| 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 | 52.1 | Low | 73.7 | Confident | 204 Ų | 204 | 105.3 Ų | 105.3 | 100% | 1.005 | 55% | 0.551 | S | S | * | * | 0 | 119.4 | 0 | -145.2 | 81.9 | 178.4 | 0 | 0 | 107.8 | L5 | M1-L5 HydrophobicContact CE-CD2 4.18Š| |||
| 2 | T | 53.9 | Low | 75.2 | Confident | 82 Ų | 82 | 101.5 Ų | 101.5 | 50% | 0.503 | 53% | 0.527 | S | S | . | . | trans | -75.9 | 142.2 | 176.6 | 44.9 | 0 | 0 | 0 | 0 | 110 | D4 L5 | T2-D4 PolarHBondContact O-N 3.25Å; T2-L5 PolarHBondContact O-N 3.39Å; T2-L5 VanDerWaalsContact OG1-CD1 3.29Å; T2-L5 WeakPolarHBondContact OG1-CD1 3.44Å | ||
| 3 | P | 66.9 | Low | 76.5 | Confident | 107 Ų | 107 | 98.5 Ų | 98.5 | 70% | 0.695 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -58.2 | -24.9 | -177.1 | 19.4 | -30.7 | 0 | 0 | 0 | 114 | T7 | P3-T7 PolarHBondContact O-N 2.74Å; P3-T7 VanDerWaalsContact O-N 3.11Å; P3-T7 PolarHBondContact O-OG1 2.88Å |
| 4 | D | 68.8 | Low | 77.8 | Confident | 92 Ų | 92 | 95.1 Ų | 95.1 | 49% | 0.492 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -70 | -29.3 | 174.9 | -165.9 | 29.3 | 0 | 0 | 0 | 113.2 | T2 K8 | T2-D4 PolarHBondContact O-N 3.25Å; D4-K8 WeakPolarHBondContact O-CD 3.34Å; D4-K8 VanDerWaalsContact O-CG 3.23Å; D4-K8 WeakPolarHBondContact O-CG 3.29Å; D4-K8 PolarHBondContact O-N 3.07Å; D4-K8 WeakPolarHBondContact OD1-CE 3.23Å; D4-K8 IonicContact OD1-NZ 3.54Å; D4-K8 WeakPolarHBondContact OD2-CE 3.46Å; D4-K8 IonicContact OD2-NZ 2.74Å; D4-K8 PolarHBondContact OD2-NZ 3.29Å |
| 5 | L | 66.3 | Low | 78.9 | Confident | 96 Ų | 96 | 96.7 Ų | 96.7 | 50% | 0.503 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -74.3 | -40.2 | 174.7 | -106.1 | 105.2 | 0 | 0 | 0 | 111.8 | M1 T2 K8 D9 | M1-L5 HydrophobicContact CE-CD2 4.18Å; T2-L5 PolarHBondContact O-N 3.39Å; T2-L5 VanDerWaalsContact OG1-CD1 3.29Å; T2-L5 WeakPolarHBondContact OG1-CD1 3.44Å; L5-K8 PolarHBondContact O-N 3.07Å; L5-D9 PolarHBondContact O-N 2.92Å |
| 6 | D | 75.6 | Confident | 80 | Confident | 78 Ų | 78 | 91.2 Ų | 91.2 | 42% | 0.417 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -65.7 | -39.5 | 177.6 | -174.4 | 55.2 | 0 | 0 | 0 | 111.5 | D9 R10 | D6-D9 PolarHBondContact O-N 3.47Å; D6-R10 WeakPolarHBondContact O-CB 3.38Å; D6-R10 WeakPolarHBondContact O-CG 3.5Å; D6-R10 PolarHBondContact O-N 3.19Å |
| 7 | T | 82.5 | Confident | 80.9 | Confident | 79 Ų | 79 | 88.7 Ų | 88.7 | 49% | 0.485 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -64.3 | -43.1 | 176.3 | -54.4 | 0 | 0 | 0 | 0 | 111.5 | P3 R10 C11 | P3-T7 PolarHBondContact O-N 2.74Å; P3-T7 VanDerWaalsContact O-N 3.11Å; P3-T7 PolarHBondContact O-OG1 2.88Å; T7-R10 PolarHBondContact O-N 3.42Å; T7-C11 WeakPolarHBondContact O-CB 3.34Å; T7-C11 PolarHBondContact O-N 3.43Å; T7-C11 PolarHBondContact O-SG 3.16Å |
| 8 | K | 82.8 | Confident | 81.8 | Confident | 123 Ų | 123 | 90.5 Ų | 90.5 | 54% | 0.535 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -64.2 | -43.1 | 178.1 | -74.5 | 168.7 | -171.5 | 163.3 | 0 | 112.4 | D4 L5 C11 F12 | D4-K8 WeakPolarHBondContact O-CD 3.34Å; D4-K8 VanDerWaalsContact O-CG 3.23Å; D4-K8 WeakPolarHBondContact O-CG 3.29Å; D4-K8 PolarHBondContact O-N 3.07Å; D4-K8 WeakPolarHBondContact OD1-CE 3.23Å; D4-K8 IonicContact OD1-NZ 3.54Å; D4-K8 WeakPolarHBondContact OD2-CE 3.46Å; D4-K8 IonicContact OD2-NZ 2.74Å; D4-K8 PolarHBondContact OD2-NZ 3.29Å; L5-K8 PolarHBondContact O-N 3.07Å; K8-C11 PolarHBondContact O-N 2.71Å; K8-F12 WeakPolarHBondContact O-CB 3.37Å; K8-F12 PolarHBondContact O-N 2.93Å |
| 9 | D | 84.6 | Confident | 82.6 | Confident | 53 Ų | 53 | 85.8 Ų | 85.8 | 28% | 0.283 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -63.9 | -43.3 | 177 | -176.9 | 43.3 | 0 | 0 | 0 | 111.6 | L5 D6 C11 F12 R13 H259 | L5-D9 PolarHBondContact O-N 2.92Å; D6-D9 PolarHBondContact O-N 3.47Å; D9-C11 PolarHBondContact O-N 3.35Å; D9-F12 PolarHBondContact O-N 3.14Å; D9-R13 VanDerWaalsContact CG-NE 3.28Å; D9-R13 VanDerWaalsContact O-CG 3.3Å; D9-R13 WeakPolarHBondContact O-CG 3.47Å; D9-R13 PolarHBondContact O-N 3.34Å; D9-R13 IonicContact OD1-CZ 3.94Å; D9-R13 IonicContact OD1-NE 3.17Å; D9-R13 PolarHBondContact OD1-NE 3.44Å; D9-R13 IonicContact OD1-NH2 2.73Å; D9-R13 IonicContact OD2-CZ 3.12Å; D9-R13 IonicContact OD2-NE 2.81Å; D9-R13 PolarHBondContact OD2-NE 3.34Å; D9-R13 IonicContact OD2-NH2 2.93Å; D9-R13 PolarHBondContact OD2-NH2 3.03Å; D9-H259 IonicContact OD1-CE1 3.62Å; D9-H259 IonicContact OD1-ND1 3.89Å |
| 10 | R | 86.4 | Confident | 83.3 | Confident | 169 Ų | 169 | 81.6 Ų | 81.6 | 64% | 0.638 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -64.2 | -41.9 | 176.7 | -67.7 | 174.7 | 81.1 | 178.5 | 5.2 | 112.4 | D6 T7 F12 A14 | D6-R10 WeakPolarHBondContact O-CB 3.38Å; D6-R10 WeakPolarHBondContact O-CG 3.5Å; D6-R10 PolarHBondContact O-N 3.19Å; T7-R10 PolarHBondContact O-N 3.42Å; R10-F12 VanDerWaalsContact C-N 3.35Å; R10-A14 WeakPolarHBondContact O-CB 3.33Å; R10-A14 PolarHBondContact O-N 3.06Å |
| 11 | C | 90.6 | Very high | 84 | Confident | 75 Ų | 75 | 81.4 Ų | 81.4 | 51% | 0.507 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -61.1 | -43.5 | 173.2 | -78.2 | 0 | 0 | 0 | 0 | 111.7 | T7 K8 D9 A14 L15 | T7-C11 WeakPolarHBondContact O-CB 3.34Å; T7-C11 PolarHBondContact O-N 3.43Å; T7-C11 PolarHBondContact O-SG 3.16Å; K8-C11 PolarHBondContact O-N 2.71Å; D9-C11 PolarHBondContact O-N 3.35Å; C11-A14 PolarHBondContact O-N 2.82Å; C11-L15 WeakPolarHBondContact O-CG 3.21Å; C11-L15 PolarHBondContact O-N 3.5Å |
| 12 | F | 92.1 | Very high | 86.1 | Confident | 60 Ų | 60 | 74.6 Ų | 74.6 | 26% | 0.263 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -64.1 | -46.1 | 179.8 | -173 | -115.1 | 0 | 0 | 0 | 112.1 | K8 D9 R10 A14 L15 L16 G255 F258 H259 | K8-F12 WeakPolarHBondContact O-CB 3.37Å; K8-F12 PolarHBondContact O-N 2.93Å; D9-F12 PolarHBondContact O-N 3.14Å; R10-F12 VanDerWaalsContact C-N 3.35Å; F12-A14 VanDerWaalsContact C-N 3.31Å; F12-A14 PolarHBondContact O-N 3.37Å; F12-L15 WeakPolarHBondContact O-CB 3.3Å; F12-L15 PolarHBondContact O-N 2.94Å; F12-L15 VanDerWaalsContact O-N 3.16Å; F12-L16 HydrophobicContact CD1-CD1 4.08Å; F12-L16 HydrophobicContact CE1-CD1 3.74Å; F12-L16 HydrophobicContact CE1-CG 4.34Å; F12-L16 HydrophobicContact CZ-CD1 4.2Å; F12-L16 HydrophobicContact CZ-CD2 4.27Å; F12-L16 HydrophobicContact CZ-CG 4.42Å; F12-L16 WeakPolarHBondContact O-CG 3.45Å; F12-L16 PolarHBondContact O-N 3.35Å; F12-G255 WeakPolarHBondContact CZ-O 3.42Å; F12-F258 AromaticContact CE1-CD1 3.74Å; F12-F258 HydrophobicContact CE1-CD1 3.74Å; F12-F258 HydrophobicContact CE1-CE1 4.39Å; F12-F258 AromaticContact CZ-CD1 3.71Å; F12-F258 HydrophobicContact CZ-CD1 3.71Å; F12-F258 HydrophobicContact CZ-CE1 4.46Å; F12-H259 HydrophobicContact CE1-CB 3.96Å |
| 13 | R | 92.4 | Very high | 88.2 | Confident | 63 Ų | 63 | 70.8 Ų | 70.8 | 24% | 0.238 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -59.4 | -41.5 | 174.3 | -67.4 | 167.2 | -172.4 | -130.8 | -0 | 112.3 | D9 L15 L16 I17 I81 S84 H259 | D9-R13 VanDerWaalsContact CG-NE 3.28Å; D9-R13 VanDerWaalsContact O-CG 3.3Å; D9-R13 WeakPolarHBondContact O-CG 3.47Å; D9-R13 PolarHBondContact O-N 3.34Å; D9-R13 IonicContact OD1-CZ 3.94Å; D9-R13 IonicContact OD1-NE 3.17Å; D9-R13 PolarHBondContact OD1-NE 3.44Å; D9-R13 IonicContact OD1-NH2 2.73Å; D9-R13 IonicContact OD2-CZ 3.12Å; D9-R13 IonicContact OD2-NE 2.81Å; D9-R13 PolarHBondContact OD2-NE 3.34Å; D9-R13 IonicContact OD2-NH2 2.93Å; D9-R13 PolarHBondContact OD2-NH2 3.03Å; R13-L15 VanDerWaalsContact C-N 3.32Å; R13-L15 PolarHBondContact O-N 3.47Å; R13-L16 PolarHBondContact O-N 3.43Å; R13-I17 WeakPolarHBondContact O-CG1 3.41Å; R13-I17 PolarHBondContact O-N 2.81Å; R13-I81 HydrophobicContact CB-CG2 3.96Å; R13-I81 HydrophobicContact CG-CG2 4.19Å; R13-S84 PolarHBondContact NH1-OG 3.41Å; R13-H259 PolarHBondContact NE-CE1 3.33Å |
| 14 | A | 93.9 | Very high | 89.6 | Confident | 50 Ų | 50 | 65.9 Ų | 65.9 | 41% | 0.413 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -61.7 | -40.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112 | R10 C11 F12 I17 Q18 | R10-A14 WeakPolarHBondContact O-CB 3.33Å; R10-A14 PolarHBondContact O-N 3.06Å; C11-A14 PolarHBondContact O-N 2.82Å; F12-A14 VanDerWaalsContact C-N 3.31Å; F12-A14 PolarHBondContact O-N 3.37Å; A14-I17 PolarHBondContact O-N 3.11Å; A14-Q18 WeakPolarHBondContact O-CB 3.47Å; A14-Q18 VanDerWaalsContact O-CG 3.28Å; A14-Q18 WeakPolarHBondContact O-CG 3.48Å; A14-Q18 PolarHBondContact O-N 3.23Å |
| 15 | L | 95.1 | Very high | 91 | Very high | 119 Ų | 119 | 65.1 Ų | 65.1 | 62% | 0.623 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -62.7 | -41.2 | 173.7 | -70.9 | 169.3 | 0 | 0 | 0 | 112.1 | C11 F12 R13 Q18 G19 | C11-L15 WeakPolarHBondContact O-CG 3.21Å; C11-L15 PolarHBondContact O-N 3.5Å; F12-L15 WeakPolarHBondContact O-CB 3.3Å; F12-L15 PolarHBondContact O-N 2.94Å; F12-L15 VanDerWaalsContact O-N 3.16Å; R13-L15 VanDerWaalsContact C-N 3.32Å; R13-L15 PolarHBondContact O-N 3.47Å; L15-Q18 PolarHBondContact O-N 2.95Å; L15-G19 PolarHBondContact O-N 3.43Å |
| 16 | L | 95.7 | Very high | 92.3 | Very high | 9 Ų | 9 | 61.7 Ų | 61.7 | 5% | 0.047 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -67.2 | -36.3 | 177 | -61.9 | 177.5 | 0 | 0 | 0 | 112.5 | F12 R13 G19 N20 I81 V256 H259 | F12-L16 HydrophobicContact CD1-CD1 4.08Å; F12-L16 HydrophobicContact CE1-CD1 3.74Å; F12-L16 HydrophobicContact CE1-CG 4.34Å; F12-L16 HydrophobicContact CZ-CD1 4.2Å; F12-L16 HydrophobicContact CZ-CD2 4.27Å; F12-L16 HydrophobicContact CZ-CG 4.42Å; F12-L16 WeakPolarHBondContact O-CG 3.45Å; F12-L16 PolarHBondContact O-N 3.35Å; R13-L16 PolarHBondContact O-N 3.43Å; L16-G19 PolarHBondContact O-N 2.94Å; L16-N20 PolarHBondContact O-N 2.91Å; L16-N20 PolarHBondContact O-ND2 3.05Å; L16-I81 HydrophobicContact CB-CD1 3.63Å; L16-I81 HydrophobicContact CB-CG1 4.46Å; L16-V256 HydrophobicContact CB-CG2 4.48Å; L16-V256 HydrophobicContact CD1-CG2 4.09Å; L16-V256 HydrophobicContact CD2-CG2 4.17Å; L16-V256 HydrophobicContact CG-CG2 4.48Å; L16-H259 HydrophobicContact CD1-CB 3.96Å |
| 17 | I | 96.3 | Very high | 93.3 | Very high | 49 Ų | 49 | 58 Ų | 58 | 25% | 0.251 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -65.8 | -46.8 | 174.4 | -69.5 | 166.6 | 0 | 0 | 0 | 110.2 | R13 A14 G19 N20 L21 M78 I81 V82 | R13-I17 WeakPolarHBondContact O-CG1 3.41Å; R13-I17 PolarHBondContact O-N 2.81Å; A14-I17 PolarHBondContact O-N 3.11Å; I17-G19 VanDerWaalsContact C-N 3.29Å; I17-G19 PolarHBondContact O-N 3.39Å; I17-N20 PolarHBondContact O-N 3.19Å; I17-L21 PolarHBondContact O-N 2.95Å; I17-M78 HydrophobicContact CG2-CG 4.04Å; I17-M78 HydrophobicContact CG2-SD 3.98Å; I17-I81 HydrophobicContact CD1-CG2 4.18Å; I17-I81 HydrophobicContact CG1-CB 4.24Å; I17-I81 HydrophobicContact CG1-CD1 4.33Å; I17-I81 HydrophobicContact CG1-CG2 3.94Å; I17-V82 HydrophobicContact CD1-CG2 3.91Å |
| 18 | Q | 96.4 | Very high | 93.9 | Very high | 121 Ų | 121 | 58 Ų | 58 | 57% | 0.565 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -58.5 | -42 | 173.3 | -72.9 | -79.8 | -33.6 | 0 | 0 | 111.3 | A14 L15 N20 L21 V22 | A14-Q18 WeakPolarHBondContact O-CB 3.47Å; A14-Q18 VanDerWaalsContact O-CG 3.28Å; A14-Q18 WeakPolarHBondContact O-CG 3.48Å; A14-Q18 PolarHBondContact O-N 3.23Å; L15-Q18 PolarHBondContact O-N 2.95Å; Q18-N20 PolarHBondContact O-N 3.47Å; Q18-L21 WeakPolarHBondContact O-CB 3.3Å; Q18-L21 PolarHBondContact O-N 2.98Å; Q18-V22 WeakPolarHBondContact O-CG2 3.4Å; Q18-V22 PolarHBondContact O-N 3.48Å |
| 19 | G | 96.4 | Very high | 94.4 | Very high | 2 Ų | 2 | 54 Ų | 54 | 2% | 0.021 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -56 | -48 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113 | L15 L16 I17 V22 I23 W248 | L15-G19 PolarHBondContact O-N 3.43Å; L16-G19 PolarHBondContact O-N 2.94Å; I17-G19 VanDerWaalsContact C-N 3.29Å; I17-G19 PolarHBondContact O-N 3.39Å; G19-V22 PolarHBondContact O-N 3.47Å; G19-I23 WeakPolarHBondContact O-CG1 3.49Å; G19-I23 PolarHBondContact O-N 3.49Å; G19-I23 VanDerWaalsContact O-N 3.15Å; G19-W248 PolarHBondContact O-NE1 3.5Å; G19-W248 VanDerWaalsContact O-NE1 3.1Å |
| 20 | N | 97.3 | Very high | 94.7 | Very high | 0 Ų | 0 | 51.6 Ų | 51.6 | 0% | 0 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -67.9 | -33.6 | 176.1 | -82.3 | -86.1 | 0 | 0 | 0 | 112.8 | L16 I17 Q18 V22 I23 A24 S74 M78 Y92 | L16-N20 PolarHBondContact O-N 2.91Å; L16-N20 PolarHBondContact O-ND2 3.05Å; I17-N20 PolarHBondContact O-N 3.19Å; Q18-N20 PolarHBondContact O-N 3.47Å; N20-V22 VanDerWaalsContact C-N 3.34Å; N20-V22 PolarHBondContact O-N 3.39Å; N20-I23 PolarHBondContact O-N 3.36Å; N20-A24 WeakPolarHBondContact O-CB 3.48Å; N20-A24 PolarHBondContact O-N 2.81Å; N20-S74 WeakPolarHBondContact O-CB 3.27Å; N20-M78 HydrophobicContact CB-CG 3.65Å; N20-Y92 PolarHBondContact ND2-OH 2.8Å; N20-Y92 PolarHBondContact OD1-OH 3.44Å |
| 21 | L | 97.4 | Very high | 94.9 | Very high | 79 Ų | 79 | 46 Ų | 46 | 41% | 0.414 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -61.6 | -43.4 | 174.2 | -178.4 | 64.5 | 0 | 0 | 0 | 111.4 | I17 Q18 I23 A24 C25 M78 | I17-L21 PolarHBondContact O-N 2.95Å; Q18-L21 WeakPolarHBondContact O-CB 3.3Å; Q18-L21 PolarHBondContact O-N 2.98Å; L21-I23 VanDerWaalsContact C-N 3.34Å; L21-I23 PolarHBondContact O-N 3.38Å; L21-A24 WeakPolarHBondContact O-CB 3.31Å; L21-A24 PolarHBondContact O-N 2.79Å; L21-C25 PolarHBondContact O-N 2.62Å; L21-C25 VanDerWaalsContact O-N 3.08Å; L21-C25 PolarHBondContact O-SG 3.21Å; L21-M78 HydrophobicContact CB-SD 4.32Å |
| 22 | V | 97.4 | Very high | 94.9 | Very high | 61 Ų | 61 | 45 Ų | 45 | 37% | 0.37 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -61.1 | -44.5 | 174.7 | 174.6 | 0 | 0 | 0 | 0 | 110.7 | Q18 G19 N20 A24 C25 C26 W248 | Q18-V22 WeakPolarHBondContact O-CG2 3.4Å; Q18-V22 PolarHBondContact O-N 3.48Å; G19-V22 PolarHBondContact O-N 3.47Å; N20-V22 VanDerWaalsContact C-N 3.34Å; N20-V22 PolarHBondContact O-N 3.39Å; V22-A24 VanDerWaalsContact C-N 3.32Å; V22-A24 PolarHBondContact O-N 2.85Å; V22-C25 PolarHBondContact O-N 3.38Å; V22-C26 WeakPolarHBondContact O-CB 3.34Å; V22-C26 PolarHBondContact O-N 3.23Å; V22-C26 PolarHBondContact O-SG 2.9Å; V22-C26 VanDerWaalsContact O-SG 3.35Å; V22-W248 HydrophobicContact CB-CZ2 4.12Å; V22-W248 HydrophobicContact CG1-CD2 4.49Å; V22-W248 HydrophobicContact CG1-CZ2 4.3Å; V22-W248 HydrophobicContact CG2-CZ2 4.07Å |
| 23 | I | 96.9 | Very high | 94.6 | Very high | 1 Ų | 1 | 45 Ų | 45 | 1% | 0.005 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -63.1 | -38.6 | 177.6 | -59.5 | 164.6 | 0 | 0 | 0 | 111.3 | G19 N20 L21 C25 C26 G27 L70 S74 M96 T249 V252 | G19-I23 WeakPolarHBondContact O-CG1 3.49Å; G19-I23 PolarHBondContact O-N 3.49Å; G19-I23 VanDerWaalsContact O-N 3.15Å; N20-I23 PolarHBondContact O-N 3.36Å; L21-I23 VanDerWaalsContact C-N 3.34Å; L21-I23 PolarHBondContact O-N 3.38Å; I23-C25 PolarHBondContact O-N 2.98Å; I23-C26 WeakPolarHBondContact O-CB 3.47Å; I23-C26 PolarHBondContact O-N 2.96Å; I23-G27 PolarHBondContact O-N 3.17Å; I23-L70 HydrophobicContact CG2-CD2 3.93Å; I23-S74 WeakPolarHBondContact CB-OG 3.38Å; I23-S74 VanDerWaalsContact CG2-OG 3.24Å; I23-S74 WeakPolarHBondContact CG2-OG 3.47Å; I23-M96 HydrophobicContact CB-CE 4.41Å; I23-M96 HydrophobicContact CD1-CE 3.67Å; I23-M96 HydrophobicContact CG2-CE 3.7Å; I23-T249 HydrophobicContact CD1-CG2 4.17Å; I23-V252 HydrophobicContact CD1-CB 3.88Å; I23-V252 HydrophobicContact CD1-CG1 3.91Å; I23-V252 HydrophobicContact CD1-CG2 3.91Å |
| 24 | A | 97.5 | Very high | 94.2 | Very high | 4 Ų | 4 | 42.5 Ų | 42.5 | 3% | 0.033 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -61.1 | -46.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | N20 L21 V22 C26 G27 I28 F71 I75 | N20-A24 WeakPolarHBondContact O-CB 3.48Å; N20-A24 PolarHBondContact O-N 2.81Å; L21-A24 WeakPolarHBondContact O-CB 3.31Å; L21-A24 PolarHBondContact O-N 2.79Å; V22-A24 VanDerWaalsContact C-N 3.32Å; V22-A24 PolarHBondContact O-N 2.85Å; A24-C26 VanDerWaalsContact C-N 3.34Å; A24-G27 PolarHBondContact O-N 3.45Å; A24-I28 PolarHBondContact O-N 2.71Å; A24-I28 VanDerWaalsContact O-N 3.12Å; A24-F71 HydrophobicContact CB-CD2 4.04Å; A24-I75 HydrophobicContact CB-CD1 4.4Å |
| 25 | C | 96.9 | Very high | 93.9 | Very high | 76 Ų | 76 | 44.2 Ų | 44.2 | 51% | 0.514 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -62 | -42.3 | 174.9 | -67.3 | 0 | 0 | 0 | 0 | 111.8 | L21 V22 I23 G27 I28 A29 | L21-C25 PolarHBondContact O-N 2.62Å; L21-C25 VanDerWaalsContact O-N 3.08Å; L21-C25 PolarHBondContact O-SG 3.21Å; V22-C25 PolarHBondContact O-N 3.38Å; I23-C25 PolarHBondContact O-N 2.98Å; C25-G27 PolarHBondContact O-N 2.93Å; C25-I28 PolarHBondContact O-N 3.34Å; C25-A29 PolarHBondContact O-N 3Å |
| 26 | C | 95 | Very high | 93.3 | Very high | 25 Ų | 25 | 45.1 Ų | 45.1 | 17% | 0.169 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -61.4 | -40.6 | 174.8 | -76.4 | 0 | 0 | 0 | 0 | 112.7 | V22 I23 A24 A29 L30 F241 I245 | V22-C26 WeakPolarHBondContact O-CB 3.34Å; V22-C26 PolarHBondContact O-N 3.23Å; V22-C26 PolarHBondContact O-SG 2.9Å; V22-C26 VanDerWaalsContact O-SG 3.35Å; I23-C26 WeakPolarHBondContact O-CB 3.47Å; I23-C26 PolarHBondContact O-N 2.96Å; A24-C26 VanDerWaalsContact C-N 3.34Å; C26-A29 PolarHBondContact O-N 3.4Å; C26-L30 WeakPolarHBondContact O-CB 3.46Å; C26-L30 PolarHBondContact O-N 3.32Å; C26-F241 HydrophobicContact CB-CZ 4.41Å; C26-I245 HydrophobicContact CB-CD1 3.74Å; C26-I245 HydrophobicContact CB-CG1 3.72Å |
| 27 | G | 95 | Very high | 92.4 | Very high | 0 Ų | 0 | 47.3 Ų | 47.3 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -62 | -43.2 | 176 | 0 | 0 | 0 | 0 | 0 | 112.6 | I23 A24 C25 L30 M31 G67 | I23-G27 PolarHBondContact O-N 3.17Å; A24-G27 PolarHBondContact O-N 3.45Å; C25-G27 PolarHBondContact O-N 2.93Å; G27-L30 PolarHBondContact O-N 3.21Å; G27-M31 WeakPolarHBondContact O-CB 3.42Å; G27-M31 PolarHBondContact O-N 3.42Å; G27-G67 CarbonylContact C-O 3.43Å; G27-G67 WeakPolarHBondContact CA-O 3.39Å; G27-G67 CarbonylContact O-C 3.49Å; G27-G67 WeakPolarHBondContact O-CA 3.36Å |
| 28 | I | 95.4 | Very high | 91.5 | Very high | 78 Ų | 78 | 46.7 Ų | 46.7 | 40% | 0.4 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -62.6 | -45.2 | 173.8 | -65.6 | 169.5 | 0 | 0 | 0 | 110.9 | A24 C25 M31 A32 F71 | A24-I28 PolarHBondContact O-N 2.71Å; A24-I28 VanDerWaalsContact O-N 3.12Å; C25-I28 PolarHBondContact O-N 3.34Å; I28-M31 PolarHBondContact O-N 3.47Å; I28-A32 WeakPolarHBondContact O-CB 3.07Å; I28-A32 PolarHBondContact O-N 3.42Å; I28-F71 HydrophobicContact CD1-CD2 3.67Å; I28-F71 HydrophobicContact CD1-CE2 3.67Å; I28-F71 HydrophobicContact CG1-CB 4.44Å; I28-F71 HydrophobicContact CG1-CD2 3.65Å; I28-F71 HydrophobicContact CG1-CE2 4.14Å; I28-F71 HydrophobicContact CG1-CG 4.11Å |
| 29 | A | 93.8 | Very high | 90.6 | Very high | 39 Ų | 39 | 44.7 Ų | 44.7 | 32% | 0.322 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -63.4 | -42.6 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112 | C25 C26 A32 M33 F241 | C25-A29 PolarHBondContact O-N 3Å; C26-A29 PolarHBondContact O-N 3.4Å; A29-A32 PolarHBondContact O-N 3.48Å; A29-M33 WeakPolarHBondContact O-CG 3.44Å; A29-M33 PolarHBondContact O-N 3.05Å; A29-F241 HydrophobicContact CB-CE1 4.18Å; A29-F241 HydrophobicContact CB-CZ 3.71Å |
| 30 | L | 90.4 | Very high | 89.2 | Confident | 4 Ų | 4 | 46.6 Ų | 46.6 | 2% | 0.021 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -60.5 | -48 | 174.7 | -177.8 | 63.6 | 0 | 0 | 0 | 110.9 | C26 G27 A32 M33 C34 L70 E103 F241 | C26-L30 WeakPolarHBondContact O-CB 3.46Å; C26-L30 PolarHBondContact O-N 3.32Å; G27-L30 PolarHBondContact O-N 3.21Å; L30-A32 VanDerWaalsContact C-N 3.34Å; L30-A32 PolarHBondContact O-N 3.07Å; L30-M33 HydrophobicContact CD1-CE 4.41Å; L30-M33 PolarHBondContact O-N 3.05Å; L30-C34 PolarHBondContact O-N 3.4Å; L30-C34 PolarHBondContact O-SG 3.16Å; L30-C34 VanDerWaalsContact O-SG 3.41Å; L30-L70 HydrophobicContact CD2-CD1 4.25Å; L30-E103 WeakPolarHBondContact CD2-OE1 3.38Å; L30-E103 WeakPolarHBondContact CD2-OE2 3.41Å; L30-F241 HydrophobicContact CB-CE1 4.16Å; L30-F241 HydrophobicContact CD1-CD1 4.5Å |
| 31 | M | 91.2 | Very high | 87.3 | Confident | 52 Ų | 52 | 57.3 Ų | 57.3 | 26% | 0.256 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -56.6 | -47.9 | 175.9 | -173.9 | -175.5 | 67.7 | 0 | 0 | 111.2 | G27 I28 M33 C34 I35 L64 F68 | G27-M31 WeakPolarHBondContact O-CB 3.42Å; G27-M31 PolarHBondContact O-N 3.42Å; I28-M31 PolarHBondContact O-N 3.47Å; M31-M33 PolarHBondContact O-N 3.04Å; M31-C34 PolarHBondContact O-N 2.83Å; M31-I35 HydrophobicContact CG-CD1 4.12Å; M31-I35 VanDerWaalsContact O-CG1 3.3Å; M31-I35 WeakPolarHBondContact O-CG1 3.42Å; M31-I35 PolarHBondContact O-N 3.35Å; M31-L64 HydrophobicContact CG-CD1 3.63Å; M31-F68 HydrophobicContact SD-CB 4.16Å; M31-F68 HydrophobicContact SD-CD2 4.19Å |
| 32 | A | 90.6 | Very high | 85.6 | Confident | 54 Ų | 54 | 54.9 Ų | 54.9 | 45% | 0.446 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -61.5 | -40.6 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | I28 A29 L30 I35 F36 | I28-A32 WeakPolarHBondContact O-CB 3.07Å; I28-A32 PolarHBondContact O-N 3.42Å; A29-A32 PolarHBondContact O-N 3.48Å; L30-A32 VanDerWaalsContact C-N 3.34Å; L30-A32 PolarHBondContact O-N 3.07Å; A32-I35 PolarHBondContact O-N 3.45Å; A32-F36 PolarHBondContact O-N 3.05Å |
| 33 | M | 85.1 | Confident | 84.3 | Confident | 60 Ų | 60 | 52.6 Ų | 52.6 | 30% | 0.296 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -65.4 | -42.2 | 175.7 | -71.6 | -168 | -64.7 | 0 | 0 | 112.1 | A29 L30 M31 F36 F37 V238 F241 | A29-M33 WeakPolarHBondContact O-CG 3.44Å; A29-M33 PolarHBondContact O-N 3.05Å; L30-M33 HydrophobicContact CD1-CE 4.41Å; L30-M33 PolarHBondContact O-N 3.05Å; M31-M33 PolarHBondContact O-N 3.04Å; M33-F36 WeakPolarHBondContact O-CB 3.33Å; M33-F36 PolarHBondContact O-N 3.39Å; M33-F37 PolarHBondContact O-N 3.03Å; M33-V238 HydrophobicContact CB-CG2 4.5Å; M33-V238 HydrophobicContact CE-CG2 4.49Å; M33-V238 HydrophobicContact SD-CG2 4.15Å; M33-F241 HydrophobicContact CE-CB 4.21Å; M33-F241 HydrophobicContact CE-CD1 3.13Å; M33-F241 HydrophobicContact CE-CE1 3.43Å; M33-F241 VanDerWaalsContact CE-CE1 3.43Å; M33-F241 HydrophobicContact CE-CG 3.73Å; M33-F241 HydrophobicContact CE-CZ 4.31Å |
| 34 | C | 84.7 | Confident | 83.2 | Confident | 10 Ų | 10 | 53.9 Ų | 53.9 | 7% | 0.068 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -65 | -39.8 | 175.6 | -67.9 | 0 | 0 | 0 | 0 | 112 | L30 M31 F36 F37 I38 G63 L64 | L30-C34 PolarHBondContact O-N 3.4Å; L30-C34 PolarHBondContact O-SG 3.16Å; L30-C34 VanDerWaalsContact O-SG 3.41Å; M31-C34 PolarHBondContact O-N 2.83Å; C34-F36 VanDerWaalsContact C-N 3.34Å; C34-F36 PolarHBondContact O-N 3.31Å; C34-F37 PolarHBondContact O-N 2.93Å; C34-I38 VanDerWaalsContact O-CG1 3.31Å; C34-I38 WeakPolarHBondContact O-CG1 3.29Å; C34-I38 PolarHBondContact O-N 3.42Å; C34-G63 VanDerWaalsContact SG-C 3.55Å; C34-L64 HydrophobicContact CB-CB 3.92Å; C34-L64 HydrophobicContact CB-CD1 4.18Å |
| 35 | I | 87.6 | Confident | 82.1 | Confident | 85 Ų | 85 | 55.9 Ų | 55.9 | 44% | 0.436 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -60.2 | -45.2 | 173.6 | -68.1 | 170.5 | 0 | 0 | 0 | 110.6 | M31 A32 F37 I38 S39 L64 | M31-I35 HydrophobicContact CG-CD1 4.12Å; M31-I35 VanDerWaalsContact O-CG1 3.3Å; M31-I35 WeakPolarHBondContact O-CG1 3.42Å; M31-I35 PolarHBondContact O-N 3.35Å; A32-I35 PolarHBondContact O-N 3.45Å; I35-F37 VanDerWaalsContact C-N 3.27Å; I35-F37 PolarHBondContact O-N 3.31Å; I35-I38 PolarHBondContact O-N 2.85Å; I35-S39 WeakPolarHBondContact O-CB 3.42Å; I35-S39 PolarHBondContact O-N 3.03Å; I35-L64 HydrophobicContact CD1-CD1 4.08Å; I35-L64 HydrophobicContact CG1-CD1 3.4Å |
| 36 | F | 82.8 | Confident | 81.2 | Confident | 138 Ų | 138 | 52.6 Ų | 52.6 | 61% | 0.605 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -58.6 | -41.5 | 177.3 | 178.2 | -96.5 | 0 | 0 | 0 | 111.6 | A32 M33 C34 | A32-F36 PolarHBondContact O-N 3.05Å; M33-F36 WeakPolarHBondContact O-CB 3.33Å; M33-F36 PolarHBondContact O-N 3.39Å; C34-F36 VanDerWaalsContact C-N 3.34Å; C34-F36 PolarHBondContact O-N 3.31Å |
| 37 | F | 75.9 | Confident | 80.5 | Confident | 56 Ų | 56 | 51.4 Ų | 51.4 | 25% | 0.246 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -66.8 | -40.6 | 177.2 | -128.9 | -85.6 | 0 | 0 | 0 | 112.8 | M33 C34 I35 L231 H234 | M33-F37 PolarHBondContact O-N 3.03Å; C34-F37 PolarHBondContact O-N 2.93Å; I35-F37 VanDerWaalsContact C-N 3.27Å; I35-F37 PolarHBondContact O-N 3.31Å; F37-L231 HydrophobicContact CE1-CD2 4.02Å; F37-L231 HydrophobicContact CZ-CD2 3.83Å; F37-H234 HydrophobicContact CE2-CB 4.14Å |
| 38 | I | 77.8 | Confident | 79.6 | Confident | 36 Ų | 36 | 51.9 Ų | 51.9 | 19% | 0.185 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -74.2 | -34.3 | -179.6 | -69 | 166.3 | 0 | 0 | 0 | 111.8 | C34 I35 D40 W57 A60 W61 L64 | C34-I38 VanDerWaalsContact O-CG1 3.31Å; C34-I38 WeakPolarHBondContact O-CG1 3.29Å; C34-I38 PolarHBondContact O-N 3.42Å; I35-I38 PolarHBondContact O-N 2.85Å; I38-D40 PolarHBondContact O-N 3.24Å; I38-D40 VanDerWaalsContact O-N 3.13Å; I38-W57 HydrophobicContact CB-CZ3 4.46Å; I38-W57 HydrophobicContact CG1-CZ3 4.21Å; I38-W57 HydrophobicContact CG2-CH2 4.17Å; I38-W57 HydrophobicContact CG2-CZ3 3.96Å; I38-A60 HydrophobicContact CD1-CB 4.36Å; I38-A60 HydrophobicContact CG1-CB 4.03Å; I38-W61 HydrophobicContact CD1-CD2 4.06Å; I38-W61 HydrophobicContact CD1-CG 4.25Å; I38-W61 HydrophobicContact CG2-CZ2 4.23Å; I38-L64 HydrophobicContact CD1-CB 4.38Å; I38-L64 HydrophobicContact CD1-CD2 4.09Å |
| 39 | S | 77.9 | Confident | 78.7 | Confident | 79 Ų | 79 | 53.2 Ų | 53.2 | 55% | 0.552 | 27% | 0.272 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.9 | -4.7 | -174.8 | -177.1 | 0 | 0 | 0 | 0 | 114.4 | I35 R41 | I35-S39 WeakPolarHBondContact O-CB 3.42Å; I35-S39 PolarHBondContact O-N 3.03Å; S39-R41 PolarHBondContact O-N 3.14Å; S39-R41 VanDerWaalsContact O-N 3.13Å |
| 40 | D | 65.9 | Low | 77.8 | Confident | 41 Ų | 41 | 52.6 Ų | 52.6 | 22% | 0.219 | 27% | 0.267 | C | S | . | . | trans | 22.6 | 70.2 | 174.9 | -168.4 | 31.2 | 0 | 0 | 0 | 116.6 | I38 A42 G43 L44 Y45 | I38-D40 PolarHBondContact O-N 3.24Å; I38-D40 VanDerWaalsContact O-N 3.13Å; D40-A42 PolarHBondContact O-N 3.46Å; D40-A42 PolarHBondContact OD1-N 3.14Å; D40-G43 VanDerWaalsContact CG-N 3.34Å; D40-G43 WeakPolarHBondContact OD1-CA 3.2Å; D40-G43 PolarHBondContact OD1-N 2.95Å; D40-G43 WeakPolarHBondContact OD2-CA 3.38Å; D40-G43 PolarHBondContact OD2-N 3.3Å; D40-L44 PolarHBondContact OD1-N 3.02Å; D40-Y45 PolarHBondContact OD1-N 3.41Å; D40-Y45 WeakPolarHBondContact OD2-CB 3.49Å; D40-Y45 PolarHBondContact OD2-N 3.27Å | ||
| 41 | R | 57.7 | Low | 77 | Confident | 226 Ų | 226 | 53.7 Ų | 53.7 | 85% | 0.853 | 27% | 0.274 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.8 | -17.5 | 171.3 | -64.7 | -150.3 | -160.2 | -171.2 | 8.1 | 112.8 | S39 R157 | S39-R41 PolarHBondContact O-N 3.14Å; S39-R41 VanDerWaalsContact O-N 3.13Å; R41-R157 PolarHBondContact O-NH1 2.97Å |
| 42 | A | 61.3 | Low | 75.8 | Confident | 28 Ų | 28 | 54.2 Ų | 54.2 | 23% | 0.231 | 29% | 0.292 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -106.8 | 0.9 | -166.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | D40 L44 R157 | D40-A42 PolarHBondContact O-N 3.46Å; D40-A42 PolarHBondContact OD1-N 3.14Å; A42-L44 HydrophobicContact CB-CB 4.3Å; A42-L44 HydrophobicContact CB-CD1 3.75Å; A42-L44 HydrophobicContact CB-CG 3.73Å; A42-L44 PolarHBondContact O-N 2.95Å; A42-R157 VanDerWaalsContact C-NH1 3.27Å; A42-R157 VanDerWaalsContact O-CZ 3.3Å; A42-R157 PolarHBondContact O-NH1 2.8Å; A42-R157 PolarHBondContact O-NH2 3.21Å |
| 43 | G | 70 | Confident | 74.6 | Confident | 13 Ų | 13 | 51.7 Ų | 51.7 | 13% | 0.134 | 27% | 0.271 | C | S | . | . | S | Bend | trans | 58.6 | 13.8 | -171.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | D40 Y45 V46 L47 A154 | D40-G43 VanDerWaalsContact CG-N 3.34Å; D40-G43 WeakPolarHBondContact OD1-CA 3.2Å; D40-G43 PolarHBondContact OD1-N 2.95Å; D40-G43 WeakPolarHBondContact OD2-CA 3.38Å; D40-G43 PolarHBondContact OD2-N 3.3Å; G43-Y45 VanDerWaalsContact C-N 3.31Å; G43-V46 WeakPolarHBondContact O-CG1 3.31Å; G43-L47 WeakPolarHBondContact O-CG 3.37Å; G43-A154 WeakPolarHBondContact O-CB 3.43Å |
| 44 | L | 74.9 | Confident | 73.9 | Confident | 27 Ų | 27 | 52.3 Ų | 52.3 | 14% | 0.141 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -72.9 | -35.3 | 179.5 | -79 | 171.6 | 0 | 0 | 0 | 109.2 | D40 A42 L47 V48 F158 I227 L231 | D40-L44 PolarHBondContact OD1-N 3.02Å; A42-L44 HydrophobicContact CB-CB 4.3Å; A42-L44 HydrophobicContact CB-CD1 3.75Å; A42-L44 HydrophobicContact CB-CG 3.73Å; A42-L44 PolarHBondContact O-N 2.95Å; L44-L47 PolarHBondContact O-N 3.43Å; L44-V48 WeakPolarHBondContact O-CG2 3.32Å; L44-V48 PolarHBondContact O-N 2.9Å; L44-V48 VanDerWaalsContact O-N 3.12Å; L44-F158 HydrophobicContact CD1-CZ 4.39Å; L44-F158 HydrophobicContact CD2-CE1 4.24Å; L44-F158 HydrophobicContact CD2-CE2 3.68Å; L44-F158 HydrophobicContact CD2-CZ 3.29Å; L44-F158 HydrophobicContact CG-CE2 4.2Å; L44-F158 HydrophobicContact CG-CZ 3.69Å; L44-I227 HydrophobicContact CD2-CB 4.33Å; L44-I227 HydrophobicContact CD2-CG2 3.7Å; L44-L231 HydrophobicContact CB-CD1 4.34Å; L44-L231 HydrophobicContact CD1-CG 4.44Å; L44-L231 HydrophobicContact CD2-CD1 3.95Å |
| 45 | Y | 74.4 | Confident | 73.1 | Confident | 47 Ų | 47 | 53.1 Ų | 53.1 | 18% | 0.184 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -65.3 | -43 | 178.5 | 173.1 | -98.6 | 0 | 0 | 0 | 111.5 | D40 G43 L47 V48 Y49 W57 | D40-Y45 PolarHBondContact OD1-N 3.41Å; D40-Y45 WeakPolarHBondContact OD2-CB 3.49Å; D40-Y45 PolarHBondContact OD2-N 3.27Å; G43-Y45 VanDerWaalsContact C-N 3.31Å; Y45-L47 VanDerWaalsContact C-N 3.26Å; Y45-L47 PolarHBondContact O-N 2.72Å; Y45-V48 PolarHBondContact O-N 3.32Å; Y45-Y49 VanDerWaalsContact O-CB 3.27Å; Y45-Y49 WeakPolarHBondContact O-CB 3.45Å; Y45-Y49 PolarHBondContact O-N 3.43Å; Y45-W57 HydrophobicContact CD2-CE3 4.18Å; Y45-W57 HydrophobicContact CE1-CE3 4.14Å; Y45-W57 HydrophobicContact CE1-CZ3 4.15Å; Y45-W57 HydrophobicContact CE2-CB 3.87Å; Y45-W57 AromaticContact CE2-CD2 3.87Å; Y45-W57 HydrophobicContact CE2-CD2 3.87Å; Y45-W57 AromaticContact CE2-CE3 3.25Å; Y45-W57 HydrophobicContact CE2-CE3 3.25Å; Y45-W57 HydrophobicContact CE2-CG 4.17Å; Y45-W57 AromaticContact CE2-CZ3 3.92Å; Y45-W57 HydrophobicContact CE2-CZ3 3.92Å; Y45-W57 AromaticContact CZ-CD2 3.59Å; Y45-W57 AromaticContact CZ-CE3 3.23Å; Y45-W57 AromaticContact CZ-CG 3.99Å; Y45-W57 AromaticContact CZ-CZ3 3.69Å; Y45-W57 WeakPolarHBondContact OH-CB 3.48Å |
| 46 | V | 78.3 | Confident | 72.4 | Confident | 7 Ų | 7 | 50.5 Ų | 50.5 | 4% | 0.042 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -64 | -33.1 | 178.5 | 68.6 | 0 | 0 | 0 | 0 | 112.2 | G43 A50 I151 A154 | G43-V46 WeakPolarHBondContact O-CG1 3.31Å; V46-A50 VanDerWaalsContact O-CB 3.25Å; V46-A50 WeakPolarHBondContact O-CB 3.23Å; V46-A50 PolarHBondContact O-N 3.43Å; V46-I151 HydrophobicContact CG2-CG1 4.24Å; V46-A154 HydrophobicContact CG1-CB 4.27Å |
| 47 | L | 80 | Confident | 72 | Confident | 0 Ų | 0 | 47.9 Ų | 47.9 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -65.4 | -47.6 | 173.9 | -66.5 | 173.7 | 0 | 0 | 0 | 111.7 | G43 L44 Y45 A50 T51 F122 Q125 I151 A154 W155 F158 I227 | G43-L47 WeakPolarHBondContact O-CG 3.37Å; L44-L47 PolarHBondContact O-N 3.43Å; Y45-L47 VanDerWaalsContact C-N 3.26Å; Y45-L47 PolarHBondContact O-N 2.72Å; L47-A50 PolarHBondContact O-N 3.42Å; L47-T51 PolarHBondContact O-N 3.18Å; L47-F122 HydrophobicContact CB-CE1 4.18Å; L47-Q125 VanDerWaalsContact CD2-NE2 3.34Å; L47-I151 HydrophobicContact CD2-CG2 4.27Å; L47-A154 HydrophobicContact CD1-CB 4Å; L47-A154 HydrophobicContact CD2-CB 4.15Å; L47-A154 HydrophobicContact CG-CB 3.93Å; L47-W155 HydrophobicContact CD2-CG 4.4Å; L47-F158 HydrophobicContact CD1-CD2 4.12Å; L47-F158 HydrophobicContact CD1-CE2 3.92Å; L47-I227 HydrophobicContact CD1-CD1 4.33Å; L47-I227 HydrophobicContact CD1-CG2 4.19Å |
| 48 | V | 76.8 | Confident | 72 | Confident | 10 Ų | 10 | 51.1 Ų | 51.1 | 6% | 0.061 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -67.9 | -38 | 178.3 | 176.2 | 0 | 0 | 0 | 0 | 111.7 | L44 Y45 A50 T51 I56 F117 F122 L231 | L44-V48 WeakPolarHBondContact O-CG2 3.32Å; L44-V48 PolarHBondContact O-N 2.9Å; L44-V48 VanDerWaalsContact O-N 3.12Å; Y45-V48 PolarHBondContact O-N 3.32Å; V48-A50 VanDerWaalsContact C-N 3.29Å; V48-A50 PolarHBondContact O-N 2.92Å; V48-T51 PolarHBondContact O-N 3.29Å; V48-T51 PolarHBondContact O-OG1 3.35Å; V48-I56 HydrophobicContact CG1-CD1 3.68Å; V48-F117 HydrophobicContact CG2-CE1 3.92Å; V48-F122 HydrophobicContact CG2-CE1 4.48Å; V48-F122 HydrophobicContact CG2-CZ 4.33Å; V48-L231 HydrophobicContact CG2-CD1 3.92Å; V48-L231 HydrophobicContact CG2-CD2 4.41Å |
| 49 | Y | 74.6 | Confident | 72.1 | Confident | 106 Ų | 106 | 50.3 Ų | 50.3 | 42% | 0.416 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -60.8 | -41.9 | 175 | 177.7 | -98.4 | 0 | 0 | 0 | 111.1 | Y45 T51 G52 V147 | Y45-Y49 VanDerWaalsContact O-CB 3.27Å; Y45-Y49 WeakPolarHBondContact O-CB 3.45Å; Y45-Y49 PolarHBondContact O-N 3.43Å; Y49-T51 PolarHBondContact O-N 3.11Å; Y49-G52 PolarHBondContact O-N 3.46Å; Y49-G52 VanDerWaalsContact O-N 3.08Å; Y49-V147 HydrophobicContact CD1-CG2 4.1Å; Y49-V147 HydrophobicContact CE1-CG2 3.81Å |
| 50 | A | 75.1 | Confident | 72.2 | Confident | 25 Ų | 25 | 47.3 Ų | 47.3 | 21% | 0.207 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -69.3 | -15.5 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | V46 L47 V48 G52 Q125 V147 I151 | V46-A50 VanDerWaalsContact O-CB 3.25Å; V46-A50 WeakPolarHBondContact O-CB 3.23Å; V46-A50 PolarHBondContact O-N 3.43Å; L47-A50 PolarHBondContact O-N 3.42Å; V48-A50 VanDerWaalsContact C-N 3.29Å; V48-A50 PolarHBondContact O-N 2.92Å; A50-G52 PolarHBondContact O-N 3.22Å; A50-Q125 HydrophobicContact CB-CG 3.56Å; A50-V147 HydrophobicContact CB-CG1 4.42Å; A50-I151 HydrophobicContact CB-CD1 3.36Å; A50-I151 HydrophobicContact CB-CG1 3.87Å |
| 51 | T | 73.6 | Confident | 73.2 | Confident | 27 Ų | 27 | 49.7 Ų | 49.7 | 17% | 0.166 | 25% | 0.252 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -74.5 | 0.1 | 171 | 69.4 | 0 | 0 | 0 | 0 | 112.7 | L47 V48 Y49 L121 Q125 | L47-T51 PolarHBondContact O-N 3.18Å; V48-T51 PolarHBondContact O-N 3.29Å; V48-T51 PolarHBondContact O-OG1 3.35Å; Y49-T51 PolarHBondContact O-N 3.11Å; T51-L121 HydrophobicContact CG2-CB 4.1Å; T51-Q125 HydrophobicContact CG2-CB 4.38Å |
| 52 | G | 66.3 | Low | 74.5 | Confident | 63 Ų | 63 | 42.6 Ų | 42.6 | 65% | 0.649 | 23% | 0.23 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 82.4 | 15.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | Y49 A50 | Y49-G52 PolarHBondContact O-N 3.46Å; Y49-G52 VanDerWaalsContact O-N 3.08Å; A50-G52 PolarHBondContact O-N 3.22Å |
| 53 | N | 66.6 | Low | 75.7 | Confident | 2 Ų | 2 | 41.5 Ų | 41.5 | 1% | 0.011 | 22% | 0.221 | C | C | . | . | trans | -100.9 | 87.3 | 177.7 | -168.7 | 6.7 | 0 | 0 | 0 | 112.2 | S55 I56 W116 | N53-S55 PolarHBondContact O-N 3.15Å; N53-S55 WeakPolarHBondContact OD1-CB 3.33Å; N53-S55 PolarHBondContact OD1-N 3.39Å; N53-S55 PolarHBondContact OD1-OG 3.21Å; N53-I56 VanDerWaalsContact ND2-CD1 3.29Å; N53-I56 WeakPolarHBondContact ND2-CD1 3.2Å; N53-I56 WeakPolarHBondContact ND2-CG1 3.47Å; N53-W116 HydrophobicContact CB-CD2 4.17Å; N53-W116 HydrophobicContact CB-CE3 3.24Å; N53-W116 HydrophobicContact CB-CH2 4.01Å; N53-W116 HydrophobicContact CB-CZ3 3.14Å; N53-W116 VanDerWaalsContact ND2-CZ3 3.26Å; N53-W116 WeakPolarHBondContact ND2-CZ3 2.98Å; N53-W116 WeakPolarHBondContact OD1-CH2 3.26Å; N53-W116 WeakPolarHBondContact OD1-CZ3 3.17Å | ||
| 54 | D | 69 | Low | 76.6 | Confident | 72 Ų | 72 | 42.1 Ų | 42.1 | 39% | 0.385 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -73.5 | -9 | 173.5 | 66.7 | -23.3 | 0 | 0 | 0 | 113.3 | W57 R58 | D54-W57 PolarHBondContact O-N 3.45Å; D54-R58 WeakPolarHBondContact O-CG 3.5Å; D54-R58 PolarHBondContact O-N 3.4Å; D54-R58 VanDerWaalsContact O-N 3.09Å; D54-R58 PolarHBondContact O-NE 3.44Å; D54-R58 IonicContact OD1-CZ 3.46Å; D54-R58 IonicContact OD1-NH2 2.79Å; D54-R58 PolarHBondContact OD1-NH2 3.32Å; D54-R58 IonicContact OD2-CZ 2.93Å; D54-R58 IonicContact OD2-NE 3.59Å; D54-R58 IonicContact OD2-NH1 3.02Å; D54-R58 PolarHBondContact OD2-NH1 3.04Å; D54-R58 IonicContact OD2-NH2 3.78Å; D54-R58 PolarHBondContact OD2-NH2 3.11Å |
| 55 | S | 69 | Low | 77.5 | Confident | 27 Ų | 27 | 47.1 Ų | 47.1 | 19% | 0.189 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -70.2 | -34.4 | -177.4 | -53.9 | 0 | 0 | 0 | 0 | 112.9 | N53 R58 G59 | N53-S55 PolarHBondContact O-N 3.15Å; N53-S55 WeakPolarHBondContact OD1-CB 3.33Å; N53-S55 PolarHBondContact OD1-N 3.39Å; N53-S55 PolarHBondContact OD1-OG 3.21Å; S55-R58 PolarHBondContact OG-NH2 2.99Å; S55-G59 PolarHBondContact O-N 3.42Å |
| 56 | I | 71.5 | Confident | 78.4 | Confident | 31 Ų | 31 | 45.3 Ų | 45.3 | 16% | 0.159 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -68 | -42.8 | 177 | -67.2 | 168.3 | 0 | 0 | 0 | 110.5 | V48 N53 G59 A60 F117 | V48-I56 HydrophobicContact CG1-CD1 3.68Å; N53-I56 VanDerWaalsContact ND2-CD1 3.29Å; N53-I56 WeakPolarHBondContact ND2-CD1 3.2Å; N53-I56 WeakPolarHBondContact ND2-CG1 3.47Å; I56-G59 PolarHBondContact O-N 3.47Å; I56-A60 PolarHBondContact O-N 3.3Å; I56-F117 HydrophobicContact CD1-CZ 4.14Å |
| 57 | W | 74.4 | Confident | 79.1 | Confident | 83 Ų | 83 | 45 Ų | 45 | 31% | 0.314 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -58.7 | -51.8 | 175.1 | 173.8 | -121.6 | 0 | 0 | 0 | 111.8 | I38 Y45 D54 G59 A60 W61 | I38-W57 HydrophobicContact CB-CZ3 4.46Å; I38-W57 HydrophobicContact CG1-CZ3 4.21Å; I38-W57 HydrophobicContact CG2-CH2 4.17Å; I38-W57 HydrophobicContact CG2-CZ3 3.96Å; Y45-W57 HydrophobicContact CD2-CE3 4.18Å; Y45-W57 HydrophobicContact CE1-CE3 4.14Å; Y45-W57 HydrophobicContact CE1-CZ3 4.15Å; Y45-W57 HydrophobicContact CE2-CB 3.87Å; Y45-W57 AromaticContact CE2-CD2 3.87Å; Y45-W57 HydrophobicContact CE2-CD2 3.87Å; Y45-W57 AromaticContact CE2-CE3 3.25Å; Y45-W57 HydrophobicContact CE2-CE3 3.25Å; Y45-W57 HydrophobicContact CE2-CG 4.17Å; Y45-W57 AromaticContact CE2-CZ3 3.92Å; Y45-W57 HydrophobicContact CE2-CZ3 3.92Å; Y45-W57 AromaticContact CZ-CD2 3.59Å; Y45-W57 AromaticContact CZ-CE3 3.23Å; Y45-W57 AromaticContact CZ-CG 3.99Å; Y45-W57 AromaticContact CZ-CZ3 3.69Å; Y45-W57 WeakPolarHBondContact OH-CB 3.48Å; D54-W57 PolarHBondContact O-N 3.45Å; W57-G59 VanDerWaalsContact C-N 3.28Å; W57-G59 PolarHBondContact O-N 2.85Å; W57-A60 PolarHBondContact O-N 2.99Å; W57-W61 AromaticContact CD2-CD1 3.59Å; W57-W61 AromaticContact CD2-NE1 3.56Å; W57-W61 AromaticContact CE2-CD1 3.51Å; W57-W61 AromaticContact CE2-NE1 3.16Å; W57-W61 AromaticContact CE3-CD1 3.8Å; W57-W61 AromaticContact CE3-NE1 3.57Å; W57-W61 AromaticContact CH2-CE2 3.85Å; W57-W61 HydrophobicContact CH2-CZ2 4.08Å; W57-W61 AromaticContact CH2-NE1 3.02Å; W57-W61 AromaticContact CZ2-CD1 3.77Å; W57-W61 AromaticContact CZ2-CE2 3.82Å; W57-W61 HydrophobicContact CZ2-CZ2 4.2Å; W57-W61 AromaticContact CZ2-NE1 2.91Å; W57-W61 AromaticContact CZ3-NE1 3.34Å; W57-W61 VanDerWaalsContact CZ3-NE1 3.34Å; W57-W61 AromaticContact NE1-CD1 3.95Å; W57-W61 AromaticContact NE1-NE1 3.92Å; W57-W61 PolarHBondContact O-N 2.97Å |
| 58 | R | 77.7 | Confident | 79.8 | Confident | 123 Ų | 123 | 50.4 Ų | 50.4 | 46% | 0.464 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -59.5 | -41.7 | 177.2 | -70.3 | -178.9 | -65 | -158.4 | -0.7 | 111.1 | D54 S55 A60 W61 I62 | D54-R58 WeakPolarHBondContact O-CG 3.5Å; D54-R58 PolarHBondContact O-N 3.4Å; D54-R58 VanDerWaalsContact O-N 3.09Å; D54-R58 PolarHBondContact O-NE 3.44Å; D54-R58 IonicContact OD1-CZ 3.46Å; D54-R58 IonicContact OD1-NH2 2.79Å; D54-R58 PolarHBondContact OD1-NH2 3.32Å; D54-R58 IonicContact OD2-CZ 2.93Å; D54-R58 IonicContact OD2-NE 3.59Å; D54-R58 IonicContact OD2-NH1 3.02Å; D54-R58 PolarHBondContact OD2-NH1 3.04Å; D54-R58 IonicContact OD2-NH2 3.78Å; D54-R58 PolarHBondContact OD2-NH2 3.11Å; S55-R58 PolarHBondContact OG-NH2 2.99Å; R58-A60 PolarHBondContact O-N 3.35Å; R58-W61 PolarHBondContact O-N 2.83Å; R58-I62 WeakPolarHBondContact O-CB 3.3Å; R58-I62 WeakPolarHBondContact O-CD1 3.27Å; R58-I62 VanDerWaalsContact O-CG1 3.22Å; R58-I62 WeakPolarHBondContact O-CG1 3.41Å; R58-I62 PolarHBondContact O-N 3.19Å |
| 59 | G | 79.1 | Confident | 80.8 | Confident | 19 Ų | 19 | 51.3 Ų | 51.3 | 20% | 0.196 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -59.9 | -43.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | S55 I56 W57 I62 G63 | S55-G59 PolarHBondContact O-N 3.42Å; I56-G59 PolarHBondContact O-N 3.47Å; W57-G59 VanDerWaalsContact C-N 3.28Å; W57-G59 PolarHBondContact O-N 2.85Å; G59-I62 PolarHBondContact O-N 3.41Å; G59-G63 PolarHBondContact O-N 3.03Å |
| 60 | A | 80.8 | Confident | 81.8 | Confident | 16 Ų | 16 | 46.5 Ų | 46.5 | 13% | 0.132 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -64 | -41.1 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | I38 I56 W57 R58 G63 L64 | I38-A60 HydrophobicContact CD1-CB 4.36Å; I38-A60 HydrophobicContact CG1-CB 4.03Å; I56-A60 PolarHBondContact O-N 3.3Å; W57-A60 PolarHBondContact O-N 2.99Å; R58-A60 PolarHBondContact O-N 3.35Å; A60-G63 PolarHBondContact O-N 2.95Å; A60-L64 PolarHBondContact O-N 2.89Å |
| 61 | W | 85.2 | Confident | 82.8 | Confident | 92 Ų | 92 | 48.6 Ų | 48.6 | 35% | 0.348 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -67.9 | -42.2 | 174.4 | -81.4 | 96.4 | 0 | 0 | 0 | 112.9 | I38 W57 R58 G63 L64 F65 | I38-W61 HydrophobicContact CD1-CD2 4.06Å; I38-W61 HydrophobicContact CD1-CG 4.25Å; I38-W61 HydrophobicContact CG2-CZ2 4.23Å; W57-W61 AromaticContact CD2-CD1 3.59Å; W57-W61 AromaticContact CD2-NE1 3.56Å; W57-W61 AromaticContact CE2-CD1 3.51Å; W57-W61 AromaticContact CE2-NE1 3.16Å; W57-W61 AromaticContact CE3-CD1 3.8Å; W57-W61 AromaticContact CE3-NE1 3.57Å; W57-W61 AromaticContact CH2-CE2 3.85Å; W57-W61 HydrophobicContact CH2-CZ2 4.08Å; W57-W61 AromaticContact CH2-NE1 3.02Å; W57-W61 AromaticContact CZ2-CD1 3.77Å; W57-W61 AromaticContact CZ2-CE2 3.82Å; W57-W61 HydrophobicContact CZ2-CZ2 4.2Å; W57-W61 AromaticContact CZ2-NE1 2.91Å; W57-W61 AromaticContact CZ3-NE1 3.34Å; W57-W61 VanDerWaalsContact CZ3-NE1 3.34Å; W57-W61 AromaticContact NE1-CD1 3.95Å; W57-W61 AromaticContact NE1-NE1 3.92Å; W57-W61 PolarHBondContact O-N 2.97Å; R58-W61 PolarHBondContact O-N 2.83Å; W61-G63 VanDerWaalsContact C-N 3.32Å; W61-G63 PolarHBondContact O-N 3.42Å; W61-L64 HydrophobicContact CE3-CD2 3.81Å; W61-L64 HydrophobicContact CZ3-CD2 3.84Å; W61-L64 WeakPolarHBondContact O-CB 3.26Å; W61-L64 PolarHBondContact O-N 2.97Å; W61-F65 HydrophobicContact CE3-CD2 4.47Å; W61-F65 AromaticContact CE3-CE2 3.62Å; W61-F65 HydrophobicContact CE3-CE2 3.62Å; W61-F65 AromaticContact CE3-CZ 3.96Å; W61-F65 HydrophobicContact CE3-CZ 3.96Å; W61-F65 HydrophobicContact CZ3-CE2 4.26Å; W61-F65 HydrophobicContact CZ3-CZ 4.13Å; W61-F65 WeakPolarHBondContact O-CD2 3.31Å; W61-F65 PolarHBondContact O-N 3.1Å; W61-F65 VanDerWaalsContact O-N 3.08Å |
| 62 | I | 85.7 | Confident | 84 | Confident | 77 Ų | 77 | 49.9 Ų | 49.9 | 40% | 0.395 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -58.4 | -48.5 | 174.4 | -69.3 | 164.5 | 0 | 0 | 0 | 109.3 | R58 G59 L64 F65 T66 | R58-I62 WeakPolarHBondContact O-CB 3.3Å; R58-I62 WeakPolarHBondContact O-CD1 3.27Å; R58-I62 VanDerWaalsContact O-CG1 3.22Å; R58-I62 WeakPolarHBondContact O-CG1 3.41Å; R58-I62 PolarHBondContact O-N 3.19Å; G59-I62 PolarHBondContact O-N 3.41Å; I62-L64 VanDerWaalsContact C-N 3.32Å; I62-L64 PolarHBondContact O-N 3.21Å; I62-F65 PolarHBondContact O-N 3.41Å; I62-T66 WeakPolarHBondContact O-CB 3.32Å; I62-T66 PolarHBondContact O-N 3.46Å; I62-T66 PolarHBondContact O-OG1 3.04Å |
| 63 | G | 86 | Confident | 85.5 | Confident | 4 Ų | 4 | 47.5 Ų | 47.5 | 4% | 0.041 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -59 | -39.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | C34 G59 A60 W61 T66 G67 | C34-G63 VanDerWaalsContact SG-C 3.55Å; G59-G63 PolarHBondContact O-N 3.03Å; A60-G63 PolarHBondContact O-N 2.95Å; W61-G63 VanDerWaalsContact C-N 3.32Å; W61-G63 PolarHBondContact O-N 3.42Å; G63-T66 PolarHBondContact O-N 3.48Å; G63-G67 PolarHBondContact O-N 3.4Å |
| 64 | L | 90.5 | Very high | 86.9 | Confident | 27 Ų | 27 | 47.4 Ų | 47.4 | 14% | 0.141 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -58.8 | -52.4 | 175.5 | -179.5 | 72.6 | 0 | 0 | 0 | 111.8 | M31 C34 I35 I38 A60 W61 I62 G67 F68 | M31-L64 HydrophobicContact CG-CD1 3.63Å; C34-L64 HydrophobicContact CB-CB 3.92Å; C34-L64 HydrophobicContact CB-CD1 4.18Å; I35-L64 HydrophobicContact CD1-CD1 4.08Å; I35-L64 HydrophobicContact CG1-CD1 3.4Å; I38-L64 HydrophobicContact CD1-CB 4.38Å; I38-L64 HydrophobicContact CD1-CD2 4.09Å; A60-L64 PolarHBondContact O-N 2.89Å; W61-L64 HydrophobicContact CE3-CD2 3.81Å; W61-L64 HydrophobicContact CZ3-CD2 3.84Å; W61-L64 WeakPolarHBondContact O-CB 3.26Å; W61-L64 PolarHBondContact O-N 2.97Å; I62-L64 VanDerWaalsContact C-N 3.32Å; I62-L64 PolarHBondContact O-N 3.21Å; L64-G67 PolarHBondContact O-N 3.18Å; L64-F68 PolarHBondContact O-N 3.36Å; L64-F68 VanDerWaalsContact O-N 3.12Å |
| 65 | F | 92.3 | Very high | 88.3 | Confident | 131 Ų | 131 | 47.7 Ų | 47.7 | 58% | 0.575 | 24% | 0.235 | S | C | * | . | H | α-helix | trans | -68.5 | -37.7 | -179.2 | -71.1 | -62.4 | 0 | 0 | 0 | 112 | W61 I62 F68 A69 | W61-F65 HydrophobicContact CE3-CD2 4.47Å; W61-F65 AromaticContact CE3-CE2 3.62Å; W61-F65 HydrophobicContact CE3-CE2 3.62Å; W61-F65 AromaticContact CE3-CZ 3.96Å; W61-F65 HydrophobicContact CE3-CZ 3.96Å; W61-F65 HydrophobicContact CZ3-CE2 4.26Å; W61-F65 HydrophobicContact CZ3-CZ 4.13Å; W61-F65 WeakPolarHBondContact O-CD2 3.31Å; W61-F65 PolarHBondContact O-N 3.1Å; W61-F65 VanDerWaalsContact O-N 3.08Å; I62-F65 PolarHBondContact O-N 3.41Å; F65-F68 PolarHBondContact O-N 3.14Å; F65-A69 WeakPolarHBondContact O-CB 3.29Å; F65-A69 PolarHBondContact O-N 3.4Å |
| 66 | T | 92.9 | Very high | 89.6 | Confident | 10 Ų | 10 | 49.8 Ų | 49.8 | 6% | 0.061 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -62.9 | -43.1 | 174.8 | -61.3 | 0 | 0 | 0 | 0 | 111.4 | I62 G63 F68 A69 L70 I99 E103 | I62-T66 WeakPolarHBondContact O-CB 3.32Å; I62-T66 PolarHBondContact O-N 3.46Å; I62-T66 PolarHBondContact O-OG1 3.04Å; G63-T66 PolarHBondContact O-N 3.48Å; T66-F68 PolarHBondContact O-N 2.9Å; T66-A69 PolarHBondContact O-N 3.26Å; T66-L70 HydrophobicContact CG2-CD1 4.38Å; T66-L70 WeakPolarHBondContact O-CB 3.44Å; T66-L70 WeakPolarHBondContact O-CG 3.49Å; T66-L70 PolarHBondContact O-N 3.38Å; T66-I99 HydrophobicContact CG2-CG2 4.04Å; T66-E103 HydrophobicContact CG2-CB 3.83Å; T66-E103 HydrophobicContact CG2-CG 4.47Å; T66-E103 WeakPolarHBondContact CG2-OE2 3.43Å |
| 67 | G | 93.8 | Very high | 90.8 | Very high | 0 Ų | 0 | 48.3 Ų | 48.3 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -61.1 | -43.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113 | G27 G63 L64 L70 F71 | G27-G67 CarbonylContact C-O 3.43Å; G27-G67 WeakPolarHBondContact CA-O 3.39Å; G27-G67 CarbonylContact O-C 3.49Å; G27-G67 WeakPolarHBondContact O-CA 3.36Å; G63-G67 PolarHBondContact O-N 3.4Å; L64-G67 PolarHBondContact O-N 3.18Å; G67-L70 PolarHBondContact O-N 3.45Å; G67-F71 PolarHBondContact O-N 2.93Å; G67-F71 VanDerWaalsContact O-N 3.11Å |
| 68 | F | 95.8 | Very high | 91.8 | Very high | 113 Ų | 113 | 46 Ų | 46 | 50% | 0.496 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -63.2 | -44.6 | 173.7 | 179.4 | -106.2 | 0 | 0 | 0 | 112.2 | M31 L64 F65 T66 L70 F71 C72 | M31-F68 HydrophobicContact SD-CB 4.16Å; M31-F68 HydrophobicContact SD-CD2 4.19Å; L64-F68 PolarHBondContact O-N 3.36Å; L64-F68 VanDerWaalsContact O-N 3.12Å; F65-F68 PolarHBondContact O-N 3.14Å; T66-F68 PolarHBondContact O-N 2.9Å; F68-L70 PolarHBondContact O-N 3.49Å; F68-F71 WeakPolarHBondContact O-CB 3.48Å; F68-F71 PolarHBondContact O-N 2.92Å; F68-C72 PolarHBondContact O-N 3Å |
| 69 | A | 96.4 | Very high | 92.7 | Very high | 30 Ų | 30 | 45.2 Ų | 45.2 | 25% | 0.248 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -63.4 | -41 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | F65 T66 F71 C72 T73 I99 | F65-A69 WeakPolarHBondContact O-CB 3.29Å; F65-A69 PolarHBondContact O-N 3.4Å; T66-A69 PolarHBondContact O-N 3.26Å; A69-F71 VanDerWaalsContact C-N 3.31Å; A69-F71 PolarHBondContact O-N 3.44Å; A69-C72 PolarHBondContact O-N 3.39Å; A69-T73 WeakPolarHBondContact O-CB 3.43Å; A69-T73 PolarHBondContact O-N 3.44Å; A69-T73 PolarHBondContact O-OG1 3.23Å; A69-I99 HydrophobicContact CB-CD1 3.8Å; A69-I99 HydrophobicContact CB-CG1 4.06Å |
| 70 | L | 95.8 | Very high | 93.4 | Very high | 4 Ų | 4 | 44.3 Ų | 44.3 | 2% | 0.021 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -57.3 | -45 | 173.7 | -81.2 | 171.8 | 0 | 0 | 0 | 111.1 | I23 L30 T66 G67 F68 S74 M96 I99 I245 | I23-L70 HydrophobicContact CG2-CD2 3.93Å; L30-L70 HydrophobicContact CD2-CD1 4.25Å; T66-L70 HydrophobicContact CG2-CD1 4.38Å; T66-L70 WeakPolarHBondContact O-CB 3.44Å; T66-L70 WeakPolarHBondContact O-CG 3.49Å; T66-L70 PolarHBondContact O-N 3.38Å; G67-L70 PolarHBondContact O-N 3.45Å; F68-L70 PolarHBondContact O-N 3.49Å; L70-S74 WeakPolarHBondContact O-CB 3.28Å; L70-S74 PolarHBondContact O-N 2.72Å; L70-S74 PolarHBondContact O-OG 3.15Å; L70-M96 HydrophobicContact CD2-CE 4.27Å; L70-M96 HydrophobicContact CD2-SD 4.4Å; L70-I99 HydrophobicContact CD2-CG2 3.45Å; L70-I99 VanDerWaalsContact CD2-CG2 3.45Å; L70-I99 HydrophobicContact CG-CG2 3.54Å; L70-I245 HydrophobicContact CD1-CG2 4.31Å |
| 71 | F | 97.5 | Very high | 94.1 | Very high | 70 Ų | 70 | 43.6 Ų | 43.6 | 31% | 0.307 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -59.5 | -55.3 | 176.2 | 172.2 | -106.4 | 0 | 0 | 0 | 111.3 | A24 I28 G67 F68 A69 T73 S74 I75 | A24-F71 HydrophobicContact CB-CD2 4.04Å; I28-F71 HydrophobicContact CD1-CD2 3.67Å; I28-F71 HydrophobicContact CD1-CE2 3.67Å; I28-F71 HydrophobicContact CG1-CB 4.44Å; I28-F71 HydrophobicContact CG1-CD2 3.65Å; I28-F71 HydrophobicContact CG1-CE2 4.14Å; I28-F71 HydrophobicContact CG1-CG 4.11Å; G67-F71 PolarHBondContact O-N 2.93Å; G67-F71 VanDerWaalsContact O-N 3.11Å; F68-F71 WeakPolarHBondContact O-CB 3.48Å; F68-F71 PolarHBondContact O-N 2.92Å; A69-F71 VanDerWaalsContact C-N 3.31Å; A69-F71 PolarHBondContact O-N 3.44Å; F71-T73 PolarHBondContact O-N 2.94Å; F71-S74 PolarHBondContact O-N 3Å; F71-I75 HydrophobicContact CE2-CD1 4.16Å; F71-I75 HydrophobicContact CE2-CG1 4.2Å; F71-I75 HydrophobicContact CZ-CD1 4.48Å; F71-I75 HydrophobicContact CZ-CG1 4.21Å; F71-I75 WeakPolarHBondContact O-CG1 3.3Å; F71-I75 PolarHBondContact O-N 2.91Å; F71-I75 VanDerWaalsContact O-N 3.15Å |
| 72 | C | 97.7 | Very high | 94.4 | Very high | 53 Ų | 53 | 44.1 Ų | 44.1 | 36% | 0.358 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -60.7 | -47.1 | -178.7 | -68 | 0 | 0 | 0 | 0 | 112.9 | F68 A69 S74 I75 F76 | F68-C72 PolarHBondContact O-N 3Å; A69-C72 PolarHBondContact O-N 3.39Å; C72-S74 VanDerWaalsContact C-N 3.29Å; C72-S74 PolarHBondContact O-N 3.23Å; C72-I75 PolarHBondContact O-N 2.92Å; C72-F76 PolarHBondContact O-N 2.88Å |
| 73 | T | 96.9 | Very high | 94.7 | Very high | 14 Ų | 14 | 42.8 Ų | 42.8 | 9% | 0.086 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -67.9 | -29.9 | -179.3 | -63.7 | 0 | 0 | 0 | 0 | 111.8 | A69 F71 F76 G77 Y92 L95 M96 I99 | A69-T73 WeakPolarHBondContact O-CB 3.43Å; A69-T73 PolarHBondContact O-N 3.44Å; A69-T73 PolarHBondContact O-OG1 3.23Å; F71-T73 PolarHBondContact O-N 2.94Å; T73-F76 PolarHBondContact O-N 3.12Å; T73-G77 PolarHBondContact O-N 3.34Å; T73-Y92 HydrophobicContact CG2-CD2 3.89Å; T73-Y92 HydrophobicContact CG2-CE2 4.04Å; T73-Y92 WeakPolarHBondContact O-CE2 3.39Å; T73-L95 HydrophobicContact CG2-CB 4.08Å; T73-M96 HydrophobicContact CG2-CB 4.25Å; T73-M96 HydrophobicContact CG2-SD 3.63Å; T73-I99 HydrophobicContact CG2-CD1 4.07Å; T73-I99 WeakPolarHBondContact OG1-CD1 3.14Å |
| 74 | S | 97.3 | Very high | 94.7 | Very high | 0 Ų | 0 | 43.7 Ų | 43.7 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -68.6 | -41 | 173.8 | -62 | 0 | 0 | 0 | 0 | 112.5 | N20 I23 L70 F71 C72 F76 G77 M78 | N20-S74 WeakPolarHBondContact O-CB 3.27Å; I23-S74 WeakPolarHBondContact CB-OG 3.38Å; I23-S74 VanDerWaalsContact CG2-OG 3.24Å; I23-S74 WeakPolarHBondContact CG2-OG 3.47Å; L70-S74 WeakPolarHBondContact O-CB 3.28Å; L70-S74 PolarHBondContact O-N 2.72Å; L70-S74 PolarHBondContact O-OG 3.15Å; F71-S74 PolarHBondContact O-N 3Å; C72-S74 VanDerWaalsContact C-N 3.29Å; C72-S74 PolarHBondContact O-N 3.23Å; S74-F76 VanDerWaalsContact C-N 3.34Å; S74-G77 PolarHBondContact O-N 2.99Å; S74-M78 PolarHBondContact O-N 3.37Å |
| 75 | I | 97.3 | Very high | 94.8 | Very high | 77 Ų | 77 | 48.8 Ų | 48.8 | 40% | 0.395 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -61.5 | -45.6 | 172.2 | -58.3 | -51.7 | 0 | 0 | 0 | 110.4 | A24 F71 C72 G77 M78 H79 | A24-I75 HydrophobicContact CB-CD1 4.4Å; F71-I75 HydrophobicContact CE2-CD1 4.16Å; F71-I75 HydrophobicContact CE2-CG1 4.2Å; F71-I75 HydrophobicContact CZ-CD1 4.48Å; F71-I75 HydrophobicContact CZ-CG1 4.21Å; F71-I75 WeakPolarHBondContact O-CG1 3.3Å; F71-I75 PolarHBondContact O-N 2.91Å; F71-I75 VanDerWaalsContact O-N 3.15Å; C72-I75 PolarHBondContact O-N 2.92Å; I75-G77 VanDerWaalsContact C-N 3.29Å; I75-G77 PolarHBondContact O-N 2.69Å; I75-M78 HydrophobicContact CD1-CE 3.33Å; I75-M78 HydrophobicContact CG1-CE 4.44Å; I75-M78 PolarHBondContact O-N 3.22Å; I75-H79 PolarHBondContact O-N 3.03Å; I75-H79 VanDerWaalsContact O-N 3.16Å |
| 76 | F | 97.4 | Very high | 94.6 | Very high | 71 Ų | 71 | 47 Ų | 47 | 31% | 0.311 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -60.2 | -39.3 | 174.9 | 177.6 | -113.3 | 0 | 0 | 0 | 112.1 | C72 T73 S74 H79 A80 I88 A91 Y92 L95 | C72-F76 PolarHBondContact O-N 2.88Å; T73-F76 PolarHBondContact O-N 3.12Å; S74-F76 VanDerWaalsContact C-N 3.34Å; F76-H79 PolarHBondContact O-N 2.94Å; F76-A80 WeakPolarHBondContact O-CB 3.45Å; F76-A80 PolarHBondContact O-N 2.92Å; F76-I88 HydrophobicContact CE2-CG2 3.89Å; F76-I88 HydrophobicContact CZ-CG2 3.68Å; F76-A91 HydrophobicContact CE1-CB 4.41Å; F76-A91 HydrophobicContact CZ-CB 4.41Å; F76-Y92 HydrophobicContact CD1-CD2 4.29Å; F76-L95 HydrophobicContact CD1-CD1 4.39Å; F76-L95 HydrophobicContact CE1-CD1 4.25Å |
| 77 | G | 96.3 | Very high | 94.6 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -61.8 | -45.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | T73 S74 I75 H79 A80 I81 | T73-G77 PolarHBondContact O-N 3.34Å; S74-G77 PolarHBondContact O-N 2.99Å; I75-G77 VanDerWaalsContact C-N 3.29Å; I75-G77 PolarHBondContact O-N 2.69Å; G77-H79 VanDerWaalsContact C-N 3.31Å; G77-H79 PolarHBondContact O-N 3.49Å; G77-A80 WeakPolarHBondContact O-CB 3.25Å; G77-A80 PolarHBondContact O-N 2.9Å; G77-I81 WeakPolarHBondContact O-CD1 3.31Å; G77-I81 VanDerWaalsContact O-CG1 3.27Å; G77-I81 WeakPolarHBondContact O-CG1 3.37Å; G77-I81 PolarHBondContact O-N 3.48Å |
| 78 | M | 96.3 | Very high | 94.6 | Very high | 36 Ų | 36 | 55.2 Ų | 55.2 | 18% | 0.177 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -58.2 | -45.4 | 173.9 | -69.2 | -171.5 | -73.1 | 0 | 0 | 111.3 | I17 N20 L21 S74 I75 I81 V82 | I17-M78 HydrophobicContact CG2-CG 4.04Å; I17-M78 HydrophobicContact CG2-SD 3.98Å; N20-M78 HydrophobicContact CB-CG 3.65Å; L21-M78 HydrophobicContact CB-SD 4.32Å; S74-M78 PolarHBondContact O-N 3.37Å; I75-M78 HydrophobicContact CD1-CE 3.33Å; I75-M78 HydrophobicContact CG1-CE 4.44Å; I75-M78 PolarHBondContact O-N 3.22Å; M78-I81 PolarHBondContact O-N 2.74Å; M78-V82 WeakPolarHBondContact O-CG2 3.36Å; M78-V82 PolarHBondContact O-N 2.92Å; M78-V82 VanDerWaalsContact O-N 3.11Å |
| 79 | H | 95.7 | Very high | 94.5 | Very high | 105 Ų | 105 | 49.9 Ų | 49.9 | 49% | 0.486 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -63.4 | -42.5 | 175.3 | 176.2 | -93.6 | 0 | 0 | 0 | 112.3 | I75 F76 G77 I81 V82 V83 | I75-H79 PolarHBondContact O-N 3.03Å; I75-H79 VanDerWaalsContact O-N 3.16Å; F76-H79 PolarHBondContact O-N 2.94Å; G77-H79 VanDerWaalsContact C-N 3.31Å; G77-H79 PolarHBondContact O-N 3.49Å; H79-I81 VanDerWaalsContact C-N 3.33Å; H79-I81 PolarHBondContact O-N 3.12Å; H79-V82 PolarHBondContact O-N 2.66Å; H79-V83 WeakPolarHBondContact O-CG2 3.42Å; H79-V83 PolarHBondContact O-N 3.23Å |
| 80 | A | 94.6 | Very high | 94.4 | Very high | 0 Ų | 0 | 51.6 Ų | 51.6 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -60.9 | -41 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | F76 G77 S84 I88 L89 | F76-A80 WeakPolarHBondContact O-CB 3.45Å; F76-A80 PolarHBondContact O-N 2.92Å; G77-A80 WeakPolarHBondContact O-CB 3.25Å; G77-A80 PolarHBondContact O-N 2.9Å; A80-S84 PolarHBondContact O-N 3Å; A80-I88 HydrophobicContact CB-CG2 3.7Å; A80-L89 HydrophobicContact CB-CD1 3.94Å |
| 81 | I | 94.3 | Very high | 94.4 | Very high | 1 Ų | 1 | 53.4 Ų | 53.4 | 1% | 0.005 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -65.8 | -44.9 | 176.5 | -65.4 | 157.6 | 0 | 0 | 0 | 110.7 | R13 L16 I17 G77 M78 H79 V83 S84 L89 V256 | R13-I81 HydrophobicContact CB-CG2 3.96Å; R13-I81 HydrophobicContact CG-CG2 4.19Å; L16-I81 HydrophobicContact CB-CD1 3.63Å; L16-I81 HydrophobicContact CB-CG1 4.46Å; I17-I81 HydrophobicContact CD1-CG2 4.18Å; I17-I81 HydrophobicContact CG1-CB 4.24Å; I17-I81 HydrophobicContact CG1-CD1 4.33Å; I17-I81 HydrophobicContact CG1-CG2 3.94Å; G77-I81 WeakPolarHBondContact O-CD1 3.31Å; G77-I81 VanDerWaalsContact O-CG1 3.27Å; G77-I81 WeakPolarHBondContact O-CG1 3.37Å; G77-I81 PolarHBondContact O-N 3.48Å; M78-I81 PolarHBondContact O-N 2.74Å; H79-I81 VanDerWaalsContact C-N 3.33Å; H79-I81 PolarHBondContact O-N 3.12Å; I81-V83 PolarHBondContact O-N 2.92Å; I81-S84 PolarHBondContact O-N 3.46Å; I81-S84 PolarHBondContact O-OG 3.28Å; I81-L89 HydrophobicContact CG1-CD1 4.17Å; I81-V256 HydrophobicContact CD1-CG2 4.25Å |
| 82 | V | 92.6 | Very high | 94.4 | Very high | 103 Ų | 103 | 50 Ų | 50 | 62% | 0.624 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -61.7 | -43.9 | 178.4 | 171.2 | 0 | 0 | 0 | 0 | 111.6 | I17 M78 H79 | I17-V82 HydrophobicContact CD1-CG2 3.91Å; M78-V82 WeakPolarHBondContact O-CG2 3.36Å; M78-V82 PolarHBondContact O-N 2.92Å; M78-V82 VanDerWaalsContact O-N 3.11Å; H79-V82 PolarHBondContact O-N 2.66Å |
| 83 | V | 91 | Very high | 94.3 | Very high | 50 Ų | 50 | 48.3 Ų | 48.3 | 30% | 0.303 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -74.8 | -29.1 | -178.8 | 174.4 | 0 | 0 | 0 | 0 | 112 | H79 I81 K85 I88 | H79-V83 WeakPolarHBondContact O-CG2 3.42Å; H79-V83 PolarHBondContact O-N 3.23Å; I81-V83 PolarHBondContact O-N 2.92Å; V83-K85 HydrophobicContact CG1-CB 4.03Å; V83-K85 HydrophobicContact CG1-CD 3.63Å; V83-K85 HydrophobicContact CG1-CG 3.64Å; V83-K85 PolarHBondContact O-N 2.97Å; V83-K85 VanDerWaalsContact O-N 3.07Å; V83-I88 HydrophobicContact CG1-CD1 3.87Å |
| 84 | S | 87.3 | Confident | 94.3 | Very high | 23 Ų | 23 | 52.5 Ų | 52.5 | 16% | 0.161 | 27% | 0.27 | C | S | . | . | trans | 53.7 | 28.3 | 176.7 | -57.7 | 0 | 0 | 0 | 0 | 115.1 | R13 A80 I81 | R13-S84 PolarHBondContact NH1-OG 3.41Å; A80-S84 PolarHBondContact O-N 3Å; I81-S84 PolarHBondContact O-N 3.46Å; I81-S84 PolarHBondContact O-OG 3.28Å | ||
| 85 | K | 91.3 | Very high | 94.3 | Very high | 133 Ų | 133 | 56.4 Ų | 56.4 | 58% | 0.578 | 29% | 0.29 | S | S | * | . | trans | -87.8 | 128.3 | 173.5 | -74.4 | 177.3 | -174 | -179.2 | 0 | 109.8 | V83 N87 I88 L89 | V83-K85 HydrophobicContact CG1-CB 4.03Å; V83-K85 HydrophobicContact CG1-CD 3.63Å; V83-K85 HydrophobicContact CG1-CG 3.64Å; V83-K85 PolarHBondContact O-N 2.97Å; V83-K85 VanDerWaalsContact O-N 3.07Å; K85-N87 VanDerWaalsContact C-N 3.31Å; K85-N87 PolarHBondContact O-N 3.28Å; K85-I88 HydrophobicContact CB-CB 4.46Å; K85-I88 HydrophobicContact CB-CD1 4.08Å; K85-I88 HydrophobicContact CB-CG1 4.11Å; K85-I88 HydrophobicContact CD-CD1 4.11Å; K85-I88 PolarHBondContact O-N 3.16Å; K85-L89 PolarHBondContact O-N 3.21Å | ||
| 86 | R | 89.6 | Confident | 94.2 | Very high | 95 Ų | 95 | 52.7 Ų | 52.7 | 36% | 0.358 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -52 | -44.4 | -176 | -160.2 | 170.6 | 169.7 | 156.1 | -4.8 | 113.4 | I88 L89 L90 Y260 | R86-I88 PolarHBondContact O-N 3.34Å; R86-L89 PolarHBondContact O-N 2.76Å; R86-L90 WeakPolarHBondContact O-CB 3.43Å; R86-L90 PolarHBondContact O-N 3.41Å; R86-Y260 HydrophobicContact CB-CE2 4.33Å; R86-Y260 HydrophobicContact CG-CD2 3.98Å; R86-Y260 HydrophobicContact CG-CE2 3.22Å; R86-Y260 PolarHBondContact NE-OH 3.13Å; R86-Y260 WeakPolarHBondContact O-CE2 3.14Å |
| 87 | N | 91.8 | Very high | 94.2 | Very high | 136 Ų | 136 | 52.7 Ų | 52.7 | 73% | 0.727 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -65 | -39.7 | 179.5 | -66.3 | -8.7 | 0 | 0 | 0 | 113.2 | K85 A91 | K85-N87 VanDerWaalsContact C-N 3.31Å; K85-N87 PolarHBondContact O-N 3.28Å; N87-A91 WeakPolarHBondContact O-CB 3.42Å; N87-A91 PolarHBondContact O-N 3.47Å |
| 88 | I | 94.1 | Very high | 94.1 | Very high | 46 Ų | 46 | 57 Ų | 57 | 24% | 0.236 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -71.8 | -41.6 | -179.6 | -55.8 | -178.8 | 0 | 0 | 0 | 109.8 | F76 A80 V83 K85 R86 A91 Y92 | F76-I88 HydrophobicContact CE2-CG2 3.89Å; F76-I88 HydrophobicContact CZ-CG2 3.68Å; A80-I88 HydrophobicContact CB-CG2 3.7Å; V83-I88 HydrophobicContact CG1-CD1 3.87Å; K85-I88 HydrophobicContact CB-CB 4.46Å; K85-I88 HydrophobicContact CB-CD1 4.08Å; K85-I88 HydrophobicContact CB-CG1 4.11Å; K85-I88 HydrophobicContact CD-CD1 4.11Å; K85-I88 PolarHBondContact O-N 3.16Å; R86-I88 PolarHBondContact O-N 3.34Å; I88-A91 PolarHBondContact O-N 2.93Å; I88-Y92 PolarHBondContact O-N 2.85Å |
| 89 | L | 93.9 | Very high | 94 | Very high | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -66 | -39.8 | 178 | -149 | 76.8 | 0 | 0 | 0 | 111.5 | A80 I81 K85 R86 Y92 I93 V256 Y260 L263 | A80-L89 HydrophobicContact CB-CD1 3.94Å; I81-L89 HydrophobicContact CG1-CD1 4.17Å; K85-L89 PolarHBondContact O-N 3.21Å; R86-L89 PolarHBondContact O-N 2.76Å; L89-Y92 WeakPolarHBondContact O-CB 3.45Å; L89-Y92 PolarHBondContact O-N 3.41Å; L89-I93 VanDerWaalsContact O-CG1 3.31Å; L89-I93 WeakPolarHBondContact O-CG1 3.38Å; L89-I93 PolarHBondContact O-N 2.91Å; L89-V256 HydrophobicContact CD1-CG1 4.03Å; L89-V256 HydrophobicContact CD2-CG1 4.08Å; L89-V256 HydrophobicContact CG-CG1 3.82Å; L89-Y260 HydrophobicContact CB-CD2 4.27Å; L89-Y260 HydrophobicContact CD2-CD2 4.21Å; L89-L263 HydrophobicContact CD2-CD1 3.88Å |
| 90 | L | 94.1 | Very high | 93.9 | Very high | 67 Ų | 67 | 53.9 Ų | 53.9 | 35% | 0.351 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -62.8 | -45.2 | 173.6 | -175.9 | 64.2 | 0 | 0 | 0 | 111.7 | R86 Y92 I93 L94 Y260 | R86-L90 WeakPolarHBondContact O-CB 3.43Å; R86-L90 PolarHBondContact O-N 3.41Å; L90-Y92 VanDerWaalsContact C-N 3.28Å; L90-Y92 PolarHBondContact O-N 2.99Å; L90-I93 PolarHBondContact O-N 3.43Å; L90-L94 HydrophobicContact CD1-CG 4.49Å; L90-L94 HydrophobicContact CG-CD1 4.25Å; L90-L94 WeakPolarHBondContact O-CG 3.22Å; L90-L94 PolarHBondContact O-N 3.49Å; L90-Y260 HydrophobicContact CB-CE2 3.89Å; L90-Y260 HydrophobicContact CD1-CE2 4.38Å |
| 91 | A | 95.8 | Very high | 93.8 | Very high | 41 Ų | 41 | 56.6 Ų | 56.6 | 34% | 0.339 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -58.7 | -41.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | F76 N87 I88 L95 | F76-A91 HydrophobicContact CE1-CB 4.41Å; F76-A91 HydrophobicContact CZ-CB 4.41Å; N87-A91 WeakPolarHBondContact O-CB 3.42Å; N87-A91 PolarHBondContact O-N 3.47Å; I88-A91 PolarHBondContact O-N 2.93Å; A91-L95 WeakPolarHBondContact O-CB 3.19Å; A91-L95 VanDerWaalsContact O-CG 3.29Å; A91-L95 WeakPolarHBondContact O-CG 3.48Å; A91-L95 PolarHBondContact O-N 3.29Å |
| 92 | Y | 96.8 | Very high | 93.6 | Very high | 0 Ų | 0 | 62.2 Ų | 62.2 | 0% | 0 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -61.2 | -49.4 | 174.2 | 161.9 | -97.2 | 0 | 0 | 0 | 111.9 | N20 T73 F76 I88 L89 L90 L94 L95 M96 V256 | N20-Y92 PolarHBondContact ND2-OH 2.8Å; N20-Y92 PolarHBondContact OD1-OH 3.44Å; T73-Y92 HydrophobicContact CG2-CD2 3.89Å; T73-Y92 HydrophobicContact CG2-CE2 4.04Å; T73-Y92 WeakPolarHBondContact O-CE2 3.39Å; F76-Y92 HydrophobicContact CD1-CD2 4.29Å; I88-Y92 PolarHBondContact O-N 2.85Å; L89-Y92 WeakPolarHBondContact O-CB 3.45Å; L89-Y92 PolarHBondContact O-N 3.41Å; L90-Y92 VanDerWaalsContact C-N 3.28Å; L90-Y92 PolarHBondContact O-N 2.99Å; Y92-L94 VanDerWaalsContact C-N 3.32Å; Y92-L94 PolarHBondContact O-N 2.94Å; Y92-L95 PolarHBondContact O-N 3.37Å; Y92-M96 HydrophobicContact CE2-CB 4.33Å; Y92-M96 HydrophobicContact CE2-CG 4.38Å; Y92-M96 HydrophobicContact CE2-SD 4.3Å; Y92-M96 VanDerWaalsContact O-CB 3.31Å; Y92-M96 WeakPolarHBondContact O-CB 3.13Å; Y92-M96 PolarHBondContact O-N 3.32Å; Y92-V256 HydrophobicContact CD1-CG1 3.83Å; Y92-V256 HydrophobicContact CE1-CB 4.03Å; Y92-V256 HydrophobicContact CE1-CG1 3.72Å; Y92-V256 HydrophobicContact CE1-CG2 3.85Å |
| 93 | I | 96.3 | Very high | 93.4 | Very high | 16 Ų | 16 | 57.5 Ų | 57.5 | 8% | 0.082 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -57.7 | -47 | -179.7 | -68.3 | 162.1 | 0 | 0 | 0 | 110.3 | L89 L90 M96 V97 V256 I257 Y260 | L89-I93 VanDerWaalsContact O-CG1 3.31Å; L89-I93 WeakPolarHBondContact O-CG1 3.38Å; L89-I93 PolarHBondContact O-N 2.91Å; L90-I93 PolarHBondContact O-N 3.43Å; I93-M96 PolarHBondContact O-N 3.44Å; I93-V97 HydrophobicContact CG2-CG2 4.39Å; I93-V97 WeakPolarHBondContact O-CB 3.33Å; I93-V97 VanDerWaalsContact O-CG2 3.27Å; I93-V97 WeakPolarHBondContact O-CG2 3.32Å; I93-V97 PolarHBondContact O-N 2.97Å; I93-V256 HydrophobicContact CD1-CG1 4.13Å; I93-V256 HydrophobicContact CG1-CG1 3.9Å; I93-I257 HydrophobicContact CD1-CG1 4.02Å; I93-I257 HydrophobicContact CG1-CG1 4.34Å; I93-I257 HydrophobicContact CG2-CD1 4.35Å; I93-I257 HydrophobicContact CG2-CG1 4.05Å; I93-Y260 HydrophobicContact CD1-CD2 4.33Å; I93-Y260 HydrophobicContact CD1-CG 4.2Å |
| 94 | L | 96.8 | Very high | 93.3 | Very high | 103 Ų | 103 | 57.3 Ų | 57.3 | 54% | 0.539 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -62.7 | -46.8 | 180 | -68.4 | 175.4 | 0 | 0 | 0 | 112 | L90 Y92 M96 V97 I98 | L90-L94 HydrophobicContact CD1-CG 4.49Å; L90-L94 HydrophobicContact CG-CD1 4.25Å; L90-L94 WeakPolarHBondContact O-CG 3.22Å; L90-L94 PolarHBondContact O-N 3.49Å; Y92-L94 VanDerWaalsContact C-N 3.32Å; Y92-L94 PolarHBondContact O-N 2.94Å; L94-M96 VanDerWaalsContact C-N 3.34Å; L94-M96 PolarHBondContact O-N 3.48Å; L94-V97 PolarHBondContact O-N 3.12Å; L94-I98 WeakPolarHBondContact O-CG1 3.24Å; L94-I98 PolarHBondContact O-N 2.81Å; L94-I98 VanDerWaalsContact O-N 3.11Å |
| 95 | L | 96.7 | Very high | 93.2 | Very high | 81 Ų | 81 | 58.6 Ų | 58.6 | 42% | 0.424 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -60.9 | -43.9 | 176.5 | -73.7 | 170.2 | 0 | 0 | 0 | 111.6 | T73 F76 A91 Y92 I98 I99 | T73-L95 HydrophobicContact CG2-CB 4.08Å; F76-L95 HydrophobicContact CD1-CD1 4.39Å; F76-L95 HydrophobicContact CE1-CD1 4.25Å; A91-L95 WeakPolarHBondContact O-CB 3.19Å; A91-L95 VanDerWaalsContact O-CG 3.29Å; A91-L95 WeakPolarHBondContact O-CG 3.48Å; A91-L95 PolarHBondContact O-N 3.29Å; Y92-L95 PolarHBondContact O-N 3.37Å; L95-I98 PolarHBondContact O-N 3.02Å; L95-I99 VanDerWaalsContact O-CG1 3.3Å; L95-I99 WeakPolarHBondContact O-CG1 3.37Å; L95-I99 PolarHBondContact O-N 2.89Å |
| 96 | M | 96.3 | Very high | 92.7 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -67.6 | -37.3 | -178.3 | -158.5 | 65.1 | 155.9 | 0 | 0 | 112.1 | I23 L70 T73 Y92 I93 L94 I99 Y100 T249 I253 | I23-M96 HydrophobicContact CB-CE 4.41Å; I23-M96 HydrophobicContact CD1-CE 3.67Å; I23-M96 HydrophobicContact CG2-CE 3.7Å; L70-M96 HydrophobicContact CD2-CE 4.27Å; L70-M96 HydrophobicContact CD2-SD 4.4Å; T73-M96 HydrophobicContact CG2-CB 4.25Å; T73-M96 HydrophobicContact CG2-SD 3.63Å; Y92-M96 HydrophobicContact CE2-CB 4.33Å; Y92-M96 HydrophobicContact CE2-CG 4.38Å; Y92-M96 HydrophobicContact CE2-SD 4.3Å; Y92-M96 VanDerWaalsContact O-CB 3.31Å; Y92-M96 WeakPolarHBondContact O-CB 3.13Å; Y92-M96 PolarHBondContact O-N 3.32Å; I93-M96 PolarHBondContact O-N 3.44Å; L94-M96 VanDerWaalsContact C-N 3.34Å; L94-M96 PolarHBondContact O-N 3.48Å; M96-I99 PolarHBondContact O-N 2.84Å; M96-Y100 WeakPolarHBondContact O-CB 3.46Å; M96-Y100 PolarHBondContact O-N 3.29Å; M96-T249 HydrophobicContact CE-CG2 3.87Å; M96-T249 HydrophobicContact CG-CG2 4.3Å; M96-I253 HydrophobicContact CB-CD1 4.33Å; M96-I253 HydrophobicContact CB-CG1 4.35Å; M96-I253 HydrophobicContact CG-CD1 3.84Å; M96-I253 HydrophobicContact CG-CG1 3.83Å |
| 97 | V | 95.9 | Very high | 92.3 | Very high | 70 Ų | 70 | 49.2 Ų | 49.2 | 42% | 0.424 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -65.9 | -39.7 | 174.9 | 168.5 | 0 | 0 | 0 | 0 | 111.7 | I93 L94 Y100 A101 I253 | I93-V97 HydrophobicContact CG2-CG2 4.39Å; I93-V97 WeakPolarHBondContact O-CB 3.33Å; I93-V97 VanDerWaalsContact O-CG2 3.27Å; I93-V97 WeakPolarHBondContact O-CG2 3.32Å; I93-V97 PolarHBondContact O-N 2.97Å; L94-V97 PolarHBondContact O-N 3.12Å; V97-Y100 WeakPolarHBondContact O-CB 3.32Å; V97-Y100 PolarHBondContact O-N 3.35Å; V97-A101 PolarHBondContact O-N 3.5Å; V97-I253 HydrophobicContact CG2-CG2 4.39Å |
| 98 | I | 94.9 | Very high | 91.8 | Very high | 91 Ų | 91 | 47.3 Ų | 47.3 | 47% | 0.467 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -62.4 | -48.6 | 175.6 | -68.4 | 165.4 | 0 | 0 | 0 | 110.2 | L94 L95 Y100 A101 F102 | L94-I98 WeakPolarHBondContact O-CG1 3.24Å; L94-I98 PolarHBondContact O-N 2.81Å; L94-I98 VanDerWaalsContact O-N 3.11Å; L95-I98 PolarHBondContact O-N 3.02Å; I98-Y100 VanDerWaalsContact C-N 3.32Å; I98-Y100 PolarHBondContact O-N 3.25Å; I98-A101 PolarHBondContact O-N 3.28Å; I98-F102 HydrophobicContact CG2-CD2 3.91Å; I98-F102 HydrophobicContact CG2-CE2 3.66Å; I98-F102 VanDerWaalsContact O-CD2 3.26Å; I98-F102 WeakPolarHBondContact O-CD2 3.25Å; I98-F102 PolarHBondContact O-N 3.41Å; I98-F102 VanDerWaalsContact O-N 3.15Å |
| 99 | I | 95.1 | Very high | 91.1 | Very high | 15 Ų | 15 | 47.2 Ų | 47.2 | 8% | 0.077 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -62.4 | -41.8 | 178.6 | -66.5 | 166.5 | 0 | 0 | 0 | 110.7 | T66 A69 L70 T73 L95 M96 A101 F102 E103 | T66-I99 HydrophobicContact CG2-CG2 4.04Å; A69-I99 HydrophobicContact CB-CD1 3.8Å; A69-I99 HydrophobicContact CB-CG1 4.06Å; L70-I99 HydrophobicContact CD2-CG2 3.45Å; L70-I99 VanDerWaalsContact CD2-CG2 3.45Å; L70-I99 HydrophobicContact CG-CG2 3.54Å; T73-I99 HydrophobicContact CG2-CD1 4.07Å; T73-I99 WeakPolarHBondContact OG1-CD1 3.14Å; L95-I99 VanDerWaalsContact O-CG1 3.3Å; L95-I99 WeakPolarHBondContact O-CG1 3.37Å; L95-I99 PolarHBondContact O-N 2.89Å; M96-I99 PolarHBondContact O-N 2.84Å; I99-A101 VanDerWaalsContact C-N 3.31Å; I99-A101 PolarHBondContact O-N 3.08Å; I99-F102 PolarHBondContact O-N 3.27Å; I99-E103 PolarHBondContact O-N 2.86Å |
| 100 | Y | 93.8 | Very high | 90.2 | Very high | 61 Ų | 61 | 49 Ų | 49 | 24% | 0.239 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -56.8 | -44 | 175 | -176.9 | -87.5 | 0 | 0 | 0 | 111.8 | M96 V97 I98 E103 V104 L246 T249 F250 I253 | M96-Y100 WeakPolarHBondContact O-CB 3.46Å; M96-Y100 PolarHBondContact O-N 3.29Å; V97-Y100 WeakPolarHBondContact O-CB 3.32Å; V97-Y100 PolarHBondContact O-N 3.35Å; I98-Y100 VanDerWaalsContact C-N 3.32Å; I98-Y100 PolarHBondContact O-N 3.25Å; Y100-E103 PolarHBondContact O-N 2.93Å; Y100-V104 HydrophobicContact CD1-CG2 3.97Å; Y100-V104 HydrophobicContact CE1-CG2 3.63Å; Y100-V104 WeakPolarHBondContact O-CG2 3.45Å; Y100-V104 PolarHBondContact O-N 2.81Å; Y100-L246 HydrophobicContact CD1-CD2 4.48Å; Y100-L246 HydrophobicContact CD2-CD2 3.61Å; Y100-L246 HydrophobicContact CE1-CD2 4.38Å; Y100-L246 HydrophobicContact CE2-CB 4.09Å; Y100-L246 HydrophobicContact CE2-CD2 3.5Å; Y100-L246 HydrophobicContact CE2-CG 4.44Å; Y100-L246 WeakPolarHBondContact CE2-O 3.33Å; Y100-L246 HydrophobicContact CG-CD2 4.12Å; Y100-T249 HydrophobicContact CD2-CG2 3.95Å; Y100-F250 HydrophobicContact CE2-CB 4.23Å; Y100-I253 HydrophobicContact CD2-CD1 4.25Å; Y100-I253 HydrophobicContact CG-CD1 4.45Å |
| 101 | A | 92.2 | Very high | 89.3 | Confident | 57 Ų | 57 | 48 Ų | 48 | 47% | 0.471 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -64 | -41.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | V97 I98 I99 E103 V104 A105 | V97-A101 PolarHBondContact O-N 3.5Å; I98-A101 PolarHBondContact O-N 3.28Å; I99-A101 VanDerWaalsContact C-N 3.31Å; I99-A101 PolarHBondContact O-N 3.08Å; A101-E103 VanDerWaalsContact C-N 3.34Å; A101-V104 PolarHBondContact O-N 3.5Å; A101-A105 PolarHBondContact O-N 3.44Å |
| 102 | F | 89.9 | Confident | 88.4 | Confident | 119 Ų | 119 | 49.8 Ų | 49.8 | 52% | 0.522 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -64.9 | -37.7 | 174.4 | -77.9 | -65.6 | 0 | 0 | 0 | 112.4 | I98 I99 A105 S106 | I98-F102 HydrophobicContact CG2-CD2 3.91Å; I98-F102 HydrophobicContact CG2-CE2 3.66Å; I98-F102 VanDerWaalsContact O-CD2 3.26Å; I98-F102 WeakPolarHBondContact O-CD2 3.25Å; I98-F102 PolarHBondContact O-N 3.41Å; I98-F102 VanDerWaalsContact O-N 3.15Å; I99-F102 PolarHBondContact O-N 3.27Å; F102-A105 PolarHBondContact O-N 3.33Å; F102-S106 PolarHBondContact O-N 3.44Å; F102-S106 PolarHBondContact O-OG 3.44Å |
| 103 | E | 88.6 | Confident | 87 | Confident | 4 Ų | 4 | 51.4 Ų | 51.4 | 2% | 0.019 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -70.4 | -35.5 | 177 | -173.6 | 61 | -174.5 | 0 | 0 | 112.4 | L30 T66 I99 Y100 A101 A105 S106 A107 L246 | L30-E103 WeakPolarHBondContact CD2-OE1 3.38Å; L30-E103 WeakPolarHBondContact CD2-OE2 3.41Å; T66-E103 HydrophobicContact CG2-CB 3.83Å; T66-E103 HydrophobicContact CG2-CG 4.47Å; T66-E103 WeakPolarHBondContact CG2-OE2 3.43Å; I99-E103 PolarHBondContact O-N 2.86Å; Y100-E103 PolarHBondContact O-N 2.93Å; A101-E103 VanDerWaalsContact C-N 3.34Å; E103-A105 VanDerWaalsContact C-N 3.34Å; E103-S106 WeakPolarHBondContact CA-OG 3.48Å; E103-S106 PolarHBondContact O-N 3.11Å; E103-S106 PolarHBondContact O-OG 3.24Å; E103-S106 PolarHBondContact OE2-OG 3.28Å; E103-S106 VanDerWaalsContact OE2-OG 3.12Å; E103-A107 VanDerWaalsContact O-CB 3.25Å; E103-A107 WeakPolarHBondContact O-CB 3.48Å; E103-A107 PolarHBondContact O-N 3.12Å; E103-L246 HydrophobicContact CB-CD2 3.88Å; E103-L246 HydrophobicContact CG-CD1 4.43Å; E103-L246 HydrophobicContact CG-CD2 3.78Å; E103-L246 HydrophobicContact CG-CG 4.01Å |
| 104 | V | 88.9 | Confident | 85.1 | Confident | 46 Ų | 46 | 55.1 Ų | 55.1 | 28% | 0.279 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -60.6 | -46.3 | 169.5 | 171.7 | 0 | 0 | 0 | 0 | 110.2 | Y100 A101 A107 I108 L246 | Y100-V104 HydrophobicContact CD1-CG2 3.97Å; Y100-V104 HydrophobicContact CE1-CG2 3.63Å; Y100-V104 WeakPolarHBondContact O-CG2 3.45Å; Y100-V104 PolarHBondContact O-N 2.81Å; A101-V104 PolarHBondContact O-N 3.5Å; V104-A107 PolarHBondContact O-N 3.25Å; V104-I108 HydrophobicContact CG1-CD1 3.62Å; V104-I108 HydrophobicContact CG1-CG1 4.35Å; V104-I108 WeakPolarHBondContact O-CB 3.37Å; V104-I108 VanDerWaalsContact O-CG1 3.23Å; V104-I108 WeakPolarHBondContact O-CG1 3.38Å; V104-I108 PolarHBondContact O-N 3.49Å; V104-L246 HydrophobicContact CB-CD1 4.47Å; V104-L246 HydrophobicContact CG2-CD1 3.86Å; V104-L246 HydrophobicContact CG2-CD2 3.65Å; V104-L246 HydrophobicContact CG2-CG 4.37Å |
| 105 | A | 85 | Confident | 83.2 | Confident | 49 Ų | 49 | 56.3 Ų | 56.3 | 41% | 0.405 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -63.2 | -42.4 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | A101 F102 E103 T109 | A101-A105 PolarHBondContact O-N 3.44Å; F102-A105 PolarHBondContact O-N 3.33Å; E103-A105 VanDerWaalsContact C-N 3.34Å; A105-T109 WeakPolarHBondContact O-CB 3.36Å; A105-T109 PolarHBondContact O-N 3.15Å; A105-T109 PolarHBondContact O-OG1 3.09Å |
| 106 | S | 80.3 | Confident | 81.6 | Confident | 17 Ų | 17 | 56.5 Ų | 56.5 | 12% | 0.119 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -66.1 | -44.4 | 177.2 | 68.4 | 0 | 0 | 0 | 0 | 111.5 | F102 E103 T109 A110 | F102-S106 PolarHBondContact O-N 3.44Å; F102-S106 PolarHBondContact O-OG 3.44Å; E103-S106 WeakPolarHBondContact CA-OG 3.48Å; E103-S106 PolarHBondContact O-N 3.11Å; E103-S106 PolarHBondContact O-OG 3.24Å; E103-S106 PolarHBondContact OE2-OG 3.28Å; E103-S106 VanDerWaalsContact OE2-OG 3.12Å; S106-T109 WeakPolarHBondContact O-CB 3.44Å; S106-T109 PolarHBondContact O-N 3.37Å; S106-A110 PolarHBondContact O-N 3.2Å |
| 107 | A | 80.9 | Confident | 80.4 | Confident | 15 Ų | 15 | 57.6 Ų | 57.6 | 12% | 0.124 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -64.8 | -41.4 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | E103 V104 T109 A110 A111 L246 | E103-A107 VanDerWaalsContact O-CB 3.25Å; E103-A107 WeakPolarHBondContact O-CB 3.48Å; E103-A107 PolarHBondContact O-N 3.12Å; V104-A107 PolarHBondContact O-N 3.25Å; A107-T109 VanDerWaalsContact C-N 3.34Å; A107-A110 PolarHBondContact O-N 3.29Å; A107-A111 VanDerWaalsContact O-CB 3.3Å; A107-A111 WeakPolarHBondContact O-CB 3.48Å; A107-A111 PolarHBondContact O-N 3.34Å; A107-L246 HydrophobicContact CB-CD1 4.15Å |
| 108 | I | 82.1 | Confident | 79.8 | Confident | 95 Ų | 95 | 56.9 Ų | 56.9 | 49% | 0.487 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -62.2 | -44.2 | 173.5 | -69.2 | 168.5 | 0 | 0 | 0 | 110.2 | V104 A110 A111 T112 | V104-I108 HydrophobicContact CG1-CD1 3.62Å; V104-I108 HydrophobicContact CG1-CG1 4.35Å; V104-I108 WeakPolarHBondContact O-CB 3.37Å; V104-I108 VanDerWaalsContact O-CG1 3.23Å; V104-I108 WeakPolarHBondContact O-CG1 3.38Å; V104-I108 PolarHBondContact O-N 3.49Å; I108-A110 PolarHBondContact O-N 3.05Å; I108-A111 PolarHBondContact O-N 2.84Å; I108-T112 HydrophobicContact CG2-CG2 4.03Å; I108-T112 WeakPolarHBondContact O-CB 3.46Å; I108-T112 WeakPolarHBondContact O-CG2 3.44Å; I108-T112 PolarHBondContact O-N 3.37Å; I108-T112 PolarHBondContact O-OG1 3.49Å |
| 109 | T | 78.6 | Confident | 79.3 | Confident | 44 Ų | 44 | 53.8 Ų | 53.8 | 27% | 0.27 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -58.8 | -48.9 | 177.4 | -57 | 0 | 0 | 0 | 0 | 110.5 | A105 S106 A107 A111 T112 H113 | A105-T109 WeakPolarHBondContact O-CB 3.36Å; A105-T109 PolarHBondContact O-N 3.15Å; A105-T109 PolarHBondContact O-OG1 3.09Å; S106-T109 WeakPolarHBondContact O-CB 3.44Å; S106-T109 PolarHBondContact O-N 3.37Å; A107-T109 VanDerWaalsContact C-N 3.34Å; T109-A111 VanDerWaalsContact C-N 3.34Å; T109-A111 PolarHBondContact O-N 3.27Å; T109-T112 PolarHBondContact O-OG1 3.23Å; T109-H113 VanDerWaalsContact O-CB 3.31Å; T109-H113 WeakPolarHBondContact O-CB 3.37Å; T109-H113 VanDerWaalsContact O-CG 3.32Å; T109-H113 PolarHBondContact O-N 2.91Å; T109-H113 VanDerWaalsContact O-N 3.12Å; T109-H113 PolarHBondContact O-ND1 2.88Å |
| 110 | A | 75 | Confident | 79 | Confident | 38 Ų | 38 | 59.5 Ų | 59.5 | 31% | 0.314 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -61.7 | -38.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | S106 A107 I108 S239 | S106-A110 PolarHBondContact O-N 3.2Å; A107-A110 PolarHBondContact O-N 3.29Å; I108-A110 PolarHBondContact O-N 3.05Å; A110-S239 WeakPolarHBondContact CB-OG 3.32Å |
| 111 | A | 76.2 | Confident | 78.6 | Confident | 45 Ų | 45 | 59.5 Ų | 59.5 | 37% | 0.372 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -75.4 | -37.4 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | A107 I108 T109 S239 | A107-A111 VanDerWaalsContact O-CB 3.3Å; A107-A111 WeakPolarHBondContact O-CB 3.48Å; A107-A111 PolarHBondContact O-N 3.34Å; I108-A111 PolarHBondContact O-N 2.84Å; T109-A111 VanDerWaalsContact C-N 3.34Å; T109-A111 PolarHBondContact O-N 3.27Å; A111-S239 PolarHBondContact N-OG 3.38Å |
| 112 | T | 75.8 | Confident | 78.4 | Confident | 79 Ų | 79 | 56.9 Ų | 56.9 | 49% | 0.485 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -83.2 | -25.5 | -176.4 | 52.7 | 0 | 0 | 0 | 0 | 113.1 | I108 T109 K114 | I108-T112 HydrophobicContact CG2-CG2 4.03Å; I108-T112 WeakPolarHBondContact O-CB 3.46Å; I108-T112 WeakPolarHBondContact O-CG2 3.44Å; I108-T112 PolarHBondContact O-N 3.37Å; I108-T112 PolarHBondContact O-OG1 3.49Å; T109-T112 PolarHBondContact O-OG1 3.23Å; T112-K114 PolarHBondContact O-N 2.94Å; T112-K114 VanDerWaalsContact O-N 3.14Å |
| 113 | H | 67 | Low | 78.5 | Confident | 35 Ų | 35 | 51.9 Ų | 51.9 | 16% | 0.162 | 29% | 0.29 | C | S | . | . | G | 310 helix | trans | -83.5 | 20.1 | -176.5 | -72.3 | 58.9 | 0 | 0 | 0 | 113.9 | T109 D115 W116 | T109-H113 VanDerWaalsContact O-CB 3.31Å; T109-H113 WeakPolarHBondContact O-CB 3.37Å; T109-H113 VanDerWaalsContact O-CG 3.32Å; T109-H113 PolarHBondContact O-N 2.91Å; T109-H113 VanDerWaalsContact O-N 3.12Å; T109-H113 PolarHBondContact O-ND1 2.88Å; H113-D115 PolarHBondContact O-N 3.08Å; H113-W116 VanDerWaalsContact CA-CD1 3.42Å; H113-W116 HydrophobicContact CB-CG 4.33Å; H113-W116 AromaticContact CD2-CD1 3.81Å; H113-W116 AromaticContact CD2-CE2 3.21Å; H113-W116 AromaticContact CD2-CZ2 3.36Å; H113-W116 WeakPolarHBondContact CD2-CZ2 3.45Å; H113-W116 AromaticContact CD2-NE1 3.09Å; H113-W116 PolarHBondContact CD2-NE1 3.46Å; H113-W116 AromaticContact CG-CD1 3.9Å; H113-W116 AromaticContact CG-NE1 3.45Å; H113-W116 AromaticContact NE2-CE2 3.8Å; H113-W116 AromaticContact NE2-CZ2 3.48Å; H113-W116 WeakPolarHBondContact NE2-CZ2 3.07Å; H113-W116 AromaticContact NE2-NE1 3.82Å; H113-W116 PolarHBondContact O-N 2.87Å |
| 114 | K | 56.9 | Low | 78.6 | Confident | 93 Ų | 93 | 57.6 Ų | 57.6 | 40% | 0.404 | 32% | 0.315 | S | S | . | . | G | 310 helix | trans | -62.9 | -28.7 | 174.5 | -71.7 | -179.1 | -177.7 | 174.9 | 0 | 113 | T112 W116 F117 F236 | T112-K114 PolarHBondContact O-N 2.94Å; T112-K114 VanDerWaalsContact O-N 3.14Å; K114-W116 PolarHBondContact O-N 3.38Å; K114-W116 VanDerWaalsContact O-N 3.12Å; K114-F117 PolarHBondContact O-N 3.28Å; K114-F236 VanDerWaalsContact NZ-CE2 3.31Å |
| 115 | D | 57.5 | Low | 78.6 | Confident | 129 Ų | 129 | 55.6 Ų | 55.6 | 69% | 0.69 | 30% | 0.302 | S | S | * | . | G | 310 helix | trans | -73.9 | 2.3 | -178.5 | -56.7 | -30.2 | 0 | 0 | 0 | 113.7 | H113 V118 | H113-D115 PolarHBondContact O-N 3.08Å; D115-V118 WeakPolarHBondContact O-CG2 3.5Å |
| 116 | W | 61.7 | Low | 78.9 | Confident | 84 Ų | 84 | 53.3 Ų | 53.3 | 32% | 0.318 | 28% | 0.283 | S | S | . | . | G | 310 helix | trans | -93.7 | -14.5 | -179.2 | -63.5 | 67 | 0 | 0 | 0 | 112.8 | N53 H113 K114 V118 L121 | N53-W116 HydrophobicContact CB-CD2 4.17Å; N53-W116 HydrophobicContact CB-CE3 3.24Å; N53-W116 HydrophobicContact CB-CH2 4.01Å; N53-W116 HydrophobicContact CB-CZ3 3.14Å; N53-W116 VanDerWaalsContact ND2-CZ3 3.26Å; N53-W116 WeakPolarHBondContact ND2-CZ3 2.98Å; N53-W116 WeakPolarHBondContact OD1-CH2 3.26Å; N53-W116 WeakPolarHBondContact OD1-CZ3 3.17Å; H113-W116 VanDerWaalsContact CA-CD1 3.42Å; H113-W116 HydrophobicContact CB-CG 4.33Å; H113-W116 AromaticContact CD2-CD1 3.81Å; H113-W116 AromaticContact CD2-CE2 3.21Å; H113-W116 AromaticContact CD2-CZ2 3.36Å; H113-W116 WeakPolarHBondContact CD2-CZ2 3.45Å; H113-W116 AromaticContact CD2-NE1 3.09Å; H113-W116 PolarHBondContact CD2-NE1 3.46Å; H113-W116 AromaticContact CG-CD1 3.9Å; H113-W116 AromaticContact CG-NE1 3.45Å; H113-W116 AromaticContact NE2-CE2 3.8Å; H113-W116 AromaticContact NE2-CZ2 3.48Å; H113-W116 WeakPolarHBondContact NE2-CZ2 3.07Å; H113-W116 AromaticContact NE2-NE1 3.82Å; H113-W116 PolarHBondContact O-N 2.87Å; K114-W116 PolarHBondContact O-N 3.38Å; K114-W116 VanDerWaalsContact O-N 3.12Å; W116-V118 PolarHBondContact O-N 3.48Å; W116-L121 WeakPolarHBondContact O-CD1 3.39Å |
| 117 | F | 71.7 | Confident | 79.4 | Confident | 23 Ų | 23 | 53.3 Ų | 53.3 | 10% | 0.101 | 28% | 0.282 | C | S | . | . | trans | -87 | 37.4 | 173.5 | -58 | -70.7 | 0 | 0 | 0 | 110.9 | V48 I56 K114 F122 Y224 A228 L231 I232 | V48-F117 HydrophobicContact CG2-CE1 3.92Å; I56-F117 HydrophobicContact CD1-CZ 4.14Å; K114-F117 PolarHBondContact O-N 3.28Å; F117-F122 HydrophobicContact CB-CE2 4.39Å; F117-F122 HydrophobicContact CD1-CE2 4.31Å; F117-F122 HydrophobicContact CD1-CZ 4.13Å; F117-Y224 VanDerWaalsContact O-CE2 3.23Å; F117-Y224 WeakPolarHBondContact O-CE2 3.5Å; F117-Y224 PolarHBondContact O-OH 2.03Å; F117-A228 HydrophobicContact CB-CB 4.47Å; F117-L231 HydrophobicContact CD1-CB 4.23Å; F117-L231 HydrophobicContact CD1-CD1 4.27Å; F117-L231 HydrophobicContact CE1-CB 3.83Å; F117-L231 HydrophobicContact CE1-CD1 3.92Å; F117-L231 HydrophobicContact CE1-CD2 4.02Å; F117-L231 HydrophobicContact CE1-CG 4.15Å; F117-L231 HydrophobicContact CZ-CB 4.14Å; F117-L231 HydrophobicContact CZ-CD2 4.3Å; F117-I232 HydrophobicContact CB-CD1 4.18Å; F117-I232 HydrophobicContact CB-CG1 4.12Å; F117-I232 HydrophobicContact CD2-CG1 3.95Å; F117-I232 HydrophobicContact CG-CG1 4.13Å | ||
| 118 | V | 82.6 | Confident | 79.8 | Confident | 56 Ų | 56 | 57.3 Ų | 57.3 | 34% | 0.339 | 30% | 0.298 | S | S | . | . | trans | -76.9 | 134.3 | 179 | 174.2 | 0 | 0 | 0 | 0 | 109 | D115 W116 E120 L121 | D115-V118 WeakPolarHBondContact O-CG2 3.5Å; W116-V118 PolarHBondContact O-N 3.48Å; V118-E120 HydrophobicContact CG1-CB 4.05Å; V118-E120 HydrophobicContact CG1-CG 4.22Å; V118-E120 PolarHBondContact O-N 3.26Å; V118-E120 VanDerWaalsContact O-N 3.13Å; V118-L121 PolarHBondContact O-N 3.47Å | ||
| 119 | P | 85.6 | Confident | 80.1 | Confident | 25 Ų | 25 | 54.2 Ų | 54.2 | 16% | 0.162 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -56.7 | -32.1 | -178.2 | 20.3 | -33.3 | 0 | 0 | 0 | 113.2 | L121 F122 L123 V167 Y168 Y224 | P119-L121 VanDerWaalsContact C-N 3.31Å; P119-L121 PolarHBondContact O-N 3.36Å; P119-F122 PolarHBondContact O-N 2.87Å; P119-L123 WeakPolarHBondContact O-CB 3.22Å; P119-L123 PolarHBondContact O-N 3.25Å; P119-V167 HydrophobicContact CB-CG1 3.67Å; P119-V167 WeakPolarHBondContact O-CG1 3.38Å; P119-Y168 HydrophobicContact CB-CE1 3.8Å; P119-Y168 HydrophobicContact CB-CE2 4.34Å; P119-Y168 WeakPolarHBondContact CB-OH 3.36Å; P119-Y168 HydrophobicContact CG-CE1 3.97Å; P119-Y168 WeakPolarHBondContact CG-OH 3.12Å; P119-Y224 HydrophobicContact CB-CD1 4.31Å; P119-Y224 HydrophobicContact CB-CD2 3.63Å; P119-Y224 HydrophobicContact CB-CE1 4.44Å; P119-Y224 HydrophobicContact CB-CE2 3.77Å; P119-Y224 HydrophobicContact CB-CG 3.91Å; P119-Y224 HydrophobicContact CG-CE2 4.28Å |
| 120 | E | 87.8 | Confident | 80.7 | Confident | 135 Ų | 135 | 52.1 Ų | 52.1 | 63% | 0.631 | 27% | 0.269 | S | S | * | . | H | α-helix | trans | -61.1 | -34.4 | 176.6 | -61.7 | -169.6 | 167 | 0 | 0 | 114.1 | V118 L123 K124 | V118-E120 HydrophobicContact CG1-CB 4.05Å; V118-E120 HydrophobicContact CG1-CG 4.22Å; V118-E120 PolarHBondContact O-N 3.26Å; V118-E120 VanDerWaalsContact O-N 3.13Å; E120-L123 PolarHBondContact O-N 2.87Å; E120-K124 WeakPolarHBondContact O-CB 3.48Å; E120-K124 PolarHBondContact O-N 3.49Å |
| 121 | L | 86.8 | Confident | 81.3 | Confident | 61 Ų | 61 | 53.1 Ų | 53.1 | 32% | 0.319 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -68.6 | -44.5 | 177.8 | -72 | 172.4 | 0 | 0 | 0 | 110.7 | T51 W116 V118 P119 L123 K124 Q125 | T51-L121 HydrophobicContact CG2-CB 4.1Å; W116-L121 WeakPolarHBondContact O-CD1 3.39Å; V118-L121 PolarHBondContact O-N 3.47Å; P119-L121 VanDerWaalsContact C-N 3.31Å; P119-L121 PolarHBondContact O-N 3.36Å; L121-L123 VanDerWaalsContact C-N 3.3Å; L121-L123 PolarHBondContact O-N 3.38Å; L121-K124 PolarHBondContact O-N 3.12Å; L121-Q125 WeakPolarHBondContact O-CB 3.35Å; L121-Q125 PolarHBondContact O-N 3.41Å |
| 122 | F | 88.3 | Confident | 81.7 | Confident | 3 Ų | 3 | 54.8 Ų | 54.8 | 1% | 0.013 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -63.4 | -37.9 | 173.4 | -70.6 | -74.1 | 0 | 0 | 0 | 111.7 | L47 V48 F117 P119 Q125 M126 V167 Y224 I227 | L47-F122 HydrophobicContact CB-CE1 4.18Å; V48-F122 HydrophobicContact CG2-CE1 4.48Å; V48-F122 HydrophobicContact CG2-CZ 4.33Å; F117-F122 HydrophobicContact CB-CE2 4.39Å; F117-F122 HydrophobicContact CD1-CE2 4.31Å; F117-F122 HydrophobicContact CD1-CZ 4.13Å; P119-F122 PolarHBondContact O-N 2.87Å; F122-Q125 PolarHBondContact O-N 2.81Å; F122-M126 WeakPolarHBondContact O-CB 3.12Å; F122-M126 PolarHBondContact O-N 3.35Å; F122-V167 HydrophobicContact CB-CG2 3.78Å; F122-Y224 HydrophobicContact CD2-CD2 4.13Å; F122-Y224 HydrophobicContact CD2-CE2 4.1Å; F122-Y224 HydrophobicContact CE2-CE2 4.32Å; F122-I227 HydrophobicContact CD1-CG2 4.49Å; F122-I227 HydrophobicContact CE1-CG2 4.04Å; F122-I227 HydrophobicContact CZ-CG2 4.3Å |
| 123 | L | 91.3 | Very high | 81.9 | Confident | 14 Ų | 14 | 54.5 Ų | 54.5 | 7% | 0.073 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -64.6 | -51.4 | 178.6 | 178.4 | 63.1 | 0 | 0 | 0 | 110.2 | P119 E120 L121 Q125 M126 L127 V167 Y168 D172 Y176 | P119-L123 WeakPolarHBondContact O-CB 3.22Å; P119-L123 PolarHBondContact O-N 3.25Å; E120-L123 PolarHBondContact O-N 2.87Å; L121-L123 VanDerWaalsContact C-N 3.3Å; L121-L123 PolarHBondContact O-N 3.38Å; L123-Q125 VanDerWaalsContact C-N 3.31Å; L123-Q125 PolarHBondContact O-N 3.05Å; L123-M126 HydrophobicContact CD1-CE 3.93Å; L123-M126 PolarHBondContact O-N 3.49Å; L123-L127 HydrophobicContact CD1-CD1 3.86Å; L123-L127 HydrophobicContact CD1-CD2 4.43Å; L123-L127 HydrophobicContact CD1-CG 4.04Å; L123-L127 HydrophobicContact CG-CD1 3.86Å; L123-L127 HydrophobicContact CG-CG 4.42Å; L123-L127 WeakPolarHBondContact O-CG 3.4Å; L123-L127 PolarHBondContact O-N 3.02Å; L123-V167 HydrophobicContact CB-CB 4.28Å; L123-V167 HydrophobicContact CB-CG1 4.37Å; L123-V167 HydrophobicContact CB-CG2 4.12Å; L123-V167 HydrophobicContact CD1-CB 4.39Å; L123-Y168 HydrophobicContact CD2-CD2 4.34Å; L123-Y168 HydrophobicContact CD2-CE2 4.04Å; L123-D172 HydrophobicContact CD1-CB 3.78Å; L123-Y176 HydrophobicContact CD1-CD2 4.43Å; L123-Y176 HydrophobicContact CD2-CD2 4.23Å; L123-Y176 HydrophobicContact CD2-CE2 3.78Å |
| 124 | K | 90 | Very high | 82.3 | Confident | 124 Ų | 124 | 55.9 Ų | 55.9 | 54% | 0.539 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -58.2 | -45.3 | 177 | -175 | 179.3 | 179.6 | -177.9 | 0 | 111.4 | E120 L121 Q128 | E120-K124 WeakPolarHBondContact O-CB 3.48Å; E120-K124 PolarHBondContact O-N 3.49Å; L121-K124 PolarHBondContact O-N 3.12Å; K124-Q128 VanDerWaalsContact O-CB 3.3Å; K124-Q128 WeakPolarHBondContact O-CB 3.19Å; K124-Q128 VanDerWaalsContact O-CG 3.23Å; K124-Q128 WeakPolarHBondContact O-CG 3.35Å; K124-Q128 PolarHBondContact O-N 2.73Å; K124-Q128 VanDerWaalsContact O-N 3.1Å |
| 125 | Q | 90.2 | Very high | 82.9 | Confident | 4 Ų | 4 | 54.7 Ų | 54.7 | 2% | 0.019 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -63.7 | -41.6 | 179.5 | 174.2 | -101.4 | -41.4 | 0 | 0 | 112.4 | L47 A50 T51 L121 F122 L123 N129 | L47-Q125 VanDerWaalsContact CD2-NE2 3.34Å; A50-Q125 HydrophobicContact CB-CG 3.56Å; T51-Q125 HydrophobicContact CG2-CB 4.38Å; L121-Q125 WeakPolarHBondContact O-CB 3.35Å; L121-Q125 PolarHBondContact O-N 3.41Å; F122-Q125 PolarHBondContact O-N 2.81Å; L123-Q125 VanDerWaalsContact C-N 3.31Å; L123-Q125 PolarHBondContact O-N 3.05Å; Q125-N129 WeakPolarHBondContact O-CB 3.33Å; Q125-N129 PolarHBondContact O-N 2.93Å; Q125-N129 VanDerWaalsContact O-N 3.11Å; Q125-N129 PolarHBondContact O-ND2 3.35Å; Q125-N129 VanDerWaalsContact O-ND2 3.1Å |
| 126 | M | 91.3 | Very high | 83.2 | Confident | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -63.2 | -54.2 | 175.5 | -176.9 | -131.9 | -53.9 | 0 | 0 | 111 | F122 L123 Q128 N129 Y130 W155 V167 W173 | F122-M126 WeakPolarHBondContact O-CB 3.12Å; F122-M126 PolarHBondContact O-N 3.35Å; L123-M126 HydrophobicContact CD1-CE 3.93Å; L123-M126 PolarHBondContact O-N 3.49Å; M126-Q128 PolarHBondContact O-N 2.85Å; M126-N129 PolarHBondContact O-N 3.09Å; M126-Y130 WeakPolarHBondContact O-CB 3.37Å; M126-Y130 PolarHBondContact O-N 2.7Å; M126-W155 HydrophobicContact CB-CZ2 3.72Å; M126-W155 HydrophobicContact CE-CH2 3.82Å; M126-W155 HydrophobicContact CE-CZ2 4.09Å; M126-W155 HydrophobicContact CE-CZ3 4.17Å; M126-W155 HydrophobicContact CG-CD2 3.96Å; M126-W155 HydrophobicContact CG-CE3 4.42Å; M126-W155 HydrophobicContact CG-CG 4.42Å; M126-W155 HydrophobicContact CG-CH2 4.39Å; M126-W155 HydrophobicContact CG-CZ2 3.88Å; M126-V167 HydrophobicContact CE-CB 3.94Å; M126-V167 HydrophobicContact CE-CG2 3.46Å; M126-V167 VanDerWaalsContact CE-CG2 3.46Å; M126-V167 VanDerWaalsContact CE-N 3.3Å; M126-W173 HydrophobicContact CG-CH2 3.61Å; M126-W173 HydrophobicContact CG-CZ2 3.92Å; M126-W173 HydrophobicContact CG-CZ3 4.36Å; M126-W173 HydrophobicContact SD-CD2 4.27Å; M126-W173 HydrophobicContact SD-CE3 4.34Å; M126-W173 HydrophobicContact SD-CH2 3.36Å; M126-W173 WeakPolarHBondContact SD-CH2 3.25Å; M126-W173 HydrophobicContact SD-CZ2 3.26Å; M126-W173 WeakPolarHBondContact SD-CZ2 3.43Å; M126-W173 HydrophobicContact SD-CZ3 3.92Å |
| 127 | L | 91.2 | Very high | 83 | Confident | 18 Ų | 18 | 59.4 Ų | 59.4 | 9% | 0.094 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -60.1 | -34.3 | -177.3 | -63.5 | 170 | 0 | 0 | 0 | 112.4 | L123 Y176 S178 H179 | L123-L127 HydrophobicContact CD1-CD1 3.86Å; L123-L127 HydrophobicContact CD1-CD2 4.43Å; L123-L127 HydrophobicContact CD1-CG 4.04Å; L123-L127 HydrophobicContact CG-CD1 3.86Å; L123-L127 HydrophobicContact CG-CG 4.42Å; L123-L127 WeakPolarHBondContact O-CG 3.4Å; L123-L127 PolarHBondContact O-N 3.02Å; L127-Y176 HydrophobicContact CD1-CD2 4.16Å; L127-Y176 HydrophobicContact CD1-CG 3.97Å; L127-S178 WeakPolarHBondContact O-CA 3.09Å; L127-S178 WeakPolarHBondContact O-CB 3.49Å; L127-H179 PolarHBondContact O-N 3.23Å; L127-H179 VanDerWaalsContact O-N 3.08Å |
| 128 | Q | 89.3 | Confident | 82.2 | Confident | 98 Ų | 98 | 64.5 Ų | 64.5 | 46% | 0.458 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -88.1 | -20.8 | -176.5 | -70.3 | -175.5 | -18.6 | 0 | 0 | 115.3 | K124 M126 H179 | K124-Q128 VanDerWaalsContact O-CB 3.3Å; K124-Q128 WeakPolarHBondContact O-CB 3.19Å; K124-Q128 VanDerWaalsContact O-CG 3.23Å; K124-Q128 WeakPolarHBondContact O-CG 3.35Å; K124-Q128 PolarHBondContact O-N 2.73Å; K124-Q128 VanDerWaalsContact O-N 3.1Å; M126-Q128 PolarHBondContact O-N 2.85Å; Q128-H179 PolarHBondContact O-CD2 3.34Å |
| 129 | N | 88.3 | Confident | 80.9 | Confident | 30 Ų | 30 | 67.3 Ų | 67.3 | 16% | 0.16 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -126.3 | -18.7 | -171.8 | -60.1 | -58.6 | 0 | 0 | 0 | 114.1 | Q125 M126 N131 K132 I151 | Q125-N129 WeakPolarHBondContact O-CB 3.33Å; Q125-N129 PolarHBondContact O-N 2.93Å; Q125-N129 VanDerWaalsContact O-N 3.11Å; Q125-N129 PolarHBondContact O-ND2 3.35Å; Q125-N129 VanDerWaalsContact O-ND2 3.1Å; M126-N129 PolarHBondContact O-N 3.09Å; N129-N131 PolarHBondContact O-N 3.32Å; N129-K132 PolarHBondContact O-N 2.8Å; N129-I151 HydrophobicContact CB-CD1 3.58Å; N129-I151 HydrophobicContact CB-CG2 4.14Å |
| 130 | Y | 89.9 | Confident | 79.6 | Confident | 1 Ų | 1 | 67.4 Ų | 67.4 | 0% | 0.004 | 36% | 0.357 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66.7 | 124.8 | 177.7 | -177 | -90.2 | 0 | 0 | 0 | 111.2 | M126 K132 T152 W155 N156 M159 W173 F180 P192 | M126-Y130 WeakPolarHBondContact O-CB 3.37Å; M126-Y130 PolarHBondContact O-N 2.7Å; Y130-K132 PolarHBondContact O-N 2.97Å; Y130-K132 VanDerWaalsContact O-N 3.11Å; Y130-T152 HydrophobicContact CD2-CG2 4.21Å; Y130-T152 HydrophobicContact CE2-CG2 3.96Å; Y130-W155 HydrophobicContact CD2-CB 3.71Å; Y130-W155 HydrophobicContact CD2-CG 4.17Å; Y130-W155 HydrophobicContact CE2-CB 3.8Å; Y130-N156 WeakPolarHBondContact CE2-OD1 3.18Å; Y130-N156 PolarHBondContact OH-OD1 3.28Å; Y130-M159 HydrophobicContact CE2-CE 3.86Å; Y130-W173 AromaticContact CD1-CH2 3.35Å; Y130-W173 HydrophobicContact CD1-CH2 3.35Å; Y130-W173 HydrophobicContact CD1-CZ2 4.47Å; Y130-W173 AromaticContact CD1-CZ3 3.51Å; Y130-W173 HydrophobicContact CD1-CZ3 3.51Å; Y130-W173 HydrophobicContact CD2-CH2 4.01Å; Y130-W173 AromaticContact CE1-CH2 3.8Å; Y130-W173 HydrophobicContact CE1-CH2 3.8Å; Y130-W173 HydrophobicContact CE1-CZ3 4.1Å; Y130-W173 HydrophobicContact CE2-CH2 4.42Å; Y130-W173 AromaticContact CG-CH2 3.47Å; Y130-W173 HydrophobicContact CG-CH2 3.47Å; Y130-W173 VanDerWaalsContact CG-CH2 3.47Å; Y130-W173 AromaticContact CG-CZ3 3.98Å; Y130-W173 HydrophobicContact CG-CZ3 3.98Å; Y130-F180 HydrophobicContact CD1-CB 4.05Å; Y130-F180 HydrophobicContact CD1-CD2 4.21Å; Y130-F180 HydrophobicContact CD1-CG 4.38Å; Y130-F180 HydrophobicContact CE1-CB 4.45Å; Y130-F180 AromaticContact CE1-CD2 3.78Å; Y130-F180 HydrophobicContact CE1-CD2 3.78Å; Y130-F180 HydrophobicContact CE1-CE2 4.42Å; Y130-F180 HydrophobicContact CE1-CG 4.31Å; Y130-P192 HydrophobicContact CD1-CG 4.41Å; Y130-P192 HydrophobicContact CE1-CB 4.2Å; Y130-P192 HydrophobicContact CE1-CG 3.52Å; Y130-P192 WeakPolarHBondContact OH-CB 3.17Å |
| 131 | N | 87.4 | Confident | 78.6 | Confident | 59 Ų | 59 | 64.7 Ų | 64.7 | 32% | 0.316 | 35% | 0.35 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 51.7 | 27.7 | -175.7 | -79.4 | -16.3 | 0 | 0 | 0 | 114.4 | N129 T152 Q183 | N129-N131 PolarHBondContact O-N 3.32Å; N131-T152 PolarHBondContact N-OG1 3.25Å; N131-T152 VanDerWaalsContact N-OG1 3.09Å; N131-T152 WeakPolarHBondContact OD1-CG2 3.27Å; N131-Q183 PolarHBondContact O-NE2 2.81Å; N131-Q183 VanDerWaalsContact O-NE2 3.1Å |
| 132 | K | 85.8 | Confident | 77.7 | Confident | 79 Ų | 79 | 68.7 Ų | 68.7 | 34% | 0.343 | 37% | 0.367 | S | S | . | . | P | Polyproline II helix | trans | -63.3 | 127.9 | 176.9 | -175.2 | 179.1 | -175.7 | 174.3 | 0 | 109.6 | N129 Y130 I148 | N129-K132 PolarHBondContact O-N 2.8Å; Y130-K132 PolarHBondContact O-N 2.97Å; Y130-K132 VanDerWaalsContact O-N 3.11Å; K132-I148 HydrophobicContact CB-CD1 4.42Å; K132-I148 HydrophobicContact CB-CG2 4.03Å; K132-I148 HydrophobicContact CD-CD1 3.97Å; K132-I148 HydrophobicContact CG-CD1 4.42Å |
| 133 | P | 79.8 | Confident | 76.7 | Confident | 74 Ų | 74 | 74 Ų | 74 | 48% | 0.481 | 40% | 0.396 | S | S | . | . | P | Polyproline II helix | trans | -70.7 | 138 | 179 | 28.7 | -25.8 | 0 | 0 | 0 | 109 | ||
| 134 | L | 75.7 | Confident | 75.9 | Confident | 64 Ų | 64 | 78.2 Ų | 78.2 | 34% | 0.335 | 42% | 0.415 | S | S | . | . | P | Polyproline II helix | trans | -71.1 | 140.6 | 176.5 | -67.1 | 166.9 | 0 | 0 | 0 | 109.2 | D136 I145 I148 | L134-D136 PolarHBondContact O-N 3.49Å; L134-I145 HydrophobicContact CD1-CG1 4.38Å; L134-I145 HydrophobicContact CD1-CG2 4Å; L134-I145 HydrophobicContact CD2-CB 4.29Å; L134-I145 HydrophobicContact CD2-CG1 3.91Å; L134-I145 HydrophobicContact CD2-CG2 4.41Å; L134-I148 HydrophobicContact CD2-CD1 4.08Å |
| 135 | P | 68.8 | Low | 75.2 | Confident | 67 Ų | 67 | 74.1 Ų | 74.1 | 44% | 0.435 | 40% | 0.399 | S | S | . | . | P | Polyproline II helix | trans | -67 | 122.5 | 180 | 24.8 | -31.1 | 0 | 0 | 0 | 110.8 | N137 | P135-N137 PolarHBondContact O-N 3.04Š|
| 136 | D | 63.8 | Low | 74.5 | Confident | 158 Ų | 158 | 81.3 Ų | 81.3 | 85% | 0.845 | 43% | 0.427 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.4 | -19.6 | -178.9 | -68.3 | -39.6 | 0 | 0 | 0 | 114 | L134 | L134-D136 PolarHBondContact O-N 3.49Š|
| 137 | N | 57.6 | Low | 73.9 | Confident | 155 Ų | 155 | 82.6 Ų | 82.6 | 83% | 0.829 | 44% | 0.435 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -121.8 | 12 | -162.7 | -62.7 | -34.6 | 0 | 0 | 0 | 115.7 | P135 | P135-N137 PolarHBondContact O-N 3.04Š|
| 138 | L | 55.9 | Low | 73.5 | Confident | 129 Ų | 129 | 82.5 Ų | 82.5 | 68% | 0.675 | 43% | 0.434 | S | S | * | . | S | Bend | trans | -135.1 | 153.2 | 175.1 | -129.4 | 76.5 | 0 | 0 | 0 | 107.9 | S140 | L138-S140 PolarHBondContact O-N 3.19Š|
| 139 | P | 54.3 | Low | 73.3 | Confident | 116 Ų | 116 | 81.9 Ų | 81.9 | 75% | 0.753 | 43% | 0.434 | S | S | * | . | trans | -67.7 | 93.8 | 161.7 | 22.1 | -11.8 | 0 | 0 | 0 | 105.5 | T141 | P139-T141 PolarHBondContact O-N 3.04Š| ||
| 140 | S | 59.5 | Low | 73.2 | Confident | 26 Ų | 26 | 81.1 Ų | 81.1 | 18% | 0.182 | 43% | 0.433 | C | S | . | . | trans | -49.9 | 117.4 | 158.7 | 44.5 | 0 | 0 | 0 | 0 | 105.4 | L138 Q142 I145 | L138-S140 PolarHBondContact O-N 3.19Å; S140-Q142 PolarHBondContact O-N 3.13Å; S140-I145 WeakPolarHBondContact OG-CD1 3.39Å; S140-I145 WeakPolarHBondContact OG-CG1 3.36Å | ||
| 141 | T | 65.7 | Low | 73.1 | Confident | 79 Ų | 79 | 81.1 Ų | 81.1 | 49% | 0.485 | 43% | 0.433 | S | S | . | . | trans | -54 | 136.2 | 174.9 | 20.5 | 0 | 0 | 0 | 0 | 107.3 | P139 D143 Q144 I145 | P139-T141 PolarHBondContact O-N 3.04Å; T141-D143 PolarHBondContact O-N 3.2Å; T141-Q144 WeakPolarHBondContact O-CB 3.23Å; T141-Q144 PolarHBondContact O-N 2.85Å; T141-I145 PolarHBondContact O-N 2.84Å | ||
| 142 | Q | 67.2 | Low | 73.3 | Confident | 144 Ų | 144 | 78.9 Ų | 78.9 | 67% | 0.673 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -46.3 | -34 | -179.1 | -175.4 | 66 | 18.6 | 0 | 0 | 111.9 | S140 I145 Y146 | S140-Q142 PolarHBondContact O-N 3.13Å; Q142-I145 PolarHBondContact O-N 2.89Å; Q142-Y146 WeakPolarHBondContact O-CB 3.4Å; Q142-Y146 PolarHBondContact O-N 3.44Å |
| 143 | D | 68.8 | Low | 73.5 | Confident | 115 Ų | 115 | 81.8 Ų | 81.8 | 62% | 0.615 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -61 | -41.5 | 175.5 | -56.7 | -28.1 | 0 | 0 | 0 | 113.7 | T141 Y146 V147 | T141-D143 PolarHBondContact O-N 3.2Å; D143-Y146 PolarHBondContact O-N 3.32Å; D143-V147 WeakPolarHBondContact O-CB 3.17Å; D143-V147 WeakPolarHBondContact O-CG2 3.29Å; D143-V147 PolarHBondContact O-N 2.99Å |
| 144 | Q | 74 | Confident | 73.9 | Confident | 103 Ų | 103 | 78.4 Ų | 78.4 | 48% | 0.481 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -66.6 | -40.6 | 178.3 | -71.1 | -178 | -15.4 | 0 | 0 | 111.7 | T141 V147 I148 | T141-Q144 WeakPolarHBondContact O-CB 3.23Å; T141-Q144 PolarHBondContact O-N 2.85Å; Q144-V147 PolarHBondContact O-N 3.36Å; Q144-I148 WeakPolarHBondContact O-CG1 3.3Å; Q144-I148 PolarHBondContact O-N 3.48Å |
| 145 | I | 75.9 | Confident | 74.7 | Confident | 38 Ų | 38 | 75.4 Ų | 75.4 | 20% | 0.195 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -61.8 | -49.1 | 176.3 | -55.3 | 176.7 | 0 | 0 | 0 | 109.5 | L134 S140 T141 Q142 V147 I148 N149 | L134-I145 HydrophobicContact CD1-CG1 4.38Å; L134-I145 HydrophobicContact CD1-CG2 4Å; L134-I145 HydrophobicContact CD2-CB 4.29Å; L134-I145 HydrophobicContact CD2-CG1 3.91Å; L134-I145 HydrophobicContact CD2-CG2 4.41Å; S140-I145 WeakPolarHBondContact OG-CD1 3.39Å; S140-I145 WeakPolarHBondContact OG-CG1 3.36Å; T141-I145 PolarHBondContact O-N 2.84Å; Q142-I145 PolarHBondContact O-N 2.89Å; I145-V147 VanDerWaalsContact C-N 3.35Å; I145-V147 PolarHBondContact O-N 3.5Å; I145-I148 PolarHBondContact O-N 2.94Å; I145-N149 WeakPolarHBondContact O-CB 3.35Å; I145-N149 PolarHBondContact O-N 3.49Å |
| 146 | Y | 75.2 | Confident | 75.8 | Confident | 155 Ų | 155 | 73.9 Ų | 73.9 | 61% | 0.608 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -59 | -45 | 179 | 174.6 | -99.4 | 0 | 0 | 0 | 111.9 | Q142 D143 G150 | Q142-Y146 WeakPolarHBondContact O-CB 3.4Å; Q142-Y146 PolarHBondContact O-N 3.44Å; D143-Y146 PolarHBondContact O-N 3.32Å; Y146-G150 PolarHBondContact O-N 2.98Å |
| 147 | V | 78.2 | Confident | 77.1 | Confident | 27 Ų | 27 | 69.6 Ų | 69.6 | 16% | 0.164 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -66.5 | -47.9 | -179.3 | 171.3 | 0 | 0 | 0 | 0 | 111.6 | Y49 A50 D143 Q144 I145 N149 G150 I151 | Y49-V147 HydrophobicContact CD1-CG2 4.1Å; Y49-V147 HydrophobicContact CE1-CG2 3.81Å; A50-V147 HydrophobicContact CB-CG1 4.42Å; D143-V147 WeakPolarHBondContact O-CB 3.17Å; D143-V147 WeakPolarHBondContact O-CG2 3.29Å; D143-V147 PolarHBondContact O-N 2.99Å; Q144-V147 PolarHBondContact O-N 3.36Å; I145-V147 VanDerWaalsContact C-N 3.35Å; I145-V147 PolarHBondContact O-N 3.5Å; V147-N149 PolarHBondContact O-N 2.92Å; V147-G150 PolarHBondContact O-N 3.38Å; V147-I151 HydrophobicContact CG1-CD1 3.66Å; V147-I151 HydrophobicContact CG1-CG1 4.34Å; V147-I151 WeakPolarHBondContact O-CB 3.42Å; V147-I151 WeakPolarHBondContact O-CD1 3.33Å; V147-I151 WeakPolarHBondContact O-CG1 3.34Å; V147-I151 PolarHBondContact O-N 3.41Å |
| 148 | I | 83.3 | Confident | 78.6 | Confident | 15 Ų | 15 | 62.9 Ų | 62.9 | 8% | 0.077 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -62.4 | -45.7 | -179.6 | -69.8 | 166.1 | 0 | 0 | 0 | 111.1 | K132 L134 Q144 I145 T152 | K132-I148 HydrophobicContact CB-CD1 4.42Å; K132-I148 HydrophobicContact CB-CG2 4.03Å; K132-I148 HydrophobicContact CD-CD1 3.97Å; K132-I148 HydrophobicContact CG-CD1 4.42Å; L134-I148 HydrophobicContact CD2-CD1 4.08Å; Q144-I148 WeakPolarHBondContact O-CG1 3.3Å; Q144-I148 PolarHBondContact O-N 3.48Å; I145-I148 PolarHBondContact O-N 2.94Å; I148-T152 WeakPolarHBondContact O-CB 3.26Å; I148-T152 PolarHBondContact O-N 2.98Å; I148-T152 PolarHBondContact O-OG1 3.41Å |
| 149 | N | 84.9 | Confident | 80.4 | Confident | 86 Ų | 86 | 56.8 Ų | 56.8 | 46% | 0.46 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -65.8 | -45.5 | 178.7 | -71.8 | -12 | 0 | 0 | 0 | 111 | I145 V147 I151 T152 E153 | I145-N149 WeakPolarHBondContact O-CB 3.35Å; I145-N149 PolarHBondContact O-N 3.49Å; V147-N149 PolarHBondContact O-N 2.92Å; N149-I151 PolarHBondContact O-N 3.26Å; N149-T152 PolarHBondContact O-N 2.91Å; N149-E153 VanDerWaalsContact O-CB 3.31Å; N149-E153 WeakPolarHBondContact O-CB 3.34Å; N149-E153 PolarHBondContact O-N 2.88Å |
| 150 | G | 85.7 | Confident | 82.1 | Confident | 14 Ų | 14 | 53.5 Ų | 53.5 | 14% | 0.144 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -61.6 | -40.8 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | Y146 V147 A154 | Y146-G150 PolarHBondContact O-N 2.98Å; V147-G150 PolarHBondContact O-N 3.38Å; G150-A154 VanDerWaalsContact O-CB 3.24Å; G150-A154 WeakPolarHBondContact O-CB 3.42Å; G150-A154 PolarHBondContact O-N 3.36Å |
| 151 | I | 88.1 | Confident | 83.5 | Confident | 0 Ų | 0 | 58.4 Ų | 58.4 | 0% | 0 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -60 | -50.1 | 173.4 | -72.6 | 165.6 | 0 | 0 | 0 | 110.7 | V46 L47 A50 N129 V147 N149 A154 W155 | V46-I151 HydrophobicContact CG2-CG1 4.24Å; L47-I151 HydrophobicContact CD2-CG2 4.27Å; A50-I151 HydrophobicContact CB-CD1 3.36Å; A50-I151 HydrophobicContact CB-CG1 3.87Å; N129-I151 HydrophobicContact CB-CD1 3.58Å; N129-I151 HydrophobicContact CB-CG2 4.14Å; V147-I151 HydrophobicContact CG1-CD1 3.66Å; V147-I151 HydrophobicContact CG1-CG1 4.34Å; V147-I151 WeakPolarHBondContact O-CB 3.42Å; V147-I151 WeakPolarHBondContact O-CD1 3.33Å; V147-I151 WeakPolarHBondContact O-CG1 3.34Å; V147-I151 PolarHBondContact O-N 3.41Å; N149-I151 PolarHBondContact O-N 3.26Å; I151-A154 PolarHBondContact O-N 2.94Å; I151-W155 VanDerWaalsContact O-CD1 3.28Å; I151-W155 PolarHBondContact O-N 3.25Å |
| 152 | T | 90.3 | Very high | 84.7 | Confident | 13 Ų | 13 | 56 Ų | 56 | 8% | 0.08 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -63.9 | -43.7 | -176.8 | -61 | 0 | 0 | 0 | 0 | 110.9 | Y130 N131 I148 N149 N156 | Y130-T152 HydrophobicContact CD2-CG2 4.21Å; Y130-T152 HydrophobicContact CE2-CG2 3.96Å; N131-T152 PolarHBondContact N-OG1 3.25Å; N131-T152 VanDerWaalsContact N-OG1 3.09Å; N131-T152 WeakPolarHBondContact OD1-CG2 3.27Å; I148-T152 WeakPolarHBondContact O-CB 3.26Å; I148-T152 PolarHBondContact O-N 2.98Å; I148-T152 PolarHBondContact O-OG1 3.41Å; N149-T152 PolarHBondContact O-N 2.91Å; T152-N156 WeakPolarHBondContact O-CB 3.22Å; T152-N156 PolarHBondContact O-N 2.82Å; T152-N156 PolarHBondContact O-ND2 3.43Å |
| 153 | E | 89.9 | Confident | 85.8 | Confident | 140 Ų | 140 | 55.8 Ų | 55.8 | 65% | 0.654 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -62.3 | -46.4 | 175.9 | -174.4 | 177.3 | 176.6 | 0 | 0 | 111.7 | N149 W155 N156 R157 | N149-E153 VanDerWaalsContact O-CB 3.31Å; N149-E153 WeakPolarHBondContact O-CB 3.34Å; N149-E153 PolarHBondContact O-N 2.88Å; E153-W155 PolarHBondContact O-N 3.08Å; E153-N156 PolarHBondContact O-N 3.39Å; E153-R157 WeakPolarHBondContact O-CB 3.48Å; E153-R157 PolarHBondContact O-N 3.43Å |
| 154 | A | 89.8 | Confident | 87 | Confident | 3 Ų | 3 | 50.3 Ų | 50.3 | 3% | 0.025 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -59.6 | -49.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | G43 V46 L47 G150 I151 N156 R157 F158 | G43-A154 WeakPolarHBondContact O-CB 3.43Å; V46-A154 HydrophobicContact CG1-CB 4.27Å; L47-A154 HydrophobicContact CD1-CB 4Å; L47-A154 HydrophobicContact CD2-CB 4.15Å; L47-A154 HydrophobicContact CG-CB 3.93Å; G150-A154 VanDerWaalsContact O-CB 3.24Å; G150-A154 WeakPolarHBondContact O-CB 3.42Å; G150-A154 PolarHBondContact O-N 3.36Å; I151-A154 PolarHBondContact O-N 2.94Å; A154-N156 PolarHBondContact O-N 3.27Å; A154-R157 PolarHBondContact O-N 3.48Å; A154-F158 WeakPolarHBondContact O-CD2 3.23Å; A154-F158 PolarHBondContact O-N 3.33Å |
| 155 | W | 91.7 | Very high | 88 | Confident | 0 Ų | 0 | 45.4 Ų | 45.4 | 0% | 0 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -59.5 | -46.2 | 176 | -87.2 | 109.8 | 0 | 0 | 0 | 112.2 | L47 M126 Y130 I151 E153 R157 F158 M159 V167 C223 I227 | L47-W155 HydrophobicContact CD2-CG 4.4Å; M126-W155 HydrophobicContact CB-CZ2 3.72Å; M126-W155 HydrophobicContact CE-CH2 3.82Å; M126-W155 HydrophobicContact CE-CZ2 4.09Å; M126-W155 HydrophobicContact CE-CZ3 4.17Å; M126-W155 HydrophobicContact CG-CD2 3.96Å; M126-W155 HydrophobicContact CG-CE3 4.42Å; M126-W155 HydrophobicContact CG-CG 4.42Å; M126-W155 HydrophobicContact CG-CH2 4.39Å; M126-W155 HydrophobicContact CG-CZ2 3.88Å; Y130-W155 HydrophobicContact CD2-CB 3.71Å; Y130-W155 HydrophobicContact CD2-CG 4.17Å; Y130-W155 HydrophobicContact CE2-CB 3.8Å; I151-W155 VanDerWaalsContact O-CD1 3.28Å; I151-W155 PolarHBondContact O-N 3.25Å; E153-W155 PolarHBondContact O-N 3.08Å; W155-R157 VanDerWaalsContact C-N 3.27Å; W155-R157 PolarHBondContact O-N 3.21Å; W155-F158 PolarHBondContact O-N 3.3Å; W155-M159 HydrophobicContact CB-CE 4.13Å; W155-M159 WeakPolarHBondContact O-CB 3.3Å; W155-M159 WeakPolarHBondContact O-CE 3.25Å; W155-M159 VanDerWaalsContact O-CG 3.3Å; W155-M159 WeakPolarHBondContact O-CG 3.35Å; W155-M159 PolarHBondContact O-N 2.77Å; W155-V167 HydrophobicContact CH2-CG2 3.54Å; W155-V167 HydrophobicContact CZ2-CG2 4.03Å; W155-C223 HydrophobicContact CZ3-CB 3.85Å; W155-I227 HydrophobicContact CE3-CD1 4.36Å; W155-I227 HydrophobicContact CH2-CD1 3.72Å; W155-I227 HydrophobicContact CZ2-CD1 4.2Å; W155-I227 HydrophobicContact CZ3-CD1 3.85Å |
| 156 | N | 91.9 | Very high | 88.8 | Confident | 35 Ų | 35 | 43.6 Ų | 43.6 | 19% | 0.187 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -58 | -42.4 | 177.3 | -75.2 | -17.6 | 0 | 0 | 0 | 111.9 | Y130 T152 E153 A154 T160 Q194 | Y130-N156 WeakPolarHBondContact CE2-OD1 3.18Å; Y130-N156 PolarHBondContact OH-OD1 3.28Å; T152-N156 WeakPolarHBondContact O-CB 3.22Å; T152-N156 PolarHBondContact O-N 2.82Å; T152-N156 PolarHBondContact O-ND2 3.43Å; E153-N156 PolarHBondContact O-N 3.39Å; A154-N156 PolarHBondContact O-N 3.27Å; N156-T160 WeakPolarHBondContact O-CB 3.27Å; N156-T160 PolarHBondContact O-N 3.5Å; N156-T160 VanDerWaalsContact O-N 3.11Å; N156-T160 PolarHBondContact O-OG1 2.98Å; N156-Q194 HydrophobicContact CB-CG 3.92Å; N156-Q194 VanDerWaalsContact CG-NE2 3.31Å; N156-Q194 PolarHBondContact ND2-NE2 3.46Å; N156-Q194 PolarHBondContact OD1-NE2 2.98Å; N156-Q194 PolarHBondContact OD1-OE1 2.93Å |
| 157 | R | 90.3 | Very high | 89.7 | Confident | 69 Ų | 69 | 36.3 Ų | 36.3 | 26% | 0.26 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -67.2 | -46.8 | 179.1 | -156.8 | -173.4 | 76.9 | -137.5 | -15.9 | 111.6 | R41 A42 E153 A154 W155 T160 E161 | R41-R157 PolarHBondContact O-NH1 2.97Å; A42-R157 VanDerWaalsContact C-NH1 3.27Å; A42-R157 VanDerWaalsContact O-CZ 3.3Å; A42-R157 PolarHBondContact O-NH1 2.8Å; A42-R157 PolarHBondContact O-NH2 3.21Å; E153-R157 WeakPolarHBondContact O-CB 3.48Å; E153-R157 PolarHBondContact O-N 3.43Å; A154-R157 PolarHBondContact O-N 3.48Å; W155-R157 VanDerWaalsContact C-N 3.27Å; W155-R157 PolarHBondContact O-N 3.21Å; R157-T160 PolarHBondContact O-N 2.96Å; R157-E161 WeakPolarHBondContact CD-OE1 3.31Å; R157-E161 VanDerWaalsContact CG-CD 3.4Å; R157-E161 HydrophobicContact CG-CG 4.03Å; R157-E161 WeakPolarHBondContact CG-OE1 3.35Å; R157-E161 IonicContact NE-OE1 3.8Å; R157-E161 IonicContact NE-OE2 3.26Å; R157-E161 PolarHBondContact NE-OE2 2.78Å; R157-E161 WeakPolarHBondContact O-CB 3.4Å; R157-E161 WeakPolarHBondContact O-CG 3.49Å; R157-E161 PolarHBondContact O-N 3.48Å |
| 158 | F | 90.7 | Very high | 90.4 | Very high | 14 Ų | 14 | 40.8 Ų | 40.8 | 6% | 0.061 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -60.5 | -47.6 | 176.9 | -80.6 | -64.6 | 0 | 0 | 0 | 112.6 | L44 L47 A154 W155 T160 S162 C164 I227 | L44-F158 HydrophobicContact CD1-CZ 4.39Å; L44-F158 HydrophobicContact CD2-CE1 4.24Å; L44-F158 HydrophobicContact CD2-CE2 3.68Å; L44-F158 HydrophobicContact CD2-CZ 3.29Å; L44-F158 HydrophobicContact CG-CE2 4.2Å; L44-F158 HydrophobicContact CG-CZ 3.69Å; L47-F158 HydrophobicContact CD1-CD2 4.12Å; L47-F158 HydrophobicContact CD1-CE2 3.92Å; A154-F158 WeakPolarHBondContact O-CD2 3.23Å; A154-F158 PolarHBondContact O-N 3.33Å; W155-F158 PolarHBondContact O-N 3.3Å; F158-T160 VanDerWaalsContact C-N 3.26Å; F158-T160 PolarHBondContact O-N 3.16Å; F158-S162 WeakPolarHBondContact O-CA 3.2Å; F158-S162 VanDerWaalsContact O-CB 3.23Å; F158-S162 WeakPolarHBondContact O-CB 3.06Å; F158-S162 PolarHBondContact O-N 2.87Å; F158-C164 PolarHBondContact O-SG 3.28Å; F158-I227 HydrophobicContact CB-CD1 4.47Å; F158-I227 HydrophobicContact CB-CG1 4.45Å; F158-I227 HydrophobicContact CD1-CG1 3.93Å; F158-I227 HydrophobicContact CD2-CD1 4.1Å; F158-I227 HydrophobicContact CD2-CG1 3.83Å; F158-I227 HydrophobicContact CE1-CG1 4.17Å; F158-I227 HydrophobicContact CE2-CG1 4.09Å; F158-I227 HydrophobicContact CG-CD1 4.2Å; F158-I227 HydrophobicContact CG-CG1 3.79Å; F158-I227 HydrophobicContact CZ-CG1 4.28Å |
| 159 | M | 92.3 | Very high | 90.9 | Very high | 0 Ų | 0 | 40.4 Ų | 40.4 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -59.5 | -40.1 | 179.4 | -70 | -175.9 | -70.3 | 0 | 0 | 111.7 | Y130 W155 K163 C164 W173 P192 Q194 C195 | Y130-M159 HydrophobicContact CE2-CE 3.86Å; W155-M159 HydrophobicContact CB-CE 4.13Å; W155-M159 WeakPolarHBondContact O-CB 3.3Å; W155-M159 WeakPolarHBondContact O-CE 3.25Å; W155-M159 VanDerWaalsContact O-CG 3.3Å; W155-M159 WeakPolarHBondContact O-CG 3.35Å; W155-M159 PolarHBondContact O-N 2.77Å; M159-K163 WeakPolarHBondContact O-CA 3.45Å; M159-K163 PolarHBondContact O-N 3.29Å; M159-C164 VanDerWaalsContact CA-O 3.24Å; M159-C164 WeakPolarHBondContact CA-O 3.25Å; M159-C164 WeakPolarHBondContact CB-O 3.18Å; M159-C164 PolarHBondContact O-N 3.21Å; M159-W173 HydrophobicContact SD-CZ2 4.27Å; M159-P192 HydrophobicContact CE-CB 3.87Å; M159-P192 HydrophobicContact CE-CG 4.1Å; M159-P192 HydrophobicContact SD-CB 4.26Å; M159-P192 HydrophobicContact SD-CG 4.34Å; M159-Q194 CarbonylContact C-O 3.45Å; M159-Q194 HydrophobicContact CB-CB 3.77Å; M159-Q194 HydrophobicContact CE-CB 4.09Å; M159-C195 PolarHBondContact SD-SG 2.93Å |
| 160 | T | 90.3 | Very high | 91.3 | Very high | 48 Ų | 48 | 37 Ų | 37 | 29% | 0.294 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -75 | -52.3 | 180 | -52 | 0 | 0 | 0 | 0 | 112.8 | N156 R157 F158 | N156-T160 WeakPolarHBondContact O-CB 3.27Å; N156-T160 PolarHBondContact O-N 3.5Å; N156-T160 VanDerWaalsContact O-N 3.11Å; N156-T160 PolarHBondContact O-OG1 2.98Å; R157-T160 PolarHBondContact O-N 2.96Å; F158-T160 VanDerWaalsContact C-N 3.26Å; F158-T160 PolarHBondContact O-N 3.16Å |
| 161 | E | 90.1 | Very high | 91.5 | Very high | 128 Ų | 128 | 43.3 Ų | 43.3 | 60% | 0.598 | 21% | 0.205 | S | C | * | . | H | α-helix | trans | -75.2 | -41.9 | -173.4 | -69.3 | 179.6 | 171.4 | 0 | 0 | 112.4 | R157 | R157-E161 WeakPolarHBondContact CD-OE1 3.31Å; R157-E161 VanDerWaalsContact CG-CD 3.4Å; R157-E161 HydrophobicContact CG-CG 4.03Å; R157-E161 WeakPolarHBondContact CG-OE1 3.35Å; R157-E161 IonicContact NE-OE1 3.8Å; R157-E161 IonicContact NE-OE2 3.26Å; R157-E161 PolarHBondContact NE-OE2 2.78Å; R157-E161 WeakPolarHBondContact O-CB 3.4Å; R157-E161 WeakPolarHBondContact O-CG 3.49Å; R157-E161 PolarHBondContact O-N 3.48Å |
| 162 | S | 89.4 | Confident | 91.7 | Very high | 30 Ų | 30 | 43.7 Ų | 43.7 | 21% | 0.21 | 21% | 0.207 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -90.1 | -1.5 | -177.3 | -54.4 | 0 | 0 | 0 | 0 | 113 | F158 C164 | F158-S162 WeakPolarHBondContact O-CA 3.2Å; F158-S162 VanDerWaalsContact O-CB 3.23Å; F158-S162 WeakPolarHBondContact O-CB 3.06Å; F158-S162 PolarHBondContact O-N 2.87Å; S162-C164 VanDerWaalsContact C-N 3.31Å; S162-C164 PolarHBondContact O-N 2.95Å |
| 163 | K | 91.7 | Very high | 91.8 | Very high | 139 Ų | 139 | 43 Ų | 43 | 60% | 0.604 | 20% | 0.203 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 53.5 | 48.2 | 177.9 | -60.4 | -178.5 | -176.9 | 178.6 | 0 | 112.2 | M159 H219 | M159-K163 WeakPolarHBondContact O-CA 3.45Å; M159-K163 PolarHBondContact O-N 3.29Å; K163-H219 WeakPolarHBondContact O-CB 3.36Å; K163-H219 VanDerWaalsContact O-CG 3.3Å; K163-H219 PolarHBondContact O-ND1 3.35Å |
| 164 | C | 93.4 | Very high | 91.7 | Very high | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 19% | 0.188 | C | C | . | . | trans | -128.3 | 167 | -177.3 | 64 | 0 | 0 | 0 | 0 | 110.1 | F158 M159 S162 Q221 C223 Y226 | F158-C164 PolarHBondContact O-SG 3.28Å; M159-C164 VanDerWaalsContact CA-O 3.24Å; M159-C164 WeakPolarHBondContact CA-O 3.25Å; M159-C164 WeakPolarHBondContact CB-O 3.18Å; M159-C164 PolarHBondContact O-N 3.21Å; S162-C164 VanDerWaalsContact C-N 3.31Å; S162-C164 PolarHBondContact O-N 2.95Å; C164-Q221 CarbonylContact C-O 3.02Å; C164-Q221 VanDerWaalsContact CA-O 3.24Å; C164-Q221 WeakPolarHBondContact CA-O 3.12Å; C164-Q221 WeakPolarHBondContact CB-O 3.44Å; C164-C223 HydrophobicContact CB-CB 3.91Å; C164-C223 WeakPolarHBondContact CB-SG 3.22Å; C164-C223 WeakPolarHBondContact SG-CA 3.34Å; C164-C223 WeakPolarHBondContact SG-CB 3.45Å; C164-C223 CovalentContact SG-SG 2.03Å; C164-C223 PolarHBondContact SG-SG 3.38Å; C164-Y226 HydrophobicContact CB-CD2 4.07Å; C164-Y226 HydrophobicContact CB-CE2 4.17Å | ||
| 165 | C | 94.2 | Very high | 91.7 | Very high | 0 Ų | 0 | 45.6 Ų | 45.6 | 0% | 0 | 22% | 0.216 | C | C | . | . | trans | -144.3 | 134.2 | 176.3 | -172.1 | 0 | 0 | 0 | 0 | 111.4 | G169 P170 C195 H219 Q221 | C165-G169 CarbonylContact O-C 3.51Å; C165-G169 WeakPolarHBondContact O-CA 3.45Å; C165-G169 PolarHBondContact O-N 3.35Å; C165-P170 HydrophobicContact CB-CB 4.14Å; C165-P170 VanDerWaalsContact SG-CA 3.57Å; C165-C195 HydrophobicContact CB-CB 3.53Å; C165-C195 WeakPolarHBondContact CB-SG 3.19Å; C165-C195 WeakPolarHBondContact SG-CB 3.39Å; C165-C195 CovalentContact SG-SG 2.02Å; C165-C195 PolarHBondContact SG-SG 3.28Å; C165-H219 HydrophobicContact CB-CB 4.38Å; C165-H219 WeakPolarHBondContact CB-O 3.48Å; C165-Q221 PolarHBondContact N-O 3.32Å | ||
| 166 | G | 93.2 | Very high | 91.6 | Very high | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 23% | 0.232 | C | C | . | . | S | Bend | trans | 64.7 | -171.7 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113 | C223 | G166-C223 WeakPolarHBondContact O-CB 3.4Å; G166-C223 PolarHBondContact O-N 2.82Å |
| 167 | V | 93.9 | Very high | 91.3 | Very high | 2 Ų | 2 | 54.8 Ų | 54.8 | 1% | 0.012 | 26% | 0.255 | C | S | . | . | S | Bend | trans | -80.5 | -55.4 | 176.7 | 159.7 | 0 | 0 | 0 | 0 | 109.4 | P119 F122 L123 M126 W155 D172 G222 C223 Y224 | P119-V167 HydrophobicContact CB-CG1 3.67Å; P119-V167 WeakPolarHBondContact O-CG1 3.38Å; F122-V167 HydrophobicContact CB-CG2 3.78Å; L123-V167 HydrophobicContact CB-CB 4.28Å; L123-V167 HydrophobicContact CB-CG1 4.37Å; L123-V167 HydrophobicContact CB-CG2 4.12Å; L123-V167 HydrophobicContact CD1-CB 4.39Å; M126-V167 HydrophobicContact CE-CB 3.94Å; M126-V167 HydrophobicContact CE-CG2 3.46Å; M126-V167 VanDerWaalsContact CE-CG2 3.46Å; M126-V167 VanDerWaalsContact CE-N 3.3Å; W155-V167 HydrophobicContact CH2-CG2 3.54Å; W155-V167 HydrophobicContact CZ2-CG2 4.03Å; V167-D172 WeakPolarHBondContact CA-OD2 3.24Å; V167-D172 PolarHBondContact N-OD2 3.3Å; V167-G222 CarbonylContact O-C 3.49Å; V167-G222 VanDerWaalsContact O-CA 3.22Å; V167-G222 WeakPolarHBondContact O-CA 3.31Å; V167-C223 PolarHBondContact O-N 3.36Å; V167-Y224 VanDerWaalsContact O-CB 3.25Å; V167-Y224 WeakPolarHBondContact O-CB 3.19Å; V167-Y224 PolarHBondContact O-N 2.83Å |
| 168 | Y | 94 | Very high | 91.2 | Very high | 121 Ų | 121 | 51.6 Ų | 51.6 | 48% | 0.475 | 24% | 0.243 | S | C | . | . | S | Bend | trans | -95.4 | -29.1 | 177.8 | -61.3 | -73.6 | 0 | 0 | 0 | 111.8 | P119 L123 D172 G222 | P119-Y168 HydrophobicContact CB-CE1 3.8Å; P119-Y168 HydrophobicContact CB-CE2 4.34Å; P119-Y168 WeakPolarHBondContact CB-OH 3.36Å; P119-Y168 HydrophobicContact CG-CE1 3.97Å; P119-Y168 WeakPolarHBondContact CG-OH 3.12Å; L123-Y168 HydrophobicContact CD2-CD2 4.34Å; L123-Y168 HydrophobicContact CD2-CE2 4.04Å; Y168-D172 PolarHBondContact N-OD2 3.44Å; Y168-G222 WeakPolarHBondContact O-CA 3.26Å; Y168-G222 PolarHBondContact O-N 3.25Å |
| 169 | G | 93.2 | Very high | 91.1 | Very high | 7 Ų | 7 | 53.3 Ų | 53.3 | 7% | 0.072 | 25% | 0.251 | C | S | . | . | trans | 168.4 | -178.9 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | C165 E171 D172 | C165-G169 CarbonylContact O-C 3.51Å; C165-G169 WeakPolarHBondContact O-CA 3.45Å; C165-G169 PolarHBondContact O-N 3.35Å; G169-E171 PolarHBondContact O-N 3.36Å; G169-D172 PolarHBondContact N-OD2 3.12Å; G169-D172 WeakPolarHBondContact O-CB 3.45Å; G169-D172 PolarHBondContact O-N 3.37Å; G169-D172 VanDerWaalsContact O-N 3.16Å | ||
| 170 | P | 92.1 | Very high | 90.9 | Very high | 13 Ų | 13 | 53.8 Ų | 53.8 | 8% | 0.084 | 25% | 0.253 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -62.3 | -23.4 | 178.9 | 24.7 | -33.8 | 0 | 0 | 0 | 113.6 | C165 D172 W173 W191 L218 | C165-P170 HydrophobicContact CB-CB 4.14Å; C165-P170 VanDerWaalsContact SG-CA 3.57Å; P170-D172 PolarHBondContact O-N 3.05Å; P170-W173 PolarHBondContact O-N 2.98Å; P170-W191 HydrophobicContact CB-CD2 4.25Å; P170-W191 HydrophobicContact CB-CE3 4.07Å; P170-W191 HydrophobicContact CB-CZ3 4.46Å; P170-L218 HydrophobicContact CB-CD1 4.16Å; P170-L218 HydrophobicContact CB-CD2 3.88Å; P170-L218 HydrophobicContact CB-CG 4.34Å; P170-L218 HydrophobicContact CG-CD2 3.66Å; P170-L218 HydrophobicContact CG-CG 4.2Å |
| 171 | E | 91.3 | Very high | 90.8 | Very high | 147 Ų | 147 | 56 Ų | 56 | 69% | 0.687 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -60.7 | -24.2 | 176.3 | -63.8 | -172.8 | -166.5 | 0 | 0 | 113.2 | G169 W173 V174 K175 | G169-E171 PolarHBondContact O-N 3.36Å; E171-W173 PolarHBondContact O-N 3.48Å; E171-V174 PolarHBondContact O-N 3.22Å; E171-V174 VanDerWaalsContact O-N 3.1Å; E171-K175 WeakPolarHBondContact O-CB 3.18Å; E171-K175 PolarHBondContact O-N 3.42Å |
| 172 | D | 92.8 | Very high | 90.6 | Very high | 8 Ų | 8 | 55.3 Ų | 55.3 | 4% | 0.043 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -57.1 | -34.1 | 179 | -70.5 | -25.8 | 0 | 0 | 0 | 112.2 | L123 V167 Y168 G169 P170 | L123-D172 HydrophobicContact CD1-CB 3.78Å; V167-D172 WeakPolarHBondContact CA-OD2 3.24Å; V167-D172 PolarHBondContact N-OD2 3.3Å; Y168-D172 PolarHBondContact N-OD2 3.44Å; G169-D172 PolarHBondContact N-OD2 3.12Å; G169-D172 WeakPolarHBondContact O-CB 3.45Å; G169-D172 PolarHBondContact O-N 3.37Å; G169-D172 VanDerWaalsContact O-N 3.16Å; P170-D172 PolarHBondContact O-N 3.05Å |
| 173 | W | 90.7 | Very high | 90.4 | Very high | 0 Ų | 0 | 58.7 Ų | 58.7 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -74.9 | -28.1 | -179.4 | -61.4 | 104.1 | 0 | 0 | 0 | 113.6 | M126 Y130 M159 P170 E171 F180 R181 P190 W191 P192 | M126-W173 HydrophobicContact CG-CH2 3.61Å; M126-W173 HydrophobicContact CG-CZ2 3.92Å; M126-W173 HydrophobicContact CG-CZ3 4.36Å; M126-W173 HydrophobicContact SD-CD2 4.27Å; M126-W173 HydrophobicContact SD-CE3 4.34Å; M126-W173 HydrophobicContact SD-CH2 3.36Å; M126-W173 WeakPolarHBondContact SD-CH2 3.25Å; M126-W173 HydrophobicContact SD-CZ2 3.26Å; M126-W173 WeakPolarHBondContact SD-CZ2 3.43Å; M126-W173 HydrophobicContact SD-CZ3 3.92Å; Y130-W173 AromaticContact CD1-CH2 3.35Å; Y130-W173 HydrophobicContact CD1-CH2 3.35Å; Y130-W173 HydrophobicContact CD1-CZ2 4.47Å; Y130-W173 AromaticContact CD1-CZ3 3.51Å; Y130-W173 HydrophobicContact CD1-CZ3 3.51Å; Y130-W173 HydrophobicContact CD2-CH2 4.01Å; Y130-W173 AromaticContact CE1-CH2 3.8Å; Y130-W173 HydrophobicContact CE1-CH2 3.8Å; Y130-W173 HydrophobicContact CE1-CZ3 4.1Å; Y130-W173 HydrophobicContact CE2-CH2 4.42Å; Y130-W173 AromaticContact CG-CH2 3.47Å; Y130-W173 HydrophobicContact CG-CH2 3.47Å; Y130-W173 VanDerWaalsContact CG-CH2 3.47Å; Y130-W173 AromaticContact CG-CZ3 3.98Å; Y130-W173 HydrophobicContact CG-CZ3 3.98Å; M159-W173 HydrophobicContact SD-CZ2 4.27Å; P170-W173 PolarHBondContact O-N 2.98Å; E171-W173 PolarHBondContact O-N 3.48Å; W173-F180 HydrophobicContact CE3-CB 4.07Å; W173-F180 AromaticContact CE3-CD1 3.95Å; W173-F180 HydrophobicContact CE3-CD1 3.95Å; W173-F180 HydrophobicContact CE3-CG 4.15Å; W173-F180 HydrophobicContact CZ3-CB 3.86Å; W173-F180 HydrophobicContact CZ3-CD1 4.46Å; W173-F180 HydrophobicContact CZ3-CG 4.2Å; W173-R181 WeakPolarHBondContact O-CD 3.06Å; W173-P190 WeakPolarHBondContact CB-O 3.38Å; W173-W191 HydrophobicContact CB-CB 4.06Å; W173-W191 HydrophobicContact CG-CB 3.91Å; W173-P192 VanDerWaalsContact CD2-CD 3.47Å; W173-P192 HydrophobicContact CD2-CG 4.03Å; W173-P192 HydrophobicContact CE3-CG 4.27Å; W173-P192 HydrophobicContact CH2-CG 3.8Å; W173-P192 HydrophobicContact CZ2-CG 3.51Å; W173-P192 HydrophobicContact CZ3-CG 4.17Å |
| 174 | V | 89.7 | Confident | 90.1 | Very high | 54 Ų | 54 | 53.7 Ų | 53.7 | 33% | 0.327 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -97.1 | -39.4 | -174.7 | -176.5 | 0 | 0 | 0 | 0 | 111.1 | E171 P190 W191 | E171-V174 PolarHBondContact O-N 3.22Å; E171-V174 VanDerWaalsContact O-N 3.1Å; V174-P190 HydrophobicContact CG2-CB 4.14Å; V174-W191 HydrophobicContact CG2-CE3 4.07Å; V174-W191 HydrophobicContact CG2-CZ3 4.21Å |
| 175 | K | 89.7 | Confident | 89.5 | Confident | 142 Ų | 142 | 57.3 Ų | 57.3 | 62% | 0.617 | 27% | 0.268 | S | S | * | . | H | α-helix | trans | -71.2 | -34 | -175.9 | -175.5 | 178 | 179.1 | -177.2 | 0 | 112.7 | E171 | E171-K175 WeakPolarHBondContact O-CB 3.18Å; E171-K175 PolarHBondContact O-N 3.42Å |
| 176 | Y | 87.6 | Confident | 88.7 | Confident | 88 Ų | 88 | 60.7 Ų | 60.7 | 35% | 0.345 | 29% | 0.286 | S | S | . | . | S | Bend | trans | -112.9 | 154.1 | -176.2 | -57.5 | -70.9 | 0 | 0 | 0 | 111.7 | L123 L127 S178 | L123-Y176 HydrophobicContact CD1-CD2 4.43Å; L123-Y176 HydrophobicContact CD2-CD2 4.23Å; L123-Y176 HydrophobicContact CD2-CE2 3.78Å; L127-Y176 HydrophobicContact CD1-CD2 4.16Å; L127-Y176 HydrophobicContact CD1-CG 3.97Å; Y176-S178 PolarHBondContact O-N 3.1Å |
| 177 | E | 86.6 | Confident | 87.8 | Confident | 141 Ų | 141 | 64.6 Ų | 64.6 | 66% | 0.659 | 32% | 0.318 | S | S | * | . | trans | -74.9 | 124.7 | 171.3 | -163.9 | -179.2 | 166.3 | 0 | 0 | 109.7 | Q182 | E177-Q182 PolarHBondContact OE1-NE2 3.11Š| ||
| 178 | S | 89.2 | Confident | 87 | Confident | 2 Ų | 2 | 69 Ų | 69 | 1% | 0.014 | 34% | 0.341 | C | S | . | . | trans | -130.1 | 156.9 | 176.8 | 62.9 | 0 | 0 | 0 | 0 | 110.6 | L127 Y176 F180 R181 Q182 | L127-S178 WeakPolarHBondContact O-CA 3.09Å; L127-S178 WeakPolarHBondContact O-CB 3.49Å; Y176-S178 PolarHBondContact O-N 3.1Å; S178-F180 PolarHBondContact O-N 3.1Å; S178-R181 PolarHBondContact O-N 3.33Å; S178-R181 VanDerWaalsContact O-N 3.1Å; S178-R181 WeakPolarHBondContact OG-CB 3.5Å; S178-R181 PolarHBondContact OG-N 2.78Å; S178-R181 VanDerWaalsContact OG-N 3.1Å; S178-Q182 WeakPolarHBondContact O-CG 3.36Å; S178-Q182 PolarHBondContact O-N 3.05Å | ||
| 179 | H | 87.1 | Confident | 86.5 | Confident | 49 Ų | 49 | 64.5 Ų | 64.5 | 23% | 0.227 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -60.6 | -31.8 | 172.2 | -85.4 | -65 | 0 | 0 | 0 | 112.4 | L127 Q128 Q182 Q183 | L127-H179 PolarHBondContact O-N 3.23Å; L127-H179 VanDerWaalsContact O-N 3.08Å; Q128-H179 PolarHBondContact O-CD2 3.34Å; H179-Q182 PolarHBondContact ND1-OE1 3.43Å; H179-Q182 VanDerWaalsContact ND1-OE1 3.13Å; H179-Q182 PolarHBondContact O-N 3.39Å; H179-Q183 PolarHBondContact O-N 3.37Å |
| 180 | F | 88.4 | Confident | 86.2 | Confident | 10 Ų | 10 | 64.8 Ų | 64.8 | 4% | 0.044 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -58.3 | -49.2 | 171.8 | 176.1 | -98.2 | 0 | 0 | 0 | 111.9 | Y130 W173 S178 Q182 Q183 N184 N189 W191 P192 | Y130-F180 HydrophobicContact CD1-CB 4.05Å; Y130-F180 HydrophobicContact CD1-CD2 4.21Å; Y130-F180 HydrophobicContact CD1-CG 4.38Å; Y130-F180 HydrophobicContact CE1-CB 4.45Å; Y130-F180 AromaticContact CE1-CD2 3.78Å; Y130-F180 HydrophobicContact CE1-CD2 3.78Å; Y130-F180 HydrophobicContact CE1-CE2 4.42Å; Y130-F180 HydrophobicContact CE1-CG 4.31Å; W173-F180 HydrophobicContact CE3-CB 4.07Å; W173-F180 AromaticContact CE3-CD1 3.95Å; W173-F180 HydrophobicContact CE3-CD1 3.95Å; W173-F180 HydrophobicContact CE3-CG 4.15Å; W173-F180 HydrophobicContact CZ3-CB 3.86Å; W173-F180 HydrophobicContact CZ3-CD1 4.46Å; W173-F180 HydrophobicContact CZ3-CG 4.2Å; S178-F180 PolarHBondContact O-N 3.1Å; F180-Q182 VanDerWaalsContact C-N 3.31Å; F180-Q182 PolarHBondContact O-N 3.45Å; F180-Q183 PolarHBondContact O-N 3.13Å; F180-Q183 VanDerWaalsContact O-N 3.1Å; F180-N184 HydrophobicContact CE1-CB 4.09Å; F180-N184 HydrophobicContact CE2-CB 4.43Å; F180-N184 WeakPolarHBondContact CE2-ND2 3.4Å; F180-N184 HydrophobicContact CZ-CB 4.02Å; F180-N184 WeakPolarHBondContact O-CB 3.47Å; F180-N184 PolarHBondContact O-N 2.92Å; F180-N184 PolarHBondContact O-ND2 3.25Å; F180-N189 WeakPolarHBondContact CE1-O 3.34Å; F180-N189 HydrophobicContact CZ-CB 4.18Å; F180-W191 VanDerWaalsContact CZ-C 3.42Å; F180-W191 WeakPolarHBondContact CZ-O 3.42Å; F180-P192 HydrophobicContact CD2-CG 4.44Å; F180-P192 HydrophobicContact CE2-CG 4.25Å; F180-P192 HydrophobicContact CZ-CG 4.34Å |
| 181 | R | 87.5 | Confident | 86.2 | Confident | 94 Ų | 94 | 65.5 Ų | 65.5 | 36% | 0.355 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -68.9 | -27.9 | -178.7 | -171.2 | 166.8 | -176.2 | -106.7 | 0.4 | 113.1 | W173 S178 Q183 D186 | W173-R181 WeakPolarHBondContact O-CD 3.06Å; S178-R181 PolarHBondContact O-N 3.33Å; S178-R181 VanDerWaalsContact O-N 3.1Å; S178-R181 WeakPolarHBondContact OG-CB 3.5Å; S178-R181 PolarHBondContact OG-N 2.78Å; S178-R181 VanDerWaalsContact OG-N 3.1Å; R181-Q183 PolarHBondContact O-N 2.84Å; R181-D186 IonicContact CZ-OD1 3.7Å; R181-D186 IonicContact CZ-OD2 3.6Å; R181-D186 IonicContact NE-OD1 2.93Å; R181-D186 PolarHBondContact NE-OD1 3.19Å; R181-D186 IonicContact NE-OD2 3.6Å; R181-D186 IonicContact NH2-OD1 3.59Å; R181-D186 IonicContact NH2-OD2 2.74Å; R181-D186 PolarHBondContact NH2-OD2 3.28Å |
| 182 | Q | 86.4 | Confident | 86.2 | Confident | 115 Ų | 115 | 58.6 Ų | 58.6 | 54% | 0.537 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -65.3 | -24.6 | 172.3 | -70.1 | 173 | -5.2 | 0 | 0 | 112.7 | E177 S178 H179 F180 | E177-Q182 PolarHBondContact OE1-NE2 3.11Å; S178-Q182 WeakPolarHBondContact O-CG 3.36Å; S178-Q182 PolarHBondContact O-N 3.05Å; H179-Q182 PolarHBondContact ND1-OE1 3.43Å; H179-Q182 VanDerWaalsContact ND1-OE1 3.13Å; H179-Q182 PolarHBondContact O-N 3.39Å; F180-Q182 VanDerWaalsContact C-N 3.31Å; F180-Q182 PolarHBondContact O-N 3.45Å |
| 183 | Q | 84.9 | Confident | 86.1 | Confident | 100 Ų | 100 | 65.1 Ų | 65.1 | 47% | 0.467 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -102.8 | -16.4 | -178.8 | -63.3 | 174.8 | 18.2 | 0 | 0 | 113.7 | N131 H179 F180 R181 | N131-Q183 PolarHBondContact O-NE2 2.81Å; N131-Q183 VanDerWaalsContact O-NE2 3.1Å; H179-Q183 PolarHBondContact O-N 3.37Å; F180-Q183 PolarHBondContact O-N 3.13Å; F180-Q183 VanDerWaalsContact O-N 3.1Å; R181-Q183 PolarHBondContact O-N 2.84Å |
| 184 | N | 85.2 | Confident | 86.1 | Confident | 35 Ų | 35 | 67.2 Ų | 67.2 | 19% | 0.187 | 33% | 0.329 | C | S | . | . | S | Bend | trans | -125.8 | 129.5 | -174.1 | -67 | -88.7 | 0 | 0 | 0 | 109.9 | F180 N189 | F180-N184 HydrophobicContact CE1-CB 4.09Å; F180-N184 HydrophobicContact CE2-CB 4.43Å; F180-N184 WeakPolarHBondContact CE2-ND2 3.4Å; F180-N184 HydrophobicContact CZ-CB 4.02Å; F180-N184 WeakPolarHBondContact O-CB 3.47Å; F180-N184 PolarHBondContact O-N 2.92Å; F180-N184 PolarHBondContact O-ND2 3.25Å; N184-N189 HydrophobicContact CB-CB 4.25Å; N184-N189 PolarHBondContact OD1-ND2 3.1Å |
| 185 | T | 82.8 | Confident | 86.2 | Confident | 76 Ų | 76 | 64.7 Ų | 64.7 | 47% | 0.466 | 31% | 0.313 | S | S | . | . | trans | -75.6 | 146.8 | 175.1 | 69.1 | 0 | 0 | 0 | 0 | 110 | A187 D188 N189 | T185-A187 PolarHBondContact O-N 3.19Å; T185-A187 VanDerWaalsContact O-N 3.14Å; T185-D188 PolarHBondContact O-N 3.18Å; T185-D188 VanDerWaalsContact O-N 3.11Å; T185-D188 WeakPolarHBondContact OG1-CB 3.14Å; T185-D188 VanDerWaalsContact OG1-CG 3.27Å; T185-D188 PolarHBondContact OG1-N 3.16Å; T185-D188 VanDerWaalsContact OG1-N 3.16Å; T185-D188 PolarHBondContact OG1-OD2 2.83Å; T185-N189 CarbonylContact O-C 3.48Å; T185-N189 PolarHBondContact O-N 3.14Å | ||
| 186 | D | 77 | Confident | 86.2 | Confident | 71 Ų | 71 | 58.1 Ų | 58.1 | 38% | 0.38 | 29% | 0.285 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.8 | -23.3 | 176.5 | -61.7 | -22.1 | 0 | 0 | 0 | 112.1 | R181 P190 | R181-D186 IonicContact CZ-OD1 3.7Å; R181-D186 IonicContact CZ-OD2 3.6Å; R181-D186 IonicContact NE-OD1 2.93Å; R181-D186 PolarHBondContact NE-OD1 3.19Å; R181-D186 IonicContact NE-OD2 3.6Å; R181-D186 IonicContact NH2-OD1 3.59Å; R181-D186 IonicContact NH2-OD2 2.74Å; R181-D186 PolarHBondContact NH2-OD2 3.28Å; D186-P190 WeakPolarHBondContact O-CD 3.33Å |
| 187 | A | 73.2 | Confident | 86.3 | Confident | 82 Ų | 82 | 57.3 Ų | 57.3 | 68% | 0.678 | 29% | 0.285 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.9 | -34.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113 | T185 | T185-A187 PolarHBondContact O-N 3.19Å; T185-A187 VanDerWaalsContact O-N 3.14Å |
| 188 | D | 78.3 | Confident | 86.4 | Confident | 93 Ų | 93 | 54 Ų | 54 | 50% | 0.497 | 27% | 0.269 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -92.6 | -48.3 | -176.9 | -66.1 | -44.5 | 0 | 0 | 0 | 112.1 | T185 K211 | T185-D188 PolarHBondContact O-N 3.18Å; T185-D188 VanDerWaalsContact O-N 3.11Å; T185-D188 WeakPolarHBondContact OG1-CB 3.14Å; T185-D188 VanDerWaalsContact OG1-CG 3.27Å; T185-D188 PolarHBondContact OG1-N 3.16Å; T185-D188 VanDerWaalsContact OG1-N 3.16Å; T185-D188 PolarHBondContact OG1-OD2 2.83Å; D188-K211 WeakPolarHBondContact O-CE 3.45Å |
| 189 | N | 83.4 | Confident | 86 | Confident | 28 Ų | 28 | 56.8 Ų | 56.8 | 15% | 0.15 | 28% | 0.284 | C | S | . | . | trans | -147.4 | 89 | 178.6 | -54.9 | -67.8 | 0 | 0 | 0 | 110.4 | F180 N184 T185 W191 | F180-N189 WeakPolarHBondContact CE1-O 3.34Å; F180-N189 HydrophobicContact CZ-CB 4.18Å; N184-N189 HydrophobicContact CB-CB 4.25Å; N184-N189 PolarHBondContact OD1-ND2 3.1Å; T185-N189 CarbonylContact O-C 3.48Å; T185-N189 PolarHBondContact O-N 3.14Å; N189-W191 PolarHBondContact O-N 3.18Å | ||
| 190 | P | 87 | Confident | 85.6 | Confident | 12 Ų | 12 | 59.7 Ų | 59.7 | 8% | 0.078 | 32% | 0.316 | C | S | . | . | S | Bend | trans | -67.5 | -19.5 | 179.4 | 24.9 | -32.1 | 0 | 0 | 0 | 113.7 | W173 V174 D186 K211 | W173-P190 WeakPolarHBondContact CB-O 3.38Å; V174-P190 HydrophobicContact CG2-CB 4.14Å; D186-P190 WeakPolarHBondContact O-CD 3.33Å; P190-K211 WeakPolarHBondContact CG-O 3.24Å |
| 191 | W | 91.4 | Very high | 85.2 | Confident | 29 Ų | 29 | 67.2 Ų | 67.2 | 11% | 0.11 | 35% | 0.354 | C | S | . | . | S | Bend | trans | -148.9 | 168.8 | 174.7 | 41 | 74.1 | 0 | 0 | 0 | 110 | P170 W173 V174 F180 N189 C195 C210 L218 | P170-W191 HydrophobicContact CB-CD2 4.25Å; P170-W191 HydrophobicContact CB-CE3 4.07Å; P170-W191 HydrophobicContact CB-CZ3 4.46Å; W173-W191 HydrophobicContact CB-CB 4.06Å; W173-W191 HydrophobicContact CG-CB 3.91Å; V174-W191 HydrophobicContact CG2-CE3 4.07Å; V174-W191 HydrophobicContact CG2-CZ3 4.21Å; F180-W191 VanDerWaalsContact CZ-C 3.42Å; F180-W191 WeakPolarHBondContact CZ-O 3.42Å; N189-W191 PolarHBondContact O-N 3.18Å; W191-C195 HydrophobicContact CG-CB 4.33Å; W191-C210 WeakPolarHBondContact CZ2-O 3.02Å; W191-L218 HydrophobicContact CD2-CD1 4.22Å; W191-L218 VanDerWaalsContact CE2-CD1 3.49Å; W191-L218 HydrophobicContact CG-CD1 4.45Å; W191-L218 HydrophobicContact CH2-CD2 3.74Å; W191-L218 HydrophobicContact CZ2-CD1 3.77Å; W191-L218 HydrophobicContact CZ2-CD2 3.43Å; W191-L218 VanDerWaalsContact CZ2-CD2 3.43Å; W191-L218 HydrophobicContact CZ2-CG 4.16Å; W191-L218 HydrophobicContact CZ3-CD2 4.47Å; W191-L218 VanDerWaalsContact NE1-CD1 3.32Å |
| 192 | P | 91.6 | Very high | 84.7 | Confident | 1 Ų | 1 | 64.7 Ų | 64.7 | 1% | 0.006 | 36% | 0.357 | C | S | . | . | trans | -55.1 | 145.1 | 175 | -29.9 | 38.5 | 0 | 0 | 0 | 113.5 | Y130 M159 W173 F180 Q194 C195 | Y130-P192 HydrophobicContact CD1-CG 4.41Å; Y130-P192 HydrophobicContact CE1-CB 4.2Å; Y130-P192 HydrophobicContact CE1-CG 3.52Å; Y130-P192 WeakPolarHBondContact OH-CB 3.17Å; M159-P192 HydrophobicContact CE-CB 3.87Å; M159-P192 HydrophobicContact CE-CG 4.1Å; M159-P192 HydrophobicContact SD-CB 4.26Å; M159-P192 HydrophobicContact SD-CG 4.34Å; W173-P192 VanDerWaalsContact CD2-CD 3.47Å; W173-P192 HydrophobicContact CD2-CG 4.03Å; W173-P192 HydrophobicContact CE3-CG 4.27Å; W173-P192 HydrophobicContact CH2-CG 3.8Å; W173-P192 HydrophobicContact CZ2-CG 3.51Å; W173-P192 HydrophobicContact CZ3-CG 4.17Å; F180-P192 HydrophobicContact CD2-CG 4.44Å; F180-P192 HydrophobicContact CE2-CG 4.25Å; F180-P192 HydrophobicContact CZ-CG 4.34Å; P192-Q194 PolarHBondContact O-N 2.79Å; P192-Q194 VanDerWaalsContact O-N 3.14Å; P192-C195 VanDerWaalsContact O-CB 3.28Å; P192-C195 WeakPolarHBondContact O-CB 3.46Å; P192-C195 PolarHBondContact O-N 3.04Å | ||
| 193 | R | 89.5 | Confident | 84.5 | Confident | 145 Ų | 145 | 61.7 Ų | 61.7 | 55% | 0.547 | 35% | 0.352 | S | S | . | . | G | 310 helix | trans | -60.5 | -26.3 | 179.4 | -70.4 | -175.8 | 179.3 | -177.5 | 0.8 | 113.2 | C195 C196 I204 | R193-C195 PolarHBondContact O-N 2.64Å; R193-C196 VanDerWaalsContact O-CB 3.31Å; R193-C196 WeakPolarHBondContact O-CB 3.35Å; R193-C196 PolarHBondContact O-N 3.39Å; R193-I204 HydrophobicContact CB-CD1 3.98Å; R193-I204 HydrophobicContact CG-CD1 4.16Å |
| 194 | Q | 90.8 | Very high | 84.4 | Confident | 45 Ų | 45 | 59.1 Ų | 59.1 | 21% | 0.21 | 34% | 0.341 | C | S | . | . | G | 310 helix | trans | -67.9 | -17.3 | 177.6 | -64.2 | 81 | -3.9 | 0 | 0 | 112.7 | N156 M159 P192 C196 | N156-Q194 HydrophobicContact CB-CG 3.92Å; N156-Q194 VanDerWaalsContact CG-NE2 3.31Å; N156-Q194 PolarHBondContact ND2-NE2 3.46Å; N156-Q194 PolarHBondContact OD1-NE2 2.98Å; N156-Q194 PolarHBondContact OD1-OE1 2.93Å; M159-Q194 CarbonylContact C-O 3.45Å; M159-Q194 HydrophobicContact CB-CB 3.77Å; M159-Q194 HydrophobicContact CE-CB 4.09Å; P192-Q194 PolarHBondContact O-N 2.79Å; P192-Q194 VanDerWaalsContact O-N 3.14Å; Q194-C196 VanDerWaalsContact C-N 3.26Å |
| 195 | C | 91.8 | Very high | 84.2 | Confident | 0 Ų | 0 | 60.2 Ų | 60.2 | 0% | 0 | 35% | 0.351 | C | S | . | . | G | 310 helix | trans | -75.4 | -15.2 | 170.8 | -65.8 | 0 | 0 | 0 | 0 | 113.2 | M159 C165 W191 P192 R193 L218 H219 | M159-C195 PolarHBondContact SD-SG 2.93Å; C165-C195 HydrophobicContact CB-CB 3.53Å; C165-C195 WeakPolarHBondContact CB-SG 3.19Å; C165-C195 WeakPolarHBondContact SG-CB 3.39Å; C165-C195 CovalentContact SG-SG 2.02Å; C165-C195 PolarHBondContact SG-SG 3.28Å; W191-C195 HydrophobicContact CG-CB 4.33Å; P192-C195 VanDerWaalsContact O-CB 3.28Å; P192-C195 WeakPolarHBondContact O-CB 3.46Å; P192-C195 PolarHBondContact O-N 3.04Å; R193-C195 PolarHBondContact O-N 2.64Å; C195-L218 HydrophobicContact CB-CD1 4.04Å; C195-H219 WeakPolarHBondContact O-CB 3.47Å; C195-H219 PolarHBondContact O-CD2 3.31Å; C195-H219 PolarHBondContact O-N 3.04Å |
| 196 | C | 91.4 | Very high | 84.3 | Confident | 5 Ų | 5 | 61.3 Ų | 61.3 | 3% | 0.034 | 35% | 0.351 | C | S | . | . | B | Isolated β-bridge | trans | -84.9 | 146.1 | 178.7 | -60.7 | 0 | 0 | 0 | 0 | 111.3 | R193 Q194 Q198 I204 C210 | R193-C196 VanDerWaalsContact O-CB 3.31Å; R193-C196 WeakPolarHBondContact O-CB 3.35Å; R193-C196 PolarHBondContact O-N 3.39Å; Q194-C196 VanDerWaalsContact C-N 3.26Å; C196-Q198 PolarHBondContact O-N 3.13Å; C196-I204 HydrophobicContact CB-CG1 4.43Å; C196-I204 HydrophobicContact CB-CG2 3.73Å; C196-C210 WeakPolarHBondContact CA-SG 2.95Å; C196-C210 HydrophobicContact CB-CB 3.75Å; C196-C210 WeakPolarHBondContact CB-SG 3.4Å; C196-C210 WeakPolarHBondContact SG-CB 2.99Å; C196-C210 CovalentContact SG-SG 2.03Å; C196-C210 PolarHBondContact SG-SG 3.01Å |
| 197 | Q | 89.3 | Confident | 84.7 | Confident | 71 Ų | 71 | 61 Ų | 61 | 33% | 0.332 | 35% | 0.349 | S | S | . | . | P | Polyproline II helix | trans | -62.5 | 123.9 | 174.2 | -172.8 | 176.7 | 7.9 | 0 | 0 | 111.2 | S205 P216 F217 | Q197-S205 PolarHBondContact O-N 3.23Å; Q197-S205 VanDerWaalsContact O-N 3.1Å; Q197-P216 PolarHBondContact OE1-O 3.4Å; Q197-F217 PolarHBondContact N-O 2.77Å |
| 198 | Q | 87.6 | Confident | 85.3 | Confident | 70 Ų | 70 | 62.4 Ų | 62.4 | 33% | 0.327 | 34% | 0.342 | S | S | . | . | B | Isolated β-bridge | trans | -95.9 | 148.8 | 175 | -64.7 | 177.3 | -10.6 | 0 | 0 | 111.3 | C196 A203 | C196-Q198 PolarHBondContact O-N 3.13Å; Q198-A203 CarbonylContact C-O 3.49Å; Q198-A203 VanDerWaalsContact CA-O 3.28Å; Q198-A203 WeakPolarHBondContact CA-O 3.24Å |
| 199 | D | 81.9 | Confident | 85.7 | Confident | 62 Ų | 62 | 59.1 Ų | 59.1 | 33% | 0.332 | 33% | 0.327 | S | S | . | . | trans | -79.1 | 178 | 171.5 | 70.2 | 16.1 | 0 | 0 | 0 | 111.8 | M201 G202 A203 | D199-M201 PolarHBondContact O-N 3.29Å; D199-M201 VanDerWaalsContact O-N 3.13Å; D199-M201 VanDerWaalsContact OD1-C 3.27Å; D199-M201 VanDerWaalsContact OD1-CA 3.29Å; D199-M201 WeakPolarHBondContact OD1-CA 3.03Å; D199-M201 WeakPolarHBondContact OD1-CB 3.34Å; D199-M201 PolarHBondContact OD1-N 3.21Å; D199-G202 PolarHBondContact O-N 3.1Å; D199-G202 PolarHBondContact OD1-N 3.07Å; D199-A203 VanDerWaalsContact CG-O 3.31Å; D199-A203 PolarHBondContact N-O 3.08Å; D199-A203 PolarHBondContact OD1-N 3.1Å | ||
| 200 | A | 78.8 | Confident | 85.9 | Confident | 110 Ų | 110 | 57.8 Ų | 57.8 | 91% | 0.909 | 32% | 0.32 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.8 | -15.9 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||
| 201 | M | 80 | Confident | 85.9 | Confident | 167 Ų | 167 | 59.3 Ų | 59.3 | 82% | 0.823 | 33% | 0.325 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.8 | 0.1 | 176 | -61.5 | 92 | 173 | 0 | 0 | 112.6 | D199 A203 | D199-M201 PolarHBondContact O-N 3.29Å; D199-M201 VanDerWaalsContact O-N 3.13Å; D199-M201 VanDerWaalsContact OD1-C 3.27Å; D199-M201 VanDerWaalsContact OD1-CA 3.29Å; D199-M201 WeakPolarHBondContact OD1-CA 3.03Å; D199-M201 WeakPolarHBondContact OD1-CB 3.34Å; D199-M201 PolarHBondContact OD1-N 3.21Å; M201-A203 VanDerWaalsContact C-N 3.32Å |
| 202 | G | 76.1 | Confident | 85.8 | Confident | 42 Ų | 42 | 64.2 Ų | 64.2 | 43% | 0.433 | 35% | 0.352 | S | S | . | . | S | Bend | trans | 81.5 | 5.4 | -178.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | D199 | D199-G202 PolarHBondContact O-N 3.1Å; D199-G202 PolarHBondContact OD1-N 3.07Å |
| 203 | A | 83.5 | Confident | 85.5 | Confident | 52 Ų | 52 | 65.6 Ų | 65.6 | 43% | 0.43 | 37% | 0.367 | S | S | . | . | S | Bend | trans | -83.6 | 148.9 | 174.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | Q198 D199 M201 S205 | Q198-A203 CarbonylContact C-O 3.49Å; Q198-A203 VanDerWaalsContact CA-O 3.28Å; Q198-A203 WeakPolarHBondContact CA-O 3.24Å; D199-A203 VanDerWaalsContact CG-O 3.31Å; D199-A203 PolarHBondContact N-O 3.08Å; D199-A203 PolarHBondContact OD1-N 3.1Å; M201-A203 VanDerWaalsContact C-N 3.32Å; A203-S205 PolarHBondContact O-N 2.95Å |
| 204 | I | 82.9 | Confident | 85.4 | Confident | 46 Ų | 46 | 61.8 Ų | 61.8 | 24% | 0.236 | 36% | 0.359 | C | S | . | . | B | Isolated β-bridge | trans | -70.1 | 119.1 | 178.2 | -58.9 | 168.2 | 0 | 0 | 0 | 108.2 | R193 C196 L207 | R193-I204 HydrophobicContact CB-CD1 3.98Å; R193-I204 HydrophobicContact CG-CD1 4.16Å; C196-I204 HydrophobicContact CB-CG1 4.43Å; C196-I204 HydrophobicContact CB-CG2 3.73Å; I204-L207 HydrophobicContact CD1-CD1 3.94Å; I204-L207 HydrophobicContact CG2-CB 4.26Å; I204-L207 HydrophobicContact CG2-CD1 4.28Å |
| 205 | S | 79.4 | Confident | 85 | Confident | 57 Ų | 57 | 64.3 Ų | 64.3 | 40% | 0.399 | 38% | 0.382 | S | S | . | . | S | Bend | trans | -62.8 | -50.9 | -172 | 178.4 | 0 | 0 | 0 | 0 | 112.4 | Q197 A203 | Q197-S205 PolarHBondContact O-N 3.23Å; Q197-S205 VanDerWaalsContact O-N 3.1Å; A203-S205 PolarHBondContact O-N 2.95Å |
| 206 | H | 84.9 | Confident | 84.6 | Confident | 99 Ų | 99 | 68.1 Ų | 68.1 | 46% | 0.458 | 41% | 0.407 | S | S | . | . | trans | -135.8 | 89.6 | 178.2 | -71.4 | -88 | 0 | 0 | 0 | 110.8 | E208 A209 C210 F217 | H206-E208 PolarHBondContact O-N 3.35Å; H206-A209 HydrophobicContact CB-CB 3.87Å; H206-A209 PolarHBondContact O-N 2.87Å; H206-C210 WeakPolarHBondContact O-CB 3.23Å; H206-C210 PolarHBondContact O-N 3.13Å; H206-F217 HydrophobicContact CB-CD1 3.76Å; H206-F217 HydrophobicContact CB-CE1 3.97Å; H206-F217 HydrophobicContact CB-CG 4.07Å; H206-F217 HydrophobicContact CB-CZ 4.41Å; H206-F217 AromaticContact CD2-CD1 3.73Å; H206-F217 AromaticContact CD2-CE1 3.14Å; H206-F217 WeakPolarHBondContact CD2-CE1 3.41Å; H206-F217 AromaticContact CD2-CZ 3.72Å; H206-F217 AromaticContact CG-CE1 3.72Å; H206-F217 AromaticContact NE2-CE1 3.97Å | ||
| 207 | L | 85.8 | Confident | 84.5 | Confident | 64 Ų | 64 | 70.2 Ų | 70.2 | 34% | 0.335 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -59.9 | -47.5 | -175.6 | -179 | 63.2 | 0 | 0 | 0 | 112.8 | I204 C210 K211 | I204-L207 HydrophobicContact CD1-CD1 3.94Å; I204-L207 HydrophobicContact CG2-CB 4.26Å; I204-L207 HydrophobicContact CG2-CD1 4.28Å; L207-C210 WeakPolarHBondContact O-CB 3.46Å; L207-C210 PolarHBondContact O-N 3.1Å; L207-K211 WeakPolarHBondContact O-CG 3.3Å; L207-K211 PolarHBondContact O-N 3.4Å |
| 208 | E | 85.7 | Confident | 84.6 | Confident | 113 Ų | 113 | 67.6 Ų | 67.6 | 53% | 0.528 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -68.2 | -39.2 | -178 | -63.9 | -55 | 131.8 | 0 | 0 | 112.4 | H206 C210 K211 I212 | H206-E208 PolarHBondContact O-N 3.35Å; E208-C210 VanDerWaalsContact C-N 3.3Å; E208-C210 PolarHBondContact O-N 3.34Å; E208-K211 PolarHBondContact O-N 3.44Å; E208-K211 IonicContact OE1-NZ 2.8Å; E208-K211 PolarHBondContact OE1-NZ 2.89Å; E208-K211 IonicContact OE2-NZ 3.8Å; E208-I212 WeakPolarHBondContact O-CD1 3.44Å; E208-I212 WeakPolarHBondContact O-CG1 3.43Å; E208-I212 PolarHBondContact O-N 3.48Å |
| 209 | A | 85.9 | Confident | 84.8 | Confident | 23 Ų | 23 | 65.3 Ų | 65.3 | 19% | 0.19 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -66.7 | -35.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | H206 G213 V214 F217 | H206-A209 HydrophobicContact CB-CB 3.87Å; H206-A209 PolarHBondContact O-N 2.87Å; A209-G213 PolarHBondContact O-N 3.45Å; A209-V214 HydrophobicContact CB-CB 4.43Å; A209-V214 PolarHBondContact O-N 2.86Å; A209-F217 HydrophobicContact CB-CB 4.28Å; A209-F217 HydrophobicContact CB-CD2 3.45Å; A209-F217 VanDerWaalsContact CB-CD2 3.45Å; A209-F217 HydrophobicContact CB-CE2 3.96Å; A209-F217 HydrophobicContact CB-CG 3.96Å |
| 210 | C | 89.1 | Confident | 85.1 | Confident | 0 Ų | 0 | 65.8 Ų | 65.8 | 0% | 0 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -63.3 | -50.5 | 171.2 | -176.9 | 0 | 0 | 0 | 0 | 110.9 | W191 C196 H206 L207 E208 I212 G213 F217 | W191-C210 WeakPolarHBondContact CZ2-O 3.02Å; C196-C210 WeakPolarHBondContact CA-SG 2.95Å; C196-C210 HydrophobicContact CB-CB 3.75Å; C196-C210 WeakPolarHBondContact CB-SG 3.4Å; C196-C210 WeakPolarHBondContact SG-CB 2.99Å; C196-C210 CovalentContact SG-SG 2.03Å; C196-C210 PolarHBondContact SG-SG 3.01Å; H206-C210 WeakPolarHBondContact O-CB 3.23Å; H206-C210 PolarHBondContact O-N 3.13Å; L207-C210 WeakPolarHBondContact O-CB 3.46Å; L207-C210 PolarHBondContact O-N 3.1Å; E208-C210 VanDerWaalsContact C-N 3.3Å; E208-C210 PolarHBondContact O-N 3.34Å; C210-I212 PolarHBondContact O-N 3.49Å; C210-I212 VanDerWaalsContact O-N 3.16Å; C210-G213 WeakPolarHBondContact O-CA 3.45Å; C210-G213 PolarHBondContact O-N 3.45Å; C210-F217 HydrophobicContact CB-CB 4.49Å |
| 211 | K | 87.5 | Confident | 85.8 | Confident | 45 Ų | 45 | 66.2 Ų | 66.2 | 20% | 0.196 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -55.1 | -36.1 | -179.1 | -71.8 | 175.4 | -174.9 | 173.6 | 0 | 113.7 | D188 P190 L207 E208 G213 | D188-K211 WeakPolarHBondContact O-CE 3.45Å; P190-K211 WeakPolarHBondContact CG-O 3.24Å; L207-K211 WeakPolarHBondContact O-CG 3.3Å; L207-K211 PolarHBondContact O-N 3.4Å; E208-K211 PolarHBondContact O-N 3.44Å; E208-K211 IonicContact OE1-NZ 2.8Å; E208-K211 PolarHBondContact OE1-NZ 2.89Å; E208-K211 IonicContact OE2-NZ 3.8Å; K211-G213 VanDerWaalsContact C-N 3.26Å; K211-G213 PolarHBondContact O-N 2.94Å |
| 212 | I | 87.6 | Confident | 86.4 | Confident | 132 Ų | 132 | 59 Ų | 59 | 68% | 0.677 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -78 | -15.1 | 178.9 | -59.6 | 164.3 | 0 | 0 | 0 | 111.6 | E208 C210 V214 | E208-I212 WeakPolarHBondContact O-CD1 3.44Å; E208-I212 WeakPolarHBondContact O-CG1 3.43Å; E208-I212 PolarHBondContact O-N 3.48Å; C210-I212 PolarHBondContact O-N 3.49Å; C210-I212 VanDerWaalsContact O-N 3.16Å; I212-V214 HydrophobicContact CB-CG2 4.21Å; I212-V214 HydrophobicContact CG2-CG2 4.04Å |
| 213 | G | 85.6 | Confident | 87.2 | Confident | 30 Ų | 30 | 57 Ų | 57 | 31% | 0.309 | 34% | 0.336 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 82.4 | 30.2 | -179.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | A209 C210 K211 S215 | A209-G213 PolarHBondContact O-N 3.45Å; C210-G213 WeakPolarHBondContact O-CA 3.45Å; C210-G213 PolarHBondContact O-N 3.45Å; K211-G213 VanDerWaalsContact C-N 3.26Å; K211-G213 PolarHBondContact O-N 2.94Å; G213-S215 PolarHBondContact O-N 3.45Å |
| 214 | V | 87.4 | Confident | 87.6 | Confident | 64 Ų | 64 | 56.7 Ų | 56.7 | 39% | 0.388 | 32% | 0.324 | S | S | . | . | trans | -77.3 | 123.8 | 179.7 | -178.1 | 0 | 0 | 0 | 0 | 110.4 | A209 I212 F217 L218 | A209-V214 HydrophobicContact CB-CB 4.43Å; A209-V214 PolarHBondContact O-N 2.86Å; I212-V214 HydrophobicContact CB-CG2 4.21Å; I212-V214 HydrophobicContact CG2-CG2 4.04Å; V214-F217 HydrophobicContact CB-CD2 4.44Å; V214-F217 HydrophobicContact CG1-CD2 4.36Å; V214-F217 WeakPolarHBondContact O-CB 3.38Å; V214-F217 PolarHBondContact O-N 3.42Å; V214-L218 PolarHBondContact O-N 3.02Å | ||
| 215 | S | 82.3 | Confident | 87.8 | Confident | 99 Ų | 99 | 60.2 Ų | 60.2 | 69% | 0.692 | 34% | 0.344 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.4 | 134.7 | 169.2 | -177.2 | 0 | 0 | 0 | 0 | 110.3 | G213 | G213-S215 PolarHBondContact O-N 3.45Š|
| 216 | P | 84.5 | Confident | 88.2 | Confident | 79 Ų | 79 | 62 Ų | 62 | 51% | 0.513 | 34% | 0.343 | S | S | . | . | T | Hydrogen-bonded Turn | cis | -97.7 | 7.9 | 12.8 | 38.1 | -36.3 | 0 | 0 | 0 | 115.4 | Q197 L218 | Q197-P216 PolarHBondContact OE1-O 3.4Å; P216-L218 VanDerWaalsContact C-N 3.28Å; P216-L218 PolarHBondContact O-N 2.79Å |
| 217 | F | 89 | Confident | 88.3 | Confident | 50 Ų | 50 | 57.4 Ų | 57.4 | 22% | 0.219 | 32% | 0.321 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -74.6 | -16.8 | -171.1 | -53.9 | -67.9 | 0 | 0 | 0 | 114.1 | Q197 H206 A209 C210 V214 | Q197-F217 PolarHBondContact N-O 2.77Å; H206-F217 HydrophobicContact CB-CD1 3.76Å; H206-F217 HydrophobicContact CB-CE1 3.97Å; H206-F217 HydrophobicContact CB-CG 4.07Å; H206-F217 HydrophobicContact CB-CZ 4.41Å; H206-F217 AromaticContact CD2-CD1 3.73Å; H206-F217 AromaticContact CD2-CE1 3.14Å; H206-F217 WeakPolarHBondContact CD2-CE1 3.41Å; H206-F217 AromaticContact CD2-CZ 3.72Å; H206-F217 AromaticContact CG-CE1 3.72Å; H206-F217 AromaticContact NE2-CE1 3.97Å; A209-F217 HydrophobicContact CB-CB 4.28Å; A209-F217 HydrophobicContact CB-CD2 3.45Å; A209-F217 VanDerWaalsContact CB-CD2 3.45Å; A209-F217 HydrophobicContact CB-CE2 3.96Å; A209-F217 HydrophobicContact CB-CG 3.96Å; C210-F217 HydrophobicContact CB-CB 4.49Å; V214-F217 HydrophobicContact CB-CD2 4.44Å; V214-F217 HydrophobicContact CG1-CD2 4.36Å; V214-F217 WeakPolarHBondContact O-CB 3.38Å; V214-F217 PolarHBondContact O-N 3.42Å |
| 218 | L | 91.5 | Very high | 88.1 | Confident | 15 Ų | 15 | 54.4 Ų | 54.4 | 8% | 0.079 | 31% | 0.305 | C | S | . | . | B | Isolated β-bridge | trans | -108.8 | 133.4 | 171.6 | 177.3 | 64.5 | 0 | 0 | 0 | 110.6 | P170 W191 C195 V214 P216 A220 | P170-L218 HydrophobicContact CB-CD1 4.16Å; P170-L218 HydrophobicContact CB-CD2 3.88Å; P170-L218 HydrophobicContact CB-CG 4.34Å; P170-L218 HydrophobicContact CG-CD2 3.66Å; P170-L218 HydrophobicContact CG-CG 4.2Å; W191-L218 HydrophobicContact CD2-CD1 4.22Å; W191-L218 VanDerWaalsContact CE2-CD1 3.49Å; W191-L218 HydrophobicContact CG-CD1 4.45Å; W191-L218 HydrophobicContact CH2-CD2 3.74Å; W191-L218 HydrophobicContact CZ2-CD1 3.77Å; W191-L218 HydrophobicContact CZ2-CD2 3.43Å; W191-L218 VanDerWaalsContact CZ2-CD2 3.43Å; W191-L218 HydrophobicContact CZ2-CG 4.16Å; W191-L218 HydrophobicContact CZ3-CD2 4.47Å; W191-L218 VanDerWaalsContact NE1-CD1 3.32Å; C195-L218 HydrophobicContact CB-CD1 4.04Å; V214-L218 PolarHBondContact O-N 3.02Å; P216-L218 VanDerWaalsContact C-N 3.28Å; P216-L218 PolarHBondContact O-N 2.79Å; L218-A220 PolarHBondContact O-N 2.92Å; L218-A220 VanDerWaalsContact O-N 3.12Å |
| 219 | H | 91.2 | Very high | 88 | Confident | 23 Ų | 23 | 50.3 Ų | 50.3 | 11% | 0.106 | 29% | 0.294 | C | S | . | . | trans | -71.8 | 101.3 | 168.3 | -63 | -39.2 | 0 | 0 | 0 | 110.6 | K163 C165 C195 | K163-H219 WeakPolarHBondContact O-CB 3.36Å; K163-H219 VanDerWaalsContact O-CG 3.3Å; K163-H219 PolarHBondContact O-ND1 3.35Å; C165-H219 HydrophobicContact CB-CB 4.38Å; C165-H219 WeakPolarHBondContact CB-O 3.48Å; C195-H219 WeakPolarHBondContact O-CB 3.47Å; C195-H219 PolarHBondContact O-CD2 3.31Å; C195-H219 PolarHBondContact O-N 3.04Å | ||
| 220 | A | 88.6 | Confident | 87.6 | Confident | 71 Ų | 71 | 51.8 Ų | 51.8 | 59% | 0.587 | 30% | 0.301 | S | S | * | . | trans | -82.1 | -14.2 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | L218 | L218-A220 PolarHBondContact O-N 2.92Å; L218-A220 VanDerWaalsContact O-N 3.12Å | ||
| 221 | Q | 92.5 | Very high | 87 | Confident | 119 Ų | 119 | 52.2 Ų | 52.2 | 56% | 0.556 | 30% | 0.304 | S | S | * | . | S | Bend | trans | -81.5 | 139.6 | -179.8 | -67 | -177.2 | -13.1 | 0 | 0 | 111.1 | C164 C165 Y226 | C164-Q221 CarbonylContact C-O 3.02Å; C164-Q221 VanDerWaalsContact CA-O 3.24Å; C164-Q221 WeakPolarHBondContact CA-O 3.12Å; C164-Q221 WeakPolarHBondContact CB-O 3.44Å; C165-Q221 PolarHBondContact N-O 3.32Å; Q221-Y226 PolarHBondContact OE1-OH 3.22Å |
| 222 | G | 93.3 | Very high | 86.6 | Confident | 16 Ų | 16 | 53.3 Ų | 53.3 | 17% | 0.165 | 31% | 0.311 | C | S | . | . | trans | -69.4 | 146.5 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | V167 Y168 Y224 | V167-G222 CarbonylContact O-C 3.49Å; V167-G222 VanDerWaalsContact O-CA 3.22Å; V167-G222 WeakPolarHBondContact O-CA 3.31Å; Y168-G222 WeakPolarHBondContact O-CA 3.26Å; Y168-G222 PolarHBondContact O-N 3.25Å; G222-Y224 VanDerWaalsContact C-N 3.33Å | ||
| 223 | C | 92.9 | Very high | 86.2 | Confident | 0 Ų | 0 | 51.6 Ų | 51.6 | 0% | 0 | 31% | 0.307 | C | S | . | . | S | Bend | trans | -81 | -10.3 | 178.6 | -64.2 | 0 | 0 | 0 | 0 | 114 | W155 C164 G166 V167 D225 Y226 I227 | W155-C223 HydrophobicContact CZ3-CB 3.85Å; C164-C223 HydrophobicContact CB-CB 3.91Å; C164-C223 WeakPolarHBondContact CB-SG 3.22Å; C164-C223 WeakPolarHBondContact SG-CA 3.34Å; C164-C223 WeakPolarHBondContact SG-CB 3.45Å; C164-C223 CovalentContact SG-SG 2.03Å; C164-C223 PolarHBondContact SG-SG 3.38Å; G166-C223 WeakPolarHBondContact O-CB 3.4Å; G166-C223 PolarHBondContact O-N 2.82Å; V167-C223 PolarHBondContact O-N 3.36Å; C223-D225 PolarHBondContact O-N 3.32Å; C223-Y226 PolarHBondContact O-N 2.9Å; C223-Y226 VanDerWaalsContact O-N 3.14Å; C223-I227 HydrophobicContact CB-CD1 3.96Å; C223-I227 WeakPolarHBondContact O-CG1 3.41Å; C223-I227 PolarHBondContact O-N 2.02Å |
| 224 | Y | 91 | Very high | 85.7 | Confident | 45 Ų | 45 | 54.8 Ų | 54.8 | 18% | 0.176 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -55.6 | -47.3 | -174.1 | 170.7 | -101.3 | 0 | 0 | 0 | 112.9 | F117 P119 F122 V167 G222 Y226 I227 A228 | F117-Y224 VanDerWaalsContact O-CE2 3.23Å; F117-Y224 WeakPolarHBondContact O-CE2 3.5Å; F117-Y224 PolarHBondContact O-OH 2.03Å; P119-Y224 HydrophobicContact CB-CD1 4.31Å; P119-Y224 HydrophobicContact CB-CD2 3.63Å; P119-Y224 HydrophobicContact CB-CE1 4.44Å; P119-Y224 HydrophobicContact CB-CE2 3.77Å; P119-Y224 HydrophobicContact CB-CG 3.91Å; P119-Y224 HydrophobicContact CG-CE2 4.28Å; F122-Y224 HydrophobicContact CD2-CD2 4.13Å; F122-Y224 HydrophobicContact CD2-CE2 4.1Å; F122-Y224 HydrophobicContact CE2-CE2 4.32Å; V167-Y224 VanDerWaalsContact O-CB 3.25Å; V167-Y224 WeakPolarHBondContact O-CB 3.19Å; V167-Y224 PolarHBondContact O-N 2.83Å; G222-Y224 VanDerWaalsContact C-N 3.33Å; Y224-Y226 VanDerWaalsContact C-N 3.26Å; Y224-Y226 PolarHBondContact O-N 3.38Å; Y224-I227 PolarHBondContact O-N 3.42Å; Y224-I227 VanDerWaalsContact O-N 3.16Å; Y224-A228 HydrophobicContact CD2-CB 3.94Å; Y224-A228 HydrophobicContact CE1-CB 4.25Å; Y224-A228 HydrophobicContact CE2-CB 3.46Å; Y224-A228 VanDerWaalsContact CE2-CB 3.46Å; Y224-A228 WeakPolarHBondContact O-CB 3.5Å; Y224-A228 PolarHBondContact O-N 3.45Å |
| 225 | D | 88.2 | Confident | 85.2 | Confident | 120 Ų | 120 | 52.7 Ų | 52.7 | 64% | 0.642 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -64.7 | -32.2 | -178.1 | -67.8 | -31.4 | 0 | 0 | 0 | 112.3 | C223 G229 | C223-D225 PolarHBondContact O-N 3.32Å; D225-G229 VanDerWaalsContact O-CA 3.27Å; D225-G229 WeakPolarHBondContact O-CA 3.11Å; D225-G229 PolarHBondContact O-N 2.93Å |
| 226 | Y | 88.4 | Confident | 84.9 | Confident | 96 Ų | 96 | 53.2 Ų | 53.2 | 38% | 0.376 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -73.6 | -32.1 | 176.6 | -64.1 | -76.9 | 0 | 0 | 0 | 112.9 | C164 Q221 C223 Y224 P230 | C164-Y226 HydrophobicContact CB-CD2 4.07Å; C164-Y226 HydrophobicContact CB-CE2 4.17Å; Q221-Y226 PolarHBondContact OE1-OH 3.22Å; C223-Y226 PolarHBondContact O-N 2.9Å; C223-Y226 VanDerWaalsContact O-N 3.14Å; Y224-Y226 VanDerWaalsContact C-N 3.26Å; Y224-Y226 PolarHBondContact O-N 3.38Å; Y226-P230 VanDerWaalsContact O-CD 3.26Å; Y226-P230 WeakPolarHBondContact O-CD 3.45Å |
| 227 | I | 85.7 | Confident | 84.7 | Confident | 1 Ų | 1 | 51.2 Ų | 51.2 | 1% | 0.005 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -81.7 | -57.6 | 178.5 | -65.9 | 169 | 0 | 0 | 0 | 109.7 | L44 L47 F122 W155 F158 C223 Y224 L231 | L44-I227 HydrophobicContact CD2-CB 4.33Å; L44-I227 HydrophobicContact CD2-CG2 3.7Å; L47-I227 HydrophobicContact CD1-CD1 4.33Å; L47-I227 HydrophobicContact CD1-CG2 4.19Å; F122-I227 HydrophobicContact CD1-CG2 4.49Å; F122-I227 HydrophobicContact CE1-CG2 4.04Å; F122-I227 HydrophobicContact CZ-CG2 4.3Å; W155-I227 HydrophobicContact CE3-CD1 4.36Å; W155-I227 HydrophobicContact CH2-CD1 3.72Å; W155-I227 HydrophobicContact CZ2-CD1 4.2Å; W155-I227 HydrophobicContact CZ3-CD1 3.85Å; F158-I227 HydrophobicContact CB-CD1 4.47Å; F158-I227 HydrophobicContact CB-CG1 4.45Å; F158-I227 HydrophobicContact CD1-CG1 3.93Å; F158-I227 HydrophobicContact CD2-CD1 4.1Å; F158-I227 HydrophobicContact CD2-CG1 3.83Å; F158-I227 HydrophobicContact CE1-CG1 4.17Å; F158-I227 HydrophobicContact CE2-CG1 4.09Å; F158-I227 HydrophobicContact CG-CD1 4.2Å; F158-I227 HydrophobicContact CG-CG1 3.79Å; F158-I227 HydrophobicContact CZ-CG1 4.28Å; C223-I227 HydrophobicContact CB-CD1 3.96Å; C223-I227 WeakPolarHBondContact O-CG1 3.41Å; C223-I227 PolarHBondContact O-N 2.02Å; Y224-I227 PolarHBondContact O-N 3.42Å; Y224-I227 VanDerWaalsContact O-N 3.16Å; I227-L231 WeakPolarHBondContact O-CD1 3.47Å |
| 228 | A | 82.8 | Confident | 84.2 | Confident | 1 Ų | 1 | 50.5 Ų | 50.5 | 1% | 0.008 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -77.5 | -31.6 | -172.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | F117 Y224 L231 I232 | F117-A228 HydrophobicContact CB-CB 4.47Å; Y224-A228 HydrophobicContact CD2-CB 3.94Å; Y224-A228 HydrophobicContact CE1-CB 4.25Å; Y224-A228 HydrophobicContact CE2-CB 3.46Å; Y224-A228 VanDerWaalsContact CE2-CB 3.46Å; Y224-A228 WeakPolarHBondContact O-CB 3.5Å; Y224-A228 PolarHBondContact O-N 3.45Å; A228-L231 PolarHBondContact O-N 3.39Å; A228-I232 HydrophobicContact CB-CD1 4.08Å; A228-I232 WeakPolarHBondContact O-CB 3.5Å; A228-I232 VanDerWaalsContact O-CG1 3.25Å; A228-I232 WeakPolarHBondContact O-CG1 3.28Å; A228-I232 PolarHBondContact O-N 3.26Å |
| 229 | G | 82.2 | Confident | 83.8 | Confident | 27 Ų | 27 | 50.4 Ų | 50.4 | 28% | 0.278 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -54.9 | -54.1 | -177.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | D225 L231 T233 | D225-G229 VanDerWaalsContact O-CA 3.27Å; D225-G229 WeakPolarHBondContact O-CA 3.11Å; D225-G229 PolarHBondContact O-N 2.93Å; G229-L231 PolarHBondContact O-N 3.33Å; G229-T233 WeakPolarHBondContact O-CB 3.35Å; G229-T233 PolarHBondContact O-N 2.93Å; G229-T233 PolarHBondContact O-OG1 2.91Å |
| 230 | P | 79.1 | Confident | 83.6 | Confident | 54 Ų | 54 | 57.1 Ų | 57.1 | 35% | 0.351 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -60.8 | -43.9 | 175.3 | -24.9 | 35 | 0 | 0 | 0 | 112.7 | Y226 I232 T233 H234 | Y226-P230 VanDerWaalsContact O-CD 3.26Å; Y226-P230 WeakPolarHBondContact O-CD 3.45Å; P230-I232 PolarHBondContact O-N 3.32Å; P230-T233 PolarHBondContact O-N 3.36Å; P230-H234 WeakPolarHBondContact O-CB 3.4Å; P230-H234 PolarHBondContact O-CD2 2.93Å; P230-H234 PolarHBondContact O-N 3.48Å |
| 231 | L | 76.9 | Confident | 83.5 | Confident | 10 Ų | 10 | 56.5 Ų | 56.5 | 5% | 0.052 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -59.2 | -47.4 | 179.5 | -84.3 | 159.4 | 0 | 0 | 0 | 112.2 | F37 L44 V48 F117 I227 A228 G229 G235 | F37-L231 HydrophobicContact CE1-CD2 4.02Å; F37-L231 HydrophobicContact CZ-CD2 3.83Å; L44-L231 HydrophobicContact CB-CD1 4.34Å; L44-L231 HydrophobicContact CD1-CG 4.44Å; L44-L231 HydrophobicContact CD2-CD1 3.95Å; V48-L231 HydrophobicContact CG2-CD1 3.92Å; V48-L231 HydrophobicContact CG2-CD2 4.41Å; F117-L231 HydrophobicContact CD1-CB 4.23Å; F117-L231 HydrophobicContact CD1-CD1 4.27Å; F117-L231 HydrophobicContact CE1-CB 3.83Å; F117-L231 HydrophobicContact CE1-CD1 3.92Å; F117-L231 HydrophobicContact CE1-CD2 4.02Å; F117-L231 HydrophobicContact CE1-CG 4.15Å; F117-L231 HydrophobicContact CZ-CB 4.14Å; F117-L231 HydrophobicContact CZ-CD2 4.3Å; I227-L231 WeakPolarHBondContact O-CD1 3.47Å; A228-L231 PolarHBondContact O-N 3.39Å; G229-L231 PolarHBondContact O-N 3.33Å; L231-G235 PolarHBondContact O-N 3.3Å |
| 232 | I | 77.7 | Confident | 83.4 | Confident | 68 Ų | 68 | 50.9 Ų | 50.9 | 35% | 0.349 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -64.5 | -44.6 | 178.6 | -68 | 166.3 | 0 | 0 | 0 | 110.2 | F117 A228 P230 G235 F236 | F117-I232 HydrophobicContact CB-CD1 4.18Å; F117-I232 HydrophobicContact CB-CG1 4.12Å; F117-I232 HydrophobicContact CD2-CG1 3.95Å; F117-I232 HydrophobicContact CG-CG1 4.13Å; A228-I232 HydrophobicContact CB-CD1 4.08Å; A228-I232 WeakPolarHBondContact O-CB 3.5Å; A228-I232 VanDerWaalsContact O-CG1 3.25Å; A228-I232 WeakPolarHBondContact O-CG1 3.28Å; A228-I232 PolarHBondContact O-N 3.26Å; P230-I232 PolarHBondContact O-N 3.32Å; I232-G235 PolarHBondContact O-N 2.74Å; I232-F236 WeakPolarHBondContact O-CB 3.32Å; I232-F236 PolarHBondContact O-N 2.97Å |
| 233 | T | 78.9 | Confident | 83.2 | Confident | 96 Ų | 96 | 55.2 Ų | 55.2 | 59% | 0.589 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -64.8 | -47.4 | -178.9 | -55.9 | 0 | 0 | 0 | 0 | 111.4 | G229 P230 F236 G237 | G229-T233 WeakPolarHBondContact O-CB 3.35Å; G229-T233 PolarHBondContact O-N 2.93Å; G229-T233 PolarHBondContact O-OG1 2.91Å; P230-T233 PolarHBondContact O-N 3.36Å; T233-F236 PolarHBondContact O-N 3.25Å; T233-G237 PolarHBondContact O-N 3.25Å |
| 234 | H | 76.3 | Confident | 83.2 | Confident | 97 Ų | 97 | 57.5 Ų | 57.5 | 45% | 0.449 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -67.2 | -42.1 | 177.5 | -70.3 | -56.8 | 0 | 0 | 0 | 112 | F37 P230 F236 G237 V238 | F37-H234 HydrophobicContact CE2-CB 4.14Å; P230-H234 WeakPolarHBondContact O-CB 3.4Å; P230-H234 PolarHBondContact O-CD2 2.93Å; P230-H234 PolarHBondContact O-N 3.48Å; H234-F236 VanDerWaalsContact C-N 3.32Å; H234-F236 PolarHBondContact O-N 3.32Å; H234-G237 PolarHBondContact O-N 3.41Å; H234-V238 WeakPolarHBondContact O-CG2 3.32Å; H234-V238 PolarHBondContact O-N 3.1Å |
| 235 | G | 75.8 | Confident | 83.3 | Confident | 20 Ų | 20 | 55.6 Ų | 55.6 | 21% | 0.206 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -61.3 | -39.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | L231 I232 S239 | L231-G235 PolarHBondContact O-N 3.3Å; I232-G235 PolarHBondContact O-N 2.74Å; G235-S239 WeakPolarHBondContact O-CB 3.44Å; G235-S239 PolarHBondContact O-N 2.92Å; G235-S239 PolarHBondContact O-OG 3.5Å |
| 236 | F | 77 | Confident | 83.6 | Confident | 110 Ų | 110 | 50.6 Ų | 50.6 | 48% | 0.482 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -65.7 | -43.3 | 173.1 | -168.5 | -107.3 | 0 | 0 | 0 | 112.2 | K114 I232 T233 H234 S239 W240 | K114-F236 VanDerWaalsContact NZ-CE2 3.31Å; I232-F236 WeakPolarHBondContact O-CB 3.32Å; I232-F236 PolarHBondContact O-N 2.97Å; T233-F236 PolarHBondContact O-N 3.25Å; H234-F236 VanDerWaalsContact C-N 3.32Å; H234-F236 PolarHBondContact O-N 3.32Å; F236-S239 PolarHBondContact O-N 3.43Å; F236-W240 PolarHBondContact O-N 3.35Å |
| 237 | G | 79.1 | Confident | 84 | Confident | 37 Ų | 37 | 48.4 Ų | 48.4 | 38% | 0.381 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -58 | -47.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | T233 H234 S239 W240 F241 | T233-G237 PolarHBondContact O-N 3.25Å; H234-G237 PolarHBondContact O-N 3.41Å; G237-S239 PolarHBondContact O-N 2.93Å; G237-W240 PolarHBondContact O-N 3.37Å; G237-F241 VanDerWaalsContact O-CB 3.25Å; G237-F241 WeakPolarHBondContact O-CB 3.39Å; G237-F241 PolarHBondContact O-N 3.02Å |
| 238 | V | 80.1 | Confident | 84.5 | Confident | 35 Ų | 35 | 53.7 Ų | 53.7 | 21% | 0.212 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -62.3 | -43.1 | 177 | 173.1 | 0 | 0 | 0 | 0 | 111.2 | M33 H234 F241 G242 | M33-V238 HydrophobicContact CB-CG2 4.5Å; M33-V238 HydrophobicContact CE-CG2 4.49Å; M33-V238 HydrophobicContact SD-CG2 4.15Å; H234-V238 WeakPolarHBondContact O-CG2 3.32Å; H234-V238 PolarHBondContact O-N 3.1Å; V238-F241 PolarHBondContact O-N 2.84Å; V238-G242 PolarHBondContact O-N 3.11Å |
| 239 | S | 82.5 | Confident | 85.1 | Confident | 13 Ų | 13 | 53.8 Ų | 53.8 | 9% | 0.091 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -62.6 | -45.9 | 179.3 | -58.3 | 0 | 0 | 0 | 0 | 112.2 | A110 A111 G235 F236 G237 F241 G242 F243 | A110-S239 WeakPolarHBondContact CB-OG 3.32Å; A111-S239 PolarHBondContact N-OG 3.38Å; G235-S239 WeakPolarHBondContact O-CB 3.44Å; G235-S239 PolarHBondContact O-N 2.92Å; G235-S239 PolarHBondContact O-OG 3.5Å; F236-S239 PolarHBondContact O-N 3.43Å; G237-S239 PolarHBondContact O-N 2.93Å; S239-F241 VanDerWaalsContact C-N 3.35Å; S239-G242 PolarHBondContact O-N 3.09Å; S239-F243 PolarHBondContact O-N 2.92Å |
| 240 | W | 85.8 | Confident | 85.8 | Confident | 163 Ų | 163 | 57 Ų | 57 | 62% | 0.617 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -68.5 | -36.9 | 179 | -167.9 | -105.5 | 0 | 0 | 0 | 112 | F236 G237 F243 A244 | F236-W240 PolarHBondContact O-N 3.35Å; G237-W240 PolarHBondContact O-N 3.37Å; W240-F243 HydrophobicContact CE3-CD1 4.34Å; W240-F243 HydrophobicContact CH2-CD1 4.34Å; W240-F243 HydrophobicContact CH2-CE1 4.33Å; W240-F243 HydrophobicContact CZ3-CD1 4.16Å; W240-F243 HydrophobicContact CZ3-CE1 4.45Å; W240-F243 PolarHBondContact O-N 2.9Å; W240-A244 PolarHBondContact O-N 3.29Å |
| 241 | F | 88.6 | Confident | 86.6 | Confident | 58 Ų | 58 | 61.1 Ų | 61.1 | 25% | 0.254 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -62.5 | -47.8 | 173.9 | -175.9 | -104.9 | 0 | 0 | 0 | 111.9 | C26 A29 L30 M33 G237 V238 S239 F243 A244 I245 | C26-F241 HydrophobicContact CB-CZ 4.41Å; A29-F241 HydrophobicContact CB-CE1 4.18Å; A29-F241 HydrophobicContact CB-CZ 3.71Å; L30-F241 HydrophobicContact CB-CE1 4.16Å; L30-F241 HydrophobicContact CD1-CD1 4.5Å; M33-F241 HydrophobicContact CE-CB 4.21Å; M33-F241 HydrophobicContact CE-CD1 3.13Å; M33-F241 HydrophobicContact CE-CE1 3.43Å; M33-F241 VanDerWaalsContact CE-CE1 3.43Å; M33-F241 HydrophobicContact CE-CG 3.73Å; M33-F241 HydrophobicContact CE-CZ 4.31Å; G237-F241 VanDerWaalsContact O-CB 3.25Å; G237-F241 WeakPolarHBondContact O-CB 3.39Å; G237-F241 PolarHBondContact O-N 3.02Å; V238-F241 PolarHBondContact O-N 2.84Å; S239-F241 VanDerWaalsContact C-N 3.35Å; F241-F243 VanDerWaalsContact C-N 3.34Å; F241-F243 PolarHBondContact O-N 3.05Å; F241-A244 PolarHBondContact O-N 3.25Å; F241-I245 HydrophobicContact CD1-CD1 3.55Å; F241-I245 HydrophobicContact CD1-CG1 4.41Å; F241-I245 HydrophobicContact CE1-CD1 3.22Å; F241-I245 HydrophobicContact CE1-CG1 4.21Å; F241-I245 HydrophobicContact CE2-CD1 4.49Å; F241-I245 HydrophobicContact CG-CD1 4.37Å; F241-I245 HydrophobicContact CZ-CD1 3.73Å; F241-I245 HydrophobicContact CZ-CG1 4.34Å; F241-I245 WeakPolarHBondContact O-CG1 3.5Å; F241-I245 PolarHBondContact O-N 3.01Å |
| 242 | G | 88.6 | Confident | 87.5 | Confident | 2 Ų | 2 | 61.1 Ų | 61.1 | 2% | 0.021 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -58.3 | -44.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | V238 S239 A244 I245 L246 | V238-G242 PolarHBondContact O-N 3.11Å; S239-G242 PolarHBondContact O-N 3.09Å; G242-A244 PolarHBondContact O-N 3.49Å; G242-I245 PolarHBondContact O-N 3.27Å; G242-L246 VanDerWaalsContact O-CG 3.29Å; G242-L246 WeakPolarHBondContact O-CG 3.39Å; G242-L246 PolarHBondContact O-N 3.21Å |
| 243 | F | 90 | Very high | 88.4 | Confident | 106 Ų | 106 | 58.5 Ų | 58.5 | 47% | 0.465 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -57.6 | -45.5 | 174.2 | 177.1 | -103.8 | 0 | 0 | 0 | 112.7 | S239 W240 F241 I245 L246 C247 | S239-F243 PolarHBondContact O-N 2.92Å; W240-F243 HydrophobicContact CE3-CD1 4.34Å; W240-F243 HydrophobicContact CH2-CD1 4.34Å; W240-F243 HydrophobicContact CH2-CE1 4.33Å; W240-F243 HydrophobicContact CZ3-CD1 4.16Å; W240-F243 HydrophobicContact CZ3-CE1 4.45Å; W240-F243 PolarHBondContact O-N 2.9Å; F241-F243 VanDerWaalsContact C-N 3.34Å; F241-F243 PolarHBondContact O-N 3.05Å; F243-I245 PolarHBondContact O-N 3.49Å; F243-L246 WeakPolarHBondContact O-CB 3.35Å; F243-L246 PolarHBondContact O-N 3.1Å; F243-C247 VanDerWaalsContact CZ-SG 3.5Å; F243-C247 PolarHBondContact O-N 3.04Å; F243-C247 PolarHBondContact O-SG 3.36Å |
| 244 | A | 93.1 | Very high | 89.2 | Confident | 49 Ų | 49 | 57.8 Ų | 57.8 | 41% | 0.405 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -62.5 | -41.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | W240 F241 G242 L246 C247 W248 | W240-A244 PolarHBondContact O-N 3.29Å; F241-A244 PolarHBondContact O-N 3.25Å; G242-A244 PolarHBondContact O-N 3.49Å; A244-L246 VanDerWaalsContact C-N 3.32Å; A244-L246 PolarHBondContact O-N 2.95Å; A244-C247 PolarHBondContact O-N 3.43Å; A244-W248 PolarHBondContact O-N 3.19Å |
| 245 | I | 93.7 | Very high | 90.1 | Very high | 5 Ų | 5 | 53.8 Ų | 53.8 | 3% | 0.026 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -60.3 | -44.3 | 174.4 | -66.4 | 169.9 | 0 | 0 | 0 | 110.5 | C26 L70 F241 G242 F243 W248 T249 | C26-I245 HydrophobicContact CB-CD1 3.74Å; C26-I245 HydrophobicContact CB-CG1 3.72Å; L70-I245 HydrophobicContact CD1-CG2 4.31Å; F241-I245 HydrophobicContact CD1-CD1 3.55Å; F241-I245 HydrophobicContact CD1-CG1 4.41Å; F241-I245 HydrophobicContact CE1-CD1 3.22Å; F241-I245 HydrophobicContact CE1-CG1 4.21Å; F241-I245 HydrophobicContact CE2-CD1 4.49Å; F241-I245 HydrophobicContact CG-CD1 4.37Å; F241-I245 HydrophobicContact CZ-CD1 3.73Å; F241-I245 HydrophobicContact CZ-CG1 4.34Å; F241-I245 WeakPolarHBondContact O-CG1 3.5Å; F241-I245 PolarHBondContact O-N 3.01Å; G242-I245 PolarHBondContact O-N 3.27Å; F243-I245 PolarHBondContact O-N 3.49Å; I245-W248 PolarHBondContact O-N 2.85Å; I245-T249 WeakPolarHBondContact O-CB 3.35Å; I245-T249 PolarHBondContact O-N 3.16Å; I245-T249 PolarHBondContact O-OG1 3Å |
| 246 | L | 94.3 | Very high | 91 | Very high | 14 Ų | 14 | 52.9 Ų | 52.9 | 7% | 0.073 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -63.2 | -45.6 | 179.4 | -71.2 | 168.1 | 0 | 0 | 0 | 111.5 | Y100 E103 V104 A107 G242 F243 A244 W248 T249 F250 | Y100-L246 HydrophobicContact CD1-CD2 4.48Å; Y100-L246 HydrophobicContact CD2-CD2 3.61Å; Y100-L246 HydrophobicContact CE1-CD2 4.38Å; Y100-L246 HydrophobicContact CE2-CB 4.09Å; Y100-L246 HydrophobicContact CE2-CD2 3.5Å; Y100-L246 HydrophobicContact CE2-CG 4.44Å; Y100-L246 WeakPolarHBondContact CE2-O 3.33Å; Y100-L246 HydrophobicContact CG-CD2 4.12Å; E103-L246 HydrophobicContact CB-CD2 3.88Å; E103-L246 HydrophobicContact CG-CD1 4.43Å; E103-L246 HydrophobicContact CG-CD2 3.78Å; E103-L246 HydrophobicContact CG-CG 4.01Å; V104-L246 HydrophobicContact CB-CD1 4.47Å; V104-L246 HydrophobicContact CG2-CD1 3.86Å; V104-L246 HydrophobicContact CG2-CD2 3.65Å; V104-L246 HydrophobicContact CG2-CG 4.37Å; A107-L246 HydrophobicContact CB-CD1 4.15Å; G242-L246 VanDerWaalsContact O-CG 3.29Å; G242-L246 WeakPolarHBondContact O-CG 3.39Å; G242-L246 PolarHBondContact O-N 3.21Å; F243-L246 WeakPolarHBondContact O-CB 3.35Å; F243-L246 PolarHBondContact O-N 3.1Å; A244-L246 VanDerWaalsContact C-N 3.32Å; A244-L246 PolarHBondContact O-N 2.95Å; L246-W248 VanDerWaalsContact C-N 3.33Å; L246-W248 PolarHBondContact O-N 3.31Å; L246-T249 PolarHBondContact O-N 3.12Å; L246-F250 VanDerWaalsContact O-CB 3.3Å; L246-F250 WeakPolarHBondContact O-CB 3.46Å; L246-F250 PolarHBondContact O-N 3.16Å |
| 247 | C | 95.6 | Very high | 91.9 | Very high | 51 Ų | 51 | 50.8 Ų | 50.8 | 35% | 0.345 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -58.2 | -46.2 | 175.5 | -71.2 | 0 | 0 | 0 | 0 | 111.7 | F243 A244 F251 | F243-C247 VanDerWaalsContact CZ-SG 3.5Å; F243-C247 PolarHBondContact O-N 3.04Å; F243-C247 PolarHBondContact O-SG 3.36Å; A244-C247 PolarHBondContact O-N 3.43Å; C247-F251 WeakPolarHBondContact O-CD2 3.49Å |
| 248 | W | 96.1 | Very high | 92.6 | Very high | 112 Ų | 112 | 54.3 Ų | 54.3 | 42% | 0.424 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -65.3 | -48.7 | 178.7 | -179.3 | -101.3 | 0 | 0 | 0 | 112.4 | G19 V22 A244 I245 L246 F250 F251 V252 | G19-W248 PolarHBondContact O-NE1 3.5Å; G19-W248 VanDerWaalsContact O-NE1 3.1Å; V22-W248 HydrophobicContact CB-CZ2 4.12Å; V22-W248 HydrophobicContact CG1-CD2 4.49Å; V22-W248 HydrophobicContact CG1-CZ2 4.3Å; V22-W248 HydrophobicContact CG2-CZ2 4.07Å; A244-W248 PolarHBondContact O-N 3.19Å; I245-W248 PolarHBondContact O-N 2.85Å; L246-W248 VanDerWaalsContact C-N 3.33Å; L246-W248 PolarHBondContact O-N 3.31Å; W248-F250 VanDerWaalsContact C-N 3.26Å; W248-F250 PolarHBondContact O-N 3.14Å; W248-F251 PolarHBondContact O-N 3.32Å; W248-F251 VanDerWaalsContact O-N 3.14Å; W248-V252 PolarHBondContact O-N 3.32Å; W248-V252 VanDerWaalsContact O-N 3.14Å |
| 249 | T | 95.8 | Very high | 93.1 | Very high | 2 Ų | 2 | 52.8 Ų | 52.8 | 1% | 0.012 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -60.9 | -37 | -178.9 | -58.3 | 0 | 0 | 0 | 0 | 111.4 | I23 M96 Y100 I245 L246 F251 V252 I253 | I23-T249 HydrophobicContact CD1-CG2 4.17Å; M96-T249 HydrophobicContact CE-CG2 3.87Å; M96-T249 HydrophobicContact CG-CG2 4.3Å; Y100-T249 HydrophobicContact CD2-CG2 3.95Å; I245-T249 WeakPolarHBondContact O-CB 3.35Å; I245-T249 PolarHBondContact O-N 3.16Å; I245-T249 PolarHBondContact O-OG1 3Å; L246-T249 PolarHBondContact O-N 3.12Å; T249-F251 PolarHBondContact O-N 2.81Å; T249-V252 PolarHBondContact O-N 3.11Å; T249-I253 HydrophobicContact CG2-CD1 3.79Å; T249-I253 HydrophobicContact CG2-CG1 4.16Å; T249-I253 WeakPolarHBondContact O-CB 3.44Å; T249-I253 VanDerWaalsContact O-CG1 3.31Å; T249-I253 WeakPolarHBondContact O-CG1 3.07Å; T249-I253 PolarHBondContact O-N 3.14Å |
| 250 | F | 96.3 | Very high | 93.6 | Very high | 96 Ų | 96 | 54.3 Ų | 54.3 | 42% | 0.421 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -56.5 | -48.5 | 174.7 | 176.2 | -101.3 | 0 | 0 | 0 | 112.1 | Y100 L246 W248 V252 I253 L254 | Y100-F250 HydrophobicContact CE2-CB 4.23Å; L246-F250 VanDerWaalsContact O-CB 3.3Å; L246-F250 WeakPolarHBondContact O-CB 3.46Å; L246-F250 PolarHBondContact O-N 3.16Å; W248-F250 VanDerWaalsContact C-N 3.26Å; W248-F250 PolarHBondContact O-N 3.14Å; F250-V252 PolarHBondContact O-N 3Å; F250-I253 PolarHBondContact O-N 3.06Å; F250-L254 HydrophobicContact CD1-CD1 3.97Å; F250-L254 HydrophobicContact CE1-CD1 3.36Å; F250-L254 HydrophobicContact CE1-CG 4.24Å; F250-L254 HydrophobicContact CE2-CD1 4.24Å; F250-L254 HydrophobicContact CE2-CG 4.39Å; F250-L254 HydrophobicContact CZ-CD1 3.53Å; F250-L254 HydrophobicContact CZ-CG 4.15Å; F250-L254 WeakPolarHBondContact O-CG 3.13Å; F250-L254 PolarHBondContact O-N 3.11Å |
| 251 | F | 96.4 | Very high | 93.8 | Very high | 140 Ų | 140 | 50.6 Ų | 50.6 | 61% | 0.614 | 25% | 0.252 | S | S | * | . | H | α-helix | trans | -65.5 | -37.8 | 177.8 | -69.7 | -65.8 | 0 | 0 | 0 | 112.7 | C247 W248 T249 L254 G255 | C247-F251 WeakPolarHBondContact O-CD2 3.49Å; W248-F251 PolarHBondContact O-N 3.32Å; W248-F251 VanDerWaalsContact O-N 3.14Å; T249-F251 PolarHBondContact O-N 2.81Å; F251-L254 PolarHBondContact O-N 2.94Å; F251-G255 PolarHBondContact O-N 2.72Å |
| 252 | V | 96.8 | Very high | 93.8 | Very high | 9 Ų | 9 | 53.4 Ų | 53.4 | 6% | 0.055 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -65.4 | -45.3 | 176.3 | 176.9 | 0 | 0 | 0 | 0 | 111 | I23 W248 T249 F250 L254 G255 V256 | I23-V252 HydrophobicContact CD1-CB 3.88Å; I23-V252 HydrophobicContact CD1-CG1 3.91Å; I23-V252 HydrophobicContact CD1-CG2 3.91Å; W248-V252 PolarHBondContact O-N 3.32Å; W248-V252 VanDerWaalsContact O-N 3.14Å; T249-V252 PolarHBondContact O-N 3.11Å; F250-V252 PolarHBondContact O-N 3Å; V252-L254 PolarHBondContact O-N 3.26Å; V252-G255 PolarHBondContact O-N 3.23Å; V252-V256 HydrophobicContact CG1-CG2 4.48Å; V252-V256 WeakPolarHBondContact O-CG2 3.28Å; V252-V256 PolarHBondContact O-N 2.64Å |
| 253 | I | 95.9 | Very high | 93.6 | Very high | 14 Ų | 14 | 54.7 Ų | 54.7 | 7% | 0.072 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -59.4 | -47.7 | 176.3 | -70.3 | 170.9 | 0 | 0 | 0 | 110.3 | M96 V97 Y100 T249 F250 G255 V256 I257 | M96-I253 HydrophobicContact CB-CD1 4.33Å; M96-I253 HydrophobicContact CB-CG1 4.35Å; M96-I253 HydrophobicContact CG-CD1 3.84Å; M96-I253 HydrophobicContact CG-CG1 3.83Å; V97-I253 HydrophobicContact CG2-CG2 4.39Å; Y100-I253 HydrophobicContact CD2-CD1 4.25Å; Y100-I253 HydrophobicContact CG-CD1 4.45Å; T249-I253 HydrophobicContact CG2-CD1 3.79Å; T249-I253 HydrophobicContact CG2-CG1 4.16Å; T249-I253 WeakPolarHBondContact O-CB 3.44Å; T249-I253 VanDerWaalsContact O-CG1 3.31Å; T249-I253 WeakPolarHBondContact O-CG1 3.07Å; T249-I253 PolarHBondContact O-N 3.14Å; F250-I253 PolarHBondContact O-N 3.06Å; I253-G255 VanDerWaalsContact C-N 3.3Å; I253-G255 PolarHBondContact O-N 3.49Å; I253-V256 PolarHBondContact O-N 2.85Å; I253-I257 HydrophobicContact CG2-CD1 3.69Å; I253-I257 HydrophobicContact CG2-CG1 4.3Å; I253-I257 WeakPolarHBondContact O-CG1 2.99Å; I253-I257 PolarHBondContact O-N 3.47Å |
| 254 | L | 96.4 | Very high | 92.4 | Very high | 81 Ų | 81 | 57 Ų | 57 | 42% | 0.424 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -58.7 | -42.7 | 176.6 | -74.1 | -177.6 | 0 | 0 | 0 | 112 | F250 F251 V252 V256 I257 F258 | F250-L254 HydrophobicContact CD1-CD1 3.97Å; F250-L254 HydrophobicContact CE1-CD1 3.36Å; F250-L254 HydrophobicContact CE1-CG 4.24Å; F250-L254 HydrophobicContact CE2-CD1 4.24Å; F250-L254 HydrophobicContact CE2-CG 4.39Å; F250-L254 HydrophobicContact CZ-CD1 3.53Å; F250-L254 HydrophobicContact CZ-CG 4.15Å; F250-L254 WeakPolarHBondContact O-CG 3.13Å; F250-L254 PolarHBondContact O-N 3.11Å; F251-L254 PolarHBondContact O-N 2.94Å; V252-L254 PolarHBondContact O-N 3.26Å; L254-V256 PolarHBondContact O-N 3.22Å; L254-I257 PolarHBondContact O-N 3.41Å; L254-F258 WeakPolarHBondContact O-CB 3.41Å; L254-F258 PolarHBondContact O-N 3.44Å |
| 255 | G | 95.3 | Very high | 90.8 | Very high | 13 Ų | 13 | 65 Ų | 65 | 13% | 0.134 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -62.5 | -40.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | F12 F251 V252 I253 F258 H259 | F12-G255 WeakPolarHBondContact CZ-O 3.42Å; F251-G255 PolarHBondContact O-N 2.72Å; V252-G255 PolarHBondContact O-N 3.23Å; I253-G255 VanDerWaalsContact C-N 3.3Å; I253-G255 PolarHBondContact O-N 3.49Å; G255-F258 PolarHBondContact O-N 3.31Å; G255-H259 PolarHBondContact O-N 3.1Å |
| 256 | V | 94.6 | Very high | 90.7 | Very high | 0 Ų | 0 | 68 Ų | 68 | 0% | 0 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -72 | -36.8 | 176.6 | 178.7 | 0 | 0 | 0 | 0 | 111.8 | L16 I81 L89 Y92 I93 V252 I253 L254 F258 H259 Y260 | L16-V256 HydrophobicContact CB-CG2 4.48Å; L16-V256 HydrophobicContact CD1-CG2 4.09Å; L16-V256 HydrophobicContact CD2-CG2 4.17Å; L16-V256 HydrophobicContact CG-CG2 4.48Å; I81-V256 HydrophobicContact CD1-CG2 4.25Å; L89-V256 HydrophobicContact CD1-CG1 4.03Å; L89-V256 HydrophobicContact CD2-CG1 4.08Å; L89-V256 HydrophobicContact CG-CG1 3.82Å; Y92-V256 HydrophobicContact CD1-CG1 3.83Å; Y92-V256 HydrophobicContact CE1-CB 4.03Å; Y92-V256 HydrophobicContact CE1-CG1 3.72Å; Y92-V256 HydrophobicContact CE1-CG2 3.85Å; I93-V256 HydrophobicContact CD1-CG1 4.13Å; I93-V256 HydrophobicContact CG1-CG1 3.9Å; V252-V256 HydrophobicContact CG1-CG2 4.48Å; V252-V256 WeakPolarHBondContact O-CG2 3.28Å; V252-V256 PolarHBondContact O-N 2.64Å; I253-V256 PolarHBondContact O-N 2.85Å; L254-V256 PolarHBondContact O-N 3.22Å; V256-F258 VanDerWaalsContact C-N 3.34Å; V256-H259 WeakPolarHBondContact O-CB 3.31Å; V256-H259 PolarHBondContact O-N 2.89Å; V256-Y260 WeakPolarHBondContact O-CB 3.32Å; V256-Y260 PolarHBondContact O-N 3.24Å |
| 257 | I | 95.2 | Very high | 90.5 | Very high | 66 Ų | 66 | 70.8 Ų | 70.8 | 34% | 0.338 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -62.3 | -44.2 | 172.1 | -69.5 | 168.2 | 0 | 0 | 0 | 110.1 | I93 I253 L254 H259 Y260 T261 | I93-I257 HydrophobicContact CD1-CG1 4.02Å; I93-I257 HydrophobicContact CG1-CG1 4.34Å; I93-I257 HydrophobicContact CG2-CD1 4.35Å; I93-I257 HydrophobicContact CG2-CG1 4.05Å; I253-I257 HydrophobicContact CG2-CD1 3.69Å; I253-I257 HydrophobicContact CG2-CG1 4.3Å; I253-I257 WeakPolarHBondContact O-CG1 2.99Å; I253-I257 PolarHBondContact O-N 3.47Å; L254-I257 PolarHBondContact O-N 3.41Å; I257-H259 VanDerWaalsContact C-N 3.35Å; I257-H259 PolarHBondContact O-N 2.03Å; I257-Y260 WeakPolarHBondContact O-CB 3.4Å; I257-Y260 PolarHBondContact O-N 3.26Å; I257-T261 WeakPolarHBondContact O-CG2 3.42Å; I257-T261 PolarHBondContact O-N 2.91Å |
| 258 | F | 93.8 | Very high | 90.2 | Very high | 111 Ų | 111 | 71.9 Ų | 71.9 | 49% | 0.487 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -59 | -47.7 | 174.3 | 178.9 | -100.4 | 0 | 0 | 0 | 110.9 | F12 L254 G255 V256 Y260 T261 Q262 | F12-F258 AromaticContact CE1-CD1 3.74Å; F12-F258 HydrophobicContact CE1-CD1 3.74Å; F12-F258 HydrophobicContact CE1-CE1 4.39Å; F12-F258 AromaticContact CZ-CD1 3.71Å; F12-F258 HydrophobicContact CZ-CD1 3.71Å; F12-F258 HydrophobicContact CZ-CE1 4.46Å; L254-F258 WeakPolarHBondContact O-CB 3.41Å; L254-F258 PolarHBondContact O-N 3.44Å; G255-F258 PolarHBondContact O-N 3.31Å; V256-F258 VanDerWaalsContact C-N 3.34Å; F258-Y260 VanDerWaalsContact C-N 3.29Å; F258-Y260 PolarHBondContact O-N 2.87Å; F258-T261 PolarHBondContact O-N 3.47Å; F258-T261 VanDerWaalsContact O-N 3.14Å; F258-T261 PolarHBondContact O-OG1 2.93Å; F258-Q262 HydrophobicContact CE1-CG 4.18Å; F258-Q262 HydrophobicContact CZ-CG 4.19Å; F258-Q262 WeakPolarHBondContact O-CG 3.29Å; F258-Q262 PolarHBondContact O-N 3.27Å |
| 259 | H | 91.6 | Very high | 89.8 | Confident | 4 Ų | 4 | 69.6 Ų | 69.6 | 2% | 0.019 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -57.1 | -42.8 | 174.8 | -168.9 | 54 | 0 | 0 | 0 | 112.3 | D9 F12 R13 L16 G255 V256 I257 T261 Q262 L263 | D9-H259 IonicContact OD1-CE1 3.62Å; D9-H259 IonicContact OD1-ND1 3.89Å; F12-H259 HydrophobicContact CE1-CB 3.96Å; R13-H259 PolarHBondContact NE-CE1 3.33Å; L16-H259 HydrophobicContact CD1-CB 3.96Å; G255-H259 PolarHBondContact O-N 3.1Å; V256-H259 WeakPolarHBondContact O-CB 3.31Å; V256-H259 PolarHBondContact O-N 2.89Å; I257-H259 VanDerWaalsContact C-N 3.35Å; I257-H259 PolarHBondContact O-N 2.03Å; H259-T261 VanDerWaalsContact C-N 3.31Å; H259-T261 PolarHBondContact O-N 2.82Å; H259-Q262 PolarHBondContact O-N 3Å; H259-Q262 VanDerWaalsContact O-N 3.16Å; H259-L263 PolarHBondContact O-N 3.16Å |
| 260 | Y | 92.3 | Very high | 89.5 | Confident | 44 Ų | 44 | 73.8 Ų | 73.8 | 17% | 0.173 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -58.2 | -40.5 | 177.1 | 176.7 | -91.8 | 0 | 0 | 0 | 112.5 | R86 L89 L90 I93 V256 I257 F258 Q262 L263 | R86-Y260 HydrophobicContact CB-CE2 4.33Å; R86-Y260 HydrophobicContact CG-CD2 3.98Å; R86-Y260 HydrophobicContact CG-CE2 3.22Å; R86-Y260 PolarHBondContact NE-OH 3.13Å; R86-Y260 WeakPolarHBondContact O-CE2 3.14Å; L89-Y260 HydrophobicContact CB-CD2 4.27Å; L89-Y260 HydrophobicContact CD2-CD2 4.21Å; L90-Y260 HydrophobicContact CB-CE2 3.89Å; L90-Y260 HydrophobicContact CD1-CE2 4.38Å; I93-Y260 HydrophobicContact CD1-CD2 4.33Å; I93-Y260 HydrophobicContact CD1-CG 4.2Å; V256-Y260 WeakPolarHBondContact O-CB 3.32Å; V256-Y260 PolarHBondContact O-N 3.24Å; I257-Y260 WeakPolarHBondContact O-CB 3.4Å; I257-Y260 PolarHBondContact O-N 3.26Å; F258-Y260 VanDerWaalsContact C-N 3.29Å; F258-Y260 PolarHBondContact O-N 2.87Å; Y260-Q262 VanDerWaalsContact C-N 3.28Å; Y260-Q262 PolarHBondContact O-N 2.77Å; Y260-L263 PolarHBondContact O-N 2.87Å |
| 261 | T | 90.5 | Very high | 89 | Confident | 86 Ų | 86 | 72.3 Ų | 72.3 | 53% | 0.528 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -70.5 | -22.5 | 179.3 | 61.5 | 0 | 0 | 0 | 0 | 114 | I257 F258 H259 | I257-T261 WeakPolarHBondContact O-CG2 3.42Å; I257-T261 PolarHBondContact O-N 2.91Å; F258-T261 PolarHBondContact O-N 3.47Å; F258-T261 VanDerWaalsContact O-N 3.14Å; F258-T261 PolarHBondContact O-OG1 2.93Å; H259-T261 VanDerWaalsContact C-N 3.31Å; H259-T261 PolarHBondContact O-N 2.82Å |
| 262 | Q | 86.9 | Confident | 88.5 | Confident | 116 Ų | 116 | 67.5 Ų | 67.5 | 54% | 0.542 | 35% | 0.347 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.7 | -8.1 | 178.2 | -60.1 | -63.6 | -39.7 | 0 | 0 | 112.7 | F258 H259 Y260 D264 | F258-Q262 HydrophobicContact CE1-CG 4.18Å; F258-Q262 HydrophobicContact CZ-CG 4.19Å; F258-Q262 WeakPolarHBondContact O-CG 3.29Å; F258-Q262 PolarHBondContact O-N 3.27Å; H259-Q262 PolarHBondContact O-N 3Å; H259-Q262 VanDerWaalsContact O-N 3.16Å; Y260-Q262 VanDerWaalsContact C-N 3.28Å; Y260-Q262 PolarHBondContact O-N 2.77Å; Q262-D264 PolarHBondContact O-N 2.8Å |
| 263 | L | 84.4 | Confident | 87.9 | Confident | 29 Ų | 29 | 72 Ų | 72 | 15% | 0.152 | 37% | 0.37 | C | S | . | . | S | Bend | trans | -77.9 | 111.5 | 173.9 | -67.6 | 169.6 | 0 | 0 | 0 | 109 | L89 H259 Y260 | L89-L263 HydrophobicContact CD2-CD1 3.88Å; H259-L263 PolarHBondContact O-N 3.16Å; Y260-L263 PolarHBondContact O-N 2.87Å |
| 264 | D | 66.6 | Low | 87.2 | Confident | 155 Ų | 155 | 76.8 Ų | 76.8 | 83% | 0.829 | 40% | 0.395 | S | S | * | . | trans | -55.4 | 153.1 | 172.2 | -66.6 | -43 | 0 | 0 | 0 | 111.4 | Q262 | Q262-D264 PolarHBondContact O-N 2.8Š| ||
| 265 | I | 58.6 | Low | 86.3 | Confident | 217 Ų | 217 | 76.5 Ų | 76.5 | 100% | 1.113 | 39% | 0.392 | S | S | * | . | trans | -62.9 | 0 | -179.3 | -61.9 | 173.1 | 0 | 0 | 0 | 110.9 |
Retrieved 265 of 265 residues in 58.9 ms
(Link to these results)