| 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 | 63.7 | Low | 87 | Confident | 204 Ų | 204 | 123.2 Ų | 123.2 | 100% | 1.005 | 65% | 0.645 | S | S | * | * | 0 | -40.6 | 0 | -69 | -179.5 | 145.5 | 0 | 0 | 113.3 | Q3 S4 L5 | M1-Q3 PolarHBondContact O-N 2.9Å; M1-S4 PolarHBondContact O-N 3.42Å; M1-L5 PolarHBondContact O-N 2.72Å | |||
| 2 | W | 79.9 | Confident | 87.8 | Confident | 226 Ų | 226 | 120.2 Ų | 120.2 | 86% | 0.856 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -61.5 | -37.2 | 179.4 | -151.4 | -39.7 | 0 | 0 | 0 | 114.3 | S4 L5 G6 | W2-S4 PolarHBondContact O-N 2.75Å; W2-L5 WeakPolarHBondContact O-CB 3.44Å; W2-L5 PolarHBondContact O-N 3.06Å; W2-G6 PolarHBondContact O-N 3.28Å |
| 3 | Q | 79.7 | Confident | 88.5 | Confident | 166 Ų | 166 | 116.5 Ų | 116.5 | 78% | 0.776 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -64.3 | -40.5 | -179.9 | -67.6 | -177.6 | -56.4 | 0 | 0 | 113 | M1 L5 G6 L7 | M1-Q3 PolarHBondContact O-N 2.9Å; Q3-L5 VanDerWaalsContact C-N 3.3Å; Q3-L5 PolarHBondContact O-N 2.7Å; Q3-G6 PolarHBondContact O-N 3.38Å; Q3-L7 PolarHBondContact O-N 3.01Å |
| 4 | S | 85.5 | Confident | 89 | Confident | 75 Ų | 75 | 111.3 Ų | 111.3 | 52% | 0.524 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -64.3 | -37 | 176.3 | -46.7 | 0 | 0 | 0 | 0 | 111.7 | M1 W2 T8 | M1-S4 PolarHBondContact O-N 3.42Å; W2-S4 PolarHBondContact O-N 2.75Å; S4-T8 WeakPolarHBondContact O-CB 3.15Å; S4-T8 PolarHBondContact O-N 3.07Å; S4-T8 PolarHBondContact O-OG1 2.66Å |
| 5 | L | 89.2 | Confident | 89.5 | Confident | 121 Ų | 121 | 109.1 Ų | 109.1 | 63% | 0.634 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -65.3 | -44.6 | 174.4 | -70.4 | 164.6 | 0 | 0 | 0 | 111.4 | M1 W2 Q3 T8 L9 | M1-L5 PolarHBondContact O-N 2.72Å; W2-L5 WeakPolarHBondContact O-CB 3.44Å; W2-L5 PolarHBondContact O-N 3.06Å; Q3-L5 VanDerWaalsContact C-N 3.3Å; Q3-L5 PolarHBondContact O-N 2.7Å; L5-T8 PolarHBondContact O-N 3.41Å; L5-L9 WeakPolarHBondContact O-CB 3.19Å; L5-L9 PolarHBondContact O-N 2.68Å |
| 6 | G | 89.4 | Confident | 90 | Very high | 41 Ų | 41 | 109.3 Ų | 109.3 | 42% | 0.423 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -64.4 | -44.6 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | W2 Q3 L9 L10 | W2-G6 PolarHBondContact O-N 3.28Å; Q3-G6 PolarHBondContact O-N 3.38Å; G6-L9 PolarHBondContact O-N 3.4Å; G6-L10 WeakPolarHBondContact O-CB 2.95Å; G6-L10 PolarHBondContact O-N 3.14Å |
| 7 | L | 92.6 | Very high | 90.3 | Very high | 121 Ų | 121 | 108.1 Ų | 108.1 | 63% | 0.634 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -62 | -46.3 | 176.1 | -77.9 | 161.5 | 0 | 0 | 0 | 111.7 | Q3 L9 L10 V11 | Q3-L7 PolarHBondContact O-N 3.01Å; L7-L9 PolarHBondContact O-N 2.96Å; L7-L10 PolarHBondContact O-N 3.33Å; L7-V11 WeakPolarHBondContact O-CG2 3.16Å; L7-V11 PolarHBondContact O-N 2.82Å |
| 8 | T | 92.8 | Very high | 90.6 | Very high | 82 Ų | 82 | 106.8 Ų | 106.8 | 50% | 0.503 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -64.5 | -42.2 | 179 | -51.7 | 0 | 0 | 0 | 0 | 111 | S4 L5 V11 I12 | S4-T8 WeakPolarHBondContact O-CB 3.15Å; S4-T8 PolarHBondContact O-N 3.07Å; S4-T8 PolarHBondContact O-OG1 2.66Å; L5-T8 PolarHBondContact O-N 3.41Å; T8-V11 PolarHBondContact O-N 3.03Å; T8-I12 HydrophobicContact CG2-CD1 3.94Å; T8-I12 WeakPolarHBondContact O-CB 3.16Å; T8-I12 WeakPolarHBondContact O-CD1 3.39Å; T8-I12 WeakPolarHBondContact O-CG1 3.13Å; T8-I12 PolarHBondContact O-N 3.45Å |
| 9 | L | 94.5 | Very high | 90.9 | Very high | 113 Ų | 113 | 106.1 Ų | 106.1 | 59% | 0.592 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -66.4 | -39.4 | 179 | -159.6 | 146 | 0 | 0 | 0 | 111.4 | L5 G6 L7 I12 V13 | L5-L9 WeakPolarHBondContact O-CB 3.19Å; L5-L9 PolarHBondContact O-N 2.68Å; G6-L9 PolarHBondContact O-N 3.4Å; L7-L9 PolarHBondContact O-N 2.96Å; L9-I12 PolarHBondContact O-N 2.83Å; L9-V13 HydrophobicContact CD2-CG2 4.07Å; L9-V13 WeakPolarHBondContact O-CB 3.27Å; L9-V13 VanDerWaalsContact O-CG2 3.23Å; L9-V13 WeakPolarHBondContact O-CG2 3.32Å; L9-V13 PolarHBondContact O-N 3.39Å |
| 10 | L | 95.1 | Very high | 91.2 | Very high | 119 Ų | 119 | 105.7 Ų | 105.7 | 62% | 0.623 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -64.6 | -42.8 | 174.2 | -168.9 | 150.2 | 0 | 0 | 0 | 111.6 | G6 L7 V13 A14 | G6-L10 WeakPolarHBondContact O-CB 2.95Å; G6-L10 PolarHBondContact O-N 3.14Å; L7-L10 PolarHBondContact O-N 3.33Å; L10-V13 PolarHBondContact O-N 2.97Å; L10-A14 VanDerWaalsContact O-CB 3.24Å; L10-A14 WeakPolarHBondContact O-CB 2.84Å; L10-A14 PolarHBondContact O-N 3.2Å |
| 11 | V | 94.9 | Very high | 91.3 | Very high | 87 Ų | 87 | 105.6 Ų | 105.6 | 53% | 0.527 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -61.4 | -45.5 | 174.6 | 166.9 | 0 | 0 | 0 | 0 | 110.8 | L7 T8 V13 A14 T15 | L7-V11 WeakPolarHBondContact O-CG2 3.16Å; L7-V11 PolarHBondContact O-N 2.82Å; T8-V11 PolarHBondContact O-N 3.03Å; V11-V13 PolarHBondContact O-N 3.37Å; V11-A14 PolarHBondContact O-N 2.64Å; V11-T15 WeakPolarHBondContact O-CB 3.28Å; V11-T15 PolarHBondContact O-N 3.34Å; V11-T15 PolarHBondContact O-OG1 2.67Å |
| 12 | I | 95.8 | Very high | 92.8 | Very high | 87 Ų | 87 | 104 Ų | 104 | 45% | 0.446 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -58.4 | -50.7 | 176.7 | -71.2 | 164.7 | 0 | 0 | 0 | 110 | T8 L9 A14 T15 L16 | T8-I12 HydrophobicContact CG2-CD1 3.94Å; T8-I12 WeakPolarHBondContact O-CB 3.16Å; T8-I12 WeakPolarHBondContact O-CD1 3.39Å; T8-I12 WeakPolarHBondContact O-CG1 3.13Å; T8-I12 PolarHBondContact O-N 3.45Å; L9-I12 PolarHBondContact O-N 2.83Å; I12-A14 PolarHBondContact O-N 2.72Å; I12-T15 PolarHBondContact O-N 3.43Å; I12-L16 HydrophobicContact CG2-CD1 3.48Å; I12-L16 VanDerWaalsContact CG2-CD1 3.48Å; I12-L16 WeakPolarHBondContact O-CB 3.38Å; I12-L16 WeakPolarHBondContact O-CD1 3.29Å; I12-L16 PolarHBondContact O-N 2.64Å |
| 13 | V | 97 | Very high | 93.6 | Very high | 72 Ų | 72 | 98.8 Ų | 98.8 | 44% | 0.436 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -61.3 | -45 | 179.7 | 170.9 | 0 | 0 | 0 | 0 | 111.5 | L9 L10 V11 T15 L16 L17 | L9-V13 HydrophobicContact CD2-CG2 4.07Å; L9-V13 WeakPolarHBondContact O-CB 3.27Å; L9-V13 VanDerWaalsContact O-CG2 3.23Å; L9-V13 WeakPolarHBondContact O-CG2 3.32Å; L9-V13 PolarHBondContact O-N 3.39Å; L10-V13 PolarHBondContact O-N 2.97Å; V11-V13 PolarHBondContact O-N 3.37Å; V13-T15 VanDerWaalsContact C-N 3.34Å; V13-T15 PolarHBondContact O-N 2.75Å; V13-L16 PolarHBondContact O-N 2.82Å; V13-L17 HydrophobicContact CG1-CD1 4.04Å; V13-L17 WeakPolarHBondContact O-CB 3.31Å; V13-L17 PolarHBondContact O-N 3.32Å |
| 14 | A | 96.3 | Very high | 94.2 | Very high | 44 Ų | 44 | 94.1 Ų | 94.1 | 36% | 0.364 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61.8 | -43.1 | 177 | 0 | 0 | 0 | 0 | 0 | 111.5 | L10 V11 I12 L17 C18 | L10-A14 VanDerWaalsContact O-CB 3.24Å; L10-A14 WeakPolarHBondContact O-CB 2.84Å; L10-A14 PolarHBondContact O-N 3.2Å; V11-A14 PolarHBondContact O-N 2.64Å; I12-A14 PolarHBondContact O-N 2.72Å; A14-L17 PolarHBondContact O-N 3.02Å; A14-C18 WeakPolarHBondContact O-CB 3.05Å; A14-C18 PolarHBondContact O-N 3.24Å; A14-C18 PolarHBondContact O-SG 3.39Å; A14-C18 VanDerWaalsContact O-SG 3.42Å |
| 15 | T | 96.2 | Very high | 94.5 | Very high | 78 Ų | 78 | 97.6 Ų | 97.6 | 48% | 0.479 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.9 | -43.6 | 178.1 | -47.2 | 0 | 0 | 0 | 0 | 110.8 | V11 I12 V13 L17 C18 V19 | V11-T15 WeakPolarHBondContact O-CB 3.28Å; V11-T15 PolarHBondContact O-N 3.34Å; V11-T15 PolarHBondContact O-OG1 2.67Å; I12-T15 PolarHBondContact O-N 3.43Å; V13-T15 VanDerWaalsContact C-N 3.34Å; V13-T15 PolarHBondContact O-N 2.75Å; T15-L17 PolarHBondContact O-N 3.42Å; T15-C18 PolarHBondContact O-N 2.65Å; T15-V19 VanDerWaalsContact O-CG2 3.31Å; T15-V19 WeakPolarHBondContact O-CG2 2.94Å; T15-V19 PolarHBondContact O-N 2.75Å |
| 16 | L | 96.7 | Very high | 94.5 | Very high | 112 Ų | 112 | 93.7 Ų | 93.7 | 59% | 0.586 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -59.6 | -44.8 | 174.1 | -99.6 | 122.6 | 0 | 0 | 0 | 111.6 | I12 V13 V19 L20 | I12-L16 HydrophobicContact CG2-CD1 3.48Å; I12-L16 VanDerWaalsContact CG2-CD1 3.48Å; I12-L16 WeakPolarHBondContact O-CB 3.38Å; I12-L16 WeakPolarHBondContact O-CD1 3.29Å; I12-L16 PolarHBondContact O-N 2.64Å; V13-L16 PolarHBondContact O-N 2.82Å; L16-V19 PolarHBondContact O-N 3.43Å; L16-L20 WeakPolarHBondContact O-CB 3.33Å; L16-L20 PolarHBondContact O-N 3.49Å |
| 17 | L | 96.2 | Very high | 94.6 | Very high | 90 Ų | 90 | 99.3 Ų | 99.3 | 47% | 0.471 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -61.4 | -45.2 | 175 | -94.3 | 157.4 | 0 | 0 | 0 | 111.5 | V13 A14 T15 V19 L20 L21 | V13-L17 HydrophobicContact CG1-CD1 4.04Å; V13-L17 WeakPolarHBondContact O-CB 3.31Å; V13-L17 PolarHBondContact O-N 3.32Å; A14-L17 PolarHBondContact O-N 3.02Å; T15-L17 PolarHBondContact O-N 3.42Å; L17-V19 PolarHBondContact O-N 2.66Å; L17-L20 PolarHBondContact O-N 3.39Å; L17-L21 VanDerWaalsContact O-CB 3.26Å; L17-L21 WeakPolarHBondContact O-CB 3.21Å; L17-L21 WeakPolarHBondContact O-CG 3.33Å; L17-L21 PolarHBondContact O-N 3.45Å |
| 18 | C | 95.9 | Very high | 94.4 | Very high | 84 Ų | 84 | 99.2 Ų | 99.2 | 57% | 0.568 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -60 | -46.4 | 175.9 | -77.9 | 0 | 0 | 0 | 0 | 111.8 | A14 T15 L21 F22 | A14-C18 WeakPolarHBondContact O-CB 3.05Å; A14-C18 PolarHBondContact O-N 3.24Å; A14-C18 PolarHBondContact O-SG 3.39Å; A14-C18 VanDerWaalsContact O-SG 3.42Å; T15-C18 PolarHBondContact O-N 2.65Å; C18-L21 PolarHBondContact O-N 2.82Å; C18-F22 VanDerWaalsContact O-CB 3.25Å; C18-F22 WeakPolarHBondContact O-CB 3.2Å; C18-F22 PolarHBondContact O-N 2.8Å |
| 19 | V | 95.9 | Very high | 94.2 | Very high | 94 Ų | 94 | 98.4 Ų | 98.4 | 57% | 0.57 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -65.4 | -43 | 177.8 | 173.2 | 0 | 0 | 0 | 0 | 110.9 | T15 L16 L17 F22 M23 | T15-V19 VanDerWaalsContact O-CG2 3.31Å; T15-V19 WeakPolarHBondContact O-CG2 2.94Å; T15-V19 PolarHBondContact O-N 2.75Å; L16-V19 PolarHBondContact O-N 3.43Å; L17-V19 PolarHBondContact O-N 2.66Å; V19-F22 PolarHBondContact O-N 2.72Å; V19-M23 VanDerWaalsContact O-CB 3.24Å; V19-M23 WeakPolarHBondContact O-CB 3.35Å; V19-M23 PolarHBondContact O-N 2.87Å |
| 20 | L | 96.1 | Very high | 93.8 | Very high | 98 Ų | 98 | 97 Ų | 97 | 51% | 0.513 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.1 | -45.8 | 178.5 | -173.9 | 68.8 | 0 | 0 | 0 | 110.8 | L16 L17 M23 L24 | L16-L20 WeakPolarHBondContact O-CB 3.33Å; L16-L20 PolarHBondContact O-N 3.49Å; L17-L20 PolarHBondContact O-N 3.39Å; L20-M23 PolarHBondContact O-N 3.38Å; L20-L24 HydrophobicContact CD1-CD1 4.23Å; L20-L24 HydrophobicContact CG-CD1 4.49Å; L20-L24 VanDerWaalsContact O-CB 3.31Å; L20-L24 WeakPolarHBondContact O-CB 3.33Å; L20-L24 PolarHBondContact O-N 3.5Å |
| 21 | L | 94.9 | Very high | 93.3 | Very high | 104 Ų | 104 | 97.8 Ų | 97.8 | 55% | 0.545 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.6 | -44.3 | 175 | -74.6 | 173.9 | 0 | 0 | 0 | 111.1 | L17 C18 L24 F25 | L17-L21 VanDerWaalsContact O-CB 3.26Å; L17-L21 WeakPolarHBondContact O-CB 3.21Å; L17-L21 WeakPolarHBondContact O-CG 3.33Å; L17-L21 PolarHBondContact O-N 3.45Å; C18-L21 PolarHBondContact O-N 2.82Å; L21-L24 PolarHBondContact O-N 3.49Å; L21-F25 VanDerWaalsContact O-CB 3.3Å; L21-F25 WeakPolarHBondContact O-CB 3.3Å; L21-F25 PolarHBondContact O-N 3.26Å |
| 22 | F | 95.1 | Very high | 92.6 | Very high | 169 Ų | 169 | 99.2 Ų | 99.2 | 74% | 0.741 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -67.6 | -39.6 | 179.7 | -160.6 | -90.8 | 0 | 0 | 0 | 111.9 | C18 V19 F25 G26 | C18-F22 VanDerWaalsContact O-CB 3.25Å; C18-F22 WeakPolarHBondContact O-CB 3.2Å; C18-F22 PolarHBondContact O-N 2.8Å; V19-F22 PolarHBondContact O-N 2.72Å; F22-F25 PolarHBondContact O-N 3.5Å; F22-G26 PolarHBondContact O-N 2.75Å |
| 23 | M | 94.9 | Very high | 91.9 | Very high | 118 Ų | 118 | 100 Ų | 100 | 58% | 0.581 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -64.3 | -47.3 | 173.8 | -170.2 | -158.1 | 163.2 | 0 | 0 | 110.2 | V19 L20 W27 | V19-M23 VanDerWaalsContact O-CB 3.24Å; V19-M23 WeakPolarHBondContact O-CB 3.35Å; V19-M23 PolarHBondContact O-N 2.87Å; L20-M23 PolarHBondContact O-N 3.38Å; M23-W27 WeakPolarHBondContact O-CA 3.27Å; M23-W27 WeakPolarHBondContact O-CB 3.06Å; M23-W27 PolarHBondContact O-N 2.82Å |
| 24 | L | 92.4 | Very high | 90.8 | Very high | 67 Ų | 67 | 102.9 Ų | 102.9 | 35% | 0.351 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -60.3 | -45.9 | 173.8 | -106.4 | 64.5 | 0 | 0 | 0 | 110.5 | L20 L21 W27 Y28 | L20-L24 HydrophobicContact CD1-CD1 4.23Å; L20-L24 HydrophobicContact CG-CD1 4.49Å; L20-L24 VanDerWaalsContact O-CB 3.31Å; L20-L24 WeakPolarHBondContact O-CB 3.33Å; L20-L24 PolarHBondContact O-N 3.5Å; L21-L24 PolarHBondContact O-N 3.49Å; L24-W27 PolarHBondContact O-N 3.39Å; L24-Y28 HydrophobicContact CB-CD2 3.84Å; L24-Y28 HydrophobicContact CB-CE2 3.94Å; L24-Y28 HydrophobicContact CD2-CD2 4.39Å; L24-Y28 HydrophobicContact CD2-CE2 3.66Å; L24-Y28 HydrophobicContact CG-CD2 3.92Å; L24-Y28 HydrophobicContact CG-CE2 3.5Å; L24-Y28 VanDerWaalsContact CG-CE2 3.5Å; L24-Y28 WeakPolarHBondContact O-CA 3.29Å; L24-Y28 WeakPolarHBondContact O-CB 3.3Å; L24-Y28 WeakPolarHBondContact O-CD2 2.84Å; L24-Y28 PolarHBondContact O-N 2.77Å |
| 25 | F | 92.6 | Very high | 89.5 | Confident | 149 Ų | 149 | 105.1 Ų | 105.1 | 65% | 0.654 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -64.1 | -47.8 | -179.3 | -126.4 | -96.1 | 0 | 0 | 0 | 111.1 | L21 F22 W27 Y28 V29 | L21-F25 VanDerWaalsContact O-CB 3.3Å; L21-F25 WeakPolarHBondContact O-CB 3.3Å; L21-F25 PolarHBondContact O-N 3.26Å; F22-F25 PolarHBondContact O-N 3.5Å; F25-W27 VanDerWaalsContact C-N 3.35Å; F25-W27 PolarHBondContact O-N 3.47Å; F25-Y28 PolarHBondContact O-N 3.31Å; F25-V29 HydrophobicContact CD1-CG2 4.08Å; F25-V29 WeakPolarHBondContact O-CB 3.5Å; F25-V29 WeakPolarHBondContact O-CG2 3.3Å; F25-V29 PolarHBondContact O-N 2.84Å |
| 26 | G | 89.6 | Confident | 88.2 | Confident | 39 Ų | 39 | 104.2 Ų | 104.2 | 40% | 0.402 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -61.6 | -43.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | F22 V30 | F22-G26 PolarHBondContact O-N 2.75Å; G26-V30 VanDerWaalsContact O-CG2 3.28Å; G26-V30 WeakPolarHBondContact O-CG2 2.99Å; G26-V30 PolarHBondContact O-N 2.78Å |
| 27 | W | 90.3 | Very high | 86.6 | Confident | 159 Ų | 159 | 106.7 Ų | 106.7 | 60% | 0.602 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -65.3 | -46.2 | 176.3 | -178.5 | -94.8 | 0 | 0 | 0 | 112.4 | M23 L24 F25 V30 W31 | M23-W27 WeakPolarHBondContact O-CA 3.27Å; M23-W27 WeakPolarHBondContact O-CB 3.06Å; M23-W27 PolarHBondContact O-N 2.82Å; L24-W27 PolarHBondContact O-N 3.39Å; F25-W27 VanDerWaalsContact C-N 3.35Å; F25-W27 PolarHBondContact O-N 3.47Å; W27-V30 PolarHBondContact O-N 3.36Å; W27-W31 AromaticContact CD1-CE3 3.85Å; W27-W31 AromaticContact NE1-CE3 3.46Å; W27-W31 AromaticContact NE1-CZ3 3.89Å; W27-W31 WeakPolarHBondContact O-CB 3.1Å; W27-W31 PolarHBondContact O-N 2.8Å |
| 28 | Y | 89.4 | Confident | 84.9 | Confident | 119 Ų | 119 | 107.6 Ų | 107.6 | 47% | 0.467 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -69.3 | -33.7 | 178.1 | -84 | -64.6 | 0 | 0 | 0 | 111.5 | L24 F25 W31 Q32 | L24-Y28 HydrophobicContact CB-CD2 3.84Å; L24-Y28 HydrophobicContact CB-CE2 3.94Å; L24-Y28 HydrophobicContact CD2-CD2 4.39Å; L24-Y28 HydrophobicContact CD2-CE2 3.66Å; L24-Y28 HydrophobicContact CG-CD2 3.92Å; L24-Y28 HydrophobicContact CG-CE2 3.5Å; L24-Y28 VanDerWaalsContact CG-CE2 3.5Å; L24-Y28 WeakPolarHBondContact O-CA 3.29Å; L24-Y28 WeakPolarHBondContact O-CB 3.3Å; L24-Y28 WeakPolarHBondContact O-CD2 2.84Å; L24-Y28 PolarHBondContact O-N 2.77Å; F25-Y28 PolarHBondContact O-N 3.31Å; Y28-W31 HydrophobicContact CD1-CE3 4.21Å; Y28-W31 HydrophobicContact CE1-CE3 4.17Å; Y28-W31 HydrophobicContact CE1-CZ3 4.31Å; Y28-W31 CarbonylContact O-C 3.58Å; Y28-W31 PolarHBondContact O-N 3.42Å; Y28-Q32 WeakPolarHBondContact O-CA 3.4Å; Y28-Q32 WeakPolarHBondContact O-CB 3Å; Y28-Q32 WeakPolarHBondContact O-CG 3.25Å; Y28-Q32 PolarHBondContact O-N 3.26Å |
| 29 | V | 88 | Confident | 83.3 | Confident | 65 Ų | 65 | 108.3 Ų | 108.3 | 39% | 0.394 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -70.7 | -41.8 | 174.7 | 168.3 | 0 | 0 | 0 | 0 | 109.5 | F25 Q32 L33 | F25-V29 HydrophobicContact CD1-CG2 4.08Å; F25-V29 WeakPolarHBondContact O-CB 3.5Å; F25-V29 WeakPolarHBondContact O-CG2 3.3Å; F25-V29 PolarHBondContact O-N 2.84Å; V29-Q32 PolarHBondContact O-N 3.47Å; V29-L33 HydrophobicContact CG1-CD1 3.7Å; V29-L33 HydrophobicContact CG1-CG 4.15Å; V29-L33 WeakPolarHBondContact O-CB 3.18Å; V29-L33 WeakPolarHBondContact O-CG 3.01Å; V29-L33 PolarHBondContact O-N 2.83Å |
| 30 | V | 86.9 | Confident | 81.5 | Confident | 84 Ų | 84 | 111.5 Ų | 111.5 | 51% | 0.509 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -63.1 | -46.7 | 171.7 | 172.8 | 0 | 0 | 0 | 0 | 110.2 | G26 W27 Q32 L33 F34 | G26-V30 VanDerWaalsContact O-CG2 3.28Å; G26-V30 WeakPolarHBondContact O-CG2 2.99Å; G26-V30 PolarHBondContact O-N 2.78Å; W27-V30 PolarHBondContact O-N 3.36Å; V30-Q32 PolarHBondContact O-N 3.42Å; V30-L33 PolarHBondContact O-N 3.48Å; V30-F34 HydrophobicContact CG1-CD2 3.93Å; V30-F34 HydrophobicContact CG1-CE2 4.2Å; V30-F34 VanDerWaalsContact O-CB 3.31Å; V30-F34 WeakPolarHBondContact O-CB 3.1Å; V30-F34 WeakPolarHBondContact O-CD2 3.3Å; V30-F34 PolarHBondContact O-N 2.87Å |
| 31 | W | 84 | Confident | 80.1 | Confident | 134 Ų | 134 | 110.8 Ų | 110.8 | 51% | 0.508 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63 | -39.7 | 177.3 | -167.9 | -1.3 | 0 | 0 | 0 | 111.8 | W27 Y28 L35 | W27-W31 AromaticContact CD1-CE3 3.85Å; W27-W31 AromaticContact NE1-CE3 3.46Å; W27-W31 AromaticContact NE1-CZ3 3.89Å; W27-W31 WeakPolarHBondContact O-CB 3.1Å; W27-W31 PolarHBondContact O-N 2.8Å; Y28-W31 HydrophobicContact CD1-CE3 4.21Å; Y28-W31 HydrophobicContact CE1-CE3 4.17Å; Y28-W31 HydrophobicContact CE1-CZ3 4.31Å; Y28-W31 CarbonylContact O-C 3.58Å; Y28-W31 PolarHBondContact O-N 3.42Å; W31-L35 VanDerWaalsContact CD1-CD1 3.4Å; W31-L35 HydrophobicContact CG-CD1 4.36Å; W31-L35 VanDerWaalsContact O-CB 3.3Å; W31-L35 WeakPolarHBondContact O-CB 3.31Å; W31-L35 PolarHBondContact O-N 2.62Å |
| 32 | Q | 79.9 | Confident | 78.8 | Confident | 117 Ų | 117 | 115.3 Ų | 115.3 | 55% | 0.547 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -71.3 | -43.4 | 176 | -85.8 | -74.7 | -2.1 | 0 | 0 | 111.1 | Y28 V29 V30 F34 L35 S36 | Y28-Q32 WeakPolarHBondContact O-CA 3.4Å; Y28-Q32 WeakPolarHBondContact O-CB 3Å; Y28-Q32 WeakPolarHBondContact O-CG 3.25Å; Y28-Q32 PolarHBondContact O-N 3.26Å; V29-Q32 PolarHBondContact O-N 3.47Å; V30-Q32 PolarHBondContact O-N 3.42Å; Q32-F34 VanDerWaalsContact C-N 3.26Å; Q32-F34 PolarHBondContact O-N 3.37Å; Q32-L35 CarbonylContact O-C 3.55Å; Q32-L35 PolarHBondContact O-N 2.84Å; Q32-S36 VanDerWaalsContact O-CA 3.29Å; Q32-S36 WeakPolarHBondContact O-CA 3.31Å; Q32-S36 WeakPolarHBondContact O-CB 3.18Å; Q32-S36 PolarHBondContact O-N 3.48Å |
| 33 | L | 80.9 | Confident | 77.3 | Confident | 105 Ų | 105 | 112 Ų | 112 | 55% | 0.55 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -65.7 | -35.4 | 176.2 | -73.1 | 172.3 | 0 | 0 | 0 | 110.5 | V29 V30 K37 | V29-L33 HydrophobicContact CG1-CD1 3.7Å; V29-L33 HydrophobicContact CG1-CG 4.15Å; V29-L33 WeakPolarHBondContact O-CB 3.18Å; V29-L33 WeakPolarHBondContact O-CG 3.01Å; V29-L33 PolarHBondContact O-N 2.83Å; V30-L33 PolarHBondContact O-N 3.48Å; L33-K37 WeakPolarHBondContact O-CB 3.22Å; L33-K37 WeakPolarHBondContact O-CG 3.26Å; L33-K37 PolarHBondContact O-N 3.35Å |
| 34 | F | 74.8 | Confident | 75.9 | Confident | 131 Ų | 131 | 112.2 Ų | 112.2 | 58% | 0.575 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -63.8 | -59.5 | 168.3 | -96.1 | -94.8 | 0 | 0 | 0 | 110.8 | V30 Q32 S36 K37 F38 | V30-F34 HydrophobicContact CG1-CD2 3.93Å; V30-F34 HydrophobicContact CG1-CE2 4.2Å; V30-F34 VanDerWaalsContact O-CB 3.31Å; V30-F34 WeakPolarHBondContact O-CB 3.1Å; V30-F34 WeakPolarHBondContact O-CD2 3.3Å; V30-F34 PolarHBondContact O-N 2.87Å; Q32-F34 VanDerWaalsContact C-N 3.26Å; Q32-F34 PolarHBondContact O-N 3.37Å; F34-S36 PolarHBondContact O-N 3.37Å; F34-K37 PolarHBondContact O-N 2.86Å; F34-F38 HydrophobicContact CD1-CD2 4.35Å; F34-F38 HydrophobicContact CD1-CE2 4.02Å; F34-F38 WeakPolarHBondContact O-CB 3.34Å; F34-F38 WeakPolarHBondContact O-CD2 3.41Å; F34-F38 PolarHBondContact O-N 3.49Å |
| 35 | L | 70.1 | Confident | 74.4 | Confident | 92 Ų | 92 | 113.7 Ų | 113.7 | 48% | 0.482 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.2 | -23.9 | 179.9 | -87.2 | 167.4 | 0 | 0 | 0 | 114.4 | W31 Q32 F38 K39 | W31-L35 VanDerWaalsContact CD1-CD1 3.4Å; W31-L35 HydrophobicContact CG-CD1 4.36Å; W31-L35 VanDerWaalsContact O-CB 3.3Å; W31-L35 WeakPolarHBondContact O-CB 3.31Å; W31-L35 PolarHBondContact O-N 2.62Å; Q32-L35 CarbonylContact O-C 3.55Å; Q32-L35 PolarHBondContact O-N 2.84Å; L35-F38 CarbonylContact O-C 3.18Å; L35-K39 VanDerWaalsContact O-CA 3.3Å; L35-K39 WeakPolarHBondContact O-CA 3.16Å; L35-K39 VanDerWaalsContact O-CB 3.27Å; L35-K39 WeakPolarHBondContact O-CB 3.24Å; L35-K39 PolarHBondContact O-N 2.86Å |
| 36 | S | 67.9 | Low | 72.8 | Confident | 59 Ų | 59 | 108.6 Ų | 108.6 | 41% | 0.413 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -87.5 | -35.6 | -179.7 | -163.9 | 0 | 0 | 0 | 0 | 110.5 | Q32 F34 F38 K39 F40 | Q32-S36 VanDerWaalsContact O-CA 3.29Å; Q32-S36 WeakPolarHBondContact O-CA 3.31Å; Q32-S36 WeakPolarHBondContact O-CB 3.18Å; Q32-S36 PolarHBondContact O-N 3.48Å; F34-S36 PolarHBondContact O-N 3.37Å; S36-F38 VanDerWaalsContact C-N 3.32Å; S36-K39 VanDerWaalsContact O-CB 3.29Å; S36-K39 WeakPolarHBondContact O-CB 3.48Å; S36-K39 PolarHBondContact O-N 2.82Å; S36-F40 PolarHBondContact O-N 3.31Å |
| 37 | K | 63.6 | Low | 71.1 | Confident | 164 Ų | 164 | 112.8 Ų | 112.8 | 71% | 0.713 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -67.1 | -34 | 162.5 | -73.1 | -74 | 170.1 | 71.3 | 0 | 111.9 | L33 F34 K39 F40 | L33-K37 WeakPolarHBondContact O-CB 3.22Å; L33-K37 WeakPolarHBondContact O-CG 3.26Å; L33-K37 PolarHBondContact O-N 3.35Å; F34-K37 PolarHBondContact O-N 2.86Å; K37-K39 VanDerWaalsContact C-N 3.33Å; K37-F40 WeakPolarHBondContact O-CB 3.24Å |
| 38 | F | 60.1 | Low | 69.3 | Low | 109 Ų | 109 | 108.9 Ų | 108.9 | 48% | 0.478 | 54% | 0.543 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.8 | -4.4 | 167.4 | -79.9 | -87.2 | 0 | 0 | 0 | 113.1 | F34 L35 S36 F40 L41 R42 | F34-F38 HydrophobicContact CD1-CD2 4.35Å; F34-F38 HydrophobicContact CD1-CE2 4.02Å; F34-F38 WeakPolarHBondContact O-CB 3.34Å; F34-F38 WeakPolarHBondContact O-CD2 3.41Å; F34-F38 PolarHBondContact O-N 3.49Å; L35-F38 CarbonylContact O-C 3.18Å; S36-F38 VanDerWaalsContact C-N 3.32Å; F38-F40 VanDerWaalsContact C-N 3.31Å; F38-L41 VanDerWaalsContact C-N 3.32Å; F38-L41 HydrophobicContact CB-CB 4.28Å; F38-L41 HydrophobicContact CD1-CB 3.73Å; F38-L41 HydrophobicContact CD1-CD2 3.48Å; F38-L41 VanDerWaalsContact CD1-CD2 3.48Å; F38-L41 HydrophobicContact CD1-CG 4.16Å; F38-L41 HydrophobicContact CE1-CD2 3.52Å; F38-L41 HydrophobicContact CG-CB 4.36Å; F38-L41 CarbonylContact O-C 3.58Å; F38-L41 WeakPolarHBondContact O-CA 3.41Å; F38-L41 WeakPolarHBondContact O-CB 3.5Å; F38-L41 PolarHBondContact O-N 2.95Å; F38-R42 VanDerWaalsContact O-CB 3.3Å; F38-R42 WeakPolarHBondContact O-CB 3.34Å; F38-R42 PolarHBondContact O-N 3.34Å |
| 39 | K | 62.8 | Low | 67.4 | Low | 98 Ų | 98 | 106 Ų | 106 | 43% | 0.426 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -77.3 | -30.4 | 172 | -161.3 | -173.9 | 89.1 | 58.2 | 0 | 108.7 | L35 S36 K37 L41 R42 E43 | L35-K39 VanDerWaalsContact O-CA 3.3Å; L35-K39 WeakPolarHBondContact O-CA 3.16Å; L35-K39 VanDerWaalsContact O-CB 3.27Å; L35-K39 WeakPolarHBondContact O-CB 3.24Å; L35-K39 PolarHBondContact O-N 2.86Å; S36-K39 VanDerWaalsContact O-CB 3.29Å; S36-K39 WeakPolarHBondContact O-CB 3.48Å; S36-K39 PolarHBondContact O-N 2.82Å; K37-K39 VanDerWaalsContact C-N 3.33Å; K39-L41 VanDerWaalsContact C-N 3.34Å; K39-R42 CarbonylContact O-C 3.32Å; K39-R42 PolarHBondContact O-N 2.7Å; K39-E43 VanDerWaalsContact NZ-CD 3.28Å; K39-E43 IonicContact NZ-OE1 3.03Å; K39-E43 PolarHBondContact NZ-OE1 3.43Å; K39-E43 IonicContact NZ-OE2 2.82Å; K39-E43 PolarHBondContact NZ-OE2 2.92Å; K39-E43 VanDerWaalsContact O-CB 3.27Å; K39-E43 WeakPolarHBondContact O-CB 3.34Å; K39-E43 PolarHBondContact O-N 3.06Å; K39-E43 VanDerWaalsContact O-OE2 3.11Å |
| 40 | F | 57.1 | Low | 65.4 | Low | 161 Ų | 161 | 106.6 Ų | 106.6 | 71% | 0.706 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -63.2 | -35.2 | 159.2 | -113.9 | -85.5 | 0 | 0 | 0 | 112.8 | S36 K37 F38 L44 | S36-F40 PolarHBondContact O-N 3.31Å; K37-F40 WeakPolarHBondContact O-CB 3.24Å; F38-F40 VanDerWaalsContact C-N 3.31Å; F40-L44 WeakPolarHBondContact O-CB 3.37Å; F40-L44 PolarHBondContact O-N 3.47Å |
| 41 | L | 67.3 | Low | 63.6 | Low | 83 Ų | 83 | 108.3 Ų | 108.3 | 44% | 0.435 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -78.9 | -23.9 | 174 | -132.3 | 84.6 | 0 | 0 | 0 | 112.9 | F38 K39 V45 | F38-L41 VanDerWaalsContact C-N 3.32Å; F38-L41 HydrophobicContact CB-CB 4.28Å; F38-L41 HydrophobicContact CD1-CB 3.73Å; F38-L41 HydrophobicContact CD1-CD2 3.48Å; F38-L41 VanDerWaalsContact CD1-CD2 3.48Å; F38-L41 HydrophobicContact CD1-CG 4.16Å; F38-L41 HydrophobicContact CE1-CD2 3.52Å; F38-L41 HydrophobicContact CG-CB 4.36Å; F38-L41 CarbonylContact O-C 3.58Å; F38-L41 WeakPolarHBondContact O-CA 3.41Å; F38-L41 WeakPolarHBondContact O-CB 3.5Å; F38-L41 PolarHBondContact O-N 2.95Å; K39-L41 VanDerWaalsContact C-N 3.34Å; L41-V45 HydrophobicContact CG-CG2 4.43Å; L41-V45 WeakPolarHBondContact O-CA 3.33Å; L41-V45 WeakPolarHBondContact O-CB 3.23Å; L41-V45 WeakPolarHBondContact O-CG2 3.45Å; L41-V45 PolarHBondContact O-N 2.99Å |
| 42 | R | 67 | Low | 62 | Low | 199 Ų | 199 | 110.7 Ų | 110.7 | 75% | 0.751 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -89.4 | -23.5 | 175.5 | -179.7 | 172.9 | 139.9 | 147.8 | -3.8 | 110.9 | F38 K39 G46 | F38-R42 VanDerWaalsContact O-CB 3.3Å; F38-R42 WeakPolarHBondContact O-CB 3.34Å; F38-R42 PolarHBondContact O-N 3.34Å; K39-R42 CarbonylContact O-C 3.32Å; K39-R42 PolarHBondContact O-N 2.7Å; R42-G46 WeakPolarHBondContact O-CA 3.21Å; R42-G46 PolarHBondContact O-N 3.38Å |
| 43 | E | 64.4 | Low | 60.5 | Low | 101 Ų | 101 | 109.2 Ų | 109.2 | 47% | 0.472 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -69.9 | -49.7 | 155.5 | -93.4 | 147.5 | 164.3 | 0 | 0 | 108.7 | K39 V45 G46 D47 | K39-E43 VanDerWaalsContact NZ-CD 3.28Å; K39-E43 IonicContact NZ-OE1 3.03Å; K39-E43 PolarHBondContact NZ-OE1 3.43Å; K39-E43 IonicContact NZ-OE2 2.82Å; K39-E43 PolarHBondContact NZ-OE2 2.92Å; K39-E43 VanDerWaalsContact O-CB 3.27Å; K39-E43 WeakPolarHBondContact O-CB 3.34Å; K39-E43 PolarHBondContact O-N 3.06Å; K39-E43 VanDerWaalsContact O-OE2 3.11Å; E43-V45 PolarHBondContact O-N 3.37Å; E43-G46 PolarHBondContact O-N 2.91Å; E43-D47 VanDerWaalsContact O-CA 3.32Å; E43-D47 WeakPolarHBondContact O-CA 3.46Å; E43-D47 WeakPolarHBondContact O-CB 3.48Å; E43-D47 PolarHBondContact O-N 3.5Å |
| 44 | L | 64.1 | Low | 58.9 | Low | 122 Ų | 122 | 113.3 Ų | 113.3 | 64% | 0.639 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -69.1 | -35 | -179.6 | -153.8 | 74.7 | 0 | 0 | 0 | 114 | F40 A48 | F40-L44 WeakPolarHBondContact O-CB 3.37Å; F40-L44 PolarHBondContact O-N 3.47Å; L44-A48 WeakPolarHBondContact O-CB 3.19Å; L44-A48 PolarHBondContact O-N 3.46Å |
| 45 | V | 61.8 | Low | 57.5 | Low | 98 Ų | 98 | 113.4 Ų | 113.4 | 59% | 0.594 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -84.5 | -31.3 | 174.7 | 170.9 | 0 | 0 | 0 | 0 | 111.3 | L41 E43 G49 | L41-V45 HydrophobicContact CG-CG2 4.43Å; L41-V45 WeakPolarHBondContact O-CA 3.33Å; L41-V45 WeakPolarHBondContact O-CB 3.23Å; L41-V45 WeakPolarHBondContact O-CG2 3.45Å; L41-V45 PolarHBondContact O-N 2.99Å; E43-V45 PolarHBondContact O-N 3.37Å; V45-G49 PolarHBondContact O-N 2.89Å |
| 46 | G | 58.1 | Low | 55.8 | Low | 42 Ų | 42 | 120.4 Ų | 120.4 | 43% | 0.433 | 64% | 0.639 | S | S | . | * | H | α-helix | trans | -80.5 | -31.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | R42 E43 G49 | R42-G46 WeakPolarHBondContact O-CA 3.21Å; R42-G46 PolarHBondContact O-N 3.38Å; E43-G46 PolarHBondContact O-N 2.91Å; G46-G49 PolarHBondContact O-N 3.25Å |
| 47 | D | 53.9 | Low | 54.9 | Low | 126 Ų | 126 | 122.7 Ų | 122.7 | 67% | 0.674 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -80.5 | -31.5 | 170.7 | -152.7 | 41.1 | 0 | 0 | 0 | 110 | E43 G49 T50 | E43-D47 VanDerWaalsContact O-CA 3.32Å; E43-D47 WeakPolarHBondContact O-CA 3.46Å; E43-D47 WeakPolarHBondContact O-CB 3.48Å; E43-D47 PolarHBondContact O-N 3.5Å; D47-G49 PolarHBondContact O-N 3.42Å; D47-T50 CarbonylContact O-C 3.57Å; D47-T50 PolarHBondContact O-N 3.45Å; D47-T50 VanDerWaalsContact O-N 3.14Å |
| 48 | A | 52.8 | Low | 53.8 | Low | 77 Ų | 77 | 120.4 Ų | 120.4 | 64% | 0.636 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.5 | -11 | 163.8 | 0 | 0 | 0 | 0 | 0 | 114 | L44 T50 | L44-A48 WeakPolarHBondContact O-CB 3.19Å; L44-A48 PolarHBondContact O-N 3.46Å; A48-T50 VanDerWaalsContact C-N 3.28Å |
| 49 | G | 49.9 | Very low | 53 | Low | 58 Ų | 58 | 123.8 Ų | 123.8 | 60% | 0.598 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.2 | -9 | 168.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | V45 G46 D47 | V45-G49 PolarHBondContact O-N 2.89Å; G46-G49 PolarHBondContact O-N 3.25Å; D47-G49 PolarHBondContact O-N 3.42Å |
| 50 | T | 46.6 | Very low | 52 | Low | 78 Ų | 78 | 124.7 Ų | 124.7 | 48% | 0.479 | 69% | 0.69 | S | S | . | * | trans | -127.5 | 83.3 | 174.2 | -51.3 | 0 | 0 | 0 | 0 | 110.8 | D47 A48 Q52 A53 | D47-T50 CarbonylContact O-C 3.57Å; D47-T50 PolarHBondContact O-N 3.45Å; D47-T50 VanDerWaalsContact O-N 3.14Å; A48-T50 VanDerWaalsContact C-N 3.28Å; T50-Q52 PolarHBondContact O-N 3.43Å; T50-A53 HydrophobicContact CG2-CB 4.16Å | ||
| 51 | P | 48.9 | Very low | 51.2 | Low | 121 Ų | 121 | 125.7 Ų | 125.7 | 79% | 0.786 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.6 | 57 | 155.8 | 33 | -33.1 | 0 | 0 | 0 | 110 | ||
| 52 | Q | 49 | Very low | 49.9 | Very low | 184 Ų | 184 | 129.9 Ų | 129.9 | 86% | 0.86 | 71% | 0.714 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -170.7 | 36 | 171.7 | -133.9 | -173.3 | 92.4 | 0 | 0 | 119.7 | T50 | T50-Q52 PolarHBondContact O-N 3.43Š|
| 53 | A | 48.7 | Very low | 48.8 | Very low | 86 Ų | 86 | 126.1 Ų | 126.1 | 71% | 0.711 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -124.9 | 2.7 | 170 | 0 | 0 | 0 | 0 | 0 | 115.5 | T50 | T50-A53 HydrophobicContact CG2-CB 4.16Š|
| 54 | E | 47.4 | Very low | 47.9 | Very low | 191 Ų | 191 | 125.4 Ų | 125.4 | 89% | 0.893 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -135.4 | 69.7 | 168.1 | -91.3 | -167.4 | 86.4 | 0 | 0 | 110.8 | ||
| 55 | T | 45.6 | Very low | 46.5 | Very low | 133 Ų | 133 | 123.1 Ų | 123.1 | 82% | 0.816 | 73% | 0.732 | S | S | * | * | trans | -149.8 | 81.9 | 138.5 | -41.4 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 56 | R | 35 | Very low | 45.3 | Very low | 238 Ų | 238 | 123 Ų | 123 | 90% | 0.898 | 74% | 0.742 | S | S | * | * | -152.2 | 117.7 | 123.1 | -114.1 | -174.8 | 162 | -173.8 | -6.8 | 110 | |||||
| 57 | P | 47.9 | Very low | 45.3 | Very low | 107 Ų | 107 | 126.7 Ų | 126.7 | 70% | 0.695 | 76% | 0.758 | S | S | * | * | trans | -69.1 | 159.8 | 177.9 | 31.2 | -34.2 | 0 | 0 | 0 | 110.3 | ||||
| 58 | S | 41 | Very low | 44.8 | Very low | 116 Ų | 116 | 127.3 Ų | 127.3 | 81% | 0.811 | 77% | 0.766 | S | S | * | * | trans | 107 | 107 | 169.3 | -53.3 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 59 | E | 43.1 | Very low | 44.7 | Very low | 180 Ų | 180 | 133.7 Ų | 133.7 | 84% | 0.841 | 77% | 0.774 | S | S | * | * | trans | 2.2 | 139.7 | 131.7 | -130.1 | 149.2 | 77.3 | 0 | 0 | 114.9 | ||||
| 60 | P | 41.3 | Very low | 44.8 | Very low | 118 Ų | 118 | 136.1 Ų | 136.1 | 77% | 0.766 | 78% | 0.777 | S | S | * | * | -151.8 | -179.1 | 52 | 36.6 | -12.5 | 0 | 0 | 0 | 116.7 | |||||
| 61 | E | 42.3 | Very low | 44.6 | Very low | 181 Ų | 181 | 142.9 Ų | 142.9 | 85% | 0.846 | 79% | 0.794 | S | S | * | * | trans | -53.3 | 158.4 | 176.4 | -56.6 | 173.3 | 95.6 | 0 | 0 | 115.1 | ||||
| 62 | H | 39.9 | Very low | 44.1 | Very low | 172 Ų | 172 | 143.3 Ų | 143.3 | 80% | 0.796 | 79% | 0.79 | S | S | * | * | trans | -30.1 | 150.4 | 171.9 | -129.3 | -16.9 | 0 | 0 | 0 | 115.9 | A64 | H62-A64 PolarHBondContact CE1-N 3.41Å; H62-A64 PolarHBondContact ND1-N 3.01Å | ||
| 63 | P | 44 | Very low | 44.2 | Very low | 119 Ų | 119 | 145.4 Ų | 145.4 | 77% | 0.773 | 79% | 0.79 | S | S | * | * | -142.4 | 158.9 | 65.5 | 30.5 | -8.6 | 0 | 0 | 0 | 116.1 | |||||
| 64 | A | 45 | Very low | 44.3 | Very low | 87 Ų | 87 | 147 Ų | 147 | 72% | 0.719 | 79% | 0.791 | S | S | * | * | trans | 23.2 | 129.2 | 144.5 | 0 | 0 | 0 | 0 | 0 | 120.6 | H62 | H62-A64 PolarHBondContact CE1-N 3.41Å; H62-A64 PolarHBondContact ND1-N 3.01Å | ||
| 65 | G | 33.3 | Very low | 44.4 | Very low | 73 Ų | 73 | 142.1 Ų | 142.1 | 75% | 0.753 | 78% | 0.783 | S | S | * | * | trans | 125.2 | 98.5 | 132.9 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 66 | A | 38.1 | Very low | 44.7 | Very low | 96 Ų | 96 | 147.2 Ų | 147.2 | 79% | 0.793 | 79% | 0.787 | S | S | * | * | trans | 76 | 148.5 | 140.5 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 67 | P | 57.3 | Low | 45.6 | Very low | 119 Ų | 119 | 145.3 Ų | 145.3 | 77% | 0.773 | 79% | 0.789 | S | S | * | * | trans | -99.6 | 131.3 | -157.5 | 35.3 | -24.4 | 0 | 0 | 0 | 111 | ||||
| 68 | T | 42.7 | Very low | 45.8 | Very low | 139 Ų | 139 | 151 Ų | 151 | 85% | 0.853 | 80% | 0.796 | S | S | * | * | trans | -110.5 | 74.8 | 171.2 | -34.5 | 0 | 0 | 0 | 0 | 110.5 | T70 | T68-T70 PolarHBondContact O-N 3.28Š| ||
| 69 | R | 51.3 | Low | 45.9 | Very low | 212 Ų | 212 | 151 Ų | 151 | 80% | 0.8 | 79% | 0.791 | S | S | * | * | trans | -51.1 | 126.5 | 154.5 | 174.5 | -177.9 | 168.6 | 147.9 | -1.7 | 108.5 | ||||
| 70 | T | 53.4 | Low | 46.1 | Very low | 108 Ų | 108 | 146 Ų | 146 | 66% | 0.663 | 78% | 0.776 | S | S | * | * | trans | 59.5 | 135.2 | 158.3 | 57.8 | 0 | 0 | 0 | 0 | 117.1 | T68 | T68-T70 PolarHBondContact O-N 3.28Š| ||
| 71 | R | 41.7 | Very low | 46.3 | Very low | 220 Ų | 220 | 149.2 Ų | 149.2 | 83% | 0.83 | 78% | 0.778 | S | S | * | * | 157.7 | 95.6 | 129.2 | -165.6 | 154.2 | -172.4 | 148.1 | -2.3 | 107.6 | |||||
| 72 | N | 39 | Very low | 46.9 | Very low | 131 Ų | 131 | 145.9 Ų | 145.9 | 70% | 0.701 | 77% | 0.772 | S | S | * | * | 67.3 | 112.8 | 107.3 | -53.9 | -1.8 | 0 | 0 | 0 | 112.7 | |||||
| 73 | R | 49.4 | Very low | 47.3 | Very low | 228 Ų | 228 | 146 Ų | 146 | 86% | 0.86 | 77% | 0.773 | S | S | * | * | 61.7 | 134.7 | 118.8 | -154.1 | 177 | 175.1 | 116.5 | -3.2 | 116.9 | |||||
| 74 | T | 50.6 | Low | 47.6 | Very low | 119 Ų | 119 | 144.2 Ų | 144.2 | 73% | 0.73 | 76% | 0.763 | S | S | * | * | trans | 80.7 | 124.1 | 151.3 | 21.2 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 75 | A | 49.9 | Very low | 47.6 | Very low | 88 Ų | 88 | 147 Ų | 147 | 73% | 0.727 | 77% | 0.766 | S | S | * | * | trans | 72 | 82.8 | 133 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 76 | R | 52.8 | Low | 48 | Very low | 241 Ų | 241 | 155.3 Ų | 155.3 | 91% | 0.909 | 79% | 0.792 | S | S | * | * | trans | 174.8 | 111 | 137.8 | -106.3 | 169.8 | 174.7 | -140.3 | 0.4 | 110.8 | ||||
| 77 | Q | 53.5 | Low | 48.5 | Very low | 197 Ų | 197 | 158.3 Ų | 158.3 | 92% | 0.921 | 79% | 0.792 | S | S | * | * | trans | -176 | 52.4 | 137.6 | -105.4 | 173.3 | -20.7 | 0 | 0 | 107.6 | ||||
| 78 | R | 51.7 | Low | 48 | Very low | 228 Ų | 228 | 160.3 Ų | 160.3 | 86% | 0.86 | 79% | 0.793 | S | S | * | * | -20.1 | 139.7 | 112.8 | -141.1 | -178 | -156.2 | -112.1 | 3.7 | 114.7 | |||||
| 79 | V | 43.8 | Very low | 48.3 | Very low | 115 Ų | 115 | 161.5 Ų | 161.5 | 70% | 0.697 | 79% | 0.79 | S | S | * | * | trans | 94.7 | 84.7 | 162.2 | -168.9 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 80 | S | 47.5 | Very low | 48.1 | Very low | 75 Ų | 75 | 158.5 Ų | 158.5 | 52% | 0.524 | 79% | 0.789 | S | S | . | * | 73.5 | 131.8 | 108.1 | 66.6 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 81 | F | 44.4 | Very low | 47.8 | Very low | 186 Ų | 186 | 161.7 Ų | 161.7 | 82% | 0.816 | 80% | 0.797 | S | S | * | * | -169.7 | -162 | 65.3 | -73.6 | -88 | 0 | 0 | 0 | 108.4 | |||||
| 82 | P | 55.2 | Low | 48.2 | Very low | 111 Ų | 111 | 157.8 Ų | 157.8 | 72% | 0.721 | 80% | 0.795 | S | S | * | * | -118.8 | -179 | -84.9 | 36.5 | -18.6 | 0 | 0 | 0 | 112.6 | |||||
| 83 | E | 49.3 | Very low | 48.9 | Very low | 174 Ų | 174 | 159.7 Ų | 159.7 | 81% | 0.813 | 80% | 0.801 | S | S | * | * | trans | 91.8 | 121 | 146.9 | -130 | -174.8 | 92.6 | 0 | 0 | 121.7 | ||||
| 84 | S | 49 | Very low | 48.8 | Very low | 81 Ų | 81 | 154.5 Ų | 154.5 | 57% | 0.566 | 80% | 0.797 | S | S | * | * | trans | 78.7 | 130.5 | 138.6 | 64.6 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 85 | N | 45.5 | Very low | 48.7 | Very low | 147 Ų | 147 | 157.4 Ų | 157.4 | 79% | 0.786 | 80% | 0.802 | S | S | * | * | trans | 96.6 | 91.2 | 154.1 | -49.5 | -59 | 0 | 0 | 0 | 117.2 | ||||
| 86 | L | 41.5 | Very low | 48.6 | Very low | 246 Ų | 246 | 163.7 Ų | 163.7 | 100% | 1.288 | 81% | 0.809 | S | S | * | * | -179.9 | 0 | 83.8 | -150.1 | 91.4 | 0 | 0 | 0 | 110.2 |
Retrieved 86 of 86 residues in 174.5 ms
(Link to these results)