| 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 | 63.2 | Low | 86.9 | Confident | 203 Ų | 203 | 124.5 Ų | 124.5 | 100% | 1 | 65% | 0.649 | S | S | * | * | 0 | -45.1 | 0 | -73.1 | 165.9 | 147.9 | 0 | 0 | 112.9 | H3 N4 | M1-H3 VanDerWaalsContact C-N 3.29Å; M1-H3 PolarHBondContact O-N 2.88Å; M1-N4 PolarHBondContact O-N 3.39Å | |||
| 2 | W | 77.2 | Confident | 87.7 | Confident | 233 Ų | 233 | 125.4 Ų | 125.4 | 88% | 0.883 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -56.3 | -33.1 | 178.8 | -93 | 74.9 | 0 | 0 | 0 | 115.9 | N4 V5 G6 | W2-N4 PolarHBondContact O-N 2.88Å; W2-V5 PolarHBondContact O-N 3.47Å; W2-G6 PolarHBondContact O-N 2.88Å |
| 3 | H | 79.4 | Confident | 88.4 | Confident | 161 Ų | 161 | 121.2 Ų | 121.2 | 75% | 0.745 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -62.5 | -43.1 | -179.9 | -119.6 | 102.1 | 0 | 0 | 0 | 113.2 | M1 G6 L7 | M1-H3 VanDerWaalsContact C-N 3.29Å; M1-H3 PolarHBondContact O-N 2.88Å; H3-G6 PolarHBondContact O-N 3.45Å; H3-L7 PolarHBondContact O-N 3.24Å |
| 4 | N | 87.1 | Confident | 89 | Confident | 116 Ų | 116 | 115.6 Ų | 115.6 | 62% | 0.62 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -68.1 | -39.7 | 178.7 | -64.4 | -41.7 | 0 | 0 | 0 | 110.8 | M1 W2 G6 L7 T8 | M1-N4 PolarHBondContact O-N 3.39Å; W2-N4 PolarHBondContact O-N 2.88Å; N4-G6 VanDerWaalsContact C-N 3.35Å; N4-G6 PolarHBondContact O-N 2.57Å; N4-L7 PolarHBondContact O-N 2.99Å; N4-T8 PolarHBondContact O-N 3.32Å; N4-T8 PolarHBondContact O-OG1 3.31Å |
| 5 | V | 90.8 | Very high | 89.5 | Confident | 90 Ų | 90 | 112.9 Ų | 112.9 | 55% | 0.545 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -61.6 | -43.7 | 176.4 | -179.4 | 0 | 0 | 0 | 0 | 111 | W2 T8 L9 | W2-V5 PolarHBondContact O-N 3.47Å; V5-T8 PolarHBondContact O-N 2.68Å; V5-L9 WeakPolarHBondContact O-CB 3.26Å; V5-L9 PolarHBondContact O-N 3.04Å |
| 6 | G | 90.3 | Very high | 89.9 | Confident | 42 Ų | 42 | 111.8 Ų | 111.8 | 43% | 0.433 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -62.4 | -43 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | W2 H3 N4 L9 L10 | W2-G6 PolarHBondContact O-N 2.88Å; H3-G6 PolarHBondContact O-N 3.45Å; N4-G6 VanDerWaalsContact C-N 3.35Å; N4-G6 PolarHBondContact O-N 2.57Å; G6-L9 PolarHBondContact O-N 3.37Å; G6-L10 VanDerWaalsContact O-CB 3.28Å; G6-L10 WeakPolarHBondContact O-CB 3.4Å; G6-L10 PolarHBondContact O-N 3.43Å |
| 7 | L | 91.9 | Very high | 90.3 | Very high | 111 Ų | 111 | 110.8 Ų | 110.8 | 58% | 0.581 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -62.8 | -46.4 | 177.2 | -131.6 | 85.2 | 0 | 0 | 0 | 111.7 | H3 N4 L10 V11 | H3-L7 PolarHBondContact O-N 3.24Å; N4-L7 PolarHBondContact O-N 2.99Å; L7-L10 PolarHBondContact O-N 2.92Å; L7-V11 WeakPolarHBondContact O-CG2 3.16Å; L7-V11 PolarHBondContact O-N 3.36Å |
| 8 | T | 92.4 | Very high | 90.7 | Very high | 98 Ų | 98 | 109.8 Ų | 109.8 | 60% | 0.601 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -65.9 | -40.5 | 179.6 | -44.6 | 0 | 0 | 0 | 0 | 111.4 | N4 V5 V11 F12 | N4-T8 PolarHBondContact O-N 3.32Å; N4-T8 PolarHBondContact O-OG1 3.31Å; V5-T8 PolarHBondContact O-N 2.68Å; T8-V11 PolarHBondContact O-N 2.88Å; T8-F12 WeakPolarHBondContact O-CB 3.2Å; T8-F12 PolarHBondContact O-N 2.85Å |
| 9 | L | 93.9 | Very high | 90.9 | Very high | 110 Ų | 110 | 108.7 Ų | 108.7 | 58% | 0.576 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -67.8 | -40 | 178.5 | -164.5 | 140.5 | 0 | 0 | 0 | 111.4 | V5 G6 F12 V13 | V5-L9 WeakPolarHBondContact O-CB 3.26Å; V5-L9 PolarHBondContact O-N 3.04Å; G6-L9 PolarHBondContact O-N 3.37Å; L9-F12 PolarHBondContact O-N 2.92Å; L9-V13 HydrophobicContact CD2-CG2 4.22Å; L9-V13 VanDerWaalsContact O-CG2 3.29Å; L9-V13 WeakPolarHBondContact O-CG2 3.47Å; L9-V13 PolarHBondContact O-N 2.77Å |
| 10 | L | 94.8 | Very high | 91.2 | Very high | 119 Ų | 119 | 108.7 Ų | 108.7 | 62% | 0.623 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -61.3 | -45.4 | 173.5 | -175 | 72.5 | 0 | 0 | 0 | 111.5 | G6 L7 F12 V13 A14 | G6-L10 VanDerWaalsContact O-CB 3.28Å; G6-L10 WeakPolarHBondContact O-CB 3.4Å; G6-L10 PolarHBondContact O-N 3.43Å; L7-L10 PolarHBondContact O-N 2.92Å; L10-F12 VanDerWaalsContact C-N 3.32Å; L10-F12 PolarHBondContact O-N 2.95Å; L10-V13 PolarHBondContact O-N 2.85Å; L10-A14 VanDerWaalsContact O-CB 3.25Å; L10-A14 WeakPolarHBondContact O-CB 3.17Å; L10-A14 PolarHBondContact O-N 2.94Å |
| 11 | V | 94.9 | Very high | 91.4 | Very high | 87 Ų | 87 | 107.9 Ų | 107.9 | 53% | 0.527 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -62.9 | -40.6 | 177.1 | 167.2 | 0 | 0 | 0 | 0 | 111.3 | L7 T8 A14 T15 | L7-V11 WeakPolarHBondContact O-CG2 3.16Å; L7-V11 PolarHBondContact O-N 3.36Å; T8-V11 PolarHBondContact O-N 2.88Å; V11-A14 PolarHBondContact O-N 3.45Å; V11-T15 VanDerWaalsContact O-CB 3.29Å; V11-T15 WeakPolarHBondContact O-CB 3.09Å; V11-T15 PolarHBondContact O-N 2.78Å; V11-T15 PolarHBondContact O-OG1 2.97Å |
| 12 | F | 96.3 | Very high | 92.8 | Very high | 135 Ų | 135 | 103.9 Ų | 103.9 | 59% | 0.592 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -63.4 | -47.8 | 177.2 | -171.8 | -102.8 | 0 | 0 | 0 | 111.4 | T8 L9 L10 T15 L16 | T8-F12 WeakPolarHBondContact O-CB 3.2Å; T8-F12 PolarHBondContact O-N 2.85Å; L9-F12 PolarHBondContact O-N 2.92Å; L10-F12 VanDerWaalsContact C-N 3.32Å; L10-F12 PolarHBondContact O-N 2.95Å; F12-T15 PolarHBondContact O-N 2.78Å; F12-L16 HydrophobicContact CD1-CD1 3.69Å; F12-L16 HydrophobicContact CD1-CG 4.43Å; F12-L16 HydrophobicContact CE1-CD1 3.38Å; F12-L16 HydrophobicContact CE1-CG 4.21Å; F12-L16 HydrophobicContact CZ-CD1 4.02Å; F12-L16 HydrophobicContact CZ-CG 4.47Å; F12-L16 WeakPolarHBondContact O-CB 3.01Å; F12-L16 WeakPolarHBondContact O-CG 3.3Å; F12-L16 PolarHBondContact O-N 2.73Å |
| 13 | V | 97.1 | Very high | 93.6 | Very high | 71 Ų | 71 | 98 Ų | 98 | 43% | 0.43 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -61.7 | -46.4 | 175.8 | 172.3 | 0 | 0 | 0 | 0 | 110.9 | L9 L10 T15 L16 L17 | L9-V13 HydrophobicContact CD2-CG2 4.22Å; L9-V13 VanDerWaalsContact O-CG2 3.29Å; L9-V13 WeakPolarHBondContact O-CG2 3.47Å; L9-V13 PolarHBondContact O-N 2.77Å; L10-V13 PolarHBondContact O-N 2.85Å; V13-T15 VanDerWaalsContact C-N 3.32Å; V13-T15 PolarHBondContact O-N 2.86Å; V13-L16 PolarHBondContact O-N 3.19Å; V13-L17 WeakPolarHBondContact O-CB 3.37Å; V13-L17 PolarHBondContact O-N 2.76Å |
| 14 | A | 96.3 | Very high | 94.2 | Very high | 43 Ų | 43 | 92.9 Ų | 92.9 | 36% | 0.355 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.5 | -42.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | L10 V11 L17 I18 | L10-A14 VanDerWaalsContact O-CB 3.25Å; L10-A14 WeakPolarHBondContact O-CB 3.17Å; L10-A14 PolarHBondContact O-N 2.94Å; V11-A14 PolarHBondContact O-N 3.45Å; A14-L17 PolarHBondContact O-N 2.7Å; A14-I18 WeakPolarHBondContact O-CB 3.2Å; A14-I18 WeakPolarHBondContact O-CD1 3.37Å; A14-I18 WeakPolarHBondContact O-CG1 3.25Å; A14-I18 PolarHBondContact O-N 3.48Å |
| 15 | T | 96.3 | Very high | 94.3 | Very high | 75 Ų | 75 | 90.7 Ų | 90.7 | 46% | 0.46 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -65.6 | -44.9 | 178.2 | -57.4 | 0 | 0 | 0 | 0 | 111.2 | V11 F12 V13 L17 I18 V19 | V11-T15 VanDerWaalsContact O-CB 3.29Å; V11-T15 WeakPolarHBondContact O-CB 3.09Å; V11-T15 PolarHBondContact O-N 2.78Å; V11-T15 PolarHBondContact O-OG1 2.97Å; F12-T15 PolarHBondContact O-N 2.78Å; V13-T15 VanDerWaalsContact C-N 3.32Å; V13-T15 PolarHBondContact O-N 2.86Å; T15-L17 VanDerWaalsContact C-N 3.3Å; T15-L17 PolarHBondContact O-N 3.39Å; T15-I18 PolarHBondContact O-N 2.9Å; T15-V19 HydrophobicContact CG2-CG2 4.48Å; T15-V19 WeakPolarHBondContact O-CB 3.45Å; T15-V19 VanDerWaalsContact O-CG2 3.29Å; T15-V19 WeakPolarHBondContact O-CG2 3.35Å; T15-V19 PolarHBondContact O-N 2.86Å |
| 16 | L | 97 | Very high | 94.2 | Very high | 95 Ų | 95 | 88.2 Ų | 88.2 | 50% | 0.497 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -58.7 | -42.9 | 173.9 | -77.5 | 172.9 | 0 | 0 | 0 | 111.8 | F12 V13 V19 L20 | F12-L16 HydrophobicContact CD1-CD1 3.69Å; F12-L16 HydrophobicContact CD1-CG 4.43Å; F12-L16 HydrophobicContact CE1-CD1 3.38Å; F12-L16 HydrophobicContact CE1-CG 4.21Å; F12-L16 HydrophobicContact CZ-CD1 4.02Å; F12-L16 HydrophobicContact CZ-CG 4.47Å; F12-L16 WeakPolarHBondContact O-CB 3.01Å; F12-L16 WeakPolarHBondContact O-CG 3.3Å; F12-L16 PolarHBondContact O-N 2.73Å; V13-L16 PolarHBondContact O-N 3.19Å; L16-V19 PolarHBondContact O-N 3.47Å; L16-L20 VanDerWaalsContact O-CB 3.25Å; L16-L20 WeakPolarHBondContact O-CB 3.43Å; L16-L20 PolarHBondContact O-N 3.39Å |
| 17 | L | 96.8 | Very high | 94.1 | Very high | 94 Ų | 94 | 93.4 Ų | 93.4 | 49% | 0.492 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -66.4 | -41.8 | 179.5 | -147.2 | 166.2 | 0 | 0 | 0 | 110.7 | V13 A14 T15 L20 L21 | V13-L17 WeakPolarHBondContact O-CB 3.37Å; V13-L17 PolarHBondContact O-N 2.76Å; A14-L17 PolarHBondContact O-N 2.7Å; T15-L17 VanDerWaalsContact C-N 3.3Å; T15-L17 PolarHBondContact O-N 3.39Å; L17-L20 PolarHBondContact O-N 2.79Å; L17-L21 HydrophobicContact CD2-CD1 3.34Å; L17-L21 HydrophobicContact CD2-CG 3.85Å; L17-L21 VanDerWaalsContact O-CB 3.28Å; L17-L21 WeakPolarHBondContact O-CB 3.14Å; L17-L21 VanDerWaalsContact O-CG 3.31Å; L17-L21 WeakPolarHBondContact O-CG 3.37Å; L17-L21 PolarHBondContact O-N 3.06Å |
| 18 | I | 96.1 | Very high | 94 | Very high | 93 Ų | 93 | 95.4 Ų | 95.4 | 48% | 0.477 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.2 | -46.1 | 174.3 | -68.7 | 162.2 | 0 | 0 | 0 | 110.7 | A14 T15 L20 L21 L22 | A14-I18 WeakPolarHBondContact O-CB 3.2Å; A14-I18 WeakPolarHBondContact O-CD1 3.37Å; A14-I18 WeakPolarHBondContact O-CG1 3.25Å; A14-I18 PolarHBondContact O-N 3.48Å; T15-I18 PolarHBondContact O-N 2.9Å; I18-L20 VanDerWaalsContact C-N 3.32Å; I18-L20 PolarHBondContact O-N 2.74Å; I18-L21 PolarHBondContact O-N 3.03Å; I18-L22 HydrophobicContact CG2-CD1 4.01Å; I18-L22 HydrophobicContact CG2-CG 4.27Å; I18-L22 WeakPolarHBondContact O-CB 3.46Å; I18-L22 VanDerWaalsContact O-CG 3.29Å; I18-L22 WeakPolarHBondContact O-CG 3.08Å; I18-L22 PolarHBondContact O-N 2.8Å |
| 19 | V | 96.1 | Very high | 93.7 | Very high | 89 Ų | 89 | 97.1 Ų | 97.1 | 54% | 0.539 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.9 | -43.5 | 177.5 | 170.3 | 0 | 0 | 0 | 0 | 110.6 | T15 L16 L22 M23 | T15-V19 HydrophobicContact CG2-CG2 4.48Å; T15-V19 WeakPolarHBondContact O-CB 3.45Å; T15-V19 VanDerWaalsContact O-CG2 3.29Å; T15-V19 WeakPolarHBondContact O-CG2 3.35Å; T15-V19 PolarHBondContact O-N 2.86Å; L16-V19 PolarHBondContact O-N 3.47Å; V19-L22 PolarHBondContact O-N 2.84Å; V19-M23 VanDerWaalsContact O-CB 3.3Å; V19-M23 WeakPolarHBondContact O-CB 3.05Å; V19-M23 PolarHBondContact O-N 3.38Å |
| 20 | L | 96.2 | Very high | 93.3 | Very high | 109 Ų | 109 | 96.1 Ų | 96.1 | 57% | 0.571 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -61.7 | -47.4 | 176 | -175.4 | 66.7 | 0 | 0 | 0 | 111 | L16 L17 I18 L22 M23 V24 | L16-L20 VanDerWaalsContact O-CB 3.25Å; L16-L20 WeakPolarHBondContact O-CB 3.43Å; L16-L20 PolarHBondContact O-N 3.39Å; L17-L20 PolarHBondContact O-N 2.79Å; I18-L20 VanDerWaalsContact C-N 3.32Å; I18-L20 PolarHBondContact O-N 2.74Å; L20-L22 VanDerWaalsContact C-N 3.35Å; L20-L22 PolarHBondContact O-N 2.68Å; L20-M23 PolarHBondContact O-N 3.2Å; L20-V24 HydrophobicContact CD1-CG2 4.33Å; L20-V24 HydrophobicContact CG-CG2 4.46Å; L20-V24 VanDerWaalsContact O-CB 3.28Å; L20-V24 WeakPolarHBondContact O-CB 3.06Å; L20-V24 WeakPolarHBondContact O-CG2 3.41Å; L20-V24 PolarHBondContact O-N 3.46Å |
| 21 | L | 95.1 | Very high | 92.8 | Very high | 91 Ų | 91 | 97.9 Ų | 97.9 | 48% | 0.476 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -59.3 | -43.8 | 175 | -82.2 | 162.7 | 0 | 0 | 0 | 111.5 | L17 I18 V24 C25 | L17-L21 HydrophobicContact CD2-CD1 3.34Å; L17-L21 HydrophobicContact CD2-CG 3.85Å; L17-L21 VanDerWaalsContact O-CB 3.28Å; L17-L21 WeakPolarHBondContact O-CB 3.14Å; L17-L21 VanDerWaalsContact O-CG 3.31Å; L17-L21 WeakPolarHBondContact O-CG 3.37Å; L17-L21 PolarHBondContact O-N 3.06Å; I18-L21 PolarHBondContact O-N 3.03Å; L21-V24 PolarHBondContact O-N 3.26Å; L21-C25 WeakPolarHBondContact O-CA 3.17Å; L21-C25 WeakPolarHBondContact O-CB 3.12Å; L21-C25 PolarHBondContact O-N 3.3Å; L21-C25 PolarHBondContact O-SG 2.86Å |
| 22 | L | 93.2 | Very high | 92.2 | Very high | 120 Ų | 120 | 99.6 Ų | 99.6 | 63% | 0.628 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -68 | -35.7 | 178.3 | -73.3 | 179.3 | 0 | 0 | 0 | 112.1 | I18 V19 L20 G26 | I18-L22 HydrophobicContact CG2-CD1 4.01Å; I18-L22 HydrophobicContact CG2-CG 4.27Å; I18-L22 WeakPolarHBondContact O-CB 3.46Å; I18-L22 VanDerWaalsContact O-CG 3.29Å; I18-L22 WeakPolarHBondContact O-CG 3.08Å; I18-L22 PolarHBondContact O-N 2.8Å; V19-L22 PolarHBondContact O-N 2.84Å; L20-L22 VanDerWaalsContact C-N 3.35Å; L20-L22 PolarHBondContact O-N 2.68Å; L22-G26 WeakPolarHBondContact O-CA 3.2Å; L22-G26 PolarHBondContact O-N 3.31Å |
| 23 | M | 94.8 | Very high | 91.3 | Very high | 109 Ų | 109 | 96.3 Ų | 96.3 | 54% | 0.537 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -66.8 | -46.2 | 176.7 | -163.7 | -86.2 | 148 | 0 | 0 | 110.6 | V19 L20 W27 | V19-M23 VanDerWaalsContact O-CB 3.3Å; V19-M23 WeakPolarHBondContact O-CB 3.05Å; V19-M23 PolarHBondContact O-N 3.38Å; L20-M23 PolarHBondContact O-N 3.2Å; M23-W27 HydrophobicContact CE-CE3 3.59Å; M23-W27 HydrophobicContact CE-CZ3 4.06Å; M23-W27 WeakPolarHBondContact O-CB 3.45Å; M23-W27 PolarHBondContact O-N 2.77Å; M23-W27 HydrophobicContact SD-CE3 4.46Å |
| 24 | V | 91.4 | Very high | 90 | Very high | 53 Ų | 53 | 99.2 Ų | 99.2 | 32% | 0.321 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -70 | -45.1 | 178.6 | 174.3 | 0 | 0 | 0 | 0 | 111.1 | L20 L21 W27 Y28 | L20-V24 HydrophobicContact CD1-CG2 4.33Å; L20-V24 HydrophobicContact CG-CG2 4.46Å; L20-V24 VanDerWaalsContact O-CB 3.28Å; L20-V24 WeakPolarHBondContact O-CB 3.06Å; L20-V24 WeakPolarHBondContact O-CG2 3.41Å; L20-V24 PolarHBondContact O-N 3.46Å; L21-V24 PolarHBondContact O-N 3.26Å; V24-W27 PolarHBondContact O-N 3.3Å; V24-Y28 HydrophobicContact CB-CD2 4.47Å; V24-Y28 HydrophobicContact CB-CE2 4.5Å; V24-Y28 HydrophobicContact CG1-CD2 3.33Å; V24-Y28 HydrophobicContact CG1-CE2 3.12Å; V24-Y28 WeakPolarHBondContact O-CB 3.43Å; V24-Y28 WeakPolarHBondContact O-CD2 3.35Å; V24-Y28 PolarHBondContact O-N 3.3Å |
| 25 | C | 89.4 | Confident | 88.8 | Confident | 71 Ų | 71 | 102.5 Ų | 102.5 | 48% | 0.48 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.5 | -43.1 | 173.4 | -79.5 | 0 | 0 | 0 | 0 | 111.4 | L21 W27 Y28 F29 | L21-C25 WeakPolarHBondContact O-CA 3.17Å; L21-C25 WeakPolarHBondContact O-CB 3.12Å; L21-C25 PolarHBondContact O-N 3.3Å; L21-C25 PolarHBondContact O-SG 2.86Å; C25-W27 VanDerWaalsContact C-N 3.33Å; C25-W27 PolarHBondContact O-N 2.79Å; C25-Y28 PolarHBondContact O-N 2.7Å; C25-F29 WeakPolarHBondContact O-CA 3.28Å; C25-F29 WeakPolarHBondContact O-CB 3.22Å; C25-F29 PolarHBondContact O-N 2.92Å |
| 26 | G | 88.6 | Confident | 87.5 | Confident | 38 Ų | 38 | 101.4 Ų | 101.4 | 39% | 0.392 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.5 | -43.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | L22 V30 | L22-G26 WeakPolarHBondContact O-CA 3.2Å; L22-G26 PolarHBondContact O-N 3.31Å; G26-V30 VanDerWaalsContact O-CG2 3.3Å; G26-V30 WeakPolarHBondContact O-CG2 3.49Å; G26-V30 PolarHBondContact O-N 3.38Å |
| 27 | W | 88.3 | Confident | 86 | Confident | 151 Ų | 151 | 103 Ų | 103 | 57% | 0.572 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -61.9 | -54.6 | 173 | -173.7 | -49.2 | 0 | 0 | 0 | 111.8 | M23 V24 C25 F29 V30 W31 | M23-W27 HydrophobicContact CE-CE3 3.59Å; M23-W27 HydrophobicContact CE-CZ3 4.06Å; M23-W27 WeakPolarHBondContact O-CB 3.45Å; M23-W27 PolarHBondContact O-N 2.77Å; M23-W27 HydrophobicContact SD-CE3 4.46Å; V24-W27 PolarHBondContact O-N 3.3Å; C25-W27 VanDerWaalsContact C-N 3.33Å; C25-W27 PolarHBondContact O-N 2.79Å; W27-F29 VanDerWaalsContact C-N 3.27Å; W27-F29 PolarHBondContact O-N 3.46Å; W27-V30 PolarHBondContact O-N 2.92Å; W27-W31 AromaticContact NE1-CE3 3.46Å; W27-W31 AromaticContact NE1-CZ3 3.86Å; W27-W31 WeakPolarHBondContact O-CB 3.3Å; W27-W31 PolarHBondContact O-N 3.39Å |
| 28 | Y | 89 | Confident | 84.6 | Confident | 152 Ų | 152 | 104.7 Ų | 104.7 | 60% | 0.596 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -63.1 | -35.3 | -179.5 | -79.3 | -60 | 0 | 0 | 0 | 111.5 | V24 C25 W31 H32 | V24-Y28 HydrophobicContact CB-CD2 4.47Å; V24-Y28 HydrophobicContact CB-CE2 4.5Å; V24-Y28 HydrophobicContact CG1-CD2 3.33Å; V24-Y28 HydrophobicContact CG1-CE2 3.12Å; V24-Y28 WeakPolarHBondContact O-CB 3.43Å; V24-Y28 WeakPolarHBondContact O-CD2 3.35Å; V24-Y28 PolarHBondContact O-N 3.3Å; C25-Y28 PolarHBondContact O-N 2.7Å; Y28-W31 PolarHBondContact O-N 2.88Å; Y28-H32 WeakPolarHBondContact O-CA 3.43Å; Y28-H32 WeakPolarHBondContact O-CB 3.42Å; Y28-H32 PolarHBondContact O-N 3.42Å |
| 29 | F | 86.9 | Confident | 83.2 | Confident | 135 Ų | 135 | 106.4 Ų | 106.4 | 59% | 0.592 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -70.2 | -40.1 | -180 | -163 | -107.6 | 0 | 0 | 0 | 110.6 | C25 W27 L33 | C25-F29 WeakPolarHBondContact O-CA 3.28Å; C25-F29 WeakPolarHBondContact O-CB 3.22Å; C25-F29 PolarHBondContact O-N 2.92Å; W27-F29 VanDerWaalsContact C-N 3.27Å; W27-F29 PolarHBondContact O-N 3.46Å; F29-L33 HydrophobicContact CD1-CD1 3.36Å; F29-L33 HydrophobicContact CD1-CG 3.9Å; F29-L33 HydrophobicContact CE1-CD1 3.14Å; F29-L33 HydrophobicContact CE1-CD2 4.35Å; F29-L33 HydrophobicContact CE1-CG 3.8Å; F29-L33 HydrophobicContact CE2-CG 4.41Å; F29-L33 HydrophobicContact CG-CD1 4.21Å; F29-L33 HydrophobicContact CG-CG 4.27Å; F29-L33 HydrophobicContact CZ-CD1 3.82Å; F29-L33 HydrophobicContact CZ-CD2 4.19Å; F29-L33 HydrophobicContact CZ-CG 4.05Å; F29-L33 WeakPolarHBondContact O-CA 3.3Å; F29-L33 WeakPolarHBondContact O-CB 3Å; F29-L33 WeakPolarHBondContact O-CG 2.95Å; F29-L33 PolarHBondContact O-N 3.31Å |
| 30 | V | 85.6 | Confident | 81.6 | Confident | 89 Ų | 89 | 108.7 Ų | 108.7 | 54% | 0.539 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -63 | -47.8 | 170.9 | 172.7 | 0 | 0 | 0 | 0 | 110.3 | G26 W27 H32 F34 | G26-V30 VanDerWaalsContact O-CG2 3.3Å; G26-V30 WeakPolarHBondContact O-CG2 3.49Å; G26-V30 PolarHBondContact O-N 3.38Å; W27-V30 PolarHBondContact O-N 2.92Å; V30-H32 PolarHBondContact O-N 3.34Å; V30-F34 HydrophobicContact CG1-CD2 4.12Å; V30-F34 HydrophobicContact CG1-CE2 4.45Å; V30-F34 VanDerWaalsContact O-CB 3.3Å; V30-F34 WeakPolarHBondContact O-CB 3.39Å; V30-F34 WeakPolarHBondContact O-CD2 3.09Å; V30-F34 PolarHBondContact O-N 3.41Å |
| 31 | W | 83.4 | Confident | 80.2 | Confident | 155 Ų | 155 | 108 Ų | 108 | 59% | 0.587 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -59.3 | -46.5 | 177.5 | -170.6 | -49.3 | 0 | 0 | 0 | 111.8 | W27 Y28 F34 L35 | W27-W31 AromaticContact NE1-CE3 3.46Å; W27-W31 AromaticContact NE1-CZ3 3.86Å; W27-W31 WeakPolarHBondContact O-CB 3.3Å; W27-W31 PolarHBondContact O-N 3.39Å; Y28-W31 PolarHBondContact O-N 2.88Å; W31-F34 PolarHBondContact O-N 2.73Å; W31-L35 VanDerWaalsContact CD1-CD1 3.42Å; W31-L35 PolarHBondContact O-N 3.31Å |
| 32 | H | 81.6 | Confident | 78.9 | Confident | 124 Ų | 124 | 113.4 Ų | 113.4 | 57% | 0.574 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -78.5 | -36.1 | -173.6 | -162.8 | -62.9 | 0 | 0 | 0 | 111.5 | Y28 V30 F34 S36 | Y28-H32 WeakPolarHBondContact O-CA 3.43Å; Y28-H32 WeakPolarHBondContact O-CB 3.42Å; Y28-H32 PolarHBondContact O-N 3.42Å; V30-H32 PolarHBondContact O-N 3.34Å; H32-F34 VanDerWaalsContact C-N 3.34Å; H32-S36 PolarHBondContact CE1-OG 2.93Å; H32-S36 PolarHBondContact ND1-OG 2.86Å; H32-S36 WeakPolarHBondContact O-CA 3.39Å; H32-S36 WeakPolarHBondContact O-CB 3.36Å; H32-S36 PolarHBondContact O-N 3.45Å; H32-S36 PolarHBondContact O-OG 2.86Å |
| 33 | L | 78.1 | Confident | 77.6 | Confident | 65 Ų | 65 | 112.4 Ų | 112.4 | 34% | 0.34 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -66.1 | -39.1 | 169.2 | -77.9 | 179.6 | 0 | 0 | 0 | 110.8 | F29 K37 | F29-L33 HydrophobicContact CD1-CD1 3.36Å; F29-L33 HydrophobicContact CD1-CG 3.9Å; F29-L33 HydrophobicContact CE1-CD1 3.14Å; F29-L33 HydrophobicContact CE1-CD2 4.35Å; F29-L33 HydrophobicContact CE1-CG 3.8Å; F29-L33 HydrophobicContact CE2-CG 4.41Å; F29-L33 HydrophobicContact CG-CD1 4.21Å; F29-L33 HydrophobicContact CG-CG 4.27Å; F29-L33 HydrophobicContact CZ-CD1 3.82Å; F29-L33 HydrophobicContact CZ-CD2 4.19Å; F29-L33 HydrophobicContact CZ-CG 4.05Å; F29-L33 WeakPolarHBondContact O-CA 3.3Å; F29-L33 WeakPolarHBondContact O-CB 3Å; F29-L33 WeakPolarHBondContact O-CG 2.95Å; F29-L33 PolarHBondContact O-N 3.31Å; L33-K37 HydrophobicContact CD2-CG 4.5Å; L33-K37 WeakPolarHBondContact O-CA 3.25Å; L33-K37 WeakPolarHBondContact O-CB 3.16Å; L33-K37 WeakPolarHBondContact O-CG 3.28Å; L33-K37 PolarHBondContact O-N 3.46Å |
| 34 | F | 70.6 | Confident | 76.2 | Confident | 133 Ų | 133 | 112 Ų | 112 | 58% | 0.583 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -64 | -49.7 | 175.3 | -100.9 | -96 | 0 | 0 | 0 | 111.4 | V30 W31 H32 F38 | V30-F34 HydrophobicContact CG1-CD2 4.12Å; V30-F34 HydrophobicContact CG1-CE2 4.45Å; V30-F34 VanDerWaalsContact O-CB 3.3Å; V30-F34 WeakPolarHBondContact O-CB 3.39Å; V30-F34 WeakPolarHBondContact O-CD2 3.09Å; V30-F34 PolarHBondContact O-N 3.41Å; W31-F34 PolarHBondContact O-N 2.73Å; H32-F34 VanDerWaalsContact C-N 3.34Å; F34-F38 AromaticContact CD1-CD2 3.94Å; F34-F38 HydrophobicContact CD1-CD2 3.94Å; F34-F38 AromaticContact CD1-CE2 3.71Å; F34-F38 HydrophobicContact CD1-CE2 3.71Å; F34-F38 HydrophobicContact CE1-CD2 4.46Å; F34-F38 AromaticContact CE1-CE2 3.79Å; F34-F38 HydrophobicContact CE1-CE2 3.79Å; F34-F38 VanDerWaalsContact O-CB 3.26Å; F34-F38 WeakPolarHBondContact O-CB 3.05Å; F34-F38 WeakPolarHBondContact O-CD2 3.47Å; F34-F38 PolarHBondContact O-N 3.47Å |
| 35 | L | 70 | Confident | 74.9 | Confident | 111 Ų | 111 | 114.2 Ų | 114.2 | 58% | 0.581 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -66.5 | -45.5 | 178.1 | -76.6 | 176.1 | 0 | 0 | 0 | 112.6 | W31 K39 | W31-L35 VanDerWaalsContact CD1-CD1 3.42Å; W31-L35 PolarHBondContact O-N 3.31Å; L35-K39 WeakPolarHBondContact O-CB 3.21Å; L35-K39 PolarHBondContact O-N 2.92Å |
| 36 | S | 68.6 | Low | 73.4 | Confident | 53 Ų | 53 | 112.6 Ų | 112.6 | 37% | 0.371 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -71.7 | -40.3 | -179.1 | -62.6 | 0 | 0 | 0 | 0 | 112.3 | H32 F40 | H32-S36 PolarHBondContact CE1-OG 2.93Å; H32-S36 PolarHBondContact ND1-OG 2.86Å; H32-S36 WeakPolarHBondContact O-CA 3.39Å; H32-S36 WeakPolarHBondContact O-CB 3.36Å; H32-S36 PolarHBondContact O-N 3.45Å; H32-S36 PolarHBondContact O-OG 2.86Å; S36-F40 WeakPolarHBondContact O-CB 3.39Å; S36-F40 PolarHBondContact O-N 3.43Å |
| 37 | K | 67.3 | Low | 71.8 | Confident | 127 Ų | 127 | 115.7 Ų | 115.7 | 55% | 0.552 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -73.3 | -33.4 | 176.2 | -70 | -74.4 | 176.5 | 72.8 | 0 | 112.4 | L33 L41 | L33-K37 HydrophobicContact CD2-CG 4.5Å; L33-K37 WeakPolarHBondContact O-CA 3.25Å; L33-K37 WeakPolarHBondContact O-CB 3.16Å; L33-K37 WeakPolarHBondContact O-CG 3.28Å; L33-K37 PolarHBondContact O-N 3.46Å; K37-L41 WeakPolarHBondContact O-CA 3.05Å; K37-L41 WeakPolarHBondContact O-CB 3.42Å; K37-L41 PolarHBondContact O-N 2.84Å |
| 38 | F | 66.1 | Low | 70.2 | Confident | 131 Ų | 131 | 112.9 Ų | 112.9 | 58% | 0.575 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -75.1 | -31 | 171.3 | -88.7 | -91.6 | 0 | 0 | 0 | 112.9 | F34 R42 | F34-F38 AromaticContact CD1-CD2 3.94Å; F34-F38 HydrophobicContact CD1-CD2 3.94Å; F34-F38 AromaticContact CD1-CE2 3.71Å; F34-F38 HydrophobicContact CD1-CE2 3.71Å; F34-F38 HydrophobicContact CE1-CD2 4.46Å; F34-F38 AromaticContact CE1-CE2 3.79Å; F34-F38 HydrophobicContact CE1-CE2 3.79Å; F34-F38 VanDerWaalsContact O-CB 3.26Å; F34-F38 WeakPolarHBondContact O-CB 3.05Å; F34-F38 WeakPolarHBondContact O-CD2 3.47Å; F34-F38 PolarHBondContact O-N 3.47Å; F38-R42 WeakPolarHBondContact O-CB 3.29Å; F38-R42 PolarHBondContact O-N 3Å |
| 39 | K | 67.6 | Low | 68.4 | Low | 128 Ų | 128 | 108.1 Ų | 108.1 | 56% | 0.557 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -68.1 | -44.7 | 171.6 | -155.7 | -177.4 | 88.4 | 62.8 | 0 | 110.3 | L35 R42 E43 | L35-K39 WeakPolarHBondContact O-CB 3.21Å; L35-K39 PolarHBondContact O-N 2.92Å; K39-R42 PolarHBondContact O-N 2.81Å; K39-E43 IonicContact NZ-OE1 2.8Å; K39-E43 IonicContact NZ-OE2 3.85Å; K39-E43 PolarHBondContact NZ-OE2 2.9Å; K39-E43 WeakPolarHBondContact O-CB 3.49Å; K39-E43 PolarHBondContact O-N 3.45Å |
| 40 | F | 61.3 | Low | 66.6 | Low | 138 Ų | 138 | 106.3 Ų | 106.3 | 61% | 0.605 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -73.5 | -34 | 177.7 | -145.3 | -87.5 | 0 | 0 | 0 | 113.2 | S36 L44 | S36-F40 WeakPolarHBondContact O-CB 3.39Å; S36-F40 PolarHBondContact O-N 3.43Å; F40-L44 WeakPolarHBondContact O-CB 3.29Å; F40-L44 PolarHBondContact O-N 3.32Å |
| 41 | L | 66.3 | Low | 64.9 | Low | 95 Ų | 95 | 109.5 Ų | 109.5 | 50% | 0.497 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -69.7 | -38.2 | 170 | -107.7 | 66 | 0 | 0 | 0 | 110.7 | K37 E43 L44 V45 | K37-L41 WeakPolarHBondContact O-CA 3.05Å; K37-L41 WeakPolarHBondContact O-CB 3.42Å; K37-L41 PolarHBondContact O-N 2.84Å; L41-E43 VanDerWaalsContact C-N 3.33Å; L41-L44 PolarHBondContact O-N 3.38Å; L41-V45 WeakPolarHBondContact O-CA 3.48Å; L41-V45 WeakPolarHBondContact O-CB 3.39Å; L41-V45 WeakPolarHBondContact O-CG2 3.33Å; L41-V45 PolarHBondContact O-N 2.93Å |
| 42 | R | 69.3 | Low | 63.2 | Low | 204 Ų | 204 | 110.4 Ų | 110.4 | 77% | 0.77 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -73.1 | -29.6 | 177.5 | -176.1 | 152.1 | 63.6 | 146.5 | -0.3 | 112.3 | F38 K39 G46 | F38-R42 WeakPolarHBondContact O-CB 3.29Å; F38-R42 PolarHBondContact O-N 3Å; K39-R42 PolarHBondContact O-N 2.81Å; R42-G46 WeakPolarHBondContact O-CA 3.29Å; R42-G46 PolarHBondContact O-N 3.35Å |
| 43 | E | 65.9 | Low | 61.7 | Low | 99 Ų | 99 | 106.9 Ų | 106.9 | 46% | 0.463 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -74.7 | -39.7 | 172.6 | -155.8 | 153.9 | -165.7 | 0 | 0 | 109.7 | K39 L41 D47 | K39-E43 IonicContact NZ-OE1 2.8Å; K39-E43 IonicContact NZ-OE2 3.85Å; K39-E43 PolarHBondContact NZ-OE2 2.9Å; K39-E43 WeakPolarHBondContact O-CB 3.49Å; K39-E43 PolarHBondContact O-N 3.45Å; L41-E43 VanDerWaalsContact C-N 3.33Å; E43-D47 VanDerWaalsContact O-CB 3.22Å; E43-D47 WeakPolarHBondContact O-CB 3.44Å; E43-D47 PolarHBondContact O-N 3.47Å |
| 44 | L | 64.7 | Low | 60.1 | Low | 101 Ų | 101 | 111.5 Ų | 111.5 | 53% | 0.529 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -78.3 | -42.8 | 177 | -163.8 | 70.6 | 0 | 0 | 0 | 113.8 | F40 L41 T48 | F40-L44 WeakPolarHBondContact O-CB 3.29Å; F40-L44 PolarHBondContact O-N 3.32Å; L41-L44 PolarHBondContact O-N 3.38Å; L44-T48 VanDerWaalsContact O-CB 3.25Å; L44-T48 WeakPolarHBondContact O-CB 3.19Å; L44-T48 WeakPolarHBondContact O-CG2 3.48Å; L44-T48 PolarHBondContact O-N 3.34Å; L44-T48 PolarHBondContact O-OG1 3.49Å |
| 45 | V | 64.3 | Low | 58.8 | Low | 98 Ų | 98 | 112.6 Ų | 112.6 | 59% | 0.594 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -71.3 | -31.9 | 172.8 | 169.7 | 0 | 0 | 0 | 0 | 110.9 | L41 T48 G49 | L41-V45 WeakPolarHBondContact O-CA 3.48Å; L41-V45 WeakPolarHBondContact O-CB 3.39Å; L41-V45 WeakPolarHBondContact O-CG2 3.33Å; L41-V45 PolarHBondContact O-N 2.93Å; V45-T48 WeakPolarHBondContact CA-OG1 3.28Å; V45-G49 PolarHBondContact O-N 3.25Å |
| 46 | G | 57.1 | Low | 57.2 | Low | 37 Ų | 37 | 115.4 Ų | 115.4 | 38% | 0.381 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -74.3 | -42.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113 | R42 S50 | R42-G46 WeakPolarHBondContact O-CA 3.29Å; R42-G46 PolarHBondContact O-N 3.35Å; G46-S50 PolarHBondContact O-N 2.97Å |
| 47 | D | 55.4 | Low | 56.4 | Low | 103 Ų | 103 | 116.5 Ų | 116.5 | 55% | 0.551 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -79.5 | -21.9 | 176.2 | -83.8 | -17.4 | 0 | 0 | 0 | 113.3 | E43 Q51 | E43-D47 VanDerWaalsContact O-CB 3.22Å; E43-D47 WeakPolarHBondContact O-CB 3.44Å; E43-D47 PolarHBondContact O-N 3.47Å; D47-Q51 WeakPolarHBondContact O-CB 3.31Å; D47-Q51 PolarHBondContact O-N 3.4Å |
| 48 | T | 54.8 | Low | 55.3 | Low | 92 Ų | 92 | 115.7 Ų | 115.7 | 56% | 0.564 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -83.2 | -19.5 | 172.9 | 51.8 | 0 | 0 | 0 | 0 | 113.8 | L44 V45 | L44-T48 VanDerWaalsContact O-CB 3.25Å; L44-T48 WeakPolarHBondContact O-CB 3.19Å; L44-T48 WeakPolarHBondContact O-CG2 3.48Å; L44-T48 PolarHBondContact O-N 3.34Å; L44-T48 PolarHBondContact O-OG1 3.49Å; V45-T48 WeakPolarHBondContact CA-OG1 3.28Å |
| 49 | G | 52 | Low | 54 | Low | 53 Ų | 53 | 113 Ų | 113 | 55% | 0.546 | 63% | 0.628 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -89.4 | -8.7 | 172.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | V45 | V45-G49 PolarHBondContact O-N 3.25Š|
| 50 | S | 49 | Very low | 52.4 | Low | 97 Ų | 97 | 112.3 Ų | 112.3 | 68% | 0.678 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.2 | -2.4 | -177.5 | -167.7 | 0 | 0 | 0 | 0 | 114.5 | G46 | G46-S50 PolarHBondContact O-N 2.97Š|
| 51 | Q | 48.5 | Very low | 51.5 | Low | 155 Ų | 155 | 114.3 Ų | 114.3 | 72% | 0.724 | 65% | 0.651 | S | S | * | * | S | Bend | trans | -102.6 | 22.6 | 174.3 | -147.7 | -179 | 110.4 | 0 | 0 | 113.1 | D47 G53 | D47-Q51 WeakPolarHBondContact O-CB 3.31Å; D47-Q51 PolarHBondContact O-N 3.4Å; Q51-G53 VanDerWaalsContact C-N 3.34Å |
| 52 | E | 48.4 | Very low | 50.1 | Low | 174 Ų | 174 | 115.3 Ų | 115.3 | 81% | 0.813 | 66% | 0.661 | S | S | * | * | S | Bend | trans | -89.5 | 3.7 | 170.1 | -53.8 | -173.4 | 112.1 | 0 | 0 | 113 | ||
| 53 | G | 50.6 | Low | 48.9 | Very low | 50 Ų | 50 | 112.8 Ų | 112.8 | 52% | 0.515 | 66% | 0.658 | S | S | . | * | S | Bend | trans | -153.1 | 60.5 | -175.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | Q51 | Q51-G53 VanDerWaalsContact C-N 3.34Š|
| 54 | D | 44.3 | Very low | 47.7 | Very low | 163 Ų | 163 | 115.9 Ų | 115.9 | 87% | 0.872 | 67% | 0.673 | S | S | * | * | trans | 167.1 | 71.9 | 132.8 | -76.6 | -18.3 | 0 | 0 | 0 | 110 | ||||
| 55 | H | 44.2 | Very low | 46.4 | Very low | 155 Ų | 155 | 118.4 Ų | 118.4 | 72% | 0.718 | 69% | 0.687 | S | S | * | * | trans | -82 | 105.1 | 148.7 | -175.3 | -108.9 | 0 | 0 | 0 | 106.8 | P57 | H55-P57 VanDerWaalsContact CE1-CB 3.49Å; H55-P57 WeakPolarHBondContact CE1-CB 3.33Å; H55-P57 WeakPolarHBondContact CE1-CG 3.25Å; H55-P57 WeakPolarHBondContact ND1-CD 3.29Å; H55-P57 WeakPolarHBondContact ND1-CG 3.22Å | ||
| 56 | E | 36.1 | Very low | 45.8 | Very low | 171 Ų | 171 | 118.6 Ų | 118.6 | 80% | 0.799 | 69% | 0.69 | S | S | * | * | trans | -111 | 108.4 | 150.9 | -109.1 | -68.4 | 96.4 | 0 | 0 | 107.7 | ||||
| 57 | P | 52.2 | Low | 45.3 | Very low | 76 Ų | 76 | 122.8 Ų | 122.8 | 49% | 0.494 | 71% | 0.713 | S | S | . | * | trans | -97 | 105.6 | 173.4 | 38.8 | -30.3 | 0 | 0 | 0 | 108.2 | H55 | H55-P57 VanDerWaalsContact CE1-CB 3.49Å; H55-P57 WeakPolarHBondContact CE1-CB 3.33Å; H55-P57 WeakPolarHBondContact CE1-CG 3.25Å; H55-P57 WeakPolarHBondContact ND1-CD 3.29Å; H55-P57 WeakPolarHBondContact ND1-CG 3.22Å | ||
| 58 | S | 42.4 | Very low | 44.6 | Very low | 110 Ų | 110 | 121.7 Ų | 121.7 | 77% | 0.769 | 72% | 0.719 | S | S | * | * | trans | -154.5 | 118.1 | 161 | -158.3 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 59 | G | 40.1 | Very low | 44.4 | Very low | 73 Ų | 73 | 122.4 Ų | 122.4 | 75% | 0.753 | 73% | 0.728 | S | S | * | * | trans | -63.1 | 154 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 60 | S | 34.2 | Very low | 44.2 | Very low | 115 Ų | 115 | 125.4 Ų | 125.4 | 80% | 0.804 | 74% | 0.737 | S | S | * | * | trans | -160.8 | 114.9 | 142.6 | 55.8 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 61 | E | 40.7 | Very low | 44.4 | Very low | 180 Ų | 180 | 129.6 Ų | 129.6 | 84% | 0.841 | 75% | 0.746 | S | S | * | * | trans | -47.4 | 156.5 | 155.8 | -54.7 | 162 | 127 | 0 | 0 | 109.5 | ||||
| 62 | T | 38.7 | Very low | 44.8 | Very low | 115 Ų | 115 | 132 Ų | 132 | 71% | 0.706 | 75% | 0.748 | S | S | * | * | trans | 111.5 | 109.3 | 154 | -42.4 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 63 | E | 42.8 | Very low | 45 | Very low | 151 Ų | 151 | 131.9 Ų | 131.9 | 71% | 0.706 | 75% | 0.752 | S | S | * | * | trans | 78.6 | 118.7 | 140.8 | -74.6 | 169 | 62.8 | 0 | 0 | 122.3 | ||||
| 64 | E | 42.1 | Very low | 45.1 | Very low | 164 Ų | 164 | 139.4 Ų | 139.4 | 77% | 0.766 | 76% | 0.764 | S | S | * | * | 81.7 | 94.2 | 127.1 | -61.5 | 176.9 | 151.6 | 0 | 0 | 121.2 | |||||
| 65 | D | 36.5 | Very low | 45.3 | Very low | 154 Ų | 154 | 136.9 Ų | 136.9 | 82% | 0.824 | 76% | 0.759 | S | S | * | * | 44.8 | 173.5 | 128.5 | -142.3 | 27.9 | 0 | 0 | 0 | 121.1 | |||||
| 66 | P | 51.5 | Low | 45.6 | Very low | 102 Ų | 102 | 134.2 Ų | 134.2 | 66% | 0.662 | 76% | 0.764 | S | S | * | * | -115.3 | 116 | -101.3 | 35.9 | -17.6 | 0 | 0 | 0 | 111.7 | |||||
| 67 | S | 46.1 | Very low | 46.4 | Very low | 125 Ų | 125 | 137.7 Ų | 137.7 | 87% | 0.874 | 77% | 0.77 | S | S | * | * | trans | -160 | 144.6 | 165 | -157.3 | 0 | 0 | 0 | 0 | 114 | ||||
| 68 | A | 41.9 | Very low | 46.5 | Very low | 81 Ų | 81 | 143.6 Ų | 143.6 | 67% | 0.669 | 79% | 0.791 | S | S | * | * | trans | 77.2 | 77 | 165.3 | 0 | 0 | 0 | 0 | 0 | 116.5 | P70 | A68-P70 VanDerWaalsContact O-CD 3.28Å; A68-P70 WeakPolarHBondContact O-CD 3.28Å | ||
| 69 | S | 49.5 | Very low | 46.9 | Very low | 107 Ų | 107 | 149.2 Ų | 149.2 | 75% | 0.748 | 80% | 0.796 | S | S | * | * | trans | -61.4 | 129.6 | 138.1 | 168.9 | 0 | 0 | 0 | 0 | 109.8 | H71 | S69-H71 PolarHBondContact OG-N 3.26Š| ||
| 70 | P | 48.5 | Very low | 47.1 | Very low | 115 Ų | 115 | 156.1 Ų | 156.1 | 75% | 0.747 | 80% | 0.799 | S | S | * | * | trans | -115.6 | 56.6 | 156.4 | 15.8 | 7.9 | 0 | 0 | 0 | 109 | A68 R72 | A68-P70 VanDerWaalsContact O-CD 3.28Å; A68-P70 WeakPolarHBondContact O-CD 3.28Å; P70-R72 PolarHBondContact O-N 3.04Å | ||
| 71 | H | 53.8 | Low | 47.4 | Very low | 185 Ų | 185 | 155 Ų | 155 | 86% | 0.856 | 80% | 0.796 | S | S | * | * | trans | -73.9 | 61.8 | 163.6 | -144.8 | 51.4 | 0 | 0 | 0 | 109.8 | S69 | S69-H71 PolarHBondContact OG-N 3.26Š| ||
| 72 | R | 55.3 | Low | 47.7 | Very low | 206 Ų | 206 | 152.7 Ų | 152.7 | 78% | 0.777 | 80% | 0.797 | S | S | * | * | trans | -163.4 | 76.6 | 177 | -144.5 | -174.3 | -169.5 | -153.6 | 6 | 115.1 | P70 | P70-R72 PolarHBondContact O-N 3.04Š| ||
| 73 | I | 53.9 | Low | 48.2 | Very low | 172 Ų | 172 | 152.3 Ų | 152.3 | 88% | 0.882 | 81% | 0.805 | S | S | * | * | trans | -130.4 | 72.2 | 156.1 | -51.1 | -179.1 | 0 | 0 | 0 | 106.9 | ||||
| 74 | R | 51.9 | Low | 48.6 | Very low | 208 Ų | 208 | 150 Ų | 150 | 79% | 0.785 | 81% | 0.812 | S | S | * | * | 66.5 | 82.9 | 88.4 | -160.5 | 177.9 | -162.1 | 167.9 | 4.8 | 112.1 | |||||
| 75 | S | 49.2 | Very low | 49.2 | Very low | 109 Ų | 109 | 149.7 Ų | 149.7 | 76% | 0.762 | 82% | 0.816 | S | S | * | * | S | Bend | trans | -47.5 | 141.4 | 157.7 | 30 | 0 | 0 | 0 | 0 | 113.7 | ||
| 76 | A | 49.4 | Very low | 50.1 | Low | 100 Ų | 100 | 151.4 Ų | 151.4 | 83% | 0.826 | 82% | 0.819 | S | S | * | * | S | Bend | trans | 59.9 | 68.2 | 147.8 | 0 | 0 | 0 | 0 | 0 | 119 | ||
| 77 | R | 54.4 | Low | 50.3 | Low | 243 Ų | 243 | 150.1 Ų | 150.1 | 92% | 0.917 | 82% | 0.824 | S | S | * | * | trans | -172.5 | 87.4 | 149.9 | -134.9 | 177.7 | -178.7 | -167 | 1.3 | 113.5 | ||||
| 78 | Q | 53.8 | Low | 50.1 | Low | 201 Ų | 201 | 156.9 Ų | 156.9 | 94% | 0.939 | 84% | 0.841 | S | S | * | * | trans | -145.3 | 62.3 | 154.4 | -149.1 | 167.4 | -56.6 | 0 | 0 | 112.1 | ||||
| 79 | R | 49.8 | Very low | 50.5 | Low | 228 Ų | 228 | 160.7 Ų | 160.7 | 86% | 0.86 | 85% | 0.85 | S | S | * | * | trans | -69.9 | 116.7 | 155.6 | -178.5 | -176.2 | -170.1 | -127.9 | 3.8 | 107.4 | ||||
| 80 | R | 45.3 | Very low | 50.6 | Low | 218 Ų | 218 | 163.5 Ų | 163.5 | 82% | 0.823 | 86% | 0.855 | S | S | * | * | trans | 148.8 | 113.9 | 130.3 | -163.2 | 164.9 | -162.6 | 157.9 | 1.9 | 115.5 | ||||
| 81 | A | 40.9 | Very low | 50.7 | Low | 91 Ų | 91 | 166.2 Ų | 166.2 | 75% | 0.752 | 86% | 0.861 | S | S | * | * | trans | 66.5 | 145.2 | 147.2 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 82 | P | 46.8 | Very low | 50.5 | Low | 132 Ų | 132 | 165.1 Ų | 165.1 | 86% | 0.857 | 86% | 0.861 | S | S | * | * | -134.1 | 161.8 | 80.9 | 35.4 | -20 | 0 | 0 | 0 | 115.2 | |||||
| 83 | A | 48.6 | Very low | 50.2 | Low | 106 Ų | 106 | 162.6 Ų | 162.6 | 88% | 0.876 | 87% | 0.867 | S | S | * | * | trans | -77.2 | 140.2 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 84 | A | 52.3 | Low | 50 | Low | 102 Ų | 102 | 161.9 Ų | 161.9 | 84% | 0.843 | 87% | 0.865 | S | S | * | * | trans | -172.9 | 138.5 | 161 | 0 | 0 | 0 | 0 | 0 | 104.2 | ||||
| 85 | D | 54.6 | Low | 49.8 | Very low | 158 Ų | 158 | 158.6 Ų | 158.6 | 85% | 0.845 | 87% | 0.871 | S | S | * | * | cis | -164.8 | 158.4 | 13.5 | 179.9 | 37.4 | 0 | 0 | 0 | 106.5 | ||||
| 86 | E | 55.2 | Low | 49.9 | Very low | 191 Ų | 191 | 162.5 Ų | 162.5 | 89% | 0.893 | 88% | 0.88 | S | S | * | * | trans | -66.6 | 134.3 | -175.4 | -157.2 | 155.6 | 99.2 | 0 | 0 | 111.9 | ||||
| 87 | G | 55.9 | Low | 49.9 | Very low | 74 Ų | 74 | 167.7 Ų | 167.7 | 76% | 0.763 | 88% | 0.884 | S | S | * | * | trans | -149.4 | 89.1 | -175.3 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 88 | H | 41.6 | Very low | 49.5 | Very low | 268 Ų | 268 | 160.8 Ų | 160.8 | 100% | 1.241 | 88% | 0.881 | S | S | * | * | trans | 44.8 | 0 | 152.9 | -145.3 | 83.3 | 0 | 0 | 0 | 120.4 |
Retrieved 88 of 88 residues in 53 ms
(Link to these results)