų | 52 | 12% | 0.124 | 29% | 0.294 | C | S | . | . | P | Polyproline II helix | trans | -100.8 | 141.9 | 173.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | T133 T137 | T133-G139 PolarHBondContact N-O 2.97Å; T133-G139 PolarHBondContact OG1-O 3.25Å; T137-G139 PolarHBondContact O-N 3.42Å |
| 140 | T | 71.7 | Confident | 71.7 | Confident | 1 Ų | 1 | 51.8 Ų | 51.8 | 1% | 0.006 | 29% | 0.292 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.8 | 129.2 | 168.6 | -64.7 | 0 | 0 | 0 | 0 | 109.3 | T90 L92 F94 A130 V132 | T90-T140 HydrophobicContact CG2-CG2 4.41Å; T90-T140 VanDerWaalsContact CG2-O 3.25Å; T90-T140 WeakPolarHBondContact CG2-O 3.46Å; T90-T140 PolarHBondContact N-O 3.26Å; T90-T140 PolarHBondContact O-N 3.42Å; T90-T140 VanDerWaalsContact O-O 3.13Å; L92-T140 WeakPolarHBondContact O-CB 3.25Å; L92-T140 PolarHBondContact O-OG1 2.85Å; F94-T140 HydrophobicContact CD2-CG2 3.8Å; F94-T140 HydrophobicContact CE2-CG2 3.67Å; A130-T140 HydrophobicContact CB-CG2 4.02Å; V132-T140 HydrophobicContact CG2-CG2 4.29Å |
| 141 | C | 77.3 | Confident | 71.8 | Confident | 9 Ų | 9 | 52 Ų | 52 | 6% | 0.061 | 29% | 0.293 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.7 | 117.6 | 174.1 | -92.9 | 0 | 0 | 0 | 0 | 110.6 | A130 R131 Y143 C160 | A130-C141 CarbonylContact C-O 3.53Å; A130-C141 WeakPolarHBondContact CA-O 3.16Å; R131-C141 PolarHBondContact N-O 2.93Å; R131-C141 PolarHBondContact O-N 2.86Å; C141-Y143 HydrophobicContact CB-CD2 4.46Å; C141-Y143 HydrophobicContact CB-CE2 3.67Å; C141-C160 WeakPolarHBondContact CA-SG 3.43Å; C141-C160 HydrophobicContact CB-CB 4.02Å; C141-C160 WeakPolarHBondContact CB-SG 3.48Å; C141-C160 WeakPolarHBondContact SG-CB 3.45Å; C141-C160 CovalentContact SG-SG 2.04Å; C141-C160 PolarHBondContact SG-SG 2.85Å |
| 142 | L | 80.9 | Confident | 71.8 | Confident | 1 Ų | 1 | 49.5 Ų | 49.5 | 1% | 0.005 | 29% | 0.285 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.4 | 119.9 | 171.5 | -69.3 | 174.1 | 0 | 0 | 0 | 109.9 | F64 G87 L88 T90 L92 F94 I128 T129 A130 F144 | F64-L142 HydrophobicContact CE1-CD1 3.76Å; F64-L142 HydrophobicContact CZ-CD1 3.82Å; G87-L142 CarbonylContact C-O 3.57Å; G87-L142 WeakPolarHBondContact CA-O 3.35Å; L88-L142 HydrophobicContact CB-CB 4.31Å; L88-L142 PolarHBondContact N-O 3.11Å; L88-L142 PolarHBondContact O-N 2.81Å; T90-L142 HydrophobicContact CG2-CD1 3.64Å; T90-L142 HydrophobicContact CG2-CG 3.69Å; L92-L142 HydrophobicContact CD1-CD1 4.03Å; F94-L142 HydrophobicContact CZ-CD2 4.43Å; I128-L142 HydrophobicContact CG2-CD2 4.29Å; T129-L142 CarbonylContact O-C 3.47Å; T129-L142 WeakPolarHBondContact O-CA 3.37Å; A130-L142 HydrophobicContact CB-CD2 3.47Å; A130-L142 VanDerWaalsContact CB-CD2 3.47Å; L142-F144 HydrophobicContact CB-CE2 3.88Å; L142-F144 HydrophobicContact CB-CZ 4.21Å; L142-F144 HydrophobicContact CD1-CZ 4.28Å |
| 143 | Y | 81.3 | Confident | 71.7 | Confident | 21 Ų | 21 | 53.1 Ų | 53.1 | 8% | 0.082 | 31% | 0.312 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.8 | 124.5 | 173 | -59.8 | -90.4 | 0 | 0 | 0 | 109.4 | V85 V86 I128 T129 R131 C141 C160 S161 A165 | V85-Y143 HydrophobicContact CG1-CD1 4.17Å; V86-Y143 CarbonylContact O-C 3.52Å; V86-Y143 WeakPolarHBondContact O-CA 3.41Å; I128-Y143 CarbonylContact C-O 3.53Å; I128-Y143 WeakPolarHBondContact CA-O 3.01Å; T129-Y143 PolarHBondContact N-O 2.91Å; T129-Y143 PolarHBondContact O-N 3.34Å; R131-Y143 HydrophobicContact CB-CE2 4.17Å; C141-Y143 HydrophobicContact CB-CD2 4.46Å; C141-Y143 HydrophobicContact CB-CE2 3.67Å; Y143-C160 HydrophobicContact CE1-CB 3.99Å; Y143-S161 PolarHBondContact OH-O 3.38Å; Y143-A165 HydrophobicContact CD1-CB 4.42Å; Y143-A165 HydrophobicContact CE1-CB 4.39Å |
| 144 | F | 84.1 | Confident | 71.9 | Confident | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 31% | 0.313 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.2 | 119.4 | 173.6 | -59.8 | -89.4 | 0 | 0 | 0 | 108.3 | F60 F64 V85 V86 L88 V126 L127 I128 L142 L151 | F60-F144 HydrophobicContact CE1-CD1 4.19Å; F60-F144 HydrophobicContact CE1-CE1 4.05Å; F60-F144 HydrophobicContact CE1-CE2 4.39Å; F60-F144 HydrophobicContact CE1-CG 4.41Å; F60-F144 HydrophobicContact CE1-CZ 4.16Å; F60-F144 AromaticContact CZ-CD1 3.75Å; F60-F144 HydrophobicContact CZ-CD1 3.75Å; F60-F144 AromaticContact CZ-CE1 3.94Å; F60-F144 HydrophobicContact CZ-CE1 3.94Å; F60-F144 HydrophobicContact CZ-CG 4.13Å; F60-F144 HydrophobicContact CZ-CZ 4.49Å; F64-F144 HydrophobicContact CD1-CZ 4.43Å; F64-F144 AromaticContact CD2-CE1 3.68Å; F64-F144 HydrophobicContact CD2-CE1 3.68Å; F64-F144 HydrophobicContact CD2-CZ 4.08Å; F64-F144 HydrophobicContact CE1-CZ 4.18Å; F64-F144 AromaticContact CE2-CE1 3.51Å; F64-F144 HydrophobicContact CE2-CE1 3.51Å; F64-F144 AromaticContact CE2-CZ 3.83Å; F64-F144 HydrophobicContact CE2-CZ 3.83Å; F64-F144 HydrophobicContact CG-CE1 4.36Å; F64-F144 HydrophobicContact CG-CZ 4.38Å; F64-F144 HydrophobicContact CZ-CE1 4.05Å; F64-F144 AromaticContact CZ-CZ 3.88Å; F64-F144 HydrophobicContact CZ-CZ 3.88Å; V85-F144 CarbonylContact C-O 3.54Å; V85-F144 VanDerWaalsContact CA-O 3.29Å; V85-F144 WeakPolarHBondContact CA-O 3.03Å; V86-F144 PolarHBondContact N-O 3.05Å; V86-F144 PolarHBondContact O-N 2.87Å; L88-F144 HydrophobicContact CB-CE2 3.99Å; L88-F144 HydrophobicContact CD2-CE2 4.11Å; V126-F144 HydrophobicContact CG1-CB 4.49Å; V126-F144 HydrophobicContact CG1-CD1 4.44Å; L127-F144 WeakPolarHBondContact O-CA 3.39Å; I128-F144 HydrophobicContact CG1-CD1 3.87Å; I128-F144 HydrophobicContact CG1-CE1 3.98Å; I128-F144 HydrophobicContact CG2-CE1 4.3Å; L142-F144 HydrophobicContact CB-CE2 3.88Å; L142-F144 HydrophobicContact CB-CZ 4.21Å; L142-F144 HydrophobicContact CD1-CZ 4.28Å; F144-L151 HydrophobicContact CB-CD1 4.05Å; F144-L151 HydrophobicContact CB-CD2 3.86Å; F144-L151 WeakPolarHBondContact O-CD1 3.45Å |
| 145 | S | 84.5 | Confident | 72.3 | Confident | 11 Ų | 11 | 56.2 Ų | 56.2 | 8% | 0.077 | 32% | 0.322 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.3 | 124.3 | 175.9 | -177.2 | 0 | 0 | 0 | 0 | 110.2 | W80 G82 H84 L127 | W80-S145 VanDerWaalsContact CZ2-O 3.28Å; W80-S145 WeakPolarHBondContact CZ2-O 3.38Å; W80-S145 PolarHBondContact NE1-O 3.21Å; W80-S145 PolarHBondContact NE1-OG 3.48Å; G82-S145 PolarHBondContact O-OG 2.89Å; G82-S145 VanDerWaalsContact O-OG 3.05Å; H84-S145 WeakPolarHBondContact O-CA 3.26Å; L127-S145 PolarHBondContact N-O 3.39Å; L127-S145 PolarHBondContact O-N 2.85Å |
| 146 | A | 83.9 | Confident | 72.9 | Confident | 0 Ų | 0 | 50.5 Ų | 50.5 | 0% | 0 | 30% | 0.297 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -148.5 | 172.4 | -178.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | G82 H84 V126 I150 L151 | G82-A146 CarbonylContact C-O 3.56Å; G82-A146 VanDerWaalsContact CA-C 3.45Å; G82-A146 WeakPolarHBondContact CA-O 3.42Å; H84-A146 PolarHBondContact N-O 3.37Å; H84-A146 PolarHBondContact O-N 3.43Å; V126-A146 HydrophobicContact CB-CB 4.48Å; V126-A146 HydrophobicContact CG1-CB 4.3Å; V126-A146 HydrophobicContact CG2-CB 3.96Å; A146-I150 HydrophobicContact CB-CB 4.03Å; A146-I150 HydrophobicContact CB-CD1 4.17Å; A146-I150 HydrophobicContact CB-CG2 3.98Å; A146-L151 HydrophobicContact CB-CD1 3.81Å; A146-L151 HydrophobicContact CB-CD2 4.5Å; A146-L151 HydrophobicContact CB-CG 3.82Å |
| 147 | V | 82.7 | Confident | 73.5 | Confident | 54 Ų | 54 | 38.7 Ų | 38.7 | 33% | 0.327 | 25% | 0.254 | S | S | . | . | S | Bend | trans | -62.9 | 143.4 | 168.6 | -175.8 | 0 | 0 | 0 | 0 | 109.1 | I150 | V147-I150 HydrophobicContact CB-CD1 3.69Å; V147-I150 HydrophobicContact CB-CG1 4.43Å; V147-I150 HydrophobicContact CG2-CD1 4.29Å; V147-I150 WeakPolarHBondContact O-CB 3.44Å; V147-I150 WeakPolarHBondContact O-CG1 3.17Å; V147-I150 PolarHBondContact O-N 2.87Å |
| 148 | P | 77.7 | Confident | 74.4 | Confident | 73 Ų | 73 | 36 Ų | 36 | 47% | 0.474 | 24% | 0.235 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -52.1 | 141.8 | 176.2 | -27.8 | 35.4 | 0 | 0 | 0 | 112.7 | S83 H84 | S83-P148 WeakPolarHBondContact OG-CD 3.42Å; S83-P148 WeakPolarHBondContact OG-CG 3.27Å; H84-P148 HydrophobicContact CB-CG 4.46Å |
| 149 | G | 74.4 | Confident | 75.1 | Confident | 64 Ų | 64 | 35.2 Ų | 35.2 | 66% | 0.66 | 23% | 0.225 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 87.1 | -3.6 | -179.5 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||
| 150 | I | 80 | Confident | 75.5 | Confident | 14 Ų | 14 | 35.5 Ų | 35.5 | 7% | 0.072 | 23% | 0.225 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -89.8 | -44.2 | 173.9 | -63 | 176.9 | 0 | 0 | 0 | 111 | L117 Q124 V126 A146 V147 | L117-I150 HydrophobicContact CD1-CG2 3.35Å; Q124-I150 HydrophobicContact CB-CD1 3.29Å; Q124-I150 HydrophobicContact CB-CG1 4.4Å; Q124-I150 HydrophobicContact CG-CD1 3.64Å; V126-I150 HydrophobicContact CG2-CG2 3.91Å; A146-I150 HydrophobicContact CB-CB 4.03Å; A146-I150 HydrophobicContact CB-CD1 4.17Å; A146-I150 HydrophobicContact CB-CG2 3.98Å; V147-I150 HydrophobicContact CB-CD1 3.69Å; V147-I150 HydrophobicContact CB-CG1 4.43Å; V147-I150 HydrophobicContact CG2-CD1 4.29Å; V147-I150 WeakPolarHBondContact O-CB 3.44Å; V147-I150 WeakPolarHBondContact O-CG1 3.17Å; V147-I150 PolarHBondContact O-N 2.87Å |
| 151 | L | 78.9 | Confident | 75.2 | Confident | 6 Ų | 6 | 39.5 Ų | 39.5 | 3% | 0.031 | 25% | 0.253 | C | S | . | . | S | Bend | trans | -86.3 | 150.1 | 179.1 | -65 | 169.7 | 0 | 0 | 0 | 109.8 | F60 V86 V126 F144 A146 S153 | F60-L151 HydrophobicContact CE2-CD2 3.7Å; F60-L151 HydrophobicContact CZ-CD2 3.75Å; V86-L151 HydrophobicContact CG2-CB 4.33Å; V86-L151 HydrophobicContact CG2-CD1 4.12Å; V126-L151 HydrophobicContact CG1-CD2 4.49Å; F144-L151 HydrophobicContact CB-CD1 4.05Å; F144-L151 HydrophobicContact CB-CD2 3.86Å; F144-L151 WeakPolarHBondContact O-CD1 3.45Å; A146-L151 HydrophobicContact CB-CD1 3.81Å; A146-L151 HydrophobicContact CB-CD2 4.5Å; A146-L151 HydrophobicContact CB-CG 3.82Å; L151-S153 PolarHBondContact O-N 2.96Å |
| 152 | P | 75 | Confident | 74.1 | Confident | 13 Ų | 13 | 47.8 Ų | 47.8 | 8% | 0.084 | 29% | 0.291 | C | S | . | . | trans | -53.5 | 128.4 | 172.2 | -23.6 | 33.3 | 0 | 0 | 0 | 110.4 | D56 W57 F60 S154 | D56-P152 HydrophobicContact CB-CB 4.27Å; D56-P152 HydrophobicContact CB-CG 4.46Å; W57-P152 HydrophobicContact CD2-CB 3.98Å; W57-P152 HydrophobicContact CD2-CG 3.86Å; W57-P152 HydrophobicContact CE3-CG 4.02Å; W57-P152 HydrophobicContact CG-CB 4.29Å; W57-P152 HydrophobicContact CG-CG 4.36Å; W57-P152 HydrophobicContact CH2-CB 4.5Å; W57-P152 HydrophobicContact CH2-CG 4.25Å; W57-P152 HydrophobicContact CZ2-CB 3.91Å; W57-P152 HydrophobicContact CZ2-CG 4.14Å; W57-P152 HydrophobicContact CZ3-CG 4.22Å; F60-P152 HydrophobicContact CB-CG 4.13Å; F60-P152 HydrophobicContact CG-CG 4.27Å; P152-S154 VanDerWaalsContact C-N 3.26Å | ||
| 153 | S | 69.3 | Low | 72.7 | Confident | 108 Ų | 108 | 56.4 Ų | 56.4 | 76% | 0.755 | 33% | 0.331 | S | S | * | . | S | Bend | trans | -76.7 | -16.7 | 178.8 | -52.7 | 0 | 0 | 0 | 0 | 112.7 | L151 | L151-S153 PolarHBondContact O-N 2.96Š|
| 154 | S | 68.3 | Low | 71 | Confident | 38 Ų | 38 | 55.9 Ų | 55.9 | 27% | 0.266 | 33% | 0.332 | S | S | . | . | S | Bend | trans | -71 | 146.9 | 174.9 | 50.7 | 0 | 0 | 0 | 0 | 112.1 | P54 W57 P152 | P54-S154 VanDerWaalsContact CG-OG 3.25Å; P54-S154 WeakPolarHBondContact CG-OG 3.36Å; W57-S154 PolarHBondContact NE1-O 2.85Å; W57-S154 PolarHBondContact NE1-OG 3.34Å; W57-S154 VanDerWaalsContact NE1-OG 3.09Å; P152-S154 VanDerWaalsContact C-N 3.26Å |
| 155 | Q | 68.5 | Low | 69.2 | Low | 158 Ų | 158 | 58.5 Ų | 58.5 | 74% | 0.738 | 35% | 0.354 | S | S | * | . | P | Polyproline II helix | trans | -52.3 | 133.7 | 176.8 | -166.5 | 172.3 | 20.2 | 0 | 0 | 111.2 | W57 | W57-Q155 PolarHBondContact NE1-O 3.07Š|
| 156 | P | 68.3 | Low | 67.1 | Low | 21 Ų | 21 | 61.1 Ų | 61.1 | 14% | 0.136 | 38% | 0.382 | C | S | . | . | P | Polyproline II helix | trans | -64.7 | 153 | 179 | 27.2 | -35.3 | 0 | 0 | 0 | 111.1 | W57 V86 G87 L88 I158 S159 | W57-P156 HydrophobicContact CH2-CB 3.99Å; W57-P156 HydrophobicContact CZ2-CB 3.69Å; V86-P156 HydrophobicContact CG1-CB 3.68Å; V86-P156 HydrophobicContact CG1-CG 3.56Å; G87-P156 WeakPolarHBondContact O-CG 3.37Å; L88-P156 HydrophobicContact CD1-CB 3.84Å; P156-I158 VanDerWaalsContact C-N 3.28Å; P156-I158 PolarHBondContact O-N 3.19Å; P156-S159 WeakPolarHBondContact CG-OG 3.21Å |
| 157 | P | 64.4 | Low | 64.8 | Low | 18 Ų | 18 | 68.1 Ų | 68.1 | 12% | 0.117 | 42% | 0.42 | C | S | . | . | S | Bend | trans | -63.5 | -32.8 | -175.2 | -21.2 | 32.2 | 0 | 0 | 0 | 113.6 | W57 L189 K191 | W57-P157 HydrophobicContact CG-CG 4.46Å; P157-L189 HydrophobicContact CB-CB 3.85Å; P157-L189 HydrophobicContact CB-CD2 3.9Å; P157-L189 HydrophobicContact CG-CB 3.71Å; P157-L189 HydrophobicContact CG-CD2 3.87Å; P157-K191 HydrophobicContact CB-CB 4.3Å |
| 158 | I | 70.3 | Confident | 62.6 | Low | 58 Ų | 58 | 67.1 Ų | 67.1 | 30% | 0.297 | 42% | 0.417 | S | S | . | . | S | Bend | trans | -138.4 | 100.9 | 173.7 | -46.8 | 173.6 | 0 | 0 | 0 | 108.6 | L88 L89 P156 | L88-I158 WeakPolarHBondContact CA-O 3.23Å; L89-I158 HydrophobicContact CB-CB 4.14Å; L89-I158 HydrophobicContact CB-CG2 3.56Å; L89-I158 HydrophobicContact CD2-CG2 3.92Å; L89-I158 HydrophobicContact CG-CG2 4.36Å; L89-I158 PolarHBondContact N-O 2.91Å; P156-I158 VanDerWaalsContact C-N 3.28Å; P156-I158 PolarHBondContact O-N 3.19Å |
| 159 | S | 70.9 | Confident | 60.5 | Low | 59 Ų | 59 | 69.7 Ų | 69.7 | 41% | 0.413 | 43% | 0.432 | S | S | . | . | P | Polyproline II helix | trans | -74.5 | 145 | -179.1 | -56.2 | 0 | 0 | 0 | 0 | 112.4 | G87 P156 | G87-S159 WeakPolarHBondContact O-CA 3.28Å; P156-S159 WeakPolarHBondContact CG-OG 3.21Å |
| 160 | C | 73.6 | Confident | 58.7 | Low | 18 Ų | 18 | 70.6 Ų | 70.6 | 12% | 0.122 | 42% | 0.421 | C | S | . | . | P | Polyproline II helix | trans | -82.3 | 152.3 | 162.1 | -68.8 | 0 | 0 | 0 | 0 | 110.7 | G87 L88 C141 Y143 | G87-C160 PolarHBondContact O-N 3.31Å; L88-C160 VanDerWaalsContact C-SG 3.53Å; C141-C160 WeakPolarHBondContact CA-SG 3.43Å; C141-C160 HydrophobicContact CB-CB 4.02Å; C141-C160 WeakPolarHBondContact CB-SG 3.48Å; C141-C160 WeakPolarHBondContact SG-CB 3.45Å; C141-C160 CovalentContact SG-SG 2.04Å; C141-C160 PolarHBondContact SG-SG 2.85Å; Y143-C160 HydrophobicContact CE1-CB 3.99Å |
| 161 | S | 65.4 | Low | 56.6 | Low | 86 Ų | 86 | 73.6 Ų | 73.6 | 60% | 0.601 | 44% | 0.443 | S | S | * | . | P | Polyproline II helix | trans | -62.5 | 134.4 | 168.7 | -174.7 | 0 | 0 | 0 | 0 | 110 | Y143 E163 | Y143-S161 PolarHBondContact OH-O 3.38Å; S161-E163 PolarHBondContact O-N 3.17Å; S161-E163 VanDerWaalsContact O-N 3.07Å |
| 162 | E | 54.4 | Low | 54.6 | Low | 182 Ų | 182 | 78.9 Ų | 78.9 | 85% | 0.85 | 48% | 0.478 | S | S | * | . | G | 310 helix | trans | -62.2 | -15.3 | -175.1 | -78 | -159.7 | 149.1 | 0 | 0 | 114.3 | G164 A165 | E162-G164 PolarHBondContact O-N 3.46Å; E162-A165 PolarHBondContact O-N 2.94Å |
| 163 | E | 51.1 | Low | 53.1 | Low | 183 Ų | 183 | 89.3 Ų | 89.3 | 86% | 0.855 | 52% | 0.516 | S | S | * | . | G | 310 helix | trans | -61.4 | -8.1 | -176.6 | -132.2 | 131.5 | -157.9 | 0 | 0 | 114.2 | S161 | S161-E163 PolarHBondContact O-N 3.17Å; S161-E163 VanDerWaalsContact O-N 3.07Å |
| 164 | G | 46.2 | Very low | 52.1 | Low | 9 Ų | 9 | 87.5 Ų | 87.5 | 9% | 0.093 | 50% | 0.496 | C | S | . | . | G | 310 helix | trans | -100.3 | -13.4 | -177.4 | 0 | 0 | 0 | 0 | 0 | 117.4 | R131 E162 | R131-G164 VanDerWaalsContact NH1-CA 3.33Å; R131-G164 PolarHBondContact NH1-O 3.39Å; E162-G164 PolarHBondContact O-N 3.46Å |
| 165 | A | 45 | Very low | 51.2 | Low | 55 Ų | 55 | 88.4 Ų | 88.4 | 46% | 0.455 | 51% | 0.511 | S | S | . | . | S | Bend | trans | -82.6 | -24 | -165 | 0 | 0 | 0 | 0 | 0 | 114.9 | V85 Y143 E162 | V85-A165 HydrophobicContact CG1-CB 4.41Å; Y143-A165 HydrophobicContact CD1-CB 4.42Å; Y143-A165 HydrophobicContact CE1-CB 4.39Å; E162-A165 PolarHBondContact O-N 2.94Å |
| 166 | G | 40.2 | Very low | 50.6 | Low | 66 Ų | 66 | 89.1 Ų | 89.1 | 68% | 0.68 | 52% | 0.515 | S | S | * | . | S | Bend | trans | -91.3 | -24.9 | -168.4 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||
| 167 | N | 37.2 | Very low | 50.2 | Low | 147 Ų | 147 | 96 Ų | 96 | 79% | 0.786 | 55% | 0.545 | S | S | * | . | trans | -134.2 | 39.9 | -162.9 | -66.3 | -22.4 | 0 | 0 | 0 | 113.8 | T169 | N167-T169 PolarHBondContact O-N 3.35Š| ||
| 168 | A | 36.3 | Very low | 50.4 | Low | 33 Ų | 33 | 98.1 Ų | 98.1 | 27% | 0.273 | 56% | 0.56 | S | S | . | * | trans | -78.9 | 89.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | T105 L170 | T105-A168 HydrophobicContact CG2-CB 4.34Å; A168-L170 PolarHBondContact O-N 3.39Å | ||
| 169 | T | 32 | Very low | 50.1 | Low | 127 Ų | 127 | 98 Ų | 98 | 78% | 0.779 | 56% | 0.562 | S | S | * | * | trans | -57.7 | 121.7 | 167.5 | -37.4 | 0 | 0 | 0 | 0 | 108.8 | N167 S171 | N167-T169 PolarHBondContact O-N 3.35Å; T169-S171 PolarHBondContact O-N 3.05Å; T169-S171 VanDerWaalsContact O-N 3.17Å | ||
| 170 | L | 38.1 | Very low | 49.7 | Very low | 84 Ų | 84 | 98.3 Ų | 98.3 | 44% | 0.44 | 56% | 0.564 | S | S | . | * | trans | -58.3 | 113.8 | -179.5 | -72 | 146.5 | 0 | 0 | 0 | 109.4 | Q107 A168 P172 | Q107-L170 VanDerWaalsContact OE1-CD2 3.27Å; A168-L170 PolarHBondContact O-N 3.39Å; L170-P172 WeakPolarHBondContact O-CD 3.34Å | ||
| 171 | S | 34.3 | Very low | 49.2 | Very low | 76 Ų | 76 | 97.7 Ų | 97.7 | 53% | 0.531 | 56% | 0.56 | S | S | . | * | trans | -88.6 | 112.5 | 167.3 | -166.9 | 0 | 0 | 0 | 0 | 108.5 | T169 R173 | T169-S171 PolarHBondContact O-N 3.05Å; T169-S171 VanDerWaalsContact O-N 3.17Å; S171-R173 VanDerWaalsContact C-N 3.31Å; S171-R173 PolarHBondContact O-N 3.43Å; S171-R173 VanDerWaalsContact O-N 3.08Å | ||
| 172 | P | 38.2 | Very low | 48.5 | Very low | 118 Ų | 118 | 101.7 Ų | 101.7 | 77% | 0.766 | 56% | 0.562 | S | S | * | * | trans | -88.4 | 72.6 | -176.7 | 35.3 | -29.2 | 0 | 0 | 0 | 108.2 | L170 | L170-P172 WeakPolarHBondContact O-CD 3.34Š| ||
| 173 | R | 43.4 | Very low | 48.3 | Very low | 231 Ų | 231 | 95 Ų | 95 | 87% | 0.872 | 54% | 0.535 | S | S | * | . | trans | -167.1 | 69.2 | 172.2 | -110 | 168 | -162.9 | -145.5 | 6 | 111.5 | S171 | S171-R173 VanDerWaalsContact C-N 3.31Å; S171-R173 PolarHBondContact O-N 3.43Å; S171-R173 VanDerWaalsContact O-N 3.08Å | ||
| 174 | M | 48.1 | Very low | 47.7 | Very low | 70 Ų | 70 | 94.5 Ų | 94.5 | 35% | 0.345 | 53% | 0.532 | S | S | . | . | trans | -121.3 | 134.1 | 151.6 | -106.7 | 92.2 | 173.2 | 0 | 0 | 106.5 | R104 | R104-M174 HydrophobicContact CB-CE 4.16Å; R104-M174 HydrophobicContact CG-CE 4.49Å | ||
| 175 | G | 49.9 | Very low | 47.7 | Very low | 57 Ų | 57 | 102 Ų | 102 | 59% | 0.588 | 57% | 0.565 | S | S | * | * | trans | -57.7 | 164.2 | -175.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | P71 E177 | P71-G175 WeakPolarHBondContact CG-O 3.21Å; G175-E177 PolarHBondContact O-N 2.97Å | ||
| 176 | E | 54.7 | Low | 47.6 | Very low | 174 Ų | 174 | 101.2 Ų | 101.2 | 81% | 0.813 | 56% | 0.562 | S | S | * | * | S | Bend | trans | -62.1 | 10 | -177.5 | -61.4 | -178.2 | 151 | 0 | 0 | 114.8 | ||
| 177 | E | 61.7 | Low | 47.9 | Very low | 164 Ų | 164 | 99.3 Ų | 99.3 | 77% | 0.766 | 54% | 0.536 | S | S | * | . | P | Polyproline II helix | trans | -88.2 | 123.7 | -175.2 | -65.8 | -178.8 | 176.3 | 0 | 0 | 110.9 | G175 | G175-E177 PolarHBondContact O-N 2.97Š|
| 178 | C | 67.4 | Low | 48.2 | Very low | 63 Ų | 63 | 96.1 Ų | 96.1 | 43% | 0.426 | 52% | 0.522 | S | S | . | . | P | Polyproline II helix | trans | -72.3 | 134.6 | 171.4 | -54.6 | 0 | 0 | 0 | 0 | 110.2 | T68 L69 C70 | T68-C178 HydrophobicContact CG2-CB 3.49Å; T68-C178 VanDerWaalsContact CG2-CB 3.49Å; L69-C178 CarbonylContact O-C 3.55Å; L69-C178 WeakPolarHBondContact O-CA 3.47Å; C70-C178 HydrophobicContact CB-CB 4Å; C70-C178 WeakPolarHBondContact CB-SG 2.94Å; C70-C178 WeakPolarHBondContact SG-CB 3.25Å; C70-C178 CovalentContact SG-SG 2.04Å; C70-C178 PolarHBondContact SG-SG 2.96Å |
| 179 | V | 64.2 | Low | 48.5 | Very low | 56 Ų | 56 | 95.4 Ų | 95.4 | 34% | 0.339 | 51% | 0.514 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.4 | 117.5 | 179.9 | -177.8 | 0 | 0 | 0 | 0 | 109.2 | L69 F94 V181 | L69-V179 PolarHBondContact N-O 3.31Å; L69-V179 PolarHBondContact O-N 3.28Å; F94-V179 HydrophobicContact CD1-CG1 4.47Å; F94-V179 HydrophobicContact CE1-CG1 4.18Å; V179-V181 PolarHBondContact O-N 2.94Å |
| 180 | S | 63.3 | Low | 48.9 | Very low | 65 Ų | 65 | 90.9 Ų | 90.9 | 46% | 0.455 | 49% | 0.486 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.9 | 127.6 | 169.2 | 57.1 | 0 | 0 | 0 | 0 | 109.6 | W182 | S180-W182 PolarHBondContact O-N 3.36Å |
| 181 | V | 61.8 | Low | 49 | Very low | 6 Ų | 6 | 91.7 Ų | 91.7 | 4% | 0.036 | 49% | 0.486 | C | S | . | . | trans | -81.8 | 108 | 172.4 | -179.3 | 0 | 0 | 0 | 0 | 107.7 | F64 L67 L69 L92 V179 L187 | F64-V181 HydrophobicContact CD1-CG1 4.03Å; F64-V181 HydrophobicContact CE1-CB 4.45Å; F64-V181 HydrophobicContact CE1-CG1 3.62Å; F64-V181 HydrophobicContact CE1-CG2 4.23Å; F64-V181 HydrophobicContact CZ-CG1 4.26Å; F64-V181 HydrophobicContact CZ-CG2 4.03Å; L67-V181 PolarHBondContact O-N 3.29Å; L69-V181 HydrophobicContact CD1-CG2 3.54Å; L69-V181 HydrophobicContact CG-CG2 3.74Å; L92-V181 HydrophobicContact CD1-CG1 4.13Å; V179-V181 PolarHBondContact O-N 2.94Å; V181-L187 HydrophobicContact CG1-CD1 3.64Å | ||
| 182 | W | 51.8 | Low | 49.7 | Very low | 170 Ų | 170 | 92.8 Ų | 92.8 | 64% | 0.644 | 49% | 0.485 | S | S | * | . | trans | -130 | 143.1 | 172.1 | 68.4 | -69.3 | 0 | 0 | 0 | 109.1 | S180 H184 | S180-W182 PolarHBondContact O-N 3.36Å; W182-H184 HydrophobicContact CZ3-CB 4.49Å | ||
| 183 | S | 49.6 | Very low | 50.3 | Low | 42 Ų | 42 | 89.7 Ų | 89.7 | 29% | 0.294 | 46% | 0.462 | S | S | . | . | trans | -120.7 | 130 | 173 | 169.3 | 0 | 0 | 0 | 0 | 107.3 | E185 G186 | S183-E185 PolarHBondContact O-N 2.94Å; S183-E185 VanDerWaalsContact O-N 3.09Å; S183-E185 PolarHBondContact OG-N 3.44Å; S183-G186 PolarHBondContact O-N 3.36Å; S183-G186 VanDerWaalsContact O-N 3.08Å; S183-G186 PolarHBondContact OG-O 2.95Å | ||
| 184 | H | 39.4 | Very low | 51.1 | Low | 171 Ų | 171 | 81.8 Ų | 81.8 | 79% | 0.792 | 44% | 0.439 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.9 | -15.7 | -178.7 | -149.6 | -35.6 | 0 | 0 | 0 | 112.7 | W182 | W182-H184 HydrophobicContact CZ3-CB 4.49Š|
| 185 | E | 44.6 | Very low | 51.8 | Low | 166 Ų | 166 | 82.6 Ų | 82.6 | 78% | 0.776 | 45% | 0.452 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -113.6 | 13.9 | 178.1 | -62.9 | -164.9 | 153.8 | 0 | 0 | 113.5 | S183 | S183-E185 PolarHBondContact O-N 2.94Å; S183-E185 VanDerWaalsContact O-N 3.09Å; S183-E185 PolarHBondContact OG-N 3.44Å |
| 186 | G | 44.1 | Very low | 52.7 | Low | 39 Ų | 39 | 87.1 Ų | 87.1 | 40% | 0.402 | 46% | 0.457 | S | S | . | . | trans | 70.2 | 149.5 | -162.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | S183 V188 | S183-G186 PolarHBondContact O-N 3.36Å; S183-G186 VanDerWaalsContact O-N 3.08Å; S183-G186 PolarHBondContact OG-O 2.95Å; G186-V188 PolarHBondContact O-N 2.85Å | ||
| 187 | L | 46.3 | Very low | 53.5 | Low | 27 Ų | 27 | 83.8 Ų | 83.8 | 14% | 0.141 | 44% | 0.442 | C | S | . | . | S | Bend | trans | -77.3 | 53.9 | 175.1 | -139 | 129.1 | 0 | 0 | 0 | 108.8 | L61 F64 V181 L189 | L61-L187 HydrophobicContact CB-CD2 4.07Å; L61-L187 HydrophobicContact CD2-CD2 3.66Å; L61-L187 HydrophobicContact CG-CD2 4.33Å; F64-L187 HydrophobicContact CD1-CD1 4.18Å; F64-L187 HydrophobicContact CD1-CD2 4.03Å; F64-L187 HydrophobicContact CE1-CD1 4.34Å; V181-L187 HydrophobicContact CG1-CD1 3.64Å; L187-L189 VanDerWaalsContact C-N 3.3Å; L187-L189 HydrophobicContact CD2-CD1 3.57Å; L187-L189 HydrophobicContact CG-CD1 4.34Å; L187-L189 PolarHBondContact O-N 3.39Å; L187-L189 VanDerWaalsContact O-N 3.13Å |
| 188 | V | 42.3 | Very low | 54 | Low | 80 Ų | 80 | 76.1 Ų | 76.1 | 49% | 0.485 | 41% | 0.406 | S | S | . | . | trans | -85.1 | 82.5 | 178.8 | -178.2 | 0 | 0 | 0 | 0 | 105 | G186 T190 | G186-V188 PolarHBondContact O-N 2.85Å; V188-T190 HydrophobicContact CG1-CG2 3.57Å; V188-T190 PolarHBondContact O-N 3.49Å | ||
| 189 | L | 44.5 | Very low | 54.6 | Low | 18 Ų | 18 | 74.3 Ų | 74.3 | 9% | 0.094 | 40% | 0.396 | C | S | . | . | trans | -70.3 | 71.8 | 165.4 | -85.6 | 88.7 | 0 | 0 | 0 | 108.5 | I53 L61 L88 P157 L187 K191 | I53-L189 WeakPolarHBondContact CD1-O 3.45Å; L61-L189 HydrophobicContact CD1-CB 3.55Å; L61-L189 HydrophobicContact CD1-CD1 3.56Å; L61-L189 HydrophobicContact CD1-CD2 4.4Å; L61-L189 HydrophobicContact CD1-CG 4.02Å; L61-L189 HydrophobicContact CD2-CD1 3.9Å; L61-L189 HydrophobicContact CG-CD1 4.29Å; L88-L189 HydrophobicContact CD1-CD2 3.07Å; L88-L189 HydrophobicContact CD1-CG 4.46Å; L88-L189 HydrophobicContact CD2-CD1 3.78Å; L88-L189 HydrophobicContact CD2-CD2 3.65Å; L88-L189 HydrophobicContact CD2-CG 4.38Å; L88-L189 HydrophobicContact CG-CD1 4.47Å; L88-L189 HydrophobicContact CG-CD2 3.47Å; L88-L189 VanDerWaalsContact CG-CD2 3.47Å; P157-L189 HydrophobicContact CB-CB 3.85Å; P157-L189 HydrophobicContact CB-CD2 3.9Å; P157-L189 HydrophobicContact CG-CB 3.71Å; P157-L189 HydrophobicContact CG-CD2 3.87Å; L187-L189 VanDerWaalsContact C-N 3.3Å; L187-L189 HydrophobicContact CD2-CD1 3.57Å; L187-L189 HydrophobicContact CG-CD1 4.34Å; L187-L189 PolarHBondContact O-N 3.39Å; L187-L189 VanDerWaalsContact O-N 3.13Å; L189-K191 PolarHBondContact O-N 3.34Å | ||
| 190 | T | 38.8 | Very low | 55.6 | Low | 32 Ų | 32 | 76.2 Ų | 76.2 | 20% | 0.196 | 40% | 0.403 | C | S | . | . | trans | -69.2 | 111.6 | 155.9 | 40.3 | 0 | 0 | 0 | 0 | 107.6 | R49 I53 V188 L192 | R49-T190 HydrophobicContact CB-CG2 3.88Å; R49-T190 HydrophobicContact CG-CG2 3.93Å; I53-T190 HydrophobicContact CD1-CG2 3.96Å; V188-T190 HydrophobicContact CG1-CG2 3.57Å; V188-T190 PolarHBondContact O-N 3.49Å; T190-L192 VanDerWaalsContact C-N 3.35Å; T190-L192 PolarHBondContact O-N 2.87Å | ||
| 191 | K | 41.5 | Very low | 56.6 | Low | 101 Ų | 101 | 75.9 Ų | 75.9 | 44% | 0.439 | 40% | 0.4 | S | S | . | . | trans | -46 | 107.3 | 164.5 | -172.9 | -175.8 | -177.6 | -175.3 | 0 | 105 | S50 P157 L189 L193 | S50-K191 WeakPolarHBondContact CB-O 3.4Å; P157-K191 HydrophobicContact CB-CB 4.3Å; L189-K191 PolarHBondContact O-N 3.34Å; K191-L193 PolarHBondContact O-N 3.48Å | ||
| 192 | L | 49.3 | Very low | 57.8 | Low | 98 Ų | 98 | 75.6 Ų | 75.6 | 51% | 0.513 | 40% | 0.399 | S | S | . | . | B | Isolated β-bridge | trans | -59.1 | 131.5 | 172.1 | -75.7 | 94.8 | 0 | 0 | 0 | 104.6 | T190 T194 | T190-L192 VanDerWaalsContact C-N 3.35Å; T190-L192 PolarHBondContact O-N 2.87Å; L192-T194 PolarHBondContact O-N 3.43Å; L192-T194 VanDerWaalsContact O-N 3.11Å |
| 193 | L | 49.7 | Very low | 59.5 | Low | 54 Ų | 54 | 70.3 Ų | 70.3 | 28% | 0.283 | 39% | 0.388 | S | S | . | . | P | Polyproline II helix | trans | -48.9 | 129.4 | 158 | -82.4 | 94 | 0 | 0 | 0 | 105 | K191 S195 L198 | K191-L193 PolarHBondContact O-N 3.48Å; L193-S195 PolarHBondContact O-N 3.11Å; L193-L198 HydrophobicContact CB-CB 4.19Å; L193-L198 HydrophobicContact CB-CD1 4.18Å |
| 194 | T | 59.7 | Low | 61.6 | Low | 65 Ų | 65 | 76.3 Ų | 76.3 | 40% | 0.399 | 40% | 0.404 | S | S | . | . | P | Polyproline II helix | trans | -54.4 | 139.7 | -179.7 | 61.3 | 0 | 0 | 0 | 0 | 106.5 | L192 E196 E197 L198 | L192-T194 PolarHBondContact O-N 3.43Å; L192-T194 VanDerWaalsContact O-N 3.11Å; T194-E196 CarbonylContact O-C 3.58Å; T194-E196 PolarHBondContact O-N 3.45Å; T194-E197 PolarHBondContact O-N 3.32Å; T194-E197 WeakPolarHBondContact OG1-CB 3.4Å; T194-E197 VanDerWaalsContact OG1-CG 3.23Å; T194-E197 WeakPolarHBondContact OG1-CG 3.27Å; T194-E197 PolarHBondContact OG1-N 2.95Å; T194-L198 PolarHBondContact O-N 2.9Å; T194-L198 VanDerWaalsContact O-N 3.08Å |
| 195 | S | 62.6 | Low | 64.1 | Low | 86 Ų | 86 | 70.1 Ų | 70.1 | 60% | 0.601 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -52.4 | -26.1 | -178.8 | 50.2 | 0 | 0 | 0 | 0 | 111.8 | L193 A199 | L193-S195 PolarHBondContact O-N 3.11Å; S195-A199 WeakPolarHBondContact O-CB 3.28Å; S195-A199 PolarHBondContact O-N 2.83Å |
| 196 | E | 70 | Confident | 66.3 | Low | 152 Ų | 152 | 64.8 Ų | 64.8 | 71% | 0.71 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -67.9 | -51.1 | 172.4 | -60.2 | -175.4 | 169.4 | 0 | 0 | 113.2 | T194 L198 A199 L200 | T194-E196 CarbonylContact O-C 3.58Å; T194-E196 PolarHBondContact O-N 3.45Å; E196-L198 VanDerWaalsContact C-N 3.32Å; E196-L198 PolarHBondContact O-N 3.24Å; E196-A199 PolarHBondContact O-N 2.89Å; E196-L200 VanDerWaalsContact O-CB 3.28Å; E196-L200 WeakPolarHBondContact O-CB 3.39Å; E196-L200 PolarHBondContact O-N 3.19Å |
| 197 | E | 70.5 | Confident | 68.6 | Low | 104 Ų | 104 | 67.6 Ų | 67.6 | 49% | 0.486 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -60.6 | -42.7 | 177.9 | -78.7 | 172.9 | 173.2 | 0 | 0 | 111.6 | T194 L200 C201 | T194-E197 PolarHBondContact O-N 3.32Å; T194-E197 WeakPolarHBondContact OG1-CB 3.4Å; T194-E197 VanDerWaalsContact OG1-CG 3.23Å; T194-E197 WeakPolarHBondContact OG1-CG 3.27Å; T194-E197 PolarHBondContact OG1-N 2.95Å; E197-L200 PolarHBondContact O-N 2.9Å; E197-C201 WeakPolarHBondContact O-CB 3.29Å; E197-C201 PolarHBondContact O-N 3.44Å |
| 198 | L | 72.1 | Confident | 70.9 | Confident | 4 Ų | 4 | 71 Ų | 71 | 2% | 0.021 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -72.6 | -37.3 | -179.2 | -161.7 | 142.6 | 0 | 0 | 0 | 111.7 | L41 R45 L48 L193 T194 E196 L200 G202 | L41-L198 HydrophobicContact CB-CD2 3.91Å; L41-L198 HydrophobicContact CB-CG 4.45Å; L41-L198 HydrophobicContact CD2-CD1 4.33Å; L41-L198 HydrophobicContact CD2-CG 4.3Å; L41-L198 WeakPolarHBondContact O-CD2 3.23Å; R45-L198 HydrophobicContact CG-CD2 4.05Å; L48-L198 HydrophobicContact CB-CD1 3.72Å; L48-L198 HydrophobicContact CD1-CD1 4.36Å; L193-L198 HydrophobicContact CB-CB 4.19Å; L193-L198 HydrophobicContact CB-CD1 4.18Å; T194-L198 PolarHBondContact O-N 2.9Å; T194-L198 VanDerWaalsContact O-N 3.08Å; E196-L198 VanDerWaalsContact C-N 3.32Å; E196-L198 PolarHBondContact O-N 3.24Å; L198-L200 VanDerWaalsContact C-N 3.34Å; L198-G202 PolarHBondContact O-N 3.41Å |
| 199 | A | 81.1 | Confident | 73.3 | Confident | 25 Ų | 25 | 67.2 Ų | 67.2 | 21% | 0.207 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -64.4 | -39.3 | 170.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | L42 S195 E196 S203 | L42-A199 HydrophobicContact CD2-CB 4.41Å; S195-A199 WeakPolarHBondContact O-CB 3.28Å; S195-A199 PolarHBondContact O-N 2.83Å; E196-A199 PolarHBondContact O-N 2.89Å; A199-S203 WeakPolarHBondContact O-CB 3.31Å; A199-S203 PolarHBondContact O-N 2.88Å |
| 200 | L | 85.3 | Confident | 75.6 | Confident | 95 Ų | 95 | 69 Ų | 69 | 50% | 0.497 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -66.5 | -46.5 | 177.9 | -170.5 | 70.6 | 0 | 0 | 0 | 111.1 | E196 E197 L198 R204 | E196-L200 VanDerWaalsContact O-CB 3.28Å; E196-L200 WeakPolarHBondContact O-CB 3.39Å; E196-L200 PolarHBondContact O-N 3.19Å; E197-L200 PolarHBondContact O-N 2.9Å; L198-L200 VanDerWaalsContact C-N 3.34Å; L200-R204 WeakPolarHBondContact O-CB 3.49Å; L200-R204 WeakPolarHBondContact O-CG 3.36Å; L200-R204 PolarHBondContact O-N 3.15Å |
| 201 | C | 84.3 | Confident | 78.2 | Confident | 58 Ų | 58 | 73.6 Ų | 73.6 | 39% | 0.392 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -63.5 | -51 | 177 | -174.4 | 0 | 0 | 0 | 0 | 111.4 | E197 S203 R204 L205 | E197-C201 WeakPolarHBondContact O-CB 3.29Å; E197-C201 PolarHBondContact O-N 3.44Å; C201-S203 VanDerWaalsContact C-N 3.34Å; C201-S203 PolarHBondContact O-N 3.22Å; C201-R204 PolarHBondContact O-N 3.48Å; C201-L205 WeakPolarHBondContact O-CB 3.25Å; C201-L205 WeakPolarHBondContact O-CG 3.32Å; C201-L205 PolarHBondContact O-N 3.48Å |
| 202 | G | 85.8 | Confident | 80.7 | Confident | 0 Ų | 0 | 69.9 Ų | 69.9 | 0% | 0 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -60 | -43.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | L198 L205 L206 | L198-G202 PolarHBondContact O-N 3.41Å; G202-L205 PolarHBondContact O-N 3.24Å; G202-L206 WeakPolarHBondContact O-CG 3.29Å; G202-L206 PolarHBondContact O-N 2.87Å |
| 203 | S | 88.9 | Confident | 82.7 | Confident | 59 Ų | 59 | 67.3 Ų | 67.3 | 41% | 0.413 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -62.5 | -46.6 | 175.5 | -178.4 | 0 | 0 | 0 | 0 | 111.9 | A199 C201 L205 L206 V207 | A199-S203 WeakPolarHBondContact O-CB 3.31Å; A199-S203 PolarHBondContact O-N 2.88Å; C201-S203 VanDerWaalsContact C-N 3.34Å; C201-S203 PolarHBondContact O-N 3.22Å; S203-L205 VanDerWaalsContact C-N 3.34Å; S203-L205 PolarHBondContact O-N 3.41Å; S203-L206 PolarHBondContact O-N 3.39Å; S203-V207 VanDerWaalsContact O-CG2 3.31Å; S203-V207 WeakPolarHBondContact O-CG2 3.5Å; S203-V207 PolarHBondContact O-N 2.92Å |
| 204 | R | 92.5 | Very high | 84.8 | Confident | 168 Ų | 168 | 70.1 Ų | 70.1 | 63% | 0.634 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -61.6 | -41.4 | 177.5 | -75.3 | 175.5 | -178.4 | -157.6 | 2 | 112.3 | L200 C201 V207 L208 | L200-R204 WeakPolarHBondContact O-CB 3.49Å; L200-R204 WeakPolarHBondContact O-CG 3.36Å; L200-R204 PolarHBondContact O-N 3.15Å; C201-R204 PolarHBondContact O-N 3.48Å; R204-V207 PolarHBondContact O-N 2.93Å; R204-L208 VanDerWaalsContact O-CB 3.27Å; R204-L208 WeakPolarHBondContact O-CB 3.38Å; R204-L208 PolarHBondContact O-N 3.38Å |
| 205 | L | 91.8 | Very high | 86.3 | Confident | 42 Ų | 42 | 71.4 Ų | 71.4 | 22% | 0.22 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -64.9 | -41 | 176.3 | -77.3 | 164.4 | 0 | 0 | 0 | 112.1 | L37 L41 C201 G202 S203 G209 | L37-L205 HydrophobicContact CD2-CD1 3.89Å; L37-L205 HydrophobicContact CD2-CD2 4.5Å; L37-L205 HydrophobicContact CG-CD1 4.09Å; L41-L205 HydrophobicContact CD1-CD1 3.52Å; C201-L205 WeakPolarHBondContact O-CB 3.25Å; C201-L205 WeakPolarHBondContact O-CG 3.32Å; C201-L205 PolarHBondContact O-N 3.48Å; G202-L205 PolarHBondContact O-N 3.24Å; S203-L205 VanDerWaalsContact C-N 3.34Å; S203-L205 PolarHBondContact O-N 3.41Å; L205-G209 PolarHBondContact O-N 2.79Å |
| 206 | L | 91.7 | Very high | 87.6 | Confident | 54 Ų | 54 | 67.6 Ų | 67.6 | 28% | 0.283 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -64.2 | -45.7 | 174.5 | -75.5 | -171.8 | 0 | 0 | 0 | 112.2 | L35 L42 G202 S203 G209 S210 | L35-L206 HydrophobicContact CD2-CD2 3.81Å; L35-L206 WeakPolarHBondContact O-CD2 3.48Å; L42-L206 HydrophobicContact CD1-CD1 3.31Å; L42-L206 HydrophobicContact CD1-CG 4.03Å; G202-L206 WeakPolarHBondContact O-CG 3.29Å; G202-L206 PolarHBondContact O-N 2.87Å; S203-L206 PolarHBondContact O-N 3.39Å; L206-G209 PolarHBondContact O-N 3.22Å; L206-S210 VanDerWaalsContact O-CB 3.23Å; L206-S210 WeakPolarHBondContact O-CB 3.34Å; L206-S210 PolarHBondContact O-N 2.85Å |
| 207 | V | 92.7 | Very high | 88.4 | Confident | 97 Ų | 97 | 62 Ų | 62 | 59% | 0.588 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -63 | -48.1 | 179.4 | 171.3 | 0 | 0 | 0 | 0 | 110.4 | S203 R204 S210 F211 | S203-V207 VanDerWaalsContact O-CG2 3.31Å; S203-V207 WeakPolarHBondContact O-CG2 3.5Å; S203-V207 PolarHBondContact O-N 2.92Å; R204-V207 PolarHBondContact O-N 2.93Å; V207-S210 PolarHBondContact O-N 3.01Å; V207-F211 WeakPolarHBondContact O-CB 3.08Å; V207-F211 PolarHBondContact O-N 3.36Å |
| 208 | L | 93.5 | Very high | 89.2 | Confident | 98 Ų | 98 | 62.3 Ų | 62.3 | 51% | 0.513 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -63.6 | -44.9 | 177.9 | -173.9 | 68.3 | 0 | 0 | 0 | 111.2 | R204 S210 F211 L212 | R204-L208 VanDerWaalsContact O-CB 3.27Å; R204-L208 WeakPolarHBondContact O-CB 3.38Å; R204-L208 PolarHBondContact O-N 3.38Å; L208-S210 PolarHBondContact O-N 2.96Å; L208-F211 PolarHBondContact O-N 2.96Å; L208-L212 HydrophobicContact CG-CD1 4.38Å; L208-L212 VanDerWaalsContact O-CG 3.28Å; L208-L212 WeakPolarHBondContact O-CG 3.47Å; L208-L212 PolarHBondContact O-N 3.43Å |
| 209 | G | 92.6 | Very high | 89.8 | Confident | 1 Ų | 1 | 65.2 Ų | 65.2 | 1% | 0.01 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -61.4 | -44.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | L205 L206 L212 L213 | L205-G209 PolarHBondContact O-N 2.79Å; L206-G209 PolarHBondContact O-N 3.22Å; G209-L212 PolarHBondContact O-N 3.34Å; G209-L213 WeakPolarHBondContact O-CG 3.36Å; G209-L213 PolarHBondContact O-N 3.3Å; G209-L213 VanDerWaalsContact O-N 3.11Å |
| 210 | S | 92.6 | Very high | 89.7 | Confident | 56 Ų | 56 | 66.5 Ų | 66.5 | 39% | 0.392 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -62.9 | -45.6 | 174.8 | -176.9 | 0 | 0 | 0 | 0 | 112 | L206 V207 L208 L212 L213 L214 | L206-S210 VanDerWaalsContact O-CB 3.23Å; L206-S210 WeakPolarHBondContact O-CB 3.34Å; L206-S210 PolarHBondContact O-N 2.85Å; V207-S210 PolarHBondContact O-N 3.01Å; L208-S210 PolarHBondContact O-N 2.96Å; S210-L212 VanDerWaalsContact C-N 3.34Å; S210-L212 PolarHBondContact O-N 3.35Å; S210-L213 PolarHBondContact O-N 3.26Å; S210-L214 WeakPolarHBondContact O-CG 3.3Å; S210-L214 PolarHBondContact O-N 3.01Å |
| 211 | F | 94.1 | Very high | 89.6 | Confident | 129 Ų | 129 | 65.8 Ų | 65.8 | 57% | 0.566 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -59 | -44.4 | 177.1 | 178.7 | -96.5 | 0 | 0 | 0 | 112.1 | V207 L208 L213 L214 F215 | V207-F211 WeakPolarHBondContact O-CB 3.08Å; V207-F211 PolarHBondContact O-N 3.36Å; L208-F211 PolarHBondContact O-N 2.96Å; F211-L213 PolarHBondContact O-N 3.46Å; F211-L214 PolarHBondContact O-N 2.98Å; F211-F215 WeakPolarHBondContact O-CB 3.34Å; F211-F215 PolarHBondContact O-N 2.9Å |
| 212 | L | 93.2 | Very high | 89.3 | Confident | 22 Ų | 22 | 67.2 Ų | 67.2 | 12% | 0.115 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -62.7 | -40.8 | 177.5 | -72.4 | 177.9 | 0 | 0 | 0 | 112.5 | L27 L30 L208 G209 S210 C216 | L27-L212 HydrophobicContact CD2-CD2 3.88Å; L30-L212 HydrophobicContact CB-CD1 4.09Å; L30-L212 HydrophobicContact CD2-CD1 3.62Å; L30-L212 HydrophobicContact CG-CD1 3.69Å; L208-L212 HydrophobicContact CG-CD1 4.38Å; L208-L212 VanDerWaalsContact O-CG 3.28Å; L208-L212 WeakPolarHBondContact O-CG 3.47Å; L208-L212 PolarHBondContact O-N 3.43Å; G209-L212 PolarHBondContact O-N 3.34Å; S210-L212 VanDerWaalsContact C-N 3.34Å; S210-L212 PolarHBondContact O-N 3.35Å; L212-C216 VanDerWaalsContact O-CB 3.25Å; L212-C216 WeakPolarHBondContact O-CB 3.11Å; L212-C216 PolarHBondContact O-N 3.31Å |
| 213 | L | 93 | Very high | 88.5 | Confident | 44 Ų | 44 | 68.5 Ų | 68.5 | 23% | 0.23 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -69 | -40.3 | 177.4 | -70.9 | 171.2 | 0 | 0 | 0 | 112.3 | L28 L32 L35 G209 S210 F211 C216 G217 | L28-L213 HydrophobicContact CD1-CD2 4.35Å; L28-L213 HydrophobicContact CG-CD2 4.38Å; L32-L213 HydrophobicContact CD2-CD1 4.37Å; L32-L213 HydrophobicContact CD2-CD2 4.47Å; L32-L213 HydrophobicContact CG-CD2 4.31Å; L35-L213 HydrophobicContact CD1-CD1 3.29Å; L35-L213 HydrophobicContact CG-CD1 4.06Å; G209-L213 WeakPolarHBondContact O-CG 3.36Å; G209-L213 PolarHBondContact O-N 3.3Å; G209-L213 VanDerWaalsContact O-N 3.11Å; S210-L213 PolarHBondContact O-N 3.26Å; F211-L213 PolarHBondContact O-N 3.46Å; L213-C216 PolarHBondContact O-N 3.48Å; L213-G217 PolarHBondContact O-N 2.98Å |
| 214 | L | 93.2 | Very high | 87.6 | Confident | 114 Ų | 114 | 68.7 Ų | 68.7 | 60% | 0.597 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -63 | -46.4 | 174.2 | -72.8 | 173.7 | 0 | 0 | 0 | 111.1 | S210 F211 C216 G217 L218 | S210-L214 WeakPolarHBondContact O-CG 3.3Å; S210-L214 PolarHBondContact O-N 3.01Å; F211-L214 PolarHBondContact O-N 2.98Å; L214-C216 VanDerWaalsContact C-N 3.34Å; L214-C216 PolarHBondContact O-N 2.88Å; L214-G217 PolarHBondContact O-N 2.95Å; L214-L218 WeakPolarHBondContact O-CG 3.38Å; L214-L218 PolarHBondContact O-N 3.35Å |
| 215 | F | 91.4 | Very high | 86.6 | Confident | 92 Ų | 92 | 67.5 Ų | 67.5 | 40% | 0.404 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -61.4 | -43.3 | 176.5 | -174.6 | -105.4 | 0 | 0 | 0 | 111.5 | L27 F211 G217 L218 L219 | L27-F215 HydrophobicContact CD1-CD1 4.18Å; L27-F215 HydrophobicContact CD1-CE1 4.34Å; F211-F215 WeakPolarHBondContact O-CB 3.34Å; F211-F215 PolarHBondContact O-N 2.9Å; F215-G217 PolarHBondContact O-N 3.21Å; F215-L218 PolarHBondContact O-N 3.45Å; F215-L219 HydrophobicContact CD1-CD1 3.87Å; F215-L219 HydrophobicContact CD1-CG 4.35Å; F215-L219 HydrophobicContact CE1-CD1 3.49Å; F215-L219 VanDerWaalsContact CE1-CD1 3.49Å; F215-L219 HydrophobicContact CE1-CD2 4.46Å; F215-L219 HydrophobicContact CE1-CG 4.06Å; F215-L219 HydrophobicContact CZ-CD1 4.1Å; F215-L219 HydrophobicContact CZ-CD2 4.24Å; F215-L219 HydrophobicContact CZ-CG 4.25Å; F215-L219 WeakPolarHBondContact O-CG 3.36Å; F215-L219 PolarHBondContact O-N 3.32Å |
| 216 | C | 89.1 | Confident | 85.2 | Confident | 6 Ų | 6 | 70.2 Ų | 70.2 | 4% | 0.041 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -60.4 | -44.4 | 173.9 | -171.7 | 0 | 0 | 0 | 0 | 111.9 | L27 L212 L213 L214 L219 C220 | L27-C216 HydrophobicContact CB-CB 4.38Å; L212-C216 VanDerWaalsContact O-CB 3.25Å; L212-C216 WeakPolarHBondContact O-CB 3.11Å; L212-C216 PolarHBondContact O-N 3.31Å; L213-C216 PolarHBondContact O-N 3.48Å; L214-C216 VanDerWaalsContact C-N 3.34Å; L214-C216 PolarHBondContact O-N 2.88Å; C216-L219 PolarHBondContact O-N 3.29Å; C216-C220 PolarHBondContact O-N 3.22Å; C216-C220 PolarHBondContact O-SG 3.29Å |
| 217 | G | 87.1 | Confident | 83.5 | Confident | 33 Ų | 33 | 72.4 Ų | 72.4 | 34% | 0.34 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -61.4 | -42.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | L213 L214 F215 C220 C221 | L213-G217 PolarHBondContact O-N 2.98Å; L214-G217 PolarHBondContact O-N 2.95Å; F215-G217 PolarHBondContact O-N 3.21Å; G217-C220 PolarHBondContact O-N 3.45Å; G217-C221 PolarHBondContact O-N 3.31Å; G217-C221 PolarHBondContact O-SG 3.45Å |
| 218 | L | 87.9 | Confident | 81.5 | Confident | 112 Ų | 112 | 74.3 Ų | 74.3 | 59% | 0.586 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -62.3 | -45.2 | 175.3 | -73.3 | 170.1 | 0 | 0 | 0 | 112 | L214 F215 C220 C221 V222 | L214-L218 WeakPolarHBondContact O-CG 3.38Å; L214-L218 PolarHBondContact O-N 3.35Å; F215-L218 PolarHBondContact O-N 3.45Å; L218-C220 VanDerWaalsContact C-N 3.33Å; L218-C220 PolarHBondContact O-N 2.8Å; L218-C221 PolarHBondContact O-N 2.92Å; L218-V222 WeakPolarHBondContact O-CG2 3.36Å; L218-V222 PolarHBondContact O-N 2.97Å |
| 219 | L | 83.2 | Confident | 79.5 | Confident | 64 Ų | 64 | 73.5 Ų | 73.5 | 34% | 0.335 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -58.6 | -45.4 | 175.2 | -71.4 | 176.7 | 0 | 0 | 0 | 111.4 | L27 F215 C216 C221 V222 T223 | L27-L219 HydrophobicContact CD1-CD1 4.14Å; F215-L219 HydrophobicContact CD1-CD1 3.87Å; F215-L219 HydrophobicContact CD1-CG 4.35Å; F215-L219 HydrophobicContact CE1-CD1 3.49Å; F215-L219 VanDerWaalsContact CE1-CD1 3.49Å; F215-L219 HydrophobicContact CE1-CD2 4.46Å; F215-L219 HydrophobicContact CE1-CG 4.06Å; F215-L219 HydrophobicContact CZ-CD1 4.1Å; F215-L219 HydrophobicContact CZ-CD2 4.24Å; F215-L219 HydrophobicContact CZ-CG 4.25Å; F215-L219 WeakPolarHBondContact O-CG 3.36Å; F215-L219 PolarHBondContact O-N 3.32Å; C216-L219 PolarHBondContact O-N 3.29Å; L219-C221 PolarHBondContact O-N 3.28Å; L219-V222 PolarHBondContact O-N 3.1Å; L219-T223 WeakPolarHBondContact O-CG2 3.46Å; L219-T223 PolarHBondContact O-N 3.47Å; L219-T223 PolarHBondContact O-OG1 3.3Å |
| 220 | C | 80.4 | Confident | 77.3 | Confident | 53 Ų | 53 | 84.7 Ų | 84.7 | 36% | 0.358 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -59.9 | -44.3 | 175.3 | -69.4 | 0 | 0 | 0 | 0 | 111.9 | C216 G217 L218 T223 A224 | C216-C220 PolarHBondContact O-N 3.22Å; C216-C220 PolarHBondContact O-SG 3.29Å; G217-C220 PolarHBondContact O-N 3.45Å; L218-C220 VanDerWaalsContact C-N 3.33Å; L218-C220 PolarHBondContact O-N 2.8Å; C220-T223 PolarHBondContact O-N 3.43Å; C220-T223 PolarHBondContact O-OG1 3.33Å; C220-A224 WeakPolarHBondContact O-CB 3.35Å; C220-A224 PolarHBondContact O-N 3.1Å |
| 221 | C | 82 | Confident | 75.1 | Confident | 79 Ų | 79 | 93.4 Ų | 93.4 | 53% | 0.534 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -62.1 | -45.8 | 176.5 | -70.8 | 0 | 0 | 0 | 0 | 112.4 | G217 L218 L219 T223 A224 M225 | G217-C221 PolarHBondContact O-N 3.31Å; G217-C221 PolarHBondContact O-SG 3.45Å; L218-C221 PolarHBondContact O-N 2.92Å; L219-C221 PolarHBondContact O-N 3.28Å; C221-T223 VanDerWaalsContact C-N 3.34Å; C221-T223 PolarHBondContact O-N 3.27Å; C221-A224 PolarHBondContact O-N 3.37Å; C221-M225 VanDerWaalsContact O-CG 3.27Å; C221-M225 WeakPolarHBondContact O-CG 3.33Å; C221-M225 PolarHBondContact O-N 2.99Å |
| 222 | V | 78.3 | Confident | 72.7 | Confident | 88 Ų | 88 | 96 Ų | 96 | 53% | 0.533 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.4 | -44.8 | 178.9 | 171.9 | 0 | 0 | 0 | 0 | 110.5 | L218 L219 A224 M225 C226 | L218-V222 WeakPolarHBondContact O-CG2 3.36Å; L218-V222 PolarHBondContact O-N 2.97Å; L219-V222 PolarHBondContact O-N 3.1Å; V222-A224 PolarHBondContact O-N 2.9Å; V222-M225 PolarHBondContact O-N 3.46Å; V222-C226 WeakPolarHBondContact O-CB 3.46Å; V222-C226 PolarHBondContact O-N 3.47Å; V222-C226 PolarHBondContact O-SG 3.29Å |
| 223 | T | 70.3 | Confident | 70.4 | Confident | 27 Ų | 27 | 100.4 Ų | 100.4 | 17% | 0.166 | 53% | 0.528 | C | S | . | . | H | α-helix | trans | -61.5 | -45.1 | 175.9 | 59.1 | 0 | 0 | 0 | 0 | 111.6 | L20 L219 C220 C221 M225 C226 F227 | L20-T223 HydrophobicContact CD1-CG2 4.29Å; L20-T223 HydrophobicContact CD2-CG2 4.2Å; L219-T223 WeakPolarHBondContact O-CG2 3.46Å; L219-T223 PolarHBondContact O-N 3.47Å; L219-T223 PolarHBondContact O-OG1 3.3Å; C220-T223 PolarHBondContact O-N 3.43Å; C220-T223 PolarHBondContact O-OG1 3.33Å; C221-T223 VanDerWaalsContact C-N 3.34Å; C221-T223 PolarHBondContact O-N 3.27Å; T223-M225 VanDerWaalsContact C-N 3.28Å; T223-M225 PolarHBondContact O-N 3.48Å; T223-C226 PolarHBondContact O-N 3.25Å; T223-F227 WeakPolarHBondContact O-CB 3.43Å; T223-F227 WeakPolarHBondContact O-CD2 3.48Å; T223-F227 PolarHBondContact O-N 2.97Å |
| 224 | A | 68.5 | Low | 68.1 | Low | 64 Ų | 64 | 105.7 Ų | 105.7 | 53% | 0.529 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -60.2 | -36.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | C220 C221 V222 H228 | C220-A224 WeakPolarHBondContact O-CB 3.35Å; C220-A224 PolarHBondContact O-N 3.1Å; C221-A224 PolarHBondContact O-N 3.37Å; V222-A224 PolarHBondContact O-N 2.9Å; A224-H228 PolarHBondContact O-N 3.29Å |
| 225 | M | 71.3 | Confident | 66.1 | Low | 143 Ų | 143 | 112.3 Ų | 112.3 | 70% | 0.704 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -74.2 | -41.9 | 177.7 | -66.8 | -63.1 | -70.3 | 0 | 0 | 112.4 | C221 V222 T223 F227 H228 | C221-M225 VanDerWaalsContact O-CG 3.27Å; C221-M225 WeakPolarHBondContact O-CG 3.33Å; C221-M225 PolarHBondContact O-N 2.99Å; V222-M225 PolarHBondContact O-N 3.46Å; T223-M225 VanDerWaalsContact C-N 3.28Å; T223-M225 PolarHBondContact O-N 3.48Å; M225-F227 VanDerWaalsContact C-N 3.32Å; M225-F227 PolarHBondContact O-N 2.89Å; M225-H228 PolarHBondContact O-N 3.35Å |
| 226 | C | 63.3 | Low | 64.1 | Low | 99 Ų | 99 | 111.6 Ų | 111.6 | 67% | 0.669 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -67.9 | -31 | 178.6 | -69.6 | 0 | 0 | 0 | 0 | 112.8 | V222 T223 | V222-C226 WeakPolarHBondContact O-CB 3.46Å; V222-C226 PolarHBondContact O-N 3.47Å; V222-C226 PolarHBondContact O-SG 3.29Å; T223-C226 PolarHBondContact O-N 3.25Å |
| 227 | F | 56.4 | Low | 62.1 | Low | 99 Ų | 99 | 122.5 Ų | 122.5 | 43% | 0.434 | 62% | 0.615 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -95.9 | 11.1 | 178.4 | -67.9 | -70.1 | 0 | 0 | 0 | 113.7 | C13 T223 M225 P229 | C13-F227 HydrophobicContact CB-CD2 4.42Å; C13-F227 VanDerWaalsContact SG-CD2 3.58Å; C13-F227 WeakPolarHBondContact SG-CE2 3.27Å; T223-F227 WeakPolarHBondContact O-CB 3.43Å; T223-F227 WeakPolarHBondContact O-CD2 3.48Å; T223-F227 PolarHBondContact O-N 2.97Å; M225-F227 VanDerWaalsContact C-N 3.32Å; M225-F227 PolarHBondContact O-N 2.89Å; F227-P229 VanDerWaalsContact O-CD 3.28Å; F227-P229 WeakPolarHBondContact O-CD 3.28Å; F227-P229 VanDerWaalsContact O-N 3.07Å |
| 228 | H | 50.4 | Low | 60.4 | Low | 138 Ų | 138 | 127 Ų | 127 | 64% | 0.639 | 64% | 0.635 | S | S | * | * | S | Bend | trans | -62.3 | 116 | 171.9 | -147.7 | -68.7 | 0 | 0 | 0 | 107.9 | A224 M225 R230 | A224-H228 PolarHBondContact O-N 3.29Å; M225-H228 PolarHBondContact O-N 3.35Å; H228-R230 PolarHBondContact O-N 2.88Å |
| 229 | P | 50.9 | Low | 58.6 | Low | 81 Ų | 81 | 133.1 Ų | 133.1 | 53% | 0.526 | 65% | 0.651 | S | S | . | * | trans | -63 | 116.9 | -174 | 24.7 | -31.8 | 0 | 0 | 0 | 107 | F227 R231 | F227-P229 VanDerWaalsContact O-CD 3.28Å; F227-P229 WeakPolarHBondContact O-CD 3.28Å; F227-P229 VanDerWaalsContact O-N 3.07Å; P229-R231 PolarHBondContact O-N 2.97Å | ||
| 230 | R | 46.8 | Very low | 56.8 | Low | 235 Ų | 235 | 141.9 Ų | 141.9 | 89% | 0.887 | 70% | 0.697 | S | S | * | * | trans | -52.8 | 107.7 | 167.1 | -169.5 | 177.6 | -170.4 | 174.5 | 2.4 | 105.1 | H228 E232 | H228-R230 PolarHBondContact O-N 2.88Å; R230-E232 VanDerWaalsContact C-N 3.32Å; R230-E232 PolarHBondContact O-N 2.76Å | ||
| 231 | R | 46 | Very low | 55.6 | Low | 240 Ų | 240 | 146.4 Ų | 146.4 | 91% | 0.906 | 71% | 0.714 | S | S | * | * | trans | -54.2 | 96.8 | -177.5 | -169.9 | -179.1 | -167.8 | -174.2 | 3.5 | 107.6 | P229 S233 | P229-R231 PolarHBondContact O-N 2.97Å; R231-S233 PolarHBondContact O-N 2.95Å | ||
| 232 | E | 44.6 | Very low | 54.2 | Low | 182 Ų | 182 | 149.9 Ų | 149.9 | 85% | 0.85 | 72% | 0.723 | S | S | * | * | trans | -62.8 | 100.3 | 178.4 | -88.2 | 168.3 | 162.8 | 0 | 0 | 107.9 | R230 H234 | R230-E232 VanDerWaalsContact C-N 3.32Å; R230-E232 PolarHBondContact O-N 2.76Å; E232-H234 PolarHBondContact O-N 2.93Å | ||
| 233 | S | 43.4 | Very low | 52.9 | Low | 116 Ų | 116 | 153.3 Ų | 153.3 | 81% | 0.811 | 73% | 0.734 | S | S | * | * | trans | -70.6 | 74.5 | 166.1 | 53.3 | 0 | 0 | 0 | 0 | 108.3 | R231 | R231-S233 PolarHBondContact O-N 2.95Š| ||
| 234 | H | 45.7 | Very low | 51.8 | Low | 155 Ų | 155 | 160.8 Ų | 160.8 | 72% | 0.718 | 77% | 0.767 | S | S | * | * | trans | -144.5 | 66.1 | 171.5 | -153.1 | -90.3 | 0 | 0 | 0 | 110.3 | E232 S236 | E232-H234 PolarHBondContact O-N 2.93Å; H234-S236 PolarHBondContact O-N 2.88Å | ||
| 235 | W | 50.2 | Low | 50.8 | Low | 253 Ų | 253 | 166.8 Ų | 166.8 | 96% | 0.958 | 78% | 0.782 | S | S | * | * | trans | -68.7 | 94 | 155.4 | -87.9 | 89 | 0 | 0 | 0 | 107.8 | R237 | W235-R237 PolarHBondContact O-N 3.36Š| ||
| 236 | S | 50.4 | Low | 49.4 | Very low | 77 Ų | 77 | 168.4 Ų | 168.4 | 54% | 0.538 | 79% | 0.787 | S | S | . | * | trans | -36.1 | 118.4 | 161.3 | 40.3 | 0 | 0 | 0 | 0 | 113 | H234 T238 | H234-S236 PolarHBondContact O-N 2.88Å; S236-T238 PolarHBondContact O-N 3.32Å | ||
| 237 | R | 48 | Very low | 48.4 | Very low | 235 Ų | 235 | 173.4 Ų | 173.4 | 89% | 0.887 | 80% | 0.796 | S | S | * | * | trans | -27.3 | 116 | 138.6 | -179.9 | -172.1 | -65.1 | 175.3 | -1.3 | 111.1 | W235 | W235-R237 PolarHBondContact O-N 3.36Š| ||
| 238 | T | 50 | Low | 47.8 | Very low | 126 Ų | 126 | 179.1 Ų | 179.1 | 77% | 0.773 | 82% | 0.823 | S | S | * | * | trans | 166.8 | 106.8 | 135.6 | 39.1 | 0 | 0 | 0 | 0 | 110.2 | S236 | S236-T238 PolarHBondContact O-N 3.32Š| ||
| 239 | R | 50.9 | Low | 47.6 | Very low | 242 Ų | 242 | 182.5 Ų | 182.5 | 91% | 0.913 | 84% | 0.839 | S | S | * | * | trans | -153.3 | 118.5 | 140.8 | -100.8 | -165.9 | -118.3 | -155.2 | 0.7 | 107.2 | ||||
| 240 | L | 44.4 | Very low | 47.3 | Very low | 248 Ų | 248 | 191.7 Ų | 191.7 | 100% | 1.298 | 87% | 0.867 | S | S | * | * | trans | 32.7 | 0 | 166 | -74 | 101.3 | 0 | 0 | 0 | 118.5 |
Retrieved 240 of 240 residues in 198.7 ms
(Link to these results)